NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
585119 |
2mwm   |
25342 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mwm
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 1699
_Distance_constraint_stats_list.Viol_count 4486
_Distance_constraint_stats_list.Viol_total 15783.657
_Distance_constraint_stats_list.Viol_max 1.769
_Distance_constraint_stats_list.Viol_rms 0.1129
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0232
_Distance_constraint_stats_list.Viol_average_violations_only 0.1759
_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 3 ALA 2.627 1.476 6 1 "[ .+ 1 . 2]"
1 4 LYS 20.619 1.476 6 18 "[*-* *+************ *]"
1 5 LYS 7.485 0.730 16 5 "[ * . -**1 .+ 2]"
1 6 THR 4.556 0.110 14 0 "[ . 1 . 2]"
1 7 LEU 9.346 0.133 18 0 "[ . 1 . 2]"
1 8 ILE 8.052 1.049 1 4 "[+ .- 1* . *2]"
1 9 LEU 5.443 0.448 3 0 "[ . 1 . 2]"
1 10 TYR 4.836 0.114 15 0 "[ . 1 . 2]"
1 11 TYR 26.521 0.880 5 17 "[****+ ***** -******]"
1 12 SER 3.433 0.117 12 0 "[ . 1 . 2]"
1 13 TRP 30.859 1.482 2 19 "[*+-******* *********]"
1 14 SER 0.185 0.058 13 0 "[ . 1 . 2]"
1 15 GLY 1.307 0.078 4 0 "[ . 1 . 2]"
1 16 GLU 23.217 1.625 20 20 [******************-+]
1 17 THR 24.998 1.625 20 20 [******************-+]
1 18 LYS 1.630 0.088 14 0 "[ . 1 . 2]"
1 19 LYS 2.761 0.193 9 0 "[ . 1 . 2]"
1 20 MET 24.581 1.378 11 9 "[ * ** 1+* .- ***]"
1 21 ALA 5.124 0.109 12 0 "[ . 1 . 2]"
1 22 GLU 9.569 0.759 19 8 "[** . ** 1 ** +-]"
1 23 LYS 6.576 0.931 18 3 "[ . 1 - . + *]"
1 24 ILE 3.865 0.453 17 0 "[ . 1 . 2]"
1 25 ASN 21.240 1.021 11 18 "[ ***-*** *+*********]"
1 26 SER 5.231 0.431 6 0 "[ . 1 . 2]"
1 27 GLU 1.284 0.233 5 0 "[ . 1 . 2]"
1 28 ILE 3.080 0.112 2 0 "[ . 1 . 2]"
1 29 LYS 5.074 0.527 7 1 "[ . + 1 . 2]"
1 30 ASP 4.607 0.527 7 1 "[ . + 1 . 2]"
1 31 SER 9.614 1.049 1 4 "[+ .- 1* . *2]"
1 32 GLU 3.662 0.377 20 0 "[ . 1 . 2]"
1 33 LEU 26.101 1.021 11 19 "[******** *+********-]"
1 34 LYS 6.932 0.468 7 0 "[ . 1 . 2]"
1 35 GLU 0.596 0.089 15 0 "[ . 1 . 2]"
1 36 VAL 42.033 1.359 2 20 [*+***********-******]
1 37 LYS 4.312 0.442 11 0 "[ . 1 . 2]"
1 38 VAL 7.661 0.442 11 0 "[ . 1 . 2]"
1 39 SER 8.039 0.856 7 2 "[ . + 1 -. 2]"
1 40 GLU 0.843 0.295 7 0 "[ . 1 . 2]"
1 41 GLY 0.745 0.074 17 0 "[ . 1 . 2]"
1 42 THR 2.232 0.117 13 0 "[ . 1 . 2]"
1 43 PHE 10.402 0.874 8 6 "[** * + * . -]"
1 44 ASP 3.399 0.598 13 1 "[ . 1 + . 2]"
1 45 ALA 15.647 0.946 4 13 "[***+* ** *.****-]"
1 46 ASP 15.386 0.946 4 13 "[***+* ** *.****-]"
1 47 MET 5.800 0.385 9 0 "[ . 1 . 2]"
1 48 TYR 20.280 1.643 6 14 "[-***.+* ** * .*****]"
1 49 LYS 21.018 1.643 6 14 "[-***.+* ** * .*****]"
1 50 THR 6.358 0.598 13 1 "[ . 1 + . 2]"
1 51 SER 1.368 0.109 20 0 "[ . 1 . 2]"
1 52 ASP 2.383 0.205 14 0 "[ . 1 . 2]"
1 53 ILE 6.587 0.441 8 0 "[ . 1 . 2]"
1 54 ALA 32.631 1.248 15 19 "[****** *-*****+*****]"
1 55 LEU 2.493 0.087 4 0 "[ . 1 . 2]"
1 56 ASP 25.757 1.769 18 20 [**-**************+**]
1 57 GLN 42.880 1.248 15 19 "[****** *******+***-*]"
1 58 ILE 20.474 0.888 18 7 "[ *. **1* .* +-2]"
1 59 GLN 26.615 1.769 18 20 [**-**************+**]
1 60 GLY 0.062 0.062 19 0 "[ . 1 . 2]"
1 61 ASN 0.754 0.074 9 0 "[ . 1 . 2]"
1 62 LYS 4.325 0.596 18 1 "[ . 1 . + 2]"
1 63 ASP 3.195 0.596 18 1 "[ . 1 . + 2]"
1 64 PHE 0.663 0.204 4 0 "[ . 1 . 2]"
1 65 PRO 9.265 1.233 7 7 "[ . + * ** .- **2]"
1 66 GLU 14.242 1.233 7 15 "[ * *.*+- * *********]"
1 67 ILE 17.405 0.985 16 19 "[***-********* *+****]"
1 68 GLN 36.875 0.922 4 20 [-**+****************]
1 69 LEU 35.753 1.359 2 19 [*+*******1****-*****]
1 70 ASP 2.768 0.483 3 0 "[ . 1 . 2]"
1 71 ASN 2.481 0.116 5 0 "[ . 1 . 2]"
1 72 ILE 31.287 1.384 8 16 "[** ****+*1** -**** *]"
1 73 ASP 30.356 1.384 8 16 "[** ****+*1** -**** *]"
1 74 TYR 10.003 0.545 14 1 "[ . 1 +. 2]"
1 75 ASN 12.449 0.849 20 4 "[ * . * 1 -. +]"
1 76 ASN 4.297 0.232 4 0 "[ . 1 . 2]"
1 77 TYR 8.403 0.394 7 0 "[ . 1 . 2]"
1 78 ASP 0.695 0.080 9 0 "[ . 1 . 2]"
1 79 LEU 1.524 0.092 6 0 "[ . 1 . 2]"
1 80 ILE 4.487 0.394 7 0 "[ . 1 . 2]"
1 81 LEU 5.238 0.128 17 0 "[ . 1 . 2]"
1 82 ILE 21.992 1.382 20 10 "[ * ** 1****.* - +]"
1 83 GLY 5.830 0.768 7 3 "[ - + 1 * . 2]"
1 84 SER 2.079 0.107 8 0 "[ . 1 . 2]"
1 85 PRO 43.576 1.482 2 20 [*+-*****************]
1 86 VAL 20.137 1.670 9 11 "[ * .* +* **-* ***2]"
1 87 TRP 12.077 0.874 8 6 "[** * + * . -]"
1 88 SER 1.314 0.091 17 0 "[ . 1 . 2]"
1 89 GLY 4.417 0.455 20 0 "[ . 1 . 2]"
1 90 TYR 6.490 0.705 5 3 "[ + * - . 2]"
1 91 PRO 41.546 1.257 11 20 [*****-****+*********]
1 92 ALA 21.340 1.286 5 19 "[**-*+****** ********]"
1 93 THR 42.908 1.257 11 20 [*****-****+*********]
1 94 PRO 8.029 0.524 13 2 "[ -. 1 + . 2]"
1 95 ILE 8.172 0.928 13 1 "[ . 1 + . 2]"
1 96 LYS 4.263 0.662 13 2 "[ . 1 + . -]"
1 97 THR 6.330 1.126 12 3 "[ * . 1-+ . 2]"
1 98 LEU 3.428 0.928 13 1 "[ . 1 + . 2]"
1 99 LEU 3.590 0.662 13 2 "[ . 1 + . -]"
1 100 ASP 4.259 1.346 17 1 "[ . 1 . + 2]"
1 101 GLN 7.334 1.126 12 4 "[ * . 1*+ .- 2]"
1 102 MET 5.891 0.882 5 1 "[ + 1 . 2]"
1 103 LYS 5.887 1.346 17 2 "[ - 1 . + 2]"
1 104 ASN 13.906 0.708 13 2 "[ - 1 + . 2]"
1 105 TYR 8.341 0.979 15 7 "[ ** . **1 + * -]"
1 106 ARG 9.650 0.979 15 5 "[ * . *1 + * -]"
1 107 GLY 0.768 0.506 20 1 "[ . 1 . +]"
1 108 GLU 6.973 0.444 10 0 "[ . 1 . 2]"
1 109 VAL 7.204 0.197 4 0 "[ . 1 . 2]"
1 110 ALA 2.261 0.128 17 0 "[ . 1 . 2]"
1 111 SER 18.452 1.382 20 10 "[ * ** 1****.* - +]"
1 112 PHE 5.024 0.768 7 3 "[ - + 1 * . 2]"
1 113 PHE 11.309 1.670 9 6 "[ * .* +1 * . -*2]"
1 114 THR 6.775 1.378 11 3 "[ .- 1+ . *2]"
1 115 SER 3.738 0.761 15 1 "[ . 1 + 2]"
1 116 ALA 5.747 0.344 17 0 "[ . 1 . 2]"
1 117 GLY 5.504 0.344 17 0 "[ . 1 . 2]"
1 118 THR 3.903 0.615 13 2 "[ -. 1 + . 2]"
1 119 ASN 13.762 0.664 15 10 "[ * -.* * ***+ * *2]"
1 120 HIS 6.620 1.198 15 4 "[ * . - + *2]"
1 121 LYS 2.473 0.092 15 0 "[ . 1 . 2]"
1 122 ALA 5.090 0.115 11 0 "[ . 1 . 2]"
1 123 TYR 6.670 1.198 15 4 "[ * . - + *2]"
1 124 VAL 3.199 0.500 15 0 "[ . 1 . 2]"
1 125 SER 1.704 0.087 11 0 "[ . 1 . 2]"
1 126 HIS 4.657 0.705 5 3 "[ + * - . 2]"
1 127 PHE 1.535 0.095 3 0 "[ . 1 . 2]"
1 128 ASN 0.635 0.073 10 0 "[ . 1 . 2]"
1 129 GLU 1.684 0.089 12 0 "[ . 1 . 2]"
1 130 TRP 8.561 0.888 18 4 "[ *. *1* . + 2]"
1 131 ALA 1.920 0.098 11 0 "[ . 1 . 2]"
1 132 ASP 3.177 0.088 17 0 "[ . 1 . 2]"
1 133 GLY 1.864 0.098 11 0 "[ . 1 . 2]"
1 134 LEU 4.429 0.882 5 1 "[ + 1 . 2]"
1 135 ASN 5.743 0.444 10 0 "[ . 1 . 2]"
1 136 VAL 1.594 0.136 15 0 "[ . 1 . 2]"
1 137 ILE 5.213 0.265 20 0 "[ . 1 . 2]"
1 138 GLY 0.810 0.070 9 0 "[ . 1 . 2]"
1 139 VAL 3.704 0.109 11 0 "[ . 1 . 2]"
1 140 ALA 12.735 0.953 18 10 "[ ** * * * * *.- + *]"
1 141 ARG 4.281 0.339 11 0 "[ . 1 . 2]"
1 142 ASP 17.080 1.313 6 7 "[ * *+ 1** .- *2]"
1 143 ASP 1.134 0.453 17 0 "[ . 1 . 2]"
1 144 SER 4.965 0.680 11 1 "[ . 1+ . 2]"
1 145 GLU 16.925 0.953 18 11 "[ ** * * *** *.- + *]"
1 146 VAL 4.655 0.510 1 1 "[+ . 1 . 2]"
1 147 ASP 1.304 0.083 1 0 "[ . 1 . 2]"
1 148 LYS 10.557 0.556 18 5 "[ * -. 1 * . + *]"
1 149 TRP 26.848 0.556 18 6 "[-* *. 1 * . + *]"
1 150 SER 6.316 0.392 12 0 "[ . 1 . 2]"
1 151 LYS 8.554 0.684 5 7 "[* - + * 1* .* *]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 ALA H 1 3 ALA MB . . 2.890 2.677 2.398 2.924 0.034 14 0 "[ . 1 . 2]" 1
2 1 3 ALA H 1 4 LYS H . . 3.320 3.278 2.786 3.407 0.087 7 0 "[ . 1 . 2]" 1
3 1 3 ALA HA 1 4 LYS H . . 2.540 2.363 2.117 2.608 0.068 16 0 "[ . 1 . 2]" 1
4 1 3 ALA HA 1 4 LYS HD3 . . 4.680 4.429 3.990 6.156 1.476 6 1 "[ .+ 1 . 2]" 1
5 1 3 ALA MB 1 4 LYS H . . 3.850 3.680 3.488 3.789 . 0 0 "[ . 1 . 2]" 1
6 1 4 LYS H 1 4 LYS HB3 . . 3.550 3.512 3.264 3.721 0.171 19 0 "[ . 1 . 2]" 1
7 1 4 LYS H 1 4 LYS HD3 . . 3.430 2.925 2.155 4.263 0.833 6 1 "[ .+ 1 . 2]" 1
8 1 4 LYS H 1 4 LYS HG3 . . 3.950 4.387 2.871 4.722 0.772 3 16 "[*-+ * *********** *]" 1
9 1 4 LYS H 1 5 LYS H . . 4.400 3.647 1.857 4.462 0.062 6 0 "[ . 1 . 2]" 1
10 1 4 LYS HA 1 4 LYS HD3 . . 4.250 4.079 3.910 4.240 . 0 0 "[ . 1 . 2]" 1
11 1 4 LYS HA 1 5 LYS H . . 2.830 2.409 2.215 2.915 0.085 17 0 "[ . 1 . 2]" 1
12 1 4 LYS HA 1 78 ASP H . . 5.000 3.856 3.460 4.632 . 0 0 "[ . 1 . 2]" 1
13 1 4 LYS HA 1 78 ASP HB3 . . 4.290 3.036 2.237 3.695 . 0 0 "[ . 1 . 2]" 1
14 1 4 LYS HA 1 79 LEU H . . 5.280 5.251 4.809 5.372 0.092 6 0 "[ . 1 . 2]" 1
15 1 4 LYS HB3 1 5 LYS H . . 4.570 4.201 2.240 4.643 0.073 11 0 "[ . 1 . 2]" 1
16 1 4 LYS HG3 1 5 LYS H . . 5.260 5.254 3.936 5.990 0.730 16 5 "[ * . -**1 .+ 2]" 1
17 1 5 LYS H 1 5 LYS HG3 . . 4.010 3.584 2.979 4.096 0.086 3 0 "[ . 1 . 2]" 1
18 1 5 LYS H 1 6 THR H . . 4.830 4.374 4.197 4.769 . 0 0 "[ . 1 . 2]" 1
19 1 5 LYS H 1 78 ASP H . . 4.150 2.371 1.910 3.092 . 0 0 "[ . 1 . 2]" 1
20 1 5 LYS H 1 78 ASP HB3 . . 3.520 2.730 1.821 3.590 0.070 5 0 "[ . 1 . 2]" 1
21 1 5 LYS H 1 79 LEU H . . 4.910 3.855 3.278 4.883 . 0 0 "[ . 1 . 2]" 1
22 1 5 LYS HA 1 5 LYS HG3 . . 4.000 3.479 3.039 3.848 . 0 0 "[ . 1 . 2]" 1
23 1 5 LYS HA 1 6 THR H . . 2.760 2.360 2.116 2.533 . 0 0 "[ . 1 . 2]" 1
24 1 5 LYS HA 1 6 THR HA . . 4.730 4.489 4.320 4.560 . 0 0 "[ . 1 . 2]" 1
25 1 5 LYS HA 1 6 THR HB . . 4.490 4.435 4.035 4.578 0.088 10 0 "[ . 1 . 2]" 1
26 1 5 LYS HG3 1 6 THR H . . 4.680 4.742 4.486 4.771 0.091 6 0 "[ . 1 . 2]" 1
27 1 5 LYS HG3 1 77 TYR HA . . 4.720 3.679 2.928 4.302 . 0 0 "[ . 1 . 2]" 1
28 1 6 THR H 1 6 THR HB . . 3.300 2.798 2.337 3.132 . 0 0 "[ . 1 . 2]" 1
29 1 6 THR H 1 6 THR MG . . 4.670 3.946 3.712 4.082 . 0 0 "[ . 1 . 2]" 1
30 1 6 THR HA 1 6 THR MG . . 3.370 2.373 2.258 2.663 . 0 0 "[ . 1 . 2]" 1
31 1 6 THR HA 1 7 LEU H . . 2.890 2.168 2.087 2.242 . 0 0 "[ . 1 . 2]" 1
32 1 6 THR HA 1 7 LEU HB3 . . 4.550 4.579 4.449 4.629 0.079 11 0 "[ . 1 . 2]" 1
33 1 6 THR HA 1 78 ASP H . . 4.960 4.163 3.691 4.993 0.033 10 0 "[ . 1 . 2]" 1
34 1 6 THR HA 1 79 LEU H . . 3.850 3.010 2.690 3.360 . 0 0 "[ . 1 . 2]" 1
35 1 6 THR HA 1 79 LEU QD . . 4.750 3.883 3.474 4.394 . 0 0 "[ . 1 . 2]" 1
36 1 6 THR HA 1 80 ILE HA . . 4.290 4.096 3.704 4.326 0.036 2 0 "[ . 1 . 2]" 1
37 1 6 THR HA 1 81 LEU H . . 5.500 5.243 4.715 5.567 0.067 3 0 "[ . 1 . 2]" 1
38 1 6 THR HB 1 32 GLU H . . 4.940 4.279 3.508 5.018 0.078 12 0 "[ . 1 . 2]" 1
39 1 6 THR MG 1 7 LEU H . . 3.340 3.134 2.576 3.447 0.107 19 0 "[ . 1 . 2]" 1
40 1 6 THR MG 1 32 GLU H . . 5.010 4.228 3.326 5.120 0.110 14 0 "[ . 1 . 2]" 1
41 1 6 THR MG 1 80 ILE HA . . 4.370 3.778 3.205 4.317 . 0 0 "[ . 1 . 2]" 1
42 1 6 THR MG 1 81 LEU H . . 3.950 3.736 3.130 4.040 0.090 1 0 "[ . 1 . 2]" 1
43 1 6 THR MG 1 81 LEU QD . . 2.970 2.416 1.989 3.069 0.099 16 0 "[ . 1 . 2]" 1
44 1 7 LEU H 1 7 LEU HB3 . . 3.850 2.460 2.351 2.581 . 0 0 "[ . 1 . 2]" 1
45 1 7 LEU H 1 7 LEU HG . . 4.440 4.448 4.372 4.507 0.067 16 0 "[ . 1 . 2]" 1
46 1 7 LEU H 1 8 ILE H . . 4.670 4.527 4.150 4.670 . 0 0 "[ . 1 . 2]" 1
47 1 7 LEU H 1 77 TYR HA . . 4.870 4.940 4.858 4.961 0.091 15 0 "[ . 1 . 2]" 1
48 1 7 LEU H 1 78 ASP H . . 5.210 5.055 4.662 5.290 0.080 9 0 "[ . 1 . 2]" 1
49 1 7 LEU H 1 79 LEU H . . 4.580 4.029 3.771 4.345 . 0 0 "[ . 1 . 2]" 1
50 1 7 LEU H 1 80 ILE HA . . 3.730 2.806 2.528 3.035 . 0 0 "[ . 1 . 2]" 1
51 1 7 LEU H 1 80 ILE MD . . 5.060 4.547 4.265 4.783 . 0 0 "[ . 1 . 2]" 1
52 1 7 LEU H 1 81 LEU H . . 4.760 4.191 3.829 4.666 . 0 0 "[ . 1 . 2]" 1
53 1 7 LEU H 1 81 LEU QD . . 5.140 4.617 3.975 5.224 0.084 8 0 "[ . 1 . 2]" 1
54 1 7 LEU HA 1 7 LEU QD . . 3.150 2.158 2.045 2.295 . 0 0 "[ . 1 . 2]" 1
55 1 7 LEU HA 1 7 LEU HG . . 4.110 3.201 3.016 3.387 . 0 0 "[ . 1 . 2]" 1
56 1 7 LEU HA 1 8 ILE H . . 3.060 2.270 2.160 2.388 . 0 0 "[ . 1 . 2]" 1
57 1 7 LEU HA 1 8 ILE HB . . 4.680 4.601 4.100 4.760 0.080 4 0 "[ . 1 . 2]" 1
58 1 7 LEU HA 1 9 LEU QD . . 4.570 4.617 3.899 4.703 0.133 18 0 "[ . 1 . 2]" 1
59 1 7 LEU HA 1 32 GLU H . . 3.770 3.123 2.541 3.749 . 0 0 "[ . 1 . 2]" 1
60 1 7 LEU HB3 1 8 ILE H . . 4.830 4.097 3.717 4.546 . 0 0 "[ . 1 . 2]" 1
61 1 7 LEU HB3 1 80 ILE HA . . 4.440 3.055 2.643 3.376 . 0 0 "[ . 1 . 2]" 1
62 1 7 LEU HB3 1 80 ILE MD . . 5.500 3.227 3.016 3.535 . 0 0 "[ . 1 . 2]" 1
63 1 7 LEU QD 1 8 ILE H . . 3.220 2.245 1.847 3.271 0.051 19 0 "[ . 1 . 2]" 1
64 1 7 LEU QD 1 9 LEU HA . . 5.010 4.339 4.004 4.614 . 0 0 "[ . 1 . 2]" 1
65 1 7 LEU QD 1 32 GLU H . . 4.340 3.918 3.242 4.427 0.087 19 0 "[ . 1 . 2]" 1
66 1 7 LEU QD 1 32 GLU HB3 . . 3.770 2.553 2.110 3.406 . 0 0 "[ . 1 . 2]" 1
67 1 7 LEU QD 1 32 GLU HG3 . . 4.920 4.292 3.394 4.819 . 0 0 "[ . 1 . 2]" 1
68 1 7 LEU QD 1 33 LEU H . . 5.130 4.191 3.327 4.951 . 0 0 "[ . 1 . 2]" 1
69 1 7 LEU QD 1 33 LEU HA . . 4.470 4.139 3.513 4.593 0.123 19 0 "[ . 1 . 2]" 1
70 1 7 LEU QD 1 34 LYS H . . 4.090 3.705 2.962 4.191 0.101 7 0 "[ . 1 . 2]" 1
71 1 7 LEU QD 1 34 LYS HA . . 4.700 4.703 4.356 4.829 0.129 10 0 "[ . 1 . 2]" 1
72 1 7 LEU QD 1 34 LYS HB3 . . 5.280 3.814 3.343 4.278 . 0 0 "[ . 1 . 2]" 1
73 1 7 LEU QD 1 34 LYS HG3 . . 4.240 2.797 2.077 4.119 . 0 0 "[ . 1 . 2]" 1
74 1 7 LEU QD 1 77 TYR QD . . 5.030 3.095 2.635 3.383 . 0 0 "[ . 1 . 2]" 1
75 1 7 LEU HG 1 8 ILE H . . 4.150 3.013 2.342 3.979 . 0 0 "[ . 1 . 2]" 1
76 1 7 LEU HG 1 9 LEU HA . . 5.040 4.657 4.280 5.047 0.007 14 0 "[ . 1 . 2]" 1
77 1 7 LEU HG 1 9 LEU QD . . 3.080 2.279 1.869 2.557 . 0 0 "[ . 1 . 2]" 1
78 1 7 LEU HG 1 9 LEU HG . . 3.840 2.446 2.111 3.911 0.071 8 0 "[ . 1 . 2]" 1
79 1 7 LEU HG 1 80 ILE HA . . 4.780 4.602 4.234 4.864 0.084 8 0 "[ . 1 . 2]" 1
80 1 7 LEU HG 1 80 ILE MD . . 4.390 4.340 3.986 4.475 0.085 17 0 "[ . 1 . 2]" 1
81 1 8 ILE H 1 8 ILE HB . . 3.400 2.597 2.366 2.835 . 0 0 "[ . 1 . 2]" 1
82 1 8 ILE H 1 8 ILE MD . . 3.960 3.823 3.193 4.053 0.093 17 0 "[ . 1 . 2]" 1
83 1 8 ILE H 1 8 ILE HG13 . . 4.280 2.786 2.301 3.103 . 0 0 "[ . 1 . 2]" 1
84 1 8 ILE H 1 32 GLU H . . 4.290 3.828 3.104 4.352 0.062 6 0 "[ . 1 . 2]" 1
85 1 8 ILE H 1 32 GLU HB3 . . 4.970 3.901 3.289 5.021 0.051 17 0 "[ . 1 . 2]" 1
86 1 8 ILE H 1 33 LEU H . . 5.410 4.843 4.540 5.461 0.051 14 0 "[ . 1 . 2]" 1
87 1 8 ILE H 1 33 LEU HA . . 3.910 3.512 2.977 3.959 0.049 14 0 "[ . 1 . 2]" 1
88 1 8 ILE HA 1 8 ILE MD . . 4.260 3.966 3.859 4.058 . 0 0 "[ . 1 . 2]" 1
89 1 8 ILE HA 1 8 ILE MG . . 3.370 2.389 2.115 2.604 . 0 0 "[ . 1 . 2]" 1
90 1 8 ILE HA 1 9 LEU H . . 2.900 2.226 2.155 2.295 . 0 0 "[ . 1 . 2]" 1
91 1 8 ILE HA 1 9 LEU HA . . 4.540 4.525 4.470 4.561 0.021 17 0 "[ . 1 . 2]" 1
92 1 8 ILE HA 1 80 ILE MG . . 4.680 3.888 3.516 4.291 . 0 0 "[ . 1 . 2]" 1
93 1 8 ILE HA 1 81 LEU H . . 3.910 2.845 2.618 3.235 . 0 0 "[ . 1 . 2]" 1
94 1 8 ILE HB 1 8 ILE MD . . 3.260 2.367 2.260 2.491 . 0 0 "[ . 1 . 2]" 1
95 1 8 ILE HB 1 33 LEU H . . 4.990 4.838 4.605 5.072 0.082 20 0 "[ . 1 . 2]" 1
96 1 8 ILE HB 1 33 LEU HA . . 3.430 2.273 2.000 2.675 . 0 0 "[ . 1 . 2]" 1
97 1 8 ILE HB 1 33 LEU QD . . 3.180 2.763 2.261 3.257 0.077 20 0 "[ . 1 . 2]" 1
98 1 8 ILE HB 1 34 LYS H . . 4.160 3.262 2.334 3.739 . 0 0 "[ . 1 . 2]" 1
99 1 8 ILE MD 1 24 ILE MD . . 5.310 4.868 4.157 5.380 0.070 6 0 "[ . 1 . 2]" 1
100 1 8 ILE MD 1 24 ILE MG . . 3.680 2.880 2.091 3.763 0.083 17 0 "[ . 1 . 2]" 1
101 1 8 ILE MD 1 25 ASN H . . 3.920 3.612 3.261 4.010 0.090 18 0 "[ . 1 . 2]" 1
102 1 8 ILE MD 1 25 ASN HA . . 3.230 2.353 2.031 2.596 . 0 0 "[ . 1 . 2]" 1
103 1 8 ILE MD 1 25 ASN HB3 . . 4.090 3.938 3.597 4.198 0.108 4 0 "[ . 1 . 2]" 1
104 1 8 ILE MD 1 25 ASN HD21 . . 3.980 2.283 1.814 3.232 . 0 0 "[ . 1 . 2]" 1
105 1 8 ILE MD 1 25 ASN HD22 . . 4.450 3.424 2.801 4.098 . 0 0 "[ . 1 . 2]" 1
106 1 8 ILE MD 1 26 SER H . . 5.460 5.133 4.760 5.483 0.023 19 0 "[ . 1 . 2]" 1
107 1 8 ILE MD 1 31 SER HB3 . . 3.670 3.549 2.166 4.719 1.049 1 4 "[+ .- 1* . *2]" 1
108 1 8 ILE MD 1 32 GLU H . . 4.940 3.829 3.138 4.512 . 0 0 "[ . 1 . 2]" 1
109 1 8 ILE MD 1 33 LEU HA . . 4.680 3.268 2.267 3.887 . 0 0 "[ . 1 . 2]" 1
110 1 8 ILE MG 1 9 LEU H . . 3.430 2.934 2.403 3.504 0.074 15 0 "[ . 1 . 2]" 1
111 1 8 ILE MG 1 9 LEU HA . . 5.130 3.871 3.489 4.275 . 0 0 "[ . 1 . 2]" 1
112 1 8 ILE MG 1 10 TYR HA . . 5.490 4.966 4.322 5.572 0.082 5 0 "[ . 1 . 2]" 1
113 1 8 ILE MG 1 24 ILE MD . . 4.660 4.309 3.482 4.713 0.053 14 0 "[ . 1 . 2]" 1
114 1 8 ILE MG 1 25 ASN HA . . 5.500 4.560 3.787 5.241 . 0 0 "[ . 1 . 2]" 1
115 1 8 ILE MG 1 33 LEU HA . . 4.270 3.500 2.896 4.142 . 0 0 "[ . 1 . 2]" 1
116 1 8 ILE MG 1 34 LYS H . . 4.370 3.765 3.255 4.416 0.046 5 0 "[ . 1 . 2]" 1
117 1 8 ILE MG 1 81 LEU HB3 . . 4.420 3.321 2.308 4.431 0.010 6 0 "[ . 1 . 2]" 1
118 1 9 LEU H 1 9 LEU HB3 . . 4.190 3.750 3.609 3.867 . 0 0 "[ . 1 . 2]" 1
119 1 9 LEU H 1 9 LEU MD1 . . 3.960 3.707 2.667 4.408 0.448 3 0 "[ . 1 . 2]" 1
120 1 9 LEU H 1 9 LEU QD . . 4.170 3.300 2.312 3.755 . 0 0 "[ . 1 . 2]" 1
121 1 9 LEU H 1 9 LEU HG . . 4.230 3.244 2.512 4.297 0.067 8 0 "[ . 1 . 2]" 1
122 1 9 LEU H 1 10 TYR H . . 4.940 4.107 3.639 4.581 . 0 0 "[ . 1 . 2]" 1
123 1 9 LEU H 1 34 LYS H . . 4.950 4.986 4.873 5.034 0.084 17 0 "[ . 1 . 2]" 1
124 1 9 LEU H 1 80 ILE MG . . 5.180 3.697 3.210 4.346 . 0 0 "[ . 1 . 2]" 1
125 1 9 LEU H 1 82 ILE H . . 5.000 4.869 4.495 5.076 0.076 3 0 "[ . 1 . 2]" 1
126 1 9 LEU H 1 82 ILE MD . . 5.160 4.631 3.760 5.259 0.099 13 0 "[ . 1 . 2]" 1
127 1 9 LEU H 1 82 ILE HG13 . . 5.180 3.705 3.023 4.538 . 0 0 "[ . 1 . 2]" 1
128 1 9 LEU H 1 82 ILE MG . . 5.240 4.612 4.257 4.991 . 0 0 "[ . 1 . 2]" 1
129 1 9 LEU H 1 83 GLY H . . 4.710 4.449 3.788 4.777 0.067 18 0 "[ . 1 . 2]" 1
130 1 9 LEU HA 1 9 LEU QD . . 3.180 2.425 2.087 3.132 . 0 0 "[ . 1 . 2]" 1
131 1 9 LEU HA 1 9 LEU HG . . 4.270 2.991 2.342 3.820 . 0 0 "[ . 1 . 2]" 1
132 1 9 LEU HA 1 10 TYR H . . 3.030 2.330 2.145 2.427 . 0 0 "[ . 1 . 2]" 1
133 1 9 LEU HA 1 34 LYS H . . 3.870 3.452 2.824 3.935 0.065 6 0 "[ . 1 . 2]" 1
134 1 9 LEU HA 1 35 GLU HA . . 4.930 3.786 3.115 4.817 . 0 0 "[ . 1 . 2]" 1
135 1 9 LEU HB3 1 9 LEU QD . . 2.860 2.150 2.096 2.416 . 0 0 "[ . 1 . 2]" 1
136 1 9 LEU HB3 1 10 TYR H . . 4.110 3.673 2.316 4.181 0.071 11 0 "[ . 1 . 2]" 1
137 1 9 LEU HB3 1 82 ILE HA . . 5.220 4.503 4.027 4.915 . 0 0 "[ . 1 . 2]" 1
138 1 9 LEU QD 1 10 TYR H . . 4.630 3.964 3.573 4.321 . 0 0 "[ . 1 . 2]" 1
139 1 9 LEU QD 1 34 LYS H . . 4.020 3.789 3.307 4.130 0.110 20 0 "[ . 1 . 2]" 1
140 1 9 LEU QD 1 34 LYS HB3 . . 4.260 2.402 2.018 3.452 . 0 0 "[ . 1 . 2]" 1
141 1 9 LEU HG 1 80 ILE MG . . 5.030 3.341 2.290 4.237 . 0 0 "[ . 1 . 2]" 1
