Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
601921 | 2n1g RC | 25559 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n1g
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 2129
_Distance_constraint_stats_list.Viol_count 2961
_Distance_constraint_stats_list.Viol_total 16594.066
_Distance_constraint_stats_list.Viol_max 1.392
_Distance_constraint_stats_list.Viol_rms 0.0933
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0195
_Distance_constraint_stats_list.Viol_average_violations_only 0.2802
_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 ASN 22.157 1.064 18 8 "[-* ** * 1 ** . + 2]"
1 2 LEU 13.830 0.926 9 10 "[ * *+1-***.*** 2]"
1 3 ALA 2.195 0.675 18 1 "[ . 1 . + 2]"
1 4 GLY 15.617 1.064 18 7 "[-* . * 1*** . + 2]"
1 5 ALA 12.648 0.921 7 5 "[ * + 1 *. *- 2]"
1 6 VAL 14.126 0.870 18 6 "[ ** * 1* . *+ 2]"
1 7 GLU 45.135 0.921 7 17 "[ -****+******** ** *]"
1 8 PHE 15.832 0.529 15 3 "[ .- *1 + 2]"
1 9 ASN 26.741 0.890 3 5 "[ -+ * * 1 * . 2]"
1 10 ASP 39.016 0.832 11 12 "[ *** *1+-*** ** *]"
1 11 VAL 11.782 0.926 9 5 "[ . *+1 *.-* 2]"
1 12 LYS 33.512 1.045 18 17 "[****** * *-** ***+**]"
1 13 THR 36.727 1.000 15 19 "[***** ****-***+*****]"
1 14 LEU 12.647 0.700 14 8 "[** *. 1 * +.*- *]"
1 15 LEU 22.600 0.737 11 11 "[ * ** * 1+** . ****]"
1 16 ARG 49.987 1.392 18 20 [*************-***+**]
1 17 GLU 30.249 1.392 18 15 "[** ** ** *** *.*-+**]"
1 18 TRP 8.301 0.615 20 6 "[ *** - . * +]"
1 19 ILE 5.466 0.464 17 0 "[ . 1 . 2]"
1 20 THR 6.394 0.728 11 4 "[ . *+ . *-2]"
1 21 THR 3.607 0.464 17 0 "[ . 1 . 2]"
1 22 ILE 4.148 0.503 10 1 "[ . + . 2]"
1 23 SER 7.120 0.608 2 3 "[ + . 1 . - *]"
1 24 ASP 2.903 0.539 20 1 "[ . 1 . +]"
1 25 PRO 4.166 0.615 20 5 "[ *-* 1 . * +]"
1 26 MET 14.670 0.768 14 9 "[**-*. 1* *+. * *2]"
1 27 GLU 0.999 0.327 10 0 "[ . 1 . 2]"
1 28 GLU 4.498 0.580 10 3 "[ - . + . *2]"
1 29 ASP 20.106 1.076 13 11 "[**-*. 1**+*.** *]"
1 30 ILE 33.154 1.360 14 20 [***********-*+******]
1 31 LEU 21.700 0.833 13 16 "[ -**. ** ***+*******]"
1 32 GLN 39.195 1.360 14 12 "[ -**. * 1***+.*** *]"
1 33 VAL 18.412 0.981 13 20 [************+*-*****]
1 34 VAL 14.365 0.878 14 9 "[ * - * * *+.* **2]"
1 35 LYS 10.491 0.810 4 3 "[ +. 1* - . 2]"
1 36 TYR 5.097 0.355 17 0 "[ . 1 . 2]"
1 37 CYS 5.205 0.719 13 1 "[ . 1 + . 2]"
1 38 THR 14.360 0.605 18 9 "[ ** .** ** - . + *]"
1 39 ASP 7.906 0.810 4 2 "[ -+. 1 . 2]"
1 40 LEU 13.229 0.830 11 5 "[ ** 1+ *-. 2]"
1 41 ILE 22.988 0.991 2 19 "[*+********-***** ***]"
1 42 GLU 11.729 0.727 4 3 "[ -+. * . 2]"
1 43 GLU 36.630 0.794 3 14 "[ +******* -** ***]"
1 44 LYS 24.861 0.794 3 13 "[ +****-** ** ***]"
1 45 ASP 28.178 0.991 2 19 "[*+********-***** ***]"
1 46 LEU 35.600 0.650 11 8 "[ ** . *-*1+ . * *]"
1 47 GLU 24.942 0.830 11 10 "[ ** ***-*1+ * . * 2]"
1 48 LYS 24.785 0.708 3 10 "[ *+** * * * * * -]"
1 49 LEU 10.671 0.765 10 5 "[ . + * * *-]"
1 50 ASP 10.887 0.765 10 3 "[ . + . *-]"
1 51 LEU 15.312 0.514 15 1 "[ . 1 + 2]"
1 52 VAL 34.131 1.045 18 15 "[****** *-** ** +**]"
1 53 ILE 10.594 0.669 15 3 "[ - . 1 + *2]"
1 54 LYS 13.707 0.642 2 6 "[-+ .* 1 ** *]"
1 55 TYR 29.642 1.078 20 20 [*-*****************+]
1 56 MET 9.056 0.737 11 8 "[ * ** 1+*- . * *]"
1 57 LYS 5.134 0.412 10 0 "[ . 1 . 2]"
1 58 ARG 13.483 0.663 15 8 "[-* ** * 1* + *]"
1 59 LEU 7.729 0.709 6 6 "[ * *+ * 1* * 2]"
1 60 MET 15.025 0.708 11 4 "[ - . *+ . * 2]"
1 61 GLN 5.213 0.477 19 0 "[ . 1 . 2]"
1 62 GLN 5.948 0.484 4 0 "[ . 1 . 2]"
1 63 SER 1.057 0.400 19 0 "[ . 1 . 2]"
1 64 VAL 12.685 0.581 14 6 "[ * . * * +.*- 2]"
1 65 GLU 10.431 0.614 2 4 "[ + . - 1 .* *2]"
1 66 SER 4.190 0.607 8 1 "[ . + 1 . 2]"
1 67 VAL 0.792 0.225 15 0 "[ . 1 . 2]"
1 68 TRP 5.553 0.608 2 4 "[ +* * 1 . - 2]"
1 69 ASN 16.578 0.614 2 7 "[ + . -* * *. * *2]"
1 70 MET 0.231 0.231 16 0 "[ . 1 . 2]"
1 71 ALA 4.237 0.708 11 3 "[ . *+ . -2]"
1 72 PHE 4.778 0.542 18 1 "[ . 1 . + 2]"
1 73 ASP 18.017 0.771 12 12 "[*****- * 1 + *** *]"
1 74 PHE 18.367 0.744 6 7 "[ ** .+ 1 - . ***]"
1 75 ILE 25.176 0.771 12 16 "[** **- * * +********]"
1 76 LEU 30.037 1.139 20 12 "[ * **-* 1* * **** +]"
1 77 ASP 40.394 0.744 6 13 "[*** .+* -* * ** ***]"
1 78 ASN 23.346 0.510 9 1 "[ . +1 . 2]"
1 79 VAL 16.103 1.139 20 6 "[ . ** 1 .**- +]"
1 80 GLN 50.916 0.708 6 17 "[*** *+********** **]"
1 81 VAL 24.510 0.876 4 8 "[ *+* * ** .* * 2]"
1 82 VAL 15.255 0.605 18 9 "[ ** .** ** - . + *]"
1 83 LEU 4.009 0.535 18 1 "[ . 1 . + 2]"
1 84 GLN 26.155 0.927 2 16 "[ +******-*** .*****]"
1 85 GLN 14.301 0.977 5 13 "[* *-+ ** * **** * *]"
1 86 THR 11.479 0.946 7 9 "[* * * + 1* **.- *2]"
1 87 TYR 19.761 0.977 5 12 "[* *-+ ** * **** *]"
1 88 GLY 17.053 0.927 2 8 "[ + .* * 1** . - **]"
1 89 SER 18.527 0.520 11 3 "[ . 1+ .- *2]"
1 90 THR 23.325 0.707 19 6 "[ - . *1 * *. *+2]"
1 91 LEU 36.983 0.707 19 14 "[ ** **-***** *. *+*]"
1 92 LYS 32.256 1.018 16 11 "[* * . - *1 **.+****]"
1 93 VAL 19.144 0.936 14 8 "[ * * *1 +.*** -]"
1 94 THR 20.532 1.018 16 11 "[* * * *1 **.+***-]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 60 MET HB2 1 61 GLN H . . 4.230 3.037 2.536 3.285 . 0 0 "[ . 1 . 2]" 1
2 1 12 LYS H 1 12 LYS HB2 . . 3.980 2.640 2.393 3.670 . 0 0 "[ . 1 . 2]" 1
3 1 16 ARG H 1 16 ARG HB3 . . 3.980 2.784 2.539 3.569 . 0 0 "[ . 1 . 2]" 1
4 1 16 ARG H 1 16 ARG HB2 . . 3.980 2.442 2.175 2.613 . 0 0 "[ . 1 . 2]" 1
5 1 87 TYR H 1 87 TYR HB3 . . 3.830 3.038 2.598 3.692 . 0 0 "[ . 1 . 2]" 1
6 1 56 MET H 1 56 MET HB3 . . 3.920 2.499 2.317 2.598 . 0 0 "[ . 1 . 2]" 1
7 1 56 MET H 1 56 MET HB2 . . 3.920 2.831 2.290 3.679 . 0 0 "[ . 1 . 2]" 1
8 1 52 VAL H 1 52 VAL HB . . 3.580 2.424 2.331 2.513 . 0 0 "[ . 1 . 2]" 1
9 1 35 LYS H 1 35 LYS HB3 . . 3.730 2.830 2.460 3.612 . 0 0 "[ . 1 . 2]" 1
10 1 40 LEU H 1 40 LEU HB3 . . 3.790 3.430 2.653 3.676 . 0 0 "[ . 1 . 2]" 1
11 1 55 TYR H 1 55 TYR HB2 . . 3.610 2.364 2.158 2.505 . 0 0 "[ . 1 . 2]" 1
12 1 80 GLN HB2 1 81 VAL H . . 3.550 3.085 2.695 3.704 0.154 13 0 "[ . 1 . 2]" 1
13 1 39 ASP H 1 39 ASP HB2 . . 3.670 2.449 2.258 2.589 . 0 0 "[ . 1 . 2]" 1
14 1 78 ASN H 1 78 ASN HB2 . . 3.550 2.422 2.302 2.592 . 0 0 "[ . 1 . 2]" 1
15 1 78 ASN H 1 78 ASN HB3 . . 3.550 3.612 3.569 3.648 0.098 10 0 "[ . 1 . 2]" 1
16 1 15 LEU H 1 15 LEU HB2 . . 4.040 2.555 2.400 2.661 . 0 0 "[ . 1 . 2]" 1
17 1 15 LEU H 1 15 LEU HB3 . . 4.040 3.637 3.572 3.684 . 0 0 "[ . 1 . 2]" 1
18 1 60 MET H 1 60 MET HB2 . . 4.040 2.371 2.128 2.465 . 0 0 "[ . 1 . 2]" 1
19 1 31 LEU H 1 31 LEU HB2 . . 3.890 2.855 2.413 3.744 . 0 0 "[ . 1 . 2]" 1
20 1 72 PHE H 1 72 PHE HB2 . . 3.890 2.719 2.500 3.509 . 0 0 "[ . 1 . 2]" 1
21 1 72 PHE H 1 72 PHE HB3 . . 3.890 2.341 2.167 2.588 . 0 0 "[ . 1 . 2]" 1
22 1 48 LYS H 1 48 LYS HB2 . . 3.360 2.595 2.281 3.683 0.323 5 0 "[ . 1 . 2]" 1
23 1 90 THR H 1 90 THR HB . . 3.860 3.421 2.571 3.851 . 0 0 "[ . 1 . 2]" 1
24 1 64 VAL H 1 64 VAL HB . . 3.950 2.768 2.496 3.686 . 0 0 "[ . 1 . 2]" 1
25 1 40 LEU HB3 1 41 ILE H . . 4.110 3.502 2.643 3.902 . 0 0 "[ . 1 . 2]" 1
26 1 22 ILE H 1 22 ILE HB . . 4.170 2.752 2.484 3.011 . 0 0 "[ . 1 . 2]" 1
27 1 73 ASP H 1 73 ASP HB2 . . 3.760 2.497 2.354 2.602 . 0 0 "[ . 1 . 2]" 1
28 1 73 ASP H 1 73 ASP HB3 . . 3.760 2.815 2.449 3.644 . 0 0 "[ . 1 . 2]" 1
29 1 6 VAL H 1 6 VAL HB . . 3.860 3.001 2.604 3.853 . 0 0 "[ . 1 . 2]" 1
30 1 49 LEU H 1 49 LEU HB2 . . 3.640 2.463 2.285 2.710 . 0 0 "[ . 1 . 2]" 1
31 1 49 LEU H 1 49 LEU HB3 . . 3.640 2.540 2.336 2.725 . 0 0 "[ . 1 . 2]" 1
32 1 38 THR H 1 38 THR HB . . 4.110 3.623 3.558 3.666 . 0 0 "[ . 1 . 2]" 1
33 1 37 CYS H 1 37 CYS HB3 . . 3.950 3.585 3.523 3.646 . 0 0 "[ . 1 . 2]" 1
34 1 37 CYS H 1 37 CYS HB2 . . 3.950 2.435 2.358 2.512 . 0 0 "[ . 1 . 2]" 1
35 1 74 PHE H 1 74 PHE HB2 . . 3.700 2.584 2.494 2.695 . 0 0 "[ . 1 . 2]" 1
36 1 13 THR HB 1 14 LEU H . . 3.480 2.706 2.287 3.162 . 0 0 "[ . 1 . 2]" 1
37 1 81 VAL HB 1 82 VAL H . . 3.270 2.598 2.441 2.801 . 0 0 "[ . 1 . 2]" 1
38 1 53 ILE H 1 53 ILE HB . . 3.580 2.376 2.163 2.520 . 0 0 "[ . 1 . 2]" 1
39 1 12 LYS HB3 1 13 THR H . . 3.890 2.721 2.296 3.859 . 0 0 "[ . 1 . 2]" 1
40 1 13 THR H 1 13 THR HB . . 3.360 2.540 2.400 2.683 . 0 0 "[ . 1 . 2]" 1
41 1 45 ASP H 1 45 ASP HB3 . . 3.550 2.874 2.416 3.706 0.156 9 0 "[ . 1 . 2]" 1
42 1 57 LYS QB 1 58 ARG H . . 4.800 2.875 2.283 3.699 . 0 0 "[ . 1 . 2]" 1
43 1 57 LYS H 1 59 LEU H . . 5.310 4.335 3.998 4.747 . 0 0 "[ . 1 . 2]" 1
44 1 55 TYR HA 1 59 LEU H . . 5.250 4.371 3.916 4.730 . 0 0 "[ . 1 . 2]" 1
45 1 57 LYS HA 1 59 LEU H . . 5.340 4.567 4.330 4.933 . 0 0 "[ . 1 . 2]" 1
46 1 58 ARG QB 1 59 LEU H . . 4.950 2.549 2.365 2.781 . 0 0 "[ . 1 . 2]" 1
47 1 58 ARG HA 1 61 GLN H . . 4.790 3.852 3.505 4.303 . 0 0 "[ . 1 . 2]" 1
48 1 57 LYS HA 1 61 GLN H . . 5.100 4.075 3.517 4.424 . 0 0 "[ . 1 . 2]" 1
49 1 83 LEU H 1 85 GLN H . . 4.570 4.033 3.844 4.256 . 0 0 "[ . 1 . 2]" 1
50 1 83 LEU QB 1 85 GLN H . . 5.850 4.759 4.624 5.064 . 0 0 "[ . 1 . 2]" 1
51 1 91 LEU H 1 92 LYS H . . 4.380 4.502 4.291 4.658 0.278 18 0 "[ . 1 . 2]" 1
52 1 92 LYS H 1 93 VAL H . . 4.110 4.345 4.062 4.517 0.407 17 0 "[ . 1 . 2]" 1
53 1 91 LEU HA 1 92 LYS H . . 2.870 2.202 2.115 2.426 . 0 0 "[ . 1 . 2]" 1
54 1 2 LEU H 1 3 ALA H . . 4.790 3.654 2.110 4.492 . 0 0 "[ . 1 . 2]" 1
55 1 5 ALA H 1 7 GLU H . . 5.070 5.185 4.483 5.991 0.921 7 3 "[ . + 1 -. * 2]" 1
56 1 3 ALA H 1 5 ALA H . . 4.970 3.840 2.620 4.567 . 0 0 "[ . 1 . 2]" 1
57 1 1 ASN HA 1 5 ALA H . . 4.690 4.818 3.658 5.200 0.510 18 1 "[ . 1 . + 2]" 1
58 1 1 ASN HB2 1 5 ALA H . . 4.850 3.266 2.300 4.553 . 0 0 "[ . 1 . 2]" 1
59 1 1 ASN HB3 1 5 ALA H . . 4.850 4.337 2.890 5.141 0.291 5 0 "[ . 1 . 2]" 1
60 1 3 ALA HA 1 5 ALA H . . 4.790 4.480 4.100 5.063 0.273 16 0 "[ . 1 . 2]" 1
61 1 68 TRP HA 1 71 ALA H . . 4.380 3.285 2.949 3.679 . 0 0 "[ . 1 . 2]" 1
62 1 69 ASN QB 1 71 ALA H . . 6.380 4.714 4.400 5.007 . 0 0 "[ . 1 . 2]" 1
63 1 35 LYS HA 1 37 CYS H . . 5.410 4.545 4.372 4.727 . 0 0 "[ . 1 . 2]" 1
64 1 33 VAL HA 1 37 CYS H . . 4.760 4.020 3.752 4.158 . 0 0 "[ . 1 . 2]" 1
65 1 10 ASP H 1 11 VAL H . . 3.480 2.582 2.356 2.746 . 0 0 "[ . 1 . 2]" 1
66 1 10 ASP H 1 12 LYS H . . 4.380 4.008 3.781 4.190 . 0 0 "[ . 1 . 2]" 1
67 1 7 GLU H 1 10 ASP H . . 4.720 4.750 4.086 5.141 0.421 4 0 "[ . 1 . 2]" 1
68 1 7 GLU HA 1 10 ASP H . . 4.040 4.580 4.367 4.872 0.832 11 12 "[ *** *1+-*** ** *]" 1
69 1 7 GLU QB 1 10 ASP H . . 3.530 2.637 2.215 2.973 . 0 0 "[ . 1 . 2]" 1
70 1 29 ASP H 1 30 ILE H . . 3.950 2.505 2.401 2.745 . 0 0 "[ . 1 . 2]" 1
71 1 29 ASP H 1 31 LEU H . . 4.600 4.040 3.729 4.305 . 0 0 "[ . 1 . 2]" 1
72 1 26 MET H 1 29 ASP H . . 5.380 4.812 4.055 5.525 0.145 4 0 "[ . 1 . 2]" 1
73 1 27 GLU H 1 29 ASP H . . 5.160 4.750 4.284 5.339 0.179 14 0 "[ . 1 . 2]" 1
74 1 26 MET HA 1 29 ASP H . . 5.130 5.256 4.648 5.898 0.768 14 4 "[- *. 1 +. * 2]" 1
75 1 39 ASP H 1 42 GLU H . . 5.160 4.856 4.543 5.001 . 0 0 "[ . 1 . 2]" 1
76 1 37 CYS H 1 39 ASP H . . 4.690 4.081 3.843 4.367 . 0 0 "[ . 1 . 2]" 1
77 1 39 ASP H 1 40 LEU H . . 3.760 2.643 2.497 2.819 . 0 0 "[ . 1 . 2]" 1
78 1 38 THR HB 1 39 ASP H . . 4.290 3.802 3.606 3.983 . 0 0 "[ . 1 . 2]" 1
79 1 35 LYS HA 1 39 ASP H . . 4.790 4.187 3.771 4.414 . 0 0 "[ . 1 . 2]" 1
80 1 37 CYS HA 1 39 ASP H . . 5.000 4.498 4.225 4.801 . 0 0 "[ . 1 . 2]" 1
81 1 75 ILE H 1 76 LEU H . . 4.230 2.723 2.590 2.848 . 0 0 "[ . 1 . 2]" 1
82 1 75 ILE H 1 77 ASP H . . 4.850 4.130 4.007 4.272 . 0 0 "[ . 1 . 2]" 1
83 1 74 PHE H 1 75 ILE H . . 4.040 2.749 2.679 2.811 . 0 0 "[ . 1 . 2]" 1
84 1 73 ASP H 1 75 ILE H . . 5.000 4.497 4.138 4.710 . 0 0 "[ . 1 . 2]" 1
85 1 75 ILE H 1 78 ASN H . . 4.910 4.961 4.782 5.093 0.183 14 0 "[ . 1 . 2]" 1
86 1 41 ILE HA 1 45 ASP H . . 3.730 4.450 4.133 4.721 0.991 2 19 "[*+********-***** ***]" 1
87 1 40 LEU HA 1 45 ASP H . . 4.070 3.420 2.968 3.958 . 0 0 "[ . 1 . 2]" 1
88 1 75 ILE H 1 75 ILE HB . . 3.860 2.563 2.499 2.633 . 0 0 "[ . 1 . 2]" 1
89 1 50 ASP H 1 52 VAL H . . 4.880 4.346 3.987 4.635 . 0 0 "[ . 1 . 2]" 1
90 1 49 LEU H 1 50 ASP H . . 3.480 2.815 2.671 2.938 . 0 0 "[ . 1 . 2]" 1
91 1 48 LYS HA 1 50 ASP H . . 4.820 4.308 4.079 4.536 . 0 0 "[ . 1 . 2]" 1
92 1 49 LEU HB3 1 50 ASP H . . 4.040 2.482 2.083 2.679 . 0 0 "[ . 1 . 2]" 1
93 1 49 LEU HB2 1 50 ASP H . . 4.040 3.791 3.508 3.959 . 0 0 "[ . 1 . 2]" 1
94 1 73 ASP H 1 74 PHE H . . 3.890 2.729 2.632 2.874 . 0 0 "[ . 1 . 2]" 1
95 1 70 MET HA 1 73 ASP H . . 4.010 3.440 3.138 3.881 . 0 0 "[ . 1 . 2]" 1
96 1 72 PHE HB3 1 73 ASP H . . 4.290 2.569 2.273 3.585 . 0 0 "[ . 1 . 2]" 1
97 1 72 PHE HB2 1 73 ASP H . . 4.290 3.897 3.729 4.181 . 0 0 "[ . 1 . 2]" 1
98 1 69 ASN QB 1 73 ASP H . . 6.380 5.066 4.603 5.608 . 0 0 "[ . 1 . 2]" 1
99 1 73 ASP H 1 75 ILE HB . . 5.250 5.739 5.323 6.021 0.771 12 11 "[** **- * 1 + *** *]" 1
100 1 77 ASP H 1 80 GLN H . . 4.720 4.936 4.856 5.007 0.287 6 0 "[ . 1 . 2]" 1
101 1 74 PHE H 1 77 ASP H . . 5.040 4.762 4.597 4.936 . 0 0 "[ . 1 . 2]" 1
102 1 77 ASP H 1 78 ASN H . . 3.480 2.827 2.704 2.912 . 0 0 "[ . 1 . 2]" 1
103 1 75 ILE HA 1 77 ASP H . . 4.720 4.511 4.320 4.777 0.057 18 0 "[ . 1 . 2]" 1
104 1 75 ILE HB 1 77 ASP H . . 4.970 5.008 4.805 5.125 0.155 16 0 "[ . 1 . 2]" 1
105 1 76 LEU HB2 1 77 ASP H . . 3.670 3.383 2.719 4.081 0.411 4 0 "[ . 1 . 2]" 1
106 1 26 MET H 1 27 GLU H . . 5.160 4.573 4.483 4.657 . 0 0 "[ . 1 . 2]" 1
107 1 26 MET HA 1 27 GLU H . . 3.390 2.281 2.156 2.446 . 0 0 "[ . 1 . 2]" 1
108 1 26 MET HB3 1 27 GLU H . . 4.350 3.504 2.336 4.272 . 0 0 "[ . 1 . 2]" 1
109 1 26 MET HB2 1 27 GLU H . . 4.350 3.400 2.389 4.415 0.065 2 0 "[ . 1 . 2]" 1
110 1 27 GLU H 1 27 GLU HB3 . . 3.670 2.681 2.446 3.590 . 0 0 "[ . 1 . 2]" 1
111 1 27 GLU H 1 27 GLU HB2 . . 3.670 2.597 2.354 3.628 . 0 0 "[ . 1 . 2]" 1
112 1 27 GLU H 1 28 GLU H . . 4.070 2.716 2.515 2.868 . 0 0 "[ . 1 . 2]" 1
113 1 28 GLU H 1 30 ILE H . . 5.070 4.033 3.706 4.369 . 0 0 "[ . 1 . 2]" 1
114 1 28 GLU H 1 29 ASP H . . 3.950 2.836 2.641 3.093 . 0 0 "[ . 1 . 2]" 1
115 1 26 MET HA 1 28 GLU H . . 4.570 4.127 3.753 4.590 0.020 13 0 "[ . 1 . 2]" 1
116 1 42 GLU H 1 45 ASP H . . 5.340 5.365 5.079 5.653 0.313 6 0 "[ . 1 . 2]" 1
117 1 42 GLU H 1 43 GLU H . . 3.760 2.491 2.423 2.569 . 0 0 "[ . 1 . 2]" 1
118 1 39 ASP HA 1 42 GLU H . . 3.890 3.333 2.950 3.630 . 0 0 "[ . 1 . 2]" 1
119 1 42 GLU H 1 43 GLU HA . . 4.880 5.166 5.105 5.200 0.320 6 0 "[ . 1 . 2]" 1
120 1 43 GLU H 1 45 ASP H . . 4.380 3.590 3.338 3.789 . 0 0 "[ . 1 . 2]" 1
121 1 39 ASP HA 1 43 GLU H . . 4.720 4.236 3.807 4.525 . 0 0 "[ . 1 . 2]" 1
122 1 41 ILE HA 1 43 GLU H . . 4.450 4.298 4.077 4.552 0.102 10 0 "[ . 1 . 2]" 1
123 1 42 GLU QB 1 43 GLU H . . 4.800 3.295 2.499 3.885 . 0 0 "[ . 1 . 2]" 1
124 1 47 GLU H 1 50 ASP H . . 4.940 4.758 4.411 5.120 0.180 11 0 "[ . 1 . 2]" 1
125 1 46 LEU H 1 47 GLU H . . 3.170 2.635 2.506 2.750 . 0 0 "[ . 1 . 2]" 1
126 1 45 ASP HA 1 47 GLU H . . 3.890 3.047 2.807 3.346 . 0 0 "[ . 1 . 2]" 1
127 1 64 VAL H 1 65 GLU H . . 3.390 3.051 2.370 3.954 0.564 16 1 "[ . 1 .+ 2]" 1
128 1 64 VAL HA 1 65 GLU H . . 3.800 3.563 3.344 3.615 . 0 0 "[ . 1 . 2]" 1
129 1 63 SER QB 1 65 GLU H . . 5.270 4.509 3.874 5.670 0.400 19 0 "[ . 1 . 2]" 1
130 1 6 VAL H 1 7 GLU H . . 3.420 2.234 1.765 2.612 . 0 0 "[ . 1 . 2]" 1
131 1 7 GLU H 1 10 ASP HB3 . . 4.660 4.245 3.382 5.138 0.478 11 0 "[ . 1 . 2]" 1
132 1 7 GLU H 1 10 ASP HB2 . . 4.660 4.627 3.580 5.288 0.628 9 4 "[ .* +1 * - 2]" 1
133 1 7 GLU H 1 7 GLU QB . . 3.860 2.418 2.081 2.754 . 0 0 "[ . 1 . 2]" 1
134 1 72 PHE H 1 75 ILE H . . 4.910 4.866 4.656 5.010 0.100 10 0 "[ . 1 . 2]" 1
135 1 71 ALA H 1 72 PHE H . . 3.950 2.543 2.381 2.692 . 0 0 "[ . 1 . 2]" 1
136 1 72 PHE H 1 73 ASP H . . 3.860 2.804 2.614 2.895 . 0 0 "[ . 1 . 2]" 1
137 1 68 TRP HA 1 72 PHE H . . 4.910 3.947 3.665 4.192 . 0 0 "[ . 1 . 2]" 1
138 1 69 ASN HA 1 72 PHE H . . 4.170 3.377 3.027 3.744 . 0 0 "[ . 1 . 2]" 1
139 1 69 ASN QB 1 72 PHE H . . 6.320 4.905 4.640 5.107 . 0 0 "[ . 1 . 2]" 1
140 1 70 MET QB 1 72 PHE H . . 6.320 4.786 4.515 5.257 . 0 0 "[ . 1 . 2]" 1
141 1 72 PHE H 1 74 PHE H . . 4.850 4.153 3.914 4.364 . 0 0 "[ . 1 . 2]" 1
142 1 73 ASP HB2 1 74 PHE H . . 4.170 3.622 2.670 4.076 . 0 0 "[ . 1 . 2]" 1
143 1 73 ASP HB3 1 74 PHE H . . 4.170 2.904 2.484 3.815 . 0 0 "[ . 1 . 2]" 1
144 1 74 PHE H 1 75 ILE HB . . 4.850 4.990 4.799 5.053 0.203 13 0 "[ . 1 . 2]" 1
145 1 3 ALA H 1 4 GLY H . . 4.070 2.934 2.264 3.986 . 0 0 "[ . 1 . 2]" 1
146 1 2 LEU H 1 4 GLY H . . 4.540 4.031 3.026 5.059 0.519 11 1 "[ . 1+ . 2]" 1
147 1 1 ASN HA 1 4 GLY H . . 5.100 5.354 4.622 6.164 1.064 18 6 "[*- . * 1 ** . + 2]" 1
148 1 2 LEU HA 1 4 GLY H . . 4.200 4.251 3.428 5.054 0.854 8 5 "[ . + 1*-* . * 2]" 1
149 1 1 ASN HB2 1 4 GLY H . . 4.690 3.503 2.992 3.958 . 0 0 "[ . 1 . 2]" 1
150 1 87 TYR H 1 88 GLY H . . 3.210 2.309 2.033 2.470 . 0 0 "[ . 1 . 2]" 1
151 1 88 GLY H 1 89 SER H . . 3.580 2.448 2.309 2.541 . 0 0 "[ . 1 . 2]" 1
152 1 84 GLN HA 1 88 GLY H . . 3.240 3.152 2.558 3.524 0.284 10 0 "[ . 1 . 2]" 1
153 1 87 TYR HB3 1 88 GLY H . . 4.170 3.338 2.969 4.124 . 0 0 "[ . 1 . 2]" 1
154 1 87 TYR HB2 1 88 GLY H . . 4.170 3.681 3.118 4.008 . 0 0 "[ . 1 . 2]" 1
155 1 18 TRP H 1 19 ILE H . . 4.170 2.832 2.555 3.058 . 0 0 "[ . 1 . 2]" 1
156 1 15 LEU HA 1 19 ILE H . . 5.220 4.022 3.569 4.378 . 0 0 "[ . 1 . 2]" 1
157 1 17 GLU QB 1 19 ILE H . . 6.290 5.282 4.779 5.458 . 0 0 "[ . 1 . 2]" 1
158 1 27 GLU HA 1 30 ILE H . . 4.660 3.392 2.913 4.335 . 0 0 "[ . 1 . 2]" 1
159 1 29 ASP QB 1 30 ILE H . . 4.790 3.341 2.797 3.696 . 0 0 "[ . 1 . 2]" 1
160 1 39 ASP H 1 41 ILE H . . 4.820 4.143 3.919 4.314 . 0 0 "[ . 1 . 2]" 1
161 1 41 ILE H 1 42 GLU H . . 3.830 2.710 2.421 2.871 . 0 0 "[ . 1 . 2]" 1
162 1 41 ILE H 1 43 GLU H . . 4.720 3.949 3.828 4.122 . 0 0 "[ . 1 . 2]" 1
163 1 38 THR HB 1 41 ILE H . . 5.220 5.408 5.155 5.662 0.442 6 0 "[ . 1 . 2]" 1
164 1 39 ASP HA 1 41 ILE H . . 4.970 4.315 4.123 4.586 . 0 0 "[ . 1 . 2]" 1
165 1 38 THR HA 1 41 ILE H . . 4.070 3.502 3.162 3.833 . 0 0 "[ . 1 . 2]" 1
166 1 37 CYS HA 1 41 ILE H . . 4.940 4.539 4.419 4.631 . 0 0 "[ . 1 . 2]" 1
167 1 40 LEU HB2 1 41 ILE H . . 4.110 3.027 2.691 3.809 . 0 0 "[ . 1 . 2]" 1
168 1 53 ILE H 1 56 MET H . . 5.440 4.877 4.513 5.155 . 0 0 "[ . 1 . 2]" 1
169 1 53 ILE H 1 54 LYS H . . 3.860 2.664 2.518 2.787 . 0 0 "[ . 1 . 2]" 1
170 1 50 ASP HA 1 53 ILE H . . 4.420 4.186 3.802 4.420 0.000 11 0 "[ . 1 . 2]" 1
171 1 50 ASP QB 1 53 ILE H . . 6.160 5.412 5.193 5.561 . 0 0 "[ . 1 . 2]" 1
172 1 12 LYS H 1 13 THR H . . 3.790 2.613 2.448 2.793 . 0 0 "[ . 1 . 2]" 1
173 1 9 ASN HA 1 12 LYS H . . 4.480 3.648 3.202 4.080 . 0 0 "[ . 1 . 2]" 1
174 1 35 LYS H 1 37 CYS H . . 4.660 4.141 3.928 4.276 . 0 0 "[ . 1 . 2]" 1
175 1 35 LYS H 1 36 TYR HA . . 5.220 5.347 5.226 5.420 0.200 1 0 "[ . 1 . 2]" 1
176 1 35 LYS H 1 36 TYR QB . . 6.160 4.655 4.293 4.986 . 0 0 "[ . 1 . 2]" 1
177 1 34 VAL HB 1 35 LYS H . . 3.860 2.683 2.466 2.844 . 0 0 "[ . 1 . 2]" 1
178 1 44 LYS H 1 45 ASP H . . 3.330 2.636 2.512 2.744 . 0 0 "[ . 1 . 2]" 1
179 1 42 GLU H 1 44 LYS H . . 4.540 3.959 3.693 4.284 . 0 0 "[ . 1 . 2]" 1
180 1 42 GLU HA 1 44 LYS H . . 4.290 3.730 3.397 4.065 . 0 0 "[ . 1 . 2]" 1
181 1 41 ILE HA 1 44 LYS H . . 4.380 3.859 3.517 4.420 0.040 16 0 "[ . 1 . 2]" 1
182 1 47 GLU H 1 48 LYS H . . 3.420 2.752 2.463 3.033 . 0 0 "[ . 1 . 2]" 1
183 1 48 LYS H 1 50 ASP H . . 4.760 4.287 4.091 4.502 . 0 0 "[ . 1 . 2]" 1
184 1 45 ASP HA 1 48 LYS H . . 5.000 4.283 3.259 5.141 0.141 5 0 "[ . 1 . 2]" 1
185 1 46 LEU HA 1 48 LYS H . . 4.510 4.128 3.661 4.567 0.057 4 0 "[ . 1 . 2]" 1
186 1 48 LYS H 1 50 ASP QB . . 6.380 4.963 4.708 5.252 . 0 0 "[ . 1 . 2]" 1
187 1 47 GLU QB 1 48 LYS H . . 5.110 2.369 2.222 2.577 . 0 0 "[ . 1 . 2]" 1
188 1 52 VAL H 1 54 LYS H . . 4.660 4.100 3.752 4.498 . 0 0 "[ . 1 . 2]" 1
189 1 54 LYS H 1 55 TYR H . . 3.950 2.554 2.418 2.794 . 0 0 "[ . 1 . 2]" 1
190 1 50 ASP HA 1 54 LYS H . . 4.320 4.262 3.823 4.539 0.219 7 0 "[ . 1 . 2]" 1
191 1 53 ILE HB 1 54 LYS H . . 3.790 2.860 2.641 3.027 . 0 0 "[ . 1 . 2]" 1
192 1 55 TYR H 1 57 LYS H . . 4.850 3.857 3.614 4.246 . 0 0 "[ . 1 . 2]" 1
193 1 57 LYS H 1 58 ARG H . . 3.730 2.704 2.559 2.942 . 0 0 "[ . 1 . 2]" 1
194 1 53 ILE HA 1 57 LYS H . . 4.790 3.864 3.291 4.110 . 0 0 "[ . 1 . 2]" 1
195 1 57 LYS H 1 58 ARG QB . . 5.670 4.486 4.304 4.895 . 0 0 "[ . 1 . 2]" 1
196 1 14 LEU H 1 16 ARG H . . 5.000 4.265 4.082 4.462 . 0 0 "[ . 1 . 2]" 1
197 1 14 LEU H 1 15 LEU H . . 3.860 2.785 2.582 3.079 . 0 0 "[ . 1 . 2]" 1
198 1 14 LEU H 1 17 GLU H . . 5.130 5.468 4.821 5.830 0.700 14 7 "[* *. 1 * +.*- *]" 1
199 1 12 LYS H 1 14 LEU H . . 4.720 4.148 3.794 4.520 . 0 0 "[ . 1 . 2]" 1
200 1 11 VAL H 1 14 LEU H . . 5.160 4.910 4.671 5.183 0.023 18 0 "[ . 1 . 2]" 1
201 1 12 LYS HA 1 14 LEU H . . 5.160 4.403 4.012 4.857 . 0 0 "[ . 1 . 2]" 1
202 1 11 VAL HA 1 14 LEU H . . 4.350 3.838 3.354 4.284 . 0 0 "[ . 1 . 2]" 1
203 1 15 LEU H 1 17 GLU H . . 5.500 4.957 4.445 5.264 . 0 0 "[ . 1 . 2]" 1
204 1 12 LYS H 1 15 LEU H . . 5.070 4.854 4.605 5.033 . 0 0 "[ . 1 . 2]" 1
205 1 13 THR HA 1 15 LEU H . . 4.970 4.986 4.647 5.148 0.178 11 0 "[ . 1 . 2]" 1
206 1 11 VAL HA 1 15 LEU H . . 5.130 4.260 3.984 4.599 . 0 0 "[ . 1 . 2]" 1
207 1 1 ASN H1 1 2 LEU H . . 4.970 4.394 3.875 4.602 . 0 0 "[ . 1 . 2]" 1
208 1 2 LEU H 1 5 ALA H . . 3.700 3.391 2.417 4.283 0.583 5 1 "[ + 1 . 2]" 1
209 1 1 ASN HA 1 2 LEU H . . 3.300 2.443 2.127 3.011 . 0 0 "[ . 1 . 2]" 1
210 1 1 ASN HB3 1 2 LEU H . . 4.040 3.717 2.052 4.266 0.226 4 0 "[ . 1 . 2]" 1
211 1 1 ASN HB2 1 2 LEU H . . 4.040 2.893 1.892 4.385 0.345 11 0 "[ . 1 . 2]" 1
212 1 31 LEU H 1 34 VAL H . . 5.000 4.831 4.682 4.984 . 0 0 "[ . 1 . 2]" 1
213 1 30 ILE H 1 31 LEU H . . 4.230 2.504 2.222 2.771 . 0 0 "[ . 1 . 2]" 1
214 1 28 GLU HA 1 31 LEU H . . 4.290 3.638 2.929 4.136 . 0 0 "[ . 1 . 2]" 1
215 1 30 ILE HB 1 31 LEU H . . 3.760 2.717 2.325 2.924 . 0 0 "[ . 1 . 2]" 1
216 1 31 LEU H 1 31 LEU HB3 . . 3.890 3.013 2.185 3.643 . 0 0 "[ . 1 . 2]" 1
217 1 40 LEU H 1 42 GLU H . . 5.040 4.080 3.572 4.381 . 0 0 "[ . 1 . 2]" 1
218 1 37 CYS H 1 40 LEU H . . 4.880 4.678 4.558 4.793 . 0 0 "[ . 1 . 2]" 1
219 1 39 ASP HB3 1 40 LEU H . . 4.040 3.314 2.520 3.978 . 0 0 "[ . 1 . 2]" 1
220 1 39 ASP HB2 1 40 LEU H . . 4.040 3.274 2.454 4.057 0.017 5 0 "[ . 1 . 2]" 1
221 1 45 ASP H 1 46 LEU H . . 3.420 3.073 2.524 3.494 0.074 19 0 "[ . 1 . 2]" 1
222 1 44 LYS H 1 46 LEU H . . 4.720 4.706 4.193 5.113 0.393 4 0 "[ . 1 . 2]" 1
223 1 45 ASP HA 1 46 LEU H . . 3.170 2.719 2.454 2.888 . 0 0 "[ . 1 . 2]" 1
224 1 46 LEU H 1 47 GLU HA . . 4.720 5.115 4.991 5.167 0.447 11 0 "[ . 1 . 2]" 1
225 1 45 ASP HB2 1 46 LEU H . . 4.480 4.539 4.280 4.676 0.196 1 0 "[ . 1 . 2]" 1
226 1 44 LYS QB 1 46 LEU H . . 5.670 4.432 4.087 4.851 . 0 0 "[ . 1 . 2]" 1
227 1 46 LEU H 1 46 LEU HB2 . . 3.520 3.644 3.560 3.697 0.177 9 0 "[ . 1 . 2]" 1
228 1 47 GLU H 1 49 LEU H . . 4.540 3.829 3.623 4.180 . 0 0 "[ . 1 . 2]" 1
229 1 46 LEU HA 1 49 LEU H . . 3.640 2.818 2.400 3.284 . 0 0 "[ . 1 . 2]" 1
230 1 49 LEU H 1 50 ASP QB . . 5.730 4.457 4.342 4.577 . 0 0 "[ . 1 . 2]" 1
231 1 48 LYS HB3 1 49 LEU H . . 3.980 3.522 2.516 4.265 0.285 5 0 "[ . 1 . 2]" 1
232 1 48 LYS HB2 1 49 LEU H . . 3.980 3.091 2.402 4.021 0.041 5 0 "[ . 1 . 2]" 1
233 1 51 LEU H 1 53 ILE H . . 4.720 4.348 4.124 4.575 . 0 0 "[ . 1 . 2]" 1
234 1 50 ASP H 1 51 LEU H . . 3.830 2.875 2.747 3.021 . 0 0 "[ . 1 . 2]" 1
235 1 48 LYS HA 1 51 LEU H . . 4.070 3.396 2.745 3.824 . 0 0 "[ . 1 . 2]" 1
236 1 50 ASP QB 1 51 LEU H . . 4.710 2.382 2.215 2.602 . 0 0 "[ . 1 . 2]" 1
237 1 51 LEU H 1 52 VAL HB . . 4.630 4.761 4.525 4.977 0.347 1 0 "[ . 1 . 2]" 1
238 1 51 LEU H 1 51 LEU HB3 . . 3.700 3.588 3.474 3.641 . 0 0 "[ . 1 . 2]" 1
239 1 76 LEU H 1 77 ASP H . . 3.830 2.715 2.568 2.822 . 0 0 "[ . 1 . 2]" 1
240 1 74 PHE H 1 76 LEU H . . 4.970 4.324 4.082 4.584 . 0 0 "[ . 1 . 2]" 1
241 1 81 VAL H 1 83 LEU H . . 4.790 3.931 3.687 4.252 . 0 0 "[ . 1 . 2]" 1
242 1 80 GLN HA 1 83 LEU H . . 4.110 3.347 2.966 3.708 . 0 0 "[ . 1 . 2]" 1
243 1 79 VAL HA 1 83 LEU H . . 4.850 4.201 3.988 4.350 . 0 0 "[ . 1 . 2]" 1
244 1 82 VAL HB 1 83 LEU H . . 3.670 2.938 2.668 4.205 0.535 18 1 "[ . 1 . + 2]" 1
245 1 54 LYS H 1 56 MET H . . 4.720 4.287 3.934 4.650 . 0 0 "[ . 1 . 2]" 1
246 1 56 MET H 1 58 ARG H . . 4.570 4.323 4.093 4.622 0.052 19 0 "[ . 1 . 2]" 1
247 1 53 ILE HA 1 56 MET H . . 4.070 3.680 3.062 3.986 . 0 0 "[ . 1 . 2]" 1
