NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
416009 |
2ddy   |
6014 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ddy
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 1242
_Distance_constraint_stats_list.Viol_count 2487
_Distance_constraint_stats_list.Viol_total 14007.327
_Distance_constraint_stats_list.Viol_max 1.091
_Distance_constraint_stats_list.Viol_rms 0.0826
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0180
_Distance_constraint_stats_list.Viol_average_violations_only 0.2253
_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 8 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 9 LYS 14.029 0.965 1 12 "[+ * -**** **. * 2* *.]"
1 10 TRP 10.541 0.580 16 3 "[ * . 1 .+ 2* .]"
1 11 THR 0.939 0.219 15 0 "[ . 1 . 2 .]"
1 12 SER 3.016 0.580 16 1 "[ . 1 .+ 2 .]"
1 13 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 14 VAL 0.878 0.181 17 0 "[ . 1 . 2 .]"
1 15 VAL 6.392 0.499 5 0 "[ . 1 . 2 .]"
1 16 THR 5.019 0.442 17 0 "[ . 1 . 2 .]"
1 17 TYR 6.680 0.442 17 0 "[ . 1 . 2 .]"
1 18 ARG 4.016 0.717 22 1 "[ . 1 . 2 + .]"
1 19 ILE 1.549 0.312 12 0 "[ . 1 . 2 .]"
1 20 VAL 16.277 0.794 18 13 "[-* ** * *1 * ***+ 2* *]"
1 21 SER 15.767 0.794 18 13 "[-* ** * *1 * ***+ 2* *]"
1 22 TYR 2.494 0.307 24 0 "[ . 1 . 2 .]"
1 23 THR 2.082 0.425 14 0 "[ . 1 . 2 .]"
1 24 ARG 1.667 0.305 16 0 "[ . 1 . 2 .]"
1 25 ASP 8.497 0.554 2 2 "[ + - 1 . 2 .]"
1 26 LEU 14.124 0.995 15 5 "[ - . * + * * .]"
1 27 PRO 0.063 0.034 9 0 "[ . 1 . 2 .]"
1 28 HIS 11.850 0.789 3 13 "[ +** * -1 **.*** * **.]"
1 29 ILE 15.297 0.789 3 13 "[ +** * -1 **.*** * **.]"
1 30 THR 1.452 0.508 23 1 "[ . 1 . 2 + .]"
1 31 VAL 4.227 0.947 24 1 "[ . 1 . 2 +.]"
1 32 ASP 2.653 0.231 11 0 "[ . 1 . 2 .]"
1 33 ARG 4.883 0.778 23 1 "[ . 1 . 2 + .]"
1 34 LEU 9.602 0.867 15 5 "[ . * + -2 **.]"
1 35 VAL 0.691 0.236 13 0 "[ . 1 . 2 .]"
1 36 SER 6.879 0.906 20 7 "[ ** * * 1 * . +- .]"
1 37 LYS 6.273 0.906 20 7 "[ ** * * 1 * . +- .]"
1 38 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 39 LEU 8.109 0.508 14 1 "[ . 1 +. 2 .]"
1 40 ASN 15.961 0.722 22 7 "[ *. 1 * -.** 2 + *]"
1 41 MET 8.747 0.722 22 6 "[ *. 1 * .** 2 + -]"
1 42 TRP 24.124 0.894 17 11 "[* . *1 **+ -*****]"
1 43 GLY 5.664 0.535 7 1 "[ . + 1 . 2 .]"
1 44 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 46 ILE 15.248 0.535 7 1 "[ . + 1 . 2 .]"
1 47 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 48 LEU 6.211 0.499 7 0 "[ . 1 . 2 .]"
1 49 HIS 5.435 0.343 5 0 "[ . 1 . 2 .]"
1 50 PHE 8.356 0.575 5 2 "[ + 1 . 2 - .]"
1 51 ARG 3.311 0.355 23 0 "[ . 1 . 2 .]"
1 52 LYS 3.553 0.207 12 0 "[ . 1 . 2 .]"
1 53 VAL 2.023 0.437 2 0 "[ . 1 . 2 .]"
1 54 VAL 0.280 0.202 9 0 "[ . 1 . 2 .]"
1 55 TRP 0.188 0.162 25 0 "[ . 1 . 2 .]"
1 56 GLY 2.068 0.375 15 0 "[ . 1 . 2 .]"
1 57 THR 2.068 0.375 15 0 "[ . 1 . 2 .]"
1 58 ALA 2.187 0.646 22 1 "[ . 1 . 2 + .]"
1 59 ASP 0.433 0.368 5 0 "[ . 1 . 2 .]"
1 60 ILE 0.787 0.216 13 0 "[ . 1 . 2 .]"
1 61 MET 5.084 0.646 22 1 "[ . 1 . 2 + .]"
1 62 ILE 0.707 0.353 20 0 "[ . 1 . 2 .]"
1 63 GLY 1.357 0.484 14 0 "[ . 1 . 2 .]"
1 64 PHE 5.650 0.947 24 2 "[ . 1 -. 2 +.]"
1 65 ALA 4.039 0.388 1 0 "[ . 1 . 2 .]"
1 66 ARG 0.041 0.041 19 0 "[ . 1 . 2 .]"
1 67 GLY 0.041 0.041 19 0 "[ . 1 . 2 .]"
1 68 ALA 3.525 0.943 17 2 "[ . 1 -. + 2 .]"
1 69 HIS 10.814 0.897 3 6 "[ + **** 1 - 2 .]"
1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 71 ASP 26.468 1.091 24 12 "[* * *** -1 *.*** 2 *+.]"
1 72 SER 3.367 0.630 11 1 "[ . 1+ . 2 .]"
1 73 TYR 25.333 1.086 23 13 "[*** . * *1* *.* -** + *]"
1 74 PRO 6.088 0.943 17 3 "[ . 1 *- + 2 .]"
1 75 PHE 27.661 1.091 18 17 "[ * -******* **.**+*2* *.]"
1 76 ASP 10.209 0.753 12 4 "[ -. 1 + * 2 *]"
1 77 GLY 0.722 0.281 15 0 "[ . 1 . 2 .]"
1 78 PRO 1.891 0.327 18 0 "[ . 1 . 2 .]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 80 ASN 1.248 0.300 21 0 "[ . 1 . 2 .]"
1 81 THR 4.740 0.324 6 0 "[ . 1 . 2 .]"
1 82 LEU 13.359 0.624 16 4 "[ . 1 * .+- 2 * .]"
1 83 ALA 15.498 0.519 6 1 "[ .+ 1 . 2 .]"
1 84 HIS 37.105 1.091 18 21 "[*-* ******* **** +*** ***]"
1 85 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 86 PHE 11.327 0.453 18 0 "[ . 1 . 2 .]"
1 87 ALA 1.100 0.336 10 0 "[ . 1 . 2 .]"
1 88 PRO 6.058 0.346 9 0 "[ . 1 . 2 .]"
1 89 GLY 20.226 0.743 11 11 "[ * ** *1+ -** *2 * *.]"
1 92 LEU 7.145 0.453 18 0 "[ . 1 . 2 .]"
1 93 GLY 17.161 0.743 11 10 "[ ** *1+ -** *2 * *.]"
1 94 GLY 9.533 0.401 20 0 "[ . 1 . 2 .]"
1 95 ASP 0.720 0.217 23 0 "[ . 1 . 2 .]"
1 96 ALA 8.450 0.401 20 0 "[ . 1 . 2 .]"
1 97 HIS 19.227 1.091 24 14 "[ - .* **** ****** 2* +.]"
1 98 PHE 19.745 0.969 9 4 "[ .- +1 .* * .]"
1 99 ASP 17.094 0.753 12 3 "[ . 1 + * 2 -]"
1 100 GLU 6.820 0.447 9 0 "[ . 1 . 2 .]"
1 101 ASP 4.091 0.360 18 0 "[ . 1 . 2 .]"
1 102 GLU 12.759 0.624 16 4 "[ . 1 * .+- 2 * .]"
1 103 ARG 1.536 0.433 1 0 "[ . 1 . 2 .]"
1 104 TRP 18.270 0.969 9 5 "[ - +1 *.* * .]"
1 105 THR 6.335 0.451 10 0 "[ . 1 . 2 .]"
1 106 ASP 1.914 0.386 4 0 "[ . 1 . 2 .]"
1 107 GLY 5.379 0.451 10 0 "[ . 1 . 2 .]"
1 110 LEU 8.131 0.746 12 4 "[- . 1 + . 2* * .]"
1 111 GLY 7.030 0.746 12 4 "[- . 1 + . 2* * .]"
1 112 ILE 5.404 0.586 23 1 "[ . 1 . 2 + .]"
1 113 ASN 0.219 0.219 17 0 "[ . 1 . 2 .]"
1 114 PHE 10.984 0.995 15 6 "[ . * * + * -* .]"
1 115 LEU 5.640 0.927 7 2 "[ . + 1 . 2 - .]"
1 116 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 117 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 118 ALA 0.108 0.062 23 0 "[ . 1 . 2 .]"
1 119 THR 3.671 0.317 24 0 "[ . 1 . 2 .]"
1 120 HIS 0.482 0.096 12 0 "[ . 1 . 2 .]"
1 121 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 122 LEU 0.604 0.145 10 0 "[ . 1 . 2 .]"
1 123 GLY 5.823 0.558 17 1 "[ . 1 . + 2 .]"
1 124 HIS 0.334 0.285 11 0 "[ . 1 . 2 .]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 126 LEU 6.299 0.575 5 2 "[ + 1 . 2 - .]"
1 127 GLY 0.690 0.336 10 0 "[ . 1 . 2 .]"
1 128 MET 3.568 0.478 11 0 "[ . 1 . 2 .]"
1 129 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 130 HIS 4.968 0.513 24 2 "[ -. 1 . 2 +.]"
1 131 SER 4.968 0.513 24 2 "[ -. 1 . 2 +.]"
1 132 SER 1.222 0.331 2 0 "[ . 1 . 2 .]"
1 133 ASP 16.117 0.837 16 3 "[ . 1 .+ 2- * .]"
1 135 ASN 15.231 0.837 16 4 "[ - . 1* .+ 2 * .]"
1 136 ALA 12.531 0.829 23 3 "[ * . 1* . 2 + .]"
1 137 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 138 MET 0.093 0.044 16 0 "[ . 1 . 2 .]"
1 139 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 141 THR 1.005 0.079 2 0 "[ . 1 . 2 .]"
1 142 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 143 GLY 6.484 0.597 19 4 "[ . 1 . * +- * .]"
1 144 ASN 16.167 0.789 23 7 "[ * . 1 * . * *- *+ .]"
1 145 GLY 9.683 0.789 23 3 "[ * . 1 - . 2 + .]"
1 146 ASP 3.489 0.451 14 0 "[ . 1 . 2 .]"
1 147 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 148 GLN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 149 ASN 11.925 0.634 3 3 "[- + . 1 . * .]"
1 150 PHE 4.429 0.425 23 0 "[ . 1 . 2 .]"
1 151 LYS 13.015 0.611 14 6 "[ . 1 * +.** * -.]"
1 152 LEU 20.588 0.913 9 9 "[* * . +1 *.** * *-.]"
1 153 SER 10.861 0.825 18 11 "[** ** *- ** + 2** .]"
1 154 GLN 14.228 0.953 25 17 "[********** *- * * ** +]"
1 155 ASP 3.389 0.284 23 0 "[ . 1 . 2 .]"
1 156 ASP 12.312 0.535 13 4 "[ - . * 1 + . * 2 .]"
1 157 ILE 12.518 0.825 18 11 "[** ** *- ** + 2** .]"
1 158 LYS 14.850 0.953 25 17 "[********** *- * * ** +]"
1 159 GLY 1.013 0.354 10 0 "[ . 1 . 2 .]"
1 160 ILE 19.777 0.894 17 12 "[*- . * 1 * **+* 2** **]"
1 161 GLN 5.430 0.549 21 2 "[ - 1 . 2+ .]"
1 162 LYS 0.354 0.354 10 0 "[ . 1 . 2 .]"
1 163 LEU 8.063 0.423 25 0 "[ . 1 . 2 .]"
1 164 TYR 12.304 0.423 25 0 "[ . 1 . 2 .]"
1 165 GLY 3.552 0.419 11 0 "[ . 1 . 2 .]"
1 166 LYS 7.307 0.654 5 2 "[ + 1 . - .]"
1 167 ARG 5.233 0.654 5 2 "[ + 1 . - .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 PRO HA 1 9 LYS H . . 3.700 2.290 2.102 2.819 . 0 0 "[ . 1 . 2 .]" 1
2 1 8 PRO QB 1 9 LYS H . . 4.400 3.127 2.503 4.094 . 0 0 "[ . 1 . 2 .]" 1
3 1 9 LYS H 1 9 LYS HB2 . . 3.200 3.725 3.323 4.165 0.965 1 12 "[+ * -**** **. * 2* *.]" 1
4 1 9 LYS H 1 9 LYS QG . . 4.300 3.967 3.092 4.163 . 0 0 "[ . 1 . 2 .]" 1
5 1 9 LYS H 1 10 TRP H . . 4.300 3.351 2.080 4.172 . 0 0 "[ . 1 . 2 .]" 1
6 1 9 LYS H 1 10 TRP HA . . 4.700 4.646 3.728 5.053 0.353 7 0 "[ . 1 . 2 .]" 1
7 1 9 LYS H 1 88 PRO QB . . 5.300 4.027 3.221 4.818 . 0 0 "[ . 1 . 2 .]" 1
8 1 9 LYS H 1 88 PRO QD . . 5.700 4.318 3.337 5.099 . 0 0 "[ . 1 . 2 .]" 1
9 1 9 LYS H 1 126 LEU QD . . 5.400 4.490 3.809 4.949 . 0 0 "[ . 1 . 2 .]" 1
10 1 9 LYS HA 1 9 LYS HB2 . . 3.100 2.501 2.207 2.995 . 0 0 "[ . 1 . 2 .]" 1
11 1 9 LYS HA 1 10 TRP H . . 4.100 2.335 2.103 3.431 . 0 0 "[ . 1 . 2 .]" 1
12 1 9 LYS HA 1 163 LEU QD . . 5.200 3.585 2.326 4.665 . 0 0 "[ . 1 . 2 .]" 1
13 1 10 TRP H 1 10 TRP HA . . 2.900 2.708 2.214 2.954 0.054 5 0 "[ . 1 . 2 .]" 1
14 1 10 TRP H 1 10 TRP HB2 . . 3.200 2.819 2.427 3.766 0.566 21 2 "[ . 1 .- 2+ .]" 1
15 1 10 TRP H 1 10 TRP HB3 . . 4.000 3.667 3.558 4.159 0.159 21 0 "[ . 1 . 2 .]" 1
16 1 10 TRP H 1 10 TRP HD1 . . 3.400 2.567 2.211 3.726 0.326 21 0 "[ . 1 . 2 .]" 1
17 1 10 TRP H 1 10 TRP HE1 . . 5.100 4.354 3.924 5.288 0.188 21 0 "[ . 1 . 2 .]" 1
18 1 10 TRP H 1 48 LEU MD2 . . 7.000 5.121 3.946 5.831 . 0 0 "[ . 1 . 2 .]" 1
19 1 10 TRP H 1 88 PRO QB . . 5.300 4.006 3.139 4.818 . 0 0 "[ . 1 . 2 .]" 1
20 1 10 TRP H 1 88 PRO QD . . 7.000 6.003 4.682 6.739 . 0 0 "[ . 1 . 2 .]" 1
21 1 10 TRP HA 1 11 THR HA . . 4.700 4.415 4.226 4.919 0.219 15 0 "[ . 1 . 2 .]" 1
22 1 10 TRP HB2 1 12 SER H . . 3.400 3.009 2.625 3.409 0.009 16 0 "[ . 1 . 2 .]" 1
23 1 10 TRP HB2 1 15 VAL MG2 . . 5.400 2.905 2.139 3.942 . 0 0 "[ . 1 . 2 .]" 1
24 1 10 TRP HB3 1 12 SER H . . 3.000 2.897 2.628 3.580 0.580 16 1 "[ . 1 .+ 2 .]" 1
25 1 10 TRP HB3 1 15 VAL MG2 . . 4.900 3.338 2.558 4.742 . 0 0 "[ . 1 . 2 .]" 1
26 1 10 TRP HB3 1 48 LEU MD1 . . 5.500 5.373 4.866 5.917 0.417 16 0 "[ . 1 . 2 .]" 1
27 1 10 TRP HE1 1 15 VAL MG1 . . 5.200 3.232 2.688 4.165 . 0 0 "[ . 1 . 2 .]" 1
28 1 10 TRP HE1 1 60 ILE MD . . 6.300 3.020 2.216 3.874 . 0 0 "[ . 1 . 2 .]" 1
29 1 10 TRP HE1 1 88 PRO HG3 . . 3.900 3.952 3.640 4.246 0.346 9 0 "[ . 1 . 2 .]" 1
30 1 10 TRP HE1 1 126 LEU H . . 5.100 4.369 3.802 4.675 . 0 0 "[ . 1 . 2 .]" 1
31 1 10 TRP HE1 1 126 LEU HA . . 3.500 2.293 2.037 2.576 . 0 0 "[ . 1 . 2 .]" 1
32 1 10 TRP HE1 1 126 LEU QB . . 5.300 4.562 4.296 4.828 . 0 0 "[ . 1 . 2 .]" 1
33 1 10 TRP HE1 1 126 LEU QD . . 4.300 2.955 2.253 3.271 . 0 0 "[ . 1 . 2 .]" 1
34 1 10 TRP HE3 1 89 GLY H . . 3.600 3.437 3.104 4.129 0.529 3 1 "[ + . 1 . 2 .]" 1
35 1 10 TRP HZ3 1 59 ASP QB . . 4.000 3.131 2.719 3.443 . 0 0 "[ . 1 . 2 .]" 1
36 1 10 TRP HZ3 1 89 GLY H . . 4.100 2.608 2.247 2.989 . 0 0 "[ . 1 . 2 .]" 1
37 1 11 THR HA 1 12 SER H . . 5.300 3.377 2.787 3.565 . 0 0 "[ . 1 . 2 .]" 1
38 1 11 THR HA 1 12 SER HA . . 4.900 4.689 4.555 4.847 . 0 0 "[ . 1 . 2 .]" 1
39 1 11 THR HB 1 12 SER HA . . 5.000 4.845 4.575 5.173 0.173 14 0 "[ . 1 . 2 .]" 1
40 1 11 THR MG 1 12 SER H . . 7.000 4.040 3.222 4.400 . 0 0 "[ . 1 . 2 .]" 1
41 1 12 SER H 1 12 SER HB2 . . 3.100 3.113 2.834 3.390 0.290 14 0 "[ . 1 . 2 .]" 1
42 1 12 SER H 1 12 SER HB3 . . 3.100 2.515 2.146 2.874 . 0 0 "[ . 1 . 2 .]" 1
43 1 12 SER H 1 15 VAL MG2 . . 7.000 4.583 3.858 5.711 . 0 0 "[ . 1 . 2 .]" 1
44 1 12 SER HA 1 13 LYS H . . 3.000 2.294 2.181 2.663 . 0 0 "[ . 1 . 2 .]" 1
45 1 12 SER HB2 1 14 VAL H . . 6.000 3.956 3.847 4.121 . 0 0 "[ . 1 . 2 .]" 1
46 1 12 SER HB3 1 14 VAL H . . 4.500 3.085 2.774 3.333 . 0 0 "[ . 1 . 2 .]" 1
47 1 13 LYS H 1 14 VAL H . . 4.300 2.332 1.963 2.593 . 0 0 "[ . 1 . 2 .]" 1
48 1 13 LYS HA 1 14 VAL H . . 3.800 3.316 3.205 3.433 . 0 0 "[ . 1 . 2 .]" 1
49 1 13 LYS HA 1 48 LEU HA . . 4.700 3.729 3.288 4.012 . 0 0 "[ . 1 . 2 .]" 1
50 1 13 LYS HA 1 48 LEU MD2 . . 4.800 3.614 3.165 3.972 . 0 0 "[ . 1 . 2 .]" 1
51 1 13 LYS QB 1 14 VAL H . . 6.100 3.743 3.252 4.044 . 0 0 "[ . 1 . 2 .]" 1
52 1 13 LYS QG 1 14 VAL H . . 5.700 3.553 2.750 4.924 . 0 0 "[ . 1 . 2 .]" 1
53 1 13 LYS QG 1 14 VAL HB . . 6.700 4.273 2.666 6.196 . 0 0 "[ . 1 . 2 .]" 1
54 1 14 VAL H 1 14 VAL HB . . 3.800 3.275 2.719 3.981 0.181 17 0 "[ . 1 . 2 .]" 1
55 1 14 VAL H 1 15 VAL H . . 5.100 4.127 3.910 4.290 . 0 0 "[ . 1 . 2 .]" 1
56 1 14 VAL H 1 15 VAL MG2 . . 7.000 4.213 3.387 5.705 . 0 0 "[ . 1 . 2 .]" 1
57 1 14 VAL HA 1 15 VAL H . . 4.600 2.164 2.084 2.255 . 0 0 "[ . 1 . 2 .]" 1
58 1 14 VAL HA 1 48 LEU HA . . 5.900 4.828 4.170 5.560 . 0 0 "[ . 1 . 2 .]" 1
59 1 14 VAL HA 1 48 LEU MD2 . . 4.400 3.096 2.230 3.932 . 0 0 "[ . 1 . 2 .]" 1
60 1 14 VAL HB 1 15 VAL H . . 4.300 4.095 2.790 4.396 0.096 9 0 "[ . 1 . 2 .]" 1
61 1 14 VAL QG 1 15 VAL H . . 5.300 2.811 2.425 3.686 . 0 0 "[ . 1 . 2 .]" 1
62 1 14 VAL QG 1 16 THR HA . . 7.000 4.430 4.048 5.579 . 0 0 "[ . 1 . 2 .]" 1
63 1 14 VAL QG 1 16 THR MG . . 5.700 3.780 3.278 4.547 . 0 0 "[ . 1 . 2 .]" 1
64 1 14 VAL QG 1 50 PHE H . . 5.000 3.836 3.069 4.826 . 0 0 "[ . 1 . 2 .]" 1
65 1 14 VAL QG 1 50 PHE HA . . 5.500 3.070 2.506 4.418 . 0 0 "[ . 1 . 2 .]" 1
66 1 14 VAL QG 1 51 ARG H . . 5.100 3.533 3.106 4.969 . 0 0 "[ . 1 . 2 .]" 1
67 1 14 VAL QG 1 51 ARG HA . . 6.600 4.458 3.939 5.908 . 0 0 "[ . 1 . 2 .]" 1
68 1 14 VAL QG 1 51 ARG QB . . 6.900 2.585 2.062 3.872 . 0 0 "[ . 1 . 2 .]" 1
69 1 14 VAL QG 1 51 ARG QD . . 5.200 2.616 1.916 4.250 . 0 0 "[ . 1 . 2 .]" 1
70 1 15 VAL H 1 15 VAL HB . . 3.200 2.639 2.237 3.462 0.262 5 0 "[ . 1 . 2 .]" 1
71 1 15 VAL H 1 15 VAL MG2 . . 3.800 2.940 2.114 3.903 0.103 1 0 "[ . 1 . 2 .]" 1
72 1 15 VAL H 1 16 THR H . . 4.500 4.507 4.328 4.588 0.088 22 0 "[ . 1 . 2 .]" 1
73 1 15 VAL H 1 16 THR HA . . 5.500 4.853 4.643 4.972 . 0 0 "[ . 1 . 2 .]" 1
74 1 15 VAL H 1 16 THR MG . . 7.000 5.107 4.720 5.819 . 0 0 "[ . 1 . 2 .]" 1
