NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
483038 |
1um7   |
11198 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1um7
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 1897
_Distance_constraint_stats_list.Viol_count 1997
_Distance_constraint_stats_list.Viol_total 8011.629
_Distance_constraint_stats_list.Viol_max 1.902
_Distance_constraint_stats_list.Viol_rms 0.0731
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0106
_Distance_constraint_stats_list.Viol_average_violations_only 0.2006
_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 7 GLY 0.529 0.193 17 0 "[ . 1 . 2]"
1 8 ARG 4.032 0.536 12 3 "[ .* * + . 2]"
1 9 PRO 0.127 0.127 2 0 "[ . 1 . 2]"
1 10 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 GLY 2.151 0.515 12 2 "[ . - 1 + . 2]"
1 12 ASP 2.612 0.515 12 2 "[ . - 1 + . 2]"
1 13 ALA 0.560 0.113 8 0 "[ . 1 . 2]"
1 14 ARG 39.299 1.902 13 20 [**-*********+*******]
1 15 GLU 2.638 0.666 8 2 "[ . + 1 . - 2]"
1 16 PRO 6.204 0.630 13 2 "[ . 1 +-. 2]"
1 17 ARG 19.366 0.872 20 8 "[* * * * **- +]"
1 18 LYS 6.507 0.740 18 2 "[ .- 1 . + 2]"
1 19 ILE 16.928 0.796 1 8 "[+ * - * *** *]"
1 20 ILE 5.250 0.733 6 1 "[ .+ 1 . 2]"
1 21 LEU 2.551 0.341 8 0 "[ . 1 . 2]"
1 22 HIS 6.743 0.300 17 0 "[ . 1 . 2]"
1 23 LYS 31.576 0.961 17 19 "[ **************-+***]"
1 24 GLY 1.910 0.418 13 0 "[ . 1 . 2]"
1 25 SER 0.323 0.075 12 0 "[ . 1 . 2]"
1 26 THR 0.374 0.308 18 0 "[ . 1 . 2]"
1 27 GLY 12.165 0.858 18 6 "[ . * 1 - * *+ *]"
1 28 LEU 11.337 0.858 18 6 "[ - . * 1 * *+ *]"
1 29 GLY 1.595 0.497 8 0 "[ . 1 . 2]"
1 30 PHE 14.997 0.522 13 2 "[ . - + . 2]"
1 31 ASN 8.787 0.456 10 0 "[ . 1 . 2]"
1 32 ILE 0.052 0.021 9 0 "[ . 1 . 2]"
1 33 VAL 1.827 0.233 8 0 "[ . 1 . 2]"
1 34 GLY 0.195 0.057 16 0 "[ . 1 . 2]"
1 35 GLY 0.385 0.128 7 0 "[ . 1 . 2]"
1 36 GLU 2.680 0.987 19 1 "[ . 1 . +2]"
1 37 ASP 1.197 0.377 19 0 "[ . 1 . 2]"
1 38 GLY 2.577 0.718 15 1 "[ . 1 + 2]"
1 39 GLU 8.134 0.987 19 6 "[* . * ** . +-]"
1 40 GLY 0.752 0.718 15 1 "[ . 1 + 2]"
1 41 ILE 0.134 0.081 15 0 "[ . 1 . 2]"
1 42 PHE 2.045 0.385 9 0 "[ . 1 . 2]"
1 43 VAL 0.525 0.265 17 0 "[ . 1 . 2]"
1 44 SER 4.625 0.951 6 1 "[ .+ 1 . 2]"
1 45 PHE 9.528 0.532 6 1 "[ .+ 1 . 2]"
1 46 ILE 12.957 0.257 13 0 "[ . 1 . 2]"
1 47 LEU 6.959 0.245 2 0 "[ . 1 . 2]"
1 48 ALA 0.682 0.098 14 0 "[ . 1 . 2]"
1 49 GLY 6.663 0.293 9 0 "[ . 1 . 2]"
1 50 GLY 7.090 0.393 12 0 "[ . 1 . 2]"
1 51 PRO 22.586 0.582 8 3 "[ * . + 1 .- 2]"
1 52 ALA 1.590 0.113 9 0 "[ . 1 . 2]"
1 53 ASP 3.909 0.293 9 0 "[ . 1 . 2]"
1 54 LEU 5.688 0.224 16 0 "[ . 1 . 2]"
1 55 SER 0.408 0.071 19 0 "[ . 1 . 2]"
1 56 GLY 0.027 0.027 3 0 "[ . 1 . 2]"
1 57 GLU 2.115 0.449 15 0 "[ . 1 . 2]"
