NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
573872 |
2ml6   |
19807 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ml6
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 2258
_Distance_constraint_stats_list.Viol_count 5020
_Distance_constraint_stats_list.Viol_total 8483.895
_Distance_constraint_stats_list.Viol_max 0.995
_Distance_constraint_stats_list.Viol_rms 0.0424
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0094
_Distance_constraint_stats_list.Viol_average_violations_only 0.0845
_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 1 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ALA 0.142 0.092 9 0 "[ . 1 . 2]"
1 3 GLU 4.331 0.693 17 2 "[ . - 1 . + 2]"
1 4 GLU 10.217 0.735 14 3 "[ . 1 * +* 2]"
1 5 GLU 5.211 0.140 15 0 "[ . 1 . 2]"
1 6 ASP 2.130 0.085 13 0 "[ . 1 . 2]"
1 7 PHE 2.932 0.111 18 0 "[ . 1 . 2]"
1 8 LYS 3.288 0.101 19 0 "[ . 1 . 2]"
1 9 THR 4.550 0.122 11 0 "[ . 1 . 2]"
1 10 PHE 3.911 0.111 11 0 "[ . 1 . 2]"
1 11 LEU 2.125 0.096 12 0 "[ . 1 . 2]"
1 12 GLN 1.612 0.129 3 0 "[ . 1 . 2]"
1 13 LYS 3.888 0.367 18 0 "[ . 1 . 2]"
1 14 PHE 4.644 0.105 12 0 "[ . 1 . 2]"
1 15 THR 6.256 0.633 6 2 "[ .+ - 1 . 2]"
1 16 SER 1.480 0.093 20 0 "[ . 1 . 2]"
1 17 SER 3.471 0.664 1 1 "[+ . 1 . 2]"
1 18 ALA 2.853 0.462 8 0 "[ . 1 . 2]"
1 19 SER 1.214 0.088 11 0 "[ . 1 . 2]"
1 20 PHE 1.011 0.097 11 0 "[ . 1 . 2]"
1 21 GLN 9.927 0.995 6 2 "[ .+ - 1 . 2]"
1 22 TYR 6.183 0.576 6 2 "[ .+ - 1 . 2]"
1 23 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ARG 2.171 0.088 13 0 "[ . 1 . 2]"
1 25 ILE 5.896 0.133 7 0 "[ . 1 . 2]"
1 26 LYS 1.274 0.114 1 0 "[ . 1 . 2]"
1 27 PHE 2.829 0.319 4 0 "[ . 1 . 2]"
1 28 PRO 3.013 0.105 16 0 "[ . 1 . 2]"
1 29 LEU 12.589 0.644 20 3 "[ . * 1 -. +]"
1 30 LYS 6.626 0.594 17 1 "[ . 1 . + 2]"
1 31 SER 0.698 0.091 9 0 "[ . 1 . 2]"
1 32 PRO 1.978 0.088 16 0 "[ . 1 . 2]"
1 33 ILE 9.638 0.880 3 1 "[ + . 1 . 2]"
1 34 ALA 3.131 0.101 4 0 "[ . 1 . 2]"
1 35 LEU 7.369 0.490 15 0 "[ . 1 . 2]"
1 36 LEU 4.459 0.142 8 0 "[ . 1 . 2]"
1 37 LYS 5.083 0.105 17 0 "[ . 1 . 2]"
1 38 ASP 3.520 0.325 3 0 "[ . 1 . 2]"
1 39 ASP 3.094 0.086 5 0 "[ . 1 . 2]"
1 40 GLY 3.343 0.142 8 0 "[ . 1 . 2]"
1 41 GLU 6.659 0.187 16 0 "[ . 1 . 2]"
1 42 THR 5.850 0.151 2 0 "[ . 1 . 2]"
1 43 GLU 2.739 0.116 1 0 "[ . 1 . 2]"
1 44 GLN 8.561 0.122 4 0 "[ . 1 . 2]"
1 45 THR 7.904 0.119 6 0 "[ . 1 . 2]"
1 46 PHE 5.699 0.219 19 0 "[ . 1 . 2]"
1 47 PRO 1.683 0.219 19 0 "[ . 1 . 2]"
1 48 PHE 14.782 0.880 3 4 "[ + . * 1 -. *]"
1 49 THR 2.743 0.105 16 0 "[ . 1 . 2]"
1 50 ARG 2.638 0.776 7 2 "[ . + 1 -. 2]"
1 51 GLU 3.724 0.402 3 0 "[ . 1 . 2]"
1 52 LYS 5.049 0.730 14 2 "[ . 1- +. 2]"
1 53 TRP 5.955 0.095 5 0 "[ . 1 . 2]"
1 54 ALA 7.545 0.683 1 3 "[+ - . 1 * . 2]"
1 55 LEU 7.127 0.467 13 0 "[ . 1 . 2]"
1 56 LEU 3.724 0.797 9 2 "[ . -+1 . 2]"
1 57 ASP 4.197 0.659 7 1 "[ . + 1 . 2]"
1 58 GLU 10.842 0.900 18 6 "[ - .* 1 * . *+*2]"
1 59 GLU 7.688 0.900 18 7 "[ - .** 1 * . *+*2]"
1 60 THR 2.091 0.123 20 0 "[ . 1 . 2]"
1 61 LEU 7.050 0.291 20 0 "[ . 1 . 2]"
1 62 LYS 11.738 0.398 20 0 "[ . 1 . 2]"
1 63 GLU 5.430 0.398 20 0 "[ . 1 . 2]"
1 64 GLY 3.512 0.497 18 0 "[ . 1 . 2]"
1 65 ARG 10.250 0.927 3 7 "[* +** * 1- . * 2]"
1 66 THR 8.415 0.927 3 7 "[* +** * 1- . * 2]"
1 67 THR 3.443 0.114 10 0 "[ . 1 . 2]"
1 68 GLU 2.411 0.106 1 0 "[ . 1 . 2]"
1 69 GLU 2.755 0.106 1 0 "[ . 1 . 2]"
1 70 GLU 9.585 0.511 14 1 "[ . 1 +. 2]"
1 71 GLY 1.181 0.104 13 0 "[ . 1 . 2]"
1 72 GLY 4.707 0.467 7 0 "[ . 1 . 2]"
1 73 THR 6.505 0.467 7 0 "[ . 1 . 2]"
1 74 TYR 8.462 0.124 1 0 "[ . 1 . 2]"
1 75 ILE 7.399 0.330 14 0 "[ . 1 . 2]"
1 76 SER 6.874 0.704 18 2 "[ . 1 . + -]"
1 77 HIS 3.296 0.174 11 0 "[ . 1 . 2]"
1 78 PHE 5.519 0.105 14 0 "[ . 1 . 2]"
1 79 THR 2.443 0.221 11 0 "[ . 1 . 2]"
1 80 VAL 4.365 0.319 2 0 "[ . 1 . 2]"
1 81 ASN 9.553 0.436 2 0 "[ . 1 . 2]"
1 82 GLU 4.394 0.326 5 0 "[ . 1 . 2]"
1 83 PRO 1.711 0.096 19 0 "[ . 1 . 2]"
1 84 ALA 3.202 0.329 1 0 "[ . 1 . 2]"
1 85 HIS 2.300 0.329 1 0 "[ . 1 . 2]"
1 86 LYS 7.310 0.727 13 1 "[ . 1 + . 2]"
1 87 GLU 0.567 0.084 1 0 "[ . 1 . 2]"
1 88 PHE 3.633 0.119 17 0 "[ . 1 . 2]"
1 89 GLU 6.204 0.360 2 0 "[ . 1 . 2]"
1 90 ALA 10.397 0.821 18 2 "[ . 1 . + -]"
1 91 GLY 2.310 0.096 14 0 "[ . 1 . 2]"
1 92 TYR 4.255 0.097 14 0 "[ . 1 . 2]"
1 93 ASP 2.149 0.330 14 0 "[ . 1 . 2]"
1 94 GLU 3.719 0.725 10 1 "[ . + . 2]"
1 95 SER 0.994 0.188 10 0 "[ . 1 . 2]"
1 96 GLU 3.171 0.655 1 1 "[+ . 1 . 2]"
1 97 PRO 2.454 0.098 18 0 "[ . 1 . 2]"
1 98 SER 0.428 0.079 11 0 "[ . 1 . 2]"
1 99 LEU 6.089 0.821 18 1 "[ . 1 . + 2]"
1 100 ARG 4.830 0.273 16 0 "[ . 1 . 2]"
1 101 VAL 3.543 0.119 17 0 "[ . 1 . 2]"
1 102 VAL 0.964 0.241 17 0 "[ . 1 . 2]"
1 103 PHE 1.791 0.111 11 0 "[ . 1 . 2]"
1 104 GLU 8.691 0.727 13 1 "[ . 1 + . 2]"
1 105 LEU 7.812 0.268 5 0 "[ . 1 . 2]"
1 106 THR 3.238 0.120 9 0 "[ . 1 . 2]"
1 107 ASP 2.026 0.094 11 0 "[ . 1 . 2]"
1 108 GLY 3.399 0.549 15 3 "[ . 1 * -+ 2]"
1 109 LYS 9.291 0.592 16 5 "[- * 1 *+* 2]"
1 110 TRP 9.903 0.438 17 0 "[ . 1 . 2]"
1 111 TYR 3.261 0.120 9 0 "[ . 1 . 2]"
1 112 VAL 4.693 0.123 1 0 "[ . 1 . 2]"
1 113 THR 3.408 0.116 12 0 "[ . 1 . 2]"
1 114 ASP 3.331 0.594 17 1 "[ . 1 . + 2]"
1 115 CYS 2.138 0.266 12 0 "[ . 1 . 2]"
1 116 TYR 3.918 0.273 16 0 "[ . 1 . 2]"
1 117 ASN 9.896 0.949 14 4 "[- . * *1 +. 2]"
1 118 ASP 1.273 0.122 12 0 "[ . 1 . 2]"
1 119 TRP 7.152 0.949 14 3 "[- . * 1 +. 2]"
1 120 TYR 10.191 0.364 8 0 "[ . 1 . 2]"
1 121 ASN 6.245 0.344 14 0 "[ . 1 . 2]"
1 122 PHE 5.456 0.317 2 0 "[ . 1 . 2]"
1 123 ASP 1.299 0.189 15 0 "[ . 1 . 2]"
1 124 LEU 4.581 0.189 15 0 "[ . 1 . 2]"
1 125 PRO 6.748 0.558 8 2 "[- . + 1 . 2]"
1 126 ILE 13.223 0.558 8 1 "[ . + 1 . 2]"
1 127 ASN 3.756 0.095 18 0 "[ . 1 . 2]"
1 128 GLU 3.403 0.514 1 1 "[+ . 1 . 2]"
1 129 LEU 5.120 0.456 13 0 "[ . 1 . 2]"
1 130 GLU 8.050 0.456 13 0 "[ . 1 . 2]"
1 131 GLU 9.171 0.750 15 5 "[ - . * 1 *+ * 2]"
1 132 THR 7.647 0.750 15 1 "[ . 1 + 2]"
1 133 ILE 17.590 0.750 1 5 "[+* . - 1* *. 2]"
1 134 GLN 10.522 0.750 1 3 "[+* . - 1 . 2]"
1 135 ALA 3.468 0.112 8 0 "[ . 1 . 2]"
1 136 VAL 3.427 0.111 3 0 "[ . 1 . 2]"
1 137 GLN 8.252 0.667 19 4 "[ * . * 1 .- +2]"
1 138 GLU 4.281 0.093 15 0 "[ . 1 . 2]"
1 139 GLU 3.275 0.097 14 0 "[ . 1 . 2]"
1 140 ASN 13.208 0.683 1 6 "[+ - . * 1 * .* *2]"
1 141 LYS 4.418 0.117 4 0 "[ . 1 . 2]"
1 142 ALA 5.155 0.117 4 0 "[ . 1 . 2]"
1 143 PHE 6.568 0.096 12 0 "[ . 1 . 2]"
1 144 GLU 7.320 0.483 18 0 "[ . 1 . 2]"
1 145 GLU 4.257 0.370 8 0 "[ . 1 . 2]"
1 146 LEU 3.841 0.458 18 0 "[ . 1 . 2]"
1 147 HIS 3.802 0.091 11 0 "[ . 1 . 2]"
1 148 PRO 2.484 0.108 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY HA2 1 2 ALA MB . . 5.480 4.494 3.717 5.080 . 0 0 "[ . 1 . 2]" 1
2 1 2 ALA HA 1 3 GLU H . . 2.930 2.401 2.184 2.979 0.049 2 0 "[ . 1 . 2]" 1
3 1 2 ALA MB 1 4 GLU H . . 5.500 4.344 3.099 5.592 0.092 9 0 "[ . 1 . 2]" 1
4 1 3 GLU H 1 3 GLU HB2 . . 3.220 3.143 2.462 3.913 0.693 17 2 "[ . - 1 . + 2]" 1
5 1 3 GLU H 1 4 GLU H . . 4.090 3.727 2.888 4.152 0.062 20 0 "[ . 1 . 2]" 1
6 1 3 GLU HA 1 3 GLU HB3 . . 2.840 2.633 2.274 3.061 0.221 16 0 "[ . 1 . 2]" 1
7 1 3 GLU HA 1 4 GLU H . . 2.400 2.288 2.159 2.479 0.079 7 0 "[ . 1 . 2]" 1
8 1 3 GLU HB2 1 3 GLU QG . . 2.720 2.334 2.155 2.583 . 0 0 "[ . 1 . 2]" 1
9 1 3 GLU HB3 1 4 GLU H . . 4.560 4.068 2.998 4.619 0.059 7 0 "[ . 1 . 2]" 1
10 1 4 GLU H 1 4 GLU HB2 . . 2.890 2.901 2.320 3.625 0.735 14 3 "[ . 1 - +* 2]" 1
11 1 4 GLU H 1 4 GLU HG3 . . 3.650 3.028 2.555 3.697 0.047 18 0 "[ . 1 . 2]" 1
12 1 4 GLU HA 1 4 GLU HB2 . . 2.950 2.918 2.396 3.022 0.072 20 0 "[ . 1 . 2]" 1
13 1 4 GLU HA 1 4 GLU HG2 . . 3.550 3.481 3.160 3.716 0.166 15 0 "[ . 1 . 2]" 1
14 1 4 GLU HA 1 4 GLU HG3 . . 3.650 2.763 2.230 3.637 . 0 0 "[ . 1 . 2]" 1
15 1 4 GLU HA 1 5 GLU H . . 2.610 2.453 2.180 2.675 0.065 19 0 "[ . 1 . 2]" 1
16 1 4 GLU HA 1 5 GLU QB . . 4.570 4.052 3.810 4.344 . 0 0 "[ . 1 . 2]" 1
17 1 4 GLU HA 1 105 LEU QD . . 4.370 3.480 3.243 3.795 . 0 0 "[ . 1 . 2]" 1
18 1 4 GLU HA 1 108 GLY HA2 . . 3.490 2.723 2.210 3.244 . 0 0 "[ . 1 . 2]" 1
19 1 4 GLU HA 1 108 GLY HA3 . . 3.560 2.591 1.957 3.419 . 0 0 "[ . 1 . 2]" 1
20 1 4 GLU HB2 1 4 GLU HG3 . . 2.890 2.868 2.294 2.980 0.090 13 0 "[ . 1 . 2]" 1
21 1 4 GLU HB2 1 5 GLU H . . 3.560 3.038 2.246 3.594 0.034 7 0 "[ . 1 . 2]" 1
22 1 4 GLU HB2 1 105 LEU QD . . 3.420 2.738 1.927 3.146 . 0 0 "[ . 1 . 2]" 1
23 1 4 GLU HB2 1 108 GLY HA2 . . 4.450 3.779 2.224 4.506 0.056 9 0 "[ . 1 . 2]" 1
24 1 4 GLU HB3 1 4 GLU HG2 . . 2.640 2.247 2.189 2.415 . 0 0 "[ . 1 . 2]" 1
25 1 4 GLU HB3 1 4 GLU HG3 . . 2.760 2.764 2.568 3.022 0.262 12 0 "[ . 1 . 2]" 1
26 1 4 GLU HB3 1 105 LEU QD . . 4.300 2.142 1.895 2.931 . 0 0 "[ . 1 . 2]" 1
27 1 4 GLU HB3 1 108 GLY HA3 . . 4.720 3.555 2.367 4.322 . 0 0 "[ . 1 . 2]" 1
28 1 4 GLU HG2 1 5 GLU H . . 4.390 4.416 4.216 4.530 0.140 15 0 "[ . 1 . 2]" 1
29 1 4 GLU HG2 1 105 LEU QD . . 4.320 2.356 1.955 3.980 . 0 0 "[ . 1 . 2]" 1
30 1 4 GLU HG2 1 108 GLY HA2 . . 4.400 2.945 2.118 4.448 0.048 12 0 "[ . 1 . 2]" 1
31 1 4 GLU HG2 1 108 GLY HA3 . . 4.950 4.129 3.425 5.000 0.050 19 0 "[ . 1 . 2]" 1
32 1 4 GLU HG3 1 5 GLU H . . 4.490 4.305 3.405 4.563 0.073 7 0 "[ . 1 . 2]" 1
33 1 4 GLU HG3 1 105 LEU QD . . 4.400 3.408 3.187 3.691 . 0 0 "[ . 1 . 2]" 1
34 1 4 GLU HG3 1 108 GLY HA2 . . 4.450 3.103 2.169 4.497 0.047 15 0 "[ . 1 . 2]" 1
35 1 4 GLU HG3 1 108 GLY HA3 . . 4.480 3.713 2.745 5.029 0.549 15 3 "[ . 1 * -+ 2]" 1
36 1 5 GLU H 1 5 GLU QB . . 2.940 2.162 1.979 2.353 . 0 0 "[ . 1 . 2]" 1
37 1 5 GLU H 1 5 GLU QG . . 4.020 3.972 3.856 4.083 0.063 2 0 "[ . 1 . 2]" 1
38 1 5 GLU H 1 6 ASP H . . 5.170 4.560 4.446 4.708 . 0 0 "[ . 1 . 2]" 1
39 1 5 GLU H 1 105 LEU QD . . 3.680 2.593 2.097 2.957 . 0 0 "[ . 1 . 2]" 1
40 1 5 GLU H 1 108 GLY HA2 . . 4.540 3.517 2.716 3.935 . 0 0 "[ . 1 . 2]" 1
41 1 5 GLU H 1 110 TRP HD1 . . 3.990 4.014 3.653 4.072 0.082 1 0 "[ . 1 . 2]" 1
42 1 5 GLU HA 1 5 GLU QG . . 3.270 2.674 2.183 3.138 . 0 0 "[ . 1 . 2]" 1
43 1 5 GLU HA 1 6 ASP H . . 2.740 2.419 2.175 2.690 . 0 0 "[ . 1 . 2]" 1
44 1 5 GLU HA 1 6 ASP HB2 . . 4.820 4.357 3.855 4.898 0.078 15 0 "[ . 1 . 2]" 1
45 1 5 GLU HA 1 9 THR MG . . 5.160 5.031 4.363 5.264 0.104 18 0 "[ . 1 . 2]" 1
46 1 5 GLU QB 1 6 ASP H . . 4.060 3.271 2.491 3.757 . 0 0 "[ . 1 . 2]" 1
47 1 5 GLU QB 1 105 LEU QD . . 3.430 3.004 2.575 3.481 0.051 14 0 "[ . 1 . 2]" 1
48 1 5 GLU QB 1 109 LYS HA . . 3.670 3.001 2.241 3.752 0.082 17 0 "[ . 1 . 2]" 1
49 1 5 GLU QB 1 110 TRP H . . 4.290 3.126 2.443 3.856 . 0 0 "[ . 1 . 2]" 1
50 1 5 GLU QB 1 110 TRP HD1 . . 2.810 2.109 1.860 2.542 . 0 0 "[ . 1 . 2]" 1
51 1 5 GLU QB 1 110 TRP HE1 . . 4.370 3.179 2.249 4.168 . 0 0 "[ . 1 . 2]" 1
52 1 5 GLU QG 1 6 ASP H . . 3.700 2.312 1.774 2.758 . 0 0 "[ . 1 . 2]" 1
53 1 5 GLU QG 1 9 THR MG . . 4.670 3.914 2.953 4.692 0.022 10 0 "[ . 1 . 2]" 1
54 1 5 GLU QG 1 10 PHE H . . 4.930 3.481 3.037 3.900 . 0 0 "[ . 1 . 2]" 1
55 1 5 GLU QG 1 10 PHE HB2 . . 4.060 2.404 2.063 2.730 . 0 0 "[ . 1 . 2]" 1
56 1 5 GLU QG 1 10 PHE HB3 . . 4.370 2.463 2.023 3.949 . 0 0 "[ . 1 . 2]" 1
57 1 5 GLU QG 1 10 PHE QD . . 4.270 3.750 3.152 4.352 0.082 3 0 "[ . 1 . 2]" 1
58 1 5 GLU QG 1 109 LYS HA . . 4.670 4.335 3.509 4.762 0.092 15 0 "[ . 1 . 2]" 1
59 1 5 GLU QG 1 110 TRP H . . 4.820 3.764 2.948 4.456 . 0 0 "[ . 1 . 2]" 1
60 1 5 GLU QG 1 110 TRP HD1 . . 2.990 2.532 2.146 2.966 . 0 0 "[ . 1 . 2]" 1
61 1 5 GLU QG 1 110 TRP HE1 . . 4.000 4.010 3.649 4.097 0.097 7 0 "[ . 1 . 2]" 1
62 1 6 ASP H 1 6 ASP HB2 . . 3.270 2.852 2.315 3.339 0.069 13 0 "[ . 1 . 2]" 1
63 1 6 ASP H 1 6 ASP HB3 . . 3.210 2.459 2.046 2.891 . 0 0 "[ . 1 . 2]" 1
64 1 6 ASP H 1 7 PHE H . . 5.500 4.462 4.158 4.637 . 0 0 "[ . 1 . 2]" 1
65 1 6 ASP H 1 9 THR HB . . 4.520 3.254 2.644 4.000 . 0 0 "[ . 1 . 2]" 1
66 1 6 ASP H 1 10 PHE HB2 . . 5.280 4.725 4.171 5.298 0.018 8 0 "[ . 1 . 2]" 1
67 1 6 ASP H 1 110 TRP HD1 . . 4.470 4.423 3.845 4.555 0.085 13 0 "[ . 1 . 2]" 1
68 1 6 ASP HA 1 7 PHE H . . 3.010 2.307 1.985 2.670 . 0 0 "[ . 1 . 2]" 1
69 1 6 ASP HA 1 7 PHE HA . . 4.790 4.391 4.291 4.532 . 0 0 "[ . 1 . 2]" 1
70 1 6 ASP HA 1 7 PHE QB . . 4.550 4.311 3.945 4.632 0.082 18 0 "[ . 1 . 2]" 1
71 1 6 ASP HA 1 110 TRP HE1 . . 4.530 3.626 2.865 4.375 . 0 0 "[ . 1 . 2]" 1
72 1 6 ASP HB2 1 9 THR H . . 4.590 4.223 3.717 4.501 . 0 0 "[ . 1 . 2]" 1
73 1 6 ASP HB2 1 9 THR HB . . 3.730 3.643 2.687 3.814 0.084 11 0 "[ . 1 . 2]" 1
74 1 6 ASP HB3 1 7 PHE H . . 4.590 3.909 2.669 4.410 . 0 0 "[ . 1 . 2]" 1
75 1 6 ASP HB3 1 9 THR H . . 3.970 2.799 2.090 3.312 . 0 0 "[ . 1 . 2]" 1
76 1 6 ASP HB3 1 9 THR HB . . 3.570 2.213 1.981 3.217 . 0 0 "[ . 1 . 2]" 1
77 1 6 ASP HB3 1 9 THR MG . . 4.550 3.678 3.182 4.628 0.078 12 0 "[ . 1 . 2]" 1
78 1 7 PHE H 1 7 PHE QB . . 3.130 2.415 2.142 2.838 . 0 0 "[ . 1 . 2]" 1
79 1 7 PHE H 1 8 LYS H . . 3.650 2.755 2.080 3.163 . 0 0 "[ . 1 . 2]" 1
80 1 7 PHE H 1 10 PHE HB3 . . 5.000 5.034 4.653 5.098 0.098 15 0 "[ . 1 . 2]" 1
81 1 7 PHE H 1 86 LYS QE . . 5.250 4.570 3.354 5.125 . 0 0 "[ . 1 . 2]" 1
82 1 7 PHE HA 1 10 PHE H . . 4.800 4.109 3.540 4.683 . 0 0 "[ . 1 . 2]" 1
83 1 7 PHE HA 1 10 PHE HB3 . . 4.040 3.758 2.405 4.123 0.083 18 0 "[ . 1 . 2]" 1
84 1 7 PHE HA 1 10 PHE QD . . 3.590 2.550 2.101 3.584 . 0 0 "[ . 1 . 2]" 1
85 1 7 PHE QB 1 8 LYS H . . 3.940 3.576 2.718 3.888 . 0 0 "[ . 1 . 2]" 1
86 1 7 PHE QB 1 86 LYS HD2 . . 5.350 3.740 2.319 4.995 . 0 0 "[ . 1 . 2]" 1
87 1 7 PHE QB 1 86 LYS QE . . 4.240 2.293 1.825 3.144 . 0 0 "[ . 1 . 2]" 1
88 1 7 PHE QB 1 110 TRP HH2 . . 4.650 4.563 3.944 4.761 0.111 18 0 "[ . 1 . 2]" 1
89 1 7 PHE QB 1 110 TRP HZ2 . . 3.810 3.499 2.626 3.912 0.102 13 0 "[ . 1 . 2]" 1
90 1 8 LYS H 1 8 LYS HB2 . . 2.960 2.884 2.637 3.028 0.068 18 0 "[ . 1 . 2]" 1
91 1 8 LYS H 1 8 LYS HB3 . . 3.140 2.293 2.032 2.534 . 0 0 "[ . 1 . 2]" 1
92 1 8 LYS H 1 8 LYS HG3 . . 4.700 4.578 4.494 4.656 . 0 0 "[ . 1 . 2]" 1
93 1 8 LYS H 1 9 THR H . . 3.340 2.506 2.108 2.864 . 0 0 "[ . 1 . 2]" 1
94 1 8 LYS H 1 9 THR HA . . 5.330 5.069 4.721 5.398 0.068 16 0 "[ . 1 . 2]" 1
95 1 8 LYS HA 1 8 LYS QD . . 4.050 4.030 3.738 4.151 0.101 19 0 "[ . 1 . 2]" 1
96 1 8 LYS HA 1 8 LYS HG2 . . 3.730 3.336 3.165 3.484 . 0 0 "[ . 1 . 2]" 1
97 1 8 LYS HA 1 8 LYS HG3 . . 3.230 2.681 2.426 2.985 . 0 0 "[ . 1 . 2]" 1
98 1 8 LYS HA 1 11 LEU H . . 4.180 3.708 3.403 4.046 . 0 0 "[ . 1 . 2]" 1
99 1 8 LYS HA 1 11 LEU HB2 . . 4.030 3.068 2.435 3.795 . 0 0 "[ . 1 . 2]" 1
100 1 8 LYS HA 1 11 LEU HB3 . . 3.710 3.530 3.023 3.792 0.082 16 0 "[ . 1 . 2]" 1
101 1 8 LYS HA 1 11 LEU QD . . 4.360 3.438 2.860 4.014 . 0 0 "[ . 1 . 2]" 1
102 1 8 LYS HA 1 12 GLN H . . 4.900 4.461 3.764 4.968 0.068 14 0 "[ . 1 . 2]" 1
103 1 8 LYS HA 1 12 GLN HG3 . . 5.330 4.519 4.042 5.149 . 0 0 "[ . 1 . 2]" 1
104 1 8 LYS HB2 1 8 LYS QE . . 5.010 3.578 2.699 4.228 . 0 0 "[ . 1 . 2]" 1
105 1 8 LYS HB2 1 9 THR H . . 3.850 3.835 3.672 3.923 0.073 19 0 "[ . 1 . 2]" 1
106 1 8 LYS HB3 1 8 LYS QE . . 4.290 3.036 1.871 4.319 0.029 12 0 "[ . 1 . 2]" 1
107 1 8 LYS HB3 1 9 THR H . . 3.630 2.403 2.148 2.655 . 0 0 "[ . 1 . 2]" 1
108 1 8 LYS HB3 1 9 THR HA . . 4.910 4.495 4.243 4.863 . 0 0 "[ . 1 . 2]" 1
109 1 8 LYS QD 1 8 LYS HG3 . . 2.800 2.283 2.170 2.580 . 0 0 "[ . 1 . 2]" 1
110 1 8 LYS QE 1 8 LYS HG2 . . 3.540 2.431 2.136 3.017 . 0 0 "[ . 1 . 2]" 1
111 1 8 LYS QE 1 8 LYS HG3 . . 3.610 2.943 2.155 3.479 . 0 0 "[ . 1 . 2]" 1
112 1 8 LYS HG2 1 9 THR HB . . 4.900 4.940 4.708 4.988 0.088 14 0 "[ . 1 . 2]" 1
113 1 8 LYS HG3 1 9 THR H . . 5.410 4.235 4.021 4.411 . 0 0 "[ . 1 . 2]" 1
114 1 9 THR H 1 9 THR HB . . 3.200 2.370 2.078 2.540 . 0 0 "[ . 1 . 2]" 1
115 1 9 THR H 1 9 THR MG . . 3.720 3.698 3.584 3.773 0.053 8 0 "[ . 1 . 2]" 1
116 1 9 THR HA 1 9 THR MG . . 2.880 2.493 2.258 2.696 . 0 0 "[ . 1 . 2]" 1
117 1 9 THR HA 1 11 LEU H . . 5.500 4.176 3.886 4.713 . 0 0 "[ . 1 . 2]" 1
118 1 9 THR HA 1 12 GLN H . . 3.840 3.473 3.167 3.703 . 0 0 "[ . 1 . 2]" 1
119 1 9 THR HA 1 12 GLN QB . . 3.460 3.068 2.536 3.549 0.089 17 0 "[ . 1 . 2]" 1
120 1 9 THR HB 1 10 PHE H . . 3.480 2.858 2.495 3.124 . 0 0 "[ . 1 . 2]" 1
121 1 9 THR MG 1 10 PHE H . . 3.770 3.538 3.137 3.843 0.073 5 0 "[ . 1 . 2]" 1
122 1 9 THR MG 1 12 GLN QB . . 4.520 3.726 3.374 4.150 . 0 0 "[ . 1 . 2]" 1
123 1 9 THR MG 1 12 GLN HG3 . . 4.820 4.699 4.398 4.905 0.085 4 0 "[ . 1 . 2]" 1
124 1 9 THR MG 1 13 LYS QE . . 3.620 2.702 2.003 3.742 0.122 11 0 "[ . 1 . 2]" 1
125 1 9 THR MG 1 13 LYS HG2 . . 4.820 4.588 3.204 4.907 0.087 13 0 "[ . 1 . 2]" 1
126 1 10 PHE H 1 10 PHE HB2 . . 3.540 3.392 2.748 3.574 0.034 5 0 "[ . 1 . 2]" 1
127 1 10 PHE H 1 10 PHE HB3 . . 3.330 2.201 2.060 2.288 . 0 0 "[ . 1 . 2]" 1
128 1 10 PHE H 1 10 PHE QD . . 4.040 2.854 2.418 4.079 0.039 19 0 "[ . 1 . 2]" 1
129 1 10 PHE H 1 11 LEU H . . 3.570 2.644 2.473 2.868 . 0 0 "[ . 1 . 2]" 1
130 1 10 PHE HA 1 13 LYS H . . 4.300 3.730 3.236 4.171 . 0 0 "[ . 1 . 2]" 1
131 1 10 PHE HA 1 13 LYS HB2 . . 4.110 3.109 2.688 3.754 . 0 0 "[ . 1 . 2]" 1
132 1 10 PHE HA 1 13 LYS HD3 . . 4.860 4.148 3.020 4.936 0.076 18 0 "[ . 1 . 2]" 1
133 1 10 PHE HA 1 13 LYS QE . . 4.740 4.377 3.432 4.816 0.076 18 0 "[ . 1 . 2]" 1
134 1 10 PHE HB2 1 11 LEU H . . 4.290 4.195 3.867 4.350 0.060 17 0 "[ . 1 . 2]" 1
135 1 10 PHE HB2 1 110 TRP HD1 . . 4.070 3.408 2.574 4.146 0.076 13 0 "[ . 1 . 2]" 1
136 1 10 PHE HB3 1 11 LEU H . . 4.240 3.509 2.479 3.837 . 0 0 "[ . 1 . 2]" 1
137 1 10 PHE HB3 1 110 TRP HD1 . . 5.000 3.343 2.563 4.333 . 0 0 "[ . 1 . 2]" 1
138 1 10 PHE QD 1 11 LEU H . . 3.870 2.448 2.022 3.144 . 0 0 "[ . 1 . 2]" 1
139 1 10 PHE QD 1 11 LEU HA . . 4.580 3.676 3.040 4.120 . 0 0 "[ . 1 . 2]" 1
140 1 10 PHE QD 1 11 LEU HB2 . . 3.940 3.164 2.481 3.986 0.046 15 0 "[ . 1 . 2]" 1
141 1 10 PHE QD 1 11 LEU QD . . 4.560 3.607 2.647 4.167 . 0 0 "[ . 1 . 2]" 1
142 1 10 PHE QD 1 110 TRP HB3 . . 5.420 3.539 2.592 4.669 . 0 0 "[ . 1 . 2]" 1
143 1 10 PHE QE 1 11 LEU HA . . 4.330 3.852 3.435 4.328 . 0 0 "[ . 1 . 2]" 1
144 1 10 PHE QE 1 11 LEU QD . . 3.910 2.662 2.039 3.491 . 0 0 "[ . 1 . 2]" 1
145 1 10 PHE QE 1 11 LEU HG . . 4.840 4.180 2.464 4.936 0.096 12 0 "[ . 1 . 2]" 1
146 1 10 PHE QE 1 103 PHE QD . . 3.260 2.883 2.306 3.371 0.111 11 0 "[ . 1 . 2]" 1
147 1 10 PHE HZ 1 103 PHE QD . . 3.640 3.169 2.268 3.665 0.025 20 0 "[ . 1 . 2]" 1
148 1 11 LEU H 1 11 LEU HB2 . . 3.280 2.145 1.969 2.352 . 0 0 "[ . 1 . 2]" 1
149 1 11 LEU H 1 11 LEU HB3 . . 3.340 2.925 2.504 3.408 0.068 19 0 "[ . 1 . 2]" 1
150 1 11 LEU H 1 11 LEU QD . . 4.120 3.524 3.242 3.671 . 0 0 "[ . 1 . 2]" 1
151 1 11 LEU H 1 11 LEU HG . . 4.580 4.111 2.967 4.535 . 0 0 "[ . 1 . 2]" 1
152 1 11 LEU H 1 12 GLN H . . 3.490 2.686 2.499 2.945 . 0 0 "[ . 1 . 2]" 1
153 1 11 LEU HA 1 11 LEU QD . . 2.950 2.065 1.897 2.213 . 0 0 "[ . 1 . 2]" 1
154 1 11 LEU HA 1 11 LEU HG . . 3.470 2.902 2.488 3.563 0.093 8 0 "[ . 1 . 2]" 1
155 1 11 LEU HA 1 13 LYS H . . 4.590 4.286 3.496 4.638 0.048 19 0 "[ . 1 . 2]" 1
156 1 11 LEU HA 1 14 PHE H . . 3.940 3.309 3.080 3.670 . 0 0 "[ . 1 . 2]" 1
157 1 11 LEU HA 1 14 PHE HB2 . . 3.800 3.046 2.511 3.460 . 0 0 "[ . 1 . 2]" 1
158 1 11 LEU HA 1 14 PHE QD . . 4.710 3.760 3.450 4.156 . 0 0 "[ . 1 . 2]" 1
159 1 11 LEU HA 1 15 THR H . . 5.130 4.075 3.703 4.823 . 0 0 "[ . 1 . 2]" 1
160 1 11 LEU HB2 1 12 GLN H . . 4.100 3.389 2.874 3.729 . 0 0 "[ . 1 . 2]" 1
161 1 11 LEU HB3 1 12 GLN H . . 3.710 2.631 2.219 3.139 . 0 0 "[ . 1 . 2]" 1
162 1 11 LEU HB3 1 12 GLN HA . . 4.750 4.091 3.797 4.338 . 0 0 "[ . 1 . 2]" 1
163 1 11 LEU QD 1 14 PHE H . . 5.260 4.411 4.108 4.701 . 0 0 "[ . 1 . 2]" 1
164 1 11 LEU QD 1 14 PHE HB2 . . 4.270 3.794 3.257 4.162 . 0 0 "[ . 1 . 2]" 1
165 1 11 LEU QD 1 14 PHE HB3 . . 4.820 2.767 2.278 3.206 . 0 0 "[ . 1 . 2]" 1
166 1 11 LEU QD 1 14 PHE QD . . 4.200 2.650 2.271 3.212 . 0 0 "[ . 1 . 2]" 1
167 1 11 LEU QD 1 14 PHE QE . . 4.290 4.080 3.617 4.334 0.044 3 0 "[ . 1 . 2]" 1
168 1 11 LEU QD 1 15 THR H . . 4.800 4.075 3.299 4.778 . 0 0 "[ . 1 . 2]" 1
169 1 11 LEU QD 1 15 THR MG . . 4.200 2.561 1.966 3.159 . 0 0 "[ . 1 . 2]" 1
170 1 11 LEU QD 1 61 LEU HA . . 4.690 3.900 3.505 4.204 . 0 0 "[ . 1 . 2]" 1
171 1 11 LEU QD 1 61 LEU QB . . 4.860 1.981 1.860 2.194 . 0 0 "[ . 1 . 2]" 1
172 1 11 LEU QD 1 61 LEU QD . . 3.670 2.582 1.974 3.231 . 0 0 "[ . 1 . 2]" 1
173 1 11 LEU QD 1 61 LEU HG . . 5.310 3.082 2.144 4.698 . 0 0 "[ . 1 . 2]" 1
174 1 11 LEU QD 1 88 PHE QE . . 4.560 3.992 2.783 4.343 . 0 0 "[ . 1 . 2]" 1
175 1 12 GLN H 1 12 GLN QB . . 2.790 2.542 2.379 2.664 . 0 0 "[ . 1 . 2]" 1
176 1 12 GLN H 1 12 GLN HG2 . . 3.330 3.206 2.839 3.387 0.057 6 0 "[ . 1 . 2]" 1
177 1 12 GLN H 1 12 GLN HG3 . . 3.350 2.193 1.902 2.821 . 0 0 "[ . 1 . 2]" 1
178 1 12 GLN H 1 14 PHE H . . 4.830 4.273 3.958 4.433 . 0 0 "[ . 1 . 2]" 1
179 1 12 GLN HA 1 12 GLN QB . . 2.800 2.379 2.324 2.433 . 0 0 "[ . 1 . 2]" 1
180 1 12 GLN HA 1 12 GLN HG2 . . 3.400 2.522 2.252 2.749 . 0 0 "[ . 1 . 2]" 1
181 1 12 GLN HA 1 12 GLN HG3 . . 3.410 3.204 2.980 3.477 0.067 11 0 "[ . 1 . 2]" 1
182 1 12 GLN HA 1 14 PHE H . . 5.330 4.723 4.494 4.943 . 0 0 "[ . 1 . 2]" 1
183 1 12 GLN HA 1 15 THR H . . 4.370 3.875 3.486 4.314 . 0 0 "[ . 1 . 2]" 1
184 1 12 GLN QB 1 12 GLN HG2 . . 2.660 2.400 2.338 2.575 . 0 0 "[ . 1 . 2]" 1
185 1 12 GLN QB 1 12 GLN HG3 . . 2.790 2.352 2.181 2.414 . 0 0 "[ . 1 . 2]" 1
186 1 12 GLN QB 1 13 LYS H . . 3.400 2.561 2.194 3.476 0.076 16 0 "[ . 1 . 2]" 1
187 1 12 GLN HE22 1 12 GLN HG3 . . 4.060 3.955 3.529 4.189 0.129 3 0 "[ . 1 . 2]" 1
188 1 13 LYS H 1 13 LYS HB2 . . 2.950 2.440 2.254 2.649 . 0 0 "[ . 1 . 2]" 1
189 1 13 LYS H 1 13 LYS HB3 . . 3.710 3.595 3.507 3.763 0.053 16 0 "[ . 1 . 2]" 1
190 1 13 LYS H 1 13 LYS HD2 . . 4.270 3.783 3.279 4.326 0.056 16 0 "[ . 1 . 2]" 1
191 1 13 LYS H 1 13 LYS HD3 . . 5.500 4.476 2.968 5.121 . 0 0 "[ . 1 . 2]" 1
192 1 13 LYS H 1 13 LYS HG2 . . 3.820 3.553 2.430 3.893 0.073 14 0 "[ . 1 . 2]" 1
193 1 13 LYS H 1 13 LYS HG3 . . 3.500 2.412 1.948 3.867 0.367 18 0 "[ . 1 . 2]" 1
194 1 13 LYS H 1 14 PHE H . . 3.330 2.522 1.906 2.743 . 0 0 "[ . 1 . 2]" 1
195 1 13 LYS H 1 14 PHE HB2 . . 4.710 4.643 4.078 4.788 0.078 18 0 "[ . 1 . 2]" 1
196 1 13 LYS H 1 15 THR H . . 4.510 4.085 3.091 4.370 . 0 0 "[ . 1 . 2]" 1
197 1 13 LYS HA 1 13 LYS HD2 . . 4.730 4.549 2.154 4.805 0.075 11 0 "[ . 1 . 2]" 1
198 1 13 LYS HA 1 13 LYS HD3 . . 4.520 4.336 2.302 4.593 0.073 20 0 "[ . 1 . 2]" 1
199 1 13 LYS HA 1 13 LYS HG2 . . 3.400 2.634 2.399 3.243 . 0 0 "[ . 1 . 2]" 1
200 1 13 LYS HA 1 13 LYS HG3 . . 3.160 2.979 2.718 3.492 0.332 18 0 "[ . 1 . 2]" 1
201 1 13 LYS HA 1 16 SER H . . 4.030 3.607 3.201 4.075 0.045 9 0 "[ . 1 . 2]" 1
202 1 13 LYS HB2 1 14 PHE H . . 3.490 2.505 2.334 2.660 . 0 0 "[ . 1 . 2]" 1
203 1 13 LYS HB2 1 20 PHE QE . . 3.690 2.927 2.413 3.521 . 0 0 "[ . 1 . 2]" 1
204 1 13 LYS HB3 1 13 LYS HD2 . . 4.000 3.282 2.737 3.942 . 0 0 "[ . 1 . 2]" 1
205 1 13 LYS HB3 1 13 LYS HD3 . . 3.960 2.624 2.340 3.569 . 0 0 "[ . 1 . 2]" 1
206 1 13 LYS HB3 1 13 LYS QE . . 4.200 4.069 3.516 4.272 0.072 4 0 "[ . 1 . 2]" 1
207 1 13 LYS HB3 1 14 PHE H . . 3.900 3.548 3.295 3.672 . 0 0 "[ . 1 . 2]" 1
208 1 13 LYS HB3 1 14 PHE HA . . 5.230 4.441 4.142 4.659 . 0 0 "[ . 1 . 2]" 1
209 1 13 LYS HB3 1 20 PHE QD . . 4.780 3.414 2.787 3.844 . 0 0 "[ . 1 . 2]" 1
210 1 13 LYS HB3 1 20 PHE QE . . 4.130 3.325 2.916 3.646 . 0 0 "[ . 1 . 2]" 1
211 1 13 LYS HD3 1 14 PHE H . . 5.300 5.244 4.542 5.381 0.081 15 0 "[ . 1 . 2]" 1
212 1 13 LYS HG2 1 14 PHE H . . 5.040 4.931 4.287 5.103 0.063 12 0 "[ . 1 . 2]" 1
213 1 14 PHE H 1 14 PHE HB2 . . 3.370 2.317 2.190 2.412 . 0 0 "[ . 1 . 2]" 1
214 1 14 PHE H 1 14 PHE HB3 . . 3.320 2.598 2.429 2.720 . 0 0 "[ . 1 . 2]" 1
215 1 14 PHE H 1 14 PHE QD . . 4.420 4.126 4.033 4.181 . 0 0 "[ . 1 . 2]" 1
216 1 14 PHE H 1 15 THR H . . 3.840 2.868 2.732 3.076 . 0 0 "[ . 1 . 2]" 1
