NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
350008 |
2k3t   |
15777 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k3t
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 1472
_Distance_constraint_stats_list.Viol_count 1710
_Distance_constraint_stats_list.Viol_total 8702.416
_Distance_constraint_stats_list.Viol_max 1.408
_Distance_constraint_stats_list.Viol_rms 0.0864
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0148
_Distance_constraint_stats_list.Viol_average_violations_only 0.2545
_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 4 GLY 13.125 1.141 6 16 "[* **.+* -**********2]"
1 5 ASP 18.839 0.968 5 20 [****+*********-*****]
1 6 PRO 4.568 0.388 19 0 "[ . 1 . 2]"
1 7 GLY 0.445 0.080 13 0 "[ . 1 . 2]"
1 8 LEU 71.888 1.141 6 20 [*****+****-*********]
1 9 VAL 1.972 0.233 20 0 "[ . 1 . 2]"
1 10 SER 7.664 0.541 4 1 "[ +. 1 . 2]"
1 11 ALA 0.336 0.089 12 0 "[ . 1 . 2]"
1 12 TYR 0.040 0.020 13 0 "[ . 1 . 2]"
1 13 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ALA 0.380 0.247 9 0 "[ . 1 . 2]"
1 15 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 LEU 9.419 0.483 7 0 "[ . 1 . 2]"
1 17 GLU 1.478 0.247 9 0 "[ . 1 . 2]"
1 18 GLY 0.071 0.071 3 0 "[ . 1 . 2]"
1 19 GLY 0.829 0.432 14 0 "[ . 1 . 2]"
1 20 VAL 40.261 1.257 16 20 [********-******+****]
1 21 THR 21.652 0.768 5 14 "[****+ * *** * **- *]"
1 22 GLY 38.885 1.257 16 20 [********-******+****]
1 23 ASN 9.921 1.170 9 1 "[ . +1 . 2]"
1 24 PRO 6.129 0.387 11 0 "[ . 1 . 2]"
1 25 ALA 7.481 0.784 19 1 "[ . 1 . +2]"
1 26 GLU 29.224 0.799 19 15 "[ *******1 ***.-**+*]"
1 27 PHE 40.131 1.369 13 19 "[****** **-**+*******]"
1 28 VAL 7.368 0.497 16 0 "[ . 1 . 2]"
1 29 VAL 9.446 0.587 6 4 "[ *+ - *. 2]"
1 30 ASN 21.447 0.896 12 16 "[***-* **** +**.*** *]"
1 31 THR 6.425 0.753 12 4 "[ -*. * + . 2]"
1 32 SER 0.150 0.058 18 0 "[ . 1 . 2]"
1 33 ASN 22.128 0.991 5 8 "[ + * *1- * * * *2]"
1 34 ALA 24.395 1.020 15 20 [*****-********+*****]
1 35 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 GLY 0.628 0.220 15 0 "[ . 1 . 2]"
1 38 ALA 8.631 0.542 8 1 "[ . + 1 . 2]"
1 39 LEU 4.858 0.811 9 4 "[ - *. +1 . *2]"
1 40 SER 11.234 0.767 19 4 "[- . * 1 . * +2]"
1 41 VAL 1.548 0.811 9 1 "[ . +1 . 2]"
1 42 THR 0.315 0.076 11 0 "[ . 1 . 2]"
1 43 ILE 2.904 0.429 3 0 "[ . 1 . 2]"
1 44 ASP 1.823 0.117 15 0 "[ . 1 . 2]"
1 45 GLY 3.924 0.407 1 0 "[ . 1 . 2]"
1 46 PRO 8.186 0.601 16 1 "[ . 1 .+ 2]"
1 47 SER 6.026 0.611 11 1 "[ . 1+ . 2]"
1 48 LYS 3.664 0.479 3 0 "[ . 1 . 2]"
1 49 VAL 13.053 0.574 17 2 "[ - . 1 . + 2]"
1 50 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 MET 11.228 0.883 14 5 "[ *- **1 +. 2]"
1 52 ASP 5.490 0.955 12 5 "[ . * 1*+ . * -]"
1 53 CYS 2.044 0.883 14 1 "[ . 1 +. 2]"
1 54 GLN 0.624 0.142 20 0 "[ . 1 . 2]"
1 55 GLU 5.892 0.478 12 0 "[ . 1 . 2]"
1 56 CYS 2.914 0.478 12 0 "[ . 1 . 2]"
1 57 PRO 0.112 0.059 6 0 "[ . 1 . 2]"
1 58 GLU 26.407 0.896 12 16 "[**-** **** +**.*** *]"
1 59 GLY 0.928 0.449 11 0 "[ . 1 . 2]"
1 60 TYR 5.343 0.587 6 4 "[ *+ - *. 2]"
1 61 ARG 7.699 0.751 6 6 "[ *-.+ 1 ***. 2]"
1 62 VAL 0.831 0.213 7 0 "[ . 1 . 2]"
1 63 THR 23.336 0.955 12 14 "[ *** ***1*+* .-****]"
1 64 TYR 9.278 0.574 17 1 "[ . 1 . + 2]"
1 65 THR 6.542 0.502 2 1 "[ + . 1 . 2]"
1 66 PRO 4.821 0.718 7 1 "[ . + 1 . 2]"
1 67 MET 12.308 0.889 4 8 "[* *+* *- ** . 2]"
1 68 ALA 13.466 0.889 4 9 "[* *+* *-*** . 2]"
1 69 PRO 0.370 0.292 6 0 "[ . 1 . 2]"
1 70 GLY 18.654 1.018 9 18 "[****** +*******-***]"
1 71 SER 9.981 0.633 11 3 "[ . 1+ .* -]"
1 72 TYR 8.950 0.510 9 1 "[ . +1 . 2]"
1 73 LEU 4.760 1.408 1 4 "[+ - ** 1 . 2]"
1 74 ILE 6.063 0.434 8 0 "[ . 1 . 2]"
1 75 SER 7.449 0.937 12 3 "[ . * -1 + . 2]"
1 76 ILE 27.298 1.369 13 19 "[*-**** *****+*******]"
1 77 LYS 25.111 0.937 12 11 "[-* . * ***+ *.** *2]"
1 78 TYR 10.542 0.555 15 1 "[ . 1 + 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 TYR 11.916 0.802 14 6 "[ * . *- +.* *2]"
1 83 HIS 9.962 0.673 15 2 "[ . 1 + - 2]"
1 84 ILE 2.046 0.384 6 0 "[ . 1 . 2]"
1 85 GLY 1.162 0.580 20 1 "[ . 1 . +]"
1 86 GLY 0.861 0.163 19 0 "[ . 1 . 2]"
1 87 SER 13.022 0.673 15 2 "[ . 1 + - 2]"
1 88 PRO 5.759 0.992 7 3 "[ - +* 1 . 2]"
1 89 PHE 6.233 1.408 1 2 "[+ . 1 . -]"
1 90 LYS 22.885 0.832 5 15 "[-* *+ ** **** *** **]"
1 91 ALA 0.679 0.273 13 0 "[ . 1 . 2]"
1 92 LYS 17.861 0.832 5 14 "[-* *+ ** **** *** *2]"
1 93 VAL 12.602 1.018 9 6 "[ .* +1 * *. **2]"
1 94 THR 0.032 0.032 9 0 "[ . 1 . 2]"
1 95 GLY 1.895 0.292 6 0 "[ . 1 . 2]"
1 96 PRO 6.073 0.561 11 1 "[ . 1+ . 2]"
1 97 ARG 1.362 0.130 7 0 "[ . 1 . 2]"
1 98 LEU 3.775 0.561 11 1 "[ . 1+ . 2]"
1 99 VAL 0.318 0.212 7 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 GLY QA 1 5 ASP H . . 2.940 2.202 2.105 2.315 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLY QA 1 5 ASP QB . . 4.580 3.894 3.518 4.187 . 0 0 "[ . 1 . 2]" 1
3 1 4 GLY QA 1 8 LEU HG . . 4.700 5.356 4.974 5.841 1.141 6 16 "[* **.+* -**********2]" 1
4 1 4 GLY QA 1 78 TYR QE . . 3.720 2.604 2.211 3.125 . 0 0 "[ . 1 . 2]" 1
5 1 4 GLY HA2 1 5 ASP H . . 3.480 2.333 2.136 2.620 . 0 0 "[ . 1 . 2]" 1
6 1 4 GLY HA2 1 78 TYR QE . . 4.420 3.944 3.215 4.373 . 0 0 "[ . 1 . 2]" 1
7 1 4 GLY HA3 1 5 ASP H . . 3.480 2.837 2.440 3.266 . 0 0 "[ . 1 . 2]" 1
8 1 4 GLY HA3 1 78 TYR QE . . 4.420 2.653 2.239 3.256 . 0 0 "[ . 1 . 2]" 1
9 1 5 ASP H 1 5 ASP HB2 . . 3.610 2.677 2.343 3.402 . 0 0 "[ . 1 . 2]" 1
10 1 5 ASP H 1 5 ASP QB . . 3.130 2.466 2.220 2.796 . 0 0 "[ . 1 . 2]" 1
11 1 5 ASP H 1 5 ASP HB3 . . 3.610 3.273 2.420 3.815 0.205 11 0 "[ . 1 . 2]" 1
12 1 5 ASP H 1 8 LEU HG . . 4.640 4.482 4.182 5.066 0.426 5 0 "[ . 1 . 2]" 1
13 1 5 ASP H 1 34 ALA HA . . 4.480 3.510 3.245 4.035 . 0 0 "[ . 1 . 2]" 1
14 1 5 ASP H 1 34 ALA MB . . 4.160 2.286 1.967 3.148 . 0 0 "[ . 1 . 2]" 1
15 1 5 ASP H 1 78 TYR QE . . 4.500 3.636 2.414 5.055 0.555 15 1 "[ . 1 + 2]" 1
16 1 5 ASP HA 1 6 PRO HD2 . . 3.090 2.413 2.149 2.698 . 0 0 "[ . 1 . 2]" 1
17 1 5 ASP HA 1 6 PRO HD3 . . 3.090 2.270 2.003 2.486 . 0 0 "[ . 1 . 2]" 1
18 1 5 ASP HA 1 6 PRO HG2 . . 4.920 4.500 4.385 4.568 . 0 0 "[ . 1 . 2]" 1
19 1 5 ASP HA 1 6 PRO QG . . 4.270 3.974 3.888 4.053 . 0 0 "[ . 1 . 2]" 1
20 1 5 ASP HA 1 6 PRO HG3 . . 4.920 4.433 4.243 4.586 . 0 0 "[ . 1 . 2]" 1
21 1 5 ASP HA 1 8 LEU HG . . 5.500 6.277 6.175 6.468 0.968 5 20 [****+*****-*********] 1
22 1 5 ASP QB 1 6 PRO QD . . 3.750 3.086 2.409 3.598 . 0 0 "[ . 1 . 2]" 1
23 1 5 ASP QB 1 8 LEU H . . 3.970 2.728 2.522 2.950 . 0 0 "[ . 1 . 2]" 1
24 1 5 ASP QB 1 8 LEU QB . . 3.510 2.410 2.250 2.654 . 0 0 "[ . 1 . 2]" 1
25 1 5 ASP QB 1 8 LEU MD2 . . 3.620 2.236 2.180 2.315 . 0 0 "[ . 1 . 2]" 1
26 1 5 ASP QB 1 8 LEU HG . . 3.460 3.311 3.135 3.538 0.078 14 0 "[ . 1 . 2]" 1
27 1 5 ASP HB2 1 8 LEU H . . 4.710 3.562 2.747 4.624 . 0 0 "[ . 1 . 2]" 1
28 1 5 ASP HB2 1 8 LEU QB . . 4.200 3.060 2.319 4.123 . 0 0 "[ . 1 . 2]" 1
29 1 5 ASP HB3 1 8 LEU H . . 4.710 2.995 2.743 3.589 . 0 0 "[ . 1 . 2]" 1
30 1 5 ASP HB3 1 8 LEU QB . . 4.200 3.187 2.265 4.097 . 0 0 "[ . 1 . 2]" 1
31 1 6 PRO HA 1 8 LEU H . . 4.490 4.189 4.070 4.325 . 0 0 "[ . 1 . 2]" 1
32 1 6 PRO HA 1 9 VAL H . . 4.470 3.344 3.135 3.511 . 0 0 "[ . 1 . 2]" 1
33 1 6 PRO HA 1 9 VAL QG . . 3.390 2.991 2.192 3.167 . 0 0 "[ . 1 . 2]" 1
34 1 6 PRO HA 1 34 ALA MB . . 4.670 4.811 4.346 5.058 0.388 19 0 "[ . 1 . 2]" 1
35 1 6 PRO HA 1 78 TYR H . . 5.400 5.035 4.485 5.574 0.174 16 0 "[ . 1 . 2]" 1
36 1 6 PRO HA 1 78 TYR QB . . 4.430 3.001 2.615 3.419 . 0 0 "[ . 1 . 2]" 1
37 1 6 PRO HA 1 78 TYR QD . . 3.750 3.007 2.411 3.965 0.215 11 0 "[ . 1 . 2]" 1
38 1 6 PRO HA 1 78 TYR QE . . 5.500 4.646 3.803 5.826 0.326 11 0 "[ . 1 . 2]" 1
39 1 6 PRO HA 1 84 ILE MG . . 3.780 2.331 2.066 2.648 . 0 0 "[ . 1 . 2]" 1
40 1 6 PRO HB2 1 7 GLY H . . 3.870 3.318 2.850 3.747 . 0 0 "[ . 1 . 2]" 1
41 1 6 PRO HB2 1 7 GLY HA2 . . 5.090 4.320 4.124 4.521 . 0 0 "[ . 1 . 2]" 1
42 1 6 PRO HB2 1 7 GLY QA . . 4.470 4.034 3.809 4.251 . 0 0 "[ . 1 . 2]" 1
43 1 6 PRO HB2 1 7 GLY HA3 . . 5.090 4.850 4.478 5.170 0.080 13 0 "[ . 1 . 2]" 1
44 1 6 PRO HB2 1 84 ILE HA . . 3.960 2.732 2.167 3.468 . 0 0 "[ . 1 . 2]" 1
45 1 6 PRO HB2 1 84 ILE MG . . 4.620 3.338 2.778 4.032 . 0 0 "[ . 1 . 2]" 1
46 1 6 PRO HB3 1 78 TYR H . . 4.980 3.604 2.890 4.281 . 0 0 "[ . 1 . 2]" 1
47 1 6 PRO HB3 1 78 TYR QD . . 5.270 3.746 2.582 5.387 0.117 11 0 "[ . 1 . 2]" 1
48 1 6 PRO HB3 1 84 ILE HA . . 5.020 2.981 2.264 3.831 . 0 0 "[ . 1 . 2]" 1
49 1 6 PRO HB3 1 84 ILE MG . . 4.360 2.543 2.331 2.855 . 0 0 "[ . 1 . 2]" 1
50 1 6 PRO QD 1 7 GLY H . . 3.680 2.914 2.783 3.017 . 0 0 "[ . 1 . 2]" 1
51 1 6 PRO QG 1 7 GLY H . . 4.090 3.361 2.638 4.163 0.073 19 0 "[ . 1 . 2]" 1
52 1 6 PRO HG2 1 7 GLY H . . 4.870 3.536 2.668 4.524 . 0 0 "[ . 1 . 2]" 1
53 1 6 PRO HG3 1 7 GLY H . . 4.870 4.506 4.158 4.866 . 0 0 "[ . 1 . 2]" 1
54 1 7 GLY H 1 8 LEU H . . 3.400 2.551 2.422 2.644 . 0 0 "[ . 1 . 2]" 1
55 1 7 GLY QA 1 8 LEU QB . . 4.850 4.521 4.496 4.552 . 0 0 "[ . 1 . 2]" 1
56 1 7 GLY HA2 1 8 LEU QB . . 5.500 5.352 5.326 5.368 . 0 0 "[ . 1 . 2]" 1
57 1 7 GLY HA3 1 8 LEU QB . . 5.500 4.875 4.832 4.933 . 0 0 "[ . 1 . 2]" 1
58 1 8 LEU H 1 8 LEU QB . . 3.120 2.198 2.174 2.214 . 0 0 "[ . 1 . 2]" 1
59 1 8 LEU H 1 8 LEU MD1 . . 4.250 4.073 4.024 4.120 . 0 0 "[ . 1 . 2]" 1
60 1 8 LEU H 1 8 LEU HG . . 4.310 4.071 4.021 4.132 . 0 0 "[ . 1 . 2]" 1
61 1 8 LEU H 1 9 VAL H . . 3.140 2.433 2.378 2.555 . 0 0 "[ . 1 . 2]" 1
62 1 8 LEU H 1 9 VAL HB . . 5.120 4.585 4.438 5.082 . 0 0 "[ . 1 . 2]" 1
63 1 8 LEU H 1 9 VAL QG . . 4.210 4.019 3.609 4.209 . 0 0 "[ . 1 . 2]" 1
64 1 8 LEU H 1 34 ALA MB . . 4.290 3.993 3.851 4.202 . 0 0 "[ . 1 . 2]" 1
65 1 8 LEU HA 1 8 LEU MD1 . . 2.780 2.088 2.043 2.112 . 0 0 "[ . 1 . 2]" 1
66 1 8 LEU HA 1 8 LEU HG . . 3.940 3.700 3.683 3.724 . 0 0 "[ . 1 . 2]" 1
67 1 8 LEU QB 1 8 LEU MD1 . . 3.190 2.300 2.286 2.329 . 0 0 "[ . 1 . 2]" 1
68 1 8 LEU QB 1 9 VAL H . . 4.070 2.799 2.672 3.028 . 0 0 "[ . 1 . 2]" 1
69 1 8 LEU QB 1 33 ASN HB2 . . 4.970 3.473 2.908 4.161 . 0 0 "[ . 1 . 2]" 1
70 1 8 LEU QB 1 33 ASN HB3 . . 4.940 3.273 2.755 3.620 . 0 0 "[ . 1 . 2]" 1
71 1 8 LEU QB 1 34 ALA H . . 4.570 3.895 3.688 4.055 . 0 0 "[ . 1 . 2]" 1
72 1 8 LEU QB 1 34 ALA HA . . 3.330 2.509 2.188 2.812 . 0 0 "[ . 1 . 2]" 1
73 1 8 LEU QB 1 34 ALA MB . . 3.680 2.300 2.208 2.514 . 0 0 "[ . 1 . 2]" 1
74 1 8 LEU QB 1 35 GLY H . . 5.500 5.227 5.097 5.408 . 0 0 "[ . 1 . 2]" 1
75 1 8 LEU MD1 1 33 ASN HB2 . . 4.660 3.731 3.399 4.423 . 0 0 "[ . 1 . 2]" 1
76 1 8 LEU MD1 1 33 ASN HB3 . . 4.290 2.582 2.375 3.160 . 0 0 "[ . 1 . 2]" 1
77 1 8 LEU MD1 1 34 ALA H . . 4.770 4.971 4.829 5.158 0.388 5 0 "[ . 1 . 2]" 1
78 1 8 LEU HG 1 33 ASN HA . . 5.500 5.988 5.775 6.337 0.837 5 7 "[ + * *1- * * *2]" 1
79 1 8 LEU HG 1 33 ASN HB2 . . 5.500 5.588 5.176 6.326 0.826 5 3 "[ + * 1 . - 2]" 1
80 1 8 LEU HG 1 33 ASN HB3 . . 4.260 4.720 4.418 5.251 0.991 5 7 "[ + * *1 * * - *2]" 1
81 1 8 LEU HG 1 34 ALA H . . 4.990 5.754 5.574 6.010 1.020 15 20 [*****-********+*****] 1
82 1 8 LEU HG 1 34 ALA HA . . 3.420 3.332 3.011 3.564 0.144 15 0 "[ . 1 . 2]" 1
83 1 9 VAL H 1 9 VAL HB . . 3.310 2.492 2.373 2.897 . 0 0 "[ . 1 . 2]" 1
84 1 9 VAL H 1 9 VAL MG1 . . 4.170 3.819 3.783 3.841 . 0 0 "[ . 1 . 2]" 1
85 1 9 VAL H 1 9 VAL QG . . 3.320 2.256 1.922 2.349 . 0 0 "[ . 1 . 2]" 1
86 1 9 VAL H 1 9 VAL MG2 . . 4.170 2.273 1.927 2.373 . 0 0 "[ . 1 . 2]" 1
87 1 9 VAL H 1 34 ALA MB . . 4.560 2.865 2.745 3.168 . 0 0 "[ . 1 . 2]" 1
88 1 9 VAL H 1 84 ILE MG . . 4.740 4.455 4.200 4.791 0.051 13 0 "[ . 1 . 2]" 1
89 1 9 VAL H 1 85 GLY H . . 5.420 4.895 4.111 5.394 . 0 0 "[ . 1 . 2]" 1
90 1 9 VAL HA 1 9 VAL MG1 . . 3.570 2.498 2.273 2.560 . 0 0 "[ . 1 . 2]" 1
91 1 9 VAL HA 1 9 VAL QG . . 3.070 2.140 2.129 2.171 . 0 0 "[ . 1 . 2]" 1
92 1 9 VAL HA 1 9 VAL MG2 . . 3.570 2.340 2.282 2.696 . 0 0 "[ . 1 . 2]" 1
93 1 9 VAL HA 1 10 SER H . . 2.810 2.143 2.097 2.223 . 0 0 "[ . 1 . 2]" 1
94 1 9 VAL HA 1 10 SER HA . . 4.780 4.452 4.436 4.479 . 0 0 "[ . 1 . 2]" 1
95 1 9 VAL HA 1 30 ASN HB3 . . 4.900 4.884 4.504 5.113 0.213 18 0 "[ . 1 . 2]" 1
96 1 9 VAL HA 1 31 THR MG . . 5.260 4.323 4.046 4.589 . 0 0 "[ . 1 . 2]" 1
97 1 9 VAL HA 1 33 ASN HB2 . . 5.020 4.050 3.279 4.597 . 0 0 "[ . 1 . 2]" 1
98 1 9 VAL HA 1 34 ALA H . . 4.700 4.654 4.406 4.933 0.233 20 0 "[ . 1 . 2]" 1
99 1 9 VAL HA 1 34 ALA MB . . 4.240 3.075 2.776 3.345 . 0 0 "[ . 1 . 2]" 1
100 1 9 VAL HA 1 84 ILE MG . . 5.500 4.869 4.727 5.042 . 0 0 "[ . 1 . 2]" 1
101 1 9 VAL HB 1 10 SER H . . 4.640 4.129 3.732 4.205 . 0 0 "[ . 1 . 2]" 1
102 1 9 VAL HB 1 84 ILE HB . . 4.200 2.913 2.217 3.379 . 0 0 "[ . 1 . 2]" 1
103 1 9 VAL HB 1 84 ILE MG . . 3.540 2.580 2.352 2.881 . 0 0 "[ . 1 . 2]" 1
104 1 9 VAL HB 1 85 GLY H . . 5.500 4.302 3.688 4.943 . 0 0 "[ . 1 . 2]" 1
105 1 9 VAL QG 1 10 SER H . . 3.260 2.515 2.369 2.617 . 0 0 "[ . 1 . 2]" 1
106 1 9 VAL QG 1 10 SER HA . . 4.180 3.406 3.227 3.686 . 0 0 "[ . 1 . 2]" 1
107 1 9 VAL QG 1 31 THR MG . . 3.820 2.254 2.100 2.442 . 0 0 "[ . 1 . 2]" 1
108 1 9 VAL QG 1 34 ALA H . . 4.870 3.988 3.833 4.220 . 0 0 "[ . 1 . 2]" 1
109 1 9 VAL QG 1 34 ALA HA . . 4.890 4.237 4.076 4.335 . 0 0 "[ . 1 . 2]" 1
110 1 9 VAL QG 1 34 ALA MB . . 3.230 2.018 1.941 2.079 . 0 0 "[ . 1 . 2]" 1
111 1 9 VAL QG 1 78 TYR QB . . 4.000 2.791 2.329 3.282 . 0 0 "[ . 1 . 2]" 1
112 1 9 VAL QG 1 78 TYR QD . . 3.850 2.773 2.422 3.042 . 0 0 "[ . 1 . 2]" 1
113 1 9 VAL QG 1 78 TYR QE . . 4.020 2.758 2.528 3.033 . 0 0 "[ . 1 . 2]" 1
114 1 9 VAL QG 1 84 ILE HB . . 4.250 2.753 2.438 3.101 . 0 0 "[ . 1 . 2]" 1
115 1 9 VAL QG 1 84 ILE MG . . 3.000 2.128 2.051 2.271 . 0 0 "[ . 1 . 2]" 1
116 1 9 VAL MG1 1 10 SER H . . 4.310 2.551 2.381 2.662 . 0 0 "[ . 1 . 2]" 1
117 1 9 VAL MG1 1 31 THR HA . . 3.750 3.221 2.516 3.658 . 0 0 "[ . 1 . 2]" 1
118 1 9 VAL MG1 1 84 ILE MG . . 3.610 2.164 2.076 2.526 . 0 0 "[ . 1 . 2]" 1
119 1 9 VAL MG2 1 10 SER H . . 4.310 3.834 3.733 4.238 . 0 0 "[ . 1 . 2]" 1
120 1 9 VAL MG2 1 31 THR HA . . 3.750 2.338 2.137 3.468 . 0 0 "[ . 1 . 2]" 1
121 1 9 VAL MG2 1 84 ILE MG . . 3.610 3.303 2.575 3.627 0.017 13 0 "[ . 1 . 2]" 1
122 1 10 SER H 1 10 SER QB . . 3.580 2.603 2.529 2.681 . 0 0 "[ . 1 . 2]" 1
123 1 10 SER H 1 11 ALA H . . 4.700 4.418 4.366 4.509 . 0 0 "[ . 1 . 2]" 1
124 1 10 SER H 1 29 VAL HA . . 5.150 5.145 4.990 5.303 0.153 4 0 "[ . 1 . 2]" 1
125 1 10 SER H 1 30 ASN H . . 4.000 3.606 3.507 3.802 . 0 0 "[ . 1 . 2]" 1
126 1 10 SER H 1 30 ASN HB2 . . 4.630 4.889 4.695 5.171 0.541 4 1 "[ +. 1 . 2]" 1
127 1 10 SER H 1 30 ASN HB3 . . 3.950 3.242 3.030 3.499 . 0 0 "[ . 1 . 2]" 1
128 1 10 SER H 1 31 THR HA . . 5.160 4.362 3.926 4.830 . 0 0 "[ . 1 . 2]" 1
129 1 10 SER HA 1 11 ALA H . . 2.810 2.617 2.272 2.786 . 0 0 "[ . 1 . 2]" 1
130 1 10 SER HA 1 11 ALA HA . . 4.890 4.589 4.429 4.676 . 0 0 "[ . 1 . 2]" 1
131 1 10 SER HA 1 11 ALA MB . . 4.130 3.959 3.899 4.039 . 0 0 "[ . 1 . 2]" 1
132 1 10 SER HA 1 84 ILE MD . . 3.710 2.392 2.210 2.863 . 0 0 "[ . 1 . 2]" 1
133 1 10 SER QB 1 11 ALA H . . 3.280 2.750 2.113 2.956 . 0 0 "[ . 1 . 2]" 1
134 1 10 SER QB 1 12 TYR QD . . 4.380 3.987 3.796 4.193 . 0 0 "[ . 1 . 2]" 1
135 1 10 SER QB 1 12 TYR QE . . 4.220 2.503 2.376 2.652 . 0 0 "[ . 1 . 2]" 1
136 1 10 SER QB 1 30 ASN HB3 . . 4.110 3.097 2.456 3.852 . 0 0 "[ . 1 . 2]" 1