1 58 LEU 4.305 0.491 17 0 "[ . 1 . 2]"
1 59 ARG 3.570 0.313 7 0 "[ . 1 . 2]"
1 60 ARG 11.495 0.951 6 1 "[ .+ 1 . 2]"
1 61 GLY 5.733 0.702 17 1 "[ . 1 . + 2]"
1 62 ASP 3.353 0.702 17 1 "[ . 1 . + 2]"
1 63 ARG 17.241 1.068 15 18 "[***** *******-+* ***]"
1 64 ILE 0.314 0.283 17 0 "[ . 1 . 2]"
1 65 LEU 13.267 0.708 10 9 "[ . * +**- ** **2]"
1 66 SER 9.350 0.440 20 0 "[ . 1 . 2]"
1 67 VAL 6.453 0.372 19 0 "[ . 1 . 2]"
1 68 ASN 21.426 0.841 1 20 [+******-************]
1 69 GLY 11.522 0.694 17 17 "[ *-**** ********+**2]"
1 70 VAL 5.952 0.440 20 0 "[ . 1 . 2]"
1 71 ASN 8.405 0.350 18 0 "[ . 1 . 2]"
1 72 LEU 1.564 0.165 7 0 "[ . 1 . 2]"
1 73 ARG 7.590 0.708 10 2 "[ .* + . 2]"
1 74 ASN 3.700 0.827 1 2 "[+ . 1 . - 2]"
1 75 ALA 1.904 0.827 1 2 "[+ . 1 . - 2]"
1 76 THR 4.861 0.688 5 6 "[-** +* 1 . *2]"
1 77 HIS 0.007 0.007 15 0 "[ . 1 . 2]"
1 78 GLU 9.356 0.495 15 0 "[ . 1 . 2]"
1 79 GLN 9.864 0.688 5 6 "[-** +* 1 . *2]"
1 80 ALA 0.041 0.012 16 0 "[ . 1 . 2]"
1 81 ALA 0.363 0.115 19 0 "[ . 1 . 2]"
1 82 ALA 2.003 0.670 9 1 "[ . +1 . 2]"
1 83 ALA 8.646 0.611 18 6 "[ . -1 * ** + *]"
1 84 LEU 8.642 0.770 15 11 "[ * *** *1 ** + **-]"
1 85 LYS 13.466 0.915 9 1 "[ . +1 . 2]"
1 86 ARG 14.172 0.915 9 7 "[ . +1 *-** * *]"
1 87 ALA 17.176 0.841 1 7 "[+ * . - 1 *. * **]"
1 88 GLY 0.960 0.486 14 0 "[ . 1 . 2]"
1 89 GLN 11.985 0.961 17 15 "[ * ******* ***-+* *]"
1 90 SER 0.786 0.121 14 0 "[ . 1 . 2]"
1 91 VAL 1.791 0.158 20 0 "[ . 1 . 2]"
1 92 THR 0.032 0.019 12 0 "[ . 1 . 2]"
1 93 ILE 1.485 0.239 18 0 "[ . 1 . 2]"
1 94 VAL 6.889 0.536 15 1 "[ . 1 + 2]"
1 95 ALA 15.534 0.879 13 15 "[* * ** ***+*******]"
1 96 GLN 12.833 0.963 14 5 "[ . * *+*- 2]"
1 97 TYR 19.635 1.068 15 19 "[*****-********+* ***]"
1 98 ARG 9.909 0.846 19 7 "[ .- * 1** *. *+2]"
1 99 PRO 2.095 0.344 6 0 "[ . 1 . 2]"
1 100 GLU 12.199 0.813 7 5 "[ . + 1 **-. *2]"
1 101 GLU 2.968 0.767 13 1 "[ . 1 + . 2]"
1 102 TYR 2.986 0.972 13 2 "[ . 1- + . 2]"
1 103 SER 16.056 0.928 11 9 "[* . ** *+-**. *2]"
1 104 ARG 4.123 0.641 7 2 "[ . + 1 - . 2]"
1 105 PHE 10.601 0.715 8 6 "[* . + * - *. *2]"
1 106 GLU 10.670 0.972 13 2 "[ . 1- + . 2]"
1 107 SER 1.775 0.898 13 2 "[ . 1- + . 2]"
1 108 SER 0.705 0.705 18 1 "[ . 1 . + 2]"
1 109 GLY 0.705 0.705 18 1 "[ . 1 . + 2]"
1 110 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 SER 0.000 0.000 . 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 7 GLY HA3 1 8 ARG H . . 3.410 2.970 2.199 3.603 0.193 17 0 "[ . 1 . 2]" 1
2 1 8 ARG H 1 8 ARG HB2 . . 3.720 2.637 2.151 3.436 . 0 0 "[ . 1 . 2]" 1
3 1 8 ARG H 1 8 ARG HB3 . . 4.180 3.707 3.345 4.102 . 0 0 "[ . 1 . 2]" 1
4 1 8 ARG H 1 8 ARG HG3 . . 3.970 3.466 2.356 4.493 0.523 12 1 "[ . 1 + . 2]" 1