217 1 14 PHE H 1 15 THR MG . . 4.720 4.368 4.126 4.788 0.068 5 0 "[ . 1 . 2]" 1
218 1 14 PHE H 1 16 SER H . . 4.820 4.263 4.058 4.442 . 0 0 "[ . 1 . 2]" 1
219 1 14 PHE H 1 20 PHE QD . . 4.440 3.879 3.493 4.260 . 0 0 "[ . 1 . 2]" 1
220 1 14 PHE HA 1 14 PHE QD . . 3.960 2.483 2.191 2.821 . 0 0 "[ . 1 . 2]" 1
221 1 14 PHE HA 1 20 PHE QD . . 2.880 2.142 1.985 2.686 . 0 0 "[ . 1 . 2]" 1
222 1 14 PHE HA 1 20 PHE QE . . 2.960 2.945 2.504 3.057 0.097 11 0 "[ . 1 . 2]" 1
223 1 14 PHE HA 1 21 GLN HA . . 5.080 3.465 3.004 4.665 . 0 0 "[ . 1 . 2]" 1
224 1 14 PHE HA 1 21 GLN HE21 . . 5.500 3.891 3.303 5.325 . 0 0 "[ . 1 . 2]" 1
225 1 14 PHE HB2 1 15 THR H . . 4.260 3.963 3.694 4.339 0.079 12 0 "[ . 1 . 2]" 1
226 1 14 PHE HB2 1 15 THR MG . . 4.710 4.383 4.117 4.765 0.055 12 0 "[ . 1 . 2]" 1
227 1 14 PHE HB2 1 20 PHE QE . . 4.330 2.656 2.277 3.348 . 0 0 "[ . 1 . 2]" 1
228 1 14 PHE HB3 1 15 THR H . . 3.770 2.807 2.461 3.618 . 0 0 "[ . 1 . 2]" 1
229 1 14 PHE HB3 1 15 THR MG . . 3.970 2.827 2.531 3.364 . 0 0 "[ . 1 . 2]" 1
230 1 14 PHE HB3 1 61 LEU QD . . 5.230 4.267 3.260 4.932 . 0 0 "[ . 1 . 2]" 1
231 1 14 PHE QD 1 15 THR H . . 4.780 4.132 3.567 4.644 . 0 0 "[ . 1 . 2]" 1
232 1 14 PHE QD 1 15 THR MG . . 2.980 2.734 2.298 3.085 0.105 12 0 "[ . 1 . 2]" 1
233 1 14 PHE QD 1 21 GLN H . . 4.450 4.494 4.205 4.552 0.102 12 0 "[ . 1 . 2]" 1
234 1 14 PHE QD 1 21 GLN HA . . 3.850 2.408 2.139 3.457 . 0 0 "[ . 1 . 2]" 1
235 1 14 PHE QD 1 21 GLN HB2 . . 5.250 3.876 3.441 4.870 . 0 0 "[ . 1 . 2]" 1
236 1 14 PHE QD 1 21 GLN HE21 . . 5.500 3.721 2.883 5.011 . 0 0 "[ . 1 . 2]" 1
237 1 14 PHE QD 1 56 LEU HB2 . . 5.310 4.596 3.976 5.358 0.048 20 0 "[ . 1 . 2]" 1
238 1 14 PHE QD 1 61 LEU QD . . 3.290 2.708 2.069 3.243 . 0 0 "[ . 1 . 2]" 1
239 1 14 PHE QE 1 24 ARG QB . . 3.870 2.578 2.114 3.431 . 0 0 "[ . 1 . 2]" 1
240 1 14 PHE QE 1 25 ILE HG12 . . 4.980 3.594 3.143 4.243 . 0 0 "[ . 1 . 2]" 1
241 1 14 PHE QE 1 25 ILE HG13 . . 4.770 2.975 2.306 4.258 . 0 0 "[ . 1 . 2]" 1
242 1 14 PHE QE 1 61 LEU QD . . 2.790 2.465 2.181 2.698 . 0 0 "[ . 1 . 2]" 1
243 1 15 THR H 1 15 THR MG . . 3.270 2.472 2.182 2.911 . 0 0 "[ . 1 . 2]" 1
244 1 15 THR H 1 16 SER H . . 3.300 2.708 2.392 2.999 . 0 0 "[ . 1 . 2]" 1
245 1 15 THR HA 1 15 THR MG . . 3.710 2.350 2.191 2.559 . 0 0 "[ . 1 . 2]" 1
246 1 15 THR HA 1 21 GLN HB2 . . 5.220 5.008 4.365 5.853 0.633 6 2 "[ .+ - 1 . 2]" 1
247 1 15 THR HA 1 21 GLN HE21 . . 4.900 3.656 2.890 4.939 0.039 14 0 "[ . 1 . 2]" 1
248 1 15 THR HA 1 21 GLN HE22 . . 4.710 3.349 2.692 4.203 . 0 0 "[ . 1 . 2]" 1
249 1 15 THR HA 1 61 LEU QD . . 4.440 4.071 3.185 4.471 0.031 17 0 "[ . 1 . 2]" 1
250 1 15 THR HB 1 57 ASP HB3 . . 4.720 4.756 4.429 5.139 0.419 4 0 "[ . 1 . 2]" 1
251 1 15 THR HB 1 58 GLU H . . 3.550 2.847 2.655 3.299 . 0 0 "[ . 1 . 2]" 1
252 1 15 THR HB 1 58 GLU HA . . 3.360 2.490 2.153 2.861 . 0 0 "[ . 1 . 2]" 1
253 1 15 THR HB 1 58 GLU QB . . 3.990 2.859 2.268 3.706 . 0 0 "[ . 1 . 2]" 1
254 1 15 THR HB 1 58 GLU HG2 . . 5.330 4.160 2.228 5.393 0.063 14 0 "[ . 1 . 2]" 1
255 1 15 THR HB 1 58 GLU HG3 . . 5.110 4.340 3.022 5.374 0.264 16 0 "[ . 1 . 2]" 1
256 1 15 THR HB 1 61 LEU H . . 5.010 5.055 4.879 5.097 0.087 11 0 "[ . 1 . 2]" 1
257 1 15 THR MG 1 16 SER H . . 4.800 4.356 4.181 4.447 . 0 0 "[ . 1 . 2]" 1
258 1 15 THR MG 1 21 GLN HE21 . . 4.560 4.281 3.537 5.096 0.536 8 1 "[ . + 1 . 2]" 1
259 1 15 THR MG 1 21 GLN HE22 . . 5.500 3.851 3.258 4.627 . 0 0 "[ . 1 . 2]" 1
260 1 15 THR MG 1 58 GLU H . . 4.120 3.858 3.648 4.205 0.085 11 0 "[ . 1 . 2]" 1
261 1 15 THR MG 1 58 GLU HA . . 3.110 2.191 2.025 2.565 . 0 0 "[ . 1 . 2]" 1
262 1 15 THR MG 1 58 GLU HG2 . . 5.500 4.533 3.489 5.323 . 0 0 "[ . 1 . 2]" 1
263 1 15 THR MG 1 58 GLU HG3 . . 5.500 4.527 2.956 5.569 0.069 16 0 "[ . 1 . 2]" 1
264 1 15 THR MG 1 61 LEU QD . . 3.630 2.161 1.873 2.692 . 0 0 "[ . 1 . 2]" 1
265 1 16 SER H 1 16 SER HB2 . . 4.150 3.125 2.661 3.897 . 0 0 "[ . 1 . 2]" 1
266 1 16 SER H 1 17 SER H . . 2.910 2.378 1.794 2.928 0.018 1 0 "[ . 1 . 2]" 1
267 1 16 SER HA 1 17 SER HA . . 4.290 4.274 3.967 4.383 0.093 20 0 "[ . 1 . 2]" 1
268 1 16 SER HA 1 147 HIS HB2 . . 4.910 4.777 4.136 4.988 0.078 13 0 "[ . 1 . 2]" 1
269 1 16 SER HA 1 147 HIS HB3 . . 4.740 3.195 2.725 3.582 . 0 0 "[ . 1 . 2]" 1
270 1 17 SER H 1 17 SER HB2 . . 3.410 3.371 2.564 4.074 0.664 1 1 "[+ . 1 . 2]" 1
271 1 17 SER H 1 18 ALA H . . 4.660 3.709 3.030 4.340 . 0 0 "[ . 1 . 2]" 1
272 1 17 SER H 1 18 ALA MB . . 5.500 4.877 4.380 5.373 . 0 0 "[ . 1 . 2]" 1
273 1 17 SER H 1 20 PHE QB . . 5.220 4.164 3.731 4.700 . 0 0 "[ . 1 . 2]" 1
274 1 17 SER H 1 147 HIS HB3 . . 4.560 3.512 3.011 4.033 . 0 0 "[ . 1 . 2]" 1
275 1 17 SER HA 1 18 ALA H . . 3.040 2.193 2.126 2.364 . 0 0 "[ . 1 . 2]" 1
276 1 17 SER HB3 1 18 ALA H . . 5.260 4.150 2.843 4.572 . 0 0 "[ . 1 . 2]" 1
277 1 17 SER HB3 1 20 PHE QB . . 4.640 2.311 1.966 3.711 . 0 0 "[ . 1 . 2]" 1
278 1 18 ALA H 1 18 ALA MB . . 3.080 2.194 2.124 2.238 . 0 0 "[ . 1 . 2]" 1
279 1 18 ALA H 1 19 SER H . . 3.770 2.873 2.468 3.115 . 0 0 "[ . 1 . 2]" 1
280 1 18 ALA H 1 143 PHE QD . . 4.680 4.390 3.656 4.748 0.068 1 0 "[ . 1 . 2]" 1
281 1 18 ALA H 1 144 GLU HA . . 4.960 3.806 3.488 4.126 . 0 0 "[ . 1 . 2]" 1
282 1 18 ALA H 1 147 HIS HB2 . . 4.540 3.575 3.234 4.157 . 0 0 "[ . 1 . 2]" 1
283 1 18 ALA H 1 147 HIS HB3 . . 4.340 3.187 2.699 3.637 . 0 0 "[ . 1 . 2]" 1
284 1 18 ALA H 1 148 PRO HA . . 4.480 3.841 3.355 4.298 . 0 0 "[ . 1 . 2]" 1
285 1 18 ALA HA 1 21 GLN H . . 3.830 3.564 3.248 3.827 . 0 0 "[ . 1 . 2]" 1
286 1 18 ALA HA 1 21 GLN HB2 . . 4.080 3.530 2.907 4.542 0.462 8 0 "[ . 1 . 2]" 1
287 1 18 ALA HA 1 21 GLN HB3 . . 4.440 2.832 2.281 4.180 . 0 0 "[ . 1 . 2]" 1
288 1 18 ALA HA 1 21 GLN QG . . 5.210 4.148 1.915 4.707 . 0 0 "[ . 1 . 2]" 1
289 1 18 ALA HA 1 22 TYR H . . 4.750 4.078 3.764 4.279 . 0 0 "[ . 1 . 2]" 1
290 1 18 ALA HA 1 55 LEU QD . . 3.510 2.738 2.172 3.456 . 0 0 "[ . 1 . 2]" 1
291 1 18 ALA MB 1 19 SER H . . 3.420 2.467 2.294 2.720 . 0 0 "[ . 1 . 2]" 1
292 1 18 ALA MB 1 19 SER HA . . 4.980 3.841 3.742 3.968 . 0 0 "[ . 1 . 2]" 1
293 1 18 ALA MB 1 22 TYR HB2 . . 5.090 5.035 4.671 5.176 0.086 16 0 "[ . 1 . 2]" 1
294 1 18 ALA MB 1 22 TYR QD . . 4.270 3.314 3.012 3.654 . 0 0 "[ . 1 . 2]" 1
295 1 18 ALA MB 1 22 TYR QE . . 3.420 3.057 2.678 3.508 0.088 14 0 "[ . 1 . 2]" 1
296 1 18 ALA MB 1 55 LEU QD . . 3.320 2.378 1.843 3.168 . 0 0 "[ . 1 . 2]" 1
297 1 18 ALA MB 1 143 PHE QD . . 2.610 2.448 2.153 2.686 0.076 11 0 "[ . 1 . 2]" 1
298 1 18 ALA MB 1 144 GLU H . . 4.540 3.886 3.695 4.015 . 0 0 "[ . 1 . 2]" 1
299 1 18 ALA MB 1 144 GLU HA . . 3.610 2.311 2.129 2.540 . 0 0 "[ . 1 . 2]" 1
300 1 18 ALA MB 1 144 GLU HB2 . . 4.300 2.559 2.165 3.739 . 0 0 "[ . 1 . 2]" 1
301 1 18 ALA MB 1 144 GLU HG2 . . 3.960 3.728 2.257 4.049 0.089 7 0 "[ . 1 . 2]" 1
302 1 18 ALA MB 1 148 PRO HA . . 4.100 3.984 3.278 4.208 0.108 14 0 "[ . 1 . 2]" 1
303 1 19 SER H 1 19 SER QB . . 3.330 2.427 2.157 2.919 . 0 0 "[ . 1 . 2]" 1
304 1 19 SER H 1 20 PHE H . . 3.650 2.805 2.614 3.093 . 0 0 "[ . 1 . 2]" 1
305 1 19 SER HA 1 22 TYR H . . 4.400 3.531 3.083 3.820 . 0 0 "[ . 1 . 2]" 1
306 1 19 SER HA 1 22 TYR HB2 . . 4.760 2.728 2.301 2.949 . 0 0 "[ . 1 . 2]" 1
307 1 19 SER HA 1 22 TYR HB3 . . 4.450 4.356 3.819 4.524 0.074 13 0 "[ . 1 . 2]" 1
308 1 19 SER HA 1 22 TYR QD . . 3.400 2.764 2.370 2.985 . 0 0 "[ . 1 . 2]" 1
309 1 19 SER HA 1 22 TYR QE . . 4.990 4.918 4.528 5.078 0.088 11 0 "[ . 1 . 2]" 1
310 1 19 SER QB 1 20 PHE H . . 4.930 2.903 2.415 3.487 . 0 0 "[ . 1 . 2]" 1
311 1 20 PHE H 1 20 PHE QB . . 3.390 2.239 2.180 2.337 . 0 0 "[ . 1 . 2]" 1
312 1 20 PHE H 1 20 PHE QD . . 4.270 4.205 4.150 4.276 0.006 10 0 "[ . 1 . 2]" 1
313 1 20 PHE H 1 21 GLN H . . 3.540 2.751 2.565 3.014 . 0 0 "[ . 1 . 2]" 1
314 1 20 PHE QB 1 21 GLN H . . 4.150 2.585 2.317 2.952 . 0 0 "[ . 1 . 2]" 1
315 1 20 PHE QD 1 21 GLN H . . 4.220 3.323 2.965 3.872 . 0 0 "[ . 1 . 2]" 1
316 1 20 PHE QD 1 21 GLN HA . . 4.530 3.427 2.844 4.530 . 0 0 "[ . 1 . 2]" 1
317 1 21 GLN H 1 21 GLN HB2 . . 3.550 2.560 2.177 3.545 . 0 0 "[ . 1 . 2]" 1
318 1 21 GLN H 1 21 GLN HB3 . . 3.470 2.586 2.334 2.940 . 0 0 "[ . 1 . 2]" 1
319 1 21 GLN H 1 21 GLN HE21 . . 5.170 4.490 3.963 5.226 0.056 14 0 "[ . 1 . 2]" 1
320 1 21 GLN H 1 21 GLN QG . . 5.110 3.781 1.855 4.008 . 0 0 "[ . 1 . 2]" 1
321 1 21 GLN H 1 22 TYR H . . 3.800 3.019 2.889 3.326 . 0 0 "[ . 1 . 2]" 1
322 1 21 GLN H 1 23 SER H . . 4.940 4.324 4.075 4.694 . 0 0 "[ . 1 . 2]" 1
323 1 21 GLN H 1 55 LEU QD . . 5.400 4.767 4.198 5.328 . 0 0 "[ . 1 . 2]" 1
324 1 21 GLN HA 1 21 GLN HE22 . . 4.920 5.086 4.933 5.915 0.995 6 2 "[ .+ - 1 . 2]" 1
325 1 21 GLN HA 1 21 GLN QG . . 3.650 2.420 2.094 3.379 . 0 0 "[ . 1 . 2]" 1
326 1 21 GLN HA 1 24 ARG H . . 5.450 3.893 3.651 4.270 . 0 0 "[ . 1 . 2]" 1
327 1 21 GLN HA 1 25 ILE MD . . 5.150 3.884 3.474 4.484 . 0 0 "[ . 1 . 2]" 1
328 1 21 GLN HB2 1 21 GLN HE21 . . 4.070 2.202 1.784 3.194 . 0 0 "[ . 1 . 2]" 1
329 1 21 GLN HB2 1 21 GLN HE22 . . 4.330 3.524 3.336 4.146 . 0 0 "[ . 1 . 2]" 1
330 1 21 GLN HB2 1 22 TYR H . . 4.260 3.799 3.546 4.009 . 0 0 "[ . 1 . 2]" 1
331 1 21 GLN HB2 1 55 LEU QD . . 4.640 3.777 3.256 4.479 . 0 0 "[ . 1 . 2]" 1
332 1 21 GLN HB3 1 21 GLN HE21 . . 4.330 3.476 2.883 4.321 . 0 0 "[ . 1 . 2]" 1
333 1 21 GLN HB3 1 21 GLN HE22 . . 4.870 4.385 3.643 4.647 . 0 0 "[ . 1 . 2]" 1
334 1 21 GLN HB3 1 22 TYR H . . 3.540 2.629 2.251 4.116 0.576 6 2 "[ .+ - 1 . 2]" 1
335 1 21 GLN HB3 1 53 TRP HE1 . . 5.440 4.567 4.000 5.315 . 0 0 "[ . 1 . 2]" 1
336 1 21 GLN HB3 1 55 LEU QD . . 4.450 3.043 2.455 4.327 . 0 0 "[ . 1 . 2]" 1
337 1 21 GLN HE21 1 56 LEU H . . 4.270 3.850 2.081 4.355 0.085 14 0 "[ . 1 . 2]" 1
338 1 21 GLN HE22 1 55 LEU HA . . 4.570 3.998 3.286 4.483 . 0 0 "[ . 1 . 2]" 1
339 1 21 GLN HE22 1 56 LEU H . . 3.890 2.548 1.935 2.973 . 0 0 "[ . 1 . 2]" 1
340 1 21 GLN HE22 1 56 LEU HG . . 4.790 4.179 3.577 5.548 0.758 8 1 "[ . + 1 . 2]" 1
341 1 21 GLN QG 1 22 TYR H . . 5.500 3.262 2.298 3.693 . 0 0 "[ . 1 . 2]" 1
342 1 21 GLN QG 1 25 ILE MD . . 4.310 2.420 1.989 3.761 . 0 0 "[ . 1 . 2]" 1
343 1 21 GLN QG 1 53 TRP HE1 . . 4.380 2.643 2.201 3.026 . 0 0 "[ . 1 . 2]" 1
344 1 21 GLN QG 1 55 LEU QD . . 4.840 2.636 2.110 3.121 . 0 0 "[ . 1 . 2]" 1
345 1 21 GLN QG 1 56 LEU H . . 4.680 4.347 4.026 4.576 . 0 0 "[ . 1 . 2]" 1
346 1 22 TYR H 1 22 TYR HB2 . . 3.670 2.352 2.260 2.411 . 0 0 "[ . 1 . 2]" 1
347 1 22 TYR H 1 22 TYR HB3 . . 3.710 3.566 3.518 3.605 . 0 0 "[ . 1 . 2]" 1
348 1 22 TYR H 1 22 TYR QD . . 3.860 3.061 2.816 3.271 . 0 0 "[ . 1 . 2]" 1
349 1 22 TYR H 1 23 SER H . . 3.520 2.941 2.775 3.165 . 0 0 "[ . 1 . 2]" 1
350 1 22 TYR H 1 25 ILE MD . . 5.300 3.932 3.653 4.262 . 0 0 "[ . 1 . 2]" 1
351 1 22 TYR H 1 55 LEU QD . . 4.600 3.935 3.552 4.455 . 0 0 "[ . 1 . 2]" 1
352 1 22 TYR HA 1 22 TYR QD . . 2.800 2.321 2.202 2.667 . 0 0 "[ . 1 . 2]" 1
353 1 22 TYR HA 1 22 TYR QE . . 4.970 4.303 4.180 4.491 . 0 0 "[ . 1 . 2]" 1
354 1 22 TYR HA 1 24 ARG H . . 4.070 3.699 3.449 3.885 . 0 0 "[ . 1 . 2]" 1
355 1 22 TYR HA 1 25 ILE H . . 4.480 4.083 3.476 4.559 0.079 9 0 "[ . 1 . 2]" 1
356 1 22 TYR HA 1 25 ILE HB . . 4.630 3.386 2.833 3.969 . 0 0 "[ . 1 . 2]" 1
357 1 22 TYR HA 1 25 ILE MD . . 3.410 2.248 2.021 2.431 . 0 0 "[ . 1 . 2]" 1
358 1 22 TYR HB2 1 23 SER H . . 4.130 2.766 2.540 3.117 . 0 0 "[ . 1 . 2]" 1
359 1 22 TYR HB3 1 23 SER H . . 3.850 3.440 3.038 3.792 . 0 0 "[ . 1 . 2]" 1
360 1 22 TYR QD 1 25 ILE MD . . 3.680 3.210 2.384 3.552 . 0 0 "[ . 1 . 2]" 1
361 1 22 TYR QD 1 50 ARG QG . . 3.310 2.448 2.139 2.887 . 0 0 "[ . 1 . 2]" 1
362 1 22 TYR QD 1 55 LEU QD . . 4.230 3.373 3.007 3.791 . 0 0 "[ . 1 . 2]" 1
363 1 22 TYR QE 1 25 ILE MD . . 4.140 4.170 3.500 4.273 0.133 7 0 "[ . 1 . 2]" 1
364 1 22 TYR QE 1 50 ARG HA . . 4.120 3.966 3.377 4.198 0.078 19 0 "[ . 1 . 2]" 1
365 1 22 TYR QE 1 50 ARG QG . . 3.460 2.461 2.182 2.994 . 0 0 "[ . 1 . 2]" 1
366 1 22 TYR QE 1 53 TRP H . . 4.760 4.060 3.332 4.526 . 0 0 "[ . 1 . 2]" 1
367 1 22 TYR QE 1 53 TRP QB . . 3.800 2.175 1.979 2.759 . 0 0 "[ . 1 . 2]" 1
368 1 22 TYR QE 1 53 TRP HD1 . . 3.130 2.978 2.365 3.218 0.088 13 0 "[ . 1 . 2]" 1
369 1 22 TYR QE 1 55 LEU QD . . 3.100 2.405 2.169 2.884 . 0 0 "[ . 1 . 2]" 1
370 1 22 TYR QE 1 144 GLU HG2 . . 5.080 4.768 4.071 5.155 0.075 4 0 "[ . 1 . 2]" 1
371 1 23 SER H 1 23 SER QB . . 3.010 2.326 2.059 2.579 . 0 0 "[ . 1 . 2]" 1
372 1 23 SER HA 1 23 SER QB . . 2.800 2.388 2.153 2.508 . 0 0 "[ . 1 . 2]" 1
373 1 24 ARG H 1 24 ARG HG2 . . 4.890 3.893 2.485 4.880 . 0 0 "[ . 1 . 2]" 1
374 1 24 ARG H 1 24 ARG HG3 . . 4.990 4.389 3.937 4.687 . 0 0 "[ . 1 . 2]" 1
375 1 24 ARG H 1 25 ILE H . . 3.280 2.523 2.262 2.856 . 0 0 "[ . 1 . 2]" 1
376 1 24 ARG H 1 25 ILE MD . . 5.500 3.864 3.226 4.300 . 0 0 "[ . 1 . 2]" 1
377 1 24 ARG H 1 25 ILE HG12 . . 5.280 4.921 4.163 5.338 0.058 14 0 "[ . 1 . 2]" 1
378 1 24 ARG H 1 25 ILE MG . . 5.500 5.354 5.215 5.564 0.064 1 0 "[ . 1 . 2]" 1
379 1 24 ARG H 1 112 VAL H . . 5.500 5.555 5.429 5.587 0.087 20 0 "[ . 1 . 2]" 1
380 1 24 ARG HA 1 24 ARG HD2 . . 3.900 3.482 2.187 3.966 0.066 14 0 "[ . 1 . 2]" 1
381 1 24 ARG HA 1 24 ARG HD3 . . 4.070 3.150 2.054 4.144 0.074 17 0 "[ . 1 . 2]" 1
382 1 24 ARG HA 1 24 ARG HE . . 3.690 2.886 1.738 3.756 0.066 7 0 "[ . 1 . 2]" 1
383 1 24 ARG HA 1 111 TYR HA . . 5.080 3.402 3.115 3.771 . 0 0 "[ . 1 . 2]" 1
384 1 24 ARG QB 1 24 ARG HE . . 4.580 3.291 2.293 4.238 . 0 0 "[ . 1 . 2]" 1
385 1 24 ARG QB 1 25 ILE MD . . 5.350 4.129 3.370 4.832 . 0 0 "[ . 1 . 2]" 1
386 1 24 ARG QB 1 111 TYR HA . . 3.930 3.241 2.279 4.018 0.088 13 0 "[ . 1 . 2]" 1
387 1 24 ARG QB 1 112 VAL H . . 5.070 3.628 3.190 4.287 . 0 0 "[ . 1 . 2]" 1
388 1 25 ILE H 1 25 ILE HB . . 3.310 2.600 2.329 2.921 . 0 0 "[ . 1 . 2]" 1
389 1 25 ILE H 1 25 ILE MD . . 4.530 3.728 2.983 4.195 . 0 0 "[ . 1 . 2]" 1
390 1 25 ILE H 1 25 ILE HG12 . . 4.190 4.140 3.706 4.273 0.083 12 0 "[ . 1 . 2]" 1
391 1 25 ILE H 1 25 ILE HG13 . . 3.890 2.915 2.498 3.146 . 0 0 "[ . 1 . 2]" 1
392 1 25 ILE H 1 25 ILE MG . . 4.240 3.857 3.708 3.983 . 0 0 "[ . 1 . 2]" 1
393 1 25 ILE H 1 26 LYS H . . 4.720 4.373 4.210 4.522 . 0 0 "[ . 1 . 2]" 1
394 1 25 ILE HA 1 25 ILE MD . . 4.200 3.907 3.796 3.970 . 0 0 "[ . 1 . 2]" 1
395 1 25 ILE HA 1 25 ILE HG12 . . 3.930 2.776 2.619 2.985 . 0 0 "[ . 1 . 2]" 1
396 1 25 ILE HA 1 25 ILE HG13 . . 4.130 2.906 2.585 3.295 . 0 0 "[ . 1 . 2]" 1
397 1 25 ILE HA 1 25 ILE MG . . 3.270 2.383 2.224 2.501 . 0 0 "[ . 1 . 2]" 1
398 1 25 ILE HA 1 26 LYS H . . 3.080 2.209 2.074 2.482 . 0 0 "[ . 1 . 2]" 1
399 1 25 ILE HA 1 112 VAL H . . 3.590 2.498 2.071 2.850 . 0 0 "[ . 1 . 2]" 1
400 1 25 ILE HA 1 112 VAL HB . . 3.600 2.413 2.173 2.771 . 0 0 "[ . 1 . 2]" 1
401 1 25 ILE HB 1 25 ILE MD . . 3.680 2.300 2.130 2.442 . 0 0 "[ . 1 . 2]" 1
402 1 25 ILE HB 1 26 LYS H . . 4.850 4.190 3.534 4.429 . 0 0 "[ . 1 . 2]" 1
403 1 25 ILE HB 1 112 VAL HB . . 4.430 4.440 4.276 4.513 0.083 12 0 "[ . 1 . 2]" 1
404 1 25 ILE MD 1 25 ILE MG . . 3.470 2.128 2.041 2.456 . 0 0 "[ . 1 . 2]" 1
405 1 25 ILE MD 1 53 TRP QB . . 5.120 3.865 3.523 4.325 . 0 0 "[ . 1 . 2]" 1
406 1 25 ILE MD 1 53 TRP HD1 . . 4.750 4.139 3.631 4.746 . 0 0 "[ . 1 . 2]" 1
407 1 25 ILE MD 1 53 TRP HE1 . . 3.950 3.393 2.912 4.034 0.084 13 0 "[ . 1 . 2]" 1
408 1 25 ILE MD 1 53 TRP HZ2 . . 3.790 3.010 2.661 3.408 . 0 0 "[ . 1 . 2]" 1
409 1 25 ILE MD 1 112 VAL H . . 4.980 5.066 4.883 5.103 0.123 1 0 "[ . 1 . 2]" 1
410 1 25 ILE MD 1 112 VAL HB . . 3.970 3.826 3.550 4.021 0.051 6 0 "[ . 1 . 2]" 1
411 1 25 ILE MD 1 112 VAL MG2 . . 4.490 3.560 3.099 4.222 . 0 0 "[ . 1 . 2]" 1
412 1 25 ILE HG12 1 112 VAL H . . 4.870 3.808 3.483 4.270 . 0 0 "[ . 1 . 2]" 1
413 1 25 ILE HG12 1 112 VAL HB . . 3.760 2.185 2.050 2.416 . 0 0 "[ . 1 . 2]" 1
414 1 25 ILE HG12 1 112 VAL MG2 . . 4.180 2.708 2.315 3.294 . 0 0 "[ . 1 . 2]" 1
415 1 25 ILE HG13 1 25 ILE MG . . 3.620 3.203 3.126 3.248 . 0 0 "[ . 1 . 2]" 1
416 1 25 ILE MG 1 26 LYS H . . 3.370 2.666 1.912 2.974 . 0 0 "[ . 1 . 2]" 1
417 1 25 ILE MG 1 26 LYS HA . . 4.930 4.097 3.609 4.376 . 0 0 "[ . 1 . 2]" 1
418 1 25 ILE MG 1 26 LYS QB . . 4.820 3.929 3.610 4.112 . 0 0 "[ . 1 . 2]" 1
419 1 25 ILE MG 1 27 PHE H . . 5.120 4.491 2.908 5.160 0.040 5 0 "[ . 1 . 2]" 1
420 1 25 ILE MG 1 29 LEU QD . . 3.100 2.153 1.943 2.801 . 0 0 "[ . 1 . 2]" 1
421 1 25 ILE MG 1 29 LEU HG . . 5.020 3.774 3.298 4.676 . 0 0 "[ . 1 . 2]" 1
422 1 25 ILE MG 1 112 VAL H . . 4.230 4.084 3.739 4.323 0.093 14 0 "[ . 1 . 2]" 1
423 1 25 ILE MG 1 112 VAL HB . . 3.470 2.524 2.116 3.018 . 0 0 "[ . 1 . 2]" 1
424 1 25 ILE MG 1 112 VAL MG2 . . 4.580 3.750 3.523 4.206 . 0 0 "[ . 1 . 2]" 1
425 1 26 LYS H 1 26 LYS QB . . 3.240 2.217 1.945 2.558 . 0 0 "[ . 1 . 2]" 1
426 1 26 LYS H 1 26 LYS QD . . 4.770 3.156 2.569 4.207 . 0 0 "[ . 1 . 2]" 1
427 1 26 LYS H 1 26 LYS QE . . 5.430 4.755 4.240 5.114 . 0 0 "[ . 1 . 2]" 1
428 1 26 LYS H 1 29 LEU QD . . 4.160 3.397 2.850 4.212 0.052 19 0 "[ . 1 . 2]" 1
429 1 26 LYS H 1 111 TYR QB . . 4.760 3.810 2.914 4.761 0.001 12 0 "[ . 1 . 2]" 1
430 1 26 LYS H 1 112 VAL H . . 4.440 3.796 3.407 4.425 . 0 0 "[ . 1 . 2]" 1
431 1 26 LYS H 1 112 VAL HB . . 4.460 3.748 3.325 4.129 . 0 0 "[ . 1 . 2]" 1
432 1 26 LYS H 1 112 VAL MG1 . . 5.060 4.256 3.770 5.074 0.014 5 0 "[ . 1 . 2]" 1
433 1 26 LYS H 1 113 THR HA . . 4.570 3.202 2.733 3.495 . 0 0 "[ . 1 . 2]" 1
434 1 26 LYS H 1 113 THR MG . . 4.140 3.754 3.223 4.240 0.100 10 0 "[ . 1 . 2]" 1
435 1 26 LYS HA 1 26 LYS QD . . 4.060 2.863 2.429 3.334 . 0 0 "[ . 1 . 2]" 1
436 1 26 LYS HA 1 26 LYS QE . . 4.870 3.488 2.113 3.916 . 0 0 "[ . 1 . 2]" 1
437 1 26 LYS HA 1 27 PHE H . . 2.830 2.307 2.094 2.546 . 0 0 "[ . 1 . 2]" 1
438 1 26 LYS QB 1 27 PHE H . . 3.960 3.091 2.585 4.037 0.077 12 0 "[ . 1 . 2]" 1
439 1 26 LYS QB 1 29 LEU QD . . 5.030 3.267 2.298 4.201 . 0 0 "[ . 1 . 2]" 1
440 1 26 LYS QB 1 111 TYR QB . . 4.440 4.065 3.202 4.554 0.114 1 0 "[ . 1 . 2]" 1
441 1 26 LYS QB 1 111 TYR QR . . 5.170 4.173 3.033 5.263 0.093 9 0 "[ . 1 . 2]" 1
442 1 26 LYS QB 1 113 THR HA . . 3.450 2.427 2.002 3.061 . 0 0 "[ . 1 . 2]" 1
443 1 26 LYS QD 1 27 PHE H . . 5.300 4.659 4.047 5.134 . 0 0 "[ . 1 . 2]" 1
444 1 26 LYS QD 1 111 TYR QB . . 4.340 2.757 2.067 3.655 . 0 0 "[ . 1 . 2]" 1
445 1 26 LYS QD 1 111 TYR QD . . 4.340 2.682 2.037 3.501 . 0 0 "[ . 1 . 2]" 1
446 1 26 LYS QD 1 111 TYR QR . . 5.020 2.587 1.924 3.426 . 0 0 "[ . 1 . 2]" 1
447 1 26 LYS QD 1 113 THR HB . . 4.390 4.217 3.781 4.341 . 0 0 "[ . 1 . 2]" 1
448 1 26 LYS QE 1 26 LYS QG . . 3.300 2.185 1.969 2.406 . 0 0 "[ . 1 . 2]" 1
449 1 26 LYS QE 1 27 PHE H . . 5.270 4.934 3.255 5.163 . 0 0 "[ . 1 . 2]" 1
450 1 26 LYS QE 1 111 TYR QB . . 5.210 3.432 2.380 4.776 . 0 0 "[ . 1 . 2]" 1
451 1 26 LYS QE 1 111 TYR QD . . 4.530 3.171 2.590 4.000 . 0 0 "[ . 1 . 2]" 1
452 1 26 LYS QE 1 111 TYR QR . . 4.050 2.900 2.509 3.655 . 0 0 "[ . 1 . 2]" 1
453 1 26 LYS QG 1 27 PHE H . . 4.470 3.316 2.258 4.332 . 0 0 "[ . 1 . 2]" 1
454 1 27 PHE H 1 27 PHE HB2 . . 3.840 3.822 3.352 3.923 0.083 17 0 "[ . 1 . 2]" 1
455 1 27 PHE H 1 27 PHE HB3 . . 3.440 3.436 2.909 3.759 0.319 4 0 "[ . 1 . 2]" 1
456 1 27 PHE H 1 29 LEU QD . . 5.500 4.653 3.727 5.251 . 0 0 "[ . 1 . 2]" 1
457 1 27 PHE HA 1 28 PRO HA . . 3.390 2.261 2.065 2.490 . 0 0 "[ . 1 . 2]" 1
458 1 27 PHE HA 1 29 LEU H . . 3.900 3.600 3.251 3.970 0.070 1 0 "[ . 1 . 2]" 1
459 1 27 PHE HA 1 29 LEU QD . . 4.180 3.146 1.885 3.945 . 0 0 "[ . 1 . 2]" 1
460 1 27 PHE HA 1 29 LEU HG . . 4.570 3.551 2.584 4.669 0.099 12 0 "[ . 1 . 2]" 1
461 1 27 PHE HB2 1 49 THR HA . . 3.780 2.849 2.087 3.840 0.060 1 0 "[ . 1 . 2]" 1
462 1 27 PHE HB2 1 49 THR MG . . 4.240 3.652 2.975 4.320 0.080 19 0 "[ . 1 . 2]" 1
463 1 27 PHE HB2 1 50 ARG H . . 5.450 3.157 2.475 4.025 . 0 0 "[ . 1 . 2]" 1
464 1 27 PHE HB3 1 28 PRO HA . . 3.920 3.517 2.509 3.972 0.052 12 0 "[ . 1 . 2]" 1
465 1 27 PHE HB3 1 50 ARG H . . 5.500 3.505 2.798 4.097 . 0 0 "[ . 1 . 2]" 1
466 1 27 PHE HB3 1 50 ARG HB2 . . 3.950 3.377 2.524 4.035 0.085 3 0 "[ . 1 . 2]" 1
467 1 28 PRO HA 1 29 LEU H . . 3.400 2.432 2.100 2.610 . 0 0 "[ . 1 . 2]" 1
468 1 28 PRO HA 1 29 LEU HG . . 4.890 3.944 3.315 4.994 0.104 12 0 "[ . 1 . 2]" 1
469 1 28 PRO HB2 1 29 LEU H . . 4.020 2.596 2.151 3.004 . 0 0 "[ . 1 . 2]" 1
470 1 28 PRO HB2 1 29 LEU QD . . 5.500 4.792 3.885 5.130 . 0 0 "[ . 1 . 2]" 1
471 1 28 PRO HB2 1 48 PHE H . . 4.550 3.666 2.586 4.328 . 0 0 "[ . 1 . 2]" 1
472 1 28 PRO HB2 1 49 THR MG . . 3.840 3.791 3.471 3.945 0.105 16 0 "[ . 1 . 2]" 1
473 1 28 PRO HB3 1 29 LEU H . . 4.080 3.545 3.171 3.781 . 0 0 "[ . 1 . 2]" 1
474 1 28 PRO HB3 1 48 PHE H . . 4.170 4.096 3.329 4.255 0.085 9 0 "[ . 1 . 2]" 1
475 1 28 PRO HB3 1 49 THR HA . . 4.740 3.409 2.645 4.058 . 0 0 "[ . 1 . 2]" 1
476 1 28 PRO HB3 1 49 THR MG . . 2.980 2.435 2.161 2.641 . 0 0 "[ . 1 . 2]" 1
477 1 28 PRO HD2 1 49 THR MG . . 5.340 5.108 3.909 5.432 0.092 3 0 "[ . 1 . 2]" 1
478 1 28 PRO HD3 1 49 THR MG . . 4.940 3.794 2.372 4.444 . 0 0 "[ . 1 . 2]" 1
479 1 28 PRO HG2 1 29 LEU H . . 5.210 4.331 3.907 4.844 . 0 0 "[ . 1 . 2]" 1
480 1 28 PRO HG2 1 49 THR MG . . 5.500 4.896 3.997 5.225 . 0 0 "[ . 1 . 2]" 1
481 1 28 PRO HG3 1 49 THR MG . . 4.270 3.939 2.756 4.353 0.083 11 0 "[ . 1 . 2]" 1
482 1 29 LEU H 1 29 LEU QD . . 4.020 2.958 2.003 3.412 . 0 0 "[ . 1 . 2]" 1
483 1 29 LEU H 1 29 LEU HG . . 3.530 2.914 2.278 3.617 0.087 6 0 "[ . 1 . 2]" 1
484 1 29 LEU H 1 30 LYS H . . 5.330 4.440 4.217 4.628 . 0 0 "[ . 1 . 2]" 1
485 1 29 LEU H 1 48 PHE H . . 5.030 4.234 3.426 5.077 0.047 12 0 "[ . 1 . 2]" 1
486 1 29 LEU H 1 48 PHE HB2 . . 3.990 3.562 2.741 4.393 0.403 18 0 "[ . 1 . 2]" 1
487 1 29 LEU H 1 48 PHE HB3 . . 4.340 3.428 2.227 4.435 0.095 19 0 "[ . 1 . 2]" 1
488 1 29 LEU H 1 49 THR MG . . 5.260 4.684 4.222 5.135 . 0 0 "[ . 1 . 2]" 1
489 1 29 LEU HA 1 29 LEU QD . . 3.040 2.170 2.041 2.404 . 0 0 "[ . 1 . 2]" 1
490 1 29 LEU HA 1 30 LYS H . . 3.180 2.579 2.286 3.000 . 0 0 "[ . 1 . 2]" 1
491 1 29 LEU HA 1 114 ASP HA . . 4.290 3.642 2.773 4.238 . 0 0 "[ . 1 . 2]" 1
492 1 29 LEU HB2 1 30 LYS H . . 4.350 3.357 2.758 3.847 . 0 0 "[ . 1 . 2]" 1
493 1 29 LEU HB2 1 48 PHE HB2 . . 4.280 3.143 2.056 3.950 . 0 0 "[ . 1 . 2]" 1
494 1 29 LEU HB2 1 48 PHE HB3 . . 5.030 2.961 2.126 4.045 . 0 0 "[ . 1 . 2]" 1
495 1 29 LEU HB2 1 114 ASP HA . . 4.310 3.926 3.584 4.165 . 0 0 "[ . 1 . 2]" 1
496 1 29 LEU HB2 1 115 CYS H . . 4.890 4.125 3.126 4.723 . 0 0 "[ . 1 . 2]" 1
497 1 29 LEU HB3 1 30 LYS H . . 4.200 2.194 1.721 2.661 . 0 0 "[ . 1 . 2]" 1
498 1 29 LEU HB3 1 48 PHE HB2 . . 4.970 4.776 3.752 5.614 0.644 20 1 "[ . 1 . +]" 1
499 1 29 LEU HB3 1 114 ASP HA . . 3.540 2.239 1.949 2.519 . 0 0 "[ . 1 . 2]" 1
500 1 29 LEU HB3 1 115 CYS H . . 3.780 3.021 1.922 3.600 . 0 0 "[ . 1 . 2]" 1
501 1 29 LEU QD 1 30 LYS H . . 3.480 3.313 3.108 3.442 . 0 0 "[ . 1 . 2]" 1
502 1 29 LEU QD 1 31 SER H . . 5.500 4.156 3.771 4.686 . 0 0 "[ . 1 . 2]" 1
503 1 29 LEU QD 1 48 PHE HA . . 4.600 4.395 3.991 4.640 0.040 14 0 "[ . 1 . 2]" 1
504 1 29 LEU QD 1 48 PHE HB2 . . 4.320 3.454 2.431 4.334 0.014 14 0 "[ . 1 . 2]" 1
505 1 29 LEU QD 1 48 PHE HB3 . . 4.700 3.301 2.064 4.553 . 0 0 "[ . 1 . 2]" 1
506 1 29 LEU QD 1 53 TRP HE3 . . 3.560 2.962 2.289 3.549 . 0 0 "[ . 1 . 2]" 1
507 1 29 LEU QD 1 53 TRP HZ3 . . 3.540 2.825 2.315 3.517 . 0 0 "[ . 1 . 2]" 1
508 1 29 LEU QD 1 113 THR HA . . 4.090 2.704 2.169 3.271 . 0 0 "[ . 1 . 2]" 1
509 1 29 LEU QD 1 114 ASP H . . 4.160 3.047 2.699 3.388 . 0 0 "[ . 1 . 2]" 1
510 1 29 LEU QD 1 114 ASP HA . . 3.520 2.417 2.015 2.882 . 0 0 "[ . 1 . 2]" 1
511 1 29 LEU QD 1 115 CYS H . . 3.670 3.092 2.637 3.450 . 0 0 "[ . 1 . 2]" 1
512 1 29 LEU QD 1 115 CYS HA . . 5.030 4.074 3.891 4.533 . 0 0 "[ . 1 . 2]" 1
513 1 29 LEU QD 1 115 CYS HB2 . . 3.590 2.957 2.195 3.610 0.020 20 0 "[ . 1 . 2]" 1
514 1 29 LEU QD 1 115 CYS HB3 . . 3.290 2.353 1.911 2.674 . 0 0 "[ . 1 . 2]" 1