75 1 15 VAL H 1 49 HIS H . . 4.700 4.070 3.807 4.399 . 0 0 "[ . 1 . 2 .]" 1
76 1 15 VAL H 1 49 HIS HB2 . . 4.670 4.806 4.641 5.013 0.343 5 0 "[ . 1 . 2 .]" 1
77 1 15 VAL H 1 50 PHE HA . . 3.300 2.331 2.221 2.471 . 0 0 "[ . 1 . 2 .]" 1
78 1 15 VAL H 1 50 PHE HB3 . . 4.800 4.153 3.930 4.475 . 0 0 "[ . 1 . 2 .]" 1
79 1 15 VAL H 1 50 PHE QD . . 5.700 3.906 3.454 4.374 . 0 0 "[ . 1 . 2 .]" 1
80 1 15 VAL H 1 50 PHE QE . . 8.000 5.424 5.131 5.728 . 0 0 "[ . 1 . 2 .]" 1
81 1 15 VAL H 1 51 ARG H . . 3.900 3.876 3.734 4.055 0.155 9 0 "[ . 1 . 2 .]" 1
82 1 15 VAL HB 1 48 LEU MD2 . . 5.800 3.036 2.359 4.234 . 0 0 "[ . 1 . 2 .]" 1
83 1 15 VAL HB 1 50 PHE QD . . 7.300 3.121 2.347 4.758 . 0 0 "[ . 1 . 2 .]" 1
84 1 15 VAL HB 1 50 PHE QE . . 6.400 4.606 3.697 5.483 . 0 0 "[ . 1 . 2 .]" 1
85 1 15 VAL MG1 1 16 THR H . . 5.500 2.739 2.148 3.885 . 0 0 "[ . 1 . 2 .]" 1
86 1 15 VAL MG1 1 48 LEU MD2 . . 6.200 3.457 2.102 4.188 . 0 0 "[ . 1 . 2 .]" 1
87 1 15 VAL MG1 1 50 PHE HB2 . . 6.500 5.340 3.828 6.999 0.499 5 0 "[ . 1 . 2 .]" 1
88 1 15 VAL MG1 1 50 PHE QD . . 6.100 3.185 1.882 4.645 . 0 0 "[ . 1 . 2 .]" 1
89 1 15 VAL MG1 1 50 PHE QE . . 8.200 4.345 2.910 5.461 . 0 0 "[ . 1 . 2 .]" 1
90 1 15 VAL MG1 1 59 ASP QB . . 5.800 2.569 1.822 4.137 . 0 0 "[ . 1 . 2 .]" 1
91 1 15 VAL MG1 1 60 ILE H . . 6.100 3.843 3.141 5.044 . 0 0 "[ . 1 . 2 .]" 1
92 1 15 VAL MG1 1 60 ILE MD . . 7.000 2.069 1.809 2.828 . 0 0 "[ . 1 . 2 .]" 1
93 1 15 VAL MG1 1 60 ILE QG . . 5.500 2.643 1.861 3.790 . 0 0 "[ . 1 . 2 .]" 1
94 1 15 VAL MG1 1 60 ILE MG . . 6.700 4.316 3.775 4.961 . 0 0 "[ . 1 . 2 .]" 1
95 1 15 VAL MG1 1 126 LEU QD . . 4.800 3.575 2.633 4.257 . 0 0 "[ . 1 . 2 .]" 1
96 1 15 VAL MG2 1 16 THR H . . 4.400 3.578 1.968 4.438 0.038 5 0 "[ . 1 . 2 .]" 1
97 1 15 VAL MG2 1 48 LEU MD1 . . 6.200 3.495 2.540 5.057 . 0 0 "[ . 1 . 2 .]" 1
98 1 15 VAL MG2 1 50 PHE QD . . 7.200 3.728 2.330 4.463 . 0 0 "[ . 1 . 2 .]" 1
99 1 15 VAL MG2 1 50 PHE QE . . 7.500 4.382 3.271 5.550 . 0 0 "[ . 1 . 2 .]" 1
100 1 16 THR H 1 16 THR HB . . 4.000 3.494 2.811 3.767 . 0 0 "[ . 1 . 2 .]" 1
101 1 16 THR H 1 16 THR MG . . 4.000 2.456 2.118 2.827 . 0 0 "[ . 1 . 2 .]" 1
102 1 16 THR H 1 17 TYR H . . 5.100 4.582 4.514 4.669 . 0 0 "[ . 1 . 2 .]" 1
103 1 16 THR H 1 59 ASP H . . 4.000 3.338 3.119 3.709 . 0 0 "[ . 1 . 2 .]" 1
104 1 16 THR H 1 59 ASP QB . . 5.000 2.549 2.192 3.904 . 0 0 "[ . 1 . 2 .]" 1
105 1 16 THR H 1 60 ILE MD . . 6.300 4.265 3.338 4.907 . 0 0 "[ . 1 . 2 .]" 1
106 1 16 THR HA 1 17 TYR H . . 3.100 2.247 2.158 2.336 . 0 0 "[ . 1 . 2 .]" 1
107 1 16 THR HA 1 17 TYR QD . . 3.600 3.697 3.300 4.042 0.442 17 0 "[ . 1 . 2 .]" 1
108 1 16 THR HA 1 51 ARG H . . 3.100 2.520 2.248 2.784 . 0 0 "[ . 1 . 2 .]" 1
109 1 16 THR HA 1 51 ARG QB . . 5.100 3.327 2.846 3.951 . 0 0 "[ . 1 . 2 .]" 1
110 1 16 THR HA 1 53 VAL MG2 . . 7.000 5.201 4.045 6.034 . 0 0 "[ . 1 . 2 .]" 1
111 1 16 THR HA 1 58 ALA MB . . 7.000 3.969 3.687 4.329 . 0 0 "[ . 1 . 2 .]" 1
112 1 16 THR HB 1 17 TYR H . . 4.300 3.409 2.898 4.170 . 0 0 "[ . 1 . 2 .]" 1
113 1 16 THR HB 1 53 VAL QG . . 8.400 2.508 1.936 3.765 . 0 0 "[ . 1 . 2 .]" 1
114 1 16 THR HB 1 53 VAL MG2 . . 5.900 4.046 1.992 5.974 0.074 14 0 "[ . 1 . 2 .]" 1
115 1 16 THR HB 1 58 ALA MB . . 5.400 3.238 2.319 4.545 . 0 0 "[ . 1 . 2 .]" 1
116 1 16 THR HB 1 59 ASP H . . 5.700 3.993 3.270 5.076 . 0 0 "[ . 1 . 2 .]" 1
117 1 16 THR HB 1 60 ILE H . . 6.000 5.393 4.777 6.216 0.216 13 0 "[ . 1 . 2 .]" 1
118 1 16 THR MG 1 17 TYR H . . 6.900 4.021 3.833 4.272 . 0 0 "[ . 1 . 2 .]" 1
119 1 16 THR MG 1 51 ARG H . . 5.600 4.259 3.554 5.102 . 0 0 "[ . 1 . 2 .]" 1
120 1 16 THR MG 1 51 ARG QB . . 5.400 3.343 2.251 4.192 . 0 0 "[ . 1 . 2 .]" 1
121 1 16 THR MG 1 51 ARG QD . . 8.000 4.790 3.327 5.586 . 0 0 "[ . 1 . 2 .]" 1
122 1 16 THR MG 1 53 VAL MG2 . . 5.400 4.054 2.242 5.188 . 0 0 "[ . 1 . 2 .]" 1
123 1 16 THR MG 1 58 ALA HA . . 5.100 3.690 2.516 4.359 . 0 0 "[ . 1 . 2 .]" 1
124 1 16 THR MG 1 59 ASP H . . 5.400 3.254 1.955 4.287 . 0 0 "[ . 1 . 2 .]" 1
125 1 17 TYR H 1 17 TYR HB3 . . 4.000 3.122 2.970 3.304 . 0 0 "[ . 1 . 2 .]" 1
126 1 17 TYR H 1 17 TYR QE . . 4.800 4.295 4.103 4.518 . 0 0 "[ . 1 . 2 .]" 1
127 1 17 TYR H 1 18 ARG H . . 5.000 4.514 4.445 4.566 . 0 0 "[ . 1 . 2 .]" 1
128 1 17 TYR H 1 18 ARG HA . . 5.000 5.018 4.931 5.089 0.089 23 0 "[ . 1 . 2 .]" 1
129 1 17 TYR H 1 51 ARG H . . 4.300 3.626 3.474 3.803 . 0 0 "[ . 1 . 2 .]" 1
130 1 17 TYR H 1 52 LYS H . . 5.100 4.728 4.513 4.898 . 0 0 "[ . 1 . 2 .]" 1
131 1 17 TYR H 1 52 LYS HA . . 3.300 2.680 2.420 3.006 . 0 0 "[ . 1 . 2 .]" 1
132 1 17 TYR H 1 52 LYS HG3 . . 4.400 4.164 3.728 4.461 0.061 20 0 "[ . 1 . 2 .]" 1
133 1 17 TYR H 1 53 VAL H . . 4.000 3.947 3.630 4.437 0.437 2 0 "[ . 1 . 2 .]" 1
134 1 17 TYR H 1 53 VAL QG . . 6.000 3.646 3.322 4.027 . 0 0 "[ . 1 . 2 .]" 1
135 1 17 TYR H 1 60 ILE HB . . 5.100 4.650 4.290 5.072 . 0 0 "[ . 1 . 2 .]" 1
136 1 17 TYR HA 1 18 ARG H . . 3.800 2.329 2.224 2.420 . 0 0 "[ . 1 . 2 .]" 1
137 1 17 TYR HA 1 58 ALA MB . . 6.200 2.450 2.252 2.632 . 0 0 "[ . 1 . 2 .]" 1
138 1 17 TYR HA 1 59 ASP QB . . 5.500 4.553 4.254 5.868 0.368 5 0 "[ . 1 . 2 .]" 1
139 1 17 TYR HA 1 60 ILE H . . 3.400 2.525 2.336 2.811 . 0 0 "[ . 1 . 2 .]" 1
140 1 17 TYR HA 1 60 ILE MG . . 6.100 3.713 3.393 4.018 . 0 0 "[ . 1 . 2 .]" 1
141 1 17 TYR HB2 1 18 ARG H . . 3.500 2.668 2.500 2.896 . 0 0 "[ . 1 . 2 .]" 1
142 1 17 TYR HB2 1 60 ILE H . . 5.300 4.495 4.131 5.130 . 0 0 "[ . 1 . 2 .]" 1
143 1 17 TYR HB2 1 62 ILE MD . . 6.400 2.536 1.965 2.845 . 0 0 "[ . 1 . 2 .]" 1
144 1 17 TYR HB3 1 18 ARG H . . 4.100 3.941 3.843 4.041 . 0 0 "[ . 1 . 2 .]" 1
145 1 17 TYR HB3 1 39 LEU QD . . 6.100 3.715 2.681 5.130 . 0 0 "[ . 1 . 2 .]" 1
146 1 17 TYR HB3 1 58 ALA MB . . 6.000 4.449 4.241 4.593 . 0 0 "[ . 1 . 2 .]" 1
147 1 17 TYR QD 1 18 ARG H . . 6.200 3.413 2.841 4.032 . 0 0 "[ . 1 . 2 .]" 1
148 1 17 TYR QD 1 19 ILE MD . . 6.300 3.293 2.854 3.804 . 0 0 "[ . 1 . 2 .]" 1
149 1 17 TYR QD 1 35 VAL MG1 . . 8.100 3.564 2.708 4.129 . 0 0 "[ . 1 . 2 .]" 1
150 1 17 TYR QD 1 51 ARG H . . 7.600 3.188 2.786 3.635 . 0 0 "[ . 1 . 2 .]" 1
151 1 17 TYR QD 1 62 ILE MD . . 7.000 2.893 2.042 3.794 . 0 0 "[ . 1 . 2 .]" 1
152 1 17 TYR QE 1 19 ILE MD . . 6.500 2.835 2.115 3.755 . 0 0 "[ . 1 . 2 .]" 1
153 1 17 TYR QE 1 51 ARG H . . 8.000 3.984 3.098 4.928 . 0 0 "[ . 1 . 2 .]" 1
154 1 17 TYR QE 1 52 LYS H . . 7.500 4.549 3.759 5.498 . 0 0 "[ . 1 . 2 .]" 1
155 1 17 TYR HE1 1 35 VAL MG1 . . 7.000 4.434 2.144 5.688 . 0 0 "[ . 1 . 2 .]" 1
156 1 17 TYR HE1 1 39 LEU QD . . 5.800 4.640 3.222 6.097 0.297 23 0 "[ . 1 . 2 .]" 1
157 1 18 ARG H 1 18 ARG HB2 . . 3.300 3.321 2.905 4.017 0.717 22 1 "[ . 1 . 2 + .]" 1
158 1 18 ARG H 1 18 ARG HB3 . . 3.900 3.278 2.971 3.704 . 0 0 "[ . 1 . 2 .]" 1
159 1 18 ARG H 1 19 ILE HA . . 4.600 4.485 4.312 4.714 0.114 5 0 "[ . 1 . 2 .]" 1
160 1 18 ARG H 1 19 ILE QG . . 4.100 4.028 3.775 4.412 0.312 12 0 "[ . 1 . 2 .]" 1
161 1 18 ARG H 1 60 ILE H . . 4.700 4.262 4.094 4.510 . 0 0 "[ . 1 . 2 .]" 1
162 1 18 ARG H 1 61 MET HA . . 3.100 2.648 2.222 3.164 0.064 12 0 "[ . 1 . 2 .]" 1
163 1 18 ARG H 1 62 ILE H . . 3.900 3.439 3.214 3.769 . 0 0 "[ . 1 . 2 .]" 1
164 1 18 ARG HA 1 19 ILE QG . . 4.300 3.555 2.919 3.901 . 0 0 "[ . 1 . 2 .]" 1
165 1 18 ARG HA 1 58 ALA MB . . 6.600 3.841 3.569 4.133 . 0 0 "[ . 1 . 2 .]" 1
166 1 18 ARG HB2 1 53 VAL MG2 . . 4.100 2.617 1.966 4.076 . 0 0 "[ . 1 . 2 .]" 1
167 1 18 ARG HB2 1 58 ALA MB . . 6.100 2.182 1.939 3.892 . 0 0 "[ . 1 . 2 .]" 1
168 1 18 ARG HB3 1 58 ALA MB . . 6.400 2.879 2.371 3.683 . 0 0 "[ . 1 . 2 .]" 1
169 1 19 ILE H 1 19 ILE HA . . 3.000 2.926 2.822 2.961 . 0 0 "[ . 1 . 2 .]" 1
170 1 19 ILE H 1 19 ILE MD . . 5.300 3.475 2.617 4.191 . 0 0 "[ . 1 . 2 .]" 1
171 1 19 ILE H 1 19 ILE QG . . 3.200 2.534 1.981 2.962 . 0 0 "[ . 1 . 2 .]" 1
172 1 19 ILE H 1 20 VAL H . . 5.100 4.116 3.612 4.408 . 0 0 "[ . 1 . 2 .]" 1
173 1 19 ILE H 1 52 LYS HG3 . . 6.000 4.809 4.345 5.635 . 0 0 "[ . 1 . 2 .]" 1
174 1 19 ILE HA 1 20 VAL H . . 2.900 2.212 2.148 2.270 . 0 0 "[ . 1 . 2 .]" 1
175 1 19 ILE HA 1 62 ILE H . . 4.900 2.557 2.188 2.905 . 0 0 "[ . 1 . 2 .]" 1
176 1 19 ILE HA 1 62 ILE HB . . 3.500 2.389 2.204 2.603 . 0 0 "[ . 1 . 2 .]" 1
177 1 19 ILE HA 1 62 ILE MD . . 5.500 3.428 2.928 3.943 . 0 0 "[ . 1 . 2 .]" 1
178 1 19 ILE HA 1 62 ILE MG . . 6.000 3.675 3.317 4.231 . 0 0 "[ . 1 . 2 .]" 1
179 1 19 ILE HB 1 62 ILE MG . . 7.000 5.116 4.650 5.990 . 0 0 "[ . 1 . 2 .]" 1
180 1 19 ILE MD 1 22 TYR QD . . 6.300 3.791 3.234 4.251 . 0 0 "[ . 1 . 2 .]" 1
181 1 19 ILE MD 1 31 VAL QG . . 7.500 2.231 1.983 2.730 . 0 0 "[ . 1 . 2 .]" 1
182 1 19 ILE MD 1 32 ASP HA . . 5.900 2.697 1.958 3.573 . 0 0 "[ . 1 . 2 .]" 1
183 1 19 ILE MD 1 35 VAL MG1 . . 6.600 2.815 2.119 3.378 . 0 0 "[ . 1 . 2 .]" 1
184 1 19 ILE MD 1 35 VAL MG2 . . 6.300 3.209 2.317 3.907 . 0 0 "[ . 1 . 2 .]" 1
185 1 19 ILE MD 1 62 ILE HB . . 6.700 4.004 1.996 4.443 . 0 0 "[ . 1 . 2 .]" 1
186 1 19 ILE MD 1 62 ILE MD . . 6.400 3.149 2.072 3.723 . 0 0 "[ . 1 . 2 .]" 1
187 1 19 ILE QG 1 20 VAL H . . 4.600 4.527 4.340 4.889 0.289 12 0 "[ . 1 . 2 .]" 1
188 1 19 ILE QG 1 35 VAL MG1 . . 6.100 3.670 2.941 4.186 . 0 0 "[ . 1 . 2 .]" 1
189 1 19 ILE QG 1 35 VAL MG2 . . 6.100 3.583 2.653 4.058 . 0 0 "[ . 1 . 2 .]" 1
190 1 19 ILE QG 1 62 ILE MG . . 5.800 3.160 2.663 4.006 . 0 0 "[ . 1 . 2 .]" 1
191 1 19 ILE MG 1 20 VAL H . . 6.000 3.331 2.991 3.639 . 0 0 "[ . 1 . 2 .]" 1
192 1 19 ILE MG 1 21 SER H . . 5.800 3.068 2.762 3.531 . 0 0 "[ . 1 . 2 .]" 1
193 1 19 ILE MG 1 22 TYR QE . . 6.900 2.793 2.440 5.173 . 0 0 "[ . 1 . 2 .]" 1
194 1 19 ILE MG 1 31 VAL QG . . 5.000 2.402 1.967 2.885 . 0 0 "[ . 1 . 2 .]" 1
195 1 19 ILE MG 1 62 ILE HB . . 4.100 2.624 2.229 3.246 . 0 0 "[ . 1 . 2 .]" 1
196 1 19 ILE MG 1 62 ILE MG . . 6.500 2.637 2.163 3.948 . 0 0 "[ . 1 . 2 .]" 1
197 1 20 VAL H 1 20 VAL HB . . 3.470 3.497 2.076 3.764 0.294 9 0 "[ . 1 . 2 .]" 1
198 1 20 VAL H 1 20 VAL MG1 . . 4.200 2.945 2.452 3.875 . 0 0 "[ . 1 . 2 .]" 1
199 1 20 VAL H 1 20 VAL MG2 . . 3.600 2.125 1.911 3.508 . 0 0 "[ . 1 . 2 .]" 1
200 1 20 VAL H 1 21 SER H . . 3.500 2.348 2.109 2.697 . 0 0 "[ . 1 . 2 .]" 1
201 1 20 VAL H 1 21 SER QB . . 5.400 4.672 4.148 5.301 . 0 0 "[ . 1 . 2 .]" 1
202 1 20 VAL H 1 62 ILE H . . 3.500 3.154 2.752 3.853 0.353 20 0 "[ . 1 . 2 .]" 1
203 1 20 VAL H 1 62 ILE HB . . 4.400 4.051 3.912 4.228 . 0 0 "[ . 1 . 2 .]" 1
204 1 20 VAL HB 1 21 SER H . . 3.200 3.622 2.685 3.994 0.794 18 13 "[-* ** * *1 * ***+ 2* *]" 1
205 1 20 VAL MG2 1 21 SER H . . 5.100 2.591 2.050 4.344 . 0 0 "[ . 1 . 2 .]" 1
206 1 20 VAL MG2 1 21 SER QB . . 5.000 3.151 2.290 4.661 . 0 0 "[ . 1 . 2 .]" 1
207 1 21 SER H 1 21 SER QB . . 3.100 2.887 2.605 3.291 0.191 10 0 "[ . 1 . 2 .]" 1
208 1 21 SER H 1 22 TYR H . . 5.300 4.270 4.109 4.388 . 0 0 "[ . 1 . 2 .]" 1
209 1 21 SER H 1 22 TYR HA . . 5.000 4.534 4.304 4.753 . 0 0 "[ . 1 . 2 .]" 1
210 1 21 SER H 1 63 GLY HA2 . . 3.000 2.557 2.253 3.272 0.272 14 0 "[ . 1 . 2 .]" 1
211 1 21 SER H 1 63 GLY HA3 . . 4.600 3.872 3.473 5.013 0.413 14 0 "[ . 1 . 2 .]" 1
212 1 21 SER H 1 64 PHE H . . 4.000 3.866 3.349 4.328 0.328 7 0 "[ . 1 . 2 .]" 1
213 1 21 SER HA 1 22 TYR H . . 3.400 2.545 2.091 2.779 . 0 0 "[ . 1 . 2 .]" 1
214 1 21 SER HA 1 22 TYR QD . . 6.500 3.363 2.486 5.416 . 0 0 "[ . 1 . 2 .]" 1
215 1 21 SER QB 1 22 TYR H . . 3.300 3.079 2.195 3.534 0.234 12 0 "[ . 1 . 2 .]" 1
216 1 21 SER QB 1 63 GLY HA2 . . 4.900 2.883 2.218 4.168 . 0 0 "[ . 1 . 2 .]" 1
217 1 21 SER QB 1 63 GLY HA3 . . 4.900 3.474 2.678 5.384 0.484 14 0 "[ . 1 . 2 .]" 1
218 1 21 SER QB 1 64 PHE H . . 4.700 2.310 1.907 3.767 . 0 0 "[ . 1 . 2 .]" 1
219 1 22 TYR H 1 22 TYR HB2 . . 3.100 2.893 2.706 3.407 0.307 24 0 "[ . 1 . 2 .]" 1
220 1 22 TYR H 1 22 TYR HB3 . . 4.300 3.795 2.347 3.992 . 0 0 "[ . 1 . 2 .]" 1
221 1 22 TYR H 1 64 PHE H . . 5.400 4.265 3.687 5.272 . 0 0 "[ . 1 . 2 .]" 1
222 1 22 TYR H 1 64 PHE QD . . 7.100 3.455 3.044 5.002 . 0 0 "[ . 1 . 2 .]" 1
223 1 22 TYR HA 1 31 VAL QG . . 5.500 3.365 2.357 3.983 . 0 0 "[ . 1 . 2 .]" 1
224 1 22 TYR HA 1 64 PHE H . . 5.100 4.937 4.626 5.329 0.229 9 0 "[ . 1 . 2 .]" 1
225 1 22 TYR HB3 1 31 VAL QG . . 4.900 3.458 2.344 4.672 . 0 0 "[ . 1 . 2 .]" 1
226 1 22 TYR QD 1 31 VAL H . . 7.900 4.847 4.244 5.744 . 0 0 "[ . 1 . 2 .]" 1
227 1 22 TYR QD 1 32 ASP H . . 7.600 4.694 3.465 5.756 . 0 0 "[ . 1 . 2 .]" 1
228 1 22 TYR QE 1 32 ASP H . . 6.600 3.856 2.902 5.476 . 0 0 "[ . 1 . 2 .]" 1
229 1 23 THR HA 1 24 ARG H . . 3.400 2.665 2.450 3.407 0.007 5 0 "[ . 1 . 2 .]" 1
230 1 23 THR HA 1 25 ASP H . . 5.600 4.568 4.217 4.947 . 0 0 "[ . 1 . 2 .]" 1
231 1 23 THR HB 1 24 ARG H . . 4.100 3.645 3.463 4.138 0.038 5 0 "[ . 1 . 2 .]" 1
232 1 23 THR HB 1 26 LEU MD2 . . 6.400 5.442 3.952 6.825 0.425 14 0 "[ . 1 . 2 .]" 1
233 1 23 THR HB 1 104 TRP HD1 . . 4.800 4.101 3.595 4.546 . 0 0 "[ . 1 . 2 .]" 1
234 1 23 THR HB 1 104 TRP HE1 . . 5.400 5.154 4.537 5.556 0.156 17 0 "[ . 1 . 2 .]" 1
235 1 23 THR MG 1 24 ARG H . . 5.500 2.786 2.425 3.392 . 0 0 "[ . 1 . 2 .]" 1
236 1 23 THR MG 1 25 ASP H . . 5.200 3.184 2.574 3.833 . 0 0 "[ . 1 . 2 .]" 1
237 1 23 THR MG 1 25 ASP HB2 . . 6.300 4.228 3.358 4.937 . 0 0 "[ . 1 . 2 .]" 1
238 1 23 THR MG 1 26 LEU H . . 4.800 2.255 1.858 2.837 . 0 0 "[ . 1 . 2 .]" 1
239 1 23 THR MG 1 26 LEU HB2 . . 5.200 3.273 2.024 5.181 . 0 0 "[ . 1 . 2 .]" 1
240 1 23 THR MG 1 26 LEU QB . . 6.100 3.063 2.011 4.276 . 0 0 "[ . 1 . 2 .]" 1
241 1 23 THR MG 1 26 LEU MD1 . . 5.200 2.898 2.146 4.374 . 0 0 "[ . 1 . 2 .]" 1
242 1 23 THR MG 1 26 LEU MD2 . . 6.400 3.260 1.824 4.426 . 0 0 "[ . 1 . 2 .]" 1
243 1 23 THR MG 1 31 VAL QG . . 7.300 2.044 1.858 2.576 . 0 0 "[ . 1 . 2 .]" 1