137 1 10 SER HB2 1 11 ALA H . . 4.000 3.747 3.387 4.089 0.089 12 0 "[ . 1 . 2]" 1
138 1 10 SER HB2 1 12 TYR QE . . 4.850 3.430 2.468 4.160 . 0 0 "[ . 1 . 2]" 1
139 1 10 SER HB2 1 30 ASN HB3 . . 4.730 4.079 2.496 4.903 0.173 1 0 "[ . 1 . 2]" 1
140 1 10 SER HB3 1 11 ALA H . . 4.000 2.838 2.134 3.093 . 0 0 "[ . 1 . 2]" 1
141 1 10 SER HB3 1 12 TYR QE . . 4.850 2.867 2.401 3.509 . 0 0 "[ . 1 . 2]" 1
142 1 10 SER HB3 1 30 ASN HB3 . . 4.730 3.633 2.538 5.113 0.383 12 0 "[ . 1 . 2]" 1
143 1 11 ALA H 1 11 ALA MB . . 3.300 2.615 2.304 2.762 . 0 0 "[ . 1 . 2]" 1
144 1 11 ALA H 1 84 ILE MD . . 4.010 3.273 2.453 3.875 . 0 0 "[ . 1 . 2]" 1
145 1 11 ALA HA 1 12 TYR H . . 2.850 2.220 2.191 2.247 . 0 0 "[ . 1 . 2]" 1
146 1 11 ALA HA 1 12 TYR QE . . 4.820 4.670 4.445 4.830 0.010 7 0 "[ . 1 . 2]" 1
147 1 11 ALA HA 1 16 LEU MD1 . . 4.630 3.730 3.625 3.826 . 0 0 "[ . 1 . 2]" 1
148 1 11 ALA HA 1 29 VAL HA . . 3.380 2.510 2.247 2.662 . 0 0 "[ . 1 . 2]" 1
149 1 11 ALA HA 1 29 VAL MG1 . . 4.320 3.952 3.641 4.131 . 0 0 "[ . 1 . 2]" 1
150 1 11 ALA HA 1 30 ASN H . . 3.950 2.472 2.264 2.684 . 0 0 "[ . 1 . 2]" 1
151 1 11 ALA MB 1 12 TYR H . . 3.510 2.744 2.606 2.874 . 0 0 "[ . 1 . 2]" 1
152 1 11 ALA MB 1 16 LEU MD1 . . 3.020 2.079 1.981 2.172 . 0 0 "[ . 1 . 2]" 1
153 1 11 ALA MB 1 16 LEU MD2 . . 3.690 2.525 2.339 2.737 . 0 0 "[ . 1 . 2]" 1
154 1 11 ALA MB 1 27 PHE QD . . 4.140 2.812 2.581 3.027 . 0 0 "[ . 1 . 2]" 1
155 1 11 ALA MB 1 29 VAL HA . . 3.720 2.653 2.444 2.898 . 0 0 "[ . 1 . 2]" 1
156 1 11 ALA MB 1 30 ASN H . . 4.740 3.630 3.337 4.051 . 0 0 "[ . 1 . 2]" 1
157 1 11 ALA MB 1 89 PHE QE . . 4.170 2.854 2.571 3.217 . 0 0 "[ . 1 . 2]" 1
158 1 11 ALA MB 1 89 PHE HZ . . 4.170 3.024 2.797 3.384 . 0 0 "[ . 1 . 2]" 1
159 1 12 TYR H 1 12 TYR QD . . 4.560 3.314 3.194 3.426 . 0 0 "[ . 1 . 2]" 1
160 1 12 TYR H 1 12 TYR QE . . 5.190 5.163 5.097 5.210 0.020 13 0 "[ . 1 . 2]" 1
161 1 12 TYR H 1 16 LEU MD1 . . 4.000 2.990 2.914 3.207 . 0 0 "[ . 1 . 2]" 1
162 1 12 TYR H 1 27 PHE QB . . 4.480 3.635 3.353 3.872 . 0 0 "[ . 1 . 2]" 1
163 1 12 TYR H 1 28 VAL H . . 3.610 3.080 2.969 3.261 . 0 0 "[ . 1 . 2]" 1
164 1 12 TYR H 1 28 VAL HB . . 5.410 4.384 3.698 5.308 . 0 0 "[ . 1 . 2]" 1
165 1 12 TYR H 1 28 VAL QG . . 4.870 3.672 2.837 4.293 . 0 0 "[ . 1 . 2]" 1
166 1 12 TYR H 1 29 VAL HA . . 4.310 3.877 3.671 4.001 . 0 0 "[ . 1 . 2]" 1
167 1 12 TYR H 1 30 ASN H . . 4.590 4.062 3.932 4.264 . 0 0 "[ . 1 . 2]" 1
168 1 12 TYR HA 1 12 TYR QD . . 3.430 2.819 2.698 2.934 . 0 0 "[ . 1 . 2]" 1
169 1 13 GLY H 1 16 LEU MD1 . . 4.250 3.194 3.031 3.543 . 0 0 "[ . 1 . 2]" 1
170 1 13 GLY QA 1 27 PHE HA . . 3.810 2.199 2.116 2.262 . 0 0 "[ . 1 . 2]" 1
171 1 13 GLY QA 1 27 PHE QB . . 4.840 2.804 2.341 3.102 . 0 0 "[ . 1 . 2]" 1
172 1 13 GLY QA 1 28 VAL H . . 4.910 3.318 3.195 3.399 . 0 0 "[ . 1 . 2]" 1
173 1 14 ALA H 1 14 ALA MB . . 3.620 2.170 2.165 2.176 . 0 0 "[ . 1 . 2]" 1
174 1 14 ALA HA 1 16 LEU H . . 4.310 3.894 3.825 3.954 . 0 0 "[ . 1 . 2]" 1
175 1 14 ALA HA 1 17 GLU H . . 4.110 3.528 3.386 3.712 . 0 0 "[ . 1 . 2]" 1
176 1 14 ALA HA 1 17 GLU QB . . 4.030 3.335 3.116 3.625 . 0 0 "[ . 1 . 2]" 1
177 1 14 ALA HA 1 17 GLU QG . . 4.640 3.346 3.105 3.787 . 0 0 "[ . 1 . 2]" 1
178 1 14 ALA MB 1 15 GLY H . . 3.710 2.871 2.814 2.915 . 0 0 "[ . 1 . 2]" 1
179 1 14 ALA MB 1 15 GLY HA2 . . 4.740 3.954 3.903 4.003 . 0 0 "[ . 1 . 2]" 1
180 1 14 ALA MB 1 15 GLY HA3 . . 4.690 4.412 4.345 4.468 . 0 0 "[ . 1 . 2]" 1
181 1 14 ALA MB 1 16 LEU H . . 4.880 4.529 4.481 4.573 . 0 0 "[ . 1 . 2]" 1
182 1 14 ALA MB 1 17 GLU H . . 5.160 4.422 4.356 4.479 . 0 0 "[ . 1 . 2]" 1
183 1 14 ALA MB 1 17 GLU QG . . 4.700 4.509 4.216 4.947 0.247 9 0 "[ . 1 . 2]" 1
184 1 14 ALA MB 1 18 GLY H . . 4.940 4.504 4.210 5.011 0.071 3 0 "[ . 1 . 2]" 1
185 1 15 GLY H 1 16 LEU H . . 3.640 2.785 2.751 2.804 . 0 0 "[ . 1 . 2]" 1
186 1 15 GLY H 1 16 LEU HG . . 5.190 4.282 4.095 4.408 . 0 0 "[ . 1 . 2]" 1
187 1 15 GLY H 1 25 ALA MB . . 5.500 3.983 3.542 4.342 . 0 0 "[ . 1 . 2]" 1
188 1 15 GLY H 1 27 PHE QB . . 4.120 2.694 2.290 3.090 . 0 0 "[ . 1 . 2]" 1
189 1 15 GLY HA2 1 17 GLU H . . 4.750 3.881 3.710 4.011 . 0 0 "[ . 1 . 2]" 1
190 1 15 GLY HA2 1 18 GLY H . . 4.300 3.134 2.919 3.384 . 0 0 "[ . 1 . 2]" 1
191 1 15 GLY HA2 1 25 ALA MB . . 3.470 2.139 2.052 2.275 . 0 0 "[ . 1 . 2]" 1
192 1 15 GLY HA2 1 27 PHE QB . . 5.080 4.356 3.947 4.792 . 0 0 "[ . 1 . 2]" 1
193 1 15 GLY HA2 1 27 PHE QD . . 5.370 4.022 3.836 4.282 . 0 0 "[ . 1 . 2]" 1
194 1 15 GLY HA2 1 64 TYR QE . . 4.580 3.484 3.099 3.872 . 0 0 "[ . 1 . 2]" 1
195 1 15 GLY HA3 1 18 GLY H . . 5.090 4.566 4.336 4.812 . 0 0 "[ . 1 . 2]" 1
196 1 15 GLY HA3 1 25 ALA MB . . 3.350 2.923 2.630 3.221 . 0 0 "[ . 1 . 2]" 1
197 1 15 GLY HA3 1 26 GLU H . . 4.030 3.177 2.403 3.637 . 0 0 "[ . 1 . 2]" 1
198 1 15 GLY HA3 1 27 PHE QB . . 4.670 2.961 2.494 3.417 . 0 0 "[ . 1 . 2]" 1
199 1 15 GLY HA3 1 27 PHE QD . . 4.220 2.378 2.197 2.634 . 0 0 "[ . 1 . 2]" 1
200 1 15 GLY HA3 1 64 TYR QE . . 4.290 2.921 2.550 3.368 . 0 0 "[ . 1 . 2]" 1
201 1 16 LEU H 1 16 LEU HB2 . . 3.690 2.454 2.392 2.483 . 0 0 "[ . 1 . 2]" 1
202 1 16 LEU H 1 16 LEU QB . . 3.100 2.414 2.357 2.441 . 0 0 "[ . 1 . 2]" 1
203 1 16 LEU H 1 16 LEU HB3 . . 3.690 3.581 3.557 3.595 . 0 0 "[ . 1 . 2]" 1
204 1 16 LEU H 1 16 LEU MD1 . . 3.970 3.605 3.521 3.664 . 0 0 "[ . 1 . 2]" 1
205 1 16 LEU H 1 16 LEU MD2 . . 4.200 3.352 3.241 3.474 . 0 0 "[ . 1 . 2]" 1
206 1 16 LEU H 1 16 LEU HG . . 3.380 2.265 2.213 2.325 . 0 0 "[ . 1 . 2]" 1
207 1 16 LEU H 1 17 GLU QB . . 4.660 4.586 4.458 4.714 0.054 7 0 "[ . 1 . 2]" 1
208 1 16 LEU H 1 17 GLU QG . . 4.730 4.057 3.823 4.226 . 0 0 "[ . 1 . 2]" 1
209 1 16 LEU H 1 18 GLY H . . 4.270 4.043 3.893 4.177 . 0 0 "[ . 1 . 2]" 1
210 1 16 LEU H 1 25 ALA MB . . 5.220 5.156 5.004 5.318 0.098 19 0 "[ . 1 . 2]" 1
211 1 16 LEU H 1 27 PHE HA . . 5.180 4.948 4.659 5.183 0.003 6 0 "[ . 1 . 2]" 1
212 1 16 LEU H 1 27 PHE QB . . 3.900 2.795 2.599 3.106 . 0 0 "[ . 1 . 2]" 1
213 1 16 LEU H 1 27 PHE QD . . 4.680 3.923 3.657 4.184 . 0 0 "[ . 1 . 2]" 1
214 1 16 LEU HA 1 16 LEU MD1 . . 4.070 3.873 3.851 3.888 . 0 0 "[ . 1 . 2]" 1
215 1 16 LEU HA 1 16 LEU MD2 . . 3.200 2.115 2.075 2.142 . 0 0 "[ . 1 . 2]" 1
216 1 16 LEU HA 1 16 LEU HG . . 3.970 3.144 3.022 3.208 . 0 0 "[ . 1 . 2]" 1
217 1 16 LEU HA 1 18 GLY H . . 5.290 4.496 4.165 4.747 . 0 0 "[ . 1 . 2]" 1
218 1 16 LEU HA 1 27 PHE QB . . 5.150 4.433 4.216 4.614 . 0 0 "[ . 1 . 2]" 1
219 1 16 LEU HA 1 27 PHE QD . . 5.130 4.566 4.371 4.790 . 0 0 "[ . 1 . 2]" 1
220 1 16 LEU HA 1 74 ILE MD . . 3.340 2.353 2.210 2.705 . 0 0 "[ . 1 . 2]" 1
221 1 16 LEU HA 1 89 PHE HB2 . . 5.360 3.697 3.483 3.939 . 0 0 "[ . 1 . 2]" 1
222 1 16 LEU HA 1 89 PHE QD . . 5.290 4.584 4.341 4.889 . 0 0 "[ . 1 . 2]" 1
223 1 16 LEU QB 1 16 LEU MD1 . . 3.000 2.088 2.081 2.095 . 0 0 "[ . 1 . 2]" 1
224 1 16 LEU QB 1 17 GLU H . . 3.590 2.904 2.808 3.000 . 0 0 "[ . 1 . 2]" 1
225 1 16 LEU QB 1 17 GLU QG . . 4.070 3.089 2.867 3.248 . 0 0 "[ . 1 . 2]" 1
226 1 16 LEU QB 1 27 PHE QB . . 4.720 3.950 3.894 4.065 . 0 0 "[ . 1 . 2]" 1
227 1 16 LEU QB 1 89 PHE HB2 . . 4.490 3.777 3.534 4.270 . 0 0 "[ . 1 . 2]" 1
228 1 16 LEU QB 1 89 PHE HB3 . . 4.210 2.867 2.647 3.284 . 0 0 "[ . 1 . 2]" 1
229 1 16 LEU QB 1 89 PHE QD . . 3.940 2.988 2.666 3.446 . 0 0 "[ . 1 . 2]" 1
230 1 16 LEU HB2 1 16 LEU MD1 . . 3.440 2.318 2.284 2.350 . 0 0 "[ . 1 . 2]" 1
231 1 16 LEU HB2 1 17 GLU H . . 4.140 2.986 2.879 3.093 . 0 0 "[ . 1 . 2]" 1
232 1 16 LEU HB2 1 17 GLU QG . . 4.740 3.176 2.939 3.353 . 0 0 "[ . 1 . 2]" 1
233 1 16 LEU HB2 1 89 PHE HB3 . . 4.930 4.582 4.357 5.017 0.087 7 0 "[ . 1 . 2]" 1
234 1 16 LEU HB2 1 89 PHE QD . . 4.670 4.474 4.103 5.050 0.380 7 0 "[ . 1 . 2]" 1
235 1 16 LEU HB3 1 16 LEU MD1 . . 3.440 2.371 2.345 2.412 . 0 0 "[ . 1 . 2]" 1
236 1 16 LEU HB3 1 17 GLU H . . 4.140 3.969 3.839 4.040 . 0 0 "[ . 1 . 2]" 1
237 1 16 LEU HB3 1 17 GLU QG . . 4.740 4.229 3.985 4.453 . 0 0 "[ . 1 . 2]" 1
238 1 16 LEU HB3 1 89 PHE HB3 . . 4.930 2.898 2.670 3.329 . 0 0 "[ . 1 . 2]" 1
239 1 16 LEU HB3 1 89 PHE QD . . 4.670 3.035 2.701 3.520 . 0 0 "[ . 1 . 2]" 1
240 1 16 LEU MD1 1 17 GLU H . . 4.960 4.795 4.675 4.887 . 0 0 "[ . 1 . 2]" 1
241 1 16 LEU MD1 1 27 PHE QB . . 3.930 2.980 2.704 3.259 . 0 0 "[ . 1 . 2]" 1
242 1 16 LEU MD1 1 76 ILE MD . . 3.950 3.548 3.295 3.987 0.037 9 0 "[ . 1 . 2]" 1
243 1 16 LEU MD1 1 89 PHE HB3 . . 5.040 4.189 3.897 4.775 . 0 0 "[ . 1 . 2]" 1
244 1 16 LEU MD1 1 89 PHE QD . . 4.450 3.408 3.154 3.866 . 0 0 "[ . 1 . 2]" 1
245 1 16 LEU MD1 1 89 PHE QE . . 4.550 3.227 3.017 3.642 . 0 0 "[ . 1 . 2]" 1
246 1 16 LEU MD2 1 27 PHE QB . . 4.870 2.975 2.646 3.629 . 0 0 "[ . 1 . 2]" 1
247 1 16 LEU MD2 1 27 PHE QD . . 4.540 2.741 2.594 3.006 . 0 0 "[ . 1 . 2]" 1
248 1 16 LEU MD2 1 74 ILE HB . . 4.560 3.474 3.184 3.729 . 0 0 "[ . 1 . 2]" 1
249 1 16 LEU MD2 1 74 ILE MD . . 3.330 2.441 2.279 2.869 . 0 0 "[ . 1 . 2]" 1
250 1 16 LEU MD2 1 74 ILE HG12 . . 5.400 4.854 4.624 5.309 . 0 0 "[ . 1 . 2]" 1
251 1 16 LEU MD2 1 74 ILE QG . . 4.760 4.194 3.973 4.556 . 0 0 "[ . 1 . 2]" 1
252 1 16 LEU MD2 1 74 ILE HG13 . . 5.400 4.590 4.329 4.960 . 0 0 "[ . 1 . 2]" 1
253 1 16 LEU MD2 1 74 ILE MG . . 3.540 2.917 2.640 3.147 . 0 0 "[ . 1 . 2]" 1
254 1 16 LEU MD2 1 76 ILE MD . . 3.460 2.263 2.122 2.670 . 0 0 "[ . 1 . 2]" 1
255 1 16 LEU MD2 1 89 PHE HB2 . . 5.080 2.673 2.445 2.999 . 0 0 "[ . 1 . 2]" 1
256 1 16 LEU MD2 1 89 PHE HB3 . . 4.450 3.044 2.792 3.339 . 0 0 "[ . 1 . 2]" 1
257 1 16 LEU MD2 1 89 PHE QD . . 4.160 2.935 2.773 3.089 . 0 0 "[ . 1 . 2]" 1
258 1 16 LEU MD2 1 89 PHE QE . . 4.680 3.709 3.344 3.965 . 0 0 "[ . 1 . 2]" 1
259 1 16 LEU HG 1 17 GLU H . . 4.370 4.423 4.362 4.497 0.127 7 0 "[ . 1 . 2]" 1
260 1 16 LEU HG 1 27 PHE H . . 5.500 5.849 5.754 5.983 0.483 7 0 "[ . 1 . 2]" 1
261 1 16 LEU HG 1 27 PHE HA . . 5.140 4.522 4.323 5.055 . 0 0 "[ . 1 . 2]" 1
262 1 16 LEU HG 1 27 PHE QB . . 3.840 2.298 2.196 2.623 . 0 0 "[ . 1 . 2]" 1
263 1 16 LEU HG 1 27 PHE QD . . 4.750 3.502 3.172 3.716 . 0 0 "[ . 1 . 2]" 1
264 1 16 LEU HG 1 28 VAL H . . 5.500 4.954 4.512 5.316 . 0 0 "[ . 1 . 2]" 1
265 1 17 GLU H 1 17 GLU HB2 . . 3.930 2.454 2.417 2.474 . 0 0 "[ . 1 . 2]" 1
266 1 17 GLU H 1 17 GLU QB . . 3.190 2.417 2.382 2.436 . 0 0 "[ . 1 . 2]" 1
267 1 17 GLU H 1 17 GLU HB3 . . 3.930 3.631 3.608 3.649 . 0 0 "[ . 1 . 2]" 1
268 1 17 GLU H 1 17 GLU QG . . 3.840 2.484 2.428 2.573 . 0 0 "[ . 1 . 2]" 1
269 1 17 GLU H 1 18 GLY H . . 2.930 2.307 2.220 2.367 . 0 0 "[ . 1 . 2]" 1
270 1 17 GLU H 1 18 GLY QA . . 5.300 4.320 4.206 4.424 . 0 0 "[ . 1 . 2]" 1
271 1 17 GLU H 1 91 ALA HA . . 5.310 4.551 4.322 4.733 . 0 0 "[ . 1 . 2]" 1
272 1 17 GLU HA 1 17 GLU QG . . 3.500 2.671 2.411 2.977 . 0 0 "[ . 1 . 2]" 1
273 1 17 GLU HA 1 91 ALA HA . . 4.320 3.192 2.981 3.427 . 0 0 "[ . 1 . 2]" 1
274 1 17 GLU QB 1 18 GLY H . . 3.690 2.811 2.640 3.148 . 0 0 "[ . 1 . 2]" 1
275 1 17 GLU HB2 1 18 GLY H . . 4.340 2.886 2.700 3.263 . 0 0 "[ . 1 . 2]" 1
276 1 17 GLU HB3 1 18 GLY H . . 4.340 3.879 3.728 4.136 . 0 0 "[ . 1 . 2]" 1
277 1 17 GLU QG 1 18 GLY H . . 4.400 4.160 4.104 4.285 . 0 0 "[ . 1 . 2]" 1
278 1 18 GLY H 1 25 ALA MB . . 5.230 4.238 3.923 4.536 . 0 0 "[ . 1 . 2]" 1
279 1 18 GLY H 1 91 ALA HA . . 4.640 3.828 3.445 4.137 . 0 0 "[ . 1 . 2]" 1
280 1 18 GLY H 1 91 ALA MB . . 4.400 3.122 2.802 3.359 . 0 0 "[ . 1 . 2]" 1
281 1 18 GLY H 1 92 LYS H . . 5.500 4.526 4.147 4.904 . 0 0 "[ . 1 . 2]" 1
282 1 18 GLY QA 1 91 ALA HA . . 3.760 3.225 2.940 3.456 . 0 0 "[ . 1 . 2]" 1
283 1 18 GLY QA 1 91 ALA MB . . 3.470 2.233 2.067 2.401 . 0 0 "[ . 1 . 2]" 1
284 1 18 GLY QA 1 92 LYS H . . 3.820 2.853 2.472 3.191 . 0 0 "[ . 1 . 2]" 1
285 1 18 GLY QA 1 93 VAL QG . . 3.430 2.611 2.265 3.078 . 0 0 "[ . 1 . 2]" 1
286 1 18 GLY HA2 1 19 GLY H . . 3.390 3.009 2.768 3.198 . 0 0 "[ . 1 . 2]" 1
287 1 18 GLY HA2 1 91 ALA HA . . 4.380 3.654 3.026 4.171 . 0 0 "[ . 1 . 2]" 1
288 1 18 GLY HA2 1 92 LYS H . . 4.620 3.756 2.670 4.470 . 0 0 "[ . 1 . 2]" 1
289 1 18 GLY HA3 1 19 GLY H . . 3.390 2.215 2.109 2.292 . 0 0 "[ . 1 . 2]" 1
290 1 18 GLY HA3 1 91 ALA HA . . 4.380 3.768 3.436 4.208 . 0 0 "[ . 1 . 2]" 1
291 1 18 GLY HA3 1 92 LYS H . . 4.620 3.068 2.655 3.347 . 0 0 "[ . 1 . 2]" 1
292 1 19 GLY H 1 93 VAL HA . . 3.300 2.557 2.267 3.118 . 0 0 "[ . 1 . 2]" 1
293 1 19 GLY H 1 93 VAL QG . . 3.640 2.482 2.122 2.904 . 0 0 "[ . 1 . 2]" 1
294 1 19 GLY H 1 94 THR H . . 4.610 4.006 3.482 4.642 0.032 9 0 "[ . 1 . 2]" 1
295 1 19 GLY QA 1 20 VAL H . . 2.870 2.208 2.114 2.287 . 0 0 "[ . 1 . 2]" 1
296 1 19 GLY QA 1 20 VAL HB . . 4.450 4.354 4.031 4.523 0.073 5 0 "[ . 1 . 2]" 1
297 1 19 GLY QA 1 25 ALA MB . . 3.860 3.187 2.422 4.292 0.432 14 0 "[ . 1 . 2]" 1
298 1 19 GLY QA 1 93 VAL QG . . 4.040 3.295 2.714 3.700 . 0 0 "[ . 1 . 2]" 1
299 1 20 VAL H 1 20 VAL HB . . 3.510 2.608 2.406 3.209 . 0 0 "[ . 1 . 2]" 1
300 1 20 VAL H 1 20 VAL QG . . 3.640 2.579 2.291 2.848 . 0 0 "[ . 1 . 2]" 1
301 1 20 VAL H 1 21 THR H . . 4.960 4.527 4.415 4.635 . 0 0 "[ . 1 . 2]" 1
302 1 20 VAL H 1 23 ASN QB . . 4.170 3.485 3.205 3.806 . 0 0 "[ . 1 . 2]" 1
303 1 20 VAL HA 1 20 VAL QG . . 3.150 2.171 2.149 2.303 . 0 0 "[ . 1 . 2]" 1
304 1 20 VAL HA 1 21 THR H . . 2.850 2.235 2.187 2.331 . 0 0 "[ . 1 . 2]" 1
305 1 20 VAL HB 1 21 THR H . . 4.400 4.084 3.955 4.213 . 0 0 "[ . 1 . 2]" 1
306 1 20 VAL HB 1 23 ASN QB . . 3.790 2.747 2.316 4.665 0.875 9 1 "[ . +1 . 2]" 1
307 1 20 VAL HB 1 23 ASN QD . . 4.300 2.992 2.273 5.470 1.170 9 1 "[ . +1 . 2]" 1
308 1 20 VAL QG 1 21 THR H . . 3.480 2.466 2.196 2.608 . 0 0 "[ . 1 . 2]" 1
309 1 20 VAL QG 1 21 THR HB . . 5.050 4.582 4.386 4.797 . 0 0 "[ . 1 . 2]" 1
310 1 20 VAL QG 1 22 GLY H . . 4.000 4.845 4.584 5.041 1.041 5 20 [****+***-***********] 1
311 1 20 VAL QG 1 22 GLY QA . . 3.520 4.510 4.245 4.777 1.257 16 20 [***************+**-*] 1
312 1 20 VAL QG 1 23 ASN HB2 . . 4.390 3.544 3.092 4.072 . 0 0 "[ . 1 . 2]" 1
313 1 20 VAL QG 1 23 ASN QB . . 3.760 3.161 2.130 3.586 . 0 0 "[ . 1 . 2]" 1
314 1 20 VAL QG 1 23 ASN HB3 . . 4.390 3.975 2.156 4.702 0.312 8 0 "[ . 1 . 2]" 1
315 1 20 VAL QG 1 23 ASN QD . . 4.440 3.027 2.527 4.349 . 0 0 "[ . 1 . 2]" 1
316 1 20 VAL QG 1 95 GLY HA2 . . 4.370 3.638 3.077 4.183 . 0 0 "[ . 1 . 2]" 1
317 1 20 VAL QG 1 96 PRO HD2 . . 4.680 3.442 3.156 3.752 . 0 0 "[ . 1 . 2]" 1
318 1 20 VAL QG 1 96 PRO HD3 . . 4.780 4.300 3.985 4.755 . 0 0 "[ . 1 . 2]" 1
319 1 21 THR H 1 21 THR HB . . 3.750 3.605 3.574 3.624 . 0 0 "[ . 1 . 2]" 1
320 1 21 THR H 1 21 THR MG . . 3.180 2.301 2.224 2.376 . 0 0 "[ . 1 . 2]" 1
321 1 21 THR H 1 66 PRO HG2 . . 5.060 4.324 3.989 5.051 . 0 0 "[ . 1 . 2]" 1
322 1 21 THR H 1 95 GLY HA2 . . 4.920 4.697 4.450 4.821 . 0 0 "[ . 1 . 2]" 1
323 1 21 THR H 1 95 GLY HA3 . . 3.820 3.012 2.777 3.159 . 0 0 "[ . 1 . 2]" 1
324 1 21 THR H 1 96 PRO HD2 . . 4.950 4.233 3.798 4.554 . 0 0 "[ . 1 . 2]" 1
325 1 21 THR H 1 96 PRO HD3 . . 5.500 5.680 5.292 5.933 0.433 11 0 "[ . 1 . 2]" 1
326 1 21 THR HA 1 21 THR MG . . 3.340 2.312 2.289 2.341 . 0 0 "[ . 1 . 2]" 1
327 1 21 THR HA 1 22 GLY H . . 3.070 2.179 2.120 2.261 . 0 0 "[ . 1 . 2]" 1
328 1 21 THR HA 1 22 GLY QA . . 4.350 3.957 3.919 4.004 . 0 0 "[ . 1 . 2]" 1
