NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575447 |
2mem   |
19526 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mem
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 3172
_Distance_constraint_stats_list.Viol_count 12001
_Distance_constraint_stats_list.Viol_total 54616.605
_Distance_constraint_stats_list.Viol_max 1.723
_Distance_constraint_stats_list.Viol_rms 0.1252
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0430
_Distance_constraint_stats_list.Viol_average_violations_only 0.2276
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 MET 1.307 0.351 9 0 "[ . 1 . 2]"
1 5 MET 21.172 0.764 10 15 "[**-*.****+** ** ** 2]"
1 6 SER 22.621 0.900 13 14 "[ *-*****1 *+ ** ***]"
1 7 THR 10.645 0.637 17 2 "[ -. 1 . + 2]"
1 8 VAL 93.095 1.723 1 20 [+*****************-*]
1 9 CYS 35.036 0.846 8 8 "[* . + 1 * *.** **]"
1 10 VAL 82.230 0.820 2 20 [*+*********-********]
1 11 TYR 37.892 0.651 12 15 "[ *******-1*+* .****2]"
1 12 VAL 86.614 0.934 2 20 [-+******************]
1 13 ASN 27.733 0.452 2 0 "[ . 1 . 2]"
1 14 LYS 72.246 0.765 20 16 "[*** ***-*1** ***** +]"
1 15 HIS 9.494 0.385 4 0 "[ . 1 . 2]"
1 16 GLY 38.297 0.945 2 18 "[*+********** **- ***]"
1 17 ASN 45.238 0.921 2 16 "[*+**** * * **-**** *]"
1 18 PHE 86.500 1.223 14 20 [*********-***+******]
1 19 GLY 37.392 0.657 13 17 "[****** * 1**+*****-*]"
1 20 PRO 70.221 0.616 20 14 "[ ******* *-.****+]"
1 21 HIS 16.497 1.110 12 8 "[ ** -* +**.* 2]"
1 22 LEU 80.976 0.833 11 17 "[ * *******+***** *-*]"
1 23 ASP 61.959 1.215 14 20 [**********-**+******]
1 24 PRO 41.591 0.861 4 7 "[ *+. 1* *.* **]"
1 25 LYS 98.859 1.215 14 20 [-************+******]
1 26 ARG 70.572 1.137 5 20 [****+*****-*********]
1 27 ILE 89.848 0.601 1 12 "[+ **.* **1- * * ** *]"
1 28 GLN 64.914 0.635 1 3 "[+ -*. 1 . 2]"
1 29 GLN 70.340 0.765 20 18 "[******* **** *****-+]"
1 30 LEU 65.356 0.736 6 18 "[*****+* **** *****-*]"
1 31 PRO 28.415 0.934 2 6 "[ +* . *1 * - *]"
1 32 ASP 36.845 0.695 17 5 "[ . * *-+* 2]"
1 33 HIS 25.465 0.822 18 6 "[ ** . *1 * + *]"
1 34 PHE 41.193 0.588 20 19 "[-******* **********+]"
1 35 GLY 3.335 0.427 4 0 "[ . 1 . 2]"
1 36 PRO 17.650 0.637 17 3 "[ -. 1 * + 2]"
1 37 GLY 23.988 0.714 8 8 "[* *. +*1 * **-2]"
1 38 PRO 42.134 0.660 11 10 "[** *. *- 1+* ** * 2]"
1 39 VAL 115.277 1.184 12 20 [*****-*****+********]
1 40 ASN 28.614 0.900 13 2 "[ . 1 +-. 2]"
1 41 VAL 90.234 0.936 6 20 [*****+************-*]
1 42 VAL 102.772 0.898 8 20 [*******+****-*******]
1 43 LEU 74.231 0.965 10 20 [*********+******-***]
1 44 ARG 55.699 0.823 5 18 "[*** +******** **-***]"
1 45 ARG 78.669 0.892 17 19 "[* ***-**********+***]"
1 46 ILE 74.096 0.898 8 20 [**-****+************]
1 47 VAL 41.245 0.645 14 6 "[ * .* - +.* *2]"
1 48 GLN 17.260 0.798 11 11 "[* **- *1+ **. * **]"
1 49 ALA 50.079 0.865 20 12 "[****.* * 1* * * *- +]"
1 50 CYS 24.009 0.819 15 8 "[* **. 1*- + * *2]"
1 51 VAL 70.583 0.690 20 15 "[ ***.* ****** ***- +]"
1 52 ASP 20.149 0.865 20 8 "[ ***. - 1 **. *+]"
1 53 CYS 76.973 0.640 12 14 "[ * *.***-* +* ** ***]"
1 54 ALA 69.303 0.865 7 19 [****.*+***-*********]
1 55 LEU 45.176 0.865 7 20 [**-***+*************]
1 56 GLU 33.346 0.862 2 6 "[ +* . 1* .- **2]"
1 57 THR 122.036 0.866 18 19 "[***** ***********+*-]"
1 58 LYS 56.345 0.862 2 19 "[*+*** ***********-**]"
1 59 THR 37.009 0.667 18 13 "[ * .* * *****-* +**]"
1 60 VAL 86.723 0.712 19 18 "[ ** ********-*****+*]"
1 61 PHE 65.859 0.822 12 20 [***********+-*******]
1 62 GLY 23.602 0.866 18 17 "[*-*** ***1*******+ *]"
1 63 TYR 23.599 0.778 17 12 "[ * *** -****** + 2]"
1 64 LEU 34.946 0.769 10 16 "[ **** * *+******** -]"
1 65 LYS 17.162 0.771 12 5 "[ *. 1-+**. 2]"
1 66 PRO 59.930 0.829 18 15 "[* -*. ***1****.**+**]"
1 67 ASP 53.193 1.182 18 15 "[* -*. ********.**+ *]"
1 68 ASN 21.238 0.825 4 9 "[ +. ** -* **.** 2]"
1 69 ARG 60.666 1.182 18 17 "[-***. ***********+*2]"
1 70 GLY 20.109 0.796 16 6 "[ - . * 1 * *+ *2]"
1 71 GLY 9.408 0.673 2 2 "[ + . 1- . 2]"
1 72 GLU 24.023 0.746 18 3 "[ . * 1 . + -]"
1 73 VAL 41.021 0.765 19 15 "[* *** *-**** .***+*]"
1 74 ILE 49.837 0.633 8 5 "[ - + 1 . ***2]"
1 75 THR 31.853 0.622 18 2 "[ . - 1 . + 2]"
1 76 ALA 64.454 0.840 19 14 "[*-**. **1 * *****+*]"
1 77 SER 44.063 0.713 17 9 "[ * * * ** -*+ *]"
1 78 PHE 80.757 0.897 2 17 "[*+*** ********** * -]"
1 79 ASP 6.484 0.629 4 2 "[ +. - 1 . 2]"
1 80 GLY 9.772 0.651 12 3 "[- . 1 + . *]"
1 81 GLU 54.660 0.897 2 10 "[*+ *. **** **. -]"
1 82 THR 40.713 0.796 7 17 "[*** * +*-1**********]"
1 83 HIS 31.910 0.796 7 17 "[*** * +-*1**********]"
1 84 SER 34.301 0.630 8 3 "[ * . + 1 . *2]"
1 85 ILE 107.700 0.829 18 19 "[** *****-********+**]"
1 86 GLN 45.696 0.980 8 7 "[ *- . *+ 1 . ***2]"
1 87 LEU 59.352 0.746 18 17 "[** *.** -********+**]"
1 88 PRO 45.757 0.668 18 13 "[ ***** -1** ***+*2]"
1 89 PRO 10.312 0.302 4 0 "[ . 1 . 2]"
1 90 VAL 60.431 0.817 6 10 "[ ***+ ***-* . * 2]"
1 91 ASN 22.933 0.772 15 16 "[* *-*****1 ***+* ***]"
1 92 SER 11.622 0.560 12 2 "[ - . 1 + . 2]"
1 93 ALA 82.264 1.723 1 20 [+****-**************]
1 94 SER 1.581 0.260 16 0 "[ . 1 . 2]"
1 95 PHE 33.917 0.817 6 20 [*****+***-**********]
1 96 ALA 83.353 1.133 6 20 [***-*+**************]
1 97 LEU 21.259 0.846 8 9 "[ . *+*1** *.*- *]"
1 98 ARG 70.729 1.112 4 17 "[***+-** *** **** ***]"
1 99 PHE 28.411 1.112 4 8 "[** +* 1 -* ** 2]"
1 100 LEU 34.459 0.543 19 2 "[ . 1 - . +2]"
1 101 GLU 42.923 0.958 11 10 "[ *** -*1+* * **2]"
1 102 ASN 45.024 0.680 5 18 "[**-*+* *******.*****]"
1 103 PHE 47.639 0.819 15 15 "[******** 1** -+ * **]"
1 104 CYS 49.123 0.636 17 11 "[* ******1 -. +* *]"
1 105 HIS 45.562 0.680 5 20 [****+**********-****]
1 106 SER 8.208 0.424 2 0 "[ . 1 . 2]"
1 107 LEU 52.917 1.110 12 18 "[-****** ***+**** ***]"
1 108 GLN 35.390 0.616 20 5 "[ . * * -.* +]"
1 109 CYS 61.092 1.223 14 18 "[* *******-** +******]"
1 110 ASP 16.017 0.785 15 5 "[- . *1 * + * 2]"
1 111 ASN 22.785 0.921 2 10 "[*+ *.* * 1 * **-* 2]"
1 112 LEU 74.396 0.945 2 20 [*+*************-****]
1 113 LEU 44.778 0.767 3 20 [**+********-********]
1 114 SER 31.418 0.820 2 18 [*+**.******-**.*****]
1 115 SER 26.191 0.754 6 5 "[* * .+ *1* . 2]"
1 116 GLN 35.224 0.726 5 3 "[ - + 1 * . 2]"
1 117 PRO 26.320 0.793 19 5 "[**- * 1 . +2]"
1 118 PHE 14.377 0.793 19 4 "[** . - . +2]"
1 119 SER 14.877 0.676 19 4 "[** . - . +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 3 HIS HA 1 4 MET H . . 3.510 2.620 2.134 3.506 . 0 0 "[ . 1 . 2]" 1
2 1 4 MET QG 1 5 MET QG . . 4.020 3.885 3.285 4.371 0.351 9 0 "[ . 1 . 2]" 1
3 1 5 MET HA 1 5 MET QB . . 2.550 2.203 2.187 2.225 . 0 0 "[ . 1 . 2]" 1
4 1 5 MET HA 1 6 SER H . . 3.430 2.467 2.285 2.619 . 0 0 "[ . 1 . 2]" 1
5 1 5 MET HA 1 6 SER QB . . 4.360 4.298 4.109 4.649 0.289 19 0 "[ . 1 . 2]" 1
6 1 5 MET HA 1 39 VAL QG . . 3.890 3.421 2.905 3.715 . 0 0 "[ . 1 . 2]" 1
7 1 5 MET HA 1 91 ASN QB . . 3.190 2.780 2.240 3.679 0.489 12 0 "[ . 1 . 2]" 1
8 1 5 MET QB 1 6 SER H . . 4.610 2.439 2.116 2.906 . 0 0 "[ . 1 . 2]" 1
9 1 5 MET QB 1 6 SER HA . . 4.920 4.680 4.569 4.772 . 0 0 "[ . 1 . 2]" 1
10 1 5 MET QB 1 38 PRO HA . . 4.420 4.784 3.886 5.080 0.660 11 10 "[** *. *- 1+* ** * 2]" 1
11 1 5 MET QB 1 38 PRO HB3 . . 4.990 4.423 3.456 4.995 0.005 8 0 "[ . 1 . 2]" 1
12 1 5 MET QB 1 39 VAL H . . 4.220 3.866 3.043 4.205 . 0 0 "[ . 1 . 2]" 1
13 1 5 MET QB 1 39 VAL QG . . 4.010 2.015 1.817 2.192 . 0 0 "[ . 1 . 2]" 1
14 1 5 MET QB 1 40 ASN H . . 3.930 3.632 3.080 3.948 0.018 4 0 "[ . 1 . 2]" 1
15 1 5 MET QB 1 40 ASN QB . . 5.120 4.031 3.222 4.574 . 0 0 "[ . 1 . 2]" 1
16 1 5 MET QB 1 90 VAL H . . 5.110 5.366 4.688 5.874 0.764 10 5 "[ - .* *+ . * 2]" 1
17 1 5 MET QB 1 90 VAL QG . . 4.810 3.915 3.424 4.415 . 0 0 "[ . 1 . 2]" 1
18 1 5 MET QB 1 91 ASN H . . 5.500 5.223 4.720 5.949 0.449 10 0 "[ . 1 . 2]" 1
19 1 5 MET QB 1 91 ASN QB . . 4.310 3.712 2.998 4.270 . 0 0 "[ . 1 . 2]" 1
20 1 5 MET QB 1 92 SER H . . 5.500 5.426 5.049 6.006 0.506 3 1 "[ + . 1 . 2]" 1
21 1 5 MET QG 1 6 SER HA . . 5.500 4.306 3.974 4.463 . 0 0 "[ . 1 . 2]" 1
22 1 5 MET QG 1 6 SER QB . . 5.500 4.599 4.297 4.836 . 0 0 "[ . 1 . 2]" 1
23 1 5 MET QG 1 38 PRO HA . . 4.150 3.127 2.593 3.448 . 0 0 "[ . 1 . 2]" 1
24 1 5 MET QG 1 38 PRO HB2 . . 4.620 3.053 2.378 4.062 . 0 0 "[ . 1 . 2]" 1
25 1 5 MET QG 1 38 PRO HB3 . . 4.510 2.562 1.809 3.034 . 0 0 "[ . 1 . 2]" 1
26 1 5 MET QG 1 39 VAL H . . 4.110 3.115 2.681 3.440 . 0 0 "[ . 1 . 2]" 1
27 1 5 MET QG 1 39 VAL QG . . 4.170 2.571 2.291 2.981 . 0 0 "[ . 1 . 2]" 1
28 1 5 MET QG 1 40 ASN H . . 3.690 3.453 2.820 4.206 0.516 14 1 "[ . 1 +. 2]" 1
29 1 5 MET QG 1 41 VAL H . . 5.370 4.757 4.290 5.607 0.237 14 0 "[ . 1 . 2]" 1
30 1 5 MET QG 1 91 ASN HA . . 5.500 4.625 4.056 5.264 . 0 0 "[ . 1 . 2]" 1
31 1 6 SER H 1 6 SER QB . . 3.830 2.317 2.262 2.668 . 0 0 "[ . 1 . 2]" 1
32 1 6 SER H 1 7 THR H . . 4.600 4.569 4.525 4.638 0.038 16 0 "[ . 1 . 2]" 1
33 1 6 SER H 1 39 VAL H . . 4.010 4.117 3.979 4.289 0.279 1 0 "[ . 1 . 2]" 1
34 1 6 SER H 1 39 VAL QG . . 4.840 1.964 1.866 2.063 . 0 0 "[ . 1 . 2]" 1
35 1 6 SER H 1 40 ASN H . . 4.780 5.045 4.770 5.161 0.381 19 0 "[ . 1 . 2]" 1
36 1 6 SER H 1 90 VAL QG . . 4.980 4.469 4.131 4.810 . 0 0 "[ . 1 . 2]" 1
37 1 6 SER H 1 91 ASN HA . . 3.080 2.559 2.253 2.970 . 0 0 "[ . 1 . 2]" 1
38 1 6 SER H 1 92 SER H . . 5.500 4.544 4.237 5.041 . 0 0 "[ . 1 . 2]" 1
39 1 6 SER HA 1 6 SER QB . . 2.670 2.386 2.181 2.446 . 0 0 "[ . 1 . 2]" 1
40 1 6 SER HA 1 7 THR H . . 2.870 2.607 2.529 2.724 . 0 0 "[ . 1 . 2]" 1
41 1 6 SER HA 1 7 THR HA . . 5.020 4.608 4.568 4.652 . 0 0 "[ . 1 . 2]" 1
42 1 6 SER HA 1 39 VAL H . . 5.090 4.869 4.759 4.943 . 0 0 "[ . 1 . 2]" 1
43 1 6 SER HA 1 39 VAL HB . . 4.530 4.398 4.282 4.498 . 0 0 "[ . 1 . 2]" 1
44 1 6 SER HA 1 39 VAL QG . . 3.990 3.821 3.724 3.899 . 0 0 "[ . 1 . 2]" 1
45 1 6 SER HA 1 92 SER HA . . 5.470 5.198 4.826 5.539 0.069 1 0 "[ . 1 . 2]" 1
46 1 6 SER QB 1 7 THR H . . 3.330 2.851 2.022 3.260 . 0 0 "[ . 1 . 2]" 1
47 1 6 SER QB 1 39 VAL H . . 4.100 3.971 3.814 4.735 0.635 13 1 "[ . 1 + . 2]" 1
48 1 6 SER QB 1 39 VAL HB . . 4.560 2.197 2.013 3.448 . 0 0 "[ . 1 . 2]" 1
49 1 6 SER QB 1 39 VAL QG . . 3.150 2.266 2.050 3.173 0.023 13 0 "[ . 1 . 2]" 1
50 1 6 SER QB 1 40 ASN H . . 5.390 5.366 5.155 6.290 0.900 13 1 "[ . 1 + . 2]" 1
51 1 6 SER QB 1 91 ASN HA . . 3.800 3.723 3.256 4.459 0.659 12 1 "[ . 1 + . 2]" 1
52 1 6 SER QB 1 91 ASN QB . . 5.340 4.440 3.969 5.645 0.305 12 0 "[ . 1 . 2]" 1
53 1 6 SER QB 1 91 ASN QD . . 5.500 5.898 4.516 6.272 0.772 15 13 "[ *-*****1 * +* ***]" 1
54 1 6 SER QB 1 92 SER H . . 3.880 3.866 3.609 4.440 0.560 12 1 "[ . 1 + . 2]" 1
55 1 6 SER QB 1 92 SER HA . . 4.520 2.747 2.274 3.278 . 0 0 "[ . 1 . 2]" 1
56 1 6 SER QB 1 93 ALA H . . 5.160 3.001 2.761 3.380 . 0 0 "[ . 1 . 2]" 1
57 1 6 SER QB 1 93 ALA HA . . 4.200 3.122 2.824 3.488 . 0 0 "[ . 1 . 2]" 1
58 1 6 SER QB 1 93 ALA MB . . 4.150 2.892 1.933 3.426 . 0 0 "[ . 1 . 2]" 1
59 1 7 THR H 1 7 THR HB . . 3.980 3.859 3.810 3.893 . 0 0 "[ . 1 . 2]" 1
60 1 7 THR H 1 8 VAL H . . 4.560 4.341 4.286 4.387 . 0 0 "[ . 1 . 2]" 1
61 1 7 THR H 1 8 VAL QG . . 4.090 3.718 3.564 3.991 . 0 0 "[ . 1 . 2]" 1
62 1 7 THR H 1 39 VAL H . . 4.460 4.396 4.053 4.597 0.137 10 0 "[ . 1 . 2]" 1
63 1 7 THR H 1 39 VAL QG . . 3.920 4.155 4.013 4.325 0.405 20 0 "[ . 1 . 2]" 1
64 1 7 THR H 1 93 ALA MB . . 4.240 3.392 3.101 3.802 . 0 0 "[ . 1 . 2]" 1
65 1 7 THR HA 1 8 VAL H . . 3.040 2.214 2.172 2.258 . 0 0 "[ . 1 . 2]" 1
66 1 7 THR HA 1 8 VAL HA . . 4.820 4.516 4.488 4.556 . 0 0 "[ . 1 . 2]" 1
67 1 7 THR HA 1 8 VAL QG . . 3.220 3.304 3.226 3.388 0.168 19 0 "[ . 1 . 2]" 1
68 1 7 THR HA 1 37 GLY QA . . 5.250 4.604 4.267 4.816 . 0 0 "[ . 1 . 2]" 1
69 1 7 THR HA 1 38 PRO HA . . 3.560 2.679 2.310 3.092 . 0 0 "[ . 1 . 2]" 1
70 1 7 THR HA 1 39 VAL H . . 3.530 2.625 2.190 2.936 . 0 0 "[ . 1 . 2]" 1
71 1 7 THR HA 1 39 VAL HA . . 4.550 3.799 3.658 4.092 . 0 0 "[ . 1 . 2]" 1
72 1 7 THR HA 1 39 VAL HB . . 5.500 3.596 3.451 3.832 . 0 0 "[ . 1 . 2]" 1
73 1 7 THR HB 1 8 VAL H . . 3.180 3.070 2.907 3.222 0.042 8 0 "[ . 1 . 2]" 1
74 1 7 THR HB 1 8 VAL HA . . 4.610 4.426 4.239 4.508 . 0 0 "[ . 1 . 2]" 1
75 1 7 THR HB 1 36 PRO HB2 . . 4.220 4.187 3.727 4.857 0.637 17 2 "[ -. 1 . + 2]" 1
76 1 7 THR HB 1 36 PRO HB3 . . 4.920 4.988 4.712 5.098 0.178 7 0 "[ . 1 . 2]" 1
77 1 7 THR HB 1 37 GLY H . . 4.230 3.799 3.129 4.146 . 0 0 "[ . 1 . 2]" 1
78 1 7 THR HB 1 38 PRO HA . . 5.270 4.322 3.851 4.815 . 0 0 "[ . 1 . 2]" 1
79 1 7 THR HB 1 42 VAL QG . . 5.160 4.972 4.776 5.188 0.028 20 0 "[ . 1 . 2]" 1
80 1 8 VAL H 1 8 VAL HB . . 4.130 3.901 3.858 3.924 . 0 0 "[ . 1 . 2]" 1
81 1 8 VAL H 1 8 VAL QG . . 2.970 2.295 2.253 2.350 . 0 0 "[ . 1 . 2]" 1
82 1 8 VAL H 1 9 CYS H . . 4.550 4.414 4.371 4.450 . 0 0 "[ . 1 . 2]" 1
83 1 8 VAL H 1 9 CYS HA . . 5.030 4.897 4.834 4.947 . 0 0 "[ . 1 . 2]" 1
84 1 8 VAL H 1 35 GLY HA3 . . 5.470 5.400 4.936 5.897 0.427 4 0 "[ . 1 . 2]" 1
85 1 8 VAL H 1 36 PRO HB3 . . 5.380 5.568 5.199 5.841 0.461 5 0 "[ . 1 . 2]" 1
86 1 8 VAL H 1 37 GLY H . . 3.290 3.068 2.776 3.298 0.008 4 0 "[ . 1 . 2]" 1
87 1 8 VAL H 1 37 GLY QA . . 4.810 4.364 4.173 4.442 . 0 0 "[ . 1 . 2]" 1
88 1 8 VAL H 1 38 PRO HA . . 4.760 4.132 3.854 4.507 . 0 0 "[ . 1 . 2]" 1
89 1 8 VAL H 1 39 VAL HA . . 4.270 3.628 3.321 3.874 . 0 0 "[ . 1 . 2]" 1
90 1 8 VAL H 1 42 VAL HB . . 4.490 4.365 4.126 4.656 0.166 20 0 "[ . 1 . 2]" 1
91 1 8 VAL H 1 42 VAL QG . . 3.520 3.041 2.901 3.156 . 0 0 "[ . 1 . 2]" 1
92 1 8 VAL HA 1 8 VAL QG . . 2.890 2.307 2.259 2.338 . 0 0 "[ . 1 . 2]" 1
93 1 8 VAL HA 1 9 CYS H . . 2.700 2.356 2.227 2.524 . 0 0 "[ . 1 . 2]" 1
94 1 8 VAL HA 1 9 CYS HA . . 4.520 4.542 4.492 4.608 0.088 1 0 "[ . 1 . 2]" 1
95 1 8 VAL HA 1 9 CYS HB2 . . 5.450 5.473 4.394 5.799 0.349 9 0 "[ . 1 . 2]" 1
96 1 8 VAL HA 1 9 CYS QB . . 4.690 4.318 3.953 4.506 . 0 0 "[ . 1 . 2]" 1
97 1 8 VAL HA 1 9 CYS HB3 . . 5.450 4.564 4.411 4.706 . 0 0 "[ . 1 . 2]" 1
98 1 8 VAL HA 1 36 PRO HA . . 5.280 4.850 4.320 5.191 . 0 0 "[ . 1 . 2]" 1
99 1 8 VAL HA 1 36 PRO HB3 . . 5.500 5.207 4.571 5.736 0.236 5 0 "[ . 1 . 2]" 1
100 1 8 VAL HA 1 37 GLY H . . 4.880 4.803 4.480 4.934 0.054 15 0 "[ . 1 . 2]" 1
101 1 8 VAL HA 1 42 VAL MG1 . . 4.750 4.995 4.803 5.158 0.408 1 0 "[ . 1 . 2]" 1
102 1 8 VAL HA 1 42 VAL MG2 . . 4.750 4.865 4.710 5.070 0.320 16 0 "[ . 1 . 2]" 1
103 1 8 VAL HA 1 93 ALA HA . . 5.420 5.434 5.172 5.609 0.189 15 0 "[ . 1 . 2]" 1
104 1 8 VAL HA 1 93 ALA MB . . 3.840 4.077 3.765 4.271 0.431 19 0 "[ . 1 . 2]" 1
105 1 8 VAL HB 1 9 CYS H . . 3.880 2.487 2.217 2.923 . 0 0 "[ . 1 . 2]" 1
106 1 8 VAL HB 1 10 VAL QG . . 5.140 3.346 2.858 3.615 . 0 0 "[ . 1 . 2]" 1
107 1 8 VAL HB 1 39 VAL HA . . 5.300 4.881 4.753 5.098 . 0 0 "[ . 1 . 2]" 1
108 1 8 VAL HB 1 39 VAL QG . . 3.930 5.017 4.848 5.114 1.184 12 20 [***********+******-*] 1
109 1 8 VAL HB 1 42 VAL MG1 . . 4.990 3.585 3.321 3.808 . 0 0 "[ . 1 . 2]" 1
110 1 8 VAL HB 1 42 VAL QG . . 3.840 3.445 3.235 3.653 . 0 0 "[ . 1 . 2]" 1
111 1 8 VAL HB 1 42 VAL MG2 . . 4.990 4.471 4.237 4.713 . 0 0 "[ . 1 . 2]" 1
112 1 8 VAL HB 1 93 ALA HA . . 3.520 5.128 5.043 5.243 1.723 1 20 [+*********-*********] 1
113 1 8 VAL HB 1 93 ALA MB . . 4.060 4.425 4.323 4.519 0.459 8 0 "[ . 1 . 2]" 1
114 1 8 VAL HB 1 96 ALA MB . . 4.430 3.527 3.437 3.694 . 0 0 "[ . 1 . 2]" 1
115 1 8 VAL QG 1 9 CYS H . . 3.260 3.199 3.054 3.371 0.111 6 0 "[ . 1 . 2]" 1
116 1 8 VAL QG 1 9 CYS HA . . 4.510 3.776 3.557 4.040 . 0 0 "[ . 1 . 2]" 1
117 1 8 VAL QG 1 10 VAL H . . 4.280 4.010 3.649 4.426 0.146 9 0 "[ . 1 . 2]" 1
118 1 8 VAL QG 1 36 PRO HA . . 5.440 4.663 4.481 4.930 . 0 0 "[ . 1 . 2]" 1
119 1 8 VAL QG 1 37 GLY H . . 4.620 3.963 3.849 4.144 . 0 0 "[ . 1 . 2]" 1
120 1 8 VAL QG 1 39 VAL H . . 3.710 3.653 3.434 3.795 0.085 10 0 "[ . 1 . 2]" 1
121 1 8 VAL QG 1 39 VAL HA . . 2.680 1.908 1.798 2.061 . 0 0 "[ . 1 . 2]" 1
122 1 8 VAL QG 1 39 VAL HB . . 4.190 3.005 2.883 3.127 . 0 0 "[ . 1 . 2]" 1
123 1 8 VAL QG 1 39 VAL QG . . 2.670 2.656 2.518 2.759 0.089 12 0 "[ . 1 . 2]" 1
124 1 8 VAL QG 1 42 VAL HA . . 4.270 4.510 4.445 4.608 0.338 17 0 "[ . 1 . 2]" 1
125 1 8 VAL QG 1 42 VAL HB . . 3.390 2.197 2.008 2.387 . 0 0 "[ . 1 . 2]" 1
126 1 8 VAL QG 1 42 VAL QG . . 4.670 1.895 1.793 2.018 . 0 0 "[ . 1 . 2]" 1
127 1 8 VAL QG 1 93 ALA HA . . 2.900 2.307 2.200 2.394 . 0 0 "[ . 1 . 2]" 1
128 1 8 VAL QG 1 93 ALA MB . . 2.990 2.061 1.967 2.154 . 0 0 "[ . 1 . 2]" 1
129 1 8 VAL QG 1 95 PHE H . . 5.440 4.852 4.666 5.007 . 0 0 "[ . 1 . 2]" 1
130 1 8 VAL QG 1 96 ALA H . . 4.500 3.754 3.626 3.858 . 0 0 "[ . 1 . 2]" 1
131 1 8 VAL QG 1 96 ALA HA . . 5.080 3.859 3.763 3.965 . 0 0 "[ . 1 . 2]" 1
132 1 8 VAL QG 1 96 ALA MB . . 3.090 1.793 1.728 1.916 . 0 0 "[ . 1 . 2]" 1
133 1 8 VAL QG 1 97 LEU H . . 4.080 3.628 3.381 3.950 . 0 0 "[ . 1 . 2]" 1
134 1 9 CYS H 1 9 CYS HB2 . . 3.710 3.719 3.133 3.949 0.239 1 0 "[ . 1 . 2]" 1
135 1 9 CYS H 1 9 CYS QB . . 3.220 3.009 2.500 3.222 0.002 5 0 "[ . 1 . 2]" 1
136 1 9 CYS H 1 9 CYS HB3 . . 3.710 3.179 2.628 3.427 . 0 0 "[ . 1 . 2]" 1
137 1 9 CYS H 1 10 VAL H . . 4.200 4.006 3.846 4.267 0.067 9 0 "[ . 1 . 2]" 1
138 1 9 CYS H 1 10 VAL HA . . 4.760 4.695 4.421 4.889 0.129 6 0 "[ . 1 . 2]" 1
139 1 9 CYS H 1 10 VAL QG . . 4.380 4.003 3.765 4.229 . 0 0 "[ . 1 . 2]" 1
140 1 9 CYS H 1 35 GLY HA3 . . 5.330 4.760 4.543 5.005 . 0 0 "[ . 1 . 2]" 1
141 1 9 CYS H 1 36 PRO HA . . 4.370 4.355 3.891 4.701 0.331 5 0 "[ . 1 . 2]" 1
142 1 9 CYS H 1 37 GLY H . . 5.320 5.104 4.882 5.215 . 0 0 "[ . 1 . 2]" 1
143 1 9 CYS H 1 93 ALA MB . . 5.170 5.590 5.398 5.753 0.583 19 4 "[ . - 1 .* +*]" 1
144 1 9 CYS H 1 97 LEU QD . . 5.020 4.803 3.746 5.866 0.846 8 4 "[ . + 1 * *. - 2]" 1
145 1 9 CYS H 1 115 SER HA . . 4.750 4.338 3.712 4.845 0.095 2 0 "[ . 1 . 2]" 1
146 1 9 CYS H 1 115 SER HB2 . . 5.500 5.024 3.675 6.061 0.561 1 1 "[+ . 1 . 2]" 1
147 1 9 CYS H 1 115 SER QB . . 4.630 4.461 3.484 5.072 0.442 16 0 "[ . 1 . 2]" 1
148 1 9 CYS H 1 115 SER HB3 . . 5.500 5.202 3.627 5.998 0.498 11 0 "[ . 1 . 2]" 1
149 1 9 CYS HA 1 10 VAL H . . 3.000 2.177 2.129 2.214 . 0 0 "[ . 1 . 2]" 1
150 1 9 CYS HA 1 10 VAL HB . . 5.500 5.460 4.669 5.885 0.385 10 0 "[ . 1 . 2]" 1
151 1 9 CYS HA 1 10 VAL QG . . 4.120 3.590 3.427 3.852 . 0 0 "[ . 1 . 2]" 1
152 1 9 CYS HA 1 35 GLY H . . 4.720 4.680 4.437 5.009 0.289 7 0 "[ . 1 . 2]" 1
153 1 9 CYS HA 1 35 GLY HA2 . . 4.060 3.555 3.218 3.954 . 0 0 "[ . 1 . 2]" 1
154 1 9 CYS HA 1 35 GLY HA3 . . 4.170 1.971 1.778 2.239 . 0 0 "[ . 1 . 2]" 1
155 1 9 CYS HA 1 36 PRO HB3 . . 4.560 4.327 3.552 4.804 0.244 5 0 "[ . 1 . 2]" 1
156 1 9 CYS HA 1 37 GLY H . . 4.030 3.881 3.663 4.132 0.102 18 0 "[ . 1 . 2]" 1
157 1 9 CYS HA 1 42 VAL MG1 . . 4.370 3.225 2.779 3.682 . 0 0 "[ . 1 . 2]" 1
158 1 9 CYS HA 1 42 VAL QG . . 3.820 3.008 2.687 3.385 . 0 0 "[ . 1 . 2]" 1
159 1 9 CYS HA 1 42 VAL MG2 . . 4.370 3.622 3.261 3.949 . 0 0 "[ . 1 . 2]" 1
160 1 9 CYS QB 1 35 GLY HA3 . . 4.780 2.983 2.464 3.600 . 0 0 "[ . 1 . 2]" 1
161 1 9 CYS QB 1 36 PRO HA . . 3.760 2.234 1.944 2.642 . 0 0 "[ . 1 . 2]" 1
162 1 9 CYS QB 1 36 PRO HB2 . . 4.530 3.736 3.482 3.992 . 0 0 "[ . 1 . 2]" 1
163 1 9 CYS QB 1 36 PRO HB3 . . 4.290 2.260 1.832 2.594 . 0 0 "[ . 1 . 2]" 1
164 1 9 CYS QB 1 36 PRO QD . . 4.260 3.248 2.714 3.893 . 0 0 "[ . 1 . 2]" 1
165 1 9 CYS QB 1 36 PRO HG2 . . 4.770 4.547 4.032 4.967 0.197 3 0 "[ . 1 . 2]" 1
166 1 9 CYS QB 1 36 PRO HG3 . . 4.350 3.706 2.730 4.339 . 0 0 "[ . 1 . 2]" 1
167 1 9 CYS QB 1 37 GLY H . . 4.310 4.047 3.652 4.432 0.122 7 0 "[ . 1 . 2]" 1
168 1 9 CYS HB2 1 10 VAL H . . 4.480 3.874 3.293 4.505 0.025 20 0 "[ . 1 . 2]" 1
169 1 9 CYS HB2 1 36 PRO HA . . 4.450 3.280 2.156 3.766 . 0 0 "[ . 1 . 2]" 1
170 1 9 CYS HB2 1 36 PRO QD . . 4.950 3.675 2.832 4.521 . 0 0 "[ . 1 . 2]" 1
171 1 9 CYS HB3 1 10 VAL H . . 4.480 4.419 4.289 4.499 0.019 4 0 "[ . 1 . 2]" 1
172 1 9 CYS HB3 1 36 PRO HA . . 4.450 2.590 1.959 4.051 . 0 0 "[ . 1 . 2]" 1
173 1 9 CYS HB3 1 36 PRO QD . . 4.950 3.740 2.848 4.800 . 0 0 "[ . 1 . 2]" 1
174 1 10 VAL H 1 10 VAL HB . . 3.650 3.353 2.553 3.805 0.155 9 0 "[ . 1 . 2]" 1
175 1 10 VAL H 1 10 VAL MG1 . . 3.890 3.083 2.520 3.908 0.018 7 0 "[ . 1 . 2]" 1
176 1 10 VAL H 1 10 VAL QG . . 3.140 2.141 1.978 2.593 . 0 0 "[ . 1 . 2]" 1
177 1 10 VAL H 1 10 VAL MG2 . . 3.890 2.198 2.041 2.632 . 0 0 "[ . 1 . 2]" 1
178 1 10 VAL H 1 11 TYR H . . 4.630 4.530 4.411 4.580 . 0 0 "[ . 1 . 2]" 1
179 1 10 VAL H 1 34 PHE H . . 4.020 3.623 3.272 3.963 . 0 0 "[ . 1 . 2]" 1
180 1 10 VAL H 1 34 PHE HA . . 4.930 5.073 4.838 5.136 0.206 17 0 "[ . 1 . 2]" 1
181 1 10 VAL H 1 34 PHE QB . . 3.950 3.705 3.257 4.126 0.176 6 0 "[ . 1 . 2]" 1
182 1 10 VAL H 1 35 GLY HA3 . . 4.100 3.169 2.448 3.658 . 0 0 "[ . 1 . 2]" 1
183 1 10 VAL H 1 36 PRO HA . . 4.900 4.840 4.233 5.130 0.230 1 0 "[ . 1 . 2]" 1
184 1 10 VAL H 1 37 GLY H . . 5.500 5.623 5.155 6.033 0.533 9 1 "[ . +1 . 2]" 1
185 1 10 VAL H 1 42 VAL HA . . 5.500 5.905 5.633 6.103 0.603 6 7 "[ ** .+* *1 - . *2]" 1
186 1 10 VAL H 1 42 VAL HB . . 5.500 5.345 5.091 5.668 0.168 7 0 "[ . 1 . 2]" 1
187 1 10 VAL H 1 42 VAL QG . . 4.010 2.631 2.416 2.892 . 0 0 "[ . 1 . 2]" 1
188 1 10 VAL H 1 46 ILE MD . . 4.900 4.933 4.597 5.044 0.144 20 0 "[ . 1 . 2]" 1
189 1 10 VAL HA 1 10 VAL MG1 . . 3.180 2.427 2.370 2.459 . 0 0 "[ . 1 . 2]" 1
190 1 10 VAL HA 1 10 VAL MG2 . . 3.180 3.000 2.490 3.263 0.083 10 0 "[ . 1 . 2]" 1
191 1 10 VAL HA 1 11 TYR H . . 3.160 2.266 2.121 2.356 . 0 0 "[ . 1 . 2]" 1
192 1 10 VAL HA 1 11 TYR QB . . 4.240 4.362 4.136 4.531 0.291 18 0 "[ . 1 . 2]" 1
193 1 10 VAL HA 1 11 TYR QD . . 4.810 3.642 2.988 4.210 . 0 0 "[ . 1 . 2]" 1
194 1 10 VAL HA 1 12 VAL H . . 5.500 5.635 5.442 5.854 0.354 6 0 "[ . 1 . 2]" 1
195 1 10 VAL HA 1 34 PHE H . . 4.940 4.884 4.759 5.023 0.083 8 0 "[ . 1 . 2]" 1
196 1 10 VAL HA 1 46 ILE MD . . 5.400 5.238 4.827 5.529 0.129 14 0 "[ . 1 . 2]" 1
197 1 10 VAL HA 1 114 SER H . . 4.190 3.787 3.359 4.286 0.096 2 0 "[ . 1 . 2]" 1
198 1 10 VAL HA 1 114 SER QB . . 5.340 5.217 4.801 5.584 0.244 13 0 "[ . 1 . 2]" 1
199 1 10 VAL HA 1 115 SER H . . 5.080 4.040 3.579 4.372 . 0 0 "[ . 1 . 2]" 1
200 1 10 VAL HA 1 115 SER HA . . 3.590 1.966 1.695 2.529 . 0 0 "[ . 1 . 2]" 1
201 1 10 VAL HA 1 115 SER HB2 . . 5.080 3.910 2.993 4.969 . 0 0 "[ . 1 . 2]" 1
202 1 10 VAL HA 1 115 SER QB . . 4.460 3.654 2.942 4.448 . 0 0 "[ . 1 . 2]" 1
203 1 10 VAL HA 1 115 SER HB3 . . 5.080 4.672 3.532 5.495 0.415 15 0 "[ . 1 . 2]" 1
204 1 10 VAL HA 1 116 GLN H . . 4.710 4.700 4.199 5.028 0.318 2 0 "[ . 1 . 2]" 1
205 1 10 VAL HB 1 11 TYR H . . 4.290 3.090 2.447 3.802 . 0 0 "[ . 1 . 2]" 1
206 1 10 VAL HB 1 11 TYR QB . . 5.500 5.255 4.823 5.784 0.284 13 0 "[ . 1 . 2]" 1
207 1 10 VAL HB 1 12 VAL H . . 5.500 4.850 4.579 5.176 . 0 0 "[ . 1 . 2]" 1
208 1 10 VAL HB 1 33 HIS HA . . 5.500 5.059 4.491 5.551 0.051 8 0 "[ . 1 . 2]" 1
209 1 10 VAL HB 1 34 PHE H . . 5.050 3.968 2.909 4.717 . 0 0 "[ . 1 . 2]" 1
210 1 10 VAL HB 1 34 PHE QB . . 4.410 3.864 2.557 4.555 0.145 10 0 "[ . 1 . 2]" 1
211 1 10 VAL HB 1 34 PHE HD2 . . 5.500 4.886 3.989 5.435 . 0 0 "[ . 1 . 2]" 1
212 1 10 VAL HB 1 42 VAL QG . . 4.230 3.748 2.786 4.420 0.190 10 0 "[ . 1 . 2]" 1
213 1 10 VAL HB 1 46 ILE MD . . 3.840 3.172 2.408 3.680 . 0 0 "[ . 1 . 2]" 1
214 1 10 VAL HB 1 113 LEU QD . . 3.820 3.062 1.977 4.587 0.767 3 2 "[ + . - 1 . 2]" 1
215 1 10 VAL HB 1 114 SER H . . 4.360 3.669 2.679 5.180 0.820 2 7 "[ +* .** 1 * .-* 2]" 1
216 1 10 VAL QG 1 11 TYR H . . 3.160 2.889 2.005 3.584 0.424 8 0 "[ . 1 . 2]" 1
217 1 10 VAL QG 1 11 TYR HA . . 3.820 3.794 3.588 4.251 0.431 8 0 "[ . 1 . 2]" 1
218 1 10 VAL QG 1 12 VAL HA . . 4.790 3.948 3.398 4.333 . 0 0 "[ . 1 . 2]" 1
219 1 10 VAL QG 1 34 PHE H . . 3.740 2.692 2.123 3.579 . 0 0 "[ . 1 . 2]" 1
220 1 10 VAL QG 1 34 PHE HA . . 4.860 4.393 3.890 5.193 0.333 2 0 "[ . 1 . 2]" 1
221 1 10 VAL QG 1 34 PHE QB . . 4.050 2.380 1.892 3.268 . 0 0 "[ . 1 . 2]" 1
222 1 10 VAL QG 1 34 PHE HD2 . . 3.720 3.195 2.626 4.149 0.429 3 0 "[ . 1 . 2]" 1
223 1 10 VAL QG 1 35 GLY HA3 . . 5.440 4.256 4.068 4.590 . 0 0 "[ . 1 . 2]" 1
224 1 10 VAL QG 1 42 VAL HA . . 5.440 4.364 3.985 4.776 . 0 0 "[ . 1 . 2]" 1
225 1 10 VAL QG 1 42 VAL HB . . 4.040 3.925 3.768 4.225 0.185 10 0 "[ . 1 . 2]" 1
226 1 10 VAL QG 1 43 LEU HA . . 4.220 4.020 3.791 4.268 0.048 1 0 "[ . 1 . 2]" 1
227 1 10 VAL QG 1 46 ILE MD . . 2.630 1.840 1.695 2.101 . 0 0 "[ . 1 . 2]" 1
228 1 10 VAL QG 1 46 ILE HG12 . . 4.180 3.112 2.831 3.491 . 0 0 "[ . 1 . 2]" 1
229 1 10 VAL QG 1 96 ALA MB . . 4.190 3.784 3.496 4.093 . 0 0 "[ . 1 . 2]" 1
230 1 10 VAL QG 1 97 LEU HA . . 4.630 3.819 3.186 4.259 . 0 0 "[ . 1 . 2]" 1
231 1 10 VAL QG 1 97 LEU QB . . 5.280 3.921 3.032 4.567 . 0 0 "[ . 1 . 2]" 1
232 1 10 VAL QG 1 113 LEU HA . . 3.950 4.130 3.342 4.699 0.749 14 8 "[ . *** - +* **]" 1
233 1 10 VAL QG 1 113 LEU QB . . 3.730 2.513 1.875 3.017 . 0 0 "[ . 1 . 2]" 1
234 1 10 VAL QG 1 113 LEU QD . . 3.420 2.074 1.785 2.243 . 0 0 "[ . 1 . 2]" 1
235 1 10 VAL QG 1 113 LEU HG . . 3.840 3.131 2.780 3.502 . 0 0 "[ . 1 . 2]" 1
236 1 10 VAL QG 1 114 SER H . . 3.080 3.213 2.363 3.765 0.685 8 11 "[* *. +***- *. ***]" 1
237 1 10 VAL QG 1 114 SER QB . . 5.280 4.812 4.174 5.270 . 0 0 "[ . 1 . 2]" 1
238 1 10 VAL QG 1 115 SER H . . 5.270 3.392 3.033 3.956 . 0 0 "[ . 1 . 2]" 1
239 1 10 VAL QG 1 115 SER HA . . 4.080 2.720 2.062 3.294 . 0 0 "[ . 1 . 2]" 1
240 1 10 VAL QG 1 115 SER QB . . 4.520 2.555 1.789 3.571 . 0 0 "[ . 1 . 2]" 1
241 1 10 VAL MG1 1 11 TYR H . . 4.100 3.225 2.011 3.980 . 0 0 "[ . 1 . 2]" 1
242 1 10 VAL MG1 1 34 PHE H . . 5.040 4.384 3.518 5.047 0.007 8 0 "[ . 1 . 2]" 1
243 1 10 VAL MG1 1 34 PHE QB . . 4.360 3.855 3.571 4.083 . 0 0 "[ . 1 . 2]" 1
244 1 10 VAL MG1 1 34 PHE HD2 . . 4.640 4.758 3.971 5.218 0.578 11 4 "[ - *+ *. 2]" 1
245 1 10 VAL MG1 1 43 LEU HA . . 5.500 4.750 4.196 5.536 0.036 7 0 "[ . 1 . 2]" 1
246 1 10 VAL MG1 1 46 ILE MD . . 3.060 2.927 1.988 3.451 0.391 8 0 "[ . 1 . 2]" 1
247 1 10 VAL MG1 1 115 SER HA . . 4.710 2.910 2.065 3.716 . 0 0 "[ . 1 . 2]" 1
248 1 10 VAL MG2 1 11 TYR H . . 4.100 3.745 3.366 4.069 . 0 0 "[ . 1 . 2]" 1
249 1 10 VAL MG2 1 34 PHE H . . 5.040 3.057 2.126 4.628 . 0 0 "[ . 1 . 2]" 1
250 1 10 VAL MG2 1 34 PHE QB . . 4.360 2.517 1.896 3.709 . 0 0 "[ . 1 . 2]" 1
251 1 10 VAL MG2 1 34 PHE HD2 . . 4.640 3.600 2.634 5.205 0.565 17 2 "[ .- 1 . + 2]" 1
252 1 10 VAL MG2 1 43 LEU HA . . 5.500 4.509 3.877 4.980 . 0 0 "[ . 1 . 2]" 1
253 1 10 VAL MG2 1 46 ILE MD . . 3.060 2.144 1.700 2.942 . 0 0 "[ . 1 . 2]" 1
254 1 10 VAL MG2 1 115 SER HA . . 4.710 4.103 2.440 5.018 0.308 15 0 "[ . 1 . 2]" 1
255 1 11 TYR H 1 11 TYR QB . . 3.640 2.565 2.440 2.680 . 0 0 "[ . 1 . 2]" 1
256 1 11 TYR H 1 11 TYR QD . . 4.610 2.995 2.302 3.443 . 0 0 "[ . 1 . 2]" 1
257 1 11 TYR H 1 12 VAL H . . 4.270 4.026 3.929 4.184 . 0 0 "[ . 1 . 2]" 1
258 1 11 TYR H 1 33 HIS HA . . 4.720 4.695 4.490 4.947 0.227 15 0 "[ . 1 . 2]" 1
259 1 11 TYR H 1 34 PHE H . . 5.270 4.750 4.460 5.059 . 0 0 "[ . 1 . 2]" 1
260 1 11 TYR H 1 46 ILE MD . . 5.340 5.201 4.654 5.810 0.470 8 0 "[ . 1 . 2]" 1
261 1 11 TYR H 1 113 LEU HA . . 4.650 4.079 3.754 4.359 . 0 0 "[ . 1 . 2]" 1
262 1 11 TYR H 1 113 LEU QB . . 5.040 3.548 3.289 3.711 . 0 0 "[ . 1 . 2]" 1
263 1 11 TYR H 1 113 LEU QD . . 4.170 4.140 3.733 4.366 0.196 18 0 "[ . 1 . 2]" 1
264 1 11 TYR H 1 113 LEU HG . . 5.500 5.944 5.545 6.103 0.603 18 11 "[ ** ** *-1 ** .**+ 2]" 1
265 1 11 TYR H 1 114 SER H . . 3.740 2.281 2.005 2.510 . 0 0 "[ . 1 . 2]" 1
266 1 11 TYR H 1 114 SER QB . . 4.960 4.236 3.441 4.745 . 0 0 "[ . 1 . 2]" 1
267 1 11 TYR H 1 115 SER HA . . 3.860 3.535 3.176 4.082 0.222 15 0 "[ . 1 . 2]" 1
268 1 11 TYR H 1 115 SER QB . . 5.340 5.114 4.623 5.655 0.315 15 0 "[ . 1 . 2]" 1
269 1 11 TYR H 1 116 GLN H . . 4.850 4.900 4.092 5.090 0.240 19 0 "[ . 1 . 2]" 1
270 1 11 TYR HA 1 11 TYR QD . . 4.440 2.860 2.598 3.215 . 0 0 "[ . 1 . 2]" 1
271 1 11 TYR HA 1 12 VAL H . . 3.180 2.158 2.112 2.193 . 0 0 "[ . 1 . 2]" 1
272 1 11 TYR HA 1 12 VAL QG . . 4.070 3.634 3.541 3.719 . 0 0 "[ . 1 . 2]" 1
273 1 11 TYR HA 1 33 HIS H . . 4.830 4.891 4.721 5.079 0.249 12 0 "[ . 1 . 2]" 1
274 1 11 TYR HA 1 33 HIS HA . . 3.530 2.382 2.117 2.671 . 0 0 "[ . 1 . 2]" 1
275 1 11 TYR HA 1 33 HIS HB2 . . 4.050 2.740 2.313 3.205 . 0 0 "[ . 1 . 2]" 1
276 1 11 TYR HA 1 33 HIS HB3 . . 3.680 2.402 2.011 2.861 . 0 0 "[ . 1 . 2]" 1
277 1 11 TYR HA 1 34 PHE H . . 3.990 3.547 3.297 3.742 . 0 0 "[ . 1 . 2]" 1
278 1 11 TYR HA 1 113 LEU QD . . 5.440 5.935 5.565 6.063 0.623 16 12 "[ ***.** *1* * .+**-2]" 1
279 1 11 TYR QB 1 12 VAL H . . 4.120 3.623 3.560 3.678 . 0 0 "[ . 1 . 2]" 1
280 1 11 TYR QB 1 13 ASN H . . 5.500 4.711 4.201 4.954 . 0 0 "[ . 1 . 2]" 1
281 1 11 TYR QB 1 34 PHE H . . 5.500 5.480 5.256 5.628 0.128 8 0 "[ . 1 . 2]" 1
282 1 11 TYR QB 1 114 SER H . . 4.030 3.453 3.226 3.628 . 0 0 "[ . 1 . 2]" 1
283 1 11 TYR QB 1 116 GLN H . . 5.050 5.114 3.561 5.701 0.651 12 1 "[ . 1 + . 2]" 1
284 1 11 TYR QD 1 116 GLN H . . 5.110 3.974 2.261 4.636 . 0 0 "[ . 1 . 2]" 1
285 1 11 TYR QD 1 117 PRO HA . . 4.500 3.366 3.013 3.848 . 0 0 "[ . 1 . 2]" 1
286 1 11 TYR QD 1 117 PRO QB . . 5.330 4.339 3.569 4.717 . 0 0 "[ . 1 . 2]" 1
287 1 11 TYR HE2 1 117 PRO HA . . 5.070 3.673 1.819 5.505 0.435 3 0 "[ . 1 . 2]" 1
288 1 11 TYR HE2 1 117 PRO QB . . 5.500 3.732 2.109 5.548 0.048 1 0 "[ . 1 . 2]" 1
289 1 12 VAL H 1 12 VAL HB . . 3.150 2.583 2.494 2.676 . 0 0 "[ . 1 . 2]" 1
290 1 12 VAL H 1 12 VAL QG . . 2.890 2.099 1.997 2.158 . 0 0 "[ . 1 . 2]" 1
291 1 12 VAL H 1 13 ASN H . . 4.650 4.298 4.110 4.439 . 0 0 "[ . 1 . 2]" 1
292 1 12 VAL H 1 32 ASP HA . . 4.040 4.249 4.002 4.629 0.589 15 2 "[ . 1 + - 2]" 1
293 1 12 VAL H 1 33 HIS H . . 3.870 3.959 3.817 4.179 0.309 17 0 "[ . 1 . 2]" 1
294 1 12 VAL H 1 33 HIS HA . . 3.530 1.757 1.685 1.826 . 0 0 "[ . 1 . 2]" 1
295 1 12 VAL H 1 33 HIS HB3 . . 4.580 3.311 2.858 3.673 . 0 0 "[ . 1 . 2]" 1
296 1 12 VAL H 1 34 PHE H . . 4.130 3.469 3.345 3.635 . 0 0 "[ . 1 . 2]" 1
297 1 12 VAL H 1 34 PHE HA . . 5.500 6.031 5.981 6.088 0.588 20 16 "[-* *.*** * ********+]" 1
298 1 12 VAL H 1 34 PHE HD2 . . 5.040 5.055 4.830 5.247 0.207 8 0 "[ . 1 . 2]" 1
299 1 12 VAL H 1 46 ILE MD . . 5.500 4.740 4.423 5.152 . 0 0 "[ . 1 . 2]" 1
300 1 12 VAL H 1 113 LEU HA . . 5.180 4.437 4.176 4.635 . 0 0 "[ . 1 . 2]" 1
301 1 12 VAL H 1 113 LEU HB2 . . 5.500 4.521 4.126 4.766 . 0 0 "[ . 1 . 2]" 1
302 1 12 VAL H 1 113 LEU QB . . 4.710 4.151 3.811 4.396 . 0 0 "[ . 1 . 2]" 1
303 1 12 VAL H 1 113 LEU HB3 . . 5.500 4.837 4.481 5.233 . 0 0 "[ . 1 . 2]" 1
304 1 12 VAL H 1 114 SER H . . 5.070 4.838 4.588 5.047 . 0 0 "[ . 1 . 2]" 1
305 1 12 VAL HA 1 12 VAL QG . . 2.880 2.186 2.173 2.205 . 0 0 "[ . 1 . 2]" 1
306 1 12 VAL HA 1 13 ASN H . . 3.250 2.167 2.123 2.225 . 0 0 "[ . 1 . 2]" 1
307 1 12 VAL HA 1 13 ASN HA . . 4.500 4.475 4.442 4.507 0.007 9 0 "[ . 1 . 2]" 1
308 1 12 VAL HA 1 13 ASN HB3 . . 4.830 4.596 4.478 4.742 . 0 0 "[ . 1 . 2]" 1
309 1 12 VAL HA 1 14 LYS H . . 5.170 5.083 4.752 5.473 0.303 4 0 "[ . 1 . 2]" 1
310 1 12 VAL HA 1 14 LYS QD . . 5.340 5.000 4.470 5.404 0.064 5 0 "[ . 1 . 2]" 1
311 1 12 VAL HA 1 112 LEU HA . . 5.390 4.937 4.725 5.241 . 0 0 "[ . 1 . 2]" 1
312 1 12 VAL HA 1 112 LEU QD . . 4.530 4.148 3.921 4.367 . 0 0 "[ . 1 . 2]" 1
313 1 12 VAL HA 1 112 LEU HG . . 5.500 4.439 4.127 4.692 . 0 0 "[ . 1 . 2]" 1
314 1 12 VAL HA 1 113 LEU H . . 5.500 4.621 4.472 4.794 . 0 0 "[ . 1 . 2]" 1
315 1 12 VAL HA 1 113 LEU HA . . 4.030 2.341 2.089 2.675 . 0 0 "[ . 1 . 2]" 1
316 1 12 VAL HA 1 113 LEU QB . . 4.480 2.410 1.981 2.632 . 0 0 "[ . 1 . 2]" 1
317 1 12 VAL HA 1 114 SER H . . 4.450 4.014 3.716 4.353 . 0 0 "[ . 1 . 2]" 1
318 1 12 VAL HB 1 13 ASN H . . 4.200 4.414 4.344 4.473 0.273 5 0 "[ . 1 . 2]" 1
319 1 12 VAL HB 1 14 LYS QE . . 5.210 3.521 2.938 4.125 . 0 0 "[ . 1 . 2]" 1
320 1 12 VAL HB 1 32 ASP H . . 4.340 4.739 4.499 5.035 0.695 17 2 "[ . 1 .-+ 2]" 1
321 1 12 VAL HB 1 32 ASP HA . . 4.200 2.895 2.590 3.272 . 0 0 "[ . 1 . 2]" 1
322 1 12 VAL HB 1 33 HIS H . . 4.920 3.700 3.515 3.853 . 0 0 "[ . 1 . 2]" 1
323 1 12 VAL HB 1 46 ILE MD . . 4.660 4.820 4.594 5.072 0.412 16 0 "[ . 1 . 2]" 1
324 1 12 VAL HB 1 112 LEU QD . . 5.440 4.970 4.719 5.126 . 0 0 "[ . 1 . 2]" 1
325 1 12 VAL QG 1 13 ASN H . . 3.250 3.171 2.993 3.380 0.130 9 0 "[ . 1 . 2]" 1
326 1 12 VAL QG 1 13 ASN HA . . 4.330 4.110 3.942 4.313 . 0 0 "[ . 1 . 2]" 1
327 1 12 VAL QG 1 13 ASN HB3 . . 4.940 4.870 4.674 5.016 0.076 9 0 "[ . 1 . 2]" 1
328 1 12 VAL QG 1 14 LYS H . . 3.840 3.421 2.823 3.866 0.026 4 0 "[ . 1 . 2]" 1
329 1 12 VAL QG 1 14 LYS HA . . 4.110 3.821 3.343 4.105 . 0 0 "[ . 1 . 2]" 1
330 1 12 VAL QG 1 14 LYS HB3 . . 4.100 3.381 2.900 4.452 0.352 4 0 "[ . 1 . 2]" 1
331 1 12 VAL QG 1 14 LYS QD . . 3.270 2.870 2.025 3.518 0.248 9 0 "[ . 1 . 2]" 1
332 1 12 VAL QG 1 14 LYS QE . . 3.350 2.890 2.524 3.534 0.184 10 0 "[ . 1 . 2]" 1
333 1 12 VAL QG 1 14 LYS HG2 . . 4.410 4.802 4.194 5.164 0.754 5 7 "[* * + -*1* . * 2]" 1
334 1 12 VAL QG 1 14 LYS HG3 . . 4.730 4.961 4.597 5.180 0.450 18 0 "[ . 1 . 2]" 1
335 1 12 VAL QG 1 27 ILE MG . . 4.290 3.678 3.380 3.902 . 0 0 "[ . 1 . 2]" 1