244 1 23 THR MG 1 64 PHE QE . . 7.800 3.771 2.296 4.472 . 0 0 "[ . 1 . 2 .]" 1
245 1 23 THR MG 1 64 PHE HZ . . 5.900 4.560 3.861 5.105 . 0 0 "[ . 1 . 2 .]" 1
246 1 23 THR MG 1 104 TRP H . . 7.000 5.416 4.908 5.723 . 0 0 "[ . 1 . 2 .]" 1
247 1 23 THR MG 1 104 TRP HD1 . . 7.000 4.319 3.864 4.678 . 0 0 "[ . 1 . 2 .]" 1
248 1 24 ARG H 1 24 ARG HB2 . . 3.300 2.733 2.429 3.098 . 0 0 "[ . 1 . 2 .]" 1
249 1 24 ARG H 1 24 ARG HB3 . . 3.900 3.233 2.565 3.784 . 0 0 "[ . 1 . 2 .]" 1
250 1 24 ARG H 1 25 ASP H . . 5.600 2.107 1.900 3.432 . 0 0 "[ . 1 . 2 .]" 1
251 1 24 ARG H 1 25 ASP HA . . 5.800 4.715 4.490 5.631 . 0 0 "[ . 1 . 2 .]" 1
252 1 24 ARG H 1 26 LEU H . . 3.600 3.541 3.135 3.905 0.305 16 0 "[ . 1 . 2 .]" 1
253 1 24 ARG HB2 1 25 ASP H . . 4.100 3.559 2.510 4.200 0.100 18 0 "[ . 1 . 2 .]" 1
254 1 24 ARG HB3 1 25 ASP H . . 3.800 3.101 2.381 3.981 0.181 24 0 "[ . 1 . 2 .]" 1
255 1 25 ASP H 1 25 ASP HB2 . . 3.200 2.258 2.123 2.543 . 0 0 "[ . 1 . 2 .]" 1
256 1 25 ASP H 1 25 ASP HB3 . . 3.400 3.031 2.586 3.556 0.156 2 0 "[ . 1 . 2 .]" 1
257 1 25 ASP H 1 26 LEU H . . 3.000 2.665 2.285 3.158 0.158 8 0 "[ . 1 . 2 .]" 1
258 1 25 ASP HA 1 26 LEU H . . 4.000 3.468 3.393 3.537 . 0 0 "[ . 1 . 2 .]" 1
259 1 25 ASP HB2 1 26 LEU H . . 4.500 3.685 3.076 4.091 . 0 0 "[ . 1 . 2 .]" 1
260 1 25 ASP HB2 1 104 TRP H . . 2.900 2.994 2.635 3.412 0.512 5 1 "[ + 1 . 2 .]" 1
261 1 25 ASP HB3 1 26 LEU H . . 3.100 3.155 2.575 3.654 0.554 2 1 "[ + . 1 . 2 .]" 1
262 1 25 ASP HB3 1 104 TRP H . . 4.000 3.295 2.686 3.746 . 0 0 "[ . 1 . 2 .]" 1
263 1 25 ASP HB3 1 104 TRP HD1 . . 5.300 4.962 4.183 5.534 0.234 6 0 "[ . 1 . 2 .]" 1
264 1 26 LEU H 1 26 LEU MD1 . . 4.200 3.871 2.453 4.229 0.029 14 0 "[ . 1 . 2 .]" 1
265 1 26 LEU H 1 26 LEU MD2 . . 4.100 3.263 2.026 3.828 . 0 0 "[ . 1 . 2 .]" 1
266 1 26 LEU HA 1 26 LEU MD2 . . 4.400 3.186 2.162 3.985 . 0 0 "[ . 1 . 2 .]" 1
267 1 26 LEU HA 1 30 THR MG . . 7.000 4.300 3.767 4.749 . 0 0 "[ . 1 . 2 .]" 1
268 1 26 LEU QB 1 30 THR MG . . 6.100 2.475 2.098 3.141 . 0 0 "[ . 1 . 2 .]" 1
269 1 26 LEU QB 1 31 VAL QG . . 6.400 3.270 2.419 4.076 . 0 0 "[ . 1 . 2 .]" 1
270 1 26 LEU HB2 1 30 THR MG . . 6.000 3.069 2.132 4.435 . 0 0 "[ . 1 . 2 .]" 1
271 1 26 LEU HB2 1 31 VAL QG . . 5.000 3.412 2.502 4.513 . 0 0 "[ . 1 . 2 .]" 1
272 1 26 LEU MD1 1 30 THR MG . . 5.800 2.705 2.002 3.901 . 0 0 "[ . 1 . 2 .]" 1
273 1 26 LEU MD1 1 31 VAL QG . . 6.600 2.944 1.852 5.135 . 0 0 "[ . 1 . 2 .]" 1
274 1 26 LEU MD1 1 34 LEU MD2 . . 4.900 3.552 2.074 5.767 0.867 15 2 "[ . - + 2 .]" 1
275 1 26 LEU MD1 1 104 TRP QB . . 7.100 3.376 2.201 5.056 . 0 0 "[ . 1 . 2 .]" 1
276 1 26 LEU MD1 1 105 THR H . . 5.500 4.492 3.172 5.591 0.091 15 0 "[ . 1 . 2 .]" 1
277 1 26 LEU MD1 1 105 THR HA . . 5.800 3.614 2.103 4.771 . 0 0 "[ . 1 . 2 .]" 1
278 1 26 LEU MD1 1 106 ASP HB2 . . 6.300 4.087 2.386 5.364 . 0 0 "[ . 1 . 2 .]" 1
279 1 26 LEU MD1 1 114 PHE HB2 . . 4.900 3.316 2.258 5.803 0.903 10 4 "[ . + * - * .]" 1
280 1 26 LEU MD1 1 114 PHE HB3 . . 5.000 3.494 2.414 5.995 0.995 15 3 "[ . 1 + * - .]" 1
281 1 26 LEU MD2 1 27 PRO QD . . 6.700 3.965 3.108 4.526 . 0 0 "[ . 1 . 2 .]" 1
282 1 26 LEU MD2 1 30 THR HB . . 6.700 5.055 3.544 5.534 . 0 0 "[ . 1 . 2 .]" 1
283 1 26 LEU MD2 1 30 THR MG . . 5.400 3.579 2.888 3.952 . 0 0 "[ . 1 . 2 .]" 1
284 1 26 LEU MD2 1 31 VAL HA . . 6.800 5.741 3.583 6.695 . 0 0 "[ . 1 . 2 .]" 1
285 1 26 LEU MD2 1 34 LEU MD2 . . 7.100 4.552 3.616 6.169 . 0 0 "[ . 1 . 2 .]" 1
286 1 26 LEU MD2 1 105 THR HA . . 5.500 2.387 1.911 4.888 . 0 0 "[ . 1 . 2 .]" 1
287 1 26 LEU MD2 1 106 ASP H . . 6.000 2.919 2.131 5.687 . 0 0 "[ . 1 . 2 .]" 1
288 1 26 LEU MD2 1 106 ASP HA . . 6.100 3.826 3.192 5.449 . 0 0 "[ . 1 . 2 .]" 1
289 1 26 LEU MD2 1 106 ASP HB3 . . 6.400 3.507 2.172 5.198 . 0 0 "[ . 1 . 2 .]" 1
290 1 27 PRO HB2 1 30 THR H . . 3.500 3.227 2.944 3.534 0.034 9 0 "[ . 1 . 2 .]" 1
291 1 27 PRO HB3 1 30 THR H . . 5.300 4.729 4.566 4.929 . 0 0 "[ . 1 . 2 .]" 1
292 1 27 PRO QD 1 30 THR MG . . 8.000 2.685 2.336 3.027 . 0 0 "[ . 1 . 2 .]" 1
293 1 27 PRO QG 1 30 THR H . . 5.400 2.906 2.629 3.223 . 0 0 "[ . 1 . 2 .]" 1
294 1 28 HIS HB2 1 29 ILE H . . 3.200 3.177 2.503 3.843 0.643 18 9 "[ *. * 1 **.* + - **.]" 1
295 1 28 HIS HB3 1 29 ILE H . . 4.100 4.045 3.554 4.363 0.263 24 0 "[ . 1 . 2 .]" 1
296 1 28 HIS HD2 1 29 ILE H . . 4.700 4.252 2.866 5.489 0.789 3 4 "[ + * -1 . * 2 .]" 1
297 1 29 ILE H 1 29 ILE HB . . 3.900 2.656 2.419 2.908 . 0 0 "[ . 1 . 2 .]" 1
298 1 29 ILE H 1 29 ILE QG . . 3.900 4.038 3.985 4.157 0.257 7 0 "[ . 1 . 2 .]" 1
299 1 29 ILE H 1 29 ILE MG . . 4.400 2.031 1.910 2.345 . 0 0 "[ . 1 . 2 .]" 1
300 1 29 ILE H 1 30 THR H . . 3.400 2.462 2.253 2.782 . 0 0 "[ . 1 . 2 .]" 1
301 1 29 ILE HA 1 29 ILE QG . . 3.800 2.456 2.285 2.917 . 0 0 "[ . 1 . 2 .]" 1
302 1 29 ILE HA 1 30 THR H . . 3.800 3.509 3.470 3.542 . 0 0 "[ . 1 . 2 .]" 1
303 1 29 ILE HA 1 30 THR HA . . 5.000 4.742 4.716 4.785 . 0 0 "[ . 1 . 2 .]" 1
304 1 29 ILE HA 1 32 ASP H . . 3.900 3.383 3.213 3.520 . 0 0 "[ . 1 . 2 .]" 1
305 1 29 ILE HB 1 30 THR H . . 4.400 4.158 3.880 4.297 . 0 0 "[ . 1 . 2 .]" 1
306 1 29 ILE QG 1 33 ARG QG . . 5.100 3.281 2.488 4.223 . 0 0 "[ . 1 . 2 .]" 1
307 1 29 ILE MG 1 30 THR H . . 5.000 2.524 2.417 2.641 . 0 0 "[ . 1 . 2 .]" 1
308 1 29 ILE MG 1 30 THR HA . . 4.600 3.660 3.437 3.826 . 0 0 "[ . 1 . 2 .]" 1
309 1 30 THR H 1 30 THR HB . . 2.900 2.306 2.203 2.445 . 0 0 "[ . 1 . 2 .]" 1
310 1 30 THR H 1 30 THR MG . . 4.400 3.721 3.631 3.799 . 0 0 "[ . 1 . 2 .]" 1
311 1 30 THR H 1 31 VAL H . . 2.900 2.444 2.363 2.592 . 0 0 "[ . 1 . 2 .]" 1
312 1 30 THR H 1 31 VAL HB . . 4.700 4.385 4.249 4.623 . 0 0 "[ . 1 . 2 .]" 1
313 1 30 THR H 1 32 ASP H . . 4.900 3.947 3.756 4.065 . 0 0 "[ . 1 . 2 .]" 1
314 1 30 THR HA 1 31 VAL H . . 4.500 3.668 3.644 3.691 . 0 0 "[ . 1 . 2 .]" 1
315 1 30 THR HA 1 33 ARG H . . 4.500 3.271 3.107 3.594 . 0 0 "[ . 1 . 2 .]" 1
316 1 30 THR HA 1 33 ARG HB2 . . 3.300 2.338 2.085 3.808 0.508 23 1 "[ . 1 . 2 + .]" 1
317 1 30 THR HB 1 31 VAL H . . 3.500 2.753 2.634 2.896 . 0 0 "[ . 1 . 2 .]" 1
318 1 30 THR MG 1 31 VAL H . . 5.800 3.145 2.810 3.519 . 0 0 "[ . 1 . 2 .]" 1
319 1 30 THR MG 1 34 LEU MD1 . . 6.000 2.403 1.919 4.753 . 0 0 "[ . 1 . 2 .]" 1
320 1 30 THR MG 1 106 ASP HB2 . . 4.000 3.426 2.633 4.386 0.386 4 0 "[ . 1 . 2 .]" 1
321 1 30 THR MG 1 106 ASP HB3 . . 5.200 3.163 2.276 4.667 . 0 0 "[ . 1 . 2 .]" 1
322 1 31 VAL H 1 31 VAL HA . . 3.100 2.741 2.670 2.810 . 0 0 "[ . 1 . 2 .]" 1
323 1 31 VAL H 1 31 VAL HB . . 2.800 2.510 2.284 2.691 . 0 0 "[ . 1 . 2 .]" 1
324 1 31 VAL H 1 31 VAL QG . . 3.600 2.236 2.112 2.663 . 0 0 "[ . 1 . 2 .]" 1
325 1 31 VAL H 1 32 ASP H . . 3.200 3.112 2.880 3.264 0.064 4 0 "[ . 1 . 2 .]" 1
326 1 31 VAL H 1 32 ASP QB . . 4.800 4.892 4.675 5.031 0.231 11 0 "[ . 1 . 2 .]" 1
327 1 31 VAL H 1 33 ARG H . . 4.700 4.402 4.241 4.519 . 0 0 "[ . 1 . 2 .]" 1
328 1 31 VAL HA 1 32 ASP H . . 4.400 3.608 3.582 3.656 . 0 0 "[ . 1 . 2 .]" 1
329 1 31 VAL HA 1 34 LEU QB . . 4.000 2.809 2.478 3.860 . 0 0 "[ . 1 . 2 .]" 1
330 1 31 VAL HA 1 35 VAL H . . 4.400 3.756 3.640 4.030 . 0 0 "[ . 1 . 2 .]" 1
331 1 31 VAL HA 1 114 PHE QE . . 6.800 3.642 2.443 4.908 . 0 0 "[ . 1 . 2 .]" 1
332 1 31 VAL HB 1 32 ASP H . . 3.300 2.697 2.503 3.066 . 0 0 "[ . 1 . 2 .]" 1
333 1 31 VAL QG 1 32 ASP H . . 5.300 3.028 2.723 3.360 . 0 0 "[ . 1 . 2 .]" 1
334 1 31 VAL QG 1 33 ARG H . . 6.400 4.680 4.563 4.873 . 0 0 "[ . 1 . 2 .]" 1
335 1 31 VAL QG 1 35 VAL MG2 . . 7.100 2.946 2.643 3.503 . 0 0 "[ . 1 . 2 .]" 1
336 1 31 VAL QG 1 64 PHE HD1 . . 5.500 4.993 4.377 6.447 0.947 24 1 "[ . 1 . 2 +.]" 1
337 1 31 VAL QG 1 64 PHE QE . . 7.500 3.004 2.519 3.388 . 0 0 "[ . 1 . 2 .]" 1
338 1 31 VAL QG 1 64 PHE HZ . . 5.600 2.770 2.056 3.606 . 0 0 "[ . 1 . 2 .]" 1
339 1 32 ASP H 1 32 ASP HA . . 3.000 2.879 2.815 2.939 . 0 0 "[ . 1 . 2 .]" 1
340 1 32 ASP H 1 32 ASP QB . . 3.000 2.281 2.127 2.393 . 0 0 "[ . 1 . 2 .]" 1
341 1 32 ASP H 1 33 ARG H . . 3.100 2.757 2.619 2.878 . 0 0 "[ . 1 . 2 .]" 1
342 1 32 ASP H 1 34 LEU H . . 4.600 4.199 4.078 4.348 . 0 0 "[ . 1 . 2 .]" 1
343 1 32 ASP HA 1 33 ARG H . . 4.400 3.600 3.553 3.656 . 0 0 "[ . 1 . 2 .]" 1
344 1 32 ASP HA 1 33 ARG HA . . 5.300 4.775 4.719 4.836 . 0 0 "[ . 1 . 2 .]" 1
345 1 32 ASP HA 1 34 LEU H . . 4.900 4.419 4.227 4.603 . 0 0 "[ . 1 . 2 .]" 1
346 1 32 ASP HA 1 35 VAL H . . 3.700 3.490 3.346 3.618 . 0 0 "[ . 1 . 2 .]" 1
347 1 32 ASP HA 1 35 VAL MG1 . . 5.800 3.199 2.735 3.562 . 0 0 "[ . 1 . 2 .]" 1
348 1 32 ASP QB 1 33 ARG H . . 3.100 2.720 2.515 2.875 . 0 0 "[ . 1 . 2 .]" 1
349 1 33 ARG H 1 33 ARG HB2 . . 4.200 2.253 2.144 2.549 . 0 0 "[ . 1 . 2 .]" 1
350 1 33 ARG H 1 33 ARG HB3 . . 3.700 3.466 2.408 3.590 . 0 0 "[ . 1 . 2 .]" 1
351 1 33 ARG H 1 33 ARG QD . . 4.300 3.680 2.543 4.232 . 0 0 "[ . 1 . 2 .]" 1
352 1 33 ARG H 1 33 ARG QG . . 5.000 3.178 2.675 4.061 . 0 0 "[ . 1 . 2 .]" 1
353 1 33 ARG H 1 34 LEU H . . 3.100 2.679 2.466 2.836 . 0 0 "[ . 1 . 2 .]" 1
354 1 33 ARG H 1 34 LEU MD1 . . 7.000 4.893 4.098 6.252 . 0 0 "[ . 1 . 2 .]" 1
355 1 33 ARG H 1 34 LEU MD2 . . 5.400 5.463 4.774 5.856 0.456 15 0 "[ . 1 . 2 .]" 1
356 1 33 ARG H 1 35 VAL H . . 5.800 4.177 4.022 4.376 . 0 0 "[ . 1 . 2 .]" 1
357 1 33 ARG HA 1 34 LEU H . . 4.000 3.561 3.501 3.607 . 0 0 "[ . 1 . 2 .]" 1
358 1 33 ARG HA 1 37 LYS H . . 5.200 4.018 3.827 4.224 . 0 0 "[ . 1 . 2 .]" 1
359 1 33 ARG HB2 1 34 LEU H . . 3.300 2.987 2.761 4.078 0.778 23 1 "[ . 1 . 2 + .]" 1
360 1 33 ARG QG 1 34 LEU H . . 5.200 4.470 4.312 4.629 . 0 0 "[ . 1 . 2 .]" 1
361 1 34 LEU H 1 34 LEU QB . . 3.500 2.273 2.090 2.553 . 0 0 "[ . 1 . 2 .]" 1
362 1 34 LEU H 1 34 LEU MD1 . . 3.600 3.188 2.573 4.200 0.600 24 2 "[ . 1 . -2 +.]" 1
363 1 34 LEU H 1 35 VAL H . . 3.400 2.558 2.435 2.645 . 0 0 "[ . 1 . 2 .]" 1
364 1 34 LEU H 1 35 VAL HB . . 4.900 4.396 4.235 4.509 . 0 0 "[ . 1 . 2 .]" 1
365 1 34 LEU H 1 37 LYS H . . 4.800 4.620 4.480 4.751 . 0 0 "[ . 1 . 2 .]" 1
366 1 34 LEU QB 1 35 VAL H . . 5.100 2.772 2.448 3.620 . 0 0 "[ . 1 . 2 .]" 1
367 1 34 LEU QB 1 115 LEU QD . . 8.000 2.296 1.871 3.352 . 0 0 "[ . 1 . 2 .]" 1
368 1 34 LEU MD1 1 115 LEU QD . . 6.200 2.948 1.918 3.673 . 0 0 "[ . 1 . 2 .]" 1
369 1 34 LEU MD2 1 35 VAL H . . 6.100 4.443 2.105 4.874 . 0 0 "[ . 1 . 2 .]" 1
370 1 34 LEU MD2 1 115 LEU QD . . 6.400 2.779 1.903 4.019 . 0 0 "[ . 1 . 2 .]" 1
371 1 35 VAL H 1 35 VAL HB . . 3.900 2.172 2.084 2.250 . 0 0 "[ . 1 . 2 .]" 1
372 1 35 VAL H 1 35 VAL MG2 . . 4.600 2.858 2.597 3.199 . 0 0 "[ . 1 . 2 .]" 1
373 1 35 VAL H 1 36 SER H . . 3.000 2.933 2.720 3.076 0.076 22 0 "[ . 1 . 2 .]" 1
374 1 35 VAL HA 1 36 SER H . . 4.000 3.624 3.590 3.663 . 0 0 "[ . 1 . 2 .]" 1
375 1 35 VAL HA 1 37 LYS H . . 4.700 4.393 4.224 4.677 . 0 0 "[ . 1 . 2 .]" 1
376 1 35 VAL HA 1 38 ALA H . . 3.900 3.373 3.204 3.640 . 0 0 "[ . 1 . 2 .]" 1
377 1 35 VAL HA 1 38 ALA MB . . 4.300 2.303 2.076 2.663 . 0 0 "[ . 1 . 2 .]" 1
378 1 35 VAL HB 1 36 SER H . . 3.100 2.989 2.741 3.336 0.236 13 0 "[ . 1 . 2 .]" 1
379 1 35 VAL MG1 1 36 SER H . . 5.000 2.627 2.311 2.978 . 0 0 "[ . 1 . 2 .]" 1
380 1 35 VAL MG1 1 39 LEU QD . . 7.800 2.090 1.853 2.212 . 0 0 "[ . 1 . 2 .]" 1
381 1 35 VAL MG1 1 39 LEU HG . . 5.700 3.070 2.504 4.405 . 0 0 "[ . 1 . 2 .]" 1
382 1 35 VAL MG1 1 62 ILE MD . . 7.500 3.018 2.509 3.763 . 0 0 "[ . 1 . 2 .]" 1
383 1 35 VAL MG2 1 36 SER H . . 6.100 4.213 4.106 4.273 . 0 0 "[ . 1 . 2 .]" 1
384 1 35 VAL MG2 1 39 LEU HB2 . . 5.900 5.270 4.936 5.526 . 0 0 "[ . 1 . 2 .]" 1
385 1 35 VAL MG2 1 39 LEU QD . . 6.900 3.420 2.680 3.851 . 0 0 "[ . 1 . 2 .]" 1
386 1 35 VAL MG2 1 39 LEU HG . . 6.700 3.986 3.283 5.626 . 0 0 "[ . 1 . 2 .]" 1
387 1 35 VAL MG2 1 118 ALA MB . . 6.800 2.469 2.007 3.051 . 0 0 "[ . 1 . 2 .]" 1
388 1 36 SER H 1 36 SER HA . . 3.100 2.756 2.691 2.842 . 0 0 "[ . 1 . 2 .]" 1
389 1 36 SER H 1 37 LYS H . . 3.100 3.000 2.772 3.136 0.036 25 0 "[ . 1 . 2 .]" 1
390 1 36 SER H 1 37 LYS QB . . 6.100 5.138 4.645 5.573 . 0 0 "[ . 1 . 2 .]" 1
391 1 36 SER H 1 37 LYS HG3 . . 5.500 5.625 5.090 6.406 0.906 20 7 "[ ** * * 1 * . +- .]" 1
392 1 36 SER H 1 38 ALA H . . 4.700 4.323 4.158 4.481 . 0 0 "[ . 1 . 2 .]" 1
393 1 36 SER H 1 39 LEU H . . 6.000 4.713 4.666 4.778 . 0 0 "[ . 1 . 2 .]" 1
394 1 36 SER H 1 39 LEU QD . . 5.900 4.437 4.018 4.720 . 0 0 "[ . 1 . 2 .]" 1
395 1 36 SER HA 1 37 LYS H . . 3.700 3.583 3.522 3.662 . 0 0 "[ . 1 . 2 .]" 1
396 1 36 SER HA 1 39 LEU H . . 3.800 3.646 3.434 3.846 0.046 12 0 "[ . 1 . 2 .]" 1
397 1 36 SER HA 1 39 LEU QD . . 6.100 3.330 2.914 3.984 . 0 0 "[ . 1 . 2 .]" 1
398 1 36 SER HA 1 40 ASN H . . 5.300 3.748 3.516 3.938 . 0 0 "[ . 1 . 2 .]" 1
399 1 37 LYS H 1 37 LYS QB . . 3.400 2.491 2.222 2.850 . 0 0 "[ . 1 . 2 .]" 1
400 1 37 LYS H 1 37 LYS HG2 . . 4.900 3.223 2.086 4.235 . 0 0 "[ . 1 . 2 .]" 1
401 1 37 LYS H 1 37 LYS HG3 . . 3.500 3.066 2.667 3.558 0.058 20 0 "[ . 1 . 2 .]" 1
402 1 37 LYS H 1 38 ALA H . . 3.200 2.521 2.322 2.651 . 0 0 "[ . 1 . 2 .]" 1
403 1 37 LYS H 1 38 ALA MB . . 7.000 4.162 3.999 4.295 . 0 0 "[ . 1 . 2 .]" 1
404 1 37 LYS H 1 115 LEU QD . . 6.300 4.206 3.717 4.731 . 0 0 "[ . 1 . 2 .]" 1
405 1 37 LYS HA 1 40 ASN H . . 3.500 3.337 3.180 3.549 0.049 6 0 "[ . 1 . 2 .]" 1
406 1 37 LYS QB 1 38 ALA H . . 5.500 3.175 2.661 3.741 . 0 0 "[ . 1 . 2 .]" 1
407 1 37 LYS QB 1 115 LEU QD . . 7.900 3.216 2.344 4.097 . 0 0 "[ . 1 . 2 .]" 1
408 1 37 LYS HG2 1 115 LEU QD . . 7.000 4.062 2.395 5.519 . 0 0 "[ . 1 . 2 .]" 1
409 1 38 ALA H 1 39 LEU H . . 4.200 2.639 2.527 2.805 . 0 0 "[ . 1 . 2 .]" 1
410 1 38 ALA H 1 40 ASN H . . 4.800 3.967 3.742 4.108 . 0 0 "[ . 1 . 2 .]" 1
411 1 38 ALA HA 1 39 LEU H . . 4.900 3.596 3.545 3.621 . 0 0 "[ . 1 . 2 .]" 1
412 1 38 ALA HA 1 39 LEU HA . . 6.000 4.752 4.721 4.788 . 0 0 "[ . 1 . 2 .]" 1