248 1 54 LYS HA 1 56 MET H . . 4.880 4.765 4.284 5.045 0.165 2 0 "[ . 1 . 2]" 1
249 1 55 TYR HB2 1 56 MET H . . 4.110 3.283 2.334 3.668 . 0 0 "[ . 1 . 2]" 1
250 1 56 MET H 1 58 ARG QB . . 6.380 5.135 4.750 5.625 . 0 0 "[ . 1 . 2]" 1
251 1 56 MET H 1 57 LYS QB . . 6.010 4.613 4.215 5.332 . 0 0 "[ . 1 . 2]" 1
252 1 60 MET H 1 61 GLN H . . 4.140 2.591 2.390 2.783 . 0 0 "[ . 1 . 2]" 1
253 1 59 LEU H 1 60 MET H . . 4.010 2.576 2.479 2.755 . 0 0 "[ . 1 . 2]" 1
254 1 60 MET H 1 61 GLN HA . . 5.190 5.250 5.121 5.410 0.220 3 0 "[ . 1 . 2]" 1
255 1 57 LYS HA 1 60 MET H . . 4.820 3.696 3.241 4.124 . 0 0 "[ . 1 . 2]" 1
256 1 60 MET H 1 60 MET HB3 . . 4.040 3.599 3.420 3.664 . 0 0 "[ . 1 . 2]" 1
257 1 58 ARG QB 1 60 MET H . . 6.290 4.760 4.487 5.050 . 0 0 "[ . 1 . 2]" 1
258 1 57 LYS QB 1 60 MET H . . 6.380 5.139 4.788 5.415 . 0 0 "[ . 1 . 2]" 1
259 1 59 LEU HB3 1 60 MET H . . 4.480 3.716 3.464 3.882 . 0 0 "[ . 1 . 2]" 1
260 1 59 LEU HB2 1 60 MET H . . 4.480 2.721 2.399 3.078 . 0 0 "[ . 1 . 2]" 1
261 1 70 MET H 1 71 ALA H . . 3.860 2.486 2.402 2.554 . 0 0 "[ . 1 . 2]" 1
262 1 67 VAL HA 1 70 MET H . . 4.940 3.239 2.736 3.882 . 0 0 "[ . 1 . 2]" 1
263 1 69 ASN QB 1 70 MET H . . 5.670 2.740 2.395 3.077 . 0 0 "[ . 1 . 2]" 1
264 1 8 PHE H 1 9 ASN H . . 5.220 2.746 2.568 2.877 . 0 0 "[ . 1 . 2]" 1
265 1 9 ASN H 1 12 LYS H . . 5.130 4.626 4.448 4.746 . 0 0 "[ . 1 . 2]" 1
266 1 9 ASN H 1 11 VAL H . . 4.420 4.119 3.829 4.338 . 0 0 "[ . 1 . 2]" 1
267 1 9 ASN H 1 10 ASP H . . 3.330 2.533 2.379 2.727 . 0 0 "[ . 1 . 2]" 1
268 1 9 ASN H 1 10 ASP HA . . 4.970 5.188 5.081 5.285 0.315 9 0 "[ . 1 . 2]" 1
269 1 8 PHE HB3 1 9 ASN H . . 3.890 3.166 2.898 3.336 . 0 0 "[ . 1 . 2]" 1
270 1 8 PHE HB2 1 9 ASN H . . 3.890 4.244 4.110 4.351 0.461 12 0 "[ . 1 . 2]" 1
271 1 7 GLU QB 1 9 ASN H . . 4.170 3.052 2.444 3.976 . 0 0 "[ . 1 . 2]" 1
272 1 1 ASN H1 1 36 TYR HA . . 4.820 4.503 3.081 5.129 0.309 5 0 "[ . 1 . 2]" 1
273 1 67 VAL H 1 69 ASN H . . 4.820 4.423 4.126 4.839 0.019 18 0 "[ . 1 . 2]" 1
274 1 66 SER HB3 1 69 ASN H . . 4.760 4.080 2.592 5.036 0.276 6 0 "[ . 1 . 2]" 1
275 1 66 SER HB2 1 69 ASN H . . 4.760 3.614 2.633 5.024 0.264 8 0 "[ . 1 . 2]" 1
276 1 68 TRP HB2 1 69 ASN H . . 4.450 2.892 2.584 3.130 . 0 0 "[ . 1 . 2]" 1
277 1 68 TRP HB3 1 69 ASN H . . 4.450 3.817 3.527 4.025 . 0 0 "[ . 1 . 2]" 1
278 1 76 LEU H 1 78 ASN H . . 4.790 4.469 4.279 4.656 . 0 0 "[ . 1 . 2]" 1
279 1 78 ASN H 1 81 VAL H . . 4.850 4.818 4.675 4.927 0.077 11 0 "[ . 1 . 2]" 1
280 1 77 ASP HB2 1 78 ASN H . . 3.860 3.784 3.668 3.844 . 0 0 "[ . 1 . 2]" 1
281 1 78 ASN H 1 81 VAL HB . . 4.690 5.069 4.946 5.163 0.473 14 0 "[ . 1 . 2]" 1
282 1 31 LEU H 1 32 GLN H . . 3.980 2.500 2.251 2.879 . 0 0 "[ . 1 . 2]" 1
283 1 32 GLN H 1 34 VAL H . . 4.820 4.168 3.791 4.410 . 0 0 "[ . 1 . 2]" 1
284 1 32 GLN H 1 35 LYS H . . 5.040 4.753 4.456 4.885 . 0 0 "[ . 1 . 2]" 1
285 1 30 ILE H 1 32 GLN H . . 5.100 3.882 3.501 4.255 . 0 0 "[ . 1 . 2]" 1
286 1 29 ASP H 1 32 GLN H . . 4.720 4.621 4.292 4.871 0.151 10 0 "[ . 1 . 2]" 1
287 1 60 MET HB3 1 61 GLN H . . 4.230 3.726 3.125 4.063 . 0 0 "[ . 1 . 2]" 1
288 1 61 GLN H 1 62 GLN H . . 4.290 2.409 2.247 2.699 . 0 0 "[ . 1 . 2]" 1
289 1 58 ARG HA 1 62 GLN H . . 5.070 4.227 3.991 4.499 . 0 0 "[ . 1 . 2]" 1
290 1 79 VAL H 1 80 GLN H . . 3.790 2.636 2.553 2.740 . 0 0 "[ . 1 . 2]" 1
291 1 78 ASN H 1 80 GLN H . . 4.480 4.304 4.117 4.415 . 0 0 "[ . 1 . 2]" 1
292 1 80 GLN H 1 82 VAL H . . 5.070 4.317 4.083 4.545 . 0 0 "[ . 1 . 2]" 1
293 1 76 LEU HA 1 80 GLN H . . 4.420 4.054 3.850 4.248 . 0 0 "[ . 1 . 2]" 1
294 1 80 GLN H 1 80 GLN HB3 . . 3.730 3.509 2.670 3.661 . 0 0 "[ . 1 . 2]" 1
295 1 80 GLN H 1 80 GLN HB2 . . 3.730 2.415 2.177 2.511 . 0 0 "[ . 1 . 2]" 1
296 1 80 GLN H 1 83 LEU QB . . 6.380 4.489 4.189 5.214 . 0 0 "[ . 1 . 2]" 1
297 1 83 LEU H 1 84 GLN H . . 3.670 2.573 2.424 2.756 . 0 0 "[ . 1 . 2]" 1
298 1 84 GLN H 1 85 GLN H . . 3.450 2.546 2.405 2.760 . 0 0 "[ . 1 . 2]" 1
299 1 22 ILE H 1 23 SER H . . 4.850 4.447 3.939 4.623 . 0 0 "[ . 1 . 2]" 1
300 1 15 LEU H 1 16 ARG H . . 4.260 2.927 2.729 3.017 . 0 0 "[ . 1 . 2]" 1
301 1 16 ARG H 1 17 GLU H . . 4.140 2.800 2.462 2.987 . 0 0 "[ . 1 . 2]" 1
302 1 13 THR H 1 16 ARG H . . 5.040 4.999 4.805 5.198 0.158 8 0 "[ . 1 . 2]" 1
303 1 14 LEU HA 1 16 ARG H . . 4.690 4.530 4.220 4.969 0.279 15 0 "[ . 1 . 2]" 1
304 1 12 LYS HA 1 16 ARG H . . 4.910 4.000 3.457 4.627 . 0 0 "[ . 1 . 2]" 1
305 1 58 ARG H 1 60 MET H . . 4.880 4.165 3.956 4.488 . 0 0 "[ . 1 . 2]" 1
306 1 56 MET HA 1 58 ARG H . . 5.100 4.636 4.318 4.908 . 0 0 "[ . 1 . 2]" 1
307 1 23 SER H 1 24 ASP H . . 3.950 2.483 1.987 2.691 . 0 0 "[ . 1 . 2]" 1
308 1 22 ILE HB 1 23 SER H . . 4.510 4.159 3.935 4.414 . 0 0 "[ . 1 . 2]" 1
309 1 84 GLN HA 1 89 SER H . . 3.640 2.799 2.180 3.565 . 0 0 "[ . 1 . 2]" 1
310 1 87 TYR HB3 1 89 SER H . . 4.600 2.812 2.204 3.717 . 0 0 "[ . 1 . 2]" 1
311 1 87 TYR HB2 1 89 SER H . . 4.600 3.796 2.400 4.568 . 0 0 "[ . 1 . 2]" 1
312 1 13 THR H 1 15 LEU H . . 4.910 4.473 4.205 4.627 . 0 0 "[ . 1 . 2]" 1
313 1 10 ASP H 1 13 THR H . . 4.790 4.642 4.480 4.845 0.055 8 0 "[ . 1 . 2]" 1
314 1 9 ASN HA 1 13 THR H . . 4.720 4.120 3.732 4.404 . 0 0 "[ . 1 . 2]" 1
315 1 11 VAL HA 1 13 THR H . . 4.630 4.625 4.403 5.040 0.410 8 0 "[ . 1 . 2]" 1
316 1 11 VAL HB 1 13 THR H . . 4.600 4.893 4.698 5.072 0.472 17 0 "[ . 1 . 2]" 1
317 1 20 THR H 1 22 ILE H . . 5.380 4.132 3.711 4.632 . 0 0 "[ . 1 . 2]" 1
318 1 20 THR H 1 21 THR H . . 3.980 2.489 2.318 2.742 . 0 0 "[ . 1 . 2]" 1
319 1 17 GLU HA 1 20 THR H . . 4.970 3.394 2.989 3.803 . 0 0 "[ . 1 . 2]" 1
320 1 17 GLU QB 1 20 THR H . . 6.380 4.890 4.498 5.227 . 0 0 "[ . 1 . 2]" 1
321 1 19 ILE HB 1 20 THR H . . 4.790 2.923 2.590 3.411 . 0 0 "[ . 1 . 2]" 1
322 1 21 THR H 1 22 ILE H . . 3.830 2.349 2.048 2.606 . 0 0 "[ . 1 . 2]" 1
323 1 17 GLU HA 1 21 THR H . . 5.000 3.324 2.460 4.122 . 0 0 "[ . 1 . 2]" 1
324 1 19 ILE HA 1 21 THR H . . 4.690 4.713 4.186 5.154 0.464 17 0 "[ . 1 . 2]" 1
325 1 17 GLU QB 1 21 THR H . . 6.380 4.195 3.422 4.899 . 0 0 "[ . 1 . 2]" 1
326 1 37 CYS H 1 38 THR H . . 3.920 2.814 2.638 2.959 . 0 0 "[ . 1 . 2]" 1
327 1 38 THR H 1 40 LEU H . . 4.820 4.050 3.855 4.267 . 0 0 "[ . 1 . 2]" 1
328 1 36 TYR HA 1 38 THR H . . 4.970 4.664 4.342 4.894 . 0 0 "[ . 1 . 2]" 1
329 1 35 LYS HA 1 38 THR H . . 4.420 3.790 3.340 4.023 . 0 0 "[ . 1 . 2]" 1
330 1 34 VAL HA 1 38 THR H . . 4.790 4.196 3.981 4.487 . 0 0 "[ . 1 . 2]" 1
331 1 37 CYS HB3 1 38 THR H . . 4.420 3.489 3.223 3.822 . 0 0 "[ . 1 . 2]" 1
332 1 36 TYR QB 1 38 THR H . . 6.380 4.838 4.663 4.977 . 0 0 "[ . 1 . 2]" 1
333 1 37 CYS HB2 1 38 THR H . . 4.420 2.574 2.357 2.956 . 0 0 "[ . 1 . 2]" 1
334 1 83 LEU H 1 86 THR H . . 5.310 4.714 4.618 5.036 . 0 0 "[ . 1 . 2]" 1
335 1 86 THR H 1 89 SER H . . 5.190 5.367 4.944 5.710 0.520 11 3 "[ . 1+ .- *2]" 1
336 1 86 THR H 1 87 TYR HB3 . . 5.160 5.387 4.806 6.106 0.946 7 6 "[* * * + 1 *-. 2]" 1
337 1 86 THR H 1 87 TYR HB2 . . 5.160 4.681 4.481 4.786 . 0 0 "[ . 1 . 2]" 1
338 1 85 GLN HB3 1 86 THR H . . 3.890 3.732 3.532 3.980 0.090 10 0 "[ . 1 . 2]" 1
339 1 85 GLN HB2 1 86 THR H . . 3.890 2.797 2.611 3.008 . 0 0 "[ . 1 . 2]" 1
340 1 83 LEU QB 1 86 THR H . . 6.380 5.128 4.833 5.440 . 0 0 "[ . 1 . 2]" 1
341 1 90 THR H 1 91 LEU H . . 4.140 4.352 3.939 4.628 0.488 17 0 "[ . 1 . 2]" 1
342 1 89 SER H 1 90 THR H . . 4.170 4.203 3.795 4.458 0.288 13 0 "[ . 1 . 2]" 1
343 1 84 GLN HA 1 90 THR H . . 4.910 4.577 3.977 5.129 0.219 13 0 "[ . 1 . 2]" 1
344 1 93 VAL H 1 94 THR H . . 3.080 2.792 2.051 3.705 0.625 18 3 "[ . 1 . *+ -]" 1
345 1 30 ILE HA 1 33 VAL H . . 4.570 3.739 3.477 3.995 . 0 0 "[ . 1 . 2]" 1
346 1 93 VAL HB 1 94 THR H . . 3.550 3.141 1.958 4.486 0.936 14 6 "[ * -1 +. ** *]" 1
347 1 11 VAL H 1 12 LYS H . . 3.950 2.830 2.618 2.994 . 0 0 "[ . 1 . 2]" 1
348 1 11 VAL H 1 13 THR H . . 4.690 4.229 3.931 4.650 . 0 0 "[ . 1 . 2]" 1
349 1 8 PHE HA 1 11 VAL H . . 4.070 3.363 2.792 3.786 . 0 0 "[ . 1 . 2]" 1
350 1 9 ASN HA 1 11 VAL H . . 5.040 4.759 4.468 5.086 0.046 9 0 "[ . 1 . 2]" 1
351 1 10 ASP HB3 1 11 VAL H . . 4.260 3.011 2.206 3.813 . 0 0 "[ . 1 . 2]" 1
352 1 10 ASP HB2 1 11 VAL H . . 4.260 3.490 2.324 4.012 . 0 0 "[ . 1 . 2]" 1
353 1 31 LEU H 1 33 VAL H . . 5.070 4.261 4.059 4.501 . 0 0 "[ . 1 . 2]" 1
354 1 33 VAL H 1 35 LYS H . . 4.760 4.163 3.937 4.524 . 0 0 "[ . 1 . 2]" 1
355 1 34 VAL H 1 35 LYS H . . 4.010 2.670 2.501 2.767 . 0 0 "[ . 1 . 2]" 1
356 1 33 VAL H 1 34 VAL H . . 3.890 2.688 2.482 2.852 . 0 0 "[ . 1 . 2]" 1
357 1 33 VAL HB 1 34 VAL H . . 4.110 3.849 3.598 4.289 0.179 15 0 "[ . 1 . 2]" 1
358 1 52 VAL H 1 53 ILE H . . 3.980 2.730 2.553 2.912 . 0 0 "[ . 1 . 2]" 1
359 1 51 LEU H 1 52 VAL H . . 3.860 2.704 2.535 2.898 . 0 0 "[ . 1 . 2]" 1
360 1 50 ASP QB 1 52 VAL H . . 6.040 4.746 4.517 4.991 . 0 0 "[ . 1 . 2]" 1
361 1 52 VAL H 1 53 ILE HB . . 4.790 4.782 4.530 5.041 0.251 3 0 "[ . 1 . 2]" 1
362 1 51 LEU HB3 1 52 VAL H . . 4.110 3.485 3.181 3.799 . 0 0 "[ . 1 . 2]" 1
363 1 51 LEU HB2 1 52 VAL H . . 4.110 2.732 2.326 2.997 . 0 0 "[ . 1 . 2]" 1
364 1 63 SER QB 1 64 VAL H . . 5.390 3.527 2.669 4.055 . 0 0 "[ . 1 . 2]" 1
365 1 5 ALA H 1 6 VAL H . . 4.790 4.322 4.020 4.409 . 0 0 "[ . 1 . 2]" 1
366 1 76 LEU H 1 79 VAL H . . 5.130 4.977 4.866 5.100 . 0 0 "[ . 1 . 2]" 1
367 1 79 VAL H 1 81 VAL H . . 4.600 4.045 3.872 4.252 . 0 0 "[ . 1 . 2]" 1
368 1 78 ASN H 1 79 VAL H . . 3.760 2.795 2.676 2.894 . 0 0 "[ . 1 . 2]" 1
369 1 77 ASP HA 1 79 VAL H . . 5.190 4.703 4.571 4.982 . 0 0 "[ . 1 . 2]" 1
370 1 79 VAL H 1 80 GLN HA . . 5.160 5.278 5.212 5.356 0.196 10 0 "[ . 1 . 2]" 1
371 1 76 LEU HA 1 79 VAL H . . 4.170 3.791 3.477 4.025 . 0 0 "[ . 1 . 2]" 1
372 1 80 GLN H 1 81 VAL H . . 3.610 2.560 2.500 2.650 . 0 0 "[ . 1 . 2]" 1
373 1 77 ASP HA 1 81 VAL H . . 4.720 4.316 4.098 4.496 . 0 0 "[ . 1 . 2]" 1
374 1 79 VAL HA 1 81 VAL H . . 4.790 4.346 4.146 4.532 . 0 0 "[ . 1 . 2]" 1
375 1 80 GLN HB3 1 81 VAL H . . 3.550 3.677 2.603 3.995 0.445 18 0 "[ . 1 . 2]" 1
376 1 82 VAL H 1 83 LEU H . . 3.550 2.618 2.492 2.734 . 0 0 "[ . 1 . 2]" 1
377 1 82 VAL H 1 84 GLN H . . 4.760 4.134 3.883 4.309 . 0 0 "[ . 1 . 2]" 1
378 1 82 VAL H 1 85 GLN H . . 4.940 4.824 4.528 4.977 0.037 11 0 "[ . 1 . 2]" 1
379 1 81 VAL H 1 82 VAL H . . 3.550 2.723 2.615 2.799 . 0 0 "[ . 1 . 2]" 1
380 1 82 VAL H 1 83 LEU HA . . 5.100 5.272 5.166 5.353 0.253 9 0 "[ . 1 . 2]" 1
381 1 82 VAL H 1 83 LEU QB . . 5.510 4.327 4.073 4.533 . 0 0 "[ . 1 . 2]" 1
382 1 17 GLU H 1 18 TRP H . . 3.950 2.545 2.336 2.644 . 0 0 "[ . 1 . 2]" 1
383 1 16 ARG H 1 18 TRP H . . 5.250 3.798 3.614 4.121 . 0 0 "[ . 1 . 2]" 1
384 1 36 TYR H 1 38 THR H . . 4.790 4.388 4.113 4.588 . 0 0 "[ . 1 . 2]" 1
385 1 34 VAL H 1 36 TYR H . . 4.940 4.263 4.115 4.434 . 0 0 "[ . 1 . 2]" 1
386 1 35 LYS H 1 36 TYR H . . 3.890 2.718 2.561 2.826 . 0 0 "[ . 1 . 2]" 1
387 1 36 TYR H 1 37 CYS H . . 3.790 2.694 2.544 2.839 . 0 0 "[ . 1 . 2]" 1
388 1 33 VAL HA 1 36 TYR H . . 4.140 3.478 2.936 3.779 . 0 0 "[ . 1 . 2]" 1
389 1 34 VAL HA 1 36 TYR H . . 4.720 4.628 4.498 4.799 0.079 11 0 "[ . 1 . 2]" 1
390 1 35 LYS HB3 1 36 TYR H . . 4.200 2.699 2.297 3.468 . 0 0 "[ . 1 . 2]" 1
391 1 35 LYS HB2 1 36 TYR H . . 4.200 3.586 2.599 3.969 . 0 0 "[ . 1 . 2]" 1
392 1 52 VAL H 1 55 TYR H . . 5.190 4.835 4.635 5.038 . 0 0 "[ . 1 . 2]" 1
393 1 53 ILE H 1 55 TYR H . . 4.820 4.096 3.748 4.369 . 0 0 "[ . 1 . 2]" 1
394 1 55 TYR H 1 56 MET H . . 3.700 2.504 2.283 2.704 . 0 0 "[ . 1 . 2]" 1
395 1 53 ILE HB 1 55 TYR H . . 4.720 5.093 4.908 5.323 0.603 15 2 "[ - . 1 + 2]" 1
396 1 55 TYR H 1 57 LYS QB . . 5.880 4.844 4.188 5.972 0.092 15 0 "[ . 1 . 2]" 1
397 1 86 THR H 1 87 TYR H . . 3.110 2.497 2.405 2.706 . 0 0 "[ . 1 . 2]" 1
398 1 87 TYR H 1 89 SER H . . 4.290 3.811 3.368 4.001 . 0 0 "[ . 1 . 2]" 1
399 1 83 LEU HA 1 87 TYR H . . 3.580 3.184 2.915 3.597 0.017 13 0 "[ . 1 . 2]" 1
400 1 83 LEU QB 1 87 TYR H . . 6.380 4.862 4.411 5.126 . 0 0 "[ . 1 . 2]" 1
401 1 59 LEU H 1 59 LEU HG . . 4.510 2.645 2.109 3.798 . 0 0 "[ . 1 . 2]" 1
402 1 12 LYS H 1 12 LYS HG2 . . 5.500 4.283 2.583 4.555 . 0 0 "[ . 1 . 2]" 1
403 1 9 ASN HA 1 9 ASN HD22 . . 5.500 4.590 3.897 5.410 . 0 0 "[ . 1 . 2]" 1
404 1 9 ASN H 1 9 ASN HD22 . . 5.500 4.825 3.712 5.898 0.398 12 0 "[ . 1 . 2]" 1
405 1 18 TRP H 1 18 TRP HD1 . . 5.500 4.821 4.637 5.318 . 0 0 "[ . 1 . 2]" 1
406 1 40 LEU H 1 40 LEU HG . . 4.380 3.177 2.126 4.633 0.253 6 0 "[ . 1 . 2]" 1
407 1 44 LYS H 1 44 LYS QD . . 5.500 2.437 2.069 2.743 . 0 0 "[ . 1 . 2]" 1
408 1 32 GLN QE 1 33 VAL H . . 5.500 4.310 1.780 5.554 0.054 2 0 "[ . 1 . 2]" 1
409 1 21 THR H 1 21 THR HG1 . . 5.500 3.218 2.308 4.393 . 0 0 "[ . 1 . 2]" 1
410 1 78 ASN H 1 78 ASN HD22 . . 4.880 3.747 3.488 4.011 . 0 0 "[ . 1 . 2]" 1
411 1 78 ASN H 1 78 ASN HD21 . . 4.880 2.496 1.951 3.674 . 0 0 "[ . 1 . 2]" 1
412 1 15 LEU H 1 15 LEU HG . . 4.420 2.352 2.131 2.617 . 0 0 "[ . 1 . 2]" 1
413 1 26 MET H 1 26 MET HG3 . . 5.500 3.455 2.386 4.510 . 0 0 "[ . 1 . 2]" 1
414 1 26 MET H 1 26 MET HG2 . . 5.500 3.225 1.874 4.500 . 0 0 "[ . 1 . 2]" 1
415 1 20 THR H 1 20 THR HG1 . . 5.440 2.471 1.844 3.444 . 0 0 "[ . 1 . 2]" 1
416 1 1 ASN HA 1 1 ASN HD22 . . 5.500 5.208 4.495 5.449 . 0 0 "[ . 1 . 2]" 1
417 1 61 GLN HA 1 61 GLN HE22 . . 5.500 4.502 3.192 5.932 0.432 7 0 "[ . 1 . 2]" 1
418 1 70 MET H 1 70 MET HG2 . . 5.500 3.317 2.105 3.699 . 0 0 "[ . 1 . 2]" 1
419 1 69 ASN H 1 69 ASN HD22 . . 5.500 4.255 3.396 5.734 0.234 20 0 "[ . 1 . 2]" 1
420 1 37 CYS H 1 37 CYS HG . . 4.230 2.899 2.341 3.343 . 0 0 "[ . 1 . 2]" 1
421 1 1 ASN H1 1 1 ASN HD21 . . 5.500 4.485 2.497 5.295 . 0 0 "[ . 1 . 2]" 1
422 1 9 ASN H 1 9 ASN HD21 . . 5.500 4.211 2.248 4.873 . 0 0 "[ . 1 . 2]" 1
423 1 61 GLN HA 1 61 GLN HE21 . . 5.500 3.688 2.201 4.809 . 0 0 "[ . 1 . 2]" 1
424 1 57 LYS QD 1 58 ARG H . . 6.380 3.012 2.505 4.410 . 0 0 "[ . 1 . 2]" 1
425 1 1 ASN H1 1 1 ASN HD22 . . 5.500 4.531 3.215 5.201 . 0 0 "[ . 1 . 2]" 1
426 1 57 LYS QE 1 59 LEU H . . 6.380 6.043 5.408 6.352 . 0 0 "[ . 1 . 2]" 1
427 1 59 LEU H 1 62 GLN QG . . 6.380 4.857 4.258 6.193 . 0 0 "[ . 1 . 2]" 1
428 1 80 GLN HE22 1 93 VAL H . . 5.500 4.279 2.512 5.541 0.041 18 0 "[ . 1 . 2]" 1
429 1 80 GLN HE21 1 93 VAL H . . 5.500 4.681 3.215 5.981 0.481 11 0 "[ . 1 . 2]" 1
430 1 71 ALA H 1 72 PHE QD . . 7.630 5.938 4.759 6.169 . 0 0 "[ . 1 . 2]" 1
431 1 70 MET HG3 1 71 ALA H . . 5.500 4.177 2.952 5.048 . 0 0 "[ . 1 . 2]" 1
432 1 36 TYR QD 1 37 CYS H . . 7.630 4.014 3.060 4.456 . 0 0 "[ . 1 . 2]" 1
433 1 36 TYR QE 1 37 CYS H . . 7.630 5.934 5.157 6.350 . 0 0 "[ . 1 . 2]" 1
434 1 26 MET HG3 1 29 ASP H . . 5.500 4.848 2.079 6.093 0.593 2 2 "[ +- . 1 . 2]" 1
435 1 26 MET HG2 1 29 ASP H . . 5.500 4.451 2.565 6.230 0.730 2 3 "[ + . 1* - . 2]" 1
436 1 36 TYR QD 1 39 ASP H . . 7.630 5.428 4.900 5.990 . 0 0 "[ . 1 . 2]" 1
437 1 35 LYS QG 1 39 ASP H . . 6.380 5.108 4.265 6.324 . 0 0 "[ . 1 . 2]" 1
438 1 74 PHE QD 1 75 ILE H . . 7.630 3.323 3.051 3.738 . 0 0 "[ . 1 . 2]" 1
439 1 49 LEU HG 1 50 ASP H . . 5.500 3.949 3.069 5.079 . 0 0 "[ . 1 . 2]" 1
440 1 48 LYS QG 1 50 ASP H . . 6.380 5.764 4.668 6.138 . 0 0 "[ . 1 . 2]" 1
441 1 72 PHE QD 1 73 ASP H . . 7.630 3.123 2.677 4.019 . 0 0 "[ . 1 . 2]" 1
442 1 17 GLU H 1 20 THR HG1 . . 5.500 4.453 4.097 5.407 . 0 0 "[ . 1 . 2]" 1
443 1 16 ARG QG 1 17 GLU H . . 6.380 3.655 3.307 4.389 . 0 0 "[ . 1 . 2]" 1
444 1 26 MET HG3 1 27 GLU H . . 5.500 4.563 3.267 5.195 . 0 0 "[ . 1 . 2]" 1
445 1 26 MET HG2 1 27 GLU H . . 5.500 4.462 3.177 5.484 . 0 0 "[ . 1 . 2]" 1
446 1 26 MET HG3 1 28 GLU H . . 5.500 4.486 2.529 6.056 0.556 19 1 "[ . 1 . +2]" 1
447 1 26 MET HG2 1 28 GLU H . . 5.500 4.275 1.994 5.600 0.100 9 0 "[ . 1 . 2]" 1
448 1 46 LEU HG 1 47 GLU H . . 4.540 3.762 3.202 4.078 . 0 0 "[ . 1 . 2]" 1
449 1 47 GLU H 1 48 LYS QG . . 6.380 5.159 3.818 6.223 . 0 0 "[ . 1 . 2]" 1
450 1 65 GLU H 1 69 ASN HD21 . . 5.500 4.775 3.602 6.114 0.614 2 1 "[ + . 1 . 2]" 1
451 1 60 MET HB3 1 72 PHE H . . 5.500 3.884 3.226 5.218 . 0 0 "[ . 1 . 2]" 1
452 1 60 MET HB2 1 72 PHE H . . 5.500 4.930 4.285 6.042 0.542 18 1 "[ . 1 . + 2]" 1
453 1 72 PHE QD 1 74 PHE H . . 7.630 5.368 5.062 5.700 . 0 0 "[ . 1 . 2]" 1
454 1 87 TYR QD 1 88 GLY H . . 7.630 4.605 4.388 4.783 . 0 0 "[ . 1 . 2]" 1
455 1 84 GLN QG 1 88 GLY H . . 6.380 5.125 4.612 5.673 . 0 0 "[ . 1 . 2]" 1
456 1 22 ILE H 1 68 TRP HZ2 . . 5.500 3.697 3.089 4.387 . 0 0 "[ . 1 . 2]" 1
457 1 21 THR HG1 1 22 ILE H . . 5.500 4.524 3.025 5.422 . 0 0 "[ . 1 . 2]" 1
458 1 18 TRP HH2 1 30 ILE H . . 5.500 4.971 4.178 5.670 0.170 18 0 "[ . 1 . 2]" 1
459 1 30 ILE H 1 31 LEU HG . . 5.500 4.986 4.118 6.333 0.833 13 6 "[ . - 1* + * **2]" 1
460 1 8 PHE QD 1 12 LYS H . . 7.630 4.405 3.722 4.973 . 0 0 "[ . 1 . 2]" 1
461 1 35 LYS H 1 35 LYS QE . . 6.380 5.753 4.280 6.092 . 0 0 "[ . 1 . 2]" 1
462 1 48 LYS H 1 48 LYS HE2 . . 5.500 5.013 3.606 5.684 0.184 20 0 "[ . 1 . 2]" 1
463 1 48 LYS H 1 48 LYS HE3 . . 5.500 5.122 3.416 6.112 0.612 18 3 "[ * . 1 . + -]" 1
464 1 54 LYS H 1 55 TYR QD . . 7.630 5.795 4.257 6.214 . 0 0 "[ . 1 . 2]" 1
465 1 54 LYS H 1 54 LYS HG3 . . 4.540 2.831 2.439 4.551 0.011 20 0 "[ . 1 . 2]" 1
466 1 56 MET QG 1 57 LYS H . . 6.380 3.143 2.152 3.852 . 0 0 "[ . 1 . 2]" 1
467 1 15 LEU H 1 55 TYR QD . . 7.630 5.049 4.469 5.760 . 0 0 "[ . 1 . 2]" 1
468 1 2 LEU H 1 36 TYR QD . . 7.630 4.561 3.038 5.411 . 0 0 "[ . 1 . 2]" 1
469 1 2 LEU H 1 36 TYR QE . . 7.630 4.808 3.433 5.758 . 0 0 "[ . 1 . 2]" 1
470 1 36 TYR QD 1 40 LEU H . . 7.630 5.567 4.747 6.048 . 0 0 "[ . 1 . 2]" 1
471 1 48 LYS QG 1 49 LEU H . . 6.380 3.980 2.423 4.746 . 0 0 "[ . 1 . 2]" 1
472 1 8 PHE QE 1 51 LEU H . . 7.630 5.300 4.704 5.851 . 0 0 "[ . 1 . 2]" 1
473 1 72 PHE QD 1 76 LEU H . . 7.630 4.885 3.732 5.593 . 0 0 "[ . 1 . 2]" 1
474 1 74 PHE QD 1 76 LEU H . . 7.630 5.567 5.292 5.894 . 0 0 "[ . 1 . 2]" 1
475 1 80 GLN HE21 1 91 LEU H . . 5.500 3.933 2.996 4.815 . 0 0 "[ . 1 . 2]" 1
476 1 55 TYR QD 1 56 MET H . . 7.630 4.017 3.435 4.637 . 0 0 "[ . 1 . 2]" 1
477 1 15 LEU HG 1 56 MET H . . 5.500 5.885 5.593 6.237 0.737 11 8 "[ * ** 1+*- . * *]" 1
478 1 56 MET QG 1 60 MET H . . 6.380 4.868 4.456 5.675 . 0 0 "[ . 1 . 2]" 1
479 1 59 LEU HG 1 60 MET H . . 5.500 4.551 4.137 5.218 . 0 0 "[ . 1 . 2]" 1
480 1 1 ASN H1 1 36 TYR QD . . 7.630 3.664 1.953 4.748 . 0 0 "[ . 1 . 2]" 1
481 1 1 ASN H1 1 36 TYR QE . . 7.630 4.532 2.293 5.914 . 0 0 "[ . 1 . 2]" 1
482 1 1 ASN H1 1 36 TYR QB . . 6.380 4.406 2.666 5.499 . 0 0 "[ . 1 . 2]" 1
483 1 65 GLU H 1 69 ASN HD22 . . 5.500 4.432 3.290 6.032 0.532 19 2 "[ . - 1 . +2]" 1
484 1 64 VAL H 1 69 ASN HD22 . . 5.500 4.519 2.823 6.055 0.555 7 2 "[ . + 1 . - 2]" 1
485 1 65 GLU HA 1 69 ASN HD22 . . 5.440 4.015 2.901 6.050 0.610 19 1 "[ . 1 . +2]" 1
486 1 63 SER QB 1 69 ASN HD22 . . 6.380 3.690 2.459 6.109 . 0 0 "[ . 1 . 2]" 1
487 1 65 GLU HA 1 69 ASN HD21 . . 5.440 4.020 2.090 5.585 0.145 6 0 "[ . 1 . 2]" 1
488 1 63 SER QB 1 69 ASN HD21 . . 6.380 3.902 2.979 6.051 . 0 0 "[ . 1 . 2]" 1
489 1 64 VAL H 1 69 ASN HD21 . . 5.500 5.292 3.450 6.081 0.581 14 3 "[ * . - +. 2]" 1
490 1 69 ASN H 1 69 ASN HD21 . . 5.500 3.076 1.771 4.554 . 0 0 "[ . 1 . 2]" 1
491 1 63 SER QB 1 69 ASN H . . 6.380 4.572 3.606 5.859 . 0 0 "[ . 1 . 2]" 1
492 1 61 GLN HE21 1 72 PHE QD . . 7.630 4.695 3.536 6.091 . 0 0 "[ . 1 . 2]" 1
493 1 61 GLN HE22 1 72 PHE QD . . 7.630 4.763 3.759 6.068 . 0 0 "[ . 1 . 2]" 1
494 1 59 LEU HA 1 62 GLN HE21 . . 5.500 2.387 1.740 3.598 . 0 0 "[ . 1 . 2]" 1
495 1 59 LEU HA 1 62 GLN HE22 . . 5.500 3.338 3.029 3.574 . 0 0 "[ . 1 . 2]" 1
496 1 59 LEU HG 1 62 GLN HE22 . . 5.500 4.253 2.501 5.224 . 0 0 "[ . 1 . 2]" 1
497 1 80 GLN HE22 1 91 LEU H . . 5.500 4.702 2.805 6.042 0.542 19 1 "[ . 1 . +2]" 1
498 1 80 GLN HB3 1 80 GLN HE22 . . 5.500 4.512 3.845 5.414 . 0 0 "[ . 1 . 2]" 1
499 1 80 GLN HB2 1 80 GLN HE22 . . 5.500 4.719 4.282 5.381 . 0 0 "[ . 1 . 2]" 1
500 1 59 LEU HG 1 62 GLN HE21 . . 5.500 4.152 2.036 5.263 . 0 0 "[ . 1 . 2]" 1
501 1 82 VAL HA 1 85 GLN HE21 . . 5.500 2.935 1.799 4.764 . 0 0 "[ . 1 . 2]" 1
502 1 82 VAL HA 1 85 GLN HE22 . . 5.500 3.768 2.872 5.138 . 0 0 "[ . 1 . 2]" 1
503 1 16 ARG H 1 55 TYR QD . . 7.630 4.385 3.578 5.120 . 0 0 "[ . 1 . 2]" 1
504 1 16 ARG H 1 55 TYR QE . . 7.630 3.774 2.519 5.510 . 0 0 "[ . 1 . 2]" 1
505 1 57 LYS QE 1 58 ARG H . . 6.380 4.406 3.082 5.142 . 0 0 "[ . 1 . 2]" 1
506 1 58 ARG H 1 59 LEU HG . . 5.500 4.805 4.117 6.163 0.663 15 5 "[ * *- 1* + 2]" 1
507 1 87 TYR QD 1 89 SER H . . 7.630 3.855 2.903 5.141 . 0 0 "[ . 1 . 2]" 1
508 1 13 THR H 1 15 LEU HG . . 5.500 5.780 5.349 6.043 0.543 19 4 "[ * * 1- . +2]" 1
509 1 12 LYS HG3 1 13 THR H . . 5.500 4.653 2.748 5.025 . 0 0 "[ . 1 . 2]" 1
510 1 12 LYS HG2 1 13 THR H . . 5.500 3.796 2.335 5.165 . 0 0 "[ . 1 . 2]" 1
511 1 20 THR HG1 1 21 THR H . . 5.500 3.370 2.760 4.444 . 0 0 "[ . 1 . 2]" 1
512 1 37 CYS HG 1 38 THR H . . 5.500 4.879 4.700 5.119 . 0 0 "[ . 1 . 2]" 1
513 1 35 LYS QG 1 38 THR H . . 6.380 5.662 4.835 6.021 . 0 0 "[ . 1 . 2]" 1
514 1 86 THR H 1 87 TYR QD . . 7.630 5.670 4.353 6.187 . 0 0 "[ . 1 . 2]" 1
515 1 85 GLN HG3 1 86 THR H . . 5.500 4.478 4.378 4.636 . 0 0 "[ . 1 . 2]" 1
516 1 85 GLN HG2 1 86 THR H . . 5.500 5.139 5.065 5.240 . 0 0 "[ . 1 . 2]" 1
517 1 32 GLN HG2 1 33 VAL H . . 5.500 3.794 2.542 4.870 . 0 0 "[ . 1 . 2]" 1
518 1 32 GLN HG3 1 33 VAL H . . 5.500 3.129 2.023 4.905 . 0 0 "[ . 1 . 2]" 1
519 1 8 PHE QD 1 52 VAL H . . 7.630 4.657 3.989 5.051 . 0 0 "[ . 1 . 2]" 1
520 1 6 VAL H 1 7 GLU HG3 . . 5.500 5.092 3.007 6.159 0.659 11 3 "[ . - 1+ . * 2]" 1
521 1 6 VAL H 1 7 GLU HG2 . . 5.500 4.205 2.647 5.667 0.167 17 0 "[ . 1 . 2]" 1
522 1 38 THR HB 1 82 VAL H . . 5.500 5.963 5.692 6.105 0.605 18 9 "[ ** .** ** - . + *]" 1
523 1 17 GLU QG 1 18 TRP H . . 4.120 2.964 2.163 4.208 0.088 19 0 "[ . 1 . 2]" 1
524 1 18 TRP HE1 1 68 TRP HZ2 . . 5.500 5.384 4.713 6.051 0.551 5 1 "[ + 1 . 2]" 1
525 1 18 TRP HE1 1 25 PRO HA . . 5.500 3.960 2.652 4.866 . 0 0 "[ . 1 . 2]" 1
526 1 23 SER HA 1 68 TRP HE1 . . 4.790 3.460 2.447 4.404 . 0 0 "[ . 1 . 2]" 1
527 1 19 ILE HA 1 68 TRP HE1 . . 5.500 4.153 3.314 5.070 . 0 0 "[ . 1 . 2]" 1
528 1 36 TYR H 1 37 CYS HG . . 5.500 4.867 4.331 5.287 . 0 0 "[ . 1 . 2]" 1
529 1 35 LYS QG 1 36 TYR H . . 6.380 4.030 3.421 4.601 . 0 0 "[ . 1 . 2]" 1
530 1 8 PHE QE 1 55 TYR H . . 7.630 4.968 4.274 5.764 . 0 0 "[ . 1 . 2]" 1
531 1 55 TYR H 1 56 MET QG . . 6.380 5.320 3.774 6.087 . 0 0 "[ . 1 . 2]" 1
532 1 11 VAL MG2 1 12 LYS H . . 6.520 3.722 3.442 3.970 . 0 0 "[ . 1 . 2]" 1
533 1 51 LEU H 1 51 LEU MD1 . . 5.430 3.007 1.921 3.991 . 0 0 "[ . 1 . 2]" 1
534 1 40 LEU H 1 40 LEU MD2 . . 5.680 3.698 3.119 4.338 . 0 0 "[ . 1 . 2]" 1
535 1 34 VAL MG1 1 79 VAL H . . 6.520 4.148 3.355 4.605 . 0 0 "[ . 1 . 2]" 1
536 1 41 ILE MD 1 83 LEU H . . 5.000 2.667 2.480 2.929 . 0 0 "[ . 1 . 2]" 1
537 1 30 ILE MG 1 31 LEU H . . 5.870 3.617 3.346 3.822 . 0 0 "[ . 1 . 2]" 1
538 1 75 ILE MG 1 76 LEU H . . 4.840 3.390 3.196 3.596 . 0 0 "[ . 1 . 2]" 1
539 1 53 ILE H 1 53 ILE MD . . 5.750 3.506 2.540 3.768 . 0 0 "[ . 1 . 2]" 1
540 1 19 ILE MG 1 59 LEU H . . 6.520 4.352 4.087 4.806 . 0 0 "[ . 1 . 2]" 1
541 1 85 GLN H 1 90 THR MG . . 6.520 5.371 4.715 6.229 . 0 0 "[ . 1 . 2]" 1
542 1 85 GLN H 1 86 THR MG . . 6.520 5.664 3.955 5.902 . 0 0 "[ . 1 . 2]" 1
543 1 93 VAL H 1 94 THR MG . . 6.520 5.172 3.386 6.086 . 0 0 "[ . 1 . 2]" 1
544 1 3 ALA MB 1 5 ALA H . . 6.080 3.851 3.208 4.744 . 0 0 "[ . 1 . 2]" 1
545 1 37 CYS H 1 38 THR MG . . 6.520 4.350 4.179 4.494 . 0 0 "[ . 1 . 2]" 1
546 1 22 ILE MG 1 24 ASP H . . 5.590 2.486 1.770 3.036 . 0 0 "[ . 1 . 2]" 1
547 1 26 MET ME 1 29 ASP H . . 6.180 4.470 2.307 5.712 . 0 0 "[ . 1 . 2]" 1
548 1 38 THR MG 1 39 ASP H . . 6.050 3.969 3.868 4.082 . 0 0 "[ . 1 . 2]" 1
549 1 39 ASP H 1 82 VAL MG2 . . 6.520 5.977 5.715 6.110 . 0 0 "[ . 1 . 2]" 1
550 1 39 ASP H 1 82 VAL MG1 . . 6.520 5.162 4.845 5.414 . 0 0 "[ . 1 . 2]" 1
551 1 39 ASP H 1 41 ILE MD . . 6.520 4.942 4.765 5.142 . 0 0 "[ . 1 . 2]" 1
552 1 39 ASP H 1 40 LEU MD2 . . 6.520 5.573 5.121 6.169 . 0 0 "[ . 1 . 2]" 1
553 1 39 ASP H 1 40 LEU MD1 . . 6.520 5.274 4.135 5.940 . 0 0 "[ . 1 . 2]" 1
554 1 49 LEU MD1 1 50 ASP H . . 6.520 4.216 3.090 4.590 . 0 0 "[ . 1 . 2]" 1
