NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
456191 |
2kum   |
16839 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kum
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 2035
_Distance_constraint_stats_list.Viol_count 10509
_Distance_constraint_stats_list.Viol_total 217806.625
_Distance_constraint_stats_list.Viol_max 3.731
_Distance_constraint_stats_list.Viol_rms 0.3817
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1189
_Distance_constraint_stats_list.Viol_average_violations_only 0.6909
_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 PHE 429.724 2.494 10 30 [*********+************-*******]
1 2 LEU 538.632 2.588 24 30 [**-********************+******]
1 3 LEU 594.922 2.317 29 30 [*****************-**********+*]
1 4 PRO 491.328 2.990 30 30 [************-****************+]
1 5 PRO 438.231 2.990 30 30 [*********-*******************+]
1 6 SER 90.570 1.516 30 29 [*********-****.**************+]
1 7 THR 284.883 2.027 20 30 [****-**************+**********]
1 8 ALA 267.790 1.723 8 30 [*******+*************-********]
1 9 CYS 483.036 2.461 2 30 [*+**-*************************]
1 10 CYS 401.790 2.461 2 30 [*+*********-******************]
1 11 THR 409.306 2.588 24 30 [*********************-*+******]
1 12 GLN 644.853 2.990 30 30 [************-****************+]
1 13 LEU 576.248 2.606 14 30 [*********-***+****************]
1 14 TYR 670.441 3.251 29 30 [**********************-*****+*]
1 15 ARG 356.871 2.209 30 30 [*********************-*******+]
1 16 LYS 548.978 2.091 23 30 [*********************-+*******]
1 17 PRO 696.319 2.290 11 30 [**********+*-*****************]
1 18 LEU 989.910 2.912 24 30 [**-********************+******]
1 19 SER 322.479 2.613 9 30 [********+-********************]
1 20 ASP 435.192 2.461 2 30 [*+*****************-**********]
1 21 LYS 666.438 2.613 9 30 [******-*+*********************]
1 22 LEU 1354.659 2.588 24 30 [**-********************+******]
1 23 LEU 767.756 2.571 21 30 [**-*****************+*********]
1 24 ARG 744.760 2.458 6 30 [*****+****************-*******]
1 25 LYS 809.400 2.322 25 30 [************-***********+*****]
1 26 VAL 951.034 2.494 10 30 [*********+****-***************]
1 27 ILE 1426.471 3.602 25 30 [**-*********************+*****]
1 28 GLN 582.579 3.009 27 30 [************-*************+***]
1 29 VAL 840.823 2.588 24 30 [**-********************+******]
1 30 GLU 503.111 2.990 30 30 [************-****************+]
1 31 LEU 713.254 2.601 30 30 [*********-*******************+]
1 32 GLN 579.313 2.990 30 30 [****-************************+]
1 33 GLU 622.375 2.990 30 30 [************-****************+]
1 34 ALA 134.391 1.563 18 30 [*****************+*****-******]
1 35 ASP 488.256 2.461 2 30 [*+*******-********************]
1 36 GLY 71.198 1.516 30 28 "[*-***** ******************** +]"
1 37 ASP 274.653 2.461 2 30 [*+**************-*************]
1 38 CYS 237.619 1.876 25 30 [**********************-*+*****]
1 39 HIS 595.215 2.458 6 30 [*****+****************-*******]
1 40 LEU 740.120 2.588 24 30 [**-********************+******]
1 41 GLN 369.043 2.990 30 30 [***-*************************+]
1 42 ALA 249.281 1.306 12 30 [***********+-*****************]
1 43 PHE 704.502 2.494 10 30 [*********+**************-*****]
1 44 VAL 895.308 2.631 29 30 [**-*************************+*]
1 45 LEU 474.429 3.138 28 30 [*-*************************+**]
1 46 HIS 367.924 2.094 3 30 [**+*******************-*******]
1 47 LEU 1057.276 3.731 28 30 [**-************************+**]
1 48 ALA 297.332 2.242 26 30 [*****************-*******+****]
1 49 GLN 479.802 3.602 25 30 [********-***************+*****]
1 50 ARG 703.313 2.494 10 30 [*********+************-*******]
1 51 SER 168.623 2.912 24 30 [***********************+**-***]
1 52 ILE 1073.295 3.138 28 30 [**-************************+**]
1 53 CYS 441.637 2.461 2 30 [*+*************************-**]
1 54 ILE 1046.036 3.251 29 30 [**-*************************+*]
1 55 HIS 562.607 2.926 15 30 [*********-****+***************]
1 56 PRO 708.067 2.990 30 30 [************-****************+]
1 57 GLN 492.028 2.926 15 30 [************-*+***************]
1 58 ASN 769.612 2.338 9 30 [**-*****+*********************]
1 59 PRO 492.656 2.290 11 30 [**********+*-*****************]
1 60 SER 509.139 2.338 9 30 [********+-********************]
1 61 LEU 654.912 2.743 27 30 [*********************-****+***]
1 62 SER 293.468 2.338 9 30 [********+******-**************]
1 63 GLN 392.939 2.990 30 30 [************-****************+]
1 64 TRP 944.485 3.731 28 30 [**********************-****+**]
1 65 PHE 663.024 2.494 10 30 [*********+************-*******]
1 66 GLU 501.310 2.990 30 30 [************-****************+]
1 67 HIS 452.326 1.887 30 30 [**********************-******+]
1 68 GLN 431.986 2.242 26 30 [*****-*******************+****]
1 69 GLU 409.966 2.990 30 30 [************-****************+]
1 70 ARG 923.279 2.494 10 30 [*********+************-*******]
1 71 LYS 712.490 2.491 7 30 [******+****************-******]
1 72 LEU 837.389 2.588 24 30 [**-********************+******]
1 73 HIS 540.048 2.130 10 30 [*********+************-*******]
1 74 GLY 228.308 2.491 7 30 [*-****+***********************]
1 75 THR 446.889 2.458 6 30 [*****+***************-********]
1 76 LEU 746.782 2.588 24 30 [**-********************+******]
1 77 PRO 458.576 2.130 10 30 [*********+***************-****]
1 78 LYS 560.725 2.091 23 30 [****-*****************+*******]
1 79 LEU 820.038 2.588 24 30 [**-********************+******]
1 80 ASN 440.546 2.461 2 30 [*+**********************-*****]
1 81 PHE 701.174 2.568 26 30 [**********************-**+****]
1 82 GLY 32.933 1.580 30 19 "[** *** * **** ***2* **-* +]"
1 83 MET 491.845 2.458 6 30 [*****+******-*****************]
1 84 LEU 867.390 2.588 24 30 [**-********************+******]
1 85 ARG 918.262 2.990 30 30 [**********************-******+]
1 86 LYS 604.211 2.091 23 30 [****-*****************+*******]
1 87 MET 627.229 2.461 2 30 [*+**********-*****************]
1 88 GLY 215.595 2.290 11 30 [**********+************-******]
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 LEU H 1 75 THR H 3.200 . 4.500 2.356 1.908 2.721 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 27 ILE H 1 46 HIS H 4.000 . 6.000 3.507 3.212 3.709 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 14 TYR H 1 45 LEU H 4.300 . 6.000 4.099 3.982 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 11 THR H 1 33 GLU H 3.400 . 4.800 3.901 3.818 4.001 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 7 THR HA 1 88 GLY H 2.500 . 3.300 3.262 2.700 4.367 1.067 10 2 "[ . + .- 2 . 3]" 1
6 1 8 ALA MB 1 87 MET H 2.600 . 3.400 4.368 3.791 4.597 1.197 6 28 "[*****+********* -*******.*****]" 1
7 1 2 LEU QB 1 85 ARG H 3.000 . 4.100 2.356 1.693 3.165 0.207 26 0 "[ . 1 . 2 . 3]" 1
8 1 2 LEU QD 1 85 ARG H 2.600 . 3.400 3.533 1.951 4.440 1.040 27 14 "[ * ***-*** . **2 **. + *]" 1
9 1 3 LEU QB 1 84 LEU H 2.400 . 3.100 2.429 1.754 2.993 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 2 LEU QD 1 84 LEU H 4.100 . 6.000 3.061 1.700 3.927 0.300 12 0 "[ . 1 . 2 . 3]" 1
11 1 4 PRO QD 1 84 LEU H 2.600 . 3.400 3.518 3.122 4.916 1.516 30 2 "[ . 1 . 2 .- +]" 1
12 1 18 LEU QD 1 80 ASN H 3.000 . 4.100 3.325 2.358 3.906 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 8 ALA MB 1 86 LYS H 3.800 . 5.600 3.554 2.699 4.573 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 17 PRO QB 1 86 LYS H 2.700 . 3.600 2.874 2.435 3.197 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 2 LEU QD 1 86 LYS H 4.100 . 6.000 4.462 3.320 4.872 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 1 PHE QB 1 84 LEU H 5.500 . 6.000 3.971 2.240 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 4 PRO QB 1 88 GLY H 2.700 . 3.600 4.442 2.822 4.883 1.283 8 25 "[*******+*1** ** ****** *- ****]" 1
18 1 8 ALA MB 1 88 GLY H 4.500 . 6.000 5.273 2.774 5.999 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 2 LEU QD 1 88 GLY H 3.100 . 4.300 3.851 2.327 5.109 0.809 25 3 "[ . 1 .- * 2 + 3]" 1
20 1 2 LEU QB 1 88 GLY H 3.100 . 4.300 4.086 2.499 5.302 1.002 16 6 "[ . * .+ **2 -* 3]" 1
21 1 3 LEU QB 1 87 MET H 4.400 . 6.000 3.878 3.176 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 2 LEU QD 1 87 MET H 3.000 . 4.100 4.271 3.190 5.044 0.944 18 9 "[* ** 1 *-. *+*2 * 3]" 1
23 1 4 PRO QB 1 86 LYS H 2.500 . 3.300 2.874 2.435 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 4 PRO QG 1 85 ARG H 4.300 . 6.000 3.510 2.702 4.238 . 0 0 "[ . 1 . 2 . 3]" 1
25 1 4 PRO QG 1 85 ARG H 4.300 . 6.000 3.511 2.702 4.240 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 10 CYS QB 1 85 ARG H 3.300 . 4.600 4.101 2.438 5.170 0.570 30 1 "[ . 1 . 2 . +]" 1
27 1 4 PRO QD 1 85 ARG H 2.900 . 3.900 3.546 2.756 5.089 1.189 26 3 "[ . 1 . 2 - .+ *]" 1
28 1 2 LEU QD 1 83 MET H 4.600 . 6.000 4.183 2.322 5.317 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 3 LEU QB 1 83 MET H 3.700 . 5.500 3.705 1.987 4.295 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 10 CYS QB 1 83 MET H 2.800 . 3.800 4.559 1.966 6.009 2.209 30 18 "[* * ***1* * .* **2***-*** +]" 1
31 1 9 CYS QB 1 83 MET H 3.100 . 4.300 4.387 3.104 5.059 0.759 6 3 "[ - .+ 1 * . 2 . 3]" 1
32 1 1 PHE QB 1 83 MET H 3.500 . 5.000 4.177 3.083 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 4 PRO HA 1 82 GLY H 2.700 . 3.600 3.378 2.975 5.180 1.580 30 2 "[ . 1 - . 2 . +]" 1
34 1 4 PRO QD 1 81 PHE H 4.000 . 6.000 4.345 3.841 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 18 LEU QD 1 81 PHE H 4.500 . 6.000 3.354 1.528 5.241 0.472 23 0 "[ . 1 . 2 . 3]" 1
36 1 1 PHE QD 1 80 ASN H 5.200 . 6.000 4.635 3.617 5.754 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 1 PHE QB 1 80 ASN H 4.800 . 6.000 4.820 4.097 5.461 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 4 PRO QG 1 80 ASN H 4.400 . 6.000 5.429 3.989 5.875 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 16 LYS QB 1 80 ASN H 2.700 . 3.600 4.108 3.311 4.748 1.148 5 14 "[* *+ * 1* ** **2**- ** 3]" 1
40 1 3 LEU HG 1 80 ASN H 3.000 . 4.100 4.597 2.526 5.697 1.597 5 19 "[* *+* **1 * *. ***-** *. ****]" 1
41 1 16 LYS QB 1 79 LEU H 2.700 . 3.600 3.397 2.844 3.740 0.140 18 0 "[ . 1 . 2 . 3]" 1
42 1 18 LEU QD 1 79 LEU H 2.700 . 3.600 2.686 1.808 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 5 PRO QB 1 79 LEU H 2.900 . 3.900 3.885 2.874 4.564 0.664 4 5 "[ +. * 1 . **2 .- 3]" 1
44 1 16 LYS QB 1 78 LYS H 3.000 . 4.100 2.232 1.763 2.642 0.137 26 0 "[ . 1 . 2 . 3]" 1
45 1 21 LYS QB 1 78 LYS H 2.800 . 3.800 2.364 2.007 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 15 ARG QB 1 78 LYS H 3.100 . 4.300 2.825 1.857 3.840 0.043 29 0 "[ . 1 . 2 . 3]" 1
47 1 3 LEU HG 1 75 THR H 3.700 . 5.400 3.213 2.684 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 2 LEU QB 1 75 THR H 3.500 . 5.000 3.440 2.721 5.112 0.112 6 0 "[ . 1 . 2 . 3]" 1
49 1 8 ALA MB 1 75 THR H 4.100 . 6.000 3.518 2.745 5.220 . 0 0 "[ . 1 . 2 . 3]" 1
50 1 2 LEU QD 1 75 THR H 4.500 . 6.000 3.606 2.649 4.310 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 2 LEU QB 1 74 GLY H 3.900 . 5.900 3.010 2.082 4.043 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 7 THR MG 1 74 GLY H 5.100 . 6.000 4.536 3.447 5.763 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 15 ARG QB 1 73 HIS H 4.800 . 6.000 2.436 1.734 3.802 0.266 25 0 "[ . 1 . 2 . 3]" 1
54 1 17 PRO QB 1 73 HIS H 3.100 . 4.300 4.342 3.272 5.033 0.733 6 1 "[ .+ 1 . 2 . 3]" 1
55 1 2 LEU QD 1 73 HIS H 3.200 . 4.500 3.443 2.223 4.209 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 2 LEU QD 1 72 LEU H 4.200 . 6.000 2.040 1.712 2.255 0.288 7 0 "[ . 1 . 2 . 3]" 1
57 1 1 PHE QB 1 72 LEU H 4.300 . 6.000 4.750 4.463 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 2 LEU QB 1 72 LEU H 2.800 . 3.800 3.005 2.743 3.167 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 17 PRO QB 1 71 LYS H 3.000 . 4.100 2.599 2.408 2.689 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 8 ALA MB 1 71 LYS H 3.800 . 5.600 3.401 2.758 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 3 LEU QB 1 71 LYS H 3.100 . 4.300 3.294 2.893 3.640 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 4 PRO QG 1 70 ARG H 3.200 . 4.500 2.751 2.555 2.988 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 3 LEU HG 1 70 ARG H 3.900 . 5.800 2.031 1.795 2.351 0.205 7 0 "[ . 1 . 2 . 3]" 1
64 1 22 LEU HA 1 70 ARG H 2.700 . 3.600 3.193 3.072 3.270 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 2 LEU QD 1 70 ARG H 5.300 . 6.000 4.454 3.990 5.227 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 7 THR HA 1 69 GLU H 3.100 . 4.300 5.523 5.178 5.655 1.355 27 30 [******-*******************+***] 1
67 1 4 PRO QG 1 69 GLU H 2.900 . 3.900 2.023 1.952 2.149 . 0 0 "[ . 1 . 2 . 3]" 1
68 1 21 LYS QB 1 69 GLU H 3.900 . 5.800 2.324 2.166 2.685 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 2 LEU QD 1 69 GLU H 4.900 . 6.000 3.711 3.206 4.443 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 2 LEU QB 1 69 GLU H 5.100 . 6.000 3.771 3.244 4.118 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 4 PRO QG 1 68 GLN H 3.800 . 5.600 3.913 3.802 3.997 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 4 PRO QG 1 67 HIS H 4.400 . 6.000 2.480 2.290 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 4 PRO QG 1 66 GLU H 2.700 . 3.600 2.439 2.173 2.585 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 16 LYS QB 1 66 GLU H 4.700 . 6.000 4.074 3.466 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 3 LEU HG 1 66 GLU H 3.100 . 4.300 4.478 3.679 5.431 1.131 30 9 "[ * . * * * .*- 2 *.* +]" 1
76 1 9 CYS HA 1 66 GLU H 4.800 . 6.000 5.071 4.644 5.179 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 1 PHE QB 1 65 PHE H 3.300 . 4.600 2.182 2.052 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 1 PHE QB 1 65 PHE H 3.400 . 4.900 2.187 2.054 2.318 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 4 PRO QG 1 65 PHE H 4.300 . 6.000 4.168 3.480 4.359 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 23 LEU QD 1 65 PHE H 3.000 . 4.200 3.560 3.376 3.804 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 14 TYR QD 1 65 PHE H 4.000 . 6.000 4.379 4.201 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 1 PHE QD 1 68 GLN H 5.000 . 6.000 4.518 4.225 4.823 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 12 GLN QE 1 64 TRP H 5.200 . 6.000 4.249 3.077 4.604 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 1 PHE QD 1 64 TRP H 5.100 . 6.000 4.545 3.950 5.034 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 14 TYR QD 1 64 TRP H 5.200 . 6.000 4.533 4.306 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 4 PRO QG 1 64 TRP H 4.200 . 6.000 2.964 2.488 3.497 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 2 LEU QB 1 64 TRP H 3.100 . 4.300 4.481 4.370 4.602 0.302 2 0 "[ . 1 . 2 . 3]" 1
88 1 23 LEU QD 1 64 TRP H 2.800 . 3.800 3.696 3.485 3.892 0.092 3 0 "[ . 1 . 2 . 3]" 1
89 1 1 PHE HA 1 63 GLN H 3.000 . 4.100 2.702 2.686 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 4 PRO QG 1 63 GLN H 3.000 . 4.100 2.387 2.195 2.606 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 1 PHE QD 1 62 SER H 3.000 . 4.100 4.435 3.937 4.959 0.859 7 8 "[ . + *** . 2 - . ***]" 1
92 1 4 PRO QG 1 62 SER H 3.800 . 5.600 4.084 3.774 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 4 PRO QB 1 62 SER H 4.800 . 6.000 4.354 3.690 5.385 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 10 CYS QB 1 62 SER H 3.100 . 4.300 4.445 3.988 5.160 0.860 23 4 "[ . 1- . 2 + . * *]" 1
95 1 2 LEU QD 1 62 SER H 3.000 . 4.200 4.150 3.252 4.798 0.598 26 4 "[ . 1 - . 2 * .+ *]" 1
96 1 4 PRO QG 1 61 LEU H 3.300 . 4.600 4.085 3.898 4.364 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 2 LEU QD 1 61 LEU H 2.700 . 3.600 4.820 4.417 5.125 1.525 2 30 [*+*****-**********************] 1
98 1 5 PRO QD 1 60 SER H 3.700 . 5.400 2.290 2.149 2.533 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 1 PHE QB 1 60 SER H 3.100 . 4.300 3.331 2.391 3.936 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 4 PRO QG 1 60 SER H 3.100 . 4.300 2.531 2.233 3.032 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 4 PRO QB 1 60 SER H 3.000 . 4.200 4.222 3.432 4.803 0.603 9 1 "[ . +1 . 2 . 3]" 1
102 1 2 LEU QB 1 60 SER H 5.200 . 6.000 4.283 4.028 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 15 ARG QB 1 60 SER H 4.300 . 6.000 4.332 4.080 4.507 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 16 LYS QB 1 60 SER H 4.800 . 6.000 4.267 3.806 4.768 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 9 CYS HA 1 60 SER H 4.300 . 6.000 3.314 3.121 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 5 PRO QD 1 58 ASN H 4.700 . 6.000 3.942 3.589 4.134 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 2 LEU HA 1 58 ASN H 2.700 . 3.600 3.774 3.006 4.247 0.647 1 12 "[+ * * ** * *. *2 *.* -*3]" 1
108 1 22 LEU HA 1 58 ASN H 4.400 . 6.000 4.119 3.926 4.273 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 17 PRO QG 1 58 ASN H 4.800 . 6.000 4.424 4.112 4.803 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 4 PRO QB 1 58 ASN H 2.700 . 3.600 4.608 4.177 5.140 1.540 12 30 [***********+-*****************] 1
111 1 31 LEU QD 1 58 ASN H 3.000 . 4.100 4.734 4.026 5.219 1.119 7 21 "[** ***+ *** *** *-** * .* ***]" 1
112 1 23 LEU QD 1 58 ASN H 2.500 . 3.300 4.746 4.019 5.232 1.932 7 30 [******+*******************-***] 1
113 1 2 LEU QD 1 58 ASN H 2.800 . 3.800 4.578 3.572 5.446 1.646 26 22 "[ *- .** 1*********** ***+ ***]" 1
114 1 12 GLN H 1 58 ASN H 2.900 . 3.900 5.717 4.672 6.182 2.282 7 30 [******+***************-*******] 1
115 1 12 GLN QE 1 58 ASN H 5.900 . 6.000 4.412 1.954 5.180 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 1 PHE QB 1 55 HIS H 3.000 . 4.100 3.467 2.788 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 16 LYS QB 1 55 HIS H 3.500 . 5.000 2.441 2.259 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 2 LEU HA 1 54 ILE H 4.400 . 6.000 4.121 3.958 4.357 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 3 LEU HG 1 54 ILE H 3.500 . 5.000 4.332 3.772 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 8 ALA MB 1 54 ILE H 3.500 . 5.000 2.943 2.444 3.099 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 11 THR MG 1 54 ILE H 2.600 . 3.400 3.401 2.880 4.211 0.811 29 1 "[ . 1 . 2 . +3]" 1
122 1 13 LEU QD 1 54 ILE H 2.500 . 3.300 3.297 2.619 3.632 0.332 13 0 "[ . 1 . 2 . 3]" 1
123 1 31 LEU QD 1 54 ILE H 2.900 . 3.900 2.872 2.462 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 2 LEU QD 1 53 CYS H 3.800 . 5.600 3.249 2.559 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 3 LEU HG 1 52 ILE H 4.000 . 6.000 3.295 3.049 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 30 GLU HA 1 51 SER H 4.200 . 6.000 4.860 4.364 5.209 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 1 PHE QB 1 51 SER H 3.200 . 4.500 4.274 3.203 5.146 0.646 17 2 "[ . 1 - + 2 . 3]" 1
128 1 4 PRO QB 1 51 SER H 2.800 . 3.800 2.359 2.055 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 2 LEU QD 1 51 SER H 5.300 . 6.000 3.298 1.676 3.983 0.124 26 0 "[ . 1 . 2 . 3]" 1
130 1 18 LEU QD 1 51 SER H 4.700 . 6.000 4.157 3.493 4.563 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 31 LEU QD 1 51 SER H 4.800 . 6.000 4.557 2.991 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 30 GLU HA 1 50 ARG H 3.700 . 5.400 4.275 4.000 4.521 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 39 HIS QB 1 50 ARG H 4.900 . 6.000 5.711 5.412 5.954 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 1 PHE QB 1 50 ARG H 4.900 . 6.000 3.607 1.965 4.606 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 4 PRO QB 1 50 ARG H 3.100 . 4.300 2.962 2.310 3.618 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 18 LEU QD 1 50 ARG H 3.400 . 4.800 3.561 3.273 3.842 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 2 LEU QD 1 50 ARG H 5.300 . 6.000 4.360 3.491 4.798 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 4 PRO HA 1 49 GLN H 3.900 . 5.800 4.615 4.148 4.988 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 1 PHE QB 1 49 GLN H 4.600 . 6.000 4.478 3.275 5.433 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 4 PRO QB 1 49 GLN H 3.000 . 4.100 2.496 2.002 2.707 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 16 LYS QB 1 49 GLN H 3.200 . 4.500 2.548 2.231 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 8 ALA MB 1 49 GLN H 3.900 . 5.800 3.732 3.008 4.821 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 18 LEU QD 1 49 GLN H 4.700 . 6.000 3.688 3.491 4.213 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 2 LEU QB 1 49 GLN H 5.500 . 6.000 3.494 2.964 4.048 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 6 SER HA 1 48 ALA H 5.000 . 6.000 5.207 5.065 5.353 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 5 PRO QD 1 48 ALA H 4.900 . 6.000 3.733 3.135 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 1 PHE QB 1 48 ALA H 4.500 . 6.000 5.230 3.290 5.510 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 4 PRO QB 1 48 ALA H 4.300 . 6.000 4.048 3.347 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 4 PRO QG 1 48 ALA H 5.100 . 6.000 3.800 3.070 5.200 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 11 THR MG 1 48 ALA H 2.700 . 3.600 3.490 3.219 3.859 0.259 8 0 "[ . 1 . 2 . 3]" 1
151 1 2 LEU QD 1 48 ALA H 3.500 . 5.000 3.207 2.954 3.346 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 30 GLU HA 1 47 LEU H 2.300 . 3.000 2.111 2.053 2.179 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 5 PRO QD 1 47 LEU H 4.400 . 6.000 4.130 3.853 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 39 HIS QB 1 47 LEU H 3.800 . 5.600 4.385 3.558 5.110 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 8 ALA MB 1 47 LEU H 5.300 . 6.000 3.673 3.185 4.321 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 23 LEU QD 1 47 LEU H 3.900 . 5.800 4.397 3.686 4.787 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 2 LEU QD 1 47 LEU H 5.200 . 6.000 3.332 3.062 3.673 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 12 GLN QE 1 46 HIS H 3.900 . 5.800 5.632 5.060 5.958 0.158 11 0 "[ . 1 . 2 . 3]" 1
159 1 28 GLN HA 1 46 HIS H 5.600 . 6.000 5.071 4.816 5.385 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 5 PRO QD 1 46 HIS H 5.200 . 6.000 4.840 4.421 5.285 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 4 PRO QG 1 46 HIS H 2.800 . 3.800 3.923 3.375 4.347 0.547 29 1 "[ . 1 . 2 . +3]" 1
162 1 5 PRO QB 1 46 HIS H 2.900 . 3.900 3.480 2.815 4.037 0.137 2 0 "[ . 1 . 2 . 3]" 1
163 1 4 PRO QB 1 46 HIS H 4.400 . 6.000 3.882 3.363 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 3 LEU HG 1 46 HIS H 4.300 . 6.000 3.178 2.990 3.428 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 2 LEU QB 1 46 HIS H 5.500 . 6.000 4.324 4.178 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 13 LEU QD 1 46 HIS H 2.800 . 3.800 3.367 3.141 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 2 LEU QD 1 46 HIS H 5.200 . 6.000 2.585 2.353 2.908 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 3 LEU HA 1 45 LEU H 2.400 . 3.100 2.107 2.065 2.175 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 39 HIS QB 1 45 LEU H 4.800 . 6.000 4.594 3.919 5.455 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 9 CYS QB 1 45 LEU H 4.900 . 6.000 4.746 4.412 5.023 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 3 LEU HG 1 45 LEU H 2.500 . 3.300 2.283 2.220 2.462 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 2 LEU QB 1 45 LEU H 4.000 . 6.000 3.532 3.299 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 2 LEU QD 1 45 LEU H 3.100 . 4.300 2.519 2.333 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 13 LEU QD 1 45 LEU H 3.800 . 5.600 3.112 2.165 3.328 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 29 VAL HA 1 44 VAL H 4.600 . 6.000 4.544 4.205 4.825 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 5 PRO QB 1 44 VAL H 2.500 . 3.300 3.223 2.683 3.591 0.291 1 0 "[ . 1 . 2 . 3]" 1
177 1 3 LEU HG 1 44 VAL H 4.500 . 6.000 4.288 3.504 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 4 PRO QB 1 44 VAL H 3.900 . 5.800 4.201 3.644 4.914 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 11 THR MG 1 44 VAL H 2.900 . 4.000 4.244 3.985 4.578 0.578 27 3 "[ * . 1 . 2 . + -3]" 1
180 1 8 ALA MB 1 44 VAL H 5.100 . 6.000 3.897 3.291 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 13 LEU QD 1 44 VAL H 4.400 . 6.000 3.791 3.438 4.062 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 3 LEU HA 1 43 PHE H 5.000 . 6.000 4.333 4.090 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 2 LEU HA 1 43 PHE H 2.800 . 3.800 2.188 2.065 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 5 PRO QD 1 43 PHE H 2.800 . 3.800 2.783 2.262 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 4 PRO QB 1 43 PHE H 3.000 . 4.200 4.261 3.839 4.943 0.743 27 3 "[ . 1 . * 2 . + -3]" 1
186 1 3 LEU HG 1 43 PHE H 5.300 . 6.000 3.390 2.715 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 15 ARG QB 1 43 PHE H 3.000 . 4.100 3.388 2.715 4.489 0.389 11 0 "[ . 1 . 2 . 3]" 1
188 1 8 ALA MB 1 43 PHE H 4.900 . 6.000 3.215 2.802 3.710 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 2 LEU QD 1 43 PHE H 4.900 . 6.000 3.720 3.473 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 3 LEU HA 1 42 ALA H 4.100 . 6.000 3.938 3.791 4.144 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 4 PRO QG 1 42 ALA H 3.100 . 4.300 4.658 4.332 5.014 0.714 16 6 "[ .* 1 *- *+ 2 . * 3]" 1
192 1 17 PRO QG 1 42 ALA H 2.600 . 3.500 3.181 2.492 4.098 0.598 24 2 "[ . - 1 . 2 +. 3]" 1
193 1 8 ALA MB 1 42 ALA H 2.900 . 3.900 3.793 3.256 4.408 0.508 18 1 "[ . 1 . + 2 . 3]" 1
194 1 7 THR MG 1 42 ALA H 2.800 . 3.800 4.052 3.641 4.341 0.541 28 1 "[ . 1 . 2 . + 3]" 1
195 1 2 LEU QD 1 42 ALA H 3.600 . 5.200 3.708 3.436 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 31 LEU QD 1 42 ALA H 4.100 . 6.000 3.231 2.668 4.240 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 4 PRO QD 1 41 GLN H 3.000 . 4.100 3.476 2.469 4.350 0.250 12 0 "[ . 1 . 2 . 3]" 1
198 1 4 PRO QB 1 41 GLN H 3.200 . 4.500 2.351 2.279 2.444 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 7 THR MG 1 41 GLN H 3.100 . 4.300 2.646 2.151 3.282 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 2 LEU QD 1 41 GLN H 4.200 . 6.000 2.832 1.932 3.555 0.068 20 0 "[ . 1 . 2 . 3]" 1
201 1 4 PRO QD 1 40 LEU H 3.100 . 4.300 2.965 1.988 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 9 CYS QB 1 40 LEU H 4.700 . 6.000 3.222 2.306 5.470 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 4 PRO HA 1 39 HIS H 2.900 . 3.900 2.394 2.139 2.567 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 1 PHE QB 1 39 HIS H 4.200 . 6.000 2.335 1.838 2.805 0.162 14 0 "[ . 1 . 2 . 3]" 1