413 1 38 ALA HA 1 41 MET H . . 4.700 3.334 3.114 3.434 . 0 0 "[ . 1 . 2 .]" 1
414 1 38 ALA HA 1 115 LEU QD . . 4.800 3.096 2.413 3.588 . 0 0 "[ . 1 . 2 .]" 1
415 1 38 ALA MB 1 39 LEU H . . 4.300 2.466 2.358 2.608 . 0 0 "[ . 1 . 2 .]" 1
416 1 38 ALA MB 1 115 LEU HA . . 6.900 3.467 2.776 3.990 . 0 0 "[ . 1 . 2 .]" 1
417 1 38 ALA MB 1 115 LEU QD . . 5.400 2.123 1.943 2.985 . 0 0 "[ . 1 . 2 .]" 1
418 1 38 ALA MB 1 118 ALA MB . . 6.500 2.903 2.520 3.317 . 0 0 "[ . 1 . 2 .]" 1
419 1 38 ALA MB 1 119 THR MG . . 7.800 3.385 2.802 3.882 . 0 0 "[ . 1 . 2 .]" 1
420 1 39 LEU H 1 39 LEU HB2 . . 3.600 2.312 2.201 2.365 . 0 0 "[ . 1 . 2 .]" 1
421 1 39 LEU H 1 39 LEU HB3 . . 4.100 3.555 3.474 3.600 . 0 0 "[ . 1 . 2 .]" 1
422 1 39 LEU H 1 39 LEU QD . . 4.300 3.229 2.298 3.416 . 0 0 "[ . 1 . 2 .]" 1
423 1 39 LEU H 1 39 LEU HG . . 4.300 2.876 2.527 4.154 . 0 0 "[ . 1 . 2 .]" 1
424 1 39 LEU H 1 40 ASN H . . 4.100 2.642 2.524 2.803 . 0 0 "[ . 1 . 2 .]" 1
425 1 39 LEU H 1 40 ASN QB . . 4.100 4.395 4.245 4.608 0.508 14 1 "[ . 1 +. 2 .]" 1
426 1 39 LEU H 1 41 MET H . . 4.300 3.986 3.897 4.141 . 0 0 "[ . 1 . 2 .]" 1
427 1 39 LEU HA 1 39 LEU QD . . 3.600 2.140 2.064 2.428 . 0 0 "[ . 1 . 2 .]" 1
428 1 39 LEU HA 1 39 LEU HG . . 4.000 2.918 2.545 3.744 . 0 0 "[ . 1 . 2 .]" 1
429 1 39 LEU HA 1 40 ASN H . . 4.400 3.597 3.568 3.637 . 0 0 "[ . 1 . 2 .]" 1
430 1 39 LEU HA 1 42 TRP H . . 4.500 2.963 2.823 3.064 . 0 0 "[ . 1 . 2 .]" 1
431 1 39 LEU HA 1 42 TRP HD1 . . 4.200 3.457 2.936 3.953 . 0 0 "[ . 1 . 2 .]" 1
432 1 39 LEU HA 1 50 PHE QE . . 7.900 4.340 3.850 4.814 . 0 0 "[ . 1 . 2 .]" 1
433 1 39 LEU HA 1 122 LEU QD . . 7.100 4.151 3.222 5.181 . 0 0 "[ . 1 . 2 .]" 1
434 1 39 LEU HB2 1 40 ASN H . . 3.200 2.808 2.656 2.960 . 0 0 "[ . 1 . 2 .]" 1
435 1 39 LEU HB3 1 40 ASN H . . 4.600 3.505 3.393 3.653 . 0 0 "[ . 1 . 2 .]" 1
436 1 39 LEU QD 1 50 PHE QD . . 6.900 2.905 2.653 3.612 . 0 0 "[ . 1 . 2 .]" 1
437 1 39 LEU QD 1 50 PHE QE . . 7.100 2.825 2.371 3.560 . 0 0 "[ . 1 . 2 .]" 1
438 1 39 LEU QD 1 50 PHE HZ . . 5.900 3.249 2.594 4.074 . 0 0 "[ . 1 . 2 .]" 1
439 1 39 LEU QD 1 60 ILE MD . . 5.500 3.281 2.572 4.064 . 0 0 "[ . 1 . 2 .]" 1
440 1 39 LEU QD 1 62 ILE MD . . 8.000 3.715 3.376 4.341 . 0 0 "[ . 1 . 2 .]" 1
441 1 39 LEU QD 1 62 ILE MG . . 8.000 5.780 5.574 5.939 . 0 0 "[ . 1 . 2 .]" 1
442 1 39 LEU QD 1 122 LEU H . . 5.700 5.014 4.548 5.267 . 0 0 "[ . 1 . 2 .]" 1
443 1 39 LEU QD 1 122 LEU QB . . 5.000 2.370 2.031 2.686 . 0 0 "[ . 1 . 2 .]" 1
444 1 39 LEU QD 1 126 LEU QD . . 4.900 2.820 2.210 3.652 . 0 0 "[ . 1 . 2 .]" 1
445 1 39 LEU HG 1 40 ASN H . . 5.400 4.774 4.627 5.249 . 0 0 "[ . 1 . 2 .]" 1
446 1 39 LEU HG 1 122 LEU QB . . 4.200 3.835 3.422 4.345 0.145 10 0 "[ . 1 . 2 .]" 1
447 1 39 LEU HG 1 122 LEU QD . . 7.000 2.663 1.947 3.749 . 0 0 "[ . 1 . 2 .]" 1
448 1 40 ASN H 1 40 ASN QB . . 3.900 2.244 2.144 2.328 . 0 0 "[ . 1 . 2 .]" 1
449 1 40 ASN H 1 41 MET H . . 4.000 2.848 2.685 3.029 . 0 0 "[ . 1 . 2 .]" 1
450 1 40 ASN H 1 41 MET HB2 . . 4.600 4.936 4.481 5.322 0.722 22 6 "[ *. 1 * .** 2 + -]" 1
451 1 40 ASN H 1 42 TRP H . . 4.700 4.222 3.986 4.357 . 0 0 "[ . 1 . 2 .]" 1
452 1 40 ASN QB 1 41 MET H . . 4.000 2.809 2.464 3.069 . 0 0 "[ . 1 . 2 .]" 1
453 1 41 MET H 1 41 MET HA . . 3.100 2.906 2.818 2.958 . 0 0 "[ . 1 . 2 .]" 1
454 1 41 MET H 1 41 MET HB2 . . 3.400 2.332 2.096 2.523 . 0 0 "[ . 1 . 2 .]" 1
455 1 41 MET H 1 41 MET HB3 . . 4.100 3.561 3.286 3.673 . 0 0 "[ . 1 . 2 .]" 1
456 1 41 MET H 1 41 MET HG2 . . 5.200 4.096 3.602 4.621 . 0 0 "[ . 1 . 2 .]" 1
457 1 41 MET H 1 41 MET HG3 . . 5.100 3.007 2.523 3.939 . 0 0 "[ . 1 . 2 .]" 1
458 1 41 MET H 1 42 TRP H . . 3.200 2.602 2.308 2.914 . 0 0 "[ . 1 . 2 .]" 1
459 1 41 MET H 1 42 TRP QB . . 6.800 4.458 4.165 4.850 . 0 0 "[ . 1 . 2 .]" 1
460 1 41 MET H 1 43 GLY H . . 4.400 4.137 3.884 4.366 . 0 0 "[ . 1 . 2 .]" 1
461 1 41 MET H 1 44 LYS H . . 4.900 4.586 4.411 4.746 . 0 0 "[ . 1 . 2 .]" 1
462 1 41 MET HA 1 42 TRP H . . 5.600 3.563 3.448 3.635 . 0 0 "[ . 1 . 2 .]" 1
463 1 41 MET HA 1 152 LEU MD2 . . 5.700 4.639 4.174 5.331 . 0 0 "[ . 1 . 2 .]" 1
464 1 41 MET HB3 1 42 TRP H . . 3.900 3.659 3.016 4.048 0.148 22 0 "[ . 1 . 2 .]" 1
465 1 41 MET ME 1 119 THR MG . . 6.100 3.416 2.561 4.082 . 0 0 "[ . 1 . 2 .]" 1
466 1 42 TRP H 1 42 TRP QB . . 3.600 2.230 2.144 2.277 . 0 0 "[ . 1 . 2 .]" 1
467 1 42 TRP H 1 42 TRP HD1 . . 3.900 3.182 2.766 3.564 . 0 0 "[ . 1 . 2 .]" 1
468 1 42 TRP H 1 42 TRP HE1 . . 6.000 5.530 5.206 5.976 . 0 0 "[ . 1 . 2 .]" 1
469 1 42 TRP H 1 43 GLY H . . 3.000 2.565 2.125 2.831 . 0 0 "[ . 1 . 2 .]" 1
470 1 42 TRP H 1 43 GLY QA . . 5.800 4.427 4.020 4.682 . 0 0 "[ . 1 . 2 .]" 1
471 1 42 TRP HA 1 160 ILE MG . . 7.000 5.219 4.742 5.686 . 0 0 "[ . 1 . 2 .]" 1
472 1 42 TRP QB 1 43 GLY H . . 4.900 2.616 2.507 2.733 . 0 0 "[ . 1 . 2 .]" 1
473 1 42 TRP QB 1 46 ILE MD . . 7.100 3.475 3.043 4.077 . 0 0 "[ . 1 . 2 .]" 1
474 1 42 TRP HE1 1 119 THR HB . . 4.100 4.241 4.075 4.417 0.317 24 0 "[ . 1 . 2 .]" 1
475 1 42 TRP HE1 1 119 THR MG . . 5.300 2.008 1.753 2.309 . 0 0 "[ . 1 . 2 .]" 1
476 1 42 TRP HE1 1 122 LEU QB . . 6.000 3.926 3.103 4.988 . 0 0 "[ . 1 . 2 .]" 1
477 1 42 TRP HE1 1 123 GLY H . . 3.900 3.249 2.772 3.940 0.040 24 0 "[ . 1 . 2 .]" 1
478 1 42 TRP HE1 1 123 GLY HA2 . . 4.000 3.976 3.706 4.461 0.461 17 0 "[ . 1 . 2 .]" 1
479 1 42 TRP HE1 1 123 GLY HA3 . . 3.700 3.882 3.636 4.258 0.558 17 1 "[ . 1 . + 2 .]" 1
480 1 42 TRP HE1 1 152 LEU HG . . 5.000 5.105 4.623 5.553 0.553 9 3 "[ . +1 . - * .]" 1
481 1 42 TRP HE3 1 126 LEU QD . . 4.700 3.274 2.916 3.611 . 0 0 "[ . 1 . 2 .]" 1
482 1 42 TRP HE3 1 160 ILE MD . . 4.700 2.176 1.987 2.361 . 0 0 "[ . 1 . 2 .]" 1
483 1 42 TRP HZ2 1 152 LEU MD2 . . 5.600 4.479 3.171 5.195 . 0 0 "[ . 1 . 2 .]" 1
484 1 42 TRP HZ3 1 160 ILE H . . 4.200 4.596 3.772 5.094 0.894 17 8 "[- . 1 **+ 2** **]" 1
485 1 43 GLY H 1 44 LYS H . . 3.300 2.734 2.573 2.841 . 0 0 "[ . 1 . 2 .]" 1
486 1 43 GLY H 1 46 ILE HG12 . . 4.900 5.035 4.391 5.435 0.535 7 1 "[ . + 1 . 2 .]" 1
487 1 43 GLY H 1 50 PHE QE . . 6.500 3.670 2.799 4.427 . 0 0 "[ . 1 . 2 .]" 1
488 1 43 GLY QA 1 45 GLU H . . 4.900 3.343 3.203 3.456 . 0 0 "[ . 1 . 2 .]" 1
489 1 43 GLY QA 1 46 ILE H . . 4.100 2.729 2.487 3.070 . 0 0 "[ . 1 . 2 .]" 1
490 1 43 GLY QA 1 46 ILE MD . . 6.000 3.715 3.472 3.932 . 0 0 "[ . 1 . 2 .]" 1
491 1 43 GLY QA 1 50 PHE HE2 . . 5.800 4.594 2.261 6.186 0.386 19 0 "[ . 1 . 2 .]" 1
492 1 44 LYS H 1 45 GLU H . . 3.900 2.763 2.304 3.006 . 0 0 "[ . 1 . 2 .]" 1
493 1 44 LYS HA 1 45 GLU H . . 5.600 3.450 3.318 3.536 . 0 0 "[ . 1 . 2 .]" 1
494 1 44 LYS QB 1 45 GLU H . . 5.100 3.149 2.973 3.405 . 0 0 "[ . 1 . 2 .]" 1
495 1 45 GLU H 1 46 ILE H . . 3.200 2.139 2.068 2.263 . 0 0 "[ . 1 . 2 .]" 1
496 1 45 GLU H 1 46 ILE HG12 . . 4.200 3.769 3.551 3.963 . 0 0 "[ . 1 . 2 .]" 1
497 1 45 GLU HA 1 46 ILE H . . 3.900 3.496 3.382 3.588 . 0 0 "[ . 1 . 2 .]" 1
498 1 45 GLU QB 1 152 LEU MD2 . . 8.000 3.810 3.108 4.776 . 0 0 "[ . 1 . 2 .]" 1
499 1 45 GLU QB 1 157 ILE MG . . 8.000 5.108 3.989 5.714 . 0 0 "[ . 1 . 2 .]" 1
500 1 45 GLU QB 1 161 GLN H . . 5.700 5.308 4.732 5.623 . 0 0 "[ . 1 . 2 .]" 1
501 1 46 ILE H 1 46 ILE MD . . 4.600 4.161 3.962 4.349 . 0 0 "[ . 1 . 2 .]" 1
502 1 46 ILE H 1 46 ILE HG12 . . 3.000 2.669 2.355 2.963 . 0 0 "[ . 1 . 2 .]" 1
503 1 46 ILE H 1 46 ILE HG13 . . 3.200 2.901 2.592 3.318 0.118 5 0 "[ . 1 . 2 .]" 1
504 1 46 ILE H 1 48 LEU H . . 4.400 4.256 4.025 4.427 0.027 23 0 "[ . 1 . 2 .]" 1
505 1 46 ILE HA 1 48 LEU H . . 5.300 4.329 4.071 4.595 . 0 0 "[ . 1 . 2 .]" 1
506 1 46 ILE HA 1 164 TYR QB . . 4.200 4.380 3.711 4.596 0.396 2 0 "[ . 1 . 2 .]" 1
507 1 46 ILE HB 1 48 LEU HB3 . . 4.200 4.021 3.667 4.413 0.213 18 0 "[ . 1 . 2 .]" 1
508 1 46 ILE MD 1 48 LEU H . . 6.100 3.851 3.369 4.218 . 0 0 "[ . 1 . 2 .]" 1
509 1 46 ILE MD 1 48 LEU QB . . 6.800 2.222 1.993 2.533 . 0 0 "[ . 1 . 2 .]" 1
510 1 46 ILE MD 1 48 LEU MD1 . . 7.100 2.206 1.996 2.461 . 0 0 "[ . 1 . 2 .]" 1
511 1 46 ILE MD 1 48 LEU QD . . 9.000 2.188 1.988 2.417 . 0 0 "[ . 1 . 2 .]" 1
512 1 46 ILE MD 1 50 PHE HZ . . 5.800 4.137 3.577 4.487 . 0 0 "[ . 1 . 2 .]" 1
513 1 46 ILE MD 1 126 LEU QD . . 5.700 2.316 1.898 2.760 . 0 0 "[ . 1 . 2 .]" 1
514 1 46 ILE MD 1 160 ILE MD . . 7.100 2.057 1.932 2.371 . 0 0 "[ . 1 . 2 .]" 1
515 1 46 ILE MD 1 160 ILE MG . . 7.200 3.692 3.388 4.009 . 0 0 "[ . 1 . 2 .]" 1
516 1 46 ILE MD 1 164 TYR QB . . 5.500 4.241 3.324 4.766 . 0 0 "[ . 1 . 2 .]" 1
517 1 46 ILE MD 1 164 TYR QD . . 5.900 3.628 2.909 4.094 . 0 0 "[ . 1 . 2 .]" 1
518 1 46 ILE MD 1 164 TYR QE . . 7.500 3.496 2.104 5.457 . 0 0 "[ . 1 . 2 .]" 1
519 1 46 ILE HG12 1 48 LEU H . . 4.500 4.555 4.038 4.999 0.499 7 0 "[ . 1 . 2 .]" 1
520 1 46 ILE HG13 1 48 LEU H . . 3.600 2.919 2.366 3.343 . 0 0 "[ . 1 . 2 .]" 1
521 1 46 ILE HG13 1 48 LEU MD1 . . 5.100 3.993 3.641 4.504 . 0 0 "[ . 1 . 2 .]" 1
522 1 46 ILE MG 1 47 PRO QD . . 6.000 2.936 2.559 3.349 . 0 0 "[ . 1 . 2 .]" 1
523 1 46 ILE MG 1 160 ILE MD . . 7.600 2.070 1.889 2.260 . 0 0 "[ . 1 . 2 .]" 1
524 1 46 ILE MG 1 160 ILE MG . . 6.900 1.999 1.831 2.424 . 0 0 "[ . 1 . 2 .]" 1
525 1 46 ILE MG 1 161 GLN HA . . 6.000 4.676 4.313 5.034 . 0 0 "[ . 1 . 2 .]" 1
526 1 46 ILE MG 1 164 TYR QB . . 3.900 2.374 2.087 2.633 . 0 0 "[ . 1 . 2 .]" 1
527 1 47 PRO QB 1 48 LEU H . . 5.000 4.083 4.039 4.127 . 0 0 "[ . 1 . 2 .]" 1
528 1 48 LEU H 1 48 LEU QB . . 3.600 2.383 2.275 2.514 . 0 0 "[ . 1 . 2 .]" 1
529 1 48 LEU H 1 49 HIS H . . 5.700 4.458 4.319 4.554 . 0 0 "[ . 1 . 2 .]" 1
530 1 48 LEU H 1 49 HIS HE1 . . 5.100 4.957 4.590 5.218 0.118 10 0 "[ . 1 . 2 .]" 1
531 1 48 LEU HA 1 48 LEU HB2 . . 2.900 2.672 2.570 2.742 . 0 0 "[ . 1 . 2 .]" 1
532 1 48 LEU HA 1 48 LEU MD2 . . 3.800 2.961 2.337 3.374 . 0 0 "[ . 1 . 2 .]" 1
533 1 48 LEU HA 1 48 LEU HG . . 4.500 2.351 2.154 2.528 . 0 0 "[ . 1 . 2 .]" 1
534 1 48 LEU HA 1 49 HIS H . . 3.600 2.303 2.176 2.436 . 0 0 "[ . 1 . 2 .]" 1
535 1 48 LEU QB 1 49 HIS H . . 4.300 3.559 3.432 3.669 . 0 0 "[ . 1 . 2 .]" 1
536 1 48 LEU HB3 1 50 PHE HZ . . 5.200 3.579 3.060 4.675 . 0 0 "[ . 1 . 2 .]" 1
537 1 48 LEU MD1 1 49 HIS H . . 6.800 4.398 3.984 4.659 . 0 0 "[ . 1 . 2 .]" 1
538 1 48 LEU MD1 1 50 PHE QE . . 8.100 3.882 2.628 4.977 . 0 0 "[ . 1 . 2 .]" 1
539 1 48 LEU MD1 1 126 LEU HG . . 4.300 3.730 3.513 4.123 . 0 0 "[ . 1 . 2 .]" 1
540 1 48 LEU MD1 1 164 TYR QD . . 8.000 5.132 3.743 5.880 . 0 0 "[ . 1 . 2 .]" 1
541 1 48 LEU MD2 1 49 HIS H . . 5.200 2.095 1.865 2.372 . 0 0 "[ . 1 . 2 .]" 1
542 1 48 LEU MD2 1 126 LEU HA . . 7.000 4.920 4.210 5.602 . 0 0 "[ . 1 . 2 .]" 1
543 1 49 HIS H 1 49 HIS HB2 . . 3.100 2.685 2.542 2.847 . 0 0 "[ . 1 . 2 .]" 1
544 1 49 HIS H 1 50 PHE H . . 5.100 4.472 4.379 4.545 . 0 0 "[ . 1 . 2 .]" 1
545 1 49 HIS HA 1 50 PHE H . . 3.600 2.471 2.391 2.599 . 0 0 "[ . 1 . 2 .]" 1
546 1 49 HIS HD2 1 50 PHE H . . 4.600 4.564 4.162 4.895 0.295 10 0 "[ . 1 . 2 .]" 1
547 1 50 PHE H 1 50 PHE HB2 . . 3.800 3.011 2.921 3.093 . 0 0 "[ . 1 . 2 .]" 1
548 1 50 PHE H 1 50 PHE HB3 . . 3.900 3.859 3.793 3.914 0.014 13 0 "[ . 1 . 2 .]" 1
549 1 50 PHE H 1 50 PHE QD . . 5.700 2.600 2.315 3.128 . 0 0 "[ . 1 . 2 .]" 1
550 1 50 PHE H 1 50 PHE QE . . 4.700 4.283 4.065 4.449 . 0 0 "[ . 1 . 2 .]" 1
551 1 50 PHE H 1 51 ARG QB . . 6.300 5.230 4.812 5.643 . 0 0 "[ . 1 . 2 .]" 1
552 1 50 PHE HA 1 51 ARG H . . 3.900 2.310 2.251 2.412 . 0 0 "[ . 1 . 2 .]" 1
553 1 50 PHE HA 1 51 ARG QB . . 6.300 3.907 3.725 4.208 . 0 0 "[ . 1 . 2 .]" 1
554 1 50 PHE HB2 1 51 ARG H . . 3.400 3.484 3.161 3.755 0.355 23 0 "[ . 1 . 2 .]" 1
555 1 50 PHE HB3 1 51 ARG H . . 4.100 2.877 2.496 3.148 . 0 0 "[ . 1 . 2 .]" 1
556 1 50 PHE QD 1 51 ARG H . . 6.500 4.590 4.353 4.765 . 0 0 "[ . 1 . 2 .]" 1
557 1 50 PHE QD 1 60 ILE MD . . 5.000 3.376 2.410 4.210 . 0 0 "[ . 1 . 2 .]" 1
558 1 50 PHE QD 1 126 LEU QD . . 7.900 3.642 3.181 4.117 . 0 0 "[ . 1 . 2 .]" 1
559 1 50 PHE QE 1 126 LEU QD . . 6.200 2.173 1.912 2.480 . 0 0 "[ . 1 . 2 .]" 1
560 1 50 PHE HE1 1 126 LEU QD . . 4.900 3.966 2.012 5.475 0.575 5 2 "[ + 1 . 2 - .]" 1
561 1 51 ARG H 1 51 ARG QD . . 5.100 4.372 3.511 4.879 . 0 0 "[ . 1 . 2 .]" 1
562 1 51 ARG H 1 52 LYS H . . 5.000 4.435 4.366 4.490 . 0 0 "[ . 1 . 2 .]" 1
563 1 51 ARG HA 1 52 LYS H . . 3.700 2.542 2.299 2.742 . 0 0 "[ . 1 . 2 .]" 1
564 1 51 ARG QB 1 58 ALA MB . . 8.000 5.861 5.343 6.223 . 0 0 "[ . 1 . 2 .]" 1
565 1 51 ARG QD 1 52 LYS H . . 7.000 4.095 2.347 4.992 . 0 0 "[ . 1 . 2 .]" 1
566 1 52 LYS H 1 52 LYS HA . . 3.100 2.959 2.919 2.979 . 0 0 "[ . 1 . 2 .]" 1
567 1 52 LYS H 1 52 LYS QD . . 6.200 4.846 4.576 5.230 . 0 0 "[ . 1 . 2 .]" 1
568 1 52 LYS H 1 52 LYS HG2 . . 4.600 4.631 4.542 4.736 0.136 10 0 "[ . 1 . 2 .]" 1
569 1 52 LYS H 1 52 LYS HG3 . . 4.500 4.589 4.482 4.707 0.207 12 0 "[ . 1 . 2 .]" 1
570 1 52 LYS H 1 53 VAL H . . 5.600 4.308 4.093 4.418 . 0 0 "[ . 1 . 2 .]" 1
571 1 52 LYS H 1 53 VAL QG . . 8.100 4.509 3.981 5.076 . 0 0 "[ . 1 . 2 .]" 1
572 1 52 LYS HA 1 52 LYS HB2 . . 2.900 2.661 2.513 2.835 . 0 0 "[ . 1 . 2 .]" 1
573 1 52 LYS HA 1 53 VAL H . . 2.600 2.222 2.088 2.412 . 0 0 "[ . 1 . 2 .]" 1
574 1 52 LYS QD 1 53 VAL H . . 6.700 4.617 3.589 5.312 . 0 0 "[ . 1 . 2 .]" 1
575 1 52 LYS HG2 1 53 VAL H . . 3.500 2.746 2.026 3.594 0.094 13 0 "[ . 1 . 2 .]" 1
576 1 52 LYS HG3 1 53 VAL H . . 4.400 3.260 2.205 4.097 . 0 0 "[ . 1 . 2 .]" 1
577 1 53 VAL H 1 54 VAL H . . 5.600 4.481 2.861 4.673 . 0 0 "[ . 1 . 2 .]" 1
578 1 53 VAL HA 1 54 VAL H . . 3.200 2.426 2.219 3.402 0.202 9 0 "[ . 1 . 2 .]" 1
579 1 53 VAL HA 1 54 VAL MG1 . . 7.000 3.746 3.195 5.525 . 0 0 "[ . 1 . 2 .]" 1
580 1 53 VAL HA 1 54 VAL MG2 . . 6.300 3.746 3.370 4.417 . 0 0 "[ . 1 . 2 .]" 1