555 1 49 LEU MD2 1 50 ASP H . . 6.520 4.153 3.422 4.534 . 0 0 "[ . 1 . 2]" 1
556 1 71 ALA MB 1 73 ASP H . . 6.520 4.674 4.480 4.932 . 0 0 "[ . 1 . 2]" 1
557 1 13 THR MG 1 17 GLU H . . 6.520 4.863 4.117 5.754 . 0 0 "[ . 1 . 2]" 1
558 1 17 GLU H 1 19 ILE MD . . 6.520 6.036 5.905 6.133 . 0 0 "[ . 1 . 2]" 1
559 1 27 GLU H 1 30 ILE MD . . 6.520 4.630 3.731 5.949 . 0 0 "[ . 1 . 2]" 1
560 1 71 ALA MB 1 72 PHE H . . 5.340 2.580 2.364 2.779 . 0 0 "[ . 1 . 2]" 1
561 1 71 ALA MB 1 74 PHE H . . 6.520 4.588 4.431 4.742 . 0 0 "[ . 1 . 2]" 1
562 1 74 PHE H 1 75 ILE MD . . 6.520 5.182 4.966 5.404 . 0 0 "[ . 1 . 2]" 1
563 1 3 ALA MB 1 4 GLY H . . 5.740 3.588 2.402 3.766 . 0 0 "[ . 1 . 2]" 1
564 1 4 GLY H 1 5 ALA MB . . 6.520 4.529 3.645 5.043 . 0 0 "[ . 1 . 2]" 1
565 1 41 ILE MG 1 88 GLY H . . 6.520 5.277 4.693 5.798 . 0 0 "[ . 1 . 2]" 1
566 1 86 THR MG 1 88 GLY H . . 6.520 4.924 4.077 5.229 . 0 0 "[ . 1 . 2]" 1
567 1 21 THR MG 1 22 ILE H . . 6.520 3.299 2.558 3.937 . 0 0 "[ . 1 . 2]" 1
568 1 53 ILE H 1 56 MET ME . . 5.900 4.366 3.915 4.977 . 0 0 "[ . 1 . 2]" 1
569 1 11 VAL MG1 1 12 LYS H . . 6.520 3.341 3.115 3.643 . 0 0 "[ . 1 . 2]" 1
570 1 34 VAL MG2 1 35 LYS H . . 6.270 3.947 3.846 4.081 . 0 0 "[ . 1 . 2]" 1
571 1 34 VAL MG1 1 35 LYS H . . 6.270 3.400 3.192 3.642 . 0 0 "[ . 1 . 2]" 1
572 1 41 ILE MG 1 44 LYS H . . 6.520 4.718 4.510 5.128 . 0 0 "[ . 1 . 2]" 1
573 1 54 LYS H 1 56 MET ME . . 6.520 5.568 4.926 6.072 . 0 0 "[ . 1 . 2]" 1
574 1 53 ILE MD 1 54 LYS H . . 6.460 4.787 4.404 4.885 . 0 0 "[ . 1 . 2]" 1
575 1 56 MET ME 1 57 LYS H . . 6.520 4.743 3.709 5.047 . 0 0 "[ . 1 . 2]" 1
576 1 53 ILE MG 1 57 LYS H . . 6.520 4.006 3.366 4.262 . 0 0 "[ . 1 . 2]" 1
577 1 57 LYS H 1 76 LEU MD2 . . 6.520 5.181 3.965 6.193 . 0 0 "[ . 1 . 2]" 1
578 1 57 LYS H 1 76 LEU MD1 . . 6.520 5.470 3.652 6.044 . 0 0 "[ . 1 . 2]" 1
579 1 13 THR MG 1 14 LEU H . . 5.400 3.523 3.048 3.974 . 0 0 "[ . 1 . 2]" 1
580 1 13 THR MG 1 15 LEU H . . 6.520 5.480 5.126 5.808 . 0 0 "[ . 1 . 2]" 1
581 1 15 LEU H 1 19 ILE MD . . 6.520 5.596 5.143 5.972 . 0 0 "[ . 1 . 2]" 1
582 1 30 ILE MD 1 31 LEU H . . 6.520 4.701 4.382 4.831 . 0 0 "[ . 1 . 2]" 1
583 1 40 LEU H 1 41 ILE MD . . 6.520 4.931 4.693 5.219 . 0 0 "[ . 1 . 2]" 1
584 1 41 ILE MG 1 46 LEU H . . 6.520 5.957 5.529 6.155 . 0 0 "[ . 1 . 2]" 1
585 1 38 THR MG 1 83 LEU H . . 6.520 4.944 4.642 5.242 . 0 0 "[ . 1 . 2]" 1
586 1 83 LEU H 1 86 THR MG . . 6.520 6.023 4.220 6.251 . 0 0 "[ . 1 . 2]" 1
587 1 22 ILE MG 1 26 MET H . . 6.520 3.539 2.808 4.164 . 0 0 "[ . 1 . 2]" 1
588 1 15 LEU QD 1 56 MET H . . 6.520 2.799 2.479 3.124 . 0 0 "[ . 1 . 2]" 1
589 1 19 ILE MD 1 56 MET H . . 6.520 4.356 3.783 4.687 . 0 0 "[ . 1 . 2]" 1
590 1 69 ASN H 1 71 ALA MB . . 6.520 4.608 4.341 4.982 . 0 0 "[ . 1 . 2]" 1
591 1 3 ALA MB 1 32 GLN QE . . 6.520 3.763 1.895 5.292 . 0 0 "[ . 1 . 2]" 1
592 1 38 THR MG 1 80 GLN H . . 6.520 5.478 5.066 5.974 . 0 0 "[ . 1 . 2]" 1
593 1 79 VAL MG2 1 80 GLN H . . 5.810 3.501 2.250 3.884 . 0 0 "[ . 1 . 2]" 1
594 1 84 GLN H 1 90 THR MG . . 6.520 3.517 2.883 4.312 . 0 0 "[ . 1 . 2]" 1
595 1 53 ILE MG 1 58 ARG H . . 6.520 5.682 5.187 5.877 . 0 0 "[ . 1 . 2]" 1
596 1 19 ILE MD 1 58 ARG H . . 6.520 5.159 4.617 5.623 . 0 0 "[ . 1 . 2]" 1
597 1 22 ILE MD 1 23 SER H . . 6.330 4.330 3.946 5.273 . 0 0 "[ . 1 . 2]" 1
598 1 89 SER H 1 90 THR MG . . 6.520 4.795 4.007 6.076 . 0 0 "[ . 1 . 2]" 1
599 1 20 THR H 1 21 THR MG . . 6.520 5.375 3.956 5.854 . 0 0 "[ . 1 . 2]" 1
600 1 19 ILE MG 1 20 THR H . . 6.520 3.591 3.185 4.058 . 0 0 "[ . 1 . 2]" 1
601 1 20 THR MG 1 21 THR H . . 6.520 4.093 3.797 4.378 . 0 0 "[ . 1 . 2]" 1
602 1 21 THR H 1 22 ILE MD . . 6.520 4.426 3.886 5.207 . 0 0 "[ . 1 . 2]" 1
603 1 38 THR H 1 41 ILE MD . . 6.490 4.174 3.948 4.383 . 0 0 "[ . 1 . 2]" 1
604 1 41 ILE MG 1 86 THR H . . 6.520 3.965 3.731 4.489 . 0 0 "[ . 1 . 2]" 1
605 1 5 ALA MB 1 11 VAL H . . 6.180 4.466 3.441 5.283 . 0 0 "[ . 1 . 2]" 1
606 1 11 VAL H 1 14 LEU QD . . 6.520 4.010 3.438 4.513 . 0 0 "[ . 1 . 2]" 1
607 1 51 LEU MD1 1 52 VAL H . . 6.520 4.440 3.956 4.837 . 0 0 "[ . 1 . 2]" 1
608 1 34 VAL MG2 1 79 VAL H . . 6.520 4.779 4.255 5.352 . 0 0 "[ . 1 . 2]" 1
609 1 81 VAL H 1 90 THR MG . . 6.520 4.736 4.274 5.464 . 0 0 "[ . 1 . 2]" 1
610 1 38 THR MG 1 82 VAL H . . 6.520 4.074 3.864 4.325 . 0 0 "[ . 1 . 2]" 1
611 1 18 TRP H 1 19 ILE MD . . 6.520 5.213 4.862 5.551 . 0 0 "[ . 1 . 2]" 1
612 1 18 TRP HE1 1 22 ILE MG . . 6.520 4.206 3.137 4.906 . 0 0 "[ . 1 . 2]" 1
613 1 15 LEU QD 1 55 TYR H . . 6.520 3.985 3.497 4.273 . 0 0 "[ . 1 . 2]" 1
614 1 53 ILE MD 1 55 TYR H . . 6.520 5.763 5.378 6.337 . 0 0 "[ . 1 . 2]" 1
615 1 86 THR MG 1 87 TYR H . . 5.840 3.213 2.099 3.820 . 0 0 "[ . 1 . 2]" 1
616 1 41 ILE MG 1 87 TYR H . . 6.520 3.502 2.934 4.352 . 0 0 "[ . 1 . 2]" 1
617 1 1 ASN H1 1 6 VAL QG . . 6.420 4.286 3.031 5.865 . 0 0 "[ . 1 . 2]" 1
618 1 1 ASN H1 1 40 LEU QD . . 6.420 4.408 2.354 5.921 . 0 0 "[ . 1 . 2]" 1
619 1 1 ASN QB 1 4 GLY H . . 4.080 3.362 2.960 3.834 . 0 0 "[ . 1 . 2]" 1
620 1 1 ASN QB 1 5 ALA H . . 4.130 2.999 2.285 3.410 . 0 0 "[ . 1 . 2]" 1
621 1 1 ASN QD 1 4 GLY H . . 5.340 3.361 1.917 5.347 0.007 19 0 "[ . 1 . 2]" 1
622 1 1 ASN QD 1 4 GLY QA . . 4.530 2.887 1.805 4.491 . 0 0 "[ . 1 . 2]" 1
623 1 1 ASN QD 1 6 VAL QG . . 5.720 4.074 2.497 6.088 0.368 5 0 "[ . 1 . 2]" 1
624 1 2 LEU H 1 2 LEU QB . . 3.430 2.590 2.192 3.181 . 0 0 "[ . 1 . 2]" 1
625 1 2 LEU QD 1 5 ALA H . . 6.420 4.556 3.114 5.271 . 0 0 "[ . 1 . 2]" 1
626 1 2 LEU QD 1 11 VAL H . . 6.420 4.591 3.352 5.582 . 0 0 "[ . 1 . 2]" 1
627 1 2 LEU QD 1 14 LEU H . . 6.420 5.483 4.594 6.372 . 0 0 "[ . 1 . 2]" 1
628 1 2 LEU QD 1 15 LEU H . . 6.420 4.899 3.611 5.611 . 0 0 "[ . 1 . 2]" 1
629 1 2 LEU QD 1 36 TYR H . . 6.420 4.480 3.991 4.836 . 0 0 "[ . 1 . 2]" 1
630 1 2 LEU QD 1 37 CYS H . . 6.420 4.514 3.694 5.151 . 0 0 "[ . 1 . 2]" 1
631 1 3 ALA HA 1 32 GLN QE . . 5.340 4.040 1.842 6.015 0.675 18 1 "[ . 1 . + 2]" 1
632 1 5 ALA H 1 6 VAL QG . . 6.210 4.634 4.060 5.329 . 0 0 "[ . 1 . 2]" 1
633 1 5 ALA H 1 11 VAL QG . . 6.420 4.830 3.351 5.497 . 0 0 "[ . 1 . 2]" 1
634 1 6 VAL H 1 7 GLU QB . . 5.000 4.142 3.382 4.684 . 0 0 "[ . 1 . 2]" 1
635 1 6 VAL H 1 10 ASP QB . . 5.080 5.172 4.504 5.607 0.527 6 2 "[ .+ 1 . - 2]" 1
636 1 6 VAL H 1 11 VAL QG . . 6.420 4.874 3.913 5.414 . 0 0 "[ . 1 . 2]" 1
637 1 7 GLU QB 1 11 VAL H . . 4.730 4.023 3.820 4.365 . 0 0 "[ . 1 . 2]" 1
638 1 7 GLU QG 1 10 ASP H . . 5.340 4.463 3.943 4.953 . 0 0 "[ . 1 . 2]" 1
639 1 8 PHE QB 1 9 ASN H . . 3.410 3.082 2.842 3.227 . 0 0 "[ . 1 . 2]" 1
640 1 8 PHE QB 1 10 ASP H . . 4.620 5.015 4.843 5.149 0.529 15 3 "[ .- *1 + 2]" 1
641 1 9 ASN H 1 12 LYS QB . . 4.790 4.638 4.390 5.182 0.392 18 0 "[ . 1 . 2]" 1
642 1 9 ASN QB 1 10 ASP H . . 3.260 2.680 2.412 3.557 0.297 2 0 "[ . 1 . 2]" 1
643 1 9 ASN QB 1 13 THR H . . 4.760 4.983 4.627 5.257 0.497 13 0 "[ . 1 . 2]" 1
644 1 10 ASP H 1 10 ASP QB . . 3.390 2.316 2.198 2.684 . 0 0 "[ . 1 . 2]" 1
645 1 10 ASP H 1 14 LEU QD . . 6.420 5.535 5.110 5.979 . 0 0 "[ . 1 . 2]" 1
646 1 10 ASP QB 1 11 VAL H . . 3.720 2.689 2.188 3.386 . 0 0 "[ . 1 . 2]" 1
647 1 10 ASP QB 1 12 LYS H . . 4.970 4.854 4.550 5.203 0.233 18 0 "[ . 1 . 2]" 1
648 1 11 VAL QG 1 14 LEU H . . 6.420 4.612 4.343 4.903 . 0 0 "[ . 1 . 2]" 1
649 1 12 LYS H 1 12 LYS QG . . 4.700 3.845 2.540 4.090 . 0 0 "[ . 1 . 2]" 1
650 1 12 LYS H 1 12 LYS QE . . 5.340 4.103 3.658 5.340 0.000 20 0 "[ . 1 . 2]" 1
651 1 12 LYS H 1 52 VAL QG . . 6.420 5.184 4.479 5.571 . 0 0 "[ . 1 . 2]" 1
652 1 12 LYS QB 1 13 THR H . . 3.170 2.625 2.275 3.476 0.306 9 0 "[ . 1 . 2]" 1
653 1 12 LYS QD 1 13 THR H . . 5.340 4.609 3.014 5.627 0.287 18 0 "[ . 1 . 2]" 1
654 1 12 LYS QE 1 13 THR H . . 5.340 3.786 2.667 5.048 . 0 0 "[ . 1 . 2]" 1
655 1 14 LEU H 1 15 LEU QB . . 4.910 4.708 4.456 4.991 0.081 10 0 "[ . 1 . 2]" 1
656 1 14 LEU QB 1 15 LEU H . . 4.030 2.252 2.054 3.485 . 0 0 "[ . 1 . 2]" 1
657 1 14 LEU QD 1 15 LEU H . . 5.550 3.640 1.833 3.974 . 0 0 "[ . 1 . 2]" 1
658 1 14 LEU QD 1 17 GLU H . . 6.420 5.812 5.321 6.315 . 0 0 "[ . 1 . 2]" 1
659 1 14 LEU QD 1 18 TRP H . . 6.420 5.404 4.999 5.755 . 0 0 "[ . 1 . 2]" 1
660 1 15 LEU H 1 15 LEU QB . . 3.530 2.507 2.365 2.603 . 0 0 "[ . 1 . 2]" 1
661 1 15 LEU H 1 16 ARG QB . . 4.470 4.696 4.437 4.894 0.424 9 0 "[ . 1 . 2]" 1
662 1 15 LEU QD 1 18 TRP H . . 6.420 5.229 4.908 5.611 . 0 0 "[ . 1 . 2]" 1
663 1 16 ARG H 1 16 ARG QB . . 3.420 2.263 2.154 2.317 . 0 0 "[ . 1 . 2]" 1
664 1 16 ARG H 1 16 ARG QD . . 5.340 4.111 2.368 4.629 . 0 0 "[ . 1 . 2]" 1
665 1 16 ARG H 1 17 GLU QG . . 5.340 4.668 4.013 6.113 0.773 5 3 "[ + 1 . -*2]" 1
666 1 16 ARG H 1 59 LEU QD . . 6.420 3.917 3.558 4.570 . 0 0 "[ . 1 . 2]" 1
667 1 17 GLU H 1 18 TRP QB . . 5.000 4.196 3.947 4.330 . 0 0 "[ . 1 . 2]" 1
668 1 18 TRP H 1 18 TRP QB . . 3.670 2.174 2.062 2.238 . 0 0 "[ . 1 . 2]" 1
669 1 18 TRP HE1 1 22 ILE QG . . 5.340 4.268 3.601 5.843 0.503 10 1 "[ . + . 2]" 1
670 1 19 ILE MG 1 62 GLN QE . . 6.290 4.825 3.390 6.024 . 0 0 "[ . 1 . 2]" 1
671 1 20 THR H 1 59 LEU QD . . 6.420 4.091 3.533 4.712 . 0 0 "[ . 1 . 2]" 1
672 1 21 THR H 1 22 ILE QG . . 5.340 3.842 3.459 5.752 0.412 17 0 "[ . 1 . 2]" 1
673 1 22 ILE QG 1 23 SER H . . 5.340 4.749 4.014 4.991 . 0 0 "[ . 1 . 2]" 1
674 1 23 SER H 1 23 SER QB . . 3.500 2.494 2.189 2.713 . 0 0 "[ . 1 . 2]" 1
675 1 23 SER H 1 24 ASP QB . . 4.620 4.692 4.134 5.159 0.539 20 1 "[ . 1 . +]" 1
676 1 23 SER QB 1 68 TRP HE1 . . 5.340 5.270 4.496 5.948 0.608 2 2 "[ + . 1 . - 2]" 1
677 1 26 MET QB 1 29 ASP H . . 4.410 3.818 2.616 5.048 0.638 14 1 "[ . 1 +. 2]" 1
678 1 27 GLU H 1 27 GLU QB . . 3.200 2.291 2.215 2.578 . 0 0 "[ . 1 . 2]" 1
679 1 28 GLU H 1 28 GLU QB . . 3.230 2.495 2.263 2.843 . 0 0 "[ . 1 . 2]" 1
680 1 28 GLU H 1 31 LEU QD . . 6.420 4.354 3.822 5.058 . 0 0 "[ . 1 . 2]" 1
681 1 28 GLU QB 1 29 ASP H . . 4.120 2.652 2.289 3.758 . 0 0 "[ . 1 . 2]" 1
682 1 29 ASP H 1 30 ILE QG . . 5.340 3.927 3.690 4.292 . 0 0 "[ . 1 . 2]" 1
683 1 29 ASP QB 1 31 LEU H . . 5.000 5.029 4.662 5.227 0.227 2 0 "[ . 1 . 2]" 1
684 1 29 ASP QB 1 32 GLN H . . 5.110 4.712 4.343 5.198 0.088 15 0 "[ . 1 . 2]" 1
685 1 29 ASP QB 1 32 GLN QE . . 5.180 4.575 2.558 6.256 1.076 13 6 "[ * . 1**+ .- *]" 1
686 1 30 ILE H 1 32 GLN QG . . 5.340 4.967 3.988 6.111 0.771 14 7 "[ * . 1*-*+.* *]" 1
687 1 30 ILE H 1 33 VAL QG . . 6.420 4.120 3.985 4.375 . 0 0 "[ . 1 . 2]" 1
688 1 31 LEU H 1 31 LEU QB . . 3.170 2.421 2.111 2.826 . 0 0 "[ . 1 . 2]" 1
689 1 31 LEU H 1 32 GLN QG . . 5.340 4.860 3.800 6.094 0.754 11 6 "[ - . 1+** .* *]" 1
690 1 31 LEU QB 1 32 GLN H . . 4.320 2.933 2.544 3.754 . 0 0 "[ . 1 . 2]" 1
691 1 31 LEU QD 1 32 GLN H . . 6.420 3.668 2.313 4.245 . 0 0 "[ . 1 . 2]" 1
692 1 31 LEU QD 1 35 LYS H . . 6.420 4.491 3.106 5.323 . 0 0 "[ . 1 . 2]" 1
693 1 32 GLN H 1 32 GLN QG . . 4.790 2.991 2.011 4.034 . 0 0 "[ . 1 . 2]" 1
694 1 32 GLN H 1 32 GLN QE . . 5.340 4.307 2.322 5.605 0.265 9 0 "[ . 1 . 2]" 1
695 1 32 GLN H 1 33 VAL QG . . 6.420 3.711 3.529 3.986 . 0 0 "[ . 1 . 2]" 1
696 1 32 GLN HA 1 32 GLN QE . . 5.340 4.005 2.188 5.179 . 0 0 "[ . 1 . 2]" 1
697 1 32 GLN QB 1 33 VAL H . . 3.970 3.016 2.065 3.702 . 0 0 "[ . 1 . 2]" 1
698 1 32 GLN QG 1 33 VAL H . . 4.660 2.890 2.014 4.354 . 0 0 "[ . 1 . 2]" 1
699 1 32 GLN QG 1 34 VAL H . . 5.340 5.149 4.556 6.218 0.878 14 2 "[ . - 1 +. 2]" 1
700 1 33 VAL QG 1 34 VAL H . . 5.500 2.241 2.046 2.636 . 0 0 "[ . 1 . 2]" 1
701 1 33 VAL QG 1 36 TYR H . . 6.420 4.658 4.227 4.795 . 0 0 "[ . 1 . 2]" 1
702 1 34 VAL H 1 35 LYS QB . . 4.350 4.416 4.110 4.582 0.232 17 0 "[ . 1 . 2]" 1
703 1 34 VAL QG 1 35 LYS H . . 5.440 3.208 3.075 3.362 . 0 0 "[ . 1 . 2]" 1
704 1 34 VAL QG 1 36 TYR H . . 6.420 4.766 4.650 4.870 . 0 0 "[ . 1 . 2]" 1
705 1 34 VAL QG 1 77 ASP H . . 6.420 5.510 5.180 5.853 . 0 0 "[ . 1 . 2]" 1
706 1 34 VAL QG 1 78 ASN H . . 6.420 4.204 3.915 4.613 . 0 0 "[ . 1 . 2]" 1
707 1 34 VAL QG 1 79 VAL H . . 5.020 3.898 3.237 4.326 . 0 0 "[ . 1 . 2]" 1
708 1 35 LYS H 1 35 LYS QD . . 5.340 4.235 3.270 4.591 . 0 0 "[ . 1 . 2]" 1
709 1 35 LYS QD 1 36 TYR H . . 5.340 4.350 3.042 5.050 . 0 0 "[ . 1 . 2]" 1
710 1 35 LYS QD 1 39 ASP H . . 5.340 4.618 3.738 6.150 0.810 4 1 "[ +. 1 . 2]" 1
711 1 37 CYS H 1 37 CYS QB . . 3.380 2.397 2.325 2.467 . 0 0 "[ . 1 . 2]" 1
712 1 37 CYS H 1 39 ASP QB . . 5.050 4.782 4.491 5.253 0.203 5 0 "[ . 1 . 2]" 1
713 1 37 CYS H 1 40 LEU QD . . 6.420 4.282 3.676 5.404 . 0 0 "[ . 1 . 2]" 1
714 1 37 CYS QB 1 38 THR H . . 3.860 2.510 2.302 2.862 . 0 0 "[ . 1 . 2]" 1
715 1 37 CYS QB 1 39 ASP H . . 4.590 4.622 4.452 4.891 0.301 16 0 "[ . 1 . 2]" 1
716 1 37 CYS QB 1 40 LEU H . . 4.820 4.888 4.664 5.043 0.223 18 0 "[ . 1 . 2]" 1
717 1 38 THR H 1 79 VAL QG . . 6.420 3.851 3.222 4.438 . 0 0 "[ . 1 . 2]" 1
718 1 39 ASP H 1 40 LEU QB . . 4.500 4.549 4.175 4.879 0.379 15 0 "[ . 1 . 2]" 1
719 1 39 ASP H 1 42 GLU QG . . 5.340 4.845 4.043 6.056 0.716 4 2 "[ -+. 1 . 2]" 1
720 1 39 ASP QB 1 40 LEU H . . 3.540 2.760 2.402 3.069 . 0 0 "[ . 1 . 2]" 1
721 1 39 ASP QB 1 41 ILE H . . 5.140 4.753 4.627 4.875 . 0 0 "[ . 1 . 2]" 1
722 1 39 ASP QB 1 42 GLU H . . 5.110 4.858 4.570 5.096 . 0 0 "[ . 1 . 2]" 1
723 1 40 LEU H 1 40 LEU QB . . 3.310 2.340 2.151 2.511 . 0 0 "[ . 1 . 2]" 1
724 1 40 LEU H 1 40 LEU QD . . 4.930 3.178 2.351 3.704 . 0 0 "[ . 1 . 2]" 1
725 1 40 LEU QB 1 41 ILE H . . 3.350 2.746 2.592 2.875 . 0 0 "[ . 1 . 2]" 1
726 1 40 LEU QB 1 43 GLU H . . 4.590 4.812 4.598 5.102 0.512 14 1 "[ . 1 +. 2]" 1
727 1 40 LEU QB 1 46 LEU H . . 5.340 4.499 3.787 5.303 . 0 0 "[ . 1 . 2]" 1
728 1 40 LEU QB 1 47 GLU H . . 5.340 5.162 4.526 6.170 0.830 11 4 "[ -* 1+ * . 2]" 1
729 1 40 LEU QD 1 43 GLU H . . 6.420 4.650 4.033 4.970 . 0 0 "[ . 1 . 2]" 1
730 1 40 LEU QD 1 49 LEU H . . 5.440 2.484 1.978 2.899 . 0 0 "[ . 1 . 2]" 1
731 1 41 ILE H 1 42 GLU QG . . 5.340 4.520 4.082 6.067 0.727 4 3 "[ -+. * . 2]" 1
732 1 41 ILE QG 1 42 GLU H . . 5.340 3.981 3.875 4.093 . 0 0 "[ . 1 . 2]" 1
733 1 43 GLU H 1 43 GLU QB . . 3.330 2.383 2.259 2.514 . 0 0 "[ . 1 . 2]" 1
734 1 43 GLU H 1 43 GLU QG . . 4.080 3.185 2.386 4.082 0.002 16 0 "[ . 1 . 2]" 1
735 1 43 GLU H 1 44 LYS QG . . 5.340 5.439 4.840 5.691 0.351 20 0 "[ . 1 . 2]" 1
736 1 43 GLU H 1 45 ASP QB . . 4.940 4.644 4.239 5.018 0.078 10 0 "[ . 1 . 2]" 1
737 1 43 GLU QG 1 44 LYS H . . 5.340 4.456 4.161 4.688 . 0 0 "[ . 1 . 2]" 1
738 1 44 LYS H 1 44 LYS QG . . 4.650 3.457 3.182 3.833 . 0 0 "[ . 1 . 2]" 1
739 1 44 LYS H 1 45 ASP QB . . 4.850 4.540 4.311 5.025 0.175 10 0 "[ . 1 . 2]" 1
740 1 44 LYS QG 1 45 ASP H . . 4.970 4.908 4.503 5.020 0.050 7 0 "[ . 1 . 2]" 1
741 1 45 ASP H 1 45 ASP QB . . 3.040 2.416 2.282 2.648 . 0 0 "[ . 1 . 2]" 1
742 1 45 ASP QB 1 46 LEU H . . 3.880 3.944 3.811 4.055 0.175 12 0 "[ . 1 . 2]" 1
743 1 45 ASP QB 1 47 GLU H . . 4.970 4.414 4.029 4.739 . 0 0 "[ . 1 . 2]" 1
744 1 46 LEU H 1 46 LEU QB . . 2.930 2.705 2.509 2.849 . 0 0 "[ . 1 . 2]" 1
745 1 46 LEU H 1 83 LEU QD . . 6.420 5.586 5.120 6.040 . 0 0 "[ . 1 . 2]" 1
746 1 46 LEU QB 1 47 GLU H . . 3.730 3.909 3.699 4.003 0.273 15 0 "[ . 1 . 2]" 1
747 1 47 GLU QG 1 48 LYS H . . 5.340 3.434 2.830 3.951 . 0 0 "[ . 1 . 2]" 1
748 1 48 LYS QB 1 49 LEU H . . 3.420 2.759 2.358 3.680 0.260 5 0 "[ . 1 . 2]" 1
749 1 48 LYS QB 1 51 LEU H . . 4.620 4.898 4.501 5.134 0.514 15 1 "[ . 1 + 2]" 1
750 1 48 LYS QB 1 52 VAL H . . 4.650 4.482 3.731 5.143 0.493 15 0 "[ . 1 . 2]" 1
751 1 49 LEU QD 1 50 ASP H . . 5.610 3.667 3.011 4.025 . 0 0 "[ . 1 . 2]" 1
752 1 50 ASP H 1 51 LEU QB . . 4.530 4.795 4.505 4.997 0.467 8 0 "[ . 1 . 2]" 1
753 1 51 LEU H 1 51 LEU QB . . 3.080 2.340 2.145 2.486 . 0 0 "[ . 1 . 2]" 1
754 1 51 LEU H 1 52 VAL QG . . 6.270 4.206 3.988 4.407 . 0 0 "[ . 1 . 2]" 1
755 1 51 LEU QB 1 52 VAL H . . 3.580 2.635 2.277 2.886 . 0 0 "[ . 1 . 2]" 1
756 1 51 LEU QB 1 55 TYR H . . 5.290 5.032 4.709 5.348 0.058 1 0 "[ . 1 . 2]" 1
757 1 52 VAL QG 1 54 LYS H . . 6.420 4.640 4.465 4.866 . 0 0 "[ . 1 . 2]" 1
758 1 52 VAL QG 1 55 TYR H . . 6.420 4.597 4.320 4.783 . 0 0 "[ . 1 . 2]" 1
759 1 52 VAL QG 1 56 MET H . . 6.360 4.185 3.960 4.429 . 0 0 "[ . 1 . 2]" 1
760 1 52 VAL QG 1 57 LYS H . . 6.420 5.705 5.539 5.970 . 0 0 "[ . 1 . 2]" 1
761 1 53 ILE H 1 53 ILE QG . . 4.560 2.503 2.306 3.658 . 0 0 "[ . 1 . 2]" 1
762 1 53 ILE H 1 54 LYS QB . . 4.910 4.616 4.480 4.854 . 0 0 "[ . 1 . 2]" 1
763 1 54 LYS H 1 54 LYS QB . . 3.300 2.338 2.230 2.447 . 0 0 "[ . 1 . 2]" 1
764 1 54 LYS H 1 54 LYS QG . . 3.950 2.697 2.408 4.053 0.103 20 0 "[ . 1 . 2]" 1
765 1 54 LYS H 1 55 TYR QB . . 4.790 4.329 4.156 4.627 . 0 0 "[ . 1 . 2]" 1
766 1 54 LYS H 1 93 VAL QG . . 6.420 3.888 3.290 4.891 . 0 0 "[ . 1 . 2]" 1
767 1 54 LYS QB 1 55 TYR H . . 3.880 2.900 2.571 3.101 . 0 0 "[ . 1 . 2]" 1
768 1 54 LYS QB 1 58 ARG H . . 4.500 4.872 4.600 5.128 0.628 20 5 "[-* .* 1 * +]" 1
769 1 54 LYS QG 1 55 TYR H . . 5.340 4.356 3.968 4.604 . 0 0 "[ . 1 . 2]" 1
770 1 55 TYR H 1 56 MET QB . . 4.820 4.269 3.840 4.921 0.101 12 0 "[ . 1 . 2]" 1
771 1 55 TYR QB 1 56 MET H . . 3.570 2.365 2.169 2.687 . 0 0 "[ . 1 . 2]" 1
772 1 55 TYR QB 1 57 LYS H . . 4.970 4.631 4.435 4.855 . 0 0 "[ . 1 . 2]" 1
773 1 56 MET H 1 56 MET QB . . 3.400 2.273 2.125 2.527 . 0 0 "[ . 1 . 2]" 1
774 1 56 MET H 1 59 LEU QD . . 6.420 4.496 4.179 4.674 . 0 0 "[ . 1 . 2]" 1
775 1 56 MET QB 1 57 LYS H . . 4.290 2.802 2.212 3.659 . 0 0 "[ . 1 . 2]" 1
776 1 57 LYS H 1 60 MET QB . . 4.650 4.804 4.299 5.062 0.412 10 0 "[ . 1 . 2]" 1
777 1 57 LYS QG 1 58 ARG H . . 5.340 3.439 2.108 4.516 . 0 0 "[ . 1 . 2]" 1
778 1 57 LYS QE 1 61 GLN QE . . 6.160 3.904 2.072 5.457 . 0 0 "[ . 1 . 2]" 1
779 1 58 ARG H 1 59 LEU QB . . 4.700 4.734 4.529 4.871 0.171 2 0 "[ . 1 . 2]" 1
780 1 58 ARG H 1 93 VAL QG . . 6.420 4.666 3.592 5.654 . 0 0 "[ . 1 . 2]" 1
781 1 58 ARG QG 1 59 LEU H . . 5.340 3.707 3.362 4.217 . 0 0 "[ . 1 . 2]" 1
782 1 58 ARG QG 1 62 GLN QE . . 5.180 3.417 1.847 5.437 0.257 17 0 "[ . 1 . 2]" 1
783 1 58 ARG QD 1 62 GLN QE . . 6.160 4.515 2.922 6.059 . 0 0 "[ . 1 . 2]" 1
784 1 59 LEU H 1 59 LEU QB . . 3.460 2.420 2.345 2.502 . 0 0 "[ . 1 . 2]" 1
785 1 59 LEU H 1 60 MET QB . . 4.790 4.509 4.143 4.741 . 0 0 "[ . 1 . 2]" 1
786 1 59 LEU QB 1 60 MET H . . 3.930 2.654 2.362 2.966 . 0 0 "[ . 1 . 2]" 1
787 1 59 LEU QD 1 62 GLN QE . . 5.720 2.355 1.849 3.272 . 0 0 "[ . 1 . 2]" 1
788 1 60 MET H 1 60 MET QB . . 3.430 2.340 2.108 2.429 . 0 0 "[ . 1 . 2]" 1
789 1 60 MET H 1 62 GLN QE . . 5.340 5.267 4.815 5.824 0.484 4 0 "[ . 1 . 2]" 1
790 1 60 MET H 1 72 PHE QB . . 5.340 4.886 4.213 5.408 0.068 3 0 "[ . 1 . 2]" 1
791 1 60 MET QB 1 61 GLN H . . 3.460 2.900 2.477 3.153 . 0 0 "[ . 1 . 2]" 1
792 1 60 MET QB 1 69 ASN H . . 5.340 4.513 3.942 5.551 0.211 3 0 "[ . 1 . 2]" 1
793 1 60 MET QB 1 73 ASP H . . 5.340 5.326 4.822 5.886 0.546 3 1 "[ + . 1 . 2]" 1
794 1 60 MET QG 1 71 ALA H . . 5.340 5.294 4.246 6.048 0.708 11 2 "[ . -+ . 2]" 1
795 1 61 GLN H 1 61 GLN QE . . 5.340 4.709 3.550 5.285 . 0 0 "[ . 1 . 2]" 1
796 1 61 GLN H 1 62 GLN QB . . 4.530 4.489 3.837 5.007 0.477 19 0 "[ . 1 . 2]" 1
797 1 62 GLN HA 1 62 GLN QE . . 5.340 4.980 4.301 5.602 0.262 6 0 "[ . 1 . 2]" 1
798 1 64 VAL H 1 65 GLU QG . . 5.340 4.918 3.414 5.754 0.414 16 0 "[ . 1 . 2]" 1
799 1 64 VAL HB 1 69 ASN QD . . 5.340 5.223 4.415 5.833 0.493 14 0 "[ . 1 . 2]" 1
800 1 64 VAL QG 1 69 ASN QD . . 6.180 4.328 2.761 4.865 . 0 0 "[ . 1 . 2]" 1
801 1 65 GLU H 1 65 GLU QG . . 3.970 2.689 2.191 3.348 . 0 0 "[ . 1 . 2]" 1
802 1 65 GLU H 1 66 SER QB . . 4.790 4.244 3.601 4.792 0.002 11 0 "[ . 1 . 2]" 1
803 1 65 GLU HA 1 69 ASN QD . . 4.740 3.499 2.045 4.592 . 0 0 "[ . 1 . 2]" 1
804 1 66 SER QB 1 69 ASN H . . 4.130 3.191 2.572 4.058 . 0 0 "[ . 1 . 2]" 1
805 1 66 SER QB 1 69 ASN QD . . 4.530 3.690 2.027 5.137 0.607 8 1 "[ . + 1 . 2]" 1
806 1 67 VAL QG 1 71 ALA H . . 6.420 4.120 3.520 4.681 . 0 0 "[ . 1 . 2]" 1
807 1 68 TRP QB 1 72 PHE H . . 4.650 4.659 4.488 4.887 0.237 18 0 "[ . 1 . 2]" 1
808 1 69 ASN H 1 70 MET QG . . 5.340 4.095 3.746 4.475 . 0 0 "[ . 1 . 2]" 1
809 1 72 PHE H 1 73 ASP QB . . 4.470 4.561 4.352 4.919 0.449 10 0 "[ . 1 . 2]" 1
810 1 72 PHE QB 1 73 ASP H . . 3.760 2.530 2.254 3.391 . 0 0 "[ . 1 . 2]" 1
811 1 73 ASP H 1 74 PHE QB . . 4.700 4.468 4.337 4.659 . 0 0 "[ . 1 . 2]" 1
812 1 74 PHE H 1 75 ILE QG . . 5.340 4.243 4.062 4.415 . 0 0 "[ . 1 . 2]" 1
813 1 74 PHE HA 1 78 ASN QD . . 5.340 3.387 2.759 4.193 . 0 0 "[ . 1 . 2]" 1
814 1 74 PHE QB 1 75 ILE H . . 4.210 2.377 2.278 2.616 . 0 0 "[ . 1 . 2]" 1
815 1 74 PHE QB 1 77 ASP H . . 5.080 5.204 4.991 5.392 0.312 3 0 "[ . 1 . 2]" 1
816 1 74 PHE QD 1 78 ASN QD . . 7.310 3.113 2.792 3.967 . 0 0 "[ . 1 . 2]" 1
817 1 75 ILE QG 1 76 LEU H . . 5.340 4.018 3.954 4.102 . 0 0 "[ . 1 . 2]" 1
818 1 76 LEU H 1 76 LEU QB . . 3.350 2.278 2.171 2.471 . 0 0 "[ . 1 . 2]" 1
819 1 76 LEU H 1 77 ASP QB . . 4.500 4.491 4.346 4.597 0.097 20 0 "[ . 1 . 2]" 1
820 1 76 LEU H 1 79 VAL QG . . 6.420 3.996 3.850 4.105 . 0 0 "[ . 1 . 2]" 1
821 1 76 LEU QB 1 78 ASN H . . 4.760 5.040 4.927 5.125 0.365 4 0 "[ . 1 . 2]" 1
822 1 76 LEU QD 1 80 GLN QE . . 5.990 3.245 2.136 4.249 . 0 0 "[ . 1 . 2]" 1
823 1 77 ASP H 1 77 ASP QB . . 2.940 2.289 2.250 2.324 . 0 0 "[ . 1 . 2]" 1
824 1 77 ASP H 1 78 ASN QB . . 4.440 4.760 4.499 4.950 0.510 9 1 "[ . +1 . 2]" 1
825 1 77 ASP H 1 78 ASN QD . . 5.340 4.343 3.955 5.116 . 0 0 "[ . 1 . 2]" 1
826 1 77 ASP H 1 79 VAL QG . . 6.420 4.166 4.044 4.351 . 0 0 "[ . 1 . 2]" 1
827 1 77 ASP H 1 80 GLN QB . . 5.050 5.120 4.657 5.465 0.415 6 0 "[ . 1 . 2]" 1
828 1 77 ASP QB 1 78 ASN H . . 3.330 2.353 2.253 2.465 . 0 0 "[ . 1 . 2]" 1
829 1 77 ASP QB 1 78 ASN QD . . 5.180 3.102 2.154 4.074 . 0 0 "[ . 1 . 2]" 1
830 1 78 ASN H 1 78 ASN QD . . 4.140 2.448 1.943 3.384 . 0 0 "[ . 1 . 2]" 1
831 1 78 ASN QB 1 79 VAL H . . 3.260 2.722 2.525 2.909 . 0 0 "[ . 1 . 2]" 1
832 1 78 ASN QD 1 79 VAL H . . 5.340 4.409 4.063 4.725 . 0 0 "[ . 1 . 2]" 1
833 1 79 VAL H 1 80 GLN QB . . 4.440 4.615 4.271 4.833 0.393 10 0 "[ . 1 . 2]" 1
834 1 79 VAL QG 1 80 GLN H . . 5.020 2.223 2.108 2.382 . 0 0 "[ . 1 . 2]" 1
835 1 80 GLN H 1 80 GLN QB . . 3.270 2.369 2.135 2.470 . 0 0 "[ . 1 . 2]" 1
836 1 80 GLN H 1 80 GLN QG . . 4.320 2.720 2.351 4.091 . 0 0 "[ . 1 . 2]" 1
837 1 80 GLN H 1 80 GLN QE . . 5.340 5.075 4.130 5.733 0.393 11 0 "[ . 1 . 2]" 1
838 1 80 GLN QB 1 81 VAL H . . 2.920 2.855 2.554 3.055 0.135 19 0 "[ . 1 . 2]" 1
839 1 80 GLN QG 1 81 VAL H . . 5.230 4.283 3.975 4.487 . 0 0 "[ . 1 . 2]" 1
840 1 80 GLN QE 1 91 LEU QB . . 6.160 4.439 1.881 5.101 . 0 0 "[ . 1 . 2]" 1
841 1 80 GLN QE 1 91 LEU HG . . 5.340 3.666 1.834 4.617 . 0 0 "[ . 1 . 2]" 1
842 1 81 VAL HA 1 84 GLN QE . . 5.340 4.854 2.846 6.216 0.876 4 8 "[ *+* * ** .- * 2]" 1
843 1 81 VAL HB 1 85 GLN QE . . 5.340 4.426 3.835 6.040 0.700 18 1 "[ . 1 . + 2]" 1
844 1 81 VAL QG 1 84 GLN QE . . 5.600 4.654 2.973 6.131 0.531 4 1 "[ +. 1 . 2]" 1
845 1 81 VAL QG 1 85 GLN H . . 6.420 4.357 4.149 4.485 . 0 0 "[ . 1 . 2]" 1
846 1 82 VAL H 1 82 VAL QG . . 4.260 2.187 1.949 2.322 . 0 0 "[ . 1 . 2]" 1
847 1 82 VAL QG 1 85 GLN QE . . 6.180 3.239 2.248 4.525 . 0 0 "[ . 1 . 2]" 1
848 1 82 VAL QG 1 86 THR H . . 6.420 3.919 3.755 4.091 . 0 0 "[ . 1 . 2]" 1
849 1 83 LEU QD 1 86 THR H . . 6.420 4.823 4.245 5.124 . 0 0 "[ . 1 . 2]" 1
850 1 83 LEU QD 1 87 TYR H . . 6.420 3.592 3.068 4.337 . 0 0 "[ . 1 . 2]" 1
851 1 83 LEU QD 1 88 GLY H . . 6.420 4.649 4.043 5.652 . 0 0 "[ . 1 . 2]" 1
852 1 83 LEU QD 1 89 SER H . . 6.420 3.990 2.815 4.895 . 0 0 "[ . 1 . 2]" 1
853 1 83 LEU QD 1 90 THR H . . 6.420 4.293 3.409 4.813 . 0 0 "[ . 1 . 2]" 1
854 1 83 LEU QD 1 91 LEU H . . 6.330 2.114 1.764 2.841 . 0 0 "[ . 1 . 2]" 1
855 1 84 GLN H 1 84 GLN QB . . 3.350 2.326 2.142 2.694 . 0 0 "[ . 1 . 2]" 1
856 1 84 GLN H 1 84 GLN QE . . 5.340 5.019 4.089 5.854 0.514 9 1 "[ . +1 . 2]" 1
857 1 84 GLN HA 1 84 GLN QE . . 5.340 4.150 2.518 4.990 . 0 0 "[ . 1 . 2]" 1
858 1 84 GLN QB 1 88 GLY H . . 4.790 4.860 4.268 5.138 0.348 18 0 "[ . 1 . 2]" 1
859 1 84 GLN QB 1 89 SER H . . 5.340 4.668 3.764 5.539 0.199 18 0 "[ . 1 . 2]" 1
860 1 84 GLN QE 1 85 GLN H . . 5.340 4.654 3.307 5.322 . 0 0 "[ . 1 . 2]" 1
861 1 84 GLN QE 1 85 GLN HA . . 5.340 4.456 3.024 5.367 0.027 6 0 "[ . 1 . 2]" 1
862 1 84 GLN QE 1 88 GLY QA . . 5.180 4.697 2.359 6.107 0.927 2 8 "[ + .* * 1** . - **]" 1
