NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
587217 |
2my8   |
16884 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2my8
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 1988
_Distance_constraint_stats_list.Viol_count 26412
_Distance_constraint_stats_list.Viol_total 295812.531
_Distance_constraint_stats_list.Viol_max 3.066
_Distance_constraint_stats_list.Viol_rms 0.5161
_Distance_constraint_stats_list.Viol_average_all_restraints 0.3720
_Distance_constraint_stats_list.Viol_average_violations_only 0.5600
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 SER 48.297 1.768 10 20 [***-*****+**********]
1 3 HIS 77.902 2.195 5 20 [***-+***************]
1 4 MET 73.768 2.195 5 20 [****+*********-*****]
1 5 GLN 325.675 3.066 9 20 [********+****-******]
1 6 LYS 204.508 2.034 13 20 [*****-******+*******]
1 7 GLU 302.033 2.013 9 20 [******-*+***********]
1 8 GLY 150.610 1.901 7 20 [******+-************]
1 9 PRO 186.548 1.948 12 20 [***********+*****-**]
1 10 GLU 110.198 1.467 1 20 [+*******************]
1 11 GLY 141.608 2.123 13 20 [************+*******]
1 12 ALA 446.198 1.983 6 20 [*****+*****-********]
1 13 ASN 377.861 2.042 5 20 [****+****-**********]
1 14 LEU 668.374 2.933 13 20 [*******-****+*******]
1 15 PHE 393.568 3.012 12 20 [*******-***+********]
1 16 ILE 731.240 2.042 1 20 [+*******************]
1 17 TYR 270.101 2.463 13 20 [******-*****+*******]
1 18 HIS 339.653 2.466 8 20 [*******+***********-]
1 19 LEU 554.625 2.783 4 20 [***+***************-]
1 20 PRO 534.699 2.408 20 20 [**************-****+]
1 21 GLN 247.891 2.742 10 20 [******-**+**********]
1 22 GLU 167.180 1.931 4 20 [***+*-**************]
1 23 PHE 562.971 2.783 4 20 [***+**********-*****]
1 24 GLY 196.354 1.931 4 20 [***+*-**************]
1 25 ASP 167.971 1.754 9 20 [********+*-*********]
1 26 GLN 218.549 2.788 13 20 [*****-******+*******]
1 27 ASP 188.899 2.017 5 20 [****+***-***********]
1 28 ILE 546.913 1.989 19 20 [**********-*******+*]
1 29 LEU 402.679 1.661 7 20 [******+***-*********]
1 30 GLN 201.080 2.545 10 20 [*********+***-******]
1 31 MET 204.233 1.665 17 20 [********-*******+***]
1 32 PHE 528.249 2.893 16 20 [-**************+****]
1 33 MET 202.410 2.620 20 20 [*********-*********+]
1 34 PRO 246.346 2.620 20 20 [**************-****+]
1 35 PHE 262.720 2.009 11 20 [******-***+*********]
1 36 GLY 128.443 1.786 18 20 [******-**********+**]
1 37 ASN 134.039 2.544 3 20 [**+************-****]
1 38 VAL 474.035 2.116 16 20 [*******-*******+****]
1 39 ILE 547.723 2.034 13 20 [*****-******+*******]
1 40 SER 382.311 3.066 9 20 [******-*+***********]
1 41 ALA 352.289 2.659 9 20 [********+*-*********]
1 42 LYS 458.032 2.454 9 20 [********+*******-***]
1 43 VAL 253.997 1.308 5 20 [****+************-**]
1 44 PHE 264.035 1.880 17 20 [***********-****+***]
1 45 ILE 234.710 2.391 13 20 [************+*-*****]
1 46 ASP 294.638 2.995 9 20 [*****-**+***********]
1 47 LYS 407.136 2.501 17 20 [*****-**********+***]
1 48 GLN 253.466 2.088 11 20 [*********-+*********]
1 49 THR 168.003 1.583 10 20 [*********+*****-****]
1 50 ASN 101.381 1.206 7 11 "[ ***.*+ 1*** .- **]"
1 51 LEU 337.450 2.995 9 20 [********+-**********]
1 52 SER 219.511 3.051 17 20 [***********-****+***]
1 53 LYS 79.734 2.157 11 20 [**********+********-]
1 54 CYS 43.587 2.340 16 20 [***************+*-**]
1 55 PHE 250.997 3.051 17 20 [****************+*-*]
1 56 GLY 314.592 2.249 13 20 [********-***+*******]
1 57 PHE 551.051 3.012 12 20 [***********+*****-**]
1 58 VAL 752.516 2.933 13 20 [*******-****+*******]
1 59 SER 408.588 2.063 8 20 [*******+************]
1 60 TYR 455.548 1.743 16 20 [******-********+****]
1 61 ASP 278.033 2.544 3 20 [**+*******-*********]
1 62 ASN 262.862 1.727 13 20 [*******-****+*******]
1 63 PRO 299.368 2.123 13 20 [*******-****+*******]
1 64 VAL 202.910 1.587 6 20 [*****+**-***********]
1 65 SER 244.254 1.786 18 20 [***************-*+**]
1 66 ALA 254.110 1.317 20 20 [***********-*******+]
1 67 GLN 180.621 1.606 3 20 [-*+*****************]
1 68 ALA 67.615 0.739 8 10 "[ ** .* + 1 - *.*** *]"
1 69 ALA 208.846 2.009 11 20 [**********+****-****]
1 70 ILE 359.747 2.118 10 20 [***-*****+**********]
1 71 GLN 147.916 2.905 4 20 [***+*****-**********]
1 72 ALA 75.244 1.415 18 19 [****-*********.**+**]
1 73 MET 347.225 2.763 16 20 [************-**+****]
1 74 ASN 316.065 2.325 10 20 [***-*****+**********]
1 75 GLY 154.415 2.408 16 20 [-**************+****]
1 76 PHE 480.124 3.066 14 20 [************-+******]
1 77 GLN 206.347 2.608 16 20 [******-********+****]
1 78 ILE 620.030 2.230 3 20 [**+***-*************]
1 79 GLY 125.557 1.140 4 20 [***+************-***]
1 80 MET 126.945 1.796 9 20 [********+*******-***]
1 81 LYS 286.841 2.466 8 20 [****-**+************]
1 82 ARG 396.511 2.608 16 20 [***************+*-**]
1 83 LEU 755.377 3.066 14 20 [*************+***-**]
1 84 LYS 419.307 2.571 16 20 [**************-+****]
1 85 VAL 632.842 2.625 16 20 [**************-+****]
1 86 GLN 173.659 1.801 10 20 [*********+-*********]
1 87 LEU 115.245 2.118 10 20 [***-*****+**********]
1 88 LYS 184.070 2.355 5 20 [***-+***************]
1 89 ARG 131.858 2.280 17 20 [***-************+***]
1 90 SER 103.379 2.384 17 20 [***-************+***]
1 91 LYS 157.191 2.635 20 20 [*****************-*+]
1 92 ASN 79.464 2.635 20 20 [*************-*****+]
1 93 ASP 45.674 1.415 11 20 [**********+**-******]
1 94 SER 47.453 2.811 20 20 [*****************-*+]
1 95 LYS 46.373 2.811 20 20 [********-**********+]
1 96 PRO 20.576 0.631 12 1 "[ . 1 + . 2]"
1 97 TYR 24.251 1.414 10 13 "[**-** *+** *. ***]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY QA 1 2 SER HA 4.310 3.880 4.740 3.985 3.921 4.404 . 0 0 "[ . 1 . 2]" 1
2 1 2 SER H 1 3 HIS H 4.470 4.020 4.920 4.412 3.914 4.697 0.106 11 0 "[ . 1 . 2]" 1
3 1 2 SER HA 1 2 SER QB 2.820 2.540 3.100 2.282 2.209 2.469 0.331 9 0 "[ . 1 . 2]" 1
4 1 2 SER HA 1 3 HIS H 3.390 3.050 3.730 2.642 2.224 3.399 0.826 11 6 "[ * -. * 1+* . *]" 1
5 1 2 SER HA 1 3 HIS QB 4.530 4.080 4.980 4.169 3.735 4.497 0.345 19 0 "[ . 1 . 2]" 1
6 1 2 SER HA 1 6 LYS QE 4.380 3.940 4.820 4.500 2.387 5.073 1.553 11 1 "[ . 1+ . 2]" 1
7 1 2 SER QB 1 3 HIS H 4.460 4.010 4.910 2.817 2.242 3.915 1.768 10 16 "[****** **+ ****-**2]" 1
8 1 2 SER QB 1 3 HIS QB 5.130 4.620 5.640 4.758 4.336 5.131 0.284 11 0 "[ . 1 . 2]" 1
9 1 2 SER QB 1 4 MET H 3.930 3.540 4.320 3.815 3.421 4.649 0.329 11 0 "[ . 1 . 2]" 1
10 1 2 SER QB 1 4 MET QB 5.500 4.950 6.050 5.822 5.236 6.284 0.234 20 0 "[ . 1 . 2]" 1
11 1 2 SER QB 1 6 LYS QD 5.500 4.950 6.050 5.363 4.265 6.021 0.685 10 1 "[ . + . 2]" 1
12 1 2 SER QB 1 6 LYS QE 4.340 3.910 4.770 4.488 2.731 5.139 1.179 10 1 "[ . + . 2]" 1
13 1 3 HIS H 1 6 LYS QD 5.500 4.950 6.050 5.094 4.717 6.012 0.233 18 0 "[ . 1 . 2]" 1
14 1 3 HIS QB 1 4 MET H 5.500 4.950 6.050 3.275 2.755 4.017 2.195 5 20 [****+*************-*] 1
15 1 3 HIS QB 1 4 MET HA 5.420 4.880 5.960 4.667 4.426 4.925 0.454 5 0 "[ . 1 . 2]" 1
16 1 3 HIS QB 1 4 MET QB 4.400 3.960 4.840 3.823 3.196 4.384 0.764 18 3 "[ -. 1 .* + 2]" 1
17 1 4 MET HA 1 4 MET QG 3.630 3.270 3.990 2.642 2.206 3.435 1.064 15 14 "[* *. ** * -**+*****]" 1
18 1 4 MET HA 1 5 GLN H 3.080 2.770 3.390 2.697 2.539 3.159 0.231 19 0 "[ . 1 . 2]" 1
19 1 4 MET HA 1 5 GLN QB 5.270 4.740 5.800 4.262 3.957 4.444 0.783 13 5 "[* . 1 +*.*- 2]" 1
20 1 4 MET HA 1 6 LYS QE 5.500 4.950 6.050 5.300 4.746 5.829 0.204 8 0 "[ . 1 . 2]" 1
21 1 4 MET HA 1 41 ALA H 5.500 4.950 6.050 5.067 4.798 5.620 0.152 7 0 "[ . 1 . 2]" 1
22 1 4 MET QG 1 5 GLN H 4.070 3.660 4.480 3.532 1.994 4.342 1.666 7 2 "[ . + 1 - 2]" 1
23 1 5 GLN H 1 5 GLN QB 4.130 3.720 4.540 2.308 2.182 2.589 1.538 11 20 [**-*******+*********] 1
24 1 5 GLN H 1 5 GLN QG 4.810 4.760 5.290 4.019 3.538 4.191 1.222 10 20 [********-+**********] 1
25 1 5 GLN H 1 6 LYS H 4.340 3.910 4.770 4.117 3.766 4.689 0.144 20 0 "[ . 1 . 2]" 1
26 1 5 GLN HA 1 5 GLN QE 5.450 4.900 6.000 4.578 4.030 5.396 0.870 8 12 "[* ** *+ 1***-. * **]" 1
27 1 5 GLN HA 1 5 GLN QG 4.040 3.640 4.420 3.231 3.022 3.364 0.618 2 5 "[ +* .* *1 . - 2]" 1
28 1 5 GLN HA 1 6 LYS H 2.850 2.570 3.130 2.312 2.095 2.464 0.475 8 0 "[ . 1 . 2]" 1
29 1 5 GLN HA 1 6 LYS QB 5.080 4.570 5.590 4.856 4.572 5.075 . 0 0 "[ . 1 . 2]" 1
30 1 5 GLN HA 1 6 LYS QD 4.720 4.250 5.190 3.942 3.116 4.657 1.134 8 4 "[ . + 1 * * -2]" 1
31 1 5 GLN HA 1 40 SER H 5.480 4.930 6.030 5.461 5.222 5.817 . 0 0 "[ . 1 . 2]" 1
32 1 5 GLN HA 1 40 SER HA 4.110 3.700 4.520 3.724 3.502 4.086 0.198 8 0 "[ . 1 . 2]" 1
33 1 5 GLN HA 1 40 SER QB 5.240 4.950 5.760 2.214 1.884 2.627 3.066 9 20 [*******-+***********] 1
34 1 5 GLN HA 1 41 ALA H 5.500 4.950 6.050 5.069 4.792 5.413 0.158 8 0 "[ . 1 . 2]" 1
35 1 5 GLN QB 1 6 LYS H 4.500 4.050 4.950 4.000 3.664 4.147 0.386 9 0 "[ . 1 . 2]" 1
36 1 5 GLN QB 1 40 SER H 5.500 4.950 6.050 6.466 6.025 7.074 1.024 5 5 "[ + * 1 * . *-]" 1
37 1 5 GLN QB 1 40 SER QB 5.500 4.950 6.050 2.928 2.424 3.495 2.526 10 20 [****-****+**********] 1
38 1 5 GLN QB 1 41 ALA H 3.740 3.370 4.110 5.265 4.555 5.745 1.635 9 19 "[******* +-**********]" 1
39 1 5 GLN QB 1 41 ALA HA 5.500 4.950 6.050 5.957 5.558 6.209 0.159 5 0 "[ . 1 . 2]" 1
40 1 5 GLN QB 1 42 LYS H 4.890 4.400 5.380 5.451 5.159 5.647 0.267 18 0 "[ . 1 . 2]" 1
41 1 5 GLN QB 1 42 LYS QE 4.920 4.430 5.410 4.153 3.992 4.263 0.438 16 0 "[ . 1 . 2]" 1
42 1 5 GLN QE 1 15 PHE QE 4.700 4.230 5.170 3.376 2.062 5.208 2.168 17 15 "[** ** ** 1*-**.*+***]" 1
43 1 5 GLN QE 1 57 PHE QE 5.500 4.950 6.050 3.691 2.293 5.151 2.657 10 17 "[ ***-****+** ******]" 1
44 1 5 GLN QG 1 6 LYS H . 4.950 5.290 4.043 2.938 4.515 2.012 9 19 "[*** ****+**********-]" 1
45 1 5 GLN QG 1 6 LYS HA 4.630 4.170 5.090 3.922 3.716 4.191 0.454 15 0 "[ . 1 . 2]" 1
46 1 5 GLN QG 1 15 PHE QE 5.290 4.760 5.430 4.606 4.228 4.963 0.532 9 1 "[ . +1 . 2]" 1
47 1 5 GLN QG 1 40 SER QB 5.500 4.950 6.020 4.056 3.581 4.376 1.369 6 20 [****-+**************] 1
48 1 5 GLN QG 1 42 LYS QG 5.500 4.950 6.050 4.426 4.120 5.093 0.830 8 13 "[* -* *+*1 ** *** **]" 1
49 1 6 LYS H 1 6 LYS QB 3.550 3.200 3.900 3.250 3.002 3.556 0.198 4 0 "[ . 1 . 2]" 1
50 1 6 LYS H 1 6 LYS QD 3.540 3.190 3.890 2.296 1.833 3.119 1.357 4 14 "[-**+.*** * *.*****]" 1
51 1 6 LYS H 1 6 LYS QG 4.140 3.730 4.550 3.173 2.173 4.063 1.557 14 7 "[-** . ** +. *]" 1
52 1 6 LYS H 1 39 ILE HB 5.500 4.950 6.050 4.647 4.211 4.963 0.739 1 2 "[+ . 1 . - 2]" 1
53 1 6 LYS H 1 39 ILE MG 4.990 4.490 5.490 4.802 4.553 5.278 . 0 0 "[ . 1 . 2]" 1
54 1 6 LYS H 1 40 SER HA 5.260 4.730 5.790 4.693 4.485 5.381 0.245 20 0 "[ . 1 . 2]" 1
55 1 6 LYS H 1 40 SER QB 4.850 4.370 5.240 3.638 3.088 4.022 1.282 12 16 "[* ***-**1*+*******2]" 1
56 1 6 LYS HA 1 6 LYS QD 4.100 3.690 4.510 3.658 3.527 3.791 0.163 6 0 "[ . 1 . 2]" 1
57 1 6 LYS HA 1 6 LYS QG 4.020 3.620 4.420 3.538 3.393 3.678 0.227 11 0 "[ . 1 . 2]" 1
58 1 6 LYS HA 1 7 GLU H 2.700 2.430 2.970 2.166 2.067 2.267 0.363 16 0 "[ . 1 . 2]" 1
59 1 6 LYS HA 1 7 GLU QG . 4.950 5.250 4.032 3.791 4.573 1.159 17 18 "[******* **-**** +***]" 1
60 1 6 LYS HA 1 39 ILE MD 5.500 4.950 6.050 6.262 6.089 6.509 0.459 13 0 "[ . 1 . 2]" 1
61 1 6 LYS HA 1 39 ILE MG 5.500 4.950 6.050 6.193 6.100 6.331 0.281 11 0 "[ . 1 . 2]" 1
62 1 6 LYS QB 1 6 LYS QD 2.450 2.200 2.700 2.408 2.229 2.544 . 0 0 "[ . 1 . 2]" 1
63 1 6 LYS QB 1 7 GLU H 4.170 3.750 4.590 3.581 3.379 3.710 0.371 9 0 "[ . 1 . 2]" 1
64 1 6 LYS QB 1 7 GLU QG 5.500 4.950 6.050 4.960 4.714 5.270 0.236 15 0 "[ . 1 . 2]" 1
65 1 6 LYS QB 1 39 ILE MD 5.500 4.950 6.050 5.373 4.942 5.804 0.008 20 0 "[ . 1 . 2]" 1
66 1 6 LYS QB 1 39 ILE MG 4.380 3.940 4.820 4.985 4.658 5.320 0.500 6 1 "[ .+ 1 . 2]" 1
67 1 6 LYS QD 1 7 GLU H 4.350 3.910 4.790 4.587 4.413 4.750 . 0 0 "[ . 1 . 2]" 1
68 1 6 LYS QD 1 7 GLU QG 5.500 4.950 6.050 6.053 5.851 6.671 0.621 8 1 "[ . + 1 . 2]" 1
69 1 6 LYS QD 1 39 ILE HA 5.500 4.950 6.050 5.401 5.091 5.764 . 0 0 "[ . 1 . 2]" 1
70 1 6 LYS QD 1 39 ILE HB 4.050 3.640 4.460 3.606 3.288 3.984 0.352 5 0 "[ . 1 . 2]" 1
71 1 6 LYS QD 1 39 ILE MD 5.170 4.650 5.690 4.127 3.617 4.748 1.033 11 11 "[*** * **+*-*. *]" 1
72 1 6 LYS QD 1 39 ILE MG 3.960 3.560 4.360 3.005 2.650 3.381 0.910 2 11 "[*+* * -*****. *]" 1
73 1 6 LYS QD 1 40 SER HA 4.760 4.280 5.240 4.836 4.454 5.340 0.100 11 0 "[ . 1 . 2]" 1
74 1 6 LYS QD 1 40 SER QB 4.690 4.380 5.160 4.602 4.037 4.906 0.343 9 0 "[ . 1 . 2]" 1
75 1 6 LYS QE 1 39 ILE HA 4.620 4.160 5.080 4.718 4.269 5.094 0.014 15 0 "[ . 1 . 2]" 1
76 1 6 LYS QE 1 39 ILE MD 4.780 4.300 5.260 4.479 4.207 4.965 0.093 7 0 "[ . 1 . 2]" 1
77 1 6 LYS QE 1 39 ILE MG 4.530 4.080 4.980 2.493 2.046 2.974 2.034 13 20 [************+******-] 1
78 1 6 LYS QG 1 7 GLU H 4.730 4.260 5.200 4.859 4.423 5.138 . 0 0 "[ . 1 . 2]" 1
79 1 6 LYS QG 1 39 ILE MD 5.390 4.850 5.930 5.084 4.477 5.804 0.373 17 0 "[ . 1 . 2]" 1
80 1 6 LYS QG 1 39 ILE MG 3.870 3.480 4.260 4.122 3.575 4.496 0.236 10 0 "[ . 1 . 2]" 1
81 1 7 GLU H 1 7 GLU QB 3.680 3.310 4.050 2.787 2.340 3.048 0.970 16 8 "[ * *- * 1* * *+ 2]" 1
82 1 7 GLU H 1 7 GLU QG 4.260 3.830 4.270 2.292 1.964 2.946 1.866 18 20 [*******-*********+**] 1
83 1 7 GLU H 1 8 GLY H 5.140 4.630 5.650 4.677 4.570 4.805 0.060 9 0 "[ . 1 . 2]" 1
84 1 7 GLU H 1 39 ILE MD 5.500 4.950 6.050 5.620 5.421 5.908 . 0 0 "[ . 1 . 2]" 1
85 1 7 GLU H 1 39 ILE MG 5.500 4.950 6.050 6.298 6.137 6.467 0.417 11 0 "[ . 1 . 2]" 1
86 1 7 GLU H 1 40 SER QB 5.500 4.950 6.050 5.561 5.302 6.476 0.426 9 0 "[ . 1 . 2]" 1
87 1 7 GLU HA 1 7 GLU QG 4.100 3.690 4.410 3.389 3.299 3.492 0.391 20 0 "[ . 1 . 2]" 1
88 1 7 GLU HA 1 8 GLY H 3.400 3.060 3.740 2.661 2.224 2.795 0.836 7 1 "[ . + 1 . 2]" 1
89 1 7 GLU HA 1 8 GLY QA 4.690 4.220 5.160 3.852 3.751 3.930 0.469 19 0 "[ . 1 . 2]" 1
90 1 7 GLU HA 1 13 ASN QD 5.500 4.950 6.050 6.150 5.883 6.859 0.809 7 1 "[ . + 1 . 2]" 1
91 1 7 GLU HA 1 39 ILE MD 5.500 4.950 6.050 3.489 3.099 3.971 1.851 19 20 [***************-**+*] 1
92 1 7 GLU HA 1 59 SER QB 4.360 3.920 4.750 3.310 2.729 3.622 1.191 11 15 "[ *****- *+***** * *]" 1
93 1 7 GLU QB 1 8 GLY H . 3.890 4.290 2.168 2.002 2.609 1.888 2 20 [*+****-*************] 1
94 1 7 GLU QB 1 8 GLY QA 5.500 4.950 6.050 4.050 3.956 4.214 0.994 1 20 [+**************-****] 1
95 1 7 GLU QB 1 9 PRO QD 5.290 4.760 5.520 4.536 4.247 5.310 0.513 17 1 "[ . 1 . + 2]" 1
96 1 7 GLU QB 1 9 PRO QG 5.450 4.900 6.000 6.002 5.604 6.695 0.695 16 1 "[ . 1 .+ 2]" 1
97 1 7 GLU QB 1 12 ALA MB 4.080 3.670 4.490 4.352 3.918 4.682 0.192 4 0 "[ . 1 . 2]" 1
98 1 7 GLU QB 1 13 ASN QD 5.230 4.950 5.440 3.652 3.362 4.264 1.588 18 20 [******-**********+**] 1
99 1 7 GLU QB 1 39 ILE QG 5.500 4.950 6.050 5.652 5.343 5.913 . 0 0 "[ . 1 . 2]" 1
100 1 7 GLU QG 1 8 GLY H 5.240 4.720 5.540 3.747 3.105 4.405 1.615 11 19 "[-***** ***+*********]" 1
101 1 7 GLU QG 1 13 ASN QB 5.060 4.550 5.570 3.838 3.103 4.756 1.447 1 11 "[+ *-.** * * * ***2]" 1
102 1 7 GLU QG 1 13 ASN QD 5.500 4.950 6.050 3.400 2.937 3.957 2.013 9 20 [********+*-*********] 1
103 1 7 GLU QG 1 39 ILE MD 5.500 4.950 6.050 5.892 5.749 6.152 0.102 15 0 "[ . 1 . 2]" 1
104 1 7 GLU QG 1 59 SER QB 5.500 4.950 6.050 4.552 4.054 4.991 0.896 18 11 "[* - . * ** * ** *+*2]" 1
105 1 8 GLY H 1 12 ALA MB 5.500 4.950 6.050 4.349 4.069 4.654 0.881 16 14 "[* **** - ** **+* **]" 1
106 1 8 GLY H 1 13 ASN QD . 4.650 5.080 5.451 4.785 6.981 1.901 7 6 "[* .*+ 1* * - 2]" 1
107 1 8 GLY H 1 39 ILE MD 4.780 4.300 5.260 3.935 2.798 4.178 1.502 7 1 "[ . + 1 . 2]" 1
108 1 8 GLY H 1 39 ILE QG 5.500 4.950 6.050 5.498 4.746 5.790 0.204 7 0 "[ . 1 . 2]" 1
109 1 8 GLY H 1 39 ILE MG 5.500 4.950 6.050 6.108 5.084 6.249 0.199 2 0 "[ . 1 . 2]" 1
110 1 8 GLY H 1 59 SER QB 4.470 4.020 4.920 4.460 3.955 4.979 0.065 16 0 "[ . 1 . 2]" 1
111 1 8 GLY QA 1 9 PRO QG 5.500 4.950 6.050 4.104 4.038 4.152 0.912 7 20 [******+****-********] 1
112 1 8 GLY QA 1 12 ALA MB 5.320 4.790 5.850 5.058 4.518 5.320 0.272 16 0 "[ . 1 . 2]" 1
113 1 8 GLY QA 1 39 ILE MD 4.010 4.000 4.410 3.283 3.071 3.397 0.929 4 20 [***+****-***********] 1
114 1 8 GLY QA 1 39 ILE QG 5.150 4.630 5.670 5.133 4.746 5.362 . 0 0 "[ . 1 . 2]" 1
115 1 8 GLY QA 1 39 ILE MG 5.500 4.950 6.050 5.144 4.926 5.314 0.024 16 0 "[ . 1 . 2]" 1
116 1 8 GLY QA 1 61 ASP HA 5.000 4.500 5.500 4.478 4.276 4.763 0.224 20 0 "[ . 1 . 2]" 1
117 1 9 PRO HA 1 10 GLU H 2.860 2.570 3.150 2.323 2.270 2.422 0.300 11 0 "[ . 1 . 2]" 1
118 1 9 PRO HA 1 10 GLU HA 5.080 4.570 5.590 4.489 4.452 4.565 0.118 14 0 "[ . 1 . 2]" 1
119 1 9 PRO HA 1 10 GLU HB2 5.030 4.530 5.530 5.656 5.516 5.784 0.254 1 0 "[ . 1 . 2]" 1
120 1 9 PRO HA 1 10 GLU QG 5.200 4.680 5.720 4.655 3.968 5.280 0.712 1 2 "[+ - . 1 . 2]" 1
121 1 9 PRO HA 1 11 GLY H 5.040 4.540 5.540 5.699 5.495 5.957 0.417 13 0 "[ . 1 . 2]" 1
122 1 9 PRO HA 1 12 ALA MB 5.500 4.950 6.050 6.189 6.041 6.359 0.309 18 0 "[ . 1 . 2]" 1
123 1 9 PRO QB 1 10 GLU H 3.460 3.110 3.810 2.967 2.690 3.400 0.420 20 0 "[ . 1 . 2]" 1
124 1 9 PRO QB 1 10 GLU HA 5.500 4.950 6.050 4.642 4.503 4.750 0.447 18 0 "[ . 1 . 2]" 1
125 1 9 PRO QB 1 12 ALA MB 5.500 4.950 6.050 5.108 5.020 5.195 . 0 0 "[ . 1 . 2]" 1
126 1 9 PRO QD 1 10 GLU H 5.500 4.950 6.050 4.903 4.825 4.981 0.125 9 0 "[ . 1 . 2]" 1
127 1 9 PRO QD 1 39 ILE MD 5.500 4.950 5.530 4.113 4.021 4.246 0.929 7 20 [******+*********-***] 1
128 1 9 PRO QD 1 61 ASP H 5.500 4.950 6.050 5.774 5.677 5.910 . 0 0 "[ . 1 . 2]" 1
129 1 9 PRO QD 1 61 ASP HA 4.370 4.090 4.810 3.461 3.354 3.632 0.736 5 18 "[*** +******* **-****]" 1
130 1 9 PRO QD 1 61 ASP QB 5.500 4.950 6.050 4.781 4.612 4.888 0.338 16 0 "[ . 1 . 2]" 1
131 1 9 PRO QD 1 62 ASN H 5.500 4.950 6.050 5.250 5.147 5.365 . 0 0 "[ . 1 . 2]" 1
132 1 9 PRO QD 1 62 ASN HA 5.500 4.950 6.050 4.201 4.028 4.292 0.922 16 20 [*-*************+****] 1
133 1 9 PRO QD 1 62 ASN QB 5.500 4.950 6.050 4.952 4.691 5.306 0.259 7 0 "[ . 1 . 2]" 1
134 1 9 PRO QD 1 63 PRO QD 4.730 4.260 5.200 4.369 4.179 4.496 0.081 14 0 "[ . 1 . 2]" 1
135 1 9 PRO QG 1 10 GLU H 5.280 4.750 5.810 4.232 3.968 4.598 0.782 20 10 "[- ** **1 ** * *+]" 1
136 1 9 PRO QG 1 10 GLU QG 5.500 4.950 6.050 4.832 4.590 4.955 0.360 3 0 "[ . 1 . 2]" 1
137 1 9 PRO QG 1 11 GLY H . 4.950 5.210 4.650 4.436 5.097 0.514 15 1 "[ . 1 + 2]" 1
138 1 9 PRO QG 1 12 ALA H 5.360 4.820 5.750 3.499 2.872 4.284 1.948 12 20 [********-**+********] 1
139 1 9 PRO QG 1 12 ALA HA 5.250 4.720 5.780 5.682 5.312 5.901 0.121 7 0 "[ . 1 . 2]" 1
140 1 9 PRO QG 1 12 ALA MB 3.930 3.790 4.320 3.493 3.380 3.561 0.410 4 0 "[ . 1 . 2]" 1
141 1 9 PRO QG 1 39 ILE MD 5.500 4.950 6.050 5.664 5.565 5.813 . 0 0 "[ . 1 . 2]" 1
142 1 9 PRO QG 1 61 ASP HA 5.450 4.950 6.000 4.515 4.412 4.705 0.538 5 3 "[ + -1* . 2]" 1
143 1 9 PRO QG 1 62 ASN H 5.500 4.950 6.050 5.198 4.940 5.336 0.010 15 0 "[ . 1 . 2]" 1
144 1 9 PRO QG 1 62 ASN HA 4.240 4.180 4.660 3.274 2.990 3.437 1.190 15 20 [*************-+*****] 1
145 1 9 PRO QG 1 62 ASN QB 4.160 3.740 4.580 3.972 3.541 4.395 0.199 15 0 "[ . 1 . 2]" 1
146 1 9 PRO QG 1 63 PRO HA 5.500 4.950 5.750 5.632 5.392 5.780 0.030 7 0 "[ . 1 . 2]" 1
147 1 9 PRO QG 1 63 PRO QB 4.500 4.050 4.950 5.224 4.849 5.456 0.506 18 1 "[ . 1 . + 2]" 1
148 1 10 GLU H 1 10 GLU HB2 2.950 2.650 3.250 3.392 3.247 3.494 0.244 1 0 "[ . 1 . 2]" 1
149 1 10 GLU H 1 10 GLU QG 3.980 3.600 4.380 2.952 2.133 3.228 1.467 1 14 "[+ *******1*- **** 2]" 1
150 1 10 GLU H 1 11 GLY H 4.760 4.280 5.240 4.403 4.308 4.550 . 0 0 "[ . 1 . 2]" 1
151 1 10 GLU H 1 13 ASN QD 5.500 4.950 6.050 6.477 5.669 7.071 1.021 15 9 "[* .-* *1* *+** 2]" 1
152 1 10 GLU H 1 63 PRO QG 5.500 4.950 6.050 6.792 6.396 7.457 1.407 12 10 "[ ***. * *-+* .* * 2]" 1
153 1 10 GLU HA 1 10 GLU QG 3.890 3.590 4.280 3.504 3.422 3.553 0.168 1 0 "[ . 1 . 2]" 1
154 1 10 GLU HA 1 11 GLY H 3.090 2.780 3.400 2.248 2.121 2.341 0.659 20 11 "[ *- * * ** *.** *+]" 1
155 1 10 GLU HA 1 11 GLY QA 4.390 3.950 4.830 3.906 3.867 3.965 0.083 15 0 "[ . 1 . 2]" 1
156 1 10 GLU HA 1 12 ALA H 4.070 3.660 4.480 4.415 3.959 4.701 0.221 3 0 "[ . 1 . 2]" 1
157 1 10 GLU HA 1 12 ALA MB 5.500 4.950 6.050 5.874 5.557 6.034 . 0 0 "[ . 1 . 2]" 1
158 1 10 GLU HA 1 13 ASN QD 5.100 4.590 5.560 4.489 3.998 4.890 0.592 12 1 "[ . 1 + . 2]" 1
159 1 10 GLU HB2 1 11 GLY H 4.580 4.120 5.040 3.901 3.783 4.023 0.337 11 0 "[ . 1 . 2]" 1
160 1 10 GLU HB3 1 11 GLY H 4.500 4.050 4.950 4.614 4.510 4.681 . 0 0 "[ . 1 . 2]" 1
161 1 10 GLU HB3 1 11 GLY QA 5.390 4.850 5.930 5.310 5.209 5.410 . 0 0 "[ . 1 . 2]" 1
162 1 10 GLU QG 1 11 GLY H 4.170 3.750 4.590 4.348 4.026 4.508 . 0 0 "[ . 1 . 2]" 1
163 1 10 GLU QG 1 11 GLY QA 5.040 4.540 5.540 3.942 3.764 4.075 0.776 18 17 "[*** ** *** *-****+**]" 1
164 1 11 GLY H 1 12 ALA H 3.720 3.350 4.090 2.741 1.862 3.164 1.488 15 7 "[* .** *1 *+- 2]" 1
165 1 11 GLY H 1 12 ALA MB 5.500 4.950 6.050 4.544 3.994 4.860 0.956 15 6 "[* .** *1 -+ 2]" 1
166 1 11 GLY H 1 13 ASN H 4.940 4.450 5.430 5.166 4.868 5.442 0.012 5 0 "[ . 1 . 2]" 1
167 1 11 GLY H 1 13 ASN QD 5.500 4.950 6.050 3.916 3.273 4.444 1.677 5 20 [****+*******-*******] 1
168 1 11 GLY H 1 63 PRO QD 4.330 3.900 4.760 5.087 4.594 5.558 0.798 4 5 "[ - +. 1 * *. * 2]" 1
169 1 11 GLY QA 1 12 ALA HA 5.500 4.950 6.050 4.023 3.883 4.146 1.067 19 20 [******-***********+*] 1
170 1 11 GLY QA 1 13 ASN H 5.500 4.950 5.840 5.019 4.870 5.366 0.080 15 0 "[ . 1 . 2]" 1
171 1 11 GLY QA 1 63 PRO QB . 4.750 4.790 2.875 2.627 3.126 2.123 13 20 [***-********+*******] 1
172 1 12 ALA H 1 12 ALA MB 3.460 3.110 3.810 2.307 2.059 2.680 1.051 20 19 "[********-**** *****+]" 1
173 1 12 ALA H 1 13 ASN H 3.350 3.010 3.690 4.111 3.785 4.276 0.586 8 10 "[ **** + -* . * **]" 1
174 1 12 ALA H 1 13 ASN QB 5.110 4.600 5.620 5.161 4.509 5.494 0.091 14 0 "[ . 1 . 2]" 1
175 1 12 ALA H 1 13 ASN QD 4.920 4.520 5.410 4.490 3.940 4.882 0.580 18 1 "[ . 1 . + 2]" 1
176 1 12 ALA H 1 63 PRO HA 5.020 4.520 5.520 4.920 4.515 5.391 0.005 8 0 "[ . 1 . 2]" 1
177 1 12 ALA H 1 63 PRO QB 5.500 4.950 5.810 4.750 4.548 5.314 0.402 17 0 "[ . 1 . 2]" 1
178 1 12 ALA H 1 63 PRO QG 5.500 4.950 6.050 5.057 4.814 5.598 0.136 8 0 "[ . 1 . 2]" 1
179 1 12 ALA H 1 66 ALA MB 5.240 4.720 5.760 5.544 5.337 5.722 . 0 0 "[ . 1 . 2]" 1
180 1 12 ALA HA 1 13 ASN HA 5.500 4.950 6.050 4.455 4.236 4.557 0.714 16 7 "[ *-*. 1 ** *+ 2]" 1
181 1 12 ALA HA 1 13 ASN QD 5.440 4.900 5.980 5.306 4.765 5.571 0.135 5 0 "[ . 1 . 2]" 1
182 1 12 ALA HA 1 14 LEU QD 5.460 4.910 6.010 4.024 3.382 5.696 1.528 3 15 "[-*+ ******** * * **]" 1
183 1 12 ALA HA 1 59 SER HA 5.440 4.900 5.980 6.146 5.949 6.319 0.339 2 0 "[ . 1 . 2]" 1
184 1 12 ALA HA 1 60 TYR QB 5.410 4.870 5.950 4.804 4.595 5.038 0.275 9 0 "[ . 1 . 2]" 1
185 1 12 ALA HA 1 60 TYR QD 5.340 4.810 5.870 5.402 5.222 5.725 . 0 0 "[ . 1 . 2]" 1
186 1 12 ALA HA 1 62 ASN HA 5.320 4.790 5.850 6.030 5.818 6.441 0.591 14 1 "[ . 1 +. 2]" 1
187 1 12 ALA HA 1 63 PRO HA 3.590 3.230 3.950 3.833 3.735 3.917 . 0 0 "[ . 1 . 2]" 1
188 1 12 ALA HA 1 63 PRO QB . 4.950 5.200 4.523 4.249 4.702 0.701 13 5 "[ . * 1 +-** 2]" 1
189 1 12 ALA HA 1 63 PRO QG 5.180 4.660 5.700 5.758 5.609 5.852 0.152 5 0 "[ . 1 . 2]" 1
190 1 12 ALA HA 1 66 ALA H 4.890 4.400 5.380 5.328 5.117 5.507 0.127 7 0 "[ . 1 . 2]" 1
191 1 12 ALA HA 1 66 ALA HA 5.060 4.550 5.570 5.704 5.592 5.886 0.316 7 0 "[ . 1 . 2]" 1
192 1 12 ALA HA 1 66 ALA MB 3.500 3.150 3.850 3.186 3.073 3.304 0.077 8 0 "[ . 1 . 2]" 1
193 1 12 ALA HA 1 67 GLN H 5.500 4.950 6.050 7.142 6.861 7.315 1.265 2 20 [*+*****-************] 1
194 1 12 ALA MB 1 13 ASN H 4.610 4.150 5.070 3.634 3.530 3.706 0.620 5 9 "[ -*+ **1** *. * 2]" 1
195 1 12 ALA MB 1 13 ASN HA 5.500 4.950 6.050 3.978 3.692 4.252 1.258 16 20 [********-******+****] 1
196 1 12 ALA MB 1 13 ASN QD 5.500 4.950 6.050 4.880 4.423 5.281 0.527 19 1 "[ . 1 . +2]" 1
197 1 12 ALA MB 1 14 LEU QD 5.500 4.950 6.050 3.874 3.342 5.541 1.608 12 17 "[*** *******+* * *-**]" 1
198 1 12 ALA MB 1 59 SER HA 5.500 4.950 6.050 4.434 4.307 4.622 0.643 17 11 "[ *** -* * **** + 2]" 1
199 1 12 ALA MB 1 59 SER QB 5.460 4.910 6.010 4.303 3.786 4.577 1.124 16 13 "[ * ***** 1 *-*+* **]" 1