515 1 29 LEU HG 1 30 LYS H . . 4.610 4.542 3.978 4.691 0.081 3 0 "[ . 1 . 2]" 1
516 1 29 LEU HG 1 48 PHE HB2 . . 5.250 4.914 3.620 5.825 0.575 7 3 "[ . + 1 -. *]" 1
517 1 30 LYS H 1 30 LYS HB2 . . 3.380 2.399 2.125 2.700 . 0 0 "[ . 1 . 2]" 1
518 1 30 LYS H 1 30 LYS QD . . 4.820 4.120 3.865 4.729 . 0 0 "[ . 1 . 2]" 1
519 1 30 LYS H 1 30 LYS HG3 . . 3.780 2.767 2.246 3.363 . 0 0 "[ . 1 . 2]" 1
520 1 30 LYS H 1 31 SER H . . 3.740 2.436 1.942 2.996 . 0 0 "[ . 1 . 2]" 1
521 1 30 LYS H 1 114 ASP HA . . 3.770 2.579 2.251 2.821 . 0 0 "[ . 1 . 2]" 1
522 1 30 LYS H 1 114 ASP HB2 . . 4.890 3.569 2.774 5.099 0.209 17 0 "[ . 1 . 2]" 1
523 1 30 LYS H 1 115 CYS H . . 4.720 4.106 3.166 4.786 0.066 5 0 "[ . 1 . 2]" 1
524 1 30 LYS HA 1 30 LYS HB2 . . 2.890 2.975 2.969 2.980 0.090 20 0 "[ . 1 . 2]" 1
525 1 30 LYS HA 1 30 LYS HG2 . . 3.530 2.394 2.179 2.659 . 0 0 "[ . 1 . 2]" 1
526 1 30 LYS HA 1 30 LYS HG3 . . 3.770 3.034 2.810 3.241 . 0 0 "[ . 1 . 2]" 1
527 1 30 LYS HA 1 114 ASP HA . . 5.380 5.293 4.846 5.456 0.076 12 0 "[ . 1 . 2]" 1
528 1 30 LYS HB2 1 31 SER H . . 3.540 3.186 2.306 3.613 0.073 8 0 "[ . 1 . 2]" 1
529 1 30 LYS HB2 1 114 ASP HB2 . . 3.880 2.668 2.129 4.232 0.352 17 0 "[ . 1 . 2]" 1
530 1 30 LYS HB3 1 114 ASP HA . . 5.210 5.199 4.741 5.308 0.098 6 0 "[ . 1 . 2]" 1
531 1 30 LYS QD 1 30 LYS HG2 . . 2.400 2.376 2.292 2.446 0.046 6 0 "[ . 1 . 2]" 1
532 1 30 LYS QD 1 114 ASP HB2 . . 4.420 3.318 2.431 5.014 0.594 17 1 "[ . 1 . + 2]" 1
533 1 30 LYS QE 1 30 LYS HG2 . . 2.950 2.417 2.221 2.859 . 0 0 "[ . 1 . 2]" 1
534 1 30 LYS QE 1 30 LYS HG3 . . 3.810 2.418 2.261 2.673 . 0 0 "[ . 1 . 2]" 1
535 1 30 LYS QE 1 113 THR HB . . 3.700 3.467 2.341 3.791 0.091 10 0 "[ . 1 . 2]" 1
536 1 30 LYS QE 1 113 THR MG . . 5.340 4.083 2.324 4.888 . 0 0 "[ . 1 . 2]" 1
537 1 30 LYS HG2 1 31 SER H . . 5.350 5.178 4.866 5.399 0.049 13 0 "[ . 1 . 2]" 1
538 1 30 LYS HG3 1 31 SER H . . 4.970 4.735 4.516 4.936 . 0 0 "[ . 1 . 2]" 1
539 1 30 LYS HG3 1 113 THR HB . . 4.430 4.039 2.921 4.516 0.086 19 0 "[ . 1 . 2]" 1
540 1 31 SER H 1 31 SER HB2 . . 3.370 2.598 2.103 3.400 0.030 5 0 "[ . 1 . 2]" 1
541 1 31 SER H 1 31 SER HB3 . . 3.350 2.729 2.199 3.434 0.084 9 0 "[ . 1 . 2]" 1
542 1 31 SER H 1 114 ASP HA . . 4.450 3.481 2.839 4.024 . 0 0 "[ . 1 . 2]" 1
543 1 31 SER H 1 115 CYS H . . 4.320 3.531 3.314 3.973 . 0 0 "[ . 1 . 2]" 1
544 1 31 SER HB3 1 115 CYS H . . 4.790 3.237 2.236 4.881 0.091 9 0 "[ . 1 . 2]" 1
545 1 32 PRO HA 1 33 ILE HB . . 5.070 4.532 4.253 4.798 . 0 0 "[ . 1 . 2]" 1
546 1 32 PRO HA 1 48 PHE H . . 4.740 3.825 2.550 4.828 0.088 16 0 "[ . 1 . 2]" 1
547 1 32 PRO HB2 1 33 ILE H . . 3.750 3.025 2.589 3.413 . 0 0 "[ . 1 . 2]" 1
548 1 32 PRO HB2 1 45 THR HA . . 4.400 3.926 3.564 4.434 0.034 8 0 "[ . 1 . 2]" 1
549 1 32 PRO HB2 1 45 THR HB . . 3.280 2.614 2.047 3.349 0.069 12 0 "[ . 1 . 2]" 1
550 1 32 PRO HB2 1 45 THR MG . . 4.120 2.998 2.227 3.546 . 0 0 "[ . 1 . 2]" 1
551 1 32 PRO HB2 1 46 PHE H . . 4.050 3.331 2.541 4.118 0.068 10 0 "[ . 1 . 2]" 1
552 1 32 PRO HB3 1 33 ILE H . . 3.740 3.741 3.436 3.823 0.083 5 0 "[ . 1 . 2]" 1
553 1 32 PRO HB3 1 45 THR HB . . 4.080 3.668 3.096 4.163 0.083 6 0 "[ . 1 . 2]" 1
554 1 33 ILE H 1 33 ILE HB . . 3.300 2.373 2.193 2.528 . 0 0 "[ . 1 . 2]" 1
555 1 33 ILE H 1 33 ILE MD . . 4.170 3.466 2.974 3.812 . 0 0 "[ . 1 . 2]" 1
556 1 33 ILE H 1 33 ILE HG12 . . 4.460 3.872 3.517 4.309 . 0 0 "[ . 1 . 2]" 1
557 1 33 ILE H 1 33 ILE HG13 . . 4.000 2.564 2.136 3.111 . 0 0 "[ . 1 . 2]" 1
558 1 33 ILE H 1 33 ILE MG . . 4.220 3.759 3.673 3.836 . 0 0 "[ . 1 . 2]" 1
559 1 33 ILE H 1 46 PHE H . . 4.190 3.024 2.768 3.635 . 0 0 "[ . 1 . 2]" 1
560 1 33 ILE H 1 48 PHE H . . 5.360 4.567 3.679 5.428 0.068 13 0 "[ . 1 . 2]" 1
561 1 33 ILE HA 1 33 ILE MD . . 4.310 3.892 3.795 4.012 . 0 0 "[ . 1 . 2]" 1
562 1 33 ILE HA 1 33 ILE HG12 . . 3.990 2.680 2.431 2.846 . 0 0 "[ . 1 . 2]" 1
563 1 33 ILE HA 1 33 ILE HG13 . . 3.720 2.817 2.494 3.063 . 0 0 "[ . 1 . 2]" 1
564 1 33 ILE HA 1 33 ILE MG . . 3.330 2.508 2.385 2.640 . 0 0 "[ . 1 . 2]" 1
565 1 33 ILE HA 1 34 ALA H . . 2.830 2.238 2.145 2.415 . 0 0 "[ . 1 . 2]" 1
566 1 33 ILE HA 1 34 ALA MB . . 4.070 4.044 3.845 4.154 0.084 8 0 "[ . 1 . 2]" 1
567 1 33 ILE HB 1 33 ILE MD . . 3.300 2.329 2.175 2.433 . 0 0 "[ . 1 . 2]" 1
568 1 33 ILE HB 1 34 ALA H . . 4.810 4.392 4.027 4.605 . 0 0 "[ . 1 . 2]" 1
569 1 33 ILE HB 1 45 THR HA . . 4.910 4.900 4.679 4.990 0.080 12 0 "[ . 1 . 2]" 1
570 1 33 ILE HB 1 46 PHE H . . 4.300 3.274 2.910 3.571 . 0 0 "[ . 1 . 2]" 1
571 1 33 ILE HB 1 46 PHE HB2 . . 3.640 2.484 2.242 2.822 . 0 0 "[ . 1 . 2]" 1
572 1 33 ILE HB 1 46 PHE HB3 . . 3.930 2.846 2.264 3.792 . 0 0 "[ . 1 . 2]" 1
573 1 33 ILE HB 1 46 PHE QD . . 4.420 4.254 3.169 4.504 0.084 11 0 "[ . 1 . 2]" 1
574 1 33 ILE MD 1 33 ILE MG . . 3.110 2.151 2.077 2.328 . 0 0 "[ . 1 . 2]" 1
575 1 33 ILE MD 1 34 ALA H . . 5.500 5.425 5.130 5.575 0.075 6 0 "[ . 1 . 2]" 1
576 1 33 ILE MD 1 35 LEU QD . . 5.200 3.942 3.606 4.410 . 0 0 "[ . 1 . 2]" 1
577 1 33 ILE MD 1 46 PHE HB2 . . 4.650 3.772 3.139 4.190 . 0 0 "[ . 1 . 2]" 1
578 1 33 ILE MD 1 46 PHE HB3 . . 4.770 3.213 2.529 3.701 . 0 0 "[ . 1 . 2]" 1
579 1 33 ILE MD 1 46 PHE QD . . 4.040 3.943 3.019 4.158 0.118 10 0 "[ . 1 . 2]" 1
580 1 33 ILE MD 1 48 PHE HA . . 3.450 2.828 2.332 3.235 . 0 0 "[ . 1 . 2]" 1
581 1 33 ILE MD 1 48 PHE QD . . 3.780 3.450 2.957 3.901 0.121 13 0 "[ . 1 . 2]" 1
582 1 33 ILE MD 1 49 THR H . . 4.320 4.308 3.899 4.422 0.102 9 0 "[ . 1 . 2]" 1
583 1 33 ILE MD 1 52 LYS HD2 . . 4.420 2.947 2.192 3.694 . 0 0 "[ . 1 . 2]" 1
584 1 33 ILE MD 1 52 LYS HD3 . . 3.590 2.184 1.988 2.706 . 0 0 "[ . 1 . 2]" 1
585 1 33 ILE MD 1 52 LYS QE . . 4.100 2.157 1.791 2.750 . 0 0 "[ . 1 . 2]" 1
586 1 33 ILE MD 1 52 LYS HG2 . . 5.500 4.361 3.331 4.602 . 0 0 "[ . 1 . 2]" 1
587 1 33 ILE MD 1 52 LYS HG3 . . 4.900 3.868 1.989 4.645 . 0 0 "[ . 1 . 2]" 1
588 1 33 ILE MD 1 120 TYR HB2 . . 5.390 3.309 2.431 4.306 . 0 0 "[ . 1 . 2]" 1
589 1 33 ILE MD 1 120 TYR HB3 . . 5.330 3.194 2.566 3.858 . 0 0 "[ . 1 . 2]" 1
590 1 33 ILE MD 1 120 TYR QD . . 3.770 3.118 2.682 3.739 . 0 0 "[ . 1 . 2]" 1
591 1 33 ILE MD 1 120 TYR QE . . 4.520 3.714 3.251 4.438 . 0 0 "[ . 1 . 2]" 1
592 1 33 ILE HG12 1 34 ALA H . . 5.160 4.663 4.282 4.893 . 0 0 "[ . 1 . 2]" 1
593 1 33 ILE HG12 1 120 TYR HB2 . . 4.350 2.914 2.344 3.953 . 0 0 "[ . 1 . 2]" 1
594 1 33 ILE HG12 1 120 TYR QD . . 5.230 3.741 3.077 5.006 . 0 0 "[ . 1 . 2]" 1
595 1 33 ILE HG13 1 34 ALA H . . 5.110 4.955 4.683 5.174 0.064 1 0 "[ . 1 . 2]" 1
596 1 33 ILE HG13 1 46 PHE HB2 . . 5.400 4.976 4.511 5.444 0.044 12 0 "[ . 1 . 2]" 1
597 1 33 ILE HG13 1 48 PHE HB3 . . 4.590 3.869 2.783 5.470 0.880 3 1 "[ + . 1 . 2]" 1
598 1 33 ILE HG13 1 48 PHE QD . . 4.740 2.991 2.148 4.784 0.044 11 0 "[ . 1 . 2]" 1
599 1 33 ILE MG 1 34 ALA H . . 3.550 3.109 2.384 3.632 0.082 13 0 "[ . 1 . 2]" 1
600 1 33 ILE MG 1 34 ALA HA . . 4.960 3.978 3.626 4.432 . 0 0 "[ . 1 . 2]" 1
601 1 33 ILE MG 1 46 PHE H . . 4.400 4.057 3.574 4.503 0.103 5 0 "[ . 1 . 2]" 1
602 1 33 ILE MG 1 46 PHE HB2 . . 4.500 2.971 2.386 3.624 . 0 0 "[ . 1 . 2]" 1
603 1 33 ILE MG 1 120 TYR HA . . 4.750 3.939 3.677 4.323 . 0 0 "[ . 1 . 2]" 1
604 1 33 ILE MG 1 120 TYR HB2 . . 3.660 2.795 2.194 3.616 . 0 0 "[ . 1 . 2]" 1
605 1 33 ILE MG 1 120 TYR HB3 . . 3.380 2.160 1.968 2.438 . 0 0 "[ . 1 . 2]" 1
606 1 33 ILE MG 1 120 TYR QD . . 3.310 3.379 3.002 3.447 0.137 3 0 "[ . 1 . 2]" 1
607 1 33 ILE MG 1 121 ASN H . . 5.500 5.268 4.813 5.597 0.097 8 0 "[ . 1 . 2]" 1
608 1 34 ALA H 1 34 ALA MB . . 3.000 2.405 2.238 2.638 . 0 0 "[ . 1 . 2]" 1
609 1 34 ALA H 1 35 LEU QD . . 4.850 3.558 2.523 4.467 . 0 0 "[ . 1 . 2]" 1
610 1 34 ALA H 1 45 THR MG . . 5.290 4.535 3.542 5.057 . 0 0 "[ . 1 . 2]" 1
611 1 34 ALA HA 1 35 LEU H . . 2.860 2.232 2.014 2.330 . 0 0 "[ . 1 . 2]" 1
612 1 34 ALA HA 1 35 LEU QD . . 4.980 3.823 2.971 4.519 . 0 0 "[ . 1 . 2]" 1
613 1 34 ALA HA 1 44 GLN H . . 5.370 4.227 3.912 4.467 . 0 0 "[ . 1 . 2]" 1
614 1 34 ALA HA 1 44 GLN HE21 . . 4.790 4.113 3.478 4.891 0.101 4 0 "[ . 1 . 2]" 1
615 1 34 ALA HA 1 45 THR HA . . 3.380 2.370 2.179 2.644 . 0 0 "[ . 1 . 2]" 1
616 1 34 ALA HA 1 45 THR HB . . 4.690 4.484 3.796 4.752 0.062 17 0 "[ . 1 . 2]" 1
617 1 34 ALA HA 1 45 THR MG . . 3.300 2.962 2.355 3.393 0.093 6 0 "[ . 1 . 2]" 1
618 1 34 ALA HA 1 46 PHE H . . 4.000 3.821 3.556 4.071 0.071 9 0 "[ . 1 . 2]" 1
619 1 34 ALA MB 1 35 LEU H . . 3.390 3.265 2.797 3.491 0.101 5 0 "[ . 1 . 2]" 1
620 1 34 ALA MB 1 35 LEU HA . . 4.690 4.221 3.961 4.403 . 0 0 "[ . 1 . 2]" 1
621 1 34 ALA MB 1 45 THR HA . . 3.950 3.414 2.947 3.772 . 0 0 "[ . 1 . 2]" 1
622 1 34 ALA MB 1 45 THR HB . . 4.650 4.382 3.851 4.745 0.095 6 0 "[ . 1 . 2]" 1
623 1 34 ALA MB 1 45 THR MG . . 3.510 2.371 2.099 3.122 . 0 0 "[ . 1 . 2]" 1
624 1 35 LEU H 1 35 LEU HB3 . . 4.180 3.803 3.358 4.008 . 0 0 "[ . 1 . 2]" 1
625 1 35 LEU H 1 35 LEU QD . . 4.210 3.085 2.204 3.719 . 0 0 "[ . 1 . 2]" 1
626 1 35 LEU H 1 35 LEU HG . . 4.220 3.677 2.827 4.324 0.104 8 0 "[ . 1 . 2]" 1
627 1 35 LEU H 1 36 LEU H . . 4.950 4.368 4.239 4.499 . 0 0 "[ . 1 . 2]" 1
628 1 35 LEU H 1 44 GLN HB3 . . 4.570 2.905 2.308 4.638 0.068 4 0 "[ . 1 . 2]" 1
629 1 35 LEU H 1 44 GLN QG . . 4.330 4.167 1.657 4.436 0.106 20 0 "[ . 1 . 2]" 1
630 1 35 LEU H 1 45 THR HA . . 3.910 3.788 3.281 3.990 0.080 10 0 "[ . 1 . 2]" 1
631 1 35 LEU HA 1 35 LEU QD . . 2.940 2.220 2.102 2.499 . 0 0 "[ . 1 . 2]" 1
632 1 35 LEU HA 1 36 LEU H . . 3.150 2.580 2.150 2.863 . 0 0 "[ . 1 . 2]" 1
633 1 35 LEU HA 1 122 PHE HA . . 3.670 3.358 2.524 3.742 0.072 19 0 "[ . 1 . 2]" 1
634 1 35 LEU HB2 1 35 LEU QD . . 2.990 2.202 2.119 2.278 . 0 0 "[ . 1 . 2]" 1
635 1 35 LEU HB2 1 36 LEU H . . 3.900 3.196 2.740 3.964 0.064 8 0 "[ . 1 . 2]" 1
636 1 35 LEU HB2 1 44 GLN HE21 . . 4.480 2.929 2.004 4.568 0.088 17 0 "[ . 1 . 2]" 1
637 1 35 LEU HB3 1 36 LEU H . . 3.950 2.184 1.860 2.759 . 0 0 "[ . 1 . 2]" 1
638 1 35 LEU HB3 1 124 LEU H . . 4.670 4.429 3.080 4.762 0.092 18 0 "[ . 1 . 2]" 1
639 1 35 LEU HB3 1 126 ILE HA . . 5.040 4.897 4.304 5.530 0.490 15 0 "[ . 1 . 2]" 1
640 1 35 LEU QD 1 36 LEU H . . 3.710 3.506 3.144 3.665 . 0 0 "[ . 1 . 2]" 1
641 1 35 LEU QD 1 44 GLN HE22 . . 5.500 2.981 2.209 4.043 . 0 0 "[ . 1 . 2]" 1
642 1 35 LEU QD 1 120 TYR HB3 . . 4.600 2.846 2.378 3.623 . 0 0 "[ . 1 . 2]" 1
643 1 35 LEU QD 1 122 PHE H . . 4.430 4.281 4.089 4.478 0.048 12 0 "[ . 1 . 2]" 1
644 1 35 LEU QD 1 122 PHE HA . . 3.320 2.923 2.323 3.378 0.058 16 0 "[ . 1 . 2]" 1
645 1 35 LEU QD 1 122 PHE QD . . 4.810 4.067 3.047 4.805 . 0 0 "[ . 1 . 2]" 1
646 1 35 LEU QD 1 123 ASP H . . 5.260 4.630 4.169 5.009 . 0 0 "[ . 1 . 2]" 1
647 1 35 LEU QD 1 124 LEU H . . 3.720 3.205 2.470 3.727 0.007 7 0 "[ . 1 . 2]" 1
648 1 35 LEU QD 1 124 LEU QB . . 3.270 2.306 1.908 3.188 . 0 0 "[ . 1 . 2]" 1
649 1 35 LEU QD 1 124 LEU HG . . 3.840 3.337 2.800 3.589 . 0 0 "[ . 1 . 2]" 1
650 1 35 LEU QD 1 126 ILE H . . 5.500 4.070 3.577 4.894 . 0 0 "[ . 1 . 2]" 1
651 1 35 LEU QD 1 126 ILE HA . . 3.490 3.261 2.596 3.558 0.068 20 0 "[ . 1 . 2]" 1
652 1 35 LEU QD 1 126 ILE MD . . 3.920 3.658 3.239 3.935 0.015 17 0 "[ . 1 . 2]" 1
653 1 35 LEU QD 1 126 ILE HG12 . . 4.220 3.301 2.475 4.264 0.044 17 0 "[ . 1 . 2]" 1
654 1 35 LEU QD 1 126 ILE HG13 . . 4.200 2.747 2.315 3.582 . 0 0 "[ . 1 . 2]" 1
655 1 35 LEU QD 1 129 LEU QD . . 3.630 1.972 1.841 2.119 . 0 0 "[ . 1 . 2]" 1
656 1 35 LEU HG 1 36 LEU H . . 4.700 4.537 3.516 4.773 0.073 12 0 "[ . 1 . 2]" 1
657 1 35 LEU HG 1 120 TYR HB3 . . 4.870 4.704 4.254 4.954 0.084 19 0 "[ . 1 . 2]" 1
658 1 36 LEU H 1 36 LEU HB2 . . 3.080 2.484 2.135 2.756 . 0 0 "[ . 1 . 2]" 1
659 1 36 LEU H 1 36 LEU HB3 . . 3.690 3.624 3.169 3.747 0.057 17 0 "[ . 1 . 2]" 1
660 1 36 LEU HA 1 36 LEU HG . . 4.150 3.204 2.353 3.800 . 0 0 "[ . 1 . 2]" 1
661 1 36 LEU HA 1 37 LYS H . . 2.930 2.212 2.112 2.335 . 0 0 "[ . 1 . 2]" 1
662 1 36 LEU HB2 1 37 LYS H . . 4.380 4.188 3.684 4.444 0.064 10 0 "[ . 1 . 2]" 1
663 1 36 LEU HB2 1 40 GLY HA2 . . 5.320 5.202 4.581 5.397 0.077 1 0 "[ . 1 . 2]" 1
664 1 36 LEU HB3 1 37 LYS H . . 3.980 3.216 2.791 3.616 . 0 0 "[ . 1 . 2]" 1
665 1 36 LEU HB3 1 40 GLY HA2 . . 4.480 4.149 3.563 4.552 0.072 7 0 "[ . 1 . 2]" 1
666 1 36 LEU QD 1 37 LYS H . . 4.400 3.592 3.280 3.992 . 0 0 "[ . 1 . 2]" 1
667 1 36 LEU QD 1 40 GLY H . . 5.100 4.530 2.801 5.189 0.089 2 0 "[ . 1 . 2]" 1
668 1 36 LEU QD 1 40 GLY HA2 . . 4.230 3.511 2.172 4.188 . 0 0 "[ . 1 . 2]" 1
669 1 36 LEU QD 1 40 GLY HA3 . . 4.300 4.300 3.567 4.442 0.142 8 0 "[ . 1 . 2]" 1
670 1 36 LEU QD 1 41 GLU H . . 5.280 4.070 3.614 4.815 . 0 0 "[ . 1 . 2]" 1
671 1 36 LEU QD 1 41 GLU HA . . 3.740 2.329 1.819 3.669 . 0 0 "[ . 1 . 2]" 1
672 1 36 LEU QD 1 42 THR H . . 5.450 2.629 1.796 3.374 . 0 0 "[ . 1 . 2]" 1
673 1 36 LEU QD 1 42 THR HA . . 5.070 4.408 4.061 5.039 . 0 0 "[ . 1 . 2]" 1
674 1 36 LEU QD 1 43 GLU H . . 5.060 4.818 4.152 5.176 0.116 1 0 "[ . 1 . 2]" 1
675 1 36 LEU HG 1 41 GLU HA . . 5.250 4.669 3.841 5.329 0.079 4 0 "[ . 1 . 2]" 1
676 1 37 LYS H 1 37 LYS HB2 . . 3.250 2.541 2.216 2.805 . 0 0 "[ . 1 . 2]" 1
677 1 37 LYS H 1 37 LYS HB3 . . 3.670 3.601 3.495 3.714 0.044 9 0 "[ . 1 . 2]" 1
678 1 37 LYS H 1 37 LYS HD2 . . 4.160 4.033 3.136 4.248 0.088 3 0 "[ . 1 . 2]" 1
679 1 37 LYS H 1 37 LYS HD3 . . 4.200 4.067 3.820 4.263 0.063 16 0 "[ . 1 . 2]" 1
680 1 37 LYS H 1 37 LYS HG2 . . 3.800 3.359 2.225 3.882 0.082 20 0 "[ . 1 . 2]" 1
681 1 37 LYS H 1 37 LYS HG3 . . 3.630 2.394 1.906 3.710 0.080 7 0 "[ . 1 . 2]" 1
682 1 37 LYS H 1 42 THR HB . . 4.380 2.638 1.774 3.521 . 0 0 "[ . 1 . 2]" 1
683 1 37 LYS H 1 126 ILE MD . . 3.710 3.558 3.287 3.807 0.097 17 0 "[ . 1 . 2]" 1
684 1 37 LYS HA 1 37 LYS HD2 . . 5.500 4.640 2.298 5.070 . 0 0 "[ . 1 . 2]" 1
685 1 37 LYS HA 1 37 LYS HD3 . . 4.720 4.569 3.905 4.781 0.061 12 0 "[ . 1 . 2]" 1
686 1 37 LYS HA 1 37 LYS HG2 . . 3.420 2.777 2.546 3.468 0.048 7 0 "[ . 1 . 2]" 1
687 1 37 LYS HA 1 37 LYS HG3 . . 3.850 3.192 2.728 3.923 0.073 17 0 "[ . 1 . 2]" 1
688 1 37 LYS HA 1 38 ASP H . . 2.790 2.658 2.313 2.866 0.076 11 0 "[ . 1 . 2]" 1
689 1 37 LYS HA 1 126 ILE MD . . 3.130 2.080 1.952 2.750 . 0 0 "[ . 1 . 2]" 1
690 1 37 LYS HA 1 126 ILE HG13 . . 4.520 4.497 4.033 4.600 0.080 7 0 "[ . 1 . 2]" 1
691 1 37 LYS HB2 1 37 LYS QE . . 4.940 3.685 2.928 4.183 . 0 0 "[ . 1 . 2]" 1
692 1 37 LYS HB2 1 39 ASP H . . 4.260 3.149 2.463 4.300 0.040 1 0 "[ . 1 . 2]" 1
693 1 37 LYS HB2 1 42 THR HB . . 4.010 2.522 2.107 2.963 . 0 0 "[ . 1 . 2]" 1
694 1 37 LYS HB3 1 37 LYS QE . . 4.390 2.919 1.987 3.793 . 0 0 "[ . 1 . 2]" 1
695 1 37 LYS HB3 1 42 THR HB . . 4.220 4.038 3.688 4.301 0.081 3 0 "[ . 1 . 2]" 1
696 1 37 LYS HD2 1 42 THR HB . . 3.930 3.132 2.191 4.035 0.105 17 0 "[ . 1 . 2]" 1
697 1 37 LYS HD2 1 44 GLN QG . . 3.540 3.134 2.239 3.640 0.100 20 0 "[ . 1 . 2]" 1
698 1 37 LYS HD2 1 126 ILE MD . . 5.260 3.972 2.159 4.743 . 0 0 "[ . 1 . 2]" 1
699 1 37 LYS HD3 1 42 THR HB . . 3.860 2.813 2.263 3.948 0.088 7 0 "[ . 1 . 2]" 1
700 1 37 LYS QE 1 126 ILE MD . . 5.480 3.326 2.061 4.058 . 0 0 "[ . 1 . 2]" 1
701 1 37 LYS HG2 1 42 THR HB . . 4.880 3.910 1.866 4.906 0.026 8 0 "[ . 1 . 2]" 1
702 1 37 LYS HG2 1 44 GLN QG . . 4.460 3.166 2.250 4.510 0.050 17 0 "[ . 1 . 2]" 1
703 1 37 LYS HG3 1 42 THR HB . . 4.690 2.742 2.063 3.946 . 0 0 "[ . 1 . 2]" 1
704 1 38 ASP H 1 38 ASP HB2 . . 3.240 2.958 1.909 3.565 0.325 3 0 "[ . 1 . 2]" 1
705 1 38 ASP H 1 38 ASP HB3 . . 3.750 2.934 2.343 3.817 0.067 16 0 "[ . 1 . 2]" 1
706 1 38 ASP H 1 39 ASP H . . 3.520 3.073 2.700 3.428 . 0 0 "[ . 1 . 2]" 1
707 1 38 ASP H 1 126 ILE MD . . 4.570 3.936 3.560 4.651 0.081 8 0 "[ . 1 . 2]" 1
708 1 38 ASP HA 1 38 ASP HB2 . . 2.710 2.532 2.407 2.793 0.083 17 0 "[ . 1 . 2]" 1
709 1 38 ASP HA 1 39 ASP H . . 3.310 3.059 2.685 3.389 0.079 16 0 "[ . 1 . 2]" 1
710 1 38 ASP HA 1 40 GLY H . . 3.740 3.581 2.769 3.828 0.088 17 0 "[ . 1 . 2]" 1
711 1 39 ASP H 1 39 ASP HB2 . . 3.410 2.983 2.085 3.475 0.065 20 0 "[ . 1 . 2]" 1
712 1 39 ASP H 1 39 ASP HB3 . . 3.940 2.969 2.452 3.724 . 0 0 "[ . 1 . 2]" 1
713 1 39 ASP H 1 40 GLY H . . 3.320 2.352 1.735 2.982 . 0 0 "[ . 1 . 2]" 1
714 1 39 ASP H 1 40 GLY HA2 . . 5.030 4.339 3.804 5.083 0.053 16 0 "[ . 1 . 2]" 1
715 1 39 ASP H 1 41 GLU H . . 5.360 5.385 4.724 5.445 0.085 3 0 "[ . 1 . 2]" 1
716 1 39 ASP H 1 42 THR H . . 5.240 4.464 3.778 5.088 . 0 0 "[ . 1 . 2]" 1
717 1 39 ASP HA 1 39 ASP HB2 . . 2.900 2.590 2.365 2.980 0.080 3 0 "[ . 1 . 2]" 1
718 1 39 ASP HA 1 39 ASP HB3 . . 2.900 2.931 2.542 2.986 0.086 5 0 "[ . 1 . 2]" 1
719 1 39 ASP HB2 1 40 GLY H . . 4.620 4.332 3.691 4.604 . 0 0 "[ . 1 . 2]" 1
720 1 39 ASP HB3 1 42 THR H . . 5.200 4.490 3.327 5.227 0.027 3 0 "[ . 1 . 2]" 1
721 1 40 GLY H 1 42 THR H . . 4.760 4.544 3.577 4.837 0.077 17 0 "[ . 1 . 2]" 1
722 1 41 GLU H 1 41 GLU HB2 . . 3.500 2.933 2.367 3.687 0.187 16 0 "[ . 1 . 2]" 1
723 1 41 GLU H 1 41 GLU HB3 . . 3.590 3.369 2.610 3.672 0.082 17 0 "[ . 1 . 2]" 1
724 1 41 GLU H 1 41 GLU HG2 . . 3.900 3.018 2.067 3.786 . 0 0 "[ . 1 . 2]" 1
725 1 41 GLU H 1 41 GLU HG3 . . 3.990 2.778 2.277 3.571 . 0 0 "[ . 1 . 2]" 1
726 1 41 GLU H 1 42 THR H . . 3.500 3.335 2.922 3.581 0.081 10 0 "[ . 1 . 2]" 1
727 1 41 GLU HA 1 41 GLU HG2 . . 3.800 2.966 2.270 3.883 0.083 13 0 "[ . 1 . 2]" 1
728 1 41 GLU HA 1 41 GLU HG3 . . 3.710 3.484 3.023 3.781 0.071 8 0 "[ . 1 . 2]" 1
729 1 41 GLU HB2 1 42 THR H . . 4.340 4.340 4.152 4.421 0.081 11 0 "[ . 1 . 2]" 1
730 1 41 GLU HB3 1 42 THR H . . 4.280 4.332 4.080 4.431 0.151 2 0 "[ . 1 . 2]" 1
731 1 42 THR H 1 42 THR HB . . 3.540 3.314 2.562 3.617 0.077 10 0 "[ . 1 . 2]" 1
732 1 42 THR H 1 42 THR MG . . 3.930 3.414 1.975 3.685 . 0 0 "[ . 1 . 2]" 1
733 1 42 THR HA 1 43 GLU H . . 2.710 2.209 1.969 2.615 . 0 0 "[ . 1 . 2]" 1
734 1 42 THR HA 1 43 GLU QB . . 4.270 4.284 4.057 4.353 0.083 20 0 "[ . 1 . 2]" 1
735 1 42 THR HB 1 43 GLU H . . 3.640 3.365 2.485 3.711 0.071 8 0 "[ . 1 . 2]" 1
736 1 42 THR MG 1 43 GLU H . . 3.150 2.981 2.214 3.257 0.107 18 0 "[ . 1 . 2]" 1
737 1 43 GLU H 1 43 GLU QB . . 2.850 2.468 2.234 2.863 0.013 4 0 "[ . 1 . 2]" 1
738 1 43 GLU H 1 43 GLU QG . . 3.690 2.468 1.931 3.382 . 0 0 "[ . 1 . 2]" 1
739 1 43 GLU HA 1 43 GLU QG . . 3.810 3.035 2.172 3.410 . 0 0 "[ . 1 . 2]" 1
740 1 43 GLU HA 1 44 GLN H . . 2.810 2.223 2.081 2.339 . 0 0 "[ . 1 . 2]" 1
741 1 43 GLU HA 1 44 GLN HB3 . . 5.040 4.698 4.391 5.093 0.053 11 0 "[ . 1 . 2]" 1
742 1 43 GLU QB 1 44 GLN H . . 4.010 3.098 2.704 3.612 . 0 0 "[ . 1 . 2]" 1
743 1 43 GLU QB 1 45 THR MG . . 4.660 4.305 3.803 4.755 0.095 13 0 "[ . 1 . 2]" 1
744 1 43 GLU QG 1 44 GLN H . . 4.240 3.900 3.216 4.170 . 0 0 "[ . 1 . 2]" 1
745 1 44 GLN H 1 44 GLN HB3 . . 3.500 2.986 2.710 3.395 . 0 0 "[ . 1 . 2]" 1
746 1 44 GLN H 1 44 GLN HE21 . . 5.500 4.847 4.393 5.398 . 0 0 "[ . 1 . 2]" 1
747 1 44 GLN H 1 45 THR H . . 4.690 4.283 4.176 4.378 . 0 0 "[ . 1 . 2]" 1
748 1 44 GLN H 1 126 ILE MD . . 5.450 5.432 4.682 5.555 0.105 12 0 "[ . 1 . 2]" 1
749 1 44 GLN HA 1 44 GLN HE21 . . 5.070 4.361 3.199 4.662 . 0 0 "[ . 1 . 2]" 1
750 1 44 GLN HA 1 44 GLN QG . . 3.110 2.463 2.250 3.232 0.122 4 0 "[ . 1 . 2]" 1
751 1 44 GLN HA 1 45 THR H . . 2.640 2.395 2.262 2.497 . 0 0 "[ . 1 . 2]" 1
752 1 44 GLN HB3 1 44 GLN HE21 . . 3.830 2.228 1.848 3.248 . 0 0 "[ . 1 . 2]" 1
753 1 44 GLN HB3 1 45 THR H . . 3.990 3.822 3.589 4.044 0.054 14 0 "[ . 1 . 2]" 1
754 1 44 GLN HB3 1 126 ILE MD . . 3.760 3.090 2.345 3.442 . 0 0 "[ . 1 . 2]" 1
755 1 44 GLN HE21 1 44 GLN QG . . 2.960 2.609 2.337 2.883 . 0 0 "[ . 1 . 2]" 1
756 1 44 GLN HE21 1 45 THR H . . 4.070 3.969 2.047 4.152 0.082 7 0 "[ . 1 . 2]" 1
757 1 44 GLN HE21 1 126 ILE MD . . 3.180 3.003 2.356 3.275 0.095 20 0 "[ . 1 . 2]" 1
758 1 44 GLN HE21 1 126 ILE HG12 . . 3.780 3.136 2.423 3.445 . 0 0 "[ . 1 . 2]" 1
759 1 44 GLN HE21 1 126 ILE HG13 . . 4.020 3.706 2.755 4.099 0.079 19 0 "[ . 1 . 2]" 1
760 1 44 GLN HE22 1 45 THR H . . 5.500 4.577 3.426 5.543 0.043 16 0 "[ . 1 . 2]" 1
761 1 44 GLN HE22 1 126 ILE MD . . 5.190 3.333 2.308 4.418 . 0 0 "[ . 1 . 2]" 1
762 1 44 GLN QG 1 45 THR H . . 3.220 2.720 2.063 3.331 0.111 4 0 "[ . 1 . 2]" 1
763 1 44 GLN QG 1 45 THR HA . . 5.190 4.324 3.597 5.179 . 0 0 "[ . 1 . 2]" 1
764 1 44 GLN QG 1 126 ILE MD . . 3.540 2.695 1.951 3.660 0.120 13 0 "[ . 1 . 2]" 1
765 1 44 GLN QG 1 126 ILE HG12 . . 4.120 3.709 2.307 4.235 0.115 20 0 "[ . 1 . 2]" 1
766 1 45 THR H 1 45 THR MG . . 3.200 3.254 3.086 3.308 0.108 15 0 "[ . 1 . 2]" 1
767 1 45 THR HA 1 45 THR MG . . 3.060 2.288 2.139 2.384 . 0 0 "[ . 1 . 2]" 1
768 1 45 THR HA 1 46 PHE H . . 3.070 2.244 2.069 2.409 . 0 0 "[ . 1 . 2]" 1
769 1 45 THR HA 1 46 PHE QD . . 4.220 4.227 3.920 4.325 0.105 20 0 "[ . 1 . 2]" 1
770 1 45 THR HB 1 46 PHE H . . 3.660 2.737 2.373 3.237 . 0 0 "[ . 1 . 2]" 1
771 1 45 THR MG 1 46 PHE H . . 3.590 3.627 3.405 3.709 0.119 6 0 "[ . 1 . 2]" 1
772 1 46 PHE H 1 46 PHE HB2 . . 4.060 2.519 2.392 2.673 . 0 0 "[ . 1 . 2]" 1
773 1 46 PHE H 1 46 PHE HB3 . . 4.130 3.433 3.270 3.716 . 0 0 "[ . 1 . 2]" 1
774 1 46 PHE H 1 46 PHE QD . . 3.940 3.703 3.387 3.900 . 0 0 "[ . 1 . 2]" 1
775 1 46 PHE HA 1 46 PHE QD . . 3.170 2.551 2.283 2.874 . 0 0 "[ . 1 . 2]" 1
776 1 46 PHE HA 1 47 PRO HG2 . . 4.480 4.564 4.476 4.699 0.219 19 0 "[ . 1 . 2]" 1
777 1 46 PHE HB3 1 47 PRO HG2 . . 5.500 4.358 3.845 4.810 . 0 0 "[ . 1 . 2]" 1
778 1 46 PHE HB3 1 129 LEU QD . . 5.110 3.868 3.228 4.350 . 0 0 "[ . 1 . 2]" 1
779 1 46 PHE QD 1 129 LEU QD . . 3.130 2.744 2.322 3.210 0.080 13 0 "[ . 1 . 2]" 1
780 1 47 PRO HA 1 48 PHE H . . 3.490 2.233 2.145 2.344 . 0 0 "[ . 1 . 2]" 1
781 1 47 PRO QB 1 48 PHE H . . 3.890 3.286 2.737 3.628 . 0 0 "[ . 1 . 2]" 1
782 1 48 PHE H 1 48 PHE HB2 . . 4.160 2.897 2.211 3.582 . 0 0 "[ . 1 . 2]" 1
783 1 48 PHE H 1 48 PHE HB3 . . 4.070 3.035 2.618 3.472 . 0 0 "[ . 1 . 2]" 1
784 1 48 PHE H 1 49 THR MG . . 4.650 3.732 2.854 4.374 . 0 0 "[ . 1 . 2]" 1
785 1 48 PHE HA 1 49 THR H . . 3.120 2.340 2.227 2.538 . 0 0 "[ . 1 . 2]" 1
786 1 48 PHE HA 1 52 LYS HD2 . . 3.500 2.219 1.938 3.823 0.323 14 0 "[ . 1 . 2]" 1
787 1 48 PHE HA 1 52 LYS HD3 . . 3.750 2.884 2.024 3.815 0.065 12 0 "[ . 1 . 2]" 1
788 1 48 PHE HA 1 52 LYS QE . . 3.350 3.310 3.110 3.370 0.020 19 0 "[ . 1 . 2]" 1
789 1 48 PHE HA 1 52 LYS HG3 . . 3.880 3.677 2.673 3.948 0.068 11 0 "[ . 1 . 2]" 1
790 1 48 PHE HB3 1 49 THR H . . 5.020 4.332 3.845 4.566 . 0 0 "[ . 1 . 2]" 1
791 1 49 THR H 1 49 THR MG . . 3.610 2.894 2.347 3.705 0.095 16 0 "[ . 1 . 2]" 1
792 1 49 THR H 1 52 LYS HD2 . . 3.950 2.328 1.840 3.095 . 0 0 "[ . 1 . 2]" 1
793 1 49 THR H 1 52 LYS HD3 . . 4.600 3.483 1.920 4.562 . 0 0 "[ . 1 . 2]" 1
794 1 49 THR H 1 52 LYS QE . . 5.500 3.882 3.340 4.400 . 0 0 "[ . 1 . 2]" 1
795 1 49 THR H 1 52 LYS HG3 . . 5.080 2.992 2.271 4.167 . 0 0 "[ . 1 . 2]" 1
796 1 49 THR HA 1 49 THR MG . . 3.090 2.328 2.190 2.469 . 0 0 "[ . 1 . 2]" 1
797 1 49 THR HA 1 50 ARG H . . 3.480 2.647 2.436 2.924 . 0 0 "[ . 1 . 2]" 1
798 1 49 THR HA 1 50 ARG HA . . 4.950 4.400 4.276 4.525 . 0 0 "[ . 1 . 2]" 1
799 1 49 THR HA 1 50 ARG HB2 . . 5.430 4.727 4.421 4.931 . 0 0 "[ . 1 . 2]" 1
800 1 49 THR HB 1 50 ARG H . . 3.190 2.210 2.001 2.824 . 0 0 "[ . 1 . 2]" 1
801 1 49 THR HB 1 51 GLU H . . 4.390 2.964 2.434 3.426 . 0 0 "[ . 1 . 2]" 1
802 1 49 THR MG 1 50 ARG H . . 3.790 3.621 3.256 3.779 . 0 0 "[ . 1 . 2]" 1
803 1 50 ARG H 1 50 ARG HB2 . . 3.440 2.467 2.191 2.788 . 0 0 "[ . 1 . 2]" 1
804 1 50 ARG H 1 50 ARG HB3 . . 3.240 2.472 2.274 2.763 . 0 0 "[ . 1 . 2]" 1
805 1 50 ARG H 1 50 ARG HD3 . . 5.130 4.772 4.239 5.906 0.776 7 2 "[ . + 1 -. 2]" 1
806 1 50 ARG H 1 50 ARG QG . . 4.310 3.943 3.851 4.064 . 0 0 "[ . 1 . 2]" 1
807 1 50 ARG H 1 51 GLU H . . 3.950 2.685 2.367 2.821 . 0 0 "[ . 1 . 2]" 1
808 1 50 ARG HA 1 50 ARG QG . . 3.250 2.438 2.243 2.635 . 0 0 "[ . 1 . 2]" 1