581 1 53 VAL HA 1 55 TRP H . . 5.000 4.356 3.871 4.792 . 0 0 "[ . 1 . 2 .]" 1
582 1 53 VAL HB 1 54 VAL H . . 3.200 2.543 2.183 3.278 0.078 9 0 "[ . 1 . 2 .]" 1
583 1 53 VAL HB 1 54 VAL MG2 . . 7.000 4.214 3.337 5.656 . 0 0 "[ . 1 . 2 .]" 1
584 1 53 VAL HB 1 55 TRP H . . 3.400 3.058 2.468 3.562 0.162 25 0 "[ . 1 . 2 .]" 1
585 1 53 VAL QG 1 58 ALA H . . 8.400 4.020 3.316 4.528 . 0 0 "[ . 1 . 2 .]" 1
586 1 53 VAL QG 1 58 ALA HA . . 6.200 2.790 2.399 3.235 . 0 0 "[ . 1 . 2 .]" 1
587 1 53 VAL QG 1 58 ALA MB . . 7.100 2.055 1.857 2.422 . 0 0 "[ . 1 . 2 .]" 1
588 1 54 VAL H 1 54 VAL MG1 . . 3.900 2.869 2.090 3.613 . 0 0 "[ . 1 . 2 .]" 1
589 1 54 VAL H 1 54 VAL MG2 . . 3.600 2.273 2.043 3.113 . 0 0 "[ . 1 . 2 .]" 1
590 1 54 VAL H 1 55 TRP H . . 3.300 2.462 2.113 3.139 . 0 0 "[ . 1 . 2 .]" 1
591 1 54 VAL HA 1 54 VAL MG1 . . 3.700 2.408 2.221 2.937 . 0 0 "[ . 1 . 2 .]" 1
592 1 54 VAL HA 1 55 TRP H . . 4.600 3.319 2.769 3.639 . 0 0 "[ . 1 . 2 .]" 1
593 1 54 VAL HB 1 55 TRP H . . 4.900 3.929 3.019 4.584 . 0 0 "[ . 1 . 2 .]" 1
594 1 54 VAL MG1 1 55 TRP H . . 6.000 4.059 2.979 4.445 . 0 0 "[ . 1 . 2 .]" 1
595 1 54 VAL MG2 1 55 TRP H . . 5.400 3.031 1.892 4.352 . 0 0 "[ . 1 . 2 .]" 1
596 1 55 TRP QB 1 56 GLY H . . 4.800 2.896 2.063 4.121 . 0 0 "[ . 1 . 2 .]" 1
597 1 56 GLY H 1 57 THR H . . 4.100 3.612 1.980 4.475 0.375 15 0 "[ . 1 . 2 .]" 1
598 1 56 GLY HA3 1 57 THR H . . 4.400 2.733 2.195 3.617 . 0 0 "[ . 1 . 2 .]" 1
599 1 57 THR H 1 57 THR HB . . 4.200 3.152 2.420 3.823 . 0 0 "[ . 1 . 2 .]" 1
600 1 57 THR HA 1 58 ALA H . . 3.700 2.401 2.164 2.731 . 0 0 "[ . 1 . 2 .]" 1
601 1 57 THR HA 1 58 ALA MB . . 6.400 3.807 3.598 4.182 . 0 0 "[ . 1 . 2 .]" 1
602 1 57 THR HA 1 61 MET QG . . 5.800 4.345 2.355 4.993 . 0 0 "[ . 1 . 2 .]" 1
603 1 57 THR HB 1 58 ALA H . . 4.400 3.645 2.314 4.326 . 0 0 "[ . 1 . 2 .]" 1
604 1 57 THR MG 1 58 ALA H . . 5.400 3.107 1.928 4.226 . 0 0 "[ . 1 . 2 .]" 1
605 1 58 ALA H 1 61 MET QB . . 3.200 3.144 2.139 3.846 0.646 22 1 "[ . 1 . 2 + .]" 1
606 1 58 ALA H 1 61 MET QG . . 5.100 4.236 2.992 4.927 . 0 0 "[ . 1 . 2 .]" 1
607 1 58 ALA HA 1 59 ASP H . . 3.100 2.552 2.305 2.899 . 0 0 "[ . 1 . 2 .]" 1
608 1 58 ALA HA 1 60 ILE H . . 4.900 4.567 4.264 4.780 . 0 0 "[ . 1 . 2 .]" 1
609 1 58 ALA MB 1 59 ASP H . . 4.000 2.230 2.024 2.689 . 0 0 "[ . 1 . 2 .]" 1
610 1 59 ASP H 1 59 ASP QB . . 2.800 2.524 2.360 2.864 0.064 5 0 "[ . 1 . 2 .]" 1
611 1 59 ASP H 1 60 ILE H . . 3.000 2.543 2.181 2.828 . 0 0 "[ . 1 . 2 .]" 1
612 1 59 ASP H 1 60 ILE MD . . 5.900 5.029 4.229 5.441 . 0 0 "[ . 1 . 2 .]" 1
613 1 59 ASP H 1 60 ILE QG . . 7.000 4.519 3.852 5.288 . 0 0 "[ . 1 . 2 .]" 1
614 1 60 ILE H 1 60 ILE HB . . 4.000 2.517 2.344 2.751 . 0 0 "[ . 1 . 2 .]" 1
615 1 60 ILE H 1 60 ILE MD . . 4.200 3.448 2.806 3.709 . 0 0 "[ . 1 . 2 .]" 1
616 1 60 ILE H 1 60 ILE QG . . 4.700 2.663 2.206 3.263 . 0 0 "[ . 1 . 2 .]" 1
617 1 60 ILE H 1 61 MET H . . 4.900 3.863 3.558 4.156 . 0 0 "[ . 1 . 2 .]" 1
618 1 60 ILE HA 1 60 ILE QG . . 3.800 2.665 2.252 3.256 . 0 0 "[ . 1 . 2 .]" 1
619 1 60 ILE MD 1 122 LEU QB . . 7.000 4.729 4.111 5.206 . 0 0 "[ . 1 . 2 .]" 1
620 1 60 ILE MD 1 122 LEU QD . . 7.900 3.239 2.057 4.319 . 0 0 "[ . 1 . 2 .]" 1
621 1 60 ILE MG 1 62 ILE MD . . 5.800 2.266 2.008 3.095 . 0 0 "[ . 1 . 2 .]" 1
622 1 60 ILE MG 1 96 ALA H . . 5.900 4.117 3.726 4.421 . 0 0 "[ . 1 . 2 .]" 1
623 1 60 ILE MG 1 96 ALA MB . . 5.700 3.617 3.368 3.984 . 0 0 "[ . 1 . 2 .]" 1
624 1 61 MET H 1 61 MET QB . . 3.000 2.384 2.279 2.800 . 0 0 "[ . 1 . 2 .]" 1
625 1 61 MET H 1 61 MET QG . . 4.600 3.868 2.333 4.151 . 0 0 "[ . 1 . 2 .]" 1
626 1 61 MET H 1 62 ILE H . . 5.100 4.431 4.123 4.576 . 0 0 "[ . 1 . 2 .]" 1
627 1 61 MET H 1 94 GLY HA3 . . 5.600 5.072 4.871 5.497 . 0 0 "[ . 1 . 2 .]" 1
628 1 61 MET H 1 95 ASP H . . 5.200 4.602 4.087 4.857 . 0 0 "[ . 1 . 2 .]" 1
629 1 61 MET H 1 96 ALA H . . 3.800 3.868 3.501 4.108 0.308 19 0 "[ . 1 . 2 .]" 1
630 1 61 MET HA 1 62 ILE H . . 2.700 2.224 2.175 2.292 . 0 0 "[ . 1 . 2 .]" 1
631 1 61 MET QB 1 62 ILE H . . 4.800 3.730 2.735 4.016 . 0 0 "[ . 1 . 2 .]" 1
632 1 62 ILE H 1 62 ILE HB . . 4.000 2.566 2.231 2.877 . 0 0 "[ . 1 . 2 .]" 1
633 1 62 ILE HA 1 62 ILE MD . . 4.500 3.781 3.485 3.989 . 0 0 "[ . 1 . 2 .]" 1
634 1 62 ILE HA 1 63 GLY H . . 3.900 2.225 2.076 2.339 . 0 0 "[ . 1 . 2 .]" 1
635 1 62 ILE HA 1 96 ALA H . . 3.500 2.974 2.710 3.175 . 0 0 "[ . 1 . 2 .]" 1
636 1 62 ILE HA 1 96 ALA MB . . 6.800 3.094 2.809 3.329 . 0 0 "[ . 1 . 2 .]" 1
637 1 62 ILE HA 1 97 HIS HD2 . . 4.700 4.144 3.729 4.717 0.017 24 0 "[ . 1 . 2 .]" 1
638 1 62 ILE HB 1 63 GLY H . . 4.500 4.177 3.918 4.357 . 0 0 "[ . 1 . 2 .]" 1
639 1 62 ILE MD 1 122 LEU QD . . 8.800 2.649 1.973 3.848 . 0 0 "[ . 1 . 2 .]" 1
640 1 62 ILE MG 1 63 GLY H . . 4.800 2.675 2.244 2.987 . 0 0 "[ . 1 . 2 .]" 1
641 1 63 GLY H 1 64 PHE H . . 5.500 4.369 3.802 4.490 . 0 0 "[ . 1 . 2 .]" 1
642 1 63 GLY H 1 96 ALA H . . 4.700 4.301 3.844 4.791 0.091 25 0 "[ . 1 . 2 .]" 1
643 1 63 GLY H 1 97 HIS HA . . 3.000 2.643 2.272 2.892 . 0 0 "[ . 1 . 2 .]" 1
644 1 63 GLY H 1 98 PHE H . . 4.900 3.964 3.787 4.358 . 0 0 "[ . 1 . 2 .]" 1
645 1 63 GLY H 1 98 PHE HD1 . . 4.200 2.995 2.767 3.678 . 0 0 "[ . 1 . 2 .]" 1
646 1 63 GLY H 1 98 PHE HE1 . . 4.400 3.761 3.271 4.149 . 0 0 "[ . 1 . 2 .]" 1
647 1 63 GLY HA2 1 64 PHE H . . 2.800 2.338 2.187 2.456 . 0 0 "[ . 1 . 2 .]" 1
648 1 63 GLY HA3 1 64 PHE H . . 3.800 2.960 2.731 3.573 . 0 0 "[ . 1 . 2 .]" 1
649 1 64 PHE H 1 64 PHE HB2 . . 3.000 2.784 2.646 3.752 0.752 14 1 "[ . 1 +. 2 .]" 1
650 1 64 PHE H 1 64 PHE QE . . 5.200 4.488 3.897 4.792 . 0 0 "[ . 1 . 2 .]" 1
651 1 64 PHE H 1 65 ALA H . . 4.600 4.415 4.298 4.565 . 0 0 "[ . 1 . 2 .]" 1
652 1 64 PHE H 1 65 ALA MB . . 6.000 4.707 4.165 5.191 . 0 0 "[ . 1 . 2 .]" 1
653 1 64 PHE H 1 98 PHE H . . 5.200 4.622 4.148 4.882 . 0 0 "[ . 1 . 2 .]" 1
654 1 64 PHE HA 1 65 ALA H . . 4.000 2.265 2.181 2.443 . 0 0 "[ . 1 . 2 .]" 1
655 1 64 PHE HA 1 98 PHE H . . 3.000 2.350 2.028 2.467 . 0 0 "[ . 1 . 2 .]" 1
656 1 64 PHE HA 1 100 GLU H . . 4.700 4.100 3.830 4.465 . 0 0 "[ . 1 . 2 .]" 1
657 1 64 PHE HB2 1 65 ALA H . . 4.300 3.713 3.019 4.010 . 0 0 "[ . 1 . 2 .]" 1
658 1 64 PHE HB3 1 104 TRP HE1 . . 5.000 4.766 4.195 5.518 0.518 14 1 "[ . 1 +. 2 .]" 1
659 1 64 PHE QD 1 104 TRP HE1 . . 6.800 4.107 3.280 5.747 . 0 0 "[ . 1 . 2 .]" 1
660 1 64 PHE QE 1 104 TRP HE1 . . 8.000 5.418 4.471 6.857 . 0 0 "[ . 1 . 2 .]" 1
661 1 65 ALA H 1 65 ALA HA . . 3.100 2.932 2.792 2.985 . 0 0 "[ . 1 . 2 .]" 1
662 1 65 ALA H 1 66 ARG H . . 4.900 4.390 4.314 4.455 . 0 0 "[ . 1 . 2 .]" 1
663 1 65 ALA H 1 75 PHE HD2 . . 5.200 4.375 3.949 5.075 . 0 0 "[ . 1 . 2 .]" 1
664 1 65 ALA H 1 75 PHE HE2 . . 4.100 3.904 3.228 4.439 0.339 14 0 "[ . 1 . 2 .]" 1
665 1 65 ALA H 1 98 PHE H . . 3.800 3.913 3.711 4.188 0.388 1 0 "[ . 1 . 2 .]" 1
666 1 65 ALA H 1 98 PHE HB2 . . 4.600 4.327 4.154 4.632 0.032 19 0 "[ . 1 . 2 .]" 1
667 1 65 ALA H 1 99 ASP H . . 5.600 4.911 4.782 5.066 . 0 0 "[ . 1 . 2 .]" 1
668 1 65 ALA H 1 99 ASP HA . . 3.400 3.057 2.773 3.334 . 0 0 "[ . 1 . 2 .]" 1
669 1 65 ALA H 1 100 GLU H . . 3.500 2.446 2.337 2.645 . 0 0 "[ . 1 . 2 .]" 1
670 1 65 ALA H 1 100 GLU QB . . 4.500 3.071 2.812 3.835 . 0 0 "[ . 1 . 2 .]" 1
671 1 65 ALA HA 1 66 ARG H . . 3.700 2.585 2.298 2.795 . 0 0 "[ . 1 . 2 .]" 1
672 1 65 ALA MB 1 66 ARG H . . 3.700 2.358 2.162 2.691 . 0 0 "[ . 1 . 2 .]" 1
673 1 65 ALA MB 1 66 ARG HA . . 5.600 4.139 3.964 4.324 . 0 0 "[ . 1 . 2 .]" 1
674 1 65 ALA MB 1 69 HIS HD2 . . 5.000 3.351 2.119 4.606 . 0 0 "[ . 1 . 2 .]" 1
675 1 66 ARG H 1 66 ARG QB . . 3.800 2.779 2.117 3.316 . 0 0 "[ . 1 . 2 .]" 1
676 1 66 ARG H 1 67 GLY H . . 5.000 3.100 2.052 4.300 . 0 0 "[ . 1 . 2 .]" 1
677 1 66 ARG HA 1 67 GLY H . . 3.500 2.687 2.088 3.541 0.041 19 0 "[ . 1 . 2 .]" 1
678 1 66 ARG QB 1 67 GLY H . . 5.200 3.720 1.959 4.082 . 0 0 "[ . 1 . 2 .]" 1
679 1 67 GLY HA2 1 77 GLY H . . 4.500 3.211 2.471 4.425 . 0 0 "[ . 1 . 2 .]" 1
680 1 68 ALA HA 1 74 PRO HB2 . . 4.700 3.502 2.567 4.507 . 0 0 "[ . 1 . 2 .]" 1
681 1 68 ALA HA 1 74 PRO HB3 . . 3.800 3.254 2.165 4.743 0.943 17 2 "[ . 1 -. + 2 .]" 1
682 1 68 ALA MB 1 69 HIS H . . 4.300 2.451 1.973 3.219 . 0 0 "[ . 1 . 2 .]" 1
683 1 68 ALA MB 1 74 PRO HA . . 6.600 3.595 2.179 4.759 . 0 0 "[ . 1 . 2 .]" 1
684 1 68 ALA MB 1 74 PRO HB2 . . 4.900 3.174 2.175 5.025 0.125 7 0 "[ . 1 . 2 .]" 1
685 1 68 ALA MB 1 74 PRO HB3 . . 5.900 2.813 2.178 4.310 . 0 0 "[ . 1 . 2 .]" 1
686 1 68 ALA MB 1 75 PHE H . . 5.700 3.872 2.528 4.768 . 0 0 "[ . 1 . 2 .]" 1
687 1 69 HIS H 1 71 ASP H . . 4.300 4.551 3.664 5.197 0.897 3 4 "[ + *-* 1 . 2 .]" 1
688 1 69 HIS H 1 74 PRO HA . . 3.300 3.255 2.599 3.827 0.527 15 1 "[ . 1 + 2 .]" 1
689 1 69 HIS HE1 1 75 PHE H . . 6.000 4.288 2.953 6.608 0.608 8 1 "[ . + 1 . 2 .]" 1
690 1 70 GLY HA2 1 71 ASP H . . 3.900 2.460 2.167 3.169 . 0 0 "[ . 1 . 2 .]" 1
691 1 70 GLY HA3 1 71 ASP H . . 4.400 3.497 3.251 3.572 . 0 0 "[ . 1 . 2 .]" 1
692 1 71 ASP H 1 73 TYR H . . 4.200 4.195 3.292 5.286 1.086 23 6 "[* . * -1 *.* 2 + .]" 1
693 1 71 ASP H 1 97 HIS HE1 . . 5.300 5.672 5.146 6.391 1.091 24 6 "[ . -1 *.*** 2 +.]" 1
694 1 71 ASP HA 1 73 TYR H . . 5.200 5.156 4.202 5.993 0.793 14 3 "[ . - 1 +. 2 * .]" 1
695 1 71 ASP QB 1 73 TYR H . . 5.200 3.726 2.567 4.851 . 0 0 "[ . 1 . 2 .]" 1
696 1 71 ASP QB 1 97 HIS HD2 . . 7.000 5.562 4.957 6.380 . 0 0 "[ . 1 . 2 .]" 1
697 1 71 ASP QB 1 97 HIS HE1 . . 5.500 2.370 2.064 3.001 . 0 0 "[ . 1 . 2 .]" 1
698 1 72 SER HA 1 72 SER HB3 . . 3.000 2.886 2.443 3.097 0.097 3 0 "[ . 1 . 2 .]" 1
699 1 72 SER HB2 1 73 TYR H . . 3.700 3.457 2.539 4.330 0.630 11 1 "[ . 1+ . 2 .]" 1
700 1 73 TYR H 1 73 TYR HB2 . . 3.000 2.823 2.298 3.401 0.401 12 0 "[ . 1 . 2 .]" 1
701 1 73 TYR H 1 73 TYR QE . . 5.500 5.059 4.120 5.761 0.261 2 0 "[ . 1 . 2 .]" 1
702 1 73 TYR H 1 84 HIS HE1 . . 3.900 4.256 3.461 4.705 0.805 23 10 "[*** . 1* *. -** + *]" 1
703 1 74 PRO HA 1 74 PRO HB3 . . 3.000 2.312 2.280 2.357 . 0 0 "[ . 1 . 2 .]" 1
704 1 74 PRO HA 1 75 PHE H . . 4.000 2.392 2.121 3.437 . 0 0 "[ . 1 . 2 .]" 1
705 1 74 PRO QB 1 75 PHE H . . 4.100 2.842 2.334 3.915 . 0 0 "[ . 1 . 2 .]" 1
706 1 75 PHE H 1 75 PHE HB2 . . 3.400 2.426 2.179 3.466 0.066 14 0 "[ . 1 . 2 .]" 1
707 1 75 PHE H 1 75 PHE HB3 . . 3.900 3.497 3.196 4.180 0.280 14 0 "[ . 1 . 2 .]" 1
708 1 75 PHE H 1 75 PHE HD2 . . 4.000 4.242 3.613 4.741 0.741 17 4 "[ .* 1 *.-+ 2 .]" 1
709 1 75 PHE H 1 76 ASP H . . 5.800 4.227 4.064 4.433 . 0 0 "[ . 1 . 2 .]" 1
710 1 75 PHE H 1 84 HIS HE1 . . 4.800 5.314 4.086 5.891 1.091 18 14 "[ * ***-*** * .* +*2* *.]" 1
711 1 75 PHE HA 1 76 ASP H . . 3.000 2.527 2.203 3.500 0.500 17 0 "[ . 1 . 2 .]" 1
712 1 75 PHE HA 1 77 GLY H . . 5.000 4.458 4.320 4.660 . 0 0 "[ . 1 . 2 .]" 1
713 1 75 PHE HB2 1 76 ASP H . . 3.400 3.532 3.054 3.908 0.508 4 1 "[ +. 1 . 2 .]" 1
714 1 75 PHE HB3 1 76 ASP H . . 3.300 2.176 1.870 2.691 . 0 0 "[ . 1 . 2 .]" 1
715 1 75 PHE HB3 1 77 GLY H . . 4.000 2.458 2.247 2.992 . 0 0 "[ . 1 . 2 .]" 1
716 1 75 PHE HE1 1 81 THR MG . . 3.800 2.642 2.373 2.850 . 0 0 "[ . 1 . 2 .]" 1
717 1 76 ASP H 1 76 ASP HB2 . . 4.300 3.542 3.463 4.118 . 0 0 "[ . 1 . 2 .]" 1
718 1 76 ASP H 1 76 ASP HB3 . . 3.400 2.822 2.443 3.744 0.344 17 0 "[ . 1 . 2 .]" 1
719 1 76 ASP H 1 77 GLY H . . 4.000 2.326 1.848 2.899 . 0 0 "[ . 1 . 2 .]" 1
720 1 76 ASP H 1 77 GLY HA2 . . 5.000 4.545 4.028 5.281 0.281 15 0 "[ . 1 . 2 .]" 1
721 1 76 ASP H 1 99 ASP QB . . 5.100 5.176 4.244 5.853 0.753 12 3 "[ . 1 + * 2 -]" 1
722 1 76 ASP HA 1 77 GLY H . . 4.800 3.548 3.367 3.636 . 0 0 "[ . 1 . 2 .]" 1
723 1 77 GLY H 1 77 GLY HA2 . . 3.000 2.294 2.175 2.431 . 0 0 "[ . 1 . 2 .]" 1
724 1 77 GLY HA2 1 78 PRO HA . . 5.800 4.395 4.246 4.514 . 0 0 "[ . 1 . 2 .]" 1
725 1 78 PRO HA 1 79 GLY H . . 2.800 2.282 2.156 2.559 . 0 0 "[ . 1 . 2 .]" 1
726 1 78 PRO HA 1 102 GLU H . . 5.600 4.949 4.586 5.474 . 0 0 "[ . 1 . 2 .]" 1
727 1 78 PRO HA 1 102 GLU HA . . 3.500 3.479 3.085 3.827 0.327 18 0 "[ . 1 . 2 .]" 1
728 1 78 PRO QB 1 79 GLY H . . 5.100 3.832 3.620 4.059 . 0 0 "[ . 1 . 2 .]" 1
729 1 78 PRO QG 1 79 GLY H . . 6.400 4.825 4.590 4.914 . 0 0 "[ . 1 . 2 .]" 1
730 1 79 GLY HA2 1 80 ASN H . . 3.400 2.671 2.480 2.888 . 0 0 "[ . 1 . 2 .]" 1
731 1 79 GLY HA3 1 80 ASN H . . 3.800 2.648 2.393 2.923 . 0 0 "[ . 1 . 2 .]" 1
732 1 80 ASN HB2 1 81 THR H . . 4.000 3.459 2.260 3.927 . 0 0 "[ . 1 . 2 .]" 1
733 1 80 ASN HB3 1 81 THR H . . 2.800 2.610 2.091 3.100 0.300 21 0 "[ . 1 . 2 .]" 1
734 1 81 THR H 1 81 THR HB . . 3.400 2.801 2.600 2.961 . 0 0 "[ . 1 . 2 .]" 1
735 1 81 THR H 1 81 THR MG . . 4.700 3.665 3.559 3.829 . 0 0 "[ . 1 . 2 .]" 1
736 1 81 THR HA 1 82 LEU H . . 2.900 2.265 2.193 2.438 . 0 0 "[ . 1 . 2 .]" 1
737 1 81 THR HA 1 83 ALA H . . 5.600 4.030 3.910 4.337 . 0 0 "[ . 1 . 2 .]" 1
738 1 81 THR HB 1 82 LEU H . . 4.200 4.319 4.140 4.524 0.324 6 0 "[ . 1 . 2 .]" 1
739 1 81 THR HB 1 83 ALA H . . 5.000 4.938 4.704 5.168 0.168 6 0 "[ . 1 . 2 .]" 1
740 1 81 THR MG 1 82 LEU H . . 5.500 3.096 2.733 3.461 . 0 0 "[ . 1 . 2 .]" 1
741 1 82 LEU H 1 82 LEU HB2 . . 3.300 2.485 2.360 2.637 . 0 0 "[ . 1 . 2 .]" 1
742 1 82 LEU H 1 82 LEU QD . . 4.700 2.476 1.968 3.295 . 0 0 "[ . 1 . 2 .]" 1
743 1 82 LEU H 1 82 LEU HG . . 3.600 2.959 2.017 3.559 . 0 0 "[ . 1 . 2 .]" 1
744 1 82 LEU H 1 83 ALA H . . 2.800 2.446 2.221 2.954 0.154 23 0 "[ . 1 . 2 .]" 1
745 1 82 LEU HA 1 83 ALA H . . 4.200 3.531 3.472 3.566 . 0 0 "[ . 1 . 2 .]" 1
746 1 82 LEU HB2 1 83 ALA H . . 3.300 2.857 2.694 2.989 . 0 0 "[ . 1 . 2 .]" 1
747 1 82 LEU HB3 1 83 ALA H . . 3.600 3.827 3.614 4.008 0.408 2 0 "[ . 1 . 2 .]" 1
748 1 82 LEU QD 1 83 ALA H . . 6.200 3.997 3.738 4.267 . 0 0 "[ . 1 . 2 .]" 1
749 1 82 LEU QD 1 102 GLU QB . . 4.400 2.870 2.365 3.551 . 0 0 "[ . 1 . 2 .]" 1