5 1 8 ARG HA 1 8 ARG HD2 . . 4.510 4.065 1.995 4.841 0.331 2 0 "[ . 1 . 2]" 1
6 1 8 ARG HA 1 8 ARG HG3 . . 3.630 2.600 2.023 3.683 0.053 12 0 "[ . 1 . 2]" 1
7 1 8 ARG HA 1 9 PRO HD2 . . 2.880 2.604 2.293 2.828 . 0 0 "[ . 1 . 2]" 1
8 1 8 ARG HA 1 9 PRO HD3 . . 2.990 1.993 1.948 2.080 . 0 0 "[ . 1 . 2]" 1
9 1 8 ARG HB2 1 9 PRO HD2 . . 4.650 4.130 3.668 4.609 . 0 0 "[ . 1 . 2]" 1
10 1 8 ARG HB3 1 8 ARG HG2 . . 2.520 2.463 2.264 3.056 0.536 12 3 "[ .- * + . 2]" 1
11 1 8 ARG HB3 1 9 PRO HD2 . . 3.760 2.660 2.001 3.369 . 0 0 "[ . 1 . 2]" 1
12 1 8 ARG HB3 1 9 PRO HD3 . . 4.510 3.630 3.080 4.163 . 0 0 "[ . 1 . 2]" 1
13 1 8 ARG HG2 1 9 PRO HD2 . . 4.830 3.351 2.410 4.465 . 0 0 "[ . 1 . 2]" 1
14 1 8 ARG HG3 1 9 PRO HD3 . . 4.830 4.121 3.071 4.957 0.127 2 0 "[ . 1 . 2]" 1
15 1 9 PRO HA 1 10 GLY H . . 3.270 2.463 2.162 2.761 . 0 0 "[ . 1 . 2]" 1
16 1 9 PRO HB2 1 10 GLY H . . 4.720 2.889 1.989 4.452 . 0 0 "[ . 1 . 2]" 1
17 1 11 GLY HA3 1 12 ASP H . . 3.060 2.779 2.200 3.575 0.515 12 2 "[ . - 1 + . 2]" 1
18 1 11 GLY HA3 1 13 ALA H . . 4.950 3.846 3.000 4.915 . 0 0 "[ . 1 . 2]" 1
19 1 12 ASP H 1 12 ASP HB2 . . 3.830 2.700 2.123 3.742 . 0 0 "[ . 1 . 2]" 1
20 1 12 ASP H 1 12 ASP HB3 . . 3.830 3.520 3.294 3.795 . 0 0 "[ . 1 . 2]" 1
21 1 12 ASP HA 1 13 ALA H . . 3.100 2.790 2.376 3.080 . 0 0 "[ . 1 . 2]" 1
22 1 12 ASP HA 1 13 ALA MB . . 4.300 3.944 3.656 4.386 0.086 8 0 "[ . 1 . 2]" 1
23 1 12 ASP HB2 1 13 ALA H . . 4.320 4.255 4.085 4.433 0.113 8 0 "[ . 1 . 2]" 1
24 1 12 ASP HB3 1 13 ALA H . . 4.440 4.268 4.147 4.395 . 0 0 "[ . 1 . 2]" 1
25 1 13 ALA H 1 13 ALA MB . . 2.920 2.656 2.069 2.928 0.008 14 0 "[ . 1 . 2]" 1
26 1 13 ALA H 1 14 ARG H . . 3.750 3.270 2.689 3.780 0.030 17 0 "[ . 1 . 2]" 1
27 1 13 ALA HA 1 14 ARG H . . 3.380 2.541 2.287 3.439 0.059 8 0 "[ . 1 . 2]" 1
28 1 13 ALA HA 1 15 GLU H . . 4.450 4.085 3.416 4.416 . 0 0 "[ . 1 . 2]" 1
29 1 13 ALA MB 1 14 ARG H . . 4.020 3.554 1.809 3.793 . 0 0 "[ . 1 . 2]" 1
30 1 13 ALA MB 1 97 TYR HB2 . . 4.400 3.791 3.046 4.332 . 0 0 "[ . 1 . 2]" 1
31 1 13 ALA MB 1 97 TYR HB3 . . 4.650 3.694 3.046 4.347 . 0 0 "[ . 1 . 2]" 1
32 1 13 ALA MB 1 97 TYR QD . . 4.510 3.555 2.111 4.498 . 0 0 "[ . 1 . 2]" 1
33 1 14 ARG H 1 14 ARG HB3 . . 3.800 3.756 3.607 4.078 0.278 8 0 "[ . 1 . 2]" 1
34 1 14 ARG H 1 14 ARG HG3 . . 3.980 3.838 3.312 4.592 0.612 6 1 "[ .+ 1 . 2]" 1
35 1 14 ARG H 1 15 GLU H . . 3.340 2.185 1.883 3.483 0.143 8 0 "[ . 1 . 2]" 1
36 1 14 ARG HA 1 14 ARG HD2 . . 4.140 3.504 2.206 4.123 . 0 0 "[ . 1 . 2]" 1
37 1 14 ARG HA 1 14 ARG HD3 . . 4.020 3.501 2.187 4.056 0.036 1 0 "[ . 1 . 2]" 1
38 1 14 ARG HA 1 14 ARG HG3 . . 3.400 2.561 2.010 3.787 0.387 18 0 "[ . 1 . 2]" 1