142 1 10 TYR H 1 11 TYR H . . 5.320 4.479 4.244 4.600 . 0 0 "[ . 1 . 2]" 1
143 1 10 TYR H 1 11 TYR HA . . 5.330 4.969 4.656 5.212 . 0 0 "[ . 1 . 2]" 1
144 1 10 TYR H 1 34 LYS H . . 4.790 4.443 3.488 4.868 0.078 4 0 "[ . 1 . 2]" 1
145 1 10 TYR H 1 35 GLU HA . . 3.720 2.648 2.195 3.205 . 0 0 "[ . 1 . 2]" 1
146 1 10 TYR H 1 36 VAL H . . 3.940 3.857 3.303 4.017 0.077 8 0 "[ . 1 . 2]" 1
147 1 10 TYR HA 1 11 TYR H . . 3.090 2.333 2.182 2.504 . 0 0 "[ . 1 . 2]" 1
148 1 10 TYR HA 1 36 VAL H . . 5.160 4.936 4.621 5.214 0.054 20 0 "[ . 1 . 2]" 1
149 1 10 TYR HA 1 82 ILE HA . . 4.920 3.682 3.137 4.166 . 0 0 "[ . 1 . 2]" 1
150 1 10 TYR HA 1 82 ILE MG . . 4.430 3.407 3.018 3.682 . 0 0 "[ . 1 . 2]" 1
151 1 10 TYR HA 1 83 GLY H . . 3.480 2.148 1.757 2.663 . 0 0 "[ . 1 . 2]" 1
152 1 10 TYR HA 1 83 GLY HA2 . . 4.780 4.454 4.102 4.820 0.040 8 0 "[ . 1 . 2]" 1
153 1 10 TYR HA 1 83 GLY HA3 . . 4.330 3.316 2.758 3.706 . 0 0 "[ . 1 . 2]" 1
154 1 10 TYR HB3 1 11 TYR H . . 4.360 3.369 2.369 3.932 . 0 0 "[ . 1 . 2]" 1
155 1 10 TYR HB3 1 17 THR MG . . 4.060 3.519 2.059 4.174 0.114 15 0 "[ . 1 . 2]" 1
156 1 10 TYR HB3 1 82 ILE MG . . 5.500 4.923 4.371 5.608 0.108 11 0 "[ . 1 . 2]" 1
157 1 10 TYR HB3 1 83 GLY H . . 4.500 3.059 2.455 4.168 . 0 0 "[ . 1 . 2]" 1
158 1 10 TYR HB3 1 83 GLY HA2 . . 5.120 4.282 3.602 5.130 0.010 8 0 "[ . 1 . 2]" 1
159 1 10 TYR QD 1 17 THR MG . . 4.450 2.949 2.039 4.531 0.081 20 0 "[ . 1 . 2]" 1
160 1 10 TYR QD 1 21 ALA HA . . 3.760 3.605 2.198 3.869 0.109 12 0 "[ . 1 . 2]" 1
161 1 10 TYR QD 1 21 ALA MB . . 3.230 2.693 2.111 3.305 0.075 18 0 "[ . 1 . 2]" 1
162 1 10 TYR QD 1 83 GLY HA2 . . 4.790 4.655 4.168 4.897 0.107 16 0 "[ . 1 . 2]" 1
163 1 10 TYR QD 1 83 GLY HA3 . . 4.470 3.285 2.765 3.562 . 0 0 "[ . 1 . 2]" 1
164 1 11 TYR H 1 11 TYR HB3 . . 3.610 2.502 2.292 2.693 . 0 0 "[ . 1 . 2]" 1
165 1 11 TYR H 1 11 TYR HD1 . . 5.360 4.892 4.791 5.022 . 0 0 "[ . 1 . 2]" 1
166 1 11 TYR H 1 17 THR HB . . 5.180 4.899 4.281 5.259 0.079 7 0 "[ . 1 . 2]" 1
167 1 11 TYR H 1 17 THR MG . . 3.970 3.415 2.712 4.020 0.050 4 0 "[ . 1 . 2]" 1
168 1 11 TYR H 1 82 ILE MG . . 4.810 4.511 4.007 4.909 0.099 13 0 "[ . 1 . 2]" 1
169 1 11 TYR H 1 83 GLY H . . 4.440 3.783 3.121 4.497 0.057 4 0 "[ . 1 . 2]" 1
170 1 11 TYR H 1 84 SER HA . . 4.280 3.044 2.598 3.472 . 0 0 "[ . 1 . 2]" 1
171 1 11 TYR H 1 95 ILE MD . . 4.500 3.909 3.495 4.336 . 0 0 "[ . 1 . 2]" 1
172 1 11 TYR HA 1 12 SER H . . 3.030 2.280 2.056 2.750 . 0 0 "[ . 1 . 2]" 1
173 1 11 TYR HA 1 36 VAL H . . 4.590 2.841 2.575 3.148 . 0 0 "[ . 1 . 2]" 1
174 1 11 TYR HA 1 36 VAL HB . . 4.170 3.294 2.599 3.706 . 0 0 "[ . 1 . 2]" 1
175 1 11 TYR HA 1 95 ILE MD . . 5.240 5.285 5.071 5.354 0.114 7 0 "[ . 1 . 2]" 1
176 1 11 TYR HB3 1 12 SER H . . 4.450 4.312 3.354 4.567 0.117 12 0 "[ . 1 . 2]" 1
177 1 11 TYR HB3 1 36 VAL H . . 5.410 5.428 5.019 5.731 0.321 10 0 "[ . 1 . 2]" 1
178 1 11 TYR HB3 1 36 VAL HB . . 4.080 4.431 3.751 4.611 0.531 15 1 "[ . 1 + 2]" 1
179 1 11 TYR HB3 1 36 VAL QG . . 4.010 4.554 3.042 4.890 0.880 5 16 "[****+ ***** -.*****]" 1
180 1 11 TYR HB3 1 95 ILE MD . . 3.590 3.667 3.335 3.777 0.187 3 0 "[ . 1 . 2]" 1
181 1 11 TYR HD1 1 12 SER H . . 4.330 2.678 2.014 3.145 . 0 0 "[ . 1 . 2]" 1
182 1 11 TYR HD1 1 36 VAL HB . . 4.570 4.118 3.223 4.546 . 0 0 "[ . 1 . 2]" 1
183 1 11 TYR HD2 1 84 SER HA . . 5.120 3.683 3.014 4.451 . 0 0 "[ . 1 . 2]" 1
184 1 11 TYR HD2 1 85 PRO HB3 . . 4.970 4.901 4.321 5.051 0.081 7 0 "[ . 1 . 2]" 1
185 1 11 TYR HD2 1 85 PRO HD3 . . 4.980 2.585 2.146 3.126 . 0 0 "[ . 1 . 2]" 1
186 1 11 TYR HD2 1 95 ILE MD . . 5.020 4.641 4.070 5.114 0.094 20 0 "[ . 1 . 2]" 1
187 1 11 TYR QE 1 38 VAL H . . 5.180 3.564 2.789 4.653 . 0 0 "[ . 1 . 2]" 1
188 1 11 TYR QE 1 38 VAL MG2 . . 3.840 3.205 2.778 3.696 . 0 0 "[ . 1 . 2]" 1
189 1 12 SER H 1 12 SER HB3 . . 3.720 2.999 2.543 3.493 . 0 0 "[ . 1 . 2]" 1
190 1 12 SER H 1 13 TRP H . . 4.880 4.321 3.852 4.527 . 0 0 "[ . 1 . 2]" 1
191 1 12 SER H 1 17 THR HB . . 4.810 4.402 3.852 4.860 0.050 20 0 "[ . 1 . 2]" 1
192 1 12 SER H 1 36 VAL H . . 5.500 4.243 3.582 5.292 . 0 0 "[ . 1 . 2]" 1
193 1 12 SER H 1 36 VAL HB . . 5.500 5.388 4.756 5.577 0.077 15 0 "[ . 1 . 2]" 1
194 1 12 SER HA 1 16 GLU H . . 4.880 4.853 4.375 4.965 0.085 13 0 "[ . 1 . 2]" 1
195 1 12 SER HA 1 17 THR H . . 4.920 3.598 3.058 4.050 . 0 0 "[ . 1 . 2]" 1
196 1 12 SER HA 1 17 THR HA . . 4.820 4.739 4.402 4.901 0.081 19 0 "[ . 1 . 2]" 1
197 1 12 SER HA 1 17 THR HB . . 3.200 2.042 1.922 2.273 . 0 0 "[ . 1 . 2]" 1
198 1 12 SER HA 1 18 LYS HA . . 5.080 4.736 3.861 5.153 0.073 1 0 "[ . 1 . 2]" 1
199 1 12 SER HB3 1 18 LYS H . . 4.300 3.431 2.220 4.051 . 0 0 "[ . 1 . 2]" 1
200 1 12 SER HB3 1 18 LYS HA . . 4.630 3.348 2.564 4.218 . 0 0 "[ . 1 . 2]" 1
201 1 12 SER HB3 1 18 LYS HB3 . . 4.570 4.194 2.924 4.658 0.088 14 0 "[ . 1 . 2]" 1
202 1 13 TRP H 1 13 TRP HB3 . . 3.760 2.649 2.372 3.239 . 0 0 "[ . 1 . 2]" 1
203 1 13 TRP H 1 14 SER H . . 3.440 3.218 2.755 3.498 0.058 13 0 "[ . 1 . 2]" 1
204 1 13 TRP H 1 15 GLY H . . 4.310 4.037 2.574 4.374 0.064 1 0 "[ . 1 . 2]" 1
205 1 13 TRP H 1 17 THR H . . 5.500 3.371 2.561 3.909 . 0 0 "[ . 1 . 2]" 1
206 1 13 TRP HA 1 85 PRO HB3 . . 4.200 4.199 3.698 4.292 0.092 3 0 "[ . 1 . 2]" 1
207 1 13 TRP HB3 1 13 TRP HE1 . . 4.920 5.234 4.770 5.313 0.393 4 0 "[ . 1 . 2]" 1
208 1 13 TRP HB3 1 14 SER H . . 5.090 1.989 1.813 2.261 . 0 0 "[ . 1 . 2]" 1
209 1 13 TRP HB3 1 85 PRO HA . . 4.160 5.263 4.174 5.642 1.482 2 19 "[*+-******* *********]" 1
210 1 13 TRP HE1 1 85 PRO HB3 . . 5.020 4.960 4.418 5.107 0.087 9 0 "[ . 1 . 2]" 1
211 1 14 SER H 1 15 GLY H . . 3.330 2.439 1.717 3.208 . 0 0 "[ . 1 . 2]" 1
212 1 14 SER H 1 16 GLU H . . 4.700 2.908 2.533 3.293 . 0 0 "[ . 1 . 2]" 1
213 1 15 GLY H 1 16 GLU H . . 3.640 2.356 1.738 3.151 . 0 0 "[ . 1 . 2]" 1
214 1 15 GLY H 1 17 THR H . . 4.580 4.299 3.630 4.658 0.078 4 0 "[ . 1 . 2]" 1
215 1 15 GLY HA2 1 18 LYS HB3 . . 4.170 2.863 2.250 3.770 . 0 0 "[ . 1 . 2]" 1
216 1 15 GLY HA3 1 18 LYS HB3 . . 4.590 4.306 3.759 4.665 0.075 8 0 "[ . 1 . 2]" 1
217 1 16 GLU H 1 16 GLU HB3 . . 4.070 3.598 3.163 3.829 . 0 0 "[ . 1 . 2]" 1
218 1 16 GLU H 1 16 GLU HG3 . . 4.060 2.838 1.885 4.036 . 0 0 "[ . 1 . 2]" 1
219 1 16 GLU H 1 17 THR H . . 3.610 2.724 2.200 3.292 . 0 0 "[ . 1 . 2]" 1
220 1 16 GLU H 1 18 LYS H . . 4.730 3.511 2.606 4.252 . 0 0 "[ . 1 . 2]" 1
221 1 16 GLU HA 1 19 LYS H . . 4.000 3.965 3.413 4.095 0.095 2 0 "[ . 1 . 2]" 1
222 1 16 GLU HB3 1 17 THR H . . 4.570 3.216 2.694 3.646 . 0 0 "[ . 1 . 2]" 1
223 1 16 GLU HB3 1 17 THR HB . . 4.880 5.961 5.502 6.505 1.625 20 20 [******************-+] 1
224 1 16 GLU HG3 1 17 THR H . . 4.860 4.022 1.934 4.668 . 0 0 "[ . 1 . 2]" 1
225 1 17 THR H 1 17 THR HB . . 4.120 2.883 2.453 3.215 . 0 0 "[ . 1 . 2]" 1
226 1 17 THR H 1 17 THR MG . . 4.340 3.526 3.057 3.776 . 0 0 "[ . 1 . 2]" 1
227 1 17 THR H 1 18 LYS H . . 3.790 2.821 2.602 3.043 . 0 0 "[ . 1 . 2]" 1
228 1 17 THR H 1 19 LYS H . . 5.350 4.646 4.407 5.107 . 0 0 "[ . 1 . 2]" 1
229 1 17 THR H 1 114 THR MG . . 5.290 4.317 3.524 5.370 0.080 13 0 "[ . 1 . 2]" 1
230 1 17 THR MG 1 18 LYS HA . . 5.500 4.615 4.079 5.364 . 0 0 "[ . 1 . 2]" 1
231 1 17 THR MG 1 83 GLY HA3 . . 4.160 3.231 2.415 4.208 0.048 13 0 "[ . 1 . 2]" 1
232 1 17 THR MG 1 84 SER H . . 3.830 3.341 2.826 3.918 0.088 8 0 "[ . 1 . 2]" 1
233 1 17 THR MG 1 84 SER HA . . 3.610 3.301 2.641 3.715 0.105 8 0 "[ . 1 . 2]" 1
234 1 17 THR MG 1 113 PHE HA . . 5.300 3.880 2.813 4.779 . 0 0 "[ . 1 . 2]" 1
235 1 17 THR MG 1 114 THR H . . 5.500 4.128 2.847 5.342 . 0 0 "[ . 1 . 2]" 1
236 1 17 THR MG 1 114 THR MG . . 3.680 3.117 2.051 3.808 0.128 7 0 "[ . 1 . 2]" 1
237 1 18 LYS H 1 19 LYS H . . 3.730 2.806 2.273 3.195 . 0 0 "[ . 1 . 2]" 1
238 1 18 LYS H 1 21 ALA MB . . 5.220 4.830 4.417 5.261 0.041 13 0 "[ . 1 . 2]" 1
239 1 18 LYS HA 1 18 LYS HG3 . . 3.730 3.112 2.574 3.705 . 0 0 "[ . 1 . 2]" 1
240 1 18 LYS HA 1 19 LYS HA . . 4.810 4.763 4.608 4.840 0.030 20 0 "[ . 1 . 2]" 1
241 1 18 LYS HA 1 20 MET H . . 4.980 4.367 3.819 4.816 . 0 0 "[ . 1 . 2]" 1
242 1 18 LYS HA 1 21 ALA H . . 4.550 3.816 3.210 4.614 0.064 8 0 "[ . 1 . 2]" 1
243 1 18 LYS HA 1 21 ALA MB . . 3.620 2.696 2.300 3.144 . 0 0 "[ . 1 . 2]" 1
244 1 18 LYS HA 1 22 GLU H . . 5.500 4.551 3.962 5.197 . 0 0 "[ . 1 . 2]" 1
245 1 19 LYS H 1 19 LYS HB3 . . 3.600 3.113 2.554 3.654 0.054 7 0 "[ . 1 . 2]" 1
246 1 19 LYS H 1 19 LYS HG3 . . 4.770 4.018 2.693 4.517 . 0 0 "[ . 1 . 2]" 1
247 1 19 LYS H 1 20 MET H . . 3.670 2.694 2.356 3.084 . 0 0 "[ . 1 . 2]" 1
248 1 19 LYS H 1 21 ALA H . . 5.020 4.331 4.019 4.712 . 0 0 "[ . 1 . 2]" 1
249 1 19 LYS HA 1 19 LYS HG3 . . 4.200 3.272 2.277 3.769 . 0 0 "[ . 1 . 2]" 1
250 1 19 LYS HA 1 22 GLU H . . 4.110 4.035 3.692 4.197 0.087 15 0 "[ . 1 . 2]" 1
251 1 19 LYS HB3 1 19 LYS HG3 . . 2.860 2.737 2.422 3.053 0.193 9 0 "[ . 1 . 2]" 1
252 1 19 LYS HB3 1 20 MET H . . 3.520 3.006 2.275 3.615 0.095 15 0 "[ . 1 . 2]" 1
253 1 20 MET H 1 20 MET ME . . 3.900 3.438 2.811 4.030 0.130 5 0 "[ . 1 . 2]" 1
254 1 20 MET H 1 20 MET HG3 . . 4.940 4.406 2.781 4.588 . 0 0 "[ . 1 . 2]" 1
255 1 20 MET H 1 21 ALA H . . 3.400 2.915 2.324 3.452 0.052 9 0 "[ . 1 . 2]" 1
256 1 20 MET H 1 21 ALA MB . . 5.500 4.249 3.839 4.679 . 0 0 "[ . 1 . 2]" 1
257 1 20 MET H 1 114 THR MG . . 4.520 4.117 3.315 4.622 0.102 11 0 "[ . 1 . 2]" 1
258 1 20 MET HA 1 20 MET ME . . 3.220 2.894 2.571 3.334 0.114 5 0 "[ . 1 . 2]" 1
259 1 20 MET HA 1 23 LYS H . . 3.970 3.779 3.368 4.042 0.072 20 0 "[ . 1 . 2]" 1
260 1 20 MET HA 1 23 LYS HB3 . . 3.200 3.308 2.584 4.131 0.931 18 3 "[ . 1 - . + *]" 1
261 1 20 MET HA 1 24 ILE MD . . 5.060 3.877 3.223 4.328 . 0 0 "[ . 1 . 2]" 1
262 1 20 MET HA 1 24 ILE HG13 . . 4.170 3.852 3.368 4.250 0.080 3 0 "[ . 1 . 2]" 1
263 1 20 MET HB3 1 21 ALA H . . 5.080 3.738 3.098 4.433 . 0 0 "[ . 1 . 2]" 1
264 1 20 MET HB3 1 114 THR MG . . 4.990 3.323 2.479 4.586 . 0 0 "[ . 1 . 2]" 1
265 1 20 MET ME 1 21 ALA H . . 5.090 5.123 4.321 5.196 0.106 11 0 "[ . 1 . 2]" 1
266 1 20 MET ME 1 24 ILE MD . . 5.020 4.271 1.760 4.951 . 0 0 "[ . 1 . 2]" 1
267 1 20 MET ME 1 114 THR MG . . 3.710 2.638 2.034 3.777 0.067 9 0 "[ . 1 . 2]" 1
268 1 20 MET ME 1 142 ASP H . . 4.840 4.161 3.734 4.732 . 0 0 "[ . 1 . 2]" 1
269 1 20 MET ME 1 142 ASP HA . . 3.490 2.496 2.187 3.076 . 0 0 "[ . 1 . 2]" 1
270 1 20 MET ME 1 142 ASP HB3 . . 4.580 3.007 2.300 3.696 . 0 0 "[ . 1 . 2]" 1
271 1 20 MET ME 1 143 ASP H . . 3.710 3.341 2.676 3.811 0.101 11 0 "[ . 1 . 2]" 1
272 1 20 MET HG3 1 24 ILE MD . . 4.640 2.322 1.947 3.601 . 0 0 "[ . 1 . 2]" 1
273 1 20 MET HG3 1 114 THR MG . . 4.280 4.112 3.435 5.658 1.378 11 3 "[ .- 1+ . *2]" 1
274 1 20 MET HG3 1 142 ASP H . . 5.130 5.363 4.654 6.443 1.313 6 5 "[ *+ 1* .- *2]" 1
275 1 20 MET HG3 1 142 ASP HA . . 3.620 3.926 3.372 4.468 0.848 2 6 "[ + *- 1** .* 2]" 1
276 1 21 ALA H 1 21 ALA MB . . 3.160 2.334 2.098 2.900 . 0 0 "[ . 1 . 2]" 1
277 1 21 ALA H 1 22 GLU H . . 3.470 2.351 2.084 2.459 . 0 0 "[ . 1 . 2]" 1
278 1 21 ALA H 1 22 GLU HA . . 4.880 4.855 4.451 4.976 0.096 19 0 "[ . 1 . 2]" 1
279 1 21 ALA H 1 23 LYS H . . 5.020 3.476 2.520 4.144 . 0 0 "[ . 1 . 2]" 1
280 1 21 ALA H 1 33 LEU QD . . 5.210 4.682 4.251 5.076 . 0 0 "[ . 1 . 2]" 1
281 1 21 ALA HA 1 23 LYS H . . 5.360 4.508 4.066 4.928 . 0 0 "[ . 1 . 2]" 1
282 1 21 ALA HA 1 24 ILE H . . 4.090 3.978 3.631 4.157 0.067 7 0 "[ . 1 . 2]" 1
283 1 21 ALA HA 1 24 ILE HB . . 3.560 3.361 2.790 3.630 0.070 15 0 "[ . 1 . 2]" 1
284 1 21 ALA HA 1 24 ILE MD . . 4.200 3.565 2.463 4.250 0.050 16 0 "[ . 1 . 2]" 1
285 1 21 ALA HA 1 24 ILE MG . . 4.800 4.568 4.078 4.890 0.090 17 0 "[ . 1 . 2]" 1
286 1 21 ALA HA 1 25 ASN H . . 4.530 4.171 3.855 4.465 . 0 0 "[ . 1 . 2]" 1
287 1 21 ALA HA 1 33 LEU QD . . 5.030 3.449 2.778 3.898 . 0 0 "[ . 1 . 2]" 1
288 1 21 ALA MB 1 22 GLU H . . 3.590 2.292 2.101 2.588 . 0 0 "[ . 1 . 2]" 1
289 1 21 ALA MB 1 24 ILE H . . 5.040 4.968 4.673 5.099 0.059 13 0 "[ . 1 . 2]" 1
290 1 21 ALA MB 1 25 ASN H . . 5.290 4.684 4.420 4.895 . 0 0 "[ . 1 . 2]" 1
291 1 22 GLU H 1 22 GLU HB3 . . 3.650 3.279 2.727 3.626 . 0 0 "[ . 1 . 2]" 1
292 1 22 GLU H 1 22 GLU HG3 . . 3.490 2.168 1.836 2.795 . 0 0 "[ . 1 . 2]" 1
293 1 22 GLU H 1 23 LYS H . . 3.590 2.812 2.587 3.002 . 0 0 "[ . 1 . 2]" 1
294 1 22 GLU H 1 24 ILE H . . 5.210 4.629 4.293 4.869 . 0 0 "[ . 1 . 2]" 1
295 1 22 GLU H 1 25 ASN H . . 5.500 4.826 4.674 5.037 . 0 0 "[ . 1 . 2]" 1
296 1 22 GLU H 1 33 LEU QD . . 4.620 3.688 3.046 4.183 . 0 0 "[ . 1 . 2]" 1
297 1 22 GLU HA 1 22 GLU HG3 . . 3.760 3.511 3.117 3.827 0.067 20 0 "[ . 1 . 2]" 1
298 1 22 GLU HA 1 25 ASN H . . 3.990 3.532 3.209 3.856 . 0 0 "[ . 1 . 2]" 1
299 1 22 GLU HA 1 25 ASN HB3 . . 3.450 2.735 2.210 3.506 0.056 12 0 "[ . 1 . 2]" 1
300 1 22 GLU HA 1 26 SER H . . 4.660 4.373 3.522 4.725 0.065 3 0 "[ . 1 . 2]" 1
301 1 22 GLU HA 1 33 LEU QD . . 3.380 2.686 2.113 3.290 . 0 0 "[ . 1 . 2]" 1
302 1 22 GLU HB3 1 23 LYS H . . 4.300 4.036 3.609 4.411 0.111 20 0 "[ . 1 . 2]" 1
303 1 22 GLU HG3 1 23 LYS H . . 5.070 3.375 1.953 4.535 . 0 0 "[ . 1 . 2]" 1
304 1 22 GLU HG3 1 33 LEU QD . . 4.200 4.526 4.015 4.959 0.759 19 8 "[** . ** 1 ** +-]" 1
305 1 23 LYS H 1 23 LYS HB3 . . 3.080 2.761 2.151 3.256 0.176 20 0 "[ . 1 . 2]" 1
306 1 23 LYS H 1 24 ILE H . . 3.500 2.813 2.586 3.089 . 0 0 "[ . 1 . 2]" 1
307 1 23 LYS H 1 25 ASN H . . 4.330 4.106 3.786 4.363 0.033 12 0 "[ . 1 . 2]" 1
308 1 23 LYS HA 1 23 LYS HD3 . . 4.640 4.170 2.581 4.769 0.129 11 0 "[ . 1 . 2]" 1
309 1 23 LYS HA 1 23 LYS HG3 . . 3.990 2.461 2.108 3.533 . 0 0 "[ . 1 . 2]" 1
310 1 23 LYS HA 1 26 SER H . . 4.330 3.838 3.391 4.167 . 0 0 "[ . 1 . 2]" 1
311 1 23 LYS HB3 1 24 ILE H . . 3.620 2.477 2.121 3.086 . 0 0 "[ . 1 . 2]" 1
312 1 23 LYS HG3 1 24 ILE H . . 5.250 4.301 2.648 4.750 . 0 0 "[ . 1 . 2]" 1
313 1 24 ILE H 1 24 ILE HB . . 3.290 2.376 2.179 2.826 . 0 0 "[ . 1 . 2]" 1
314 1 24 ILE H 1 24 ILE MD . . 4.140 3.453 2.970 3.793 . 0 0 "[ . 1 . 2]" 1
315 1 24 ILE H 1 24 ILE HG13 . . 3.480 2.152 1.928 2.436 . 0 0 "[ . 1 . 2]" 1
316 1 24 ILE H 1 24 ILE MG . . 4.100 3.724 3.636 3.775 . 0 0 "[ . 1 . 2]" 1
317 1 24 ILE H 1 25 ASN H . . 3.680 2.777 2.372 3.018 . 0 0 "[ . 1 . 2]" 1
318 1 24 ILE H 1 25 ASN HA . . 5.430 5.350 5.022 5.492 0.062 1 0 "[ . 1 . 2]" 1
319 1 24 ILE H 1 26 SER H . . 5.200 4.336 3.913 4.715 . 0 0 "[ . 1 . 2]" 1
320 1 24 ILE H 1 27 GLU H . . 5.380 4.960 4.551 5.250 . 0 0 "[ . 1 . 2]" 1
321 1 24 ILE H 1 146 VAL QG . . 5.110 4.531 4.054 4.875 . 0 0 "[ . 1 . 2]" 1
322 1 24 ILE HA 1 24 ILE HG13 . . 4.110 2.964 2.718 3.572 . 0 0 "[ . 1 . 2]" 1
323 1 24 ILE HA 1 24 ILE MG . . 3.540 2.500 2.230 2.702 . 0 0 "[ . 1 . 2]" 1
324 1 24 ILE HA 1 26 SER H . . 5.010 4.205 3.554 4.629 . 0 0 "[ . 1 . 2]" 1
325 1 24 ILE HA 1 27 GLU H . . 3.930 3.233 2.801 3.580 . 0 0 "[ . 1 . 2]" 1
326 1 24 ILE HA 1 27 GLU HB3 . . 4.180 4.158 3.768 4.273 0.093 1 0 "[ . 1 . 2]" 1
327 1 24 ILE HA 1 27 GLU HG3 . . 4.580 3.417 1.955 4.513 . 0 0 "[ . 1 . 2]" 1
328 1 24 ILE HA 1 28 ILE H . . 5.500 4.743 3.719 5.492 . 0 0 "[ . 1 . 2]" 1
329 1 24 ILE HA 1 146 VAL QG . . 4.590 2.784 2.032 3.347 . 0 0 "[ . 1 . 2]" 1
330 1 24 ILE HB 1 24 ILE MD . . 3.440 2.408 2.279 2.676 . 0 0 "[ . 1 . 2]" 1
331 1 24 ILE HB 1 25 ASN H . . 3.890 2.833 2.512 3.037 . 0 0 "[ . 1 . 2]" 1
332 1 24 ILE MD 1 24 ILE MG . . 3.270 2.080 2.016 2.179 . 0 0 "[ . 1 . 2]" 1
333 1 24 ILE MD 1 25 ASN H . . 5.500 4.761 4.423 5.063 . 0 0 "[ . 1 . 2]" 1
334 1 24 ILE MD 1 28 ILE MD . . 5.490 4.382 3.995 4.652 . 0 0 "[ . 1 . 2]" 1
335 1 24 ILE MD 1 81 LEU QD . . 4.760 3.609 2.725 4.837 0.077 12 0 "[ . 1 . 2]" 1
336 1 24 ILE MD 1 112 PHE HB3 . . 5.290 4.233 2.823 5.198 . 0 0 "[ . 1 . 2]" 1
337 1 24 ILE MD 1 142 ASP HA . . 5.460 4.463 3.867 5.313 . 0 0 "[ . 1 . 2]" 1
338 1 24 ILE MD 1 143 ASP HA . . 3.870 2.674 2.120 3.808 . 0 0 "[ . 1 . 2]" 1
339 1 24 ILE MD 1 143 ASP HB3 . . 4.670 2.894 2.208 4.769 0.099 3 0 "[ . 1 . 2]" 1
340 1 24 ILE MD 1 146 VAL QG . . 3.670 2.792 2.005 3.511 . 0 0 "[ . 1 . 2]" 1
341 1 24 ILE HG13 1 143 ASP HB3 . . 4.570 3.032 2.262 5.023 0.453 17 0 "[ . 1 . 2]" 1
342 1 24 ILE MG 1 25 ASN H . . 4.280 3.509 3.253 3.890 . 0 0 "[ . 1 . 2]" 1
343 1 24 ILE MG 1 25 ASN HA . . 4.450 3.560 3.273 3.975 . 0 0 "[ . 1 . 2]" 1
344 1 24 ILE MG 1 27 GLU H . . 5.170 4.375 4.130 4.816 . 0 0 "[ . 1 . 2]" 1
345 1 24 ILE MG 1 28 ILE H . . 5.500 4.521 3.573 5.297 . 0 0 "[ . 1 . 2]" 1
346 1 24 ILE MG 1 28 ILE MD . . 3.440 2.080 1.939 2.424 . 0 0 "[ . 1 . 2]" 1
347 1 24 ILE MG 1 28 ILE MG . . 5.410 4.391 4.075 4.736 . 0 0 "[ . 1 . 2]" 1
348 1 24 ILE MG 1 81 LEU QD . . 3.590 2.758 1.927 3.671 0.081 12 0 "[ . 1 . 2]" 1
349 1 24 ILE MG 1 146 VAL H . . 5.300 5.136 4.378 5.388 0.088 1 0 "[ . 1 . 2]" 1
350 1 24 ILE MG 1 146 VAL HA . . 5.500 4.142 3.650 4.610 . 0 0 "[ . 1 . 2]" 1
351 1 25 ASN H 1 25 ASN HB3 . . 3.320 2.516 2.325 2.748 . 0 0 "[ . 1 . 2]" 1
352 1 25 ASN H 1 25 ASN HD21 . . 5.470 4.595 4.438 4.753 . 0 0 "[ . 1 . 2]" 1
353 1 25 ASN H 1 26 SER H . . 3.570 2.837 2.652 3.073 . 0 0 "[ . 1 . 2]" 1
354 1 25 ASN H 1 27 GLU H . . 5.340 4.207 4.052 4.359 . 0 0 "[ . 1 . 2]" 1
355 1 25 ASN H 1 33 LEU QD . . 4.670 3.746 3.395 4.221 . 0 0 "[ . 1 . 2]" 1
356 1 25 ASN HA 1 25 ASN HD21 . . 3.370 2.176 1.938 2.457 . 0 0 "[ . 1 . 2]" 1
357 1 25 ASN HA 1 25 ASN HD22 . . 3.740 3.656 3.425 3.805 0.065 19 0 "[ . 1 . 2]" 1
358 1 25 ASN HA 1 33 LEU QD . . 5.020 4.124 3.466 4.762 . 0 0 "[ . 1 . 2]" 1
359 1 25 ASN HB3 1 26 SER H . . 3.630 2.938 2.609 3.493 . 0 0 "[ . 1 . 2]" 1
360 1 25 ASN HB3 1 33 LEU HB3 . . 4.820 5.512 4.949 5.841 1.021 11 18 "[ ***-*** *+*********]" 1
361 1 25 ASN HB3 1 33 LEU QD . . 3.730 2.708 2.229 3.507 . 0 0 "[ . 1 . 2]" 1
362 1 25 ASN HD21 1 26 SER H . . 5.010 5.029 4.451 5.092 0.082 3 0 "[ . 1 . 2]" 1
363 1 25 ASN HD21 1 28 ILE HB . . 5.440 3.797 2.918 4.351 . 0 0 "[ . 1 . 2]" 1
364 1 25 ASN HD21 1 31 SER H . . 4.620 4.502 3.780 4.700 0.080 7 0 "[ . 1 . 2]" 1
365 1 25 ASN HD21 1 31 SER HB3 . . 5.130 4.153 2.223 5.212 0.082 19 0 "[ . 1 . 2]" 1
366 1 25 ASN HD21 1 32 GLU H . . 5.500 4.586 3.622 5.574 0.074 12 0 "[ . 1 . 2]" 1