329 1 21 THR HA 1 23 ASN H . . 4.190 3.431 3.211 3.623 . 0 0 "[ . 1 . 2]" 1
330 1 21 THR HA 1 66 PRO HG2 . . 3.990 2.414 2.213 3.129 . 0 0 "[ . 1 . 2]" 1
331 1 21 THR HA 1 66 PRO HG3 . . 4.140 4.122 3.901 4.858 0.718 7 1 "[ . + 1 . 2]" 1
332 1 21 THR HA 1 93 VAL QG . . 4.480 3.345 2.869 4.332 . 0 0 "[ . 1 . 2]" 1
333 1 21 THR HB 1 22 GLY H . . 4.350 2.948 2.622 3.284 . 0 0 "[ . 1 . 2]" 1
334 1 21 THR HB 1 22 GLY QA . . 5.070 3.916 3.704 4.040 . 0 0 "[ . 1 . 2]" 1
335 1 21 THR HB 1 68 ALA HA . . 4.360 4.422 4.042 4.702 0.342 5 0 "[ . 1 . 2]" 1
336 1 21 THR HB 1 95 GLY HA3 . . 4.980 4.816 4.516 5.121 0.141 3 0 "[ . 1 . 2]" 1
337 1 21 THR MG 1 68 ALA H . . 4.100 2.750 2.436 3.411 . 0 0 "[ . 1 . 2]" 1
338 1 21 THR MG 1 68 ALA HA . . 3.780 2.817 2.620 3.512 . 0 0 "[ . 1 . 2]" 1
339 1 21 THR MG 1 68 ALA MB . . 4.180 3.840 3.726 4.161 . 0 0 "[ . 1 . 2]" 1
340 1 21 THR MG 1 69 PRO HD2 . . 4.400 3.889 3.720 4.246 . 0 0 "[ . 1 . 2]" 1
341 1 21 THR MG 1 69 PRO QD . . 3.550 2.661 2.423 3.136 . 0 0 "[ . 1 . 2]" 1
342 1 21 THR MG 1 69 PRO HD3 . . 4.400 2.711 2.456 3.231 . 0 0 "[ . 1 . 2]" 1
343 1 21 THR MG 1 69 PRO QG . . 4.750 4.080 3.684 4.292 . 0 0 "[ . 1 . 2]" 1
344 1 21 THR MG 1 70 GLY H . . 4.280 4.766 3.974 5.048 0.768 5 13 "[****+ *** * **- *]" 1
345 1 21 THR MG 1 93 VAL HB . . 3.970 3.785 2.355 4.272 0.302 10 0 "[ . 1 . 2]" 1
346 1 21 THR MG 1 95 GLY HA2 . . 4.820 4.778 4.337 5.038 0.218 6 0 "[ . 1 . 2]" 1
347 1 21 THR MG 1 95 GLY HA3 . . 4.120 3.552 3.217 3.854 . 0 0 "[ . 1 . 2]" 1
348 1 21 THR MG 1 96 PRO HD2 . . 4.600 4.340 4.135 4.837 0.237 19 0 "[ . 1 . 2]" 1
349 1 21 THR MG 1 97 ARG HA . . 4.560 3.527 3.100 4.646 0.086 12 0 "[ . 1 . 2]" 1
350 1 22 GLY H 1 23 ASN H . . 3.540 2.884 2.753 3.067 . 0 0 "[ . 1 . 2]" 1
351 1 22 GLY H 1 65 THR MG . . 3.740 2.807 2.583 3.073 . 0 0 "[ . 1 . 2]" 1
352 1 22 GLY H 1 66 PRO HB2 . . 5.200 4.764 4.192 5.080 . 0 0 "[ . 1 . 2]" 1
353 1 22 GLY H 1 66 PRO HG2 . . 4.400 3.591 2.954 3.969 . 0 0 "[ . 1 . 2]" 1
354 1 22 GLY H 1 66 PRO HG3 . . 5.180 5.244 4.631 5.588 0.408 5 0 "[ . 1 . 2]" 1
355 1 22 GLY QA 1 23 ASN QB . . 5.250 4.494 4.181 4.662 . 0 0 "[ . 1 . 2]" 1
356 1 22 GLY QA 1 65 THR HB . . 5.500 4.947 4.779 5.254 . 0 0 "[ . 1 . 2]" 1
357 1 22 GLY QA 1 65 THR MG . . 3.260 2.415 2.227 2.684 . 0 0 "[ . 1 . 2]" 1
358 1 23 ASN H 1 23 ASN HB2 . . 3.750 2.738 2.350 3.633 . 0 0 "[ . 1 . 2]" 1
359 1 23 ASN H 1 23 ASN QB . . 3.060 2.340 2.143 2.555 . 0 0 "[ . 1 . 2]" 1
360 1 23 ASN H 1 23 ASN HB3 . . 3.750 3.224 2.170 3.753 0.003 5 0 "[ . 1 . 2]" 1
361 1 23 ASN H 1 23 ASN QD . . 4.830 3.923 2.621 4.763 . 0 0 "[ . 1 . 2]" 1
362 1 23 ASN H 1 24 PRO HD2 . . 4.840 4.980 4.938 5.021 0.181 9 0 "[ . 1 . 2]" 1
363 1 23 ASN H 1 65 THR MG . . 3.840 3.198 2.436 3.973 0.133 14 0 "[ . 1 . 2]" 1
364 1 23 ASN H 1 66 PRO HD2 . . 4.370 3.801 3.423 4.679 0.309 14 0 "[ . 1 . 2]" 1
365 1 23 ASN HA 1 24 PRO HD2 . . 3.070 2.420 2.335 2.534 . 0 0 "[ . 1 . 2]" 1
366 1 23 ASN HA 1 24 PRO HD3 . . 3.030 2.389 2.337 2.447 . 0 0 "[ . 1 . 2]" 1
367 1 23 ASN HA 1 24 PRO HG2 . . 4.810 4.601 4.532 4.677 . 0 0 "[ . 1 . 2]" 1
368 1 23 ASN HA 1 24 PRO QG . . 4.160 4.088 4.038 4.144 . 0 0 "[ . 1 . 2]" 1
369 1 23 ASN HA 1 24 PRO HG3 . . 4.810 4.577 4.534 4.637 . 0 0 "[ . 1 . 2]" 1
370 1 23 ASN HA 1 65 THR MG . . 4.510 3.646 3.381 4.008 . 0 0 "[ . 1 . 2]" 1
371 1 23 ASN QB 1 24 PRO HA . . 5.150 4.735 4.480 5.241 0.091 1 0 "[ . 1 . 2]" 1
372 1 23 ASN QB 1 24 PRO HD2 . . 3.410 2.583 2.278 3.207 . 0 0 "[ . 1 . 2]" 1
373 1 23 ASN QB 1 24 PRO HD3 . . 3.740 3.717 3.550 4.017 0.277 20 0 "[ . 1 . 2]" 1
374 1 23 ASN HB2 1 24 PRO HD2 . . 4.000 3.674 2.680 4.117 0.117 15 0 "[ . 1 . 2]" 1
375 1 23 ASN HB3 1 24 PRO HD2 . . 4.000 2.995 2.294 4.387 0.387 11 0 "[ . 1 . 2]" 1
376 1 24 PRO HA 1 25 ALA H . . 2.890 2.153 2.111 2.268 . 0 0 "[ . 1 . 2]" 1
377 1 24 PRO HA 1 25 ALA MB . . 4.720 3.988 3.888 4.084 . 0 0 "[ . 1 . 2]" 1
378 1 24 PRO HA 1 63 THR MG . . 4.010 3.611 3.262 4.045 0.035 17 0 "[ . 1 . 2]" 1
379 1 24 PRO HA 1 64 TYR H . . 5.170 4.281 4.137 4.570 . 0 0 "[ . 1 . 2]" 1
380 1 24 PRO HA 1 65 THR HA . . 4.100 2.809 2.487 3.275 . 0 0 "[ . 1 . 2]" 1
381 1 24 PRO HA 1 65 THR HB . . 5.500 4.694 4.408 5.290 . 0 0 "[ . 1 . 2]" 1
382 1 24 PRO HA 1 65 THR MG . . 4.920 3.600 3.292 3.947 . 0 0 "[ . 1 . 2]" 1
383 1 24 PRO QB 1 25 ALA HA . . 5.340 4.267 3.975 4.731 . 0 0 "[ . 1 . 2]" 1
384 1 24 PRO QB 1 63 THR HB . . 5.340 4.863 4.580 5.354 0.014 7 0 "[ . 1 . 2]" 1
385 1 24 PRO QB 1 63 THR MG . . 3.030 2.374 2.148 2.732 . 0 0 "[ . 1 . 2]" 1
386 1 24 PRO HB2 1 25 ALA H . . 4.470 3.433 3.094 4.175 . 0 0 "[ . 1 . 2]" 1
387 1 24 PRO HB2 1 63 THR MG . . 3.560 2.498 2.255 2.894 . 0 0 "[ . 1 . 2]" 1
388 1 24 PRO HB3 1 25 ALA H . . 4.470 3.946 3.745 4.472 0.002 19 0 "[ . 1 . 2]" 1
389 1 24 PRO HB3 1 63 THR MG . . 3.560 2.966 2.652 3.369 . 0 0 "[ . 1 . 2]" 1
390 1 25 ALA H 1 25 ALA MB . . 3.320 2.381 2.205 2.582 . 0 0 "[ . 1 . 2]" 1
391 1 25 ALA H 1 26 GLU H . . 4.310 4.477 4.370 4.690 0.380 19 0 "[ . 1 . 2]" 1
392 1 25 ALA H 1 63 THR HA . . 4.580 4.708 4.438 5.364 0.784 19 1 "[ . 1 . +2]" 1
393 1 25 ALA H 1 63 THR MG . . 4.130 3.526 3.159 4.168 0.038 11 0 "[ . 1 . 2]" 1
394 1 25 ALA H 1 64 TYR H . . 3.660 3.069 2.873 3.682 0.022 19 0 "[ . 1 . 2]" 1
395 1 25 ALA H 1 65 THR HA . . 4.310 3.375 3.195 3.574 . 0 0 "[ . 1 . 2]" 1
396 1 25 ALA H 1 66 PRO HD2 . . 4.770 4.146 3.487 4.601 . 0 0 "[ . 1 . 2]" 1
397 1 25 ALA H 1 66 PRO HD3 . . 4.670 3.721 3.141 4.031 . 0 0 "[ . 1 . 2]" 1
398 1 25 ALA HA 1 26 GLU H . . 2.730 2.318 2.180 2.465 . 0 0 "[ . 1 . 2]" 1
399 1 25 ALA HA 1 26 GLU HA . . 4.810 4.473 4.416 4.535 . 0 0 "[ . 1 . 2]" 1
400 1 25 ALA HA 1 26 GLU QB . . 5.050 4.032 3.675 4.355 . 0 0 "[ . 1 . 2]" 1
401 1 25 ALA MB 1 26 GLU H . . 3.710 2.920 2.540 3.342 . 0 0 "[ . 1 . 2]" 1
402 1 25 ALA MB 1 26 GLU HA . . 4.500 4.236 4.013 4.416 . 0 0 "[ . 1 . 2]" 1
403 1 25 ALA MB 1 64 TYR H . . 4.110 3.690 3.274 4.075 . 0 0 "[ . 1 . 2]" 1
404 1 25 ALA MB 1 64 TYR QD . . 4.120 3.660 3.316 4.172 0.052 20 0 "[ . 1 . 2]" 1
405 1 25 ALA MB 1 64 TYR QE . . 3.630 3.109 2.772 3.680 0.050 20 0 "[ . 1 . 2]" 1
406 1 25 ALA MB 1 66 PRO HD3 . . 4.140 3.182 2.464 3.706 . 0 0 "[ . 1 . 2]" 1
407 1 26 GLU H 1 26 GLU QB . . 3.250 2.920 2.387 3.354 0.104 11 0 "[ . 1 . 2]" 1
408 1 26 GLU H 1 26 GLU QG . . 4.180 3.353 2.531 4.363 0.183 6 0 "[ . 1 . 2]" 1
409 1 26 GLU H 1 63 THR HA . . 4.780 4.829 4.698 4.955 0.175 11 0 "[ . 1 . 2]" 1
410 1 26 GLU H 1 64 TYR H . . 5.210 5.015 4.945 5.109 . 0 0 "[ . 1 . 2]" 1
411 1 26 GLU HA 1 27 PHE H . . 2.800 2.201 2.115 2.297 . 0 0 "[ . 1 . 2]" 1
412 1 26 GLU HA 1 27 PHE HA . . 4.890 4.477 4.417 4.521 . 0 0 "[ . 1 . 2]" 1
413 1 26 GLU HA 1 62 VAL QG . . 4.840 4.215 3.539 4.673 . 0 0 "[ . 1 . 2]" 1
414 1 26 GLU HA 1 63 THR HA . . 3.370 2.390 2.247 2.637 . 0 0 "[ . 1 . 2]" 1
415 1 26 GLU HA 1 63 THR MG . . 3.990 3.499 3.017 3.947 . 0 0 "[ . 1 . 2]" 1
416 1 26 GLU HA 1 64 TYR H . . 4.120 3.583 3.380 3.858 . 0 0 "[ . 1 . 2]" 1
417 1 26 GLU QB 1 27 PHE H . . 3.730 2.985 2.354 3.766 0.036 4 0 "[ . 1 . 2]" 1
418 1 26 GLU QB 1 27 PHE HA . . 4.650 4.326 4.047 4.583 . 0 0 "[ . 1 . 2]" 1
419 1 26 GLU QB 1 61 ARG QG . . 4.200 3.880 2.714 4.951 0.751 6 6 "[ *-.+ 1 ***. 2]" 1
420 1 26 GLU QB 1 63 THR HA . . 3.900 2.996 2.350 3.985 0.085 4 0 "[ . 1 . 2]" 1
421 1 26 GLU QB 1 63 THR HB . . 4.460 4.475 4.067 5.172 0.712 4 3 "[ *+. 1 - . 2]" 1
422 1 26 GLU QB 1 63 THR MG . . 2.990 2.447 2.236 2.863 . 0 0 "[ . 1 . 2]" 1
423 1 26 GLU QB 1 64 TYR H . . 4.550 4.165 3.651 4.949 0.399 4 0 "[ . 1 . 2]" 1
424 1 26 GLU HB2 1 27 PHE H . . 4.380 3.193 2.382 4.236 . 0 0 "[ . 1 . 2]" 1
425 1 26 GLU HB2 1 27 PHE HA . . 5.500 4.878 4.150 5.816 0.316 14 0 "[ . 1 . 2]" 1
426 1 26 GLU HB2 1 63 THR HA . . 4.740 3.442 3.107 4.118 . 0 0 "[ . 1 . 2]" 1
427 1 26 GLU HB3 1 27 PHE H . . 4.380 3.920 3.560 4.228 . 0 0 "[ . 1 . 2]" 1
428 1 26 GLU HB3 1 27 PHE HA . . 5.500 5.307 4.651 5.738 0.238 19 0 "[ . 1 . 2]" 1
429 1 26 GLU HB3 1 63 THR HA . . 4.740 3.632 2.397 5.306 0.566 4 1 "[ +. 1 . 2]" 1
430 1 26 GLU QG 1 27 PHE H . . 4.830 3.363 2.458 4.284 . 0 0 "[ . 1 . 2]" 1
431 1 26 GLU QG 1 27 PHE HA . . 5.280 3.935 3.325 5.132 . 0 0 "[ . 1 . 2]" 1
432 1 26 GLU QG 1 61 ARG HG2 . . 5.040 4.291 2.862 5.457 0.417 15 0 "[ . 1 . 2]" 1
433 1 26 GLU QG 1 61 ARG QG . . 4.400 3.807 2.757 4.812 0.412 15 0 "[ . 1 . 2]" 1
434 1 26 GLU QG 1 61 ARG HG3 . . 5.040 4.325 3.056 5.348 0.308 15 0 "[ . 1 . 2]" 1
435 1 26 GLU QG 1 63 THR HA . . 4.930 4.178 3.168 4.949 0.019 8 0 "[ . 1 . 2]" 1
436 1 26 GLU QG 1 63 THR HB . . 5.500 5.460 4.340 6.299 0.799 19 9 "[ * ***1 .-**+*]" 1
437 1 26 GLU QG 1 63 THR MG . . 4.280 3.742 3.092 4.141 . 0 0 "[ . 1 . 2]" 1
438 1 27 PHE H 1 27 PHE QD . . 4.340 3.109 2.875 3.261 . 0 0 "[ . 1 . 2]" 1
439 1 27 PHE H 1 61 ARG HG2 . . 5.390 4.185 3.215 4.650 . 0 0 "[ . 1 . 2]" 1
440 1 27 PHE H 1 61 ARG QG . . 4.690 3.630 2.939 3.909 . 0 0 "[ . 1 . 2]" 1
441 1 27 PHE H 1 61 ARG HG3 . . 5.390 4.075 3.402 4.859 . 0 0 "[ . 1 . 2]" 1
442 1 27 PHE H 1 62 VAL H . . 3.660 3.240 3.068 3.394 . 0 0 "[ . 1 . 2]" 1
443 1 27 PHE H 1 62 VAL HB . . 5.260 4.013 3.547 5.182 . 0 0 "[ . 1 . 2]" 1
444 1 27 PHE H 1 62 VAL QG . . 5.230 3.849 2.918 4.189 . 0 0 "[ . 1 . 2]" 1
445 1 27 PHE H 1 63 THR HA . . 4.780 3.706 3.476 3.967 . 0 0 "[ . 1 . 2]" 1
446 1 27 PHE H 1 63 THR MG . . 5.180 5.038 4.720 5.367 0.187 19 0 "[ . 1 . 2]" 1
447 1 27 PHE HA 1 27 PHE QD . . 4.050 3.756 3.724 3.769 . 0 0 "[ . 1 . 2]" 1
448 1 27 PHE HA 1 28 VAL H . . 3.070 2.368 2.242 2.488 . 0 0 "[ . 1 . 2]" 1
449 1 27 PHE HA 1 28 VAL HB . . 4.880 4.600 4.336 4.901 0.021 11 0 "[ . 1 . 2]" 1
450 1 27 PHE HA 1 28 VAL QG . . 3.990 3.631 3.335 3.884 . 0 0 "[ . 1 . 2]" 1
451 1 27 PHE QB 1 28 VAL H . . 3.300 2.554 2.430 2.818 . 0 0 "[ . 1 . 2]" 1
452 1 27 PHE QB 1 62 VAL QG . . 5.350 4.590 3.951 4.852 . 0 0 "[ . 1 . 2]" 1
453 1 27 PHE QD 1 28 VAL H . . 4.290 3.243 2.772 3.795 . 0 0 "[ . 1 . 2]" 1
454 1 27 PHE QD 1 29 VAL MG2 . . 3.560 3.119 2.742 3.744 0.184 7 0 "[ . 1 . 2]" 1
455 1 27 PHE QD 1 62 VAL HB . . 5.500 3.941 3.477 5.576 0.076 20 0 "[ . 1 . 2]" 1
456 1 27 PHE QD 1 64 TYR QE . . 4.130 2.901 2.655 3.331 . 0 0 "[ . 1 . 2]" 1
457 1 27 PHE QD 1 76 ILE MD . . 4.170 3.423 3.082 3.982 . 0 0 "[ . 1 . 2]" 1
458 1 27 PHE QE 1 28 VAL H . . 5.500 5.444 4.896 5.951 0.451 11 0 "[ . 1 . 2]" 1
459 1 27 PHE QE 1 29 VAL HB . . 4.760 4.962 4.722 5.097 0.337 15 0 "[ . 1 . 2]" 1
460 1 27 PHE QE 1 29 VAL MG2 . . 3.250 2.273 2.107 2.386 . 0 0 "[ . 1 . 2]" 1
461 1 27 PHE QE 1 43 ILE MD . . 4.350 2.897 2.491 3.547 . 0 0 "[ . 1 . 2]" 1
462 1 27 PHE QE 1 62 VAL HB . . 4.790 3.407 2.938 4.882 0.092 20 0 "[ . 1 . 2]" 1
463 1 27 PHE QE 1 62 VAL QG . . 3.330 2.505 2.306 2.613 . 0 0 "[ . 1 . 2]" 1
464 1 27 PHE QE 1 64 TYR QD . . 4.060 2.865 2.454 4.295 0.235 7 0 "[ . 1 . 2]" 1
465 1 27 PHE QE 1 64 TYR QE . . 4.110 2.814 2.538 3.690 . 0 0 "[ . 1 . 2]" 1
466 1 27 PHE QE 1 74 ILE MD . . 3.800 2.429 2.125 2.670 . 0 0 "[ . 1 . 2]" 1
467 1 27 PHE QE 1 76 ILE MD . . 3.560 2.340 2.233 2.460 . 0 0 "[ . 1 . 2]" 1
468 1 27 PHE QE 1 76 ILE QG . . 5.190 3.110 2.859 3.537 . 0 0 "[ . 1 . 2]" 1
469 1 27 PHE QE 1 76 ILE MG . . 4.370 3.557 3.312 3.800 . 0 0 "[ . 1 . 2]" 1
470 1 27 PHE HZ 1 43 ILE MD . . 5.500 3.453 2.946 4.960 . 0 0 "[ . 1 . 2]" 1
471 1 27 PHE HZ 1 62 VAL HB . . 5.500 3.626 3.094 5.446 . 0 0 "[ . 1 . 2]" 1
472 1 27 PHE HZ 1 62 VAL QG . . 3.410 2.501 2.341 2.770 . 0 0 "[ . 1 . 2]" 1
473 1 27 PHE HZ 1 76 ILE MG . . 3.610 4.714 3.908 4.979 1.369 13 19 "[****** **-**+*******]" 1
474 1 28 VAL H 1 28 VAL HB . . 3.240 2.822 2.550 3.184 . 0 0 "[ . 1 . 2]" 1
475 1 28 VAL H 1 28 VAL MG1 . . 4.110 3.250 2.197 3.941 . 0 0 "[ . 1 . 2]" 1
476 1 28 VAL H 1 28 VAL QG . . 3.400 2.520 2.186 2.776 . 0 0 "[ . 1 . 2]" 1
477 1 28 VAL H 1 28 VAL MG2 . . 4.110 3.226 2.449 3.982 . 0 0 "[ . 1 . 2]" 1
478 1 28 VAL HA 1 28 VAL MG1 . . 3.300 2.744 2.281 3.266 . 0 0 "[ . 1 . 2]" 1
479 1 28 VAL HA 1 28 VAL MG2 . . 3.300 2.399 2.307 2.548 . 0 0 "[ . 1 . 2]" 1
480 1 28 VAL HA 1 29 VAL H . . 2.800 2.141 2.111 2.173 . 0 0 "[ . 1 . 2]" 1
481 1 28 VAL HA 1 29 VAL HB . . 4.940 4.690 4.643 4.756 . 0 0 "[ . 1 . 2]" 1
482 1 28 VAL HA 1 58 GLU QB . . 5.270 5.534 5.151 5.767 0.497 16 0 "[ . 1 . 2]" 1
483 1 28 VAL QG 1 29 VAL H . . 3.310 2.685 2.510 2.802 . 0 0 "[ . 1 . 2]" 1
484 1 28 VAL QG 1 30 ASN H . . 4.540 3.498 3.271 4.026 . 0 0 "[ . 1 . 2]" 1
485 1 28 VAL QG 1 30 ASN HA . . 4.220 2.784 2.621 3.114 . 0 0 "[ . 1 . 2]" 1
486 1 28 VAL QG 1 30 ASN HB2 . . 4.080 3.032 2.374 3.769 . 0 0 "[ . 1 . 2]" 1
487 1 28 VAL QG 1 30 ASN HB3 . . 5.440 4.192 3.610 4.939 . 0 0 "[ . 1 . 2]" 1
488 1 28 VAL QG 1 58 GLU HA . . 4.820 4.001 3.854 4.237 . 0 0 "[ . 1 . 2]" 1
489 1 28 VAL QG 1 58 GLU QB . . 3.610 2.161 2.019 2.387 . 0 0 "[ . 1 . 2]" 1
490 1 28 VAL QG 1 58 GLU QG . . 3.580 2.275 1.989 3.665 0.085 11 0 "[ . 1 . 2]" 1
491 1 28 VAL QG 1 59 GLY QA . . 5.280 2.949 2.592 3.281 . 0 0 "[ . 1 . 2]" 1
492 1 28 VAL QG 1 60 TYR H . . 3.940 3.231 2.662 3.845 . 0 0 "[ . 1 . 2]" 1
493 1 28 VAL QG 1 61 ARG QG . . 3.950 2.659 2.089 3.726 . 0 0 "[ . 1 . 2]" 1
494 1 28 VAL MG1 1 29 VAL H . . 4.280 3.264 2.647 4.050 . 0 0 "[ . 1 . 2]" 1
495 1 28 VAL MG1 1 58 GLU QG . . 4.700 2.456 2.275 3.872 . 0 0 "[ . 1 . 2]" 1
496 1 28 VAL MG2 1 29 VAL H . . 4.280 3.518 2.543 4.241 . 0 0 "[ . 1 . 2]" 1
497 1 28 VAL MG2 1 58 GLU QG . . 4.700 2.884 2.128 4.527 . 0 0 "[ . 1 . 2]" 1
498 1 29 VAL H 1 29 VAL HB . . 3.590 2.578 2.538 2.626 . 0 0 "[ . 1 . 2]" 1
499 1 29 VAL H 1 29 VAL MG1 . . 4.600 3.823 3.808 3.837 . 0 0 "[ . 1 . 2]" 1
500 1 29 VAL H 1 29 VAL MG2 . . 3.650 2.230 2.096 2.444 . 0 0 "[ . 1 . 2]" 1
501 1 29 VAL H 1 60 TYR H . . 3.670 3.834 3.380 4.257 0.587 6 4 "[ *+ - *. 2]" 1
502 1 29 VAL HA 1 29 VAL MG1 . . 3.380 2.345 2.302 2.383 . 0 0 "[ . 1 . 2]" 1
503 1 29 VAL HA 1 29 VAL MG2 . . 3.420 2.477 2.433 2.518 . 0 0 "[ . 1 . 2]" 1
504 1 29 VAL HA 1 30 ASN H . . 2.990 2.161 2.135 2.189 . 0 0 "[ . 1 . 2]" 1
505 1 29 VAL HA 1 30 ASN HB2 . . 4.740 4.554 4.220 4.676 . 0 0 "[ . 1 . 2]" 1
506 1 29 VAL HA 1 30 ASN HB3 . . 4.830 4.536 4.439 4.694 . 0 0 "[ . 1 . 2]" 1
507 1 29 VAL HA 1 39 LEU QD . . 5.440 4.578 4.451 4.696 . 0 0 "[ . 1 . 2]" 1
508 1 29 VAL HB 1 39 LEU QD . . 4.310 2.699 2.486 2.927 . 0 0 "[ . 1 . 2]" 1
509 1 29 VAL HB 1 60 TYR H . . 4.010 3.241 3.008 3.555 . 0 0 "[ . 1 . 2]" 1
510 1 29 VAL HB 1 60 TYR HB2 . . 4.040 2.398 2.260 2.669 . 0 0 "[ . 1 . 2]" 1
511 1 29 VAL HB 1 60 TYR HB3 . . 5.050 3.882 3.730 4.159 . 0 0 "[ . 1 . 2]" 1
512 1 29 VAL HB 1 60 TYR QD . . 4.320 3.551 3.166 3.820 . 0 0 "[ . 1 . 2]" 1
513 1 29 VAL MG1 1 30 ASN H . . 3.950 3.126 2.997 3.221 . 0 0 "[ . 1 . 2]" 1
514 1 29 VAL MG1 1 30 ASN HA . . 4.820 4.384 4.291 4.486 . 0 0 "[ . 1 . 2]" 1
515 1 29 VAL MG1 1 60 TYR QD . . 4.480 3.716 3.417 4.040 . 0 0 "[ . 1 . 2]" 1
516 1 29 VAL MG2 1 30 ASN H . . 4.780 4.267 4.218 4.311 . 0 0 "[ . 1 . 2]" 1
517 1 29 VAL MG2 1 60 TYR H . . 4.970 4.607 4.334 4.948 . 0 0 "[ . 1 . 2]" 1
518 1 29 VAL MG2 1 60 TYR HB2 . . 4.750 3.469 3.262 3.627 . 0 0 "[ . 1 . 2]" 1
519 1 29 VAL MG2 1 60 TYR HB3 . . 5.500 4.141 3.956 4.368 . 0 0 "[ . 1 . 2]" 1