39 1 14 ARG HA 1 14 ARG QH2 . . 4.830 6.470 5.809 6.732 1.902 13 20 [*****-******+*******] 1
40 1 14 ARG HA 1 15 GLU H . . 3.630 3.628 3.602 3.650 0.020 13 0 "[ . 1 . 2]" 1
41 1 14 ARG HA 1 97 TYR H . . 4.830 4.625 4.046 4.819 . 0 0 "[ . 1 . 2]" 1
42 1 14 ARG HA 1 97 TYR HB3 . . 4.220 3.675 2.833 4.216 . 0 0 "[ . 1 . 2]" 1
43 1 14 ARG HB2 1 14 ARG HD2 . . 4.080 3.414 2.920 3.652 . 0 0 "[ . 1 . 2]" 1
44 1 14 ARG HB2 1 14 ARG HD3 . . 4.020 2.536 2.023 3.978 . 0 0 "[ . 1 . 2]" 1
45 1 14 ARG HB2 1 15 GLU H . . 5.060 2.524 2.187 3.180 . 0 0 "[ . 1 . 2]" 1
46 1 14 ARG HB2 1 15 GLU QG . . 4.400 4.274 3.200 5.066 0.666 8 2 "[ . + 1 . - 2]" 1
47 1 14 ARG HB3 1 14 ARG HD3 . . 4.220 3.459 3.206 3.679 . 0 0 "[ . 1 . 2]" 1
48 1 14 ARG HB3 1 15 GLU H . . 5.060 3.400 2.707 3.720 . 0 0 "[ . 1 . 2]" 1
49 1 14 ARG HD2 1 14 ARG QH2 . . 4.400 4.180 4.060 4.290 . 0 0 "[ . 1 . 2]" 1
50 1 14 ARG HD3 1 14 ARG QH2 . . 4.220 4.163 4.043 4.291 0.071 18 0 "[ . 1 . 2]" 1
51 1 14 ARG HG2 1 14 ARG QH2 . . 4.400 4.128 3.807 4.931 0.531 6 2 "[ - .+ 1 . 2]" 1
52 1 15 GLU H 1 15 GLU HB2 . . 3.190 2.118 2.035 3.433 0.243 18 0 "[ . 1 . 2]" 1
53 1 15 GLU H 1 15 GLU HB3 . . 3.540 3.282 3.016 3.355 . 0 0 "[ . 1 . 2]" 1
54 1 15 GLU H 1 15 GLU QG . . 3.680 3.146 1.691 3.359 . 0 0 "[ . 1 . 2]" 1
55 1 15 GLU H 1 16 PRO HD2 . . 4.920 4.783 4.763 4.811 . 0 0 "[ . 1 . 2]" 1
56 1 15 GLU H 1 16 PRO HD3 . . 5.050 4.775 4.732 4.807 . 0 0 "[ . 1 . 2]" 1
57 1 15 GLU HA 1 15 GLU QG . . 3.790 2.169 1.955 3.153 . 0 0 "[ . 1 . 2]" 1
58 1 15 GLU HA 1 16 PRO HD2 . . 3.300 3.059 3.015 3.079 . 0 0 "[ . 1 . 2]" 1
59 1 15 GLU HA 1 16 PRO HD3 . . 2.960 2.244 2.207 2.261 . 0 0 "[ . 1 . 2]" 1
60 1 15 GLU HA 1 96 GLN HE21 . . 4.140 3.618 2.290 4.588 0.448 14 0 "[ . 1 . 2]" 1
61 1 15 GLU HB2 1 16 PRO HD2 . . 3.530 3.418 1.758 3.548 0.018 17 0 "[ . 1 . 2]" 1
62 1 15 GLU HB2 1 16 PRO HD3 . . 4.220 4.066 2.878 4.184 . 0 0 "[ . 1 . 2]" 1
63 1 15 GLU HB3 1 16 PRO HD2 . . 3.360 1.984 1.948 2.561 . 0 0 "[ . 1 . 2]" 1
64 1 15 GLU HB3 1 16 PRO HD3 . . 3.580 3.054 2.905 3.072 . 0 0 "[ . 1 . 2]" 1
65 1 15 GLU QG 1 16 PRO HD2 . . 4.300 2.278 2.011 3.969 . 0 0 "[ . 1 . 2]" 1
66 1 15 GLU QG 1 16 PRO HD3 . . 4.650 2.160 1.985 4.456 . 0 0 "[ . 1 . 2]" 1
67 1 16 PRO HA 1 17 ARG H . . 3.120 2.213 2.149 2.427 . 0 0 "[ . 1 . 2]" 1
68 1 16 PRO HA 1 65 LEU QD . . 3.870 3.324 2.980 3.538 . 0 0 "[ . 1 . 2]" 1
69 1 16 PRO HA 1 94 VAL MG1 . . 4.400 3.826 3.440 4.161 . 0 0 "[ . 1 . 2]" 1
70 1 16 PRO HA 1 95 ALA H . . 4.900 4.625 4.149 4.866 . 0 0 "[ . 1 . 2]" 1
71 1 16 PRO HA 1 96 GLN H . . 4.830 3.872 3.457 4.291 . 0 0 "[ . 1 . 2]" 1
72 1 16 PRO HA 1 96 GLN HB2 . . 3.920 2.954 2.388 4.513 0.593 14 1 "[ . 1 +. 2]" 1