809 1 50 ARG HA 1 52 LYS H . . 5.500 3.603 3.337 3.887 . 0 0 "[ . 1 . 2]" 1
810 1 50 ARG HA 1 53 TRP H . . 4.750 3.964 3.333 4.810 0.060 13 0 "[ . 1 . 2]" 1
811 1 50 ARG HA 1 53 TRP QB . . 3.990 2.857 2.543 3.444 . 0 0 "[ . 1 . 2]" 1
812 1 50 ARG HB2 1 50 ARG HD2 . . 3.710 3.082 2.532 3.791 0.081 5 0 "[ . 1 . 2]" 1
813 1 50 ARG HB2 1 50 ARG HD3 . . 3.770 2.849 2.256 3.778 0.008 16 0 "[ . 1 . 2]" 1
814 1 50 ARG HB2 1 51 GLU H . . 4.940 4.094 3.907 4.381 . 0 0 "[ . 1 . 2]" 1
815 1 50 ARG HB3 1 50 ARG HD2 . . 3.940 3.350 2.413 3.871 . 0 0 "[ . 1 . 2]" 1
816 1 50 ARG HB3 1 51 GLU H . . 3.520 3.013 2.812 3.401 . 0 0 "[ . 1 . 2]" 1
817 1 50 ARG QG 1 51 GLU H . . 4.820 3.966 3.577 4.412 . 0 0 "[ . 1 . 2]" 1
818 1 50 ARG QG 1 51 GLU HA . . 4.470 4.007 3.497 4.554 0.084 16 0 "[ . 1 . 2]" 1
819 1 51 GLU H 1 51 GLU HB2 . . 3.260 2.160 1.932 3.478 0.218 19 0 "[ . 1 . 2]" 1
820 1 51 GLU H 1 51 GLU HB3 . . 4.190 2.694 2.259 3.065 . 0 0 "[ . 1 . 2]" 1
821 1 51 GLU H 1 51 GLU HG3 . . 4.970 4.291 3.636 4.436 . 0 0 "[ . 1 . 2]" 1
822 1 51 GLU H 1 52 LYS H . . 3.390 3.125 2.836 3.467 0.077 4 0 "[ . 1 . 2]" 1
823 1 51 GLU H 1 53 TRP H . . 4.790 4.719 4.306 4.873 0.083 14 0 "[ . 1 . 2]" 1
824 1 51 GLU HA 1 51 GLU HG3 . . 4.090 2.491 2.193 3.824 . 0 0 "[ . 1 . 2]" 1
825 1 51 GLU HA 1 137 GLN HE21 . . 4.150 4.045 3.210 4.552 0.402 3 0 "[ . 1 . 2]" 1
826 1 51 GLU HA 1 137 GLN HE22 . . 4.520 3.569 2.827 4.592 0.072 5 0 "[ . 1 . 2]" 1
827 1 51 GLU HB3 1 133 ILE MG . . 5.320 4.424 3.636 5.276 . 0 0 "[ . 1 . 2]" 1
828 1 51 GLU HG2 1 133 ILE MD . . 5.260 4.950 4.107 5.365 0.105 11 0 "[ . 1 . 2]" 1
829 1 51 GLU HG2 1 133 ILE MG . . 4.530 4.138 3.413 4.634 0.104 18 0 "[ . 1 . 2]" 1
830 1 51 GLU HG3 1 133 ILE MG . . 4.370 3.999 3.280 4.472 0.102 2 0 "[ . 1 . 2]" 1
831 1 52 LYS H 1 52 LYS HD3 . . 5.500 5.012 3.907 5.547 0.047 4 0 "[ . 1 . 2]" 1
832 1 52 LYS H 1 52 LYS HG2 . . 3.850 3.039 2.511 3.893 0.043 13 0 "[ . 1 . 2]" 1
833 1 52 LYS H 1 52 LYS HG3 . . 4.240 2.981 2.568 4.008 . 0 0 "[ . 1 . 2]" 1
834 1 52 LYS H 1 53 TRP HA . . 4.170 4.232 4.135 4.263 0.093 9 0 "[ . 1 . 2]" 1
835 1 52 LYS H 1 53 TRP QB . . 4.570 3.454 3.148 3.825 . 0 0 "[ . 1 . 2]" 1
836 1 52 LYS HA 1 52 LYS HD3 . . 5.320 4.750 4.461 5.251 . 0 0 "[ . 1 . 2]" 1
837 1 52 LYS HA 1 52 LYS HG3 . . 4.020 3.710 3.310 4.103 0.083 14 0 "[ . 1 . 2]" 1
838 1 52 LYS HA 1 120 TYR QE . . 4.630 4.171 3.649 4.685 0.055 8 0 "[ . 1 . 2]" 1
839 1 52 LYS HA 1 133 ILE MD . . 5.080 4.515 3.974 5.007 . 0 0 "[ . 1 . 2]" 1
840 1 52 LYS HA 1 133 ILE HG12 . . 5.160 3.931 3.464 4.588 . 0 0 "[ . 1 . 2]" 1
841 1 52 LYS HA 1 133 ILE MG . . 3.850 2.708 2.203 3.650 . 0 0 "[ . 1 . 2]" 1
842 1 52 LYS HD3 1 133 ILE MD . . 4.650 4.672 4.073 5.380 0.730 14 2 "[ . 1- +. 2]" 1
843 1 52 LYS QE 1 129 LEU QD . . 4.850 3.330 2.779 3.853 . 0 0 "[ . 1 . 2]" 1
844 1 52 LYS QE 1 133 ILE MD . . 4.300 2.696 2.219 3.451 . 0 0 "[ . 1 . 2]" 1
845 1 52 LYS HG2 1 53 TRP H . . 4.960 4.603 3.841 5.037 0.077 13 0 "[ . 1 . 2]" 1
846 1 53 TRP H 1 53 TRP QB . . 3.100 2.268 2.169 2.470 . 0 0 "[ . 1 . 2]" 1
847 1 53 TRP H 1 54 ALA H . . 4.610 4.576 4.415 4.663 0.053 16 0 "[ . 1 . 2]" 1
848 1 53 TRP HA 1 53 TRP HE3 . . 3.420 3.015 2.286 3.484 0.064 18 0 "[ . 1 . 2]" 1
849 1 53 TRP HA 1 54 ALA H . . 3.100 2.388 2.163 2.691 . 0 0 "[ . 1 . 2]" 1
850 1 53 TRP QB 1 53 TRP HD1 . . 3.130 2.575 2.394 2.826 . 0 0 "[ . 1 . 2]" 1
851 1 53 TRP QB 1 54 ALA H . . 4.480 3.524 3.118 3.942 . 0 0 "[ . 1 . 2]" 1
852 1 53 TRP HD1 1 54 ALA HA . . 4.420 3.810 3.378 4.152 . 0 0 "[ . 1 . 2]" 1
853 1 53 TRP HD1 1 55 LEU H . . 4.460 4.055 3.266 4.555 0.095 5 0 "[ . 1 . 2]" 1
854 1 53 TRP HD1 1 55 LEU HA . . 4.250 3.612 3.170 4.177 . 0 0 "[ . 1 . 2]" 1
855 1 53 TRP HD1 1 55 LEU QD . . 2.820 2.423 1.929 2.856 0.036 8 0 "[ . 1 . 2]" 1
856 1 53 TRP HD1 1 55 LEU HG . . 4.630 3.390 2.422 4.670 0.040 20 0 "[ . 1 . 2]" 1
857 1 53 TRP HE1 1 55 LEU H . . 5.500 4.463 3.941 4.806 . 0 0 "[ . 1 . 2]" 1
858 1 53 TRP HE1 1 55 LEU HA . . 3.430 2.324 1.817 2.764 . 0 0 "[ . 1 . 2]" 1
859 1 53 TRP HE1 1 55 LEU QD . . 3.420 2.243 1.947 2.866 . 0 0 "[ . 1 . 2]" 1
860 1 53 TRP HE1 1 56 LEU H . . 4.080 3.753 2.937 4.168 0.088 10 0 "[ . 1 . 2]" 1
861 1 53 TRP HE1 1 56 LEU HG . . 4.920 3.933 2.923 4.992 0.072 14 0 "[ . 1 . 2]" 1
862 1 53 TRP HE3 1 115 CYS HB2 . . 4.780 4.330 3.799 4.848 0.068 14 0 "[ . 1 . 2]" 1
863 1 53 TRP HH2 1 56 LEU QD . . 3.860 3.381 2.817 3.893 0.033 13 0 "[ . 1 . 2]" 1
864 1 53 TRP HH2 1 101 VAL QG . . 3.740 3.002 2.365 3.644 . 0 0 "[ . 1 . 2]" 1
865 1 53 TRP HH2 1 112 VAL MG1 . . 3.120 2.762 2.111 3.208 0.088 20 0 "[ . 1 . 2]" 1
866 1 53 TRP HH2 1 115 CYS HB2 . . 4.960 3.617 2.507 4.609 . 0 0 "[ . 1 . 2]" 1
867 1 53 TRP HH2 1 115 CYS HB3 . . 5.330 4.684 2.837 5.404 0.074 5 0 "[ . 1 . 2]" 1
868 1 53 TRP HZ2 1 55 LEU HA . . 5.090 4.400 4.022 5.147 0.057 17 0 "[ . 1 . 2]" 1
869 1 53 TRP HZ2 1 56 LEU QD . . 2.930 2.586 2.136 2.989 0.059 4 0 "[ . 1 . 2]" 1
870 1 53 TRP HZ2 1 56 LEU HG . . 3.490 3.361 2.819 3.571 0.081 8 0 "[ . 1 . 2]" 1
871 1 53 TRP HZ3 1 115 CYS HB2 . . 3.470 2.425 2.080 3.287 . 0 0 "[ . 1 . 2]" 1
872 1 53 TRP HZ3 1 115 CYS HB3 . . 3.480 2.914 2.098 3.463 . 0 0 "[ . 1 . 2]" 1
873 1 54 ALA H 1 54 ALA MB . . 3.190 2.524 2.188 2.816 . 0 0 "[ . 1 . 2]" 1
874 1 54 ALA H 1 55 LEU H . . 5.300 4.290 4.050 4.561 . 0 0 "[ . 1 . 2]" 1
875 1 54 ALA H 1 136 VAL QG . . 4.730 3.840 3.094 4.274 . 0 0 "[ . 1 . 2]" 1
876 1 54 ALA HA 1 55 LEU H . . 2.970 2.163 1.948 2.371 . 0 0 "[ . 1 . 2]" 1
877 1 54 ALA HA 1 55 LEU HB2 . . 5.040 4.486 4.298 4.726 . 0 0 "[ . 1 . 2]" 1
878 1 54 ALA HA 1 55 LEU HG . . 4.440 4.149 3.294 4.567 0.127 20 0 "[ . 1 . 2]" 1
879 1 54 ALA HA 1 136 VAL QG . . 3.180 2.695 2.021 3.276 0.096 18 0 "[ . 1 . 2]" 1
880 1 54 ALA HA 1 140 ASN HD21 . . 3.780 3.507 2.748 4.260 0.480 13 0 "[ . 1 . 2]" 1
881 1 54 ALA HA 1 140 ASN HD22 . . 4.190 2.079 1.726 2.757 . 0 0 "[ . 1 . 2]" 1
882 1 54 ALA MB 1 55 LEU H . . 3.680 2.904 2.463 3.229 . 0 0 "[ . 1 . 2]" 1
883 1 54 ALA MB 1 117 ASN HB2 . . 5.080 4.578 3.515 5.557 0.477 20 0 "[ . 1 . 2]" 1
884 1 54 ALA MB 1 117 ASN HD21 . . 3.620 2.912 2.087 3.836 0.216 9 0 "[ . 1 . 2]" 1
885 1 54 ALA MB 1 117 ASN HD22 . . 3.700 2.936 2.217 3.768 0.068 15 0 "[ . 1 . 2]" 1
886 1 54 ALA MB 1 119 TRP HB3 . . 5.240 4.740 3.740 5.309 0.069 6 0 "[ . 1 . 2]" 1
887 1 54 ALA MB 1 119 TRP HD1 . . 3.010 2.787 2.256 3.124 0.114 20 0 "[ . 1 . 2]" 1
888 1 54 ALA MB 1 119 TRP HE1 . . 3.580 2.856 2.343 3.237 . 0 0 "[ . 1 . 2]" 1
889 1 54 ALA MB 1 136 VAL HA . . 4.510 4.160 3.763 4.612 0.102 1 0 "[ . 1 . 2]" 1
890 1 54 ALA MB 1 136 VAL QG . . 3.240 1.990 1.773 2.335 . 0 0 "[ . 1 . 2]" 1
891 1 54 ALA MB 1 140 ASN HD21 . . 4.860 4.340 2.902 5.543 0.683 1 3 "[+ - . 1 * . 2]" 1
892 1 55 LEU H 1 55 LEU HB2 . . 3.280 2.415 2.302 2.591 . 0 0 "[ . 1 . 2]" 1
893 1 55 LEU H 1 55 LEU HB3 . . 3.950 3.576 3.446 3.678 . 0 0 "[ . 1 . 2]" 1
894 1 55 LEU H 1 55 LEU QD . . 3.730 2.867 1.812 3.439 . 0 0 "[ . 1 . 2]" 1
895 1 55 LEU H 1 55 LEU HG . . 3.660 2.903 2.174 3.721 0.061 15 0 "[ . 1 . 2]" 1
896 1 55 LEU H 1 136 VAL QG . . 4.810 4.069 3.371 4.551 . 0 0 "[ . 1 . 2]" 1
897 1 55 LEU H 1 140 ASN HB3 . . 4.900 4.562 4.093 4.982 0.082 15 0 "[ . 1 . 2]" 1
898 1 55 LEU H 1 140 ASN HD21 . . 4.220 3.818 2.820 4.687 0.467 13 0 "[ . 1 . 2]" 1
899 1 55 LEU H 1 140 ASN HD22 . . 4.730 3.061 2.149 3.852 . 0 0 "[ . 1 . 2]" 1
900 1 55 LEU HA 1 55 LEU QD . . 3.270 2.149 2.074 2.370 . 0 0 "[ . 1 . 2]" 1
901 1 55 LEU HA 1 55 LEU HG . . 3.950 3.081 2.707 3.560 . 0 0 "[ . 1 . 2]" 1
902 1 55 LEU HA 1 56 LEU H . . 3.130 2.245 2.033 2.464 . 0 0 "[ . 1 . 2]" 1
903 1 55 LEU HA 1 56 LEU HG . . 4.640 3.525 2.906 4.739 0.099 12 0 "[ . 1 . 2]" 1
904 1 55 LEU HB2 1 56 LEU H . . 4.390 3.952 3.626 4.403 0.013 17 0 "[ . 1 . 2]" 1
905 1 55 LEU HB2 1 140 ASN HA . . 4.890 3.275 2.496 4.011 . 0 0 "[ . 1 . 2]" 1
906 1 55 LEU HB2 1 143 PHE H . . 5.370 5.257 4.870 5.444 0.074 3 0 "[ . 1 . 2]" 1
907 1 55 LEU HB3 1 143 PHE QD . . 4.720 3.226 2.786 3.400 . 0 0 "[ . 1 . 2]" 1
908 1 55 LEU QD 1 56 LEU H . . 3.830 3.399 3.039 3.809 . 0 0 "[ . 1 . 2]" 1
909 1 55 LEU QD 1 140 ASN H . . 5.180 4.510 3.957 5.057 . 0 0 "[ . 1 . 2]" 1
910 1 55 LEU QD 1 140 ASN HA . . 3.520 2.351 2.013 2.924 . 0 0 "[ . 1 . 2]" 1
911 1 55 LEU QD 1 140 ASN HB2 . . 3.900 3.715 3.420 3.921 0.021 9 0 "[ . 1 . 2]" 1
912 1 55 LEU QD 1 140 ASN HB3 . . 3.800 2.399 2.173 2.663 . 0 0 "[ . 1 . 2]" 1
913 1 55 LEU QD 1 140 ASN HD21 . . 5.500 3.512 2.168 4.623 . 0 0 "[ . 1 . 2]" 1
914 1 55 LEU QD 1 140 ASN HD22 . . 5.360 3.731 2.801 4.505 . 0 0 "[ . 1 . 2]" 1
915 1 55 LEU QD 1 141 LYS H . . 5.500 4.673 4.439 4.923 . 0 0 "[ . 1 . 2]" 1
916 1 55 LEU QD 1 143 PHE H . . 4.460 4.059 3.630 4.385 . 0 0 "[ . 1 . 2]" 1
917 1 55 LEU QD 1 143 PHE HB2 . . 4.530 3.657 3.419 4.011 . 0 0 "[ . 1 . 2]" 1
918 1 55 LEU QD 1 143 PHE HB3 . . 4.380 2.363 2.077 2.681 . 0 0 "[ . 1 . 2]" 1
919 1 55 LEU QD 1 143 PHE QD . . 2.540 2.191 1.990 2.612 0.072 18 0 "[ . 1 . 2]" 1
920 1 55 LEU QD 1 144 GLU H . . 4.600 2.993 2.665 3.749 . 0 0 "[ . 1 . 2]" 1
921 1 55 LEU QD 1 144 GLU HA . . 4.860 3.689 3.281 4.750 . 0 0 "[ . 1 . 2]" 1
922 1 55 LEU QD 1 144 GLU HB2 . . 5.260 3.948 3.524 5.106 . 0 0 "[ . 1 . 2]" 1
923 1 55 LEU QD 1 144 GLU HB3 . . 5.160 2.680 2.159 4.915 . 0 0 "[ . 1 . 2]" 1
924 1 55 LEU QD 1 144 GLU HG2 . . 3.990 2.991 1.982 3.398 . 0 0 "[ . 1 . 2]" 1
925 1 55 LEU QD 1 144 GLU HG3 . . 4.330 4.093 3.191 4.382 0.052 20 0 "[ . 1 . 2]" 1
926 1 55 LEU HG 1 140 ASN HD21 . . 5.120 4.482 3.132 5.398 0.278 7 0 "[ . 1 . 2]" 1
927 1 55 LEU HG 1 140 ASN HD22 . . 5.500 4.292 2.920 5.585 0.085 18 0 "[ . 1 . 2]" 1
928 1 55 LEU HG 1 143 PHE QD . . 4.620 4.129 2.802 4.712 0.092 9 0 "[ . 1 . 2]" 1
929 1 55 LEU HG 1 144 GLU HG2 . . 5.500 5.262 3.880 5.573 0.073 12 0 "[ . 1 . 2]" 1
930 1 56 LEU H 1 56 LEU HB2 . . 3.810 2.561 2.094 2.744 . 0 0 "[ . 1 . 2]" 1
931 1 56 LEU H 1 56 LEU QD . . 4.140 3.219 2.306 3.646 . 0 0 "[ . 1 . 2]" 1
932 1 56 LEU H 1 56 LEU HG . . 3.720 2.903 2.135 3.807 0.087 11 0 "[ . 1 . 2]" 1
933 1 56 LEU H 1 57 ASP H . . 4.990 4.522 4.237 4.754 . 0 0 "[ . 1 . 2]" 1
934 1 56 LEU H 1 61 LEU QD . . 5.180 4.331 3.842 4.767 . 0 0 "[ . 1 . 2]" 1
935 1 56 LEU HA 1 56 LEU QD . . 3.000 2.291 2.188 2.624 . 0 0 "[ . 1 . 2]" 1
936 1 56 LEU HA 1 57 ASP H . . 2.960 2.324 2.108 2.866 . 0 0 "[ . 1 . 2]" 1
937 1 56 LEU HA 1 61 LEU QD . . 4.940 4.086 3.813 4.405 . 0 0 "[ . 1 . 2]" 1
938 1 56 LEU HB2 1 56 LEU QD . . 3.180 2.266 2.104 2.450 . 0 0 "[ . 1 . 2]" 1
939 1 56 LEU HB2 1 57 ASP H . . 4.540 3.889 3.128 4.298 . 0 0 "[ . 1 . 2]" 1
940 1 56 LEU HB2 1 61 LEU QD . . 3.790 2.345 2.010 2.795 . 0 0 "[ . 1 . 2]" 1
941 1 56 LEU HB3 1 56 LEU QD . . 2.670 2.177 2.113 2.254 . 0 0 "[ . 1 . 2]" 1
942 1 56 LEU HB3 1 57 ASP H . . 4.530 2.908 2.151 3.359 . 0 0 "[ . 1 . 2]" 1
943 1 56 LEU QD 1 57 ASP H . . 3.970 3.658 3.395 3.834 . 0 0 "[ . 1 . 2]" 1
944 1 56 LEU QD 1 60 THR MG . . 3.350 2.046 1.908 2.352 . 0 0 "[ . 1 . 2]" 1
945 1 56 LEU QD 1 61 LEU QD . . 3.150 2.070 1.829 2.408 . 0 0 "[ . 1 . 2]" 1
946 1 56 LEU QD 1 99 LEU QD . . 3.540 2.389 1.913 2.979 . 0 0 "[ . 1 . 2]" 1
947 1 56 LEU QD 1 117 ASN HD21 . . 4.550 3.556 2.385 5.347 0.797 9 1 "[ . +1 . 2]" 1
948 1 56 LEU QD 1 117 ASN HD22 . . 5.370 3.003 2.037 4.176 . 0 0 "[ . 1 . 2]" 1
949 1 57 ASP H 1 57 ASP HB2 . . 3.820 2.608 2.230 3.712 . 0 0 "[ . 1 . 2]" 1
950 1 57 ASP H 1 60 THR HB . . 3.780 2.399 2.041 2.712 . 0 0 "[ . 1 . 2]" 1
951 1 57 ASP H 1 60 THR MG . . 4.180 3.190 2.956 3.500 . 0 0 "[ . 1 . 2]" 1
952 1 57 ASP H 1 61 LEU H . . 4.610 4.496 3.866 4.697 0.087 20 0 "[ . 1 . 2]" 1
953 1 57 ASP HA 1 58 GLU H . . 3.570 2.509 2.383 2.722 . 0 0 "[ . 1 . 2]" 1
954 1 57 ASP HA 1 58 GLU QB . . 4.800 4.421 4.103 4.673 . 0 0 "[ . 1 . 2]" 1
955 1 57 ASP HB2 1 58 GLU H . . 3.510 3.290 2.062 3.602 0.092 17 0 "[ . 1 . 2]" 1
956 1 57 ASP HB3 1 58 GLU H . . 3.290 2.395 2.070 3.580 0.290 4 0 "[ . 1 . 2]" 1
957 1 57 ASP HB3 1 59 GLU H . . 4.260 3.003 2.302 4.919 0.659 7 1 "[ . + 1 . 2]" 1
958 1 58 GLU H 1 58 GLU QB . . 3.390 2.417 2.065 2.841 . 0 0 "[ . 1 . 2]" 1
959 1 58 GLU H 1 58 GLU HG2 . . 4.080 3.206 1.839 4.485 0.405 6 0 "[ . 1 . 2]" 1
960 1 58 GLU H 1 59 GLU H . . 3.600 2.660 2.463 3.071 . 0 0 "[ . 1 . 2]" 1
961 1 58 GLU HA 1 58 GLU HG2 . . 3.710 3.189 2.440 3.789 0.079 4 0 "[ . 1 . 2]" 1
962 1 58 GLU HA 1 58 GLU HG3 . . 3.570 3.159 2.144 3.786 0.216 9 0 "[ . 1 . 2]" 1
963 1 58 GLU HA 1 61 LEU H . . 4.140 3.502 2.905 4.152 0.012 14 0 "[ . 1 . 2]" 1
964 1 58 GLU HA 1 61 LEU QD . . 5.350 4.159 3.780 5.050 . 0 0 "[ . 1 . 2]" 1
965 1 58 GLU QB 1 59 GLU H . . 3.630 2.941 1.976 3.490 . 0 0 "[ . 1 . 2]" 1
966 1 58 GLU HG3 1 59 GLU H . . 4.180 3.619 2.186 5.080 0.900 18 6 "[ - .* 1 * . *+*2]" 1
967 1 59 GLU H 1 59 GLU QB . . 2.730 2.478 2.264 2.770 0.040 8 0 "[ . 1 . 2]" 1
968 1 59 GLU H 1 59 GLU QG . . 3.200 2.494 2.053 3.137 . 0 0 "[ . 1 . 2]" 1
969 1 59 GLU HA 1 59 GLU QB . . 2.760 2.341 2.115 2.521 . 0 0 "[ . 1 . 2]" 1
970 1 59 GLU HA 1 59 GLU QG . . 3.420 2.624 2.159 3.492 0.072 8 0 "[ . 1 . 2]" 1
971 1 59 GLU HA 1 62 LYS H . . 4.500 4.465 4.040 4.591 0.091 14 0 "[ . 1 . 2]" 1
972 1 59 GLU HA 1 62 LYS HB2 . . 3.370 2.702 2.145 3.491 0.121 20 0 "[ . 1 . 2]" 1
973 1 59 GLU HA 1 62 LYS QD . . 3.260 2.339 2.009 3.283 0.023 19 0 "[ . 1 . 2]" 1
974 1 59 GLU HA 1 62 LYS QE . . 4.250 3.577 2.423 4.329 0.079 9 0 "[ . 1 . 2]" 1
975 1 59 GLU HA 1 62 LYS QG . . 3.810 3.202 2.384 3.898 0.088 14 0 "[ . 1 . 2]" 1
976 1 59 GLU QB 1 59 GLU QG . . 2.400 2.100 2.036 2.125 . 0 0 "[ . 1 . 2]" 1
977 1 60 THR H 1 60 THR HB . . 3.190 2.536 2.250 2.743 . 0 0 "[ . 1 . 2]" 1
978 1 60 THR H 1 60 THR MG . . 4.480 3.739 3.654 3.821 . 0 0 "[ . 1 . 2]" 1
979 1 60 THR H 1 61 LEU H . . 3.240 2.552 2.146 2.862 . 0 0 "[ . 1 . 2]" 1
980 1 60 THR H 1 61 LEU QB . . 4.990 4.618 4.254 4.956 . 0 0 "[ . 1 . 2]" 1
981 1 60 THR H 1 62 LYS H . . 4.790 4.753 4.594 4.858 0.068 4 0 "[ . 1 . 2]" 1
982 1 60 THR HA 1 60 THR MG . . 3.080 2.340 2.193 2.484 . 0 0 "[ . 1 . 2]" 1
983 1 60 THR HA 1 62 LYS H . . 5.070 4.053 3.754 4.441 . 0 0 "[ . 1 . 2]" 1
984 1 60 THR HB 1 61 LEU H . . 3.650 2.649 2.405 3.247 . 0 0 "[ . 1 . 2]" 1
985 1 60 THR MG 1 61 LEU H . . 3.590 3.646 3.490 3.713 0.123 20 0 "[ . 1 . 2]" 1
986 1 60 THR MG 1 61 LEU QD . . 3.720 2.684 2.025 3.435 . 0 0 "[ . 1 . 2]" 1
987 1 60 THR MG 1 62 LYS H . . 4.870 4.730 4.485 4.969 0.099 16 0 "[ . 1 . 2]" 1
988 1 61 LEU H 1 61 LEU QB . . 3.340 2.367 2.138 2.743 . 0 0 "[ . 1 . 2]" 1
989 1 61 LEU H 1 61 LEU QD . . 3.250 2.816 2.404 3.216 . 0 0 "[ . 1 . 2]" 1
990 1 61 LEU H 1 62 LYS HA . . 4.880 4.938 4.734 4.974 0.094 18 0 "[ . 1 . 2]" 1
991 1 61 LEU H 1 62 LYS QG . . 4.910 4.827 4.506 5.032 0.122 20 0 "[ . 1 . 2]" 1
992 1 61 LEU HA 1 61 LEU QD . . 2.860 2.175 2.070 2.304 . 0 0 "[ . 1 . 2]" 1
993 1 61 LEU HA 1 61 LEU HG . . 3.860 3.341 2.497 3.803 . 0 0 "[ . 1 . 2]" 1
994 1 61 LEU HA 1 62 LYS H . . 3.180 2.608 2.415 2.821 . 0 0 "[ . 1 . 2]" 1
995 1 61 LEU HA 1 62 LYS HA . . 4.770 4.428 4.240 4.590 . 0 0 "[ . 1 . 2]" 1
996 1 61 LEU HA 1 62 LYS HB2 . . 4.790 4.844 4.653 5.081 0.291 20 0 "[ . 1 . 2]" 1
997 1 61 LEU HA 1 88 PHE QD . . 4.980 4.143 3.591 4.529 . 0 0 "[ . 1 . 2]" 1
998 1 61 LEU HA 1 88 PHE QE . . 4.480 2.809 2.295 3.083 . 0 0 "[ . 1 . 2]" 1
999 1 61 LEU QB 1 61 LEU QD . . 2.690 2.003 1.875 2.098 . 0 0 "[ . 1 . 2]" 1
1000 1 61 LEU QB 1 62 LYS H . . 4.290 3.934 3.849 4.007 . 0 0 "[ . 1 . 2]" 1
1001 1 61 LEU QD 1 62 LYS H . . 5.100 4.148 3.933 4.470 . 0 0 "[ . 1 . 2]" 1
1002 1 61 LEU QD 1 88 PHE HB2 . . 4.650 3.743 2.799 4.545 . 0 0 "[ . 1 . 2]" 1
1003 1 61 LEU QD 1 88 PHE HB3 . . 4.340 3.584 2.901 4.115 . 0 0 "[ . 1 . 2]" 1
1004 1 61 LEU QD 1 88 PHE QD . . 3.730 2.988 2.336 3.468 . 0 0 "[ . 1 . 2]" 1
1005 1 61 LEU QD 1 88 PHE QE . . 3.170 2.989 2.249 3.239 0.069 15 0 "[ . 1 . 2]" 1
1006 1 61 LEU QD 1 99 LEU QD . . 4.250 3.048 2.430 3.531 . 0 0 "[ . 1 . 2]" 1
1007 1 61 LEU QD 1 99 LEU HG . . 5.230 4.530 3.822 5.115 . 0 0 "[ . 1 . 2]" 1
1008 1 61 LEU QD 1 101 VAL HB . . 3.750 3.600 3.034 3.811 0.061 7 0 "[ . 1 . 2]" 1
1009 1 61 LEU QD 1 101 VAL QG . . 3.460 2.537 2.047 3.102 . 0 0 "[ . 1 . 2]" 1
1010 1 62 LYS H 1 62 LYS HB2 . . 3.040 2.500 2.158 3.316 0.276 20 0 "[ . 1 . 2]" 1
1011 1 62 LYS H 1 62 LYS HB3 . . 3.250 3.216 2.336 3.335 0.085 7 0 "[ . 1 . 2]" 1
1012 1 62 LYS H 1 62 LYS QD . . 4.910 4.636 4.293 4.946 0.036 17 0 "[ . 1 . 2]" 1
1013 1 62 LYS H 1 62 LYS QG . . 3.860 3.814 3.474 3.953 0.093 18 0 "[ . 1 . 2]" 1
1014 1 62 LYS H 1 63 GLU H . . 4.420 4.419 4.218 4.495 0.075 6 0 "[ . 1 . 2]" 1
1015 1 62 LYS H 1 88 PHE QE . . 3.450 3.488 3.115 3.568 0.118 14 0 "[ . 1 . 2]" 1
1016 1 62 LYS HA 1 62 LYS QG . . 3.370 2.209 2.089 2.792 . 0 0 "[ . 1 . 2]" 1
1017 1 62 LYS HA 1 63 GLU H . . 2.760 2.286 2.081 2.461 . 0 0 "[ . 1 . 2]" 1
1018 1 62 LYS HB2 1 62 LYS QE . . 4.350 3.821 3.295 4.172 . 0 0 "[ . 1 . 2]" 1
1019 1 62 LYS HB2 1 63 GLU H . . 4.000 4.053 3.709 4.096 0.096 2 0 "[ . 1 . 2]" 1
1020 1 62 LYS HB3 1 62 LYS QE . . 4.570 3.723 2.254 4.257 . 0 0 "[ . 1 . 2]" 1
1021 1 62 LYS HB3 1 63 GLU H . . 3.690 3.036 2.803 4.088 0.398 20 0 "[ . 1 . 2]" 1
1022 1 62 LYS QD 1 63 GLU H . . 4.500 4.242 3.772 4.583 0.083 9 0 "[ . 1 . 2]" 1
1023 1 62 LYS QE 1 62 LYS QG . . 3.470 2.219 1.996 2.460 . 0 0 "[ . 1 . 2]" 1
1024 1 62 LYS QG 1 63 GLU H . . 3.630 2.558 2.020 2.818 . 0 0 "[ . 1 . 2]" 1
1025 1 62 LYS QG 1 63 GLU QB . . 4.760 4.653 4.190 4.872 0.112 1 0 "[ . 1 . 2]" 1
1026 1 63 GLU H 1 63 GLU QB . . 3.070 2.696 2.528 2.855 . 0 0 "[ . 1 . 2]" 1
1027 1 63 GLU H 1 63 GLU QG . . 3.360 2.753 2.425 3.026 . 0 0 "[ . 1 . 2]" 1
1028 1 63 GLU HA 1 63 GLU QG . . 3.740 2.676 2.380 3.232 . 0 0 "[ . 1 . 2]" 1
1029 1 63 GLU HA 1 64 GLY H . . 2.920 2.220 2.084 2.330 . 0 0 "[ . 1 . 2]" 1
1030 1 63 GLU HA 1 77 HIS HA . . 4.900 2.592 2.169 3.804 . 0 0 "[ . 1 . 2]" 1
1031 1 63 GLU HA 1 88 PHE QE . . 4.280 3.920 3.052 4.357 0.077 18 0 "[ . 1 . 2]" 1
1032 1 63 GLU QB 1 63 GLU QG . . 2.450 2.046 1.926 2.117 . 0 0 "[ . 1 . 2]" 1
1033 1 63 GLU QB 1 64 GLY H . . 3.560 3.333 2.431 3.640 0.080 1 0 "[ . 1 . 2]" 1
1034 1 63 GLU QB 1 64 GLY HA2 . . 5.270 4.142 3.749 4.418 . 0 0 "[ . 1 . 2]" 1
1035 1 63 GLU QB 1 77 HIS HA . . 3.560 2.968 2.333 3.517 . 0 0 "[ . 1 . 2]" 1
1036 1 63 GLU QB 1 77 HIS HB2 . . 4.400 3.482 2.879 4.046 . 0 0 "[ . 1 . 2]" 1
1037 1 63 GLU QB 1 77 HIS HB3 . . 4.370 3.193 2.707 3.601 . 0 0 "[ . 1 . 2]" 1
1038 1 63 GLU QB 1 78 PHE H . . 3.880 3.927 3.519 3.983 0.103 12 0 "[ . 1 . 2]" 1
1039 1 63 GLU QG 1 64 GLY H . . 5.100 4.493 4.162 4.712 . 0 0 "[ . 1 . 2]" 1
1040 1 63 GLU QG 1 77 HIS HA . . 3.470 2.634 2.067 3.054 . 0 0 "[ . 1 . 2]" 1
1041 1 63 GLU QG 1 77 HIS HB3 . . 4.760 4.074 3.106 4.618 . 0 0 "[ . 1 . 2]" 1
1042 1 63 GLU QG 1 78 PHE H . . 4.110 3.027 2.290 3.845 . 0 0 "[ . 1 . 2]" 1
1043 1 63 GLU QG 1 78 PHE QD . . 3.450 2.347 2.079 2.735 . 0 0 "[ . 1 . 2]" 1
1044 1 63 GLU QG 1 88 PHE QD . . 5.020 4.140 3.636 4.630 . 0 0 "[ . 1 . 2]" 1
1045 1 63 GLU QG 1 88 PHE QE . . 4.270 2.891 2.137 3.959 . 0 0 "[ . 1 . 2]" 1
1046 1 64 GLY H 1 65 ARG H . . 4.320 4.337 4.221 4.379 0.059 18 0 "[ . 1 . 2]" 1
1047 1 64 GLY H 1 75 ILE MG . . 5.500 4.154 3.676 4.605 . 0 0 "[ . 1 . 2]" 1
1048 1 64 GLY H 1 76 SER H . . 3.660 3.033 2.473 3.716 0.056 9 0 "[ . 1 . 2]" 1
1049 1 64 GLY H 1 76 SER HB2 . . 4.180 3.645 2.433 4.677 0.497 18 0 "[ . 1 . 2]" 1
1050 1 64 GLY H 1 76 SER HB3 . . 4.620 4.188 2.661 4.698 0.078 12 0 "[ . 1 . 2]" 1
1051 1 64 GLY H 1 77 HIS HA . . 4.450 3.905 3.454 4.513 0.063 7 0 "[ . 1 . 2]" 1
1052 1 64 GLY HA2 1 65 ARG H . . 2.910 2.627 2.415 2.963 0.053 8 0 "[ . 1 . 2]" 1
1053 1 64 GLY HA2 1 65 ARG HA . . 5.220 4.572 4.287 4.716 . 0 0 "[ . 1 . 2]" 1
1054 1 64 GLY HA3 1 65 ARG H . . 3.130 2.535 2.281 2.757 . 0 0 "[ . 1 . 2]" 1
1055 1 65 ARG H 1 65 ARG QB . . 3.330 2.738 2.187 3.303 . 0 0 "[ . 1 . 2]" 1
1056 1 65 ARG H 1 65 ARG QD . . 5.240 4.336 3.616 4.827 . 0 0 "[ . 1 . 2]" 1
1057 1 65 ARG H 1 65 ARG QG . . 4.430 2.838 2.023 3.780 . 0 0 "[ . 1 . 2]" 1
1058 1 65 ARG H 1 65 ARG HG3 . . 4.010 3.332 2.894 4.508 0.498 7 0 "[ . 1 . 2]" 1
1059 1 65 ARG H 1 66 THR H . . 4.740 4.380 4.097 4.680 . 0 0 "[ . 1 . 2]" 1
1060 1 65 ARG H 1 76 SER H . . 5.070 5.017 4.801 5.141 0.071 8 0 "[ . 1 . 2]" 1
1061 1 65 ARG HA 1 65 ARG QG . . 3.750 2.832 2.234 3.368 . 0 0 "[ . 1 . 2]" 1
1062 1 65 ARG HA 1 66 THR H . . 2.820 2.270 2.124 2.516 . 0 0 "[ . 1 . 2]" 1
1063 1 65 ARG HA 1 66 THR HA . . 4.730 4.488 4.340 4.597 . 0 0 "[ . 1 . 2]" 1
1064 1 65 ARG HA 1 73 THR MG . . 4.650 4.016 3.515 4.503 . 0 0 "[ . 1 . 2]" 1
1065 1 65 ARG HA 1 75 ILE HA . . 3.460 2.162 1.958 2.344 . 0 0 "[ . 1 . 2]" 1
1066 1 65 ARG HA 1 75 ILE HB . . 5.110 5.037 4.854 5.176 0.066 1 0 "[ . 1 . 2]" 1
1067 1 65 ARG HA 1 75 ILE MD . . 4.580 4.652 4.545 4.694 0.114 14 0 "[ . 1 . 2]" 1
1068 1 65 ARG HA 1 75 ILE HG13 . . 4.100 3.473 3.025 4.134 0.034 14 0 "[ . 1 . 2]" 1
1069 1 65 ARG HA 1 75 ILE MG . . 4.970 3.511 3.060 3.928 . 0 0 "[ . 1 . 2]" 1
1070 1 65 ARG HA 1 76 SER H . . 4.270 3.419 3.036 3.857 . 0 0 "[ . 1 . 2]" 1
1071 1 65 ARG QB 1 65 ARG QD . . 3.260 2.197 2.004 2.459 . 0 0 "[ . 1 . 2]" 1
1072 1 65 ARG QB 1 65 ARG HE . . 4.650 3.293 2.149 4.049 . 0 0 "[ . 1 . 2]" 1
1073 1 65 ARG QB 1 66 THR H . . 3.480 2.831 2.365 3.566 0.086 7 0 "[ . 1 . 2]" 1
1074 1 65 ARG QB 1 73 THR MG . . 4.280 2.494 2.120 3.396 . 0 0 "[ . 1 . 2]" 1
1075 1 65 ARG QB 1 75 ILE HA . . 4.190 3.443 2.814 4.140 . 0 0 "[ . 1 . 2]" 1
1076 1 65 ARG QB 1 75 ILE MD . . 4.570 3.913 3.079 4.665 0.095 12 0 "[ . 1 . 2]" 1
1077 1 65 ARG QB 1 75 ILE HG13 . . 3.770 3.083 2.219 3.845 0.075 3 0 "[ . 1 . 2]" 1
1078 1 65 ARG QB 1 75 ILE MG . . 4.510 3.641 2.577 4.603 0.093 10 0 "[ . 1 . 2]" 1
1079 1 65 ARG QD 1 73 THR MG . . 4.060 2.632 1.993 3.881 . 0 0 "[ . 1 . 2]" 1
1080 1 65 ARG QD 1 75 ILE MD . . 4.610 3.770 2.485 4.483 . 0 0 "[ . 1 . 2]" 1
1081 1 65 ARG QD 1 75 ILE HG13 . . 4.920 3.601 2.177 4.735 . 0 0 "[ . 1 . 2]" 1
1082 1 65 ARG QD 1 75 ILE MG . . 5.500 4.035 2.726 5.015 . 0 0 "[ . 1 . 2]" 1
1083 1 65 ARG HE 1 73 THR MG . . 5.110 3.823 2.753 5.200 0.090 14 0 "[ . 1 . 2]" 1
1084 1 65 ARG QG 1 73 THR MG . . 4.070 3.288 2.151 4.122 0.052 14 0 "[ . 1 . 2]" 1
1085 1 65 ARG QG 1 75 ILE HG13 . . 5.500 3.550 2.131 5.545 0.045 16 0 "[ . 1 . 2]" 1
1086 1 65 ARG QG 1 75 ILE MG . . 4.800 3.550 2.152 4.901 0.101 2 0 "[ . 1 . 2]" 1
1087 1 65 ARG HG3 1 66 THR H . . 4.300 4.284 2.414 5.227 0.927 3 7 "[* +** * 1- . * 2]" 1
1088 1 66 THR H 1 66 THR HB . . 3.630 2.580 2.384 3.064 . 0 0 "[ . 1 . 2]" 1
1089 1 66 THR H 1 73 THR HA . . 4.570 4.238 3.866 4.617 0.047 5 0 "[ . 1 . 2]" 1
1090 1 66 THR H 1 73 THR MG . . 3.960 3.587 3.072 4.043 0.083 6 0 "[ . 1 . 2]" 1
1091 1 66 THR H 1 74 TYR H . . 3.900 3.285 2.750 3.808 . 0 0 "[ . 1 . 2]" 1
1092 1 66 THR H 1 74 TYR HB2 . . 4.910 4.718 4.248 4.985 0.075 12 0 "[ . 1 . 2]" 1
1093 1 66 THR H 1 74 TYR HB3 . . 4.560 3.350 2.960 3.657 . 0 0 "[ . 1 . 2]" 1
1094 1 66 THR H 1 75 ILE HA . . 3.990 3.558 3.178 3.950 . 0 0 "[ . 1 . 2]" 1
1095 1 66 THR H 1 75 ILE HG13 . . 5.460 4.262 3.839 4.743 . 0 0 "[ . 1 . 2]" 1
1096 1 66 THR HA 1 66 THR MG . . 3.480 2.669 2.283 3.267 . 0 0 "[ . 1 . 2]" 1
1097 1 66 THR HA 1 67 THR H . . 2.810 2.581 2.400 2.824 0.014 9 0 "[ . 1 . 2]" 1
1098 1 66 THR HB 1 67 THR H . . 3.920 3.717 3.380 3.979 0.059 18 0 "[ . 1 . 2]" 1
1099 1 66 THR HB 1 74 TYR HB2 . . 4.290 3.869 3.093 4.369 0.079 20 0 "[ . 1 . 2]" 1
1100 1 66 THR HB 1 74 TYR HB3 . . 4.270 2.464 2.028 3.442 . 0 0 "[ . 1 . 2]" 1
1101 1 66 THR MG 1 67 THR H . . 3.410 2.208 1.832 2.630 . 0 0 "[ . 1 . 2]" 1
1102 1 66 THR MG 1 68 GLU HA . . 4.180 4.010 3.269 4.284 0.104 1 0 "[ . 1 . 2]" 1