336 1 12 VAL QG 1 28 GLN HA . . 5.030 5.382 5.062 5.665 0.635 1 2 "[+ - . 1 . 2]" 1
337 1 12 VAL QG 1 30 LEU QB . . 3.320 3.570 2.389 3.812 0.492 17 0 "[ . 1 . 2]" 1
338 1 12 VAL QG 1 30 LEU QD . . 3.400 1.841 1.756 2.166 . 0 0 "[ . 1 . 2]" 1
339 1 12 VAL QG 1 30 LEU HG . . 3.770 4.047 3.499 4.228 0.458 12 0 "[ . 1 . 2]" 1
340 1 12 VAL QG 1 31 PRO HA . . 5.180 5.015 4.800 5.228 0.048 17 0 "[ . 1 . 2]" 1
341 1 12 VAL QG 1 31 PRO QG . . 3.730 3.576 2.881 4.664 0.934 2 2 "[ + . 1 . - 2]" 1
342 1 12 VAL QG 1 32 ASP H . . 4.330 4.752 4.527 4.929 0.599 17 2 "[ . - . + 2]" 1
343 1 12 VAL QG 1 32 ASP HA . . 3.370 3.565 3.324 3.802 0.432 5 0 "[ . 1 . 2]" 1
344 1 12 VAL QG 1 33 HIS H . . 3.580 3.573 3.425 3.748 0.168 17 0 "[ . 1 . 2]" 1
345 1 12 VAL QG 1 33 HIS HA . . 3.760 2.263 2.064 2.472 . 0 0 "[ . 1 . 2]" 1
346 1 12 VAL QG 1 33 HIS HB3 . . 4.960 4.367 4.085 4.572 . 0 0 "[ . 1 . 2]" 1
347 1 12 VAL QG 1 34 PHE H . . 4.310 2.753 2.292 3.191 . 0 0 "[ . 1 . 2]" 1
348 1 12 VAL QG 1 34 PHE HA . . 5.160 4.405 4.173 4.613 . 0 0 "[ . 1 . 2]" 1
349 1 12 VAL QG 1 34 PHE QB . . 4.710 3.253 3.042 3.509 . 0 0 "[ . 1 . 2]" 1
350 1 12 VAL QG 1 34 PHE HD2 . . 3.370 2.246 2.147 2.413 . 0 0 "[ . 1 . 2]" 1
351 1 12 VAL QG 1 46 ILE MD . . 4.320 2.268 2.095 2.458 . 0 0 "[ . 1 . 2]" 1
352 1 12 VAL QG 1 112 LEU QD . . 3.190 2.620 2.335 2.771 . 0 0 "[ . 1 . 2]" 1
353 1 12 VAL QG 1 112 LEU HG . . 4.450 2.893 2.703 3.142 . 0 0 "[ . 1 . 2]" 1
354 1 12 VAL QG 1 113 LEU HA . . 5.130 3.633 3.421 3.889 . 0 0 "[ . 1 . 2]" 1
355 1 12 VAL QG 1 113 LEU QB . . 4.920 2.547 2.311 2.852 . 0 0 "[ . 1 . 2]" 1
356 1 13 ASN H 1 13 ASN HB2 . . 3.390 2.828 2.741 2.884 . 0 0 "[ . 1 . 2]" 1
357 1 13 ASN H 1 13 ASN HB3 . . 3.460 2.463 2.368 2.560 . 0 0 "[ . 1 . 2]" 1
358 1 13 ASN H 1 13 ASN QD . . 4.670 4.494 4.397 4.584 . 0 0 "[ . 1 . 2]" 1
359 1 13 ASN H 1 14 LYS H . . 4.210 3.981 3.777 4.227 0.017 4 0 "[ . 1 . 2]" 1
360 1 13 ASN H 1 14 LYS HA . . 4.960 5.007 4.935 5.093 0.133 9 0 "[ . 1 . 2]" 1
361 1 13 ASN H 1 15 HIS H . . 5.240 5.387 5.296 5.625 0.385 4 0 "[ . 1 . 2]" 1
362 1 13 ASN H 1 16 GLY H . . 5.500 5.216 5.109 5.314 . 0 0 "[ . 1 . 2]" 1
363 1 13 ASN H 1 112 LEU H . . 5.500 5.346 5.150 5.515 0.015 13 0 "[ . 1 . 2]" 1
364 1 13 ASN H 1 112 LEU HA . . 3.890 3.574 3.362 3.716 . 0 0 "[ . 1 . 2]" 1
365 1 13 ASN H 1 112 LEU HB3 . . 5.080 5.393 5.296 5.532 0.452 2 0 "[ . 1 . 2]" 1
366 1 13 ASN H 1 112 LEU QD . . 3.310 3.657 3.608 3.707 0.397 14 0 "[ . 1 . 2]" 1
367 1 13 ASN H 1 112 LEU HG . . 4.490 4.625 4.423 4.754 0.264 8 0 "[ . 1 . 2]" 1
368 1 13 ASN H 1 113 LEU H . . 4.680 3.926 3.660 4.212 . 0 0 "[ . 1 . 2]" 1
369 1 13 ASN H 1 113 LEU HA . . 4.310 2.287 1.971 2.494 . 0 0 "[ . 1 . 2]" 1
370 1 13 ASN H 1 113 LEU QB . . 4.380 3.526 3.108 3.770 . 0 0 "[ . 1 . 2]" 1
371 1 13 ASN H 1 113 LEU QD . . 4.890 4.545 4.337 4.733 . 0 0 "[ . 1 . 2]" 1
372 1 13 ASN H 1 114 SER H . . 5.080 4.425 4.136 4.722 . 0 0 "[ . 1 . 2]" 1
373 1 13 ASN HA 1 14 LYS H . . 2.880 2.216 2.095 2.312 . 0 0 "[ . 1 . 2]" 1
374 1 13 ASN HA 1 14 LYS HB3 . . 5.500 5.150 4.972 5.601 0.101 4 0 "[ . 1 . 2]" 1
375 1 13 ASN HA 1 14 LYS QD . . 3.940 3.334 3.130 3.693 . 0 0 "[ . 1 . 2]" 1
376 1 13 ASN HA 1 14 LYS HG2 . . 4.420 4.155 3.512 4.455 0.035 5 0 "[ . 1 . 2]" 1
377 1 13 ASN HA 1 15 HIS H . . 3.480 3.204 3.077 3.601 0.121 4 0 "[ . 1 . 2]" 1
378 1 13 ASN HA 1 16 GLY H . . 4.900 4.180 3.969 4.349 . 0 0 "[ . 1 . 2]" 1
379 1 13 ASN HA 1 112 LEU HA . . 5.210 5.072 4.998 5.241 0.031 4 0 "[ . 1 . 2]" 1
380 1 13 ASN HA 1 112 LEU QD . . 4.640 4.679 4.549 4.824 0.184 4 0 "[ . 1 . 2]" 1
381 1 13 ASN HB2 1 14 LYS H . . 4.630 4.529 4.374 4.612 . 0 0 "[ . 1 . 2]" 1
382 1 13 ASN HB2 1 15 HIS H . . 4.950 4.811 4.640 5.014 0.064 4 0 "[ . 1 . 2]" 1
383 1 13 ASN HB2 1 112 LEU HA . . 4.980 4.984 4.750 5.117 0.137 14 0 "[ . 1 . 2]" 1
384 1 13 ASN HB3 1 16 GLY HA3 . . 5.000 3.821 3.411 4.159 . 0 0 "[ . 1 . 2]" 1
385 1 13 ASN HB3 1 112 LEU HA . . 3.480 3.343 3.069 3.475 . 0 0 "[ . 1 . 2]" 1
386 1 13 ASN HB3 1 112 LEU QD . . 4.580 4.322 4.088 4.552 . 0 0 "[ . 1 . 2]" 1
387 1 13 ASN HB3 1 113 LEU HA . . 5.120 3.736 3.244 3.956 . 0 0 "[ . 1 . 2]" 1
388 1 13 ASN QD 1 15 HIS H . . 4.390 4.156 3.734 4.493 0.103 8 0 "[ . 1 . 2]" 1
389 1 13 ASN QD 1 15 HIS HA . . 5.500 5.242 4.895 5.510 0.010 14 0 "[ . 1 . 2]" 1
390 1 13 ASN QD 1 16 GLY H . . 3.990 2.970 2.784 3.315 . 0 0 "[ . 1 . 2]" 1
391 1 13 ASN QD 1 16 GLY HA2 . . 4.400 3.048 2.557 3.434 . 0 0 "[ . 1 . 2]" 1
392 1 13 ASN QD 1 16 GLY HA3 . . 4.480 2.742 2.508 3.155 . 0 0 "[ . 1 . 2]" 1
393 1 13 ASN QD 1 17 ASN H . . 4.680 4.600 4.239 4.999 0.319 14 0 "[ . 1 . 2]" 1
394 1 13 ASN QD 1 111 ASN HA . . 5.500 3.943 3.584 4.501 . 0 0 "[ . 1 . 2]" 1
395 1 13 ASN QD 1 111 ASN HB2 . . 4.750 3.536 2.765 4.494 . 0 0 "[ . 1 . 2]" 1
396 1 13 ASN QD 1 111 ASN HB3 . . 4.750 2.865 2.285 4.602 . 0 0 "[ . 1 . 2]" 1
397 1 13 ASN QD 1 112 LEU H . . 5.500 5.173 4.951 5.325 . 0 0 "[ . 1 . 2]" 1
398 1 13 ASN QD 1 112 LEU HA . . 4.640 4.347 4.046 4.562 . 0 0 "[ . 1 . 2]" 1
399 1 14 LYS H 1 14 LYS HB3 . . 3.310 3.003 2.856 3.561 0.251 4 0 "[ . 1 . 2]" 1
400 1 14 LYS H 1 14 LYS QD . . 2.940 1.848 1.722 2.608 . 0 0 "[ . 1 . 2]" 1
401 1 14 LYS H 1 14 LYS HE2 . . 4.720 4.064 3.723 4.707 . 0 0 "[ . 1 . 2]" 1
402 1 14 LYS H 1 14 LYS QE . . 4.150 3.713 3.441 4.223 0.073 4 0 "[ . 1 . 2]" 1
403 1 14 LYS H 1 14 LYS HE3 . . 4.720 4.306 4.049 5.035 0.315 4 0 "[ . 1 . 2]" 1
404 1 14 LYS H 1 14 LYS HG2 . . 4.280 2.361 1.839 2.553 . 0 0 "[ . 1 . 2]" 1
405 1 14 LYS H 1 14 LYS HG3 . . 4.310 3.640 3.434 3.749 . 0 0 "[ . 1 . 2]" 1
406 1 14 LYS H 1 15 HIS H . . 3.080 2.543 2.443 2.679 . 0 0 "[ . 1 . 2]" 1
407 1 14 LYS H 1 15 HIS HA . . 5.400 5.177 5.098 5.287 . 0 0 "[ . 1 . 2]" 1
408 1 14 LYS H 1 15 HIS HB2 . . 4.720 4.816 4.645 4.946 0.226 2 0 "[ . 1 . 2]" 1
409 1 14 LYS H 1 16 GLY H . . 4.300 4.096 3.945 4.261 . 0 0 "[ . 1 . 2]" 1
410 1 14 LYS H 1 27 ILE MG . . 5.280 4.599 4.432 5.365 0.085 4 0 "[ . 1 . 2]" 1
411 1 14 LYS H 1 28 GLN QE . . 5.110 5.292 4.926 5.541 0.431 13 0 "[ . 1 . 2]" 1
412 1 14 LYS H 1 32 ASP HA . . 4.890 4.540 4.116 4.914 0.024 1 0 "[ . 1 . 2]" 1
413 1 14 LYS H 1 112 LEU QD . . 4.120 3.938 3.711 4.494 0.374 4 0 "[ . 1 . 2]" 1
414 1 14 LYS HA 1 14 LYS HD2 . . 5.330 3.845 2.571 4.153 . 0 0 "[ . 1 . 2]" 1
415 1 14 LYS HA 1 14 LYS QD . . 4.670 3.743 2.548 4.017 . 0 0 "[ . 1 . 2]" 1
416 1 14 LYS HA 1 14 LYS HD3 . . 5.330 5.158 4.168 5.341 0.011 10 0 "[ . 1 . 2]" 1
417 1 14 LYS HA 1 14 LYS HG2 . . 3.610 3.733 3.530 3.774 0.164 5 0 "[ . 1 . 2]" 1
418 1 14 LYS HA 1 15 HIS H . . 3.560 3.410 3.357 3.472 . 0 0 "[ . 1 . 2]" 1
419 1 14 LYS HA 1 15 HIS HA . . 4.950 4.767 4.715 4.828 . 0 0 "[ . 1 . 2]" 1
420 1 14 LYS HA 1 16 GLY H . . 3.600 3.621 3.397 3.865 0.265 4 0 "[ . 1 . 2]" 1
421 1 14 LYS HA 1 27 ILE MG . . 3.490 2.630 2.451 2.993 . 0 0 "[ . 1 . 2]" 1
422 1 14 LYS HA 1 28 GLN QE . . 3.630 3.805 3.581 4.009 0.379 18 0 "[ . 1 . 2]" 1
423 1 14 LYS HA 1 112 LEU QD . . 4.030 2.449 2.250 2.941 . 0 0 "[ . 1 . 2]" 1
424 1 14 LYS HB2 1 15 HIS H . . 4.070 4.004 2.972 4.211 0.141 9 0 "[ . 1 . 2]" 1
425 1 14 LYS HB2 1 16 GLY H . . 5.120 5.306 4.926 5.519 0.399 18 0 "[ . 1 . 2]" 1
426 1 14 LYS HB2 1 28 GLN QE . . 3.980 2.457 2.096 2.899 . 0 0 "[ . 1 . 2]" 1
427 1 14 LYS HB2 1 28 GLN QG . . 5.200 3.898 3.478 4.932 . 0 0 "[ . 1 . 2]" 1
428 1 14 LYS HB3 1 14 LYS QD . . 3.680 2.697 2.585 2.946 . 0 0 "[ . 1 . 2]" 1
429 1 14 LYS HB3 1 15 HIS H . . 4.550 4.441 4.153 4.550 . 0 0 "[ . 1 . 2]" 1
430 1 14 LYS HB3 1 16 GLY H . . 5.500 5.626 5.508 5.804 0.304 18 0 "[ . 1 . 2]" 1
431 1 14 LYS HB3 1 27 ILE MG . . 3.930 2.508 2.263 3.506 . 0 0 "[ . 1 . 2]" 1
432 1 14 LYS HB3 1 28 GLN QE . . 4.140 3.869 2.770 4.221 0.081 13 0 "[ . 1 . 2]" 1
433 1 14 LYS HB3 1 28 GLN QG . . 5.130 4.885 4.104 5.102 . 0 0 "[ . 1 . 2]" 1
434 1 14 LYS QD 1 15 HIS H . . 5.040 3.931 3.775 4.550 . 0 0 "[ . 1 . 2]" 1
435 1 14 LYS QD 1 28 GLN HA . . 4.690 4.060 3.652 4.270 . 0 0 "[ . 1 . 2]" 1
436 1 14 LYS QD 1 32 ASP HA . . 4.160 2.589 1.801 3.042 . 0 0 "[ . 1 . 2]" 1
437 1 14 LYS HD2 1 27 ILE MG . . 5.500 4.705 4.340 4.952 . 0 0 "[ . 1 . 2]" 1
438 1 14 LYS HD2 1 28 GLN HA . . 5.500 4.712 4.400 4.988 . 0 0 "[ . 1 . 2]" 1
439 1 14 LYS HD3 1 27 ILE MG . . 5.500 5.555 5.366 5.724 0.224 19 0 "[ . 1 . 2]" 1
440 1 14 LYS HD3 1 28 GLN HA . . 5.500 4.442 3.901 4.971 . 0 0 "[ . 1 . 2]" 1
441 1 14 LYS QE 1 14 LYS HG3 . . 3.330 2.737 2.397 2.902 . 0 0 "[ . 1 . 2]" 1
442 1 14 LYS QE 1 27 ILE MG . . 4.300 3.740 3.360 4.315 0.015 13 0 "[ . 1 . 2]" 1
443 1 14 LYS QE 1 28 GLN H . . 4.880 4.877 4.436 5.104 0.224 19 0 "[ . 1 . 2]" 1
444 1 14 LYS QE 1 28 GLN HA . . 3.500 2.807 2.014 3.212 . 0 0 "[ . 1 . 2]" 1
445 1 14 LYS QE 1 28 GLN QE . . 5.340 5.128 4.337 5.548 0.208 5 0 "[ . 1 . 2]" 1
446 1 14 LYS QE 1 28 GLN QG . . 5.340 5.265 4.621 5.575 0.235 19 0 "[ . 1 . 2]" 1
447 1 14 LYS QE 1 29 GLN H . . 4.290 4.764 4.292 5.055 0.765 20 12 "[*** .** 1-* **** +]" 1
448 1 14 LYS QE 1 30 LEU H . . 4.150 4.092 3.149 4.289 0.139 10 0 "[ . 1 . 2]" 1
449 1 14 LYS QE 1 30 LEU QB . . 4.500 4.266 2.090 4.803 0.303 13 0 "[ . 1 . 2]" 1
450 1 14 LYS QE 1 30 LEU QD . . 4.090 2.524 1.893 3.736 . 0 0 "[ . 1 . 2]" 1
451 1 14 LYS QE 1 30 LEU HG . . 3.350 3.654 3.504 3.818 0.468 18 0 "[ . 1 . 2]" 1
452 1 14 LYS QE 1 32 ASP HA . . 4.080 2.513 2.057 3.356 . 0 0 "[ . 1 . 2]" 1
453 1 14 LYS HE2 1 14 LYS HG3 . . 4.090 3.170 2.883 3.691 . 0 0 "[ . 1 . 2]" 1
454 1 14 LYS HE2 1 28 GLN HA . . 4.120 3.370 2.265 4.368 0.248 5 0 "[ . 1 . 2]" 1
455 1 14 LYS HE2 1 30 LEU H . . 4.840 4.590 3.398 5.159 0.319 8 0 "[ . 1 . 2]" 1
456 1 14 LYS HE2 1 30 LEU QD . . 4.720 2.804 2.144 4.322 . 0 0 "[ . 1 . 2]" 1
457 1 14 LYS HE3 1 14 LYS HG3 . . 4.090 3.370 2.433 3.785 . 0 0 "[ . 1 . 2]" 1
458 1 14 LYS HE3 1 28 GLN HA . . 4.120 3.771 2.022 4.615 0.495 19 0 "[ . 1 . 2]" 1
459 1 14 LYS HE3 1 30 LEU H . . 4.840 4.779 3.235 5.152 0.312 16 0 "[ . 1 . 2]" 1
460 1 14 LYS HE3 1 30 LEU QD . . 4.720 2.939 1.919 4.240 . 0 0 "[ . 1 . 2]" 1
461 1 14 LYS HG2 1 15 HIS H . . 4.100 2.911 2.567 3.675 . 0 0 "[ . 1 . 2]" 1
462 1 14 LYS HG2 1 16 GLY H . . 5.500 5.137 4.961 5.576 0.076 4 0 "[ . 1 . 2]" 1
463 1 14 LYS HG2 1 28 GLN HA . . 4.750 4.160 3.615 5.152 0.402 4 0 "[ . 1 . 2]" 1
464 1 14 LYS HG2 1 28 GLN QE . . 4.600 4.226 3.333 5.072 0.472 4 0 "[ . 1 . 2]" 1
465 1 14 LYS HG2 1 32 ASP HA . . 5.450 5.032 3.800 5.563 0.113 5 0 "[ . 1 . 2]" 1
466 1 14 LYS HG3 1 27 ILE MG . . 5.320 4.258 3.894 5.468 0.148 4 0 "[ . 1 . 2]" 1
467 1 14 LYS HG3 1 28 GLN HA . . 4.820 2.528 1.941 3.856 . 0 0 "[ . 1 . 2]" 1
468 1 14 LYS HG3 1 30 LEU QD . . 5.280 4.890 4.543 5.560 0.280 10 0 "[ . 1 . 2]" 1
469 1 15 HIS H 1 15 HIS HB2 . . 3.110 2.617 2.407 2.714 . 0 0 "[ . 1 . 2]" 1
470 1 15 HIS H 1 15 HIS HB3 . . 3.010 2.512 2.411 2.680 . 0 0 "[ . 1 . 2]" 1
471 1 15 HIS H 1 16 GLY H . . 2.840 2.476 2.404 2.563 . 0 0 "[ . 1 . 2]" 1
472 1 15 HIS H 1 16 GLY HA2 . . 5.420 5.114 4.871 5.218 . 0 0 "[ . 1 . 2]" 1
473 1 15 HIS H 1 16 GLY HA3 . . 4.960 4.751 4.653 4.838 . 0 0 "[ . 1 . 2]" 1
474 1 15 HIS H 1 28 GLN QE . . 4.680 4.656 4.072 5.019 0.339 11 0 "[ . 1 . 2]" 1
475 1 15 HIS H 1 112 LEU HA . . 5.500 5.509 5.281 5.735 0.235 4 0 "[ . 1 . 2]" 1
476 1 15 HIS H 1 112 LEU QD . . 4.980 4.798 4.597 5.042 0.062 4 0 "[ . 1 . 2]" 1
477 1 15 HIS HA 1 16 GLY H . . 3.510 3.447 3.322 3.509 . 0 0 "[ . 1 . 2]" 1
478 1 15 HIS HA 1 16 GLY HA2 . . 4.820 4.838 4.758 4.940 0.120 18 0 "[ . 1 . 2]" 1
479 1 15 HIS HA 1 16 GLY HA3 . . 5.390 5.307 5.206 5.373 . 0 0 "[ . 1 . 2]" 1
480 1 15 HIS HA 1 28 GLN QE . . 4.430 3.737 3.119 4.281 . 0 0 "[ . 1 . 2]" 1
481 1 15 HIS HB2 1 16 GLY H . . 5.410 4.206 4.099 4.407 . 0 0 "[ . 1 . 2]" 1
482 1 15 HIS HB3 1 16 GLY H . . 3.540 3.224 2.998 3.641 0.101 4 0 "[ . 1 . 2]" 1
483 1 16 GLY H 1 16 GLY HA3 . . 2.750 2.301 2.286 2.318 . 0 0 "[ . 1 . 2]" 1
484 1 16 GLY H 1 17 ASN H . . 4.010 3.910 2.941 4.489 0.479 20 0 "[ . 1 . 2]" 1
485 1 16 GLY H 1 17 ASN HA . . 5.500 5.420 4.928 5.715 0.215 17 0 "[ . 1 . 2]" 1
486 1 16 GLY H 1 112 LEU HA . . 4.170 4.025 3.880 4.185 0.015 15 0 "[ . 1 . 2]" 1
487 1 16 GLY H 1 112 LEU QD . . 3.550 4.204 3.893 4.478 0.928 2 18 "[*+********** **- ***]" 1
488 1 16 GLY HA2 1 17 ASN H . . 3.410 3.154 2.744 3.549 0.139 2 0 "[ . 1 . 2]" 1
489 1 16 GLY HA2 1 17 ASN HA . . 4.710 4.543 4.324 4.732 0.022 4 0 "[ . 1 . 2]" 1
490 1 16 GLY HA2 1 17 ASN QB . . 5.140 4.549 4.443 4.659 . 0 0 "[ . 1 . 2]" 1
491 1 16 GLY HA2 1 111 ASN QB . . 4.620 3.306 2.729 5.047 0.427 16 0 "[ . 1 . 2]" 1
492 1 16 GLY HA2 1 111 ASN QD . . 5.130 4.425 2.492 5.036 . 0 0 "[ . 1 . 2]" 1
493 1 16 GLY HA2 1 112 LEU HA . . 5.500 5.321 5.063 5.669 0.169 15 0 "[ . 1 . 2]" 1
494 1 16 GLY HA3 1 17 ASN H . . 3.070 2.310 2.179 2.504 . 0 0 "[ . 1 . 2]" 1
495 1 16 GLY HA3 1 17 ASN HA . . 4.630 4.539 4.471 4.627 . 0 0 "[ . 1 . 2]" 1
496 1 16 GLY HA3 1 17 ASN QB . . 4.740 4.250 4.056 4.491 . 0 0 "[ . 1 . 2]" 1
497 1 16 GLY HA3 1 111 ASN QB . . 4.430 2.725 2.142 4.278 . 0 0 "[ . 1 . 2]" 1
498 1 16 GLY HA3 1 111 ASN QD . . 4.620 4.293 2.056 4.823 0.203 8 0 "[ . 1 . 2]" 1
499 1 16 GLY HA3 1 112 LEU HA . . 4.530 3.602 3.308 3.944 . 0 0 "[ . 1 . 2]" 1
500 1 16 GLY HA3 1 112 LEU QD . . 3.970 4.463 4.073 4.915 0.945 2 8 "[*+ . 1** *- **2]" 1
501 1 17 ASN H 1 17 ASN QB . . 2.830 2.474 2.270 2.809 . 0 0 "[ . 1 . 2]" 1
502 1 17 ASN H 1 17 ASN QD . . 4.860 4.734 4.506 5.108 0.248 2 0 "[ . 1 . 2]" 1
503 1 17 ASN H 1 18 PHE H . . 4.580 4.470 4.251 4.605 0.025 13 0 "[ . 1 . 2]" 1
504 1 17 ASN H 1 18 PHE HA . . 5.500 5.173 4.660 5.576 0.076 20 0 "[ . 1 . 2]" 1
505 1 17 ASN H 1 110 ASP H . . 4.790 3.986 3.504 4.731 . 0 0 "[ . 1 . 2]" 1
506 1 17 ASN H 1 111 ASN QB . . 4.070 3.161 2.331 4.590 0.520 17 1 "[ . 1 . + 2]" 1
507 1 17 ASN H 1 111 ASN QD . . 4.160 3.938 2.312 5.081 0.921 2 5 "[-+ *. 1 * * 2]" 1
508 1 17 ASN H 1 112 LEU HA . . 4.070 3.671 2.699 4.467 0.397 5 0 "[ . 1 . 2]" 1
509 1 17 ASN H 1 112 LEU MD1 . . 5.060 4.156 3.307 4.816 . 0 0 "[ . 1 . 2]" 1
510 1 17 ASN H 1 112 LEU QD . . 4.160 4.014 3.244 4.599 0.439 5 0 "[ . 1 . 2]" 1
511 1 17 ASN H 1 112 LEU MD2 . . 5.060 5.334 4.687 5.825 0.765 5 9 "[ * + * -**.** *]" 1
512 1 17 ASN HA 1 18 PHE H . . 2.770 2.221 2.122 2.444 . 0 0 "[ . 1 . 2]" 1
513 1 17 ASN HA 1 18 PHE HA . . 4.700 4.377 4.327 4.486 . 0 0 "[ . 1 . 2]" 1
514 1 17 ASN HA 1 18 PHE HB2 . . 5.500 5.136 4.935 5.595 0.095 9 0 "[ . 1 . 2]" 1
515 1 17 ASN HA 1 18 PHE HB3 . . 5.500 5.517 5.038 5.642 0.142 2 0 "[ . 1 . 2]" 1
516 1 17 ASN HA 1 18 PHE QD . . 4.530 3.963 3.711 4.179 . 0 0 "[ . 1 . 2]" 1
517 1 17 ASN HA 1 111 ASN QD . . 5.500 5.592 4.790 6.079 0.579 6 3 "[ .+ * 1 - 2]" 1
518 1 17 ASN HA 1 112 LEU MD1 . . 5.500 5.000 4.802 5.240 . 0 0 "[ . 1 . 2]" 1
519 1 17 ASN HA 1 112 LEU MD2 . . 5.500 5.883 5.684 6.032 0.532 5 2 "[ + 1 -. 2]" 1
520 1 17 ASN QB 1 18 PHE H . . 3.240 3.491 3.212 3.668 0.428 17 0 "[ . 1 . 2]" 1
521 1 17 ASN QB 1 19 GLY H . . 4.620 4.609 4.288 5.056 0.436 13 0 "[ . 1 . 2]" 1
522 1 17 ASN QB 1 109 CYS QB . . 4.050 3.598 2.747 4.032 . 0 0 "[ . 1 . 2]" 1
523 1 17 ASN QB 1 110 ASP H . . 2.770 1.828 1.703 2.123 . 0 0 "[ . 1 . 2]" 1
524 1 17 ASN QB 1 111 ASN QB . . 4.460 3.898 3.519 5.031 0.571 17 1 "[ . 1 . + 2]" 1
525 1 17 ASN QB 1 111 ASN QD . . 4.030 3.533 2.841 3.947 . 0 0 "[ . 1 . 2]" 1
526 1 17 ASN QB 1 112 LEU H . . 4.610 4.389 3.965 4.710 0.100 14 0 "[ . 1 . 2]" 1
527 1 17 ASN QB 1 112 LEU QD . . 4.260 4.226 3.818 4.530 0.270 5 0 "[ . 1 . 2]" 1
528 1 17 ASN QD 1 18 PHE H . . 5.200 4.125 3.275 4.435 . 0 0 "[ . 1 . 2]" 1
529 1 17 ASN QD 1 19 GLY H . . 4.560 4.003 3.444 4.566 0.006 19 0 "[ . 1 . 2]" 1
530 1 17 ASN QD 1 20 PRO HA . . 5.500 5.098 4.061 5.828 0.328 2 0 "[ . 1 . 2]" 1
531 1 17 ASN QD 1 20 PRO HD3 . . 5.500 3.250 2.255 3.843 . 0 0 "[ . 1 . 2]" 1
532 1 17 ASN QD 1 109 CYS HA . . 3.920 2.414 1.949 4.022 0.102 11 0 "[ . 1 . 2]" 1
533 1 17 ASN QD 1 109 CYS QB . . 4.550 3.819 3.418 4.738 0.188 11 0 "[ . 1 . 2]" 1
534 1 17 ASN QD 1 110 ASP H . . 4.810 2.580 1.934 4.438 . 0 0 "[ . 1 . 2]" 1
535 1 18 PHE H 1 18 PHE HB2 . . 3.380 2.985 2.860 3.500 0.120 9 0 "[ . 1 . 2]" 1
536 1 18 PHE H 1 18 PHE HB3 . . 3.860 3.646 3.229 3.773 . 0 0 "[ . 1 . 2]" 1
537 1 18 PHE H 1 18 PHE QD . . 4.090 2.554 2.268 2.889 . 0 0 "[ . 1 . 2]" 1
538 1 18 PHE H 1 18 PHE QE . . 4.360 3.936 3.831 4.162 . 0 0 "[ . 1 . 2]" 1
539 1 18 PHE H 1 19 GLY H . . 2.980 2.411 2.204 2.610 . 0 0 "[ . 1 . 2]" 1
540 1 18 PHE H 1 19 GLY QA . . 4.180 4.347 4.172 4.556 0.376 9 0 "[ . 1 . 2]" 1
541 1 18 PHE H 1 20 PRO HA . . 4.380 4.637 3.841 4.959 0.579 7 5 "[ * + 1 * . -*2]" 1
542 1 18 PHE H 1 20 PRO HB3 . . 5.500 5.464 4.583 5.849 0.349 5 0 "[ . 1 . 2]" 1
543 1 18 PHE H 1 109 CYS HA . . 4.510 4.888 4.598 5.072 0.562 14 4 "[ . *- +. *]" 1
544 1 18 PHE H 1 109 CYS QB . . 3.760 4.549 3.907 4.983 1.223 14 17 "[* ********-* +.*****]" 1
545 1 18 PHE H 1 110 ASP H . . 4.900 5.172 5.022 5.234 0.334 1 0 "[ . 1 . 2]" 1
546 1 18 PHE H 1 112 LEU QD . . 4.330 4.303 4.105 4.456 0.126 5 0 "[ . 1 . 2]" 1
547 1 18 PHE HA 1 18 PHE HB3 . . 2.930 2.339 2.285 2.370 . 0 0 "[ . 1 . 2]" 1
548 1 18 PHE HA 1 22 LEU HB2 . . 4.050 4.056 3.931 4.161 0.111 20 0 "[ . 1 . 2]" 1
549 1 18 PHE HA 1 22 LEU HB3 . . 4.870 5.055 4.938 5.161 0.291 14 0 "[ . 1 . 2]" 1
550 1 18 PHE HA 1 22 LEU QD . . 4.390 4.012 3.929 4.188 . 0 0 "[ . 1 . 2]" 1
551 1 18 PHE HA 1 22 LEU HG . . 5.500 5.715 5.506 5.823 0.323 14 0 "[ . 1 . 2]" 1
552 1 18 PHE HA 1 27 ILE HB . . 4.300 3.989 3.555 4.433 0.133 13 0 "[ . 1 . 2]" 1
553 1 18 PHE HA 1 27 ILE MD . . 4.530 3.437 3.198 3.800 . 0 0 "[ . 1 . 2]" 1
554 1 18 PHE HA 1 27 ILE HG13 . . 4.610 2.707 2.373 3.067 . 0 0 "[ . 1 . 2]" 1
555 1 18 PHE HA 1 28 GLN QE . . 4.720 4.945 4.682 5.107 0.387 10 0 "[ . 1 . 2]" 1
556 1 18 PHE HA 1 109 CYS QB . . 4.550 4.163 3.992 4.605 0.055 14 0 "[ . 1 . 2]" 1
557 1 18 PHE HA 1 112 LEU HB2 . . 5.490 4.341 4.051 4.722 . 0 0 "[ . 1 . 2]" 1
558 1 18 PHE HA 1 112 LEU MD1 . . 4.710 2.684 2.409 3.136 . 0 0 "[ . 1 . 2]" 1
559 1 18 PHE HA 1 112 LEU QD . . 3.420 2.553 2.315 2.903 . 0 0 "[ . 1 . 2]" 1
560 1 18 PHE HA 1 112 LEU MD2 . . 4.710 3.225 2.809 3.475 . 0 0 "[ . 1 . 2]" 1
561 1 18 PHE HB2 1 19 GLY H . . 3.850 2.273 2.048 2.964 . 0 0 "[ . 1 . 2]" 1
562 1 18 PHE HB2 1 22 LEU H . . 4.070 4.433 4.165 4.694 0.624 13 4 "[ * . 1 + . *-2]" 1
563 1 18 PHE HB2 1 22 LEU HB2 . . 4.080 3.591 3.024 3.865 . 0 0 "[ . 1 . 2]" 1
564 1 18 PHE HB2 1 22 LEU HB3 . . 4.880 4.920 4.270 5.146 0.266 13 0 "[ . 1 . 2]" 1
565 1 18 PHE HB2 1 27 ILE MD . . 5.290 4.801 4.352 5.213 . 0 0 "[ . 1 . 2]" 1
566 1 18 PHE HB2 1 112 LEU QD . . 5.320 4.724 4.282 5.087 . 0 0 "[ . 1 . 2]" 1
567 1 18 PHE HB3 1 19 GLY H . . 3.860 3.675 3.507 4.010 0.150 10 0 "[ . 1 . 2]" 1
568 1 18 PHE HB3 1 20 PRO HA . . 4.840 5.014 4.695 5.215 0.375 13 0 "[ . 1 . 2]" 1
569 1 18 PHE HB3 1 22 LEU HB2 . . 4.280 3.799 3.458 4.406 0.126 9 0 "[ . 1 . 2]" 1
570 1 18 PHE HB3 1 22 LEU HB3 . . 5.050 4.654 4.385 5.390 0.340 9 0 "[ . 1 . 2]" 1
571 1 18 PHE HB3 1 27 ILE MD . . 5.000 3.931 3.568 4.482 . 0 0 "[ . 1 . 2]" 1
572 1 18 PHE HB3 1 27 ILE MG . . 4.410 2.673 2.391 2.864 . 0 0 "[ . 1 . 2]" 1
573 1 18 PHE HB3 1 28 GLN QE . . 5.500 4.323 3.651 4.763 . 0 0 "[ . 1 . 2]" 1
574 1 18 PHE HB3 1 28 GLN QG . . 5.500 5.468 5.102 5.800 0.300 16 0 "[ . 1 . 2]" 1
575 1 18 PHE HB3 1 112 LEU QD . . 4.890 4.130 3.852 4.519 . 0 0 "[ . 1 . 2]" 1
576 1 18 PHE QD 1 20 PRO HA . . 4.730 3.572 1.774 4.363 . 0 0 "[ . 1 . 2]" 1
577 1 18 PHE QE 1 19 GLY H . . 4.520 4.964 3.748 5.177 0.657 13 17 "[****** * 1**+*****-*]" 1
578 1 19 GLY H 1 20 PRO HA . . 3.980 2.512 2.077 2.700 . 0 0 "[ . 1 . 2]" 1
579 1 19 GLY H 1 20 PRO HB2 . . 4.850 5.022 4.584 5.211 0.361 13 0 "[ . 1 . 2]" 1
580 1 19 GLY H 1 20 PRO HB3 . . 5.120 4.002 3.611 4.170 . 0 0 "[ . 1 . 2]" 1
581 1 19 GLY H 1 20 PRO HD2 . . 5.220 5.208 5.016 5.375 0.155 13 0 "[ . 1 . 2]" 1
582 1 19 GLY H 1 20 PRO HD3 . . 4.360 4.530 4.251 4.752 0.392 13 0 "[ . 1 . 2]" 1
583 1 19 GLY H 1 20 PRO QG . . 5.500 5.129 4.862 5.278 . 0 0 "[ . 1 . 2]" 1
584 1 19 GLY H 1 21 HIS H . . 4.870 4.576 4.447 4.692 . 0 0 "[ . 1 . 2]" 1
585 1 19 GLY H 1 22 LEU H . . 5.090 4.060 3.947 4.144 . 0 0 "[ . 1 . 2]" 1
586 1 19 GLY H 1 22 LEU HB2 . . 4.280 3.905 3.826 4.074 . 0 0 "[ . 1 . 2]" 1
587 1 19 GLY H 1 22 LEU QD . . 5.500 4.616 4.525 4.679 . 0 0 "[ . 1 . 2]" 1
588 1 19 GLY H 1 22 LEU HG . . 4.660 4.970 4.536 5.092 0.432 7 0 "[ . 1 . 2]" 1
589 1 19 GLY H 1 27 ILE HG13 . . 5.500 4.810 4.607 5.123 . 0 0 "[ . 1 . 2]" 1
590 1 19 GLY H 1 109 CYS HB2 . . 4.430 4.781 4.598 5.009 0.579 14 2 "[ . 1 +. - 2]" 1
591 1 19 GLY H 1 109 CYS QB . . 3.820 3.797 3.506 4.026 0.206 14 0 "[ . 1 . 2]" 1
592 1 19 GLY H 1 109 CYS HB3 . . 4.430 3.989 3.630 4.257 . 0 0 "[ . 1 . 2]" 1
593 1 19 GLY H 1 112 LEU QD . . 5.000 4.664 4.419 4.967 . 0 0 "[ . 1 . 2]" 1
594 1 19 GLY QA 1 20 PRO HD2 . . 4.220 4.054 3.996 4.146 . 0 0 "[ . 1 . 2]" 1
595 1 19 GLY QA 1 20 PRO HD3 . . 4.370 4.277 4.234 4.356 . 0 0 "[ . 1 . 2]" 1
596 1 19 GLY QA 1 20 PRO QG . . 4.840 4.530 4.466 4.598 . 0 0 "[ . 1 . 2]" 1
597 1 19 GLY QA 1 21 HIS H . . 4.590 2.410 2.196 2.736 . 0 0 "[ . 1 . 2]" 1
598 1 19 GLY QA 1 22 LEU H . . 4.700 1.667 1.561 1.735 . 0 0 "[ . 1 . 2]" 1
599 1 19 GLY QA 1 22 LEU QD . . 4.070 2.878 2.654 3.043 . 0 0 "[ . 1 . 2]" 1
600 1 19 GLY QA 1 108 GLN HB2 . . 5.170 4.608 4.245 5.113 . 0 0 "[ . 1 . 2]" 1
601 1 19 GLY QA 1 109 CYS H . . 4.840 3.915 3.583 4.455 . 0 0 "[ . 1 . 2]" 1
602 1 19 GLY QA 1 112 LEU QD . . 5.100 3.867 3.638 4.173 . 0 0 "[ . 1 . 2]" 1
603 1 20 PRO HA 1 22 LEU H . . 3.950 3.181 2.916 3.580 . 0 0 "[ . 1 . 2]" 1
604 1 20 PRO HA 1 22 LEU HB2 . . 4.540 4.485 4.347 4.678 0.138 12 0 "[ . 1 . 2]" 1
605 1 20 PRO HA 1 109 CYS QB . . 5.060 5.244 5.044 5.429 0.369 17 0 "[ . 1 . 2]" 1
606 1 20 PRO HB2 1 22 LEU H . . 4.570 4.977 4.806 5.107 0.537 11 3 "[ . 1+ .* -]" 1
607 1 20 PRO HB3 1 22 LEU H . . 5.500 5.359 5.147 5.580 0.080 12 0 "[ . 1 . 2]" 1
608 1 20 PRO HD2 1 21 HIS H . . 4.440 2.854 2.585 2.983 . 0 0 "[ . 1 . 2]" 1
609 1 20 PRO HD2 1 108 GLN H . . 5.500 5.862 5.483 6.116 0.616 20 5 "[ . * * -.* +]" 1
610 1 20 PRO HD2 1 108 GLN HB2 . . 4.260 2.438 2.244 2.546 . 0 0 "[ . 1 . 2]" 1
611 1 20 PRO HD2 1 108 GLN QE . . 5.210 3.181 1.774 4.619 . 0 0 "[ . 1 . 2]" 1
612 1 20 PRO HD2 1 108 GLN HG2 . . 4.720 5.022 4.797 5.134 0.414 12 0 "[ . 1 . 2]" 1
613 1 20 PRO HD2 1 108 GLN HG3 . . 4.740 4.376 4.051 4.783 0.043 20 0 "[ . 1 . 2]" 1
614 1 20 PRO HD2 1 109 CYS HA . . 5.500 5.565 4.959 5.773 0.273 13 0 "[ . 1 . 2]" 1
615 1 20 PRO HD3 1 21 HIS H . . 4.500 4.018 3.825 4.132 . 0 0 "[ . 1 . 2]" 1
616 1 20 PRO HD3 1 108 GLN HA . . 5.500 5.711 5.318 5.954 0.454 6 0 "[ . 1 . 2]" 1
617 1 20 PRO HD3 1 108 GLN HB2 . . 4.220 3.166 2.619 3.741 . 0 0 "[ . 1 . 2]" 1
618 1 20 PRO HD3 1 108 GLN QE . . 4.800 3.826 2.753 5.023 0.223 4 0 "[ . 1 . 2]" 1
619 1 20 PRO HD3 1 108 GLN HG2 . . 5.500 5.647 5.331 5.945 0.445 14 0 "[ . 1 . 2]" 1
620 1 20 PRO HD3 1 108 GLN HG3 . . 5.500 5.474 4.913 6.030 0.530 14 2 "[ . 1 +. -]" 1
621 1 20 PRO HD3 1 109 CYS H . . 5.500 5.860 5.501 6.044 0.544 6 7 "[ .+**-* . * *]" 1
622 1 20 PRO HD3 1 109 CYS HA . . 4.830 5.001 4.648 5.112 0.282 5 0 "[ . 1 . 2]" 1
623 1 20 PRO QG 1 21 HIS H . . 4.370 3.433 2.865 3.804 . 0 0 "[ . 1 . 2]" 1
624 1 20 PRO QG 1 108 GLN HB2 . . 4.770 4.253 3.955 4.410 . 0 0 "[ . 1 . 2]" 1
625 1 20 PRO QG 1 108 GLN QE . . 4.170 3.688 2.871 4.507 0.337 13 0 "[ . 1 . 2]" 1
626 1 21 HIS H 1 21 HIS HB2 . . 3.750 2.662 2.312 3.681 . 0 0 "[ . 1 . 2]" 1
627 1 21 HIS H 1 21 HIS HB3 . . 3.750 3.230 2.501 3.648 . 0 0 "[ . 1 . 2]" 1
628 1 21 HIS H 1 21 HIS HD2 . . 5.480 4.122 2.283 5.298 . 0 0 "[ . 1 . 2]" 1
629 1 21 HIS H 1 22 LEU H . . 3.180 2.559 2.447 2.812 . 0 0 "[ . 1 . 2]" 1
630 1 21 HIS H 1 22 LEU HA . . 5.440 5.219 5.078 5.439 . 0 0 "[ . 1 . 2]" 1
631 1 21 HIS H 1 22 LEU QD . . 5.470 4.285 4.101 4.562 . 0 0 "[ . 1 . 2]" 1
632 1 21 HIS H 1 22 LEU HG . . 4.170 4.005 3.770 4.396 0.226 14 0 "[ . 1 . 2]" 1
633 1 21 HIS H 1 107 LEU HB3 . . 5.420 4.247 3.699 5.415 . 0 0 "[ . 1 . 2]" 1
634 1 21 HIS H 1 107 LEU QD . . 5.380 4.784 4.295 5.655 0.275 14 0 "[ . 1 . 2]" 1
635 1 21 HIS H 1 108 GLN HB2 . . 4.940 4.137 3.686 4.608 . 0 0 "[ . 1 . 2]" 1
636 1 21 HIS HA 1 55 LEU QD . . 4.510 3.302 2.672 4.325 . 0 0 "[ . 1 . 2]" 1
637 1 21 HIS HA 1 60 VAL QG . . 5.230 4.556 3.630 5.708 0.478 16 0 "[ . 1 . 2]" 1
638 1 21 HIS QB 1 22 LEU H . . 4.080 3.383 2.981 3.917 . 0 0 "[ . 1 . 2]" 1
639 1 21 HIS QB 1 22 LEU HA . . 5.210 4.436 4.133 4.827 . 0 0 "[ . 1 . 2]" 1
640 1 21 HIS QB 1 22 LEU QD . . 3.400 3.179 2.834 3.884 0.484 12 0 "[ . 1 . 2]" 1
641 1 21 HIS QB 1 54 ALA MB . . 4.850 3.970 3.284 4.525 . 0 0 "[ . 1 . 2]" 1
642 1 21 HIS QB 1 55 LEU H . . 5.330 4.552 4.284 5.121 . 0 0 "[ . 1 . 2]" 1
643 1 21 HIS QB 1 55 LEU QD . . 5.230 4.661 3.976 5.602 0.372 4 0 "[ . 1 . 2]" 1
644 1 21 HIS QB 1 60 VAL QG . . 3.860 2.951 1.842 4.037 0.177 18 0 "[ . 1 . 2]" 1
645 1 21 HIS QB 1 107 LEU HA . . 4.490 3.187 2.177 5.209 0.719 12 3 "[ . 1 + -.* 2]" 1
646 1 21 HIS QB 1 107 LEU QD . . 3.850 3.025 2.298 4.960 1.110 12 2 "[ . 1 + .- 2]" 1
647 1 21 HIS HB2 1 22 LEU H . . 4.680 3.743 3.084 4.431 . 0 0 "[ . 1 . 2]" 1
648 1 21 HIS HB3 1 22 LEU H . . 4.680 4.031 3.299 4.365 . 0 0 "[ . 1 . 2]" 1
649 1 21 HIS HD2 1 60 VAL QG . . 4.620 3.939 2.009 5.143 0.523 5 1 "[ + 1 . 2]" 1
650 1 21 HIS HD2 1 107 LEU QD . . 3.820 3.776 1.997 4.787 0.967 4 4 "[ +. -* * . 2]" 1
651 1 22 LEU H 1 22 LEU HB2 . . 2.980 2.594 2.530 2.661 . 0 0 "[ . 1 . 2]" 1
652 1 22 LEU H 1 22 LEU QD . . 3.750 3.134 2.843 3.302 . 0 0 "[ . 1 . 2]" 1
653 1 22 LEU H 1 22 LEU HG . . 3.250 2.728 2.543 2.928 . 0 0 "[ . 1 . 2]" 1
654 1 22 LEU H 1 23 ASP H . . 4.360 4.466 4.363 4.511 0.151 19 0 "[ . 1 . 2]" 1
655 1 22 LEU H 1 54 ALA MB . . 5.470 5.095 4.787 5.735 0.265 17 0 "[ . 1 . 2]" 1
656 1 22 LEU H 1 55 LEU H . . 5.060 4.486 4.248 4.796 . 0 0 "[ . 1 . 2]" 1
657 1 22 LEU H 1 55 LEU QD . . 4.020 4.029 3.368 4.853 0.833 11 3 "[ *. 1+ .- 2]" 1
658 1 22 LEU H 1 55 LEU HG . . 5.500 4.741 4.176 6.126 0.626 5 1 "[ + 1 . 2]" 1
659 1 22 LEU H 1 107 LEU HB3 . . 5.500 4.718 4.350 6.062 0.562 14 1 "[ . 1 +. 2]" 1
660 1 22 LEU H 1 107 LEU QD . . 5.440 4.753 4.348 5.759 0.319 14 0 "[ . 1 . 2]" 1
661 1 22 LEU HA 1 22 LEU QD . . 3.170 2.167 2.089 2.236 . 0 0 "[ . 1 . 2]" 1
662 1 22 LEU HA 1 23 ASP H . . 3.240 2.231 2.140 2.283 . 0 0 "[ . 1 . 2]" 1
663 1 22 LEU HA 1 23 ASP QB . . 4.260 4.094 4.020 4.148 . 0 0 "[ . 1 . 2]" 1
664 1 22 LEU HA 1 27 ILE MD . . 4.420 4.394 4.253 4.722 0.302 14 0 "[ . 1 . 2]" 1
665 1 22 LEU HA 1 53 CYS H . . 5.500 5.971 5.586 6.140 0.640 12 13 "[ * *.****- +* .* ***]" 1
666 1 22 LEU HA 1 53 CYS HA . . 5.500 5.730 5.184 6.053 0.553 2 3 "[ + . - 1 * . 2]" 1
667 1 22 LEU HA 1 53 CYS HB2 . . 5.500 4.916 4.074 5.504 0.004 20 0 "[ . 1 . 2]" 1
668 1 22 LEU HA 1 53 CYS QB . . 4.740 4.432 3.881 4.921 0.181 20 0 "[ . 1 . 2]" 1
669 1 22 LEU HA 1 53 CYS HB3 . . 5.500 5.103 4.329 6.030 0.530 15 1 "[ . 1 + 2]" 1
670 1 22 LEU HA 1 54 ALA H . . 4.820 4.460 4.144 4.680 . 0 0 "[ . 1 . 2]" 1
671 1 22 LEU HA 1 54 ALA HA . . 3.520 1.887 1.694 2.320 . 0 0 "[ . 1 . 2]" 1
672 1 22 LEU HA 1 54 ALA MB . . 3.940 3.318 2.907 3.953 0.013 17 0 "[ . 1 . 2]" 1
673 1 22 LEU HA 1 55 LEU H . . 3.470 2.567 2.241 3.238 . 0 0 "[ . 1 . 2]" 1
674 1 22 LEU HA 1 55 LEU QD . . 3.560 3.969 2.865 4.327 0.767 11 7 "[ *. -*+* .* *]" 1
675 1 22 LEU HA 1 55 LEU HG . . 4.370 3.545 3.206 4.773 0.403 5 0 "[ . 1 . 2]" 1
676 1 22 LEU HA 1 60 VAL QG . . 5.440 4.397 3.719 4.773 . 0 0 "[ . 1 . 2]" 1
677 1 22 LEU HB2 1 27 ILE HB . . 5.500 5.197 5.076 5.410 . 0 0 "[ . 1 . 2]" 1
678 1 22 LEU HB2 1 27 ILE MD . . 4.620 2.996 2.804 3.213 . 0 0 "[ . 1 . 2]" 1
679 1 22 LEU HB2 1 27 ILE HG12 . . 4.340 3.573 3.452 3.814 . 0 0 "[ . 1 . 2]" 1
680 1 22 LEU HB2 1 27 ILE HG13 . . 4.330 2.877 2.747 3.073 . 0 0 "[ . 1 . 2]" 1
681 1 22 LEU HB3 1 23 ASP H . . 3.590 3.086 2.861 3.375 . 0 0 "[ . 1 . 2]" 1
682 1 22 LEU HB3 1 27 ILE HB . . 4.670 5.070 4.969 5.164 0.494 1 0 "[ . 1 . 2]" 1
683 1 22 LEU HB3 1 27 ILE MD . . 3.730 2.183 2.015 2.535 . 0 0 "[ . 1 . 2]" 1
684 1 22 LEU HB3 1 27 ILE HG13 . . 4.990 3.010 2.797 3.125 . 0 0 "[ . 1 . 2]" 1
685 1 22 LEU HB3 1 50 CYS HA . . 4.770 4.155 3.834 4.500 . 0 0 "[ . 1 . 2]" 1
686 1 22 LEU HB3 1 53 CYS QB . . 4.880 3.554 2.866 4.254 . 0 0 "[ . 1 . 2]" 1
687 1 22 LEU HB3 1 54 ALA HA . . 3.990 3.676 3.295 4.180 0.190 17 0 "[ . 1 . 2]" 1
688 1 22 LEU QD 1 23 ASP H . . 3.760 3.704 3.536 3.887 0.127 5 0 "[ . 1 . 2]" 1
689 1 22 LEU QD 1 27 ILE HB . . 5.500 5.253 5.126 5.412 . 0 0 "[ . 1 . 2]" 1
690 1 22 LEU QD 1 27 ILE MD . . 2.670 1.994 1.878 2.144 . 0 0 "[ . 1 . 2]" 1
691 1 22 LEU QD 1 27 ILE HG12 . . 4.540 3.783 3.551 3.938 . 0 0 "[ . 1 . 2]" 1
692 1 22 LEU QD 1 50 CYS HA . . 3.420 2.394 2.129 2.772 . 0 0 "[ . 1 . 2]" 1
693 1 22 LEU QD 1 50 CYS HB2 . . 4.410 3.390 3.246 3.629 . 0 0 "[ . 1 . 2]" 1
694 1 22 LEU QD 1 50 CYS QB . . 3.600 2.180 2.016 3.107 . 0 0 "[ . 1 . 2]" 1
695 1 22 LEU QD 1 50 CYS HB3 . . 4.410 2.234 2.036 3.753 . 0 0 "[ . 1 . 2]" 1
696 1 22 LEU QD 1 51 VAL H . . 4.950 4.179 3.889 4.494 . 0 0 "[ . 1 . 2]" 1
697 1 22 LEU QD 1 51 VAL HA . . 4.150 3.642 3.284 3.885 . 0 0 "[ . 1 . 2]" 1
698 1 22 LEU QD 1 53 CYS H . . 4.350 4.153 3.591 4.489 0.139 12 0 "[ . 1 . 2]" 1
699 1 22 LEU QD 1 53 CYS HA . . 5.420 5.062 4.545 5.361 . 0 0 "[ . 1 . 2]" 1
700 1 22 LEU QD 1 53 CYS QB . . 4.500 3.396 2.673 3.867 . 0 0 "[ . 1 . 2]" 1
701 1 22 LEU QD 1 54 ALA H . . 3.690 3.480 3.174 3.848 0.158 13 0 "[ . 1 . 2]" 1
702 1 22 LEU QD 1 54 ALA HA . . 3.240 2.331 1.998 2.571 . 0 0 "[ . 1 . 2]" 1
703 1 22 LEU QD 1 54 ALA MB . . 3.480 2.197 1.925 2.636 . 0 0 "[ . 1 . 2]" 1
704 1 22 LEU QD 1 55 LEU H . . 3.820 3.533 3.218 3.913 0.093 5 0 "[ . 1 . 2]" 1
705 1 22 LEU QD 1 55 LEU HG . . 5.120 4.877 4.565 5.830 0.710 5 1 "[ + 1 . 2]" 1
706 1 22 LEU QD 1 60 VAL QG . . 3.980 2.727 2.223 2.999 . 0 0 "[ . 1 . 2]" 1
707 1 22 LEU QD 1 107 LEU HB2 . . 5.220 3.570 3.109 4.564 . 0 0 "[ . 1 . 2]" 1
708 1 22 LEU QD 1 107 LEU MD1 . . 3.950 1.830 1.633 2.996 . 0 0 "[ . 1 . 2]" 1
709 1 22 LEU QD 1 107 LEU QD . . 3.190 1.793 1.567 2.943 . 0 0 "[ . 1 . 2]" 1
710 1 22 LEU QD 1 107 LEU MD2 . . 3.950 2.710 1.927 4.314 0.364 20 0 "[ . 1 . 2]" 1
711 1 22 LEU QD 1 109 CYS HB2 . . 4.670 3.394 2.862 3.850 . 0 0 "[ . 1 . 2]" 1
712 1 22 LEU QD 1 109 CYS QB . . 4.070 2.847 2.405 3.239 . 0 0 "[ . 1 . 2]" 1
713 1 22 LEU QD 1 109 CYS HB3 . . 4.670 3.062 2.586 3.504 . 0 0 "[ . 1 . 2]" 1
714 1 22 LEU HG 1 107 LEU MD1 . . 5.300 3.127 2.658 4.268 . 0 0 "[ . 1 . 2]" 1
715 1 22 LEU HG 1 107 LEU QD . . 3.840 3.021 2.577 4.142 0.302 14 0 "[ . 1 . 2]" 1
716 1 22 LEU HG 1 107 LEU MD2 . . 5.300 4.067 3.261 5.668 0.368 20 0 "[ . 1 . 2]" 1
717 1 23 ASP H 1 23 ASP HB2 . . 3.440 2.540 2.465 2.637 . 0 0 "[ . 1 . 2]" 1
718 1 23 ASP H 1 23 ASP QB . . 3.010 2.244 2.197 2.273 . 0 0 "[ . 1 . 2]" 1
719 1 23 ASP H 1 23 ASP HB3 . . 3.440 2.500 2.448 2.590 . 0 0 "[ . 1 . 2]" 1
720 1 23 ASP H 1 24 PRO HD3 . . 4.850 4.917 4.756 5.042 0.192 2 0 "[ . 1 . 2]" 1
721 1 23 ASP H 1 25 LYS H . . 5.480 5.698 5.513 5.945 0.465 10 0 "[ . 1 . 2]" 1
722 1 23 ASP H 1 26 ARG H . . 5.100 5.223 4.990 5.377 0.277 20 0 "[ . 1 . 2]" 1
723 1 23 ASP H 1 26 ARG QD . . 4.500 3.817 3.588 4.246 . 0 0 "[ . 1 . 2]" 1
724 1 23 ASP H 1 27 ILE H . . 5.210 5.010 4.678 5.268 0.058 16 0 "[ . 1 . 2]" 1
725 1 23 ASP H 1 27 ILE MD . . 4.480 4.455 4.058 4.750 0.270 14 0 "[ . 1 . 2]" 1
726 1 23 ASP H 1 27 ILE HG12 . . 4.750 3.871 3.469 4.103 . 0 0 "[ . 1 . 2]" 1
727 1 23 ASP H 1 53 CYS HA . . 4.670 4.561 3.940 4.847 0.177 19 0 "[ . 1 . 2]" 1
728 1 23 ASP H 1 53 CYS QB . . 4.060 3.562 2.720 4.177 0.117 12 0 "[ . 1 . 2]" 1
729 1 23 ASP H 1 54 ALA H . . 4.960 4.642 4.502 4.876 . 0 0 "[ . 1 . 2]" 1
730 1 23 ASP H 1 54 ALA HA . . 3.550 2.869 2.343 3.722 0.172 17 0 "[ . 1 . 2]" 1
731 1 23 ASP H 1 54 ALA MB . . 4.770 4.444 4.017 5.043 0.273 17 0 "[ . 1 . 2]" 1
732 1 23 ASP H 1 55 LEU H . . 4.060 3.172 2.565 3.770 . 0 0 "[ . 1 . 2]" 1
733 1 23 ASP H 1 55 LEU HA . . 5.240 4.979 4.609 5.475 0.235 11 0 "[ . 1 . 2]" 1
734 1 23 ASP H 1 55 LEU MD1 . . 4.370 4.091 2.762 4.636 0.266 19 0 "[ . 1 . 2]" 1
735 1 23 ASP H 1 55 LEU QD . . 3.830 3.459 2.743 3.734 . 0 0 "[ . 1 . 2]" 1
736 1 23 ASP H 1 55 LEU MD2 . . 4.370 3.810 3.560 4.640 0.270 5 0 "[ . 1 . 2]" 1
737 1 23 ASP H 1 55 LEU HG . . 3.880 2.996 2.676 3.730 . 0 0 "[ . 1 . 2]" 1
738 1 23 ASP HA 1 24 PRO HA . . 4.500 4.483 4.435 4.520 0.020 20 0 "[ . 1 . 2]" 1
739 1 23 ASP HA 1 24 PRO HD2 . . 3.180 2.156 1.967 2.374 . 0 0 "[ . 1 . 2]" 1
740 1 23 ASP HA 1 24 PRO HD3 . . 3.200 2.487 2.301 2.633 . 0 0 "[ . 1 . 2]" 1
741 1 23 ASP HA 1 24 PRO HG2 . . 4.320 4.356 4.169 4.518 0.198 11 0 "[ . 1 . 2]" 1
742 1 23 ASP HA 1 24 PRO HG3 . . 4.510 4.505 4.464 4.537 0.027 14 0 "[ . 1 . 2]" 1
743 1 23 ASP HA 1 25 LYS H . . 3.870 4.105 3.915 4.291 0.421 2 0 "[ . 1 . 2]" 1