73 1 16 PRO HA 1 96 GLN HB3 . . 4.400 2.179 1.950 3.988 . 0 0 "[ . 1 . 2]" 1
74 1 16 PRO HA 1 96 GLN HE21 . . 4.940 3.630 3.006 4.328 . 0 0 "[ . 1 . 2]" 1
75 1 16 PRO HA 1 96 GLN HE22 . . 4.900 5.027 4.444 5.530 0.630 13 1 "[ . 1 + . 2]" 1
76 1 16 PRO HA 1 96 GLN HG2 . . 4.510 4.090 1.919 4.496 . 0 0 "[ . 1 . 2]" 1
77 1 16 PRO HB2 1 65 LEU QD . . 3.470 2.987 2.533 3.366 . 0 0 "[ . 1 . 2]" 1
78 1 16 PRO HB2 1 94 VAL MG1 . . 3.350 2.169 1.747 2.578 . 0 0 "[ . 1 . 2]" 1
79 1 16 PRO HB2 1 95 ALA H . . 5.060 4.785 4.088 5.389 0.329 17 0 "[ . 1 . 2]" 1
80 1 16 PRO HB3 1 17 ARG H . . 4.400 3.862 3.409 4.182 . 0 0 "[ . 1 . 2]" 1
81 1 16 PRO HB3 1 65 LEU QD . . 3.290 1.859 1.774 2.022 . 0 0 "[ . 1 . 2]" 1
82 1 16 PRO HB3 1 94 VAL MG1 . . 3.240 3.164 2.816 3.335 0.095 15 0 "[ . 1 . 2]" 1
83 1 16 PRO HB3 1 95 ALA H . . 5.440 5.007 4.428 5.490 0.050 17 0 "[ . 1 . 2]" 1
84 1 16 PRO HD2 1 65 LEU QD . . 4.830 4.641 4.523 4.880 0.050 14 0 "[ . 1 . 2]" 1
85 1 16 PRO HD2 1 96 GLN HE21 . . 5.060 4.244 3.675 4.890 . 0 0 "[ . 1 . 2]" 1
86 1 16 PRO HD2 1 96 GLN HE22 . . 5.060 4.645 3.555 5.045 . 0 0 "[ . 1 . 2]" 1
87 1 16 PRO HD3 1 65 LEU QD . . 4.830 3.820 3.655 4.070 . 0 0 "[ . 1 . 2]" 1
88 1 16 PRO HD3 1 96 GLN HE21 . . 4.400 2.743 1.958 3.434 . 0 0 "[ . 1 . 2]" 1
89 1 16 PRO HD3 1 96 GLN HE22 . . 4.510 2.923 1.888 3.345 . 0 0 "[ . 1 . 2]" 1
90 1 16 PRO HG3 1 65 LEU QD . . 3.760 2.685 2.439 2.939 . 0 0 "[ . 1 . 2]" 1
91 1 17 ARG H 1 17 ARG HB3 . . 3.870 3.084 2.623 3.622 . 0 0 "[ . 1 . 2]" 1
92 1 17 ARG H 1 17 ARG QD . . 4.080 3.273 2.590 3.801 . 0 0 "[ . 1 . 2]" 1
93 1 17 ARG H 1 17 ARG HG2 . . 3.720 2.340 1.949 3.193 . 0 0 "[ . 1 . 2]" 1
94 1 17 ARG H 1 17 ARG HG3 . . 4.620 2.945 1.847 3.892 . 0 0 "[ . 1 . 2]" 1
95 1 17 ARG H 1 18 LYS H . . 4.700 4.467 4.185 4.586 . 0 0 "[ . 1 . 2]" 1
96 1 17 ARG H 1 19 ILE MD . . 5.060 3.661 3.401 3.966 . 0 0 "[ . 1 . 2]" 1
97 1 17 ARG H 1 94 VAL HA . . 5.270 4.317 3.815 4.696 . 0 0 "[ . 1 . 2]" 1
98 1 17 ARG H 1 94 VAL MG1 . . 3.920 3.394 2.858 3.778 . 0 0 "[ . 1 . 2]" 1
99 1 17 ARG H 1 95 ALA H . . 3.650 3.428 3.172 3.669 0.019 13 0 "[ . 1 . 2]" 1
100 1 17 ARG H 1 95 ALA HA . . 5.500 4.634 4.314 5.026 . 0 0 "[ . 1 . 2]" 1
101 1 17 ARG H 1 95 ALA MB . . 5.100 4.538 4.277 4.800 . 0 0 "[ . 1 . 2]" 1
102 1 17 ARG HA 1 17 ARG QD . . 4.510 4.349 4.266 4.473 . 0 0 "[ . 1 . 2]" 1
103 1 17 ARG HA 1 18 LYS H . . 2.900 2.450 2.256 2.713 . 0 0 "[ . 1 . 2]" 1
104 1 17 ARG HA 1 95 ALA H . . 5.340 5.411 5.138 5.638 0.298 5 0 "[ . 1 . 2]" 1
105 1 17 ARG HB2 1 17 ARG HE . . 4.080 2.862 2.464 3.851 . 0 0 "[ . 1 . 2]" 1
106 1 17 ARG HB2 1 17 ARG HG3 . . 2.920 2.491 2.273 2.833 . 0 0 "[ . 1 . 2]" 1