750 1 82 LEU QD 1 102 GLU QG . . 4.900 3.503 2.321 4.249 . 0 0 "[ . 1 . 2 .]" 1
751 1 82 LEU QD 1 103 ARG H . . 7.000 5.140 4.187 6.101 . 0 0 "[ . 1 . 2 .]" 1
752 1 82 LEU QD 1 112 ILE MD . . 6.200 2.228 1.799 2.879 . 0 0 "[ . 1 . 2 .]" 1
753 1 82 LEU QD 1 112 ILE MG . . 5.300 2.026 1.896 2.213 . 0 0 "[ . 1 . 2 .]" 1
754 1 82 LEU QD 1 142 TYR QD . . 6.900 3.116 2.071 4.298 . 0 0 "[ . 1 . 2 .]" 1
755 1 82 LEU HG 1 102 GLU QB . . 5.300 4.571 3.317 5.924 0.624 16 4 "[ . 1 * .+- 2 * .]" 1
756 1 82 LEU HG 1 104 TRP HH2 . . 5.200 5.156 4.869 5.415 0.215 12 0 "[ . 1 . 2 .]" 1
757 1 82 LEU HG 1 112 ILE MG . . 6.500 4.525 4.213 4.834 . 0 0 "[ . 1 . 2 .]" 1
758 1 83 ALA H 1 83 ALA MB . . 3.600 2.738 2.683 2.810 . 0 0 "[ . 1 . 2 .]" 1
759 1 83 ALA H 1 84 HIS H . . 4.600 4.352 4.302 4.426 . 0 0 "[ . 1 . 2 .]" 1
760 1 83 ALA H 1 84 HIS HB2 . . 6.200 6.271 6.073 6.352 0.152 14 0 "[ . 1 . 2 .]" 1
761 1 83 ALA HA 1 84 HIS H . . 2.900 2.503 2.413 2.582 . 0 0 "[ . 1 . 2 .]" 1
762 1 83 ALA HA 1 98 PHE H . . 5.300 4.766 4.633 4.899 . 0 0 "[ . 1 . 2 .]" 1
763 1 83 ALA HA 1 98 PHE HA . . 4.800 2.188 2.042 2.360 . 0 0 "[ . 1 . 2 .]" 1
764 1 83 ALA HA 1 98 PHE HB3 . . 4.200 4.462 3.923 4.719 0.519 6 1 "[ .+ 1 . 2 .]" 1
765 1 83 ALA HA 1 99 ASP H . . 3.800 3.386 3.246 3.609 . 0 0 "[ . 1 . 2 .]" 1
766 1 83 ALA MB 1 84 HIS H . . 3.800 2.398 2.236 2.596 . 0 0 "[ . 1 . 2 .]" 1
767 1 83 ALA MB 1 98 PHE HB3 . . 6.100 3.212 2.682 3.541 . 0 0 "[ . 1 . 2 .]" 1
768 1 83 ALA MB 1 98 PHE QD . . 7.100 2.500 2.340 2.707 . 0 0 "[ . 1 . 2 .]" 1
769 1 83 ALA MB 1 117 ALA MB . . 7.500 3.254 2.865 3.454 . 0 0 "[ . 1 . 2 .]" 1
770 1 83 ALA MB 1 121 GLU QG . . 8.000 2.396 1.996 2.829 . 0 0 "[ . 1 . 2 .]" 1
771 1 84 HIS H 1 84 HIS HB2 . . 4.000 4.092 4.006 4.144 0.144 18 0 "[ . 1 . 2 .]" 1
772 1 84 HIS H 1 85 ALA H . . 4.900 4.415 4.346 4.531 . 0 0 "[ . 1 . 2 .]" 1
773 1 84 HIS H 1 97 HIS H . . 3.700 2.849 2.706 2.979 . 0 0 "[ . 1 . 2 .]" 1
774 1 84 HIS H 1 97 HIS QB . . 3.500 3.860 3.217 4.258 0.758 10 11 "[ - .* **+* * ** * 2* .]" 1
775 1 84 HIS H 1 98 PHE HA . . 4.200 3.586 3.393 3.811 . 0 0 "[ . 1 . 2 .]" 1
776 1 84 HIS HA 1 85 ALA H . . 3.300 2.449 2.372 2.516 . 0 0 "[ . 1 . 2 .]" 1
777 1 84 HIS HB2 1 85 ALA H . . 2.800 2.546 2.372 2.790 . 0 0 "[ . 1 . 2 .]" 1
778 1 84 HIS HB3 1 85 ALA H . . 4.800 3.875 3.744 4.055 . 0 0 "[ . 1 . 2 .]" 1
779 1 85 ALA H 1 86 PHE H . . 5.800 4.323 4.283 4.379 . 0 0 "[ . 1 . 2 .]" 1
780 1 85 ALA HA 1 86 PHE H . . 3.200 2.445 2.299 2.584 . 0 0 "[ . 1 . 2 .]" 1
781 1 85 ALA HA 1 96 ALA H . . 5.100 4.677 4.544 4.823 . 0 0 "[ . 1 . 2 .]" 1
782 1 85 ALA HA 1 96 ALA HA . . 2.600 2.082 2.017 2.205 . 0 0 "[ . 1 . 2 .]" 1
783 1 85 ALA MB 1 86 PHE H . . 4.300 2.405 2.216 2.655 . 0 0 "[ . 1 . 2 .]" 1
784 1 85 ALA MB 1 96 ALA HA . . 4.500 2.996 2.363 3.520 . 0 0 "[ . 1 . 2 .]" 1
785 1 85 ALA MB 1 97 HIS H . . 6.400 3.838 3.356 4.185 . 0 0 "[ . 1 . 2 .]" 1
786 1 85 ALA MB 1 121 GLU HA . . 5.700 2.880 2.586 3.335 . 0 0 "[ . 1 . 2 .]" 1
787 1 85 ALA MB 1 121 GLU QB . . 4.900 2.333 2.062 2.896 . 0 0 "[ . 1 . 2 .]" 1
788 1 85 ALA MB 1 124 HIS H . . 5.700 4.084 3.797 4.478 . 0 0 "[ . 1 . 2 .]" 1
789 1 85 ALA MB 1 124 HIS HB2 . . 5.300 2.380 2.156 2.739 . 0 0 "[ . 1 . 2 .]" 1
790 1 85 ALA MB 1 125 SER H . . 5.500 3.631 3.321 4.326 . 0 0 "[ . 1 . 2 .]" 1
791 1 85 ALA MB 1 125 SER HA . . 5.700 4.024 3.657 4.334 . 0 0 "[ . 1 . 2 .]" 1
792 1 86 PHE H 1 86 PHE QB . . 3.700 2.745 2.618 2.914 . 0 0 "[ . 1 . 2 .]" 1
793 1 86 PHE H 1 86 PHE QE . . 5.100 4.728 4.502 4.924 . 0 0 "[ . 1 . 2 .]" 1
794 1 86 PHE H 1 87 ALA H . . 5.300 4.468 4.403 4.511 . 0 0 "[ . 1 . 2 .]" 1
795 1 86 PHE H 1 94 GLY H . . 3.900 3.986 3.407 4.201 0.301 9 0 "[ . 1 . 2 .]" 1
796 1 86 PHE H 1 95 ASP H . . 4.600 3.595 3.322 4.173 . 0 0 "[ . 1 . 2 .]" 1
797 1 86 PHE HA 1 87 ALA H . . 4.100 2.379 2.264 2.592 . 0 0 "[ . 1 . 2 .]" 1
798 1 86 PHE QB 1 87 ALA H . . 4.500 2.689 2.169 2.992 . 0 0 "[ . 1 . 2 .]" 1
799 1 86 PHE QB 1 93 GLY HA2 . . 3.900 2.380 2.106 2.674 . 0 0 "[ . 1 . 2 .]" 1
800 1 86 PHE QB 1 94 GLY HA2 . . 6.200 4.161 3.724 4.447 . 0 0 "[ . 1 . 2 .]" 1
801 1 86 PHE HB2 1 92 LEU QB . . 4.800 4.965 4.647 5.253 0.453 18 0 "[ . 1 . 2 .]" 1
802 1 86 PHE HB2 1 92 LEU MD2 . . 5.300 3.626 3.154 4.385 . 0 0 "[ . 1 . 2 .]" 1
803 1 86 PHE HB2 1 93 GLY HA3 . . 5.700 4.223 3.878 4.513 . 0 0 "[ . 1 . 2 .]" 1
804 1 86 PHE HB3 1 92 LEU QB . . 5.000 5.016 4.463 5.324 0.324 9 0 "[ . 1 . 2 .]" 1
805 1 86 PHE HB3 1 92 LEU MD2 . . 6.500 3.237 2.698 4.424 . 0 0 "[ . 1 . 2 .]" 1
806 1 86 PHE HB3 1 93 GLY HA3 . . 4.900 4.788 4.284 5.309 0.409 9 0 "[ . 1 . 2 .]" 1
807 1 86 PHE QD 1 87 ALA H . . 7.500 4.335 3.863 4.507 . 0 0 "[ . 1 . 2 .]" 1
808 1 86 PHE QD 1 94 GLY H . . 6.700 4.374 4.055 4.741 . 0 0 "[ . 1 . 2 .]" 1
809 1 86 PHE QD 1 95 ASP H . . 6.700 2.551 2.312 3.440 . 0 0 "[ . 1 . 2 .]" 1
810 1 86 PHE QE 1 94 GLY H . . 6.700 6.562 6.224 6.899 0.199 21 0 "[ . 1 . 2 .]" 1
811 1 86 PHE QE 1 95 ASP H . . 7.300 4.557 4.210 5.497 . 0 0 "[ . 1 . 2 .]" 1
812 1 87 ALA H 1 87 ALA HA . . 2.900 2.891 2.790 2.958 0.058 10 0 "[ . 1 . 2 .]" 1
813 1 87 ALA H 1 94 GLY H . . 4.200 3.906 3.196 4.304 0.104 9 0 "[ . 1 . 2 .]" 1
814 1 87 ALA HA 1 127 GLY H . . 5.300 4.979 4.035 5.636 0.336 10 0 "[ . 1 . 2 .]" 1
815 1 87 ALA MB 1 88 PRO HD2 . . 4.700 2.273 2.027 2.722 . 0 0 "[ . 1 . 2 .]" 1
816 1 88 PRO HA 1 89 GLY H . . 2.900 2.446 2.234 2.618 . 0 0 "[ . 1 . 2 .]" 1
817 1 88 PRO HD2 1 89 GLY QA . . 5.400 5.528 5.133 5.715 0.315 25 0 "[ . 1 . 2 .]" 1
818 1 89 GLY H 1 93 GLY H . . 5.200 5.380 4.331 5.943 0.743 11 10 "[ ** *1+ -** *2 * *.]" 1
819 1 89 GLY H 1 93 GLY HA3 . . 3.300 3.584 2.878 3.931 0.631 11 6 "[ . 1+ ** *2 - *.]" 1
820 1 92 LEU HA 1 93 GLY H . . 3.900 3.593 3.483 3.648 . 0 0 "[ . 1 . 2 .]" 1
821 1 92 LEU HA 1 95 ASP H . . 4.600 4.508 4.012 4.817 0.217 23 0 "[ . 1 . 2 .]" 1
822 1 92 LEU QB 1 93 GLY H . . 3.500 2.867 2.568 3.100 . 0 0 "[ . 1 . 2 .]" 1
823 1 92 LEU MD2 1 93 GLY H . . 7.000 3.965 3.321 4.663 . 0 0 "[ . 1 . 2 .]" 1
824 1 92 LEU MD2 1 94 GLY H . . 7.000 5.532 5.046 6.132 . 0 0 "[ . 1 . 2 .]" 1
825 1 92 LEU MD2 1 97 HIS HE1 . . 7.000 5.173 3.709 7.313 0.313 4 0 "[ . 1 . 2 .]" 1
826 1 92 LEU HG 1 95 ASP H . . 4.500 4.138 3.967 4.341 . 0 0 "[ . 1 . 2 .]" 1
827 1 93 GLY H 1 93 GLY HA3 . . 3.000 2.292 2.226 2.323 . 0 0 "[ . 1 . 2 .]" 1
828 1 93 GLY H 1 94 GLY H . . 5.400 4.635 4.593 4.664 . 0 0 "[ . 1 . 2 .]" 1
829 1 93 GLY HA2 1 94 GLY H . . 3.000 2.312 2.243 2.385 . 0 0 "[ . 1 . 2 .]" 1
830 1 93 GLY HA2 1 95 ASP H . . 4.600 3.453 3.205 3.780 . 0 0 "[ . 1 . 2 .]" 1
831 1 93 GLY HA3 1 94 GLY H . . 3.600 2.971 2.823 3.164 . 0 0 "[ . 1 . 2 .]" 1
832 1 93 GLY HA3 1 95 ASP H . . 5.200 4.438 4.341 4.538 . 0 0 "[ . 1 . 2 .]" 1
833 1 94 GLY H 1 94 GLY HA2 . . 2.800 2.234 2.201 2.263 . 0 0 "[ . 1 . 2 .]" 1
834 1 94 GLY H 1 94 GLY HA3 . . 2.900 2.865 2.735 2.941 0.041 10 0 "[ . 1 . 2 .]" 1
835 1 94 GLY H 1 95 ASP H . . 3.700 2.998 2.728 3.169 . 0 0 "[ . 1 . 2 .]" 1
836 1 94 GLY HA2 1 95 ASP H . . 4.200 3.400 3.297 3.500 . 0 0 "[ . 1 . 2 .]" 1
837 1 94 GLY HA3 1 95 ASP H . . 4.000 3.184 2.777 3.315 . 0 0 "[ . 1 . 2 .]" 1
838 1 94 GLY HA3 1 96 ALA H . . 6.000 6.221 6.094 6.401 0.401 20 0 "[ . 1 . 2 .]" 1
839 1 95 ASP H 1 95 ASP QB . . 3.900 2.540 2.457 2.650 . 0 0 "[ . 1 . 2 .]" 1
840 1 95 ASP H 1 96 ALA H . . 5.700 4.588 4.511 4.678 . 0 0 "[ . 1 . 2 .]" 1
841 1 95 ASP HA 1 95 ASP HB2 . . 3.100 3.091 3.075 3.105 0.005 3 0 "[ . 1 . 2 .]" 1
842 1 95 ASP HA 1 96 ALA MB . . 5.100 3.710 3.628 3.801 . 0 0 "[ . 1 . 2 .]" 1
843 1 95 ASP QB 1 96 ALA H . . 5.100 2.851 2.726 3.032 . 0 0 "[ . 1 . 2 .]" 1
844 1 96 ALA H 1 97 HIS H . . 5.000 4.425 4.368 4.497 . 0 0 "[ . 1 . 2 .]" 1
845 1 96 ALA HA 1 97 HIS H . . 3.300 2.339 2.232 2.416 . 0 0 "[ . 1 . 2 .]" 1
846 1 96 ALA MB 1 97 HIS H . . 4.000 2.528 2.383 2.757 . 0 0 "[ . 1 . 2 .]" 1
847 1 96 ALA MB 1 98 PHE HZ . . 6.300 3.441 2.611 4.007 . 0 0 "[ . 1 . 2 .]" 1
848 1 96 ALA MB 1 121 GLU QB . . 6.900 2.361 2.065 2.685 . 0 0 "[ . 1 . 2 .]" 1
849 1 97 HIS H 1 97 HIS QB . . 3.400 2.987 2.649 3.205 . 0 0 "[ . 1 . 2 .]" 1
850 1 97 HIS H 1 98 PHE H . . 5.000 4.211 4.160 4.283 . 0 0 "[ . 1 . 2 .]" 1
851 1 97 HIS H 1 98 PHE HD1 . . 4.500 3.798 3.626 3.994 . 0 0 "[ . 1 . 2 .]" 1
852 1 97 HIS H 1 98 PHE HE1 . . 6.000 3.857 3.523 4.215 . 0 0 "[ . 1 . 2 .]" 1
853 1 97 HIS HA 1 98 PHE H . . 2.900 2.230 2.127 2.304 . 0 0 "[ . 1 . 2 .]" 1
854 1 97 HIS HA 1 98 PHE QD . . 5.100 2.526 2.249 2.706 . 0 0 "[ . 1 . 2 .]" 1
855 1 97 HIS QB 1 98 PHE H . . 3.900 2.866 2.647 3.382 . 0 0 "[ . 1 . 2 .]" 1
856 1 98 PHE H 1 98 PHE HB2 . . 3.100 2.346 2.152 2.791 . 0 0 "[ . 1 . 2 .]" 1
857 1 98 PHE H 1 98 PHE HB3 . . 3.800 3.554 3.447 3.767 . 0 0 "[ . 1 . 2 .]" 1
858 1 98 PHE H 1 98 PHE HD1 . . 3.600 2.419 2.249 2.567 . 0 0 "[ . 1 . 2 .]" 1
859 1 98 PHE H 1 98 PHE HE1 . . 5.900 4.761 4.516 4.953 . 0 0 "[ . 1 . 2 .]" 1
860 1 98 PHE H 1 99 ASP H . . 5.500 4.474 4.429 4.505 . 0 0 "[ . 1 . 2 .]" 1
861 1 98 PHE HA 1 99 ASP H . . 4.000 2.338 2.282 2.393 . 0 0 "[ . 1 . 2 .]" 1
862 1 98 PHE HB2 1 99 ASP H . . 5.500 3.860 3.530 4.035 . 0 0 "[ . 1 . 2 .]" 1
863 1 98 PHE HB2 1 104 TRP HE1 . . 4.700 4.813 3.940 5.669 0.969 9 3 "[ . +1 .- * .]" 1
864 1 98 PHE HB3 1 99 ASP H . . 3.000 2.789 2.570 2.943 . 0 0 "[ . 1 . 2 .]" 1
865 1 98 PHE HD1 1 99 ASP H . . 5.600 5.758 5.623 5.844 0.244 8 0 "[ . 1 . 2 .]" 1
866 1 98 PHE HZ 1 118 ALA HA . . 3.900 2.546 2.034 2.906 . 0 0 "[ . 1 . 2 .]" 1
867 1 98 PHE HZ 1 118 ALA MB . . 6.100 3.714 3.240 4.137 . 0 0 "[ . 1 . 2 .]" 1
868 1 99 ASP H 1 99 ASP QB . . 3.400 2.334 2.225 2.476 . 0 0 "[ . 1 . 2 .]" 1
869 1 99 ASP H 1 100 GLU H . . 5.800 4.260 4.169 4.370 . 0 0 "[ . 1 . 2 .]" 1
870 1 99 ASP H 1 102 GLU QG . . 4.600 4.415 3.543 5.072 0.472 13 0 "[ . 1 . 2 .]" 1
871 1 99 ASP H 1 104 TRP HE1 . . 4.600 3.932 3.673 4.510 . 0 0 "[ . 1 . 2 .]" 1
872 1 99 ASP H 1 104 TRP HZ2 . . 4.900 2.239 2.057 2.574 . 0 0 "[ . 1 . 2 .]" 1
873 1 99 ASP HA 1 100 GLU H . . 3.100 2.213 2.140 2.264 . 0 0 "[ . 1 . 2 .]" 1
874 1 99 ASP HA 1 101 ASP H . . 3.500 3.437 3.289 3.689 0.189 18 0 "[ . 1 . 2 .]" 1
875 1 99 ASP QB 1 100 GLU H . . 3.700 3.803 3.584 4.058 0.358 18 0 "[ . 1 . 2 .]" 1
876 1 99 ASP QB 1 102 GLU H . . 3.200 3.078 2.436 3.602 0.402 17 0 "[ . 1 . 2 .]" 1
877 1 99 ASP QB 1 104 TRP HE1 . . 5.200 3.985 3.764 4.195 . 0 0 "[ . 1 . 2 .]" 1
878 1 100 GLU H 1 100 GLU QB . . 3.400 2.232 2.112 2.849 . 0 0 "[ . 1 . 2 .]" 1
879 1 100 GLU H 1 100 GLU QG . . 5.000 3.917 2.221 4.100 . 0 0 "[ . 1 . 2 .]" 1
880 1 100 GLU H 1 101 ASP H . . 3.400 2.517 2.365 2.694 . 0 0 "[ . 1 . 2 .]" 1
881 1 100 GLU H 1 101 ASP HB2 . . 4.500 4.506 4.189 4.860 0.360 18 0 "[ . 1 . 2 .]" 1
882 1 100 GLU H 1 102 GLU H . . 4.600 4.256 4.117 4.421 . 0 0 "[ . 1 . 2 .]" 1
883 1 100 GLU QB 1 101 ASP H . . 4.100 2.893 2.553 3.647 . 0 0 "[ . 1 . 2 .]" 1
884 1 100 GLU QB 1 104 TRP HD1 . . 5.100 4.851 4.296 5.547 0.447 9 0 "[ . 1 . 2 .]" 1
885 1 100 GLU QB 1 104 TRP HE1 . . 4.400 4.345 3.983 4.643 0.243 25 0 "[ . 1 . 2 .]" 1
886 1 100 GLU QG 1 104 TRP HE1 . . 7.000 4.395 4.035 5.192 . 0 0 "[ . 1 . 2 .]" 1
887 1 101 ASP H 1 101 ASP HB2 . . 2.900 2.293 2.124 2.549 . 0 0 "[ . 1 . 2 .]" 1
888 1 101 ASP H 1 101 ASP HB3 . . 3.000 2.910 2.640 3.145 0.145 25 0 "[ . 1 . 2 .]" 1
889 1 101 ASP H 1 102 GLU H . . 3.200 2.788 2.393 3.006 . 0 0 "[ . 1 . 2 .]" 1
890 1 101 ASP H 1 102 GLU QB . . 5.600 4.774 4.411 5.008 . 0 0 "[ . 1 . 2 .]" 1
891 1 101 ASP HA 1 102 GLU H . . 3.900 3.413 3.322 3.481 . 0 0 "[ . 1 . 2 .]" 1
892 1 101 ASP HB2 1 102 GLU H . . 4.000 4.049 3.883 4.309 0.309 17 0 "[ . 1 . 2 .]" 1
893 1 102 GLU H 1 102 GLU QB . . 3.200 2.460 2.368 2.538 . 0 0 "[ . 1 . 2 .]" 1
894 1 102 GLU H 1 102 GLU QG . . 3.100 2.848 2.630 3.074 . 0 0 "[ . 1 . 2 .]" 1
895 1 102 GLU H 1 103 ARG H . . 4.900 4.318 4.043 4.484 . 0 0 "[ . 1 . 2 .]" 1
896 1 102 GLU H 1 104 TRP HE1 . . 3.700 3.116 2.593 3.304 . 0 0 "[ . 1 . 2 .]" 1
897 1 102 GLU HA 1 103 ARG H . . 2.800 2.317 2.099 2.589 . 0 0 "[ . 1 . 2 .]" 1
898 1 102 GLU HA 1 103 ARG QB . . 4.600 4.305 3.951 4.553 . 0 0 "[ . 1 . 2 .]" 1
899 1 102 GLU QB 1 103 ARG H . . 3.600 2.961 2.073 3.694 0.094 14 0 "[ . 1 . 2 .]" 1
900 1 102 GLU QB 1 104 TRP HE1 . . 4.600 3.131 2.729 3.413 . 0 0 "[ . 1 . 2 .]" 1
901 1 102 GLU QB 1 112 ILE MD . . 6.200 3.396 1.901 4.950 . 0 0 "[ . 1 . 2 .]" 1
902 1 102 GLU QG 1 103 ARG H . . 4.700 4.276 3.645 4.792 0.092 7 0 "[ . 1 . 2 .]" 1
903 1 102 GLU QG 1 104 TRP HE1 . . 4.700 4.651 4.315 4.938 0.238 20 0 "[ . 1 . 2 .]" 1
904 1 103 ARG H 1 103 ARG QB . . 2.900 2.342 2.063 2.969 0.069 10 0 "[ . 1 . 2 .]" 1
905 1 103 ARG H 1 104 TRP H . . 5.000 4.533 4.229 4.672 . 0 0 "[ . 1 . 2 .]" 1
906 1 103 ARG H 1 104 TRP QB . . 7.000 6.016 5.667 6.383 . 0 0 "[ . 1 . 2 .]" 1
907 1 103 ARG H 1 112 ILE MD . . 7.000 4.360 2.687 6.154 . 0 0 "[ . 1 . 2 .]" 1
908 1 103 ARG QB 1 104 TRP H . . 3.500 3.189 2.683 3.933 0.433 1 0 "[ . 1 . 2 .]" 1
909 1 103 ARG QB 1 112 ILE H . . 5.700 3.755 2.916 4.999 . 0 0 "[ . 1 . 2 .]" 1
910 1 104 TRP H 1 104 TRP QB . . 3.800 2.560 2.374 2.727 . 0 0 "[ . 1 . 2 .]" 1
911 1 104 TRP H 1 104 TRP HD1 . . 4.700 3.534 3.014 4.131 . 0 0 "[ . 1 . 2 .]" 1
912 1 104 TRP H 1 104 TRP HE1 . . 6.000 5.440 5.005 5.958 . 0 0 "[ . 1 . 2 .]" 1
913 1 104 TRP HA 1 105 THR H . . 4.500 2.303 2.179 2.449 . 0 0 "[ . 1 . 2 .]" 1
914 1 104 TRP HA 1 105 THR HA . . 4.800 4.522 4.457 4.628 . 0 0 "[ . 1 . 2 .]" 1
915 1 104 TRP HA 1 112 ILE H . . 3.800 2.958 2.250 3.607 . 0 0 "[ . 1 . 2 .]" 1
916 1 104 TRP QB 1 114 PHE H . . 6.100 4.162 3.633 5.011 . 0 0 "[ . 1 . 2 .]" 1