205 1 4 PRO QB 1 38 CYS H 5.600 . 6.000 3.668 2.849 4.638 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 4 PRO HA 1 38 CYS H 2.800 . 3.800 2.845 2.736 2.899 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 9 CYS QB 1 37 ASP H 4.300 . 6.000 4.518 3.729 5.212 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 1 PHE QB 1 37 ASP H 4.800 . 6.000 4.534 3.775 5.231 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 2 LEU HA 1 35 ASP H 2.600 . 3.400 3.887 3.618 4.165 0.765 12 16 "[ * *- +**. **** *** ** *]" 1
210 1 2 LEU HA 1 35 ASP H 2.700 . 3.600 3.887 3.619 4.163 0.563 12 2 "[ . 1 + . -2 . 3]" 1
211 1 22 LEU HA 1 35 ASP H 5.100 . 6.000 3.671 3.364 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 1 PHE QB 1 35 ASP H 4.000 . 6.000 4.957 4.419 5.292 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 9 CYS QB 1 35 ASP H 5.000 . 6.000 5.333 4.444 5.704 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 4 PRO QB 1 35 ASP H 4.100 . 6.000 4.210 4.007 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 21 LYS QB 1 35 ASP H 3.100 . 4.300 2.646 2.177 3.275 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 18 LEU H 1 35 ASP H 4.500 . 6.000 3.309 2.570 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 4 PRO QG 1 34 ALA H 4.200 . 6.000 2.649 2.310 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 33 GLU H 1 35 ASP H 4.700 . 6.000 4.688 4.416 5.178 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 4 PRO QB 1 33 GLU H 4.000 . 6.000 3.755 3.631 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 4 PRO QB 1 33 GLU H 4.000 . 6.000 3.849 3.679 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 3 LEU HG 1 33 GLU H 3.600 . 5.200 2.419 2.190 2.533 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 7 THR MG 1 33 GLU H 3.000 . 4.200 3.669 3.275 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 31 LEU QD 1 33 GLU H 5.600 . 6.000 4.163 3.916 4.516 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 4 PRO QB 1 32 GLN H 3.400 . 4.800 2.246 2.181 2.318 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 16 LYS QB 1 32 GLN H 5.100 . 6.000 3.708 2.869 3.859 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 2 LEU QD 1 32 GLN H 2.800 . 3.800 3.170 2.744 3.493 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 9 CYS HA 1 32 GLN H 2.700 . 3.600 2.066 2.034 2.098 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 7 THR MG 1 32 GLN H 4.300 . 6.000 3.639 3.270 4.086 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 4 PRO QB 1 31 LEU H 5.000 . 6.000 4.729 4.411 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 16 LYS QB 1 31 LEU H 4.100 . 6.000 4.944 4.354 5.320 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 2 LEU QD 1 31 LEU H 4.400 . 6.000 3.887 2.747 4.530 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 5 PRO QB 1 29 VAL H 3.100 . 4.300 3.639 2.751 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 4 PRO QG 1 29 VAL H 4.400 . 6.000 2.651 2.461 3.063 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 3 LEU HA 1 28 GLN H 2.900 . 4.000 5.206 4.937 5.493 1.493 29 30 [**********************-*****+*] 1
235 1 1 PHE QB 1 28 GLN H 2.200 . 2.800 2.834 2.479 3.221 0.421 21 0 "[ . 1 . 2 . 3]" 1
236 1 1 PHE QB 1 28 GLN H 3.300 . 4.700 2.833 2.478 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 4 PRO QB 1 28 GLN H 3.500 . 5.100 2.669 2.583 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 13 LEU QD 1 28 GLN H 5.700 . 6.000 4.163 3.948 4.748 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 26 VAL H 1 35 ASP H 3.000 . 4.100 5.741 5.158 5.976 1.876 10 30 [**-******+********************] 1
240 1 26 VAL H 1 30 GLU HA 4.600 . 6.000 4.449 4.058 5.317 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 4 PRO QB 1 26 VAL H 4.900 . 6.000 3.911 3.752 4.020 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 3 LEU HG 1 26 VAL H 3.400 . 4.900 3.361 3.150 3.652 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 23 LEU QD 1 26 VAL H 4.100 . 6.000 4.390 3.911 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 21 LYS H 1 25 LYS H 2.700 . 3.600 4.007 3.846 4.165 0.565 27 3 "[ -. 1 . 2 * . + 3]" 1
245 1 5 PRO QB 1 25 LYS H 3.700 . 5.400 4.378 4.003 4.629 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 3 LEU HG 1 25 LYS H 3.000 . 4.100 2.657 2.199 3.011 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 25 LYS H 1 35 ASP H 2.800 . 3.800 6.011 5.911 6.122 2.322 25 30 [**-*********************+*****] 1
248 1 24 ARG H 1 35 ASP H 2.600 . 3.500 5.842 5.466 5.958 2.458 6 30 [*****+***********-************] 1
249 1 21 LYS H 1 24 ARG H 3.100 . 4.300 2.737 2.611 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 2 LEU HA 1 24 ARG H 4.200 . 6.000 5.108 5.040 5.175 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 9 CYS QB 1 24 ARG H 5.100 . 6.000 4.190 3.032 4.547 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 9 CYS QB 1 24 ARG H 2.600 . 3.500 4.998 4.135 5.283 1.783 25 30 [*******************-****+*****] 1
253 1 5 PRO QB 1 24 ARG H 4.900 . 6.000 5.604 5.169 5.875 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 3 LEU HG 1 24 ARG H 3.200 . 4.500 3.164 2.842 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 2 LEU QB 1 24 ARG H 3.200 . 4.500 2.588 2.458 2.815 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 4 PRO QG 1 24 ARG H 4.700 . 6.000 4.653 4.335 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 2 LEU QD 1 24 ARG H 4.300 . 6.000 3.679 3.516 3.828 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 7 THR H 1 23 LEU H 3.100 . 4.300 4.964 4.590 5.284 0.984 28 26 "[********** ****** *2-***** +**]" 1
259 1 9 CYS QB 1 23 LEU H 2.900 . 4.000 4.700 4.450 4.893 0.893 21 28 "[***************** *2+*****-***]" 1
260 1 4 PRO QB 1 23 LEU H 5.200 . 6.000 3.831 3.665 4.032 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 21 LYS QB 1 23 LEU H 3.700 . 5.400 3.660 3.465 3.804 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 2 LEU QB 1 23 LEU H 3.200 . 4.500 2.049 1.889 2.130 0.011 18 0 "[ . 1 . 2 . 3]" 1
263 1 2 LEU QD 1 23 LEU H 4.600 . 6.000 2.728 2.538 3.331 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 8 ALA MB 1 23 LEU H 5.500 . 6.000 4.129 3.711 4.333 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 9 CYS QB 1 22 LEU H 4.200 . 6.000 4.445 3.818 5.375 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 5 PRO QD 1 22 LEU H 5.600 . 6.000 4.967 4.896 5.023 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 4 PRO QG 1 22 LEU H 5.700 . 6.000 5.048 4.608 5.249 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 4 PRO QB 1 22 LEU H 5.800 . 6.000 5.013 4.589 5.222 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 4 PRO QB 1 22 LEU H 5.200 . 6.000 4.356 4.108 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 3 LEU HG 1 22 LEU H 2.300 . 3.000 2.587 2.491 2.781 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 2 LEU QB 1 22 LEU H 3.500 . 5.000 2.128 1.765 2.284 0.235 7 0 "[ . 1 . 2 . 3]" 1
272 1 8 ALA MB 1 22 LEU H 2.900 . 4.000 3.829 3.607 4.037 0.037 10 0 "[ . 1 . 2 . 3]" 1
273 1 2 LEU QD 1 22 LEU H 4.600 . 6.000 4.179 3.885 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 2 LEU QD 1 22 LEU H 3.900 . 5.800 2.876 2.272 3.027 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 22 LEU H 1 23 LEU QD 5.800 . 6.000 4.480 3.711 4.943 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 7 THR H 1 22 LEU H 2.600 . 3.500 4.460 4.073 4.987 1.487 9 30 [********+*****************-***] 1
277 1 21 LYS H 1 22 LEU HA 5.100 . 6.000 5.328 5.250 5.371 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 4 PRO QB 1 21 LYS H 4.400 . 6.000 4.633 4.217 4.979 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 3 LEU HG 1 21 LYS H 3.900 . 5.800 3.561 3.339 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 2 LEU QD 1 21 LYS H 5.200 . 6.000 4.418 4.178 4.701 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 2 LEU QD 1 21 LYS H 4.300 . 6.000 4.350 3.915 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 21 LYS H 1 23 LEU QD 5.900 . 6.000 4.707 4.247 5.180 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 20 ASP H 1 21 LYS QB 4.000 . 6.000 4.587 4.390 4.704 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 20 ASP H 1 23 LEU QD 4.900 . 6.000 3.680 3.383 4.300 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 2 LEU QB 1 20 ASP H 3.900 . 5.800 3.422 3.254 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 8 ALA MB 1 20 ASP H 3.600 . 5.200 3.910 3.621 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 2 LEU QD 1 19 SER H 2.900 . 4.000 2.069 1.950 2.347 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 18 LEU H 1 29 VAL H 4.500 . 6.000 5.331 4.751 5.958 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 18 LEU H 1 24 ARG HE 4.700 . 6.000 4.742 3.881 5.644 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 14 TYR QE 1 18 LEU H 4.400 . 6.000 5.238 3.632 5.952 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 2 LEU HA 1 18 LEU H 3.700 . 5.400 4.050 3.286 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 6 SER HB3 1 18 LEU H 3.900 . 5.800 2.652 2.055 3.197 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 16 LYS QB 1 18 LEU H 3.600 . 5.200 2.445 2.250 3.025 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 18 LEU H 1 18 LEU QD 3.700 . 5.400 3.048 1.979 3.262 0.021 24 0 "[ . 1 . 2 . 3]" 1
295 1 18 LEU H 1 23 LEU QD 2.900 . 3.900 3.556 2.977 4.034 0.134 25 0 "[ . 1 . 2 . 3]" 1
296 1 14 TYR H 1 14 TYR QD 4.100 . 6.000 4.041 3.754 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 14 TYR H 1 30 GLU HA 3.600 . 5.200 3.238 2.847 3.633 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 9 CYS QB 1 14 TYR H 4.800 . 6.000 4.772 4.155 5.416 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 9 CYS QB 1 14 TYR H 3.900 . 5.800 3.241 2.669 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 4 PRO QB 1 14 TYR H 3.700 . 5.400 5.329 4.864 5.568 0.168 21 0 "[ . 1 . 2 . 3]" 1
301 1 14 TYR H 1 16 LYS QB 4.300 . 6.000 3.822 3.411 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 2 LEU QD 1 14 TYR H 4.100 . 6.000 4.359 4.191 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 9 CYS QB 1 13 LEU H 3.300 . 4.600 4.769 3.878 5.577 0.977 23 6 "[ * . * * . -* + . 3]" 1
304 1 9 CYS QB 1 13 LEU H 4.900 . 6.000 4.650 4.271 5.093 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 2 LEU QD 1 13 LEU H 3.900 . 5.800 5.284 4.028 5.690 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 13 LEU H 1 14 TYR QD 4.300 . 6.000 4.984 3.036 5.884 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 7 THR HA 1 12 GLN H 3.300 . 4.600 3.101 2.928 3.212 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 4 PRO QD 1 12 GLN H 3.100 . 4.300 4.469 3.700 5.467 1.167 7 7 "[ * + 1* * * 2* . - 3]" 1
309 1 10 CYS QB 1 12 GLN H 2.800 . 3.800 3.289 2.338 5.008 1.208 21 4 "[ * 1- . 2+ . * 3]" 1
310 1 10 CYS QB 1 12 GLN H 3.800 . 5.600 3.291 2.338 5.016 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 2 LEU QD 1 12 GLN H 4.700 . 6.000 4.388 3.860 5.227 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 12 GLN H 1 13 LEU QD 4.600 . 6.000 4.236 3.805 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 7 THR HA 1 11 THR H 3.600 . 5.200 2.772 2.654 2.831 . 0 0 "[ . 1 . 2 . 3]" 1
314 1 11 THR H 1 13 LEU QD 5.000 . 6.000 5.317 4.629 5.763 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 4 PRO QG 1 11 THR H 4.600 . 6.000 4.622 4.122 4.918 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 3 LEU HA 1 10 CYS H 2.900 . 4.000 2.205 2.075 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 2 LEU QD 1 10 CYS H 5.500 . 6.000 3.400 2.663 3.762 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 9 CYS H 1 14 TYR QD 5.000 . 6.000 5.002 3.998 5.679 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 7 THR MG 1 9 CYS H 4.400 . 6.000 3.809 3.227 4.693 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 2 LEU QD 1 9 CYS H 5.700 . 6.000 2.960 1.973 4.061 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 7 THR MG 1 9 CYS H 4.700 . 6.000 3.782 3.219 4.617 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 3 LEU HA 1 8 ALA H 5.100 . 6.000 4.561 4.165 5.081 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 2 LEU HA 1 8 ALA H 4.600 . 6.000 4.115 3.063 5.050 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 7 THR HA 1 8 ALA H 2.100 . 2.600 2.287 2.115 2.561 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 4 PRO QD 1 8 ALA H 4.600 . 6.000 4.741 4.257 5.244 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 8 ALA H 1 9 CYS QB 5.400 . 6.000 3.963 3.120 4.761 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 8 ALA H 1 9 CYS QB 5.700 . 6.000 4.541 4.071 5.223 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 4 PRO QB 1 8 ALA H 6.000 . 6.000 4.614 4.135 5.199 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 2 LEU QD 1 8 ALA H 4.400 . 6.000 4.952 4.393 5.475 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 6 SER H 1 7 THR MG 4.200 . 6.000 5.919 5.048 6.050 0.050 12 0 "[ . 1 . 2 . 3]" 1
331 1 4 PRO QB 1 7 THR H 4.700 . 6.000 3.405 2.991 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 7 THR H 1 8 ALA MB 4.100 . 6.000 4.088 3.293 4.990 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 4 PRO QG 1 63 GLN QE 4.600 . 6.000 2.073 1.760 3.515 0.240 21 0 "[ . 1 . 2 . 3]" 1
334 1 4 PRO QG 1 63 GLN QE 4.500 . 6.000 2.077 1.761 3.534 0.239 21 0 "[ . 1 . 2 . 3]" 1
335 1 16 LYS QB 1 68 GLN QE 3.400 . 4.900 1.912 1.615 2.122 0.285 2 0 "[ . 1 . 2 . 3]" 1
336 1 1 PHE QB 1 50 ARG HE 3.700 . 5.400 2.436 2.299 2.497 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 15 ARG QD 1 15 ARG HE 3.800 . 5.600 2.442 2.252 2.492 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 1 PHE QB 1 24 ARG HE 4.200 . 6.000 2.451 2.254 2.499 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 2 LEU QB 1 70 ARG HE 3.600 . 5.200 2.146 1.955 2.347 0.045 5 0 "[ . 1 . 2 . 3]" 1
340 1 16 LYS QB 1 70 ARG H 2.700 . 3.600 2.778 2.706 2.890 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 39 HIS QB 1 51 SER H 2.500 . 3.300 2.674 2.417 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 4 PRO QD 1 6 SER H 2.800 . 3.800 3.262 2.826 3.415 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 4 PRO QD 1 7 THR H 3.000 . 4.100 3.516 3.272 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 2 LEU QD 1 3 LEU H 3.000 . 4.100 2.125 1.788 2.902 0.112 25 0 "[ . 1 . 2 . 3]" 1
345 1 3 LEU H 1 3 LEU HG 2.500 . 3.300 2.584 2.270 2.964 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 2 LEU QB 1 3 LEU H 2.200 . 2.800 2.093 1.948 2.218 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 3 LEU H 1 4 PRO QB 5.200 . 6.000 4.178 3.404 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 3 LEU H 1 5 PRO QB 5.700 . 6.000 5.248 4.874 5.455 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 1 PHE QB 1 3 LEU H 3.000 . 4.100 5.312 4.229 5.815 1.715 27 26 "[* -********** **********. +***]" 1
350 1 3 LEU H 1 4 PRO QD 2.100 . 2.700 3.639 3.405 3.741 1.041 7 30 [******+******************-****] 1
351 1 5 PRO QD 1 76 LEU H 4.700 . 6.000 4.233 3.694 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 3 LEU H 1 39 HIS QB 3.000 . 4.100 3.962 2.130 6.008 1.908 9 7 "[ * . +1 . * *2 * . *-]" 1
353 1 3 LEU H 1 22 LEU HA 2.700 . 3.600 5.018 4.153 5.842 2.242 26 30 [*************************+-***] 1
354 1 2 LEU HA 1 3 LEU H 1.800 . 2.200 1.966 1.911 2.097 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 3 LEU H 1 3 LEU HA 2.400 . 3.100 2.516 2.163 2.592 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 1 PHE QD 1 3 LEU H 5.100 . 6.000 4.448 3.301 5.294 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 3 LEU H 1 14 TYR QE 5.500 . 6.000 5.355 4.122 5.807 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 27 ILE H 1 29 VAL HA 2.700 . 3.600 2.122 2.075 2.230 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 1 PHE QB 1 27 ILE H 3.300 . 4.600 3.517 3.214 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 5 PRO QB 1 27 ILE H 3.900 . 5.800 1.966 1.720 2.232 0.280 13 0 "[ . 1 . 2 . 3]" 1
361 1 4 PRO QB 1 27 ILE H 3.200 . 4.500 3.185 2.613 3.265 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 11 THR MG 1 27 ILE H 2.500 . 3.300 1.966 1.836 2.154 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 2 LEU QD 1 27 ILE H 4.000 . 6.000 2.231 2.046 2.428 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 2 LEU QD 1 27 ILE H 3.200 . 4.500 2.263 1.956 2.596 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 13 LEU QD 1 27 ILE H 5.100 . 6.000 2.648 2.329 3.223 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 27 ILE H 1 31 LEU QD 5.200 . 6.000 3.720 3.244 4.009 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 7 THR HA 1 12 GLN QE 5.100 . 6.000 4.147 3.906 4.780 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 7 THR HA 1 12 GLN QE 4.400 . 6.000 4.146 3.906 4.777 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 7 THR MG 1 12 GLN QE 5.100 . 6.000 4.111 2.738 4.694 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 2 LEU QB 1 28 GLN QE 3.100 . 4.300 3.881 3.356 4.355 0.055 27 0 "[ . 1 . 2 . 3]" 1
371 1 2 LEU QB 1 28 GLN QE 3.100 . 4.300 3.868 3.345 4.319 0.019 27 0 "[ . 1 . 2 . 3]" 1
372 1 1 PHE QB 1 32 GLN QE 3.000 . 4.100 2.889 1.855 4.462 0.362 12 0 "[ . 1 . 2 . 3]" 1
373 1 10 CYS QB 1 32 GLN QE 5.400 . 6.000 2.944 1.684 4.124 0.116 12 0 "[ . 1 . 2 . 3]" 1
374 1 9 CYS QB 1 32 GLN QE 5.100 . 6.000 2.821 1.684 3.644 0.116 12 0 "[ . 1 . 2 . 3]" 1
375 1 9 CYS QB 1 32 GLN QE 2.800 . 3.800 2.838 1.855 4.261 0.461 12 0 "[ . 1 . 2 . 3]" 1
376 1 10 CYS QB 1 32 GLN QE 5.800 . 6.000 2.964 1.684 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 2 LEU QD 1 32 GLN QE 2.800 . 3.800 2.291 1.797 3.007 0.003 23 0 "[ . 1 . 2 . 3]" 1
378 1 7 THR MG 1 32 GLN QE 3.700 . 5.400 3.132 1.890 4.152 0.110 10 0 "[ . 1 . 2 . 3]" 1
379 1 7 THR MG 1 32 GLN QE 5.100 . 6.000 3.132 1.890 4.152 0.010 10 0 "[ . 1 . 2 . 3]" 1
380 1 2 LEU QB 1 32 GLN QE 3.000 . 4.200 3.186 1.890 4.436 0.236 24 0 "[ . 1 . 2 . 3]" 1
381 1 2 LEU H 1 49 GLN QE 4.800 . 6.000 2.478 1.886 3.170 0.014 15 0 "[ . 1 . 2 . 3]" 1
382 1 22 LEU HA 1 49 GLN QE 5.500 . 6.000 4.319 3.529 5.160 . 0 0 "[ . 1 . 2 . 3]" 1
383 1 2 LEU QD 1 49 GLN QE 4.500 . 6.000 2.729 1.963 3.878 0.037 17 0 "[ . 1 . 2 . 3]" 1
384 1 2 LEU QD 1 49 GLN QE 4.200 . 6.000 2.729 1.963 3.875 0.037 17 0 "[ . 1 . 2 . 3]" 1
385 1 2 LEU HA 1 57 GLN QE 3.800 . 5.600 4.321 3.534 5.049 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 4 PRO QB 1 57 GLN QE 2.500 . 3.300 2.976 1.792 4.594 1.294 12 4 "[ . 1-+ . * 2 . *]" 1
387 1 2 LEU QD 1 80 ASN QD 5.100 . 6.000 4.508 2.373 5.222 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 2 LEU HA 1 58 ASN QD 3.800 . 5.600 3.079 2.123 3.686 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 16 LYS QB 1 58 ASN QD 2.900 . 4.000 4.099 3.363 4.639 0.639 18 6 "[ * .-* 1 . + 2 * * 3]" 1
390 1 18 LEU QD 1 58 ASN QD 2.700 . 3.600 4.682 3.136 5.316 1.716 25 26 "[-** ***************2*** +*** *]" 1
391 1 2 LEU HA 1 63 GLN QE 2.800 . 3.800 3.185 2.289 4.540 0.740 12 1 "[ . 1 + . 2 . 3]" 1
392 1 22 LEU HA 1 63 GLN QE 2.900 . 3.900 4.367 3.667 5.289 1.389 12 14 "[ * *-* **1*+ *.** * .* *3]" 1
393 1 23 LEU QD 1 63 GLN QE 2.900 . 3.800 4.423 2.426 5.092 1.292 12 21 "[** -* ***1 + *** * *** *** ***]" 1
394 1 1 PHE QD 1 68 GLN QE 5.000 . 6.000 2.946 1.813 4.433 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 1 PHE QB 1 68 GLN QE 5.300 . 6.000 3.514 2.495 4.370 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 3 LEU HG 1 68 GLN QE 5.600 . 6.000 3.557 1.892 4.246 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 3 LEU H 1 80 ASN QD 3.600 . 5.200 3.272 1.934 4.234 0.066 5 0 "[ . 1 . 2 . 3]" 1
398 1 7 THR HA 1 80 ASN QD 2.900 . 3.900 4.061 2.961 5.411 1.511 11 10 "[ * *. - 1+** . **2* *. 3]" 1
399 1 7 THR HA 1 12 GLN QE 4.200 . 6.000 3.521 2.917 4.202 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 3 LEU HG 1 57 GLN QE 3.000 . 4.200 4.098 3.008 5.015 0.815 11 4 "[ * .- 1+ . * 2 . 3]" 1
401 1 2 LEU QB 1 57 GLN QE 3.200 . 4.500 4.032 2.891 4.791 0.291 4 0 "[ . 1 . 2 . 3]" 1
402 1 1 PHE QD 1 73 HIS H 5.100 . 6.000 4.888 2.334 5.686 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 7 THR H 1 62 SER H 4.700 . 6.000 4.767 4.606 4.923 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 12 GLN QE 1 27 ILE H 4.600 . 6.000 5.036 4.575 5.533 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 14 TYR QD 1 64 TRP HE1 4.700 . 6.000 5.034 4.681 5.211 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 1 PHE HA 1 64 TRP HE1 4.100 . 6.000 5.377 5.174 5.571 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 5 PRO QD 1 64 TRP HE1 2.900 . 4.000 4.981 4.637 5.615 1.615 17 30 [****************+********-****] 1
408 1 5 PRO QB 1 64 TRP HE1 3.900 . 5.800 3.347 2.817 4.211 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 4 PRO QB 1 64 TRP HE1 4.700 . 6.000 3.291 2.923 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 16 LYS QB 1 64 TRP HE1 2.700 . 3.600 4.013 2.208 4.483 0.883 29 21 "[** ****- * ** .* * *****. **+*]" 1
411 1 2 LEU QB 1 64 TRP HE1 2.700 . 3.600 4.480 4.043 4.912 1.312 19 29 "[*- ***************+***********]" 1
412 1 2 LEU QD 1 64 TRP HE1 2.300 . 3.000 2.254 1.872 2.693 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 18 LEU QD 1 64 TRP HE1 2.300 . 3.000 2.004 1.693 2.521 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 23 LEU QD 1 64 TRP HE1 2.500 . 3.300 2.379 1.875 3.516 0.216 9 0 "[ . 1 . 2 . 3]" 1
415 1 12 GLN QE 1 47 LEU H 5.500 . 6.000 5.285 4.492 5.673 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 12 GLN QE 1 47 LEU H 5.500 . 6.000 4.719 4.287 4.967 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 21 LYS H 1 66 GLU H 3.600 . 5.200 2.532 2.405 2.689 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 2 LEU QD 1 11 THR H 5.500 . 6.000 4.343 3.768 4.818 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 1 PHE QD 1 72 LEU H 5.000 . 6.000 4.911 4.355 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 1 PHE QD 1 70 ARG H 6.000 . 6.000 4.416 3.221 5.263 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 27 ILE H 1 47 LEU H 4.400 . 6.000 4.486 4.309 4.772 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 1 PHE QD 1 31 LEU H 3.100 . 4.300 5.377 4.118 5.960 1.660 3 24 "[**+**** ********* * -*.*****]" 1
423 1 12 GLN QE 1 31 LEU H 5.000 . 6.000 5.230 4.585 5.586 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 9 CYS HA 1 47 LEU H 5.000 . 6.000 5.706 5.570 5.831 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 7 THR HA 1 68 GLN H 3.100 . 4.300 3.322 3.116 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 12 GLN QE 1 31 LEU QD 4.300 . 6.000 4.308 3.873 4.629 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 12 GLN QE 1 18 LEU QD 4.300 . 6.000 2.725 1.961 3.893 0.039 17 0 "[ . 1 . 2 . 3]" 1
428 1 4 PRO QB 1 12 GLN QE 4.300 . 6.000 3.217 1.666 3.629 0.234 13 0 "[ . 1 . 2 . 3]" 1
429 1 66 GLU H 1 69 GLU H 3.700 . 5.400 2.644 2.551 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 30 GLU H 1 44 VAL H 3.800 . 5.600 3.451 3.014 3.755 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 85 ARG H 1 85 ARG HA 1.900 . 2.400 2.808 2.243 2.930 0.530 25 3 "[ . 1 * . - 2 + 3]" 1
432 1 85 ARG HA 1 86 LYS H 1.900 . 2.400 2.019 1.910 2.547 0.147 10 0 "[ . 1 . 2 . 3]" 1
433 1 78 LYS HA 1 79 LEU H 2.000 . 2.500 2.242 2.093 2.446 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 71 LYS HA 1 72 LEU H 2.500 . 3.300 2.206 2.140 2.665 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 70 ARG HA 1 71 LYS H 2.600 . 3.400 2.659 2.576 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 68 GLN HA 1 71 LYS H 2.500 . 3.300 3.051 2.565 3.376 0.076 11 0 "[ . 1 . 2 . 3]" 1
437 1 68 GLN HA 1 69 GLU H 2.700 . 3.600 2.689 2.664 2.711 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 22 LEU H 1 24 ARG H 3.700 . 5.400 3.833 3.741 3.947 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 19 SER QB 1 20 ASP H 2.900 . 3.900 2.547 2.466 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 17 PRO HA 1 18 LEU H 2.500 . 3.300 2.121 2.072 2.237 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 12 GLN QB 1 13 LEU H 2.800 . 3.800 2.323 2.163 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 5 PRO HA 1 6 SER H 2.200 . 2.800 1.975 1.944 2.616 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 83 MET ME 1 85 ARG HA 3.600 . 5.200 5.001 2.517 6.028 0.828 17 9 "[ *. * 1 * -* + * * . *3]" 1
444 1 2 LEU HA 1 83 MET ME 3.800 . 5.600 2.912 1.875 4.025 0.125 5 0 "[ . 1 . 2 . 3]" 1
445 1 12 GLN QE 1 83 MET ME 2.100 . 2.600 3.496 2.093 4.149 1.549 26 24 "[*** ******* *** *-*** *.+****]" 1
446 1 14 TYR QD 1 83 MET ME 2.300 . 3.000 2.471 1.453 3.610 0.610 6 1 "[ .+ 1 . 2 . 3]" 1
447 1 1 PHE QD 1 83 MET ME 3.900 . 5.800 2.763 1.454 3.889 0.546 22 1 "[ . 1 . 2 + . 3]" 1
448 1 3 LEU H 1 83 MET ME 4.600 . 6.000 4.279 3.281 5.252 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 21 LYS H 1 83 MET ME 4.200 . 6.000 3.596 1.955 4.208 0.045 25 0 "[ . 1 . 2 . 3]" 1
450 1 7 THR H 1 83 MET ME 3.700 . 5.400 3.795 3.021 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 2 LEU H 1 86 LYS QB 4.200 . 6.000 3.411 2.762 3.738 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 16 LYS QE 1 21 LYS H 4.800 . 6.000 3.799 3.503 4.160 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 16 LYS QE 1 25 LYS H 4.200 . 6.000 3.908 3.332 4.720 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 9 CYS QB 1 16 LYS QD 1.500 . 2.200 1.511 1.487 1.535 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 16 LYS QD 1 19 SER H 4.100 . 6.000 4.093 3.046 4.921 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 16 LYS QB 1 71 LYS QG 1.900 . 2.400 1.796 1.712 1.850 . 0 0 "[ . 1 . 2 . 3]" 1
457 1 3 LEU HG 1 71 LYS QG 1.700 . 2.200 1.690 1.601 1.724 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 2 LEU QD 1 71 LYS QG 3.900 . 5.800 3.129 2.025 3.854 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 9 CYS QB 1 71 LYS QG 2.100 . 2.700 2.092 1.911 2.383 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 22 LEU HA 1 71 LYS QG 3.000 . 4.200 3.721 3.195 4.479 0.279 11 0 "[ . 1 . 2 . 3]" 1
461 1 7 THR HA 1 25 LYS QG 2.700 . 3.600 2.501 2.098 2.910 . 0 0 "[ . 1 . 2 . 3]" 1
462 1 7 THR HA 1 71 LYS QG 2.300 . 3.000 2.208 1.952 2.499 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 3 LEU H 1 25 LYS QG 3.100 . 4.300 2.752 1.864 3.656 0.036 29 0 "[ . 1 . 2 . 3]" 1
464 1 3 LEU H 1 71 LYS QG 3.000 . 4.100 2.901 1.888 4.051 0.012 28 0 "[ . 1 . 2 . 3]" 1