200 1 12 ALA MB 1 60 TYR H 4.470 4.020 4.920 2.875 2.728 3.052 1.292 5 20 [****+************-**] 1
201 1 12 ALA MB 1 60 TYR HA 5.500 4.950 6.050 4.629 4.499 4.736 0.451 5 0 "[ . 1 . 2]" 1
202 1 12 ALA MB 1 60 TYR QB . 4.370 4.540 2.796 2.672 2.988 1.698 5 20 [****+**********-****] 1
203 1 12 ALA MB 1 60 TYR QD 4.430 3.990 4.870 3.919 3.796 4.128 0.194 12 0 "[ . 1 . 2]" 1
204 1 12 ALA MB 1 61 ASP H 5.130 4.620 5.640 4.632 4.494 4.807 0.126 19 0 "[ . 1 . 2]" 1
205 1 12 ALA MB 1 61 ASP HA 5.500 4.950 6.050 4.124 3.834 4.575 1.116 1 18 "[+**-******** *.*****]" 1
206 1 12 ALA MB 1 62 ASN H 4.310 3.880 4.740 3.645 3.511 3.800 0.369 18 0 "[ . 1 . 2]" 1
207 1 12 ALA MB 1 62 ASN HA 5.170 4.650 5.690 3.521 3.308 3.911 1.342 13 20 [************+-******] 1
208 1 12 ALA MB 1 62 ASN QB 5.500 4.950 6.050 4.843 4.662 5.143 0.288 13 0 "[ . 1 . 2]" 1
209 1 12 ALA MB 1 62 ASN HD21 5.500 4.950 6.050 5.358 5.053 6.140 0.090 17 0 "[ . 1 . 2]" 1
210 1 12 ALA MB 1 63 PRO HA 3.820 3.440 4.200 3.374 3.282 3.503 0.158 12 0 "[ . 1 . 2]" 1
211 1 12 ALA MB 1 63 PRO QB 5.060 4.780 5.570 4.199 4.019 4.338 0.761 14 15 "[ ****** **-**+*** 2]" 1
212 1 12 ALA MB 1 63 PRO QD 5.500 4.950 5.670 3.092 2.967 3.184 1.983 6 20 [***-*+**************] 1
213 1 12 ALA MB 1 63 PRO QG 5.290 4.760 5.820 4.665 4.548 4.736 0.212 6 0 "[ . 1 . 2]" 1
214 1 12 ALA MB 1 64 VAL H 5.500 4.950 6.050 5.566 5.351 5.772 . 0 0 "[ . 1 . 2]" 1
215 1 12 ALA MB 1 66 ALA H 5.500 4.950 6.050 4.617 4.211 4.809 0.739 13 2 "[ . 1 -+ . 2]" 1
216 1 12 ALA MB 1 66 ALA HA 5.500 4.950 6.050 5.233 4.858 5.375 0.092 13 0 "[ . 1 . 2]" 1
217 1 12 ALA MB 1 66 ALA MB 4.080 3.670 4.490 3.405 2.961 3.559 0.709 13 1 "[ . 1 + . 2]" 1
218 1 13 ASN H 1 13 ASN QB 3.720 3.690 4.090 3.283 2.612 3.424 1.078 14 2 "[ . -1 +. 2]" 1
219 1 13 ASN H 1 13 ASN QD 4.490 4.200 4.940 3.912 3.611 4.246 0.589 18 4 "[ * * - . + 2]" 1
220 1 13 ASN H 1 14 LEU H 5.300 4.770 5.830 4.239 4.035 4.423 0.735 5 12 "[ ***+* ***- *. * *]" 1
221 1 13 ASN H 1 14 LEU QD 5.500 4.950 6.050 3.580 2.908 4.790 2.042 5 15 "[-** +******* * * **]" 1
222 1 13 ASN H 1 63 PRO HA 5.500 4.950 6.050 6.179 5.906 6.336 0.286 10 0 "[ . 1 . 2]" 1
223 1 13 ASN H 1 66 ALA MB 5.370 4.830 5.910 4.199 3.664 4.480 1.166 14 12 "[* *** **1* +. *-**]" 1
224 1 13 ASN HA 1 14 LEU H 3.410 3.070 3.750 2.321 2.226 2.557 0.844 3 20 [**+**************-**] 1
225 1 13 ASN HA 1 14 LEU HA 5.500 4.950 6.050 4.540 4.494 4.579 0.456 3 0 "[ . 1 . 2]" 1
226 1 13 ASN HA 1 14 LEU QB 4.890 4.400 5.380 4.399 4.151 4.879 0.249 4 0 "[ . 1 . 2]" 1
227 1 13 ASN HA 1 14 LEU QD 5.500 4.950 6.050 3.453 2.944 5.041 2.006 20 17 "[*** ********* * *-*+]" 1
228 1 13 ASN HA 1 15 PHE QE 5.140 4.630 5.650 4.912 4.653 5.365 . 0 0 "[ . 1 . 2]" 1
229 1 13 ASN HA 1 58 VAL H 5.500 4.950 6.050 6.046 5.489 6.301 0.251 3 0 "[ . 1 . 2]" 1
230 1 13 ASN HA 1 58 VAL QG 5.500 4.950 6.050 5.999 5.792 6.332 0.282 16 0 "[ . 1 . 2]" 1
231 1 13 ASN HA 1 59 SER H 5.500 4.950 6.050 5.883 5.600 6.091 0.041 2 0 "[ . 1 . 2]" 1
232 1 13 ASN HA 1 59 SER QB 5.330 4.950 5.860 3.592 3.097 4.111 1.853 5 20 [****+*********-*****] 1
233 1 13 ASN HA 1 60 TYR H 4.710 4.240 5.180 4.205 4.022 4.374 0.218 12 0 "[ . 1 . 2]" 1
234 1 13 ASN QB 1 14 LEU H . 4.720 5.220 3.688 3.610 3.774 1.110 9 20 [********+********-**] 1
235 1 13 ASN QB 1 14 LEU QD 5.500 4.950 6.050 4.389 4.061 5.260 0.889 9 14 "[ ** ****+*-* * * **]" 1
236 1 13 ASN QB 1 15 PHE QE 5.310 4.780 5.350 3.940 3.719 4.204 1.061 10 20 [*********+***-******] 1
237 1 13 ASN QB 1 59 SER HA 5.470 4.920 6.020 4.682 4.232 5.272 0.688 12 3 "[ . 1 +- . * 2]" 1
238 1 14 LEU H 1 14 LEU QB 3.830 3.450 4.210 2.369 2.037 3.166 1.413 16 17 "[ *********** **+- **]" 1
239 1 14 LEU H 1 14 LEU QD 4.960 4.460 5.460 2.355 1.824 3.735 2.636 18 20 [*************-***+**] 1
240 1 14 LEU H 1 14 LEU HG 4.380 3.940 4.820 4.133 3.603 4.448 0.337 4 0 "[ . 1 . 2]" 1
241 1 14 LEU H 1 15 PHE H 5.480 4.930 6.030 4.581 4.461 4.695 0.469 3 0 "[ . 1 . 2]" 1
242 1 14 LEU H 1 15 PHE HA 5.500 4.950 6.050 5.053 4.929 5.219 0.021 20 0 "[ . 1 . 2]" 1
243 1 14 LEU H 1 15 PHE QD 5.500 4.950 6.050 4.625 4.141 4.793 0.809 11 1 "[ . 1+ . 2]" 1
244 1 14 LEU H 1 58 VAL H 4.430 3.990 4.870 4.455 4.142 4.761 . 0 0 "[ . 1 . 2]" 1
245 1 14 LEU H 1 58 VAL QG 5.500 4.950 6.000 4.565 4.385 4.956 0.565 14 3 "[- *. 1 +. 2]" 1
246 1 14 LEU H 1 59 SER HA 4.710 4.240 5.180 3.184 2.715 3.501 1.525 16 20 [***************+*-**] 1
247 1 14 LEU H 1 60 TYR H 5.240 4.720 5.760 4.660 4.494 5.081 0.226 16 0 "[ . 1 . 2]" 1
248 1 14 LEU HA 1 14 LEU QD 3.680 3.310 4.050 2.259 1.954 3.340 1.356 16 17 "[ *********** **+- **]" 1
249 1 14 LEU HA 1 15 PHE H 3.300 2.970 3.630 2.549 2.489 2.624 0.481 13 0 "[ . 1 . 2]" 1
250 1 14 LEU HA 1 15 PHE HA 5.500 4.950 6.050 4.578 4.534 4.618 0.416 6 0 "[ . 1 . 2]" 1
251 1 14 LEU HA 1 15 PHE HB2 5.500 4.950 6.050 5.382 5.078 5.541 . 0 0 "[ . 1 . 2]" 1
252 1 14 LEU HA 1 15 PHE QD 5.500 4.950 6.050 5.001 4.816 5.136 0.134 1 0 "[ . 1 . 2]" 1
253 1 14 LEU HA 1 58 VAL QG 5.500 4.950 6.050 5.396 4.927 5.749 0.023 4 0 "[ . 1 . 2]" 1
254 1 14 LEU HA 1 70 ILE MD 5.500 4.950 6.050 4.911 4.681 5.078 0.269 1 0 "[ . 1 . 2]" 1
255 1 14 LEU HA 1 70 ILE QG 5.500 4.950 6.050 5.325 5.000 6.080 0.030 1 0 "[ . 1 . 2]" 1
256 1 14 LEU QB 1 15 PHE H . 4.340 4.630 3.592 3.199 3.869 1.141 1 18 "[+**-********* * ****]" 1
257 1 14 LEU QB 1 16 ILE MD 5.120 4.610 5.630 3.323 2.968 4.140 1.642 14 19 "[-*********** +******]" 1
258 1 14 LEU QB 1 32 PHE QD 5.500 4.950 6.050 5.186 4.627 6.613 0.563 18 1 "[ . 1 . + 2]" 1
259 1 14 LEU QB 1 58 VAL H 4.980 4.480 5.480 4.208 3.722 5.533 0.758 12 11 "[ **.*-*** + * * *2]" 1
260 1 14 LEU QB 1 58 VAL QG 4.540 4.090 4.990 3.377 2.649 4.480 1.441 4 16 "[ **+**-***** ** * **]" 1
261 1 14 LEU QB 1 59 SER HA 5.500 4.950 6.050 4.409 3.547 5.948 1.403 16 16 "[ ****-***** **+* **]" 1
262 1 14 LEU QB 1 85 VAL HA 5.500 4.950 6.050 5.355 4.839 6.086 0.111 1 0 "[ . 1 . 2]" 1
263 1 14 LEU QB 1 85 VAL QG . 4.440 4.750 2.922 2.322 3.530 2.118 13 20 [***-********+*******] 1
264 1 14 LEU QD 1 15 PHE H 4.270 3.840 4.700 3.865 3.487 4.100 0.353 16 0 "[ . 1 . 2]" 1
265 1 14 LEU QD 1 32 PHE QD 3.930 3.540 4.320 4.345 3.227 4.988 0.668 20 4 "[ * . * 1- . +]" 1
266 1 14 LEU QD 1 32 PHE QE 5.500 4.950 6.050 3.681 2.057 4.500 2.893 16 18 "[* ********-****+***2]" 1
267 1 14 LEU QD 1 58 VAL QG 5.400 4.860 5.940 3.596 1.927 4.172 2.933 13 20 [******-*****+*******] 1
268 1 14 LEU QD 1 59 SER H 5.500 4.950 6.050 5.312 4.286 6.284 0.664 1 1 "[+ . 1 . 2]" 1
269 1 14 LEU QD 1 59 SER HA 5.500 4.950 6.050 3.713 3.151 5.448 1.799 13 17 "[*** ****-***+ * ****]" 1
270 1 14 LEU QD 1 59 SER QB 5.500 4.950 6.050 4.907 4.383 6.316 0.567 3 5 "[* + . - 1 * . * 2]" 1
271 1 14 LEU QD 1 60 TYR QB 5.500 4.950 6.050 3.882 3.510 5.223 1.440 12 17 "[*** *******+- * ****]" 1
272 1 14 LEU QD 1 60 TYR QD 3.550 3.200 3.900 2.603 2.163 3.863 1.037 9 17 "[*** ****+**** * ***-]" 1
273 1 14 LEU QD 1 60 TYR QE 2.960 2.660 3.260 2.666 2.436 3.039 0.224 13 0 "[ . 1 . 2]" 1
274 1 14 LEU QD 1 66 ALA H 5.500 4.950 6.050 4.687 4.162 5.609 0.788 11 6 "[ * * *1+* - 2]" 1
275 1 14 LEU QD 1 66 ALA HA 4.000 3.600 4.400 3.009 2.391 3.603 1.209 11 13 "[ * **-***+* * * **]" 1
276 1 14 LEU QD 1 66 ALA MB 3.660 3.290 4.030 2.363 1.973 3.375 1.317 20 14 "[ ** ****-*** * * *+]" 1
277 1 14 LEU QD 1 67 GLN H 5.500 4.950 6.050 5.379 4.935 6.440 0.390 18 0 "[ . 1 . 2]" 1
278 1 14 LEU QD 1 67 GLN HA 5.350 4.810 5.890 5.453 5.062 7.114 1.224 18 2 "[- . 1 . + 2]" 1
279 1 14 LEU QD 1 69 ALA H 5.220 4.700 5.740 5.017 4.438 5.403 0.262 16 0 "[ . 1 . 2]" 1
280 1 14 LEU QD 1 70 ILE H 4.960 4.460 5.460 4.437 3.686 5.490 0.774 16 3 "[ *. 1 -.+ 2]" 1
281 1 14 LEU QD 1 70 ILE HA 5.490 4.940 6.040 4.568 3.421 5.354 1.519 16 3 "[ -. 1 *.+ 2]" 1
282 1 14 LEU QD 1 85 VAL HA 5.500 4.950 6.050 5.263 4.271 5.669 0.679 14 2 "[ . 1 +.- 2]" 1
283 1 14 LEU QD 1 85 VAL QG 3.420 3.080 3.760 2.569 1.851 2.837 1.229 14 6 "[ *. *1 * +.* - 2]" 1
284 1 14 LEU QD 1 86 GLN H 5.500 4.950 6.050 4.707 3.669 4.881 1.281 16 1 "[ . 1 .+ 2]" 1
285 1 14 LEU QD 1 86 GLN HA 5.180 4.660 5.700 5.286 4.747 6.169 0.469 13 0 "[ . 1 . 2]" 1
286 1 14 LEU HG 1 15 PHE H 5.000 4.500 5.500 5.690 5.570 5.892 0.392 3 0 "[ . 1 . 2]" 1
287 1 14 LEU HG 1 32 PHE QD 4.700 4.230 5.170 5.421 5.133 5.641 0.471 16 0 "[ . 1 . 2]" 1
288 1 14 LEU HG 1 32 PHE QE 4.960 4.460 5.460 4.071 3.408 4.635 1.052 13 6 "[* . **1 + - *2]" 1
289 1 14 LEU HG 1 58 VAL QG 4.060 3.650 4.470 4.728 4.279 5.606 1.136 16 1 "[ . 1 .+ 2]" 1
290 1 14 LEU HG 1 60 TYR H 5.500 4.950 6.050 6.399 6.074 7.381 1.331 13 1 "[ . 1 + . 2]" 1
291 1 14 LEU HG 1 60 TYR QD 4.900 4.410 5.390 4.395 3.590 4.900 0.820 4 2 "[ +. 1 -. 2]" 1
292 1 14 LEU HG 1 60 TYR QE 3.780 3.400 4.160 3.743 3.387 4.166 0.013 4 0 "[ . 1 . 2]" 1
293 1 14 LEU HG 1 66 ALA HA 4.070 3.660 4.480 4.141 3.567 4.650 0.170 13 0 "[ . 1 . 2]" 1
294 1 14 LEU HG 1 69 ALA H 5.280 4.750 5.810 6.083 5.956 6.198 0.388 3 0 "[ . 1 . 2]" 1
295 1 14 LEU HG 1 69 ALA MB 3.080 2.770 3.390 3.504 3.277 3.777 0.387 16 0 "[ . 1 . 2]" 1
296 1 14 LEU HG 1 70 ILE H 5.210 4.690 5.730 5.359 4.858 5.808 0.078 14 0 "[ . 1 . 2]" 1
297 1 14 LEU HG 1 85 VAL QG . 3.540 3.890 3.513 3.144 4.273 0.396 13 0 "[ . 1 . 2]" 1
298 1 15 PHE H 1 15 PHE HB2 3.810 3.430 4.190 2.950 2.767 3.056 0.663 16 6 "[* . *- 1 *+ * 2]" 1
299 1 15 PHE H 1 15 PHE QD 4.380 3.940 4.820 3.763 3.681 3.851 0.259 12 0 "[ . 1 . 2]" 1
300 1 15 PHE H 1 16 ILE H 4.740 4.270 5.210 4.660 4.538 4.718 . 0 0 "[ . 1 . 2]" 1
301 1 15 PHE H 1 16 ILE MD 4.900 4.410 5.390 4.179 4.049 4.377 0.361 14 0 "[ . 1 . 2]" 1
302 1 15 PHE H 1 57 PHE HA 5.500 4.950 6.050 5.923 5.744 6.128 0.078 20 0 "[ . 1 . 2]" 1
303 1 15 PHE H 1 85 VAL QG 5.500 4.950 6.050 4.107 3.818 4.377 1.132 2 20 [*+-*****************] 1
304 1 15 PHE H 1 86 GLN QB 5.430 4.890 5.970 4.500 3.089 4.966 1.801 10 4 "[ .* + . * -]" 1
305 1 15 PHE HA 1 15 PHE QD 3.860 3.470 4.250 2.178 2.026 2.345 1.444 8 20 [*******+*-**********] 1
306 1 15 PHE HA 1 16 ILE H 3.340 3.010 3.670 2.622 2.566 2.682 0.444 6 0 "[ . 1 . 2]" 1
307 1 15 PHE HA 1 16 ILE HB 5.200 4.680 5.720 4.660 4.427 4.877 0.253 20 0 "[ . 1 . 2]" 1
308 1 15 PHE HA 1 16 ILE MD 4.890 4.400 5.380 2.677 2.475 2.875 1.925 11 20 [**********+******-**] 1
309 1 15 PHE HA 1 16 ILE QG 5.500 4.950 6.050 4.653 4.514 4.836 0.436 14 0 "[ . 1 . 2]" 1
310 1 15 PHE HA 1 28 ILE MD 5.500 4.950 6.050 5.644 5.335 5.919 . 0 0 "[ . 1 . 2]" 1
311 1 15 PHE HA 1 57 PHE HA 3.850 3.470 4.230 3.286 3.098 3.430 0.372 3 0 "[ . 1 . 2]" 1
312 1 15 PHE HA 1 57 PHE QD 5.390 4.850 5.930 5.338 4.802 5.649 0.048 16 0 "[ . 1 . 2]" 1
313 1 15 PHE HA 1 58 VAL H 4.760 4.280 5.240 3.261 2.974 3.834 1.306 1 19 "[+************ *****-]" 1
314 1 15 PHE HB2 1 16 ILE HA 5.500 4.950 6.050 5.202 5.081 5.366 . 0 0 "[ . 1 . 2]" 1
315 1 15 PHE HB2 1 86 GLN H 5.090 4.580 5.600 4.652 4.515 5.011 0.065 9 0 "[ . 1 . 2]" 1
316 1 15 PHE HB2 1 86 GLN QB 4.610 4.150 5.070 4.807 4.115 5.207 0.137 3 0 "[ . 1 . 2]" 1
317 1 15 PHE HB2 1 86 GLN QG 3.760 3.380 4.140 3.533 3.281 4.151 0.099 18 0 "[ . 1 . 2]" 1
318 1 15 PHE HB3 1 16 ILE HA 5.500 4.950 6.050 4.873 4.771 4.956 0.179 9 0 "[ . 1 . 2]" 1
319 1 15 PHE HB3 1 17 TYR QE 4.810 4.330 5.290 5.335 4.816 5.508 0.218 18 0 "[ . 1 . 2]" 1
320 1 15 PHE QD 1 16 ILE H 4.210 3.790 4.630 4.017 3.843 4.097 . 0 0 "[ . 1 . 2]" 1
321 1 15 PHE QD 1 17 TYR QE 5.300 4.770 5.830 5.473 5.068 5.929 0.099 8 0 "[ . 1 . 2]" 1
322 1 15 PHE QD 1 57 PHE HA 5.500 4.950 6.050 2.094 1.938 2.314 3.012 12 20 [**********-+********] 1
323 1 15 PHE QD 1 58 VAL H 5.500 4.950 6.050 2.660 2.019 3.148 2.931 11 20 [**-*******+*********] 1
324 1 15 PHE QD 1 86 GLN QB 5.500 4.950 6.050 5.649 4.914 6.087 0.037 14 0 "[ . 1 . 2]" 1
325 1 15 PHE QE 1 40 SER QB 4.800 4.320 5.210 5.031 4.549 6.208 0.998 9 1 "[ . +1 . 2]" 1
326 1 15 PHE QE 1 57 PHE QB 5.500 4.950 6.050 3.084 2.755 3.360 2.195 10 20 [********-+**********] 1
327 1 15 PHE QE 1 57 PHE QD 2.830 2.550 3.110 2.710 2.392 3.157 0.158 6 0 "[ . 1 . 2]" 1
328 1 15 PHE QE 1 57 PHE QE 3.360 3.020 3.700 3.685 3.421 3.864 0.164 17 0 "[ . 1 . 2]" 1
329 1 15 PHE QE 1 59 SER H 4.980 4.480 5.480 5.585 5.226 5.801 0.321 9 0 "[ . 1 . 2]" 1
330 1 15 PHE QE 1 59 SER QB 5.500 4.950 6.050 4.317 3.826 4.808 1.124 3 12 "[**+**- ** **.** 2]" 1
331 1 16 ILE H 1 16 ILE HB 4.000 3.600 4.400 2.919 2.790 3.169 0.810 20 19 "[**-************ ***+]" 1
332 1 16 ILE H 1 16 ILE MD 4.350 3.910 4.790 3.090 2.820 3.252 1.090 2 20 [*+-*****************] 1
333 1 16 ILE H 1 16 ILE QG 5.100 4.780 5.610 4.108 4.013 4.221 0.767 2 20 [*+-*****************] 1
334 1 16 ILE H 1 16 ILE MG 4.830 4.350 5.310 4.042 3.958 4.094 0.392 20 0 "[ . 1 . 2]" 1
335 1 16 ILE H 1 17 TYR H 5.500 4.950 6.050 4.361 4.206 4.456 0.744 14 19 "[* ***-*******+******]" 1
336 1 16 ILE H 1 28 ILE MD 5.260 4.730 5.790 5.627 5.327 5.802 0.012 16 0 "[ . 1 . 2]" 1
337 1 16 ILE H 1 56 GLY H 4.490 4.040 4.940 3.176 2.350 3.975 1.690 8 13 "[*- .**+*1 **** ***]" 1
338 1 16 ILE H 1 57 PHE HA 4.670 4.200 5.140 4.278 3.973 4.641 0.227 1 0 "[ . 1 . 2]" 1
339 1 16 ILE H 1 58 VAL QG 5.500 4.950 6.050 4.891 4.744 5.169 0.206 11 0 "[ . 1 . 2]" 1
340 1 16 ILE H 1 85 VAL QG 5.040 4.540 5.540 5.114 4.959 5.241 . 0 0 "[ . 1 . 2]" 1
341 1 16 ILE HA 1 16 ILE MD 4.590 4.130 5.050 2.731 2.507 3.029 1.623 8 20 [*-*****+************] 1
342 1 16 ILE HA 1 16 ILE MG 3.770 3.390 4.150 2.588 2.336 2.753 1.054 16 20 [*******-*******+****] 1
343 1 16 ILE HA 1 17 TYR H 3.270 2.940 3.600 2.501 2.457 2.539 0.483 16 0 "[ . 1 . 2]" 1
344 1 16 ILE HA 1 17 TYR QB 5.500 4.950 6.050 4.604 4.343 4.849 0.607 7 2 "[ . + 1 . - 2]" 1
345 1 16 ILE HA 1 17 TYR QD 5.500 4.950 6.050 4.707 4.565 4.919 0.385 20 0 "[ . 1 . 2]" 1
346 1 16 ILE HA 1 19 LEU QD 5.500 4.950 6.050 6.259 5.906 6.480 0.430 10 0 "[ . 1 . 2]" 1
347 1 16 ILE HA 1 84 LYS H 5.500 4.950 6.050 4.865 4.671 5.071 0.279 9 0 "[ . 1 . 2]" 1
348 1 16 ILE HA 1 85 VAL QG 5.010 4.510 5.510 3.276 3.080 3.512 1.430 2 20 [*+*******-**********] 1
349 1 16 ILE HA 1 86 GLN H 4.610 4.150 5.070 3.755 3.554 3.977 0.596 4 2 "[ +- 1 . 2]" 1
350 1 16 ILE HB 1 16 ILE MD 3.770 3.390 4.150 2.852 2.679 2.990 0.711 4 13 "[-* +** * *****. * *]" 1
351 1 16 ILE HB 1 17 TYR H 5.210 4.690 5.730 4.665 4.486 4.775 0.204 16 0 "[ . 1 . 2]" 1
352 1 16 ILE HB 1 18 HIS H 5.500 4.950 6.050 6.372 6.175 6.899 0.849 20 1 "[ . 1 . +]" 1
353 1 16 ILE HB 1 28 ILE MD 4.320 3.890 4.750 4.107 3.925 4.321 . 0 0 "[ . 1 . 2]" 1
354 1 16 ILE HB 1 32 PHE QE 5.500 4.950 6.050 6.247 6.059 6.370 0.320 18 0 "[ . 1 . 2]" 1
355 1 16 ILE HB 1 56 GLY H 4.420 3.980 4.860 2.694 2.357 2.983 1.623 14 20 [*************+*-****] 1
356 1 16 ILE HB 1 56 GLY QA 5.500 4.950 6.050 3.591 2.908 4.219 2.042 1 20 [+**-****************] 1
357 1 16 ILE HB 1 57 PHE HA 5.500 4.950 6.050 5.588 5.140 5.864 . 0 0 "[ . 1 . 2]" 1
358 1 16 ILE HB 1 83 LEU QD 3.940 3.550 4.330 4.376 4.256 4.484 0.154 15 0 "[ . 1 . 2]" 1
359 1 16 ILE MD 1 17 TYR H 5.500 4.950 6.050 4.895 4.693 5.136 0.257 7 0 "[ . 1 . 2]" 1
360 1 16 ILE MD 1 19 LEU QD 5.240 4.720 5.760 5.130 4.645 5.522 0.075 13 0 "[ . 1 . 2]" 1
361 1 16 ILE MD 1 28 ILE MD 3.860 3.470 4.250 3.145 2.418 3.514 1.052 2 3 "[ + -. 1 * . 2]" 1
362 1 16 ILE MD 1 28 ILE QG 4.160 3.740 4.580 4.340 3.943 4.634 0.054 3 0 "[ . 1 . 2]" 1
363 1 16 ILE MD 1 32 PHE QD 4.270 3.840 4.700 4.451 4.321 4.665 . 0 0 "[ . 1 . 2]" 1
364 1 16 ILE MD 1 32 PHE QE 4.080 3.670 4.490 3.406 3.226 3.722 0.444 15 0 "[ . 1 . 2]" 1
365 1 16 ILE MD 1 56 GLY H 5.130 4.620 5.640 4.530 4.336 4.999 0.284 6 0 "[ . 1 . 2]" 1
366 1 16 ILE MD 1 56 GLY QA 5.500 4.950 6.050 4.340 3.706 4.593 1.244 2 9 "[*+ ** 1*** - * 2]" 1
367 1 16 ILE MD 1 57 PHE H 5.320 4.790 5.850 4.903 4.546 5.117 0.244 2 0 "[ . 1 . 2]" 1
368 1 16 ILE MD 1 57 PHE HA 4.580 4.120 5.040 4.026 3.583 4.337 0.537 3 1 "[ + . 1 . 2]" 1
369 1 16 ILE MD 1 57 PHE QD 5.500 4.950 6.050 5.791 5.453 6.169 0.119 18 0 "[ . 1 . 2]" 1
370 1 16 ILE MD 1 58 VAL HA 5.500 4.950 6.050 4.962 4.864 5.097 0.086 3 0 "[ . 1 . 2]" 1
371 1 16 ILE MD 1 58 VAL HB 3.380 3.040 3.720 3.944 3.196 4.204 0.484 17 0 "[ . 1 . 2]" 1
372 1 16 ILE MD 1 73 MET QB 5.500 4.950 6.050 4.971 4.797 5.268 0.153 8 0 "[ . 1 . 2]" 1
373 1 16 ILE MD 1 83 LEU QB 5.500 4.950 6.050 6.226 6.055 6.382 0.332 3 0 "[ . 1 . 2]" 1
374 1 16 ILE MD 1 83 LEU HG 5.430 4.890 5.970 4.906 4.741 5.094 0.149 7 0 "[ . 1 . 2]" 1
375 1 16 ILE MD 1 85 VAL HA 5.500 4.950 6.050 3.909 3.446 4.554 1.504 10 19 "[* *-*****+**********]" 1
376 1 16 ILE MD 1 85 VAL QG 4.610 4.220 5.070 2.606 2.443 3.037 1.777 9 20 [*-******+***********] 1
377 1 16 ILE QG 1 16 ILE MG 2.960 2.660 3.260 2.032 1.976 2.093 0.684 2 20 [*+***************-**] 1
378 1 16 ILE QG 1 17 TYR H 5.500 4.950 6.050 4.760 4.578 4.932 0.372 2 0 "[ . 1 . 2]" 1
379 1 16 ILE QG 1 18 HIS H 5.500 4.950 6.050 7.168 7.044 7.341 1.291 20 20 [*******-***********+] 1
380 1 16 ILE QG 1 19 LEU QD 5.500 4.950 6.050 4.245 3.806 4.584 1.144 13 17 "[*- ** ******+******2]" 1
381 1 16 ILE QG 1 28 ILE MD 3.970 3.570 4.370 2.986 2.804 3.201 0.766 8 14 "[* - . *+*1* ********]" 1
382 1 16 ILE QG 1 28 ILE QG 4.770 4.290 4.870 4.045 3.818 4.294 0.472 18 0 "[ . 1 . 2]" 1
383 1 16 ILE QG 1 32 PHE QD 5.500 4.950 6.050 4.954 4.805 5.144 0.145 18 0 "[ . 1 . 2]" 1
384 1 16 ILE QG 1 32 PHE QE 5.110 4.600 5.370 3.661 3.501 3.778 1.099 16 20 [***********-***+****] 1
385 1 16 ILE QG 1 56 GLY H 5.500 4.950 6.050 4.599 4.362 4.843 0.588 14 2 "[ . - +. 2]" 1
386 1 16 ILE QG 1 56 GLY QA 5.500 4.950 6.050 4.555 3.889 5.296 1.061 1 3 "[+ . - 1 * . 2]" 1
387 1 16 ILE QG 1 73 MET QB 5.500 4.950 6.050 4.961 4.729 5.202 0.221 2 0 "[ . 1 . 2]" 1
388 1 16 ILE QG 1 83 LEU QD 3.190 2.870 3.510 2.710 2.609 3.147 0.261 18 0 "[ . 1 . 2]" 1
389 1 16 ILE QG 1 83 LEU HG 3.110 2.800 3.420 3.475 3.352 3.603 0.183 19 0 "[ . 1 . 2]" 1
390 1 16 ILE MG 1 17 TYR H 4.230 3.810 4.650 3.263 2.927 3.472 0.883 16 12 "[****** -1* * .+** 2]" 1
391 1 16 ILE MG 1 17 TYR HA 5.500 4.950 6.050 3.868 3.752 3.974 1.198 19 20 [*************-****+*] 1
392 1 16 ILE MG 1 17 TYR QB 5.060 4.550 5.570 4.513 4.234 4.692 0.316 16 0 "[ . 1 . 2]" 1
393 1 16 ILE MG 1 17 TYR QD 4.610 4.150 5.070 5.138 4.993 5.239 0.169 13 0 "[ . 1 . 2]" 1
394 1 16 ILE MG 1 18 HIS H 5.270 4.740 5.800 4.370 4.285 4.640 0.455 19 0 "[ . 1 . 2]" 1
395 1 16 ILE MG 1 18 HIS QB 5.500 4.950 6.050 4.364 4.088 4.885 0.862 5 15 "[*** +* *****-.****2]" 1
396 1 16 ILE MG 1 19 LEU H 5.500 4.950 6.050 3.944 3.260 4.655 1.690 14 16 "[*- ** *******+* ***2]" 1
397 1 16 ILE MG 1 19 LEU QB 3.170 2.850 3.490 2.729 2.383 3.801 0.467 7 0 "[ . 1 . 2]" 1
398 1 16 ILE MG 1 19 LEU QD 4.050 3.640 4.460 3.296 2.810 3.649 0.830 7 5 "[ . +* 1 - * *2]" 1
399 1 16 ILE MG 1 23 PHE QE 5.500 4.950 6.050 5.074 4.809 5.343 0.141 13 0 "[ . 1 . 2]" 1
400 1 16 ILE MG 1 32 PHE QD 5.500 4.950 6.050 6.098 6.012 6.222 0.172 3 0 "[ . 1 . 2]" 1
401 1 16 ILE MG 1 32 PHE QE 4.250 3.820 4.680 4.691 4.504 4.806 0.126 7 0 "[ . 1 . 2]" 1
402 1 16 ILE MG 1 55 PHE HA 5.500 4.950 6.050 3.978 3.247 5.008 1.703 8 13 "[ *.**+** *-** ***]" 1
403 1 16 ILE MG 1 55 PHE QB 5.500 4.950 6.050 4.850 4.575 5.110 0.375 12 0 "[ . 1 . 2]" 1
404 1 16 ILE MG 1 55 PHE QD 4.750 4.280 5.220 5.145 4.426 5.615 0.395 6 0 "[ . 1 . 2]" 1
405 1 16 ILE MG 1 56 GLY H 5.500 4.950 6.050 3.586 3.015 3.945 1.935 20 20 [***************-***+] 1
406 1 16 ILE MG 1 83 LEU H 5.400 4.860 5.940 5.764 5.521 6.191 0.251 20 0 "[ . 1 . 2]" 1
407 1 16 ILE MG 1 83 LEU HA 5.500 4.950 6.050 3.603 3.416 4.163 1.534 13 20 [************+******-] 1
408 1 16 ILE MG 1 83 LEU QB 4.260 3.830 4.690 4.270 4.092 4.492 . 0 0 "[ . 1 . 2]" 1
409 1 16 ILE MG 1 83 LEU QD 2.730 2.460 3.000 2.280 1.916 2.392 0.544 20 1 "[ . 1 . +]" 1
410 1 16 ILE MG 1 83 LEU HG 3.320 2.990 3.650 2.804 2.517 3.219 0.473 17 0 "[ . 1 . 2]" 1
411 1 16 ILE MG 1 84 LYS QB 4.180 3.760 4.600 5.063 4.758 5.635 1.035 20 6 "[ . ** 1 * -*+]" 1
412 1 17 TYR H 1 17 TYR QD 3.540 3.190 3.890 3.271 3.159 3.443 0.031 11 0 "[ . 1 . 2]" 1
413 1 17 TYR H 1 18 HIS H 5.500 4.950 6.050 4.675 4.642 4.733 0.308 17 0 "[ . 1 . 2]" 1
414 1 17 TYR H 1 83 LEU HA 5.240 4.720 5.760 5.884 5.705 6.028 0.268 10 0 "[ . 1 . 2]" 1
415 1 17 TYR H 1 84 LYS H 4.360 3.920 4.800 3.884 3.786 3.965 0.134 18 0 "[ . 1 . 2]" 1
416 1 17 TYR H 1 84 LYS QB 4.560 4.100 5.020 4.213 3.988 4.440 0.112 14 0 "[ . 1 . 2]" 1
417 1 17 TYR H 1 84 LYS QG 5.500 4.950 6.050 4.547 3.419 5.794 1.531 10 5 "[ - . +* * . * 2]" 1
418 1 17 TYR H 1 85 VAL HA 5.450 4.900 6.000 3.517 3.299 3.848 1.601 8 20 [*******+*-**********] 1
419 1 17 TYR H 1 85 VAL QG 5.320 4.790 5.850 4.557 4.300 4.887 0.490 18 0 "[ . 1 . 2]" 1
420 1 17 TYR HA 1 17 TYR QD 3.510 3.160 3.860 2.753 2.439 2.895 0.721 9 1 "[ . +1 . 2]" 1
421 1 17 TYR HA 1 17 TYR QE 5.200 4.680 5.720 4.713 4.576 4.870 0.104 8 0 "[ . 1 . 2]" 1
422 1 17 TYR HA 1 19 LEU H 4.790 4.310 5.270 4.666 4.122 5.108 0.188 14 0 "[ . 1 . 2]" 1
423 1 17 TYR HA 1 19 LEU QD 5.500 4.950 6.050 6.059 5.882 6.186 0.136 11 0 "[ . 1 . 2]" 1
424 1 17 TYR HA 1 55 PHE QB 3.980 3.580 4.380 3.428 2.725 3.823 0.855 14 3 "[ *. 1 - +. 2]" 1
425 1 17 TYR HA 1 55 PHE QD 4.930 4.440 5.420 3.583 1.977 4.879 2.463 13 10 "[*** * ** + .** -]" 1
426 1 17 TYR HA 1 56 GLY H 5.080 4.570 5.590 4.840 4.525 5.148 0.045 1 0 "[ . 1 . 2]" 1
427 1 17 TYR HA 1 84 LYS QB 5.500 4.950 6.050 5.418 5.011 5.631 . 0 0 "[ . 1 . 2]" 1
428 1 17 TYR QB 1 18 HIS H 4.300 4.080 4.730 3.069 2.807 3.375 1.273 12 20 [******-****+********] 1
429 1 17 TYR QB 1 18 HIS HA 5.410 4.870 5.950 4.589 4.415 4.881 0.455 3 0 "[ . 1 . 2]" 1
430 1 17 TYR QB 1 55 PHE QB 5.500 4.950 6.050 5.100 4.490 5.506 0.460 14 0 "[ . 1 . 2]" 1
431 1 17 TYR QB 1 84 LYS H 5.180 4.660 5.700 4.150 3.988 4.341 0.672 20 10 "[** . ** 1 - ** **+]" 1
432 1 17 TYR QB 1 84 LYS QB 4.580 4.120 4.650 3.161 2.809 3.282 1.311 18 20 [***-*************+**] 1
433 1 17 TYR QB 1 84 LYS QG 5.500 4.950 6.050 3.292 2.734 4.538 2.216 10 19 "[********-+*** ******]" 1
434 1 17 TYR QD 1 18 HIS H 5.270 4.740 5.800 4.453 4.250 4.564 0.490 18 0 "[ . 1 . 2]" 1
435 1 17 TYR QD 1 55 PHE QB 3.430 3.090 3.770 3.747 3.096 4.135 0.365 2 0 "[ . 1 . 2]" 1
436 1 17 TYR QD 1 55 PHE QD 3.380 3.040 3.720 2.980 2.640 3.834 0.400 2 0 "[ . 1 . 2]" 1
437 1 17 TYR QD 1 56 GLY H 5.500 4.950 6.050 5.457 4.849 6.102 0.101 8 0 "[ . 1 . 2]" 1
438 1 17 TYR QD 1 84 LYS QB 4.830 4.350 5.310 4.763 4.337 5.059 0.013 9 0 "[ . 1 . 2]" 1
439 1 17 TYR QD 1 84 LYS QD 5.500 4.950 6.050 6.071 5.826 6.291 0.241 4 0 "[ . 1 . 2]" 1
440 1 17 TYR QD 1 84 LYS QG 4.030 3.630 4.430 4.358 3.991 5.800 1.370 14 1 "[ . 1 +. 2]" 1
441 1 17 TYR QE 1 55 PHE QB 4.700 4.230 5.170 4.595 4.011 5.135 0.219 14 0 "[ . 1 . 2]" 1
442 1 17 TYR QE 1 55 PHE QD 3.920 3.530 4.310 3.685 3.419 4.067 0.111 18 0 "[ . 1 . 2]" 1
443 1 17 TYR QE 1 84 LYS QG 4.980 4.480 5.480 5.819 5.450 7.471 1.991 14 3 "[ *. - 1 +. 2]" 1
444 1 18 HIS H 1 18 HIS HD2 5.130 4.620 5.640 5.234 3.467 5.719 1.153 7 1 "[ . + 1 . 2]" 1
445 1 18 HIS H 1 19 LEU H 4.010 3.610 4.410 3.093 2.744 3.252 0.866 14 6 "[ *. 1- +* * *2]" 1
446 1 18 HIS H 1 19 LEU QD 5.500 4.950 6.050 5.663 5.483 5.835 . 0 0 "[ . 1 . 2]" 1
447 1 18 HIS H 1 55 PHE HA 5.170 4.650 5.690 4.407 3.542 5.148 1.108 6 3 "[ .+ * 1 -. 2]" 1
448 1 18 HIS H 1 55 PHE QB 5.350 4.810 5.890 4.495 3.818 5.055 0.992 14 6 "[ *.* - * * +. 2]" 1
449 1 18 HIS H 1 55 PHE QD 5.080 4.570 5.590 4.964 3.331 6.034 1.239 3 8 "[*-+ * 1* * .** 2]" 1
450 1 18 HIS H 1 56 GLY H 5.500 4.950 6.050 6.062 5.736 6.352 0.302 19 0 "[ . 1 . 2]" 1
451 1 18 HIS H 1 81 LYS QD 5.500 4.950 6.050 5.402 5.151 5.635 . 0 0 "[ . 1 . 2]" 1
452 1 18 HIS H 1 84 LYS H 5.300 4.770 5.830 5.333 5.199 5.498 . 0 0 "[ . 1 . 2]" 1
453 1 18 HIS H 1 84 LYS QB 5.500 4.950 6.050 5.469 5.042 5.737 . 0 0 "[ . 1 . 2]" 1