917 1 104 TRP HE3 1 112 ILE H . . 4.800 4.698 4.076 5.286 0.486 23 0 "[ . 1 . 2 .]" 1
918 1 105 THR H 1 105 THR HB . . 4.400 3.187 2.823 3.346 . 0 0 "[ . 1 . 2 .]" 1
919 1 105 THR H 1 105 THR MG . . 3.900 2.419 2.303 2.589 . 0 0 "[ . 1 . 2 .]" 1
920 1 105 THR H 1 106 ASP HA . . 5.200 4.899 4.652 5.070 . 0 0 "[ . 1 . 2 .]" 1
921 1 105 THR H 1 114 PHE H . . 3.400 2.791 2.525 3.124 . 0 0 "[ . 1 . 2 .]" 1
922 1 105 THR H 1 114 PHE HA . . 5.000 4.453 4.178 4.692 . 0 0 "[ . 1 . 2 .]" 1
923 1 105 THR H 1 114 PHE HB2 . . 3.800 3.299 2.745 3.806 0.006 7 0 "[ . 1 . 2 .]" 1
924 1 105 THR HA 1 106 ASP H . . 3.300 2.328 2.188 2.551 . 0 0 "[ . 1 . 2 .]" 1
925 1 105 THR HA 1 106 ASP HA . . 5.100 4.400 4.336 4.479 . 0 0 "[ . 1 . 2 .]" 1
926 1 105 THR HA 1 107 GLY QA . . 5.500 5.706 5.586 5.951 0.451 10 0 "[ . 1 . 2 .]" 1
927 1 105 THR HB 1 106 ASP H . . 4.500 4.048 3.767 4.394 . 0 0 "[ . 1 . 2 .]" 1
928 1 105 THR HB 1 111 GLY HA2 . . 4.900 4.675 4.121 5.156 0.256 18 0 "[ . 1 . 2 .]" 1
929 1 105 THR HB 1 111 GLY HA3 . . 4.900 3.020 2.447 3.897 . 0 0 "[ . 1 . 2 .]" 1
930 1 105 THR MG 1 106 ASP H . . 6.500 3.589 3.083 3.932 . 0 0 "[ . 1 . 2 .]" 1
931 1 105 THR MG 1 107 GLY H . . 6.800 2.669 2.056 3.828 . 0 0 "[ . 1 . 2 .]" 1
932 1 105 THR MG 1 107 GLY QA . . 7.000 3.027 2.505 3.916 . 0 0 "[ . 1 . 2 .]" 1
933 1 105 THR MG 1 110 LEU HA . . 7.000 4.718 3.674 5.954 . 0 0 "[ . 1 . 2 .]" 1
934 1 105 THR MG 1 110 LEU HB2 . . 6.700 4.929 3.246 6.282 . 0 0 "[ . 1 . 2 .]" 1
935 1 105 THR MG 1 111 GLY HA3 . . 6.700 2.847 2.272 3.659 . 0 0 "[ . 1 . 2 .]" 1
936 1 105 THR MG 1 112 ILE H . . 5.600 2.992 2.053 3.803 . 0 0 "[ . 1 . 2 .]" 1
937 1 105 THR MG 1 113 ASN HA . . 4.100 2.409 1.933 2.862 . 0 0 "[ . 1 . 2 .]" 1
938 1 105 THR MG 1 114 PHE H . . 5.300 3.419 2.776 3.826 . 0 0 "[ . 1 . 2 .]" 1
939 1 106 ASP H 1 106 ASP HA . . 3.000 2.928 2.623 2.983 . 0 0 "[ . 1 . 2 .]" 1
940 1 106 ASP H 1 106 ASP HB2 . . 3.800 3.435 2.612 3.786 . 0 0 "[ . 1 . 2 .]" 1
941 1 106 ASP H 1 106 ASP HB3 . . 3.300 2.874 2.138 3.684 0.384 2 0 "[ . 1 . 2 .]" 1
942 1 106 ASP H 1 107 GLY H . . 4.100 2.590 2.160 3.218 . 0 0 "[ . 1 . 2 .]" 1
943 1 106 ASP HA 1 107 GLY H . . 4.100 3.304 2.611 3.602 . 0 0 "[ . 1 . 2 .]" 1
944 1 106 ASP HB3 1 107 GLY H . . 5.100 4.010 2.369 4.715 . 0 0 "[ . 1 . 2 .]" 1
945 1 107 GLY QA 1 113 ASN HB2 . . 5.400 3.887 3.088 5.619 0.219 17 0 "[ . 1 . 2 .]" 1
946 1 107 GLY QA 1 148 GLN QB . . 5.900 4.708 2.660 5.460 . 0 0 "[ . 1 . 2 .]" 1
947 1 110 LEU HA 1 110 LEU HB3 . . 3.100 2.726 2.394 3.074 . 0 0 "[ . 1 . 2 .]" 1
948 1 110 LEU HA 1 110 LEU MD1 . . 3.700 3.599 2.246 4.011 0.311 11 0 "[ . 1 . 2 .]" 1
949 1 110 LEU HA 1 111 GLY H . . 3.900 2.884 2.143 3.616 . 0 0 "[ . 1 . 2 .]" 1
950 1 110 LEU HB2 1 111 GLY H . . 3.600 3.440 2.526 4.153 0.553 1 1 "[+ . 1 . 2 .]" 1
951 1 110 LEU HB3 1 111 GLY H . . 3.200 2.963 2.261 3.946 0.746 12 3 "[ . 1 + . 2* - .]" 1
952 1 110 LEU MD1 1 111 GLY H . . 5.900 4.540 3.126 5.163 . 0 0 "[ . 1 . 2 .]" 1
953 1 110 LEU MD1 1 111 GLY HA3 . . 7.000 5.686 3.251 6.410 . 0 0 "[ . 1 . 2 .]" 1
954 1 111 GLY HA2 1 112 ILE H . . 3.300 2.829 2.374 3.384 0.084 20 0 "[ . 1 . 2 .]" 1
955 1 111 GLY HA2 1 112 ILE HA . . 5.500 4.442 4.278 4.609 . 0 0 "[ . 1 . 2 .]" 1
956 1 111 GLY HA3 1 112 ILE H . . 3.400 2.461 2.209 2.947 . 0 0 "[ . 1 . 2 .]" 1
957 1 111 GLY HA3 1 112 ILE HA . . 5.700 4.547 4.408 4.735 . 0 0 "[ . 1 . 2 .]" 1
958 1 112 ILE H 1 112 ILE HB . . 3.800 2.749 2.312 3.875 0.075 20 0 "[ . 1 . 2 .]" 1
959 1 112 ILE H 1 112 ILE MD . . 4.400 3.062 1.877 3.874 . 0 0 "[ . 1 . 2 .]" 1
960 1 112 ILE H 1 112 ILE HG12 . . 3.900 3.306 2.194 4.486 0.586 23 1 "[ . 1 . 2 + .]" 1
961 1 112 ILE H 1 112 ILE MG . . 4.400 3.609 2.657 3.869 . 0 0 "[ . 1 . 2 .]" 1
962 1 112 ILE H 1 113 ASN H . . 4.900 4.311 3.872 4.545 . 0 0 "[ . 1 . 2 .]" 1
963 1 112 ILE HA 1 112 ILE MD . . 4.700 3.076 2.193 4.205 . 0 0 "[ . 1 . 2 .]" 1
964 1 112 ILE HA 1 113 ASN H . . 3.000 2.162 2.099 2.257 . 0 0 "[ . 1 . 2 .]" 1
965 1 112 ILE HB 1 113 ASN H . . 4.800 4.082 2.798 4.461 . 0 0 "[ . 1 . 2 .]" 1
966 1 112 ILE MD 1 113 ASN H . . 7.000 4.582 3.480 5.496 . 0 0 "[ . 1 . 2 .]" 1
967 1 112 ILE MD 1 142 TYR QD . . 7.200 4.121 2.675 5.477 . 0 0 "[ . 1 . 2 .]" 1
968 1 112 ILE MG 1 113 ASN H . . 6.100 3.150 2.348 4.268 . 0 0 "[ . 1 . 2 .]" 1
969 1 112 ILE MG 1 142 TYR QD . . 7.000 3.654 2.474 4.705 . 0 0 "[ . 1 . 2 .]" 1
970 1 113 ASN H 1 113 ASN HB2 . . 4.200 2.482 2.269 2.845 . 0 0 "[ . 1 . 2 .]" 1
971 1 113 ASN H 1 113 ASN HB3 . . 3.900 2.625 2.503 2.870 . 0 0 "[ . 1 . 2 .]" 1
972 1 113 ASN H 1 114 PHE H . . 4.800 4.358 4.118 4.536 . 0 0 "[ . 1 . 2 .]" 1
973 1 114 PHE H 1 114 PHE HB2 . . 3.400 2.403 2.101 2.858 . 0 0 "[ . 1 . 2 .]" 1
974 1 114 PHE H 1 114 PHE HB3 . . 3.900 2.599 2.249 3.158 . 0 0 "[ . 1 . 2 .]" 1
975 1 114 PHE H 1 115 LEU H . . 4.700 2.742 2.497 2.973 . 0 0 "[ . 1 . 2 .]" 1
976 1 114 PHE H 1 115 LEU HB2 . . 4.600 4.768 4.230 5.527 0.927 7 2 "[ . + 1 . 2 - .]" 1
977 1 114 PHE HA 1 115 LEU H . . 3.900 3.536 3.442 3.581 . 0 0 "[ . 1 . 2 .]" 1
978 1 114 PHE HA 1 118 ALA H . . 3.800 3.706 3.492 3.862 0.062 23 0 "[ . 1 . 2 .]" 1
979 1 114 PHE HB2 1 115 LEU H . . 4.200 3.997 3.558 4.213 0.013 10 0 "[ . 1 . 2 .]" 1
980 1 115 LEU H 1 115 LEU HB3 . . 4.400 2.784 2.247 3.328 . 0 0 "[ . 1 . 2 .]" 1
981 1 115 LEU H 1 116 TYR H . . 4.600 2.352 2.212 2.531 . 0 0 "[ . 1 . 2 .]" 1
982 1 115 LEU HA 1 118 ALA MB . . 4.100 2.668 2.264 2.957 . 0 0 "[ . 1 . 2 .]" 1
983 1 115 LEU HB3 1 116 TYR H . . 4.700 2.725 2.470 3.119 . 0 0 "[ . 1 . 2 .]" 1
984 1 115 LEU QD 1 118 ALA H . . 8.400 4.912 4.404 5.456 . 0 0 "[ . 1 . 2 .]" 1
985 1 115 LEU QD 1 119 THR H . . 8.100 4.177 3.217 4.875 . 0 0 "[ . 1 . 2 .]" 1
986 1 115 LEU QD 1 150 PHE HE1 . . 4.300 2.756 2.028 3.443 . 0 0 "[ . 1 . 2 .]" 1
987 1 116 TYR H 1 117 ALA H . . 3.300 2.535 2.293 2.696 . 0 0 "[ . 1 . 2 .]" 1
988 1 116 TYR H 1 119 THR H . . 5.300 4.733 4.535 4.939 . 0 0 "[ . 1 . 2 .]" 1
989 1 116 TYR HA 1 117 ALA H . . 4.100 3.566 3.510 3.620 . 0 0 "[ . 1 . 2 .]" 1
990 1 116 TYR HA 1 117 ALA MB . . 6.500 5.051 5.016 5.089 . 0 0 "[ . 1 . 2 .]" 1
991 1 116 TYR QB 1 117 ALA H . . 3.800 2.559 2.417 2.768 . 0 0 "[ . 1 . 2 .]" 1
992 1 117 ALA H 1 118 ALA H . . 3.300 2.795 2.619 2.988 . 0 0 "[ . 1 . 2 .]" 1
993 1 117 ALA H 1 118 ALA MB . . 6.300 4.421 4.260 4.622 . 0 0 "[ . 1 . 2 .]" 1
994 1 118 ALA H 1 119 THR H . . 3.500 2.914 2.737 3.115 . 0 0 "[ . 1 . 2 .]" 1
995 1 118 ALA HA 1 119 THR H . . 4.100 3.641 3.597 3.697 . 0 0 "[ . 1 . 2 .]" 1
996 1 118 ALA HA 1 122 LEU H . . 4.000 3.591 3.490 3.779 . 0 0 "[ . 1 . 2 .]" 1
997 1 118 ALA HA 1 122 LEU QD . . 7.700 2.787 2.223 3.581 . 0 0 "[ . 1 . 2 .]" 1
998 1 118 ALA MB 1 119 THR H . . 4.300 2.438 2.307 2.595 . 0 0 "[ . 1 . 2 .]" 1
999 1 118 ALA MB 1 121 GLU QG . . 6.300 4.802 4.618 5.021 . 0 0 "[ . 1 . 2 .]" 1
1000 1 119 THR H 1 119 THR HB . . 3.200 2.553 2.401 2.836 . 0 0 "[ . 1 . 2 .]" 1
1001 1 119 THR H 1 120 HIS H . . 3.000 2.869 2.668 3.096 0.096 12 0 "[ . 1 . 2 .]" 1
1002 1 119 THR HA 1 122 LEU H . . 4.200 3.726 3.479 3.849 . 0 0 "[ . 1 . 2 .]" 1
1003 1 119 THR HA 1 123 GLY H . . 4.200 3.647 3.292 3.930 . 0 0 "[ . 1 . 2 .]" 1
1004 1 119 THR HB 1 120 HIS H . . 3.000 2.670 2.493 2.888 . 0 0 "[ . 1 . 2 .]" 1
1005 1 119 THR MG 1 123 GLY H . . 6.900 4.214 4.003 4.394 . 0 0 "[ . 1 . 2 .]" 1
1006 1 119 THR MG 1 137 VAL QG . . 6.700 2.629 1.908 3.250 . 0 0 "[ . 1 . 2 .]" 1
1007 1 120 HIS H 1 121 GLU H . . 3.000 2.828 2.716 2.990 . 0 0 "[ . 1 . 2 .]" 1
1008 1 120 HIS H 1 122 LEU H . . 4.300 4.277 4.174 4.386 0.086 1 0 "[ . 1 . 2 .]" 1
1009 1 120 HIS H 1 137 VAL MG2 . . 6.600 4.251 3.353 5.523 . 0 0 "[ . 1 . 2 .]" 1
1010 1 120 HIS HA 1 137 VAL MG1 . . 5.900 4.322 2.340 5.107 . 0 0 "[ . 1 . 2 .]" 1
1011 1 121 GLU H 1 122 LEU H . . 3.300 2.289 2.224 2.374 . 0 0 "[ . 1 . 2 .]" 1
1012 1 121 GLU HA 1 123 GLY H . . 5.600 4.649 4.513 4.747 . 0 0 "[ . 1 . 2 .]" 1
1013 1 121 GLU HA 1 124 HIS H . . 4.200 3.561 3.437 3.693 . 0 0 "[ . 1 . 2 .]" 1
1014 1 121 GLU HA 1 125 SER H . . 4.900 4.523 4.296 4.766 . 0 0 "[ . 1 . 2 .]" 1
1015 1 121 GLU QB 1 122 LEU H . . 4.500 2.581 2.407 2.754 . 0 0 "[ . 1 . 2 .]" 1
1016 1 122 LEU H 1 122 LEU QB . . 3.400 2.253 2.181 2.335 . 0 0 "[ . 1 . 2 .]" 1
1017 1 122 LEU H 1 123 GLY H . . 3.400 2.779 2.613 2.962 . 0 0 "[ . 1 . 2 .]" 1
1018 1 122 LEU HA 1 125 SER H . . 3.900 2.862 2.658 3.074 . 0 0 "[ . 1 . 2 .]" 1
1019 1 122 LEU QB 1 123 GLY H . . 3.400 2.653 2.516 2.819 . 0 0 "[ . 1 . 2 .]" 1
1020 1 122 LEU QB 1 125 SER H . . 4.800 4.544 4.268 4.758 . 0 0 "[ . 1 . 2 .]" 1
1021 1 122 LEU QB 1 126 LEU H . . 4.500 4.386 4.175 4.570 0.070 11 0 "[ . 1 . 2 .]" 1
1022 1 122 LEU QD 1 126 LEU H . . 7.700 4.636 4.017 5.426 . 0 0 "[ . 1 . 2 .]" 1
1023 1 123 GLY H 1 123 GLY HA2 . . 3.000 2.623 2.584 2.671 . 0 0 "[ . 1 . 2 .]" 1
1024 1 123 GLY H 1 123 GLY HA3 . . 3.100 2.313 2.284 2.342 . 0 0 "[ . 1 . 2 .]" 1
1025 1 123 GLY H 1 124 HIS H . . 3.300 3.073 3.021 3.161 . 0 0 "[ . 1 . 2 .]" 1
1026 1 123 GLY H 1 126 LEU H . . 5.600 4.714 4.493 4.877 . 0 0 "[ . 1 . 2 .]" 1
1027 1 123 GLY HA2 1 124 HIS H . . 4.500 3.444 3.408 3.483 . 0 0 "[ . 1 . 2 .]" 1
1028 1 123 GLY HA3 1 124 HIS H . . 3.600 2.910 2.840 2.976 . 0 0 "[ . 1 . 2 .]" 1
1029 1 124 HIS H 1 124 HIS HB2 . . 3.200 2.593 2.497 2.671 . 0 0 "[ . 1 . 2 .]" 1
1030 1 124 HIS H 1 125 SER H . . 3.400 2.133 2.050 2.262 . 0 0 "[ . 1 . 2 .]" 1
1031 1 124 HIS H 1 126 LEU H . . 4.900 3.727 3.531 3.899 . 0 0 "[ . 1 . 2 .]" 1
1032 1 124 HIS H 1 127 GLY H . . 6.000 4.727 4.434 5.001 . 0 0 "[ . 1 . 2 .]" 1
1033 1 124 HIS H 1 128 MET H . . 5.200 4.922 4.601 5.485 0.285 11 0 "[ . 1 . 2 .]" 1
1034 1 124 HIS H 1 138 MET ME . . 6.200 4.905 3.923 5.725 . 0 0 "[ . 1 . 2 .]" 1
1035 1 124 HIS HA 1 125 SER H . . 3.800 3.564 3.469 3.687 . 0 0 "[ . 1 . 2 .]" 1
1036 1 124 HIS HA 1 126 LEU H . . 4.500 4.288 3.981 4.549 0.049 3 0 "[ . 1 . 2 .]" 1
1037 1 124 HIS HB2 1 125 SER H . . 3.600 2.884 2.604 3.286 . 0 0 "[ . 1 . 2 .]" 1
1038 1 125 SER H 1 126 LEU H . . 3.500 2.697 2.336 3.077 . 0 0 "[ . 1 . 2 .]" 1
1039 1 125 SER HA 1 126 LEU H . . 3.900 3.581 3.517 3.613 . 0 0 "[ . 1 . 2 .]" 1
1040 1 126 LEU H 1 126 LEU QB . . 3.700 2.114 2.025 2.276 . 0 0 "[ . 1 . 2 .]" 1
1041 1 126 LEU H 1 126 LEU QD . . 4.500 3.011 2.407 3.449 . 0 0 "[ . 1 . 2 .]" 1
1042 1 126 LEU H 1 127 GLY H . . 3.200 2.845 2.652 3.076 . 0 0 "[ . 1 . 2 .]" 1
1043 1 126 LEU H 1 128 MET H . . 4.400 4.419 3.848 4.878 0.478 11 0 "[ . 1 . 2 .]" 1
1044 1 126 LEU HA 1 126 LEU QD . . 3.700 2.007 1.937 2.084 . 0 0 "[ . 1 . 2 .]" 1
1045 1 126 LEU QB 1 127 GLY H . . 5.300 2.883 2.254 3.301 . 0 0 "[ . 1 . 2 .]" 1
1046 1 126 LEU QB 1 128 MET H . . 6.700 4.018 2.988 4.818 . 0 0 "[ . 1 . 2 .]" 1
1047 1 126 LEU QB 1 160 ILE MD . . 5.800 3.910 3.473 4.302 . 0 0 "[ . 1 . 2 .]" 1
1048 1 126 LEU HG 1 160 ILE MD . . 5.800 3.395 2.740 4.062 . 0 0 "[ . 1 . 2 .]" 1
1049 1 127 GLY H 1 128 MET QB . . 6.800 4.465 3.535 5.060 . 0 0 "[ . 1 . 2 .]" 1
1050 1 127 GLY HA2 1 128 MET H . . 3.600 2.959 2.396 3.570 . 0 0 "[ . 1 . 2 .]" 1
1051 1 127 GLY HA3 1 128 MET H . . 3.600 3.385 2.665 3.607 0.007 3 0 "[ . 1 . 2 .]" 1
1052 1 128 MET H 1 128 MET ME . . 3.800 2.970 2.317 3.268 . 0 0 "[ . 1 . 2 .]" 1
1053 1 128 MET HA 1 163 LEU QD . . 7.000 4.132 2.194 5.901 . 0 0 "[ . 1 . 2 .]" 1
1054 1 128 MET QB 1 129 GLY H . . 6.300 2.448 1.815 3.601 . 0 0 "[ . 1 . 2 .]" 1
1055 1 130 HIS HB2 1 131 SER H . . 3.600 3.768 3.423 4.113 0.513 24 2 "[ -. 1 . 2 +.]" 1
1056 1 130 HIS HB3 1 131 SER H . . 3.200 2.348 1.973 2.848 . 0 0 "[ . 1 . 2 .]" 1
1057 1 131 SER QB 1 138 MET H . . 5.600 4.329 3.233 5.208 . 0 0 "[ . 1 . 2 .]" 1
1058 1 132 SER H 1 133 ASP H . . 3.600 3.303 2.430 3.931 0.331 2 0 "[ . 1 . 2 .]" 1
1059 1 133 ASP H 1 133 ASP HB2 . . 3.100 2.998 2.528 3.355 0.255 14 0 "[ . 1 . 2 .]" 1
1060 1 133 ASP H 1 133 ASP HB3 . . 2.900 3.169 2.923 3.418 0.518 21 1 "[ . 1 . 2+ .]" 1
1061 1 133 ASP HA 1 136 ALA H . . 5.100 5.072 4.870 5.636 0.536 23 1 "[ . 1 . 2 + .]" 1
1062 1 133 ASP HB3 1 135 ASN H . . 2.800 2.952 2.583 3.637 0.837 16 1 "[ . 1 .+ 2 .]" 1
1063 1 133 ASP HB3 1 136 ALA H . . 3.200 3.103 2.788 3.751 0.551 23 1 "[ . 1 . 2 + .]" 1
1064 1 135 ASN H 1 135 ASN HB2 . . 3.000 2.718 2.398 3.485 0.485 23 0 "[ . 1 . 2 .]" 1
1065 1 135 ASN H 1 135 ASN HB3 . . 3.800 3.753 3.316 4.012 0.212 16 0 "[ . 1 . 2 .]" 1
1066 1 135 ASN H 1 136 ALA H . . 3.200 2.506 1.811 2.862 . 0 0 "[ . 1 . 2 .]" 1
1067 1 135 ASN H 1 136 ALA MB . . 5.100 3.766 3.072 4.145 . 0 0 "[ . 1 . 2 .]" 1
1068 1 135 ASN HB2 1 136 ALA H . . 3.900 4.238 2.751 4.729 0.829 23 3 "[ - . 1* . 2 + .]" 1
1069 1 135 ASN HB3 1 136 ALA H . . 4.900 4.432 3.680 4.554 . 0 0 "[ . 1 . 2 .]" 1
1070 1 136 ALA H 1 139 TYR H . . 4.700 4.279 3.949 4.618 . 0 0 "[ . 1 . 2 .]" 1
1071 1 136 ALA H 1 139 TYR QB . . 3.300 2.758 2.376 3.186 . 0 0 "[ . 1 . 2 .]" 1
1072 1 136 ALA HA 1 138 MET H . . 3.800 3.666 3.365 3.844 0.044 16 0 "[ . 1 . 2 .]" 1
1073 1 136 ALA MB 1 138 MET H . . 3.700 2.454 2.151 2.760 . 0 0 "[ . 1 . 2 .]" 1
1074 1 136 ALA MB 1 139 TYR H . . 3.700 2.715 2.421 2.985 . 0 0 "[ . 1 . 2 .]" 1
1075 1 136 ALA MB 1 156 ASP H . . 6.400 5.068 4.599 5.414 . 0 0 "[ . 1 . 2 .]" 1
1076 1 137 VAL MG1 1 138 MET H . . 6.400 2.765 2.095 4.202 . 0 0 "[ . 1 . 2 .]" 1
1077 1 137 VAL MG1 1 152 LEU HG . . 4.900 3.749 3.248 4.087 . 0 0 "[ . 1 . 2 .]" 1
1078 1 137 VAL MG2 1 138 MET H . . 6.700 3.716 2.344 4.182 . 0 0 "[ . 1 . 2 .]" 1
1079 1 138 MET H 1 138 MET HB2 . . 2.900 2.377 2.209 2.524 . 0 0 "[ . 1 . 2 .]" 1
1080 1 138 MET H 1 138 MET HB3 . . 3.700 3.379 2.682 3.696 . 0 0 "[ . 1 . 2 .]" 1