465 1 3 LEU H 1 85 ARG HA 1.900 . 2.400 2.262 2.063 2.825 0.425 23 0 "[ . 1 . 2 . 3]" 1
466 1 7 THR H 1 85 ARG QD 3.900 . 5.800 3.977 3.396 4.506 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 4 PRO QB 1 85 ARG QB 1.900 . 2.300 4.164 2.417 5.290 2.990 30 29 "[**************** *****-******+]" 1
468 1 1 PHE QD 1 85 ARG QG 2.300 . 3.000 2.956 2.020 3.837 0.837 30 10 "[ - . ** 1 * . * *2 **.* +]" 1
469 1 3 LEU HG 1 35 ASP H 2.200 . 2.800 1.970 1.604 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 3 LEU H 1 27 ILE QG 3.300 . 4.600 3.863 2.199 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 2 LEU HG 1 3 LEU H 3.800 . 5.600 3.011 1.889 3.733 0.111 9 0 "[ . 1 . 2 . 3]" 1
472 1 7 THR H 1 84 LEU HA 2.100 . 2.600 2.703 2.193 2.814 0.214 4 0 "[ . 1 . 2 . 3]" 1
473 1 2 LEU QD 1 3 LEU QB 1.800 . 2.200 1.639 1.469 1.683 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 4 PRO QD 1 22 LEU QB 3.500 . 5.000 3.468 3.145 4.023 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 7 THR HA 1 72 LEU QB 2.100 . 2.700 2.069 1.959 2.194 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 2 LEU QB 1 84 LEU QD 1.800 . 2.200 1.694 1.429 1.745 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 1 PHE QB 1 84 LEU QD 3.800 . 5.600 3.070 1.832 4.000 0.168 25 0 "[ . 1 . 2 . 3]" 1
478 1 12 GLN QE 1 84 LEU QD 2.100 . 2.700 2.775 1.924 3.614 0.914 11 7 "[ - *. * 1+ . * * . * 3]" 1
479 1 1 PHE QD 1 84 LEU QD 3.300 . 4.600 1.997 1.727 2.354 0.273 11 0 "[ . 1 . 2 . 3]" 1
480 1 19 SER H 1 84 LEU QD 2.900 . 4.000 2.812 1.669 3.559 0.131 12 0 "[ . 1 . 2 . 3]" 1
481 1 37 ASP QB 1 83 MET HA 3.000 . 4.100 3.131 2.127 3.499 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 4 PRO QG 1 83 MET HA 2.100 . 2.700 2.173 2.026 2.407 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 4 PRO QD 1 83 MET HA 3.500 . 5.100 4.072 3.765 4.516 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 35 ASP H 1 83 MET HA 2.300 . 3.000 2.649 2.132 2.762 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 35 ASP H 1 83 MET QB 3.100 . 4.300 2.486 1.888 2.992 0.012 26 0 "[ . 1 . 2 . 3]" 1
486 1 35 ASP H 1 83 MET QB 2.700 . 3.600 2.486 1.888 2.992 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 4 PRO QG 1 83 MET HG2 2.400 . 3.100 2.137 2.033 2.307 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 4 PRO QG 1 83 MET HG3 2.400 . 3.100 2.124 2.025 2.283 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 3 LEU HG 1 83 MET HG3 4.000 . 6.000 3.674 1.894 4.850 0.106 24 0 "[ . 1 . 2 . 3]" 1
490 1 2 LEU QB 1 83 MET HG2 4.900 . 6.000 3.732 2.405 5.337 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 2 LEU QD 1 83 MET HG2 5.100 . 6.000 3.700 1.780 5.317 0.020 25 0 "[ . 1 . 2 . 3]" 1
492 1 2 LEU QD 1 83 MET HG3 4.200 . 6.000 3.849 1.884 5.402 0.116 28 0 "[ . 1 . 2 . 3]" 1
493 1 35 ASP H 1 83 MET HG2 3.800 . 5.600 2.929 1.996 3.822 0.004 24 0 "[ . 1 . 2 . 3]" 1
494 1 35 ASP H 1 83 MET HG3 3.000 . 4.100 2.926 1.892 4.069 0.008 19 0 "[ . 1 . 2 . 3]" 1
495 1 2 LEU QD 1 83 MET ME 3.300 . 4.600 2.401 1.852 3.239 0.148 17 0 "[ . 1 . 2 . 3]" 1
496 1 18 LEU QD 1 83 MET ME 3.400 . 4.900 2.269 1.812 2.686 0.088 17 0 "[ . 1 . 2 . 3]" 1
497 1 31 LEU QD 1 83 MET ME 2.200 . 2.800 3.173 1.977 4.193 1.393 7 14 "[ * **+ *1- .* **2 * ** * *]" 1
498 1 2 LEU HA 1 82 GLY QA 3.800 . 5.600 3.704 3.432 3.908 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 7 THR H 1 82 GLY QA 2.600 . 3.400 3.312 2.729 4.334 0.934 26 3 "[ . 1 . 2 * -+ 3]" 1
500 1 2 LEU QB 1 81 PHE HA 3.200 . 4.400 3.733 1.980 4.629 0.229 2 0 "[ . 1 . 2 . 3]" 1
501 1 2 LEU QD 1 81 PHE HA 3.400 . 4.800 3.316 2.126 4.815 0.015 30 0 "[ . 1 . 2 . 3]" 1
502 1 2 LEU H 1 81 PHE HA 2.800 . 3.800 3.100 2.172 3.456 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 23 LEU QD 1 81 PHE QB 2.300 . 3.000 4.442 3.578 5.568 2.568 26 30 [******************-******+****] 1
504 1 2 LEU QD 1 14 TYR QB 3.400 . 4.800 2.395 1.863 2.964 0.137 25 0 "[ . 1 . 2 . 3]" 1
505 1 2 LEU QD 1 81 PHE QB 3.000 . 4.100 2.578 1.881 3.596 0.019 25 0 "[ . 1 . 2 . 3]" 1
506 1 14 TYR QB 1 16 LYS QB 3.900 . 5.800 2.837 2.518 3.222 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 3 LEU HG 1 81 PHE QB 3.300 . 4.600 3.047 1.818 3.869 0.182 4 0 "[ . 1 . 2 . 3]" 1
508 1 9 CYS QB 1 81 PHE HB2 1.500 . 2.200 1.757 1.749 1.764 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 1 PHE QB 1 81 PHE HB3 1.500 . 2.200 1.751 1.688 1.764 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 4 PRO QD 1 81 PHE QB 4.100 . 6.000 4.152 3.753 4.488 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 7 THR HA 1 9 CYS QB 3.600 . 5.200 3.576 2.742 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 2 LEU QD 1 9 CYS QB 4.300 . 6.000 3.967 3.301 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 2 LEU QD 1 79 LEU QB 2.100 . 2.700 1.926 1.851 2.074 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 18 LEU QD 1 79 LEU QB 2.700 . 3.600 1.924 1.851 2.072 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 4 PRO QB 1 22 LEU QD 3.100 . 4.300 2.601 1.713 3.176 0.187 2 0 "[ . 1 . 2 . 3]" 1
516 1 1 PHE QB 1 79 LEU QD 3.200 . 4.500 2.958 1.923 4.606 0.106 14 0 "[ . 1 . 2 . 3]" 1
517 1 12 GLN QE 1 22 LEU QD 5.100 . 6.000 3.262 2.039 4.194 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 14 TYR QD 1 79 LEU QD 3.000 . 4.100 2.361 1.720 3.654 0.180 28 0 "[ . 1 . 2 . 3]" 1
519 1 22 LEU QD 1 24 ARG H 4.300 . 6.000 3.474 3.196 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 21 LYS H 1 22 LEU QD 2.300 . 3.000 2.298 1.796 3.012 0.012 19 0 "[ . 1 . 2 . 3]" 1
521 1 3 LEU H 1 79 LEU QD 3.100 . 4.300 2.857 2.121 3.357 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 7 THR H 1 79 LEU QD 4.100 . 6.000 2.683 1.808 3.446 0.192 15 0 "[ . 1 . 2 . 3]" 1
523 1 2 LEU H 1 22 LEU QD 3.600 . 5.200 2.735 1.745 3.299 0.255 12 0 "[ . 1 . 2 . 3]" 1
524 1 1 PHE QD 1 79 LEU QD 3.300 . 4.600 2.286 1.614 3.315 0.386 23 0 "[ . 1 . 2 . 3]" 1
525 1 4 PRO QG 1 79 LEU QD 3.400 . 4.900 3.557 1.887 5.309 0.409 2 0 "[ . 1 . 2 . 3]" 1
526 1 4 PRO QB 1 79 LEU QD 2.400 . 3.100 2.419 1.849 3.432 0.332 17 0 "[ . 1 . 2 . 3]" 1
527 1 19 SER H 1 78 LYS HA 2.000 . 2.500 2.337 2.151 2.616 0.116 25 0 "[ . 1 . 2 . 3]" 1
528 1 3 LEU H 1 78 LYS HA 2.500 . 3.300 2.739 2.496 2.909 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 16 LYS QB 1 37 ASP HA 2.100 . 2.600 2.101 1.996 2.174 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 8 ALA MB 1 71 LYS QB 1.900 . 2.400 1.755 1.701 1.798 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 9 CYS QB 1 68 GLN QG 2.900 . 3.900 1.856 1.598 3.009 0.302 26 0 "[ . 1 . 2 . 3]" 1
532 1 9 CYS QB 1 21 LYS QB 3.500 . 5.100 2.097 1.638 3.021 0.262 14 0 "[ . 1 . 2 . 3]" 1
533 1 3 LEU H 1 68 GLN QG 2.400 . 3.100 2.311 2.176 2.595 . 0 0 "[ . 1 . 2 . 3]" 1
534 1 3 LEU H 1 71 LYS QB 2.400 . 3.100 2.314 2.176 2.598 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 35 ASP H 1 68 GLN QG 2.600 . 3.400 1.815 1.604 2.217 0.196 22 0 "[ . 1 . 2 . 3]" 1
536 1 35 ASP H 1 71 LYS QB 2.700 . 3.600 1.916 1.634 2.285 0.166 22 0 "[ . 1 . 2 . 3]" 1
537 1 2 LEU QD 1 21 LYS QB 3.000 . 4.100 2.081 1.742 2.464 0.158 15 0 "[ . 1 . 2 . 3]" 1
538 1 16 LYS QD 1 21 LYS H 3.800 . 5.600 3.459 3.097 3.654 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 35 ASP H 1 71 LYS QG 3.700 . 5.400 2.151 1.656 2.786 0.344 5 0 "[ . 1 . 2 . 3]" 1
540 1 3 LEU HG 1 77 PRO HA 3.300 . 4.600 4.024 3.136 4.439 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 3 LEU H 1 77 PRO QD 4.400 . 6.000 3.936 3.511 4.068 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 3 LEU H 1 77 PRO QD 2.800 . 3.800 3.926 3.510 4.061 0.261 7 0 "[ . 1 . 2 . 3]" 1
543 1 5 PRO QB 1 12 GLN QE 3.600 . 5.300 3.275 2.473 3.701 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 3 LEU H 1 77 PRO QB 2.700 . 3.600 2.804 1.837 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 4 PRO QB 1 77 PRO QB 2.000 . 2.500 1.980 1.969 1.988 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 5 PRO QB 1 17 PRO HB3 1.400 . 2.200 1.574 1.570 1.577 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 2 LEU H 1 17 PRO QB 4.000 . 6.000 3.226 2.716 3.555 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 2 LEU QD 1 77 PRO QG 3.900 . 5.800 2.290 1.843 3.118 0.157 6 0 "[ . 1 . 2 . 3]" 1
549 1 2 LEU QB 1 77 PRO QG 4.200 . 6.000 2.730 1.937 3.650 0.063 22 0 "[ . 1 . 2 . 3]" 1
550 1 1 PHE QD 1 77 PRO QG 2.500 . 3.300 4.331 2.330 5.430 2.130 10 23 "[* ******-+ ** * ****** *.****3]" 1
551 1 2 LEU QD 1 7 THR HB 3.700 . 5.500 3.738 3.150 4.195 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 3 LEU HG 1 75 THR HB 3.700 . 5.400 4.198 2.872 4.612 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 3 LEU H 1 7 THR HB 2.200 . 2.800 3.139 1.841 3.562 0.762 3 17 "[ +*. - 1 ********* * * ***3]" 1
554 1 3 LEU HG 1 75 THR HA 3.000 . 4.100 3.775 3.397 4.145 0.045 25 0 "[ . 1 . 2 . 3]" 1
555 1 3 LEU H 1 75 THR HA 2.100 . 2.700 2.215 2.113 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 1 PHE HA 1 7 THR MG 1.800 . 2.200 1.902 1.899 1.904 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 3 LEU HA 1 7 THR MG 3.100 . 4.300 3.424 3.075 3.646 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 2 LEU HA 1 7 THR MG 1.900 . 2.400 2.032 1.980 2.082 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 7 THR MG 1 9 CYS QB 4.000 . 6.000 3.357 2.490 3.866 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 4 PRO QB 1 7 THR MG 3.800 . 5.600 2.801 1.933 3.513 0.067 14 0 "[ . 1 . 2 . 3]" 1
561 1 1 PHE QB 1 7 THR MG 4.100 . 6.000 2.970 1.673 4.263 0.327 26 0 "[ . 1 . 2 . 3]" 1
562 1 3 LEU H 1 7 THR MG 2.600 . 3.400 2.913 2.430 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 7 THR MG 1 35 ASP H 2.700 . 3.600 2.859 2.491 3.835 0.235 20 0 "[ . 1 . 2 . 3]" 1
564 1 7 THR MG 1 22 LEU HA 2.600 . 3.500 3.956 3.449 4.757 1.257 20 11 "[ -**.* 1* * . * + * . * *]" 1
565 1 4 PRO QD 1 7 THR MG 3.600 . 5.200 3.317 2.576 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 4 PRO QD 1 7 THR MG 3.800 . 5.600 3.314 2.576 3.664 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 7 THR MG 1 19 SER QB 2.200 . 2.800 3.999 3.571 4.827 2.027 20 30 [*******************+-*********] 1
568 1 7 THR MG 1 74 GLY QA 4.100 . 6.000 4.000 3.571 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 2 LEU QD 1 74 GLY QA 2.800 . 3.800 3.675 2.405 4.560 0.760 20 6 "[ * * 1 . +- .* *]" 1
570 1 2 LEU QD 1 73 HIS QB 2.300 . 2.900 4.107 3.682 4.359 1.459 1 30 [+****-************************] 1
571 1 35 ASP H 1 72 LEU QB 2.400 . 3.100 2.374 2.024 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 35 ASP H 1 72 LEU QB 2.500 . 3.300 2.819 2.588 3.002 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 2 LEU QD 1 72 LEU QB 2.500 . 3.300 1.940 1.633 2.073 0.067 3 0 "[ . 1 . 2 . 3]" 1
574 1 22 LEU HA 1 72 LEU QD 3.300 . 4.700 2.381 1.853 3.144 0.047 1 0 "[ . 1 . 2 . 3]" 1
575 1 4 PRO QB 1 18 LEU QD 3.400 . 4.900 2.738 2.069 3.304 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 5 PRO QB 1 18 LEU QD 3.400 . 4.900 2.353 1.653 2.876 0.247 2 0 "[ . 1 . 2 . 3]" 1
577 1 9 CYS QB 1 18 LEU QD 4.000 . 6.000 3.281 1.889 4.075 0.111 25 0 "[ . 1 . 2 . 3]" 1
578 1 1 PHE QB 1 18 LEU QD 3.700 . 5.400 2.653 1.816 3.036 0.184 25 0 "[ . 1 . 2 . 3]" 1
579 1 18 LEU QD 1 22 LEU HA 3.500 . 5.100 2.392 1.853 3.091 0.047 1 0 "[ . 1 . 2 . 3]" 1
580 1 18 LEU QD 1 22 LEU HA 3.400 . 4.800 2.268 1.847 2.879 0.153 1 0 "[ . 1 . 2 . 3]" 1
581 1 12 GLN QE 1 72 LEU QD 2.300 . 3.000 2.035 1.729 2.687 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 8 ALA MB 1 71 LYS HA 2.200 . 2.800 2.420 2.249 2.929 0.129 7 0 "[ . 1 . 2 . 3]" 1
583 1 1 PHE HA 1 2 LEU QD 3.800 . 5.600 3.592 2.860 3.984 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 3 LEU QB 1 70 ARG HA 2.300 . 3.000 2.919 1.881 3.117 0.117 9 0 "[ . 1 . 2 . 3]" 1
585 1 16 LYS QB 1 70 ARG HA 2.000 . 2.500 2.020 1.991 2.047 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 35 ASP H 1 70 ARG HA 2.100 . 2.600 2.338 2.294 2.404 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 22 LEU HA 1 71 LYS QE 3.400 . 4.800 4.122 3.500 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 1 PHE HA 1 71 LYS QE 3.900 . 5.800 3.361 2.158 3.761 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 1 PHE HA 1 71 LYS QE 3.800 . 5.700 3.357 2.158 3.755 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 14 TYR QE 1 71 LYS QE 2.100 . 2.700 2.453 1.901 3.177 0.477 22 0 "[ . 1 . 2 . 3]" 1
591 1 1 PHE HA 1 71 LYS QD 2.800 . 3.800 2.318 1.858 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 14 TYR QE 1 16 LYS QD 4.100 . 6.000 2.272 1.888 3.927 0.112 8 0 "[ . 1 . 2 . 3]" 1
593 1 16 LYS QD 1 25 LYS H 3.500 . 5.000 4.023 3.353 4.355 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 2 LEU QD 1 71 LYS QG 3.700 . 5.400 3.254 2.028 3.939 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 35 ASP H 1 71 LYS QG 2.300 . 3.000 2.173 1.658 2.843 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 1 PHE HA 1 1 PHE QB 2.200 . 2.800 2.321 2.181 2.424 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 1 PHE HA 1 5 PRO QB 3.300 . 4.700 3.862 3.558 4.078 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 18 LEU QD 1 50 ARG QD 3.000 . 4.100 2.374 1.763 3.011 0.137 6 0 "[ . 1 . 2 . 3]" 1
599 1 1 PHE HA 1 24 ARG QD 2.900 . 3.900 3.582 2.957 3.829 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 1 PHE HA 1 24 ARG QB 2.300 . 3.000 1.932 1.925 1.938 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 17 PRO QB 1 69 GLU HA 3.600 . 5.200 3.158 2.945 3.743 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 35 ASP H 1 63 GLN HA 2.400 . 3.100 2.579 2.537 2.619 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 4 PRO QG 1 63 GLN HA 2.100 . 2.700 1.998 1.921 2.082 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 4 PRO QB 1 63 GLN HA 2.500 . 3.300 2.210 2.075 2.538 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 5 PRO QB 1 63 GLN HA 3.000 . 4.100 2.418 2.249 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 30 GLU QG 1 61 LEU QD 2.400 . 3.100 5.358 5.086 5.843 2.743 27 30 [************************-*+***] 1
607 1 22 LEU HA 1 30 GLU QG 2.800 . 3.800 2.219 2.106 2.435 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 22 LEU HA 1 30 GLU QG 3.000 . 4.100 2.239 2.114 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 3 LEU HA 1 33 GLU QG 2.200 . 2.800 3.743 3.446 4.204 1.404 3 30 [**+********************-******] 1
610 1 2 LEU H 1 30 GLU QG 3.000 . 4.100 3.626 3.287 3.798 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 30 GLU QG 1 35 ASP H 3.300 . 4.600 2.206 1.863 2.813 0.137 9 0 "[ . 1 . 2 . 3]" 1
612 1 2 LEU QD 1 49 GLN QB 3.900 . 5.800 3.472 2.199 4.028 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 2 LEU QD 1 49 GLN QB 4.000 . 6.000 3.307 2.184 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 5 PRO QB 1 49 GLN QB 1.900 . 2.400 1.826 1.781 1.857 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 5 PRO QB 1 66 GLU QB 2.100 . 2.600 1.826 1.781 1.857 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 4 PRO QB 1 49 GLN HB3 1.500 . 2.200 1.683 1.677 1.725 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 1 PHE QB 1 49 GLN QB 3.400 . 4.800 3.575 1.844 5.009 0.209 8 0 "[ . 1 . 2 . 3]" 1
618 1 22 LEU HA 1 66 GLU QB 2.200 . 2.500 2.011 1.977 2.066 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 14 TYR QD 1 49 GLN QB 4.200 . 6.000 2.475 1.951 2.944 0.049 5 0 "[ . 1 . 2 . 3]" 1
620 1 1 PHE QD 1 66 GLU QB 3.400 . 4.900 2.555 1.981 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 1 PHE QE 1 49 GLN QB 2.800 . 3.800 3.110 2.322 3.935 0.135 7 0 "[ . 1 . 2 . 3]" 1
622 1 17 PRO QB 1 68 GLN HA 2.600 . 3.500 1.961 1.750 2.051 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 1 PHE HA 1 68 GLN QG 4.200 . 6.000 2.517 2.024 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 2 LEU QD 1 25 LYS QD 3.500 . 5.000 3.685 2.806 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 4 PRO QG 1 25 LYS QD 3.300 . 4.700 2.322 2.249 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 22 LEU HA 1 25 LYS QD 2.900 . 3.900 2.074 1.680 2.319 0.220 26 0 "[ . 1 . 2 . 3]" 1
627 1 2 LEU HA 1 25 LYS QD 3.400 . 4.900 3.641 3.526 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 1 PHE QD 1 25 LYS QD 4.500 . 6.000 2.976 2.673 3.275 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 2 LEU H 1 68 GLN QB 3.100 . 4.300 3.369 2.547 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 2 LEU H 1 25 LYS QD 4.500 . 6.000 3.396 2.549 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 21 LYS H 1 67 HIS HA 2.600 . 3.500 2.728 2.710 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 4 PRO QG 1 67 HIS QB 2.600 . 3.400 3.717 3.559 3.943 0.543 25 1 "[ . 1 . 2 + 3]" 1
633 1 4 PRO QG 1 67 HIS QB 3.700 . 5.400 3.326 3.250 3.460 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 22 LEU HA 1 67 HIS QB 3.500 . 5.000 3.469 3.356 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 1 PHE HA 1 67 HIS QB 3.600 . 5.200 3.470 2.911 3.844 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 1 PHE QB 1 66 GLU HA 3.400 . 4.900 3.519 2.747 3.835 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 4 PRO QG 1 66 GLU QG 2.200 . 2.800 2.044 1.937 2.085 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 1 PHE QB 1 30 GLU QG 4.400 . 6.000 2.436 1.875 2.886 0.125 5 0 "[ . 1 . 2 . 3]" 1
639 1 1 PHE QB 1 66 GLU QG 4.000 . 6.000 2.952 2.324 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 1 PHE QB 1 66 GLU QB 3.300 . 4.700 3.188 2.855 3.411 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 1 PHE QB 1 64 TRP HA 2.600 . 3.500 1.958 1.749 2.112 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 4 PRO QG 1 63 GLN HA 2.200 . 2.800 2.260 2.097 2.366 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 1 PHE QB 1 63 GLN HA 4.300 . 6.000 4.058 3.889 4.214 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 1 PHE QD 1 62 SER HA 3.200 . 4.500 2.577 1.914 3.992 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 4 PRO QG 1 62 SER QB 3.700 . 5.400 3.478 1.756 4.089 0.244 10 0 "[ . 1 . 2 . 3]" 1
646 1 4 PRO QB 1 62 SER QB 4.100 . 6.000 3.572 3.078 4.539 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 28 GLN HA 1 60 SER QB 2.100 . 2.700 4.729 4.291 5.038 2.338 9 30 [*****-**+*********************] 1
648 1 1 PHE QD 1 62 SER QB 3.200 . 4.500 4.155 3.381 5.130 0.630 29 1 "[ . 1 . 2 . +3]" 1
649 1 11 THR MG 1 48 ALA HA 2.300 . 3.000 3.281 2.726 4.055 1.055 27 10 "[ *. ** . * 2 *-** + *3]" 1
650 1 13 LEU QD 1 61 LEU QD 1.600 . 2.200 1.777 1.625 1.886 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 2 LEU QD 1 61 LEU QD 1.600 . 2.200 2.005 1.769 2.339 0.139 2 0 "[ . 1 . 2 . 3]" 1
652 1 18 LEU QD 1 23 LEU QD 1.600 . 2.200 1.780 1.616 2.021 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 4 PRO QB 1 61 LEU QD 3.700 . 5.400 2.574 1.893 3.801 0.107 25 0 "[ . 1 . 2 . 3]" 1
654 1 1 PHE QD 1 61 LEU QD 1.900 . 2.400 2.699 2.050 3.110 0.710 27 9 "[* . *1 * *.* 2- * . +* 3]" 1
655 1 1 PHE QD 1 61 LEU QD 2.000 . 2.500 2.691 2.050 3.098 0.598 27 3 "[ . 1 * . 2 - . + 3]" 1
656 1 2 LEU HA 1 61 LEU QD 2.500 . 3.300 3.748 2.501 3.980 0.680 20 18 "[** *.****1* **.* * +*- .* **3]" 1
657 1 4 PRO QG 1 60 SER HA 3.000 . 4.100 2.903 2.364 3.342 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 4 PRO QB 1 60 SER HA 2.900 . 4.000 3.002 1.896 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 2 LEU QD 1 60 SER HA 2.200 . 2.800 4.293 3.757 4.531 1.731 27 30 [***********************-**+***] 1
660 1 23 LEU QD 1 60 SER HA 4.100 . 6.000 4.132 3.719 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 23 LEU QD 1 60 SER QB 4.500 . 6.000 3.563 3.050 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 18 LEU QD 1 60 SER QB 2.100 . 2.600 3.700 2.174 4.164 1.564 21 29 "[*******************-+** ******]" 1
663 1 4 PRO QB 1 60 SER QB 2.400 . 3.000 2.759 1.975 3.421 0.421 24 0 "[ . 1 . 2 . 3]" 1
664 1 2 LEU QB 1 60 SER QB 4.500 . 6.000 3.361 2.693 3.623 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 29 VAL H 1 59 PRO QD 4.300 . 6.000 2.961 2.680 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 3 LEU H 1 59 PRO QD 4.100 . 6.000 4.178 3.961 4.348 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 15 ARG QD 1 59 PRO QD 4.300 . 6.000 3.338 2.808 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 15 ARG QD 1 59 PRO QD 4.800 . 6.000 3.337 2.808 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 29 VAL H 1 59 PRO QB 4.800 . 6.000 2.838 2.352 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 16 LYS QB 1 59 PRO QB 2.300 . 3.000 4.312 3.521 5.091 2.091 23 30 [**********************+-******] 1
671 1 4 PRO QG 1 28 GLN HA 5.000 . 6.000 3.782 3.664 3.901 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 2 LEU HA 1 58 ASN QB 3.500 . 5.000 3.614 3.184 3.901 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 3 LEU H 1 57 GLN HA 2.800 . 3.800 2.660 2.279 3.296 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 13 LEU QD 1 56 PRO HA 3.400 . 4.900 2.925 2.165 3.465 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 2 LEU QD 1 56 PRO QD 2.200 . 2.800 3.139 2.217 3.960 1.160 22 10 "[ * .- 1 ** **** 2 +* . 3]" 1
676 1 2 LEU HA 1 5 PRO QD 1.800 . 2.200 1.918 1.814 2.164 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 2 LEU QD 1 25 LYS QB 3.400 . 4.800 2.891 1.659 3.294 0.341 26 0 "[ . 1 . 2 . 3]" 1
678 1 2 LEU QD 1 25 LYS QB 3.500 . 5.000 3.138 1.661 3.577 0.339 26 0 "[ . 1 . 2 . 3]" 1
679 1 2 LEU QD 1 15 ARG QB 3.700 . 5.400 2.795 2.086 3.357 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 12 GLN QE 1 56 PRO QB 4.300 . 6.000 2.253 1.661 3.119 0.339 1 0 "[ . 1 . 2 . 3]" 1
681 1 14 TYR QE 1 25 LYS QB 4.300 . 6.000 3.472 1.821 3.714 0.179 18 0 "[ . 1 . 2 . 3]" 1
682 1 14 TYR QE 1 15 ARG QB 4.700 . 6.000 2.330 1.791 2.619 0.209 18 0 "[ . 1 . 2 . 3]" 1
683 1 1 PHE QD 1 28 GLN QB 2.900 . 4.000 2.618 1.981 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 1 PHE QD 1 15 ARG QB 2.900 . 4.000 2.475 1.967 2.987 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 15 ARG QB 1 28 GLN H 3.500 . 5.100 2.419 1.765 2.673 0.135 1 0 "[ . 1 . 2 . 3]" 1
686 1 15 ARG QB 1 29 VAL H 2.900 . 4.000 2.617 2.404 3.028 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 5 PRO QD 1 28 GLN QB 3.800 . 5.600 2.441 2.380 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 1 PHE QB 1 50 ARG QB 2.500 . 3.300 2.326 2.026 2.713 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 4 PRO QG 1 15 ARG QB 1.600 . 2.200 1.568 1.560 1.571 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 2 LEU QD 1 25 LYS QB 3.100 . 4.300 2.210 1.563 2.777 0.337 26 0 "[ . 1 . 2 . 3]" 1
691 1 13 LEU QD 1 56 PRO QG 4.100 . 6.000 3.201 2.311 3.707 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 15 ARG QB 1 56 PRO HG3 1.800 . 2.200 1.773 1.769 1.775 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 4 PRO QG 1 56 PRO QG 2.900 . 3.900 1.971 1.951 1.980 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 12 GLN QE 1 24 ARG QG 3.700 . 5.400 2.633 1.877 3.760 0.123 23 0 "[ . 1 . 2 . 3]" 1
695 1 12 GLN QE 1 15 ARG QG 4.000 . 6.000 2.650 1.877 3.863 0.123 23 0 "[ . 1 . 2 . 3]" 1
696 1 12 GLN H 1 24 ARG QG 2.500 . 3.300 2.122 1.660 2.375 0.040 17 0 "[ . 1 . 2 . 3]" 1
697 1 2 LEU QD 1 81 PHE QD 2.300 . 3.000 2.385 1.761 3.080 0.080 30 0 "[ . 1 . 2 . 3]" 1
698 1 2 LEU QD 1 43 PHE QE 3.100 . 4.300 2.137 1.641 2.480 0.259 11 0 "[ . 1 . 2 . 3]" 1
699 1 9 CYS QB 1 15 ARG HA 2.900 . 3.900 2.204 1.866 2.374 0.034 29 0 "[ . 1 . 2 . 3]" 1
700 1 4 PRO QB 1 55 HIS HA 2.500 . 3.300 1.956 1.860 2.167 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 2 LEU QB 1 15 ARG HA 2.200 . 2.800 2.158 2.109 2.303 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 7 THR MG 1 55 HIS HA 2.200 . 2.800 3.272 2.518 3.631 0.831 17 19 "[** ** *** **.*+ *2* -**** *]" 1
703 1 2 LEU QD 1 55 HIS HA 2.000 . 2.500 2.385 1.851 3.114 0.614 22 4 "[ * . 1 . - 2 +* . 3]" 1
704 1 5 PRO QD 1 55 HIS HA 3.800 . 5.600 1.957 1.860 2.170 0.140 2 0 "[ . 1 . 2 . 3]" 1
705 1 1 PHE QD 1 15 ARG HA 3.900 . 5.800 3.073 2.125 4.267 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 3 LEU HG 1 54 ILE HB 3.100 . 4.300 3.371 2.456 3.848 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 3 LEU HG 1 54 ILE MG 3.000 . 4.100 3.807 2.734 4.188 0.088 12 0 "[ . 1 . 2 . 3]" 1
708 1 30 GLU HA 1 54 ILE MG 3.500 . 5.000 2.753 2.505 3.163 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 2 LEU H 1 54 ILE MG 2.600 . 3.400 2.458 2.254 2.737 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 11 THR H 1 54 ILE MG 2.400 . 3.100 5.016 4.698 5.194 2.094 3 30 [**+***********-***************] 1
711 1 23 LEU QD 1 54 ILE MD 1.700 . 2.200 2.350 1.887 2.878 0.678 17 3 "[ . 1 . + 2 * . - 3]" 1
712 1 31 LEU QD 1 54 ILE MD 2.000 . 2.500 2.383 1.894 2.930 0.430 17 0 "[ . 1 . 2 . 3]" 1
713 1 18 LEU QD 1 54 ILE MD 2.100 . 2.700 2.040 1.704 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 3 LEU HG 1 54 ILE MD 2.500 . 3.300 2.719 2.246 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 2 LEU QB 1 54 ILE MD 3.100 . 4.300 2.754 2.237 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 8 ALA MB 1 54 ILE MD 4.200 . 6.000 2.918 2.247 3.376 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 16 LYS QB 1 54 ILE MD 2.600 . 3.400 2.433 1.884 3.871 0.471 24 0 "[ . 1 . 2 . 3]" 1
718 1 1 PHE QB 1 54 ILE MD 1.800 . 2.200 3.054 2.411 3.309 1.109 18 26 "[*** ************ +*2**-*** ***]" 1
719 1 15 ARG QD 1 54 ILE MD 4.500 . 6.000 3.259 2.441 3.601 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 9 CYS QB 1 54 ILE MD 2.400 . 3.100 4.221 3.765 4.558 1.458 23 30 [***-******************+*******] 1
721 1 3 LEU HA 1 54 ILE MD 2.300 . 2.900 3.576 3.078 3.987 1.087 4 23 "[* *+** ***-**** ***** ***** 3]" 1
722 1 2 LEU HA 1 54 ILE MD 4.000 . 6.000 3.994 3.666 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 14 TYR QD 1 54 ILE MD 3.300 . 4.600 4.112 3.425 4.638 0.038 27 0 "[ . 1 . 2 . 3]" 1
724 1 14 TYR QE 1 54 ILE MD 2.300 . 3.000 5.509 4.731 6.009 3.009 27 30 [*****************-********+***] 1
725 1 27 ILE H 1 54 ILE MD 2.500 . 3.300 4.432 3.854 5.105 1.805 29 30 [****-***********************+*] 1
726 1 2 LEU QD 1 53 CYS HA 3.500 . 5.000 2.077 1.750 2.738 0.250 13 0 "[ . 1 . 2 . 3]" 1
727 1 11 THR H 1 52 ILE HA 2.500 . 3.300 2.239 2.163 2.319 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 29 VAL H 1 52 ILE HA 3.000 . 4.100 2.947 2.937 2.954 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 1 PHE QB 1 52 ILE HB 2.200 . 2.800 4.465 4.179 4.687 1.887 30 30 [*************************-***+] 1