454 1 18 HIS HA 1 18 HIS HD2 4.740 4.270 5.210 4.699 3.999 4.847 0.271 7 0 "[ . 1 . 2]" 1
455 1 18 HIS HA 1 19 LEU QB 5.500 4.950 6.050 4.416 4.354 4.475 0.596 17 13 "[ ***.* 1******+ *-]" 1
456 1 18 HIS HA 1 55 PHE HA 5.500 4.950 6.050 5.822 5.308 6.253 0.203 17 0 "[ . 1 . 2]" 1
457 1 18 HIS HA 1 84 LYS H 5.500 4.950 6.050 5.559 5.401 5.750 . 0 0 "[ . 1 . 2]" 1
458 1 18 HIS QB 1 19 LEU HA 5.500 4.950 6.050 4.425 4.290 4.583 0.660 1 14 "[+** **-*** ** .* **]" 1
459 1 18 HIS QB 1 20 PRO QG 5.500 4.950 6.050 5.584 4.958 5.994 . 0 0 "[ . 1 . 2]" 1
460 1 18 HIS QB 1 81 LYS QB . 4.950 5.410 3.545 3.240 3.715 1.710 12 20 [***********+*-******] 1
461 1 18 HIS QB 1 81 LYS QD . 4.950 5.160 2.821 2.484 3.457 2.466 8 20 [*****-*+************] 1
462 1 18 HIS QB 1 82 ARG H . 4.950 5.030 3.792 3.661 3.940 1.289 16 20 [***************+***-] 1
463 1 18 HIS QB 1 82 ARG QB 5.500 4.950 6.050 4.125 3.908 4.291 1.042 6 20 [*****+*****-********] 1
464 1 18 HIS QB 1 83 LEU HA 3.920 3.820 4.310 3.498 3.270 3.668 0.550 20 1 "[ . 1 . +]" 1
465 1 18 HIS QB 1 83 LEU QD 5.500 4.950 5.670 4.801 3.607 5.014 1.343 20 1 "[ . 1 . +]" 1
466 1 18 HIS QB 1 84 LYS H 4.730 4.720 5.200 2.991 2.845 3.152 1.875 8 20 [*-*****+************] 1
467 1 18 HIS QB 1 84 LYS HA 5.500 4.950 6.050 5.196 5.042 5.354 . 0 0 "[ . 1 . 2]" 1
468 1 18 HIS QB 1 84 LYS QB 5.500 4.950 6.050 3.294 3.112 3.543 1.838 18 20 [*****************+*-] 1
469 1 18 HIS HD2 1 83 LEU HA 5.500 4.950 6.050 5.801 5.433 6.274 0.224 7 0 "[ . 1 . 2]" 1
470 1 18 HIS HD2 1 84 LYS H 4.350 3.910 4.790 4.761 4.464 4.965 0.175 2 0 "[ . 1 . 2]" 1
471 1 18 HIS HD2 1 84 LYS QB 3.570 3.210 3.930 3.232 3.082 3.443 0.128 20 0 "[ . 1 . 2]" 1
472 1 18 HIS HD2 1 84 LYS QD 5.500 4.950 6.050 5.991 5.782 6.129 0.079 15 0 "[ . 1 . 2]" 1
473 1 18 HIS HD2 1 84 LYS QG 5.230 4.710 5.750 4.425 4.098 4.550 0.612 2 1 "[ + . 1 . 2]" 1
474 1 19 LEU H 1 19 LEU QD 4.550 4.090 5.010 3.697 3.600 3.814 0.490 9 0 "[ . 1 . 2]" 1
475 1 19 LEU H 1 19 LEU HG 4.850 4.370 5.330 4.449 4.392 4.541 . 0 0 "[ . 1 . 2]" 1
476 1 19 LEU H 1 20 PRO HA 5.500 4.950 6.050 5.348 5.132 5.627 . 0 0 "[ . 1 . 2]" 1
477 1 19 LEU H 1 20 PRO QG 5.500 4.950 6.050 6.171 5.943 6.282 0.232 20 0 "[ . 1 . 2]" 1
478 1 19 LEU H 1 55 PHE HA 5.130 4.620 5.640 4.346 3.461 4.643 1.159 14 4 "[ *. * - +. 2]" 1
479 1 19 LEU H 1 83 LEU HA 3.830 3.450 4.210 5.768 5.291 6.102 1.892 3 20 [**+**********-******] 1
480 1 19 LEU H 1 83 LEU QD 5.500 4.950 6.050 5.440 4.296 5.735 0.654 20 1 "[ . 1 . +]" 1
481 1 19 LEU H 1 83 LEU HG 5.500 4.950 6.050 7.225 6.361 7.779 1.729 6 16 "[*** *+***- ** ** ***]" 1
482 1 19 LEU HA 1 19 LEU QD 3.650 3.280 4.020 3.235 2.990 3.356 0.290 3 0 "[ . 1 . 2]" 1
483 1 19 LEU HA 1 20 PRO QD 3.830 3.450 4.210 2.234 2.173 2.300 1.277 4 20 [***+***********-****] 1
484 1 19 LEU HA 1 20 PRO QG 5.360 4.950 5.900 4.115 4.048 4.183 0.902 4 20 [***+***********-****] 1
485 1 19 LEU HA 1 23 PHE QB 5.500 4.950 6.050 4.512 4.411 4.582 0.539 8 3 "[ . + 1 * - 2]" 1
486 1 19 LEU HA 1 23 PHE QD 5.500 4.950 6.050 4.849 4.778 5.010 0.172 9 0 "[ . 1 . 2]" 1
487 1 19 LEU HA 1 23 PHE QE 5.500 4.950 6.050 6.042 5.928 6.154 0.104 16 0 "[ . 1 . 2]" 1
488 1 19 LEU HA 1 78 ILE MD 5.500 4.950 6.050 6.507 6.402 6.767 0.717 16 3 "[ . * -+ 2]" 1
489 1 19 LEU HA 1 81 LYS QD 4.810 4.330 5.290 4.652 4.271 4.949 0.059 6 0 "[ . 1 . 2]" 1
490 1 19 LEU HA 1 83 LEU QD 3.930 3.540 4.320 3.279 2.336 3.550 1.204 20 1 "[ . 1 . +]" 1
491 1 19 LEU QB 1 20 PRO QD 5.500 4.950 6.050 3.709 3.503 3.839 1.447 20 20 [***************-***+] 1
492 1 19 LEU QB 1 23 PHE QB 5.150 4.630 5.500 4.117 3.999 4.286 0.631 4 11 "[ +-* *** * *. ** *]" 1
493 1 19 LEU QB 1 55 PHE HA 5.500 4.950 6.050 3.350 2.878 3.815 2.072 10 20 [*********+*******-**] 1
494 1 19 LEU QB 1 56 GLY QA 5.500 4.950 6.050 4.519 3.803 4.894 1.147 1 5 "[+* - 1* * . 2]" 1
495 1 19 LEU QB 1 81 LYS QD 5.500 4.950 5.920 4.983 4.615 5.249 0.335 2 0 "[ . 1 . 2]" 1
496 1 19 LEU QD 1 20 PRO QD 4.570 4.110 5.030 3.484 3.203 3.705 0.907 16 14 "[ * -*** *** **+* **]" 1
497 1 19 LEU QD 1 20 PRO QG 5.500 4.950 6.050 4.474 4.315 4.883 0.635 17 8 "[ * . - ** .*+ **]" 1
498 1 19 LEU QD 1 22 GLU QG 4.610 4.150 5.070 4.971 4.653 5.123 0.053 2 0 "[ . 1 . 2]" 1
499 1 19 LEU QD 1 23 PHE H 5.500 4.950 6.050 2.515 2.310 2.674 2.640 3 20 [**+*****-***********] 1
500 1 19 LEU QD 1 23 PHE QB 5.250 4.720 5.580 2.140 2.011 2.276 2.709 17 20 [************-***+***] 1
501 1 19 LEU QD 1 23 PHE QD 3.080 2.770 3.390 2.977 2.864 3.195 . 0 0 "[ . 1 . 2]" 1
502 1 19 LEU QD 1 23 PHE QE 4.060 3.650 4.470 4.728 4.633 4.887 0.417 13 0 "[ . 1 . 2]" 1
503 1 19 LEU QD 1 55 PHE HA 4.390 3.950 4.830 3.991 3.669 4.517 0.281 17 0 "[ . 1 . 2]" 1
504 1 19 LEU QD 1 55 PHE QB 5.500 4.950 6.050 4.993 4.772 5.168 0.178 10 0 "[ . 1 . 2]" 1
505 1 19 LEU QD 1 55 PHE QD 5.500 4.950 6.050 5.124 4.058 5.767 0.892 17 2 "[ - . 1 . + 2]" 1
506 1 19 LEU QD 1 56 GLY H 4.990 4.490 5.490 3.984 3.425 4.557 1.065 3 10 "[-*+** ** * .** 2]" 1
507 1 19 LEU QD 1 56 GLY QA 5.500 4.950 6.050 3.423 2.701 3.788 2.249 13 20 [***-********+*******] 1
508 1 19 LEU QD 1 83 LEU QD 3.490 3.140 3.840 4.098 3.605 4.315 0.475 12 0 "[ . 1 . 2]" 1
509 1 19 LEU HG 1 22 GLU HA 5.500 4.950 6.050 5.941 5.699 6.223 0.173 4 0 "[ . 1 . 2]" 1
510 1 19 LEU HG 1 23 PHE QB 5.500 4.950 6.050 2.257 2.167 2.426 2.783 4 20 [***+***********-****] 1
511 1 19 LEU HG 1 23 PHE QD 4.100 3.690 4.510 3.655 3.516 3.873 0.174 1 0 "[ . 1 . 2]" 1
512 1 19 LEU HG 1 23 PHE QE 5.500 4.950 6.050 5.544 5.415 5.766 . 0 0 "[ . 1 . 2]" 1
513 1 19 LEU HG 1 56 GLY H 5.390 4.850 5.930 6.588 6.009 7.334 1.404 8 9 "[ .**+*1 * * **-]" 1
514 1 19 LEU HG 1 56 GLY QA 5.500 4.950 6.050 6.262 5.291 6.767 0.717 4 4 "[ +. -1 . * *]" 1
515 1 20 PRO HA 1 21 GLN H 3.540 3.190 3.890 2.781 2.707 2.825 0.483 14 0 "[ . 1 . 2]" 1
516 1 20 PRO HA 1 21 GLN HA 4.340 3.910 4.770 3.797 3.732 3.872 0.178 20 0 "[ . 1 . 2]" 1
517 1 20 PRO HA 1 21 GLN QB 5.350 4.810 5.890 4.702 4.621 4.762 0.189 14 0 "[ . 1 . 2]" 1
518 1 20 PRO HA 1 21 GLN QG 4.940 4.450 5.430 4.251 4.208 4.300 0.242 14 0 "[ . 1 . 2]" 1
519 1 20 PRO HA 1 23 PHE H 5.500 4.950 6.050 5.150 5.029 5.222 . 0 0 "[ . 1 . 2]" 1
520 1 20 PRO HA 1 78 ILE MG 5.190 4.670 5.710 6.193 6.090 6.303 0.593 20 8 "[ . * **** - * +]" 1
521 1 20 PRO HA 1 81 LYS HA 5.160 4.640 5.680 5.286 5.043 5.694 0.014 6 0 "[ . 1 . 2]" 1
522 1 20 PRO HA 1 81 LYS QD 3.910 3.520 4.300 3.064 2.420 3.604 1.100 9 7 "[ * *-* +1 * . * 2]" 1
523 1 20 PRO HA 1 81 LYS QE 4.720 4.250 5.190 4.600 4.483 4.743 . 0 0 "[ . 1 . 2]" 1
524 1 20 PRO QB 1 21 GLN H 4.650 4.180 5.120 1.887 1.778 2.007 2.402 10 20 [***-*****+**********] 1
525 1 20 PRO QB 1 22 GLU H 4.770 4.290 5.250 5.194 4.880 5.299 0.049 2 0 "[ . 1 . 2]" 1
526 1 20 PRO QB 1 23 PHE QD 5.500 4.950 6.050 4.699 4.594 4.886 0.356 14 0 "[ . 1 . 2]" 1
527 1 20 PRO QB 1 23 PHE QE 5.500 4.950 6.050 4.881 4.731 5.105 0.219 4 0 "[ . 1 . 2]" 1
528 1 20 PRO QB 1 76 PHE QB 5.330 4.800 5.860 5.686 5.505 5.840 . 0 0 "[ . 1 . 2]" 1
529 1 20 PRO QB 1 78 ILE HB 5.500 4.950 6.050 3.056 2.955 3.174 1.995 6 20 [*****+*************-] 1
530 1 20 PRO QB 1 78 ILE MD 5.150 4.630 5.670 3.208 2.991 3.438 1.639 18 20 [*****************+*-] 1
531 1 20 PRO QB 1 78 ILE QG 5.500 4.950 6.050 3.804 3.590 4.638 1.360 18 19 "[*** *************+*-]" 1
532 1 20 PRO QB 1 78 ILE MG 4.720 4.250 5.190 3.896 3.828 3.970 0.422 6 0 "[ . 1 . 2]" 1
533 1 20 PRO QB 1 81 LYS QB 3.410 3.070 3.750 2.152 1.893 2.513 1.177 4 20 [***+*-**************] 1
534 1 20 PRO QB 1 81 LYS QD 3.320 2.990 3.650 3.975 3.639 4.271 0.621 3 4 "[ +-. 1 . * *2]" 1
535 1 20 PRO QB 1 82 ARG H 5.040 4.540 5.540 5.335 5.199 5.567 0.027 6 0 "[ . 1 . 2]" 1
536 1 20 PRO QB 1 82 ARG HA 4.260 3.830 4.690 4.810 4.620 4.984 0.294 20 0 "[ . 1 . 2]" 1
537 1 20 PRO QB 1 83 LEU QD 4.890 4.400 5.380 4.391 3.765 4.623 0.635 20 1 "[ . 1 . +]" 1
538 1 20 PRO QD 1 76 PHE QB 5.500 4.950 6.050 5.035 4.781 5.211 0.169 4 0 "[ . 1 . 2]" 1
539 1 20 PRO QD 1 78 ILE HB 5.500 4.950 6.050 5.592 5.298 5.701 . 0 0 "[ . 1 . 2]" 1
540 1 20 PRO QD 1 78 ILE MD 4.700 4.230 5.170 4.050 3.952 4.222 0.278 12 0 "[ . 1 . 2]" 1
541 1 20 PRO QD 1 81 LYS QD 5.500 4.950 6.050 4.306 3.884 4.634 1.066 2 10 "[*+ *****- * . * 2]" 1
542 1 20 PRO QD 1 83 LEU QD 4.740 4.270 5.210 2.288 1.862 2.523 2.408 20 20 [*****-*************+] 1
543 1 20 PRO QG 1 23 PHE H 5.500 4.950 6.050 5.042 4.783 5.923 0.167 20 0 "[ . 1 . 2]" 1
544 1 20 PRO QG 1 23 PHE QD 5.500 4.950 6.050 3.697 3.558 4.672 1.392 16 19 "[*** ***********+*-**]" 1
545 1 20 PRO QG 1 23 PHE QE 5.500 4.950 5.970 3.668 3.544 4.363 1.406 12 20 [***-*******+********] 1
546 1 20 PRO QG 1 76 PHE QB 5.500 4.950 6.050 4.326 4.181 4.459 0.769 4 19 [***+**************-2] 1
547 1 20 PRO QG 1 77 GLN HA 5.500 4.950 6.050 5.780 5.099 6.031 . 0 0 "[ . 1 . 2]" 1
548 1 20 PRO QG 1 78 ILE HB 5.390 4.850 5.930 3.761 3.401 3.860 1.449 4 20 [***+*************-**] 1
549 1 20 PRO QG 1 78 ILE MD 3.910 3.520 4.300 2.451 2.334 2.620 1.186 3 20 [**+******-**********] 1
550 1 20 PRO QG 1 78 ILE QG 5.170 4.650 5.690 3.435 3.294 4.107 1.356 17 20 [***-************+***] 1
551 1 20 PRO QG 1 83 LEU H 5.500 4.950 6.050 3.667 2.968 4.114 1.982 4 20 [*-*+****************] 1
552 1 20 PRO QG 1 83 LEU QB 4.200 3.780 4.620 3.418 3.030 3.716 0.750 16 4 "[ *. * -.+ 2]" 1
553 1 20 PRO QG 1 83 LEU QD 3.910 3.520 4.300 2.969 2.477 3.214 1.043 20 14 "[*** . - ****** ***+]" 1
554 1 21 GLN H 1 21 GLN QB 3.960 3.560 4.360 2.488 2.448 2.543 1.112 16 20 [***-***********+****] 1
555 1 21 GLN H 1 21 GLN QG 4.970 4.470 5.470 1.796 1.728 1.847 2.742 10 20 [*********+*****-****] 1
556 1 21 GLN H 1 22 GLU H 4.470 4.020 4.920 3.990 3.821 4.069 0.199 4 0 "[ . 1 . 2]" 1
557 1 21 GLN H 1 23 PHE H 5.500 4.950 6.050 4.608 4.549 4.681 0.401 10 0 "[ . 1 . 2]" 1
558 1 21 GLN H 1 78 ILE MD 5.500 4.950 6.050 4.714 4.505 5.036 0.445 6 0 "[ . 1 . 2]" 1
559 1 21 GLN H 1 78 ILE MG 5.290 4.760 5.820 4.604 4.498 4.735 0.262 6 0 "[ . 1 . 2]" 1
560 1 21 GLN H 1 81 LYS QD 5.500 4.950 6.050 5.430 4.742 6.020 0.208 7 0 "[ . 1 . 2]" 1
561 1 21 GLN HA 1 21 GLN QG 4.100 3.700 4.510 3.353 3.335 3.386 0.365 10 0 "[ . 1 . 2]" 1
562 1 21 GLN HA 1 22 GLU HA 5.500 4.950 6.050 4.548 4.511 4.609 0.439 6 0 "[ . 1 . 2]" 1
563 1 21 GLN HA 1 22 GLU QB 3.700 3.330 4.070 4.945 4.864 5.005 0.935 12 20 [*******-***+********] 1
564 1 21 GLN HA 1 23 PHE H 4.770 4.290 5.250 4.818 4.743 4.884 . 0 0 "[ . 1 . 2]" 1
565 1 21 GLN HA 1 81 LYS QD 5.500 4.950 6.050 5.573 4.732 6.294 0.244 20 0 "[ . 1 . 2]" 1
566 1 21 GLN QB 1 23 PHE H 4.440 4.000 4.880 4.796 4.730 4.837 . 0 0 "[ . 1 . 2]" 1
567 1 21 GLN QB 1 23 PHE QD 5.500 4.950 6.050 5.192 5.131 5.263 . 0 0 "[ . 1 . 2]" 1
568 1 21 GLN QB 1 78 ILE HB 4.420 3.980 4.860 5.124 5.014 5.621 0.761 4 2 "[ +. 1 . -]" 1
569 1 21 GLN QB 1 78 ILE MG 4.670 4.200 5.140 4.615 4.439 4.889 . 0 0 "[ . 1 . 2]" 1
570 1 21 GLN QE 1 22 GLU QG 5.500 4.950 6.050 4.568 4.467 4.691 0.483 17 0 "[ . 1 . 2]" 1
571 1 21 GLN QE 1 23 PHE H 4.420 3.980 4.860 4.200 4.012 4.282 . 0 0 "[ . 1 . 2]" 1
572 1 21 GLN QE 1 23 PHE QB 5.500 4.950 6.050 4.072 3.955 4.190 0.995 5 20 [***-+***************] 1
573 1 21 GLN QE 1 27 ASP HA 5.500 4.950 6.050 6.539 5.868 6.931 0.881 4 13 "[ *+* -* *** *.****2]" 1
574 1 21 GLN QE 1 78 ILE MG 5.500 4.950 6.050 4.043 3.815 4.322 1.135 4 20 [***+***************-] 1
575 1 21 GLN QG 1 23 PHE H 4.150 3.730 4.510 4.281 4.120 4.412 . 0 0 "[ . 1 . 2]" 1
576 1 21 GLN QG 1 23 PHE QB 5.160 4.640 5.680 4.578 4.348 4.949 0.292 9 0 "[ . 1 . 2]" 1
577 1 21 GLN QG 1 23 PHE QE 4.180 3.760 4.600 4.207 4.051 4.359 . 0 0 "[ . 1 . 2]" 1
578 1 22 GLU H 1 22 GLU QB . 3.640 3.760 2.670 2.365 2.783 1.275 12 20 [****-******+********] 1
579 1 22 GLU H 1 22 GLU QG 3.910 3.520 4.300 3.640 3.428 3.970 0.092 9 0 "[ . 1 . 2]" 1
580 1 22 GLU H 1 23 PHE H 3.640 3.280 4.000 3.011 2.853 3.076 0.427 4 0 "[ . 1 . 2]" 1
581 1 22 GLU H 1 23 PHE QB 5.500 4.950 6.050 4.514 4.467 4.563 0.483 9 0 "[ . 1 . 2]" 1
582 1 22 GLU H 1 23 PHE QD 5.500 4.950 6.050 3.896 3.598 4.071 1.352 4 20 [***+-***************] 1
583 1 22 GLU HA 1 22 GLU QG 3.520 3.170 3.870 3.280 2.854 3.438 0.316 4 0 "[ . 1 . 2]" 1
584 1 22 GLU HA 1 23 PHE QB 5.500 4.950 6.050 4.985 4.868 5.176 0.082 5 0 "[ . 1 . 2]" 1
585 1 22 GLU HA 1 23 PHE QD 5.500 4.950 6.050 5.832 5.633 5.902 . 0 0 "[ . 1 . 2]" 1
586 1 22 GLU QB 1 23 PHE H . 4.950 5.430 4.235 4.077 4.291 0.873 4 20 [***+*-**************] 1
587 1 22 GLU QG 1 23 PHE H 4.750 4.280 5.220 4.271 4.128 4.405 0.152 3 0 "[ . 1 . 2]" 1
588 1 22 GLU QG 1 23 PHE HA 5.500 4.950 6.050 3.651 3.407 3.810 1.543 3 20 [**+*******-*********] 1
589 1 22 GLU QG 1 23 PHE QB 5.500 4.950 6.050 5.212 5.028 5.359 . 0 0 "[ . 1 . 2]" 1
590 1 22 GLU QG 1 23 PHE QD 4.520 4.070 4.970 5.086 4.910 5.184 0.214 5 0 "[ . 1 . 2]" 1
591 1 22 GLU QG 1 24 GLY H 5.500 4.950 6.050 3.275 3.019 3.493 1.931 4 20 [-**+****************] 1
592 1 22 GLU QG 1 43 VAL QG 5.500 4.950 6.050 5.541 5.421 5.635 . 0 0 "[ . 1 . 2]" 1
593 1 23 PHE H 1 23 PHE QD 4.710 4.240 5.180 3.736 3.458 3.838 0.782 4 5 "[ +. * 1** . - 2]" 1
594 1 23 PHE H 1 24 GLY H 4.930 4.440 5.420 4.499 4.417 4.596 0.023 8 0 "[ . 1 . 2]" 1
595 1 23 PHE HA 1 23 PHE QD 3.030 2.730 3.330 2.311 2.241 2.349 0.489 9 0 "[ . 1 . 2]" 1
596 1 23 PHE HA 1 23 PHE QE 4.990 4.490 5.490 4.507 4.421 4.580 0.069 9 0 "[ . 1 . 2]" 1
597 1 23 PHE HA 1 24 GLY H 3.210 2.890 3.530 2.350 2.249 2.410 0.641 9 15 "[** *- *+**** * ****]" 1
598 1 23 PHE HA 1 28 ILE H 5.500 4.950 6.050 5.684 5.311 5.943 . 0 0 "[ . 1 . 2]" 1
599 1 23 PHE QB 1 24 GLY H 5.140 4.630 5.190 3.820 3.774 3.863 0.856 7 20 [******+***********-*] 1
600 1 23 PHE QB 1 24 GLY QA 5.500 4.950 6.050 4.185 4.125 4.227 0.825 12 20 [*-*********+********] 1
601 1 23 PHE QB 1 28 ILE H 5.500 4.950 6.050 4.950 4.808 5.210 0.142 17 0 "[ . 1 . 2]" 1
602 1 23 PHE QB 1 28 ILE HB 5.500 4.950 6.050 4.882 4.641 5.204 0.309 4 0 "[ . 1 . 2]" 1
603 1 23 PHE QB 1 28 ILE MD 5.500 4.950 6.050 4.711 4.434 4.879 0.516 16 1 "[ . 1 .+ 2]" 1
604 1 23 PHE QB 1 28 ILE MG 5.500 4.950 6.050 5.798 5.600 5.973 . 0 0 "[ . 1 . 2]" 1
605 1 23 PHE QB 1 43 VAL QG . 4.950 5.400 3.805 3.731 4.023 1.219 9 20 [********+******-****] 1
606 1 23 PHE QD 1 24 GLY H 3.840 3.460 4.220 4.293 4.074 4.418 0.198 3 0 "[ . 1 . 2]" 1
607 1 23 PHE QD 1 27 ASP HA 5.500 4.950 6.050 5.914 5.423 6.173 0.123 8 0 "[ . 1 . 2]" 1
608 1 23 PHE QD 1 27 ASP QB 4.010 3.610 4.410 3.553 3.105 3.850 0.505 9 1 "[ . +1 . 2]" 1
609 1 23 PHE QD 1 28 ILE HA 5.500 4.950 6.050 4.923 4.756 5.059 0.194 9 0 "[ . 1 . 2]" 1
610 1 23 PHE QD 1 28 ILE HB 5.500 4.950 6.050 5.235 5.022 5.545 . 0 0 "[ . 1 . 2]" 1
611 1 23 PHE QD 1 28 ILE MD 5.040 4.540 5.540 4.493 4.328 4.637 0.212 16 0 "[ . 1 . 2]" 1
612 1 23 PHE QD 1 28 ILE QG 4.090 3.680 4.500 3.466 3.407 3.560 0.273 3 0 "[ . 1 . 2]" 1
613 1 23 PHE QD 1 28 ILE MG 5.500 4.950 6.050 5.898 5.836 5.979 . 0 0 "[ . 1 . 2]" 1
614 1 23 PHE QD 1 43 VAL QG 5.280 4.950 5.810 5.011 4.880 5.239 0.070 20 0 "[ . 1 . 2]" 1
615 1 23 PHE QD 1 78 ILE MD 5.430 4.890 5.970 4.651 4.548 4.808 0.342 5 0 "[ . 1 . 2]" 1
616 1 23 PHE QD 1 78 ILE MG 5.500 4.950 6.050 5.515 5.324 5.714 . 0 0 "[ . 1 . 2]" 1
617 1 23 PHE QE 1 27 ASP QB 3.760 3.380 4.140 3.912 3.578 4.079 . 0 0 "[ . 1 . 2]" 1
618 1 23 PHE QE 1 28 ILE HA 4.350 3.910 4.790 4.845 4.495 4.945 0.155 6 0 "[ . 1 . 2]" 1
619 1 23 PHE QE 1 28 ILE MD 5.500 4.950 6.050 5.325 5.188 5.447 . 0 0 "[ . 1 . 2]" 1
620 1 23 PHE QE 1 28 ILE QG 5.500 4.950 6.050 4.230 4.121 4.294 0.829 9 20 [********+****-******] 1
621 1 23 PHE QE 1 28 ILE MG 5.500 4.950 6.050 6.462 6.253 6.524 0.474 4 0 "[ . 1 . 2]" 1
622 1 23 PHE QE 1 31 MET QB 5.500 4.950 6.050 3.882 3.553 4.221 1.397 17 20 [***********-****+***] 1
623 1 23 PHE QE 1 31 MET QG 5.450 4.900 6.000 3.706 3.235 4.237 1.665 17 20 [***********-****+***] 1
624 1 23 PHE QE 1 32 PHE QE 3.600 3.240 3.960 3.972 3.767 4.139 0.179 3 0 "[ . 1 . 2]" 1
625 1 23 PHE QE 1 78 ILE MD 3.990 3.590 4.390 3.494 3.369 3.634 0.221 11 0 "[ . 1 . 2]" 1
626 1 23 PHE QE 1 83 LEU QD 5.500 4.950 6.050 2.974 2.645 3.251 2.305 20 20 [*****************-*+] 1
627 1 24 GLY H 1 25 ASP H 4.660 4.190 5.130 4.470 4.428 4.540 . 0 0 "[ . 1 . 2]" 1
628 1 24 GLY H 1 26 GLN H 5.500 4.950 6.050 5.076 4.805 5.396 0.145 5 0 "[ . 1 . 2]" 1
629 1 24 GLY H 1 27 ASP H 4.170 3.750 4.590 3.763 3.548 4.031 0.202 13 0 "[ . 1 . 2]" 1
630 1 24 GLY H 1 27 ASP HA 5.360 4.820 5.900 5.735 5.254 6.021 0.121 14 0 "[ . 1 . 2]" 1
631 1 24 GLY H 1 27 ASP QB 4.170 3.750 4.590 3.059 2.444 3.357 1.306 13 10 "[ -** ** + * ** *]" 1
632 1 24 GLY H 1 28 ILE H 5.110 4.600 5.620 4.868 4.478 5.222 0.122 9 0 "[ . 1 . 2]" 1
633 1 24 GLY H 1 43 VAL QG 5.500 4.950 6.050 4.618 4.518 4.689 0.432 11 0 "[ . 1 . 2]" 1
634 1 24 GLY QA 1 25 ASP H 3.210 2.890 3.450 2.347 2.314 2.378 0.576 11 20 [**********+**-******] 1
635 1 24 GLY QA 1 25 ASP QB 5.500 4.950 6.050 4.117 4.021 4.222 0.929 18 20 [*******-*********+**] 1
636 1 24 GLY QA 1 26 GLN H 5.260 4.820 5.790 3.949 3.594 4.187 1.226 5 20 [****+***-***********] 1
637 1 24 GLY QA 1 27 ASP H 5.500 4.950 6.050 4.126 3.946 4.303 1.004 17 20 [***********-****+***] 1
638 1 24 GLY QA 1 27 ASP QB 5.500 4.950 6.050 4.356 3.931 4.672 1.019 6 9 "[ .+* *- * * ** *]" 1
639 1 24 GLY QA 1 43 VAL HB . 4.610 4.790 3.463 3.302 3.649 1.308 5 20 [***-+***************] 1
640 1 25 ASP H 1 25 ASP QB . 3.500 3.820 2.347 2.201 2.458 1.299 1 20 [+**********-********] 1
641 1 25 ASP H 1 26 GLN H 3.470 3.120 3.820 3.089 2.866 3.307 0.254 16 0 "[ . 1 . 2]" 1
642 1 25 ASP H 1 26 GLN QB 5.240 4.720 5.760 5.259 4.968 5.515 . 0 0 "[ . 1 . 2]" 1
643 1 25 ASP H 1 26 GLN QG 5.310 4.780 5.840 4.892 4.502 5.581 0.278 9 0 "[ . 1 . 2]" 1
644 1 25 ASP H 1 27 ASP H 4.900 4.410 5.390 4.654 4.488 4.879 . 0 0 "[ . 1 . 2]" 1
645 1 25 ASP H 1 27 ASP QB 5.500 4.950 6.050 5.767 5.284 6.084 0.034 1 0 "[ . 1 . 2]" 1
646 1 25 ASP H 1 28 ILE H 5.500 4.950 6.050 5.300 5.089 5.558 . 0 0 "[ . 1 . 2]" 1
647 1 25 ASP H 1 28 ILE MG 5.500 4.950 6.050 5.598 5.277 5.971 . 0 0 "[ . 1 . 2]" 1
648 1 25 ASP H 1 41 ALA MB 5.500 4.950 6.050 5.844 5.249 6.304 0.254 18 0 "[ . 1 . 2]" 1
649 1 25 ASP H 1 43 VAL HB 4.630 4.170 5.090 4.213 3.897 4.442 0.273 17 0 "[ . 1 . 2]" 1
650 1 25 ASP H 1 43 VAL QG . 4.460 4.940 3.941 3.714 4.098 0.746 16 10 "[ * ** **1* *-+* 2]" 1
651 1 25 ASP HA 1 27 ASP H 5.180 4.660 5.700 4.658 4.563 4.841 0.097 8 0 "[ . 1 . 2]" 1
652 1 25 ASP HA 1 28 ILE H 4.430 3.990 4.870 3.980 3.751 4.230 0.239 16 0 "[ . 1 . 2]" 1
653 1 25 ASP HA 1 28 ILE MG 3.690 3.320 4.060 3.419 3.129 3.785 0.191 9 0 "[ . 1 . 2]" 1
654 1 25 ASP HA 1 41 ALA MB 5.270 4.740 5.800 3.541 2.986 4.033 1.754 9 20 [********+********-**] 1
655 1 25 ASP HA 1 42 LYS HA 4.350 3.910 4.790 4.527 4.191 4.911 0.121 9 0 "[ . 1 . 2]" 1
656 1 25 ASP HA 1 43 VAL H 4.720 4.250 5.190 4.615 4.184 5.028 0.066 17 0 "[ . 1 . 2]" 1
657 1 25 ASP HA 1 43 VAL QG 4.200 3.780 4.620 3.940 3.747 4.226 0.033 20 0 "[ . 1 . 2]" 1
658 1 25 ASP QB 1 26 GLN H . 3.630 3.940 2.689 2.214 3.097 1.416 15 20 [-*************+*****] 1
659 1 25 ASP QB 1 26 GLN QG 5.500 4.950 6.050 4.877 4.652 5.291 0.298 5 0 "[ . 1 . 2]" 1
660 1 25 ASP QB 1 27 ASP H 5.500 4.950 6.050 5.069 4.729 5.348 0.221 15 0 "[ . 1 . 2]" 1
661 1 25 ASP QB 1 28 ILE MG 5.230 4.710 5.750 4.737 4.285 5.199 0.425 8 0 "[ . 1 . 2]" 1
662 1 25 ASP QB 1 41 ALA MB 5.350 4.810 5.890 4.042 3.269 4.851 1.541 9 10 "[** * *+1- **.** 2]" 1
663 1 25 ASP QB 1 42 LYS HA 5.140 4.630 5.480 4.044 3.667 4.289 0.963 2 12 "[*+*-.* ******. *2]" 1
664 1 25 ASP QB 1 42 LYS QB 4.620 4.160 5.080 5.239 4.927 5.448 0.368 8 0 "[ . 1 . 2]" 1
665 1 25 ASP QB 1 43 VAL H 5.500 4.950 5.620 4.218 4.069 4.657 0.881 4 19 "[***+-** ************]" 1
666 1 25 ASP QB 1 43 VAL QG 5.120 4.950 5.630 4.599 4.395 4.833 0.555 14 2 "[ -. 1 +. 2]" 1
667 1 26 GLN H 1 26 GLN QB 3.190 2.870 3.510 2.505 2.428 2.604 0.442 8 0 "[ . 1 . 2]" 1
668 1 26 GLN H 1 26 GLN QE 5.500 4.950 6.050 3.933 2.162 4.845 2.788 13 6 "[ .*- 1 + * * *]" 1
669 1 26 GLN H 1 26 GLN QG 3.530 3.180 3.880 2.794 2.439 3.160 0.741 10 7 "[- *** +** . 2]" 1
670 1 26 GLN H 1 27 ASP H 3.300 2.970 3.630 2.963 2.811 3.283 0.159 12 0 "[ . 1 . 2]" 1
671 1 26 GLN H 1 27 ASP HA 5.500 4.950 6.050 5.467 5.338 5.726 . 0 0 "[ . 1 . 2]" 1
672 1 26 GLN H 1 28 ILE H 5.000 4.500 5.500 4.623 4.465 4.803 0.035 16 0 "[ . 1 . 2]" 1
673 1 26 GLN H 1 28 ILE MG 5.410 4.870 5.950 5.646 5.444 5.953 0.003 10 0 "[ . 1 . 2]" 1
674 1 26 GLN H 1 29 LEU QB 5.500 4.950 6.050 5.192 4.746 5.394 0.204 9 0 "[ . 1 . 2]" 1
675 1 26 GLN HA 1 26 GLN QE 5.100 4.590 5.610 3.697 3.321 4.185 1.269 8 14 "[***** +*-** *.** *2]" 1
676 1 26 GLN HA 1 26 GLN QG 3.470 3.120 3.820 3.446 3.392 3.591 . 0 0 "[ . 1 . 2]" 1
677 1 26 GLN HA 1 27 ASP QB 5.500 4.950 6.050 5.402 5.247 5.499 . 0 0 "[ . 1 . 2]" 1
678 1 26 GLN HA 1 29 LEU H 3.860 3.470 4.250 4.030 3.759 4.242 . 0 0 "[ . 1 . 2]" 1
679 1 26 GLN HA 1 29 LEU QB 3.590 3.550 3.950 3.220 3.024 3.404 0.526 13 2 "[ . -1 + . 2]" 1
680 1 26 GLN HA 1 29 LEU QD 4.960 4.460 5.460 3.916 3.536 4.059 0.924 18 8 "[ *-* *1 * * + *]" 1
681 1 26 GLN HA 1 29 LEU HG 5.010 4.510 5.510 5.585 5.312 5.720 0.210 11 0 "[ . 1 . 2]" 1
682 1 26 GLN QB 1 27 ASP H 4.130 3.720 4.520 3.545 3.375 3.655 0.345 9 0 "[ . 1 . 2]" 1
683 1 26 GLN QB 1 27 ASP QB 5.500 4.950 6.050 4.915 4.631 5.089 0.319 9 0 "[ . 1 . 2]" 1
684 1 26 GLN QB 1 29 LEU QB 5.330 4.950 5.860 4.509 4.236 4.674 0.714 18 7 "[ .** *1 - * + *]" 1
685 1 26 GLN QB 1 30 GLN QE 5.500 4.950 6.050 3.395 2.405 3.990 2.545 10 20 [*******-*+**********] 1
686 1 26 GLN QE 1 27 ASP QB 5.500 4.950 6.050 3.799 3.236 4.265 1.714 20 20 [***-***************+] 1
687 1 26 GLN QG 1 27 ASP H 4.240 3.820 4.660 2.034 1.803 2.355 2.017 5 20 [****+**********-****] 1
688 1 26 GLN QG 1 29 LEU QB 5.500 4.950 6.050 5.599 5.232 5.935 . 0 0 "[ . 1 . 2]" 1
689 1 27 ASP H 1 27 ASP QB 3.390 3.050 3.730 2.293 2.094 2.464 0.956 9 20 [********+*********-*] 1
690 1 27 ASP H 1 28 ILE H 3.420 3.080 3.760 2.833 2.762 2.950 0.318 1 0 "[ . 1 . 2]" 1
691 1 27 ASP H 1 28 ILE HA 5.500 4.950 6.050 5.335 5.291 5.416 . 0 0 "[ . 1 . 2]" 1
692 1 27 ASP H 1 28 ILE MG 5.470 4.920 6.020 5.349 5.175 5.572 . 0 0 "[ . 1 . 2]" 1
693 1 27 ASP H 1 29 LEU H 5.120 4.610 5.630 4.320 4.213 4.369 0.397 9 0 "[ . 1 . 2]" 1
694 1 27 ASP H 1 30 GLN H 5.500 4.950 6.050 5.343 5.159 5.471 . 0 0 "[ . 1 . 2]" 1
695 1 27 ASP H 1 30 GLN QE 4.100 3.690 4.510 4.161 3.952 4.400 . 0 0 "[ . 1 . 2]" 1
696 1 27 ASP H 1 43 VAL QG 5.500 4.950 6.050 6.058 5.972 6.143 0.093 13 0 "[ . 1 . 2]" 1
697 1 27 ASP HA 1 28 ILE MG 5.500 4.950 6.050 5.924 5.821 6.035 . 0 0 "[ . 1 . 2]" 1
698 1 27 ASP HA 1 30 GLN H 4.270 3.840 4.700 3.720 3.617 3.845 0.223 19 0 "[ . 1 . 2]" 1
699 1 27 ASP HA 1 30 GLN QG 5.020 4.520 5.520 4.245 2.823 4.940 1.697 1 5 "[+ . *- 1 ** 2]" 1
700 1 27 ASP QB 1 28 ILE H 3.760 3.380 4.140 3.109 2.548 3.385 0.832 9 1 "[ . +1 . 2]" 1
701 1 27 ASP QB 1 28 ILE HA 4.430 3.990 4.870 4.438 3.704 4.675 0.286 9 0 "[ . 1 . 2]" 1
702 1 27 ASP QB 1 29 LEU H 5.500 4.950 6.050 4.791 4.419 4.884 0.531 9 1 "[ . +1 . 2]" 1
703 1 27 ASP QB 1 30 GLN QE 5.500 4.950 6.050 3.820 3.383 4.530 1.567 3 18 [**+**-***1*********2] 1
704 1 28 ILE H 1 28 ILE HB 3.550 3.200 3.900 2.139 2.061 2.213 1.139 15 20 [**************+-****] 1
705 1 28 ILE H 1 28 ILE MD 5.090 4.580 5.600 4.487 4.328 4.590 0.252 16 0 "[ . 1 . 2]" 1
706 1 28 ILE H 1 28 ILE QG 4.600 4.140 5.060 3.439 3.167 3.554 0.973 16 20 [***************+**-*] 1
707 1 28 ILE H 1 28 ILE MG 3.830 3.450 4.210 3.302 3.208 3.553 0.242 18 0 "[ . 1 . 2]" 1
708 1 28 ILE H 1 29 LEU H 3.830 3.450 4.210 2.912 2.725 3.075 0.725 13 13 "[****.* ** +*. -***]" 1
709 1 28 ILE H 1 29 LEU QB 5.500 4.950 6.010 4.506 4.370 4.691 0.580 4 7 "[ *+.* *1- * . * 2]" 1
710 1 28 ILE H 1 29 LEU QD 5.500 4.950 6.050 5.754 5.639 5.904 . 0 0 "[ . 1 . 2]" 1
