NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
406152 |
1xfr   |
4849 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1xfr
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 2201
_Distance_constraint_stats_list.Viol_count 5715
_Distance_constraint_stats_list.Viol_total 10229.250
_Distance_constraint_stats_list.Viol_max 0.973
_Distance_constraint_stats_list.Viol_rms 0.0475
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0116
_Distance_constraint_stats_list.Viol_average_violations_only 0.0895
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 SER 7.381 0.884 18 3 "[- . 1 . *+ 2]"
1 2 GLN 5.568 0.801 6 4 "[ .+ * -. * 2]"
1 3 GLU 5.326 0.884 18 3 "[- . 1 . *+ 2]"
1 4 VAL 5.158 0.398 13 0 "[ . 1 . 2]"
1 5 MET 26.091 0.899 11 14 "[* **. *- *+****** *2]"
1 6 LYS 0.096 0.096 13 0 "[ . 1 . 2]"
1 7 ASN 7.283 0.899 19 1 "[ . 1 . +2]"
1 8 LEU 3.141 0.104 9 0 "[ . 1 . 2]"
1 9 SER 1.254 0.092 7 0 "[ . 1 . 2]"
1 10 LEU 6.463 0.180 19 0 "[ . 1 . 2]"
1 11 ASN 9.199 0.899 19 1 "[ . 1 . +2]"
1 12 PHE 4.335 0.109 18 0 "[ . 1 . 2]"
1 13 GLY 0.537 0.089 8 0 "[ . 1 . 2]"
1 14 LYS 5.116 0.215 20 0 "[ . 1 . 2]"
1 15 ALA 1.478 0.156 20 0 "[ . 1 . 2]"
1 16 LEU 2.376 0.101 13 0 "[ . 1 . 2]"
1 17 ASP 3.556 0.103 16 0 "[ . 1 . 2]"
1 18 GLU 6.239 0.102 16 0 "[ . 1 . 2]"
1 19 CYS 8.657 0.104 6 0 "[ . 1 . 2]"
1 20 LYS 7.842 0.688 2 1 "[ + . 1 . 2]"
1 21 LYS 9.788 0.540 2 3 "[ + . -1 * 2]"
1 22 GLU 4.722 0.115 10 0 "[ . 1 . 2]"
1 23 MET 7.628 0.109 19 0 "[ . 1 . 2]"
1 24 THR 7.064 0.149 6 0 "[ . 1 . 2]"
1 25 LEU 8.462 0.564 16 1 "[ . 1 .+ 2]"
1 26 THR 6.575 0.149 6 0 "[ . 1 . 2]"
1 27 ASP 2.928 0.688 2 1 "[ + . 1 . 2]"
1 28 ALA 2.467 0.102 9 0 "[ . 1 . 2]"
1 29 ILE 9.494 0.133 6 0 "[ . 1 . 2]"
1 30 ASN 6.978 0.688 13 3 "[ * 1- + . 2]"
1 31 GLU 4.851 0.688 13 1 "[ . 1 + . 2]"
1 32 ASP 8.231 0.761 1 4 "[+ . - 1* .* 2]"
1 33 PHE 7.537 0.100 13 0 "[ . 1 . 2]"
1 34 TYR 4.306 0.118 16 0 "[ . 1 . 2]"
1 35 ASN 9.506 0.761 1 4 "[+ . - 1* .* 2]"
1 36 PHE 13.835 0.127 6 0 "[ . 1 . 2]"
1 37 TRP 7.098 0.093 13 0 "[ . 1 . 2]"
1 38 LYS 6.494 0.108 1 0 "[ . 1 . 2]"
1 39 GLU 8.464 0.703 2 4 "[ + . -1 * . * 2]"
1 40 GLY 4.232 0.703 2 4 "[ + . -1 * . * 2]"
1 41 TYR 15.954 0.139 6 0 "[ . 1 . 2]"
1 42 GLU 7.783 0.665 2 1 "[ + . 1 . 2]"
1 43 ILE 7.073 0.117 20 0 "[ . 1 . 2]"
1 44 LYS 6.612 0.665 2 2 "[ + . 1 -. 2]"
1 45 ASN 6.084 0.902 17 1 "[ . 1 . + 2]"
1 46 ARG 16.029 0.876 10 6 "[ - + ** **2]"
1 47 GLU 12.630 0.902 17 5 "[ * . *1 .-+* 2]"
1 48 THR 15.204 0.600 3 3 "[ + . *1 . - 2]"
1 49 GLY 4.665 0.095 18 0 "[ . 1 . 2]"
1 50 CYS 3.712 0.561 13 1 "[ . 1 + . 2]"
1 51 ALA 1.482 0.135 13 0 "[ . 1 . 2]"
1 52 ILE 3.774 0.123 14 0 "[ . 1 . 2]"
1 53 MET 11.975 0.561 13 1 "[ . 1 + . 2]"
1 54 CYS 5.585 0.225 16 0 "[ . 1 . 2]"
1 55 LEU 2.871 0.135 13 0 "[ . 1 . 2]"
1 56 SER 2.867 0.543 8 1 "[ . + 1 . 2]"
1 57 THR 6.583 0.130 6 0 "[ . 1 . 2]"
1 58 LYS 9.545 0.156 20 0 "[ . 1 . 2]"
1 59 LEU 4.104 0.090 8 0 "[ . 1 . 2]"
1 60 ASN 5.180 0.680 2 1 "[ + . 1 . 2]"
1 61 MET 8.901 0.130 6 0 "[ . 1 . 2]"
1 62 LEU 15.942 0.973 15 9 "[** * *- * ** + 2]"
1 63 ASP 21.355 0.973 15 9 "[** * -* * ** + 2]"
1 64 PRO 15.253 0.809 2 2 "[-+ . 1 . 2]"
1 65 GLU 12.152 0.439 11 0 "[ . 1 . 2]"
1 66 GLY 2.998 0.137 3 0 "[ . 1 . 2]"
1 67 ASN 1.158 0.205 4 0 "[ . 1 . 2]"
1 68 LEU 1.221 0.099 15 0 "[ . 1 . 2]"
1 69 HIS 7.168 0.266 11 0 "[ . 1 . 2]"
1 70 HIS 3.317 0.095 14 0 "[ . 1 . 2]"
1 71 GLY 3.216 0.085 11 0 "[ . 1 . 2]"
1 72 ASN 3.409 0.680 2 1 "[ + . 1 . 2]"
1 73 ALA 3.225 0.110 3 0 "[ . 1 . 2]"
1 74 MET 8.630 0.118 2 0 "[ . 1 . 2]"
1 75 GLU 8.449 0.398 15 0 "[ . 1 . 2]"
1 76 PHE 11.191 0.398 15 0 "[ . 1 . 2]"
1 77 ALA 2.928 0.097 17 0 "[ . 1 . 2]"
1 78 LYS 11.957 0.103 13 0 "[ . 1 . 2]"
1 79 LYS 6.246 0.091 15 0 "[ . 1 . 2]"
1 80 HIS 7.081 0.094 2 0 "[ . 1 . 2]"
1 81 GLY 0.126 0.047 18 0 "[ . 1 . 2]"
1 82 ALA 2.849 0.101 18 0 "[ . 1 . 2]"
1 83 ASP 4.458 0.099 12 0 "[ . 1 . 2]"
1 84 GLU 6.913 0.099 1 0 "[ . 1 . 2]"
1 85 THR 5.157 0.166 11 0 "[ . 1 . 2]"
1 86 MET 8.571 0.115 4 0 "[ . 1 . 2]"
1 87 ALA 8.231 0.118 2 0 "[ . 1 . 2]"
1 88 GLN 1.741 0.084 18 0 "[ . 1 . 2]"
1 89 GLN 7.859 0.208 10 0 "[ . 1 . 2]"
1 90 LEU 7.262 0.112 13 0 "[ . 1 . 2]"
1 91 ILE 5.452 0.112 5 0 "[ . 1 . 2]"
1 92 ASP 2.012 0.083 15 0 "[ . 1 . 2]"
1 93 ILE 9.056 0.446 14 0 "[ . 1 . 2]"
1 94 VAL 2.649 0.099 15 0 "[ . 1 . 2]"
1 95 HIS 3.267 0.112 5 0 "[ . 1 . 2]"
1 96 GLY 0.065 0.053 10 0 "[ . 1 . 2]"
1 97 CYS 8.778 0.199 11 0 "[ . 1 . 2]"
1 98 GLU 2.547 0.885 6 1 "[ .+ 1 . 2]"
1 99 LYS 3.811 0.099 2 0 "[ . 1 . 2]"
1 100 SER 5.805 0.199 11 0 "[ . 1 . 2]"
1 101 THR 11.275 0.116 13 0 "[ . 1 . 2]"
1 102 PRO 6.092 0.095 17 0 "[ . 1 . 2]"
1 103 ALA 4.918 0.097 9 0 "[ . 1 . 2]"
1 104 ASN 20.990 0.537 2 5 "[ + . * 1- * . *2]"
1 105 ASP 3.497 0.098 15 0 "[ . 1 . 2]"
1 106 ASP 8.636 0.118 12 0 "[ . 1 . 2]"
1 107 LYS 11.009 0.730 11 3 "[ - . * 1+ . 2]"
1 108 CYS 3.724 0.159 14 0 "[ . 1 . 2]"
1 109 ILE 22.350 0.876 10 8 "[* * * +*** . - 2]"
1 110 TRP 17.397 0.885 6 4 "[ - .+ * 1* . 2]"
1 111 THR 2.022 0.187 8 0 "[ . 1 . 2]"
1 112 LEU 17.548 0.853 1 7 "[+ * * 1*** . - 2]"
1 113 GLY 4.102 0.388 5 0 "[ . 1 . 2]"
1 114 VAL 5.035 0.103 6 0 "[ . 1 . 2]"
1 115 ALA 1.820 0.095 10 0 "[ . 1 . 2]"
1 116 THR 4.086 0.117 20 0 "[ . 1 . 2]"
1 117 CYS 0.559 0.083 14 0 "[ . 1 . 2]"
1 118 PHE 15.442 0.749 13 4 "[ * . - 1 + . * 2]"
1 119 LYS 1.428 0.090 14 0 "[ . 1 . 2]"
1 120 ALA 2.957 0.113 3 0 "[ . 1 . 2]"
1 121 GLU 8.512 0.749 13 4 "[ * . - 1 + . * 2]"
1 122 ILE 12.357 0.570 18 3 "[ * . - 1 . + 2]"
1 123 HIS 3.674 0.090 10 0 "[ . 1 . 2]"
1 124 LYS 9.084 0.618 17 4 "[ * -*1 . + 2]"
1 125 LEU 6.636 0.329 10 0 "[ . 1 . 2]"
1 126 ASN 0.663 0.069 8 0 "[ . 1 . 2]"
1 127 TRP 21.862 0.899 11 9 "[* .* *+* *.** -2]"
1 128 ALA 2.329 0.421 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 SER HA 1 127 TRP HD1 . . 4.880 4.464 3.589 4.957 0.077 11 0 "[ . 1 . 2]" 1
2 1 1 SER HA 1 127 TRP HE1 . . 4.700 4.670 3.702 4.793 0.093 4 0 "[ . 1 . 2]" 1
3 1 1 SER HB2 1 3 GLU H . . 4.070 4.106 3.529 4.954 0.884 18 3 "[- . 1 . *+ 2]" 1
4 1 1 SER HB2 1 3 GLU QB . . 4.750 3.792 3.037 4.743 . 0 0 "[ . 1 . 2]" 1
5 1 1 SER HB2 1 4 VAL H . . 4.500 3.445 2.574 4.175 . 0 0 "[ . 1 . 2]" 1
6 1 1 SER HB2 1 4 VAL HB . . 4.820 4.120 2.386 5.209 0.389 7 0 "[ . 1 . 2]" 1
7 1 1 SER HB2 1 4 VAL QG . . 4.530 2.615 2.054 3.498 . 0 0 "[ . 1 . 2]" 1
8 1 1 SER HB3 1 4 VAL H . . 4.110 3.838 2.900 4.378 0.268 20 0 "[ . 1 . 2]" 1
9 1 1 SER HB3 1 4 VAL QG . . 4.010 3.575 2.526 4.408 0.398 13 0 "[ . 1 . 2]" 1
10 1 2 GLN HA 1 2 GLN HG2 . . 4.200 2.561 2.121 3.713 . 0 0 "[ . 1 . 2]" 1
11 1 2 GLN HA 1 2 GLN HG3 . . 3.730 3.010 2.190 3.632 . 0 0 "[ . 1 . 2]" 1
12 1 2 GLN HA 1 127 TRP HA . . 3.950 3.216 2.403 4.016 0.066 16 0 "[ . 1 . 2]" 1
13 1 2 GLN QB 1 3 GLU H . . 3.530 2.581 1.895 3.097 . 0 0 "[ . 1 . 2]" 1
14 1 2 GLN HG2 1 127 TRP HA . . 4.030 3.064 2.124 3.971 . 0 0 "[ . 1 . 2]" 1
15 1 2 GLN HG2 1 128 ALA HA . . 4.830 3.574 2.317 4.670 . 0 0 "[ . 1 . 2]" 1
16 1 2 GLN HG3 1 127 TRP HA . . 4.060 2.847 1.976 4.028 . 0 0 "[ . 1 . 2]" 1
17 1 2 GLN HG3 1 127 TRP HB3 . . 5.040 4.718 3.059 5.841 0.801 6 4 "[ .+ * -. * 2]" 1
18 1 2 GLN HG3 1 128 ALA H . . 4.770 3.806 3.002 5.191 0.421 14 0 "[ . 1 . 2]" 1
19 1 2 GLN HG3 1 128 ALA HA . . 4.550 4.179 2.998 4.913 0.363 17 0 "[ . 1 . 2]" 1
20 1 3 GLU H 1 3 GLU QB . . 2.820 2.097 1.944 2.221 . 0 0 "[ . 1 . 2]" 1
21 1 3 GLU H 1 3 GLU QG . . 3.840 3.885 3.772 3.938 0.098 8 0 "[ . 1 . 2]" 1
22 1 3 GLU H 1 4 VAL H . . 3.180 3.034 2.823 3.253 0.073 10 0 "[ . 1 . 2]" 1
23 1 3 GLU HA 1 3 GLU QG . . 3.200 2.412 2.219 2.599 . 0 0 "[ . 1 . 2]" 1
24 1 3 GLU QB 1 4 VAL H . . 3.660 2.201 1.912 2.444 . 0 0 "[ . 1 . 2]" 1
25 1 3 GLU QB 1 4 VAL HA . . 4.340 4.140 4.008 4.255 . 0 0 "[ . 1 . 2]" 1
26 1 3 GLU QB 1 4 VAL HB . . 4.580 4.065 3.438 4.532 . 0 0 "[ . 1 . 2]" 1
27 1 3 GLU QB 1 4 VAL QG . . 4.640 3.100 2.705 3.304 . 0 0 "[ . 1 . 2]" 1
28 1 3 GLU QG 1 4 VAL H . . 4.290 3.488 3.026 4.074 . 0 0 "[ . 1 . 2]" 1
29 1 3 GLU QG 1 4 VAL HA . . 4.530 3.835 3.498 4.607 0.077 20 0 "[ . 1 . 2]" 1
30 1 3 GLU QG 1 4 VAL QG . . 4.530 4.000 3.202 4.348 . 0 0 "[ . 1 . 2]" 1
31 1 4 VAL H 1 4 VAL HB . . 3.280 2.526 2.326 2.843 . 0 0 "[ . 1 . 2]" 1
32 1 4 VAL H 1 4 VAL QG . . 3.190 2.001 1.809 2.300 . 0 0 "[ . 1 . 2]" 1
33 1 4 VAL H 1 5 MET H . . 3.390 2.631 2.304 2.909 . 0 0 "[ . 1 . 2]" 1
34 1 4 VAL H 1 6 LYS H . . 4.770 4.340 4.135 4.651 . 0 0 "[ . 1 . 2]" 1
35 1 4 VAL HA 1 4 VAL QG . . 3.150 2.246 2.160 2.437 . 0 0 "[ . 1 . 2]" 1
36 1 4 VAL HA 1 5 MET HA . . 5.080 4.835 4.692 4.894 . 0 0 "[ . 1 . 2]" 1
37 1 4 VAL HA 1 7 ASN H . . 3.820 3.346 3.156 3.708 . 0 0 "[ . 1 . 2]" 1
38 1 4 VAL HA 1 7 ASN QB . . 3.160 2.467 2.178 2.774 . 0 0 "[ . 1 . 2]" 1
39 1 4 VAL HA 1 7 ASN HD21 . . 4.510 3.753 2.910 4.450 . 0 0 "[ . 1 . 2]" 1
40 1 4 VAL HB 1 5 MET H . . 3.790 3.393 2.588 3.892 0.102 11 0 "[ . 1 . 2]" 1
41 1 4 VAL HB 1 7 ASN QB . . 4.800 4.678 4.222 4.902 0.102 4 0 "[ . 1 . 2]" 1
42 1 4 VAL QG 1 5 MET H . . 4.760 2.690 2.033 3.595 . 0 0 "[ . 1 . 2]" 1
43 1 4 VAL QG 1 5 MET HA . . 4.400 3.377 3.120 3.988 . 0 0 "[ . 1 . 2]" 1
44 1 4 VAL QG 1 5 MET HG2 . . 5.500 4.855 3.765 5.883 0.383 3 0 "[ . 1 . 2]" 1
45 1 4 VAL QG 1 7 ASN QB . . 4.080 3.156 2.919 3.544 . 0 0 "[ . 1 . 2]" 1
46 1 4 VAL QG 1 8 LEU H . . 4.960 3.677 3.396 3.839 . 0 0 "[ . 1 . 2]" 1
47 1 4 VAL QG 1 8 LEU HA . . 5.160 4.682 4.374 4.862 . 0 0 "[ . 1 . 2]" 1
48 1 4 VAL QG 1 8 LEU QD . . 3.450 2.068 1.817 2.299 . 0 0 "[ . 1 . 2]" 1
49 1 4 VAL QG 1 8 LEU HG . . 3.770 2.838 2.270 3.855 0.085 18 0 "[ . 1 . 2]" 1
50 1 4 VAL QG 1 81 GLY HA2 . . 4.890 3.818 3.445 4.241 . 0 0 "[ . 1 . 2]" 1
51 1 4 VAL QG 1 81 GLY HA3 . . 4.450 2.816 2.215 3.475 . 0 0 "[ . 1 . 2]" 1
52 1 4 VAL QG 1 82 ALA H . . 3.990 2.792 2.423 3.332 . 0 0 "[ . 1 . 2]" 1
53 1 4 VAL QG 1 82 ALA HA . . 3.250 2.218 1.926 2.502 . 0 0 "[ . 1 . 2]" 1
54 1 4 VAL QG 1 82 ALA MB . . 3.550 2.505 2.127 2.937 . 0 0 "[ . 1 . 2]" 1
55 1 4 VAL QG 1 83 ASP H . . 4.740 3.639 2.980 4.187 . 0 0 "[ . 1 . 2]" 1
56 1 5 MET H 1 5 MET HB3 . . 3.500 2.923 2.410 3.378 . 0 0 "[ . 1 . 2]" 1
57 1 5 MET H 1 5 MET HG2 . . 4.100 4.206 3.649 4.607 0.507 8 1 "[ . + 1 . 2]" 1
58 1 5 MET H 1 5 MET HG3 . . 4.640 4.392 4.194 4.688 0.048 16 0 "[ . 1 . 2]" 1
59 1 5 MET HA 1 5 MET ME . . 4.300 2.782 2.059 4.123 . 0 0 "[ . 1 . 2]" 1
60 1 5 MET HA 1 5 MET HG2 . . 2.810 2.766 2.091 3.706 0.896 13 6 "[ **. * 1* + - 2]" 1
61 1 5 MET HA 1 7 ASN H . . 4.930 4.588 4.405 4.741 . 0 0 "[ . 1 . 2]" 1
62 1 5 MET HA 1 8 LEU H . . 4.400 3.452 3.151 3.743 . 0 0 "[ . 1 . 2]" 1
63 1 5 MET HA 1 8 LEU HB2 . . 3.760 2.536 2.296 2.701 . 0 0 "[ . 1 . 2]" 1
64 1 5 MET HA 1 8 LEU HB3 . . 4.150 4.079 3.747 4.210 0.060 16 0 "[ . 1 . 2]" 1
65 1 5 MET HA 1 8 LEU QD . . 3.810 2.393 2.040 3.670 . 0 0 "[ . 1 . 2]" 1
66 1 5 MET HA 1 8 LEU HG . . 4.560 4.171 3.175 4.653 0.093 18 0 "[ . 1 . 2]" 1
67 1 5 MET HA 1 9 SER H . . 4.570 4.033 3.747 4.559 . 0 0 "[ . 1 . 2]" 1
68 1 5 MET HB2 1 5 MET ME . . 3.640 3.947 3.710 4.284 0.644 16 4 "[* . - * .+ 2]" 1
69 1 5 MET HB3 1 127 TRP HB2 . . 4.910 4.910 4.171 5.809 0.899 11 4 "[* . 1+ -.* 2]" 1
70 1 5 MET ME 1 5 MET HG2 . . 3.000 2.462 2.154 3.159 0.159 4 0 "[ . 1 . 2]" 1
71 1 5 MET ME 1 8 LEU QD . . 4.140 3.176 2.065 4.148 0.008 16 0 "[ . 1 . 2]" 1
72 1 5 MET ME 1 37 TRP HH2 . . 4.660 3.861 2.874 4.648 . 0 0 "[ . 1 . 2]" 1
73 1 5 MET ME 1 37 TRP HZ2 . . 4.010 3.433 2.213 4.102 0.092 19 0 "[ . 1 . 2]" 1
74 1 5 MET ME 1 118 PHE QE . . 4.080 3.480 2.939 4.174 0.094 12 0 "[ . 1 . 2]" 1
75 1 5 MET ME 1 118 PHE HZ . . 4.050 3.184 2.523 4.010 . 0 0 "[ . 1 . 2]" 1
76 1 5 MET ME 1 122 ILE MD . . 4.550 2.959 2.187 3.665 . 0 0 "[ . 1 . 2]" 1
77 1 5 MET ME 1 122 ILE HG13 . . 4.660 3.487 2.627 4.149 . 0 0 "[ . 1 . 2]" 1
78 1 5 MET ME 1 122 ILE MG . . 4.310 3.006 1.974 3.872 . 0 0 "[ . 1 . 2]" 1
79 1 5 MET ME 1 127 TRP HB3 . . 5.020 4.318 2.883 5.088 0.068 9 0 "[ . 1 . 2]" 1
80 1 5 MET ME 1 127 TRP HE3 . . 5.490 3.621 2.030 4.355 . 0 0 "[ . 1 . 2]" 1
81 1 5 MET ME 1 127 TRP HZ3 . . 5.170 4.393 2.814 5.271 0.101 5 0 "[ . 1 . 2]" 1
82 1 5 MET HG2 1 8 LEU QD . . 5.500 4.088 3.171 5.187 . 0 0 "[ . 1 . 2]" 1
83 1 5 MET HG2 1 122 ILE MD . . 5.480 4.273 3.497 5.202 . 0 0 "[ . 1 . 2]" 1
84 1 5 MET HG2 1 122 ILE MG . . 4.700 3.476 2.060 4.719 0.019 19 0 "[ . 1 . 2]" 1
85 1 5 MET HG2 1 127 TRP HB2 . . 4.730 4.291 2.666 5.548 0.818 10 5 "[ . + * *. * -2]" 1
86 1 5 MET HG2 1 127 TRP HE3 . . 4.560 3.608 2.894 4.064 . 0 0 "[ . 1 . 2]" 1
87 1 5 MET HG3 1 122 ILE MG . . 5.280 3.067 2.042 4.049 . 0 0 "[ . 1 . 2]" 1
88 1 5 MET HG3 1 127 TRP HE3 . . 4.680 3.551 2.237 4.635 . 0 0 "[ . 1 . 2]" 1
89 1 6 LYS H 1 6 LYS QB . . 3.100 2.224 2.016 2.625 . 0 0 "[ . 1 . 2]" 1
90 1 6 LYS QB 1 7 ASN H . . 3.400 2.476 2.227 2.843 . 0 0 "[ . 1 . 2]" 1
91 1 6 LYS QB 1 7 ASN QB . . 4.160 3.843 3.578 4.256 0.096 13 0 "[ . 1 . 2]" 1
92 1 7 ASN H 1 7 ASN QB . . 2.800 2.182 2.032 2.275 . 0 0 "[ . 1 . 2]" 1
93 1 7 ASN H 1 8 LEU H . . 3.430 2.782 2.664 2.892 . 0 0 "[ . 1 . 2]" 1
94 1 7 ASN HA 1 10 LEU H . . 4.200 3.369 3.017 3.926 . 0 0 "[ . 1 . 2]" 1
95 1 7 ASN HA 1 10 LEU HB2 . . 3.460 2.867 2.210 3.517 0.057 9 0 "[ . 1 . 2]" 1
96 1 7 ASN HA 1 10 LEU HB3 . . 3.460 2.438 2.182 3.041 . 0 0 "[ . 1 . 2]" 1
97 1 7 ASN HA 1 10 LEU QD . . 4.000 2.944 2.768 3.206 . 0 0 "[ . 1 . 2]" 1
98 1 7 ASN HA 1 10 LEU HG . . 4.780 4.844 4.680 4.867 0.087 10 0 "[ . 1 . 2]" 1
99 1 7 ASN HA 1 11 ASN H . . 4.720 3.852 3.654 4.212 . 0 0 "[ . 1 . 2]" 1
100 1 7 ASN HA 1 11 ASN HD21 . . 4.580 3.528 3.243 3.884 . 0 0 "[ . 1 . 2]" 1
101 1 7 ASN HA 1 11 ASN HD22 . . 4.890 4.692 4.244 4.973 0.083 19 0 "[ . 1 . 2]" 1
102 1 7 ASN QB 1 7 ASN HD21 . . 3.150 2.239 2.164 2.387 . 0 0 "[ . 1 . 2]" 1
103 1 7 ASN QB 1 8 LEU H . . 3.350 2.527 2.303 2.669 . 0 0 "[ . 1 . 2]" 1
104 1 7 ASN QB 1 8 LEU HA . . 4.820 4.104 3.871 4.327 . 0 0 "[ . 1 . 2]" 1
105 1 7 ASN QB 1 8 LEU HB3 . . 5.500 5.547 5.183 5.597 0.097 14 0 "[ . 1 . 2]" 1
106 1 7 ASN QB 1 8 LEU QD . . 5.030 3.802 2.321 4.279 . 0 0 "[ . 1 . 2]" 1
107 1 7 ASN QB 1 8 LEU HG . . 4.360 3.914 3.587 4.464 0.104 9 0 "[ . 1 . 2]" 1
108 1 7 ASN QB 1 9 SER H . . 4.790 4.852 4.771 4.882 0.092 7 0 "[ . 1 . 2]" 1
109 1 7 ASN HD21 1 8 LEU QD . . 5.220 4.530 3.030 4.964 . 0 0 "[ . 1 . 2]" 1
110 1 7 ASN HD21 1 11 ASN HD21 . . 4.450 4.333 3.801 5.349 0.899 19 1 "[ . 1 . +2]" 1
111 1 7 ASN HD21 1 80 HIS HA . . 4.620 3.782 2.932 4.497 . 0 0 "[ . 1 . 2]" 1
112 1 7 ASN HD21 1 80 HIS HB2 . . 4.810 4.500 3.946 4.848 0.038 10 0 "[ . 1 . 2]" 1
113 1 7 ASN HD21 1 80 HIS HB3 . . 3.990 2.776 2.355 3.144 . 0 0 "[ . 1 . 2]" 1
114 1 7 ASN HD22 1 80 HIS HB3 . . 4.320 3.855 3.132 4.405 0.085 3 0 "[ . 1 . 2]" 1
115 1 7 ASN HD22 1 80 HIS HD2 . . 5.160 3.016 1.949 4.607 . 0 0 "[ . 1 . 2]" 1
116 1 8 LEU H 1 8 LEU HB2 . . 3.710 2.276 2.115 2.447 . 0 0 "[ . 1 . 2]" 1
117 1 8 LEU H 1 8 LEU HB3 . . 4.050 3.530 3.427 3.632 . 0 0 "[ . 1 . 2]" 1
118 1 8 LEU H 1 8 LEU QD . . 4.160 3.020 2.198 3.311 . 0 0 "[ . 1 . 2]" 1
119 1 8 LEU H 1 8 LEU HG . . 3.620 2.950 2.623 3.617 . 0 0 "[ . 1 . 2]" 1
120 1 8 LEU H 1 9 SER H . . 3.660 2.756 2.635 2.949 . 0 0 "[ . 1 . 2]" 1
121 1 8 LEU HA 1 8 LEU QD . . 2.890 2.275 2.077 2.843 . 0 0 "[ . 1 . 2]" 1
122 1 8 LEU HA 1 11 ASN H . . 4.780 3.672 3.392 3.941 . 0 0 "[ . 1 . 2]" 1
123 1 8 LEU HA 1 11 ASN QB . . 4.940 3.097 2.515 4.787 . 0 0 "[ . 1 . 2]" 1
124 1 8 LEU HA 1 76 PHE QE . . 4.370 2.982 2.194 3.842 . 0 0 "[ . 1 . 2]" 1
125 1 8 LEU HA 1 80 HIS HB2 . . 4.710 4.288 3.818 4.626 . 0 0 "[ . 1 . 2]" 1
126 1 8 LEU HA 1 80 HIS HB3 . . 4.300 4.079 3.487 4.384 0.084 19 0 "[ . 1 . 2]" 1
127 1 8 LEU HB2 1 9 SER H . . 3.720 2.535 2.259 2.742 . 0 0 "[ . 1 . 2]" 1
128 1 8 LEU HB2 1 76 PHE QE . . 5.030 4.574 3.863 5.081 0.051 9 0 "[ . 1 . 2]" 1
129 1 8 LEU HB3 1 9 SER H . . 4.220 3.157 2.893 3.379 . 0 0 "[ . 1 . 2]" 1
130 1 8 LEU HB3 1 76 PHE QE . . 4.730 3.046 2.490 3.496 . 0 0 "[ . 1 . 2]" 1
131 1 8 LEU QD 1 9 SER H . . 5.050 3.995 3.865 4.155 . 0 0 "[ . 1 . 2]" 1
132 1 8 LEU QD 1 76 PHE QD . . 4.430 2.363 1.941 2.932 . 0 0 "[ . 1 . 2]" 1
133 1 8 LEU QD 1 76 PHE QE . . 4.060 2.452 2.141 3.146 . 0 0 "[ . 1 . 2]" 1
134 1 8 LEU QD 1 77 ALA HA . . 3.290 2.032 1.845 2.519 . 0 0 "[ . 1 . 2]" 1
135 1 8 LEU QD 1 77 ALA MB . . 3.580 2.847 2.497 3.115 . 0 0 "[ . 1 . 2]" 1
136 1 8 LEU QD 1 80 HIS H . . 4.680 3.328 2.961 4.150 . 0 0 "[ . 1 . 2]" 1
137 1 8 LEU QD 1 80 HIS HB2 . . 3.690 2.144 2.008 2.528 . 0 0 "[ . 1 . 2]" 1
138 1 8 LEU QD 1 80 HIS HB3 . . 3.990 2.894 2.102 3.207 . 0 0 "[ . 1 . 2]" 1
139 1 8 LEU QD 1 82 ALA H . . 4.660 3.555 2.957 4.008 . 0 0 "[ . 1 . 2]" 1
140 1 8 LEU QD 1 82 ALA MB . . 3.350 2.257 1.962 2.571 . 0 0 "[ . 1 . 2]" 1
141 1 8 LEU HG 1 82 ALA MB . . 5.500 4.229 3.357 4.626 . 0 0 "[ . 1 . 2]" 1
142 1 9 SER H 1 10 LEU H . . 4.200 2.777 2.620 2.990 . 0 0 "[ . 1 . 2]" 1
143 1 10 LEU H 1 10 LEU HB2 . . 3.170 2.558 2.098 3.133 . 0 0 "[ . 1 . 2]" 1
144 1 10 LEU H 1 10 LEU HB3 . . 3.370 2.484 2.298 3.019 . 0 0 "[ . 1 . 2]" 1
145 1 10 LEU H 1 10 LEU QD . . 4.710 3.689 3.245 3.944 . 0 0 "[ . 1 . 2]" 1
146 1 10 LEU H 1 10 LEU HG . . 4.410 4.372 4.262 4.483 0.073 15 0 "[ . 1 . 2]" 1
147 1 10 LEU H 1 11 ASN H . . 3.840 2.343 2.011 2.484 . 0 0 "[ . 1 . 2]" 1
148 1 10 LEU H 1 11 ASN HA . . 4.930 4.956 4.581 5.025 0.095 3 0 "[ . 1 . 2]" 1
149 1 10 LEU HA 1 10 LEU QD . . 3.260 2.476 2.075 3.046 . 0 0 "[ . 1 . 2]" 1
150 1 10 LEU HA 1 10 LEU HG . . 4.000 2.700 2.271 3.207 . 0 0 "[ . 1 . 2]" 1
151 1 10 LEU HA 1 11 ASN QB . . 5.500 5.287 5.154 5.301 . 0 0 "[ . 1 . 2]" 1
152 1 10 LEU HB2 1 10 LEU QD . . 3.200 2.126 2.076 2.182 . 0 0 "[ . 1 . 2]" 1
153 1 10 LEU HB2 1 11 ASN H . . 3.570 3.589 2.915 3.661 0.091 10 0 "[ . 1 . 2]" 1
154 1 10 LEU HB2 1 11 ASN HD21 . . 4.710 4.720 4.059 4.890 0.180 19 0 "[ . 1 . 2]" 1
155 1 10 LEU HB3 1 10 LEU QD . . 3.120 2.162 2.054 2.259 . 0 0 "[ . 1 . 2]" 1
156 1 10 LEU HB3 1 11 ASN H . . 3.590 2.298 2.133 2.587 . 0 0 "[ . 1 . 2]" 1
157 1 10 LEU HB3 1 11 ASN HD21 . . 4.800 3.044 2.460 3.246 . 0 0 "[ . 1 . 2]" 1
158 1 10 LEU QD 1 11 ASN H . . 5.000 3.442 2.582 3.944 . 0 0 "[ . 1 . 2]" 1
159 1 10 LEU QD 1 11 ASN HA . . 4.470 3.730 2.897 4.384 . 0 0 "[ . 1 . 2]" 1
160 1 10 LEU QD 1 11 ASN HD21 . . 4.820 3.204 2.823 3.597 . 0 0 "[ . 1 . 2]" 1
161 1 10 LEU QD 1 11 ASN HD22 . . 4.410 3.347 2.616 4.465 0.055 19 0 "[ . 1 . 2]" 1
162 1 10 LEU QD 1 14 LYS QD . . 5.070 4.517 4.016 4.982 . 0 0 "[ . 1 . 2]" 1
163 1 10 LEU QD 1 14 LYS QE . . 3.930 3.289 2.261 3.807 . 0 0 "[ . 1 . 2]" 1
164 1 10 LEU HG 1 11 ASN H . . 4.680 3.878 3.172 4.466 . 0 0 "[ . 1 . 2]" 1
165 1 10 LEU HG 1 11 ASN HA . . 4.850 4.036 3.191 4.903 0.053 15 0 "[ . 1 . 2]" 1
166 1 10 LEU HG 1 14 LYS QE . . 4.820 3.832 2.586 4.721 . 0 0 "[ . 1 . 2]" 1
167 1 11 ASN H 1 11 ASN QB . . 3.520 2.131 2.079 2.379 . 0 0 "[ . 1 . 2]" 1
168 1 11 ASN H 1 12 PHE H . . 3.450 2.605 2.364 2.748 . 0 0 "[ . 1 . 2]" 1
169 1 11 ASN HA 1 11 ASN HD21 . . 4.450 3.637 3.045 3.906 . 0 0 "[ . 1 . 2]" 1
170 1 11 ASN HA 1 11 ASN HD22 . . 4.820 4.059 3.671 4.923 0.103 19 0 "[ . 1 . 2]" 1
171 1 11 ASN HA 1 12 PHE HB3 . . 5.460 5.487 4.933 5.550 0.090 3 0 "[ . 1 . 2]" 1
172 1 11 ASN HA 1 14 LYS H . . 4.030 3.668 3.214 4.101 0.071 20 0 "[ . 1 . 2]" 1
173 1 11 ASN HA 1 14 LYS QD . . 3.710 3.667 3.031 3.823 0.113 16 0 "[ . 1 . 2]" 1
174 1 11 ASN HA 1 14 LYS QE . . 3.740 3.041 2.535 3.707 . 0 0 "[ . 1 . 2]" 1
175 1 11 ASN HA 1 14 LYS HG2 . . 3.690 2.246 1.968 3.781 0.091 20 0 "[ . 1 . 2]" 1
176 1 11 ASN HA 1 14 LYS HG3 . . 3.720 2.503 1.998 3.403 . 0 0 "[ . 1 . 2]" 1
177 1 11 ASN QB 1 12 PHE H . . 4.480 2.847 2.424 3.850 . 0 0 "[ . 1 . 2]" 1
178 1 11 ASN QB 1 76 PHE QE . . 4.760 3.182 2.743 4.162 . 0 0 "[ . 1 . 2]" 1
179 1 11 ASN QB 1 76 PHE HZ . . 4.270 2.657 2.157 3.972 . 0 0 "[ . 1 . 2]" 1
180 1 12 PHE H 1 12 PHE HB2 . . 3.500 2.528 2.322 2.716 . 0 0 "[ . 1 . 2]" 1
181 1 12 PHE H 1 12 PHE HB3 . . 3.440 2.274 2.120 2.359 . 0 0 "[ . 1 . 2]" 1
182 1 12 PHE H 1 12 PHE QD . . 4.560 4.127 3.938 4.177 . 0 0 "[ . 1 . 2]" 1
183 1 12 PHE H 1 13 GLY H . . 3.870 2.841 2.687 3.029 . 0 0 "[ . 1 . 2]" 1
184 1 12 PHE H 1 76 PHE QE . . 5.130 3.766 3.374 4.141 . 0 0 "[ . 1 . 2]" 1
185 1 12 PHE H 1 76 PHE HZ . . 4.200 2.900 2.591 3.269 . 0 0 "[ . 1 . 2]" 1
186 1 12 PHE HA 1 12 PHE QD . . 3.530 2.958 2.505 3.366 . 0 0 "[ . 1 . 2]" 1
187 1 12 PHE HA 1 59 LEU QD . . 3.510 1.966 1.795 2.118 . 0 0 "[ . 1 . 2]" 1
188 1 12 PHE HA 1 59 LEU HG . . 5.030 3.842 3.036 4.578 . 0 0 "[ . 1 . 2]" 1
189 1 12 PHE HA 1 76 PHE QE . . 4.800 3.739 2.879 4.022 . 0 0 "[ . 1 . 2]" 1
190 1 12 PHE HA 1 76 PHE HZ . . 4.170 2.983 2.580 3.342 . 0 0 "[ . 1 . 2]" 1
191 1 12 PHE HB2 1 13 GLY H . . 4.570 3.917 3.724 4.177 . 0 0 "[ . 1 . 2]" 1
192 1 12 PHE HB2 1 76 PHE HZ . . 4.980 3.128 2.417 3.553 . 0 0 "[ . 1 . 2]" 1
193 1 12 PHE HB3 1 13 GLY H . . 4.880 2.527 2.249 2.912 . 0 0 "[ . 1 . 2]" 1
194 1 12 PHE HB3 1 76 PHE QE . . 4.600 4.401 4.032 4.699 0.099 13 0 "[ . 1 . 2]" 1
195 1 12 PHE HB3 1 76 PHE HZ . . 4.410 4.294 3.795 4.493 0.083 10 0 "[ . 1 . 2]" 1
196 1 12 PHE QD 1 13 GLY H . . 5.060 3.062 2.627 3.673 . 0 0 "[ . 1 . 2]" 1
197 1 12 PHE QD 1 13 GLY HA3 . . 4.540 3.743 3.029 4.306 . 0 0 "[ . 1 . 2]" 1
198 1 12 PHE QD 1 55 LEU HB2 . . 4.400 4.194 3.595 4.460 0.060 20 0 "[ . 1 . 2]" 1
199 1 12 PHE QD 1 55 LEU QD . . 4.060 2.876 2.308 3.743 . 0 0 "[ . 1 . 2]" 1
200 1 12 PHE QD 1 56 SER H . . 5.090 5.104 4.708 5.182 0.092 17 0 "[ . 1 . 2]" 1
201 1 12 PHE QD 1 59 LEU QD . . 3.710 2.268 2.025 3.646 . 0 0 "[ . 1 . 2]" 1
202 1 12 PHE QD 1 61 MET ME . . 3.860 2.781 2.196 3.502 . 0 0 "[ . 1 . 2]" 1
203 1 12 PHE QD 1 76 PHE QD . . 5.260 4.999 4.324 5.369 0.109 18 0 "[ . 1 . 2]" 1
204 1 12 PHE QD 1 76 PHE QE . . 4.710 4.016 3.084 4.512 . 0 0 "[ . 1 . 2]" 1
205 1 12 PHE QD 1 76 PHE HZ . . 4.930 4.404 3.587 4.991 0.061 19 0 "[ . 1 . 2]" 1
206 1 12 PHE QE 1 13 GLY HA2 . . 5.160 4.683 3.904 5.139 . 0 0 "[ . 1 . 2]" 1
207 1 12 PHE QE 1 52 ILE HA . . 4.350 2.883 1.993 3.486 . 0 0 "[ . 1 . 2]" 1
208 1 12 PHE QE 1 52 ILE MD . . 4.980 4.149 3.608 4.659 . 0 0 "[ . 1 . 2]" 1
209 1 12 PHE QE 1 52 ILE MG . . 4.030 2.943 2.442 3.247 . 0 0 "[ . 1 . 2]" 1
210 1 12 PHE QE 1 55 LEU HB2 . . 4.640 3.036 2.454 3.248 . 0 0 "[ . 1 . 2]" 1
211 1 12 PHE QE 1 55 LEU QD . . 4.160 2.552 2.277 3.485 . 0 0 "[ . 1 . 2]" 1
212 1 12 PHE QE 1 56 SER H . . 5.050 3.402 2.715 3.886 . 0 0 "[ . 1 . 2]" 1
213 1 12 PHE QE 1 56 SER HA . . 4.270 3.101 2.324 4.356 0.086 17 0 "[ . 1 . 2]" 1
214 1 12 PHE QE 1 59 LEU QD . . 5.210 3.096 2.650 4.335 . 0 0 "[ . 1 . 2]" 1
215 1 12 PHE QE 1 61 MET ME . . 3.960 3.072 2.179 4.051 0.091 5 0 "[ . 1 . 2]" 1
216 1 12 PHE HZ 1 52 ILE HG13 . . 5.330 4.509 3.586 5.371 0.041 10 0 "[ . 1 . 2]" 1
217 1 12 PHE HZ 1 52 ILE MG . . 4.400 2.151 2.073 2.270 . 0 0 "[ . 1 . 2]" 1
218 1 13 GLY H 1 14 LYS H . . 3.780 3.113 2.808 3.461 . 0 0 "[ . 1 . 2]" 1