730 1 5 PRO QD 1 52 ILE HB 4.300 . 6.000 2.211 1.781 3.223 0.219 7 0 "[ . 1 . 2 . 3]" 1
731 1 4 PRO QD 1 52 ILE HB 3.600 . 5.300 2.212 1.781 3.226 0.119 7 0 "[ . 1 . 2 . 3]" 1
732 1 3 LEU HA 1 52 ILE HB 2.400 . 3.100 2.271 2.095 2.337 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 3 LEU QB 1 28 GLN HA 3.200 . 4.500 5.053 4.398 5.463 0.963 22 19 "[** ***** 1* **.* -** +* .* **]" 1
734 1 3 LEU H 1 52 ILE HB 2.500 . 3.300 2.677 2.311 3.089 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 11 THR H 1 52 ILE HB 3.700 . 5.400 3.938 3.777 4.102 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 29 VAL H 1 52 ILE HB 2.900 . 4.000 2.646 2.550 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 2 LEU QD 1 40 LEU HG 1.700 . 2.200 1.616 1.612 1.619 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 18 LEU QD 1 52 ILE QG 2.400 . 3.100 2.035 1.830 2.162 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 3 LEU HA 1 52 ILE QG 3.700 . 5.400 2.424 2.288 2.487 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 14 TYR QD 1 40 LEU HG 3.500 . 5.000 2.717 1.650 3.661 0.350 1 0 "[ . 1 . 2 . 3]" 1
741 1 11 THR H 1 52 ILE QG 4.500 . 6.000 4.022 3.879 4.101 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 2 LEU H 1 40 LEU HG 4.400 . 6.000 3.438 2.335 4.253 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 2 LEU QD 1 52 ILE MG 2.000 . 2.500 1.771 1.563 2.057 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 3 LEU HG 1 52 ILE MG 1.900 . 2.300 3.685 3.279 3.921 1.621 3 30 [**+*************-*************] 1
745 1 4 PRO QB 1 52 ILE MG 2.400 . 3.100 3.547 3.022 3.877 0.777 1 12 "[+** * ** - *. *2* .* * 3]" 1
746 1 52 ILE MG 1 54 ILE HA 3.600 . 5.200 4.256 3.829 4.726 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 43 PHE HA 1 52 ILE MG 4.300 . 6.000 3.898 3.658 4.027 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 14 TYR QD 1 52 ILE MG 3.100 . 4.300 2.955 2.331 3.336 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 27 ILE H 1 52 ILE MG 2.400 . 3.100 4.215 3.916 4.479 1.379 29 30 [***********-****************+*] 1
750 1 1 PHE QB 1 52 ILE MD 2.400 . 3.100 3.230 2.412 3.770 0.670 15 3 "[ . 1 + * - . 3]" 1
751 1 2 LEU QB 1 51 SER HA 4.100 . 6.000 3.649 3.247 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 31 LEU QD 1 51 SER HA 2.400 . 3.100 3.732 3.340 4.359 1.259 29 24 "[** *. ****** *.******** **-*+*]" 1
753 1 31 LEU QD 1 51 SER QB 1.900 . 2.400 2.350 1.858 3.129 0.729 29 5 "[ . 1 * .* * 2 - . +3]" 1
754 1 2 LEU QD 1 51 SER QB 4.200 . 6.000 2.228 1.746 2.859 0.254 3 0 "[ . 1 . 2 . 3]" 1
755 1 2 LEU QD 1 51 SER QB 4.500 . 6.000 2.230 1.746 2.869 0.154 3 0 "[ . 1 . 2 . 3]" 1
756 1 2 LEU QB 1 51 SER QB 4.200 . 6.000 2.425 1.778 3.504 0.222 25 0 "[ . 1 . 2 . 3]" 1
757 1 2 LEU QB 1 51 SER QB 3.900 . 5.800 2.425 1.778 3.504 0.222 25 0 "[ . 1 . 2 . 3]" 1
758 1 29 VAL H 1 51 SER QB . . 3.400 2.942 2.523 3.216 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 18 LEU QD 1 50 ARG QD 3.800 . 5.600 2.372 1.763 3.008 0.237 6 0 "[ . 1 . 2 . 3]" 1
760 1 13 LEU H 1 24 ARG QD 4.200 . 6.000 4.387 3.220 5.392 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 1 PHE QE 1 15 ARG QB 4.000 . 6.000 2.476 1.967 3.000 0.033 11 0 "[ . 1 . 2 . 3]" 1
762 1 13 LEU H 1 50 ARG QB 3.300 . 4.600 2.360 2.058 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 4 PRO HA 1 40 LEU HG 3.800 . 5.600 3.110 2.331 3.436 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 2 LEU HA 1 41 GLN QG 3.100 . 4.300 2.815 2.404 3.287 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 12 GLN QE 1 41 GLN QG 3.400 . 4.900 2.123 1.892 2.378 0.008 3 0 "[ . 1 . 2 . 3]" 1
766 1 12 GLN QE 1 49 GLN QG 2.300 . 3.000 2.371 2.081 2.717 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 1 PHE QE 1 49 GLN QB 4.200 . 6.000 3.110 2.322 3.935 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 2 LEU QD 1 48 ALA MB 3.400 . 4.800 2.250 1.889 2.881 0.111 20 0 "[ . 1 . 2 . 3]" 1
769 1 2 LEU QD 1 48 ALA MB 2.200 . 2.800 2.455 1.714 2.816 0.016 16 0 "[ . 1 . 2 . 3]" 1
770 1 16 LYS QB 1 48 ALA MB 2.700 . 3.600 3.690 3.436 3.950 0.350 17 0 "[ . 1 . 2 . 3]" 1
771 1 30 GLU HA 1 48 ALA MB 3.900 . 5.800 4.063 3.704 4.173 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 1 PHE QE 1 48 ALA MB 3.500 . 5.100 4.475 3.611 4.820 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 2 LEU QD 1 47 LEU HG 3.100 . 4.300 1.787 1.301 2.330 0.599 1 2 "[+ . 1 . 2 . -]" 1
774 1 4 PRO QG 1 47 LEU HG 4.100 . 6.000 3.656 3.030 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 14 TYR QE 1 16 LYS QD 4.400 . 6.000 2.274 1.888 3.953 0.112 8 0 "[ . 1 . 2 . 3]" 1
776 1 1 PHE QR 1 16 LYS QD 3.900 . 5.800 3.407 3.205 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 16 LYS QD 1 29 VAL H 2.300 . 3.000 3.346 3.232 3.476 0.476 22 0 "[ . 1 . 2 . 3]" 1
778 1 16 LYS QD 1 27 ILE H 3.900 . 5.800 4.223 3.516 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 4 PRO QG 1 18 LEU QD 2.800 . 3.800 2.365 1.788 2.911 0.012 4 0 "[ . 1 . 2 . 3]" 1
780 1 4 PRO QG 1 47 LEU QD 2.200 . 2.800 1.785 1.633 1.881 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 9 CYS QB 1 47 LEU QD 2.000 . 2.500 2.661 1.959 3.392 0.892 13 4 "[ . *1 + . 2 *- 3]" 1
782 1 5 PRO QD 1 47 LEU QD 2.700 . 3.600 2.995 2.724 3.225 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 22 LEU HA 1 47 LEU QD 3.300 . 4.700 3.356 2.689 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 2 LEU HA 1 47 LEU QD 3.200 . 4.500 4.458 4.083 4.804 0.304 13 0 "[ . 1 . 2 . 3]" 1
785 1 27 ILE H 1 47 LEU QD 2.100 . 2.600 3.985 3.758 4.248 1.648 3 30 [**+**********-****************] 1
786 1 27 ILE H 1 45 LEU HA 2.900 . 4.000 2.751 2.629 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 18 LEU QD 1 45 LEU QB 3.600 . 5.200 2.007 1.712 2.258 0.288 11 0 "[ . 1 . 2 . 3]" 1
788 1 2 LEU QD 1 45 LEU QB 3.500 . 5.100 2.139 1.735 2.517 0.165 11 0 "[ . 1 . 2 . 3]" 1
789 1 3 LEU HA 1 45 LEU QB 3.000 . 4.100 2.365 2.316 2.415 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 2 LEU QD 1 3 LEU HG 1.900 . 2.300 1.675 1.644 1.683 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 5 PRO QB 1 45 LEU HG 4.000 . 6.000 3.429 2.473 4.085 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 3 LEU HA 1 3 LEU HG 2.500 . 3.300 2.817 2.067 3.365 0.065 25 0 "[ . 1 . 2 . 3]" 1
793 1 3 LEU H 1 3 LEU HG 2.600 . 3.400 3.063 2.413 3.572 0.172 5 0 "[ . 1 . 2 . 3]" 1
794 1 31 LEU QD 1 45 LEU QD 1.700 . 2.200 1.778 1.625 1.886 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 23 LEU QD 1 45 LEU QD 2.700 . 3.600 1.585 1.515 1.675 0.285 7 0 "[ . 1 . 2 . 3]" 1
796 1 2 LEU QD 1 45 LEU QD 2.500 . 3.300 1.997 1.662 2.258 0.038 5 0 "[ . 1 . 2 . 3]" 1
797 1 2 LEU QD 1 45 LEU QD 1.900 . 2.300 1.514 1.399 1.665 0.101 23 0 "[ . 1 . 2 . 3]" 1
798 1 8 ALA MB 1 45 LEU QD 2.100 . 2.600 1.934 1.856 1.964 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 1 PHE QD 1 45 LEU QD 4.000 . 4.300 3.870 3.670 4.057 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 29 VAL H 1 45 LEU QD 4.800 . 6.000 4.082 3.878 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 11 THR H 1 45 LEU QD 2.600 . 3.500 3.336 3.122 3.580 0.080 17 0 "[ . 1 . 2 . 3]" 1
802 1 3 LEU HA 1 45 LEU QD 3.400 . 4.800 1.872 1.763 1.985 0.237 26 0 "[ . 1 . 2 . 3]" 1
803 1 9 CYS QB 1 13 LEU QD 2.900 . 4.000 2.798 2.389 3.173 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 4 PRO QB 1 45 LEU QD 3.700 . 5.400 3.152 2.290 3.528 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 2 LEU QD 1 45 LEU QD 1.800 . 2.200 1.514 1.399 1.665 0.001 23 0 "[ . 1 . 2 . 3]" 1
806 1 13 LEU QD 1 43 PHE HA 2.800 . 3.800 3.720 3.172 4.110 0.310 14 0 "[ . 1 . 2 . 3]" 1
807 1 5 PRO QB 1 13 LEU QD 4.000 . 6.000 3.131 1.945 3.385 0.055 29 0 "[ . 1 . 2 . 3]" 1
808 1 4 PRO QG 1 44 VAL HA 3.300 . 4.700 2.964 2.255 3.000 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 27 ILE H 1 44 VAL HA 2.400 . 3.100 2.162 2.113 2.246 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 13 LEU QD 1 44 VAL QG 3.600 . 5.300 3.190 2.983 3.419 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 3 LEU HG 1 44 VAL QG 4.000 . 6.000 3.150 2.271 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 4 PRO QB 1 44 VAL QG 2.500 . 3.300 2.665 1.655 3.295 0.045 1 0 "[ . 1 . 2 . 3]" 1
813 1 8 ALA MB 1 44 VAL QG 3.800 . 5.600 2.474 1.870 3.244 0.130 7 0 "[ . 1 . 2 . 3]" 1
814 1 7 THR MG 1 44 VAL QG 3.400 . 4.900 4.063 3.692 4.193 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 7 THR MG 1 44 VAL QG 1.800 . 2.200 2.528 2.237 3.078 0.878 17 5 "[ * . 1 . + * .-* 3]" 1
816 1 3 LEU HG 1 44 VAL QG 4.000 . 6.000 3.136 2.269 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 4 PRO QB 1 44 VAL QG 2.600 . 3.400 2.666 1.655 3.297 0.145 1 0 "[ . 1 . 2 . 3]" 1
818 1 9 CYS QB 1 44 VAL QG 3.400 . 4.800 2.699 2.309 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 11 THR H 1 44 VAL QG 3.600 . 5.200 2.930 2.654 3.169 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 1 PHE QD 1 43 PHE HA 3.800 . 5.600 4.427 4.277 4.546 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 13 LEU QD 1 43 PHE QB 3.600 . 5.200 3.249 2.802 3.518 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 4 PRO QB 1 43 PHE QB 2.900 . 3.900 3.502 2.887 4.116 0.216 17 0 "[ . 1 . 2 . 3]" 1
823 1 10 CYS QB 1 13 LEU QD 2.700 . 3.600 2.974 2.426 3.555 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 10 CYS H 1 43 PHE QB 4.200 . 6.000 3.519 3.195 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 13 LEU QD 1 42 ALA MB 2.500 . 3.300 2.272 1.940 2.713 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 2 LEU QD 1 42 ALA MB 2.800 . 3.800 1.975 1.792 2.216 0.008 23 0 "[ . 1 . 2 . 3]" 1
827 1 2 LEU QD 1 42 ALA MB 2.300 . 2.900 2.216 2.049 2.533 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 3 LEU HG 1 42 ALA MB 3.700 . 5.400 4.172 3.790 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 10 CYS QB 1 42 ALA MB 3.000 . 4.100 2.678 2.134 3.019 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 9 CYS QB 1 42 ALA MB 3.200 . 4.500 2.673 2.131 2.979 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 5 PRO QD 1 42 ALA MB 2.000 . 2.500 2.886 2.462 3.211 0.711 30 8 "[ . 1** . * 2 * **- +]" 1
832 1 3 LEU HA 1 42 ALA MB 2.700 . 3.600 3.640 3.536 3.755 0.155 28 0 "[ . 1 . 2 . 3]" 1
833 1 29 VAL H 1 41 GLN HA 2.600 . 3.400 2.162 2.087 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 13 LEU H 1 28 GLN HA 2.300 . 3.000 2.436 2.247 2.593 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 2 LEU QD 1 41 GLN QG 3.300 . 4.600 4.360 4.044 4.644 0.044 29 0 "[ . 1 . 2 . 3]" 1
836 1 8 ALA MB 1 41 GLN QG 2.200 . 2.800 2.379 1.923 3.111 0.311 14 0 "[ . 1 . 2 . 3]" 1
837 1 2 LEU HA 1 41 GLN QG 4.300 . 6.000 2.811 2.402 3.278 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 12 GLN QE 1 41 GLN QG 3.700 . 5.400 3.997 3.549 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 2 LEU QD 1 41 GLN QB 2.700 . 3.600 3.971 3.296 4.601 1.001 29 12 "[*** . 1 *** - 2* *. **+3]" 1
840 1 15 ARG QB 1 41 GLN QB 3.300 . 4.600 2.928 2.408 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 2 LEU QD 1 40 LEU HA 2.400 . 3.100 2.987 1.899 3.440 0.340 3 0 "[ . 1 . 2 . 3]" 1
842 1 14 TYR QD 1 40 LEU HA 2.900 . 4.000 2.761 2.250 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 21 LYS H 1 40 LEU QB 2.500 . 3.300 3.227 1.890 4.518 1.218 24 11 "[ ***. * 1 -. * 2 *+. ***3]" 1
844 1 14 TYR QD 1 40 LEU QB 4.100 . 5.200 2.417 1.869 3.143 0.131 10 0 "[ . 1 . 2 . 3]" 1
845 1 2 LEU QD 1 40 LEU QB 2.700 . 3.600 1.915 1.832 2.073 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 2 LEU QD 1 40 LEU QB 2.500 . 3.300 1.915 1.832 2.073 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 5 PRO QB 1 22 LEU QD 2.700 . 3.600 2.615 1.714 3.242 0.086 2 0 "[ . 1 . 2 . 3]" 1
848 1 9 CYS QB 1 22 LEU QD 2.300 . 3.000 5.339 5.242 5.461 2.461 2 30 [*+**************************-*] 1
849 1 9 CYS QB 1 22 LEU QD 2.100 . 2.600 3.955 3.065 4.476 1.876 25 28 "[*-*********** ****** ***+*****]" 1
850 1 4 PRO QD 1 22 LEU QD 3.700 . 5.400 2.314 1.984 2.793 0.016 9 0 "[ . 1 . 2 . 3]" 1
851 1 4 PRO HA 1 22 LEU QD 3.300 . 4.700 3.308 2.981 3.648 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 2 LEU QD 1 4 PRO QB 3.400 . 4.800 3.127 2.910 3.449 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 9 CYS QB 1 22 LEU QD 3.700 . 5.400 2.976 1.887 3.552 0.113 25 0 "[ . 1 . 2 . 3]" 1
854 1 2 LEU QD 1 3 LEU HA 2.000 . 2.500 2.050 1.769 2.641 0.141 9 0 "[ . 1 . 2 . 3]" 1
855 1 2 LEU HA 1 3 LEU QD 2.700 . 3.600 2.610 1.823 3.435 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 13 LEU H 1 40 LEU QD 4.400 . 6.000 2.821 1.932 3.533 0.068 20 0 "[ . 1 . 2 . 3]" 1
857 1 4 PRO QD 1 37 ASP QB 3.600 . 5.200 3.863 3.573 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 3 LEU HA 1 37 ASP QB 3.600 . 5.200 3.624 2.362 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 9 CYS QB 1 35 ASP HA 2.600 . 3.400 2.454 2.375 2.576 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 9 CYS QB 1 35 ASP HA 2.300 . 3.000 2.842 2.441 3.027 0.027 2 0 "[ . 1 . 2 . 3]" 1
861 1 10 CYS QB 1 11 THR MG 3.400 . 4.800 2.869 2.137 3.381 . 0 0 "[ . 1 . 2 . 3]" 1
862 1 7 THR MG 1 35 ASP HB3 3.200 . 4.500 4.040 3.555 4.524 0.024 19 0 "[ . 1 . 2 . 3]" 1
863 1 7 THR MG 1 10 CYS QB 3.300 . 4.600 3.685 3.075 4.349 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 4 PRO QD 1 10 CYS QB 4.800 . 6.000 4.377 4.193 4.565 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 4 PRO HA 1 34 ALA HA 4.000 . 6.000 2.942 2.647 3.273 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 3 LEU HG 1 34 ALA MB 4.000 . 6.000 4.151 3.891 4.475 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 4 PRO QG 1 34 ALA MB 2.200 . 2.800 3.979 3.765 4.231 1.431 12 30 [***********+-*****************] 1
868 1 2 LEU HA 1 34 ALA MB 3.900 . 5.800 3.077 2.565 3.692 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 4 PRO HA 1 34 ALA MB 3.000 . 4.200 3.121 2.662 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 3 LEU HG 1 25 LYS HA 2.200 . 2.800 2.405 2.262 2.598 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 4 PRO QG 1 25 LYS HA 2.200 . 2.800 1.836 1.778 1.905 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 4 PRO QB 1 33 GLU HA 3.600 . 5.200 2.307 2.173 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 2 LEU H 1 33 GLU HA 2.700 . 3.600 2.811 2.744 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 7 THR MG 1 33 GLU QG 3.800 . 5.600 2.759 2.147 3.111 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 18 LEU QD 1 33 GLU QB 4.100 . 6.000 4.228 3.893 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 7 THR MG 1 33 GLU QB 3.000 . 4.100 3.765 3.558 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 3 LEU HA 1 33 GLU QB 2.300 . 3.000 4.282 4.055 4.355 1.355 27 30 [**-***********************+***] 1
878 1 22 LEU HA 1 33 GLU QB 4.100 . 6.000 2.429 1.864 3.901 0.136 24 0 "[ . 1 . 2 . 3]" 1
879 1 3 LEU HG 1 12 GLN HA 3.600 . 5.200 3.641 3.372 4.101 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 12 GLN HA 1 13 LEU H 2.300 . 3.000 2.303 2.105 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 4 PRO QB 1 32 GLN QG 3.100 . 4.300 2.074 1.964 2.086 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 11 THR H 1 32 GLN QG 4.100 . 6.000 3.897 3.812 3.955 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 3 LEU HA 1 17 PRO QB 2.400 . 3.100 2.191 2.159 2.212 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 2 LEU QD 1 12 GLN HA 3.400 . 4.800 4.946 4.350 5.596 0.796 11 3 "[ -. 1+ . 2 .* 3]" 1
885 1 11 THR H 1 31 LEU QB 3.200 . 3.800 2.355 2.208 2.714 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 11 THR H 1 31 LEU HG 3.100 . 4.300 3.383 3.056 3.596 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 9 CYS HA 1 18 LEU QD 2.500 . 3.300 1.828 1.741 2.047 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 12 GLN QE 1 31 LEU QD 3.500 . 4.700 2.996 1.884 3.454 0.016 4 0 "[ . 1 . 2 . 3]" 1
889 1 1 PHE QD 1 31 LEU QD 1.900 . 2.300 2.525 1.855 2.804 0.504 3 1 "[ + . 1 . 2 . 3]" 1
890 1 17 PRO QG 1 31 LEU QD 3.200 . 4.500 2.540 1.940 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
891 1 2 LEU HA 1 31 LEU QD 4.000 . 6.000 3.227 2.940 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 1 PHE QD 1 31 LEU QD 2.700 . 3.600 2.525 1.855 2.804 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 11 THR H 1 31 LEU QD 3.700 . 5.400 2.351 1.881 2.624 0.119 20 0 "[ . 1 . 2 . 3]" 1
894 1 11 THR H 1 30 GLU QG 3.300 . 4.600 3.418 3.219 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 8 ALA MB 1 29 VAL QG 3.900 . 5.800 3.243 2.940 3.628 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 3 LEU HG 1 29 VAL QG 3.500 . 5.100 3.085 2.619 3.315 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 2 LEU HG 1 29 VAL QG 2.200 . 2.800 3.803 3.132 4.285 1.485 26 29 "[**-********* ************+****]" 1
898 1 12 GLN QE 1 29 VAL QG 2.700 . 3.600 2.256 1.882 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 1 PHE QD 1 29 VAL QG 2.000 . 2.500 2.907 2.251 3.387 0.887 20 13 "[* **.* 1-** .* * + *.* *3]" 1
900 1 12 GLN QE 1 29 VAL QG 3.600 . 5.200 2.256 1.882 2.633 0.118 23 0 "[ . 1 . 2 . 3]" 1
901 1 1 PHE QD 1 29 VAL QG 2.400 . 3.100 2.942 2.278 3.421 0.321 20 0 "[ . 1 . 2 . 3]" 1
902 1 14 TYR QD 1 29 VAL QG 4.200 . 6.000 2.713 1.870 3.867 0.130 7 0 "[ . 1 . 2 . 3]" 1
903 1 14 TYR QD 1 29 VAL QG 2.900 . 3.900 2.722 1.870 3.907 0.030 7 0 "[ . 1 . 2 . 3]" 1
904 1 14 TYR QE 1 29 VAL QG 3.700 . 5.500 4.908 3.800 5.636 0.136 27 0 "[ . 1 . 2 . 3]" 1
905 1 28 GLN QG 1 29 VAL H 2.900 . 3.900 4.200 3.677 4.579 0.679 18 1 "[ . 1 . + 2 . 3]" 1
906 1 4 PRO QB 1 28 GLN QG 3.500 . 5.000 3.119 2.822 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 2 LEU QD 1 28 GLN QG 3.900 . 5.800 3.160 2.749 3.615 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 28 GLN QB 1 29 VAL H 4.400 . 6.000 2.657 2.465 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 28 GLN H 1 28 GLN QB 2.900 . 3.900 2.436 1.767 2.695 0.133 1 0 "[ . 1 . 2 . 3]" 1
910 1 27 ILE HA 1 28 GLN H 3.000 . 4.100 3.471 3.402 3.527 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 27 ILE H 1 27 ILE HA 3.100 . 4.300 2.908 2.823 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 5 PRO QD 1 27 ILE HB 4.500 . 6.000 5.638 5.551 5.727 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 27 ILE HB 1 28 GLN H 3.300 . 4.700 3.898 3.638 4.086 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 5 PRO QD 1 27 ILE QG 5.300 . 6.000 3.661 3.547 3.831 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 4 PRO QG 1 27 ILE QG 3.500 . 5.000 2.716 2.463 3.095 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 27 ILE QG 1 30 GLU HA 4.200 . 6.000 2.945 2.419 3.408 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 4 PRO QB 1 27 ILE MG 2.800 . 3.800 4.260 4.054 4.547 0.747 9 12 "[** -. * +* **. 2* ** *]" 1
918 1 5 PRO QB 1 27 ILE MG 2.900 . 4.000 4.204 4.020 4.425 0.425 9 0 "[ . 1 . 2 . 3]" 1
919 1 4 PRO QG 1 27 ILE MG 3.500 . 5.000 4.196 3.630 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 5 PRO QD 1 27 ILE MG 2.300 . 2.900 3.683 3.466 3.937 1.037 5 30 [****+**-**********************] 1
921 1 27 ILE MG 1 30 GLU HA 4.200 . 6.000 3.546 2.849 4.172 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 1 PHE QE 1 27 ILE MD 2.300 . 3.000 5.187 4.787 5.494 2.494 10 30 [*********+****-***************] 1
923 1 27 ILE MD 1 30 GLU HA 2.200 . 2.800 4.075 3.528 4.602 1.802 1 30 [+**********************-******] 1
924 1 5 PRO QD 1 27 ILE MD 2.300 . 2.900 4.915 4.446 5.190 2.290 11 30 [*-********+*******************] 1
925 1 1 PHE QB 1 27 ILE MD 2.400 . 3.100 4.019 3.511 4.635 1.535 5 29 "[****+*-********************* *]" 1
926 1 1 PHE QB 1 27 ILE MD 2.400 . 3.100 4.018 3.511 4.634 1.534 5 29 "[****+*-********************* *]" 1
927 1 5 PRO QB 1 27 ILE MD 2.300 . 3.000 3.338 2.889 4.083 1.083 25 8 "[ * . * *1 .* 2- *+* 3]" 1
928 1 4 PRO QG 1 27 ILE MD 2.200 . 2.800 3.847 3.602 4.160 1.360 18 30 [*****************+*****-******] 1
929 1 4 PRO QG 1 27 ILE MD 2.200 . 2.800 4.325 3.471 4.720 1.920 22 30 [*-*******************+********] 1
930 1 2 LEU QB 1 27 ILE MD 1.900 . 2.300 1.812 1.591 1.863 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 26 VAL HA 1 27 ILE H 2.200 . 2.800 2.215 2.134 2.348 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 17 PRO QB 1 25 LYS H 2.400 . 3.100 4.373 3.996 4.641 1.541 9 30 [*-******+*********************] 1
933 1 2 LEU QB 1 26 VAL QG 2.400 . 3.100 1.761 1.299 2.263 0.401 1 0 "[ . 1 . 2 . 3]" 1
934 1 3 LEU QD 1 8 ALA MB 2.300 . 3.000 2.123 1.737 2.476 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 16 LYS QB 1 26 VAL QG 4.200 . 6.000 3.122 2.924 3.289 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 3 LEU QD 1 4 PRO QB 3.200 . 4.400 4.182 3.473 4.474 0.074 17 0 "[ . 1 . 2 . 3]" 1
937 1 3 LEU QD 1 4 PRO QG 3.200 . 4.500 3.183 3.042 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 1 PHE QB 1 26 VAL QG 2.600 . 3.500 3.346 3.128 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 3 LEU QD 1 4 PRO QD 3.200 . 4.500 2.580 2.250 2.722 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 1 PHE HA 1 3 LEU QD 3.200 . 4.500 3.714 3.190 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 3 LEU QD 1 12 GLN QE 2.200 . 2.800 2.556 1.566 3.515 0.715 2 1 "[ + . 1 . 2 . 3]" 1
942 1 3 LEU QD 1 12 GLN H 3.000 . 4.100 3.607 3.270 3.944 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 26 VAL QG 1 28 GLN H 3.500 . 5.000 2.446 2.115 2.803 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 26 VAL QG 1 27 ILE H 3.100 . 4.300 2.607 2.086 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 11 THR H 1 26 VAL QG 3.500 . 5.000 2.577 2.350 2.888 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 3 LEU HG 1 26 VAL QG 3.100 . 4.300 2.149 1.736 2.523 0.164 11 0 "[ . 1 . 2 . 3]" 1
947 1 4 PRO QB 1 26 VAL QG 2.700 . 3.600 3.326 2.929 3.517 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 5 PRO QD 1 26 VAL QG 2.500 . 3.300 1.799 1.697 1.975 0.003 27 0 "[ . 1 . 2 . 3]" 1
949 1 3 LEU HA 1 26 VAL QG 2.300 . 2.900 3.162 2.811 3.535 0.635 15 4 "[ - . * 1 + * . 3]" 1
950 1 12 GLN QE 1 26 VAL QG 2.200 . 2.800 3.425 3.146 3.630 0.830 3 29 "[**+************* *******-*****]" 1
951 1 2 LEU QD 1 84 LEU HA 1.900 . 2.300 2.446 1.771 3.264 0.964 17 11 "[ * . 1 ****-+ 2* * **3]" 1
952 1 21 LYS H 1 84 LEU HA 4.100 . 6.000 4.031 2.824 4.840 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 1 PHE QD 1 25 LYS QB 4.200 . 6.000 3.247 2.145 3.454 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 22 LEU HA 1 25 LYS QG 2.300 . 3.000 3.382 2.381 4.184 1.184 19 12 "[* . * *1 *** *+* . -* *]" 1
955 1 23 LEU QD 1 43 PHE QE 3.200 . 4.500 2.476 2.036 2.876 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 31 LEU QD 1 43 PHE QE 3.700 . 5.400 2.287 1.820 2.563 0.180 18 0 "[ . 1 . 2 . 3]" 1
957 1 16 LYS QB 1 43 PHE QE 3.600 . 5.200 2.856 2.183 3.334 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 1 PHE QB 1 1 PHE QD 2.400 . 3.100 2.128 2.122 2.146 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 1 PHE QD 1 2 LEU QB 4.300 . 6.000 3.384 2.306 4.239 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 1 PHE QB 1 1 PHE QE 4.100 . 6.000 3.911 3.855 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 2 LEU QD 1 39 HIS HD2 2.100 . 2.600 3.608 2.090 4.453 1.853 5 22 "[ * -+*** *********** ** ** *]" 1
962 1 2 LEU QD 1 64 TRP HZ2 2.200 . 2.800 1.927 1.485 2.313 0.115 3 0 "[ . 1 . 2 . 3]" 1
963 1 2 LEU QD 1 64 TRP HH2 2.300 . 2.900 1.992 1.718 2.304 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 18 LEU QD 1 64 TRP HH2 2.000 . 2.500 2.027 1.722 2.668 0.168 3 0 "[ . 1 . 2 . 3]" 1
965 1 18 LEU QD 1 64 TRP HZ3 2.200 . 2.800 3.570 3.218 4.036 1.236 3 28 "[-*+************* * ***********]" 1
966 1 7 THR MG 1 14 TYR QD 4.000 . 6.000 2.583 2.162 3.061 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 5 PRO HA 1 14 TYR QE 3.500 . 5.100 3.664 2.649 4.175 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 3 LEU HG 1 14 TYR QE 3.200 . 4.400 3.829 2.436 4.809 0.409 24 0 "[ . 1 . 2 . 3]" 1
969 1 2 LEU QD 1 65 PHE HZ 2.200 . 2.800 2.572 1.992 3.218 0.418 2 0 "[ . 1 . 2 . 3]" 1
970 1 31 LEU QD 1 65 PHE HZ 2.400 . 3.100 3.108 2.451 3.917 0.817 24 4 "[ *. * . 2 +. -]" 1
971 1 1 PHE QD 1 65 PHE HZ 3.600 . 5.200 2.722 2.012 3.500 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 31 LEU QD 1 65 PHE QE 2.300 . 2.900 2.195 1.812 2.835 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 2 LEU QD 1 65 PHE QE 2.100 . 2.700 1.994 1.687 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 23 LEU QD 1 65 PHE QE 2.400 . 3.100 2.011 1.719 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 8 ALA MB 1 65 PHE QE 2.500 . 3.300 3.725 1.960 4.517 1.217 23 19 "[-** . * **** *** * +*** ***]" 1
976 1 1 PHE HA 1 65 PHE QE 4.200 . 6.000 3.551 2.694 4.248 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 2 LEU QD 1 43 PHE HZ 2.200 . 2.800 2.898 1.866 4.151 1.351 2 6 "[ + . 1 . 2 * .- ***]" 1
978 1 2 LEU QD 1 24 ARG HA 3.000 . 4.100 2.548 1.919 3.048 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 3 LEU HG 1 24 ARG HA 3.800 . 5.600 2.476 1.889 3.740 0.111 25 0 "[ . 1 . 2 . 3]" 1
980 1 2 LEU QD 1 12 GLN QB 3.700 . 5.400 3.264 3.011 3.646 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 5 PRO QB 1 24 ARG QB 2.600 . 3.500 3.733 3.248 3.900 0.400 3 0 "[ . 1 . 2 . 3]" 1
982 1 1 PHE QD 1 24 ARG QB 4.600 . 6.000 2.843 1.859 3.743 0.041 7 0 "[ . 1 . 2 . 3]" 1
983 1 1 PHE QD 1 24 ARG QB 4.100 . 6.000 4.535 4.339 4.765 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 4 PRO QG 1 24 ARG QG 3.700 . 5.400 3.888 3.473 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 4 PRO QD 1 24 ARG QG 3.200 . 4.500 2.861 2.304 3.267 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 18 LEU QD 1 23 LEU HA 3.400 . 4.800 1.870 1.720 2.067 0.280 27 0 "[ . 1 . 2 . 3]" 1
987 1 1 PHE QR 1 23 LEU HA 4.600 . 6.000 3.308 3.094 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 23 LEU HA 1 24 ARG H 3.300 . 4.600 3.122 3.028 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 18 LEU QD 1 23 LEU QD 1.700 . 2.200 1.905 1.733 2.352 0.152 14 0 "[ . 1 . 2 . 3]" 1
990 1 2 LEU HG 1 23 LEU QD 2.900 . 3.900 1.711 1.699 1.718 0.201 17 0 "[ . 1 . 2 . 3]" 1
991 1 8 ALA MB 1 23 LEU QD 2.400 . 3.100 1.978 1.784 2.244 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 1 PHE HA 1 23 LEU QD 2.500 . 3.300 2.017 1.776 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 1 PHE QD 1 23 LEU QD 3.300 . 4.700 3.620 3.175 3.806 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 2 LEU QD 1 22 LEU HA 3.200 . 4.500 2.892 2.284 3.143 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 9 CYS QB 1 22 LEU HA 3.200 . 4.500 2.353 1.793 3.686 0.107 18 0 "[ . 1 . 2 . 3]" 1