711 1 28 ILE H 1 41 ALA MB 5.500 4.950 6.050 5.052 4.875 5.279 0.075 13 0 "[ . 1 . 2]" 1
712 1 28 ILE H 1 43 VAL QG 4.970 4.470 5.470 5.231 5.054 5.372 . 0 0 "[ . 1 . 2]" 1
713 1 28 ILE HA 1 28 ILE MD 4.560 4.100 5.020 3.798 3.729 3.875 0.371 4 0 "[ . 1 . 2]" 1
714 1 28 ILE HA 1 28 ILE QG 4.020 3.620 4.420 2.257 2.151 2.361 1.469 2 20 [*+****************-*] 1
715 1 28 ILE HA 1 29 LEU QB 5.500 4.950 6.050 5.147 5.058 5.206 . 0 0 "[ . 1 . 2]" 1
716 1 28 ILE HA 1 31 MET H 4.110 3.700 4.520 3.935 3.643 4.288 0.057 8 0 "[ . 1 . 2]" 1
717 1 28 ILE HA 1 31 MET QB 3.970 3.570 4.370 3.623 3.412 3.853 0.158 17 0 "[ . 1 . 2]" 1
718 1 28 ILE HA 1 31 MET QG 5.300 4.770 5.830 5.286 5.102 5.479 . 0 0 "[ . 1 . 2]" 1
719 1 28 ILE HA 1 32 PHE QD 4.210 3.790 4.630 3.763 3.678 3.860 0.112 12 0 "[ . 1 . 2]" 1
720 1 28 ILE HA 1 32 PHE QE 5.500 4.950 6.050 5.498 5.297 5.676 . 0 0 "[ . 1 . 2]" 1
721 1 28 ILE HA 1 41 ALA MB 5.500 4.950 6.050 5.499 5.405 5.617 . 0 0 "[ . 1 . 2]" 1
722 1 28 ILE HA 1 58 VAL QG 5.500 4.950 6.050 4.428 4.085 4.684 0.865 19 11 "[- * * ** * * .** +*]" 1
723 1 28 ILE HB 1 29 LEU H 4.570 4.110 5.030 3.962 3.883 4.017 0.227 16 0 "[ . 1 . 2]" 1
724 1 28 ILE HB 1 43 VAL QG 4.460 4.010 4.910 4.185 4.041 4.417 . 0 0 "[ . 1 . 2]" 1
725 1 28 ILE HB 1 58 VAL QG 5.140 4.630 5.650 4.548 4.055 4.789 0.575 19 1 "[ . 1 . +2]" 1
726 1 28 ILE MD 1 28 ILE MG 3.650 3.280 4.020 1.920 1.880 1.947 1.400 20 20 [****************-**+] 1
727 1 28 ILE MD 1 32 PHE QD 5.070 4.560 5.580 4.409 4.238 4.683 0.322 4 0 "[ . 1 . 2]" 1
728 1 28 ILE MD 1 32 PHE QE 5.030 4.530 5.530 4.626 4.452 4.854 0.078 2 0 "[ . 1 . 2]" 1
729 1 28 ILE MD 1 41 ALA HA 5.500 4.950 6.050 3.948 3.710 4.221 1.240 15 20 [***-**********+*****] 1
730 1 28 ILE MD 1 42 LYS H 4.530 4.080 4.980 4.146 3.950 4.411 0.130 15 0 "[ . 1 . 2]" 1
731 1 28 ILE MD 1 42 LYS HA 5.500 4.950 6.050 5.755 5.494 6.093 0.043 4 0 "[ . 1 . 2]" 1
732 1 28 ILE MD 1 43 VAL QG 3.270 2.940 3.600 3.393 3.121 3.781 0.181 4 0 "[ . 1 . 2]" 1
733 1 28 ILE MD 1 56 GLY H 5.470 4.920 6.020 5.061 4.719 5.366 0.201 10 0 "[ . 1 . 2]" 1
734 1 28 ILE MD 1 56 GLY QA 4.650 4.180 4.810 3.375 2.970 3.712 1.210 3 19 "[**+ *********-******]" 1
735 1 28 ILE MD 1 57 PHE H 4.470 4.020 4.920 3.686 3.491 3.909 0.529 13 3 "[ * . 1 + .- 2]" 1
736 1 28 ILE MD 1 57 PHE QD 5.500 4.950 6.050 5.506 5.136 5.917 . 0 0 "[ . 1 . 2]" 1
737 1 28 ILE MD 1 58 VAL HB 3.900 3.510 4.290 4.369 4.081 4.495 0.205 9 0 "[ . 1 . 2]" 1
738 1 28 ILE MD 1 58 VAL QG 3.960 3.560 4.360 1.958 1.828 2.097 1.732 19 20 [***-**************+*] 1
739 1 28 ILE QG 1 29 LEU H 5.500 4.950 6.050 4.810 4.761 4.869 0.189 2 0 "[ . 1 . 2]" 1
740 1 28 ILE QG 1 29 LEU HA 5.500 4.950 6.050 5.335 5.220 5.491 . 0 0 "[ . 1 . 2]" 1
741 1 28 ILE QG 1 32 PHE QB 5.500 4.950 6.050 3.502 3.284 4.193 1.666 14 20 [*************+*-****] 1
742 1 28 ILE QG 1 32 PHE QE 5.190 4.950 5.710 4.258 4.136 4.413 0.814 3 20 [**+-****************] 1
743 1 28 ILE QG 1 41 ALA MB 4.650 4.180 5.120 4.798 4.710 4.892 . 0 0 "[ . 1 . 2]" 1
744 1 28 ILE QG 1 43 VAL QG 5.090 4.580 5.600 4.140 3.961 4.375 0.619 9 8 "[* ****+1 * -]" 1
745 1 28 ILE QG 1 57 PHE H 5.500 4.950 6.050 5.845 5.632 6.013 . 0 0 "[ . 1 . 2]" 1
746 1 28 ILE QG 1 58 VAL HB 4.150 3.730 4.570 5.715 4.849 6.213 1.643 4 19 "[***+************-* *]" 1
747 1 28 ILE QG 1 58 VAL QG 4.600 4.570 5.060 3.048 2.581 3.395 1.989 19 20 [***-**************+*] 1
748 1 28 ILE MG 1 29 LEU H 3.840 3.460 4.220 3.252 3.169 3.368 0.291 6 0 "[ . 1 . 2]" 1
749 1 28 ILE MG 1 29 LEU HA 4.930 4.440 5.420 3.100 2.957 3.167 1.483 9 20 [*****-**+***********] 1
750 1 28 ILE MG 1 41 ALA HA 5.180 4.660 5.700 3.028 2.862 3.249 1.798 7 20 [***-**+*************] 1
751 1 28 ILE MG 1 41 ALA MB 3.500 3.150 3.850 2.039 1.951 2.097 1.199 6 20 [*****+*********-****] 1
752 1 28 ILE MG 1 42 LYS H 4.630 4.170 5.090 3.850 3.733 3.978 0.437 6 0 "[ . 1 . 2]" 1
753 1 28 ILE MG 1 42 LYS HA 5.140 4.630 5.650 5.076 4.894 5.343 . 0 0 "[ . 1 . 2]" 1
754 1 28 ILE MG 1 43 VAL H 5.110 4.600 5.620 5.741 5.643 5.869 0.249 9 0 "[ . 1 . 2]" 1
755 1 28 ILE MG 1 43 VAL QG 3.580 3.220 3.940 4.163 4.064 4.458 0.518 16 1 "[ . 1 .+ 2]" 1
756 1 28 ILE MG 1 57 PHE H 5.180 4.660 5.700 4.928 4.647 5.159 0.013 3 0 "[ . 1 . 2]" 1
757 1 28 ILE MG 1 58 VAL H 5.500 4.950 6.050 5.643 5.277 6.079 0.029 14 0 "[ . 1 . 2]" 1
758 1 28 ILE MG 1 58 VAL HB 3.470 3.120 3.820 5.011 4.368 5.424 1.604 12 20 [***********+******-*] 1
759 1 28 ILE MG 1 58 VAL QG 3.870 3.480 4.260 2.464 1.970 2.775 1.510 19 20 [***********-******+*] 1
760 1 29 LEU H 1 29 LEU QB 3.500 3.150 3.690 2.366 2.261 2.451 0.889 18 20 [-****************+**] 1
761 1 29 LEU H 1 29 LEU QD 5.350 4.810 5.890 3.962 3.894 4.001 0.916 18 20 [*****************+*-] 1
762 1 29 LEU H 1 30 GLN QB 4.950 4.460 5.440 4.330 4.230 4.438 0.230 20 0 "[ . 1 . 2]" 1
763 1 29 LEU H 1 30 GLN QE 4.120 3.710 4.530 4.026 3.801 4.456 . 0 0 "[ . 1 . 2]" 1
764 1 29 LEU H 1 33 MET QG 5.500 4.950 6.050 6.347 6.237 6.474 0.424 20 0 "[ . 1 . 2]" 1
765 1 29 LEU H 1 41 ALA MB 4.410 3.970 4.850 4.689 4.543 4.809 . 0 0 "[ . 1 . 2]" 1
766 1 29 LEU H 1 58 VAL QG 5.500 4.950 6.050 5.585 5.177 5.789 . 0 0 "[ . 1 . 2]" 1
767 1 29 LEU HA 1 29 LEU QD 3.350 3.010 3.690 2.447 2.319 2.614 0.691 8 16 "[**- ***+*** ***** *2]" 1
768 1 29 LEU HA 1 29 LEU HG 4.210 3.790 4.630 3.366 3.312 3.432 0.478 13 0 "[ . 1 . 2]" 1
769 1 29 LEU HA 1 31 MET H 5.130 4.620 5.640 5.183 4.893 5.354 . 0 0 "[ . 1 . 2]" 1
770 1 29 LEU HA 1 31 MET QB 5.500 4.950 6.050 6.411 6.265 6.500 0.450 18 0 "[ . 1 . 2]" 1
771 1 29 LEU HA 1 32 PHE H 4.820 4.340 5.300 4.366 4.262 4.441 0.078 20 0 "[ . 1 . 2]" 1
772 1 29 LEU HA 1 32 PHE QB 5.500 4.950 6.050 4.261 4.176 4.374 0.774 7 20 [******+********-****] 1
773 1 29 LEU HA 1 33 MET H 5.260 4.730 5.790 5.284 5.001 5.605 . 0 0 "[ . 1 . 2]" 1
774 1 29 LEU HA 1 33 MET QG 5.100 4.590 5.610 4.627 4.482 4.841 0.108 7 0 "[ . 1 . 2]" 1
775 1 29 LEU HA 1 38 VAL QG 5.310 4.780 5.310 3.334 3.119 3.508 1.661 7 20 [******+-************] 1
776 1 29 LEU HA 1 41 ALA HA 5.500 4.950 6.050 6.224 6.089 6.320 0.270 18 0 "[ . 1 . 2]" 1
777 1 29 LEU HA 1 41 ALA MB 3.860 3.470 4.250 3.843 3.714 3.955 . 0 0 "[ . 1 . 2]" 1
778 1 29 LEU HA 1 58 VAL QG 5.420 4.880 5.430 4.359 4.085 4.518 0.795 19 10 "[ ** * ** * - . * +*]" 1
779 1 29 LEU QB 1 30 GLN H 3.530 3.480 3.880 2.832 2.672 3.034 0.808 7 18 "[***** +****-*******2]" 1
780 1 29 LEU QB 1 30 GLN HA 5.500 4.950 6.050 4.543 4.387 4.709 0.563 15 4 "[* . *- 1 + 2]" 1
781 1 29 LEU QB 1 30 GLN QE 5.500 4.950 6.050 4.289 3.857 4.467 1.093 10 19 "[*********+* *-******]" 1
782 1 29 LEU QB 1 30 GLN QG 5.270 4.740 5.800 3.925 3.311 4.933 1.429 13 14 "[ ***** ***-+*. ***2]" 1
783 1 29 LEU QB 1 33 MET QG 5.500 4.950 6.050 5.253 5.100 5.296 . 0 0 "[ . 1 . 2]" 1
784 1 29 LEU QB 1 38 VAL QG 5.500 4.950 6.050 4.248 4.059 4.418 0.891 18 20 [*******-*********+**] 1
785 1 29 LEU QB 1 41 ALA HA 5.500 4.950 6.050 5.933 5.719 6.045 . 0 0 "[ . 1 . 2]" 1
786 1 29 LEU QB 1 41 ALA MB 4.200 3.780 4.220 3.298 3.160 3.407 0.620 20 5 "[ * 1 *. * -+]" 1
787 1 29 LEU QD 1 30 GLN H 4.480 4.030 4.930 4.142 4.076 4.233 . 0 0 "[ . 1 . 2]" 1
788 1 29 LEU QD 1 30 GLN HA 4.890 4.400 5.380 4.490 4.384 4.567 0.016 8 0 "[ . 1 . 2]" 1
789 1 29 LEU QD 1 30 GLN QE 5.060 4.550 5.570 5.088 4.627 5.266 . 0 0 "[ . 1 . 2]" 1
790 1 29 LEU QD 1 31 MET H 5.470 4.920 6.020 5.899 5.715 6.014 . 0 0 "[ . 1 . 2]" 1
791 1 29 LEU QD 1 32 PHE H 5.500 4.950 6.050 5.474 5.314 5.599 . 0 0 "[ . 1 . 2]" 1
792 1 29 LEU QD 1 32 PHE QB 5.500 4.950 6.050 5.164 4.962 5.395 . 0 0 "[ . 1 . 2]" 1
793 1 29 LEU QD 1 33 MET H 5.090 4.580 5.600 5.529 5.325 5.692 0.092 4 0 "[ . 1 . 2]" 1
794 1 29 LEU QD 1 33 MET HA 4.790 4.310 5.270 4.811 4.635 5.121 . 0 0 "[ . 1 . 2]" 1
795 1 29 LEU QD 1 33 MET QB 5.240 4.720 5.760 4.504 4.360 4.610 0.360 20 0 "[ . 1 . 2]" 1
796 1 29 LEU QD 1 33 MET QG 3.950 3.550 4.350 3.377 3.270 3.471 0.280 12 0 "[ . 1 . 2]" 1
797 1 29 LEU QD 1 38 VAL H 5.050 4.540 5.560 4.540 4.287 4.795 0.253 11 0 "[ . 1 . 2]" 1
798 1 29 LEU QD 1 38 VAL HB 4.150 3.730 4.570 4.638 4.474 4.796 0.226 14 0 "[ . 1 . 2]" 1
799 1 29 LEU QD 1 38 VAL QG 3.780 3.400 3.850 2.290 2.152 2.424 1.248 5 20 [****+***-***********] 1
800 1 29 LEU QD 1 39 ILE H 5.500 4.950 6.050 5.925 5.642 6.142 0.092 12 0 "[ . 1 . 2]" 1
801 1 29 LEU QD 1 39 ILE QG 5.390 4.850 5.930 6.585 6.356 6.839 0.909 12 14 "[****.* *1 + -******]" 1
802 1 29 LEU QD 1 40 SER HA 5.470 4.920 6.020 5.928 5.663 6.115 0.095 16 0 "[ . 1 . 2]" 1
803 1 29 LEU QD 1 41 ALA MB 3.390 3.050 3.730 3.116 3.006 3.305 0.044 8 0 "[ . 1 . 2]" 1
804 1 29 LEU QD 1 58 VAL QG 5.240 4.720 5.760 4.577 4.417 4.700 0.303 8 0 "[ . 1 . 2]" 1
805 1 29 LEU HG 1 30 GLN H 4.530 4.080 4.980 3.963 3.904 4.044 0.176 4 0 "[ . 1 . 2]" 1
806 1 29 LEU HG 1 30 GLN HA 4.630 4.170 5.090 4.125 4.061 4.205 0.109 12 0 "[ . 1 . 2]" 1
807 1 29 LEU HG 1 30 GLN QB 4.680 4.210 5.150 5.056 4.228 5.443 0.293 20 0 "[ . 1 . 2]" 1
808 1 29 LEU HG 1 30 GLN QE 5.500 4.950 6.050 5.701 5.313 5.864 . 0 0 "[ . 1 . 2]" 1
809 1 29 LEU HG 1 31 MET H 5.500 4.950 6.050 6.384 6.295 6.463 0.413 13 0 "[ . 1 . 2]" 1
810 1 29 LEU HG 1 32 PHE H 5.500 4.950 6.050 6.440 6.348 6.549 0.499 4 0 "[ . 1 . 2]" 1
811 1 29 LEU HG 1 33 MET QB 5.500 4.950 6.050 4.906 4.798 5.032 0.152 20 0 "[ . 1 . 2]" 1
812 1 29 LEU HG 1 33 MET QG 4.580 4.120 5.040 4.043 3.934 4.105 0.186 20 0 "[ . 1 . 2]" 1
813 1 29 LEU HG 1 38 VAL QG 5.500 4.950 6.050 4.253 4.012 4.397 0.938 7 20 [******+*-***********] 1
814 1 29 LEU HG 1 41 ALA MB 3.960 3.560 4.360 5.474 5.374 5.561 1.201 6 20 [*****+*-************] 1
815 1 30 GLN H 1 30 GLN QB 3.020 2.720 3.320 2.576 2.489 2.647 0.231 20 0 "[ . 1 . 2]" 1
816 1 30 GLN H 1 30 GLN QG . 3.800 4.070 2.776 2.266 3.072 1.534 15 20 [**************+****-] 1
817 1 30 GLN H 1 31 MET H 3.530 3.180 3.880 2.697 2.549 2.781 0.631 3 6 "[ +*. -1 *. ** 2]" 1
818 1 30 GLN H 1 31 MET QB 5.500 4.950 6.050 4.640 4.549 4.793 0.401 9 0 "[ . 1 . 2]" 1
819 1 30 GLN H 1 32 PHE H 4.060 3.650 4.470 4.034 3.863 4.310 . 0 0 "[ . 1 . 2]" 1
820 1 30 GLN H 1 33 MET QG 5.500 4.950 6.050 5.340 4.970 5.433 . 0 0 "[ . 1 . 2]" 1
821 1 30 GLN H 1 41 ALA MB 5.500 4.950 6.050 6.142 6.038 6.255 0.205 12 0 "[ . 1 . 2]" 1
822 1 30 GLN HA 1 30 GLN QB 2.910 2.620 3.200 2.350 2.172 2.468 0.448 8 0 "[ . 1 . 2]" 1
823 1 30 GLN HA 1 30 GLN QE 5.500 4.950 6.050 4.524 4.302 4.878 0.648 12 11 "[ **** *1*+ *. -**2]" 1
824 1 30 GLN HA 1 30 GLN QG . 3.330 3.610 2.790 2.563 3.342 0.767 20 15 "[ ***** ****-*. ***+]" 1
825 1 30 GLN HA 1 33 MET QG 4.220 3.800 4.640 3.513 2.813 3.694 0.987 8 3 "[ -* . + 1 . 2]" 1
826 1 30 GLN QG 1 31 MET H 3.820 3.440 4.200 3.744 2.183 4.296 1.257 16 5 "[* . ** 1 -+ 2]" 1
827 1 31 MET H 1 31 MET QB 3.490 3.140 3.840 2.405 2.356 2.462 0.784 8 20 [**-****+************] 1
828 1 31 MET H 1 31 MET QG 4.350 3.910 4.790 4.288 4.234 4.358 . 0 0 "[ . 1 . 2]" 1
829 1 31 MET H 1 32 PHE H 3.600 3.240 3.960 2.887 2.623 2.966 0.617 15 2 "[ . - 1 + 2]" 1
830 1 31 MET H 1 32 PHE QB 5.500 4.950 6.050 4.504 4.060 4.682 0.890 15 4 "[* .-* 1 + 2]" 1
831 1 31 MET H 1 32 PHE QD 5.350 4.810 5.890 5.220 4.866 5.498 . 0 0 "[ . 1 . 2]" 1
832 1 31 MET H 1 33 MET H 4.800 4.320 5.280 4.225 4.040 4.390 0.280 15 0 "[ . 1 . 2]" 1
833 1 31 MET HA 1 31 MET QG 3.960 3.560 4.360 3.085 2.647 3.226 0.913 8 4 "[ * . + 1 .-* 2]" 1
834 1 31 MET HA 1 32 PHE QB 5.500 4.950 6.050 5.126 4.964 5.289 . 0 0 "[ . 1 . 2]" 1
835 1 31 MET HA 1 33 MET H 4.420 3.980 4.860 3.849 3.720 3.931 0.260 14 0 "[ . 1 . 2]" 1
836 1 31 MET HA 1 34 PRO QD 5.500 4.950 6.050 3.684 3.368 3.980 1.582 11 20 [**********+*****-***] 1
837 1 31 MET QB 1 32 PHE H 4.210 3.790 4.630 3.442 3.400 3.521 0.390 4 0 "[ . 1 . 2]" 1
838 1 31 MET QB 1 32 PHE HA 5.500 4.950 6.050 4.625 4.550 4.702 0.400 13 0 "[ . 1 . 2]" 1
839 1 31 MET QB 1 32 PHE QD 3.870 3.480 4.260 3.511 3.206 3.887 0.274 8 0 "[ . 1 . 2]" 1
840 1 31 MET QB 1 32 PHE QE 5.120 4.610 5.630 5.097 4.614 5.510 . 0 0 "[ . 1 . 2]" 1
841 1 31 MET QB 1 33 MET H 5.500 4.950 6.050 4.931 4.886 5.007 0.064 9 0 "[ . 1 . 2]" 1
842 1 31 MET QG 1 32 PHE H 5.500 4.950 6.050 4.551 4.310 4.741 0.640 4 2 "[ +. -1 . 2]" 1
843 1 31 MET QG 1 32 PHE QB 5.230 4.710 5.750 4.889 4.596 5.527 0.114 13 0 "[ . 1 . 2]" 1
844 1 31 MET QG 1 32 PHE QD 5.500 4.950 6.050 3.836 3.591 4.317 1.359 1 20 [+******-************] 1
845 1 31 MET QG 1 32 PHE QE 5.500 4.950 6.050 4.693 4.514 5.018 0.436 20 0 "[ . 1 . 2]" 1
846 1 31 MET QG 1 34 PRO QD 5.500 4.950 6.050 5.172 4.913 5.442 0.037 1 0 "[ . 1 . 2]" 1
847 1 31 MET QG 1 76 PHE QB 5.500 4.950 6.050 5.863 5.547 6.574 0.524 14 1 "[ . 1 +. 2]" 1
848 1 32 PHE H 1 32 PHE QB . 3.550 3.880 2.213 2.123 2.281 1.427 19 20 [***************-**+*] 1
849 1 32 PHE H 1 32 PHE QD 4.090 3.680 4.500 3.677 3.439 3.862 0.241 3 0 "[ . 1 . 2]" 1
850 1 32 PHE H 1 33 MET H 3.360 3.020 3.700 2.313 2.111 2.561 0.909 15 16 "[**- *** *** * +*****]" 1
851 1 32 PHE H 1 33 MET QG 5.380 4.840 5.920 5.050 4.863 5.202 . 0 0 "[ . 1 . 2]" 1
852 1 32 PHE H 1 34 PRO QD 5.500 4.950 6.050 3.952 3.719 4.310 1.231 15 20 [***-**********+*****] 1
853 1 32 PHE H 1 38 VAL QG 5.120 4.610 5.630 5.008 4.747 5.273 . 0 0 "[ . 1 . 2]" 1
854 1 32 PHE H 1 58 VAL QG 5.500 4.950 5.580 4.825 4.493 5.053 0.457 8 0 "[ . 1 . 2]" 1
855 1 32 PHE HA 1 32 PHE QD 3.790 3.410 4.170 3.077 3.027 3.121 0.383 4 0 "[ . 1 . 2]" 1
856 1 32 PHE HA 1 34 PRO QD 4.390 3.950 4.830 3.375 2.688 3.709 1.262 1 6 "[+ * * -* * 2]" 1
857 1 32 PHE HA 1 69 ALA MB 5.500 4.950 6.050 5.094 4.882 5.352 0.068 3 0 "[ . 1 . 2]" 1
858 1 32 PHE QB 1 38 VAL QG . 4.950 5.310 3.717 3.440 4.067 1.510 13 20 [***-********+*******] 1
859 1 32 PHE QB 1 58 VAL QG . 4.440 4.720 2.601 2.324 2.859 2.116 7 20 [******+*********-***] 1
860 1 32 PHE QB 1 60 TYR QE 5.500 4.950 6.050 4.396 3.614 4.741 1.336 8 4 "[ * . + 1 .* -]" 1
861 1 32 PHE QD 1 33 MET H 5.220 4.700 5.740 5.138 5.096 5.203 . 0 0 "[ . 1 . 2]" 1
862 1 32 PHE QD 1 38 VAL QG 5.500 4.950 6.050 4.843 4.460 5.357 0.490 13 0 "[ . 1 . 2]" 1
863 1 32 PHE QD 1 60 TYR QE 4.090 3.680 4.500 3.477 2.972 3.656 0.708 3 2 "[ + . 1 - . 2]" 1
864 1 32 PHE QD 1 69 ALA MB 3.850 3.470 4.230 3.690 3.199 3.926 0.271 3 0 "[ . 1 . 2]" 1
865 1 32 PHE QD 1 85 VAL QG 5.500 4.950 6.030 5.009 4.831 5.130 0.119 10 0 "[ . 1 . 2]" 1
866 1 32 PHE QE 1 58 VAL QG 5.170 4.950 5.690 3.154 2.790 3.835 2.160 10 20 [*********+*******-**] 1
867 1 32 PHE QE 1 69 ALA MB 4.090 3.680 4.500 3.086 2.333 3.488 1.347 18 9 "[ **.* 1 *-.**+ *]" 1
868 1 32 PHE QE 1 73 MET QB 4.420 3.980 4.860 3.792 3.553 3.982 0.427 18 0 "[ . 1 . 2]" 1
869 1 32 PHE QE 1 73 MET QG 5.120 4.610 5.630 2.658 2.518 2.820 2.092 3 20 [**+****************-] 1
870 1 32 PHE QE 1 83 LEU QD 5.500 4.950 6.050 2.607 2.394 3.367 2.556 9 20 [********+**********-] 1
871 1 32 PHE QE 1 83 LEU HG 4.280 3.850 4.710 4.818 4.324 4.983 0.273 3 0 "[ . 1 . 2]" 1
872 1 32 PHE QE 1 85 VAL QG 4.300 3.870 4.380 3.390 3.205 3.543 0.665 10 9 "[- * * *+* *** 2]" 1
873 1 33 MET H 1 33 MET QB 3.690 3.320 4.060 2.127 2.050 2.184 1.270 5 20 [****+***********-***] 1
874 1 33 MET H 1 33 MET QG 3.860 3.470 4.250 3.695 3.529 3.815 . 0 0 "[ . 1 . 2]" 1
875 1 33 MET H 1 34 PRO HA 5.500 4.950 6.050 5.442 5.316 5.592 . 0 0 "[ . 1 . 2]" 1
876 1 33 MET H 1 34 PRO QD 4.100 3.690 4.510 2.272 2.038 2.507 1.652 8 20 [****-**+************] 1
877 1 33 MET H 1 34 PRO QG 4.580 4.120 5.040 4.186 3.904 4.469 0.216 8 0 "[ . 1 . 2]" 1
878 1 33 MET H 1 38 VAL QG 4.800 4.320 5.280 4.787 4.382 5.081 . 0 0 "[ . 1 . 2]" 1
879 1 33 MET H 1 58 VAL QG 5.500 4.950 6.050 5.756 5.533 5.962 . 0 0 "[ . 1 . 2]" 1
880 1 33 MET HA 1 33 MET QG 3.840 3.460 4.220 2.234 2.091 2.552 1.369 20 20 [***********-*******+] 1
881 1 33 MET HA 1 35 PHE H 5.380 4.840 5.920 4.136 3.798 4.459 1.042 18 15 "[ ** .****-*** .**+**]" 1
882 1 33 MET HA 1 36 GLY H 4.160 3.740 4.580 4.194 3.690 4.467 0.050 3 0 "[ . 1 . 2]" 1
883 1 33 MET HA 1 38 VAL QG 3.430 3.090 3.770 3.209 2.957 3.635 0.133 14 0 "[ . 1 . 2]" 1
884 1 33 MET HA 1 60 TYR QE 4.270 3.840 4.700 4.023 3.802 4.330 0.038 4 0 "[ . 1 . 2]" 1
885 1 33 MET QB 1 34 PRO QD 5.500 4.950 6.050 2.555 2.330 3.010 2.620 20 20 [-******************+] 1
886 1 33 MET QB 1 38 VAL QG 4.960 4.950 5.460 4.243 4.025 4.517 0.925 7 19 "[** ***+********-****]" 1
887 1 33 MET QG 1 38 VAL H 5.500 4.950 6.050 4.774 4.090 5.539 0.860 7 4 "[ . + -* *. 2]" 1
888 1 33 MET QG 1 38 VAL HB 4.750 4.280 5.220 5.044 4.594 5.408 0.188 9 0 "[ . 1 . 2]" 1
889 1 33 MET QG 1 58 VAL QG 5.500 4.950 6.050 6.013 5.682 6.237 0.187 8 0 "[ . 1 . 2]" 1
890 1 33 MET QG 1 60 TYR QE 5.500 4.950 6.050 5.353 4.837 5.864 0.113 4 0 "[ . 1 . 2]" 1
891 1 34 PRO HA 1 35 PHE HA 4.720 4.250 5.190 4.499 4.464 4.541 . 0 0 "[ . 1 . 2]" 1
892 1 34 PRO HA 1 35 PHE QD 5.500 4.950 6.050 5.571 5.530 5.665 . 0 0 "[ . 1 . 2]" 1
893 1 34 PRO HA 1 36 GLY H 5.500 4.950 6.050 4.108 3.748 4.623 1.202 4 19 "[** +**-*************]" 1
894 1 34 PRO QB 1 35 PHE HA 5.500 4.950 6.050 4.570 4.498 4.646 0.452 4 0 "[ . 1 . 2]" 1
895 1 34 PRO QB 1 35 PHE QD 5.120 4.610 5.630 4.446 4.352 4.568 0.258 6 0 "[ . 1 . 2]" 1
896 1 34 PRO QB 1 35 PHE QE 5.500 4.950 6.050 4.702 4.561 4.822 0.389 7 0 "[ . 1 . 2]" 1
897 1 34 PRO QD 1 35 PHE H 5.200 4.680 5.720 3.683 3.479 3.810 1.201 1 20 [+***********-*******] 1
898 1 34 PRO QD 1 35 PHE QD 5.500 4.950 6.050 4.835 4.611 4.983 0.339 1 0 "[ . 1 . 2]" 1
899 1 34 PRO QD 1 35 PHE QE 5.500 4.950 6.050 4.937 4.844 5.162 0.106 17 0 "[ . 1 . 2]" 1
900 1 34 PRO QD 1 58 VAL QG 5.480 4.930 6.030 6.500 6.047 6.906 0.876 17 11 "[ ***. * 1 -**.*+**2]" 1
901 1 34 PRO QG 1 35 PHE H 5.230 4.710 5.750 3.127 2.950 3.309 1.760 15 20 [**************+**-**] 1
902 1 34 PRO QG 1 35 PHE HA 5.500 4.950 6.050 4.926 4.808 5.027 0.142 15 0 "[ . 1 . 2]" 1
903 1 34 PRO QG 1 35 PHE QB 5.500 4.950 6.050 4.842 4.642 4.937 0.308 15 0 "[ . 1 . 2]" 1
904 1 34 PRO QG 1 35 PHE QE 4.520 4.070 4.970 3.758 3.559 3.883 0.511 15 1 "[ . 1 + 2]" 1
905 1 34 PRO QG 1 72 ALA MB 4.830 4.350 5.310 5.561 4.932 6.202 0.892 18 3 "[ -. 1 *. + 2]" 1
906 1 35 PHE H 1 35 PHE QB . 3.730 4.070 3.089 2.972 3.197 0.758 5 20 [**-*+***************] 1
907 1 35 PHE H 1 35 PHE QD 3.660 3.290 4.030 3.042 2.986 3.101 0.304 5 0 "[ . 1 . 2]" 1
908 1 35 PHE H 1 35 PHE QE 5.390 4.850 5.930 4.610 4.410 4.756 0.440 12 0 "[ . 1 . 2]" 1
909 1 35 PHE H 1 36 GLY H 3.290 2.960 3.620 2.624 2.569 2.674 0.391 6 0 "[ . 1 . 2]" 1
910 1 35 PHE H 1 36 GLY QA 5.500 4.950 6.050 4.503 4.450 4.547 0.500 3 1 "[ + . 1 . 2]" 1
911 1 35 PHE H 1 68 ALA MB 5.500 4.950 6.050 6.343 6.146 6.789 0.739 8 3 "[ * . + 1 .- 2]" 1
912 1 35 PHE HA 1 35 PHE QD 3.560 3.200 3.920 3.183 3.066 3.418 0.134 1 0 "[ . 1 . 2]" 1
913 1 35 PHE HA 1 36 GLY QA 4.360 3.920 4.800 3.981 3.933 4.014 . 0 0 "[ . 1 . 2]" 1
914 1 35 PHE HA 1 68 ALA MB 5.010 4.510 5.510 5.368 4.678 5.637 0.127 5 0 "[ . 1 . 2]" 1
915 1 35 PHE QB 1 36 GLY H . 4.380 4.650 3.886 3.735 3.928 0.645 3 6 "[* + . -* * . *]" 1
916 1 35 PHE QB 1 36 GLY QA 5.500 4.950 6.050 4.136 3.971 4.217 0.979 13 20 [************+***-***] 1
917 1 35 PHE QB 1 65 SER HA 4.840 4.360 5.320 3.961 3.722 4.269 0.638 3 3 "[ + . * 1 .- 2]" 1
918 1 35 PHE QB 1 65 SER QB 4.960 4.460 5.460 3.137 2.723 3.546 1.737 3 20 [**+**************-**] 1
919 1 35 PHE QB 1 69 ALA H . 4.730 5.120 4.720 4.398 4.899 0.332 18 0 "[ . 1 . 2]" 1
920 1 35 PHE QB 1 69 ALA HA 5.500 4.950 6.050 5.362 4.874 5.636 0.076 18 0 "[ . 1 . 2]" 1
921 1 35 PHE QB 1 69 ALA MB 5.190 4.670 5.580 4.107 3.480 4.331 1.190 18 9 "[ ** . * 1 - .**+**]" 1
922 1 35 PHE QD 1 36 GLY H 4.530 4.080 4.980 4.830 4.391 5.017 0.037 13 0 "[ . 1 . 2]" 1
923 1 35 PHE QD 1 60 TYR QE 4.800 4.320 5.280 3.873 3.225 4.420 1.095 19 9 "[ ** .* * 1 * .*- +*]" 1
924 1 35 PHE QD 1 68 ALA HA 5.500 4.950 6.050 6.005 5.666 6.161 0.111 14 0 "[ . 1 . 2]" 1
925 1 35 PHE QD 1 68 ALA MB 4.150 3.730 4.570 3.476 3.081 3.621 0.649 3 1 "[ + . 1 . 2]" 1
926 1 35 PHE QD 1 69 ALA H 5.190 4.670 5.710 4.685 4.399 5.161 0.271 5 0 "[ . 1 . 2]" 1
927 1 35 PHE QD 1 69 ALA HA 4.300 3.870 4.730 4.315 3.931 4.638 . 0 0 "[ . 1 . 2]" 1
928 1 35 PHE QD 1 69 ALA MB 3.860 3.470 4.250 3.228 3.143 3.363 0.327 11 0 "[ . 1 . 2]" 1
929 1 35 PHE QD 1 72 ALA MB 4.980 4.480 5.480 5.058 4.686 5.280 . 0 0 "[ . 1 . 2]" 1
930 1 35 PHE QE 1 68 ALA MB 3.710 3.340 4.080 3.795 3.451 4.254 0.174 18 0 "[ . 1 . 2]" 1
931 1 35 PHE QE 1 69 ALA HA 5.120 4.610 5.630 3.274 2.601 4.294 2.009 11 19 "[**********+*****- **]" 1
932 1 35 PHE QE 1 72 ALA MB 3.420 3.080 3.760 3.292 3.066 3.524 0.014 7 0 "[ . 1 . 2]" 1
933 1 35 PHE QE 1 73 MET H 5.500 4.950 6.050 6.168 5.932 6.315 0.265 18 0 "[ . 1 . 2]" 1
934 1 36 GLY H 1 37 ASN H 4.590 4.130 5.050 4.617 4.557 4.685 . 0 0 "[ . 1 . 2]" 1
935 1 36 GLY H 1 38 VAL QG 5.190 4.670 5.710 5.156 4.846 5.489 . 0 0 "[ . 1 . 2]" 1
936 1 36 GLY H 1 60 TYR QD 4.980 4.480 5.480 5.105 4.684 5.333 . 0 0 "[ . 1 . 2]" 1
937 1 36 GLY H 1 60 TYR QE 3.760 3.380 4.140 4.021 3.572 4.179 0.039 16 0 "[ . 1 . 2]" 1
938 1 36 GLY QA 1 37 ASN H 3.410 3.150 3.750 2.407 2.302 2.508 0.848 20 20 [*************-*****+] 1
939 1 36 GLY QA 1 37 ASN QB 4.710 4.500 5.180 4.038 3.960 4.163 0.540 14 6 "[ * *1-* +. * 2]" 1
940 1 36 GLY QA 1 60 TYR QD . 4.870 5.020 4.209 3.465 4.394 1.405 18 16 "[** *.** -1*******+**]" 1
941 1 36 GLY QA 1 60 TYR QE 5.500 4.950 5.540 4.428 3.418 4.764 1.532 18 5 "[ . - 1 **. *+ 2]" 1
942 1 36 GLY QA 1 62 ASN HD21 5.500 4.950 6.050 5.857 5.568 6.012 . 0 0 "[ . 1 . 2]" 1
943 1 36 GLY QA 1 65 SER QB . 4.950 5.370 3.859 3.164 4.081 1.786 18 20 [*************-***+**] 1
944 1 37 ASN H 1 37 ASN QB 3.070 2.760 3.380 2.722 2.636 2.867 0.124 18 0 "[ . 1 . 2]" 1
945 1 37 ASN H 1 37 ASN QD . 4.950 5.400 4.273 4.157 4.412 0.793 4 20 [***+*********-******] 1
946 1 37 ASN H 1 38 VAL H 4.820 4.340 5.300 4.637 4.588 4.685 . 0 0 "[ . 1 . 2]" 1
947 1 37 ASN H 1 38 VAL HA 5.500 4.950 6.050 5.364 5.259 5.475 . 0 0 "[ . 1 . 2]" 1
948 1 37 ASN H 1 38 VAL QG 5.500 4.950 6.050 5.078 4.894 5.166 0.056 6 0 "[ . 1 . 2]" 1
949 1 37 ASN H 1 60 TYR HA 5.500 4.950 6.050 5.721 5.551 6.004 . 0 0 "[ . 1 . 2]" 1
950 1 37 ASN H 1 60 TYR QD 4.230 3.810 4.650 4.110 3.778 4.421 0.032 18 0 "[ . 1 . 2]" 1
951 1 37 ASN H 1 60 TYR QE 5.340 4.810 5.870 5.342 4.767 5.786 0.043 18 0 "[ . 1 . 2]" 1
952 1 37 ASN H 1 61 ASP H 5.110 4.600 5.620 4.574 4.475 4.793 0.125 13 0 "[ . 1 . 2]" 1
953 1 37 ASN H 1 61 ASP QB 5.500 4.950 6.050 4.558 4.019 4.940 0.931 15 7 "[ *. ** 1 * +*- 2]" 1
954 1 37 ASN H 1 62 ASN HD21 5.500 4.950 6.050 5.617 5.427 5.915 . 0 0 "[ . 1 . 2]" 1
955 1 37 ASN H 1 62 ASN HD22 5.500 4.950 6.050 5.477 4.863 6.003 0.087 17 0 "[ . 1 . 2]" 1
956 1 37 ASN H 1 65 SER QB 5.500 4.950 6.050 5.251 4.928 5.447 0.022 10 0 "[ . 1 . 2]" 1
957 1 37 ASN HA 1 37 ASN QD 4.270 3.840 4.700 4.302 4.255 4.379 . 0 0 "[ . 1 . 2]" 1
958 1 37 ASN HA 1 38 VAL H 2.970 2.670 3.270 2.260 2.217 2.323 0.453 3 0 "[ . 1 . 2]" 1
959 1 37 ASN HA 1 38 VAL HA 4.910 4.420 5.400 4.400 4.359 4.453 0.061 1 0 "[ . 1 . 2]" 1
960 1 37 ASN HA 1 38 VAL HB 4.440 4.000 4.880 4.592 4.067 4.955 0.075 14 0 "[ . 1 . 2]" 1
961 1 37 ASN QB 1 38 VAL H 3.950 3.550 4.350 3.031 2.762 3.202 0.788 1 8 "[+ *. * *1* * * - 2]" 1
962 1 37 ASN QB 1 38 VAL HA 5.070 4.560 5.580 4.726 4.546 4.831 0.014 4 0 "[ . 1 . 2]" 1
963 1 37 ASN QB 1 38 VAL HB 5.500 4.950 6.050 5.653 5.329 5.911 . 0 0 "[ . 1 . 2]" 1
964 1 37 ASN QB 1 38 VAL QG . 4.950 5.410 4.207 3.977 4.389 0.973 1 20 [+******************-] 1
965 1 37 ASN QB 1 39 ILE MD 5.500 4.950 6.050 5.826 5.542 6.172 0.122 18 0 "[ . 1 . 2]" 1
966 1 37 ASN QB 1 60 TYR HA 5.500 4.950 6.050 6.027 5.767 6.202 0.152 7 0 "[ . 1 . 2]" 1
967 1 37 ASN QB 1 60 TYR QD 5.250 4.720 5.780 5.435 5.255 5.636 . 0 0 "[ . 1 . 2]" 1
968 1 37 ASN QD 1 38 VAL H 5.500 4.950 6.050 4.730 4.544 4.934 0.406 15 0 "[ . 1 . 2]" 1