219 1 13 GLY HA2 1 55 LEU QD . . 4.200 2.047 1.850 2.277 . 0 0 "[ . 1 . 2]" 1
220 1 13 GLY HA3 1 33 PHE QD . . 5.500 5.344 3.987 5.589 0.089 8 0 "[ . 1 . 2]" 1
221 1 13 GLY HA3 1 55 LEU QD . . 3.860 3.194 2.612 3.534 . 0 0 "[ . 1 . 2]" 1
222 1 14 LYS H 1 14 LYS HB2 . . 2.960 2.361 2.221 2.526 . 0 0 "[ . 1 . 2]" 1
223 1 14 LYS H 1 14 LYS QD . . 5.120 4.338 4.057 4.694 . 0 0 "[ . 1 . 2]" 1
224 1 14 LYS H 1 14 LYS HG2 . . 3.800 2.829 2.424 4.015 0.215 20 0 "[ . 1 . 2]" 1
225 1 14 LYS H 1 14 LYS HG3 . . 4.020 3.452 2.929 3.851 . 0 0 "[ . 1 . 2]" 1
226 1 14 LYS H 1 15 ALA H . . 3.730 2.830 2.443 3.031 . 0 0 "[ . 1 . 2]" 1
227 1 14 LYS H 1 16 LEU H . . 4.750 4.312 4.103 4.659 . 0 0 "[ . 1 . 2]" 1
228 1 14 LYS H 1 55 LEU QD . . 4.780 3.466 3.075 3.727 . 0 0 "[ . 1 . 2]" 1
229 1 14 LYS HA 1 14 LYS HB2 . . 2.990 3.027 2.989 3.039 0.049 6 0 "[ . 1 . 2]" 1
230 1 14 LYS HA 1 14 LYS HB3 . . 2.990 2.598 2.470 2.703 . 0 0 "[ . 1 . 2]" 1
231 1 14 LYS HA 1 14 LYS QD . . 3.540 2.862 2.117 3.630 0.090 20 0 "[ . 1 . 2]" 1
232 1 14 LYS HA 1 14 LYS HG3 . . 3.680 3.643 2.998 3.764 0.084 1 0 "[ . 1 . 2]" 1
233 1 14 LYS HA 1 16 LEU H . . 3.900 3.796 3.491 3.948 0.048 3 0 "[ . 1 . 2]" 1
234 1 14 LYS HB2 1 14 LYS QD . . 3.130 3.172 2.736 3.236 0.106 4 0 "[ . 1 . 2]" 1
235 1 14 LYS HB2 1 15 ALA H . . 3.500 2.530 2.209 3.067 . 0 0 "[ . 1 . 2]" 1
236 1 14 LYS HB2 1 15 ALA HA . . 4.850 4.663 4.343 4.928 0.078 20 0 "[ . 1 . 2]" 1
237 1 14 LYS HB2 1 59 LEU QD . . 5.240 3.795 3.344 4.142 . 0 0 "[ . 1 . 2]" 1
238 1 14 LYS HB3 1 14 LYS HG3 . . 2.990 2.707 2.552 3.027 0.037 20 0 "[ . 1 . 2]" 1
239 1 14 LYS HB3 1 15 ALA H . . 4.400 3.186 2.838 3.745 . 0 0 "[ . 1 . 2]" 1
240 1 14 LYS HB3 1 15 ALA HA . . 4.730 4.187 3.978 4.440 . 0 0 "[ . 1 . 2]" 1
241 1 14 LYS HB3 1 59 LEU QD . . 5.450 5.047 4.671 5.309 . 0 0 "[ . 1 . 2]" 1
242 1 14 LYS QE 1 14 LYS HG3 . . 3.260 2.736 2.117 3.381 0.121 10 0 "[ . 1 . 2]" 1
243 1 15 ALA H 1 15 ALA MB . . 3.250 2.237 2.168 2.348 . 0 0 "[ . 1 . 2]" 1
244 1 15 ALA H 1 16 LEU H . . 3.670 3.127 2.644 3.434 . 0 0 "[ . 1 . 2]" 1
245 1 15 ALA H 1 55 LEU QD . . 3.930 2.827 2.502 3.353 . 0 0 "[ . 1 . 2]" 1
246 1 15 ALA HA 1 16 LEU H . . 3.520 3.084 2.735 3.220 . 0 0 "[ . 1 . 2]" 1
247 1 15 ALA HA 1 17 ASP H . . 4.290 4.106 3.902 4.298 0.008 13 0 "[ . 1 . 2]" 1
248 1 15 ALA HA 1 18 GLU H . . 3.880 3.479 3.338 3.698 . 0 0 "[ . 1 . 2]" 1
249 1 15 ALA HA 1 18 GLU QB . . 4.350 3.208 2.782 3.495 . 0 0 "[ . 1 . 2]" 1
250 1 15 ALA HA 1 18 GLU HG2 . . 4.640 3.892 2.967 4.489 . 0 0 "[ . 1 . 2]" 1
251 1 15 ALA HA 1 18 GLU HG3 . . 4.770 3.123 2.143 4.045 . 0 0 "[ . 1 . 2]" 1
252 1 15 ALA HA 1 55 LEU QD . . 4.880 3.996 3.799 4.397 . 0 0 "[ . 1 . 2]" 1
253 1 15 ALA MB 1 16 LEU H . . 4.170 3.670 3.553 3.815 . 0 0 "[ . 1 . 2]" 1
254 1 15 ALA MB 1 18 GLU H . . 4.430 4.066 3.832 4.338 . 0 0 "[ . 1 . 2]" 1
255 1 15 ALA MB 1 18 GLU QB . . 3.810 2.532 2.136 2.991 . 0 0 "[ . 1 . 2]" 1
256 1 15 ALA MB 1 18 GLU HG2 . . 4.710 4.293 3.424 4.785 0.075 2 0 "[ . 1 . 2]" 1
257 1 15 ALA MB 1 18 GLU HG3 . . 4.730 3.248 2.500 3.798 . 0 0 "[ . 1 . 2]" 1
258 1 15 ALA MB 1 19 CYS H . . 4.990 3.599 3.333 3.941 . 0 0 "[ . 1 . 2]" 1
259 1 15 ALA MB 1 19 CYS HB2 . . 5.400 4.421 3.796 4.907 . 0 0 "[ . 1 . 2]" 1
260 1 15 ALA MB 1 55 LEU HA . . 4.350 3.474 3.072 4.091 . 0 0 "[ . 1 . 2]" 1
261 1 15 ALA MB 1 55 LEU QD . . 3.440 2.385 2.098 3.204 . 0 0 "[ . 1 . 2]" 1
262 1 15 ALA MB 1 58 LYS HA . . 4.870 4.887 4.490 4.983 0.113 15 0 "[ . 1 . 2]" 1
263 1 15 ALA MB 1 58 LYS QD . . 3.220 2.204 1.989 3.376 0.156 20 0 "[ . 1 . 2]" 1
264 1 15 ALA MB 1 58 LYS QE . . 4.640 3.330 1.712 3.638 . 0 0 "[ . 1 . 2]" 1
265 1 16 LEU H 1 16 LEU HB2 . . 2.910 2.556 2.463 2.657 . 0 0 "[ . 1 . 2]" 1
266 1 16 LEU H 1 16 LEU HB3 . . 3.060 2.452 2.197 2.587 . 0 0 "[ . 1 . 2]" 1
267 1 16 LEU H 1 16 LEU QD . . 4.520 3.752 3.654 3.794 . 0 0 "[ . 1 . 2]" 1
268 1 16 LEU H 1 16 LEU HG . . 4.430 4.455 4.395 4.498 0.068 16 0 "[ . 1 . 2]" 1
269 1 16 LEU H 1 17 ASP H . . 3.490 2.833 2.701 3.000 . 0 0 "[ . 1 . 2]" 1
270 1 16 LEU H 1 18 GLU H . . 4.370 4.126 3.788 4.279 . 0 0 "[ . 1 . 2]" 1
271 1 16 LEU H 1 55 LEU QD . . 3.640 2.801 2.450 3.250 . 0 0 "[ . 1 . 2]" 1
272 1 16 LEU HA 1 16 LEU QD . . 3.330 2.247 2.094 2.496 . 0 0 "[ . 1 . 2]" 1
273 1 16 LEU HA 1 16 LEU HG . . 4.240 3.074 2.801 3.855 . 0 0 "[ . 1 . 2]" 1
274 1 16 LEU HA 1 19 CYS H . . 4.080 3.641 3.425 3.866 . 0 0 "[ . 1 . 2]" 1
275 1 16 LEU HA 1 19 CYS HB2 . . 4.010 2.767 2.610 3.530 . 0 0 "[ . 1 . 2]" 1
276 1 16 LEU HA 1 19 CYS HB3 . . 4.190 4.262 4.240 4.277 0.087 8 0 "[ . 1 . 2]" 1
277 1 16 LEU HA 1 20 LYS H . . 4.400 4.128 3.927 4.416 0.016 13 0 "[ . 1 . 2]" 1
278 1 16 LEU HA 1 51 ALA MB . . 4.560 4.223 3.796 4.571 0.011 15 0 "[ . 1 . 2]" 1
279 1 16 LEU HA 1 55 LEU QD . . 3.310 2.187 1.972 2.388 . 0 0 "[ . 1 . 2]" 1
280 1 16 LEU HB2 1 17 ASP H . . 4.160 3.867 3.670 4.047 . 0 0 "[ . 1 . 2]" 1
281 1 16 LEU HB2 1 55 LEU QD . . 4.410 2.597 2.209 3.107 . 0 0 "[ . 1 . 2]" 1
282 1 16 LEU HB3 1 17 ASP H . . 3.380 2.465 2.263 2.737 . 0 0 "[ . 1 . 2]" 1
283 1 16 LEU QD 1 17 ASP H . . 4.910 3.552 2.459 3.953 . 0 0 "[ . 1 . 2]" 1
284 1 16 LEU QD 1 19 CYS HB2 . . 4.730 3.555 2.807 4.365 . 0 0 "[ . 1 . 2]" 1
285 1 16 LEU QD 1 19 CYS HB3 . . 5.060 4.300 3.813 4.850 . 0 0 "[ . 1 . 2]" 1
286 1 16 LEU QD 1 20 LYS H . . 5.120 4.131 3.379 4.495 . 0 0 "[ . 1 . 2]" 1
287 1 16 LEU QD 1 20 LYS HD2 . . 5.320 2.613 1.964 3.324 . 0 0 "[ . 1 . 2]" 1
288 1 16 LEU QD 1 20 LYS HD3 . . 5.250 2.928 1.873 4.411 . 0 0 "[ . 1 . 2]" 1
289 1 16 LEU QD 1 20 LYS QE . . 4.870 3.676 2.282 4.106 . 0 0 "[ . 1 . 2]" 1
290 1 16 LEU QD 1 20 LYS HG2 . . 4.480 3.783 3.284 4.024 . 0 0 "[ . 1 . 2]" 1
291 1 16 LEU QD 1 20 LYS HG3 . . 5.330 2.940 2.124 3.294 . 0 0 "[ . 1 . 2]" 1
292 1 16 LEU QD 1 29 ILE MD . . 3.890 2.261 2.046 2.749 . 0 0 "[ . 1 . 2]" 1
293 1 16 LEU QD 1 29 ILE HG13 . . 5.030 2.388 2.097 3.256 . 0 0 "[ . 1 . 2]" 1
294 1 16 LEU QD 1 30 ASN HA . . 4.150 3.140 2.719 3.618 . 0 0 "[ . 1 . 2]" 1
295 1 16 LEU QD 1 33 PHE HB2 . . 4.850 3.635 3.259 3.992 . 0 0 "[ . 1 . 2]" 1
296 1 16 LEU QD 1 33 PHE HB3 . . 4.670 3.951 3.626 4.312 . 0 0 "[ . 1 . 2]" 1
297 1 16 LEU QD 1 33 PHE QD . . 3.820 2.468 2.153 3.221 . 0 0 "[ . 1 . 2]" 1
298 1 16 LEU QD 1 33 PHE QE . . 4.330 2.207 2.023 2.873 . 0 0 "[ . 1 . 2]" 1
299 1 16 LEU QD 1 33 PHE HZ . . 4.930 3.412 2.908 3.771 . 0 0 "[ . 1 . 2]" 1
300 1 16 LEU QD 1 51 ALA MB . . 3.730 2.353 1.997 2.742 . 0 0 "[ . 1 . 2]" 1
301 1 16 LEU QD 1 55 LEU QD . . 4.410 2.276 2.069 2.900 . 0 0 "[ . 1 . 2]" 1
302 1 16 LEU QD 1 55 LEU HG . . 5.370 3.479 3.089 4.082 . 0 0 "[ . 1 . 2]" 1
303 1 16 LEU HG 1 17 ASP HA . . 4.830 3.631 3.150 4.931 0.101 13 0 "[ . 1 . 2]" 1
304 1 16 LEU HG 1 20 LYS QE . . 4.890 4.284 3.864 4.779 . 0 0 "[ . 1 . 2]" 1
305 1 16 LEU HG 1 29 ILE MD . . 5.290 3.342 2.748 4.632 . 0 0 "[ . 1 . 2]" 1
306 1 17 ASP H 1 17 ASP HB2 . . 3.020 2.184 1.998 2.358 . 0 0 "[ . 1 . 2]" 1
307 1 17 ASP H 1 17 ASP HB3 . . 3.010 2.826 2.536 3.087 0.077 4 0 "[ . 1 . 2]" 1
308 1 17 ASP H 1 18 GLU H . . 3.090 2.588 2.400 2.710 . 0 0 "[ . 1 . 2]" 1
309 1 17 ASP HA 1 17 ASP HB2 . . 3.040 2.661 2.540 2.819 . 0 0 "[ . 1 . 2]" 1
310 1 17 ASP HA 1 20 LYS H . . 3.420 3.164 2.941 3.370 . 0 0 "[ . 1 . 2]" 1
311 1 17 ASP HA 1 20 LYS HB2 . . 2.910 2.133 2.031 2.294 . 0 0 "[ . 1 . 2]" 1
312 1 17 ASP HA 1 20 LYS HD2 . . 4.110 3.641 2.056 3.866 . 0 0 "[ . 1 . 2]" 1
313 1 17 ASP HA 1 20 LYS HD3 . . 3.480 2.066 1.969 2.729 . 0 0 "[ . 1 . 2]" 1
314 1 17 ASP HA 1 20 LYS QE . . 4.150 3.320 2.330 3.993 . 0 0 "[ . 1 . 2]" 1
315 1 17 ASP HA 1 20 LYS HG2 . . 4.180 4.262 4.245 4.283 0.103 16 0 "[ . 1 . 2]" 1
316 1 17 ASP HA 1 20 LYS HG3 . . 4.200 3.400 3.191 3.792 . 0 0 "[ . 1 . 2]" 1
317 1 17 ASP HA 1 21 LYS H . . 4.280 4.027 3.677 4.355 0.075 2 0 "[ . 1 . 2]" 1
318 1 17 ASP HB2 1 18 GLU H . . 3.530 3.601 3.506 3.624 0.094 9 0 "[ . 1 . 2]" 1
319 1 17 ASP HB3 1 18 GLU H . . 3.460 2.749 2.391 3.200 . 0 0 "[ . 1 . 2]" 1
320 1 17 ASP HB3 1 18 GLU HA . . 4.920 4.167 3.903 4.408 . 0 0 "[ . 1 . 2]" 1
321 1 18 GLU H 1 18 GLU QB . . 2.950 2.532 2.252 2.838 . 0 0 "[ . 1 . 2]" 1
322 1 18 GLU H 1 18 GLU HG2 . . 3.500 2.589 2.188 2.889 . 0 0 "[ . 1 . 2]" 1
323 1 18 GLU H 1 18 GLU HG3 . . 3.740 3.212 2.137 3.812 0.072 11 0 "[ . 1 . 2]" 1
324 1 18 GLU H 1 19 CYS H . . 3.200 2.834 2.651 3.010 . 0 0 "[ . 1 . 2]" 1
325 1 18 GLU H 1 19 CYS HB2 . . 4.650 4.681 4.519 4.723 0.073 11 0 "[ . 1 . 2]" 1
326 1 18 GLU H 1 20 LYS H . . 4.230 3.919 3.723 4.016 . 0 0 "[ . 1 . 2]" 1
327 1 18 GLU HA 1 18 GLU HG2 . . 3.360 2.647 2.441 3.189 . 0 0 "[ . 1 . 2]" 1
328 1 18 GLU HA 1 18 GLU HG3 . . 3.550 3.612 3.405 3.652 0.102 16 0 "[ . 1 . 2]" 1
329 1 18 GLU HA 1 21 LYS H . . 3.610 3.635 3.403 3.691 0.081 18 0 "[ . 1 . 2]" 1
330 1 18 GLU HA 1 21 LYS QB . . 3.450 3.260 2.946 3.523 0.073 16 0 "[ . 1 . 2]" 1
331 1 18 GLU HA 1 21 LYS QD . . 3.990 3.669 2.094 4.081 0.091 19 0 "[ . 1 . 2]" 1
332 1 18 GLU QB 1 19 CYS H . . 3.680 2.336 2.146 2.629 . 0 0 "[ . 1 . 2]" 1
333 1 18 GLU QB 1 58 LYS QD . . 4.010 3.345 3.038 3.658 . 0 0 "[ . 1 . 2]" 1
334 1 18 GLU QB 1 58 LYS QE . . 3.750 2.915 2.161 3.446 . 0 0 "[ . 1 . 2]" 1
335 1 18 GLU HG3 1 58 LYS QD . . 4.760 4.593 3.921 4.850 0.090 13 0 "[ . 1 . 2]" 1
336 1 19 CYS H 1 19 CYS HB2 . . 3.240 2.318 2.156 2.489 . 0 0 "[ . 1 . 2]" 1
337 1 19 CYS H 1 19 CYS HB3 . . 3.540 3.523 3.302 3.599 0.059 2 0 "[ . 1 . 2]" 1
338 1 19 CYS H 1 20 LYS H . . 3.150 2.860 2.655 3.020 . 0 0 "[ . 1 . 2]" 1
339 1 19 CYS H 1 55 LEU QD . . 5.130 3.967 3.594 4.360 . 0 0 "[ . 1 . 2]" 1
340 1 19 CYS H 1 58 LYS QE . . 4.730 3.766 3.162 4.303 . 0 0 "[ . 1 . 2]" 1
341 1 19 CYS HA 1 22 GLU H . . 3.660 3.428 2.882 3.718 0.058 10 0 "[ . 1 . 2]" 1
342 1 19 CYS HA 1 22 GLU HB2 . . 3.340 2.161 2.055 2.369 . 0 0 "[ . 1 . 2]" 1
343 1 19 CYS HA 1 22 GLU HB3 . . 3.550 3.597 3.486 3.631 0.081 8 0 "[ . 1 . 2]" 1
344 1 19 CYS HA 1 22 GLU HG2 . . 4.580 4.147 2.900 4.668 0.088 16 0 "[ . 1 . 2]" 1
345 1 19 CYS HA 1 22 GLU HG3 . . 4.470 2.966 2.267 3.708 . 0 0 "[ . 1 . 2]" 1
346 1 19 CYS HA 1 23 MET H . . 4.290 3.950 3.466 4.364 0.074 20 0 "[ . 1 . 2]" 1
347 1 19 CYS HA 1 23 MET HG2 . . 4.930 4.949 4.528 5.005 0.075 14 0 "[ . 1 . 2]" 1
348 1 19 CYS HA 1 23 MET HG3 . . 4.730 3.560 3.343 3.762 . 0 0 "[ . 1 . 2]" 1
349 1 19 CYS HA 1 25 LEU MD1 . . 5.270 4.554 4.042 5.103 . 0 0 "[ . 1 . 2]" 1
350 1 19 CYS HA 1 58 LYS QD . . 5.150 4.997 4.083 5.254 0.104 6 0 "[ . 1 . 2]" 1
351 1 19 CYS HA 1 58 LYS QE . . 4.060 3.420 2.952 4.069 0.009 20 0 "[ . 1 . 2]" 1
352 1 19 CYS HB2 1 20 LYS H . . 3.380 2.973 2.761 3.471 0.091 7 0 "[ . 1 . 2]" 1
353 1 19 CYS HB2 1 25 LEU MD1 . . 5.050 3.900 3.150 4.640 . 0 0 "[ . 1 . 2]" 1
354 1 19 CYS HB2 1 51 ALA HA . . 4.800 4.277 3.981 4.855 0.055 15 0 "[ . 1 . 2]" 1
355 1 19 CYS HB2 1 54 CYS HB3 . . 3.570 3.648 3.637 3.659 0.089 19 0 "[ . 1 . 2]" 1
356 1 19 CYS HB2 1 55 LEU QD . . 4.910 3.184 2.404 3.755 . 0 0 "[ . 1 . 2]" 1
357 1 19 CYS HB3 1 20 LYS H . . 3.880 3.631 3.211 3.804 . 0 0 "[ . 1 . 2]" 1
358 1 19 CYS HB3 1 22 GLU HB2 . . 4.900 4.381 4.153 4.714 . 0 0 "[ . 1 . 2]" 1
359 1 19 CYS HB3 1 23 MET ME . . 3.600 3.603 3.128 3.702 0.102 16 0 "[ . 1 . 2]" 1
360 1 19 CYS HB3 1 25 LEU MD1 . . 4.560 3.011 2.535 3.356 . 0 0 "[ . 1 . 2]" 1
361 1 19 CYS HB3 1 51 ALA HA . . 3.880 3.277 2.876 3.758 . 0 0 "[ . 1 . 2]" 1
362 1 19 CYS HB3 1 51 ALA MB . . 5.260 4.028 3.670 4.533 . 0 0 "[ . 1 . 2]" 1
363 1 19 CYS HB3 1 54 CYS HB2 . . 4.290 3.490 3.320 4.005 . 0 0 "[ . 1 . 2]" 1
364 1 19 CYS HB3 1 54 CYS HB3 . . 3.820 2.532 2.286 3.384 . 0 0 "[ . 1 . 2]" 1
365 1 19 CYS HB3 1 55 LEU QD . . 5.110 3.992 2.697 4.568 . 0 0 "[ . 1 . 2]" 1
366 1 20 LYS H 1 20 LYS HB2 . . 3.250 2.211 2.119 2.256 . 0 0 "[ . 1 . 2]" 1
367 1 20 LYS H 1 20 LYS HB3 . . 3.350 3.436 3.417 3.449 0.099 7 0 "[ . 1 . 2]" 1
368 1 20 LYS H 1 20 LYS HD3 . . 4.020 3.867 3.585 4.341 0.321 2 0 "[ . 1 . 2]" 1
369 1 20 LYS H 1 20 LYS HG2 . . 4.210 3.884 3.657 4.276 0.066 13 0 "[ . 1 . 2]" 1
370 1 20 LYS H 1 20 LYS HG3 . . 3.420 2.692 2.461 3.182 . 0 0 "[ . 1 . 2]" 1
371 1 20 LYS H 1 21 LYS H . . 3.030 2.855 2.713 3.072 0.042 4 0 "[ . 1 . 2]" 1
372 1 20 LYS H 1 29 ILE MD . . 4.700 4.587 4.354 4.775 0.075 9 0 "[ . 1 . 2]" 1
373 1 20 LYS HA 1 20 LYS HD2 . . 4.970 4.762 4.619 4.895 . 0 0 "[ . 1 . 2]" 1
374 1 20 LYS HA 1 20 LYS HG2 . . 3.760 2.638 2.507 2.796 . 0 0 "[ . 1 . 2]" 1
375 1 20 LYS HA 1 20 LYS HG3 . . 3.920 2.731 2.276 2.873 . 0 0 "[ . 1 . 2]" 1
376 1 20 LYS HA 1 24 THR HA . . 4.710 4.513 4.212 4.761 0.051 16 0 "[ . 1 . 2]" 1
377 1 20 LYS HA 1 25 LEU H . . 3.160 2.581 2.322 2.793 . 0 0 "[ . 1 . 2]" 1
378 1 20 LYS HA 1 25 LEU HB2 . . 2.870 2.135 2.047 2.287 . 0 0 "[ . 1 . 2]" 1
379 1 20 LYS HA 1 25 LEU MD1 . . 3.370 2.746 2.458 3.148 . 0 0 "[ . 1 . 2]" 1
380 1 20 LYS HA 1 25 LEU MD2 . . 4.580 4.078 3.821 4.352 . 0 0 "[ . 1 . 2]" 1
381 1 20 LYS HA 1 25 LEU HG . . 3.830 2.487 2.176 2.861 . 0 0 "[ . 1 . 2]" 1
382 1 20 LYS HA 1 29 ILE MD . . 4.770 3.690 3.533 3.909 . 0 0 "[ . 1 . 2]" 1
383 1 20 LYS HB2 1 20 LYS QE . . 4.290 2.917 2.185 3.902 . 0 0 "[ . 1 . 2]" 1
384 1 20 LYS HB2 1 25 LEU H . . 4.740 4.755 4.634 4.824 0.084 16 0 "[ . 1 . 2]" 1
385 1 20 LYS HB2 1 29 ILE MD . . 4.500 4.464 4.195 4.580 0.080 20 0 "[ . 1 . 2]" 1
386 1 20 LYS HB3 1 20 LYS QE . . 4.230 2.467 1.874 3.385 . 0 0 "[ . 1 . 2]" 1
387 1 20 LYS HB3 1 21 LYS H . . 3.250 3.178 2.949 3.329 0.079 14 0 "[ . 1 . 2]" 1
388 1 20 LYS HB3 1 25 LEU H . . 4.000 3.444 3.216 3.565 . 0 0 "[ . 1 . 2]" 1
389 1 20 LYS HB3 1 29 ILE MD . . 4.230 4.211 4.094 4.328 0.098 14 0 "[ . 1 . 2]" 1
390 1 20 LYS HD2 1 27 ASP HA . . 4.390 3.995 3.056 5.078 0.688 2 1 "[ + . 1 . 2]" 1
391 1 20 LYS HD2 1 29 ILE MD . . 4.240 2.506 2.227 3.741 . 0 0 "[ . 1 . 2]" 1
392 1 20 LYS HD3 1 29 ILE MD . . 4.220 3.627 2.994 4.152 . 0 0 "[ . 1 . 2]" 1
393 1 20 LYS QE 1 20 LYS HG2 . . 3.750 2.508 2.178 2.956 . 0 0 "[ . 1 . 2]" 1
394 1 20 LYS QE 1 25 LEU HB2 . . 4.780 4.359 4.117 4.680 . 0 0 "[ . 1 . 2]" 1
395 1 20 LYS QE 1 27 ASP HA . . 4.000 2.822 2.018 3.888 . 0 0 "[ . 1 . 2]" 1
396 1 20 LYS QE 1 29 ILE MD . . 4.290 3.503 2.715 3.926 . 0 0 "[ . 1 . 2]" 1
397 1 20 LYS QE 1 29 ILE HG12 . . 5.290 3.856 2.871 4.433 . 0 0 "[ . 1 . 2]" 1
398 1 20 LYS HG2 1 25 LEU H . . 3.910 3.924 3.697 3.992 0.082 12 0 "[ . 1 . 2]" 1
399 1 20 LYS HG2 1 25 LEU HB2 . . 3.290 2.300 2.056 2.621 . 0 0 "[ . 1 . 2]" 1
400 1 20 LYS HG2 1 29 ILE MD . . 3.850 2.232 2.082 2.473 . 0 0 "[ . 1 . 2]" 1
401 1 20 LYS HG3 1 29 ILE MD . . 4.080 2.336 2.006 2.542 . 0 0 "[ . 1 . 2]" 1
402 1 21 LYS H 1 21 LYS QB . . 2.530 2.158 1.741 2.444 . 0 0 "[ . 1 . 2]" 1
403 1 21 LYS H 1 21 LYS QD . . 4.100 2.960 2.103 4.198 0.098 6 0 "[ . 1 . 2]" 1
404 1 21 LYS H 1 21 LYS HG2 . . 3.790 4.065 3.873 4.330 0.540 2 3 "[ + . -1 * 2]" 1
405 1 21 LYS H 1 21 LYS HG3 . . 4.530 3.601 2.609 4.386 . 0 0 "[ . 1 . 2]" 1
406 1 21 LYS H 1 22 GLU H . . 2.900 2.617 2.397 2.802 . 0 0 "[ . 1 . 2]" 1
407 1 21 LYS HA 1 21 LYS QB . . 2.740 2.369 2.013 2.484 . 0 0 "[ . 1 . 2]" 1
408 1 21 LYS HA 1 21 LYS QD . . 3.800 3.617 2.701 3.919 0.119 10 0 "[ . 1 . 2]" 1
409 1 21 LYS HA 1 21 LYS HG2 . . 3.670 3.129 2.587 3.584 . 0 0 "[ . 1 . 2]" 1
410 1 21 LYS HA 1 21 LYS HG3 . . 3.770 2.629 2.198 3.841 0.071 10 0 "[ . 1 . 2]" 1
411 1 21 LYS HA 1 22 GLU H . . 3.570 3.572 3.409 3.640 0.070 14 0 "[ . 1 . 2]" 1
412 1 21 LYS HA 1 24 THR H . . 4.330 3.443 3.093 3.981 . 0 0 "[ . 1 . 2]" 1
413 1 21 LYS HA 1 24 THR HA . . 4.140 3.458 2.880 3.977 . 0 0 "[ . 1 . 2]" 1
414 1 21 LYS QB 1 21 LYS QD . . 2.800 2.275 1.996 2.626 . 0 0 "[ . 1 . 2]" 1
415 1 21 LYS QB 1 21 LYS HE2 . . 4.340 3.629 2.070 4.412 0.072 20 0 "[ . 1 . 2]" 1
416 1 21 LYS QB 1 22 GLU H . . 3.000 2.895 2.676 3.115 0.115 10 0 "[ . 1 . 2]" 1
417 1 21 LYS QD 1 22 GLU H . . 4.940 4.190 2.154 5.014 0.074 7 0 "[ . 1 . 2]" 1
418 1 22 GLU H 1 22 GLU HB2 . . 3.020 2.313 2.148 2.491 . 0 0 "[ . 1 . 2]" 1
419 1 22 GLU H 1 22 GLU HB3 . . 3.690 3.526 3.415 3.656 . 0 0 "[ . 1 . 2]" 1
420 1 22 GLU H 1 22 GLU HG2 . . 3.340 2.828 2.114 3.418 0.078 1 0 "[ . 1 . 2]" 1
421 1 22 GLU H 1 22 GLU HG3 . . 3.240 3.019 2.308 3.323 0.083 14 0 "[ . 1 . 2]" 1
422 1 22 GLU H 1 23 MET H . . 3.060 2.899 2.610 3.078 0.018 6 0 "[ . 1 . 2]" 1
423 1 22 GLU H 1 24 THR H . . 4.730 4.121 3.774 4.310 . 0 0 "[ . 1 . 2]" 1
424 1 22 GLU HA 1 22 GLU HB3 . . 2.920 2.620 2.526 2.708 . 0 0 "[ . 1 . 2]" 1
425 1 22 GLU HA 1 22 GLU HG2 . . 3.150 2.459 2.216 2.882 . 0 0 "[ . 1 . 2]" 1
426 1 22 GLU HA 1 24 THR H . . 4.590 4.458 4.230 4.655 0.065 20 0 "[ . 1 . 2]" 1
427 1 22 GLU HB2 1 23 MET H . . 3.320 2.654 2.190 2.972 . 0 0 "[ . 1 . 2]" 1
428 1 22 GLU HB3 1 22 GLU HG2 . . 2.980 2.867 2.452 3.048 0.068 8 0 "[ . 1 . 2]" 1
429 1 22 GLU HB3 1 23 MET H . . 3.440 3.384 3.040 3.527 0.087 17 0 "[ . 1 . 2]" 1
430 1 23 MET H 1 23 MET HB2 . . 3.090 2.503 2.364 2.606 . 0 0 "[ . 1 . 2]" 1
431 1 23 MET H 1 23 MET HB3 . . 3.590 3.639 3.573 3.673 0.083 18 0 "[ . 1 . 2]" 1
432 1 23 MET H 1 23 MET ME . . 4.620 4.390 4.028 4.664 0.044 17 0 "[ . 1 . 2]" 1
433 1 23 MET H 1 23 MET HG2 . . 3.720 3.432 3.036 3.795 0.075 4 0 "[ . 1 . 2]" 1
434 1 23 MET H 1 23 MET HG3 . . 3.480 2.660 2.357 2.996 . 0 0 "[ . 1 . 2]" 1
435 1 23 MET H 1 24 THR H . . 2.990 2.348 2.136 2.568 . 0 0 "[ . 1 . 2]" 1
436 1 23 MET H 1 24 THR HA . . 4.380 4.306 4.023 4.463 0.083 7 0 "[ . 1 . 2]" 1
437 1 23 MET H 1 25 LEU H . . 4.280 4.107 3.853 4.352 0.072 12 0 "[ . 1 . 2]" 1
438 1 23 MET H 1 25 LEU MD1 . . 4.880 4.302 3.942 4.649 . 0 0 "[ . 1 . 2]" 1
439 1 23 MET H 1 25 LEU MD2 . . 4.370 4.365 4.150 4.462 0.092 17 0 "[ . 1 . 2]" 1
440 1 23 MET H 1 25 LEU HG . . 4.590 3.489 3.354 3.684 . 0 0 "[ . 1 . 2]" 1
441 1 23 MET HA 1 23 MET HG2 . . 3.230 2.623 2.363 2.977 . 0 0 "[ . 1 . 2]" 1
442 1 23 MET HA 1 23 MET HG3 . . 3.640 3.311 2.834 3.636 . 0 0 "[ . 1 . 2]" 1
443 1 23 MET HA 1 24 THR H . . 3.600 3.283 3.189 3.448 . 0 0 "[ . 1 . 2]" 1
444 1 23 MET HA 1 25 LEU MD2 . . 4.740 4.392 4.207 4.658 . 0 0 "[ . 1 . 2]" 1
445 1 23 MET HB2 1 23 MET ME . . 3.430 2.583 2.313 2.903 . 0 0 "[ . 1 . 2]" 1
446 1 23 MET HB2 1 24 THR H . . 4.830 3.613 3.201 3.870 . 0 0 "[ . 1 . 2]" 1
447 1 23 MET HB2 1 25 LEU MD1 . . 3.930 2.816 2.506 3.246 . 0 0 "[ . 1 . 2]" 1
448 1 23 MET HB2 1 25 LEU MD2 . . 4.000 2.460 2.293 2.606 . 0 0 "[ . 1 . 2]" 1
449 1 23 MET HB2 1 25 LEU HG . . 3.640 2.235 2.107 2.438 . 0 0 "[ . 1 . 2]" 1
450 1 23 MET HB3 1 23 MET ME . . 2.940 2.486 2.269 2.767 . 0 0 "[ . 1 . 2]" 1
451 1 23 MET HB3 1 25 LEU MD1 . . 4.290 3.844 3.557 4.204 . 0 0 "[ . 1 . 2]" 1
452 1 23 MET HB3 1 25 LEU MD2 . . 3.980 2.684 2.444 3.017 . 0 0 "[ . 1 . 2]" 1
453 1 23 MET HB3 1 25 LEU HG . . 4.120 3.683 3.471 4.013 . 0 0 "[ . 1 . 2]" 1
454 1 23 MET ME 1 23 MET HG2 . . 3.240 3.066 2.515 3.349 0.109 19 0 "[ . 1 . 2]" 1
455 1 23 MET ME 1 23 MET HG3 . . 3.810 2.765 2.283 3.434 . 0 0 "[ . 1 . 2]" 1
456 1 23 MET ME 1 25 LEU MD1 . . 4.580 2.204 2.025 2.419 . 0 0 "[ . 1 . 2]" 1
457 1 23 MET ME 1 25 LEU MD2 . . 3.750 2.320 2.089 2.730 . 0 0 "[ . 1 . 2]" 1
458 1 23 MET ME 1 25 LEU HG . . 4.010 3.568 3.273 3.820 . 0 0 "[ . 1 . 2]" 1
459 1 23 MET ME 1 50 CYS HA . . 4.070 3.506 2.956 3.718 . 0 0 "[ . 1 . 2]" 1
460 1 23 MET ME 1 50 CYS HB2 . . 4.150 3.628 3.490 3.933 . 0 0 "[ . 1 . 2]" 1
461 1 23 MET ME 1 50 CYS HB3 . . 3.430 2.208 2.035 2.494 . 0 0 "[ . 1 . 2]" 1
462 1 23 MET ME 1 54 CYS H . . 4.210 3.289 3.024 3.470 . 0 0 "[ . 1 . 2]" 1
463 1 23 MET ME 1 54 CYS HA . . 4.240 4.062 3.838 4.313 0.073 6 0 "[ . 1 . 2]" 1
464 1 23 MET ME 1 54 CYS HB2 . . 3.940 2.193 2.010 2.486 . 0 0 "[ . 1 . 2]" 1
465 1 23 MET ME 1 54 CYS HB3 . . 4.910 3.112 2.866 3.337 . 0 0 "[ . 1 . 2]" 1
466 1 23 MET HG2 1 25 LEU MD2 . . 4.880 4.615 4.117 4.944 0.064 5 0 "[ . 1 . 2]" 1
467 1 23 MET HG3 1 25 LEU MD2 . . 4.580 4.354 4.004 4.662 0.082 16 0 "[ . 1 . 2]" 1
468 1 23 MET HG3 1 54 CYS HB2 . . 4.790 4.079 3.200 4.856 0.066 8 0 "[ . 1 . 2]" 1
469 1 24 THR H 1 24 THR HA . . 2.740 2.200 2.151 2.242 . 0 0 "[ . 1 . 2]" 1
470 1 24 THR H 1 24 THR HB . . 3.830 3.620 3.370 3.767 . 0 0 "[ . 1 . 2]" 1
471 1 24 THR H 1 24 THR MG . . 4.360 3.984 3.841 4.080 . 0 0 "[ . 1 . 2]" 1
472 1 24 THR H 1 25 LEU H . . 3.280 3.102 2.925 3.257 . 0 0 "[ . 1 . 2]" 1
473 1 24 THR H 1 25 LEU HG . . 5.040 3.902 3.488 4.242 . 0 0 "[ . 1 . 2]" 1
474 1 24 THR HA 1 24 THR MG . . 2.920 2.380 2.231 2.483 . 0 0 "[ . 1 . 2]" 1
475 1 24 THR HA 1 25 LEU H . . 2.810 2.270 2.093 2.386 . 0 0 "[ . 1 . 2]" 1
476 1 24 THR HA 1 25 LEU MD2 . . 4.770 4.441 4.280 4.574 . 0 0 "[ . 1 . 2]" 1
477 1 24 THR HA 1 25 LEU HG . . 4.380 4.386 4.147 4.455 0.075 8 0 "[ . 1 . 2]" 1
478 1 24 THR HB 1 25 LEU H . . 4.580 4.555 4.501 4.593 0.013 2 0 "[ . 1 . 2]" 1
479 1 24 THR MG 1 25 LEU H . . 3.900 3.684 3.537 3.830 . 0 0 "[ . 1 . 2]" 1
480 1 24 THR MG 1 25 LEU MD2 . . 4.250 4.378 4.358 4.392 0.142 11 0 "[ . 1 . 2]" 1
481 1 24 THR MG 1 26 THR HA . . 4.800 4.680 4.123 4.893 0.093 15 0 "[ . 1 . 2]" 1
482 1 24 THR MG 1 26 THR MG . . 3.600 3.718 3.677 3.749 0.149 6 0 "[ . 1 . 2]" 1
483 1 25 LEU H 1 25 LEU HB2 . . 3.570 2.822 2.743 2.924 . 0 0 "[ . 1 . 2]" 1
484 1 25 LEU H 1 25 LEU MD1 . . 4.230 4.050 3.989 4.105 . 0 0 "[ . 1 . 2]" 1
485 1 25 LEU H 1 25 LEU MD2 . . 3.660 3.430 3.254 3.583 . 0 0 "[ . 1 . 2]" 1
486 1 25 LEU H 1 25 LEU HG . . 3.480 2.696 2.569 2.824 . 0 0 "[ . 1 . 2]" 1
487 1 25 LEU H 1 26 THR H . . 4.770 4.418 4.320 4.518 . 0 0 "[ . 1 . 2]" 1
488 1 25 LEU HA 1 25 LEU MD1 . . 4.340 3.896 3.852 3.970 . 0 0 "[ . 1 . 2]" 1
489 1 25 LEU HA 1 25 LEU MD2 . . 3.050 2.302 2.211 2.458 . 0 0 "[ . 1 . 2]" 1
490 1 25 LEU HA 1 25 LEU HG . . 4.160 3.382 3.308 3.449 . 0 0 "[ . 1 . 2]" 1
491 1 25 LEU HA 1 26 THR H . . 3.210 2.291 2.155 2.649 . 0 0 "[ . 1 . 2]" 1
492 1 25 LEU HA 1 26 THR MG . . 4.190 3.156 2.656 3.490 . 0 0 "[ . 1 . 2]" 1
493 1 25 LEU HA 1 47 GLU QB . . 4.230 3.363 2.955 3.665 . 0 0 "[ . 1 . 2]" 1
494 1 25 LEU HB2 1 26 THR H . . 4.130 3.652 2.853 4.013 . 0 0 "[ . 1 . 2]" 1
495 1 25 LEU HB3 1 25 LEU MD1 . . 3.320 2.384 2.333 2.435 . 0 0 "[ . 1 . 2]" 1
496 1 25 LEU HB3 1 26 THR H . . 3.780 2.849 2.181 3.227 . 0 0 "[ . 1 . 2]" 1
497 1 25 LEU MD1 1 50 CYS HB2 . . 4.850 4.015 3.475 4.710 . 0 0 "[ . 1 . 2]" 1
498 1 25 LEU MD1 1 50 CYS HB3 . . 4.850 3.063 2.480 3.760 . 0 0 "[ . 1 . 2]" 1
499 1 25 LEU MD1 1 51 ALA H . . 3.730 2.841 2.519 3.387 . 0 0 "[ . 1 . 2]" 1
500 1 25 LEU MD1 1 51 ALA HA . . 3.670 2.388 2.159 2.757 . 0 0 "[ . 1 . 2]" 1
501 1 25 LEU MD1 1 51 ALA MB . . 3.160 2.103 2.036 2.337 . 0 0 "[ . 1 . 2]" 1
502 1 25 LEU MD2 1 26 THR H . . 4.450 3.963 3.772 4.142 . 0 0 "[ . 1 . 2]" 1
503 1 25 LEU MD2 1 26 THR MG . . 4.570 4.489 4.072 4.682 0.112 20 0 "[ . 1 . 2]" 1
504 1 25 LEU MD2 1 47 GLU HA . . 3.780 2.910 2.592 3.363 . 0 0 "[ . 1 . 2]" 1
505 1 25 LEU MD2 1 47 GLU HG3 . . 4.450 4.232 3.332 5.014 0.564 16 1 "[ . 1 .+ 2]" 1
506 1 25 LEU MD2 1 50 CYS HB2 . . 3.870 3.512 3.036 3.944 0.074 7 0 "[ . 1 . 2]" 1