367 1 25 ASN HD22 1 28 ILE HB . . 5.380 5.064 4.293 5.457 0.077 5 0 "[ . 1 . 2]" 1
368 1 25 ASN HD22 1 31 SER H . . 4.680 4.275 3.563 4.739 0.059 2 0 "[ . 1 . 2]" 1
369 1 25 ASN HD22 1 32 GLU HA . . 5.350 3.868 2.801 4.521 . 0 0 "[ . 1 . 2]" 1
370 1 25 ASN HD22 1 33 LEU H . . 5.040 4.826 3.970 5.123 0.083 14 0 "[ . 1 . 2]" 1
371 1 25 ASN HD22 1 33 LEU HB3 . . 5.150 4.890 3.902 5.976 0.826 8 2 "[ . + 1 - 2]" 1
372 1 26 SER H 1 26 SER HB3 . . 3.130 3.126 2.364 3.561 0.431 6 0 "[ . 1 . 2]" 1
373 1 26 SER H 1 28 ILE H . . 4.620 4.196 3.725 4.504 . 0 0 "[ . 1 . 2]" 1
374 1 26 SER HB3 1 27 GLU H . . 4.110 3.475 2.420 4.343 0.233 5 0 "[ . 1 . 2]" 1
375 1 27 GLU H 1 27 GLU HB3 . . 3.890 3.466 2.936 3.714 . 0 0 "[ . 1 . 2]" 1
376 1 27 GLU H 1 27 GLU HG3 . . 4.110 3.678 2.819 4.186 0.076 5 0 "[ . 1 . 2]" 1
377 1 27 GLU H 1 28 ILE H . . 3.240 2.568 2.006 2.994 . 0 0 "[ . 1 . 2]" 1
378 1 27 GLU H 1 146 VAL QG . . 5.240 4.249 3.641 4.723 . 0 0 "[ . 1 . 2]" 1
379 1 27 GLU HA 1 27 GLU HG3 . . 3.910 3.745 3.587 3.931 0.021 16 0 "[ . 1 . 2]" 1
380 1 27 GLU HB3 1 28 ILE H . . 5.040 4.155 3.348 4.612 . 0 0 "[ . 1 . 2]" 1
381 1 27 GLU HB3 1 146 VAL QG . . 4.430 2.991 2.149 4.299 . 0 0 "[ . 1 . 2]" 1
382 1 28 ILE H 1 28 ILE HB . . 3.160 2.480 2.257 2.769 . 0 0 "[ . 1 . 2]" 1
383 1 28 ILE H 1 28 ILE MD . . 4.390 3.903 3.404 4.383 . 0 0 "[ . 1 . 2]" 1
384 1 28 ILE H 1 28 ILE MG . . 4.250 3.810 3.714 3.926 . 0 0 "[ . 1 . 2]" 1
385 1 28 ILE H 1 29 LYS H . . 4.470 4.459 4.272 4.547 0.077 6 0 "[ . 1 . 2]" 1
386 1 28 ILE H 1 146 VAL QG . . 5.230 4.360 3.456 4.931 . 0 0 "[ . 1 . 2]" 1
387 1 28 ILE HA 1 28 ILE MD . . 3.990 3.832 3.687 3.952 . 0 0 "[ . 1 . 2]" 1
388 1 28 ILE HA 1 28 ILE MG . . 3.170 2.520 2.331 2.637 . 0 0 "[ . 1 . 2]" 1
389 1 28 ILE HA 1 29 LYS H . . 2.770 2.324 2.103 2.452 . 0 0 "[ . 1 . 2]" 1
390 1 28 ILE HB 1 28 ILE MD . . 3.680 2.448 2.282 2.602 . 0 0 "[ . 1 . 2]" 1
391 1 28 ILE HB 1 31 SER H . . 4.570 4.509 4.135 4.652 0.082 16 0 "[ . 1 . 2]" 1
392 1 28 ILE MD 1 28 ILE MG . . 2.960 2.051 1.980 2.109 . 0 0 "[ . 1 . 2]" 1
393 1 28 ILE MD 1 29 LYS H . . 4.770 4.716 4.539 4.882 0.112 2 0 "[ . 1 . 2]" 1
394 1 28 ILE MD 1 150 SER HB3 . . 5.060 4.402 2.950 5.156 0.096 12 0 "[ . 1 . 2]" 1
395 1 28 ILE MG 1 29 LYS H . . 3.540 2.130 1.948 2.594 . 0 0 "[ . 1 . 2]" 1
396 1 28 ILE MG 1 29 LYS HA . . 4.040 3.961 3.685 4.117 0.077 8 0 "[ . 1 . 2]" 1
397 1 28 ILE MG 1 30 ASP H . . 4.800 4.581 4.248 4.863 0.063 8 0 "[ . 1 . 2]" 1
398 1 28 ILE MG 1 31 SER H . . 4.100 3.228 2.862 3.711 . 0 0 "[ . 1 . 2]" 1
399 1 28 ILE MG 1 32 GLU H . . 5.240 4.953 4.398 5.337 0.097 1 0 "[ . 1 . 2]" 1
400 1 29 LYS H 1 29 LYS HB3 . . 3.500 2.758 2.153 3.282 . 0 0 "[ . 1 . 2]" 1
401 1 29 LYS H 1 29 LYS HG3 . . 4.220 4.143 3.264 4.516 0.296 6 0 "[ . 1 . 2]" 1
402 1 29 LYS H 1 30 ASP H . . 4.970 4.449 4.250 4.590 . 0 0 "[ . 1 . 2]" 1
403 1 29 LYS H 1 31 SER H . . 5.010 4.604 4.185 4.975 . 0 0 "[ . 1 . 2]" 1
404 1 29 LYS HA 1 30 ASP H . . 2.740 2.519 2.005 2.814 0.074 6 0 "[ . 1 . 2]" 1
405 1 29 LYS HA 1 30 ASP HA . . 4.410 4.421 4.246 4.487 0.077 12 0 "[ . 1 . 2]" 1
406 1 29 LYS HA 1 31 SER H . . 4.460 4.156 3.287 4.506 0.046 1 0 "[ . 1 . 2]" 1
407 1 29 LYS HB3 1 30 ASP H . . 4.040 3.014 2.005 4.113 0.073 8 0 "[ . 1 . 2]" 1
408 1 29 LYS HG3 1 30 ASP H . . 3.750 3.304 1.680 4.277 0.527 7 1 "[ . + 1 . 2]" 1
409 1 30 ASP H 1 30 ASP HA . . 2.760 2.647 2.245 2.843 0.083 9 0 "[ . 1 . 2]" 1
410 1 30 ASP H 1 31 SER H . . 3.350 3.251 2.657 3.456 0.106 11 0 "[ . 1 . 2]" 1
411 1 30 ASP HA 1 31 SER H . . 3.450 2.686 2.127 3.228 . 0 0 "[ . 1 . 2]" 1
412 1 31 SER H 1 31 SER HB3 . . 3.730 2.799 2.274 3.781 0.051 12 0 "[ . 1 . 2]" 1
413 1 31 SER H 1 32 GLU H . . 4.540 4.532 4.343 4.616 0.076 6 0 "[ . 1 . 2]" 1
414 1 31 SER HA 1 32 GLU H . . 3.060 2.572 2.114 3.095 0.035 10 0 "[ . 1 . 2]" 1
415 1 31 SER HB3 1 32 GLU H . . 3.600 3.478 2.385 3.977 0.377 20 0 "[ . 1 . 2]" 1
416 1 32 GLU H 1 32 GLU HB3 . . 3.550 3.180 2.601 3.633 0.083 6 0 "[ . 1 . 2]" 1
417 1 32 GLU H 1 32 GLU HG3 . . 5.030 4.297 3.052 4.832 . 0 0 "[ . 1 . 2]" 1
418 1 32 GLU H 1 33 LEU H . . 4.610 4.345 4.159 4.618 0.008 12 0 "[ . 1 . 2]" 1
419 1 32 GLU HA 1 33 LEU H . . 2.850 2.377 2.118 2.648 . 0 0 "[ . 1 . 2]" 1
420 1 32 GLU HA 1 33 LEU HA . . 4.940 4.500 4.372 4.685 . 0 0 "[ . 1 . 2]" 1
421 1 32 GLU HB3 1 33 LEU H . . 3.830 2.911 2.169 3.511 . 0 0 "[ . 1 . 2]" 1
422 1 32 GLU HG3 1 33 LEU H . . 4.590 3.294 1.918 4.648 0.058 13 0 "[ . 1 . 2]" 1
423 1 33 LEU H 1 33 LEU HB3 . . 3.510 2.942 2.533 3.320 . 0 0 "[ . 1 . 2]" 1
424 1 33 LEU H 1 33 LEU QD . . 4.460 4.017 3.905 4.110 . 0 0 "[ . 1 . 2]" 1
425 1 33 LEU H 1 33 LEU HG . . 4.990 4.395 3.950 4.640 . 0 0 "[ . 1 . 2]" 1
426 1 33 LEU H 1 34 LYS H . . 4.650 4.096 3.714 4.377 . 0 0 "[ . 1 . 2]" 1
427 1 33 LEU HA 1 33 LEU QD . . 3.220 2.189 2.100 2.283 . 0 0 "[ . 1 . 2]" 1
428 1 33 LEU HA 1 34 LYS H . . 2.950 2.226 2.119 2.337 . 0 0 "[ . 1 . 2]" 1
429 1 33 LEU HB3 1 34 LYS H . . 4.630 4.223 3.435 4.610 . 0 0 "[ . 1 . 2]" 1
430 1 33 LEU QD 1 34 LYS H . . 3.520 2.747 2.186 3.395 . 0 0 "[ . 1 . 2]" 1
431 1 33 LEU HG 1 34 LYS H . . 4.240 4.051 3.379 4.334 0.094 1 0 "[ . 1 . 2]" 1
432 1 34 LYS H 1 34 LYS HB3 . . 3.680 3.488 2.669 3.916 0.236 11 0 "[ . 1 . 2]" 1
433 1 34 LYS H 1 34 LYS HG3 . . 4.450 4.313 3.563 4.567 0.117 13 0 "[ . 1 . 2]" 1
434 1 34 LYS H 1 35 GLU H . . 4.820 4.426 4.269 4.653 . 0 0 "[ . 1 . 2]" 1
435 1 34 LYS HA 1 34 LYS HG3 . . 3.930 3.511 2.407 3.988 0.058 11 0 "[ . 1 . 2]" 1
436 1 34 LYS HA 1 35 GLU H . . 2.830 2.491 2.251 2.919 0.089 15 0 "[ . 1 . 2]" 1
437 1 34 LYS HB3 1 35 GLU H . . 4.360 2.591 2.221 3.675 . 0 0 "[ . 1 . 2]" 1
438 1 34 LYS HE3 1 34 LYS HG3 . . 3.180 2.831 2.303 3.648 0.468 7 0 "[ . 1 . 2]" 1
439 1 34 LYS HG3 1 35 GLU H . . 4.910 4.469 3.117 4.977 0.067 19 0 "[ . 1 . 2]" 1
440 1 35 GLU H 1 36 VAL H . . 4.740 4.331 3.341 4.584 . 0 0 "[ . 1 . 2]" 1
441 1 35 GLU H 1 36 VAL QG . . 4.860 4.241 3.789 4.664 . 0 0 "[ . 1 . 2]" 1
442 1 35 GLU HA 1 36 VAL H . . 2.980 2.300 2.006 2.521 . 0 0 "[ . 1 . 2]" 1
443 1 35 GLU HA 1 36 VAL HB . . 4.650 4.597 4.225 4.727 0.077 8 0 "[ . 1 . 2]" 1
444 1 35 GLU HA 1 36 VAL QG . . 4.260 3.202 2.919 3.645 . 0 0 "[ . 1 . 2]" 1
445 1 36 VAL H 1 36 VAL HB . . 3.350 2.666 2.323 2.796 . 0 0 "[ . 1 . 2]" 1
446 1 36 VAL H 1 36 VAL QG . . 3.620 2.526 2.044 2.766 . 0 0 "[ . 1 . 2]" 1
447 1 36 VAL HA 1 36 VAL QG . . 3.060 2.159 2.079 2.268 . 0 0 "[ . 1 . 2]" 1
448 1 36 VAL HA 1 37 LYS H . . 2.840 2.409 2.261 2.517 . 0 0 "[ . 1 . 2]" 1
449 1 36 VAL HA 1 37 LYS HA . . 4.690 4.557 4.491 4.630 . 0 0 "[ . 1 . 2]" 1
450 1 36 VAL HA 1 67 ILE HB . . 5.130 4.814 4.340 5.209 0.079 4 0 "[ . 1 . 2]" 1
451 1 36 VAL HA 1 68 GLN H . . 5.270 4.882 4.299 5.293 0.023 15 0 "[ . 1 . 2]" 1
452 1 36 VAL HA 1 69 LEU HA . . 4.710 4.374 3.360 4.794 0.084 13 0 "[ . 1 . 2]" 1
453 1 36 VAL HA 1 69 LEU HB3 . . 4.280 5.064 2.439 5.639 1.359 2 18 [*+**.****1****-*****] 1
454 1 36 VAL HA 1 69 LEU MD2 . . 3.740 3.413 1.937 4.174 0.434 2 0 "[ . 1 . 2]" 1
455 1 36 VAL QG 1 37 LYS H . . 3.650 2.334 1.976 3.353 . 0 0 "[ . 1 . 2]" 1
456 1 36 VAL QG 1 67 ILE HA . . 4.510 3.807 3.479 4.185 . 0 0 "[ . 1 . 2]" 1
457 1 36 VAL QG 1 67 ILE HB . . 3.130 2.525 2.116 3.173 0.043 13 0 "[ . 1 . 2]" 1
458 1 36 VAL QG 1 68 GLN H . . 4.520 3.475 3.030 3.904 . 0 0 "[ . 1 . 2]" 1
459 1 37 LYS H 1 37 LYS HB3 . . 3.930 3.538 3.056 3.925 . 0 0 "[ . 1 . 2]" 1
460 1 37 LYS H 1 38 VAL H . . 4.680 4.366 4.238 4.591 . 0 0 "[ . 1 . 2]" 1
461 1 37 LYS H 1 68 GLN H . . 3.920 3.121 2.472 3.897 . 0 0 "[ . 1 . 2]" 1
462 1 37 LYS H 1 69 LEU HA . . 5.110 4.856 4.174 5.181 0.071 12 0 "[ . 1 . 2]" 1
463 1 37 LYS HA 1 38 VAL H . . 2.880 2.522 2.320 2.837 . 0 0 "[ . 1 . 2]" 1
464 1 37 LYS HA 1 38 VAL MG2 . . 4.050 3.823 3.429 4.115 0.065 16 0 "[ . 1 . 2]" 1
465 1 37 LYS HB3 1 38 VAL H . . 3.410 3.122 2.105 3.852 0.442 11 0 "[ . 1 . 2]" 1
466 1 38 VAL H 1 38 VAL MG1 . . 3.860 3.064 2.818 3.326 . 0 0 "[ . 1 . 2]" 1
467 1 38 VAL H 1 38 VAL MG2 . . 3.090 2.269 2.036 2.527 . 0 0 "[ . 1 . 2]" 1
468 1 38 VAL H 1 39 SER H . . 4.790 4.394 4.261 4.515 . 0 0 "[ . 1 . 2]" 1
469 1 38 VAL H 1 39 SER HA . . 5.150 5.111 4.862 5.229 0.079 17 0 "[ . 1 . 2]" 1
470 1 38 VAL HA 1 38 VAL MG1 . . 3.200 2.313 2.250 2.390 . 0 0 "[ . 1 . 2]" 1
471 1 38 VAL HA 1 39 SER H . . 3.000 2.682 2.506 2.957 . 0 0 "[ . 1 . 2]" 1
472 1 38 VAL HA 1 67 ILE HA . . 3.760 2.390 2.029 2.783 . 0 0 "[ . 1 . 2]" 1
473 1 38 VAL HA 1 67 ILE MG . . 5.190 3.558 3.047 4.344 . 0 0 "[ . 1 . 2]" 1
474 1 38 VAL HA 1 68 GLN H . . 4.500 3.421 2.821 3.918 . 0 0 "[ . 1 . 2]" 1
475 1 38 VAL HB 1 39 SER H . . 3.110 2.161 1.913 2.405 . 0 0 "[ . 1 . 2]" 1
476 1 38 VAL HB 1 42 THR HB . . 4.530 3.939 3.057 4.452 . 0 0 "[ . 1 . 2]" 1
477 1 38 VAL HB 1 42 THR MG . . 3.640 3.137 2.424 3.692 0.052 7 0 "[ . 1 . 2]" 1
478 1 38 VAL MG1 1 39 SER H . . 3.890 3.635 3.375 3.779 . 0 0 "[ . 1 . 2]" 1
479 1 38 VAL MG1 1 42 THR MG . . 3.700 3.323 2.495 3.816 0.116 1 0 "[ . 1 . 2]" 1
480 1 38 VAL MG1 1 65 PRO HA . . 5.230 5.215 4.449 5.330 0.100 15 0 "[ . 1 . 2]" 1
481 1 38 VAL MG1 1 66 GLU H . . 5.500 4.519 3.686 5.236 . 0 0 "[ . 1 . 2]" 1
482 1 38 VAL MG1 1 67 ILE HA . . 3.610 3.060 2.233 3.562 . 0 0 "[ . 1 . 2]" 1
483 1 38 VAL MG1 1 67 ILE MG . . 3.460 2.594 2.225 3.193 . 0 0 "[ . 1 . 2]" 1
484 1 38 VAL MG1 1 68 GLN H . . 4.790 4.489 3.649 4.882 0.092 3 0 "[ . 1 . 2]" 1
485 1 38 VAL MG1 1 94 PRO HA . . 4.520 3.108 2.602 3.649 . 0 0 "[ . 1 . 2]" 1
486 1 38 VAL MG2 1 39 SER H . . 4.000 3.206 2.684 3.621 . 0 0 "[ . 1 . 2]" 1
487 1 38 VAL MG2 1 39 SER HA . . 5.440 4.417 4.158 4.618 . 0 0 "[ . 1 . 2]" 1
488 1 38 VAL MG2 1 42 THR H . . 4.520 4.153 3.646 4.585 0.065 7 0 "[ . 1 . 2]" 1
489 1 38 VAL MG2 1 42 THR HB . . 3.270 2.822 2.368 3.334 0.064 2 0 "[ . 1 . 2]" 1
490 1 38 VAL MG2 1 42 THR MG . . 3.690 3.051 2.563 3.713 0.023 2 0 "[ . 1 . 2]" 1
491 1 38 VAL MG2 1 43 PHE H . . 4.590 4.557 3.984 4.702 0.112 16 0 "[ . 1 . 2]" 1
492 1 39 SER H 1 39 SER HB3 . . 3.050 2.916 2.119 3.141 0.091 4 0 "[ . 1 . 2]" 1
493 1 39 SER H 1 40 GLU H . . 4.630 4.440 4.332 4.581 . 0 0 "[ . 1 . 2]" 1
494 1 39 SER H 1 42 THR H . . 5.430 5.387 4.763 5.512 0.082 7 0 "[ . 1 . 2]" 1
495 1 39 SER H 1 42 THR MG . . 4.830 4.080 3.367 4.681 . 0 0 "[ . 1 . 2]" 1
496 1 39 SER H 1 67 ILE HA . . 4.960 4.429 3.896 4.994 0.034 15 0 "[ . 1 . 2]" 1
497 1 39 SER H 1 68 GLN HE21 . . 4.880 3.701 2.716 4.625 . 0 0 "[ . 1 . 2]" 1
498 1 39 SER H 1 68 GLN HE22 . . 4.890 4.710 3.483 4.968 0.078 17 0 "[ . 1 . 2]" 1
499 1 39 SER HA 1 39 SER HB3 . . 2.830 2.804 2.245 3.046 0.216 14 0 "[ . 1 . 2]" 1
500 1 39 SER HA 1 40 GLU H . . 2.680 2.539 2.227 2.737 0.057 5 0 "[ . 1 . 2]" 1
501 1 39 SER HA 1 68 GLN HE21 . . 4.830 2.709 2.017 4.237 . 0 0 "[ . 1 . 2]" 1
502 1 39 SER HA 1 68 GLN HE22 . . 4.680 3.080 2.294 4.542 . 0 0 "[ . 1 . 2]" 1
503 1 39 SER HB3 1 40 GLU H . . 3.490 2.676 2.290 3.785 0.295 7 0 "[ . 1 . 2]" 1
504 1 39 SER HB3 1 68 GLN HE21 . . 4.670 4.300 2.998 5.401 0.731 7 2 "[ . + 1 -. 2]" 1
505 1 39 SER HB3 1 68 GLN HE22 . . 5.070 4.664 3.403 5.926 0.856 7 2 "[ . + 1 -. 2]" 1
506 1 40 GLU H 1 41 GLY H . . 4.650 4.360 2.619 4.659 0.009 4 0 "[ . 1 . 2]" 1
507 1 40 GLU H 1 42 THR H . . 5.230 4.769 4.427 5.263 0.033 20 0 "[ . 1 . 2]" 1
508 1 40 GLU HA 1 41 GLY H . . 2.720 2.318 2.073 2.790 0.070 10 0 "[ . 1 . 2]" 1
509 1 40 GLU HA 1 42 THR H . . 3.950 3.461 3.129 4.023 0.073 8 0 "[ . 1 . 2]" 1
510 1 41 GLY H 1 42 THR H . . 3.320 2.706 2.271 3.017 . 0 0 "[ . 1 . 2]" 1
511 1 41 GLY H 1 43 PHE H . . 4.390 4.251 3.678 4.464 0.074 17 0 "[ . 1 . 2]" 1
512 1 41 GLY HA2 1 42 THR H . . 3.470 3.250 2.908 3.520 0.050 7 0 "[ . 1 . 2]" 1
513 1 41 GLY HA2 1 43 PHE H . . 4.560 4.038 3.236 4.615 0.055 15 0 "[ . 1 . 2]" 1
514 1 42 THR H 1 42 THR HB . . 3.010 2.569 2.166 2.766 . 0 0 "[ . 1 . 2]" 1
515 1 42 THR H 1 42 THR MG . . 4.370 3.706 3.582 3.876 . 0 0 "[ . 1 . 2]" 1
516 1 42 THR H 1 43 PHE H . . 3.130 2.647 2.157 2.977 . 0 0 "[ . 1 . 2]" 1
517 1 42 THR H 1 43 PHE HA . . 5.470 5.162 4.486 5.474 0.004 3 0 "[ . 1 . 2]" 1
518 1 42 THR HA 1 42 THR MG . . 3.750 2.377 2.223 2.681 . 0 0 "[ . 1 . 2]" 1
519 1 42 THR HA 1 53 ILE MG . . 4.910 4.182 2.217 5.004 0.094 9 0 "[ . 1 . 2]" 1
520 1 42 THR HB 1 43 PHE H . . 3.070 2.747 2.497 3.115 0.045 9 0 "[ . 1 . 2]" 1
521 1 42 THR MG 1 43 PHE H . . 4.250 3.783 3.477 4.135 . 0 0 "[ . 1 . 2]" 1
522 1 42 THR MG 1 43 PHE HA . . 4.770 4.453 4.131 4.814 0.044 10 0 "[ . 1 . 2]" 1
523 1 42 THR MG 1 43 PHE QD . . 3.960 2.711 2.155 3.516 . 0 0 "[ . 1 . 2]" 1
524 1 42 THR MG 1 53 ILE MD . . 5.460 4.953 4.188 5.577 0.117 13 0 "[ . 1 . 2]" 1
525 1 42 THR MG 1 53 ILE MG . . 4.770 3.660 2.667 4.518 . 0 0 "[ . 1 . 2]" 1
526 1 42 THR MG 1 65 PRO HA . . 4.370 3.476 2.895 3.909 . 0 0 "[ . 1 . 2]" 1
527 1 42 THR MG 1 65 PRO HB3 . . 3.370 2.146 1.921 2.657 . 0 0 "[ . 1 . 2]" 1
528 1 42 THR MG 1 66 GLU H . . 5.450 4.097 3.007 5.186 . 0 0 "[ . 1 . 2]" 1
529 1 43 PHE H 1 43 PHE QD . . 4.140 3.244 2.669 3.658 . 0 0 "[ . 1 . 2]" 1
530 1 43 PHE H 1 44 ASP HA . . 5.420 4.814 4.432 5.129 . 0 0 "[ . 1 . 2]" 1
531 1 43 PHE H 1 53 ILE MD . . 4.880 4.547 3.585 4.979 0.099 3 0 "[ . 1 . 2]" 1
532 1 43 PHE HA 1 43 PHE QD . . 3.470 2.995 2.337 3.586 0.116 5 0 "[ . 1 . 2]" 1
533 1 43 PHE HA 1 50 THR MG . . 5.180 3.469 2.211 4.130 . 0 0 "[ . 1 . 2]" 1
534 1 43 PHE HA 1 53 ILE MD . . 3.330 2.286 1.969 2.597 . 0 0 "[ . 1 . 2]" 1
535 1 43 PHE HA 1 53 ILE MG . . 4.300 3.164 2.448 3.930 . 0 0 "[ . 1 . 2]" 1
536 1 43 PHE HB3 1 44 ASP H . . 3.190 2.455 1.834 3.354 0.164 20 0 "[ . 1 . 2]" 1
537 1 43 PHE HB3 1 50 THR MG . . 4.700 2.909 2.061 3.545 . 0 0 "[ . 1 . 2]" 1
538 1 43 PHE HB3 1 53 ILE MD . . 5.060 3.438 2.343 4.412 . 0 0 "[ . 1 . 2]" 1
539 1 43 PHE HB3 1 87 TRP HE1 . . 4.110 4.089 3.185 4.984 0.874 8 6 "[** * + * . -]" 1
540 1 43 PHE QD 1 44 ASP H . . 4.360 3.673 3.052 4.177 . 0 0 "[ . 1 . 2]" 1
541 1 43 PHE QD 1 50 THR HB . . 5.040 4.256 2.103 5.139 0.099 2 0 "[ . 1 . 2]" 1
542 1 43 PHE QD 1 50 THR MG . . 4.170 3.560 2.148 4.297 0.127 14 0 "[ . 1 . 2]" 1
543 1 43 PHE QD 1 53 ILE HB . . 4.210 3.464 2.438 4.311 0.101 1 0 "[ . 1 . 2]" 1
544 1 43 PHE QD 1 53 ILE MD . . 4.020 3.372 2.645 4.141 0.121 20 0 "[ . 1 . 2]" 1
545 1 43 PHE QD 1 53 ILE MG . . 3.580 2.926 2.074 3.706 0.126 20 0 "[ . 1 . 2]" 1
546 1 44 ASP H 1 44 ASP HB3 . . 3.720 3.012 2.673 3.517 . 0 0 "[ . 1 . 2]" 1
547 1 44 ASP H 1 50 THR HA . . 4.680 4.259 3.669 4.746 0.066 20 0 "[ . 1 . 2]" 1
548 1 44 ASP H 1 50 THR HB . . 4.280 4.298 3.948 4.364 0.084 15 0 "[ . 1 . 2]" 1
549 1 44 ASP H 1 50 THR MG . . 4.680 2.052 1.746 2.396 . 0 0 "[ . 1 . 2]" 1
550 1 44 ASP H 1 53 ILE MD . . 4.400 3.142 2.262 3.760 . 0 0 "[ . 1 . 2]" 1
551 1 44 ASP H 1 87 TRP HE1 . . 4.170 3.933 3.303 4.252 0.082 20 0 "[ . 1 . 2]" 1
552 1 44 ASP HA 1 45 ALA H . . 2.920 2.781 2.498 2.993 0.073 4 0 "[ . 1 . 2]" 1
553 1 44 ASP HA 1 45 ALA MB . . 4.290 4.061 3.759 4.301 0.011 8 0 "[ . 1 . 2]" 1
554 1 44 ASP HA 1 53 ILE MD . . 5.180 4.861 4.171 5.259 0.079 17 0 "[ . 1 . 2]" 1
555 1 44 ASP HB3 1 45 ALA H . . 4.480 3.076 2.048 3.994 . 0 0 "[ . 1 . 2]" 1
556 1 44 ASP HB3 1 46 ASP H . . 4.320 2.782 2.246 4.598 0.278 13 0 "[ . 1 . 2]" 1
557 1 44 ASP HB3 1 50 THR H . . 5.000 4.477 3.993 5.598 0.598 13 1 "[ . 1 + . 2]" 1
558 1 44 ASP HB3 1 53 ILE MD . . 4.790 3.830 3.096 4.841 0.051 4 0 "[ . 1 . 2]" 1
559 1 45 ALA H 1 45 ALA MB . . 2.900 2.503 2.236 2.834 . 0 0 "[ . 1 . 2]" 1
560 1 45 ALA H 1 46 ASP H . . 3.500 2.676 1.828 3.381 . 0 0 "[ . 1 . 2]" 1
561 1 45 ALA H 1 46 ASP HB3 . . 5.340 5.090 4.564 6.219 0.879 4 1 "[ +. 1 . 2]" 1
562 1 45 ALA H 1 87 TRP HE1 . . 5.500 5.005 3.756 5.576 0.076 12 0 "[ . 1 . 2]" 1
563 1 45 ALA H 1 87 TRP HZ2 . . 5.500 4.703 2.174 5.550 0.050 1 0 "[ . 1 . 2]" 1
564 1 45 ALA HA 1 46 ASP HA . . 4.710 4.691 4.454 4.785 0.075 4 0 "[ . 1 . 2]" 1
565 1 45 ALA HA 1 87 TRP HE1 . . 4.670 3.285 2.174 4.132 . 0 0 "[ . 1 . 2]" 1
566 1 45 ALA HA 1 87 TRP HZ2 . . 3.910 3.576 2.337 3.998 0.088 3 0 "[ . 1 . 2]" 1
567 1 45 ALA MB 1 46 ASP H . . 3.750 3.567 3.124 3.800 0.050 19 0 "[ . 1 . 2]" 1
568 1 45 ALA MB 1 46 ASP HB3 . . 5.060 5.639 5.212 6.006 0.946 4 13 "[***+* ** *.****-]" 1
569 1 45 ALA MB 1 87 TRP HE1 . . 5.500 4.634 3.002 5.501 0.001 13 0 "[ . 1 . 2]" 1
570 1 45 ALA MB 1 87 TRP HZ2 . . 4.690 4.489 3.694 4.800 0.110 9 0 "[ . 1 . 2]" 1
571 1 46 ASP H 1 46 ASP HB3 . . 3.470 2.815 2.466 3.443 . 0 0 "[ . 1 . 2]" 1
572 1 46 ASP H 1 49 LYS H . . 5.280 5.193 4.471 5.367 0.087 10 0 "[ . 1 . 2]" 1
573 1 46 ASP H 1 49 LYS HB3 . . 5.500 3.906 3.048 4.560 . 0 0 "[ . 1 . 2]" 1
574 1 46 ASP H 1 50 THR H . . 5.470 3.940 2.967 4.720 . 0 0 "[ . 1 . 2]" 1
575 1 46 ASP H 1 87 TRP HZ2 . . 5.500 5.204 4.027 5.591 0.091 13 0 "[ . 1 . 2]" 1
576 1 46 ASP HA 1 47 MET H . . 3.030 2.579 2.229 2.935 . 0 0 "[ . 1 . 2]" 1
577 1 46 ASP HA 1 47 MET HA . . 4.850 4.497 4.264 4.665 . 0 0 "[ . 1 . 2]" 1
578 1 46 ASP HA 1 47 MET HB3 . . 5.240 4.518 4.197 5.068 . 0 0 "[ . 1 . 2]" 1
579 1 46 ASP HB3 1 47 MET H . . 5.400 2.956 2.514 3.701 . 0 0 "[ . 1 . 2]" 1
580 1 46 ASP HB3 1 49 LYS H . . 3.960 2.599 2.062 2.888 . 0 0 "[ . 1 . 2]" 1
581 1 46 ASP HB3 1 49 LYS HB3 . . 3.780 2.371 2.045 2.973 . 0 0 "[ . 1 . 2]" 1
582 1 46 ASP HB3 1 50 THR H . . 5.160 2.677 1.779 3.722 . 0 0 "[ . 1 . 2]" 1
583 1 47 MET H 1 47 MET HB3 . . 3.620 2.732 2.149 3.311 . 0 0 "[ . 1 . 2]" 1
584 1 47 MET H 1 47 MET ME . . 4.920 3.871 2.435 4.355 . 0 0 "[ . 1 . 2]" 1
585 1 47 MET H 1 47 MET HG3 . . 4.160 3.559 2.163 4.532 0.372 17 0 "[ . 1 . 2]" 1
586 1 47 MET H 1 48 TYR H . . 3.650 2.286 1.771 2.995 . 0 0 "[ . 1 . 2]" 1
587 1 47 MET HA 1 47 MET ME . . 4.840 4.434 3.813 4.943 0.103 4 0 "[ . 1 . 2]" 1
588 1 47 MET HA 1 50 THR H . . 4.840 4.533 4.000 4.928 0.088 13 0 "[ . 1 . 2]" 1
589 1 47 MET HA 1 50 THR MG . . 4.980 4.786 4.167 5.082 0.102 20 0 "[ . 1 . 2]" 1
590 1 47 MET HB3 1 48 TYR H . . 4.190 3.524 2.211 4.271 0.081 11 0 "[ . 1 . 2]" 1
591 1 47 MET ME 1 47 MET HG3 . . 3.440 3.070 2.099 3.457 0.017 13 0 "[ . 1 . 2]" 1
592 1 47 MET ME 1 48 TYR H . . 4.800 3.821 2.592 4.741 . 0 0 "[ . 1 . 2]" 1