969 1 37 ASN QD 1 39 ILE MD 5.500 4.950 6.050 4.595 4.406 5.021 0.544 8 3 "[ * + 1 .- 2]" 1
970 1 37 ASN QD 1 39 ILE MG 5.390 4.850 5.800 4.958 4.595 5.250 0.255 14 0 "[ . 1 . 2]" 1
971 1 37 ASN QD 1 61 ASP HA 5.500 4.950 6.050 5.324 4.713 5.945 0.237 17 0 "[ . 1 . 2]" 1
972 1 37 ASN QD 1 61 ASP QB 5.320 4.950 5.850 2.994 2.406 3.624 2.544 3 20 [**+*********-*******] 1
973 1 38 VAL H 1 38 VAL HB 3.290 2.960 3.620 3.240 2.913 3.491 0.047 20 0 "[ . 1 . 2]" 1
974 1 38 VAL H 1 38 VAL QG . 4.030 4.040 2.020 1.914 2.104 2.116 16 20 [***************+***-] 1
975 1 38 VAL H 1 39 ILE H 5.400 4.860 5.940 4.637 4.563 4.683 0.297 20 0 "[ . 1 . 2]" 1
976 1 38 VAL H 1 60 TYR HA 5.500 4.950 6.050 5.261 5.035 5.396 . 0 0 "[ . 1 . 2]" 1
977 1 38 VAL H 1 60 TYR QD 4.910 4.420 5.400 4.700 4.474 4.895 . 0 0 "[ . 1 . 2]" 1
978 1 38 VAL H 1 60 TYR QE 5.500 4.950 6.050 5.468 5.120 5.686 . 0 0 "[ . 1 . 2]" 1
979 1 38 VAL HA 1 39 ILE H 3.290 2.960 3.620 2.436 2.342 2.519 0.618 20 13 "[ * .**-*1** ** ***+]" 1
980 1 38 VAL HA 1 39 ILE HA 5.050 4.540 5.560 4.458 4.384 4.510 0.156 11 0 "[ . 1 . 2]" 1
981 1 38 VAL HA 1 39 ILE HB 5.210 4.690 5.730 5.416 5.302 5.481 . 0 0 "[ . 1 . 2]" 1
982 1 38 VAL HA 1 39 ILE QG 5.500 4.950 6.050 3.447 3.310 3.532 1.640 11 20 [*********-+*********] 1
983 1 38 VAL HA 1 40 SER H 4.000 3.600 4.400 4.426 4.246 4.610 0.210 11 0 "[ . 1 . 2]" 1
984 1 38 VAL HA 1 58 VAL QG 5.500 4.950 6.050 4.909 4.602 5.613 0.348 18 0 "[ . 1 . 2]" 1
985 1 38 VAL HA 1 59 SER HA 5.500 4.950 6.050 6.116 5.845 6.326 0.276 3 0 "[ . 1 . 2]" 1
986 1 38 VAL HA 1 60 TYR HA 3.830 3.450 4.210 2.612 2.430 2.741 1.020 13 20 [************+**-****] 1
987 1 38 VAL HA 1 60 TYR QB 5.470 4.920 6.020 4.502 4.276 4.651 0.644 5 4 "[ * + * - . 2]" 1
988 1 38 VAL HA 1 60 TYR QD 3.550 3.200 3.900 3.382 3.107 3.583 0.093 3 0 "[ . 1 . 2]" 1
989 1 38 VAL HA 1 60 TYR QE 5.500 4.950 6.050 4.813 4.658 4.978 0.292 3 0 "[ . 1 . 2]" 1
990 1 38 VAL HA 1 61 ASP H 4.890 4.400 5.380 4.405 4.196 4.626 0.204 5 0 "[ . 1 . 2]" 1
991 1 38 VAL HB 1 40 SER H 5.500 4.950 6.050 5.187 4.688 5.560 0.262 7 0 "[ . 1 . 2]" 1
992 1 38 VAL HB 1 58 VAL QG 5.500 4.950 6.050 3.743 3.162 4.788 1.788 18 17 "[******* ******** + -]" 1
993 1 38 VAL QG 1 39 ILE H . 4.380 4.630 2.731 2.557 2.925 1.823 7 20 [******+************-] 1
994 1 38 VAL QG 1 39 ILE HA 4.300 3.870 4.730 3.801 3.675 3.999 0.195 7 0 "[ . 1 . 2]" 1
995 1 38 VAL QG 1 40 SER HA 4.770 4.290 5.250 4.502 4.119 4.885 0.171 9 0 "[ . 1 . 2]" 1
996 1 38 VAL QG 1 40 SER QB 5.420 4.880 5.580 4.329 3.955 4.495 0.925 7 11 "[*- *. + *** ** * *2]" 1
997 1 38 VAL QG 1 41 ALA H 4.870 4.380 5.360 4.650 4.286 5.150 0.094 18 0 "[ . 1 . 2]" 1
998 1 38 VAL QG 1 58 VAL HA 5.500 4.950 6.050 3.786 3.574 4.061 1.376 1 20 [+******-************] 1
999 1 38 VAL QG 1 58 VAL HB 5.180 4.950 5.700 4.189 3.646 4.629 1.304 13 13 "[***** * ** +-. * **]" 1
1000 1 38 VAL QG 1 58 VAL QG 4.190 3.770 4.190 2.411 2.038 2.664 1.732 13 20 [************+*****-*] 1
1001 1 38 VAL QG 1 59 SER H 4.780 4.300 5.260 3.094 2.459 3.904 1.841 11 19 "[**********+-***** **]" 1
1002 1 38 VAL QG 1 60 TYR HA 4.950 4.540 5.440 3.928 3.430 4.278 1.110 5 11 "[* * + -* ** * . * **]" 1
1003 1 38 VAL QG 1 60 TYR QD 4.790 4.310 5.270 3.814 3.338 4.008 0.972 8 5 "[ * * + 1 . -*]" 1
1004 1 38 VAL QG 1 60 TYR QE 3.990 3.590 4.390 3.709 3.376 3.897 0.214 8 0 "[ . 1 . 2]" 1
1005 1 39 ILE H 1 39 ILE HB 3.820 3.440 4.200 3.150 3.080 3.218 0.360 15 0 "[ . 1 . 2]" 1
1006 1 39 ILE H 1 39 ILE MD 4.500 4.050 4.950 3.930 3.796 4.026 0.254 19 0 "[ . 1 . 2]" 1
1007 1 39 ILE H 1 39 ILE QG 4.220 3.800 4.640 2.217 2.066 2.331 1.734 9 20 [**-*****+***********] 1
1008 1 39 ILE H 1 39 ILE MG 4.310 3.880 4.740 3.906 3.849 3.963 0.031 20 0 "[ . 1 . 2]" 1
1009 1 39 ILE H 1 40 SER H 3.460 3.110 3.810 2.390 2.207 2.564 0.903 10 20 [********-+**********] 1
1010 1 39 ILE H 1 40 SER HA 5.500 4.950 6.050 5.107 4.957 5.208 . 0 0 "[ . 1 . 2]" 1
1011 1 39 ILE H 1 40 SER QB 5.450 4.900 6.000 4.616 4.257 5.211 0.643 10 2 "[ . - + . 2]" 1
1012 1 39 ILE H 1 58 VAL HA 5.500 4.950 6.050 6.005 5.805 6.162 0.112 10 0 "[ . 1 . 2]" 1
1013 1 39 ILE H 1 59 SER HA 5.500 4.950 6.050 5.402 5.089 5.663 . 0 0 "[ . 1 . 2]" 1
1014 1 39 ILE H 1 59 SER QB 5.500 4.950 6.050 4.259 4.068 4.552 0.882 5 19 "[****+********** -***]" 1
1015 1 39 ILE H 1 60 TYR HA 4.140 3.730 4.550 3.578 3.419 3.725 0.311 20 0 "[ . 1 . 2]" 1
1016 1 39 ILE H 1 60 TYR QD 5.500 4.950 6.050 5.386 5.050 5.584 . 0 0 "[ . 1 . 2]" 1
1017 1 39 ILE H 1 61 ASP H 5.450 4.900 6.000 5.556 5.327 5.795 . 0 0 "[ . 1 . 2]" 1
1018 1 39 ILE H 1 61 ASP HA 5.500 4.950 6.050 6.140 5.939 6.259 0.209 11 0 "[ . 1 . 2]" 1
1019 1 39 ILE HA 1 39 ILE MD 4.690 4.220 5.160 4.027 3.972 4.072 0.248 16 0 "[ . 1 . 2]" 1
1020 1 39 ILE HA 1 39 ILE MG 3.600 3.240 3.960 2.236 2.170 2.320 1.070 20 20 [**************-****+] 1
1021 1 39 ILE HA 1 40 SER HA 5.500 4.950 6.050 4.697 4.608 4.753 0.342 1 0 "[ . 1 . 2]" 1
1022 1 39 ILE HA 1 60 TYR HA 5.500 4.950 6.050 6.184 6.004 6.295 0.245 15 0 "[ . 1 . 2]" 1
1023 1 39 ILE HB 1 39 ILE MD 3.580 3.220 3.940 2.516 2.347 2.656 0.873 19 20 [***************-**+*] 1
1024 1 39 ILE HB 1 40 SER H 3.590 3.230 3.950 3.397 3.159 3.591 0.071 11 0 "[ . 1 . 2]" 1
1025 1 39 ILE HB 1 40 SER HA 5.250 4.720 5.780 4.558 4.452 4.687 0.268 10 0 "[ . 1 . 2]" 1
1026 1 39 ILE HB 1 40 SER QB 4.480 4.140 4.930 4.313 4.159 4.566 . 0 0 "[ . 1 . 2]" 1
1027 1 39 ILE HB 1 59 SER H 5.500 4.950 6.050 5.609 5.225 5.844 . 0 0 "[ . 1 . 2]" 1
1028 1 39 ILE HB 1 59 SER QB 5.500 4.950 5.700 4.327 4.134 4.682 0.816 15 17 "[-** ******** *+ ****]" 1
1029 1 39 ILE HB 1 60 TYR HA 5.500 4.950 6.050 5.916 5.730 6.113 0.063 14 0 "[ . 1 . 2]" 1
1030 1 39 ILE MD 1 39 ILE MG 3.020 2.720 3.320 1.990 1.933 2.059 0.787 11 20 [***-******+*********] 1
1031 1 39 ILE MD 1 40 SER H 4.910 4.420 5.400 5.048 4.885 5.206 . 0 0 "[ . 1 . 2]" 1
1032 1 39 ILE MD 1 59 SER QB 4.280 3.850 4.710 4.346 4.105 4.581 . 0 0 "[ . 1 . 2]" 1
1033 1 39 ILE MD 1 60 TYR H 5.500 4.950 6.050 5.436 4.988 5.753 . 0 0 "[ . 1 . 2]" 1
1034 1 39 ILE MD 1 60 TYR HA 5.240 4.720 5.760 4.631 4.476 4.811 0.244 7 0 "[ . 1 . 2]" 1
1035 1 39 ILE MD 1 61 ASP H 4.890 4.400 5.380 4.524 4.382 4.713 0.018 13 0 "[ . 1 . 2]" 1
1036 1 39 ILE MD 1 61 ASP HA 3.730 3.360 4.100 3.042 2.929 3.096 0.431 7 0 "[ . 1 . 2]" 1
1037 1 39 ILE MD 1 61 ASP QB 4.180 3.920 4.600 3.600 3.313 4.131 0.607 6 9 "[ -* *+ ** . ***]" 1
1038 1 39 ILE MD 1 62 ASN H 5.500 4.950 6.050 6.117 6.005 6.218 0.168 10 0 "[ . 1 . 2]" 1
1039 1 39 ILE QG 1 40 SER H 4.710 4.240 5.180 3.874 3.781 3.957 0.459 1 0 "[ . 1 . 2]" 1
1040 1 39 ILE QG 1 40 SER HA 5.500 4.950 6.050 5.831 5.744 5.900 . 0 0 "[ . 1 . 2]" 1
1041 1 39 ILE QG 1 40 SER QB 5.500 4.950 6.050 5.221 4.979 5.590 . 0 0 "[ . 1 . 2]" 1
1042 1 39 ILE QG 1 59 SER QB 5.500 4.950 5.590 4.126 4.007 4.249 0.943 9 20 [******-*+***********] 1
1043 1 39 ILE QG 1 60 TYR HA 5.380 4.840 5.920 3.612 3.456 3.710 1.384 13 20 [************+*-*****] 1
1044 1 39 ILE QG 1 61 ASP H 5.440 4.900 5.980 4.383 4.186 4.589 0.714 3 10 "[ *+ *** 1 * . **-*]" 1
1045 1 39 ILE QG 1 61 ASP HA 5.310 4.780 5.840 4.053 3.901 4.179 0.879 5 20 [****+********-******] 1
1046 1 39 ILE QG 1 61 ASP QB 5.440 4.900 5.810 4.007 3.634 4.774 1.266 10 15 "[*** ****-+** *. ***]" 1
1047 1 39 ILE MG 1 40 SER H 4.320 3.890 4.750 4.343 4.234 4.427 . 0 0 "[ . 1 . 2]" 1
1048 1 39 ILE MG 1 40 SER HA 5.500 4.950 6.050 4.708 4.617 4.796 0.333 13 0 "[ . 1 . 2]" 1
1049 1 39 ILE MG 1 40 SER QB 5.500 4.950 6.050 5.087 4.799 5.209 0.151 9 0 "[ . 1 . 2]" 1
1050 1 39 ILE MG 1 60 TYR HA 5.500 4.950 6.050 6.086 5.987 6.265 0.215 15 0 "[ . 1 . 2]" 1
1051 1 39 ILE MG 1 61 ASP H 5.500 4.950 6.050 6.567 6.420 6.905 0.855 15 7 "[ *. * ** -+* 2]" 1
1052 1 39 ILE MG 1 61 ASP HA 5.270 4.740 5.800 5.842 5.751 5.958 0.158 15 0 "[ . 1 . 2]" 1
1053 1 39 ILE MG 1 61 ASP QB 4.540 4.090 4.990 5.488 5.166 6.261 1.271 15 6 "[ *. - 1 * +** 2]" 1
1054 1 40 SER H 1 40 SER QB 4.050 3.640 4.360 2.771 2.599 3.193 1.041 11 19 "[******** *+***-*****]" 1
1055 1 40 SER H 1 41 ALA H 4.800 4.320 5.280 4.278 4.176 4.353 0.144 7 0 "[ . 1 . 2]" 1
1056 1 40 SER H 1 41 ALA MB 5.500 4.950 6.050 4.722 4.592 4.852 0.358 10 0 "[ . 1 . 2]" 1
1057 1 40 SER H 1 58 VAL HA 5.130 4.620 5.640 4.598 4.373 4.827 0.247 13 0 "[ . 1 . 2]" 1
1058 1 40 SER H 1 58 VAL QG 5.250 4.720 5.780 4.522 4.344 4.731 0.376 13 0 "[ . 1 . 2]" 1
1059 1 40 SER H 1 59 SER H 3.970 3.570 4.370 3.175 2.732 3.385 0.838 13 4 "[ * .- 1 + .* 2]" 1
1060 1 40 SER H 1 59 SER HA 5.500 4.950 6.050 5.466 5.132 5.756 . 0 0 "[ . 1 . 2]" 1
1061 1 40 SER H 1 59 SER QB 4.650 4.180 5.120 3.891 3.452 4.306 0.728 1 3 "[+ . 1- *. 2]" 1
1062 1 40 SER H 1 60 TYR HA 5.250 4.720 5.780 5.534 5.241 5.829 0.049 4 0 "[ . 1 . 2]" 1
1063 1 40 SER HA 1 41 ALA H 2.840 2.560 3.120 2.205 2.158 2.255 0.402 10 0 "[ . 1 . 2]" 1
1064 1 40 SER HA 1 41 ALA HA 4.510 4.060 4.960 4.494 4.446 4.541 . 0 0 "[ . 1 . 2]" 1
1065 1 40 SER HA 1 41 ALA MB 4.640 4.180 5.100 4.227 4.161 4.308 0.019 9 0 "[ . 1 . 2]" 1
1066 1 40 SER HA 1 59 SER H 5.500 4.950 6.050 5.216 4.930 5.820 0.020 13 0 "[ . 1 . 2]" 1
1067 1 40 SER QB 1 41 ALA H 4.020 3.640 4.420 3.418 3.224 3.551 0.416 9 0 "[ . 1 . 2]" 1
1068 1 40 SER QB 1 41 ALA HA 5.500 4.950 5.920 4.158 3.923 4.264 1.027 9 20 [******-*+***********] 1
1069 1 40 SER QB 1 41 ALA MB 5.500 4.950 6.050 4.693 4.588 4.779 0.362 9 0 "[ . 1 . 2]" 1
1070 1 40 SER QB 1 42 LYS H 5.500 4.950 6.050 5.001 4.703 5.228 0.247 9 0 "[ . 1 . 2]" 1
1071 1 40 SER QB 1 42 LYS QB 5.500 4.950 6.050 5.323 4.586 5.694 0.364 9 0 "[ . 1 . 2]" 1
1072 1 40 SER QB 1 42 LYS QG 5.500 4.950 6.050 4.478 4.159 4.821 0.791 2 12 "[*+* * *1*** **-* 2]" 1
1073 1 40 SER QB 1 57 PHE QB . 4.950 5.300 3.766 3.389 3.969 1.561 15 20 [**********-***+*****] 1
1074 1 40 SER QB 1 57 PHE QD 5.260 4.730 5.790 5.022 4.434 5.600 0.296 15 0 "[ . 1 . 2]" 1
1075 1 40 SER QB 1 58 VAL HA 5.500 4.950 6.050 3.848 3.462 4.652 1.488 13 19 "[******** ***+-******]" 1
1076 1 40 SER QB 1 59 SER H 5.110 4.600 5.280 3.040 2.537 4.068 2.063 8 20 [***-***+************] 1
1077 1 40 SER QB 1 59 SER QB 4.260 4.010 4.690 2.820 2.192 3.816 1.818 19 19 "[******** ******-**+*]" 1
1078 1 41 ALA H 1 41 ALA MB 3.810 3.430 4.190 2.660 2.565 2.771 0.865 15 20 [*******-******+*****] 1
1079 1 41 ALA H 1 42 LYS H 5.280 4.750 5.810 4.343 4.257 4.438 0.493 8 0 "[ . 1 . 2]" 1
1080 1 41 ALA H 1 42 LYS QB 5.450 4.900 6.000 4.527 4.414 4.614 0.486 6 0 "[ . 1 . 2]" 1
1081 1 41 ALA H 1 42 LYS QG 5.250 4.720 5.780 4.950 4.660 5.351 0.060 5 0 "[ . 1 . 2]" 1
1082 1 41 ALA H 1 58 VAL HA 5.250 4.720 5.780 5.577 5.422 5.946 0.166 9 0 "[ . 1 . 2]" 1
1083 1 41 ALA H 1 58 VAL QG 5.500 4.950 6.050 5.422 5.129 5.782 . 0 0 "[ . 1 . 2]" 1
1084 1 41 ALA HA 1 42 LYS H 3.170 2.850 3.490 2.468 2.385 2.520 0.465 17 0 "[ . 1 . 2]" 1
1085 1 41 ALA HA 1 42 LYS QB 4.940 4.450 5.430 4.801 4.724 4.875 . 0 0 "[ . 1 . 2]" 1
1086 1 41 ALA HA 1 57 PHE H 5.160 4.640 5.680 4.909 4.709 5.032 . 0 0 "[ . 1 . 2]" 1
1087 1 41 ALA HA 1 57 PHE QB 5.500 4.950 6.050 4.314 4.183 4.519 0.767 20 19 "[**********-**** ***+]" 1
1088 1 41 ALA HA 1 57 PHE QD 5.500 4.950 6.050 6.249 6.173 6.358 0.308 1 0 "[ . 1 . 2]" 1
1089 1 41 ALA HA 1 58 VAL HA 3.800 3.420 4.180 3.670 3.502 3.882 . 0 0 "[ . 1 . 2]" 1
1090 1 41 ALA HA 1 58 VAL HB 5.410 4.870 5.950 6.270 5.990 6.659 0.709 9 1 "[ . +1 . 2]" 1
1091 1 41 ALA HA 1 58 VAL QG 4.680 4.210 4.760 3.668 3.232 4.037 0.978 19 12 "[ ** . * 1****.**-+*]" 1
1092 1 41 ALA HA 1 59 SER H 4.970 4.470 5.470 5.219 4.873 5.494 0.024 17 0 "[ . 1 . 2]" 1
1093 1 41 ALA MB 1 42 LYS H 3.870 3.480 4.260 3.432 3.378 3.492 0.102 10 0 "[ . 1 . 2]" 1
1094 1 41 ALA MB 1 42 LYS HA 5.500 4.950 6.050 4.029 3.924 4.144 1.026 5 20 [****+***-***********] 1
1095 1 41 ALA MB 1 42 LYS QB 4.920 4.430 5.410 4.599 4.480 4.697 . 0 0 "[ . 1 . 2]" 1
1096 1 41 ALA MB 1 43 VAL QG 4.860 4.370 5.350 5.051 4.790 5.302 . 0 0 "[ . 1 . 2]" 1
1097 1 41 ALA MB 1 58 VAL HA 4.310 3.880 4.740 4.471 4.305 4.670 . 0 0 "[ . 1 . 2]" 1
1098 1 41 ALA MB 1 58 VAL HB 3.630 3.270 3.990 6.233 5.827 6.649 2.659 9 20 [********+*******-***] 1
1099 1 41 ALA MB 1 58 VAL QG 3.710 3.340 4.080 3.550 3.270 3.877 0.070 19 0 "[ . 1 . 2]" 1
1100 1 41 ALA MB 1 59 SER H 5.500 4.950 6.050 5.459 5.259 5.700 . 0 0 "[ . 1 . 2]" 1
1101 1 42 LYS H 1 42 LYS QB 3.820 3.440 4.200 3.333 3.291 3.360 0.149 6 0 "[ . 1 . 2]" 1
1102 1 42 LYS H 1 42 LYS QE 5.500 4.950 6.050 4.933 4.817 5.232 0.133 10 0 "[ . 1 . 2]" 1
1103 1 42 LYS H 1 42 LYS QG 5.080 4.570 5.590 2.955 2.852 3.039 1.718 2 20 [*+****-*************] 1
1104 1 42 LYS H 1 43 VAL H 4.740 4.270 5.210 4.271 4.175 4.357 0.095 13 0 "[ . 1 . 2]" 1
1105 1 42 LYS H 1 57 PHE H 4.110 3.700 4.520 3.431 3.281 3.545 0.419 3 0 "[ . 1 . 2]" 1
1106 1 42 LYS H 1 57 PHE HA 5.500 4.950 6.050 5.538 5.417 5.671 . 0 0 "[ . 1 . 2]" 1
1107 1 42 LYS H 1 57 PHE QB 5.210 4.950 5.730 3.211 3.119 3.472 1.831 20 20 [*********-*********+] 1
1108 1 42 LYS H 1 57 PHE QD 5.500 4.950 6.050 4.769 4.486 5.294 0.464 18 0 "[ . 1 . 2]" 1
1109 1 42 LYS H 1 58 VAL HA 4.610 4.150 5.070 5.162 4.987 5.296 0.226 15 0 "[ . 1 . 2]" 1
1110 1 42 LYS HA 1 43 VAL H 3.000 2.700 3.300 2.422 2.353 2.471 0.347 9 0 "[ . 1 . 2]" 1
1111 1 42 LYS HA 1 43 VAL HB 4.580 4.120 5.040 4.863 4.707 4.950 . 0 0 "[ . 1 . 2]" 1
1112 1 42 LYS HA 1 43 VAL QG 5.500 4.950 6.050 4.348 4.265 4.471 0.685 6 19 "[*****+********* -***]" 1
1113 1 42 LYS QB 1 42 LYS QE 4.080 3.670 4.490 3.798 3.637 3.852 0.033 5 0 "[ . 1 . 2]" 1
1114 1 42 LYS QB 1 43 VAL H 3.950 3.550 4.350 3.275 3.140 3.398 0.410 18 0 "[ . 1 . 2]" 1
1115 1 42 LYS QB 1 43 VAL HA 5.500 4.950 6.050 4.605 4.418 4.733 0.532 5 1 "[ + 1 . 2]" 1
1116 1 42 LYS QB 1 43 VAL HB 5.340 4.810 5.870 5.536 5.452 5.626 . 0 0 "[ . 1 . 2]" 1
1117 1 42 LYS QB 1 44 PHE QB 5.500 4.950 6.050 3.764 3.275 4.357 1.675 13 20 [************+****-**] 1
1118 1 42 LYS QB 1 57 PHE H 4.670 4.200 5.140 5.531 5.405 5.680 0.540 18 1 "[ . 1 . + 2]" 1
1119 1 42 LYS QB 1 57 PHE QB 5.210 4.690 5.590 4.575 4.347 4.837 0.343 9 0 "[ . 1 . 2]" 1
1120 1 42 LYS QB 1 57 PHE QD 4.920 4.430 5.410 5.381 4.945 5.567 0.157 9 0 "[ . 1 . 2]" 1
1121 1 42 LYS QB 1 57 PHE QE 5.500 4.950 6.050 6.376 6.063 6.775 0.725 9 1 "[ . +1 . 2]" 1
1122 1 42 LYS QD 1 44 PHE QB 4.320 3.890 4.750 2.153 2.010 2.413 1.880 17 20 [***********-****+***] 1
1123 1 42 LYS QE 1 43 VAL H 5.390 4.850 5.930 5.643 5.434 5.864 . 0 0 "[ . 1 . 2]" 1
1124 1 42 LYS QE 1 43 VAL HA 5.500 4.950 6.050 4.671 4.459 4.780 0.491 9 0 "[ . 1 . 2]" 1
1125 1 42 LYS QE 1 43 VAL QG 5.500 4.950 6.050 5.313 5.157 5.420 . 0 0 "[ . 1 . 2]" 1
1126 1 42 LYS QE 1 44 PHE H 4.920 4.430 5.410 3.072 2.911 3.240 1.519 6 20 [*-***+**************] 1
1127 1 42 LYS QE 1 44 PHE HA 4.060 3.650 4.470 4.622 4.536 4.752 0.282 2 0 "[ . 1 . 2]" 1
1128 1 42 LYS QE 1 44 PHE QB 3.790 3.410 4.170 2.538 2.067 2.945 1.343 18 19 "[** *********-****+**]" 1
1129 1 42 LYS QE 1 45 ILE H 4.350 3.910 4.790 4.955 4.810 5.144 0.354 18 0 "[ . 1 . 2]" 1
1130 1 42 LYS QE 1 46 ASP QB 5.380 4.840 5.920 4.546 4.070 5.112 0.770 13 3 "[ *- . 1 + . 2]" 1
1131 1 42 LYS QE 1 57 PHE QB 3.750 3.370 4.130 3.183 2.827 3.474 0.543 16 1 "[ . 1 .+ 2]" 1
1132 1 42 LYS QE 1 57 PHE QD 5.180 4.660 5.700 2.826 2.271 3.391 2.389 16 20 [********-******+****] 1
1133 1 42 LYS QE 1 57 PHE QE 5.040 4.540 5.540 3.018 2.635 3.849 1.905 18 20 [********-********+**] 1
1134 1 42 LYS QG 1 43 VAL H 5.140 4.630 5.650 4.726 4.538 4.894 0.092 6 0 "[ . 1 . 2]" 1
1135 1 42 LYS QG 1 57 PHE QB 5.500 4.950 6.050 2.807 2.496 3.083 2.454 9 20 [********+*******-***] 1
1136 1 43 VAL H 1 43 VAL HB 3.560 3.200 3.920 2.563 2.479 2.645 0.721 17 20 [*********-******+***] 1
1137 1 43 VAL H 1 43 VAL QG 3.940 3.930 4.330 3.031 2.958 3.091 0.972 13 20 [************+****-**] 1
1138 1 43 VAL H 1 44 PHE QD 5.500 4.950 6.050 4.683 4.368 4.788 0.582 6 1 "[ .+ 1 . 2]" 1
1139 1 43 VAL HA 1 44 PHE QB 5.500 4.950 6.050 4.675 4.621 4.721 0.329 13 0 "[ . 1 . 2]" 1
1140 1 43 VAL HA 1 56 GLY QA 4.440 4.000 4.760 3.252 3.033 3.445 0.967 3 20 [**+****-************] 1
1141 1 43 VAL HA 1 57 PHE H 4.840 4.360 5.320 4.167 3.945 4.336 0.415 1 0 "[ . 1 . 2]" 1
1142 1 43 VAL HA 1 57 PHE QD 4.700 4.230 5.170 4.379 3.781 5.438 0.449 1 0 "[ . 1 . 2]" 1
1143 1 43 VAL HB 1 44 PHE H 4.880 4.390 5.370 4.620 4.576 4.666 . 0 0 "[ . 1 . 2]" 1
1144 1 43 VAL HB 1 44 PHE QD 5.500 4.950 6.050 6.024 5.674 6.179 0.129 9 0 "[ . 1 . 2]" 1
1145 1 43 VAL HB 1 56 GLY QA 5.500 4.950 6.050 5.350 5.046 5.592 . 0 0 "[ . 1 . 2]" 1
1146 1 43 VAL HB 1 57 PHE H 5.500 4.950 6.050 6.561 6.255 6.852 0.802 10 10 "[ *.* +** *** -*2]" 1
1147 1 43 VAL QG 1 44 PHE H . 4.250 4.400 3.730 3.651 3.840 0.599 8 12 "[* *.**+*- **** * 2]" 1
1148 1 43 VAL QG 1 44 PHE HA 5.120 4.610 5.630 3.766 3.549 4.027 1.061 16 20 [*-*************+****] 1
1149 1 43 VAL QG 1 44 PHE QB 5.270 4.740 5.800 4.882 4.747 4.966 . 0 0 "[ . 1 . 2]" 1
1150 1 43 VAL QG 1 45 ILE MD 5.190 4.670 5.710 4.750 4.151 5.047 0.519 9 1 "[ . +1 . 2]" 1
1151 1 43 VAL QG 1 57 PHE H 5.380 4.840 5.910 4.126 3.740 4.374 1.100 1 18 "[+**-*****1***** ****]" 1
1152 1 44 PHE H 1 56 GLY QA 5.500 4.950 6.050 4.453 4.282 4.651 0.668 9 11 "[ *. * +* - *** ***]" 1
1153 1 44 PHE H 1 57 PHE QD 5.200 4.680 5.720 4.327 3.584 5.438 1.096 18 3 "[- . 1 .* + 2]" 1
1154 1 44 PHE HA 1 44 PHE QD 3.160 2.840 3.480 2.857 2.718 3.048 0.122 9 0 "[ . 1 . 2]" 1
1155 1 44 PHE HA 1 44 PHE QE 5.500 4.950 6.050 4.558 4.465 4.594 0.485 16 0 "[ . 1 . 2]" 1
1156 1 44 PHE HA 1 45 ILE H 2.930 2.640 3.220 2.341 2.293 2.373 0.347 19 0 "[ . 1 . 2]" 1
1157 1 44 PHE HA 1 45 ILE HB 5.190 4.670 5.710 5.180 5.049 5.258 . 0 0 "[ . 1 . 2]" 1
1158 1 44 PHE HA 1 47 LYS QE 5.500 4.950 6.050 5.568 5.267 5.960 . 0 0 "[ . 1 . 2]" 1
1159 1 44 PHE QB 1 45 ILE H 4.770 4.290 5.250 2.718 2.501 2.919 1.789 15 20 [**-***********+*****] 1
1160 1 44 PHE QB 1 45 ILE HB 4.760 4.280 5.240 4.730 4.570 4.979 . 0 0 "[ . 1 . 2]" 1
1161 1 44 PHE QB 1 45 ILE MD 4.470 4.020 4.920 4.168 3.915 4.742 0.105 13 0 "[ . 1 . 2]" 1
1162 1 44 PHE QB 1 46 ASP HA 3.840 3.460 4.220 4.262 4.056 4.382 0.162 17 0 "[ . 1 . 2]" 1
1163 1 44 PHE QB 1 47 LYS QE 5.110 4.600 5.620 3.210 2.988 3.493 1.612 10 20 [******-**+**********] 1
1164 1 44 PHE QD 1 45 ILE H 3.410 3.070 3.750 2.973 2.815 3.176 0.255 1 0 "[ . 1 . 2]" 1
1165 1 44 PHE QD 1 45 ILE HA 5.500 4.950 6.050 5.564 5.298 5.756 . 0 0 "[ . 1 . 2]" 1
1166 1 44 PHE QD 1 47 LYS QE 5.500 4.950 6.050 3.836 3.189 4.522 1.761 2 18 "[*+**** *******.****-]" 1
1167 1 44 PHE QD 1 47 LYS QG 4.220 3.800 4.640 4.596 4.013 4.982 0.342 7 0 "[ . 1 . 2]" 1
1168 1 45 ILE H 1 45 ILE HB 3.510 3.160 3.860 2.845 2.763 2.913 0.397 20 0 "[ . 1 . 2]" 1
1169 1 45 ILE H 1 45 ILE MD 4.590 4.130 5.050 2.042 1.739 3.012 2.391 13 20 [********-***+*******] 1
1170 1 45 ILE H 1 45 ILE QG 4.130 3.720 4.540 2.523 2.183 2.698 1.537 9 20 [*****-**+***********] 1
1171 1 45 ILE H 1 45 ILE MG 4.610 4.150 5.070 3.961 3.921 4.000 0.229 5 0 "[ . 1 . 2]" 1
1172 1 45 ILE H 1 46 ASP H 5.500 4.950 6.050 4.617 4.541 4.663 0.409 9 0 "[ . 1 . 2]" 1
1173 1 45 ILE H 1 47 LYS QE 5.500 4.950 6.050 4.820 4.689 5.015 0.261 6 0 "[ . 1 . 2]" 1
1174 1 45 ILE HA 1 45 ILE MG 3.540 3.190 3.890 2.481 2.402 2.533 0.788 13 20 [************+*-*****] 1
1175 1 45 ILE HA 1 46 ASP QB 5.220 4.840 5.740 4.461 4.400 4.517 0.440 14 0 "[ . 1 . 2]" 1
1176 1 45 ILE HA 1 47 LYS H 5.500 4.950 6.050 5.567 5.432 5.691 . 0 0 "[ . 1 . 2]" 1
1177 1 45 ILE HA 1 47 LYS QG 4.940 4.450 5.430 5.604 5.533 5.678 0.248 18 0 "[ . 1 . 2]" 1
1178 1 45 ILE HB 1 46 ASP H 4.010 3.610 4.410 4.231 4.175 4.284 . 0 0 "[ . 1 . 2]" 1
1179 1 45 ILE HB 1 46 ASP QB 5.270 4.740 5.800 5.688 5.626 5.801 0.001 9 0 "[ . 1 . 2]" 1
1180 1 45 ILE HB 1 47 LYS H 5.500 4.950 6.050 4.833 4.720 5.010 0.230 20 0 "[ . 1 . 2]" 1
1181 1 45 ILE HB 1 47 LYS HA 5.500 4.950 6.050 4.802 4.730 4.884 0.220 14 0 "[ . 1 . 2]" 1
1182 1 45 ILE HB 1 47 LYS QB 4.900 4.410 5.390 5.262 4.938 5.461 0.071 6 0 "[ . 1 . 2]" 1
1183 1 45 ILE HB 1 47 LYS QE 5.500 4.950 6.050 5.206 4.967 5.490 . 0 0 "[ . 1 . 2]" 1
1184 1 45 ILE HB 1 50 ASN HA 5.350 4.810 5.890 5.715 5.556 5.906 0.016 15 0 "[ . 1 . 2]" 1
1185 1 45 ILE QG 1 46 ASP H 5.500 4.950 6.050 4.740 4.633 4.971 0.317 17 0 "[ . 1 . 2]" 1
1186 1 45 ILE QG 1 47 LYS QE 5.500 4.950 6.050 6.317 6.077 6.593 0.543 7 2 "[ . + 1 - 2]" 1
1187 1 45 ILE QG 1 51 LEU QD 5.500 4.950 6.050 5.488 5.247 6.248 0.198 9 0 "[ . 1 . 2]" 1
1188 1 45 ILE MG 1 46 ASP H 4.050 3.640 4.460 3.240 3.180 3.320 0.460 19 0 "[ . 1 . 2]" 1
1189 1 45 ILE MG 1 46 ASP HA 5.060 4.550 5.570 4.689 4.582 4.740 . 0 0 "[ . 1 . 2]" 1
1190 1 45 ILE MG 1 46 ASP QB 5.500 4.950 6.050 4.293 4.224 4.381 0.726 17 20 [************-***+***] 1
1191 1 45 ILE MG 1 47 LYS H 4.360 3.920 4.800 4.778 4.622 4.840 0.040 5 0 "[ . 1 . 2]" 1
1192 1 45 ILE MG 1 47 LYS HA 4.680 4.210 5.150 4.184 4.117 4.295 0.093 14 0 "[ . 1 . 2]" 1
1193 1 45 ILE MG 1 47 LYS QD 5.500 4.950 6.050 6.193 6.076 6.319 0.269 14 0 "[ . 1 . 2]" 1
1194 1 45 ILE MG 1 47 LYS QE 5.040 4.540 5.540 5.640 5.553 5.767 0.227 15 0 "[ . 1 . 2]" 1
1195 1 45 ILE MG 1 47 LYS QG 5.500 4.950 6.050 4.664 4.547 4.806 0.403 3 0 "[ . 1 . 2]" 1
1196 1 45 ILE MG 1 50 ASN H 4.820 4.340 5.300 5.228 4.925 5.397 0.097 3 0 "[ . 1 . 2]" 1
1197 1 45 ILE MG 1 50 ASN HA 3.690 3.320 4.060 3.573 3.395 3.768 . 0 0 "[ . 1 . 2]" 1
1198 1 45 ILE MG 1 50 ASN HB2 4.770 4.290 5.250 5.365 4.720 5.839 0.589 3 1 "[ + . 1 . 2]" 1
1199 1 45 ILE MG 1 50 ASN HB3 5.080 4.570 5.590 4.857 4.516 5.508 0.054 12 0 "[ . 1 . 2]" 1
1200 1 45 ILE MG 1 50 ASN QD 5.500 4.950 6.050 5.220 4.643 6.066 0.307 12 0 "[ . 1 . 2]" 1
1201 1 45 ILE MG 1 51 LEU H 4.720 4.250 5.190 4.026 3.902 4.172 0.348 6 0 "[ . 1 . 2]" 1
1202 1 45 ILE MG 1 51 LEU HA 5.500 4.950 6.050 4.972 4.838 5.295 0.112 13 0 "[ . 1 . 2]" 1
1203 1 45 ILE MG 1 51 LEU QD 3.800 3.420 4.180 3.560 3.316 3.950 0.104 18 0 "[ . 1 . 2]" 1
1204 1 45 ILE MG 1 52 SER H 3.840 3.460 4.220 4.725 4.588 5.032 0.812 7 7 "[ - . + *1** *. * 2]" 1
1205 1 45 ILE MG 1 52 SER QB 5.500 4.950 6.050 5.027 4.872 5.244 0.078 10 0 "[ . 1 . 2]" 1
1206 1 45 ILE MG 1 53 LYS H 5.160 4.640 5.680 4.232 3.867 4.477 0.773 3 4 "[ *+ . 1 * - 2]" 1
1207 1 46 ASP H 1 46 ASP QB 3.900 3.510 3.940 2.281 2.175 2.419 1.335 14 20 [********-****+******] 1
1208 1 46 ASP H 1 47 LYS QE 4.740 4.270 5.210 5.080 4.955 5.191 . 0 0 "[ . 1 . 2]" 1
1209 1 46 ASP H 1 47 LYS QG 4.660 4.190 5.130 5.198 5.154 5.238 0.108 15 0 "[ . 1 . 2]" 1
1210 1 46 ASP HA 1 47 LYS HA 5.160 4.640 5.680 4.518 4.461 4.543 0.179 7 0 "[ . 1 . 2]" 1
1211 1 46 ASP HA 1 47 LYS QB 5.130 4.620 5.640 4.886 4.800 4.936 . 0 0 "[ . 1 . 2]" 1
1212 1 46 ASP HA 1 47 LYS QD 4.190 3.770 4.610 3.784 3.551 4.250 0.219 17 0 "[ . 1 . 2]" 1
1213 1 46 ASP HA 1 47 LYS QE 3.660 3.290 4.030 2.963 2.857 3.096 0.433 6 0 "[ . 1 . 2]" 1
1214 1 46 ASP HA 1 47 LYS QG 4.550 4.090 5.010 3.613 3.405 3.704 0.685 7 6 "[ .-+* 1 * **]" 1
1215 1 46 ASP HA 1 48 GLN H 5.380 4.840 5.920 3.926 3.844 4.125 0.996 20 20 [********-**********+] 1
1216 1 46 ASP HA 1 49 THR H 4.930 4.440 5.420 5.483 5.317 5.636 0.216 9 0 "[ . 1 . 2]" 1
1217 1 46 ASP HA 1 51 LEU QD 5.110 4.600 5.620 4.473 4.360 4.730 0.240 9 0 "[ . 1 . 2]" 1
1218 1 46 ASP QB 1 47 LYS H 5.310 4.780 5.390 3.716 3.636 3.772 1.144 13 20 [************+-******] 1
1219 1 46 ASP QB 1 47 LYS HA 5.500 4.950 6.050 4.722 4.611 4.840 0.339 2 0 "[ . 1 . 2]" 1
1220 1 46 ASP QB 1 47 LYS QE . 4.950 5.270 4.804 4.487 4.952 0.463 7 0 "[ . 1 . 2]" 1
1221 1 46 ASP QB 1 47 LYS QG . 4.720 5.120 5.073 5.033 5.139 0.019 11 0 "[ . 1 . 2]" 1
1222 1 46 ASP QB 1 48 GLN H 5.400 4.860 5.940 3.071 2.939 3.331 1.921 18 20 [********-********+**] 1
1223 1 46 ASP QB 1 49 THR H 4.820 4.700 5.300 3.276 3.117 3.663 1.583 10 20 [********-+**********] 1