744 1 23 ASP HA 1 25 LYS QD . . 3.840 4.864 4.388 5.055 1.215 14 20 [*************+*-****] 1
745 1 23 ASP HA 1 25 LYS QE . . 4.680 4.499 4.092 5.146 0.466 12 0 "[ . 1 . 2]" 1
746 1 23 ASP HA 1 26 ARG H . . 4.600 4.866 4.743 4.955 0.355 11 0 "[ . 1 . 2]" 1
747 1 23 ASP HA 1 55 LEU MD1 . . 3.890 2.683 2.142 4.071 0.181 19 0 "[ . 1 . 2]" 1
748 1 23 ASP HA 1 55 LEU QD . . 2.980 2.348 2.011 2.689 . 0 0 "[ . 1 . 2]" 1
749 1 23 ASP HA 1 55 LEU MD2 . . 3.890 2.779 2.016 3.354 . 0 0 "[ . 1 . 2]" 1
750 1 23 ASP HA 1 55 LEU HG . . 4.410 2.818 2.491 3.676 . 0 0 "[ . 1 . 2]" 1
751 1 23 ASP QB 1 24 PRO HD2 . . 4.430 3.711 3.601 3.870 . 0 0 "[ . 1 . 2]" 1
752 1 23 ASP QB 1 25 LYS H . . 4.210 3.948 3.798 4.117 . 0 0 "[ . 1 . 2]" 1
753 1 23 ASP QB 1 25 LYS QD . . 4.980 4.996 4.416 5.169 0.189 18 0 "[ . 1 . 2]" 1
754 1 23 ASP QB 1 26 ARG H . . 3.510 3.122 2.971 3.254 . 0 0 "[ . 1 . 2]" 1
755 1 23 ASP QB 1 26 ARG HA . . 4.440 4.910 4.788 5.030 0.590 20 8 "[ * . ** 1- * .* *+]" 1
756 1 23 ASP QB 1 26 ARG HB3 . . 4.810 3.845 3.624 4.020 . 0 0 "[ . 1 . 2]" 1
757 1 23 ASP QB 1 26 ARG QD . . 3.490 2.008 1.807 2.293 . 0 0 "[ . 1 . 2]" 1
758 1 23 ASP QB 1 26 ARG QG . . 4.090 2.986 2.556 3.420 . 0 0 "[ . 1 . 2]" 1
759 1 23 ASP QB 1 27 ILE H . . 3.830 3.963 3.725 4.130 0.300 19 0 "[ . 1 . 2]" 1
760 1 23 ASP QB 1 54 ALA HA . . 4.930 4.212 3.649 4.859 . 0 0 "[ . 1 . 2]" 1
761 1 23 ASP QB 1 55 LEU QD . . 3.560 2.234 1.994 2.724 . 0 0 "[ . 1 . 2]" 1
762 1 23 ASP QB 1 55 LEU HG . . 4.740 2.774 2.400 3.135 . 0 0 "[ . 1 . 2]" 1
763 1 24 PRO HA 1 26 ARG H . . 4.420 4.747 4.576 4.918 0.498 9 0 "[ . 1 . 2]" 1
764 1 24 PRO HA 1 27 ILE H . . 4.220 3.836 3.612 4.167 . 0 0 "[ . 1 . 2]" 1
765 1 24 PRO HA 1 27 ILE HB . . 3.170 2.660 2.376 2.964 . 0 0 "[ . 1 . 2]" 1
766 1 24 PRO HA 1 27 ILE HG12 . . 4.250 3.802 3.473 4.061 . 0 0 "[ . 1 . 2]" 1
767 1 24 PRO HA 1 27 ILE HG13 . . 4.240 3.563 3.327 3.827 . 0 0 "[ . 1 . 2]" 1
768 1 24 PRO HA 1 27 ILE MG . . 3.950 3.702 3.425 3.891 . 0 0 "[ . 1 . 2]" 1
769 1 24 PRO HA 1 28 GLN H . . 4.630 4.789 4.592 5.056 0.426 13 0 "[ . 1 . 2]" 1
770 1 24 PRO HA 1 28 GLN QE . . 3.850 3.752 3.228 4.385 0.535 4 1 "[ +. 1 . 2]" 1
771 1 24 PRO HA 1 28 GLN QG . . 4.150 4.281 4.106 4.389 0.239 9 0 "[ . 1 . 2]" 1
772 1 24 PRO HB2 1 25 LYS H . . 3.800 3.495 3.241 3.771 . 0 0 "[ . 1 . 2]" 1
773 1 24 PRO HB2 1 25 LYS HG2 . . 5.500 5.866 5.436 6.058 0.558 20 3 "[ -. 1* . +]" 1
774 1 24 PRO HB2 1 25 LYS HG3 . . 4.600 4.461 3.823 4.692 0.092 18 0 "[ . 1 . 2]" 1
775 1 24 PRO HB2 1 28 GLN QE . . 4.850 4.048 3.401 4.589 . 0 0 "[ . 1 . 2]" 1
776 1 24 PRO HB3 1 25 LYS H . . 4.400 4.328 4.176 4.485 0.085 20 0 "[ . 1 . 2]" 1
777 1 24 PRO HB3 1 25 LYS QD . . 5.500 4.386 4.067 4.719 . 0 0 "[ . 1 . 2]" 1
778 1 24 PRO HB3 1 27 ILE HB . . 5.100 4.883 4.607 5.240 0.140 13 0 "[ . 1 . 2]" 1
779 1 24 PRO HB3 1 27 ILE MG . . 5.500 5.245 4.907 5.554 0.054 13 0 "[ . 1 . 2]" 1
780 1 24 PRO HB3 1 28 GLN QE . . 5.090 4.564 3.981 5.227 0.137 4 0 "[ . 1 . 2]" 1
781 1 24 PRO HD2 1 25 LYS H . . 3.650 3.097 2.857 3.375 . 0 0 "[ . 1 . 2]" 1
782 1 24 PRO HD2 1 25 LYS QE . . 4.810 3.232 2.751 4.044 . 0 0 "[ . 1 . 2]" 1
783 1 24 PRO HD2 1 55 LEU MD1 . . 4.580 3.423 2.775 5.028 0.448 19 0 "[ . 1 . 2]" 1
784 1 24 PRO HD2 1 55 LEU QD . . 3.670 3.040 2.544 3.449 . 0 0 "[ . 1 . 2]" 1
785 1 24 PRO HD2 1 55 LEU MD2 . . 4.580 3.591 2.552 4.425 . 0 0 "[ . 1 . 2]" 1
786 1 24 PRO HD3 1 25 LYS H . . 4.290 4.146 4.016 4.293 0.003 9 0 "[ . 1 . 2]" 1
787 1 24 PRO HD3 1 25 LYS QD . . 4.320 4.366 4.180 4.479 0.159 19 0 "[ . 1 . 2]" 1
788 1 24 PRO HD3 1 25 LYS QE . . 5.340 4.738 4.230 5.639 0.299 12 0 "[ . 1 . 2]" 1
789 1 24 PRO HD3 1 55 LEU MD1 . . 4.180 3.326 2.756 4.753 0.573 19 1 "[ . 1 . +2]" 1
790 1 24 PRO HD3 1 55 LEU MD2 . . 4.180 4.353 2.891 5.041 0.861 4 4 "[ -+. 1 *.* 2]" 1
791 1 24 PRO HG2 1 25 LYS H . . 3.440 2.718 2.406 3.054 . 0 0 "[ . 1 . 2]" 1
792 1 24 PRO HG2 1 25 LYS HB2 . . 4.880 4.545 4.372 4.733 . 0 0 "[ . 1 . 2]" 1
793 1 24 PRO HG2 1 25 LYS HB3 . . 5.270 5.560 5.454 5.716 0.446 20 0 "[ . 1 . 2]" 1
794 1 24 PRO HG2 1 25 LYS QD . . 4.170 1.893 1.787 2.209 . 0 0 "[ . 1 . 2]" 1
795 1 24 PRO HG2 1 25 LYS HG2 . . 5.010 4.839 4.694 4.971 . 0 0 "[ . 1 . 2]" 1
796 1 24 PRO HG2 1 25 LYS HG3 . . 4.650 4.050 3.503 4.302 . 0 0 "[ . 1 . 2]" 1
797 1 24 PRO HG2 1 26 ARG H . . 5.090 5.147 4.910 5.417 0.327 20 0 "[ . 1 . 2]" 1
798 1 24 PRO HG3 1 25 LYS H . . 4.460 4.229 3.989 4.483 0.023 20 0 "[ . 1 . 2]" 1
799 1 24 PRO HG3 1 25 LYS QD . . 3.800 3.495 3.392 3.642 . 0 0 "[ . 1 . 2]" 1
800 1 25 LYS H 1 25 LYS HB2 . . 2.920 2.497 2.444 2.668 . 0 0 "[ . 1 . 2]" 1
801 1 25 LYS H 1 25 LYS HB3 . . 3.700 3.661 3.633 3.704 0.004 16 0 "[ . 1 . 2]" 1
802 1 25 LYS H 1 25 LYS QD . . 3.360 1.993 1.747 2.194 . 0 0 "[ . 1 . 2]" 1
803 1 25 LYS H 1 25 LYS QE . . 3.820 2.863 2.540 3.814 . 0 0 "[ . 1 . 2]" 1
804 1 25 LYS H 1 25 LYS HG2 . . 3.940 4.098 4.002 4.209 0.269 11 0 "[ . 1 . 2]" 1
805 1 25 LYS H 1 25 LYS HG3 . . 3.110 3.507 3.135 3.687 0.577 6 5 "[ .+ * 1 * - *]" 1
806 1 25 LYS H 1 26 ARG H . . 2.990 2.460 2.298 2.636 . 0 0 "[ . 1 . 2]" 1
807 1 25 LYS H 1 26 ARG HA . . 5.010 5.145 5.012 5.301 0.291 14 0 "[ . 1 . 2]" 1
808 1 25 LYS H 1 26 ARG QD . . 5.040 5.031 4.710 5.267 0.227 1 0 "[ . 1 . 2]" 1
809 1 25 LYS H 1 27 ILE HG12 . . 5.370 5.272 4.892 5.602 0.232 14 0 "[ . 1 . 2]" 1
810 1 25 LYS H 1 28 GLN H . . 5.000 4.810 4.682 4.942 . 0 0 "[ . 1 . 2]" 1
811 1 25 LYS H 1 28 GLN QG . . 5.500 4.567 4.305 4.854 . 0 0 "[ . 1 . 2]" 1
812 1 25 LYS HA 1 25 LYS HB3 . . 2.820 2.529 2.440 2.557 . 0 0 "[ . 1 . 2]" 1
813 1 25 LYS HA 1 25 LYS QD . . 3.830 3.304 3.130 3.585 . 0 0 "[ . 1 . 2]" 1
814 1 25 LYS HA 1 25 LYS QE . . 4.530 4.478 4.314 5.158 0.628 5 2 "[ + 1 .- 2]" 1
815 1 25 LYS HA 1 25 LYS HG2 . . 3.670 3.677 3.613 3.712 0.042 15 0 "[ . 1 . 2]" 1
816 1 25 LYS HA 1 25 LYS HG3 . . 3.000 2.474 2.427 2.574 . 0 0 "[ . 1 . 2]" 1
817 1 25 LYS HA 1 27 ILE H . . 4.900 4.407 4.321 4.625 . 0 0 "[ . 1 . 2]" 1
818 1 25 LYS HA 1 28 GLN H . . 4.210 3.515 3.363 3.788 . 0 0 "[ . 1 . 2]" 1
819 1 25 LYS HA 1 28 GLN HB2 . . 3.840 3.336 3.023 3.685 . 0 0 "[ . 1 . 2]" 1
820 1 25 LYS HA 1 28 GLN QG . . 3.970 2.738 2.464 3.203 . 0 0 "[ . 1 . 2]" 1
821 1 25 LYS HA 1 29 GLN QG . . 4.910 4.280 4.121 4.617 . 0 0 "[ . 1 . 2]" 1
822 1 25 LYS HB2 1 25 LYS QD . . 3.340 2.772 2.565 2.840 . 0 0 "[ . 1 . 2]" 1
823 1 25 LYS HB2 1 26 ARG H . . 3.390 2.597 2.485 2.708 . 0 0 "[ . 1 . 2]" 1
824 1 25 LYS HB2 1 26 ARG HA . . 4.950 4.369 4.190 4.446 . 0 0 "[ . 1 . 2]" 1
825 1 25 LYS HB2 1 26 ARG QD . . 4.790 4.675 4.494 4.792 0.002 4 0 "[ . 1 . 2]" 1
826 1 25 LYS HB2 1 27 ILE H . . 5.140 4.961 4.875 5.069 . 0 0 "[ . 1 . 2]" 1
827 1 25 LYS HB2 1 29 GLN QE . . 5.500 4.333 3.913 4.564 . 0 0 "[ . 1 . 2]" 1
828 1 25 LYS HB3 1 26 ARG H . . 4.200 3.575 3.423 3.771 . 0 0 "[ . 1 . 2]" 1
829 1 25 LYS HB3 1 26 ARG HA . . 4.970 4.396 4.263 4.571 . 0 0 "[ . 1 . 2]" 1
830 1 25 LYS HB3 1 29 GLN QE . . 4.940 2.907 2.448 3.206 . 0 0 "[ . 1 . 2]" 1
831 1 25 LYS QD 1 25 LYS HG2 . . 2.750 2.409 2.386 2.465 . 0 0 "[ . 1 . 2]" 1
832 1 25 LYS QD 1 25 LYS HG3 . . 2.510 2.195 2.189 2.201 . 0 0 "[ . 1 . 2]" 1
833 1 25 LYS QD 1 26 ARG H . . 4.440 4.087 3.645 4.211 . 0 0 "[ . 1 . 2]" 1
834 1 25 LYS QE 1 25 LYS HG2 . . 3.850 2.878 2.398 3.022 . 0 0 "[ . 1 . 2]" 1
835 1 25 LYS QE 1 25 LYS HG3 . . 3.890 3.551 3.355 3.580 . 0 0 "[ . 1 . 2]" 1
836 1 25 LYS QE 1 26 ARG QD . . 3.840 4.633 4.361 4.977 1.137 5 20 [****+***-***********] 1
837 1 25 LYS QE 1 29 GLN QE . . 5.500 5.978 5.565 6.216 0.716 5 11 "[- **+ * ** ** **2]" 1
838 1 25 LYS HG2 1 26 ARG H . . 5.490 5.096 4.985 5.207 . 0 0 "[ . 1 . 2]" 1
839 1 25 LYS HG3 1 26 ARG H . . 4.570 4.921 4.774 5.002 0.432 1 0 "[ . 1 . 2]" 1
840 1 26 ARG H 1 26 ARG HB2 . . 3.050 2.459 2.318 2.612 . 0 0 "[ . 1 . 2]" 1
841 1 26 ARG H 1 26 ARG HB3 . . 3.800 3.590 3.549 3.632 . 0 0 "[ . 1 . 2]" 1
842 1 26 ARG H 1 26 ARG QD . . 3.930 3.567 3.373 3.701 . 0 0 "[ . 1 . 2]" 1
843 1 26 ARG H 1 26 ARG QG . . 2.980 2.255 2.050 2.538 . 0 0 "[ . 1 . 2]" 1
844 1 26 ARG H 1 27 ILE H . . 3.160 2.574 2.469 2.665 . 0 0 "[ . 1 . 2]" 1
845 1 26 ARG H 1 27 ILE HB . . 4.360 4.519 4.379 4.718 0.358 20 0 "[ . 1 . 2]" 1
846 1 26 ARG H 1 27 ILE HG12 . . 4.500 4.535 4.372 4.622 0.122 15 0 "[ . 1 . 2]" 1
847 1 26 ARG H 1 28 GLN H . . 3.840 4.009 3.885 4.153 0.313 3 0 "[ . 1 . 2]" 1
848 1 26 ARG H 1 29 GLN QE . . 5.140 4.879 4.542 5.239 0.099 12 0 "[ . 1 . 2]" 1
849 1 26 ARG H 1 53 CYS QB . . 4.240 4.490 4.195 4.667 0.427 3 0 "[ . 1 . 2]" 1
850 1 26 ARG HA 1 26 ARG QD . . 4.530 4.197 4.065 4.302 . 0 0 "[ . 1 . 2]" 1
851 1 26 ARG HA 1 26 ARG QG . . 2.840 2.498 2.415 2.556 . 0 0 "[ . 1 . 2]" 1
852 1 26 ARG HA 1 28 GLN H . . 4.110 3.945 3.825 4.105 . 0 0 "[ . 1 . 2]" 1
853 1 26 ARG HA 1 29 GLN HB2 . . 3.630 2.602 2.314 3.101 . 0 0 "[ . 1 . 2]" 1
854 1 26 ARG HA 1 29 GLN QE . . 4.190 3.962 3.453 4.338 0.148 11 0 "[ . 1 . 2]" 1
855 1 26 ARG HA 1 29 GLN QG . . 3.570 2.114 1.931 2.334 . 0 0 "[ . 1 . 2]" 1
856 1 26 ARG HA 1 53 CYS QB . . 4.580 4.542 4.199 5.032 0.452 1 0 "[ . 1 . 2]" 1
857 1 26 ARG HB2 1 26 ARG QD . . 3.490 2.320 2.230 2.376 . 0 0 "[ . 1 . 2]" 1
858 1 26 ARG HB2 1 27 ILE H . . 3.780 2.735 2.603 2.832 . 0 0 "[ . 1 . 2]" 1
859 1 26 ARG HB2 1 53 CYS HA . . 3.610 3.421 2.895 3.890 0.280 9 0 "[ . 1 . 2]" 1
860 1 26 ARG HB2 1 53 CYS QB . . 4.470 2.286 2.107 2.428 . 0 0 "[ . 1 . 2]" 1
861 1 26 ARG HB3 1 26 ARG QD . . 3.450 2.728 2.481 2.952 . 0 0 "[ . 1 . 2]" 1
862 1 26 ARG HB3 1 27 ILE H . . 3.970 3.727 3.506 3.913 . 0 0 "[ . 1 . 2]" 1
863 1 26 ARG HB3 1 27 ILE HA . . 4.660 4.675 4.444 4.882 0.222 7 0 "[ . 1 . 2]" 1
864 1 26 ARG HB3 1 27 ILE MD . . 5.090 4.813 4.430 5.134 0.044 17 0 "[ . 1 . 2]" 1
865 1 26 ARG HB3 1 53 CYS HA . . 3.910 3.176 2.583 3.708 . 0 0 "[ . 1 . 2]" 1
866 1 26 ARG HB3 1 53 CYS QB . . 5.180 2.557 1.976 3.224 . 0 0 "[ . 1 . 2]" 1
867 1 26 ARG QD 1 27 ILE H . . 4.810 4.698 4.503 4.798 . 0 0 "[ . 1 . 2]" 1
868 1 26 ARG QD 1 53 CYS H . . 5.480 4.959 4.552 5.478 . 0 0 "[ . 1 . 2]" 1
869 1 26 ARG QD 1 53 CYS HA . . 3.340 2.279 1.787 2.868 . 0 0 "[ . 1 . 2]" 1
870 1 26 ARG QD 1 53 CYS HB2 . . 4.630 4.204 2.549 4.818 0.188 16 0 "[ . 1 . 2]" 1
871 1 26 ARG QD 1 53 CYS QB . . 3.980 3.021 2.463 3.453 . 0 0 "[ . 1 . 2]" 1
872 1 26 ARG QD 1 53 CYS HB3 . . 4.630 3.208 2.702 3.872 . 0 0 "[ . 1 . 2]" 1
873 1 26 ARG QD 1 54 ALA H . . 5.330 4.739 4.367 5.232 . 0 0 "[ . 1 . 2]" 1
874 1 26 ARG QG 1 27 ILE H . . 4.390 4.123 3.921 4.321 . 0 0 "[ . 1 . 2]" 1
875 1 26 ARG QG 1 29 GLN QG . . 4.420 3.488 3.254 3.731 . 0 0 "[ . 1 . 2]" 1
876 1 26 ARG QG 1 53 CYS HA . . 4.220 3.985 3.653 4.294 0.074 9 0 "[ . 1 . 2]" 1
877 1 27 ILE H 1 27 ILE HB . . 3.320 2.344 2.254 2.453 . 0 0 "[ . 1 . 2]" 1
878 1 27 ILE H 1 27 ILE MD . . 3.690 3.532 3.379 3.681 . 0 0 "[ . 1 . 2]" 1
879 1 27 ILE H 1 27 ILE HG12 . . 3.390 2.465 2.294 2.642 . 0 0 "[ . 1 . 2]" 1
880 1 27 ILE H 1 27 ILE HG13 . . 4.000 3.789 3.707 3.892 . 0 0 "[ . 1 . 2]" 1
881 1 27 ILE H 1 27 ILE MG . . 3.780 3.758 3.712 3.808 0.028 20 0 "[ . 1 . 2]" 1
882 1 27 ILE H 1 28 GLN H . . 3.210 2.734 2.655 2.877 . 0 0 "[ . 1 . 2]" 1
883 1 27 ILE H 1 28 GLN HA . . 5.490 5.382 5.312 5.497 0.007 8 0 "[ . 1 . 2]" 1
884 1 27 ILE H 1 28 GLN HB2 . . 5.230 5.172 4.944 5.325 0.095 9 0 "[ . 1 . 2]" 1
885 1 27 ILE H 1 28 GLN QG . . 4.670 4.176 3.956 4.391 . 0 0 "[ . 1 . 2]" 1
886 1 27 ILE H 1 29 GLN H . . 4.160 3.981 3.867 4.204 0.044 8 0 "[ . 1 . 2]" 1
887 1 27 ILE H 1 29 GLN QG . . 5.500 4.584 4.443 4.749 . 0 0 "[ . 1 . 2]" 1
888 1 27 ILE H 1 30 LEU QD . . 4.170 4.054 3.816 4.273 0.103 14 0 "[ . 1 . 2]" 1
889 1 27 ILE H 1 53 CYS QB . . 4.450 3.662 3.337 3.967 . 0 0 "[ . 1 . 2]" 1
890 1 27 ILE HA 1 27 ILE MD . . 3.160 1.974 1.918 2.025 . 0 0 "[ . 1 . 2]" 1
891 1 27 ILE HA 1 27 ILE HG12 . . 3.790 2.933 2.832 3.004 . 0 0 "[ . 1 . 2]" 1
892 1 27 ILE HA 1 27 ILE HG13 . . 3.850 3.707 3.683 3.725 . 0 0 "[ . 1 . 2]" 1
893 1 27 ILE HA 1 27 ILE MG . . 3.250 2.674 2.594 2.759 . 0 0 "[ . 1 . 2]" 1
894 1 27 ILE HA 1 29 GLN H . . 3.890 4.049 3.820 4.286 0.396 9 0 "[ . 1 . 2]" 1
895 1 27 ILE HA 1 29 GLN HB2 . . 5.280 5.398 5.150 5.632 0.352 9 0 "[ . 1 . 2]" 1
896 1 27 ILE HA 1 30 LEU H . . 3.960 3.830 3.677 4.141 0.181 8 0 "[ . 1 . 2]" 1
897 1 27 ILE HA 1 30 LEU QB . . 5.500 4.378 4.035 4.859 . 0 0 "[ . 1 . 2]" 1
898 1 27 ILE HA 1 30 LEU QD . . 3.330 2.055 1.792 2.332 . 0 0 "[ . 1 . 2]" 1
899 1 27 ILE HA 1 30 LEU HG . . 3.650 2.553 2.044 3.374 . 0 0 "[ . 1 . 2]" 1
900 1 27 ILE HA 1 53 CYS QB . . 4.290 3.867 3.392 4.264 . 0 0 "[ . 1 . 2]" 1
901 1 27 ILE HA 1 112 LEU QD . . 4.980 3.956 3.725 4.176 . 0 0 "[ . 1 . 2]" 1
902 1 27 ILE HB 1 27 ILE MD . . 3.430 3.281 3.272 3.294 . 0 0 "[ . 1 . 2]" 1
903 1 27 ILE HB 1 28 GLN H . . 3.160 3.060 2.976 3.262 0.102 10 0 "[ . 1 . 2]" 1
904 1 27 ILE HB 1 28 GLN HB2 . . 5.500 5.451 5.174 5.761 0.261 10 0 "[ . 1 . 2]" 1
905 1 27 ILE HB 1 28 GLN QG . . 4.320 3.612 3.437 3.786 . 0 0 "[ . 1 . 2]" 1
906 1 27 ILE HB 1 30 LEU QD . . 4.720 4.324 4.260 4.417 . 0 0 "[ . 1 . 2]" 1
907 1 27 ILE MD 1 27 ILE MG . . 2.950 2.142 2.102 2.208 . 0 0 "[ . 1 . 2]" 1
908 1 27 ILE MD 1 28 GLN H . . 4.900 4.836 4.796 4.881 . 0 0 "[ . 1 . 2]" 1
909 1 27 ILE MD 1 28 GLN HA . . 5.500 5.814 5.717 5.876 0.376 12 0 "[ . 1 . 2]" 1
910 1 27 ILE MD 1 28 GLN QE . . 5.500 5.444 5.174 5.801 0.301 18 0 "[ . 1 . 2]" 1
911 1 27 ILE MD 1 29 GLN H . . 5.480 5.499 5.313 5.665 0.185 9 0 "[ . 1 . 2]" 1
912 1 27 ILE MD 1 30 LEU H . . 5.210 5.097 4.992 5.269 0.059 16 0 "[ . 1 . 2]" 1
913 1 27 ILE MD 1 30 LEU QD . . 3.940 1.917 1.763 2.170 . 0 0 "[ . 1 . 2]" 1
914 1 27 ILE MD 1 30 LEU HG . . 4.510 3.705 3.250 4.169 . 0 0 "[ . 1 . 2]" 1
915 1 27 ILE MD 1 49 ALA MB . . 4.560 4.238 3.955 4.404 . 0 0 "[ . 1 . 2]" 1
916 1 27 ILE MD 1 50 CYS HA . . 4.000 3.231 2.944 3.493 . 0 0 "[ . 1 . 2]" 1
917 1 27 ILE MD 1 50 CYS HB2 . . 5.340 5.372 4.489 5.798 0.458 20 0 "[ . 1 . 2]" 1
918 1 27 ILE MD 1 50 CYS QB . . 4.690 4.270 3.678 4.707 0.017 20 0 "[ . 1 . 2]" 1
919 1 27 ILE MD 1 50 CYS HB3 . . 5.340 4.522 3.803 5.546 0.206 18 0 "[ . 1 . 2]" 1
920 1 27 ILE MD 1 53 CYS H . . 4.600 5.001 4.572 5.132 0.532 8 5 "[ .- +*1 * . *]" 1
921 1 27 ILE MD 1 53 CYS HA . . 5.050 5.298 4.915 5.497 0.447 9 0 "[ . 1 . 2]" 1
922 1 27 ILE MD 1 53 CYS HB2 . . 3.740 3.120 2.669 3.612 . 0 0 "[ . 1 . 2]" 1
923 1 27 ILE MD 1 53 CYS QB . . 3.180 2.872 2.501 3.291 0.111 11 0 "[ . 1 . 2]" 1
924 1 27 ILE MD 1 53 CYS HB3 . . 3.740 3.362 2.950 3.793 0.053 11 0 "[ . 1 . 2]" 1
925 1 27 ILE MD 1 54 ALA H . . 5.290 5.642 5.397 5.796 0.506 1 2 "[+ . 1- . 2]" 1
926 1 27 ILE MD 1 112 LEU MD1 . . 3.960 2.478 2.251 2.730 . 0 0 "[ . 1 . 2]" 1
927 1 27 ILE MD 1 112 LEU QD . . 3.120 2.043 1.881 2.255 . 0 0 "[ . 1 . 2]" 1
928 1 27 ILE MD 1 112 LEU MD2 . . 3.960 2.193 1.971 2.476 . 0 0 "[ . 1 . 2]" 1
929 1 27 ILE MD 1 112 LEU HG . . 5.130 3.992 3.730 4.237 . 0 0 "[ . 1 . 2]" 1
930 1 27 ILE HG12 1 27 ILE MG . . 3.310 3.256 3.248 3.265 . 0 0 "[ . 1 . 2]" 1
931 1 27 ILE HG12 1 28 GLN H . . 4.740 4.711 4.594 4.876 0.136 10 0 "[ . 1 . 2]" 1
932 1 27 ILE HG12 1 28 GLN QG . . 5.500 5.728 5.604 5.838 0.338 10 0 "[ . 1 . 2]" 1
933 1 27 ILE HG12 1 53 CYS HA . . 5.500 5.748 5.196 6.077 0.577 20 2 "[ . -1 . +]" 1
934 1 27 ILE HG13 1 27 ILE MG . . 3.150 2.389 2.356 2.412 . 0 0 "[ . 1 . 2]" 1
935 1 27 ILE HG13 1 53 CYS QB . . 5.340 4.634 3.994 5.051 . 0 0 "[ . 1 . 2]" 1
936 1 27 ILE MG 1 28 GLN H . . 3.570 3.450 3.337 3.552 . 0 0 "[ . 1 . 2]" 1
937 1 27 ILE MG 1 28 GLN HA . . 3.430 3.547 3.478 3.602 0.172 12 0 "[ . 1 . 2]" 1
938 1 27 ILE MG 1 28 GLN QE . . 3.640 2.820 2.545 3.138 . 0 0 "[ . 1 . 2]" 1
939 1 27 ILE MG 1 28 GLN QG . . 4.290 3.636 3.481 3.734 . 0 0 "[ . 1 . 2]" 1
940 1 27 ILE MG 1 29 GLN H . . 4.570 4.915 4.793 5.019 0.449 6 0 "[ . 1 . 2]" 1
941 1 27 ILE MG 1 30 LEU H . . 5.140 5.166 4.692 5.438 0.298 8 0 "[ . 1 . 2]" 1
942 1 27 ILE MG 1 30 LEU QD . . 3.040 2.876 2.681 3.104 0.064 8 0 "[ . 1 . 2]" 1
943 1 27 ILE MG 1 30 LEU HG . . 4.490 4.033 3.530 4.240 . 0 0 "[ . 1 . 2]" 1
944 1 27 ILE MG 1 49 ALA MB . . 5.500 5.925 5.591 6.101 0.601 1 8 "[+ **.* 1* * *- 2]" 1
945 1 27 ILE MG 1 112 LEU HA . . 5.500 4.744 4.581 4.924 . 0 0 "[ . 1 . 2]" 1
946 1 27 ILE MG 1 112 LEU MD1 . . 4.390 1.966 1.840 2.124 . 0 0 "[ . 1 . 2]" 1
947 1 27 ILE MG 1 112 LEU QD . . 3.080 1.949 1.825 2.107 . 0 0 "[ . 1 . 2]" 1
948 1 27 ILE MG 1 112 LEU MD2 . . 4.390 3.224 3.016 3.482 . 0 0 "[ . 1 . 2]" 1
949 1 28 GLN H 1 28 GLN HB2 . . 3.010 2.641 2.509 2.737 . 0 0 "[ . 1 . 2]" 1
950 1 28 GLN H 1 28 GLN HB3 . . 3.780 3.669 3.628 3.695 . 0 0 "[ . 1 . 2]" 1
951 1 28 GLN H 1 28 GLN QE . . 4.050 3.727 3.476 4.125 0.075 20 0 "[ . 1 . 2]" 1
952 1 28 GLN H 1 28 GLN QG . . 3.230 2.210 2.069 2.396 . 0 0 "[ . 1 . 2]" 1
953 1 28 GLN H 1 29 GLN H . . 3.040 2.429 2.360 2.480 . 0 0 "[ . 1 . 2]" 1
954 1 28 GLN H 1 29 GLN HA . . 5.120 5.040 4.961 5.118 . 0 0 "[ . 1 . 2]" 1
955 1 28 GLN H 1 29 GLN HB2 . . 4.740 4.792 4.668 4.935 0.195 3 0 "[ . 1 . 2]" 1
956 1 28 GLN H 1 29 GLN QG . . 3.680 3.705 3.495 3.878 0.198 15 0 "[ . 1 . 2]" 1
957 1 28 GLN H 1 30 LEU HG . . 4.870 4.475 4.357 4.886 0.016 10 0 "[ . 1 . 2]" 1
958 1 28 GLN HA 1 28 GLN QE . . 4.760 3.787 3.668 3.872 . 0 0 "[ . 1 . 2]" 1
959 1 28 GLN HA 1 28 GLN QG . . 3.540 3.104 2.961 3.178 . 0 0 "[ . 1 . 2]" 1
960 1 28 GLN HA 1 29 GLN H . . 3.570 3.476 3.423 3.526 . 0 0 "[ . 1 . 2]" 1
961 1 28 GLN HA 1 29 GLN HA . . 4.800 4.795 4.727 4.848 0.048 6 0 "[ . 1 . 2]" 1
962 1 28 GLN HA 1 29 GLN QG . . 5.210 5.240 5.138 5.379 0.169 14 0 "[ . 1 . 2]" 1
963 1 28 GLN HA 1 30 LEU QD . . 4.740 4.267 4.025 4.704 . 0 0 "[ . 1 . 2]" 1
964 1 28 GLN HA 1 30 LEU HG . . 4.600 4.562 4.243 4.747 0.147 1 0 "[ . 1 . 2]" 1
965 1 28 GLN HB2 1 28 GLN QE . . 4.370 4.306 4.277 4.347 . 0 0 "[ . 1 . 2]" 1
966 1 28 GLN HB2 1 29 GLN H . . 4.020 3.165 2.876 3.372 . 0 0 "[ . 1 . 2]" 1
967 1 28 GLN HB2 1 29 GLN HA . . 4.580 4.261 3.986 4.501 . 0 0 "[ . 1 . 2]" 1
968 1 28 GLN HB3 1 28 GLN QE . . 3.980 4.117 4.079 4.143 0.163 14 0 "[ . 1 . 2]" 1
969 1 28 GLN HB3 1 29 GLN H . . 4.360 4.181 4.039 4.349 . 0 0 "[ . 1 . 2]" 1
970 1 28 GLN QE 1 112 LEU QD . . 5.350 4.687 4.439 4.899 . 0 0 "[ . 1 . 2]" 1
971 1 28 GLN QG 1 29 GLN H . . 4.430 4.134 3.878 4.315 . 0 0 "[ . 1 . 2]" 1
972 1 29 GLN H 1 29 GLN HB2 . . 2.910 2.596 2.504 2.678 . 0 0 "[ . 1 . 2]" 1
973 1 29 GLN H 1 29 GLN HB3 . . 3.910 3.673 3.646 3.704 . 0 0 "[ . 1 . 2]" 1
974 1 29 GLN H 1 29 GLN QE . . 4.730 3.881 3.572 4.117 . 0 0 "[ . 1 . 2]" 1
975 1 29 GLN H 1 29 GLN QG . . 2.950 2.338 2.154 2.468 . 0 0 "[ . 1 . 2]" 1
976 1 29 GLN H 1 30 LEU H . . 2.900 2.500 2.408 2.620 . 0 0 "[ . 1 . 2]" 1
977 1 29 GLN H 1 30 LEU QB . . 5.430 4.918 4.687 5.045 . 0 0 "[ . 1 . 2]" 1
978 1 29 GLN H 1 30 LEU QD . . 3.510 4.042 3.260 4.246 0.736 6 15 "[****.+* *1-* ***** *]" 1
979 1 29 GLN H 1 30 LEU HG . . 3.540 3.645 3.514 3.783 0.243 10 0 "[ . 1 . 2]" 1
980 1 29 GLN HA 1 29 GLN HB3 . . 2.960 2.461 2.421 2.509 . 0 0 "[ . 1 . 2]" 1
981 1 29 GLN HA 1 29 GLN QE . . 4.460 3.771 3.659 3.947 . 0 0 "[ . 1 . 2]" 1
982 1 29 GLN HA 1 29 GLN QG . . 2.950 3.090 2.986 3.187 0.237 5 0 "[ . 1 . 2]" 1
983 1 29 GLN HA 1 30 LEU HG . . 5.010 5.330 5.235 5.518 0.508 19 1 "[ . 1 . +2]" 1
984 1 29 GLN HB2 1 30 LEU H . . 3.140 2.904 2.565 3.507 0.367 5 0 "[ . 1 . 2]" 1
985 1 29 GLN HB3 1 30 LEU H . . 3.680 3.935 3.699 4.361 0.681 5 2 "[ + 1 . -2]" 1
986 1 29 GLN HB3 1 30 LEU HG . . 5.500 5.787 5.516 6.070 0.570 19 3 "[ - * . +2]" 1
987 1 29 GLN QG 1 30 LEU H . . 5.500 4.136 3.950 4.352 . 0 0 "[ . 1 . 2]" 1
988 1 30 LEU H 1 30 LEU QB . . 3.570 2.759 2.588 2.840 . 0 0 "[ . 1 . 2]" 1
989 1 30 LEU H 1 30 LEU QD . . 3.090 2.819 2.091 2.963 . 0 0 "[ . 1 . 2]" 1
990 1 30 LEU H 1 30 LEU HG . . 2.830 1.954 1.864 2.226 . 0 0 "[ . 1 . 2]" 1
991 1 30 LEU H 1 31 PRO HD2 . . 4.790 4.949 4.853 5.150 0.360 2 0 "[ . 1 . 2]" 1
992 1 30 LEU H 1 31 PRO HD3 . . 5.220 5.299 4.948 5.400 0.180 9 0 "[ . 1 . 2]" 1
993 1 30 LEU HA 1 30 LEU QD . . 3.640 3.376 2.245 3.537 . 0 0 "[ . 1 . 2]" 1
994 1 30 LEU HA 1 31 PRO HD2 . . 3.170 2.691 2.502 2.994 . 0 0 "[ . 1 . 2]" 1
995 1 30 LEU HA 1 31 PRO HD3 . . 3.060 2.584 2.184 2.742 . 0 0 "[ . 1 . 2]" 1
996 1 30 LEU HA 1 31 PRO QG . . 4.810 4.256 4.043 4.428 . 0 0 "[ . 1 . 2]" 1
997 1 30 LEU QB 1 31 PRO HD2 . . 3.910 2.026 1.837 2.254 . 0 0 "[ . 1 . 2]" 1
998 1 30 LEU QB 1 31 PRO HD3 . . 3.730 3.314 3.021 3.470 . 0 0 "[ . 1 . 2]" 1
999 1 30 LEU QD 1 31 PRO HA . . 5.500 4.605 4.312 5.496 . 0 0 "[ . 1 . 2]" 1
1000 1 30 LEU QD 1 31 PRO HD2 . . 3.450 3.365 2.997 3.525 0.075 10 0 "[ . 1 . 2]" 1
1001 1 30 LEU QD 1 31 PRO QG . . 5.420 4.024 3.755 4.609 . 0 0 "[ . 1 . 2]" 1
1002 1 30 LEU QD 1 49 ALA MB . . 3.650 1.984 1.788 2.208 . 0 0 "[ . 1 . 2]" 1
1003 1 31 PRO HA 1 32 ASP H . . 2.940 2.288 2.159 2.381 . 0 0 "[ . 1 . 2]" 1
1004 1 31 PRO HA 1 32 ASP HB2 . . 4.300 4.364 4.202 4.637 0.337 5 0 "[ . 1 . 2]" 1
1005 1 31 PRO HB2 1 32 ASP H . . 3.060 2.885 2.523 3.608 0.548 18 1 "[ . 1 . + 2]" 1
1006 1 31 PRO HB2 1 32 ASP HA . . 4.540 4.814 4.671 4.945 0.405 17 0 "[ . 1 . 2]" 1
1007 1 31 PRO HB2 1 33 HIS H . . 3.150 2.439 2.228 3.023 . 0 0 "[ . 1 . 2]" 1
1008 1 31 PRO HB2 1 34 PHE HA . . 5.270 4.794 4.289 5.185 . 0 0 "[ . 1 . 2]" 1
1009 1 31 PRO HB3 1 32 ASP H . . 3.510 3.405 2.872 3.626 0.116 5 0 "[ . 1 . 2]" 1
1010 1 31 PRO HB3 1 33 HIS H . . 4.100 3.915 2.723 4.189 0.089 17 0 "[ . 1 . 2]" 1
1011 1 31 PRO HD2 1 33 HIS H . . 5.300 5.674 5.199 6.012 0.712 3 5 "[ + . *1 * - *]" 1
1012 1 31 PRO HD2 1 49 ALA MB . . 4.530 4.206 3.682 4.787 0.257 10 0 "[ . 1 . 2]" 1
1013 1 31 PRO HD3 1 49 ALA MB . . 5.500 5.416 5.006 5.867 0.367 10 0 "[ . 1 . 2]" 1
1014 1 31 PRO QG 1 32 ASP H . . 4.600 4.305 4.075 4.575 . 0 0 "[ . 1 . 2]" 1
1015 1 31 PRO QG 1 33 HIS H . . 3.660 3.719 3.244 4.482 0.822 18 2 "[ - . 1 . + 2]" 1
1016 1 31 PRO QG 1 34 PHE HA . . 5.130 4.343 3.698 4.818 . 0 0 "[ . 1 . 2]" 1
1017 1 32 ASP H 1 32 ASP HB2 . . 3.140 2.580 2.467 2.708 . 0 0 "[ . 1 . 2]" 1
1018 1 32 ASP H 1 32 ASP HB3 . . 3.070 2.454 2.216 2.575 . 0 0 "[ . 1 . 2]" 1
1019 1 32 ASP H 1 33 HIS H . . 2.850 2.546 2.263 2.681 . 0 0 "[ . 1 . 2]" 1
1020 1 32 ASP H 1 33 HIS HA . . 5.420 5.197 4.984 5.298 . 0 0 "[ . 1 . 2]" 1
1021 1 32 ASP HA 1 33 HIS H . . 3.210 3.387 3.291 3.468 0.258 5 0 "[ . 1 . 2]" 1
1022 1 32 ASP HB2 1 33 HIS H . . 4.760 4.275 4.118 4.343 . 0 0 "[ . 1 . 2]" 1
1023 1 32 ASP HB3 1 33 HIS H . . 4.100 3.354 3.076 3.599 . 0 0 "[ . 1 . 2]" 1
1024 1 33 HIS H 1 33 HIS HB3 . . 3.730 3.542 3.406 3.728 . 0 0 "[ . 1 . 2]" 1
1025 1 33 HIS H 1 34 PHE H . . 4.190 4.263 4.141 4.328 0.138 19 0 "[ . 1 . 2]" 1
1026 1 33 HIS H 1 34 PHE HA . . 4.670 4.786 4.730 4.861 0.191 7 0 "[ . 1 . 2]" 1
1027 1 33 HIS H 1 34 PHE QB . . 5.500 5.620 5.497 5.699 0.199 5 0 "[ . 1 . 2]" 1
1028 1 33 HIS HA 1 34 PHE H . . 3.290 2.240 2.149 2.316 . 0 0 "[ . 1 . 2]" 1
1029 1 33 HIS HA 1 34 PHE HA . . 4.590 4.489 4.465 4.520 . 0 0 "[ . 1 . 2]" 1
1030 1 33 HIS HB2 1 34 PHE H . . 3.760 2.815 2.574 3.104 . 0 0 "[ . 1 . 2]" 1
1031 1 33 HIS HB2 1 34 PHE HA . . 4.880 4.468 4.321 4.719 . 0 0 "[ . 1 . 2]" 1
1032 1 33 HIS HB3 1 34 PHE H . . 4.470 3.929 3.682 4.112 . 0 0 "[ . 1 . 2]" 1
1033 1 34 PHE H 1 34 PHE QB . . 3.660 2.526 2.369 2.649 . 0 0 "[ . 1 . 2]" 1
1034 1 34 PHE H 1 34 PHE HD2 . . 4.650 3.750 3.563 3.913 . 0 0 "[ . 1 . 2]" 1
1035 1 34 PHE H 1 35 GLY H . . 4.600 4.131 3.926 4.484 . 0 0 "[ . 1 . 2]" 1
1036 1 34 PHE H 1 35 GLY HA3 . . 5.500 4.823 4.596 5.136 . 0 0 "[ . 1 . 2]" 1
1037 1 34 PHE H 1 46 ILE MD . . 4.940 4.044 3.549 4.509 . 0 0 "[ . 1 . 2]" 1
1038 1 34 PHE HA 1 35 GLY H . . 3.300 2.206 2.139 2.373 . 0 0 "[ . 1 . 2]" 1
1039 1 34 PHE HA 1 35 GLY HA2 . . 4.670 4.401 4.315 4.567 . 0 0 "[ . 1 . 2]" 1
1040 1 34 PHE HA 1 35 GLY HA3 . . 4.630 4.489 4.457 4.582 . 0 0 "[ . 1 . 2]" 1
1041 1 34 PHE HA 1 42 VAL QG . . 5.140 3.928 3.705 4.130 . 0 0 "[ . 1 . 2]" 1
1042 1 34 PHE HA 1 45 ARG QB . . 5.500 4.903 4.362 5.314 . 0 0 "[ . 1 . 2]" 1
1043 1 34 PHE HA 1 45 ARG QG . . 5.500 5.194 4.371 5.947 0.447 1 0 "[ . 1 . 2]" 1
1044 1 34 PHE HA 1 46 ILE MD . . 5.310 5.165 4.746 5.533 0.223 8 0 "[ . 1 . 2]" 1
1045 1 34 PHE QB 1 35 GLY H . . 4.280 3.453 2.538 3.698 . 0 0 "[ . 1 . 2]" 1
1046 1 34 PHE QB 1 42 VAL HA . . 4.370 2.948 2.712 3.264 . 0 0 "[ . 1 . 2]" 1
1047 1 34 PHE QB 1 42 VAL MG1 . . 4.630 2.207 2.010 2.523 . 0 0 "[ . 1 . 2]" 1
1048 1 34 PHE QB 1 42 VAL QG . . 3.480 2.170 1.991 2.477 . 0 0 "[ . 1 . 2]" 1
1049 1 34 PHE QB 1 42 VAL MG2 . . 4.630 3.241 2.845 3.615 . 0 0 "[ . 1 . 2]" 1
1050 1 34 PHE QB 1 46 ILE MD . . 3.580 2.641 2.143 3.008 . 0 0 "[ . 1 . 2]" 1
1051 1 34 PHE HD2 1 42 VAL HA . . 5.500 5.628 5.330 6.060 0.560 16 2 "[ - . 1 .+ 2]" 1
1052 1 34 PHE HD2 1 45 ARG QB . . 4.440 3.786 3.466 4.155 . 0 0 "[ . 1 . 2]" 1
1053 1 34 PHE HD2 1 46 ILE HA . . 4.320 3.708 3.213 4.170 . 0 0 "[ . 1 . 2]" 1
1054 1 34 PHE HD2 1 46 ILE MD . . 3.710 1.860 1.716 1.983 . 0 0 "[ . 1 . 2]" 1
1055 1 34 PHE HD2 1 46 ILE HG12 . . 4.720 3.602 3.341 3.887 . 0 0 "[ . 1 . 2]" 1
1056 1 34 PHE HD2 1 46 ILE HG13 . . 5.270 4.474 4.304 4.660 . 0 0 "[ . 1 . 2]" 1
1057 1 34 PHE HD2 1 46 ILE MG . . 4.560 4.434 3.919 4.724 0.164 8 0 "[ . 1 . 2]" 1
1058 1 35 GLY H 1 36 PRO HA . . 4.990 4.865 4.753 5.025 0.035 18 0 "[ . 1 . 2]" 1
1059 1 35 GLY H 1 36 PRO QD . . 5.440 4.791 4.558 5.158 . 0 0 "[ . 1 . 2]" 1
1060 1 35 GLY H 1 37 GLY H . . 5.500 5.376 5.073 5.692 0.192 5 0 "[ . 1 . 2]" 1
1061 1 35 GLY H 1 42 VAL MG1 . . 5.090 4.315 3.492 4.806 . 0 0 "[ . 1 . 2]" 1
1062 1 35 GLY H 1 42 VAL MG2 . . 5.090 3.942 3.156 4.388 . 0 0 "[ . 1 . 2]" 1
1063 1 35 GLY HA2 1 36 PRO HA . . 3.360 2.766 2.534 3.017 . 0 0 "[ . 1 . 2]" 1
1064 1 35 GLY HA2 1 36 PRO HB2 . . 4.970 4.928 4.757 5.049 0.079 2 0 "[ . 1 . 2]" 1
1065 1 35 GLY HA2 1 36 PRO HB3 . . 5.260 4.893 4.694 5.058 . 0 0 "[ . 1 . 2]" 1
1066 1 35 GLY HA2 1 37 GLY H . . 3.630 2.909 2.681 3.285 . 0 0 "[ . 1 . 2]" 1
1067 1 35 GLY HA2 1 37 GLY QA . . 4.620 3.252 3.064 3.451 . 0 0 "[ . 1 . 2]" 1
1068 1 35 GLY HA2 1 42 VAL MG1 . . 4.430 4.007 3.707 4.425 . 0 0 "[ . 1 . 2]" 1
1069 1 35 GLY HA2 1 42 VAL QG . . 3.530 2.807 2.635 3.109 . 0 0 "[ . 1 . 2]" 1
1070 1 35 GLY HA2 1 42 VAL MG2 . . 4.430 2.869 2.696 3.179 . 0 0 "[ . 1 . 2]" 1
1071 1 35 GLY HA3 1 36 PRO HA . . 3.670 2.371 2.169 2.573 . 0 0 "[ . 1 . 2]" 1
1072 1 35 GLY HA3 1 36 PRO HB3 . . 5.150 4.418 4.272 4.664 . 0 0 "[ . 1 . 2]" 1
1073 1 35 GLY HA3 1 37 GLY H . . 3.620 3.321 3.002 3.726 0.106 3 0 "[ . 1 . 2]" 1
1074 1 35 GLY HA3 1 37 GLY QA . . 5.200 4.516 4.237 4.824 . 0 0 "[ . 1 . 2]" 1
1075 1 35 GLY HA3 1 42 VAL MG1 . . 4.190 3.506 3.158 4.004 . 0 0 "[ . 1 . 2]" 1
1076 1 35 GLY HA3 1 42 VAL QG . . 3.470 2.962 2.585 3.338 . 0 0 "[ . 1 . 2]" 1
1077 1 35 GLY HA3 1 42 VAL MG2 . . 4.190 3.207 2.730 3.603 . 0 0 "[ . 1 . 2]" 1
1078 1 36 PRO HA 1 37 GLY H . . 3.260 2.143 2.120 2.197 . 0 0 "[ . 1 . 2]" 1
1079 1 36 PRO HA 1 37 GLY QA . . 4.800 3.941 3.921 3.959 . 0 0 "[ . 1 . 2]" 1
1080 1 36 PRO HA 1 42 VAL QG . . 3.940 3.672 3.408 4.039 0.099 1 0 "[ . 1 . 2]" 1
1081 1 36 PRO HB2 1 37 GLY H . . 3.600 3.539 3.327 3.720 0.120 15 0 "[ . 1 . 2]" 1
1082 1 36 PRO HB2 1 42 VAL QG . . 5.440 5.413 5.119 5.729 0.289 1 0 "[ . 1 . 2]" 1
1083 1 36 PRO HB3 1 37 GLY H . . 4.130 3.926 3.678 4.038 . 0 0 "[ . 1 . 2]" 1
1084 1 36 PRO QD 1 37 GLY H . . 5.170 4.951 4.821 5.013 . 0 0 "[ . 1 . 2]" 1
1085 1 36 PRO HG2 1 37 GLY QA . . 5.180 5.059 4.699 5.745 0.565 15 3 "[ *. 1 + - 2]" 1
1086 1 37 GLY H 1 38 PRO HD2 . . 4.630 4.828 4.591 5.035 0.405 3 0 "[ . 1 . 2]" 1
1087 1 37 GLY H 1 38 PRO HD3 . . 5.170 4.873 4.602 5.185 0.015 19 0 "[ . 1 . 2]" 1
1088 1 37 GLY H 1 42 VAL HB . . 5.150 5.184 4.913 5.601 0.451 1 0 "[ . 1 . 2]" 1
1089 1 37 GLY H 1 42 VAL MG1 . . 4.260 4.408 4.046 4.756 0.496 1 0 "[ . 1 . 2]" 1
1090 1 37 GLY H 1 42 VAL QG . . 3.080 2.656 2.362 2.971 . 0 0 "[ . 1 . 2]" 1
1091 1 37 GLY H 1 42 VAL MG2 . . 4.260 2.678 2.376 3.001 . 0 0 "[ . 1 . 2]" 1
1092 1 37 GLY QA 1 38 PRO HD2 . . 3.520 2.510 2.138 2.789 . 0 0 "[ . 1 . 2]" 1
1093 1 37 GLY QA 1 38 PRO HD3 . . 3.610 2.339 2.099 2.639 . 0 0 "[ . 1 . 2]" 1
1094 1 37 GLY QA 1 38 PRO QG . . 4.600 3.731 3.630 3.844 . 0 0 "[ . 1 . 2]" 1
1095 1 37 GLY QA 1 41 VAL HB . . 5.500 4.559 4.104 5.018 . 0 0 "[ . 1 . 2]" 1
1096 1 37 GLY QA 1 41 VAL QG . . 4.040 4.377 4.003 4.754 0.714 8 5 "[* . +*1 . *-2]" 1
1097 1 37 GLY QA 1 42 VAL H . . 5.270 4.971 4.601 5.321 0.051 18 0 "[ . 1 . 2]" 1
1098 1 37 GLY QA 1 42 VAL QG . . 3.540 2.819 2.544 3.135 . 0 0 "[ . 1 . 2]" 1
1099 1 38 PRO HA 1 39 VAL H . . 2.880 2.150 2.074 2.225 . 0 0 "[ . 1 . 2]" 1
1100 1 38 PRO HA 1 39 VAL HA . . 4.530 4.369 4.319 4.425 . 0 0 "[ . 1 . 2]" 1
1101 1 38 PRO HA 1 39 VAL HB . . 4.450 4.547 4.438 4.675 0.225 7 0 "[ . 1 . 2]" 1
1102 1 38 PRO HA 1 39 VAL QG . . 4.180 3.624 3.473 3.796 . 0 0 "[ . 1 . 2]" 1
1103 1 38 PRO HA 1 40 ASN H . . 3.990 4.189 4.015 4.378 0.388 12 0 "[ . 1 . 2]" 1
1104 1 38 PRO HA 1 41 VAL H . . 4.600 4.692 4.568 4.855 0.255 17 0 "[ . 1 . 2]" 1
1105 1 38 PRO HA 1 42 VAL H . . 5.000 5.142 5.044 5.244 0.244 19 0 "[ . 1 . 2]" 1
1106 1 38 PRO HA 1 42 VAL QG . . 4.060 4.169 4.028 4.324 0.264 18 0 "[ . 1 . 2]" 1
1107 1 38 PRO HB2 1 39 VAL H . . 3.850 3.512 3.309 3.680 . 0 0 "[ . 1 . 2]" 1
1108 1 38 PRO HB2 1 39 VAL HA . . 5.270 5.157 5.036 5.283 0.013 16 0 "[ . 1 . 2]" 1
1109 1 38 PRO HB2 1 39 VAL QG . . 4.360 3.909 3.597 4.199 . 0 0 "[ . 1 . 2]" 1
1110 1 38 PRO HB2 1 40 ASN H . . 3.510 3.109 2.941 3.390 . 0 0 "[ . 1 . 2]" 1
1111 1 38 PRO HB2 1 41 VAL H . . 3.140 2.588 2.202 3.078 . 0 0 "[ . 1 . 2]" 1
1112 1 38 PRO HB2 1 41 VAL QG . . 4.040 2.623 2.233 3.325 . 0 0 "[ . 1 . 2]" 1
1113 1 38 PRO HB2 1 42 VAL QG . . 5.030 4.461 4.197 4.749 . 0 0 "[ . 1 . 2]" 1
1114 1 38 PRO HB3 1 39 VAL H . . 4.310 3.644 3.323 3.908 . 0 0 "[ . 1 . 2]" 1
1115 1 38 PRO HB3 1 39 VAL QG . . 5.180 4.172 3.898 4.626 . 0 0 "[ . 1 . 2]" 1
1116 1 38 PRO HB3 1 40 ASN H . . 4.610 4.245 3.848 4.768 0.158 8 0 "[ . 1 . 2]" 1
1117 1 38 PRO HB3 1 41 VAL H . . 4.570 4.298 3.837 4.755 0.185 17 0 "[ . 1 . 2]" 1
1118 1 38 PRO HB3 1 41 VAL QG . . 4.160 3.762 3.402 4.245 0.085 13 0 "[ . 1 . 2]" 1
1119 1 38 PRO HB3 1 42 VAL H . . 5.500 5.677 5.352 5.967 0.467 2 0 "[ . 1 . 2]" 1
1120 1 38 PRO HD2 1 41 VAL H . . 4.690 4.316 3.667 5.123 0.433 8 0 "[ . 1 . 2]" 1
1121 1 38 PRO HD2 1 41 VAL QG . . 3.740 3.052 2.600 3.573 . 0 0 "[ . 1 . 2]" 1
1122 1 38 PRO HD2 1 42 VAL H . . 4.610 3.997 3.433 4.825 0.215 1 0 "[ . 1 . 2]" 1
1123 1 38 PRO HD2 1 42 VAL QG . . 3.930 3.078 2.639 3.512 . 0 0 "[ . 1 . 2]" 1
1124 1 38 PRO HD3 1 41 VAL QG . . 4.220 3.908 3.501 4.320 0.100 1 0 "[ . 1 . 2]" 1
1125 1 38 PRO HD3 1 42 VAL QG . . 4.400 4.118 3.680 4.586 0.186 19 0 "[ . 1 . 2]" 1
1126 1 38 PRO QG 1 40 ASN QB . . 5.500 4.766 3.710 5.738 0.238 20 0 "[ . 1 . 2]" 1
1127 1 38 PRO QG 1 41 VAL H . . 3.760 3.411 2.710 3.839 0.079 10 0 "[ . 1 . 2]" 1
1128 1 38 PRO QG 1 41 VAL HA . . 4.600 4.791 4.362 5.046 0.446 11 0 "[ . 1 . 2]" 1
1129 1 38 PRO QG 1 41 VAL QG . . 3.080 2.089 1.962 2.242 . 0 0 "[ . 1 . 2]" 1
1130 1 38 PRO QG 1 42 VAL H . . 4.400 4.325 3.708 4.794 0.394 5 0 "[ . 1 . 2]" 1
1131 1 38 PRO QG 1 42 VAL QG . . 4.800 4.073 3.636 4.449 . 0 0 "[ . 1 . 2]" 1
1132 1 39 VAL H 1 39 VAL HB . . 3.630 2.505 2.420 2.612 . 0 0 "[ . 1 . 2]" 1
1133 1 39 VAL H 1 39 VAL QG . . 2.730 2.053 1.977 2.169 . 0 0 "[ . 1 . 2]" 1
1134 1 39 VAL H 1 40 ASN H . . 3.460 2.900 2.774 3.075 . 0 0 "[ . 1 . 2]" 1
1135 1 39 VAL H 1 41 VAL H . . 4.740 4.436 4.266 4.576 . 0 0 "[ . 1 . 2]" 1
1136 1 39 VAL H 1 42 VAL H . . 5.360 4.934 4.858 4.999 . 0 0 "[ . 1 . 2]" 1
1137 1 39 VAL H 1 42 VAL HB . . 5.030 5.223 4.966 5.424 0.394 5 0 "[ . 1 . 2]" 1
1138 1 39 VAL H 1 90 VAL QG . . 5.440 4.788 4.618 4.987 . 0 0 "[ . 1 . 2]" 1
1139 1 39 VAL H 1 96 ALA MB . . 5.490 4.992 4.548 5.227 . 0 0 "[ . 1 . 2]" 1
1140 1 39 VAL HA 1 39 VAL QG . . 2.510 2.440 2.341 2.480 . 0 0 "[ . 1 . 2]" 1
1141 1 39 VAL HA 1 40 ASN HA . . 5.230 4.878 4.759 5.005 . 0 0 "[ . 1 . 2]" 1
1142 1 39 VAL HA 1 41 VAL H . . 4.470 4.651 4.532 4.785 0.315 6 0 "[ . 1 . 2]" 1
1143 1 39 VAL HA 1 42 VAL H . . 3.850 4.048 3.808 4.139 0.289 11 0 "[ . 1 . 2]" 1
1144 1 39 VAL HA 1 42 VAL HA . . 5.500 6.029 5.795 6.129 0.629 3 14 "[* +**-* *** *** **]" 1
1145 1 39 VAL HA 1 42 VAL HB . . 3.400 3.241 3.006 3.351 . 0 0 "[ . 1 . 2]" 1
1146 1 39 VAL HA 1 42 VAL MG1 . . 4.580 4.498 4.268 4.647 0.067 5 0 "[ . 1 . 2]" 1
1147 1 39 VAL HA 1 42 VAL QG . . 3.290 3.578 3.482 3.690 0.400 14 0 "[ . 1 . 2]" 1
1148 1 39 VAL HA 1 42 VAL MG2 . . 4.580 3.759 3.661 3.889 . 0 0 "[ . 1 . 2]" 1
1149 1 39 VAL HA 1 43 LEU H . . 4.320 4.256 3.937 4.506 0.186 20 0 "[ . 1 . 2]" 1
1150 1 39 VAL HA 1 43 LEU QB . . 4.520 4.713 4.401 4.916 0.396 20 0 "[ . 1 . 2]" 1
1151 1 39 VAL HA 1 43 LEU QD . . 4.870 4.233 4.056 4.380 . 0 0 "[ . 1 . 2]" 1
1152 1 39 VAL HA 1 90 VAL QG . . 4.440 4.289 4.136 4.445 0.005 8 0 "[ . 1 . 2]" 1