1103 1 66 THR MG 1 68 GLU QG . . 4.540 3.303 2.307 4.195 . 0 0 "[ . 1 . 2]" 1
1104 1 66 THR MG 1 74 TYR H . . 4.440 3.499 1.720 4.452 0.012 16 0 "[ . 1 . 2]" 1
1105 1 66 THR MG 1 74 TYR HB2 . . 4.330 3.729 2.203 4.424 0.094 16 0 "[ . 1 . 2]" 1
1106 1 66 THR MG 1 74 TYR HB3 . . 3.780 3.035 2.072 3.585 . 0 0 "[ . 1 . 2]" 1
1107 1 66 THR MG 1 74 TYR QD . . 3.700 3.512 2.789 3.811 0.111 11 0 "[ . 1 . 2]" 1
1108 1 67 THR H 1 67 THR HB . . 3.190 2.837 2.531 3.275 0.085 2 0 "[ . 1 . 2]" 1
1109 1 67 THR H 1 67 THR MG . . 3.760 3.822 3.268 3.874 0.114 10 0 "[ . 1 . 2]" 1
1110 1 67 THR H 1 74 TYR H . . 5.190 4.861 4.353 5.260 0.070 7 0 "[ . 1 . 2]" 1
1111 1 67 THR HA 1 67 THR MG . . 2.660 2.306 2.090 2.492 . 0 0 "[ . 1 . 2]" 1
1112 1 67 THR HA 1 68 GLU H . . 2.830 2.313 2.162 2.644 . 0 0 "[ . 1 . 2]" 1
1113 1 67 THR HA 1 68 GLU HB2 . . 4.820 4.478 4.171 4.703 . 0 0 "[ . 1 . 2]" 1
1114 1 67 THR HB 1 68 GLU H . . 4.610 3.942 2.660 4.452 . 0 0 "[ . 1 . 2]" 1
1115 1 67 THR HB 1 68 GLU HA . . 5.060 4.779 4.150 5.141 0.081 16 0 "[ . 1 . 2]" 1
1116 1 67 THR MG 1 68 GLU H . . 3.340 2.854 2.270 3.446 0.106 15 0 "[ . 1 . 2]" 1
1117 1 67 THR MG 1 68 GLU HA . . 5.170 4.355 3.820 5.199 0.029 2 0 "[ . 1 . 2]" 1
1118 1 67 THR MG 1 68 GLU HB2 . . 5.150 4.642 4.313 5.173 0.023 17 0 "[ . 1 . 2]" 1
1119 1 67 THR MG 1 71 GLY H . . 5.440 5.187 4.205 5.544 0.104 13 0 "[ . 1 . 2]" 1
1120 1 67 THR MG 1 72 GLY H . . 5.500 4.698 3.709 5.601 0.101 14 0 "[ . 1 . 2]" 1
1121 1 68 GLU H 1 68 GLU HB2 . . 3.250 2.427 2.163 2.776 . 0 0 "[ . 1 . 2]" 1
1122 1 68 GLU H 1 68 GLU QG . . 3.770 3.129 2.421 3.543 . 0 0 "[ . 1 . 2]" 1
1123 1 68 GLU H 1 72 GLY H . . 4.420 3.264 2.447 4.306 . 0 0 "[ . 1 . 2]" 1
1124 1 68 GLU HA 1 68 GLU QG . . 3.360 2.273 2.133 2.585 . 0 0 "[ . 1 . 2]" 1
1125 1 68 GLU HA 1 69 GLU H . . 2.600 2.358 2.155 2.614 0.014 3 0 "[ . 1 . 2]" 1
1126 1 68 GLU HA 1 69 GLU QB . . 4.030 3.961 3.666 4.136 0.106 1 0 "[ . 1 . 2]" 1
1127 1 68 GLU HB2 1 69 GLU H . . 3.770 3.755 3.507 3.852 0.082 2 0 "[ . 1 . 2]" 1
1128 1 68 GLU HB2 1 71 GLY H . . 4.370 2.841 2.329 3.679 . 0 0 "[ . 1 . 2]" 1
1129 1 68 GLU HB2 1 71 GLY QA . . 4.650 3.276 2.358 4.168 . 0 0 "[ . 1 . 2]" 1
1130 1 68 GLU HB2 1 72 GLY H . . 3.670 2.360 1.749 3.364 . 0 0 "[ . 1 . 2]" 1
1131 1 68 GLU HB2 1 72 GLY HA2 . . 5.030 4.327 3.793 5.087 0.057 8 0 "[ . 1 . 2]" 1
1132 1 68 GLU HB3 1 69 GLU H . . 3.550 2.433 2.177 2.677 . 0 0 "[ . 1 . 2]" 1
1133 1 68 GLU HB3 1 69 GLU HA . . 4.940 4.583 4.369 4.798 . 0 0 "[ . 1 . 2]" 1
1134 1 68 GLU HB3 1 70 GLU H . . 3.230 2.365 1.968 2.940 . 0 0 "[ . 1 . 2]" 1
1135 1 68 GLU HB3 1 71 GLY H . . 4.930 2.973 1.877 3.764 . 0 0 "[ . 1 . 2]" 1
1136 1 68 GLU HB3 1 72 GLY H . . 4.450 3.894 3.361 4.508 0.058 5 0 "[ . 1 . 2]" 1
1137 1 68 GLU QG 1 69 GLU H . . 3.740 3.580 3.291 3.677 . 0 0 "[ . 1 . 2]" 1
1138 1 69 GLU H 1 69 GLU QB . . 2.720 2.242 1.893 2.568 . 0 0 "[ . 1 . 2]" 1
1139 1 69 GLU H 1 70 GLU H . . 3.410 2.381 2.068 2.728 . 0 0 "[ . 1 . 2]" 1
1140 1 69 GLU HA 1 69 GLU QB . . 2.510 2.410 2.145 2.562 0.052 13 0 "[ . 1 . 2]" 1
1141 1 69 GLU HA 1 70 GLU H . . 3.210 3.283 3.064 3.308 0.098 16 0 "[ . 1 . 2]" 1
1142 1 69 GLU QB 1 69 GLU QG . . 2.400 2.096 2.000 2.144 . 0 0 "[ . 1 . 2]" 1
1143 1 70 GLU H 1 70 GLU HA . . 2.840 2.924 2.879 2.936 0.096 7 0 "[ . 1 . 2]" 1
1144 1 70 GLU H 1 70 GLU HB2 . . 3.560 3.849 3.732 4.071 0.511 14 1 "[ . 1 +. 2]" 1
1145 1 70 GLU H 1 70 GLU HG2 . . 3.100 2.475 2.197 2.887 . 0 0 "[ . 1 . 2]" 1
1146 1 70 GLU H 1 70 GLU HG3 . . 3.500 3.168 2.553 3.503 0.003 10 0 "[ . 1 . 2]" 1
1147 1 70 GLU H 1 71 GLY H . . 3.470 2.206 2.048 2.417 . 0 0 "[ . 1 . 2]" 1
1148 1 70 GLU HA 1 70 GLU HB2 . . 2.970 2.406 2.331 2.493 . 0 0 "[ . 1 . 2]" 1
1149 1 70 GLU HA 1 70 GLU HB3 . . 2.830 2.442 2.390 2.505 . 0 0 "[ . 1 . 2]" 1
1150 1 70 GLU HA 1 71 GLY H . . 3.190 3.154 2.842 3.270 0.080 12 0 "[ . 1 . 2]" 1
1151 1 71 GLY H 1 72 GLY H . . 3.420 3.144 2.694 3.492 0.072 10 0 "[ . 1 . 2]" 1
1152 1 71 GLY QA 1 72 GLY H . . 2.770 2.285 2.101 2.608 . 0 0 "[ . 1 . 2]" 1
1153 1 72 GLY H 1 73 THR H . . 4.190 4.171 3.620 4.271 0.081 20 0 "[ . 1 . 2]" 1
1154 1 72 GLY H 1 92 TYR QE . . 5.340 3.846 2.108 5.416 0.076 15 0 "[ . 1 . 2]" 1
1155 1 72 GLY HA2 1 73 THR H . . 3.030 2.599 2.156 3.104 0.074 18 0 "[ . 1 . 2]" 1
1156 1 72 GLY HA2 1 92 TYR QD . . 4.490 4.005 2.902 4.575 0.085 18 0 "[ . 1 . 2]" 1
1157 1 72 GLY HA2 1 92 TYR QE . . 5.360 4.481 3.456 5.195 . 0 0 "[ . 1 . 2]" 1
1158 1 72 GLY HA3 1 73 THR H . . 2.620 2.601 2.045 3.087 0.467 7 0 "[ . 1 . 2]" 1
1159 1 72 GLY HA3 1 73 THR HA . . 4.940 4.527 4.325 4.665 . 0 0 "[ . 1 . 2]" 1
1160 1 72 GLY HA3 1 92 TYR QD . . 3.910 3.176 2.403 3.914 0.004 2 0 "[ . 1 . 2]" 1
1161 1 72 GLY HA3 1 92 TYR QE . . 4.750 3.463 2.531 4.573 . 0 0 "[ . 1 . 2]" 1
1162 1 73 THR H 1 73 THR MG . . 3.770 3.804 3.724 3.877 0.107 19 0 "[ . 1 . 2]" 1
1163 1 73 THR H 1 74 TYR H . . 4.420 4.032 3.510 4.481 0.061 5 0 "[ . 1 . 2]" 1
1164 1 73 THR HA 1 73 THR MG . . 3.130 2.419 2.240 2.599 . 0 0 "[ . 1 . 2]" 1
1165 1 73 THR HA 1 74 TYR H . . 3.090 2.238 2.173 2.330 . 0 0 "[ . 1 . 2]" 1
1166 1 73 THR HB 1 75 ILE MD . . 4.310 3.601 3.008 4.220 . 0 0 "[ . 1 . 2]" 1
1167 1 73 THR HB 1 93 ASP HB2 . . 3.920 2.861 2.015 4.011 0.091 6 0 "[ . 1 . 2]" 1
1168 1 73 THR HB 1 93 ASP HB3 . . 3.980 2.871 2.301 3.876 . 0 0 "[ . 1 . 2]" 1
1169 1 73 THR MG 1 74 TYR H . . 3.450 3.416 2.811 3.549 0.099 15 0 "[ . 1 . 2]" 1
1170 1 73 THR MG 1 74 TYR HB2 . . 5.500 5.366 5.131 5.558 0.058 6 0 "[ . 1 . 2]" 1
1171 1 73 THR MG 1 75 ILE MD . . 3.440 2.443 2.167 2.774 . 0 0 "[ . 1 . 2]" 1
1172 1 73 THR MG 1 75 ILE HG13 . . 4.390 2.501 2.184 3.139 . 0 0 "[ . 1 . 2]" 1
1173 1 73 THR MG 1 93 ASP H . . 4.320 3.789 3.210 4.241 . 0 0 "[ . 1 . 2]" 1
1174 1 73 THR MG 1 93 ASP HB2 . . 4.060 3.080 2.309 4.325 0.265 14 0 "[ . 1 . 2]" 1
1175 1 73 THR MG 1 93 ASP HB3 . . 4.240 3.791 2.697 4.321 0.081 11 0 "[ . 1 . 2]" 1
1176 1 74 TYR H 1 74 TYR HB2 . . 3.770 2.587 2.293 2.973 . 0 0 "[ . 1 . 2]" 1
1177 1 74 TYR H 1 74 TYR HB3 . . 3.750 2.600 2.413 3.040 . 0 0 "[ . 1 . 2]" 1
1178 1 74 TYR H 1 74 TYR QD . . 4.950 4.246 4.095 4.329 . 0 0 "[ . 1 . 2]" 1
1179 1 74 TYR H 1 75 ILE HG13 . . 5.500 4.849 4.189 5.285 . 0 0 "[ . 1 . 2]" 1
1180 1 74 TYR H 1 92 TYR QD . . 5.500 4.116 3.352 5.265 . 0 0 "[ . 1 . 2]" 1
1181 1 74 TYR HA 1 74 TYR QD . . 3.060 2.179 2.046 2.323 . 0 0 "[ . 1 . 2]" 1
1182 1 74 TYR HA 1 75 ILE H . . 3.040 2.291 2.179 2.381 . 0 0 "[ . 1 . 2]" 1
1183 1 74 TYR HA 1 75 ILE HB . . 5.060 4.624 4.429 4.850 . 0 0 "[ . 1 . 2]" 1
1184 1 74 TYR HA 1 75 ILE MD . . 4.840 3.636 2.551 4.925 0.085 2 0 "[ . 1 . 2]" 1
1185 1 74 TYR HA 1 92 TYR HA . . 3.160 2.127 1.934 2.213 . 0 0 "[ . 1 . 2]" 1
1186 1 74 TYR HA 1 93 ASP H . . 4.000 3.781 3.490 4.077 0.077 14 0 "[ . 1 . 2]" 1
1187 1 74 TYR HB2 1 75 ILE H . . 5.500 4.431 4.242 4.591 . 0 0 "[ . 1 . 2]" 1
1188 1 74 TYR HB2 1 92 TYR HA . . 4.840 4.368 3.990 4.683 . 0 0 "[ . 1 . 2]" 1
1189 1 74 TYR HB2 1 92 TYR QE . . 3.220 2.914 2.568 3.305 0.085 18 0 "[ . 1 . 2]" 1
1190 1 74 TYR HB3 1 92 TYR QE . . 4.660 4.340 4.096 4.625 . 0 0 "[ . 1 . 2]" 1
1191 1 74 TYR QD 1 90 ALA MB . . 4.240 3.920 3.346 4.298 0.058 14 0 "[ . 1 . 2]" 1
1192 1 74 TYR QD 1 91 GLY H . . 4.030 3.585 3.338 4.070 0.040 9 0 "[ . 1 . 2]" 1
1193 1 74 TYR QD 1 91 GLY HA2 . . 4.520 3.274 2.907 3.864 . 0 0 "[ . 1 . 2]" 1
1194 1 74 TYR QD 1 92 TYR H . . 4.770 3.472 3.148 3.951 . 0 0 "[ . 1 . 2]" 1
1195 1 74 TYR QD 1 92 TYR HA . . 2.980 2.896 2.612 3.067 0.087 10 0 "[ . 1 . 2]" 1
1196 1 74 TYR QD 1 92 TYR QD . . 4.260 2.847 2.353 3.282 . 0 0 "[ . 1 . 2]" 1
1197 1 74 TYR QD 1 92 TYR QE . . 3.210 3.147 2.850 3.273 0.063 16 0 "[ . 1 . 2]" 1
1198 1 74 TYR QE 1 90 ALA MB . . 2.740 2.776 2.274 2.864 0.124 1 0 "[ . 1 . 2]" 1
1199 1 74 TYR QE 1 91 GLY H . . 5.500 3.244 2.834 3.920 . 0 0 "[ . 1 . 2]" 1
1200 1 74 TYR QE 1 91 GLY HA2 . . 3.140 2.180 2.046 2.514 . 0 0 "[ . 1 . 2]" 1
1201 1 74 TYR QE 1 91 GLY HA3 . . 3.680 3.769 3.764 3.776 0.096 14 0 "[ . 1 . 2]" 1
1202 1 74 TYR QE 1 92 TYR H . . 4.060 3.877 3.154 4.149 0.089 17 0 "[ . 1 . 2]" 1
1203 1 74 TYR QE 1 92 TYR QD . . 3.940 3.454 2.930 3.979 0.039 12 0 "[ . 1 . 2]" 1
1204 1 74 TYR QE 1 92 TYR QE . . 3.830 3.499 3.141 3.926 0.096 3 0 "[ . 1 . 2]" 1
1205 1 75 ILE H 1 75 ILE HB . . 3.280 2.530 2.334 2.684 . 0 0 "[ . 1 . 2]" 1
1206 1 75 ILE H 1 75 ILE MD . . 4.260 2.790 1.953 4.177 . 0 0 "[ . 1 . 2]" 1
1207 1 75 ILE H 1 75 ILE HG12 . . 4.090 4.143 3.970 4.181 0.091 11 0 "[ . 1 . 2]" 1
1208 1 75 ILE H 1 75 ILE HG13 . . 4.380 3.171 2.941 3.479 . 0 0 "[ . 1 . 2]" 1
1209 1 75 ILE H 1 75 ILE MG . . 3.990 3.805 3.717 3.865 . 0 0 "[ . 1 . 2]" 1
1210 1 75 ILE H 1 76 SER H . . 4.820 4.388 3.834 4.612 . 0 0 "[ . 1 . 2]" 1
1211 1 75 ILE H 1 91 GLY H . . 3.900 3.019 2.753 3.561 . 0 0 "[ . 1 . 2]" 1
1212 1 75 ILE H 1 92 TYR HA . . 4.290 3.008 2.695 3.333 . 0 0 "[ . 1 . 2]" 1
1213 1 75 ILE HA 1 75 ILE MD . . 3.900 3.669 3.459 3.955 0.055 7 0 "[ . 1 . 2]" 1
1214 1 75 ILE HA 1 75 ILE HG12 . . 3.600 3.213 2.416 3.661 0.061 18 0 "[ . 1 . 2]" 1
1215 1 75 ILE HA 1 75 ILE HG13 . . 3.630 2.606 2.361 3.112 . 0 0 "[ . 1 . 2]" 1
1216 1 75 ILE HA 1 75 ILE MG . . 3.310 2.405 2.282 2.520 . 0 0 "[ . 1 . 2]" 1
1217 1 75 ILE HA 1 76 SER H . . 2.860 2.265 2.157 2.347 . 0 0 "[ . 1 . 2]" 1
1218 1 75 ILE HB 1 75 ILE MD . . 3.310 2.316 2.218 2.473 . 0 0 "[ . 1 . 2]" 1
1219 1 75 ILE HB 1 76 SER H . . 4.690 4.076 3.830 4.515 . 0 0 "[ . 1 . 2]" 1
1220 1 75 ILE HB 1 91 GLY H . . 4.770 3.621 3.050 4.355 . 0 0 "[ . 1 . 2]" 1
1221 1 75 ILE HB 1 92 TYR HA . . 5.150 4.603 3.988 4.975 . 0 0 "[ . 1 . 2]" 1
1222 1 75 ILE MD 1 75 ILE MG . . 3.080 2.762 2.047 3.168 0.088 1 0 "[ . 1 . 2]" 1
1223 1 75 ILE MD 1 92 TYR HA . . 4.270 3.252 2.516 4.364 0.094 3 0 "[ . 1 . 2]" 1
1224 1 75 ILE MD 1 93 ASP H . . 3.920 2.869 2.475 3.650 . 0 0 "[ . 1 . 2]" 1
1225 1 75 ILE MD 1 93 ASP HA . . 3.710 2.731 2.257 3.679 . 0 0 "[ . 1 . 2]" 1
1226 1 75 ILE MD 1 93 ASP HB2 . . 3.490 2.344 2.036 3.652 0.162 14 0 "[ . 1 . 2]" 1
1227 1 75 ILE MD 1 93 ASP HB3 . . 3.760 3.518 2.333 3.847 0.087 15 0 "[ . 1 . 2]" 1
1228 1 75 ILE HG13 1 75 ILE MG . . 3.610 2.922 2.652 3.273 . 0 0 "[ . 1 . 2]" 1
1229 1 75 ILE HG13 1 92 TYR HA . . 4.980 4.736 3.625 5.052 0.072 10 0 "[ . 1 . 2]" 1
1230 1 75 ILE HG13 1 93 ASP HB2 . . 5.090 4.276 2.632 5.420 0.330 14 0 "[ . 1 . 2]" 1
1231 1 75 ILE MG 1 76 SER H . . 3.320 2.540 2.137 3.417 0.097 14 0 "[ . 1 . 2]" 1
1232 1 75 ILE MG 1 76 SER HA . . 4.520 3.564 3.172 4.172 . 0 0 "[ . 1 . 2]" 1
1233 1 75 ILE MG 1 77 HIS H . . 5.490 4.062 3.618 4.527 . 0 0 "[ . 1 . 2]" 1
1234 1 75 ILE MG 1 77 HIS HB3 . . 3.890 3.710 3.255 3.984 0.094 3 0 "[ . 1 . 2]" 1
1235 1 75 ILE MG 1 77 HIS HD2 . . 3.850 3.593 2.966 3.940 0.090 5 0 "[ . 1 . 2]" 1
1236 1 75 ILE MG 1 90 ALA HA . . 5.500 4.276 3.748 5.373 . 0 0 "[ . 1 . 2]" 1
1237 1 75 ILE MG 1 91 GLY H . . 5.000 4.416 3.944 4.762 . 0 0 "[ . 1 . 2]" 1
1238 1 76 SER H 1 76 SER HB2 . . 3.560 2.901 2.425 3.859 0.299 10 0 "[ . 1 . 2]" 1
1239 1 76 SER HA 1 77 HIS H . . 2.950 2.284 2.216 2.383 . 0 0 "[ . 1 . 2]" 1
1240 1 76 SER HA 1 77 HIS HD2 . . 4.520 3.954 3.406 4.576 0.056 5 0 "[ . 1 . 2]" 1
1241 1 76 SER HA 1 90 ALA H . . 4.580 4.633 4.541 4.662 0.082 17 0 "[ . 1 . 2]" 1
1242 1 76 SER HA 1 90 ALA HA . . 3.050 2.233 2.024 2.373 . 0 0 "[ . 1 . 2]" 1
1243 1 76 SER HA 1 90 ALA MB . . 3.440 2.610 2.150 3.169 . 0 0 "[ . 1 . 2]" 1
1244 1 76 SER HA 1 91 GLY H . . 3.920 3.790 3.159 3.988 0.068 8 0 "[ . 1 . 2]" 1
1245 1 76 SER HB2 1 90 ALA MB . . 4.260 3.540 2.157 4.346 0.086 9 0 "[ . 1 . 2]" 1
1246 1 76 SER HB3 1 90 ALA MB . . 3.430 3.043 2.221 4.134 0.704 18 2 "[ . 1 . + -]" 1
1247 1 77 HIS H 1 77 HIS HD2 . . 3.290 2.529 2.193 2.950 . 0 0 "[ . 1 . 2]" 1
1248 1 77 HIS H 1 78 PHE H . . 4.840 4.336 4.163 4.419 . 0 0 "[ . 1 . 2]" 1
1249 1 77 HIS H 1 79 THR MG . . 5.290 4.562 4.043 5.269 . 0 0 "[ . 1 . 2]" 1
1250 1 77 HIS H 1 89 GLU H . . 4.060 3.180 2.812 4.044 . 0 0 "[ . 1 . 2]" 1
1251 1 77 HIS H 1 90 ALA HA . . 3.870 3.673 3.304 3.930 0.060 2 0 "[ . 1 . 2]" 1
1252 1 77 HIS H 1 90 ALA MB . . 4.370 3.874 3.447 4.336 . 0 0 "[ . 1 . 2]" 1
1253 1 77 HIS HA 1 78 PHE H . . 3.050 2.540 2.206 2.909 . 0 0 "[ . 1 . 2]" 1
1254 1 77 HIS HA 1 78 PHE QD . . 3.750 3.762 3.417 3.844 0.094 9 0 "[ . 1 . 2]" 1
1255 1 77 HIS HB2 1 78 PHE H . . 3.570 2.204 1.888 2.637 . 0 0 "[ . 1 . 2]" 1
1256 1 77 HIS HB2 1 79 THR MG . . 5.140 4.525 3.631 5.232 0.092 3 0 "[ . 1 . 2]" 1
1257 1 77 HIS HB3 1 78 PHE H . . 3.730 3.577 3.347 3.806 0.076 19 0 "[ . 1 . 2]" 1
1258 1 77 HIS HD2 1 79 THR MG . . 3.340 2.792 2.155 3.458 0.118 3 0 "[ . 1 . 2]" 1
1259 1 77 HIS HD2 1 89 GLU H . . 4.750 3.672 2.875 4.597 . 0 0 "[ . 1 . 2]" 1
1260 1 77 HIS HD2 1 89 GLU HB2 . . 3.670 3.195 2.330 3.844 0.174 11 0 "[ . 1 . 2]" 1
1261 1 77 HIS HD2 1 89 GLU HB3 . . 3.770 3.614 2.972 3.848 0.078 19 0 "[ . 1 . 2]" 1
1262 1 78 PHE H 1 78 PHE QB . . 3.150 2.654 2.270 3.049 . 0 0 "[ . 1 . 2]" 1
1263 1 78 PHE H 1 78 PHE QD . . 3.820 2.282 1.982 2.813 . 0 0 "[ . 1 . 2]" 1
1264 1 78 PHE H 1 79 THR H . . 4.960 4.465 4.087 4.645 . 0 0 "[ . 1 . 2]" 1
1265 1 78 PHE H 1 79 THR MG . . 4.880 4.695 4.101 4.962 0.082 13 0 "[ . 1 . 2]" 1
1266 1 78 PHE H 1 80 VAL H . . 5.270 5.316 5.100 5.359 0.089 16 0 "[ . 1 . 2]" 1
1267 1 78 PHE HA 1 78 PHE QD . . 4.100 3.440 2.754 3.762 . 0 0 "[ . 1 . 2]" 1
1268 1 78 PHE HA 1 79 THR H . . 3.060 2.282 2.205 2.359 . 0 0 "[ . 1 . 2]" 1
1269 1 78 PHE HA 1 79 THR MG . . 4.740 3.735 3.255 4.172 . 0 0 "[ . 1 . 2]" 1
1270 1 78 PHE HA 1 80 VAL H . . 4.370 3.858 3.131 4.177 . 0 0 "[ . 1 . 2]" 1
1271 1 78 PHE HA 1 88 PHE QD . . 4.650 3.610 2.666 4.446 . 0 0 "[ . 1 . 2]" 1
1272 1 78 PHE HA 1 89 GLU H . . 3.860 3.229 2.694 3.918 0.058 19 0 "[ . 1 . 2]" 1
1273 1 78 PHE QB 1 79 THR H . . 4.330 3.047 2.726 3.636 . 0 0 "[ . 1 . 2]" 1
1274 1 78 PHE QB 1 80 VAL H . . 4.570 2.907 2.465 3.348 . 0 0 "[ . 1 . 2]" 1
1275 1 78 PHE QD 1 79 THR H . . 4.870 3.981 3.501 4.457 . 0 0 "[ . 1 . 2]" 1
1276 1 78 PHE QD 1 80 VAL H . . 4.640 3.163 2.053 4.515 . 0 0 "[ . 1 . 2]" 1
1277 1 78 PHE QD 1 80 VAL QG . . 4.640 3.859 3.243 4.462 . 0 0 "[ . 1 . 2]" 1
1278 1 78 PHE QD 1 86 LYS HB3 . . 3.310 2.898 2.169 3.412 0.102 2 0 "[ . 1 . 2]" 1
1279 1 78 PHE QD 1 87 GLU H . . 4.240 3.650 2.456 4.324 0.084 1 0 "[ . 1 . 2]" 1
1280 1 78 PHE QD 1 88 PHE QD . . 4.180 3.849 3.115 4.285 0.105 14 0 "[ . 1 . 2]" 1
1281 1 79 THR H 1 79 THR MG . . 3.290 2.828 2.484 3.129 . 0 0 "[ . 1 . 2]" 1
1282 1 79 THR H 1 80 VAL H . . 3.070 2.421 2.156 2.678 . 0 0 "[ . 1 . 2]" 1
1283 1 79 THR H 1 80 VAL HB . . 5.220 4.496 3.887 5.029 . 0 0 "[ . 1 . 2]" 1
1284 1 79 THR H 1 80 VAL QG . . 4.930 3.051 2.632 3.451 . 0 0 "[ . 1 . 2]" 1
1285 1 79 THR H 1 87 GLU H . . 5.030 3.824 3.208 4.850 . 0 0 "[ . 1 . 2]" 1
1286 1 79 THR HA 1 79 THR MG . . 2.950 2.252 2.150 2.514 . 0 0 "[ . 1 . 2]" 1
1287 1 79 THR HB 1 80 VAL QG . . 4.090 3.725 3.150 4.097 0.007 18 0 "[ . 1 . 2]" 1
1288 1 79 THR MG 1 80 VAL H . . 4.360 4.342 4.047 4.446 0.086 11 0 "[ . 1 . 2]" 1
1289 1 79 THR MG 1 89 GLU H . . 4.610 3.745 3.242 4.692 0.082 4 0 "[ . 1 . 2]" 1
1290 1 79 THR MG 1 89 GLU HB2 . . 3.370 2.347 2.032 2.725 . 0 0 "[ . 1 . 2]" 1
1291 1 79 THR MG 1 89 GLU HB3 . . 3.650 3.261 2.735 3.731 0.081 9 0 "[ . 1 . 2]" 1
1292 1 79 THR MG 1 89 GLU HG2 . . 4.400 4.233 3.779 4.501 0.101 4 0 "[ . 1 . 2]" 1
1293 1 79 THR MG 1 89 GLU HG3 . . 3.900 3.541 2.597 4.121 0.221 11 0 "[ . 1 . 2]" 1
1294 1 80 VAL H 1 80 VAL HB . . 3.810 3.109 2.456 3.621 . 0 0 "[ . 1 . 2]" 1
1295 1 80 VAL H 1 80 VAL QG . . 3.540 2.468 2.023 2.931 . 0 0 "[ . 1 . 2]" 1
1296 1 80 VAL H 1 81 ASN H . . 4.570 4.250 3.896 4.515 . 0 0 "[ . 1 . 2]" 1
1297 1 80 VAL H 1 87 GLU H . . 3.880 3.533 2.759 3.945 0.065 18 0 "[ . 1 . 2]" 1
1298 1 80 VAL HA 1 80 VAL QG . . 3.140 2.310 2.094 2.501 . 0 0 "[ . 1 . 2]" 1
1299 1 80 VAL HA 1 81 ASN H . . 2.870 2.229 2.083 2.531 . 0 0 "[ . 1 . 2]" 1
1300 1 80 VAL HA 1 81 ASN HB2 . . 4.860 4.606 4.327 4.914 0.054 9 0 "[ . 1 . 2]" 1
1301 1 80 VAL HA 1 81 ASN HB3 . . 4.600 4.608 4.224 4.919 0.319 2 0 "[ . 1 . 2]" 1
1302 1 80 VAL HB 1 81 ASN H . . 5.490 4.206 3.749 4.513 . 0 0 "[ . 1 . 2]" 1
1303 1 80 VAL HB 1 86 LYS HA . . 4.450 3.591 2.164 4.529 0.079 5 0 "[ . 1 . 2]" 1
1304 1 80 VAL HB 1 87 GLU QG . . 3.850 3.268 2.362 3.763 . 0 0 "[ . 1 . 2]" 1
1305 1 80 VAL QG 1 81 ASN H . . 3.420 2.710 2.076 3.316 . 0 0 "[ . 1 . 2]" 1
1306 1 80 VAL QG 1 81 ASN HA . . 4.170 3.638 3.002 4.154 . 0 0 "[ . 1 . 2]" 1
1307 1 80 VAL QG 1 81 ASN HB2 . . 5.290 4.761 4.278 5.137 . 0 0 "[ . 1 . 2]" 1
1308 1 80 VAL QG 1 81 ASN HB3 . . 5.500 4.700 4.257 5.043 . 0 0 "[ . 1 . 2]" 1
1309 1 80 VAL QG 1 82 GLU H . . 3.590 2.918 2.168 3.534 . 0 0 "[ . 1 . 2]" 1
1310 1 80 VAL QG 1 82 GLU QB . . 4.880 2.837 2.187 3.534 . 0 0 "[ . 1 . 2]" 1
1311 1 80 VAL QG 1 82 GLU QG . . 3.090 2.492 2.059 3.178 0.088 9 0 "[ . 1 . 2]" 1
1312 1 80 VAL QG 1 85 HIS HB3 . . 4.870 3.758 2.575 4.710 . 0 0 "[ . 1 . 2]" 1
1313 1 80 VAL QG 1 86 LYS H . . 5.160 4.091 3.636 4.959 . 0 0 "[ . 1 . 2]" 1
1314 1 80 VAL QG 1 86 LYS HA . . 3.850 2.177 1.862 2.835 . 0 0 "[ . 1 . 2]" 1
1315 1 80 VAL QG 1 87 GLU H . . 4.160 2.384 1.691 3.560 . 0 0 "[ . 1 . 2]" 1
1316 1 80 VAL QG 1 87 GLU HB2 . . 4.620 2.836 2.027 4.379 . 0 0 "[ . 1 . 2]" 1
1317 1 80 VAL QG 1 87 GLU QG . . 3.900 2.122 1.821 2.698 . 0 0 "[ . 1 . 2]" 1
1318 1 81 ASN H 1 81 ASN HB2 . . 3.650 3.150 2.733 3.497 . 0 0 "[ . 1 . 2]" 1
1319 1 81 ASN H 1 81 ASN HB3 . . 3.800 2.706 2.332 3.098 . 0 0 "[ . 1 . 2]" 1
1320 1 81 ASN H 1 82 GLU H . . 4.260 3.654 2.796 4.185 . 0 0 "[ . 1 . 2]" 1
1321 1 81 ASN H 1 82 GLU QG . . 4.100 3.760 2.914 4.189 0.089 12 0 "[ . 1 . 2]" 1
1322 1 81 ASN HA 1 82 GLU H . . 3.140 2.283 2.105 2.466 . 0 0 "[ . 1 . 2]" 1
1323 1 81 ASN HA 1 86 LYS HD3 . . 5.010 3.328 2.436 4.851 . 0 0 "[ . 1 . 2]" 1
1324 1 81 ASN HA 1 86 LYS HG2 . . 3.850 3.114 2.719 3.420 . 0 0 "[ . 1 . 2]" 1
1325 1 81 ASN HA 1 86 LYS HG3 . . 4.600 4.575 3.830 4.684 0.084 3 0 "[ . 1 . 2]" 1
1326 1 81 ASN HB2 1 81 ASN HD22 . . 3.720 3.876 3.574 4.156 0.436 2 0 "[ . 1 . 2]" 1
1327 1 81 ASN HB2 1 82 GLU H . . 5.310 4.585 4.462 4.654 . 0 0 "[ . 1 . 2]" 1
1328 1 81 ASN HB3 1 81 ASN HD22 . . 3.910 3.932 3.538 4.153 0.243 3 0 "[ . 1 . 2]" 1
1329 1 81 ASN HB3 1 82 GLU H . . 4.600 4.522 4.393 4.625 0.025 6 0 "[ . 1 . 2]" 1
1330 1 81 ASN HD21 1 82 GLU H . . 5.090 4.188 3.003 5.416 0.326 5 0 "[ . 1 . 2]" 1
1331 1 81 ASN HD22 1 82 GLU H . . 5.390 5.011 4.422 5.167 . 0 0 "[ . 1 . 2]" 1
1332 1 82 GLU H 1 82 GLU QG . . 3.600 3.239 2.715 3.674 0.074 12 0 "[ . 1 . 2]" 1
1333 1 82 GLU H 1 83 PRO HD2 . . 5.500 4.835 4.761 4.925 . 0 0 "[ . 1 . 2]" 1
1334 1 82 GLU H 1 85 HIS H . . 4.650 3.999 3.442 4.651 0.001 13 0 "[ . 1 . 2]" 1
1335 1 82 GLU H 1 86 LYS HA . . 4.000 3.936 3.120 4.081 0.081 6 0 "[ . 1 . 2]" 1
1336 1 82 GLU H 1 86 LYS HG2 . . 4.090 2.547 1.962 4.058 . 0 0 "[ . 1 . 2]" 1
1337 1 82 GLU H 1 86 LYS HG3 . . 4.490 3.637 2.985 4.554 0.064 19 0 "[ . 1 . 2]" 1
1338 1 82 GLU HA 1 82 GLU QG . . 3.420 2.722 2.453 3.103 . 0 0 "[ . 1 . 2]" 1
1339 1 82 GLU HA 1 83 PRO HD2 . . 2.990 2.585 2.352 2.846 . 0 0 "[ . 1 . 2]" 1
1340 1 82 GLU HA 1 83 PRO HD3 . . 3.070 2.494 2.299 2.841 . 0 0 "[ . 1 . 2]" 1
1341 1 82 GLU HA 1 83 PRO QG . . 4.120 4.179 4.102 4.216 0.096 19 0 "[ . 1 . 2]" 1
1342 1 82 GLU QB 1 83 PRO HD2 . . 3.690 2.198 1.994 2.697 . 0 0 "[ . 1 . 2]" 1
1343 1 82 GLU QB 1 84 ALA H . . 3.630 2.812 2.271 3.232 . 0 0 "[ . 1 . 2]" 1
1344 1 82 GLU QB 1 84 ALA MB . . 5.500 4.230 3.741 4.842 . 0 0 "[ . 1 . 2]" 1
1345 1 82 GLU QB 1 85 HIS H . . 4.280 2.457 1.734 2.753 . 0 0 "[ . 1 . 2]" 1
1346 1 82 GLU QB 1 85 HIS HB3 . . 3.790 2.642 2.077 3.937 0.147 1 0 "[ . 1 . 2]" 1
1347 1 82 GLU QG 1 83 PRO HD2 . . 3.900 3.795 3.513 3.991 0.091 11 0 "[ . 1 . 2]" 1
1348 1 82 GLU QG 1 85 HIS H . . 4.510 4.335 3.286 4.609 0.099 10 0 "[ . 1 . 2]" 1
1349 1 82 GLU QG 1 85 HIS HB3 . . 4.730 3.314 2.246 4.004 . 0 0 "[ . 1 . 2]" 1
1350 1 83 PRO HA 1 84 ALA MB . . 5.500 4.659 4.496 4.848 . 0 0 "[ . 1 . 2]" 1
1351 1 83 PRO HB2 1 84 ALA H . . 3.780 3.474 2.916 3.828 0.048 1 0 "[ . 1 . 2]" 1
1352 1 83 PRO HD2 1 84 ALA H . . 4.260 2.932 2.440 3.274 . 0 0 "[ . 1 . 2]" 1
1353 1 83 PRO HD2 1 85 HIS H . . 5.500 4.285 3.561 4.769 . 0 0 "[ . 1 . 2]" 1
1354 1 84 ALA H 1 84 ALA MB . . 3.030 2.423 2.228 2.675 . 0 0 "[ . 1 . 2]" 1
1355 1 84 ALA H 1 85 HIS H . . 3.070 2.278 1.904 2.542 . 0 0 "[ . 1 . 2]" 1
1356 1 84 ALA H 1 85 HIS HB2 . . 5.060 4.258 3.698 4.688 . 0 0 "[ . 1 . 2]" 1
1357 1 84 ALA H 1 85 HIS HB3 . . 4.790 4.282 3.492 5.119 0.329 1 0 "[ . 1 . 2]" 1
1358 1 84 ALA H 1 110 TRP HH2 . . 4.980 4.412 4.057 4.818 . 0 0 "[ . 1 . 2]" 1
1359 1 84 ALA HA 1 105 LEU H . . 4.620 3.750 3.214 4.379 . 0 0 "[ . 1 . 2]" 1
1360 1 84 ALA HA 1 105 LEU HB2 . . 3.680 2.869 2.544 3.228 . 0 0 "[ . 1 . 2]" 1
1361 1 84 ALA HA 1 105 LEU HB3 . . 3.510 2.336 2.081 2.779 . 0 0 "[ . 1 . 2]" 1
1362 1 84 ALA HA 1 105 LEU QD . . 3.570 2.562 2.194 3.356 . 0 0 "[ . 1 . 2]" 1
1363 1 84 ALA HA 1 105 LEU HG . . 4.690 4.518 3.978 4.776 0.086 11 0 "[ . 1 . 2]" 1
1364 1 84 ALA HA 1 110 TRP HH2 . . 3.080 2.877 2.332 3.139 0.059 20 0 "[ . 1 . 2]" 1
1365 1 84 ALA HA 1 110 TRP HZ2 . . 3.730 3.654 3.380 3.809 0.079 6 0 "[ . 1 . 2]" 1
1366 1 84 ALA HA 1 110 TRP HZ3 . . 4.440 4.029 3.537 4.509 0.069 7 0 "[ . 1 . 2]" 1
1367 1 84 ALA MB 1 85 HIS H . . 4.360 3.486 3.275 3.758 . 0 0 "[ . 1 . 2]" 1
1368 1 84 ALA MB 1 85 HIS HA . . 5.280 4.334 4.110 4.467 . 0 0 "[ . 1 . 2]" 1
1369 1 84 ALA MB 1 85 HIS HB2 . . 4.530 3.831 3.201 4.620 0.090 1 0 "[ . 1 . 2]" 1
1370 1 84 ALA MB 1 85 HIS HB3 . . 5.360 4.588 3.928 5.435 0.075 19 0 "[ . 1 . 2]" 1
1371 1 84 ALA MB 1 104 GLU HA . . 4.670 4.560 4.072 4.780 0.110 11 0 "[ . 1 . 2]" 1
1372 1 84 ALA MB 1 105 LEU H . . 3.330 3.095 2.738 3.411 0.081 11 0 "[ . 1 . 2]" 1
1373 1 84 ALA MB 1 105 LEU HB2 . . 3.520 3.519 3.160 3.618 0.098 6 0 "[ . 1 . 2]" 1
1374 1 84 ALA MB 1 105 LEU HB3 . . 3.080 2.109 2.054 2.204 . 0 0 "[ . 1 . 2]" 1
1375 1 84 ALA MB 1 105 LEU QD . . 3.540 2.245 2.029 2.441 . 0 0 "[ . 1 . 2]" 1
1376 1 84 ALA MB 1 105 LEU HG . . 4.450 3.770 3.446 4.035 . 0 0 "[ . 1 . 2]" 1
1377 1 84 ALA MB 1 110 TRP HH2 . . 4.620 4.399 4.018 4.554 . 0 0 "[ . 1 . 2]" 1
1378 1 84 ALA MB 1 110 TRP HZ3 . . 5.500 4.889 4.701 5.119 . 0 0 "[ . 1 . 2]" 1
1379 1 85 HIS H 1 85 HIS HB2 . . 4.030 3.165 2.874 3.511 . 0 0 "[ . 1 . 2]" 1
1380 1 85 HIS H 1 85 HIS HB3 . . 3.800 2.894 2.513 3.849 0.049 1 0 "[ . 1 . 2]" 1
1381 1 85 HIS H 1 86 LYS H . . 4.510 3.922 2.740 4.375 . 0 0 "[ . 1 . 2]" 1
1382 1 85 HIS H 1 86 LYS HG2 . . 5.440 4.150 3.628 4.997 . 0 0 "[ . 1 . 2]" 1
1383 1 85 HIS H 1 86 LYS HG3 . . 4.960 3.442 2.831 4.341 . 0 0 "[ . 1 . 2]" 1
1384 1 85 HIS H 1 110 TRP HH2 . . 3.610 3.372 2.796 3.683 0.073 14 0 "[ . 1 . 2]" 1
1385 1 85 HIS H 1 110 TRP HZ3 . . 5.070 4.192 3.561 4.846 . 0 0 "[ . 1 . 2]" 1
1386 1 85 HIS HA 1 86 LYS H . . 2.990 2.286 2.196 2.583 . 0 0 "[ . 1 . 2]" 1
1387 1 85 HIS HA 1 86 LYS HA . . 4.970 4.460 4.370 4.729 . 0 0 "[ . 1 . 2]" 1
1388 1 85 HIS HA 1 104 GLU HA . . 3.620 2.745 2.251 3.579 . 0 0 "[ . 1 . 2]" 1
1389 1 85 HIS HA 1 104 GLU HG2 . . 4.700 3.804 2.898 4.500 . 0 0 "[ . 1 . 2]" 1
1390 1 85 HIS HA 1 104 GLU HG3 . . 4.960 4.316 3.613 4.775 . 0 0 "[ . 1 . 2]" 1
1391 1 85 HIS HA 1 105 LEU H . . 4.630 3.773 3.294 4.531 . 0 0 "[ . 1 . 2]" 1
1392 1 85 HIS HA 1 110 TRP HZ3 . . 4.060 3.105 2.385 3.892 . 0 0 "[ . 1 . 2]" 1
1393 1 85 HIS HB2 1 86 LYS H . . 4.530 4.493 4.345 4.609 0.079 11 0 "[ . 1 . 2]" 1
1394 1 85 HIS HB3 1 86 LYS H . . 4.670 4.307 3.616 4.621 . 0 0 "[ . 1 . 2]" 1
1395 1 86 LYS H 1 86 LYS HG2 . . 4.530 4.077 3.505 4.398 . 0 0 "[ . 1 . 2]" 1