1224 1 46 ASP QB 1 49 THR MG 5.500 4.950 6.050 4.969 4.547 5.185 0.403 7 0 "[ . 1 . 2]" 1
1225 1 46 ASP QB 1 50 ASN H . 4.950 5.180 4.519 4.386 4.877 0.564 13 3 "[ - . 1 *+ . 2]" 1
1226 1 46 ASP QB 1 50 ASN HA 5.500 4.950 6.050 4.887 4.670 5.187 0.280 11 0 "[ . 1 . 2]" 1
1227 1 46 ASP QB 1 51 LEU H . 4.330 4.520 3.698 3.433 4.121 0.897 2 13 "[*+* * ***** -** *]" 1
1228 1 46 ASP QB 1 51 LEU QB 5.500 4.950 6.050 4.722 4.517 5.079 0.433 2 0 "[ . 1 . 2]" 1
1229 1 46 ASP QB 1 51 LEU QD 5.440 4.950 5.980 2.170 1.955 2.384 2.995 9 20 [********+****-******] 1
1230 1 46 ASP QB 1 52 SER H 5.500 4.950 6.050 6.105 5.749 6.580 0.530 7 1 "[ . + 1 . 2]" 1
1231 1 47 LYS H 1 47 LYS QB 3.340 3.010 3.670 2.931 2.904 2.956 0.106 5 0 "[ . 1 . 2]" 1
1232 1 47 LYS H 1 47 LYS QD 5.080 4.570 5.590 2.240 2.069 2.587 2.501 17 20 [*************-**+***] 1
1233 1 47 LYS H 1 47 LYS QE 4.700 4.230 5.170 2.499 2.389 2.594 1.841 14 20 [********-****+******] 1
1234 1 47 LYS H 1 47 LYS QG 4.210 3.790 4.630 1.850 1.753 1.908 2.037 7 20 [******+*-***********] 1
1235 1 47 LYS H 1 48 GLN H 3.860 3.470 4.250 3.166 3.082 3.337 0.388 16 0 "[ . 1 . 2]" 1
1236 1 47 LYS H 1 48 GLN QG 5.500 4.950 6.050 4.173 3.754 4.963 1.196 16 15 "[****** *-* ***.+ **2]" 1
1237 1 47 LYS H 1 49 THR H 5.500 4.950 6.050 5.401 5.286 5.555 . 0 0 "[ . 1 . 2]" 1
1238 1 47 LYS HA 1 47 LYS QD 4.230 3.810 4.650 3.979 3.817 4.142 . 0 0 "[ . 1 . 2]" 1
1239 1 47 LYS HA 1 47 LYS QE 4.440 4.000 4.880 4.806 4.694 4.910 0.030 17 0 "[ . 1 . 2]" 1
1240 1 47 LYS HA 1 47 LYS QG 4.130 3.720 4.540 2.983 2.840 3.229 0.880 14 19 [*************+.****-] 1
1241 1 47 LYS HA 1 48 GLN HA 4.870 4.380 5.360 4.672 4.601 4.749 . 0 0 "[ . 1 . 2]" 1
1242 1 47 LYS HA 1 49 THR H 5.500 4.950 6.050 4.911 4.776 5.101 0.174 2 0 "[ . 1 . 2]" 1
1243 1 47 LYS HA 1 50 ASN H 4.540 4.090 4.990 3.795 3.698 3.901 0.392 18 0 "[ . 1 . 2]" 1
1244 1 47 LYS HA 1 50 ASN HA 3.770 3.390 4.150 3.760 3.452 4.109 . 0 0 "[ . 1 . 2]" 1
1245 1 47 LYS HA 1 50 ASN HB3 5.500 4.950 6.050 4.915 4.781 5.047 0.169 9 0 "[ . 1 . 2]" 1
1246 1 47 LYS QB 1 47 LYS QD 2.920 2.630 3.210 2.352 2.250 2.466 0.380 14 0 "[ . 1 . 2]" 1
1247 1 47 LYS QB 1 48 GLN H 3.970 3.570 4.370 3.712 3.589 3.885 . 0 0 "[ . 1 . 2]" 1
1248 1 47 LYS QB 1 48 GLN HA 5.060 4.550 5.570 4.169 3.964 4.278 0.586 14 1 "[ . 1 +. 2]" 1
1249 1 47 LYS QB 1 48 GLN QG 5.120 4.610 5.630 4.350 3.867 4.602 0.743 14 2 "[ - 1 +. 2]" 1
1250 1 47 LYS QB 1 49 THR H 5.500 4.950 6.050 5.752 5.583 5.948 . 0 0 "[ . 1 . 2]" 1
1251 1 47 LYS QB 1 50 ASN HB3 5.500 4.950 6.050 6.090 5.896 6.224 0.174 19 0 "[ . 1 . 2]" 1
1252 1 47 LYS QD 1 47 LYS QG 2.600 2.340 2.860 2.103 2.088 2.113 0.252 14 0 "[ . 1 . 2]" 1
1253 1 47 LYS QD 1 48 GLN H 5.500 4.950 6.050 3.715 3.323 4.463 1.627 17 19 "[*****-******* **+***]" 1
1254 1 47 LYS QD 1 48 GLN HA 4.890 4.400 5.380 5.110 4.720 5.353 . 0 0 "[ . 1 . 2]" 1
1255 1 47 LYS QD 1 48 GLN QB 5.420 4.880 5.960 4.872 4.593 5.489 0.287 4 0 "[ . 1 . 2]" 1
1256 1 47 LYS QD 1 48 GLN QG . 4.950 5.060 3.654 3.427 3.796 1.523 15 20 [**************+-****] 1
1257 1 47 LYS QE 1 47 LYS QG 3.130 2.820 3.440 2.231 2.137 2.340 0.683 7 19 "[******+**-****** ***]" 1
1258 1 47 LYS QE 1 48 GLN QE 5.150 4.630 5.670 4.722 2.542 5.559 2.088 11 5 "[ . * 1+ * - *]" 1
1259 1 47 LYS QE 1 48 GLN QG 5.080 4.940 5.590 4.852 4.611 5.073 0.329 15 0 "[ . 1 . 2]" 1
1260 1 47 LYS QE 1 51 LEU QD 5.500 4.950 6.050 6.379 6.146 6.665 0.615 14 1 "[ . 1 +. 2]" 1
1261 1 47 LYS QG 1 48 GLN H 5.240 4.720 5.760 4.522 4.458 4.659 0.262 12 0 "[ . 1 . 2]" 1
1262 1 47 LYS QG 1 48 GLN HA 5.500 4.950 6.050 5.979 5.875 6.028 . 0 0 "[ . 1 . 2]" 1
1263 1 47 LYS QG 1 48 GLN QG 5.500 4.950 6.050 5.164 4.975 5.508 . 0 0 "[ . 1 . 2]" 1
1264 1 48 GLN H 1 48 GLN QB 3.500 3.150 3.590 2.971 2.874 3.114 0.276 7 0 "[ . 1 . 2]" 1
1265 1 48 GLN H 1 48 GLN QG 3.920 3.530 4.280 2.265 1.874 3.090 1.656 16 17 "[******-*** ***.+***2]" 1
1266 1 48 GLN H 1 49 THR H 3.310 2.980 3.640 2.663 2.373 2.721 0.607 14 1 "[ . 1 +. 2]" 1
1267 1 48 GLN H 1 49 THR MG 5.140 4.630 5.650 5.054 4.565 5.258 0.065 14 0 "[ . 1 . 2]" 1
1268 1 48 GLN H 1 50 ASN H 4.130 3.720 4.540 3.706 3.561 3.849 0.159 20 0 "[ . 1 . 2]" 1
1269 1 48 GLN HA 1 48 GLN QE 5.500 4.950 6.050 4.673 3.712 5.322 1.238 20 5 "[ . - 1* * * +]" 1
1270 1 48 GLN HA 1 48 GLN QG 3.700 3.370 4.070 3.175 2.904 3.334 0.466 7 0 "[ . 1 . 2]" 1
1271 1 48 GLN HA 1 49 THR MG 5.500 4.950 6.050 4.857 4.685 4.978 0.265 14 0 "[ . 1 . 2]" 1
1272 1 48 GLN QB 1 49 THR H 4.160 3.740 4.480 3.160 2.393 3.467 1.347 17 6 "[ . * 1* -* + *]" 1
1273 1 48 GLN QB 1 49 THR HA 5.420 4.880 5.960 4.336 3.970 4.569 0.910 17 9 "[* - * *1* ** + *]" 1
1274 1 48 GLN QB 1 49 THR MG 4.530 4.080 4.830 3.382 2.810 3.655 1.270 15 11 "[ *** *-* *+ * **]" 1
1275 1 48 GLN QB 1 50 ASN H 5.500 4.950 6.050 4.856 4.455 5.107 0.495 11 0 "[ . 1 . 2]" 1
1276 1 48 GLN QG 1 49 THR MG 4.800 4.320 5.270 4.159 3.908 4.657 0.412 4 0 "[ . 1 . 2]" 1
1277 1 48 GLN QG 1 50 ASN H 5.500 4.950 6.050 5.041 4.551 5.869 0.399 12 0 "[ . 1 . 2]" 1
1278 1 49 THR H 1 49 THR MG 4.130 3.720 4.540 3.118 2.670 3.317 1.050 7 8 "[ . + *1* -** * *]" 1
1279 1 49 THR H 1 50 ASN H 3.330 3.000 3.660 2.593 2.492 2.763 0.508 6 1 "[ .+ 1 . 2]" 1
1280 1 49 THR H 1 50 ASN HA 5.040 4.540 5.540 4.513 4.416 4.792 0.124 2 0 "[ . 1 . 2]" 1
1281 1 49 THR H 1 50 ASN HB3 5.500 4.950 6.050 6.017 5.653 6.292 0.242 20 0 "[ . 1 . 2]" 1
1282 1 49 THR H 1 51 LEU H 4.510 4.060 4.960 4.056 3.886 4.230 0.174 18 0 "[ . 1 . 2]" 1
1283 1 49 THR H 1 51 LEU QD 5.500 4.950 6.050 4.317 3.431 4.740 1.519 7 11 "[ *.*+**- * ** **2]" 1
1284 1 49 THR HA 1 49 THR MG 3.450 3.110 3.790 2.414 2.266 2.687 0.844 2 18 "[*+**** * ****-******]" 1
1285 1 49 THR HA 1 50 ASN HB3 5.120 4.610 5.630 5.607 5.054 5.924 0.294 11 0 "[ . 1 . 2]" 1
1286 1 49 THR HA 1 50 ASN QD 5.500 4.950 6.050 4.744 4.326 5.357 0.624 16 8 "[ * *. 1**- .+ **]" 1
1287 1 49 THR HA 1 51 LEU H 5.200 4.680 5.720 5.093 5.010 5.177 . 0 0 "[ . 1 . 2]" 1
1288 1 49 THR HA 1 51 LEU QB 5.500 4.950 6.050 5.915 5.679 6.021 . 0 0 "[ . 1 . 2]" 1
1289 1 49 THR HA 1 51 LEU QD 5.300 4.770 5.830 5.359 4.707 5.826 0.063 7 0 "[ . 1 . 2]" 1
1290 1 49 THR HB 1 50 ASN H 5.470 4.920 6.020 4.480 4.420 4.608 0.500 16 1 "[ . 1 .+ 2]" 1
1291 1 49 THR HB 1 51 LEU H 5.000 4.500 5.500 4.669 4.550 4.953 . 0 0 "[ . 1 . 2]" 1
1292 1 49 THR HB 1 51 LEU QB 5.100 4.890 5.610 4.283 4.225 4.375 0.665 1 20 [+************-******] 1
1293 1 49 THR HB 1 51 LEU QD 4.340 3.910 4.770 3.925 3.693 4.482 0.217 19 0 "[ . 1 . 2]" 1
1294 1 49 THR MG 1 50 ASN H 5.160 4.640 5.680 4.588 4.475 4.673 0.165 7 0 "[ . 1 . 2]" 1
1295 1 49 THR MG 1 51 LEU H 5.500 4.950 6.050 5.384 5.046 5.530 . 0 0 "[ . 1 . 2]" 1
1296 1 49 THR MG 1 51 LEU QB 5.500 4.950 6.050 5.153 4.502 5.346 0.448 9 0 "[ . 1 . 2]" 1
1297 1 49 THR MG 1 51 LEU QD 4.100 3.690 4.510 4.046 3.544 4.478 0.146 7 0 "[ . 1 . 2]" 1
1298 1 49 THR MG 1 51 LEU HG 5.500 4.950 6.050 5.009 4.570 6.490 0.440 9 0 "[ . 1 . 2]" 1
1299 1 50 ASN H 1 50 ASN HA 2.940 2.650 3.230 2.347 2.329 2.370 0.321 8 0 "[ . 1 . 2]" 1
1300 1 50 ASN H 1 50 ASN HB2 4.130 3.720 4.540 3.804 3.560 4.101 0.160 3 0 "[ . 1 . 2]" 1
1301 1 50 ASN H 1 50 ASN HB3 3.960 3.560 4.360 3.468 3.063 3.769 0.497 15 0 "[ . 1 . 2]" 1
1302 1 50 ASN H 1 51 LEU H 3.760 3.380 4.140 3.329 3.185 3.443 0.195 6 0 "[ . 1 . 2]" 1
1303 1 50 ASN H 1 51 LEU QB 5.500 4.950 6.050 5.502 5.289 5.651 . 0 0 "[ . 1 . 2]" 1
1304 1 50 ASN H 1 51 LEU QD 5.500 4.950 6.050 4.845 3.744 5.104 1.206 7 1 "[ . + 1 . 2]" 1
1305 1 50 ASN HA 1 51 LEU HA 4.860 4.370 5.350 4.436 4.386 4.514 . 0 0 "[ . 1 . 2]" 1
1306 1 50 ASN HA 1 51 LEU QD 5.330 4.800 5.860 4.517 3.624 4.714 1.176 7 1 "[ . + 1 . 2]" 1
1307 1 50 ASN HB2 1 51 LEU H 5.170 4.650 5.690 4.422 4.387 4.456 0.263 7 0 "[ . 1 . 2]" 1
1308 1 50 ASN HB2 1 51 LEU HA 4.740 4.270 5.210 4.663 4.565 4.778 . 0 0 "[ . 1 . 2]" 1
1309 1 50 ASN HB2 1 51 LEU QD 5.340 4.810 5.870 5.909 5.326 6.002 0.132 16 0 "[ . 1 . 2]" 1
1310 1 50 ASN HB3 1 51 LEU H 5.250 4.720 5.780 4.593 4.456 4.830 0.264 16 0 "[ . 1 . 2]" 1
1311 1 50 ASN HB3 1 51 LEU QD 5.370 4.830 5.910 6.080 5.381 6.357 0.447 17 0 "[ . 1 . 2]" 1
1312 1 50 ASN QD 1 51 LEU H 5.500 4.950 6.050 4.747 4.474 5.148 0.476 16 0 "[ . 1 . 2]" 1
1313 1 51 LEU H 1 51 LEU QB . 3.720 3.920 2.935 2.780 3.000 0.940 9 20 [********+**-********] 1
1314 1 51 LEU H 1 51 LEU QD 4.340 3.910 4.770 2.674 1.856 2.842 2.054 7 20 [******+*****-*******] 1
1315 1 51 LEU H 1 51 LEU HG 4.170 3.750 4.590 2.330 2.001 3.803 1.749 18 18 "[****** * *-******+**]" 1
1316 1 51 LEU H 1 52 SER H 4.350 3.910 4.790 4.536 4.437 4.674 . 0 0 "[ . 1 . 2]" 1
1317 1 51 LEU HA 1 51 LEU QD 3.290 2.960 3.620 3.457 3.399 3.509 . 0 0 "[ . 1 . 2]" 1
1318 1 51 LEU HA 1 52 SER H 3.200 2.880 3.520 2.908 2.743 3.112 0.137 3 0 "[ . 1 . 2]" 1
1319 1 51 LEU HA 1 52 SER QB 5.190 4.670 5.710 4.580 4.425 4.831 0.245 12 0 "[ . 1 . 2]" 1
1320 1 51 LEU QB 1 52 SER H 4.730 4.260 4.760 2.138 1.869 2.458 2.391 17 20 [********-*******+***] 1
1321 1 51 LEU QB 1 52 SER QB 5.500 4.950 6.050 4.061 3.923 4.250 1.027 17 20 [*-**************+***] 1
1322 1 51 LEU QB 1 86 GLN QE 5.300 4.850 5.830 4.608 4.447 4.876 0.403 8 0 "[ . 1 . 2]" 1
1323 1 51 LEU QD 1 52 SER H 4.220 3.800 4.640 2.973 2.711 3.559 1.089 15 17 "[****** * -****+*** *]" 1
1324 1 51 LEU QD 1 52 SER HA 5.300 4.770 5.830 4.791 4.576 5.191 0.194 2 0 "[ . 1 . 2]" 1
1325 1 51 LEU QD 1 52 SER QB 5.500 4.950 6.050 4.233 3.903 4.518 1.047 15 19 "[****** ****-**+*****]" 1
1326 1 51 LEU QD 1 53 LYS H 5.500 4.950 6.050 5.963 5.591 6.426 0.376 9 0 "[ . 1 . 2]" 1
1327 1 51 LEU QD 1 86 GLN QB 5.500 4.950 6.050 6.332 6.015 6.760 0.710 3 2 "[- + . 1 . 2]" 1
1328 1 51 LEU QD 1 86 GLN QE 5.110 4.710 5.620 4.016 3.359 4.585 1.351 9 13 "[*** * +-* * *****2]" 1
1329 1 51 LEU HG 1 52 SER H 4.690 4.220 5.160 4.423 2.846 4.864 1.374 9 2 "[ . - +1 . 2]" 1
1330 1 52 SER H 1 52 SER QB 3.790 3.410 4.110 2.461 2.249 2.786 1.161 7 20 [*-****+*************] 1
1331 1 52 SER H 1 53 LYS H 5.480 4.930 6.030 4.772 4.675 4.807 0.255 9 0 "[ . 1 . 2]" 1
1332 1 52 SER HA 1 55 PHE QD 4.460 4.010 4.910 4.973 4.255 5.493 0.583 18 2 "[ . 1 . +-2]" 1
1333 1 52 SER QB 1 53 LYS H 5.500 4.950 6.050 3.240 2.793 3.587 2.157 11 20 [**********+**-******] 1
1334 1 52 SER QB 1 55 PHE QD 5.500 4.950 6.050 2.885 1.899 3.873 3.051 17 20 [*************-**+***] 1
1335 1 52 SER QB 1 86 GLN QE 4.870 4.640 5.360 4.311 4.009 4.486 0.631 9 1 "[ . +1 . 2]" 1
1336 1 52 SER QB 1 86 GLN QG 5.500 4.950 6.050 5.534 5.292 6.146 0.096 3 0 "[ . 1 . 2]" 1
1337 1 53 LYS H 1 54 CYS H 5.220 4.700 5.740 3.813 2.605 4.641 2.095 15 10 "[ - *.*** 1 **+ **2]" 1
1338 1 53 LYS HA 1 55 PHE QE 5.500 4.950 6.050 5.604 4.768 6.290 0.240 18 0 "[ . 1 . 2]" 1
1339 1 53 LYS QB 1 54 CYS QB 4.040 3.640 4.440 4.113 3.576 4.450 0.064 3 0 "[ . 1 . 2]" 1
1340 1 53 LYS QB 1 55 PHE QD 5.220 4.700 5.740 5.218 4.043 5.948 0.657 13 1 "[ . 1 + . 2]" 1
1341 1 53 LYS QB 1 55 PHE QE 5.280 4.750 5.810 6.203 4.686 7.650 1.840 18 9 "[ *. * ** ** +*-]" 1
1342 1 54 CYS H 1 55 PHE H 5.500 4.950 6.050 3.666 2.610 4.606 2.340 16 17 "[*** * * *******+*-**]" 1
1343 1 55 PHE H 1 55 PHE QD 3.790 3.410 4.170 3.492 2.714 4.054 0.696 12 1 "[ . 1 + . 2]" 1
1344 1 55 PHE HA 1 55 PHE QD 3.940 3.550 4.330 2.948 1.899 3.640 1.651 3 6 "[* + * 1* .-* 2]" 1
1345 1 55 PHE HA 1 56 GLY QA 5.500 4.950 6.050 4.060 4.006 4.176 0.944 11 20 [*****-****+*********] 1
1346 1 55 PHE QB 1 56 GLY H 4.040 3.640 4.440 3.223 2.350 3.667 1.290 1 9 "[+** * 1*-* .** 2]" 1
1347 1 55 PHE QD 1 56 GLY H 3.970 3.570 4.370 3.672 3.137 4.317 0.433 20 0 "[ . 1 . 2]" 1
1348 1 56 GLY H 1 57 PHE H 5.430 4.890 5.970 4.602 4.523 4.690 0.367 4 0 "[ . 1 . 2]" 1
1349 1 56 GLY H 1 57 PHE HA 5.100 4.590 5.610 5.277 5.032 5.543 . 0 0 "[ . 1 . 2]" 1
1350 1 56 GLY QA 1 57 PHE QB 5.500 4.950 6.050 3.819 3.643 3.996 1.307 11 20 [*****-****+*********] 1
1351 1 56 GLY QA 1 57 PHE QE 4.720 4.250 5.190 3.771 3.331 4.086 0.919 16 8 "[ ** - * ** .+* 2]" 1
1352 1 56 GLY QA 1 58 VAL QG 5.500 4.950 6.050 4.584 4.207 4.849 0.743 16 3 "[ * 1 .+- 2]" 1
1353 1 57 PHE H 1 57 PHE QD 4.150 3.730 4.570 2.466 2.227 2.790 1.503 3 20 [**+*****-***********] 1
1354 1 57 PHE H 1 57 PHE QE 5.340 4.810 5.870 4.704 4.517 5.009 0.293 3 0 "[ . 1 . 2]" 1
1355 1 57 PHE H 1 58 VAL H 5.500 4.950 6.050 4.582 4.513 4.726 0.437 8 0 "[ . 1 . 2]" 1
1356 1 57 PHE H 1 58 VAL QG 5.500 4.950 6.050 4.392 3.645 4.563 1.305 16 10 "[ * 1****-+***2]" 1
1357 1 57 PHE HA 1 57 PHE QD 3.870 3.480 4.260 3.129 2.696 3.196 0.784 9 2 "[ . +1 .- 2]" 1
1358 1 57 PHE HA 1 57 PHE QE 4.990 4.490 5.490 4.708 4.367 4.850 0.123 9 0 "[ . 1 . 2]" 1
1359 1 57 PHE HA 1 58 VAL H 3.200 2.880 3.520 2.544 2.472 2.620 0.408 16 0 "[ . 1 . 2]" 1
1360 1 57 PHE HA 1 58 VAL HB 5.280 4.750 5.810 5.795 5.371 6.020 0.210 19 0 "[ . 1 . 2]" 1
1361 1 57 PHE HA 1 58 VAL QG 5.500 4.950 6.050 3.919 3.608 4.082 1.342 16 20 [***************+*-**] 1
1362 1 57 PHE QB 1 58 VAL H 4.700 4.520 5.170 3.794 3.036 3.910 1.484 14 20 [***********-*+******] 1
1363 1 57 PHE QB 1 58 VAL HA 5.500 4.950 6.050 4.225 4.003 4.346 0.947 4 20 [***+***********-****] 1
1364 1 57 PHE QB 1 58 VAL QG 5.500 4.950 6.050 4.474 4.207 4.605 0.743 16 4 "[ . 1 *.+- *2]" 1
1365 1 57 PHE QD 1 58 VAL H 4.470 4.020 4.920 4.935 4.336 5.062 0.142 13 0 "[ . 1 . 2]" 1
1366 1 57 PHE QD 1 58 VAL HA 5.500 4.950 6.050 6.017 5.750 6.164 0.114 2 0 "[ . 1 . 2]" 1
1367 1 58 VAL H 1 58 VAL HB 3.920 3.530 4.310 3.357 3.185 3.617 0.345 9 0 "[ . 1 . 2]" 1
1368 1 58 VAL H 1 58 VAL QG 3.890 3.500 4.280 2.304 2.099 3.003 1.401 3 19 "[**+********** *-****]" 1
1369 1 58 VAL H 1 59 SER H 5.300 4.770 5.830 4.460 4.324 4.594 0.446 18 0 "[ . 1 . 2]" 1
1370 1 58 VAL HA 1 59 SER H 3.170 2.850 3.490 2.476 2.369 2.567 0.481 19 0 "[ . 1 . 2]" 1
1371 1 58 VAL HA 1 59 SER HA 5.500 4.950 6.050 4.596 4.478 4.695 0.472 19 0 "[ . 1 . 2]" 1
1372 1 58 VAL HA 1 59 SER QB 4.720 4.250 5.190 4.441 3.994 4.746 0.256 14 0 "[ . 1 . 2]" 1
1373 1 58 VAL HB 1 59 SER H 4.940 4.450 5.430 3.660 2.957 4.183 1.493 4 14 "[***+* -* ** **. * **]" 1
1374 1 58 VAL QG 1 59 SER H 4.120 3.710 4.270 3.105 2.515 3.475 1.195 14 12 "[****. - ** *+.** *2]" 1
1375 1 58 VAL QG 1 59 SER HA 5.360 4.820 5.900 4.346 4.215 4.484 0.605 4 9 "[** +.-* 1 **.* *]" 1
1376 1 58 VAL QG 1 59 SER QB 5.500 4.950 6.050 4.744 4.382 4.932 0.568 14 1 "[ . 1 +. 2]" 1
1377 1 58 VAL QG 1 60 TYR H 5.480 4.930 6.030 5.320 4.964 5.744 . 0 0 "[ . 1 . 2]" 1
1378 1 58 VAL QG 1 60 TYR HA 5.500 4.950 6.050 5.324 4.989 5.976 . 0 0 "[ . 1 . 2]" 1
1379 1 58 VAL QG 1 60 TYR QD 4.170 3.750 4.590 4.669 4.497 5.334 0.744 19 2 "[ . 1 . - +2]" 1
1380 1 59 SER H 1 60 TYR HA 5.500 4.950 6.050 5.089 4.789 5.567 0.161 11 0 "[ . 1 . 2]" 1
1381 1 59 SER HA 1 60 TYR H 3.280 2.950 3.610 2.558 2.489 2.706 0.461 19 0 "[ . 1 . 2]" 1
1382 1 59 SER HA 1 60 TYR HA 5.500 4.950 6.050 4.711 4.645 4.764 0.305 8 0 "[ . 1 . 2]" 1
1383 1 59 SER HA 1 60 TYR QB 5.500 4.950 6.050 4.575 4.274 4.727 0.676 13 3 "[ -. * 1 + . 2]" 1
1384 1 59 SER HA 1 60 TYR QD 5.400 4.860 5.940 4.620 4.078 4.916 0.782 13 2 "[ . - 1 + . 2]" 1
1385 1 59 SER QB 1 60 TYR H 4.880 4.390 5.160 3.313 2.647 3.637 1.743 16 20 [********-******+****] 1
1386 1 60 TYR H 1 60 TYR QB 3.790 3.410 4.170 2.393 2.257 2.555 1.153 18 20 [***-*************+**] 1
1387 1 60 TYR H 1 60 TYR QD 3.890 3.500 4.280 3.296 3.123 3.837 0.377 17 0 "[ . 1 . 2]" 1
1388 1 60 TYR H 1 61 ASP H 5.440 4.900 5.980 4.684 4.546 4.757 0.354 16 0 "[ . 1 . 2]" 1
1389 1 60 TYR H 1 62 ASN H 5.370 4.830 5.910 5.457 5.338 5.580 . 0 0 "[ . 1 . 2]" 1
1390 1 60 TYR HA 1 60 TYR QD 3.680 3.310 4.050 2.862 2.741 2.970 0.569 18 2 "[ -. 1 . + 2]" 1
1391 1 60 TYR HA 1 60 TYR QE 5.390 4.850 5.930 4.766 4.674 4.833 0.176 18 0 "[ . 1 . 2]" 1
1392 1 60 TYR HA 1 61 ASP H 3.400 3.060 3.740 2.756 2.666 2.808 0.394 13 0 "[ . 1 . 2]" 1
1393 1 60 TYR HA 1 61 ASP QB 5.500 4.950 6.050 4.517 4.348 4.782 0.602 8 6 "[ . + *-* . **]" 1
1394 1 60 TYR HA 1 62 ASN H 4.470 4.020 4.920 4.967 4.882 5.036 0.116 19 0 "[ . 1 . 2]" 1
1395 1 60 TYR QB 1 61 ASP H 3.660 3.420 4.030 2.286 2.104 2.480 1.316 8 20 [*******+*****-******] 1
1396 1 60 TYR QB 1 62 ASN H 3.490 3.160 3.840 2.912 2.799 2.981 0.361 13 0 "[ . 1 . 2]" 1
1397 1 60 TYR QB 1 65 SER QB 4.990 4.490 5.490 3.467 2.986 3.808 1.504 14 20 [****-********+******] 1
1398 1 60 TYR QB 1 66 ALA H 5.500 4.950 6.050 4.525 4.235 4.766 0.715 13 5 "[- . * * + .* 2]" 1
1399 1 60 TYR QB 1 66 ALA HA 5.500 4.950 6.050 4.744 4.490 4.867 0.460 13 0 "[ . 1 . 2]" 1
1400 1 60 TYR QB 1 66 ALA MB . 4.950 5.240 4.046 3.776 4.236 1.174 13 20 [***-********+*******] 1
1401 1 60 TYR QD 1 61 ASP H 3.960 3.560 4.360 3.696 3.432 3.917 0.128 13 0 "[ . 1 . 2]" 1
1402 1 60 TYR QD 1 62 ASN H 4.660 4.190 5.130 5.015 4.814 5.101 . 0 0 "[ . 1 . 2]" 1
1403 1 60 TYR QD 1 62 ASN HD21 5.500 4.950 6.050 5.896 5.632 6.212 0.162 17 0 "[ . 1 . 2]" 1
1404 1 60 TYR QD 1 65 SER H 5.500 4.950 6.050 5.795 5.615 5.985 . 0 0 "[ . 1 . 2]" 1
1405 1 60 TYR QD 1 65 SER HA 5.500 4.950 6.050 5.783 5.553 6.042 . 0 0 "[ . 1 . 2]" 1
1406 1 60 TYR QD 1 66 ALA H 4.330 3.900 4.760 4.645 4.452 4.792 0.032 11 0 "[ . 1 . 2]" 1
1407 1 60 TYR QD 1 66 ALA HA 4.160 3.740 4.580 3.582 3.494 3.693 0.246 10 0 "[ . 1 . 2]" 1
1408 1 60 TYR QD 1 66 ALA MB 3.320 2.990 3.650 3.588 3.347 3.781 0.131 18 0 "[ . 1 . 2]" 1
1409 1 60 TYR QE 1 65 SER QB 5.500 4.950 6.050 4.019 3.699 4.234 1.251 13 20 [**-*********+*******] 1
1410 1 60 TYR QE 1 66 ALA H 5.120 4.610 5.630 5.611 5.481 5.766 0.136 11 0 "[ . 1 . 2]" 1
1411 1 60 TYR QE 1 66 ALA HA 3.620 3.260 3.980 3.694 3.495 3.921 . 0 0 "[ . 1 . 2]" 1
1412 1 60 TYR QE 1 66 ALA MB 4.810 4.330 5.290 4.502 4.204 4.792 0.126 7 0 "[ . 1 . 2]" 1
1413 1 60 TYR QE 1 69 ALA H 5.340 4.810 5.870 4.921 4.757 5.139 0.053 17 0 "[ . 1 . 2]" 1
1414 1 60 TYR QE 1 69 ALA HA 5.500 4.950 6.050 5.547 5.376 5.702 . 0 0 "[ . 1 . 2]" 1
1415 1 60 TYR QE 1 69 ALA MB 3.260 2.930 3.590 2.823 2.664 2.954 0.266 1 0 "[ . 1 . 2]" 1
1416 1 61 ASP H 1 61 ASP QB 4.150 3.730 4.350 2.418 2.214 2.534 1.516 17 20 [*************-**+***] 1
1417 1 61 ASP H 1 62 ASN H 3.510 3.160 3.860 2.896 2.775 3.003 0.385 10 0 "[ . 1 . 2]" 1
1418 1 61 ASP H 1 62 ASN HA 5.500 4.950 6.050 5.304 5.177 5.385 . 0 0 "[ . 1 . 2]" 1
1419 1 61 ASP QB 1 62 ASN H 4.680 4.210 5.150 3.405 3.183 3.656 1.027 8 20 [*******+*****-******] 1
1420 1 61 ASP QB 1 62 ASN HA 5.500 4.950 6.050 4.519 4.106 4.617 0.844 17 3 "[ -. 1 * . + 2]" 1
1421 1 61 ASP QB 1 62 ASN QB 4.630 4.170 5.090 3.777 3.679 3.901 0.491 4 0 "[ . 1 . 2]" 1
1422 1 62 ASN H 1 62 ASN QB 4.150 3.730 4.570 3.378 3.340 3.442 0.390 12 0 "[ . 1 . 2]" 1
1423 1 62 ASN H 1 63 PRO QD 5.480 4.950 6.030 4.483 4.337 4.675 0.613 17 8 "[ **** - 1 *. + *]" 1
1424 1 62 ASN H 1 65 SER QB 5.500 4.950 6.050 4.540 4.379 4.709 0.571 9 6 "[* *. +1* -. *2]" 1
1425 1 62 ASN H 1 66 ALA H 5.500 4.950 6.050 5.364 5.021 5.671 . 0 0 "[ . 1 . 2]" 1
1426 1 62 ASN H 1 66 ALA MB 5.500 4.950 6.050 5.728 5.514 6.008 . 0 0 "[ . 1 . 2]" 1
1427 1 62 ASN HA 1 62 ASN HD22 5.170 4.650 5.690 4.965 4.909 5.042 . 0 0 "[ . 1 . 2]" 1
1428 1 62 ASN HA 1 63 PRO QB 5.500 4.950 6.050 4.832 4.719 4.894 0.231 3 0 "[ . 1 . 2]" 1
1429 1 62 ASN HA 1 63 PRO QD 3.640 3.280 3.830 2.271 2.121 2.489 1.159 17 20 [************-***+***] 1
1430 1 62 ASN HA 1 63 PRO QG 4.960 4.460 5.460 4.123 4.030 4.313 0.430 17 0 "[ . 1 . 2]" 1
1431 1 62 ASN HA 1 64 VAL H 4.800 4.320 5.280 4.446 4.356 4.566 . 0 0 "[ . 1 . 2]" 1
1432 1 62 ASN HA 1 64 VAL QG 5.500 4.950 6.050 5.721 5.599 5.819 . 0 0 "[ . 1 . 2]" 1
1433 1 62 ASN HA 1 65 SER H 5.310 4.780 5.840 5.279 5.168 5.495 . 0 0 "[ . 1 . 2]" 1
1434 1 62 ASN QB 1 62 ASN HD22 3.840 3.460 4.220 3.469 3.340 3.556 0.120 17 0 "[ . 1 . 2]" 1
1435 1 62 ASN QB 1 63 PRO HA 5.500 4.950 6.050 4.952 4.818 5.043 0.132 13 0 "[ . 1 . 2]" 1
1436 1 62 ASN QB 1 63 PRO QD 4.270 4.130 4.570 2.646 2.403 2.895 1.727 13 20 [************+***-***] 1
1437 1 62 ASN QB 1 64 VAL H 4.470 4.020 4.920 3.416 3.295 3.473 0.725 17 20 [*************-**+***] 1
1438 1 62 ASN QB 1 64 VAL HB 5.500 4.950 6.050 4.703 4.417 4.792 0.533 17 1 "[ . 1 . + 2]" 1
1439 1 62 ASN QB 1 64 VAL QG 5.450 4.900 5.650 4.142 4.050 4.211 0.850 17 20 [*******-********+***] 1
1440 1 62 ASN QB 1 65 SER H 5.420 4.880 5.960 4.707 4.323 4.783 0.557 17 1 "[ . 1 . + 2]" 1
1441 1 62 ASN HD21 1 64 VAL H 5.500 4.950 6.050 4.883 4.593 4.964 0.357 17 0 "[ . 1 . 2]" 1
1442 1 62 ASN HD21 1 64 VAL HB 4.950 4.460 5.440 5.407 4.797 5.538 0.098 8 0 "[ . 1 . 2]" 1
1443 1 62 ASN HD21 1 64 VAL QG 5.290 4.760 5.820 5.477 5.004 5.602 . 0 0 "[ . 1 . 2]" 1
1444 1 62 ASN HD21 1 65 SER H 4.780 4.300 5.260 4.280 4.096 4.397 0.204 5 0 "[ . 1 . 2]" 1
1445 1 62 ASN HD21 1 65 SER HA 5.500 4.950 6.050 6.310 6.050 6.404 0.354 2 0 "[ . 1 . 2]" 1
1446 1 62 ASN HD21 1 65 SER QB 5.500 4.950 5.590 4.468 4.208 4.592 0.742 5 6 "[* * + * 1 . * -]" 1
1447 1 62 ASN HD22 1 64 VAL H 5.500 4.950 6.050 5.250 5.015 6.208 0.158 17 0 "[ . 1 . 2]" 1
1448 1 62 ASN HD22 1 64 VAL HB 5.500 4.950 6.050 4.967 4.674 6.230 0.276 13 0 "[ . 1 . 2]" 1
1449 1 62 ASN HD22 1 64 VAL QG 5.500 4.950 6.050 5.144 4.914 6.023 0.036 13 0 "[ . 1 . 2]" 1
1450 1 62 ASN HD22 1 65 SER QB 5.500 4.950 6.050 4.514 4.394 5.208 0.556 1 7 "[+* *. 1 * *.* -2]" 1
1451 1 63 PRO HA 1 64 VAL QG 5.500 4.950 6.050 5.049 4.988 5.109 . 0 0 "[ . 1 . 2]" 1
1452 1 63 PRO HA 1 65 SER H 5.070 4.560 5.580 4.312 4.217 4.384 0.343 14 0 "[ . 1 . 2]" 1
1453 1 63 PRO HA 1 66 ALA H 4.310 3.880 4.740 3.645 3.524 3.735 0.356 3 0 "[ . 1 . 2]" 1
1454 1 63 PRO HA 1 66 ALA MB 3.920 3.530 4.310 3.337 3.209 3.525 0.321 13 0 "[ . 1 . 2]" 1
1455 1 63 PRO HA 1 67 GLN H 5.190 4.670 5.710 5.276 4.994 5.517 . 0 0 "[ . 1 . 2]" 1
1456 1 63 PRO HA 1 67 GLN QG 5.500 4.950 6.050 5.271 4.961 5.495 . 0 0 "[ . 1 . 2]" 1
1457 1 63 PRO QB 1 64 VAL H 4.440 4.000 4.880 3.668 3.547 3.742 0.453 8 0 "[ . 1 . 2]" 1
1458 1 63 PRO QB 1 64 VAL HA 5.350 4.810 5.890 4.351 4.260 4.420 0.550 8 3 "[* . + 1 . - 2]" 1
1459 1 63 PRO QB 1 64 VAL QG 5.500 4.950 5.910 4.177 3.965 4.255 0.985 8 20 [*******+*****-******] 1
1460 1 63 PRO QB 1 65 SER H 5.500 4.950 5.870 5.350 5.292 5.401 . 0 0 "[ . 1 . 2]" 1
1461 1 63 PRO QB 1 66 ALA H 5.500 4.950 6.050 5.064 4.992 5.121 . 0 0 "[ . 1 . 2]" 1
1462 1 63 PRO QB 1 66 ALA MB 5.440 4.900 5.940 4.268 4.150 4.381 0.750 3 20 [**+**********-******] 1
1463 1 63 PRO QB 1 67 GLN QE 5.370 4.950 5.910 4.160 3.344 4.360 1.606 3 20 [**+*-***************] 1
1464 1 63 PRO QB 1 67 GLN QG 5.210 4.690 5.270 4.782 4.381 5.068 0.309 16 0 "[ . 1 . 2]" 1
1465 1 63 PRO QD 1 64 VAL H . 4.260 4.520 3.895 3.827 3.972 0.433 7 0 "[ . 1 . 2]" 1
1466 1 63 PRO QD 1 64 VAL HA 5.320 4.790 5.850 6.066 5.987 6.135 0.285 17 0 "[ . 1 . 2]" 1
1467 1 63 PRO QD 1 64 VAL QG 4.950 4.950 5.440 4.832 4.726 4.914 0.224 7 0 "[ . 1 . 2]" 1
1468 1 63 PRO QD 1 65 SER H 5.500 4.950 6.050 5.414 5.389 5.458 . 0 0 "[ . 1 . 2]" 1
1469 1 63 PRO QG 1 64 VAL H 4.350 3.910 4.790 3.708 3.563 3.842 0.347 3 0 "[ . 1 . 2]" 1
1470 1 63 PRO QG 1 64 VAL QG 4.760 4.280 5.240 4.094 3.973 4.188 0.307 16 0 "[ . 1 . 2]" 1
1471 1 64 VAL H 1 64 VAL HB 2.980 2.680 3.280 2.659 2.609 2.756 0.071 8 0 "[ . 1 . 2]" 1
1472 1 64 VAL H 1 64 VAL QG 3.250 2.920 3.580 2.559 2.497 2.634 0.423 17 0 "[ . 1 . 2]" 1
1473 1 64 VAL H 1 65 SER H 3.390 3.050 3.730 2.688 2.654 2.737 0.396 4 0 "[ . 1 . 2]" 1
1474 1 64 VAL H 1 65 SER HA 5.500 4.950 6.050 5.275 5.242 5.354 . 0 0 "[ . 1 . 2]" 1
1475 1 64 VAL H 1 65 SER QB 5.420 4.880 5.960 5.256 5.182 5.324 . 0 0 "[ . 1 . 2]" 1
1476 1 64 VAL H 1 66 ALA H 4.930 4.440 5.420 4.369 4.311 4.444 0.129 19 0 "[ . 1 . 2]" 1
1477 1 64 VAL H 1 66 ALA MB 5.500 4.950 6.050 5.368 5.291 5.485 . 0 0 "[ . 1 . 2]" 1
1478 1 64 VAL H 1 67 GLN QG 5.100 4.590 5.610 5.816 5.576 5.960 0.350 20 0 "[ . 1 . 2]" 1