593 1 47 MET ME 1 48 TYR QD . . 4.260 2.814 1.961 4.111 . 0 0 "[ . 1 . 2]" 1
594 1 47 MET ME 1 48 TYR QE . . 3.620 3.483 2.442 3.739 0.119 14 0 "[ . 1 . 2]" 1
595 1 47 MET HG3 1 48 TYR H . . 4.440 3.244 1.882 4.479 0.039 6 0 "[ . 1 . 2]" 1
596 1 47 MET HG3 1 48 TYR HA . . 5.050 4.396 3.534 4.924 . 0 0 "[ . 1 . 2]" 1
597 1 47 MET HG3 1 48 TYR QD . . 5.160 3.299 2.158 5.545 0.385 9 0 "[ . 1 . 2]" 1
598 1 48 TYR H 1 48 TYR HB3 . . 3.130 2.992 2.572 3.202 0.072 6 0 "[ . 1 . 2]" 1
599 1 48 TYR H 1 48 TYR QD . . 3.700 2.563 2.011 3.008 . 0 0 "[ . 1 . 2]" 1
600 1 48 TYR H 1 48 TYR QE . . 5.070 3.851 3.628 4.168 . 0 0 "[ . 1 . 2]" 1
601 1 48 TYR H 1 49 LYS H . . 3.110 2.289 1.921 2.789 . 0 0 "[ . 1 . 2]" 1
602 1 48 TYR HA 1 48 TYR QD . . 3.760 3.759 3.648 3.797 0.037 2 0 "[ . 1 . 2]" 1
603 1 48 TYR HA 1 51 SER H . . 3.880 3.545 3.105 3.960 0.080 14 0 "[ . 1 . 2]" 1
604 1 48 TYR HB3 1 49 LYS H . . 4.110 4.142 3.994 4.191 0.081 7 0 "[ . 1 . 2]" 1
605 1 48 TYR QD 1 49 LYS H . . 4.510 2.968 2.487 3.387 . 0 0 "[ . 1 . 2]" 1
606 1 48 TYR QE 1 49 LYS H . . 5.380 3.892 3.488 4.236 . 0 0 "[ . 1 . 2]" 1
607 1 48 TYR QE 1 49 LYS HB3 . . 4.180 5.009 4.414 5.823 1.643 6 14 "[-***.+* ** * .*****]" 1
608 1 49 LYS H 1 49 LYS HB3 . . 3.570 2.773 2.562 3.059 . 0 0 "[ . 1 . 2]" 1
609 1 49 LYS H 1 50 THR H . . 3.390 2.857 2.634 3.168 . 0 0 "[ . 1 . 2]" 1
610 1 49 LYS H 1 50 THR MG . . 5.500 4.335 3.965 4.558 . 0 0 "[ . 1 . 2]" 1
611 1 49 LYS H 1 51 SER H . . 4.620 4.104 3.738 4.555 . 0 0 "[ . 1 . 2]" 1
612 1 49 LYS HA 1 49 LYS HG3 . . 3.750 2.607 2.255 3.082 . 0 0 "[ . 1 . 2]" 1
613 1 49 LYS HA 1 52 ASP H . . 3.890 3.767 3.601 3.959 0.069 15 0 "[ . 1 . 2]" 1
614 1 49 LYS HA 1 52 ASP HB3 . . 3.800 3.616 2.955 4.005 0.205 14 0 "[ . 1 . 2]" 1
615 1 49 LYS HA 1 53 ILE H . . 5.270 4.505 4.110 5.168 . 0 0 "[ . 1 . 2]" 1
616 1 49 LYS HA 1 53 ILE MD . . 4.790 4.377 3.709 4.874 0.084 1 0 "[ . 1 . 2]" 1
617 1 49 LYS HB3 1 50 THR H . . 3.890 2.496 2.253 2.677 . 0 0 "[ . 1 . 2]" 1
618 1 49 LYS HG3 1 50 THR H . . 5.500 4.192 3.691 4.638 . 0 0 "[ . 1 . 2]" 1
619 1 49 LYS HG3 1 53 ILE MD . . 3.150 2.608 2.098 3.591 0.441 8 0 "[ . 1 . 2]" 1
620 1 50 THR H 1 50 THR MG . . 4.410 2.198 1.833 2.439 . 0 0 "[ . 1 . 2]" 1
621 1 50 THR H 1 51 SER H . . 3.660 2.758 2.541 3.305 . 0 0 "[ . 1 . 2]" 1
622 1 50 THR H 1 53 ILE MD . . 5.260 3.981 3.271 4.396 . 0 0 "[ . 1 . 2]" 1
623 1 50 THR H 1 87 TRP HE1 . . 5.480 5.057 4.314 5.575 0.095 9 0 "[ . 1 . 2]" 1
624 1 50 THR HA 1 50 THR MG . . 3.480 2.315 2.200 2.564 . 0 0 "[ . 1 . 2]" 1
625 1 50 THR HB 1 53 ILE HB . . 4.640 4.314 3.707 4.715 0.075 11 0 "[ . 1 . 2]" 1
626 1 50 THR HB 1 53 ILE MD . . 4.200 4.004 3.297 4.294 0.094 11 0 "[ . 1 . 2]" 1
627 1 50 THR MG 1 51 SER H . . 4.460 4.154 3.991 4.359 . 0 0 "[ . 1 . 2]" 1
628 1 50 THR MG 1 53 ILE H . . 5.500 4.856 4.600 5.096 . 0 0 "[ . 1 . 2]" 1
629 1 50 THR MG 1 53 ILE HB . . 5.450 3.934 3.454 4.460 . 0 0 "[ . 1 . 2]" 1
630 1 50 THR MG 1 53 ILE MD . . 4.960 2.568 2.216 2.999 . 0 0 "[ . 1 . 2]" 1
631 1 50 THR MG 1 54 ALA H . . 5.340 5.110 4.700 5.408 0.068 3 0 "[ . 1 . 2]" 1
632 1 50 THR MG 1 54 ALA MB . . 5.110 5.014 4.481 5.248 0.138 15 0 "[ . 1 . 2]" 1
633 1 50 THR MG 1 87 TRP HD1 . . 4.610 3.700 2.803 4.431 . 0 0 "[ . 1 . 2]" 1
634 1 50 THR MG 1 87 TRP HE1 . . 4.490 2.018 1.630 2.315 . 0 0 "[ . 1 . 2]" 1
635 1 51 SER H 1 54 ALA MB . . 5.500 5.338 4.720 5.609 0.109 20 0 "[ . 1 . 2]" 1
636 1 51 SER HA 1 52 ASP H . . 3.520 3.536 3.311 3.587 0.067 4 0 "[ . 1 . 2]" 1
637 1 52 ASP H 1 52 ASP HB3 . . 3.350 2.649 2.464 3.030 . 0 0 "[ . 1 . 2]" 1
638 1 52 ASP H 1 53 ILE H . . 3.600 2.580 2.229 2.991 . 0 0 "[ . 1 . 2]" 1
639 1 52 ASP H 1 53 ILE MD . . 5.250 4.912 4.317 5.337 0.087 3 0 "[ . 1 . 2]" 1
640 1 52 ASP H 1 54 ALA H . . 4.740 4.359 3.930 4.692 . 0 0 "[ . 1 . 2]" 1
641 1 52 ASP HA 1 55 LEU H . . 4.300 3.689 3.393 4.155 . 0 0 "[ . 1 . 2]" 1
642 1 52 ASP HA 1 55 LEU HB3 . . 3.730 2.787 2.399 3.348 . 0 0 "[ . 1 . 2]" 1
643 1 52 ASP HA 1 55 LEU QD . . 3.910 3.421 3.000 3.891 . 0 0 "[ . 1 . 2]" 1
644 1 52 ASP HA 1 55 LEU HG . . 4.960 4.567 3.930 5.036 0.076 8 0 "[ . 1 . 2]" 1
645 1 52 ASP HB3 1 53 ILE H . . 3.720 2.477 2.162 3.044 . 0 0 "[ . 1 . 2]" 1
646 1 53 ILE H 1 53 ILE HB . . 3.180 2.637 2.530 2.897 . 0 0 "[ . 1 . 2]" 1
647 1 53 ILE H 1 53 ILE MD . . 3.550 3.408 3.167 3.602 0.052 10 0 "[ . 1 . 2]" 1
648 1 53 ILE H 1 53 ILE HG13 . . 3.440 2.066 1.837 2.396 . 0 0 "[ . 1 . 2]" 1
649 1 53 ILE H 1 53 ILE MG . . 4.000 3.814 3.778 3.864 . 0 0 "[ . 1 . 2]" 1
650 1 53 ILE H 1 54 ALA H . . 3.370 2.941 2.652 3.127 . 0 0 "[ . 1 . 2]" 1
651 1 53 ILE H 1 54 ALA MB . . 5.180 4.644 4.330 4.895 . 0 0 "[ . 1 . 2]" 1
652 1 53 ILE HA 1 53 ILE HG13 . . 3.850 2.990 2.835 3.321 . 0 0 "[ . 1 . 2]" 1
653 1 53 ILE HA 1 53 ILE MG . . 3.230 2.402 2.261 2.586 . 0 0 "[ . 1 . 2]" 1
654 1 53 ILE HA 1 55 LEU H . . 4.680 4.375 3.825 4.749 0.069 9 0 "[ . 1 . 2]" 1
655 1 53 ILE HA 1 55 LEU HB3 . . 5.430 5.385 5.059 5.506 0.076 18 0 "[ . 1 . 2]" 1
656 1 53 ILE HA 1 56 ASP H . . 4.160 3.670 3.138 4.070 . 0 0 "[ . 1 . 2]" 1
657 1 53 ILE HA 1 56 ASP HB3 . . 4.220 3.487 2.769 4.295 0.075 18 0 "[ . 1 . 2]" 1
658 1 53 ILE HB 1 54 ALA H . . 3.510 2.489 2.289 2.722 . 0 0 "[ . 1 . 2]" 1
659 1 53 ILE HB 1 55 LEU H . . 5.210 4.867 4.654 5.111 . 0 0 "[ . 1 . 2]" 1
660 1 53 ILE MD 1 54 ALA H . . 4.620 4.330 4.108 4.541 . 0 0 "[ . 1 . 2]" 1
661 1 53 ILE HG13 1 54 ALA H . . 5.500 4.293 3.773 4.504 . 0 0 "[ . 1 . 2]" 1
662 1 53 ILE MG 1 54 ALA H . . 3.990 3.372 2.906 3.711 . 0 0 "[ . 1 . 2]" 1
663 1 53 ILE MG 1 54 ALA HA . . 4.250 3.389 2.761 3.878 . 0 0 "[ . 1 . 2]" 1
664 1 53 ILE MG 1 55 LEU H . . 5.500 4.941 4.528 5.292 . 0 0 "[ . 1 . 2]" 1
665 1 53 ILE MG 1 57 GLN H . . 5.500 4.505 3.894 4.986 . 0 0 "[ . 1 . 2]" 1
666 1 53 ILE MG 1 57 GLN QE . . 3.990 3.720 2.776 4.117 0.127 2 0 "[ . 1 . 2]" 1
667 1 54 ALA H 1 54 ALA MB . . 3.020 2.250 2.178 2.376 . 0 0 "[ . 1 . 2]" 1
668 1 54 ALA H 1 55 LEU H . . 3.470 2.658 2.459 2.801 . 0 0 "[ . 1 . 2]" 1
669 1 54 ALA H 1 56 ASP H . . 4.660 4.291 4.123 4.474 . 0 0 "[ . 1 . 2]" 1
670 1 54 ALA HA 1 56 ASP H . . 4.380 4.377 4.202 4.451 0.071 5 0 "[ . 1 . 2]" 1
671 1 54 ALA HA 1 57 GLN H . . 4.230 3.495 3.213 3.918 . 0 0 "[ . 1 . 2]" 1
672 1 54 ALA HA 1 57 GLN HB3 . . 3.790 4.705 4.276 5.038 1.248 15 19 "[****** *******+*-***]" 1
673 1 54 ALA MB 1 55 LEU H . . 3.290 2.817 2.464 3.339 0.049 8 0 "[ . 1 . 2]" 1
674 1 54 ALA MB 1 55 LEU HA . . 5.290 3.927 3.509 4.295 . 0 0 "[ . 1 . 2]" 1
675 1 54 ALA MB 1 56 ASP H . . 4.870 4.681 4.506 4.884 0.014 8 0 "[ . 1 . 2]" 1
676 1 54 ALA MB 1 57 GLN HB3 . . 5.160 5.641 5.230 6.023 0.863 5 10 "[** + *-1* ** **]" 1
677 1 54 ALA MB 1 58 ILE MD . . 4.590 2.828 2.057 3.904 . 0 0 "[ . 1 . 2]" 1
678 1 54 ALA MB 1 92 ALA HA . . 4.920 3.276 2.296 3.915 . 0 0 "[ . 1 . 2]" 1
679 1 54 ALA MB 1 93 THR H . . 4.860 4.521 4.010 4.955 0.095 17 0 "[ . 1 . 2]" 1
680 1 54 ALA MB 1 93 THR MG . . 3.430 3.536 3.422 3.563 0.133 6 0 "[ . 1 . 2]" 1
681 1 55 LEU H 1 55 LEU HB3 . . 3.330 2.599 2.401 3.131 . 0 0 "[ . 1 . 2]" 1
682 1 55 LEU H 1 55 LEU QD . . 4.120 3.702 3.589 3.798 . 0 0 "[ . 1 . 2]" 1
683 1 55 LEU H 1 56 ASP H . . 3.320 2.600 2.163 2.885 . 0 0 "[ . 1 . 2]" 1
684 1 55 LEU H 1 58 ILE MD . . 5.500 3.890 3.276 4.505 . 0 0 "[ . 1 . 2]" 1
685 1 55 LEU HA 1 55 LEU QD . . 3.210 2.093 2.008 2.160 . 0 0 "[ . 1 . 2]" 1
686 1 55 LEU HA 1 55 LEU HG . . 4.060 3.282 2.678 3.745 . 0 0 "[ . 1 . 2]" 1
687 1 55 LEU HA 1 57 GLN H . . 4.870 4.361 3.815 4.763 . 0 0 "[ . 1 . 2]" 1
688 1 55 LEU HA 1 58 ILE H . . 4.550 3.466 3.194 3.714 . 0 0 "[ . 1 . 2]" 1
689 1 55 LEU HA 1 58 ILE HB . . 3.490 2.472 2.251 2.766 . 0 0 "[ . 1 . 2]" 1
690 1 55 LEU HA 1 58 ILE MD . . 3.600 2.205 2.028 2.387 . 0 0 "[ . 1 . 2]" 1
691 1 55 LEU HA 1 58 ILE MG . . 4.090 3.757 3.517 4.153 0.063 5 0 "[ . 1 . 2]" 1
692 1 55 LEU HA 1 59 GLN H . . 4.640 3.923 3.636 4.142 . 0 0 "[ . 1 . 2]" 1
693 1 55 LEU HB3 1 56 ASP H . . 3.720 2.609 2.363 2.821 . 0 0 "[ . 1 . 2]" 1
694 1 55 LEU HB3 1 59 GLN HE21 . . 5.200 4.354 3.442 5.272 0.072 9 0 "[ . 1 . 2]" 1
695 1 55 LEU HB3 1 59 GLN HE22 . . 5.500 5.318 4.230 5.587 0.087 4 0 "[ . 1 . 2]" 1
696 1 55 LEU QD 1 56 ASP H . . 5.500 3.634 2.989 4.152 . 0 0 "[ . 1 . 2]" 1
697 1 55 LEU QD 1 58 ILE MD . . 3.770 2.932 2.296 3.313 . 0 0 "[ . 1 . 2]" 1
698 1 55 LEU QD 1 58 ILE MG . . 3.450 2.990 2.516 3.290 . 0 0 "[ . 1 . 2]" 1
699 1 55 LEU QD 1 59 GLN H . . 5.170 3.290 2.691 3.781 . 0 0 "[ . 1 . 2]" 1
700 1 55 LEU QD 1 59 GLN HE21 . . 4.500 2.221 1.600 3.278 . 0 0 "[ . 1 . 2]" 1
701 1 55 LEU QD 1 59 GLN HE22 . . 4.890 2.549 2.134 3.110 . 0 0 "[ . 1 . 2]" 1
702 1 55 LEU QD 1 59 GLN HG3 . . 4.830 2.171 1.971 2.473 . 0 0 "[ . 1 . 2]" 1
703 1 55 LEU HG 1 56 ASP H . . 4.950 4.561 3.808 5.033 0.083 13 0 "[ . 1 . 2]" 1
704 1 55 LEU HG 1 59 GLN HE21 . . 5.500 3.403 1.753 5.412 . 0 0 "[ . 1 . 2]" 1
705 1 55 LEU HG 1 59 GLN HE22 . . 5.500 4.116 2.780 5.575 0.075 15 0 "[ . 1 . 2]" 1
706 1 56 ASP H 1 56 ASP HB3 . . 3.430 2.686 2.181 3.474 0.044 20 0 "[ . 1 . 2]" 1
707 1 56 ASP H 1 57 GLN H . . 3.420 2.741 2.573 2.874 . 0 0 "[ . 1 . 2]" 1
708 1 56 ASP H 1 57 GLN HG3 . . 4.880 4.440 3.969 4.954 0.074 17 0 "[ . 1 . 2]" 1
709 1 56 ASP H 1 59 GLN H . . 5.270 4.945 4.726 5.327 0.057 1 0 "[ . 1 . 2]" 1
710 1 56 ASP HA 1 59 GLN H . . 4.240 3.868 3.534 4.251 0.011 18 0 "[ . 1 . 2]" 1
711 1 56 ASP HA 1 59 GLN HB3 . . 4.100 5.244 4.761 5.869 1.769 18 20 [**-**************+**] 1
712 1 56 ASP HA 1 59 GLN HE21 . . 5.120 4.191 2.876 5.199 0.079 12 0 "[ . 1 . 2]" 1
713 1 56 ASP HA 1 61 ASN QD . . 3.090 2.499 1.926 3.044 . 0 0 "[ . 1 . 2]" 1
714 1 56 ASP HB3 1 57 GLN H . . 4.150 2.991 2.411 4.012 . 0 0 "[ . 1 . 2]" 1
715 1 56 ASP HB3 1 62 LYS HG3 . . 4.460 3.642 2.347 4.838 0.378 8 0 "[ . 1 . 2]" 1
716 1 57 GLN H 1 57 GLN HB3 . . 3.900 3.618 3.531 3.717 . 0 0 "[ . 1 . 2]" 1
717 1 57 GLN H 1 57 GLN QE . . 5.500 4.834 3.873 5.098 . 0 0 "[ . 1 . 2]" 1
718 1 57 GLN H 1 57 GLN HG3 . . 3.230 2.323 2.067 3.011 . 0 0 "[ . 1 . 2]" 1
719 1 57 GLN H 1 58 ILE H . . 3.520 2.688 2.434 2.872 . 0 0 "[ . 1 . 2]" 1
720 1 57 GLN H 1 58 ILE HB . . 5.020 4.643 4.386 5.032 0.012 8 0 "[ . 1 . 2]" 1
721 1 57 GLN HA 1 62 LYS H . . 3.540 3.205 2.601 3.623 0.083 1 0 "[ . 1 . 2]" 1
722 1 57 GLN HA 1 62 LYS HB3 . . 4.550 3.630 2.836 4.065 . 0 0 "[ . 1 . 2]" 1
723 1 57 GLN HB3 1 57 GLN QE . . 4.540 3.299 2.357 4.004 . 0 0 "[ . 1 . 2]" 1
724 1 57 GLN HB3 1 58 ILE H . . 4.110 4.231 3.583 4.543 0.433 12 0 "[ . 1 . 2]" 1
725 1 57 GLN HB3 1 58 ILE MD . . 5.500 5.798 5.508 6.220 0.720 16 3 "[ . * 1 .+ -2]" 1
726 1 57 GLN HB3 1 64 PHE HA . . 4.700 3.159 2.898 3.538 . 0 0 "[ . 1 . 2]" 1
727 1 57 GLN HB3 1 65 PRO HD3 . . 5.140 3.807 3.106 4.667 . 0 0 "[ . 1 . 2]" 1
728 1 57 GLN HB3 1 93 THR MG . . 3.740 3.656 2.677 4.346 0.606 20 1 "[ . 1 . +]" 1
729 1 57 GLN QE 1 62 LYS HB3 . . 5.380 4.154 3.134 5.458 0.078 20 0 "[ . 1 . 2]" 1
730 1 57 GLN QE 1 64 PHE HA . . 4.750 3.069 2.174 4.129 . 0 0 "[ . 1 . 2]" 1
731 1 57 GLN QE 1 65 PRO HB3 . . 4.920 2.998 2.181 3.995 . 0 0 "[ . 1 . 2]" 1
732 1 57 GLN HG3 1 62 LYS HB3 . . 4.950 3.920 2.947 5.030 0.080 17 0 "[ . 1 . 2]" 1
733 1 58 ILE H 1 58 ILE HB . . 3.070 2.405 2.219 2.529 . 0 0 "[ . 1 . 2]" 1
734 1 58 ILE H 1 58 ILE MD . . 4.690 3.654 3.112 4.095 . 0 0 "[ . 1 . 2]" 1
735 1 58 ILE H 1 58 ILE HG13 . . 4.440 2.825 2.254 3.305 . 0 0 "[ . 1 . 2]" 1
736 1 58 ILE H 1 58 ILE MG . . 3.820 3.768 3.692 3.848 0.028 8 0 "[ . 1 . 2]" 1
737 1 58 ILE HA 1 58 ILE MD . . 4.150 3.863 3.793 3.940 . 0 0 "[ . 1 . 2]" 1
738 1 58 ILE HA 1 58 ILE HG13 . . 3.760 2.712 2.490 2.894 . 0 0 "[ . 1 . 2]" 1
739 1 58 ILE HA 1 58 ILE MG . . 3.350 2.603 2.474 2.773 . 0 0 "[ . 1 . 2]" 1
740 1 58 ILE HA 1 60 GLY H . . 5.060 3.997 3.745 4.239 . 0 0 "[ . 1 . 2]" 1
741 1 58 ILE HA 1 130 TRP HZ2 . . 5.120 2.780 2.001 4.921 . 0 0 "[ . 1 . 2]" 1
742 1 58 ILE HB 1 58 ILE MD . . 2.940 2.297 2.232 2.395 . 0 0 "[ . 1 . 2]" 1
743 1 58 ILE HB 1 59 GLN H . . 3.570 2.538 2.355 2.766 . 0 0 "[ . 1 . 2]" 1
744 1 58 ILE HB 1 59 GLN HG3 . . 5.060 3.380 2.752 3.852 . 0 0 "[ . 1 . 2]" 1
745 1 58 ILE HB 1 130 TRP HZ2 . . 4.750 4.458 4.146 4.828 0.078 11 0 "[ . 1 . 2]" 1
746 1 58 ILE MD 1 58 ILE MG . . 3.340 2.127 2.035 2.268 . 0 0 "[ . 1 . 2]" 1
747 1 58 ILE MD 1 59 GLN H . . 5.480 4.432 4.232 4.619 . 0 0 "[ . 1 . 2]" 1
748 1 58 ILE MD 1 90 TYR H . . 5.500 5.515 5.288 5.610 0.110 4 0 "[ . 1 . 2]" 1
749 1 58 ILE MD 1 90 TYR HB3 . . 4.170 3.637 2.288 4.407 0.237 9 0 "[ . 1 . 2]" 1
750 1 58 ILE MD 1 90 TYR QD . . 4.370 3.048 2.481 3.738 . 0 0 "[ . 1 . 2]" 1
751 1 58 ILE MD 1 93 THR MG . . 3.710 3.646 2.753 3.856 0.146 13 0 "[ . 1 . 2]" 1
752 1 58 ILE MD 1 130 TRP HZ2 . . 3.980 3.782 2.209 4.084 0.104 1 0 "[ . 1 . 2]" 1
753 1 58 ILE HG13 1 93 THR MG . . 4.770 3.359 2.734 3.863 . 0 0 "[ . 1 . 2]" 1
754 1 58 ILE HG13 1 130 TRP HE1 . . 5.500 4.811 3.496 6.089 0.589 4 2 "[ +. 1 . - 2]" 1
755 1 58 ILE HG13 1 130 TRP HZ2 . . 3.850 3.835 2.668 4.738 0.888 18 3 "[ . -1* . + 2]" 1
756 1 58 ILE MG 1 59 GLN H . . 4.430 3.068 2.804 3.399 . 0 0 "[ . 1 . 2]" 1
757 1 58 ILE MG 1 59 GLN HA . . 4.040 3.001 2.664 3.498 . 0 0 "[ . 1 . 2]" 1
758 1 58 ILE MG 1 59 GLN HE21 . . 5.500 5.179 4.561 5.584 0.084 19 0 "[ . 1 . 2]" 1
759 1 58 ILE MG 1 59 GLN HG3 . . 4.480 3.070 2.479 3.603 . 0 0 "[ . 1 . 2]" 1
760 1 58 ILE MG 1 60 GLY H . . 5.500 4.545 4.360 4.763 . 0 0 "[ . 1 . 2]" 1
761 1 58 ILE MG 1 130 TRP HE1 . . 5.500 3.550 2.567 4.285 . 0 0 "[ . 1 . 2]" 1
762 1 58 ILE MG 1 130 TRP HZ2 . . 4.550 2.356 2.065 3.387 . 0 0 "[ . 1 . 2]" 1
763 1 59 GLN H 1 59 GLN HB3 . . 3.480 3.568 3.502 3.631 0.151 14 0 "[ . 1 . 2]" 1
764 1 59 GLN H 1 59 GLN HE21 . . 5.500 4.031 3.584 4.490 . 0 0 "[ . 1 . 2]" 1
765 1 59 GLN H 1 59 GLN HG3 . . 4.060 2.578 2.238 3.085 . 0 0 "[ . 1 . 2]" 1
766 1 59 GLN H 1 60 GLY H . . 3.530 2.910 2.602 3.155 . 0 0 "[ . 1 . 2]" 1
767 1 59 GLN H 1 60 GLY QA . . 5.310 4.756 4.513 4.981 . 0 0 "[ . 1 . 2]" 1
768 1 59 GLN HA 1 59 GLN HG3 . . 3.200 3.009 2.714 3.271 0.071 20 0 "[ . 1 . 2]" 1
769 1 59 GLN HA 1 61 ASN H . . 4.960 4.656 4.258 5.027 0.067 5 0 "[ . 1 . 2]" 1
770 1 59 GLN HB3 1 61 ASN QD . . 4.610 3.556 2.849 4.378 . 0 0 "[ . 1 . 2]" 1
771 1 60 GLY H 1 61 ASN H . . 3.340 2.386 1.929 2.769 . 0 0 "[ . 1 . 2]" 1
772 1 60 GLY H 1 62 LYS H . . 4.830 3.771 3.293 4.186 . 0 0 "[ . 1 . 2]" 1
773 1 60 GLY QA 1 61 ASN HA . . 4.730 4.163 4.088 4.288 . 0 0 "[ . 1 . 2]" 1
774 1 60 GLY QA 1 62 LYS H . . 4.740 3.815 3.058 4.802 0.062 19 0 "[ . 1 . 2]" 1
775 1 61 ASN H 1 61 ASN HB3 . . 3.880 3.640 3.548 3.801 . 0 0 "[ . 1 . 2]" 1
776 1 61 ASN H 1 61 ASN QD . . 5.020 3.637 2.064 4.216 . 0 0 "[ . 1 . 2]" 1
777 1 61 ASN H 1 62 LYS H . . 3.110 2.457 2.160 2.847 . 0 0 "[ . 1 . 2]" 1
778 1 61 ASN H 1 62 LYS HA . . 5.500 5.106 4.727 5.416 . 0 0 "[ . 1 . 2]" 1
779 1 61 ASN HB3 1 62 LYS H . . 4.660 3.740 3.194 4.320 . 0 0 "[ . 1 . 2]" 1
780 1 61 ASN HB3 1 62 LYS HG3 . . 5.200 4.993 3.654 5.274 0.074 9 0 "[ . 1 . 2]" 1
781 1 62 LYS H 1 62 LYS HB3 . . 4.120 3.545 3.205 3.849 . 0 0 "[ . 1 . 2]" 1
782 1 62 LYS H 1 62 LYS HG3 . . 4.540 4.366 3.510 4.607 0.067 7 0 "[ . 1 . 2]" 1
783 1 62 LYS H 1 63 ASP H . . 4.730 4.371 4.239 4.472 . 0 0 "[ . 1 . 2]" 1
784 1 62 LYS HA 1 63 ASP H . . 2.810 2.427 2.095 2.810 . 0 0 "[ . 1 . 2]" 1
785 1 62 LYS HA 1 63 ASP HB3 . . 5.090 4.909 4.333 5.686 0.596 18 1 "[ . 1 . + 2]" 1
786 1 62 LYS HB3 1 63 ASP H . . 3.380 2.352 1.776 2.898 . 0 0 "[ . 1 . 2]" 1
787 1 63 ASP H 1 63 ASP HB3 . . 3.140 2.897 2.481 3.584 0.444 4 0 "[ . 1 . 2]" 1
788 1 63 ASP HA 1 64 PHE H . . 3.030 2.606 2.300 3.076 0.046 8 0 "[ . 1 . 2]" 1
789 1 63 ASP HB3 1 64 PHE H . . 3.850 3.151 1.981 3.799 . 0 0 "[ . 1 . 2]" 1
790 1 64 PHE H 1 64 PHE QD . . 3.850 2.798 1.898 3.291 . 0 0 "[ . 1 . 2]" 1
791 1 64 PHE H 1 64 PHE QE . . 4.740 4.122 3.647 4.837 0.097 20 0 "[ . 1 . 2]" 1
792 1 64 PHE HA 1 64 PHE QD . . 4.190 3.688 2.119 3.813 . 0 0 "[ . 1 . 2]" 1
793 1 64 PHE HA 1 65 PRO HD3 . . 3.590 2.446 2.212 2.611 . 0 0 "[ . 1 . 2]" 1
794 1 64 PHE QD 1 65 PRO HA . . 5.020 4.537 3.931 5.139 0.119 20 0 "[ . 1 . 2]" 1
795 1 64 PHE QD 1 96 LYS HE3 . . 5.140 4.177 3.135 5.344 0.204 4 0 "[ . 1 . 2]" 1
796 1 65 PRO HA 1 66 GLU H . . 2.650 2.306 2.077 2.702 0.052 18 0 "[ . 1 . 2]" 1
797 1 65 PRO HA 1 66 GLU HG3 . . 4.620 4.708 3.418 5.853 1.233 7 7 "[ . + * ** .- **2]" 1
798 1 66 GLU H 1 66 GLU HB3 . . 3.060 3.243 2.552 3.706 0.646 6 8 "[ * *.+ - 1 ** * *]" 1
799 1 66 GLU H 1 66 GLU HG3 . . 3.610 2.965 2.432 3.681 0.071 3 0 "[ . 1 . 2]" 1
800 1 66 GLU H 1 67 ILE H . . 4.570 4.557 4.401 4.643 0.073 1 0 "[ . 1 . 2]" 1
801 1 66 GLU H 1 67 ILE MG . . 5.500 4.963 4.243 5.350 . 0 0 "[ . 1 . 2]" 1
802 1 66 GLU H 1 97 THR MG . . 5.500 4.789 4.410 5.227 . 0 0 "[ . 1 . 2]" 1
803 1 66 GLU HA 1 67 ILE H . . 2.770 2.437 2.137 2.696 . 0 0 "[ . 1 . 2]" 1
804 1 66 GLU HA 1 67 ILE HA . . 5.230 4.505 4.421 4.579 . 0 0 "[ . 1 . 2]" 1
805 1 66 GLU HA 1 67 ILE MG . . 4.330 3.670 3.082 4.152 . 0 0 "[ . 1 . 2]" 1
806 1 66 GLU HA 1 97 THR MG . . 3.370 2.388 2.074 3.008 . 0 0 "[ . 1 . 2]" 1
807 1 66 GLU HB3 1 67 ILE H . . 4.310 3.220 2.121 4.133 . 0 0 "[ . 1 . 2]" 1
808 1 66 GLU HG3 1 67 ILE H . . 5.110 4.251 2.851 5.176 0.066 8 0 "[ . 1 . 2]" 1
809 1 67 ILE H 1 67 ILE MD . . 4.040 3.959 3.701 4.119 0.079 18 0 "[ . 1 . 2]" 1
810 1 67 ILE H 1 67 ILE MG . . 3.670 2.988 2.676 3.311 . 0 0 "[ . 1 . 2]" 1
811 1 67 ILE H 1 68 GLN H . . 5.060 4.435 4.270 4.554 . 0 0 "[ . 1 . 2]" 1
812 1 67 ILE H 1 97 THR HB . . 5.350 4.095 2.878 4.960 . 0 0 "[ . 1 . 2]" 1
813 1 67 ILE H 1 101 GLN HE22 . . 5.500 5.377 4.269 6.485 0.985 16 1 "[ . 1 .+ 2]" 1
814 1 67 ILE HA 1 67 ILE MD . . 4.480 4.221 4.174 4.262 . 0 0 "[ . 1 . 2]" 1
815 1 67 ILE HA 1 67 ILE MG . . 3.180 2.298 2.224 2.376 . 0 0 "[ . 1 . 2]" 1
816 1 67 ILE HA 1 68 GLN H . . 2.940 2.301 2.171 2.506 . 0 0 "[ . 1 . 2]" 1
817 1 67 ILE HA 1 68 GLN HB3 . . 4.880 5.537 4.537 5.781 0.901 16 19 "[***-********* *+****]" 1
818 1 67 ILE HA 1 68 GLN HG3 . . 5.110 4.519 3.228 5.035 . 0 0 "[ . 1 . 2]" 1