996 1 2 LEU HA 1 22 LEU QB 3.300 . 4.700 4.967 4.261 5.239 0.539 20 3 "[ . *1 . + -. 3]" 1
997 1 12 GLN H 1 22 LEU QB 2.900 . 4.000 3.421 2.558 3.609 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 22 LEU QB 1 35 ASP H 2.700 . 3.600 2.508 1.933 3.136 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 22 LEU QD 1 25 LYS H 5.000 . 6.000 4.281 4.050 4.870 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 7 THR H 1 22 LEU QD 2.400 . 3.100 2.091 1.964 2.416 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 1 PHE HA 1 22 LEU QD 3.900 . 5.800 2.323 1.985 2.804 0.015 9 0 "[ . 1 . 2 . 3]" 1
1002 1 4 PRO QD 1 22 LEU QD 4.900 . 6.000 2.326 1.987 2.820 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 1 PHE HA 1 21 LYS HA 3.500 . 5.000 4.275 4.213 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 21 LYS HA 1 25 LYS H 4.300 . 6.000 5.727 5.166 6.046 0.046 27 0 "[ . 1 . 2 . 3]" 1
1005 1 12 GLN H 1 21 LYS QB 4.600 . 6.000 4.153 4.053 4.322 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 21 LYS QB 1 24 ARG H 4.300 . 6.000 4.912 4.701 5.081 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 2 LEU QB 1 20 ASP HA 3.300 . 4.700 1.933 1.731 2.223 0.169 6 0 "[ . 1 . 2 . 3]" 1
1008 1 12 GLN H 1 20 ASP HA 3.200 . 4.500 3.009 2.781 3.196 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 12 GLN H 1 20 ASP QB 4.100 . 6.000 4.293 3.805 4.424 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 13 LEU QD 1 19 SER HA 3.700 . 5.400 4.068 3.742 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 2 LEU QD 1 19 SER HA 3.600 . 5.200 3.916 3.823 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 19 SER HA 1 21 LYS QB 3.900 . 5.800 5.137 4.876 5.335 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 11 THR H 1 19 SER HA 2.900 . 4.000 2.218 2.136 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 2 LEU QD 1 19 SER QB 3.300 . 4.600 2.323 1.984 2.812 0.016 9 0 "[ . 1 . 2 . 3]" 1
1015 1 18 LEU QD 1 19 SER QB 2.800 . 3.800 2.323 1.984 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 19 SER QB 1 21 LYS QB 3.400 . 4.800 3.010 2.663 3.411 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 3 LEU HG 1 19 SER QB 3.200 . 4.400 3.217 2.699 3.907 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 2 LEU QB 1 19 SER QB 3.000 . 4.100 2.375 1.724 2.830 0.176 21 0 "[ . 1 . 2 . 3]" 1
1019 1 3 LEU HG 1 19 SER QB 3.300 . 4.700 3.218 2.699 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 2 LEU QB 1 19 SER QB 2.600 . 3.400 2.374 1.724 2.830 0.076 21 0 "[ . 1 . 2 . 3]" 1
1021 1 19 SER QB 1 21 LYS QB 3.500 . 5.100 3.010 2.663 3.411 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 9 CYS QB 1 19 SER QB 4.300 . 6.000 4.359 4.115 4.991 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 1 PHE QE 1 19 SER QB 3.900 . 5.800 2.738 2.516 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 1 PHE QE 1 19 SER QB 3.500 . 5.000 2.738 2.516 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 19 SER QB 1 21 LYS H 4.000 . 5.600 2.833 2.645 3.238 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 18 LEU QB 1 23 LEU QD . . 3.100 1.983 1.783 2.244 0.117 9 0 "[ . 1 . 2 . 3]" 1
1027 1 18 LEU HG 1 23 LEU QD 3.400 . 4.900 3.463 3.211 4.086 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 18 LEU HG 1 19 SER QB 4.400 . 6.000 3.672 2.931 4.288 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 5 PRO QD 1 18 LEU HG 4.100 . 6.000 3.632 2.922 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 14 TYR QD 1 18 LEU HG 2.400 . 3.100 3.917 3.116 4.507 1.407 16 25 "[****.*** 1**-**+* ***** ******]" 1
1031 1 1 PHE QB 1 18 LEU QD 2.200 . 2.800 3.211 2.935 3.543 0.743 5 8 "[ *+ - ** * . * 2 . *]" 1
1032 1 14 TYR QE 1 18 LEU QD 2.800 . 3.800 2.510 2.018 2.870 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 18 LEU QD 1 28 GLN H 4.100 . 6.000 2.700 1.860 3.883 0.140 4 0 "[ . 1 . 2 . 3]" 1
1034 1 18 LEU QD 1 29 VAL H 2.900 . 4.000 4.255 3.883 4.466 0.466 27 0 "[ . 1 . 2 . 3]" 1
1035 1 5 PRO QD 1 18 LEU QD 3.100 . 4.300 3.438 2.169 3.686 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 2 LEU H 1 17 PRO HA 2.700 . 3.600 2.182 2.120 2.319 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 4 PRO QB 1 5 PRO QD 3.000 . 4.100 2.456 2.295 2.559 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 2 LEU H 1 5 PRO QB 2.100 . 2.700 3.220 2.715 3.544 0.844 1 15 "[+* *** - *** ***2 *** 3]" 1
1039 1 2 LEU HA 1 17 PRO QG 3.900 . 5.800 3.678 3.513 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 16 LYS QB 1 17 PRO QG 4.400 . 6.000 3.756 2.851 4.187 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 2 LEU HA 1 2 LEU QD 2.100 . 2.700 2.631 2.036 3.346 0.646 3 1 "[ + . 1 . 2 . 3]" 1
1042 1 5 PRO QD 1 16 LYS HA 2.100 . 2.600 1.931 1.822 2.191 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 4 PRO QD 1 16 LYS HA 2.500 . 3.300 1.933 1.822 2.193 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 3 LEU HG 1 16 LYS QB 2.500 . 3.300 2.243 2.093 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 3 LEU HG 1 16 LYS QG 2.100 . 2.600 2.070 2.004 2.091 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 15 ARG HA 1 24 ARG HE 3.900 . 5.800 3.394 2.135 4.586 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 14 TYR QD 1 15 ARG QD 3.000 . 4.100 2.430 2.074 2.493 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 1 PHE QD 1 15 ARG QG 3.000 . 4.100 2.425 2.181 2.925 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 14 TYR QD 1 15 ARG QG 3.900 . 5.800 2.443 2.183 2.976 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 9 CYS QB 1 15 ARG QG 2.200 . 2.800 1.993 1.795 2.086 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 1 PHE QB 1 13 LEU HA 3.400 . 4.900 4.042 3.938 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 13 LEU HA 1 14 TYR H 2.600 . 3.500 2.209 2.091 2.301 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 3 LEU HG 1 13 LEU QB 3.000 . 4.100 2.388 2.340 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 7 THR MG 1 13 LEU QD 2.300 . 2.900 1.821 1.726 1.895 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 13 LEU QD 1 16 LYS QB 3.000 . 4.100 3.399 3.023 3.646 . 0 0 "[ . 1 . 2 . 3]" 1
1056 1 13 LEU QD 1 15 ARG QB 3.300 . 4.700 3.138 2.836 3.563 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 2 LEU H 1 13 LEU QD 2.500 . 3.300 2.844 2.443 3.125 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 7 THR MG 1 12 GLN HA 3.000 . 4.100 4.088 3.734 4.269 0.169 4 0 "[ . 1 . 2 . 3]" 1
1059 1 12 GLN HA 1 12 GLN QE 3.900 . 5.800 4.055 3.467 4.882 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 12 GLN H 1 12 GLN HA 3.100 . 4.300 2.881 2.814 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 12 GLN QE 1 12 GLN QG 3.100 . 4.300 1.938 1.892 2.098 0.008 29 0 "[ . 1 . 2 . 3]" 1
1062 1 3 LEU HA 1 12 GLN QB 2.900 . 3.900 2.160 2.140 2.303 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 4 PRO QB 1 11 THR HB 3.700 . 5.400 4.283 3.630 4.888 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 2 LEU QD 1 11 THR HB 2.100 . 2.600 4.496 3.648 5.188 2.588 24 30 [***********************+**-***] 1
1065 1 2 LEU QD 1 11 THR HA 2.600 . 3.500 2.819 2.027 3.206 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 11 THR MG 1 12 GLN H 3.300 . 4.700 4.071 3.175 4.402 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 9 CYS QB 1 11 THR MG 3.400 . 4.900 4.503 3.660 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 4 PRO QB 1 11 THR MG 3.600 . 5.200 4.278 1.977 4.954 0.023 14 0 "[ . 1 . 2 . 3]" 1
1069 1 2 LEU QD 1 11 THR MG 2.700 . 3.600 3.480 2.269 4.760 1.160 20 5 "[ . 1 - *. + .* *]" 1
1070 1 10 CYS QB 1 11 THR MG 3.900 . 5.800 2.870 2.137 3.384 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 10 CYS QB 1 13 LEU QD 3.500 . 5.100 2.975 2.426 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 8 ALA HA 1 9 CYS QB 3.900 . 5.800 4.165 3.883 4.366 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 3 LEU H 1 8 ALA HA 2.000 . 2.500 2.156 2.034 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 8 ALA MB 1 13 LEU QD 4.100 . 6.000 4.676 4.202 5.111 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 2 LEU QD 1 8 ALA MB 3.300 . 4.600 2.524 1.872 3.687 0.128 7 0 "[ . 1 . 2 . 3]" 1
1076 1 2 LEU QD 1 8 ALA MB 3.000 . 4.100 2.567 1.876 3.735 0.024 7 0 "[ . 1 . 2 . 3]" 1
1077 1 4 PRO QG 1 8 ALA MB 4.500 . 6.000 3.059 2.088 3.716 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 4 PRO QG 1 8 ALA MB 5.100 . 6.000 2.311 1.467 3.146 0.433 19 0 "[ . 1 . 2 . 3]" 1
1079 1 4 PRO QB 1 8 ALA MB 4.500 . 6.000 2.686 1.645 3.461 0.255 8 0 "[ . 1 . 2 . 3]" 1
1080 1 8 ALA MB 1 9 CYS QB 4.200 . 6.000 3.573 2.672 4.189 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 8 ALA MB 1 9 CYS QB 4.800 . 6.000 4.163 3.668 4.649 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 4 PRO QD 1 8 ALA MB 3.700 . 5.400 4.649 3.929 5.235 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 1 PHE HA 1 8 ALA MB 3.600 . 5.200 5.250 4.768 5.572 0.372 19 0 "[ . 1 . 2 . 3]" 1
1084 1 3 LEU HA 1 8 ALA MB 3.800 . 5.600 2.792 1.938 3.524 0.062 14 0 "[ . 1 . 2 . 3]" 1
1085 1 4 PRO QD 1 7 THR HB 3.600 . 5.200 2.836 2.250 3.424 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 7 THR HA 1 8 ALA MB 2.800 . 3.800 4.255 4.006 4.605 0.805 6 9 "[* .+* -* * .* * 2 * 3]" 1
1087 1 3 LEU H 1 7 THR HA 2.100 . 2.700 2.408 2.168 2.836 0.136 6 0 "[ . 1 . 2 . 3]" 1
1088 1 7 THR HA 1 19 SER H 2.900 . 4.000 2.878 2.224 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 6 SER HB2 1 7 THR H 2.800 . 3.800 3.965 3.588 4.394 0.594 24 5 "[ - * . * 2 +.* 3]" 1
1090 1 6 SER QB 1 7 THR MG 4.000 . 6.000 5.275 4.960 5.621 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 6 SER QB 1 8 ALA MB 3.800 . 5.600 5.365 4.824 5.990 0.390 17 0 "[ . 1 . 2 . 3]" 1
1092 1 4 PRO QG 1 6 SER QB 4.100 . 6.000 4.373 3.706 5.132 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 4 PRO QB 1 6 SER QB 4.300 . 6.000 3.550 3.275 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 2 LEU H 1 5 PRO HA 2.300 . 3.000 2.165 2.118 2.990 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 3 LEU H 1 4 PRO QD 1.900 . 2.300 3.695 3.254 4.023 1.723 8 30 [*******+***-******************] 1
1096 1 2 LEU H 1 4 PRO QG 4.200 . 6.000 4.267 3.550 4.452 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 4 PRO QD 1 4 PRO QG 1.900 . 2.400 1.753 1.747 1.759 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 1 PHE HA 1 4 PRO QD 4.300 . 6.000 2.854 2.253 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 4 PRO QB 1 4 PRO QG 1.900 . 2.300 1.968 1.955 1.974 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 4 PRO QB 1 4 PRO QG 1.800 . 2.200 1.968 1.955 1.974 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 2 LEU QD 1 4 PRO QB 4.400 . 6.000 3.887 3.349 4.493 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 2 LEU QD 1 4 PRO QG 3.700 . 5.400 3.461 2.918 4.007 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 2 LEU QD 1 3 LEU HA 2.000 . 2.500 1.723 1.593 1.996 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 3 LEU HG 1 76 LEU HA 2.200 . 2.800 2.272 2.137 2.406 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 2 LEU QB 1 3 LEU HA 2.000 . 2.500 2.126 2.009 2.187 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 3 LEU HA 1 4 PRO QD 2.300 . 3.000 1.850 1.772 1.909 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 3 LEU HA 1 4 PRO QD 2.700 . 3.600 1.850 1.772 1.909 0.028 16 0 "[ . 1 . 2 . 3]" 1
1108 1 3 LEU H 1 76 LEU HA 2.200 . 2.800 2.820 2.246 2.929 0.129 7 0 "[ . 1 . 2 . 3]" 1
1109 1 3 LEU HG 1 4 PRO QD 4.500 . 6.000 2.731 1.460 4.473 0.540 21 1 "[ . 1 . 2+ . 3]" 1
1110 1 3 LEU HG 1 5 PRO QD 4.400 . 6.000 3.896 1.920 4.491 0.080 20 0 "[ . 1 . 2 . 3]" 1
1111 1 3 LEU HG 1 4 PRO QD 4.000 . 6.000 3.658 1.919 4.158 0.081 20 0 "[ . 1 . 2 . 3]" 1
1112 1 22 LEU HG 1 23 LEU QD 4.200 . 6.000 3.662 2.621 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 3 LEU QD 1 4 PRO QB 3.700 . 5.400 3.259 2.238 3.590 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 1 PHE QE 1 3 LEU QD 3.900 . 5.800 2.802 1.886 4.193 0.114 10 0 "[ . 1 . 2 . 3]" 1
1115 1 2 LEU QD 1 3 LEU H 2.100 . 2.600 1.988 1.497 2.391 0.103 23 0 "[ . 1 . 2 . 3]" 1
1116 1 2 LEU HA 1 3 LEU H 1.600 . 2.200 2.214 2.146 2.263 0.063 21 0 "[ . 1 . 2 . 3]" 1
1117 1 2 LEU HG 1 3 LEU HA 4.100 . 6.000 4.017 3.087 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 1 PHE QD 1 2 LEU QD 3.700 . 5.400 2.407 1.651 2.707 0.349 11 0 "[ . 1 . 2 . 3]" 1
1119 1 2 LEU QD 1 12 GLN QE 2.200 . 2.800 2.402 1.807 3.023 0.223 2 0 "[ . 1 . 2 . 3]" 1
1120 1 1 PHE QB 1 2 LEU QD 3.100 . 4.300 4.541 3.115 5.456 1.156 12 9 "[ *. 1 +* .**- 2 * . **3]" 1
1121 1 2 LEU QD 1 5 PRO QB 3.200 . 4.500 3.332 2.234 3.750 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 2 LEU QD 1 4 PRO QG 3.600 . 5.200 2.892 2.076 3.518 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 2 LEU QD 1 4 PRO QB 3.300 . 4.600 3.217 2.095 4.127 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 1 PHE QB 1 2 LEU QB 4.500 . 6.000 4.577 3.857 4.931 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 7 THR HA 1 87 MET QG 2.300 . 3.000 3.563 2.317 4.620 1.620 25 18 "[*** * * *1* * * -**2* **+ * *]" 1
1126 1 4 PRO QG 1 85 ARG HA 3.700 . 5.400 4.086 2.509 4.333 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 3 LEU HA 1 68 GLN QG 3.700 . 5.400 3.945 3.382 4.322 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 2 LEU QB 1 84 LEU HA 1.900 . 2.400 2.239 2.114 2.470 0.070 8 0 "[ . 1 . 2 . 3]" 1
1129 1 23 LEU QD 1 64 TRP HE3 2.300 . 3.000 2.347 2.075 2.613 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 1 PHE QE 1 2 LEU QD 4.400 . 6.000 2.893 1.891 4.237 0.109 10 0 "[ . 1 . 2 . 3]" 1
1131 1 35 ASP H 1 63 GLN HA 3.500 . 5.000 3.421 3.181 3.754 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 22 LEU HA 1 64 TRP QB 4.000 . 6.000 2.401 1.955 2.702 0.045 17 0 "[ . 1 . 2 . 3]" 1
1133 1 22 LEU HA 1 64 TRP QB 3.400 . 4.900 2.407 1.956 2.712 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 9 CYS HA 1 60 SER QB 4.200 . 6.000 2.115 1.414 3.033 0.586 4 2 "[ +. 1 . 2 . - 3]" 1
1135 1 9 CYS QB 1 35 ASP HA 3.100 . 4.300 5.425 4.860 5.704 1.404 22 30 [************-********+********] 1
1136 1 5 PRO QB 1 18 LEU QD 3.600 . 5.200 2.665 1.718 3.364 0.282 2 0 "[ . 1 . 2 . 3]" 1
1137 1 9 CYS QB 1 40 LEU QD 4.300 . 6.000 3.239 1.835 4.003 0.065 24 0 "[ . 1 . 2 . 3]" 1
1138 1 1 PHE HA 1 4 PRO QD 4.200 . 6.000 5.852 5.349 5.926 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 2 LEU HA 1 53 CYS QB 3.600 . 5.200 2.612 2.070 3.249 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 2 LEU HA 1 53 CYS QB 3.400 . 4.800 2.607 2.070 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 4 PRO QB 1 29 VAL HB 3.200 . 4.500 5.136 4.628 5.468 0.968 18 19 "[*-**.******** ** +*2 * * *]" 1
1142 1 9 CYS QB 1 45 LEU HG 4.400 . 6.000 3.375 2.595 4.584 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 1 PHE HZ 1 2 LEU QD 2.500 . 3.300 3.834 2.444 5.617 2.317 29 13 "[ ***** 1*- * 2* **. +*]" 1
1144 1 3 LEU HA 1 38 CYS QB 3.400 . 4.900 2.503 1.656 3.644 0.244 24 0 "[ . 1 . 2 . 3]" 1
1145 1 50 ARG QB 1 77 PRO QD 2.000 . 2.500 2.213 2.182 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 42 ALA HA 1 56 PRO QD 3.300 . 4.700 1.865 1.670 2.443 0.230 22 0 "[ . 1 . 2 . 3]" 1
1147 1 31 LEU H 1 31 LEU HA 2.300 . 3.000 2.070 2.036 2.101 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 50 ARG H 1 51 SER HA 4.400 . 6.000 4.680 4.493 5.024 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 45 LEU H 1 51 SER HA 5.800 . 6.000 4.892 4.644 5.353 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 23 LEU QD 1 26 VAL H 2.900 . 4.000 4.534 3.967 4.875 0.875 14 18 "[ ***. * 1 **+**** * -**** *3]" 1
1151 1 22 LEU H 1 23 LEU QD 4.300 . 6.000 4.584 3.756 5.137 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 18 LEU H 1 23 LEU QD 3.100 . 4.300 3.614 2.991 4.203 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 64 TRP HE1 1 68 GLN QE 2.800 . 3.800 3.696 2.337 5.741 1.941 14 11 "[ .*- *1** +* * 2* * * 3]" 1
1154 1 87 MET H 1 88 GLY H 3.000 . 4.100 2.252 1.934 3.248 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 82 GLY H 1 83 MET H 3.400 . 4.900 2.661 2.056 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 81 PHE H 1 82 GLY H 3.300 . 4.600 2.719 2.208 3.464 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 75 THR H 1 76 LEU H 3.200 . 4.500 4.268 3.947 4.522 0.022 6 0 "[ . 1 . 2 . 3]" 1
1158 1 74 GLY H 1 75 THR H 3.400 . 4.800 2.482 1.924 2.896 0.076 11 0 "[ . 1 . 2 . 3]" 1
1159 1 72 LEU H 1 73 HIS H 3.700 . 5.400 3.760 2.688 4.454 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 69 GLU H 1 70 ARG H 3.600 . 5.200 2.656 2.560 2.787 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 68 GLN H 1 69 GLU H 3.700 . 5.400 2.533 2.371 2.663 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 65 PHE H 1 66 GLU H 3.500 . 5.000 2.788 2.618 2.932 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 64 TRP H 1 65 PHE H 3.600 . 5.200 2.654 2.543 2.862 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 63 GLN H 1 64 TRP H 3.700 . 5.500 2.628 2.533 2.722 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 62 SER H 1 63 GLN H 3.400 . 4.900 2.725 2.497 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 61 LEU H 1 62 SER H 3.500 . 5.100 2.510 2.395 2.681 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 60 SER H 1 61 LEU H 3.500 . 5.100 2.671 2.360 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 43 PHE H 1 54 ILE H 2.600 . 3.400 3.794 3.338 4.545 1.145 29 12 "[* * * *1 *-** * 2 * . *+3]" 1
1169 1 53 CYS H 1 54 ILE H 4.200 . 6.000 4.397 4.354 4.492 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 52 ILE H 1 53 CYS H 4.400 . 6.000 4.437 4.342 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 51 SER H 1 52 ILE H 3.800 . 5.600 4.348 4.068 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 50 ARG H 1 51 SER H 3.000 . 4.100 4.366 4.206 4.483 0.383 22 0 "[ . 1 . 2 . 3]" 1
1173 1 49 GLN H 1 50 ARG H 2.500 . 3.300 2.046 1.815 2.300 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 48 ALA H 1 49 GLN H 3.200 . 4.500 2.735 2.483 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 46 HIS H 1 47 LEU H 4.300 . 6.000 4.178 4.078 4.284 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 44 VAL H 1 45 LEU H 4.600 . 6.000 4.435 4.254 4.531 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 43 PHE H 1 44 VAL H 5.200 . 6.000 4.239 4.039 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 57 GLN H 1 58 ASN H 3.500 . 5.000 3.216 2.381 3.913 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 42 ALA H 1 43 PHE H 5.200 . 6.000 4.279 4.055 4.418 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 41 GLN H 1 42 ALA H 3.700 . 5.400 4.474 4.318 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 39 HIS H 1 40 LEU H 4.100 . 6.000 3.046 2.074 4.616 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 38 CYS H 1 39 HIS H 3.300 . 4.700 4.371 4.238 4.538 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 37 ASP H 1 38 CYS H 2.900 . 3.900 2.410 1.986 3.456 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 36 GLY H 1 37 ASP H 3.800 . 5.600 3.127 2.516 4.305 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 35 ASP H 1 36 GLY H 3.400 . 4.800 1.908 1.417 4.129 0.583 24 1 "[ . 1 . 2 +. 3]" 1
1186 1 34 ALA H 1 35 ASP H 3.800 . 5.600 2.757 2.518 3.260 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 33 GLU H 1 34 ALA H 4.300 . 6.000 4.592 4.515 4.635 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 32 GLN H 1 33 GLU H 3.300 . 4.700 4.321 4.221 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 30 GLU H 1 31 LEU H 3.600 . 5.200 4.389 4.121 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 29 VAL H 1 30 GLU H 4.900 . 6.000 4.336 4.211 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 28 GLN H 1 29 VAL H 5.100 . 6.000 4.360 4.249 4.411 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 27 ILE H 1 28 GLN H 3.100 . 4.300 2.222 1.823 2.638 0.077 14 0 "[ . 1 . 2 . 3]" 1
1193 1 26 VAL H 1 27 ILE H 4.500 . 6.000 4.443 4.051 4.645 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 25 LYS H 1 26 VAL H 2.700 . 3.600 2.162 1.966 2.482 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 24 ARG H 1 25 LYS H 3.300 . 4.700 2.728 2.618 2.870 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 23 LEU H 1 24 ARG H 3.000 . 4.100 2.751 2.622 2.861 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 22 LEU H 1 23 LEU H 2.300 . 2.900 2.429 2.318 2.497 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 21 LYS H 1 22 LEU H 3.500 . 5.000 2.790 2.634 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 20 ASP H 1 21 LYS H 2.900 . 3.900 2.654 2.562 2.742 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 19 SER H 1 20 ASP H 4.000 . 6.000 4.580 4.505 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 18 LEU H 1 19 SER H 4.400 . 6.000 4.568 4.516 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 13 LEU H 1 14 TYR H 4.600 . 6.000 4.396 4.217 4.616 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 12 GLN H 1 13 LEU H 4.300 . 6.000 4.340 3.729 4.606 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 11 THR H 1 12 GLN H 3.200 . 4.400 2.301 1.947 2.570 0.053 20 0 "[ . 1 . 2 . 3]" 1
1205 1 10 CYS H 1 11 THR H 4.300 . 6.000 4.402 4.237 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 9 CYS H 1 10 CYS H 4.200 . 6.000 3.424 2.454 4.006 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 6 SER H 1 7 THR H 3.500 . 5.000 2.578 1.878 2.741 0.122 23 0 "[ . 1 . 2 . 3]" 1
1208 1 2 LEU H 1 3 LEU H 4.800 . 6.000 4.382 3.890 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 88 GLY H 1 88 GLY QA 2.300 . 3.000 2.399 2.257 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 87 MET HA 1 88 GLY H 2.100 . 2.700 3.265 2.253 3.509 0.809 17 22 "[ * ******1** ** +*** *-*.* ***]" 1
1211 1 87 MET QG 1 88 GLY H 3.200 . 4.500 4.096 2.721 4.773 0.273 10 0 "[ . 1 . 2 . 3]" 1
1212 1 87 MET QB 1 88 GLY H 4.100 . 6.000 3.137 2.409 3.840 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 87 MET H 1 87 MET HA 2.300 . 2.900 2.850 2.242 2.950 0.050 23 0 "[ . 1 . 2 . 3]" 1
1214 1 87 MET H 1 87 MET QG 3.600 . 5.200 3.001 2.199 4.112 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 87 MET H 1 87 MET QB 3.100 . 3.100 2.530 2.218 3.433 0.333 16 0 "[ . 1 . 2 . 3]" 1
1216 1 85 ARG QB 1 87 MET H 2.200 . 2.800 4.175 3.038 4.551 1.751 30 29 "[-********************* ******+]" 1
1217 1 86 LYS HA 1 87 MET H 2.400 . 3.100 3.184 2.846 3.469 0.369 25 0 "[ . 1 . 2 . 3]" 1
1218 1 85 ARG H 1 85 ARG QD 4.300 . 6.000 4.083 3.438 4.752 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 85 ARG H 1 85 ARG QB 2.800 . 3.000 2.500 2.273 3.282 0.282 23 0 "[ . 1 . 2 . 3]" 1
1220 1 84 LEU H 1 84 LEU HA 2.500 . 3.300 2.896 2.258 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 83 MET HA 1 84 LEU H 2.500 . 3.300 3.302 2.198 3.504 0.204 2 0 "[ . 1 . 2 . 3]" 1
1222 1 83 MET HG3 1 84 LEU H 3.800 . 5.600 3.863 2.679 5.273 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 83 MET QB 1 84 LEU H 4.200 . 4.200 3.584 1.955 3.998 0.045 26 0 "[ . 1 . 2 . 3]" 1
1224 1 83 MET H 1 83 MET HA 2.600 . 3.400 2.821 2.233 2.938 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 83 MET H 1 83 MET HG2 3.500 . 5.000 3.159 2.011 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 83 MET H 1 83 MET HG3 3.000 . 4.100 3.166 1.902 4.408 0.308 29 0 "[ . 1 . 2 . 3]" 1
1227 1 83 MET H 1 83 MET QB 3.100 . 3.600 2.632 2.191 3.452 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 82 GLY QA 1 83 MET H 2.500 . 3.300 2.820 2.219 2.929 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 82 GLY H 1 82 GLY QA 2.500 . 3.300 2.234 2.191 2.467 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 81 PHE HA 1 82 GLY H 2.800 . 3.800 3.101 2.173 3.457 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 81 PHE QB 1 82 GLY H 3.500 . 5.000 3.719 3.030 4.034 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 81 PHE H 1 81 PHE HA 2.600 . 3.500 2.856 2.253 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 81 PHE H 1 81 PHE QB 3.300 . 3.300 2.650 2.232 3.354 0.054 30 0 "[ . 1 . 2 . 3]" 1
1234 1 80 ASN QB 1 81 PHE H 3.100 . 4.300 3.803 3.062 4.030 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 80 ASN HA 1 81 PHE H 2.500 . 3.300 2.536 2.127 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 80 ASN H 1 80 ASN HA 2.400 . 3.100 2.519 2.240 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 80 ASN H 1 80 ASN QB 2.700 . 3.600 3.024 2.356 3.421 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 79 LEU QB 1 80 ASN H 2.700 . 3.600 3.290 1.731 3.839 0.239 15 0 "[ . 1 . 2 . 3]" 1
1239 1 79 LEU QB 1 80 ASN H 4.100 . 6.000 3.539 1.733 4.005 0.267 30 0 "[ . 1 . 2 . 3]" 1
1240 1 86 LYS QB 1 87 MET H . . 4.100 3.417 2.765 3.756 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 85 ARG QG 1 86 LYS H 3.300 . 4.700 4.209 3.625 4.852 0.152 24 0 "[ . 1 . 2 . 3]" 1
1242 1 83 MET HG2 1 84 LEU H 5.100 . 6.000 3.806 2.636 5.225 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 81 PHE QD 1 82 GLY H 4.000 . 6.000 4.219 2.775 4.993 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 81 PHE H 1 81 PHE QD 3.200 . 4.500 2.663 1.851 3.558 0.049 2 0 "[ . 1 . 2 . 3]" 1
1245 1 80 ASN H 1 81 PHE QD 5.100 . 6.000 4.027 2.892 5.336 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 80 ASN H 1 80 ASN QD 6.000 . 6.000 3.399 1.968 4.911 0.032 5 0 "[ . 1 . 2 . 3]" 1
1247 1 79 LEU HA 1 80 ASN H 2.200 . 2.800 2.705 2.067 3.214 0.414 7 0 "[ . 1 . 2 . 3]" 1
1248 1 79 LEU H 1 79 LEU QB 2.700 . 3.600 2.211 1.713 2.751 0.087 12 0 "[ . 1 . 2 . 3]" 1
1249 1 79 LEU H 1 79 LEU QB 2.600 . 3.500 2.750 2.259 3.317 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 78 LYS H 1 78 LYS HA 2.700 . 3.600 2.890 2.851 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 77 PRO QD 1 78 LYS H 2.800 . 3.700 4.871 4.581 5.022 1.322 16 30 [***-***********+**************] 1
1252 1 77 PRO QB 1 78 LYS H 3.000 . 4.100 2.832 1.838 3.601 0.062 26 0 "[ . 1 . 2 . 3]" 1
1253 1 77 PRO QG 1 78 LYS H 4.200 . 6.000 4.219 3.312 4.715 . 0 0 "[ . 1 . 2 . 3]" 1
1254 1 74 GLY QA 1 75 THR H 2.400 . 3.100 2.820 2.431 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 75 THR H 1 75 THR HB 2.900 . 3.900 3.601 3.038 4.082 0.182 7 0 "[ . 1 . 2 . 3]" 1