1479 1 64 VAL HA 1 64 VAL QG 3.260 2.930 3.590 2.233 2.184 2.261 0.746 8 20 [*-*****+************] 1
1480 1 64 VAL HA 1 66 ALA H 5.310 4.780 5.840 4.358 4.104 4.487 0.676 19 5 "[ .* -1 . * +*]" 1
1481 1 64 VAL HA 1 66 ALA MB 5.500 4.950 6.050 5.208 5.085 5.286 . 0 0 "[ . 1 . 2]" 1
1482 1 64 VAL HA 1 67 GLN QB 3.590 3.230 3.950 3.977 3.475 4.240 0.290 5 0 "[ . 1 . 2]" 1
1483 1 64 VAL HA 1 67 GLN QG 3.980 3.580 4.380 3.832 3.621 4.070 . 0 0 "[ . 1 . 2]" 1
1484 1 64 VAL HA 1 68 ALA H 4.940 4.450 5.430 5.404 5.233 5.519 0.089 20 0 "[ . 1 . 2]" 1
1485 1 64 VAL HA 1 68 ALA MB 5.500 4.950 6.050 6.062 5.913 6.163 0.113 17 0 "[ . 1 . 2]" 1
1486 1 64 VAL HB 1 65 SER H 3.520 3.170 3.870 3.137 3.104 3.175 0.066 3 0 "[ . 1 . 2]" 1
1487 1 64 VAL HB 1 65 SER HA 5.150 4.630 5.670 4.581 4.539 4.641 0.091 17 0 "[ . 1 . 2]" 1
1488 1 64 VAL HB 1 66 ALA H 5.500 4.950 6.050 5.514 5.415 5.601 . 0 0 "[ . 1 . 2]" 1
1489 1 64 VAL QG 1 65 SER H 4.150 3.730 4.570 3.545 3.505 3.573 0.225 3 0 "[ . 1 . 2]" 1
1490 1 64 VAL QG 1 65 SER HA 5.500 4.950 6.050 3.595 3.516 3.671 1.434 13 20 [************+***-***] 1
1491 1 64 VAL QG 1 65 SER QB 5.500 4.950 6.050 4.363 4.299 4.464 0.651 13 19 "[***-********+ ******]" 1
1492 1 64 VAL QG 1 66 ALA H 5.500 4.950 6.050 4.827 4.700 4.924 0.250 19 0 "[ . 1 . 2]" 1
1493 1 64 VAL QG 1 67 GLN QE 5.500 4.950 6.050 4.352 3.363 5.596 1.587 6 12 "[* **.+ -*1* *. ****]" 1
1494 1 64 VAL QG 1 67 GLN QG 5.150 4.630 5.670 4.505 4.367 4.702 0.263 7 0 "[ . 1 . 2]" 1
1495 1 64 VAL QG 1 68 ALA MB 4.950 4.460 5.440 4.410 4.249 4.482 0.211 14 0 "[ . 1 . 2]" 1
1496 1 65 SER H 1 65 SER QB 3.780 3.520 4.160 2.931 2.851 2.987 0.669 3 20 [**+**************-**] 1
1497 1 65 SER H 1 66 ALA H 3.390 3.050 3.730 2.798 2.737 2.945 0.313 7 0 "[ . 1 . 2]" 1
1498 1 65 SER H 1 66 ALA MB 5.160 4.640 5.680 4.610 4.549 4.736 0.091 20 0 "[ . 1 . 2]" 1
1499 1 65 SER HA 1 66 ALA HA 4.650 4.180 5.120 4.825 4.761 4.887 . 0 0 "[ . 1 . 2]" 1
1500 1 65 SER HA 1 67 GLN H 4.830 4.350 5.310 4.149 4.061 4.288 0.289 6 0 "[ . 1 . 2]" 1
1501 1 65 SER HA 1 67 GLN QB 5.500 4.950 6.050 5.194 4.845 5.483 0.105 3 0 "[ . 1 . 2]" 1
1502 1 65 SER HA 1 68 ALA MB 4.000 3.600 4.400 3.588 3.486 3.692 0.114 18 0 "[ . 1 . 2]" 1
1503 1 65 SER HA 1 69 ALA MB 5.500 4.950 6.050 5.355 5.103 5.549 . 0 0 "[ . 1 . 2]" 1
1504 1 65 SER QB 1 66 ALA H 4.150 3.920 4.570 3.706 3.628 3.832 0.292 10 0 "[ . 1 . 2]" 1
1505 1 65 SER QB 1 66 ALA HA 5.500 4.950 6.050 4.396 4.311 4.448 0.639 10 20 [*******-*+**********] 1
1506 1 65 SER QB 1 66 ALA MB 5.500 4.950 6.050 4.787 4.664 4.878 0.286 19 0 "[ . 1 . 2]" 1
1507 1 65 SER QB 1 68 ALA MB 5.500 4.950 6.050 4.471 4.319 4.595 0.631 18 7 "[ * .* 1 - *. *+ *]" 1
1508 1 65 SER QB 1 69 ALA MB 5.500 4.950 6.050 4.659 4.562 4.809 0.388 11 0 "[ . 1 . 2]" 1
1509 1 66 ALA H 1 66 ALA MB 3.450 3.110 3.790 2.388 2.333 2.433 0.777 4 20 [***+**************-*] 1
1510 1 66 ALA H 1 67 GLN H 3.680 3.310 4.050 2.775 2.559 2.938 0.751 19 10 "[ *.* *-1* *. **+*]" 1
1511 1 66 ALA H 1 67 GLN HA 5.500 4.950 6.050 5.354 5.207 5.454 . 0 0 "[ . 1 . 2]" 1
1512 1 66 ALA H 1 67 GLN QB 5.170 4.650 5.690 4.983 4.713 5.205 . 0 0 "[ . 1 . 2]" 1
1513 1 66 ALA H 1 67 GLN QE 5.500 4.950 6.050 5.050 3.949 6.179 1.001 5 8 "[ * + - * ** ** 2]" 1
1514 1 66 ALA H 1 67 GLN QG 4.780 4.300 5.260 4.519 4.213 4.847 0.087 19 0 "[ . 1 . 2]" 1
1515 1 66 ALA H 1 68 ALA H 5.000 4.500 5.500 4.567 4.447 4.664 0.053 17 0 "[ . 1 . 2]" 1
1516 1 66 ALA H 1 69 ALA H 5.500 4.950 6.050 5.221 5.109 5.291 . 0 0 "[ . 1 . 2]" 1
1517 1 66 ALA HA 1 67 GLN QG 5.500 4.950 6.050 5.449 5.122 5.695 . 0 0 "[ . 1 . 2]" 1
1518 1 66 ALA HA 1 68 ALA H 5.500 4.950 6.050 4.578 4.470 4.654 0.480 1 0 "[ . 1 . 2]" 1
1519 1 66 ALA HA 1 69 ALA H 4.330 3.900 4.760 3.660 3.467 3.775 0.433 3 0 "[ . 1 . 2]" 1
1520 1 66 ALA HA 1 69 ALA MB 4.030 3.630 4.430 3.345 3.209 3.473 0.421 3 0 "[ . 1 . 2]" 1
1521 1 66 ALA HA 1 70 ILE H 5.270 4.740 5.800 4.435 4.094 4.571 0.646 3 1 "[ + . 1 . 2]" 1
1522 1 66 ALA HA 1 70 ILE HB 5.500 4.950 6.050 5.976 5.630 6.155 0.105 16 0 "[ . 1 . 2]" 1
1523 1 66 ALA MB 1 67 GLN H 3.790 3.410 4.170 3.007 2.939 3.129 0.471 7 0 "[ . 1 . 2]" 1
1524 1 66 ALA MB 1 67 GLN HA 5.500 4.950 6.050 3.953 3.768 4.108 1.182 13 20 [************+-******] 1
1525 1 66 ALA MB 1 67 GLN QB 5.320 4.790 5.850 4.683 4.580 4.800 0.210 12 0 "[ . 1 . 2]" 1
1526 1 66 ALA MB 1 67 GLN QG 4.480 4.030 4.930 3.663 3.358 3.812 0.672 1 3 "[+ . *1- . 2]" 1
1527 1 66 ALA MB 1 69 ALA MB 4.000 3.600 4.400 4.259 4.056 4.412 0.012 9 0 "[ . 1 . 2]" 1
1528 1 66 ALA MB 1 70 ILE MG 5.440 4.900 5.980 5.505 5.169 5.720 . 0 0 "[ . 1 . 2]" 1
1529 1 67 GLN H 1 67 GLN QB 3.190 2.870 3.510 2.571 2.485 2.638 0.385 3 0 "[ . 1 . 2]" 1
1530 1 67 GLN H 1 67 GLN QG 3.030 2.730 3.330 2.548 2.410 2.657 0.320 9 0 "[ . 1 . 2]" 1
1531 1 67 GLN H 1 70 ILE H 5.500 4.950 6.050 5.110 5.036 5.197 . 0 0 "[ . 1 . 2]" 1
1532 1 67 GLN H 1 70 ILE HB 5.390 4.850 5.930 5.793 5.648 5.908 . 0 0 "[ . 1 . 2]" 1
1533 1 67 GLN H 1 70 ILE MD 4.590 4.130 5.050 5.072 4.668 5.207 0.157 16 0 "[ . 1 . 2]" 1
1534 1 67 GLN HA 1 67 GLN QG 3.450 3.110 3.790 2.793 2.441 3.110 0.669 3 6 "[ +*. - 1 *. ** 2]" 1
1535 1 67 GLN HA 1 69 ALA H 5.500 4.950 6.050 4.645 4.539 4.749 0.411 7 0 "[ . 1 . 2]" 1
1536 1 67 GLN HA 1 70 ILE H 4.160 3.740 4.580 3.748 3.541 4.026 0.199 16 0 "[ . 1 . 2]" 1
1537 1 67 GLN HA 1 70 ILE HA 5.500 4.950 6.050 5.947 5.725 6.192 0.142 4 0 "[ . 1 . 2]" 1
1538 1 67 GLN HA 1 70 ILE HB 3.680 3.310 4.050 3.348 3.166 3.614 0.144 13 0 "[ . 1 . 2]" 1
1539 1 67 GLN HA 1 70 ILE MD 3.820 3.440 4.200 3.463 3.358 3.678 0.082 13 0 "[ . 1 . 2]" 1
1540 1 67 GLN HA 1 70 ILE QG 5.500 4.950 6.050 3.991 3.399 4.584 1.551 16 17 "[** ****-******+* **]" 1
1541 1 67 GLN HA 1 70 ILE MG 4.360 3.920 4.800 4.589 4.427 4.830 0.030 4 0 "[ . 1 . 2]" 1
1542 1 67 GLN QB 1 68 ALA H 3.460 3.110 3.810 2.833 2.759 2.883 0.351 20 0 "[ . 1 . 2]" 1
1543 1 67 GLN QB 1 68 ALA MB 4.350 3.910 4.790 4.007 3.905 4.144 0.005 6 0 "[ . 1 . 2]" 1
1544 1 67 GLN QB 1 69 ALA H 5.500 4.950 6.050 5.095 5.013 5.158 . 0 0 "[ . 1 . 2]" 1
1545 1 67 GLN QB 1 70 ILE HB 5.270 4.740 5.800 4.963 4.684 5.361 0.056 13 0 "[ . 1 . 2]" 1
1546 1 67 GLN QB 1 70 ILE MD 5.500 4.950 6.050 5.027 4.799 5.315 0.151 16 0 "[ . 1 . 2]" 1
1547 1 67 GLN QB 1 70 ILE MG 5.430 4.890 5.970 5.645 5.408 6.023 0.053 4 0 "[ . 1 . 2]" 1
1548 1 67 GLN QG 1 68 ALA H 4.620 4.160 5.080 4.394 4.342 4.506 . 0 0 "[ . 1 . 2]" 1
1549 1 67 GLN QG 1 70 ILE H 5.500 4.950 6.050 6.009 5.754 6.247 0.197 10 0 "[ . 1 . 2]" 1
1550 1 67 GLN QG 1 70 ILE HB 5.090 4.580 5.600 5.537 5.236 5.788 0.188 5 0 "[ . 1 . 2]" 1
1551 1 67 GLN QG 1 70 ILE MD 4.500 4.050 4.950 4.632 4.237 4.946 . 0 0 "[ . 1 . 2]" 1
1552 1 68 ALA H 1 68 ALA MB 3.080 2.770 3.390 2.366 2.342 2.410 0.428 20 0 "[ . 1 . 2]" 1
1553 1 68 ALA H 1 70 ILE H 5.250 4.720 5.780 4.525 4.400 4.598 0.320 1 0 "[ . 1 . 2]" 1
1554 1 68 ALA H 1 70 ILE MD 5.500 4.950 6.050 6.075 5.168 6.266 0.216 14 0 "[ . 1 . 2]" 1
1555 1 68 ALA H 1 70 ILE QG 5.500 4.950 6.050 5.878 5.553 6.543 0.493 1 0 "[ . 1 . 2]" 1
1556 1 68 ALA HA 1 69 ALA MB 5.500 4.950 6.050 5.161 5.094 5.209 . 0 0 "[ . 1 . 2]" 1
1557 1 68 ALA HA 1 70 ILE H 5.250 4.720 5.780 4.578 4.450 4.744 0.270 14 0 "[ . 1 . 2]" 1
1558 1 68 ALA HA 1 71 GLN H 4.240 3.820 4.660 3.825 3.725 4.056 0.095 7 0 "[ . 1 . 2]" 1
1559 1 68 ALA HA 1 71 GLN QB 3.590 3.230 3.950 3.525 3.229 3.985 0.035 16 0 "[ . 1 . 2]" 1
1560 1 68 ALA HA 1 72 ALA H 5.140 4.630 5.650 4.720 4.448 4.954 0.182 13 0 "[ . 1 . 2]" 1
1561 1 68 ALA HA 1 72 ALA MB 5.500 4.950 6.050 5.376 5.005 5.686 . 0 0 "[ . 1 . 2]" 1
1562 1 68 ALA MB 1 69 ALA H 3.700 3.330 4.070 2.908 2.818 2.978 0.512 16 1 "[ . 1 .+ 2]" 1
1563 1 68 ALA MB 1 69 ALA HA 4.670 4.200 5.140 4.028 3.974 4.063 0.226 18 0 "[ . 1 . 2]" 1
1564 1 68 ALA MB 1 69 ALA MB 3.740 3.370 4.110 4.030 3.800 4.167 0.057 3 0 "[ . 1 . 2]" 1
1565 1 68 ALA MB 1 70 ILE H 5.500 4.950 6.050 4.954 4.873 5.041 0.077 16 0 "[ . 1 . 2]" 1
1566 1 68 ALA MB 1 71 GLN H 5.490 4.940 6.040 4.983 4.904 5.175 0.036 13 0 "[ . 1 . 2]" 1
1567 1 68 ALA MB 1 71 GLN QB 4.350 3.910 4.790 4.513 4.272 4.851 0.061 16 0 "[ . 1 . 2]" 1
1568 1 68 ALA MB 1 72 ALA MB 4.380 3.940 4.820 4.639 4.386 4.846 0.026 11 0 "[ . 1 . 2]" 1
1569 1 69 ALA H 1 69 ALA MB 3.420 3.080 3.760 2.298 2.240 2.404 0.840 16 20 [**-************+****] 1
1570 1 69 ALA H 1 70 ILE H 3.700 3.330 4.070 2.966 2.904 3.037 0.426 20 0 "[ . 1 . 2]" 1
1571 1 69 ALA H 1 70 ILE HB 5.240 4.720 5.760 5.191 5.087 5.305 . 0 0 "[ . 1 . 2]" 1
1572 1 69 ALA H 1 71 GLN H 4.220 3.800 4.640 4.663 4.540 4.753 0.113 16 0 "[ . 1 . 2]" 1
1573 1 69 ALA HA 1 70 ILE HA 5.500 4.950 6.050 4.778 4.679 4.822 0.271 18 0 "[ . 1 . 2]" 1
1574 1 69 ALA HA 1 71 GLN H 3.980 3.580 4.380 4.412 4.284 4.497 0.117 6 0 "[ . 1 . 2]" 1
1575 1 69 ALA HA 1 72 ALA H 3.890 3.500 4.280 3.480 3.380 3.587 0.120 8 0 "[ . 1 . 2]" 1
1576 1 69 ALA HA 1 72 ALA HA 5.500 4.950 6.050 5.796 5.673 5.894 . 0 0 "[ . 1 . 2]" 1
1577 1 69 ALA HA 1 72 ALA MB 3.950 3.550 4.350 3.452 3.405 3.529 0.145 3 0 "[ . 1 . 2]" 1
1578 1 69 ALA HA 1 73 MET H 4.700 4.230 5.170 4.429 4.159 4.589 0.071 18 0 "[ . 1 . 2]" 1
1579 1 69 ALA HA 1 73 MET QB 4.530 4.080 4.980 4.029 3.890 4.147 0.190 20 0 "[ . 1 . 2]" 1
1580 1 69 ALA MB 1 70 ILE H 3.960 3.560 4.360 2.977 2.757 3.256 0.803 13 13 "[ ** **** ***+ * -*]" 1
1581 1 69 ALA MB 1 70 ILE HA 5.500 4.950 6.050 3.938 3.802 4.105 1.148 3 20 [**+**************-**] 1
1582 1 69 ALA MB 1 70 ILE HB 5.500 4.950 6.050 4.988 4.832 5.185 0.118 3 0 "[ . 1 . 2]" 1
1583 1 69 ALA MB 1 70 ILE QG 5.500 4.950 6.050 3.647 3.417 4.883 1.533 3 19 "[ *+**************-**]" 1
1584 1 69 ALA MB 1 71 GLN H 5.480 4.930 6.030 4.908 4.747 5.062 0.183 13 0 "[ . 1 . 2]" 1
1585 1 69 ALA MB 1 72 ALA H 5.500 4.950 6.050 4.795 4.706 4.919 0.244 8 0 "[ . 1 . 2]" 1
1586 1 69 ALA MB 1 72 ALA MB 4.030 3.630 4.430 4.431 4.361 4.492 0.062 12 0 "[ . 1 . 2]" 1
1587 1 69 ALA MB 1 73 MET H 5.500 4.950 6.050 4.845 4.752 4.923 0.198 8 0 "[ . 1 . 2]" 1
1588 1 69 ALA MB 1 73 MET HA 5.500 4.950 6.050 5.636 5.477 5.839 . 0 0 "[ . 1 . 2]" 1
1589 1 69 ALA MB 1 85 VAL HB 5.500 4.950 6.050 6.023 5.861 6.120 0.070 4 0 "[ . 1 . 2]" 1
1590 1 69 ALA MB 1 85 VAL QG 4.420 4.200 4.860 3.777 3.598 3.866 0.602 18 2 "[ . 1 . -+ 2]" 1
1591 1 70 ILE H 1 70 ILE HB 3.010 2.710 3.310 2.464 2.391 2.557 0.319 19 0 "[ . 1 . 2]" 1
1592 1 70 ILE H 1 70 ILE MD 4.240 3.820 4.660 3.706 2.424 3.908 1.396 1 1 "[+ . 1 . 2]" 1
1593 1 70 ILE H 1 70 ILE QG 3.880 3.490 4.270 2.431 2.255 3.484 1.235 10 19 "[ ********+*******-**]" 1
1594 1 70 ILE H 1 70 ILE MG 4.250 3.820 4.680 3.811 3.787 3.829 0.033 19 0 "[ . 1 . 2]" 1
1595 1 70 ILE H 1 71 GLN H 3.540 3.190 3.890 2.962 2.816 3.042 0.374 14 0 "[ . 1 . 2]" 1
1596 1 70 ILE H 1 71 GLN QB 4.900 4.410 5.390 4.860 4.721 4.984 . 0 0 "[ . 1 . 2]" 1
1597 1 70 ILE H 1 71 GLN QE 5.500 4.950 6.050 5.673 5.430 5.929 . 0 0 "[ . 1 . 2]" 1
1598 1 70 ILE H 1 72 ALA H 5.500 4.950 6.050 4.811 4.764 4.854 0.186 18 0 "[ . 1 . 2]" 1
1599 1 70 ILE H 1 85 VAL QG 5.330 4.800 5.860 4.331 4.175 4.563 0.625 13 9 "[* * .* * + .*** -]" 1
1600 1 70 ILE HA 1 70 ILE MD 4.520 4.070 4.970 3.826 2.538 3.953 1.532 1 1 "[+ . 1 . 2]" 1
1601 1 70 ILE HA 1 70 ILE QG 3.930 3.540 4.320 2.419 2.326 2.791 1.214 14 20 [-************+******] 1
1602 1 70 ILE HA 1 70 ILE MG 3.570 3.210 3.930 2.695 2.618 2.761 0.592 13 11 "[ * **** ** + ** -]" 1
1603 1 70 ILE HA 1 71 GLN HA 5.500 4.950 6.050 4.790 4.699 4.853 0.251 12 0 "[ . 1 . 2]" 1
1604 1 70 ILE HA 1 71 GLN QB 5.500 4.950 6.050 5.483 5.396 5.564 . 0 0 "[ . 1 . 2]" 1
1605 1 70 ILE HA 1 72 ALA H 5.300 4.770 5.830 5.019 4.910 5.165 . 0 0 "[ . 1 . 2]" 1
1606 1 70 ILE HA 1 73 MET H 4.800 4.320 5.280 3.945 3.848 4.066 0.472 12 0 "[ . 1 . 2]" 1
1607 1 70 ILE HA 1 74 ASN H 4.230 3.810 4.650 3.851 3.739 4.065 0.071 8 0 "[ . 1 . 2]" 1
1608 1 70 ILE HA 1 74 ASN HA 5.500 4.950 6.050 5.394 5.301 5.494 . 0 0 "[ . 1 . 2]" 1
1609 1 70 ILE HA 1 74 ASN QB 4.360 3.920 4.800 4.425 4.257 4.600 . 0 0 "[ . 1 . 2]" 1
1610 1 70 ILE HA 1 74 ASN QD 5.500 4.950 6.050 5.506 5.367 5.609 . 0 0 "[ . 1 . 2]" 1
1611 1 70 ILE HA 1 85 VAL H 5.500 4.950 6.050 5.979 5.820 6.138 0.088 4 0 "[ . 1 . 2]" 1
1612 1 70 ILE HA 1 85 VAL HB 4.510 4.060 4.960 4.056 3.884 4.218 0.176 13 0 "[ . 1 . 2]" 1
1613 1 70 ILE HB 1 70 ILE MD 3.200 2.880 3.520 2.599 2.504 2.834 0.376 4 0 "[ . 1 . 2]" 1
1614 1 70 ILE HB 1 71 GLN H 3.320 2.990 3.650 3.077 3.013 3.197 . 0 0 "[ . 1 . 2]" 1
1615 1 70 ILE HB 1 71 GLN QB 4.800 4.320 5.280 4.839 4.398 5.148 . 0 0 "[ . 1 . 2]" 1
1616 1 70 ILE HB 1 71 GLN QE 5.500 4.950 6.050 4.476 4.197 4.821 0.753 13 6 "[ - . * + . * **]" 1
1617 1 70 ILE HB 1 72 ALA H 5.250 4.720 5.780 5.914 5.816 5.982 0.202 9 0 "[ . 1 . 2]" 1
1618 1 70 ILE HB 1 74 ASN QB 5.500 4.950 6.050 5.924 5.887 5.984 . 0 0 "[ . 1 . 2]" 1
1619 1 70 ILE MD 1 70 ILE MG 3.200 2.880 3.520 2.296 2.144 3.217 0.736 6 16 "[ ** *+** ******** -*]" 1
1620 1 70 ILE MD 1 71 GLN H 5.500 4.950 6.050 5.149 4.618 5.298 0.332 1 0 "[ . 1 . 2]" 1
1621 1 70 ILE MD 1 85 VAL HB 5.500 4.950 6.050 5.519 4.688 5.914 0.262 1 0 "[ . 1 . 2]" 1
1622 1 70 ILE MD 1 86 GLN H 5.500 4.950 6.050 6.083 5.566 6.494 0.444 14 0 "[ . 1 . 2]" 1
1623 1 70 ILE MD 1 86 GLN HA 4.440 4.000 4.880 5.139 5.006 5.522 0.642 3 1 "[ + . 1 . 2]" 1
1624 1 70 ILE MD 1 87 LEU HA 4.970 4.470 5.470 4.246 2.352 5.168 2.118 10 5 "[ * .* + . * -]" 1
1625 1 70 ILE QG 1 71 GLN H 5.500 4.950 6.050 4.532 4.445 4.844 0.505 10 1 "[ . + . 2]" 1
1626 1 70 ILE QG 1 71 GLN QB 5.500 4.950 6.050 6.113 5.878 6.277 0.227 9 0 "[ . 1 . 2]" 1
1627 1 70 ILE QG 1 85 VAL H 5.500 4.950 6.050 6.070 5.807 6.185 0.135 13 0 "[ . 1 . 2]" 1
1628 1 70 ILE QG 1 85 VAL HB 5.160 4.640 5.680 4.415 4.277 4.674 0.363 9 0 "[ . 1 . 2]" 1
1629 1 70 ILE QG 1 85 VAL QG 4.290 3.860 4.720 2.239 2.152 2.521 1.708 6 20 [-****+**************] 1
1630 1 70 ILE QG 1 86 GLN HA 5.500 4.950 6.050 5.575 4.890 6.026 0.060 1 0 "[ . 1 . 2]" 1
1631 1 70 ILE MG 1 71 GLN H 4.030 3.630 4.430 3.535 3.441 3.595 0.189 19 0 "[ . 1 . 2]" 1
1632 1 70 ILE MG 1 71 GLN HA 4.030 3.630 4.430 3.662 3.523 3.841 0.107 4 0 "[ . 1 . 2]" 1
1633 1 70 ILE MG 1 71 GLN QB 4.890 4.400 5.380 4.642 4.323 4.967 0.077 16 0 "[ . 1 . 2]" 1
1634 1 70 ILE MG 1 71 GLN QE . 4.950 5.020 3.870 3.291 4.292 1.659 19 20 [******-***********+*] 1
1635 1 70 ILE MG 1 71 GLN QG 4.660 4.190 5.130 5.100 4.793 5.445 0.315 1 0 "[ . 1 . 2]" 1
1636 1 70 ILE MG 1 74 ASN H 4.840 4.360 5.320 4.265 4.209 4.322 0.151 11 0 "[ . 1 . 2]" 1
1637 1 70 ILE MG 1 74 ASN HA 5.460 4.910 6.010 5.122 4.999 5.208 . 0 0 "[ . 1 . 2]" 1
1638 1 70 ILE MG 1 74 ASN QB 4.310 3.880 4.500 3.389 3.340 3.445 0.540 11 8 "[* -* **+* * 2]" 1
1639 1 70 ILE MG 1 74 ASN QD 4.910 4.820 5.400 4.282 4.146 4.472 0.674 17 12 "[* **. ***- * +***]" 1
1640 1 70 ILE MG 1 85 VAL H 5.290 4.760 5.820 5.434 5.142 5.647 . 0 0 "[ . 1 . 2]" 1
1641 1 70 ILE MG 1 86 GLN HA 5.500 4.950 6.050 5.489 5.222 5.716 . 0 0 "[ . 1 . 2]" 1
1642 1 71 GLN H 1 71 GLN QB 2.970 2.670 3.270 2.291 2.244 2.335 0.426 19 0 "[ . 1 . 2]" 1
1643 1 71 GLN H 1 71 GLN QE 4.440 4.000 4.880 3.557 3.289 3.881 0.711 13 7 "[- **.* 1 *+ .* 2]" 1
1644 1 71 GLN H 1 72 ALA H 3.610 3.250 3.970 3.120 3.016 3.213 0.234 14 0 "[ . 1 . 2]" 1
1645 1 71 GLN H 1 72 ALA HA 5.410 4.870 5.950 5.648 5.552 5.727 . 0 0 "[ . 1 . 2]" 1
1646 1 71 GLN H 1 72 ALA MB 5.350 4.810 5.890 4.943 4.842 5.063 . 0 0 "[ . 1 . 2]" 1
1647 1 71 GLN H 1 73 MET H 5.500 4.950 6.050 4.341 4.092 4.490 0.858 13 16 "[- **** ***+*******]" 1
1648 1 71 GLN HA 1 71 GLN QE 5.500 4.950 6.050 3.444 2.045 4.148 2.905 4 20 [***+****-***********] 1
1649 1 71 GLN HA 1 71 GLN QG 3.570 3.210 3.930 2.633 2.106 2.924 1.104 13 8 "[* *-.* *1 *+ .* 2]" 1
1650 1 71 GLN HA 1 72 ALA HA 4.400 3.960 4.840 4.694 4.655 4.763 . 0 0 "[ . 1 . 2]" 1
1651 1 71 GLN HA 1 72 ALA MB 5.500 4.950 6.050 5.151 5.121 5.204 . 0 0 "[ . 1 . 2]" 1
1652 1 71 GLN HA 1 74 ASN QB 5.500 4.950 6.050 4.675 4.417 4.917 0.533 16 2 "[ . 1 - .+ 2]" 1
1653 1 71 GLN QB 1 72 ALA H 3.320 2.990 3.650 2.738 2.679 2.844 0.311 8 0 "[ . 1 . 2]" 1
1654 1 71 GLN QB 1 72 ALA HA 4.380 3.940 4.820 4.012 3.827 4.325 0.113 18 0 "[ . 1 . 2]" 1
1655 1 71 GLN QB 1 72 ALA MB 3.790 3.410 4.170 3.776 3.617 3.986 . 0 0 "[ . 1 . 2]" 1
1656 1 71 GLN QB 1 73 MET H 5.500 4.950 6.050 4.622 4.518 4.759 0.432 5 0 "[ . 1 . 2]" 1
1657 1 71 GLN QG 1 72 ALA HA 4.880 4.390 5.370 5.043 4.136 5.461 0.254 4 0 "[ . 1 . 2]" 1
1658 1 72 ALA H 1 72 ALA MB 3.250 2.920 3.580 2.385 2.344 2.425 0.576 6 19 [****-+********.*****] 1
1659 1 72 ALA H 1 73 MET H 3.510 3.160 3.860 2.840 2.775 2.878 0.385 13 0 "[ . 1 . 2]" 1
1660 1 72 ALA H 1 73 MET HA 5.500 4.950 6.050 5.412 5.359 5.453 . 0 0 "[ . 1 . 2]" 1
1661 1 72 ALA H 1 73 MET QB 4.550 4.090 5.010 4.581 4.396 4.832 . 0 0 "[ . 1 . 2]" 1
1662 1 72 ALA H 1 73 MET QG 5.500 4.950 6.050 5.539 4.735 5.743 0.215 18 0 "[ . 1 . 2]" 1
1663 1 72 ALA H 1 74 ASN H 5.080 4.570 5.590 4.547 4.489 4.645 0.081 2 0 "[ . 1 . 2]" 1
1664 1 72 ALA HA 1 73 MET HA 4.530 4.080 4.980 4.695 4.566 4.754 . 0 0 "[ . 1 . 2]" 1
1665 1 72 ALA HA 1 73 MET QB 5.450 4.900 6.000 5.379 5.198 5.459 . 0 0 "[ . 1 . 2]" 1
1666 1 72 ALA HA 1 74 ASN H 5.500 4.950 6.050 4.620 4.570 4.727 0.380 2 0 "[ . 1 . 2]" 1
1667 1 72 ALA HA 1 74 ASN QD 5.500 4.950 6.050 4.626 4.493 4.872 0.457 13 0 "[ . 1 . 2]" 1
1668 1 72 ALA MB 1 73 MET H 3.840 3.460 4.220 3.471 3.419 3.532 0.041 16 0 "[ . 1 . 2]" 1
1669 1 72 ALA MB 1 73 MET HA 5.290 4.760 5.820 4.381 4.350 4.408 0.410 17 0 "[ . 1 . 2]" 1
1670 1 72 ALA MB 1 73 MET QB 4.280 3.850 4.710 4.460 4.205 4.570 . 0 0 "[ . 1 . 2]" 1
1671 1 72 ALA MB 1 73 MET QG 5.310 4.780 5.840 4.372 3.365 4.571 1.415 18 3 "[ . 1 . *+ -]" 1
1672 1 72 ALA MB 1 74 ASN H 5.290 4.760 5.820 5.154 5.115 5.231 . 0 0 "[ . 1 . 2]" 1
1673 1 73 MET H 1 73 MET QB 3.740 3.370 4.110 2.646 2.559 2.768 0.811 6 20 [*****+**********-***] 1
1674 1 73 MET H 1 73 MET QG 4.720 4.250 5.190 4.005 3.324 4.115 0.926 18 2 "[ . 1 . -+ 2]" 1
1675 1 73 MET H 1 74 ASN H 3.530 3.180 3.880 2.157 2.084 2.247 1.096 7 20 [******+********-****] 1
1676 1 73 MET H 1 74 ASN HA 5.500 4.950 6.050 4.733 4.665 4.805 0.285 15 0 "[ . 1 . 2]" 1
1677 1 73 MET H 1 74 ASN QB 5.500 4.950 6.050 4.785 4.714 4.860 0.236 7 0 "[ . 1 . 2]" 1
1678 1 73 MET H 1 85 VAL QG 5.420 4.880 5.960 4.609 4.470 4.723 0.410 16 0 "[ . 1 . 2]" 1
1679 1 73 MET HA 1 74 ASN HA 4.880 4.390 5.370 4.493 4.428 4.568 . 0 0 "[ . 1 . 2]" 1
1680 1 73 MET HA 1 76 PHE H 4.440 4.000 4.880 4.439 4.089 4.873 . 0 0 "[ . 1 . 2]" 1
1681 1 73 MET HA 1 76 PHE HA 5.410 4.870 5.950 5.117 4.822 5.345 0.048 17 0 "[ . 1 . 2]" 1
1682 1 73 MET HA 1 76 PHE QD 4.900 4.410 5.390 3.347 2.750 4.403 1.660 12 13 "[-** *****1*+ * **2]" 1
1683 1 73 MET HA 1 76 PHE QE 5.500 4.950 6.050 5.132 4.709 5.742 0.241 12 0 "[ . 1 . 2]" 1
1684 1 73 MET HA 1 85 VAL QG 5.030 4.530 5.530 4.340 4.154 4.493 0.376 11 0 "[ . 1 . 2]" 1
1685 1 73 MET QB 1 74 ASN H 4.200 3.780 4.620 3.323 3.240 3.457 0.540 3 5 "[ *+ .* - 1* . 2]" 1
1686 1 73 MET QB 1 75 GLY H 5.150 4.630 5.670 5.784 5.372 5.947 0.277 12 0 "[ . 1 . 2]" 1
1687 1 73 MET QB 1 76 PHE QB 5.500 4.950 6.050 4.497 3.982 4.679 0.968 18 6 "[ *. * -*. *+ 2]" 1
1688 1 73 MET QB 1 76 PHE QD 5.450 4.900 6.000 4.825 4.571 5.246 0.329 18 0 "[ . 1 . 2]" 1
1689 1 73 MET QB 1 85 VAL QG 5.180 4.660 5.700 2.224 2.035 2.360 2.625 16 20 [***-***********+****] 1
1690 1 73 MET QG 1 74 ASN H 5.080 4.570 5.590 5.018 4.833 5.093 . 0 0 "[ . 1 . 2]" 1
1691 1 73 MET QG 1 76 PHE H 5.500 4.950 6.050 6.068 5.807 6.220 0.170 18 0 "[ . 1 . 2]" 1
1692 1 73 MET QG 1 76 PHE QB 5.160 4.670 5.680 4.271 4.060 4.492 0.610 4 4 "[ +. * -*. 2]" 1
1693 1 73 MET QG 1 76 PHE QD 3.500 3.150 3.850 3.828 3.563 4.115 0.265 17 0 "[ . 1 . 2]" 1
1694 1 73 MET QG 1 76 PHE QE 5.500 4.950 6.050 4.853 4.663 5.095 0.287 4 0 "[ . 1 . 2]" 1
1695 1 73 MET QG 1 83 LEU QB 5.500 4.950 6.050 4.770 4.652 5.026 0.298 12 0 "[ . 1 . 2]" 1
1696 1 73 MET QG 1 83 LEU QD 5.500 4.950 6.050 2.572 2.187 4.178 2.763 16 20 [***************+***-] 1
1697 1 73 MET QG 1 85 VAL QG 5.260 4.730 5.790 3.115 2.958 3.456 1.772 15 20 [**************+**-**] 1
1698 1 74 ASN H 1 74 ASN QB . 3.600 3.930 2.889 2.848 2.926 0.752 2 20 [*+**********-*******] 1
1699 1 74 ASN H 1 74 ASN QD 5.500 4.950 6.050 2.782 2.625 2.972 2.325 10 20 [*******-*+**********] 1
1700 1 74 ASN H 1 75 GLY H 5.220 4.700 5.740 4.686 4.553 4.744 0.147 20 0 "[ . 1 . 2]" 1
1701 1 74 ASN H 1 85 VAL HB 4.990 4.490 5.490 4.527 4.402 4.695 0.088 18 0 "[ . 1 . 2]" 1
1702 1 74 ASN H 1 85 VAL QG 5.080 4.570 5.540 4.268 4.163 4.417 0.407 6 0 "[ . 1 . 2]" 1
1703 1 74 ASN HA 1 75 GLY H 3.350 3.010 3.690 2.488 2.434 2.532 0.576 15 14 "[-** . ***** **+ ** *]" 1
1704 1 74 ASN HA 1 75 GLY QA 5.500 4.950 5.920 4.136 4.089 4.174 0.861 20 20 [***********-*******+] 1
1705 1 74 ASN HA 1 76 PHE H 5.000 4.500 5.500 4.245 4.154 4.297 0.346 19 0 "[ . 1 . 2]" 1
1706 1 74 ASN HA 1 84 LYS HA 4.510 4.060 4.960 3.707 3.439 3.856 0.621 16 2 "[ - . 1 .+ 2]" 1
1707 1 74 ASN HA 1 84 LYS QD 3.630 3.270 3.990 4.182 3.951 4.416 0.426 17 0 "[ . 1 . 2]" 1
1708 1 74 ASN HA 1 85 VAL H 4.070 3.660 4.480 3.333 3.251 3.406 0.409 10 0 "[ . 1 . 2]" 1
1709 1 74 ASN HA 1 85 VAL HA 4.240 3.820 4.660 5.850 5.762 5.930 1.270 13 20 [************+**-****] 1
1710 1 74 ASN HA 1 85 VAL HB 4.360 3.920 4.800 3.580 3.504 3.726 0.416 4 0 "[ . 1 . 2]" 1
1711 1 74 ASN QB 1 75 GLY H 5.240 4.720 5.440 3.225 3.093 3.549 1.627 12 20 [***********+*******-] 1
1712 1 74 ASN QB 1 84 LYS HA 5.300 4.950 5.830 4.599 4.404 4.744 0.546 2 2 "[ + . 1 .- 2]" 1
1713 1 74 ASN QB 1 85 VAL H 5.340 4.810 5.350 3.842 3.766 3.913 1.044 16 20 [*********-*****+****] 1
1714 1 74 ASN QB 1 85 VAL HA 5.500 4.950 6.050 6.093 6.061 6.143 0.093 20 0 "[ . 1 . 2]" 1
1715 1 74 ASN QB 1 85 VAL HB 4.800 4.320 4.800 3.836 3.773 3.938 0.547 13 5 "[* . -* 1* + . 2]" 1
1716 1 74 ASN QB 1 85 VAL QG . 4.950 5.260 3.903 3.845 4.103 1.105 14 20 [*-***********+******] 1
1717 1 74 ASN QD 1 85 VAL HB 5.500 4.950 6.050 6.297 6.200 6.396 0.346 2 0 "[ . 1 . 2]" 1
1718 1 74 ASN QD 1 85 VAL QG 5.500 4.950 6.050 5.611 5.524 5.800 . 0 0 "[ . 1 . 2]" 1
1719 1 75 GLY H 1 76 PHE H 3.620 3.260 3.980 2.928 2.615 3.017 0.645 20 1 "[ . 1 . +]" 1
1720 1 75 GLY H 1 76 PHE HA 5.500 4.950 6.050 5.329 5.106 5.425 . 0 0 "[ . 1 . 2]" 1
1721 1 75 GLY H 1 76 PHE QB 5.500 4.950 6.050 4.795 4.530 4.931 0.420 20 0 "[ . 1 . 2]" 1
1722 1 75 GLY H 1 82 ARG QD 5.500 4.950 6.050 4.046 3.534 4.745 1.416 19 19 "[***********-*** **+*]" 1
1723 1 75 GLY H 1 83 LEU QB 5.060 4.550 5.570 4.330 4.215 4.548 0.335 17 0 "[ . 1 . 2]" 1
1724 1 75 GLY H 1 83 LEU QD 5.500 4.950 6.050 4.793 4.621 5.643 0.329 10 0 "[ . 1 . 2]" 1
1725 1 75 GLY H 1 83 LEU HG 5.500 4.950 6.050 6.234 6.107 6.413 0.363 17 0 "[ . 1 . 2]" 1
1726 1 75 GLY H 1 84 LYS HA 4.340 3.910 4.770 3.732 3.473 3.840 0.437 16 0 "[ . 1 . 2]" 1
1727 1 75 GLY H 1 85 VAL H 5.470 4.920 6.020 4.797 4.602 4.906 0.318 20 0 "[ . 1 . 2]" 1
1728 1 75 GLY H 1 85 VAL QG 4.930 4.440 5.420 5.606 5.464 5.704 0.284 6 0 "[ . 1 . 2]" 1
1729 1 75 GLY QA 1 76 PHE HA 4.570 4.110 5.030 3.979 3.896 4.095 0.214 8 0 "[ . 1 . 2]" 1
1730 1 75 GLY QA 1 76 PHE QB 5.500 4.950 6.050 4.588 4.493 4.681 0.457 4 0 "[ . 1 . 2]" 1
1731 1 75 GLY QA 1 77 GLN H 5.390 4.850 5.930 4.872 4.620 5.161 0.230 20 0 "[ . 1 . 2]" 1
1732 1 75 GLY QA 1 82 ARG QB 4.970 4.950 5.470 4.561 3.630 5.226 1.320 20 7 "[ * *-***1 . +]" 1
1733 1 75 GLY QA 1 82 ARG QG 5.500 4.950 6.050 3.660 2.542 4.622 2.408 16 13 "[* **. ******+**-2]" 1
1734 1 75 GLY QA 1 83 LEU QB 4.480 4.350 4.930 4.948 4.792 5.083 0.153 6 0 "[ . 1 . 2]" 1
1735 1 75 GLY QA 1 84 LYS HA 5.500 4.950 6.050 5.368 5.050 5.550 . 0 0 "[ . 1 . 2]" 1
1736 1 76 PHE H 1 76 PHE QB 3.430 3.110 3.770 2.393 2.297 2.486 0.813 12 20 [***********+****-***] 1