107 1 17 ARG HB2 1 18 LYS H . . 3.330 2.698 2.045 3.273 . 0 0 "[ . 1 . 2]" 1
108 1 17 ARG HB2 1 19 ILE MD . . 4.020 3.926 3.585 4.023 0.003 11 0 "[ . 1 . 2]" 1
109 1 17 ARG HB2 1 19 ILE QG . . 4.510 3.483 3.218 3.859 . 0 0 "[ . 1 . 2]" 1
110 1 17 ARG HB3 1 17 ARG QD . . 3.450 2.795 2.340 3.404 . 0 0 "[ . 1 . 2]" 1
111 1 17 ARG QD 1 19 ILE MD . . 4.650 2.100 1.758 2.494 . 0 0 "[ . 1 . 2]" 1
112 1 17 ARG QD 1 95 ALA MB . . 5.060 4.228 3.985 4.393 . 0 0 "[ . 1 . 2]" 1
113 1 17 ARG QD 1 96 GLN HA . . 4.220 3.648 2.565 4.868 0.648 14 4 "[ . * +*- 2]" 1
114 1 17 ARG HE 1 17 ARG HG2 . . 4.220 3.561 2.677 3.916 . 0 0 "[ . 1 . 2]" 1
115 1 17 ARG HE 1 19 ILE MD . . 3.920 3.898 3.568 3.995 0.075 1 0 "[ . 1 . 2]" 1
116 1 17 ARG HG2 1 18 LYS H . . 5.060 4.616 4.315 4.902 . 0 0 "[ . 1 . 2]" 1
117 1 17 ARG HG2 1 19 ILE MD . . 3.170 2.689 1.950 3.916 0.746 20 3 "[ * - 1 . +]" 1
118 1 17 ARG HG2 1 19 ILE QG . . 3.830 3.592 2.786 4.626 0.796 1 8 "[+ * * * *-* *]" 1
119 1 17 ARG HG2 1 95 ALA H . . 4.430 3.866 3.013 5.302 0.872 20 4 "[* * - 1 . +]" 1
120 1 17 ARG HG3 1 18 LYS H . . 4.830 4.298 4.082 4.622 . 0 0 "[ . 1 . 2]" 1
121 1 17 ARG HG3 1 19 ILE MD . . 4.650 2.279 2.016 2.898 . 0 0 "[ . 1 . 2]" 1
122 1 17 ARG HG3 1 95 ALA H . . 4.900 3.949 3.022 4.582 . 0 0 "[ . 1 . 2]" 1
123 1 18 LYS H 1 18 LYS HB3 . . 3.180 2.492 2.124 3.206 0.026 1 0 "[ . 1 . 2]" 1
124 1 18 LYS H 1 18 LYS HD2 . . 5.060 4.895 4.553 5.800 0.740 18 2 "[ .- 1 . + 2]" 1
125 1 18 LYS H 1 18 LYS QG . . 4.480 3.847 3.689 3.994 . 0 0 "[ . 1 . 2]" 1
126 1 18 LYS H 1 19 ILE H . . 4.550 4.408 4.282 4.532 . 0 0 "[ . 1 . 2]" 1
127 1 18 LYS H 1 19 ILE MD . . 5.060 4.786 4.341 5.067 0.007 11 0 "[ . 1 . 2]" 1
128 1 18 LYS H 1 19 ILE QG . . 5.260 4.109 3.751 4.695 . 0 0 "[ . 1 . 2]" 1
129 1 18 LYS H 1 94 VAL MG1 . . 4.680 4.065 3.461 4.628 . 0 0 "[ . 1 . 2]" 1
130 1 18 LYS HA 1 18 LYS HD2 . . 4.830 4.482 3.337 4.794 . 0 0 "[ . 1 . 2]" 1
131 1 18 LYS HA 1 18 LYS QG . . 3.830 2.412 2.076 2.726 . 0 0 "[ . 1 . 2]" 1
132 1 18 LYS HA 1 19 ILE H . . 3.140 2.192 2.177 2.239 . 0 0 "[ . 1 . 2]" 1
133 1 18 LYS HA 1 19 ILE HB . . 4.650 4.551 4.363 4.706 0.056 13 0 "[ . 1 . 2]" 1
134 1 18 LYS HA 1 19 ILE MD . . 4.400 4.127 3.822 4.385 . 0 0 "[ . 1 . 2]" 1
135 1 18 LYS HA 1 19 ILE QG . . 4.830 3.872 3.646 4.388 . 0 0 "[ . 1 . 2]" 1
136 1 18 LYS HA 1 92 THR MG . . 4.020 3.549 3.309 3.770 . 0 0 "[ . 1 . 2]" 1
137 1 18 LYS HA 1 94 VAL HA . . 3.410 2.592 2.276 2.832 . 0 0 "[ . 1 . 2]" 1
138 1 18 LYS HA 1 94 VAL MG1 . . 4.300 3.013 2.678 3.421 . 0 0 "[ . 1 . 2]" 1
139 1 18 LYS HA 1 94 VAL MG2 . . 3.490 2.439 2.157 2.832 . 0 0 "[ . 1 . 2]" 1
140 1 18 LYS HA 1 95 ALA H . . 4.390 4.252 3.989 4.427 0.037 13 0 "[ . 1 . 2]" 1