1396 1 86 LYS H 1 86 LYS HG3 . . 4.460 3.328 2.674 3.863 . 0 0 "[ . 1 . 2]" 1
1397 1 86 LYS H 1 104 GLU HA . . 4.330 3.917 3.407 4.398 0.068 11 0 "[ . 1 . 2]" 1
1398 1 86 LYS H 1 104 GLU HG2 . . 5.300 5.227 4.453 6.027 0.727 13 1 "[ . 1 + . 2]" 1
1399 1 86 LYS H 1 110 TRP HZ3 . . 3.370 2.790 1.983 3.396 0.026 11 0 "[ . 1 . 2]" 1
1400 1 86 LYS HA 1 86 LYS HD2 . . 5.260 4.416 4.118 4.662 . 0 0 "[ . 1 . 2]" 1
1401 1 86 LYS HA 1 86 LYS HG2 . . 3.700 2.510 2.285 2.815 . 0 0 "[ . 1 . 2]" 1
1402 1 86 LYS HA 1 86 LYS HG3 . . 4.230 3.232 2.875 3.467 . 0 0 "[ . 1 . 2]" 1
1403 1 86 LYS HA 1 87 GLU H . . 3.110 2.460 2.311 2.729 . 0 0 "[ . 1 . 2]" 1
1404 1 86 LYS HB2 1 87 GLU H . . 4.900 3.697 3.151 4.559 . 0 0 "[ . 1 . 2]" 1
1405 1 86 LYS HB2 1 103 PHE HB2 . . 4.630 2.922 2.142 3.390 . 0 0 "[ . 1 . 2]" 1
1406 1 86 LYS HB2 1 103 PHE HB3 . . 4.590 4.209 3.413 4.661 0.071 1 0 "[ . 1 . 2]" 1
1407 1 86 LYS HB2 1 103 PHE QD . . 4.510 3.835 2.782 4.486 . 0 0 "[ . 1 . 2]" 1
1408 1 86 LYS HB3 1 87 GLU H . . 4.430 2.613 2.086 3.785 . 0 0 "[ . 1 . 2]" 1
1409 1 86 LYS HB3 1 103 PHE QD . . 5.120 4.504 3.832 5.215 0.095 3 0 "[ . 1 . 2]" 1
1410 1 86 LYS QE 1 110 TRP HH2 . . 3.550 2.653 1.915 3.337 . 0 0 "[ . 1 . 2]" 1
1411 1 86 LYS QE 1 110 TRP HZ2 . . 3.800 3.094 2.423 3.725 . 0 0 "[ . 1 . 2]" 1
1412 1 86 LYS HG2 1 87 GLU H . . 4.960 4.273 3.916 4.643 . 0 0 "[ . 1 . 2]" 1
1413 1 86 LYS HG2 1 110 TRP HH2 . . 4.360 4.229 3.759 4.432 0.072 8 0 "[ . 1 . 2]" 1
1414 1 86 LYS HG3 1 103 PHE HB2 . . 5.370 4.798 4.300 5.440 0.070 1 0 "[ . 1 . 2]" 1
1415 1 86 LYS HG3 1 110 TRP HH2 . . 3.860 2.598 2.174 3.054 . 0 0 "[ . 1 . 2]" 1
1416 1 86 LYS HG3 1 110 TRP HZ3 . . 4.780 3.605 2.908 4.398 . 0 0 "[ . 1 . 2]" 1
1417 1 87 GLU H 1 87 GLU QG . . 5.100 2.903 2.381 3.922 . 0 0 "[ . 1 . 2]" 1
1418 1 87 GLU HA 1 102 VAL HA . . 3.620 2.343 2.053 2.789 . 0 0 "[ . 1 . 2]" 1
1419 1 87 GLU HA 1 102 VAL QG . . 4.120 3.333 2.975 3.797 . 0 0 "[ . 1 . 2]" 1
1420 1 87 GLU HA 1 103 PHE QD . . 5.110 3.140 2.051 4.542 . 0 0 "[ . 1 . 2]" 1
1421 1 87 GLU HB3 1 88 PHE H . . 4.690 3.004 2.226 4.140 . 0 0 "[ . 1 . 2]" 1
1422 1 87 GLU HB3 1 102 VAL QG . . 4.150 2.940 2.091 4.108 . 0 0 "[ . 1 . 2]" 1
1423 1 87 GLU QG 1 88 PHE H . . 5.500 4.073 2.144 4.491 . 0 0 "[ . 1 . 2]" 1
1424 1 87 GLU QG 1 102 VAL HA . . 4.440 3.341 2.235 4.049 . 0 0 "[ . 1 . 2]" 1
1425 1 87 GLU QG 1 103 PHE H . . 4.500 3.959 3.316 4.416 . 0 0 "[ . 1 . 2]" 1
1426 1 88 PHE H 1 88 PHE HB2 . . 3.890 3.003 2.487 3.433 . 0 0 "[ . 1 . 2]" 1
1427 1 88 PHE H 1 88 PHE HB3 . . 3.880 2.768 2.404 3.185 . 0 0 "[ . 1 . 2]" 1
1428 1 88 PHE H 1 101 VAL H . . 3.710 2.711 2.525 3.018 . 0 0 "[ . 1 . 2]" 1
1429 1 88 PHE H 1 101 VAL HB . . 4.110 3.585 2.971 4.026 . 0 0 "[ . 1 . 2]" 1
1430 1 88 PHE H 1 101 VAL QG . . 4.620 3.718 1.829 4.305 . 0 0 "[ . 1 . 2]" 1
1431 1 88 PHE H 1 102 VAL HA . . 4.370 3.641 3.169 4.111 . 0 0 "[ . 1 . 2]" 1
1432 1 88 PHE H 1 103 PHE QD . . 5.330 3.995 3.079 5.360 0.030 3 0 "[ . 1 . 2]" 1
1433 1 88 PHE HA 1 88 PHE QD . . 4.100 2.882 2.465 3.122 . 0 0 "[ . 1 . 2]" 1
1434 1 88 PHE HA 1 89 GLU H . . 3.130 2.233 2.155 2.324 . 0 0 "[ . 1 . 2]" 1
1435 1 88 PHE HA 1 101 VAL H . . 5.500 4.656 4.377 5.003 . 0 0 "[ . 1 . 2]" 1
1436 1 88 PHE HA 1 101 VAL HB . . 4.980 5.034 4.816 5.099 0.119 17 0 "[ . 1 . 2]" 1
1437 1 88 PHE HB2 1 101 VAL H . . 5.500 4.463 4.202 5.174 . 0 0 "[ . 1 . 2]" 1
1438 1 88 PHE HB2 1 103 PHE QD . . 4.340 3.570 2.606 4.205 . 0 0 "[ . 1 . 2]" 1
1439 1 88 PHE HB3 1 101 VAL H . . 4.490 3.067 2.673 3.884 . 0 0 "[ . 1 . 2]" 1
1440 1 88 PHE HB3 1 101 VAL HB . . 3.800 2.241 2.043 2.598 . 0 0 "[ . 1 . 2]" 1
1441 1 88 PHE HB3 1 101 VAL QG . . 4.690 2.817 1.872 3.212 . 0 0 "[ . 1 . 2]" 1
1442 1 88 PHE QD 1 89 GLU H . . 4.440 3.509 2.845 4.137 . 0 0 "[ . 1 . 2]" 1
1443 1 88 PHE QD 1 90 ALA MB . . 4.380 3.772 3.004 4.236 . 0 0 "[ . 1 . 2]" 1
1444 1 88 PHE QD 1 99 LEU QD . . 3.920 2.902 2.059 3.886 . 0 0 "[ . 1 . 2]" 1
1445 1 88 PHE QD 1 101 VAL HB . . 4.240 3.673 2.907 4.111 . 0 0 "[ . 1 . 2]" 1
1446 1 88 PHE QD 1 101 VAL QG . . 3.640 3.103 2.565 3.628 . 0 0 "[ . 1 . 2]" 1
1447 1 88 PHE QE 1 90 ALA MB . . 3.570 2.835 2.185 3.551 . 0 0 "[ . 1 . 2]" 1
1448 1 88 PHE QE 1 99 LEU QD . . 3.530 2.920 2.085 3.615 0.085 20 0 "[ . 1 . 2]" 1
1449 1 88 PHE QE 1 101 VAL QG . . 5.070 4.490 3.763 4.936 . 0 0 "[ . 1 . 2]" 1
1450 1 89 GLU H 1 89 GLU HB2 . . 3.840 2.484 2.288 2.694 . 0 0 "[ . 1 . 2]" 1
1451 1 89 GLU H 1 89 GLU HG3 . . 4.610 3.742 3.285 4.394 . 0 0 "[ . 1 . 2]" 1
1452 1 89 GLU H 1 100 ARG HA . . 5.120 4.893 4.254 5.182 0.062 18 0 "[ . 1 . 2]" 1
1453 1 89 GLU HA 1 89 GLU HG2 . . 3.670 2.395 2.144 2.702 . 0 0 "[ . 1 . 2]" 1
1454 1 89 GLU HA 1 89 GLU HG3 . . 3.990 2.785 2.376 3.218 . 0 0 "[ . 1 . 2]" 1
1455 1 89 GLU HA 1 90 ALA H . . 2.970 2.235 2.115 2.327 . 0 0 "[ . 1 . 2]" 1
1456 1 89 GLU HA 1 90 ALA MB . . 4.560 4.169 4.002 4.277 . 0 0 "[ . 1 . 2]" 1
1457 1 89 GLU HA 1 97 PRO HB3 . . 4.370 4.306 3.929 4.456 0.086 17 0 "[ . 1 . 2]" 1
1458 1 89 GLU HA 1 97 PRO QG . . 5.030 4.854 4.533 5.128 0.098 18 0 "[ . 1 . 2]" 1
1459 1 89 GLU HA 1 99 LEU H . . 5.300 4.581 4.053 4.985 . 0 0 "[ . 1 . 2]" 1
1460 1 89 GLU HA 1 99 LEU QD . . 5.500 4.641 3.529 5.244 . 0 0 "[ . 1 . 2]" 1
1461 1 89 GLU HA 1 100 ARG HA . . 3.520 2.752 2.467 2.971 . 0 0 "[ . 1 . 2]" 1
1462 1 89 GLU HA 1 100 ARG HG2 . . 5.470 4.918 3.995 5.486 0.016 11 0 "[ . 1 . 2]" 1
1463 1 89 GLU HA 1 100 ARG HG3 . . 4.910 3.477 2.765 4.200 . 0 0 "[ . 1 . 2]" 1
1464 1 89 GLU HA 1 101 VAL H . . 4.070 4.065 3.726 4.151 0.081 18 0 "[ . 1 . 2]" 1
1465 1 89 GLU HB2 1 90 ALA H . . 4.300 4.370 4.150 4.660 0.360 2 0 "[ . 1 . 2]" 1
1466 1 89 GLU HG2 1 100 ARG HA . . 4.090 3.777 2.708 4.169 0.079 5 0 "[ . 1 . 2]" 1
1467 1 89 GLU HG2 1 100 ARG QD . . 4.780 3.727 2.747 4.325 . 0 0 "[ . 1 . 2]" 1
1468 1 89 GLU HG3 1 90 ALA H . . 5.490 4.713 3.869 5.213 . 0 0 "[ . 1 . 2]" 1
1469 1 89 GLU HG3 1 100 ARG HA . . 4.460 3.982 2.679 4.534 0.074 10 0 "[ . 1 . 2]" 1
1470 1 90 ALA H 1 90 ALA MB . . 3.370 2.706 2.390 2.905 . 0 0 "[ . 1 . 2]" 1
1471 1 90 ALA H 1 97 PRO HB2 . . 4.630 3.389 3.034 3.943 . 0 0 "[ . 1 . 2]" 1
1472 1 90 ALA H 1 97 PRO HB3 . . 4.050 3.530 3.044 4.119 0.069 14 0 "[ . 1 . 2]" 1
1473 1 90 ALA H 1 98 SER H . . 4.740 3.909 3.367 4.567 . 0 0 "[ . 1 . 2]" 1
1474 1 90 ALA H 1 99 LEU H . . 3.730 3.068 2.705 3.397 . 0 0 "[ . 1 . 2]" 1
1475 1 90 ALA H 1 99 LEU HB2 . . 4.790 4.522 2.760 5.611 0.821 18 1 "[ . 1 . + 2]" 1
1476 1 90 ALA H 1 99 LEU QD . . 5.500 4.089 2.768 4.739 . 0 0 "[ . 1 . 2]" 1
1477 1 90 ALA H 1 99 LEU HG . . 5.220 4.891 4.246 5.301 0.081 2 0 "[ . 1 . 2]" 1
1478 1 90 ALA H 1 100 ARG HA . . 4.250 4.050 3.509 4.322 0.072 11 0 "[ . 1 . 2]" 1
1479 1 90 ALA HA 1 91 GLY H . . 2.970 2.243 2.141 2.444 . 0 0 "[ . 1 . 2]" 1
1480 1 90 ALA MB 1 91 GLY H . . 3.520 2.840 2.435 3.486 . 0 0 "[ . 1 . 2]" 1
1481 1 90 ALA MB 1 91 GLY HA2 . . 5.120 3.958 3.657 4.167 . 0 0 "[ . 1 . 2]" 1
1482 1 90 ALA MB 1 98 SER H . . 5.070 4.086 3.822 4.395 . 0 0 "[ . 1 . 2]" 1
1483 1 90 ALA MB 1 98 SER QB . . 5.020 4.421 3.583 4.883 . 0 0 "[ . 1 . 2]" 1
1484 1 90 ALA MB 1 99 LEU H . . 4.050 3.504 2.918 4.066 0.016 3 0 "[ . 1 . 2]" 1
1485 1 90 ALA MB 1 99 LEU QD . . 4.000 2.762 2.066 3.328 . 0 0 "[ . 1 . 2]" 1
1486 1 91 GLY H 1 97 PRO HA . . 4.950 4.312 3.886 4.878 . 0 0 "[ . 1 . 2]" 1
1487 1 91 GLY H 1 98 SER H . . 5.500 4.721 4.258 5.146 . 0 0 "[ . 1 . 2]" 1
1488 1 91 GLY HA2 1 92 TYR H . . 3.410 2.467 2.318 2.580 . 0 0 "[ . 1 . 2]" 1
1489 1 91 GLY HA2 1 97 PRO HA . . 4.660 2.918 2.250 3.773 . 0 0 "[ . 1 . 2]" 1
1490 1 91 GLY HA2 1 98 SER H . . 3.770 3.099 2.300 3.658 . 0 0 "[ . 1 . 2]" 1
1491 1 91 GLY HA2 1 99 LEU H . . 5.080 4.630 4.132 5.076 . 0 0 "[ . 1 . 2]" 1
1492 1 91 GLY HA3 1 92 TYR H . . 3.550 2.739 2.525 2.922 . 0 0 "[ . 1 . 2]" 1
1493 1 91 GLY HA3 1 98 SER H . . 3.670 3.339 2.460 3.737 0.067 7 0 "[ . 1 . 2]" 1
1494 1 92 TYR H 1 92 TYR HB2 . . 3.440 2.320 2.178 2.399 . 0 0 "[ . 1 . 2]" 1
1495 1 92 TYR H 1 92 TYR HB3 . . 3.770 3.570 3.487 3.622 . 0 0 "[ . 1 . 2]" 1
1496 1 92 TYR H 1 92 TYR QD . . 3.070 2.398 2.088 2.663 . 0 0 "[ . 1 . 2]" 1
1497 1 92 TYR H 1 92 TYR QE . . 4.540 4.565 4.114 4.637 0.097 14 0 "[ . 1 . 2]" 1
1498 1 92 TYR H 1 95 SER QB . . 4.700 3.329 2.422 4.183 . 0 0 "[ . 1 . 2]" 1
1499 1 92 TYR HA 1 93 ASP H . . 3.390 2.309 2.172 2.604 . 0 0 "[ . 1 . 2]" 1
1500 1 92 TYR HB2 1 93 ASP H . . 4.580 3.866 3.214 4.102 . 0 0 "[ . 1 . 2]" 1
1501 1 92 TYR HB2 1 95 SER QB . . 4.180 2.680 2.033 3.520 . 0 0 "[ . 1 . 2]" 1
1502 1 92 TYR HB3 1 93 ASP H . . 4.000 2.602 1.838 2.946 . 0 0 "[ . 1 . 2]" 1
1503 1 92 TYR HB3 1 95 SER H . . 5.500 4.451 3.573 5.162 . 0 0 "[ . 1 . 2]" 1
1504 1 92 TYR HB3 1 95 SER QB . . 5.090 3.650 3.000 4.649 . 0 0 "[ . 1 . 2]" 1
1505 1 93 ASP H 1 93 ASP HB2 . . 3.340 2.501 2.035 3.434 0.094 6 0 "[ . 1 . 2]" 1
1506 1 93 ASP H 1 93 ASP HB3 . . 3.360 2.601 2.130 3.160 . 0 0 "[ . 1 . 2]" 1
1507 1 93 ASP HA 1 94 GLU H . . 2.690 2.393 2.163 2.770 0.080 2 0 "[ . 1 . 2]" 1
1508 1 93 ASP HA 1 95 SER H . . 3.890 3.466 3.187 3.987 0.097 14 0 "[ . 1 . 2]" 1
1509 1 93 ASP HB3 1 94 GLU H . . 5.180 3.748 3.147 4.415 . 0 0 "[ . 1 . 2]" 1
1510 1 94 GLU H 1 94 GLU HA . . 2.780 2.319 2.167 2.867 0.087 10 0 "[ . 1 . 2]" 1
1511 1 94 GLU H 1 94 GLU HB2 . . 3.270 3.279 2.903 3.995 0.725 10 1 "[ . + . 2]" 1
1512 1 94 GLU H 1 95 SER H . . 3.520 2.913 1.511 3.499 . 0 0 "[ . 1 . 2]" 1
1513 1 94 GLU HA 1 94 GLU HB2 . . 2.890 2.853 2.347 2.981 0.091 2 0 "[ . 1 . 2]" 1
1514 1 94 GLU HA 1 95 SER H . . 3.520 3.277 2.999 3.550 0.030 18 0 "[ . 1 . 2]" 1
1515 1 94 GLU HB2 1 95 SER H . . 4.050 4.014 3.628 4.238 0.188 10 0 "[ . 1 . 2]" 1
1516 1 95 SER H 1 95 SER QB . . 3.450 2.568 2.241 3.094 . 0 0 "[ . 1 . 2]" 1
1517 1 95 SER H 1 96 GLU H . . 4.660 4.390 4.275 4.604 . 0 0 "[ . 1 . 2]" 1
1518 1 95 SER HA 1 96 GLU H . . 3.370 2.607 2.324 2.918 . 0 0 "[ . 1 . 2]" 1
1519 1 95 SER HA 1 96 GLU QB . . 4.520 4.377 4.072 4.439 . 0 0 "[ . 1 . 2]" 1
1520 1 95 SER QB 1 96 GLU H . . 3.540 2.285 1.793 2.832 . 0 0 "[ . 1 . 2]" 1
1521 1 95 SER QB 1 96 GLU QB . . 4.890 4.256 3.710 4.498 . 0 0 "[ . 1 . 2]" 1
1522 1 96 GLU H 1 96 GLU QB . . 3.270 2.439 2.080 2.940 . 0 0 "[ . 1 . 2]" 1
1523 1 96 GLU H 1 96 GLU HG3 . . 3.690 3.131 1.897 3.760 0.070 1 0 "[ . 1 . 2]" 1
1524 1 96 GLU H 1 97 PRO HA . . 5.500 5.382 4.708 5.566 0.066 16 0 "[ . 1 . 2]" 1
1525 1 96 GLU HA 1 96 GLU HG3 . . 3.470 3.288 2.742 4.125 0.655 1 1 "[+ . 1 . 2]" 1
1526 1 96 GLU HA 1 97 PRO HD2 . . 3.090 2.514 2.226 2.748 . 0 0 "[ . 1 . 2]" 1
1527 1 96 GLU HA 1 97 PRO HD3 . . 2.820 2.497 2.377 2.652 . 0 0 "[ . 1 . 2]" 1
1528 1 96 GLU QB 1 97 PRO HD2 . . 3.580 2.264 2.071 2.657 . 0 0 "[ . 1 . 2]" 1
1529 1 97 PRO HA 1 98 SER H . . 3.280 2.285 2.060 2.504 . 0 0 "[ . 1 . 2]" 1
1530 1 97 PRO HA 1 99 LEU H . . 4.050 3.907 3.335 4.125 0.075 14 0 "[ . 1 . 2]" 1
1531 1 97 PRO HB2 1 98 SER H . . 4.230 2.863 2.425 3.635 . 0 0 "[ . 1 . 2]" 1
1532 1 97 PRO HB2 1 99 LEU H . . 3.480 2.993 2.606 3.303 . 0 0 "[ . 1 . 2]" 1
1533 1 97 PRO HB3 1 98 SER H . . 3.850 3.525 3.221 3.929 0.079 11 0 "[ . 1 . 2]" 1
1534 1 97 PRO HB3 1 99 LEU H . . 4.300 4.161 3.840 4.363 0.063 4 0 "[ . 1 . 2]" 1
1535 1 97 PRO QG 1 99 LEU H . . 4.960 4.699 4.259 5.023 0.063 4 0 "[ . 1 . 2]" 1
1536 1 97 PRO QG 1 100 ARG QD . . 4.910 3.805 2.661 4.687 . 0 0 "[ . 1 . 2]" 1
1537 1 98 SER H 1 98 SER QB . . 3.710 2.540 2.210 2.817 . 0 0 "[ . 1 . 2]" 1
1538 1 98 SER H 1 99 LEU H . . 3.090 2.017 1.732 2.466 . 0 0 "[ . 1 . 2]" 1
1539 1 98 SER QB 1 99 LEU H . . 4.210 3.249 2.530 3.743 . 0 0 "[ . 1 . 2]" 1
1540 1 99 LEU H 1 99 LEU HB2 . . 3.530 3.004 2.447 3.580 0.050 18 0 "[ . 1 . 2]" 1
1541 1 99 LEU H 1 99 LEU QD . . 5.120 3.844 3.456 4.094 . 0 0 "[ . 1 . 2]" 1
1542 1 99 LEU H 1 100 ARG H . . 5.500 4.184 3.826 4.525 . 0 0 "[ . 1 . 2]" 1
1543 1 99 LEU HA 1 99 LEU QD . . 3.110 2.188 1.924 2.461 . 0 0 "[ . 1 . 2]" 1
1544 1 99 LEU HA 1 100 ARG H . . 3.030 2.174 1.947 2.271 . 0 0 "[ . 1 . 2]" 1
1545 1 99 LEU HA 1 101 VAL QG . . 5.280 4.509 4.137 4.989 . 0 0 "[ . 1 . 2]" 1
1546 1 99 LEU HA 1 116 TYR QD . . 3.950 3.869 3.358 4.033 0.083 12 0 "[ . 1 . 2]" 1
1547 1 99 LEU HA 1 117 ASN HA . . 3.850 3.125 2.392 3.790 . 0 0 "[ . 1 . 2]" 1
1548 1 99 LEU HA 1 118 ASP H . . 5.050 4.464 3.908 5.119 0.069 11 0 "[ . 1 . 2]" 1
1549 1 99 LEU HB3 1 100 ARG H . . 4.820 4.145 3.449 4.468 . 0 0 "[ . 1 . 2]" 1
1550 1 99 LEU QD 1 100 ARG H . . 3.320 2.756 2.076 3.344 0.024 3 0 "[ . 1 . 2]" 1
1551 1 99 LEU QD 1 100 ARG HA . . 5.500 4.075 2.853 5.081 . 0 0 "[ . 1 . 2]" 1
1552 1 99 LEU QD 1 116 TYR H . . 4.490 3.955 3.324 4.386 . 0 0 "[ . 1 . 2]" 1
1553 1 99 LEU QD 1 117 ASN HA . . 3.380 2.409 1.967 2.998 . 0 0 "[ . 1 . 2]" 1
1554 1 99 LEU QD 1 117 ASN HB2 . . 4.020 3.617 3.054 4.424 0.404 20 0 "[ . 1 . 2]" 1
1555 1 99 LEU QD 1 117 ASN HB3 . . 4.400 4.213 3.915 4.443 0.043 3 0 "[ . 1 . 2]" 1
1556 1 99 LEU QD 1 117 ASN HD21 . . 4.720 3.671 2.610 4.658 . 0 0 "[ . 1 . 2]" 1
1557 1 99 LEU QD 1 117 ASN HD22 . . 4.150 3.332 2.498 4.103 . 0 0 "[ . 1 . 2]" 1
1558 1 99 LEU QD 1 118 ASP H . . 4.460 3.418 2.599 4.218 . 0 0 "[ . 1 . 2]" 1
1559 1 100 ARG H 1 101 VAL QG . . 4.230 3.515 3.056 3.938 . 0 0 "[ . 1 . 2]" 1
1560 1 100 ARG H 1 115 CYS HA . . 4.950 4.645 3.990 5.027 0.077 12 0 "[ . 1 . 2]" 1
1561 1 100 ARG H 1 116 TYR H . . 3.780 2.927 2.640 3.272 . 0 0 "[ . 1 . 2]" 1
1562 1 100 ARG H 1 116 TYR HB2 . . 4.910 3.990 3.205 4.957 0.047 19 0 "[ . 1 . 2]" 1
1563 1 100 ARG H 1 116 TYR HB3 . . 4.670 2.541 2.038 3.331 . 0 0 "[ . 1 . 2]" 1
1564 1 100 ARG H 1 116 TYR QD . . 4.050 3.828 3.162 4.153 0.103 3 0 "[ . 1 . 2]" 1
1565 1 100 ARG HA 1 100 ARG QD . . 4.860 3.947 3.589 4.195 . 0 0 "[ . 1 . 2]" 1
1566 1 100 ARG HA 1 100 ARG HG2 . . 4.070 2.975 2.514 3.238 . 0 0 "[ . 1 . 2]" 1
1567 1 100 ARG HA 1 100 ARG HG3 . . 4.120 2.339 2.140 2.544 . 0 0 "[ . 1 . 2]" 1
1568 1 100 ARG HA 1 101 VAL H . . 2.970 2.235 2.050 2.371 . 0 0 "[ . 1 . 2]" 1
1569 1 100 ARG HA 1 101 VAL QG . . 5.500 3.572 3.199 4.214 . 0 0 "[ . 1 . 2]" 1
1570 1 100 ARG HB2 1 100 ARG QD . . 3.920 2.492 2.223 2.809 . 0 0 "[ . 1 . 2]" 1
1571 1 100 ARG HB2 1 100 ARG HE . . 5.500 3.482 2.904 4.322 . 0 0 "[ . 1 . 2]" 1
1572 1 100 ARG HB2 1 101 VAL H . . 5.060 4.390 4.120 4.614 . 0 0 "[ . 1 . 2]" 1
1573 1 100 ARG HB2 1 116 TYR H . . 4.780 4.657 4.164 4.855 0.075 17 0 "[ . 1 . 2]" 1
1574 1 100 ARG HB2 1 116 TYR HB2 . . 4.200 3.732 2.584 4.473 0.273 16 0 "[ . 1 . 2]" 1
1575 1 100 ARG HB2 1 116 TYR HB3 . . 3.970 2.820 2.274 3.323 . 0 0 "[ . 1 . 2]" 1
1576 1 100 ARG HB2 1 116 TYR QD . . 5.170 3.366 2.502 4.523 . 0 0 "[ . 1 . 2]" 1
1577 1 100 ARG HB3 1 101 VAL H . . 4.040 3.997 3.636 4.140 0.100 17 0 "[ . 1 . 2]" 1
1578 1 100 ARG HB3 1 116 TYR H . . 4.540 3.412 3.064 3.631 . 0 0 "[ . 1 . 2]" 1
1579 1 100 ARG HB3 1 116 TYR HB2 . . 4.410 2.633 2.045 3.542 . 0 0 "[ . 1 . 2]" 1
1580 1 100 ARG HB3 1 116 TYR HB3 . . 4.010 2.320 2.130 2.774 . 0 0 "[ . 1 . 2]" 1
1581 1 100 ARG HB3 1 116 TYR QD . . 3.560 3.608 3.368 3.694 0.134 16 0 "[ . 1 . 2]" 1
1582 1 100 ARG QD 1 102 VAL QG . . 4.730 4.147 3.102 4.592 . 0 0 "[ . 1 . 2]" 1
1583 1 100 ARG HG2 1 101 VAL H . . 4.350 3.185 2.387 4.321 . 0 0 "[ . 1 . 2]" 1
1584 1 100 ARG HG2 1 116 TYR H . . 5.500 5.176 4.410 5.551 0.051 6 0 "[ . 1 . 2]" 1
1585 1 100 ARG HG3 1 101 VAL H . . 4.380 3.406 2.791 4.455 0.075 3 0 "[ . 1 . 2]" 1
1586 1 100 ARG HG3 1 102 VAL QG . . 5.320 4.613 3.897 5.319 . 0 0 "[ . 1 . 2]" 1
1587 1 101 VAL H 1 101 VAL QG . . 3.550 2.788 2.336 3.109 . 0 0 "[ . 1 . 2]" 1
1588 1 101 VAL H 1 102 VAL H . . 5.390 4.179 3.810 4.819 . 0 0 "[ . 1 . 2]" 1
1589 1 101 VAL HA 1 101 VAL QG . . 3.130 2.151 2.078 2.265 . 0 0 "[ . 1 . 2]" 1
1590 1 101 VAL HA 1 102 VAL H . . 2.980 2.241 2.105 2.519 . 0 0 "[ . 1 . 2]" 1
1591 1 101 VAL HA 1 115 CYS HA . . 3.440 2.754 1.901 3.282 . 0 0 "[ . 1 . 2]" 1
1592 1 101 VAL HA 1 115 CYS HB2 . . 4.750 4.400 3.239 4.829 0.079 7 0 "[ . 1 . 2]" 1
1593 1 101 VAL HA 1 116 TYR H . . 4.440 3.811 2.980 4.494 0.054 15 0 "[ . 1 . 2]" 1
1594 1 101 VAL HB 1 102 VAL H . . 4.810 4.318 3.925 4.546 . 0 0 "[ . 1 . 2]" 1
1595 1 101 VAL QG 1 102 VAL H . . 3.260 2.861 2.325 3.228 . 0 0 "[ . 1 . 2]" 1
1596 1 101 VAL QG 1 103 PHE QD . . 4.070 3.286 2.469 3.611 . 0 0 "[ . 1 . 2]" 1
1597 1 101 VAL QG 1 114 ASP H . . 4.750 4.267 3.839 4.734 . 0 0 "[ . 1 . 2]" 1
1598 1 101 VAL QG 1 115 CYS HA . . 4.470 3.148 2.641 3.547 . 0 0 "[ . 1 . 2]" 1
1599 1 101 VAL QG 1 115 CYS HB2 . . 4.330 3.539 2.016 4.077 . 0 0 "[ . 1 . 2]" 1
1600 1 101 VAL QG 1 116 TYR H . . 5.500 3.592 3.128 3.930 . 0 0 "[ . 1 . 2]" 1
1601 1 102 VAL H 1 102 VAL HB . . 3.470 2.493 2.019 2.750 . 0 0 "[ . 1 . 2]" 1
1602 1 102 VAL H 1 102 VAL QG . . 3.310 2.542 2.226 2.930 . 0 0 "[ . 1 . 2]" 1
1603 1 102 VAL H 1 103 PHE H . . 5.080 4.531 4.214 4.732 . 0 0 "[ . 1 . 2]" 1
1604 1 102 VAL H 1 113 THR H . . 4.880 4.199 3.679 4.963 0.083 19 0 "[ . 1 . 2]" 1
1605 1 102 VAL H 1 114 ASP H . . 4.030 3.215 2.668 3.817 . 0 0 "[ . 1 . 2]" 1
1606 1 102 VAL H 1 114 ASP HB2 . . 4.960 4.588 3.037 5.037 0.077 10 0 "[ . 1 . 2]" 1
1607 1 102 VAL H 1 114 ASP HB3 . . 5.010 3.218 2.336 4.653 . 0 0 "[ . 1 . 2]" 1
1608 1 102 VAL H 1 115 CYS HA . . 4.220 3.903 3.521 4.271 0.051 7 0 "[ . 1 . 2]" 1
1609 1 102 VAL HA 1 102 VAL QG . . 3.140 2.130 2.036 2.229 . 0 0 "[ . 1 . 2]" 1
1610 1 102 VAL HA 1 103 PHE H . . 3.150 2.232 2.060 2.541 . 0 0 "[ . 1 . 2]" 1
1611 1 102 VAL HB 1 103 PHE H . . 4.410 4.108 3.824 4.315 . 0 0 "[ . 1 . 2]" 1
1612 1 102 VAL HB 1 113 THR H . . 4.790 3.309 2.852 4.269 . 0 0 "[ . 1 . 2]" 1
1613 1 102 VAL HB 1 114 ASP H . . 3.530 2.743 2.493 3.482 . 0 0 "[ . 1 . 2]" 1
1614 1 102 VAL HB 1 114 ASP HB2 . . 3.870 3.150 2.188 3.767 . 0 0 "[ . 1 . 2]" 1
1615 1 102 VAL HB 1 114 ASP HB3 . . 3.800 2.377 2.049 3.700 . 0 0 "[ . 1 . 2]" 1
1616 1 102 VAL QG 1 103 PHE H . . 3.310 2.470 2.224 2.765 . 0 0 "[ . 1 . 2]" 1
1617 1 102 VAL QG 1 103 PHE HA . . 4.650 3.592 3.030 3.819 . 0 0 "[ . 1 . 2]" 1
1618 1 102 VAL QG 1 103 PHE QD . . 5.480 4.459 4.133 4.976 . 0 0 "[ . 1 . 2]" 1
1619 1 102 VAL QG 1 104 GLU HG2 . . 4.010 3.883 3.506 4.251 0.241 17 0 "[ . 1 . 2]" 1
1620 1 102 VAL QG 1 104 GLU HG3 . . 4.210 2.696 2.246 4.000 . 0 0 "[ . 1 . 2]" 1
1621 1 102 VAL QG 1 113 THR H . . 3.480 3.317 1.827 3.518 0.038 19 0 "[ . 1 . 2]" 1
1622 1 102 VAL QG 1 114 ASP HB2 . . 4.010 2.971 2.130 3.394 . 0 0 "[ . 1 . 2]" 1
1623 1 102 VAL QG 1 114 ASP HB3 . . 3.870 2.273 2.088 3.103 . 0 0 "[ . 1 . 2]" 1
1624 1 103 PHE H 1 103 PHE HB2 . . 3.870 2.674 2.372 2.948 . 0 0 "[ . 1 . 2]" 1
1625 1 103 PHE H 1 103 PHE QD . . 3.490 3.172 2.559 3.582 0.092 3 0 "[ . 1 . 2]" 1
1626 1 103 PHE H 1 104 GLU H . . 5.500 4.306 4.043 4.451 . 0 0 "[ . 1 . 2]" 1
1627 1 103 PHE HA 1 103 PHE QD . . 3.480 2.901 2.282 3.331 . 0 0 "[ . 1 . 2]" 1
1628 1 103 PHE HA 1 104 GLU H . . 3.040 2.208 2.152 2.278 . 0 0 "[ . 1 . 2]" 1
1629 1 103 PHE HA 1 104 GLU HB2 . . 5.040 4.333 4.057 4.578 . 0 0 "[ . 1 . 2]" 1
1630 1 103 PHE HA 1 112 VAL MG2 . . 4.470 3.597 3.224 4.029 . 0 0 "[ . 1 . 2]" 1
1631 1 103 PHE HA 1 113 THR H . . 3.860 3.676 3.247 3.938 0.078 16 0 "[ . 1 . 2]" 1
1632 1 103 PHE HA 1 113 THR MG . . 4.600 4.272 3.825 4.659 0.059 4 0 "[ . 1 . 2]" 1
1633 1 103 PHE HB2 1 104 GLU H . . 4.750 4.225 4.004 4.595 . 0 0 "[ . 1 . 2]" 1
1634 1 103 PHE HB2 1 110 TRP HE3 . . 3.990 3.587 3.174 3.966 . 0 0 "[ . 1 . 2]" 1
1635 1 103 PHE HB2 1 110 TRP HZ3 . . 4.350 3.243 2.925 4.001 . 0 0 "[ . 1 . 2]" 1
1636 1 103 PHE HB3 1 104 GLU H . . 4.250 3.292 2.965 3.833 . 0 0 "[ . 1 . 2]" 1
1637 1 103 PHE HB3 1 110 TRP HE3 . . 3.420 2.275 2.156 2.469 . 0 0 "[ . 1 . 2]" 1
1638 1 103 PHE HB3 1 110 TRP HZ3 . . 5.180 3.156 2.620 3.756 . 0 0 "[ . 1 . 2]" 1
1639 1 103 PHE QD 1 112 VAL MG2 . . 3.050 2.703 2.207 3.124 0.074 16 0 "[ . 1 . 2]" 1
1640 1 104 GLU H 1 104 GLU HB2 . . 3.830 2.478 2.316 2.678 . 0 0 "[ . 1 . 2]" 1
1641 1 104 GLU H 1 104 GLU HB3 . . 4.080 3.606 2.830 3.766 . 0 0 "[ . 1 . 2]" 1
1642 1 104 GLU H 1 104 GLU HG2 . . 4.550 4.335 3.951 4.537 . 0 0 "[ . 1 . 2]" 1
1643 1 104 GLU H 1 104 GLU HG3 . . 4.600 3.381 2.887 4.681 0.081 3 0 "[ . 1 . 2]" 1
1644 1 104 GLU H 1 105 LEU H . . 5.250 4.328 4.035 4.497 . 0 0 "[ . 1 . 2]" 1
1645 1 104 GLU H 1 110 TRP HA . . 4.500 4.381 3.866 4.573 0.073 13 0 "[ . 1 . 2]" 1
1646 1 104 GLU H 1 110 TRP HE3 . . 4.140 3.250 2.796 3.742 . 0 0 "[ . 1 . 2]" 1
1647 1 104 GLU H 1 111 TYR H . . 3.680 2.858 2.642 3.338 . 0 0 "[ . 1 . 2]" 1
1648 1 104 GLU H 1 111 TYR QB . . 5.500 4.273 3.471 4.990 . 0 0 "[ . 1 . 2]" 1
1649 1 104 GLU H 1 113 THR MG . . 3.890 3.452 2.749 3.969 0.079 17 0 "[ . 1 . 2]" 1
1650 1 104 GLU HA 1 104 GLU HG2 . . 3.930 2.532 2.294 2.821 . 0 0 "[ . 1 . 2]" 1
1651 1 104 GLU HA 1 104 GLU HG3 . . 3.680 2.848 2.620 3.549 . 0 0 "[ . 1 . 2]" 1
1652 1 104 GLU HA 1 105 LEU H . . 2.930 2.208 2.083 2.332 . 0 0 "[ . 1 . 2]" 1
1653 1 104 GLU HA 1 105 LEU HA . . 4.910 4.494 4.424 4.565 . 0 0 "[ . 1 . 2]" 1
1654 1 104 GLU HA 1 105 LEU HB2 . . 4.740 4.499 4.167 4.707 . 0 0 "[ . 1 . 2]" 1
1655 1 104 GLU HA 1 105 LEU HB3 . . 4.530 4.461 4.264 4.593 0.063 13 0 "[ . 1 . 2]" 1
1656 1 104 GLU HA 1 110 TRP HZ3 . . 3.820 3.258 2.819 3.852 0.032 2 0 "[ . 1 . 2]" 1
1657 1 104 GLU HB2 1 105 LEU H . . 4.490 4.200 3.975 4.533 0.043 15 0 "[ . 1 . 2]" 1
1658 1 104 GLU HB3 1 105 LEU H . . 3.860 3.166 2.786 3.927 0.067 3 0 "[ . 1 . 2]" 1
1659 1 104 GLU HB3 1 113 THR MG . . 3.980 3.667 2.574 4.064 0.084 17 0 "[ . 1 . 2]" 1
1660 1 104 GLU HG2 1 105 LEU H . . 4.830 4.045 3.541 4.445 . 0 0 "[ . 1 . 2]" 1
1661 1 104 GLU HG2 1 113 THR MG . . 4.670 4.311 3.775 4.762 0.092 4 0 "[ . 1 . 2]" 1
1662 1 104 GLU HG3 1 105 LEU H . . 4.640 4.807 4.539 4.908 0.268 5 0 "[ . 1 . 2]" 1
1663 1 104 GLU HG3 1 113 THR MG . . 4.410 3.474 2.653 4.144 . 0 0 "[ . 1 . 2]" 1
1664 1 105 LEU H 1 105 LEU HB2 . . 3.470 2.903 2.651 3.163 . 0 0 "[ . 1 . 2]" 1
1665 1 105 LEU H 1 105 LEU HB3 . . 3.290 2.444 2.295 2.596 . 0 0 "[ . 1 . 2]" 1
1666 1 105 LEU H 1 105 LEU QD . . 4.230 3.851 3.719 3.975 . 0 0 "[ . 1 . 2]" 1
1667 1 105 LEU H 1 105 LEU HG . . 4.880 4.425 4.300 4.814 . 0 0 "[ . 1 . 2]" 1
1668 1 105 LEU H 1 110 TRP HE3 . . 5.180 4.025 3.414 4.585 . 0 0 "[ . 1 . 2]" 1
1669 1 105 LEU H 1 110 TRP HZ3 . . 3.790 3.648 3.069 3.877 0.087 11 0 "[ . 1 . 2]" 1
1670 1 105 LEU HA 1 105 LEU QD . . 3.230 2.373 2.088 2.642 . 0 0 "[ . 1 . 2]" 1
1671 1 105 LEU HA 1 105 LEU HG . . 4.030 2.975 2.723 3.574 . 0 0 "[ . 1 . 2]" 1
1672 1 105 LEU HA 1 106 THR H . . 2.880 2.214 2.014 2.297 . 0 0 "[ . 1 . 2]" 1
1673 1 105 LEU HA 1 109 LYS H . . 5.010 4.359 3.942 5.055 0.045 11 0 "[ . 1 . 2]" 1
1674 1 105 LEU HA 1 110 TRP HA . . 3.540 2.215 2.014 2.456 . 0 0 "[ . 1 . 2]" 1
1675 1 105 LEU HA 1 111 TYR H . . 4.080 3.614 3.113 3.824 . 0 0 "[ . 1 . 2]" 1
1676 1 105 LEU HA 1 111 TYR QR . . 4.970 3.779 2.642 5.003 0.033 10 0 "[ . 1 . 2]" 1
1677 1 105 LEU HB2 1 105 LEU QD . . 3.200 2.186 2.112 2.498 . 0 0 "[ . 1 . 2]" 1
1678 1 105 LEU HB2 1 106 THR H . . 4.610 4.416 4.131 4.593 . 0 0 "[ . 1 . 2]" 1
1679 1 105 LEU HB2 1 110 TRP HH2 . . 5.240 3.671 3.413 3.929 . 0 0 "[ . 1 . 2]" 1
1680 1 105 LEU HB2 1 110 TRP HZ3 . . 4.770 3.579 3.257 3.894 . 0 0 "[ . 1 . 2]" 1
1681 1 105 LEU HB3 1 105 LEU QD . . 3.100 2.183 2.110 2.246 . 0 0 "[ . 1 . 2]" 1
1682 1 105 LEU HB3 1 106 THR H . . 4.650 4.324 4.097 4.460 . 0 0 "[ . 1 . 2]" 1
1683 1 105 LEU HB3 1 110 TRP HH2 . . 5.050 4.364 3.856 4.943 . 0 0 "[ . 1 . 2]" 1
1684 1 105 LEU HB3 1 110 TRP HZ3 . . 4.680 4.429 4.181 4.820 0.140 11 0 "[ . 1 . 2]" 1
1685 1 105 LEU QD 1 106 THR H . . 3.540 3.198 2.133 3.550 0.010 15 0 "[ . 1 . 2]" 1
1686 1 105 LEU QD 1 108 GLY H . . 3.900 3.312 2.071 3.581 . 0 0 "[ . 1 . 2]" 1