520 1 30 ASN H 1 30 ASN HB2 . . 3.780 2.763 2.575 2.838 . 0 0 "[ . 1 . 2]" 1
521 1 30 ASN H 1 30 ASN HB3 . . 3.660 2.413 2.323 2.599 . 0 0 "[ . 1 . 2]" 1
522 1 30 ASN H 1 31 THR MG . . 5.240 4.596 4.419 4.767 . 0 0 "[ . 1 . 2]" 1
523 1 30 ASN HA 1 31 THR H . . 2.990 2.094 2.077 2.135 . 0 0 "[ . 1 . 2]" 1
524 1 30 ASN HA 1 31 THR MG . . 4.500 3.739 3.503 3.937 . 0 0 "[ . 1 . 2]" 1
525 1 30 ASN HA 1 32 SER H . . 3.690 3.593 3.378 3.748 0.058 18 0 "[ . 1 . 2]" 1
526 1 30 ASN HA 1 58 GLU QB . . 4.260 4.797 2.565 5.156 0.896 12 16 "[***** **** +-*.*** *]" 1
527 1 30 ASN HA 1 58 GLU QG . . 4.580 3.755 2.607 4.283 . 0 0 "[ . 1 . 2]" 1
528 1 30 ASN HB2 1 31 THR H . . 4.720 4.263 4.133 4.378 . 0 0 "[ . 1 . 2]" 1
529 1 30 ASN HB2 1 58 GLU QG . . 4.630 3.482 2.844 4.007 . 0 0 "[ . 1 . 2]" 1
530 1 30 ASN HB3 1 31 THR H . . 4.890 4.351 4.225 4.468 . 0 0 "[ . 1 . 2]" 1
531 1 30 ASN HB3 1 31 THR HA . . 5.500 5.198 5.035 5.265 . 0 0 "[ . 1 . 2]" 1
532 1 30 ASN QD 1 58 GLU QB . . 4.370 4.022 3.335 4.337 . 0 0 "[ . 1 . 2]" 1
533 1 30 ASN HD21 1 58 GLU QB . . 5.230 4.230 3.735 4.834 . 0 0 "[ . 1 . 2]" 1
534 1 30 ASN HD21 1 58 GLU QG . . 4.640 2.670 2.129 3.328 . 0 0 "[ . 1 . 2]" 1
535 1 30 ASN HD22 1 58 GLU QB . . 5.230 5.101 3.751 5.644 0.414 5 0 "[ . 1 . 2]" 1
536 1 30 ASN HD22 1 58 GLU QG . . 4.640 3.562 2.779 4.341 . 0 0 "[ . 1 . 2]" 1
537 1 31 THR H 1 31 THR MG . . 3.930 2.668 2.600 2.765 . 0 0 "[ . 1 . 2]" 1
538 1 31 THR H 1 32 SER H . . 3.050 2.404 2.263 2.530 . 0 0 "[ . 1 . 2]" 1
539 1 31 THR H 1 32 SER HA . . 4.760 4.677 4.485 4.786 0.026 17 0 "[ . 1 . 2]" 1
540 1 31 THR H 1 32 SER QB . . 4.800 4.550 3.983 4.759 . 0 0 "[ . 1 . 2]" 1
541 1 31 THR H 1 58 GLU QG . . 4.710 4.943 3.896 5.463 0.753 12 4 "[ -*. * + . 2]" 1
542 1 31 THR H 1 59 GLY HA2 . . 4.090 3.350 3.008 3.710 . 0 0 "[ . 1 . 2]" 1
543 1 31 THR H 1 59 GLY QA . . 3.440 2.476 2.244 2.672 . 0 0 "[ . 1 . 2]" 1
544 1 31 THR H 1 59 GLY HA3 . . 4.090 2.552 2.316 2.740 . 0 0 "[ . 1 . 2]" 1
545 1 31 THR HA 1 31 THR MG . . 3.520 2.337 2.299 2.387 . 0 0 "[ . 1 . 2]" 1
546 1 31 THR HA 1 34 ALA H . . 4.110 3.482 3.371 3.663 . 0 0 "[ . 1 . 2]" 1
547 1 31 THR HA 1 34 ALA MB . . 3.550 2.734 2.582 2.877 . 0 0 "[ . 1 . 2]" 1
548 1 31 THR HA 1 35 GLY H . . 5.300 4.188 3.938 4.454 . 0 0 "[ . 1 . 2]" 1
549 1 31 THR HA 1 78 TYR QE . . 5.500 4.952 4.732 5.145 . 0 0 "[ . 1 . 2]" 1
550 1 31 THR HB 1 34 ALA MB . . 4.140 3.278 2.964 3.574 . 0 0 "[ . 1 . 2]" 1
551 1 31 THR MG 1 32 SER H . . 4.610 4.327 4.287 4.379 . 0 0 "[ . 1 . 2]" 1
552 1 31 THR MG 1 39 LEU QD . . 4.370 3.691 3.230 4.097 . 0 0 "[ . 1 . 2]" 1
553 1 31 THR MG 1 59 GLY QA . . 4.460 2.903 2.566 3.319 . 0 0 "[ . 1 . 2]" 1
554 1 31 THR MG 1 60 TYR H . . 5.350 3.163 2.839 3.583 . 0 0 "[ . 1 . 2]" 1
555 1 31 THR MG 1 60 TYR HB2 . . 5.440 4.093 3.687 4.330 . 0 0 "[ . 1 . 2]" 1
556 1 31 THR MG 1 60 TYR QD . . 3.760 2.636 2.308 2.986 . 0 0 "[ . 1 . 2]" 1
557 1 31 THR MG 1 78 TYR QE . . 3.850 2.481 2.205 2.864 . 0 0 "[ . 1 . 2]" 1
558 1 32 SER H 1 32 SER QB . . 3.210 2.497 2.199 2.578 . 0 0 "[ . 1 . 2]" 1
559 1 32 SER H 1 33 ASN H . . 3.950 2.853 2.740 2.912 . 0 0 "[ . 1 . 2]" 1
560 1 32 SER H 1 34 ALA H . . 4.670 4.196 4.086 4.293 . 0 0 "[ . 1 . 2]" 1
561 1 32 SER HA 1 34 ALA H . . 5.170 3.941 3.627 4.132 . 0 0 "[ . 1 . 2]" 1
562 1 32 SER QB 1 34 ALA H . . 5.250 4.637 4.560 4.918 . 0 0 "[ . 1 . 2]" 1
563 1 33 ASN H 1 33 ASN HB2 . . 3.630 2.326 2.218 2.375 . 0 0 "[ . 1 . 2]" 1
564 1 33 ASN H 1 33 ASN HB3 . . 4.050 3.563 3.520 3.602 . 0 0 "[ . 1 . 2]" 1
565 1 33 ASN H 1 34 ALA H . . 3.180 2.560 2.428 2.678 . 0 0 "[ . 1 . 2]" 1
566 1 33 ASN H 1 34 ALA MB . . 4.610 3.977 3.823 4.143 . 0 0 "[ . 1 . 2]" 1
567 1 33 ASN HB2 1 34 ALA H . . 4.410 3.388 3.207 3.544 . 0 0 "[ . 1 . 2]" 1
568 1 33 ASN HB3 1 34 ALA H . . 4.720 4.115 3.939 4.241 . 0 0 "[ . 1 . 2]" 1
569 1 34 ALA H 1 34 ALA MB . . 3.080 2.304 2.267 2.354 . 0 0 "[ . 1 . 2]" 1
570 1 34 ALA H 1 35 GLY H . . 3.400 2.197 2.077 2.343 . 0 0 "[ . 1 . 2]" 1
571 1 34 ALA MB 1 35 GLY H . . 3.800 2.673 2.363 3.037 . 0 0 "[ . 1 . 2]" 1
572 1 34 ALA MB 1 78 TYR QE . . 3.530 3.236 2.786 3.794 0.264 18 0 "[ . 1 . 2]" 1
573 1 35 GLY QA 1 36 ALA MB . . 4.650 3.643 3.533 3.779 . 0 0 "[ . 1 . 2]" 1
574 1 36 ALA H 1 36 ALA MB . . 3.550 2.457 2.182 2.765 . 0 0 "[ . 1 . 2]" 1
575 1 36 ALA H 1 37 GLY H . . 4.880 4.514 4.274 4.668 . 0 0 "[ . 1 . 2]" 1
576 1 36 ALA HA 1 37 GLY H . . 3.030 2.331 2.143 2.534 . 0 0 "[ . 1 . 2]" 1
577 1 36 ALA MB 1 37 GLY H . . 3.790 2.578 2.186 3.243 . 0 0 "[ . 1 . 2]" 1
578 1 36 ALA MB 1 37 GLY QA . . 4.950 3.678 3.534 3.902 . 0 0 "[ . 1 . 2]" 1
579 1 37 GLY H 1 38 ALA H . . 4.510 4.369 4.278 4.424 . 0 0 "[ . 1 . 2]" 1
580 1 37 GLY H 1 78 TYR QE . . 4.340 4.032 3.468 4.560 0.220 15 0 "[ . 1 . 2]" 1
581 1 37 GLY QA 1 38 ALA MB . . 4.230 3.722 3.612 3.762 . 0 0 "[ . 1 . 2]" 1
582 1 37 GLY QA 1 78 TYR QE . . 4.480 3.239 2.623 3.558 . 0 0 "[ . 1 . 2]" 1
583 1 38 ALA H 1 38 ALA MB . . 3.380 2.233 2.206 2.444 . 0 0 "[ . 1 . 2]" 1
584 1 38 ALA H 1 39 LEU H . . 4.600 4.608 4.466 4.648 0.048 10 0 "[ . 1 . 2]" 1
585 1 38 ALA HA 1 39 LEU H . . 2.750 2.198 2.137 2.252 . 0 0 "[ . 1 . 2]" 1
586 1 38 ALA HA 1 39 LEU QB . . 4.530 3.965 3.894 4.025 . 0 0 "[ . 1 . 2]" 1
587 1 38 ALA MB 1 39 LEU H . . 3.310 2.869 2.691 3.145 . 0 0 "[ . 1 . 2]" 1
588 1 38 ALA MB 1 40 SER QB . . 4.700 4.692 4.242 5.242 0.542 8 1 "[ . + 1 . 2]" 1
589 1 38 ALA MB 1 78 TYR HA . . 4.760 4.731 4.577 4.833 0.073 8 0 "[ . 1 . 2]" 1
590 1 38 ALA MB 1 78 TYR QD . . 4.920 5.163 4.906 5.307 0.387 9 0 "[ . 1 . 2]" 1
591 1 38 ALA MB 1 79 GLY H . . 4.590 3.569 3.306 3.794 . 0 0 "[ . 1 . 2]" 1
592 1 39 LEU H 1 39 LEU QB . . 3.190 2.376 2.255 2.527 . 0 0 "[ . 1 . 2]" 1
593 1 39 LEU H 1 39 LEU MD1 . . 4.780 4.339 4.168 4.705 . 0 0 "[ . 1 . 2]" 1
594 1 39 LEU H 1 39 LEU QD . . 4.170 3.875 3.777 3.986 . 0 0 "[ . 1 . 2]" 1
595 1 39 LEU H 1 39 LEU MD2 . . 4.780 4.371 4.047 4.516 . 0 0 "[ . 1 . 2]" 1
596 1 39 LEU H 1 39 LEU HG . . 4.990 4.466 4.362 4.569 . 0 0 "[ . 1 . 2]" 1
597 1 39 LEU H 1 40 SER H . . 5.230 4.502 4.337 4.590 . 0 0 "[ . 1 . 2]" 1
598 1 39 LEU HA 1 39 LEU MD1 . . 4.590 2.235 2.132 3.415 . 0 0 "[ . 1 . 2]" 1
599 1 39 LEU HA 1 39 LEU QD . . 3.480 2.210 2.123 3.116 . 0 0 "[ . 1 . 2]" 1
600 1 39 LEU HA 1 39 LEU MD2 . . 4.590 3.894 3.597 3.934 . 0 0 "[ . 1 . 2]" 1
601 1 39 LEU HA 1 40 SER H . . 3.030 2.232 2.192 2.290 . 0 0 "[ . 1 . 2]" 1
602 1 39 LEU HA 1 40 SER QB . . 4.620 4.072 3.871 4.364 . 0 0 "[ . 1 . 2]" 1
603 1 39 LEU HA 1 78 TYR HA . . 3.860 2.516 2.373 2.645 . 0 0 "[ . 1 . 2]" 1
604 1 39 LEU HA 1 78 TYR QD . . 3.790 2.755 2.324 3.311 . 0 0 "[ . 1 . 2]" 1
605 1 39 LEU HA 1 78 TYR QE . . 5.120 4.557 4.118 4.897 . 0 0 "[ . 1 . 2]" 1
606 1 39 LEU HA 1 79 GLY H . . 4.730 3.743 3.448 3.926 . 0 0 "[ . 1 . 2]" 1
607 1 39 LEU QB 1 78 TYR QD . . 4.100 2.714 2.255 3.299 . 0 0 "[ . 1 . 2]" 1
608 1 39 LEU HB2 1 78 TYR QD . . 4.740 2.744 2.267 3.355 . 0 0 "[ . 1 . 2]" 1
609 1 39 LEU HB3 1 78 TYR QD . . 4.740 4.342 3.965 4.865 0.125 18 0 "[ . 1 . 2]" 1
610 1 39 LEU QD 1 40 SER H . . 3.550 2.583 2.186 3.111 . 0 0 "[ . 1 . 2]" 1
611 1 39 LEU QD 1 40 SER QB . . 5.040 4.305 3.959 4.599 . 0 0 "[ . 1 . 2]" 1
612 1 39 LEU QD 1 41 VAL HB . . 5.110 2.899 2.318 4.004 . 0 0 "[ . 1 . 2]" 1
613 1 39 LEU QD 1 41 VAL QG . . 3.660 2.254 2.026 3.118 . 0 0 "[ . 1 . 2]" 1
614 1 39 LEU QD 1 60 TYR HB2 . . 4.280 2.236 2.114 2.384 . 0 0 "[ . 1 . 2]" 1
615 1 39 LEU QD 1 60 TYR HB3 . . 4.410 2.490 2.216 2.790 . 0 0 "[ . 1 . 2]" 1
616 1 39 LEU QD 1 60 TYR QD . . 3.970 2.584 2.295 3.095 . 0 0 "[ . 1 . 2]" 1
617 1 39 LEU QD 1 76 ILE MG . . 3.890 2.209 1.985 2.456 . 0 0 "[ . 1 . 2]" 1
618 1 39 LEU QD 1 78 TYR HA . . 4.010 3.085 2.731 4.052 0.042 9 0 "[ . 1 . 2]" 1
619 1 39 LEU QD 1 78 TYR QB . . 4.250 2.517 2.308 3.054 . 0 0 "[ . 1 . 2]" 1
620 1 39 LEU QD 1 78 TYR QD . . 3.410 2.187 2.098 2.303 . 0 0 "[ . 1 . 2]" 1
621 1 39 LEU HG 1 40 SER H . . 4.070 2.624 2.322 3.197 . 0 0 "[ . 1 . 2]" 1
622 1 39 LEU HG 1 41 VAL H . . 5.120 3.094 2.034 5.195 0.075 9 0 "[ . 1 . 2]" 1
623 1 39 LEU HG 1 41 VAL QG . . 3.320 2.692 2.057 4.131 0.811 9 1 "[ . +1 . 2]" 1
624 1 39 LEU HG 1 76 ILE HA . . 4.990 5.099 4.802 5.649 0.659 4 3 "[ - +. 1 . *2]" 1
625 1 39 LEU HG 1 78 TYR QD . . 5.200 4.433 3.658 4.679 . 0 0 "[ . 1 . 2]" 1
626 1 40 SER H 1 40 SER QB . . 3.440 2.619 2.289 2.790 . 0 0 "[ . 1 . 2]" 1
627 1 40 SER H 1 78 TYR HA . . 4.410 3.343 3.155 3.574 . 0 0 "[ . 1 . 2]" 1
628 1 40 SER H 1 78 TYR QB . . 5.390 4.311 3.930 4.771 . 0 0 "[ . 1 . 2]" 1
629 1 40 SER H 1 78 TYR QD . . 4.840 4.533 4.156 5.027 0.187 13 0 "[ . 1 . 2]" 1
630 1 40 SER QB 1 41 VAL H . . 3.940 3.628 2.084 4.096 0.156 14 0 "[ . 1 . 2]" 1
631 1 40 SER QB 1 41 VAL QG . . 5.350 4.738 3.978 4.992 . 0 0 "[ . 1 . 2]" 1
632 1 40 SER QB 1 77 LYS H . . 4.190 3.980 3.532 4.337 0.147 14 0 "[ . 1 . 2]" 1
633 1 40 SER QB 1 77 LYS HB2 . . 3.520 2.457 2.187 2.865 . 0 0 "[ . 1 . 2]" 1
634 1 40 SER QB 1 77 LYS HB3 . . 4.010 3.325 2.768 3.917 . 0 0 "[ . 1 . 2]" 1
635 1 40 SER QB 1 77 LYS QD . . 5.200 3.656 3.011 4.169 . 0 0 "[ . 1 . 2]" 1
636 1 40 SER QB 1 77 LYS HG2 . . 4.930 5.166 4.839 5.697 0.767 19 3 "[- . 1 . * +2]" 1
637 1 40 SER QB 1 77 LYS HG3 . . 4.690 4.650 4.251 5.009 0.319 19 0 "[ . 1 . 2]" 1
638 1 40 SER QB 1 78 TYR HA . . 4.850 4.388 3.874 5.222 0.372 9 0 "[ . 1 . 2]" 1
639 1 41 VAL H 1 41 VAL HB . . 3.920 2.963 2.487 3.848 . 0 0 "[ . 1 . 2]" 1
640 1 41 VAL H 1 41 VAL MG1 . . 4.330 2.718 2.024 4.140 . 0 0 "[ . 1 . 2]" 1
641 1 41 VAL H 1 41 VAL QG . . 3.540 2.358 1.972 3.175 . 0 0 "[ . 1 . 2]" 1
642 1 41 VAL H 1 41 VAL MG2 . . 4.330 3.589 1.978 4.100 . 0 0 "[ . 1 . 2]" 1
643 1 41 VAL H 1 42 THR H . . 5.200 4.411 3.598 4.672 . 0 0 "[ . 1 . 2]" 1
644 1 41 VAL H 1 77 LYS H . . 5.500 4.192 2.819 4.953 . 0 0 "[ . 1 . 2]" 1
645 1 41 VAL HA 1 42 THR H . . 3.060 2.146 2.084 2.230 . 0 0 "[ . 1 . 2]" 1
646 1 41 VAL HA 1 42 THR HA . . 4.680 4.458 4.415 4.481 . 0 0 "[ . 1 . 2]" 1
647 1 41 VAL HA 1 51 MET ME . . 5.500 4.938 4.351 5.639 0.139 3 0 "[ . 1 . 2]" 1
648 1 41 VAL HA 1 76 ILE QG . . 5.030 4.136 3.774 4.486 . 0 0 "[ . 1 . 2]" 1
649 1 41 VAL HA 1 77 LYS H . . 4.400 2.741 2.325 3.467 . 0 0 "[ . 1 . 2]" 1
650 1 41 VAL QG 1 42 THR H . . 4.060 2.461 2.297 2.683 . 0 0 "[ . 1 . 2]" 1
651 1 41 VAL QG 1 76 ILE H . . 5.440 4.010 3.587 4.534 . 0 0 "[ . 1 . 2]" 1
652 1 41 VAL QG 1 76 ILE HA . . 3.630 2.321 2.030 2.880 . 0 0 "[ . 1 . 2]" 1
653 1 41 VAL QG 1 77 LYS H . . 4.700 3.568 2.685 4.191 . 0 0 "[ . 1 . 2]" 1
654 1 41 VAL MG1 1 42 THR H . . 4.760 3.629 2.493 4.056 . 0 0 "[ . 1 . 2]" 1
655 1 41 VAL MG2 1 42 THR H . . 4.760 2.835 2.317 4.105 . 0 0 "[ . 1 . 2]" 1
656 1 42 THR H 1 42 THR HB . . 3.900 2.822 2.572 3.426 . 0 0 "[ . 1 . 2]" 1
657 1 42 THR H 1 42 THR MG . . 4.150 3.743 2.618 3.973 . 0 0 "[ . 1 . 2]" 1
658 1 42 THR H 1 43 ILE HG12 . . 5.500 4.942 4.644 5.327 . 0 0 "[ . 1 . 2]" 1
659 1 42 THR H 1 43 ILE HG13 . . 4.800 4.524 4.239 4.874 0.074 8 0 "[ . 1 . 2]" 1
660 1 42 THR H 1 51 MET ME . . 5.500 4.556 3.582 5.224 . 0 0 "[ . 1 . 2]" 1
661 1 42 THR H 1 74 ILE MG . . 4.910 4.193 3.850 4.477 . 0 0 "[ . 1 . 2]" 1
662 1 42 THR H 1 75 SER H . . 3.700 3.512 3.230 3.693 . 0 0 "[ . 1 . 2]" 1
663 1 42 THR H 1 75 SER QB . . 4.440 3.120 2.935 3.353 . 0 0 "[ . 1 . 2]" 1
664 1 42 THR H 1 76 ILE HA . . 4.410 3.705 3.465 4.076 . 0 0 "[ . 1 . 2]" 1
665 1 42 THR H 1 76 ILE QG . . 5.290 4.493 4.090 4.780 . 0 0 "[ . 1 . 2]" 1
666 1 42 THR HA 1 42 THR MG . . 3.160 2.553 2.357 3.236 0.076 11 0 "[ . 1 . 2]" 1
667 1 42 THR HA 1 43 ILE H . . 2.930 2.257 2.184 2.458 . 0 0 "[ . 1 . 2]" 1
668 1 42 THR HA 1 43 ILE HB . . 4.750 4.647 4.427 4.757 0.007 8 0 "[ . 1 . 2]" 1
669 1 42 THR HA 1 51 MET ME . . 4.530 3.573 2.459 4.426 . 0 0 "[ . 1 . 2]" 1
670 1 42 THR HB 1 43 ILE H . . 4.250 4.024 3.790 4.180 . 0 0 "[ . 1 . 2]" 1
671 1 42 THR HB 1 75 SER QB . . 4.770 2.776 2.153 4.778 0.008 15 0 "[ . 1 . 2]" 1
672 1 42 THR MG 1 43 ILE H . . 3.710 2.633 2.423 3.318 . 0 0 "[ . 1 . 2]" 1
673 1 42 THR MG 1 44 ASP H . . 5.190 3.926 3.576 4.517 . 0 0 "[ . 1 . 2]" 1
674 1 42 THR MG 1 75 SER QB . . 4.940 3.435 2.141 4.021 . 0 0 "[ . 1 . 2]" 1
675 1 43 ILE H 1 43 ILE HB . . 3.580 2.707 2.613 2.830 . 0 0 "[ . 1 . 2]" 1
676 1 43 ILE H 1 43 ILE HG12 . . 4.890 3.895 3.784 4.060 . 0 0 "[ . 1 . 2]" 1
677 1 43 ILE H 1 43 ILE HG13 . . 4.220 2.884 2.657 3.072 . 0 0 "[ . 1 . 2]" 1
678 1 43 ILE H 1 43 ILE MG . . 4.370 3.907 3.873 3.953 . 0 0 "[ . 1 . 2]" 1
679 1 43 ILE H 1 51 MET ME . . 4.420 3.984 3.495 4.581 0.161 4 0 "[ . 1 . 2]" 1
680 1 43 ILE HA 1 43 ILE MD . . 4.230 3.838 3.780 3.878 . 0 0 "[ . 1 . 2]" 1
681 1 43 ILE HA 1 43 ILE HG12 . . 4.160 2.476 2.380 2.551 . 0 0 "[ . 1 . 2]" 1
682 1 43 ILE HA 1 43 ILE HG13 . . 4.170 3.105 3.062 3.166 . 0 0 "[ . 1 . 2]" 1
683 1 43 ILE HA 1 43 ILE MG . . 3.340 2.388 2.358 2.430 . 0 0 "[ . 1 . 2]" 1
684 1 43 ILE HB 1 43 ILE MD . . 3.300 2.548 2.510 2.583 . 0 0 "[ . 1 . 2]" 1
685 1 43 ILE HB 1 44 ASP H . . 4.860 4.305 4.141 4.396 . 0 0 "[ . 1 . 2]" 1
686 1 43 ILE HB 1 49 VAL MG1 . . 4.910 3.777 3.519 4.116 . 0 0 "[ . 1 . 2]" 1
687 1 43 ILE HB 1 49 VAL MG2 . . 3.450 2.438 2.100 2.767 . 0 0 "[ . 1 . 2]" 1
688 1 43 ILE HB 1 51 MET ME . . 4.890 4.052 3.119 4.719 . 0 0 "[ . 1 . 2]" 1
689 1 43 ILE MD 1 43 ILE MG . . 2.780 1.983 1.962 1.998 . 0 0 "[ . 1 . 2]" 1
690 1 43 ILE MD 1 49 VAL MG1 . . 4.090 3.404 3.019 3.725 . 0 0 "[ . 1 . 2]" 1
691 1 43 ILE MD 1 49 VAL MG2 . . 3.070 2.283 2.192 2.452 . 0 0 "[ . 1 . 2]" 1
692 1 43 ILE MD 1 51 MET HB2 . . 4.940 3.735 2.556 5.048 0.108 17 0 "[ . 1 . 2]" 1
693 1 43 ILE MD 1 51 MET QB . . 4.230 3.510 2.519 4.208 . 0 0 "[ . 1 . 2]" 1
694 1 43 ILE MD 1 51 MET HB3 . . 4.940 4.602 3.812 5.369 0.429 3 0 "[ . 1 . 2]" 1
695 1 43 ILE MD 1 51 MET ME . . 3.640 2.603 1.988 3.726 0.086 7 0 "[ . 1 . 2]" 1
696 1 43 ILE MD 1 51 MET QG . . 3.800 2.963 2.337 4.058 0.258 20 0 "[ . 1 . 2]" 1
697 1 43 ILE MD 1 64 TYR QB . . 3.350 2.809 2.452 3.350 0.000 20 0 "[ . 1 . 2]" 1
698 1 43 ILE MD 1 64 TYR QD . . 3.770 3.002 2.761 3.350 . 0 0 "[ . 1 . 2]" 1
699 1 43 ILE MD 1 74 ILE MD . . 4.050 2.933 2.800 3.202 . 0 0 "[ . 1 . 2]" 1
700 1 43 ILE MD 1 74 ILE HG12 . . 4.710 2.648 2.435 3.022 . 0 0 "[ . 1 . 2]" 1
701 1 43 ILE MD 1 74 ILE QG . . 4.080 2.617 2.411 2.976 . 0 0 "[ . 1 . 2]" 1
702 1 43 ILE MD 1 74 ILE HG13 . . 4.710 4.086 3.875 4.456 . 0 0 "[ . 1 . 2]" 1
703 1 43 ILE HG12 1 43 ILE MG . . 3.600 2.462 2.428 2.490 . 0 0 "[ . 1 . 2]" 1
704 1 43 ILE HG12 1 44 ASP H . . 4.450 4.435 4.266 4.551 0.101 15 0 "[ . 1 . 2]" 1
705 1 43 ILE HG12 1 74 ILE QG . . 3.880 2.376 2.221 2.535 . 0 0 "[ . 1 . 2]" 1
706 1 43 ILE HG13 1 43 ILE MG . . 3.410 3.228 3.222 3.233 . 0 0 "[ . 1 . 2]" 1
707 1 43 ILE HG13 1 51 MET ME . . 4.790 2.740 2.278 3.503 . 0 0 "[ . 1 . 2]" 1
708 1 43 ILE MG 1 44 ASP H . . 3.680 2.890 2.562 3.088 . 0 0 "[ . 1 . 2]" 1
709 1 43 ILE MG 1 49 VAL HB . . 4.950 4.274 4.036 4.681 . 0 0 "[ . 1 . 2]" 1
710 1 43 ILE MG 1 49 VAL MG1 . . 3.320 2.497 2.278 2.993 . 0 0 "[ . 1 . 2]" 1
711 1 43 ILE MG 1 72 TYR HB2 . . 3.790 3.670 3.201 3.901 0.111 14 0 "[ . 1 . 2]" 1