863 1 85 GLN H 1 85 GLN QE . . 5.340 3.864 3.384 4.484 . 0 0 "[ . 1 . 2]" 1
864 1 85 GLN H 1 87 TYR QB . . 5.050 5.634 5.249 6.027 0.977 5 12 "[* *-+ ** * **** *]" 1
865 1 85 GLN HA 1 85 GLN QE . . 5.340 4.660 4.310 4.931 . 0 0 "[ . 1 . 2]" 1
866 1 85 GLN QB 1 87 TYR H . . 5.000 4.970 4.746 5.156 0.156 1 0 "[ . 1 . 2]" 1
867 1 86 THR H 1 87 TYR QB . . 4.440 4.387 4.206 4.595 0.155 7 0 "[ . 1 . 2]" 1
868 1 87 TYR QB 1 89 SER H . . 4.040 2.601 2.188 3.045 . 0 0 "[ . 1 . 2]" 1
869 1 89 SER H 1 89 SER QB . . 3.480 2.798 2.537 3.209 . 0 0 "[ . 1 . 2]" 1
870 1 89 SER QB 1 90 THR H . . 3.320 3.184 2.388 3.602 0.282 19 0 "[ . 1 . 2]" 1
871 1 91 LEU QD 1 93 VAL H . . 6.420 3.935 3.156 5.137 . 0 0 "[ . 1 . 2]" 1
872 1 92 LYS H 1 92 LYS QB . . 3.160 2.610 2.307 3.263 0.103 19 0 "[ . 1 . 2]" 1
873 1 92 LYS H 1 92 LYS QG . . 4.970 2.676 1.893 3.565 . 0 0 "[ . 1 . 2]" 1
874 1 92 LYS QB 1 93 VAL H . . 3.560 3.291 2.664 3.574 0.014 16 0 "[ . 1 . 2]" 1
875 1 92 LYS QB 1 94 THR H . . 4.090 3.639 2.682 4.356 0.266 16 0 "[ . 1 . 2]" 1
876 1 92 LYS QG 1 93 VAL H . . 5.140 4.340 3.934 4.895 . 0 0 "[ . 1 . 2]" 1
877 1 92 LYS QG 1 94 THR H . . 5.030 5.202 3.497 6.048 1.018 16 7 "[* * . 1 -*.+** 2]" 1
878 1 93 VAL H 1 93 VAL QG . . 4.230 2.124 1.877 2.638 . 0 0 "[ . 1 . 2]" 1
879 1 81 VAL HA 1 84 GLN HB2 . . 4.690 3.951 2.850 5.148 0.458 6 0 "[ . 1 . 2]" 1
880 1 81 VAL HA 1 84 GLN HB3 . . 4.690 3.359 2.478 4.439 . 0 0 "[ . 1 . 2]" 1
881 1 61 GLN QB 1 62 GLN H . . 6.380 2.824 2.386 3.640 . 0 0 "[ . 1 . 2]" 1
882 1 32 GLN H 1 32 GLN QB . . 3.550 2.386 2.115 2.782 . 0 0 "[ . 1 . 2]" 1
883 1 84 GLN HB3 1 85 GLN H . . 4.570 3.145 2.310 4.193 . 0 0 "[ . 1 . 2]" 1
884 1 84 GLN HB2 1 85 GLN H . . 4.570 3.906 3.551 4.199 . 0 0 "[ . 1 . 2]" 1
885 1 84 GLN H 1 84 GLN HB2 . . 4.170 2.846 2.253 3.696 . 0 0 "[ . 1 . 2]" 1
886 1 84 GLN H 1 84 GLN HB3 . . 4.170 2.581 2.355 2.772 . 0 0 "[ . 1 . 2]" 1
887 1 17 GLU QB 1 18 TRP H . . 6.100 3.355 2.420 3.768 . 0 0 "[ . 1 . 2]" 1
888 1 55 TYR HA 1 58 ARG QB . . 5.450 2.992 2.662 3.455 . 0 0 "[ . 1 . 2]" 1
889 1 82 VAL HA 1 85 GLN HB3 . . 4.480 4.355 3.770 4.819 0.339 10 0 "[ . 1 . 2]" 1
890 1 82 VAL HA 1 85 GLN HB2 . . 4.480 2.704 2.118 3.105 . 0 0 "[ . 1 . 2]" 1
891 1 31 LEU HA 1 34 VAL HB . . 3.830 2.713 2.086 3.376 . 0 0 "[ . 1 . 2]" 1
892 1 67 VAL HB 1 68 TRP HA . . 4.790 4.569 4.199 5.015 0.225 15 0 "[ . 1 . 2]" 1
893 1 33 VAL H 1 33 VAL HB . . 3.580 3.658 2.877 3.773 0.193 5 0 "[ . 1 . 2]" 1
894 1 12 LYS H 1 12 LYS HB3 . . 3.980 2.417 2.186 3.632 . 0 0 "[ . 1 . 2]" 1
895 1 12 LYS HB2 1 13 THR H . . 3.890 3.878 2.987 4.072 0.182 16 0 "[ . 1 . 2]" 1
896 1 67 VAL H 1 67 VAL HB . . 4.140 3.088 2.525 3.688 . 0 0 "[ . 1 . 2]" 1
897 1 34 VAL H 1 34 VAL HB . . 3.830 2.524 2.429 2.615 . 0 0 "[ . 1 . 2]" 1
898 1 78 ASN HA 1 81 VAL HB . . 4.290 2.690 2.399 2.972 . 0 0 "[ . 1 . 2]" 1
899 1 63 SER HA 1 64 VAL HB . . 4.880 4.707 4.276 4.899 0.019 18 0 "[ . 1 . 2]" 1
900 1 49 LEU H 1 52 VAL HB . . 4.910 4.908 4.690 5.156 0.246 20 0 "[ . 1 . 2]" 1
901 1 81 VAL H 1 81 VAL HB . . 3.760 2.403 2.325 2.485 . 0 0 "[ . 1 . 2]" 1
902 1 11 VAL H 1 11 VAL HB . . 3.700 2.606 2.355 2.858 . 0 0 "[ . 1 . 2]" 1
903 1 11 VAL HB 1 12 LYS H . . 3.920 2.410 2.200 2.673 . 0 0 "[ . 1 . 2]" 1
904 1 35 LYS H 1 35 LYS HB2 . . 3.730 2.422 2.138 2.665 . 0 0 "[ . 1 . 2]" 1
905 1 64 VAL HB 1 65 GLU H . . 3.330 2.414 1.924 3.715 0.385 20 0 "[ . 1 . 2]" 1
906 1 79 VAL HB 1 80 GLN H . . 4.660 4.014 3.928 4.105 . 0 0 "[ . 1 . 2]" 1
907 1 52 VAL HB 1 53 ILE H . . 4.070 2.568 2.407 2.920 . 0 0 "[ . 1 . 2]" 1
908 1 70 MET QB 1 71 ALA H . . 5.140 2.748 2.427 3.700 . 0 0 "[ . 1 . 2]" 1
909 1 48 LYS H 1 48 LYS HB3 . . 3.360 3.334 2.575 3.665 0.305 4 0 "[ . 1 . 2]" 1
910 1 92 LYS H 1 92 LYS HB2 . . 4.110 2.832 2.335 3.958 . 0 0 "[ . 1 . 2]" 1
911 1 92 LYS H 1 92 LYS HB3 . . 4.110 3.561 2.961 3.812 . 0 0 "[ . 1 . 2]" 1
912 1 93 VAL H 1 93 VAL HB . . 3.730 2.623 2.463 2.868 . 0 0 "[ . 1 . 2]" 1
913 1 92 LYS HB2 1 93 VAL H . . 4.940 4.071 2.945 4.453 . 0 0 "[ . 1 . 2]" 1
914 1 92 LYS HB3 1 93 VAL H . . 4.940 3.625 2.716 4.379 . 0 0 "[ . 1 . 2]" 1
915 1 54 LYS HB2 1 55 TYR H . . 5.340 3.073 2.660 4.016 . 0 0 "[ . 1 . 2]" 1
916 1 54 LYS HB3 1 55 TYR H . . 5.340 3.728 2.876 3.944 . 0 0 "[ . 1 . 2]" 1
917 1 6 VAL HB 1 7 GLU H . . 4.070 3.721 2.836 4.487 0.417 9 0 "[ . 1 . 2]" 1
918 1 41 ILE HB 1 42 GLU H . . 4.850 2.553 2.372 2.881 . 0 0 "[ . 1 . 2]" 1
919 1 30 ILE H 1 30 ILE HB . . 3.890 2.585 2.463 2.663 . 0 0 "[ . 1 . 2]" 1
920 1 9 ASN H 1 9 ASN HB2 . . 3.920 2.550 2.374 3.677 . 0 0 "[ . 1 . 2]" 1
921 1 9 ASN H 1 9 ASN HB3 . . 3.920 3.303 2.444 3.672 . 0 0 "[ . 1 . 2]" 1
922 1 9 ASN HB2 1 10 ASP H . . 4.450 3.078 2.463 3.987 . 0 0 "[ . 1 . 2]" 1
923 1 9 ASN HB3 1 10 ASP H . . 4.450 3.420 2.440 4.053 . 0 0 "[ . 1 . 2]" 1
924 1 72 PHE HA 1 75 ILE HB . . 4.040 3.301 2.564 3.878 . 0 0 "[ . 1 . 2]" 1
925 1 75 ILE HB 1 76 LEU H . . 3.890 2.504 2.272 2.631 . 0 0 "[ . 1 . 2]" 1
926 1 65 GLU HA 1 69 ASN QB . . 5.200 3.627 2.179 4.667 . 0 0 "[ . 1 . 2]" 1
927 1 36 TYR HA 1 39 ASP HB2 . . 4.230 2.904 2.103 4.391 0.161 5 0 "[ . 1 . 2]" 1
928 1 36 TYR HA 1 39 ASP HB3 . . 4.230 3.461 2.222 4.585 0.355 17 0 "[ . 1 . 2]" 1
929 1 55 TYR H 1 55 TYR HB3 . . 3.610 2.950 2.523 3.616 0.006 2 0 "[ . 1 . 2]" 1
930 1 55 TYR HB3 1 56 MET H . . 4.110 2.533 2.189 3.167 . 0 0 "[ . 1 . 2]" 1
931 1 45 ASP HB3 1 46 LEU H . . 4.480 4.347 4.110 4.529 0.049 10 0 "[ . 1 . 2]" 1
932 1 39 ASP H 1 39 ASP HB3 . . 3.670 3.233 2.493 3.688 0.018 16 0 "[ . 1 . 2]" 1
933 1 45 ASP H 1 45 ASP HB2 . . 3.550 2.725 2.348 3.114 . 0 0 "[ . 1 . 2]" 1
934 1 74 PHE H 1 74 PHE HB3 . . 3.700 2.497 2.399 2.580 . 0 0 "[ . 1 . 2]" 1
935 1 71 ALA HA 1 74 PHE HB2 . . 4.200 3.411 2.934 3.716 . 0 0 "[ . 1 . 2]" 1
936 1 71 ALA HA 1 74 PHE HB3 . . 4.200 2.648 2.091 3.081 . 0 0 "[ . 1 . 2]" 1
937 1 46 LEU H 1 46 LEU HB3 . . 3.520 2.794 2.556 2.997 . 0 0 "[ . 1 . 2]" 1
938 1 87 TYR H 1 87 TYR HB2 . . 3.830 2.372 2.187 2.575 . 0 0 "[ . 1 . 2]" 1
939 1 74 PHE HA 1 77 ASP HB2 . . 3.640 3.942 3.449 4.384 0.744 6 7 "[ ** .+ 1 - . ***]" 1
940 1 77 ASP HB3 1 78 ASN H . . 3.860 2.377 2.274 2.495 . 0 0 "[ . 1 . 2]" 1
941 1 77 ASP H 1 77 ASP HB3 . . 3.360 2.534 2.444 2.583 . 0 0 "[ . 1 . 2]" 1
942 1 77 ASP H 1 77 ASP HB2 . . 3.360 2.612 2.485 2.716 . 0 0 "[ . 1 . 2]" 1
943 1 76 LEU HB3 1 77 ASP H . . 3.670 3.146 2.635 3.863 0.193 5 0 "[ . 1 . 2]" 1
944 1 70 MET HA 1 73 ASP HB2 . . 4.850 3.325 2.543 3.911 . 0 0 "[ . 1 . 2]" 1
945 1 70 MET HA 1 73 ASP HB3 . . 4.850 3.311 2.604 5.081 0.231 16 0 "[ . 1 . 2]" 1
946 1 31 LEU HB3 1 32 GLN H . . 5.250 3.541 2.589 4.278 . 0 0 "[ . 1 . 2]" 1
947 1 31 LEU HB2 1 32 GLN H . . 5.250 3.459 2.612 4.204 . 0 0 "[ . 1 . 2]" 1
948 1 40 LEU H 1 40 LEU HB2 . . 3.790 2.391 2.174 2.562 . 0 0 "[ . 1 . 2]" 1
949 1 46 LEU HA 1 49 LEU HB2 . . 4.140 2.332 1.778 2.739 . 0 0 "[ . 1 . 2]" 1
950 1 83 LEU QB 1 84 GLN H . . 4.800 2.691 2.496 2.861 . 0 0 "[ . 1 . 2]" 1
951 1 91 LEU QB 1 92 LYS H . . 4.610 3.136 2.442 3.621 . 0 0 "[ . 1 . 2]" 1
952 1 1 ASN HB3 1 4 GLY H . . 4.690 4.678 3.329 5.190 0.500 1 1 "[+ . 1 . 2]" 1
953 1 14 LEU H 1 14 LEU QB . . 3.580 2.488 2.287 2.788 . 0 0 "[ . 1 . 2]" 1
954 1 51 LEU H 1 51 LEU HB2 . . 3.700 2.372 2.165 2.534 . 0 0 "[ . 1 . 2]" 1
955 1 59 LEU H 1 59 LEU HB3 . . 3.950 3.606 3.538 3.655 . 0 0 "[ . 1 . 2]" 1
956 1 59 LEU H 1 59 LEU HB2 . . 3.950 2.459 2.378 2.553 . 0 0 "[ . 1 . 2]" 1
957 1 3 ALA HA 1 4 GLY HA2 . . 5.040 4.620 4.277 4.912 . 0 0 "[ . 1 . 2]" 1
958 1 3 ALA HA 1 4 GLY HA3 . . 5.040 4.485 4.284 4.927 . 0 0 "[ . 1 . 2]" 1
959 1 2 LEU HA 1 3 ALA HA . . 4.480 4.386 4.250 4.649 0.169 17 0 "[ . 1 . 2]" 1
960 1 5 ALA HA 1 6 VAL H . . 3.330 2.361 2.128 2.757 . 0 0 "[ . 1 . 2]" 1
961 1 26 MET HA 1 27 GLU HA . . 4.660 4.269 4.135 4.404 . 0 0 "[ . 1 . 2]" 1
962 1 70 MET QB 1 71 ALA HA . . 6.260 4.077 3.891 4.801 . 0 0 "[ . 1 . 2]" 1
963 1 71 ALA HA 1 73 ASP H . . 4.880 4.485 4.308 4.671 . 0 0 "[ . 1 . 2]" 1
964 1 71 ALA HA 1 75 ILE H . . 4.260 3.946 3.599 4.351 0.091 13 0 "[ . 1 . 2]" 1
965 1 92 LYS HA 1 93 VAL H . . 2.560 2.156 2.059 2.255 . 0 0 "[ . 1 . 2]" 1
966 1 92 LYS HA 1 94 THR H . . 3.920 4.184 3.337 4.879 0.959 17 6 "[ * . 1 *. +**-]" 1
967 1 92 LYS HA 1 93 VAL HB . . 4.570 4.703 4.418 4.918 0.348 5 0 "[ . 1 . 2]" 1
968 1 64 VAL HA 1 65 GLU HA . . 4.600 4.679 4.568 4.838 0.238 16 0 "[ . 1 . 2]" 1
969 1 7 GLU HA 1 8 PHE HB2 . . 4.760 4.680 4.465 4.800 0.040 6 0 "[ . 1 . 2]" 1
970 1 7 GLU HA 1 8 PHE HB3 . . 4.760 4.757 4.532 4.942 0.182 15 0 "[ . 1 . 2]" 1
971 1 7 GLU HA 1 9 ASN H . . 5.160 3.866 3.601 4.203 . 0 0 "[ . 1 . 2]" 1
972 1 43 GLU HA 1 45 ASP H . . 4.230 4.429 4.234 4.609 0.379 14 0 "[ . 1 . 2]" 1
973 1 46 LEU HA 1 50 ASP H . . 4.760 3.984 3.618 4.474 . 0 0 "[ . 1 . 2]" 1
974 1 45 ASP H 1 46 LEU HA . . 4.690 4.631 4.248 4.935 0.245 20 0 "[ . 1 . 2]" 1
975 1 10 ASP HA 1 13 THR H . . 3.980 3.467 3.182 4.119 0.139 8 0 "[ . 1 . 2]" 1
976 1 10 ASP HA 1 12 LYS H . . 5.280 4.414 4.199 4.641 . 0 0 "[ . 1 . 2]" 1
977 1 45 ASP HA 1 46 LEU HA . . 5.100 4.663 4.521 4.745 . 0 0 "[ . 1 . 2]" 1
978 1 46 LEU HA 1 49 LEU HB3 . . 4.140 2.170 1.850 2.780 . 0 0 "[ . 1 . 2]" 1
979 1 46 LEU HA 1 50 ASP QB . . 6.380 5.146 4.622 5.745 . 0 0 "[ . 1 . 2]" 1
980 1 58 ARG QB 1 59 LEU HA . . 6.070 4.155 3.692 4.300 . 0 0 "[ . 1 . 2]" 1
981 1 78 ASN HA 1 82 VAL H . . 4.660 4.241 4.032 4.495 . 0 0 "[ . 1 . 2]" 1
982 1 78 ASN HA 1 81 VAL H . . 4.040 3.637 3.343 3.899 . 0 0 "[ . 1 . 2]" 1
983 1 59 LEU HA 1 62 GLN H . . 4.970 3.544 3.150 3.851 . 0 0 "[ . 1 . 2]" 1
984 1 78 ASN HA 1 80 GLN H . . 5.000 4.554 4.416 4.666 . 0 0 "[ . 1 . 2]" 1
985 1 44 LYS HA 1 45 ASP H . . 3.450 3.034 2.928 3.108 . 0 0 "[ . 1 . 2]" 1
986 1 44 LYS HA 1 46 LEU H . . 4.790 3.513 3.049 3.926 . 0 0 "[ . 1 . 2]" 1
987 1 89 SER HA 1 90 THR H . . 2.960 2.267 2.153 2.465 . 0 0 "[ . 1 . 2]" 1
988 1 88 GLY H 1 89 SER HA . . 4.850 5.093 5.010 5.172 0.322 19 0 "[ . 1 . 2]" 1
989 1 89 SER HA 1 90 THR HA . . 4.420 4.499 4.415 4.583 0.163 4 0 "[ . 1 . 2]" 1
990 1 84 GLN HA 1 89 SER HA . . 4.350 4.135 3.629 4.817 0.467 3 0 "[ . 1 . 2]" 1
991 1 69 ASN HA 1 72 PHE HB3 . . 4.790 2.471 1.804 3.243 . 0 0 "[ . 1 . 2]" 1
992 1 69 ASN HA 1 72 PHE HB2 . . 4.790 3.243 2.470 4.849 0.059 7 0 "[ . 1 . 2]" 1
993 1 73 ASP HA 1 76 LEU H . . 4.070 4.224 3.825 4.498 0.428 6 0 "[ . 1 . 2]" 1
994 1 73 ASP HA 1 77 ASP H . . 5.500 4.095 3.848 4.387 . 0 0 "[ . 1 . 2]" 1
995 1 77 ASP HA 1 80 GLN H . . 4.320 3.955 3.758 4.131 . 0 0 "[ . 1 . 2]" 1
996 1 49 LEU HA 1 52 VAL H . . 4.940 3.850 3.211 4.242 . 0 0 "[ . 1 . 2]" 1
997 1 49 LEU HA 1 52 VAL HB . . 4.540 2.830 2.351 3.495 . 0 0 "[ . 1 . 2]" 1
998 1 49 LEU HA 1 50 ASP QB . . 6.350 5.201 5.160 5.256 . 0 0 "[ . 1 . 2]" 1
999 1 50 ASP HA 1 53 ILE HB . . 3.920 3.399 3.021 3.727 . 0 0 "[ . 1 . 2]" 1
1000 1 49 LEU HA 1 50 ASP HA . . 4.880 4.905 4.834 4.973 0.093 13 0 "[ . 1 . 2]" 1
1001 1 39 ASP HA 1 42 GLU QB . . 4.770 3.190 1.911 4.024 . 0 0 "[ . 1 . 2]" 1
1002 1 76 LEU HA 1 79 VAL HB . . 3.950 4.394 3.816 5.089 1.139 20 6 "[ . ** 1 .**- +]" 1
1003 1 76 LEU HA 1 77 ASP HA . . 4.820 4.850 4.777 4.922 0.102 13 0 "[ . 1 . 2]" 1
1004 1 75 ILE HA 1 76 LEU HA . . 4.850 4.838 4.741 4.934 0.084 7 0 "[ . 1 . 2]" 1
1005 1 50 ASP HA 1 52 VAL H . . 5.040 4.814 4.491 5.104 0.064 11 0 "[ . 1 . 2]" 1
1006 1 63 SER HA 1 64 VAL H . . 3.360 2.435 2.155 3.522 0.162 11 0 "[ . 1 . 2]" 1
1007 1 76 LEU HA 1 78 ASN H . . 4.760 4.738 4.436 4.919 0.159 6 0 "[ . 1 . 2]" 1
1008 1 40 LEU HA 1 43 GLU H . . 3.830 3.292 2.863 3.634 . 0 0 "[ . 1 . 2]" 1
1009 1 51 LEU HA 1 54 LYS H . . 3.890 3.676 3.109 4.289 0.399 12 0 "[ . 1 . 2]" 1
1010 1 31 LEU HA 1 34 VAL H . . 4.110 3.549 3.135 3.974 . 0 0 "[ . 1 . 2]" 1
1011 1 31 LEU HA 1 35 LYS H . . 4.970 3.973 3.528 4.449 . 0 0 "[ . 1 . 2]" 1
1012 1 30 ILE HB 1 31 LEU HA . . 4.570 4.360 4.057 4.528 . 0 0 "[ . 1 . 2]" 1
1013 1 69 ASN QB 1 70 MET HA . . 5.820 4.121 3.890 4.358 . 0 0 "[ . 1 . 2]" 1
1014 1 34 VAL HB 1 35 LYS HA . . 4.790 4.402 4.271 4.545 . 0 0 "[ . 1 . 2]" 1
1015 1 13 THR HA 1 14 LEU HA . . 4.940 4.804 4.633 4.992 0.052 7 0 "[ . 1 . 2]" 1
1016 1 58 ARG HA 1 61 GLN QB . . 5.640 3.154 2.322 4.249 . 0 0 "[ . 1 . 2]" 1
1017 1 22 ILE HA 1 23 SER H . . 3.300 2.171 2.096 2.298 . 0 0 "[ . 1 . 2]" 1
1018 1 14 LEU HA 1 17 GLU H . . 4.540 4.435 3.820 5.062 0.522 2 1 "[ + . 1 . 2]" 1
1019 1 14 LEU HA 1 18 TRP H . . 4.260 4.273 3.915 4.666 0.406 1 0 "[ . 1 . 2]" 1
1020 1 22 ILE HA 1 24 ASP H . . 4.350 3.895 3.429 4.357 0.007 6 0 "[ . 1 . 2]" 1
1021 1 80 GLN HA 1 83 LEU QB . . 5.270 2.288 1.892 3.194 . 0 0 "[ . 1 . 2]" 1
1022 1 83 LEU QB 1 84 GLN HA . . 5.850 4.201 3.884 4.339 . 0 0 "[ . 1 . 2]" 1
1023 1 83 LEU HA 1 85 GLN H . . 4.510 4.388 3.929 4.524 0.014 8 0 "[ . 1 . 2]" 1
1024 1 47 GLU QB 1 48 LYS HA . . 5.910 4.295 4.153 4.455 . 0 0 "[ . 1 . 2]" 1
1025 1 47 GLU HA 1 48 LYS HA . . 5.000 4.814 4.705 4.908 . 0 0 "[ . 1 . 2]" 1
1026 1 47 GLU HA 1 50 ASP QB . . 4.860 3.164 2.655 3.979 . 0 0 "[ . 1 . 2]" 1
1027 1 22 ILE HB 1 23 SER HA . . 5.000 5.078 4.674 5.220 0.220 17 0 "[ . 1 . 2]" 1
1028 1 47 GLU HA 1 50 ASP H . . 4.110 3.760 3.460 4.334 0.224 5 0 "[ . 1 . 2]" 1
1029 1 48 LYS HA 1 52 VAL H . . 4.290 3.962 3.367 4.561 0.271 13 0 "[ . 1 . 2]" 1
1030 1 17 GLU HA 1 19 ILE H . . 4.450 4.534 4.207 4.873 0.423 18 0 "[ . 1 . 2]" 1
1031 1 32 GLN HA 1 35 LYS H . . 4.170 3.745 3.083 4.263 0.093 11 0 "[ . 1 . 2]" 1
1032 1 17 GLU HA 1 20 THR HB . . 4.320 4.524 2.012 5.048 0.728 11 4 "[ . *+ . *-2]" 1
1033 1 60 MET HA 1 63 SER QB . . 5.580 2.844 2.066 4.296 . 0 0 "[ . 1 . 2]" 1
1034 1 16 ARG HA 1 19 ILE HB . . 4.380 3.914 3.574 4.203 . 0 0 "[ . 1 . 2]" 1
1035 1 16 ARG HA 1 19 ILE H . . 4.690 4.138 3.825 4.423 . 0 0 "[ . 1 . 2]" 1
1036 1 27 GLU HA 1 31 LEU H . . 5.000 4.096 3.795 4.532 . 0 0 "[ . 1 . 2]" 1
1037 1 27 GLU HA 1 29 ASP H . . 4.880 4.407 3.921 4.945 0.065 9 0 "[ . 1 . 2]" 1
1038 1 12 LYS HA 1 15 LEU HB2 . . 4.320 2.738 2.136 3.327 . 0 0 "[ . 1 . 2]" 1
1039 1 11 VAL HB 1 12 LYS HA . . 4.630 4.209 3.957 4.553 . 0 0 "[ . 1 . 2]" 1
1040 1 12 LYS HA 1 15 LEU HB3 . . 4.320 4.382 3.764 5.014 0.694 17 1 "[ . 1 . + 2]" 1
1041 1 12 LYS HA 1 52 VAL HA . . 5.160 5.647 5.111 6.015 0.855 19 9 "[** *. *- ** +*]" 1
1042 1 54 LYS HA 1 57 LYS QB . . 4.800 2.864 1.841 4.244 . 0 0 "[ . 1 . 2]" 1
1043 1 54 LYS HA 1 58 ARG H . . 4.570 3.963 3.709 4.220 . 0 0 "[ . 1 . 2]" 1
1044 1 12 LYS HA 1 15 LEU H . . 4.480 3.621 3.121 4.160 . 0 0 "[ . 1 . 2]" 1
1045 1 54 LYS HA 1 57 LYS H . . 4.070 3.627 3.005 4.233 0.163 2 0 "[ . 1 . 2]" 1
1046 1 90 THR HA 1 91 LEU H . . 3.420 2.267 2.165 2.584 . 0 0 "[ . 1 . 2]" 1
1047 1 56 MET HA 1 59 LEU H . . 4.350 4.027 3.322 4.576 0.226 2 0 "[ . 1 . 2]" 1
1048 1 90 THR HA 1 91 LEU QB . . 5.610 4.550 4.405 4.663 . 0 0 "[ . 1 . 2]" 1
1049 1 56 MET HA 1 57 LYS QB . . 6.380 5.318 5.179 5.570 . 0 0 "[ . 1 . 2]" 1
1050 1 36 TYR HA 1 39 ASP H . . 4.480 3.604 3.189 4.129 . 0 0 "[ . 1 . 2]" 1
1051 1 74 PHE HA 1 77 ASP H . . 4.660 3.942 3.612 4.234 . 0 0 "[ . 1 . 2]" 1
1052 1 8 PHE HA 1 12 LYS H . . 4.380 3.808 3.415 4.172 . 0 0 "[ . 1 . 2]" 1
1053 1 74 PHE HA 1 78 ASN H . . 4.720 4.281 4.022 4.526 . 0 0 "[ . 1 . 2]" 1
1054 1 74 PHE HA 1 77 ASP HB3 . . 3.640 3.097 2.817 3.389 . 0 0 "[ . 1 . 2]" 1
1055 1 8 PHE HA 1 11 VAL HB . . 3.890 2.284 1.927 2.961 . 0 0 "[ . 1 . 2]" 1
1056 1 55 TYR HA 1 58 ARG H . . 4.570 3.679 3.452 4.073 . 0 0 "[ . 1 . 2]" 1
1057 1 1 ASN HA 1 6 VAL HA . . 4.140 3.217 2.470 4.474 0.334 5 0 "[ . 1 . 2]" 1
1058 1 2 LEU H 1 6 VAL HA . . 3.920 3.382 2.562 4.184 0.264 17 0 "[ . 1 . 2]" 1
1059 1 72 PHE HA 1 76 LEU H . . 4.630 3.876 3.487 4.384 . 0 0 "[ . 1 . 2]" 1
1060 1 64 VAL HA 1 65 GLU QB . . 5.510 5.043 4.461 5.597 0.087 19 0 "[ . 1 . 2]" 1
1061 1 63 SER QB 1 64 VAL HA . . 5.920 4.967 4.597 5.378 . 0 0 "[ . 1 . 2]" 1
1062 1 61 GLN H 1 63 SER QB . . 5.670 4.770 4.144 5.823 0.153 12 0 "[ . 1 . 2]" 1
1063 1 36 TYR QB 1 37 CYS HA . . 6.380 3.910 3.646 4.248 . 0 0 "[ . 1 . 2]" 1
1064 1 37 CYS HA 1 49 LEU HA . . 4.480 4.033 3.613 5.094 0.614 13 1 "[ . 1 + . 2]" 1
1065 1 37 CYS HA 1 40 LEU H . . 4.230 3.577 3.216 3.907 . 0 0 "[ . 1 . 2]" 1
1066 1 67 VAL HA 1 71 ALA H . . 4.820 4.308 3.944 4.807 . 0 0 "[ . 1 . 2]" 1
1067 1 89 SER HB3 1 90 THR H . . 4.140 3.426 2.474 4.040 . 0 0 "[ . 1 . 2]" 1
1068 1 89 SER HB2 1 90 THR H . . 4.140 4.017 2.415 4.425 0.285 19 0 "[ . 1 . 2]" 1
1069 1 66 SER HA 1 67 VAL HA . . 4.480 4.447 4.367 4.568 0.088 9 0 "[ . 1 . 2]" 1
1070 1 67 VAL HA 1 69 ASN QB . . 6.380 4.667 3.965 5.269 . 0 0 "[ . 1 . 2]" 1
1071 1 67 VAL HA 1 70 MET QB . . 5.110 2.994 2.442 4.420 . 0 0 "[ . 1 . 2]" 1
1072 1 85 GLN HB2 1 86 THR HA . . 4.910 4.451 4.283 4.594 . 0 0 "[ . 1 . 2]" 1
1073 1 85 GLN HB3 1 86 THR HA . . 4.910 4.406 4.205 4.603 . 0 0 "[ . 1 . 2]" 1
1074 1 75 ILE HA 1 78 ASN H . . 4.140 3.817 3.384 4.208 0.068 18 0 "[ . 1 . 2]" 1
1075 1 82 VAL HA 1 85 GLN H . . 3.700 3.406 2.932 3.648 . 0 0 "[ . 1 . 2]" 1
1076 1 41 ILE HA 1 46 LEU HA . . 4.540 4.328 4.062 4.638 0.098 7 0 "[ . 1 . 2]" 1
1077 1 41 ILE HA 1 44 LYS HA . . 4.510 4.076 3.378 4.878 0.368 16 0 "[ . 1 . 2]" 1
1078 1 30 ILE HA 1 33 VAL HB . . 4.350 5.146 4.958 5.331 0.981 13 20 [************+*-*****] 1
1079 1 38 THR HA 1 79 VAL HA . . 5.000 3.922 3.504 4.264 . 0 0 "[ . 1 . 2]" 1
1080 1 52 VAL HA 1 55 TYR HB2 . . 4.230 3.526 2.562 4.247 0.017 1 0 "[ . 1 . 2]" 1
1081 1 52 VAL HA 1 55 TYR HB3 . . 4.230 3.698 2.999 5.098 0.868 2 2 "[ + . 1 - 2]" 1
1082 1 13 THR HA 1 16 ARG HB3 . . 4.230 3.855 2.995 5.230 1.000 15 3 "[ . *-1 + 2]" 1
1083 1 13 THR HA 1 16 ARG HB2 . . 4.230 4.056 3.030 4.988 0.758 20 1 "[ . 1 . +]" 1
1084 1 81 VAL HA 1 83 LEU QB . . 6.380 5.102 4.670 5.544 . 0 0 "[ . 1 . 2]" 1
1085 1 30 ILE HA 1 32 GLN H . . 4.690 4.368 3.985 4.753 0.063 18 0 "[ . 1 . 2]" 1
1086 1 81 VAL HA 1 84 GLN H . . 4.010 3.631 3.452 3.791 . 0 0 "[ . 1 . 2]" 1
1087 1 81 VAL HA 1 83 LEU H . . 4.820 4.425 4.206 4.566 . 0 0 "[ . 1 . 2]" 1
1088 1 81 VAL HA 1 85 GLN H . . 4.720 4.435 4.225 4.579 . 0 0 "[ . 1 . 2]" 1
1089 1 30 ILE HA 1 34 VAL H . . 5.100 4.319 4.115 4.469 . 0 0 "[ . 1 . 2]" 1
1090 1 13 THR HA 1 16 ARG H . . 4.420 4.054 3.587 4.392 . 0 0 "[ . 1 . 2]" 1
1091 1 13 THR HA 1 17 GLU H . . 4.880 4.514 3.840 5.124 0.244 16 0 "[ . 1 . 2]" 1
1092 1 52 VAL HA 1 55 TYR H . . 3.790 3.838 3.462 4.283 0.493 3 0 "[ . 1 . 2]" 1
1093 1 52 VAL HA 1 56 MET H . . 4.820 4.200 3.981 4.435 . 0 0 "[ . 1 . 2]" 1
1094 1 33 VAL HA 1 36 TYR QB . . 5.450 2.775 2.174 3.128 . 0 0 "[ . 1 . 2]" 1
1095 1 79 VAL HA 1 82 VAL HB . . 4.170 3.163 2.521 4.585 0.415 18 0 "[ . 1 . 2]" 1
1096 1 79 VAL HA 1 82 VAL H . . 4.290 3.652 3.417 3.853 . 0 0 "[ . 1 . 2]" 1
1097 1 35 LYS HA 1 38 THR HB . . 4.910 4.903 4.535 5.127 0.217 6 0 "[ . 1 . 2]" 1
1098 1 34 VAL HA 1 37 CYS H . . 4.200 3.636 3.427 3.911 . 0 0 "[ . 1 . 2]" 1
1099 1 10 ASP HA 1 13 THR HB . . 3.860 2.718 2.333 3.275 . 0 0 "[ . 1 . 2]" 1
1100 1 86 THR H 1 86 THR HB . . 3.390 2.551 2.398 3.613 0.223 14 0 "[ . 1 . 2]" 1
1101 1 86 THR HB 1 87 TYR H . . 3.610 2.464 2.127 4.000 0.390 11 0 "[ . 1 . 2]" 1
1102 1 90 THR HB 1 91 LEU H . . 3.670 3.555 2.401 4.377 0.707 19 3 "[ . 1 -. *+2]" 1
1103 1 94 THR H 1 94 THR HB . . 3.920 3.446 2.512 3.871 . 0 0 "[ . 1 . 2]" 1
1104 1 21 THR H 1 21 THR HB . . 4.040 2.577 2.183 3.872 . 0 0 "[ . 1 . 2]" 1
1105 1 21 THR HB 1 22 ILE H . . 4.850 3.050 2.545 3.957 . 0 0 "[ . 1 . 2]" 1
1106 1 18 TRP HA 1 19 ILE HA . . 4.910 4.721 4.648 4.820 . 0 0 "[ . 1 . 2]" 1
1107 1 57 LYS HA 1 60 MET HB2 . . 4.660 2.785 2.117 3.425 . 0 0 "[ . 1 . 2]" 1
1108 1 57 LYS HA 1 60 MET HB3 . . 4.660 4.315 3.303 5.015 0.355 19 0 "[ . 1 . 2]" 1
1109 1 57 LYS HA 1 58 ARG HA . . 4.880 4.841 4.739 4.916 0.036 7 0 "[ . 1 . 2]" 1
1110 1 87 TYR H 1 88 GLY HA2 . . 5.040 4.603 4.347 4.791 . 0 0 "[ . 1 . 2]" 1
1111 1 87 TYR H 1 88 GLY HA3 . . 5.040 5.010 4.801 5.175 0.135 12 0 "[ . 1 . 2]" 1
1112 1 12 LYS H 1 12 LYS HG3 . . 5.500 4.413 2.632 4.644 . 0 0 "[ . 1 . 2]" 1
1113 1 92 LYS HG3 1 93 VAL H . . 5.500 5.020 4.283 5.707 0.207 16 0 "[ . 1 . 2]" 1
1114 1 92 LYS HG2 1 93 VAL H . . 5.500 4.885 4.122 5.498 . 0 0 "[ . 1 . 2]" 1
1115 1 92 LYS H 1 92 LYS HG3 . . 5.500 3.246 2.437 4.244 . 0 0 "[ . 1 . 2]" 1
1116 1 92 LYS H 1 92 LYS HG2 . . 5.500 3.251 1.925 4.126 . 0 0 "[ . 1 . 2]" 1
1117 1 44 LYS H 1 44 LYS HG3 . . 5.500 3.683 3.249 4.550 . 0 0 "[ . 1 . 2]" 1
1118 1 44 LYS H 1 44 LYS HG2 . . 5.500 4.529 3.350 4.696 . 0 0 "[ . 1 . 2]" 1
1119 1 80 GLN HE22 1 91 LEU HG . . 5.500 4.821 1.840 6.096 0.596 9 3 "[ - . +1 . *2]" 1
1120 1 80 GLN HE21 1 91 LEU HG . . 5.500 4.120 2.369 5.194 . 0 0 "[ . 1 . 2]" 1
1121 1 51 LEU H 1 51 LEU HG . . 5.500 3.738 2.173 4.128 . 0 0 "[ . 1 . 2]" 1
1122 1 91 LEU H 1 91 LEU HG . . 5.500 2.367 1.995 3.526 . 0 0 "[ . 1 . 2]" 1
1123 1 91 LEU HG 1 92 LYS H . . 5.500 4.902 4.055 5.224 . 0 0 "[ . 1 . 2]" 1
1124 1 83 LEU HG 1 91 LEU QB . . 6.380 5.322 4.543 6.137 . 0 0 "[ . 1 . 2]" 1
1125 1 58 ARG QB 1 59 LEU HG . . 6.380 3.386 2.847 4.285 . 0 0 "[ . 1 . 2]" 1
1126 1 27 GLU QG 1 31 LEU HG . . 6.380 3.831 1.805 6.111 . 0 0 "[ . 1 . 2]" 1
1127 1 28 GLU HA 1 31 LEU HG . . 5.500 3.452 1.945 4.662 . 0 0 "[ . 1 . 2]" 1
1128 1 83 LEU H 1 83 LEU HG . . 5.500 4.430 2.695 4.627 . 0 0 "[ . 1 . 2]" 1
1129 1 45 ASP HA 1 46 LEU HG . . 5.500 4.969 4.075 5.944 0.444 13 0 "[ . 1 . 2]" 1
1130 1 35 LYS HA 1 35 LYS HD2 . . 5.470 3.175 2.019 4.619 . 0 0 "[ . 1 . 2]" 1
1131 1 46 LEU H 1 46 LEU HG . . 4.940 2.565 1.871 3.558 . 0 0 "[ . 1 . 2]" 1
1132 1 58 ARG H 1 58 ARG HG2 . . 5.500 4.428 3.533 4.700 . 0 0 "[ . 1 . 2]" 1
1133 1 58 ARG H 1 58 ARG HG3 . . 5.500 4.200 2.251 4.568 . 0 0 "[ . 1 . 2]" 1
1134 1 13 THR H 1 14 LEU HG . . 5.500 4.660 4.306 5.083 . 0 0 "[ . 1 . 2]" 1
1135 1 31 LEU H 1 31 LEU HG . . 5.380 2.982 2.193 4.337 . 0 0 "[ . 1 . 2]" 1
1136 1 54 LYS H 1 54 LYS HG2 . . 4.540 3.845 2.473 4.547 0.007 20 0 "[ . 1 . 2]" 1
1137 1 31 LEU HG 1 32 GLN H . . 5.500 3.787 2.611 4.611 . 0 0 "[ . 1 . 2]" 1
1138 1 9 ASN HA 1 12 LYS HD2 . . 5.500 4.847 3.460 5.421 . 0 0 "[ . 1 . 2]" 1
1139 1 54 LYS H 1 54 LYS HD3 . . 5.500 4.336 3.647 5.038 . 0 0 "[ . 1 . 2]" 1
1140 1 54 LYS H 1 54 LYS HD2 . . 5.500 4.735 3.922 6.012 0.512 20 1 "[ . 1 . +]" 1
1141 1 54 LYS HA 1 54 LYS HD2 . . 5.500 4.687 3.272 4.887 . 0 0 "[ . 1 . 2]" 1
1142 1 54 LYS HA 1 54 LYS HD3 . . 5.500 4.454 2.066 4.769 . 0 0 "[ . 1 . 2]" 1
1143 1 43 GLU HB2 1 44 LYS QD . . 5.500 4.996 4.675 5.378 . 0 0 "[ . 1 . 2]" 1
1144 1 43 GLU HB3 1 44 LYS QD . . 5.500 4.857 4.432 5.372 . 0 0 "[ . 1 . 2]" 1
1145 1 34 VAL HA 1 75 ILE HG13 . . 5.500 5.950 5.725 6.099 0.599 8 9 "[ * - + * **.* **2]" 1
1146 1 48 LYS QG 1 52 VAL HB . . 6.380 5.608 4.107 6.375 . 0 0 "[ . 1 . 2]" 1
1147 1 37 CYS HA 1 79 VAL HB . . 5.500 5.184 4.660 5.750 0.250 16 0 "[ . 1 . 2]" 1
1148 1 8 PHE QD 1 52 VAL HB . . 7.630 5.663 4.750 6.139 . 0 0 "[ . 1 . 2]" 1
1149 1 70 MET H 1 70 MET HG3 . . 5.500 2.481 2.049 3.975 . 0 0 "[ . 1 . 2]" 1
1150 1 70 MET HG2 1 71 ALA H . . 5.500 4.742 2.371 5.126 . 0 0 "[ . 1 . 2]" 1
1151 1 8 PHE QD 1 11 VAL HB . . 7.630 2.989 2.159 3.886 . 0 0 "[ . 1 . 2]" 1
1152 1 77 ASP HA 1 80 GLN HG2 . . 5.500 5.538 4.094 6.114 0.614 7 6 "[* .*+ -* .* 2]" 1
1153 1 77 ASP HA 1 80 GLN HG3 . . 5.500 4.750 4.013 6.014 0.514 15 1 "[ . 1 + 2]" 1
1154 1 80 GLN H 1 80 GLN HG2 . . 5.500 3.677 2.487 4.618 . 0 0 "[ . 1 . 2]" 1
1155 1 80 GLN H 1 80 GLN HG3 . . 5.500 2.968 2.383 4.568 . 0 0 "[ . 1 . 2]" 1
1156 1 59 LEU HG 1 62 GLN QG . . 6.380 5.082 3.784 6.147 . 0 0 "[ . 1 . 2]" 1
1157 1 60 MET HA 1 62 GLN QG . . 6.380 5.114 4.435 6.122 . 0 0 "[ . 1 . 2]" 1
1158 1 81 VAL HA 1 84 GLN QG . . 6.380 3.556 2.122 4.987 . 0 0 "[ . 1 . 2]" 1
1159 1 85 GLN H 1 85 GLN HG3 . . 4.940 2.460 2.246 2.636 . 0 0 "[ . 1 . 2]" 1
1160 1 85 GLN H 1 85 GLN HG2 . . 4.940 3.696 3.479 3.864 . 0 0 "[ . 1 . 2]" 1
1161 1 84 GLN QG 1 85 GLN H . . 6.380 3.582 2.307 4.491 . 0 0 "[ . 1 . 2]" 1
1162 1 60 MET H 1 62 GLN QG . . 6.380 4.900 4.338 6.194 . 0 0 "[ . 1 . 2]" 1
1163 1 83 LEU H 1 84 GLN QG . . 6.380 5.449 3.902 6.169 . 0 0 "[ . 1 . 2]" 1
1164 1 32 GLN H 1 32 GLN HG3 . . 5.500 3.606 2.026 4.535 . 0 0 "[ . 1 . 2]" 1