507 1 25 LEU MD2 1 50 CYS HB3 . . 4.030 2.879 2.407 3.514 . 0 0 "[ . 1 . 2]" 1
508 1 25 LEU MD2 1 51 ALA H . . 4.780 4.098 3.771 4.579 . 0 0 "[ . 1 . 2]" 1
509 1 26 THR H 1 26 THR MG . . 3.260 2.163 1.946 2.723 . 0 0 "[ . 1 . 2]" 1
510 1 26 THR H 1 29 ILE MG . . 4.970 3.181 2.651 3.705 . 0 0 "[ . 1 . 2]" 1
511 1 26 THR HA 1 26 THR MG . . 3.310 2.366 2.244 2.558 . 0 0 "[ . 1 . 2]" 1
512 1 26 THR HA 1 27 ASP H . . 2.770 2.521 2.366 2.823 0.053 12 0 "[ . 1 . 2]" 1
513 1 26 THR HA 1 27 ASP HA . . 4.720 4.404 4.270 4.504 . 0 0 "[ . 1 . 2]" 1
514 1 26 THR HA 1 27 ASP QB . . 4.310 4.221 4.097 4.261 . 0 0 "[ . 1 . 2]" 1
515 1 26 THR HA 1 28 ALA H . . 4.220 4.005 3.827 4.276 0.056 11 0 "[ . 1 . 2]" 1
516 1 26 THR HB 1 27 ASP H . . 2.610 2.451 1.964 2.663 0.053 20 0 "[ . 1 . 2]" 1
517 1 26 THR HB 1 28 ALA H . . 3.210 2.526 2.044 3.249 0.039 12 0 "[ . 1 . 2]" 1
518 1 26 THR HB 1 28 ALA MB . . 4.450 3.211 2.603 4.060 . 0 0 "[ . 1 . 2]" 1
519 1 26 THR MG 1 27 ASP H . . 3.960 3.764 3.555 3.996 0.036 7 0 "[ . 1 . 2]" 1
520 1 26 THR MG 1 28 ALA H . . 4.130 4.040 3.623 4.225 0.095 11 0 "[ . 1 . 2]" 1
521 1 26 THR MG 1 29 ILE MD . . 4.740 4.836 4.718 4.873 0.133 6 0 "[ . 1 . 2]" 1
522 1 26 THR MG 1 29 ILE MG . . 4.240 4.147 3.830 4.353 0.113 20 0 "[ . 1 . 2]" 1
523 1 26 THR MG 1 47 GLU QB . . 4.450 3.818 3.340 4.084 . 0 0 "[ . 1 . 2]" 1
524 1 27 ASP H 1 27 ASP QB . . 3.060 2.209 2.023 2.390 . 0 0 "[ . 1 . 2]" 1
525 1 27 ASP H 1 28 ALA H . . 3.070 2.386 2.074 2.559 . 0 0 "[ . 1 . 2]" 1
526 1 27 ASP H 1 28 ALA HA . . 4.880 4.908 4.677 4.962 0.082 10 0 "[ . 1 . 2]" 1
527 1 27 ASP H 1 28 ALA MB . . 4.580 4.089 3.834 4.306 . 0 0 "[ . 1 . 2]" 1
528 1 27 ASP HA 1 29 ILE H . . 3.760 3.632 3.295 3.833 0.073 9 0 "[ . 1 . 2]" 1
529 1 27 ASP HA 1 29 ILE HG12 . . 5.020 3.440 3.161 3.878 . 0 0 "[ . 1 . 2]" 1
530 1 27 ASP HA 1 29 ILE HG13 . . 5.120 4.766 3.895 5.172 0.052 17 0 "[ . 1 . 2]" 1
531 1 27 ASP HA 1 29 ILE MG . . 5.180 4.922 4.516 5.292 0.112 9 0 "[ . 1 . 2]" 1
532 1 27 ASP HA 1 30 ASN H . . 3.730 3.268 2.683 3.805 0.075 11 0 "[ . 1 . 2]" 1
533 1 27 ASP HA 1 30 ASN HD21 . . 4.870 3.377 2.509 4.156 . 0 0 "[ . 1 . 2]" 1
534 1 27 ASP QB 1 28 ALA H . . 3.860 3.427 2.711 3.687 . 0 0 "[ . 1 . 2]" 1
535 1 27 ASP QB 1 28 ALA HA . . 5.100 4.470 3.704 4.825 . 0 0 "[ . 1 . 2]" 1
536 1 27 ASP QB 1 30 ASN HD21 . . 5.040 3.328 2.637 3.937 . 0 0 "[ . 1 . 2]" 1
537 1 27 ASP QB 1 30 ASN HD22 . . 4.760 4.494 3.370 4.710 . 0 0 "[ . 1 . 2]" 1
538 1 28 ALA H 1 28 ALA MB . . 2.760 2.243 2.174 2.311 . 0 0 "[ . 1 . 2]" 1
539 1 28 ALA H 1 29 ILE H . . 2.980 2.827 2.531 3.050 0.070 16 0 "[ . 1 . 2]" 1
540 1 28 ALA H 1 29 ILE MG . . 4.730 4.227 3.725 4.642 . 0 0 "[ . 1 . 2]" 1
541 1 28 ALA H 1 30 ASN H . . 4.480 4.237 3.963 4.528 0.048 5 0 "[ . 1 . 2]" 1
542 1 28 ALA HA 1 30 ASN H . . 4.340 3.829 3.561 4.163 . 0 0 "[ . 1 . 2]" 1
543 1 28 ALA HA 1 31 GLU QB . . 3.820 2.938 2.303 3.549 . 0 0 "[ . 1 . 2]" 1
544 1 28 ALA HA 1 31 GLU QG . . 4.610 4.297 3.420 4.524 . 0 0 "[ . 1 . 2]" 1
545 1 28 ALA MB 1 29 ILE H . . 3.570 2.929 2.723 3.249 . 0 0 "[ . 1 . 2]" 1
546 1 28 ALA MB 1 29 ILE HA . . 4.960 4.009 3.860 4.173 . 0 0 "[ . 1 . 2]" 1
547 1 28 ALA MB 1 29 ILE MD . . 5.190 5.174 4.898 5.292 0.102 9 0 "[ . 1 . 2]" 1
548 1 28 ALA MB 1 29 ILE MG . . 4.310 3.417 3.106 3.692 . 0 0 "[ . 1 . 2]" 1
549 1 28 ALA MB 1 31 GLU QB . . 4.920 3.786 3.490 4.161 . 0 0 "[ . 1 . 2]" 1
550 1 28 ALA MB 1 45 ASN QB . . 4.900 4.285 3.385 4.916 0.016 8 0 "[ . 1 . 2]" 1
551 1 28 ALA MB 1 45 ASN HD21 . . 5.110 3.190 2.437 4.527 . 0 0 "[ . 1 . 2]" 1
552 1 28 ALA MB 1 45 ASN HD22 . . 3.860 2.877 1.896 3.953 0.093 3 0 "[ . 1 . 2]" 1
553 1 29 ILE H 1 29 ILE HB . . 3.780 3.669 3.605 3.719 . 0 0 "[ . 1 . 2]" 1
554 1 29 ILE H 1 29 ILE MD . . 4.260 3.527 3.315 3.751 . 0 0 "[ . 1 . 2]" 1
555 1 29 ILE H 1 29 ILE HG12 . . 3.350 2.318 1.999 2.559 . 0 0 "[ . 1 . 2]" 1
556 1 29 ILE H 1 29 ILE HG13 . . 3.770 3.644 3.153 3.841 0.071 10 0 "[ . 1 . 2]" 1
557 1 29 ILE H 1 29 ILE MG . . 3.220 2.316 2.049 2.575 . 0 0 "[ . 1 . 2]" 1
558 1 29 ILE H 1 30 ASN H . . 2.990 2.576 2.248 2.801 . 0 0 "[ . 1 . 2]" 1
559 1 29 ILE H 1 31 GLU QB . . 5.060 5.023 4.475 5.167 0.107 11 0 "[ . 1 . 2]" 1
560 1 29 ILE H 1 32 ASP H . . 4.840 4.792 4.427 4.926 0.086 1 0 "[ . 1 . 2]" 1
561 1 29 ILE HA 1 29 ILE MD . . 4.360 4.216 4.164 4.261 . 0 0 "[ . 1 . 2]" 1
562 1 29 ILE HA 1 29 ILE MG . . 3.310 2.362 2.255 2.548 . 0 0 "[ . 1 . 2]" 1
563 1 29 ILE HA 1 32 ASP H . . 3.840 2.843 2.661 3.190 . 0 0 "[ . 1 . 2]" 1
564 1 29 ILE HA 1 32 ASP QB . . 3.960 2.455 2.081 3.821 . 0 0 "[ . 1 . 2]" 1
565 1 29 ILE HB 1 29 ILE MD . . 3.520 2.564 2.366 2.677 . 0 0 "[ . 1 . 2]" 1
566 1 29 ILE HB 1 30 ASN H . . 4.200 4.188 4.023 4.282 0.082 5 0 "[ . 1 . 2]" 1
567 1 29 ILE HB 1 32 ASP H . . 5.080 4.707 4.448 5.144 0.064 6 0 "[ . 1 . 2]" 1
568 1 29 ILE HB 1 33 PHE QD . . 3.880 3.265 2.465 3.884 0.004 16 0 "[ . 1 . 2]" 1
569 1 29 ILE HB 1 33 PHE QE . . 4.070 2.676 2.421 3.323 . 0 0 "[ . 1 . 2]" 1
570 1 29 ILE HB 1 48 THR HB . . 4.230 3.577 2.514 4.250 0.020 9 0 "[ . 1 . 2]" 1
571 1 29 ILE HB 1 48 THR MG . . 3.960 2.272 1.976 2.844 . 0 0 "[ . 1 . 2]" 1
572 1 29 ILE MD 1 29 ILE MG . . 3.280 2.046 2.006 2.104 . 0 0 "[ . 1 . 2]" 1
573 1 29 ILE MD 1 30 ASN H . . 4.730 4.249 3.956 4.457 . 0 0 "[ . 1 . 2]" 1
574 1 29 ILE MD 1 33 PHE QD . . 4.410 3.866 3.399 4.355 . 0 0 "[ . 1 . 2]" 1
575 1 29 ILE MD 1 33 PHE QE . . 3.850 2.635 2.271 2.994 . 0 0 "[ . 1 . 2]" 1
576 1 29 ILE MD 1 33 PHE HZ . . 5.380 4.303 3.795 4.729 . 0 0 "[ . 1 . 2]" 1
577 1 29 ILE HG12 1 29 ILE MG . . 3.390 2.674 2.381 2.805 . 0 0 "[ . 1 . 2]" 1
578 1 29 ILE HG12 1 30 ASN H . . 3.640 2.681 2.298 3.070 . 0 0 "[ . 1 . 2]" 1
579 1 29 ILE HG12 1 30 ASN HA . . 4.690 4.336 3.841 4.771 0.081 9 0 "[ . 1 . 2]" 1
580 1 29 ILE HG13 1 30 ASN H . . 3.540 3.228 2.603 3.599 0.059 16 0 "[ . 1 . 2]" 1
581 1 29 ILE HG13 1 30 ASN HA . . 4.280 3.611 3.271 3.960 . 0 0 "[ . 1 . 2]" 1
582 1 29 ILE HG13 1 33 PHE QD . . 4.940 2.666 2.306 3.335 . 0 0 "[ . 1 . 2]" 1
583 1 29 ILE HG13 1 33 PHE QE . . 4.970 2.765 2.388 3.998 . 0 0 "[ . 1 . 2]" 1
584 1 29 ILE HG13 1 48 THR MG . . 4.800 4.320 3.889 4.735 . 0 0 "[ . 1 . 2]" 1
585 1 29 ILE MG 1 30 ASN H . . 4.190 4.103 3.850 4.276 0.086 20 0 "[ . 1 . 2]" 1
586 1 29 ILE MG 1 33 PHE QD . . 5.190 4.659 4.082 5.040 . 0 0 "[ . 1 . 2]" 1
587 1 29 ILE MG 1 45 ASN QB . . 4.390 3.055 2.439 3.840 . 0 0 "[ . 1 . 2]" 1
588 1 29 ILE MG 1 45 ASN HD22 . . 4.930 3.825 2.395 4.662 . 0 0 "[ . 1 . 2]" 1
589 1 29 ILE MG 1 47 GLU HA . . 4.610 4.024 3.848 4.250 . 0 0 "[ . 1 . 2]" 1
590 1 29 ILE MG 1 47 GLU QB . . 3.630 2.208 1.978 2.385 . 0 0 "[ . 1 . 2]" 1
591 1 29 ILE MG 1 47 GLU HG3 . . 5.100 4.278 3.480 4.860 . 0 0 "[ . 1 . 2]" 1
592 1 29 ILE MG 1 48 THR H . . 4.170 3.110 2.800 3.360 . 0 0 "[ . 1 . 2]" 1
593 1 29 ILE MG 1 48 THR HB . . 3.700 3.784 3.418 3.824 0.124 9 0 "[ . 1 . 2]" 1
594 1 29 ILE MG 1 51 ALA H . . 4.830 4.319 4.059 4.632 . 0 0 "[ . 1 . 2]" 1
595 1 29 ILE MG 1 51 ALA MB . . 4.420 3.146 2.680 3.695 . 0 0 "[ . 1 . 2]" 1
596 1 30 ASN H 1 30 ASN HB2 . . 2.940 2.469 2.099 3.528 0.588 5 2 "[ + 1- . 2]" 1
597 1 30 ASN H 1 30 ASN HB3 . . 3.430 3.126 2.143 3.519 0.089 17 0 "[ . 1 . 2]" 1
598 1 30 ASN H 1 30 ASN HD21 . . 4.720 3.714 2.171 4.666 . 0 0 "[ . 1 . 2]" 1
599 1 30 ASN H 1 32 ASP H . . 4.510 4.040 3.740 4.339 . 0 0 "[ . 1 . 2]" 1
600 1 30 ASN H 1 33 PHE QD . . 4.990 4.371 4.048 4.684 . 0 0 "[ . 1 . 2]" 1
601 1 30 ASN HA 1 30 ASN HD21 . . 4.450 4.275 3.925 4.510 0.060 17 0 "[ . 1 . 2]" 1
602 1 30 ASN HA 1 30 ASN HD22 . . 4.640 4.589 4.267 4.747 0.107 5 0 "[ . 1 . 2]" 1
603 1 30 ASN HA 1 33 PHE H . . 4.070 3.559 3.410 3.773 . 0 0 "[ . 1 . 2]" 1
604 1 30 ASN HA 1 33 PHE HB2 . . 3.320 2.664 2.529 2.829 . 0 0 "[ . 1 . 2]" 1
605 1 30 ASN HA 1 33 PHE HB3 . . 4.180 4.228 4.112 4.262 0.082 5 0 "[ . 1 . 2]" 1
606 1 30 ASN HA 1 33 PHE QD . . 3.900 2.873 2.597 3.237 . 0 0 "[ . 1 . 2]" 1
607 1 30 ASN HB2 1 31 GLU H . . 3.720 3.320 2.382 4.408 0.688 13 1 "[ . 1 + . 2]" 1
608 1 30 ASN HB3 1 31 GLU H . . 4.520 3.380 2.520 4.189 . 0 0 "[ . 1 . 2]" 1
609 1 31 GLU H 1 31 GLU QB . . 2.750 2.127 1.873 2.291 . 0 0 "[ . 1 . 2]" 1
610 1 31 GLU H 1 31 GLU QG . . 4.010 3.518 3.131 3.767 . 0 0 "[ . 1 . 2]" 1
611 1 31 GLU H 1 32 ASP H . . 2.960 2.621 2.374 2.944 . 0 0 "[ . 1 . 2]" 1
612 1 31 GLU HA 1 31 GLU QB . . 2.670 2.400 2.068 2.582 . 0 0 "[ . 1 . 2]" 1
613 1 31 GLU HA 1 34 TYR HB2 . . 3.670 3.597 2.143 3.749 0.079 19 0 "[ . 1 . 2]" 1
614 1 31 GLU HA 1 34 TYR HB3 . . 3.560 2.456 2.150 3.119 . 0 0 "[ . 1 . 2]" 1
615 1 31 GLU HA 1 34 TYR QD . . 3.670 3.001 2.505 3.575 . 0 0 "[ . 1 . 2]" 1
616 1 31 GLU HA 1 35 ASN H . . 4.650 3.667 3.201 4.123 . 0 0 "[ . 1 . 2]" 1
617 1 31 GLU HA 1 35 ASN HD21 . . 4.970 3.393 2.886 4.228 . 0 0 "[ . 1 . 2]" 1
618 1 31 GLU HA 1 35 ASN HD22 . . 4.580 3.756 3.014 4.504 . 0 0 "[ . 1 . 2]" 1
619 1 31 GLU QB 1 32 ASP H . . 3.290 2.883 2.476 3.373 0.083 13 0 "[ . 1 . 2]" 1
620 1 31 GLU QB 1 34 TYR QD . . 4.570 4.446 3.927 4.688 0.118 16 0 "[ . 1 . 2]" 1
621 1 31 GLU QB 1 35 ASN HD21 . . 4.250 3.362 2.737 4.188 . 0 0 "[ . 1 . 2]" 1
622 1 31 GLU QB 1 35 ASN HD22 . . 4.610 3.693 2.030 4.693 0.083 8 0 "[ . 1 . 2]" 1
623 1 31 GLU QB 1 41 TYR QE . . 4.760 4.403 3.476 4.899 0.139 6 0 "[ . 1 . 2]" 1
624 1 31 GLU QG 1 35 ASN HD21 . . 4.540 2.546 1.806 3.726 . 0 0 "[ . 1 . 2]" 1
625 1 31 GLU QG 1 35 ASN HD22 . . 4.320 2.757 2.042 3.272 . 0 0 "[ . 1 . 2]" 1
626 1 32 ASP H 1 32 ASP QB . . 3.280 2.314 2.158 2.606 . 0 0 "[ . 1 . 2]" 1
627 1 32 ASP H 1 33 PHE H . . 3.310 2.744 2.581 2.921 . 0 0 "[ . 1 . 2]" 1
628 1 32 ASP H 1 33 PHE HB2 . . 4.660 4.654 4.258 4.734 0.074 6 0 "[ . 1 . 2]" 1
629 1 32 ASP H 1 48 THR MG . . 5.280 3.924 3.573 4.334 . 0 0 "[ . 1 . 2]" 1
630 1 32 ASP HA 1 35 ASN H . . 4.620 3.736 3.298 4.226 . 0 0 "[ . 1 . 2]" 1
631 1 32 ASP HA 1 35 ASN HB3 . . 4.720 4.945 4.095 5.481 0.761 1 4 "[+ . - 1* .* 2]" 1
632 1 32 ASP HA 1 41 TYR QE . . 2.890 2.957 2.852 3.005 0.115 1 0 "[ . 1 . 2]" 1
633 1 32 ASP HA 1 43 ILE MG . . 5.400 4.737 4.016 5.265 . 0 0 "[ . 1 . 2]" 1
634 1 32 ASP QB 1 33 PHE H . . 4.110 2.580 2.166 3.583 . 0 0 "[ . 1 . 2]" 1
635 1 32 ASP QB 1 41 TYR QE . . 3.960 3.530 2.200 3.866 . 0 0 "[ . 1 . 2]" 1
636 1 32 ASP QB 1 43 ILE MD . . 4.780 4.057 2.688 4.667 . 0 0 "[ . 1 . 2]" 1
637 1 32 ASP QB 1 43 ILE HG12 . . 4.770 3.677 2.118 4.524 . 0 0 "[ . 1 . 2]" 1
638 1 32 ASP QB 1 43 ILE MG . . 4.030 3.191 2.294 3.780 . 0 0 "[ . 1 . 2]" 1
639 1 32 ASP QB 1 48 THR MG . . 3.570 2.104 1.865 3.300 . 0 0 "[ . 1 . 2]" 1
640 1 33 PHE H 1 33 PHE HB2 . . 3.190 2.309 2.215 2.488 . 0 0 "[ . 1 . 2]" 1
641 1 33 PHE H 1 33 PHE HB3 . . 3.600 3.543 3.489 3.614 0.014 19 0 "[ . 1 . 2]" 1
642 1 33 PHE H 1 33 PHE QD . . 3.450 3.124 2.675 3.529 0.079 16 0 "[ . 1 . 2]" 1
643 1 33 PHE H 1 34 TYR H . . 3.540 2.733 2.167 3.091 . 0 0 "[ . 1 . 2]" 1
644 1 33 PHE HA 1 33 PHE QD . . 3.470 2.366 2.012 2.788 . 0 0 "[ . 1 . 2]" 1
645 1 33 PHE HA 1 33 PHE QE . . 4.900 4.417 4.290 4.641 . 0 0 "[ . 1 . 2]" 1
646 1 33 PHE HA 1 36 PHE H . . 3.890 3.500 3.336 3.690 . 0 0 "[ . 1 . 2]" 1
647 1 33 PHE HA 1 36 PHE HA . . 4.730 4.597 4.336 4.791 0.061 1 0 "[ . 1 . 2]" 1
648 1 33 PHE HA 1 36 PHE HB2 . . 4.110 2.354 2.156 2.525 . 0 0 "[ . 1 . 2]" 1
649 1 33 PHE HA 1 36 PHE HB3 . . 3.380 3.455 3.443 3.468 0.088 19 0 "[ . 1 . 2]" 1
650 1 33 PHE HA 1 36 PHE QD . . 3.950 3.698 3.140 4.050 0.100 13 0 "[ . 1 . 2]" 1
651 1 33 PHE HB2 1 34 TYR H . . 4.090 2.781 2.554 3.007 . 0 0 "[ . 1 . 2]" 1
652 1 33 PHE HB3 1 34 TYR H . . 4.250 3.565 3.263 3.891 . 0 0 "[ . 1 . 2]" 1
653 1 33 PHE QD 1 34 TYR H . . 4.550 4.563 4.450 4.638 0.088 5 0 "[ . 1 . 2]" 1
654 1 33 PHE QD 1 51 ALA MB . . 4.570 4.281 4.003 4.580 0.010 1 0 "[ . 1 . 2]" 1
655 1 33 PHE QE 1 48 THR HB . . 3.820 3.667 3.026 3.907 0.087 4 0 "[ . 1 . 2]" 1
656 1 33 PHE QE 1 51 ALA MB . . 3.410 2.397 2.099 2.718 . 0 0 "[ . 1 . 2]" 1
657 1 33 PHE QE 1 52 ILE H . . 4.610 4.312 4.123 4.453 . 0 0 "[ . 1 . 2]" 1
658 1 33 PHE QE 1 52 ILE HA . . 4.810 4.174 3.606 4.719 . 0 0 "[ . 1 . 2]" 1
659 1 33 PHE QE 1 52 ILE MD . . 4.390 2.837 2.251 4.100 . 0 0 "[ . 1 . 2]" 1
660 1 33 PHE QE 1 52 ILE HG12 . . 3.430 2.569 2.197 3.380 . 0 0 "[ . 1 . 2]" 1
661 1 33 PHE QE 1 52 ILE HG13 . . 3.700 2.833 2.504 3.418 . 0 0 "[ . 1 . 2]" 1
662 1 33 PHE QE 1 55 LEU QD . . 3.860 3.373 2.970 3.816 . 0 0 "[ . 1 . 2]" 1
663 1 33 PHE HZ 1 48 THR HA . . 3.700 3.614 2.866 3.779 0.079 13 0 "[ . 1 . 2]" 1
664 1 33 PHE HZ 1 48 THR HB . . 3.940 3.686 2.959 3.998 0.058 10 0 "[ . 1 . 2]" 1
665 1 33 PHE HZ 1 51 ALA H . . 4.870 4.645 4.176 4.910 0.040 9 0 "[ . 1 . 2]" 1
666 1 33 PHE HZ 1 51 ALA MB . . 3.330 2.242 2.019 2.419 . 0 0 "[ . 1 . 2]" 1
667 1 33 PHE HZ 1 52 ILE H . . 4.400 3.146 2.881 3.334 . 0 0 "[ . 1 . 2]" 1
668 1 33 PHE HZ 1 52 ILE HA . . 4.450 3.647 3.202 4.309 . 0 0 "[ . 1 . 2]" 1
669 1 33 PHE HZ 1 52 ILE MD . . 4.600 3.500 3.220 3.966 . 0 0 "[ . 1 . 2]" 1
670 1 33 PHE HZ 1 52 ILE HG12 . . 3.860 3.219 2.834 3.894 0.034 5 0 "[ . 1 . 2]" 1
671 1 33 PHE HZ 1 52 ILE HG13 . . 3.770 2.218 2.090 2.557 . 0 0 "[ . 1 . 2]" 1
672 1 33 PHE HZ 1 55 LEU QD . . 4.020 3.208 2.849 4.078 0.058 5 0 "[ . 1 . 2]" 1
673 1 34 TYR H 1 34 TYR HB2 . . 3.440 2.574 2.125 2.842 . 0 0 "[ . 1 . 2]" 1
674 1 34 TYR H 1 34 TYR HB3 . . 3.360 2.298 2.172 3.210 . 0 0 "[ . 1 . 2]" 1
675 1 34 TYR H 1 34 TYR QD . . 4.020 4.081 3.803 4.119 0.099 19 0 "[ . 1 . 2]" 1
676 1 34 TYR H 1 35 ASN H . . 3.620 2.665 2.473 2.804 . 0 0 "[ . 1 . 2]" 1
677 1 34 TYR HA 1 34 TYR QD . . 3.040 2.496 2.204 2.931 . 0 0 "[ . 1 . 2]" 1
678 1 34 TYR HB2 1 35 ASN H . . 3.980 3.834 3.159 4.047 0.067 3 0 "[ . 1 . 2]" 1
679 1 34 TYR HB3 1 35 ASN H . . 3.710 2.487 2.183 2.750 . 0 0 "[ . 1 . 2]" 1
680 1 34 TYR HB3 1 35 ASN HD21 . . 4.630 3.992 3.266 4.678 0.048 6 0 "[ . 1 . 2]" 1
681 1 34 TYR QD 1 35 ASN HA . . 4.340 4.235 3.501 4.413 0.073 13 0 "[ . 1 . 2]" 1
682 1 35 ASN H 1 35 ASN HB2 . . 3.950 2.582 2.336 3.695 . 0 0 "[ . 1 . 2]" 1
683 1 35 ASN H 1 35 ASN HB3 . . 3.550 3.566 2.740 3.685 0.135 8 0 "[ . 1 . 2]" 1
684 1 35 ASN H 1 36 PHE H . . 3.410 2.624 2.336 2.840 . 0 0 "[ . 1 . 2]" 1
685 1 35 ASN HA 1 37 TRP H . . 4.480 3.856 3.361 4.542 0.062 14 0 "[ . 1 . 2]" 1
686 1 35 ASN HA 1 38 LYS H . . 4.670 4.087 3.251 4.725 0.055 12 0 "[ . 1 . 2]" 1
687 1 35 ASN HA 1 38 LYS QD . . 4.720 3.181 2.045 4.804 0.084 13 0 "[ . 1 . 2]" 1
688 1 35 ASN HA 1 38 LYS QE . . 4.240 3.908 3.312 4.321 0.081 4 0 "[ . 1 . 2]" 1
689 1 35 ASN HA 1 38 LYS QG . . 5.020 3.504 2.520 4.434 . 0 0 "[ . 1 . 2]" 1
690 1 35 ASN HB2 1 41 TYR QD . . 4.300 3.263 2.746 4.115 . 0 0 "[ . 1 . 2]" 1
691 1 35 ASN HB2 1 41 TYR QE . . 4.230 2.735 2.151 4.320 0.090 6 0 "[ . 1 . 2]" 1
692 1 35 ASN HB3 1 36 PHE H . . 4.870 4.324 3.602 4.617 . 0 0 "[ . 1 . 2]" 1
693 1 35 ASN HB3 1 38 LYS QG . . 4.250 2.778 2.199 4.160 . 0 0 "[ . 1 . 2]" 1
694 1 35 ASN HD21 1 41 TYR QD . . 4.320 4.342 3.883 4.416 0.096 14 0 "[ . 1 . 2]" 1
695 1 35 ASN HD22 1 41 TYR QE . . 4.840 3.655 1.995 4.496 . 0 0 "[ . 1 . 2]" 1
696 1 36 PHE H 1 36 PHE HB2 . . 3.460 2.337 2.185 2.423 . 0 0 "[ . 1 . 2]" 1
697 1 36 PHE H 1 36 PHE HB3 . . 3.170 2.545 2.368 2.949 . 0 0 "[ . 1 . 2]" 1
698 1 36 PHE H 1 36 PHE QD . . 4.380 4.156 4.083 4.223 . 0 0 "[ . 1 . 2]" 1
699 1 36 PHE H 1 37 TRP H . . 3.980 2.988 2.685 3.497 . 0 0 "[ . 1 . 2]" 1
700 1 36 PHE HA 1 36 PHE QD . . 3.660 2.954 2.571 3.335 . 0 0 "[ . 1 . 2]" 1
701 1 36 PHE HA 1 41 TYR QD . . 4.030 4.064 3.927 4.142 0.112 12 0 "[ . 1 . 2]" 1
702 1 36 PHE HA 1 41 TYR QE . . 4.580 4.598 4.244 4.686 0.106 17 0 "[ . 1 . 2]" 1
703 1 36 PHE HA 1 43 ILE MD . . 4.360 3.159 2.274 3.877 . 0 0 "[ . 1 . 2]" 1
704 1 36 PHE HB2 1 37 TRP H . . 3.890 3.916 3.693 3.977 0.087 13 0 "[ . 1 . 2]" 1
705 1 36 PHE HB3 1 37 TRP H . . 4.240 2.688 2.260 2.899 . 0 0 "[ . 1 . 2]" 1
706 1 36 PHE HB3 1 37 TRP HE3 . . 5.500 5.545 5.429 5.584 0.084 12 0 "[ . 1 . 2]" 1
707 1 36 PHE QD 1 37 TRP HA . . 4.550 3.890 2.995 4.604 0.054 13 0 "[ . 1 . 2]" 1
708 1 36 PHE QD 1 37 TRP HB2 . . 5.130 4.773 4.421 5.027 . 0 0 "[ . 1 . 2]" 1
709 1 36 PHE QD 1 37 TRP HB3 . . 5.140 4.998 4.567 5.233 0.093 13 0 "[ . 1 . 2]" 1
710 1 36 PHE QD 1 37 TRP HD1 . . 4.560 4.124 3.668 4.595 0.035 19 0 "[ . 1 . 2]" 1
711 1 36 PHE QD 1 37 TRP HE1 . . 5.210 3.571 2.986 4.399 . 0 0 "[ . 1 . 2]" 1
712 1 36 PHE QD 1 37 TRP HE3 . . 4.570 3.902 3.224 4.478 . 0 0 "[ . 1 . 2]" 1
713 1 36 PHE QD 1 37 TRP HZ3 . . 5.090 4.391 3.755 4.934 . 0 0 "[ . 1 . 2]" 1
714 1 36 PHE QD 1 43 ILE MD . . 4.120 2.250 1.972 2.577 . 0 0 "[ . 1 . 2]" 1
715 1 36 PHE QD 1 43 ILE HG13 . . 4.920 4.615 4.130 4.997 0.077 8 0 "[ . 1 . 2]" 1
716 1 36 PHE QD 1 43 ILE MG . . 4.840 4.165 3.629 4.482 . 0 0 "[ . 1 . 2]" 1
717 1 36 PHE QD 1 52 ILE MD . . 5.260 4.479 3.722 4.907 . 0 0 "[ . 1 . 2]" 1
718 1 36 PHE QE 1 37 TRP HE3 . . 5.300 4.504 3.744 5.066 . 0 0 "[ . 1 . 2]" 1
719 1 36 PHE QE 1 37 TRP HH2 . . 4.410 2.646 2.372 3.223 . 0 0 "[ . 1 . 2]" 1
720 1 36 PHE QE 1 37 TRP HZ2 . . 4.820 2.963 2.440 3.740 . 0 0 "[ . 1 . 2]" 1
721 1 36 PHE QE 1 43 ILE MD . . 4.470 2.615 2.136 3.133 . 0 0 "[ . 1 . 2]" 1
722 1 36 PHE QE 1 43 ILE MG . . 5.190 4.323 3.803 4.757 . 0 0 "[ . 1 . 2]" 1
723 1 36 PHE QE 1 52 ILE MD . . 3.880 3.632 3.054 4.003 0.123 14 0 "[ . 1 . 2]" 1
724 1 36 PHE QE 1 115 ALA MB . . 4.070 3.219 2.725 4.165 0.095 10 0 "[ . 1 . 2]" 1
725 1 36 PHE QE 1 118 PHE QD . . 4.640 4.613 4.228 4.767 0.127 6 0 "[ . 1 . 2]" 1
726 1 36 PHE QE 1 118 PHE QE . . 5.310 4.841 4.182 5.367 0.057 8 0 "[ . 1 . 2]" 1
727 1 36 PHE QE 1 119 LYS HA . . 4.920 3.622 2.371 4.772 . 0 0 "[ . 1 . 2]" 1
728 1 36 PHE QE 1 119 LYS HB2 . . 4.970 3.053 2.807 3.373 . 0 0 "[ . 1 . 2]" 1
729 1 36 PHE QE 1 119 LYS HB3 . . 4.530 4.336 4.057 4.590 0.060 15 0 "[ . 1 . 2]" 1
730 1 36 PHE QE 1 122 ILE MG . . 4.930 4.377 4.181 4.673 . 0 0 "[ . 1 . 2]" 1
731 1 36 PHE HZ 1 52 ILE MD . . 4.810 4.882 4.746 4.921 0.111 8 0 "[ . 1 . 2]" 1
732 1 36 PHE HZ 1 115 ALA MB . . 4.130 3.748 3.320 4.206 0.076 14 0 "[ . 1 . 2]" 1
733 1 36 PHE HZ 1 118 PHE QD . . 4.660 3.582 3.058 3.926 . 0 0 "[ . 1 . 2]" 1
734 1 36 PHE HZ 1 119 LYS HA . . 5.140 3.296 2.871 4.458 . 0 0 "[ . 1 . 2]" 1
735 1 36 PHE HZ 1 119 LYS HB2 . . 5.100 2.595 2.256 3.578 . 0 0 "[ . 1 . 2]" 1
736 1 36 PHE HZ 1 119 LYS HB3 . . 5.110 4.304 4.004 5.195 0.085 6 0 "[ . 1 . 2]" 1
737 1 36 PHE HZ 1 122 ILE HG13 . . 4.830 4.768 4.416 4.898 0.068 13 0 "[ . 1 . 2]" 1
738 1 36 PHE HZ 1 122 ILE MG . . 5.500 5.612 5.589 5.623 0.123 12 0 "[ . 1 . 2]" 1
739 1 37 TRP H 1 37 TRP HB2 . . 3.470 2.494 2.352 2.640 . 0 0 "[ . 1 . 2]" 1
740 1 37 TRP H 1 37 TRP HB3 . . 3.910 3.634 3.545 3.746 . 0 0 "[ . 1 . 2]" 1
741 1 37 TRP H 1 37 TRP HD1 . . 4.270 3.398 2.908 4.028 . 0 0 "[ . 1 . 2]" 1
742 1 37 TRP H 1 38 LYS H . . 3.270 3.123 2.860 3.353 0.083 16 0 "[ . 1 . 2]" 1
743 1 37 TRP HA 1 37 TRP HE3 . . 3.630 2.172 2.005 2.451 . 0 0 "[ . 1 . 2]" 1
744 1 37 TRP HA 1 37 TRP HZ3 . . 4.570 4.408 4.160 4.613 0.043 2 0 "[ . 1 . 2]" 1
745 1 37 TRP HA 1 128 ALA MB . . 5.420 3.763 3.342 4.437 . 0 0 "[ . 1 . 2]" 1
746 1 37 TRP HB2 1 37 TRP HD1 . . 3.580 2.568 2.512 2.643 . 0 0 "[ . 1 . 2]" 1
747 1 37 TRP HB3 1 37 TRP HE3 . . 4.030 3.065 2.905 3.391 . 0 0 "[ . 1 . 2]" 1
748 1 37 TRP HB3 1 128 ALA MB . . 4.810 2.700 2.070 3.553 . 0 0 "[ . 1 . 2]" 1
749 1 37 TRP HE3 1 122 ILE HB . . 4.610 4.594 4.408 4.697 0.087 2 0 "[ . 1 . 2]" 1
750 1 37 TRP HE3 1 122 ILE MG . . 4.970 4.343 4.018 4.709 . 0 0 "[ . 1 . 2]" 1
751 1 37 TRP HE3 1 128 ALA MB . . 4.530 2.597 2.224 3.401 . 0 0 "[ . 1 . 2]" 1
752 1 37 TRP HH2 1 119 LYS HA . . 3.450 3.415 2.951 3.534 0.084 16 0 "[ . 1 . 2]" 1
753 1 37 TRP HH2 1 122 ILE H . . 4.900 4.910 4.712 4.980 0.080 17 0 "[ . 1 . 2]" 1
754 1 37 TRP HH2 1 122 ILE HB . . 3.830 2.715 2.490 2.972 . 0 0 "[ . 1 . 2]" 1
755 1 37 TRP HH2 1 122 ILE MD . . 5.100 3.834 3.432 4.008 . 0 0 "[ . 1 . 2]" 1
756 1 37 TRP HH2 1 122 ILE HG12 . . 4.580 3.321 2.869 3.679 . 0 0 "[ . 1 . 2]" 1
757 1 37 TRP HH2 1 122 ILE HG13 . . 4.420 2.191 2.059 2.365 . 0 0 "[ . 1 . 2]" 1
758 1 37 TRP HH2 1 122 ILE MG . . 4.120 2.137 2.040 2.279 . 0 0 "[ . 1 . 2]" 1
759 1 37 TRP HH2 1 123 HIS H . . 5.050 5.119 5.090 5.133 0.083 18 0 "[ . 1 . 2]" 1
760 1 37 TRP HH2 1 128 ALA MB . . 5.320 4.113 3.581 4.802 . 0 0 "[ . 1 . 2]" 1
761 1 37 TRP HZ2 1 122 ILE MG . . 5.300 3.414 3.016 3.770 . 0 0 "[ . 1 . 2]" 1
762 1 37 TRP HZ2 1 128 ALA MB . . 5.500 4.474 3.755 5.322 . 0 0 "[ . 1 . 2]" 1
763 1 37 TRP HZ3 1 119 LYS HA . . 4.100 3.537 2.803 4.126 0.026 16 0 "[ . 1 . 2]" 1
764 1 37 TRP HZ3 1 122 ILE HB . . 4.520 2.323 2.146 2.579 . 0 0 "[ . 1 . 2]" 1
765 1 37 TRP HZ3 1 122 ILE HG12 . . 4.750 4.051 3.656 4.387 . 0 0 "[ . 1 . 2]" 1
766 1 37 TRP HZ3 1 122 ILE MG . . 4.580 2.974 2.557 3.489 . 0 0 "[ . 1 . 2]" 1
767 1 37 TRP HZ3 1 128 ALA MB . . 5.470 3.212 2.676 4.174 . 0 0 "[ . 1 . 2]" 1
768 1 38 LYS H 1 38 LYS HB2 . . 3.110 2.030 1.879 2.206 . 0 0 "[ . 1 . 2]" 1
769 1 38 LYS H 1 38 LYS HB3 . . 3.120 3.201 3.189 3.213 0.093 7 0 "[ . 1 . 2]" 1
770 1 38 LYS H 1 38 LYS QD . . 4.820 3.607 2.780 4.570 . 0 0 "[ . 1 . 2]" 1
771 1 38 LYS H 1 38 LYS QG . . 4.390 3.534 3.048 3.940 . 0 0 "[ . 1 . 2]" 1
772 1 38 LYS H 1 39 GLU H . . 4.370 4.439 4.406 4.457 0.087 18 0 "[ . 1 . 2]" 1
773 1 38 LYS H 1 41 TYR H . . 4.650 4.407 3.909 4.717 0.067 12 0 "[ . 1 . 2]" 1
774 1 38 LYS H 1 41 TYR HB2 . . 4.900 3.911 3.598 4.542 . 0 0 "[ . 1 . 2]" 1
775 1 38 LYS H 1 41 TYR HB3 . . 4.500 3.513 3.191 3.902 . 0 0 "[ . 1 . 2]" 1
776 1 38 LYS HA 1 38 LYS QD . . 4.100 3.175 2.150 3.934 . 0 0 "[ . 1 . 2]" 1
777 1 38 LYS HA 1 38 LYS QE . . 4.350 3.474 1.844 4.453 0.103 13 0 "[ . 1 . 2]" 1
778 1 38 LYS HA 1 38 LYS QG . . 3.650 2.425 2.058 2.783 . 0 0 "[ . 1 . 2]" 1
779 1 38 LYS HA 1 39 GLU H . . 2.810 2.394 2.084 2.853 0.043 4 0 "[ . 1 . 2]" 1
780 1 38 LYS HA 1 39 GLU HA . . 4.620 4.346 4.147 4.571 . 0 0 "[ . 1 . 2]" 1
781 1 38 LYS HB2 1 38 LYS QD . . 2.810 2.607 2.473 2.758 . 0 0 "[ . 1 . 2]" 1
782 1 38 LYS HB2 1 39 GLU H . . 4.170 3.846 3.596 4.236 0.066 12 0 "[ . 1 . 2]" 1
783 1 38 LYS HB2 1 41 TYR H . . 4.010 3.541 3.121 3.889 . 0 0 "[ . 1 . 2]" 1
784 1 38 LYS HB2 1 41 TYR HB2 . . 3.780 2.238 2.050 2.680 . 0 0 "[ . 1 . 2]" 1
785 1 38 LYS HB2 1 41 TYR HB3 . . 3.870 2.715 2.133 3.064 . 0 0 "[ . 1 . 2]" 1
786 1 38 LYS HB2 1 41 TYR QD . . 5.020 3.260 2.643 3.670 . 0 0 "[ . 1 . 2]" 1
787 1 38 LYS HB2 1 41 TYR QE . . 5.120 5.122 4.792 5.219 0.099 12 0 "[ . 1 . 2]" 1
788 1 38 LYS HB3 1 39 GLU H . . 4.490 2.523 2.110 3.168 . 0 0 "[ . 1 . 2]" 1
789 1 38 LYS HB3 1 41 TYR HB2 . . 4.000 2.335 2.132 2.610 . 0 0 "[ . 1 . 2]" 1
790 1 38 LYS HB3 1 41 TYR QD . . 4.690 3.814 3.463 4.083 . 0 0 "[ . 1 . 2]" 1
791 1 38 LYS QD 1 41 TYR HB2 . . 4.440 3.440 2.270 4.448 0.008 19 0 "[ . 1 . 2]" 1
792 1 38 LYS QD 1 41 TYR QD . . 4.330 3.065 2.101 4.214 . 0 0 "[ . 1 . 2]" 1
793 1 38 LYS QD 1 41 TYR QE . . 4.970 4.507 3.788 5.078 0.108 1 0 "[ . 1 . 2]" 1