1153 1 39 VAL HA 1 96 ALA H . . 5.500 5.417 4.912 5.771 0.271 18 0 "[ . 1 . 2]" 1
1154 1 39 VAL HA 1 96 ALA MB . . 4.060 2.871 2.350 3.191 . 0 0 "[ . 1 . 2]" 1
1155 1 39 VAL HB 1 40 ASN H . . 4.100 3.921 3.825 3.987 . 0 0 "[ . 1 . 2]" 1
1156 1 39 VAL HB 1 42 VAL HB . . 5.500 5.663 5.442 5.778 0.278 3 0 "[ . 1 . 2]" 1
1157 1 39 VAL HB 1 91 ASN HA . . 5.500 4.867 4.510 5.352 . 0 0 "[ . 1 . 2]" 1
1158 1 39 VAL HB 1 92 SER H . . 5.410 5.039 4.864 5.325 . 0 0 "[ . 1 . 2]" 1
1159 1 39 VAL HB 1 93 ALA HA . . 4.150 3.334 2.968 3.477 . 0 0 "[ . 1 . 2]" 1
1160 1 39 VAL HB 1 93 ALA MB . . 5.500 4.105 3.748 4.391 . 0 0 "[ . 1 . 2]" 1
1161 1 39 VAL HB 1 95 PHE H . . 5.500 6.218 6.114 6.301 0.801 13 20 [-***********+*******] 1
1162 1 39 VAL HB 1 96 ALA H . . 5.500 5.112 4.783 5.268 . 0 0 "[ . 1 . 2]" 1
1163 1 39 VAL HB 1 96 ALA HA . . 4.270 5.336 5.220 5.403 1.133 6 20 [*****+*-************] 1
1164 1 39 VAL HB 1 96 ALA MB . . 3.830 3.477 3.318 3.607 . 0 0 "[ . 1 . 2]" 1
1165 1 39 VAL QG 1 40 ASN H . . 2.820 1.994 1.872 2.100 . 0 0 "[ . 1 . 2]" 1
1166 1 39 VAL QG 1 40 ASN HA . . 3.640 3.108 3.003 3.196 . 0 0 "[ . 1 . 2]" 1
1167 1 39 VAL QG 1 40 ASN QB . . 4.180 3.172 2.567 3.619 . 0 0 "[ . 1 . 2]" 1
1168 1 39 VAL QG 1 43 LEU QB . . 4.660 3.775 3.390 4.007 . 0 0 "[ . 1 . 2]" 1
1169 1 39 VAL QG 1 43 LEU QD . . 3.760 2.460 2.229 2.776 . 0 0 "[ . 1 . 2]" 1
1170 1 39 VAL QG 1 90 VAL H . . 4.210 4.079 3.815 4.357 0.147 12 0 "[ . 1 . 2]" 1
1171 1 39 VAL QG 1 90 VAL HB . . 4.490 3.127 2.783 3.406 . 0 0 "[ . 1 . 2]" 1
1172 1 39 VAL QG 1 90 VAL QG . . 2.810 1.754 1.697 1.817 . 0 0 "[ . 1 . 2]" 1
1173 1 39 VAL QG 1 91 ASN H . . 4.140 3.473 3.254 3.779 . 0 0 "[ . 1 . 2]" 1
1174 1 39 VAL QG 1 91 ASN HA . . 3.120 2.366 2.049 2.853 . 0 0 "[ . 1 . 2]" 1
1175 1 39 VAL QG 1 91 ASN QB . . 4.560 3.849 3.564 4.230 . 0 0 "[ . 1 . 2]" 1
1176 1 39 VAL QG 1 92 SER H . . 3.610 2.752 2.591 3.000 . 0 0 "[ . 1 . 2]" 1
1177 1 39 VAL QG 1 92 SER HB2 . . 5.500 4.684 4.125 5.056 . 0 0 "[ . 1 . 2]" 1
1178 1 39 VAL QG 1 92 SER QB . . 4.340 3.971 3.879 4.117 . 0 0 "[ . 1 . 2]" 1
1179 1 39 VAL QG 1 92 SER HB3 . . 5.500 4.364 4.130 4.803 . 0 0 "[ . 1 . 2]" 1
1180 1 39 VAL QG 1 93 ALA H . . 5.440 3.858 3.698 4.065 . 0 0 "[ . 1 . 2]" 1
1181 1 39 VAL QG 1 93 ALA HA . . 2.820 2.438 2.277 2.738 . 0 0 "[ . 1 . 2]" 1
1182 1 39 VAL QG 1 93 ALA MB . . 3.150 3.648 3.528 3.751 0.601 8 10 "[ ***.- +*** * . *]" 1
1183 1 39 VAL QG 1 94 SER H . . 5.440 4.649 4.494 4.845 . 0 0 "[ . 1 . 2]" 1
1184 1 39 VAL QG 1 95 PHE H . . 4.260 3.784 3.668 3.991 . 0 0 "[ . 1 . 2]" 1
1185 1 39 VAL QG 1 96 ALA H . . 3.520 2.687 2.358 2.940 . 0 0 "[ . 1 . 2]" 1
1186 1 39 VAL QG 1 96 ALA HA . . 3.340 2.630 2.535 2.751 . 0 0 "[ . 1 . 2]" 1
1187 1 39 VAL QG 1 96 ALA MB . . 2.750 1.578 1.501 1.649 . 0 0 "[ . 1 . 2]" 1
1188 1 40 ASN H 1 40 ASN QB . . 2.960 2.508 2.191 2.602 . 0 0 "[ . 1 . 2]" 1
1189 1 40 ASN H 1 41 VAL H . . 3.130 2.675 2.502 2.967 . 0 0 "[ . 1 . 2]" 1
1190 1 40 ASN H 1 42 VAL H . . 4.510 4.285 3.967 4.488 . 0 0 "[ . 1 . 2]" 1
1191 1 40 ASN H 1 43 LEU H . . 4.910 4.991 4.797 5.070 0.160 5 0 "[ . 1 . 2]" 1
1192 1 40 ASN H 1 43 LEU QB . . 5.500 5.799 5.601 5.868 0.368 8 0 "[ . 1 . 2]" 1
1193 1 40 ASN H 1 43 LEU HG . . 5.500 4.890 4.575 5.318 . 0 0 "[ . 1 . 2]" 1
1194 1 40 ASN H 1 90 VAL H . . 5.500 5.431 4.772 5.971 0.471 9 0 "[ . 1 . 2]" 1
1195 1 40 ASN H 1 90 VAL QG . . 4.090 3.309 3.139 3.760 . 0 0 "[ . 1 . 2]" 1
1196 1 40 ASN H 1 96 ALA MB . . 5.380 5.194 4.716 5.538 0.158 13 0 "[ . 1 . 2]" 1
1197 1 40 ASN HA 1 41 VAL HA . . 5.500 4.740 4.713 4.772 . 0 0 "[ . 1 . 2]" 1
1198 1 40 ASN HA 1 43 LEU H . . 4.370 4.138 3.699 4.419 0.049 13 0 "[ . 1 . 2]" 1
1199 1 40 ASN HA 1 43 LEU QD . . 3.670 2.487 2.193 2.802 . 0 0 "[ . 1 . 2]" 1
1200 1 40 ASN HA 1 43 LEU HG . . 3.800 2.706 2.210 3.233 . 0 0 "[ . 1 . 2]" 1
1201 1 40 ASN HA 1 44 ARG H . . 4.700 4.516 4.272 4.730 0.030 3 0 "[ . 1 . 2]" 1
1202 1 40 ASN HA 1 72 GLU HG2 . . 4.060 3.568 3.117 4.420 0.360 8 0 "[ . 1 . 2]" 1
1203 1 40 ASN HA 1 72 GLU QG . . 3.220 3.073 2.477 3.635 0.415 8 0 "[ . 1 . 2]" 1
1204 1 40 ASN HA 1 72 GLU HG3 . . 4.060 3.444 2.585 4.495 0.435 17 0 "[ . 1 . 2]" 1
1205 1 40 ASN HA 1 90 VAL H . . 4.440 4.043 3.608 4.596 0.156 1 0 "[ . 1 . 2]" 1
1206 1 40 ASN HA 1 90 VAL QG . . 3.450 2.309 2.034 3.064 . 0 0 "[ . 1 . 2]" 1
1207 1 40 ASN QB 1 41 VAL H . . 3.720 2.799 2.259 3.546 . 0 0 "[ . 1 . 2]" 1
1208 1 40 ASN QB 1 41 VAL HA . . 4.880 4.039 3.710 4.467 . 0 0 "[ . 1 . 2]" 1
1209 1 40 ASN QB 1 41 VAL QG . . 4.810 3.111 2.562 3.920 . 0 0 "[ . 1 . 2]" 1
1210 1 40 ASN QB 1 42 VAL H . . 5.500 4.969 4.589 5.449 . 0 0 "[ . 1 . 2]" 1
1211 1 40 ASN QB 1 43 LEU H . . 5.430 5.342 5.176 5.512 0.082 13 0 "[ . 1 . 2]" 1
1212 1 40 ASN QB 1 44 ARG H . . 5.500 5.299 5.107 5.779 0.279 13 0 "[ . 1 . 2]" 1
1213 1 40 ASN QB 1 72 GLU H . . 5.400 4.892 4.296 5.760 0.360 9 0 "[ . 1 . 2]" 1
1214 1 40 ASN QB 1 72 GLU HA . . 4.820 4.430 3.502 5.050 0.230 17 0 "[ . 1 . 2]" 1
1215 1 40 ASN QB 1 72 GLU HG2 . . 4.520 3.563 2.744 4.867 0.347 9 0 "[ . 1 . 2]" 1
1216 1 40 ASN QB 1 72 GLU QG . . 3.880 2.604 1.948 3.527 . 0 0 "[ . 1 . 2]" 1
1217 1 40 ASN QB 1 72 GLU HG3 . . 4.520 2.730 1.959 3.692 . 0 0 "[ . 1 . 2]" 1
1218 1 40 ASN QB 1 90 VAL H . . 4.310 3.632 2.237 4.319 0.009 9 0 "[ . 1 . 2]" 1
1219 1 40 ASN QB 1 90 VAL QG . . 4.780 3.003 2.053 3.855 . 0 0 "[ . 1 . 2]" 1
1220 1 41 VAL H 1 41 VAL HB . . 3.340 2.506 2.409 2.584 . 0 0 "[ . 1 . 2]" 1
1221 1 41 VAL H 1 41 VAL QG . . 2.720 2.243 2.087 2.340 . 0 0 "[ . 1 . 2]" 1
1222 1 41 VAL H 1 42 VAL H . . 3.150 2.597 2.441 2.762 . 0 0 "[ . 1 . 2]" 1
1223 1 41 VAL H 1 42 VAL HA . . 5.300 5.221 5.113 5.345 0.045 10 0 "[ . 1 . 2]" 1
1224 1 41 VAL H 1 42 VAL HB . . 4.890 4.812 4.618 5.021 0.131 2 0 "[ . 1 . 2]" 1
1225 1 41 VAL H 1 42 VAL QG . . 4.140 3.959 3.823 4.140 . 10 0 "[ . 1 . 2]" 1
1226 1 41 VAL H 1 43 LEU H . . 3.980 4.203 4.050 4.384 0.404 6 0 "[ . 1 . 2]" 1
1227 1 41 VAL H 1 43 LEU HG . . 4.970 4.701 4.403 5.066 0.096 13 0 "[ . 1 . 2]" 1
1228 1 41 VAL H 1 44 ARG H . . 4.840 4.867 4.765 4.979 0.139 2 0 "[ . 1 . 2]" 1
1229 1 41 VAL HA 1 41 VAL QG . . 2.720 2.177 2.164 2.190 . 0 0 "[ . 1 . 2]" 1
1230 1 41 VAL HA 1 42 VAL HA . . 5.030 4.838 4.763 4.899 . 0 0 "[ . 1 . 2]" 1
1231 1 41 VAL HA 1 43 LEU H . . 4.610 4.474 4.278 4.702 0.092 6 0 "[ . 1 . 2]" 1
1232 1 41 VAL HA 1 44 ARG H . . 3.500 3.578 3.369 3.732 0.232 6 0 "[ . 1 . 2]" 1
1233 1 41 VAL HA 1 44 ARG HG2 . . 3.940 2.107 1.907 2.436 . 0 0 "[ . 1 . 2]" 1
1234 1 41 VAL HA 1 45 ARG H . . 3.870 4.185 4.026 4.350 0.480 3 0 "[ . 1 . 2]" 1
1235 1 41 VAL HA 1 45 ARG QD . . 4.560 4.811 4.431 5.158 0.598 16 5 "[* .* 1- * .+ 2]" 1
1236 1 41 VAL HA 1 72 GLU QG . . 4.210 3.939 3.540 4.510 0.300 8 0 "[ . 1 . 2]" 1
1237 1 41 VAL HB 1 42 VAL H . . 3.670 2.652 2.457 2.900 . 0 0 "[ . 1 . 2]" 1
1238 1 41 VAL HB 1 42 VAL HA . . 3.930 4.348 4.271 4.509 0.579 1 2 "[+ . 1 - . 2]" 1
1239 1 41 VAL HB 1 42 VAL QG . . 5.190 3.270 3.179 3.495 . 0 0 "[ . 1 . 2]" 1
1240 1 41 VAL QG 1 42 VAL H . . 3.410 3.215 2.987 3.387 . 0 0 "[ . 1 . 2]" 1
1241 1 41 VAL QG 1 43 LEU H . . 3.930 4.710 4.587 4.866 0.936 6 20 [*****+************-*] 1
1242 1 41 VAL QG 1 44 ARG H . . 4.260 4.467 4.279 4.595 0.335 13 0 "[ . 1 . 2]" 1
1243 1 41 VAL QG 1 44 ARG QD . . 4.240 3.063 2.360 3.605 . 0 0 "[ . 1 . 2]" 1
1244 1 41 VAL QG 1 44 ARG HG2 . . 3.710 3.163 2.754 3.403 . 0 0 "[ . 1 . 2]" 1
1245 1 41 VAL QG 1 45 ARG H . . 3.750 4.057 3.928 4.179 0.429 17 0 "[ . 1 . 2]" 1
1246 1 41 VAL QG 1 45 ARG HA . . 4.180 4.812 4.559 5.072 0.892 17 14 "[* *****- * **** + *]" 1
1247 1 41 VAL QG 1 45 ARG QD . . 3.040 3.063 2.572 3.422 0.382 9 0 "[ . 1 . 2]" 1
1248 1 41 VAL QG 1 45 ARG QG . . 4.010 2.271 2.108 2.446 . 0 0 "[ . 1 . 2]" 1
1249 1 42 VAL H 1 42 VAL HB . . 3.230 2.559 2.468 2.646 . 0 0 "[ . 1 . 2]" 1
1250 1 42 VAL H 1 42 VAL MG1 . . 3.790 3.822 3.785 3.852 0.062 9 0 "[ . 1 . 2]" 1
1251 1 42 VAL H 1 42 VAL QG . . 2.800 2.106 2.010 2.202 . 0 0 "[ . 1 . 2]" 1
1252 1 42 VAL H 1 42 VAL MG2 . . 3.790 2.116 2.018 2.215 . 0 0 "[ . 1 . 2]" 1
1253 1 42 VAL H 1 43 LEU H . . 3.440 2.838 2.716 2.994 . 0 0 "[ . 1 . 2]" 1
1254 1 42 VAL H 1 43 LEU QB . . 5.500 5.063 4.946 5.247 . 0 0 "[ . 1 . 2]" 1
1255 1 42 VAL H 1 43 LEU HG . . 5.500 4.682 4.329 4.992 . 0 0 "[ . 1 . 2]" 1
1256 1 42 VAL H 1 44 ARG H . . 4.510 4.285 4.112 4.394 . 0 0 "[ . 1 . 2]" 1
1257 1 42 VAL H 1 96 ALA MB . . 5.240 5.276 4.770 5.566 0.326 10 0 "[ . 1 . 2]" 1
1258 1 42 VAL HA 1 42 VAL MG1 . . 3.010 2.501 2.439 2.554 . 0 0 "[ . 1 . 2]" 1
1259 1 42 VAL HA 1 42 VAL QG . . 2.620 2.188 2.173 2.204 . 0 0 "[ . 1 . 2]" 1
1260 1 42 VAL HA 1 42 VAL MG2 . . 3.010 2.418 2.381 2.461 . 0 0 "[ . 1 . 2]" 1
1261 1 42 VAL HA 1 43 LEU H . . 3.550 3.598 3.552 3.634 0.084 6 0 "[ . 1 . 2]" 1
1262 1 42 VAL HA 1 43 LEU HA . . 4.860 4.773 4.748 4.805 . 0 0 "[ . 1 . 2]" 1
1263 1 42 VAL HA 1 44 ARG H . . 4.890 4.539 4.420 4.626 . 0 0 "[ . 1 . 2]" 1
1264 1 42 VAL HA 1 45 ARG H . . 4.560 3.663 3.426 3.829 . 0 0 "[ . 1 . 2]" 1
1265 1 42 VAL HA 1 45 ARG QB . . 3.500 2.785 2.498 3.172 . 0 0 "[ . 1 . 2]" 1
1266 1 42 VAL HA 1 45 ARG QG . . 4.530 3.074 2.565 3.848 . 0 0 "[ . 1 . 2]" 1
1267 1 42 VAL HA 1 46 ILE MD . . 4.280 5.067 4.956 5.178 0.898 8 20 [*****-*+************] 1
1268 1 42 VAL HB 1 43 LEU H . . 3.370 2.823 2.693 3.096 . 0 0 "[ . 1 . 2]" 1
1269 1 42 VAL HB 1 43 LEU HA . . 4.440 4.482 4.371 4.553 0.113 8 0 "[ . 1 . 2]" 1
1270 1 42 VAL QG 1 43 LEU H . . 3.650 3.318 3.210 3.519 . 0 0 "[ . 1 . 2]" 1
1271 1 42 VAL QG 1 43 LEU HA . . 4.220 3.478 3.335 3.747 . 0 0 "[ . 1 . 2]" 1
1272 1 42 VAL QG 1 43 LEU QB . . 5.380 4.067 3.926 4.334 . 0 0 "[ . 1 . 2]" 1
1273 1 42 VAL QG 1 46 ILE MD . . 3.490 3.493 3.222 3.622 0.132 11 0 "[ . 1 . 2]" 1
1274 1 42 VAL QG 1 46 ILE HG12 . . 4.180 3.491 3.242 3.733 . 0 0 "[ . 1 . 2]" 1
1275 1 42 VAL QG 1 46 ILE HG13 . . 4.410 3.958 3.623 4.313 . 0 0 "[ . 1 . 2]" 1
1276 1 42 VAL QG 1 96 ALA MB . . 4.450 3.617 3.260 3.910 . 0 0 "[ . 1 . 2]" 1
1277 1 42 VAL MG1 1 43 LEU H . . 4.230 3.543 3.381 3.869 . 0 0 "[ . 1 . 2]" 1
1278 1 42 VAL MG2 1 43 LEU H . . 4.230 4.014 3.974 4.063 . 0 0 "[ . 1 . 2]" 1
1279 1 43 LEU H 1 43 LEU QB . . 3.360 2.552 2.448 2.641 . 0 0 "[ . 1 . 2]" 1
1280 1 43 LEU H 1 43 LEU QD . . 3.330 3.225 3.151 3.287 . 0 0 "[ . 1 . 2]" 1
1281 1 43 LEU H 1 43 LEU HG . . 3.640 2.519 2.299 2.752 . 0 0 "[ . 1 . 2]" 1
1282 1 43 LEU H 1 44 ARG H . . 3.250 2.608 2.531 2.679 . 0 0 "[ . 1 . 2]" 1
1283 1 43 LEU H 1 44 ARG HB3 . . 4.640 4.917 4.587 5.083 0.443 2 0 "[ . 1 . 2]" 1
1284 1 43 LEU H 1 44 ARG HG2 . . 5.020 4.510 4.083 5.152 0.132 16 0 "[ . 1 . 2]" 1
1285 1 43 LEU H 1 45 ARG H . . 3.940 3.997 3.867 4.115 0.175 20 0 "[ . 1 . 2]" 1
1286 1 43 LEU H 1 45 ARG QG . . 5.500 5.110 4.785 5.635 0.135 1 0 "[ . 1 . 2]" 1
1287 1 43 LEU H 1 96 ALA HA . . 4.950 4.615 4.196 4.884 . 0 0 "[ . 1 . 2]" 1
1288 1 43 LEU H 1 96 ALA MB . . 3.860 3.957 3.662 4.109 0.249 19 0 "[ . 1 . 2]" 1
1289 1 43 LEU HA 1 43 LEU QD . . 3.400 3.476 3.435 3.504 0.104 1 0 "[ . 1 . 2]" 1
1290 1 43 LEU HA 1 44 ARG HA . . 4.890 4.754 4.715 4.791 . 0 0 "[ . 1 . 2]" 1
1291 1 43 LEU HA 1 46 ILE HB . . 4.140 3.487 3.213 3.713 . 0 0 "[ . 1 . 2]" 1
1292 1 43 LEU HA 1 46 ILE MD . . 4.390 4.539 4.223 4.887 0.497 1 0 "[ . 1 . 2]" 1
1293 1 43 LEU HA 1 46 ILE HG12 . . 3.730 3.184 2.913 3.555 . 0 0 "[ . 1 . 2]" 1
1294 1 43 LEU HA 1 96 ALA MB . . 3.520 4.257 4.008 4.485 0.965 10 19 "[***-**** +**********]" 1
1295 1 43 LEU HA 1 100 LEU H . . 4.940 4.950 4.547 5.129 0.189 13 0 "[ . 1 . 2]" 1
1296 1 43 LEU HA 1 100 LEU QD . . 3.980 2.128 1.908 2.248 . 0 0 "[ . 1 . 2]" 1
1297 1 43 LEU QB 1 44 ARG H . . 4.180 3.567 3.512 3.626 . 0 0 "[ . 1 . 2]" 1
1298 1 43 LEU QB 1 90 VAL QG . . 4.200 3.786 3.709 3.889 . 0 0 "[ . 1 . 2]" 1
1299 1 43 LEU QB 1 96 ALA HA . . 4.380 2.481 2.185 2.803 . 0 0 "[ . 1 . 2]" 1
1300 1 43 LEU QB 1 96 ALA MB . . 4.060 2.818 2.565 2.953 . 0 0 "[ . 1 . 2]" 1
1301 1 43 LEU QD 1 44 ARG H . . 3.230 2.527 2.286 2.805 . 0 0 "[ . 1 . 2]" 1
1302 1 43 LEU QD 1 44 ARG HA . . 3.340 2.460 2.352 2.569 . 0 0 "[ . 1 . 2]" 1
1303 1 43 LEU QD 1 44 ARG HB2 . . 3.630 3.607 3.255 3.841 0.211 13 0 "[ . 1 . 2]" 1
1304 1 43 LEU QD 1 44 ARG QD . . 5.230 4.252 3.990 4.921 . 0 0 "[ . 1 . 2]" 1
1305 1 43 LEU QD 1 45 ARG H . . 4.980 4.323 4.201 4.460 . 0 0 "[ . 1 . 2]" 1
1306 1 43 LEU QD 1 72 GLU QG . . 5.010 2.157 1.784 2.683 . 0 0 "[ . 1 . 2]" 1
1307 1 43 LEU QD 1 89 PRO HA . . 4.810 4.692 4.320 5.020 0.210 9 0 "[ . 1 . 2]" 1
1308 1 43 LEU QD 1 90 VAL H . . 4.170 3.876 3.626 4.106 . 0 0 "[ . 1 . 2]" 1
1309 1 43 LEU QD 1 90 VAL HA . . 5.210 4.891 4.743 5.071 . 0 0 "[ . 1 . 2]" 1
1310 1 43 LEU QD 1 90 VAL HB . . 4.090 3.673 3.450 4.032 . 0 0 "[ . 1 . 2]" 1
1311 1 43 LEU QD 1 90 VAL QG . . 2.760 1.796 1.723 1.917 . 0 0 "[ . 1 . 2]" 1
1312 1 43 LEU QD 1 96 ALA H . . 4.200 4.015 3.764 4.417 0.217 3 0 "[ . 1 . 2]" 1
1313 1 43 LEU QD 1 96 ALA HA . . 3.220 1.993 1.813 2.334 . 0 0 "[ . 1 . 2]" 1
1314 1 43 LEU QD 1 96 ALA MB . . 3.320 3.115 2.920 3.324 0.004 13 0 "[ . 1 . 2]" 1
1315 1 43 LEU QD 1 99 PHE H . . 5.070 3.816 3.633 4.040 . 0 0 "[ . 1 . 2]" 1
1316 1 43 LEU QD 1 99 PHE HA . . 4.690 4.250 4.113 4.439 . 0 0 "[ . 1 . 2]" 1
1317 1 43 LEU QD 1 99 PHE QB . . 3.740 2.045 1.810 2.261 . 0 0 "[ . 1 . 2]" 1
1318 1 43 LEU QD 1 100 LEU H . . 5.280 4.022 3.627 4.288 . 0 0 "[ . 1 . 2]" 1
1319 1 43 LEU HG 1 44 ARG H . . 3.500 2.530 2.287 2.693 . 0 0 "[ . 1 . 2]" 1
1320 1 43 LEU HG 1 44 ARG HA . . 4.240 4.434 4.008 4.743 0.503 17 1 "[ . 1 . + 2]" 1
1321 1 43 LEU HG 1 45 ARG H . . 4.820 4.952 4.767 5.059 0.239 17 0 "[ . 1 . 2]" 1
1322 1 43 LEU HG 1 90 VAL QG . . 4.610 3.509 3.311 3.890 . 0 0 "[ . 1 . 2]" 1
1323 1 44 ARG H 1 44 ARG HB2 . . 3.560 3.661 3.533 3.699 0.139 2 0 "[ . 1 . 2]" 1
1324 1 44 ARG H 1 44 ARG HB3 . . 3.220 2.523 2.261 2.700 . 0 0 "[ . 1 . 2]" 1
1325 1 44 ARG H 1 44 ARG QD . . 4.590 4.021 3.628 4.476 . 0 0 "[ . 1 . 2]" 1
1326 1 44 ARG H 1 44 ARG HG3 . . 4.290 3.711 3.311 4.189 . 0 0 "[ . 1 . 2]" 1
1327 1 44 ARG H 1 45 ARG H . . 3.520 2.503 2.445 2.575 . 0 0 "[ . 1 . 2]" 1
1328 1 44 ARG H 1 45 ARG HA . . 5.250 5.143 5.098 5.200 . 0 0 "[ . 1 . 2]" 1
1329 1 44 ARG H 1 46 ILE H . . 4.290 4.195 4.012 4.296 0.006 15 0 "[ . 1 . 2]" 1
1330 1 44 ARG H 1 47 VAL H . . 5.370 4.945 4.839 5.083 . 0 0 "[ . 1 . 2]" 1
1331 1 44 ARG H 1 72 GLU QG . . 3.970 3.663 3.459 4.035 0.065 16 0 "[ . 1 . 2]" 1
1332 1 44 ARG H 1 74 ILE MD . . 5.040 4.648 4.521 4.873 . 0 0 "[ . 1 . 2]" 1
1333 1 44 ARG H 1 96 ALA MB . . 5.460 5.961 5.719 6.107 0.647 8 12 "[ -* .**+ * ** *** *2]" 1
1334 1 44 ARG HA 1 44 ARG HG2 . . 3.870 3.844 3.738 3.945 0.075 19 0 "[ . 1 . 2]" 1
1335 1 44 ARG HA 1 44 ARG HG3 . . 3.620 3.748 3.581 3.863 0.243 13 0 "[ . 1 . 2]" 1
1336 1 44 ARG HA 1 45 ARG HA . . 4.880 4.823 4.744 4.907 0.027 2 0 "[ . 1 . 2]" 1
1337 1 44 ARG HA 1 46 ILE H . . 4.240 4.185 3.932 4.365 0.125 15 0 "[ . 1 . 2]" 1
1338 1 44 ARG HA 1 47 VAL H . . 4.150 3.318 3.084 3.602 . 0 0 "[ . 1 . 2]" 1
1339 1 44 ARG HA 1 47 VAL MG1 . . 4.860 4.083 3.782 4.391 . 0 0 "[ . 1 . 2]" 1
1340 1 44 ARG HA 1 47 VAL QG . . 3.860 2.943 2.523 3.324 . 0 0 "[ . 1 . 2]" 1
1341 1 44 ARG HA 1 47 VAL MG2 . . 4.860 3.023 2.547 3.441 . 0 0 "[ . 1 . 2]" 1
1342 1 44 ARG HA 1 48 GLN H . . 4.300 3.766 3.587 4.033 . 0 0 "[ . 1 . 2]" 1
1343 1 44 ARG HA 1 72 GLU HB2 . . 5.500 5.100 4.857 5.506 0.006 18 0 "[ . 1 . 2]" 1
1344 1 44 ARG HA 1 72 GLU QG . . 4.720 4.256 3.866 4.754 0.034 16 0 "[ . 1 . 2]" 1
1345 1 44 ARG HA 1 74 ILE MD . . 3.330 2.340 2.166 2.656 . 0 0 "[ . 1 . 2]" 1
1346 1 44 ARG HA 1 74 ILE MG . . 5.500 5.290 5.167 5.529 0.029 19 0 "[ . 1 . 2]" 1
1347 1 44 ARG HA 1 87 LEU QD . . 5.430 3.411 2.943 3.912 . 0 0 "[ . 1 . 2]" 1
1348 1 44 ARG HB2 1 44 ARG QD . . 3.690 2.580 2.377 2.976 . 0 0 "[ . 1 . 2]" 1
1349 1 44 ARG HB2 1 45 ARG H . . 4.200 4.176 4.007 4.353 0.153 16 0 "[ . 1 . 2]" 1
1350 1 44 ARG HB2 1 48 GLN HB3 . . 4.670 4.318 3.860 4.622 . 0 0 "[ . 1 . 2]" 1
1351 1 44 ARG HB2 1 74 ILE MD . . 3.440 2.198 2.028 2.365 . 0 0 "[ . 1 . 2]" 1
1352 1 44 ARG HB3 1 45 ARG H . . 3.740 4.008 3.767 4.161 0.421 7 0 "[ . 1 . 2]" 1
1353 1 44 ARG HB3 1 48 GLN QE . . 4.810 4.651 4.176 5.229 0.419 2 0 "[ . 1 . 2]" 1
1354 1 44 ARG HB3 1 72 GLU HB3 . . 3.510 2.341 1.935 2.783 . 0 0 "[ . 1 . 2]" 1
1355 1 44 ARG HB3 1 72 GLU QG . . 4.440 2.364 2.166 2.615 . 0 0 "[ . 1 . 2]" 1
1356 1 44 ARG QD 1 45 ARG QD . . 4.280 4.486 3.343 5.103 0.823 5 7 "[ +* *1* - .* * 2]" 1
1357 1 44 ARG QD 1 72 GLU H . . 5.340 5.095 4.611 5.858 0.518 20 1 "[ . 1 . +]" 1
1358 1 44 ARG QD 1 72 GLU HA . . 3.880 2.963 2.413 3.891 0.011 1 0 "[ . 1 . 2]" 1
1359 1 44 ARG QD 1 72 GLU HB2 . . 5.340 3.921 3.379 4.780 . 0 0 "[ . 1 . 2]" 1
1360 1 44 ARG QD 1 72 GLU QG . . 4.550 2.732 2.183 3.591 . 0 0 "[ . 1 . 2]" 1
1361 1 44 ARG QD 1 73 VAL H . . 3.650 2.271 1.751 3.553 . 0 0 "[ . 1 . 2]" 1
1362 1 44 ARG QD 1 73 VAL QG . . 4.720 4.040 2.942 5.089 0.369 1 0 "[ . 1 . 2]" 1
1363 1 44 ARG QD 1 87 LEU QD . . 5.280 4.139 3.596 4.678 . 0 0 "[ . 1 . 2]" 1
1364 1 44 ARG HD2 1 45 ARG H . . 5.150 5.257 4.815 5.589 0.439 16 0 "[ . 1 . 2]" 1
1365 1 44 ARG HD2 1 72 GLU HB3 . . 4.550 2.884 1.968 4.649 0.099 3 0 "[ . 1 . 2]" 1
1366 1 44 ARG HD2 1 74 ILE MD . . 5.500 4.133 3.283 5.263 . 0 0 "[ . 1 . 2]" 1
1367 1 44 ARG HD3 1 45 ARG H . . 5.150 5.094 4.746 5.427 0.277 3 0 "[ . 1 . 2]" 1
1368 1 44 ARG HD3 1 72 GLU HB3 . . 4.550 3.013 2.153 4.082 . 0 0 "[ . 1 . 2]" 1
1369 1 44 ARG HD3 1 74 ILE MD . . 5.500 4.717 3.860 5.449 . 0 0 "[ . 1 . 2]" 1
1370 1 44 ARG HG2 1 45 ARG H . . 3.240 2.765 2.480 3.081 . 0 0 "[ . 1 . 2]" 1
1371 1 44 ARG HG2 1 46 ILE H . . 5.420 5.297 5.023 5.579 0.159 7 0 "[ . 1 . 2]" 1
1372 1 44 ARG HG2 1 48 GLN QE . . 5.500 4.272 3.482 5.109 . 0 0 "[ . 1 . 2]" 1
1373 1 44 ARG HG3 1 45 ARG H . . 3.970 3.082 2.710 3.650 . 0 0 "[ . 1 . 2]" 1
1374 1 44 ARG HG3 1 48 GLN QE . . 5.500 2.777 2.170 3.661 . 0 0 "[ . 1 . 2]" 1
1375 1 44 ARG HG3 1 73 VAL H . . 4.600 4.466 4.027 5.109 0.509 1 1 "[+ . 1 . 2]" 1
1376 1 44 ARG HG3 1 74 ILE MD . . 4.410 3.684 2.872 4.079 . 0 0 "[ . 1 . 2]" 1
1377 1 44 ARG HG3 1 87 LEU QD . . 5.440 5.140 4.499 5.646 0.206 18 0 "[ . 1 . 2]" 1
1378 1 45 ARG H 1 45 ARG QB . . 3.030 2.372 2.283 2.470 . 0 0 "[ . 1 . 2]" 1
1379 1 45 ARG H 1 45 ARG HD2 . . 4.320 4.026 3.334 4.735 0.415 11 0 "[ . 1 . 2]" 1
1380 1 45 ARG H 1 45 ARG QD . . 3.800 3.615 3.242 3.909 0.109 13 0 "[ . 1 . 2]" 1
1381 1 45 ARG H 1 45 ARG HD3 . . 4.320 4.450 3.534 5.030 0.710 13 4 "[* .* 1 -+ . 2]" 1
1382 1 45 ARG H 1 45 ARG QG . . 3.700 2.583 2.357 2.777 . 0 0 "[ . 1 . 2]" 1
1383 1 45 ARG H 1 46 ILE H . . 3.160 2.628 2.554 2.738 . 0 0 "[ . 1 . 2]" 1
1384 1 45 ARG H 1 46 ILE HA . . 5.500 5.283 5.228 5.379 . 0 0 "[ . 1 . 2]" 1
1385 1 45 ARG H 1 46 ILE HB . . 5.360 4.936 4.741 5.089 . 0 0 "[ . 1 . 2]" 1
1386 1 45 ARG H 1 46 ILE MD . . 5.070 5.251 5.075 5.389 0.319 1 0 "[ . 1 . 2]" 1
1387 1 45 ARG H 1 46 ILE HG12 . . 4.460 4.248 4.123 4.403 . 0 0 "[ . 1 . 2]" 1
1388 1 45 ARG H 1 48 GLN H . . 5.090 4.860 4.753 5.048 . 0 0 "[ . 1 . 2]" 1
1389 1 45 ARG H 1 48 GLN QE . . 5.260 4.815 4.258 5.523 0.263 1 0 "[ . 1 . 2]" 1
1390 1 45 ARG H 1 74 ILE MD . . 5.500 4.751 4.625 4.899 . 0 0 "[ . 1 . 2]" 1
1391 1 45 ARG HA 1 45 ARG HD2 . . 3.980 2.317 1.990 2.920 . 0 0 "[ . 1 . 2]" 1
1392 1 45 ARG HA 1 45 ARG QD . . 3.370 2.101 1.980 2.251 . 0 0 "[ . 1 . 2]" 1
1393 1 45 ARG HA 1 45 ARG HD3 . . 3.980 3.220 2.120 3.754 . 0 0 "[ . 1 . 2]" 1
1394 1 45 ARG HA 1 45 ARG QG . . 3.130 2.952 2.810 3.071 . 0 0 "[ . 1 . 2]" 1
1395 1 45 ARG HA 1 46 ILE HA . . 4.800 4.832 4.744 4.878 0.078 8 0 "[ . 1 . 2]" 1
1396 1 45 ARG HA 1 47 VAL H . . 5.000 4.638 4.391 4.787 . 0 0 "[ . 1 . 2]" 1
1397 1 45 ARG HA 1 48 GLN H . . 4.320 3.853 3.641 4.245 . 0 0 "[ . 1 . 2]" 1
1398 1 45 ARG HA 1 48 GLN QE . . 4.480 3.641 2.564 4.413 . 0 0 "[ . 1 . 2]" 1
1399 1 45 ARG HA 1 48 GLN QG . . 4.250 2.205 2.050 2.490 . 0 0 "[ . 1 . 2]" 1
1400 1 45 ARG HA 1 49 ALA H . . 4.220 3.988 3.730 4.285 0.065 20 0 "[ . 1 . 2]" 1
1401 1 45 ARG HA 1 49 ALA MB . . 4.470 4.192 3.956 4.471 0.001 3 0 "[ . 1 . 2]" 1
1402 1 45 ARG HA 1 74 ILE MD . . 5.060 4.652 4.465 4.922 . 0 0 "[ . 1 . 2]" 1
1403 1 45 ARG QB 1 45 ARG HD2 . . 3.610 2.904 2.462 3.201 . 0 0 "[ . 1 . 2]" 1
1404 1 45 ARG QB 1 45 ARG QD . . 3.080 2.749 2.374 2.984 . 0 0 "[ . 1 . 2]" 1
1405 1 45 ARG QB 1 45 ARG HD3 . . 3.610 3.414 3.067 3.569 . 0 0 "[ . 1 . 2]" 1
1406 1 45 ARG QB 1 46 ILE H . . 3.410 2.768 2.618 3.105 . 0 0 "[ . 1 . 2]" 1
1407 1 45 ARG QB 1 46 ILE HA . . 4.270 4.057 3.895 4.290 0.020 1 0 "[ . 1 . 2]" 1
1408 1 45 ARG QB 1 46 ILE MD . . 4.080 3.807 3.485 4.200 0.120 1 0 "[ . 1 . 2]" 1
1409 1 45 ARG QB 1 46 ILE MG . . 5.500 5.293 5.138 5.567 0.067 1 0 "[ . 1 . 2]" 1
1410 1 45 ARG QB 1 49 ALA H . . 5.430 5.016 4.779 5.206 . 0 0 "[ . 1 . 2]" 1
1411 1 45 ARG QB 1 49 ALA MB . . 4.420 4.125 3.783 4.318 . 0 0 "[ . 1 . 2]" 1
1412 1 45 ARG HD2 1 48 GLN QE . . 4.140 3.812 2.050 4.938 0.798 11 4 "[ *- *1+ . 2]" 1
1413 1 45 ARG HD3 1 48 GLN QE . . 4.140 4.179 3.204 4.917 0.777 1 7 "[+ .- 1 **. * **]" 1
1414 1 45 ARG QG 1 46 ILE H . . 5.500 4.343 4.206 4.606 . 0 0 "[ . 1 . 2]" 1
1415 1 46 ILE H 1 46 ILE HB . . 3.220 2.618 2.565 2.697 . 0 0 "[ . 1 . 2]" 1
1416 1 46 ILE H 1 46 ILE MD . . 3.430 3.366 3.154 3.533 0.103 13 0 "[ . 1 . 2]" 1
1417 1 46 ILE H 1 46 ILE HG12 . . 3.270 2.187 2.069 2.364 . 0 0 "[ . 1 . 2]" 1
1418 1 46 ILE H 1 46 ILE HG13 . . 3.710 3.629 3.512 3.744 0.034 1 0 "[ . 1 . 2]" 1
1419 1 46 ILE H 1 46 ILE MG . . 3.890 3.846 3.828 3.872 . 0 0 "[ . 1 . 2]" 1
1420 1 46 ILE H 1 47 VAL H . . 3.430 2.622 2.449 2.694 . 0 0 "[ . 1 . 2]" 1
1421 1 46 ILE H 1 47 VAL QG . . 4.280 3.959 3.886 4.081 . 0 0 "[ . 1 . 2]" 1
1422 1 46 ILE H 1 48 GLN H . . 4.420 4.340 4.225 4.568 0.148 8 0 "[ . 1 . 2]" 1
1423 1 46 ILE H 1 48 GLN QG . . 5.500 4.451 4.349 4.631 . 0 0 "[ . 1 . 2]" 1
1424 1 46 ILE H 1 49 ALA H . . 4.610 4.802 4.668 4.908 0.298 18 0 "[ . 1 . 2]" 1
1425 1 46 ILE H 1 74 ILE MD . . 5.480 5.209 4.986 5.450 . 0 0 "[ . 1 . 2]" 1
1426 1 46 ILE H 1 100 LEU HB3 . . 5.360 5.107 4.789 5.372 0.012 6 0 "[ . 1 . 2]" 1
1427 1 46 ILE H 1 100 LEU QD . . 4.780 4.289 3.930 4.546 . 0 0 "[ . 1 . 2]" 1
1428 1 46 ILE HA 1 46 ILE MD . . 3.540 2.159 2.023 2.376 . 0 0 "[ . 1 . 2]" 1
1429 1 46 ILE HA 1 46 ILE HG12 . . 3.490 3.115 3.052 3.213 . 0 0 "[ . 1 . 2]" 1
1430 1 46 ILE HA 1 46 ILE HG13 . . 4.070 3.854 3.812 3.926 . 0 0 "[ . 1 . 2]" 1
1431 1 46 ILE HA 1 46 ILE MG . . 3.090 2.452 2.410 2.490 . 0 0 "[ . 1 . 2]" 1
1432 1 46 ILE HA 1 47 VAL HA . . 4.870 4.829 4.774 4.881 0.011 17 0 "[ . 1 . 2]" 1
1433 1 46 ILE HA 1 48 GLN H . . 5.220 4.910 4.660 5.191 . 0 0 "[ . 1 . 2]" 1
1434 1 46 ILE HA 1 49 ALA H . . 3.890 3.963 3.701 4.169 0.279 18 0 "[ . 1 . 2]" 1
1435 1 46 ILE HA 1 49 ALA HA . . 5.500 5.847 5.501 6.101 0.601 18 3 "[ -.* 1 . + 2]" 1
1436 1 46 ILE HA 1 49 ALA MB . . 3.130 2.913 2.622 3.127 . 0 0 "[ . 1 . 2]" 1
1437 1 46 ILE HA 1 50 CYS H . . 4.810 4.351 4.031 4.557 . 0 0 "[ . 1 . 2]" 1
1438 1 46 ILE HA 1 100 LEU QD . . 4.770 4.995 4.462 5.136 0.366 18 0 "[ . 1 . 2]" 1
1439 1 46 ILE HA 1 113 LEU HG . . 5.500 5.243 4.567 6.025 0.525 3 1 "[ + . 1 . 2]" 1
1440 1 46 ILE HB 1 46 ILE MD . . 3.410 3.269 3.260 3.283 . 0 0 "[ . 1 . 2]" 1
1441 1 46 ILE HB 1 47 VAL H . . 3.440 2.356 2.232 2.486 . 0 0 "[ . 1 . 2]" 1
1442 1 46 ILE HB 1 47 VAL HA . . 4.450 4.028 3.955 4.131 . 0 0 "[ . 1 . 2]" 1
1443 1 46 ILE HB 1 47 VAL HB . . 4.940 4.687 4.449 4.909 . 0 0 "[ . 1 . 2]" 1
1444 1 46 ILE HB 1 48 GLN H . . 5.160 5.108 4.977 5.316 0.156 8 0 "[ . 1 . 2]" 1
1445 1 46 ILE HB 1 49 ALA H . . 5.500 5.659 5.485 5.818 0.318 4 0 "[ . 1 . 2]" 1
1446 1 46 ILE HB 1 100 LEU QD . . 3.500 2.940 2.691 3.169 . 0 0 "[ . 1 . 2]" 1
1447 1 46 ILE HB 1 103 PHE QD . . 5.500 5.286 4.339 5.666 0.166 3 0 "[ . 1 . 2]" 1
1448 1 46 ILE MD 1 46 ILE MG . . 2.880 2.106 2.058 2.141 . 0 0 "[ . 1 . 2]" 1
1449 1 46 ILE MD 1 47 VAL H . . 4.750 4.661 4.579 4.731 . 0 0 "[ . 1 . 2]" 1
1450 1 46 ILE MD 1 49 ALA H . . 5.500 5.612 5.265 5.901 0.401 6 0 "[ . 1 . 2]" 1
1451 1 46 ILE MD 1 49 ALA MB . . 4.840 4.086 3.796 4.413 . 0 0 "[ . 1 . 2]" 1
1452 1 46 ILE MD 1 100 LEU QD . . 3.310 3.525 2.711 3.687 0.377 5 0 "[ . 1 . 2]" 1
1453 1 46 ILE MD 1 100 LEU HG . . 4.970 3.742 3.362 5.293 0.323 8 0 "[ . 1 . 2]" 1
1454 1 46 ILE MD 1 113 LEU QB . . 4.320 2.619 2.362 2.999 . 0 0 "[ . 1 . 2]" 1
1455 1 46 ILE MD 1 113 LEU QD . . 3.580 3.015 2.491 3.737 0.157 3 0 "[ . 1 . 2]" 1
1456 1 46 ILE MD 1 113 LEU HG . . 3.870 2.328 1.778 3.472 . 0 0 "[ . 1 . 2]" 1
1457 1 46 ILE MD 1 114 SER H . . 5.500 5.045 4.753 5.374 . 0 0 "[ . 1 . 2]" 1
1458 1 46 ILE HG12 1 46 ILE MG . . 3.430 3.260 3.255 3.265 . 0 0 "[ . 1 . 2]" 1
1459 1 46 ILE HG12 1 47 VAL H . . 3.960 4.084 3.964 4.188 0.228 12 0 "[ . 1 . 2]" 1
1460 1 46 ILE HG12 1 100 LEU QD . . 4.290 3.505 2.777 3.749 . 0 0 "[ . 1 . 2]" 1
1461 1 46 ILE HG13 1 46 ILE MG . . 3.370 2.458 2.419 2.553 . 0 0 "[ . 1 . 2]" 1
1462 1 46 ILE HG13 1 47 VAL H . . 4.930 4.683 4.536 4.780 . 0 0 "[ . 1 . 2]" 1
1463 1 46 ILE HG13 1 100 LEU QD . . 4.480 2.608 1.719 2.849 . 0 0 "[ . 1 . 2]" 1
1464 1 46 ILE MG 1 47 VAL H . . 3.690 3.352 3.226 3.495 . 0 0 "[ . 1 . 2]" 1
1465 1 46 ILE MG 1 47 VAL HA . . 3.960 3.298 3.117 3.506 . 0 0 "[ . 1 . 2]" 1
1466 1 46 ILE MG 1 49 ALA H . . 5.260 4.979 4.763 5.175 . 0 0 "[ . 1 . 2]" 1
1467 1 46 ILE MG 1 49 ALA MB . . 4.060 3.995 3.652 4.272 0.212 18 0 "[ . 1 . 2]" 1
1468 1 46 ILE MG 1 50 CYS H . . 4.960 4.270 4.168 4.402 . 0 0 "[ . 1 . 2]" 1
1469 1 46 ILE MG 1 50 CYS QB . . 4.780 3.879 2.965 4.168 . 0 0 "[ . 1 . 2]" 1
1470 1 46 ILE MG 1 100 LEU H . . 5.260 5.291 5.098 5.511 0.251 19 0 "[ . 1 . 2]" 1
1471 1 46 ILE MG 1 100 LEU HA . . 4.870 4.634 3.999 4.998 0.128 16 0 "[ . 1 . 2]" 1
1472 1 46 ILE MG 1 100 LEU HB3 . . 4.570 3.325 2.955 3.722 . 0 0 "[ . 1 . 2]" 1
1473 1 46 ILE MG 1 100 LEU QD . . 2.740 2.505 1.871 2.811 0.071 2 0 "[ . 1 . 2]" 1
1474 1 46 ILE MG 1 100 LEU HG . . 5.020 2.119 1.788 4.144 . 0 0 "[ . 1 . 2]" 1
1475 1 46 ILE MG 1 103 PHE QD . . 4.590 3.900 2.713 4.323 . 0 0 "[ . 1 . 2]" 1
1476 1 46 ILE MG 1 112 LEU HB3 . . 5.500 4.818 4.352 5.293 . 0 0 "[ . 1 . 2]" 1
1477 1 46 ILE MG 1 113 LEU QB . . 3.970 3.530 3.115 4.085 0.115 8 0 "[ . 1 . 2]" 1
1478 1 46 ILE MG 1 113 LEU QD . . 3.010 2.635 2.022 3.143 0.133 3 0 "[ . 1 . 2]" 1
1479 1 46 ILE MG 1 113 LEU HG . . 3.870 2.521 2.104 3.180 . 0 0 "[ . 1 . 2]" 1
1480 1 47 VAL H 1 47 VAL HB . . 3.150 2.554 2.427 2.661 . 0 0 "[ . 1 . 2]" 1
1481 1 47 VAL H 1 47 VAL MG1 . . 3.770 3.809 3.760 3.834 0.064 8 0 "[ . 1 . 2]" 1
1482 1 47 VAL H 1 47 VAL QG . . 2.810 2.094 2.031 2.191 . 0 0 "[ . 1 . 2]" 1
1483 1 47 VAL H 1 47 VAL MG2 . . 3.770 2.104 2.039 2.206 . 0 0 "[ . 1 . 2]" 1
1484 1 47 VAL H 1 48 GLN H . . 3.460 2.853 2.774 3.003 . 0 0 "[ . 1 . 2]" 1
1485 1 47 VAL H 1 48 GLN QG . . 4.400 4.285 4.105 4.428 0.028 17 0 "[ . 1 . 2]" 1
1486 1 47 VAL H 1 49 ALA H . . 3.990 4.133 3.967 4.281 0.291 18 0 "[ . 1 . 2]" 1
1487 1 47 VAL H 1 49 ALA MB . . 4.830 4.787 4.624 4.926 0.096 9 0 "[ . 1 . 2]" 1
1488 1 47 VAL H 1 50 CYS H . . 4.790 4.751 4.640 4.866 0.076 17 0 "[ . 1 . 2]" 1
1489 1 47 VAL H 1 51 VAL QG . . 5.440 5.483 5.213 5.787 0.347 14 0 "[ . 1 . 2]" 1
1490 1 47 VAL H 1 74 ILE MD . . 4.270 3.853 3.629 4.145 . 0 0 "[ . 1 . 2]" 1
1491 1 47 VAL H 1 100 LEU HB3 . . 4.240 3.792 3.492 4.490 0.250 8 0 "[ . 1 . 2]" 1
1492 1 47 VAL H 1 100 LEU QD . . 4.820 4.262 3.958 4.529 . 0 0 "[ . 1 . 2]" 1
1493 1 47 VAL H 1 103 PHE QD . . 5.500 5.084 4.745 5.433 . 0 0 "[ . 1 . 2]" 1
1494 1 47 VAL HA 1 47 VAL MG1 . . 3.130 2.491 2.413 2.554 . 0 0 "[ . 1 . 2]" 1
1495 1 47 VAL HA 1 47 VAL MG2 . . 3.130 2.442 2.381 2.484 . 0 0 "[ . 1 . 2]" 1
1496 1 47 VAL HA 1 48 GLN HA . . 5.020 4.794 4.727 4.842 . 0 0 "[ . 1 . 2]" 1
1497 1 47 VAL HA 1 49 ALA H . . 4.220 4.448 4.226 4.650 0.430 18 0 "[ . 1 . 2]" 1
1498 1 47 VAL HA 1 49 ALA MB . . 5.050 5.030 4.751 5.346 0.296 14 0 "[ . 1 . 2]" 1
1499 1 47 VAL HA 1 50 CYS H . . 3.530 3.601 3.390 3.891 0.361 14 0 "[ . 1 . 2]" 1
1500 1 47 VAL HA 1 50 CYS QB . . 3.470 2.793 2.413 3.305 . 0 0 "[ . 1 . 2]" 1
1501 1 47 VAL HA 1 51 VAL H . . 4.450 4.216 3.999 4.500 0.050 14 0 "[ . 1 . 2]" 1
1502 1 47 VAL HA 1 51 VAL QG . . 4.180 3.685 3.204 3.968 . 0 0 "[ . 1 . 2]" 1
1503 1 47 VAL HA 1 74 ILE MD . . 4.710 4.344 4.245 4.538 . 0 0 "[ . 1 . 2]" 1
1504 1 47 VAL HA 1 74 ILE HG13 . . 5.500 5.556 5.220 5.774 0.274 1 0 "[ . 1 . 2]" 1
1505 1 47 VAL HA 1 74 ILE MG . . 5.010 4.887 4.645 5.177 0.167 1 0 "[ . 1 . 2]" 1
1506 1 47 VAL HA 1 100 LEU HB3 . . 5.300 4.330 3.939 5.522 0.222 8 0 "[ . 1 . 2]" 1
1507 1 47 VAL HA 1 103 PHE QD . . 4.320 2.947 2.597 3.491 . 0 0 "[ . 1 . 2]" 1
1508 1 47 VAL HA 1 103 PHE HZ . . 4.600 4.521 2.982 5.073 0.473 3 0 "[ . 1 . 2]" 1
1509 1 47 VAL HB 1 48 GLN H . . 3.490 2.559 2.291 2.693 . 0 0 "[ . 1 . 2]" 1
1510 1 47 VAL HB 1 48 GLN HB3 . . 4.380 4.193 4.065 4.330 . 0 0 "[ . 1 . 2]" 1
1511 1 47 VAL HB 1 49 ALA H . . 5.500 4.951 4.824 5.055 . 0 0 "[ . 1 . 2]" 1
1512 1 47 VAL HB 1 51 VAL QG . . 5.020 4.430 4.107 4.980 . 0 0 "[ . 1 . 2]" 1
1513 1 47 VAL HB 1 74 ILE MD . . 3.600 2.076 1.946 2.385 . 0 0 "[ . 1 . 2]" 1
1514 1 47 VAL HB 1 74 ILE HG12 . . 5.490 4.343 4.029 4.744 . 0 0 "[ . 1 . 2]" 1
1515 1 47 VAL HB 1 74 ILE MG . . 5.330 3.851 3.595 4.277 . 0 0 "[ . 1 . 2]" 1
1516 1 47 VAL QG 1 48 GLN H . . 3.300 3.161 2.936 3.282 . 0 0 "[ . 1 . 2]" 1
1517 1 47 VAL QG 1 48 GLN HA . . 3.720 3.370 3.208 3.517 . 0 0 "[ . 1 . 2]" 1
1518 1 47 VAL QG 1 48 GLN HB2 . . 5.440 5.011 4.763 5.157 . 0 0 "[ . 1 . 2]" 1
1519 1 47 VAL QG 1 48 GLN QG . . 5.440 4.554 4.290 4.733 . 0 0 "[ . 1 . 2]" 1
1520 1 47 VAL QG 1 49 ALA H . . 4.840 4.607 4.498 4.728 . 0 0 "[ . 1 . 2]" 1
1521 1 47 VAL QG 1 50 CYS H . . 4.760 4.459 4.271 4.735 . 0 0 "[ . 1 . 2]" 1
1522 1 47 VAL QG 1 50 CYS QB . . 4.630 3.651 3.435 4.225 . 0 0 "[ . 1 . 2]" 1
1523 1 47 VAL QG 1 51 VAL H . . 4.100 4.013 3.818 4.457 0.357 14 0 "[ . 1 . 2]" 1
1524 1 47 VAL QG 1 51 VAL HB . . 4.580 4.370 4.074 4.700 0.120 11 0 "[ . 1 . 2]" 1
1525 1 47 VAL QG 1 51 VAL QG . . 3.080 2.448 2.236 3.013 . 0 0 "[ . 1 . 2]" 1
1526 1 47 VAL QG 1 52 ASP H . . 5.440 5.659 5.430 6.085 0.645 14 1 "[ . 1 +. 2]" 1
1527 1 47 VAL QG 1 61 PHE HA . . 5.440 5.727 5.168 6.024 0.584 3 5 "[ + .* - .* *2]" 1
1528 1 47 VAL QG 1 64 LEU QD . . 2.720 2.065 1.947 2.266 . 0 0 "[ . 1 . 2]" 1
1529 1 47 VAL QG 1 74 ILE H . . 5.440 5.528 5.351 5.711 0.271 15 0 "[ . 1 . 2]" 1
1530 1 47 VAL QG 1 74 ILE HB . . 4.310 4.019 3.811 4.215 . 0 0 "[ . 1 . 2]" 1
1531 1 47 VAL QG 1 74 ILE MD . . 2.770 2.368 2.234 2.545 . 0 0 "[ . 1 . 2]" 1
1532 1 47 VAL QG 1 74 ILE HG13 . . 3.290 2.222 2.049 2.476 . 0 0 "[ . 1 . 2]" 1
1533 1 47 VAL QG 1 74 ILE MG . . 3.080 2.412 2.207 2.669 . 0 0 "[ . 1 . 2]" 1
1534 1 47 VAL QG 1 75 THR H . . 5.440 5.533 5.257 5.730 0.290 15 0 "[ . 1 . 2]" 1
1535 1 47 VAL QG 1 103 PHE HB2 . . 4.120 3.341 3.162 3.749 . 0 0 "[ . 1 . 2]" 1
1536 1 47 VAL QG 1 103 PHE HB3 . . 3.610 3.083 2.759 3.446 . 0 0 "[ . 1 . 2]" 1
1537 1 47 VAL QG 1 103 PHE QD . . 3.690 2.517 2.340 2.837 . 0 0 "[ . 1 . 2]" 1
1538 1 47 VAL QG 1 103 PHE HZ . . 4.150 3.393 2.956 3.725 . 0 0 "[ . 1 . 2]" 1
1539 1 47 VAL MG1 1 48 GLN H . . 3.950 3.347 3.027 3.521 . 0 0 "[ . 1 . 2]" 1
1540 1 47 VAL MG1 1 49 ALA H . . 5.500 4.993 4.816 5.140 . 0 0 "[ . 1 . 2]" 1
1541 1 47 VAL MG1 1 74 ILE HG13 . . 4.030 2.232 2.056 2.492 . 0 0 "[ . 1 . 2]" 1
1542 1 47 VAL MG1 1 103 PHE HA . . 5.500 5.513 5.238 5.930 0.430 20 0 "[ . 1 . 2]" 1
1543 1 47 VAL MG1 1 103 PHE QD . . 4.290 3.034 2.771 3.325 . 0 0 "[ . 1 . 2]" 1
1544 1 47 VAL MG2 1 48 GLN H . . 3.950 3.894 3.760 3.955 0.005 1 0 "[ . 1 . 2]" 1
1545 1 47 VAL MG2 1 49 ALA H . . 5.500 5.411 5.264 5.523 0.023 18 0 "[ . 1 . 2]" 1
1546 1 47 VAL MG2 1 74 ILE HG13 . . 4.030 4.080 3.774 4.349 0.319 1 0 "[ . 1 . 2]" 1
1547 1 47 VAL MG2 1 103 PHE HA . . 5.500 5.505 5.285 5.873 0.373 20 0 "[ . 1 . 2]" 1
1548 1 47 VAL MG2 1 103 PHE QD . . 4.290 2.703 2.462 3.078 . 0 0 "[ . 1 . 2]" 1
1549 1 48 GLN H 1 48 GLN HB3 . . 3.460 2.581 2.501 2.676 . 0 0 "[ . 1 . 2]" 1
1550 1 48 GLN H 1 48 GLN QE . . 5.500 3.706 3.401 4.711 . 0 0 "[ . 1 . 2]" 1
1551 1 48 GLN H 1 48 GLN QG . . 3.290 2.287 2.119 2.407 . 0 0 "[ . 1 . 2]" 1
1552 1 48 GLN H 1 49 ALA H . . 3.350 2.633 2.501 2.831 . 0 0 "[ . 1 . 2]" 1
1553 1 48 GLN H 1 49 ALA HA . . 5.490 5.284 5.154 5.442 . 0 0 "[ . 1 . 2]" 1
1554 1 48 GLN H 1 49 ALA MB . . 4.690 4.349 4.258 4.533 . 0 0 "[ . 1 . 2]" 1
1555 1 48 GLN H 1 50 CYS H . . 4.460 4.099 3.784 4.571 0.111 8 0 "[ . 1 . 2]" 1
1556 1 48 GLN H 1 51 VAL QG . . 4.610 4.319 3.891 4.643 0.033 14 0 "[ . 1 . 2]" 1
1557 1 48 GLN H 1 74 ILE MD . . 3.220 2.386 2.089 2.578 . 0 0 "[ . 1 . 2]" 1
1558 1 48 GLN H 1 74 ILE HG13 . . 5.280 4.668 4.283 4.954 . 0 0 "[ . 1 . 2]" 1
1559 1 48 GLN H 1 74 ILE MG . . 3.890 3.525 3.371 3.722 . 0 0 "[ . 1 . 2]" 1