819 1 67 ILE HB 1 67 ILE MD . . 3.200 2.404 2.293 2.494 . 0 0 "[ . 1 . 2]" 1
820 1 67 ILE HB 1 68 GLN H . . 3.000 2.570 2.350 2.940 . 0 0 "[ . 1 . 2]" 1
821 1 67 ILE MD 1 68 GLN H . . 4.640 4.422 4.095 4.707 0.067 2 0 "[ . 1 . 2]" 1
822 1 67 ILE MD 1 68 GLN HA . . 5.500 5.357 4.951 5.599 0.099 17 0 "[ . 1 . 2]" 1
823 1 67 ILE MD 1 69 LEU HB3 . . 4.380 2.889 2.204 4.200 . 0 0 "[ . 1 . 2]" 1
824 1 67 ILE MD 1 97 THR HB . . 4.190 3.054 2.103 3.818 . 0 0 "[ . 1 . 2]" 1
825 1 67 ILE MD 1 98 LEU H . . 3.950 3.318 2.447 3.753 . 0 0 "[ . 1 . 2]" 1
826 1 67 ILE MD 1 98 LEU HA . . 3.290 2.568 2.184 3.241 . 0 0 "[ . 1 . 2]" 1
827 1 67 ILE MD 1 101 GLN HE21 . . 4.820 3.147 2.031 4.171 . 0 0 "[ . 1 . 2]" 1
828 1 67 ILE MD 1 101 GLN HE22 . . 4.430 2.717 1.736 4.877 0.447 16 0 "[ . 1 . 2]" 1
829 1 67 ILE MD 1 101 GLN HG3 . . 5.020 4.067 2.795 4.851 . 0 0 "[ . 1 . 2]" 1
830 1 67 ILE MG 1 68 GLN H . . 3.850 3.680 3.504 3.905 0.055 2 0 "[ . 1 . 2]" 1
831 1 67 ILE MG 1 97 THR H . . 4.870 3.821 3.242 4.241 . 0 0 "[ . 1 . 2]" 1
832 1 67 ILE MG 1 97 THR HB . . 3.450 2.255 1.976 2.569 . 0 0 "[ . 1 . 2]" 1
833 1 67 ILE MG 1 98 LEU H . . 4.430 3.408 2.583 4.229 . 0 0 "[ . 1 . 2]" 1
834 1 67 ILE MG 1 98 LEU HA . . 5.010 4.223 3.251 5.090 0.080 2 0 "[ . 1 . 2]" 1
835 1 68 GLN H 1 68 GLN HB3 . . 3.720 3.691 3.224 3.760 0.040 1 0 "[ . 1 . 2]" 1
836 1 68 GLN H 1 68 GLN HG3 . . 3.980 3.435 2.536 3.970 . 0 0 "[ . 1 . 2]" 1
837 1 68 GLN H 1 69 LEU H . . 4.210 3.179 2.627 4.275 0.065 14 0 "[ . 1 . 2]" 1
838 1 68 GLN HA 1 68 GLN HG3 . . 3.480 3.680 3.020 4.029 0.549 20 2 "[- . 1 . +]" 1
839 1 68 GLN HA 1 69 LEU H . . 2.880 2.555 1.966 2.973 0.093 18 0 "[ . 1 . 2]" 1
840 1 68 GLN HB3 1 69 LEU H . . 4.640 4.286 3.512 4.560 . 0 0 "[ . 1 . 2]" 1
841 1 68 GLN HG3 1 69 LEU H . . 4.930 5.489 4.447 5.852 0.922 4 13 "[**-+** **1 ** * * *]" 1
842 1 69 LEU H 1 69 LEU HB3 . . 3.590 3.042 2.561 3.717 0.127 10 0 "[ . 1 . 2]" 1
843 1 69 LEU H 1 69 LEU MD1 . . 4.170 4.135 2.180 4.294 0.124 18 0 "[ . 1 . 2]" 1
844 1 69 LEU H 1 69 LEU QD . . 4.330 3.742 2.174 4.003 . 0 0 "[ . 1 . 2]" 1
845 1 69 LEU HA 1 69 LEU MD1 . . 3.830 2.939 2.034 3.856 0.026 20 0 "[ . 1 . 2]" 1
846 1 69 LEU HA 1 70 ASP H . . 2.720 2.374 1.952 2.797 0.077 7 0 "[ . 1 . 2]" 1
847 1 69 LEU HB3 1 69 LEU MD1 . . 3.330 2.728 2.210 3.277 . 0 0 "[ . 1 . 2]" 1
848 1 69 LEU HB3 1 70 ASP H . . 3.970 3.214 2.224 3.943 . 0 0 "[ . 1 . 2]" 1
849 1 69 LEU QD 1 70 ASP H . . 3.820 2.125 1.608 3.306 . 0 0 "[ . 1 . 2]" 1
850 1 69 LEU MD1 1 70 ASP H . . 4.810 2.927 1.612 4.260 . 0 0 "[ . 1 . 2]" 1
851 1 69 LEU MD2 1 70 ASP H . . 3.750 2.923 1.669 4.233 0.483 3 0 "[ . 1 . 2]" 1
852 1 69 LEU MD2 1 70 ASP HA . . 5.500 5.069 4.063 5.909 0.409 2 0 "[ . 1 . 2]" 1
853 1 70 ASP H 1 70 ASP HB3 . . 3.670 3.495 2.946 3.729 0.059 12 0 "[ . 1 . 2]" 1
854 1 70 ASP HA 1 70 ASP HB3 . . 2.920 2.616 2.302 2.969 0.049 9 0 "[ . 1 . 2]" 1
855 1 70 ASP HA 1 71 ASN H . . 2.630 2.485 2.352 2.688 0.058 17 0 "[ . 1 . 2]" 1
856 1 70 ASP HB3 1 71 ASN H . . 2.780 2.507 2.081 2.862 0.082 9 0 "[ . 1 . 2]" 1
857 1 70 ASP HB3 1 72 ILE MD . . 5.240 3.965 2.832 5.204 . 0 0 "[ . 1 . 2]" 1
858 1 71 ASN H 1 71 ASN HB3 . . 3.080 2.715 2.486 3.099 0.019 9 0 "[ . 1 . 2]" 1
859 1 71 ASN H 1 71 ASN HD21 . . 5.130 4.767 4.268 5.121 . 0 0 "[ . 1 . 2]" 1
860 1 71 ASN H 1 72 ILE H . . 4.630 4.454 4.239 4.667 0.037 12 0 "[ . 1 . 2]" 1
861 1 71 ASN H 1 72 ILE HG13 . . 4.480 4.117 3.650 4.559 0.079 3 0 "[ . 1 . 2]" 1
862 1 71 ASN HA 1 72 ILE H . . 2.610 2.136 2.024 2.254 . 0 0 "[ . 1 . 2]" 1
863 1 71 ASN HA 1 72 ILE MD . . 4.820 4.891 4.746 4.936 0.116 5 0 "[ . 1 . 2]" 1
864 1 71 ASN HA 1 72 ILE HG13 . . 4.940 3.845 3.623 4.052 . 0 0 "[ . 1 . 2]" 1
865 1 71 ASN HA 1 72 ILE MG . . 5.500 5.426 5.293 5.547 0.047 13 0 "[ . 1 . 2]" 1
866 1 71 ASN HD21 1 72 ILE H . . 4.030 3.780 3.022 4.109 0.079 4 0 "[ . 1 . 2]" 1
867 1 71 ASN HD22 1 72 ILE H . . 4.820 4.041 3.513 4.693 . 0 0 "[ . 1 . 2]" 1
868 1 72 ILE H 1 72 ILE HB . . 3.210 2.675 2.473 2.910 . 0 0 "[ . 1 . 2]" 1
869 1 72 ILE H 1 72 ILE MD . . 4.320 4.165 3.848 4.374 0.054 10 0 "[ . 1 . 2]" 1
870 1 72 ILE H 1 72 ILE HG13 . . 3.780 3.192 2.955 3.301 . 0 0 "[ . 1 . 2]" 1
871 1 72 ILE H 1 72 ILE MG . . 4.100 3.858 3.720 4.019 . 0 0 "[ . 1 . 2]" 1
872 1 72 ILE H 1 73 ASP H . . 4.490 4.317 4.182 4.490 0.000 20 0 "[ . 1 . 2]" 1
873 1 72 ILE HA 1 72 ILE MD . . 3.950 3.875 3.775 3.976 0.026 16 0 "[ . 1 . 2]" 1
874 1 72 ILE HA 1 72 ILE HG13 . . 3.890 2.925 2.683 3.157 . 0 0 "[ . 1 . 2]" 1
875 1 72 ILE HA 1 72 ILE MG . . 3.140 2.513 2.368 2.656 . 0 0 "[ . 1 . 2]" 1
876 1 72 ILE HA 1 73 ASP H . . 2.710 2.239 2.080 2.425 . 0 0 "[ . 1 . 2]" 1
877 1 72 ILE HA 1 73 ASP HB3 . . 4.280 5.332 4.218 5.664 1.384 8 16 "[** **-*+*1** ***** *]" 1
878 1 72 ILE HB 1 72 ILE MD . . 2.950 2.401 2.314 2.532 . 0 0 "[ . 1 . 2]" 1
879 1 72 ILE HB 1 73 ASP H . . 4.180 4.087 3.628 4.258 0.078 11 0 "[ . 1 . 2]" 1
880 1 72 ILE HB 1 74 TYR QD . . 4.450 4.065 2.947 4.527 0.077 20 0 "[ . 1 . 2]" 1
881 1 72 ILE HB 1 74 TYR QE . . 4.430 2.801 2.138 3.303 . 0 0 "[ . 1 . 2]" 1
882 1 72 ILE MD 1 72 ILE MG . . 3.300 2.096 2.027 2.139 . 0 0 "[ . 1 . 2]" 1
883 1 72 ILE MD 1 74 TYR QE . . 3.980 3.156 2.422 3.778 . 0 0 "[ . 1 . 2]" 1
884 1 72 ILE MG 1 73 ASP H . . 3.390 2.465 1.929 2.793 . 0 0 "[ . 1 . 2]" 1
885 1 72 ILE MG 1 73 ASP HA . . 3.970 3.976 3.852 4.074 0.104 18 0 "[ . 1 . 2]" 1
886 1 72 ILE MG 1 73 ASP HB3 . . 4.240 4.472 3.765 4.912 0.672 7 5 "[ *. +* 1* -. 2]" 1
887 1 72 ILE MG 1 74 TYR H . . 4.090 3.887 3.296 4.176 0.086 5 0 "[ . 1 . 2]" 1
888 1 72 ILE MG 1 74 TYR HA . . 3.950 3.412 2.801 3.883 . 0 0 "[ . 1 . 2]" 1
889 1 72 ILE MG 1 74 TYR QD . . 3.540 3.004 2.522 3.558 0.018 16 0 "[ . 1 . 2]" 1
890 1 72 ILE MG 1 74 TYR QE . . 3.790 2.816 2.286 3.630 . 0 0 "[ . 1 . 2]" 1
891 1 72 ILE MG 1 75 ASN H . . 5.500 5.286 4.885 5.581 0.081 6 0 "[ . 1 . 2]" 1
892 1 72 ILE MG 1 77 TYR QE . . 4.010 3.063 2.308 4.044 0.034 20 0 "[ . 1 . 2]" 1
893 1 73 ASP H 1 73 ASP HB3 . . 3.340 3.242 2.535 3.531 0.191 11 0 "[ . 1 . 2]" 1
894 1 73 ASP H 1 74 TYR H . . 4.680 4.250 3.621 4.484 . 0 0 "[ . 1 . 2]" 1
895 1 73 ASP H 1 76 ASN HD21 . . 4.940 4.699 3.987 5.021 0.081 6 0 "[ . 1 . 2]" 1
896 1 73 ASP H 1 76 ASN HD22 . . 5.140 4.451 3.753 5.200 0.060 10 0 "[ . 1 . 2]" 1
897 1 73 ASP HA 1 74 TYR H . . 2.910 2.214 2.066 2.378 . 0 0 "[ . 1 . 2]" 1
898 1 73 ASP HA 1 75 ASN H . . 4.500 3.505 3.152 4.539 0.039 3 0 "[ . 1 . 2]" 1
899 1 73 ASP HB3 1 76 ASN HD21 . . 4.060 2.738 1.942 4.066 0.006 13 0 "[ . 1 . 2]" 1
900 1 73 ASP HB3 1 76 ASN HD22 . . 4.050 2.773 2.272 4.102 0.052 13 0 "[ . 1 . 2]" 1
901 1 74 TYR H 1 74 TYR HB3 . . 3.620 3.617 3.521 3.704 0.084 3 0 "[ . 1 . 2]" 1
902 1 74 TYR H 1 74 TYR QD . . 3.550 3.015 2.554 3.431 . 0 0 "[ . 1 . 2]" 1
903 1 74 TYR H 1 74 TYR QE . . 5.400 4.508 4.130 4.998 . 0 0 "[ . 1 . 2]" 1
904 1 74 TYR H 1 75 ASN H . . 3.530 2.649 2.294 3.534 0.004 3 0 "[ . 1 . 2]" 1
905 1 74 TYR H 1 76 ASN H . . 5.100 4.738 4.518 5.175 0.075 3 0 "[ . 1 . 2]" 1
906 1 74 TYR H 1 80 ILE MD . . 5.500 5.143 4.816 5.557 0.057 3 0 "[ . 1 . 2]" 1
907 1 74 TYR HA 1 74 TYR QD . . 3.130 2.345 2.071 2.802 . 0 0 "[ . 1 . 2]" 1
908 1 74 TYR HA 1 76 ASN H . . 4.380 3.649 3.116 4.179 . 0 0 "[ . 1 . 2]" 1
909 1 74 TYR HA 1 80 ILE MD . . 3.900 3.361 2.976 3.743 . 0 0 "[ . 1 . 2]" 1
910 1 74 TYR HB3 1 75 ASN H . . 3.920 4.252 4.011 4.465 0.545 14 1 "[ . 1 +. 2]" 1
911 1 74 TYR HB3 1 80 ILE MD . . 4.520 2.324 1.958 3.071 . 0 0 "[ . 1 . 2]" 1
912 1 74 TYR QD 1 75 ASN H . . 4.940 4.722 4.316 4.967 0.027 5 0 "[ . 1 . 2]" 1
913 1 74 TYR QD 1 80 ILE MD . . 3.240 3.007 2.402 3.342 0.102 4 0 "[ . 1 . 2]" 1
914 1 74 TYR QD 1 80 ILE MG . . 4.970 4.199 3.712 4.551 . 0 0 "[ . 1 . 2]" 1
915 1 74 TYR QD 1 102 MET HA . . 3.180 2.815 2.066 3.260 0.080 8 0 "[ . 1 . 2]" 1
916 1 74 TYR QD 1 102 MET ME . . 4.360 3.674 2.701 4.455 0.095 5 0 "[ . 1 . 2]" 1
917 1 74 TYR QD 1 102 MET HG3 . . 5.010 4.566 3.505 5.088 0.078 5 0 "[ . 1 . 2]" 1
918 1 74 TYR QE 1 80 ILE MD . . 4.900 4.467 3.911 4.992 0.092 3 0 "[ . 1 . 2]" 1
919 1 74 TYR QE 1 80 ILE MG . . 5.500 4.815 4.116 5.411 . 0 0 "[ . 1 . 2]" 1
920 1 74 TYR QE 1 101 GLN HB3 . . 4.700 3.882 2.670 4.771 0.071 6 0 "[ . 1 . 2]" 1
921 1 74 TYR QE 1 102 MET HA . . 4.450 4.111 3.461 4.526 0.076 10 0 "[ . 1 . 2]" 1
922 1 74 TYR QE 1 102 MET HG3 . . 4.990 4.576 3.216 5.085 0.095 1 0 "[ . 1 . 2]" 1
923 1 75 ASN H 1 75 ASN HB3 . . 3.220 2.926 2.415 3.305 0.085 18 0 "[ . 1 . 2]" 1
924 1 75 ASN H 1 76 ASN H . . 3.310 2.764 2.073 3.168 . 0 0 "[ . 1 . 2]" 1
925 1 75 ASN H 1 76 ASN HD22 . . 5.100 4.384 3.756 5.164 0.064 17 0 "[ . 1 . 2]" 1
926 1 75 ASN HA 1 75 ASN HD21 . . 3.680 2.619 1.968 3.588 . 0 0 "[ . 1 . 2]" 1
927 1 75 ASN HA 1 77 TYR H . . 4.100 3.685 3.375 4.051 . 0 0 "[ . 1 . 2]" 1
928 1 75 ASN HB3 1 76 ASN H . . 5.130 3.517 2.318 4.218 . 0 0 "[ . 1 . 2]" 1
929 1 75 ASN HD21 1 105 TYR HA . . 4.580 3.514 2.360 4.653 0.073 6 0 "[ . 1 . 2]" 1
930 1 75 ASN HD21 1 106 ARG H . . 5.110 3.952 2.759 4.917 . 0 0 "[ . 1 . 2]" 1
931 1 75 ASN HD22 1 105 TYR HA . . 3.980 3.764 2.579 4.643 0.663 3 2 "[ + . - 1 . 2]" 1
932 1 75 ASN HD22 1 106 ARG H . . 4.530 3.932 2.917 4.950 0.420 3 0 "[ . 1 . 2]" 1
933 1 75 ASN HD22 1 106 ARG HG3 . . 4.710 4.067 2.104 5.559 0.849 20 1 "[ . 1 . +]" 1
934 1 76 ASN H 1 76 ASN HB3 . . 3.550 3.162 2.461 3.635 0.085 9 0 "[ . 1 . 2]" 1
935 1 76 ASN H 1 76 ASN HD21 . . 4.830 2.576 1.979 3.872 . 0 0 "[ . 1 . 2]" 1
936 1 76 ASN H 1 76 ASN HD22 . . 5.500 3.425 2.787 4.333 . 0 0 "[ . 1 . 2]" 1
937 1 76 ASN HA 1 76 ASN HD21 . . 4.760 4.156 3.907 4.576 . 0 0 "[ . 1 . 2]" 1
938 1 76 ASN HA 1 76 ASN HD22 . . 4.930 4.825 4.383 5.027 0.097 15 0 "[ . 1 . 2]" 1
939 1 76 ASN HB3 1 76 ASN HD21 . . 3.660 2.817 2.176 3.587 . 0 0 "[ . 1 . 2]" 1
940 1 76 ASN HB3 1 77 TYR H . . 4.460 4.453 4.073 4.692 0.232 4 0 "[ . 1 . 2]" 1
941 1 76 ASN HD22 1 77 TYR QE . . 4.630 3.777 2.451 4.726 0.096 18 0 "[ . 1 . 2]" 1
942 1 77 TYR H 1 77 TYR HB3 . . 3.520 3.687 3.552 3.885 0.365 4 0 "[ . 1 . 2]" 1
943 1 77 TYR H 1 77 TYR QD . . 3.730 2.822 2.431 3.598 . 0 0 "[ . 1 . 2]" 1
944 1 77 TYR H 1 78 ASP H . . 5.170 4.420 4.142 4.600 . 0 0 "[ . 1 . 2]" 1
945 1 77 TYR H 1 80 ILE MD . . 5.480 3.927 3.689 4.273 . 0 0 "[ . 1 . 2]" 1
946 1 77 TYR HA 1 77 TYR QD . . 4.220 2.768 2.417 3.049 . 0 0 "[ . 1 . 2]" 1
947 1 77 TYR HA 1 78 ASP H . . 3.200 2.209 2.043 2.364 . 0 0 "[ . 1 . 2]" 1
948 1 77 TYR HA 1 79 LEU H . . 4.140 3.876 3.514 4.207 0.067 6 0 "[ . 1 . 2]" 1
949 1 77 TYR HB3 1 78 ASP H . . 4.360 3.135 2.616 3.676 . 0 0 "[ . 1 . 2]" 1
950 1 77 TYR HB3 1 79 LEU H . . 4.650 3.163 2.726 3.547 . 0 0 "[ . 1 . 2]" 1
951 1 77 TYR HB3 1 80 ILE HB . . 5.500 5.464 5.082 5.894 0.394 7 0 "[ . 1 . 2]" 1
952 1 77 TYR HB3 1 80 ILE MD . . 4.750 3.437 2.836 3.895 . 0 0 "[ . 1 . 2]" 1
953 1 77 TYR QD 1 78 ASP H . . 5.320 4.005 3.570 4.284 . 0 0 "[ . 1 . 2]" 1
954 1 77 TYR QD 1 79 LEU H . . 5.470 4.553 4.159 5.070 . 0 0 "[ . 1 . 2]" 1
955 1 78 ASP H 1 78 ASP HB3 . . 3.730 2.714 2.390 3.442 . 0 0 "[ . 1 . 2]" 1
956 1 78 ASP H 1 79 LEU H . . 3.050 2.293 1.990 2.742 . 0 0 "[ . 1 . 2]" 1
957 1 78 ASP H 1 79 LEU HA . . 5.500 5.041 4.658 5.473 . 0 0 "[ . 1 . 2]" 1
958 1 78 ASP HB3 1 79 LEU H . . 3.980 2.823 2.247 3.496 . 0 0 "[ . 1 . 2]" 1
959 1 78 ASP HB3 1 79 LEU HB3 . . 5.170 4.247 3.292 5.235 0.065 4 0 "[ . 1 . 2]" 1
960 1 79 LEU H 1 79 LEU HB3 . . 3.930 2.789 2.354 3.304 . 0 0 "[ . 1 . 2]" 1
961 1 79 LEU H 1 79 LEU QD . . 4.730 3.945 3.835 4.031 . 0 0 "[ . 1 . 2]" 1
962 1 79 LEU H 1 80 ILE H . . 4.920 4.379 4.271 4.584 . 0 0 "[ . 1 . 2]" 1
963 1 79 LEU HA 1 79 LEU QD . . 3.190 2.302 2.072 2.524 . 0 0 "[ . 1 . 2]" 1
964 1 79 LEU HA 1 80 ILE H . . 3.020 2.280 2.171 2.387 . 0 0 "[ . 1 . 2]" 1
965 1 79 LEU HA 1 108 GLU H . . 3.640 2.824 2.512 3.719 0.079 20 0 "[ . 1 . 2]" 1
966 1 79 LEU HA 1 108 GLU HB3 . . 4.670 4.075 3.643 4.745 0.075 10 0 "[ . 1 . 2]" 1
967 1 79 LEU QD 1 80 ILE H . . 3.290 2.144 1.872 2.491 . 0 0 "[ . 1 . 2]" 1
968 1 79 LEU QD 1 108 GLU H . . 3.990 3.724 3.252 4.047 0.057 20 0 "[ . 1 . 2]" 1
969 1 79 LEU QD 1 108 GLU HA . . 4.130 4.053 3.679 4.157 0.027 18 0 "[ . 1 . 2]" 1
970 1 79 LEU QD 1 108 GLU HB3 . . 3.530 2.567 2.106 3.579 0.049 10 0 "[ . 1 . 2]" 1
971 1 79 LEU QD 1 109 VAL H . . 4.840 3.839 3.423 4.416 . 0 0 "[ . 1 . 2]" 1
972 1 79 LEU QD 1 109 VAL HA . . 3.980 3.082 2.475 3.859 . 0 0 "[ . 1 . 2]" 1
973 1 79 LEU QD 1 110 ALA MB . . 3.970 3.273 2.964 3.745 . 0 0 "[ . 1 . 2]" 1
974 1 79 LEU QD 1 149 TRP HB3 . . 4.360 3.069 2.816 3.251 . 0 0 "[ . 1 . 2]" 1
975 1 79 LEU QD 1 150 SER HA . . 3.460 2.448 1.960 3.166 . 0 0 "[ . 1 . 2]" 1
976 1 79 LEU QD 1 151 LYS H . . 5.380 3.915 2.800 4.664 . 0 0 "[ . 1 . 2]" 1
977 1 79 LEU HG 1 80 ILE H . . 4.420 3.625 2.833 4.501 0.081 1 0 "[ . 1 . 2]" 1
978 1 80 ILE H 1 80 ILE HB . . 3.610 2.848 2.737 2.994 . 0 0 "[ . 1 . 2]" 1
979 1 80 ILE H 1 80 ILE MD . . 4.690 4.366 4.172 4.609 . 0 0 "[ . 1 . 2]" 1
980 1 80 ILE H 1 109 VAL H . . 5.060 4.808 4.462 5.049 . 0 0 "[ . 1 . 2]" 1
981 1 80 ILE H 1 109 VAL HA . . 3.760 2.794 2.448 3.236 . 0 0 "[ . 1 . 2]" 1
982 1 80 ILE HA 1 80 ILE MD . . 4.240 3.841 3.738 3.944 . 0 0 "[ . 1 . 2]" 1
983 1 80 ILE HA 1 80 ILE MG . . 3.360 2.376 2.231 2.482 . 0 0 "[ . 1 . 2]" 1
984 1 80 ILE HA 1 81 LEU H . . 3.000 2.212 2.145 2.352 . 0 0 "[ . 1 . 2]" 1
985 1 80 ILE HA 1 82 ILE MD . . 5.240 4.693 3.937 5.337 0.097 16 0 "[ . 1 . 2]" 1
986 1 80 ILE HB 1 80 ILE MD . . 3.070 2.494 2.279 2.564 . 0 0 "[ . 1 . 2]" 1
987 1 80 ILE HB 1 81 LEU H . . 4.730 4.357 3.970 4.596 . 0 0 "[ . 1 . 2]" 1
988 1 80 ILE HB 1 109 VAL HA . . 4.290 3.476 3.023 4.048 . 0 0 "[ . 1 . 2]" 1
989 1 80 ILE MD 1 80 ILE MG . . 3.240 2.067 2.033 2.104 . 0 0 "[ . 1 . 2]" 1
990 1 80 ILE MD 1 109 VAL HA . . 5.480 5.276 4.812 5.579 0.099 20 0 "[ . 1 . 2]" 1
991 1 80 ILE MD 1 109 VAL MG2 . . 4.780 3.587 2.989 4.095 . 0 0 "[ . 1 . 2]" 1
992 1 80 ILE MG 1 81 LEU H . . 3.440 2.950 2.347 3.313 . 0 0 "[ . 1 . 2]" 1
993 1 80 ILE MG 1 82 ILE H . . 5.500 4.578 4.383 4.768 . 0 0 "[ . 1 . 2]" 1
994 1 80 ILE MG 1 82 ILE HB . . 5.500 4.732 4.331 4.961 . 0 0 "[ . 1 . 2]" 1
995 1 80 ILE MG 1 82 ILE MD . . 3.070 2.272 1.996 2.725 . 0 0 "[ . 1 . 2]" 1
996 1 80 ILE MG 1 82 ILE HG13 . . 4.360 2.736 2.169 3.247 . 0 0 "[ . 1 . 2]" 1
997 1 80 ILE MG 1 109 VAL MG1 . . 3.780 3.370 2.920 3.874 0.094 19 0 "[ . 1 . 2]" 1
998 1 80 ILE MG 1 109 VAL MG2 . . 4.180 3.948 3.449 4.299 0.119 5 0 "[ . 1 . 2]" 1
999 1 81 LEU H 1 81 LEU QD . . 4.070 2.626 2.284 3.301 . 0 0 "[ . 1 . 2]" 1
1000 1 81 LEU H 1 81 LEU HG . . 4.060 3.949 2.855 4.140 0.080 12 0 "[ . 1 . 2]" 1
1001 1 81 LEU HA 1 81 LEU QD . . 3.500 2.536 2.047 3.062 . 0 0 "[ . 1 . 2]" 1
1002 1 81 LEU HA 1 82 ILE H . . 2.940 2.261 2.185 2.325 . 0 0 "[ . 1 . 2]" 1
1003 1 81 LEU HA 1 82 ILE HB . . 4.540 4.450 4.072 4.602 0.062 9 0 "[ . 1 . 2]" 1
1004 1 81 LEU HA 1 109 VAL HA . . 4.140 4.078 3.283 4.226 0.086 9 0 "[ . 1 . 2]" 1
1005 1 81 LEU HA 1 109 VAL MG1 . . 5.400 3.972 3.218 4.601 . 0 0 "[ . 1 . 2]" 1
1006 1 81 LEU HA 1 110 ALA H . . 3.630 2.579 2.170 3.188 . 0 0 "[ . 1 . 2]" 1
1007 1 81 LEU HA 1 110 ALA MB . . 4.260 3.234 2.741 3.557 . 0 0 "[ . 1 . 2]" 1
1008 1 81 LEU HB3 1 82 ILE H . . 4.390 3.027 2.608 3.495 . 0 0 "[ . 1 . 2]" 1
1009 1 81 LEU HB3 1 82 ILE HA . . 4.350 4.320 4.109 4.422 0.072 20 0 "[ . 1 . 2]" 1
1010 1 81 LEU QD 1 110 ALA H . . 3.580 3.332 2.450 3.708 0.128 17 0 "[ . 1 . 2]" 1
1011 1 81 LEU QD 1 110 ALA MB . . 3.100 2.489 1.965 3.202 0.102 4 0 "[ . 1 . 2]" 1
1012 1 81 LEU QD 1 149 TRP HB3 . . 5.070 2.432 2.050 3.643 . 0 0 "[ . 1 . 2]" 1
1013 1 81 LEU QD 1 149 TRP HE3 . . 3.820 2.522 2.066 3.894 0.074 12 0 "[ . 1 . 2]" 1
1014 1 81 LEU HG 1 110 ALA MB . . 4.740 3.030 2.088 4.673 . 0 0 "[ . 1 . 2]" 1
1015 1 81 LEU HG 1 149 TRP HE3 . . 5.040 4.136 2.721 5.101 0.061 5 0 "[ . 1 . 2]" 1
1016 1 82 ILE H 1 82 ILE HB . . 3.340 2.649 2.534 2.830 . 0 0 "[ . 1 . 2]" 1
1017 1 82 ILE H 1 82 ILE MD . . 4.300 3.201 2.387 4.360 0.060 20 0 "[ . 1 . 2]" 1
1018 1 82 ILE H 1 82 ILE HG13 . . 5.220 3.545 2.898 4.082 . 0 0 "[ . 1 . 2]" 1
1019 1 82 ILE H 1 82 ILE MG . . 4.440 3.852 3.743 3.952 . 0 0 "[ . 1 . 2]" 1
1020 1 82 ILE H 1 110 ALA MB . . 5.500 3.980 3.509 4.366 . 0 0 "[ . 1 . 2]" 1
1021 1 82 ILE H 1 111 SER HA . . 3.510 2.915 2.403 3.560 0.050 4 0 "[ . 1 . 2]" 1
1022 1 82 ILE H 1 111 SER HB3 . . 5.000 5.332 4.484 5.952 0.952 8 10 "[ * *+ 1****.* - *]" 1
1023 1 82 ILE H 1 112 PHE H . . 4.430 3.834 3.340 4.496 0.066 4 0 "[ . 1 . 2]" 1
1024 1 82 ILE HA 1 82 ILE MD . . 4.250 3.564 3.057 3.977 . 0 0 "[ . 1 . 2]" 1
1025 1 82 ILE HA 1 82 ILE HG13 . . 3.770 2.542 2.252 3.188 . 0 0 "[ . 1 . 2]" 1
1026 1 82 ILE HA 1 82 ILE MG . . 3.430 2.490 2.303 2.696 . 0 0 "[ . 1 . 2]" 1
1027 1 82 ILE HA 1 83 GLY H . . 3.140 2.245 2.080 2.433 . 0 0 "[ . 1 . 2]" 1
1028 1 82 ILE HA 1 83 GLY HA3 . . 4.820 4.363 4.255 4.462 . 0 0 "[ . 1 . 2]" 1
1029 1 82 ILE HB 1 83 GLY H . . 4.480 4.131 3.749 4.428 . 0 0 "[ . 1 . 2]" 1
1030 1 82 ILE HB 1 95 ILE MG . . 5.500 3.815 3.364 4.244 . 0 0 "[ . 1 . 2]" 1
1031 1 82 ILE HB 1 111 SER HA . . 4.040 3.096 2.181 3.784 . 0 0 "[ . 1 . 2]" 1
1032 1 82 ILE HB 1 111 SER HB3 . . 4.500 4.543 3.142 5.882 1.382 20 7 "[ * * 1* *-.* +]" 1
1033 1 82 ILE HB 1 112 PHE H . . 5.250 4.574 3.888 5.260 0.010 20 0 "[ . 1 . 2]" 1
1034 1 82 ILE MD 1 83 GLY H . . 5.110 5.058 4.770 5.214 0.104 20 0 "[ . 1 . 2]" 1
1035 1 82 ILE MD 1 95 ILE MG . . 3.710 3.321 2.458 3.801 0.091 7 0 "[ . 1 . 2]" 1
1036 1 82 ILE MG 1 83 GLY H . . 3.860 2.478 2.132 2.955 . 0 0 "[ . 1 . 2]" 1
1037 1 82 ILE MG 1 83 GLY HA2 . . 5.470 3.730 3.306 4.142 . 0 0 "[ . 1 . 2]" 1
1038 1 82 ILE MG 1 83 GLY HA3 . . 4.200 4.197 4.045 4.305 0.105 4 0 "[ . 1 . 2]" 1
1039 1 82 ILE MG 1 84 SER HB3 . . 5.500 4.038 3.388 5.011 . 0 0 "[ . 1 . 2]" 1
1040 1 82 ILE MG 1 95 ILE MG . . 3.270 2.141 1.934 2.460 . 0 0 "[ . 1 . 2]" 1
1041 1 82 ILE MG 1 111 SER HB3 . . 5.330 4.767 3.375 6.200 0.870 8 2 "[ . + 1 . -]" 1
1042 1 83 GLY H 1 84 SER H . . 4.870 4.506 4.343 4.740 . 0 0 "[ . 1 . 2]" 1