794 1 38 LYS QE 1 38 LYS QG . . 3.260 2.132 1.951 2.304 . 0 0 "[ . 1 . 2]" 1
795 1 38 LYS QE 1 41 TYR QD . . 5.250 4.495 2.827 5.356 0.106 4 0 "[ . 1 . 2]" 1
796 1 38 LYS QG 1 39 GLU H . . 4.290 2.875 2.406 3.117 . 0 0 "[ . 1 . 2]" 1
797 1 38 LYS QG 1 41 TYR H . . 5.500 4.667 4.035 4.921 . 0 0 "[ . 1 . 2]" 1
798 1 38 LYS QG 1 41 TYR HB2 . . 4.880 3.293 2.304 4.130 . 0 0 "[ . 1 . 2]" 1
799 1 38 LYS QG 1 41 TYR HB3 . . 4.670 4.377 3.536 4.671 0.001 14 0 "[ . 1 . 2]" 1
800 1 38 LYS QG 1 41 TYR QD . . 4.890 3.231 2.338 4.600 . 0 0 "[ . 1 . 2]" 1
801 1 39 GLU H 1 39 GLU QB . . 2.890 2.467 1.956 2.847 . 0 0 "[ . 1 . 2]" 1
802 1 39 GLU H 1 39 GLU HG2 . . 4.150 2.700 1.848 4.223 0.073 6 0 "[ . 1 . 2]" 1
803 1 39 GLU H 1 39 GLU HG3 . . 4.060 3.535 2.335 4.242 0.182 14 0 "[ . 1 . 2]" 1
804 1 39 GLU H 1 40 GLY H . . 4.670 3.347 2.453 4.345 . 0 0 "[ . 1 . 2]" 1
805 1 39 GLU HA 1 39 GLU HG2 . . 3.960 3.648 2.442 4.006 0.046 18 0 "[ . 1 . 2]" 1
806 1 39 GLU HA 1 39 GLU HG3 . . 3.960 3.574 2.543 4.060 0.100 15 0 "[ . 1 . 2]" 1
807 1 39 GLU HA 1 40 GLY H . . 2.820 2.652 2.207 2.897 0.077 8 0 "[ . 1 . 2]" 1
808 1 39 GLU HA 1 41 TYR H . . 4.360 4.421 4.227 4.455 0.095 5 0 "[ . 1 . 2]" 1
809 1 39 GLU QB 1 39 GLU HG2 . . 2.800 2.398 2.157 2.569 . 0 0 "[ . 1 . 2]" 1
810 1 39 GLU QB 1 40 GLY H . . 4.160 4.028 3.951 4.098 . 0 0 "[ . 1 . 2]" 1
811 1 39 GLU HG2 1 40 GLY H . . 4.160 4.264 3.870 4.863 0.703 2 4 "[ + . -1 * . * 2]" 1
812 1 40 GLY H 1 41 TYR H . . 3.310 2.110 1.674 3.172 . 0 0 "[ . 1 . 2]" 1
813 1 41 TYR H 1 41 TYR HB2 . . 3.080 2.536 2.322 2.922 . 0 0 "[ . 1 . 2]" 1
814 1 41 TYR H 1 41 TYR HB3 . . 3.050 2.408 2.282 2.604 . 0 0 "[ . 1 . 2]" 1
815 1 41 TYR H 1 41 TYR QD . . 4.100 4.180 4.143 4.194 0.094 17 0 "[ . 1 . 2]" 1
816 1 41 TYR H 1 42 GLU H . . 4.590 4.627 4.541 4.674 0.084 15 0 "[ . 1 . 2]" 1
817 1 41 TYR HA 1 41 TYR QD . . 3.590 3.247 3.047 3.379 . 0 0 "[ . 1 . 2]" 1
818 1 41 TYR HA 1 42 GLU H . . 2.770 2.297 2.143 2.551 . 0 0 "[ . 1 . 2]" 1
819 1 41 TYR QD 1 42 GLU H . . 4.430 3.181 2.807 3.475 . 0 0 "[ . 1 . 2]" 1
820 1 41 TYR QD 1 42 GLU HA . . 3.170 3.267 3.217 3.285 0.115 3 0 "[ . 1 . 2]" 1
821 1 41 TYR QD 1 42 GLU QB . . 5.050 4.449 4.286 4.614 . 0 0 "[ . 1 . 2]" 1
822 1 41 TYR QD 1 43 ILE H . . 4.570 3.874 3.662 4.196 . 0 0 "[ . 1 . 2]" 1
823 1 41 TYR QD 1 43 ILE HA . . 4.380 3.810 3.505 4.247 . 0 0 "[ . 1 . 2]" 1
824 1 41 TYR QD 1 43 ILE HB . . 4.600 4.653 4.524 4.703 0.103 6 0 "[ . 1 . 2]" 1
825 1 41 TYR QD 1 43 ILE MD . . 4.140 3.508 3.236 3.759 . 0 0 "[ . 1 . 2]" 1
826 1 41 TYR QD 1 43 ILE HG12 . . 4.000 2.858 2.443 3.493 . 0 0 "[ . 1 . 2]" 1
827 1 41 TYR QD 1 43 ILE HG13 . . 3.600 2.374 2.119 2.589 . 0 0 "[ . 1 . 2]" 1
828 1 41 TYR QD 1 43 ILE MG . . 4.870 4.616 4.274 4.945 0.075 5 0 "[ . 1 . 2]" 1
829 1 41 TYR QE 1 42 GLU H . . 4.950 4.388 3.829 4.718 . 0 0 "[ . 1 . 2]" 1
830 1 41 TYR QE 1 42 GLU HA . . 4.860 4.814 4.504 4.959 0.099 6 0 "[ . 1 . 2]" 1
831 1 41 TYR QE 1 43 ILE H . . 4.520 4.473 4.058 4.618 0.098 1 0 "[ . 1 . 2]" 1
832 1 41 TYR QE 1 43 ILE HA . . 3.390 2.586 2.205 3.078 . 0 0 "[ . 1 . 2]" 1
833 1 41 TYR QE 1 43 ILE MD . . 4.410 3.835 3.477 4.086 . 0 0 "[ . 1 . 2]" 1
834 1 41 TYR QE 1 43 ILE HG12 . . 3.650 2.261 2.030 2.775 . 0 0 "[ . 1 . 2]" 1
835 1 41 TYR QE 1 43 ILE HG13 . . 3.520 3.177 2.625 3.584 0.064 12 0 "[ . 1 . 2]" 1
836 1 41 TYR QE 1 43 ILE MG . . 4.260 3.534 2.973 4.063 . 0 0 "[ . 1 . 2]" 1
837 1 42 GLU H 1 42 GLU QB . . 3.350 2.388 2.222 2.721 . 0 0 "[ . 1 . 2]" 1
838 1 42 GLU H 1 42 GLU HG2 . . 4.420 4.161 1.870 4.509 0.089 9 0 "[ . 1 . 2]" 1
839 1 42 GLU H 1 42 GLU HG3 . . 4.190 3.958 3.201 4.504 0.314 6 0 "[ . 1 . 2]" 1
840 1 42 GLU HA 1 42 GLU HG2 . . 3.740 3.259 2.328 3.830 0.090 10 0 "[ . 1 . 2]" 1
841 1 42 GLU HA 1 42 GLU HG3 . . 3.560 2.615 2.173 3.756 0.196 2 0 "[ . 1 . 2]" 1
842 1 42 GLU HA 1 43 ILE H . . 2.580 2.115 1.999 2.250 . 0 0 "[ . 1 . 2]" 1
843 1 42 GLU HA 1 43 ILE HB . . 4.690 4.205 3.840 4.510 . 0 0 "[ . 1 . 2]" 1
844 1 42 GLU HA 1 43 ILE HG13 . . 4.940 3.218 2.762 3.635 . 0 0 "[ . 1 . 2]" 1
845 1 42 GLU HA 1 43 ILE MG . . 5.370 5.226 4.990 5.371 0.001 20 0 "[ . 1 . 2]" 1
846 1 42 GLU QB 1 43 ILE H . . 4.050 3.104 2.373 3.662 . 0 0 "[ . 1 . 2]" 1
847 1 42 GLU QB 1 44 LYS QE . . 4.460 2.901 2.041 3.935 . 0 0 "[ . 1 . 2]" 1
848 1 42 GLU QB 1 44 LYS QG . . 4.140 3.483 2.525 4.097 . 0 0 "[ . 1 . 2]" 1
849 1 42 GLU HG2 1 43 ILE H . . 4.420 3.709 2.394 4.506 0.086 14 0 "[ . 1 . 2]" 1
850 1 42 GLU HG2 1 44 LYS QG . . 4.910 3.807 2.066 5.575 0.665 2 1 "[ + . 1 . 2]" 1
851 1 42 GLU HG3 1 43 ILE H . . 4.260 3.342 2.246 4.344 0.084 18 0 "[ . 1 . 2]" 1
852 1 42 GLU HG3 1 44 LYS QE . . 4.460 3.863 2.030 4.552 0.092 18 0 "[ . 1 . 2]" 1
853 1 43 ILE H 1 43 ILE HB . . 2.940 2.438 2.200 2.720 . 0 0 "[ . 1 . 2]" 1
854 1 43 ILE H 1 43 ILE MD . . 4.490 3.838 3.504 4.198 . 0 0 "[ . 1 . 2]" 1
855 1 43 ILE H 1 43 ILE HG12 . . 3.960 3.843 3.577 4.019 0.059 5 0 "[ . 1 . 2]" 1
856 1 43 ILE H 1 43 ILE HG13 . . 3.290 2.701 2.386 2.906 . 0 0 "[ . 1 . 2]" 1
857 1 43 ILE H 1 43 ILE MG . . 4.290 3.754 3.628 3.890 . 0 0 "[ . 1 . 2]" 1
858 1 43 ILE H 1 44 LYS H . . 4.570 4.198 4.012 4.415 . 0 0 "[ . 1 . 2]" 1
859 1 43 ILE H 1 44 LYS HA . . 4.810 4.865 4.675 4.894 0.084 7 0 "[ . 1 . 2]" 1
860 1 43 ILE H 1 116 THR MG . . 4.190 3.680 2.752 4.073 . 0 0 "[ . 1 . 2]" 1
861 1 43 ILE HA 1 43 ILE MD . . 4.400 3.906 3.706 4.022 . 0 0 "[ . 1 . 2]" 1
862 1 43 ILE HA 1 43 ILE HG12 . . 3.880 2.641 2.375 2.886 . 0 0 "[ . 1 . 2]" 1
863 1 43 ILE HA 1 43 ILE HG13 . . 4.200 3.099 2.854 3.291 . 0 0 "[ . 1 . 2]" 1
864 1 43 ILE HA 1 43 ILE MG . . 3.460 2.432 2.281 2.604 . 0 0 "[ . 1 . 2]" 1
865 1 43 ILE HA 1 44 LYS H . . 2.780 2.228 2.101 2.295 . 0 0 "[ . 1 . 2]" 1
866 1 43 ILE HA 1 44 LYS HA . . 4.640 4.452 4.397 4.504 . 0 0 "[ . 1 . 2]" 1
867 1 43 ILE HA 1 45 ASN H . . 4.150 3.597 3.232 3.961 . 0 0 "[ . 1 . 2]" 1
868 1 43 ILE HB 1 44 LYS H . . 4.590 4.415 4.240 4.549 . 0 0 "[ . 1 . 2]" 1
869 1 43 ILE HB 1 112 LEU QD . . 3.930 3.185 2.536 3.627 . 0 0 "[ . 1 . 2]" 1
870 1 43 ILE HB 1 116 THR MG . . 3.310 3.232 2.563 3.417 0.107 5 0 "[ . 1 . 2]" 1
871 1 43 ILE MD 1 43 ILE MG . . 3.920 2.126 2.033 2.227 . 0 0 "[ . 1 . 2]" 1
872 1 43 ILE MD 1 116 THR MG . . 4.610 3.399 2.385 4.379 . 0 0 "[ . 1 . 2]" 1
873 1 43 ILE MG 1 44 LYS H . . 4.030 3.136 2.797 3.448 . 0 0 "[ . 1 . 2]" 1
874 1 43 ILE MG 1 44 LYS HA . . 3.740 3.745 3.492 3.846 0.106 13 0 "[ . 1 . 2]" 1
875 1 43 ILE MG 1 45 ASN H . . 3.960 3.299 2.859 3.674 . 0 0 "[ . 1 . 2]" 1
876 1 43 ILE MG 1 45 ASN QB . . 4.780 3.736 2.956 4.228 . 0 0 "[ . 1 . 2]" 1
877 1 43 ILE MG 1 116 THR MG . . 4.290 4.180 3.614 4.407 0.117 20 0 "[ . 1 . 2]" 1
878 1 44 LYS H 1 44 LYS HB2 . . 3.540 2.713 2.511 2.836 . 0 0 "[ . 1 . 2]" 1
879 1 44 LYS H 1 44 LYS HB3 . . 3.790 3.815 3.632 3.868 0.078 2 0 "[ . 1 . 2]" 1
880 1 44 LYS H 1 44 LYS QG . . 3.750 3.275 2.668 3.830 0.080 16 0 "[ . 1 . 2]" 1
881 1 44 LYS H 1 45 ASN H . . 3.190 1.928 1.780 2.194 . 0 0 "[ . 1 . 2]" 1
882 1 44 LYS H 1 112 LEU QD . . 5.180 3.963 3.476 4.450 . 0 0 "[ . 1 . 2]" 1
883 1 44 LYS HA 1 44 LYS HB3 . . 2.950 2.523 2.420 2.603 . 0 0 "[ . 1 . 2]" 1
884 1 44 LYS HA 1 44 LYS QD . . 3.850 3.356 2.090 3.945 0.095 3 0 "[ . 1 . 2]" 1
885 1 44 LYS HA 1 44 LYS QG . . 3.190 2.532 2.162 3.138 . 0 0 "[ . 1 . 2]" 1
886 1 44 LYS HA 1 112 LEU QD . . 3.560 2.722 2.263 3.220 . 0 0 "[ . 1 . 2]" 1
887 1 44 LYS HB2 1 44 LYS QE . . 4.800 3.074 2.046 4.344 . 0 0 "[ . 1 . 2]" 1
888 1 44 LYS HB2 1 45 ASN H . . 4.450 3.471 2.801 3.926 . 0 0 "[ . 1 . 2]" 1
889 1 44 LYS HB3 1 44 LYS QE . . 3.470 3.352 2.944 4.070 0.600 14 1 "[ . 1 +. 2]" 1
890 1 44 LYS HB3 1 45 ASN H . . 4.470 4.177 3.927 4.364 . 0 0 "[ . 1 . 2]" 1
891 1 44 LYS HB3 1 112 LEU QD . . 5.400 4.368 3.859 4.958 . 0 0 "[ . 1 . 2]" 1
892 1 45 ASN H 1 45 ASN QB . . 3.320 2.203 2.109 2.358 . 0 0 "[ . 1 . 2]" 1
893 1 45 ASN H 1 45 ASN HD21 . . 4.850 4.468 3.599 4.965 0.115 13 0 "[ . 1 . 2]" 1
894 1 45 ASN H 1 46 ARG H . . 4.810 4.470 4.162 4.666 . 0 0 "[ . 1 . 2]" 1
895 1 45 ASN HA 1 46 ARG H . . 2.670 2.260 2.169 2.347 . 0 0 "[ . 1 . 2]" 1
896 1 45 ASN HA 1 46 ARG HA . . 4.690 4.488 4.374 4.571 . 0 0 "[ . 1 . 2]" 1
897 1 45 ASN HA 1 47 GLU H . . 3.390 3.424 3.148 3.480 0.090 16 0 "[ . 1 . 2]" 1
898 1 45 ASN QB 1 45 ASN HD22 . . 3.820 3.285 3.227 3.416 . 0 0 "[ . 1 . 2]" 1
899 1 45 ASN QB 1 46 ARG H . . 3.950 3.815 3.589 4.027 0.077 8 0 "[ . 1 . 2]" 1
900 1 45 ASN QB 1 47 GLU H . . 4.090 3.131 2.631 3.797 . 0 0 "[ . 1 . 2]" 1
901 1 45 ASN QB 1 48 THR H . . 3.530 2.585 2.061 2.950 . 0 0 "[ . 1 . 2]" 1
902 1 45 ASN QB 1 48 THR HA . . 4.500 4.539 4.095 4.611 0.111 16 0 "[ . 1 . 2]" 1
903 1 45 ASN QB 1 48 THR MG . . 4.110 1.981 1.891 2.119 . 0 0 "[ . 1 . 2]" 1
904 1 45 ASN HD22 1 47 GLU QB . . 4.590 3.793 2.324 5.492 0.902 17 1 "[ . 1 . + 2]" 1
905 1 45 ASN HD22 1 48 THR MG . . 4.630 4.397 3.378 5.189 0.559 17 1 "[ . 1 . + 2]" 1
906 1 46 ARG H 1 46 ARG HB2 . . 3.360 2.790 2.184 3.448 0.088 13 0 "[ . 1 . 2]" 1
907 1 46 ARG H 1 46 ARG HB3 . . 3.320 2.220 2.073 2.710 . 0 0 "[ . 1 . 2]" 1
908 1 46 ARG H 1 46 ARG HG2 . . 4.070 3.798 2.353 4.488 0.418 18 0 "[ . 1 . 2]" 1
909 1 46 ARG H 1 47 GLU H . . 3.960 2.676 2.376 2.942 . 0 0 "[ . 1 . 2]" 1
910 1 46 ARG H 1 48 THR H . . 4.810 4.418 4.239 4.541 . 0 0 "[ . 1 . 2]" 1
911 1 46 ARG H 1 112 LEU QD . . 4.930 3.581 3.028 4.039 . 0 0 "[ . 1 . 2]" 1
912 1 46 ARG HA 1 46 ARG HG2 . . 3.890 3.421 2.898 3.872 . 0 0 "[ . 1 . 2]" 1
913 1 46 ARG HA 1 46 ARG HG3 . . 3.750 3.033 2.426 3.928 0.178 12 0 "[ . 1 . 2]" 1
914 1 46 ARG HA 1 48 THR H . . 4.340 3.922 3.656 4.255 . 0 0 "[ . 1 . 2]" 1
915 1 46 ARG HA 1 49 GLY H . . 3.820 3.347 2.969 3.617 . 0 0 "[ . 1 . 2]" 1
916 1 46 ARG HA 1 49 GLY HA2 . . 5.500 5.270 4.721 5.582 0.082 16 0 "[ . 1 . 2]" 1
917 1 46 ARG HA 1 50 CYS H . . 4.920 4.402 4.023 4.836 . 0 0 "[ . 1 . 2]" 1
918 1 46 ARG HA 1 109 ILE MD . . 4.010 3.507 2.897 4.112 0.102 2 0 "[ . 1 . 2]" 1
919 1 46 ARG HA 1 112 LEU QD . . 3.430 2.073 1.843 2.283 . 0 0 "[ . 1 . 2]" 1
920 1 46 ARG HB2 1 46 ARG HD2 . . 4.150 3.112 2.464 3.993 . 0 0 "[ . 1 . 2]" 1
921 1 46 ARG HB2 1 46 ARG HD3 . . 4.040 3.219 2.397 4.058 0.018 12 0 "[ . 1 . 2]" 1
922 1 46 ARG HB2 1 47 GLU H . . 4.710 4.182 3.857 4.326 . 0 0 "[ . 1 . 2]" 1
923 1 46 ARG HB2 1 109 ILE MD . . 4.320 2.619 2.108 3.373 . 0 0 "[ . 1 . 2]" 1
924 1 46 ARG HB3 1 46 ARG HD2 . . 4.060 3.052 2.117 3.922 . 0 0 "[ . 1 . 2]" 1
925 1 46 ARG HB3 1 46 ARG HD3 . . 4.080 3.025 2.366 3.727 . 0 0 "[ . 1 . 2]" 1
926 1 46 ARG HB3 1 47 GLU H . . 4.160 3.259 2.753 4.068 . 0 0 "[ . 1 . 2]" 1
927 1 46 ARG HB3 1 109 ILE MD . . 4.780 3.471 2.116 4.438 . 0 0 "[ . 1 . 2]" 1
928 1 46 ARG HD2 1 46 ARG QH1 . . 3.990 2.863 1.892 3.698 . 0 0 "[ . 1 . 2]" 1
929 1 46 ARG HD2 1 46 ARG QH2 . . 3.900 4.109 3.836 4.244 0.344 8 0 "[ . 1 . 2]" 1
930 1 46 ARG HD2 1 109 ILE MD . . 4.680 2.998 2.090 4.281 . 0 0 "[ . 1 . 2]" 1
931 1 46 ARG HD3 1 46 ARG QH1 . . 4.280 2.649 1.826 3.799 . 0 0 "[ . 1 . 2]" 1
932 1 46 ARG HD3 1 46 ARG QH2 . . 4.180 4.089 3.905 4.245 0.065 18 0 "[ . 1 . 2]" 1
933 1 46 ARG HD3 1 109 ILE MD . . 3.740 3.413 2.121 4.616 0.876 10 1 "[ . + . 2]" 1
934 1 46 ARG HE 1 108 CYS HB2 . . 5.140 3.918 2.701 5.212 0.072 19 0 "[ . 1 . 2]" 1
935 1 46 ARG HE 1 109 ILE MD . . 4.610 3.146 1.761 4.013 . 0 0 "[ . 1 . 2]" 1
936 1 46 ARG HE 1 109 ILE HG12 . . 4.810 3.410 2.632 4.857 0.047 2 0 "[ . 1 . 2]" 1
937 1 46 ARG HE 1 109 ILE HG13 . . 4.350 3.716 2.309 4.435 0.085 15 0 "[ . 1 . 2]" 1
938 1 46 ARG HG2 1 46 ARG QH2 . . 5.310 4.602 3.989 5.465 0.155 10 0 "[ . 1 . 2]" 1
939 1 46 ARG HG2 1 108 CYS HB2 . . 4.470 3.441 2.413 4.547 0.077 14 0 "[ . 1 . 2]" 1
940 1 46 ARG HG2 1 108 CYS HB3 . . 4.430 3.344 2.554 4.442 0.012 14 0 "[ . 1 . 2]" 1
941 1 46 ARG HG3 1 46 ARG QH2 . . 4.840 4.650 4.000 5.432 0.592 19 4 "[ - 1 ** +2]" 1
942 1 46 ARG HG3 1 47 GLU H . . 4.790 4.430 2.935 5.091 0.301 18 0 "[ . 1 . 2]" 1
943 1 46 ARG HG3 1 47 GLU HA . . 5.120 4.693 3.399 5.958 0.838 18 1 "[ . 1 . + 2]" 1
944 1 46 ARG HG3 1 108 CYS HB2 . . 4.450 2.574 2.179 3.385 . 0 0 "[ . 1 . 2]" 1
945 1 46 ARG HG3 1 108 CYS HB3 . . 4.530 2.889 2.236 3.842 . 0 0 "[ . 1 . 2]" 1
946 1 46 ARG HG3 1 109 ILE MD . . 4.920 3.224 2.119 4.516 . 0 0 "[ . 1 . 2]" 1
947 1 47 GLU H 1 47 GLU QB . . 3.590 2.532 2.429 2.738 . 0 0 "[ . 1 . 2]" 1
948 1 47 GLU H 1 47 GLU HG2 . . 4.040 3.101 1.973 3.892 . 0 0 "[ . 1 . 2]" 1
949 1 47 GLU H 1 47 GLU HG3 . . 3.820 2.697 2.022 3.604 . 0 0 "[ . 1 . 2]" 1
950 1 47 GLU H 1 48 THR H . . 3.390 2.810 2.650 2.970 . 0 0 "[ . 1 . 2]" 1
951 1 47 GLU HA 1 47 GLU HG2 . . 3.460 2.888 2.330 3.633 0.173 3 0 "[ . 1 . 2]" 1
952 1 47 GLU HA 1 47 GLU HG3 . . 3.790 3.193 2.333 3.851 0.061 7 0 "[ . 1 . 2]" 1
953 1 47 GLU HA 1 49 GLY H . . 4.510 4.510 4.317 4.587 0.077 10 0 "[ . 1 . 2]" 1
954 1 47 GLU HA 1 50 CYS H . . 3.580 3.356 3.112 3.636 0.056 19 0 "[ . 1 . 2]" 1
955 1 47 GLU HA 1 50 CYS HB2 . . 3.480 2.954 2.596 3.282 . 0 0 "[ . 1 . 2]" 1
956 1 47 GLU HA 1 50 CYS HB3 . . 4.020 3.956 3.572 4.093 0.073 16 0 "[ . 1 . 2]" 1
957 1 47 GLU HA 1 51 ALA H . . 4.340 4.022 3.830 4.374 0.034 16 0 "[ . 1 . 2]" 1
958 1 47 GLU QB 1 48 THR H . . 3.980 3.033 2.719 3.358 . 0 0 "[ . 1 . 2]" 1
959 1 47 GLU QB 1 48 THR MG . . 5.450 3.377 2.849 3.715 . 0 0 "[ . 1 . 2]" 1
960 1 47 GLU HG2 1 48 THR H . . 4.940 5.077 4.303 5.540 0.600 3 2 "[ + . -1 . 2]" 1
961 1 48 THR H 1 48 THR HA . . 2.840 2.888 2.848 2.906 0.066 11 0 "[ . 1 . 2]" 1
962 1 48 THR H 1 48 THR HB . . 3.640 3.635 3.580 3.703 0.063 1 0 "[ . 1 . 2]" 1
963 1 48 THR H 1 48 THR MG . . 3.660 2.204 1.753 2.538 . 0 0 "[ . 1 . 2]" 1
964 1 48 THR H 1 49 GLY H . . 3.020 2.435 2.316 2.522 . 0 0 "[ . 1 . 2]" 1
965 1 48 THR H 1 49 GLY HA3 . . 4.570 4.614 4.496 4.643 0.073 18 0 "[ . 1 . 2]" 1
966 1 48 THR HA 1 48 THR MG . . 3.200 2.554 2.426 2.871 . 0 0 "[ . 1 . 2]" 1
967 1 48 THR HA 1 49 GLY H . . 3.580 3.549 3.475 3.587 0.007 7 0 "[ . 1 . 2]" 1
968 1 48 THR HA 1 52 ILE MD . . 4.300 4.344 4.002 4.397 0.097 4 0 "[ . 1 . 2]" 1
969 1 48 THR HB 1 49 GLY H . . 4.060 3.838 3.604 4.142 0.082 19 0 "[ . 1 . 2]" 1
970 1 48 THR MG 1 49 GLY H . . 4.530 3.753 3.150 3.942 . 0 0 "[ . 1 . 2]" 1
971 1 49 GLY H 1 50 CYS H . . 3.350 2.942 2.819 3.039 . 0 0 "[ . 1 . 2]" 1
972 1 49 GLY H 1 51 ALA H . . 4.640 4.176 3.962 4.343 . 0 0 "[ . 1 . 2]" 1
973 1 49 GLY H 1 108 CYS HB3 . . 4.760 4.611 4.137 4.815 0.055 1 0 "[ . 1 . 2]" 1
974 1 49 GLY H 1 112 LEU HB2 . . 4.700 3.143 2.291 4.413 . 0 0 "[ . 1 . 2]" 1
975 1 49 GLY H 1 112 LEU QD . . 4.040 2.932 1.882 3.546 . 0 0 "[ . 1 . 2]" 1
976 1 49 GLY HA2 1 52 ILE H . . 4.450 3.780 3.596 4.070 . 0 0 "[ . 1 . 2]" 1
977 1 49 GLY HA2 1 52 ILE HB . . 3.710 2.889 2.559 3.148 . 0 0 "[ . 1 . 2]" 1
978 1 49 GLY HA2 1 52 ILE MD . . 3.830 2.637 2.249 3.148 . 0 0 "[ . 1 . 2]" 1
979 1 49 GLY HA2 1 52 ILE MG . . 4.850 4.044 3.752 4.314 . 0 0 "[ . 1 . 2]" 1
980 1 49 GLY HA2 1 111 THR HB . . 4.290 3.751 3.295 4.297 0.007 16 0 "[ . 1 . 2]" 1
981 1 49 GLY HA2 1 111 THR MG . . 4.250 3.440 2.733 3.920 . 0 0 "[ . 1 . 2]" 1
982 1 49 GLY HA2 1 112 LEU H . . 4.360 3.240 2.902 3.575 . 0 0 "[ . 1 . 2]" 1
983 1 49 GLY HA2 1 112 LEU HB2 . . 4.760 2.971 2.363 3.793 . 0 0 "[ . 1 . 2]" 1
984 1 49 GLY HA2 1 112 LEU HB3 . . 4.830 4.017 3.292 4.894 0.064 6 0 "[ . 1 . 2]" 1
985 1 49 GLY HA2 1 112 LEU QD . . 4.620 3.639 3.192 3.885 . 0 0 "[ . 1 . 2]" 1
986 1 49 GLY HA2 1 112 LEU HG . . 5.050 4.329 2.282 5.140 0.090 19 0 "[ . 1 . 2]" 1
987 1 49 GLY HA3 1 52 ILE HB . . 4.750 4.437 4.144 4.618 . 0 0 "[ . 1 . 2]" 1
988 1 49 GLY HA3 1 108 CYS HB3 . . 4.750 3.651 3.191 4.044 . 0 0 "[ . 1 . 2]" 1
989 1 49 GLY HA3 1 111 THR MG . . 4.970 4.420 3.848 4.751 . 0 0 "[ . 1 . 2]" 1
990 1 49 GLY HA3 1 112 LEU H . . 4.650 2.835 2.365 3.313 . 0 0 "[ . 1 . 2]" 1
991 1 49 GLY HA3 1 112 LEU HA . . 4.500 3.164 2.713 3.568 . 0 0 "[ . 1 . 2]" 1
992 1 49 GLY HA3 1 112 LEU HB2 . . 4.910 2.228 1.937 2.897 . 0 0 "[ . 1 . 2]" 1
993 1 49 GLY HA3 1 112 LEU HB3 . . 4.210 3.168 2.399 4.284 0.074 17 0 "[ . 1 . 2]" 1
994 1 49 GLY HA3 1 112 LEU QD . . 4.450 3.147 2.159 3.631 . 0 0 "[ . 1 . 2]" 1
995 1 49 GLY HA3 1 112 LEU HG . . 4.610 3.903 2.320 4.705 0.095 18 0 "[ . 1 . 2]" 1
996 1 50 CYS H 1 50 CYS HB2 . . 3.740 2.180 2.069 2.250 . 0 0 "[ . 1 . 2]" 1
997 1 50 CYS H 1 50 CYS HB3 . . 4.060 3.361 3.246 3.447 . 0 0 "[ . 1 . 2]" 1
998 1 50 CYS H 1 51 ALA H . . 3.490 2.730 2.533 2.845 . 0 0 "[ . 1 . 2]" 1
999 1 50 CYS H 1 108 CYS HB2 . . 4.330 4.335 3.836 4.397 0.067 6 0 "[ . 1 . 2]" 1
1000 1 50 CYS H 1 108 CYS HB3 . . 3.700 2.615 2.264 2.709 . 0 0 "[ . 1 . 2]" 1
1001 1 50 CYS HA 1 53 MET H . . 4.840 3.181 3.032 3.391 . 0 0 "[ . 1 . 2]" 1
1002 1 50 CYS HA 1 53 MET HB2 . . 3.650 3.137 2.768 3.871 0.221 16 0 "[ . 1 . 2]" 1
1003 1 50 CYS HA 1 53 MET HB3 . . 4.000 2.572 2.191 2.854 . 0 0 "[ . 1 . 2]" 1
1004 1 50 CYS HA 1 53 MET ME . . 3.410 2.758 2.213 3.280 . 0 0 "[ . 1 . 2]" 1
1005 1 50 CYS HA 1 53 MET HG3 . . 5.090 4.879 4.233 5.651 0.561 13 1 "[ . 1 + . 2]" 1
1006 1 50 CYS HB2 1 51 ALA H . . 3.520 3.464 3.284 3.578 0.058 11 0 "[ . 1 . 2]" 1
1007 1 50 CYS HB3 1 51 ALA H . . 3.770 3.313 3.097 3.557 . 0 0 "[ . 1 . 2]" 1
1008 1 50 CYS HB3 1 53 MET ME . . 4.570 4.074 3.636 4.576 0.006 5 0 "[ . 1 . 2]" 1
1009 1 51 ALA H 1 51 ALA MB . . 3.060 2.263 2.223 2.338 . 0 0 "[ . 1 . 2]" 1
1010 1 51 ALA H 1 52 ILE H . . 3.790 2.761 2.717 2.841 . 0 0 "[ . 1 . 2]" 1
1011 1 51 ALA HA 1 54 CYS H . . 4.010 3.483 3.321 3.607 . 0 0 "[ . 1 . 2]" 1
1012 1 51 ALA HA 1 54 CYS HB3 . . 3.480 2.770 2.482 3.012 . 0 0 "[ . 1 . 2]" 1
1013 1 51 ALA HA 1 55 LEU H . . 4.690 3.967 3.681 4.123 . 0 0 "[ . 1 . 2]" 1
1014 1 51 ALA MB 1 52 ILE H . . 3.520 2.424 2.336 2.567 . 0 0 "[ . 1 . 2]" 1
1015 1 51 ALA MB 1 52 ILE HG13 . . 4.260 3.164 2.977 3.380 . 0 0 "[ . 1 . 2]" 1
1016 1 51 ALA MB 1 54 CYS HB3 . . 5.110 4.156 3.816 4.400 . 0 0 "[ . 1 . 2]" 1
1017 1 51 ALA MB 1 55 LEU H . . 4.810 4.418 3.907 4.580 . 0 0 "[ . 1 . 2]" 1
1018 1 51 ALA MB 1 55 LEU HG . . 3.600 3.627 3.331 3.735 0.135 13 0 "[ . 1 . 2]" 1
1019 1 52 ILE H 1 52 ILE HB . . 3.150 2.363 2.197 2.467 . 0 0 "[ . 1 . 2]" 1
1020 1 52 ILE H 1 52 ILE MD . . 4.210 3.383 3.195 3.584 . 0 0 "[ . 1 . 2]" 1
1021 1 52 ILE H 1 52 ILE HG12 . . 3.630 3.574 3.463 3.683 0.053 19 0 "[ . 1 . 2]" 1
1022 1 52 ILE H 1 52 ILE HG13 . . 3.650 2.214 2.098 2.341 . 0 0 "[ . 1 . 2]" 1
1023 1 52 ILE H 1 52 ILE MG . . 4.560 3.751 3.689 3.790 . 0 0 "[ . 1 . 2]" 1
1024 1 52 ILE H 1 53 MET H . . 3.950 2.898 2.775 3.014 . 0 0 "[ . 1 . 2]" 1
1025 1 52 ILE H 1 111 THR MG . . 4.690 4.295 3.982 4.723 0.033 11 0 "[ . 1 . 2]" 1
1026 1 52 ILE HA 1 52 ILE MD . . 4.500 3.863 3.804 3.931 . 0 0 "[ . 1 . 2]" 1
1027 1 52 ILE HA 1 52 ILE HG12 . . 4.210 2.562 2.417 2.746 . 0 0 "[ . 1 . 2]" 1
1028 1 52 ILE HA 1 52 ILE HG13 . . 3.960 2.774 2.579 2.908 . 0 0 "[ . 1 . 2]" 1
1029 1 52 ILE HA 1 55 LEU H . . 4.300 3.568 3.344 3.955 . 0 0 "[ . 1 . 2]" 1
1030 1 52 ILE HA 1 55 LEU HB2 . . 4.250 2.640 2.461 2.926 . 0 0 "[ . 1 . 2]" 1
1031 1 52 ILE HA 1 55 LEU HB3 . . 4.800 4.220 4.006 4.570 . 0 0 "[ . 1 . 2]" 1
1032 1 52 ILE HA 1 55 LEU QD . . 3.870 2.565 2.121 3.404 . 0 0 "[ . 1 . 2]" 1
1033 1 52 ILE HA 1 55 LEU HG . . 4.640 3.775 3.204 4.111 . 0 0 "[ . 1 . 2]" 1
1034 1 52 ILE HB 1 52 ILE MD . . 3.690 2.384 2.248 2.501 . 0 0 "[ . 1 . 2]" 1
1035 1 52 ILE HB 1 53 MET H . . 3.810 2.657 2.433 2.836 . 0 0 "[ . 1 . 2]" 1
1036 1 52 ILE HB 1 111 THR MG . . 3.780 2.500 2.148 3.026 . 0 0 "[ . 1 . 2]" 1
1037 1 52 ILE MD 1 52 ILE MG . . 3.650 2.160 2.077 2.222 . 0 0 "[ . 1 . 2]" 1
1038 1 52 ILE MD 1 115 ALA HA . . 5.260 4.331 4.022 4.688 . 0 0 "[ . 1 . 2]" 1
1039 1 52 ILE MD 1 115 ALA MB . . 3.420 2.082 1.948 2.266 . 0 0 "[ . 1 . 2]" 1
1040 1 52 ILE MG 1 53 MET H . . 4.720 3.261 3.053 3.471 . 0 0 "[ . 1 . 2]" 1
1041 1 52 ILE MG 1 53 MET HA . . 4.370 3.478 3.240 3.679 . 0 0 "[ . 1 . 2]" 1
1042 1 52 ILE MG 1 53 MET HB2 . . 5.160 4.320 4.062 4.587 . 0 0 "[ . 1 . 2]" 1
1043 1 52 ILE MG 1 111 THR MG . . 3.920 2.068 1.995 2.256 . 0 0 "[ . 1 . 2]" 1
1044 1 52 ILE MG 1 115 ALA MB . . 3.500 2.362 1.999 2.688 . 0 0 "[ . 1 . 2]" 1
1045 1 53 MET H 1 53 MET HB2 . . 3.520 2.360 2.225 2.571 . 0 0 "[ . 1 . 2]" 1
1046 1 53 MET H 1 53 MET HB3 . . 3.430 2.574 2.261 2.821 . 0 0 "[ . 1 . 2]" 1
1047 1 53 MET H 1 53 MET HG2 . . 4.330 4.405 4.302 4.509 0.179 1 0 "[ . 1 . 2]" 1
1048 1 53 MET H 1 53 MET HG3 . . 4.450 4.388 4.143 4.526 0.076 16 0 "[ . 1 . 2]" 1
1049 1 53 MET H 1 54 CYS H . . 3.780 2.906 2.804 3.007 . 0 0 "[ . 1 . 2]" 1
1050 1 53 MET H 1 111 THR MG . . 3.930 2.652 2.480 2.965 . 0 0 "[ . 1 . 2]" 1
1051 1 53 MET HA 1 53 MET HG2 . . 3.860 2.666 2.213 3.259 . 0 0 "[ . 1 . 2]" 1
1052 1 53 MET HA 1 53 MET HG3 . . 3.970 2.946 2.292 3.483 . 0 0 "[ . 1 . 2]" 1
1053 1 53 MET HA 1 111 THR MG . . 4.450 2.443 2.150 2.835 . 0 0 "[ . 1 . 2]" 1
1054 1 53 MET HB2 1 53 MET ME . . 2.810 2.908 2.382 3.059 0.249 7 0 "[ . 1 . 2]" 1
1055 1 53 MET HB2 1 54 CYS H . . 3.660 3.830 3.688 3.885 0.225 16 0 "[ . 1 . 2]" 1
1056 1 53 MET HB2 1 108 CYS HA . . 4.950 3.999 3.521 4.717 . 0 0 "[ . 1 . 2]" 1
1057 1 53 MET HB2 1 111 THR MG . . 4.550 2.338 2.200 2.673 . 0 0 "[ . 1 . 2]" 1
1058 1 53 MET HB3 1 53 MET ME . . 2.960 2.233 2.102 2.619 . 0 0 "[ . 1 . 2]" 1
1059 1 53 MET HB3 1 54 CYS H . . 3.820 2.533 2.357 2.706 . 0 0 "[ . 1 . 2]" 1
1060 1 53 MET HB3 1 108 CYS HA . . 4.790 4.334 3.911 4.949 0.159 14 0 "[ . 1 . 2]" 1
1061 1 53 MET HB3 1 111 THR HB . . 4.830 4.194 3.888 4.644 . 0 0 "[ . 1 . 2]" 1
1062 1 53 MET HB3 1 111 THR MG . . 4.290 3.725 3.628 4.068 . 0 0 "[ . 1 . 2]" 1
1063 1 53 MET ME 1 53 MET HG2 . . 3.910 3.018 2.409 3.427 . 0 0 "[ . 1 . 2]" 1
1064 1 53 MET ME 1 54 CYS H . . 4.800 3.959 3.459 4.303 . 0 0 "[ . 1 . 2]" 1
1065 1 53 MET ME 1 54 CYS HB2 . . 4.890 4.505 4.060 4.984 0.094 4 0 "[ . 1 . 2]" 1
1066 1 53 MET ME 1 62 LEU QD . . 4.680 4.376 3.893 4.682 0.002 8 0 "[ . 1 . 2]" 1
1067 1 53 MET ME 1 107 LYS H . . 4.970 4.594 4.047 5.063 0.093 16 0 "[ . 1 . 2]" 1
1068 1 53 MET ME 1 107 LYS QG . . 4.080 3.555 3.012 3.828 . 0 0 "[ . 1 . 2]" 1
1069 1 53 MET ME 1 108 CYS H . . 4.750 3.749 2.866 4.270 . 0 0 "[ . 1 . 2]" 1
1070 1 53 MET ME 1 108 CYS HA . . 3.920 3.300 2.247 3.758 . 0 0 "[ . 1 . 2]" 1
1071 1 53 MET ME 1 108 CYS HB3 . . 4.990 4.786 3.901 5.085 0.095 13 0 "[ . 1 . 2]" 1
1072 1 53 MET HG2 1 62 LEU QD . . 4.280 2.825 2.158 3.276 . 0 0 "[ . 1 . 2]" 1
1073 1 53 MET HG2 1 111 THR MG . . 4.570 4.014 3.343 4.757 0.187 8 0 "[ . 1 . 2]" 1
1074 1 53 MET HG3 1 62 LEU QD . . 4.600 3.297 2.221 4.051 . 0 0 "[ . 1 . 2]" 1
1075 1 53 MET HG3 1 111 THR MG . . 4.780 3.534 2.659 4.015 . 0 0 "[ . 1 . 2]" 1
1076 1 54 CYS H 1 54 CYS HB2 . . 3.290 2.526 2.359 2.667 . 0 0 "[ . 1 . 2]" 1
1077 1 54 CYS H 1 54 CYS HB3 . . 3.320 2.553 2.443 2.647 . 0 0 "[ . 1 . 2]" 1
1078 1 54 CYS H 1 55 LEU H . . 3.670 2.832 2.695 3.165 . 0 0 "[ . 1 . 2]" 1
1079 1 54 CYS HA 1 57 THR HB . . 3.400 2.742 2.265 3.462 0.062 6 0 "[ . 1 . 2]" 1