1560 1 48 GLN HA 1 49 ALA HA . . 5.340 4.821 4.743 4.853 . 0 0 "[ . 1 . 2]" 1
1561 1 48 GLN HA 1 50 CYS H . . 4.500 4.258 3.886 4.819 0.319 8 0 "[ . 1 . 2]" 1
1562 1 48 GLN HA 1 51 VAL H . . 4.020 3.413 2.911 3.905 . 0 0 "[ . 1 . 2]" 1
1563 1 48 GLN HA 1 51 VAL HB . . 3.390 3.080 2.218 3.434 0.044 18 0 "[ . 1 . 2]" 1
1564 1 48 GLN HA 1 51 VAL MG1 . . 5.060 4.492 3.757 4.768 . 0 0 "[ . 1 . 2]" 1
1565 1 48 GLN HA 1 51 VAL QG . . 3.600 2.923 2.440 3.352 . 0 0 "[ . 1 . 2]" 1
1566 1 48 GLN HA 1 51 VAL MG2 . . 5.060 2.968 2.457 3.431 . 0 0 "[ . 1 . 2]" 1
1567 1 48 GLN HA 1 52 ASP H . . 4.190 3.825 3.536 4.062 . 0 0 "[ . 1 . 2]" 1
1568 1 48 GLN HA 1 64 LEU QD . . 4.830 4.365 4.032 4.822 . 0 0 "[ . 1 . 2]" 1
1569 1 48 GLN HA 1 74 ILE MD . . 3.150 2.988 2.799 3.361 0.211 17 0 "[ . 1 . 2]" 1
1570 1 48 GLN HA 1 74 ILE HG13 . . 4.620 4.595 4.341 4.965 0.345 17 0 "[ . 1 . 2]" 1
1571 1 48 GLN HA 1 74 ILE MG . . 3.590 1.956 1.772 2.314 . 0 0 "[ . 1 . 2]" 1
1572 1 48 GLN HA 1 75 THR H . . 4.870 3.834 3.270 4.401 . 0 0 "[ . 1 . 2]" 1
1573 1 48 GLN HB2 1 49 ALA H . . 5.130 4.029 3.910 4.186 . 0 0 "[ . 1 . 2]" 1
1574 1 48 GLN HB2 1 49 ALA HA . . 5.240 4.846 4.757 4.957 . 0 0 "[ . 1 . 2]" 1
1575 1 48 GLN HB2 1 74 ILE HA . . 4.760 3.327 3.005 3.657 . 0 0 "[ . 1 . 2]" 1
1576 1 48 GLN HB2 1 74 ILE MD . . 3.570 3.509 3.337 3.673 0.103 17 0 "[ . 1 . 2]" 1
1577 1 48 GLN HB2 1 74 ILE MG . . 4.270 2.986 2.678 3.317 . 0 0 "[ . 1 . 2]" 1
1578 1 48 GLN HB2 1 75 THR H . . 4.410 2.491 1.934 3.143 . 0 0 "[ . 1 . 2]" 1
1579 1 48 GLN HB3 1 49 ALA H . . 3.930 4.069 3.991 4.223 0.293 17 0 "[ . 1 . 2]" 1
1580 1 48 GLN HB3 1 74 ILE H . . 5.500 5.335 5.058 5.809 0.309 3 0 "[ . 1 . 2]" 1
1581 1 48 GLN HB3 1 74 ILE MD . . 3.740 2.096 1.865 2.328 . 0 0 "[ . 1 . 2]" 1
1582 1 48 GLN HB3 1 74 ILE MG . . 3.830 2.490 2.015 2.931 . 0 0 "[ . 1 . 2]" 1
1583 1 48 GLN HB3 1 75 THR H . . 4.920 2.932 2.521 3.627 . 0 0 "[ . 1 . 2]" 1
1584 1 48 GLN QE 1 49 ALA H . . 5.270 4.996 4.778 5.289 0.019 17 0 "[ . 1 . 2]" 1
1585 1 48 GLN QE 1 73 VAL H . . 5.500 4.317 3.851 5.705 0.205 2 0 "[ . 1 . 2]" 1
1586 1 48 GLN QE 1 75 THR H . . 5.330 3.378 2.512 5.309 . 0 0 "[ . 1 . 2]" 1
1587 1 48 GLN QG 1 49 ALA H . . 3.390 2.438 2.304 2.721 . 0 0 "[ . 1 . 2]" 1
1588 1 48 GLN QG 1 49 ALA HA . . 4.240 3.551 3.368 3.853 . 0 0 "[ . 1 . 2]" 1
1589 1 48 GLN QG 1 49 ALA MB . . 4.080 3.313 3.115 3.610 . 0 0 "[ . 1 . 2]" 1
1590 1 48 GLN QG 1 74 ILE MD . . 5.030 3.393 3.063 3.721 . 0 0 "[ . 1 . 2]" 1
1591 1 48 GLN QG 1 75 THR H . . 5.500 4.325 3.855 5.064 . 0 0 "[ . 1 . 2]" 1
1592 1 49 ALA H 1 49 ALA MB . . 2.700 2.278 2.256 2.316 . 0 0 "[ . 1 . 2]" 1
1593 1 49 ALA H 1 50 CYS H . . 3.200 2.554 2.366 2.695 . 0 0 "[ . 1 . 2]" 1
1594 1 49 ALA H 1 50 CYS HA . . 5.420 5.203 5.047 5.286 . 0 0 "[ . 1 . 2]" 1
1595 1 49 ALA H 1 50 CYS QB . . 4.520 4.550 4.210 4.706 0.186 8 0 "[ . 1 . 2]" 1
1596 1 49 ALA H 1 51 VAL H . . 4.570 4.255 3.943 4.424 . 0 0 "[ . 1 . 2]" 1
1597 1 49 ALA H 1 51 VAL QG . . 4.900 4.812 4.451 5.029 0.129 20 0 "[ . 1 . 2]" 1
1598 1 49 ALA H 1 52 ASP H . . 4.990 4.855 4.470 5.038 0.048 20 0 "[ . 1 . 2]" 1
1599 1 49 ALA H 1 52 ASP QB . . 5.200 4.840 4.332 5.118 . 0 0 "[ . 1 . 2]" 1
1600 1 49 ALA H 1 74 ILE MD . . 4.650 4.569 4.382 4.779 0.129 17 0 "[ . 1 . 2]" 1
1601 1 49 ALA HA 1 50 CYS HA . . 5.000 4.818 4.737 4.863 . 0 0 "[ . 1 . 2]" 1
1602 1 49 ALA HA 1 51 VAL H . . 5.250 4.733 4.444 4.966 . 0 0 "[ . 1 . 2]" 1
1603 1 49 ALA HA 1 52 ASP H . . 3.920 3.914 3.261 4.273 0.353 20 0 "[ . 1 . 2]" 1
1604 1 49 ALA HA 1 52 ASP HB2 . . 4.080 4.127 3.076 4.945 0.865 20 4 "[ * . - 1 * . +]" 1
1605 1 49 ALA HA 1 52 ASP QB . . 3.340 2.941 2.052 3.484 0.144 20 0 "[ . 1 . 2]" 1
1606 1 49 ALA HA 1 52 ASP HB3 . . 4.080 3.012 2.084 3.561 . 0 0 "[ . 1 . 2]" 1
1607 1 49 ALA HA 1 53 CYS H . . 5.050 4.084 3.771 4.352 . 0 0 "[ . 1 . 2]" 1
1608 1 49 ALA MB 1 50 CYS H . . 3.060 2.613 2.289 3.020 . 0 0 "[ . 1 . 2]" 1
1609 1 49 ALA MB 1 50 CYS HA . . 3.980 3.883 3.659 4.135 0.155 20 0 "[ . 1 . 2]" 1
1610 1 49 ALA MB 1 50 CYS QB . . 4.590 4.306 3.776 4.645 0.055 20 0 "[ . 1 . 2]" 1
1611 1 49 ALA MB 1 51 VAL H . . 5.070 4.751 4.517 5.079 0.009 20 0 "[ . 1 . 2]" 1
1612 1 49 ALA MB 1 52 ASP H . . 5.170 4.956 4.478 5.382 0.212 20 0 "[ . 1 . 2]" 1
1613 1 49 ALA MB 1 52 ASP QB . . 5.280 4.305 3.513 4.829 . 0 0 "[ . 1 . 2]" 1
1614 1 50 CYS H 1 50 CYS HB2 . . 3.650 2.470 2.439 2.565 . 0 0 "[ . 1 . 2]" 1
1615 1 50 CYS H 1 50 CYS QB . . 2.950 2.416 2.236 2.463 . 0 0 "[ . 1 . 2]" 1
1616 1 50 CYS H 1 50 CYS HB3 . . 3.650 3.543 2.462 3.635 . 0 0 "[ . 1 . 2]" 1
1617 1 50 CYS H 1 51 VAL QG . . 4.120 3.971 3.811 4.116 . 0 0 "[ . 1 . 2]" 1
1618 1 50 CYS H 1 52 ASP H . . 4.170 4.178 3.801 4.447 0.277 13 0 "[ . 1 . 2]" 1
1619 1 50 CYS H 1 53 CYS H . . 4.930 4.674 4.592 4.802 . 0 0 "[ . 1 . 2]" 1
1620 1 50 CYS H 1 103 PHE HZ . . 5.230 5.582 4.083 6.049 0.819 15 8 "[* **. 1*- + * *2]" 1
1621 1 50 CYS H 1 107 LEU QD . . 5.440 5.060 4.639 5.847 0.407 20 0 "[ . 1 . 2]" 1
1622 1 50 CYS HA 1 51 VAL QG . . 5.100 4.801 4.727 4.897 . 0 0 "[ . 1 . 2]" 1
1623 1 50 CYS HA 1 52 ASP H . . 4.630 4.636 4.303 5.006 0.376 20 0 "[ . 1 . 2]" 1
1624 1 50 CYS HA 1 53 CYS H . . 3.740 3.669 3.340 4.113 0.373 20 0 "[ . 1 . 2]" 1
1625 1 50 CYS HA 1 53 CYS QB . . 3.570 3.088 2.431 3.969 0.399 11 0 "[ . 1 . 2]" 1
1626 1 50 CYS HA 1 54 ALA H . . 5.030 4.712 4.405 5.067 0.037 20 0 "[ . 1 . 2]" 1
1627 1 50 CYS HA 1 54 ALA MB . . 4.460 4.476 4.352 4.812 0.352 14 0 "[ . 1 . 2]" 1
1628 1 50 CYS HA 1 107 LEU QD . . 4.760 4.233 3.756 5.070 0.310 20 0 "[ . 1 . 2]" 1
1629 1 50 CYS QB 1 51 VAL H . . 3.130 2.551 2.277 2.883 . 0 0 "[ . 1 . 2]" 1
1630 1 50 CYS QB 1 103 PHE HZ . . 4.340 3.339 2.348 3.776 . 0 0 "[ . 1 . 2]" 1
1631 1 50 CYS QB 1 107 LEU QD . . 3.560 2.372 1.949 3.536 . 0 0 "[ . 1 . 2]" 1
1632 1 50 CYS HB2 1 51 VAL H . . 3.600 2.675 2.317 3.969 0.369 18 0 "[ . 1 . 2]" 1
1633 1 50 CYS HB2 1 103 PHE HZ . . 4.940 3.652 2.396 5.083 0.143 18 0 "[ . 1 . 2]" 1
1634 1 50 CYS HB3 1 51 VAL H . . 3.600 3.545 2.665 3.879 0.279 8 0 "[ . 1 . 2]" 1
1635 1 50 CYS HB3 1 103 PHE HZ . . 4.940 3.990 3.373 4.480 . 0 0 "[ . 1 . 2]" 1
1636 1 51 VAL H 1 51 VAL HB . . 3.130 2.744 2.550 2.914 . 0 0 "[ . 1 . 2]" 1
1637 1 51 VAL H 1 51 VAL MG1 . . 3.990 3.846 3.795 3.899 . 0 0 "[ . 1 . 2]" 1
1638 1 51 VAL H 1 51 VAL QG . . 2.870 2.024 1.894 2.163 . 0 0 "[ . 1 . 2]" 1
1639 1 51 VAL H 1 51 VAL MG2 . . 3.990 2.031 1.899 2.173 . 0 0 "[ . 1 . 2]" 1
1640 1 51 VAL H 1 52 ASP H . . 3.190 2.640 2.522 2.767 . 0 0 "[ . 1 . 2]" 1
1641 1 51 VAL H 1 52 ASP HA . . 5.500 5.289 5.170 5.405 . 0 0 "[ . 1 . 2]" 1
1642 1 51 VAL H 1 52 ASP HB2 . . 5.500 5.055 4.831 5.294 . 0 0 "[ . 1 . 2]" 1
1643 1 51 VAL H 1 52 ASP QB . . 4.700 4.388 4.211 4.541 . 0 0 "[ . 1 . 2]" 1
1644 1 51 VAL H 1 52 ASP HB3 . . 5.500 4.825 4.565 5.009 . 0 0 "[ . 1 . 2]" 1
1645 1 51 VAL H 1 53 CYS H . . 4.220 4.075 3.788 4.296 0.076 5 0 "[ . 1 . 2]" 1
1646 1 51 VAL H 1 54 ALA H . . 4.960 4.924 4.665 5.144 0.184 20 0 "[ . 1 . 2]" 1
1647 1 51 VAL H 1 54 ALA MB . . 4.530 4.365 4.232 4.538 0.008 12 0 "[ . 1 . 2]" 1
1648 1 51 VAL H 1 60 VAL QG . . 4.660 4.109 3.708 4.531 . 0 0 "[ . 1 . 2]" 1
1649 1 51 VAL H 1 64 LEU MD1 . . 5.500 5.465 4.780 6.062 0.562 18 4 "[ * . 1- .* + 2]" 1
1650 1 51 VAL H 1 64 LEU QD . . 4.820 4.679 4.478 4.980 0.160 17 0 "[ . 1 . 2]" 1
1651 1 51 VAL H 1 64 LEU MD2 . . 5.500 5.198 4.640 6.080 0.580 4 1 "[ +. 1 . 2]" 1
1652 1 51 VAL H 1 74 ILE MD . . 5.500 5.428 5.258 5.778 0.278 8 0 "[ . 1 . 2]" 1
1653 1 51 VAL H 1 74 ILE MG . . 4.670 4.270 4.042 4.571 . 0 0 "[ . 1 . 2]" 1
1654 1 51 VAL H 1 103 PHE HZ . . 5.160 3.767 2.755 4.145 . 0 0 "[ . 1 . 2]" 1
1655 1 51 VAL HA 1 51 VAL MG1 . . 2.970 2.393 2.326 2.475 . 0 0 "[ . 1 . 2]" 1
1656 1 51 VAL HA 1 51 VAL MG2 . . 2.970 2.571 2.473 2.671 . 0 0 "[ . 1 . 2]" 1
1657 1 51 VAL HA 1 52 ASP HA . . 4.830 4.833 4.755 4.945 0.115 7 0 "[ . 1 . 2]" 1
1658 1 51 VAL HA 1 53 CYS H . . 4.440 4.452 4.197 4.743 0.303 10 0 "[ . 1 . 2]" 1
1659 1 51 VAL HA 1 54 ALA H . . 3.540 3.667 3.411 3.882 0.342 20 0 "[ . 1 . 2]" 1
1660 1 51 VAL HA 1 54 ALA HA . . 4.970 4.913 4.545 5.216 0.246 12 0 "[ . 1 . 2]" 1
1661 1 51 VAL HA 1 54 ALA MB . . 2.990 2.416 2.145 2.657 . 0 0 "[ . 1 . 2]" 1
1662 1 51 VAL HA 1 60 VAL HB . . 4.640 3.683 3.412 4.216 . 0 0 "[ . 1 . 2]" 1
1663 1 51 VAL HA 1 60 VAL QG . . 2.880 2.134 1.844 2.660 . 0 0 "[ . 1 . 2]" 1
1664 1 51 VAL HA 1 61 PHE H . . 5.500 5.663 5.420 6.007 0.507 17 1 "[ . 1 . + 2]" 1
1665 1 51 VAL HA 1 74 ILE MG . . 5.500 5.256 4.901 5.587 0.087 14 0 "[ . 1 . 2]" 1
1666 1 51 VAL HA 1 76 ALA MB . . 4.960 4.652 4.331 5.008 0.048 3 0 "[ . 1 . 2]" 1
1667 1 51 VAL HA 1 103 PHE HZ . . 4.690 3.500 2.819 4.541 . 0 0 "[ . 1 . 2]" 1
1668 1 51 VAL HB 1 52 ASP H . . 3.240 2.629 2.441 2.927 . 0 0 "[ . 1 . 2]" 1
1669 1 51 VAL HB 1 52 ASP HA . . 4.260 4.190 4.004 4.493 0.233 14 0 "[ . 1 . 2]" 1
1670 1 51 VAL HB 1 53 CYS H . . 4.870 5.059 4.796 5.250 0.380 17 0 "[ . 1 . 2]" 1
1671 1 51 VAL HB 1 54 ALA H . . 5.320 5.442 5.230 5.610 0.290 20 0 "[ . 1 . 2]" 1
1672 1 51 VAL HB 1 61 PHE HA . . 5.500 5.327 4.818 6.100 0.600 17 3 "[ *-. 1 . + 2]" 1
1673 1 51 VAL HB 1 74 ILE MD . . 5.500 5.255 4.843 5.597 0.097 18 0 "[ . 1 . 2]" 1
1674 1 51 VAL HB 1 74 ILE MG . . 3.880 3.103 2.668 3.290 . 0 0 "[ . 1 . 2]" 1
1675 1 51 VAL HB 1 75 THR H . . 5.500 5.480 4.709 6.075 0.575 8 1 "[ . + 1 . 2]" 1
1676 1 51 VAL HB 1 76 ALA MB . . 4.390 2.920 2.239 4.086 . 0 0 "[ . 1 . 2]" 1
1677 1 51 VAL QG 1 52 ASP HA . . 3.800 3.709 3.471 4.045 0.245 11 0 "[ . 1 . 2]" 1
1678 1 51 VAL QG 1 52 ASP QB . . 5.280 4.168 3.881 4.342 . 0 0 "[ . 1 . 2]" 1
1679 1 51 VAL QG 1 53 CYS H . . 4.440 4.708 4.509 4.823 0.383 5 0 "[ . 1 . 2]" 1
1680 1 51 VAL QG 1 54 ALA H . . 4.320 4.386 4.256 4.501 0.181 19 0 "[ . 1 . 2]" 1
1681 1 51 VAL QG 1 57 THR H . . 5.440 5.464 5.286 5.722 0.282 19 0 "[ . 1 . 2]" 1
1682 1 51 VAL QG 1 57 THR HA . . 4.080 3.461 3.234 3.858 . 0 0 "[ . 1 . 2]" 1
1683 1 51 VAL QG 1 57 THR HB . . 4.930 4.463 4.358 4.678 . 0 0 "[ . 1 . 2]" 1
1684 1 51 VAL QG 1 57 THR MG . . 2.950 1.864 1.713 2.071 . 0 0 "[ . 1 . 2]" 1
1685 1 51 VAL QG 1 60 VAL HA . . 5.270 4.356 4.016 5.134 . 0 0 "[ . 1 . 2]" 1
1686 1 51 VAL QG 1 60 VAL HB . . 3.700 2.902 2.384 3.711 0.011 17 0 "[ . 1 . 2]" 1
1687 1 51 VAL QG 1 60 VAL QG . . 2.760 2.011 1.796 2.530 . 0 0 "[ . 1 . 2]" 1
1688 1 51 VAL QG 1 61 PHE H . . 3.660 3.369 3.089 4.078 0.418 17 0 "[ . 1 . 2]" 1
1689 1 51 VAL QG 1 61 PHE HA . . 3.230 2.631 2.209 3.163 . 0 0 "[ . 1 . 2]" 1
1690 1 51 VAL QG 1 61 PHE HB2 . . 3.800 2.718 2.410 3.234 . 0 0 "[ . 1 . 2]" 1
1691 1 51 VAL QG 1 62 GLY H . . 5.390 4.819 4.447 5.414 0.024 17 0 "[ . 1 . 2]" 1
1692 1 51 VAL QG 1 63 TYR H . . 5.440 4.864 4.325 5.337 . 0 0 "[ . 1 . 2]" 1
1693 1 51 VAL QG 1 64 LEU QD . . 2.970 1.963 1.780 2.271 . 0 0 "[ . 1 . 2]" 1
1694 1 51 VAL QG 1 74 ILE HA . . 5.430 5.073 4.692 5.491 0.061 8 0 "[ . 1 . 2]" 1
1695 1 51 VAL QG 1 74 ILE MG . . 2.820 2.171 1.891 2.618 . 0 0 "[ . 1 . 2]" 1
1696 1 51 VAL QG 1 75 THR HA . . 5.330 5.334 4.746 5.714 0.384 8 0 "[ . 1 . 2]" 1
1697 1 51 VAL QG 1 76 ALA HA . . 3.700 3.434 2.087 4.351 0.651 2 1 "[ + . 1 . 2]" 1
1698 1 51 VAL QG 1 76 ALA MB . . 2.960 1.992 1.869 2.190 . 0 0 "[ . 1 . 2]" 1
1699 1 51 VAL QG 1 77 SER H . . 4.160 4.213 3.413 4.850 0.690 20 3 "[ . * - . +]" 1
1700 1 51 VAL QG 1 103 PHE QD . . 4.610 4.181 3.848 4.609 . 0 0 "[ . 1 . 2]" 1
1701 1 51 VAL QG 1 103 PHE HZ . . 3.830 1.823 1.712 2.074 . 0 0 "[ . 1 . 2]" 1
1702 1 51 VAL MG1 1 52 ASP H . . 3.930 3.675 3.497 3.906 . 0 0 "[ . 1 . 2]" 1
1703 1 51 VAL MG1 1 53 CYS H . . 5.130 5.215 4.959 5.369 0.239 11 0 "[ . 1 . 2]" 1
1704 1 51 VAL MG1 1 54 ALA MB . . 3.720 3.400 3.213 3.632 . 0 0 "[ . 1 . 2]" 1
1705 1 51 VAL MG1 1 60 VAL HB . . 4.300 2.952 2.396 3.903 . 0 0 "[ . 1 . 2]" 1
1706 1 51 VAL MG1 1 61 PHE H . . 5.150 3.430 3.118 4.262 . 0 0 "[ . 1 . 2]" 1
1707 1 51 VAL MG1 1 61 PHE HA . . 3.960 2.725 2.235 3.460 . 0 0 "[ . 1 . 2]" 1
1708 1 51 VAL MG1 1 61 PHE HB2 . . 4.890 2.737 2.425 3.272 . 0 0 "[ . 1 . 2]" 1
1709 1 51 VAL MG1 1 64 LEU MD1 . . 4.910 3.120 2.354 3.630 . 0 0 "[ . 1 . 2]" 1
1710 1 51 VAL MG1 1 64 LEU MD2 . . 4.910 3.324 2.645 4.448 . 0 0 "[ . 1 . 2]" 1
1711 1 51 VAL MG2 1 52 ASP H . . 3.930 3.716 3.554 3.934 0.004 14 0 "[ . 1 . 2]" 1
1712 1 51 VAL MG2 1 53 CYS H . . 5.130 5.365 5.124 5.559 0.429 5 0 "[ . 1 . 2]" 1
1713 1 51 VAL MG2 1 54 ALA MB . . 3.720 4.148 3.793 4.389 0.669 12 9 "[ * . *** +* * - *]" 1
1714 1 51 VAL MG2 1 60 VAL HB . . 4.300 4.441 4.044 4.832 0.532 6 1 "[ .+ 1 . 2]" 1
1715 1 51 VAL MG2 1 61 PHE H . . 5.150 5.048 4.577 5.396 0.246 6 0 "[ . 1 . 2]" 1
1716 1 51 VAL MG2 1 61 PHE HA . . 3.960 3.606 3.131 4.204 0.244 4 0 "[ . 1 . 2]" 1
1717 1 51 VAL MG2 1 61 PHE HB2 . . 4.890 4.695 4.119 5.063 0.173 3 0 "[ . 1 . 2]" 1
1718 1 51 VAL MG2 1 64 LEU MD1 . . 4.910 2.368 1.854 2.836 . 0 0 "[ . 1 . 2]" 1
1719 1 51 VAL MG2 1 64 LEU MD2 . . 4.910 2.302 1.840 3.247 . 0 0 "[ . 1 . 2]" 1
1720 1 52 ASP H 1 52 ASP HB2 . . 3.190 2.575 2.480 2.733 . 0 0 "[ . 1 . 2]" 1
1721 1 52 ASP H 1 52 ASP HB3 . . 3.190 2.512 2.348 2.606 . 0 0 "[ . 1 . 2]" 1
1722 1 52 ASP H 1 53 CYS H . . 3.270 2.643 2.505 2.783 . 0 0 "[ . 1 . 2]" 1
1723 1 52 ASP H 1 53 CYS HA . . 5.430 5.314 5.208 5.420 . 0 0 "[ . 1 . 2]" 1
1724 1 52 ASP H 1 54 ALA H . . 4.200 3.935 3.815 4.108 . 0 0 "[ . 1 . 2]" 1
1725 1 52 ASP H 1 54 ALA MB . . 4.650 4.461 4.334 4.614 . 0 0 "[ . 1 . 2]" 1
1726 1 52 ASP H 1 60 VAL QG . . 5.320 4.999 4.751 5.459 0.139 17 0 "[ . 1 . 2]" 1
1727 1 52 ASP H 1 74 ILE MG . . 5.500 4.719 4.394 5.141 . 0 0 "[ . 1 . 2]" 1
1728 1 52 ASP HA 1 53 CYS HA . . 4.650 4.746 4.715 4.795 0.145 5 0 "[ . 1 . 2]" 1
1729 1 52 ASP HA 1 54 ALA H . . 4.050 3.832 3.631 4.041 . 0 0 "[ . 1 . 2]" 1
1730 1 52 ASP HA 1 54 ALA MB . . 5.230 4.561 4.406 4.787 . 0 0 "[ . 1 . 2]" 1
1731 1 52 ASP HA 1 57 THR MG . . 5.500 3.114 2.282 4.019 . 0 0 "[ . 1 . 2]" 1
1732 1 52 ASP HA 1 76 ALA MB . . 4.370 3.922 2.714 5.210 0.840 19 3 "[ *-. 1 . +2]" 1
1733 1 52 ASP QB 1 53 CYS H . . 4.000 2.673 2.398 3.058 . 0 0 "[ . 1 . 2]" 1
1734 1 52 ASP HB2 1 53 CYS H . . 4.790 3.955 3.809 4.128 . 0 0 "[ . 1 . 2]" 1
1735 1 52 ASP HB3 1 53 CYS H . . 4.790 2.719 2.423 3.152 . 0 0 "[ . 1 . 2]" 1
1736 1 53 CYS H 1 53 CYS QB . . 3.070 2.452 2.366 2.656 . 0 0 "[ . 1 . 2]" 1
1737 1 53 CYS H 1 54 ALA H . . 2.950 2.546 2.425 2.657 . 0 0 "[ . 1 . 2]" 1
1738 1 53 CYS H 1 54 ALA HA . . 4.580 4.854 4.656 5.018 0.438 10 0 "[ . 1 . 2]" 1
1739 1 53 CYS H 1 54 ALA MB . . 3.740 4.028 3.823 4.203 0.463 10 0 "[ . 1 . 2]" 1
1740 1 53 CYS HA 1 54 ALA H . . 3.550 3.256 3.098 3.366 . 0 0 "[ . 1 . 2]" 1
1741 1 53 CYS HA 1 54 ALA MB . . 5.020 4.869 4.760 4.940 . 0 0 "[ . 1 . 2]" 1
1742 1 53 CYS QB 1 54 ALA H . . 3.850 3.535 3.274 3.852 0.002 11 0 "[ . 1 . 2]" 1
1743 1 53 CYS QB 1 54 ALA HA . . 4.670 4.214 3.854 4.631 . 0 0 "[ . 1 . 2]" 1
1744 1 53 CYS QB 1 54 ALA MB . . 5.290 4.460 4.230 4.941 . 0 0 "[ . 1 . 2]" 1
1745 1 53 CYS HB2 1 54 ALA H . . 4.540 3.769 3.418 4.347 . 0 0 "[ . 1 . 2]" 1
1746 1 53 CYS HB3 1 54 ALA H . . 4.540 4.323 4.172 4.472 . 0 0 "[ . 1 . 2]" 1
1747 1 54 ALA H 1 54 ALA MB . . 2.620 2.251 2.198 2.311 . 0 0 "[ . 1 . 2]" 1
1748 1 54 ALA H 1 55 LEU H . . 4.650 4.548 4.429 4.608 . 0 0 "[ . 1 . 2]" 1
1749 1 54 ALA H 1 57 THR HA . . 5.500 4.691 4.071 5.031 . 0 0 "[ . 1 . 2]" 1
1750 1 54 ALA H 1 60 VAL QG . . 3.870 4.083 3.958 4.192 0.322 6 0 "[ . 1 . 2]" 1
1751 1 54 ALA HA 1 55 LEU H . . 3.060 2.169 2.112 2.244 . 0 0 "[ . 1 . 2]" 1
1752 1 54 ALA HA 1 55 LEU HA . . 4.400 4.468 4.413 4.508 0.108 20 0 "[ . 1 . 2]" 1
1753 1 54 ALA HA 1 55 LEU QD . . 3.600 4.270 2.970 4.465 0.865 7 19 [****.*+***-*********] 1
1754 1 54 ALA HA 1 55 LEU HG . . 4.300 3.965 3.727 4.353 0.053 5 0 "[ . 1 . 2]" 1
1755 1 54 ALA HA 1 60 VAL QG . . 3.930 3.619 3.145 3.887 . 0 0 "[ . 1 . 2]" 1
1756 1 54 ALA HA 1 107 LEU QD . . 5.440 4.815 4.096 6.002 0.562 20 1 "[ . 1 . +]" 1
1757 1 54 ALA MB 1 55 LEU H . . 3.470 2.918 2.479 3.296 . 0 0 "[ . 1 . 2]" 1
1758 1 54 ALA MB 1 55 LEU QD . . 4.240 4.563 3.816 4.820 0.580 17 2 "[ - . 1 . + 2]" 1
1759 1 54 ALA MB 1 57 THR H . . 4.790 3.903 3.515 4.343 . 0 0 "[ . 1 . 2]" 1
1760 1 54 ALA MB 1 57 THR HA . . 3.760 2.391 2.109 2.672 . 0 0 "[ . 1 . 2]" 1
1761 1 54 ALA MB 1 60 VAL H . . 4.810 4.360 4.177 4.545 . 0 0 "[ . 1 . 2]" 1
1762 1 54 ALA MB 1 60 VAL HA . . 4.550 4.710 4.596 4.863 0.313 8 0 "[ . 1 . 2]" 1
1763 1 54 ALA MB 1 60 VAL HB . . 3.290 2.803 2.494 3.130 . 0 0 "[ . 1 . 2]" 1
1764 1 54 ALA MB 1 60 VAL QG . . 2.930 1.677 1.613 1.760 . 0 0 "[ . 1 . 2]" 1
1765 1 54 ALA MB 1 61 PHE H . . 5.240 5.102 4.802 5.307 0.067 18 0 "[ . 1 . 2]" 1
1766 1 55 LEU H 1 55 LEU HB2 . . 4.170 2.543 2.399 3.670 . 0 0 "[ . 1 . 2]" 1
1767 1 55 LEU H 1 55 LEU QB . . 3.440 2.463 2.363 2.892 . 0 0 "[ . 1 . 2]" 1
1768 1 55 LEU H 1 55 LEU HB3 . . 4.170 3.560 3.027 3.680 . 0 0 "[ . 1 . 2]" 1
1769 1 55 LEU H 1 55 LEU MD1 . . 3.790 3.480 1.803 3.782 . 0 0 "[ . 1 . 2]" 1
1770 1 55 LEU H 1 55 LEU QD . . 3.150 3.020 1.801 3.223 0.073 2 0 "[ . 1 . 2]" 1
1771 1 55 LEU H 1 55 LEU MD2 . . 3.790 3.432 3.207 4.102 0.312 5 0 "[ . 1 . 2]" 1
1772 1 55 LEU H 1 55 LEU HG . . 3.650 2.321 1.997 2.987 . 0 0 "[ . 1 . 2]" 1
1773 1 55 LEU H 1 60 VAL QG . . 4.320 3.908 3.328 4.304 . 0 0 "[ . 1 . 2]" 1
1774 1 55 LEU HA 1 55 LEU MD1 . . 4.500 3.939 3.606 3.991 . 0 0 "[ . 1 . 2]" 1
1775 1 55 LEU HA 1 55 LEU QD . . 3.680 2.254 2.050 3.509 . 0 0 "[ . 1 . 2]" 1
1776 1 55 LEU HA 1 55 LEU MD2 . . 4.500 2.314 2.057 4.148 . 0 0 "[ . 1 . 2]" 1
1777 1 55 LEU HA 1 55 LEU HG . . 3.830 3.171 2.754 3.775 . 0 0 "[ . 1 . 2]" 1
1778 1 55 LEU HA 1 56 GLU HA . . 4.510 4.387 4.350 4.418 . 0 0 "[ . 1 . 2]" 1
1779 1 55 LEU HA 1 56 GLU QB . . 5.180 4.295 4.226 4.386 . 0 0 "[ . 1 . 2]" 1
1780 1 55 LEU HA 1 57 THR H . . 5.500 4.238 3.890 4.801 . 0 0 "[ . 1 . 2]" 1
1781 1 55 LEU QB 1 55 LEU QD . . 2.480 1.994 1.954 2.021 . 0 0 "[ . 1 . 2]" 1
1782 1 55 LEU QB 1 56 GLU HA . . 5.340 4.888 4.733 4.992 . 0 0 "[ . 1 . 2]" 1
1783 1 55 LEU HB2 1 55 LEU MD1 . . 3.320 2.359 2.287 2.434 . 0 0 "[ . 1 . 2]" 1
1784 1 55 LEU HB2 1 55 LEU MD2 . . 3.320 3.193 2.571 3.259 . 0 0 "[ . 1 . 2]" 1
1785 1 55 LEU HB3 1 55 LEU MD1 . . 3.320 2.563 2.414 3.258 . 0 0 "[ . 1 . 2]" 1
1786 1 55 LEU HB3 1 55 LEU MD2 . . 3.320 2.409 2.250 2.511 . 0 0 "[ . 1 . 2]" 1
1787 1 55 LEU QD 1 56 GLU QB . . 5.440 4.559 3.082 4.783 . 0 0 "[ . 1 . 2]" 1
1788 1 56 GLU HA 1 56 GLU HG2 . . 3.490 3.146 3.068 3.203 . 0 0 "[ . 1 . 2]" 1
1789 1 56 GLU HA 1 56 GLU HG3 . . 3.260 2.569 2.482 2.695 . 0 0 "[ . 1 . 2]" 1
1790 1 56 GLU HA 1 57 THR H . . 3.170 2.417 2.280 2.555 . 0 0 "[ . 1 . 2]" 1
1791 1 56 GLU HA 1 57 THR HA . . 4.870 4.676 4.546 4.758 . 0 0 "[ . 1 . 2]" 1
1792 1 56 GLU HA 1 57 THR HB . . 4.700 4.594 4.488 4.795 0.095 6 0 "[ . 1 . 2]" 1
1793 1 56 GLU HA 1 58 LYS H . . 3.890 3.512 3.291 3.849 . 0 0 "[ . 1 . 2]" 1
1794 1 56 GLU HA 1 58 LYS HB3 . . 5.160 5.295 4.910 6.022 0.862 2 2 "[ + . 1- . 2]" 1
1795 1 56 GLU HA 1 58 LYS QD . . 4.070 3.434 2.268 4.028 . 0 0 "[ . 1 . 2]" 1
1796 1 56 GLU HA 1 59 THR H . . 4.270 4.391 4.184 4.648 0.378 2 0 "[ . 1 . 2]" 1
1797 1 56 GLU HA 1 60 VAL H . . 5.320 5.489 5.311 5.717 0.397 19 0 "[ . 1 . 2]" 1
1798 1 56 GLU HA 1 60 VAL QG . . 5.100 4.820 4.597 5.164 0.064 19 0 "[ . 1 . 2]" 1
1799 1 56 GLU QB 1 57 THR H . . 4.510 4.042 4.021 4.062 . 0 0 "[ . 1 . 2]" 1
1800 1 56 GLU QB 1 58 LYS H . . 5.180 4.826 4.674 5.025 . 0 0 "[ . 1 . 2]" 1
1801 1 56 GLU QB 1 59 THR H . . 3.920 4.118 4.014 4.247 0.327 4 0 "[ . 1 . 2]" 1
1802 1 56 GLU QB 1 59 THR HB . . 4.100 3.462 3.289 3.650 . 0 0 "[ . 1 . 2]" 1
1803 1 56 GLU QB 1 59 THR MG . . 4.410 4.458 4.254 4.660 0.250 4 0 "[ . 1 . 2]" 1
1804 1 56 GLU QB 1 60 VAL H . . 4.150 4.573 4.387 4.862 0.712 19 5 "[ * . 1* .- *+2]" 1
1805 1 56 GLU HG2 1 57 THR H . . 5.500 4.602 4.336 4.721 . 0 0 "[ . 1 . 2]" 1
1806 1 56 GLU HG2 1 58 LYS H . . 4.250 3.991 3.701 4.341 0.091 12 0 "[ . 1 . 2]" 1
1807 1 56 GLU HG2 1 58 LYS HA . . 5.500 5.698 5.402 5.906 0.406 12 0 "[ . 1 . 2]" 1
1808 1 56 GLU HG2 1 59 THR H . . 3.360 2.586 2.324 2.826 . 0 0 "[ . 1 . 2]" 1
1809 1 56 GLU HG2 1 59 THR HA . . 4.940 4.598 4.475 4.870 . 0 0 "[ . 1 . 2]" 1
1810 1 56 GLU HG2 1 59 THR HB . . 4.780 2.621 2.220 3.022 . 0 0 "[ . 1 . 2]" 1
1811 1 56 GLU HG2 1 59 THR MG . . 4.190 3.970 3.717 4.201 0.011 2 0 "[ . 1 . 2]" 1
1812 1 56 GLU HG2 1 60 VAL H . . 4.310 4.115 3.759 4.534 0.224 19 0 "[ . 1 . 2]" 1
1813 1 56 GLU HG3 1 57 THR H . . 5.450 4.678 4.376 4.984 . 0 0 "[ . 1 . 2]" 1
1814 1 56 GLU HG3 1 58 LYS H . . 4.460 4.362 4.052 4.864 0.404 4 0 "[ . 1 . 2]" 1
1815 1 56 GLU HG3 1 59 THR HB . . 4.480 4.357 3.844 4.758 0.278 19 0 "[ . 1 . 2]" 1
1816 1 56 GLU HG3 1 60 VAL H . . 5.500 5.697 5.453 5.997 0.497 19 0 "[ . 1 . 2]" 1
1817 1 57 THR H 1 57 THR HB . . 3.900 2.502 2.414 2.617 . 0 0 "[ . 1 . 2]" 1
1818 1 57 THR H 1 57 THR MG . . 3.960 3.760 3.743 3.802 . 0 0 "[ . 1 . 2]" 1
1819 1 57 THR H 1 58 LYS H . . 3.790 2.789 2.701 2.864 . 0 0 "[ . 1 . 2]" 1
1820 1 57 THR H 1 58 LYS QD . . 4.080 4.334 3.127 4.733 0.653 20 6 "[ ** - 1 * .* +]" 1
1821 1 57 THR H 1 59 THR H . . 4.830 4.533 4.403 4.618 . 0 0 "[ . 1 . 2]" 1
1822 1 57 THR H 1 60 VAL H . . 5.430 4.951 4.806 5.091 . 0 0 "[ . 1 . 2]" 1
1823 1 57 THR H 1 60 VAL HB . . 5.500 4.851 4.652 4.988 . 0 0 "[ . 1 . 2]" 1
1824 1 57 THR H 1 61 PHE H . . 5.500 6.090 5.963 6.156 0.656 18 19 "[-**** ***********+**]" 1
1825 1 57 THR HA 1 57 THR MG . . 3.070 2.499 2.441 2.556 . 0 0 "[ . 1 . 2]" 1
1826 1 57 THR HA 1 58 LYS H . . 3.570 3.524 3.492 3.587 0.017 2 0 "[ . 1 . 2]" 1
1827 1 57 THR HA 1 58 LYS HA . . 5.500 4.940 4.900 4.997 . 0 0 "[ . 1 . 2]" 1
1828 1 57 THR HA 1 58 LYS HG2 . . 5.390 5.141 4.934 5.758 0.368 2 0 "[ . 1 . 2]" 1
1829 1 57 THR HA 1 60 VAL H . . 3.490 3.402 3.085 3.548 0.058 20 0 "[ . 1 . 2]" 1
1830 1 57 THR HA 1 60 VAL HB . . 4.120 2.269 2.025 2.385 . 0 0 "[ . 1 . 2]" 1
1831 1 57 THR HA 1 60 VAL QG . . 2.970 2.817 2.486 3.066 0.096 9 0 "[ . 1 . 2]" 1
1832 1 57 THR HA 1 61 PHE H . . 3.770 4.011 3.628 4.181 0.411 12 0 "[ . 1 . 2]" 1
1833 1 57 THR HA 1 61 PHE HA . . 5.490 5.888 5.604 6.077 0.587 4 5 "[ *+. * 1 . -*2]" 1
1834 1 57 THR HA 1 76 ALA MB . . 4.490 4.911 4.742 5.081 0.591 9 7 "[- *. +1 *. ***2]" 1
1835 1 57 THR HB 1 58 LYS H . . 3.170 2.726 2.451 3.011 . 0 0 "[ . 1 . 2]" 1
1836 1 57 THR HB 1 58 LYS HA . . 4.680 4.305 4.126 4.477 . 0 0 "[ . 1 . 2]" 1
1837 1 57 THR HB 1 58 LYS QD . . 4.300 4.771 3.872 5.012 0.712 19 17 "[* *** **** *-*****+*]" 1
1838 1 57 THR HB 1 59 THR H . . 5.180 5.240 5.088 5.334 0.154 6 0 "[ . 1 . 2]" 1
1839 1 57 THR HB 1 60 VAL QG . . 5.500 5.019 4.761 5.217 . 0 0 "[ . 1 . 2]" 1
1840 1 57 THR HB 1 76 ALA MB . . 4.210 4.488 4.207 4.900 0.690 18 2 "[ . - 1 . + 2]" 1
1841 1 57 THR HB 1 77 SER H . . 4.670 4.602 4.019 5.013 0.343 6 0 "[ . 1 . 2]" 1
1842 1 57 THR HB 1 78 PHE HA . . 4.240 4.124 3.554 4.567 0.327 14 0 "[ . 1 . 2]" 1
1843 1 57 THR HB 1 78 PHE HB2 . . 4.550 4.747 4.296 5.029 0.479 12 0 "[ . 1 . 2]" 1
1844 1 57 THR HB 1 78 PHE HD1 . . 4.600 5.057 4.791 5.156 0.556 12 7 "[*** . 1 + *.* -]" 1
1845 1 57 THR MG 1 58 LYS H . . 3.590 3.565 3.375 3.759 0.169 6 0 "[ . 1 . 2]" 1
1846 1 57 THR MG 1 58 LYS HA . . 3.720 3.631 3.404 3.826 0.106 1 0 "[ . 1 . 2]" 1
1847 1 57 THR MG 1 59 THR H . . 4.830 5.031 4.957 5.091 0.261 18 0 "[ . 1 . 2]" 1
1848 1 57 THR MG 1 60 VAL H . . 4.430 4.644 4.434 4.755 0.325 7 0 "[ . 1 . 2]" 1
1849 1 57 THR MG 1 60 VAL HA . . 5.500 5.891 5.631 6.030 0.530 7 4 "[ . + -1 *. * 2]" 1
1850 1 57 THR MG 1 60 VAL QG . . 3.310 3.612 3.418 3.750 0.440 20 0 "[ . 1 . 2]" 1
1851 1 57 THR MG 1 61 PHE H . . 4.000 3.848 3.559 3.974 . 0 0 "[ . 1 . 2]" 1
1852 1 57 THR MG 1 61 PHE HA . . 4.380 4.540 4.358 4.772 0.392 7 0 "[ . 1 . 2]" 1
1853 1 57 THR MG 1 61 PHE HB2 . . 4.180 2.830 2.610 3.251 . 0 0 "[ . 1 . 2]" 1
1854 1 57 THR MG 1 62 GLY H . . 5.190 5.836 5.520 6.056 0.866 18 17 "[*-*** ***1*******+ *]" 1
1855 1 57 THR MG 1 76 ALA H . . 5.040 5.105 4.722 5.379 0.339 1 0 "[ . 1 . 2]" 1
1856 1 57 THR MG 1 76 ALA HA . . 3.700 3.293 2.554 3.711 0.011 2 0 "[ . 1 . 2]" 1
1857 1 57 THR MG 1 76 ALA MB . . 2.780 2.151 1.887 2.447 . 0 0 "[ . 1 . 2]" 1
1858 1 57 THR MG 1 77 SER H . . 3.520 2.466 1.916 2.816 . 0 0 "[ . 1 . 2]" 1
1859 1 57 THR MG 1 78 PHE H . . 4.690 4.620 4.373 4.995 0.305 17 0 "[ . 1 . 2]" 1
1860 1 57 THR MG 1 78 PHE HB2 . . 4.050 3.592 3.138 4.004 . 0 0 "[ . 1 . 2]" 1
1861 1 57 THR MG 1 78 PHE HB3 . . 4.760 4.811 4.356 5.152 0.392 5 0 "[ . 1 . 2]" 1
1862 1 58 LYS H 1 58 LYS HB2 . . 3.640 3.576 3.535 3.688 0.048 2 0 "[ . 1 . 2]" 1
1863 1 58 LYS H 1 58 LYS HB3 . . 2.980 2.541 2.462 2.702 . 0 0 "[ . 1 . 2]" 1
1864 1 58 LYS H 1 58 LYS QD . . 3.680 2.944 1.752 3.402 . 0 0 "[ . 1 . 2]" 1
1865 1 58 LYS H 1 58 LYS QE . . 4.230 4.154 3.084 4.446 0.216 12 0 "[ . 1 . 2]" 1
1866 1 58 LYS H 1 58 LYS HG2 . . 3.420 2.213 1.927 2.983 . 0 0 "[ . 1 . 2]" 1
1867 1 58 LYS H 1 58 LYS HG3 . . 3.920 3.605 3.386 3.931 0.011 2 0 "[ . 1 . 2]" 1
1868 1 58 LYS H 1 59 THR H . . 3.300 2.862 2.748 2.986 . 0 0 "[ . 1 . 2]" 1
1869 1 58 LYS H 1 59 THR HA . . 5.500 5.490 5.412 5.579 0.079 7 0 "[ . 1 . 2]" 1
1870 1 58 LYS H 1 59 THR HB . . 5.120 5.118 4.905 5.286 0.166 4 0 "[ . 1 . 2]" 1
1871 1 58 LYS H 1 60 VAL H . . 4.290 4.157 3.942 4.321 0.031 17 0 "[ . 1 . 2]" 1
1872 1 58 LYS H 1 60 VAL HB . . 5.500 4.953 4.794 5.082 . 0 0 "[ . 1 . 2]" 1
1873 1 58 LYS H 1 61 PHE H . . 5.030 4.711 4.594 4.853 . 0 0 "[ . 1 . 2]" 1
1874 1 58 LYS H 1 78 PHE HA . . 5.020 4.570 3.778 5.178 0.158 6 0 "[ . 1 . 2]" 1
1875 1 58 LYS H 1 78 PHE HB2 . . 4.580 4.994 4.776 5.170 0.590 12 5 "[ -. * 1*+ . *]" 1
1876 1 58 LYS H 1 78 PHE HD1 . . 5.020 4.011 3.868 4.185 . 0 0 "[ . 1 . 2]" 1
1877 1 58 LYS HA 1 58 LYS QD . . 4.250 4.383 3.917 4.507 0.257 12 0 "[ . 1 . 2]" 1
1878 1 58 LYS HA 1 58 LYS QE . . 4.550 4.282 3.986 4.392 . 0 0 "[ . 1 . 2]" 1
1879 1 58 LYS HA 1 59 THR HA . . 5.500 4.773 4.735 4.839 . 0 0 "[ . 1 . 2]" 1
1880 1 58 LYS HA 1 60 VAL H . . 4.880 4.593 4.332 4.834 . 0 0 "[ . 1 . 2]" 1
1881 1 58 LYS HA 1 61 PHE H . . 4.610 3.751 3.509 4.121 . 0 0 "[ . 1 . 2]" 1
1882 1 58 LYS HA 1 61 PHE HB3 . . 5.100 3.018 2.586 3.458 . 0 0 "[ . 1 . 2]" 1
1883 1 58 LYS HA 1 62 GLY H . . 5.500 4.953 4.371 5.285 . 0 0 "[ . 1 . 2]" 1
1884 1 58 LYS HA 1 78 PHE HB3 . . 5.500 5.032 4.716 5.476 . 0 0 "[ . 1 . 2]" 1
1885 1 58 LYS HA 1 78 PHE HD1 . . 3.810 2.576 1.733 3.163 . 0 0 "[ . 1 . 2]" 1
1886 1 58 LYS HA 1 78 PHE HE1 . . 4.160 3.939 3.451 4.716 0.556 5 1 "[ + 1 . 2]" 1
1887 1 58 LYS HB2 1 58 LYS QD . . 3.910 3.314 3.140 3.577 . 0 0 "[ . 1 . 2]" 1
1888 1 58 LYS HB2 1 58 LYS QE . . 4.420 2.519 2.189 3.315 . 0 0 "[ . 1 . 2]" 1
1889 1 58 LYS HB2 1 59 THR H . . 4.020 3.765 3.659 3.906 . 0 0 "[ . 1 . 2]" 1
1890 1 58 LYS HB2 1 78 PHE HD1 . . 5.200 2.788 2.475 3.328 . 0 0 "[ . 1 . 2]" 1
1891 1 58 LYS HB3 1 58 LYS QD . . 3.870 2.500 2.413 2.752 . 0 0 "[ . 1 . 2]" 1
1892 1 58 LYS HB3 1 58 LYS QE . . 3.630 2.302 1.898 2.554 . 0 0 "[ . 1 . 2]" 1
1893 1 58 LYS HB3 1 59 THR H . . 5.050 4.063 3.968 4.126 . 0 0 "[ . 1 . 2]" 1
1894 1 58 LYS HB3 1 78 PHE HB2 . . 4.950 4.222 3.749 4.561 . 0 0 "[ . 1 . 2]" 1
1895 1 58 LYS HB3 1 78 PHE HD1 . . 5.110 2.109 1.818 2.566 . 0 0 "[ . 1 . 2]" 1
1896 1 58 LYS QD 1 59 THR H . . 3.980 4.006 3.178 4.340 0.360 4 0 "[ . 1 . 2]" 1
1897 1 58 LYS QD 1 78 PHE HD1 . . 4.370 4.192 3.588 4.789 0.419 12 0 "[ . 1 . 2]" 1
1898 1 58 LYS QE 1 58 LYS HG3 . . 3.650 2.520 2.417 2.572 . 0 0 "[ . 1 . 2]" 1
1899 1 58 LYS QE 1 59 THR H . . 5.500 4.863 4.713 5.030 . 0 0 "[ . 1 . 2]" 1
1900 1 58 LYS QE 1 78 PHE HA . . 4.460 4.759 3.432 4.986 0.526 9 2 "[ . +1 . - 2]" 1
1901 1 58 LYS QE 1 78 PHE HD1 . . 4.480 3.303 2.851 3.985 . 0 0 "[ . 1 . 2]" 1
1902 1 58 LYS QE 1 78 PHE HE1 . . 4.410 2.778 1.802 4.210 . 0 0 "[ . 1 . 2]" 1
1903 1 58 LYS QE 1 79 ASP H . . 5.500 4.202 2.858 4.944 . 0 0 "[ . 1 . 2]" 1
1904 1 58 LYS HG2 1 59 THR H . . 3.880 2.306 1.993 2.672 . 0 0 "[ . 1 . 2]" 1
1905 1 58 LYS HG2 1 59 THR HB . . 4.760 4.189 3.824 4.662 . 0 0 "[ . 1 . 2]" 1
1906 1 58 LYS HG2 1 60 VAL H . . 4.620 4.467 4.264 4.752 0.132 12 0 "[ . 1 . 2]" 1
1907 1 58 LYS HG3 1 59 THR H . . 4.060 2.963 2.587 3.882 . 0 0 "[ . 1 . 2]" 1
1908 1 58 LYS HG3 1 59 THR HA . . 5.130 4.213 3.867 5.143 0.013 6 0 "[ . 1 . 2]" 1
1909 1 59 THR H 1 59 THR HB . . 3.030 2.478 2.423 2.572 . 0 0 "[ . 1 . 2]" 1
1910 1 59 THR H 1 60 VAL H . . 3.120 2.330 2.283 2.402 . 0 0 "[ . 1 . 2]" 1
1911 1 59 THR H 1 60 VAL HA . . 4.750 5.034 4.983 5.092 0.342 19 0 "[ . 1 . 2]" 1
1912 1 59 THR H 1 60 VAL HB . . 3.890 4.412 4.224 4.557 0.667 18 13 "[ * .* * *****-* +**]" 1
1913 1 59 THR H 1 60 VAL QG . . 4.360 3.688 3.404 3.871 . 0 0 "[ . 1 . 2]" 1
1914 1 59 THR H 1 61 PHE H . . 4.110 3.795 3.652 3.966 . 0 0 "[ . 1 . 2]" 1
1915 1 59 THR H 1 61 PHE HB3 . . 5.500 5.077 4.774 5.462 . 0 0 "[ . 1 . 2]" 1
1916 1 59 THR H 1 62 GLY H . . 4.750 4.822 4.568 5.018 0.268 18 0 "[ . 1 . 2]" 1
1917 1 59 THR HA 1 59 THR MG . . 3.000 2.468 2.420 2.524 . 0 0 "[ . 1 . 2]" 1
1918 1 59 THR HA 1 61 PHE H . . 4.960 4.159 3.966 4.337 . 0 0 "[ . 1 . 2]" 1
1919 1 59 THR HA 1 62 GLY H . . 3.950 3.460 3.106 3.635 . 0 0 "[ . 1 . 2]" 1
1920 1 59 THR HB 1 60 VAL H . . 3.440 2.697 2.524 2.949 . 0 0 "[ . 1 . 2]" 1
1921 1 59 THR HB 1 60 VAL HA . . 4.620 4.390 4.233 4.531 . 0 0 "[ . 1 . 2]" 1
1922 1 59 THR HB 1 60 VAL QG . . 4.030 3.162 2.824 3.439 . 0 0 "[ . 1 . 2]" 1
1923 1 59 THR HB 1 61 PHE H . . 5.500 4.985 4.830 5.171 . 0 0 "[ . 1 . 2]" 1
1924 1 59 THR HB 1 62 GLY H . . 5.500 5.429 5.235 5.535 0.035 13 0 "[ . 1 . 2]" 1
1925 1 59 THR MG 1 60 VAL H . . 3.770 3.602 3.415 3.810 0.040 4 0 "[ . 1 . 2]" 1
1926 1 59 THR MG 1 60 VAL HA . . 3.760 3.744 3.468 4.104 0.344 4 0 "[ . 1 . 2]" 1
1927 1 59 THR MG 1 60 VAL QG . . 3.900 3.644 3.241 4.008 0.108 4 0 "[ . 1 . 2]" 1
1928 1 59 THR MG 1 62 GLY H . . 4.590 4.475 4.286 4.589 . 0 0 "[ . 1 . 2]" 1
1929 1 60 VAL H 1 60 VAL HB . . 3.650 2.449 2.288 2.560 . 0 0 "[ . 1 . 2]" 1
1930 1 60 VAL H 1 60 VAL QG . . 3.060 2.121 1.929 2.309 . 0 0 "[ . 1 . 2]" 1
1931 1 60 VAL H 1 61 PHE H . . 3.340 2.580 2.464 2.703 . 0 0 "[ . 1 . 2]" 1
1932 1 60 VAL H 1 61 PHE HA . . 5.340 5.260 5.157 5.352 0.012 5 0 "[ . 1 . 2]" 1
1933 1 60 VAL H 1 61 PHE HB2 . . 4.960 4.796 4.628 4.987 0.027 6 0 "[ . 1 . 2]" 1
1934 1 60 VAL H 1 62 GLY H . . 4.040 3.943 3.810 4.083 0.043 10 0 "[ . 1 . 2]" 1
1935 1 60 VAL HA 1 60 VAL QG . . 2.750 2.188 2.161 2.210 . 0 0 "[ . 1 . 2]" 1
1936 1 60 VAL HA 1 61 PHE HA . . 4.810 4.835 4.766 4.896 0.086 12 0 "[ . 1 . 2]" 1
1937 1 60 VAL HA 1 62 GLY H . . 4.330 3.885 3.713 4.091 . 0 0 "[ . 1 . 2]" 1
1938 1 60 VAL HA 1 63 TYR H . . 4.210 3.794 3.404 4.196 . 0 0 "[ . 1 . 2]" 1
1939 1 60 VAL HA 1 63 TYR QB . . 4.210 3.860 3.278 4.441 0.231 9 0 "[ . 1 . 2]" 1
1940 1 60 VAL HA 1 63 TYR QD . . 3.390 2.046 1.693 2.760 . 0 0 "[ . 1 . 2]" 1
1941 1 60 VAL HA 1 107 LEU QD . . 3.930 3.523 2.759 4.148 0.218 15 0 "[ . 1 . 2]" 1
1942 1 60 VAL HB 1 61 PHE H . . 4.250 2.882 2.685 3.007 . 0 0 "[ . 1 . 2]" 1
1943 1 60 VAL HB 1 61 PHE HA . . 5.090 4.542 4.303 4.704 . 0 0 "[ . 1 . 2]" 1
1944 1 60 VAL HB 1 62 GLY H . . 5.500 4.957 4.841 5.088 . 0 0 "[ . 1 . 2]" 1
1945 1 60 VAL HB 1 107 LEU QD . . 5.440 4.365 3.971 4.977 . 0 0 "[ . 1 . 2]" 1
1946 1 60 VAL QG 1 61 PHE H . . 3.160 3.341 3.194 3.408 0.248 20 0 "[ . 1 . 2]" 1
1947 1 60 VAL QG 1 61 PHE HA . . 3.680 3.638 3.361 3.952 0.272 16 0 "[ . 1 . 2]" 1
1948 1 60 VAL QG 1 61 PHE HB2 . . 5.060 4.311 3.903 4.636 . 0 0 "[ . 1 . 2]" 1
1949 1 60 VAL QG 1 61 PHE HB3 . . 4.560 5.021 4.858 5.151 0.591 2 6 "[ + . 1**- . * *]" 1
1950 1 60 VAL QG 1 62 GLY H . . 4.260 4.435 4.370 4.570 0.310 19 0 "[ . 1 . 2]" 1
1951 1 60 VAL QG 1 63 TYR H . . 4.840 4.341 4.147 4.531 . 0 0 "[ . 1 . 2]" 1
1952 1 60 VAL QG 1 63 TYR QB . . 5.210 3.756 3.366 4.201 . 0 0 "[ . 1 . 2]" 1
1953 1 60 VAL QG 1 63 TYR QD . . 4.170 3.254 2.745 3.825 . 0 0 "[ . 1 . 2]" 1
1954 1 60 VAL QG 1 107 LEU HA . . 5.440 4.348 3.848 5.255 . 0 0 "[ . 1 . 2]" 1
1955 1 60 VAL QG 1 107 LEU QD . . 3.290 2.012 1.753 2.573 . 0 0 "[ . 1 . 2]" 1
1956 1 61 PHE H 1 61 PHE HB2 . . 3.240 2.494 2.389 2.709 . 0 0 "[ . 1 . 2]" 1
1957 1 61 PHE H 1 61 PHE HB3 . . 3.450 2.537 2.399 2.695 . 0 0 "[ . 1 . 2]" 1
1958 1 61 PHE H 1 62 GLY H . . 3.310 2.468 2.361 2.620 . 0 0 "[ . 1 . 2]" 1
1959 1 61 PHE H 1 62 GLY QA . . 5.210 4.364 4.289 4.504 . 0 0 "[ . 1 . 2]" 1
1960 1 61 PHE H 1 63 TYR H . . 4.360 4.197 4.005 4.373 0.013 9 0 "[ . 1 . 2]" 1
1961 1 61 PHE H 1 64 LEU QD . . 4.780 4.237 4.046 4.537 . 0 0 "[ . 1 . 2]" 1
1962 1 61 PHE HA 1 63 TYR H . . 3.730 3.729 3.465 3.984 0.254 20 0 "[ . 1 . 2]" 1
1963 1 61 PHE HA 1 64 LEU MD1 . . 4.250 2.950 1.905 3.877 . 0 0 "[ . 1 . 2]" 1
1964 1 61 PHE HA 1 64 LEU QD . . 3.200 2.086 1.872 2.371 . 0 0 "[ . 1 . 2]" 1
1965 1 61 PHE HA 1 64 LEU MD2 . . 4.250 3.026 1.878 4.514 0.264 16 0 "[ . 1 . 2]" 1