1165 1 32 GLN H 1 32 GLN HG2 . . 5.500 3.490 2.166 4.552 . 0 0 "[ . 1 . 2]" 1
1166 1 49 LEU HG 1 53 ILE HB . . 5.500 4.470 3.585 6.169 0.669 15 2 "[ . 1 + -2]" 1
1167 1 65 GLU H 1 65 GLU HG2 . . 5.500 3.138 2.264 4.427 . 0 0 "[ . 1 . 2]" 1
1168 1 65 GLU H 1 65 GLU HG3 . . 5.500 3.203 2.835 3.760 . 0 0 "[ . 1 . 2]" 1
1169 1 43 GLU H 1 43 GLU HG2 . . 4.850 3.397 2.410 4.631 . 0 0 "[ . 1 . 2]" 1
1170 1 43 GLU HA 1 43 GLU HG2 . . 4.200 3.180 2.949 3.836 . 0 0 "[ . 1 . 2]" 1
1171 1 47 GLU HG3 1 48 LYS H . . 5.500 4.569 4.180 4.930 . 0 0 "[ . 1 . 2]" 1
1172 1 47 GLU HG2 1 48 LYS H . . 5.500 3.562 2.879 4.239 . 0 0 "[ . 1 . 2]" 1
1173 1 43 GLU H 1 43 GLU HG3 . . 4.850 4.187 3.843 4.667 . 0 0 "[ . 1 . 2]" 1
1174 1 47 GLU H 1 47 GLU HG2 . . 5.470 4.472 4.373 4.569 . 0 0 "[ . 1 . 2]" 1
1175 1 47 GLU H 1 47 GLU HG3 . . 5.470 4.546 4.453 4.765 . 0 0 "[ . 1 . 2]" 1
1176 1 7 GLU H 1 7 GLU HG2 . . 5.250 3.006 1.945 4.522 . 0 0 "[ . 1 . 2]" 1
1177 1 7 GLU H 1 7 GLU HG3 . . 5.250 3.750 2.017 4.788 . 0 0 "[ . 1 . 2]" 1
1178 1 27 GLU QG 1 28 GLU H . . 6.380 3.913 2.673 4.482 . 0 0 "[ . 1 . 2]" 1
1179 1 7 GLU HG2 1 9 ASN H . . 5.500 5.374 4.305 6.056 0.556 5 3 "[ - + 1 * . 2]" 1
1180 1 7 GLU HG3 1 9 ASN H . . 5.500 5.195 4.129 6.073 0.573 7 1 "[ . + 1 . 2]" 1
1181 1 28 GLU QG 1 29 ASP H . . 6.380 4.140 2.329 4.609 . 0 0 "[ . 1 . 2]" 1
1182 1 2 LEU HA 1 36 TYR QB . . 6.380 3.432 2.485 4.526 . 0 0 "[ . 1 . 2]" 1
1183 1 9 ASN HA 1 12 LYS HE2 . . 5.500 2.909 1.866 5.349 . 0 0 "[ . 1 . 2]" 1
1184 1 48 LYS HB2 1 48 LYS HE2 . . 4.970 3.603 1.920 4.485 . 0 0 "[ . 1 . 2]" 1
1185 1 48 LYS HB3 1 48 LYS HE2 . . 4.970 3.440 2.010 4.792 . 0 0 "[ . 1 . 2]" 1
1186 1 48 LYS HB3 1 48 LYS HE3 . . 4.970 3.676 1.957 5.198 0.228 20 0 "[ . 1 . 2]" 1
1187 1 48 LYS HB2 1 48 LYS HE3 . . 4.970 4.002 2.267 5.043 0.073 9 0 "[ . 1 . 2]" 1
1188 1 48 LYS HA 1 48 LYS HE2 . . 5.500 4.381 2.356 5.514 0.014 5 0 "[ . 1 . 2]" 1
1189 1 48 LYS HA 1 48 LYS HE3 . . 5.500 4.051 2.334 5.982 0.482 3 0 "[ . 1 . 2]" 1
1190 1 7 GLU HA 1 48 LYS HE3 . . 5.500 5.122 3.676 6.140 0.640 5 5 "[ * *+ - * . 2]" 1
1191 1 7 GLU HA 1 48 LYS HE2 . . 5.500 5.264 4.180 6.208 0.708 3 4 "[ + . * * . - 2]" 1
1192 1 8 PHE QD 1 48 LYS HE3 . . 7.630 4.519 2.966 6.011 . 0 0 "[ . 1 . 2]" 1
1193 1 8 PHE QD 1 48 LYS HE2 . . 7.630 5.097 3.627 6.089 . 0 0 "[ . 1 . 2]" 1
1194 1 54 LYS H 1 54 LYS QE . . 6.380 4.783 4.085 5.565 . 0 0 "[ . 1 . 2]" 1
1195 1 57 LYS QE 1 61 GLN HE22 . . 6.380 4.771 2.241 6.123 . 0 0 "[ . 1 . 2]" 1
1196 1 57 LYS QE 1 61 GLN HE21 . . 6.380 4.346 2.409 6.128 . 0 0 "[ . 1 . 2]" 1
1197 1 41 ILE HB 1 83 LEU QB . . 6.380 5.124 4.825 6.108 . 0 0 "[ . 1 . 2]" 1
1198 1 50 ASP HA 1 91 LEU QB . . 6.160 5.239 3.899 5.945 . 0 0 "[ . 1 . 2]" 1
1199 1 80 GLN HE22 1 91 LEU QB . . 6.380 5.426 3.456 6.144 . 0 0 "[ . 1 . 2]" 1
1200 1 80 GLN HE21 1 91 LEU QB . . 6.380 4.929 1.889 6.017 . 0 0 "[ . 1 . 2]" 1
1201 1 57 LYS QE 1 72 PHE QD . . 8.510 5.329 2.374 6.160 . 0 0 "[ . 1 . 2]" 1
1202 1 16 ARG HA 1 16 ARG HD2 . . 5.500 2.711 2.097 4.609 . 0 0 "[ . 1 . 2]" 1
1203 1 55 TYR HA 1 58 ARG QD . . 6.380 4.270 2.829 5.784 . 0 0 "[ . 1 . 2]" 1
1204 1 16 ARG H 1 16 ARG HD2 . . 5.500 4.841 3.042 5.975 0.475 20 0 "[ . 1 . 2]" 1
1205 1 16 ARG H 1 16 ARG HD3 . . 5.500 4.540 2.469 5.025 . 0 0 "[ . 1 . 2]" 1
1206 1 2 LEU HA 1 36 TYR QD . . 7.630 3.325 2.184 4.887 . 0 0 "[ . 1 . 2]" 1
1207 1 80 GLN HE21 1 91 LEU HA . . 5.500 5.134 4.245 6.202 0.702 5 1 "[ + 1 . 2]" 1
1208 1 80 GLN HE22 1 91 LEU HA . . 5.500 5.574 4.101 6.133 0.633 7 8 "[ * .-+* * * *. *]" 1
1209 1 71 ALA HA 1 74 PHE QD . . 7.630 4.147 3.528 4.579 . 0 0 "[ . 1 . 2]" 1
1210 1 80 GLN HE22 1 92 LYS HA . . 5.500 3.379 2.297 4.906 . 0 0 "[ . 1 . 2]" 1
1211 1 80 GLN HE21 1 92 LYS HA . . 5.500 3.700 2.577 5.238 . 0 0 "[ . 1 . 2]" 1
1212 1 43 GLU HA 1 44 LYS HG2 . . 5.500 5.551 3.145 6.062 0.562 8 2 "[ . + 1 . - 2]" 1
1213 1 43 GLU HA 1 44 LYS HG3 . . 5.500 5.520 4.877 6.136 0.636 19 2 "[ - . 1 . +2]" 1
1214 1 43 GLU HA 1 43 GLU HG3 . . 4.200 3.354 2.486 3.853 . 0 0 "[ . 1 . 2]" 1
1215 1 9 ASN HA 1 12 LYS HG2 . . 5.500 4.802 2.528 5.589 0.089 1 0 "[ . 1 . 2]" 1
1216 1 9 ASN HA 1 12 LYS HG3 . . 5.500 4.955 3.628 5.736 0.236 3 0 "[ . 1 . 2]" 1
1217 1 9 ASN HA 1 12 LYS HD3 . . 5.500 4.270 3.025 5.638 0.138 1 0 "[ . 1 . 2]" 1
1218 1 9 ASN HA 1 12 LYS HE3 . . 5.500 3.518 2.096 4.893 . 0 0 "[ . 1 . 2]" 1
1219 1 59 LEU HA 1 62 GLN QG . . 6.380 2.553 1.886 3.776 . 0 0 "[ . 1 . 2]" 1
1220 1 78 ASN HA 1 78 ASN HD22 . . 5.500 4.184 3.614 4.764 . 0 0 "[ . 1 . 2]" 1
1221 1 69 ASN HA 1 69 ASN HD22 . . 5.500 4.049 3.625 4.468 . 0 0 "[ . 1 . 2]" 1
1222 1 69 ASN HA 1 72 PHE QD . . 7.630 3.637 1.802 4.579 . 0 0 "[ . 1 . 2]" 1
1223 1 72 PHE QD 1 73 ASP HA . . 7.630 3.569 2.969 4.443 . 0 0 "[ . 1 . 2]" 1
1224 1 49 LEU HG 1 50 ASP HA . . 5.310 4.256 3.192 6.075 0.765 10 3 "[ . + . *-]" 1
1225 1 51 LEU HA 1 54 LYS QE . . 6.380 4.526 3.060 5.874 . 0 0 "[ . 1 . 2]" 1
1226 1 62 GLN QG 1 63 SER HA . . 6.380 3.983 3.533 6.009 . 0 0 "[ . 1 . 2]" 1
1227 1 35 LYS HA 1 35 LYS HD3 . . 5.470 3.108 1.881 4.677 . 0 0 "[ . 1 . 2]" 1
1228 1 57 LYS QD 1 58 ARG HA . . 6.380 2.783 2.195 6.273 . 0 0 "[ . 1 . 2]" 1
1229 1 58 ARG HA 1 62 GLN QG . . 6.380 5.247 3.875 6.280 . 0 0 "[ . 1 . 2]" 1
1230 1 58 ARG HA 1 61 GLN QG . . 6.380 4.249 2.341 5.306 . 0 0 "[ . 1 . 2]" 1
1231 1 18 TRP HA 1 68 TRP HZ2 . . 5.500 4.770 4.490 5.316 . 0 0 "[ . 1 . 2]" 1
1232 1 41 ILE HB 1 83 LEU HA . . 5.500 4.497 4.146 4.892 . 0 0 "[ . 1 . 2]" 1
1233 1 83 LEU HA 1 87 TYR QD . . 7.630 4.490 2.463 5.315 . 0 0 "[ . 1 . 2]" 1
1234 1 46 LEU HG 1 47 GLU HA . . 5.500 5.000 3.972 5.864 0.364 18 0 "[ . 1 . 2]" 1
1235 1 8 PHE QD 1 48 LYS HA . . 7.630 4.769 4.067 5.524 . 0 0 "[ . 1 . 2]" 1
1236 1 42 GLU HA 1 44 LYS QZ . . 6.480 3.681 2.452 5.589 . 0 0 "[ . 1 . 2]" 1
1237 1 17 GLU HA 1 20 THR HG1 . . 5.340 2.490 1.871 3.664 . 0 0 "[ . 1 . 2]" 1
1238 1 16 ARG QG 1 17 GLU HA . . 6.380 4.100 3.516 5.890 . 0 0 "[ . 1 . 2]" 1
1239 1 16 ARG HA 1 16 ARG HD3 . . 5.500 3.172 2.403 4.616 . 0 0 "[ . 1 . 2]" 1
1240 1 68 TRP HA 1 68 TRP HZ3 . . 5.070 4.648 4.311 5.024 . 0 0 "[ . 1 . 2]" 1
1241 1 16 ARG HA 1 55 TYR QE . . 7.630 3.688 2.772 6.103 . 0 0 "[ . 1 . 2]" 1
1242 1 12 LYS HA 1 15 LEU HG . . 5.500 3.722 2.911 4.337 . 0 0 "[ . 1 . 2]" 1
1243 1 12 LYS HA 1 55 TYR QE . . 7.630 3.534 2.544 4.494 . 0 0 "[ . 1 . 2]" 1
1244 1 12 LYS HA 1 55 TYR QD . . 7.630 3.483 2.720 4.174 . 0 0 "[ . 1 . 2]" 1
1245 1 8 PHE QD 1 12 LYS HA . . 7.630 5.311 4.913 5.888 . 0 0 "[ . 1 . 2]" 1
1246 1 55 TYR QD 1 56 MET HA . . 7.630 4.353 3.565 5.853 . 0 0 "[ . 1 . 2]" 1
1247 1 83 LEU QB 1 90 THR HA . . 6.380 3.186 2.023 3.679 . 0 0 "[ . 1 . 2]" 1
1248 1 74 PHE HA 1 78 ASN HD22 . . 5.500 3.953 3.471 4.391 . 0 0 "[ . 1 . 2]" 1
1249 1 74 PHE HA 1 78 ASN HD21 . . 5.500 3.760 2.896 5.310 . 0 0 "[ . 1 . 2]" 1
1250 1 35 LYS QG 1 36 TYR HA . . 6.380 4.649 3.479 5.923 . 0 0 "[ . 1 . 2]" 1
1251 1 18 TRP HZ2 1 25 PRO HA . . 5.500 5.263 4.083 6.115 0.615 20 5 "[ *-* 1 . * +]" 1
1252 1 54 LYS HG3 1 93 VAL HA . . 5.500 4.641 3.450 5.882 0.382 2 0 "[ . 1 . 2]" 1
1253 1 54 LYS HG2 1 93 VAL HA . . 5.500 4.123 2.723 6.095 0.595 20 1 "[ . 1 . +]" 1
1254 1 55 TYR HA 1 57 LYS QD . . 6.380 5.812 4.983 6.252 . 0 0 "[ . 1 . 2]" 1
1255 1 55 TYR HA 1 59 LEU HG . . 5.500 4.509 3.787 6.209 0.709 6 1 "[ .+ 1 . 2]" 1
1256 1 1 ASN HB3 1 6 VAL HA . . 5.500 4.431 2.875 6.053 0.553 5 2 "[ +- 1 . 2]" 1
1257 1 1 ASN HB2 1 6 VAL HA . . 5.500 4.338 2.722 5.900 0.400 18 0 "[ . 1 . 2]" 1
1258 1 57 LYS QE 1 94 THR HA . . 6.380 4.882 3.414 6.019 . 0 0 "[ . 1 . 2]" 1
1259 1 62 GLN QG 1 63 SER QB . . 7.260 4.113 3.183 6.013 . 0 0 "[ . 1 . 2]" 1
1260 1 63 SER QB 1 68 TRP HD1 . . 6.380 4.004 3.143 4.893 . 0 0 "[ . 1 . 2]" 1
1261 1 67 VAL HA 1 70 MET HG3 . . 5.500 2.980 2.375 4.094 . 0 0 "[ . 1 . 2]" 1
1262 1 67 VAL HA 1 70 MET HG2 . . 5.500 4.109 2.396 5.203 . 0 0 "[ . 1 . 2]" 1
1263 1 86 THR HA 1 87 TYR QD . . 7.630 5.777 4.890 6.281 . 0 0 "[ . 1 . 2]" 1
1264 1 74 PHE QD 1 75 ILE HA . . 7.630 3.322 2.999 3.882 . 0 0 "[ . 1 . 2]" 1
1265 1 41 ILE HA 1 87 TYR QE . . 7.630 4.980 2.640 6.103 . 0 0 "[ . 1 . 2]" 1
1266 1 82 VAL HA 1 85 GLN HG2 . . 5.500 5.012 4.395 5.577 0.077 16 0 "[ . 1 . 2]" 1
1267 1 82 VAL HA 1 85 GLN HG3 . . 5.500 3.752 3.146 4.247 . 0 0 "[ . 1 . 2]" 1
1268 1 13 THR HA 1 16 ARG QG . . 6.380 4.851 3.533 6.105 . 0 0 "[ . 1 . 2]" 1
1269 1 18 TRP HH2 1 30 ILE HA . . 5.310 2.803 2.291 3.486 . 0 0 "[ . 1 . 2]" 1
1270 1 18 TRP HZ2 1 30 ILE HA . . 5.500 2.910 2.174 3.481 . 0 0 "[ . 1 . 2]" 1
1271 1 8 PHE QE 1 52 VAL HA . . 7.630 2.956 2.170 3.818 . 0 0 "[ . 1 . 2]" 1
1272 1 52 VAL HA 1 55 TYR QD . . 7.630 4.766 3.616 5.273 . 0 0 "[ . 1 . 2]" 1
1273 1 11 VAL HA 1 14 LEU HG . . 5.500 3.866 2.697 5.158 . 0 0 "[ . 1 . 2]" 1
1274 1 33 VAL HA 1 36 TYR QD . . 7.630 2.881 1.841 4.226 . 0 0 "[ . 1 . 2]" 1
1275 1 34 VAL HA 1 75 ILE HG12 . . 5.500 4.365 4.049 4.549 . 0 0 "[ . 1 . 2]" 1
1276 1 34 VAL HA 1 37 CYS HG . . 5.500 3.456 2.401 4.170 . 0 0 "[ . 1 . 2]" 1
1277 1 86 THR HB 1 87 TYR QD . . 7.630 4.206 2.350 6.115 . 0 0 "[ . 1 . 2]" 1
1278 1 80 GLN HE22 1 90 THR HB . . 5.500 4.462 2.438 6.086 0.586 9 1 "[ . +1 . 2]" 1
1279 1 80 GLN HE21 1 90 THR HB . . 5.500 3.891 1.774 5.669 0.169 19 0 "[ . 1 . 2]" 1
1280 1 90 THR HB 1 91 LEU HG . . 5.500 5.460 4.106 6.162 0.662 9 6 "[ - . +1 * *. **2]" 1
1281 1 19 ILE HA 1 68 TRP HZ2 . . 5.500 3.494 2.588 4.003 . 0 0 "[ . 1 . 2]" 1
1282 1 57 LYS HA 1 72 PHE QD . . 7.630 2.597 1.977 3.709 . 0 0 "[ . 1 . 2]" 1
1283 1 53 ILE MD 1 75 ILE HB . . 6.520 4.331 3.741 5.800 . 0 0 "[ . 1 . 2]" 1
1284 1 53 ILE MD 1 56 MET ME . . 5.430 2.744 2.096 3.901 . 0 0 "[ . 1 . 2]" 1
1285 1 37 CYS HG 1 53 ILE MD . . 6.520 3.237 2.677 4.148 . 0 0 "[ . 1 . 2]" 1
1286 1 34 VAL HA 1 53 ILE MD . . 6.520 4.773 4.265 5.257 . 0 0 "[ . 1 . 2]" 1
1287 1 37 CYS HA 1 53 ILE MD . . 6.520 4.434 3.149 5.172 . 0 0 "[ . 1 . 2]" 1
1288 1 49 LEU HA 1 53 ILE MD . . 6.520 4.488 3.126 4.928 . 0 0 "[ . 1 . 2]" 1
1289 1 50 ASP HA 1 53 ILE MD . . 6.520 5.556 3.887 6.164 . 0 0 "[ . 1 . 2]" 1
1290 1 53 ILE MD 1 56 MET H . . 6.520 5.229 4.566 6.455 . 0 0 "[ . 1 . 2]" 1
1291 1 52 VAL H 1 53 ILE MD . . 6.520 5.544 4.227 5.990 . 0 0 "[ . 1 . 2]" 1
1292 1 21 THR HB 1 22 ILE MD . . 6.520 3.413 2.470 5.447 . 0 0 "[ . 1 . 2]" 1
1293 1 18 TRP HD1 1 22 ILE MD . . 6.520 3.314 1.792 3.975 . 0 0 "[ . 1 . 2]" 1
1294 1 22 ILE MD 1 24 ASP H . . 6.520 5.236 4.842 6.025 . 0 0 "[ . 1 . 2]" 1
1295 1 18 TRP HE1 1 22 ILE MD . . 6.520 5.055 3.602 5.728 . 0 0 "[ . 1 . 2]" 1
1296 1 25 PRO HD2 1 30 ILE MD . . 6.520 4.885 4.028 6.038 . 0 0 "[ . 1 . 2]" 1
1297 1 30 ILE MD 1 60 MET ME . . 7.540 4.327 2.578 5.335 . 0 0 "[ . 1 . 2]" 1
1298 1 25 PRO HD3 1 30 ILE MD . . 6.520 5.167 4.610 5.910 . 0 0 "[ . 1 . 2]" 1
1299 1 27 GLU HA 1 30 ILE MD . . 5.710 2.865 1.930 4.351 . 0 0 "[ . 1 . 2]" 1
1300 1 26 MET HA 1 30 ILE MD . . 6.520 4.800 3.993 6.119 . 0 0 "[ . 1 . 2]" 1
1301 1 18 TRP HH2 1 30 ILE MD . . 6.520 4.026 1.965 5.036 . 0 0 "[ . 1 . 2]" 1
1302 1 29 ASP H 1 30 ILE MD . . 6.520 5.074 4.815 5.423 . 0 0 "[ . 1 . 2]" 1
1303 1 19 ILE MD 1 75 ILE MD . . 7.540 4.888 4.562 5.417 . 0 0 "[ . 1 . 2]" 1
1304 1 30 ILE MD 1 75 ILE MD . . 7.540 3.690 2.207 4.435 . 0 0 "[ . 1 . 2]" 1
1305 1 33 VAL QG 1 75 ILE MD . . 6.550 2.056 1.854 2.455 . 0 0 "[ . 1 . 2]" 1
1306 1 71 ALA MB 1 75 ILE MD . . 7.540 2.714 2.321 3.209 . 0 0 "[ . 1 . 2]" 1
1307 1 33 VAL HB 1 75 ILE MD . . 6.330 3.823 3.389 5.132 . 0 0 "[ . 1 . 2]" 1
1308 1 37 CYS HG 1 75 ILE MD . . 6.520 5.241 4.366 6.047 . 0 0 "[ . 1 . 2]" 1
1309 1 72 PHE HB2 1 75 ILE MD . . 6.520 4.891 3.576 5.550 . 0 0 "[ . 1 . 2]" 1
1310 1 56 MET QG 1 75 ILE MD . . 7.400 3.343 2.908 4.148 . 0 0 "[ . 1 . 2]" 1
1311 1 72 PHE HB3 1 75 ILE MD . . 6.520 5.606 4.305 6.073 . 0 0 "[ . 1 . 2]" 1
1312 1 56 MET HA 1 75 ILE MD . . 6.520 5.729 5.289 6.047 . 0 0 "[ . 1 . 2]" 1
1313 1 30 ILE HA 1 75 ILE MD . . 6.520 3.128 2.645 3.487 . 0 0 "[ . 1 . 2]" 1
1314 1 18 TRP HH2 1 75 ILE MD . . 6.520 2.586 2.038 3.350 . 0 0 "[ . 1 . 2]" 1
1315 1 68 TRP HZ3 1 75 ILE MD . . 6.520 4.734 3.915 5.679 . 0 0 "[ . 1 . 2]" 1
1316 1 33 VAL H 1 75 ILE MD . . 6.520 5.058 4.918 5.360 . 0 0 "[ . 1 . 2]" 1
1317 1 71 ALA H 1 75 ILE MD . . 6.520 5.425 5.160 5.691 . 0 0 "[ . 1 . 2]" 1
1318 1 72 PHE H 1 75 ILE MD . . 6.520 4.343 3.649 4.700 . 0 0 "[ . 1 . 2]" 1
1319 1 75 ILE H 1 75 ILE MD . . 5.250 3.510 3.404 3.625 . 0 0 "[ . 1 . 2]" 1
1320 1 75 ILE MD 1 76 LEU H . . 6.270 4.481 4.241 4.577 . 0 0 "[ . 1 . 2]" 1
1321 1 38 THR MG 1 41 ILE MD . . 7.540 2.929 2.466 3.219 . 0 0 "[ . 1 . 2]" 1
1322 1 41 ILE MD 1 49 LEU HG . . 6.520 4.631 3.304 5.304 . 0 0 "[ . 1 . 2]" 1
1323 1 41 ILE MD 1 79 VAL HA . . 5.810 2.919 2.529 3.357 . 0 0 "[ . 1 . 2]" 1
1324 1 37 CYS HA 1 41 ILE MD . . 6.460 4.836 4.422 5.229 . 0 0 "[ . 1 . 2]" 1
1325 1 38 THR HA 1 41 ILE MD . . 5.560 1.862 1.776 2.053 . 0 0 "[ . 1 . 2]" 1
1326 1 41 ILE MD 1 83 LEU HA . . 6.520 2.511 2.070 2.963 . 0 0 "[ . 1 . 2]" 1
1327 1 38 THR HB 1 41 ILE MD . . 6.520 3.655 3.239 3.944 . 0 0 "[ . 1 . 2]" 1
1328 1 41 ILE MD 1 82 VAL H . . 6.520 3.969 3.652 4.463 . 0 0 "[ . 1 . 2]" 1
1329 1 41 ILE H 1 41 ILE MD . . 5.340 3.466 3.385 3.558 . 0 0 "[ . 1 . 2]" 1
1330 1 37 CYS H 1 41 ILE MD . . 6.520 6.022 5.776 6.113 . 0 0 "[ . 1 . 2]" 1
1331 1 41 ILE MD 1 42 GLU H . . 6.520 4.471 4.288 4.720 . 0 0 "[ . 1 . 2]" 1
1332 1 15 LEU HG 1 19 ILE MD . . 6.520 5.217 4.722 5.688 . 0 0 "[ . 1 . 2]" 1
1333 1 19 ILE MD 1 60 MET HG3 . . 6.520 2.499 1.911 4.360 . 0 0 "[ . 1 . 2]" 1
1334 1 19 ILE MD 1 56 MET QG . . 7.400 3.153 1.858 4.440 . 0 0 "[ . 1 . 2]" 1
1335 1 19 ILE MD 1 56 MET HA . . 6.120 2.168 1.747 2.484 . 0 0 "[ . 1 . 2]" 1
1336 1 15 LEU HA 1 19 ILE MD . . 6.520 3.648 3.196 4.071 . 0 0 "[ . 1 . 2]" 1
1337 1 18 TRP HH2 1 19 ILE MD . . 6.520 5.199 4.142 5.883 . 0 0 "[ . 1 . 2]" 1
1338 1 19 ILE MD 1 59 LEU H . . 6.520 3.667 3.284 4.041 . 0 0 "[ . 1 . 2]" 1
1339 1 19 ILE MD 1 68 TRP HZ3 . . 6.520 4.493 3.606 5.163 . 0 0 "[ . 1 . 2]" 1
1340 1 19 ILE MD 1 68 TRP HH2 . . 6.520 5.701 4.643 6.083 . 0 0 "[ . 1 . 2]" 1
1341 1 16 ARG H 1 19 ILE MD . . 6.520 4.955 4.670 5.216 . 0 0 "[ . 1 . 2]" 1
1342 1 19 ILE MD 1 60 MET H . . 6.490 3.015 2.657 3.302 . 0 0 "[ . 1 . 2]" 1
1343 1 16 ARG QG 1 19 ILE MG . . 7.400 6.211 5.738 6.392 . 0 0 "[ . 1 . 2]" 1
1344 1 19 ILE MG 1 60 MET ME . . 7.480 3.662 3.260 4.250 . 0 0 "[ . 1 . 2]" 1
1345 1 19 ILE MG 1 60 MET HG3 . . 6.520 2.926 2.335 4.004 . 0 0 "[ . 1 . 2]" 1
1346 1 19 ILE MG 1 56 MET HA . . 6.520 4.675 3.919 5.076 . 0 0 "[ . 1 . 2]" 1
1347 1 19 ILE MG 1 59 LEU HA . . 6.520 3.772 3.516 4.059 . 0 0 "[ . 1 . 2]" 1
1348 1 19 ILE MG 1 20 THR HA . . 6.520 3.537 3.081 4.083 . 0 0 "[ . 1 . 2]" 1
1349 1 19 ILE MG 1 20 THR HB . . 6.520 5.205 4.741 5.720 . 0 0 "[ . 1 . 2]" 1
1350 1 19 ILE MG 1 68 TRP HZ2 . . 6.520 5.089 3.914 5.452 . 0 0 "[ . 1 . 2]" 1
1351 1 19 ILE MG 1 68 TRP HZ3 . . 6.520 4.689 4.037 5.559 . 0 0 "[ . 1 . 2]" 1
1352 1 19 ILE MG 1 60 MET H . . 6.520 3.195 2.765 3.743 . 0 0 "[ . 1 . 2]" 1
1353 1 56 MET ME 1 75 ILE MG . . 7.200 2.481 1.902 2.868 . 0 0 "[ . 1 . 2]" 1
1354 1 33 VAL HB 1 75 ILE MG . . 6.490 3.662 2.706 5.585 . 0 0 "[ . 1 . 2]" 1
1355 1 37 CYS HG 1 75 ILE MG . . 6.520 3.444 2.485 4.522 . 0 0 "[ . 1 . 2]" 1
1356 1 34 VAL HA 1 75 ILE MG . . 5.030 2.783 2.527 3.005 . 0 0 "[ . 1 . 2]" 1
1357 1 75 ILE MG 1 76 LEU HA . . 6.520 3.466 3.258 3.674 . 0 0 "[ . 1 . 2]" 1
1358 1 74 PHE QD 1 75 ILE MG . . 8.650 4.597 4.347 4.983 . 0 0 "[ . 1 . 2]" 1
1359 1 75 ILE MG 1 78 ASN H . . 6.520 5.061 4.763 5.363 . 0 0 "[ . 1 . 2]" 1
1360 1 33 VAL H 1 75 ILE MG . . 6.520 5.482 4.912 5.875 . 0 0 "[ . 1 . 2]" 1
1361 1 37 CYS H 1 75 ILE MG . . 6.520 5.158 4.851 5.415 . 0 0 "[ . 1 . 2]" 1
1362 1 75 ILE MG 1 79 VAL H . . 6.520 4.224 3.982 4.523 . 0 0 "[ . 1 . 2]" 1
1363 1 34 VAL H 1 75 ILE MG . . 6.520 3.930 3.443 4.307 . 0 0 "[ . 1 . 2]" 1
1364 1 36 TYR QD 1 56 MET ME . . 8.650 5.221 4.091 5.996 . 0 0 "[ . 1 . 2]" 1
1365 1 37 CYS H 1 56 MET ME . . 6.520 5.483 4.953 5.998 . 0 0 "[ . 1 . 2]" 1
1366 1 55 TYR H 1 56 MET ME . . 6.520 5.289 4.797 5.738 . 0 0 "[ . 1 . 2]" 1
1367 1 56 MET H 1 56 MET ME . . 5.400 3.801 3.362 4.014 . 0 0 "[ . 1 . 2]" 1
1368 1 52 VAL H 1 56 MET ME . . 6.520 5.815 5.380 6.125 . 0 0 "[ . 1 . 2]" 1
1369 1 67 VAL H 1 70 MET ME . . 6.520 4.751 3.647 6.095 . 0 0 "[ . 1 . 2]" 1
1370 1 70 MET ME 1 71 ALA H . . 6.520 5.344 4.250 6.036 . 0 0 "[ . 1 . 2]" 1
1371 1 70 MET H 1 70 MET ME . . 6.520 4.211 3.472 4.728 . 0 0 "[ . 1 . 2]" 1
1372 1 67 VAL HA 1 70 MET ME . . 5.430 3.052 1.903 4.096 . 0 0 "[ . 1 . 2]" 1
1373 1 25 PRO HA 1 26 MET ME . . 6.520 4.678 3.536 6.113 . 0 0 "[ . 1 . 2]" 1
1374 1 26 MET ME 1 27 GLU H . . 6.520 5.739 5.060 6.219 . 0 0 "[ . 1 . 2]" 1
1375 1 26 MET H 1 26 MET ME . . 6.520 3.542 2.394 4.958 . 0 0 "[ . 1 . 2]" 1
1376 1 26 MET ME 1 28 GLU H . . 6.520 5.176 3.603 5.907 . 0 0 "[ . 1 . 2]" 1
1377 1 60 MET H 1 60 MET ME . . 6.520 4.672 4.099 4.974 . 0 0 "[ . 1 . 2]" 1
1378 1 60 MET ME 1 72 PHE H . . 6.520 3.894 3.288 4.422 . 0 0 "[ . 1 . 2]" 1
1379 1 60 MET ME 1 71 ALA H . . 6.520 4.855 4.264 5.419 . 0 0 "[ . 1 . 2]" 1
1380 1 60 MET ME 1 68 TRP HH2 . . 6.210 4.864 4.174 6.156 . 0 0 "[ . 1 . 2]" 1
1381 1 60 MET ME 1 68 TRP HZ3 . . 4.880 2.889 2.144 4.120 . 0 0 "[ . 1 . 2]" 1
1382 1 18 TRP HH2 1 60 MET ME . . 4.780 3.092 2.462 3.585 . 0 0 "[ . 1 . 2]" 1
1383 1 60 MET ME 1 68 TRP HA . . 6.520 3.395 2.797 4.768 . 0 0 "[ . 1 . 2]" 1
1384 1 60 MET ME 1 72 PHE HA . . 6.330 3.658 2.275 4.300 . 0 0 "[ . 1 . 2]" 1
1385 1 56 MET HA 1 60 MET ME . . 5.430 3.848 2.825 4.746 . 0 0 "[ . 1 . 2]" 1
1386 1 56 MET QG 1 60 MET ME . . 7.400 2.713 1.792 4.037 . 0 0 "[ . 1 . 2]" 1
1387 1 60 MET ME 1 71 ALA MB . . 7.540 2.587 2.090 3.365 . 0 0 "[ . 1 . 2]" 1
1388 1 60 MET ME 1 75 ILE MD . . 6.360 2.136 1.786 2.781 . 0 0 "[ . 1 . 2]" 1
1389 1 19 ILE MD 1 60 MET ME . . 6.270 2.502 1.982 2.970 . 0 0 "[ . 1 . 2]" 1
1390 1 30 ILE MD 1 71 ALA MB . . 7.540 2.488 1.855 3.249 . 0 0 "[ . 1 . 2]" 1
1391 1 30 ILE MG 1 71 ALA MB . . 7.540 2.896 2.144 3.873 . 0 0 "[ . 1 . 2]" 1
1392 1 68 TRP HA 1 71 ALA MB . . 5.530 2.325 1.961 2.876 . 0 0 "[ . 1 . 2]" 1
1393 1 18 TRP HH2 1 71 ALA MB . . 6.520 4.174 3.569 4.803 . 0 0 "[ . 1 . 2]" 1
1394 1 68 TRP HZ3 1 71 ALA MB . . 6.300 4.080 3.516 4.707 . 0 0 "[ . 1 . 2]" 1
1395 1 68 TRP H 1 71 ALA MB . . 6.520 4.474 4.136 4.782 . 0 0 "[ . 1 . 2]" 1
1396 1 53 ILE MG 1 54 LYS H . . 6.080 3.335 2.898 3.679 . 0 0 "[ . 1 . 2]" 1
1397 1 50 ASP HA 1 53 ILE MG . . 6.520 4.408 3.670 4.708 . 0 0 "[ . 1 . 2]" 1
1398 1 53 ILE MG 1 54 LYS HA . . 6.520 3.286 2.993 3.683 . 0 0 "[ . 1 . 2]" 1
1399 1 53 ILE MG 1 76 LEU HA . . 6.520 3.794 3.044 4.547 . 0 0 "[ . 1 . 2]" 1
1400 1 53 ILE MG 1 57 LYS QE . . 7.400 5.463 3.817 6.218 . 0 0 "[ . 1 . 2]" 1
1401 1 50 ASP QB 1 53 ILE MG . . 7.400 5.871 5.154 6.135 . 0 0 "[ . 1 . 2]" 1
1402 1 53 ILE MG 1 57 LYS HA . . 6.520 4.922 4.407 5.342 . 0 0 "[ . 1 . 2]" 1
1403 1 53 ILE MG 1 56 MET ME . . 7.540 4.370 2.937 5.179 . 0 0 "[ . 1 . 2]" 1
1404 1 53 ILE MG 1 54 LYS HB3 . . 6.520 5.236 4.763 5.802 . 0 0 "[ . 1 . 2]" 1
1405 1 53 ILE MG 1 54 LYS HB2 . . 6.520 4.833 4.059 5.509 . 0 0 "[ . 1 . 2]" 1
1406 1 41 ILE MG 1 46 LEU HG . . 6.520 5.749 4.374 6.253 . 0 0 "[ . 1 . 2]" 1
1407 1 41 ILE MG 1 83 LEU QB . . 7.400 3.342 3.058 3.783 . 0 0 "[ . 1 . 2]" 1
1408 1 41 ILE MG 1 87 TYR QE . . 8.400 4.168 1.791 5.373 . 0 0 "[ . 1 . 2]" 1
1409 1 41 ILE MG 1 87 TYR QD . . 8.650 3.129 2.016 3.820 . 0 0 "[ . 1 . 2]" 1
1410 1 41 ILE MG 1 43 GLU H . . 6.520 4.942 4.741 5.340 . 0 0 "[ . 1 . 2]" 1
1411 1 41 ILE MG 1 42 GLU H . . 5.810 3.479 3.185 3.857 . 0 0 "[ . 1 . 2]" 1
1412 1 41 ILE MG 1 83 LEU H . . 6.520 3.830 3.515 4.379 . 0 0 "[ . 1 . 2]" 1
1413 1 22 ILE MG 1 68 TRP HE1 . . 6.520 4.842 4.049 5.591 . 0 0 "[ . 1 . 2]" 1
1414 1 22 ILE MG 1 23 SER H . . 5.960 2.917 2.494 3.784 . 0 0 "[ . 1 . 2]" 1
1415 1 22 ILE MG 1 68 TRP HZ2 . . 6.180 3.145 2.038 3.946 . 0 0 "[ . 1 . 2]" 1
1416 1 21 THR H 1 22 ILE MG . . 6.520 5.778 5.533 6.009 . 0 0 "[ . 1 . 2]" 1
1417 1 18 TRP HD1 1 22 ILE MG . . 6.520 3.706 2.843 4.495 . 0 0 "[ . 1 . 2]" 1
1418 1 22 ILE MG 1 25 PRO HA . . 5.740 2.714 2.017 3.710 . 0 0 "[ . 1 . 2]" 1
1419 1 22 ILE MG 1 25 PRO HG3 . . 6.520 4.987 3.881 6.086 . 0 0 "[ . 1 . 2]" 1
1420 1 22 ILE MG 1 25 PRO HG2 . . 6.520 5.415 4.730 6.155 . 0 0 "[ . 1 . 2]" 1
1421 1 30 ILE MG 1 33 VAL HB . . 6.520 5.848 5.432 6.130 . 0 0 "[ . 1 . 2]" 1
1422 1 30 ILE MG 1 74 PHE HB2 . . 6.520 4.703 4.067 5.277 . 0 0 "[ . 1 . 2]" 1
1423 1 30 ILE MG 1 74 PHE HB3 . . 6.520 3.682 3.054 4.297 . 0 0 "[ . 1 . 2]" 1
1424 1 27 GLU HA 1 30 ILE MG . . 6.520 3.960 3.512 4.794 . 0 0 "[ . 1 . 2]" 1
1425 1 30 ILE MG 1 74 PHE QD . . 8.180 2.592 2.187 3.331 . 0 0 "[ . 1 . 2]" 1
1426 1 30 ILE MG 1 32 GLN H . . 6.520 5.128 4.849 5.393 . 0 0 "[ . 1 . 2]" 1
1427 1 30 ILE MG 1 34 VAL H . . 6.430 4.344 4.057 4.532 . 0 0 "[ . 1 . 2]" 1
1428 1 30 ILE MG 1 75 ILE H . . 5.740 4.400 3.874 4.861 . 0 0 "[ . 1 . 2]" 1
1429 1 2 LEU HG 1 3 ALA MB . . 6.360 4.745 2.199 5.985 . 0 0 "[ . 1 . 2]" 1
1430 1 2 LEU QD 1 3 ALA MB . . 7.540 3.068 2.062 4.182 . 0 0 "[ . 1 . 2]" 1
1431 1 5 ALA MB 1 10 ASP HB2 . . 6.210 3.244 2.273 4.660 . 0 0 "[ . 1 . 2]" 1
1432 1 1 ASN HA 1 5 ALA MB . . 6.520 5.523 4.647 6.288 . 0 0 "[ . 1 . 2]" 1
1433 1 5 ALA MB 1 6 VAL H . . 5.620 2.629 1.990 3.449 . 0 0 "[ . 1 . 2]" 1
1434 1 5 ALA MB 1 7 GLU H . . 6.520 2.623 1.988 3.248 . 0 0 "[ . 1 . 2]" 1
1435 1 8 PHE HA 1 11 VAL MG1 . . 6.520 3.555 3.154 4.157 . 0 0 "[ . 1 . 2]" 1
1436 1 11 VAL MG1 1 36 TYR QE . . 8.650 5.031 2.076 6.218 . 0 0 "[ . 1 . 2]" 1
1437 1 11 VAL MG1 1 36 TYR QD . . 8.650 4.881 3.092 5.687 . 0 0 "[ . 1 . 2]" 1
1438 1 64 VAL MG1 1 65 GLU H . . 6.210 3.122 2.175 4.204 . 0 0 "[ . 1 . 2]" 1
1439 1 2 LEU H 1 11 VAL MG1 . . 6.520 5.419 4.531 6.217 . 0 0 "[ . 1 . 2]" 1
1440 1 93 VAL MG2 1 94 THR H . . 6.520 3.907 3.525 4.454 . 0 0 "[ . 1 . 2]" 1
1441 1 67 VAL MG2 1 68 TRP H . . 6.520 3.335 2.413 4.047 . 0 0 "[ . 1 . 2]" 1
1442 1 25 PRO HD3 1 67 VAL MG2 . . 6.520 3.604 2.653 4.977 . 0 0 "[ . 1 . 2]" 1
1443 1 67 VAL MG2 1 70 MET QB . . 7.400 4.618 4.192 5.809 . 0 0 "[ . 1 . 2]" 1
1444 1 67 VAL MG2 1 71 ALA MB . . 7.540 4.797 3.567 5.851 . 0 0 "[ . 1 . 2]" 1
1445 1 25 PRO QB 1 67 VAL MG2 . . 7.400 4.712 3.649 6.028 . 0 0 "[ . 1 . 2]" 1
1446 1 25 PRO HG3 1 67 VAL MG2 . . 6.520 3.659 2.061 5.354 . 0 0 "[ . 1 . 2]" 1
1447 1 25 PRO HG2 1 67 VAL MG1 . . 6.520 3.441 2.164 5.023 . 0 0 "[ . 1 . 2]" 1
1448 1 25 PRO HG3 1 67 VAL MG1 . . 6.520 4.093 2.705 5.796 . 0 0 "[ . 1 . 2]" 1
1449 1 25 PRO HD2 1 67 VAL MG1 . . 6.520 3.580 2.141 4.751 . 0 0 "[ . 1 . 2]" 1
1450 1 67 VAL MG1 1 70 MET QB . . 7.400 3.471 2.613 4.937 . 0 0 "[ . 1 . 2]" 1
1451 1 67 VAL MG1 1 71 ALA MB . . 7.540 4.135 2.717 5.683 . 0 0 "[ . 1 . 2]" 1
1452 1 25 PRO QB 1 67 VAL MG1 . . 7.400 4.776 3.026 6.218 . 0 0 "[ . 1 . 2]" 1
1453 1 67 VAL MG1 1 68 TRP H . . 6.520 4.017 3.783 4.349 . 0 0 "[ . 1 . 2]" 1
1454 1 86 THR MG 1 87 TYR QD . . 8.650 3.365 2.583 4.268 . 0 0 "[ . 1 . 2]" 1
1455 1 86 THR MG 1 87 TYR QE . . 8.650 4.687 2.762 5.887 . 0 0 "[ . 1 . 2]" 1
1456 1 83 LEU HA 1 86 THR MG . . 4.630 4.224 2.699 4.579 . 0 0 "[ . 1 . 2]" 1
1457 1 42 GLU QB 1 86 THR MG . . 7.400 3.767 2.333 5.304 . 0 0 "[ . 1 . 2]" 1
1458 1 41 ILE HB 1 86 THR MG . . 6.520 3.862 3.191 4.678 . 0 0 "[ . 1 . 2]" 1
1459 1 41 ILE MG 1 86 THR MG . . 7.380 2.159 1.876 2.803 . 0 0 "[ . 1 . 2]" 1
1460 1 78 ASN HA 1 81 VAL MG1 . . 6.490 3.914 3.657 4.193 . 0 0 "[ . 1 . 2]" 1
1461 1 6 VAL MG1 1 7 GLU H . . 6.330 4.053 2.869 4.499 . 0 0 "[ . 1 . 2]" 1
1462 1 6 VAL MG2 1 7 GLU H . . 6.330 3.811 2.943 4.379 . 0 0 "[ . 1 . 2]" 1
1463 1 1 ASN HA 1 6 VAL MG1 . . 6.520 3.454 1.800 5.246 . 0 0 "[ . 1 . 2]" 1
1464 1 19 ILE MG 1 20 THR MG . . 7.540 3.191 2.453 5.189 . 0 0 "[ . 1 . 2]" 1
1465 1 20 THR MG 1 59 LEU MD1 . . 7.540 3.705 2.677 6.089 . 0 0 "[ . 1 . 2]" 1
1466 1 16 ARG QG 1 20 THR MG . . 7.210 3.723 2.917 5.574 . 0 0 "[ . 1 . 2]" 1
1467 1 19 ILE HA 1 20 THR MG . . 6.520 4.882 4.656 6.179 . 0 0 "[ . 1 . 2]" 1