712 1 43 ILE MG 1 72 TYR HB3 . . 3.650 2.398 2.214 2.535 . 0 0 "[ . 1 . 2]" 1
713 1 43 ILE MG 1 72 TYR QD . . 3.350 2.316 2.142 2.572 . 0 0 "[ . 1 . 2]" 1
714 1 43 ILE MG 1 73 LEU H . . 4.830 3.699 3.272 4.209 . 0 0 "[ . 1 . 2]" 1
715 1 43 ILE MG 1 73 LEU HA . . 5.500 4.771 4.461 5.060 . 0 0 "[ . 1 . 2]" 1
716 1 44 ASP H 1 44 ASP HB2 . . 3.750 2.815 2.393 3.241 . 0 0 "[ . 1 . 2]" 1
717 1 44 ASP H 1 44 ASP QB . . 3.130 2.360 2.268 2.592 . 0 0 "[ . 1 . 2]" 1
718 1 44 ASP H 1 44 ASP HB3 . . 3.750 2.672 2.428 3.639 . 0 0 "[ . 1 . 2]" 1
719 1 44 ASP H 1 45 GLY H . . 4.520 4.565 4.346 4.637 0.117 15 0 "[ . 1 . 2]" 1
720 1 44 ASP H 1 73 LEU H . . 3.790 3.463 3.231 3.607 . 0 0 "[ . 1 . 2]" 1
721 1 44 ASP H 1 73 LEU QB . . 5.050 3.419 3.203 3.791 . 0 0 "[ . 1 . 2]" 1
722 1 44 ASP HA 1 45 GLY H . . 2.940 2.415 2.210 2.552 . 0 0 "[ . 1 . 2]" 1
723 1 44 ASP HA 1 45 GLY QA . . 4.630 4.007 3.926 4.063 . 0 0 "[ . 1 . 2]" 1
724 1 44 ASP QB 1 45 GLY H . . 4.210 3.330 2.259 3.788 . 0 0 "[ . 1 . 2]" 1
725 1 44 ASP QB 1 73 LEU H . . 4.170 3.482 3.230 3.947 . 0 0 "[ . 1 . 2]" 1
726 1 44 ASP QB 1 73 LEU QB . . 3.430 2.549 2.306 3.296 . 0 0 "[ . 1 . 2]" 1
727 1 44 ASP QB 1 73 LEU QD . . 4.140 3.466 3.221 4.185 0.045 5 0 "[ . 1 . 2]" 1
728 1 44 ASP HB2 1 45 GLY H . . 4.790 3.977 3.574 4.270 . 0 0 "[ . 1 . 2]" 1
729 1 44 ASP HB2 1 73 LEU QB . . 5.140 3.897 2.403 4.880 . 0 0 "[ . 1 . 2]" 1
730 1 44 ASP HB3 1 45 GLY H . . 4.790 3.627 2.284 4.234 . 0 0 "[ . 1 . 2]" 1
731 1 44 ASP HB3 1 73 LEU QB . . 5.140 2.768 2.324 3.869 . 0 0 "[ . 1 . 2]" 1
732 1 45 GLY H 1 46 PRO QD . . 5.350 4.346 4.075 4.395 . 0 0 "[ . 1 . 2]" 1
733 1 45 GLY H 1 47 SER H . . 4.840 4.432 3.748 4.827 . 0 0 "[ . 1 . 2]" 1
734 1 45 GLY QA 1 46 PRO QD . . 2.790 1.998 1.952 2.036 . 0 0 "[ . 1 . 2]" 1
735 1 45 GLY QA 1 46 PRO HG2 . . 4.210 4.090 4.031 4.180 . 0 0 "[ . 1 . 2]" 1
736 1 45 GLY QA 1 72 TYR HA . . 3.510 2.377 2.152 2.629 . 0 0 "[ . 1 . 2]" 1
737 1 45 GLY HA2 1 46 PRO HD2 . . 3.650 3.083 2.894 3.411 . 0 0 "[ . 1 . 2]" 1
738 1 45 GLY HA2 1 46 PRO HD3 . . 3.650 2.857 2.729 3.222 . 0 0 "[ . 1 . 2]" 1
739 1 45 GLY HA2 1 46 PRO HG2 . . 5.040 5.161 5.009 5.447 0.407 1 0 "[ . 1 . 2]" 1
740 1 45 GLY HA2 1 47 SER H . . 4.620 4.492 4.377 4.784 0.164 14 0 "[ . 1 . 2]" 1
741 1 45 GLY HA2 1 72 TYR HA . . 4.040 2.803 2.577 3.254 . 0 0 "[ . 1 . 2]" 1
742 1 45 GLY HA2 1 72 TYR QD . . 4.300 4.111 4.012 4.280 . 0 0 "[ . 1 . 2]" 1
743 1 45 GLY HA3 1 46 PRO HD2 . . 3.650 2.122 2.036 2.198 . 0 0 "[ . 1 . 2]" 1
744 1 45 GLY HA3 1 46 PRO HD3 . . 3.650 2.947 2.710 3.114 . 0 0 "[ . 1 . 2]" 1
745 1 45 GLY HA3 1 46 PRO HG2 . . 5.040 4.291 4.227 4.407 . 0 0 "[ . 1 . 2]" 1
746 1 45 GLY HA3 1 47 SER H . . 4.620 3.385 3.224 3.736 . 0 0 "[ . 1 . 2]" 1
747 1 45 GLY HA3 1 72 TYR HA . . 4.040 2.600 2.278 2.883 . 0 0 "[ . 1 . 2]" 1
748 1 45 GLY HA3 1 72 TYR QD . . 4.300 2.671 2.521 2.893 . 0 0 "[ . 1 . 2]" 1
749 1 46 PRO HA 1 68 ALA MB . . 5.500 4.622 4.263 5.300 . 0 0 "[ . 1 . 2]" 1
750 1 46 PRO QB 1 47 SER H . . 4.010 3.537 3.314 3.804 . 0 0 "[ . 1 . 2]" 1
751 1 46 PRO QB 1 68 ALA MB . . 4.050 2.546 2.243 3.228 . 0 0 "[ . 1 . 2]" 1
752 1 46 PRO QD 1 47 SER H . . 3.800 2.849 2.731 3.174 . 0 0 "[ . 1 . 2]" 1
753 1 46 PRO QD 1 68 ALA MB . . 5.290 4.168 3.985 4.552 . 0 0 "[ . 1 . 2]" 1
754 1 46 PRO QD 1 70 GLY QA . . 5.180 3.486 3.242 3.826 . 0 0 "[ . 1 . 2]" 1
755 1 46 PRO QD 1 71 SER H . . 4.290 3.272 2.589 3.999 . 0 0 "[ . 1 . 2]" 1
756 1 46 PRO QD 1 72 TYR QD . . 4.510 3.173 3.033 3.276 . 0 0 "[ . 1 . 2]" 1
757 1 46 PRO QD 1 72 TYR QE . . 4.500 3.046 2.985 3.098 . 0 0 "[ . 1 . 2]" 1
758 1 46 PRO HD2 1 47 SER H . . 4.590 2.916 2.785 3.274 . 0 0 "[ . 1 . 2]" 1
759 1 46 PRO HD2 1 71 SER H . . 5.080 4.693 4.004 5.348 0.268 16 0 "[ . 1 . 2]" 1
760 1 46 PRO HD2 1 72 TYR HA . . 4.850 3.443 3.179 3.637 . 0 0 "[ . 1 . 2]" 1
761 1 46 PRO HD3 1 47 SER H . . 4.590 4.016 3.927 4.271 . 0 0 "[ . 1 . 2]" 1
762 1 46 PRO HD3 1 71 SER H . . 5.080 3.343 2.622 4.129 . 0 0 "[ . 1 . 2]" 1
763 1 46 PRO HD3 1 72 TYR HA . . 4.850 3.762 3.490 4.043 . 0 0 "[ . 1 . 2]" 1
764 1 46 PRO HG2 1 47 SER H . . 3.950 2.864 2.540 3.459 . 0 0 "[ . 1 . 2]" 1
765 1 46 PRO HG2 1 70 GLY QA . . 4.500 4.234 3.949 4.605 0.105 18 0 "[ . 1 . 2]" 1
766 1 46 PRO HG2 1 71 SER H . . 5.500 5.373 4.745 6.101 0.601 16 1 "[ . 1 .+ 2]" 1
767 1 46 PRO HG2 1 72 TYR QE . . 4.700 3.175 2.958 3.346 . 0 0 "[ . 1 . 2]" 1
768 1 46 PRO HG3 1 47 SER H . . 5.090 4.290 4.039 4.781 . 0 0 "[ . 1 . 2]" 1
769 1 46 PRO HG3 1 68 ALA MB . . 4.620 3.452 3.241 3.931 . 0 0 "[ . 1 . 2]" 1
770 1 46 PRO HG3 1 70 GLY HA2 . . 4.170 4.292 4.069 4.644 0.474 18 0 "[ . 1 . 2]" 1
771 1 46 PRO HG3 1 70 GLY HA3 . . 4.170 2.621 2.366 2.999 . 0 0 "[ . 1 . 2]" 1
772 1 46 PRO HG3 1 71 SER H . . 4.730 3.799 3.208 4.520 . 0 0 "[ . 1 . 2]" 1
773 1 46 PRO HG3 1 72 TYR QE . . 5.230 3.594 3.321 3.926 . 0 0 "[ . 1 . 2]" 1
774 1 47 SER H 1 47 SER QB . . 3.330 2.869 2.699 3.358 0.028 11 0 "[ . 1 . 2]" 1
775 1 47 SER H 1 48 LYS H . . 5.240 4.402 4.336 4.463 . 0 0 "[ . 1 . 2]" 1
776 1 47 SER H 1 49 VAL MG1 . . 4.870 4.549 3.682 4.935 0.065 18 0 "[ . 1 . 2]" 1
777 1 47 SER H 1 68 ALA MB . . 4.670 3.732 3.257 4.412 . 0 0 "[ . 1 . 2]" 1
778 1 47 SER H 1 72 TYR QE . . 3.440 2.895 2.133 3.141 . 0 0 "[ . 1 . 2]" 1
779 1 47 SER HA 1 48 LYS QB . . 4.570 4.686 4.468 4.887 0.317 5 0 "[ . 1 . 2]" 1
780 1 47 SER HA 1 48 LYS QG . . 4.720 4.140 3.807 5.199 0.479 3 0 "[ . 1 . 2]" 1
781 1 47 SER HA 1 68 ALA MB . . 4.910 4.455 4.181 4.858 . 0 0 "[ . 1 . 2]" 1
782 1 47 SER QB 1 48 LYS H . . 4.330 2.439 1.979 2.887 . 0 0 "[ . 1 . 2]" 1
783 1 47 SER QB 1 48 LYS QB . . 4.650 4.063 3.694 4.441 . 0 0 "[ . 1 . 2]" 1
784 1 47 SER QB 1 67 MET H . . 4.650 3.677 3.334 4.509 . 0 0 "[ . 1 . 2]" 1
785 1 47 SER QB 1 67 MET HB2 . . 4.790 4.584 4.310 4.919 0.129 1 0 "[ . 1 . 2]" 1
786 1 47 SER QB 1 67 MET QB . . 4.110 4.107 3.956 4.405 0.295 1 0 "[ . 1 . 2]" 1
787 1 47 SER QB 1 67 MET HB3 . . 4.790 4.647 4.389 5.037 0.247 11 0 "[ . 1 . 2]" 1
788 1 47 SER QB 1 67 MET QG . . 4.720 2.261 2.110 2.549 . 0 0 "[ . 1 . 2]" 1
789 1 47 SER QB 1 68 ALA H . . 4.040 3.767 3.356 4.651 0.611 11 1 "[ . 1+ . 2]" 1
790 1 47 SER QB 1 68 ALA MB . . 3.100 2.540 2.163 2.966 . 0 0 "[ . 1 . 2]" 1
791 1 47 SER QB 1 72 TYR QE . . 4.780 3.751 3.208 4.333 . 0 0 "[ . 1 . 2]" 1
792 1 48 LYS HA 1 48 LYS QD . . 4.030 3.577 2.157 4.269 0.239 12 0 "[ . 1 . 2]" 1
793 1 48 LYS HA 1 48 LYS QG . . 3.630 2.549 2.299 3.354 . 0 0 "[ . 1 . 2]" 1
794 1 48 LYS HA 1 49 VAL H . . 2.970 2.400 2.156 2.642 . 0 0 "[ . 1 . 2]" 1
795 1 48 LYS QB 1 49 VAL H . . 4.000 2.706 2.136 3.893 . 0 0 "[ . 1 . 2]" 1
796 1 48 LYS QG 1 49 VAL H . . 4.620 3.948 3.253 4.789 0.169 4 0 "[ . 1 . 2]" 1
797 1 49 VAL H 1 49 VAL MG1 . . 3.700 2.771 2.018 3.194 . 0 0 "[ . 1 . 2]" 1
798 1 49 VAL H 1 49 VAL MG2 . . 3.340 2.324 2.176 2.491 . 0 0 "[ . 1 . 2]" 1
799 1 49 VAL H 1 64 TYR QB . . 5.500 5.694 5.261 6.074 0.574 17 1 "[ . 1 . + 2]" 1
800 1 49 VAL HA 1 49 VAL MG1 . . 3.040 2.390 2.313 2.479 . 0 0 "[ . 1 . 2]" 1
801 1 49 VAL HA 1 49 VAL MG2 . . 3.480 3.258 3.249 3.267 . 0 0 "[ . 1 . 2]" 1
802 1 49 VAL HA 1 50 LYS H . . 3.120 2.250 2.183 2.305 . 0 0 "[ . 1 . 2]" 1
803 1 49 VAL HA 1 65 THR H . . 4.720 4.662 4.325 5.131 0.411 8 0 "[ . 1 . 2]" 1
804 1 49 VAL HA 1 65 THR HB . . 5.500 5.167 4.526 5.669 0.169 8 0 "[ . 1 . 2]" 1
805 1 49 VAL HA 1 72 TYR QE . . 5.500 4.507 4.187 4.968 . 0 0 "[ . 1 . 2]" 1
806 1 49 VAL HB 1 50 LYS H . . 3.710 2.813 2.574 3.102 . 0 0 "[ . 1 . 2]" 1
807 1 49 VAL HB 1 64 TYR HA . . 4.390 4.398 4.051 4.688 0.298 8 0 "[ . 1 . 2]" 1
808 1 49 VAL HB 1 64 TYR QB . . 3.840 2.547 2.300 2.900 . 0 0 "[ . 1 . 2]" 1
809 1 49 VAL HB 1 64 TYR QD . . 4.210 2.429 2.295 2.860 . 0 0 "[ . 1 . 2]" 1
810 1 49 VAL HB 1 65 THR H . . 4.340 3.451 2.864 3.778 . 0 0 "[ . 1 . 2]" 1
811 1 49 VAL HB 1 65 THR HB . . 5.320 5.090 4.289 5.635 0.315 2 0 "[ . 1 . 2]" 1
812 1 49 VAL MG1 1 50 LYS H . . 4.240 3.835 3.643 3.993 . 0 0 "[ . 1 . 2]" 1
813 1 49 VAL MG1 1 64 TYR QD . . 3.580 2.464 2.310 2.613 . 0 0 "[ . 1 . 2]" 1
814 1 49 VAL MG1 1 65 THR H . . 4.590 4.608 4.155 4.992 0.402 8 0 "[ . 1 . 2]" 1
815 1 49 VAL MG1 1 66 PRO HA . . 3.220 2.123 1.933 2.338 . 0 0 "[ . 1 . 2]" 1
816 1 49 VAL MG1 1 66 PRO HB3 . . 3.820 2.853 2.478 3.453 . 0 0 "[ . 1 . 2]" 1
817 1 49 VAL MG1 1 67 MET H . . 4.270 3.549 2.985 3.918 . 0 0 "[ . 1 . 2]" 1
818 1 49 VAL MG1 1 72 TYR QD . . 4.170 2.725 2.413 3.116 . 0 0 "[ . 1 . 2]" 1
819 1 49 VAL MG1 1 72 TYR QE . . 3.480 2.210 2.138 2.323 . 0 0 "[ . 1 . 2]" 1
820 1 49 VAL MG2 1 50 LYS H . . 4.250 3.772 3.537 4.020 . 0 0 "[ . 1 . 2]" 1
821 1 49 VAL MG2 1 51 MET HA . . 4.720 3.922 3.256 4.346 . 0 0 "[ . 1 . 2]" 1
822 1 49 VAL MG2 1 51 MET QB . . 3.750 2.584 2.089 4.034 0.284 15 0 "[ . 1 . 2]" 1
823 1 49 VAL MG2 1 51 MET QG . . 4.070 3.352 1.996 4.135 0.065 14 0 "[ . 1 . 2]" 1
824 1 49 VAL MG2 1 64 TYR QB . . 3.320 2.667 2.271 3.119 . 0 0 "[ . 1 . 2]" 1
825 1 49 VAL MG2 1 64 TYR QD . . 3.860 3.151 2.689 3.596 . 0 0 "[ . 1 . 2]" 1
826 1 49 VAL MG2 1 65 THR H . . 4.520 4.436 3.810 5.022 0.502 2 1 "[ + . 1 . 2]" 1
827 1 49 VAL MG2 1 72 TYR QE . . 4.310 4.258 3.998 4.371 0.061 11 0 "[ . 1 . 2]" 1
828 1 50 LYS H 1 50 LYS QB . . 3.480 2.339 2.164 2.508 . 0 0 "[ . 1 . 2]" 1
829 1 50 LYS H 1 65 THR HB . . 4.600 3.449 2.839 3.883 . 0 0 "[ . 1 . 2]" 1
830 1 50 LYS HA 1 51 MET H . . 2.970 2.303 2.186 2.545 . 0 0 "[ . 1 . 2]" 1
831 1 50 LYS QB 1 64 TYR HA . . 5.100 4.329 3.844 4.684 . 0 0 "[ . 1 . 2]" 1
832 1 50 LYS QB 1 65 THR H . . 4.490 2.968 2.474 3.328 . 0 0 "[ . 1 . 2]" 1
833 1 50 LYS QB 1 65 THR HB . . 4.200 2.432 2.168 3.456 . 0 0 "[ . 1 . 2]" 1
834 1 51 MET H 1 51 MET HB2 . . 4.170 2.718 2.309 3.353 . 0 0 "[ . 1 . 2]" 1
835 1 51 MET H 1 51 MET QB . . 3.540 2.403 2.172 2.785 . 0 0 "[ . 1 . 2]" 1
836 1 51 MET H 1 51 MET HB3 . . 4.170 2.848 2.513 3.744 . 0 0 "[ . 1 . 2]" 1
837 1 51 MET H 1 51 MET ME . . 5.500 5.156 4.471 6.137 0.637 9 4 "[ *- *+1 . 2]" 1
838 1 51 MET H 1 51 MET QG . . 4.610 3.797 2.452 4.385 . 0 0 "[ . 1 . 2]" 1
839 1 51 MET HA 1 51 MET ME . . 4.820 4.348 3.909 4.648 . 0 0 "[ . 1 . 2]" 1
840 1 51 MET HA 1 51 MET QG . . 3.650 2.383 2.295 2.466 . 0 0 "[ . 1 . 2]" 1
841 1 51 MET HA 1 52 ASP H . . 3.010 2.150 2.113 2.188 . 0 0 "[ . 1 . 2]" 1
842 1 51 MET HA 1 63 THR H . . 4.800 4.772 4.304 5.123 0.323 3 0 "[ . 1 . 2]" 1
843 1 51 MET HA 1 64 TYR HA . . 3.340 2.458 2.239 2.753 . 0 0 "[ . 1 . 2]" 1
844 1 51 MET HA 1 64 TYR QB . . 3.670 2.619 2.281 3.008 . 0 0 "[ . 1 . 2]" 1
845 1 51 MET HA 1 65 THR H . . 4.650 3.967 3.671 4.396 . 0 0 "[ . 1 . 2]" 1
846 1 51 MET QB 1 64 TYR HA . . 5.310 4.178 3.476 4.756 . 0 0 "[ . 1 . 2]" 1
847 1 51 MET QB 1 64 TYR QB . . 3.990 3.056 2.328 3.714 . 0 0 "[ . 1 . 2]" 1
848 1 51 MET HB2 1 62 VAL QG . . 5.500 4.626 4.174 5.095 . 0 0 "[ . 1 . 2]" 1
849 1 51 MET HB2 1 64 TYR QB . . 4.540 3.261 2.351 4.562 0.022 15 0 "[ . 1 . 2]" 1
850 1 51 MET HB3 1 62 VAL QG . . 5.500 4.542 2.955 5.217 . 0 0 "[ . 1 . 2]" 1
851 1 51 MET HB3 1 64 TYR QB . . 4.540 4.193 3.757 4.705 0.165 19 0 "[ . 1 . 2]" 1
852 1 51 MET ME 1 53 CYS HA . . 5.500 5.246 4.575 6.383 0.883 14 1 "[ . 1 +. 2]" 1
853 1 51 MET ME 1 53 CYS QB . . 5.000 3.758 2.879 4.862 . 0 0 "[ . 1 . 2]" 1
854 1 51 MET ME 1 62 VAL QG . . 3.610 2.392 1.943 3.276 . 0 0 "[ . 1 . 2]" 1
855 1 51 MET ME 1 64 TYR QB . . 5.310 3.870 2.636 4.793 . 0 0 "[ . 1 . 2]" 1
856 1 51 MET ME 1 64 TYR QD . . 5.320 4.730 3.792 5.798 0.478 7 0 "[ . 1 . 2]" 1
857 1 51 MET QG 1 52 ASP H . . 3.870 2.840 2.398 4.056 0.186 15 0 "[ . 1 . 2]" 1
858 1 51 MET QG 1 62 VAL QG . . 3.240 2.718 2.253 3.319 0.079 17 0 "[ . 1 . 2]" 1
859 1 51 MET QG 1 64 TYR HA . . 4.630 3.842 3.353 4.360 . 0 0 "[ . 1 . 2]" 1
860 1 51 MET QG 1 64 TYR QB . . 4.050 2.467 2.110 3.001 . 0 0 "[ . 1 . 2]" 1
861 1 52 ASP H 1 52 ASP HB2 . . 3.860 3.053 2.551 3.296 . 0 0 "[ . 1 . 2]" 1
862 1 52 ASP H 1 52 ASP QB . . 3.350 2.555 2.405 2.672 . 0 0 "[ . 1 . 2]" 1
863 1 52 ASP H 1 52 ASP HB3 . . 3.860 2.943 2.519 3.814 . 0 0 "[ . 1 . 2]" 1
864 1 52 ASP H 1 63 THR H . . 3.760 3.197 2.948 3.452 . 0 0 "[ . 1 . 2]" 1
865 1 52 ASP H 1 63 THR HB . . 4.410 3.731 3.289 4.035 . 0 0 "[ . 1 . 2]" 1
866 1 52 ASP H 1 64 TYR HA . . 4.280 3.496 3.294 3.720 . 0 0 "[ . 1 . 2]" 1
867 1 52 ASP HA 1 53 CYS H . . 3.170 2.242 2.147 2.394 . 0 0 "[ . 1 . 2]" 1
868 1 52 ASP HA 1 53 CYS QB . . 4.620 4.132 3.828 4.522 . 0 0 "[ . 1 . 2]" 1
869 1 52 ASP QB 1 63 THR H . . 4.410 3.643 3.220 4.135 . 0 0 "[ . 1 . 2]" 1
870 1 52 ASP QB 1 63 THR HB . . 3.680 2.832 2.276 3.531 . 0 0 "[ . 1 . 2]" 1
871 1 52 ASP HB2 1 63 THR HB . . 4.230 4.102 2.484 5.185 0.955 12 5 "[ . * 1*+ . * -]" 1
872 1 52 ASP HB3 1 63 THR HB . . 4.230 3.194 2.289 4.354 0.124 16 0 "[ . 1 . 2]" 1
873 1 53 CYS H 1 53 CYS HB2 . . 4.170 2.964 2.462 4.036 . 0 0 "[ . 1 . 2]" 1
874 1 53 CYS H 1 53 CYS QB . . 3.580 2.531 2.264 3.288 . 0 0 "[ . 1 . 2]" 1
875 1 53 CYS H 1 53 CYS HB3 . . 4.170 2.916 2.427 3.765 . 0 0 "[ . 1 . 2]" 1
876 1 53 CYS H 1 54 GLN H . . 4.940 4.496 4.374 4.601 . 0 0 "[ . 1 . 2]" 1
877 1 53 CYS HA 1 54 GLN H . . 2.960 2.246 2.139 2.376 . 0 0 "[ . 1 . 2]" 1
878 1 53 CYS HA 1 54 GLN QB . . 4.370 4.127 3.758 4.309 . 0 0 "[ . 1 . 2]" 1
879 1 53 CYS HA 1 62 VAL QG . . 3.770 2.913 2.233 3.487 . 0 0 "[ . 1 . 2]" 1
880 1 53 CYS HA 1 63 THR H . . 4.870 3.523 3.080 3.838 . 0 0 "[ . 1 . 2]" 1
881 1 53 CYS QB 1 54 GLN H . . 4.030 3.371 2.419 3.768 . 0 0 "[ . 1 . 2]" 1
882 1 53 CYS QB 1 62 VAL QG . . 4.290 2.650 2.147 3.342 . 0 0 "[ . 1 . 2]" 1
883 1 53 CYS HB2 1 54 GLN H . . 4.600 3.959 2.448 4.281 . 0 0 "[ . 1 . 2]" 1
884 1 53 CYS HB3 1 54 GLN H . . 4.600 3.786 2.827 4.181 . 0 0 "[ . 1 . 2]" 1
885 1 54 GLN H 1 54 GLN QB . . 3.540 2.814 2.579 3.302 . 0 0 "[ . 1 . 2]" 1
886 1 54 GLN H 1 54 GLN QG . . 4.390 3.425 2.523 4.308 . 0 0 "[ . 1 . 2]" 1
887 1 54 GLN H 1 61 ARG H . . 4.160 3.476 3.271 3.656 . 0 0 "[ . 1 . 2]" 1
888 1 54 GLN H 1 61 ARG QB . . 4.600 3.582 3.339 4.053 . 0 0 "[ . 1 . 2]" 1
889 1 54 GLN H 1 62 VAL HA . . 4.250 3.741 3.380 3.943 . 0 0 "[ . 1 . 2]" 1
890 1 54 GLN H 1 62 VAL QG . . 4.560 3.852 3.188 4.320 . 0 0 "[ . 1 . 2]" 1
891 1 54 GLN HA 1 54 GLN QG . . 3.990 2.721 2.354 3.361 . 0 0 "[ . 1 . 2]" 1
892 1 54 GLN HA 1 55 GLU H . . 2.980 2.301 2.156 2.618 . 0 0 "[ . 1 . 2]" 1
893 1 54 GLN HA 1 55 GLU QB . . 4.410 4.260 4.008 4.552 0.142 20 0 "[ . 1 . 2]" 1
894 1 54 GLN QB 1 55 GLU H . . 3.730 3.072 2.166 3.809 0.079 9 0 "[ . 1 . 2]" 1
895 1 54 GLN QB 1 61 ARG H . . 5.340 4.092 3.561 5.017 . 0 0 "[ . 1 . 2]" 1
896 1 55 GLU H 1 55 GLU QB . . 3.060 2.468 2.242 3.180 0.120 17 0 "[ . 1 . 2]" 1
897 1 55 GLU H 1 55 GLU HG2 . . 4.650 3.568 2.077 4.500 . 0 0 "[ . 1 . 2]" 1
898 1 55 GLU H 1 55 GLU QG . . 3.880 3.281 2.052 4.042 0.162 15 0 "[ . 1 . 2]" 1
899 1 55 GLU H 1 55 GLU HG3 . . 4.650 4.053 3.206 4.582 . 0 0 "[ . 1 . 2]" 1
900 1 55 GLU HA 1 55 GLU QG . . 3.610 2.861 2.396 3.518 . 0 0 "[ . 1 . 2]" 1
901 1 55 GLU HA 1 56 CYS H . . 2.990 2.206 2.110 2.283 . 0 0 "[ . 1 . 2]" 1
902 1 55 GLU HA 1 60 TYR HA . . 3.570 2.525 2.226 2.863 . 0 0 "[ . 1 . 2]" 1