1081 1 138 MET H 1 138 MET ME . . 4.600 3.328 2.572 3.835 . 0 0 "[ . 1 . 2 .]" 1
1082 1 138 MET H 1 139 TYR H . . 4.100 2.788 2.572 2.920 . 0 0 "[ . 1 . 2 .]" 1
1083 1 138 MET H 1 139 TYR HA . . 6.000 4.809 4.471 5.203 . 0 0 "[ . 1 . 2 .]" 1
1084 1 138 MET HA 1 138 MET ME . . 4.900 3.070 2.085 4.292 . 0 0 "[ . 1 . 2 .]" 1
1085 1 138 MET HA 1 139 TYR H . . 4.100 3.193 2.944 3.485 . 0 0 "[ . 1 . 2 .]" 1
1086 1 138 MET HB2 1 138 MET ME . . 4.700 2.674 2.145 4.033 . 0 0 "[ . 1 . 2 .]" 1
1087 1 138 MET HB3 1 138 MET ME . . 4.100 3.581 3.344 3.937 . 0 0 "[ . 1 . 2 .]" 1
1088 1 139 TYR H 1 139 TYR QB . . 3.000 2.215 2.119 2.305 . 0 0 "[ . 1 . 2 .]" 1
1089 1 141 THR H 1 141 THR MG . . 4.800 3.549 1.953 4.199 . 0 0 "[ . 1 . 2 .]" 1
1090 1 141 THR HA 1 141 THR HB . . 3.000 2.893 2.346 3.079 0.079 2 0 "[ . 1 . 2 .]" 1
1091 1 142 TYR H 1 142 TYR HB2 . . 4.200 2.531 2.098 3.430 . 0 0 "[ . 1 . 2 .]" 1
1092 1 142 TYR HA 1 143 GLY H . . 3.100 2.252 2.080 2.725 . 0 0 "[ . 1 . 2 .]" 1
1093 1 142 TYR QD 1 143 GLY H . . 8.000 3.458 1.921 4.630 . 0 0 "[ . 1 . 2 .]" 1
1094 1 142 TYR QE 1 143 GLY H . . 7.400 5.058 3.922 6.042 . 0 0 "[ . 1 . 2 .]" 1
1095 1 143 GLY H 1 144 ASN H . . 4.200 3.761 2.974 4.310 0.110 2 0 "[ . 1 . 2 .]" 1
1096 1 143 GLY H 1 147 PRO QG . . 7.000 5.815 3.799 6.747 . 0 0 "[ . 1 . 2 .]" 1
1097 1 143 GLY HA2 1 144 ASN H . . 3.300 2.641 2.174 3.617 0.317 15 0 "[ . 1 . 2 .]" 1
1098 1 143 GLY HA3 1 144 ASN H . . 2.900 2.879 2.192 3.497 0.597 19 4 "[ . 1 . * +- * .]" 1
1099 1 144 ASN H 1 144 ASN HB2 . . 4.300 2.765 2.088 3.505 . 0 0 "[ . 1 . 2 .]" 1
1100 1 144 ASN H 1 145 GLY H . . 3.400 2.807 2.144 3.612 0.212 25 0 "[ . 1 . 2 .]" 1
1101 1 144 ASN HA 1 145 GLY H . . 4.100 3.539 3.382 3.600 . 0 0 "[ . 1 . 2 .]" 1
1102 1 144 ASN HB2 1 145 GLY H . . 3.000 3.102 2.497 3.603 0.603 2 2 "[ + . 1 - . 2 .]" 1
1103 1 144 ASN HB3 1 145 GLY H . . 2.900 2.932 2.219 3.689 0.789 23 2 "[ . 1 - . 2 + .]" 1
1104 1 146 ASP HA 1 149 ASN H . . 5.000 4.742 4.275 5.135 0.135 6 0 "[ . 1 . 2 .]" 1
1105 1 146 ASP HA 1 149 ASN QD . . 5.100 5.107 4.468 5.551 0.451 14 0 "[ . 1 . 2 .]" 1
1106 1 148 GLN HA 1 149 ASN H . . 4.100 3.508 3.282 3.634 . 0 0 "[ . 1 . 2 .]" 1
1107 1 148 GLN QB 1 149 ASN H . . 7.000 2.910 2.435 3.603 . 0 0 "[ . 1 . 2 .]" 1
1108 1 149 ASN H 1 149 ASN HB2 . . 3.400 3.337 2.421 4.034 0.634 3 3 "[- + . 1 . * .]" 1
1109 1 149 ASN H 1 150 PHE H . . 4.100 3.431 2.382 4.040 . 0 0 "[ . 1 . 2 .]" 1
1110 1 149 ASN H 1 150 PHE QB . . 7.000 4.620 3.654 5.685 . 0 0 "[ . 1 . 2 .]" 1
1111 1 149 ASN HA 1 150 PHE H . . 3.300 2.428 2.115 3.332 0.032 17 0 "[ . 1 . 2 .]" 1
1112 1 149 ASN HB3 1 150 PHE H . . 4.400 4.438 4.092 4.715 0.315 14 0 "[ . 1 . 2 .]" 1
1113 1 150 PHE H 1 150 PHE QB . . 3.800 2.693 2.368 3.104 . 0 0 "[ . 1 . 2 .]" 1
1114 1 150 PHE H 1 150 PHE QE . . 5.000 4.260 3.789 4.576 . 0 0 "[ . 1 . 2 .]" 1
1115 1 150 PHE HD2 1 151 LYS H . . 4.500 3.971 2.666 4.925 0.425 23 0 "[ . 1 . 2 .]" 1
1116 1 150 PHE QE 1 152 LEU MD2 . . 9.000 5.628 4.471 6.582 . 0 0 "[ . 1 . 2 .]" 1
1117 1 151 LYS H 1 151 LYS QB . . 3.400 3.122 2.779 3.540 0.140 12 0 "[ . 1 . 2 .]" 1
1118 1 151 LYS H 1 151 LYS HD2 . . 3.500 3.019 1.838 4.098 0.598 12 1 "[ . 1 + . 2 .]" 1
1119 1 151 LYS H 1 151 LYS HD3 . . 3.100 3.122 2.384 3.548 0.448 21 0 "[ . 1 . 2 .]" 1
1120 1 151 LYS H 1 152 LEU H . . 3.900 3.287 2.599 4.511 0.611 14 2 "[ . 1 +. - .]" 1
1121 1 151 LYS H 1 152 LEU HA . . 5.400 5.003 4.133 5.546 0.146 24 0 "[ . 1 . 2 .]" 1
1122 1 151 LYS QB 1 152 LEU H . . 4.300 3.733 2.133 4.055 . 0 0 "[ . 1 . 2 .]" 1
1123 1 151 LYS QB 1 152 LEU HG . . 5.800 5.801 5.230 6.346 0.546 17 3 "[ . 1 .*+ 2 -.]" 1
1124 1 152 LEU H 1 152 LEU HA . . 3.000 2.381 2.201 2.929 . 0 0 "[ . 1 . 2 .]" 1
1125 1 152 LEU H 1 152 LEU QB . . 3.800 3.043 2.345 3.498 . 0 0 "[ . 1 . 2 .]" 1
1126 1 152 LEU H 1 152 LEU MD1 . . 4.900 2.350 1.863 3.150 . 0 0 "[ . 1 . 2 .]" 1
1127 1 152 LEU H 1 152 LEU MD2 . . 3.900 4.228 3.946 4.813 0.913 9 3 "[- * . +1 . 2 .]" 1
1128 1 152 LEU H 1 152 LEU HG . . 3.600 2.895 2.535 3.670 0.070 14 0 "[ . 1 . 2 .]" 1
1129 1 152 LEU HA 1 152 LEU MD2 . . 3.600 3.606 3.440 3.710 0.110 11 0 "[ . 1 . 2 .]" 1
1130 1 152 LEU HA 1 152 LEU HG . . 3.500 2.472 2.341 2.637 . 0 0 "[ . 1 . 2 .]" 1
1131 1 152 LEU QB 1 157 ILE H . . 6.800 3.428 2.588 3.854 . 0 0 "[ . 1 . 2 .]" 1
1132 1 152 LEU MD1 1 157 ILE HB . . 7.000 6.867 6.037 7.461 0.461 6 0 "[ . 1 . 2 .]" 1
1133 1 152 LEU MD1 1 157 ILE MD . . 7.200 3.758 3.412 4.210 . 0 0 "[ . 1 . 2 .]" 1
1134 1 152 LEU MD2 1 157 ILE H . . 6.300 4.280 3.701 4.711 . 0 0 "[ . 1 . 2 .]" 1
1135 1 152 LEU HG 1 157 ILE MD . . 6.100 4.406 4.086 5.006 . 0 0 "[ . 1 . 2 .]" 1
1136 1 153 SER H 1 157 ILE H . . 4.700 5.110 4.453 5.525 0.825 18 11 "[** ** *- ** + 2** .]" 1
1137 1 154 GLN HA 1 156 ASP H . . 4.700 3.953 3.622 4.345 . 0 0 "[ . 1 . 2 .]" 1
1138 1 154 GLN HA 1 157 ILE MD . . 7.000 3.907 3.388 5.035 . 0 0 "[ . 1 . 2 .]" 1
1139 1 154 GLN QB 1 158 LYS QB . . 3.000 3.527 2.251 3.953 0.953 25 17 "[********** *- * * ** +]" 1
1140 1 155 ASP HA 1 156 ASP H . . 4.000 3.509 3.405 3.592 . 0 0 "[ . 1 . 2 .]" 1
1141 1 155 ASP HA 1 158 LYS H . . 5.200 3.837 3.537 4.594 . 0 0 "[ . 1 . 2 .]" 1
1142 1 155 ASP HA 1 158 LYS QB . . 4.100 2.737 2.370 4.117 0.017 23 0 "[ . 1 . 2 .]" 1
1143 1 155 ASP QB 1 156 ASP H . . 3.300 3.285 2.364 3.584 0.284 23 0 "[ . 1 . 2 .]" 1
1144 1 156 ASP H 1 156 ASP HB2 . . 3.100 2.276 2.107 2.940 . 0 0 "[ . 1 . 2 .]" 1
1145 1 156 ASP H 1 156 ASP HB3 . . 3.300 3.090 2.305 3.536 0.236 23 0 "[ . 1 . 2 .]" 1
1146 1 156 ASP H 1 157 ILE H . . 3.100 2.502 2.333 2.956 . 0 0 "[ . 1 . 2 .]" 1
1147 1 156 ASP H 1 157 ILE HB . . 4.600 4.285 3.961 4.688 0.088 23 0 "[ . 1 . 2 .]" 1
1148 1 156 ASP H 1 157 ILE MD . . 7.000 4.272 3.749 5.677 . 0 0 "[ . 1 . 2 .]" 1
1149 1 156 ASP HA 1 159 GLY H . . 4.200 3.527 3.323 4.084 . 0 0 "[ . 1 . 2 .]" 1
1150 1 156 ASP HB2 1 157 ILE H . . 3.500 3.055 2.019 3.802 0.302 22 0 "[ . 1 . 2 .]" 1
1151 1 156 ASP HB2 1 160 ILE H . . 5.700 5.992 5.377 6.235 0.535 13 4 "[ - . * 1 + . * 2 .]" 1
1152 1 156 ASP HB3 1 157 ILE H . . 3.800 2.518 2.173 3.045 . 0 0 "[ . 1 . 2 .]" 1
1153 1 157 ILE H 1 157 ILE HB . . 4.000 2.256 2.072 2.488 . 0 0 "[ . 1 . 2 .]" 1
1154 1 157 ILE H 1 157 ILE MD . . 4.400 2.519 2.031 3.566 . 0 0 "[ . 1 . 2 .]" 1
1155 1 157 ILE H 1 158 LYS H . . 3.500 2.828 2.414 3.272 . 0 0 "[ . 1 . 2 .]" 1
1156 1 157 ILE H 1 158 LYS HA . . 6.000 5.399 5.046 5.759 . 0 0 "[ . 1 . 2 .]" 1
1157 1 157 ILE H 1 159 GLY H . . 4.800 4.194 3.885 4.474 . 0 0 "[ . 1 . 2 .]" 1
1158 1 157 ILE HA 1 160 ILE H . . 4.200 3.545 3.221 3.873 . 0 0 "[ . 1 . 2 .]" 1
1159 1 157 ILE HA 1 160 ILE MG . . 6.600 3.387 2.860 3.785 . 0 0 "[ . 1 . 2 .]" 1
1160 1 157 ILE HB 1 158 LYS H . . 3.800 2.895 2.468 3.117 . 0 0 "[ . 1 . 2 .]" 1
1161 1 157 ILE HB 1 158 LYS HA . . 6.000 4.839 4.424 5.191 . 0 0 "[ . 1 . 2 .]" 1
1162 1 157 ILE HB 1 158 LYS QB . . 5.500 4.397 3.910 4.621 . 0 0 "[ . 1 . 2 .]" 1
1163 1 157 ILE MD 1 158 LYS H . . 7.000 4.449 4.213 4.894 . 0 0 "[ . 1 . 2 .]" 1
1164 1 157 ILE MG 1 158 LYS H . . 7.000 2.924 2.389 3.455 . 0 0 "[ . 1 . 2 .]" 1
1165 1 158 LYS H 1 158 LYS HA . . 3.000 2.824 2.734 2.950 . 0 0 "[ . 1 . 2 .]" 1
1166 1 158 LYS H 1 158 LYS QB . . 2.800 2.212 2.140 2.418 . 0 0 "[ . 1 . 2 .]" 1
1167 1 158 LYS H 1 159 GLY H . . 3.200 2.716 2.149 2.927 . 0 0 "[ . 1 . 2 .]" 1
1168 1 158 LYS H 1 160 ILE H . . 4.900 4.373 3.910 4.607 . 0 0 "[ . 1 . 2 .]" 1
1169 1 158 LYS HA 1 159 GLY H . . 5.200 3.571 3.481 3.629 . 0 0 "[ . 1 . 2 .]" 1
1170 1 158 LYS HA 1 160 ILE H . . 5.200 4.841 4.611 5.066 . 0 0 "[ . 1 . 2 .]" 1
1171 1 158 LYS HA 1 161 GLN H . . 4.600 3.655 3.227 3.934 . 0 0 "[ . 1 . 2 .]" 1
1172 1 158 LYS HA 1 161 GLN QB . . 4.000 3.119 2.147 4.157 0.157 18 0 "[ . 1 . 2 .]" 1
1173 1 158 LYS HA 1 162 LYS H . . 4.900 4.200 3.876 4.662 . 0 0 "[ . 1 . 2 .]" 1
1174 1 158 LYS QB 1 159 GLY H . . 3.200 2.687 2.421 3.018 . 0 0 "[ . 1 . 2 .]" 1
1175 1 158 LYS QB 1 159 GLY QA . . 4.200 3.818 3.609 3.999 . 0 0 "[ . 1 . 2 .]" 1
1176 1 158 LYS QG 1 161 GLN H . . 7.000 5.333 4.992 5.555 . 0 0 "[ . 1 . 2 .]" 1
1177 1 159 GLY H 1 160 ILE H . . 3.600 2.643 2.465 2.826 . 0 0 "[ . 1 . 2 .]" 1
1178 1 159 GLY H 1 161 GLN H . . 4.500 4.178 3.983 4.372 . 0 0 "[ . 1 . 2 .]" 1
1179 1 159 GLY H 1 162 LYS H . . 4.800 4.646 4.513 4.783 . 0 0 "[ . 1 . 2 .]" 1
1180 1 159 GLY QA 1 160 ILE H . . 3.900 2.589 2.502 2.696 . 0 0 "[ . 1 . 2 .]" 1
1181 1 159 GLY QA 1 162 LYS H . . 3.800 3.511 3.280 3.660 . 0 0 "[ . 1 . 2 .]" 1
1182 1 159 GLY QA 1 162 LYS HB3 . . 3.700 2.805 2.544 4.054 0.354 10 0 "[ . 1 . 2 .]" 1
1183 1 159 GLY QA 1 163 LEU H . . 4.200 4.085 3.714 4.332 0.132 5 0 "[ . 1 . 2 .]" 1
1184 1 160 ILE H 1 160 ILE HB . . 2.900 2.199 2.071 2.386 . 0 0 "[ . 1 . 2 .]" 1
1185 1 160 ILE H 1 160 ILE MD . . 4.700 3.797 3.380 4.114 . 0 0 "[ . 1 . 2 .]" 1
1186 1 160 ILE H 1 160 ILE MG . . 4.500 3.652 3.445 3.751 . 0 0 "[ . 1 . 2 .]" 1
1187 1 160 ILE H 1 161 GLN H . . 3.900 3.016 2.854 3.215 . 0 0 "[ . 1 . 2 .]" 1
1188 1 160 ILE H 1 162 LYS H . . 4.700 4.073 3.954 4.211 . 0 0 "[ . 1 . 2 .]" 1
1189 1 160 ILE H 1 163 LEU H . . 5.500 4.692 4.506 4.898 . 0 0 "[ . 1 . 2 .]" 1
1190 1 160 ILE HA 1 160 ILE MD . . 4.600 2.125 2.021 2.215 . 0 0 "[ . 1 . 2 .]" 1
1191 1 160 ILE HA 1 162 LYS H . . 5.000 3.973 3.764 4.290 . 0 0 "[ . 1 . 2 .]" 1
1192 1 160 ILE HA 1 163 LEU H . . 3.200 3.244 3.004 3.477 0.277 10 0 "[ . 1 . 2 .]" 1
1193 1 160 ILE HA 1 163 LEU QB . . 3.400 2.409 2.077 2.884 . 0 0 "[ . 1 . 2 .]" 1
1194 1 160 ILE HA 1 163 LEU QD . . 5.800 2.885 2.051 3.973 . 0 0 "[ . 1 . 2 .]" 1
1195 1 160 ILE HB 1 161 GLN H . . 3.000 2.807 2.564 3.021 0.021 21 0 "[ . 1 . 2 .]" 1
1196 1 160 ILE MD 1 163 LEU QB . . 4.000 3.126 2.685 3.732 . 0 0 "[ . 1 . 2 .]" 1
1197 1 160 ILE MD 1 163 LEU QD . . 5.800 2.877 2.113 4.292 . 0 0 "[ . 1 . 2 .]" 1
1198 1 160 ILE MD 1 164 TYR QD . . 4.200 3.214 2.509 3.810 . 0 0 "[ . 1 . 2 .]" 1
1199 1 160 ILE MG 1 161 GLN H . . 5.000 2.730 2.218 3.050 . 0 0 "[ . 1 . 2 .]" 1
1200 1 161 GLN H 1 161 GLN QB . . 3.300 2.363 2.181 2.561 . 0 0 "[ . 1 . 2 .]" 1
1201 1 161 GLN H 1 161 GLN HG2 . . 4.000 3.105 2.358 3.867 . 0 0 "[ . 1 . 2 .]" 1
1202 1 161 GLN H 1 161 GLN HG3 . . 3.300 3.168 2.354 3.849 0.549 21 2 "[ - 1 . 2+ .]" 1
1203 1 161 GLN H 1 162 LYS H . . 3.000 2.718 2.568 2.884 . 0 0 "[ . 1 . 2 .]" 1
1204 1 161 GLN H 1 163 LEU H . . 4.400 4.131 3.886 4.380 . 0 0 "[ . 1 . 2 .]" 1
1205 1 161 GLN HA 1 162 LYS H . . 4.500 3.443 3.352 3.556 . 0 0 "[ . 1 . 2 .]" 1
1206 1 161 GLN HA 1 163 LEU H . . 4.300 4.137 3.697 4.557 0.257 21 0 "[ . 1 . 2 .]" 1
1207 1 162 LYS H 1 162 LYS QB . . 3.200 2.299 2.228 2.468 . 0 0 "[ . 1 . 2 .]" 1
1208 1 162 LYS H 1 163 LEU H . . 2.900 2.275 2.017 2.493 . 0 0 "[ . 1 . 2 .]" 1
1209 1 162 LYS H 1 163 LEU QB . . 5.100 4.071 3.557 4.355 . 0 0 "[ . 1 . 2 .]" 1
1210 1 162 LYS H 1 163 LEU QD . . 8.200 4.347 3.715 5.383 . 0 0 "[ . 1 . 2 .]" 1
1211 1 162 LYS H 1 164 TYR H . . 4.500 4.060 3.773 4.354 . 0 0 "[ . 1 . 2 .]" 1
1212 1 162 LYS HA 1 163 LEU H . . 4.000 3.531 3.418 3.645 . 0 0 "[ . 1 . 2 .]" 1
1213 1 162 LYS HA 1 163 LEU HA . . 5.700 4.786 4.668 4.988 . 0 0 "[ . 1 . 2 .]" 1
1214 1 162 LYS QB 1 163 LEU H . . 4.300 2.893 2.451 3.204 . 0 0 "[ . 1 . 2 .]" 1
1215 1 162 LYS QG 1 163 LEU H . . 4.500 4.031 3.569 4.250 . 0 0 "[ . 1 . 2 .]" 1
1216 1 163 LEU H 1 163 LEU QB . . 3.100 2.220 1.961 2.412 . 0 0 "[ . 1 . 2 .]" 1
1217 1 163 LEU H 1 163 LEU HG . . 4.200 3.731 2.528 4.372 0.172 25 0 "[ . 1 . 2 .]" 1
1218 1 163 LEU H 1 164 TYR H . . 3.300 2.612 2.239 3.058 . 0 0 "[ . 1 . 2 .]" 1
1219 1 163 LEU H 1 165 GLY H . . 4.100 3.853 3.325 4.351 0.251 22 0 "[ . 1 . 2 .]" 1
1220 1 163 LEU HA 1 163 LEU QD . . 4.200 2.516 2.047 3.026 . 0 0 "[ . 1 . 2 .]" 1
1221 1 163 LEU HA 1 164 TYR H . . 4.000 3.603 3.556 3.660 . 0 0 "[ . 1 . 2 .]" 1
1222 1 163 LEU QB 1 164 TYR H . . 3.100 2.551 2.377 2.770 . 0 0 "[ . 1 . 2 .]" 1
1223 1 163 LEU QD 1 164 TYR H . . 7.500 4.005 3.485 4.207 . 0 0 "[ . 1 . 2 .]" 1
1224 1 163 LEU QD 1 164 TYR QE . . 9.000 3.910 2.129 6.384 . 0 0 "[ . 1 . 2 .]" 1
1225 1 163 LEU HG 1 164 TYR H . . 4.800 4.871 4.382 5.223 0.423 25 0 "[ . 1 . 2 .]" 1
1226 1 164 TYR H 1 164 TYR QB . . 3.700 2.698 2.327 3.031 . 0 0 "[ . 1 . 2 .]" 1
1227 1 164 TYR H 1 164 TYR QD . . 5.500 2.589 2.312 3.481 . 0 0 "[ . 1 . 2 .]" 1
1228 1 164 TYR H 1 164 TYR QE . . 4.800 4.602 4.279 4.953 0.153 18 0 "[ . 1 . 2 .]" 1
1229 1 164 TYR H 1 165 GLY H . . 2.800 2.413 2.019 3.023 0.223 11 0 "[ . 1 . 2 .]" 1
1230 1 164 TYR H 1 165 GLY HA2 . . 4.700 4.730 4.056 5.119 0.419 11 0 "[ . 1 . 2 .]" 1
1231 1 164 TYR QB 1 165 GLY H . . 4.200 3.698 2.348 4.084 . 0 0 "[ . 1 . 2 .]" 1
1232 1 165 GLY H 1 166 LYS H . . 5.500 3.679 2.597 4.487 . 0 0 "[ . 1 . 2 .]" 1
1233 1 165 GLY H 1 166 LYS QG . . 6.800 5.467 4.773 6.268 . 0 0 "[ . 1 . 2 .]" 1
1234 1 165 GLY HA2 1 166 LYS H . . 3.900 3.065 2.185 3.586 . 0 0 "[ . 1 . 2 .]" 1
1235 1 165 GLY HA3 1 166 LYS H . . 3.900 2.454 2.117 3.263 . 0 0 "[ . 1 . 2 .]" 1
1236 1 166 LYS H 1 166 LYS HB2 . . 3.100 2.919 2.315 3.470 0.370 13 0 "[ . 1 . 2 .]" 1
1237 1 166 LYS H 1 167 ARG H . . 3.100 2.421 1.967 3.191 0.091 17 0 "[ . 1 . 2 .]" 1
1238 1 166 LYS HA 1 166 LYS HB2 . . 3.100 2.985 2.634 3.087 . 0 0 "[ . 1 . 2 .]" 1
1239 1 166 LYS HB2 1 167 ARG H . . 3.000 2.892 2.341 3.633 0.633 20 1 "[ . 1 . + .]" 1
1240 1 166 LYS HB3 1 167 ARG H . . 3.300 3.024 2.217 3.954 0.654 5 1 "[ + 1 . 2 .]" 1
1241 1 166 LYS QG 1 167 ARG H . . 6.300 4.272 3.840 4.571 . 0 0 "[ . 1 . 2 .]" 1
1242 1 167 ARG H 1 167 ARG QG . . 4.200 3.343 2.420 3.937 . 0 0 "[ . 1 . 2 .]" 1
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