1966 1 61 PHE HA 1 64 LEU HG . . 4.220 3.471 2.709 4.414 0.194 16 0 "[ . 1 . 2]" 1
1967 1 61 PHE HA 1 74 ILE MG . . 4.910 4.854 4.553 5.144 0.234 19 0 "[ . 1 . 2]" 1
1968 1 61 PHE HA 1 76 ALA MB . . 4.620 4.160 3.580 4.805 0.185 17 0 "[ . 1 . 2]" 1
1969 1 61 PHE HB2 1 62 GLY H . . 4.310 4.104 3.993 4.247 . 0 0 "[ . 1 . 2]" 1
1970 1 61 PHE HB2 1 76 ALA MB . . 3.810 3.086 2.261 3.656 . 0 0 "[ . 1 . 2]" 1
1971 1 61 PHE HB3 1 62 GLY H . . 3.500 3.150 2.921 3.336 . 0 0 "[ . 1 . 2]" 1
1972 1 61 PHE HB3 1 63 TYR H . . 5.410 5.183 5.074 5.284 . 0 0 "[ . 1 . 2]" 1
1973 1 61 PHE HB3 1 76 ALA MB . . 4.030 4.297 3.621 4.852 0.822 12 5 "[ * . *1 + * -]" 1
1974 1 62 GLY H 1 63 TYR HA . . 5.390 5.224 5.082 5.387 . 0 0 "[ . 1 . 2]" 1
1975 1 62 GLY H 1 63 TYR QB . . 4.780 4.684 4.556 4.901 0.121 9 0 "[ . 1 . 2]" 1
1976 1 62 GLY H 1 63 TYR QD . . 4.210 3.756 3.119 4.274 0.064 19 0 "[ . 1 . 2]" 1
1977 1 62 GLY H 1 64 LEU QD . . 4.480 4.197 3.857 4.772 0.292 4 0 "[ . 1 . 2]" 1
1978 1 62 GLY H 1 64 LEU HG . . 5.500 5.643 5.128 5.995 0.495 20 0 "[ . 1 . 2]" 1
1979 1 62 GLY QA 1 63 TYR H . . 3.550 2.916 2.869 2.959 . 0 0 "[ . 1 . 2]" 1
1980 1 62 GLY QA 1 63 TYR HA . . 4.700 4.115 4.060 4.158 . 0 0 "[ . 1 . 2]" 1
1981 1 62 GLY QA 1 63 TYR QD . . 4.740 4.249 3.307 4.583 . 0 0 "[ . 1 . 2]" 1
1982 1 62 GLY QA 1 64 LEU H . . 3.650 3.543 3.314 3.976 0.326 20 0 "[ . 1 . 2]" 1
1983 1 63 TYR H 1 63 TYR HB2 . . 3.730 2.444 2.376 2.549 . 0 0 "[ . 1 . 2]" 1
1984 1 63 TYR H 1 63 TYR QB . . 2.940 2.409 2.346 2.505 . 0 0 "[ . 1 . 2]" 1
1985 1 63 TYR H 1 63 TYR HB3 . . 3.730 3.644 3.617 3.683 . 0 0 "[ . 1 . 2]" 1
1986 1 63 TYR H 1 63 TYR QD . . 3.850 2.524 2.028 2.918 . 0 0 "[ . 1 . 2]" 1
1987 1 63 TYR H 1 63 TYR HE1 . . 5.500 5.364 4.424 6.278 0.778 17 5 "[ .*- ** . + 2]" 1
1988 1 63 TYR H 1 64 LEU QD . . 3.690 3.120 2.410 4.008 0.318 4 0 "[ . 1 . 2]" 1
1989 1 63 TYR H 1 64 LEU HG . . 4.020 4.292 3.409 4.789 0.769 10 9 "[ * - * + **** * 2]" 1
1990 1 63 TYR HA 1 64 LEU QB . . 5.340 5.205 4.969 5.503 0.163 20 0 "[ . 1 . 2]" 1
1991 1 63 TYR HA 1 64 LEU QD . . 4.960 4.448 3.961 5.057 0.097 3 0 "[ . 1 . 2]" 1
1992 1 63 TYR HA 1 64 LEU HG . . 5.500 5.593 4.759 6.213 0.713 12 10 "[ * * * -* +*** * 2]" 1
1993 1 63 TYR QB 1 64 LEU H . . 3.720 3.285 2.734 3.586 . 0 0 "[ . 1 . 2]" 1
1994 1 63 TYR QB 1 64 LEU QD . . 4.320 2.995 2.267 3.975 . 0 0 "[ . 1 . 2]" 1
1995 1 63 TYR QB 1 107 LEU QD . . 4.340 3.651 2.702 4.460 0.120 6 0 "[ . 1 . 2]" 1
1996 1 63 TYR HB2 1 64 LEU H . . 4.440 3.442 2.825 3.810 . 0 0 "[ . 1 . 2]" 1
1997 1 63 TYR HB2 1 103 PHE QD . . 4.860 3.478 2.648 4.587 . 0 0 "[ . 1 . 2]" 1
1998 1 63 TYR HB3 1 64 LEU H . . 4.440 4.164 3.639 4.426 . 0 0 "[ . 1 . 2]" 1
1999 1 63 TYR HB3 1 103 PHE QD . . 4.860 3.267 2.528 4.288 . 0 0 "[ . 1 . 2]" 1
2000 1 63 TYR QD 1 64 LEU H . . 5.470 4.611 4.312 4.826 . 0 0 "[ . 1 . 2]" 1
2001 1 63 TYR QD 1 107 LEU QD . . 4.260 3.413 2.362 4.431 0.171 15 0 "[ . 1 . 2]" 1
2002 1 64 LEU H 1 64 LEU HB2 . . 3.880 3.775 2.620 3.957 0.077 13 0 "[ . 1 . 2]" 1
2003 1 64 LEU H 1 64 LEU HB3 . . 3.880 3.533 3.268 3.762 . 0 0 "[ . 1 . 2]" 1
2004 1 64 LEU H 1 64 LEU QD . . 2.920 2.210 1.808 3.466 0.546 4 1 "[ +. 1 . 2]" 1
2005 1 64 LEU H 1 64 LEU HG . . 3.060 2.775 2.411 3.154 0.094 12 0 "[ . 1 . 2]" 1
2006 1 64 LEU H 1 65 LYS H . . 4.080 4.182 3.836 4.494 0.414 20 0 "[ . 1 . 2]" 1
2007 1 64 LEU H 1 65 LYS HA . . 4.750 4.784 4.616 5.096 0.346 20 0 "[ . 1 . 2]" 1
2008 1 64 LEU HA 1 64 LEU QB . . 2.530 2.181 2.147 2.378 . 0 0 "[ . 1 . 2]" 1
2009 1 64 LEU HA 1 64 LEU QD . . 3.610 3.371 2.204 3.490 . 0 0 "[ . 1 . 2]" 1
2010 1 64 LEU HA 1 64 LEU HG . . 3.910 3.726 3.163 3.842 . 0 0 "[ . 1 . 2]" 1
2011 1 64 LEU HA 1 65 LYS H . . 2.820 2.173 2.065 2.264 . 0 0 "[ . 1 . 2]" 1
2012 1 64 LEU HA 1 65 LYS HA . . 4.620 4.452 4.416 4.485 . 0 0 "[ . 1 . 2]" 1
2013 1 64 LEU HA 1 65 LYS QB . . 4.730 4.363 4.166 4.681 . 0 0 "[ . 1 . 2]" 1
2014 1 64 LEU HA 1 65 LYS HG2 . . 5.500 3.993 3.522 5.273 . 0 0 "[ . 1 . 2]" 1
2015 1 64 LEU HA 1 65 LYS QG . . 4.660 3.756 3.465 4.193 . 0 0 "[ . 1 . 2]" 1
2016 1 64 LEU HA 1 65 LYS HG3 . . 5.500 5.018 3.674 5.575 0.075 19 0 "[ . 1 . 2]" 1
2017 1 64 LEU QB 1 65 LYS H . . 4.130 3.193 2.653 3.693 . 0 0 "[ . 1 . 2]" 1
2018 1 64 LEU QB 1 85 ILE MD . . 3.120 2.376 1.960 2.703 . 0 0 "[ . 1 . 2]" 1
2019 1 64 LEU QB 1 85 ILE HG12 . . 4.980 4.623 3.757 5.041 0.061 2 0 "[ . 1 . 2]" 1
2020 1 64 LEU QD 1 74 ILE HB . . 4.100 2.849 2.429 3.311 . 0 0 "[ . 1 . 2]" 1
2021 1 64 LEU QD 1 74 ILE HG13 . . 4.010 2.399 2.088 2.846 . 0 0 "[ . 1 . 2]" 1
2022 1 64 LEU QD 1 74 ILE MG . . 3.020 2.032 1.793 2.595 . 0 0 "[ . 1 . 2]" 1
2023 1 64 LEU QD 1 85 ILE HG12 . . 4.800 3.191 2.539 3.991 . 0 0 "[ . 1 . 2]" 1
2024 1 64 LEU MD1 1 103 PHE QD . . 4.490 4.619 3.956 4.992 0.502 20 1 "[ . 1 . +]" 1
2025 1 64 LEU MD2 1 103 PHE QD . . 4.490 3.233 2.819 3.702 . 0 0 "[ . 1 . 2]" 1
2026 1 65 LYS H 1 65 LYS HB2 . . 3.710 3.653 2.542 3.794 0.084 19 0 "[ . 1 . 2]" 1
2027 1 65 LYS H 1 65 LYS QB . . 2.850 2.808 2.502 3.029 0.179 13 0 "[ . 1 . 2]" 1
2028 1 65 LYS H 1 65 LYS HB3 . . 3.710 2.972 2.605 3.731 0.021 14 0 "[ . 1 . 2]" 1
2029 1 65 LYS H 1 65 LYS QD . . 5.180 4.073 3.380 4.457 . 0 0 "[ . 1 . 2]" 1
2030 1 65 LYS H 1 65 LYS QE . . 5.340 4.346 3.600 5.301 . 0 0 "[ . 1 . 2]" 1
2031 1 65 LYS H 1 65 LYS HG2 . . 3.730 2.284 1.958 3.874 0.144 14 0 "[ . 1 . 2]" 1
2032 1 65 LYS H 1 65 LYS HG3 . . 3.730 3.031 1.852 3.438 . 0 0 "[ . 1 . 2]" 1
2033 1 65 LYS H 1 66 PRO QD . . 4.850 4.508 4.357 4.548 . 0 0 "[ . 1 . 2]" 1
2034 1 65 LYS H 1 85 ILE MD . . 4.640 3.703 3.366 4.084 . 0 0 "[ . 1 . 2]" 1
2035 1 65 LYS HA 1 65 LYS QE . . 5.340 5.010 3.777 5.837 0.497 9 0 "[ . 1 . 2]" 1
2036 1 65 LYS HA 1 65 LYS HG2 . . 3.940 3.765 2.478 4.292 0.352 6 0 "[ . 1 . 2]" 1
2037 1 65 LYS HA 1 65 LYS HG3 . . 3.940 3.773 3.250 3.940 . 18 0 "[ . 1 . 2]" 1
2038 1 65 LYS HA 1 66 PRO HB3 . . 5.050 5.043 4.890 5.176 0.126 1 0 "[ . 1 . 2]" 1
2039 1 65 LYS HA 1 66 PRO QD . . 2.890 2.233 1.980 2.402 . 0 0 "[ . 1 . 2]" 1
2040 1 65 LYS HA 1 85 ILE MD . . 4.360 3.511 3.081 3.997 . 0 0 "[ . 1 . 2]" 1
2041 1 65 LYS QB 1 66 PRO HA . . 4.920 4.795 4.638 4.928 0.008 19 0 "[ . 1 . 2]" 1
2042 1 65 LYS QB 1 66 PRO QD . . 3.440 2.218 1.894 2.671 . 0 0 "[ . 1 . 2]" 1
2043 1 65 LYS QB 1 66 PRO HG2 . . 4.010 3.887 3.650 4.179 0.169 4 0 "[ . 1 . 2]" 1
2044 1 65 LYS HB2 1 66 PRO QD . . 4.270 2.324 1.991 3.415 . 0 0 "[ . 1 . 2]" 1
2045 1 65 LYS HB3 1 66 PRO QD . . 4.270 3.378 1.903 3.658 . 0 0 "[ . 1 . 2]" 1
2046 1 65 LYS QD 1 65 LYS QG . . 2.360 2.073 2.023 2.121 . 0 0 "[ . 1 . 2]" 1
2047 1 65 LYS QD 1 66 PRO QD . . 4.060 4.270 3.269 4.831 0.771 12 4 "[ *. 1-+* . 2]" 1
2048 1 65 LYS QE 1 65 LYS QG . . 2.910 2.430 2.172 2.865 . 0 0 "[ . 1 . 2]" 1
2049 1 65 LYS QG 1 66 PRO HA . . 5.340 4.668 4.121 6.090 0.750 14 1 "[ . 1 +. 2]" 1
2050 1 65 LYS QG 1 66 PRO QD . . 4.040 3.786 3.195 4.095 0.055 4 0 "[ . 1 . 2]" 1
2051 1 65 LYS HG2 1 66 PRO QD . . 4.730 4.650 3.478 4.882 0.152 12 0 "[ . 1 . 2]" 1
2052 1 65 LYS HG3 1 66 PRO QD . . 4.730 4.055 3.284 4.531 . 0 0 "[ . 1 . 2]" 1
2053 1 66 PRO HA 1 67 ASP H . . 3.410 2.210 2.079 2.367 . 0 0 "[ . 1 . 2]" 1
2054 1 66 PRO HA 1 67 ASP HA . . 4.670 4.506 4.450 4.575 . 0 0 "[ . 1 . 2]" 1
2055 1 66 PRO HA 1 67 ASP QB . . 4.400 4.046 3.798 4.296 . 0 0 "[ . 1 . 2]" 1
2056 1 66 PRO HA 1 85 ILE HA . . 3.920 3.843 3.528 4.084 0.164 2 0 "[ . 1 . 2]" 1
2057 1 66 PRO HA 1 85 ILE HB . . 3.350 2.003 1.853 2.134 . 0 0 "[ . 1 . 2]" 1
2058 1 66 PRO HA 1 85 ILE MD . . 3.260 2.919 2.756 3.064 . 0 0 "[ . 1 . 2]" 1
2059 1 66 PRO HA 1 85 ILE HG12 . . 5.220 4.853 4.701 4.982 . 0 0 "[ . 1 . 2]" 1
2060 1 66 PRO HA 1 85 ILE HG13 . . 5.000 4.073 3.898 4.796 . 0 0 "[ . 1 . 2]" 1
2061 1 66 PRO HA 1 85 ILE MG . . 3.480 3.365 3.206 3.560 0.080 17 0 "[ . 1 . 2]" 1
2062 1 66 PRO HA 1 86 GLN H . . 2.850 2.271 2.060 2.589 . 0 0 "[ . 1 . 2]" 1
2063 1 66 PRO HA 1 86 GLN HA . . 4.540 4.697 4.477 4.825 0.285 15 0 "[ . 1 . 2]" 1
2064 1 66 PRO HA 1 87 LEU QD . . 4.820 4.053 3.706 4.381 . 0 0 "[ . 1 . 2]" 1
2065 1 66 PRO HA 1 87 LEU HG . . 5.320 5.721 5.000 6.059 0.739 20 7 "[* . * 1* .** -+]" 1
2066 1 66 PRO HB2 1 67 ASP H . . 3.220 3.178 2.601 3.690 0.470 15 0 "[ . 1 . 2]" 1
2067 1 66 PRO HB2 1 67 ASP HA . . 4.080 4.435 4.031 4.762 0.682 1 5 "[+ - . 1* .* *]" 1
2068 1 66 PRO HB2 1 85 ILE HA . . 4.300 4.107 3.763 4.444 0.144 8 0 "[ . 1 . 2]" 1
2069 1 66 PRO HB2 1 85 ILE HB . . 4.480 3.758 3.602 3.865 . 0 0 "[ . 1 . 2]" 1
2070 1 66 PRO HB2 1 85 ILE MD . . 4.980 5.127 5.035 5.278 0.298 19 0 "[ . 1 . 2]" 1
2071 1 66 PRO HB2 1 85 ILE MG . . 4.460 3.948 3.726 4.173 . 0 0 "[ . 1 . 2]" 1
2072 1 66 PRO HB2 1 86 GLN H . . 4.120 3.248 2.878 3.584 . 0 0 "[ . 1 . 2]" 1
2073 1 66 PRO HB3 1 67 ASP H . . 3.610 3.782 3.414 4.091 0.481 15 0 "[ . 1 . 2]" 1
2074 1 66 PRO HB3 1 85 ILE HA . . 4.000 2.697 2.316 3.077 . 0 0 "[ . 1 . 2]" 1
2075 1 66 PRO HB3 1 85 ILE HB . . 4.480 2.348 2.136 2.534 . 0 0 "[ . 1 . 2]" 1
2076 1 66 PRO HB3 1 85 ILE MD . . 3.930 4.115 3.907 4.280 0.350 16 0 "[ . 1 . 2]" 1
2077 1 66 PRO HB3 1 85 ILE MG . . 3.790 2.412 2.171 2.692 . 0 0 "[ . 1 . 2]" 1
2078 1 66 PRO HB3 1 86 GLN H . . 3.500 2.627 2.136 2.976 . 0 0 "[ . 1 . 2]" 1
2079 1 66 PRO QD 1 85 ILE MD . . 4.850 3.605 3.230 4.012 . 0 0 "[ . 1 . 2]" 1
2080 1 66 PRO QD 1 85 ILE MG . . 3.850 2.275 2.025 2.542 . 0 0 "[ . 1 . 2]" 1
2081 1 66 PRO QD 1 86 GLN H . . 4.880 4.782 4.510 4.884 0.004 4 0 "[ . 1 . 2]" 1
2082 1 66 PRO HG2 1 67 ASP H . . 4.580 4.743 4.364 4.985 0.405 1 0 "[ . 1 . 2]" 1
2083 1 66 PRO HG2 1 85 ILE MD . . 5.500 5.573 5.357 5.768 0.268 6 0 "[ . 1 . 2]" 1
2084 1 66 PRO HG3 1 67 ASP H . . 5.210 5.440 5.073 5.706 0.496 1 0 "[ . 1 . 2]" 1
2085 1 66 PRO HG3 1 85 ILE HA . . 4.220 4.609 4.178 5.049 0.829 18 6 "[ . -**1** . + 2]" 1
2086 1 66 PRO HG3 1 85 ILE HB . . 4.990 4.290 4.060 4.469 . 0 0 "[ . 1 . 2]" 1
2087 1 66 PRO HG3 1 85 ILE MD . . 5.450 5.285 4.958 5.555 0.105 17 0 "[ . 1 . 2]" 1
2088 1 66 PRO HG3 1 85 ILE MG . . 4.480 3.138 2.943 3.388 . 0 0 "[ . 1 . 2]" 1
2089 1 66 PRO HG3 1 86 GLN H . . 5.360 4.956 4.461 5.288 . 0 0 "[ . 1 . 2]" 1
2090 1 67 ASP H 1 67 ASP HB2 . . 3.980 2.923 2.430 3.357 . 0 0 "[ . 1 . 2]" 1
2091 1 67 ASP H 1 67 ASP QB . . 3.210 2.586 2.314 2.851 . 0 0 "[ . 1 . 2]" 1
2092 1 67 ASP H 1 67 ASP HB3 . . 3.980 3.182 2.426 3.869 . 0 0 "[ . 1 . 2]" 1
2093 1 67 ASP H 1 68 ASN H . . 4.430 4.287 3.848 4.547 0.117 16 0 "[ . 1 . 2]" 1
2094 1 67 ASP H 1 69 ARG H . . 5.260 4.836 4.309 5.372 0.112 18 0 "[ . 1 . 2]" 1
2095 1 67 ASP H 1 85 ILE MD . . 4.700 4.360 3.826 4.842 0.142 8 0 "[ . 1 . 2]" 1
2096 1 67 ASP H 1 86 GLN HA . . 4.450 4.403 4.127 4.781 0.331 15 0 "[ . 1 . 2]" 1
2097 1 67 ASP H 1 86 GLN QB . . 4.290 2.514 1.849 3.381 . 0 0 "[ . 1 . 2]" 1
2098 1 67 ASP H 1 86 GLN QE . . 5.120 4.582 3.801 5.642 0.522 3 1 "[ + . 1 . 2]" 1
2099 1 67 ASP HA 1 68 ASN H . . 3.560 2.283 2.168 2.585 . 0 0 "[ . 1 . 2]" 1
2100 1 67 ASP HA 1 68 ASN QB . . 5.340 4.260 3.924 4.548 . 0 0 "[ . 1 . 2]" 1
2101 1 67 ASP HA 1 69 ARG H . . 5.120 4.274 3.850 4.729 . 0 0 "[ . 1 . 2]" 1
2102 1 67 ASP HA 1 86 GLN QB . . 4.830 4.457 3.961 4.744 . 0 0 "[ . 1 . 2]" 1
2103 1 67 ASP QB 1 68 ASN HA . . 4.410 4.704 4.479 4.969 0.559 14 2 "[ . - +. 2]" 1
2104 1 67 ASP QB 1 69 ARG H . . 3.620 3.435 2.847 3.813 0.193 19 0 "[ . 1 . 2]" 1
2105 1 67 ASP QB 1 69 ARG HA . . 5.110 5.610 4.642 6.292 1.182 18 11 "[* . -******.**+ 2]" 1
2106 1 67 ASP QB 1 86 GLN H . . 4.900 4.839 3.928 5.185 0.285 5 0 "[ . 1 . 2]" 1
2107 1 67 ASP QB 1 86 GLN HA . . 5.340 5.163 3.908 5.873 0.533 7 1 "[ . + 1 . 2]" 1
2108 1 67 ASP QB 1 87 LEU H . . 5.210 4.290 3.337 5.182 . 0 0 "[ . 1 . 2]" 1
2109 1 67 ASP HB2 1 68 ASN H . . 4.490 4.249 3.805 4.552 0.062 12 0 "[ . 1 . 2]" 1
2110 1 67 ASP HB2 1 69 ARG H . . 4.450 4.497 3.595 5.077 0.627 4 3 "[- +. 1 * . 2]" 1
2111 1 67 ASP HB2 1 88 PRO HA . . 5.160 4.887 3.475 5.756 0.596 4 2 "[ +. 1 . - 2]" 1
2112 1 67 ASP HB3 1 68 ASN H . . 4.490 3.755 3.128 4.324 . 0 0 "[ . 1 . 2]" 1
2113 1 67 ASP HB3 1 69 ARG H . . 4.450 3.591 2.932 4.113 . 0 0 "[ . 1 . 2]" 1
2114 1 67 ASP HB3 1 88 PRO HA . . 5.160 4.242 3.740 5.008 . 0 0 "[ . 1 . 2]" 1
2115 1 68 ASN H 1 68 ASN HB2 . . 4.160 2.660 2.455 3.875 . 0 0 "[ . 1 . 2]" 1
2116 1 68 ASN H 1 68 ASN HB3 . . 4.160 3.253 2.492 3.843 . 0 0 "[ . 1 . 2]" 1
2117 1 68 ASN H 1 69 ARG H . . 3.750 3.009 2.326 3.644 . 0 0 "[ . 1 . 2]" 1
2118 1 68 ASN H 1 69 ARG HA . . 4.980 4.958 4.657 5.121 0.141 3 0 "[ . 1 . 2]" 1
2119 1 68 ASN H 1 69 ARG HB2 . . 4.880 4.749 3.901 5.303 0.423 7 0 "[ . 1 . 2]" 1
2120 1 68 ASN H 1 69 ARG QG . . 5.500 4.966 3.374 5.424 . 0 0 "[ . 1 . 2]" 1
2121 1 68 ASN H 1 70 GLY H . . 5.500 4.970 4.280 5.861 0.361 4 0 "[ . 1 . 2]" 1
2122 1 68 ASN H 1 86 GLN QB . . 5.500 4.590 3.983 4.990 . 0 0 "[ . 1 . 2]" 1
2123 1 68 ASN HA 1 69 ARG H . . 3.090 2.782 2.316 3.194 0.104 8 0 "[ . 1 . 2]" 1
2124 1 68 ASN HA 1 69 ARG HA . . 4.630 4.583 4.404 4.878 0.248 8 0 "[ . 1 . 2]" 1
2125 1 68 ASN HA 1 69 ARG HB2 . . 4.990 5.020 4.499 5.250 0.260 11 0 "[ . 1 . 2]" 1
2126 1 68 ASN HA 1 69 ARG QD . . 4.250 4.648 4.132 5.075 0.825 4 7 "[ +. ** 1- * .** 2]" 1
2127 1 68 ASN HA 1 86 GLN QE . . 4.300 2.586 2.062 3.047 . 0 0 "[ . 1 . 2]" 1
2128 1 68 ASN QB 1 69 ARG H . . 4.070 3.881 3.545 4.075 0.005 16 0 "[ . 1 . 2]" 1
2129 1 68 ASN QB 1 69 ARG HA . . 4.640 4.570 4.383 4.870 0.230 19 0 "[ . 1 . 2]" 1
2130 1 68 ASN HB2 1 69 ARG H . . 4.760 4.356 3.847 4.652 . 0 0 "[ . 1 . 2]" 1
2131 1 68 ASN HB3 1 69 ARG H . . 4.760 4.401 3.748 4.671 . 0 0 "[ . 1 . 2]" 1
2132 1 69 ARG H 1 69 ARG HB2 . . 3.550 2.296 2.150 2.498 . 0 0 "[ . 1 . 2]" 1
2133 1 69 ARG H 1 69 ARG HB3 . . 3.830 3.548 3.470 3.704 . 0 0 "[ . 1 . 2]" 1
2134 1 69 ARG H 1 69 ARG HD2 . . 4.320 3.650 2.121 4.896 0.576 9 2 "[ -. +1 . 2]" 1
2135 1 69 ARG H 1 69 ARG HD3 . . 4.320 3.232 2.311 4.406 0.086 13 0 "[ . 1 . 2]" 1
2136 1 69 ARG H 1 70 GLY H . . 3.320 2.340 1.984 2.790 . 0 0 "[ . 1 . 2]" 1
2137 1 69 ARG H 1 70 GLY QA . . 4.210 4.220 3.872 4.592 0.382 8 0 "[ . 1 . 2]" 1
2138 1 69 ARG H 1 71 GLY H . . 4.120 4.060 3.391 4.793 0.673 2 2 "[ + . 1- . 2]" 1
2139 1 69 ARG H 1 86 GLN QB . . 3.580 3.770 2.978 4.560 0.980 8 4 "[ * . + 1 . -* 2]" 1
2140 1 69 ARG H 1 86 GLN QE . . 4.220 3.262 2.521 4.019 . 0 0 "[ . 1 . 2]" 1
2141 1 69 ARG H 1 88 PRO HA . . 4.660 4.217 3.717 4.998 0.338 4 0 "[ . 1 . 2]" 1
2142 1 69 ARG H 1 89 PRO HD3 . . 5.170 4.772 4.336 5.472 0.302 4 0 "[ . 1 . 2]" 1
2143 1 69 ARG HA 1 69 ARG HD2 . . 4.020 3.158 2.554 3.969 . 0 0 "[ . 1 . 2]" 1
2144 1 69 ARG HA 1 69 ARG HD3 . . 4.020 3.317 2.030 4.271 0.251 2 0 "[ . 1 . 2]" 1
2145 1 69 ARG HA 1 69 ARG QG . . 3.220 2.556 2.332 3.084 . 0 0 "[ . 1 . 2]" 1
2146 1 69 ARG HA 1 70 GLY QA . . 4.560 4.284 4.121 4.429 . 0 0 "[ . 1 . 2]" 1
2147 1 69 ARG HA 1 71 GLY H . . 5.490 5.104 4.732 5.461 . 0 0 "[ . 1 . 2]" 1
2148 1 69 ARG HA 1 86 GLN QE . . 5.500 4.701 4.234 5.171 . 0 0 "[ . 1 . 2]" 1
2149 1 69 ARG HA 1 89 PRO HD2 . . 5.500 4.965 4.542 5.678 0.178 18 0 "[ . 1 . 2]" 1
2150 1 69 ARG HB2 1 69 ARG HD2 . . 4.230 3.375 2.534 3.881 . 0 0 "[ . 1 . 2]" 1
2151 1 69 ARG HB2 1 69 ARG QD . . 3.630 2.690 2.336 3.363 . 0 0 "[ . 1 . 2]" 1
2152 1 69 ARG HB2 1 69 ARG HD3 . . 4.230 2.946 2.394 3.833 . 0 0 "[ . 1 . 2]" 1
2153 1 69 ARG HB2 1 70 GLY H . . 3.760 3.221 2.129 3.967 0.207 3 0 "[ . 1 . 2]" 1
2154 1 69 ARG HB2 1 71 GLY H . . 4.390 3.743 2.914 4.502 0.112 11 0 "[ . 1 . 2]" 1
2155 1 69 ARG HB2 1 86 GLN QE . . 5.310 4.630 3.689 5.019 . 0 0 "[ . 1 . 2]" 1
2156 1 69 ARG HB3 1 70 GLY H . . 3.530 3.774 3.208 4.326 0.796 16 5 "[ * . 1 * *+ -2]" 1
2157 1 69 ARG HB3 1 71 GLY H . . 4.110 4.049 3.289 4.553 0.443 16 0 "[ . 1 . 2]" 1
2158 1 69 ARG HB3 1 86 GLN QE . . 5.380 5.358 4.804 5.607 0.227 5 0 "[ . 1 . 2]" 1
2159 1 69 ARG QD 1 70 GLY H . . 4.420 4.580 4.184 4.908 0.488 11 0 "[ . 1 . 2]" 1
2160 1 69 ARG QD 1 86 GLN QE . . 5.340 5.385 4.952 5.654 0.314 13 0 "[ . 1 . 2]" 1
2161 1 70 GLY H 1 71 GLY H . . 3.300 2.487 2.238 2.701 . 0 0 "[ . 1 . 2]" 1
2162 1 70 GLY H 1 71 GLY QA . . 4.450 4.357 4.065 4.566 0.116 3 0 "[ . 1 . 2]" 1
2163 1 70 GLY H 1 86 GLN QB . . 3.650 3.224 2.429 3.806 0.156 18 0 "[ . 1 . 2]" 1
2164 1 70 GLY H 1 86 GLN QE . . 3.910 2.076 1.756 2.413 . 0 0 "[ . 1 . 2]" 1
2165 1 70 GLY H 1 86 GLN HG2 . . 4.760 4.823 4.259 5.167 0.407 19 0 "[ . 1 . 2]" 1
2166 1 70 GLY H 1 88 PRO HA . . 4.500 4.588 3.735 5.132 0.632 7 6 "[ - . + 1 * ** *2]" 1
2167 1 70 GLY H 1 89 PRO HD3 . . 4.960 4.153 3.447 4.627 . 0 0 "[ . 1 . 2]" 1
2168 1 70 GLY QA 1 86 GLN QB . . 4.690 3.562 2.383 4.394 . 0 0 "[ . 1 . 2]" 1
2169 1 70 GLY QA 1 86 GLN QE . . 4.240 2.118 1.914 2.343 . 0 0 "[ . 1 . 2]" 1
2170 1 70 GLY QA 1 89 PRO HB3 . . 5.500 5.427 5.139 5.594 0.094 6 0 "[ . 1 . 2]" 1
2171 1 70 GLY QA 1 89 PRO HD3 . . 4.760 4.473 4.154 4.659 . 0 0 "[ . 1 . 2]" 1
2172 1 70 GLY QA 1 89 PRO HG3 . . 5.230 4.919 4.484 5.432 0.202 4 0 "[ . 1 . 2]" 1
2173 1 71 GLY H 1 72 GLU H . . 4.000 3.585 2.768 3.924 . 0 0 "[ . 1 . 2]" 1
2174 1 71 GLY H 1 86 GLN QB . . 4.570 3.402 3.074 3.843 . 0 0 "[ . 1 . 2]" 1
2175 1 71 GLY H 1 86 GLN QE . . 5.040 3.222 2.437 4.230 . 0 0 "[ . 1 . 2]" 1
2176 1 71 GLY H 1 86 GLN HG2 . . 4.870 4.735 4.157 5.026 0.156 19 0 "[ . 1 . 2]" 1
2177 1 71 GLY H 1 87 LEU H . . 4.980 3.810 3.445 4.513 . 0 0 "[ . 1 . 2]" 1
2178 1 71 GLY H 1 87 LEU HA . . 5.500 5.398 5.074 5.936 0.436 18 0 "[ . 1 . 2]" 1
2179 1 71 GLY H 1 88 PRO HA . . 4.240 3.750 3.412 4.047 . 0 0 "[ . 1 . 2]" 1
2180 1 71 GLY H 1 89 PRO HA . . 5.500 5.037 4.114 5.617 0.117 19 0 "[ . 1 . 2]" 1
2181 1 71 GLY H 1 89 PRO HB3 . . 4.520 4.365 3.818 4.636 0.116 15 0 "[ . 1 . 2]" 1
2182 1 71 GLY H 1 89 PRO HG3 . . 5.010 4.530 4.223 4.833 . 0 0 "[ . 1 . 2]" 1
2183 1 71 GLY QA 1 72 GLU H . . 3.060 2.142 2.100 2.320 . 0 0 "[ . 1 . 2]" 1
2184 1 71 GLY QA 1 88 PRO HA . . 4.490 3.543 3.247 4.233 . 0 0 "[ . 1 . 2]" 1
2185 1 71 GLY QA 1 89 PRO HA . . 3.300 2.672 2.118 3.105 . 0 0 "[ . 1 . 2]" 1
2186 1 71 GLY QA 1 89 PRO HB3 . . 4.770 2.036 1.914 2.156 . 0 0 "[ . 1 . 2]" 1
2187 1 71 GLY QA 1 90 VAL H . . 4.600 4.546 3.882 5.007 0.407 16 0 "[ . 1 . 2]" 1
2188 1 71 GLY HA2 1 89 PRO HA . . 3.860 3.433 2.853 3.784 . 0 0 "[ . 1 . 2]" 1
2189 1 71 GLY HA3 1 89 PRO HA . . 3.860 2.806 2.183 3.335 . 0 0 "[ . 1 . 2]" 1
2190 1 72 GLU H 1 72 GLU HB2 . . 3.500 2.501 2.389 2.646 . 0 0 "[ . 1 . 2]" 1
2191 1 72 GLU H 1 72 GLU HG2 . . 3.970 3.665 2.394 4.166 0.196 4 0 "[ . 1 . 2]" 1
2192 1 72 GLU H 1 72 GLU QG . . 3.320 3.153 2.371 3.441 0.121 4 0 "[ . 1 . 2]" 1
2193 1 72 GLU H 1 72 GLU HG3 . . 3.970 3.648 3.397 3.945 . 0 0 "[ . 1 . 2]" 1
2194 1 72 GLU H 1 73 VAL H . . 4.560 4.591 4.512 4.641 0.081 10 0 "[ . 1 . 2]" 1
2195 1 72 GLU H 1 87 LEU H . . 4.470 3.241 2.706 3.708 . 0 0 "[ . 1 . 2]" 1
2196 1 72 GLU H 1 87 LEU HA . . 5.100 4.793 4.476 5.026 . 0 0 "[ . 1 . 2]" 1
2197 1 72 GLU H 1 87 LEU HB2 . . 3.200 2.545 2.107 3.471 0.271 18 0 "[ . 1 . 2]" 1
2198 1 72 GLU H 1 87 LEU QD . . 3.890 3.852 3.610 4.574 0.684 18 1 "[ . 1 . + 2]" 1
2199 1 72 GLU H 1 88 PRO HD2 . . 5.200 5.306 5.004 5.625 0.425 18 0 "[ . 1 . 2]" 1
2200 1 72 GLU H 1 89 PRO HA . . 4.640 3.493 3.136 3.913 . 0 0 "[ . 1 . 2]" 1
2201 1 72 GLU H 1 90 VAL H . . 5.500 5.192 4.609 6.048 0.548 8 1 "[ . + 1 . 2]" 1
2202 1 72 GLU HA 1 72 GLU HG2 . . 3.870 3.699 3.335 3.835 . 0 0 "[ . 1 . 2]" 1
2203 1 72 GLU HA 1 72 GLU HG3 . . 3.870 2.828 2.523 3.796 . 0 0 "[ . 1 . 2]" 1
2204 1 72 GLU HA 1 73 VAL H . . 2.870 2.479 2.374 2.634 . 0 0 "[ . 1 . 2]" 1
2205 1 72 GLU HA 1 73 VAL HA . . 4.790 4.556 4.485 4.584 . 0 0 "[ . 1 . 2]" 1
2206 1 72 GLU HA 1 73 VAL HB . . 5.090 4.613 4.276 4.750 . 0 0 "[ . 1 . 2]" 1
2207 1 72 GLU HA 1 73 VAL QG . . 3.420 3.444 3.220 3.560 0.140 11 0 "[ . 1 . 2]" 1
2208 1 72 GLU HA 1 87 LEU H . . 4.930 4.618 4.344 4.840 . 0 0 "[ . 1 . 2]" 1
2209 1 72 GLU HA 1 87 LEU HB2 . . 4.630 4.231 4.032 4.614 . 0 0 "[ . 1 . 2]" 1
2210 1 72 GLU HA 1 87 LEU QD . . 4.250 4.287 3.991 4.996 0.746 18 1 "[ . 1 . + 2]" 1
2211 1 72 GLU HB2 1 73 VAL H . . 3.480 3.499 3.152 3.693 0.213 10 0 "[ . 1 . 2]" 1
2212 1 72 GLU HB2 1 87 LEU H . . 3.750 3.714 2.954 4.113 0.363 6 0 "[ . 1 . 2]" 1
2213 1 72 GLU HB3 1 73 VAL H . . 3.590 2.327 2.103 2.478 . 0 0 "[ . 1 . 2]" 1
2214 1 72 GLU HB3 1 73 VAL HA . . 4.550 4.466 4.269 4.608 0.058 1 0 "[ . 1 . 2]" 1
2215 1 72 GLU HB3 1 73 VAL QG . . 5.120 4.487 4.013 4.607 . 0 0 "[ . 1 . 2]" 1
2216 1 72 GLU HB3 1 87 LEU H . . 4.960 4.822 3.985 5.094 0.134 1 0 "[ . 1 . 2]" 1
2217 1 72 GLU HB3 1 87 LEU QD . . 4.120 2.689 2.357 3.444 . 0 0 "[ . 1 . 2]" 1
2218 1 72 GLU QG 1 89 PRO HA . . 4.540 4.148 2.811 4.579 0.039 9 0 "[ . 1 . 2]" 1
2219 1 72 GLU QG 1 90 VAL H . . 4.960 4.477 3.801 4.852 . 0 0 "[ . 1 . 2]" 1
2220 1 72 GLU QG 1 90 VAL QG . . 4.560 3.622 3.162 3.944 . 0 0 "[ . 1 . 2]" 1
2221 1 72 GLU HG2 1 73 VAL H . . 4.640 4.678 4.505 5.021 0.381 8 0 "[ . 1 . 2]" 1
2222 1 72 GLU HG3 1 73 VAL H . . 4.640 4.186 3.853 4.714 0.074 8 0 "[ . 1 . 2]" 1
2223 1 73 VAL H 1 73 VAL HB . . 2.890 2.843 2.752 3.479 0.589 19 1 "[ . 1 . +2]" 1
2224 1 73 VAL H 1 73 VAL MG1 . . 4.040 3.875 2.460 3.981 . 0 0 "[ . 1 . 2]" 1
2225 1 73 VAL H 1 73 VAL QG . . 3.130 2.904 2.439 3.047 . 0 0 "[ . 1 . 2]" 1
2226 1 73 VAL H 1 73 VAL MG2 . . 4.040 3.070 2.893 4.020 . 0 0 "[ . 1 . 2]" 1
2227 1 73 VAL H 1 74 ILE H . . 4.230 4.249 4.128 4.326 0.096 2 0 "[ . 1 . 2]" 1
2228 1 73 VAL H 1 74 ILE HA . . 4.630 4.818 4.738 4.925 0.295 12 0 "[ . 1 . 2]" 1
2229 1 73 VAL H 1 74 ILE MD . . 4.430 3.890 3.476 4.210 . 0 0 "[ . 1 . 2]" 1
2230 1 73 VAL H 1 74 ILE HG12 . . 4.760 4.648 4.180 4.943 0.183 12 0 "[ . 1 . 2]" 1
2231 1 73 VAL H 1 86 GLN HA . . 5.320 4.969 4.659 5.188 . 0 0 "[ . 1 . 2]" 1
2232 1 73 VAL H 1 87 LEU H . . 4.740 4.821 4.362 4.998 0.258 11 0 "[ . 1 . 2]" 1
2233 1 73 VAL H 1 87 LEU HB2 . . 4.830 4.618 4.221 4.907 0.077 10 0 "[ . 1 . 2]" 1
2234 1 73 VAL H 1 87 LEU QD . . 4.460 3.670 3.235 4.335 . 0 0 "[ . 1 . 2]" 1
2235 1 73 VAL HA 1 73 VAL MG1 . . 3.290 2.540 2.442 3.269 . 0 0 "[ . 1 . 2]" 1
2236 1 73 VAL HA 1 73 VAL QG . . 2.840 2.218 2.194 2.409 . 0 0 "[ . 1 . 2]" 1
2237 1 73 VAL HA 1 73 VAL MG2 . . 3.290 2.459 2.403 2.496 . 0 0 "[ . 1 . 2]" 1
2238 1 73 VAL HA 1 74 ILE H . . 3.140 2.178 2.143 2.228 . 0 0 "[ . 1 . 2]" 1
2239 1 73 VAL HA 1 74 ILE HA . . 4.400 4.481 4.462 4.501 0.101 2 0 "[ . 1 . 2]" 1
2240 1 73 VAL HA 1 74 ILE HB . . 4.960 4.667 4.560 4.762 . 0 0 "[ . 1 . 2]" 1
2241 1 73 VAL HA 1 74 ILE MD . . 4.500 4.405 4.242 4.518 0.018 14 0 "[ . 1 . 2]" 1
2242 1 73 VAL HA 1 74 ILE HG12 . . 4.290 4.027 3.825 4.145 . 0 0 "[ . 1 . 2]" 1
2243 1 73 VAL HA 1 84 SER QB . . 5.340 4.776 4.419 5.261 . 0 0 "[ . 1 . 2]" 1
2244 1 73 VAL HA 1 85 ILE H . . 4.300 4.262 4.179 4.419 0.119 6 0 "[ . 1 . 2]" 1
2245 1 73 VAL HA 1 85 ILE MD . . 5.190 5.025 4.073 5.265 0.075 18 0 "[ . 1 . 2]" 1
2246 1 73 VAL HA 1 85 ILE HG13 . . 4.270 3.888 3.587 4.560 0.290 17 0 "[ . 1 . 2]" 1
2247 1 73 VAL HA 1 85 ILE MG . . 5.500 5.979 5.844 6.064 0.564 17 8 "[ ** *-1 ** . +* 2]" 1
2248 1 73 VAL HA 1 86 GLN H . . 4.990 4.893 4.776 4.969 . 0 0 "[ . 1 . 2]" 1
2249 1 73 VAL HA 1 86 GLN HA . . 3.630 2.626 2.377 2.878 . 0 0 "[ . 1 . 2]" 1
2250 1 73 VAL HA 1 86 GLN HG2 . . 4.430 4.204 3.759 4.660 0.230 14 0 "[ . 1 . 2]" 1
2251 1 73 VAL HA 1 86 GLN HG3 . . 5.280 4.902 4.278 5.367 0.087 14 0 "[ . 1 . 2]" 1
2252 1 73 VAL HA 1 87 LEU H . . 3.940 3.652 3.313 3.793 . 0 0 "[ . 1 . 2]" 1
2253 1 73 VAL HA 1 87 LEU HB2 . . 4.800 4.698 4.285 5.080 0.280 16 0 "[ . 1 . 2]" 1
2254 1 73 VAL HB 1 74 ILE H . . 4.530 4.247 4.160 4.358 . 0 0 "[ . 1 . 2]" 1
2255 1 73 VAL HB 1 85 ILE H . . 5.500 5.964 5.605 6.121 0.621 9 9 "[ ** +*-* .* * *]" 1
2256 1 73 VAL QG 1 74 ILE H . . 3.110 2.721 2.613 2.861 . 0 0 "[ . 1 . 2]" 1
2257 1 73 VAL QG 1 74 ILE HA . . 4.440 3.638 3.487 3.753 . 0 0 "[ . 1 . 2]" 1
2258 1 73 VAL QG 1 75 THR HA . . 4.510 4.120 3.828 4.562 0.052 19 0 "[ . 1 . 2]" 1
2259 1 73 VAL QG 1 75 THR MG . . 3.160 2.583 2.193 3.277 0.117 19 0 "[ . 1 . 2]" 1
2260 1 73 VAL QG 1 84 SER HA . . 4.320 3.653 3.300 3.947 . 0 0 "[ . 1 . 2]" 1
2261 1 73 VAL QG 1 84 SER QB . . 3.070 2.222 1.996 2.550 . 0 0 "[ . 1 . 2]" 1
2262 1 73 VAL QG 1 85 ILE H . . 3.270 3.141 2.945 3.314 0.044 9 0 "[ . 1 . 2]" 1
2263 1 73 VAL QG 1 86 GLN HA . . 3.440 2.934 2.662 3.464 0.024 19 0 "[ . 1 . 2]" 1
2264 1 73 VAL QG 1 86 GLN QE . . 4.750 4.577 4.070 4.876 0.126 19 0 "[ . 1 . 2]" 1
2265 1 73 VAL QG 1 86 GLN HG2 . . 3.330 2.656 2.103 3.370 0.040 19 0 "[ . 1 . 2]" 1
2266 1 73 VAL QG 1 86 GLN HG3 . . 3.750 3.473 2.745 3.953 0.203 19 0 "[ . 1 . 2]" 1
2267 1 73 VAL QG 1 87 LEU H . . 4.280 4.017 3.798 4.585 0.305 19 0 "[ . 1 . 2]" 1
2268 1 73 VAL MG1 1 74 ILE H . . 4.360 2.831 2.645 4.184 . 0 0 "[ . 1 . 2]" 1
2269 1 73 VAL MG1 1 86 GLN HA . . 4.010 3.938 3.660 4.775 0.765 19 1 "[ . 1 . +2]" 1
2270 1 73 VAL MG1 1 86 GLN HG2 . . 4.670 4.313 3.956 4.602 . 0 0 "[ . 1 . 2]" 1
2271 1 73 VAL MG1 1 86 GLN HG3 . . 5.200 4.521 3.852 5.807 0.607 19 1 "[ . 1 . +2]" 1
2272 1 73 VAL MG2 1 74 ILE H . . 4.360 4.033 2.811 4.155 . 0 0 "[ . 1 . 2]" 1
2273 1 73 VAL MG2 1 86 GLN HA . . 4.010 3.031 2.706 3.556 . 0 0 "[ . 1 . 2]" 1
2274 1 73 VAL MG2 1 86 GLN HG2 . . 4.670 2.685 2.109 3.466 . 0 0 "[ . 1 . 2]" 1
2275 1 73 VAL MG2 1 86 GLN HG3 . . 5.200 3.621 2.810 4.144 . 0 0 "[ . 1 . 2]" 1
2276 1 74 ILE H 1 74 ILE HB . . 3.640 2.604 2.513 2.674 . 0 0 "[ . 1 . 2]" 1
2277 1 74 ILE H 1 74 ILE MD . . 3.440 3.552 3.519 3.595 0.155 7 0 "[ . 1 . 2]" 1
2278 1 74 ILE H 1 74 ILE HG12 . . 3.760 2.850 2.722 2.964 . 0 0 "[ . 1 . 2]" 1
2279 1 74 ILE H 1 74 ILE HG13 . . 4.170 4.211 4.097 4.301 0.131 4 0 "[ . 1 . 2]" 1
2280 1 74 ILE H 1 84 SER HA . . 4.770 4.446 4.246 4.657 . 0 0 "[ . 1 . 2]" 1
2281 1 74 ILE H 1 84 SER QB . . 5.090 4.295 3.834 4.784 . 0 0 "[ . 1 . 2]" 1
2282 1 74 ILE H 1 85 ILE H . . 3.530 2.885 2.761 3.065 . 0 0 "[ . 1 . 2]" 1
2283 1 74 ILE H 1 85 ILE HA . . 5.120 4.964 4.841 5.116 . 0 0 "[ . 1 . 2]" 1
2284 1 74 ILE H 1 85 ILE MD . . 4.350 3.912 3.206 4.188 . 0 0 "[ . 1 . 2]" 1
2285 1 74 ILE H 1 85 ILE HG13 . . 4.400 2.613 2.434 2.844 . 0 0 "[ . 1 . 2]" 1
2286 1 74 ILE H 1 85 ILE MG . . 4.710 4.866 4.757 5.041 0.331 8 0 "[ . 1 . 2]" 1
2287 1 74 ILE H 1 86 GLN H . . 4.990 5.067 4.996 5.173 0.183 14 0 "[ . 1 . 2]" 1
2288 1 74 ILE H 1 86 GLN HA . . 4.210 3.950 3.772 4.223 0.013 2 0 "[ . 1 . 2]" 1
2289 1 74 ILE H 1 87 LEU H . . 4.820 5.002 4.735 5.095 0.275 2 0 "[ . 1 . 2]" 1
2290 1 74 ILE H 1 87 LEU QD . . 4.180 3.104 2.520 4.092 . 0 0 "[ . 1 . 2]" 1
2291 1 74 ILE HA 1 74 ILE MD . . 3.130 2.056 1.985 2.178 . 0 0 "[ . 1 . 2]" 1
2292 1 74 ILE HA 1 74 ILE HG12 . . 3.610 3.203 3.155 3.292 . 0 0 "[ . 1 . 2]" 1
2293 1 74 ILE HA 1 74 ILE HG13 . . 3.900 3.754 3.714 3.814 . 0 0 "[ . 1 . 2]" 1
2294 1 74 ILE HA 1 74 ILE MG . . 3.130 2.510 2.478 2.561 . 0 0 "[ . 1 . 2]" 1
2295 1 74 ILE HA 1 75 THR H . . 2.920 2.161 2.104 2.255 . 0 0 "[ . 1 . 2]" 1
2296 1 74 ILE HA 1 75 THR HA . . 4.450 4.465 4.443 4.494 0.044 19 0 "[ . 1 . 2]" 1
2297 1 74 ILE HA 1 75 THR HB . . 5.500 5.731 5.670 5.787 0.287 12 0 "[ . 1 . 2]" 1
2298 1 74 ILE HA 1 75 THR MG . . 4.830 4.050 3.911 4.256 . 0 0 "[ . 1 . 2]" 1
2299 1 74 ILE HA 1 85 ILE H . . 4.810 4.853 4.764 4.962 0.152 7 0 "[ . 1 . 2]" 1
2300 1 74 ILE HA 1 85 ILE HG12 . . 5.500 5.079 4.775 6.123 0.623 17 1 "[ . 1 . + 2]" 1
2301 1 74 ILE HA 1 85 ILE HG13 . . 5.440 4.991 4.760 5.195 . 0 0 "[ . 1 . 2]" 1
2302 1 74 ILE HA 1 87 LEU QD . . 4.220 4.124 3.871 4.518 0.298 16 0 "[ . 1 . 2]" 1
2303 1 74 ILE HB 1 75 THR H . . 4.220 4.220 4.023 4.331 0.111 20 0 "[ . 1 . 2]" 1
2304 1 74 ILE HB 1 84 SER HA . . 4.880 4.818 4.510 5.088 0.208 19 0 "[ . 1 . 2]" 1
2305 1 74 ILE HB 1 85 ILE H . . 4.030 3.594 3.175 3.936 . 0 0 "[ . 1 . 2]" 1
2306 1 74 ILE HB 1 85 ILE MD . . 3.270 2.686 2.445 2.880 . 0 0 "[ . 1 . 2]" 1
2307 1 74 ILE HB 1 85 ILE HG12 . . 4.140 2.391 1.974 3.184 . 0 0 "[ . 1 . 2]" 1
2308 1 74 ILE HB 1 85 ILE HG13 . . 4.280 2.647 2.204 3.148 . 0 0 "[ . 1 . 2]" 1
2309 1 74 ILE HB 1 85 ILE MG . . 4.650 4.338 3.989 4.831 0.181 8 0 "[ . 1 . 2]" 1
2310 1 74 ILE HB 1 87 LEU QD . . 5.090 3.062 2.663 3.573 . 0 0 "[ . 1 . 2]" 1
2311 1 74 ILE MD 1 74 ILE MG . . 2.780 2.184 2.126 2.238 . 0 0 "[ . 1 . 2]" 1
2312 1 74 ILE MD 1 75 THR H . . 3.750 3.696 3.598 3.863 0.113 19 0 "[ . 1 . 2]" 1
2313 1 74 ILE MD 1 85 ILE HG13 . . 4.620 4.847 4.638 5.073 0.453 7 0 "[ . 1 . 2]" 1
2314 1 74 ILE MD 1 87 LEU QD . . 3.020 2.352 1.916 2.660 . 0 0 "[ . 1 . 2]" 1
2315 1 74 ILE HG12 1 85 ILE MD . . 3.070 3.413 2.945 3.703 0.633 8 4 "[ - + 1 . **2]" 1
2316 1 74 ILE HG12 1 87 LEU QD . . 3.330 1.878 1.717 2.249 . 0 0 "[ . 1 . 2]" 1
2317 1 74 ILE HG13 1 74 ILE MG . . 3.330 2.343 2.321 2.374 . 0 0 "[ . 1 . 2]" 1
2318 1 74 ILE HG13 1 85 ILE HG12 . . 5.500 4.555 3.961 5.175 . 0 0 "[ . 1 . 2]" 1
2319 1 74 ILE HG13 1 85 ILE HG13 . . 4.530 4.372 3.993 4.783 0.253 7 0 "[ . 1 . 2]" 1
2320 1 74 ILE MG 1 75 THR H . . 3.010 2.759 2.502 2.930 . 0 0 "[ . 1 . 2]" 1
2321 1 74 ILE MG 1 75 THR HA . . 4.130 3.761 3.632 3.924 . 0 0 "[ . 1 . 2]" 1
2322 1 74 ILE MG 1 75 THR HB . . 5.500 5.197 4.929 5.393 . 0 0 "[ . 1 . 2]" 1
2323 1 74 ILE MG 1 85 ILE H . . 4.850 4.381 4.028 4.711 . 0 0 "[ . 1 . 2]" 1
2324 1 74 ILE MG 1 85 ILE MD . . 4.150 3.495 3.245 3.834 . 0 0 "[ . 1 . 2]" 1
2325 1 74 ILE MG 1 85 ILE HG13 . . 4.380 4.231 3.680 4.693 0.313 7 0 "[ . 1 . 2]" 1
2326 1 75 THR H 1 75 THR HB . . 3.780 3.670 3.636 3.709 . 0 0 "[ . 1 . 2]" 1
2327 1 75 THR H 1 75 THR MG . . 3.490 2.945 2.876 3.133 . 0 0 "[ . 1 . 2]" 1
2328 1 75 THR H 1 76 ALA H . . 4.690 4.489 4.438 4.520 . 0 0 "[ . 1 . 2]" 1
2329 1 75 THR H 1 84 SER HA . . 4.870 4.667 4.512 4.843 . 0 0 "[ . 1 . 2]" 1
2330 1 75 THR H 1 84 SER HB2 . . 5.500 5.474 4.944 6.014 0.514 8 1 "[ . + 1 . 2]" 1
2331 1 75 THR H 1 84 SER HB3 . . 5.500 5.316 4.957 5.655 0.155 8 0 "[ . 1 . 2]" 1
2332 1 75 THR HA 1 75 THR MG . . 3.070 2.318 2.288 2.353 . 0 0 "[ . 1 . 2]" 1
2333 1 75 THR HA 1 76 ALA H . . 2.850 2.225 2.132 2.301 . 0 0 "[ . 1 . 2]" 1
2334 1 75 THR HA 1 76 ALA HA . . 4.560 4.516 4.471 4.552 . 0 0 "[ . 1 . 2]" 1
2335 1 75 THR HA 1 76 ALA MB . . 4.300 3.820 3.714 3.934 . 0 0 "[ . 1 . 2]" 1
2336 1 75 THR HA 1 83 HIS H . . 5.170 4.743 4.170 5.076 . 0 0 "[ . 1 . 2]" 1
2337 1 75 THR HA 1 83 HIS HA . . 5.500 5.365 5.047 5.537 0.037 1 0 "[ . 1 . 2]" 1
2338 1 75 THR HA 1 84 SER H . . 4.720 4.672 4.382 4.880 0.160 18 0 "[ . 1 . 2]" 1
2339 1 75 THR HA 1 84 SER HA . . 3.330 2.400 2.181 2.638 . 0 0 "[ . 1 . 2]" 1
2340 1 75 THR HA 1 84 SER HB2 . . 4.560 3.946 3.391 4.537 . 0 0 "[ . 1 . 2]" 1
2341 1 75 THR HA 1 84 SER QB . . 3.830 3.050 2.547 3.516 . 0 0 "[ . 1 . 2]" 1
2342 1 75 THR HA 1 84 SER HB3 . . 4.560 3.176 2.632 3.683 . 0 0 "[ . 1 . 2]" 1
2343 1 75 THR HA 1 85 ILE H . . 3.920 4.007 3.667 4.252 0.332 18 0 "[ . 1 . 2]" 1
2344 1 75 THR HA 1 85 ILE MG . . 5.190 5.392 4.779 5.812 0.622 18 1 "[ . 1 . + 2]" 1
2345 1 75 THR HB 1 76 ALA H . . 3.190 2.875 2.600 3.085 . 0 0 "[ . 1 . 2]" 1
2346 1 75 THR HB 1 76 ALA HA . . 4.480 4.394 4.163 4.517 0.037 8 0 "[ . 1 . 2]" 1
2347 1 75 THR HB 1 76 ALA MB . . 4.690 4.810 4.704 4.905 0.215 12 0 "[ . 1 . 2]" 1
2348 1 75 THR HB 1 83 HIS H . . 5.340 5.089 4.316 5.629 0.289 17 0 "[ . 1 . 2]" 1
2349 1 75 THR HB 1 84 SER HA . . 4.850 4.714 4.423 5.040 0.190 18 0 "[ . 1 . 2]" 1
2350 1 75 THR HB 1 84 SER QB . . 4.670 4.123 3.830 4.479 . 0 0 "[ . 1 . 2]" 1
2351 1 75 THR MG 1 76 ALA H . . 3.470 3.636 3.492 3.713 0.243 8 0 "[ . 1 . 2]" 1
2352 1 75 THR MG 1 84 SER H . . 4.890 4.513 3.650 5.004 0.114 18 0 "[ . 1 . 2]" 1
2353 1 75 THR MG 1 84 SER HA . . 3.520 3.171 2.680 3.610 0.090 18 0 "[ . 1 . 2]" 1
2354 1 75 THR MG 1 84 SER HB2 . . 3.690 2.986 2.778 3.208 . 0 0 "[ . 1 . 2]" 1
2355 1 75 THR MG 1 84 SER QB . . 3.220 1.968 1.785 2.203 . 0 0 "[ . 1 . 2]" 1
2356 1 75 THR MG 1 84 SER HB3 . . 3.690 1.997 1.803 2.244 . 0 0 "[ . 1 . 2]" 1
2357 1 75 THR MG 1 85 ILE H . . 4.430 4.414 4.171 4.765 0.335 18 0 "[ . 1 . 2]" 1
2358 1 76 ALA H 1 76 ALA MB . . 3.400 2.747 2.554 2.852 . 0 0 "[ . 1 . 2]" 1
2359 1 76 ALA H 1 77 SER H . . 5.330 4.206 4.070 4.393 . 0 0 "[ . 1 . 2]" 1
2360 1 76 ALA H 1 77 SER HA . . 4.720 4.650 4.541 4.784 0.064 17 0 "[ . 1 . 2]" 1
2361 1 76 ALA H 1 82 THR HA . . 4.640 4.073 3.295 4.615 . 0 0 "[ . 1 . 2]" 1
2362 1 76 ALA H 1 83 HIS H . . 3.370 3.093 2.545 3.413 0.043 20 0 "[ . 1 . 2]" 1
2363 1 76 ALA H 1 83 HIS HA . . 4.750 4.846 4.594 5.006 0.256 1 0 "[ . 1 . 2]" 1
2364 1 76 ALA H 1 84 SER H . . 5.050 5.061 4.765 5.182 0.132 2 0 "[ . 1 . 2]" 1
2365 1 76 ALA H 1 84 SER HA . . 3.560 3.805 3.515 4.190 0.630 8 1 "[ . + 1 . 2]" 1
2366 1 76 ALA H 1 84 SER QB . . 4.390 4.431 3.914 4.950 0.560 8 1 "[ . + 1 . 2]" 1
2367 1 76 ALA HA 1 77 SER H . . 2.740 2.238 2.128 2.512 . 0 0 "[ . 1 . 2]" 1
2368 1 76 ALA HA 1 77 SER HA . . 4.660 4.429 4.375 4.530 . 0 0 "[ . 1 . 2]" 1
2369 1 76 ALA HA 1 77 SER QB . . 4.210 4.457 4.353 4.654 0.444 2 0 "[ . 1 . 2]" 1
2370 1 76 ALA HA 1 83 HIS H . . 4.810 4.926 4.599 5.127 0.317 20 0 "[ . 1 . 2]" 1