1256 1 75 THR H 1 75 THR HA 2.800 . 3.800 2.882 2.225 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 73 HIS HA 1 75 THR H 2.600 . 3.400 4.469 3.348 5.420 2.020 14 29 "[****** ******+*******-********]" 1
1258 1 73 HIS QB 1 75 THR H 2.900 . 3.900 3.089 2.364 5.258 1.358 9 2 "[ . - +1 . 2 . 3]" 1
1259 1 75 THR H 1 75 THR MG 2.900 . 4.000 2.871 2.501 3.864 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 73 HIS HA 1 74 GLY H 2.800 . 3.800 3.210 2.895 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 73 HIS QB 1 74 GLY H 3.900 . 5.800 3.420 2.605 4.020 . 0 0 "[ . 1 . 2 . 3]" 1
1262 1 73 HIS H 1 73 HIS HA 2.800 . 3.800 2.651 2.241 2.935 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 72 LEU HA 1 73 HIS H 3.100 . 4.300 3.265 2.143 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 73 HIS H 1 73 HIS QB 3.100 . 4.100 2.943 2.580 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 72 LEU QB 1 73 HIS H 4.200 . 6.000 2.531 1.736 3.932 0.264 25 0 "[ . 1 . 2 . 3]" 1
1266 1 72 LEU H 1 72 LEU QB 2.500 . 3.300 3.176 2.824 3.424 0.124 23 0 "[ . 1 . 2 . 3]" 1
1267 1 70 ARG QD 1 71 LYS H 4.000 . 6.000 5.494 5.048 5.777 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 70 ARG H 1 70 ARG HA 2.800 . 3.800 2.942 2.926 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 67 HIS HA 1 70 ARG H 2.700 . 3.600 3.425 3.168 3.637 0.037 30 0 "[ . 1 . 2 . 3]" 1
1270 1 70 ARG H 1 70 ARG QD 4.500 . 6.000 3.981 3.668 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 69 GLU QG 1 70 ARG H 4.300 . 6.000 3.802 3.519 3.943 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 65 PHE HA 1 69 GLU H 2.700 . 3.600 4.337 3.969 4.643 1.043 12 28 "[****.***** +**-***************]" 1
1273 1 67 HIS HA 1 69 GLU H 2.800 . 3.800 4.130 3.882 4.372 0.572 7 1 "[ . + 1 . 2 . 3]" 1
1274 1 67 HIS QB 1 69 GLU H 2.900 . 4.000 4.581 4.416 4.770 0.770 15 25 "[*** *** ******+***-* * ******]" 1
1275 1 69 GLU H 1 69 GLU QG 3.500 . 5.000 3.989 3.946 4.065 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 67 HIS HA 1 68 GLN H 3.100 . 4.300 3.548 3.509 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 68 GLN H 1 68 GLN HA 3.000 . 4.100 2.838 2.806 2.890 . 0 0 "[ . 1 . 2 . 3]" 1
1278 1 65 PHE HA 1 68 GLN H 2.700 . 3.600 3.840 3.559 4.094 0.494 22 0 "[ . 1 . 2 . 3]" 1
1279 1 67 HIS QB 1 68 GLN H 3.800 . 5.600 2.716 2.517 3.036 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 68 GLN H 1 68 GLN QB 3.600 . 5.200 2.102 2.030 2.239 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 68 GLN H 1 68 GLN QB 3.000 . 4.100 2.429 2.138 2.626 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 66 GLU HA 1 67 HIS H 3.200 . 4.500 3.533 3.507 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
1283 1 65 PHE QB 1 66 GLU H 3.700 . 5.000 2.594 2.309 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 65 PHE HA 1 66 GLU H 3.100 . 4.300 3.541 3.496 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 66 GLU H 1 66 GLU HA 2.700 . 3.600 2.853 2.813 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 64 TRP HA 1 66 GLU H 2.800 . 3.800 4.227 4.030 4.448 0.648 18 7 "[ * . - *1 * . + 2 .* *]" 1
1287 1 65 PHE H 1 65 PHE QD 4.400 . 6.000 2.823 2.112 3.401 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 65 PHE QD 1 66 GLU H 3.700 . 5.400 4.434 4.217 4.637 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 68 GLN H 1 68 GLN QE 6.000 . 6.000 4.179 3.390 4.943 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 64 TRP H 1 64 TRP QB 3.500 . 3.800 2.296 2.265 2.318 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 64 TRP H 1 64 TRP HA 3.000 . 4.100 2.818 2.782 2.841 . 0 0 "[ . 1 . 2 . 3]" 1
1292 1 63 GLN QG 1 64 TRP H 3.300 . 4.600 3.617 2.187 4.302 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 60 SER HA 1 63 GLN H 2.700 . 3.600 3.870 3.481 4.352 0.752 10 4 "[ * + . 2 *. -]" 1
1294 1 62 SER QB 1 63 GLN H 4.400 . 6.000 2.434 2.287 3.226 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 62 SER H 1 62 SER HA 2.700 . 3.600 2.814 2.786 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
1296 1 59 PRO HA 1 62 SER H 2.400 . 3.100 3.634 3.072 4.256 1.156 24 17 "[ *** * ** * *- * ****+* * 3]" 1
1297 1 61 LEU QD 1 62 SER H 3.500 . 4.500 3.637 3.416 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
1298 1 61 LEU QB 1 62 SER H 3.500 . 5.000 2.505 2.284 2.703 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 61 LEU HG 1 62 SER H 4.800 . 6.000 4.874 3.944 5.160 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 60 SER HA 1 61 LEU H 3.600 . 5.200 3.513 3.442 3.565 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 61 LEU H 1 61 LEU HA 3.000 . 4.100 2.870 2.805 2.890 . 0 0 "[ . 1 . 2 . 3]" 1
1302 1 60 SER QB 1 61 LEU H 4.900 . 5.400 2.821 2.140 3.462 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 58 ASN QB 1 61 LEU H 2.700 . 3.600 2.867 2.348 3.220 . 0 0 "[ . 1 . 2 . 3]" 1
1304 1 61 LEU H 1 61 LEU QB 3.100 . 4.000 2.186 2.075 2.267 . 0 0 "[ . 1 . 2 . 3]" 1
1305 1 61 LEU H 1 61 LEU QD 4.500 . 6.000 3.555 3.372 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 58 ASN HA 1 60 SER H 2.900 . 4.000 3.983 3.394 4.366 0.366 25 0 "[ . 1 . 2 . 3]" 1
1307 1 59 PRO QD 1 60 SER H 2.600 . 3.500 2.961 2.680 3.299 . 0 0 "[ . 1 . 2 . 3]" 1
1308 1 60 SER H 1 60 SER QB 3.300 . 4.600 2.409 2.219 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 59 PRO QB 1 60 SER H 5.700 . 6.000 2.839 2.352 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 58 ASN H 1 58 ASN HA 3.000 . 4.200 2.920 2.830 2.952 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 57 GLN HA 1 58 ASN H 3.100 . 4.300 2.660 2.279 3.297 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 58 ASN H 1 58 ASN QB 3.100 . 3.500 2.476 2.092 2.694 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 57 GLN QB 1 58 ASN H 3.900 . 5.800 3.608 3.317 3.742 . 0 0 "[ . 1 . 2 . 3]" 1
1314 1 57 GLN QB 1 58 ASN H 3.300 . 4.600 3.777 3.406 4.025 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 54 ILE MG 1 58 ASN H 2.200 . 2.800 3.936 3.138 4.696 1.896 27 28 "[*** ***************2**-***+***]" 1
1316 1 58 ASN H 1 58 ASN QD 4.900 . 6.000 4.707 4.354 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 55 HIS HE1 1 57 GLN H 2.800 . 3.800 4.666 3.275 6.079 2.279 20 15 "[ * *. ** 1*** ** * + *- * *]" 1
1318 1 57 GLN H 1 57 GLN QB 3.600 . 5.200 2.503 2.076 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 56 PRO HA 1 57 GLN H 4.500 . 6.000 3.014 2.171 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 54 ILE HA 1 55 HIS H 4.000 . 6.000 2.214 2.134 2.341 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 55 HIS H 1 55 HIS QB 4.200 . 6.000 2.293 2.166 2.645 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 53 CYS HA 1 54 ILE H 2.800 . 3.800 2.120 2.078 2.153 . 0 0 "[ . 1 . 2 . 3]" 1
1323 1 44 VAL HA 1 54 ILE H 2.500 . 3.300 2.598 2.245 3.057 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 53 CYS QB 1 54 ILE H 5.000 . 6.000 3.397 3.149 3.831 . 0 0 "[ . 1 . 2 . 3]" 1
1325 1 54 ILE H 1 54 ILE HB 3.200 . 4.500 2.470 2.219 2.723 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 54 ILE H 1 54 ILE MD 4.200 . 6.000 4.319 4.166 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 52 ILE HA 1 53 CYS H 2.500 . 3.300 2.241 2.164 2.320 . 0 0 "[ . 1 . 2 . 3]" 1
1328 1 52 ILE HB 1 53 CYS H 4.100 . 6.000 4.018 3.833 4.206 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 52 ILE QG 1 53 CYS H 2.600 . 3.500 4.114 3.961 4.232 0.732 23 29 "[*********** **********+***-***]" 1
1330 1 53 CYS H 1 53 CYS QB 3.800 . 5.600 2.483 2.332 2.627 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 45 LEU H 1 52 ILE H 3.800 . 5.600 3.193 2.830 3.643 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 51 SER HA 1 52 ILE H 3.000 . 4.100 2.193 2.122 2.326 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 46 HIS HA 1 52 ILE H 2.400 . 3.100 3.675 3.173 3.957 0.857 30 21 "[* ******* * *. **-* ******+]" 1
1334 1 52 ILE H 1 52 ILE HA 3.000 . 4.200 2.951 2.940 2.958 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 52 ILE H 1 52 ILE HB 3.000 . 4.200 2.650 2.552 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
1336 1 52 ILE H 1 52 ILE QG 2.800 . 3.800 2.813 2.473 3.675 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 52 ILE H 1 52 ILE MG 4.000 . 6.000 3.857 3.795 3.897 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 44 VAL QG 1 52 ILE H 2.300 . 3.000 3.097 2.684 3.863 0.863 29 2 "[- . 1 . 2 . +3]" 1
1339 1 51 SER H 1 51 SER HA 2.900 . 4.000 2.931 2.888 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 50 ARG HA 1 51 SER H 2.100 . 2.700 2.436 2.247 2.593 . 0 0 "[ . 1 . 2 . 3]" 1
1341 1 50 ARG QG 1 51 SER H 2.200 . 2.800 3.743 3.139 4.367 1.567 26 23 "[****.* *** ****** *2 ****+* -*]" 1
1342 1 48 ALA H 1 50 ARG H 3.900 . 5.800 4.103 3.142 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 47 LEU H 1 50 ARG H 2.100 . 2.700 3.592 3.281 3.875 1.175 2 30 [*+*************-**************] 1
1344 1 50 ARG H 1 50 ARG HA 2.400 . 3.100 2.864 2.805 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 49 GLN HA 1 50 ARG H 2.600 . 3.400 3.393 3.127 3.568 0.168 3 0 "[ . 1 . 2 . 3]" 1
1346 1 48 ALA HA 1 50 ARG H 4.200 . 6.000 4.487 4.015 5.021 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 47 LEU QB 1 50 ARG H 1.800 . 2.200 2.397 2.085 2.777 0.577 24 2 "[ . - 1 . 2 +. 3]" 1
1348 1 50 ARG H 1 50 ARG QG 2.900 . 4.000 2.779 2.383 3.326 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 50 ARG H 1 50 ARG QB 2.400 . 3.100 3.189 2.477 3.397 0.297 25 0 "[ . 1 . 2 . 3]" 1
1350 1 49 GLN H 1 49 GLN HA 2.400 . 3.100 2.928 2.876 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 48 ALA HA 1 49 GLN H 2.500 . 3.300 3.355 3.045 3.593 0.293 27 0 "[ . 1 . 2 . 3]" 1
1352 1 49 GLN H 1 49 GLN QB 2.600 . 3.500 2.839 2.503 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
1353 1 48 ALA MB 1 49 GLN H 3.200 . 4.500 3.063 1.932 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 47 LEU HA 1 48 ALA H 2.300 . 3.000 2.496 2.366 3.194 0.194 27 0 "[ . 1 . 2 . 3]" 1
1355 1 48 ALA H 1 48 ALA HA 2.200 . 2.800 2.798 2.304 2.885 0.085 24 0 "[ . 1 . 2 . 3]" 1
1356 1 47 LEU QB 1 48 ALA H 3.100 . 4.300 2.370 2.126 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
1357 1 47 LEU HG 1 48 ALA H 2.600 . 3.400 4.146 3.882 4.944 1.544 27 29 "[***********-***** ********+***]" 1
1358 1 48 ALA H 1 48 ALA MB 2.500 . 3.300 2.295 2.191 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1359 1 46 HIS QB 1 47 LEU H 4.000 . 4.700 3.918 3.771 4.001 . 0 0 "[ . 1 . 2 . 3]" 1
1360 1 47 LEU H 1 47 LEU QB 2.800 . 3.800 2.413 2.238 2.483 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 47 LEU H 1 47 LEU HG 3.800 . 5.600 3.582 3.391 3.777 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 47 LEU H 1 47 LEU QD 3.700 . 5.400 2.015 1.835 2.203 0.165 1 0 "[ . 1 . 2 . 3]" 1
1363 1 28 GLN H 1 46 HIS H 2.400 . 3.100 3.590 3.377 3.882 0.782 24 15 "[* ***** -* * .* * +* * *3]" 1
1364 1 29 VAL HA 1 46 HIS H 2.400 . 3.100 2.986 2.609 3.503 0.403 18 0 "[ . 1 . 2 . 3]" 1
1365 1 46 HIS H 1 46 HIS HA 2.900 . 3.900 2.934 2.904 2.948 . 0 0 "[ . 1 . 2 . 3]" 1
1366 1 45 LEU HA 1 46 HIS H 2.800 . 3.800 2.116 2.082 2.157 . 0 0 "[ . 1 . 2 . 3]" 1
1367 1 46 HIS H 1 46 HIS QB 2.500 . 3.300 2.369 2.297 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
1368 1 45 LEU QB 1 46 HIS H 2.200 . 2.800 3.219 3.019 3.484 0.684 17 8 "[ - ** 1 . + 2 * ** *3]" 1
1369 1 26 VAL QG 1 46 HIS H 2.100 . 2.700 2.596 2.358 2.926 0.226 25 0 "[ . 1 . 2 . 3]" 1
1370 1 44 VAL QG 1 46 HIS H 2.800 . 3.800 4.254 3.809 4.575 0.775 21 14 "[* . ***- **** **+ . ** 3]" 1
1371 1 45 LEU H 1 53 CYS HA 4.200 . 6.000 3.549 2.921 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
1372 1 44 VAL HB 1 45 LEU H 4.800 . 6.000 4.071 3.019 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 45 LEU H 1 45 LEU QB 3.500 . 5.000 2.434 2.335 2.539 . 0 0 "[ . 1 . 2 . 3]" 1
1374 1 31 LEU H 1 44 VAL H 2.800 . 3.800 4.838 4.287 5.286 1.486 4 29 "[***+********************** *-*]" 1
1375 1 43 PHE QD 1 44 VAL H 3.800 . 5.600 3.998 3.416 4.408 . 0 0 "[ . 1 . 2 . 3]" 1
1376 1 43 PHE HA 1 44 VAL H 2.500 . 3.300 2.140 2.104 2.206 . 0 0 "[ . 1 . 2 . 3]" 1
1377 1 43 PHE QB 1 44 VAL H 4.000 . 6.000 3.521 3.196 3.675 . 0 0 "[ . 1 . 2 . 3]" 1
1378 1 44 VAL H 1 44 VAL HB 3.200 . 4.500 2.609 2.465 3.766 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 44 VAL H 1 44 VAL QG 3.400 . 4.700 2.396 2.060 2.618 . 0 0 "[ . 1 . 2 . 3]" 1
1380 1 43 PHE H 1 43 PHE QD 4.500 . 6.000 3.156 2.558 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
1381 1 43 PHE H 1 43 PHE QB 3.300 . 4.700 2.309 2.163 2.545 . 0 0 "[ . 1 . 2 . 3]" 1
1382 1 32 GLN H 1 42 ALA H 2.300 . 3.000 3.186 2.729 3.592 0.592 7 2 "[ . + - . 2 . 3]" 1
1383 1 41 GLN HA 1 42 ALA H 2.500 . 3.300 2.162 2.087 2.232 . 0 0 "[ . 1 . 2 . 3]" 1
1384 1 41 GLN QG 1 42 ALA H . . 2.500 2.668 2.327 3.049 0.549 5 2 "[ + 1 . 2 - 3]" 1
1385 1 41 GLN QB 1 42 ALA H 3.600 . 5.200 3.695 3.524 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
1386 1 40 LEU HA 1 41 GLN H 2.600 . 3.400 2.287 2.126 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 41 GLN H 1 41 GLN QG 5.300 . 6.000 4.015 3.987 4.069 . 0 0 "[ . 1 . 2 . 3]" 1
1388 1 39 HIS HA 1 40 LEU H 3.600 . 5.300 2.883 2.255 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 40 LEU H 1 40 LEU QB 4.700 . 6.000 2.969 2.506 3.372 . 0 0 "[ . 1 . 2 . 3]" 1
1390 1 39 HIS H 1 39 HIS QB 4.200 . 5.800 2.667 2.266 3.015 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 38 CYS QB 1 39 HIS H 5.400 . 6.000 2.724 1.906 3.603 . 0 0 "[ . 1 . 2 . 3]" 1
1392 1 37 ASP HA 1 38 CYS H 3.700 . 5.500 3.481 3.165 3.560 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 36 GLY QA 1 38 CYS H . . 3.500 4.259 3.423 4.905 1.405 14 19 "[* ***** * * +.** -*** **** 3]" 1
1394 1 38 CYS H 1 38 CYS QB 3.600 . 4.300 2.642 2.301 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
1395 1 37 ASP QB 1 38 CYS H 3.200 . 4.500 2.474 1.981 3.529 0.019 25 0 "[ . 1 . 2 . 3]" 1
1396 1 35 ASP H 1 37 ASP H 2.700 . 3.600 3.854 2.686 5.725 2.125 18 10 "[ * . **1* * . + 2 - . ***]" 1
1397 1 35 ASP HA 1 37 ASP H 4.500 . 6.000 4.625 3.428 5.956 . 0 0 "[ . 1 . 2 . 3]" 1
1398 1 37 ASP H 1 37 ASP HA 2.900 . 4.000 2.822 2.264 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 36 GLY QA 1 37 ASP H 2.800 . 3.800 2.540 2.094 2.944 . 0 0 "[ . 1 . 2 . 3]" 1
1400 1 37 ASP H 1 37 ASP QB 3.400 . 4.500 2.618 2.235 3.307 . 0 0 "[ . 1 . 2 . 3]" 1
1401 1 35 ASP HA 1 36 GLY H 4.600 . 6.000 3.306 2.109 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1402 1 35 ASP HB3 1 36 GLY H 4.600 . 6.000 3.420 2.237 4.508 . 0 0 "[ . 1 . 2 . 3]" 1
1403 1 36 GLY H 1 36 GLY QA 4.400 . 4.900 2.225 2.180 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
1404 1 35 ASP H 1 35 ASP HA 2.900 . 3.900 2.845 2.739 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
1405 1 34 ALA HA 1 35 ASP H 2.700 . 3.600 3.167 2.906 3.401 . 0 0 "[ . 1 . 2 . 3]" 1
1406 1 35 ASP H 1 35 ASP HB3 4.100 . 6.000 3.176 2.689 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 33 GLU QB 1 35 ASP H 2.300 . 3.000 2.647 2.177 3.277 0.277 12 0 "[ . 1 . 2 . 3]" 1
1408 1 33 GLU HA 1 34 ALA H 2.600 . 3.400 2.283 2.134 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
1409 1 32 GLN HA 1 33 GLU H 2.400 . 3.100 2.158 2.114 2.206 . 0 0 "[ . 1 . 2 . 3]" 1
1410 1 33 GLU H 1 33 GLU HA 2.900 . 3.900 2.858 2.804 2.926 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 33 GLU H 1 33 GLU QG 3.900 . 4.800 2.306 1.877 3.167 0.123 24 0 "[ . 1 . 2 . 3]" 1
1412 1 33 GLU H 1 33 GLU QB 2.500 . 3.300 2.425 2.192 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
1413 1 32 GLN H 1 32 GLN QG 4.000 . 6.000 3.943 3.846 4.044 . 0 0 "[ . 1 . 2 . 3]" 1
1414 1 32 GLN H 1 32 GLN QB 4.400 . 4.600 2.247 2.181 2.319 . 0 0 "[ . 1 . 2 . 3]" 1
1415 1 31 LEU QB 1 32 GLN H 5.200 . 6.000 3.769 2.882 3.926 . 0 0 "[ . 1 . 2 . 3]" 1
1416 1 31 LEU QD 1 32 GLN H 5.300 . 6.000 2.598 2.180 4.146 . 0 0 "[ . 1 . 2 . 3]" 1
1417 1 31 LEU H 1 43 PHE HA 3.000 . 4.100 5.217 4.692 5.563 1.463 13 30 [************+******-**********] 1
1418 1 30 GLU HA 1 31 LEU H 2.900 . 4.000 2.217 2.075 2.539 . 0 0 "[ . 1 . 2 . 3]" 1
1419 1 31 LEU H 1 31 LEU HA 2.700 . 3.600 2.920 2.863 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
1420 1 30 GLU QG 1 31 LEU H 3.500 . 5.000 4.244 3.757 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 30 GLU QB 1 31 LEU H 2.500 . 3.300 2.899 2.305 3.412 0.112 26 0 "[ . 1 . 2 . 3]" 1
1422 1 30 GLU QB 1 31 LEU H 3.700 . 5.400 2.957 2.317 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 31 LEU H 1 31 LEU QB 2.800 . 3.800 2.407 2.222 3.126 . 0 0 "[ . 1 . 2 . 3]" 1
1424 1 31 LEU H 1 31 LEU QD 5.200 . 5.800 3.666 1.884 3.974 0.116 20 0 "[ . 1 . 2 . 3]" 1
1425 1 31 LEU H 1 31 LEU HG 4.300 . 6.000 4.248 3.151 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
1426 1 28 GLN HA 1 29 VAL H 2.800 . 3.800 2.274 2.144 2.336 . 0 0 "[ . 1 . 2 . 3]" 1
1427 1 28 GLN QG 1 29 VAL H 4.100 . 6.000 4.235 3.685 4.681 . 0 0 "[ . 1 . 2 . 3]" 1
1428 1 29 VAL H 1 29 VAL HB 2.800 . 3.800 2.848 2.604 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
1429 1 29 VAL H 1 29 VAL QG 4.500 . 4.500 2.420 1.940 2.753 . 0 0 "[ . 1 . 2 . 3]" 1
1430 1 28 GLN H 1 47 LEU HA 2.400 . 3.100 4.149 3.801 4.407 1.307 13 30 [**********-*+*****************] 1
1431 1 27 ILE HA 1 28 GLN H 3.100 . 4.300 3.479 3.405 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
1432 1 26 VAL HA 1 28 GLN H 2.200 . 2.800 3.859 3.489 4.197 1.397 25 30 [-***********************+*****] 1
1433 1 28 GLN H 1 28 GLN QG 5.500 . 6.000 3.426 3.006 3.711 . 0 0 "[ . 1 . 2 . 3]" 1
1434 1 28 GLN H 1 28 GLN QB 2.800 . 3.800 2.730 2.617 2.817 . 0 0 "[ . 1 . 2 . 3]" 1
1435 1 27 ILE QG 1 28 GLN H 2.400 . 3.100 2.406 2.022 2.678 . 0 0 "[ . 1 . 2 . 3]" 1
1436 1 26 VAL QG 1 28 GLN H 3.100 . 4.300 2.453 2.119 2.816 . 0 0 "[ . 1 . 2 . 3]" 1
1437 1 24 ARG H 1 26 VAL H 2.600 . 3.500 4.256 4.125 4.420 0.920 29 30 [**-*************************+*] 1
1438 1 25 LYS HA 1 26 VAL H 2.600 . 3.500 3.248 3.121 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
1439 1 24 ARG HA 1 26 VAL H 2.400 . 3.100 3.685 3.531 3.982 0.882 17 24 "[* ************* +- *** ** ***3]" 1
1440 1 26 VAL H 1 26 VAL HA 2.600 . 3.500 2.873 2.812 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
1441 1 22 LEU HA 1 26 VAL H 2.800 . 3.800 5.565 4.974 5.973 2.173 20 30 [****************-**+**********] 1
1442 1 26 VAL H 1 26 VAL HB 2.200 . 2.800 2.484 2.236 2.645 . 0 0 "[ . 1 . 2 . 3]" 1
1443 1 25 LYS QB 1 26 VAL H 4.000 . 6.000 3.392 2.948 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
1444 1 25 LYS QG 1 26 VAL H 4.900 . 4.900 4.331 3.986 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
1445 1 26 VAL H 1 26 VAL QG 2.700 . 3.600 2.244 1.916 2.568 . 0 0 "[ . 1 . 2 . 3]" 1
1446 1 25 LYS H 1 25 LYS HA 2.300 . 3.000 2.935 2.910 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
1447 1 24 ARG HA 1 25 LYS H 3.400 . 4.800 3.270 3.164 3.415 . 0 0 "[ . 1 . 2 . 3]" 1
1448 1 22 LEU HA 1 25 LYS H 2.200 . 2.800 3.847 3.487 4.056 1.256 27 30 [***************-**********+***] 1
1449 1 23 LEU HA 1 25 LYS H 3.600 . 5.200 3.465 3.287 3.740 . 0 0 "[ . 1 . 2 . 3]" 1
1450 1 21 LYS HA 1 25 LYS H 2.900 . 3.900 5.737 5.171 6.061 2.161 27 30 [***************-**********+***] 1
1451 1 25 LYS H 1 25 LYS QE 4.900 . 6.000 3.979 3.347 4.937 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 24 ARG QD 1 25 LYS H 5.500 . 6.000 4.996 4.552 5.239 . 0 0 "[ . 1 . 2 . 3]" 1
1453 1 25 LYS H 1 25 LYS QB 2.600 . 3.400 2.488 2.292 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
1454 1 24 ARG QG 1 25 LYS H 4.200 . 6.000 3.011 2.552 3.223 . 0 0 "[ . 1 . 2 . 3]" 1
1455 1 25 LYS H 1 25 LYS QG 3.600 . 4.900 2.744 2.216 3.237 . 0 0 "[ . 1 . 2 . 3]" 1
1456 1 25 LYS H 1 47 LEU QD 2.000 . 2.500 3.861 3.411 4.198 1.698 13 30 [***-********+*****************] 1
1457 1 24 ARG H 1 24 ARG HA 2.500 . 3.300 2.826 2.776 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
1458 1 22 LEU HA 1 24 ARG H 4.000 . 6.000 4.327 3.960 4.687 . 0 0 "[ . 1 . 2 . 3]" 1
1459 1 23 LEU HA 1 24 ARG H 3.100 . 4.300 3.555 3.491 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 21 LYS HA 1 24 ARG H 2.200 . 2.800 3.859 3.586 4.247 1.447 20 30 [***************-***+**********] 1
1461 1 24 ARG H 1 24 ARG QB 2.400 . 3.100 2.485 2.349 2.627 . 0 0 "[ . 1 . 2 . 3]" 1
1462 1 24 ARG H 1 24 ARG QG 2.800 . 3.300 2.189 1.943 2.408 . 0 0 "[ . 1 . 2 . 3]" 1
1463 1 23 LEU QB 1 24 ARG H 3.900 . 5.800 2.653 2.500 2.939 . 0 0 "[ . 1 . 2 . 3]" 1
1464 1 23 LEU QD 1 24 ARG H 2.700 . 3.300 4.152 4.015 4.305 1.005 27 30 [****************-*********+***] 1
1465 1 20 ASP HA 1 23 LEU H 2.300 . 3.000 3.114 2.907 3.328 0.328 15 0 "[ . 1 . 2 . 3]" 1
1466 1 22 LEU HA 1 23 LEU H 3.800 . 5.600 3.459 3.429 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
1467 1 21 LYS HA 1 23 LEU H 4.600 . 6.000 4.255 4.125 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 23 LEU H 1 23 LEU HA 3.000 . 4.100 2.803 2.764 2.825 . 0 0 "[ . 1 . 2 . 3]" 1
1469 1 22 LEU QB 1 23 LEU H 3.000 . 4.100 3.474 2.567 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 23 LEU H 1 23 LEU QB 3.200 . 4.500 2.308 1.973 2.456 0.027 18 0 "[ . 1 . 2 . 3]" 1
1471 1 19 SER HA 1 22 LEU H 2.600 . 3.500 4.799 4.658 4.921 1.421 8 30 [*******+************-*********] 1
1472 1 20 ASP HA 1 22 LEU H 2.100 . 2.700 4.411 4.238 4.548 1.848 23 30 [*-********************+*******] 1
1473 1 22 LEU H 1 22 LEU HA 2.400 . 3.100 2.860 2.850 2.872 . 0 0 "[ . 1 . 2 . 3]" 1
1474 1 21 LYS HA 1 22 LEU H 2.600 . 3.500 3.563 3.535 3.580 0.080 1 0 "[ . 1 . 2 . 3]" 1
1475 1 20 ASP QB 1 22 LEU H 2.500 . 3.300 4.996 4.789 5.392 2.092 9 30 [********+***********-*********] 1
1476 1 21 LYS QB 1 22 LEU H 3.300 . 4.600 2.437 2.230 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
1477 1 20 ASP H 1 22 LEU H 2.600 . 3.400 4.490 4.306 4.611 1.211 27 30 [********************-*****+***] 1
1478 1 19 SER H 1 21 LYS H 2.300 . 3.000 5.336 5.029 5.613 2.613 9 30 [********+*****************-***] 1
1479 1 19 SER HA 1 21 LYS H 2.100 . 2.700 4.003 3.811 4.244 1.544 11 30 [**********+************-******] 1
1480 1 20 ASP HA 1 21 LYS H 2.600 . 3.400 3.479 3.447 3.519 0.119 11 0 "[ . 1 . 2 . 3]" 1
1481 1 21 LYS H 1 21 LYS HA 2.400 . 3.100 2.795 2.769 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
1482 1 21 LYS H 1 21 LYS QE 5.800 . 6.000 4.546 3.855 5.279 . 0 0 "[ . 1 . 2 . 3]" 1
1483 1 20 ASP QB 1 21 LYS H 2.800 . 3.800 2.813 2.579 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
1484 1 21 LYS H 1 21 LYS QB 2.200 . 2.800 2.482 2.247 2.657 . 0 0 "[ . 1 . 2 . 3]" 1
1485 1 21 LYS H 1 21 LYS QG 3.800 . 5.600 2.112 1.794 2.604 0.206 20 0 "[ . 1 . 2 . 3]" 1
1486 1 19 SER HA 1 20 ASP H 2.500 . 3.300 2.218 2.136 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
1487 1 19 SER QB 1 20 ASP H 2.700 . 3.600 2.943 2.740 3.554 . 0 0 "[ . 1 . 2 . 3]" 1
1488 1 20 ASP H 1 20 ASP QB 2.400 . 3.100 2.243 2.157 2.473 . 0 0 "[ . 1 . 2 . 3]" 1
1489 1 18 LEU HG 1 19 SER H 5.000 . 6.000 4.964 4.059 5.122 . 0 0 "[ . 1 . 2 . 3]" 1
1490 1 18 LEU QB 1 19 SER H . . 3.500 2.676 2.232 2.991 . 0 0 "[ . 1 . 2 . 3]" 1
1491 1 18 LEU HA 1 19 SER H 3.200 . 4.500 2.280 2.156 2.517 . 0 0 "[ . 1 . 2 . 3]" 1
1492 1 19 SER H 1 19 SER HA 2.900 . 4.000 2.854 2.770 2.920 . 0 0 "[ . 1 . 2 . 3]" 1
1493 1 17 PRO QD 1 18 LEU H 2.200 . 2.800 4.931 4.806 5.020 2.220 23 30 [********************-*+*******] 1
1494 1 17 PRO QB 1 18 LEU H 2.300 . 2.900 3.229 2.720 3.559 0.659 1 7 "[+- ** 1 * . 2 *.* 3]" 1
1495 1 17 PRO QG 1 18 LEU H 4.400 . 6.000 4.697 4.284 4.887 . 0 0 "[ . 1 . 2 . 3]" 1
1496 1 18 LEU H 1 18 LEU QB 2.500 . 3.300 2.426 2.361 2.499 . 0 0 "[ . 1 . 2 . 3]" 1
1497 1 14 TYR H 1 55 HIS H 2.800 . 3.700 4.539 3.710 5.348 1.648 22 24 "[* * ** ************2*+* **** -]" 1
1498 1 14 TYR H 1 14 TYR HA 3.000 . 4.100 2.850 2.795 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
1499 1 13 LEU HA 1 14 TYR H 2.600 . 3.400 2.214 2.094 2.310 . 0 0 "[ . 1 . 2 . 3]" 1
1500 1 14 TYR H 1 14 TYR QB 2.700 . 3.600 2.239 2.143 2.336 . 0 0 "[ . 1 . 2 . 3]" 1
1501 1 13 LEU QB 1 14 TYR H 4.800 . 6.000 2.933 2.619 3.458 . 0 0 "[ . 1 . 2 . 3]" 1
1502 1 13 LEU HG 1 14 TYR H 2.900 . 3.900 5.022 4.915 5.152 1.252 28 30 [**************-************+**] 1
1503 1 13 LEU H 1 13 LEU HG 3.200 . 4.500 2.980 2.257 3.338 . 0 0 "[ . 1 . 2 . 3]" 1
1504 1 13 LEU H 1 13 LEU QB 3.400 . 4.800 2.604 2.431 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
1505 1 13 LEU H 1 13 LEU QD 3.700 . 5.400 3.478 3.080 3.684 . 0 0 "[ . 1 . 2 . 3]" 1
1506 1 12 GLN QB 1 13 LEU H 3.700 . 5.400 2.771 2.304 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
1507 1 12 GLN HA 1 13 LEU H 2.200 . 2.800 2.303 2.105 2.503 . 0 0 "[ . 1 . 2 . 3]" 1
1508 1 13 LEU H 1 13 LEU HA 2.800 . 3.800 2.930 2.864 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
1509 1 12 GLN H 1 12 GLN HA 2.900 . 4.000 2.893 2.829 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
1510 1 12 GLN H 1 12 GLN QG 3.700 . 5.400 2.399 1.843 2.922 0.157 11 0 "[ . 1 . 2 . 3]" 1
1511 1 12 GLN H 1 12 GLN QB 3.300 . 4.300 3.150 2.649 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
1512 1 11 THR MG 1 12 GLN H 3.400 . 4.900 4.072 3.175 4.403 . 0 0 "[ . 1 . 2 . 3]" 1
1513 1 10 CYS HA 1 11 THR H 2.900 . 3.900 2.142 2.095 2.251 . 0 0 "[ . 1 . 2 . 3]" 1
1514 1 10 CYS QB 1 11 THR H 4.700 . 6.000 3.513 3.160 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
1515 1 11 THR H 1 11 THR MG 4.000 . 6.000 2.684 1.990 3.160 0.010 30 0 "[ . 1 . 2 . 3]" 1
1516 1 10 CYS H 1 32 GLN QE 2.900 . 3.400 2.439 1.991 3.406 0.006 24 0 "[ . 1 . 2 . 3]" 1
1517 1 9 CYS QB 1 10 CYS H 4.300 . 4.300 3.934 3.519 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
1518 1 10 CYS H 1 10 CYS QB 3.000 . 4.100 2.375 2.132 2.541 . 0 0 "[ . 1 . 2 . 3]" 1
1519 1 9 CYS H 1 9 CYS HA 2.800 . 3.800 2.914 2.843 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
1520 1 8 ALA HA 1 9 CYS H 2.200 . 2.800 2.233 2.085 2.325 . 0 0 "[ . 1 . 2 . 3]" 1
1521 1 9 CYS H 1 9 CYS QB 3.300 . 3.800 2.630 2.316 2.929 . 0 0 "[ . 1 . 2 . 3]" 1
1522 1 8 ALA MB 1 9 CYS H 2.700 . 3.600 3.543 3.196 3.640 0.040 6 0 "[ . 1 . 2 . 3]" 1
1523 1 7 THR HB 1 8 ALA H 2.700 . 3.600 4.353 4.020 4.484 0.884 26 29 "[***** ***********-*******+****]" 1
1524 1 7 THR MG 1 8 ALA H 3.200 . 4.500 3.757 3.122 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
1525 1 5 PRO QD 1 6 SER H 5.500 . 6.000 4.861 3.318 4.969 . 0 0 "[ . 1 . 2 . 3]" 1
1526 1 5 PRO QB 1 6 SER H 2.500 . 3.300 3.421 3.123 3.845 0.545 23 1 "[ . 1 . 2 + . 3]" 1
1527 1 6 SER HA 1 7 THR H 2.400 . 3.100 3.077 2.888 3.310 0.210 28 0 "[ . 1 . 2 . 3]" 1