1468 1 38 THR MG 1 79 VAL HA . . 6.330 2.552 2.022 3.065 . 0 0 "[ . 1 . 2]" 1
1469 1 37 CYS HA 1 38 THR MG . . 6.520 4.986 4.902 5.114 . 0 0 "[ . 1 . 2]" 1
1470 1 17 GLU HA 1 20 THR MG . . 6.390 4.065 3.544 4.958 . 0 0 "[ . 1 . 2]" 1
1471 1 17 GLU HA 1 21 THR MG . . 5.680 4.227 2.472 5.080 . 0 0 "[ . 1 . 2]" 1
1472 1 17 GLU QB 1 21 THR MG . . 7.400 3.133 1.980 4.234 . 0 0 "[ . 1 . 2]" 1
1473 1 20 THR HG1 1 21 THR MG . . 6.520 5.411 2.932 6.073 . 0 0 "[ . 1 . 2]" 1
1474 1 1 ASN HA 1 6 VAL MG2 . . 6.520 3.355 1.862 5.315 . 0 0 "[ . 1 . 2]" 1
1475 1 38 THR MG 1 40 LEU H . . 6.520 5.403 5.234 5.553 . 0 0 "[ . 1 . 2]" 1
1476 1 36 TYR QE 1 52 VAL MG1 . . 8.650 4.726 1.744 6.238 . 0 0 "[ . 1 . 2]" 1
1477 1 52 VAL MG1 1 53 ILE H . . 6.520 3.157 2.795 3.496 . 0 0 "[ . 1 . 2]" 1
1478 1 64 VAL MG2 1 65 GLU H . . 6.210 3.777 3.555 4.078 . 0 0 "[ . 1 . 2]" 1
1479 1 38 THR MG 1 82 VAL HB . . 6.210 2.641 2.334 3.609 . 0 0 "[ . 1 . 2]" 1
1480 1 34 VAL MG1 1 78 ASN H . . 6.520 4.636 4.273 5.130 . 0 0 "[ . 1 . 2]" 1
1481 1 93 VAL MG1 1 94 THR H . . 6.520 3.465 2.218 4.367 . 0 0 "[ . 1 . 2]" 1
1482 1 57 LYS QE 1 93 VAL MG1 . . 7.400 3.130 1.790 4.940 . 0 0 "[ . 1 . 2]" 1
1483 1 54 LYS QE 1 93 VAL MG1 . . 7.400 3.564 2.664 5.892 . 0 0 "[ . 1 . 2]" 1
1484 1 2 LEU QD 1 33 VAL QG . . 7.540 2.270 1.652 3.413 . 0 0 "[ . 1 . 2]" 1
1485 1 2 LEU QD 1 33 VAL HA . . 5.740 2.889 2.290 3.790 . 0 0 "[ . 1 . 2]" 1
1486 1 2 LEU H 1 11 VAL MG2 . . 6.520 3.858 2.871 4.676 . 0 0 "[ . 1 . 2]" 1
1487 1 11 VAL MG2 1 36 TYR QD . . 8.650 5.166 3.544 5.991 . 0 0 "[ . 1 . 2]" 1
1488 1 11 VAL MG2 1 36 TYR QE . . 8.650 4.982 2.418 6.163 . 0 0 "[ . 1 . 2]" 1
1489 1 83 LEU QB 1 90 THR MG . . 7.400 3.133 2.066 4.574 . 0 0 "[ . 1 . 2]" 1
1490 1 90 THR MG 1 91 LEU HG . . 6.520 5.094 3.975 6.146 . 0 0 "[ . 1 . 2]" 1
1491 1 84 GLN QG 1 90 THR MG . . 7.400 3.306 2.302 4.785 . 0 0 "[ . 1 . 2]" 1
1492 1 81 VAL HA 1 90 THR MG . . 6.520 4.334 3.740 5.186 . 0 0 "[ . 1 . 2]" 1
1493 1 89 SER HA 1 90 THR MG . . 6.120 4.362 3.427 5.560 . 0 0 "[ . 1 . 2]" 1
1494 1 80 GLN HE21 1 90 THR MG . . 6.520 3.848 2.005 5.662 . 0 0 "[ . 1 . 2]" 1
1495 1 80 GLN HE22 1 90 THR MG . . 6.520 4.430 2.950 5.634 . 0 0 "[ . 1 . 2]" 1
1496 1 80 GLN H 1 90 THR MG . . 6.520 5.045 4.638 6.006 . 0 0 "[ . 1 . 2]" 1
1497 1 90 THR MG 1 91 LEU H . . 6.430 3.578 1.954 4.221 . 0 0 "[ . 1 . 2]" 1
1498 1 13 THR MG 1 17 GLU QB . . 7.400 4.831 3.008 6.066 . 0 0 "[ . 1 . 2]" 1
1499 1 40 LEU MD2 1 45 ASP HB2 . . 6.520 3.818 2.124 5.550 . 0 0 "[ . 1 . 2]" 1
1500 1 37 CYS HA 1 40 LEU MD2 . . 6.520 4.164 2.079 5.178 . 0 0 "[ . 1 . 2]" 1
1501 1 82 VAL MG1 1 85 GLN H . . 6.520 4.717 4.371 5.073 . 0 0 "[ . 1 . 2]" 1
1502 1 79 VAL HA 1 82 VAL MG1 . . 6.520 4.322 2.145 4.809 . 0 0 "[ . 1 . 2]" 1
1503 1 38 THR MG 1 82 VAL MG1 . . 7.130 2.821 1.784 3.156 . 0 0 "[ . 1 . 2]" 1
1504 1 76 LEU HA 1 79 VAL MG1 . . 6.520 2.254 1.826 3.843 . 0 0 "[ . 1 . 2]" 1
1505 1 79 VAL MG1 1 80 GLN HA . . 6.520 3.702 3.269 5.547 . 0 0 "[ . 1 . 2]" 1
1506 1 31 LEU MD1 1 32 GLN H . . 6.520 4.039 2.322 4.748 . 0 0 "[ . 1 . 2]" 1
1507 1 79 VAL MG1 1 80 GLN H . . 5.810 2.491 2.122 3.986 . 0 0 "[ . 1 . 2]" 1
1508 1 82 VAL MG2 1 85 GLN H . . 6.520 5.190 4.491 5.410 . 0 0 "[ . 1 . 2]" 1
1509 1 79 VAL HA 1 82 VAL MG2 . . 6.520 3.627 3.091 4.791 . 0 0 "[ . 1 . 2]" 1
1510 1 38 THR MG 1 82 VAL MG2 . . 7.130 2.113 1.845 3.473 . 0 0 "[ . 1 . 2]" 1
1511 1 58 ARG QB 1 59 LEU MD2 . . 7.400 3.949 3.312 4.965 . 0 0 "[ . 1 . 2]" 1
1512 1 16 ARG QG 1 59 LEU MD2 . . 7.400 3.632 2.404 4.348 . 0 0 "[ . 1 . 2]" 1
1513 1 20 THR MG 1 59 LEU MD2 . . 7.540 2.859 2.051 3.914 . 0 0 "[ . 1 . 2]" 1
1514 1 16 ARG HB2 1 59 LEU MD2 . . 6.520 4.657 3.965 5.797 . 0 0 "[ . 1 . 2]" 1
1515 1 16 ARG HB3 1 59 LEU MD2 . . 6.520 5.193 3.684 6.008 . 0 0 "[ . 1 . 2]" 1
1516 1 16 ARG HD2 1 59 LEU MD2 . . 6.520 2.543 1.722 4.202 . 0 0 "[ . 1 . 2]" 1
1517 1 48 LYS HA 1 51 LEU MD2 . . 6.460 3.476 2.050 4.714 . 0 0 "[ . 1 . 2]" 1
1518 1 16 ARG HA 1 59 LEU MD2 . . 5.160 3.250 2.157 3.882 . 0 0 "[ . 1 . 2]" 1
1519 1 56 MET HA 1 59 LEU MD2 . . 6.520 5.278 4.624 5.825 . 0 0 "[ . 1 . 2]" 1
1520 1 46 LEU MD1 1 87 TYR QE . . 8.650 3.787 2.391 4.796 . 0 0 "[ . 1 . 2]" 1
1521 1 46 LEU MD1 1 87 TYR QD . . 8.650 4.556 3.076 5.940 . 0 0 "[ . 1 . 2]" 1
1522 1 46 LEU H 1 46 LEU MD1 . . 5.870 3.326 2.509 4.051 . 0 0 "[ . 1 . 2]" 1
1523 1 51 LEU H 1 51 LEU MD2 . . 5.430 3.028 1.917 4.045 . 0 0 "[ . 1 . 2]" 1
1524 1 8 PHE HZ 1 51 LEU MD2 . . 6.520 4.582 2.904 6.009 . 0 0 "[ . 1 . 2]" 1
1525 1 55 TYR QD 1 59 LEU MD2 . . 8.650 4.438 3.976 4.924 . 0 0 "[ . 1 . 2]" 1
1526 1 55 TYR QE 1 59 LEU MD2 . . 8.650 4.178 3.356 5.855 . 0 0 "[ . 1 . 2]" 1
1527 1 19 ILE H 1 59 LEU MD2 . . 6.520 5.307 3.732 6.030 . 0 0 "[ . 1 . 2]" 1
1528 1 16 ARG H 1 59 LEU MD2 . . 6.520 5.490 4.495 6.071 . 0 0 "[ . 1 . 2]" 1
1529 1 51 LEU MD2 1 52 VAL H . . 6.520 4.465 3.885 5.012 . 0 0 "[ . 1 . 2]" 1
1530 1 19 ILE MG 1 59 LEU MD2 . . 7.540 3.685 2.728 4.212 . 0 0 "[ . 1 . 2]" 1
1531 1 30 ILE HA 1 33 VAL QG . . 5.130 2.183 2.014 2.440 . 0 0 "[ . 1 . 2]" 1
1532 1 18 TRP HH2 1 33 VAL QG . . 5.710 2.403 1.885 2.959 . 0 0 "[ . 1 . 2]" 1
1533 1 38 THR HB 1 82 VAL MG2 . . 6.520 2.739 2.537 2.970 . 0 0 "[ . 1 . 2]" 1
1534 1 41 ILE H 1 49 LEU MD2 . . 6.210 3.839 3.190 5.963 . 0 0 "[ . 1 . 2]" 1
1535 1 76 LEU MD1 1 77 ASP H . . 6.520 4.676 4.300 4.991 . 0 0 "[ . 1 . 2]" 1
1536 1 15 LEU QD 1 19 ILE MD . . 7.540 3.013 2.499 3.452 . 0 0 "[ . 1 . 2]" 1
1537 1 53 ILE MG 1 91 LEU MD1 . . 7.540 2.983 1.968 3.943 . 0 0 "[ . 1 . 2]" 1
1538 1 53 ILE HB 1 91 LEU MD1 . . 6.520 3.750 2.991 4.537 . 0 0 "[ . 1 . 2]" 1
1539 1 50 ASP QB 1 91 LEU MD1 . . 7.400 4.266 2.774 5.879 . 0 0 "[ . 1 . 2]" 1
1540 1 12 LYS HA 1 15 LEU QD . . 6.520 2.880 2.320 3.412 . 0 0 "[ . 1 . 2]" 1
1541 1 15 LEU QD 1 56 MET QG . . 7.400 3.143 2.050 4.138 . 0 0 "[ . 1 . 2]" 1
1542 1 50 ASP HA 1 91 LEU MD1 . . 5.090 3.416 2.534 4.784 . 0 0 "[ . 1 . 2]" 1
1543 1 15 LEU QD 1 55 TYR QD . . 8.650 2.618 1.827 3.195 . 0 0 "[ . 1 . 2]" 1
1544 1 15 LEU QD 1 55 TYR QE . . 8.650 4.125 3.611 4.624 . 0 0 "[ . 1 . 2]" 1
1545 1 50 ASP H 1 91 LEU MD1 . . 6.520 5.093 3.889 6.124 . 0 0 "[ . 1 . 2]" 1
1546 1 15 LEU QD 1 16 ARG H . . 6.520 4.232 4.003 4.343 . 0 0 "[ . 1 . 2]" 1
1547 1 36 TYR QE 1 52 VAL MG2 . . 8.650 4.799 1.725 6.877 . 0 0 "[ . 1 . 2]" 1
1548 1 52 VAL MG2 1 53 ILE H . . 6.520 3.952 3.826 4.091 . 0 0 "[ . 1 . 2]" 1
1549 1 44 LYS HA 1 46 LEU MD2 . . 6.520 3.422 2.347 4.611 . 0 0 "[ . 1 . 2]" 1
1550 1 46 LEU MD2 1 87 TYR QE . . 8.650 2.897 2.224 4.165 . 0 0 "[ . 1 . 2]" 1
1551 1 46 LEU MD2 1 87 TYR QD . . 8.650 3.645 2.168 4.917 . 0 0 "[ . 1 . 2]" 1
1552 1 50 ASP H 1 91 LEU MD2 . . 6.520 4.575 3.456 6.075 . 0 0 "[ . 1 . 2]" 1
1553 1 83 LEU MD1 1 87 TYR QD . . 8.650 3.252 1.784 4.982 . 0 0 "[ . 1 . 2]" 1
1554 1 83 LEU MD1 1 91 LEU H . . 6.520 4.175 1.902 5.405 . 0 0 "[ . 1 . 2]" 1
1555 1 83 LEU MD1 1 84 GLN H . . 6.520 4.705 4.523 5.173 . 0 0 "[ . 1 . 2]" 1
1556 1 83 LEU MD1 1 90 THR HA . . 5.930 4.167 2.713 5.756 . 0 0 "[ . 1 . 2]" 1
1557 1 50 ASP HA 1 91 LEU MD2 . . 5.090 3.811 2.504 5.571 0.481 14 0 "[ . 1 . 2]" 1
1558 1 50 ASP QB 1 91 LEU MD2 . . 7.400 3.869 2.301 6.037 . 0 0 "[ . 1 . 2]" 1
1559 1 34 VAL MG2 1 78 ASN H . . 6.520 4.840 4.392 5.369 . 0 0 "[ . 1 . 2]" 1
1560 1 40 LEU H 1 40 LEU MD1 . . 5.680 3.577 2.382 4.043 . 0 0 "[ . 1 . 2]" 1
1561 1 8 PHE HZ 1 51 LEU MD1 . . 6.520 4.444 2.736 5.966 . 0 0 "[ . 1 . 2]" 1
1562 1 31 LEU MD2 1 32 GLN H . . 6.520 4.516 3.923 4.790 . 0 0 "[ . 1 . 2]" 1
1563 1 31 LEU HA 1 34 VAL MG2 . . 5.740 3.248 2.654 3.827 . 0 0 "[ . 1 . 2]" 1
1564 1 53 ILE HB 1 91 LEU MD2 . . 6.520 4.912 2.985 5.802 . 0 0 "[ . 1 . 2]" 1
1565 1 40 LEU MD1 1 48 LYS QG . . 7.400 3.617 2.424 4.914 . 0 0 "[ . 1 . 2]" 1
1566 1 40 LEU MD2 1 48 LYS QG . . 7.400 3.267 1.763 4.949 . 0 0 "[ . 1 . 2]" 1
1567 1 47 GLU HG2 1 51 LEU MD1 . . 6.520 4.303 2.331 5.987 . 0 0 "[ . 1 . 2]" 1
1568 1 53 ILE MG 1 91 LEU MD2 . . 7.540 4.428 2.194 5.557 . 0 0 "[ . 1 . 2]" 1
1569 1 40 LEU MD1 1 48 LYS HD3 . . 6.520 4.656 2.542 5.827 . 0 0 "[ . 1 . 2]" 1
1570 1 25 PRO HG2 1 67 VAL MG2 . . 6.520 3.443 2.134 4.901 . 0 0 "[ . 1 . 2]" 1
1571 1 16 ARG HB3 1 59 LEU MD1 . . 6.520 4.698 4.064 6.080 . 0 0 "[ . 1 . 2]" 1
1572 1 56 MET HA 1 59 LEU MD1 . . 6.520 3.297 2.473 4.575 . 0 0 "[ . 1 . 2]" 1
1573 1 16 ARG HA 1 59 LEU MD1 . . 5.160 2.391 1.786 3.974 . 0 0 "[ . 1 . 2]" 1
1574 1 55 TYR QE 1 59 LEU MD1 . . 8.650 2.986 2.177 4.776 . 0 0 "[ . 1 . 2]" 1
1575 1 55 TYR QD 1 59 LEU MD1 . . 8.650 2.863 2.284 3.734 . 0 0 "[ . 1 . 2]" 1
1576 1 19 ILE H 1 59 LEU MD1 . . 6.520 4.430 3.710 5.842 . 0 0 "[ . 1 . 2]" 1
1577 1 16 ARG H 1 59 LEU MD1 . . 6.520 4.226 3.602 5.720 . 0 0 "[ . 1 . 2]" 1
1578 1 76 LEU MD2 1 77 ASP H . . 6.520 4.559 4.305 4.896 . 0 0 "[ . 1 . 2]" 1
1579 1 16 ARG HB2 1 59 LEU MD1 . . 6.520 3.898 3.158 5.652 . 0 0 "[ . 1 . 2]" 1
1580 1 58 ARG QB 1 59 LEU MD1 . . 7.400 3.837 1.918 4.884 . 0 0 "[ . 1 . 2]" 1
1581 1 19 ILE MG 1 59 LEU MD1 . . 7.540 3.623 3.222 4.302 . 0 0 "[ . 1 . 2]" 1
1582 1 83 LEU MD2 1 87 TYR QD . . 8.650 4.364 2.169 5.468 . 0 0 "[ . 1 . 2]" 1
1583 1 41 ILE H 1 49 LEU MD1 . . 6.210 4.399 3.219 5.666 . 0 0 "[ . 1 . 2]" 1
1584 1 83 LEU MD2 1 91 LEU H . . 6.520 2.336 1.771 4.548 . 0 0 "[ . 1 . 2]" 1
1585 1 83 LEU MD2 1 84 GLN H . . 6.520 4.520 4.006 4.827 . 0 0 "[ . 1 . 2]" 1
1586 1 37 CYS HA 1 49 LEU MD1 . . 6.520 2.893 1.741 5.222 . 0 0 "[ . 1 . 2]" 1
1587 1 49 LEU MD1 1 50 ASP HA . . 6.520 4.492 2.671 5.405 . 0 0 "[ . 1 . 2]" 1
1588 1 19 ILE MG 1 59 LEU HG . . 6.520 4.485 4.023 4.840 . 0 0 "[ . 1 . 2]" 1
1589 1 16 ARG QG 1 59 LEU MD1 . . 7.400 3.726 2.315 5.025 . 0 0 "[ . 1 . 2]" 1
1590 1 40 LEU MD2 1 48 LYS HD3 . . 6.520 4.427 2.469 5.983 . 0 0 "[ . 1 . 2]" 1
1591 1 40 LEU MD2 1 48 LYS HD2 . . 6.520 4.692 3.080 5.871 . 0 0 "[ . 1 . 2]" 1
1592 1 40 LEU MD1 1 48 LYS HD2 . . 6.520 4.870 2.363 6.109 . 0 0 "[ . 1 . 2]" 1
1593 1 84 GLN HB2 1 90 THR MG . . 6.520 2.859 2.041 4.639 . 0 0 "[ . 1 . 2]" 1
1594 1 84 GLN HB3 1 90 THR MG . . 6.520 3.356 1.777 4.930 . 0 0 "[ . 1 . 2]" 1
1595 1 30 ILE MG 1 34 VAL HB . . 6.520 4.411 3.835 4.723 . 0 0 "[ . 1 . 2]" 1
1596 1 25 PRO QB 1 30 ILE MD . . 7.400 2.086 1.699 2.855 . 0 0 "[ . 1 . 2]" 1
1597 1 22 ILE MG 1 25 PRO QB . . 7.400 3.840 2.886 4.895 . 0 0 "[ . 1 . 2]" 1
1598 1 52 VAL HB 1 53 ILE MD . . 6.520 4.232 2.792 4.861 . 0 0 "[ . 1 . 2]" 1
1599 1 40 LEU MD1 1 48 LYS HB2 . . 6.520 3.253 1.869 5.801 . 0 0 "[ . 1 . 2]" 1
1600 1 40 LEU MD2 1 48 LYS HB2 . . 6.520 2.850 1.751 5.035 . 0 0 "[ . 1 . 2]" 1
1601 1 40 LEU MD1 1 48 LYS HB3 . . 6.520 3.358 1.850 5.765 . 0 0 "[ . 1 . 2]" 1
1602 1 40 LEU MD2 1 48 LYS HB3 . . 6.520 3.262 2.122 4.465 . 0 0 "[ . 1 . 2]" 1
1603 1 19 ILE MD 1 60 MET HG2 . . 6.520 3.522 2.941 4.515 . 0 0 "[ . 1 . 2]" 1
1604 1 17 GLU QG 1 21 THR MG . . 6.520 3.924 2.040 5.124 . 0 0 "[ . 1 . 2]" 1
1605 1 47 GLU HG3 1 51 LEU MD1 . . 6.520 4.911 3.084 6.146 . 0 0 "[ . 1 . 2]" 1
1606 1 47 GLU HG3 1 51 LEU MD2 . . 6.520 4.384 3.425 6.061 . 0 0 "[ . 1 . 2]" 1
1607 1 47 GLU HG2 1 51 LEU MD2 . . 6.520 3.695 2.343 5.143 . 0 0 "[ . 1 . 2]" 1
1608 1 40 LEU MD1 1 45 ASP HB2 . . 6.520 4.673 2.766 6.057 . 0 0 "[ . 1 . 2]" 1
1609 1 40 LEU MD2 1 45 ASP HB3 . . 6.520 2.866 1.960 4.277 . 0 0 "[ . 1 . 2]" 1
1610 1 40 LEU MD1 1 45 ASP HB3 . . 6.520 3.719 2.068 4.649 . 0 0 "[ . 1 . 2]" 1
1611 1 5 ALA MB 1 10 ASP HB3 . . 6.210 2.914 2.175 3.822 . 0 0 "[ . 1 . 2]" 1
1612 1 11 VAL MG1 1 48 LYS HE2 . . 6.520 5.662 4.600 6.145 . 0 0 "[ . 1 . 2]" 1
1613 1 11 VAL MG2 1 48 LYS HE2 . . 6.520 4.339 3.596 5.094 . 0 0 "[ . 1 . 2]" 1
1614 1 11 VAL MG2 1 48 LYS HE3 . . 6.520 4.433 3.472 5.470 . 0 0 "[ . 1 . 2]" 1
1615 1 11 VAL MG1 1 48 LYS HE3 . . 6.520 5.630 4.542 6.146 . 0 0 "[ . 1 . 2]" 1
1616 1 53 ILE MG 1 54 LYS QE . . 7.400 5.477 4.010 6.093 . 0 0 "[ . 1 . 2]" 1
1617 1 54 LYS QE 1 93 VAL MG2 . . 7.400 4.435 2.592 6.161 . 0 0 "[ . 1 . 2]" 1
1618 1 41 ILE MD 1 83 LEU QB . . 6.840 2.267 2.097 3.488 . 0 0 "[ . 1 . 2]" 1
1619 1 57 LYS QE 1 93 VAL MG2 . . 7.400 4.579 1.932 5.878 . 0 0 "[ . 1 . 2]" 1
1620 1 16 ARG HD2 1 59 LEU MD1 . . 6.520 2.816 2.111 4.483 . 0 0 "[ . 1 . 2]" 1
1621 1 16 ARG HD3 1 59 LEU MD1 . . 6.520 3.080 2.140 5.620 . 0 0 "[ . 1 . 2]" 1
1622 1 16 ARG HD3 1 59 LEU MD2 . . 6.520 3.228 2.436 5.107 . 0 0 "[ . 1 . 2]" 1
1623 1 25 PRO HD2 1 67 VAL MG2 . . 6.520 2.876 1.868 4.659 . 0 0 "[ . 1 . 2]" 1
1624 1 25 PRO HD3 1 67 VAL MG1 . . 6.520 4.561 3.411 5.864 . 0 0 "[ . 1 . 2]" 1
1625 1 2 LEU HA 1 3 ALA MB . . 6.270 4.186 3.527 4.912 . 0 0 "[ . 1 . 2]" 1
1626 1 90 THR MG 1 91 LEU HA . . 6.520 5.250 3.837 5.821 . 0 0 "[ . 1 . 2]" 1
1627 1 30 ILE MD 1 71 ALA HA . . 6.430 3.817 2.936 4.746 . 0 0 "[ . 1 . 2]" 1
1628 1 30 ILE MG 1 71 ALA HA . . 6.520 3.598 2.874 4.369 . 0 0 "[ . 1 . 2]" 1
1629 1 71 ALA HA 1 75 ILE MD . . 5.990 4.091 3.609 4.647 . 0 0 "[ . 1 . 2]" 1
1630 1 41 ILE MG 1 46 LEU HA . . 6.520 5.752 5.341 6.108 . 0 0 "[ . 1 . 2]" 1
1631 1 10 ASP HA 1 13 THR MG . . 5.960 3.975 3.645 4.437 . 0 0 "[ . 1 . 2]" 1
1632 1 78 ASN HA 1 81 VAL MG2 . . 6.490 3.125 2.560 3.702 . 0 0 "[ . 1 . 2]" 1
1633 1 44 LYS HA 1 46 LEU MD1 . . 6.520 4.794 3.445 5.445 . 0 0 "[ . 1 . 2]" 1
1634 1 38 THR MG 1 39 ASP HA . . 6.520 5.576 5.430 5.701 . 0 0 "[ . 1 . 2]" 1
1635 1 76 LEU HA 1 79 VAL MG2 . . 6.520 4.277 2.098 4.924 . 0 0 "[ . 1 . 2]" 1
1636 1 30 ILE MG 1 31 LEU HA . . 5.030 3.694 3.379 4.126 . 0 0 "[ . 1 . 2]" 1
1637 1 31 LEU HA 1 34 VAL MG1 . . 5.740 4.070 3.440 4.671 . 0 0 "[ . 1 . 2]" 1
1638 1 13 THR MG 1 14 LEU HA . . 6.520 3.659 3.140 4.176 . 0 0 "[ . 1 . 2]" 1
1639 1 86 THR MG 1 87 TYR HA . . 6.390 3.508 3.123 5.473 . 0 0 "[ . 1 . 2]" 1
1640 1 70 MET HA 1 71 ALA MB . . 6.520 5.071 5.044 5.099 . 0 0 "[ . 1 . 2]" 1
1641 1 35 LYS HA 1 38 THR MG . . 6.520 3.684 3.033 3.983 . 0 0 "[ . 1 . 2]" 1
1642 1 49 LEU MD2 1 50 ASP HA . . 6.520 4.654 3.152 5.147 . 0 0 "[ . 1 . 2]" 1
1643 1 41 ILE MG 1 83 LEU HA . . 5.590 2.072 1.767 2.368 . 0 0 "[ . 1 . 2]" 1
1644 1 80 GLN HA 1 90 THR MG . . 4.720 3.073 2.505 3.976 . 0 0 "[ . 1 . 2]" 1
1645 1 79 VAL MG2 1 80 GLN HA . . 6.520 3.666 3.331 4.077 . 0 0 "[ . 1 . 2]" 1
1646 1 84 GLN HA 1 90 THR MG . . 6.520 3.497 2.437 4.807 . 0 0 "[ . 1 . 2]" 1
1647 1 48 LYS HA 1 51 LEU MD1 . . 6.460 4.058 2.080 5.977 . 0 0 "[ . 1 . 2]" 1
1648 1 22 ILE MG 1 23 SER HA . . 6.520 4.395 3.830 5.032 . 0 0 "[ . 1 . 2]" 1
1649 1 42 GLU HA 1 86 THR MG . . 6.520 2.954 2.131 4.281 . 0 0 "[ . 1 . 2]" 1
1650 1 41 ILE MG 1 42 GLU HA . . 5.740 3.523 3.073 3.938 . 0 0 "[ . 1 . 2]" 1
1651 1 16 ARG HA 1 19 ILE MD . . 5.900 3.846 3.596 4.146 . 0 0 "[ . 1 . 2]" 1
1652 1 83 LEU MD2 1 90 THR HA . . 5.930 2.469 1.860 4.200 . 0 0 "[ . 1 . 2]" 1
1653 1 8 PHE HA 1 11 VAL MG2 . . 6.520 2.420 2.123 2.879 . 0 0 "[ . 1 . 2]" 1
1654 1 25 PRO HA 1 30 ILE MD . . 6.520 4.316 3.780 4.943 . 0 0 "[ . 1 . 2]" 1
1655 1 53 ILE MG 1 93 VAL HA . . 6.520 4.921 3.654 6.125 . 0 0 "[ . 1 . 2]" 1
1656 1 5 ALA MB 1 6 VAL HA . . 6.520 4.251 3.896 4.586 . 0 0 "[ . 1 . 2]" 1
1657 1 71 ALA MB 1 72 PHE HA . . 6.520 3.998 3.775 4.106 . 0 0 "[ . 1 . 2]" 1
1658 1 72 PHE HA 1 75 ILE MD . . 6.300 3.280 2.114 3.874 . 0 0 "[ . 1 . 2]" 1
1659 1 72 PHE HA 1 75 ILE MG . . 6.020 4.641 4.027 5.183 . 0 0 "[ . 1 . 2]" 1
1660 1 20 THR MG 1 21 THR HA . . 6.520 5.430 3.982 5.725 . 0 0 "[ . 1 . 2]" 1
1661 1 53 ILE HA 1 56 MET ME . . 4.410 2.865 2.041 3.665 . 0 0 "[ . 1 . 2]" 1
1662 1 37 CYS HA 1 40 LEU MD1 . . 6.520 3.140 1.803 5.588 . 0 0 "[ . 1 . 2]" 1
1663 1 37 CYS HA 1 49 LEU MD2 . . 6.520 3.784 1.828 5.118 . 0 0 "[ . 1 . 2]" 1
1664 1 38 THR MG 1 82 VAL HA . . 6.520 4.932 4.783 5.480 . 0 0 "[ . 1 . 2]" 1
1665 1 52 VAL HA 1 53 ILE MD . . 6.520 5.562 4.623 6.162 . 0 0 "[ . 1 . 2]" 1
1666 1 38 THR HB 1 82 VAL MG1 . . 6.520 2.299 1.976 2.618 . 0 0 "[ . 1 . 2]" 1
1667 1 41 ILE MG 1 86 THR HB . . 6.520 2.445 2.024 4.321 . 0 0 "[ . 1 . 2]" 1
1668 1 19 ILE HA 1 60 MET ME . . 6.520 4.466 3.913 5.767 . 0 0 "[ . 1 . 2]" 1
1669 1 16 ARG HA 1 19 ILE MG . . 6.520 5.137 4.732 5.386 . 0 0 "[ . 1 . 2]" 1
1670 1 19 ILE MG 1 60 MET HA . . 6.520 2.702 2.159 3.480 . 0 0 "[ . 1 . 2]" 1
1671 1 19 ILE MG 1 59 LEU HB2 . . 6.520 2.486 2.198 2.928 . 0 0 "[ . 1 . 2]" 1
1672 1 19 ILE MG 1 59 LEU HB3 . . 6.520 2.178 1.784 2.554 . 0 0 "[ . 1 . 2]" 1
1673 1 19 ILE MG 1 60 MET HG2 . . 6.520 3.139 2.071 4.972 . 0 0 "[ . 1 . 2]" 1
1674 1 1 ASN HA 1 6 VAL QG . . 5.630 2.639 1.799 3.752 . 0 0 "[ . 1 . 2]" 1
1675 1 1 ASN QB 1 6 VAL QG . . 5.000 2.688 1.815 4.420 . 0 0 "[ . 1 . 2]" 1
1676 1 2 LEU H 1 6 VAL QG . . 5.290 3.808 2.750 4.669 . 0 0 "[ . 1 . 2]" 1
1677 1 2 LEU H 1 11 VAL QG . . 5.660 3.774 2.842 4.548 . 0 0 "[ . 1 . 2]" 1
1678 1 2 LEU HA 1 11 VAL QG . . 6.420 4.477 3.890 5.711 . 0 0 "[ . 1 . 2]" 1
1679 1 2 LEU HA 1 33 VAL QG . . 6.420 4.925 4.220 5.689 . 0 0 "[ . 1 . 2]" 1
1680 1 2 LEU QB 1 11 VAL HA . . 4.470 3.799 2.463 5.396 0.926 9 5 "[ . *+1 *.-* 2]" 1
1681 1 2 LEU QB 1 11 VAL QG . . 4.290 2.369 1.649 3.898 . 0 0 "[ . 1 . 2]" 1
1682 1 2 LEU HG 1 11 VAL QG . . 5.020 2.333 1.737 3.832 . 0 0 "[ . 1 . 2]" 1
1683 1 2 LEU QD 1 3 ALA H . . 6.420 2.863 1.633 4.215 . 0 0 "[ . 1 . 2]" 1
1684 1 2 LEU QD 1 3 ALA HA . . 6.420 4.331 3.735 5.273 . 0 0 "[ . 1 . 2]" 1
1685 1 2 LEU QD 1 11 VAL QG . . 6.230 1.938 1.560 2.419 . 0 0 "[ . 1 . 2]" 1
1686 1 2 LEU QD 1 14 LEU QB . . 6.180 3.780 2.795 4.768 . 0 0 "[ . 1 . 2]" 1
1687 1 2 LEU QD 1 14 LEU QD . . 6.580 2.710 1.855 3.853 . 0 0 "[ . 1 . 2]" 1
1688 1 2 LEU QD 1 15 LEU HA . . 6.420 5.525 4.289 6.090 . 0 0 "[ . 1 . 2]" 1
1689 1 2 LEU QD 1 15 LEU QD . . 7.230 2.974 2.365 3.471 . 0 0 "[ . 1 . 2]" 1
1690 1 2 LEU QD 1 32 GLN QG . . 5.720 3.788 1.904 5.812 0.092 5 0 "[ . 1 . 2]" 1
1691 1 2 LEU QD 1 36 TYR HA . . 6.420 4.567 3.961 5.463 . 0 0 "[ . 1 . 2]" 1
1692 1 2 LEU QD 1 36 TYR QB . . 7.260 2.437 1.909 2.987 . 0 0 "[ . 1 . 2]" 1
1693 1 2 LEU QD 1 36 TYR QD . . 8.440 2.108 1.707 2.777 . 0 0 "[ . 1 . 2]" 1
1694 1 3 ALA HA 1 4 GLY QA . . 4.260 4.043 3.856 4.263 0.003 1 0 "[ . 1 . 2]" 1
1695 1 3 ALA MB 1 4 GLY QA . . 6.290 4.124 3.602 4.316 . 0 0 "[ . 1 . 2]" 1
1696 1 3 ALA MB 1 14 LEU QD . . 7.390 1.921 1.710 2.134 . 0 0 "[ . 1 . 2]" 1
1697 1 5 ALA H 1 14 LEU QD . . 6.420 4.726 4.011 5.594 . 0 0 "[ . 1 . 2]" 1
1698 1 5 ALA HA 1 6 VAL QG . . 6.120 3.368 2.887 3.997 . 0 0 "[ . 1 . 2]" 1
1699 1 5 ALA HA 1 11 VAL QG . . 6.420 5.583 4.270 6.179 . 0 0 "[ . 1 . 2]" 1
1700 1 5 ALA MB 1 6 VAL QG . . 7.390 3.904 3.275 4.403 . 0 0 "[ . 1 . 2]" 1
1701 1 5 ALA MB 1 10 ASP QB . . 5.400 2.682 2.098 3.593 . 0 0 "[ . 1 . 2]" 1
1702 1 5 ALA MB 1 11 VAL QG . . 7.090 3.850 2.322 4.448 . 0 0 "[ . 1 . 2]" 1
1703 1 5 ALA MB 1 14 LEU QD . . 7.390 4.158 2.419 5.081 . 0 0 "[ . 1 . 2]" 1
1704 1 6 VAL HA 1 11 VAL QG . . 6.060 3.566 2.919 4.207 . 0 0 "[ . 1 . 2]" 1
1705 1 6 VAL HB 1 7 GLU QG . . 5.340 4.909 3.538 6.210 0.870 18 1 "[ . 1 . + 2]" 1
1706 1 6 VAL QG 1 7 GLU H . . 5.570 3.420 2.821 3.869 . 0 0 "[ . 1 . 2]" 1
1707 1 6 VAL QG 1 7 GLU HA . . 6.420 3.808 3.117 4.348 . 0 0 "[ . 1 . 2]" 1
1708 1 6 VAL QG 1 7 GLU QG . . 5.360 4.169 2.819 5.473 0.113 4 0 "[ . 1 . 2]" 1
1709 1 6 VAL QG 1 11 VAL QG . . 7.230 4.097 3.469 4.811 . 0 0 "[ . 1 . 2]" 1
1710 1 7 GLU H 1 7 GLU QG . . 4.450 2.744 1.936 4.135 . 0 0 "[ . 1 . 2]" 1
1711 1 7 GLU H 1 11 VAL QG . . 6.420 3.792 3.169 4.368 . 0 0 "[ . 1 . 2]" 1
1712 1 7 GLU HA 1 11 VAL QG . . 5.940 4.316 4.135 4.574 . 0 0 "[ . 1 . 2]" 1
1713 1 7 GLU QB 1 10 ASP HA . . 4.650 4.577 4.231 4.959 0.309 11 0 "[ . 1 . 2]" 1
1714 1 7 GLU QB 1 14 LEU QD . . 6.180 6.018 5.442 6.227 0.047 17 0 "[ . 1 . 2]" 1
1715 1 8 PHE HA 1 11 VAL QG . . 5.480 2.372 2.103 2.803 . 0 0 "[ . 1 . 2]" 1
1716 1 8 PHE HA 1 52 VAL QG . . 6.420 4.264 3.227 4.823 . 0 0 "[ . 1 . 2]" 1
1717 1 8 PHE QB 1 48 LYS QE . . 4.760 3.224 1.770 4.882 0.122 18 0 "[ . 1 . 2]" 1
1718 1 8 PHE QD 1 11 VAL QG . . 8.440 2.793 2.292 3.576 . 0 0 "[ . 1 . 2]" 1
1719 1 8 PHE QD 1 12 LYS QD . . 7.310 4.506 3.052 6.064 . 0 0 "[ . 1 . 2]" 1
1720 1 8 PHE QD 1 12 LYS QE . . 7.310 4.598 3.100 5.994 . 0 0 "[ . 1 . 2]" 1
1721 1 8 PHE QD 1 51 LEU QD . . 8.440 3.698 2.735 4.898 . 0 0 "[ . 1 . 2]" 1
1722 1 8 PHE QE 1 12 LYS QD . . 7.320 3.702 2.290 5.436 . 0 0 "[ . 1 . 2]" 1
1723 1 8 PHE QE 1 12 LYS QE . . 7.320 4.522 2.457 5.896 . 0 0 "[ . 1 . 2]" 1
1724 1 8 PHE QE 1 51 LEU QD . . 8.440 3.336 2.458 4.245 . 0 0 "[ . 1 . 2]" 1
1725 1 8 PHE QE 1 52 VAL QG . . 8.320 3.207 2.322 4.181 . 0 0 "[ . 1 . 2]" 1
1726 1 9 ASN H 1 9 ASN QB . . 3.040 2.391 2.232 2.638 . 0 0 "[ . 1 . 2]" 1
1727 1 9 ASN HA 1 12 LYS QB . . 4.060 2.661 2.099 4.069 0.009 9 0 "[ . 1 . 2]" 1
1728 1 9 ASN HA 1 12 LYS QD . . 4.780 3.880 2.975 4.868 0.088 1 0 "[ . 1 . 2]" 1
1729 1 9 ASN HA 1 12 LYS QE . . 4.830 2.461 1.850 3.942 . 0 0 "[ . 1 . 2]" 1
1730 1 9 ASN QD 1 12 LYS QE . . 5.180 4.768 2.762 6.070 0.890 3 1 "[ + . 1 . 2]" 1
1731 1 10 ASP HA 1 11 VAL QG . . 6.420 4.814 4.702 4.936 . 0 0 "[ . 1 . 2]" 1
1732 1 10 ASP HA 1 14 LEU QD . . 6.420 4.357 3.700 4.840 . 0 0 "[ . 1 . 2]" 1
1733 1 11 VAL HA 1 14 LEU QB . . 4.290 3.310 2.714 4.771 0.481 19 0 "[ . 1 . 2]" 1
1734 1 11 VAL HA 1 14 LEU QD . . 6.420 2.271 1.709 2.909 . 0 0 "[ . 1 . 2]" 1
1735 1 11 VAL HB 1 52 VAL QG . . 6.420 3.667 2.814 4.150 . 0 0 "[ . 1 . 2]" 1
1736 1 11 VAL QG 1 12 LYS H . . 5.720 3.106 2.967 3.272 . 0 0 "[ . 1 . 2]" 1
1737 1 11 VAL QG 1 12 LYS HA . . 6.420 3.406 3.143 3.787 . 0 0 "[ . 1 . 2]" 1
1738 1 11 VAL QG 1 13 THR H . . 6.420 4.656 4.530 4.790 . 0 0 "[ . 1 . 2]" 1
1739 1 11 VAL QG 1 14 LEU HG . . 6.420 4.873 3.981 5.836 . 0 0 "[ . 1 . 2]" 1
1740 1 11 VAL QG 1 14 LEU QD . . 6.960 3.217 2.647 3.680 . 0 0 "[ . 1 . 2]" 1
1741 1 11 VAL QG 1 15 LEU H . . 6.420 4.058 3.841 4.375 . 0 0 "[ . 1 . 2]" 1
1742 1 11 VAL QG 1 15 LEU QB . . 6.190 3.859 3.547 4.359 . 0 0 "[ . 1 . 2]" 1
1743 1 11 VAL QG 1 15 LEU HG . . 6.150 2.759 2.461 3.445 . 0 0 "[ . 1 . 2]" 1
1744 1 11 VAL QG 1 15 LEU QD . . 7.230 2.166 1.966 2.703 . 0 0 "[ . 1 . 2]" 1
1745 1 11 VAL QG 1 52 VAL HA . . 6.420 3.175 2.203 3.690 . 0 0 "[ . 1 . 2]" 1
1746 1 11 VAL QG 1 52 VAL HB . . 6.420 4.141 3.822 4.457 . 0 0 "[ . 1 . 2]" 1
1747 1 11 VAL QG 1 52 VAL QG . . 6.320 1.802 1.688 2.006 . 0 0 "[ . 1 . 2]" 1
1748 1 12 LYS H 1 14 LEU QD . . 6.420 4.772 4.228 5.400 . 0 0 "[ . 1 . 2]" 1
1749 1 12 LYS HA 1 15 LEU QB . . 3.790 2.710 2.125 3.282 . 0 0 "[ . 1 . 2]" 1
1750 1 12 LYS HA 1 55 TYR QB . . 5.340 4.362 3.867 4.666 . 0 0 "[ . 1 . 2]" 1
1751 1 12 LYS QB 1 12 LYS QD . . 3.320 2.451 2.204 2.819 . 0 0 "[ . 1 . 2]" 1
1752 1 12 LYS QB 1 13 THR HA . . 4.620 4.314 4.027 4.691 0.071 9 0 "[ . 1 . 2]" 1
1753 1 12 LYS QB 1 16 ARG QB . . 5.180 4.879 3.795 6.090 0.910 8 1 "[ . + 1 . 2]" 1
1754 1 12 LYS QB 1 52 VAL HA . . 5.340 5.954 5.088 6.385 1.045 18 14 "[***-** **** * +**]" 1
1755 1 13 THR H 1 14 LEU QD . . 6.420 4.609 3.988 5.060 . 0 0 "[ . 1 . 2]" 1
1756 1 13 THR H 1 15 LEU QD . . 6.420 5.398 5.141 5.672 . 0 0 "[ . 1 . 2]" 1
1757 1 13 THR HA 1 16 ARG QD . . 5.340 5.740 3.130 6.258 0.918 16 14 "[***** * **-.+****]" 1
1758 1 13 THR MG 1 17 GLU QG . . 6.290 3.938 3.260 4.798 . 0 0 "[ . 1 . 2]" 1
1759 1 14 LEU HA 1 17 GLU QG . . 4.550 3.559 2.382 4.667 0.117 5 0 "[ . 1 . 2]" 1
1760 1 15 LEU HA 1 18 TRP QB . . 4.500 2.469 2.122 3.308 . 0 0 "[ . 1 . 2]" 1
1761 1 15 LEU HG 1 52 VAL QG . . 6.420 3.861 3.474 4.379 . 0 0 "[ . 1 . 2]" 1
1762 1 15 LEU QD 1 16 ARG HA . . 6.270 5.059 4.814 5.277 . 0 0 "[ . 1 . 2]" 1
1763 1 15 LEU QD 1 16 ARG QD . . 6.190 5.502 4.241 5.965 . 0 0 "[ . 1 . 2]" 1
1764 1 15 LEU QD 1 18 TRP QB . . 6.180 3.606 3.119 4.442 . 0 0 "[ . 1 . 2]" 1
1765 1 15 LEU QD 1 19 ILE H . . 6.420 5.004 4.511 5.490 . 0 0 "[ . 1 . 2]" 1
1766 1 15 LEU QD 1 52 VAL HA . . 6.420 2.603 1.962 3.395 . 0 0 "[ . 1 . 2]" 1
1767 1 15 LEU QD 1 52 VAL HB . . 6.420 4.320 3.807 4.979 . 0 0 "[ . 1 . 2]" 1
1768 1 15 LEU QD 1 52 VAL QG . . 6.390 2.099 1.777 2.587 . 0 0 "[ . 1 . 2]" 1
1769 1 15 LEU QD 1 56 MET HA . . 6.420 3.067 2.438 3.886 . 0 0 "[ . 1 . 2]" 1
1770 1 15 LEU QD 1 56 MET QB . . 5.600 2.277 1.794 3.051 . 0 0 "[ . 1 . 2]" 1
1771 1 15 LEU QD 1 59 LEU QD . . 7.230 3.764 3.169 4.430 . 0 0 "[ . 1 . 2]" 1