1080 1 54 CYS HA 1 57 THR MG . . 4.270 3.771 2.480 4.228 . 0 0 "[ . 1 . 2]" 1
1081 1 54 CYS HB2 1 55 LEU H . . 3.990 3.916 3.792 4.041 0.051 14 0 "[ . 1 . 2]" 1
1082 1 54 CYS HB3 1 55 LEU H . . 3.710 2.606 2.408 2.800 . 0 0 "[ . 1 . 2]" 1
1083 1 55 LEU H 1 55 LEU HB2 . . 3.600 2.401 2.037 2.598 . 0 0 "[ . 1 . 2]" 1
1084 1 55 LEU H 1 55 LEU QD . . 4.050 3.036 1.899 3.236 . 0 0 "[ . 1 . 2]" 1
1085 1 55 LEU H 1 55 LEU HG . . 3.400 2.523 2.327 3.505 0.105 17 0 "[ . 1 . 2]" 1
1086 1 55 LEU H 1 56 SER H . . 3.900 2.872 2.714 3.021 . 0 0 "[ . 1 . 2]" 1
1087 1 55 LEU HA 1 55 LEU QD . . 2.970 2.171 2.013 2.333 . 0 0 "[ . 1 . 2]" 1
1088 1 55 LEU HA 1 55 LEU HG . . 3.620 3.070 2.799 3.682 0.062 13 0 "[ . 1 . 2]" 1
1089 1 55 LEU HA 1 58 LYS H . . 4.210 3.346 3.132 3.731 . 0 0 "[ . 1 . 2]" 1
1090 1 55 LEU HA 1 58 LYS HB2 . . 3.600 2.567 2.324 2.866 . 0 0 "[ . 1 . 2]" 1
1091 1 55 LEU HA 1 58 LYS QD . . 4.460 4.446 4.063 4.559 0.099 20 0 "[ . 1 . 2]" 1
1092 1 55 LEU HB2 1 56 SER H . . 3.980 2.567 2.421 2.825 . 0 0 "[ . 1 . 2]" 1
1093 1 55 LEU HB3 1 56 SER H . . 4.450 3.446 3.218 3.790 . 0 0 "[ . 1 . 2]" 1
1094 1 56 SER H 1 56 SER HB2 . . 3.910 2.502 2.054 2.814 . 0 0 "[ . 1 . 2]" 1
1095 1 56 SER HA 1 59 LEU H . . 4.640 3.529 3.175 3.721 . 0 0 "[ . 1 . 2]" 1
1096 1 56 SER HA 1 59 LEU HB2 . . 3.670 2.967 2.727 3.300 . 0 0 "[ . 1 . 2]" 1
1097 1 56 SER HA 1 59 LEU QD . . 4.600 2.715 2.036 3.443 . 0 0 "[ . 1 . 2]" 1
1098 1 56 SER HA 1 61 MET HB2 . . 3.980 2.625 2.298 3.098 . 0 0 "[ . 1 . 2]" 1
1099 1 56 SER HA 1 61 MET HB3 . . 4.620 4.035 3.312 4.601 . 0 0 "[ . 1 . 2]" 1
1100 1 56 SER HA 1 61 MET ME . . 4.220 3.000 2.042 4.299 0.079 20 0 "[ . 1 . 2]" 1
1101 1 56 SER HA 1 61 MET HG3 . . 5.060 4.052 3.515 4.955 . 0 0 "[ . 1 . 2]" 1
1102 1 56 SER HB2 1 57 THR H . . 3.670 2.779 2.327 3.675 0.005 10 0 "[ . 1 . 2]" 1
1103 1 56 SER HB2 1 61 MET HB2 . . 4.480 4.186 3.688 4.562 0.082 14 0 "[ . 1 . 2]" 1
1104 1 56 SER HB2 1 62 LEU QD . . 4.040 3.089 1.923 3.840 . 0 0 "[ . 1 . 2]" 1
1105 1 56 SER HB3 1 57 THR H . . 4.160 3.426 2.665 3.832 . 0 0 "[ . 1 . 2]" 1
1106 1 56 SER HB3 1 61 MET HB2 . . 4.220 2.838 2.154 4.122 . 0 0 "[ . 1 . 2]" 1
1107 1 56 SER HB3 1 61 MET HB3 . . 4.650 3.465 2.788 4.707 0.057 14 0 "[ . 1 . 2]" 1
1108 1 56 SER HB3 1 61 MET ME . . 4.960 4.136 3.001 5.042 0.082 18 0 "[ . 1 . 2]" 1
1109 1 56 SER HB3 1 62 LEU QD . . 4.090 2.876 1.858 3.754 . 0 0 "[ . 1 . 2]" 1
1110 1 56 SER HB3 1 62 LEU HG . . 4.010 3.420 2.486 4.553 0.543 8 1 "[ . + 1 . 2]" 1
1111 1 57 THR H 1 57 THR HB . . 3.200 2.326 2.060 2.649 . 0 0 "[ . 1 . 2]" 1
1112 1 57 THR H 1 57 THR MG . . 3.770 3.618 2.914 3.850 0.080 8 0 "[ . 1 . 2]" 1
1113 1 57 THR H 1 58 LYS H . . 3.480 2.868 2.691 2.984 . 0 0 "[ . 1 . 2]" 1
1114 1 57 THR H 1 59 LEU H . . 4.710 4.237 4.020 4.470 . 0 0 "[ . 1 . 2]" 1
1115 1 57 THR H 1 62 LEU QD . . 4.560 3.133 2.227 3.844 . 0 0 "[ . 1 . 2]" 1
1116 1 57 THR HA 1 57 THR MG . . 3.070 2.627 2.431 3.142 0.072 12 0 "[ . 1 . 2]" 1
1117 1 57 THR HA 1 60 ASN H . . 4.280 3.832 3.308 4.332 0.052 15 0 "[ . 1 . 2]" 1
1118 1 57 THR HA 1 60 ASN HA . . 4.630 3.868 3.197 4.701 0.071 10 0 "[ . 1 . 2]" 1
1119 1 57 THR HA 1 61 MET H . . 4.350 3.282 2.472 3.739 . 0 0 "[ . 1 . 2]" 1
1120 1 57 THR HA 1 62 LEU H . . 4.420 3.437 2.567 4.270 . 0 0 "[ . 1 . 2]" 1
1121 1 57 THR HA 1 62 LEU HB2 . . 4.320 2.927 1.929 3.574 . 0 0 "[ . 1 . 2]" 1
1122 1 57 THR HA 1 62 LEU HB3 . . 4.920 4.535 3.531 5.006 0.086 16 0 "[ . 1 . 2]" 1
1123 1 57 THR HA 1 62 LEU QD . . 3.430 2.929 2.125 3.452 0.022 7 0 "[ . 1 . 2]" 1
1124 1 57 THR HA 1 62 LEU HG . . 4.120 3.455 2.652 4.226 0.106 14 0 "[ . 1 . 2]" 1
1125 1 57 THR HB 1 58 LYS H . . 3.410 2.672 2.095 3.496 0.086 6 0 "[ . 1 . 2]" 1
1126 1 57 THR HB 1 62 LEU QD . . 4.850 3.574 2.396 4.236 . 0 0 "[ . 1 . 2]" 1
1127 1 57 THR MG 1 58 LYS H . . 4.030 2.781 2.069 3.105 . 0 0 "[ . 1 . 2]" 1
1128 1 57 THR MG 1 58 LYS HA . . 4.140 2.974 2.893 3.159 . 0 0 "[ . 1 . 2]" 1
1129 1 57 THR MG 1 58 LYS HB3 . . 4.550 4.635 4.413 4.669 0.119 18 0 "[ . 1 . 2]" 1
1130 1 57 THR MG 1 58 LYS HG2 . . 3.710 2.642 2.154 2.831 . 0 0 "[ . 1 . 2]" 1
1131 1 57 THR MG 1 58 LYS HG3 . . 4.140 3.865 2.940 4.239 0.099 20 0 "[ . 1 . 2]" 1
1132 1 57 THR MG 1 60 ASN H . . 5.120 4.295 4.147 4.654 . 0 0 "[ . 1 . 2]" 1
1133 1 57 THR MG 1 61 MET H . . 4.910 5.015 4.983 5.040 0.130 6 0 "[ . 1 . 2]" 1
1134 1 57 THR MG 1 62 LEU QD . . 3.800 3.601 3.168 3.865 0.065 17 0 "[ . 1 . 2]" 1
1135 1 58 LYS H 1 58 LYS HB2 . . 3.280 2.521 2.378 2.685 . 0 0 "[ . 1 . 2]" 1
1136 1 58 LYS H 1 58 LYS HB3 . . 3.700 3.570 3.477 3.686 . 0 0 "[ . 1 . 2]" 1
1137 1 58 LYS H 1 58 LYS QD . . 4.170 4.182 3.956 4.263 0.093 12 0 "[ . 1 . 2]" 1
1138 1 58 LYS H 1 58 LYS HG2 . . 3.430 2.581 2.223 2.885 . 0 0 "[ . 1 . 2]" 1
1139 1 58 LYS H 1 58 LYS HG3 . . 3.950 2.811 2.496 3.404 . 0 0 "[ . 1 . 2]" 1
1140 1 58 LYS H 1 59 LEU H . . 3.540 2.818 2.654 2.964 . 0 0 "[ . 1 . 2]" 1
1141 1 58 LYS HA 1 58 LYS HB3 . . 2.960 2.399 2.307 2.530 . 0 0 "[ . 1 . 2]" 1
1142 1 58 LYS HA 1 58 LYS QD . . 3.120 3.085 2.583 3.220 0.100 7 0 "[ . 1 . 2]" 1
1143 1 58 LYS HA 1 58 LYS QE . . 4.840 4.428 4.163 4.626 . 0 0 "[ . 1 . 2]" 1
1144 1 58 LYS HA 1 58 LYS HG2 . . 3.730 2.450 2.175 2.670 . 0 0 "[ . 1 . 2]" 1
1145 1 58 LYS HA 1 58 LYS HG3 . . 3.720 3.620 3.343 3.777 0.057 19 0 "[ . 1 . 2]" 1
1146 1 58 LYS HA 1 60 ASN H . . 4.420 3.571 3.210 4.014 . 0 0 "[ . 1 . 2]" 1
1147 1 58 LYS HB2 1 58 LYS QD . . 3.500 3.015 2.762 3.500 0.000 20 0 "[ . 1 . 2]" 1
1148 1 58 LYS HB2 1 59 LEU H . . 4.380 3.186 2.604 3.459 . 0 0 "[ . 1 . 2]" 1
1149 1 58 LYS HB3 1 59 LEU H . . 4.750 4.003 3.521 4.151 . 0 0 "[ . 1 . 2]" 1
1150 1 58 LYS HB3 1 59 LEU HA . . 4.610 4.658 4.398 4.695 0.085 4 0 "[ . 1 . 2]" 1
1151 1 59 LEU H 1 59 LEU HB2 . . 3.030 2.457 2.325 2.580 . 0 0 "[ . 1 . 2]" 1
1152 1 59 LEU H 1 59 LEU QD . . 4.270 2.966 2.239 3.392 . 0 0 "[ . 1 . 2]" 1
1153 1 59 LEU H 1 59 LEU HG . . 4.130 3.139 2.340 4.214 0.084 11 0 "[ . 1 . 2]" 1
1154 1 59 LEU H 1 60 ASN H . . 3.350 2.495 2.333 2.641 . 0 0 "[ . 1 . 2]" 1
1155 1 59 LEU H 1 60 ASN HA . . 4.520 4.489 4.157 4.593 0.073 7 0 "[ . 1 . 2]" 1
1156 1 59 LEU HA 1 59 LEU QD . . 2.980 2.197 1.998 2.343 . 0 0 "[ . 1 . 2]" 1
1157 1 59 LEU HA 1 59 LEU HG . . 3.950 3.088 2.402 3.728 . 0 0 "[ . 1 . 2]" 1
1158 1 59 LEU HA 1 61 MET HG3 . . 5.030 4.988 4.521 5.118 0.088 20 0 "[ . 1 . 2]" 1
1159 1 59 LEU HB2 1 59 LEU QD . . 2.880 2.204 2.141 2.291 . 0 0 "[ . 1 . 2]" 1
1160 1 59 LEU HB2 1 60 ASN H . . 3.880 3.706 3.154 3.913 0.033 4 0 "[ . 1 . 2]" 1
1161 1 59 LEU HB2 1 61 MET H . . 4.270 3.552 2.917 4.329 0.059 6 0 "[ . 1 . 2]" 1
1162 1 59 LEU HB2 1 61 MET HG2 . . 4.460 4.381 4.010 4.550 0.090 8 0 "[ . 1 . 2]" 1
1163 1 59 LEU HB3 1 60 ASN H . . 4.950 4.323 3.861 4.473 . 0 0 "[ . 1 . 2]" 1
1164 1 59 LEU QD 1 61 MET ME . . 3.730 2.733 1.999 3.745 0.015 3 0 "[ . 1 . 2]" 1
1165 1 59 LEU QD 1 61 MET HG2 . . 5.500 4.985 4.556 5.182 . 0 0 "[ . 1 . 2]" 1
1166 1 59 LEU QD 1 76 PHE QD . . 3.840 3.221 2.869 3.662 . 0 0 "[ . 1 . 2]" 1
1167 1 59 LEU QD 1 76 PHE QE . . 3.800 2.251 1.821 3.113 . 0 0 "[ . 1 . 2]" 1
1168 1 60 ASN H 1 60 ASN HA . . 2.690 2.165 2.114 2.225 . 0 0 "[ . 1 . 2]" 1
1169 1 60 ASN H 1 60 ASN HB2 . . 3.950 3.234 2.969 3.774 . 0 0 "[ . 1 . 2]" 1
1170 1 60 ASN H 1 60 ASN HB3 . . 4.120 3.804 3.434 4.046 . 0 0 "[ . 1 . 2]" 1
1171 1 60 ASN H 1 61 MET HA . . 5.220 5.236 5.104 5.297 0.077 12 0 "[ . 1 . 2]" 1
1172 1 60 ASN HA 1 62 LEU H . . 4.410 3.224 2.923 3.623 . 0 0 "[ . 1 . 2]" 1
1173 1 60 ASN HB2 1 60 ASN HD21 . . 3.440 3.171 2.303 3.647 0.207 8 0 "[ . 1 . 2]" 1
1174 1 60 ASN HB2 1 60 ASN HD22 . . 4.150 3.907 3.494 4.125 . 0 0 "[ . 1 . 2]" 1
1175 1 60 ASN HB2 1 72 ASN HD22 . . 4.050 3.899 2.571 4.449 0.399 12 0 "[ . 1 . 2]" 1
1176 1 60 ASN HB3 1 72 ASN HD21 . . 4.280 2.789 1.614 4.176 . 0 0 "[ . 1 . 2]" 1
1177 1 60 ASN HB3 1 72 ASN HD22 . . 4.370 2.873 2.156 4.431 0.061 19 0 "[ . 1 . 2]" 1
1178 1 60 ASN HD21 1 72 ASN HD22 . . 4.940 2.852 1.835 4.542 . 0 0 "[ . 1 . 2]" 1
1179 1 60 ASN HD22 1 72 ASN HD22 . . 4.340 4.021 2.547 5.020 0.680 2 1 "[ + . 1 . 2]" 1
1180 1 61 MET H 1 61 MET HB2 . . 3.640 2.529 2.239 2.966 . 0 0 "[ . 1 . 2]" 1
1181 1 61 MET H 1 61 MET HG2 . . 4.700 4.107 3.749 4.574 . 0 0 "[ . 1 . 2]" 1
1182 1 61 MET H 1 61 MET HG3 . . 4.950 3.356 2.832 4.108 . 0 0 "[ . 1 . 2]" 1
1183 1 61 MET H 1 62 LEU H . . 3.800 2.513 1.838 3.189 . 0 0 "[ . 1 . 2]" 1
1184 1 61 MET HA 1 61 MET HG2 . . 3.780 2.292 2.058 2.677 . 0 0 "[ . 1 . 2]" 1
1185 1 61 MET HA 1 61 MET HG3 . . 3.670 2.945 2.327 3.359 . 0 0 "[ . 1 . 2]" 1
1186 1 61 MET HA 1 68 LEU QD . . 5.320 4.132 3.712 4.502 . 0 0 "[ . 1 . 2]" 1
1187 1 61 MET HA 1 69 HIS HB2 . . 4.650 3.957 3.166 4.685 0.035 3 0 "[ . 1 . 2]" 1
1188 1 61 MET HA 1 69 HIS HB3 . . 4.810 2.782 2.176 3.719 . 0 0 "[ . 1 . 2]" 1
1189 1 61 MET HA 1 72 ASN HB2 . . 4.210 3.667 2.860 4.285 0.075 10 0 "[ . 1 . 2]" 1
1190 1 61 MET HA 1 72 ASN HB3 . . 4.130 2.857 2.233 3.960 . 0 0 "[ . 1 . 2]" 1
1191 1 61 MET HB3 1 61 MET ME . . 4.260 3.240 2.362 4.116 . 0 0 "[ . 1 . 2]" 1
1192 1 61 MET HB3 1 68 LEU QD . . 4.130 2.909 2.552 3.581 . 0 0 "[ . 1 . 2]" 1
1193 1 61 MET ME 1 73 ALA HA . . 3.910 3.380 2.261 4.005 0.095 2 0 "[ . 1 . 2]" 1
1194 1 61 MET ME 1 76 PHE HB2 . . 4.110 3.752 2.387 4.226 0.116 10 0 "[ . 1 . 2]" 1
1195 1 61 MET ME 1 76 PHE HB3 . . 4.120 3.658 2.233 4.203 0.083 12 0 "[ . 1 . 2]" 1
1196 1 61 MET ME 1 76 PHE QD . . 3.940 3.307 2.469 4.010 0.070 3 0 "[ . 1 . 2]" 1
1197 1 61 MET ME 1 76 PHE QE . . 4.530 3.830 2.807 4.625 0.095 6 0 "[ . 1 . 2]" 1
1198 1 61 MET HG2 1 68 LEU QD . . 4.750 3.922 3.603 4.413 . 0 0 "[ . 1 . 2]" 1
1199 1 61 MET HG2 1 73 ALA HA . . 4.780 2.594 2.094 3.396 . 0 0 "[ . 1 . 2]" 1
1200 1 61 MET HG2 1 73 ALA MB . . 3.910 3.088 2.531 3.977 0.067 20 0 "[ . 1 . 2]" 1
1201 1 61 MET HG3 1 68 LEU QD . . 4.910 4.812 4.592 4.943 0.033 7 0 "[ . 1 . 2]" 1
1202 1 61 MET HG3 1 73 ALA H . . 5.070 5.056 4.507 5.148 0.078 15 0 "[ . 1 . 2]" 1
1203 1 61 MET HG3 1 73 ALA HA . . 4.050 3.739 3.309 4.114 0.064 13 0 "[ . 1 . 2]" 1
1204 1 62 LEU H 1 62 LEU HB2 . . 3.990 2.591 2.376 3.084 . 0 0 "[ . 1 . 2]" 1
1205 1 62 LEU H 1 62 LEU HB3 . . 3.800 3.715 3.548 3.878 0.078 9 0 "[ . 1 . 2]" 1
1206 1 62 LEU H 1 62 LEU QD . . 5.020 3.436 2.751 3.926 . 0 0 "[ . 1 . 2]" 1
1207 1 62 LEU H 1 62 LEU HG . . 4.510 3.559 2.874 4.509 . 0 0 "[ . 1 . 2]" 1
1208 1 62 LEU HA 1 62 LEU QD . . 3.420 2.101 2.010 2.196 . 0 0 "[ . 1 . 2]" 1
1209 1 62 LEU HA 1 63 ASP H . . 3.090 2.077 1.994 2.192 . 0 0 "[ . 1 . 2]" 1
1210 1 62 LEU HA 1 63 ASP HB2 . . 4.750 4.658 3.819 5.612 0.862 5 9 "[** + ** - ** * 2]" 1
1211 1 62 LEU HA 1 68 LEU HA . . 3.700 2.815 2.168 3.355 . 0 0 "[ . 1 . 2]" 1
1212 1 62 LEU HA 1 69 HIS H . . 3.850 2.936 2.364 3.920 0.070 15 0 "[ . 1 . 2]" 1
1213 1 62 LEU HB2 1 66 GLY HA2 . . 4.900 4.197 3.832 4.781 . 0 0 "[ . 1 . 2]" 1
1214 1 62 LEU HB3 1 63 ASP H . . 4.130 3.347 2.775 3.742 . 0 0 "[ . 1 . 2]" 1
1215 1 62 LEU HB3 1 66 GLY H . . 4.370 3.953 3.597 4.178 . 0 0 "[ . 1 . 2]" 1
1216 1 62 LEU HB3 1 66 GLY HA2 . . 3.810 2.572 2.148 3.040 . 0 0 "[ . 1 . 2]" 1
1217 1 62 LEU HB3 1 66 GLY HA3 . . 4.630 4.224 3.687 4.692 0.062 5 0 "[ . 1 . 2]" 1
1218 1 62 LEU QD 1 63 ASP H . . 5.000 3.505 3.081 3.832 . 0 0 "[ . 1 . 2]" 1
1219 1 62 LEU QD 1 63 ASP HB2 . . 5.460 5.435 4.222 6.433 0.973 15 8 "[ * * -* * ** + 2]" 1
1220 1 62 LEU QD 1 66 GLY H . . 5.260 4.405 3.915 4.986 . 0 0 "[ . 1 . 2]" 1
1221 1 62 LEU QD 1 66 GLY HA2 . . 4.020 2.851 2.300 3.387 . 0 0 "[ . 1 . 2]" 1
1222 1 62 LEU QD 1 66 GLY HA3 . . 4.450 3.705 3.096 4.409 . 0 0 "[ . 1 . 2]" 1
1223 1 62 LEU QD 1 67 ASN HA . . 4.830 3.839 3.066 4.593 . 0 0 "[ . 1 . 2]" 1
1224 1 62 LEU QD 1 68 LEU HA . . 3.640 2.492 1.992 3.193 . 0 0 "[ . 1 . 2]" 1
1225 1 62 LEU QD 1 69 HIS H . . 5.100 3.604 3.240 4.132 . 0 0 "[ . 1 . 2]" 1
1226 1 63 ASP H 1 63 ASP HB2 . . 3.860 2.680 1.905 3.624 . 0 0 "[ . 1 . 2]" 1
1227 1 63 ASP H 1 65 GLU H . . 4.740 4.297 3.855 4.797 0.057 3 0 "[ . 1 . 2]" 1
1228 1 63 ASP H 1 69 HIS HD2 . . 4.890 4.657 4.279 4.952 0.062 1 0 "[ . 1 . 2]" 1
1229 1 63 ASP HA 1 64 PRO HA . . 4.540 4.371 4.091 4.524 . 0 0 "[ . 1 . 2]" 1
1230 1 63 ASP HA 1 64 PRO HD2 . . 3.200 3.136 2.636 3.377 0.177 14 0 "[ . 1 . 2]" 1
1231 1 63 ASP HA 1 64 PRO HD3 . . 3.800 2.395 2.129 2.711 . 0 0 "[ . 1 . 2]" 1
1232 1 63 ASP HB2 1 64 PRO HD2 . . 3.990 3.038 1.924 3.975 . 0 0 "[ . 1 . 2]" 1
1233 1 63 ASP HB2 1 64 PRO HD3 . . 4.360 3.604 2.574 4.442 0.082 9 0 "[ . 1 . 2]" 1
1234 1 63 ASP HB2 1 69 HIS HD2 . . 4.870 4.188 2.489 5.039 0.169 2 0 "[ . 1 . 2]" 1
1235 1 63 ASP HB3 1 64 PRO HD2 . . 3.660 2.989 2.099 3.866 0.206 12 0 "[ . 1 . 2]" 1
1236 1 63 ASP HB3 1 64 PRO HD3 . . 3.630 3.739 2.963 4.439 0.809 2 2 "[-+ . 1 . 2]" 1
1237 1 63 ASP HB3 1 69 HIS HD2 . . 4.990 4.497 3.060 5.075 0.085 18 0 "[ . 1 . 2]" 1
1238 1 64 PRO HA 1 66 GLY H . . 4.480 4.101 3.630 4.479 . 0 0 "[ . 1 . 2]" 1
1239 1 64 PRO HB2 1 65 GLU QG . . 3.880 3.853 3.165 3.966 0.086 11 0 "[ . 1 . 2]" 1
1240 1 64 PRO HB3 1 65 GLU H . . 4.750 4.585 4.402 4.661 . 0 0 "[ . 1 . 2]" 1
1241 1 64 PRO HD2 1 69 HIS HD2 . . 5.030 4.797 3.789 5.296 0.266 11 0 "[ . 1 . 2]" 1
1242 1 64 PRO HD3 1 65 GLU H . . 4.130 4.232 3.853 4.506 0.376 4 0 "[ . 1 . 2]" 1
1243 1 64 PRO HD3 1 69 HIS HD2 . . 5.220 3.664 2.673 4.743 . 0 0 "[ . 1 . 2]" 1
1244 1 64 PRO HG3 1 65 GLU H . . 5.020 5.054 4.535 5.459 0.439 11 0 "[ . 1 . 2]" 1
1245 1 65 GLU H 1 65 GLU HB2 . . 3.700 2.636 2.376 2.955 . 0 0 "[ . 1 . 2]" 1
1246 1 65 GLU H 1 65 GLU QG . . 3.050 2.805 2.332 3.147 0.097 14 0 "[ . 1 . 2]" 1
1247 1 65 GLU H 1 66 GLY H . . 2.800 1.833 1.527 2.025 . 0 0 "[ . 1 . 2]" 1
1248 1 65 GLU H 1 66 GLY HA2 . . 4.130 4.022 3.682 4.218 0.088 6 0 "[ . 1 . 2]" 1
1249 1 65 GLU HA 1 65 GLU QG . . 2.760 2.726 2.377 2.868 0.108 12 0 "[ . 1 . 2]" 1
1250 1 65 GLU HA 1 66 GLY H . . 3.570 3.480 3.246 3.619 0.049 10 0 "[ . 1 . 2]" 1
1251 1 65 GLU HA 1 66 GLY HA3 . . 4.830 4.668 4.393 4.820 . 0 0 "[ . 1 . 2]" 1
1252 1 65 GLU HB2 1 66 GLY H . . 4.860 2.896 2.235 3.283 . 0 0 "[ . 1 . 2]" 1
1253 1 65 GLU HB2 1 66 GLY HA3 . . 4.840 4.784 4.397 4.977 0.137 3 0 "[ . 1 . 2]" 1
1254 1 65 GLU HB2 1 67 ASN HD21 . . 4.330 2.586 1.731 3.466 . 0 0 "[ . 1 . 2]" 1
1255 1 65 GLU HB2 1 67 ASN HD22 . . 4.650 3.608 2.487 4.711 0.061 11 0 "[ . 1 . 2]" 1
1256 1 65 GLU HB3 1 66 GLY H . . 4.020 3.928 3.398 4.109 0.089 9 0 "[ . 1 . 2]" 1
1257 1 65 GLU HB3 1 67 ASN H . . 4.870 4.152 3.203 4.605 . 0 0 "[ . 1 . 2]" 1
1258 1 65 GLU HB3 1 67 ASN HD21 . . 4.230 2.989 1.855 3.742 . 0 0 "[ . 1 . 2]" 1
1259 1 65 GLU HB3 1 67 ASN HD22 . . 4.940 3.513 2.718 5.005 0.065 4 0 "[ . 1 . 2]" 1
1260 1 65 GLU QG 1 66 GLY H . . 4.020 4.031 3.789 4.129 0.109 3 0 "[ . 1 . 2]" 1
1261 1 65 GLU QG 1 67 ASN H . . 4.790 4.590 3.930 4.866 0.076 3 0 "[ . 1 . 2]" 1
1262 1 65 GLU QG 1 67 ASN HD21 . . 4.350 3.841 2.736 4.426 0.076 18 0 "[ . 1 . 2]" 1
1263 1 66 GLY H 1 66 GLY HA2 . . 2.910 2.356 2.234 2.555 . 0 0 "[ . 1 . 2]" 1
1264 1 66 GLY H 1 67 ASN H . . 3.260 2.248 1.834 2.640 . 0 0 "[ . 1 . 2]" 1
1265 1 67 ASN H 1 67 ASN HB2 . . 3.670 2.804 2.314 3.875 0.205 4 0 "[ . 1 . 2]" 1
1266 1 67 ASN HB2 1 67 ASN HD21 . . 3.630 2.519 2.203 3.534 . 0 0 "[ . 1 . 2]" 1
1267 1 68 LEU HA 1 68 LEU QD . . 3.470 2.632 2.075 3.149 . 0 0 "[ . 1 . 2]" 1
1268 1 68 LEU HA 1 68 LEU HG . . 4.140 2.753 2.104 3.798 . 0 0 "[ . 1 . 2]" 1
1269 1 68 LEU HA 1 69 HIS H . . 3.090 2.158 2.068 2.307 . 0 0 "[ . 1 . 2]" 1
1270 1 68 LEU HB2 1 94 VAL MG1 . . 4.370 3.657 3.049 4.192 . 0 0 "[ . 1 . 2]" 1
1271 1 68 LEU HB3 1 69 HIS H . . 4.820 4.096 3.231 4.410 . 0 0 "[ . 1 . 2]" 1
1272 1 68 LEU HB3 1 70 HIS HD2 . . 4.840 4.095 3.054 4.929 0.089 2 0 "[ . 1 . 2]" 1
1273 1 68 LEU HB3 1 94 VAL MG1 . . 4.450 3.977 3.584 4.549 0.099 15 0 "[ . 1 . 2]" 1
1274 1 68 LEU QD 1 69 HIS H . . 4.240 2.804 2.338 3.216 . 0 0 "[ . 1 . 2]" 1
1275 1 68 LEU QD 1 70 HIS HA . . 5.150 2.623 2.147 3.802 . 0 0 "[ . 1 . 2]" 1
1276 1 68 LEU QD 1 70 HIS HD2 . . 4.940 2.438 2.107 4.022 . 0 0 "[ . 1 . 2]" 1
1277 1 68 LEU QD 1 73 ALA HA . . 4.000 3.935 3.724 4.031 0.031 1 0 "[ . 1 . 2]" 1
1278 1 68 LEU QD 1 73 ALA MB . . 3.510 2.048 1.910 2.296 . 0 0 "[ . 1 . 2]" 1
1279 1 68 LEU QD 1 94 VAL HB . . 3.940 3.351 2.300 3.669 . 0 0 "[ . 1 . 2]" 1
1280 1 68 LEU QD 1 95 HIS HA . . 4.440 3.697 2.521 4.103 . 0 0 "[ . 1 . 2]" 1
1281 1 68 LEU HG 1 69 HIS H . . 4.960 3.261 2.042 5.026 0.066 14 0 "[ . 1 . 2]" 1
1282 1 68 LEU HG 1 70 HIS HD2 . . 5.160 4.786 2.742 5.235 0.075 1 0 "[ . 1 . 2]" 1
1283 1 69 HIS H 1 69 HIS HB2 . . 4.010 2.621 2.431 2.993 . 0 0 "[ . 1 . 2]" 1
1284 1 69 HIS H 1 69 HIS HB3 . . 3.990 2.579 2.357 2.840 . 0 0 "[ . 1 . 2]" 1
1285 1 69 HIS HA 1 69 HIS HD2 . . 4.430 4.161 3.325 4.508 0.078 8 0 "[ . 1 . 2]" 1
1286 1 69 HIS HA 1 70 HIS H . . 3.380 2.323 2.136 3.369 . 0 0 "[ . 1 . 2]" 1
1287 1 69 HIS HA 1 70 HIS HD1 . . 4.550 4.468 3.624 4.635 0.085 17 0 "[ . 1 . 2]" 1
1288 1 69 HIS HB2 1 69 HIS HD2 . . 3.580 2.632 2.559 2.790 . 0 0 "[ . 1 . 2]" 1
1289 1 69 HIS HB2 1 73 ALA MB . . 5.450 5.427 4.951 5.560 0.110 3 0 "[ . 1 . 2]" 1
1290 1 69 HIS HB3 1 72 ASN HB2 . . 4.540 2.906 2.207 3.818 . 0 0 "[ . 1 . 2]" 1
1291 1 69 HIS HB3 1 72 ASN HB3 . . 4.460 3.328 2.552 4.250 . 0 0 "[ . 1 . 2]" 1
1292 1 69 HIS HE1 1 71 GLY H . . 4.070 3.571 2.941 3.993 . 0 0 "[ . 1 . 2]" 1
1293 1 69 HIS HE1 1 71 GLY HA2 . . 4.220 4.290 4.268 4.305 0.085 11 0 "[ . 1 . 2]" 1
1294 1 69 HIS HE1 1 71 GLY HA3 . . 3.590 2.557 2.513 2.656 . 0 0 "[ . 1 . 2]" 1
1295 1 69 HIS HE1 1 72 ASN H . . 4.070 3.107 2.359 3.527 . 0 0 "[ . 1 . 2]" 1
1296 1 70 HIS H 1 70 HIS HB3 . . 3.910 3.584 3.515 3.988 0.078 20 0 "[ . 1 . 2]" 1
1297 1 70 HIS H 1 70 HIS HD1 . . 3.790 2.927 2.519 3.844 0.054 20 0 "[ . 1 . 2]" 1
1298 1 70 HIS H 1 71 GLY H . . 4.640 3.013 2.737 3.626 . 0 0 "[ . 1 . 2]" 1
1299 1 70 HIS HA 1 70 HIS HD2 . . 4.100 2.634 2.280 3.045 . 0 0 "[ . 1 . 2]" 1
1300 1 70 HIS HA 1 73 ALA MB . . 3.750 2.426 2.112 2.984 . 0 0 "[ . 1 . 2]" 1
1301 1 70 HIS HA 1 91 ILE MD . . 4.180 3.661 2.118 4.266 0.086 13 0 "[ . 1 . 2]" 1
1302 1 70 HIS HA 1 91 ILE MG . . 4.680 3.323 2.733 3.695 . 0 0 "[ . 1 . 2]" 1
1303 1 70 HIS HB2 1 71 GLY H . . 3.960 2.560 2.195 2.774 . 0 0 "[ . 1 . 2]" 1
1304 1 70 HIS HB2 1 71 GLY HA3 . . 4.660 4.627 4.286 4.742 0.082 4 0 "[ . 1 . 2]" 1
1305 1 70 HIS HB2 1 91 ILE MG . . 4.820 4.090 3.459 4.908 0.088 9 0 "[ . 1 . 2]" 1
1306 1 70 HIS HB3 1 71 GLY H . . 4.130 3.663 3.275 3.876 . 0 0 "[ . 1 . 2]" 1
1307 1 70 HIS HB3 1 91 ILE MG . . 4.990 2.673 2.045 3.623 . 0 0 "[ . 1 . 2]" 1
1308 1 70 HIS HD2 1 73 ALA MB . . 5.140 4.036 3.249 5.181 0.041 20 0 "[ . 1 . 2]" 1
1309 1 70 HIS HD2 1 91 ILE MD . . 4.910 4.321 2.523 5.005 0.095 14 0 "[ . 1 . 2]" 1
1310 1 70 HIS HD2 1 91 ILE QG . . 5.050 3.049 2.282 4.064 . 0 0 "[ . 1 . 2]" 1
1311 1 70 HIS HD2 1 91 ILE MG . . 5.090 2.193 1.910 2.746 . 0 0 "[ . 1 . 2]" 1
1312 1 70 HIS HE1 1 91 ILE MG . . 5.500 5.092 4.603 5.545 0.045 2 0 "[ . 1 . 2]" 1
1313 1 71 GLY H 1 72 ASN H . . 3.920 3.214 2.997 3.412 . 0 0 "[ . 1 . 2]" 1
1314 1 71 GLY HA2 1 74 MET HB2 . . 4.280 4.315 3.955 4.358 0.078 11 0 "[ . 1 . 2]" 1
1315 1 71 GLY HA2 1 74 MET HB3 . . 4.170 3.315 3.073 3.518 . 0 0 "[ . 1 . 2]" 1
1316 1 72 ASN H 1 72 ASN HB2 . . 4.090 2.243 2.097 2.483 . 0 0 "[ . 1 . 2]" 1
1317 1 72 ASN H 1 72 ASN HB3 . . 3.560 3.199 2.761 3.619 0.059 6 0 "[ . 1 . 2]" 1
1318 1 72 ASN H 1 73 ALA H . . 3.650 2.798 2.237 3.224 . 0 0 "[ . 1 . 2]" 1
1319 1 72 ASN HA 1 73 ALA MB . . 5.170 4.989 4.908 5.056 . 0 0 "[ . 1 . 2]" 1
1320 1 72 ASN HA 1 75 GLU H . . 4.390 3.186 2.813 3.590 . 0 0 "[ . 1 . 2]" 1
1321 1 72 ASN HA 1 75 GLU QB . . 3.250 2.272 1.992 2.864 . 0 0 "[ . 1 . 2]" 1
1322 1 72 ASN HA 1 75 GLU HG2 . . 5.060 4.290 3.347 5.097 0.037 16 0 "[ . 1 . 2]" 1
1323 1 72 ASN HA 1 75 GLU HG3 . . 4.300 3.279 2.454 4.080 . 0 0 "[ . 1 . 2]" 1
1324 1 72 ASN HB2 1 73 ALA H . . 4.570 3.463 2.864 3.971 . 0 0 "[ . 1 . 2]" 1
1325 1 72 ASN HB3 1 73 ALA H . . 4.670 3.156 2.628 3.633 . 0 0 "[ . 1 . 2]" 1
1326 1 72 ASN HB3 1 73 ALA MB . . 5.200 4.396 4.033 4.767 . 0 0 "[ . 1 . 2]" 1
1327 1 73 ALA H 1 73 ALA MB . . 3.300 2.184 2.087 2.277 . 0 0 "[ . 1 . 2]" 1
1328 1 73 ALA H 1 74 MET H . . 3.350 2.865 2.727 3.086 . 0 0 "[ . 1 . 2]" 1
1329 1 73 ALA HA 1 76 PHE H . . 4.490 3.707 3.398 4.125 . 0 0 "[ . 1 . 2]" 1
1330 1 73 ALA HA 1 76 PHE HB2 . . 4.110 3.483 3.028 4.118 0.008 16 0 "[ . 1 . 2]" 1
1331 1 73 ALA HA 1 76 PHE HB3 . . 3.990 3.187 2.687 3.521 . 0 0 "[ . 1 . 2]" 1
1332 1 73 ALA HA 1 76 PHE QD . . 4.790 4.580 3.936 4.859 0.069 11 0 "[ . 1 . 2]" 1
1333 1 73 ALA HA 1 91 ILE MD . . 4.350 3.968 3.695 4.326 . 0 0 "[ . 1 . 2]" 1
1334 1 73 ALA MB 1 74 MET H . . 3.790 2.462 2.297 2.624 . 0 0 "[ . 1 . 2]" 1
1335 1 73 ALA MB 1 74 MET HB3 . . 4.950 4.515 4.295 4.681 . 0 0 "[ . 1 . 2]" 1
1336 1 73 ALA MB 1 91 ILE MD . . 3.610 2.187 2.032 2.482 . 0 0 "[ . 1 . 2]" 1
1337 1 74 MET H 1 74 MET HB2 . . 3.140 2.505 2.274 2.630 . 0 0 "[ . 1 . 2]" 1
1338 1 74 MET H 1 74 MET HB3 . . 3.590 2.459 2.355 2.551 . 0 0 "[ . 1 . 2]" 1
1339 1 74 MET H 1 74 MET ME . . 4.860 4.355 3.686 4.581 . 0 0 "[ . 1 . 2]" 1
1340 1 74 MET H 1 74 MET HG2 . . 4.410 4.420 4.319 4.473 0.063 15 0 "[ . 1 . 2]" 1
1341 1 74 MET H 1 74 MET HG3 . . 4.330 4.368 4.323 4.393 0.063 1 0 "[ . 1 . 2]" 1
1342 1 74 MET H 1 75 GLU H . . 3.650 2.694 2.572 2.819 . 0 0 "[ . 1 . 2]" 1
1343 1 74 MET H 1 87 ALA MB . . 5.200 5.268 5.126 5.305 0.105 2 0 "[ . 1 . 2]" 1
1344 1 74 MET H 1 91 ILE MD . . 4.120 2.827 2.242 3.185 . 0 0 "[ . 1 . 2]" 1
1345 1 74 MET HA 1 74 MET ME . . 3.880 3.118 2.292 3.533 . 0 0 "[ . 1 . 2]" 1
1346 1 74 MET HA 1 77 ALA MB . . 3.520 2.615 2.228 2.998 . 0 0 "[ . 1 . 2]" 1
1347 1 74 MET HA 1 78 LYS H . . 4.320 4.070 3.874 4.275 . 0 0 "[ . 1 . 2]" 1
1348 1 74 MET HA 1 87 ALA MB . . 3.710 2.813 2.616 2.932 . 0 0 "[ . 1 . 2]" 1
1349 1 74 MET HA 1 91 ILE MD . . 3.980 2.581 2.357 3.071 . 0 0 "[ . 1 . 2]" 1
1350 1 74 MET HB2 1 74 MET ME . . 2.620 2.326 2.201 2.510 . 0 0 "[ . 1 . 2]" 1
1351 1 74 MET HB2 1 75 GLU H . . 4.060 3.997 3.822 4.123 0.063 19 0 "[ . 1 . 2]" 1
1352 1 74 MET HB3 1 75 GLU H . . 4.120 2.741 2.539 2.980 . 0 0 "[ . 1 . 2]" 1
1353 1 74 MET HB3 1 87 ALA MB . . 5.280 4.755 4.561 5.162 . 0 0 "[ . 1 . 2]" 1
1354 1 74 MET HB3 1 91 ILE MD . . 5.190 3.831 3.445 4.218 . 0 0 "[ . 1 . 2]" 1
1355 1 74 MET ME 1 74 MET HG3 . . 3.450 2.321 2.253 2.620 . 0 0 "[ . 1 . 2]" 1
1356 1 74 MET ME 1 78 LYS HD2 . . 3.920 3.938 3.350 4.023 0.103 13 0 "[ . 1 . 2]" 1
1357 1 74 MET ME 1 78 LYS HD3 . . 3.990 3.889 3.639 4.054 0.064 4 0 "[ . 1 . 2]" 1
1358 1 74 MET ME 1 78 LYS QE . . 4.400 3.404 2.851 4.082 . 0 0 "[ . 1 . 2]" 1
1359 1 74 MET ME 1 87 ALA HA . . 3.430 3.539 3.531 3.548 0.118 2 0 "[ . 1 . 2]" 1
1360 1 74 MET ME 1 87 ALA MB . . 3.210 2.033 1.932 2.138 . 0 0 "[ . 1 . 2]" 1
1361 1 74 MET ME 1 88 GLN H . . 3.750 2.887 2.591 3.178 . 0 0 "[ . 1 . 2]" 1
1362 1 74 MET ME 1 88 GLN HA . . 3.450 2.174 2.052 2.296 . 0 0 "[ . 1 . 2]" 1