1687 1 105 LEU QD 1 108 GLY HA2 . . 3.590 2.416 1.855 2.999 . 0 0 "[ . 1 . 2]" 1
1688 1 105 LEU QD 1 108 GLY HA3 . . 4.510 3.642 3.075 4.103 . 0 0 "[ . 1 . 2]" 1
1689 1 105 LEU QD 1 109 LYS H . . 4.150 3.210 2.453 3.813 . 0 0 "[ . 1 . 2]" 1
1690 1 105 LEU QD 1 109 LYS HA . . 4.510 3.260 2.929 3.693 . 0 0 "[ . 1 . 2]" 1
1691 1 105 LEU QD 1 110 TRP H . . 5.010 3.149 2.862 3.703 . 0 0 "[ . 1 . 2]" 1
1692 1 105 LEU QD 1 110 TRP HA . . 3.740 2.850 2.555 3.297 . 0 0 "[ . 1 . 2]" 1
1693 1 105 LEU QD 1 110 TRP HD1 . . 4.170 3.023 2.770 3.271 . 0 0 "[ . 1 . 2]" 1
1694 1 105 LEU QD 1 110 TRP HE1 . . 3.560 2.534 2.433 2.996 . 0 0 "[ . 1 . 2]" 1
1695 1 105 LEU QD 1 110 TRP HH2 . . 5.440 3.973 3.703 4.335 . 0 0 "[ . 1 . 2]" 1
1696 1 105 LEU QD 1 110 TRP HZ2 . . 3.650 3.050 2.817 3.455 . 0 0 "[ . 1 . 2]" 1
1697 1 105 LEU HG 1 106 THR H . . 4.300 3.240 2.768 4.388 0.088 13 0 "[ . 1 . 2]" 1
1698 1 105 LEU HG 1 107 ASP H . . 5.500 4.801 4.126 5.576 0.076 13 0 "[ . 1 . 2]" 1
1699 1 105 LEU HG 1 108 GLY H . . 4.300 3.227 2.378 4.288 . 0 0 "[ . 1 . 2]" 1
1700 1 105 LEU HG 1 108 GLY HA2 . . 4.660 3.255 2.749 3.612 . 0 0 "[ . 1 . 2]" 1
1701 1 105 LEU HG 1 108 GLY HA3 . . 4.990 4.848 4.275 5.090 0.101 13 0 "[ . 1 . 2]" 1
1702 1 105 LEU HG 1 109 LYS H . . 5.200 3.909 3.318 5.270 0.070 13 0 "[ . 1 . 2]" 1
1703 1 105 LEU HG 1 110 TRP HA . . 5.070 4.725 4.457 5.025 . 0 0 "[ . 1 . 2]" 1
1704 1 105 LEU HG 1 110 TRP HE1 . . 5.500 5.447 3.208 5.581 0.081 12 0 "[ . 1 . 2]" 1
1705 1 106 THR H 1 106 THR HB . . 3.760 2.788 2.498 3.034 . 0 0 "[ . 1 . 2]" 1
1706 1 106 THR H 1 106 THR MG . . 4.520 3.851 2.651 4.058 . 0 0 "[ . 1 . 2]" 1
1707 1 106 THR H 1 109 LYS H . . 3.310 3.013 2.413 3.386 0.076 11 0 "[ . 1 . 2]" 1
1708 1 106 THR H 1 110 TRP HA . . 3.970 3.614 3.191 4.017 0.047 8 0 "[ . 1 . 2]" 1
1709 1 106 THR H 1 111 TYR H . . 5.130 4.594 3.795 5.183 0.053 6 0 "[ . 1 . 2]" 1
1710 1 106 THR H 1 111 TYR QD . . 3.790 3.340 2.369 3.876 0.086 13 0 "[ . 1 . 2]" 1
1711 1 106 THR HA 1 106 THR MG . . 3.110 2.446 2.275 3.217 0.107 6 0 "[ . 1 . 2]" 1
1712 1 106 THR HA 1 107 ASP H . . 2.860 2.294 2.132 2.719 . 0 0 "[ . 1 . 2]" 1
1713 1 106 THR HA 1 108 GLY H . . 4.120 3.593 3.243 4.216 0.096 11 0 "[ . 1 . 2]" 1
1714 1 106 THR HA 1 109 LYS H . . 5.090 4.508 4.199 4.774 . 0 0 "[ . 1 . 2]" 1
1715 1 106 THR HB 1 107 ASP HB2 . . 5.110 4.272 3.708 5.174 0.064 6 0 "[ . 1 . 2]" 1
1716 1 106 THR HB 1 109 LYS H . . 4.780 4.498 2.128 4.887 0.107 6 0 "[ . 1 . 2]" 1
1717 1 106 THR MG 1 107 ASP H . . 3.310 2.670 1.674 3.357 0.047 6 0 "[ . 1 . 2]" 1
1718 1 106 THR MG 1 107 ASP HA . . 4.570 3.995 3.735 4.367 . 0 0 "[ . 1 . 2]" 1
1719 1 106 THR MG 1 107 ASP HB2 . . 3.410 2.586 2.280 3.104 . 0 0 "[ . 1 . 2]" 1
1720 1 106 THR MG 1 107 ASP HB3 . . 4.030 3.721 2.759 4.124 0.094 11 0 "[ . 1 . 2]" 1
1721 1 106 THR MG 1 108 GLY H . . 4.700 4.585 4.379 4.795 0.095 15 0 "[ . 1 . 2]" 1
1722 1 106 THR MG 1 109 LYS H . . 4.860 4.739 3.600 4.953 0.093 10 0 "[ . 1 . 2]" 1
1723 1 106 THR MG 1 111 TYR QR . . 3.780 3.583 2.144 3.900 0.120 9 0 "[ . 1 . 2]" 1
1724 1 107 ASP H 1 107 ASP HA . . 2.810 2.283 2.194 2.885 0.075 11 0 "[ . 1 . 2]" 1
1725 1 107 ASP H 1 107 ASP HB2 . . 3.900 3.010 1.972 3.397 . 0 0 "[ . 1 . 2]" 1
1726 1 107 ASP H 1 107 ASP HB3 . . 3.990 3.795 3.255 4.058 0.068 6 0 "[ . 1 . 2]" 1
1727 1 107 ASP H 1 108 GLY H . . 3.500 2.714 2.397 3.472 . 0 0 "[ . 1 . 2]" 1
1728 1 107 ASP HA 1 107 ASP HB3 . . 3.010 2.967 2.585 3.038 0.028 8 0 "[ . 1 . 2]" 1
1729 1 107 ASP HA 1 108 GLY H . . 3.140 2.922 2.358 3.200 0.060 1 0 "[ . 1 . 2]" 1
1730 1 107 ASP HB2 1 108 GLY H . . 4.520 4.458 4.102 4.580 0.060 2 0 "[ . 1 . 2]" 1
1731 1 107 ASP HB2 1 109 LYS H . . 4.670 4.575 3.801 4.751 0.081 13 0 "[ . 1 . 2]" 1
1732 1 107 ASP HB3 1 108 GLY H . . 4.300 4.187 3.940 4.378 0.078 6 0 "[ . 1 . 2]" 1
1733 1 107 ASP HB3 1 109 LYS H . . 4.850 3.692 3.157 4.706 . 0 0 "[ . 1 . 2]" 1
1734 1 108 GLY H 1 109 LYS H . . 3.510 2.761 2.532 3.071 . 0 0 "[ . 1 . 2]" 1
1735 1 109 LYS H 1 109 LYS HB3 . . 3.740 3.604 2.928 3.784 0.044 1 0 "[ . 1 . 2]" 1
1736 1 109 LYS H 1 109 LYS QD . . 4.140 3.594 2.257 4.243 0.103 3 0 "[ . 1 . 2]" 1
1737 1 109 LYS H 1 109 LYS QE . . 4.470 4.066 3.000 4.556 0.086 19 0 "[ . 1 . 2]" 1
1738 1 109 LYS H 1 109 LYS HG2 . . 4.100 3.281 2.143 4.191 0.091 6 0 "[ . 1 . 2]" 1
1739 1 109 LYS H 1 109 LYS HG3 . . 3.580 3.380 2.346 4.172 0.592 16 5 "[- * 1 *+* 2]" 1
1740 1 109 LYS HA 1 109 LYS QD . . 4.400 3.439 2.022 4.399 . 0 0 "[ . 1 . 2]" 1
1741 1 109 LYS HA 1 109 LYS QE . . 4.980 4.232 2.490 5.082 0.102 8 0 "[ . 1 . 2]" 1
1742 1 109 LYS HA 1 109 LYS HG2 . . 3.880 3.242 2.575 3.706 . 0 0 "[ . 1 . 2]" 1
1743 1 109 LYS HA 1 109 LYS HG3 . . 3.920 3.370 2.379 3.978 0.058 18 0 "[ . 1 . 2]" 1
1744 1 109 LYS HA 1 110 TRP H . . 3.100 2.214 2.053 2.469 . 0 0 "[ . 1 . 2]" 1
1745 1 109 LYS HA 1 110 TRP HB2 . . 5.180 4.520 4.362 4.773 . 0 0 "[ . 1 . 2]" 1
1746 1 109 LYS HA 1 110 TRP HD1 . . 4.680 4.221 3.598 4.748 0.068 14 0 "[ . 1 . 2]" 1
1747 1 109 LYS HB3 1 110 TRP H . . 3.770 3.400 2.759 4.208 0.438 17 0 "[ . 1 . 2]" 1
1748 1 109 LYS QD 1 109 LYS HG3 . . 2.750 2.310 2.154 2.483 . 0 0 "[ . 1 . 2]" 1
1749 1 110 TRP H 1 110 TRP HB2 . . 3.670 2.351 2.238 2.449 . 0 0 "[ . 1 . 2]" 1
1750 1 110 TRP H 1 110 TRP HB3 . . 3.940 3.587 3.487 3.665 . 0 0 "[ . 1 . 2]" 1
1751 1 110 TRP H 1 110 TRP HD1 . . 3.390 2.916 2.529 3.363 . 0 0 "[ . 1 . 2]" 1
1752 1 110 TRP H 1 111 TYR H . . 4.760 4.581 4.432 4.662 . 0 0 "[ . 1 . 2]" 1
1753 1 110 TRP HA 1 110 TRP HE3 . . 4.230 3.010 2.610 3.448 . 0 0 "[ . 1 . 2]" 1
1754 1 110 TRP HA 1 111 TYR H . . 2.980 2.257 2.137 2.371 . 0 0 "[ . 1 . 2]" 1
1755 1 110 TRP HA 1 111 TYR QB . . 4.470 4.350 3.856 4.557 0.087 6 0 "[ . 1 . 2]" 1
1756 1 110 TRP HA 1 111 TYR QR . . 4.610 3.682 2.872 4.683 0.073 20 0 "[ . 1 . 2]" 1
1757 1 110 TRP HB2 1 110 TRP HD1 . . 3.620 2.656 2.594 2.728 . 0 0 "[ . 1 . 2]" 1
1758 1 110 TRP HB2 1 111 TYR H . . 4.740 4.133 3.836 4.534 . 0 0 "[ . 1 . 2]" 1
1759 1 110 TRP HB3 1 111 TYR H . . 4.650 3.026 2.542 3.662 . 0 0 "[ . 1 . 2]" 1
1760 1 110 TRP HE3 1 111 TYR H . . 4.560 3.326 2.821 4.131 . 0 0 "[ . 1 . 2]" 1
1761 1 111 TYR H 1 111 TYR QB . . 3.710 2.871 2.370 3.323 . 0 0 "[ . 1 . 2]" 1
1762 1 111 TYR H 1 111 TYR QD . . 4.040 3.188 2.496 4.039 . 0 0 "[ . 1 . 2]" 1
1763 1 111 TYR H 1 112 VAL H . . 5.500 4.332 4.174 4.549 . 0 0 "[ . 1 . 2]" 1
1764 1 111 TYR HA 1 111 TYR QR . . 3.990 3.121 2.206 3.770 . 0 0 "[ . 1 . 2]" 1
1765 1 111 TYR HA 1 112 VAL H . . 3.020 2.328 2.211 2.585 . 0 0 "[ . 1 . 2]" 1
1766 1 111 TYR HA 1 112 VAL MG2 . . 4.720 3.768 3.254 4.193 . 0 0 "[ . 1 . 2]" 1
1767 1 111 TYR HA 1 113 THR MG . . 5.500 4.861 4.206 5.600 0.100 19 0 "[ . 1 . 2]" 1
1768 1 111 TYR QB 1 112 VAL H . . 3.650 3.010 2.516 3.588 . 0 0 "[ . 1 . 2]" 1
1769 1 111 TYR QB 1 113 THR MG . . 3.690 3.158 2.311 3.806 0.116 12 0 "[ . 1 . 2]" 1
1770 1 111 TYR QR 1 113 THR MG . . 4.800 3.206 1.804 4.607 . 0 0 "[ . 1 . 2]" 1
1771 1 111 TYR QD 1 112 VAL H . . 5.060 3.965 3.011 4.605 . 0 0 "[ . 1 . 2]" 1
1772 1 112 VAL H 1 112 VAL HB . . 3.530 2.420 2.215 2.819 . 0 0 "[ . 1 . 2]" 1
1773 1 112 VAL H 1 112 VAL MG2 . . 3.550 2.392 2.006 2.881 . 0 0 "[ . 1 . 2]" 1
1774 1 112 VAL H 1 113 THR H . . 5.040 4.572 4.448 4.709 . 0 0 "[ . 1 . 2]" 1
1775 1 112 VAL H 1 113 THR MG . . 5.500 4.324 3.826 4.853 . 0 0 "[ . 1 . 2]" 1
1776 1 112 VAL MG1 1 113 THR H . . 3.870 2.743 2.487 3.112 . 0 0 "[ . 1 . 2]" 1
1777 1 112 VAL MG1 1 114 ASP H . . 3.810 2.469 2.078 2.897 . 0 0 "[ . 1 . 2]" 1
1778 1 112 VAL MG2 1 113 THR H . . 4.590 4.163 3.793 4.465 . 0 0 "[ . 1 . 2]" 1
1779 1 113 THR H 1 113 THR MG . . 3.450 2.782 2.485 2.989 . 0 0 "[ . 1 . 2]" 1
1780 1 113 THR H 1 114 ASP H . . 3.000 2.111 1.771 2.455 . 0 0 "[ . 1 . 2]" 1
1781 1 113 THR HA 1 113 THR MG . . 3.070 2.440 2.173 3.171 0.101 19 0 "[ . 1 . 2]" 1
1782 1 113 THR HB 1 114 ASP H . . 4.960 4.383 3.979 4.821 . 0 0 "[ . 1 . 2]" 1
1783 1 113 THR MG 1 114 ASP H . . 4.340 4.216 3.541 4.391 0.051 9 0 "[ . 1 . 2]" 1
1784 1 114 ASP HA 1 115 CYS H . . 3.080 2.401 2.177 2.566 . 0 0 "[ . 1 . 2]" 1
1785 1 114 ASP HB2 1 115 CYS H . . 4.660 4.033 3.709 4.198 . 0 0 "[ . 1 . 2]" 1
1786 1 114 ASP HB3 1 115 CYS H . . 3.820 3.629 3.187 4.086 0.266 12 0 "[ . 1 . 2]" 1
1787 1 115 CYS H 1 116 TYR H . . 4.930 4.184 3.897 4.366 . 0 0 "[ . 1 . 2]" 1
1788 1 115 CYS HA 1 116 TYR H . . 2.970 2.198 2.096 2.315 . 0 0 "[ . 1 . 2]" 1
1789 1 115 CYS HB2 1 116 TYR H . . 4.570 3.878 3.072 4.315 . 0 0 "[ . 1 . 2]" 1
1790 1 115 CYS HB3 1 116 TYR H . . 4.490 4.177 3.437 4.552 0.062 12 0 "[ . 1 . 2]" 1
1791 1 116 TYR H 1 116 TYR HB2 . . 3.810 2.963 2.390 3.323 . 0 0 "[ . 1 . 2]" 1
1792 1 116 TYR H 1 116 TYR HB3 . . 4.020 2.774 2.492 3.075 . 0 0 "[ . 1 . 2]" 1
1793 1 116 TYR H 1 116 TYR QD . . 4.730 4.343 4.105 4.443 . 0 0 "[ . 1 . 2]" 1
1794 1 116 TYR H 1 117 ASN H . . 5.200 4.088 3.582 4.523 . 0 0 "[ . 1 . 2]" 1
1795 1 116 TYR HA 1 116 TYR QD . . 2.980 2.622 2.187 3.069 0.089 13 0 "[ . 1 . 2]" 1
1796 1 116 TYR HA 1 117 ASN H . . 3.030 2.279 2.130 2.486 . 0 0 "[ . 1 . 2]" 1
1797 1 116 TYR HB2 1 117 ASN H . . 4.890 4.502 4.212 4.709 . 0 0 "[ . 1 . 2]" 1
1798 1 116 TYR QD 1 117 ASN H . . 4.400 3.577 2.892 4.362 . 0 0 "[ . 1 . 2]" 1
1799 1 117 ASN H 1 117 ASN HB2 . . 4.070 2.946 2.147 3.381 . 0 0 "[ . 1 . 2]" 1
1800 1 117 ASN H 1 117 ASN HB3 . . 3.910 3.176 2.756 3.699 . 0 0 "[ . 1 . 2]" 1
1801 1 117 ASN H 1 120 TYR QD . . 5.500 4.371 3.245 5.563 0.063 12 0 "[ . 1 . 2]" 1
1802 1 117 ASN HA 1 118 ASP H . . 3.210 2.298 2.135 2.485 . 0 0 "[ . 1 . 2]" 1
1803 1 117 ASN HA 1 119 TRP H . . 5.130 4.298 3.813 5.207 0.077 12 0 "[ . 1 . 2]" 1
1804 1 117 ASN HB2 1 117 ASN HD22 . . 4.050 3.785 3.524 4.121 0.071 9 0 "[ . 1 . 2]" 1
1805 1 117 ASN HB2 1 120 TYR QD . . 4.800 4.550 2.787 4.888 0.088 4 0 "[ . 1 . 2]" 1
1806 1 117 ASN HB3 1 120 TYR QD . . 4.530 3.767 2.995 4.894 0.364 8 0 "[ . 1 . 2]" 1
1807 1 117 ASN HD21 1 119 TRP HD1 . . 3.370 2.867 2.110 4.041 0.671 14 2 "[- . 1 +. 2]" 1
1808 1 117 ASN HD21 1 119 TRP HE1 . . 5.130 4.743 3.665 6.079 0.949 14 3 "[* . - 1 +. 2]" 1
1809 1 117 ASN HD22 1 119 TRP HD1 . . 3.960 2.962 2.409 3.894 . 0 0 "[ . 1 . 2]" 1
1810 1 118 ASP H 1 118 ASP HB2 . . 3.510 2.807 1.992 3.590 0.080 14 0 "[ . 1 . 2]" 1
1811 1 118 ASP H 1 118 ASP HB3 . . 3.460 2.771 2.346 3.582 0.122 12 0 "[ . 1 . 2]" 1
1812 1 118 ASP H 1 119 TRP H . . 4.950 2.807 2.345 3.381 . 0 0 "[ . 1 . 2]" 1
1813 1 118 ASP HA 1 120 TYR H . . 3.660 3.536 2.935 3.759 0.099 12 0 "[ . 1 . 2]" 1
1814 1 118 ASP HB3 1 119 TRP H . . 5.180 3.676 2.498 4.453 . 0 0 "[ . 1 . 2]" 1
1815 1 119 TRP H 1 119 TRP HB2 . . 3.330 2.419 2.196 3.241 . 0 0 "[ . 1 . 2]" 1
1816 1 119 TRP H 1 119 TRP HD1 . . 4.350 3.221 2.754 3.713 . 0 0 "[ . 1 . 2]" 1
1817 1 119 TRP H 1 119 TRP HE1 . . 5.500 5.253 4.800 5.573 0.073 12 0 "[ . 1 . 2]" 1
1818 1 119 TRP H 1 120 TYR H . . 3.450 3.011 2.400 3.537 0.087 12 0 "[ . 1 . 2]" 1
1819 1 119 TRP HA 1 119 TRP HD1 . . 4.890 4.283 3.933 4.597 . 0 0 "[ . 1 . 2]" 1
1820 1 119 TRP HA 1 119 TRP HE3 . . 3.380 2.762 2.362 3.283 . 0 0 "[ . 1 . 2]" 1
1821 1 119 TRP HA 1 120 TYR HA . . 4.860 4.551 4.401 4.715 . 0 0 "[ . 1 . 2]" 1
1822 1 119 TRP HA 1 121 ASN H . . 4.950 4.504 4.063 5.017 0.067 17 0 "[ . 1 . 2]" 1
1823 1 119 TRP HA 1 121 ASN QD . . 5.500 3.946 3.176 4.566 . 0 0 "[ . 1 . 2]" 1
1824 1 119 TRP HA 1 132 THR MG . . 4.690 3.716 3.270 4.281 . 0 0 "[ . 1 . 2]" 1
1825 1 119 TRP HB2 1 119 TRP HD1 . . 3.680 2.621 2.455 2.727 . 0 0 "[ . 1 . 2]" 1
1826 1 119 TRP HB2 1 120 TYR H . . 3.980 3.190 2.700 3.628 . 0 0 "[ . 1 . 2]" 1
1827 1 119 TRP HB2 1 132 THR MG . . 4.800 4.648 4.202 4.902 0.102 3 0 "[ . 1 . 2]" 1
1828 1 119 TRP HB3 1 119 TRP HE3 . . 3.950 2.840 2.611 3.094 . 0 0 "[ . 1 . 2]" 1
1829 1 119 TRP HB3 1 120 TYR QE . . 5.090 3.485 2.928 3.849 . 0 0 "[ . 1 . 2]" 1
1830 1 119 TRP HB3 1 132 THR MG . . 4.610 3.235 2.751 3.504 . 0 0 "[ . 1 . 2]" 1
1831 1 119 TRP HD1 1 120 TYR H . . 5.500 5.447 4.926 5.594 0.094 20 0 "[ . 1 . 2]" 1
1832 1 119 TRP HD1 1 136 VAL QG . . 5.210 3.397 2.653 3.969 . 0 0 "[ . 1 . 2]" 1
1833 1 119 TRP HE1 1 136 VAL HA . . 5.370 4.226 3.336 4.778 . 0 0 "[ . 1 . 2]" 1
1834 1 119 TRP HE1 1 136 VAL QG . . 4.990 3.126 2.541 4.006 . 0 0 "[ . 1 . 2]" 1
1835 1 119 TRP HE1 1 139 GLU QB . . 5.500 4.754 4.066 5.593 0.093 12 0 "[ . 1 . 2]" 1
1836 1 119 TRP HE3 1 132 THR MG . . 2.890 2.219 1.966 2.471 . 0 0 "[ . 1 . 2]" 1
1837 1 119 TRP HE3 1 136 VAL QG . . 4.520 3.435 2.386 4.234 . 0 0 "[ . 1 . 2]" 1
1838 1 119 TRP HH2 1 135 ALA MB . . 2.980 2.577 2.284 2.942 . 0 0 "[ . 1 . 2]" 1
1839 1 119 TRP HH2 1 136 VAL HA . . 4.990 3.575 3.025 4.286 . 0 0 "[ . 1 . 2]" 1
1840 1 119 TRP HH2 1 139 GLU QG . . 4.650 3.287 2.441 3.762 . 0 0 "[ . 1 . 2]" 1
1841 1 119 TRP HZ2 1 135 ALA MB . . 4.830 4.490 3.987 4.897 0.067 8 0 "[ . 1 . 2]" 1
1842 1 119 TRP HZ2 1 136 VAL HA . . 4.590 3.089 2.613 3.858 . 0 0 "[ . 1 . 2]" 1
1843 1 119 TRP HZ2 1 139 GLU QB . . 4.230 3.579 2.683 4.327 0.097 14 0 "[ . 1 . 2]" 1
1844 1 119 TRP HZ2 1 139 GLU QG . . 3.110 2.697 2.195 2.921 . 0 0 "[ . 1 . 2]" 1
1845 1 119 TRP HZ3 1 132 THR MG . . 3.640 2.931 2.169 3.685 0.045 11 0 "[ . 1 . 2]" 1
1846 1 119 TRP HZ3 1 135 ALA MB . . 3.310 2.362 2.006 2.929 . 0 0 "[ . 1 . 2]" 1
1847 1 119 TRP HZ3 1 136 VAL QG . . 5.230 3.935 3.027 4.698 . 0 0 "[ . 1 . 2]" 1
1848 1 120 TYR H 1 120 TYR HB2 . . 3.610 2.949 2.635 3.208 . 0 0 "[ . 1 . 2]" 1
1849 1 120 TYR H 1 120 TYR QD . . 3.440 3.211 2.506 3.545 0.105 9 0 "[ . 1 . 2]" 1
1850 1 120 TYR H 1 121 ASN H . . 3.900 3.052 2.518 3.593 . 0 0 "[ . 1 . 2]" 1
1851 1 120 TYR H 1 121 ASN QD . . 4.280 4.000 3.320 4.251 . 0 0 "[ . 1 . 2]" 1
1852 1 120 TYR HA 1 120 TYR QD . . 3.270 2.830 2.346 3.304 0.034 20 0 "[ . 1 . 2]" 1
1853 1 120 TYR HA 1 121 ASN H . . 3.410 2.504 2.229 2.826 . 0 0 "[ . 1 . 2]" 1
1854 1 120 TYR HA 1 124 LEU HG . . 3.370 3.010 2.366 3.465 0.095 7 0 "[ . 1 . 2]" 1
1855 1 120 TYR HB3 1 124 LEU HG . . 4.540 4.301 3.233 4.612 0.072 11 0 "[ . 1 . 2]" 1
1856 1 120 TYR QD 1 124 LEU HG . . 3.580 3.437 2.271 3.693 0.113 3 0 "[ . 1 . 2]" 1
1857 1 120 TYR QD 1 129 LEU QD . . 3.550 2.863 2.148 3.498 . 0 0 "[ . 1 . 2]" 1
1858 1 120 TYR QD 1 132 THR MG . . 3.270 3.234 2.835 3.413 0.143 9 0 "[ . 1 . 2]" 1
1859 1 120 TYR QE 1 129 LEU QD . . 3.720 3.121 2.543 3.717 . 0 0 "[ . 1 . 2]" 1
1860 1 120 TYR QE 1 132 THR HB . . 5.180 3.709 2.572 4.943 . 0 0 "[ . 1 . 2]" 1
1861 1 120 TYR QE 1 132 THR MG . . 2.990 2.932 2.345 3.075 0.085 16 0 "[ . 1 . 2]" 1
1862 1 120 TYR QE 1 133 ILE H . . 5.500 3.834 3.196 4.666 . 0 0 "[ . 1 . 2]" 1
1863 1 120 TYR QE 1 133 ILE HA . . 3.890 2.956 2.421 3.265 . 0 0 "[ . 1 . 2]" 1
1864 1 120 TYR QE 1 133 ILE MD . . 4.490 3.624 3.275 4.011 . 0 0 "[ . 1 . 2]" 1
1865 1 120 TYR QE 1 133 ILE HG12 . . 3.290 2.275 2.075 2.662 . 0 0 "[ . 1 . 2]" 1
1866 1 120 TYR QE 1 133 ILE HG13 . . 3.110 2.740 2.319 3.138 0.028 8 0 "[ . 1 . 2]" 1
1867 1 120 TYR QE 1 133 ILE MG . . 3.740 3.797 3.758 3.838 0.098 8 0 "[ . 1 . 2]" 1
1868 1 120 TYR QE 1 136 VAL QG . . 3.640 3.026 2.625 3.335 . 0 0 "[ . 1 . 2]" 1
1869 1 121 ASN H 1 121 ASN HB2 . . 3.520 3.465 2.185 3.864 0.344 14 0 "[ . 1 . 2]" 1
1870 1 121 ASN H 1 121 ASN HB3 . . 3.820 2.899 2.438 3.701 . 0 0 "[ . 1 . 2]" 1
1871 1 121 ASN H 1 121 ASN QD . . 3.970 2.395 1.919 3.228 . 0 0 "[ . 1 . 2]" 1
1872 1 121 ASN H 1 122 PHE H . . 5.390 4.515 4.316 4.661 . 0 0 "[ . 1 . 2]" 1
1873 1 121 ASN H 1 124 LEU QB . . 4.980 3.070 2.422 3.852 . 0 0 "[ . 1 . 2]" 1
1874 1 121 ASN HA 1 122 PHE H . . 2.880 2.614 2.390 2.960 0.080 18 0 "[ . 1 . 2]" 1
1875 1 121 ASN HA 1 122 PHE QB . . 4.680 4.355 4.070 4.555 . 0 0 "[ . 1 . 2]" 1
1876 1 121 ASN HB2 1 122 PHE H . . 3.830 2.489 2.122 3.726 . 0 0 "[ . 1 . 2]" 1
1877 1 121 ASN HB3 1 122 PHE H . . 3.550 3.442 2.190 3.867 0.317 2 0 "[ . 1 . 2]" 1
1878 1 121 ASN QD 1 124 LEU QB . . 5.500 3.627 3.017 5.042 . 0 0 "[ . 1 . 2]" 1
1879 1 122 PHE H 1 122 PHE QB . . 3.020 2.051 1.874 2.878 . 0 0 "[ . 1 . 2]" 1
1880 1 122 PHE H 1 122 PHE QD . . 3.420 3.137 1.849 3.521 0.101 19 0 "[ . 1 . 2]" 1
1881 1 122 PHE HA 1 122 PHE QD . . 2.720 2.629 2.196 2.886 0.166 18 0 "[ . 1 . 2]" 1
1882 1 122 PHE HA 1 124 LEU H . . 3.540 3.557 3.268 3.630 0.090 8 0 "[ . 1 . 2]" 1
1883 1 122 PHE QB 1 123 ASP H . . 4.350 3.030 2.675 3.591 . 0 0 "[ . 1 . 2]" 1
1884 1 122 PHE QD 1 123 ASP H . . 5.500 4.716 3.204 4.995 . 0 0 "[ . 1 . 2]" 1
1885 1 123 ASP H 1 123 ASP HB2 . . 3.350 2.453 2.081 3.496 0.146 4 0 "[ . 1 . 2]" 1
1886 1 123 ASP H 1 123 ASP HB3 . . 3.410 2.651 2.326 2.894 . 0 0 "[ . 1 . 2]" 1
1887 1 123 ASP H 1 124 LEU H . . 3.130 3.014 2.606 3.211 0.081 20 0 "[ . 1 . 2]" 1
1888 1 123 ASP H 1 124 LEU QB . . 4.800 3.971 3.670 4.200 . 0 0 "[ . 1 . 2]" 1
1889 1 123 ASP HB2 1 124 LEU H . . 4.530 4.501 4.079 4.719 0.189 15 0 "[ . 1 . 2]" 1
1890 1 124 LEU H 1 124 LEU QB . . 3.320 2.462 2.231 2.789 . 0 0 "[ . 1 . 2]" 1
1891 1 124 LEU H 1 124 LEU QD . . 4.230 3.781 3.619 3.940 . 0 0 "[ . 1 . 2]" 1
1892 1 124 LEU HA 1 124 LEU QD . . 2.930 2.053 1.906 2.246 . 0 0 "[ . 1 . 2]" 1
1893 1 124 LEU HA 1 125 PRO HD2 . . 3.390 2.168 2.015 2.472 . 0 0 "[ . 1 . 2]" 1
1894 1 124 LEU QD 1 125 PRO HD2 . . 3.210 2.512 1.876 2.859 . 0 0 "[ . 1 . 2]" 1
1895 1 124 LEU QD 1 125 PRO HD3 . . 4.160 3.701 2.970 3.940 . 0 0 "[ . 1 . 2]" 1
1896 1 124 LEU QD 1 125 PRO HG2 . . 4.660 3.578 2.964 4.082 . 0 0 "[ . 1 . 2]" 1
1897 1 124 LEU QD 1 128 GLU H . . 4.020 3.629 3.321 4.009 . 0 0 "[ . 1 . 2]" 1
1898 1 124 LEU QD 1 128 GLU HA . . 5.010 4.592 4.127 4.929 . 0 0 "[ . 1 . 2]" 1
1899 1 124 LEU QD 1 128 GLU HB2 . . 3.840 2.915 2.314 3.965 0.125 1 0 "[ . 1 . 2]" 1
1900 1 124 LEU QD 1 128 GLU HB3 . . 3.940 3.494 2.844 3.908 . 0 0 "[ . 1 . 2]" 1
1901 1 124 LEU QD 1 129 LEU H . . 5.090 3.333 2.799 3.744 . 0 0 "[ . 1 . 2]" 1
1902 1 124 LEU QD 1 129 LEU HA . . 4.300 2.109 1.973 2.491 . 0 0 "[ . 1 . 2]" 1
1903 1 124 LEU QD 1 129 LEU QD . . 4.330 2.694 1.920 3.314 . 0 0 "[ . 1 . 2]" 1
1904 1 124 LEU HG 1 129 LEU QD . . 4.860 3.439 2.436 4.644 . 0 0 "[ . 1 . 2]" 1
1905 1 125 PRO HA 1 126 ILE H . . 2.990 2.256 2.147 2.345 . 0 0 "[ . 1 . 2]" 1
1906 1 125 PRO HA 1 126 ILE HA . . 4.680 4.322 4.189 4.464 . 0 0 "[ . 1 . 2]" 1
1907 1 125 PRO HA 1 126 ILE HG13 . . 4.370 3.988 3.521 4.381 0.011 20 0 "[ . 1 . 2]" 1
1908 1 125 PRO HA 1 127 ASN H . . 4.220 4.131 3.893 4.277 0.057 5 0 "[ . 1 . 2]" 1
1909 1 125 PRO HB2 1 126 ILE H . . 3.870 3.112 2.652 3.818 . 0 0 "[ . 1 . 2]" 1
1910 1 125 PRO HB2 1 127 ASN H . . 4.220 2.743 2.386 3.149 . 0 0 "[ . 1 . 2]" 1
1911 1 125 PRO HB2 1 128 GLU H . . 4.300 3.729 3.122 4.249 . 0 0 "[ . 1 . 2]" 1
1912 1 125 PRO HB3 1 127 ASN H . . 4.410 4.405 4.134 4.487 0.077 15 0 "[ . 1 . 2]" 1
1913 1 125 PRO HD2 1 128 GLU H . . 5.140 4.467 3.604 4.997 . 0 0 "[ . 1 . 2]" 1
1914 1 125 PRO HD2 1 128 GLU HB2 . . 4.200 3.224 2.421 4.714 0.514 1 1 "[+ . 1 . 2]" 1
1915 1 125 PRO HD2 1 128 GLU HB3 . . 4.630 4.450 3.777 4.704 0.074 8 0 "[ . 1 . 2]" 1
1916 1 125 PRO HD2 1 128 GLU QG . . 4.610 3.811 2.309 4.679 0.069 15 0 "[ . 1 . 2]" 1
1917 1 125 PRO HD3 1 126 ILE H . . 5.500 5.539 5.458 5.576 0.076 20 0 "[ . 1 . 2]" 1
1918 1 125 PRO HG3 1 126 ILE H . . 5.250 5.439 5.111 5.808 0.558 8 1 "[ . + 1 . 2]" 1
1919 1 125 PRO HG3 1 128 GLU H . . 4.980 4.696 4.269 4.996 0.016 8 0 "[ . 1 . 2]" 1
1920 1 126 ILE H 1 126 ILE HB . . 2.940 2.553 2.366 2.818 . 0 0 "[ . 1 . 2]" 1
1921 1 126 ILE H 1 126 ILE MD . . 3.670 2.352 1.653 3.286 . 0 0 "[ . 1 . 2]" 1
1922 1 126 ILE H 1 126 ILE HG12 . . 3.840 3.747 3.531 3.912 0.072 20 0 "[ . 1 . 2]" 1
1923 1 126 ILE H 1 126 ILE HG13 . . 3.260 2.453 2.083 2.726 . 0 0 "[ . 1 . 2]" 1
1924 1 126 ILE H 1 127 ASN H . . 3.430 2.795 2.589 2.993 . 0 0 "[ . 1 . 2]" 1
1925 1 126 ILE H 1 128 GLU H . . 4.820 4.451 4.322 4.616 . 0 0 "[ . 1 . 2]" 1
1926 1 126 ILE HA 1 126 ILE MD . . 3.840 3.716 3.545 3.929 0.089 14 0 "[ . 1 . 2]" 1
1927 1 126 ILE HA 1 126 ILE HG12 . . 3.680 3.194 2.662 3.651 . 0 0 "[ . 1 . 2]" 1
1928 1 126 ILE HA 1 126 ILE MG . . 3.570 2.468 2.316 2.575 . 0 0 "[ . 1 . 2]" 1
1929 1 126 ILE HA 1 127 ASN HA . . 4.920 4.819 4.697 4.931 0.011 9 0 "[ . 1 . 2]" 1
1930 1 126 ILE HA 1 128 GLU H . . 3.980 3.929 3.673 4.055 0.075 5 0 "[ . 1 . 2]" 1
1931 1 126 ILE HA 1 129 LEU H . . 4.210 3.328 2.805 3.583 . 0 0 "[ . 1 . 2]" 1
1932 1 126 ILE HA 1 129 LEU QD . . 4.640 2.707 2.441 2.979 . 0 0 "[ . 1 . 2]" 1
1933 1 126 ILE HB 1 127 ASN H . . 3.500 2.950 2.693 3.128 . 0 0 "[ . 1 . 2]" 1
1934 1 126 ILE HB 1 127 ASN HA . . 4.300 4.323 4.137 4.381 0.081 2 0 "[ . 1 . 2]" 1
1935 1 126 ILE HB 1 127 ASN HB3 . . 4.630 4.471 4.179 4.706 0.076 15 0 "[ . 1 . 2]" 1
1936 1 126 ILE MD 1 127 ASN H . . 4.930 4.151 3.724 4.793 . 0 0 "[ . 1 . 2]" 1
1937 1 126 ILE MD 1 129 LEU QD . . 5.500 4.455 4.101 4.709 . 0 0 "[ . 1 . 2]" 1
1938 1 126 ILE HG12 1 129 LEU QD . . 5.500 3.677 3.069 4.241 . 0 0 "[ . 1 . 2]" 1
1939 1 126 ILE MG 1 127 ASN HA . . 4.440 3.624 3.251 3.907 . 0 0 "[ . 1 . 2]" 1
1940 1 127 ASN H 1 127 ASN HB3 . . 3.320 2.362 2.016 2.692 . 0 0 "[ . 1 . 2]" 1
1941 1 127 ASN H 1 127 ASN HD21 . . 4.790 3.973 2.149 4.853 0.063 12 0 "[ . 1 . 2]" 1
1942 1 127 ASN H 1 127 ASN HD22 . . 5.260 4.603 3.610 5.344 0.084 17 0 "[ . 1 . 2]" 1
1943 1 127 ASN H 1 128 GLU H . . 3.360 2.756 2.535 2.995 . 0 0 "[ . 1 . 2]" 1
1944 1 127 ASN H 1 129 LEU H . . 5.500 4.093 3.895 4.310 . 0 0 "[ . 1 . 2]" 1
1945 1 127 ASN HA 1 127 ASN HB2 . . 2.850 2.328 2.189 2.557 . 0 0 "[ . 1 . 2]" 1
1946 1 127 ASN HA 1 127 ASN HB3 . . 2.880 2.597 2.264 2.966 0.086 17 0 "[ . 1 . 2]" 1
1947 1 127 ASN HA 1 127 ASN HD22 . . 5.390 5.145 4.542 5.379 . 0 0 "[ . 1 . 2]" 1
1948 1 127 ASN HA 1 129 LEU H . . 4.210 4.051 3.679 4.267 0.057 2 0 "[ . 1 . 2]" 1
1949 1 127 ASN HB3 1 128 GLU H . . 4.110 4.002 3.095 4.205 0.095 18 0 "[ . 1 . 2]" 1
1950 1 127 ASN HD21 1 128 GLU H . . 5.180 3.916 3.198 4.990 . 0 0 "[ . 1 . 2]" 1
1951 1 127 ASN HD21 1 128 GLU QG . . 5.240 2.999 1.774 4.272 . 0 0 "[ . 1 . 2]" 1
1952 1 127 ASN HD22 1 128 GLU QG . . 5.180 2.668 2.180 4.395 . 0 0 "[ . 1 . 2]" 1
1953 1 128 GLU H 1 128 GLU HB2 . . 3.520 2.514 2.316 3.665 0.145 1 0 "[ . 1 . 2]" 1
1954 1 128 GLU H 1 128 GLU HB3 . . 3.740 3.607 2.516 3.794 0.054 18 0 "[ . 1 . 2]" 1
1955 1 128 GLU H 1 128 GLU QG . . 3.500 2.885 2.402 3.329 . 0 0 "[ . 1 . 2]" 1
1956 1 128 GLU H 1 129 LEU H . . 3.140 2.224 2.038 2.522 . 0 0 "[ . 1 . 2]" 1
1957 1 128 GLU HA 1 128 GLU HB3 . . 3.020 2.544 2.436 2.665 . 0 0 "[ . 1 . 2]" 1
1958 1 128 GLU HA 1 128 GLU QG . . 3.070 2.787 2.262 3.184 0.114 1 0 "[ . 1 . 2]" 1
1959 1 128 GLU HA 1 131 GLU H . . 3.870 3.700 3.369 3.950 0.080 4 0 "[ . 1 . 2]" 1
1960 1 128 GLU HA 1 131 GLU HB2 . . 4.360 3.939 3.346 4.432 0.072 2 0 "[ . 1 . 2]" 1
1961 1 128 GLU HB2 1 129 LEU H . . 4.700 3.623 3.166 4.501 . 0 0 "[ . 1 . 2]" 1
1962 1 129 LEU H 1 129 LEU HB2 . . 3.350 2.327 2.173 2.553 . 0 0 "[ . 1 . 2]" 1
1963 1 129 LEU H 1 129 LEU HB3 . . 3.330 2.585 2.376 2.909 . 0 0 "[ . 1 . 2]" 1
1964 1 129 LEU H 1 129 LEU QD . . 4.920 3.710 3.644 3.794 . 0 0 "[ . 1 . 2]" 1
1965 1 129 LEU H 1 129 LEU HG . . 4.460 4.346 4.127 4.501 0.041 2 0 "[ . 1 . 2]" 1
1966 1 129 LEU H 1 130 GLU H . . 3.670 2.794 2.615 2.951 . 0 0 "[ . 1 . 2]" 1
1967 1 129 LEU H 1 130 GLU QB . . 4.700 4.744 4.575 4.783 0.083 1 0 "[ . 1 . 2]" 1
1968 1 129 LEU H 1 131 GLU H . . 5.060 4.280 4.154 4.457 . 0 0 "[ . 1 . 2]" 1
1969 1 129 LEU HA 1 129 LEU QD . . 3.000 2.659 2.110 2.941 . 0 0 "[ . 1 . 2]" 1
1970 1 129 LEU HA 1 129 LEU HG . . 4.130 2.616 2.069 3.368 . 0 0 "[ . 1 . 2]" 1
1971 1 129 LEU HA 1 131 GLU H . . 4.820 4.083 3.753 4.413 . 0 0 "[ . 1 . 2]" 1
1972 1 129 LEU HA 1 132 THR H . . 4.130 3.166 2.943 3.474 . 0 0 "[ . 1 . 2]" 1