903 1 55 GLU HA 1 60 TYR HB3 . . 5.500 4.475 4.006 4.862 . 0 0 "[ . 1 . 2]" 1
904 1 55 GLU HA 1 60 TYR QD . . 4.250 3.088 2.528 3.818 . 0 0 "[ . 1 . 2]" 1
905 1 55 GLU HA 1 61 ARG H . . 4.230 3.367 2.503 3.850 . 0 0 "[ . 1 . 2]" 1
906 1 55 GLU QB 1 56 CYS H . . 3.620 3.283 2.612 3.867 0.247 10 0 "[ . 1 . 2]" 1
907 1 55 GLU QB 1 56 CYS HA . . 4.930 4.496 4.323 4.723 . 0 0 "[ . 1 . 2]" 1
908 1 55 GLU QB 1 61 ARG H . . 5.500 5.115 4.038 5.603 0.103 18 0 "[ . 1 . 2]" 1
909 1 55 GLU QG 1 56 CYS HA . . 5.040 3.948 3.563 4.374 . 0 0 "[ . 1 . 2]" 1
910 1 55 GLU QG 1 60 TYR HA . . 5.340 4.666 3.736 5.568 0.228 4 0 "[ . 1 . 2]" 1
911 1 55 GLU HG2 1 56 CYS H . . 4.720 3.698 2.590 5.171 0.451 14 0 "[ . 1 . 2]" 1
912 1 55 GLU HG3 1 56 CYS H . . 4.720 3.697 2.794 5.198 0.478 12 0 "[ . 1 . 2]" 1
913 1 56 CYS H 1 59 GLY H . . 4.170 3.460 3.273 3.622 . 0 0 "[ . 1 . 2]" 1
914 1 56 CYS H 1 60 TYR HA . . 3.980 3.360 3.001 3.644 . 0 0 "[ . 1 . 2]" 1
915 1 56 CYS H 1 61 ARG H . . 4.900 3.863 3.233 4.420 . 0 0 "[ . 1 . 2]" 1
916 1 56 CYS HA 1 57 PRO HA . . 4.830 4.430 4.301 4.530 . 0 0 "[ . 1 . 2]" 1
917 1 56 CYS HA 1 57 PRO HD2 . . 3.640 3.020 2.575 3.239 . 0 0 "[ . 1 . 2]" 1
918 1 56 CYS HA 1 57 PRO QD . . 3.000 2.212 2.084 2.388 . 0 0 "[ . 1 . 2]" 1
919 1 56 CYS HA 1 57 PRO HD3 . . 3.640 2.316 2.127 2.725 . 0 0 "[ . 1 . 2]" 1
920 1 56 CYS HA 1 57 PRO HG2 . . 5.030 4.826 4.735 4.887 . 0 0 "[ . 1 . 2]" 1
921 1 56 CYS HA 1 57 PRO QG . . 4.420 4.102 3.995 4.332 . 0 0 "[ . 1 . 2]" 1
922 1 56 CYS HA 1 57 PRO HG3 . . 5.030 4.455 4.287 4.870 . 0 0 "[ . 1 . 2]" 1
923 1 56 CYS QB 1 57 PRO QD . . 2.970 2.087 1.945 2.253 . 0 0 "[ . 1 . 2]" 1
924 1 56 CYS QB 1 58 GLU H . . 4.320 3.013 2.516 3.393 . 0 0 "[ . 1 . 2]" 1
925 1 56 CYS HB2 1 57 PRO HD2 . . 4.710 2.715 1.968 3.912 . 0 0 "[ . 1 . 2]" 1
926 1 56 CYS HB2 1 57 PRO HD3 . . 4.710 3.444 2.637 4.769 0.059 6 0 "[ . 1 . 2]" 1
927 1 56 CYS HB3 1 57 PRO HD2 . . 4.710 3.231 2.000 3.931 . 0 0 "[ . 1 . 2]" 1
928 1 56 CYS HB3 1 57 PRO HD3 . . 4.710 3.759 3.012 4.566 . 0 0 "[ . 1 . 2]" 1
929 1 57 PRO QB 1 58 GLU H . . 4.100 3.058 2.817 3.540 . 0 0 "[ . 1 . 2]" 1
930 1 57 PRO QD 1 58 GLU H . . 4.200 2.892 2.788 3.061 . 0 0 "[ . 1 . 2]" 1
931 1 58 GLU H 1 58 GLU QB . . 3.380 2.195 2.131 2.263 . 0 0 "[ . 1 . 2]" 1
932 1 58 GLU H 1 58 GLU QG . . 4.300 4.009 3.665 4.077 . 0 0 "[ . 1 . 2]" 1
933 1 58 GLU H 1 59 GLY H . . 3.180 2.585 2.480 2.760 . 0 0 "[ . 1 . 2]" 1
934 1 58 GLU HA 1 58 GLU QG . . 3.300 2.623 2.326 2.937 . 0 0 "[ . 1 . 2]" 1
935 1 58 GLU QB 1 59 GLY H . . 3.920 3.295 3.085 3.434 . 0 0 "[ . 1 . 2]" 1
936 1 58 GLU QG 1 59 GLY H . . 4.490 4.462 4.035 4.939 0.449 11 0 "[ . 1 . 2]" 1
937 1 59 GLY H 1 60 TYR H . . 4.570 4.416 3.993 4.546 . 0 0 "[ . 1 . 2]" 1
938 1 59 GLY QA 1 60 TYR H . . 3.010 2.202 2.116 2.313 . 0 0 "[ . 1 . 2]" 1
939 1 59 GLY QA 1 60 TYR QD . . 4.830 3.945 3.472 4.314 . 0 0 "[ . 1 . 2]" 1
940 1 60 TYR H 1 60 TYR HB2 . . 3.830 2.445 2.337 2.606 . 0 0 "[ . 1 . 2]" 1
941 1 60 TYR H 1 60 TYR QD . . 4.150 2.870 2.414 3.237 . 0 0 "[ . 1 . 2]" 1
942 1 60 TYR H 1 61 ARG H . . 4.870 4.351 4.152 4.517 . 0 0 "[ . 1 . 2]" 1
943 1 60 TYR HA 1 60 TYR QD . . 3.900 2.729 2.493 3.028 . 0 0 "[ . 1 . 2]" 1
944 1 60 TYR HA 1 61 ARG H . . 2.930 2.176 2.128 2.238 . 0 0 "[ . 1 . 2]" 1
945 1 60 TYR HA 1 61 ARG QB . . 4.360 4.124 4.017 4.225 . 0 0 "[ . 1 . 2]" 1
946 1 60 TYR HB2 1 61 ARG H . . 4.640 4.418 4.336 4.497 . 0 0 "[ . 1 . 2]" 1
947 1 60 TYR HB2 1 62 VAL QG . . 4.850 4.212 3.908 4.476 . 0 0 "[ . 1 . 2]" 1
948 1 60 TYR HB3 1 61 ARG H . . 3.880 3.646 3.482 3.820 . 0 0 "[ . 1 . 2]" 1
949 1 60 TYR HB3 1 62 VAL QG . . 4.030 3.635 3.395 4.036 0.006 11 0 "[ . 1 . 2]" 1
950 1 61 ARG H 1 61 ARG QB . . 3.430 2.299 2.236 2.397 . 0 0 "[ . 1 . 2]" 1
951 1 61 ARG H 1 61 ARG HG2 . . 4.870 4.492 4.382 4.600 . 0 0 "[ . 1 . 2]" 1
952 1 61 ARG H 1 61 ARG QG . . 4.270 3.999 3.938 4.053 . 0 0 "[ . 1 . 2]" 1
953 1 61 ARG H 1 61 ARG HG3 . . 4.870 4.488 4.360 4.576 . 0 0 "[ . 1 . 2]" 1
954 1 61 ARG H 1 62 VAL QG . . 4.740 4.523 4.241 4.879 0.139 11 0 "[ . 1 . 2]" 1
955 1 61 ARG QB 1 61 ARG HD2 . . 3.770 2.752 2.134 3.342 . 0 0 "[ . 1 . 2]" 1
956 1 61 ARG QB 1 61 ARG HD3 . . 3.770 2.681 2.259 3.346 . 0 0 "[ . 1 . 2]" 1
957 1 61 ARG QB 1 62 VAL H . . 4.210 3.683 3.551 3.850 . 0 0 "[ . 1 . 2]" 1
958 1 61 ARG QG 1 62 VAL QG . . 4.760 4.205 3.854 4.396 . 0 0 "[ . 1 . 2]" 1
959 1 61 ARG HG2 1 62 VAL H . . 4.340 2.954 2.488 3.606 . 0 0 "[ . 1 . 2]" 1
960 1 61 ARG HG3 1 62 VAL H . . 4.340 3.078 2.739 3.661 . 0 0 "[ . 1 . 2]" 1
961 1 62 VAL H 1 62 VAL HB . . 4.010 2.870 2.457 3.935 . 0 0 "[ . 1 . 2]" 1
962 1 62 VAL H 1 62 VAL QG . . 3.240 2.656 2.200 2.860 . 0 0 "[ . 1 . 2]" 1
963 1 62 VAL H 1 63 THR H . . 4.610 4.327 4.093 4.468 . 0 0 "[ . 1 . 2]" 1
964 1 62 VAL HA 1 63 THR H . . 3.090 2.164 2.131 2.237 . 0 0 "[ . 1 . 2]" 1
965 1 62 VAL QG 1 63 THR H . . 3.390 2.882 2.548 3.391 0.001 18 0 "[ . 1 . 2]" 1
966 1 62 VAL QG 1 63 THR HA . . 4.370 3.535 3.303 3.984 . 0 0 "[ . 1 . 2]" 1
967 1 62 VAL QG 1 64 TYR H . . 4.750 4.142 3.821 4.963 0.213 7 0 "[ . 1 . 2]" 1
968 1 62 VAL QG 1 64 TYR QB . . 4.290 3.249 2.704 4.423 0.133 7 0 "[ . 1 . 2]" 1
969 1 62 VAL QG 1 64 TYR QD . . 3.890 2.874 2.582 3.561 . 0 0 "[ . 1 . 2]" 1
970 1 63 THR H 1 63 THR HB . . 3.740 2.665 2.454 2.800 . 0 0 "[ . 1 . 2]" 1
971 1 63 THR H 1 63 THR MG . . 4.130 3.905 3.820 3.963 . 0 0 "[ . 1 . 2]" 1
972 1 63 THR H 1 64 TYR H . . 4.710 4.402 4.320 4.544 . 0 0 "[ . 1 . 2]" 1
973 1 63 THR H 1 64 TYR QB . . 5.500 4.604 4.355 4.935 . 0 0 "[ . 1 . 2]" 1
974 1 63 THR HA 1 63 THR MG . . 3.230 2.403 2.341 2.467 . 0 0 "[ . 1 . 2]" 1
975 1 63 THR HA 1 64 TYR H . . 2.860 2.213 2.179 2.243 . 0 0 "[ . 1 . 2]" 1
976 1 63 THR HB 1 64 TYR H . . 4.320 4.083 4.005 4.145 . 0 0 "[ . 1 . 2]" 1
977 1 63 THR MG 1 64 TYR H . . 3.630 2.575 2.449 2.787 . 0 0 "[ . 1 . 2]" 1
978 1 64 TYR H 1 64 TYR QD . . 3.890 2.887 2.742 3.047 . 0 0 "[ . 1 . 2]" 1
979 1 64 TYR HA 1 64 TYR QD . . 4.410 3.743 3.728 3.757 . 0 0 "[ . 1 . 2]" 1
980 1 64 TYR HA 1 65 THR H . . 3.250 2.261 2.204 2.368 . 0 0 "[ . 1 . 2]" 1
981 1 64 TYR HA 1 65 THR HB . . 4.910 4.614 4.495 4.758 . 0 0 "[ . 1 . 2]" 1
982 1 64 TYR QB 1 65 THR H . . 3.630 2.769 2.628 2.961 . 0 0 "[ . 1 . 2]" 1
983 1 64 TYR QD 1 65 THR H . . 4.900 3.480 3.221 3.723 . 0 0 "[ . 1 . 2]" 1
984 1 64 TYR QD 1 66 PRO HB2 . . 5.500 5.068 4.813 5.331 . 0 0 "[ . 1 . 2]" 1
985 1 64 TYR QD 1 66 PRO HB3 . . 4.720 3.530 3.244 3.903 . 0 0 "[ . 1 . 2]" 1
986 1 64 TYR QD 1 66 PRO HD2 . . 4.410 4.396 4.232 4.554 0.144 15 0 "[ . 1 . 2]" 1
987 1 64 TYR QD 1 66 PRO HD3 . . 4.170 2.923 2.713 3.135 . 0 0 "[ . 1 . 2]" 1
988 1 64 TYR QD 1 66 PRO HG3 . . 4.830 4.398 4.107 4.746 . 0 0 "[ . 1 . 2]" 1
989 1 64 TYR QE 1 66 PRO HB2 . . 5.160 4.160 4.007 4.379 . 0 0 "[ . 1 . 2]" 1
990 1 64 TYR QE 1 66 PRO HB3 . . 4.510 2.507 2.311 2.736 . 0 0 "[ . 1 . 2]" 1
991 1 64 TYR QE 1 66 PRO HD2 . . 4.970 4.524 4.299 4.752 . 0 0 "[ . 1 . 2]" 1
992 1 64 TYR QE 1 66 PRO HD3 . . 4.710 2.954 2.764 3.154 . 0 0 "[ . 1 . 2]" 1
993 1 64 TYR QE 1 66 PRO HG2 . . 5.110 4.521 4.216 4.791 . 0 0 "[ . 1 . 2]" 1
994 1 64 TYR QE 1 66 PRO HG3 . . 4.340 3.060 2.674 3.443 . 0 0 "[ . 1 . 2]" 1
995 1 64 TYR QE 1 74 ILE MD . . 3.810 2.599 2.414 2.980 . 0 0 "[ . 1 . 2]" 1
996 1 64 TYR QE 1 93 VAL QG . . 3.890 3.288 2.880 3.645 . 0 0 "[ . 1 . 2]" 1
997 1 65 THR H 1 65 THR HB . . 3.580 2.579 2.464 2.664 . 0 0 "[ . 1 . 2]" 1
998 1 65 THR HA 1 65 THR MG . . 3.110 2.411 2.340 2.486 . 0 0 "[ . 1 . 2]" 1
999 1 65 THR HA 1 66 PRO HD2 . . 3.310 2.156 2.013 2.214 . 0 0 "[ . 1 . 2]" 1
1000 1 65 THR HA 1 66 PRO HD3 . . 3.460 2.453 2.334 2.705 . 0 0 "[ . 1 . 2]" 1
1001 1 65 THR HA 1 66 PRO HG2 . . 4.450 4.381 4.235 4.431 . 0 0 "[ . 1 . 2]" 1
1002 1 65 THR HA 1 66 PRO HG3 . . 4.660 4.510 4.450 4.567 . 0 0 "[ . 1 . 2]" 1
1003 1 65 THR HB 1 66 PRO HD3 . . 5.500 5.107 5.036 5.247 . 0 0 "[ . 1 . 2]" 1
1004 1 65 THR MG 1 66 PRO HD2 . . 3.630 2.856 2.720 3.073 . 0 0 "[ . 1 . 2]" 1
1005 1 65 THR MG 1 66 PRO HG2 . . 4.610 4.240 4.161 4.362 . 0 0 "[ . 1 . 2]" 1
1006 1 66 PRO HA 1 67 MET H . . 3.470 2.334 2.156 2.465 . 0 0 "[ . 1 . 2]" 1
1007 1 66 PRO HA 1 67 MET QG . . 4.510 3.789 3.560 4.155 . 0 0 "[ . 1 . 2]" 1
1008 1 66 PRO HA 1 68 ALA H . . 4.130 4.061 3.747 4.243 0.113 6 0 "[ . 1 . 2]" 1
1009 1 66 PRO HB2 1 68 ALA H . . 4.010 3.105 2.813 3.577 . 0 0 "[ . 1 . 2]" 1
1010 1 66 PRO HB2 1 72 TYR QE . . 4.950 2.695 2.416 3.266 . 0 0 "[ . 1 . 2]" 1
1011 1 66 PRO HB2 1 93 VAL QG . . 3.370 2.243 2.092 2.485 . 0 0 "[ . 1 . 2]" 1
1012 1 66 PRO HB3 1 68 ALA H . . 5.110 4.514 4.278 4.727 . 0 0 "[ . 1 . 2]" 1
1013 1 66 PRO HB3 1 72 TYR QE . . 4.980 3.168 2.816 3.541 . 0 0 "[ . 1 . 2]" 1
1014 1 66 PRO HB3 1 93 VAL QG . . 3.500 2.692 2.460 3.098 . 0 0 "[ . 1 . 2]" 1
1015 1 66 PRO HD3 1 93 VAL QG . . 5.190 3.877 3.700 4.133 . 0 0 "[ . 1 . 2]" 1
1016 1 66 PRO HG2 1 93 VAL QG . . 3.770 2.568 2.300 3.112 . 0 0 "[ . 1 . 2]" 1
1017 1 66 PRO HG3 1 93 VAL QG . . 3.500 2.186 2.085 2.386 . 0 0 "[ . 1 . 2]" 1
1018 1 67 MET H 1 67 MET QB . . 3.670 2.945 2.631 3.157 . 0 0 "[ . 1 . 2]" 1
1019 1 67 MET H 1 67 MET QG . . 4.530 2.279 1.942 2.541 . 0 0 "[ . 1 . 2]" 1
1020 1 67 MET H 1 68 ALA H . . 3.250 2.134 1.837 2.573 . 0 0 "[ . 1 . 2]" 1
1021 1 67 MET H 1 68 ALA MB . . 5.260 3.896 3.732 4.244 . 0 0 "[ . 1 . 2]" 1
1022 1 67 MET H 1 72 TYR QE . . 5.000 3.777 3.222 4.525 . 0 0 "[ . 1 . 2]" 1
1023 1 67 MET QB 1 67 MET ME . . 3.710 2.284 2.030 3.596 . 0 0 "[ . 1 . 2]" 1
1024 1 67 MET QB 1 68 ALA H . . 3.900 3.924 3.809 3.993 0.093 4 0 "[ . 1 . 2]" 1
1025 1 67 MET QB 1 99 VAL QG . . 5.060 3.675 2.573 4.459 . 0 0 "[ . 1 . 2]" 1
1026 1 67 MET HB2 1 68 ALA H . . 4.530 4.383 4.263 4.494 . 0 0 "[ . 1 . 2]" 1
1027 1 67 MET HB3 1 68 ALA H . . 4.530 4.428 4.288 4.484 . 0 0 "[ . 1 . 2]" 1
1028 1 67 MET ME 1 68 ALA HA . . 5.140 5.523 4.912 6.029 0.889 4 8 "[* *+* *- ** . 2]" 1
1029 1 67 MET ME 1 99 VAL QG . . 3.310 2.137 1.875 2.889 . 0 0 "[ . 1 . 2]" 1
1030 1 67 MET QG 1 68 ALA HA . . 4.310 4.358 3.738 4.468 0.158 16 0 "[ . 1 . 2]" 1
1031 1 67 MET QG 1 99 VAL QG . . 4.540 3.147 2.359 3.960 . 0 0 "[ . 1 . 2]" 1
1032 1 68 ALA H 1 68 ALA MB . . 3.380 2.626 2.356 2.699 . 0 0 "[ . 1 . 2]" 1
1033 1 68 ALA H 1 72 TYR QE . . 4.850 3.489 2.833 4.105 . 0 0 "[ . 1 . 2]" 1
1034 1 68 ALA HA 1 69 PRO QD . . 3.180 2.136 2.103 2.166 . 0 0 "[ . 1 . 2]" 1
1035 1 68 ALA HA 1 69 PRO QG . . 4.560 4.081 4.048 4.117 . 0 0 "[ . 1 . 2]" 1
1036 1 68 ALA HA 1 97 ARG HA . . 3.350 2.406 2.269 2.807 . 0 0 "[ . 1 . 2]" 1
1037 1 68 ALA HA 1 97 ARG QB . . 4.540 3.524 2.674 3.918 . 0 0 "[ . 1 . 2]" 1
1038 1 68 ALA MB 1 69 PRO HD2 . . 3.880 2.437 2.325 2.559 . 0 0 "[ . 1 . 2]" 1
1039 1 68 ALA MB 1 69 PRO QD . . 3.220 2.397 2.293 2.512 . 0 0 "[ . 1 . 2]" 1
1040 1 68 ALA MB 1 69 PRO HD3 . . 3.880 3.563 3.463 3.653 . 0 0 "[ . 1 . 2]" 1
1041 1 68 ALA MB 1 69 PRO QG . . 4.480 3.878 3.768 3.981 . 0 0 "[ . 1 . 2]" 1
1042 1 68 ALA MB 1 97 ARG HA . . 4.120 3.631 3.404 4.101 . 0 0 "[ . 1 . 2]" 1
1043 1 68 ALA MB 1 97 ARG HB2 . . 5.130 3.910 3.079 4.140 . 0 0 "[ . 1 . 2]" 1
1044 1 68 ALA MB 1 97 ARG QB . . 4.390 3.733 2.836 3.938 . 0 0 "[ . 1 . 2]" 1
1045 1 68 ALA MB 1 97 ARG HB3 . . 5.130 4.740 3.320 4.968 . 0 0 "[ . 1 . 2]" 1
1046 1 68 ALA MB 1 97 ARG QD . . 4.030 3.270 2.956 3.844 . 0 0 "[ . 1 . 2]" 1
1047 1 69 PRO HA 1 70 GLY H . . 3.020 2.296 2.227 2.380 . 0 0 "[ . 1 . 2]" 1
1048 1 69 PRO HA 1 72 TYR QE . . 4.960 4.177 3.741 4.776 . 0 0 "[ . 1 . 2]" 1
1049 1 69 PRO HA 1 93 VAL QG . . 3.190 2.364 2.077 2.640 . 0 0 "[ . 1 . 2]" 1
1050 1 69 PRO QB 1 70 GLY H . . 3.450 2.799 2.570 2.981 . 0 0 "[ . 1 . 2]" 1
1051 1 69 PRO QB 1 94 THR HA . . 4.200 2.497 2.338 2.696 . 0 0 "[ . 1 . 2]" 1
1052 1 69 PRO QB 1 95 GLY H . . 4.070 3.283 2.977 3.792 . 0 0 "[ . 1 . 2]" 1
1053 1 69 PRO HB2 1 70 GLY H . . 4.230 2.906 2.639 3.124 . 0 0 "[ . 1 . 2]" 1
1054 1 69 PRO HB2 1 95 GLY H . . 4.820 4.572 4.247 5.112 0.292 6 0 "[ . 1 . 2]" 1
1055 1 69 PRO HB3 1 70 GLY H . . 4.230 3.661 3.539 3.766 . 0 0 "[ . 1 . 2]" 1
1056 1 69 PRO HB3 1 95 GLY H . . 4.820 3.366 3.037 3.908 . 0 0 "[ . 1 . 2]" 1
1057 1 69 PRO QD 1 97 ARG HA . . 3.370 2.591 2.284 3.127 . 0 0 "[ . 1 . 2]" 1
1058 1 69 PRO QD 1 97 ARG QB . . 3.700 2.412 2.138 2.836 . 0 0 "[ . 1 . 2]" 1
1059 1 69 PRO QD 1 97 ARG QG . . 4.760 2.680 2.209 3.840 . 0 0 "[ . 1 . 2]" 1
1060 1 69 PRO QD 1 98 LEU H . . 5.290 4.483 3.983 5.191 . 0 0 "[ . 1 . 2]" 1
1061 1 69 PRO HD2 1 97 ARG HA . . 3.860 3.264 2.745 3.930 0.070 3 0 "[ . 1 . 2]" 1
1062 1 69 PRO HD3 1 97 ARG HA . . 3.860 2.722 2.442 3.283 . 0 0 "[ . 1 . 2]" 1
1063 1 70 GLY H 1 72 TYR QE . . 5.290 4.707 3.985 5.586 0.296 14 0 "[ . 1 . 2]" 1
1064 1 70 GLY H 1 93 VAL H . . 4.130 3.251 3.056 3.631 . 0 0 "[ . 1 . 2]" 1
1065 1 70 GLY H 1 93 VAL HB . . 3.990 3.726 3.088 5.008 1.018 9 6 "[ .* +1 * *. *-2]" 1
1066 1 70 GLY H 1 93 VAL QG . . 3.770 3.290 2.452 3.808 0.038 4 0 "[ . 1 . 2]" 1
1067 1 70 GLY QA 1 71 SER H . . 2.970 2.221 2.156 2.280 . 0 0 "[ . 1 . 2]" 1
1068 1 70 GLY QA 1 71 SER HA . . 4.550 3.996 3.964 4.020 . 0 0 "[ . 1 . 2]" 1
1069 1 70 GLY QA 1 71 SER QB . . 4.610 4.147 3.746 4.247 . 0 0 "[ . 1 . 2]" 1
1070 1 70 GLY QA 1 72 TYR QE . . 5.340 4.834 4.182 5.568 0.228 14 0 "[ . 1 . 2]" 1
1071 1 70 GLY HA2 1 71 SER H . . 3.410 2.836 2.588 3.073 . 0 0 "[ . 1 . 2]" 1
1072 1 70 GLY HA3 1 71 SER H . . 3.410 2.336 2.202 2.513 . 0 0 "[ . 1 . 2]" 1
1073 1 71 SER H 1 71 SER QB . . 3.140 2.613 2.417 3.213 0.073 1 0 "[ . 1 . 2]" 1
1074 1 71 SER H 1 72 TYR H . . 4.720 4.382 4.245 4.520 . 0 0 "[ . 1 . 2]" 1
1075 1 71 SER HA 1 72 TYR H . . 2.970 2.159 2.115 2.218 . 0 0 "[ . 1 . 2]" 1
1076 1 71 SER HA 1 72 TYR HB2 . . 4.750 4.456 4.378 4.530 . 0 0 "[ . 1 . 2]" 1
1077 1 71 SER HA 1 72 TYR QD . . 4.240 3.720 2.999 4.296 0.056 14 0 "[ . 1 . 2]" 1
1078 1 71 SER HA 1 91 ALA MB . . 4.820 4.736 4.541 5.093 0.273 13 0 "[ . 1 . 2]" 1
1079 1 71 SER HA 1 92 LYS HA . . 3.490 2.377 2.220 2.548 . 0 0 "[ . 1 . 2]" 1
1080 1 71 SER HA 1 92 LYS QB . . 4.720 4.224 3.756 4.557 . 0 0 "[ . 1 . 2]" 1
1081 1 71 SER HA 1 92 LYS QG . . 5.070 3.293 2.564 3.849 . 0 0 "[ . 1 . 2]" 1
1082 1 71 SER HA 1 93 VAL H . . 4.290 3.266 3.050 3.568 . 0 0 "[ . 1 . 2]" 1
1083 1 71 SER HA 1 93 VAL QG . . 4.500 3.945 2.997 4.392 . 0 0 "[ . 1 . 2]" 1
1084 1 71 SER QB 1 72 TYR H . . 3.860 3.322 2.865 3.678 . 0 0 "[ . 1 . 2]" 1
1085 1 71 SER QB 1 90 LYS QB . . 3.910 3.365 2.934 4.329 0.419 2 0 "[ . 1 . 2]" 1
1086 1 71 SER QB 1 90 LYS QG . . 4.380 4.203 2.203 5.013 0.633 11 2 "[ . 1+ . -]" 1
1087 1 71 SER QB 1 92 LYS QG . . 4.120 3.085 2.363 3.671 . 0 0 "[ . 1 . 2]" 1
1088 1 71 SER QB 1 93 VAL QG . . 5.360 5.264 4.520 5.679 0.319 15 0 "[ . 1 . 2]" 1
1089 1 72 TYR H 1 72 TYR HB2 . . 3.620 2.368 2.285 2.486 . 0 0 "[ . 1 . 2]" 1
1090 1 72 TYR H 1 72 TYR HB3 . . 4.080 3.611 3.566 3.683 . 0 0 "[ . 1 . 2]" 1
1091 1 72 TYR H 1 72 TYR QD . . 3.830 2.566 2.369 3.093 . 0 0 "[ . 1 . 2]" 1
1092 1 72 TYR H 1 72 TYR QE . . 5.500 4.774 4.534 5.142 . 0 0 "[ . 1 . 2]" 1
1093 1 72 TYR H 1 73 LEU H . . 4.580 4.470 4.385 4.626 0.046 11 0 "[ . 1 . 2]" 1
1094 1 72 TYR H 1 74 ILE MD . . 5.500 5.676 5.521 5.934 0.434 8 0 "[ . 1 . 2]" 1