1363 1 74 MET ME 1 91 ILE HB . . 3.130 3.098 2.624 3.228 0.098 13 0 "[ . 1 . 2]" 1
1364 1 74 MET ME 1 91 ILE MD . . 3.570 2.265 2.013 2.554 . 0 0 "[ . 1 . 2]" 1
1365 1 74 MET HG2 1 87 ALA MB . . 5.380 3.846 3.427 4.663 . 0 0 "[ . 1 . 2]" 1
1366 1 74 MET HG2 1 91 ILE MD . . 5.010 4.678 4.416 4.977 . 0 0 "[ . 1 . 2]" 1
1367 1 74 MET HG3 1 78 LYS HD3 . . 4.530 2.424 2.117 2.733 . 0 0 "[ . 1 . 2]" 1
1368 1 74 MET HG3 1 87 ALA MB . . 4.980 2.376 2.039 3.254 . 0 0 "[ . 1 . 2]" 1
1369 1 74 MET HG3 1 91 ILE MD . . 4.970 3.752 3.537 4.456 . 0 0 "[ . 1 . 2]" 1
1370 1 75 GLU H 1 75 GLU QB . . 2.910 2.191 1.868 2.614 . 0 0 "[ . 1 . 2]" 1
1371 1 75 GLU H 1 75 GLU HG2 . . 3.830 3.324 2.192 3.926 0.096 16 0 "[ . 1 . 2]" 1
1372 1 75 GLU H 1 75 GLU HG3 . . 3.950 3.472 2.331 4.045 0.095 2 0 "[ . 1 . 2]" 1
1373 1 75 GLU H 1 76 PHE HB3 . . 4.880 5.014 4.877 5.278 0.398 15 0 "[ . 1 . 2]" 1
1374 1 75 GLU HA 1 75 GLU QB . . 2.720 2.498 2.362 2.598 . 0 0 "[ . 1 . 2]" 1
1375 1 75 GLU HA 1 75 GLU HG2 . . 3.310 2.446 2.032 2.820 . 0 0 "[ . 1 . 2]" 1
1376 1 75 GLU HA 1 75 GLU HG3 . . 3.630 3.434 2.856 3.715 0.085 17 0 "[ . 1 . 2]" 1
1377 1 75 GLU HA 1 76 PHE H . . 3.620 3.596 3.557 3.624 0.004 2 0 "[ . 1 . 2]" 1
1378 1 75 GLU HA 1 78 LYS H . . 3.850 3.586 3.393 3.751 . 0 0 "[ . 1 . 2]" 1
1379 1 75 GLU HA 1 78 LYS HB3 . . 4.280 4.330 4.217 4.356 0.076 2 0 "[ . 1 . 2]" 1
1380 1 75 GLU HA 1 78 LYS HD3 . . 4.300 4.286 3.791 4.385 0.085 8 0 "[ . 1 . 2]" 1
1381 1 75 GLU QB 1 75 GLU HG3 . . 2.730 2.188 2.047 2.428 . 0 0 "[ . 1 . 2]" 1
1382 1 75 GLU QB 1 76 PHE H . . 3.220 2.454 2.189 2.835 . 0 0 "[ . 1 . 2]" 1
1383 1 75 GLU QB 1 76 PHE HA . . 4.570 3.846 3.630 4.034 . 0 0 "[ . 1 . 2]" 1
1384 1 75 GLU QB 1 76 PHE QD . . 5.090 5.178 5.023 5.208 0.118 14 0 "[ . 1 . 2]" 1
1385 1 75 GLU QB 1 77 ALA H . . 4.670 4.656 4.514 4.742 0.072 10 0 "[ . 1 . 2]" 1
1386 1 76 PHE H 1 76 PHE HB2 . . 3.230 2.352 2.187 2.491 . 0 0 "[ . 1 . 2]" 1
1387 1 76 PHE H 1 76 PHE HB3 . . 3.170 2.640 2.478 2.795 . 0 0 "[ . 1 . 2]" 1
1388 1 76 PHE H 1 76 PHE QD . . 4.330 4.136 4.090 4.184 . 0 0 "[ . 1 . 2]" 1
1389 1 76 PHE H 1 77 ALA H . . 3.610 2.829 2.554 3.028 . 0 0 "[ . 1 . 2]" 1
1390 1 76 PHE HA 1 76 PHE QD . . 3.530 2.689 2.306 3.222 . 0 0 "[ . 1 . 2]" 1
1391 1 76 PHE HA 1 79 LYS HB2 . . 3.730 3.424 2.504 3.736 0.006 18 0 "[ . 1 . 2]" 1
1392 1 76 PHE HA 1 79 LYS HB3 . . 3.730 2.559 2.347 2.801 . 0 0 "[ . 1 . 2]" 1
1393 1 76 PHE HA 1 79 LYS HD2 . . 4.630 4.095 2.525 4.714 0.084 17 0 "[ . 1 . 2]" 1
1394 1 76 PHE HA 1 79 LYS HD3 . . 4.230 3.162 2.524 4.296 0.066 9 0 "[ . 1 . 2]" 1
1395 1 76 PHE HA 1 79 LYS QE . . 4.090 3.254 1.934 4.181 0.091 15 0 "[ . 1 . 2]" 1
1396 1 76 PHE HA 1 79 LYS HG2 . . 4.660 4.329 3.788 4.622 . 0 0 "[ . 1 . 2]" 1
1397 1 76 PHE HB2 1 77 ALA H . . 4.160 3.765 3.583 3.991 . 0 0 "[ . 1 . 2]" 1
1398 1 76 PHE HB3 1 77 ALA H . . 4.240 2.532 2.404 2.673 . 0 0 "[ . 1 . 2]" 1
1399 1 76 PHE HB3 1 77 ALA MB . . 4.950 3.837 3.664 4.173 . 0 0 "[ . 1 . 2]" 1
1400 1 76 PHE QD 1 77 ALA H . . 4.840 3.725 3.537 4.041 . 0 0 "[ . 1 . 2]" 1
1401 1 76 PHE QD 1 77 ALA HA . . 4.000 3.663 3.069 4.092 0.092 8 0 "[ . 1 . 2]" 1
1402 1 76 PHE QD 1 77 ALA MB . . 4.380 4.039 3.781 4.440 0.060 15 0 "[ . 1 . 2]" 1
1403 1 76 PHE QD 1 79 LYS HG2 . . 5.220 5.209 4.904 5.307 0.087 15 0 "[ . 1 . 2]" 1
1404 1 76 PHE QD 1 80 HIS HE1 . . 5.100 3.169 2.527 3.731 . 0 0 "[ . 1 . 2]" 1
1405 1 76 PHE QE 1 80 HIS HD2 . . 4.880 4.769 3.896 4.974 0.094 2 0 "[ . 1 . 2]" 1
1406 1 76 PHE HZ 1 80 HIS HE1 . . 4.980 3.727 3.076 4.911 . 0 0 "[ . 1 . 2]" 1
1407 1 77 ALA H 1 77 ALA MB . . 3.360 2.190 2.121 2.264 . 0 0 "[ . 1 . 2]" 1
1408 1 77 ALA HA 1 79 LYS HB3 . . 4.920 4.945 4.807 4.987 0.067 17 0 "[ . 1 . 2]" 1
1409 1 77 ALA HA 1 80 HIS H . . 4.100 3.739 3.467 3.905 . 0 0 "[ . 1 . 2]" 1
1410 1 77 ALA HA 1 80 HIS HB2 . . 4.330 3.480 2.851 3.908 . 0 0 "[ . 1 . 2]" 1
1411 1 77 ALA HA 1 82 ALA H . . 4.650 4.187 3.930 4.686 0.036 20 0 "[ . 1 . 2]" 1
1412 1 77 ALA HA 1 82 ALA MB . . 4.320 2.906 2.643 3.158 . 0 0 "[ . 1 . 2]" 1
1413 1 77 ALA MB 1 78 LYS H . . 3.410 2.303 2.160 2.412 . 0 0 "[ . 1 . 2]" 1
1414 1 77 ALA MB 1 78 LYS HB2 . . 4.000 3.976 3.734 4.088 0.088 9 0 "[ . 1 . 2]" 1
1415 1 77 ALA MB 1 78 LYS HD2 . . 3.680 3.582 2.973 3.777 0.097 17 0 "[ . 1 . 2]" 1
1416 1 77 ALA MB 1 78 LYS HD3 . . 3.620 3.308 2.908 3.656 0.036 6 0 "[ . 1 . 2]" 1
1417 1 77 ALA MB 1 82 ALA H . . 4.870 4.191 4.036 4.774 . 0 0 "[ . 1 . 2]" 1
1418 1 77 ALA MB 1 82 ALA MB . . 3.250 2.189 2.036 2.638 . 0 0 "[ . 1 . 2]" 1
1419 1 78 LYS H 1 78 LYS HB2 . . 3.040 2.138 2.081 2.167 . 0 0 "[ . 1 . 2]" 1
1420 1 78 LYS H 1 78 LYS HB3 . . 3.350 3.419 3.396 3.428 0.078 16 0 "[ . 1 . 2]" 1
1421 1 78 LYS H 1 78 LYS HD2 . . 4.530 3.664 3.027 4.050 . 0 0 "[ . 1 . 2]" 1
1422 1 78 LYS H 1 78 LYS HD3 . . 4.410 2.787 2.470 3.192 . 0 0 "[ . 1 . 2]" 1
1423 1 78 LYS H 1 78 LYS HG3 . . 3.800 3.749 2.778 3.884 0.084 8 0 "[ . 1 . 2]" 1
1424 1 78 LYS H 1 79 LYS H . . 3.680 2.694 2.548 2.872 . 0 0 "[ . 1 . 2]" 1
1425 1 78 LYS H 1 79 LYS HB2 . . 4.910 4.942 4.786 4.992 0.082 13 0 "[ . 1 . 2]" 1
1426 1 78 LYS HA 1 78 LYS HD2 . . 4.950 3.544 2.944 4.410 . 0 0 "[ . 1 . 2]" 1
1427 1 78 LYS HA 1 78 LYS HG2 . . 3.670 3.405 2.702 3.595 . 0 0 "[ . 1 . 2]" 1
1428 1 78 LYS HA 1 78 LYS HG3 . . 3.440 2.196 2.071 2.326 . 0 0 "[ . 1 . 2]" 1
1429 1 78 LYS HA 1 81 GLY H . . 4.030 3.401 2.989 3.798 . 0 0 "[ . 1 . 2]" 1
1430 1 78 LYS HA 1 82 ALA H . . 3.250 2.887 2.387 3.320 0.070 18 0 "[ . 1 . 2]" 1
1431 1 78 LYS HA 1 82 ALA MB . . 3.730 2.967 2.433 3.788 0.058 12 0 "[ . 1 . 2]" 1
1432 1 78 LYS HB2 1 79 LYS H . . 4.650 3.114 2.730 3.947 . 0 0 "[ . 1 . 2]" 1
1433 1 78 LYS HD2 1 84 GLU H . . 4.890 4.949 4.865 4.979 0.089 8 0 "[ . 1 . 2]" 1
1434 1 78 LYS HD3 1 84 GLU HA . . 4.510 4.467 4.197 4.590 0.080 3 0 "[ . 1 . 2]" 1
1435 1 78 LYS HD3 1 84 GLU QG . . 4.930 4.778 4.019 5.026 0.096 16 0 "[ . 1 . 2]" 1
1436 1 78 LYS QE 1 84 GLU HA . . 3.950 2.786 1.816 3.925 . 0 0 "[ . 1 . 2]" 1
1437 1 78 LYS QE 1 84 GLU QG . . 4.500 2.382 1.910 3.787 . 0 0 "[ . 1 . 2]" 1
1438 1 78 LYS HG3 1 83 ASP HA . . 4.700 4.754 4.605 4.799 0.099 12 0 "[ . 1 . 2]" 1
1439 1 78 LYS HG3 1 84 GLU H . . 5.500 5.108 4.637 5.499 . 0 0 "[ . 1 . 2]" 1
1440 1 78 LYS HG3 1 84 GLU HA . . 4.780 4.183 3.700 4.677 . 0 0 "[ . 1 . 2]" 1
1441 1 79 LYS H 1 79 LYS HB2 . . 3.280 2.460 2.314 2.697 . 0 0 "[ . 1 . 2]" 1
1442 1 79 LYS H 1 79 LYS HB3 . . 3.440 2.350 2.160 2.626 . 0 0 "[ . 1 . 2]" 1
1443 1 79 LYS H 1 79 LYS HG2 . . 4.740 4.386 4.233 4.594 . 0 0 "[ . 1 . 2]" 1
1444 1 79 LYS H 1 79 LYS HG3 . . 5.080 4.453 4.362 4.561 . 0 0 "[ . 1 . 2]" 1
1445 1 79 LYS H 1 80 HIS H . . 3.440 2.878 2.134 3.146 . 0 0 "[ . 1 . 2]" 1
1446 1 79 LYS HA 1 79 LYS HB2 . . 2.910 2.394 2.342 2.522 . 0 0 "[ . 1 . 2]" 1
1447 1 79 LYS HA 1 79 LYS HD2 . . 4.610 4.557 4.265 4.687 0.077 3 0 "[ . 1 . 2]" 1
1448 1 79 LYS HA 1 79 LYS HD3 . . 4.900 4.498 4.043 4.973 0.073 5 0 "[ . 1 . 2]" 1
1449 1 79 LYS HA 1 79 LYS HG2 . . 3.790 3.357 3.137 3.509 . 0 0 "[ . 1 . 2]" 1
1450 1 79 LYS HA 1 79 LYS HG3 . . 3.420 2.684 2.406 2.865 . 0 0 "[ . 1 . 2]" 1
1451 1 79 LYS HA 1 81 GLY H . . 4.250 4.016 3.584 4.297 0.047 18 0 "[ . 1 . 2]" 1
1452 1 79 LYS HB2 1 79 LYS QE . . 4.380 3.564 2.724 4.194 . 0 0 "[ . 1 . 2]" 1
1453 1 79 LYS HB2 1 80 HIS H . . 3.930 3.968 3.862 4.006 0.076 7 0 "[ . 1 . 2]" 1
1454 1 79 LYS HB3 1 80 HIS H . . 3.570 2.654 2.410 2.997 . 0 0 "[ . 1 . 2]" 1
1455 1 79 LYS HD2 1 80 HIS HE1 . . 5.020 4.461 2.446 5.048 0.028 7 0 "[ . 1 . 2]" 1
1456 1 79 LYS QE 1 79 LYS HG2 . . 3.740 2.531 2.093 3.462 . 0 0 "[ . 1 . 2]" 1
1457 1 79 LYS QE 1 80 HIS HE1 . . 4.030 2.591 1.842 4.109 0.079 2 0 "[ . 1 . 2]" 1
1458 1 79 LYS HG2 1 80 HIS HE1 . . 4.510 3.521 3.191 3.718 . 0 0 "[ . 1 . 2]" 1
1459 1 79 LYS HG3 1 80 HIS HE1 . . 5.150 5.061 4.624 5.229 0.079 20 0 "[ . 1 . 2]" 1
1460 1 80 HIS H 1 80 HIS HB2 . . 3.250 2.331 2.195 2.425 . 0 0 "[ . 1 . 2]" 1
1461 1 80 HIS H 1 80 HIS HB3 . . 3.720 3.569 3.485 3.635 . 0 0 "[ . 1 . 2]" 1
1462 1 80 HIS H 1 80 HIS HD2 . . 5.000 5.059 4.787 5.087 0.087 9 0 "[ . 1 . 2]" 1
1463 1 80 HIS H 1 81 GLY H . . 3.150 2.699 2.448 2.913 . 0 0 "[ . 1 . 2]" 1
1464 1 80 HIS H 1 82 ALA H . . 4.110 3.590 3.338 3.912 . 0 0 "[ . 1 . 2]" 1
1465 1 80 HIS HA 1 80 HIS HE1 . . 4.960 4.989 4.672 5.046 0.086 13 0 "[ . 1 . 2]" 1
1466 1 80 HIS HA 1 81 GLY H . . 3.560 3.395 3.261 3.503 . 0 0 "[ . 1 . 2]" 1
1467 1 80 HIS HB2 1 80 HIS HE1 . . 4.920 4.974 4.853 5.005 0.085 3 0 "[ . 1 . 2]" 1
1468 1 81 GLY H 1 82 ALA H . . 3.040 2.264 1.918 2.494 . 0 0 "[ . 1 . 2]" 1
1469 1 81 GLY H 1 82 ALA MB . . 4.630 4.048 3.727 4.275 . 0 0 "[ . 1 . 2]" 1
1470 1 82 ALA H 1 82 ALA MB . . 3.010 2.261 2.197 2.347 . 0 0 "[ . 1 . 2]" 1
1471 1 82 ALA H 1 83 ASP H . . 4.800 4.623 4.535 4.698 . 0 0 "[ . 1 . 2]" 1
1472 1 82 ALA HA 1 83 ASP H . . 2.650 2.254 2.139 2.466 . 0 0 "[ . 1 . 2]" 1
1473 1 82 ALA HA 1 83 ASP HB2 . . 5.440 5.166 4.786 5.490 0.050 20 0 "[ . 1 . 2]" 1
1474 1 82 ALA HA 1 86 MET HB3 . . 4.480 4.327 3.818 4.537 0.057 6 0 "[ . 1 . 2]" 1
1475 1 82 ALA MB 1 83 ASP H . . 3.540 2.663 2.270 3.156 . 0 0 "[ . 1 . 2]" 1
1476 1 82 ALA MB 1 86 MET H . . 4.890 4.863 4.302 4.983 0.093 13 0 "[ . 1 . 2]" 1
1477 1 82 ALA MB 1 86 MET HB2 . . 4.290 4.324 4.178 4.387 0.097 2 0 "[ . 1 . 2]" 1
1478 1 82 ALA MB 1 86 MET HB3 . . 4.240 3.240 2.841 3.456 . 0 0 "[ . 1 . 2]" 1
1479 1 82 ALA MB 1 86 MET HG2 . . 4.880 2.079 1.971 2.224 . 0 0 "[ . 1 . 2]" 1
1480 1 82 ALA MB 1 86 MET HG3 . . 5.500 3.522 3.321 3.735 . 0 0 "[ . 1 . 2]" 1
1481 1 82 ALA MB 1 87 ALA H . . 3.720 3.430 2.949 3.787 0.067 18 0 "[ . 1 . 2]" 1
1482 1 82 ALA MB 1 87 ALA HA . . 3.850 3.751 3.438 3.951 0.101 18 0 "[ . 1 . 2]" 1
1483 1 83 ASP H 1 83 ASP HB2 . . 3.450 2.949 2.570 3.440 . 0 0 "[ . 1 . 2]" 1
1484 1 83 ASP H 1 83 ASP HB3 . . 3.950 3.583 3.313 3.740 . 0 0 "[ . 1 . 2]" 1
1485 1 83 ASP H 1 84 GLU H . . 4.730 4.623 4.561 4.707 . 0 0 "[ . 1 . 2]" 1
1486 1 83 ASP H 1 86 MET H . . 4.420 4.259 3.810 4.473 0.053 1 0 "[ . 1 . 2]" 1
1487 1 83 ASP H 1 86 MET HB2 . . 3.930 3.718 3.403 3.991 0.061 9 0 "[ . 1 . 2]" 1
1488 1 83 ASP H 1 86 MET HB3 . . 3.190 2.543 2.167 2.895 . 0 0 "[ . 1 . 2]" 1
1489 1 83 ASP HA 1 83 ASP HB2 . . 2.910 2.967 2.798 2.996 0.086 19 0 "[ . 1 . 2]" 1
1490 1 83 ASP HA 1 83 ASP HB3 . . 2.890 2.312 2.195 2.412 . 0 0 "[ . 1 . 2]" 1
1491 1 83 ASP HA 1 84 GLU H . . 2.820 2.387 2.208 2.508 . 0 0 "[ . 1 . 2]" 1
1492 1 83 ASP HA 1 84 GLU HA . . 4.310 4.311 4.230 4.380 0.070 14 0 "[ . 1 . 2]" 1
1493 1 83 ASP HB2 1 84 GLU H . . 3.400 3.206 2.686 3.473 0.073 4 0 "[ . 1 . 2]" 1
1494 1 83 ASP HB2 1 85 THR H . . 4.650 3.280 2.637 3.920 . 0 0 "[ . 1 . 2]" 1
1495 1 83 ASP HB2 1 86 MET H . . 4.680 2.299 1.926 2.774 . 0 0 "[ . 1 . 2]" 1
1496 1 83 ASP HB3 1 84 GLU H . . 2.940 2.691 2.486 2.980 0.040 9 0 "[ . 1 . 2]" 1
1497 1 83 ASP HB3 1 84 GLU HB2 . . 4.470 4.466 4.193 4.552 0.082 15 0 "[ . 1 . 2]" 1
1498 1 83 ASP HB3 1 85 THR H . . 4.200 3.681 2.638 4.258 0.058 9 0 "[ . 1 . 2]" 1
1499 1 84 GLU H 1 84 GLU HB2 . . 2.770 1.996 1.850 2.133 . 0 0 "[ . 1 . 2]" 1
1500 1 84 GLU H 1 84 GLU HB3 . . 2.970 2.942 2.696 3.046 0.076 15 0 "[ . 1 . 2]" 1
1501 1 84 GLU H 1 84 GLU QG . . 3.550 3.552 3.279 3.649 0.099 1 0 "[ . 1 . 2]" 1
1502 1 84 GLU H 1 85 THR H . . 3.250 2.912 2.632 3.313 0.063 7 0 "[ . 1 . 2]" 1
1503 1 84 GLU HA 1 84 GLU HB2 . . 2.770 2.742 2.637 2.841 0.071 10 0 "[ . 1 . 2]" 1
1504 1 84 GLU HA 1 84 GLU HB3 . . 2.980 2.996 2.936 3.052 0.072 3 0 "[ . 1 . 2]" 1
1505 1 84 GLU HA 1 84 GLU QG . . 3.140 2.198 2.046 2.436 . 0 0 "[ . 1 . 2]" 1
1506 1 84 GLU HA 1 86 MET H . . 4.740 4.455 4.191 4.783 0.043 20 0 "[ . 1 . 2]" 1
1507 1 84 GLU HA 1 87 ALA MB . . 3.210 2.946 2.604 3.278 0.068 16 0 "[ . 1 . 2]" 1
1508 1 84 GLU HA 1 88 GLN H . . 4.370 4.161 3.920 4.431 0.061 20 0 "[ . 1 . 2]" 1
1509 1 84 GLU HB2 1 84 GLU QG . . 2.710 2.181 2.103 2.369 . 0 0 "[ . 1 . 2]" 1
1510 1 84 GLU HB2 1 85 THR H . . 3.480 3.388 3.039 3.550 0.070 14 0 "[ . 1 . 2]" 1
1511 1 84 GLU HB3 1 85 THR H . . 3.190 2.503 2.246 2.802 . 0 0 "[ . 1 . 2]" 1
1512 1 84 GLU HB3 1 85 THR HA . . 4.690 4.057 3.831 4.261 . 0 0 "[ . 1 . 2]" 1
1513 1 84 GLU QG 1 85 THR H . . 4.650 4.310 3.917 4.583 . 0 0 "[ . 1 . 2]" 1
1514 1 85 THR H 1 85 THR HB . . 2.790 2.564 2.341 2.822 0.032 19 0 "[ . 1 . 2]" 1
1515 1 85 THR H 1 85 THR MG . . 3.690 3.749 3.680 3.780 0.090 8 0 "[ . 1 . 2]" 1
1516 1 85 THR H 1 86 MET H . . 3.160 2.676 2.531 2.811 . 0 0 "[ . 1 . 2]" 1
1517 1 85 THR H 1 86 MET HB3 . . 4.480 4.536 4.408 4.558 0.078 10 0 "[ . 1 . 2]" 1
1518 1 85 THR HA 1 85 THR MG . . 3.010 2.411 2.317 2.545 . 0 0 "[ . 1 . 2]" 1
1519 1 85 THR HA 1 88 GLN H . . 4.010 3.355 2.915 3.725 . 0 0 "[ . 1 . 2]" 1
1520 1 85 THR HA 1 88 GLN HB2 . . 4.470 3.346 2.716 4.131 . 0 0 "[ . 1 . 2]" 1
1521 1 85 THR HA 1 88 GLN HB3 . . 3.880 2.823 2.412 3.842 . 0 0 "[ . 1 . 2]" 1
1522 1 85 THR HB 1 86 MET H . . 3.060 2.717 2.316 3.118 0.058 3 0 "[ . 1 . 2]" 1
1523 1 85 THR MG 1 86 MET H . . 4.000 3.717 3.380 4.092 0.092 7 0 "[ . 1 . 2]" 1
1524 1 85 THR MG 1 86 MET HA . . 4.750 3.877 3.534 4.313 . 0 0 "[ . 1 . 2]" 1
1525 1 85 THR MG 1 89 GLN HE21 . . 4.760 3.989 2.355 4.864 0.104 4 0 "[ . 1 . 2]" 1
1526 1 85 THR MG 1 89 GLN HE22 . . 4.710 4.530 2.722 4.876 0.166 11 0 "[ . 1 . 2]" 1
1527 1 85 THR MG 1 89 GLN QG . . 4.170 2.880 2.272 3.563 . 0 0 "[ . 1 . 2]" 1
1528 1 86 MET H 1 86 MET HB2 . . 3.240 2.831 2.647 2.951 . 0 0 "[ . 1 . 2]" 1
1529 1 86 MET H 1 86 MET HB3 . . 3.210 2.178 2.057 2.284 . 0 0 "[ . 1 . 2]" 1
1530 1 86 MET H 1 86 MET HG2 . . 4.910 4.146 3.960 4.332 . 0 0 "[ . 1 . 2]" 1
1531 1 86 MET H 1 86 MET HG3 . . 4.400 4.425 4.348 4.471 0.071 16 0 "[ . 1 . 2]" 1
1532 1 86 MET H 1 87 ALA H . . 3.340 2.791 2.492 2.965 . 0 0 "[ . 1 . 2]" 1
1533 1 86 MET HA 1 86 MET HG2 . . 4.230 3.642 3.505 3.822 . 0 0 "[ . 1 . 2]" 1
1534 1 86 MET HA 1 86 MET HG3 . . 3.350 2.784 2.552 3.007 . 0 0 "[ . 1 . 2]" 1
1535 1 86 MET HA 1 87 ALA MB . . 5.340 4.995 4.953 5.046 . 0 0 "[ . 1 . 2]" 1
1536 1 86 MET HA 1 89 GLN HB2 . . 3.280 2.439 2.320 2.630 . 0 0 "[ . 1 . 2]" 1
1537 1 86 MET HA 1 89 GLN HB3 . . 3.790 3.857 3.765 3.876 0.086 12 0 "[ . 1 . 2]" 1
1538 1 86 MET HA 1 127 TRP HH2 . . 3.680 2.138 1.993 2.505 . 0 0 "[ . 1 . 2]" 1
1539 1 86 MET HA 1 127 TRP HZ2 . . 4.920 3.263 2.627 3.818 . 0 0 "[ . 1 . 2]" 1
1540 1 86 MET HA 1 127 TRP HZ3 . . 4.810 4.125 3.441 4.678 . 0 0 "[ . 1 . 2]" 1
1541 1 86 MET HB2 1 87 ALA H . . 4.510 4.039 3.885 4.176 . 0 0 "[ . 1 . 2]" 1
1542 1 86 MET HB3 1 87 ALA H . . 3.900 2.707 2.436 2.926 . 0 0 "[ . 1 . 2]" 1
1543 1 86 MET HB3 1 127 TRP HH2 . . 5.080 4.675 3.996 5.043 . 0 0 "[ . 1 . 2]" 1
1544 1 86 MET HG2 1 87 ALA HA . . 4.980 3.496 2.949 4.212 . 0 0 "[ . 1 . 2]" 1
1545 1 86 MET HG2 1 87 ALA MB . . 4.750 3.452 3.051 4.084 . 0 0 "[ . 1 . 2]" 1
1546 1 86 MET HG2 1 90 LEU QD . . 4.530 2.559 2.319 2.935 . 0 0 "[ . 1 . 2]" 1
1547 1 86 MET HG2 1 127 TRP HH2 . . 5.300 4.628 4.057 5.070 . 0 0 "[ . 1 . 2]" 1
1548 1 86 MET HG3 1 87 ALA MB . . 4.400 4.509 4.495 4.515 0.115 4 0 "[ . 1 . 2]" 1
1549 1 86 MET HG3 1 90 LEU QD . . 5.050 2.181 1.922 2.540 . 0 0 "[ . 1 . 2]" 1
1550 1 86 MET HG3 1 127 TRP HH2 . . 3.740 3.114 2.589 3.774 0.034 2 0 "[ . 1 . 2]" 1
1551 1 86 MET HG3 1 127 TRP HZ2 . . 4.590 4.361 3.635 4.668 0.078 18 0 "[ . 1 . 2]" 1
1552 1 86 MET HG3 1 127 TRP HZ3 . . 4.030 3.328 2.643 4.076 0.046 2 0 "[ . 1 . 2]" 1
1553 1 87 ALA H 1 87 ALA MB . . 3.110 2.167 2.109 2.238 . 0 0 "[ . 1 . 2]" 1
1554 1 87 ALA H 1 88 GLN H . . 3.610 2.762 2.641 2.863 . 0 0 "[ . 1 . 2]" 1
1555 1 87 ALA HA 1 90 LEU H . . 4.090 3.308 3.032 3.520 . 0 0 "[ . 1 . 2]" 1
1556 1 87 ALA HA 1 90 LEU HB2 . . 3.530 2.528 2.103 3.067 . 0 0 "[ . 1 . 2]" 1
1557 1 87 ALA HA 1 90 LEU HB3 . . 4.650 4.136 3.618 4.722 0.072 1 0 "[ . 1 . 2]" 1
1558 1 87 ALA HA 1 90 LEU QD . . 3.480 2.188 1.990 2.468 . 0 0 "[ . 1 . 2]" 1
1559 1 87 ALA HA 1 90 LEU HG . . 4.680 4.095 3.360 4.760 0.080 14 0 "[ . 1 . 2]" 1
1560 1 87 ALA HA 1 91 ILE H . . 4.430 4.243 3.832 4.506 0.076 15 0 "[ . 1 . 2]" 1
1561 1 87 ALA MB 1 88 GLN H . . 3.590 2.807 2.684 2.974 . 0 0 "[ . 1 . 2]" 1
1562 1 87 ALA MB 1 90 LEU QD . . 3.260 3.269 2.890 3.372 0.112 13 0 "[ . 1 . 2]" 1
1563 1 88 GLN H 1 88 GLN HB2 . . 3.230 2.448 2.122 2.665 . 0 0 "[ . 1 . 2]" 1
1564 1 88 GLN H 1 88 GLN HB3 . . 3.260 2.694 2.452 3.323 0.063 2 0 "[ . 1 . 2]" 1
1565 1 88 GLN H 1 88 GLN QG . . 4.020 3.991 3.354 4.104 0.084 18 0 "[ . 1 . 2]" 1
1566 1 88 GLN HA 1 88 GLN HE21 . . 5.010 3.076 2.413 3.939 . 0 0 "[ . 1 . 2]" 1
1567 1 88 GLN HA 1 88 GLN QG . . 3.720 2.773 2.274 3.080 . 0 0 "[ . 1 . 2]" 1
1568 1 88 GLN HA 1 91 ILE H . . 3.590 3.462 3.146 3.651 0.061 12 0 "[ . 1 . 2]" 1
1569 1 88 GLN HA 1 91 ILE HB . . 3.260 3.078 2.670 3.328 0.068 20 0 "[ . 1 . 2]" 1
1570 1 88 GLN HA 1 91 ILE MD . . 3.980 3.700 3.331 4.009 0.029 10 0 "[ . 1 . 2]" 1
1571 1 88 GLN HA 1 91 ILE MG . . 4.910 4.244 3.785 4.624 . 0 0 "[ . 1 . 2]" 1
1572 1 88 GLN HB3 1 89 GLN H . . 3.980 2.715 2.334 3.278 . 0 0 "[ . 1 . 2]" 1
1573 1 88 GLN HB3 1 89 GLN QG . . 4.890 3.952 3.455 4.546 . 0 0 "[ . 1 . 2]" 1
1574 1 88 GLN HE21 1 91 ILE HB . . 5.100 3.792 2.852 5.119 0.019 2 0 "[ . 1 . 2]" 1
1575 1 88 GLN HE21 1 91 ILE MG . . 4.890 3.512 2.701 4.856 . 0 0 "[ . 1 . 2]" 1
1576 1 88 GLN HE21 1 92 ASP H . . 4.920 3.599 2.606 4.456 . 0 0 "[ . 1 . 2]" 1
1577 1 88 GLN HE22 1 91 ILE HB . . 4.660 3.901 3.149 4.743 0.083 12 0 "[ . 1 . 2]" 1
1578 1 88 GLN HE22 1 91 ILE MG . . 4.790 3.210 2.309 4.318 . 0 0 "[ . 1 . 2]" 1
1579 1 88 GLN QG 1 91 ILE MG . . 5.500 4.893 4.038 5.339 . 0 0 "[ . 1 . 2]" 1
1580 1 89 GLN H 1 89 GLN HB2 . . 3.410 2.140 2.055 2.259 . 0 0 "[ . 1 . 2]" 1
1581 1 89 GLN H 1 89 GLN HB3 . . 3.370 3.431 3.384 3.452 0.082 18 0 "[ . 1 . 2]" 1
1582 1 89 GLN H 1 89 GLN QG . . 3.280 2.711 2.296 3.068 . 0 0 "[ . 1 . 2]" 1
1583 1 89 GLN H 1 90 LEU H . . 3.190 2.938 2.714 3.230 0.040 16 0 "[ . 1 . 2]" 1
1584 1 89 GLN HA 1 89 GLN HB3 . . 3.040 2.708 2.609 2.828 . 0 0 "[ . 1 . 2]" 1
1585 1 89 GLN HA 1 89 GLN HE21 . . 4.890 4.479 3.395 4.961 0.071 19 0 "[ . 1 . 2]" 1
1586 1 89 GLN HA 1 89 GLN QG . . 3.480 2.289 2.078 2.537 . 0 0 "[ . 1 . 2]" 1
1587 1 89 GLN HA 1 92 ASP H . . 3.920 3.275 2.889 3.582 . 0 0 "[ . 1 . 2]" 1
1588 1 89 GLN HA 1 92 ASP HB2 . . 3.400 3.250 2.296 3.473 0.073 15 0 "[ . 1 . 2]" 1
1589 1 89 GLN HA 1 92 ASP HB3 . . 3.750 2.752 2.270 3.808 0.058 6 0 "[ . 1 . 2]" 1
1590 1 89 GLN HB2 1 89 GLN HE22 . . 5.500 4.818 3.528 5.345 . 0 0 "[ . 1 . 2]" 1
1591 1 89 GLN HB2 1 90 LEU H . . 2.990 2.771 2.514 3.052 0.062 6 0 "[ . 1 . 2]" 1
1592 1 89 GLN HB2 1 93 ILE MD . . 5.150 4.012 3.622 4.425 . 0 0 "[ . 1 . 2]" 1
1593 1 89 GLN HB2 1 127 TRP HH2 . . 3.610 2.399 2.112 3.074 . 0 0 "[ . 1 . 2]" 1
1594 1 89 GLN HB2 1 127 TRP HZ2 . . 4.920 4.416 4.043 4.991 0.071 11 0 "[ . 1 . 2]" 1
1595 1 89 GLN HB2 1 127 TRP HZ3 . . 4.590 3.927 3.437 4.451 . 0 0 "[ . 1 . 2]" 1
1596 1 89 GLN HB3 1 89 GLN HE22 . . 4.770 4.346 3.718 4.618 . 0 0 "[ . 1 . 2]" 1
1597 1 89 GLN HB3 1 90 LEU H . . 3.880 3.120 2.840 3.459 . 0 0 "[ . 1 . 2]" 1
1598 1 89 GLN HB3 1 90 LEU HB2 . . 5.420 5.383 5.150 5.493 0.073 2 0 "[ . 1 . 2]" 1
1599 1 89 GLN HB3 1 93 ILE MD . . 4.790 2.570 2.203 2.938 . 0 0 "[ . 1 . 2]" 1
1600 1 89 GLN HB3 1 127 TRP HH2 . . 3.890 2.803 2.456 3.902 0.012 11 0 "[ . 1 . 2]" 1
1601 1 89 GLN HB3 1 127 TRP HZ3 . . 4.720 3.519 3.091 4.559 . 0 0 "[ . 1 . 2]" 1
1602 1 89 GLN HE21 1 93 ILE MD . . 4.840 4.372 3.200 4.928 0.088 19 0 "[ . 1 . 2]" 1
1603 1 89 GLN HE21 1 125 LEU MD1 . . 4.970 4.196 3.287 5.062 0.092 7 0 "[ . 1 . 2]" 1
1604 1 89 GLN HE21 1 125 LEU MD2 . . 4.320 3.347 2.521 4.469 0.149 11 0 "[ . 1 . 2]" 1
1605 1 89 GLN HE22 1 89 GLN QG . . 3.580 3.252 3.158 3.414 . 0 0 "[ . 1 . 2]" 1
1606 1 89 GLN HE22 1 93 ILE MD . . 4.790 4.407 3.303 4.897 0.107 12 0 "[ . 1 . 2]" 1
1607 1 89 GLN HE22 1 125 LEU MD1 . . 4.380 3.878 2.962 4.588 0.208 10 0 "[ . 1 . 2]" 1
1608 1 89 GLN HE22 1 125 LEU MD2 . . 4.380 2.777 2.133 4.034 . 0 0 "[ . 1 . 2]" 1
1609 1 89 GLN QG 1 90 LEU H . . 4.950 4.331 4.116 4.490 . 0 0 "[ . 1 . 2]" 1
1610 1 89 GLN QG 1 93 ILE MD . . 4.380 3.540 2.919 4.060 . 0 0 "[ . 1 . 2]" 1
1611 1 89 GLN QG 1 125 LEU MD1 . . 4.890 3.945 3.376 4.379 . 0 0 "[ . 1 . 2]" 1
1612 1 89 GLN QG 1 127 TRP HH2 . . 4.500 3.548 2.437 4.061 . 0 0 "[ . 1 . 2]" 1
1613 1 90 LEU H 1 90 LEU HB2 . . 3.610 2.385 2.163 2.554 . 0 0 "[ . 1 . 2]" 1
1614 1 90 LEU H 1 90 LEU HB3 . . 3.880 3.544 3.443 3.637 . 0 0 "[ . 1 . 2]" 1
1615 1 90 LEU H 1 90 LEU QD . . 3.910 2.566 1.922 3.259 . 0 0 "[ . 1 . 2]" 1
1616 1 90 LEU H 1 90 LEU HG . . 3.670 3.207 2.257 3.773 0.103 4 0 "[ . 1 . 2]" 1
1617 1 90 LEU H 1 127 TRP HH2 . . 4.820 3.992 3.503 4.480 . 0 0 "[ . 1 . 2]" 1
1618 1 90 LEU HA 1 90 LEU QD . . 3.350 2.209 1.989 2.455 . 0 0 "[ . 1 . 2]" 1
1619 1 90 LEU HA 1 93 ILE H . . 4.430 3.905 3.522 4.225 . 0 0 "[ . 1 . 2]" 1
1620 1 90 LEU HA 1 93 ILE HB . . 3.580 3.318 2.723 3.653 0.073 2 0 "[ . 1 . 2]" 1
1621 1 90 LEU HA 1 93 ILE MD . . 3.710 3.073 2.122 3.572 . 0 0 "[ . 1 . 2]" 1
1622 1 90 LEU HA 1 94 VAL HB . . 4.750 4.824 4.804 4.838 0.088 19 0 "[ . 1 . 2]" 1
1623 1 90 LEU HA 1 118 PHE QD . . 4.530 4.024 3.702 4.181 . 0 0 "[ . 1 . 2]" 1
1624 1 90 LEU HA 1 118 PHE QE . . 4.100 2.120 1.965 2.434 . 0 0 "[ . 1 . 2]" 1
1625 1 90 LEU HA 1 127 TRP HZ3 . . 4.920 4.204 3.678 4.993 0.073 11 0 "[ . 1 . 2]" 1
1626 1 90 LEU HB2 1 91 ILE H . . 3.780 2.920 2.510 3.307 . 0 0 "[ . 1 . 2]" 1
1627 1 90 LEU HB2 1 118 PHE QE . . 4.670 4.605 3.974 4.774 0.104 2 0 "[ . 1 . 2]" 1
1628 1 90 LEU HB3 1 90 LEU QD . . 3.050 2.323 2.080 2.643 . 0 0 "[ . 1 . 2]" 1
1629 1 90 LEU HB3 1 91 ILE H . . 3.960 3.682 2.941 4.027 0.067 9 0 "[ . 1 . 2]" 1
1630 1 90 LEU HB3 1 118 PHE QE . . 4.630 3.466 2.521 3.994 . 0 0 "[ . 1 . 2]" 1
1631 1 90 LEU HB3 1 118 PHE HZ . . 4.610 3.715 2.626 4.677 0.067 15 0 "[ . 1 . 2]" 1
1632 1 90 LEU QD 1 91 ILE H . . 4.980 4.129 3.770 4.493 . 0 0 "[ . 1 . 2]" 1
1633 1 90 LEU QD 1 118 PHE QE . . 4.010 2.350 2.072 3.151 . 0 0 "[ . 1 . 2]" 1
1634 1 90 LEU QD 1 118 PHE HZ . . 3.860 2.284 1.961 3.012 . 0 0 "[ . 1 . 2]" 1
1635 1 90 LEU QD 1 127 TRP HE3 . . 4.210 3.060 2.393 4.013 . 0 0 "[ . 1 . 2]" 1
1636 1 90 LEU QD 1 127 TRP HH2 . . 4.780 3.381 2.569 4.433 . 0 0 "[ . 1 . 2]" 1
1637 1 90 LEU QD 1 127 TRP HZ3 . . 3.590 2.200 1.783 3.234 . 0 0 "[ . 1 . 2]" 1
1638 1 90 LEU HG 1 127 TRP HZ3 . . 3.870 3.322 2.249 3.968 0.098 14 0 "[ . 1 . 2]" 1
1639 1 91 ILE H 1 91 ILE HB . . 2.910 2.379 2.263 2.515 . 0 0 "[ . 1 . 2]" 1
1640 1 91 ILE H 1 91 ILE MD . . 4.330 2.707 2.238 4.166 . 0 0 "[ . 1 . 2]" 1
1641 1 91 ILE H 1 91 ILE QG . . 3.760 3.440 2.744 3.650 . 0 0 "[ . 1 . 2]" 1
1642 1 91 ILE H 1 91 ILE MG . . 4.610 3.726 3.644 3.790 . 0 0 "[ . 1 . 2]" 1
1643 1 91 ILE H 1 92 ASP H . . 3.350 2.510 2.185 2.754 . 0 0 "[ . 1 . 2]" 1
1644 1 91 ILE HA 1 91 ILE MD . . 4.110 3.110 2.770 3.654 . 0 0 "[ . 1 . 2]" 1