1973 1 129 LEU HA 1 133 ILE H . . 4.960 4.067 3.835 4.248 . 0 0 "[ . 1 . 2]" 1
1974 1 129 LEU HB2 1 129 LEU QD . . 3.190 2.133 2.079 2.176 . 0 0 "[ . 1 . 2]" 1
1975 1 129 LEU HB2 1 130 GLU H . . 3.850 3.782 3.572 3.930 0.080 4 0 "[ . 1 . 2]" 1
1976 1 129 LEU HB3 1 130 GLU H . . 3.700 2.572 2.412 2.767 . 0 0 "[ . 1 . 2]" 1
1977 1 129 LEU HB3 1 130 GLU HG2 . . 4.400 4.322 3.157 4.856 0.456 13 0 "[ . 1 . 2]" 1
1978 1 129 LEU QD 1 130 GLU H . . 4.500 3.536 3.130 4.030 . 0 0 "[ . 1 . 2]" 1
1979 1 129 LEU QD 1 131 GLU H . . 5.500 4.723 4.514 4.960 . 0 0 "[ . 1 . 2]" 1
1980 1 129 LEU QD 1 132 THR H . . 5.500 4.114 3.785 4.389 . 0 0 "[ . 1 . 2]" 1
1981 1 129 LEU QD 1 132 THR HB . . 5.450 3.185 2.088 4.102 . 0 0 "[ . 1 . 2]" 1
1982 1 129 LEU QD 1 132 THR MG . . 4.430 3.734 2.623 4.321 . 0 0 "[ . 1 . 2]" 1
1983 1 129 LEU QD 1 133 ILE H . . 4.130 3.269 3.122 3.398 . 0 0 "[ . 1 . 2]" 1
1984 1 129 LEU QD 1 133 ILE HA . . 4.650 4.445 4.099 4.653 0.003 20 0 "[ . 1 . 2]" 1
1985 1 129 LEU QD 1 133 ILE MD . . 3.980 2.090 1.841 2.920 . 0 0 "[ . 1 . 2]" 1
1986 1 129 LEU QD 1 134 GLN H . . 5.500 5.448 5.334 5.490 . 0 0 "[ . 1 . 2]" 1
1987 1 129 LEU HG 1 133 ILE H . . 4.470 4.449 4.094 4.566 0.096 19 0 "[ . 1 . 2]" 1
1988 1 129 LEU HG 1 133 ILE MD . . 4.630 3.420 2.102 4.393 . 0 0 "[ . 1 . 2]" 1
1989 1 130 GLU H 1 130 GLU QB . . 2.880 2.415 2.235 2.622 . 0 0 "[ . 1 . 2]" 1
1990 1 130 GLU H 1 130 GLU HG2 . . 3.380 3.284 2.379 3.474 0.094 9 0 "[ . 1 . 2]" 1
1991 1 130 GLU H 1 130 GLU HG3 . . 3.400 2.230 2.019 3.219 . 0 0 "[ . 1 . 2]" 1
1992 1 130 GLU H 1 131 GLU H . . 3.400 2.811 2.635 2.926 . 0 0 "[ . 1 . 2]" 1
1993 1 130 GLU H 1 132 THR H . . 4.970 4.158 3.949 4.372 . 0 0 "[ . 1 . 2]" 1
1994 1 130 GLU H 1 133 ILE MD . . 4.620 4.575 4.244 4.715 0.095 11 0 "[ . 1 . 2]" 1
1995 1 130 GLU HA 1 130 GLU HG3 . . 3.460 3.066 2.780 3.680 0.220 5 0 "[ . 1 . 2]" 1
1996 1 130 GLU HA 1 132 THR H . . 4.650 4.357 4.032 4.587 . 0 0 "[ . 1 . 2]" 1
1997 1 130 GLU HA 1 133 ILE H . . 3.850 3.607 3.247 3.894 0.044 2 0 "[ . 1 . 2]" 1
1998 1 130 GLU HA 1 133 ILE HB . . 3.270 3.119 2.687 3.332 0.062 13 0 "[ . 1 . 2]" 1
1999 1 130 GLU HA 1 133 ILE MD . . 3.380 2.776 2.230 3.354 . 0 0 "[ . 1 . 2]" 1
2000 1 130 GLU HA 1 133 ILE MG . . 4.550 4.471 4.089 4.642 0.092 17 0 "[ . 1 . 2]" 1
2001 1 130 GLU HA 1 134 GLN H . . 4.790 4.609 4.203 4.868 0.078 11 0 "[ . 1 . 2]" 1
2002 1 130 GLU QB 1 131 GLU H . . 2.970 2.902 2.614 3.060 0.090 11 0 "[ . 1 . 2]" 1
2003 1 130 GLU HG2 1 133 ILE MD . . 5.090 3.722 2.910 4.424 . 0 0 "[ . 1 . 2]" 1
2004 1 130 GLU HG3 1 133 ILE MD . . 4.840 4.552 3.671 5.194 0.354 15 0 "[ . 1 . 2]" 1
2005 1 131 GLU H 1 131 GLU HB3 . . 3.070 2.627 2.273 3.027 . 0 0 "[ . 1 . 2]" 1
2006 1 131 GLU H 1 132 THR H . . 3.170 2.442 2.196 2.737 . 0 0 "[ . 1 . 2]" 1
2007 1 131 GLU HA 1 131 GLU HB2 . . 2.770 2.598 2.386 2.801 0.031 6 0 "[ . 1 . 2]" 1
2008 1 131 GLU HA 1 131 GLU HG2 . . 3.160 3.142 2.328 3.777 0.617 7 4 "[ - . + 1 *. * 2]" 1
2009 1 131 GLU HA 1 134 GLN H . . 3.440 3.342 2.731 3.525 0.085 16 0 "[ . 1 . 2]" 1
2010 1 131 GLU HA 1 134 GLN QB . . 3.040 2.957 2.587 3.141 0.101 2 0 "[ . 1 . 2]" 1
2011 1 131 GLU HA 1 134 GLN HG2 . . 3.900 3.440 2.260 3.970 0.070 3 0 "[ . 1 . 2]" 1
2012 1 131 GLU HA 1 134 GLN HG3 . . 3.780 2.924 2.171 3.710 . 0 0 "[ . 1 . 2]" 1
2013 1 131 GLU HA 1 135 ALA MB . . 5.500 4.976 4.475 5.422 . 0 0 "[ . 1 . 2]" 1
2014 1 131 GLU HB3 1 132 THR H . . 3.660 2.859 2.561 3.115 . 0 0 "[ . 1 . 2]" 1
2015 1 131 GLU HG2 1 132 THR H . . 4.630 4.610 4.020 5.380 0.750 15 1 "[ . 1 + 2]" 1
2016 1 132 THR H 1 132 THR HB . . 3.380 2.434 2.167 2.628 . 0 0 "[ . 1 . 2]" 1
2017 1 132 THR H 1 132 THR MG . . 3.750 3.735 3.665 3.788 0.038 8 0 "[ . 1 . 2]" 1
2018 1 132 THR H 1 133 ILE H . . 3.640 2.661 2.518 2.771 . 0 0 "[ . 1 . 2]" 1
2019 1 132 THR H 1 133 ILE HB . . 4.910 4.858 4.646 4.980 0.070 5 0 "[ . 1 . 2]" 1
2020 1 132 THR H 1 133 ILE MD . . 5.280 5.273 5.126 5.379 0.099 6 0 "[ . 1 . 2]" 1
2021 1 132 THR H 1 133 ILE HG13 . . 4.340 4.402 4.300 4.420 0.080 2 0 "[ . 1 . 2]" 1
2022 1 132 THR H 1 134 GLN H . . 4.140 4.046 3.914 4.197 0.057 9 0 "[ . 1 . 2]" 1
2023 1 132 THR HA 1 132 THR MG . . 3.100 2.450 2.188 2.722 . 0 0 "[ . 1 . 2]" 1
2024 1 132 THR HB 1 133 ILE H . . 4.130 2.660 2.350 2.987 . 0 0 "[ . 1 . 2]" 1
2025 1 132 THR MG 1 133 ILE H . . 4.080 3.495 3.222 3.697 . 0 0 "[ . 1 . 2]" 1
2026 1 132 THR MG 1 133 ILE HA . . 4.410 3.679 3.351 3.927 . 0 0 "[ . 1 . 2]" 1
2027 1 132 THR MG 1 135 ALA H . . 5.310 4.587 4.205 5.009 . 0 0 "[ . 1 . 2]" 1
2028 1 132 THR MG 1 135 ALA MB . . 4.170 3.331 2.936 3.795 . 0 0 "[ . 1 . 2]" 1
2029 1 132 THR MG 1 136 VAL QG . . 3.650 3.145 2.383 3.685 0.035 2 0 "[ . 1 . 2]" 1
2030 1 133 ILE H 1 133 ILE HB . . 3.060 2.544 2.337 2.706 . 0 0 "[ . 1 . 2]" 1
2031 1 133 ILE H 1 133 ILE MD . . 3.750 3.561 3.431 3.663 . 0 0 "[ . 1 . 2]" 1
2032 1 133 ILE H 1 133 ILE HG12 . . 4.020 3.484 3.346 3.641 . 0 0 "[ . 1 . 2]" 1
2033 1 133 ILE H 1 133 ILE HG13 . . 4.110 2.174 2.027 2.320 . 0 0 "[ . 1 . 2]" 1
2034 1 133 ILE H 1 133 ILE MG . . 3.720 3.792 3.682 3.824 0.104 19 0 "[ . 1 . 2]" 1
2035 1 133 ILE H 1 134 GLN H . . 3.560 2.808 2.599 3.089 . 0 0 "[ . 1 . 2]" 1
2036 1 133 ILE H 1 134 GLN HG2 . . 5.070 4.783 4.307 5.820 0.750 1 3 "[+* . - 1 . 2]" 1
2037 1 133 ILE H 1 135 ALA H . . 4.210 4.258 4.126 4.291 0.081 7 0 "[ . 1 . 2]" 1
2038 1 133 ILE HA 1 133 ILE MD . . 4.260 3.866 3.746 3.957 . 0 0 "[ . 1 . 2]" 1
2039 1 133 ILE HA 1 133 ILE HG12 . . 4.240 2.537 2.318 2.709 . 0 0 "[ . 1 . 2]" 1
2040 1 133 ILE HA 1 133 ILE HG13 . . 3.170 2.933 2.838 3.094 . 0 0 "[ . 1 . 2]" 1
2041 1 133 ILE HA 1 133 ILE MG . . 3.250 2.400 2.296 2.541 . 0 0 "[ . 1 . 2]" 1
2042 1 133 ILE HA 1 135 ALA H . . 5.500 4.445 4.241 4.606 . 0 0 "[ . 1 . 2]" 1
2043 1 133 ILE HA 1 136 VAL H . . 4.120 3.547 3.133 3.888 . 0 0 "[ . 1 . 2]" 1
2044 1 133 ILE HA 1 136 VAL QG . . 4.000 2.379 2.052 2.968 . 0 0 "[ . 1 . 2]" 1
2045 1 133 ILE HA 1 137 GLN HE21 . . 5.500 5.018 4.184 5.578 0.078 9 0 "[ . 1 . 2]" 1
2046 1 133 ILE HB 1 133 ILE MD . . 2.890 2.426 2.257 2.518 . 0 0 "[ . 1 . 2]" 1
2047 1 133 ILE HB 1 134 GLN H . . 3.430 2.960 2.673 3.234 . 0 0 "[ . 1 . 2]" 1
2048 1 133 ILE MD 1 133 ILE MG . . 3.080 2.032 1.972 2.104 . 0 0 "[ . 1 . 2]" 1
2049 1 133 ILE HG12 1 133 ILE MG . . 3.600 2.252 2.170 2.336 . 0 0 "[ . 1 . 2]" 1
2050 1 133 ILE HG12 1 134 GLN H . . 5.250 5.215 5.107 5.312 0.062 4 0 "[ . 1 . 2]" 1
2051 1 133 ILE MG 1 134 GLN H . . 3.860 3.660 3.274 3.931 0.071 10 0 "[ . 1 . 2]" 1
2052 1 133 ILE MG 1 134 GLN HA . . 3.760 3.619 3.021 3.852 0.092 10 0 "[ . 1 . 2]" 1
2053 1 133 ILE MG 1 134 GLN HG2 . . 5.500 4.266 3.733 5.627 0.127 2 0 "[ . 1 . 2]" 1
2054 1 133 ILE MG 1 134 GLN HG3 . . 5.500 5.456 5.182 5.600 0.100 12 0 "[ . 1 . 2]" 1
2055 1 133 ILE MG 1 136 VAL QG . . 5.130 3.336 2.806 3.816 . 0 0 "[ . 1 . 2]" 1
2056 1 133 ILE MG 1 137 GLN QB . . 5.410 4.601 3.795 5.373 . 0 0 "[ . 1 . 2]" 1
2057 1 133 ILE MG 1 137 GLN HE21 . . 3.940 3.060 2.323 4.015 0.075 1 0 "[ . 1 . 2]" 1
2058 1 133 ILE MG 1 137 GLN HE22 . . 4.510 3.921 2.082 4.633 0.123 5 0 "[ . 1 . 2]" 1
2059 1 133 ILE MG 1 137 GLN QG . . 4.090 3.173 2.473 4.169 0.079 16 0 "[ . 1 . 2]" 1
2060 1 134 GLN H 1 134 GLN QB . . 2.840 2.429 2.139 2.613 . 0 0 "[ . 1 . 2]" 1
2061 1 134 GLN H 1 134 GLN HG2 . . 3.400 2.518 2.099 3.491 0.091 2 0 "[ . 1 . 2]" 1
2062 1 134 GLN H 1 134 GLN HG3 . . 3.420 3.241 2.554 3.510 0.090 14 0 "[ . 1 . 2]" 1
2063 1 134 GLN H 1 135 ALA MB . . 4.940 4.229 3.959 4.386 . 0 0 "[ . 1 . 2]" 1
2064 1 134 GLN HA 1 134 GLN QB . . 2.650 2.337 2.102 2.426 . 0 0 "[ . 1 . 2]" 1
2065 1 134 GLN HA 1 134 GLN HG2 . . 3.440 3.047 2.669 4.144 0.704 1 3 "[+- . * 1 . 2]" 1
2066 1 134 GLN HA 1 135 ALA H . . 3.510 3.544 3.377 3.576 0.066 3 0 "[ . 1 . 2]" 1
2067 1 134 GLN HA 1 136 VAL H . . 4.360 4.388 4.168 4.436 0.076 11 0 "[ . 1 . 2]" 1
2068 1 134 GLN HA 1 137 GLN H . . 3.750 3.428 3.223 3.669 . 0 0 "[ . 1 . 2]" 1
2069 1 134 GLN QB 1 135 ALA H . . 3.370 2.756 2.403 3.482 0.112 8 0 "[ . 1 . 2]" 1
2070 1 134 GLN QB 1 135 ALA MB . . 4.660 4.018 3.754 4.760 0.100 8 0 "[ . 1 . 2]" 1
2071 1 134 GLN HG2 1 135 ALA H . . 5.250 4.335 3.818 4.591 . 0 0 "[ . 1 . 2]" 1
2072 1 135 ALA H 1 135 ALA MB . . 2.780 2.246 2.190 2.296 . 0 0 "[ . 1 . 2]" 1
2073 1 135 ALA H 1 136 VAL H . . 3.240 2.790 2.607 2.958 . 0 0 "[ . 1 . 2]" 1
2074 1 135 ALA H 1 136 VAL HB . . 5.250 5.058 4.656 5.318 0.068 8 0 "[ . 1 . 2]" 1
2075 1 135 ALA H 1 136 VAL QG . . 5.080 4.075 3.708 4.414 . 0 0 "[ . 1 . 2]" 1
2076 1 135 ALA HA 1 138 GLU H . . 3.460 3.326 3.086 3.516 0.056 6 0 "[ . 1 . 2]" 1
2077 1 135 ALA HA 1 138 GLU HB2 . . 3.150 2.810 2.246 3.220 0.070 3 0 "[ . 1 . 2]" 1
2078 1 135 ALA HA 1 138 GLU QG . . 3.710 2.918 2.410 3.554 . 0 0 "[ . 1 . 2]" 1
2079 1 135 ALA MB 1 136 VAL H . . 3.110 2.620 2.463 2.846 . 0 0 "[ . 1 . 2]" 1
2080 1 135 ALA MB 1 136 VAL QG . . 4.270 3.529 3.022 3.928 . 0 0 "[ . 1 . 2]" 1
2081 1 135 ALA MB 1 139 GLU H . . 5.500 4.848 4.528 5.061 . 0 0 "[ . 1 . 2]" 1
2082 1 135 ALA MB 1 139 GLU QG . . 4.520 4.261 3.658 4.475 . 0 0 "[ . 1 . 2]" 1
2083 1 136 VAL H 1 136 VAL HB . . 3.080 2.506 2.268 2.751 . 0 0 "[ . 1 . 2]" 1
2084 1 136 VAL H 1 136 VAL QG . . 3.230 2.148 1.808 2.366 . 0 0 "[ . 1 . 2]" 1
2085 1 136 VAL H 1 137 GLN H . . 3.530 2.743 2.603 2.928 . 0 0 "[ . 1 . 2]" 1
2086 1 136 VAL HA 1 136 VAL QG . . 3.210 2.218 2.048 2.349 . 0 0 "[ . 1 . 2]" 1
2087 1 136 VAL HA 1 139 GLU H . . 3.950 3.799 3.396 4.030 0.080 16 0 "[ . 1 . 2]" 1
2088 1 136 VAL HB 1 137 GLN QG . . 4.710 4.012 2.832 4.821 0.111 3 0 "[ . 1 . 2]" 1
2089 1 136 VAL QG 1 137 GLN H . . 4.360 2.897 2.150 3.411 . 0 0 "[ . 1 . 2]" 1
2090 1 136 VAL QG 1 137 GLN HA . . 4.330 3.343 3.008 3.692 . 0 0 "[ . 1 . 2]" 1
2091 1 136 VAL QG 1 137 GLN QB . . 5.500 4.096 3.631 4.648 . 0 0 "[ . 1 . 2]" 1
2092 1 136 VAL QG 1 137 GLN HE21 . . 5.280 3.607 2.431 4.345 . 0 0 "[ . 1 . 2]" 1
2093 1 136 VAL QG 1 137 GLN HE22 . . 5.500 4.243 3.098 5.271 . 0 0 "[ . 1 . 2]" 1
2094 1 136 VAL QG 1 137 GLN QG . . 5.010 2.852 2.062 3.993 . 0 0 "[ . 1 . 2]" 1
2095 1 136 VAL QG 1 140 ASN H . . 4.600 4.094 3.764 4.529 . 0 0 "[ . 1 . 2]" 1
2096 1 136 VAL QG 1 140 ASN HD21 . . 4.140 3.241 2.410 4.021 . 0 0 "[ . 1 . 2]" 1
2097 1 136 VAL QG 1 140 ASN HD22 . . 3.940 2.421 1.994 3.016 . 0 0 "[ . 1 . 2]" 1
2098 1 137 GLN H 1 137 GLN QB . . 3.160 2.439 2.219 2.625 . 0 0 "[ . 1 . 2]" 1
2099 1 137 GLN H 1 137 GLN HE21 . . 5.500 4.524 3.724 5.221 . 0 0 "[ . 1 . 2]" 1
2100 1 137 GLN H 1 137 GLN QG . . 3.330 2.339 2.028 3.047 . 0 0 "[ . 1 . 2]" 1
2101 1 137 GLN H 1 138 GLU H . . 3.220 2.580 2.333 2.835 . 0 0 "[ . 1 . 2]" 1
2102 1 137 GLN HA 1 137 GLN HE21 . . 5.500 4.482 3.443 5.012 . 0 0 "[ . 1 . 2]" 1
2103 1 137 GLN HA 1 137 GLN QG . . 3.550 2.769 2.199 3.227 . 0 0 "[ . 1 . 2]" 1
2104 1 137 GLN HA 1 140 ASN H . . 3.690 3.190 2.880 3.646 . 0 0 "[ . 1 . 2]" 1
2105 1 137 GLN HA 1 140 ASN HB2 . . 3.320 2.153 2.026 2.292 . 0 0 "[ . 1 . 2]" 1
2106 1 137 GLN HA 1 140 ASN HB3 . . 3.620 3.676 3.615 3.703 0.083 15 0 "[ . 1 . 2]" 1
2107 1 137 GLN HA 1 140 ASN HD21 . . 4.270 3.181 2.260 4.021 . 0 0 "[ . 1 . 2]" 1
2108 1 137 GLN HA 1 140 ASN HD22 . . 3.690 3.868 3.476 4.357 0.667 19 4 "[ * . * 1 .- +2]" 1
2109 1 137 GLN QB 1 138 GLU H . . 3.730 3.010 2.699 3.320 . 0 0 "[ . 1 . 2]" 1
2110 1 137 GLN QG 1 138 GLU H . . 4.450 4.265 3.912 4.506 0.056 5 0 "[ . 1 . 2]" 1
2111 1 138 GLU H 1 138 GLU HB2 . . 2.870 2.296 2.012 2.504 . 0 0 "[ . 1 . 2]" 1
2112 1 138 GLU H 1 138 GLU HB3 . . 3.520 3.520 3.336 3.592 0.072 1 0 "[ . 1 . 2]" 1
2113 1 138 GLU H 1 138 GLU QG . . 2.890 2.666 2.313 2.983 0.093 15 0 "[ . 1 . 2]" 1
2114 1 138 GLU H 1 139 GLU H . . 3.270 2.810 2.540 2.999 . 0 0 "[ . 1 . 2]" 1
2115 1 138 GLU H 1 139 GLU QB . . 5.340 5.053 4.604 5.413 0.073 12 0 "[ . 1 . 2]" 1
2116 1 138 GLU H 1 139 GLU QG . . 5.100 4.214 3.712 4.838 . 0 0 "[ . 1 . 2]" 1
2117 1 138 GLU HA 1 138 GLU HB2 . . 3.000 3.027 2.972 3.056 0.056 4 0 "[ . 1 . 2]" 1
2118 1 138 GLU HA 1 138 GLU HB3 . . 2.930 2.625 2.481 2.831 . 0 0 "[ . 1 . 2]" 1
2119 1 138 GLU HA 1 138 GLU QG . . 2.780 2.529 2.173 2.861 0.081 4 0 "[ . 1 . 2]" 1
2120 1 138 GLU HA 1 140 ASN H . . 4.780 4.437 3.894 4.749 . 0 0 "[ . 1 . 2]" 1
2121 1 138 GLU HA 1 141 LYS QD . . 3.330 2.743 1.958 3.422 0.092 4 0 "[ . 1 . 2]" 1
2122 1 138 GLU HA 1 141 LYS QE . . 4.620 3.833 2.088 4.713 0.093 4 0 "[ . 1 . 2]" 1
2123 1 138 GLU HB2 1 138 GLU QG . . 2.720 2.249 2.139 2.394 . 0 0 "[ . 1 . 2]" 1
2124 1 138 GLU HB2 1 139 GLU H . . 3.510 2.411 2.069 2.928 . 0 0 "[ . 1 . 2]" 1
2125 1 138 GLU HB3 1 139 GLU H . . 2.900 2.979 2.944 2.987 0.087 10 0 "[ . 1 . 2]" 1
2126 1 139 GLU H 1 139 GLU QB . . 3.180 2.723 2.569 2.895 . 0 0 "[ . 1 . 2]" 1
2127 1 139 GLU H 1 139 GLU QG . . 3.400 2.133 1.946 2.508 . 0 0 "[ . 1 . 2]" 1
2128 1 139 GLU H 1 140 ASN H . . 3.280 2.789 2.611 2.928 . 0 0 "[ . 1 . 2]" 1
2129 1 139 GLU HA 1 139 GLU QG . . 3.390 2.713 2.335 3.131 . 0 0 "[ . 1 . 2]" 1
2130 1 139 GLU HA 1 141 LYS H . . 4.560 4.446 3.857 4.631 0.071 16 0 "[ . 1 . 2]" 1
2131 1 139 GLU HA 1 142 ALA H . . 3.860 3.713 3.394 3.937 0.077 4 0 "[ . 1 . 2]" 1
2132 1 139 GLU HA 1 142 ALA MB . . 3.740 2.985 2.347 3.477 . 0 0 "[ . 1 . 2]" 1
2133 1 139 GLU HA 1 143 PHE H . . 5.320 4.640 4.174 5.387 0.067 9 0 "[ . 1 . 2]" 1
2134 1 139 GLU QB 1 140 ASN H . . 3.590 2.972 2.418 3.680 0.090 14 0 "[ . 1 . 2]" 1
2135 1 139 GLU QG 1 140 ASN H . . 4.640 3.352 2.174 4.121 . 0 0 "[ . 1 . 2]" 1
2136 1 139 GLU QG 1 142 ALA MB . . 5.300 4.875 4.413 5.104 . 0 0 "[ . 1 . 2]" 1
2137 1 140 ASN H 1 140 ASN HB2 . . 3.430 2.528 2.184 2.793 . 0 0 "[ . 1 . 2]" 1
2138 1 140 ASN H 1 140 ASN HB3 . . 3.650 3.655 3.477 3.713 0.063 18 0 "[ . 1 . 2]" 1
2139 1 140 ASN H 1 140 ASN HD21 . . 4.980 3.510 2.084 4.848 . 0 0 "[ . 1 . 2]" 1
2140 1 140 ASN H 1 141 LYS H . . 3.490 2.931 2.429 3.106 . 0 0 "[ . 1 . 2]" 1
2141 1 140 ASN H 1 141 LYS QG . . 5.340 4.344 3.663 4.808 . 0 0 "[ . 1 . 2]" 1
2142 1 140 ASN H 1 142 ALA H . . 4.700 4.398 4.081 4.755 0.055 20 0 "[ . 1 . 2]" 1
2143 1 140 ASN H 1 142 ALA MB . . 5.380 4.977 4.615 5.279 . 0 0 "[ . 1 . 2]" 1
2144 1 140 ASN HA 1 140 ASN HD22 . . 5.270 4.247 3.654 4.724 . 0 0 "[ . 1 . 2]" 1
2145 1 140 ASN HA 1 142 ALA H . . 5.290 4.441 4.062 4.702 . 0 0 "[ . 1 . 2]" 1
2146 1 140 ASN HA 1 143 PHE H . . 4.140 3.445 3.205 3.730 . 0 0 "[ . 1 . 2]" 1
2147 1 140 ASN HA 1 143 PHE HB2 . . 4.120 3.576 3.022 4.041 . 0 0 "[ . 1 . 2]" 1
2148 1 140 ASN HA 1 143 PHE HB3 . . 3.880 2.765 2.438 3.271 . 0 0 "[ . 1 . 2]" 1
2149 1 140 ASN HA 1 143 PHE QD . . 4.840 4.491 4.184 4.902 0.062 9 0 "[ . 1 . 2]" 1
2150 1 140 ASN HA 1 144 GLU H . . 4.510 3.976 3.779 4.410 . 0 0 "[ . 1 . 2]" 1
2151 1 140 ASN HA 1 144 GLU HG2 . . 4.520 4.508 4.263 4.603 0.083 17 0 "[ . 1 . 2]" 1
2152 1 140 ASN HB2 1 141 LYS H . . 3.880 2.764 2.496 3.192 . 0 0 "[ . 1 . 2]" 1
2153 1 140 ASN HB3 1 141 LYS H . . 4.050 3.521 3.192 3.822 . 0 0 "[ . 1 . 2]" 1
2154 1 141 LYS H 1 141 LYS HA . . 2.940 2.863 2.811 2.912 . 0 0 "[ . 1 . 2]" 1
2155 1 141 LYS H 1 141 LYS QB . . 2.830 2.618 2.373 2.797 . 0 0 "[ . 1 . 2]" 1
2156 1 141 LYS H 1 141 LYS QD . . 3.940 3.628 2.575 4.043 0.103 14 0 "[ . 1 . 2]" 1
2157 1 141 LYS H 1 141 LYS QE . . 4.700 4.298 3.369 4.764 0.064 18 0 "[ . 1 . 2]" 1
2158 1 141 LYS H 1 141 LYS QG . . 3.580 2.158 1.878 2.537 . 0 0 "[ . 1 . 2]" 1
2159 1 141 LYS H 1 142 ALA H . . 3.360 2.678 2.374 2.870 . 0 0 "[ . 1 . 2]" 1
2160 1 141 LYS H 1 144 GLU H . . 5.280 4.865 4.780 5.068 . 0 0 "[ . 1 . 2]" 1
2161 1 141 LYS HA 1 141 LYS QB . . 2.740 2.243 2.108 2.428 . 0 0 "[ . 1 . 2]" 1
2162 1 141 LYS HA 1 141 LYS QG . . 3.650 3.018 2.375 3.383 . 0 0 "[ . 1 . 2]" 1
2163 1 141 LYS HA 1 144 GLU H . . 3.910 3.470 3.156 3.644 . 0 0 "[ . 1 . 2]" 1
2164 1 141 LYS HA 1 144 GLU HG2 . . 4.810 2.668 2.081 4.299 . 0 0 "[ . 1 . 2]" 1
2165 1 141 LYS HA 1 144 GLU HG3 . . 4.260 2.405 2.112 2.744 . 0 0 "[ . 1 . 2]" 1
2166 1 141 LYS QB 1 141 LYS QD . . 2.930 2.266 2.036 2.869 . 0 0 "[ . 1 . 2]" 1
2167 1 141 LYS QB 1 141 LYS QE . . 4.380 2.593 2.056 3.599 . 0 0 "[ . 1 . 2]" 1
2168 1 141 LYS QB 1 142 ALA H . . 3.320 2.990 2.259 3.418 0.098 14 0 "[ . 1 . 2]" 1
2169 1 141 LYS QB 1 142 ALA HA . . 4.260 4.071 3.754 4.340 0.080 16 0 "[ . 1 . 2]" 1
2170 1 141 LYS QD 1 142 ALA H . . 4.140 4.176 3.760 4.257 0.117 4 0 "[ . 1 . 2]" 1
2171 1 141 LYS QG 1 142 ALA H . . 4.890 2.868 1.901 4.098 . 0 0 "[ . 1 . 2]" 1
2172 1 142 ALA H 1 142 ALA MB . . 2.710 2.256 2.195 2.347 . 0 0 "[ . 1 . 2]" 1
2173 1 142 ALA H 1 143 PHE H . . 3.250 2.724 2.547 2.847 . 0 0 "[ . 1 . 2]" 1
2174 1 142 ALA H 1 143 PHE HB2 . . 5.040 5.072 4.918 5.120 0.080 3 0 "[ . 1 . 2]" 1
2175 1 142 ALA H 1 143 PHE HB3 . . 4.820 4.828 4.742 4.893 0.073 9 0 "[ . 1 . 2]" 1
2176 1 142 ALA H 1 144 GLU H . . 4.620 4.473 4.282 4.619 . 0 0 "[ . 1 . 2]" 1
2177 1 142 ALA HA 1 146 LEU QD . . 3.850 3.636 2.633 3.908 0.058 13 0 "[ . 1 . 2]" 1
2178 1 142 ALA MB 1 143 PHE H . . 3.150 2.680 2.309 3.082 . 0 0 "[ . 1 . 2]" 1
2179 1 142 ALA MB 1 143 PHE HA . . 5.060 4.014 3.794 4.205 . 0 0 "[ . 1 . 2]" 1
2180 1 142 ALA MB 1 143 PHE HB2 . . 4.710 4.080 3.878 4.274 . 0 0 "[ . 1 . 2]" 1
2181 1 142 ALA MB 1 143 PHE HB3 . . 4.670 4.643 4.426 4.763 0.093 8 0 "[ . 1 . 2]" 1
2182 1 142 ALA MB 1 146 LEU QD . . 4.500 3.783 2.925 4.332 . 0 0 "[ . 1 . 2]" 1
2183 1 143 PHE H 1 143 PHE HB2 . . 3.290 2.530 2.342 2.792 . 0 0 "[ . 1 . 2]" 1
2184 1 143 PHE H 1 143 PHE HB3 . . 3.380 2.419 2.316 2.558 . 0 0 "[ . 1 . 2]" 1
2185 1 143 PHE H 1 144 GLU H . . 3.470 2.784 2.389 3.052 . 0 0 "[ . 1 . 2]" 1
2186 1 143 PHE H 1 146 LEU QD . . 5.390 5.046 4.330 5.317 . 0 0 "[ . 1 . 2]" 1
2187 1 143 PHE HA 1 143 PHE QD . . 3.190 3.089 2.889 3.230 0.040 1 0 "[ . 1 . 2]" 1
2188 1 143 PHE HA 1 146 LEU H . . 4.090 3.933 3.706 4.141 0.051 1 0 "[ . 1 . 2]" 1
2189 1 143 PHE HA 1 146 LEU HB2 . . 3.970 3.555 2.666 3.851 . 0 0 "[ . 1 . 2]" 1
2190 1 143 PHE HA 1 147 HIS HD2 . . 3.330 2.976 2.191 3.396 0.066 19 0 "[ . 1 . 2]" 1
2191 1 143 PHE HB2 1 144 GLU H . . 3.850 3.798 3.728 3.918 0.068 18 0 "[ . 1 . 2]" 1
2192 1 143 PHE HB3 1 144 GLU H . . 3.610 2.384 2.269 2.633 . 0 0 "[ . 1 . 2]" 1
2193 1 143 PHE QD 1 144 GLU H . . 3.180 2.910 2.747 3.273 0.093 18 0 "[ . 1 . 2]" 1
2194 1 143 PHE QD 1 144 GLU HA . . 3.130 2.662 2.427 3.177 0.047 18 0 "[ . 1 . 2]" 1
2195 1 143 PHE QD 1 144 GLU HG2 . . 4.810 4.237 2.387 4.876 0.066 6 0 "[ . 1 . 2]" 1
2196 1 143 PHE QD 1 144 GLU HG3 . . 4.850 4.824 3.947 4.946 0.096 12 0 "[ . 1 . 2]" 1
2197 1 143 PHE QD 1 147 HIS HB2 . . 4.790 3.037 2.700 3.476 . 0 0 "[ . 1 . 2]" 1
2198 1 143 PHE QD 1 147 HIS HB3 . . 4.960 4.195 3.881 4.645 . 0 0 "[ . 1 . 2]" 1
2199 1 144 GLU H 1 144 GLU HB3 . . 3.160 2.779 2.470 3.643 0.483 18 0 "[ . 1 . 2]" 1
2200 1 144 GLU H 1 144 GLU HG2 . . 3.510 2.502 2.158 2.867 . 0 0 "[ . 1 . 2]" 1
2201 1 144 GLU H 1 144 GLU HG3 . . 3.760 2.506 1.799 2.835 . 0 0 "[ . 1 . 2]" 1
2202 1 144 GLU H 1 145 GLU H . . 3.490 2.780 2.555 2.866 . 0 0 "[ . 1 . 2]" 1
2203 1 144 GLU H 1 145 GLU HA . . 5.360 5.387 5.305 5.428 0.068 14 0 "[ . 1 . 2]" 1
2204 1 144 GLU H 1 146 LEU H . . 4.700 4.227 3.599 4.451 . 0 0 "[ . 1 . 2]" 1
2205 1 144 GLU H 1 147 HIS H . . 5.500 4.765 4.512 5.037 . 0 0 "[ . 1 . 2]" 1
2206 1 144 GLU HA 1 144 GLU HB3 . . 2.950 2.359 2.294 2.413 . 0 0 "[ . 1 . 2]" 1
2207 1 144 GLU HA 1 144 GLU HG2 . . 3.840 3.795 2.529 3.940 0.100 6 0 "[ . 1 . 2]" 1
2208 1 144 GLU HA 1 144 GLU HG3 . . 3.680 3.615 3.469 3.688 0.008 14 0 "[ . 1 . 2]" 1
2209 1 144 GLU HA 1 146 LEU H . . 4.160 3.698 3.149 4.022 . 0 0 "[ . 1 . 2]" 1
2210 1 144 GLU HA 1 147 HIS H . . 3.840 2.931 2.669 3.139 . 0 0 "[ . 1 . 2]" 1
2211 1 144 GLU HG2 1 145 GLU H . . 4.580 3.894 3.533 4.344 . 0 0 "[ . 1 . 2]" 1
2212 1 144 GLU HG3 1 145 GLU H . . 4.760 2.499 2.148 3.716 . 0 0 "[ . 1 . 2]" 1
2213 1 144 GLU HG3 1 146 LEU H . . 4.800 4.824 4.607 5.258 0.458 18 0 "[ . 1 . 2]" 1
2214 1 145 GLU H 1 145 GLU HB2 . . 2.930 2.419 2.275 2.562 . 0 0 "[ . 1 . 2]" 1
2215 1 145 GLU H 1 145 GLU HB3 . . 3.060 2.471 2.331 2.628 . 0 0 "[ . 1 . 2]" 1
2216 1 145 GLU H 1 145 GLU HG2 . . 4.490 4.449 4.377 4.519 0.029 8 0 "[ . 1 . 2]" 1
2217 1 145 GLU H 1 146 LEU H . . 3.270 2.601 2.383 2.757 . 0 0 "[ . 1 . 2]" 1
2218 1 145 GLU H 1 146 LEU QD . . 5.500 4.022 3.272 4.664 . 0 0 "[ . 1 . 2]" 1
2219 1 145 GLU H 1 147 HIS H . . 4.020 4.008 3.865 4.095 0.075 16 0 "[ . 1 . 2]" 1
2220 1 145 GLU HA 1 145 GLU HB2 . . 2.720 2.473 2.405 2.627 . 0 0 "[ . 1 . 2]" 1
2221 1 145 GLU HA 1 145 GLU HB3 . . 2.960 3.028 3.011 3.035 0.075 1 0 "[ . 1 . 2]" 1
2222 1 145 GLU HA 1 145 GLU HG2 . . 3.680 3.078 2.487 3.678 . 0 0 "[ . 1 . 2]" 1
2223 1 145 GLU HA 1 145 GLU HG3 . . 3.610 2.593 2.311 2.963 . 0 0 "[ . 1 . 2]" 1
2224 1 145 GLU HB2 1 146 LEU H . . 3.990 3.991 3.814 4.059 0.069 12 0 "[ . 1 . 2]" 1
2225 1 145 GLU HB2 1 146 LEU QD . . 5.500 3.887 3.441 4.716 . 0 0 "[ . 1 . 2]" 1
2226 1 145 GLU HB3 1 146 LEU H . . 3.530 2.896 2.534 3.299 . 0 0 "[ . 1 . 2]" 1
2227 1 145 GLU HB3 1 146 LEU HB2 . . 4.220 4.214 4.035 4.299 0.079 9 0 "[ . 1 . 2]" 1
2228 1 145 GLU HB3 1 146 LEU QD . . 4.590 2.540 2.038 3.520 . 0 0 "[ . 1 . 2]" 1
2229 1 145 GLU HG2 1 146 LEU H . . 4.560 4.194 3.680 4.930 0.370 8 0 "[ . 1 . 2]" 1
2230 1 145 GLU HG2 1 146 LEU QD . . 4.940 2.624 2.174 3.357 . 0 0 "[ . 1 . 2]" 1
2231 1 146 LEU H 1 146 LEU HB2 . . 3.130 2.453 2.299 2.580 . 0 0 "[ . 1 . 2]" 1
2232 1 146 LEU H 1 146 LEU HB3 . . 3.790 3.658 3.585 3.754 . 0 0 "[ . 1 . 2]" 1
2233 1 146 LEU H 1 146 LEU QD . . 3.770 2.905 2.510 3.369 . 0 0 "[ . 1 . 2]" 1
2234 1 146 LEU H 1 147 HIS H . . 3.000 2.162 1.864 2.382 . 0 0 "[ . 1 . 2]" 1
2235 1 146 LEU H 1 147 HIS HA . . 5.310 4.944 4.755 5.081 . 0 0 "[ . 1 . 2]" 1
2236 1 146 LEU H 1 147 HIS HB2 . . 4.230 4.205 4.033 4.293 0.063 2 0 "[ . 1 . 2]" 1
2237 1 146 LEU H 1 147 HIS HD2 . . 4.170 3.637 3.180 4.215 0.045 9 0 "[ . 1 . 2]" 1
2238 1 146 LEU H 1 148 PRO HD3 . . 5.170 4.764 4.459 5.105 . 0 0 "[ . 1 . 2]" 1
2239 1 146 LEU HA 1 146 LEU QD . . 2.710 1.997 1.930 2.085 . 0 0 "[ . 1 . 2]" 1
2240 1 146 LEU HA 1 146 LEU HG . . 3.890 3.480 2.990 3.711 . 0 0 "[ . 1 . 2]" 1
2241 1 146 LEU HA 1 147 HIS HA . . 5.040 4.590 4.483 4.734 . 0 0 "[ . 1 . 2]" 1
2242 1 146 LEU HB2 1 147 HIS H . . 4.150 3.414 3.019 3.737 . 0 0 "[ . 1 . 2]" 1
2243 1 146 LEU HB2 1 147 HIS HD2 . . 3.510 2.608 2.129 3.302 . 0 0 "[ . 1 . 2]" 1
2244 1 146 LEU HB3 1 147 HIS H . . 4.370 4.026 3.764 4.229 . 0 0 "[ . 1 . 2]" 1
2245 1 146 LEU HB3 1 147 HIS HD2 . . 3.870 3.268 2.690 3.938 0.068 3 0 "[ . 1 . 2]" 1
2246 1 146 LEU QD 1 147 HIS H . . 4.560 4.117 3.950 4.238 . 0 0 "[ . 1 . 2]" 1
2247 1 146 LEU QD 1 147 HIS HD2 . . 4.880 4.072 3.527 4.675 . 0 0 "[ . 1 . 2]" 1
2248 1 147 HIS H 1 147 HIS HB2 . . 3.720 2.608 2.493 2.791 . 0 0 "[ . 1 . 2]" 1
2249 1 147 HIS H 1 147 HIS HB3 . . 3.890 3.767 3.697 3.852 . 0 0 "[ . 1 . 2]" 1
2250 1 147 HIS H 1 147 HIS HD2 . . 4.790 3.188 2.754 3.771 . 0 0 "[ . 1 . 2]" 1
2251 1 147 HIS H 1 148 PRO HD2 . . 4.120 4.130 3.827 4.191 0.071 5 0 "[ . 1 . 2]" 1
2252 1 147 HIS H 1 148 PRO HD3 . . 4.390 3.322 3.089 3.426 . 0 0 "[ . 1 . 2]" 1
2253 1 147 HIS H 1 148 PRO QG . . 5.110 5.143 4.962 5.201 0.091 11 0 "[ . 1 . 2]" 1
2254 1 147 HIS HA 1 147 HIS HD2 . . 4.970 3.837 3.413 4.387 . 0 0 "[ . 1 . 2]" 1
2255 1 147 HIS HA 1 148 PRO HD2 . . 3.440 2.165 2.037 2.265 . 0 0 "[ . 1 . 2]" 1
2256 1 147 HIS HA 1 148 PRO HD3 . . 3.230 2.930 2.794 3.133 . 0 0 "[ . 1 . 2]" 1
2257 1 147 HIS HA 1 148 PRO QG . . 4.110 4.009 3.890 4.107 . 0 0 "[ . 1 . 2]" 1
2258 1 147 HIS HB2 1 147 HIS HD2 . . 3.430 2.876 2.598 3.086 . 0 0 "[ . 1 . 2]" 1
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