1772 1 16 ARG HA 1 17 GLU QG . . 5.340 5.787 5.375 6.732 1.392 18 5 "[ * -* 1 . +*2]" 1
1773 1 16 ARG HA 1 59 LEU QB . . 5.340 4.297 4.005 4.760 . 0 0 "[ . 1 . 2]" 1
1774 1 16 ARG HA 1 59 LEU QD . . 4.240 2.029 1.780 2.427 . 0 0 "[ . 1 . 2]" 1
1775 1 16 ARG QB 1 17 GLU H . . 3.910 2.298 2.133 2.496 . 0 0 "[ . 1 . 2]" 1
1776 1 16 ARG QB 1 17 GLU HA . . 4.730 4.091 3.855 4.246 . 0 0 "[ . 1 . 2]" 1
1777 1 16 ARG QB 1 17 GLU QB . . 6.160 4.133 3.546 4.558 . 0 0 "[ . 1 . 2]" 1
1778 1 16 ARG QB 1 20 THR MG . . 6.290 4.777 4.190 5.806 . 0 0 "[ . 1 . 2]" 1
1779 1 16 ARG QB 1 59 LEU QD . . 5.060 3.358 2.994 3.836 . 0 0 "[ . 1 . 2]" 1
1780 1 16 ARG QD 1 20 THR MG . . 6.290 3.817 2.696 6.218 . 0 0 "[ . 1 . 2]" 1
1781 1 16 ARG QD 1 55 TYR HA . . 5.340 6.141 5.500 6.418 1.078 20 19 "[* ********-********+]" 1
1782 1 16 ARG QD 1 55 TYR QE . . 7.320 2.799 1.943 4.713 . 0 0 "[ . 1 . 2]" 1
1783 1 17 GLU H 1 17 GLU QG . . 4.470 2.592 1.997 4.031 . 0 0 "[ . 1 . 2]" 1
1784 1 18 TRP QB 1 19 ILE MD . . 6.290 3.883 3.284 4.865 . 0 0 "[ . 1 . 2]" 1
1785 1 19 ILE HB 1 59 LEU QD . . 6.420 2.678 2.250 3.018 . 0 0 "[ . 1 . 2]" 1
1786 1 19 ILE MG 1 60 MET QB . . 6.290 3.869 3.482 4.604 . 0 0 "[ . 1 . 2]" 1
1787 1 19 ILE MG 1 68 TRP QB . . 6.290 2.706 2.224 3.605 . 0 0 "[ . 1 . 2]" 1
1788 1 19 ILE QG 1 59 LEU QB . . 5.180 3.619 3.511 3.685 . 0 0 "[ . 1 . 2]" 1
1789 1 19 ILE QG 1 60 MET ME . . 4.670 2.539 2.148 3.544 . 0 0 "[ . 1 . 2]" 1
1790 1 19 ILE MD 1 33 VAL QG . . 7.390 4.893 4.444 5.423 . 0 0 "[ . 1 . 2]" 1
1791 1 19 ILE MD 1 55 TYR QB . . 6.290 4.643 3.221 5.235 . 0 0 "[ . 1 . 2]" 1
1792 1 19 ILE MD 1 56 MET QB . . 5.410 3.203 2.199 3.895 . 0 0 "[ . 1 . 2]" 1
1793 1 19 ILE MD 1 59 LEU QB . . 5.430 1.942 1.811 2.041 . 0 0 "[ . 1 . 2]" 1
1794 1 19 ILE MD 1 59 LEU QD . . 6.270 2.103 1.801 2.645 . 0 0 "[ . 1 . 2]" 1
1795 1 20 THR MG 1 59 LEU QB . . 5.540 3.434 2.550 5.438 . 0 0 "[ . 1 . 2]" 1
1796 1 20 THR MG 1 59 LEU QD . . 6.190 2.703 2.048 3.870 . 0 0 "[ . 1 . 2]" 1
1797 1 22 ILE HA 1 23 SER QB . . 4.820 4.392 3.946 4.533 . 0 0 "[ . 1 . 2]" 1
1798 1 22 ILE HB 1 25 PRO QD . . 5.350 4.402 3.591 5.655 0.305 19 0 "[ . 1 . 2]" 1
1799 1 22 ILE MG 1 23 SER QB . . 6.290 4.374 3.802 5.069 . 0 0 "[ . 1 . 2]" 1
1800 1 22 ILE MG 1 24 ASP QB . . 6.290 3.819 3.206 4.533 . 0 0 "[ . 1 . 2]" 1
1801 1 22 ILE MG 1 25 PRO QD . . 6.290 3.658 2.696 4.304 . 0 0 "[ . 1 . 2]" 1
1802 1 22 ILE MD 1 23 SER QB . . 6.290 5.966 5.666 6.399 0.109 6 0 "[ . 1 . 2]" 1
1803 1 23 SER QB 1 24 ASP QB . . 5.180 3.946 3.263 4.626 . 0 0 "[ . 1 . 2]" 1
1804 1 24 ASP QB 1 25 PRO QD . . 4.760 3.678 3.212 3.872 . 0 0 "[ . 1 . 2]" 1
1805 1 24 ASP QB 1 67 VAL QG . . 5.600 4.534 3.025 5.641 0.041 19 0 "[ . 1 . 2]" 1
1806 1 25 PRO HA 1 26 MET QB . . 4.700 4.534 4.155 4.774 0.074 4 0 "[ . 1 . 2]" 1
1807 1 25 PRO QB 1 30 ILE QG . . 6.170 2.852 2.301 3.379 . 0 0 "[ . 1 . 2]" 1
1808 1 25 PRO QG 1 30 ILE QG . . 5.180 4.083 3.161 4.889 . 0 0 "[ . 1 . 2]" 1
1809 1 25 PRO QG 1 30 ILE MD . . 5.040 2.973 1.971 3.899 . 0 0 "[ . 1 . 2]" 1
1810 1 25 PRO QG 1 60 MET ME . . 6.290 4.944 3.813 6.097 . 0 0 "[ . 1 . 2]" 1
1811 1 25 PRO QG 1 67 VAL HB . . 5.350 3.210 2.181 4.349 . 0 0 "[ . 1 . 2]" 1
1812 1 25 PRO QG 1 71 ALA MB . . 6.290 3.568 3.084 4.196 . 0 0 "[ . 1 . 2]" 1
1813 1 25 PRO QD 1 67 VAL QG . . 5.020 2.434 1.841 3.279 . 0 0 "[ . 1 . 2]" 1
1814 1 25 PRO QD 1 71 ALA MB . . 6.290 5.095 4.402 5.716 . 0 0 "[ . 1 . 2]" 1
1815 1 26 MET HA 1 27 GLU QB . . 4.410 4.181 4.021 4.390 . 0 0 "[ . 1 . 2]" 1
1816 1 26 MET QB 1 30 ILE MD . . 6.290 5.369 4.904 6.117 . 0 0 "[ . 1 . 2]" 1
1817 1 27 GLU HA 1 31 LEU QD . . 6.420 4.709 3.994 5.619 . 0 0 "[ . 1 . 2]" 1
1818 1 27 GLU QB 1 28 GLU H . . 3.380 3.053 2.543 3.707 0.327 10 0 "[ . 1 . 2]" 1
1819 1 27 GLU QB 1 30 ILE MD . . 6.290 4.237 3.000 5.804 . 0 0 "[ . 1 . 2]" 1
1820 1 27 GLU QG 1 31 LEU QD . . 7.260 2.886 2.050 4.422 . 0 0 "[ . 1 . 2]" 1
1821 1 28 GLU HA 1 31 LEU QB . . 3.990 3.067 1.750 4.570 0.580 10 2 "[ - . + . 2]" 1
1822 1 28 GLU HA 1 31 LEU QD . . 5.440 2.534 2.116 2.952 . 0 0 "[ . 1 . 2]" 1
1823 1 28 GLU QB 1 31 LEU QD . . 4.630 3.930 2.707 4.494 . 0 0 "[ . 1 . 2]" 1
1824 1 28 GLU QG 1 31 LEU QD . . 7.260 3.888 2.394 4.796 . 0 0 "[ . 1 . 2]" 1
1825 1 29 ASP QB 1 33 VAL QG . . 6.190 3.521 3.066 4.103 . 0 0 "[ . 1 . 2]" 1
1826 1 30 ILE HA 1 32 GLN QG . . 5.340 5.240 4.313 6.700 1.360 14 7 "[ * . 1-**+.* *]" 1
1827 1 30 ILE HB 1 33 VAL QG . . 6.420 4.503 4.359 4.761 . 0 0 "[ . 1 . 2]" 1
1828 1 30 ILE HB 1 34 VAL QG . . 6.420 4.578 4.251 4.752 . 0 0 "[ . 1 . 2]" 1
1829 1 30 ILE MG 1 31 LEU QB . . 5.970 4.559 3.949 5.115 . 0 0 "[ . 1 . 2]" 1
1830 1 30 ILE MG 1 33 VAL QG . . 7.390 3.192 2.927 3.446 . 0 0 "[ . 1 . 2]" 1
1831 1 30 ILE MG 1 34 VAL QG . . 6.620 2.679 2.292 2.931 . 0 0 "[ . 1 . 2]" 1
1832 1 30 ILE MG 1 75 ILE QG . . 6.290 2.488 2.135 2.864 . 0 0 "[ . 1 . 2]" 1
1833 1 30 ILE QG 1 71 ALA HA . . 5.340 5.101 4.408 5.942 0.602 19 1 "[ . 1 . +2]" 1
1834 1 30 ILE QG 1 71 ALA MB . . 6.060 3.273 2.637 4.099 . 0 0 "[ . 1 . 2]" 1
1835 1 30 ILE QG 1 75 ILE MD . . 6.290 3.630 2.868 4.496 . 0 0 "[ . 1 . 2]" 1
1836 1 30 ILE MD 1 34 VAL QG . . 7.390 4.963 4.190 5.325 . 0 0 "[ . 1 . 2]" 1
1837 1 30 ILE MD 1 74 PHE QB . . 6.290 4.763 4.201 5.439 . 0 0 "[ . 1 . 2]" 1
1838 1 31 LEU H 1 34 VAL QG . . 6.420 4.545 4.099 4.760 . 0 0 "[ . 1 . 2]" 1
1839 1 31 LEU HA 1 34 VAL QG . . 5.060 3.116 2.603 3.561 . 0 0 "[ . 1 . 2]" 1
1840 1 31 LEU QD 1 32 GLN HA . . 4.500 4.214 2.683 5.239 0.739 14 8 "[ -*. * 1 * +.** *]" 1
1841 1 31 LEU QD 1 32 GLN QG . . 5.530 5.221 3.841 6.319 0.789 20 3 "[ . 1 - .* +]" 1
1842 1 31 LEU QD 1 34 VAL H . . 6.420 4.913 4.458 5.280 . 0 0 "[ . 1 . 2]" 1
1843 1 32 GLN HA 1 33 VAL QG . . 6.420 4.573 4.427 4.949 . 0 0 "[ . 1 . 2]" 1
1844 1 32 GLN HA 1 35 LYS QB . . 4.380 2.834 2.022 3.463 . 0 0 "[ . 1 . 2]" 1
1845 1 32 GLN HA 1 35 LYS QD . . 5.340 5.147 3.920 6.088 0.748 11 2 "[ . 1+ - . 2]" 1
1846 1 32 GLN QB 1 33 VAL QG . . 6.190 3.535 2.591 4.551 . 0 0 "[ . 1 . 2]" 1
1847 1 32 GLN QG 1 33 VAL QG . . 6.190 2.972 2.178 4.257 . 0 0 "[ . 1 . 2]" 1
1848 1 33 VAL H 1 34 VAL QG . . 6.420 4.195 3.934 4.289 . 0 0 "[ . 1 . 2]" 1
1849 1 33 VAL QG 1 34 VAL HA . . 6.420 3.446 3.238 3.602 . 0 0 "[ . 1 . 2]" 1
1850 1 33 VAL QG 1 36 TYR QB . . 7.260 4.021 3.067 4.348 . 0 0 "[ . 1 . 2]" 1
1851 1 33 VAL QG 1 36 TYR QD . . 8.440 3.658 2.650 4.887 . 0 0 "[ . 1 . 2]" 1
1852 1 33 VAL QG 1 37 CYS H . . 6.420 4.730 3.728 4.929 . 0 0 "[ . 1 . 2]" 1
1853 1 33 VAL QG 1 37 CYS HG . . 5.790 3.692 2.445 4.083 . 0 0 "[ . 1 . 2]" 1
1854 1 33 VAL QG 1 56 MET ME . . 5.970 2.380 1.973 3.388 . 0 0 "[ . 1 . 2]" 1
1855 1 33 VAL QG 1 60 MET ME . . 7.390 3.725 3.277 4.213 . 0 0 "[ . 1 . 2]" 1
1856 1 33 VAL QG 1 75 ILE HB . . 6.420 4.400 4.022 4.847 . 0 0 "[ . 1 . 2]" 1
1857 1 33 VAL QG 1 75 ILE MG . . 6.470 2.610 2.274 2.958 . 0 0 "[ . 1 . 2]" 1
1858 1 33 VAL QG 1 75 ILE QG . . 5.720 2.758 2.299 3.656 . 0 0 "[ . 1 . 2]" 1
1859 1 34 VAL HA 1 37 CYS QB . . 4.210 2.674 2.453 3.123 . 0 0 "[ . 1 . 2]" 1
1860 1 34 VAL HA 1 75 ILE QG . . 4.640 4.260 3.970 4.425 . 0 0 "[ . 1 . 2]" 1
1861 1 34 VAL HA 1 78 ASN QB . . 5.340 4.509 3.926 5.200 . 0 0 "[ . 1 . 2]" 1
1862 1 34 VAL HA 1 79 VAL QG . . 4.860 4.341 2.797 4.864 0.004 1 0 "[ . 1 . 2]" 1
1863 1 34 VAL HB 1 35 LYS QB . . 5.340 4.180 3.845 4.702 . 0 0 "[ . 1 . 2]" 1
1864 1 34 VAL QG 1 35 LYS HA . . 6.420 3.383 3.040 3.629 . 0 0 "[ . 1 . 2]" 1
1865 1 34 VAL QG 1 35 LYS QB . . 6.190 4.100 3.688 4.513 . 0 0 "[ . 1 . 2]" 1
1866 1 34 VAL QG 1 37 CYS QB . . 6.190 3.580 3.304 4.027 . 0 0 "[ . 1 . 2]" 1
1867 1 34 VAL QG 1 38 THR MG . . 6.860 2.619 2.355 2.879 . 0 0 "[ . 1 . 2]" 1
1868 1 34 VAL QG 1 74 PHE HA . . 6.420 5.258 4.883 5.819 . 0 0 "[ . 1 . 2]" 1
1869 1 34 VAL QG 1 74 PHE QD . . 8.440 2.688 2.137 3.254 . 0 0 "[ . 1 . 2]" 1
1870 1 34 VAL QG 1 75 ILE H . . 6.420 4.049 3.819 4.448 . 0 0 "[ . 1 . 2]" 1
1871 1 34 VAL QG 1 75 ILE HA . . 4.890 2.097 1.728 2.546 . 0 0 "[ . 1 . 2]" 1
1872 1 34 VAL QG 1 75 ILE HB . . 6.330 3.967 3.818 4.206 . 0 0 "[ . 1 . 2]" 1
1873 1 34 VAL QG 1 75 ILE MG . . 6.150 2.204 1.956 2.510 . 0 0 "[ . 1 . 2]" 1
1874 1 34 VAL QG 1 75 ILE QG . . 5.410 2.057 1.868 2.271 . 0 0 "[ . 1 . 2]" 1
1875 1 34 VAL QG 1 78 ASN HA . . 5.440 4.530 4.252 5.017 . 0 0 "[ . 1 . 2]" 1
1876 1 34 VAL QG 1 78 ASN QB . . 4.940 2.261 2.039 2.692 . 0 0 "[ . 1 . 2]" 1
1877 1 34 VAL QG 1 78 ASN QD . . 5.600 3.285 1.803 4.698 . 0 0 "[ . 1 . 2]" 1
1878 1 35 LYS HA 1 35 LYS QD . . 4.770 2.540 1.865 4.061 . 0 0 "[ . 1 . 2]" 1
1879 1 36 TYR QD 1 40 LEU QD . . 8.440 3.885 2.812 4.620 . 0 0 "[ . 1 . 2]" 1
1880 1 36 TYR QD 1 52 VAL QG . . 8.440 3.575 2.152 4.483 . 0 0 "[ . 1 . 2]" 1
1881 1 36 TYR QE 1 40 LEU QD . . 8.440 4.490 1.937 6.044 . 0 0 "[ . 1 . 2]" 1
1882 1 37 CYS H 1 49 LEU QD . . 6.420 4.375 3.750 6.139 . 0 0 "[ . 1 . 2]" 1
1883 1 37 CYS H 1 79 VAL QG . . 6.420 4.681 4.103 5.074 . 0 0 "[ . 1 . 2]" 1
1884 1 37 CYS HA 1 40 LEU QB . . 4.290 2.836 2.379 3.177 . 0 0 "[ . 1 . 2]" 1
1885 1 37 CYS HA 1 40 LEU QD . . 5.390 2.645 1.802 3.876 . 0 0 "[ . 1 . 2]" 1
1886 1 37 CYS HA 1 49 LEU QB . . 5.340 3.999 3.116 4.652 . 0 0 "[ . 1 . 2]" 1
1887 1 37 CYS HA 1 49 LEU QD . . 5.370 2.319 1.736 4.361 . 0 0 "[ . 1 . 2]" 1
1888 1 37 CYS HA 1 52 VAL QG . . 6.420 4.337 3.826 5.020 . 0 0 "[ . 1 . 2]" 1
1889 1 37 CYS HA 1 79 VAL QG . . 6.420 3.705 3.486 4.217 . 0 0 "[ . 1 . 2]" 1
1890 1 37 CYS QB 1 41 ILE MD . . 6.290 3.779 3.402 4.049 . 0 0 "[ . 1 . 2]" 1
1891 1 37 CYS QB 1 49 LEU HA . . 5.340 4.877 3.909 6.059 0.719 13 1 "[ . 1 + . 2]" 1
1892 1 37 CYS QB 1 49 LEU QD . . 5.440 2.295 1.974 3.701 . 0 0 "[ . 1 . 2]" 1
1893 1 37 CYS QB 1 53 ILE QG . . 5.180 3.723 3.028 4.384 . 0 0 "[ . 1 . 2]" 1
1894 1 37 CYS QB 1 53 ILE MD . . 5.410 2.909 2.447 3.393 . 0 0 "[ . 1 . 2]" 1
1895 1 37 CYS QB 1 75 ILE MG . . 6.290 3.655 3.360 3.930 . 0 0 "[ . 1 . 2]" 1
1896 1 37 CYS QB 1 79 VAL QG . . 5.020 1.986 1.769 2.225 . 0 0 "[ . 1 . 2]" 1
1897 1 37 CYS HG 1 49 LEU QD . . 6.420 3.928 2.736 5.781 . 0 0 "[ . 1 . 2]" 1
1898 1 37 CYS HG 1 52 VAL QG . . 6.420 3.367 2.570 4.490 . 0 0 "[ . 1 . 2]" 1
1899 1 37 CYS HG 1 79 VAL QG . . 6.420 4.138 3.167 4.672 . 0 0 "[ . 1 . 2]" 1
1900 1 38 THR H 1 49 LEU QD . . 6.420 4.411 4.217 5.610 . 0 0 "[ . 1 . 2]" 1
1901 1 38 THR HA 1 79 VAL QG . . 6.420 3.444 2.576 4.404 . 0 0 "[ . 1 . 2]" 1
1902 1 38 THR HA 1 82 VAL QG . . 6.120 2.769 2.419 3.124 . 0 0 "[ . 1 . 2]" 1
1903 1 38 THR HB 1 82 VAL QG . . 5.520 2.174 1.932 2.452 . 0 0 "[ . 1 . 2]" 1
1904 1 38 THR MG 1 79 VAL QG . . 6.800 3.188 2.352 3.932 . 0 0 "[ . 1 . 2]" 1
1905 1 38 THR MG 1 82 VAL QG . . 6.120 1.987 1.779 2.165 . 0 0 "[ . 1 . 2]" 1
1906 1 39 ASP QB 1 40 LEU HA . . 4.670 4.025 3.709 4.292 . 0 0 "[ . 1 . 2]" 1
1907 1 39 ASP QB 1 40 LEU QD . . 5.120 3.685 2.649 4.397 . 0 0 "[ . 1 . 2]" 1
1908 1 40 LEU HA 1 43 GLU QG . . 4.880 3.699 2.587 5.067 0.187 10 0 "[ . 1 . 2]" 1
1909 1 40 LEU QB 1 41 ILE QG . . 5.180 3.385 3.085 3.650 . 0 0 "[ . 1 . 2]" 1
1910 1 40 LEU QB 1 49 LEU QD . . 5.970 2.627 1.951 3.363 . 0 0 "[ . 1 . 2]" 1
1911 1 40 LEU QD 1 45 ASP QB . . 5.000 2.244 1.934 3.188 . 0 0 "[ . 1 . 2]" 1
1912 1 40 LEU QD 1 48 LYS QD . . 5.030 3.520 2.170 4.333 . 0 0 "[ . 1 . 2]" 1
1913 1 40 LEU QD 1 49 LEU HA . . 5.440 2.482 2.067 3.021 . 0 0 "[ . 1 . 2]" 1
1914 1 40 LEU QD 1 49 LEU QB . . 4.960 2.497 1.628 3.172 . 0 0 "[ . 1 . 2]" 1
1915 1 40 LEU QD 1 49 LEU QD . . 7.230 2.816 2.265 3.951 . 0 0 "[ . 1 . 2]" 1
1916 1 40 LEU QD 1 52 VAL QG . . 7.230 2.893 2.292 3.466 . 0 0 "[ . 1 . 2]" 1
1917 1 41 ILE H 1 41 ILE QG . . 4.790 2.028 1.937 2.195 . 0 0 "[ . 1 . 2]" 1
1918 1 41 ILE H 1 46 LEU QB . . 5.340 4.738 3.658 5.872 0.532 20 1 "[ . 1 . +]" 1
1919 1 41 ILE H 1 49 LEU QB . . 5.340 4.505 4.196 5.047 . 0 0 "[ . 1 . 2]" 1
1920 1 41 ILE H 1 49 LEU QD . . 5.470 3.481 3.111 4.385 . 0 0 "[ . 1 . 2]" 1
1921 1 41 ILE H 1 82 VAL QG . . 6.420 4.660 4.468 4.854 . 0 0 "[ . 1 . 2]" 1
1922 1 41 ILE HA 1 46 LEU QB . . 5.340 2.907 2.016 3.813 . 0 0 "[ . 1 . 2]" 1
1923 1 41 ILE HA 1 46 LEU QD . . 5.290 3.509 1.844 4.680 . 0 0 "[ . 1 . 2]" 1
1924 1 41 ILE HA 1 49 LEU QD . . 6.420 3.631 2.993 4.814 . 0 0 "[ . 1 . 2]" 1
1925 1 41 ILE HA 1 83 LEU QD . . 6.420 3.525 3.026 4.140 . 0 0 "[ . 1 . 2]" 1
1926 1 41 ILE MG 1 42 GLU QG . . 6.290 4.438 3.050 6.018 . 0 0 "[ . 1 . 2]" 1
1927 1 41 ILE MG 1 46 LEU QD . . 6.770 3.574 2.147 4.594 . 0 0 "[ . 1 . 2]" 1
1928 1 41 ILE MG 1 82 VAL QG . . 7.390 2.528 2.027 3.065 . 0 0 "[ . 1 . 2]" 1
1929 1 41 ILE QG 1 46 LEU QD . . 5.660 4.026 2.737 5.169 . 0 0 "[ . 1 . 2]" 1
1930 1 41 ILE QG 1 49 LEU QD . . 5.550 2.187 1.851 3.049 . 0 0 "[ . 1 . 2]" 1
1931 1 41 ILE QG 1 82 VAL QG . . 6.190 3.779 3.552 4.108 . 0 0 "[ . 1 . 2]" 1
1932 1 41 ILE QG 1 83 LEU HA . . 5.340 3.713 3.389 4.018 . 0 0 "[ . 1 . 2]" 1
1933 1 41 ILE QG 1 83 LEU QB . . 6.160 3.290 2.712 4.392 . 0 0 "[ . 1 . 2]" 1
1934 1 41 ILE QG 1 83 LEU QD . . 5.610 2.151 1.808 3.099 . 0 0 "[ . 1 . 2]" 1
1935 1 41 ILE MD 1 49 LEU QB . . 6.290 4.886 4.580 5.374 . 0 0 "[ . 1 . 2]" 1
1936 1 41 ILE MD 1 82 VAL QG . . 6.450 2.290 1.851 2.650 . 0 0 "[ . 1 . 2]" 1
1937 1 42 GLU H 1 42 GLU QG . . 4.320 2.496 2.090 4.019 . 0 0 "[ . 1 . 2]" 1
1938 1 42 GLU QG 1 43 GLU H . . 5.340 3.461 2.470 4.273 . 0 0 "[ . 1 . 2]" 1
1939 1 42 GLU QG 1 82 VAL QG . . 5.340 4.197 2.666 5.626 0.286 10 0 "[ . 1 . 2]" 1
1940 1 43 GLU H 1 44 LYS QD . . 5.340 3.966 3.416 4.240 . 0 0 "[ . 1 . 2]" 1
1941 1 43 GLU QB 1 44 LYS QG . . 5.180 5.607 4.276 5.974 0.794 3 12 "[ +****-** ** **]" 1
1942 1 43 GLU QB 1 45 ASP H . . 3.500 2.880 2.486 3.499 . 0 0 "[ . 1 . 2]" 1
1943 1 44 LYS H 1 46 LEU QD . . 6.360 4.719 3.772 5.689 . 0 0 "[ . 1 . 2]" 1
1944 1 44 LYS HA 1 44 LYS QE . . 5.340 4.510 2.947 5.100 . 0 0 "[ . 1 . 2]" 1
1945 1 44 LYS HA 1 46 LEU QD . . 5.750 3.325 2.336 4.368 . 0 0 "[ . 1 . 2]" 1
1946 1 44 LYS QB 1 46 LEU QD . . 7.260 4.023 3.260 4.948 . 0 0 "[ . 1 . 2]" 1
1947 1 45 ASP H 1 46 LEU QB . . 5.200 4.555 3.764 5.152 . 0 0 "[ . 1 . 2]" 1
1948 1 45 ASP H 1 46 LEU QD . . 6.330 4.442 3.317 5.165 . 0 0 "[ . 1 . 2]" 1
1949 1 45 ASP HA 1 46 LEU QD . . 6.420 4.062 3.538 4.695 . 0 0 "[ . 1 . 2]" 1
1950 1 46 LEU H 1 46 LEU QD . . 4.860 2.366 1.750 2.959 . 0 0 "[ . 1 . 2]" 1
1951 1 46 LEU H 1 49 LEU QB . . 4.380 4.400 4.240 4.630 0.250 11 0 "[ . 1 . 2]" 1
1952 1 46 LEU HA 1 49 LEU QD . . 6.000 3.028 2.358 3.632 . 0 0 "[ . 1 . 2]" 1
1953 1 46 LEU QB 1 47 GLU HA . . 4.410 4.806 4.549 5.060 0.650 11 7 "[ ** . *-*1+ . * 2]" 1
1954 1 46 LEU HG 1 49 LEU QD . . 6.420 4.664 3.939 6.022 . 0 0 "[ . 1 . 2]" 1
1955 1 46 LEU QD 1 47 GLU H . . 5.760 2.819 2.209 3.210 . 0 0 "[ . 1 . 2]" 1
1956 1 46 LEU QD 1 47 GLU HA . . 6.420 3.686 2.996 4.473 . 0 0 "[ . 1 . 2]" 1
1957 1 46 LEU QD 1 50 ASP QB . . 7.260 4.364 3.702 5.119 . 0 0 "[ . 1 . 2]" 1
1958 1 46 LEU QD 1 83 LEU QD . . 5.850 2.527 1.857 3.572 . 0 0 "[ . 1 . 2]" 1
1959 1 47 GLU HA 1 51 LEU QD . . 6.420 3.900 3.457 4.450 . 0 0 "[ . 1 . 2]" 1
1960 1 47 GLU QG 1 48 LYS QG . . 6.170 4.491 3.322 6.195 0.025 1 0 "[ . 1 . 2]" 1
1961 1 48 LYS HA 1 51 LEU QB . . 5.110 2.874 2.080 3.438 . 0 0 "[ . 1 . 2]" 1
1962 1 48 LYS HA 1 51 LEU QD . . 5.100 2.876 2.047 3.822 . 0 0 "[ . 1 . 2]" 1
1963 1 48 LYS QB 1 48 LYS QD . . 3.330 2.602 2.308 2.921 . 0 0 "[ . 1 . 2]" 1
1964 1 48 LYS QB 1 48 LYS QE . . 3.850 2.550 1.898 3.747 . 0 0 "[ . 1 . 2]" 1
1965 1 48 LYS QB 1 51 LEU QD . . 6.180 4.407 3.311 5.247 . 0 0 "[ . 1 . 2]" 1
1966 1 48 LYS QE 1 52 VAL QG . . 5.720 3.981 2.594 5.429 . 0 0 "[ . 1 . 2]" 1
1967 1 49 LEU QB 1 50 ASP HA . . 4.500 4.177 4.008 4.363 . 0 0 "[ . 1 . 2]" 1
1968 1 49 LEU QB 1 50 ASP QB . . 6.160 3.917 3.588 4.133 . 0 0 "[ . 1 . 2]" 1
1969 1 49 LEU QB 1 53 ILE MD . . 6.290 5.115 3.817 5.555 . 0 0 "[ . 1 . 2]" 1
1970 1 49 LEU HG 1 53 ILE QG . . 5.080 3.328 2.318 4.395 . 0 0 "[ . 1 . 2]" 1
1971 1 49 LEU QD 1 50 ASP QB . . 7.260 4.308 3.492 4.919 . 0 0 "[ . 1 . 2]" 1
1972 1 49 LEU QD 1 52 VAL HB . . 6.420 3.680 2.274 4.859 . 0 0 "[ . 1 . 2]" 1
1973 1 49 LEU QD 1 53 ILE H . . 6.420 3.829 3.281 4.821 . 0 0 "[ . 1 . 2]" 1
1974 1 49 LEU QD 1 53 ILE HB . . 6.420 3.647 2.675 4.531 . 0 0 "[ . 1 . 2]" 1
1975 1 49 LEU QD 1 53 ILE QG . . 5.160 2.213 1.812 3.348 . 0 0 "[ . 1 . 2]" 1
1976 1 49 LEU QD 1 79 VAL HA . . 6.420 4.351 3.801 4.660 . 0 0 "[ . 1 . 2]" 1
1977 1 49 LEU QD 1 79 VAL QG . . 6.530 1.869 1.661 2.589 . 0 0 "[ . 1 . 2]" 1
1978 1 50 ASP HA 1 52 VAL QG . . 6.420 5.697 5.432 5.911 . 0 0 "[ . 1 . 2]" 1
1979 1 50 ASP HA 1 53 ILE QG . . 5.340 4.399 3.391 5.240 . 0 0 "[ . 1 . 2]" 1
1980 1 50 ASP HA 1 91 LEU QD . . 4.310 3.057 2.341 4.456 0.146 14 0 "[ . 1 . 2]" 1
1981 1 50 ASP QB 1 51 LEU QB . . 6.160 4.208 4.063 4.358 . 0 0 "[ . 1 . 2]" 1
1982 1 50 ASP QB 1 51 LEU QD . . 7.260 2.423 1.874 3.744 . 0 0 "[ . 1 . 2]" 1
1983 1 50 ASP QB 1 52 VAL QG . . 7.260 5.558 5.347 5.816 . 0 0 "[ . 1 . 2]" 1
1984 1 51 LEU HA 1 54 LYS QB . . 4.220 2.801 2.200 3.688 . 0 0 "[ . 1 . 2]" 1
1985 1 51 LEU HA 1 54 LYS QD . . 5.340 3.496 2.420 5.313 . 0 0 "[ . 1 . 2]" 1
1986 1 51 LEU QB 1 52 VAL HA . . 4.700 3.935 3.727 4.080 . 0 0 "[ . 1 . 2]" 1
1987 1 51 LEU QB 1 52 VAL HB . . 5.340 4.677 4.355 4.935 . 0 0 "[ . 1 . 2]" 1
1988 1 51 LEU QD 1 54 LYS QD . . 6.190 3.642 1.966 5.120 . 0 0 "[ . 1 . 2]" 1
1989 1 51 LEU QD 1 54 LYS QE . . 7.260 4.286 2.467 5.197 . 0 0 "[ . 1 . 2]" 1
1990 1 52 VAL QG 1 53 ILE H . . 5.350 3.033 2.742 3.309 . 0 0 "[ . 1 . 2]" 1
1991 1 52 VAL QG 1 53 ILE HA . . 6.330 3.236 2.876 3.505 . 0 0 "[ . 1 . 2]" 1
1992 1 52 VAL QG 1 53 ILE QG . . 5.880 3.242 2.449 4.173 . 0 0 "[ . 1 . 2]" 1
1993 1 52 VAL QG 1 53 ILE MD . . 7.390 3.119 2.369 4.126 . 0 0 "[ . 1 . 2]" 1
1994 1 52 VAL QG 1 56 MET ME . . 5.570 2.204 1.788 2.974 . 0 0 "[ . 1 . 2]" 1
1995 1 53 ILE HA 1 56 MET QB . . 4.650 2.975 2.045 4.249 . 0 0 "[ . 1 . 2]" 1
1996 1 53 ILE MG 1 76 LEU QD . . 6.270 2.047 1.797 2.310 . 0 0 "[ . 1 . 2]" 1
1997 1 53 ILE QG 1 56 MET ME . . 5.280 3.848 2.506 4.678 . 0 0 "[ . 1 . 2]" 1
1998 1 53 ILE QG 1 75 ILE MG . . 6.260 4.059 2.909 5.023 . 0 0 "[ . 1 . 2]" 1
1999 1 53 ILE QG 1 76 LEU QD . . 4.430 3.626 2.172 4.331 . 0 0 "[ . 1 . 2]" 1
2000 1 53 ILE QG 1 79 VAL QG . . 5.720 2.572 2.021 3.339 . 0 0 "[ . 1 . 2]" 1
2001 1 53 ILE QG 1 91 LEU QD . . 6.050 3.463 2.127 5.216 . 0 0 "[ . 1 . 2]" 1
2002 1 53 ILE MD 1 79 VAL QG . . 6.270 2.116 1.747 2.506 . 0 0 "[ . 1 . 2]" 1
2003 1 54 LYS HA 1 57 LYS QG . . 5.340 3.326 1.720 4.962 . 0 0 "[ . 1 . 2]" 1
2004 1 54 LYS HA 1 76 LEU QD . . 6.420 4.941 4.163 5.957 . 0 0 "[ . 1 . 2]" 1
2005 1 54 LYS HA 1 93 VAL QG . . 6.420 2.471 1.813 3.227 . 0 0 "[ . 1 . 2]" 1
2006 1 54 LYS QB 1 57 LYS QD . . 6.160 4.657 3.634 5.819 . 0 0 "[ . 1 . 2]" 1
2007 1 54 LYS QG 1 93 VAL HB . . 5.340 4.431 3.103 5.982 0.642 2 1 "[ + . 1 . 2]" 1
2008 1 54 LYS QG 1 93 VAL QG . . 4.970 1.979 1.688 3.103 . 0 0 "[ . 1 . 2]" 1
2009 1 54 LYS QD 1 93 VAL HA . . 5.340 4.348 3.036 5.898 0.558 16 1 "[ . 1 .+ 2]" 1
2010 1 55 TYR QB 1 56 MET ME . . 6.230 4.783 4.211 5.054 . 0 0 "[ . 1 . 2]" 1
2011 1 56 MET HA 1 59 LEU QB . . 4.210 3.440 2.533 4.215 0.005 15 0 "[ . 1 . 2]" 1
2012 1 56 MET QB 1 59 LEU QD . . 6.180 4.606 3.936 5.318 . 0 0 "[ . 1 . 2]" 1
2013 1 56 MET QB 1 60 MET ME . . 5.660 3.441 2.059 4.391 . 0 0 "[ . 1 . 2]" 1
2014 1 57 LYS HA 1 60 MET QB . . 4.100 2.752 2.094 3.370 . 0 0 "[ . 1 . 2]" 1
2015 1 57 LYS HA 1 76 LEU QD . . 5.700 4.065 2.829 5.288 . 0 0 "[ . 1 . 2]" 1
2016 1 57 LYS QB 1 76 LEU QD . . 7.260 2.903 1.911 3.946 . 0 0 "[ . 1 . 2]" 1
2017 1 57 LYS QG 1 58 ARG HA . . 5.340 4.113 3.034 5.530 0.190 16 0 "[ . 1 . 2]" 1
2018 1 57 LYS QG 1 76 LEU QD . . 6.190 3.180 1.949 4.200 . 0 0 "[ . 1 . 2]" 1
2019 1 57 LYS QD 1 93 VAL QG . . 7.260 2.374 1.769 3.740 . 0 0 "[ . 1 . 2]" 1
2020 1 58 ARG QG 1 59 LEU HA . . 5.340 3.974 3.276 5.888 0.548 8 1 "[ . + 1 . 2]" 1
2021 1 58 ARG QG 1 61 GLN QB . . 6.160 4.712 3.617 5.598 . 0 0 "[ . 1 . 2]" 1
2022 1 59 LEU HA 1 62 GLN QB . . 4.380 3.323 2.116 4.308 . 0 0 "[ . 1 . 2]" 1
2023 1 59 LEU QB 1 60 MET HA . . 4.120 3.992 3.850 4.150 0.030 6 0 "[ . 1 . 2]" 1
2024 1 59 LEU QB 1 60 MET ME . . 5.630 4.735 4.420 5.261 . 0 0 "[ . 1 . 2]" 1
2025 1 59 LEU QB 1 62 GLN QG . . 6.160 4.115 3.513 5.335 . 0 0 "[ . 1 . 2]" 1
2026 1 59 LEU QD 1 60 MET H . . 6.420 4.077 3.936 4.231 . 0 0 "[ . 1 . 2]" 1
2027 1 59 LEU QD 1 60 MET ME . . 7.390 5.074 4.687 5.639 . 0 0 "[ . 1 . 2]" 1
2028 1 60 MET HA 1 68 TRP QB . . 5.340 2.720 2.227 3.471 . 0 0 "[ . 1 . 2]" 1
2029 1 60 MET QB 1 69 ASN HA . . 5.340 3.009 2.429 3.941 . 0 0 "[ . 1 . 2]" 1
2030 1 60 MET QB 1 72 PHE QB . . 5.180 2.112 1.674 2.883 . 0 0 "[ . 1 . 2]" 1
2031 1 60 MET QG 1 68 TRP HA . . 5.340 3.422 2.831 3.998 . 0 0 "[ . 1 . 2]" 1
2032 1 60 MET QG 1 68 TRP HZ3 . . 5.340 4.680 3.944 5.875 0.535 3 1 "[ + . 1 . 2]" 1
2033 1 60 MET QG 1 71 ALA MB . . 6.000 3.738 2.557 4.651 . 0 0 "[ . 1 . 2]" 1
2034 1 63 SER HA 1 64 VAL QG . . 5.790 3.528 3.268 4.055 . 0 0 "[ . 1 . 2]" 1
2035 1 63 SER QB 1 64 VAL QG . . 7.260 4.610 4.252 4.850 . 0 0 "[ . 1 . 2]" 1
2036 1 63 SER QB 1 68 TRP QB . . 6.160 3.008 2.118 4.095 . 0 0 "[ . 1 . 2]" 1
2037 1 64 VAL HA 1 69 ASN QD . . 5.340 3.783 1.771 4.744 . 0 0 "[ . 1 . 2]" 1
2038 1 64 VAL QG 1 65 GLU H . . 4.900 2.956 2.167 3.686 . 0 0 "[ . 1 . 2]" 1
2039 1 64 VAL QG 1 65 GLU HA . . 6.420 3.912 3.410 4.254 . 0 0 "[ . 1 . 2]" 1
2040 1 64 VAL QG 1 65 GLU QB . . 7.260 3.152 2.448 4.000 . 0 0 "[ . 1 . 2]" 1
2041 1 64 VAL QG 1 65 GLU QG . . 5.690 2.369 1.754 4.115 . 0 0 "[ . 1 . 2]" 1
2042 1 65 GLU HA 1 66 SER QB . . 4.880 4.691 4.126 5.185 0.305 15 0 "[ . 1 . 2]" 1
2043 1 66 SER HA 1 67 VAL QG . . 6.420 3.630 3.495 3.884 . 0 0 "[ . 1 . 2]" 1
2044 1 67 VAL QG 1 68 TRP HA . . 6.420 3.735 3.243 4.025 . 0 0 "[ . 1 . 2]" 1
2045 1 67 VAL QG 1 70 MET ME . . 6.950 2.981 1.935 4.402 . 0 0 "[ . 1 . 2]" 1
2046 1 67 VAL QG 1 71 ALA HA . . 6.420 5.212 4.261 6.057 . 0 0 "[ . 1 . 2]" 1
2047 1 68 TRP QB 1 71 ALA MB . . 6.290 3.858 3.544 4.508 . 0 0 "[ . 1 . 2]" 1
2048 1 69 ASN H 1 72 PHE QB . . 4.940 4.583 4.261 5.217 0.277 7 0 "[ . 1 . 2]" 1
2049 1 69 ASN HA 1 72 PHE QB . . 3.920 2.384 1.796 3.187 . 0 0 "[ . 1 . 2]" 1
2050 1 69 ASN QB 1 70 MET QG . . 6.160 3.447 2.860 4.947 . 0 0 "[ . 1 . 2]" 1
2051 1 70 MET HA 1 73 ASP QB . . 4.080 2.790 2.510 3.343 . 0 0 "[ . 1 . 2]" 1
2052 1 71 ALA MB 1 72 PHE QB . . 6.290 3.969 3.753 4.210 . 0 0 "[ . 1 . 2]" 1
2053 1 72 PHE QB 1 73 ASP HA . . 4.850 4.374 4.197 4.859 0.009 7 0 "[ . 1 . 2]" 1
2054 1 72 PHE QD 1 76 LEU QD . . 8.440 3.169 2.217 3.868 . 0 0 "[ . 1 . 2]" 1
2055 1 73 ASP HA 1 76 LEU QB . . 3.700 3.273 2.588 3.697 . 0 0 "[ . 1 . 2]" 1
2056 1 73 ASP HA 1 76 LEU QD . . 6.300 4.064 3.025 4.694 . 0 0 "[ . 1 . 2]" 1
2057 1 74 PHE H 1 77 ASP QB . . 4.470 4.793 4.598 4.954 0.484 7 0 "[ . 1 . 2]" 1
2058 1 74 PHE HA 1 75 ILE QG . . 5.340 5.020 4.874 5.146 . 0 0 "[ . 1 . 2]" 1
2059 1 75 ILE HA 1 76 LEU QD . . 6.420 5.329 4.315 5.929 . 0 0 "[ . 1 . 2]" 1
2060 1 75 ILE HA 1 78 ASN QB . . 4.560 3.145 2.535 3.677 . 0 0 "[ . 1 . 2]" 1
2061 1 75 ILE HA 1 78 ASN QD . . 5.340 3.531 2.641 5.667 0.327 20 0 "[ . 1 . 2]" 1
2062 1 75 ILE MD 1 76 LEU QD . . 7.390 4.921 3.629 5.831 . 0 0 "[ . 1 . 2]" 1
2063 1 76 LEU HA 1 79 VAL QG . . 5.520 2.021 1.824 2.208 . 0 0 "[ . 1 . 2]" 1
2064 1 76 LEU HA 1 80 GLN QG . . 5.340 3.932 3.259 5.968 0.628 13 2 "[ . 1- + . 2]" 1
2065 1 76 LEU QB 1 80 GLN QG . . 5.180 4.310 3.089 5.768 0.588 15 2 "[ . 1 - + 2]" 1
2066 1 76 LEU HG 1 80 GLN QG . . 5.340 4.583 2.726 6.048 0.708 6 4 "[ * *+- 1 . 2]" 1
2067 1 76 LEU QD 1 80 GLN QG . . 5.600 3.174 2.256 4.617 . 0 0 "[ . 1 . 2]" 1
2068 1 77 ASP HA 1 80 GLN QB . . 4.030 3.202 2.935 3.451 . 0 0 "[ . 1 . 2]" 1
2069 1 77 ASP QB 1 81 VAL QG . . 6.190 4.022 3.857 4.275 . 0 0 "[ . 1 . 2]" 1
2070 1 78 ASN H 1 79 VAL QG . . 5.850 4.011 3.669 4.209 . 0 0 "[ . 1 . 2]" 1
2071 1 78 ASN H 1 81 VAL QG . . 6.420 4.302 3.970 4.689 . 0 0 "[ . 1 . 2]" 1
2072 1 78 ASN HA 1 81 VAL QG . . 5.010 2.998 2.521 3.447 . 0 0 "[ . 1 . 2]" 1
2073 1 78 ASN QB 1 79 VAL QG . . 6.190 3.909 3.162 4.263 . 0 0 "[ . 1 . 2]" 1
2074 1 79 VAL HA 1 82 VAL QG . . 5.630 3.358 2.142 3.782 . 0 0 "[ . 1 . 2]" 1
2075 1 79 VAL HB 1 82 VAL QG . . 6.300 5.082 4.096 5.504 . 0 0 "[ . 1 . 2]" 1