1645 1 91 ILE HA 1 94 VAL H . . 4.180 3.307 3.143 3.428 . 0 0 "[ . 1 . 2]" 1
1646 1 91 ILE HA 1 94 VAL HB . . 3.530 2.367 2.148 2.581 . 0 0 "[ . 1 . 2]" 1
1647 1 91 ILE HB 1 92 ASP H . . 3.660 3.146 2.847 3.486 . 0 0 "[ . 1 . 2]" 1
1648 1 91 ILE MD 1 91 ILE MG . . 3.980 3.004 2.063 3.263 . 0 0 "[ . 1 . 2]" 1
1649 1 91 ILE QG 1 94 VAL HB . . 3.640 3.638 3.474 3.663 0.023 4 0 "[ . 1 . 2]" 1
1650 1 91 ILE MG 1 92 ASP H . . 4.890 3.292 3.020 3.585 . 0 0 "[ . 1 . 2]" 1
1651 1 91 ILE MG 1 92 ASP HA . . 5.010 3.209 2.826 3.572 . 0 0 "[ . 1 . 2]" 1
1652 1 91 ILE MG 1 95 HIS HA . . 4.270 4.370 4.347 4.382 0.112 5 0 "[ . 1 . 2]" 1
1653 1 91 ILE MG 1 95 HIS HD2 . . 5.470 4.987 4.080 5.436 . 0 0 "[ . 1 . 2]" 1
1654 1 92 ASP H 1 92 ASP HB2 . . 3.480 2.396 2.088 2.635 . 0 0 "[ . 1 . 2]" 1
1655 1 92 ASP H 1 92 ASP HB3 . . 3.720 2.750 2.416 3.491 . 0 0 "[ . 1 . 2]" 1
1656 1 92 ASP H 1 93 ILE H . . 3.610 2.754 2.610 2.977 . 0 0 "[ . 1 . 2]" 1
1657 1 92 ASP HA 1 95 HIS H . . 4.280 4.001 3.709 4.229 . 0 0 "[ . 1 . 2]" 1
1658 1 92 ASP HA 1 95 HIS HB2 . . 4.070 4.109 3.853 4.153 0.083 15 0 "[ . 1 . 2]" 1
1659 1 92 ASP HA 1 95 HIS HB3 . . 3.850 3.059 2.701 3.368 . 0 0 "[ . 1 . 2]" 1
1660 1 92 ASP HA 1 96 GLY H . . 4.860 3.854 3.453 4.293 . 0 0 "[ . 1 . 2]" 1
1661 1 92 ASP HB2 1 93 ILE H . . 4.360 3.758 2.733 4.000 . 0 0 "[ . 1 . 2]" 1
1662 1 92 ASP HB3 1 93 ILE H . . 4.050 2.740 2.461 3.259 . 0 0 "[ . 1 . 2]" 1
1663 1 93 ILE H 1 93 ILE HB . . 2.970 2.423 2.286 2.639 . 0 0 "[ . 1 . 2]" 1
1664 1 93 ILE H 1 93 ILE MD . . 4.110 3.259 2.784 3.408 . 0 0 "[ . 1 . 2]" 1
1665 1 93 ILE H 1 93 ILE HG12 . . 3.650 3.635 3.504 3.686 0.036 1 0 "[ . 1 . 2]" 1
1666 1 93 ILE H 1 93 ILE HG13 . . 3.610 2.250 2.090 2.336 . 0 0 "[ . 1 . 2]" 1
1667 1 93 ILE H 1 93 ILE MG . . 4.270 3.740 3.682 3.782 . 0 0 "[ . 1 . 2]" 1
1668 1 93 ILE H 1 94 VAL MG2 . . 4.960 4.264 3.805 4.553 . 0 0 "[ . 1 . 2]" 1
1669 1 93 ILE H 1 118 PHE QD . . 4.750 4.678 4.422 4.836 0.086 10 0 "[ . 1 . 2]" 1
1670 1 93 ILE H 1 118 PHE QE . . 4.690 4.746 4.310 4.785 0.095 6 0 "[ . 1 . 2]" 1
1671 1 93 ILE HA 1 93 ILE MD . . 4.230 3.963 3.896 4.000 . 0 0 "[ . 1 . 2]" 1
1672 1 93 ILE HA 1 93 ILE HG12 . . 3.610 2.781 2.606 3.180 . 0 0 "[ . 1 . 2]" 1
1673 1 93 ILE HA 1 93 ILE HG13 . . 3.380 2.871 2.724 2.990 . 0 0 "[ . 1 . 2]" 1
1674 1 93 ILE HA 1 93 ILE MG . . 3.090 2.397 2.165 2.505 . 0 0 "[ . 1 . 2]" 1
1675 1 93 ILE HA 1 96 GLY H . . 4.070 3.692 3.272 4.043 . 0 0 "[ . 1 . 2]" 1
1676 1 93 ILE HB 1 93 ILE MD . . 3.620 2.348 2.213 2.464 . 0 0 "[ . 1 . 2]" 1
1677 1 93 ILE HB 1 94 VAL H . . 3.650 2.598 2.394 2.844 . 0 0 "[ . 1 . 2]" 1
1678 1 93 ILE HB 1 94 VAL MG2 . . 5.160 3.226 2.981 3.519 . 0 0 "[ . 1 . 2]" 1
1679 1 93 ILE HB 1 118 PHE HA . . 4.860 4.427 4.224 4.778 . 0 0 "[ . 1 . 2]" 1
1680 1 93 ILE HB 1 118 PHE QD . . 4.250 2.400 2.246 2.644 . 0 0 "[ . 1 . 2]" 1
1681 1 93 ILE HB 1 118 PHE QE . . 4.240 3.088 2.624 3.249 . 0 0 "[ . 1 . 2]" 1
1682 1 93 ILE MD 1 93 ILE MG . . 3.910 2.250 2.141 2.704 . 0 0 "[ . 1 . 2]" 1
1683 1 93 ILE MD 1 118 PHE HA . . 4.640 4.196 3.779 4.705 0.065 14 0 "[ . 1 . 2]" 1
1684 1 93 ILE MD 1 118 PHE QD . . 4.780 3.412 3.106 3.704 . 0 0 "[ . 1 . 2]" 1
1685 1 93 ILE MD 1 121 GLU HG2 . . 5.340 4.147 2.090 4.705 . 0 0 "[ . 1 . 2]" 1
1686 1 93 ILE MD 1 121 GLU HG3 . . 5.430 3.233 2.506 4.164 . 0 0 "[ . 1 . 2]" 1
1687 1 93 ILE MD 1 122 ILE HA . . 4.870 4.741 4.485 4.979 0.109 14 0 "[ . 1 . 2]" 1
1688 1 93 ILE MD 1 127 TRP HH2 . . 5.500 4.435 3.782 5.078 . 0 0 "[ . 1 . 2]" 1
1689 1 93 ILE MD 1 127 TRP HZ3 . . 5.030 3.882 3.237 4.823 . 0 0 "[ . 1 . 2]" 1
1690 1 93 ILE HG13 1 118 PHE QD . . 4.640 4.890 4.723 5.086 0.446 14 0 "[ . 1 . 2]" 1
1691 1 93 ILE MG 1 94 VAL H . . 4.540 3.473 3.189 3.716 . 0 0 "[ . 1 . 2]" 1
1692 1 93 ILE MG 1 94 VAL HA . . 4.870 3.553 3.330 3.700 . 0 0 "[ . 1 . 2]" 1
1693 1 93 ILE MG 1 118 PHE HA . . 3.730 2.209 1.987 2.443 . 0 0 "[ . 1 . 2]" 1
1694 1 93 ILE MG 1 118 PHE HB2 . . 4.740 2.715 2.297 3.071 . 0 0 "[ . 1 . 2]" 1
1695 1 93 ILE MG 1 118 PHE QD . . 3.360 2.068 1.978 2.226 . 0 0 "[ . 1 . 2]" 1
1696 1 93 ILE MG 1 118 PHE QE . . 5.500 3.761 3.522 3.974 . 0 0 "[ . 1 . 2]" 1
1697 1 93 ILE MG 1 121 GLU H . . 5.160 4.175 3.943 4.485 . 0 0 "[ . 1 . 2]" 1
1698 1 93 ILE MG 1 121 GLU HA . . 5.260 4.851 4.665 5.105 . 0 0 "[ . 1 . 2]" 1
1699 1 93 ILE MG 1 121 GLU HB2 . . 3.710 2.597 2.296 3.156 . 0 0 "[ . 1 . 2]" 1
1700 1 93 ILE MG 1 121 GLU HG2 . . 4.170 3.059 1.972 3.524 . 0 0 "[ . 1 . 2]" 1
1701 1 93 ILE MG 1 121 GLU HG3 . . 3.730 2.181 1.927 3.480 . 0 0 "[ . 1 . 2]" 1
1702 1 93 ILE MG 1 122 ILE H . . 5.330 4.704 4.443 5.108 . 0 0 "[ . 1 . 2]" 1
1703 1 94 VAL H 1 94 VAL HB . . 3.500 2.387 2.241 2.525 . 0 0 "[ . 1 . 2]" 1
1704 1 94 VAL H 1 94 VAL MG2 . . 3.520 2.320 2.189 2.442 . 0 0 "[ . 1 . 2]" 1
1705 1 94 VAL H 1 95 HIS H . . 3.770 2.774 2.612 2.890 . 0 0 "[ . 1 . 2]" 1
1706 1 94 VAL H 1 118 PHE QD . . 4.970 3.595 3.340 3.828 . 0 0 "[ . 1 . 2]" 1
1707 1 94 VAL H 1 118 PHE QE . . 5.100 3.942 3.331 4.321 . 0 0 "[ . 1 . 2]" 1
1708 1 94 VAL HA 1 94 VAL MG1 . . 3.580 2.498 2.343 2.607 . 0 0 "[ . 1 . 2]" 1
1709 1 94 VAL HA 1 94 VAL MG2 . . 3.290 2.277 2.220 2.391 . 0 0 "[ . 1 . 2]" 1
1710 1 94 VAL HA 1 118 PHE QD . . 4.660 3.829 3.573 4.143 . 0 0 "[ . 1 . 2]" 1
1711 1 94 VAL HB 1 95 HIS H . . 3.740 2.567 2.239 2.782 . 0 0 "[ . 1 . 2]" 1
1712 1 94 VAL MG1 1 95 HIS H . . 4.730 3.099 2.740 3.375 . 0 0 "[ . 1 . 2]" 1
1713 1 94 VAL MG1 1 95 HIS HA . . 4.110 3.293 3.008 3.583 . 0 0 "[ . 1 . 2]" 1
1714 1 94 VAL MG1 1 97 CYS H . . 4.880 4.716 4.438 4.977 0.097 15 0 "[ . 1 . 2]" 1
1715 1 94 VAL MG1 1 97 CYS HB2 . . 5.060 4.326 3.992 4.672 . 0 0 "[ . 1 . 2]" 1
1716 1 94 VAL MG1 1 98 GLU H . . 4.830 4.074 3.752 4.316 . 0 0 "[ . 1 . 2]" 1
1717 1 94 VAL MG1 1 98 GLU HG2 . . 5.320 3.915 2.641 4.925 . 0 0 "[ . 1 . 2]" 1
1718 1 94 VAL MG1 1 98 GLU HG3 . . 4.760 3.281 2.506 4.844 0.084 16 0 "[ . 1 . 2]" 1
1719 1 94 VAL MG2 1 118 PHE HB2 . . 5.040 3.194 2.768 3.589 . 0 0 "[ . 1 . 2]" 1
1720 1 94 VAL MG2 1 118 PHE QD . . 3.660 2.540 2.313 2.772 . 0 0 "[ . 1 . 2]" 1
1721 1 94 VAL MG2 1 118 PHE QE . . 4.000 2.479 2.283 2.900 . 0 0 "[ . 1 . 2]" 1
1722 1 95 HIS H 1 95 HIS HB2 . . 3.570 2.401 2.226 2.669 . 0 0 "[ . 1 . 2]" 1
1723 1 95 HIS H 1 95 HIS HB3 . . 3.690 2.598 2.419 2.754 . 0 0 "[ . 1 . 2]" 1
1724 1 95 HIS H 1 96 GLY H . . 3.840 2.661 2.544 2.803 . 0 0 "[ . 1 . 2]" 1
1725 1 95 HIS HA 1 95 HIS HD2 . . 3.510 2.423 2.164 3.061 . 0 0 "[ . 1 . 2]" 1
1726 1 95 HIS HA 1 98 GLU HB2 . . 4.580 2.853 2.367 3.268 . 0 0 "[ . 1 . 2]" 1
1727 1 95 HIS HB2 1 96 GLY H . . 4.000 3.829 3.671 4.053 0.053 10 0 "[ . 1 . 2]" 1
1728 1 95 HIS HB3 1 96 GLY H . . 4.030 2.636 2.347 2.925 . 0 0 "[ . 1 . 2]" 1
1729 1 96 GLY H 1 97 CYS H . . 3.620 2.863 2.720 3.090 . 0 0 "[ . 1 . 2]" 1
1730 1 96 GLY HA2 1 97 CYS H . . 3.630 3.445 3.133 3.627 . 0 0 "[ . 1 . 2]" 1
1731 1 97 CYS H 1 97 CYS HB2 . . 3.150 2.416 2.194 2.706 . 0 0 "[ . 1 . 2]" 1
1732 1 97 CYS H 1 97 CYS HB3 . . 3.820 3.605 3.486 3.766 . 0 0 "[ . 1 . 2]" 1
1733 1 97 CYS H 1 98 GLU H . . 3.560 2.443 1.913 3.036 . 0 0 "[ . 1 . 2]" 1
1734 1 97 CYS H 1 114 VAL MG1 . . 4.680 3.795 3.551 4.266 . 0 0 "[ . 1 . 2]" 1
1735 1 97 CYS HA 1 99 LYS H . . 4.440 3.668 3.415 3.930 . 0 0 "[ . 1 . 2]" 1
1736 1 97 CYS HA 1 100 SER H . . 3.370 3.246 2.982 3.450 0.080 12 0 "[ . 1 . 2]" 1
1737 1 97 CYS HA 1 100 SER HB2 . . 3.110 2.420 1.948 3.194 0.084 7 0 "[ . 1 . 2]" 1
1738 1 97 CYS HA 1 100 SER HB3 . . 3.000 3.015 2.312 3.199 0.199 11 0 "[ . 1 . 2]" 1
1739 1 97 CYS HA 1 101 THR H . . 3.330 2.610 2.304 3.132 . 0 0 "[ . 1 . 2]" 1
1740 1 97 CYS HA 1 101 THR HA . . 4.670 4.474 4.333 4.720 0.050 2 0 "[ . 1 . 2]" 1
1741 1 97 CYS HA 1 101 THR HB . . 3.550 3.624 3.594 3.643 0.093 4 0 "[ . 1 . 2]" 1
1742 1 97 CYS HA 1 101 THR MG . . 4.620 4.713 4.636 4.736 0.116 13 0 "[ . 1 . 2]" 1
1743 1 97 CYS HA 1 114 VAL HA . . 4.590 4.543 3.840 4.663 0.073 9 0 "[ . 1 . 2]" 1
1744 1 97 CYS HA 1 114 VAL MG1 . . 4.240 4.282 4.100 4.332 0.092 15 0 "[ . 1 . 2]" 1
1745 1 97 CYS HA 1 114 VAL MG2 . . 4.280 4.026 3.847 4.206 . 0 0 "[ . 1 . 2]" 1
1746 1 97 CYS HB2 1 98 GLU H . . 4.050 3.074 2.689 3.343 . 0 0 "[ . 1 . 2]" 1
1747 1 97 CYS HB2 1 114 VAL MG1 . . 4.110 2.216 2.106 2.576 . 0 0 "[ . 1 . 2]" 1
1748 1 97 CYS HB3 1 114 VAL MG1 . . 3.960 2.453 2.201 2.672 . 0 0 "[ . 1 . 2]" 1
1749 1 97 CYS HB3 1 114 VAL MG2 . . 5.040 2.554 2.370 3.046 . 0 0 "[ . 1 . 2]" 1
1750 1 98 GLU H 1 98 GLU HB2 . . 3.670 2.344 2.056 2.524 . 0 0 "[ . 1 . 2]" 1
1751 1 98 GLU H 1 98 GLU HG3 . . 3.660 3.027 2.402 3.748 0.088 20 0 "[ . 1 . 2]" 1
1752 1 98 GLU H 1 99 LYS H . . 3.580 3.030 2.874 3.226 . 0 0 "[ . 1 . 2]" 1
1753 1 98 GLU H 1 114 VAL MG1 . . 4.740 2.951 2.507 3.370 . 0 0 "[ . 1 . 2]" 1
1754 1 98 GLU HA 1 110 TRP HH2 . . 4.730 4.645 4.051 4.804 0.074 16 0 "[ . 1 . 2]" 1
1755 1 98 GLU HA 1 110 TRP HZ2 . . 3.790 2.758 2.316 3.069 . 0 0 "[ . 1 . 2]" 1
1756 1 98 GLU HA 1 114 VAL MG1 . . 4.580 3.080 2.484 3.466 . 0 0 "[ . 1 . 2]" 1
1757 1 98 GLU HA 1 114 VAL MG2 . . 3.570 2.183 2.058 2.366 . 0 0 "[ . 1 . 2]" 1
1758 1 98 GLU HB2 1 99 LYS H . . 4.050 3.341 3.040 3.663 . 0 0 "[ . 1 . 2]" 1
1759 1 98 GLU HB2 1 99 LYS QD . . 3.080 2.750 2.286 3.169 0.089 17 0 "[ . 1 . 2]" 1
1760 1 98 GLU HB2 1 110 TRP HZ2 . . 4.600 4.019 3.704 4.438 . 0 0 "[ . 1 . 2]" 1
1761 1 98 GLU HB3 1 110 TRP HH2 . . 4.730 4.064 3.155 4.719 . 0 0 "[ . 1 . 2]" 1
1762 1 98 GLU HB3 1 110 TRP HZ2 . . 4.070 2.499 2.122 3.174 . 0 0 "[ . 1 . 2]" 1
1763 1 98 GLU HG2 1 110 TRP HH2 . . 4.250 3.457 2.605 5.135 0.885 6 1 "[ .+ 1 . 2]" 1
1764 1 98 GLU HG2 1 110 TRP HZ2 . . 4.930 2.918 2.367 4.304 . 0 0 "[ . 1 . 2]" 1
1765 1 98 GLU HG2 1 114 VAL MG1 . . 5.410 3.091 2.143 4.327 . 0 0 "[ . 1 . 2]" 1
1766 1 98 GLU HG2 1 114 VAL MG2 . . 4.920 3.279 2.341 4.602 . 0 0 "[ . 1 . 2]" 1
1767 1 98 GLU HG3 1 110 TRP HH2 . . 5.210 4.319 2.966 5.201 . 0 0 "[ . 1 . 2]" 1
1768 1 98 GLU HG3 1 110 TRP HZ2 . . 5.120 3.709 2.229 4.540 . 0 0 "[ . 1 . 2]" 1
1769 1 98 GLU HG3 1 114 VAL MG1 . . 5.400 3.054 2.151 3.827 . 0 0 "[ . 1 . 2]" 1
1770 1 99 LYS H 1 99 LYS QB . . 3.090 2.942 2.521 3.188 0.098 10 0 "[ . 1 . 2]" 1
1771 1 99 LYS H 1 99 LYS QG . . 3.870 3.218 2.406 3.908 0.038 5 0 "[ . 1 . 2]" 1
1772 1 99 LYS H 1 100 SER H . . 3.310 1.939 1.779 2.227 . 0 0 "[ . 1 . 2]" 1
1773 1 99 LYS H 1 101 THR H . . 3.960 3.444 3.187 3.711 . 0 0 "[ . 1 . 2]" 1
1774 1 99 LYS H 1 101 THR HB . . 4.600 4.670 4.559 4.688 0.088 19 0 "[ . 1 . 2]" 1
1775 1 99 LYS HA 1 99 LYS QD . . 3.840 3.591 3.207 3.901 0.061 4 0 "[ . 1 . 2]" 1
1776 1 99 LYS HA 1 99 LYS QG . . 4.000 2.965 2.281 3.609 . 0 0 "[ . 1 . 2]" 1
1777 1 99 LYS QB 1 100 SER H . . 3.440 3.089 2.320 3.539 0.099 2 0 "[ . 1 . 2]" 1
1778 1 99 LYS QB 1 100 SER HA . . 4.430 4.165 3.598 4.522 0.092 2 0 "[ . 1 . 2]" 1
1779 1 100 SER H 1 100 SER HB2 . . 3.360 2.101 1.900 2.487 . 0 0 "[ . 1 . 2]" 1
1780 1 100 SER H 1 100 SER HB3 . . 3.570 3.286 2.693 3.447 . 0 0 "[ . 1 . 2]" 1
1781 1 100 SER H 1 101 THR H . . 2.940 2.812 2.215 3.008 0.068 6 0 "[ . 1 . 2]" 1
1782 1 100 SER HA 1 100 SER HB2 . . 2.870 2.901 2.621 2.991 0.121 2 0 "[ . 1 . 2]" 1
1783 1 100 SER HA 1 100 SER HB3 . . 2.910 2.762 2.605 2.989 0.079 7 0 "[ . 1 . 2]" 1
1784 1 100 SER HB2 1 101 THR H . . 4.530 3.081 2.504 3.775 . 0 0 "[ . 1 . 2]" 1
1785 1 100 SER HB3 1 101 THR H . . 4.450 3.287 2.426 3.955 . 0 0 "[ . 1 . 2]" 1
1786 1 101 THR H 1 101 THR HB . . 2.720 2.202 2.099 2.409 . 0 0 "[ . 1 . 2]" 1
1787 1 101 THR H 1 101 THR MG . . 3.960 3.649 3.595 3.740 . 0 0 "[ . 1 . 2]" 1
1788 1 101 THR H 1 102 PRO HD3 . . 4.610 4.592 4.410 4.687 0.077 15 0 "[ . 1 . 2]" 1
1789 1 101 THR H 1 110 TRP HE1 . . 4.860 4.761 4.333 4.930 0.070 11 0 "[ . 1 . 2]" 1
1790 1 101 THR H 1 114 VAL MG2 . . 4.570 3.905 3.661 4.301 . 0 0 "[ . 1 . 2]" 1
1791 1 101 THR HA 1 101 THR MG . . 3.300 2.548 2.439 2.652 . 0 0 "[ . 1 . 2]" 1
1792 1 101 THR HA 1 102 PRO HD2 . . 2.880 2.275 2.144 2.640 . 0 0 "[ . 1 . 2]" 1
1793 1 101 THR HA 1 102 PRO HD3 . . 2.750 2.286 2.087 2.399 . 0 0 "[ . 1 . 2]" 1
1794 1 101 THR HA 1 102 PRO HG2 . . 4.730 4.432 4.350 4.594 . 0 0 "[ . 1 . 2]" 1
1795 1 101 THR HA 1 102 PRO HG3 . . 4.370 4.420 4.242 4.446 0.076 14 0 "[ . 1 . 2]" 1
1796 1 101 THR HB 1 110 TRP HD1 . . 4.100 4.093 3.845 4.179 0.079 4 0 "[ . 1 . 2]" 1
1797 1 101 THR HB 1 110 TRP HE1 . . 4.000 3.961 3.562 4.067 0.067 20 0 "[ . 1 . 2]" 1
1798 1 101 THR HB 1 114 VAL MG2 . . 3.860 2.544 2.337 2.879 . 0 0 "[ . 1 . 2]" 1
1799 1 101 THR MG 1 102 PRO HB3 . . 5.440 5.275 5.109 5.512 0.072 19 0 "[ . 1 . 2]" 1
1800 1 101 THR MG 1 102 PRO HD2 . . 3.420 2.701 2.555 3.013 . 0 0 "[ . 1 . 2]" 1
1801 1 101 THR MG 1 102 PRO HD3 . . 3.780 3.838 3.718 3.875 0.095 17 0 "[ . 1 . 2]" 1
1802 1 101 THR MG 1 102 PRO HG2 . . 5.070 4.229 3.897 4.973 . 0 0 "[ . 1 . 2]" 1
1803 1 101 THR MG 1 102 PRO HG3 . . 5.130 5.015 4.843 5.214 0.084 19 0 "[ . 1 . 2]" 1
1804 1 101 THR MG 1 103 ALA HA . . 4.870 4.400 4.015 4.824 . 0 0 "[ . 1 . 2]" 1
1805 1 101 THR MG 1 103 ALA MB . . 3.720 2.912 2.502 3.429 . 0 0 "[ . 1 . 2]" 1
1806 1 101 THR MG 1 110 TRP HA . . 3.700 3.450 3.194 3.759 0.059 16 0 "[ . 1 . 2]" 1
1807 1 101 THR MG 1 110 TRP HD1 . . 3.270 3.231 2.899 3.363 0.093 2 0 "[ . 1 . 2]" 1
1808 1 101 THR MG 1 110 TRP HE1 . . 4.430 4.370 4.039 4.495 0.065 2 0 "[ . 1 . 2]" 1
1809 1 101 THR MG 1 113 GLY H . . 4.500 3.771 3.410 4.290 . 0 0 "[ . 1 . 2]" 1
1810 1 101 THR MG 1 113 GLY QA . . 3.380 2.233 2.005 2.579 . 0 0 "[ . 1 . 2]" 1
1811 1 101 THR MG 1 114 VAL H . . 3.960 2.797 2.388 3.361 . 0 0 "[ . 1 . 2]" 1
1812 1 101 THR MG 1 114 VAL HA . . 4.990 3.166 2.950 3.487 . 0 0 "[ . 1 . 2]" 1
1813 1 101 THR MG 1 114 VAL MG2 . . 3.860 2.664 2.257 3.170 . 0 0 "[ . 1 . 2]" 1
1814 1 102 PRO HA 1 103 ALA H . . 2.400 2.197 2.109 2.326 . 0 0 "[ . 1 . 2]" 1
1815 1 102 PRO HA 1 103 ALA HA . . 4.390 4.459 4.446 4.472 0.082 5 0 "[ . 1 . 2]" 1
1816 1 102 PRO HA 1 103 ALA MB . . 3.970 3.956 3.742 4.043 0.073 8 0 "[ . 1 . 2]" 1
1817 1 102 PRO HB2 1 103 ALA H . . 3.420 3.328 2.966 3.481 0.061 12 0 "[ . 1 . 2]" 1
1818 1 102 PRO HB3 1 103 ALA H . . 3.930 3.904 3.538 4.005 0.075 20 0 "[ . 1 . 2]" 1
1819 1 103 ALA H 1 103 ALA MB . . 2.680 2.711 2.570 2.769 0.089 19 0 "[ . 1 . 2]" 1
1820 1 103 ALA H 1 104 ASN HA . . 4.840 4.728 4.435 4.907 0.067 14 0 "[ . 1 . 2]" 1
1821 1 103 ALA H 1 110 TRP HD1 . . 4.850 4.494 4.105 4.884 0.034 9 0 "[ . 1 . 2]" 1
1822 1 103 ALA HA 1 104 ASN H . . 2.510 2.500 2.335 2.594 0.084 5 0 "[ . 1 . 2]" 1
1823 1 103 ALA MB 1 104 ASN H . . 3.290 2.199 1.868 2.604 . 0 0 "[ . 1 . 2]" 1
1824 1 103 ALA MB 1 104 ASN HA . . 4.650 4.083 3.633 4.429 . 0 0 "[ . 1 . 2]" 1
1825 1 103 ALA MB 1 109 ILE MD . . 5.340 5.045 4.611 5.437 0.097 9 0 "[ . 1 . 2]" 1
1826 1 103 ALA MB 1 109 ILE MG . . 4.920 2.474 2.146 2.936 . 0 0 "[ . 1 . 2]" 1
1827 1 103 ALA MB 1 110 TRP HD1 . . 4.640 2.247 2.044 2.513 . 0 0 "[ . 1 . 2]" 1
1828 1 104 ASN H 1 104 ASN HB3 . . 3.490 3.473 2.811 3.858 0.368 16 0 "[ . 1 . 2]" 1
1829 1 104 ASN H 1 104 ASN HD21 . . 3.680 2.725 2.012 3.751 0.071 14 0 "[ . 1 . 2]" 1
1830 1 104 ASN H 1 104 ASN HD22 . . 3.900 3.321 2.631 3.968 0.068 12 0 "[ . 1 . 2]" 1
1831 1 104 ASN H 1 105 ASP H . . 4.720 4.478 4.271 4.630 . 0 0 "[ . 1 . 2]" 1
1832 1 104 ASN HA 1 104 ASN HD21 . . 4.410 4.167 3.764 4.484 0.074 12 0 "[ . 1 . 2]" 1
1833 1 104 ASN HA 1 104 ASN HD22 . . 4.780 4.858 4.789 4.885 0.105 15 0 "[ . 1 . 2]" 1
1834 1 104 ASN HA 1 105 ASP H . . 2.820 2.551 2.341 2.757 . 0 0 "[ . 1 . 2]" 1
1835 1 104 ASN HA 1 105 ASP HB2 . . 4.690 4.484 4.217 4.768 0.078 7 0 "[ . 1 . 2]" 1
1836 1 104 ASN HA 1 106 ASP H . . 4.220 3.995 3.692 4.272 0.052 18 0 "[ . 1 . 2]" 1
1837 1 104 ASN HA 1 106 ASP HB2 . . 5.500 5.555 5.291 5.602 0.102 9 0 "[ . 1 . 2]" 1
1838 1 104 ASN HB2 1 105 ASP H . . 4.570 2.583 2.252 3.403 . 0 0 "[ . 1 . 2]" 1
1839 1 104 ASN HB2 1 106 ASP H . . 3.900 2.525 1.660 3.815 . 0 0 "[ . 1 . 2]" 1
1840 1 104 ASN HB3 1 104 ASN HD21 . . 3.100 3.122 2.441 3.637 0.537 2 4 "[ + . * 1- * . 2]" 1
1841 1 104 ASN HB3 1 104 ASN HD22 . . 3.580 3.861 3.537 4.115 0.535 19 1 "[ . 1 . +2]" 1
1842 1 104 ASN HB3 1 105 ASP H . . 4.480 2.984 2.201 3.841 . 0 0 "[ . 1 . 2]" 1
1843 1 104 ASN HB3 1 106 ASP H . . 4.320 3.684 2.058 4.408 0.088 3 0 "[ . 1 . 2]" 1
1844 1 104 ASN HB3 1 109 ILE MG . . 5.000 4.814 3.903 5.401 0.401 1 0 "[ . 1 . 2]" 1
1845 1 104 ASN HD21 1 109 ILE H . . 5.090 4.843 4.304 5.175 0.085 3 0 "[ . 1 . 2]" 1
1846 1 104 ASN HD21 1 109 ILE HB . . 4.970 2.910 2.385 3.497 . 0 0 "[ . 1 . 2]" 1
1847 1 104 ASN HD21 1 109 ILE MD . . 4.980 3.701 2.736 4.627 . 0 0 "[ . 1 . 2]" 1
1848 1 104 ASN HD21 1 109 ILE MG . . 3.570 2.545 1.990 3.213 . 0 0 "[ . 1 . 2]" 1
1849 1 104 ASN HD22 1 106 ASP H . . 4.710 4.114 2.790 4.805 0.095 14 0 "[ . 1 . 2]" 1
1850 1 104 ASN HD22 1 106 ASP HB3 . . 4.990 3.529 2.165 5.038 0.048 16 0 "[ . 1 . 2]" 1
1851 1 104 ASN HD22 1 109 ILE HB . . 4.480 3.290 2.105 4.433 . 0 0 "[ . 1 . 2]" 1
1852 1 104 ASN HD22 1 109 ILE MD . . 4.470 3.245 2.412 4.033 . 0 0 "[ . 1 . 2]" 1
1853 1 104 ASN HD22 1 109 ILE MG . . 3.530 2.392 1.769 3.096 . 0 0 "[ . 1 . 2]" 1
1854 1 105 ASP H 1 105 ASP HB2 . . 2.840 2.087 1.951 2.356 . 0 0 "[ . 1 . 2]" 1
1855 1 105 ASP H 1 105 ASP HB3 . . 3.200 3.006 2.487 3.285 0.085 5 0 "[ . 1 . 2]" 1
1856 1 105 ASP H 1 106 ASP H . . 2.890 2.808 2.527 2.949 0.059 3 0 "[ . 1 . 2]" 1
1857 1 105 ASP HA 1 105 ASP HB3 . . 2.840 2.904 2.777 2.938 0.098 15 0 "[ . 1 . 2]" 1
1858 1 105 ASP HA 1 106 ASP H . . 3.560 3.377 3.142 3.607 0.047 12 0 "[ . 1 . 2]" 1
1859 1 105 ASP HA 1 107 LYS H . . 4.640 4.622 4.280 4.719 0.079 5 0 "[ . 1 . 2]" 1
1860 1 105 ASP HB2 1 106 ASP H . . 4.030 3.928 3.149 4.121 0.091 10 0 "[ . 1 . 2]" 1
1861 1 105 ASP HB3 1 106 ASP H . . 4.040 3.568 3.110 3.877 . 0 0 "[ . 1 . 2]" 1
1862 1 106 ASP H 1 106 ASP HB2 . . 2.980 2.275 2.037 2.612 . 0 0 "[ . 1 . 2]" 1
1863 1 106 ASP H 1 106 ASP HB3 . . 3.210 2.875 2.357 3.305 0.095 3 0 "[ . 1 . 2]" 1
1864 1 106 ASP H 1 107 LYS H . . 4.090 4.135 4.082 4.173 0.083 14 0 "[ . 1 . 2]" 1
1865 1 106 ASP H 1 109 ILE H . . 5.120 4.924 4.549 5.170 0.050 19 0 "[ . 1 . 2]" 1
1866 1 106 ASP H 1 109 ILE HB . . 4.120 3.999 3.773 4.142 0.022 19 0 "[ . 1 . 2]" 1
1867 1 106 ASP H 1 109 ILE MG . . 4.620 4.706 4.569 4.725 0.105 2 0 "[ . 1 . 2]" 1
1868 1 106 ASP HA 1 107 LYS H . . 2.550 2.300 2.211 2.412 . 0 0 "[ . 1 . 2]" 1
1869 1 106 ASP HA 1 107 LYS HB2 . . 4.670 4.338 3.896 4.676 0.006 12 0 "[ . 1 . 2]" 1
1870 1 106 ASP HA 1 108 CYS H . . 4.010 3.483 3.042 3.962 . 0 0 "[ . 1 . 2]" 1
1871 1 106 ASP HB2 1 107 LYS H . . 4.760 4.705 4.572 4.823 0.063 10 0 "[ . 1 . 2]" 1
1872 1 106 ASP HB2 1 109 ILE H . . 4.570 4.072 3.087 4.654 0.084 8 0 "[ . 1 . 2]" 1
1873 1 106 ASP HB2 1 109 ILE HB . . 3.890 3.420 2.308 3.892 0.002 17 0 "[ . 1 . 2]" 1
1874 1 106 ASP HB2 1 109 ILE MD . . 4.420 4.380 3.360 4.538 0.118 12 0 "[ . 1 . 2]" 1
1875 1 106 ASP HB2 1 109 ILE HG13 . . 4.750 3.241 2.668 4.232 . 0 0 "[ . 1 . 2]" 1
1876 1 106 ASP HB3 1 107 LYS H . . 4.490 4.344 4.062 4.550 0.060 2 0 "[ . 1 . 2]" 1
1877 1 106 ASP HB3 1 109 ILE H . . 3.610 2.572 1.696 3.249 . 0 0 "[ . 1 . 2]" 1
1878 1 106 ASP HB3 1 109 ILE HB . . 3.440 2.196 2.043 2.776 . 0 0 "[ . 1 . 2]" 1
1879 1 106 ASP HB3 1 109 ILE MD . . 4.150 3.789 3.304 4.074 . 0 0 "[ . 1 . 2]" 1
1880 1 106 ASP HB3 1 109 ILE HG13 . . 4.040 2.520 2.172 3.245 . 0 0 "[ . 1 . 2]" 1
1881 1 106 ASP HB3 1 109 ILE MG . . 4.770 3.639 3.363 4.244 . 0 0 "[ . 1 . 2]" 1
1882 1 107 LYS H 1 107 LYS HB2 . . 3.390 2.301 1.908 2.566 . 0 0 "[ . 1 . 2]" 1
1883 1 107 LYS H 1 107 LYS HB3 . . 3.610 3.516 3.220 3.662 0.052 12 0 "[ . 1 . 2]" 1
1884 1 107 LYS H 1 107 LYS HD2 . . 4.890 3.825 2.207 4.961 0.071 4 0 "[ . 1 . 2]" 1
1885 1 107 LYS H 1 107 LYS HD3 . . 5.020 4.158 2.815 4.771 . 0 0 "[ . 1 . 2]" 1
1886 1 107 LYS H 1 107 LYS QG . . 3.780 2.740 2.090 3.464 . 0 0 "[ . 1 . 2]" 1
1887 1 107 LYS H 1 108 CYS H . . 3.200 2.983 2.698 3.263 0.063 8 0 "[ . 1 . 2]" 1
1888 1 107 LYS H 1 109 ILE H . . 4.500 4.547 4.459 4.581 0.081 2 0 "[ . 1 . 2]" 1
1889 1 107 LYS HA 1 107 LYS HD2 . . 3.770 3.169 2.138 3.867 0.097 6 0 "[ . 1 . 2]" 1
1890 1 107 LYS HA 1 107 LYS HD3 . . 3.610 3.296 2.293 3.853 0.243 2 0 "[ . 1 . 2]" 1
1891 1 107 LYS HA 1 107 LYS QE . . 3.770 2.564 1.888 3.319 . 0 0 "[ . 1 . 2]" 1
1892 1 107 LYS HA 1 107 LYS QG . . 3.060 2.458 2.239 2.750 . 0 0 "[ . 1 . 2]" 1
1893 1 107 LYS HA 1 109 ILE H . . 4.880 4.383 4.148 4.590 . 0 0 "[ . 1 . 2]" 1
1894 1 107 LYS HA 1 110 TRP H . . 3.490 3.341 2.999 3.540 0.050 14 0 "[ . 1 . 2]" 1
1895 1 107 LYS HA 1 110 TRP HB2 . . 3.350 3.150 2.838 3.415 0.065 4 0 "[ . 1 . 2]" 1
1896 1 107 LYS HA 1 110 TRP HB3 . . 3.120 2.132 2.001 2.283 . 0 0 "[ . 1 . 2]" 1
1897 1 107 LYS HA 1 110 TRP HE3 . . 4.040 2.685 2.429 2.889 . 0 0 "[ . 1 . 2]" 1
1898 1 107 LYS HA 1 110 TRP HZ3 . . 5.000 4.846 4.523 5.078 0.078 17 0 "[ . 1 . 2]" 1
1899 1 107 LYS HB2 1 107 LYS HD3 . . 4.270 3.558 2.951 4.297 0.027 19 0 "[ . 1 . 2]" 1
1900 1 107 LYS HB2 1 108 CYS H . . 4.280 3.206 2.956 3.397 . 0 0 "[ . 1 . 2]" 1
1901 1 107 LYS HB2 1 110 TRP HE3 . . 4.630 4.645 4.275 4.723 0.093 17 0 "[ . 1 . 2]" 1
1902 1 107 LYS HB3 1 108 CYS H . . 4.370 3.725 3.296 4.071 . 0 0 "[ . 1 . 2]" 1
1903 1 107 LYS HD2 1 110 TRP HE3 . . 4.160 3.965 2.712 4.890 0.730 11 3 "[ - . * 1+ . 2]" 1
1904 1 107 LYS QE 1 110 TRP HB3 . . 3.350 3.188 2.302 3.473 0.123 17 0 "[ . 1 . 2]" 1
1905 1 107 LYS QE 1 110 TRP HE3 . . 4.860 2.642 1.784 3.580 . 0 0 "[ . 1 . 2]" 1
1906 1 107 LYS QG 1 110 TRP HE3 . . 4.430 3.357 2.149 4.172 . 0 0 "[ . 1 . 2]" 1
1907 1 108 CYS H 1 108 CYS HB2 . . 3.280 2.715 2.585 2.998 . 0 0 "[ . 1 . 2]" 1
1908 1 108 CYS H 1 108 CYS HB3 . . 3.880 3.641 3.592 3.699 . 0 0 "[ . 1 . 2]" 1
1909 1 108 CYS H 1 109 ILE H . . 2.910 2.671 2.484 2.897 . 0 0 "[ . 1 . 2]" 1
1910 1 108 CYS H 1 109 ILE HB . . 4.610 4.667 4.558 4.691 0.081 16 0 "[ . 1 . 2]" 1
1911 1 108 CYS HA 1 111 THR MG . . 5.100 4.734 4.405 5.115 0.015 16 0 "[ . 1 . 2]" 1
1912 1 108 CYS HB2 1 109 ILE H . . 3.570 2.464 2.315 2.773 . 0 0 "[ . 1 . 2]" 1
1913 1 108 CYS HB3 1 109 ILE H . . 4.050 3.676 3.519 4.039 . 0 0 "[ . 1 . 2]" 1
1914 1 109 ILE H 1 109 ILE HB . . 2.890 2.297 2.087 2.450 . 0 0 "[ . 1 . 2]" 1
1915 1 109 ILE H 1 109 ILE MD . . 4.210 3.782 3.372 4.143 . 0 0 "[ . 1 . 2]" 1
1916 1 109 ILE H 1 109 ILE HG12 . . 3.560 2.502 2.062 3.252 . 0 0 "[ . 1 . 2]" 1
1917 1 109 ILE H 1 109 ILE HG13 . . 3.350 3.182 2.430 3.429 0.079 3 0 "[ . 1 . 2]" 1
1918 1 109 ILE H 1 109 ILE MG . . 3.800 3.720 3.606 3.796 . 0 0 "[ . 1 . 2]" 1
1919 1 109 ILE H 1 110 TRP H . . 3.110 2.655 2.476 2.826 . 0 0 "[ . 1 . 2]" 1
1920 1 109 ILE H 1 110 TRP HB3 . . 4.730 4.456 4.258 4.742 0.012 19 0 "[ . 1 . 2]" 1
1921 1 109 ILE HA 1 109 ILE MD . . 3.290 2.566 2.120 3.408 0.118 4 0 "[ . 1 . 2]" 1
1922 1 109 ILE HA 1 109 ILE HG12 . . 3.390 2.609 2.058 2.996 . 0 0 "[ . 1 . 2]" 1
1923 1 109 ILE HA 1 109 ILE HG13 . . 3.580 3.555 3.072 3.674 0.094 20 0 "[ . 1 . 2]" 1