1528 1 7 THR H 1 7 THR HA 2.800 . 3.800 2.938 2.907 2.950 . 0 0 "[ . 1 . 2 . 3]" 1
1529 1 7 THR H 1 7 THR HB 2.900 . 4.000 2.763 2.548 3.002 . 0 0 "[ . 1 . 2 . 3]" 1
1530 1 7 THR H 1 7 THR MG 3.600 . 5.200 3.898 3.813 3.994 . 0 0 "[ . 1 . 2 . 3]" 1
1531 1 5 PRO QG 1 6 SER H 4.800 . 6.000 4.698 3.751 4.858 . 0 0 "[ . 1 . 2 . 3]" 1
1532 1 1 PHE HA 1 2 LEU H 3.100 . 4.300 2.303 2.073 3.564 . 0 0 "[ . 1 . 2 . 3]" 1
1533 1 1 PHE QB 1 2 LEU H 4.200 . 6.000 3.532 2.436 3.960 . 0 0 "[ . 1 . 2 . 3]" 1
1534 1 2 LEU H 1 2 LEU QB 4.000 . 6.000 2.363 1.976 2.910 0.024 28 0 "[ . 1 . 2 . 3]" 1
1535 1 80 ASN QB 1 80 ASN QD . . 3.800 2.231 2.067 2.669 . 0 0 "[ . 1 . 2 . 3]" 1
1536 1 80 ASN HA 1 80 ASN QD . . 3.600 3.647 1.820 4.329 0.729 4 1 "[ +. 1 . 2 . 3]" 1
1537 1 63 GLN HA 1 63 GLN QE 5.500 . 6.000 4.404 3.890 5.054 . 0 0 "[ . 1 . 2 . 3]" 1
1538 1 63 GLN QE 1 63 GLN HG2 2.400 . 3.100 3.030 2.205 3.317 0.217 7 0 "[ . 1 . 2 . 3]" 1
1539 1 57 GLN HA 1 57 GLN QE 4.300 . 6.000 3.294 2.120 4.796 . 0 0 "[ . 1 . 2 . 3]" 1
1540 1 57 GLN QB 1 57 GLN QE 2.500 . 3.300 2.110 1.677 2.275 0.323 20 0 "[ . 1 . 2 . 3]" 1
1541 1 57 GLN QB 1 57 GLN QE 4.000 . 4.800 3.268 1.695 3.721 0.305 20 0 "[ . 1 . 2 . 3]" 1
1542 1 49 GLN HA 1 49 GLN QE 4.300 . 6.000 4.134 3.509 4.903 . 0 0 "[ . 1 . 2 . 3]" 1
1543 1 49 GLN QB 1 49 GLN QE 2.400 . 3.100 1.962 1.691 2.145 0.009 1 0 "[ . 1 . 2 . 3]" 1
1544 1 49 GLN QB 1 49 GLN QE 4.200 . 6.000 2.766 1.709 3.711 0.291 1 0 "[ . 1 . 2 . 3]" 1
1545 1 28 GLN QE 1 28 GLN QG . . 3.600 2.186 2.120 2.684 . 0 0 "[ . 1 . 2 . 3]" 1
1546 1 28 GLN QB 1 28 GLN QE 3.000 . 4.100 3.481 1.821 3.726 0.079 18 0 "[ . 1 . 2 . 3]" 1
1547 1 32 GLN HA 1 32 GLN QE 5.400 . 6.000 4.686 3.962 5.014 . 0 0 "[ . 1 . 2 . 3]" 1
1548 1 58 ASN QB 1 58 ASN QD 3.200 . 4.500 2.164 2.085 2.640 . 0 0 "[ . 1 . 2 . 3]" 1
1549 1 12 GLN QE 1 12 GLN HG2 3.300 . 4.700 3.221 2.840 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
1550 1 12 GLN HA 1 12 GLN QE 5.000 . 6.000 4.057 3.467 4.889 . 0 0 "[ . 1 . 2 . 3]" 1
1551 1 68 GLN HA 1 68 GLN QE 5.300 . 6.000 4.723 4.051 5.502 . 0 0 "[ . 1 . 2 . 3]" 1
1552 1 68 GLN QB 1 68 GLN QE 4.100 . 6.000 1.923 1.617 2.130 0.383 2 0 "[ . 1 . 2 . 3]" 1
1553 1 32 GLN QE 1 32 GLN QG . . 3.900 2.288 2.077 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
1554 1 50 ARG HE 1 50 ARG QG 4.400 . 6.000 2.517 2.243 2.882 . 0 0 "[ . 1 . 2 . 3]" 1
1555 1 71 LYS QB 1 72 LEU H 4.200 . 5.100 2.001 1.653 2.529 0.347 22 0 "[ . 1 . 2 . 3]" 1
1556 1 51 SER QB 1 52 ILE H 2.700 . 3.600 2.998 2.541 3.294 . 0 0 "[ . 1 . 2 . 3]" 1
1557 1 75 THR MG 1 76 LEU H 3.300 . 4.600 3.800 2.823 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
1558 1 3 LEU H 1 4 PRO QD 4.600 . 6.000 4.036 3.777 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
1559 1 75 THR HB 1 76 LEU H 3.700 . 5.400 3.392 1.844 4.071 0.156 2 0 "[ . 1 . 2 . 3]" 1
1560 1 30 GLU H 1 45 LEU HA 2.900 . 3.900 3.388 2.980 3.914 0.014 2 0 "[ . 1 . 2 . 3]" 1
1561 1 26 VAL HA 1 27 ILE H 2.300 . 3.000 2.215 2.135 2.348 . 0 0 "[ . 1 . 2 . 3]" 1
1562 1 30 GLU H 1 30 GLU QB 3.900 . 5.600 2.971 2.646 3.184 . 0 0 "[ . 1 . 2 . 3]" 1
1563 1 48 ALA MB 1 49 GLN QE 3.900 . 5.800 2.733 1.832 4.112 0.168 2 0 "[ . 1 . 2 . 3]" 1
1564 1 63 GLN H 1 65 PHE H 4.800 . 6.000 4.263 4.109 4.453 . 0 0 "[ . 1 . 2 . 3]" 1
1565 1 30 GLU H 1 44 VAL H 2.700 . 3.600 3.607 3.066 4.023 0.423 1 0 "[ . 1 . 2 . 3]" 1
1566 1 64 TRP HA 1 64 TRP HE1 4.700 . 6.000 5.755 5.581 5.842 . 0 0 "[ . 1 . 2 . 3]" 1
1567 1 64 TRP QB 1 64 TRP HE1 4.700 . 6.000 4.375 4.353 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
1568 1 60 SER H 1 62 SER H 2.800 . 3.800 4.310 3.870 4.565 0.765 24 19 "[ *** **1* *** *****+- ** *]" 1
1569 1 47 LEU H 1 49 GLN H 2.700 . 3.600 4.494 4.096 5.171 1.571 27 29 "[********-**** ************+***]" 1
1570 1 21 LYS H 1 23 LEU H 2.600 . 3.400 3.781 3.613 4.072 0.672 21 3 "[ . - 1 *. 2+ . 3]" 1
1571 1 66 GLU H 1 69 GLU H 4.800 . 6.000 4.819 4.653 5.082 . 0 0 "[ . 1 . 2 . 3]" 1
1572 1 64 TRP H 1 66 GLU H 2.900 . 3.900 4.230 3.993 4.526 0.626 12 5 "[ * . 1 + . - 2 .* *]" 1
1573 1 61 LEU H 1 63 GLN H 3.000 . 4.100 4.077 3.884 4.492 0.392 2 0 "[ . 1 . 2 . 3]" 1
1574 1 45 LEU H 1 54 ILE H 3.200 . 4.500 4.014 3.611 4.438 . 0 0 "[ . 1 . 2 . 3]" 1
1575 1 58 ASN H 1 61 LEU H 3.000 . 4.100 4.373 3.877 4.736 0.636 30 5 "[ - . 1* . * 2 * . +]" 1
1576 1 65 PHE H 1 68 GLN H 2.800 . 3.800 4.640 4.519 4.807 1.007 8 30 [*******+*********-************] 1
1577 1 68 GLN H 1 70 ARG H 2.500 . 3.300 4.074 3.882 4.348 1.048 8 30 [*******+**************-*******] 1
1578 1 47 LEU H 1 51 SER H 5.000 . 6.000 4.645 4.335 4.811 . 0 0 "[ . 1 . 2 . 3]" 1
1579 1 71 LYS HA 1 74 GLY H 2.800 . 3.800 4.996 4.027 6.291 2.491 7 26 "[* **.*+********-***2***** ****]" 1
1580 1 67 HIS HA 1 71 LYS H 3.200 . 4.400 5.108 4.574 5.660 1.260 30 24 "[ * *** *-******* ***** ** ***+]" 1
1581 1 61 LEU HA 1 64 TRP H 2.600 . 3.400 3.389 2.845 3.648 0.248 23 0 "[ . 1 . 2 . 3]" 1
1582 1 86 LYS QE 1 87 MET H 6.000 . 6.000 5.711 5.152 6.060 0.060 1 0 "[ . 1 . 2 . 3]" 1
1583 1 72 LEU H 1 73 HIS HA 5.000 . 6.000 5.428 4.935 6.193 0.193 6 0 "[ . 1 . 2 . 3]" 1
1584 1 68 GLN QE 1 68 GLN QG 4.000 . 6.000 2.412 2.102 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
1585 1 18 LEU QB 1 23 LEU QD 2.400 . 3.100 1.993 1.789 2.271 . 0 0 "[ . 1 . 2 . 3]" 1
1586 1 87 MET HA 1 87 MET QB 2.300 . 2.600 2.367 2.170 2.467 . 0 0 "[ . 1 . 2 . 3]" 1
1587 1 87 MET HA 1 87 MET QG 3.100 . 4.300 2.675 2.300 3.347 . 0 0 "[ . 1 . 2 . 3]" 1
1588 1 86 LYS HA 1 86 LYS HG2 3.100 . 4.300 3.150 2.403 3.747 . 0 0 "[ . 1 . 2 . 3]" 1
1589 1 86 LYS HA 1 86 LYS QE 5.300 . 6.000 3.605 2.138 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
1590 1 86 LYS QB 1 86 LYS HG3 2.200 . 2.800 2.271 2.141 2.460 . 0 0 "[ . 1 . 2 . 3]" 1
1591 1 86 LYS HA 1 86 LYS QB 2.600 . 2.800 2.385 2.311 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
1592 1 78 LYS HA 1 78 LYS QB 2.400 . 2.700 2.359 2.146 2.490 . 0 0 "[ . 1 . 2 . 3]" 1
1593 1 86 LYS H 1 86 LYS QB 2.500 . 3.300 3.179 2.534 3.464 0.164 30 0 "[ . 1 . 2 . 3]" 1
1594 1 86 LYS H 1 86 LYS QE 4.700 . 6.000 4.720 3.342 5.921 . 0 0 "[ . 1 . 2 . 3]" 1
1595 1 21 LYS HA 1 21 LYS QD 2.800 . 3.800 3.601 1.946 4.288 0.488 22 0 "[ . 1 . 2 . 3]" 1
1596 1 25 LYS QE 1 25 LYS QG 3.000 . 3.300 2.428 2.246 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
1597 1 85 ARG HA 1 85 ARG QD 3.300 . 4.700 3.726 1.893 4.526 0.007 24 0 "[ . 1 . 2 . 3]" 1
1598 1 85 ARG QD 1 85 ARG QG 2.000 . 2.500 2.030 1.971 2.091 . 0 0 "[ . 1 . 2 . 3]" 1
1599 1 85 ARG QB 1 85 ARG QG 1.800 . 2.200 2.067 1.983 2.090 . 0 0 "[ . 1 . 2 . 3]" 1
1600 1 85 ARG QB 1 85 ARG QD 2.300 . 3.000 2.288 2.093 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
1601 1 85 ARG HA 1 85 ARG QB 2.700 . 2.800 2.364 2.162 2.446 . 0 0 "[ . 1 . 2 . 3]" 1
1602 1 85 ARG QB 1 86 LYS H 4.300 . 4.800 3.442 2.537 4.039 . 0 0 "[ . 1 . 2 . 3]" 1
1603 1 85 ARG HA 1 85 ARG QG 2.800 . 3.800 2.552 2.208 3.333 . 0 0 "[ . 1 . 2 . 3]" 1
1604 1 84 LEU HA 1 84 LEU QB 2.600 . 3.500 2.348 2.129 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
1605 1 76 LEU QD 1 77 PRO QD . . 2.300 2.378 1.693 2.959 0.659 25 4 "[ . -1 . 2* * + 3]" 1
1606 1 84 LEU HA 1 84 LEU QD 3.300 . 4.700 2.448 1.771 3.271 0.129 30 0 "[ . 1 . 2 . 3]" 1
1607 1 83 MET HA 1 83 MET QB 2.600 . 3.100 2.207 2.164 2.473 . 0 0 "[ . 1 . 2 . 3]" 1
1608 1 83 MET HA 1 83 MET HG2 4.000 . 6.000 3.668 2.165 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
1609 1 81 PHE HA 1 81 PHE QB 2.400 . 3.100 2.267 2.156 2.462 . 0 0 "[ . 1 . 2 . 3]" 1
1610 1 81 PHE HA 1 81 PHE QD 3.500 . 5.000 3.172 1.827 3.742 0.173 12 0 "[ . 1 . 2 . 3]" 1
1611 1 81 PHE QB 1 81 PHE QD 2.500 . 3.300 2.136 2.118 2.229 . 0 0 "[ . 1 . 2 . 3]" 1
1612 1 9 CYS QB 1 11 THR MG 4.600 . 6.000 4.627 3.678 5.057 . 0 0 "[ . 1 . 2 . 3]" 1
1613 1 79 LEU HA 1 79 LEU QB 2.500 . 3.300 2.233 2.133 2.427 . 0 0 "[ . 1 . 2 . 3]" 1
1614 1 79 LEU HA 1 79 LEU QD 2.700 . 3.600 2.885 1.891 3.463 . 0 0 "[ . 1 . 2 . 3]" 1
1615 1 79 LEU HA 1 79 LEU QB 2.300 . 3.000 2.201 2.117 2.400 . 0 0 "[ . 1 . 2 . 3]" 1
1616 1 79 LEU HA 1 80 ASN QB 4.100 . 5.400 4.335 3.872 4.899 . 0 0 "[ . 1 . 2 . 3]" 1
1617 1 79 LEU H 1 79 LEU HG 3.300 . 4.700 2.571 1.727 3.848 0.173 12 0 "[ . 1 . 2 . 3]" 1
1618 1 72 LEU H 1 72 LEU HG 3.600 . 5.200 3.886 2.989 4.362 . 0 0 "[ . 1 . 2 . 3]" 1
1619 1 79 LEU QB 1 79 LEU QD 1.900 . 2.300 1.700 1.668 1.747 . 0 0 "[ . 1 . 2 . 3]" 1
1620 1 79 LEU QB 1 79 LEU QD 2.900 . 3.600 1.929 1.851 2.076 0.049 2 0 "[ . 1 . 2 . 3]" 1
1621 1 22 LEU H 1 22 LEU QD 3.400 . 4.900 2.919 2.282 3.071 . 0 0 "[ . 1 . 2 . 3]" 1
1622 1 79 LEU QD 1 80 ASN H 3.800 . 5.600 3.344 2.358 3.945 . 0 0 "[ . 1 . 2 . 3]" 1
1623 1 79 LEU H 1 79 LEU QD 2.700 . 3.600 2.694 1.809 3.470 . 0 0 "[ . 1 . 2 . 3]" 1
1624 1 78 LYS HA 1 78 LYS QE 4.700 . 6.000 4.253 2.551 5.702 . 0 0 "[ . 1 . 2 . 3]" 1
1625 1 68 GLN HA 1 71 LYS QB 2.100 . 2.700 2.295 1.853 2.604 . 0 0 "[ . 1 . 2 . 3]" 1
1626 1 21 LYS QB 1 21 LYS QG 2.200 . 2.800 2.066 1.996 2.089 . 0 0 "[ . 1 . 2 . 3]" 1
1627 1 20 ASP QB 1 21 LYS QB 3.100 . 4.300 4.713 4.465 5.374 1.074 28 4 "[ . * *1 . - . + 3]" 1
1628 1 25 LYS H 1 25 LYS QD 4.700 . 6.000 4.352 3.441 4.696 . 0 0 "[ . 1 . 2 . 3]" 1
1629 1 25 LYS HA 1 25 LYS QG 3.300 . 3.600 2.426 2.277 2.634 . 0 0 "[ . 1 . 2 . 3]" 1
1630 1 77 PRO HA 1 78 LYS H 2.000 . 2.500 2.354 2.145 2.818 0.318 26 0 "[ . 1 . 2 . 3]" 1
1631 1 77 PRO HA 1 77 PRO QD 2.900 . 3.900 3.427 3.190 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
1632 1 77 PRO HA 1 77 PRO QB 2.000 . 2.500 2.198 2.169 2.252 . 0 0 "[ . 1 . 2 . 3]" 1
1633 1 77 PRO HA 1 77 PRO QG 2.800 . 3.800 3.326 2.695 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
1634 1 77 PRO QD 1 77 PRO QG 2.200 . 2.800 1.962 1.951 1.981 . 0 0 "[ . 1 . 2 . 3]" 1
1635 1 77 PRO QB 1 77 PRO QD 3.800 . 4.300 2.762 2.634 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
1636 1 76 LEU QB 1 77 PRO QD 2.300 . 2.900 2.213 1.781 3.231 0.331 14 0 "[ . 1 . 2 . 3]" 1
1637 1 76 LEU HA 1 77 PRO QD 2.600 . 3.400 2.048 1.912 2.314 . 0 0 "[ . 1 . 2 . 3]" 1
1638 1 75 THR HB 1 75 THR MG 1.900 . 2.400 2.135 2.131 2.138 . 0 0 "[ . 1 . 2 . 3]" 1
1639 1 75 THR HA 1 75 THR HB 2.100 . 2.700 2.575 2.431 2.910 0.210 20 0 "[ . 1 . 2 . 3]" 1
1640 1 75 THR HA 1 75 THR MG 2.500 . 3.300 2.255 2.163 2.356 . 0 0 "[ . 1 . 2 . 3]" 1
1641 1 72 LEU H 1 72 LEU HA 2.400 . 3.100 2.284 2.222 2.776 . 0 0 "[ . 1 . 2 . 3]" 1
1642 1 72 LEU HA 1 72 LEU QB 2.500 . 2.700 2.365 2.100 2.488 . 0 0 "[ . 1 . 2 . 3]" 1
1643 1 72 LEU HA 1 72 LEU QD 2.900 . 3.900 2.416 1.817 3.113 0.083 16 0 "[ . 1 . 2 . 3]" 1
1644 1 72 LEU H 1 72 LEU QD 3.600 . 5.100 2.042 1.712 2.256 0.288 7 0 "[ . 1 . 2 . 3]" 1
1645 1 72 LEU QD 1 72 LEU HG 1.900 . 2.400 1.887 1.861 1.895 . 0 0 "[ . 1 . 2 . 3]" 1
1646 1 71 LYS HA 1 71 LYS QE 4.800 . 6.000 4.302 2.458 5.097 . 0 0 "[ . 1 . 2 . 3]" 1
1647 1 71 LYS QD 1 71 LYS QE 1.800 . 2.200 2.033 2.000 2.095 . 0 0 "[ . 1 . 2 . 3]" 1
1648 1 71 LYS QE 1 71 LYS QG 2.000 . 2.500 2.381 2.116 2.703 0.203 27 0 "[ . 1 . 2 . 3]" 1
1649 1 71 LYS H 1 71 LYS QE 4.600 . 6.000 4.693 4.067 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
1650 1 71 LYS HA 1 71 LYS QG 2.300 . 2.900 2.420 2.250 2.930 0.030 7 0 "[ . 1 . 2 . 3]" 1
1651 1 1 PHE HA 1 1 PHE QD 2.900 . 3.900 2.981 2.285 3.750 . 0 0 "[ . 1 . 2 . 3]" 1
1652 1 24 ARG QB 1 24 ARG QD 2.000 . 2.500 1.889 1.861 1.906 . 0 0 "[ . 1 . 2 . 3]" 1
1653 1 70 ARG H 1 70 ARG QB 2.800 . 3.800 2.910 2.786 3.066 . 0 0 "[ . 1 . 2 . 3]" 1
1654 1 70 ARG HA 1 70 ARG QB 2.500 . 3.300 2.172 2.159 2.184 . 0 0 "[ . 1 . 2 . 3]" 1
1655 1 70 ARG QB 1 70 ARG QD 3.400 . 4.800 2.222 2.066 2.398 . 0 0 "[ . 1 . 2 . 3]" 1
1656 1 70 ARG HA 1 70 ARG QG 2.400 . 3.100 3.344 3.317 3.371 0.271 14 0 "[ . 1 . 2 . 3]" 1
1657 1 70 ARG H 1 70 ARG QG 3.700 . 5.400 2.034 1.796 2.358 0.204 7 0 "[ . 1 . 2 . 3]" 1
1658 1 69 GLU H 1 69 GLU HA 2.900 . 4.000 2.799 2.761 2.832 . 0 0 "[ . 1 . 2 . 3]" 1
1659 1 31 LEU QD 1 33 GLU QG 2.100 . 2.700 2.900 2.378 3.314 0.614 24 3 "[ . 1 .- 2 +. *]" 1
1660 1 31 LEU HG 1 33 GLU QG 4.500 . 6.000 2.771 2.149 3.133 . 0 0 "[ . 1 . 2 . 3]" 1
1661 1 33 GLU HA 1 33 GLU QG . . 3.600 2.420 2.326 2.524 . 0 0 "[ . 1 . 2 . 3]" 1
1662 1 66 GLU H 1 66 GLU QG 3.800 . 5.000 2.237 1.871 2.980 0.129 9 0 "[ . 1 . 2 . 3]" 1
1663 1 66 GLU H 1 66 GLU QB 2.600 . 3.500 2.458 2.179 2.603 . 0 0 "[ . 1 . 2 . 3]" 1
1664 1 69 GLU H 1 69 GLU QB 2.900 . 3.900 2.234 2.197 2.279 . 0 0 "[ . 1 . 2 . 3]" 1
1665 1 68 GLN HA 1 68 GLN QB 2.500 . 3.300 2.151 2.134 2.158 . 0 0 "[ . 1 . 2 . 3]" 1
1666 1 68 GLN HA 1 69 GLU H 3.100 . 4.300 3.477 3.426 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
1667 1 68 GLN H 1 68 GLN QG 4.200 . 6.000 2.497 2.118 4.054 . 0 0 "[ . 1 . 2 . 3]" 1
1668 1 68 GLN HA 1 68 GLN QG 4.600 . 6.000 3.244 2.509 3.353 . 0 0 "[ . 1 . 2 . 3]" 1
1669 1 67 HIS H 1 67 HIS QB 3.500 . 3.900 2.321 2.266 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
1670 1 64 TRP HA 1 67 HIS QB 2.300 . 3.000 2.107 1.807 2.392 . 0 0 "[ . 1 . 2 . 3]" 1
1671 1 66 GLU HA 1 66 GLU QG 3.000 . 4.100 2.548 2.271 3.047 . 0 0 "[ . 1 . 2 . 3]" 1
1672 1 65 PHE HA 1 65 PHE QB 2.900 . 4.000 2.459 2.383 2.517 . 0 0 "[ . 1 . 2 . 3]" 1
1673 1 65 PHE HA 1 68 GLN QG 3.900 . 5.800 2.583 2.025 4.631 . 0 0 "[ . 1 . 2 . 3]" 1
1674 1 65 PHE H 1 65 PHE QB 3.900 . 4.700 2.304 2.130 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
1675 1 64 TRP HA 1 65 PHE H 3.600 . 5.200 3.534 3.497 3.572 . 0 0 "[ . 1 . 2 . 3]" 1
1676 1 64 TRP HA 1 64 TRP HD1 4.200 . 6.000 4.729 4.597 4.793 . 0 0 "[ . 1 . 2 . 3]" 1
1677 1 61 LEU QD 1 64 TRP QB 2.500 . 3.300 2.688 2.211 3.038 . 0 0 "[ . 1 . 2 . 3]" 1
1678 1 64 TRP HA 1 64 TRP QB 3.500 . 4.100 2.353 2.325 2.400 . 0 0 "[ . 1 . 2 . 3]" 1
1679 1 63 GLN HA 1 63 GLN QG 2.500 . 3.300 2.684 2.324 3.408 0.108 3 0 "[ . 1 . 2 . 3]" 1
1680 1 63 GLN H 1 63 GLN HA 2.800 . 3.800 2.807 2.788 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
1681 1 63 GLN HA 1 64 TRP H 3.400 . 4.800 3.496 3.453 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
1682 1 63 GLN H 1 63 GLN QG 3.700 . 5.400 2.412 2.069 3.933 . 0 0 "[ . 1 . 2 . 3]" 1
1683 1 60 SER HA 1 63 GLN QB 2.300 . 3.000 3.153 2.396 4.006 1.006 3 8 "[ + . 1* *. ** * .* -3]" 1
1684 1 63 GLN QB 1 64 TRP H 3.800 . 5.600 3.004 2.494 3.607 . 0 0 "[ . 1 . 2 . 3]" 1
1685 1 63 GLN H 1 63 GLN QB 2.900 . 4.000 2.402 2.204 2.627 . 0 0 "[ . 1 . 2 . 3]" 1
1686 1 62 SER HA 1 64 TRP QB 3.900 . 5.800 4.783 4.349 5.076 . 0 0 "[ . 1 . 2 . 3]" 1
1687 1 62 SER HA 1 62 SER QB 2.400 . 3.100 2.345 2.185 2.427 . 0 0 "[ . 1 . 2 . 3]" 1
1688 1 59 PRO HA 1 62 SER QB 2.100 . 2.600 3.024 2.176 4.147 1.547 21 10 "[ * * * . **+ *** - 3]" 1
1689 1 62 SER H 1 62 SER QB 2.400 . 3.100 2.401 2.210 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
1690 1 61 LEU HA 1 61 LEU HG 3.900 . 5.800 3.658 3.070 3.743 . 0 0 "[ . 1 . 2 . 3]" 1
1691 1 48 ALA HA 1 48 ALA MB 2.000 . 2.500 2.125 2.119 2.130 . 0 0 "[ . 1 . 2 . 3]" 1
1692 1 27 ILE MG 1 48 ALA HA 2.400 . 3.100 3.378 2.546 4.968 1.868 22 8 "[- . *** . 2*+ *. * 3]" 1
1693 1 52 ILE HB 1 52 ILE QG 2.600 . 3.400 2.386 2.362 2.471 . 0 0 "[ . 1 . 2 . 3]" 1
1694 1 61 LEU H 1 61 LEU HG 4.300 . 6.000 4.579 4.454 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
1695 1 61 LEU MD1 1 61 LEU MD2 2.500 . 3.300 2.077 2.062 2.090 . 0 0 "[ . 1 . 2 . 3]" 1
1696 1 61 LEU QB 1 61 LEU QD 3.400 . 3.400 2.057 1.907 2.077 0.093 17 0 "[ . 1 . 2 . 3]" 1
1697 1 20 ASP QB 1 23 LEU QD 2.300 . 2.900 3.320 2.834 4.059 1.159 20 8 "[ . 1 ** **+* - . * 3]" 1
1698 1 61 LEU HA 1 61 LEU QD . . 3.300 1.900 1.810 2.140 0.190 25 0 "[ . 1 . 2 . 3]" 1
1699 1 56 PRO HA 1 61 LEU QD 2.100 . 2.700 4.262 2.526 4.790 2.090 7 28 "[******+*******-* ********* ***]" 1
1700 1 43 PHE QD 1 61 LEU QD 2.000 . 2.500 2.395 2.090 2.863 0.363 29 0 "[ . 1 . 2 . 3]" 1
1701 1 61 LEU QD 1 65 PHE QE 2.100 . 2.600 2.197 1.813 2.843 0.243 27 0 "[ . 1 . 2 . 3]" 1
1702 1 43 PHE QB 1 61 LEU QD 2.200 . 2.800 1.981 1.810 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
1703 1 29 VAL QG 1 61 LEU QD 1.800 . 2.200 2.400 1.909 3.088 0.888 12 9 "[ **-. 1 + ** * * *. 3]" 1
1704 1 60 SER HA 1 62 SER H 4.600 . 6.000 4.695 4.342 4.985 . 0 0 "[ . 1 . 2 . 3]" 1
1705 1 60 SER HA 1 60 SER QB 3.200 . 3.800 2.347 2.173 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
1706 1 59 PRO HA 1 60 SER H 3.800 . 5.600 3.528 3.355 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
1707 1 59 PRO HA 1 61 LEU H 4.500 . 6.000 4.245 3.940 4.827 . 0 0 "[ . 1 . 2 . 3]" 1
1708 1 59 PRO HA 1 59 PRO QD 3.900 . 5.600 3.264 3.064 3.405 . 0 0 "[ . 1 . 2 . 3]" 1
1709 1 59 PRO HA 1 59 PRO QB 2.300 . 3.000 2.206 2.168 2.244 . 0 0 "[ . 1 . 2 . 3]" 1
1710 1 58 ASN HA 1 59 PRO QD 2.700 . 3.600 1.875 1.747 1.996 0.253 23 0 "[ . 1 . 2 . 3]" 1
1711 1 59 PRO QB 1 59 PRO QD 3.600 . 5.200 2.765 2.737 2.821 . 0 0 "[ . 1 . 2 . 3]" 1
1712 1 59 PRO QB 1 59 PRO QD 3.100 . 3.500 1.929 1.921 1.936 . 0 0 "[ . 1 . 2 . 3]" 1
1713 1 59 PRO QD 1 59 PRO QG 3.400 . 3.400 1.969 1.955 1.979 0.045 25 0 "[ . 1 . 2 . 3]" 1
1714 1 59 PRO HA 1 59 PRO QG 3.700 . 5.200 3.134 2.817 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
1715 1 58 ASN HA 1 59 PRO QG 4.500 . 6.000 3.784 3.666 3.902 . 0 0 "[ . 1 . 2 . 3]" 1
1716 1 59 PRO QG 1 60 SER H 5.500 . 6.000 3.325 2.422 4.176 . 0 0 "[ . 1 . 2 . 3]" 1
1717 1 54 ILE MG 1 58 ASN QB 2.200 . 2.600 2.184 1.793 3.285 0.685 27 1 "[ . 1 . 2 . + 3]" 1
1718 1 57 GLN HA 1 57 GLN QB 2.200 . 2.800 2.195 2.084 2.292 . 0 0 "[ . 1 . 2 . 3]" 1
1719 1 57 GLN H 1 57 GLN HA 3.000 . 4.100 2.617 2.256 2.915 . 0 0 "[ . 1 . 2 . 3]" 1
1720 1 57 GLN H 1 57 GLN QG 3.800 . 5.600 3.086 2.284 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
1721 1 57 GLN HA 1 57 GLN QG 2.400 . 3.100 2.625 2.251 3.214 0.114 17 0 "[ . 1 . 2 . 3]" 1
1722 1 57 GLN QE 1 57 GLN QG . . 3.800 2.208 2.086 2.680 . 0 0 "[ . 1 . 2 . 3]" 1
1723 1 55 HIS HE1 1 57 GLN QG 2.000 . 2.500 4.223 2.993 5.426 2.926 15 29 "[*****-********+************ **]" 1
1724 1 57 GLN QG 1 58 ASN H 4.100 . 6.000 4.637 3.786 4.891 . 0 0 "[ . 1 . 2 . 3]" 1
1725 1 57 GLN H 1 57 GLN QB 3.300 . 4.600 2.786 2.086 3.433 . 0 0 "[ . 1 . 2 . 3]" 1
1726 1 57 GLN HA 1 57 GLN QB 3.000 . 4.000 2.390 2.137 2.467 . 0 0 "[ . 1 . 2 . 3]" 1
1727 1 55 HIS HE1 1 57 GLN QB 2.200 . 2.600 2.706 1.931 3.407 0.807 15 11 "[ . * 1-** +* * * * * *]" 1
1728 1 56 PRO HA 1 56 PRO QD 4.100 . 6.000 3.288 3.080 3.444 . 0 0 "[ . 1 . 2 . 3]" 1
1729 1 43 PHE QD 1 56 PRO HA 1.900 . 2.400 2.011 1.733 2.627 0.227 23 0 "[ . 1 . 2 . 3]" 1
1730 1 43 PHE QE 1 56 PRO HA 2.100 . 2.600 3.640 2.831 4.606 2.006 23 28 "[*** ****** ***********+***-***]" 1
1731 1 56 PRO QB 1 56 PRO QD 3.800 . 5.600 2.779 2.727 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
1732 1 15 ARG QB 1 15 ARG QD . . 2.700 2.315 2.073 2.915 0.215 25 0 "[ . 1 . 2 . 3]" 1
1733 1 56 PRO QB 1 56 PRO QG 3.000 . 3.600 1.971 1.952 1.981 . 0 0 "[ . 1 . 2 . 3]" 1
1734 1 56 PRO QD 1 56 PRO QG 3.400 . 3.500 1.966 1.950 1.979 0.050 17 0 "[ . 1 . 2 . 3]" 1
1735 1 24 ARG HA 1 24 ARG QG 3.100 . 3.300 3.341 3.325 3.357 0.057 2 0 "[ . 1 . 2 . 3]" 1
1736 1 65 PHE HA 1 65 PHE QD 3.200 . 4.400 2.480 1.794 3.024 0.206 12 0 "[ . 1 . 2 . 3]" 1
1737 1 43 PHE HA 1 43 PHE QB 3.100 . 4.300 2.482 2.427 2.535 . 0 0 "[ . 1 . 2 . 3]" 1
1738 1 43 PHE QB 1 43 PHE QD 3.000 . 4.100 2.122 2.113 2.132 . 0 0 "[ . 1 . 2 . 3]" 1
1739 1 1 PHE QB 1 1 PHE QD 2.700 . 3.400 2.128 2.122 2.146 . 0 0 "[ . 1 . 2 . 3]" 1
1740 1 55 HIS HA 1 55 HIS QB 3.200 . 4.400 2.321 2.173 2.415 . 0 0 "[ . 1 . 2 . 3]" 1
1741 1 15 ARG HA 1 15 ARG QB 2.600 . 3.300 2.372 2.167 2.457 . 0 0 "[ . 1 . 2 . 3]" 1
1742 1 54 ILE MG 1 55 HIS HA 3.100 . 4.300 3.772 3.524 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
1743 1 45 LEU QD 1 54 ILE HB 2.400 . 3.100 3.748 1.955 4.165 1.065 13 27 "[**********-*+*** ********* * *]" 1
1744 1 43 PHE QB 1 54 ILE HB 2.200 . 2.800 3.551 2.901 4.306 1.506 17 26 "[*** **-*** **** +*** *********]" 1
1745 1 54 ILE HB 1 55 HIS H 4.500 . 6.000 4.240 4.073 4.440 . 0 0 "[ . 1 . 2 . 3]" 1
1746 1 54 ILE HB 1 54 ILE QG 3.400 . 4.900 2.346 2.318 2.384 . 0 0 "[ . 1 . 2 . 3]" 1
1747 1 54 ILE MG 1 61 LEU QD 1.900 . 2.300 2.166 1.760 2.580 0.280 15 0 "[ . 1 . 2 . 3]" 1
1748 1 43 PHE QB 1 54 ILE MG 2.200 . 2.800 2.562 1.872 3.437 0.637 15 3 "[ . 1 * + 2 - 3]" 1
1749 1 54 ILE MG 1 58 ASN QD 2.200 . 2.800 3.119 1.875 4.490 1.690 17 11 "[ .*** 1* . +* 2 * -** *]" 1
1750 1 43 PHE QD 1 54 ILE MG 2.600 . 3.500 4.160 3.211 4.989 1.489 25 18 "[* * * ** **-** **2*** +* * 3]" 1
1751 1 54 ILE MD 1 54 ILE MG 2.800 . 3.800 1.897 1.824 2.002 . 0 0 "[ . 1 . 2 . 3]" 1
1752 1 54 ILE HB 1 54 ILE MD 2.900 . 4.000 2.442 2.354 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
1753 1 54 ILE HA 1 54 ILE MD 3.100 . 4.300 3.732 3.686 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
1754 1 14 TYR H 1 54 ILE MD 2.200 . 2.800 5.606 5.109 6.051 3.251 29 30 [**************-*************+*] 1
1755 1 54 ILE MD 1 55 HIS H 4.800 . 6.000 4.603 4.069 5.003 . 0 0 "[ . 1 . 2 . 3]" 1
1756 1 52 ILE HA 1 52 ILE QG 4.100 . 5.200 2.427 2.293 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
1757 1 52 ILE HB 1 52 ILE MD 3.400 . 4.800 2.410 2.284 2.447 . 0 0 "[ . 1 . 2 . 3]" 1
1758 1 52 ILE HB 1 52 ILE MG 2.400 . 3.100 2.129 2.124 2.133 . 0 0 "[ . 1 . 2 . 3]" 1
1759 1 40 LEU HA 1 40 LEU HG 3.400 . 4.800 3.305 2.366 4.293 . 0 0 "[ . 1 . 2 . 3]" 1
1760 1 52 ILE QG 1 52 ILE MG 3.100 . 4.300 2.285 2.070 2.339 . 0 0 "[ . 1 . 2 . 3]" 1
1761 1 14 TYR QB 1 52 ILE MG 2.100 . 2.700 2.317 2.020 2.654 . 0 0 "[ . 1 . 2 . 3]" 1
1762 1 52 ILE HA 1 52 ILE MG 2.600 . 3.400 2.397 2.344 2.504 . 0 0 "[ . 1 . 2 . 3]" 1
1763 1 52 ILE MG 1 53 CYS H 3.300 . 4.700 2.408 2.190 2.635 . 0 0 "[ . 1 . 2 . 3]" 1
1764 1 18 LEU QD 1 52 ILE MD 1.500 . 2.200 1.986 1.742 2.715 0.515 24 1 "[ . 1 . 2 +. 3]" 1
1765 1 45 LEU HG 1 52 ILE MD 2.100 . 2.700 5.603 5.138 5.838 3.138 28 30 [***************************+-*] 1
1766 1 52 ILE HA 1 52 ILE MD 3.300 . 4.700 3.766 3.115 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
1767 1 52 ILE MD 1 53 CYS H 2.500 . 3.300 4.959 4.835 5.113 1.813 13 30 [************+****************-] 1
1768 1 52 ILE H 1 52 ILE MD 4.200 . 6.000 3.771 2.154 4.150 . 0 0 "[ . 1 . 2 . 3]" 1
1769 1 46 HIS HA 1 51 SER HA 2.400 . 3.100 2.439 1.976 2.739 . 0 0 "[ . 1 . 2 . 3]" 1
1770 1 51 SER HA 1 51 SER QB 3.000 . 3.800 2.342 2.180 2.417 . 0 0 "[ . 1 . 2 . 3]" 1
1771 1 18 LEU QD 1 51 SER HA 2.300 . 3.000 5.789 5.563 5.912 2.912 24 30 [***********-***********+******] 1
1772 1 47 LEU H 1 51 SER HA 1.900 . 2.400 2.638 2.178 3.261 0.861 16 4 "[ .* 1 *+ 2 - . 3]" 1
1773 1 44 VAL QG 1 51 SER QB 2.100 . 2.600 2.351 1.858 3.131 0.531 29 1 "[ . 1 . 2 . +3]" 1
1774 1 51 SER H 1 51 SER QB 3.300 . 4.100 2.674 2.417 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
1775 1 50 ARG H 1 50 ARG QD 5.000 . 6.000 3.669 1.965 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
1776 1 24 ARG H 1 24 ARG QD 4.500 . 6.000 3.865 3.666 4.119 . 0 0 "[ . 1 . 2 . 3]" 1
1777 1 24 ARG QB 1 24 ARG QD 3.100 . 3.800 2.281 2.097 2.407 . 0 0 "[ . 1 . 2 . 3]" 1
1778 1 50 ARG HA 1 50 ARG QB 3.000 . 4.100 2.218 2.158 2.412 . 0 0 "[ . 1 . 2 . 3]" 1
1779 1 50 ARG QB 1 50 ARG QG 3.200 . 4.500 2.051 1.999 2.089 . 0 0 "[ . 1 . 2 . 3]" 1
1780 1 50 ARG QD 1 50 ARG QG 3.000 . 3.600 2.033 1.977 2.091 . 0 0 "[ . 1 . 2 . 3]" 1
1781 1 49 GLN HA 1 49 GLN QB 2.100 . 2.700 2.134 2.110 2.150 . 0 0 "[ . 1 . 2 . 3]" 1
1782 1 48 ALA MB 1 49 GLN HA 3.300 . 4.700 4.095 3.859 4.255 . 0 0 "[ . 1 . 2 . 3]" 1
1783 1 27 ILE MD 1 49 GLN QG 2.000 . 2.500 5.931 5.419 6.102 3.602 25 30 [**************-*********+*****] 1
1784 1 34 ALA MB 1 41 GLN QG 2.300 . 2.900 3.469 2.766 4.463 1.563 18 17 "[ ** . * *1* **** +** * -. ** *]" 1
1785 1 49 GLN QB 1 49 GLN QG 2.100 . 2.700 2.012 1.975 2.021 . 0 0 "[ . 1 . 2 . 3]" 1
1786 1 49 GLN HA 1 49 GLN QG 2.200 . 2.800 2.768 2.372 3.415 0.615 7 4 "[ . + 1 - .* * 2 . 3]" 1
1787 1 49 GLN QG 1 50 ARG H 3.200 . 4.500 4.235 3.127 4.671 0.171 24 0 "[ . 1 . 2 . 3]" 1
1788 1 49 GLN H 1 49 GLN QG 3.700 . 5.400 2.949 2.027 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
1789 1 41 GLN HA 1 41 GLN QG 2.800 . 3.800 2.434 2.347 2.492 . 0 0 "[ . 1 . 2 . 3]" 1
1790 1 48 ALA MB 1 49 GLN QB 3.300 . 4.700 4.289 3.499 4.705 0.005 14 0 "[ . 1 . 2 . 3]" 1
1791 1 48 ALA HA 1 49 GLN QG 4.200 . 6.000 4.857 4.379 5.390 . 0 0 "[ . 1 . 2 . 3]" 1
1792 1 48 ALA MB 1 49 GLN QG 2.700 . 3.600 3.125 2.472 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
1793 1 47 LEU QB 1 47 LEU QD 2.700 . 3.600 1.907 1.892 1.922 . 0 0 "[ . 1 . 2 . 3]" 1
1794 1 47 LEU QB 1 47 LEU HG 2.800 . 3.800 2.440 2.410 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
1795 1 47 LEU HA 1 47 LEU QB 3.300 . 4.700 2.387 2.355 2.416 . 0 0 "[ . 1 . 2 . 3]" 1
1796 1 47 LEU QD 1 47 LEU HG 2.100 . 2.700 1.894 1.891 1.895 . 0 0 "[ . 1 . 2 . 3]" 1
1797 1 26 VAL HA 1 47 LEU HG 2.000 . 2.500 2.299 1.750 2.763 0.263 13 0 "[ . 1 . 2 . 3]" 1
1798 1 16 LYS HA 1 16 LYS QD 3.700 . 5.500 3.266 1.872 4.248 0.028 16 0 "[ . 1 . 2 . 3]" 1
1799 1 47 LEU HA 1 47 LEU HG 3.200 . 4.400 2.498 2.422 2.584 . 0 0 "[ . 1 . 2 . 3]" 1
1800 1 18 LEU QB 1 18 LEU QD 2.000 . 2.500 1.959 1.894 1.972 . 0 0 "[ . 1 . 2 . 3]" 1
1801 1 47 LEU HA 1 47 LEU QD 3.700 . 5.400 2.969 2.852 3.042 . 0 0 "[ . 1 . 2 . 3]" 1
1802 1 47 LEU QD 1 64 TRP HZ2 1.900 . 2.300 5.697 5.241 6.031 3.731 28 30 [***************************+-*] 1
1803 1 45 LEU QB 1 52 ILE MD 4.700 . 6.000 3.700 3.223 3.931 . 0 0 "[ . 1 . 2 . 3]" 1
1804 1 45 LEU HA 1 45 LEU QB 3.300 . 4.700 2.380 2.329 2.434 . 0 0 "[ . 1 . 2 . 3]" 1
1805 1 44 VAL QG 1 45 LEU HG 2.300 . 3.000 4.646 4.389 5.631 2.631 29 30 [**-*************************+*] 1
1806 1 45 LEU QD 1 45 LEU HG 2.200 . 2.800 1.891 1.883 1.894 . 0 0 "[ . 1 . 2 . 3]" 1
1807 1 45 LEU H 1 45 LEU HG 2.800 . 3.800 2.822 2.498 4.224 0.424 29 0 "[ . 1 . 2 . 3]" 1
1808 1 23 LEU QD 1 45 LEU QD 2.100 . 2.600 2.373 1.933 3.363 0.763 29 2 "[ . 1 . - 2 . +3]" 1
1809 1 43 PHE QB 1 45 LEU QD 3.500 . 5.100 3.646 2.865 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
1810 1 43 PHE QD 1 45 LEU QD 4.400 . 5.000 4.202 3.957 4.424 . 0 0 "[ . 1 . 2 . 3]" 1
1811 1 45 LEU H 1 45 LEU QD 3.600 . 5.200 3.228 2.171 3.489 . 0 0 "[ . 1 . 2 . 3]" 1
1812 1 13 LEU QD 1 14 TYR H 3.100 . 4.300 3.457 3.271 3.655 . 0 0 "[ . 1 . 2 . 3]" 1
1813 1 13 LEU QD 1 43 PHE H 2.400 . 3.100 4.074 3.461 4.762 1.662 18 29 "[******* **-******+************]" 1
1814 1 13 LEU QD 1 55 HIS HD2 2.200 . 2.500 2.591 1.872 3.474 0.974 15 5 "[ * . 1 - + * 2 * . 3]" 1