1095 1 72 TYR H 1 91 ALA MB . . 4.390 3.371 3.104 3.764 . 0 0 "[ . 1 . 2]" 1
1096 1 72 TYR H 1 92 LYS QB . . 5.500 5.434 5.046 5.760 0.260 18 0 "[ . 1 . 2]" 1
1097 1 72 TYR H 1 93 VAL QG . . 4.800 3.519 3.098 3.839 . 0 0 "[ . 1 . 2]" 1
1098 1 72 TYR HA 1 72 TYR QD . . 4.040 3.031 2.673 3.203 . 0 0 "[ . 1 . 2]" 1
1099 1 72 TYR HA 1 73 LEU H . . 2.900 2.176 2.136 2.298 . 0 0 "[ . 1 . 2]" 1
1100 1 72 TYR HA 1 73 LEU QB . . 4.840 4.046 3.932 4.333 . 0 0 "[ . 1 . 2]" 1
1101 1 72 TYR HB2 1 73 LEU H . . 4.650 4.306 3.947 4.450 . 0 0 "[ . 1 . 2]" 1
1102 1 72 TYR HB2 1 91 ALA HA . . 5.500 5.244 5.114 5.393 . 0 0 "[ . 1 . 2]" 1
1103 1 72 TYR HB2 1 91 ALA MB . . 3.260 2.564 2.364 2.909 . 0 0 "[ . 1 . 2]" 1
1104 1 72 TYR HB3 1 73 LEU H . . 3.990 3.357 2.789 3.620 . 0 0 "[ . 1 . 2]" 1
1105 1 72 TYR HB3 1 91 ALA MB . . 3.940 3.627 3.449 3.892 . 0 0 "[ . 1 . 2]" 1
1106 1 72 TYR QD 1 93 VAL H . . 4.460 3.925 3.169 4.773 0.313 19 0 "[ . 1 . 2]" 1
1107 1 72 TYR QD 1 93 VAL HB . . 4.940 3.419 2.566 5.004 0.064 12 0 "[ . 1 . 2]" 1
1108 1 72 TYR QD 1 93 VAL QG . . 3.520 2.246 2.064 2.378 . 0 0 "[ . 1 . 2]" 1
1109 1 72 TYR QE 1 93 VAL H . . 5.400 4.803 3.953 5.860 0.460 19 0 "[ . 1 . 2]" 1
1110 1 72 TYR QE 1 93 VAL HB . . 4.270 3.080 2.215 4.780 0.510 9 1 "[ . +1 . 2]" 1
1111 1 72 TYR QE 1 93 VAL QG . . 3.410 2.302 2.079 2.547 . 0 0 "[ . 1 . 2]" 1
1112 1 73 LEU H 1 73 LEU QB . . 3.160 2.312 2.194 2.485 . 0 0 "[ . 1 . 2]" 1
1113 1 73 LEU H 1 73 LEU MD1 . . 5.190 3.965 2.698 4.346 . 0 0 "[ . 1 . 2]" 1
1114 1 73 LEU H 1 73 LEU QD . . 4.470 3.621 2.661 3.939 . 0 0 "[ . 1 . 2]" 1
1115 1 73 LEU H 1 73 LEU MD2 . . 5.190 4.284 3.817 4.506 . 0 0 "[ . 1 . 2]" 1
1116 1 73 LEU H 1 74 ILE H . . 4.780 4.327 4.229 4.456 . 0 0 "[ . 1 . 2]" 1
1117 1 73 LEU HA 1 73 LEU QD . . 3.430 2.081 1.993 2.432 . 0 0 "[ . 1 . 2]" 1
1118 1 73 LEU HA 1 74 ILE H . . 2.860 2.106 2.090 2.117 . 0 0 "[ . 1 . 2]" 1
1119 1 73 LEU HA 1 74 ILE HB . . 4.760 4.595 4.472 4.694 . 0 0 "[ . 1 . 2]" 1
1120 1 73 LEU HA 1 74 ILE QG . . 5.340 3.572 3.374 3.711 . 0 0 "[ . 1 . 2]" 1
1121 1 73 LEU HA 1 90 LYS HA . . 4.080 2.596 2.407 2.764 . 0 0 "[ . 1 . 2]" 1
1122 1 73 LEU HA 1 91 ALA H . . 4.900 3.938 3.373 4.542 . 0 0 "[ . 1 . 2]" 1
1123 1 73 LEU QB 1 74 ILE H . . 4.240 3.799 3.304 3.933 . 0 0 "[ . 1 . 2]" 1
1124 1 73 LEU QB 1 90 LYS HA . . 5.500 4.093 3.677 4.675 . 0 0 "[ . 1 . 2]" 1
1125 1 73 LEU QD 1 74 ILE H . . 4.040 3.091 2.624 4.069 0.029 5 0 "[ . 1 . 2]" 1
1126 1 73 LEU QD 1 88 PRO HA . . 5.020 4.341 4.164 5.056 0.036 8 0 "[ . 1 . 2]" 1
1127 1 73 LEU QD 1 88 PRO HB2 . . 3.520 2.324 2.158 2.988 . 0 0 "[ . 1 . 2]" 1
1128 1 73 LEU QD 1 88 PRO HB3 . . 4.000 3.380 3.238 3.635 . 0 0 "[ . 1 . 2]" 1
1129 1 73 LEU QD 1 88 PRO QD . . 4.190 3.896 3.755 4.219 0.029 7 0 "[ . 1 . 2]" 1
1130 1 73 LEU QD 1 88 PRO QG . . 3.750 2.240 2.072 2.527 . 0 0 "[ . 1 . 2]" 1
1131 1 73 LEU QD 1 90 LYS HA . . 3.750 2.551 2.290 2.826 . 0 0 "[ . 1 . 2]" 1
1132 1 73 LEU QD 1 90 LYS QB . . 4.150 2.683 2.278 3.090 . 0 0 "[ . 1 . 2]" 1
1133 1 73 LEU MD1 1 88 PRO HB3 . . 4.620 3.908 3.508 5.612 0.992 7 3 "[ - +* 1 . 2]" 1
1134 1 73 LEU MD1 1 88 PRO QG . . 4.280 2.634 2.131 4.489 0.209 7 0 "[ . 1 . 2]" 1
1135 1 73 LEU MD2 1 88 PRO HB3 . . 4.620 3.909 3.537 4.074 . 0 0 "[ . 1 . 2]" 1
1136 1 73 LEU MD2 1 88 PRO QG . . 4.280 2.773 2.416 2.933 . 0 0 "[ . 1 . 2]" 1
1137 1 73 LEU HG 1 74 ILE H . . 4.890 3.654 3.291 4.963 0.073 1 0 "[ . 1 . 2]" 1
1138 1 73 LEU HG 1 89 PHE H . . 5.500 4.851 4.456 6.908 1.408 1 1 "[+ . 1 . 2]" 1
1139 1 74 ILE H 1 74 ILE HB . . 3.570 2.538 2.480 2.614 . 0 0 "[ . 1 . 2]" 1
1140 1 74 ILE H 1 74 ILE MD . . 4.250 3.795 3.663 3.898 . 0 0 "[ . 1 . 2]" 1
1141 1 74 ILE H 1 74 ILE HG12 . . 4.310 3.567 3.400 3.730 . 0 0 "[ . 1 . 2]" 1
1142 1 74 ILE H 1 74 ILE QG . . 3.580 2.356 2.200 2.493 . 0 0 "[ . 1 . 2]" 1
1143 1 74 ILE H 1 74 ILE HG13 . . 4.310 2.391 2.228 2.536 . 0 0 "[ . 1 . 2]" 1
1144 1 74 ILE H 1 74 ILE MG . . 4.420 3.825 3.805 3.849 . 0 0 "[ . 1 . 2]" 1
1145 1 74 ILE H 1 75 SER H . . 4.640 4.164 4.040 4.340 . 0 0 "[ . 1 . 2]" 1
1146 1 74 ILE H 1 88 PRO HA . . 4.780 4.746 4.205 4.993 0.213 6 0 "[ . 1 . 2]" 1
1147 1 74 ILE H 1 88 PRO HB2 . . 4.820 3.649 3.338 3.850 . 0 0 "[ . 1 . 2]" 1
1148 1 74 ILE H 1 88 PRO HB3 . . 4.850 4.782 4.317 5.038 0.188 6 0 "[ . 1 . 2]" 1
1149 1 74 ILE H 1 88 PRO QG . . 5.350 5.330 5.035 5.503 0.153 3 0 "[ . 1 . 2]" 1
1150 1 74 ILE H 1 89 PHE H . . 3.900 3.140 2.895 3.359 . 0 0 "[ . 1 . 2]" 1
1151 1 74 ILE H 1 89 PHE HB2 . . 4.400 3.724 3.582 3.909 . 0 0 "[ . 1 . 2]" 1
1152 1 74 ILE H 1 89 PHE HB3 . . 5.040 4.736 4.595 4.858 . 0 0 "[ . 1 . 2]" 1
1153 1 74 ILE H 1 91 ALA H . . 5.040 4.065 3.724 4.364 . 0 0 "[ . 1 . 2]" 1
1154 1 74 ILE HA 1 76 ILE QG . . 4.750 4.427 4.321 4.560 . 0 0 "[ . 1 . 2]" 1
1155 1 74 ILE HB 1 74 ILE MD . . 3.350 2.466 2.412 2.521 . 0 0 "[ . 1 . 2]" 1
1156 1 74 ILE HB 1 89 PHE H . . 4.070 2.932 2.790 3.107 . 0 0 "[ . 1 . 2]" 1
1157 1 74 ILE HB 1 89 PHE HB2 . . 3.580 2.364 2.232 2.454 . 0 0 "[ . 1 . 2]" 1
1158 1 74 ILE HB 1 89 PHE HB3 . . 4.100 3.899 3.766 4.048 . 0 0 "[ . 1 . 2]" 1
1159 1 74 ILE HB 1 89 PHE QD . . 4.020 3.571 3.315 3.827 . 0 0 "[ . 1 . 2]" 1
1160 1 74 ILE MD 1 89 PHE HB2 . . 3.830 3.171 2.795 3.558 . 0 0 "[ . 1 . 2]" 1
1161 1 74 ILE MD 1 89 PHE HB3 . . 4.350 3.766 3.366 4.066 . 0 0 "[ . 1 . 2]" 1
1162 1 74 ILE MD 1 91 ALA MB . . 2.820 2.296 2.174 2.427 . 0 0 "[ . 1 . 2]" 1
1163 1 74 ILE QG 1 75 SER H . . 5.180 4.413 4.338 4.474 . 0 0 "[ . 1 . 2]" 1
1164 1 74 ILE QG 1 89 PHE H . . 5.340 4.513 4.359 4.690 . 0 0 "[ . 1 . 2]" 1
1165 1 74 ILE QG 1 89 PHE HB2 . . 4.530 3.891 3.671 4.086 . 0 0 "[ . 1 . 2]" 1
1166 1 74 ILE QG 1 89 PHE HB3 . . 5.340 4.733 4.524 4.925 . 0 0 "[ . 1 . 2]" 1
1167 1 74 ILE QG 1 91 ALA MB . . 4.710 2.841 2.596 3.025 . 0 0 "[ . 1 . 2]" 1
1168 1 74 ILE HG12 1 89 PHE HB2 . . 5.270 5.107 4.886 5.288 0.018 7 0 "[ . 1 . 2]" 1
1169 1 74 ILE HG13 1 89 PHE HB2 . . 5.270 4.036 3.785 4.272 . 0 0 "[ . 1 . 2]" 1
1170 1 74 ILE MG 1 75 SER H . . 3.850 3.345 3.174 3.488 . 0 0 "[ . 1 . 2]" 1
1171 1 74 ILE MG 1 75 SER HA . . 4.840 4.253 4.025 4.460 . 0 0 "[ . 1 . 2]" 1
1172 1 74 ILE MG 1 76 ILE HG12 . . 4.060 2.447 2.254 2.916 . 0 0 "[ . 1 . 2]" 1
1173 1 74 ILE MG 1 76 ILE QG . . 3.240 1.993 1.842 2.171 . 0 0 "[ . 1 . 2]" 1
1174 1 74 ILE MG 1 76 ILE HG13 . . 4.060 2.121 1.943 2.296 . 0 0 "[ . 1 . 2]" 1
1175 1 74 ILE MG 1 89 PHE H . . 4.930 3.938 3.783 4.039 . 0 0 "[ . 1 . 2]" 1
1176 1 74 ILE MG 1 89 PHE QD . . 4.120 3.685 3.454 3.884 . 0 0 "[ . 1 . 2]" 1
1177 1 75 SER H 1 75 SER HB2 . . 3.940 2.411 2.379 2.671 . 0 0 "[ . 1 . 2]" 1
1178 1 75 SER H 1 75 SER QB . . 3.240 2.360 2.261 2.399 . 0 0 "[ . 1 . 2]" 1
1179 1 75 SER H 1 75 SER HB3 . . 3.940 3.549 2.440 3.647 . 0 0 "[ . 1 . 2]" 1
1180 1 75 SER H 1 76 ILE H . . 4.960 4.179 3.899 4.536 . 0 0 "[ . 1 . 2]" 1
1181 1 75 SER HA 1 76 ILE H . . 3.230 2.239 2.174 2.377 . 0 0 "[ . 1 . 2]" 1
1182 1 75 SER HA 1 76 ILE QG . . 4.790 3.841 3.499 4.089 . 0 0 "[ . 1 . 2]" 1
1183 1 75 SER HA 1 76 ILE MG . . 5.500 5.556 5.459 5.640 0.140 6 0 "[ . 1 . 2]" 1
1184 1 75 SER HA 1 83 HIS HE1 . . 4.600 3.014 2.673 3.445 . 0 0 "[ . 1 . 2]" 1
1185 1 75 SER HA 1 87 SER QB . . 4.840 4.347 3.508 4.665 . 0 0 "[ . 1 . 2]" 1
1186 1 75 SER HA 1 88 PRO HA . . 3.900 2.754 2.531 2.977 . 0 0 "[ . 1 . 2]" 1
1187 1 75 SER HA 1 88 PRO HB2 . . 4.400 3.605 3.450 3.920 . 0 0 "[ . 1 . 2]" 1
1188 1 75 SER HA 1 88 PRO HB3 . . 4.260 2.343 2.193 2.600 . 0 0 "[ . 1 . 2]" 1
1189 1 75 SER HA 1 88 PRO QG . . 4.520 4.350 4.224 4.555 0.035 7 0 "[ . 1 . 2]" 1
1190 1 75 SER QB 1 76 ILE H . . 4.060 3.684 3.230 4.037 . 0 0 "[ . 1 . 2]" 1
1191 1 75 SER QB 1 77 LYS QE . . 3.830 2.792 2.159 4.425 0.595 12 1 "[ . 1 + . 2]" 1
1192 1 75 SER QB 1 77 LYS HG3 . . 4.560 3.145 2.743 4.058 . 0 0 "[ . 1 . 2]" 1
1193 1 75 SER QB 1 83 HIS HE1 . . 3.730 2.359 2.223 3.184 . 0 0 "[ . 1 . 2]" 1
1194 1 75 SER QB 1 88 PRO HB3 . . 4.510 3.607 3.306 3.762 . 0 0 "[ . 1 . 2]" 1
1195 1 75 SER HB2 1 76 ILE H . . 4.860 4.472 4.253 4.578 . 0 0 "[ . 1 . 2]" 1
1196 1 75 SER HB2 1 77 LYS HE2 . . 5.500 5.668 4.373 6.437 0.937 12 3 "[ . * -1 + . 2]" 1
1197 1 75 SER HB2 1 77 LYS HE3 . . 5.500 4.211 3.146 5.513 0.013 12 0 "[ . 1 . 2]" 1
1198 1 75 SER HB3 1 76 ILE H . . 4.860 3.934 3.346 4.487 . 0 0 "[ . 1 . 2]" 1
1199 1 75 SER HB3 1 77 LYS HE2 . . 5.500 4.270 3.880 5.757 0.257 12 0 "[ . 1 . 2]" 1
1200 1 75 SER HB3 1 77 LYS HE3 . . 5.500 2.907 2.218 5.112 . 0 0 "[ . 1 . 2]" 1
1201 1 76 ILE H 1 76 ILE HB . . 4.030 2.605 2.481 2.761 . 0 0 "[ . 1 . 2]" 1
1202 1 76 ILE H 1 76 ILE MD . . 4.930 3.736 3.529 4.080 . 0 0 "[ . 1 . 2]" 1
1203 1 76 ILE H 1 76 ILE HG12 . . 5.170 3.596 3.344 4.236 . 0 0 "[ . 1 . 2]" 1
1204 1 76 ILE H 1 76 ILE QG . . 4.370 2.336 2.071 2.900 . 0 0 "[ . 1 . 2]" 1
1205 1 76 ILE H 1 76 ILE HG13 . . 5.170 2.368 2.089 2.953 . 0 0 "[ . 1 . 2]" 1
1206 1 76 ILE H 1 83 HIS HB3 . . 5.070 4.898 4.209 5.419 0.349 6 0 "[ . 1 . 2]" 1
1207 1 76 ILE H 1 84 ILE MD . . 5.500 4.942 4.756 5.232 . 0 0 "[ . 1 . 2]" 1
1208 1 76 ILE H 1 87 SER HB2 . . 4.490 3.452 3.050 4.346 . 0 0 "[ . 1 . 2]" 1
1209 1 76 ILE H 1 87 SER HB3 . . 4.490 3.798 3.287 4.233 . 0 0 "[ . 1 . 2]" 1
1210 1 76 ILE H 1 88 PRO HA . . 4.560 3.173 2.949 3.717 . 0 0 "[ . 1 . 2]" 1
1211 1 76 ILE HA 1 76 ILE MD . . 4.310 3.934 3.858 3.988 . 0 0 "[ . 1 . 2]" 1
1212 1 76 ILE HA 1 76 ILE MG . . 3.490 2.329 2.264 2.405 . 0 0 "[ . 1 . 2]" 1
1213 1 76 ILE HA 1 77 LYS HB2 . . 4.910 4.532 4.381 4.748 . 0 0 "[ . 1 . 2]" 1
1214 1 76 ILE HA 1 84 ILE MG . . 5.170 4.776 4.583 5.053 . 0 0 "[ . 1 . 2]" 1
1215 1 76 ILE HB 1 76 ILE MD . . 3.490 2.427 2.277 2.504 . 0 0 "[ . 1 . 2]" 1
1216 1 76 ILE HB 1 84 ILE H . . 4.450 3.614 3.402 3.825 . 0 0 "[ . 1 . 2]" 1
1217 1 76 ILE HB 1 84 ILE MD . . 3.520 2.903 2.541 3.177 . 0 0 "[ . 1 . 2]" 1
1218 1 76 ILE HB 1 84 ILE QG . . 3.600 2.201 2.139 2.312 . 0 0 "[ . 1 . 2]" 1
1219 1 76 ILE HB 1 87 SER HA . . 5.500 4.570 4.285 4.891 . 0 0 "[ . 1 . 2]" 1
1220 1 76 ILE HB 1 87 SER HB2 . . 4.830 2.663 2.420 4.057 . 0 0 "[ . 1 . 2]" 1
1221 1 76 ILE HB 1 87 SER QB . . 4.180 2.594 2.377 3.717 . 0 0 "[ . 1 . 2]" 1
1222 1 76 ILE HB 1 87 SER HB3 . . 4.830 3.689 3.472 4.316 . 0 0 "[ . 1 . 2]" 1
1223 1 76 ILE HB 1 89 PHE QE . . 4.470 3.490 3.083 3.862 . 0 0 "[ . 1 . 2]" 1
1224 1 76 ILE MD 1 84 ILE MD . . 3.070 2.584 2.363 2.828 . 0 0 "[ . 1 . 2]" 1
1225 1 76 ILE MD 1 84 ILE QG . . 4.140 3.332 3.087 3.505 . 0 0 "[ . 1 . 2]" 1
1226 1 76 ILE MD 1 89 PHE QD . . 3.960 2.392 2.288 2.627 . 0 0 "[ . 1 . 2]" 1
1227 1 76 ILE MD 1 89 PHE QE . . 3.530 2.323 2.220 2.508 . 0 0 "[ . 1 . 2]" 1
1228 1 76 ILE QG 1 77 LYS H . . 5.340 4.397 4.276 4.527 . 0 0 "[ . 1 . 2]" 1
1229 1 76 ILE QG 1 89 PHE QD . . 4.430 2.993 2.695 3.816 . 0 0 "[ . 1 . 2]" 1
1230 1 76 ILE MG 1 77 LYS H . . 3.650 3.127 2.716 3.500 . 0 0 "[ . 1 . 2]" 1
1231 1 76 ILE MG 1 84 ILE HB . . 4.920 4.312 4.175 4.455 . 0 0 "[ . 1 . 2]" 1
1232 1 76 ILE MG 1 84 ILE QG . . 3.790 2.344 2.030 2.850 . 0 0 "[ . 1 . 2]" 1
1233 1 76 ILE MG 1 87 SER QB . . 4.870 3.883 3.695 4.710 . 0 0 "[ . 1 . 2]" 1
1234 1 76 ILE MG 1 89 PHE QE . . 4.850 4.211 3.855 4.426 . 0 0 "[ . 1 . 2]" 1
1235 1 77 LYS H 1 77 LYS HB2 . . 3.880 2.541 2.400 2.685 . 0 0 "[ . 1 . 2]" 1
1236 1 77 LYS H 1 77 LYS QD . . 5.500 4.246 3.968 4.514 . 0 0 "[ . 1 . 2]" 1
1237 1 77 LYS H 1 77 LYS HG2 . . 4.680 3.975 3.595 4.220 . 0 0 "[ . 1 . 2]" 1
1238 1 77 LYS H 1 77 LYS HG3 . . 4.780 2.938 2.460 3.250 . 0 0 "[ . 1 . 2]" 1
1239 1 77 LYS HA 1 77 LYS HG2 . . 3.920 2.505 2.431 2.674 . 0 0 "[ . 1 . 2]" 1
1240 1 77 LYS HA 1 77 LYS HG3 . . 4.210 3.056 2.909 3.292 . 0 0 "[ . 1 . 2]" 1
1241 1 77 LYS HA 1 78 TYR H . . 3.010 2.255 2.172 2.332 . 0 0 "[ . 1 . 2]" 1
1242 1 77 LYS HA 1 78 TYR QB . . 4.670 3.828 3.696 4.064 . 0 0 "[ . 1 . 2]" 1
1243 1 77 LYS HA 1 83 HIS HA . . 3.760 2.519 2.272 2.773 . 0 0 "[ . 1 . 2]" 1
1244 1 77 LYS HA 1 84 ILE H . . 4.040 3.164 2.967 3.467 . 0 0 "[ . 1 . 2]" 1
1245 1 77 LYS HA 1 84 ILE MG . . 3.900 2.969 2.442 3.562 . 0 0 "[ . 1 . 2]" 1
1246 1 77 LYS HB2 1 77 LYS QD . . 3.860 2.448 2.240 2.510 . 0 0 "[ . 1 . 2]" 1
1247 1 77 LYS HB2 1 78 TYR H . . 4.210 4.077 3.778 4.465 0.255 13 0 "[ . 1 . 2]" 1
1248 1 77 LYS HB2 1 82 TYR H . . 4.740 4.920 4.178 5.469 0.729 19 4 "[ * . 1- .* +2]" 1
1249 1 77 LYS HB3 1 78 TYR H . . 4.000 3.023 2.749 3.730 . 0 0 "[ . 1 . 2]" 1
1250 1 77 LYS HB3 1 81 PRO HA . . 4.870 3.181 2.614 3.576 . 0 0 "[ . 1 . 2]" 1
1251 1 77 LYS HB3 1 82 TYR H . . 3.800 3.199 2.495 3.733 . 0 0 "[ . 1 . 2]" 1
1252 1 77 LYS QD 1 81 PRO HA . . 3.730 2.654 2.466 3.054 . 0 0 "[ . 1 . 2]" 1
1253 1 77 LYS QD 1 82 TYR H . . 4.210 3.880 3.486 4.213 0.003 16 0 "[ . 1 . 2]" 1
1254 1 77 LYS QD 1 82 TYR HA . . 4.100 3.976 3.387 4.353 0.253 16 0 "[ . 1 . 2]" 1
1255 1 77 LYS QD 1 82 TYR QD . . 5.500 5.621 5.113 5.922 0.422 16 0 "[ . 1 . 2]" 1
1256 1 77 LYS QE 1 77 LYS HG3 . . 3.600 2.559 2.467 2.810 . 0 0 "[ . 1 . 2]" 1
1257 1 77 LYS QE 1 82 TYR HA . . 4.450 3.887 3.349 5.252 0.802 14 2 "[ . - +. 2]" 1
1258 1 77 LYS QE 1 83 HIS HD2 . . 5.180 3.575 2.997 5.491 0.311 14 0 "[ . 1 . 2]" 1
1259 1 77 LYS QE 1 83 HIS HE1 . . 3.970 3.101 2.669 4.444 0.474 12 0 "[ . 1 . 2]" 1
1260 1 77 LYS HE2 1 77 LYS HG2 . . 4.070 2.617 2.276 4.153 0.083 14 0 "[ . 1 . 2]" 1
1261 1 77 LYS HE2 1 77 LYS HG3 . . 4.230 3.170 3.019 3.753 . 0 0 "[ . 1 . 2]" 1
1262 1 77 LYS HE3 1 77 LYS HG2 . . 4.070 3.020 2.574 3.371 . 0 0 "[ . 1 . 2]" 1
1263 1 77 LYS HE3 1 77 LYS HG3 . . 4.230 2.716 2.604 2.902 . 0 0 "[ . 1 . 2]" 1
1264 1 77 LYS HG2 1 78 TYR H . . 4.450 4.218 4.020 4.514 0.064 13 0 "[ . 1 . 2]" 1
1265 1 77 LYS HG2 1 82 TYR H . . 4.640 4.316 3.992 4.610 . 0 0 "[ . 1 . 2]" 1
1266 1 77 LYS HG2 1 83 HIS HA . . 3.810 2.496 2.259 3.259 . 0 0 "[ . 1 . 2]" 1
1267 1 77 LYS HG2 1 84 ILE H . . 5.030 4.445 4.128 5.206 0.176 12 0 "[ . 1 . 2]" 1
1268 1 77 LYS HG3 1 83 HIS HA . . 4.450 3.508 3.301 4.216 . 0 0 "[ . 1 . 2]" 1
1269 1 78 TYR H 1 78 TYR QB . . 3.450 2.638 2.374 2.738 . 0 0 "[ . 1 . 2]" 1
1270 1 78 TYR H 1 82 TYR H . . 4.370 3.647 3.165 4.816 0.446 13 0 "[ . 1 . 2]" 1
1271 1 78 TYR H 1 83 HIS HA . . 4.680 4.178 3.941 4.465 . 0 0 "[ . 1 . 2]" 1
1272 1 78 TYR H 1 84 ILE MG . . 3.980 3.035 2.173 3.590 . 0 0 "[ . 1 . 2]" 1
1273 1 78 TYR HA 1 78 TYR QD . . 3.660 2.955 2.672 3.096 . 0 0 "[ . 1 . 2]" 1
1274 1 78 TYR HA 1 79 GLY H . . 3.160 2.239 2.197 2.287 . 0 0 "[ . 1 . 2]" 1
1275 1 78 TYR HA 1 80 GLY H . . 4.500 3.547 3.457 3.628 . 0 0 "[ . 1 . 2]" 1
1276 1 78 TYR QB 1 79 GLY H . . 4.520 3.599 3.497 3.688 . 0 0 "[ . 1 . 2]" 1
1277 1 78 TYR QB 1 84 ILE HA . . 5.500 4.348 4.035 4.650 . 0 0 "[ . 1 . 2]" 1
1278 1 78 TYR QB 1 84 ILE MG . . 3.320 2.023 1.924 2.160 . 0 0 "[ . 1 . 2]" 1
1279 1 78 TYR QD 1 79 GLY H . . 4.590 3.344 3.240 3.500 . 0 0 "[ . 1 . 2]" 1
1280 1 78 TYR QD 1 84 ILE MG . . 4.450 3.466 3.190 3.681 . 0 0 "[ . 1 . 2]" 1
1281 1 79 GLY H 1 80 GLY H . . 3.910 2.702 2.628 2.777 . 0 0 "[ . 1 . 2]" 1
1282 1 80 GLY QA 1 81 PRO QD . . 2.840 2.064 2.033 2.082 . 0 0 "[ . 1 . 2]" 1
1283 1 80 GLY QA 1 81 PRO QG . . 4.280 3.817 3.811 3.831 . 0 0 "[ . 1 . 2]" 1