141 1 18 LYS HB2 1 18 LYS HE3 . . 4.510 2.881 2.003 4.495 . 0 0 "[ . 1 . 2]" 1
142 1 18 LYS HB2 1 92 THR MG . . 4.650 3.851 3.370 4.325 . 0 0 "[ . 1 . 2]" 1
143 1 18 LYS HB2 1 94 VAL MG2 . . 4.140 3.172 2.850 4.007 . 0 0 "[ . 1 . 2]" 1
144 1 18 LYS HB3 1 19 ILE H . . 4.390 4.394 3.493 4.666 0.276 19 0 "[ . 1 . 2]" 1
145 1 18 LYS HD3 1 20 ILE MD . . 4.140 2.617 1.884 4.742 0.602 6 1 "[ .+ 1 . 2]" 1
146 1 18 LYS HD3 1 92 THR MG . . 3.160 2.589 1.904 3.122 . 0 0 "[ . 1 . 2]" 1
147 1 18 LYS HE2 1 20 ILE MD . . 4.080 3.720 2.231 4.813 0.733 6 1 "[ .+ 1 . 2]" 1
148 1 18 LYS HE3 1 92 THR MG . . 3.690 2.542 1.981 3.578 . 0 0 "[ . 1 . 2]" 1
149 1 18 LYS HE3 1 94 VAL MG2 . . 4.140 3.105 1.948 4.522 0.382 6 0 "[ . 1 . 2]" 1
150 1 18 LYS QG 1 19 ILE H . . 4.510 3.034 2.635 3.490 . 0 0 "[ . 1 . 2]" 1
151 1 18 LYS QG 1 20 ILE MD . . 3.580 2.563 1.935 3.500 . 0 0 "[ . 1 . 2]" 1
152 1 18 LYS QG 1 92 THR MG . . 3.470 1.880 1.686 2.159 . 0 0 "[ . 1 . 2]" 1
153 1 18 LYS QG 1 94 VAL MG2 . . 5.060 2.684 1.842 3.375 . 0 0 "[ . 1 . 2]" 1
154 1 19 ILE H 1 19 ILE HB . . 3.680 2.553 2.328 2.704 . 0 0 "[ . 1 . 2]" 1
155 1 19 ILE H 1 19 ILE MD . . 4.020 3.218 2.910 3.551 . 0 0 "[ . 1 . 2]" 1
156 1 19 ILE H 1 19 ILE QG . . 4.080 2.933 2.563 3.265 . 0 0 "[ . 1 . 2]" 1
157 1 19 ILE H 1 19 ILE MG . . 4.400 3.791 3.649 3.850 . 0 0 "[ . 1 . 2]" 1
158 1 19 ILE H 1 20 ILE H . . 4.750 4.208 3.691 4.560 . 0 0 "[ . 1 . 2]" 1
159 1 19 ILE H 1 92 THR HA . . 4.700 4.433 3.948 4.683 . 0 0 "[ . 1 . 2]" 1
160 1 19 ILE H 1 92 THR MG . . 4.510 3.458 2.976 3.759 . 0 0 "[ . 1 . 2]" 1
161 1 19 ILE H 1 93 ILE H . . 4.220 3.523 3.125 3.805 . 0 0 "[ . 1 . 2]" 1
162 1 19 ILE H 1 93 ILE HB . . 4.780 4.253 3.733 4.357 . 0 0 "[ . 1 . 2]" 1
163 1 19 ILE H 1 93 ILE MG . . 5.060 4.365 4.042 4.764 . 0 0 "[ . 1 . 2]" 1
164 1 19 ILE H 1 94 VAL HA . . 4.400 2.840 2.558 3.296 . 0 0 "[ . 1 . 2]" 1
165 1 19 ILE H 1 94 VAL MG2 . . 4.290 3.183 2.902 3.388 . 0 0 "[ . 1 . 2]" 1
166 1 19 ILE H 1 95 ALA H . . 5.080 3.973 3.555 4.509 . 0 0 "[ . 1 . 2]" 1
167 1 19 ILE HA 1 19 ILE MD . . 3.910 3.813 3.662 3.865 . 0 0 "[ . 1 . 2]" 1
168 1 19 ILE HA 1 19 ILE QG . . 3.560 2.391 2.199 2.456 . 0 0 "[ . 1 . 2]" 1
169 1 19 ILE HA 1 19 ILE MG . . 3.030 2.441 2.341 2.542 . 0 0 "[ . 1 . 2]" 1
170 1 19 ILE HA 1 20 ILE H . . 2.870 2.213 2.177 2.287 . 0 0 "[ . 1 . 2]" 1
171 1 19 ILE HA 1 20 ILE HB . . 4.650 4.322 4.177 4.447 . 0 0 "[ . 1 . 2]" 1
172 1 19 ILE HA 1 20 ILE MD . . 4.510 4.399 4.116 4.561 0.051 18 0 "[ . 1 . 2]" 1
173 1 19 ILE HA 1 20 ILE HG13 . . 4.830 4.531 4.265 4.812 . 0 0 "[ . 1 . 2]" 1
174 1 19 ILE HA 1 57 GLU HB3 . . 5.060 3.968 3.018 4.508 . 0 0 "[ . 1 . 2]" 1