2076 1 79 VAL QG 1 80 GLN QB . . 6.190 3.433 2.819 3.740 . 0 0 "[ . 1 . 2]" 1
2077 1 79 VAL QG 1 80 GLN QG . . 6.190 2.563 2.015 4.525 . 0 0 "[ . 1 . 2]" 1
2078 1 79 VAL QG 1 83 LEU QB . . 7.260 3.212 2.748 3.879 . 0 0 "[ . 1 . 2]" 1
2079 1 79 VAL QG 1 83 LEU HG . . 6.420 5.202 2.734 6.047 . 0 0 "[ . 1 . 2]" 1
2080 1 80 GLN H 1 81 VAL QG . . 6.420 4.101 3.969 4.299 . 0 0 "[ . 1 . 2]" 1
2081 1 80 GLN H 1 82 VAL QG . . 6.030 5.119 4.288 5.439 . 0 0 "[ . 1 . 2]" 1
2082 1 80 GLN HA 1 83 LEU QD . . 5.790 2.985 1.954 4.122 . 0 0 "[ . 1 . 2]" 1
2083 1 80 GLN HA 1 91 LEU QD . . 6.420 4.428 2.575 5.462 . 0 0 "[ . 1 . 2]" 1
2084 1 80 GLN QB 1 81 VAL QG . . 6.180 3.475 3.123 3.834 . 0 0 "[ . 1 . 2]" 1
2085 1 80 GLN QB 1 90 THR MG . . 5.190 2.434 1.820 4.187 . 0 0 "[ . 1 . 2]" 1
2086 1 80 GLN QG 1 90 THR MG . . 6.290 3.091 2.149 3.919 . 0 0 "[ . 1 . 2]" 1
2087 1 80 GLN QG 1 91 LEU HG . . 5.340 3.987 1.937 5.980 0.640 11 1 "[ . 1+ . 2]" 1
2088 1 80 GLN QE 1 90 THR HA . . 5.340 4.494 2.865 5.391 0.051 2 0 "[ . 1 . 2]" 1
2089 1 80 GLN QE 1 90 THR HB . . 4.750 3.594 1.734 5.139 0.389 2 0 "[ . 1 . 2]" 1
2090 1 80 GLN QE 1 93 VAL QG . . 5.360 3.723 2.044 4.944 . 0 0 "[ . 1 . 2]" 1
2091 1 81 VAL H 1 81 VAL QG . . 4.030 2.361 2.287 2.510 . 0 0 "[ . 1 . 2]" 1
2092 1 81 VAL H 1 82 VAL QG . . 6.420 4.177 3.751 4.314 . 0 0 "[ . 1 . 2]" 1
2093 1 81 VAL HA 1 84 GLN QB . . 4.110 3.165 2.407 4.191 0.081 6 0 "[ . 1 . 2]" 1
2094 1 81 VAL HA 1 85 GLN QG . . 5.340 4.068 3.775 4.297 . 0 0 "[ . 1 . 2]" 1
2095 1 81 VAL QG 1 82 VAL H . . 5.140 3.029 2.861 3.216 . 0 0 "[ . 1 . 2]" 1
2096 1 81 VAL QG 1 82 VAL HA . . 5.850 3.301 3.121 3.515 . 0 0 "[ . 1 . 2]" 1
2097 1 81 VAL QG 1 83 LEU H . . 6.420 4.564 4.456 4.732 . 0 0 "[ . 1 . 2]" 1
2098 1 81 VAL QG 1 85 GLN QG . . 5.360 3.136 2.857 3.371 . 0 0 "[ . 1 . 2]" 1
2099 1 81 VAL QG 1 85 GLN QE . . 5.150 2.232 1.835 3.698 . 0 0 "[ . 1 . 2]" 1
2100 1 82 VAL HA 1 85 GLN QB . . 3.640 2.678 2.107 3.069 . 0 0 "[ . 1 . 2]" 1
2101 1 82 VAL QG 1 83 LEU H . . 5.410 3.292 2.354 3.439 . 0 0 "[ . 1 . 2]" 1
2102 1 82 VAL QG 1 83 LEU HA . . 6.420 3.560 3.280 3.849 . 0 0 "[ . 1 . 2]" 1
2103 1 82 VAL QG 1 83 LEU QB . . 7.260 4.109 3.256 4.707 . 0 0 "[ . 1 . 2]" 1
2104 1 82 VAL QG 1 85 GLN QB . . 6.190 3.529 2.928 3.906 . 0 0 "[ . 1 . 2]" 1
2105 1 82 VAL QG 1 85 GLN QG . . 6.190 4.492 3.939 4.863 . 0 0 "[ . 1 . 2]" 1
2106 1 82 VAL QG 1 86 THR MG . . 7.390 3.575 2.547 4.161 . 0 0 "[ . 1 . 2]" 1
2107 1 83 LEU QB 1 91 LEU QD . . 7.260 4.021 2.084 4.689 . 0 0 "[ . 1 . 2]" 1
2108 1 83 LEU QD 1 84 GLN HA . . 6.420 4.514 3.782 5.159 . 0 0 "[ . 1 . 2]" 1
2109 1 83 LEU QD 1 87 TYR HA . . 6.420 4.664 4.365 5.732 . 0 0 "[ . 1 . 2]" 1
2110 1 83 LEU QD 1 87 TYR QB . . 6.180 2.315 2.056 3.670 . 0 0 "[ . 1 . 2]" 1
2111 1 83 LEU QD 1 87 TYR QE . . 8.440 3.959 2.129 4.676 . 0 0 "[ . 1 . 2]" 1
2112 1 83 LEU QD 1 89 SER QB . . 6.190 3.718 1.772 4.868 . 0 0 "[ . 1 . 2]" 1
2113 1 83 LEU QD 1 90 THR HA . . 5.120 2.329 1.858 3.741 . 0 0 "[ . 1 . 2]" 1
2114 1 83 LEU QD 1 90 THR HB . . 6.420 4.088 3.052 5.749 . 0 0 "[ . 1 . 2]" 1
2115 1 83 LEU QD 1 91 LEU HA . . 6.420 4.004 3.123 4.490 . 0 0 "[ . 1 . 2]" 1
2116 1 84 GLN H 1 85 GLN QG . . 5.340 4.263 4.075 4.485 . 0 0 "[ . 1 . 2]" 1
2117 1 84 GLN HA 1 89 SER QB . . 5.340 4.976 4.434 5.731 0.391 16 0 "[ . 1 . 2]" 1
2118 1 84 GLN QB 1 85 GLN H . . 4.000 2.957 2.283 3.708 . 0 0 "[ . 1 . 2]" 1
2119 1 85 GLN H 1 85 GLN QG . . 4.330 2.426 2.225 2.594 . 0 0 "[ . 1 . 2]" 1
2120 1 85 GLN HA 1 85 GLN QG . . 3.670 2.448 2.397 2.506 . 0 0 "[ . 1 . 2]" 1
2121 1 85 GLN QB 1 86 THR HA . . 4.290 3.943 3.827 4.064 . 0 0 "[ . 1 . 2]" 1
2122 1 87 TYR H 1 88 GLY QA . . 4.410 4.255 4.040 4.416 0.006 12 0 "[ . 1 . 2]" 1
2123 1 88 GLY QA 1 89 SER HA . . 4.670 4.099 4.056 4.132 . 0 0 "[ . 1 . 2]" 1
2124 1 91 LEU HA 1 92 LYS QB . . 4.030 4.440 4.265 4.670 0.640 9 2 "[ . - +1 . 2]" 1
2125 1 91 LEU QD 1 92 LYS H . . 5.170 3.892 3.228 4.543 . 0 0 "[ . 1 . 2]" 1
2126 1 91 LEU QD 1 92 LYS HA . . 6.420 3.899 3.059 5.098 . 0 0 "[ . 1 . 2]" 1
2127 1 91 LEU QD 1 93 VAL HA . . 6.420 3.968 2.675 5.410 . 0 0 "[ . 1 . 2]" 1
2128 1 92 LYS HA 1 93 VAL QG . . 5.850 3.478 3.150 3.938 . 0 0 "[ . 1 . 2]" 1
2129 1 93 VAL QG 1 94 THR H . . 4.530 3.210 2.201 3.814 . 0 0 "[ . 1 . 2]" 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 88
_Distance_constraint_stats_list.Viol_count 256
_Distance_constraint_stats_list.Viol_total 1524.059
_Distance_constraint_stats_list.Viol_max 1.853
_Distance_constraint_stats_list.Viol_rms 0.1581
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0433
_Distance_constraint_stats_list.Viol_average_violations_only 0.2977
_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 2 LEU 0.218 0.218 12 0 "[ . 1 . 2]"
1 3 ALA 12.961 1.062 16 11 "[** . ***1* -+* **]"
1 14 LEU 0.075 0.075 18 0 "[ . 1 . 2]"
1 15 LEU 3.475 0.428 11 0 "[ . 1 . 2]"
1 18 TRP 0.024 0.023 17 0 "[ . 1 . 2]"
1 22 ILE 4.518 0.668 17 3 "[ . * 1 . + -2]"
1 26 MET 8.597 1.093 11 7 "[ . - *1+ **** 2]"
1 28 GLU 5.797 0.800 17 6 "[ - .* *1* * + 2]"
1 32 GLN 0.364 0.214 15 0 "[ . 1 . 2]"
1 33 VAL 9.273 0.742 19 6 "[* - . 1 ** *+2]"
2 3 ASN 1.204 0.208 15 0 "[ . 1 . 2]"
2 4 MET 3.303 0.478 15 0 "[ . 1 . 2]"
2 5 MET 7.622 0.620 17 2 "[ - 1 . + 2]"
2 6 SER 4.387 0.687 15 3 "[ . - 1* + 2]"
2 7 ASN 5.871 0.800 17 6 "[ - .* *1* * + 2]"
2 8 PHE 9.685 1.093 11 8 "[ . **1+ **.** -2]"
2 9 PHE 24.482 1.853 20 12 "[ * *** *** ** -* +]"
2 10 GLY 7.464 0.742 19 5 "[* - . 1 *. *+2]"
2 11 LYS 0.584 0.297 9 0 "[ . 1 . 2]"
2 12 ALA 16.112 1.853 20 13 "[ * *** ***-** ** +]"
2 13 ALA 7.093 1.062 16 4 "[ . *1- *+ 2]"
2 14 MET 10.248 0.870 1 10 "[+* . *- 1* .*****]"
2 15 ASN 2.988 0.607 18 1 "[ . 1 . + 2]"
2 16 LYS 0.732 0.129 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 2 10 GLY H 2 11 LYS H . . 3.920 3.354 2.791 4.217 0.297 9 0 "[ . 1 . 2]" 2
2 2 9 PHE H 2 10 GLY H . . 4.080 2.949 2.279 4.551 0.471 9 0 "[ . 1 . 2]" 2
3 2 9 PHE QB 2 10 GLY H . . 4.450 2.065 1.507 2.378 . 0 0 "[ . 1 . 2]" 2
4 2 9 PHE HA 2 10 GLY H . . 3.760 3.493 2.624 3.617 . 0 0 "[ . 1 . 2]" 2
5 2 5 MET HB2 2 6 SER H . . 4.600 4.135 3.068 4.589 . 0 0 "[ . 1 . 2]" 2
6 2 5 MET HB3 2 6 SER H . . 4.420 4.254 3.788 4.633 0.213 18 0 "[ . 1 . 2]" 2
7 2 5 MET H 2 6 SER H . . 3.910 3.050 1.610 4.028 0.118 7 0 "[ . 1 . 2]" 2
8 2 5 MET HA 2 6 SER H . . 3.260 2.747 2.193 3.533 0.273 8 0 "[ . 1 . 2]" 2
9 2 11 LYS H 2 12 ALA H . . 4.050 2.307 1.954 2.815 . 0 0 "[ . 1 . 2]" 2
10 2 11 LYS H 2 11 LYS HB2 . . 4.170 2.882 2.128 3.638 . 0 0 "[ . 1 . 2]" 2
11 2 10 GLY QA 2 11 LYS H . . 3.710 2.658 2.198 2.996 . 0 0 "[ . 1 . 2]" 2
12 2 9 PHE H 2 9 PHE QB . . 3.730 2.300 2.074 2.519 . 0 0 "[ . 1 . 2]" 2
13 2 9 PHE H 2 9 PHE QD . . 4.210 3.511 2.486 4.280 0.070 20 0 "[ . 1 . 2]" 2
14 2 8 PHE HA 2 9 PHE H . . 4.220 3.512 3.429 3.583 . 0 0 "[ . 1 . 2]" 2
15 2 9 PHE QB 2 9 PHE QE . . 4.550 3.925 3.894 3.955 . 0 0 "[ . 1 . 2]" 2
16 2 9 PHE HA 2 9 PHE QE . . 4.770 4.491 4.054 4.771 0.001 8 0 "[ . 1 . 2]" 2
17 2 11 LYS HB2 2 12 ALA H . . 4.760 3.748 3.390 4.142 . 0 0 "[ . 1 . 2]" 2
18 2 11 LYS HB3 2 12 ALA H . . 4.640 2.721 2.108 4.101 . 0 0 "[ . 1 . 2]" 2
19 2 12 ALA H 2 13 ALA H . . 3.640 2.981 2.175 4.439 0.799 16 2 "[ . 1- .+ 2]" 2
20 2 12 ALA H 2 12 ALA MB . . 3.340 2.287 2.231 2.374 . 0 0 "[ . 1 . 2]" 2
21 2 15 ASN HA 2 16 LYS H . . 3.490 2.610 2.137 3.599 0.109 20 0 "[ . 1 . 2]" 2
22 2 5 MET H 2 5 MET HG3 . . 4.460 3.158 2.273 4.789 0.329 13 0 "[ . 1 . 2]" 2
23 2 5 MET H 2 5 MET HB2 . . 3.600 2.993 2.473 3.691 0.091 8 0 "[ . 1 . 2]" 2
24 2 5 MET H 2 5 MET HB3 . . 3.910 3.772 2.713 4.151 0.241 8 0 "[ . 1 . 2]" 2
25 2 5 MET H 2 5 MET HG2 . . 4.260 3.723 2.168 4.880 0.620 17 2 "[ - 1 . + 2]" 2
26 2 4 MET HA 2 5 MET H . . 3.100 2.678 2.132 3.578 0.478 15 0 "[ . 1 . 2]" 2
27 2 7 ASN QB 2 8 PHE H . . 4.440 3.233 2.170 3.944 . 0 0 "[ . 1 . 2]" 2
28 2 7 ASN HA 2 8 PHE H . . 3.920 2.259 2.067 2.585 . 0 0 "[ . 1 . 2]" 2
29 2 8 PHE H 2 8 PHE QD . . 5.240 4.061 3.108 4.449 . 0 0 "[ . 1 . 2]" 2
30 2 14 MET H 2 14 MET HB2 . . 3.980 3.237 2.471 4.034 0.054 12 0 "[ . 1 . 2]" 2
31 2 13 ALA MB 2 14 MET H . . 3.640 3.065 1.906 3.738 0.098 15 0 "[ . 1 . 2]" 2
32 2 14 MET H 2 14 MET HG3 . . 4.990 4.258 2.824 5.133 0.143 9 0 "[ . 1 . 2]" 2
33 2 14 MET H 2 14 MET HG2 . . 5.020 4.329 2.095 5.374 0.354 16 0 "[ . 1 . 2]" 2
34 2 13 ALA HA 2 14 MET H . . 3.210 2.521 2.054 3.462 0.252 7 0 "[ . 1 . 2]" 2
35 2 8 PHE HA 2 8 PHE QD . . 4.050 2.869 2.131 3.713 . 0 0 "[ . 1 . 2]" 2
36 2 4 MET H 2 4 MET HB2 . . 4.090 2.847 2.431 3.680 . 0 0 "[ . 1 . 2]" 2
37 2 4 MET H 2 4 MET HG3 . . 5.220 3.694 2.055 4.978 . 0 0 "[ . 1 . 2]" 2
38 2 4 MET H 2 4 MET HG2 . . 4.940 3.920 2.094 5.193 0.253 13 0 "[ . 1 . 2]" 2
39 2 3 ASN HA 2 4 MET H . . 3.380 2.960 2.149 3.588 0.208 15 0 "[ . 1 . 2]" 2
40 2 13 ALA H 2 13 ALA MB . . 3.080 2.402 2.247 2.725 . 0 0 "[ . 1 . 2]" 2
41 2 8 PHE QB 2 8 PHE QE . . 4.210 3.962 3.941 3.976 . 0 0 "[ . 1 . 2]" 2
42 2 9 PHE QD 2 10 GLY H . . 4.540 3.815 2.939 4.388 . 0 0 "[ . 1 . 2]" 2
43 2 9 PHE HA 2 9 PHE QD . . 3.520 2.640 1.770 3.074 . 0 0 "[ . 1 . 2]" 2
44 2 9 PHE QD 2 12 ALA MB . . 4.650 5.274 3.362 6.503 1.853 20 12 "[ * *** *-* ** ** +]" 2
45 2 15 ASN H 2 16 LYS H . . 4.370 3.496 1.864 4.499 0.129 10 0 "[ . 1 . 2]" 2
46 2 14 MET H 2 15 ASN H . . 3.800 3.107 1.854 4.407 0.607 18 1 "[ . 1 . + 2]" 2
47 2 14 MET HA 2 15 ASN H . . 3.540 3.177 2.204 3.606 0.066 16 0 "[ . 1 . 2]" 2
48 2 6 SER QB 2 7 ASN H . . 4.480 3.150 1.991 4.085 . 0 0 "[ . 1 . 2]" 2
49 2 6 SER HA 2 7 ASN H . . 3.600 2.605 2.138 3.579 . 0 0 "[ . 1 . 2]" 2
50 1 2 LEU QD 2 9 PHE QB . . 5.000 4.297 2.771 5.218 0.218 12 0 "[ . 1 . 2]" 2
51 1 2 LEU QD 2 9 PHE QD . . 5.000 3.124 2.071 3.977 . 0 0 "[ . 1 . 2]" 2
52 1 3 ALA MB 2 13 ALA MB . . 4.000 2.869 1.873 5.062 1.062 16 2 "[ . 1- .+ 2]" 2
53 1 3 ALA MB 2 9 PHE QB . . 3.400 2.977 1.640 3.673 0.273 13 0 "[ . 1 . 2]" 2
54 1 3 ALA MB 2 10 GLY QA . . 4.000 2.652 1.892 4.136 0.136 10 0 "[ . 1 . 2]" 2
55 1 3 ALA MB 2 13 ALA HA . . 4.500 4.097 1.796 5.083 0.583 9 2 "[ . +1 - 2]" 2
56 1 3 ALA MB 2 9 PHE HA . . 4.000 3.473 2.765 4.088 0.088 5 0 "[ . 1 . 2]" 2
57 1 3 ALA MB 2 9 PHE QD . . 4.000 2.645 1.719 4.106 0.106 19 0 "[ . 1 . 2]" 2
58 1 3 ALA MB 2 10 GLY H . . 5.000 3.682 2.188 4.580 . 0 0 "[ . 1 . 2]" 2
59 1 3 ALA MB 2 14 MET H . . 5.000 4.257 2.622 5.136 0.136 18 0 "[ . 1 . 2]" 2
60 1 3 ALA HA 2 14 MET HA . . 5.500 5.554 4.327 6.370 0.870 1 9 "[+* . *- 1* .** **]" 2
61 1 14 LEU QD 2 12 ALA MB . . 4.500 2.817 1.914 3.826 . 0 0 "[ . 1 . 2]" 2
62 1 14 LEU QD 2 7 ASN QB . . 6.000 5.591 5.169 6.075 0.075 18 0 "[ . 1 . 2]" 2
63 1 14 LEU QD 2 9 PHE QB . . 5.000 3.035 2.116 4.359 . 0 0 "[ . 1 . 2]" 2
64 1 15 LEU H 2 9 PHE QD . . 5.000 4.991 4.173 5.428 0.428 11 0 "[ . 1 . 2]" 2
65 1 18 TRP HE1 2 8 PHE QB . . 5.000 4.091 3.262 5.023 0.023 17 0 "[ . 1 . 2]" 2
66 1 18 TRP H 2 8 PHE QE . . 4.000 2.768 2.238 3.445 . 0 0 "[ . 1 . 2]" 2
67 1 22 ILE MD 2 8 PHE QB . . 4.500 2.773 2.332 2.965 . 0 0 "[ . 1 . 2]" 2
68 1 22 ILE MD 2 8 PHE HA . . 4.500 4.718 4.400 5.168 0.668 17 3 "[ . * 1 . + -2]" 2
69 1 22 ILE MG 2 8 PHE QB . . 5.000 3.722 3.172 4.483 . 0 0 "[ . 1 . 2]" 2
70 1 22 ILE MG 2 8 PHE QD . . 5.000 4.499 4.271 4.909 . 0 0 "[ . 1 . 2]" 2
71 1 26 MET ME 2 3 ASN QB . . 6.000 4.306 2.478 5.983 . 0 0 "[ . 1 . 2]" 2
72 1 26 MET ME 2 6 SER QB . . 4.000 3.596 2.643 4.687 0.687 15 3 "[ . - 1* + 2]" 2
73 1 26 MET ME 2 8 PHE HA . . 4.000 4.090 3.348 5.093 1.093 11 5 "[ . *1+ *-.* 2]" 2
74 1 26 MET ME 2 3 ASN HA . . 6.000 5.057 2.914 6.109 0.109 14 0 "[ . 1 . 2]" 2
75 1 26 MET ME 2 3 ASN HD21 . . 6.000 4.814 2.548 6.133 0.133 10 0 "[ . 1 . 2]" 2
76 1 28 GLU QG 2 7 ASN HD21 . . 4.000 3.931 2.219 4.800 0.800 17 6 "[ - .* *1* * + 2]" 2
77 1 28 GLU QG 2 7 ASN HD22 . . 5.000 3.630 1.985 5.082 0.082 6 0 "[ . 1 . 2]" 2
78 1 28 GLU HB2 2 7 ASN HD21 . . 5.000 3.641 2.453 5.037 0.037 1 0 "[ . 1 . 2]" 2
79 1 28 GLU HB3 2 7 ASN HD21 . . 5.000 3.531 2.405 5.238 0.238 19 0 "[ . 1 . 2]" 2
80 1 32 GLN QB 2 9 PHE QB . . 4.500 3.735 2.879 4.714 0.214 15 0 "[ . 1 . 2]" 2
81 1 32 GLN QB 2 9 PHE QD . . 5.000 3.972 2.187 4.819 . 0 0 "[ . 1 . 2]" 2
82 1 32 GLN HG2 2 9 PHE QB . . 5.000 2.955 2.069 3.714 . 0 0 "[ . 1 . 2]" 2
83 1 32 GLN HG2 2 9 PHE QD . . 5.000 3.342 2.233 4.901 . 0 0 "[ . 1 . 2]" 2
84 1 32 GLN HG3 2 9 PHE QB . . 5.000 3.598 2.898 4.006 . 0 0 "[ . 1 . 2]" 2
85 1 32 GLN HG3 2 9 PHE QD . . 5.000 3.288 2.373 5.042 0.042 5 0 "[ . 1 . 2]" 2
86 1 33 VAL QG 2 9 PHE QD . . 3.000 2.993 2.375 3.674 0.674 15 1 "[ . 1 + 2]" 2
87 1 33 VAL QG 2 9 PHE QE . . 5.000 2.347 1.653 3.028 . 0 0 "[ . 1 . 2]" 2
88 1 33 VAL QG 2 10 GLY H . . 5.500 5.751 5.110 6.242 0.742 19 5 "[* - . 1 *. *+2]" 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 103
_Distance_constraint_stats_list.Viol_count 1211
_Distance_constraint_stats_list.Viol_total 3788.349
_Distance_constraint_stats_list.Viol_max 0.456
_Distance_constraint_stats_list.Viol_rms 0.1076
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0920
_Distance_constraint_stats_list.Viol_average_violations_only 0.1564
_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 2 LEU 3.981 0.339 9 0 "[ . 1 . 2]"
1 5 ALA 3.981 0.339 9 0 "[ . 1 . 2]"
1 7 GLU 2.384 0.241 18 0 "[ . 1 . 2]"
1 8 PHE 0.767 0.240 16 0 "[ . 1 . 2]"
1 9 ASN 2.283 0.229 5 0 "[ . 1 . 2]"
1 10 ASP 4.279 0.310 18 0 "[ . 1 . 2]"
1 11 VAL 3.977 0.294 18 0 "[ . 1 . 2]"
1 12 LYS 4.024 0.306 8 0 "[ . 1 . 2]"
1 13 THR 2.283 0.229 5 0 "[ . 1 . 2]"
1 14 LEU 6.520 0.310 18 0 "[ . 1 . 2]"
1 15 LEU 8.448 0.329 5 0 "[ . 1 . 2]"
1 16 ARG 13.219 0.456 11 0 "[ . 1 . 2]"
1 17 GLU 0.270 0.150 10 0 "[ . 1 . 2]"
1 18 TRP 7.171 0.312 6 0 "[ . 1 . 2]"
1 19 ILE 6.855 0.329 5 0 "[ . 1 . 2]"
1 20 THR 9.962 0.456 11 0 "[ . 1 . 2]"
1 21 THR 0.270 0.150 10 0 "[ . 1 . 2]"
1 22 ILE 4.929 0.312 6 0 "[ . 1 . 2]"
1 27 GLU 0.448 0.242 9 0 "[ . 1 . 2]"
1 28 GLU 3.542 0.284 10 0 "[ . 1 . 2]"
1 30 ILE 8.076 0.347 18 0 "[ . 1 . 2]"
1 31 LEU 1.141 0.242 9 0 "[ . 1 . 2]"
1 32 GLN 7.188 0.304 13 0 "[ . 1 . 2]"
1 33 VAL 1.581 0.166 9 0 "[ . 1 . 2]"
1 34 VAL 11.184 0.347 18 0 "[ . 1 . 2]"
1 35 LYS 2.363 0.219 18 0 "[ . 1 . 2]"
1 36 TYR 3.716 0.304 13 0 "[ . 1 . 2]"
1 37 CYS 11.807 0.320 2 0 "[ . 1 . 2]"
1 38 THR 14.153 0.400 6 0 "[ . 1 . 2]"
1 39 ASP 2.188 0.219 18 0 "[ . 1 . 2]"
1 40 LEU 0.070 0.051 16 0 "[ . 1 . 2]"
1 41 ILE 10.225 0.320 2 0 "[ . 1 . 2]"
1 42 GLU 11.044 0.400 6 0 "[ . 1 . 2]"
1 43 GLU 0.518 0.184 5 0 "[ . 1 . 2]"
1 48 LYS 0.220 0.118 13 0 "[ . 1 . 2]"
1 49 LEU 2.300 0.245 11 0 "[ . 1 . 2]"
1 50 ASP 2.677 0.249 6 0 "[ . 1 . 2]"
1 51 LEU 5.991 0.316 1 0 "[ . 1 . 2]"
1 52 VAL 2.864 0.307 19 0 "[ . 1 . 2]"
1 53 ILE 2.306 0.245 11 0 "[ . 1 . 2]"
1 54 LYS 8.681 0.320 12 0 "[ . 1 . 2]"
1 55 TYR 16.141 0.370 17 0 "[ . 1 . 2]"
1 56 MET 6.625 0.312 2 0 "[ . 1 . 2]"
1 57 LYS 0.999 0.244 12 0 "[ . 1 . 2]"
1 58 ARG 10.169 0.320 12 0 "[ . 1 . 2]"
1 59 LEU 15.883 0.370 17 0 "[ . 1 . 2]"
1 60 MET 3.980 0.312 2 0 "[ . 1 . 2]"
1 61 GLN 0.992 0.244 12 0 "[ . 1 . 2]"
1 62 GLN 4.165 0.236 16 0 "[ . 1 . 2]"
1 63 SER 5.733 0.336 10 0 "[ . 1 . 2]"
1 68 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ASN 8.080 0.363 8 0 "[ . 1 . 2]"
1 70 MET 5.264 0.284 10 0 "[ . 1 . 2]"
1 71 ALA 0.344 0.141 10 0 "[ . 1 . 2]"
1 72 PHE 3.500 0.252 16 0 "[ . 1 . 2]"
1 73 ASP 15.635 0.363 8 0 "[ . 1 . 2]"
1 74 PHE 8.600 0.284 10 0 "[ . 1 . 2]"
1 75 ILE 3.549 0.282 14 0 "[ . 1 . 2]"
1 76 LEU 10.976 0.337 6 0 "[ . 1 . 2]"
1 77 ASP 8.027 0.274 6 0 "[ . 1 . 2]"
1 78 ASN 10.563 0.311 7 0 "[ . 1 . 2]"
1 79 VAL 3.989 0.282 14 0 "[ . 1 . 2]"
1 80 GLN 8.655 0.337 6 0 "[ . 1 . 2]"
1 81 VAL 6.752 0.272 6 0 "[ . 1 . 2]"
1 82 VAL 7.467 0.311 7 0 "[ . 1 . 2]"
1 83 LEU 2.972 0.263 2 0 "[ . 1 . 2]"
1 84 GLN 1.178 0.157 11 0 "[ . 1 . 2]"
1 85 GLN 6.279 0.272 6 0 "[ . 1 . 2]"
1 86 THR 0.240 0.076 11 0 "[ . 1 . 2]"
1 87 TYR 2.188 0.263 2 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 LEU H 1 5 ALA O . . 2.100 2.217 1.958 2.375 0.275 11 0 "[ . 1 . 2]" 3
2 1 2 LEU N 1 5 ALA O . . 3.000 2.986 2.711 3.339 0.339 9 0 "[ . 1 . 2]" 3
3 1 7 GLU O 1 11 VAL H . . 2.100 2.117 2.009 2.294 0.194 13 0 "[ . 1 . 2]" 3
4 1 7 GLU O 1 11 VAL N . . 3.000 3.073 2.977 3.241 0.241 18 0 "[ . 1 . 2]" 3
5 1 8 PHE O 1 12 LYS H . . 2.100 2.038 1.937 2.340 0.240 16 0 "[ . 1 . 2]" 3
6 1 8 PHE O 1 12 LYS N . . 3.000 2.911 2.761 3.194 0.194 16 0 "[ . 1 . 2]" 3
7 1 9 ASN O 1 13 THR H . . 2.100 2.130 1.952 2.329 0.229 5 0 "[ . 1 . 2]" 3
8 1 9 ASN O 1 13 THR N . . 3.000 3.010 2.789 3.212 0.212 5 0 "[ . 1 . 2]" 3
9 1 10 ASP O 1 14 LEU H . . 2.100 2.190 2.027 2.370 0.270 18 0 "[ . 1 . 2]" 3
10 1 10 ASP O 1 14 LEU N . . 3.000 3.086 2.839 3.310 0.310 18 0 "[ . 1 . 2]" 3
11 1 11 VAL O 1 15 LEU H . . 2.100 2.063 1.946 2.320 0.220 18 0 "[ . 1 . 2]" 3
12 1 11 VAL O 1 15 LEU N . . 3.000 3.026 2.907 3.294 0.294 18 0 "[ . 1 . 2]" 3
13 1 12 LYS O 1 16 ARG H . . 2.100 2.170 1.987 2.406 0.306 8 0 "[ . 1 . 2]" 3
14 1 12 LYS O 1 16 ARG N . . 3.000 3.064 2.923 3.298 0.298 8 0 "[ . 1 . 2]" 3
15 1 14 LEU O 1 18 TRP H . . 2.100 2.079 1.899 2.354 0.254 1 0 "[ . 1 . 2]" 3
16 1 14 LEU O 1 18 TRP N . . 3.000 2.942 2.664 3.270 0.270 14 0 "[ . 1 . 2]" 3
17 1 15 LEU O 1 19 ILE H . . 2.100 2.243 2.058 2.375 0.275 5 0 "[ . 1 . 2]" 3
18 1 15 LEU O 1 19 ILE N . . 3.000 3.197 3.024 3.329 0.329 5 0 "[ . 1 . 2]" 3
19 1 16 ARG O 1 20 THR H . . 2.100 2.351 2.064 2.489 0.389 11 0 "[ . 1 . 2]" 3
20 1 16 ARG O 1 20 THR N . . 3.000 3.245 3.007 3.456 0.456 11 0 "[ . 1 . 2]" 3
21 1 17 GLU O 1 21 THR H . . 2.100 2.020 1.919 2.250 0.150 10 0 "[ . 1 . 2]" 3
22 1 17 GLU O 1 21 THR N . . 3.000 2.789 2.591 3.053 0.053 10 0 "[ . 1 . 2]" 3
23 1 18 TRP O 1 22 ILE H . . 2.100 2.346 2.245 2.412 0.312 6 0 "[ . 1 . 2]" 3
24 1 27 GLU O 1 31 LEU H . . 2.100 1.969 1.891 2.306 0.206 9 0 "[ . 1 . 2]" 3
25 1 27 GLU O 1 31 LEU N . . 3.000 2.829 2.717 3.242 0.242 9 0 "[ . 1 . 2]" 3
26 1 28 GLU O 1 32 GLN H . . 2.100 2.202 2.028 2.370 0.270 10 0 "[ . 1 . 2]" 3
27 1 28 GLU O 1 32 GLN N . . 3.000 3.013 2.758 3.284 0.284 10 0 "[ . 1 . 2]" 3
28 1 30 ILE O 1 34 VAL H . . 2.100 2.283 2.029 2.390 0.290 18 0 "[ . 1 . 2]" 3
29 1 30 ILE O 1 34 VAL N . . 3.000 3.215 2.953 3.347 0.347 18 0 "[ . 1 . 2]" 3
30 1 31 LEU O 1 35 LYS H . . 2.100 2.070 1.940 2.185 0.085 15 0 "[ . 1 . 2]" 3
31 1 31 LEU O 1 35 LYS N . . 3.000 2.966 2.852 3.088 0.088 15 0 "[ . 1 . 2]" 3
32 1 32 GLN O 1 36 TYR H . . 2.100 2.149 1.977 2.354 0.254 13 0 "[ . 1 . 2]" 3
33 1 32 GLN O 1 36 TYR N . . 3.000 3.079 2.867 3.304 0.304 13 0 "[ . 1 . 2]" 3
34 1 33 VAL O 1 37 CYS H . . 2.100 2.104 1.971 2.266 0.166 9 0 "[ . 1 . 2]" 3
35 1 33 VAL O 1 37 CYS N . . 3.000 3.020 2.866 3.160 0.160 9 0 "[ . 1 . 2]" 3
36 1 34 VAL O 1 38 THR H . . 2.100 2.140 1.971 2.322 0.222 15 0 "[ . 1 . 2]" 3
37 1 34 VAL O 1 38 THR N . . 3.000 3.088 2.925 3.266 0.266 15 0 "[ . 1 . 2]" 3
38 1 35 LYS O 1 39 ASP H . . 2.100 2.113 1.998 2.306 0.206 18 0 "[ . 1 . 2]" 3
39 1 35 LYS O 1 39 ASP N . . 3.000 3.004 2.862 3.219 0.219 18 0 "[ . 1 . 2]" 3
40 1 36 TYR O 1 40 LEU H . . 2.100 1.988 1.918 2.118 0.018 16 0 "[ . 1 . 2]" 3
41 1 36 TYR O 1 40 LEU N . . 3.000 2.815 2.635 3.051 0.051 16 0 "[ . 1 . 2]" 3
42 1 37 CYS O 1 41 ILE H . . 2.100 2.362 2.287 2.408 0.308 9 0 "[ . 1 . 2]" 3
43 1 37 CYS O 1 41 ILE N . . 3.000 3.250 3.141 3.320 0.320 2 0 "[ . 1 . 2]" 3
44 1 38 THR O 1 42 GLU H . . 2.100 2.384 2.301 2.473 0.373 6 0 "[ . 1 . 2]" 3
45 1 38 THR O 1 42 GLU N . . 3.000 3.268 3.047 3.400 0.400 6 0 "[ . 1 . 2]" 3
46 1 39 ASP O 1 43 GLU H . . 2.100 2.076 1.930 2.284 0.184 5 0 "[ . 1 . 2]" 3
47 1 39 ASP O 1 43 GLU N . . 3.000 2.824 2.665 2.995 . 0 0 "[ . 1 . 2]" 3
48 1 48 LYS O 1 52 VAL H . . 2.100 1.953 1.843 2.202 0.102 13 0 "[ . 1 . 2]" 3
49 1 48 LYS O 1 52 VAL N . . 3.000 2.887 2.772 3.118 0.118 13 0 "[ . 1 . 2]" 3
50 1 49 LEU O 1 53 ILE H . . 2.100 2.101 1.927 2.331 0.231 11 0 "[ . 1 . 2]" 3
51 1 49 LEU O 1 53 ILE N . . 3.000 3.033 2.841 3.245 0.245 11 0 "[ . 1 . 2]" 3
52 1 50 ASP O 1 54 LYS H . . 2.100 2.154 1.977 2.343 0.243 7 0 "[ . 1 . 2]" 3
53 1 50 ASP O 1 54 LYS N . . 3.000 3.030 2.836 3.249 0.249 6 0 "[ . 1 . 2]" 3
54 1 51 LEU O 1 55 TYR H . . 2.100 2.283 1.988 2.416 0.316 1 0 "[ . 1 . 2]" 3
55 1 51 LEU O 1 55 TYR N . . 3.000 3.088 2.729 3.306 0.306 15 0 "[ . 1 . 2]" 3
56 1 52 VAL O 1 56 MET H . . 2.100 2.120 1.979 2.323 0.223 19 0 "[ . 1 . 2]" 3
57 1 52 VAL O 1 56 MET N . . 3.000 3.078 2.943 3.307 0.307 19 0 "[ . 1 . 2]" 3
58 1 53 ILE O 1 57 LYS H . . 2.100 1.971 1.887 2.099 . 0 0 "[ . 1 . 2]" 3
59 1 53 ILE O 1 57 LYS N . . 3.000 2.853 2.682 3.006 0.006 6 0 "[ . 1 . 2]" 3
60 1 54 LYS O 1 58 ARG H . . 2.100 2.257 2.059 2.375 0.275 14 0 "[ . 1 . 2]" 3
61 1 54 LYS O 1 58 ARG N . . 3.000 3.137 2.972 3.320 0.320 12 0 "[ . 1 . 2]" 3
62 1 55 TYR O 1 59 LEU H . . 2.100 2.332 2.176 2.391 0.291 17 0 "[ . 1 . 2]" 3
63 1 55 TYR O 1 59 LEU N . . 3.000 3.275 3.147 3.370 0.370 17 0 "[ . 1 . 2]" 3
64 1 56 MET O 1 60 MET H . . 2.100 2.183 1.937 2.412 0.312 2 0 "[ . 1 . 2]" 3
65 1 56 MET O 1 60 MET N . . 3.000 3.081 2.875 3.300 0.300 2 0 "[ . 1 . 2]" 3
66 1 57 LYS O 1 61 GLN H . . 2.100 2.070 1.962 2.344 0.244 12 0 "[ . 1 . 2]" 3
67 1 57 LYS O 1 61 GLN N . . 3.000 2.884 2.679 3.177 0.177 12 0 "[ . 1 . 2]" 3
68 1 58 ARG O 1 62 GLN H . . 2.100 2.210 2.023 2.336 0.236 16 0 "[ . 1 . 2]" 3
69 1 58 ARG O 1 62 GLN N . . 3.000 3.066 2.871 3.211 0.211 1 0 "[ . 1 . 2]" 3
70 1 59 LEU O 1 63 SER H . . 2.100 2.276 2.141 2.389 0.289 16 0 "[ . 1 . 2]" 3
71 1 59 LEU O 1 63 SER N . . 3.000 3.096 2.915 3.336 0.336 10 0 "[ . 1 . 2]" 3
72 1 68 TRP O 1 72 PHE H . . 2.100 2.023 1.951 2.095 . 0 0 "[ . 1 . 2]" 3
73 1 68 TRP O 1 72 PHE N . . 3.000 2.893 2.788 2.977 . 0 0 "[ . 1 . 2]" 3
74 1 69 ASN O 1 73 ASP H . . 2.100 2.291 2.104 2.398 0.298 8 0 "[ . 1 . 2]" 3
75 1 69 ASN O 1 73 ASP N . . 3.000 3.209 2.941 3.363 0.363 8 0 "[ . 1 . 2]" 3
76 1 70 MET O 1 74 PHE H . . 2.100 2.239 2.105 2.378 0.278 13 0 "[ . 1 . 2]" 3
77 1 70 MET O 1 74 PHE N . . 3.000 3.113 2.898 3.284 0.284 10 0 "[ . 1 . 2]" 3
78 1 71 ALA O 1 75 ILE H . . 2.100 2.003 1.941 2.167 0.067 10 0 "[ . 1 . 2]" 3
79 1 71 ALA O 1 75 ILE N . . 3.000 2.961 2.849 3.141 0.141 10 0 "[ . 1 . 2]" 3
80 1 72 PHE O 1 76 LEU H . . 2.100 2.142 1.919 2.329 0.229 5 0 "[ . 1 . 2]" 3
81 1 72 PHE O 1 76 LEU N . . 3.000 3.077 2.852 3.252 0.252 16 0 "[ . 1 . 2]" 3
82 1 73 ASP O 1 77 ASP H . . 2.100 2.306 2.127 2.372 0.272 11 0 "[ . 1 . 2]" 3
83 1 73 ASP O 1 77 ASP N . . 3.000 3.171 3.017 3.274 0.274 6 0 "[ . 1 . 2]" 3
84 1 74 PHE O 1 78 ASN H . . 2.100 2.148 2.044 2.307 0.207 7 0 "[ . 1 . 2]" 3
85 1 74 PHE O 1 78 ASN N . . 3.000 3.111 3.008 3.263 0.263 7 0 "[ . 1 . 2]" 3
86 1 75 ILE O 1 79 VAL H . . 2.100 2.145 1.997 2.323 0.223 14 0 "[ . 1 . 2]" 3
87 1 75 ILE O 1 79 VAL N . . 3.000 3.089 2.916 3.282 0.282 14 0 "[ . 1 . 2]" 3
88 1 76 LEU O 1 80 GLN H . . 2.100 2.274 2.009 2.385 0.285 3 0 "[ . 1 . 2]" 3
89 1 76 LEU O 1 80 GLN N . . 3.000 3.189 2.927 3.337 0.337 6 0 "[ . 1 . 2]" 3
90 1 77 ASP O 1 81 VAL H . . 2.100 2.080 1.955 2.172 0.072 11 0 "[ . 1 . 2]" 3
91 1 77 ASP O 1 81 VAL N . . 3.000 2.962 2.843 3.095 0.095 9 0 "[ . 1 . 2]" 3
92 1 78 ASN O 1 82 VAL H . . 2.100 2.254 2.143 2.365 0.265 7 0 "[ . 1 . 2]" 3
93 1 78 ASN O 1 82 VAL N . . 3.000 3.207 3.092 3.311 0.311 7 0 "[ . 1 . 2]" 3
94 1 79 VAL O 1 83 LEU H . . 2.100 2.100 2.011 2.278 0.178 14 0 "[ . 1 . 2]" 3
95 1 79 VAL O 1 83 LEU N . . 3.000 2.951 2.838 3.186 0.186 14 0 "[ . 1 . 2]" 3
96 1 80 GLN O 1 84 GLN H . . 2.100 2.150 2.079 2.257 0.157 11 0 "[ . 1 . 2]" 3
97 1 80 GLN O 1 84 GLN N . . 3.000 2.976 2.861 3.085 0.085 11 0 "[ . 1 . 2]" 3
98 1 81 VAL O 1 85 GLN H . . 2.100 2.271 2.069 2.372 0.272 6 0 "[ . 1 . 2]" 3
99 1 81 VAL O 1 85 GLN N . . 3.000 3.137 2.917 3.269 0.269 19 0 "[ . 1 . 2]" 3
100 1 82 VAL O 1 86 THR H . . 2.100 2.025 1.947 2.163 0.063 7 0 "[ . 1 . 2]" 3
101 1 82 VAL O 1 86 THR N . . 3.000 2.886 2.788 3.076 0.076 11 0 "[ . 1 . 2]" 3
102 1 83 LEU O 1 87 TYR H . . 2.100 2.161 1.956 2.363 0.263 2 0 "[ . 1 . 2]" 3
103 1 83 LEU O 1 87 TYR N . . 3.000 2.964 2.811 3.169 0.169 16 0 "[ . 1 . 2]" 3
stop_
save_