1284 1 80 GLY QA 1 82 TYR QD . . 4.170 3.144 2.804 3.600 . 0 0 "[ . 1 . 2]" 1
1285 1 80 GLY HA2 1 81 PRO HD2 . . 3.650 3.175 3.028 3.434 . 0 0 "[ . 1 . 2]" 1
1286 1 80 GLY HA2 1 81 PRO HD3 . . 3.650 2.587 2.465 2.868 . 0 0 "[ . 1 . 2]" 1
1287 1 80 GLY HA3 1 81 PRO HD2 . . 3.650 2.315 2.210 2.405 . 0 0 "[ . 1 . 2]" 1
1288 1 80 GLY HA3 1 81 PRO HD3 . . 3.650 2.824 2.605 2.959 . 0 0 "[ . 1 . 2]" 1
1289 1 81 PRO HA 1 82 TYR H . . 3.460 3.042 2.787 3.256 . 0 0 "[ . 1 . 2]" 1
1290 1 81 PRO QB 1 82 TYR H . . 4.100 4.039 3.929 4.098 . 0 0 "[ . 1 . 2]" 1
1291 1 81 PRO QD 1 82 TYR H . . 4.860 3.426 3.058 3.821 . 0 0 "[ . 1 . 2]" 1
1292 1 81 PRO QD 1 82 TYR QD . . 4.170 2.851 2.624 3.055 . 0 0 "[ . 1 . 2]" 1
1293 1 81 PRO QG 1 82 TYR QD . . 4.760 3.620 3.415 3.895 . 0 0 "[ . 1 . 2]" 1
1294 1 81 PRO HG2 1 82 TYR QD . . 5.410 3.720 3.497 4.016 . 0 0 "[ . 1 . 2]" 1
1295 1 81 PRO HG3 1 82 TYR QD . . 5.410 4.969 4.776 5.242 . 0 0 "[ . 1 . 2]" 1
1296 1 82 TYR HA 1 82 TYR QD . . 4.100 2.604 2.454 2.693 . 0 0 "[ . 1 . 2]" 1
1297 1 82 TYR HA 1 82 TYR QE . . 4.570 4.560 4.514 4.612 0.042 1 0 "[ . 1 . 2]" 1
1298 1 82 TYR HA 1 83 HIS HD2 . . 4.270 4.038 3.605 4.499 0.229 17 0 "[ . 1 . 2]" 1
1299 1 82 TYR QB 1 83 HIS H . . 3.460 2.997 2.704 3.230 . 0 0 "[ . 1 . 2]" 1
1300 1 82 TYR QD 1 83 HIS H . . 4.010 3.877 3.710 4.046 0.036 20 0 "[ . 1 . 2]" 1
1301 1 83 HIS H 1 83 HIS HB2 . . 3.760 2.339 2.275 2.455 . 0 0 "[ . 1 . 2]" 1
1302 1 83 HIS H 1 83 HIS HB3 . . 3.900 3.534 3.510 3.567 . 0 0 "[ . 1 . 2]" 1
1303 1 83 HIS H 1 83 HIS HD2 . . 3.620 2.649 2.395 3.005 . 0 0 "[ . 1 . 2]" 1
1304 1 83 HIS HA 1 84 ILE H . . 3.080 2.238 2.208 2.275 . 0 0 "[ . 1 . 2]" 1
1305 1 83 HIS HA 1 84 ILE MG . . 4.090 3.667 3.567 3.790 . 0 0 "[ . 1 . 2]" 1
1306 1 83 HIS HB2 1 84 ILE H . . 4.710 4.167 4.026 4.274 . 0 0 "[ . 1 . 2]" 1
1307 1 83 HIS HB2 1 87 SER H . . 4.890 5.277 5.044 5.563 0.673 15 2 "[ . 1 + - 2]" 1
1308 1 83 HIS HB2 1 87 SER QB . . 4.200 3.839 3.578 3.970 . 0 0 "[ . 1 . 2]" 1
1309 1 83 HIS HB3 1 84 ILE H . . 4.230 3.071 2.961 3.218 . 0 0 "[ . 1 . 2]" 1
1310 1 83 HIS HB3 1 87 SER HA . . 5.170 4.651 4.430 4.793 . 0 0 "[ . 1 . 2]" 1
1311 1 83 HIS HB3 1 87 SER HB2 . . 4.340 3.853 2.314 4.058 . 0 0 "[ . 1 . 2]" 1
1312 1 83 HIS HB3 1 87 SER QB . . 3.480 2.200 2.085 2.296 . 0 0 "[ . 1 . 2]" 1
1313 1 83 HIS HB3 1 87 SER HB3 . . 4.340 2.225 2.154 2.369 . 0 0 "[ . 1 . 2]" 1
1314 1 83 HIS HE1 1 88 PRO HB2 . . 5.500 4.566 4.144 4.972 . 0 0 "[ . 1 . 2]" 1
1315 1 83 HIS HE1 1 88 PRO HB3 . . 4.520 2.876 2.432 3.281 . 0 0 "[ . 1 . 2]" 1
1316 1 83 HIS HE1 1 88 PRO HD2 . . 5.140 4.985 4.640 5.266 0.126 14 0 "[ . 1 . 2]" 1
1317 1 83 HIS HE1 1 88 PRO QD . . 4.310 3.269 2.962 3.552 . 0 0 "[ . 1 . 2]" 1
1318 1 83 HIS HE1 1 88 PRO HD3 . . 5.140 3.315 2.996 3.611 . 0 0 "[ . 1 . 2]" 1
1319 1 83 HIS HE1 1 88 PRO QG . . 4.310 3.579 3.276 3.807 . 0 0 "[ . 1 . 2]" 1
1320 1 84 ILE H 1 84 ILE MD . . 4.510 3.729 3.425 3.918 . 0 0 "[ . 1 . 2]" 1
1321 1 84 ILE H 1 84 ILE QG . . 3.570 2.208 2.130 2.287 . 0 0 "[ . 1 . 2]" 1
1322 1 84 ILE H 1 84 ILE MG . . 3.430 2.241 2.184 2.405 . 0 0 "[ . 1 . 2]" 1
1323 1 84 ILE H 1 87 SER QB . . 4.240 2.551 2.371 2.713 . 0 0 "[ . 1 . 2]" 1
1324 1 84 ILE HA 1 84 ILE MD . . 4.580 3.924 3.651 4.178 . 0 0 "[ . 1 . 2]" 1
1325 1 84 ILE HA 1 84 ILE MG . . 3.380 2.345 2.297 2.409 . 0 0 "[ . 1 . 2]" 1
1326 1 84 ILE HA 1 85 GLY H . . 3.260 2.471 2.243 2.588 . 0 0 "[ . 1 . 2]" 1
1327 1 84 ILE HA 1 85 GLY QA . . 4.710 3.982 3.822 4.045 . 0 0 "[ . 1 . 2]" 1
1328 1 84 ILE HB 1 84 ILE MD . . 3.130 2.351 2.243 2.400 . 0 0 "[ . 1 . 2]" 1
1329 1 84 ILE HB 1 85 GLY H . . 3.240 2.357 2.165 2.902 . 0 0 "[ . 1 . 2]" 1
1330 1 84 ILE HB 1 85 GLY HA2 . . 4.970 4.771 4.519 4.875 . 0 0 "[ . 1 . 2]" 1
1331 1 84 ILE HB 1 85 GLY QA . . 4.240 3.964 3.641 4.100 . 0 0 "[ . 1 . 2]" 1
1332 1 84 ILE HB 1 85 GLY HA3 . . 4.970 4.238 3.840 4.423 . 0 0 "[ . 1 . 2]" 1
1333 1 84 ILE MD 1 85 GLY H . . 4.630 3.440 2.800 3.940 . 0 0 "[ . 1 . 2]" 1
1334 1 84 ILE MD 1 85 GLY QA . . 5.040 3.780 2.448 4.834 . 0 0 "[ . 1 . 2]" 1
1335 1 84 ILE MD 1 87 SER H . . 4.350 3.655 2.538 4.574 0.224 19 0 "[ . 1 . 2]" 1
1336 1 84 ILE MD 1 87 SER HB2 . . 4.780 3.012 2.342 4.226 . 0 0 "[ . 1 . 2]" 1
1337 1 84 ILE MD 1 87 SER QB . . 4.070 2.916 2.268 4.045 . 0 0 "[ . 1 . 2]" 1
1338 1 84 ILE MD 1 87 SER HB3 . . 4.780 3.912 3.037 5.164 0.384 6 0 "[ . 1 . 2]" 1
1339 1 84 ILE MD 1 89 PHE QE . . 3.610 2.403 2.074 2.768 . 0 0 "[ . 1 . 2]" 1
1340 1 84 ILE MD 1 89 PHE HZ . . 4.430 3.444 3.045 4.034 . 0 0 "[ . 1 . 2]" 1
1341 1 84 ILE QG 1 85 GLY H . . 4.300 3.702 3.256 4.364 0.064 15 0 "[ . 1 . 2]" 1
1342 1 84 ILE QG 1 85 GLY QA . . 5.340 4.311 3.883 4.910 . 0 0 "[ . 1 . 2]" 1
1343 1 84 ILE QG 1 87 SER H . . 3.940 3.451 2.695 4.150 0.210 18 0 "[ . 1 . 2]" 1
1344 1 84 ILE QG 1 87 SER HA . . 5.110 4.489 3.942 5.144 0.034 7 0 "[ . 1 . 2]" 1
1345 1 84 ILE QG 1 87 SER HB2 . . 3.990 2.384 2.094 2.903 . 0 0 "[ . 1 . 2]" 1
1346 1 84 ILE QG 1 87 SER QB . . 3.310 2.281 2.006 2.730 . 0 0 "[ . 1 . 2]" 1
1347 1 84 ILE QG 1 87 SER HB3 . . 3.990 2.931 2.556 3.761 . 0 0 "[ . 1 . 2]" 1
1348 1 84 ILE QG 1 89 PHE QD . . 5.320 4.721 4.221 5.164 . 0 0 "[ . 1 . 2]" 1
1349 1 84 ILE QG 1 89 PHE QE . . 4.420 3.222 2.588 3.713 . 0 0 "[ . 1 . 2]" 1
1350 1 84 ILE MG 1 85 GLY H . . 4.170 3.721 3.648 3.974 . 0 0 "[ . 1 . 2]" 1
1351 1 84 ILE MG 1 87 SER QB . . 5.340 3.969 3.726 4.295 . 0 0 "[ . 1 . 2]" 1
1352 1 85 GLY H 1 86 GLY H . . 4.540 4.418 2.908 4.557 0.017 19 0 "[ . 1 . 2]" 1
1353 1 85 GLY H 1 87 SER H . . 4.950 4.558 4.260 4.718 . 0 0 "[ . 1 . 2]" 1
1354 1 85 GLY QA 1 86 GLY H . . 3.130 2.135 2.078 2.879 . 0 0 "[ . 1 . 2]" 1
1355 1 85 GLY QA 1 86 GLY QA . . 4.080 3.632 3.614 3.795 . 0 0 "[ . 1 . 2]" 1
1356 1 85 GLY QA 1 87 SER QB . . 5.020 4.600 4.433 4.830 . 0 0 "[ . 1 . 2]" 1
1357 1 85 GLY QA 1 89 PHE HZ . . 5.340 5.025 3.595 5.920 0.580 20 1 "[ . 1 . +]" 1
1358 1 85 GLY HA2 1 87 SER H . . 5.030 3.879 3.605 4.628 . 0 0 "[ . 1 . 2]" 1
1359 1 85 GLY HA3 1 87 SER H . . 5.030 4.375 3.698 4.625 . 0 0 "[ . 1 . 2]" 1
1360 1 86 GLY H 1 87 SER H . . 3.390 2.695 2.418 2.793 . 0 0 "[ . 1 . 2]" 1
1361 1 86 GLY H 1 87 SER QB . . 4.500 4.430 3.804 4.663 0.163 19 0 "[ . 1 . 2]" 1
1362 1 86 GLY QA 1 89 PHE QE . . 5.280 3.315 3.023 3.472 . 0 0 "[ . 1 . 2]" 1
1363 1 87 SER H 1 87 SER HB2 . . 3.590 2.602 2.183 2.732 . 0 0 "[ . 1 . 2]" 1
1364 1 87 SER H 1 87 SER QB . . 2.990 2.226 2.162 2.282 . 0 0 "[ . 1 . 2]" 1
1365 1 87 SER H 1 87 SER HB3 . . 3.590 2.473 2.359 3.483 . 0 0 "[ . 1 . 2]" 1
1366 1 87 SER H 1 88 PRO HA . . 4.960 4.909 4.791 4.993 0.033 19 0 "[ . 1 . 2]" 1
1367 1 87 SER HA 1 88 PRO HA . . 3.370 2.353 2.243 2.514 . 0 0 "[ . 1 . 2]" 1
1368 1 87 SER HA 1 88 PRO HB2 . . 4.790 4.673 4.636 4.720 . 0 0 "[ . 1 . 2]" 1
1369 1 87 SER HA 1 88 PRO HB3 . . 4.680 4.542 4.458 4.666 . 0 0 "[ . 1 . 2]" 1
1370 1 87 SER HA 1 88 PRO QG . . 5.500 4.741 4.717 4.763 . 0 0 "[ . 1 . 2]" 1
1371 1 87 SER HA 1 89 PHE H . . 3.850 3.222 2.911 3.459 . 0 0 "[ . 1 . 2]" 1
1372 1 87 SER HA 1 89 PHE HA . . 4.030 4.132 3.861 4.329 0.299 16 0 "[ . 1 . 2]" 1
1373 1 87 SER HA 1 89 PHE QD . . 4.000 2.830 2.680 3.048 . 0 0 "[ . 1 . 2]" 1
1374 1 87 SER HA 1 89 PHE QE . . 4.720 3.142 2.970 3.387 . 0 0 "[ . 1 . 2]" 1
1375 1 87 SER QB 1 88 PRO HA . . 4.220 3.297 2.471 3.402 . 0 0 "[ . 1 . 2]" 1
1376 1 87 SER QB 1 89 PHE QD . . 4.530 3.306 2.859 4.169 . 0 0 "[ . 1 . 2]" 1
1377 1 87 SER QB 1 89 PHE QE . . 3.930 2.472 2.320 3.686 . 0 0 "[ . 1 . 2]" 1
1378 1 87 SER HB2 1 88 PRO HA . . 4.860 3.663 3.538 3.890 . 0 0 "[ . 1 . 2]" 1
1379 1 87 SER HB2 1 89 PHE QE . . 4.490 2.501 2.337 3.902 . 0 0 "[ . 1 . 2]" 1
1380 1 87 SER HB3 1 88 PRO HA . . 4.860 3.810 2.500 3.970 . 0 0 "[ . 1 . 2]" 1
1381 1 87 SER HB3 1 89 PHE QE . . 4.490 4.067 3.889 4.530 0.040 6 0 "[ . 1 . 2]" 1
1382 1 88 PRO HA 1 89 PHE H . . 3.260 2.240 2.167 2.297 . 0 0 "[ . 1 . 2]" 1
1383 1 88 PRO HA 1 89 PHE HB2 . . 5.130 4.489 4.416 4.609 . 0 0 "[ . 1 . 2]" 1
1384 1 88 PRO HA 1 89 PHE QD . . 4.460 3.398 3.215 3.639 . 0 0 "[ . 1 . 2]" 1
1385 1 88 PRO HB2 1 89 PHE H . . 4.220 2.994 2.798 3.242 . 0 0 "[ . 1 . 2]" 1
1386 1 88 PRO HB2 1 89 PHE HA . . 4.770 4.602 4.499 4.690 . 0 0 "[ . 1 . 2]" 1
1387 1 88 PRO HB3 1 89 PHE H . . 4.460 3.709 3.605 3.822 . 0 0 "[ . 1 . 2]" 1
1388 1 88 PRO QG 1 89 PHE H . . 5.400 4.373 4.248 4.528 . 0 0 "[ . 1 . 2]" 1
1389 1 88 PRO QG 1 89 PHE HA . . 5.260 4.941 4.828 5.067 . 0 0 "[ . 1 . 2]" 1
1390 1 89 PHE H 1 89 PHE HB2 . . 3.720 2.421 2.342 2.467 . 0 0 "[ . 1 . 2]" 1
1391 1 89 PHE H 1 89 PHE HB3 . . 4.110 3.641 3.594 3.672 . 0 0 "[ . 1 . 2]" 1
1392 1 89 PHE H 1 89 PHE QD . . 3.690 2.566 2.428 2.717 . 0 0 "[ . 1 . 2]" 1
1393 1 89 PHE H 1 90 LYS H . . 4.560 4.529 4.411 4.578 0.018 6 0 "[ . 1 . 2]" 1
1394 1 89 PHE HA 1 89 PHE QD . . 3.760 2.999 2.899 3.108 . 0 0 "[ . 1 . 2]" 1
1395 1 89 PHE HA 1 90 LYS H . . 2.770 2.215 2.154 2.294 . 0 0 "[ . 1 . 2]" 1
1396 1 89 PHE HA 1 90 LYS HA . . 4.580 4.364 4.286 4.427 . 0 0 "[ . 1 . 2]" 1
1397 1 89 PHE HA 1 90 LYS QB . . 5.340 4.213 3.949 4.734 . 0 0 "[ . 1 . 2]" 1
1398 1 89 PHE HB2 1 90 LYS H . . 4.520 4.211 4.036 4.366 . 0 0 "[ . 1 . 2]" 1
1399 1 89 PHE HB3 1 90 LYS H . . 3.890 3.224 2.954 3.450 . 0 0 "[ . 1 . 2]" 1
1400 1 89 PHE QD 1 90 LYS H . . 4.620 4.136 3.976 4.302 . 0 0 "[ . 1 . 2]" 1
1401 1 90 LYS H 1 90 LYS HB2 . . 3.610 3.506 2.647 3.737 0.127 4 0 "[ . 1 . 2]" 1
1402 1 90 LYS H 1 90 LYS QB . . 3.090 2.657 2.292 2.987 . 0 0 "[ . 1 . 2]" 1
1403 1 90 LYS H 1 90 LYS HB3 . . 3.610 2.768 2.512 3.226 . 0 0 "[ . 1 . 2]" 1
1404 1 90 LYS H 1 91 ALA H . . 4.350 3.603 2.719 4.449 0.099 11 0 "[ . 1 . 2]" 1
1405 1 90 LYS H 1 92 LYS QG . . 5.340 5.648 5.239 6.078 0.738 8 8 "[* *- *+ ** . *2]" 1
1406 1 90 LYS HA 1 91 ALA H . . 3.550 2.569 2.070 3.173 . 0 0 "[ . 1 . 2]" 1
1407 1 90 LYS QB 1 92 LYS QG . . 3.230 3.763 3.393 4.062 0.832 5 10 "[-* *+ * 1 ** *** 2]" 1
1408 1 90 LYS QG 1 91 ALA H . . 4.950 3.939 3.344 5.029 0.079 10 0 "[ . 1 . 2]" 1
1409 1 91 ALA H 1 91 ALA MB . . 3.070 2.245 2.179 2.324 . 0 0 "[ . 1 . 2]" 1
1410 1 91 ALA H 1 92 LYS H . . 4.770 4.357 4.065 4.545 . 0 0 "[ . 1 . 2]" 1
1411 1 91 ALA HA 1 92 LYS H . . 2.810 2.172 2.113 2.207 . 0 0 "[ . 1 . 2]" 1
1412 1 91 ALA HA 1 92 LYS QB . . 4.800 4.384 4.196 4.478 . 0 0 "[ . 1 . 2]" 1
1413 1 91 ALA MB 1 92 LYS H . . 3.830 3.375 3.177 3.559 . 0 0 "[ . 1 . 2]" 1
1414 1 92 LYS H 1 92 LYS QB . . 3.110 2.407 2.276 2.499 . 0 0 "[ . 1 . 2]" 1
1415 1 92 LYS H 1 92 LYS HG2 . . 4.560 3.669 3.435 4.077 . 0 0 "[ . 1 . 2]" 1
1416 1 92 LYS H 1 92 LYS QG . . 3.920 2.542 2.396 2.780 . 0 0 "[ . 1 . 2]" 1
1417 1 92 LYS H 1 92 LYS HG3 . . 4.560 2.594 2.445 2.829 . 0 0 "[ . 1 . 2]" 1
1418 1 92 LYS H 1 93 VAL H . . 4.710 4.478 3.963 4.613 . 0 0 "[ . 1 . 2]" 1
1419 1 92 LYS HA 1 92 LYS QD . . 4.390 4.096 3.841 4.220 . 0 0 "[ . 1 . 2]" 1
1420 1 92 LYS HA 1 92 LYS HG2 . . 4.010 2.474 2.331 2.644 . 0 0 "[ . 1 . 2]" 1
1421 1 92 LYS HA 1 92 LYS QG . . 3.450 2.370 2.252 2.404 . 0 0 "[ . 1 . 2]" 1
1422 1 92 LYS HA 1 92 LYS HG3 . . 4.010 3.074 2.733 3.240 . 0 0 "[ . 1 . 2]" 1
1423 1 92 LYS HA 1 93 VAL H . . 2.840 2.191 2.116 2.290 . 0 0 "[ . 1 . 2]" 1
1424 1 92 LYS QB 1 93 VAL H . . 4.100 3.269 2.950 3.875 . 0 0 "[ . 1 . 2]" 1
1425 1 92 LYS QG 1 93 VAL H . . 4.630 4.149 3.959 4.361 . 0 0 "[ . 1 . 2]" 1
1426 1 92 LYS HG2 1 93 VAL H . . 5.490 4.392 4.133 4.866 . 0 0 "[ . 1 . 2]" 1
1427 1 92 LYS HG3 1 93 VAL H . . 5.490 5.123 4.876 5.251 . 0 0 "[ . 1 . 2]" 1
1428 1 93 VAL H 1 93 VAL HB . . 3.830 2.935 2.366 3.924 0.094 9 0 "[ . 1 . 2]" 1
1429 1 93 VAL H 1 93 VAL QG . . 3.410 2.611 1.988 2.926 . 0 0 "[ . 1 . 2]" 1
1430 1 93 VAL H 1 94 THR H . . 4.760 4.478 4.363 4.633 . 0 0 "[ . 1 . 2]" 1
1431 1 93 VAL HA 1 93 VAL QG . . 3.330 2.210 2.137 2.407 . 0 0 "[ . 1 . 2]" 1
1432 1 93 VAL HA 1 94 THR H . . 2.770 2.202 2.151 2.308 . 0 0 "[ . 1 . 2]" 1
1433 1 93 VAL HA 1 94 THR MG . . 4.000 3.635 3.369 3.780 . 0 0 "[ . 1 . 2]" 1
1434 1 93 VAL HB 1 94 THR H . . 4.640 3.667 2.531 4.130 . 0 0 "[ . 1 . 2]" 1
1435 1 93 VAL QG 1 94 THR H . . 3.380 2.697 2.389 3.341 . 0 0 "[ . 1 . 2]" 1
1436 1 94 THR H 1 94 THR MG . . 3.610 3.019 2.812 3.226 . 0 0 "[ . 1 . 2]" 1
1437 1 94 THR H 1 95 GLY H . . 4.640 4.437 4.375 4.476 . 0 0 "[ . 1 . 2]" 1
1438 1 94 THR HA 1 94 THR MG . . 3.020 2.354 2.326 2.375 . 0 0 "[ . 1 . 2]" 1
1439 1 94 THR HB 1 95 GLY H . . 3.370 2.152 1.917 2.486 . 0 0 "[ . 1 . 2]" 1
1440 1 94 THR MG 1 95 GLY H . . 4.080 3.567 3.532 3.587 . 0 0 "[ . 1 . 2]" 1
1441 1 95 GLY H 1 96 PRO HD2 . . 4.950 4.941 4.899 4.984 0.034 19 0 "[ . 1 . 2]" 1
1442 1 95 GLY H 1 96 PRO HD3 . . 5.150 4.879 4.755 5.104 . 0 0 "[ . 1 . 2]" 1
1443 1 95 GLY HA2 1 96 PRO HD2 . . 3.540 2.978 2.867 3.281 . 0 0 "[ . 1 . 2]" 1
1444 1 95 GLY HA2 1 96 PRO HD3 . . 3.470 2.627 2.485 2.940 . 0 0 "[ . 1 . 2]" 1
1445 1 95 GLY HA3 1 96 PRO HD2 . . 3.550 2.307 2.152 2.402 . 0 0 "[ . 1 . 2]" 1
1446 1 95 GLY HA3 1 96 PRO HD3 . . 3.650 3.057 2.817 3.143 . 0 0 "[ . 1 . 2]" 1
1447 1 95 GLY HA3 1 96 PRO QG . . 4.710 4.143 4.020 4.222 . 0 0 "[ . 1 . 2]" 1
1448 1 96 PRO HA 1 97 ARG H . . 3.060 2.250 2.153 2.512 . 0 0 "[ . 1 . 2]" 1
1449 1 96 PRO QB 1 97 ARG H . . 3.640 2.981 2.353 3.324 . 0 0 "[ . 1 . 2]" 1
1450 1 96 PRO QB 1 98 LEU QD . . 3.760 3.263 2.264 4.321 0.561 11 1 "[ . 1+ . 2]" 1
1451 1 96 PRO HB2 1 97 ARG H . . 4.160 3.131 2.399 3.556 . 0 0 "[ . 1 . 2]" 1
1452 1 96 PRO HB3 1 97 ARG H . . 4.160 3.768 3.396 3.994 . 0 0 "[ . 1 . 2]" 1
1453 1 96 PRO HD3 1 97 ARG H . . 5.500 5.531 5.439 5.585 0.085 8 0 "[ . 1 . 2]" 1
1454 1 96 PRO QG 1 98 LEU QD . . 3.860 2.895 2.189 3.747 . 0 0 "[ . 1 . 2]" 1
1455 1 97 ARG H 1 97 ARG QB . . 3.280 2.294 2.178 3.052 . 0 0 "[ . 1 . 2]" 1
1456 1 97 ARG HA 1 98 LEU H . . 3.470 2.383 2.146 3.559 0.089 18 0 "[ . 1 . 2]" 1
1457 1 97 ARG HA 1 99 VAL H . . 4.640 3.930 3.617 4.389 . 0 0 "[ . 1 . 2]" 1
1458 1 97 ARG QB 1 97 ARG QD . . 3.300 2.282 2.114 2.393 . 0 0 "[ . 1 . 2]" 1
1459 1 97 ARG HB2 1 97 ARG QD . . 3.820 2.608 2.332 2.992 . 0 0 "[ . 1 . 2]" 1
1460 1 97 ARG HB3 1 97 ARG QD . . 3.820 2.596 2.341 3.103 . 0 0 "[ . 1 . 2]" 1
1461 1 97 ARG QG 1 98 LEU H . . 4.150 2.984 2.587 4.122 . 0 0 "[ . 1 . 2]" 1
1462 1 97 ARG QG 1 99 VAL H . . 3.340 2.355 1.974 3.441 0.101 3 0 "[ . 1 . 2]" 1
1463 1 97 ARG HG2 1 98 LEU H . . 4.930 3.233 2.708 5.039 0.109 3 0 "[ . 1 . 2]" 1
1464 1 97 ARG HG3 1 98 LEU H . . 4.930 3.613 2.946 5.060 0.130 7 0 "[ . 1 . 2]" 1
1465 1 98 LEU H 1 99 VAL H . . 3.470 2.657 2.373 3.682 0.212 7 0 "[ . 1 . 2]" 1
1466 1 98 LEU HA 1 98 LEU MD1 . . 3.520 2.501 2.030 3.856 0.336 15 0 "[ . 1 . 2]" 1
1467 1 98 LEU HA 1 98 LEU QD . . 2.820 2.111 1.982 2.611 . 0 0 "[ . 1 . 2]" 1
1468 1 98 LEU HA 1 98 LEU MD2 . . 3.520 2.803 2.099 3.840 0.320 20 0 "[ . 1 . 2]" 1
1469 1 99 VAL H 1 99 VAL HB . . 4.070 3.186 2.490 3.842 . 0 0 "[ . 1 . 2]" 1
1470 1 99 VAL H 1 99 VAL MG1 . . 4.530 3.031 1.973 3.823 . 0 0 "[ . 1 . 2]" 1
1471 1 99 VAL H 1 99 VAL QG . . 3.960 2.132 1.883 2.709 . 0 0 "[ . 1 . 2]" 1
1472 1 99 VAL H 1 99 VAL MG2 . . 4.530 2.561 1.909 4.064 . 0 0 "[ . 1 . 2]" 1
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