1924 1 109 ILE HA 1 109 ILE MG . . 3.100 2.559 2.437 2.676 . 0 0 "[ . 1 . 2]" 1
1925 1 109 ILE HA 1 112 LEU H . . 3.900 3.618 3.413 3.872 . 0 0 "[ . 1 . 2]" 1
1926 1 109 ILE HA 1 112 LEU HB2 . . 3.280 3.353 2.329 4.133 0.853 1 7 "[+ * * 1*** . - 2]" 1
1927 1 109 ILE HA 1 112 LEU HB3 . . 4.070 2.710 2.260 3.290 . 0 0 "[ . 1 . 2]" 1
1928 1 109 ILE HA 1 112 LEU QD . . 4.160 2.428 1.996 3.013 . 0 0 "[ . 1 . 2]" 1
1929 1 109 ILE HA 1 112 LEU HG . . 4.830 4.198 3.442 4.899 0.069 10 0 "[ . 1 . 2]" 1
1930 1 109 ILE HA 1 113 GLY H . . 4.480 4.168 3.964 4.424 . 0 0 "[ . 1 . 2]" 1
1931 1 109 ILE HB 1 109 ILE MD . . 3.630 3.163 2.783 3.296 . 0 0 "[ . 1 . 2]" 1
1932 1 109 ILE HB 1 110 TRP H . . 3.260 2.554 2.363 2.753 . 0 0 "[ . 1 . 2]" 1
1933 1 109 ILE HB 1 110 TRP HA . . 4.600 4.483 4.260 4.673 0.073 4 0 "[ . 1 . 2]" 1
1934 1 109 ILE MD 1 112 LEU QD . . 3.910 2.706 2.156 3.569 . 0 0 "[ . 1 . 2]" 1
1935 1 109 ILE HG12 1 109 ILE MG . . 3.590 3.157 2.780 3.265 . 0 0 "[ . 1 . 2]" 1
1936 1 109 ILE HG13 1 109 ILE MG . . 3.730 2.652 2.316 3.226 . 0 0 "[ . 1 . 2]" 1
1937 1 109 ILE MG 1 110 TRP H . . 4.070 3.186 3.004 3.346 . 0 0 "[ . 1 . 2]" 1
1938 1 109 ILE MG 1 110 TRP HA . . 4.200 3.455 3.284 3.687 . 0 0 "[ . 1 . 2]" 1
1939 1 109 ILE MG 1 110 TRP HD1 . . 5.500 5.295 5.098 5.489 . 0 0 "[ . 1 . 2]" 1
1940 1 109 ILE MG 1 113 GLY H . . 5.090 4.132 3.974 4.386 . 0 0 "[ . 1 . 2]" 1
1941 1 110 TRP H 1 110 TRP HB2 . . 3.250 2.355 2.291 2.443 . 0 0 "[ . 1 . 2]" 1
1942 1 110 TRP H 1 110 TRP HB3 . . 3.310 2.333 2.218 2.564 . 0 0 "[ . 1 . 2]" 1
1943 1 110 TRP H 1 110 TRP HD1 . . 4.570 4.658 4.650 4.665 0.095 19 0 "[ . 1 . 2]" 1
1944 1 110 TRP HA 1 110 TRP HD1 . . 3.520 2.535 2.375 2.659 . 0 0 "[ . 1 . 2]" 1
1945 1 110 TRP HA 1 110 TRP HE3 . . 5.040 5.004 4.836 5.117 0.077 9 0 "[ . 1 . 2]" 1
1946 1 110 TRP HA 1 113 GLY H . . 3.960 3.599 3.453 3.846 . 0 0 "[ . 1 . 2]" 1
1947 1 110 TRP HA 1 114 VAL H . . 4.590 4.188 4.025 4.434 . 0 0 "[ . 1 . 2]" 1
1948 1 110 TRP HB2 1 110 TRP HD1 . . 3.660 2.884 2.757 3.002 . 0 0 "[ . 1 . 2]" 1
1949 1 110 TRP HB2 1 110 TRP HE3 . . 3.870 3.873 3.704 3.939 0.069 12 0 "[ . 1 . 2]" 1
1950 1 110 TRP HB3 1 110 TRP HE3 . . 3.400 2.388 2.134 2.470 . 0 0 "[ . 1 . 2]" 1
1951 1 110 TRP HD1 1 114 VAL H . . 5.040 5.030 4.774 5.116 0.076 17 0 "[ . 1 . 2]" 1
1952 1 110 TRP HD1 1 114 VAL MG2 . . 4.940 3.405 3.050 3.697 . 0 0 "[ . 1 . 2]" 1
1953 1 110 TRP HE1 1 114 VAL MG2 . . 5.170 3.074 2.635 3.437 . 0 0 "[ . 1 . 2]" 1
1954 1 110 TRP HE3 1 111 THR H . . 3.630 2.901 2.624 3.050 . 0 0 "[ . 1 . 2]" 1
1955 1 110 TRP HE3 1 111 THR HA . . 4.320 4.151 3.918 4.391 0.071 14 0 "[ . 1 . 2]" 1
1956 1 110 TRP HE3 1 111 THR HB . . 4.230 4.271 4.007 4.315 0.085 11 0 "[ . 1 . 2]" 1
1957 1 110 TRP HE3 1 111 THR MG . . 4.960 4.502 4.188 4.761 . 0 0 "[ . 1 . 2]" 1
1958 1 110 TRP HE3 1 114 VAL MG2 . . 4.660 4.689 4.449 4.757 0.097 17 0 "[ . 1 . 2]" 1
1959 1 110 TRP HH2 1 114 VAL MG1 . . 5.420 5.229 4.609 5.511 0.091 16 0 "[ . 1 . 2]" 1
1960 1 110 TRP HH2 1 114 VAL MG2 . . 4.620 4.587 3.924 4.723 0.103 6 0 "[ . 1 . 2]" 1
1961 1 110 TRP HZ2 1 114 VAL MG1 . . 5.500 4.739 4.298 5.203 . 0 0 "[ . 1 . 2]" 1
1962 1 110 TRP HZ2 1 114 VAL MG2 . . 4.290 3.602 3.210 3.890 . 0 0 "[ . 1 . 2]" 1
1963 1 111 THR H 1 111 THR HB . . 3.130 2.481 2.350 2.595 . 0 0 "[ . 1 . 2]" 1
1964 1 111 THR H 1 111 THR MG . . 4.430 3.717 3.660 3.806 . 0 0 "[ . 1 . 2]" 1
1965 1 111 THR H 1 112 LEU H . . 3.540 2.844 2.729 2.939 . 0 0 "[ . 1 . 2]" 1
1966 1 111 THR HA 1 111 THR MG . . 3.470 2.369 2.278 2.484 . 0 0 "[ . 1 . 2]" 1
1967 1 111 THR HA 1 114 VAL H . . 3.830 3.156 2.928 3.533 . 0 0 "[ . 1 . 2]" 1
1968 1 111 THR HA 1 114 VAL HB . . 3.490 2.374 2.042 2.752 . 0 0 "[ . 1 . 2]" 1
1969 1 111 THR HA 1 114 VAL MG1 . . 5.090 3.791 3.235 4.105 . 0 0 "[ . 1 . 2]" 1
1970 1 111 THR HA 1 114 VAL MG2 . . 4.160 2.815 2.448 3.080 . 0 0 "[ . 1 . 2]" 1
1971 1 111 THR HA 1 115 ALA H . . 4.740 3.909 3.653 4.270 . 0 0 "[ . 1 . 2]" 1
1972 1 111 THR HB 1 112 LEU H . . 3.710 2.958 2.767 3.321 . 0 0 "[ . 1 . 2]" 1
1973 1 111 THR MG 1 112 LEU H . . 4.910 3.761 3.558 3.989 . 0 0 "[ . 1 . 2]" 1
1974 1 111 THR MG 1 112 LEU HA . . 4.380 4.044 3.746 4.229 . 0 0 "[ . 1 . 2]" 1
1975 1 111 THR MG 1 115 ALA H . . 5.190 3.936 3.474 4.387 . 0 0 "[ . 1 . 2]" 1
1976 1 112 LEU H 1 112 LEU HB2 . . 3.570 2.644 2.014 3.103 . 0 0 "[ . 1 . 2]" 1
1977 1 112 LEU H 1 112 LEU HB3 . . 3.470 2.456 1.991 3.247 . 0 0 "[ . 1 . 2]" 1
1978 1 112 LEU H 1 112 LEU QD . . 4.780 3.691 3.530 3.765 . 0 0 "[ . 1 . 2]" 1
1979 1 112 LEU H 1 112 LEU HG . . 3.930 3.941 3.653 4.014 0.084 20 0 "[ . 1 . 2]" 1
1980 1 112 LEU H 1 113 GLY H . . 3.540 2.808 2.642 2.941 . 0 0 "[ . 1 . 2]" 1
1981 1 112 LEU H 1 113 GLY QA . . 4.880 4.646 4.464 4.796 . 0 0 "[ . 1 . 2]" 1
1982 1 112 LEU HA 1 112 LEU HB3 . . 2.870 2.960 2.878 3.009 0.139 8 0 "[ . 1 . 2]" 1
1983 1 112 LEU HA 1 112 LEU QD . . 3.110 2.600 2.141 2.940 . 0 0 "[ . 1 . 2]" 1
1984 1 112 LEU HA 1 112 LEU HG . . 4.160 3.057 2.152 3.681 . 0 0 "[ . 1 . 2]" 1
1985 1 112 LEU HA 1 115 ALA H . . 3.750 3.676 3.412 3.824 0.074 6 0 "[ . 1 . 2]" 1
1986 1 112 LEU HA 1 115 ALA MB . . 3.490 2.935 2.699 3.208 . 0 0 "[ . 1 . 2]" 1
1987 1 112 LEU HB2 1 113 GLY H . . 3.800 3.785 3.066 4.188 0.388 5 0 "[ . 1 . 2]" 1
1988 1 112 LEU HB3 1 113 GLY H . . 4.540 2.728 2.289 3.165 . 0 0 "[ . 1 . 2]" 1
1989 1 112 LEU QD 1 113 GLY H . . 4.820 3.564 3.363 3.933 . 0 0 "[ . 1 . 2]" 1
1990 1 112 LEU QD 1 113 GLY QA . . 5.400 3.538 3.149 3.987 . 0 0 "[ . 1 . 2]" 1
1991 1 112 LEU QD 1 116 THR H . . 4.920 3.973 3.686 4.461 . 0 0 "[ . 1 . 2]" 1
1992 1 112 LEU QD 1 116 THR MG . . 3.910 3.632 3.344 3.929 0.019 4 0 "[ . 1 . 2]" 1
1993 1 112 LEU HG 1 113 GLY H . . 4.900 3.606 2.531 4.962 0.062 9 0 "[ . 1 . 2]" 1
1994 1 113 GLY H 1 113 GLY QA . . 2.780 2.201 2.172 2.245 . 0 0 "[ . 1 . 2]" 1
1995 1 113 GLY H 1 114 VAL H . . 3.070 2.760 2.653 2.876 . 0 0 "[ . 1 . 2]" 1
1996 1 113 GLY H 1 114 VAL MG2 . . 4.890 4.199 4.020 4.368 . 0 0 "[ . 1 . 2]" 1
1997 1 113 GLY H 1 115 ALA H . . 4.780 4.220 3.979 4.423 . 0 0 "[ . 1 . 2]" 1
1998 1 113 GLY QA 1 114 VAL H . . 3.330 2.723 2.606 2.881 . 0 0 "[ . 1 . 2]" 1
1999 1 113 GLY QA 1 115 ALA H . . 4.610 4.073 3.711 4.314 . 0 0 "[ . 1 . 2]" 1
2000 1 113 GLY QA 1 116 THR H . . 4.400 3.176 2.865 3.423 . 0 0 "[ . 1 . 2]" 1
2001 1 113 GLY QA 1 116 THR HB . . 4.130 2.618 2.211 3.025 . 0 0 "[ . 1 . 2]" 1
2002 1 113 GLY QA 1 116 THR MG . . 4.810 3.885 3.546 4.241 . 0 0 "[ . 1 . 2]" 1
2003 1 114 VAL H 1 114 VAL HB . . 3.110 2.486 2.303 2.622 . 0 0 "[ . 1 . 2]" 1
2004 1 114 VAL H 1 114 VAL MG1 . . 4.190 3.782 3.730 3.825 . 0 0 "[ . 1 . 2]" 1
2005 1 114 VAL H 1 114 VAL MG2 . . 3.220 2.122 2.013 2.280 . 0 0 "[ . 1 . 2]" 1
2006 1 114 VAL H 1 115 ALA H . . 3.280 2.828 2.649 2.941 . 0 0 "[ . 1 . 2]" 1
2007 1 114 VAL H 1 115 ALA MB . . 5.030 4.501 4.318 4.621 . 0 0 "[ . 1 . 2]" 1
2008 1 114 VAL H 1 116 THR H . . 4.880 4.159 3.981 4.377 . 0 0 "[ . 1 . 2]" 1
2009 1 114 VAL HA 1 114 VAL MG1 . . 3.640 2.507 2.354 2.680 . 0 0 "[ . 1 . 2]" 1
2010 1 114 VAL HA 1 114 VAL MG2 . . 3.560 2.425 2.344 2.523 . 0 0 "[ . 1 . 2]" 1
2011 1 114 VAL HB 1 115 ALA H . . 3.400 2.793 2.393 3.222 . 0 0 "[ . 1 . 2]" 1
2012 1 114 VAL MG1 1 115 ALA H . . 4.420 3.589 3.025 3.964 . 0 0 "[ . 1 . 2]" 1
2013 1 114 VAL MG1 1 115 ALA HA . . 4.040 3.724 3.208 4.092 0.052 18 0 "[ . 1 . 2]" 1
2014 1 114 VAL MG1 1 118 PHE H . . 5.260 4.494 4.289 4.973 . 0 0 "[ . 1 . 2]" 1
2015 1 114 VAL MG1 1 118 PHE HB2 . . 4.870 3.839 3.514 4.289 . 0 0 "[ . 1 . 2]" 1
2016 1 114 VAL MG2 1 115 ALA H . . 4.600 4.026 3.929 4.177 . 0 0 "[ . 1 . 2]" 1
2017 1 115 ALA H 1 115 ALA MB . . 3.140 2.231 2.176 2.317 . 0 0 "[ . 1 . 2]" 1
2018 1 115 ALA HA 1 118 PHE H . . 3.840 3.752 3.277 3.910 0.070 4 0 "[ . 1 . 2]" 1
2019 1 115 ALA HA 1 118 PHE HB2 . . 3.780 3.757 3.344 3.861 0.081 6 0 "[ . 1 . 2]" 1
2020 1 115 ALA HA 1 118 PHE HB3 . . 3.410 2.428 2.164 2.577 . 0 0 "[ . 1 . 2]" 1
2021 1 115 ALA HA 1 118 PHE QD . . 3.740 3.155 2.595 3.663 . 0 0 "[ . 1 . 2]" 1
2022 1 115 ALA HA 1 119 LYS H . . 4.680 3.807 3.442 4.050 . 0 0 "[ . 1 . 2]" 1
2023 1 115 ALA MB 1 116 THR H . . 4.090 2.721 2.547 3.102 . 0 0 "[ . 1 . 2]" 1
2024 1 115 ALA MB 1 117 CYS H . . 5.110 4.794 4.514 4.960 . 0 0 "[ . 1 . 2]" 1
2025 1 115 ALA MB 1 118 PHE HB2 . . 5.330 5.198 4.766 5.318 . 0 0 "[ . 1 . 2]" 1
2026 1 115 ALA MB 1 118 PHE HB3 . . 5.330 3.980 3.549 4.144 . 0 0 "[ . 1 . 2]" 1
2027 1 115 ALA MB 1 118 PHE QD . . 5.290 3.861 3.400 4.237 . 0 0 "[ . 1 . 2]" 1
2028 1 116 THR H 1 116 THR HB . . 3.340 2.568 2.222 2.906 . 0 0 "[ . 1 . 2]" 1
2029 1 116 THR H 1 116 THR MG . . 3.640 3.720 3.674 3.738 0.098 8 0 "[ . 1 . 2]" 1
2030 1 116 THR H 1 117 CYS H . . 3.460 2.818 2.492 2.992 . 0 0 "[ . 1 . 2]" 1
2031 1 116 THR HA 1 116 THR MG . . 3.150 2.367 2.250 2.601 . 0 0 "[ . 1 . 2]" 1
2032 1 116 THR HA 1 119 LYS H . . 4.050 3.440 3.024 3.943 . 0 0 "[ . 1 . 2]" 1
2033 1 116 THR HA 1 119 LYS HB2 . . 3.770 3.181 2.453 3.725 . 0 0 "[ . 1 . 2]" 1
2034 1 116 THR HA 1 120 ALA H . . 4.600 4.356 4.180 4.585 . 0 0 "[ . 1 . 2]" 1
2035 1 116 THR HB 1 117 CYS H . . 3.570 2.850 2.585 3.499 . 0 0 "[ . 1 . 2]" 1
2036 1 116 THR MG 1 117 CYS H . . 4.140 3.769 3.488 4.203 0.063 14 0 "[ . 1 . 2]" 1
2037 1 116 THR MG 1 119 LYS HB3 . . 4.140 3.816 3.412 4.117 . 0 0 "[ . 1 . 2]" 1
2038 1 116 THR MG 1 120 ALA MB . . 4.290 4.257 3.915 4.403 0.113 3 0 "[ . 1 . 2]" 1
2039 1 117 CYS H 1 117 CYS HB2 . . 3.720 3.642 3.602 3.716 . 0 0 "[ . 1 . 2]" 1
2040 1 117 CYS H 1 117 CYS HB3 . . 3.310 2.785 2.472 3.134 . 0 0 "[ . 1 . 2]" 1
2041 1 117 CYS H 1 118 PHE H . . 3.520 2.609 2.302 2.770 . 0 0 "[ . 1 . 2]" 1
2042 1 117 CYS H 1 119 LYS H . . 4.710 4.192 3.548 4.339 . 0 0 "[ . 1 . 2]" 1
2043 1 117 CYS HA 1 120 ALA H . . 4.060 3.785 3.267 4.119 0.059 8 0 "[ . 1 . 2]" 1
2044 1 117 CYS HA 1 120 ALA MB . . 3.540 3.275 2.933 3.587 0.047 18 0 "[ . 1 . 2]" 1
2045 1 117 CYS HB2 1 118 PHE H . . 3.960 3.464 3.165 3.791 . 0 0 "[ . 1 . 2]" 1
2046 1 117 CYS HB3 1 118 PHE H . . 3.950 3.862 3.626 4.033 0.083 14 0 "[ . 1 . 2]" 1
2047 1 118 PHE H 1 118 PHE HB2 . . 3.370 2.459 2.346 2.573 . 0 0 "[ . 1 . 2]" 1
2048 1 118 PHE H 1 118 PHE HB3 . . 3.350 2.299 2.155 2.609 . 0 0 "[ . 1 . 2]" 1
2049 1 118 PHE H 1 118 PHE QD . . 4.530 4.127 4.033 4.280 . 0 0 "[ . 1 . 2]" 1
2050 1 118 PHE H 1 119 LYS H . . 3.810 2.944 2.833 3.054 . 0 0 "[ . 1 . 2]" 1
2051 1 118 PHE HA 1 118 PHE QD . . 3.670 2.849 2.566 3.153 . 0 0 "[ . 1 . 2]" 1
2052 1 118 PHE HA 1 121 GLU H . . 4.780 3.451 3.296 3.918 . 0 0 "[ . 1 . 2]" 1
2053 1 118 PHE HA 1 121 GLU HB2 . . 4.700 3.140 2.606 4.824 0.124 14 0 "[ . 1 . 2]" 1
2054 1 118 PHE HB2 1 119 LYS H . . 4.280 3.977 3.875 4.283 0.003 14 0 "[ . 1 . 2]" 1
2055 1 118 PHE HB2 1 121 GLU HG3 . . 4.880 5.082 4.804 5.629 0.749 13 4 "[ * . - 1 + . * 2]" 1
2056 1 118 PHE HB3 1 119 LYS H . . 3.780 2.638 2.480 3.230 . 0 0 "[ . 1 . 2]" 1
2057 1 118 PHE QD 1 119 LYS H . . 4.160 3.252 2.842 4.148 . 0 0 "[ . 1 . 2]" 1
2058 1 118 PHE QD 1 121 GLU HG3 . . 5.050 4.494 4.150 5.186 0.136 2 0 "[ . 1 . 2]" 1
2059 1 118 PHE QD 1 122 ILE MD . . 5.250 3.286 2.962 3.829 . 0 0 "[ . 1 . 2]" 1
2060 1 118 PHE QD 1 122 ILE HG12 . . 5.050 3.908 3.476 4.418 . 0 0 "[ . 1 . 2]" 1
2061 1 118 PHE QE 1 119 LYS HA . . 5.060 4.907 4.037 5.150 0.090 14 0 "[ . 1 . 2]" 1
2062 1 118 PHE QE 1 122 ILE MD . . 4.500 2.828 2.652 3.068 . 0 0 "[ . 1 . 2]" 1
2063 1 118 PHE HZ 1 122 ILE MD . . 4.500 2.984 2.581 3.334 . 0 0 "[ . 1 . 2]" 1
2064 1 119 LYS H 1 119 LYS HB2 . . 3.780 2.466 2.312 2.783 . 0 0 "[ . 1 . 2]" 1
2065 1 119 LYS H 1 119 LYS HB3 . . 3.810 2.578 2.198 2.829 . 0 0 "[ . 1 . 2]" 1
2066 1 119 LYS H 1 120 ALA H . . 3.730 3.034 2.792 3.133 . 0 0 "[ . 1 . 2]" 1
2067 1 119 LYS HA 1 119 LYS HG2 . . 3.750 2.863 2.319 3.393 . 0 0 "[ . 1 . 2]" 1
2068 1 119 LYS HA 1 122 ILE H . . 4.250 3.509 3.248 3.970 . 0 0 "[ . 1 . 2]" 1
2069 1 119 LYS HA 1 122 ILE HB . . 4.360 3.257 2.996 3.685 . 0 0 "[ . 1 . 2]" 1
2070 1 119 LYS HA 1 122 ILE MG . . 5.350 4.353 4.151 4.647 . 0 0 "[ . 1 . 2]" 1
2071 1 119 LYS HA 1 123 HIS H . . 4.700 4.388 4.122 4.777 0.077 14 0 "[ . 1 . 2]" 1
2072 1 119 LYS HB2 1 120 ALA H . . 4.080 3.819 3.577 4.097 0.017 6 0 "[ . 1 . 2]" 1
2073 1 119 LYS QE 1 120 ALA H . . 4.790 4.006 2.589 4.706 . 0 0 "[ . 1 . 2]" 1
2074 1 120 ALA H 1 120 ALA MB . . 2.930 2.205 2.106 2.258 . 0 0 "[ . 1 . 2]" 1
2075 1 120 ALA H 1 121 GLU H . . 3.630 2.839 2.579 3.017 . 0 0 "[ . 1 . 2]" 1
2076 1 120 ALA HA 1 123 HIS H . . 4.120 3.469 3.198 3.752 . 0 0 "[ . 1 . 2]" 1
2077 1 120 ALA HA 1 123 HIS QB . . 3.340 2.717 2.370 3.115 . 0 0 "[ . 1 . 2]" 1
2078 1 120 ALA HA 1 123 HIS HD2 . . 3.810 3.527 2.521 3.717 . 0 0 "[ . 1 . 2]" 1
2079 1 120 ALA HA 1 124 LYS H . . 4.390 4.329 4.008 4.468 0.078 13 0 "[ . 1 . 2]" 1
2080 1 120 ALA MB 1 121 GLU H . . 3.590 2.765 2.497 3.236 . 0 0 "[ . 1 . 2]" 1
2081 1 120 ALA MB 1 121 GLU HA . . 4.870 3.993 3.814 4.295 . 0 0 "[ . 1 . 2]" 1
2082 1 120 ALA MB 1 123 HIS QB . . 4.770 3.889 3.505 4.201 . 0 0 "[ . 1 . 2]" 1
2083 1 120 ALA MB 1 123 HIS HD2 . . 5.010 4.967 4.157 5.097 0.087 17 0 "[ . 1 . 2]" 1
2084 1 120 ALA MB 1 124 LYS H . . 4.840 4.657 4.353 4.830 . 0 0 "[ . 1 . 2]" 1
2085 1 120 ALA MB 1 124 LYS QE . . 4.790 3.775 2.447 4.894 0.104 8 0 "[ . 1 . 2]" 1
2086 1 121 GLU H 1 121 GLU HB2 . . 3.640 2.663 2.499 3.500 . 0 0 "[ . 1 . 2]" 1
2087 1 121 GLU H 1 121 GLU HB3 . . 3.670 3.466 2.049 3.641 . 0 0 "[ . 1 . 2]" 1
2088 1 121 GLU H 1 121 GLU HG2 . . 3.800 2.329 1.881 3.853 0.053 13 0 "[ . 1 . 2]" 1
2089 1 121 GLU H 1 121 GLU HG3 . . 4.120 3.335 2.217 3.875 . 0 0 "[ . 1 . 2]" 1
2090 1 121 GLU H 1 124 LYS QD . . 4.470 4.344 3.838 4.570 0.100 17 0 "[ . 1 . 2]" 1
2091 1 121 GLU HA 1 121 GLU HG2 . . 3.950 3.156 2.471 4.186 0.236 13 0 "[ . 1 . 2]" 1
2092 1 121 GLU HA 1 121 GLU HG3 . . 4.220 3.772 3.621 3.894 . 0 0 "[ . 1 . 2]" 1
2093 1 121 GLU HA 1 124 LYS H . . 3.860 3.169 2.702 3.387 . 0 0 "[ . 1 . 2]" 1
2094 1 121 GLU HA 1 124 LYS QB . . 2.860 2.473 2.139 2.932 0.072 13 0 "[ . 1 . 2]" 1
2095 1 121 GLU HA 1 124 LYS QD . . 3.380 2.266 1.982 3.430 0.050 20 0 "[ . 1 . 2]" 1
2096 1 121 GLU HA 1 124 LYS QE . . 4.200 3.630 1.828 4.289 0.089 15 0 "[ . 1 . 2]" 1
2097 1 121 GLU HA 1 125 LEU H . . 4.860 3.928 3.727 4.298 . 0 0 "[ . 1 . 2]" 1
2098 1 121 GLU HB2 1 122 ILE H . . 4.230 2.823 2.538 4.121 . 0 0 "[ . 1 . 2]" 1
2099 1 121 GLU HB3 1 122 ILE H . . 4.160 3.761 3.321 3.968 . 0 0 "[ . 1 . 2]" 1
2100 1 121 GLU HG3 1 122 ILE H . . 4.700 4.558 1.836 5.270 0.570 18 3 "[ * . - 1 . + 2]" 1
2101 1 122 ILE H 1 122 ILE HB . . 3.470 2.756 2.541 2.962 . 0 0 "[ . 1 . 2]" 1
2102 1 122 ILE H 1 122 ILE MD . . 4.500 2.633 2.417 3.243 . 0 0 "[ . 1 . 2]" 1
2103 1 122 ILE H 1 122 ILE HG12 . . 3.580 2.047 1.834 2.299 . 0 0 "[ . 1 . 2]" 1
2104 1 122 ILE H 1 122 ILE MG . . 4.380 3.800 3.736 3.872 . 0 0 "[ . 1 . 2]" 1
2105 1 122 ILE H 1 123 HIS H . . 3.470 2.761 2.590 2.927 . 0 0 "[ . 1 . 2]" 1
2106 1 122 ILE HA 1 122 ILE MD . . 3.350 2.285 2.180 2.399 . 0 0 "[ . 1 . 2]" 1
2107 1 122 ILE HA 1 122 ILE HG12 . . 3.810 3.446 3.065 3.554 . 0 0 "[ . 1 . 2]" 1
2108 1 122 ILE HA 1 122 ILE MG . . 3.650 2.391 2.268 2.612 . 0 0 "[ . 1 . 2]" 1
2109 1 122 ILE HA 1 125 LEU H . . 4.110 3.448 3.266 3.599 . 0 0 "[ . 1 . 2]" 1
2110 1 122 ILE HA 1 125 LEU HB2 . . 3.950 2.491 2.266 2.752 . 0 0 "[ . 1 . 2]" 1
2111 1 122 ILE HA 1 125 LEU HB3 . . 4.820 4.067 3.809 4.346 . 0 0 "[ . 1 . 2]" 1
2112 1 122 ILE HA 1 125 LEU MD1 . . 3.900 2.575 2.184 3.583 . 0 0 "[ . 1 . 2]" 1
2113 1 122 ILE HA 1 125 LEU MD2 . . 5.000 4.859 4.621 5.102 0.102 13 0 "[ . 1 . 2]" 1
2114 1 122 ILE HA 1 127 TRP HB3 . . 4.970 4.549 4.036 5.401 0.431 8 0 "[ . 1 . 2]" 1
2115 1 122 ILE HA 1 127 TRP HE3 . . 4.640 3.485 2.950 4.089 . 0 0 "[ . 1 . 2]" 1
2116 1 122 ILE HB 1 123 HIS H . . 3.860 2.545 2.312 2.782 . 0 0 "[ . 1 . 2]" 1
2117 1 122 ILE HB 1 128 ALA MB . . 5.010 4.009 3.122 5.104 0.094 17 0 "[ . 1 . 2]" 1
2118 1 122 ILE MD 1 122 ILE MG . . 3.320 2.203 2.058 2.388 . 0 0 "[ . 1 . 2]" 1
2119 1 122 ILE MD 1 123 HIS H . . 5.340 4.496 4.337 4.679 . 0 0 "[ . 1 . 2]" 1
2120 1 122 ILE MD 1 125 LEU MD1 . . 4.400 2.707 2.369 3.741 . 0 0 "[ . 1 . 2]" 1
2121 1 122 ILE MD 1 127 TRP HB2 . . 5.040 3.697 3.334 3.938 . 0 0 "[ . 1 . 2]" 1
2122 1 122 ILE MD 1 127 TRP HE3 . . 3.620 2.493 2.003 3.425 . 0 0 "[ . 1 . 2]" 1
2123 1 122 ILE MD 1 127 TRP HZ3 . . 4.460 3.310 2.823 4.419 . 0 0 "[ . 1 . 2]" 1
2124 1 122 ILE HG12 1 123 HIS HD2 . . 4.390 4.457 4.315 4.480 0.090 10 0 "[ . 1 . 2]" 1
2125 1 122 ILE MG 1 123 HIS H . . 4.620 3.688 3.386 3.969 . 0 0 "[ . 1 . 2]" 1
2126 1 122 ILE MG 1 127 TRP H . . 4.740 3.107 2.725 3.424 . 0 0 "[ . 1 . 2]" 1
2127 1 122 ILE MG 1 127 TRP HA . . 3.870 3.964 3.895 3.997 0.127 8 0 "[ . 1 . 2]" 1
2128 1 122 ILE MG 1 127 TRP HB2 . . 4.010 1.978 1.877 2.125 . 0 0 "[ . 1 . 2]" 1
2129 1 122 ILE MG 1 127 TRP HB3 . . 3.650 2.668 2.229 3.401 . 0 0 "[ . 1 . 2]" 1
2130 1 122 ILE MG 1 127 TRP HE3 . . 4.150 2.592 2.169 3.008 . 0 0 "[ . 1 . 2]" 1
2131 1 122 ILE MG 1 127 TRP HZ3 . . 5.330 4.622 4.209 5.021 . 0 0 "[ . 1 . 2]" 1
2132 1 122 ILE MG 1 128 ALA H . . 4.020 3.673 2.966 4.120 0.100 5 0 "[ . 1 . 2]" 1
2133 1 122 ILE MG 1 128 ALA HA . . 5.010 4.123 2.778 5.033 0.023 5 0 "[ . 1 . 2]" 1
2134 1 122 ILE MG 1 128 ALA MB . . 4.220 2.816 2.304 3.436 . 0 0 "[ . 1 . 2]" 1
2135 1 123 HIS H 1 123 HIS QB . . 3.150 2.446 2.317 2.570 . 0 0 "[ . 1 . 2]" 1
2136 1 123 HIS H 1 123 HIS HD2 . . 4.750 2.220 1.959 2.556 . 0 0 "[ . 1 . 2]" 1
2137 1 123 HIS H 1 124 LYS H . . 3.510 2.921 2.742 3.221 . 0 0 "[ . 1 . 2]" 1
2138 1 123 HIS QB 1 124 LYS H . . 3.630 2.670 2.447 3.269 . 0 0 "[ . 1 . 2]" 1
2139 1 123 HIS QB 1 124 LYS HA . . 4.740 4.004 3.871 4.285 . 0 0 "[ . 1 . 2]" 1
2140 1 124 LYS H 1 124 LYS QB . . 2.920 2.303 1.830 2.579 . 0 0 "[ . 1 . 2]" 1
2141 1 124 LYS H 1 124 LYS QD . . 4.380 3.298 2.282 3.973 . 0 0 "[ . 1 . 2]" 1
2142 1 124 LYS H 1 124 LYS HG2 . . 4.040 3.689 3.066 4.128 0.088 20 0 "[ . 1 . 2]" 1
2143 1 124 LYS H 1 124 LYS HG3 . . 3.520 3.027 2.194 4.138 0.618 17 4 "[ * -*1 . + 2]" 1
2144 1 124 LYS H 1 125 LEU H . . 3.430 2.668 2.103 3.027 . 0 0 "[ . 1 . 2]" 1
2145 1 124 LYS HA 1 124 LYS QB . . 2.730 2.361 2.108 2.521 . 0 0 "[ . 1 . 2]" 1
2146 1 124 LYS HA 1 124 LYS HG2 . . 3.410 3.052 2.493 3.608 0.198 5 0 "[ . 1 . 2]" 1
2147 1 124 LYS HA 1 124 LYS HG3 . . 3.510 2.756 2.132 3.295 . 0 0 "[ . 1 . 2]" 1
2148 1 124 LYS HA 1 126 ASN H . . 4.070 3.759 3.579 4.139 0.069 8 0 "[ . 1 . 2]" 1
2149 1 124 LYS QB 1 124 LYS QD . . 2.810 2.249 2.090 2.681 . 0 0 "[ . 1 . 2]" 1
2150 1 124 LYS QB 1 124 LYS QE . . 4.010 3.006 2.062 3.840 . 0 0 "[ . 1 . 2]" 1
2151 1 124 LYS QB 1 125 LEU H . . 2.890 2.625 2.383 2.989 0.099 9 0 "[ . 1 . 2]" 1
2152 1 124 LYS QB 1 125 LEU HA . . 4.520 4.091 3.718 4.630 0.110 17 0 "[ . 1 . 2]" 1
2153 1 124 LYS QB 1 125 LEU MD2 . . 4.710 4.462 3.962 4.831 0.121 17 0 "[ . 1 . 2]" 1
2154 1 124 LYS QB 1 125 LEU HG . . 4.910 3.489 3.082 4.019 . 0 0 "[ . 1 . 2]" 1
2155 1 124 LYS QD 1 124 LYS HG2 . . 2.630 2.356 2.130 2.542 . 0 0 "[ . 1 . 2]" 1
2156 1 124 LYS HG2 1 125 LEU H . . 4.950 4.472 2.143 5.279 0.329 10 0 "[ . 1 . 2]" 1
2157 1 125 LEU H 1 125 LEU HB2 . . 3.310 2.367 2.083 2.526 . 0 0 "[ . 1 . 2]" 1
2158 1 125 LEU H 1 125 LEU HB3 . . 3.810 3.569 3.417 3.629 . 0 0 "[ . 1 . 2]" 1
2159 1 125 LEU H 1 125 LEU MD1 . . 4.630 3.341 3.045 3.544 . 0 0 "[ . 1 . 2]" 1
2160 1 125 LEU H 1 125 LEU MD2 . . 4.320 3.852 3.627 4.181 . 0 0 "[ . 1 . 2]" 1
2161 1 125 LEU H 1 125 LEU HG . . 3.490 2.553 2.240 3.074 . 0 0 "[ . 1 . 2]" 1
2162 1 125 LEU H 1 126 ASN H . . 3.190 2.703 2.479 2.814 . 0 0 "[ . 1 . 2]" 1
2163 1 125 LEU H 1 126 ASN HA . . 5.200 4.842 4.470 4.958 . 0 0 "[ . 1 . 2]" 1
2164 1 125 LEU H 1 127 TRP H . . 4.720 4.017 3.646 4.445 . 0 0 "[ . 1 . 2]" 1
2165 1 125 LEU HA 1 125 LEU MD1 . . 4.440 3.884 3.659 3.978 . 0 0 "[ . 1 . 2]" 1
2166 1 125 LEU HA 1 125 LEU MD2 . . 2.980 2.250 2.131 2.549 . 0 0 "[ . 1 . 2]" 1
2167 1 125 LEU HA 1 125 LEU HG . . 3.630 2.729 2.213 2.957 . 0 0 "[ . 1 . 2]" 1
2168 1 125 LEU HB2 1 126 ASN H . . 4.220 3.409 2.774 3.700 . 0 0 "[ . 1 . 2]" 1
2169 1 125 LEU HB2 1 127 TRP H . . 4.150 3.128 2.721 3.516 . 0 0 "[ . 1 . 2]" 1
2170 1 125 LEU HB2 1 127 TRP HD1 . . 4.920 4.387 3.848 4.874 . 0 0 "[ . 1 . 2]" 1
2171 1 125 LEU HB2 1 127 TRP HE1 . . 4.860 4.847 4.560 4.935 0.075 7 0 "[ . 1 . 2]" 1
2172 1 125 LEU HB3 1 126 ASN H . . 4.730 4.094 3.704 4.252 . 0 0 "[ . 1 . 2]" 1
2173 1 125 LEU HB3 1 127 TRP HD1 . . 4.850 3.530 3.027 4.049 . 0 0 "[ . 1 . 2]" 1
2174 1 125 LEU HB3 1 127 TRP HE1 . . 4.360 3.316 3.103 3.674 . 0 0 "[ . 1 . 2]" 1
2175 1 125 LEU MD1 1 127 TRP HD1 . . 5.500 5.201 4.796 5.593 0.093 2 0 "[ . 1 . 2]" 1
2176 1 125 LEU MD1 1 127 TRP HE3 . . 4.400 3.200 2.864 4.123 . 0 0 "[ . 1 . 2]" 1
2177 1 125 LEU MD1 1 127 TRP HH2 . . 4.550 3.213 2.868 3.920 . 0 0 "[ . 1 . 2]" 1
2178 1 125 LEU MD1 1 127 TRP HZ2 . . 4.370 3.722 3.276 4.058 . 0 0 "[ . 1 . 2]" 1
2179 1 125 LEU MD1 1 127 TRP HZ3 . . 4.510 3.013 2.607 3.899 . 0 0 "[ . 1 . 2]" 1
2180 1 125 LEU MD2 1 126 ASN H . . 5.000 4.982 4.771 5.068 0.068 11 0 "[ . 1 . 2]" 1
2181 1 125 LEU MD2 1 127 TRP HD1 . . 5.500 4.864 4.090 5.436 . 0 0 "[ . 1 . 2]" 1
2182 1 125 LEU MD2 1 127 TRP HE1 . . 4.780 3.710 2.646 4.691 . 0 0 "[ . 1 . 2]" 1
2183 1 125 LEU MD2 1 127 TRP HE3 . . 4.830 4.920 4.893 4.938 0.108 17 0 "[ . 1 . 2]" 1
2184 1 125 LEU MD2 1 127 TRP HH2 . . 5.360 3.778 3.249 4.202 . 0 0 "[ . 1 . 2]" 1
2185 1 125 LEU MD2 1 127 TRP HZ2 . . 4.370 3.078 2.526 3.478 . 0 0 "[ . 1 . 2]" 1
2186 1 126 ASN H 1 126 ASN HA . . 2.670 2.200 2.160 2.238 . 0 0 "[ . 1 . 2]" 1
2187 1 126 ASN H 1 126 ASN HB2 . . 3.720 3.116 3.004 3.318 . 0 0 "[ . 1 . 2]" 1
2188 1 126 ASN H 1 126 ASN HB3 . . 3.850 3.756 3.546 3.915 0.065 19 0 "[ . 1 . 2]" 1
2189 1 126 ASN H 1 127 TRP H . . 3.360 2.582 2.193 2.770 . 0 0 "[ . 1 . 2]" 1
2190 1 126 ASN HA 1 126 ASN HD21 . . 4.850 4.033 2.385 4.503 . 0 0 "[ . 1 . 2]" 1
2191 1 126 ASN HA 1 127 TRP H . . 3.370 2.832 2.545 3.004 . 0 0 "[ . 1 . 2]" 1
2192 1 126 ASN HA 1 128 ALA H . . 3.630 3.192 2.631 3.637 0.007 8 0 "[ . 1 . 2]" 1
2193 1 126 ASN HB2 1 126 ASN HD21 . . 3.530 2.946 2.203 3.576 0.046 6 0 "[ . 1 . 2]" 1
2194 1 126 ASN HB3 1 126 ASN HD21 . . 3.620 2.584 2.196 3.611 . 0 0 "[ . 1 . 2]" 1
2195 1 127 TRP H 1 127 TRP HB2 . . 3.980 2.401 2.160 2.890 . 0 0 "[ . 1 . 2]" 1
2196 1 127 TRP H 1 127 TRP HB3 . . 3.580 3.608 3.453 3.852 0.272 7 0 "[ . 1 . 2]" 1
2197 1 127 TRP H 1 127 TRP HD1 . . 4.220 3.436 3.110 3.714 . 0 0 "[ . 1 . 2]" 1
2198 1 127 TRP HA 1 127 TRP HD1 . . 2.970 2.456 2.174 2.795 . 0 0 "[ . 1 . 2]" 1
2199 1 127 TRP HA 1 128 ALA H . . 3.440 3.052 2.650 3.406 . 0 0 "[ . 1 . 2]" 1
2200 1 127 TRP HB2 1 127 TRP HE3 . . 3.800 2.812 2.511 3.032 . 0 0 "[ . 1 . 2]" 1
2201 1 127 TRP HB3 1 127 TRP HE3 . . 3.680 3.039 2.735 3.579 . 0 0 "[ . 1 . 2]" 1
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