1815 1 13 LEU HA 1 13 LEU QD 3.200 . 4.300 2.071 1.987 2.253 . 0 0 "[ . 1 . 2 . 3]" 1
1816 1 13 LEU QD 1 53 CYS QB 2.000 . 2.400 2.523 1.904 3.570 1.170 30 9 "[ . 1* -*. * *** *+]" 1
1817 1 12 GLN QG 1 13 LEU QD 2.400 . 3.100 5.360 5.163 5.706 2.606 14 30 [********-****+****************] 1
1818 1 13 LEU QB 1 13 LEU QD 2.700 . 3.600 1.936 1.904 1.958 0.096 11 0 "[ . 1 . 2 . 3]" 1
1819 1 13 LEU MD1 1 13 LEU MD2 2.300 . 3.000 2.080 2.067 2.095 . 0 0 "[ . 1 . 2 . 3]" 1
1820 1 44 VAL HA 1 53 CYS HA 4.100 . 6.000 2.438 2.122 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1821 1 44 VAL MG1 1 44 VAL MG2 2.400 . 3.100 2.093 2.074 2.099 . 0 0 "[ . 1 . 2 . 3]" 1
1822 1 30 GLU QB 1 44 VAL QG 2.300 . 2.300 3.702 2.519 4.393 2.093 11 29 "[**********+*****-******** ****]" 1
1823 1 44 VAL HA 1 44 VAL QG 3.200 . 3.400 2.137 2.101 2.521 . 0 0 "[ . 1 . 2 . 3]" 1
1824 1 44 VAL QG 1 53 CYS HA 2.500 . 3.300 2.082 1.751 2.761 . 0 0 "[ . 1 . 2 . 3]" 1
1825 1 44 VAL QG 1 45 LEU H 3.500 . 3.900 2.589 2.367 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1826 1 32 GLN QB 1 44 VAL QG 2.000 . 2.500 2.653 2.208 3.018 0.518 29 2 "[ - 1 . 2 . +3]" 1
1827 1 43 PHE HA 1 44 VAL QG 2.000 . 2.500 3.439 3.190 3.643 1.143 22 30 [*********************+******-*] 1
1828 1 31 LEU HA 1 43 PHE HA 2.200 . 2.800 2.620 2.037 2.924 0.124 26 0 "[ . 1 . 2 . 3]" 1
1829 1 43 PHE HA 1 43 PHE QD 3.500 . 5.000 2.896 2.498 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
1830 1 32 GLN H 1 43 PHE HA 2.500 . 3.300 3.198 2.919 3.555 0.255 3 0 "[ . 1 . 2 . 3]" 1
1831 1 29 VAL QG 1 43 PHE QB 2.200 . 2.800 3.675 3.099 4.644 1.844 2 26 "[*+****** *******-* ******* **]" 1
1832 1 42 ALA HA 1 56 PRO QG 2.300 . 3.000 2.735 1.612 3.742 0.742 18 3 "[ - * 1 . + 2 . 3]" 1
1833 1 42 ALA HA 1 56 PRO QD 2.400 . 2.900 1.879 1.675 2.523 0.025 22 0 "[ . 1 . 2 . 3]" 1
1834 1 42 ALA HA 1 43 PHE H 2.800 . 3.800 2.245 2.136 2.520 . 0 0 "[ . 1 . 2 . 3]" 1
1835 1 32 GLN QB 1 42 ALA MB 2.000 . 2.500 2.134 1.857 2.502 0.002 28 0 "[ . 1 . 2 . 3]" 1
1836 1 32 GLN QG 1 42 ALA MB 2.200 . 2.800 3.462 2.983 3.992 1.192 12 18 "[ **-** ** +*** ** * * ***3]" 1
1837 1 42 ALA MB 1 43 PHE HA 4.400 . 6.000 4.093 3.894 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1838 1 32 GLN QE 1 42 ALA MB 2.400 . 3.100 2.814 1.835 4.102 1.002 20 4 "[ * . - . *+ . 3]" 1
1839 1 42 ALA MB 1 43 PHE H 2.900 . 4.000 2.750 2.129 3.133 . 0 0 "[ . 1 . 2 . 3]" 1
1840 1 32 GLN H 1 42 ALA MB 2.300 . 3.000 3.644 3.242 3.887 0.887 9 24 "[* *.***+**********2****-* * *]" 1
1841 1 42 ALA H 1 42 ALA MB 3.000 . 4.100 2.697 2.564 2.831 . 0 0 "[ . 1 . 2 . 3]" 1
1842 1 10 CYS H 1 42 ALA MB 2.500 . 3.300 3.961 3.474 4.606 1.306 12 22 "[* **** *-+**** ********* * 3]" 1
1843 1 41 GLN HA 1 41 GLN QB 3.300 . 4.700 2.372 2.333 2.459 . 0 0 "[ . 1 . 2 . 3]" 1
1844 1 41 GLN H 1 41 GLN QB 3.300 . 4.600 2.354 2.281 2.449 . 0 0 "[ . 1 . 2 . 3]" 1
1845 1 40 LEU HA 1 40 LEU QB 2.500 . 3.300 2.285 2.157 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
1846 1 40 LEU HA 1 41 GLN QB 3.700 . 5.400 4.039 3.865 4.141 . 0 0 "[ . 1 . 2 . 3]" 1
1847 1 40 LEU QB 1 41 GLN H 3.300 . 4.600 3.124 2.186 3.941 . 0 0 "[ . 1 . 2 . 3]" 1
1848 1 16 LYS HA 1 16 LYS QG 2.400 . 3.100 2.543 2.341 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
1849 1 22 LEU QD 1 23 LEU H 4.400 . 6.000 2.860 2.590 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
1850 1 3 LEU HA 1 3 LEU QD 3.000 . 4.100 1.872 1.776 2.801 0.124 22 0 "[ . 1 . 2 . 3]" 1
1851 1 18 LEU HA 1 18 LEU QD 2.200 . 2.800 1.999 1.866 2.985 0.185 24 0 "[ . 1 . 2 . 3]" 1
1852 1 40 LEU QD 1 41 GLN H 4.000 . 6.000 2.836 1.932 3.567 0.068 20 0 "[ . 1 . 2 . 3]" 1
1853 1 2 LEU QD 1 3 LEU H 3.400 . 4.900 3.099 1.913 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
1854 1 3 LEU H 1 3 LEU QD 3.000 . 4.100 2.290 1.903 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
1855 1 39 HIS HA 1 39 HIS QB 2.600 . 3.400 2.239 2.154 2.456 . 0 0 "[ . 1 . 2 . 3]" 1
1856 1 38 CYS HA 1 38 CYS QB 3.600 . 4.300 2.419 2.307 2.521 . 0 0 "[ . 1 . 2 . 3]" 1
1857 1 20 ASP HA 1 20 ASP QB 2.400 . 3.100 2.394 2.167 2.473 . 0 0 "[ . 1 . 2 . 3]" 1
1858 1 35 ASP H 1 35 ASP HB2 2.800 . 3.800 3.635 3.210 4.116 0.316 20 0 "[ . 1 . 2 . 3]" 1
1859 1 81 PHE HA 1 81 PHE QE 4.700 . 6.000 5.109 4.126 5.661 . 0 0 "[ . 1 . 2 . 3]" 1
1860 1 35 ASP HA 1 35 ASP HB3 2.900 . 3.900 2.848 2.442 3.034 . 0 0 "[ . 1 . 2 . 3]" 1
1861 1 34 ALA MB 1 41 GLN QB 1.800 . 2.200 1.811 1.610 2.743 0.543 18 1 "[ . 1 . + 2 . 3]" 1
1862 1 34 ALA HA 1 34 ALA MB 2.400 . 3.100 2.125 2.118 2.131 . 0 0 "[ . 1 . 2 . 3]" 1
1863 1 34 ALA MB 1 35 ASP H 3.600 . 5.200 3.369 3.009 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
1864 1 34 ALA MB 1 41 GLN H 2.000 . 2.500 3.088 2.449 3.723 1.223 10 18 "[*** ** * + **. * * *-.*****]" 1
1865 1 34 ALA H 1 34 ALA MB 2.500 . 3.300 2.247 2.213 2.276 . 0 0 "[ . 1 . 2 . 3]" 1
1866 1 33 GLU HA 1 33 GLU QB 3.200 . 4.300 2.370 2.319 2.493 . 0 0 "[ . 1 . 2 . 3]" 1
1867 1 33 GLU QB 1 34 ALA H 4.300 . 5.600 2.696 2.327 3.127 . 0 0 "[ . 1 . 2 . 3]" 1
1868 1 32 GLN HA 1 32 GLN QG 4.300 . 6.000 2.507 2.324 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
1869 1 32 GLN QG 1 33 GLU H 5.000 . 6.000 3.260 2.753 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
1870 1 32 GLN HA 1 32 GLN QB 3.200 . 4.500 2.344 2.267 2.489 . 0 0 "[ . 1 . 2 . 3]" 1
1871 1 9 CYS HA 1 9 CYS QB 3.300 . 4.000 2.404 2.329 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
1872 1 9 CYS HA 1 10 CYS H 3.200 . 4.500 2.305 2.122 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
1873 1 31 LEU QB 1 31 LEU QD 3.200 . 3.600 1.948 1.862 1.976 0.038 20 0 "[ . 1 . 2 . 3]" 1
1874 1 31 LEU QB 1 31 LEU HG 2.600 . 3.400 2.362 2.299 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
1875 1 31 LEU HA 1 31 LEU QB 2.900 . 3.900 2.298 2.158 2.330 . 0 0 "[ . 1 . 2 . 3]" 1
1876 1 18 LEU HA 1 18 LEU QB 3.200 . 4.300 2.369 2.332 2.401 . 0 0 "[ . 1 . 2 . 3]" 1
1877 1 31 LEU HA 1 31 LEU HG 3.600 . 5.200 3.316 3.204 3.717 . 0 0 "[ . 1 . 2 . 3]" 1
1878 1 31 LEU MD1 1 31 LEU MD2 2.100 . 2.700 2.081 2.061 2.090 . 0 0 "[ . 1 . 2 . 3]" 1
1879 1 31 LEU QD 1 31 LEU HG 2.100 . 2.700 1.894 1.890 1.896 . 0 0 "[ . 1 . 2 . 3]" 1
1880 1 18 LEU QD 1 18 LEU HG 2.100 . 2.600 1.894 1.886 1.897 . 0 0 "[ . 1 . 2 . 3]" 1
1881 1 31 LEU QD 1 41 GLN QG 2.300 . 2.900 2.579 1.921 3.939 1.039 20 2 "[ . 1 . + . -3]" 1
1882 1 31 LEU HA 1 31 LEU QD 3.800 . 5.600 2.257 2.005 3.437 . 0 0 "[ . 1 . 2 . 3]" 1
1883 1 31 LEU H 1 33 GLU QG 2.400 . 3.100 5.339 4.933 5.701 2.601 30 30 [*************-***************+] 1
1884 1 30 GLU HA 1 30 GLU QB 3.600 . 5.200 2.189 2.150 2.278 . 0 0 "[ . 1 . 2 . 3]" 1
1885 1 29 VAL HA 1 29 VAL QG 3.100 . 4.300 2.187 2.131 2.369 . 0 0 "[ . 1 . 2 . 3]" 1
1886 1 29 VAL QG 1 30 GLU H . . 4.000 2.765 2.378 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
1887 1 29 VAL MG1 1 29 VAL MG2 2.400 . 3.100 2.090 2.083 2.102 . 0 0 "[ . 1 . 2 . 3]" 1
1888 1 27 ILE MG 1 28 GLN QG 4.300 . 6.000 4.465 4.209 4.793 . 0 0 "[ . 1 . 2 . 3]" 1
1889 1 27 ILE HA 1 27 ILE MD 3.700 . 5.400 4.185 4.162 4.192 . 0 0 "[ . 1 . 2 . 3]" 1
1890 1 27 ILE HA 1 27 ILE QG 3.300 . 4.300 3.315 3.304 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
1891 1 27 ILE HA 1 27 ILE HB 2.900 . 3.900 2.485 2.431 2.519 . 0 0 "[ . 1 . 2 . 3]" 1
1892 1 27 ILE HB 1 27 ILE QG 3.100 . 3.900 2.354 2.308 2.382 . 0 0 "[ . 1 . 2 . 3]" 1
1893 1 27 ILE H 1 27 ILE HB 3.100 . 4.300 3.691 3.601 3.804 . 0 0 "[ . 1 . 2 . 3]" 1
1894 1 27 ILE H 1 27 ILE QG . . 3.000 1.966 1.836 2.155 0.164 28 0 "[ . 1 . 2 . 3]" 1
1895 1 27 ILE QG 1 27 ILE MG . . 3.100 2.357 2.307 2.420 . 0 0 "[ . 1 . 2 . 3]" 1
1896 1 27 ILE MD 1 27 ILE QG 2.200 . 2.800 1.888 1.884 1.890 . 0 0 "[ . 1 . 2 . 3]" 1
1897 1 27 ILE HB 1 27 ILE MG 2.200 . 2.800 2.127 2.121 2.135 . 0 0 "[ . 1 . 2 . 3]" 1
1898 1 27 ILE HA 1 27 ILE MG 2.400 . 3.100 2.296 2.236 2.375 . 0 0 "[ . 1 . 2 . 3]" 1
1899 1 27 ILE MG 1 28 GLN H 3.700 . 5.400 4.089 3.990 4.193 . 0 0 "[ . 1 . 2 . 3]" 1
1900 1 27 ILE H 1 27 ILE MG 4.100 . 6.000 2.644 2.162 3.059 . 0 0 "[ . 1 . 2 . 3]" 1
1901 1 27 ILE MG 1 48 ALA H 2.500 . 3.300 3.147 2.542 4.911 1.611 22 2 "[ . 1 . 2 + . - 3]" 1
1902 1 27 ILE H 1 27 ILE MD 3.700 . 5.500 3.668 3.514 3.866 . 0 0 "[ . 1 . 2 . 3]" 1
1903 1 27 ILE MD 1 48 ALA H 2.000 . 2.500 3.694 3.116 4.226 1.726 1 30 [+*********************-*******] 1
1904 1 27 ILE MD 1 28 GLN H 2.300 . 2.900 4.100 3.767 4.358 1.458 1 30 [+***************************-*] 1
1905 1 27 ILE MD 1 48 ALA HA 1.700 . 2.200 2.179 1.694 3.114 0.914 27 2 "[ . 1 . 2 - . + 3]" 1
1906 1 27 ILE HB 1 27 ILE MD 2.300 . 3.000 2.457 2.420 2.535 . 0 0 "[ . 1 . 2 . 3]" 1
1907 1 26 VAL HA 1 26 VAL QG 2.300 . 3.000 2.128 2.090 2.155 . 0 0 "[ . 1 . 2 . 3]" 1
1908 1 23 LEU QD 1 26 VAL QG 2.000 . 2.500 2.324 1.845 2.806 0.306 17 0 "[ . 1 . 2 . 3]" 1
1909 1 3 LEU QD 1 3 LEU HG 2.100 . 2.600 1.893 1.888 1.895 . 0 0 "[ . 1 . 2 . 3]" 1
1910 1 25 LYS H 1 26 VAL QG 2.200 . 2.800 3.194 2.926 3.797 0.997 13 8 "[ * . *1 + -* *** . 3]" 1
1911 1 26 VAL MG1 1 26 VAL MG2 2.400 . 3.100 2.076 2.063 2.086 . 0 0 "[ . 1 . 2 . 3]" 1
1912 1 25 LYS QB 1 25 LYS QE 4.900 . 6.000 1.930 1.864 2.083 0.036 27 0 "[ . 1 . 2 . 3]" 1
1913 1 25 LYS QB 1 25 LYS QG 2.700 . 3.600 2.083 2.051 2.091 . 0 0 "[ . 1 . 2 . 3]" 1
1914 1 29 VAL QG 1 43 PHE QD 2.100 . 2.600 2.820 2.027 4.135 1.535 2 9 "[ + *. 1** . - * *.* *3]" 1
1915 1 1 PHE HA 1 1 PHE QB 2.500 . 3.300 2.321 2.181 2.425 . 0 0 "[ . 1 . 2 . 3]" 1
1916 1 67 HIS HA 1 67 HIS HD2 4.300 . 6.000 2.870 2.218 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
1917 1 55 HIS HA 1 55 HIS HD2 4.500 . 6.000 3.334 2.679 4.623 . 0 0 "[ . 1 . 2 . 3]" 1
1918 1 55 HIS QB 1 55 HIS HD2 3.300 . 4.600 2.881 2.730 3.100 . 0 0 "[ . 1 . 2 . 3]" 1
1919 1 13 LEU QB 1 55 HIS HD2 2.400 . 3.100 4.501 3.664 5.015 1.915 6 30 [*****+********-***************] 1
1920 1 39 HIS QB 1 39 HIS HD2 3.200 . 4.500 2.854 2.691 3.108 . 0 0 "[ . 1 . 2 . 3]" 1
1921 1 64 TRP QB 1 65 PHE H 4.900 . 6.000 2.746 2.481 2.921 . 0 0 "[ . 1 . 2 . 3]" 1
1922 1 14 TYR QB 1 14 TYR QD 3.000 . 4.100 2.145 2.132 2.172 . 0 0 "[ . 1 . 2 . 3]" 1
1923 1 14 TYR QE 1 16 LYS QB 3.300 . 4.600 2.360 1.969 3.234 0.031 28 0 "[ . 1 . 2 . 3]" 1
1924 1 14 TYR QE 1 16 LYS QB 3.000 . 4.100 2.400 1.977 3.279 0.023 28 0 "[ . 1 . 2 . 3]" 1
1925 1 24 ARG HA 1 24 ARG QB 2.300 . 3.000 2.149 2.142 2.158 . 0 0 "[ . 1 . 2 . 3]" 1
1926 1 24 ARG HA 1 24 ARG QD 4.400 . 6.000 4.449 4.234 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1927 1 21 LYS HA 1 24 ARG QB 2.500 . 3.000 4.161 3.745 4.534 1.534 18 30 [***************-*+************] 1
1928 1 21 LYS HA 1 24 ARG QG 2.600 . 3.400 2.868 2.305 3.282 . 0 0 "[ . 1 . 2 . 3]" 1
1929 1 22 LEU HG 1 23 LEU HA 2.300 . 3.000 4.475 3.926 5.571 2.571 21 30 [*******************-+*********] 1
1930 1 23 LEU HA 1 23 LEU QB 2.500 . 3.300 2.426 2.381 2.523 . 0 0 "[ . 1 . 2 . 3]" 1
1931 1 23 LEU QB 1 23 LEU QD . . 3.400 1.959 1.949 1.982 0.051 30 0 "[ . 1 . 2 . 3]" 1
1932 1 20 ASP HA 1 23 LEU QB 2.400 . 3.100 1.981 1.780 2.308 . 0 0 "[ . 1 . 2 . 3]" 1
1933 1 23 LEU QD 1 23 LEU HG 3.100 . 4.300 1.895 1.891 1.898 0.009 17 0 "[ . 1 . 2 . 3]" 1
1934 1 23 LEU HA 1 23 LEU HG 4.200 . 6.000 2.979 2.547 3.127 . 0 0 "[ . 1 . 2 . 3]" 1
1935 1 23 LEU H 1 23 LEU HG 3.300 . 4.700 2.878 2.329 4.548 . 0 0 "[ . 1 . 2 . 3]" 1
1936 1 23 LEU MD1 1 23 LEU MD2 2.600 . 3.500 2.080 2.060 2.089 . 0 0 "[ . 1 . 2 . 3]" 1
1937 1 23 LEU HA 1 23 LEU QD 4.800 . 5.400 1.909 1.827 2.084 0.173 18 0 "[ . 1 . 2 . 3]" 1
1938 1 20 ASP HA 1 23 LEU QD 2.200 . 2.800 2.026 1.778 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
1939 1 23 LEU H 1 23 LEU QD 4.700 . 5.000 3.150 2.433 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
1940 1 22 LEU HA 1 22 LEU HG 2.500 . 3.300 3.696 3.515 3.743 0.443 27 0 "[ . 1 . 2 . 3]" 1
1941 1 22 LEU HA 1 22 LEU QB 2.400 . 3.100 2.170 2.155 2.218 . 0 0 "[ . 1 . 2 . 3]" 1
1942 1 22 LEU H 1 22 LEU QB 2.800 . 3.800 2.628 2.528 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
1943 1 22 LEU HA 1 22 LEU QD 3.300 . 4.400 3.240 2.460 3.404 . 0 0 "[ . 1 . 2 . 3]" 1
1944 1 22 LEU QD 1 23 LEU HA 4.200 . 6.000 2.833 2.185 4.933 . 0 0 "[ . 1 . 2 . 3]" 1
1945 1 22 LEU QB 1 22 LEU QD 2.200 . 2.800 1.899 1.879 1.948 . 0 0 "[ . 1 . 2 . 3]" 1
1946 1 21 LYS HA 1 21 LYS QG 3.600 . 3.800 2.561 2.310 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
1947 1 21 LYS HA 1 21 LYS QB 2.200 . 2.800 2.364 2.307 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
1948 1 20 ASP QB 1 21 LYS HA 3.800 . 5.700 4.060 3.862 4.650 . 0 0 "[ . 1 . 2 . 3]" 1
1949 1 21 LYS HA 1 21 LYS QE 4.700 . 6.000 4.458 2.704 5.141 . 0 0 "[ . 1 . 2 . 3]" 1
1950 1 21 LYS QG 1 22 LEU H . . 4.000 3.989 3.732 4.279 0.279 10 0 "[ . 1 . 2 . 3]" 1
1951 1 19 SER HA 1 20 ASP QB 3.400 . 4.900 4.139 4.032 4.477 . 0 0 "[ . 1 . 2 . 3]" 1
1952 1 19 SER HA 1 22 LEU QB 4.000 . 6.000 5.931 5.322 6.114 0.114 20 0 "[ . 1 . 2 . 3]" 1
1953 1 19 SER HA 1 19 SER QB 2.500 . 3.300 2.335 2.302 2.375 . 0 0 "[ . 1 . 2 . 3]" 1
1954 1 19 SER H 1 19 SER QB 3.100 . 3.800 2.495 2.361 2.572 . 0 0 "[ . 1 . 2 . 3]" 1
1955 1 18 LEU QB 1 18 LEU HG 3.100 . 4.300 2.345 2.316 2.473 . 0 0 "[ . 1 . 2 . 3]" 1
1956 1 18 LEU HA 1 18 LEU HG 2.900 . 4.000 3.133 2.384 3.281 . 0 0 "[ . 1 . 2 . 3]" 1
1957 1 18 LEU H 1 18 LEU HG 3.400 . 4.800 2.561 2.285 3.388 . 0 0 "[ . 1 . 2 . 3]" 1
1958 1 18 LEU H 1 18 LEU QD 3.900 . 5.600 3.123 1.982 3.339 0.018 24 0 "[ . 1 . 2 . 3]" 1
1959 1 14 TYR QE 1 18 LEU QD 1.900 . 2.300 2.514 2.019 2.878 0.578 28 3 "[ . 1 .* 2 -. + 3]" 1
1960 1 14 TYR QD 1 18 LEU QD 1.900 . 2.400 2.603 2.100 3.055 0.655 27 4 "[ . 1 . * - . +* 3]" 1
1961 1 18 LEU QD 1 19 SER H 2.600 . 3.400 3.350 3.187 3.803 0.403 24 0 "[ . 1 . 2 . 3]" 1
1962 1 17 PRO HA 1 17 PRO QD 3.500 . 5.000 3.409 3.165 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
1963 1 16 LYS QB 1 17 PRO QD . . 2.800 2.257 1.934 2.754 0.066 4 0 "[ . 1 . 2 . 3]" 1
1964 1 4 PRO QB 1 4 PRO QD 3.000 . 3.400 2.758 2.696 2.798 . 0 0 "[ . 1 . 2 . 3]" 1
1965 1 4 PRO HA 1 4 PRO QD 2.200 . 2.500 3.409 3.330 3.473 0.973 16 30 [*******-*******+**************] 1
1966 1 5 PRO QB 1 5 PRO QD 2.900 . 3.900 2.751 2.710 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
1967 1 17 PRO QB 1 17 PRO QD 2.800 . 3.700 2.757 2.726 2.866 . 0 0 "[ . 1 . 2 . 3]" 1
1968 1 17 PRO QD 1 17 PRO QG 2.200 . 2.800 1.972 1.958 1.977 . 0 0 "[ . 1 . 2 . 3]" 1
1969 1 16 LYS HA 1 16 LYS QB 2.400 . 3.100 2.179 2.116 2.294 . 0 0 "[ . 1 . 2 . 3]" 1
1970 1 16 LYS HA 1 16 LYS QB 2.500 . 3.300 2.395 2.304 2.508 . 0 0 "[ . 1 . 2 . 3]" 1
1971 1 16 LYS QB 1 17 PRO QD 4.500 . 6.000 2.543 2.070 3.443 . 0 0 "[ . 1 . 2 . 3]" 1
1972 1 16 LYS QB 1 16 LYS QE 5.100 . 6.000 3.276 1.915 3.866 0.085 17 0 "[ . 1 . 2 . 3]" 1
1973 1 14 TYR QE 1 16 LYS QG 4.100 . 6.000 3.895 2.719 4.931 . 0 0 "[ . 1 . 2 . 3]" 1
1974 1 16 LYS QG 1 17 PRO QD . . 3.000 3.094 1.946 3.889 0.889 19 7 "[ * 1 * .- +2 *. ** 3]" 1
1975 1 16 LYS QE 1 16 LYS QG 2.600 . 3.400 2.349 2.128 2.765 . 0 0 "[ . 1 . 2 . 3]" 1
1976 1 15 ARG HA 1 15 ARG QD 3.700 . 5.400 3.817 2.027 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
1977 1 15 ARG HA 1 15 ARG QG 3.900 . 5.800 2.545 2.296 3.362 . 0 0 "[ . 1 . 2 . 3]" 1
1978 1 14 TYR HA 1 14 TYR QD 3.200 . 4.500 2.534 2.091 3.060 . 0 0 "[ . 1 . 2 . 3]" 1
1979 1 13 LEU HA 1 13 LEU QB 2.900 . 4.000 2.368 2.338 2.392 . 0 0 "[ . 1 . 2 . 3]" 1
1980 1 13 LEU QB 1 13 LEU HG 3.100 . 4.300 2.389 2.341 2.451 . 0 0 "[ . 1 . 2 . 3]" 1
1981 1 13 LEU QD 1 56 PRO QD 2.100 . 2.500 3.142 2.217 3.970 1.470 22 16 "[ *-** ** ** **** 2 +*** 3]" 1
1982 1 13 LEU QD 1 55 HIS QB 2.300 . 3.000 1.992 1.792 2.631 . 0 0 "[ . 1 . 2 . 3]" 1
1983 1 12 GLN HA 1 13 LEU QD 2.300 . 3.000 4.163 3.998 4.372 1.372 30 30 [****************-************+] 1
1984 1 12 GLN QG 1 13 LEU H 3.000 . 4.100 4.533 4.275 4.930 0.830 30 10 "[ . -* **. ** .* **+]" 1
1985 1 11 THR MG 1 12 GLN QG 2.200 . 2.800 4.401 1.977 5.196 2.396 22 26 "[************* *****2*+*** **-3]" 1
1986 1 10 CYS HA 1 11 THR MG 2.200 . 2.800 4.020 3.510 4.551 1.751 22 30 [*********************+***-****] 1
1987 1 11 THR HB 1 11 THR MG 2.200 . 2.800 2.135 2.124 2.139 . 0 0 "[ . 1 . 2 . 3]" 1
1988 1 10 CYS HA 1 10 CYS QB 3.700 . 5.400 2.381 2.299 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
1989 1 8 ALA HA 1 8 ALA MB 2.000 . 2.500 2.124 2.119 2.132 . 0 0 "[ . 1 . 2 . 3]" 1
1990 1 8 ALA H 1 8 ALA MB 2.200 . 2.800 2.319 2.243 2.626 . 0 0 "[ . 1 . 2 . 3]" 1
1991 1 7 THR HA 1 7 THR MG 2.100 . 2.700 2.324 2.247 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
1992 1 6 SER HA 1 7 THR MG 3.800 . 5.600 5.856 5.707 5.976 0.376 17 0 "[ . 1 . 2 . 3]" 1
1993 1 6 SER HA 1 6 SER QB 2.200 . 2.800 2.355 2.178 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
1994 1 6 SER H 1 6 SER HA 2.500 . 3.300 2.281 2.242 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
1995 1 6 SER H 1 6 SER HB3 3.200 . 4.500 3.940 3.161 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
1996 1 6 SER H 1 6 SER HB2 3.100 . 4.300 3.542 2.928 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
1997 1 6 SER HA 1 6 SER HB3 2.200 . 2.800 2.571 2.363 3.033 0.233 28 0 "[ . 1 . 2 . 3]" 1
1998 1 6 SER HA 1 6 SER HB2 2.600 . 3.400 2.888 2.453 3.031 . 0 0 "[ . 1 . 2 . 3]" 1
1999 1 5 PRO HA 1 5 PRO QD 3.200 . 4.500 3.338 3.172 3.418 . 0 0 "[ . 1 . 2 . 3]" 1
2000 1 5 PRO HA 1 5 PRO QB 2.300 . 2.800 2.216 2.150 2.250 . 0 0 "[ . 1 . 2 . 3]" 1
2001 1 3 LEU QD 1 4 PRO QD 3.700 . 5.400 2.584 2.252 2.726 . 0 0 "[ . 1 . 2 . 3]" 1
2002 1 4 PRO HA 1 4 PRO QG . . 3.100 2.962 2.859 3.104 0.004 16 0 "[ . 1 . 2 . 3]" 1
2003 1 5 PRO HA 1 5 PRO QG 3.400 . 4.900 3.018 2.779 3.500 . 0 0 "[ . 1 . 2 . 3]" 1
2004 1 5 PRO QD 1 5 PRO QG 2.100 . 2.700 1.969 1.958 1.974 . 0 0 "[ . 1 . 2 . 3]" 1
2005 1 5 PRO QB 1 5 PRO QG 2.100 . 2.700 1.974 1.954 1.980 . 0 0 "[ . 1 . 2 . 3]" 1
2006 1 4 PRO HA 1 4 PRO QB . . 2.200 2.216 2.198 2.238 0.038 8 0 "[ . 1 . 2 . 3]" 1
2007 1 4 PRO HA 1 5 PRO QD 2.300 . 2.900 1.876 1.795 2.038 . 0 0 "[ . 1 . 2 . 3]" 1
2008 1 4 PRO QD 1 4 PRO QG 2.000 . 2.500 1.971 1.959 1.983 . 0 0 "[ . 1 . 2 . 3]" 1
2009 1 3 LEU QB 1 4 PRO QD 2.500 . 3.300 3.327 3.076 3.573 0.273 12 0 "[ . 1 . 2 . 3]" 1
2010 1 4 PRO QB 1 5 PRO QD 3.400 . 4.900 2.781 2.452 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
2011 1 4 PRO QB 1 4 PRO QG 2.000 . 2.500 1.971 1.961 1.978 . 0 0 "[ . 1 . 2 . 3]" 1
2012 1 2 LEU HA 1 2 LEU QB 2.200 . 2.800 2.199 2.153 2.298 . 0 0 "[ . 1 . 2 . 3]" 1
2013 1 2 LEU HA 1 2 LEU QB 2.300 . 2.900 2.257 2.167 2.383 . 0 0 "[ . 1 . 2 . 3]" 1
2014 1 2 LEU HA 1 2 LEU HG 3.300 . 4.700 3.322 2.525 3.715 . 0 0 "[ . 1 . 2 . 3]" 1
2015 1 2 LEU HA 1 2 LEU QD 3.400 . 4.800 2.949 2.054 3.434 . 0 0 "[ . 1 . 2 . 3]" 1
2016 1 2 LEU QB 1 2 LEU QD 1.900 . 2.400 1.692 1.677 1.710 . 0 0 "[ . 1 . 2 . 3]" 1
2017 1 47 LEU QB 1 48 ALA MB 4.000 . 6.000 3.821 3.581 4.008 . 0 0 "[ . 1 . 2 . 3]" 1
2018 1 45 LEU HA 1 45 LEU QD 4.000 . 6.000 1.878 1.765 1.993 0.235 26 0 "[ . 1 . 2 . 3]" 1
2019 1 73 HIS HA 1 73 HIS HD2 3.200 . 4.500 3.381 2.214 4.588 0.088 2 0 "[ . 1 . 2 . 3]" 1
2020 1 39 HIS HA 1 39 HIS HD2 4.400 . 6.000 4.379 4.025 4.704 . 0 0 "[ . 1 . 2 . 3]" 1
2021 1 64 TRP HA 1 64 TRP HE3 4.600 . 6.000 1.892 1.798 1.953 0.102 20 0 "[ . 1 . 2 . 3]" 1
2022 1 65 PHE QB 1 65 PHE QD 3.000 . 4.100 2.155 2.120 2.312 . 0 0 "[ . 1 . 2 . 3]" 1
2023 1 55 HIS HE1 1 57 GLN HA 2.500 . 3.300 5.500 4.763 6.138 2.838 25 30 [********************-***+*****] 1
2024 1 55 HIS HE1 1 57 GLN QB 1.800 . 2.200 2.668 1.921 3.373 1.173 15 15 "[ * *. -* 1*** +*** * * * *]" 1
2025 1 62 SER HA 1 65 PHE H 4.500 . 6.000 3.396 3.155 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
2026 1 67 HIS HA 1 70 ARG QB 3.600 . 5.300 4.408 3.954 4.868 . 0 0 "[ . 1 . 2 . 3]" 1
2027 1 65 PHE HA 1 68 GLN QB 2.300 . 3.000 3.824 2.646 4.262 1.262 30 25 "[********** ** **********. -* +]" 1
2028 1 62 SER HA 1 65 PHE QB 4.200 . 6.000 3.132 2.779 3.662 . 0 0 "[ . 1 . 2 . 3]" 1
2029 1 61 LEU HA 1 64 TRP QB . . 3.400 2.443 1.964 2.792 0.036 17 0 "[ . 1 . 2 . 3]" 1
2030 1 40 LEU HA 1 40 LEU QD 3.200 . 4.500 2.989 1.899 3.444 0.001 11 0 "[ . 1 . 2 . 3]" 1
2031 1 21 LYS HA 1 24 ARG QD 2.200 . 2.800 2.996 2.364 3.707 0.907 25 4 "[ . 1 . - + ** 3]" 1
2032 1 20 ASP QB 1 21 LYS QG 2.600 . 3.400 3.554 3.161 4.475 1.075 9 2 "[ . +1 . 2 . - 3]" 1
2033 1 76 LEU HA 1 77 PRO QG 3.700 . 5.400 3.984 3.845 4.217 . 0 0 "[ . 1 . 2 . 3]" 1
2034 1 22 LEU H 1 22 LEU HG 3.400 . 4.800 2.150 1.771 2.311 0.229 7 0 "[ . 1 . 2 . 3]" 1
2035 1 22 LEU HG 1 23 LEU H 4.500 . 6.000 2.706 2.308 3.406 . 0 0 "[ . 1 . 2 . 3]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 40
_Distance_constraint_stats_list.Viol_count 315
_Distance_constraint_stats_list.Viol_total 1930.194
_Distance_constraint_stats_list.Viol_max 0.794
_Distance_constraint_stats_list.Viol_rms 0.1185
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0536
_Distance_constraint_stats_list.Viol_average_violations_only 0.2043
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 28 GLN 0.523 0.071 22 0 "[ . 1 . 2 . 3]"
1 30 GLU 0.114 0.075 4 0 "[ . 1 . 2 . 3]"
1 32 GLN 0.461 0.143 29 0 "[ . 1 . 2 . 3]"
1 42 ALA 0.461 0.143 29 0 "[ . 1 . 2 . 3]"
1 43 PHE 3.369 0.421 29 0 "[ . 1 . 2 . 3]"
1 44 VAL 0.114 0.075 4 0 "[ . 1 . 2 . 3]"
1 45 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 46 HIS 0.523 0.071 22 0 "[ . 1 . 2 . 3]"
1 47 LEU 13.692 0.794 14 11 "[ ** * ** +. ** * *- 3]"
1 50 ARG 13.692 0.794 14 11 "[ ** * ** +. ** * *- 3]"
1 52 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 54 ILE 3.369 0.421 29 0 "[ . 1 . 2 . 3]"
1 60 SER 2.129 0.332 3 0 "[ . 1 . 2 . 3]"
1 61 LEU 1.200 0.193 20 0 "[ . 1 . 2 . 3]"
1 62 SER 15.042 0.463 26 0 "[ . 1 . 2 . 3]"
1 63 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 64 TRP 2.129 0.332 3 0 "[ . 1 . 2 . 3]"
1 65 PHE 11.367 0.363 20 0 "[ . 1 . 2 . 3]"
1 66 GLU 32.653 0.552 22 4 "[- . 1 . * +* . 3]"
1 67 HIS 0.032 0.032 9 0 "[ . 1 . 2 . 3]"
1 68 GLN 0.032 0.032 9 0 "[ . 1 . 2 . 3]"
1 69 GLU 10.166 0.363 20 0 "[ . 1 . 2 . 3]"
1 70 ARG 17.610 0.552 22 4 "[- . 1 . * +* . 3]"
1 71 LYS 0.032 0.032 9 0 "[ . 1 . 2 . 3]"
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 43 PHE N 1 54 ILE O 0.000 . 3.300 2.857 2.606 3.332 0.032 29 0 "[ . 1 . 2 . 3]" 2
2 1 43 PHE H 1 54 ILE O 0.000 . 2.300 2.060 1.714 2.721 0.421 29 0 "[ . 1 . 2 . 3]" 2
3 1 43 PHE O 1 54 ILE N 0.000 . 3.300 3.022 2.691 3.333 0.033 22 0 "[ . 1 . 2 . 3]" 2
4 1 43 PHE O 1 54 ILE H 0.000 . 2.300 2.235 1.755 2.677 0.377 22 0 "[ . 1 . 2 . 3]" 2
5 1 45 LEU N 1 52 ILE O 0.000 . 3.300 2.812 2.661 3.080 . 0 0 "[ . 1 . 2 . 3]" 2
6 1 45 LEU H 1 52 ILE O 0.000 . 2.300 1.891 1.703 2.162 . 0 0 "[ . 1 . 2 . 3]" 2
7 1 45 LEU O 1 52 ILE N 0.000 . 3.300 2.892 2.733 3.094 . 0 0 "[ . 1 . 2 . 3]" 2
8 1 45 LEU O 1 52 ILE H 0.000 . 2.300 1.939 1.777 2.128 . 0 0 "[ . 1 . 2 . 3]" 2
9 1 47 LEU N 1 50 ARG O 0.000 . 3.300 2.777 2.603 3.123 . 0 0 "[ . 1 . 2 . 3]" 2
10 1 47 LEU H 1 50 ARG O 0.000 . 2.300 1.996 1.727 2.298 . 0 0 "[ . 1 . 2 . 3]" 2
11 1 47 LEU O 1 50 ARG N 0.000 . 3.300 3.394 3.332 3.546 0.246 27 0 "[ . 1 . 2 . 3]" 2
12 1 47 LEU O 1 50 ARG H 0.000 . 2.300 2.663 2.406 3.094 0.794 14 11 "[ ** * ** +. ** * *- 3]" 2
13 1 28 GLN O 1 46 HIS N 0.000 . 3.300 2.899 2.731 3.158 . 0 0 "[ . 1 . 2 . 3]" 2
14 1 28 GLN O 1 46 HIS H 0.000 . 2.300 1.991 1.809 2.269 . 0 0 "[ . 1 . 2 . 3]" 2
15 1 28 GLN N 1 46 HIS O 0.000 . 3.300 3.176 2.873 3.336 0.036 27 0 "[ . 1 . 2 . 3]" 2
16 1 28 GLN H 1 46 HIS O 0.000 . 2.300 2.229 1.914 2.371 0.071 22 0 "[ . 1 . 2 . 3]" 2
17 1 30 GLU O 1 44 VAL N 0.000 . 3.300 2.855 2.673 3.225 . 0 0 "[ . 1 . 2 . 3]" 2
18 1 30 GLU O 1 44 VAL H 0.000 . 2.300 1.939 1.739 2.316 0.016 1 0 "[ . 1 . 2 . 3]" 2
19 1 30 GLU N 1 44 VAL O 0.000 . 3.300 2.880 2.610 3.323 0.023 4 0 "[ . 1 . 2 . 3]" 2
20 1 30 GLU H 1 44 VAL O 0.000 . 2.300 1.933 1.655 2.375 0.075 4 0 "[ . 1 . 2 . 3]" 2
21 1 32 GLN O 1 42 ALA N 0.000 . 3.300 2.978 2.698 3.328 0.028 12 0 "[ . 1 . 2 . 3]" 2
22 1 32 GLN O 1 42 ALA H 0.000 . 2.300 2.052 1.736 2.443 0.143 29 0 "[ . 1 . 2 . 3]" 2
23 1 32 GLN N 1 42 ALA O 0.000 . 3.300 2.723 2.602 2.828 . 0 0 "[ . 1 . 2 . 3]" 2
24 1 32 GLN H 1 42 ALA O 0.000 . 2.300 1.831 1.633 2.051 . 0 0 "[ . 1 . 2 . 3]" 2
25 1 60 SER O 1 64 TRP N 0.000 . 3.300 3.018 2.735 3.307 0.007 3 0 "[ . 1 . 2 . 3]" 2
26 1 60 SER O 1 64 TRP H 0.000 . 2.300 2.286 1.898 2.632 0.332 3 0 "[ . 1 . 2 . 3]" 2
27 1 61 LEU O 1 65 PHE N 0.000 . 3.300 3.074 2.742 3.342 0.042 20 0 "[ . 1 . 2 . 3]" 2
28 1 61 LEU O 1 65 PHE H 0.000 . 2.300 2.218 1.779 2.493 0.193 20 0 "[ . 1 . 2 . 3]" 2
29 1 62 SER O 1 66 GLU N 0.000 . 3.300 3.508 3.370 3.676 0.376 21 0 "[ . 1 . 2 . 3]" 2
30 1 62 SER O 1 66 GLU H 0.000 . 2.300 2.593 2.448 2.763 0.463 26 0 "[ . 1 . 2 . 3]" 2
31 1 63 GLN O 1 67 HIS N 0.000 . 3.300 2.785 2.654 3.075 . 0 0 "[ . 1 . 2 . 3]" 2
32 1 63 GLN O 1 67 HIS H 0.000 . 2.300 1.858 1.724 2.201 . 0 0 "[ . 1 . 2 . 3]" 2
33 1 64 TRP O 1 68 GLN N 0.000 . 3.300 2.610 2.552 2.706 . 0 0 "[ . 1 . 2 . 3]" 2
34 1 64 TRP O 1 68 GLN H 0.000 . 2.300 1.654 1.574 1.743 . 0 0 "[ . 1 . 2 . 3]" 2
35 1 65 PHE O 1 69 GLU N 0.000 . 3.300 3.380 3.247 3.483 0.183 12 0 "[ . 1 . 2 . 3]" 2
36 1 65 PHE O 1 69 GLU H 0.000 . 2.300 2.557 2.405 2.663 0.363 20 0 "[ . 1 . 2 . 3]" 2
37 1 66 GLU O 1 70 ARG N 0.000 . 3.300 3.470 3.391 3.561 0.261 22 0 "[ . 1 . 2 . 3]" 2
38 1 66 GLU O 1 70 ARG H 0.000 . 2.300 2.717 2.605 2.852 0.552 22 4 "[- . 1 . * +* . 3]" 2
39 1 67 HIS O 1 71 LYS N 0.000 . 3.300 2.703 2.542 2.880 . 0 0 "[ . 1 . 2 . 3]" 2
40 1 67 HIS O 1 71 LYS H 0.000 . 2.300 2.105 1.843 2.332 0.032 9 0 "[ . 1 . 2 . 3]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 4
_Distance_constraint_stats_list.Viol_count 1
_Distance_constraint_stats_list.Viol_total 0.114
_Distance_constraint_stats_list.Viol_max 0.004
_Distance_constraint_stats_list.Viol_rms 0.0003
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0038
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 20 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 21 LYS 0.004 0.004 11 0 "[ . 1 . 2 . 3]"
1 22 LEU 0.004 0.004 11 0 "[ . 1 . 2 . 3]"
1 24 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 25 LYS 0.004 0.004 11 0 "[ . 1 . 2 . 3]"
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 20 ASP O 1 24 ARG N 0.000 . 3.300 2.866 2.736 2.999 . 0 0 "[ . 1 . 2 . 3]" 3
2 1 20 ASP O 1 24 ARG H 0.000 . 2.300 2.033 1.865 2.285 . 0 0 "[ . 1 . 2 . 3]" 3
3 1 21 LYS O 1 25 LYS N 0.000 . 3.300 2.950 2.792 3.096 . 0 0 "[ . 1 . 2 . 3]" 3
4 1 21 LYS O 1 25 LYS H 0.000 . 2.300 2.139 1.996 2.304 0.004 11 0 "[ . 1 . 2 . 3]" 3
stop_
save_
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