1043 1 83 GLY H 1 95 ILE MD . . 5.180 3.901 3.418 4.645 . 0 0 "[ . 1 . 2]" 1
1044 1 83 GLY H 1 112 PHE QD . . 5.360 4.672 3.427 5.451 0.091 1 0 "[ . 1 . 2]" 1
1045 1 83 GLY HA2 1 84 SER H . . 3.220 2.374 2.243 2.521 . 0 0 "[ . 1 . 2]" 1
1046 1 83 GLY HA2 1 112 PHE H . . 4.210 2.939 2.144 3.822 . 0 0 "[ . 1 . 2]" 1
1047 1 83 GLY HA2 1 112 PHE HB3 . . 4.850 4.643 2.419 5.618 0.768 7 3 "[ - + 1 * . 2]" 1
1048 1 83 GLY HA2 1 112 PHE QD . . 3.540 3.080 2.235 3.636 0.096 18 0 "[ . 1 . 2]" 1
1049 1 83 GLY HA2 1 113 PHE HA . . 4.830 4.097 3.505 4.832 0.002 8 0 "[ . 1 . 2]" 1
1050 1 84 SER H 1 84 SER HB3 . . 3.970 3.532 2.642 4.069 0.099 15 0 "[ . 1 . 2]" 1
1051 1 84 SER H 1 85 PRO HD3 . . 5.010 4.826 4.625 4.992 . 0 0 "[ . 1 . 2]" 1
1052 1 84 SER H 1 95 ILE MD . . 4.700 4.714 4.498 4.807 0.107 8 0 "[ . 1 . 2]" 1
1053 1 84 SER H 1 113 PHE HA . . 3.600 2.744 1.991 3.365 . 0 0 "[ . 1 . 2]" 1
1054 1 84 SER H 1 114 THR H . . 4.980 4.649 3.551 5.062 0.082 12 0 "[ . 1 . 2]" 1
1055 1 84 SER HA 1 85 PRO HD3 . . 3.780 2.403 2.134 2.621 . 0 0 "[ . 1 . 2]" 1
1056 1 84 SER HA 1 95 ILE MD . . 4.310 3.728 3.309 4.212 . 0 0 "[ . 1 . 2]" 1
1057 1 84 SER HB3 1 95 ILE MD . . 4.940 2.512 2.069 3.784 . 0 0 "[ . 1 . 2]" 1
1058 1 84 SER HB3 1 95 ILE HG13 . . 4.850 3.735 2.593 4.799 . 0 0 "[ . 1 . 2]" 1
1059 1 85 PRO HA 1 86 VAL H . . 3.240 2.353 2.179 2.533 . 0 0 "[ . 1 . 2]" 1
1060 1 85 PRO HA 1 86 VAL QG . . 5.200 3.656 3.188 3.980 . 0 0 "[ . 1 . 2]" 1
1061 1 85 PRO HA 1 114 THR H . . 3.490 3.390 2.810 3.573 0.083 2 0 "[ . 1 . 2]" 1
1062 1 85 PRO HB3 1 86 VAL H . . 4.440 3.660 3.246 4.166 . 0 0 "[ . 1 . 2]" 1
1063 1 85 PRO HD3 1 92 ALA MB . . 4.640 5.559 4.768 5.926 1.286 5 19 "[**-*+****** ********]" 1
1064 1 86 VAL H 1 86 VAL HB . . 3.440 2.631 2.214 3.527 0.087 9 0 "[ . 1 . 2]" 1
1065 1 86 VAL H 1 86 VAL QG . . 3.640 2.609 2.036 2.992 . 0 0 "[ . 1 . 2]" 1
1066 1 86 VAL H 1 87 TRP H . . 5.090 4.412 4.135 4.636 . 0 0 "[ . 1 . 2]" 1
1067 1 86 VAL H 1 113 PHE HB3 . . 4.600 4.949 3.899 6.270 1.670 9 6 "[ * .* +1 * . -*2]" 1
1068 1 86 VAL H 1 114 THR H . . 4.610 3.925 3.107 4.485 . 0 0 "[ . 1 . 2]" 1
1069 1 86 VAL H 1 115 SER HA . . 4.330 4.158 3.735 4.414 0.084 5 0 "[ . 1 . 2]" 1
1070 1 86 VAL H 1 115 SER HB3 . . 5.500 5.138 4.303 6.261 0.761 15 1 "[ . 1 + 2]" 1
1071 1 86 VAL HA 1 86 VAL QG . . 3.170 2.147 2.046 2.434 . 0 0 "[ . 1 . 2]" 1
1072 1 86 VAL HA 1 87 TRP H . . 3.020 2.316 2.143 2.833 . 0 0 "[ . 1 . 2]" 1
1073 1 86 VAL HA 1 113 PHE QD . . 3.830 3.881 3.577 3.941 0.111 5 0 "[ . 1 . 2]" 1
1074 1 86 VAL HB 1 87 TRP H . . 5.220 4.092 2.773 4.534 . 0 0 "[ . 1 . 2]" 1
1075 1 86 VAL HB 1 113 PHE QD . . 5.160 4.493 3.093 5.112 . 0 0 "[ . 1 . 2]" 1
1076 1 86 VAL HB 1 115 SER H . . 5.220 4.803 3.631 5.301 0.081 3 0 "[ . 1 . 2]" 1
1077 1 86 VAL HB 1 115 SER HA . . 4.280 3.238 2.234 4.321 0.041 5 0 "[ . 1 . 2]" 1
1078 1 86 VAL HB 1 115 SER HB3 . . 4.560 3.148 2.272 4.219 . 0 0 "[ . 1 . 2]" 1
1079 1 86 VAL HB 1 116 ALA H . . 4.920 4.642 3.699 5.020 0.100 9 0 "[ . 1 . 2]" 1
1080 1 86 VAL QG 1 87 TRP H . . 3.950 2.641 2.126 3.268 . 0 0 "[ . 1 . 2]" 1
1081 1 86 VAL QG 1 87 TRP HA . . 3.980 3.796 3.329 4.005 0.025 17 0 "[ . 1 . 2]" 1
1082 1 86 VAL QG 1 89 GLY H . . 3.840 3.362 3.119 3.727 . 0 0 "[ . 1 . 2]" 1
1083 1 86 VAL QG 1 89 GLY HA2 . . 4.400 4.213 3.936 4.410 0.010 1 0 "[ . 1 . 2]" 1
1084 1 86 VAL QG 1 89 GLY HA3 . . 5.220 5.111 4.595 5.230 0.010 8 0 "[ . 1 . 2]" 1
1085 1 86 VAL QG 1 90 TYR H . . 4.350 4.142 3.489 4.381 0.031 7 0 "[ . 1 . 2]" 1
1086 1 86 VAL QG 1 113 PHE HA . . 4.920 3.996 3.411 4.647 . 0 0 "[ . 1 . 2]" 1
1087 1 86 VAL QG 1 113 PHE HB3 . . 4.360 2.667 1.944 3.984 . 0 0 "[ . 1 . 2]" 1
1088 1 86 VAL QG 1 113 PHE QD . . 3.470 2.083 1.816 2.586 . 0 0 "[ . 1 . 2]" 1
1089 1 86 VAL QG 1 114 THR H . . 4.830 3.048 2.480 3.800 . 0 0 "[ . 1 . 2]" 1
1090 1 86 VAL QG 1 115 SER H . . 5.050 3.885 2.739 4.643 . 0 0 "[ . 1 . 2]" 1
1091 1 86 VAL QG 1 115 SER HA . . 4.660 3.381 1.814 4.464 . 0 0 "[ . 1 . 2]" 1
1092 1 86 VAL QG 1 115 SER HB3 . . 3.920 2.565 1.962 3.606 . 0 0 "[ . 1 . 2]" 1
1093 1 86 VAL QG 1 116 ALA H . . 5.440 4.047 2.501 4.910 . 0 0 "[ . 1 . 2]" 1
1094 1 86 VAL QG 1 118 THR H . . 5.500 4.696 4.072 5.356 . 0 0 "[ . 1 . 2]" 1
1095 1 86 VAL QG 1 119 ASN HB3 . . 3.760 3.899 2.854 4.424 0.664 15 8 "[ * .* * * -+ * *2]" 1
1096 1 86 VAL QG 1 119 ASN HD21 . . 5.230 3.877 2.239 4.987 . 0 0 "[ . 1 . 2]" 1
1097 1 86 VAL QG 1 123 TYR H . . 5.360 4.311 3.774 4.841 . 0 0 "[ . 1 . 2]" 1
1098 1 86 VAL QG 1 123 TYR HA . . 5.130 4.110 3.304 4.794 . 0 0 "[ . 1 . 2]" 1
1099 1 86 VAL QG 1 123 TYR HB3 . . 4.420 3.161 2.333 3.956 . 0 0 "[ . 1 . 2]" 1
1100 1 86 VAL QG 1 123 TYR QD . . 4.690 2.794 1.963 3.576 . 0 0 "[ . 1 . 2]" 1
1101 1 87 TRP H 1 87 TRP HB3 . . 3.940 3.175 3.019 3.341 . 0 0 "[ . 1 . 2]" 1
1102 1 87 TRP H 1 87 TRP HE3 . . 5.500 3.944 3.021 5.548 0.048 18 0 "[ . 1 . 2]" 1
1103 1 87 TRP H 1 88 SER H . . 4.960 4.325 4.203 4.503 . 0 0 "[ . 1 . 2]" 1
1104 1 87 TRP H 1 89 GLY H . . 4.810 4.297 3.043 4.861 0.051 17 0 "[ . 1 . 2]" 1
1105 1 87 TRP H 1 90 TYR H . . 4.350 3.869 3.350 4.403 0.053 5 0 "[ . 1 . 2]" 1
1106 1 87 TRP HA 1 88 SER H . . 3.090 2.813 2.557 2.970 . 0 0 "[ . 1 . 2]" 1
1107 1 87 TRP HB3 1 88 SER H . . 4.940 2.229 2.067 2.510 . 0 0 "[ . 1 . 2]" 1
1108 1 87 TRP HB3 1 90 TYR H . . 3.420 3.454 3.028 3.510 0.090 8 0 "[ . 1 . 2]" 1
1109 1 87 TRP HB3 1 92 ALA HA . . 5.500 5.099 4.418 5.528 0.028 3 0 "[ . 1 . 2]" 1
1110 1 87 TRP HE3 1 92 ALA HA . . 4.150 3.848 2.326 4.229 0.079 5 0 "[ . 1 . 2]" 1
1111 1 87 TRP HZ3 1 92 ALA HA . . 4.890 4.550 2.389 4.979 0.089 2 0 "[ . 1 . 2]" 1
1112 1 87 TRP HZ3 1 92 ALA MB . . 5.500 2.430 2.076 3.675 . 0 0 "[ . 1 . 2]" 1
1113 1 88 SER H 1 89 GLY H . . 3.850 3.746 3.192 3.941 0.091 17 0 "[ . 1 . 2]" 1
1114 1 88 SER H 1 90 TYR H . . 5.040 4.209 3.818 4.558 . 0 0 "[ . 1 . 2]" 1
1115 1 88 SER HA 1 89 GLY HA2 . . 5.210 4.346 4.175 4.548 . 0 0 "[ . 1 . 2]" 1
1116 1 88 SER HA 1 119 ASN HD21 . . 4.290 3.627 2.644 4.353 0.063 4 0 "[ . 1 . 2]" 1
1117 1 88 SER HA 1 119 ASN HD22 . . 4.790 3.721 2.346 4.848 0.058 4 0 "[ . 1 . 2]" 1
1118 1 89 GLY H 1 90 TYR H . . 3.350 2.870 1.898 3.391 0.041 4 0 "[ . 1 . 2]" 1
1119 1 89 GLY H 1 90 TYR HA . . 5.290 4.886 4.378 5.240 . 0 0 "[ . 1 . 2]" 1
1120 1 89 GLY H 1 119 ASN HB3 . . 4.410 3.998 2.742 4.476 0.066 10 0 "[ . 1 . 2]" 1
1121 1 89 GLY H 1 119 ASN HD21 . . 4.740 2.936 2.066 3.938 . 0 0 "[ . 1 . 2]" 1
1122 1 89 GLY H 1 119 ASN HD22 . . 5.130 3.681 2.370 4.689 . 0 0 "[ . 1 . 2]" 1
1123 1 89 GLY HA2 1 119 ASN HB3 . . 4.320 2.388 2.126 2.738 . 0 0 "[ . 1 . 2]" 1
1124 1 89 GLY HA2 1 122 ALA MB . . 4.030 3.324 2.700 3.694 . 0 0 "[ . 1 . 2]" 1
1125 1 89 GLY HA3 1 119 ASN HB3 . . 5.430 3.956 3.463 4.334 . 0 0 "[ . 1 . 2]" 1
1126 1 89 GLY HA3 1 119 ASN HD21 . . 4.600 4.197 2.885 5.055 0.455 20 0 "[ . 1 . 2]" 1
1127 1 89 GLY HA3 1 122 ALA MB . . 3.840 3.884 3.591 3.955 0.115 11 0 "[ . 1 . 2]" 1
1128 1 90 TYR H 1 90 TYR QD . . 3.970 2.996 2.031 4.036 0.066 14 0 "[ . 1 . 2]" 1
1129 1 90 TYR HA 1 91 PRO HG3 . . 5.250 4.678 4.508 4.825 . 0 0 "[ . 1 . 2]" 1
1130 1 90 TYR HA 1 123 TYR HA . . 3.990 3.361 2.473 4.093 0.103 11 0 "[ . 1 . 2]" 1
1131 1 90 TYR HB3 1 91 PRO HD3 . . 4.710 3.889 3.496 4.790 0.080 14 0 "[ . 1 . 2]" 1
1132 1 90 TYR QD 1 91 PRO HD3 . . 5.380 4.776 3.427 5.372 . 0 0 "[ . 1 . 2]" 1
1133 1 90 TYR QD 1 126 HIS HB3 . . 4.530 4.095 2.612 5.235 0.705 5 3 "[ + * - . 2]" 1
1134 1 91 PRO HA 1 93 THR H . . 4.130 4.139 3.905 4.212 0.082 1 0 "[ . 1 . 2]" 1
1135 1 91 PRO HB3 1 93 THR H . . 3.410 4.412 4.044 4.518 1.108 10 20 [*******-*+**********] 1
1136 1 91 PRO HB3 1 94 PRO HD3 . . 4.310 4.229 3.442 4.786 0.476 14 0 "[ . 1 . 2]" 1
1137 1 91 PRO HB3 1 94 PRO HG3 . . 4.340 4.483 3.930 4.864 0.524 13 2 "[ -. 1 + . 2]" 1
1138 1 91 PRO HG3 1 93 THR H . . 3.980 4.680 4.243 5.237 1.257 11 16 "[*** *-* **+* ******2]" 1
1139 1 91 PRO HG3 1 123 TYR HA . . 5.380 4.469 4.204 4.860 . 0 0 "[ . 1 . 2]" 1
1140 1 92 ALA H 1 92 ALA MB . . 3.300 2.102 1.943 2.234 . 0 0 "[ . 1 . 2]" 1
1141 1 92 ALA H 1 93 THR H . . 3.260 3.140 2.915 3.295 0.035 11 0 "[ . 1 . 2]" 1
1142 1 92 ALA HA 1 93 THR H . . 3.120 2.878 2.548 3.117 . 0 0 "[ . 1 . 2]" 1
1143 1 92 ALA HA 1 93 THR MG . . 4.590 3.697 3.301 4.123 . 0 0 "[ . 1 . 2]" 1
1144 1 92 ALA MB 1 93 THR H . . 3.600 3.645 3.577 3.691 0.091 3 0 "[ . 1 . 2]" 1
1145 1 93 THR H 1 93 THR HB . . 3.980 3.762 2.900 3.978 . 0 0 "[ . 1 . 2]" 1
1146 1 93 THR H 1 93 THR MG . . 3.270 2.380 2.144 2.881 . 0 0 "[ . 1 . 2]" 1
1147 1 93 THR H 1 94 PRO HD3 . . 4.340 3.023 2.729 3.267 . 0 0 "[ . 1 . 2]" 1
1148 1 93 THR HB 1 95 ILE H . . 5.390 5.116 4.460 5.459 0.069 14 0 "[ . 1 . 2]" 1
1149 1 93 THR HB 1 96 LYS H . . 4.700 4.112 3.351 4.772 0.072 19 0 "[ . 1 . 2]" 1
1150 1 94 PRO HA 1 97 THR H . . 4.650 4.709 4.534 4.739 0.089 3 0 "[ . 1 . 2]" 1
1151 1 94 PRO HD3 1 95 ILE H . . 4.470 3.882 3.556 4.051 . 0 0 "[ . 1 . 2]" 1
1152 1 95 ILE H 1 95 ILE HB . . 3.450 2.640 2.467 2.736 . 0 0 "[ . 1 . 2]" 1
1153 1 95 ILE H 1 95 ILE MD . . 3.940 3.030 2.580 3.307 . 0 0 "[ . 1 . 2]" 1
1154 1 95 ILE H 1 95 ILE HG13 . . 4.240 3.817 3.552 4.102 . 0 0 "[ . 1 . 2]" 1
1155 1 95 ILE H 1 95 ILE MG . . 4.160 3.837 3.775 3.917 . 0 0 "[ . 1 . 2]" 1
1156 1 95 ILE H 1 96 LYS H . . 3.530 2.481 2.131 3.223 . 0 0 "[ . 1 . 2]" 1
1157 1 95 ILE H 1 96 LYS HB3 . . 5.370 4.661 4.214 5.380 0.010 5 0 "[ . 1 . 2]" 1
1158 1 95 ILE H 1 97 THR H . . 5.200 4.921 4.494 5.268 0.068 19 0 "[ . 1 . 2]" 1
1159 1 95 ILE HA 1 95 ILE MD . . 3.170 2.400 2.170 2.672 . 0 0 "[ . 1 . 2]" 1
1160 1 95 ILE HA 1 95 ILE MG . . 3.460 2.341 2.264 2.435 . 0 0 "[ . 1 . 2]" 1
1161 1 95 ILE HA 1 98 LEU H . . 3.900 3.361 3.086 3.675 . 0 0 "[ . 1 . 2]" 1
1162 1 95 ILE HA 1 98 LEU HB3 . . 3.500 2.938 2.271 4.428 0.928 13 1 "[ . 1 + . 2]" 1
1163 1 95 ILE HA 1 99 LEU H . . 4.390 4.012 3.759 4.248 . 0 0 "[ . 1 . 2]" 1
1164 1 95 ILE HB 1 96 LYS H . . 4.120 3.618 3.239 4.213 0.093 19 0 "[ . 1 . 2]" 1
1165 1 95 ILE HB 1 99 LEU H . . 5.500 5.072 4.567 5.569 0.069 19 0 "[ . 1 . 2]" 1
1166 1 95 ILE HB 1 127 PHE QD . . 3.780 3.818 3.546 3.875 0.095 3 0 "[ . 1 . 2]" 1
1167 1 95 ILE MD 1 96 LYS H . . 5.140 4.613 4.469 4.724 . 0 0 "[ . 1 . 2]" 1
1168 1 95 ILE HG13 1 127 PHE QD . . 5.110 4.371 3.864 5.112 0.002 19 0 "[ . 1 . 2]" 1
1169 1 95 ILE MG 1 96 LYS H . . 5.420 4.232 4.034 4.456 . 0 0 "[ . 1 . 2]" 1
1170 1 95 ILE MG 1 96 LYS HA . . 5.240 4.367 4.021 4.666 . 0 0 "[ . 1 . 2]" 1
1171 1 95 ILE MG 1 98 LEU H . . 4.650 4.169 3.850 4.705 0.055 19 0 "[ . 1 . 2]" 1
1172 1 95 ILE MG 1 99 LEU H . . 4.500 3.195 2.622 3.639 . 0 0 "[ . 1 . 2]" 1
1173 1 95 ILE MG 1 99 LEU QD . . 3.640 2.982 2.117 3.640 . 0 0 "[ . 1 . 2]" 1
1174 1 96 LYS H 1 96 LYS HB3 . . 3.450 2.421 2.275 2.969 . 0 0 "[ . 1 . 2]" 1
1175 1 96 LYS H 1 96 LYS HG3 . . 4.820 4.391 4.358 4.480 . 0 0 "[ . 1 . 2]" 1
1176 1 96 LYS H 1 97 THR H . . 3.480 2.870 2.162 3.092 . 0 0 "[ . 1 . 2]" 1
1177 1 96 LYS H 1 97 THR HB . . 5.340 5.264 4.504 5.406 0.066 6 0 "[ . 1 . 2]" 1
1178 1 96 LYS H 1 98 LEU H . . 4.830 4.155 3.475 4.605 . 0 0 "[ . 1 . 2]" 1
1179 1 96 LYS HA 1 96 LYS HD3 . . 4.620 2.779 2.336 4.222 . 0 0 "[ . 1 . 2]" 1
1180 1 96 LYS HA 1 96 LYS HG3 . . 3.970 3.287 3.009 3.680 . 0 0 "[ . 1 . 2]" 1
1181 1 96 LYS HA 1 99 LEU H . . 4.230 3.851 3.497 4.184 . 0 0 "[ . 1 . 2]" 1
1182 1 96 LYS HA 1 99 LEU HB3 . . 3.870 3.938 3.574 4.532 0.662 13 2 "[ . 1 + . -]" 1
1183 1 96 LYS HA 1 99 LEU QD . . 4.110 2.132 1.953 2.902 . 0 0 "[ . 1 . 2]" 1
1184 1 96 LYS HA 1 100 ASP H . . 4.980 4.570 3.920 5.055 0.075 15 0 "[ . 1 . 2]" 1
1185 1 96 LYS HB3 1 97 THR H . . 4.130 2.537 2.265 2.793 . 0 0 "[ . 1 . 2]" 1
1186 1 96 LYS HD3 1 130 TRP HA . . 5.160 3.682 2.535 5.210 0.050 4 0 "[ . 1 . 2]" 1
1187 1 96 LYS HE3 1 130 TRP HA . . 4.890 4.612 3.388 5.011 0.121 13 0 "[ . 1 . 2]" 1
1188 1 97 THR H 1 97 THR HB . . 3.490 2.690 2.320 3.030 . 0 0 "[ . 1 . 2]" 1
1189 1 97 THR H 1 97 THR MG . . 4.130 3.658 3.460 3.788 . 0 0 "[ . 1 . 2]" 1
1190 1 97 THR H 1 98 LEU H . . 3.570 2.737 2.479 2.945 . 0 0 "[ . 1 . 2]" 1
1191 1 97 THR H 1 99 LEU H . . 5.360 4.404 4.178 4.681 . 0 0 "[ . 1 . 2]" 1
1192 1 97 THR HA 1 97 THR MG . . 3.110 2.314 2.192 2.533 . 0 0 "[ . 1 . 2]" 1
1193 1 97 THR HA 1 100 ASP H . . 4.080 3.751 3.569 4.027 . 0 0 "[ . 1 . 2]" 1
1194 1 97 THR HA 1 100 ASP HB3 . . 3.870 3.624 2.959 3.938 0.068 9 0 "[ . 1 . 2]" 1
1195 1 97 THR HA 1 101 GLN H . . 5.200 4.977 4.550 5.277 0.077 8 0 "[ . 1 . 2]" 1
1196 1 97 THR HB 1 98 LEU H . . 3.430 2.800 2.366 3.499 0.069 18 0 "[ . 1 . 2]" 1
1197 1 97 THR MG 1 98 LEU HA . . 4.420 4.149 3.627 4.492 0.072 19 0 "[ . 1 . 2]" 1
1198 1 97 THR MG 1 100 ASP HB3 . . 4.720 4.204 3.844 4.776 0.056 2 0 "[ . 1 . 2]" 1
1199 1 97 THR MG 1 101 GLN HE21 . . 4.060 2.941 2.101 4.158 0.098 19 0 "[ . 1 . 2]" 1
1200 1 97 THR MG 1 101 GLN HG3 . . 4.220 4.112 3.414 5.346 1.126 12 3 "[ * . 1-+ . 2]" 1
1201 1 98 LEU H 1 98 LEU HB3 . . 3.450 2.577 2.276 3.594 0.144 13 0 "[ . 1 . 2]" 1
1202 1 98 LEU H 1 98 LEU QD . . 4.140 3.692 3.177 3.917 . 0 0 "[ . 1 . 2]" 1
1203 1 98 LEU H 1 98 LEU HG . . 4.920 4.259 2.358 4.543 . 0 0 "[ . 1 . 2]" 1
1204 1 98 LEU H 1 99 LEU H . . 3.740 2.664 2.229 2.919 . 0 0 "[ . 1 . 2]" 1
1205 1 98 LEU HA 1 98 LEU QD . . 3.210 2.185 2.090 2.405 . 0 0 "[ . 1 . 2]" 1
1206 1 98 LEU HA 1 98 LEU HG . . 3.830 3.111 2.633 3.526 . 0 0 "[ . 1 . 2]" 1
1207 1 98 LEU HA 1 101 GLN H . . 4.140 3.516 3.358 3.688 . 0 0 "[ . 1 . 2]" 1
1208 1 98 LEU HA 1 101 GLN HB3 . . 4.660 4.681 4.397 4.740 0.080 19 0 "[ . 1 . 2]" 1
1209 1 98 LEU HA 1 101 GLN HE21 . . 5.500 3.840 2.722 5.018 . 0 0 "[ . 1 . 2]" 1
1210 1 98 LEU HA 1 101 GLN HG3 . . 4.770 3.354 2.616 3.608 . 0 0 "[ . 1 . 2]" 1
1211 1 98 LEU HB3 1 99 LEU H . . 3.690 2.687 2.441 3.591 . 0 0 "[ . 1 . 2]" 1
1212 1 98 LEU HB3 1 99 LEU HA . . 4.430 4.269 3.719 4.486 0.056 14 0 "[ . 1 . 2]" 1
1213 1 98 LEU QD 1 99 LEU H . . 4.410 3.925 3.647 4.123 . 0 0 "[ . 1 . 2]" 1
1214 1 98 LEU QD 1 101 GLN H . . 5.340 4.357 3.888 4.975 . 0 0 "[ . 1 . 2]" 1
1215 1 98 LEU QD 1 101 GLN HB3 . . 5.100 4.281 3.694 5.012 . 0 0 "[ . 1 . 2]" 1
1216 1 98 LEU QD 1 102 MET H . . 5.200 4.362 3.542 5.302 0.102 8 0 "[ . 1 . 2]" 1
1217 1 98 LEU QD 1 102 MET HG3 . . 5.140 3.733 2.221 5.086 . 0 0 "[ . 1 . 2]" 1
1218 1 98 LEU HG 1 99 LEU H . . 4.590 3.867 3.194 4.662 0.072 10 0 "[ . 1 . 2]" 1
1219 1 99 LEU H 1 99 LEU HB3 . . 3.820 2.462 1.835 3.598 . 0 0 "[ . 1 . 2]" 1
1220 1 99 LEU H 1 99 LEU QD . . 3.810 3.101 2.423 3.255 . 0 0 "[ . 1 . 2]" 1
1221 1 99 LEU H 1 99 LEU HG . . 3.280 2.924 2.263 3.383 0.103 2 0 "[ . 1 . 2]" 1
1222 1 99 LEU H 1 100 ASP H . . 3.640 2.769 2.630 2.956 . 0 0 "[ . 1 . 2]" 1
1223 1 99 LEU HA 1 99 LEU QD . . 3.130 2.868 2.065 3.137 0.007 16 0 "[ . 1 . 2]" 1
1224 1 99 LEU HA 1 99 LEU HG . . 4.070 3.452 2.317 4.087 0.017 2 0 "[ . 1 . 2]" 1
1225 1 99 LEU HA 1 102 MET H . . 4.040 3.345 2.900 3.650 . 0 0 "[ . 1 . 2]" 1
1226 1 99 LEU HA 1 102 MET HB3 . . 4.690 4.264 3.450 5.013 0.323 19 0 "[ . 1 . 2]" 1
1227 1 99 LEU HA 1 102 MET ME . . 4.690 4.124 2.820 4.793 0.103 3 0 "[ . 1 . 2]" 1
1228 1 99 LEU HA 1 102 MET HG3 . . 4.480 2.504 1.961 3.478 . 0 0 "[ . 1 . 2]" 1
1229 1 99 LEU HB3 1 100 ASP H . . 3.780 3.716 3.349 3.865 0.085 18 0 "[ . 1 . 2]" 1
1230 1 99 LEU QD 1 100 ASP H . . 5.070 3.344 2.172 4.224 . 0 0 "[ . 1 . 2]" 1
1231 1 99 LEU QD 1 101 GLN H . . 5.500 4.812 4.111 5.259 . 0 0 "[ . 1 . 2]" 1
1232 1 99 LEU QD 1 102 MET H . . 5.290 4.594 4.141 5.044 . 0 0 "[ . 1 . 2]" 1
1233 1 99 LEU QD 1 130 TRP HA . . 5.240 3.998 2.917 5.059 . 0 0 "[ . 1 . 2]" 1
1234 1 99 LEU QD 1 131 ALA H . . 4.440 3.855 3.214 4.146 . 0 0 "[ . 1 . 2]" 1
1235 1 99 LEU QD 1 131 ALA HA . . 3.610 2.006 1.836 2.196 . 0 0 "[ . 1 . 2]" 1
1236 1 99 LEU QD 1 131 ALA MB . . 3.760 2.563 1.944 3.218 . 0 0 "[ . 1 . 2]" 1
1237 1 100 ASP H 1 100 ASP HB3 . . 3.480 2.732 2.374 3.148 . 0 0 "[ . 1 . 2]" 1
1238 1 100 ASP H 1 101 GLN H . . 3.470 2.685 2.529 2.871 . 0 0 "[ . 1 . 2]" 1
1239 1 100 ASP H 1 102 MET H . . 4.980 4.174 3.781 4.666 . 0 0 "[ . 1 . 2]" 1
1240 1 100 ASP HA 1 100 ASP HB3 . . 2.930 3.020 2.943 3.068 0.138 8 0 "[ . 1 . 2]" 1
1241 1 100 ASP HA 1 103 LYS HE3 . . 4.290 3.610 2.000 5.636 1.346 17 1 "[ . 1 . + 2]" 1
1242 1 100 ASP HB3 1 101 GLN H . . 4.100 2.847 2.554 3.263 . 0 0 "[ . 1 . 2]" 1
1243 1 101 GLN H 1 101 GLN HB3 . . 3.640 3.506 2.828 3.668 0.028 18 0 "[ . 1 . 2]" 1
1244 1 101 GLN H 1 101 GLN HG3 . . 3.630 2.564 2.150 3.679 0.049 16 0 "[ . 1 . 2]" 1
1245 1 101 GLN H 1 102 MET H . . 3.230 2.580 2.336 2.801 . 0 0 "[ . 1 . 2]" 1
1246 1 101 GLN H 1 103 LYS H . . 4.830 4.278 3.719 4.777 . 0 0 "[ . 1 . 2]" 1
1247 1 101 GLN HA 1 101 GLN HE21 . . 5.270 5.135 4.427 5.310 0.040 18 0 "[ . 1 . 2]" 1
1248 1 101 GLN HA 1 101 GLN HG3 . . 3.680 3.276 2.946 3.759 0.079 16 0 "[ . 1 . 2]" 1
1249 1 101 GLN HB3 1 102 MET H . . 4.440 3.931 3.207 4.634 0.194 11 0 "[ . 1 . 2]" 1
1250 1 102 MET H 1 102 MET HB3 . . 4.010 3.216 2.462 3.830 . 0 0 "[ . 1 . 2]" 1
1251 1 102 MET H 1 102 MET HG3 . . 4.360 2.503 1.929 3.659 . 0 0 "[ . 1 . 2]" 1
1252 1 102 MET H 1 103 LYS H . . 3.440 2.637 2.102 3.165 . 0 0 "[ . 1 . 2]" 1
1253 1 102 MET H 1 104 ASN H . . 5.500 5.050 4.569 5.574 0.074 14 0 "[ . 1 . 2]" 1
1254 1 102 MET H 1 134 LEU QD . . 5.500 4.528 3.608 5.229 . 0 0 "[ . 1 . 2]" 1
1255 1 102 MET HA 1 102 MET HG3 . . 3.650 3.448 2.773 3.693 0.043 16 0 "[ . 1 . 2]" 1
1256 1 102 MET HA 1 104 ASN H . . 4.480 3.639 3.174 4.203 . 0 0 "[ . 1 . 2]" 1
1257 1 102 MET HA 1 105 TYR H . . 4.760 4.272 3.821 4.841 0.081 13 0 "[ . 1 . 2]" 1
1258 1 102 MET HB3 1 134 LEU QD . . 4.830 4.152 2.194 5.712 0.882 5 1 "[ + 1 . 2]" 1
1259 1 103 LYS H 1 103 LYS HB3 . . 4.120 3.087 2.079 3.658 . 0 0 "[ . 1 . 2]" 1
1260 1 103 LYS H 1 103 LYS HG3 . . 4.240 3.604 2.324 4.326 0.086 10 0 "[ . 1 . 2]" 1
1261 1 103 LYS H 1 104 ASN H . . 3.520 3.013 2.578 3.354 . 0 0 "[ . 1 . 2]" 1
1262 1 103 LYS H 1 105 TYR H . . 4.950 4.610 4.383 4.997 0.047 13 0 "[ . 1 . 2]" 1
1263 1 103 LYS H 1 134 LEU QD . . 5.500 3.856 2.962 4.664 . 0 0 "[ . 1 . 2]" 1