2371 1 76 ALA MB 1 77 SER H . . 3.020 2.930 2.153 3.314 0.294 4 0 "[ . 1 . 2]" 1
2372 1 76 ALA MB 1 77 SER HA . . 4.410 4.388 4.038 4.572 0.162 8 0 "[ . 1 . 2]" 1
2373 1 76 ALA MB 1 77 SER QB . . 4.390 4.603 4.185 4.922 0.532 20 2 "[ . 1 .- +]" 1
2374 1 76 ALA MB 1 78 PHE H . . 4.990 4.653 4.341 4.991 0.001 2 0 "[ . 1 . 2]" 1
2375 1 76 ALA MB 1 78 PHE HB2 . . 4.480 3.913 3.469 4.241 . 0 0 "[ . 1 . 2]" 1
2376 1 76 ALA MB 1 78 PHE HB3 . . 4.930 4.438 4.020 4.760 . 0 0 "[ . 1 . 2]" 1
2377 1 76 ALA MB 1 83 HIS H . . 4.110 3.934 3.456 4.377 0.267 12 0 "[ . 1 . 2]" 1
2378 1 76 ALA MB 1 83 HIS QB . . 4.110 3.496 2.882 4.308 0.198 12 0 "[ . 1 . 2]" 1
2379 1 76 ALA MB 1 84 SER HA . . 4.560 4.641 4.240 5.091 0.531 8 2 "[ - . + 1 . 2]" 1
2380 1 77 SER H 1 77 SER QB . . 3.020 2.478 2.369 2.722 . 0 0 "[ . 1 . 2]" 1
2381 1 77 SER H 1 78 PHE H . . 4.520 4.352 4.210 4.524 0.004 16 0 "[ . 1 . 2]" 1
2382 1 77 SER H 1 78 PHE HB3 . . 5.500 5.824 5.580 6.024 0.524 12 2 "[ . 1 + - 2]" 1
2383 1 77 SER H 1 83 HIS H . . 4.770 4.842 4.643 4.986 0.216 14 0 "[ . 1 . 2]" 1
2384 1 77 SER HA 1 78 PHE H . . 2.740 2.163 2.134 2.206 . 0 0 "[ . 1 . 2]" 1
2385 1 77 SER HA 1 78 PHE HA . . 4.520 4.473 4.445 4.499 . 0 0 "[ . 1 . 2]" 1
2386 1 77 SER HA 1 81 GLU H . . 4.650 4.743 4.369 5.089 0.439 16 0 "[ . 1 . 2]" 1
2387 1 77 SER HA 1 82 THR H . . 4.870 4.731 4.316 5.063 0.193 16 0 "[ . 1 . 2]" 1
2388 1 77 SER HA 1 82 THR HA . . 3.240 2.409 1.989 2.748 . 0 0 "[ . 1 . 2]" 1
2389 1 77 SER HA 1 82 THR HB . . 4.550 4.055 2.895 4.584 0.034 14 0 "[ . 1 . 2]" 1
2390 1 77 SER HA 1 82 THR MG . . 5.210 5.092 4.343 5.450 0.240 14 0 "[ . 1 . 2]" 1
2391 1 77 SER HA 1 83 HIS H . . 3.460 3.381 2.973 3.581 0.121 14 0 "[ . 1 . 2]" 1
2392 1 77 SER QB 1 78 PHE H . . 3.620 3.515 3.283 3.663 0.043 3 0 "[ . 1 . 2]" 1
2393 1 77 SER QB 1 78 PHE HA . . 4.050 4.386 4.201 4.758 0.708 20 1 "[ . 1 . +]" 1
2394 1 77 SER QB 1 82 THR HA . . 3.940 4.227 3.680 4.653 0.713 17 3 "[ * - 1 . + 2]" 1
2395 1 77 SER QB 1 83 HIS H . . 5.500 5.282 4.928 5.471 . 0 0 "[ . 1 . 2]" 1
2396 1 78 PHE H 1 78 PHE HB2 . . 3.760 3.336 3.145 3.497 . 0 0 "[ . 1 . 2]" 1
2397 1 78 PHE H 1 78 PHE HB3 . . 3.880 2.654 2.432 2.864 . 0 0 "[ . 1 . 2]" 1
2398 1 78 PHE H 1 79 ASP H . . 4.740 4.176 3.932 4.386 . 0 0 "[ . 1 . 2]" 1
2399 1 78 PHE H 1 80 GLY H . . 4.690 4.159 3.679 5.001 0.311 12 0 "[ . 1 . 2]" 1
2400 1 78 PHE H 1 81 GLU H . . 3.160 3.496 3.085 3.661 0.501 20 1 "[ . 1 . +]" 1
2401 1 78 PHE H 1 81 GLU HA . . 4.860 4.986 4.870 5.099 0.239 18 0 "[ . 1 . 2]" 1
2402 1 78 PHE H 1 81 GLU QB . . 4.060 3.954 3.371 4.596 0.536 2 1 "[ + . 1 . 2]" 1
2403 1 78 PHE H 1 81 GLU QG . . 5.110 5.423 4.985 6.007 0.897 2 5 "[ + . * ** - . 2]" 1
2404 1 78 PHE H 1 82 THR HA . . 3.410 3.272 2.738 3.611 0.201 3 0 "[ . 1 . 2]" 1
2405 1 78 PHE H 1 83 HIS H . . 4.320 3.371 2.643 4.122 . 0 0 "[ . 1 . 2]" 1
2406 1 78 PHE H 1 83 HIS QB . . 5.250 3.917 3.387 4.449 . 0 0 "[ . 1 . 2]" 1
2407 1 78 PHE HA 1 78 PHE HD1 . . 3.650 2.659 2.386 2.955 . 0 0 "[ . 1 . 2]" 1
2408 1 78 PHE HA 1 79 ASP HA . . 4.600 4.362 4.305 4.430 . 0 0 "[ . 1 . 2]" 1
2409 1 78 PHE HA 1 80 GLY H . . 3.950 3.849 3.280 4.601 0.651 12 2 "[ . 1 + . -]" 1
2410 1 78 PHE HA 1 81 GLU H . . 4.360 4.723 4.420 4.943 0.583 2 4 "[ + *. -*1 . 2]" 1
2411 1 78 PHE HB2 1 78 PHE HE1 . . 4.860 4.831 4.729 4.933 0.073 1 0 "[ . 1 . 2]" 1
2412 1 78 PHE HB2 1 79 ASP H . . 4.870 4.222 3.992 4.401 . 0 0 "[ . 1 . 2]" 1
2413 1 78 PHE HB3 1 79 ASP H . . 4.870 4.375 4.096 4.591 . 0 0 "[ . 1 . 2]" 1
2414 1 78 PHE HD1 1 79 ASP HA . . 5.500 5.047 4.351 6.027 0.527 7 1 "[ . + 1 . 2]" 1
2415 1 78 PHE HD1 1 79 ASP HB2 . . 5.010 4.317 3.733 5.464 0.454 4 0 "[ . 1 . 2]" 1
2416 1 79 ASP H 1 80 GLY H . . 4.600 2.693 2.506 2.904 . 0 0 "[ . 1 . 2]" 1
2417 1 79 ASP H 1 81 GLU H . . 4.580 4.211 3.948 4.445 . 0 0 "[ . 1 . 2]" 1
2418 1 79 ASP HA 1 80 GLY H . . 3.570 2.901 2.540 3.087 . 0 0 "[ . 1 . 2]" 1
2419 1 79 ASP HA 1 81 GLU H . . 4.280 4.391 4.193 4.568 0.288 2 0 "[ . 1 . 2]" 1
2420 1 79 ASP HB2 1 80 GLY H . . 4.680 4.574 4.141 4.672 . 0 0 "[ . 1 . 2]" 1
2421 1 79 ASP HB2 1 81 GLU H . . 4.940 4.849 3.792 5.129 0.189 12 0 "[ . 1 . 2]" 1
2422 1 79 ASP HB3 1 80 GLY H . . 4.320 4.184 3.987 4.471 0.151 12 0 "[ . 1 . 2]" 1
2423 1 79 ASP HB3 1 81 GLU H . . 3.960 3.669 3.112 4.589 0.629 4 1 "[ +. 1 . 2]" 1
2424 1 80 GLY H 1 81 GLU H . . 3.010 2.629 2.401 2.897 . 0 0 "[ . 1 . 2]" 1
2425 1 80 GLY H 1 81 GLU HA . . 5.500 5.181 4.894 5.354 . 0 0 "[ . 1 . 2]" 1
2426 1 80 GLY H 1 81 GLU QB . . 5.340 4.918 4.721 5.103 . 0 0 "[ . 1 . 2]" 1
2427 1 80 GLY H 1 81 GLU QG . . 4.750 4.725 4.303 5.013 0.263 2 0 "[ . 1 . 2]" 1
2428 1 80 GLY QA 1 81 GLU H . . 2.980 2.919 2.852 2.964 . 0 0 "[ . 1 . 2]" 1
2429 1 80 GLY QA 1 81 GLU HA . . 4.540 4.099 4.039 4.134 . 0 0 "[ . 1 . 2]" 1
2430 1 80 GLY HA2 1 81 GLU H . . 3.520 3.331 3.043 3.465 . 0 0 "[ . 1 . 2]" 1
2431 1 80 GLY HA2 1 81 GLU QG . . 4.560 4.819 4.514 5.080 0.520 1 1 "[+ . 1 . 2]" 1
2432 1 80 GLY HA3 1 81 GLU H . . 3.520 3.245 3.089 3.444 . 0 0 "[ . 1 . 2]" 1
2433 1 80 GLY HA3 1 81 GLU QG . . 4.560 3.889 3.625 4.191 . 0 0 "[ . 1 . 2]" 1
2434 1 81 GLU H 1 81 GLU QB . . 2.850 2.581 2.442 2.750 . 0 0 "[ . 1 . 2]" 1
2435 1 81 GLU H 1 81 GLU QG . . 2.930 2.691 2.292 3.180 0.250 2 0 "[ . 1 . 2]" 1
2436 1 81 GLU H 1 82 THR H . . 4.450 4.511 4.432 4.572 0.122 7 0 "[ . 1 . 2]" 1
2437 1 81 GLU HA 1 81 GLU QG . . 2.840 2.754 2.477 3.114 0.274 18 0 "[ . 1 . 2]" 1
2438 1 81 GLU HA 1 82 THR H . . 2.620 2.422 2.302 2.521 . 0 0 "[ . 1 . 2]" 1
2439 1 81 GLU HA 1 82 THR HA . . 4.800 4.486 4.396 4.548 . 0 0 "[ . 1 . 2]" 1
2440 1 81 GLU HA 1 82 THR HB . . 4.310 4.716 4.500 4.979 0.669 13 4 "[ * . -1 +*. 2]" 1
2441 1 81 GLU HA 1 82 THR MG . . 4.790 3.954 3.757 4.241 . 0 0 "[ . 1 . 2]" 1
2442 1 81 GLU QB 1 82 THR H . . 2.850 2.421 2.319 2.670 . 0 0 "[ . 1 . 2]" 1
2443 1 81 GLU QB 1 82 THR HB . . 4.950 5.058 4.957 5.173 0.223 3 0 "[ . 1 . 2]" 1
2444 1 81 GLU HB2 1 82 THR H . . 3.440 3.544 3.429 3.645 0.205 3 0 "[ . 1 . 2]" 1
2445 1 81 GLU HB3 1 82 THR H . . 3.440 2.466 2.351 2.745 . 0 0 "[ . 1 . 2]" 1
2446 1 81 GLU QG 1 82 THR H . . 4.270 4.162 3.906 4.464 0.194 18 0 "[ . 1 . 2]" 1
2447 1 82 THR H 1 82 THR HB . . 2.970 3.002 2.831 3.277 0.307 19 0 "[ . 1 . 2]" 1
2448 1 82 THR H 1 82 THR MG . . 3.320 2.099 1.988 2.272 . 0 0 "[ . 1 . 2]" 1
2449 1 82 THR H 1 83 HIS H . . 4.520 4.301 4.073 4.488 . 0 0 "[ . 1 . 2]" 1
2450 1 82 THR HA 1 82 THR MG . . 3.250 3.285 3.273 3.296 0.046 17 0 "[ . 1 . 2]" 1
2451 1 82 THR HA 1 83 HIS H . . 2.980 2.154 2.105 2.198 . 0 0 "[ . 1 . 2]" 1
2452 1 82 THR HA 1 83 HIS HA . . 5.160 4.470 4.449 4.494 . 0 0 "[ . 1 . 2]" 1
2453 1 82 THR HA 1 83 HIS QB . . 5.040 4.289 4.114 4.449 . 0 0 "[ . 1 . 2]" 1
2454 1 82 THR HB 1 83 HIS H . . 4.310 4.329 4.152 4.471 0.161 17 0 "[ . 1 . 2]" 1
2455 1 82 THR MG 1 83 HIS H . . 3.550 4.206 3.949 4.346 0.796 7 17 "[*-* * +**1**********]" 1
2456 1 82 THR MG 1 83 HIS QB . . 5.340 5.396 5.110 5.607 0.267 7 0 "[ . 1 . 2]" 1
2457 1 83 HIS H 1 83 HIS HB2 . . 3.830 2.632 2.383 2.950 . 0 0 "[ . 1 . 2]" 1
2458 1 83 HIS H 1 83 HIS QB . . 3.250 2.478 2.308 2.680 . 0 0 "[ . 1 . 2]" 1
2459 1 83 HIS H 1 83 HIS HB3 . . 3.830 3.366 2.468 3.854 0.024 6 0 "[ . 1 . 2]" 1
2460 1 83 HIS H 1 84 SER H . . 4.600 4.458 4.295 4.571 . 0 0 "[ . 1 . 2]" 1
2461 1 83 HIS H 1 84 SER HA . . 5.190 5.126 4.773 5.458 0.268 8 0 "[ . 1 . 2]" 1
2462 1 83 HIS H 1 84 SER QB . . 5.250 5.315 4.982 5.810 0.560 19 2 "[ . - 1 . +2]" 1
2463 1 83 HIS HA 1 84 SER H . . 2.680 2.198 2.100 2.459 . 0 0 "[ . 1 . 2]" 1
2464 1 83 HIS HA 1 84 SER HA . . 4.530 4.462 4.416 4.530 . 0 0 "[ . 1 . 2]" 1
2465 1 83 HIS HA 1 84 SER QB . . 4.380 4.339 4.170 4.509 0.129 4 0 "[ . 1 . 2]" 1
2466 1 83 HIS QB 1 84 SER H . . 3.440 3.194 2.258 3.730 0.290 19 0 "[ . 1 . 2]" 1
2467 1 83 HIS HB2 1 84 SER H . . 4.150 4.139 3.628 4.380 0.230 16 0 "[ . 1 . 2]" 1
2468 1 83 HIS HB3 1 84 SER H . . 4.150 3.373 2.280 4.245 0.095 19 0 "[ . 1 . 2]" 1
2469 1 84 SER H 1 84 SER HB2 . . 4.030 3.775 3.640 3.917 . 0 0 "[ . 1 . 2]" 1
2470 1 84 SER H 1 84 SER QB . . 3.350 3.030 2.813 3.209 . 0 0 "[ . 1 . 2]" 1
2471 1 84 SER H 1 84 SER HB3 . . 4.030 3.193 2.927 3.417 . 0 0 "[ . 1 . 2]" 1
2472 1 84 SER H 1 85 ILE H . . 4.450 4.414 4.255 4.513 0.063 3 0 "[ . 1 . 2]" 1
2473 1 84 SER H 1 85 ILE MG . . 4.310 4.419 4.041 4.759 0.449 3 0 "[ . 1 . 2]" 1
2474 1 84 SER HA 1 85 ILE H . . 2.980 2.223 2.173 2.286 . 0 0 "[ . 1 . 2]" 1
2475 1 84 SER HA 1 85 ILE HA . . 4.570 4.495 4.465 4.521 . 0 0 "[ . 1 . 2]" 1
2476 1 84 SER HA 1 85 ILE MD . . 5.500 5.441 5.270 5.618 0.118 14 0 "[ . 1 . 2]" 1
2477 1 84 SER HA 1 85 ILE HG12 . . 5.290 4.139 3.895 4.992 . 0 0 "[ . 1 . 2]" 1
2478 1 84 SER HA 1 85 ILE HG13 . . 4.930 4.900 3.970 5.066 0.136 20 0 "[ . 1 . 2]" 1
2479 1 84 SER HA 1 85 ILE MG . . 4.000 3.808 3.603 4.047 0.047 8 0 "[ . 1 . 2]" 1
2480 1 84 SER QB 1 85 ILE H . . 3.190 2.950 2.691 3.253 0.063 17 0 "[ . 1 . 2]" 1
2481 1 84 SER QB 1 85 ILE HA . . 4.480 4.422 4.315 4.608 0.128 17 0 "[ . 1 . 2]" 1
2482 1 84 SER QB 1 85 ILE MG . . 4.700 4.779 4.645 4.868 0.168 17 0 "[ . 1 . 2]" 1
2483 1 84 SER HB2 1 85 ILE H . . 4.010 3.033 2.742 3.383 . 0 0 "[ . 1 . 2]" 1
2484 1 84 SER HB2 1 85 ILE MG . . 5.480 5.134 4.969 5.282 . 0 0 "[ . 1 . 2]" 1
2485 1 84 SER HB3 1 85 ILE H . . 4.010 4.047 3.895 4.221 0.211 17 0 "[ . 1 . 2]" 1
2486 1 84 SER HB3 1 85 ILE MG . . 5.480 5.697 5.573 5.805 0.325 14 0 "[ . 1 . 2]" 1
2487 1 85 ILE H 1 85 ILE HB . . 4.000 3.835 3.804 3.887 . 0 0 "[ . 1 . 2]" 1
2488 1 85 ILE H 1 85 ILE MD . . 4.080 3.998 3.632 4.085 0.005 5 0 "[ . 1 . 2]" 1
2489 1 85 ILE H 1 85 ILE HG12 . . 3.620 2.558 2.423 3.399 . 0 0 "[ . 1 . 2]" 1
2490 1 85 ILE H 1 85 ILE HG13 . . 3.640 2.813 2.071 2.956 . 0 0 "[ . 1 . 2]" 1
2491 1 85 ILE H 1 85 ILE MG . . 3.360 2.971 2.880 3.162 . 0 0 "[ . 1 . 2]" 1
2492 1 85 ILE H 1 86 GLN H . . 4.460 4.447 4.409 4.493 0.033 17 0 "[ . 1 . 2]" 1
2493 1 85 ILE H 1 86 GLN HA . . 4.890 4.931 4.837 5.051 0.161 14 0 "[ . 1 . 2]" 1
2494 1 85 ILE H 1 87 LEU QD . . 4.640 4.656 4.191 5.277 0.637 16 7 "[* . ** * -+* 2]" 1
2495 1 85 ILE HA 1 85 ILE MD . . 4.160 4.205 3.881 4.245 0.085 18 0 "[ . 1 . 2]" 1
2496 1 85 ILE HA 1 85 ILE HG12 . . 4.130 3.939 3.886 4.279 0.149 17 0 "[ . 1 . 2]" 1
2497 1 85 ILE HA 1 85 ILE HG13 . . 3.770 3.712 3.678 3.736 . 0 0 "[ . 1 . 2]" 1
2498 1 85 ILE HA 1 85 ILE MG . . 3.050 2.407 2.372 2.444 . 0 0 "[ . 1 . 2]" 1
2499 1 85 ILE HA 1 86 GLN H . . 2.910 2.489 2.339 2.617 . 0 0 "[ . 1 . 2]" 1
2500 1 85 ILE HA 1 86 GLN HG3 . . 4.820 4.047 3.852 4.322 . 0 0 "[ . 1 . 2]" 1
2501 1 85 ILE HA 1 87 LEU QD . . 5.280 5.196 4.772 5.751 0.471 9 0 "[ . 1 . 2]" 1
2502 1 85 ILE HB 1 85 ILE MD . . 2.970 2.348 2.279 2.404 . 0 0 "[ . 1 . 2]" 1
2503 1 85 ILE HB 1 86 GLN H . . 3.080 2.191 1.993 2.441 . 0 0 "[ . 1 . 2]" 1
2504 1 85 ILE HB 1 87 LEU QD . . 4.940 3.890 3.607 4.451 . 0 0 "[ . 1 . 2]" 1
2505 1 85 ILE MD 1 85 ILE MG . . 2.800 2.201 2.068 3.048 0.248 17 0 "[ . 1 . 2]" 1
2506 1 85 ILE MD 1 86 GLN H . . 3.670 3.730 3.229 4.044 0.374 6 0 "[ . 1 . 2]" 1
2507 1 85 ILE MD 1 86 GLN HA . . 4.470 4.688 3.681 4.876 0.406 14 0 "[ . 1 . 2]" 1
2508 1 85 ILE MD 1 87 LEU H . . 4.590 5.005 4.194 5.127 0.537 13 5 "[ * -.* 1 +*. 2]" 1
2509 1 85 ILE MD 1 87 LEU QD . . 3.150 2.199 1.998 2.372 . 0 0 "[ . 1 . 2]" 1
2510 1 85 ILE MD 1 87 LEU HG . . 3.440 3.520 3.101 3.736 0.296 18 0 "[ . 1 . 2]" 1
2511 1 85 ILE HG12 1 85 ILE MG . . 2.790 2.381 2.240 2.417 . 0 0 "[ . 1 . 2]" 1
2512 1 85 ILE HG12 1 86 GLN H . . 4.530 4.632 4.440 4.933 0.403 17 0 "[ . 1 . 2]" 1
2513 1 85 ILE HG12 1 87 LEU QD . . 5.240 3.664 3.339 4.307 . 0 0 "[ . 1 . 2]" 1
2514 1 85 ILE HG13 1 85 ILE MG . . 3.380 3.236 2.908 3.265 . 0 0 "[ . 1 . 2]" 1
2515 1 85 ILE HG13 1 86 GLN H . . 3.700 3.546 3.298 4.338 0.638 17 1 "[ . 1 . + 2]" 1
2516 1 85 ILE HG13 1 87 LEU QD . . 3.720 2.651 2.170 3.941 0.221 17 0 "[ . 1 . 2]" 1
2517 1 85 ILE MG 1 86 GLN H . . 3.640 3.617 3.478 3.754 0.114 20 0 "[ . 1 . 2]" 1
2518 1 85 ILE MG 1 86 GLN HA . . 5.500 5.538 5.461 5.626 0.126 17 0 "[ . 1 . 2]" 1
2519 1 86 GLN H 1 86 GLN QE . . 5.500 4.907 4.699 5.512 0.012 3 0 "[ . 1 . 2]" 1
2520 1 86 GLN H 1 86 GLN HG3 . . 4.140 3.163 2.848 3.507 . 0 0 "[ . 1 . 2]" 1
2521 1 86 GLN H 1 87 LEU H . . 4.420 4.457 4.356 4.516 0.096 1 0 "[ . 1 . 2]" 1
2522 1 86 GLN H 1 87 LEU HA . . 5.230 5.115 4.963 5.287 0.057 17 0 "[ . 1 . 2]" 1
2523 1 86 GLN H 1 87 LEU QD . . 4.630 4.062 3.640 4.657 0.027 17 0 "[ . 1 . 2]" 1
2524 1 86 GLN HA 1 86 GLN QE . . 4.150 4.105 3.879 4.205 0.055 8 0 "[ . 1 . 2]" 1
2525 1 86 GLN HA 1 87 LEU H . . 3.310 2.210 2.137 2.286 . 0 0 "[ . 1 . 2]" 1
2526 1 86 GLN HA 1 87 LEU HA . . 4.530 4.476 4.415 4.519 . 0 0 "[ . 1 . 2]" 1
2527 1 86 GLN QB 1 87 LEU H . . 3.550 2.738 2.640 2.836 . 0 0 "[ . 1 . 2]" 1
2528 1 86 GLN QE 1 87 LEU H . . 5.500 4.325 4.209 4.449 . 0 0 "[ . 1 . 2]" 1
2529 1 86 GLN QE 1 88 PRO HA . . 5.500 5.656 5.012 5.916 0.416 4 0 "[ . 1 . 2]" 1
2530 1 86 GLN HG2 1 87 LEU H . . 4.050 3.959 3.680 4.170 0.120 9 0 "[ . 1 . 2]" 1
2531 1 86 GLN HG3 1 87 LEU H . . 5.050 4.871 4.670 5.003 . 0 0 "[ . 1 . 2]" 1
2532 1 87 LEU H 1 87 LEU HB2 . . 3.190 2.534 2.443 2.650 . 0 0 "[ . 1 . 2]" 1
2533 1 87 LEU H 1 87 LEU HB3 . . 3.950 3.702 3.645 3.778 . 0 0 "[ . 1 . 2]" 1
2534 1 87 LEU H 1 87 LEU MD1 . . 4.330 3.166 2.425 4.167 . 0 0 "[ . 1 . 2]" 1
2535 1 87 LEU H 1 87 LEU QD . . 3.430 2.909 2.412 3.454 0.024 9 0 "[ . 1 . 2]" 1
2536 1 87 LEU H 1 87 LEU MD2 . . 4.330 4.044 3.619 4.406 0.076 18 0 "[ . 1 . 2]" 1
2537 1 87 LEU H 1 88 PRO HD2 . . 4.880 4.942 4.863 5.012 0.132 15 0 "[ . 1 . 2]" 1
2538 1 87 LEU H 1 88 PRO HD3 . . 5.310 5.146 5.037 5.269 . 0 0 "[ . 1 . 2]" 1
2539 1 87 LEU HA 1 87 LEU MD1 . . 4.330 3.198 2.622 3.952 . 0 0 "[ . 1 . 2]" 1
2540 1 87 LEU HA 1 87 LEU QD . . 3.480 2.526 2.107 2.967 . 0 0 "[ . 1 . 2]" 1
2541 1 87 LEU HA 1 87 LEU MD2 . . 4.330 3.293 2.115 3.952 . 0 0 "[ . 1 . 2]" 1
2542 1 87 LEU HA 1 87 LEU HG . . 3.910 2.882 2.601 3.308 . 0 0 "[ . 1 . 2]" 1
2543 1 87 LEU HA 1 88 PRO HB3 . . 5.270 5.109 4.964 5.190 . 0 0 "[ . 1 . 2]" 1
2544 1 87 LEU HA 1 88 PRO HD2 . . 3.390 2.527 2.314 2.697 . 0 0 "[ . 1 . 2]" 1
2545 1 87 LEU HA 1 88 PRO HD3 . . 3.460 2.574 2.438 2.717 . 0 0 "[ . 1 . 2]" 1
2546 1 87 LEU HA 1 88 PRO HG2 . . 4.680 4.690 4.506 4.808 0.128 15 0 "[ . 1 . 2]" 1
2547 1 87 LEU HA 1 88 PRO HG3 . . 4.840 4.730 4.655 4.870 0.030 14 0 "[ . 1 . 2]" 1
2548 1 87 LEU HB2 1 88 PRO HD2 . . 4.260 3.824 3.596 3.998 . 0 0 "[ . 1 . 2]" 1
2549 1 87 LEU HB2 1 88 PRO HD3 . . 4.720 4.880 4.660 5.060 0.340 18 0 "[ . 1 . 2]" 1
2550 1 87 LEU HB3 1 88 PRO HA . . 5.230 4.847 4.640 5.057 . 0 0 "[ . 1 . 2]" 1
2551 1 87 LEU HB3 1 88 PRO HD2 . . 4.010 2.278 2.078 2.496 . 0 0 "[ . 1 . 2]" 1
2552 1 87 LEU HB3 1 88 PRO HD3 . . 4.020 3.693 3.463 3.928 . 0 0 "[ . 1 . 2]" 1
2553 1 87 LEU HB3 1 88 PRO HG2 . . 4.630 3.935 3.690 4.134 . 0 0 "[ . 1 . 2]" 1
2554 1 87 LEU QD 1 88 PRO HD2 . . 3.780 3.403 2.949 3.756 . 0 0 "[ . 1 . 2]" 1
2555 1 87 LEU QD 1 88 PRO HD3 . . 4.350 4.219 3.542 4.618 0.268 11 0 "[ . 1 . 2]" 1
2556 1 87 LEU QD 1 88 PRO HG2 . . 4.980 4.802 4.485 5.053 0.073 4 0 "[ . 1 . 2]" 1
2557 1 87 LEU QD 1 88 PRO HG3 . . 5.440 5.380 4.914 5.741 0.301 13 0 "[ . 1 . 2]" 1
2558 1 87 LEU MD1 1 88 PRO HD2 . . 5.150 4.287 3.913 4.701 . 0 0 "[ . 1 . 2]" 1
2559 1 87 LEU MD1 1 88 PRO HD3 . . 5.500 5.069 4.708 5.473 . 0 0 "[ . 1 . 2]" 1
2560 1 87 LEU MD2 1 88 PRO HD2 . . 5.150 3.583 3.021 4.022 . 0 0 "[ . 1 . 2]" 1
2561 1 87 LEU MD2 1 88 PRO HD3 . . 5.500 4.682 3.608 5.336 . 0 0 "[ . 1 . 2]" 1
2562 1 87 LEU HG 1 88 PRO HD2 . . 4.510 3.876 3.107 4.896 0.386 17 0 "[ . 1 . 2]" 1
2563 1 87 LEU HG 1 88 PRO HD3 . . 5.320 4.851 4.203 5.820 0.500 9 1 "[ . +1 . 2]" 1
2564 1 88 PRO HA 1 89 PRO HA . . 4.760 4.508 4.459 4.560 . 0 0 "[ . 1 . 2]" 1
2565 1 88 PRO HA 1 89 PRO HD2 . . 3.320 2.392 2.175 2.587 . 0 0 "[ . 1 . 2]" 1
2566 1 88 PRO HA 1 89 PRO HD3 . . 3.320 2.363 2.255 2.512 . 0 0 "[ . 1 . 2]" 1
2567 1 88 PRO HA 1 89 PRO HG2 . . 4.560 4.550 4.372 4.684 0.124 8 0 "[ . 1 . 2]" 1
2568 1 88 PRO HA 1 89 PRO HG3 . . 4.730 4.536 4.500 4.564 . 0 0 "[ . 1 . 2]" 1
2569 1 88 PRO HA 1 90 VAL QG . . 5.440 5.485 5.191 5.714 0.274 6 0 "[ . 1 . 2]" 1
2570 1 88 PRO HB2 1 89 PRO HD2 . . 4.160 3.248 3.070 3.407 . 0 0 "[ . 1 . 2]" 1
2571 1 88 PRO HB2 1 89 PRO HD3 . . 4.570 4.371 4.145 4.618 0.048 9 0 "[ . 1 . 2]" 1
2572 1 88 PRO HB2 1 90 VAL QG . . 4.600 4.466 3.874 4.783 0.183 18 0 "[ . 1 . 2]" 1
2573 1 88 PRO HB3 1 89 PRO HD2 . . 4.310 3.616 3.455 3.718 . 0 0 "[ . 1 . 2]" 1
2574 1 88 PRO HB3 1 89 PRO HD3 . . 4.580 4.445 4.239 4.657 0.077 4 0 "[ . 1 . 2]" 1
2575 1 88 PRO HB3 1 90 VAL QG . . 5.440 5.739 5.223 6.030 0.590 18 6 "[ **** 1- . + 2]" 1
2576 1 88 PRO HD2 1 90 VAL QG . . 5.310 5.113 4.756 5.524 0.214 8 0 "[ . 1 . 2]" 1
2577 1 88 PRO HG2 1 90 VAL QG . . 4.140 4.065 3.562 4.499 0.359 18 0 "[ . 1 . 2]" 1
2578 1 88 PRO HG3 1 90 VAL QG . . 5.210 5.411 4.815 5.878 0.668 18 2 "[ . -1 . + 2]" 1
2579 1 89 PRO HA 1 90 VAL H . . 2.680 2.181 2.093 2.319 . 0 0 "[ . 1 . 2]" 1
2580 1 89 PRO HA 1 90 VAL QG . . 4.000 3.318 3.266 3.392 . 0 0 "[ . 1 . 2]" 1
2581 1 89 PRO HB2 1 90 VAL H . . 3.490 3.389 2.849 3.596 0.106 6 0 "[ . 1 . 2]" 1
2582 1 89 PRO HB3 1 90 VAL H . . 3.960 3.937 3.727 4.135 0.175 16 0 "[ . 1 . 2]" 1
2583 1 89 PRO HD3 1 90 VAL H . . 5.500 5.616 5.474 5.736 0.236 19 0 "[ . 1 . 2]" 1
2584 1 89 PRO HG2 1 90 VAL H . . 4.910 4.863 4.463 5.036 0.126 9 0 "[ . 1 . 2]" 1
2585 1 89 PRO HG2 1 90 VAL HA . . 5.220 5.139 4.739 5.400 0.180 11 0 "[ . 1 . 2]" 1
2586 1 89 PRO HG3 1 90 VAL H . . 5.500 5.584 5.256 5.702 0.202 12 0 "[ . 1 . 2]" 1
2587 1 90 VAL H 1 90 VAL HB . . 3.940 3.762 3.671 3.892 . 0 0 "[ . 1 . 2]" 1
2588 1 90 VAL H 1 90 VAL MG1 . . 3.260 2.571 2.306 2.930 . 0 0 "[ . 1 . 2]" 1
2589 1 90 VAL H 1 90 VAL QG . . 2.850 2.067 1.935 2.259 . 0 0 "[ . 1 . 2]" 1
2590 1 90 VAL H 1 90 VAL MG2 . . 3.260 2.185 2.023 2.408 . 0 0 "[ . 1 . 2]" 1
2591 1 90 VAL H 1 91 ASN H . . 4.660 4.540 4.465 4.616 . 0 0 "[ . 1 . 2]" 1
2592 1 90 VAL HA 1 90 VAL MG1 . . 3.210 2.463 2.411 2.519 . 0 0 "[ . 1 . 2]" 1
2593 1 90 VAL HA 1 90 VAL MG2 . . 3.210 3.255 3.246 3.262 0.052 9 0 "[ . 1 . 2]" 1
2594 1 90 VAL HA 1 91 ASN QB . . 5.340 4.256 3.858 4.425 . 0 0 "[ . 1 . 2]" 1
2595 1 90 VAL HA 1 91 ASN QD . . 5.390 4.286 2.737 6.123 0.733 12 2 "[ . - 1 + . 2]" 1
2596 1 90 VAL HA 1 92 SER H . . 4.430 4.044 3.876 4.239 . 0 0 "[ . 1 . 2]" 1
2597 1 90 VAL HA 1 95 PHE QB . . 4.900 4.452 3.988 4.729 . 0 0 "[ . 1 . 2]" 1
2598 1 90 VAL HB 1 91 ASN HA . . 4.520 4.467 4.323 4.594 0.074 4 0 "[ . 1 . 2]" 1
2599 1 90 VAL HB 1 92 SER H . . 4.150 2.781 2.562 2.903 . 0 0 "[ . 1 . 2]" 1
2600 1 90 VAL HB 1 92 SER QB . . 5.310 4.205 3.719 4.527 . 0 0 "[ . 1 . 2]" 1
2601 1 90 VAL HB 1 95 PHE H . . 5.230 5.138 4.792 5.327 0.097 17 0 "[ . 1 . 2]" 1
2602 1 90 VAL HB 1 95 PHE QB . . 4.820 2.568 2.259 2.772 . 0 0 "[ . 1 . 2]" 1
2603 1 90 VAL HB 1 95 PHE HD1 . . 4.460 3.779 2.909 4.584 0.124 20 0 "[ . 1 . 2]" 1
2604 1 90 VAL HB 1 96 ALA H . . 5.030 4.859 4.396 5.150 0.120 8 0 "[ . 1 . 2]" 1
2605 1 90 VAL HB 1 96 ALA MB . . 5.150 5.326 4.961 5.612 0.462 13 0 "[ . 1 . 2]" 1
2606 1 90 VAL QG 1 91 ASN HA . . 4.190 3.402 3.089 3.650 . 0 0 "[ . 1 . 2]" 1
2607 1 90 VAL QG 1 91 ASN QD . . 5.440 4.939 4.050 5.918 0.478 11 0 "[ . 1 . 2]" 1
2608 1 90 VAL QG 1 92 SER H . . 3.460 3.244 2.932 3.518 0.058 3 0 "[ . 1 . 2]" 1
2609 1 90 VAL QG 1 92 SER QB . . 5.280 4.417 4.041 4.680 . 0 0 "[ . 1 . 2]" 1
2610 1 90 VAL QG 1 95 PHE H . . 5.020 4.731 4.456 4.896 . 0 0 "[ . 1 . 2]" 1
2611 1 90 VAL QG 1 95 PHE HA . . 4.610 4.579 4.260 4.836 0.226 12 0 "[ . 1 . 2]" 1
2612 1 90 VAL QG 1 95 PHE QB . . 3.370 2.831 2.465 3.085 . 0 0 "[ . 1 . 2]" 1
2613 1 90 VAL QG 1 95 PHE HD1 . . 3.140 2.351 1.994 3.028 . 0 0 "[ . 1 . 2]" 1
2614 1 90 VAL QG 1 96 ALA H . . 3.780 3.931 3.670 4.162 0.382 7 0 "[ . 1 . 2]" 1
2615 1 90 VAL QG 1 96 ALA HA . . 3.720 3.090 2.861 3.315 . 0 0 "[ . 1 . 2]" 1
2616 1 90 VAL QG 1 96 ALA MB . . 3.390 3.676 3.515 3.786 0.396 14 0 "[ . 1 . 2]" 1
2617 1 90 VAL QG 1 99 PHE QB . . 4.680 3.183 2.745 3.634 . 0 0 "[ . 1 . 2]" 1
2618 1 90 VAL MG1 1 91 ASN H . . 4.180 3.801 3.670 3.924 . 0 0 "[ . 1 . 2]" 1
2619 1 90 VAL MG1 1 95 PHE QB . . 4.040 3.047 2.509 3.357 . 0 0 "[ . 1 . 2]" 1
2620 1 90 VAL MG1 1 95 PHE HD1 . . 4.100 2.369 2.007 3.057 . 0 0 "[ . 1 . 2]" 1
2621 1 90 VAL MG1 1 96 ALA H . . 4.760 4.864 4.310 5.077 0.317 16 0 "[ . 1 . 2]" 1
2622 1 90 VAL MG1 1 96 ALA HA . . 4.400 4.074 3.711 4.432 0.032 16 0 "[ . 1 . 2]" 1
2623 1 90 VAL MG2 1 91 ASN H . . 4.180 3.216 2.973 3.617 . 0 0 "[ . 1 . 2]" 1
2624 1 90 VAL MG2 1 95 PHE QB . . 4.040 3.419 2.764 3.663 . 0 0 "[ . 1 . 2]" 1
2625 1 90 VAL MG2 1 95 PHE HD1 . . 4.100 4.026 3.452 4.917 0.817 6 1 "[ .+ 1 . 2]" 1
2626 1 90 VAL MG2 1 96 ALA H . . 4.760 4.167 3.780 4.490 . 0 0 "[ . 1 . 2]" 1
2627 1 90 VAL MG2 1 96 ALA HA . . 4.400 3.214 2.929 3.475 . 0 0 "[ . 1 . 2]" 1
2628 1 91 ASN H 1 91 ASN QB . . 3.640 3.131 2.706 3.284 . 0 0 "[ . 1 . 2]" 1
2629 1 91 ASN HA 1 91 ASN HB2 . . 2.910 2.523 2.424 3.059 0.149 5 0 "[ . 1 . 2]" 1
2630 1 91 ASN HA 1 91 ASN QB . . 2.540 2.232 2.194 2.418 . 0 0 "[ . 1 . 2]" 1
2631 1 91 ASN HA 1 91 ASN HB3 . . 2.910 2.518 2.416 3.049 0.139 12 0 "[ . 1 . 2]" 1
2632 1 91 ASN HA 1 91 ASN QD . . 3.840 3.996 3.563 4.382 0.542 1 2 "[+ . 1 -. 2]" 1
2633 1 91 ASN HA 1 92 SER H . . 3.230 3.232 3.078 3.417 0.187 12 0 "[ . 1 . 2]" 1
2634 1 91 ASN QB 1 92 SER H . . 4.190 3.939 3.404 4.078 . 0 0 "[ . 1 . 2]" 1
2635 1 91 ASN HB2 1 92 SER H . . 4.930 4.405 3.806 4.558 . 0 0 "[ . 1 . 2]" 1
2636 1 91 ASN HB3 1 92 SER H . . 4.930 4.473 3.532 4.630 . 0 0 "[ . 1 . 2]" 1
2637 1 92 SER H 1 93 ALA H . . 5.420 4.445 4.398 4.487 . 0 0 "[ . 1 . 2]" 1
2638 1 92 SER H 1 93 ALA HA . . 4.900 5.067 4.996 5.208 0.308 12 0 "[ . 1 . 2]" 1
2639 1 92 SER H 1 93 ALA MB . . 5.500 5.582 5.492 5.648 0.148 12 0 "[ . 1 . 2]" 1
2640 1 92 SER H 1 95 PHE H . . 4.590 4.299 4.059 4.476 . 0 0 "[ . 1 . 2]" 1
2641 1 92 SER H 1 95 PHE QB . . 4.030 3.050 2.728 3.279 . 0 0 "[ . 1 . 2]" 1
2642 1 92 SER H 1 96 ALA H . . 4.930 4.806 4.560 5.035 0.105 1 0 "[ . 1 . 2]" 1
2643 1 92 SER H 1 96 ALA MB . . 5.370 5.367 5.062 5.782 0.412 1 0 "[ . 1 . 2]" 1
2644 1 92 SER QB 1 94 SER H . . 4.930 3.670 2.867 4.081 . 0 0 "[ . 1 . 2]" 1
2645 1 92 SER QB 1 95 PHE H . . 4.200 2.931 2.692 3.260 . 0 0 "[ . 1 . 2]" 1
2646 1 92 SER QB 1 95 PHE QB . . 4.810 2.133 1.906 2.517 . 0 0 "[ . 1 . 2]" 1
2647 1 92 SER HB2 1 93 ALA H . . 5.500 4.053 3.938 4.163 . 0 0 "[ . 1 . 2]" 1
2648 1 92 SER HB2 1 93 ALA MB . . 5.500 5.539 5.296 5.685 0.185 16 0 "[ . 1 . 2]" 1
2649 1 92 SER HB3 1 93 ALA H . . 5.500 3.790 2.978 4.144 . 0 0 "[ . 1 . 2]" 1
2650 1 92 SER HB3 1 93 ALA MB . . 5.500 5.190 4.479 5.478 . 0 0 "[ . 1 . 2]" 1
2651 1 93 ALA H 1 94 SER H . . 5.500 2.563 2.424 2.695 . 0 0 "[ . 1 . 2]" 1
2652 1 93 ALA H 1 95 PHE H . . 5.500 3.908 3.691 4.088 . 0 0 "[ . 1 . 2]" 1
2653 1 93 ALA HA 1 96 ALA H . . 3.490 3.290 3.167 3.457 . 0 0 "[ . 1 . 2]" 1
2654 1 93 ALA HA 1 96 ALA MB . . 3.050 2.727 2.354 3.122 0.072 1 0 "[ . 1 . 2]" 1
2655 1 93 ALA HA 1 97 LEU H . . 4.890 4.927 4.546 5.094 0.204 20 0 "[ . 1 . 2]" 1
2656 1 93 ALA HA 1 97 LEU HG . . 5.430 5.429 4.561 6.273 0.843 20 7 "[ . ** 1 * -.** +]" 1
2657 1 93 ALA MB 1 94 SER H . . 4.190 2.689 2.466 2.805 . 0 0 "[ . 1 . 2]" 1
2658 1 93 ALA MB 1 94 SER HA . . 4.050 4.009 3.913 4.088 0.038 19 0 "[ . 1 . 2]" 1
2659 1 93 ALA MB 1 95 PHE H . . 4.870 4.362 4.252 4.511 . 0 0 "[ . 1 . 2]" 1
2660 1 93 ALA MB 1 96 ALA H . . 4.710 4.515 4.405 4.655 . 0 0 "[ . 1 . 2]" 1
2661 1 93 ALA MB 1 97 LEU H . . 5.060 5.291 4.955 5.486 0.426 19 0 "[ . 1 . 2]" 1
2662 1 94 SER H 1 94 SER QB . . 3.520 2.453 2.237 2.519 . 0 0 "[ . 1 . 2]" 1
2663 1 94 SER H 1 95 PHE H . . 4.820 2.597 2.454 2.734 . 0 0 "[ . 1 . 2]" 1
2664 1 94 SER H 1 95 PHE HA . . 5.500 5.223 5.121 5.334 . 0 0 "[ . 1 . 2]" 1
2665 1 94 SER H 1 95 PHE QB . . 5.500 4.363 4.213 4.555 . 0 0 "[ . 1 . 2]" 1
2666 1 94 SER H 1 96 ALA H . . 4.580 4.097 3.892 4.240 . 0 0 "[ . 1 . 2]" 1
2667 1 94 SER H 1 96 ALA MB . . 5.500 4.777 4.553 4.996 . 0 0 "[ . 1 . 2]" 1
2668 1 94 SER HA 1 96 ALA H . . 4.620 4.250 4.141 4.451 . 0 0 "[ . 1 . 2]" 1
2669 1 94 SER HA 1 97 LEU H . . 4.600 4.090 3.687 4.714 0.114 14 0 "[ . 1 . 2]" 1
2670 1 94 SER HA 1 97 LEU QD . . 3.670 2.930 2.156 3.825 0.155 6 0 "[ . 1 . 2]" 1
2671 1 94 SER HA 1 97 LEU HG . . 3.640 3.387 2.596 3.760 0.120 14 0 "[ . 1 . 2]" 1
2672 1 94 SER HA 1 98 ARG H . . 5.500 4.544 4.206 4.888 . 0 0 "[ . 1 . 2]" 1
2673 1 94 SER QB 1 95 PHE H . . 3.310 2.992 2.799 3.200 . 0 0 "[ . 1 . 2]" 1
2674 1 94 SER QB 1 95 PHE HA . . 4.080 4.064 3.911 4.340 0.260 16 0 "[ . 1 . 2]" 1
2675 1 94 SER QB 1 95 PHE QB . . 5.260 3.914 3.766 4.147 . 0 0 "[ . 1 . 2]" 1
2676 1 94 SER QB 1 98 ARG QB . . 4.800 4.297 3.796 4.890 0.090 16 0 "[ . 1 . 2]" 1
2677 1 95 PHE H 1 95 PHE QB . . 3.210 2.328 2.243 2.383 . 0 0 "[ . 1 . 2]" 1
2678 1 95 PHE H 1 95 PHE HD1 . . 5.350 4.977 4.813 5.081 . 0 0 "[ . 1 . 2]" 1
2679 1 95 PHE H 1 96 ALA MB . . 4.280 3.994 3.793 4.262 . 0 0 "[ . 1 . 2]" 1
2680 1 95 PHE H 1 97 LEU H . . 4.590 4.452 4.201 4.840 0.250 14 0 "[ . 1 . 2]" 1
2681 1 95 PHE H 1 97 LEU QD . . 5.500 4.959 4.250 5.541 0.041 6 0 "[ . 1 . 2]" 1
2682 1 95 PHE H 1 98 ARG QB . . 4.480 4.528 4.295 4.844 0.364 18 0 "[ . 1 . 2]" 1
2683 1 95 PHE H 1 98 ARG QD . . 5.500 5.781 5.402 6.074 0.574 18 4 "[* . - * . + 2]" 1
2684 1 95 PHE HA 1 95 PHE HD1 . . 3.460 3.253 2.410 3.620 0.160 18 0 "[ . 1 . 2]" 1
2685 1 95 PHE HA 1 96 ALA MB . . 5.140 4.974 4.905 5.019 . 0 0 "[ . 1 . 2]" 1
2686 1 95 PHE HA 1 97 LEU H . . 5.500 4.545 4.202 4.966 . 0 0 "[ . 1 . 2]" 1
2687 1 95 PHE HA 1 98 ARG H . . 3.710 3.373 3.028 3.728 0.018 10 0 "[ . 1 . 2]" 1
2688 1 95 PHE HA 1 98 ARG QB . . 2.990 2.131 1.877 2.506 . 0 0 "[ . 1 . 2]" 1
2689 1 95 PHE HA 1 98 ARG QD . . 3.350 3.243 3.047 3.643 0.293 4 0 "[ . 1 . 2]" 1
2690 1 95 PHE HA 1 98 ARG QG . . 4.110 4.007 3.543 4.497 0.387 18 0 "[ . 1 . 2]" 1
2691 1 95 PHE HA 1 99 PHE H . . 4.420 3.984 3.736 4.159 . 0 0 "[ . 1 . 2]" 1
2692 1 95 PHE HA 1 99 PHE QB . . 5.260 4.534 4.324 4.823 . 0 0 "[ . 1 . 2]" 1
2693 1 95 PHE QB 1 96 ALA H . . 3.240 2.998 2.774 3.099 . 0 0 "[ . 1 . 2]" 1
2694 1 95 PHE QB 1 96 ALA HA . . 4.740 4.162 3.947 4.291 . 0 0 "[ . 1 . 2]" 1
2695 1 95 PHE QB 1 96 ALA MB . . 4.960 4.360 4.104 4.453 . 0 0 "[ . 1 . 2]" 1
2696 1 95 PHE QB 1 98 ARG QB . . 4.860 4.134 3.844 4.435 . 0 0 "[ . 1 . 2]" 1
2697 1 95 PHE HD1 1 96 ALA H . . 4.970 4.570 4.285 4.697 . 0 0 "[ . 1 . 2]" 1
2698 1 95 PHE HD1 1 96 ALA HA . . 4.810 4.413 3.935 4.825 0.015 20 0 "[ . 1 . 2]" 1
2699 1 95 PHE HD1 1 96 ALA MB . . 5.500 5.428 5.108 5.648 0.148 20 0 "[ . 1 . 2]" 1
2700 1 95 PHE HD1 1 98 ARG QB . . 4.770 3.889 2.919 4.593 . 0 0 "[ . 1 . 2]" 1
2701 1 95 PHE HD1 1 98 ARG QG . . 5.500 5.358 4.446 5.920 0.420 18 0 "[ . 1 . 2]" 1
2702 1 95 PHE HD1 1 99 PHE HA . . 4.650 4.208 3.470 4.800 0.150 18 0 "[ . 1 . 2]" 1
2703 1 95 PHE HD1 1 99 PHE QB . . 4.750 2.711 2.454 2.877 . 0 0 "[ . 1 . 2]" 1
2704 1 96 ALA H 1 96 ALA MB . . 2.780 2.261 2.175 2.311 . 0 0 "[ . 1 . 2]" 1
2705 1 96 ALA H 1 97 LEU H . . 3.300 2.925 2.746 3.125 . 0 0 "[ . 1 . 2]" 1
2706 1 96 ALA H 1 97 LEU QD . . 5.080 4.221 3.439 4.516 . 0 0 "[ . 1 . 2]" 1
2707 1 96 ALA H 1 97 LEU HG . . 4.640 4.208 3.876 4.481 . 0 0 "[ . 1 . 2]" 1
2708 1 96 ALA H 1 98 ARG QB . . 5.120 4.628 4.296 4.983 . 0 0 "[ . 1 . 2]" 1
2709 1 96 ALA H 1 99 PHE QB . . 5.500 4.937 4.807 5.120 . 0 0 "[ . 1 . 2]" 1
2710 1 96 ALA HA 1 97 LEU QD . . 5.500 4.651 4.265 5.354 . 0 0 "[ . 1 . 2]" 1
2711 1 96 ALA HA 1 98 ARG H . . 4.180 4.782 4.545 5.003 0.823 15 15 "[ *****- *** * +* ***]" 1
2712 1 96 ALA HA 1 99 PHE H . . 4.320 4.145 3.949 4.353 0.033 4 0 "[ . 1 . 2]" 1
2713 1 96 ALA HA 1 99 PHE QB . . 3.790 3.495 3.318 3.675 . 0 0 "[ . 1 . 2]" 1
2714 1 96 ALA MB 1 97 LEU H . . 3.050 2.016 1.888 2.203 . 0 0 "[ . 1 . 2]" 1
2715 1 96 ALA MB 1 97 LEU HA . . 3.950 3.614 3.486 3.739 . 0 0 "[ . 1 . 2]" 1
2716 1 96 ALA MB 1 97 LEU HG . . 4.080 3.079 2.400 3.948 . 0 0 "[ . 1 . 2]" 1
2717 1 96 ALA MB 1 98 ARG H . . 4.190 4.210 4.057 4.379 0.189 11 0 "[ . 1 . 2]" 1
2718 1 96 ALA MB 1 99 PHE H . . 4.750 4.773 4.648 4.922 0.172 11 0 "[ . 1 . 2]" 1
2719 1 96 ALA MB 1 99 PHE QB . . 4.770 4.572 4.439 4.732 . 0 0 "[ . 1 . 2]" 1
2720 1 96 ALA MB 1 100 LEU QD . . 5.440 3.626 3.403 3.833 . 0 0 "[ . 1 . 2]" 1
2721 1 97 LEU H 1 97 LEU HB2 . . 4.040 3.042 2.595 3.604 . 0 0 "[ . 1 . 2]" 1
2722 1 97 LEU H 1 97 LEU QB . . 3.410 2.623 2.504 2.792 . 0 0 "[ . 1 . 2]" 1
2723 1 97 LEU H 1 97 LEU HB3 . . 4.040 3.227 2.558 3.604 . 0 0 "[ . 1 . 2]" 1
2724 1 97 LEU H 1 97 LEU QD . . 3.100 2.490 1.737 2.813 . 0 0 "[ . 1 . 2]" 1
2725 1 97 LEU H 1 97 LEU HG . . 2.690 2.084 1.884 2.411 . 0 0 "[ . 1 . 2]" 1
2726 1 97 LEU H 1 98 ARG H . . 3.400 2.589 2.468 2.699 . 0 0 "[ . 1 . 2]" 1
2727 1 97 LEU H 1 99 PHE QB . . 5.500 5.020 4.879 5.170 . 0 0 "[ . 1 . 2]" 1
2728 1 97 LEU HA 1 97 LEU QD . . 3.730 2.746 2.122 3.546 . 0 0 "[ . 1 . 2]" 1
2729 1 97 LEU HA 1 97 LEU HG . . 3.890 3.543 3.338 3.778 . 0 0 "[ . 1 . 2]" 1
2730 1 97 LEU HA 1 99 PHE H . . 4.270 4.152 4.000 4.326 0.056 9 0 "[ . 1 . 2]" 1
2731 1 97 LEU HA 1 100 LEU QD . . 3.020 2.175 2.011 2.430 . 0 0 "[ . 1 . 2]" 1
2732 1 97 LEU HA 1 100 LEU HG . . 4.910 4.443 2.557 5.007 0.097 1 0 "[ . 1 . 2]" 1
2733 1 97 LEU HA 1 101 GLU H . . 5.140 4.550 4.356 4.910 . 0 0 "[ . 1 . 2]" 1
2734 1 97 LEU QB 1 97 LEU QD . . 2.570 1.990 1.936 2.035 . 0 0 "[ . 1 . 2]" 1
2735 1 97 LEU QB 1 98 ARG H . . 3.820 2.845 2.205 3.557 . 0 0 "[ . 1 . 2]" 1
2736 1 97 LEU QB 1 115 SER H . . 4.470 4.350 3.411 5.101 0.631 11 2 "[ . -1+ . 2]" 1
2737 1 97 LEU HB2 1 97 LEU QD . . 3.260 2.294 2.177 2.410 . 0 0 "[ . 1 . 2]" 1
2738 1 97 LEU HB2 1 98 ARG H . . 4.620 2.972 2.227 3.848 . 0 0 "[ . 1 . 2]" 1
2739 1 97 LEU HB3 1 97 LEU QD . . 3.260 2.187 2.165 2.204 . 0 0 "[ . 1 . 2]" 1
2740 1 97 LEU HB3 1 98 ARG H . . 4.620 3.888 3.551 4.216 . 0 0 "[ . 1 . 2]" 1
2741 1 97 LEU QD 1 98 ARG H . . 4.380 3.523 2.357 4.047 . 0 0 "[ . 1 . 2]" 1
2742 1 97 LEU QD 1 98 ARG QB . . 5.500 4.186 2.656 5.009 . 0 0 "[ . 1 . 2]" 1
2743 1 97 LEU QD 1 115 SER H . . 4.120 3.338 2.527 4.191 0.071 12 0 "[ . 1 . 2]" 1
2744 1 97 LEU QD 1 115 SER HA . . 4.440 3.945 3.147 4.599 0.159 12 0 "[ . 1 . 2]" 1
2745 1 97 LEU QD 1 115 SER HB2 . . 3.530 2.271 1.771 3.179 . 0 0 "[ . 1 . 2]" 1
2746 1 97 LEU QD 1 115 SER QB . . 2.980 1.949 1.691 2.309 . 0 0 "[ . 1 . 2]" 1
2747 1 97 LEU QD 1 115 SER HB3 . . 3.530 2.329 1.886 3.320 . 0 0 "[ . 1 . 2]" 1
2748 1 97 LEU QD 1 116 GLN H . . 5.500 4.580 3.980 5.131 . 0 0 "[ . 1 . 2]" 1
2749 1 97 LEU QD 1 116 GLN QE . . 5.340 3.474 2.202 4.204 . 0 0 "[ . 1 . 2]" 1
2750 1 97 LEU HG 1 98 ARG H . . 5.120 3.162 1.912 4.035 . 0 0 "[ . 1 . 2]" 1
2751 1 97 LEU HG 1 115 SER QB . . 5.340 4.113 3.647 4.573 . 0 0 "[ . 1 . 2]" 1
2752 1 98 ARG H 1 98 ARG QB . . 2.580 2.224 2.185 2.257 . 0 0 "[ . 1 . 2]" 1
2753 1 98 ARG H 1 98 ARG QD . . 3.910 4.367 4.153 4.704 0.794 18 5 "[ - *1 ** + 2]" 1
2754 1 98 ARG H 1 98 ARG QG . . 4.470 4.032 3.973 4.106 . 0 0 "[ . 1 . 2]" 1
2755 1 98 ARG H 1 99 PHE H . . 3.230 2.741 2.552 2.896 . 0 0 "[ . 1 . 2]" 1
2756 1 98 ARG H 1 99 PHE QB . . 4.210 4.471 4.295 4.615 0.405 15 0 "[ . 1 . 2]" 1
2757 1 98 ARG H 1 100 LEU H . . 5.020 4.662 4.337 4.810 . 0 0 "[ . 1 . 2]" 1
2758 1 98 ARG H 1 100 LEU QD . . 5.440 4.111 4.005 4.440 . 0 0 "[ . 1 . 2]" 1
2759 1 98 ARG H 1 101 GLU H . . 5.010 4.785 4.614 5.010 0.000 2 0 "[ . 1 . 2]" 1
2760 1 98 ARG H 1 101 GLU QB . . 4.860 4.341 3.938 4.854 . 0 0 "[ . 1 . 2]" 1
2761 1 98 ARG H 1 101 GLU QG . . 4.980 4.559 3.867 4.999 0.019 8 0 "[ . 1 . 2]" 1
2762 1 98 ARG HA 1 98 ARG QB . . 2.760 2.360 2.320 2.393 . 0 0 "[ . 1 . 2]" 1
2763 1 98 ARG HA 1 98 ARG QD . . 3.730 3.813 3.527 4.283 0.553 18 1 "[ . 1 . + 2]" 1
2764 1 98 ARG HA 1 98 ARG QG . . 2.990 2.542 2.457 2.648 . 0 0 "[ . 1 . 2]" 1
2765 1 98 ARG HA 1 99 PHE QB . . 5.500 5.240 5.187 5.283 . 0 0 "[ . 1 . 2]" 1
2766 1 98 ARG HA 1 100 LEU QD . . 4.470 4.334 4.180 4.902 0.432 8 0 "[ . 1 . 2]" 1
2767 1 98 ARG HA 1 101 GLU H . . 3.540 3.427 3.084 3.611 0.071 2 0 "[ . 1 . 2]" 1
2768 1 98 ARG HA 1 101 GLU HB2 . . 3.800 2.210 1.872 2.503 . 0 0 "[ . 1 . 2]" 1
2769 1 98 ARG HA 1 101 GLU QB . . 3.070 2.170 1.856 2.481 . 0 0 "[ . 1 . 2]" 1
2770 1 98 ARG HA 1 101 GLU HB3 . . 3.800 3.389 2.546 4.055 0.255 7 0 "[ . 1 . 2]" 1
2771 1 98 ARG HA 1 101 GLU QG . . 2.980 3.115 2.499 3.585 0.605 3 3 "[ + . 1* - 2]" 1
2772 1 98 ARG HA 1 102 ASN QB . . 5.500 5.066 4.365 5.722 0.222 2 0 "[ . 1 . 2]" 1
2773 1 98 ARG QB 1 99 PHE H . . 3.250 2.853 2.601 3.011 . 0 0 "[ . 1 . 2]" 1
2774 1 98 ARG QB 1 99 PHE HA . . 5.210 4.172 3.969 4.312 . 0 0 "[ . 1 . 2]" 1
2775 1 98 ARG QB 1 100 LEU QD . . 5.440 4.889 4.774 5.302 . 0 0 "[ . 1 . 2]" 1