1737 1 76 PHE H 1 76 PHE QD 4.900 4.410 5.390 4.352 4.279 4.512 0.131 8 0 "[ . 1 . 2]" 1
1738 1 76 PHE H 1 78 ILE QG 5.500 4.950 6.050 5.859 5.702 6.212 0.162 4 0 "[ . 1 . 2]" 1
1739 1 76 PHE H 1 83 LEU H 5.210 4.690 5.730 3.693 3.216 4.313 1.474 2 18 "[*+***-********* ** *]" 1
1740 1 76 PHE H 1 83 LEU HA 4.510 4.060 4.960 5.089 4.959 5.297 0.337 6 0 "[ . 1 . 2]" 1
1741 1 76 PHE H 1 83 LEU QB 4.470 4.020 4.920 2.561 2.437 2.920 1.583 2 20 [*+*****************-] 1
1742 1 76 PHE H 1 83 LEU HG 4.450 4.010 4.890 5.130 5.039 5.244 0.354 18 0 "[ . 1 . 2]" 1
1743 1 76 PHE HA 1 76 PHE QD 3.420 3.080 3.760 2.779 2.204 3.101 0.876 10 6 "[ *. + **.* -]" 1
1744 1 76 PHE HA 1 76 PHE QE 5.500 4.950 6.050 4.635 4.547 4.680 0.403 10 0 "[ . 1 . 2]" 1
1745 1 76 PHE HA 1 77 GLN H 3.030 2.730 3.330 2.318 2.277 2.373 0.453 9 0 "[ . 1 . 2]" 1
1746 1 76 PHE HA 1 77 GLN QG 5.500 4.950 6.050 5.926 5.227 6.110 0.060 20 0 "[ . 1 . 2]" 1
1747 1 76 PHE HA 1 78 ILE MD 5.500 4.950 6.050 5.141 4.940 5.450 0.010 13 0 "[ . 1 . 2]" 1
1748 1 76 PHE HA 1 83 LEU H 5.500 4.950 6.050 5.057 4.811 5.508 0.139 2 0 "[ . 1 . 2]" 1
1749 1 76 PHE QB 1 77 GLN H 4.720 4.390 5.190 3.970 3.843 4.094 0.547 18 1 "[ . 1 . + 2]" 1
1750 1 76 PHE QB 1 78 ILE MD 5.500 4.950 6.050 3.469 3.357 3.701 1.593 7 20 [******+******-******] 1
1751 1 76 PHE QB 1 78 ILE QG 5.200 4.680 5.460 3.725 3.574 4.211 1.106 19 19 "[*** *********-****+*]" 1
1752 1 76 PHE QB 1 82 ARG QB 5.500 4.950 6.050 5.603 4.897 6.034 0.053 6 0 "[ . 1 . 2]" 1
1753 1 76 PHE QB 1 82 ARG QD 5.010 4.510 5.510 4.883 4.283 5.111 0.227 19 0 "[ . 1 . 2]" 1
1754 1 76 PHE QB 1 83 LEU H 5.500 4.950 6.050 3.170 2.988 3.451 1.962 4 20 [***+**************-*] 1
1755 1 76 PHE QB 1 83 LEU HA 4.690 4.220 5.160 4.563 4.346 4.722 . 0 0 "[ . 1 . 2]" 1
1756 1 76 PHE QB 1 83 LEU QB 5.500 4.950 6.050 2.092 1.884 2.244 3.066 14 20 [*************+****-*] 1
1757 1 76 PHE QB 1 83 LEU QD 5.500 4.950 6.050 2.441 2.197 2.800 2.753 16 20 [***************+***-] 1
1758 1 76 PHE QB 1 83 LEU HG 4.330 4.170 4.760 4.323 4.008 4.547 0.162 20 0 "[ . 1 . 2]" 1
1759 1 76 PHE QD 1 77 GLN H 3.820 3.440 4.200 3.034 2.561 3.372 0.879 17 6 "[ -. * **.*+ 2]" 1
1760 1 76 PHE QD 1 77 GLN HA 4.270 3.840 4.700 4.622 4.403 5.038 0.338 4 0 "[ . 1 . 2]" 1
1761 1 76 PHE QD 1 77 GLN QG 5.500 4.950 6.050 5.945 5.533 6.165 0.115 4 0 "[ . 1 . 2]" 1
1762 1 76 PHE QD 1 78 ILE HA 5.500 4.950 6.050 5.290 4.957 6.046 . 0 0 "[ . 1 . 2]" 1
1763 1 76 PHE QD 1 78 ILE HB 5.050 4.540 5.560 5.450 5.184 5.963 0.403 13 0 "[ . 1 . 2]" 1
1764 1 76 PHE QD 1 78 ILE MD 3.240 2.920 3.560 2.840 2.614 3.165 0.306 18 0 "[ . 1 . 2]" 1
1765 1 76 PHE QD 1 78 ILE QG 5.100 4.590 5.610 2.725 2.360 3.554 2.230 3 20 [**+**********-******] 1
1766 1 76 PHE QD 1 78 ILE MG 5.120 4.610 5.630 4.685 4.404 5.447 0.206 3 0 "[ . 1 . 2]" 1
1767 1 76 PHE QD 1 83 LEU QD 5.500 4.950 6.050 2.936 1.934 3.894 3.016 16 20 [***************+*-**] 1
1768 1 76 PHE QE 1 77 GLN H 5.500 4.950 6.050 4.879 4.687 5.165 0.263 17 0 "[ . 1 . 2]" 1
1769 1 76 PHE QE 1 78 ILE HA 5.490 4.940 6.040 5.679 5.331 6.120 0.080 4 0 "[ . 1 . 2]" 1
1770 1 76 PHE QE 1 78 ILE MD 3.440 3.100 3.780 2.968 2.758 3.070 0.342 4 0 "[ . 1 . 2]" 1
1771 1 76 PHE QE 1 78 ILE QG 3.690 3.320 4.060 3.331 3.140 3.735 0.180 1 0 "[ . 1 . 2]" 1
1772 1 76 PHE QE 1 78 ILE MG 4.300 3.870 4.730 4.374 4.117 4.901 0.171 4 0 "[ . 1 . 2]" 1
1773 1 77 GLN H 1 77 GLN QG 4.540 4.090 4.990 4.007 3.658 4.098 0.432 16 0 "[ . 1 . 2]" 1
1774 1 77 GLN H 1 78 ILE H 5.370 4.830 5.910 4.614 4.561 4.662 0.269 4 0 "[ . 1 . 2]" 1
1775 1 77 GLN H 1 82 ARG HA 5.150 4.630 5.670 5.237 4.921 5.497 . 0 0 "[ . 1 . 2]" 1
1776 1 77 GLN H 1 82 ARG QG 5.500 4.950 6.050 5.152 4.799 5.625 0.151 12 0 "[ . 1 . 2]" 1
1777 1 77 GLN HA 1 77 GLN QE 3.380 3.040 3.720 3.721 2.763 4.060 0.340 18 0 "[ . 1 . 2]" 1
1778 1 77 GLN HA 1 77 GLN QG 3.960 3.560 4.360 2.755 2.274 3.153 1.286 16 18 "[******-********+** 2]" 1
1779 1 77 GLN HA 1 78 ILE H 3.140 2.830 3.450 2.375 2.337 2.396 0.493 4 0 "[ . 1 . 2]" 1
1780 1 77 GLN HA 1 78 ILE HB 5.340 4.810 5.870 5.235 4.979 5.353 . 0 0 "[ . 1 . 2]" 1
1781 1 77 GLN HA 1 78 ILE MG 5.040 4.540 5.540 5.636 5.584 5.682 0.142 4 0 "[ . 1 . 2]" 1
1782 1 77 GLN HA 1 82 ARG H 4.410 3.970 4.850 5.399 5.086 5.817 0.967 16 12 "[* **. **-***+** 2]" 1
1783 1 77 GLN HA 1 82 ARG QG 4.570 4.110 5.030 3.789 3.156 4.306 0.954 20 6 "[ - * ***1 . +]" 1
1784 1 77 GLN HA 1 83 LEU H 4.620 4.160 5.080 4.158 3.972 4.658 0.188 19 0 "[ . 1 . 2]" 1
1785 1 77 GLN HA 1 83 LEU QD 5.500 4.950 6.050 6.168 5.836 6.275 0.225 18 0 "[ . 1 . 2]" 1
1786 1 77 GLN QB 1 78 ILE QG 5.500 4.950 6.050 4.465 4.256 4.522 0.694 16 7 "[ . -* * **.+* 2]" 1
1787 1 77 GLN QB 1 82 ARG HA 5.330 4.800 5.860 4.502 4.230 5.363 0.570 20 1 "[ . 1 . +]" 1
1788 1 77 GLN QB 1 82 ARG QD 5.060 4.800 5.570 2.953 2.713 3.483 2.087 19 20 [***************-**+*] 1
1789 1 77 GLN QE 1 82 ARG QD 5.500 4.950 5.810 3.801 3.634 4.530 1.316 7 19 "[****-*+******** ****]" 1
1790 1 77 GLN QG 1 78 ILE H 4.040 3.640 4.440 3.297 3.187 3.551 0.453 5 0 "[ . 1 . 2]" 1
1791 1 77 GLN QG 1 78 ILE HA 5.120 4.610 5.630 4.345 4.197 5.302 0.413 18 0 "[ . 1 . 2]" 1
1792 1 77 GLN QG 1 79 GLY H 5.020 4.520 5.520 4.305 4.193 5.148 0.327 3 0 "[ . 1 . 2]" 1
1793 1 77 GLN QG 1 81 LYS H 5.260 4.730 5.790 5.102 4.909 5.314 . 0 0 "[ . 1 . 2]" 1
1794 1 77 GLN QG 1 82 ARG H 5.500 4.950 6.050 6.148 5.899 6.344 0.294 20 0 "[ . 1 . 2]" 1
1795 1 77 GLN QG 1 82 ARG HA 4.070 3.660 4.480 4.716 4.265 5.027 0.547 20 1 "[ . 1 . +]" 1
1796 1 77 GLN QG 1 82 ARG QD 5.290 4.950 5.820 4.215 2.342 4.426 2.608 16 20 [*-*************+****] 1
1797 1 77 GLN QG 1 82 ARG QG 4.850 4.370 5.330 4.800 3.948 5.574 0.422 20 0 "[ . 1 . 2]" 1
1798 1 78 ILE H 1 78 ILE HB 3.960 3.560 4.360 3.246 3.161 3.308 0.399 4 0 "[ . 1 . 2]" 1
1799 1 78 ILE H 1 78 ILE MD 5.180 4.660 5.700 4.314 4.212 4.389 0.448 4 0 "[ . 1 . 2]" 1
1800 1 78 ILE H 1 78 ILE QG 5.170 4.650 5.690 2.723 2.618 3.156 2.032 6 20 [***-*+**************] 1
1801 1 78 ILE H 1 78 ILE MG 4.170 3.750 4.590 4.149 4.116 4.183 . 0 0 "[ . 1 . 2]" 1
1802 1 78 ILE H 1 79 GLY QA 5.500 4.950 6.050 4.609 4.495 4.750 0.455 4 0 "[ . 1 . 2]" 1
1803 1 78 ILE H 1 81 LYS H 4.550 4.090 5.010 3.641 3.466 3.815 0.624 20 3 "[ .- *1 . +]" 1
1804 1 78 ILE H 1 81 LYS QB . 4.950 4.950 4.591 4.462 4.701 0.488 9 0 "[ . 1 . 2]" 1
1805 1 78 ILE H 1 82 ARG HA 4.120 3.710 4.530 3.817 3.608 4.021 0.102 19 0 "[ . 1 . 2]" 1
1806 1 78 ILE H 1 82 ARG QB 5.500 4.950 6.050 5.464 4.978 5.739 . 0 0 "[ . 1 . 2]" 1
1807 1 78 ILE H 1 82 ARG QD 5.500 4.950 6.050 5.457 4.627 5.817 0.323 19 0 "[ . 1 . 2]" 1
1808 1 78 ILE H 1 82 ARG QG 5.360 4.820 5.900 5.370 4.645 5.954 0.175 20 0 "[ . 1 . 2]" 1
1809 1 78 ILE H 1 83 LEU H 5.500 4.950 6.050 5.003 4.786 5.147 0.164 19 0 "[ . 1 . 2]" 1
1810 1 78 ILE HA 1 78 ILE MD 4.460 4.010 4.910 4.036 3.956 4.074 0.054 10 0 "[ . 1 . 2]" 1
1811 1 78 ILE HA 1 78 ILE QG 4.150 3.730 4.570 2.728 2.637 2.790 1.093 4 20 [-**+****************] 1
1812 1 78 ILE HA 1 78 ILE MG 3.760 3.380 4.140 2.352 2.308 2.400 1.072 6 20 [*****+******-*******] 1
1813 1 78 ILE HA 1 79 GLY H 3.230 2.910 3.550 2.543 2.515 2.567 0.395 6 0 "[ . 1 . 2]" 1
1814 1 78 ILE HA 1 79 GLY QA . 4.950 5.330 4.140 4.091 4.182 0.859 16 20 [*************-*+****] 1
1815 1 78 ILE HA 1 81 LYS H 5.500 4.950 6.050 5.730 5.617 5.906 . 0 0 "[ . 1 . 2]" 1
1816 1 78 ILE HB 1 78 ILE MD 3.610 3.250 3.970 2.605 2.337 2.701 0.913 4 20 [***+************-***] 1
1817 1 78 ILE HB 1 79 GLY H 5.150 4.630 5.670 4.438 4.399 4.586 0.231 1 0 "[ . 1 . 2]" 1
1818 1 78 ILE HB 1 81 LYS H 5.500 4.950 6.050 4.903 4.782 5.192 0.168 2 0 "[ . 1 . 2]" 1
1819 1 78 ILE HB 1 82 ARG HA 5.320 4.790 5.850 5.944 5.871 6.034 0.184 16 0 "[ . 1 . 2]" 1
1820 1 78 ILE MD 1 78 ILE MG 3.510 3.160 3.860 1.859 1.660 1.998 1.500 13 20 [************+****-**] 1
1821 1 78 ILE MD 1 79 GLY H 5.500 4.950 6.050 5.882 5.818 5.912 . 0 0 "[ . 1 . 2]" 1
1822 1 78 ILE MD 1 81 LYS QB 5.280 4.750 5.810 5.115 4.945 5.287 . 0 0 "[ . 1 . 2]" 1
1823 1 78 ILE MD 1 82 ARG H 5.500 4.950 6.050 7.335 7.192 7.547 1.497 10 20 [*********+*******-**] 1
1824 1 78 ILE MD 1 83 LEU HA 5.500 4.950 6.050 5.790 5.629 6.028 . 0 0 "[ . 1 . 2]" 1
1825 1 78 ILE MD 1 83 LEU QB 4.460 4.010 4.910 3.973 3.848 4.079 0.162 13 0 "[ . 1 . 2]" 1
1826 1 78 ILE QG 1 78 ILE MG 3.470 3.120 3.820 2.390 2.175 2.455 0.945 4 20 [***+*****-**********] 1
1827 1 78 ILE QG 1 79 GLY H 5.110 4.600 5.620 4.826 4.781 4.870 . 0 0 "[ . 1 . 2]" 1
1828 1 78 ILE QG 1 81 LYS QB 5.110 4.600 5.620 5.001 4.795 5.937 0.317 4 0 "[ . 1 . 2]" 1
1829 1 78 ILE QG 1 83 LEU QB 5.500 4.950 6.050 4.486 4.283 5.070 0.667 13 10 "[* * . **-+ ** **]" 1
1830 1 78 ILE MG 1 79 GLY H 4.400 3.960 4.840 3.747 3.663 3.815 0.297 4 0 "[ . 1 . 2]" 1
1831 1 78 ILE MG 1 79 GLY QA 5.500 4.950 6.050 4.011 3.810 4.235 1.140 4 20 [***+********-*******] 1
1832 1 78 ILE MG 1 81 LYS H 5.500 4.950 6.050 5.816 5.699 5.921 . 0 0 "[ . 1 . 2]" 1
1833 1 78 ILE MG 1 81 LYS QB 5.500 4.950 6.050 5.560 5.378 5.855 . 0 0 "[ . 1 . 2]" 1
1834 1 79 GLY H 1 80 MET HA 5.500 4.950 6.050 5.643 5.480 5.779 . 0 0 "[ . 1 . 2]" 1
1835 1 79 GLY H 1 81 LYS H 5.500 4.950 6.050 5.030 4.849 5.175 0.101 7 0 "[ . 1 . 2]" 1
1836 1 79 GLY QA 1 80 MET H 3.460 3.110 3.810 2.306 2.250 2.381 0.860 1 20 [+-******************] 1
1837 1 79 GLY QA 1 80 MET HA 5.500 4.950 6.050 4.081 4.049 4.107 0.901 20 20 [********-**********+] 1
1838 1 79 GLY QA 1 80 MET QG 5.500 4.950 6.050 4.167 4.050 4.249 0.900 6 20 [*****+*******-******] 1
1839 1 79 GLY QA 1 81 LYS H . 4.720 5.130 4.025 3.695 4.208 1.025 7 20 [******+*********-***] 1
1840 1 80 MET H 1 80 MET HB2 4.150 3.730 4.570 3.837 3.741 3.981 . 0 0 "[ . 1 . 2]" 1
1841 1 80 MET H 1 80 MET QG 4.340 3.910 4.760 2.438 2.325 2.651 1.585 2 20 [*+**************-***] 1
1842 1 80 MET H 1 81 LYS H 3.880 3.490 4.270 3.182 2.806 3.344 0.684 6 1 "[ .+ 1 . 2]" 1
1843 1 80 MET H 1 81 LYS HA 5.500 4.950 6.050 5.355 5.169 5.625 . 0 0 "[ . 1 . 2]" 1
1844 1 80 MET HA 1 80 MET QG 3.870 3.480 4.190 3.535 3.455 3.599 0.025 8 0 "[ . 1 . 2]" 1
1845 1 80 MET HB2 1 81 LYS H 5.360 4.820 5.900 4.623 4.533 4.656 0.287 6 0 "[ . 1 . 2]" 1
1846 1 80 MET HB2 1 81 LYS HA 5.440 4.900 5.980 4.995 4.828 5.098 0.072 6 0 "[ . 1 . 2]" 1
1847 1 80 MET HB2 1 81 LYS QG 5.500 4.950 6.050 4.867 4.375 5.180 0.575 9 1 "[ . +1 . 2]" 1
1848 1 80 MET HB3 1 81 LYS H 5.340 4.810 5.870 4.782 4.725 4.851 0.085 1 0 "[ . 1 . 2]" 1
1849 1 80 MET QG 1 81 LYS H 5.380 4.840 5.850 4.335 4.131 4.537 0.709 8 8 "[* * *+*1 . -* *]" 1
1850 1 80 MET QG 1 81 LYS HA 5.500 4.950 6.050 5.061 4.629 5.611 0.321 5 0 "[ . 1 . 2]" 1
1851 1 80 MET QG 1 81 LYS QG 5.500 4.950 6.050 3.777 3.154 4.587 1.796 9 18 "[* *** **+***-*******]" 1
1852 1 81 LYS H 1 81 LYS QD 5.000 4.500 5.500 4.881 4.651 5.210 . 0 0 "[ . 1 . 2]" 1
1853 1 81 LYS H 1 81 LYS QE 5.500 4.950 6.050 6.086 5.980 6.203 0.153 10 0 "[ . 1 . 2]" 1
1854 1 81 LYS H 1 81 LYS QG 4.670 4.200 5.070 3.752 3.647 3.931 0.553 1 4 "[+ - 1 ** . 2]" 1
1855 1 81 LYS H 1 82 ARG H 4.660 4.190 5.130 4.243 4.119 4.365 0.071 19 0 "[ . 1 . 2]" 1
1856 1 81 LYS HA 1 81 LYS QD 4.070 3.660 4.480 2.954 2.395 4.050 1.265 16 13 "[* **. * -** **+* **]" 1
1857 1 81 LYS HA 1 81 LYS QE 4.930 4.440 5.420 4.281 4.169 4.551 0.271 19 0 "[ . 1 . 2]" 1
1858 1 81 LYS HA 1 81 LYS QG 3.810 3.430 4.190 2.597 2.192 2.897 1.238 9 20 [*******-+***********] 1
1859 1 81 LYS HA 1 82 ARG H 3.020 2.720 3.320 2.392 2.336 2.450 0.384 20 0 "[ . 1 . 2]" 1
1860 1 81 LYS HA 1 82 ARG HA 5.100 4.590 5.610 4.479 4.438 4.527 0.152 11 0 "[ . 1 . 2]" 1
1861 1 81 LYS HA 1 82 ARG QB 5.400 4.860 5.940 4.528 4.268 4.760 0.592 16 1 "[ . 1 .+ 2]" 1
1862 1 81 LYS QB 1 82 ARG H . 3.820 3.970 3.109 3.004 3.259 0.816 8 20 [*******+**********-*] 1
1863 1 81 LYS QD 1 82 ARG H 3.970 3.570 4.370 3.899 3.477 5.129 0.759 6 1 "[ .+ 1 . 2]" 1
1864 1 81 LYS QD 1 82 ARG HA 4.720 4.250 5.190 5.622 5.363 6.209 1.019 6 6 "[ * *+* *1 - . 2]" 1
1865 1 82 ARG H 1 82 ARG QB 3.630 3.270 3.990 2.485 2.375 2.579 0.895 19 20 [********-*********+*] 1
1866 1 82 ARG H 1 82 ARG QD 5.320 4.790 5.650 4.898 4.439 5.130 0.351 6 0 "[ . 1 . 2]" 1
1867 1 82 ARG H 1 82 ARG QG 4.900 4.410 5.390 3.763 2.877 4.251 1.533 6 7 "[ * *+*-*1 . *]" 1
1868 1 82 ARG H 1 83 LEU H 5.230 4.710 5.750 4.601 4.433 4.652 0.277 16 0 "[ . 1 . 2]" 1
1869 1 82 ARG HA 1 82 ARG QD 4.740 4.300 5.210 3.372 2.528 3.768 1.772 19 20 [*****************-+*] 1
1870 1 82 ARG HA 1 83 LEU H 3.140 2.830 3.450 2.456 2.392 2.535 0.438 4 0 "[ . 1 . 2]" 1
1871 1 82 ARG HA 1 83 LEU QB 5.500 4.950 6.050 4.333 4.217 4.448 0.733 6 20 [*****+***********-**] 1
1872 1 82 ARG QB 1 83 LEU H 5.100 4.590 5.610 3.665 2.937 4.169 1.653 2 18 "[*+*******-***** ** *]" 1
1873 1 82 ARG QD 1 83 LEU H 5.500 4.950 6.050 4.296 3.685 4.669 1.265 19 11 "[** *****1 . *-+*]" 1
1874 1 82 ARG QG 1 83 LEU H 5.040 4.540 5.540 3.468 2.585 4.818 1.955 17 12 "[* **. ****** +*-2]" 1
1875 1 83 LEU H 1 83 LEU QD 4.350 3.910 4.790 3.622 3.197 3.695 0.713 20 1 "[ . 1 . +]" 1
1876 1 83 LEU H 1 83 LEU HG 4.650 4.180 5.120 4.550 4.421 4.648 . 0 0 "[ . 1 . 2]" 1
1877 1 83 LEU H 1 84 LYS H 5.500 4.950 6.050 4.746 4.679 4.797 0.271 16 0 "[ . 1 . 2]" 1
1878 1 83 LEU HA 1 83 LEU QD 3.390 3.050 3.730 2.656 1.841 2.805 1.209 20 1 "[ . 1 . +]" 1
1879 1 83 LEU HA 1 84 LYS H 3.300 2.970 3.630 2.475 2.408 2.512 0.562 16 7 "[- . 1** .+* **]" 1
1880 1 83 LEU HA 1 84 LYS HA 5.500 4.950 6.050 4.585 4.548 4.614 0.402 10 0 "[ . 1 . 2]" 1
1881 1 83 LEU QB 1 84 LYS H 4.170 3.750 4.590 3.880 3.700 3.974 0.050 20 0 "[ . 1 . 2]" 1
1882 1 83 LEU QD 1 84 LYS H 4.530 4.080 4.980 3.764 2.624 3.933 1.456 20 1 "[ . 1 . +]" 1
1883 1 83 LEU HG 1 84 LYS H 4.870 4.380 5.360 3.269 3.012 4.135 1.368 18 19 [*****-***********+*2] 1
1884 1 84 LYS H 1 84 LYS QB 3.720 3.350 4.090 2.670 2.543 2.817 0.807 10 20 [*-*******+**********] 1
1885 1 84 LYS H 1 84 LYS QD 5.500 4.950 6.050 4.736 4.680 4.815 0.270 8 0 "[ . 1 . 2]" 1
1886 1 84 LYS H 1 85 VAL H 5.500 4.950 6.050 4.418 4.275 4.560 0.675 1 12 "[+* ** * *1 **- ***2]" 1
1887 1 84 LYS HA 1 84 LYS QD 5.010 4.510 5.510 2.622 2.472 2.815 2.038 18 20 [*********-*******+**] 1
1888 1 84 LYS HA 1 84 LYS QE 5.500 4.950 6.050 4.665 4.548 4.790 0.402 9 0 "[ . 1 . 2]" 1
1889 1 84 LYS HA 1 85 VAL H 3.110 2.800 3.420 2.415 2.369 2.456 0.431 1 0 "[ . 1 . 2]" 1
1890 1 84 LYS HA 1 85 VAL HB 5.130 4.620 5.640 4.351 4.255 4.429 0.365 16 0 "[ . 1 . 2]" 1
1891 1 84 LYS HA 1 85 VAL QG . 4.950 5.310 4.346 4.182 4.428 0.768 13 20 [************+******-] 1
1892 1 84 LYS QB 1 84 LYS QD 2.410 2.170 2.650 2.638 2.448 2.744 0.094 9 0 "[ . 1 . 2]" 1
1893 1 84 LYS QB 1 84 LYS QE 4.840 4.360 5.320 3.866 3.692 4.076 0.668 10 12 "[* * **- *+** ** *]" 1
1894 1 84 LYS QB 1 85 VAL H 4.440 4.000 4.880 4.004 3.911 4.072 0.089 11 0 "[ . 1 . 2]" 1
1895 1 84 LYS QD 1 85 VAL H 5.410 4.870 5.950 2.498 2.299 2.760 2.571 16 20 [***-***********+****] 1
1896 1 84 LYS QD 1 86 GLN QB 5.500 4.950 6.050 4.892 3.899 5.470 1.051 14 1 "[ . 1 +. 2]" 1
1897 1 84 LYS QE 1 85 VAL H 5.500 4.950 6.050 4.603 4.518 4.792 0.432 11 0 "[ . 1 . 2]" 1
1898 1 84 LYS QE 1 86 GLN HA 5.500 4.950 6.050 4.898 3.632 5.486 1.318 17 2 "[ . - . + 2]" 1
1899 1 84 LYS QE 1 86 GLN QB 4.550 4.090 5.010 4.439 4.005 4.892 0.085 1 0 "[ . 1 . 2]" 1
1900 1 84 LYS QG 1 85 VAL H 5.000 4.500 5.500 4.092 3.539 4.204 0.961 11 1 "[ . 1+ . 2]" 1
1901 1 84 LYS QG 1 86 GLN H 5.500 4.950 6.050 5.693 5.202 6.192 0.142 14 0 "[ . 1 . 2]" 1
1902 1 84 LYS QG 1 86 GLN QB 4.960 4.460 5.460 4.774 4.304 5.576 0.156 11 0 "[ . 1 . 2]" 1
1903 1 84 LYS QG 1 86 GLN QG 5.060 4.550 5.570 4.499 3.645 5.273 0.905 10 2 "[ . + . - 2]" 1
1904 1 85 VAL H 1 85 VAL HB 3.930 3.540 4.320 2.192 2.050 2.339 1.490 17 20 [**********-*****+***] 1
1905 1 85 VAL HA 1 86 GLN H 3.160 2.840 3.480 2.482 2.407 2.546 0.433 4 0 "[ . 1 . 2]" 1
1906 1 85 VAL HA 1 86 GLN QB 4.710 4.240 5.180 4.845 4.542 5.132 . 0 0 "[ . 1 . 2]" 1
1907 1 85 VAL HB 1 86 GLN H 5.500 4.950 6.050 4.628 4.541 4.780 0.409 2 0 "[ . 1 . 2]" 1
1908 1 85 VAL HB 1 86 GLN HA 4.680 4.210 5.150 5.396 5.333 5.497 0.347 16 0 "[ . 1 . 2]" 1
1909 1 85 VAL QG 1 86 GLN H . 4.150 4.430 2.953 2.726 3.322 1.424 16 20 [*************-*+****] 1
1910 1 85 VAL QG 1 86 GLN HA 4.810 4.330 5.290 3.427 3.232 3.603 1.098 15 20 [**************+*-***] 1
1911 1 85 VAL QG 1 86 GLN QB 5.500 4.950 6.050 4.496 4.261 4.641 0.689 10 3 "[ . +- * 2]" 1
1912 1 85 VAL QG 1 86 GLN QG 4.780 4.300 5.260 4.222 4.071 4.387 0.229 3 0 "[ . 1 . 2]" 1
1913 1 86 GLN H 1 86 GLN QB 3.870 3.480 4.260 3.149 2.710 3.241 0.770 10 1 "[ . + . 2]" 1
1914 1 86 GLN H 1 87 LEU H 5.000 4.500 5.500 4.481 4.387 4.667 0.113 12 0 "[ . 1 . 2]" 1
1915 1 86 GLN HA 1 87 LEU H 3.120 2.810 3.430 2.439 2.274 2.630 0.536 3 1 "[ + . 1 . 2]" 1
1916 1 86 GLN HA 1 87 LEU QB 4.980 4.480 5.480 4.454 4.243 4.718 0.237 9 0 "[ . 1 . 2]" 1
1917 1 86 GLN QB 1 87 LEU H 4.120 3.710 4.530 3.267 2.583 3.531 1.127 14 3 "[ . -1 *+. 2]" 1
1918 1 86 GLN QB 1 87 LEU QD 5.500 4.950 6.050 5.041 4.149 5.687 0.801 17 1 "[ . 1 . + 2]" 1
1919 1 86 GLN QG 1 87 LEU H 5.500 4.950 6.050 4.765 4.418 4.890 0.532 14 1 "[ . 1 +. 2]" 1
1920 1 87 LEU H 1 87 LEU QB 3.180 2.860 3.500 2.506 2.259 2.807 0.601 10 6 "[ ** + *- * 2]" 1
1921 1 87 LEU H 1 87 LEU QD 4.360 3.920 4.800 3.112 2.196 3.930 1.724 17 11 "[**- .*** 1** .*+ *]" 1
1922 1 87 LEU H 1 87 LEU HG 4.500 4.050 4.950 3.689 2.037 4.850 2.013 2 7 "[*+* .** 1- . *]" 1
1923 1 87 LEU H 1 88 LYS H 5.320 4.790 5.850 4.665 4.439 4.788 0.351 9 0 "[ . 1 . 2]" 1
1924 1 87 LEU HA 1 87 LEU HG 4.100 3.690 4.510 3.336 2.451 3.826 1.239 9 8 "[ ** +* - * **2]" 1
1925 1 87 LEU HA 1 88 LYS H 3.310 2.980 3.640 2.476 2.296 2.548 0.684 20 8 "[ -.* 1* * * ** +]" 1
1926 1 87 LEU HA 1 88 LYS QB 5.500 4.950 6.050 4.477 4.263 4.697 0.687 11 9 "[*** . * 1+* -* *]" 1
1927 1 87 LEU QB 1 87 LEU HG 2.870 2.580 3.160 2.499 2.192 2.558 0.388 14 0 "[ . 1 . 2]" 1
1928 1 87 LEU QB 1 88 LYS H 4.380 3.940 4.820 3.595 2.787 4.188 1.153 1 6 "[+* .- 1** . *]" 1
1929 1 87 LEU QB 1 88 LYS QB 5.500 4.950 6.050 5.234 4.764 5.565 0.186 1 0 "[ . 1 . 2]" 1
1930 1 87 LEU QD 1 88 LYS H 4.350 3.910 4.790 3.789 1.960 4.358 1.950 14 1 "[ . 1 +. 2]" 1
1931 1 87 LEU HG 1 88 LYS H 4.390 3.950 4.830 4.208 2.984 4.871 0.966 4 1 "[ +. 1 . 2]" 1
1932 1 88 LYS H 1 88 LYS QB 3.650 3.550 4.020 2.563 2.271 2.720 1.279 15 20 [**-***********+*****] 1
1933 1 88 LYS H 1 88 LYS QD 5.500 4.950 6.050 4.549 3.954 5.017 0.996 6 6 "[ * .+ ** * .- 2]" 1
1934 1 88 LYS H 1 88 LYS QE 5.500 4.950 6.050 6.137 5.746 6.414 0.364 3 0 "[ . 1 . 2]" 1
1935 1 88 LYS HA 1 88 LYS QD 5.370 4.830 5.900 3.594 2.475 4.308 2.355 5 20 [****+********-******] 1
1936 1 88 LYS HA 1 88 LYS QE 5.470 4.920 6.020 4.788 3.984 5.393 0.936 10 3 "[ * -+ . 2]" 1
1937 1 88 LYS HA 1 88 LYS QG 3.580 3.220 3.940 2.754 2.212 2.982 1.008 10 4 "[ *.* + . -2]" 1
1938 1 88 LYS HA 1 89 ARG H 3.510 3.160 3.860 2.388 2.222 2.639 0.938 4 20 [***+***************-] 1
1939 1 88 LYS QB 1 88 LYS QE 4.640 4.180 5.100 3.697 3.309 3.996 0.871 18 11 "[** *. * ***- . +**]" 1
1940 1 88 LYS QB 1 89 ARG H 5.490 4.940 6.040 3.898 3.035 4.264 1.905 9 20 [********+***-*******] 1
1941 1 88 LYS QE 1 88 LYS QG 3.270 2.940 3.600 2.370 2.144 2.704 0.796 10 11 "[** *. * +*** * -*]" 1
1942 1 88 LYS QE 1 89 ARG H 5.500 4.950 6.050 5.632 4.857 6.357 0.307 6 0 "[ . 1 . 2]" 1
1943 1 88 LYS QG 1 89 ARG H 5.500 4.950 6.050 3.924 2.922 4.919 2.028 20 14 "[** *.** *****.- **+]" 1
1944 1 89 ARG H 1 89 ARG QG 4.370 3.930 4.810 3.799 1.745 4.350 2.185 16 3 "[ *. 1 .+- 2]" 1
1945 1 89 ARG HA 1 89 ARG QD 4.390 3.950 4.830 3.966 3.384 4.326 0.566 2 1 "[ + . 1 . 2]" 1
1946 1 89 ARG HA 1 89 ARG QG 3.740 3.370 4.110 2.612 2.101 3.413 1.269 14 14 "[* * **** 1***+* -**2]" 1
1947 1 89 ARG HA 1 90 SER QB 5.390 4.850 5.930 4.734 4.340 5.042 0.510 4 1 "[ +. 1 . 2]" 1
1948 1 89 ARG QB 1 89 ARG QD 3.600 3.240 3.960 2.232 2.115 2.419 1.125 15 20 [********-*****+*****] 1
1949 1 89 ARG QB 1 90 SER H 5.110 4.950 5.620 3.839 2.670 4.145 2.280 17 20 [**************-*+***] 1
1950 1 89 ARG QB 1 90 SER QB 5.500 4.950 6.050 5.203 4.077 5.739 0.873 6 1 "[ .+ 1 . 2]" 1
1951 1 89 ARG QG 1 90 SER QB 5.500 4.950 6.050 5.092 3.052 6.185 1.898 10 2 "[ . + . -]" 1
1952 1 90 SER H 1 91 LYS H 5.500 4.950 6.050 4.376 3.066 4.835 1.884 6 4 "[ *+ -1 . *]" 1
1953 1 90 SER H 1 91 LYS HA 5.500 4.950 6.050 5.381 4.819 6.042 0.131 15 0 "[ . 1 . 2]" 1
1954 1 90 SER HA 1 90 SER QB 2.830 2.550 3.110 2.379 2.212 2.548 0.338 1 0 "[ . 1 . 2]" 1
1955 1 90 SER HA 1 91 LYS H 3.430 3.090 3.770 2.678 2.348 3.018 0.742 14 5 "[* . * 1 -*+. 2]" 1
1956 1 90 SER HA 1 91 LYS QB 5.500 4.950 6.050 4.409 3.883 4.901 1.067 7 12 "[* . +* * -*******2]" 1
1957 1 90 SER HA 1 91 LYS QG 5.500 4.950 6.050 5.513 4.677 6.131 0.273 2 0 "[ . 1 . 2]" 1
1958 1 90 SER QB 1 91 LYS H 4.860 4.370 5.350 3.092 1.986 4.254 2.384 17 15 "[** *. ** **-****+**2]" 1
1959 1 90 SER QB 1 91 LYS HA 4.700 4.230 5.170 4.325 3.943 5.015 0.287 2 0 "[ . 1 . 2]" 1
1960 1 90 SER QB 1 91 LYS QB 5.500 4.950 6.050 4.547 3.439 4.867 1.511 14 5 "[ -* 1* +. * 2]" 1
1961 1 90 SER QB 1 91 LYS QG 5.400 4.860 5.940 5.318 4.090 6.011 0.770 11 1 "[ . 1+ . 2]" 1
1962 1 91 LYS H 1 91 LYS QG 5.260 4.730 5.790 3.598 2.570 4.391 2.160 11 13 "[-**** ** 1+ * ** **]" 1
1963 1 91 LYS HA 1 91 LYS QE 5.500 4.950 6.050 5.149 4.671 5.721 0.279 2 0 "[ . 1 . 2]" 1
1964 1 91 LYS HA 1 91 LYS QG 3.690 3.320 4.060 2.990 2.182 3.503 1.138 4 7 "[ +.* ** * . -* 2]" 1
1965 1 91 LYS HA 1 92 ASN HA 4.540 4.090 4.990 4.433 4.352 4.558 . 0 0 "[ . 1 . 2]" 1
1966 1 91 LYS HA 1 92 ASN QB 5.270 4.740 5.800 4.413 3.952 4.738 0.788 14 3 "[*- . 1 +. 2]" 1
1967 1 91 LYS QE 1 91 LYS QG 3.100 2.790 3.410 2.449 2.233 2.750 0.557 5 6 "[ + ** 1 * - *]" 1
1968 1 91 LYS QG 1 92 ASN H 5.500 4.950 6.050 3.219 2.489 4.355 2.461 18 20 [*-***************+**] 1
1969 1 91 LYS QG 1 92 ASN QB 5.500 4.950 6.050 4.607 2.315 5.300 2.635 20 2 "[ . - 1 . +]" 1
1970 1 91 LYS QG 1 92 ASN HD22 5.500 4.950 6.050 5.944 4.859 6.303 0.253 11 0 "[ . 1 . 2]" 1
1971 1 92 ASN QB 1 92 ASN HD22 4.010 3.610 4.410 3.332 3.196 3.497 0.414 20 0 "[ . 1 . 2]" 1
1972 1 92 ASN QB 1 93 ASP H 4.850 4.500 5.330 3.634 3.085 4.023 1.415 11 19 "[******* **+**-******]" 1
1973 1 92 ASN QB 1 93 ASP HA 5.500 4.950 6.050 4.647 4.493 4.852 0.457 9 0 "[ . 1 . 2]" 1
1974 1 93 ASP H 1 93 ASP QB 3.860 3.470 4.130 2.888 2.416 3.430 1.054 20 15 "[** ******* -* ***+]" 1
1975 1 93 ASP QB 1 94 SER HA 5.500 4.950 6.050 4.418 3.641 4.755 1.309 3 9 "[ *+ .* * 1** . -**]" 1
1976 1 94 SER QB 1 95 LYS H 5.500 4.950 6.050 3.403 2.139 4.153 2.811 20 20 [**************-****+] 1
1977 1 94 SER QB 1 95 LYS HA 5.500 4.950 6.050 4.656 4.085 4.878 0.865 20 2 "[ . -1 . +]" 1
1978 1 95 LYS HA 1 96 PRO HA 4.680 4.210 5.150 4.623 4.488 4.697 . 0 0 "[ . 1 . 2]" 1
1979 1 95 LYS HA 1 96 PRO QB 5.500 4.950 6.050 4.864 4.736 4.933 0.214 3 0 "[ . 1 . 2]" 1
1980 1 95 LYS HA 1 96 PRO HG3 5.500 4.950 6.050 4.701 4.575 4.771 0.375 2 0 "[ . 1 . 2]" 1
1981 1 95 LYS QB 1 96 PRO HA 5.500 4.950 6.050 4.807 4.650 4.936 0.300 5 0 "[ . 1 . 2]" 1
1982 1 96 PRO HA 1 97 TYR H 2.930 2.640 3.220 2.548 2.336 2.716 0.304 14 0 "[ . 1 . 2]" 1
1983 1 96 PRO HA 1 97 TYR QB 5.500 4.950 6.050 4.629 4.319 4.996 0.631 12 1 "[ . 1 + . 2]" 1
1984 1 96 PRO HD2 1 97 TYR H 5.020 4.520 5.520 5.031 4.467 5.562 0.053 8 0 "[ . 1 . 2]" 1
1985 1 96 PRO HD3 1 97 TYR H 5.500 4.950 6.050 5.359 4.958 5.719 . 0 0 "[ . 1 . 2]" 1
1986 1 96 PRO HG2 1 97 TYR H 4.890 4.400 5.380 4.751 4.175 5.327 0.225 19 0 "[ . 1 . 2]" 1
1987 1 96 PRO HG2 1 97 TYR QB 5.500 4.950 6.050 5.091 4.597 5.559 0.353 6 0 "[ . 1 . 2]" 1
1988 1 97 TYR H 1 97 TYR QB 3.930 3.540 4.320 2.878 2.126 3.420 1.414 10 12 "[**-** *+* *. ***]" 1
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