1264 1 103 LYS HA 1 103 LYS HB3 . . 2.860 2.743 2.374 3.059 0.199 10 0 "[ . 1 . 2]" 1
1265 1 103 LYS HA 1 104 ASN H . . 3.360 3.412 3.195 3.454 0.094 13 0 "[ . 1 . 2]" 1
1266 1 103 LYS HA 1 105 TYR H . . 4.070 3.717 3.435 4.124 0.054 19 0 "[ . 1 . 2]" 1
1267 1 103 LYS HA 1 134 LEU QD . . 3.350 2.345 1.954 2.828 . 0 0 "[ . 1 . 2]" 1
1268 1 103 LYS HA 1 134 LEU HG . . 4.830 4.289 2.220 4.910 0.080 18 0 "[ . 1 . 2]" 1
1269 1 103 LYS HE3 1 134 LEU QD . . 5.050 4.606 3.497 5.898 0.848 5 1 "[ + 1 . 2]" 1
1270 1 104 ASN H 1 104 ASN HB3 . . 3.340 3.282 2.298 3.697 0.357 6 0 "[ . 1 . 2]" 1
1271 1 104 ASN H 1 104 ASN HD21 . . 5.400 2.953 2.088 4.589 . 0 0 "[ . 1 . 2]" 1
1272 1 104 ASN H 1 104 ASN HD22 . . 4.790 3.912 3.111 5.498 0.708 13 1 "[ . 1 + . 2]" 1
1273 1 104 ASN H 1 105 TYR H . . 3.250 2.654 2.033 3.303 0.053 13 0 "[ . 1 . 2]" 1
1274 1 104 ASN H 1 105 TYR HA . . 5.110 4.985 4.426 5.177 0.067 10 0 "[ . 1 . 2]" 1
1275 1 104 ASN H 1 134 LEU QD . . 5.250 4.275 3.762 4.647 . 0 0 "[ . 1 . 2]" 1
1276 1 104 ASN HB3 1 104 ASN HD22 . . 3.640 3.976 3.549 4.143 0.503 5 1 "[ + 1 . 2]" 1
1277 1 104 ASN HD21 1 105 TYR H . . 4.700 4.624 3.653 4.788 0.088 9 0 "[ . 1 . 2]" 1
1278 1 105 TYR H 1 105 TYR HB3 . . 3.600 2.579 2.201 3.649 0.049 10 0 "[ . 1 . 2]" 1
1279 1 105 TYR H 1 105 TYR QD . . 4.720 3.526 2.030 4.235 . 0 0 "[ . 1 . 2]" 1
1280 1 105 TYR H 1 106 ARG H . . 4.690 4.608 4.449 4.736 0.046 9 0 "[ . 1 . 2]" 1
1281 1 105 TYR H 1 134 LEU QD . . 4.220 3.104 2.532 3.900 . 0 0 "[ . 1 . 2]" 1
1282 1 105 TYR HA 1 106 ARG H . . 2.890 2.335 2.126 2.674 . 0 0 "[ . 1 . 2]" 1
1283 1 105 TYR HA 1 106 ARG HG3 . . 4.670 4.698 3.674 5.649 0.979 15 5 "[ * . *1 + * -]" 1
1284 1 105 TYR HB3 1 106 ARG H . . 4.430 3.722 2.205 4.244 . 0 0 "[ . 1 . 2]" 1
1285 1 105 TYR HB3 1 134 LEU QD . . 4.560 2.835 2.115 4.561 0.001 10 0 "[ . 1 . 2]" 1
1286 1 105 TYR QD 1 134 LEU QD . . 3.510 2.783 2.037 3.537 0.027 1 0 "[ . 1 . 2]" 1
1287 1 106 ARG H 1 106 ARG HB3 . . 3.850 3.729 3.424 3.894 0.044 5 0 "[ . 1 . 2]" 1
1288 1 106 ARG H 1 106 ARG HG3 . . 3.960 3.663 2.673 4.081 0.121 9 0 "[ . 1 . 2]" 1
1289 1 106 ARG H 1 107 GLY HA3 . . 5.350 4.579 4.094 5.856 0.506 20 1 "[ . 1 . +]" 1
1290 1 106 ARG HA 1 106 ARG HD3 . . 4.200 3.603 2.199 4.322 0.122 18 0 "[ . 1 . 2]" 1
1291 1 106 ARG HA 1 106 ARG HG3 . . 3.870 3.620 2.737 3.955 0.085 15 0 "[ . 1 . 2]" 1
1292 1 106 ARG HB3 1 106 ARG HD3 . . 4.020 3.142 2.462 3.798 . 0 0 "[ . 1 . 2]" 1
1293 1 107 GLY HA2 1 108 GLU H . . 3.550 2.815 2.449 3.394 . 0 0 "[ . 1 . 2]" 1
1294 1 107 GLY HA3 1 108 GLU H . . 3.370 2.456 2.121 3.632 0.262 20 0 "[ . 1 . 2]" 1
1295 1 108 GLU H 1 108 GLU HB3 . . 4.060 3.589 3.297 3.810 . 0 0 "[ . 1 . 2]" 1
1296 1 108 GLU H 1 108 GLU HG3 . . 4.430 3.032 2.313 3.984 . 0 0 "[ . 1 . 2]" 1
1297 1 108 GLU H 1 109 VAL H . . 4.870 4.517 3.748 4.660 . 0 0 "[ . 1 . 2]" 1
1298 1 108 GLU H 1 109 VAL HA . . 5.280 5.122 4.512 5.351 0.071 10 0 "[ . 1 . 2]" 1
1299 1 108 GLU H 1 109 VAL MG2 . . 4.200 4.050 2.602 4.286 0.086 18 0 "[ . 1 . 2]" 1
1300 1 108 GLU H 1 137 ILE MG . . 5.100 4.909 4.547 5.162 0.062 19 0 "[ . 1 . 2]" 1
1301 1 108 GLU HA 1 108 GLU HG3 . . 4.100 2.984 2.287 3.846 . 0 0 "[ . 1 . 2]" 1
1302 1 108 GLU HA 1 109 VAL H . . 3.120 2.289 2.137 2.515 . 0 0 "[ . 1 . 2]" 1
1303 1 108 GLU HA 1 109 VAL HA . . 4.590 4.488 4.375 4.548 . 0 0 "[ . 1 . 2]" 1
1304 1 108 GLU HA 1 135 ASN HD21 . . 4.030 2.315 1.887 2.921 . 0 0 "[ . 1 . 2]" 1
1305 1 108 GLU HA 1 135 ASN HD22 . . 3.640 3.204 2.359 3.714 0.074 20 0 "[ . 1 . 2]" 1
1306 1 108 GLU HA 1 137 ILE MG . . 3.460 2.803 2.274 3.190 . 0 0 "[ . 1 . 2]" 1
1307 1 108 GLU HB3 1 137 ILE MD . . 3.790 2.434 2.060 3.671 . 0 0 "[ . 1 . 2]" 1
1308 1 108 GLU HB3 1 137 ILE MG . . 3.560 2.465 1.975 3.402 . 0 0 "[ . 1 . 2]" 1
1309 1 108 GLU HG3 1 109 VAL H . . 5.000 4.897 3.583 5.197 0.197 4 0 "[ . 1 . 2]" 1
1310 1 108 GLU HG3 1 135 ASN HD21 . . 4.670 4.043 2.355 4.994 0.324 10 0 "[ . 1 . 2]" 1
1311 1 108 GLU HG3 1 135 ASN HD22 . . 4.670 4.182 2.367 5.114 0.444 10 0 "[ . 1 . 2]" 1
1312 1 108 GLU HG3 1 137 ILE MG . . 4.090 3.503 2.037 4.355 0.265 20 0 "[ . 1 . 2]" 1
1313 1 109 VAL H 1 109 VAL HB . . 3.340 2.770 2.565 3.057 . 0 0 "[ . 1 . 2]" 1
1314 1 109 VAL H 1 109 VAL MG1 . . 4.050 3.909 3.769 3.992 . 0 0 "[ . 1 . 2]" 1
1315 1 109 VAL H 1 109 VAL MG2 . . 3.910 2.885 2.605 3.192 . 0 0 "[ . 1 . 2]" 1
1316 1 109 VAL H 1 136 VAL HA . . 3.670 3.144 2.556 3.718 0.048 17 0 "[ . 1 . 2]" 1
1317 1 109 VAL H 1 136 VAL QG . . 5.190 4.295 3.713 4.709 . 0 0 "[ . 1 . 2]" 1
1318 1 109 VAL H 1 137 ILE H . . 4.270 3.042 2.695 3.429 . 0 0 "[ . 1 . 2]" 1
1319 1 109 VAL H 1 137 ILE HA . . 5.180 5.211 5.049 5.253 0.073 13 0 "[ . 1 . 2]" 1
1320 1 109 VAL H 1 137 ILE MD . . 4.940 3.978 3.561 4.456 . 0 0 "[ . 1 . 2]" 1
1321 1 109 VAL H 1 137 ILE MG . . 3.880 2.694 2.199 3.184 . 0 0 "[ . 1 . 2]" 1
1322 1 109 VAL HA 1 109 VAL MG1 . . 3.300 2.374 2.192 2.600 . 0 0 "[ . 1 . 2]" 1
1323 1 109 VAL HA 1 109 VAL MG2 . . 3.410 2.528 2.286 2.710 . 0 0 "[ . 1 . 2]" 1
1324 1 109 VAL HA 1 110 ALA H . . 2.880 2.303 2.213 2.390 . 0 0 "[ . 1 . 2]" 1
1325 1 109 VAL HA 1 110 ALA MB . . 4.240 4.155 4.017 4.291 0.051 20 0 "[ . 1 . 2]" 1
1326 1 109 VAL HB 1 110 ALA H . . 4.770 4.191 3.740 4.501 . 0 0 "[ . 1 . 2]" 1
1327 1 109 VAL HB 1 135 ASN HD21 . . 5.260 5.196 4.291 5.345 0.085 16 0 "[ . 1 . 2]" 1
1328 1 109 VAL HB 1 136 VAL HA . . 3.270 2.875 2.253 3.334 0.064 4 0 "[ . 1 . 2]" 1
1329 1 109 VAL HB 1 137 ILE H . . 4.480 4.232 3.843 4.556 0.076 10 0 "[ . 1 . 2]" 1
1330 1 109 VAL MG1 1 110 ALA H . . 3.330 2.784 2.223 3.437 0.107 3 0 "[ . 1 . 2]" 1
1331 1 109 VAL MG2 1 110 ALA H . . 4.590 4.263 3.800 4.543 . 0 0 "[ . 1 . 2]" 1
1332 1 110 ALA H 1 110 ALA MB . . 3.490 2.578 2.225 2.746 . 0 0 "[ . 1 . 2]" 1
1333 1 110 ALA H 1 111 SER H . . 4.940 4.497 4.356 4.766 . 0 0 "[ . 1 . 2]" 1
1334 1 110 ALA HA 1 111 SER H . . 3.140 2.377 2.186 2.536 . 0 0 "[ . 1 . 2]" 1
1335 1 110 ALA HA 1 136 VAL QG . . 3.560 2.583 2.035 3.307 . 0 0 "[ . 1 . 2]" 1
1336 1 110 ALA HA 1 138 GLY H . . 3.920 2.912 2.551 3.410 . 0 0 "[ . 1 . 2]" 1
1337 1 110 ALA MB 1 111 SER H . . 3.320 2.540 2.240 2.876 . 0 0 "[ . 1 . 2]" 1
1338 1 110 ALA MB 1 136 VAL QG . . 4.470 3.707 3.165 4.193 . 0 0 "[ . 1 . 2]" 1
1339 1 110 ALA MB 1 137 ILE H . . 4.130 3.597 3.275 4.099 . 0 0 "[ . 1 . 2]" 1
1340 1 110 ALA MB 1 137 ILE HA . . 5.220 5.220 4.875 5.320 0.100 11 0 "[ . 1 . 2]" 1
1341 1 110 ALA MB 1 137 ILE HB . . 5.500 4.476 4.235 4.702 . 0 0 "[ . 1 . 2]" 1
1342 1 110 ALA MB 1 137 ILE MD . . 3.730 2.473 2.135 2.933 . 0 0 "[ . 1 . 2]" 1
1343 1 110 ALA MB 1 137 ILE MG . . 5.110 4.347 3.944 4.696 . 0 0 "[ . 1 . 2]" 1
1344 1 110 ALA MB 1 138 GLY H . . 4.500 3.260 2.807 3.600 . 0 0 "[ . 1 . 2]" 1
1345 1 110 ALA MB 1 138 GLY HA2 . . 5.500 4.743 4.404 5.047 . 0 0 "[ . 1 . 2]" 1
1346 1 110 ALA MB 1 138 GLY HA3 . . 5.050 3.702 3.120 4.182 . 0 0 "[ . 1 . 2]" 1
1347 1 110 ALA MB 1 139 VAL HA . . 4.950 4.209 3.396 5.023 0.073 19 0 "[ . 1 . 2]" 1
1348 1 110 ALA MB 1 139 VAL QG . . 5.160 4.420 3.864 4.942 . 0 0 "[ . 1 . 2]" 1
1349 1 110 ALA MB 1 149 TRP HE1 . . 5.150 3.777 3.080 4.464 . 0 0 "[ . 1 . 2]" 1
1350 1 110 ALA MB 1 149 TRP HE3 . . 4.410 3.385 2.609 4.287 . 0 0 "[ . 1 . 2]" 1
1351 1 110 ALA MB 1 149 TRP HZ2 . . 4.640 3.883 3.187 4.618 . 0 0 "[ . 1 . 2]" 1
1352 1 111 SER H 1 111 SER HB3 . . 4.180 3.238 2.632 3.942 . 0 0 "[ . 1 . 2]" 1
1353 1 111 SER H 1 136 VAL QG . . 4.540 3.354 2.558 3.922 . 0 0 "[ . 1 . 2]" 1
1354 1 111 SER H 1 138 GLY H . . 4.880 4.057 3.658 4.717 . 0 0 "[ . 1 . 2]" 1
1355 1 111 SER H 1 139 VAL H . . 5.500 4.947 4.504 5.532 0.032 5 0 "[ . 1 . 2]" 1
1356 1 111 SER H 1 139 VAL HA . . 3.440 2.935 2.346 3.377 . 0 0 "[ . 1 . 2]" 1
1357 1 111 SER H 1 139 VAL QG . . 3.990 3.245 2.613 3.833 . 0 0 "[ . 1 . 2]" 1
1358 1 111 SER H 1 140 ALA H . . 4.530 4.323 3.967 4.592 0.062 1 0 "[ . 1 . 2]" 1
1359 1 111 SER HA 1 112 PHE H . . 3.230 2.239 2.090 2.445 . 0 0 "[ . 1 . 2]" 1
1360 1 111 SER HB3 1 112 PHE H . . 4.650 4.024 2.849 4.595 . 0 0 "[ . 1 . 2]" 1
1361 1 111 SER HB3 1 139 VAL QG . . 4.380 2.903 1.927 3.981 . 0 0 "[ . 1 . 2]" 1
1362 1 112 PHE HA 1 113 PHE H . . 3.110 2.400 2.181 2.599 . 0 0 "[ . 1 . 2]" 1
1363 1 112 PHE HA 1 139 VAL HA . . 4.760 4.072 3.614 4.544 . 0 0 "[ . 1 . 2]" 1
1364 1 112 PHE HA 1 140 ALA H . . 3.730 2.873 2.435 3.235 . 0 0 "[ . 1 . 2]" 1
1365 1 112 PHE HA 1 140 ALA HA . . 4.980 4.994 4.772 5.073 0.093 9 0 "[ . 1 . 2]" 1
1366 1 112 PHE HA 1 141 ARG HA . . 4.750 3.684 2.886 4.505 . 0 0 "[ . 1 . 2]" 1
1367 1 112 PHE HA 1 142 ASP H . . 5.160 5.040 4.383 5.239 0.079 1 0 "[ . 1 . 2]" 1
1368 1 112 PHE HB3 1 113 PHE H . . 4.230 3.656 2.275 4.209 . 0 0 "[ . 1 . 2]" 1
1369 1 113 PHE H 1 113 PHE QD . . 4.100 2.827 2.151 3.297 . 0 0 "[ . 1 . 2]" 1
1370 1 113 PHE H 1 114 THR MG . . 5.500 4.400 3.944 5.584 0.084 20 0 "[ . 1 . 2]" 1
1371 1 113 PHE H 1 140 ALA H . . 5.080 4.545 3.562 5.135 0.055 18 0 "[ . 1 . 2]" 1
1372 1 113 PHE H 1 141 ARG H . . 5.250 4.801 4.347 5.175 . 0 0 "[ . 1 . 2]" 1
1373 1 113 PHE H 1 141 ARG HA . . 3.640 2.238 1.788 2.936 . 0 0 "[ . 1 . 2]" 1
1374 1 113 PHE H 1 142 ASP H . . 3.920 3.330 2.749 3.974 0.054 11 0 "[ . 1 . 2]" 1
1375 1 113 PHE HA 1 114 THR H . . 3.180 2.523 2.333 2.770 . 0 0 "[ . 1 . 2]" 1
1376 1 113 PHE HA 1 114 THR MG . . 5.270 3.872 3.043 5.337 0.067 20 0 "[ . 1 . 2]" 1
1377 1 113 PHE HB3 1 114 THR H . . 4.020 2.860 2.096 3.790 . 0 0 "[ . 1 . 2]" 1
1378 1 113 PHE QD 1 114 THR H . . 4.700 3.867 3.545 4.231 . 0 0 "[ . 1 . 2]" 1
1379 1 113 PHE QD 1 139 VAL QG . . 3.560 3.244 2.392 3.657 0.097 5 0 "[ . 1 . 2]" 1
1380 1 113 PHE QD 1 140 ALA H . . 4.810 4.064 3.037 4.826 0.016 7 0 "[ . 1 . 2]" 1
1381 1 113 PHE QD 1 141 ARG HA . . 5.280 3.651 2.504 4.924 . 0 0 "[ . 1 . 2]" 1
1382 1 114 THR H 1 114 THR MG . . 4.230 3.260 2.369 3.998 . 0 0 "[ . 1 . 2]" 1
1383 1 114 THR H 1 115 SER H . . 5.000 3.762 2.128 4.547 . 0 0 "[ . 1 . 2]" 1
1384 1 114 THR HA 1 114 THR MG . . 3.580 2.326 2.079 3.124 . 0 0 "[ . 1 . 2]" 1
1385 1 114 THR HA 1 115 SER H . . 2.960 2.465 2.153 3.035 0.075 5 0 "[ . 1 . 2]" 1
1386 1 114 THR HA 1 142 ASP H . . 4.510 3.510 2.910 4.604 0.094 2 0 "[ . 1 . 2]" 1
1387 1 114 THR HB 1 115 SER H . . 4.290 3.611 2.566 4.372 0.082 12 0 "[ . 1 . 2]" 1
1388 1 114 THR MG 1 115 SER H . . 4.320 4.076 3.598 4.413 0.093 11 0 "[ . 1 . 2]" 1
1389 1 114 THR MG 1 142 ASP H . . 4.620 3.305 2.477 4.709 0.089 12 0 "[ . 1 . 2]" 1
1390 1 114 THR MG 1 142 ASP HA . . 4.490 3.158 2.155 4.562 0.072 16 0 "[ . 1 . 2]" 1
1391 1 115 SER HA 1 116 ALA H . . 3.230 2.517 2.136 2.682 . 0 0 "[ . 1 . 2]" 1
1392 1 115 SER HA 1 116 ALA MB . . 4.700 3.992 3.732 4.214 . 0 0 "[ . 1 . 2]" 1
1393 1 115 SER HA 1 117 GLY H . . 4.630 4.253 3.639 4.670 0.040 10 0 "[ . 1 . 2]" 1
1394 1 115 SER HB3 1 116 ALA H . . 3.740 2.997 2.182 3.805 0.065 11 0 "[ . 1 . 2]" 1
1395 1 115 SER HB3 1 117 GLY H . . 4.460 3.713 2.207 4.515 0.055 10 0 "[ . 1 . 2]" 1
1396 1 115 SER HB3 1 118 THR H . . 4.680 3.970 2.640 4.764 0.084 10 0 "[ . 1 . 2]" 1
1397 1 116 ALA H 1 116 ALA MB . . 3.240 2.231 2.074 2.386 . 0 0 "[ . 1 . 2]" 1
1398 1 116 ALA H 1 117 GLY H . . 3.420 2.997 2.825 3.316 . 0 0 "[ . 1 . 2]" 1
1399 1 116 ALA H 1 117 GLY HA2 . . 5.110 5.054 4.901 5.192 0.082 5 0 "[ . 1 . 2]" 1
1400 1 116 ALA H 1 117 GLY HA3 . . 5.110 5.191 5.154 5.207 0.097 13 0 "[ . 1 . 2]" 1
1401 1 116 ALA H 1 118 THR H . . 4.180 3.433 2.912 4.051 . 0 0 "[ . 1 . 2]" 1
1402 1 116 ALA HA 1 117 GLY HA2 . . 4.640 4.802 4.460 4.984 0.344 17 0 "[ . 1 . 2]" 1
1403 1 116 ALA MB 1 117 GLY H . . 4.200 3.683 3.549 3.773 . 0 0 "[ . 1 . 2]" 1
1404 1 116 ALA MB 1 118 THR H . . 4.880 3.642 2.915 4.522 . 0 0 "[ . 1 . 2]" 1
1405 1 116 ALA MB 1 118 THR MG . . 5.340 3.808 2.707 4.774 . 0 0 "[ . 1 . 2]" 1
1406 1 117 GLY H 1 118 THR MG . . 5.500 5.019 4.591 5.490 . 0 0 "[ . 1 . 2]" 1
1407 1 117 GLY HA3 1 118 THR MG . . 4.870 4.036 3.626 4.419 . 0 0 "[ . 1 . 2]" 1
1408 1 118 THR H 1 118 THR HB . . 4.080 3.587 3.320 3.838 . 0 0 "[ . 1 . 2]" 1
1409 1 118 THR H 1 118 THR MG . . 3.660 3.147 2.454 3.674 0.014 18 0 "[ . 1 . 2]" 1
1410 1 118 THR H 1 119 ASN H . . 4.880 4.460 4.327 4.615 . 0 0 "[ . 1 . 2]" 1
1411 1 118 THR H 1 120 HIS H . . 5.440 4.685 4.104 5.414 . 0 0 "[ . 1 . 2]" 1
1412 1 118 THR HA 1 118 THR HB . . 2.900 2.628 2.498 2.764 . 0 0 "[ . 1 . 2]" 1
1413 1 118 THR HA 1 118 THR MG . . 2.890 2.236 2.070 2.337 . 0 0 "[ . 1 . 2]" 1
1414 1 118 THR HA 1 119 ASN H . . 3.240 2.432 2.242 2.656 . 0 0 "[ . 1 . 2]" 1
1415 1 118 THR HB 1 119 ASN H . . 3.180 2.619 2.217 3.103 . 0 0 "[ . 1 . 2]" 1
1416 1 118 THR HB 1 119 ASN HB3 . . 4.900 5.048 4.763 5.515 0.615 13 2 "[ -. 1 + . 2]" 1
1417 1 118 THR HB 1 119 ASN HD22 . . 5.150 3.785 2.674 4.915 . 0 0 "[ . 1 . 2]" 1
1418 1 118 THR HB 1 120 HIS H . . 5.120 4.934 4.620 5.187 0.067 3 0 "[ . 1 . 2]" 1
1419 1 118 THR MG 1 119 ASN H . . 3.980 3.412 2.845 3.748 . 0 0 "[ . 1 . 2]" 1
1420 1 119 ASN H 1 119 ASN HA . . 2.850 2.216 2.162 2.250 . 0 0 "[ . 1 . 2]" 1
1421 1 119 ASN H 1 119 ASN HD22 . . 5.500 4.542 3.772 5.137 . 0 0 "[ . 1 . 2]" 1
1422 1 119 ASN H 1 120 HIS H . . 3.220 2.886 2.697 3.128 . 0 0 "[ . 1 . 2]" 1
1423 1 119 ASN H 1 121 LYS H . . 4.900 4.958 4.833 4.988 0.088 19 0 "[ . 1 . 2]" 1
1424 1 119 ASN HA 1 120 HIS H . . 3.380 3.023 2.811 3.211 . 0 0 "[ . 1 . 2]" 1
1425 1 119 ASN HA 1 122 ALA H . . 5.080 3.566 3.290 3.943 . 0 0 "[ . 1 . 2]" 1
1426 1 119 ASN HA 1 122 ALA MB . . 4.480 3.254 2.845 3.845 . 0 0 "[ . 1 . 2]" 1
1427 1 119 ASN HB3 1 119 ASN HD21 . . 3.590 3.104 2.418 3.524 . 0 0 "[ . 1 . 2]" 1
1428 1 119 ASN HB3 1 119 ASN HD22 . . 3.970 3.849 3.553 4.092 0.122 12 0 "[ . 1 . 2]" 1
1429 1 119 ASN HB3 1 120 HIS H . . 5.010 4.479 4.315 4.603 . 0 0 "[ . 1 . 2]" 1
1430 1 119 ASN HB3 1 122 ALA MB . . 4.690 2.522 2.102 3.130 . 0 0 "[ . 1 . 2]" 1
1431 1 120 HIS H 1 120 HIS HB3 . . 3.230 2.548 2.279 3.549 0.319 5 0 "[ . 1 . 2]" 1
1432 1 120 HIS H 1 121 LYS H . . 3.550 2.956 2.782 3.167 . 0 0 "[ . 1 . 2]" 1
1433 1 120 HIS H 1 122 ALA H . . 4.240 4.296 4.165 4.334 0.094 15 0 "[ . 1 . 2]" 1
1434 1 120 HIS HA 1 122 ALA H . . 4.910 4.405 3.691 4.737 . 0 0 "[ . 1 . 2]" 1
1435 1 120 HIS HA 1 123 TYR H . . 3.940 3.754 3.430 3.996 0.056 18 0 "[ . 1 . 2]" 1
1436 1 120 HIS HA 1 123 TYR HB3 . . 3.840 3.775 2.951 5.038 1.198 15 4 "[ * . - + *2]" 1
1437 1 120 HIS HA 1 124 VAL QG . . 5.500 4.042 3.808 4.499 . 0 0 "[ . 1 . 2]" 1
1438 1 120 HIS HB3 1 121 LYS H . . 4.130 3.674 2.155 4.209 0.079 12 0 "[ . 1 . 2]" 1
1439 1 121 LYS H 1 121 LYS HB3 . . 3.210 3.046 2.192 3.301 0.091 9 0 "[ . 1 . 2]" 1
1440 1 121 LYS H 1 122 ALA H . . 3.230 2.549 2.021 2.864 . 0 0 "[ . 1 . 2]" 1
1441 1 121 LYS H 1 122 ALA HA . . 5.390 5.177 4.750 5.437 0.047 18 0 "[ . 1 . 2]" 1
1442 1 121 LYS H 1 122 ALA MB . . 4.970 4.245 3.638 4.488 . 0 0 "[ . 1 . 2]" 1
1443 1 121 LYS H 1 123 TYR H . . 4.880 4.337 3.770 4.670 . 0 0 "[ . 1 . 2]" 1
1444 1 121 LYS HA 1 121 LYS HG3 . . 3.700 2.923 2.212 3.624 . 0 0 "[ . 1 . 2]" 1
1445 1 121 LYS HA 1 124 VAL H . . 4.040 3.731 3.412 4.132 0.092 15 0 "[ . 1 . 2]" 1
1446 1 121 LYS HA 1 124 VAL HB . . 3.590 3.225 2.723 3.645 0.055 3 0 "[ . 1 . 2]" 1
1447 1 121 LYS HA 1 124 VAL QG . . 3.650 2.983 2.142 3.567 . 0 0 "[ . 1 . 2]" 1
1448 1 121 LYS HA 1 125 SER H . . 4.950 4.426 4.008 4.980 0.030 11 0 "[ . 1 . 2]" 1
1449 1 121 LYS HB3 1 122 ALA H . . 3.490 2.987 2.500 3.516 0.026 9 0 "[ . 1 . 2]" 1
1450 1 122 ALA H 1 122 ALA MB . . 2.990 2.258 2.194 2.370 . 0 0 "[ . 1 . 2]" 1
1451 1 122 ALA H 1 123 TYR H . . 3.530 2.782 2.570 3.047 . 0 0 "[ . 1 . 2]" 1
1452 1 122 ALA H 1 124 VAL H . . 4.810 4.393 4.220 4.607 . 0 0 "[ . 1 . 2]" 1
1453 1 122 ALA H 1 124 VAL QG . . 5.500 4.806 3.703 5.238 . 0 0 "[ . 1 . 2]" 1
1454 1 122 ALA H 1 125 SER H . . 4.990 4.988 4.736 5.077 0.087 11 0 "[ . 1 . 2]" 1
1455 1 122 ALA HA 1 124 VAL H . . 5.000 4.576 3.719 4.901 . 0 0 "[ . 1 . 2]" 1
1456 1 122 ALA HA 1 125 SER H . . 3.700 3.614 3.150 3.774 0.074 11 0 "[ . 1 . 2]" 1
1457 1 122 ALA HA 1 126 HIS H . . 4.410 3.955 3.624 4.475 0.065 5 0 "[ . 1 . 2]" 1
1458 1 122 ALA MB 1 123 TYR H . . 3.630 2.509 2.219 2.937 . 0 0 "[ . 1 . 2]" 1
1459 1 122 ALA MB 1 125 SER H . . 5.130 4.758 4.464 4.886 . 0 0 "[ . 1 . 2]" 1
1460 1 122 ALA MB 1 126 HIS H . . 5.210 4.429 4.066 4.853 . 0 0 "[ . 1 . 2]" 1
1461 1 122 ALA MB 1 126 HIS HD2 . . 4.930 4.635 3.246 5.035 0.105 11 0 "[ . 1 . 2]" 1
1462 1 123 TYR H 1 123 TYR HB3 . . 3.420 2.604 2.009 3.570 0.150 10 0 "[ . 1 . 2]" 1
1463 1 123 TYR H 1 123 TYR QD . . 5.000 3.352 2.094 4.241 . 0 0 "[ . 1 . 2]" 1
1464 1 123 TYR H 1 124 VAL H . . 3.480 2.914 2.544 3.104 . 0 0 "[ . 1 . 2]" 1
1465 1 123 TYR H 1 124 VAL QG . . 5.220 4.027 2.410 4.383 . 0 0 "[ . 1 . 2]" 1
1466 1 123 TYR H 1 126 HIS H . . 5.470 4.783 4.628 5.068 . 0 0 "[ . 1 . 2]" 1
1467 1 123 TYR HA 1 126 HIS H . . 4.110 3.623 3.245 4.171 0.061 15 0 "[ . 1 . 2]" 1
1468 1 123 TYR HA 1 126 HIS HB3 . . 4.810 3.776 2.639 4.894 0.084 20 0 "[ . 1 . 2]" 1
1469 1 123 TYR HB3 1 124 VAL H . . 3.670 3.200 2.306 4.170 0.500 15 0 "[ . 1 . 2]" 1
1470 1 123 TYR HB3 1 124 VAL HA . . 5.400 4.849 4.007 5.493 0.093 3 0 "[ . 1 . 2]" 1
1471 1 123 TYR HB3 1 124 VAL QG . . 4.160 3.751 3.092 4.210 0.050 7 0 "[ . 1 . 2]" 1
1472 1 123 TYR QD 1 124 VAL QG . . 4.120 3.201 2.296 4.052 . 0 0 "[ . 1 . 2]" 1
1473 1 124 VAL H 1 124 VAL HB . . 3.030 2.520 2.297 2.953 . 0 0 "[ . 1 . 2]" 1
1474 1 124 VAL H 1 124 VAL QG . . 2.950 1.975 1.744 2.214 . 0 0 "[ . 1 . 2]" 1
1475 1 124 VAL H 1 139 VAL QG . . 5.050 4.350 3.579 4.984 . 0 0 "[ . 1 . 2]" 1
1476 1 124 VAL HA 1 124 VAL QG . . 3.240 2.174 2.115 2.284 . 0 0 "[ . 1 . 2]" 1
1477 1 124 VAL HA 1 127 PHE H . . 5.070 3.877 3.397 5.048 . 0 0 "[ . 1 . 2]" 1
1478 1 124 VAL HA 1 139 VAL HB . . 4.480 4.495 4.047 4.581 0.101 8 0 "[ . 1 . 2]" 1
1479 1 124 VAL HA 1 139 VAL QG . . 3.490 2.568 2.069 3.121 . 0 0 "[ . 1 . 2]" 1
1480 1 124 VAL HB 1 125 SER H . . 3.260 2.615 2.242 2.959 . 0 0 "[ . 1 . 2]" 1
1481 1 124 VAL HB 1 125 SER HA . . 4.870 4.421 3.926 4.738 . 0 0 "[ . 1 . 2]" 1