2776 1 98 ARG QB 1 101 GLU HB2 . . 5.470 4.291 4.029 4.560 . 0 0 "[ . 1 . 2]" 1
2777 1 98 ARG QB 1 101 GLU QB . . 4.720 4.098 3.847 4.417 . 0 0 "[ . 1 . 2]" 1
2778 1 98 ARG QB 1 101 GLU HB3 . . 5.470 5.269 4.578 5.917 0.447 7 0 "[ . 1 . 2]" 1
2779 1 98 ARG QB 1 101 GLU QG . . 5.340 4.685 4.086 5.227 . 0 0 "[ . 1 . 2]" 1
2780 1 98 ARG QD 1 99 PHE H . . 3.820 3.878 3.282 4.932 1.112 4 4 "[ +- 1 * * 2]" 1
2781 1 98 ARG QD 1 99 PHE QB . . 5.040 4.383 3.646 5.734 0.694 4 1 "[ +. 1 . 2]" 1
2782 1 98 ARG QD 1 101 GLU H . . 5.430 5.532 4.947 6.388 0.958 11 7 "[ *** -1+ * * 2]" 1
2783 1 98 ARG QG 1 99 PHE H . . 4.430 4.194 3.571 4.537 0.107 1 0 "[ . 1 . 2]" 1
2784 1 98 ARG QG 1 99 PHE HA . . 4.340 4.283 3.224 4.869 0.529 1 2 "[+ . 1 -. 2]" 1
2785 1 98 ARG QG 1 101 GLU H . . 4.880 4.894 4.436 5.156 0.276 7 0 "[ . 1 . 2]" 1
2786 1 98 ARG QG 1 101 GLU QB . . 3.940 3.615 3.315 3.985 0.045 11 0 "[ . 1 . 2]" 1
2787 1 98 ARG QG 1 101 GLU QG . . 5.280 4.797 4.210 5.398 0.118 11 0 "[ . 1 . 2]" 1
2788 1 98 ARG QG 1 102 ASN H . . 4.940 4.456 3.779 5.024 0.084 16 0 "[ . 1 . 2]" 1
2789 1 99 PHE H 1 99 PHE QB . . 3.180 2.222 2.113 2.280 . 0 0 "[ . 1 . 2]" 1
2790 1 99 PHE H 1 100 LEU H . . 3.020 2.733 2.344 2.820 . 0 0 "[ . 1 . 2]" 1
2791 1 99 PHE H 1 100 LEU QD . . 3.340 3.332 3.183 3.826 0.486 8 0 "[ . 1 . 2]" 1
2792 1 99 PHE H 1 101 GLU H . . 4.400 3.721 3.504 3.873 . 0 0 "[ . 1 . 2]" 1
2793 1 99 PHE H 1 101 GLU QB . . 4.860 4.415 4.050 4.820 . 0 0 "[ . 1 . 2]" 1
2794 1 99 PHE H 1 101 GLU QG . . 5.340 5.251 4.512 5.828 0.488 19 0 "[ . 1 . 2]" 1
2795 1 99 PHE HA 1 100 LEU QD . . 5.440 4.615 4.437 5.297 . 0 0 "[ . 1 . 2]" 1
2796 1 99 PHE HA 1 101 GLU QB . . 5.030 5.074 4.739 5.556 0.526 15 1 "[ . 1 + 2]" 1
2797 1 99 PHE HA 1 102 ASN H . . 4.210 4.373 3.855 4.871 0.661 2 2 "[ + . 1 . - 2]" 1
2798 1 99 PHE HA 1 102 ASN QB . . 4.570 4.082 3.161 4.993 0.423 2 0 "[ . 1 . 2]" 1
2799 1 99 PHE HA 1 103 PHE H . . 5.300 5.175 4.718 5.853 0.553 2 1 "[ + . 1 . 2]" 1
2800 1 99 PHE QB 1 100 LEU H . . 3.650 2.491 2.174 2.755 . 0 0 "[ . 1 . 2]" 1
2801 1 99 PHE QB 1 100 LEU HA . . 5.500 4.117 4.049 4.336 . 0 0 "[ . 1 . 2]" 1
2802 1 99 PHE QB 1 100 LEU QD . . 5.440 2.967 2.601 3.436 . 0 0 "[ . 1 . 2]" 1
2803 1 99 PHE QB 1 101 GLU H . . 5.500 4.419 4.255 4.588 . 0 0 "[ . 1 . 2]" 1
2804 1 100 LEU H 1 100 LEU HB2 . . 3.720 3.759 3.632 3.802 0.082 18 0 "[ . 1 . 2]" 1
2805 1 100 LEU H 1 100 LEU HB3 . . 3.310 3.004 2.767 3.150 . 0 0 "[ . 1 . 2]" 1
2806 1 100 LEU H 1 100 LEU QD . . 2.890 1.813 1.710 2.827 . 0 0 "[ . 1 . 2]" 1
2807 1 100 LEU H 1 100 LEU HG . . 3.580 3.891 2.008 4.054 0.474 5 0 "[ . 1 . 2]" 1
2808 1 100 LEU H 1 101 GLU H . . 3.300 2.423 2.183 2.605 . 0 0 "[ . 1 . 2]" 1
2809 1 100 LEU H 1 101 GLU QB . . 5.200 4.228 3.701 4.693 . 0 0 "[ . 1 . 2]" 1
2810 1 100 LEU H 1 101 GLU QG . . 4.820 4.768 4.087 5.363 0.543 19 2 "[ . 1 - . +2]" 1
2811 1 100 LEU H 1 102 ASN H . . 5.430 4.548 4.283 4.902 . 0 0 "[ . 1 . 2]" 1
2812 1 100 LEU HA 1 102 ASN H . . 4.490 4.310 4.007 4.558 0.068 8 0 "[ . 1 . 2]" 1
2813 1 100 LEU HA 1 102 ASN QB . . 5.500 4.834 4.509 5.169 . 0 0 "[ . 1 . 2]" 1
2814 1 100 LEU HA 1 103 PHE H . . 3.850 3.147 2.890 3.447 . 0 0 "[ . 1 . 2]" 1
2815 1 100 LEU HA 1 103 PHE HA . . 5.260 4.989 4.633 5.302 0.042 2 0 "[ . 1 . 2]" 1
2816 1 100 LEU HA 1 103 PHE HB2 . . 3.900 3.171 2.862 3.341 . 0 0 "[ . 1 . 2]" 1
2817 1 100 LEU HA 1 103 PHE HB3 . . 3.610 2.228 1.786 2.600 . 0 0 "[ . 1 . 2]" 1
2818 1 100 LEU HA 1 104 CYS H . . 4.060 3.786 3.328 4.106 0.046 17 0 "[ . 1 . 2]" 1
2819 1 100 LEU HB2 1 100 LEU QD . . 2.910 2.420 2.185 2.491 . 0 0 "[ . 1 . 2]" 1
2820 1 100 LEU HB2 1 101 GLU H . . 4.240 4.261 4.181 4.365 0.125 5 0 "[ . 1 . 2]" 1
2821 1 100 LEU HB2 1 101 GLU HA . . 5.080 4.769 4.590 4.993 . 0 0 "[ . 1 . 2]" 1
2822 1 100 LEU HB2 1 104 CYS H . . 4.430 4.110 3.749 4.662 0.232 8 0 "[ . 1 . 2]" 1
2823 1 100 LEU HB3 1 101 GLU H . . 4.670 4.470 4.250 4.584 . 0 0 "[ . 1 . 2]" 1
2824 1 100 LEU HB3 1 103 PHE HB3 . . 5.500 4.102 3.716 4.407 . 0 0 "[ . 1 . 2]" 1
2825 1 100 LEU HB3 1 113 LEU QD . . 5.000 4.733 4.105 5.117 0.117 3 0 "[ . 1 . 2]" 1
2826 1 100 LEU QD 1 101 GLU H . . 3.060 2.483 2.322 3.148 0.088 8 0 "[ . 1 . 2]" 1
2827 1 100 LEU QD 1 101 GLU HA . . 4.240 2.885 2.636 3.227 . 0 0 "[ . 1 . 2]" 1
2828 1 100 LEU QD 1 101 GLU QB . . 3.960 3.411 2.929 3.791 . 0 0 "[ . 1 . 2]" 1
2829 1 100 LEU QD 1 101 GLU QG . . 4.160 2.829 2.011 3.711 . 0 0 "[ . 1 . 2]" 1
2830 1 100 LEU QD 1 102 ASN H . . 4.690 4.485 4.261 4.969 0.279 8 0 "[ . 1 . 2]" 1
2831 1 100 LEU QD 1 113 LEU HG . . 3.720 2.827 2.171 3.706 . 0 0 "[ . 1 . 2]" 1
2832 1 100 LEU HG 1 101 GLU H . . 4.700 4.876 2.723 5.081 0.381 5 0 "[ . 1 . 2]" 1
2833 1 100 LEU HG 1 113 LEU QD . . 5.010 3.125 2.118 3.725 . 0 0 "[ . 1 . 2]" 1
2834 1 101 GLU H 1 101 GLU HB2 . . 3.570 2.238 2.026 2.452 . 0 0 "[ . 1 . 2]" 1
2835 1 101 GLU H 1 101 GLU QB . . 2.850 2.206 2.001 2.415 . 0 0 "[ . 1 . 2]" 1
2836 1 101 GLU H 1 101 GLU HB3 . . 3.570 3.366 2.800 3.662 0.092 15 0 "[ . 1 . 2]" 1
2837 1 101 GLU H 1 101 GLU QG . . 3.200 3.132 2.449 3.748 0.548 19 3 "[ . - 1 * . +2]" 1
2838 1 101 GLU H 1 102 ASN H . . 3.150 2.663 2.402 2.931 . 0 0 "[ . 1 . 2]" 1
2839 1 101 GLU H 1 102 ASN HA . . 5.440 5.314 5.094 5.506 0.066 2 0 "[ . 1 . 2]" 1
2840 1 101 GLU H 1 102 ASN QB . . 4.510 4.365 4.019 4.627 0.117 13 0 "[ . 1 . 2]" 1
2841 1 101 GLU H 1 103 PHE H . . 4.320 3.909 3.605 4.168 . 0 0 "[ . 1 . 2]" 1
2842 1 101 GLU H 1 103 PHE HB3 . . 4.920 4.818 4.449 5.108 0.188 1 0 "[ . 1 . 2]" 1
2843 1 101 GLU H 1 104 CYS QB . . 5.340 5.181 4.721 5.486 0.146 5 0 "[ . 1 . 2]" 1
2844 1 101 GLU HA 1 101 GLU QB . . 2.630 2.510 2.429 2.586 . 0 0 "[ . 1 . 2]" 1
2845 1 101 GLU HA 1 101 GLU QG . . 3.180 2.399 2.269 2.868 . 0 0 "[ . 1 . 2]" 1
2846 1 101 GLU HA 1 102 ASN HA . . 5.500 4.849 4.787 4.914 . 0 0 "[ . 1 . 2]" 1
2847 1 101 GLU HA 1 102 ASN QB . . 5.310 5.226 5.165 5.271 . 0 0 "[ . 1 . 2]" 1
2848 1 101 GLU HA 1 103 PHE H . . 4.480 4.370 4.065 4.598 0.118 14 0 "[ . 1 . 2]" 1
2849 1 101 GLU HA 1 104 CYS H . . 3.990 3.677 2.873 4.128 0.138 13 0 "[ . 1 . 2]" 1
2850 1 101 GLU HA 1 104 CYS QB . . 3.560 3.223 2.062 3.945 0.385 6 0 "[ . 1 . 2]" 1
2851 1 101 GLU HA 1 105 HIS H . . 4.430 4.169 3.952 4.466 0.036 17 0 "[ . 1 . 2]" 1
2852 1 101 GLU QB 1 102 ASN H . . 2.920 2.560 2.309 2.740 . 0 0 "[ . 1 . 2]" 1
2853 1 101 GLU QB 1 102 ASN HA . . 4.090 3.965 3.796 4.154 0.064 15 0 "[ . 1 . 2]" 1
2854 1 101 GLU QB 1 102 ASN QB . . 4.160 3.856 3.641 4.089 . 0 0 "[ . 1 . 2]" 1
2855 1 101 GLU QB 1 103 PHE H . . 4.630 4.597 4.428 4.779 0.149 16 0 "[ . 1 . 2]" 1
2856 1 101 GLU HB2 1 102 ASN H . . 3.440 2.979 2.574 3.464 0.024 19 0 "[ . 1 . 2]" 1
2857 1 101 GLU HB2 1 102 ASN QB . . 4.850 4.524 3.983 5.018 0.168 12 0 "[ . 1 . 2]" 1
2858 1 101 GLU HB2 1 103 PHE H . . 5.310 5.162 4.840 5.436 0.126 19 0 "[ . 1 . 2]" 1
2859 1 101 GLU HB3 1 102 ASN H . . 3.440 3.046 2.355 3.623 0.183 3 0 "[ . 1 . 2]" 1
2860 1 101 GLU HB3 1 102 ASN QB . . 4.850 4.358 3.750 5.033 0.183 3 0 "[ . 1 . 2]" 1
2861 1 101 GLU HB3 1 103 PHE H . . 5.310 5.217 4.766 5.626 0.316 14 0 "[ . 1 . 2]" 1
2862 1 101 GLU QG 1 102 ASN H . . 4.620 4.348 4.162 4.579 . 0 0 "[ . 1 . 2]" 1
2863 1 102 ASN H 1 102 ASN QB . . 2.720 2.237 2.182 2.292 . 0 0 "[ . 1 . 2]" 1
2864 1 102 ASN H 1 102 ASN QD . . 4.520 4.392 4.289 4.494 . 0 0 "[ . 1 . 2]" 1
2865 1 102 ASN H 1 103 PHE H . . 3.410 2.605 2.517 2.680 . 0 0 "[ . 1 . 2]" 1
2866 1 102 ASN H 1 103 PHE HA . . 5.120 5.255 5.194 5.316 0.196 6 0 "[ . 1 . 2]" 1
2867 1 102 ASN H 1 103 PHE HB3 . . 4.480 4.697 4.532 4.823 0.343 6 0 "[ . 1 . 2]" 1
2868 1 102 ASN H 1 104 CYS H . . 4.170 4.349 3.979 4.654 0.484 13 0 "[ . 1 . 2]" 1
2869 1 102 ASN H 1 105 HIS H . . 4.830 4.750 4.676 4.878 0.048 6 0 "[ . 1 . 2]" 1
2870 1 102 ASN HA 1 102 ASN QB . . 2.790 2.388 2.343 2.481 . 0 0 "[ . 1 . 2]" 1
2871 1 102 ASN HA 1 102 ASN QD . . 4.300 3.309 2.034 3.815 . 0 0 "[ . 1 . 2]" 1
2872 1 102 ASN HA 1 104 CYS H . . 4.630 4.770 4.478 4.984 0.354 13 0 "[ . 1 . 2]" 1
2873 1 102 ASN HA 1 105 HIS H . . 3.730 3.687 3.528 3.942 0.212 6 0 "[ . 1 . 2]" 1
2874 1 102 ASN HA 1 105 HIS QB . . 3.380 2.610 2.301 2.899 . 0 0 "[ . 1 . 2]" 1
2875 1 102 ASN HA 1 105 HIS HD2 . . 4.470 5.008 4.311 5.150 0.680 5 16 "[* -*+* *******. ****]" 1
2876 1 102 ASN QB 1 103 PHE H . . 3.230 2.651 2.465 2.844 . 0 0 "[ . 1 . 2]" 1
2877 1 102 ASN QD 1 103 PHE H . . 4.640 3.682 3.224 4.436 . 0 0 "[ . 1 . 2]" 1
2878 1 102 ASN QD 1 103 PHE HA . . 4.860 3.559 2.897 4.600 . 0 0 "[ . 1 . 2]" 1
2879 1 102 ASN QD 1 103 PHE HB2 . . 5.500 4.432 3.469 5.909 0.409 11 0 "[ . 1 . 2]" 1
2880 1 102 ASN QD 1 104 CYS H . . 5.500 5.596 5.327 5.872 0.372 6 0 "[ . 1 . 2]" 1
2881 1 102 ASN QD 1 105 HIS H . . 5.500 5.307 4.582 5.735 0.235 10 0 "[ . 1 . 2]" 1
2882 1 102 ASN QD 1 105 HIS HB2 . . 5.480 5.569 4.399 6.118 0.638 2 8 "[*+ . - 1 **.* * *]" 1
2883 1 102 ASN QD 1 105 HIS QB . . 4.670 4.276 3.138 4.848 0.178 18 0 "[ . 1 . 2]" 1
2884 1 102 ASN QD 1 105 HIS HB3 . . 5.480 4.451 3.205 5.111 . 0 0 "[ . 1 . 2]" 1
2885 1 103 PHE H 1 103 PHE HB2 . . 3.310 2.643 2.580 2.760 . 0 0 "[ . 1 . 2]" 1
2886 1 103 PHE H 1 103 PHE HB3 . . 3.230 2.411 2.238 2.488 . 0 0 "[ . 1 . 2]" 1
2887 1 103 PHE H 1 103 PHE QD . . 4.280 4.213 4.107 4.246 . 0 0 "[ . 1 . 2]" 1
2888 1 103 PHE H 1 104 CYS H . . 3.370 2.709 2.495 2.953 . 0 0 "[ . 1 . 2]" 1
2889 1 103 PHE H 1 104 CYS HA . . 5.070 5.340 5.173 5.514 0.444 20 0 "[ . 1 . 2]" 1
2890 1 103 PHE H 1 104 CYS QB . . 4.350 4.731 4.534 4.975 0.625 8 6 "[ ***+ 1 -. *]" 1
2891 1 103 PHE H 1 105 HIS H . . 3.860 3.868 3.725 4.013 0.153 20 0 "[ . 1 . 2]" 1
2892 1 103 PHE H 1 105 HIS QB . . 5.120 4.533 4.275 4.788 . 0 0 "[ . 1 . 2]" 1
2893 1 103 PHE HA 1 103 PHE QD . . 4.410 2.515 2.364 2.763 . 0 0 "[ . 1 . 2]" 1
2894 1 103 PHE HA 1 104 CYS HA . . 4.750 4.836 4.790 4.877 0.127 12 0 "[ . 1 . 2]" 1
2895 1 103 PHE HA 1 105 HIS H . . 4.480 4.226 4.052 4.425 . 0 0 "[ . 1 . 2]" 1
2896 1 103 PHE HA 1 106 SER H . . 4.050 3.592 3.246 4.008 . 0 0 "[ . 1 . 2]" 1
2897 1 103 PHE HA 1 107 LEU H . . 5.500 4.815 4.501 5.265 . 0 0 "[ . 1 . 2]" 1
2898 1 103 PHE HA 1 107 LEU MD1 . . 5.320 4.842 4.400 5.129 . 0 0 "[ . 1 . 2]" 1
2899 1 103 PHE HA 1 107 LEU QD . . 4.640 4.355 4.062 4.581 . 0 0 "[ . 1 . 2]" 1
2900 1 103 PHE HA 1 107 LEU MD2 . . 5.320 4.965 4.411 5.281 . 0 0 "[ . 1 . 2]" 1
2901 1 103 PHE HA 1 107 LEU HG . . 4.890 4.380 4.092 4.601 . 0 0 "[ . 1 . 2]" 1
2902 1 103 PHE HB2 1 104 CYS H . . 5.000 3.892 3.717 4.083 . 0 0 "[ . 1 . 2]" 1
2903 1 103 PHE HB3 1 104 CYS H . . 3.580 2.535 2.261 2.837 . 0 0 "[ . 1 . 2]" 1
2904 1 103 PHE HB3 1 105 HIS H . . 5.330 4.792 4.644 4.999 . 0 0 "[ . 1 . 2]" 1
2905 1 103 PHE QD 1 104 CYS H . . 4.270 3.541 2.977 3.891 . 0 0 "[ . 1 . 2]" 1
2906 1 103 PHE QD 1 105 HIS H . . 5.430 5.490 5.268 5.618 0.188 15 0 "[ . 1 . 2]" 1
2907 1 103 PHE QD 1 107 LEU QD . . 4.040 3.042 2.752 3.305 . 0 0 "[ . 1 . 2]" 1
2908 1 103 PHE QD 1 107 LEU HG . . 5.070 4.112 3.887 4.385 . 0 0 "[ . 1 . 2]" 1
2909 1 103 PHE HZ 1 107 LEU QD . . 3.870 2.684 2.574 2.874 . 0 0 "[ . 1 . 2]" 1
2910 1 104 CYS H 1 104 CYS HB2 . . 3.710 2.827 2.431 3.648 . 0 0 "[ . 1 . 2]" 1
2911 1 104 CYS H 1 104 CYS QB . . 3.090 2.468 2.394 2.568 . 0 0 "[ . 1 . 2]" 1
2912 1 104 CYS H 1 104 CYS HB3 . . 3.710 3.292 2.557 3.632 . 0 0 "[ . 1 . 2]" 1
2913 1 104 CYS H 1 105 HIS H . . 3.390 2.560 2.404 2.714 . 0 0 "[ . 1 . 2]" 1
2914 1 104 CYS H 1 105 HIS HA . . 5.200 5.208 5.085 5.331 0.131 13 0 "[ . 1 . 2]" 1
2915 1 104 CYS H 1 105 HIS HB2 . . 5.250 4.757 4.500 5.004 . 0 0 "[ . 1 . 2]" 1
2916 1 104 CYS H 1 105 HIS QB . . 4.420 4.277 4.073 4.464 0.044 16 0 "[ . 1 . 2]" 1
2917 1 104 CYS H 1 105 HIS HB3 . . 5.250 4.861 4.558 5.151 . 0 0 "[ . 1 . 2]" 1
2918 1 104 CYS H 1 107 LEU H . . 5.340 4.796 4.597 5.013 . 0 0 "[ . 1 . 2]" 1
2919 1 104 CYS H 1 107 LEU MD1 . . 5.500 4.180 3.892 4.577 . 0 0 "[ . 1 . 2]" 1
2920 1 104 CYS H 1 107 LEU QD . . 4.460 4.084 3.825 4.452 . 0 0 "[ . 1 . 2]" 1
2921 1 104 CYS H 1 107 LEU MD2 . . 5.500 5.784 5.340 6.087 0.587 18 3 "[- *. 1 . + 2]" 1
2922 1 104 CYS HA 1 107 LEU H . . 3.370 3.175 2.980 3.442 0.072 20 0 "[ . 1 . 2]" 1
2923 1 104 CYS HA 1 107 LEU HB2 . . 3.550 2.532 2.275 2.768 . 0 0 "[ . 1 . 2]" 1
2924 1 104 CYS HA 1 107 LEU HB3 . . 4.760 4.075 3.814 4.424 . 0 0 "[ . 1 . 2]" 1
2925 1 104 CYS HA 1 107 LEU MD1 . . 4.240 2.171 1.917 2.774 . 0 0 "[ . 1 . 2]" 1
2926 1 104 CYS HA 1 107 LEU QD . . 3.270 2.163 1.914 2.754 . 0 0 "[ . 1 . 2]" 1
2927 1 104 CYS HA 1 107 LEU MD2 . . 4.240 4.261 4.031 4.685 0.445 18 0 "[ . 1 . 2]" 1
2928 1 104 CYS HA 1 107 LEU HG . . 3.880 2.747 2.366 3.216 . 0 0 "[ . 1 . 2]" 1
2929 1 104 CYS QB 1 107 LEU H . . 4.730 4.627 4.529 4.756 0.026 2 0 "[ . 1 . 2]" 1
2930 1 104 CYS QB 1 107 LEU QD . . 4.860 3.566 3.032 4.329 . 0 0 "[ . 1 . 2]" 1
2931 1 104 CYS QB 1 108 GLN H . . 5.340 5.109 4.916 5.370 0.030 20 0 "[ . 1 . 2]" 1
2932 1 104 CYS QB 1 109 CYS H . . 4.150 3.847 3.603 4.210 0.060 2 0 "[ . 1 . 2]" 1
2933 1 104 CYS QB 1 110 ASP HA . . 4.120 4.174 3.701 4.756 0.636 17 2 "[ . -1 . + 2]" 1
2934 1 104 CYS HB2 1 105 HIS H . . 3.570 3.275 2.837 4.111 0.541 6 4 "[ *+-* 1 . 2]" 1
2935 1 104 CYS HB3 1 105 HIS H . . 3.570 3.947 3.821 4.135 0.565 6 4 "[ -+** 1 . 2]" 1
2936 1 105 HIS H 1 105 HIS HB2 . . 3.350 2.449 2.352 2.686 . 0 0 "[ . 1 . 2]" 1
2937 1 105 HIS H 1 105 HIS QB . . 2.910 2.231 2.171 2.278 . 0 0 "[ . 1 . 2]" 1
2938 1 105 HIS H 1 105 HIS HB3 . . 3.350 2.586 2.400 2.712 . 0 0 "[ . 1 . 2]" 1
2939 1 105 HIS H 1 106 SER H . . 3.400 2.603 2.524 2.811 . 0 0 "[ . 1 . 2]" 1
2940 1 105 HIS H 1 107 LEU H . . 4.310 3.869 3.738 4.004 . 0 0 "[ . 1 . 2]" 1
2941 1 105 HIS H 1 107 LEU QD . . 5.440 4.884 4.708 5.157 . 0 0 "[ . 1 . 2]" 1
2942 1 105 HIS H 1 108 GLN H . . 5.500 4.780 4.583 5.074 . 0 0 "[ . 1 . 2]" 1
2943 1 105 HIS HA 1 107 LEU H . . 4.260 4.119 3.769 4.346 0.086 13 0 "[ . 1 . 2]" 1
2944 1 105 HIS HA 1 107 LEU HG . . 5.500 6.074 5.923 6.176 0.676 2 17 "[*+***** *** ***- ***]" 1
2945 1 105 HIS HA 1 108 GLN H . . 3.800 3.447 3.220 3.734 . 0 0 "[ . 1 . 2]" 1
2946 1 105 HIS HA 1 108 GLN HA . . 4.690 3.672 3.346 4.361 . 0 0 "[ . 1 . 2]" 1
2947 1 105 HIS HA 1 109 CYS H . . 4.810 4.310 3.923 4.692 . 0 0 "[ . 1 . 2]" 1
2948 1 106 SER H 1 106 SER QB . . 3.160 2.489 2.250 2.657 . 0 0 "[ . 1 . 2]" 1
2949 1 106 SER H 1 107 LEU H . . 3.230 2.526 2.422 2.582 . 0 0 "[ . 1 . 2]" 1
2950 1 106 SER H 1 107 LEU HB2 . . 5.190 4.841 4.696 5.001 . 0 0 "[ . 1 . 2]" 1
2951 1 106 SER H 1 107 LEU MD1 . . 5.500 5.131 4.916 5.516 0.016 16 0 "[ . 1 . 2]" 1
2952 1 106 SER H 1 107 LEU QD . . 4.160 4.437 4.275 4.584 0.424 2 0 "[ . 1 . 2]" 1
2953 1 106 SER H 1 107 LEU MD2 . . 5.500 4.872 4.580 5.093 . 0 0 "[ . 1 . 2]" 1
2954 1 106 SER H 1 107 LEU HG . . 3.940 4.022 3.765 4.238 0.298 16 0 "[ . 1 . 2]" 1
2955 1 106 SER H 1 108 GLN H . . 4.100 3.882 3.713 4.204 0.104 20 0 "[ . 1 . 2]" 1
2956 1 106 SER QB 1 107 LEU H . . 3.820 3.048 2.690 3.749 . 0 0 "[ . 1 . 2]" 1
2957 1 106 SER QB 1 107 LEU QD . . 3.910 3.391 2.999 4.253 0.343 2 0 "[ . 1 . 2]" 1
2958 1 106 SER QB 1 108 GLN H . . 5.130 4.638 4.443 4.922 . 0 0 "[ . 1 . 2]" 1
2959 1 107 LEU H 1 107 LEU HB2 . . 3.420 2.570 2.468 2.682 . 0 0 "[ . 1 . 2]" 1
2960 1 107 LEU H 1 107 LEU HB3 . . 3.780 3.647 3.610 3.704 . 0 0 "[ . 1 . 2]" 1
2961 1 107 LEU H 1 107 LEU MD1 . . 4.070 3.718 3.558 3.950 . 0 0 "[ . 1 . 2]" 1
2962 1 107 LEU H 1 107 LEU QD . . 3.310 3.077 2.898 3.329 0.019 20 0 "[ . 1 . 2]" 1
2963 1 107 LEU H 1 107 LEU MD2 . . 4.070 3.294 2.988 3.611 . 0 0 "[ . 1 . 2]" 1
2964 1 107 LEU H 1 107 LEU HG . . 3.240 2.346 2.162 2.737 . 0 0 "[ . 1 . 2]" 1
2965 1 107 LEU H 1 108 GLN H . . 3.360 2.356 2.185 2.530 . 0 0 "[ . 1 . 2]" 1
2966 1 107 LEU H 1 108 GLN HA . . 4.770 4.560 4.387 4.738 . 0 0 "[ . 1 . 2]" 1
2967 1 107 LEU H 1 108 GLN HG3 . . 4.680 4.854 4.597 5.057 0.377 16 0 "[ . 1 . 2]" 1
2968 1 107 LEU H 1 109 CYS H . . 3.840 3.722 3.506 3.903 0.063 6 0 "[ . 1 . 2]" 1
2969 1 107 LEU H 1 109 CYS QB . . 5.340 5.578 5.351 5.740 0.400 13 0 "[ . 1 . 2]" 1
2970 1 107 LEU HA 1 107 LEU MD1 . . 4.050 3.939 3.851 3.976 . 0 0 "[ . 1 . 2]" 1
2971 1 107 LEU HA 1 107 LEU QD . . 2.970 2.178 2.109 2.281 . 0 0 "[ . 1 . 2]" 1
2972 1 107 LEU HA 1 107 LEU MD2 . . 4.050 2.188 2.118 2.296 . 0 0 "[ . 1 . 2]" 1
2973 1 107 LEU HA 1 107 LEU HG . . 3.620 3.273 3.163 3.483 . 0 0 "[ . 1 . 2]" 1
2974 1 107 LEU HA 1 108 GLN H . . 3.490 3.372 3.296 3.428 . 0 0 "[ . 1 . 2]" 1
2975 1 107 LEU HA 1 108 GLN HB2 . . 4.700 4.587 4.476 4.708 0.008 16 0 "[ . 1 . 2]" 1
2976 1 107 LEU HA 1 109 CYS H . . 4.760 4.378 4.287 4.541 . 0 0 "[ . 1 . 2]" 1
2977 1 107 LEU HB2 1 107 LEU MD1 . . 3.610 2.370 2.320 2.485 . 0 0 "[ . 1 . 2]" 1
2978 1 107 LEU HB2 1 107 LEU QD . . 3.130 2.316 2.273 2.413 . 0 0 "[ . 1 . 2]" 1
2979 1 107 LEU HB2 1 107 LEU MD2 . . 3.610 3.257 3.252 3.266 . 0 0 "[ . 1 . 2]" 1
2980 1 107 LEU HB2 1 108 GLN H . . 3.670 3.254 3.123 3.443 . 0 0 "[ . 1 . 2]" 1
2981 1 107 LEU HB2 1 108 GLN HA . . 5.140 5.011 4.828 5.263 0.123 18 0 "[ . 1 . 2]" 1
2982 1 107 LEU HB2 1 109 CYS H . . 3.820 2.538 2.315 2.925 . 0 0 "[ . 1 . 2]" 1
2983 1 107 LEU HB3 1 107 LEU MD1 . . 3.410 2.421 2.308 2.491 . 0 0 "[ . 1 . 2]" 1
2984 1 107 LEU HB3 1 107 LEU MD2 . . 3.410 2.471 2.419 2.645 . 0 0 "[ . 1 . 2]" 1
2985 1 107 LEU HB3 1 108 GLN H . . 4.410 4.183 4.085 4.322 . 0 0 "[ . 1 . 2]" 1
2986 1 107 LEU HB3 1 109 CYS H . . 4.250 3.601 3.353 4.036 . 0 0 "[ . 1 . 2]" 1
2987 1 107 LEU QD 1 108 GLN H . . 4.420 4.282 4.217 4.385 . 0 0 "[ . 1 . 2]" 1
2988 1 107 LEU QD 1 109 CYS H . . 4.300 4.105 3.895 4.460 0.160 18 0 "[ . 1 . 2]" 1
2989 1 107 LEU MD1 1 108 GLN H . . 5.160 5.001 4.838 5.191 0.031 16 0 "[ . 1 . 2]" 1
2990 1 107 LEU MD1 1 109 CYS H . . 5.270 4.316 4.058 4.763 . 0 0 "[ . 1 . 2]" 1
2991 1 107 LEU MD2 1 108 GLN H . . 5.160 4.660 4.537 4.756 . 0 0 "[ . 1 . 2]" 1
2992 1 107 LEU MD2 1 109 CYS H . . 5.270 5.149 5.016 5.378 0.108 18 0 "[ . 1 . 2]" 1
2993 1 107 LEU HG 1 108 GLN H . . 4.550 4.424 4.305 4.677 0.127 20 0 "[ . 1 . 2]" 1
2994 1 107 LEU HG 1 109 CYS H . . 5.000 4.804 4.507 5.165 0.165 20 0 "[ . 1 . 2]" 1
2995 1 108 GLN H 1 108 GLN HA . . 2.820 2.244 2.232 2.271 . 0 0 "[ . 1 . 2]" 1
2996 1 108 GLN H 1 108 GLN HB2 . . 4.060 3.677 3.584 3.724 . 0 0 "[ . 1 . 2]" 1
2997 1 108 GLN H 1 108 GLN HG2 . . 4.360 3.800 3.668 3.963 . 0 0 "[ . 1 . 2]" 1
2998 1 108 GLN H 1 108 GLN HG3 . . 3.350 3.104 2.994 3.345 . 0 0 "[ . 1 . 2]" 1
2999 1 108 GLN H 1 109 CYS H . . 3.010 2.613 2.549 2.661 . 0 0 "[ . 1 . 2]" 1
3000 1 108 GLN H 1 109 CYS QB . . 4.890 5.044 4.977 5.145 0.255 20 0 "[ . 1 . 2]" 1
3001 1 108 GLN HA 1 108 GLN QE . . 4.630 4.426 4.146 4.931 0.301 4 0 "[ . 1 . 2]" 1
3002 1 108 GLN HA 1 108 GLN HG2 . . 3.560 2.671 2.570 2.772 . 0 0 "[ . 1 . 2]" 1
3003 1 108 GLN HA 1 108 GLN HG3 . . 3.540 3.063 2.941 3.174 . 0 0 "[ . 1 . 2]" 1
3004 1 108 GLN HA 1 109 CYS H . . 3.290 3.179 3.104 3.266 . 0 0 "[ . 1 . 2]" 1
3005 1 108 GLN HA 1 109 CYS HA . . 4.860 4.702 4.639 4.768 . 0 0 "[ . 1 . 2]" 1
3006 1 108 GLN HA 1 109 CYS QB . . 5.340 5.367 5.317 5.409 0.069 11 0 "[ . 1 . 2]" 1
3007 1 108 GLN HB2 1 108 GLN QE . . 3.540 2.829 1.823 3.758 0.218 4 0 "[ . 1 . 2]" 1
3008 1 108 GLN HB2 1 109 CYS H . . 4.040 3.872 3.811 3.962 . 0 0 "[ . 1 . 2]" 1
3009 1 108 GLN QE 1 108 GLN HG3 . . 3.460 2.985 2.230 3.351 . 0 0 "[ . 1 . 2]" 1
3010 1 108 GLN HG2 1 109 CYS H . . 5.500 5.408 5.350 5.483 . 0 0 "[ . 1 . 2]" 1
3011 1 108 GLN HG3 1 109 CYS H . . 4.770 4.854 4.737 4.949 0.179 14 0 "[ . 1 . 2]" 1
3012 1 109 CYS H 1 109 CYS HB2 . . 3.960 3.650 3.615 3.690 . 0 0 "[ . 1 . 2]" 1
3013 1 109 CYS H 1 109 CYS QB . . 3.280 2.779 2.689 2.850 . 0 0 "[ . 1 . 2]" 1
3014 1 109 CYS H 1 109 CYS HB3 . . 3.960 2.882 2.769 2.979 . 0 0 "[ . 1 . 2]" 1
3015 1 109 CYS H 1 110 ASP HA . . 5.460 5.436 5.353 5.550 0.090 11 0 "[ . 1 . 2]" 1
3016 1 109 CYS H 1 110 ASP QB . . 5.120 4.969 4.683 5.905 0.785 15 1 "[ . 1 + 2]" 1
3017 1 109 CYS HA 1 110 ASP H . . 3.240 2.194 2.148 2.250 . 0 0 "[ . 1 . 2]" 1
3018 1 109 CYS HA 1 110 ASP HA . . 4.660 4.489 4.453 4.532 . 0 0 "[ . 1 . 2]" 1
3019 1 109 CYS QB 1 110 ASP H . . 3.270 2.965 2.755 3.085 . 0 0 "[ . 1 . 2]" 1
3020 1 109 CYS QB 1 112 LEU HB2 . . 3.990 2.851 2.544 3.105 . 0 0 "[ . 1 . 2]" 1
3021 1 109 CYS QB 1 112 LEU QD . . 3.890 2.391 2.055 2.727 . 0 0 "[ . 1 . 2]" 1
3022 1 110 ASP H 1 110 ASP HB2 . . 3.870 3.417 2.723 3.976 0.106 8 0 "[ . 1 . 2]" 1
3023 1 110 ASP H 1 110 ASP HB3 . . 3.870 3.044 2.718 3.830 . 0 0 "[ . 1 . 2]" 1
3024 1 110 ASP H 1 111 ASN H . . 4.390 4.361 4.287 4.433 0.043 15 0 "[ . 1 . 2]" 1
3025 1 110 ASP H 1 111 ASN QD . . 4.570 4.445 3.903 5.269 0.699 13 2 "[- . 1 + . 2]" 1
3026 1 110 ASP H 1 112 LEU H . . 4.520 3.938 3.614 4.350 . 0 0 "[ . 1 . 2]" 1
3027 1 110 ASP H 1 112 LEU HB2 . . 3.890 3.662 3.258 4.246 0.356 15 0 "[ . 1 . 2]" 1
3028 1 110 ASP H 1 112 LEU HB3 . . 5.240 4.608 4.340 5.288 0.048 15 0 "[ . 1 . 2]" 1
3029 1 110 ASP H 1 112 LEU QD . . 5.360 4.376 4.075 4.831 . 0 0 "[ . 1 . 2]" 1
3030 1 110 ASP HA 1 111 ASN H . . 3.120 2.327 2.159 2.481 . 0 0 "[ . 1 . 2]" 1
3031 1 110 ASP HA 1 111 ASN HA . . 4.690 4.423 4.291 4.531 . 0 0 "[ . 1 . 2]" 1
3032 1 110 ASP HA 1 112 LEU H . . 3.630 3.062 2.830 3.497 . 0 0 "[ . 1 . 2]" 1
3033 1 110 ASP HA 1 112 LEU HB2 . . 4.500 4.449 3.988 4.862 0.362 17 0 "[ . 1 . 2]" 1
3034 1 110 ASP HA 1 112 LEU HB3 . . 5.030 4.311 3.886 4.949 . 0 0 "[ . 1 . 2]" 1
3035 1 110 ASP HA 1 113 LEU H . . 5.110 4.937 4.599 5.547 0.437 17 0 "[ . 1 . 2]" 1
3036 1 110 ASP HA 1 113 LEU QD . . 4.720 4.402 3.861 4.960 0.240 17 0 "[ . 1 . 2]" 1
3037 1 110 ASP QB 1 111 ASN H . . 3.410 3.343 2.554 3.569 0.159 17 0 "[ . 1 . 2]" 1
3038 1 110 ASP QB 1 111 ASN QD . . 5.090 3.095 2.329 5.440 0.350 13 0 "[ . 1 . 2]" 1
3039 1 110 ASP QB 1 112 LEU H . . 4.840 4.651 4.450 4.775 . 0 0 "[ . 1 . 2]" 1
3040 1 110 ASP HB2 1 111 ASN H . . 4.130 3.849 2.766 4.083 . 0 0 "[ . 1 . 2]" 1
3041 1 110 ASP HB3 1 111 ASN H . . 4.130 3.771 2.592 4.009 . 0 0 "[ . 1 . 2]" 1
3042 1 111 ASN H 1 111 ASN HB2 . . 3.980 3.720 3.290 4.027 0.047 10 0 "[ . 1 . 2]" 1
3043 1 111 ASN H 1 111 ASN HB3 . . 3.980 3.907 2.923 4.138 0.158 20 0 "[ . 1 . 2]" 1
3044 1 111 ASN H 1 111 ASN QD . . 4.840 3.502 3.199 4.901 0.061 13 0 "[ . 1 . 2]" 1
3045 1 111 ASN H 1 112 LEU H . . 3.390 2.699 2.576 2.892 . 0 0 "[ . 1 . 2]" 1
3046 1 111 ASN H 1 112 LEU HB2 . . 5.210 5.099 4.909 5.335 0.125 16 0 "[ . 1 . 2]" 1
3047 1 111 ASN H 1 112 LEU HB3 . . 5.230 4.917 4.663 5.091 . 0 0 "[ . 1 . 2]" 1
3048 1 111 ASN H 1 113 LEU H . . 4.100 4.021 3.714 4.388 0.288 17 0 "[ . 1 . 2]" 1
3049 1 111 ASN H 1 113 LEU QD . . 4.650 4.352 3.762 4.839 0.189 14 0 "[ . 1 . 2]" 1
3050 1 111 ASN HA 1 111 ASN QD . . 4.540 3.803 3.622 4.085 . 0 0 "[ . 1 . 2]" 1
3051 1 111 ASN HA 1 112 LEU H . . 3.470 3.048 2.889 3.123 . 0 0 "[ . 1 . 2]" 1
3052 1 111 ASN HA 1 112 LEU HA . . 4.670 4.720 4.639 4.776 0.106 13 0 "[ . 1 . 2]" 1
3053 1 111 ASN HA 1 112 LEU HB2 . . 5.500 5.540 5.408 5.685 0.185 2 0 "[ . 1 . 2]" 1
3054 1 111 ASN HA 1 113 LEU H . . 3.880 3.392 2.919 3.678 . 0 0 "[ . 1 . 2]" 1
3055 1 111 ASN HA 1 113 LEU QD . . 5.210 4.504 3.798 4.970 . 0 0 "[ . 1 . 2]" 1
3056 1 111 ASN QB 1 112 LEU H . . 3.990 3.808 3.719 4.098 0.108 16 0 "[ . 1 . 2]" 1
3057 1 111 ASN QB 1 112 LEU HA . . 4.400 4.436 4.223 4.980 0.580 17 3 "[ . 1 * .-+ 2]" 1
3058 1 111 ASN HB2 1 111 ASN QD . . 3.440 2.436 2.147 3.302 . 0 0 "[ . 1 . 2]" 1
3059 1 111 ASN HB3 1 111 ASN QD . . 3.440 3.063 2.194 3.305 . 0 0 "[ . 1 . 2]" 1
3060 1 112 LEU H 1 112 LEU HB2 . . 2.890 2.671 2.590 2.809 . 0 0 "[ . 1 . 2]" 1
3061 1 112 LEU H 1 112 LEU HB3 . . 3.190 2.456 2.349 2.542 . 0 0 "[ . 1 . 2]" 1
3062 1 112 LEU H 1 112 LEU MD1 . . 5.500 4.243 4.199 4.341 . 0 0 "[ . 1 . 2]" 1
3063 1 112 LEU H 1 112 LEU QD . . 4.600 3.829 3.785 3.866 . 0 0 "[ . 1 . 2]" 1
3064 1 112 LEU H 1 112 LEU MD2 . . 5.500 4.359 4.294 4.405 . 0 0 "[ . 1 . 2]" 1
3065 1 112 LEU H 1 112 LEU HG . . 4.850 4.494 4.394 4.565 . 0 0 "[ . 1 . 2]" 1
3066 1 112 LEU H 1 113 LEU H . . 3.060 2.410 2.255 2.521 . 0 0 "[ . 1 . 2]" 1
3067 1 112 LEU H 1 113 LEU HA . . 5.190 5.046 4.912 5.148 . 0 0 "[ . 1 . 2]" 1
3068 1 112 LEU H 1 113 LEU QD . . 3.340 3.261 2.876 3.505 0.165 14 0 "[ . 1 . 2]" 1
3069 1 112 LEU HA 1 112 LEU MD1 . . 3.890 2.152 2.077 2.320 . 0 0 "[ . 1 . 2]" 1
3070 1 112 LEU HA 1 112 LEU QD . . 3.060 2.142 2.069 2.305 . 0 0 "[ . 1 . 2]" 1
3071 1 112 LEU HA 1 112 LEU MD2 . . 3.890 3.922 3.879 3.982 0.092 2 0 "[ . 1 . 2]" 1
3072 1 112 LEU HA 1 112 LEU HG . . 3.700 3.315 3.241 3.437 . 0 0 "[ . 1 . 2]" 1
3073 1 112 LEU HA 1 113 LEU QD . . 5.070 4.266 4.150 4.396 . 0 0 "[ . 1 . 2]" 1
3074 1 112 LEU HB2 1 112 LEU QD . . 3.010 2.191 2.182 2.205 . 0 0 "[ . 1 . 2]" 1
3075 1 112 LEU HB2 1 113 LEU H . . 4.760 4.206 4.132 4.308 . 0 0 "[ . 1 . 2]" 1
3076 1 112 LEU HB3 1 112 LEU MD1 . . 3.350 3.261 3.252 3.273 . 0 0 "[ . 1 . 2]" 1
3077 1 112 LEU HB3 1 112 LEU QD . . 2.920 2.371 2.323 2.404 . 0 0 "[ . 1 . 2]" 1
3078 1 112 LEU HB3 1 112 LEU MD2 . . 3.350 2.435 2.378 2.476 . 0 0 "[ . 1 . 2]" 1
3079 1 112 LEU HB3 1 113 LEU H . . 3.560 3.202 3.008 3.434 . 0 0 "[ . 1 . 2]" 1
3080 1 112 LEU HB3 1 113 LEU HA . . 5.120 5.154 5.077 5.222 0.102 1 0 "[ . 1 . 2]" 1
3081 1 112 LEU HB3 1 113 LEU QD . . 3.710 2.540 2.349 2.634 . 0 0 "[ . 1 . 2]" 1
3082 1 112 LEU HB3 1 113 LEU HG . . 4.840 5.033 4.899 5.110 0.270 14 0 "[ . 1 . 2]" 1
3083 1 112 LEU QD 1 113 LEU H . . 5.310 4.234 4.095 4.299 . 0 0 "[ . 1 . 2]" 1
3084 1 112 LEU HG 1 113 LEU H . . 5.280 4.350 3.981 4.587 . 0 0 "[ . 1 . 2]" 1
3085 1 112 LEU HG 1 113 LEU QB . . 4.910 3.563 3.143 3.806 . 0 0 "[ . 1 . 2]" 1
3086 1 113 LEU H 1 113 LEU HB2 . . 4.190 4.070 4.014 4.102 . 0 0 "[ . 1 . 2]" 1
3087 1 113 LEU H 1 113 LEU QB . . 3.630 3.302 3.248 3.337 . 0 0 "[ . 1 . 2]" 1
3088 1 113 LEU H 1 113 LEU HB3 . . 4.190 3.492 3.431 3.539 . 0 0 "[ . 1 . 2]" 1
3089 1 113 LEU H 1 113 LEU QD . . 2.960 2.171 2.052 2.248 . 0 0 "[ . 1 . 2]" 1
3090 1 113 LEU H 1 113 LEU HG . . 5.260 4.504 4.410 4.591 . 0 0 "[ . 1 . 2]" 1
3091 1 113 LEU H 1 114 SER H . . 4.500 4.343 4.244 4.389 . 0 0 "[ . 1 . 2]" 1
3092 1 113 LEU H 1 114 SER QB . . 4.620 4.784 4.448 5.211 0.591 7 4 "[* * . +- 1 . 2]" 1
3093 1 113 LEU HA 1 113 LEU QD . . 3.660 3.259 3.246 3.272 . 0 0 "[ . 1 . 2]" 1
3094 1 113 LEU HA 1 114 SER H . . 3.020 2.406 2.255 2.535 . 0 0 "[ . 1 . 2]" 1
3095 1 113 LEU HA 1 114 SER QB . . 4.930 4.271 4.002 4.376 . 0 0 "[ . 1 . 2]" 1
3096 1 113 LEU QB 1 113 LEU QD . . 2.760 2.110 2.085 2.126 . 0 0 "[ . 1 . 2]" 1
3097 1 113 LEU QB 1 114 SER H . . 3.510 2.429 2.187 2.672 . 0 0 "[ . 1 . 2]" 1
3098 1 113 LEU QD 1 114 SER H . . 3.550 2.984 2.691 3.277 . 0 0 "[ . 1 . 2]" 1
3099 1 113 LEU QD 1 114 SER QB . . 4.850 4.076 3.869 4.423 . 0 0 "[ . 1 . 2]" 1
3100 1 113 LEU HG 1 114 SER H . . 4.660 4.683 4.390 4.982 0.322 2 0 "[ . 1 . 2]" 1
3101 1 114 SER H 1 114 SER HB2 . . 3.970 3.626 2.892 4.060 0.090 13 0 "[ . 1 . 2]" 1
3102 1 114 SER H 1 114 SER QB . . 3.470 3.170 2.820 3.355 . 0 0 "[ . 1 . 2]" 1
3103 1 114 SER H 1 114 SER HB3 . . 3.970 3.691 3.109 4.048 0.078 6 0 "[ . 1 . 2]" 1
3104 1 114 SER H 1 115 SER H . . 4.400 4.013 3.729 4.268 . 0 0 "[ . 1 . 2]" 1
3105 1 114 SER H 1 115 SER HA . . 4.700 4.487 4.268 4.665 . 0 0 "[ . 1 . 2]" 1
3106 1 114 SER H 1 115 SER QB . . 5.340 5.279 4.849 5.863 0.523 6 1 "[ .+ 1 . 2]" 1
3107 1 114 SER H 1 116 GLN H . . 4.770 4.944 4.373 5.131 0.361 13 0 "[ . 1 . 2]" 1
3108 1 114 SER HA 1 115 SER H . . 2.920 2.203 2.100 2.316 . 0 0 "[ . 1 . 2]" 1
3109 1 114 SER HA 1 115 SER HB2 . . 5.060 4.574 4.341 4.702 . 0 0 "[ . 1 . 2]" 1
3110 1 114 SER HA 1 115 SER QB . . 4.260 4.193 4.041 4.512 0.252 6 0 "[ . 1 . 2]" 1
3111 1 114 SER HA 1 115 SER HB3 . . 5.060 4.910 4.627 5.814 0.754 6 3 "[- * .+ 1 . 2]" 1
3112 1 114 SER QB 1 116 GLN H . . 3.980 2.758 2.188 3.431 . 0 0 "[ . 1 . 2]" 1
3113 1 114 SER QB 1 116 GLN QB . . 4.370 3.518 2.321 4.699 0.329 11 0 "[ . 1 . 2]" 1
3114 1 114 SER QB 1 116 GLN QG . . 5.210 3.925 2.003 5.192 . 0 0 "[ . 1 . 2]" 1
3115 1 114 SER HB2 1 115 SER H . . 4.130 3.797 3.207 4.485 0.355 3 0 "[ . 1 . 2]" 1
3116 1 114 SER HB3 1 115 SER H . . 4.130 3.978 2.888 4.389 0.259 16 0 "[ . 1 . 2]" 1
3117 1 115 SER H 1 115 SER HB2 . . 3.840 2.575 2.461 2.647 . 0 0 "[ . 1 . 2]" 1
3118 1 115 SER H 1 115 SER HB3 . . 3.840 2.737 2.503 3.659 . 0 0 "[ . 1 . 2]" 1
3119 1 115 SER H 1 116 GLN H . . 3.140 2.614 2.410 3.260 0.120 6 0 "[ . 1 . 2]" 1
3120 1 115 SER H 1 116 GLN QB . . 4.460 4.625 4.470 4.852 0.392 14 0 "[ . 1 . 2]" 1
3121 1 115 SER H 1 116 GLN QE . . 5.500 3.451 2.340 5.068 . 0 0 "[ . 1 . 2]" 1
3122 1 115 SER H 1 116 GLN QG . . 4.610 4.277 3.374 5.053 0.443 10 0 "[ . 1 . 2]" 1
3123 1 115 SER HA 1 116 GLN QE . . 4.980 4.577 3.982 5.239 0.259 18 0 "[ . 1 . 2]" 1
3124 1 115 SER QB 1 116 GLN H . . 3.950 3.311 3.001 3.921 . 0 0 "[ . 1 . 2]" 1
3125 1 115 SER QB 1 116 GLN QE . . 4.450 2.942 2.063 4.358 . 0 0 "[ . 1 . 2]" 1
3126 1 115 SER HB2 1 116 GLN H . . 4.710 4.178 3.237 4.502 . 0 0 "[ . 1 . 2]" 1
3127 1 115 SER HB3 1 116 GLN H . . 4.710 3.560 3.082 4.444 . 0 0 "[ . 1 . 2]" 1
3128 1 116 GLN H 1 116 GLN QB . . 2.920 2.605 2.344 3.182 0.262 6 0 "[ . 1 . 2]" 1
3129 1 116 GLN H 1 116 GLN QE . . 4.830 2.992 1.779 3.809 . 0 0 "[ . 1 . 2]" 1
3130 1 116 GLN H 1 116 GLN QG . . 3.510 2.813 2.106 3.368 . 0 0 "[ . 1 . 2]" 1
3131 1 116 GLN H 1 117 PRO HD2 . . 4.920 4.952 4.802 5.072 0.152 9 0 "[ . 1 . 2]" 1
3132 1 116 GLN H 1 117 PRO HD3 . . 5.050 4.789 4.215 5.197 0.147 19 0 "[ . 1 . 2]" 1
3133 1 116 GLN HA 1 116 GLN QE . . 4.720 3.362 2.364 4.705 . 0 0 "[ . 1 . 2]" 1
3134 1 116 GLN HA 1 116 GLN QG . . 3.230 2.939 2.524 3.549 0.319 10 0 "[ . 1 . 2]" 1
3135 1 116 GLN HA 1 117 PRO HA . . 4.800 4.539 4.434 4.613 . 0 0 "[ . 1 . 2]" 1
3136 1 116 GLN HA 1 117 PRO HD2 . . 2.960 2.344 2.127 2.641 . 0 0 "[ . 1 . 2]" 1
3137 1 116 GLN HA 1 117 PRO HD3 . . 2.920 2.435 2.300 2.667 . 0 0 "[ . 1 . 2]" 1
3138 1 116 GLN HA 1 117 PRO HG2 . . 4.270 4.521 4.339 4.740 0.470 8 0 "[ . 1 . 2]" 1
3139 1 116 GLN HA 1 117 PRO HG3 . . 4.510 4.573 4.475 4.736 0.226 18 0 "[ . 1 . 2]" 1
3140 1 116 GLN QB 1 116 GLN QE . . 3.960 2.984 1.872 3.746 . 0 0 "[ . 1 . 2]" 1
3141 1 116 GLN QB 1 117 PRO HD2 . . 3.860 2.922 2.261 3.688 . 0 0 "[ . 1 . 2]" 1
3142 1 116 GLN QB 1 117 PRO HD3 . . 4.630 3.953 3.460 4.353 . 0 0 "[ . 1 . 2]" 1
3143 1 116 GLN HB2 1 116 GLN QE . . 4.560 3.565 1.881 4.069 . 0 0 "[ . 1 . 2]" 1
3144 1 116 GLN HB2 1 117 PRO HD3 . . 5.370 4.752 3.799 5.218 . 0 0 "[ . 1 . 2]" 1
3145 1 116 GLN HB3 1 116 GLN QE . . 4.560 3.468 1.947 4.379 . 0 0 "[ . 1 . 2]" 1
3146 1 116 GLN HB3 1 117 PRO HD3 . . 5.370 4.368 3.560 4.775 . 0 0 "[ . 1 . 2]" 1
3147 1 116 GLN QE 1 116 GLN QG . . 3.100 2.312 2.157 2.782 . 0 0 "[ . 1 . 2]" 1
3148 1 116 GLN QE 1 117 PRO HD2 . . 5.500 4.999 3.471 6.015 0.515 3 1 "[ + . 1 . 2]" 1
3149 1 116 GLN QG 1 117 PRO HD2 . . 4.130 4.177 3.505 4.856 0.726 5 1 "[ + 1 . 2]" 1
3150 1 116 GLN QG 1 117 PRO HD3 . . 4.780 4.868 4.408 5.145 0.365 13 0 "[ . 1 . 2]" 1
3151 1 117 PRO HA 1 118 PHE H . . 2.740 2.395 2.176 2.519 . 0 0 "[ . 1 . 2]" 1
3152 1 117 PRO HA 1 118 PHE HA . . 4.420 4.367 4.280 4.424 0.004 9 0 "[ . 1 . 2]" 1
3153 1 117 PRO HA 1 118 PHE QD . . 3.720 3.380 2.871 4.513 0.793 19 3 "[-* . 1 . +2]" 1
3154 1 117 PRO HA 1 119 SER H . . 4.460 4.150 3.640 4.600 0.140 5 0 "[ . 1 . 2]" 1
3155 1 117 PRO QB 1 118 PHE H . . 3.050 2.628 2.393 3.215 0.165 2 0 "[ . 1 . 2]" 1
3156 1 117 PRO QB 1 118 PHE HA . . 4.850 4.582 4.493 4.708 . 0 0 "[ . 1 . 2]" 1
3157 1 117 PRO QB 1 119 SER H . . 2.910 2.488 2.212 2.746 . 0 0 "[ . 1 . 2]" 1
3158 1 117 PRO HG2 1 118 PHE H . . 4.550 4.418 4.138 4.869 0.319 19 0 "[ . 1 . 2]" 1
3159 1 117 PRO HG2 1 119 SER H . . 3.590 3.666 3.070 4.266 0.676 19 2 "[ - . 1 . +2]" 1
3160 1 117 PRO HG3 1 118 PHE H . . 5.500 5.149 4.961 5.576 0.076 2 0 "[ . 1 . 2]" 1
3161 1 117 PRO HG3 1 119 SER H . . 4.670 4.767 4.344 5.169 0.499 2 0 "[ . 1 . 2]" 1
3162 1 118 PHE H 1 118 PHE HB2 . . 3.010 2.436 2.363 2.546 . 0 0 "[ . 1 . 2]" 1
3163 1 118 PHE H 1 118 PHE HB3 . . 4.010 3.616 3.594 3.651 . 0 0 "[ . 1 . 2]" 1
3164 1 118 PHE H 1 118 PHE HE1 . . 5.030 4.418 4.130 5.224 0.194 1 0 "[ . 1 . 2]" 1
3165 1 118 PHE H 1 119 SER H . . 2.830 2.525 2.354 2.792 . 0 0 "[ . 1 . 2]" 1
3166 1 118 PHE HA 1 118 PHE HB2 . . 2.990 3.043 3.032 3.051 0.061 19 0 "[ . 1 . 2]" 1
3167 1 118 PHE HA 1 118 PHE HB3 . . 2.880 2.542 2.449 2.586 . 0 0 "[ . 1 . 2]" 1
3168 1 118 PHE HA 1 118 PHE QD . . 3.150 3.010 2.009 3.203 0.053 6 0 "[ . 1 . 2]" 1
3169 1 118 PHE HB2 1 118 PHE HE1 . . 5.120 4.910 4.770 5.508 0.388 19 0 "[ . 1 . 2]" 1
3170 1 118 PHE HB2 1 119 SER H . . 3.080 3.090 2.578 3.572 0.492 1 0 "[ . 1 . 2]" 1
3171 1 118 PHE HB3 1 119 SER H . . 3.650 3.940 3.489 4.321 0.671 2 3 "[*+ . - . 2]" 1
3172 1 118 PHE QD 1 119 SER H . . 4.810 4.280 4.031 4.690 . 0 0 "[ . 1 . 2]" 1
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