1482 1 124 VAL QG 1 125 SER H . . 4.030 3.254 2.884 3.482 . 0 0 "[ . 1 . 2]" 1
1483 1 124 VAL QG 1 125 SER HA . . 4.030 3.673 3.129 3.990 . 0 0 "[ . 1 . 2]" 1
1484 1 124 VAL QG 1 126 HIS H . . 5.500 4.766 4.428 4.993 . 0 0 "[ . 1 . 2]" 1
1485 1 124 VAL QG 1 128 ASN QD . . 3.710 2.584 2.218 3.594 . 0 0 "[ . 1 . 2]" 1
1486 1 124 VAL QG 1 139 VAL H . . 4.920 4.431 3.648 4.749 . 0 0 "[ . 1 . 2]" 1
1487 1 125 SER H 1 126 HIS H . . 3.310 2.664 2.148 2.880 . 0 0 "[ . 1 . 2]" 1
1488 1 125 SER HA 1 128 ASN HB3 . . 4.540 4.280 3.615 4.612 0.072 4 0 "[ . 1 . 2]" 1
1489 1 125 SER HA 1 128 ASN QD . . 4.600 3.187 2.930 4.136 . 0 0 "[ . 1 . 2]" 1
1490 1 125 SER HA 1 129 GLU H . . 5.370 4.478 3.820 5.438 0.068 11 0 "[ . 1 . 2]" 1
1491 1 126 HIS H 1 126 HIS HB3 . . 3.790 3.149 2.209 3.617 . 0 0 "[ . 1 . 2]" 1
1492 1 126 HIS H 1 126 HIS HD2 . . 4.800 3.797 2.279 4.888 0.088 17 0 "[ . 1 . 2]" 1
1493 1 126 HIS H 1 127 PHE H . . 3.410 2.727 2.352 3.081 . 0 0 "[ . 1 . 2]" 1
1494 1 126 HIS HA 1 126 HIS HD2 . . 3.430 2.930 2.205 3.521 0.091 11 0 "[ . 1 . 2]" 1
1495 1 126 HIS HA 1 129 GLU H . . 3.840 3.589 3.220 3.861 0.021 13 0 "[ . 1 . 2]" 1
1496 1 126 HIS HB3 1 127 PHE H . . 4.180 3.227 2.299 4.245 0.065 7 0 "[ . 1 . 2]" 1
1497 1 127 PHE H 1 127 PHE HB3 . . 3.400 2.428 2.089 2.703 . 0 0 "[ . 1 . 2]" 1
1498 1 127 PHE H 1 127 PHE QD . . 4.360 4.103 2.508 4.269 . 0 0 "[ . 1 . 2]" 1
1499 1 127 PHE H 1 128 ASN H . . 3.380 2.724 2.405 2.928 . 0 0 "[ . 1 . 2]" 1
1500 1 127 PHE H 1 129 GLU H . . 5.050 4.462 4.174 4.938 . 0 0 "[ . 1 . 2]" 1
1501 1 127 PHE HA 1 127 PHE QD . . 3.620 2.747 2.341 3.698 0.078 12 0 "[ . 1 . 2]" 1
1502 1 127 PHE HA 1 128 ASN HA . . 5.150 4.845 4.747 4.942 . 0 0 "[ . 1 . 2]" 1
1503 1 127 PHE HA 1 130 TRP H . . 4.570 3.583 3.005 3.989 . 0 0 "[ . 1 . 2]" 1
1504 1 127 PHE HA 1 131 ALA H . . 5.440 4.900 4.383 5.432 . 0 0 "[ . 1 . 2]" 1
1505 1 127 PHE HA 1 131 ALA MB . . 4.180 3.879 3.520 4.245 0.065 11 0 "[ . 1 . 2]" 1
1506 1 127 PHE QD 1 128 ASN H . . 4.040 3.388 2.448 4.102 0.062 5 0 "[ . 1 . 2]" 1
1507 1 127 PHE QD 1 128 ASN HA . . 4.680 3.568 2.866 4.479 . 0 0 "[ . 1 . 2]" 1
1508 1 127 PHE QD 1 128 ASN QD . . 5.350 3.478 2.127 4.934 . 0 0 "[ . 1 . 2]" 1
1509 1 127 PHE QD 1 139 VAL QG . . 4.520 2.944 2.081 4.173 . 0 0 "[ . 1 . 2]" 1
1510 1 128 ASN H 1 128 ASN HB3 . . 3.680 3.554 3.138 3.649 . 0 0 "[ . 1 . 2]" 1
1511 1 128 ASN H 1 128 ASN QD . . 4.300 2.640 2.254 4.040 . 0 0 "[ . 1 . 2]" 1
1512 1 128 ASN H 1 129 GLU H . . 3.760 2.957 2.658 3.205 . 0 0 "[ . 1 . 2]" 1
1513 1 128 ASN HA 1 131 ALA H . . 4.070 3.651 3.357 4.143 0.073 10 0 "[ . 1 . 2]" 1
1514 1 128 ASN HA 1 131 ALA MB . . 3.400 2.941 2.161 3.462 0.062 13 0 "[ . 1 . 2]" 1
1515 1 128 ASN HB3 1 129 GLU H . . 4.190 3.255 2.857 3.680 . 0 0 "[ . 1 . 2]" 1
1516 1 128 ASN QD 1 139 VAL QG . . 4.520 3.087 2.004 3.644 . 0 0 "[ . 1 . 2]" 1
1517 1 129 GLU H 1 129 GLU HB3 . . 3.590 3.420 3.055 3.586 . 0 0 "[ . 1 . 2]" 1
1518 1 129 GLU H 1 129 GLU HG3 . . 3.830 3.396 2.097 3.919 0.089 12 0 "[ . 1 . 2]" 1
1519 1 129 GLU H 1 130 TRP H . . 3.440 2.783 2.350 2.941 . 0 0 "[ . 1 . 2]" 1
1520 1 129 GLU H 1 131 ALA H . . 4.530 4.227 4.002 4.418 . 0 0 "[ . 1 . 2]" 1
1521 1 129 GLU H 1 131 ALA MB . . 5.300 5.075 4.541 5.356 0.056 8 0 "[ . 1 . 2]" 1
1522 1 129 GLU HA 1 129 GLU HG3 . . 3.600 3.406 2.807 3.663 0.063 2 0 "[ . 1 . 2]" 1
1523 1 129 GLU HA 1 131 ALA H . . 5.350 3.964 3.718 4.285 . 0 0 "[ . 1 . 2]" 1
1524 1 129 GLU HA 1 132 ASP H . . 4.690 4.226 3.768 4.761 0.071 2 0 "[ . 1 . 2]" 1
1525 1 129 GLU HB3 1 130 TRP H . . 3.780 3.195 2.289 3.850 0.070 18 0 "[ . 1 . 2]" 1
1526 1 129 GLU HB3 1 130 TRP HD1 . . 4.390 3.724 2.623 4.469 0.079 15 0 "[ . 1 . 2]" 1
1527 1 130 TRP H 1 130 TRP HD1 . . 3.910 3.174 2.581 3.747 . 0 0 "[ . 1 . 2]" 1
1528 1 130 TRP H 1 130 TRP HE1 . . 5.220 4.967 4.382 5.279 0.059 11 0 "[ . 1 . 2]" 1
1529 1 130 TRP H 1 131 ALA H . . 3.280 2.654 2.209 3.094 . 0 0 "[ . 1 . 2]" 1
1530 1 130 TRP H 1 132 ASP H . . 4.830 4.367 3.847 4.881 0.051 9 0 "[ . 1 . 2]" 1
1531 1 130 TRP HA 1 132 ASP H . . 4.600 4.147 3.700 4.449 . 0 0 "[ . 1 . 2]" 1
1532 1 131 ALA H 1 131 ALA MB . . 3.000 2.669 2.495 2.896 . 0 0 "[ . 1 . 2]" 1
1533 1 131 ALA H 1 132 ASP H . . 3.430 2.005 1.669 2.319 . 0 0 "[ . 1 . 2]" 1
1534 1 131 ALA H 1 132 ASP HA . . 4.280 4.202 3.884 4.357 0.077 19 0 "[ . 1 . 2]" 1
1535 1 131 ALA H 1 132 ASP HB3 . . 4.650 4.535 4.267 4.714 0.064 2 0 "[ . 1 . 2]" 1
1536 1 131 ALA HA 1 132 ASP HA . . 4.780 4.738 4.431 4.854 0.074 20 0 "[ . 1 . 2]" 1
1537 1 131 ALA MB 1 132 ASP H . . 4.380 3.507 3.033 3.777 . 0 0 "[ . 1 . 2]" 1
1538 1 131 ALA MB 1 132 ASP HA . . 5.460 4.078 3.725 4.334 . 0 0 "[ . 1 . 2]" 1
1539 1 131 ALA MB 1 133 GLY H . . 5.500 4.717 3.849 5.598 0.098 11 0 "[ . 1 . 2]" 1
1540 1 132 ASP H 1 132 ASP HB3 . . 3.290 2.743 2.456 3.132 . 0 0 "[ . 1 . 2]" 1
1541 1 132 ASP H 1 133 GLY H . . 4.390 4.103 2.768 4.478 0.088 17 0 "[ . 1 . 2]" 1
1542 1 132 ASP HA 1 133 GLY H . . 2.710 2.290 2.054 2.794 0.084 14 0 "[ . 1 . 2]" 1
1543 1 132 ASP HA 1 133 GLY HA3 . . 5.070 4.564 4.273 4.950 . 0 0 "[ . 1 . 2]" 1
1544 1 132 ASP HB3 1 133 GLY H . . 4.220 4.120 3.430 4.307 0.087 7 0 "[ . 1 . 2]" 1
1545 1 133 GLY H 1 134 LEU H . . 3.300 2.439 1.879 3.057 . 0 0 "[ . 1 . 2]" 1
1546 1 134 LEU H 1 134 LEU HB3 . . 3.830 3.695 3.516 3.888 0.058 16 0 "[ . 1 . 2]" 1
1547 1 134 LEU H 1 134 LEU QD . . 3.980 2.931 2.289 3.688 . 0 0 "[ . 1 . 2]" 1
1548 1 134 LEU H 1 135 ASN H . . 5.100 4.457 4.287 4.700 . 0 0 "[ . 1 . 2]" 1
1549 1 134 LEU HA 1 134 LEU QD . . 3.100 2.162 1.974 2.657 . 0 0 "[ . 1 . 2]" 1
1550 1 134 LEU HA 1 135 ASN H . . 3.170 2.336 2.132 2.774 . 0 0 "[ . 1 . 2]" 1
1551 1 134 LEU HB3 1 135 ASN H . . 3.720 2.624 1.896 3.272 . 0 0 "[ . 1 . 2]" 1
1552 1 134 LEU QD 1 135 ASN H . . 4.150 3.208 2.695 3.526 . 0 0 "[ . 1 . 2]" 1
1553 1 134 LEU QD 1 135 ASN HB3 . . 5.500 4.662 3.918 5.162 . 0 0 "[ . 1 . 2]" 1
1554 1 135 ASN H 1 135 ASN HB3 . . 3.590 2.379 2.149 2.908 . 0 0 "[ . 1 . 2]" 1
1555 1 135 ASN H 1 135 ASN HD21 . . 5.230 4.347 2.883 4.727 . 0 0 "[ . 1 . 2]" 1
1556 1 135 ASN H 1 136 VAL H . . 4.590 4.341 3.974 4.668 0.078 20 0 "[ . 1 . 2]" 1
1557 1 135 ASN H 1 136 VAL QG . . 5.500 4.790 4.266 5.318 . 0 0 "[ . 1 . 2]" 1
1558 1 135 ASN HA 1 136 VAL H . . 2.910 2.252 2.180 2.486 . 0 0 "[ . 1 . 2]" 1
1559 1 135 ASN HB3 1 136 VAL H . . 4.460 4.396 3.888 4.596 0.136 15 0 "[ . 1 . 2]" 1
1560 1 135 ASN HD21 1 137 ILE MG . . 4.670 3.287 2.417 4.200 . 0 0 "[ . 1 . 2]" 1
1561 1 135 ASN HD22 1 137 ILE MG . . 4.930 2.716 2.013 5.009 0.079 9 0 "[ . 1 . 2]" 1
1562 1 136 VAL H 1 136 VAL HB . . 3.040 2.710 2.367 3.103 0.063 13 0 "[ . 1 . 2]" 1
1563 1 136 VAL H 1 136 VAL QG . . 3.280 2.319 1.864 3.038 . 0 0 "[ . 1 . 2]" 1
1564 1 136 VAL H 1 137 ILE H . . 4.950 4.429 4.078 4.668 . 0 0 "[ . 1 . 2]" 1
1565 1 136 VAL H 1 137 ILE MG . . 5.490 4.712 4.097 5.153 . 0 0 "[ . 1 . 2]" 1
1566 1 136 VAL HA 1 136 VAL QG . . 3.000 2.219 2.100 2.450 . 0 0 "[ . 1 . 2]" 1
1567 1 136 VAL HA 1 137 ILE H . . 2.990 2.210 2.037 2.389 . 0 0 "[ . 1 . 2]" 1
1568 1 136 VAL HA 1 138 GLY H . . 3.970 3.710 3.193 4.006 0.036 13 0 "[ . 1 . 2]" 1
1569 1 136 VAL HB 1 137 ILE H . . 4.700 4.275 3.983 4.485 . 0 0 "[ . 1 . 2]" 1
1570 1 136 VAL HB 1 138 GLY H . . 4.710 4.485 4.223 4.780 0.070 9 0 "[ . 1 . 2]" 1
1571 1 136 VAL QG 1 137 ILE H . . 3.520 2.784 2.393 3.179 . 0 0 "[ . 1 . 2]" 1
1572 1 136 VAL QG 1 137 ILE HA . . 4.870 3.876 3.630 4.212 . 0 0 "[ . 1 . 2]" 1
1573 1 136 VAL QG 1 138 GLY H . . 3.410 2.091 1.894 2.441 . 0 0 "[ . 1 . 2]" 1
1574 1 136 VAL QG 1 138 GLY HA2 . . 4.290 3.352 2.847 3.757 . 0 0 "[ . 1 . 2]" 1
1575 1 136 VAL QG 1 139 VAL H . . 4.740 4.107 3.787 4.466 . 0 0 "[ . 1 . 2]" 1
1576 1 137 ILE H 1 137 ILE MD . . 3.630 3.726 3.706 3.742 0.112 14 0 "[ . 1 . 2]" 1
1577 1 137 ILE H 1 137 ILE MG . . 3.270 2.581 2.348 2.872 . 0 0 "[ . 1 . 2]" 1
1578 1 137 ILE H 1 138 GLY H . . 3.360 2.444 2.175 2.777 . 0 0 "[ . 1 . 2]" 1
1579 1 137 ILE H 1 138 GLY HA3 . . 5.500 4.972 4.681 5.239 . 0 0 "[ . 1 . 2]" 1
1580 1 137 ILE HA 1 137 ILE HB . . 2.880 2.448 2.377 2.530 . 0 0 "[ . 1 . 2]" 1
1581 1 137 ILE HA 1 137 ILE MD . . 4.220 4.138 3.804 4.255 0.035 16 0 "[ . 1 . 2]" 1
1582 1 137 ILE HA 1 137 ILE MG . . 2.980 2.260 2.201 2.327 . 0 0 "[ . 1 . 2]" 1
1583 1 137 ILE HB 1 137 ILE MD . . 3.090 2.331 2.198 2.476 . 0 0 "[ . 1 . 2]" 1
1584 1 137 ILE HB 1 138 GLY H . . 4.730 4.245 4.024 4.446 . 0 0 "[ . 1 . 2]" 1
1585 1 137 ILE MD 1 149 TRP H . . 4.780 4.513 4.305 4.864 0.084 12 0 "[ . 1 . 2]" 1
1586 1 137 ILE MD 1 149 TRP HA . . 3.280 2.210 1.916 2.641 . 0 0 "[ . 1 . 2]" 1
1587 1 137 ILE MD 1 149 TRP HB3 . . 4.310 2.666 2.204 3.195 . 0 0 "[ . 1 . 2]" 1
1588 1 137 ILE MD 1 149 TRP HD1 . . 3.640 2.370 2.012 2.803 . 0 0 "[ . 1 . 2]" 1
1589 1 137 ILE MD 1 149 TRP HE1 . . 4.840 4.081 3.413 4.625 . 0 0 "[ . 1 . 2]" 1
1590 1 137 ILE MD 1 149 TRP HE3 . . 5.470 5.160 4.656 5.568 0.098 9 0 "[ . 1 . 2]" 1
1591 1 138 GLY H 1 139 VAL H . . 4.380 4.241 4.074 4.381 0.001 8 0 "[ . 1 . 2]" 1
1592 1 138 GLY H 1 149 TRP HE1 . . 5.500 4.556 4.147 5.198 . 0 0 "[ . 1 . 2]" 1
1593 1 138 GLY HA2 1 139 VAL H . . 2.990 2.324 2.154 2.489 . 0 0 "[ . 1 . 2]" 1
1594 1 138 GLY HA2 1 139 VAL QG . . 4.370 3.423 3.138 3.798 . 0 0 "[ . 1 . 2]" 1
1595 1 138 GLY HA2 1 149 TRP HE1 . . 4.060 3.968 3.538 4.128 0.068 11 0 "[ . 1 . 2]" 1
1596 1 138 GLY HA2 1 149 TRP HZ2 . . 4.810 4.348 3.728 4.878 0.068 18 0 "[ . 1 . 2]" 1
1597 1 138 GLY HA3 1 139 VAL H . . 3.160 2.847 2.636 3.173 0.013 11 0 "[ . 1 . 2]" 1
1598 1 138 GLY HA3 1 139 VAL QG . . 4.730 4.220 4.109 4.406 . 0 0 "[ . 1 . 2]" 1
1599 1 138 GLY HA3 1 149 TRP HE1 . . 3.540 2.338 2.131 2.642 . 0 0 "[ . 1 . 2]" 1
1600 1 138 GLY HA3 1 149 TRP HZ2 . . 4.850 3.072 2.396 3.726 . 0 0 "[ . 1 . 2]" 1
1601 1 139 VAL H 1 139 VAL HB . . 3.480 3.124 2.777 3.589 0.109 11 0 "[ . 1 . 2]" 1
1602 1 139 VAL H 1 139 VAL QG . . 3.780 2.719 2.292 2.991 . 0 0 "[ . 1 . 2]" 1
1603 1 139 VAL H 1 140 ALA H . . 4.750 3.986 3.582 4.249 . 0 0 "[ . 1 . 2]" 1
1604 1 139 VAL H 1 140 ALA MB . . 5.500 3.970 3.528 4.295 . 0 0 "[ . 1 . 2]" 1
1605 1 139 VAL H 1 149 TRP HE1 . . 4.700 4.688 4.138 4.795 0.095 19 0 "[ . 1 . 2]" 1
1606 1 139 VAL H 1 149 TRP HZ2 . . 4.440 3.497 2.925 4.239 . 0 0 "[ . 1 . 2]" 1
1607 1 139 VAL HA 1 140 ALA H . . 3.070 2.198 1.999 2.340 . 0 0 "[ . 1 . 2]" 1
1608 1 139 VAL HA 1 140 ALA MB . . 5.330 4.071 3.844 4.270 . 0 0 "[ . 1 . 2]" 1
1609 1 139 VAL HA 1 149 TRP HZ2 . . 4.150 3.656 2.650 4.185 0.035 15 0 "[ . 1 . 2]" 1
1610 1 139 VAL HB 1 140 ALA H . . 5.100 4.211 2.979 4.552 . 0 0 "[ . 1 . 2]" 1
1611 1 139 VAL QG 1 140 ALA H . . 3.690 2.981 2.418 3.454 . 0 0 "[ . 1 . 2]" 1
1612 1 139 VAL QG 1 140 ALA HA . . 4.960 3.774 3.163 4.137 . 0 0 "[ . 1 . 2]" 1
1613 1 140 ALA H 1 140 ALA MB . . 3.610 2.712 2.546 2.923 . 0 0 "[ . 1 . 2]" 1
1614 1 140 ALA H 1 141 ARG H . . 5.000 4.376 4.162 4.527 . 0 0 "[ . 1 . 2]" 1
1615 1 140 ALA H 1 149 TRP HZ2 . . 4.180 3.305 2.708 4.235 0.055 3 0 "[ . 1 . 2]" 1
1616 1 140 ALA HA 1 141 ARG H . . 2.990 2.698 2.226 3.018 0.028 8 0 "[ . 1 . 2]" 1
1617 1 140 ALA MB 1 141 ARG H . . 3.270 2.232 1.890 2.855 . 0 0 "[ . 1 . 2]" 1
1618 1 140 ALA MB 1 144 SER H . . 5.320 4.403 3.715 4.941 . 0 0 "[ . 1 . 2]" 1
1619 1 140 ALA MB 1 145 GLU H . . 3.910 3.803 3.275 4.001 0.091 15 0 "[ . 1 . 2]" 1
1620 1 140 ALA MB 1 145 GLU HB3 . . 3.350 3.880 3.252 4.303 0.953 18 10 "[ ** * * * * *.- + *]" 1
1621 1 140 ALA MB 1 145 GLU HG3 . . 3.320 2.648 2.177 3.405 0.085 12 0 "[ . 1 . 2]" 1
1622 1 140 ALA MB 1 149 TRP HE1 . . 4.960 4.642 4.108 5.044 0.084 3 0 "[ . 1 . 2]" 1
1623 1 140 ALA MB 1 149 TRP HZ2 . . 3.390 2.481 2.160 2.870 . 0 0 "[ . 1 . 2]" 1
1624 1 141 ARG H 1 141 ARG HB3 . . 3.860 3.086 2.220 3.834 . 0 0 "[ . 1 . 2]" 1
1625 1 141 ARG H 1 141 ARG HD3 . . 3.910 3.429 2.257 4.072 0.162 20 0 "[ . 1 . 2]" 1
1626 1 141 ARG H 1 141 ARG HG3 . . 4.700 3.816 2.747 4.658 . 0 0 "[ . 1 . 2]" 1
1627 1 141 ARG H 1 142 ASP H . . 4.540 4.228 2.661 4.545 0.005 7 0 "[ . 1 . 2]" 1
1628 1 141 ARG HA 1 141 ARG HG3 . . 3.900 3.856 2.470 4.239 0.339 11 0 "[ . 1 . 2]" 1
1629 1 141 ARG HA 1 142 ASP H . . 3.050 2.355 2.155 2.938 . 0 0 "[ . 1 . 2]" 1
1630 1 141 ARG HA 1 142 ASP HA . . 4.620 4.434 4.258 4.689 0.069 12 0 "[ . 1 . 2]" 1
1631 1 141 ARG HG3 1 142 ASP H . . 4.160 3.955 3.355 4.378 0.218 16 0 "[ . 1 . 2]" 1
1632 1 142 ASP H 1 143 ASP H . . 5.160 4.630 4.230 4.790 . 0 0 "[ . 1 . 2]" 1
1633 1 142 ASP HB3 1 143 ASP H . . 3.170 1.975 1.743 3.138 . 0 0 "[ . 1 . 2]" 1
1634 1 142 ASP HB3 1 144 SER H . . 4.080 3.852 3.169 4.400 0.320 17 0 "[ . 1 . 2]" 1
1635 1 143 ASP H 1 144 SER H . . 3.540 2.891 2.517 3.573 0.033 3 0 "[ . 1 . 2]" 1
1636 1 143 ASP HA 1 146 VAL H . . 4.900 3.848 3.358 4.292 . 0 0 "[ . 1 . 2]" 1
1637 1 143 ASP HA 1 146 VAL QG . . 3.300 2.754 2.282 3.393 0.093 17 0 "[ . 1 . 2]" 1
1638 1 143 ASP HB3 1 144 SER H . . 5.190 4.621 4.495 4.768 . 0 0 "[ . 1 . 2]" 1
1639 1 143 ASP HB3 1 146 VAL QG . . 4.060 3.621 2.997 4.139 0.079 17 0 "[ . 1 . 2]" 1
1640 1 144 SER H 1 144 SER HB3 . . 3.100 3.014 2.182 3.418 0.318 4 0 "[ . 1 . 2]" 1
1641 1 144 SER H 1 145 GLU H . . 3.560 2.802 2.315 3.138 . 0 0 "[ . 1 . 2]" 1
1642 1 144 SER H 1 145 GLU HG3 . . 5.500 4.684 3.926 6.180 0.680 11 1 "[ . 1+ . 2]" 1
1643 1 144 SER H 1 146 VAL H . . 4.890 4.472 3.966 4.930 0.040 2 0 "[ . 1 . 2]" 1
1644 1 144 SER HA 1 145 GLU HA . . 4.620 4.570 4.221 4.669 0.049 11 0 "[ . 1 . 2]" 1
1645 1 144 SER HA 1 146 VAL H . . 4.910 4.275 3.887 4.800 . 0 0 "[ . 1 . 2]" 1
1646 1 144 SER HB3 1 145 GLU H . . 4.150 3.623 2.720 4.270 0.120 4 0 "[ . 1 . 2]" 1
1647 1 144 SER HB3 1 145 GLU HG3 . . 5.130 3.378 2.372 5.530 0.400 11 0 "[ . 1 . 2]" 1
1648 1 145 GLU H 1 145 GLU HB3 . . 3.590 3.779 3.606 3.963 0.373 1 0 "[ . 1 . 2]" 1
1649 1 145 GLU H 1 145 GLU HG3 . . 4.300 3.194 2.538 4.157 . 0 0 "[ . 1 . 2]" 1
1650 1 145 GLU H 1 146 VAL H . . 3.050 2.429 2.060 2.917 . 0 0 "[ . 1 . 2]" 1
1651 1 145 GLU H 1 146 VAL QG . . 4.240 3.405 2.835 4.169 . 0 0 "[ . 1 . 2]" 1
1652 1 145 GLU H 1 147 ASP H . . 5.090 4.757 4.412 5.166 0.076 11 0 "[ . 1 . 2]" 1
1653 1 145 GLU HA 1 145 GLU HG3 . . 3.470 3.187 2.708 3.523 0.053 5 0 "[ . 1 . 2]" 1
1654 1 145 GLU HA 1 147 ASP H . . 4.160 3.571 3.098 4.031 . 0 0 "[ . 1 . 2]" 1
1655 1 145 GLU HA 1 148 LYS H . . 3.950 3.582 3.296 3.916 . 0 0 "[ . 1 . 2]" 1
1656 1 145 GLU HB3 1 146 VAL H . . 5.150 4.483 4.317 4.582 . 0 0 "[ . 1 . 2]" 1
1657 1 145 GLU HB3 1 149 TRP HE1 . . 4.110 3.385 2.693 3.895 . 0 0 "[ . 1 . 2]" 1
1658 1 145 GLU HB3 1 149 TRP HZ2 . . 4.640 3.678 3.285 4.003 . 0 0 "[ . 1 . 2]" 1
1659 1 146 VAL H 1 146 VAL HB . . 3.110 2.568 2.390 2.823 . 0 0 "[ . 1 . 2]" 1
1660 1 146 VAL H 1 146 VAL QG . . 3.280 1.992 1.800 2.340 . 0 0 "[ . 1 . 2]" 1
1661 1 146 VAL H 1 147 ASP H . . 3.280 2.762 2.556 2.917 . 0 0 "[ . 1 . 2]" 1
1662 1 146 VAL H 1 148 LYS H . . 4.850 4.366 4.167 4.579 . 0 0 "[ . 1 . 2]" 1
1663 1 146 VAL HA 1 146 VAL QG . . 3.170 2.235 2.119 2.512 . 0 0 "[ . 1 . 2]" 1
1664 1 146 VAL HA 1 148 LYS H . . 3.810 3.841 3.587 3.904 0.094 20 0 "[ . 1 . 2]" 1
1665 1 146 VAL HA 1 149 TRP H . . 3.410 3.136 2.833 3.349 . 0 0 "[ . 1 . 2]" 1
1666 1 146 VAL HA 1 149 TRP HB3 . . 4.220 4.250 3.802 4.730 0.510 1 1 "[+ . 1 . 2]" 1
1667 1 146 VAL HB 1 147 ASP H . . 4.490 3.187 2.582 4.257 . 0 0 "[ . 1 . 2]" 1
1668 1 146 VAL QG 1 147 ASP H . . 3.880 3.061 2.173 3.457 . 0 0 "[ . 1 . 2]" 1
1669 1 146 VAL QG 1 147 ASP HA . . 4.050 3.594 3.045 3.992 . 0 0 "[ . 1 . 2]" 1
1670 1 146 VAL QG 1 148 LYS H . . 5.500 4.387 4.040 4.570 . 0 0 "[ . 1 . 2]" 1
1671 1 146 VAL QG 1 149 TRP H . . 5.330 4.084 3.830 4.422 . 0 0 "[ . 1 . 2]" 1
1672 1 146 VAL QG 1 150 SER HB3 . . 4.000 3.744 3.044 4.055 0.055 19 0 "[ . 1 . 2]" 1
1673 1 147 ASP H 1 148 LYS H . . 3.160 2.829 2.673 3.001 . 0 0 "[ . 1 . 2]" 1
1674 1 147 ASP H 1 149 TRP H . . 4.050 4.092 3.875 4.133 0.083 1 0 "[ . 1 . 2]" 1
1675 1 148 LYS H 1 148 LYS HG3 . . 4.240 2.722 2.572 2.979 . 0 0 "[ . 1 . 2]" 1
1676 1 148 LYS H 1 149 TRP H . . 3.060 2.136 1.909 2.361 . 0 0 "[ . 1 . 2]" 1
1677 1 148 LYS H 1 149 TRP HB3 . . 5.250 5.656 5.358 5.806 0.556 18 5 "[ * -. 1 * . + *]" 1
1678 1 148 LYS H 1 150 SER H . . 4.290 4.146 3.894 4.360 0.070 6 0 "[ . 1 . 2]" 1
1679 1 148 LYS HA 1 148 LYS HG3 . . 3.830 3.747 3.624 3.899 0.069 5 0 "[ . 1 . 2]" 1
1680 1 148 LYS HA 1 151 LYS H . . 4.730 4.429 3.823 4.808 0.078 11 0 "[ . 1 . 2]" 1
1681 1 148 LYS HA 1 151 LYS HB3 . . 4.870 4.534 2.601 4.928 0.058 1 0 "[ . 1 . 2]" 1
1682 1 148 LYS HG3 1 149 TRP HD1 . . 4.310 2.748 2.494 3.210 . 0 0 "[ . 1 . 2]" 1
1683 1 149 TRP H 1 149 TRP HB3 . . 3.400 3.629 3.537 3.689 0.289 18 0 "[ . 1 . 2]" 1
1684 1 149 TRP H 1 149 TRP HD1 . . 4.050 3.522 3.130 3.801 . 0 0 "[ . 1 . 2]" 1
1685 1 149 TRP H 1 149 TRP HE1 . . 5.170 5.096 4.783 5.232 0.062 14 0 "[ . 1 . 2]" 1
1686 1 149 TRP H 1 149 TRP HE3 . . 4.700 4.573 4.083 4.766 0.066 10 0 "[ . 1 . 2]" 1
1687 1 149 TRP H 1 150 SER HA . . 5.500 5.246 4.979 5.559 0.059 6 0 "[ . 1 . 2]" 1
1688 1 149 TRP H 1 151 LYS H . . 5.370 4.868 3.963 5.435 0.065 5 0 "[ . 1 . 2]" 1
1689 1 149 TRP HA 1 149 TRP HD1 . . 3.180 2.277 2.196 2.328 . 0 0 "[ . 1 . 2]" 1
1690 1 149 TRP HA 1 149 TRP HE1 . . 4.650 4.728 4.681 4.744 0.094 19 0 "[ . 1 . 2]" 1
1691 1 149 TRP HA 1 150 SER H . . 3.420 3.249 2.857 3.485 0.065 1 0 "[ . 1 . 2]" 1
1692 1 149 TRP HA 1 151 LYS H . . 4.870 4.114 3.693 4.525 . 0 0 "[ . 1 . 2]" 1
1693 1 149 TRP HB3 1 149 TRP HE3 . . 3.680 3.302 3.092 3.554 . 0 0 "[ . 1 . 2]" 1
1694 1 149 TRP HB3 1 150 SER H . . 4.140 4.400 4.116 4.532 0.392 12 0 "[ . 1 . 2]" 1
1695 1 150 SER H 1 150 SER HB3 . . 3.570 3.044 2.739 3.521 . 0 0 "[ . 1 . 2]" 1
1696 1 150 SER H 1 151 LYS H . . 3.080 2.474 1.877 3.151 0.071 1 0 "[ . 1 . 2]" 1
1697 1 150 SER HB3 1 151 LYS H . . 4.610 4.274 3.833 4.474 . 0 0 "[ . 1 . 2]" 1
1698 1 151 LYS H 1 151 LYS HB3 . . 3.110 3.308 2.148 3.794 0.684 5 7 "[* - + * 1* .* *]" 1
1699 1 151 LYS HA 1 151 LYS HB3 . . 2.910 2.564 2.334 3.042 0.132 19 0 "[ . 1 . 2]" 1
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