175 1 19 ILE HB 1 19 ILE MD . . 2.950 2.077 1.892 2.168 . 0 0 "[ . 1 . 2]" 1
176 1 19 ILE HB 1 20 ILE H . . 4.350 4.405 4.028 4.642 0.292 18 0 "[ . 1 . 2]" 1
177 1 19 ILE HB 1 57 GLU HB3 . . 5.420 4.777 4.270 4.951 . 0 0 "[ . 1 . 2]" 1
178 1 19 ILE HB 1 58 LEU QD . . 5.500 3.378 3.149 3.618 . 0 0 "[ . 1 . 2]" 1
179 1 19 ILE HB 1 93 ILE H . . 4.650 3.699 3.436 3.907 . 0 0 "[ . 1 . 2]" 1
180 1 19 ILE HB 1 93 ILE HB . . 3.450 3.030 2.400 3.212 . 0 0 "[ . 1 . 2]" 1
181 1 19 ILE MD 1 57 GLU HA . . 5.060 4.697 4.404 4.915 . 0 0 "[ . 1 . 2]" 1
182 1 19 ILE MD 1 57 GLU HB2 . . 4.300 3.789 3.422 4.336 0.036 11 0 "[ . 1 . 2]" 1
183 1 19 ILE MD 1 57 GLU HB3 . . 3.430 3.326 3.092 3.485 0.055 18 0 "[ . 1 . 2]" 1
184 1 19 ILE MD 1 58 LEU H . . 4.220 3.730 2.555 4.103 . 0 0 "[ . 1 . 2]" 1
185 1 19 ILE MD 1 58 LEU HA . . 3.610 2.672 2.228 3.182 . 0 0 "[ . 1 . 2]" 1
186 1 19 ILE MD 1 58 LEU HB2 . . 4.300 3.336 2.972 3.686 . 0 0 "[ . 1 . 2]" 1
187 1 19 ILE MD 1 58 LEU QD . . 3.010 2.573 1.721 2.900 . 0 0 "[ . 1 . 2]" 1
188 1 19 ILE MD 1 59 ARG H . . 4.830 4.214 3.803 4.648 . 0 0 "[ . 1 . 2]" 1
189 1 19 ILE MD 1 93 ILE H . . 5.060 5.017 4.608 5.299 0.239 18 0 "[ . 1 . 2]" 1
190 1 19 ILE MD 1 93 ILE HB . . 4.400 4.064 3.454 4.355 . 0 0 "[ . 1 . 2]" 1
191 1 19 ILE MD 1 94 VAL HA . . 4.510 3.358 2.937 3.605 . 0 0 "[ . 1 . 2]" 1
192 1 19 ILE MD 1 95 ALA H . . 3.830 2.225 1.932 2.558 . 0 0 "[ . 1 . 2]" 1
193 1 19 ILE MD 1 95 ALA HA . . 5.420 4.465 4.183 4.680 . 0 0 "[ . 1 . 2]" 1
194 1 19 ILE MD 1 95 ALA MB . . 2.820 2.692 2.421 2.885 0.065 13 0 "[ . 1 . 2]" 1
195 1 19 ILE QG 1 19 ILE MG . . 2.720 2.053 1.948 2.185 . 0 0 "[ . 1 . 2]" 1
196 1 19 ILE QG 1 20 ILE H . . 4.780 4.267 4.137 4.349 . 0 0 "[ . 1 . 2]" 1
197 1 19 ILE QG 1 57 GLU H . . 5.320 4.619 4.111 5.256 . 0 0 "[ . 1 . 2]" 1
198 1 19 ILE QG 1 57 GLU HA . . 5.420 4.006 3.395 4.341 . 0 0 "[ . 1 . 2]" 1
199 1 19 ILE QG 1 57 GLU HB2 . . 3.920 2.320 1.971 3.190 . 0 0 "[ . 1 . 2]" 1
200 1 19 ILE QG 1 57 GLU HB3 . . 3.870 1.951 1.835 1.997 . 0 0 "[ . 1 . 2]" 1
201 1 19 ILE QG 1 57 GLU HG2 . . 4.510 4.273 3.579 4.611 0.101 2 0 "[ . 1 . 2]" 1
202 1 19 ILE QG 1 58 LEU H . . 4.980 3.305 2.402 4.001 . 0 0 "[ . 1 . 2]" 1
203 1 19 ILE QG 1 58 LEU QD . . 5.060 3.914 3.228 4.206 . 0 0 "[ . 1 . 2]" 1
204 1 19 ILE QG 1 95 ALA H . . 5.500 4.071 3.774 4.413 . 0 0 "[ . 1 . 2]" 1
205 1 19 ILE MG 1 20 ILE H . . 3.430 2.895 2.143 3.433 0.003 12 0 "[ . 1 . 2]" 1
206 1 19 ILE MG 1 20 ILE HA . . 4.400 3.905 3.630 4.189 . 0 0 "[ . 1 . 2]" 1
207 1 19 ILE MG 1 55 SER QB . . 4.650 3.298 2.844 3.736 . 0 0 "[ . 1 . 2]" 1
208 1 19 ILE MG 1 57 GLU H . . 5.190 3.840 3.671 4.040 . 0 0 "[ . 1 . 2]" 1
209 1 19 ILE MG 1 57 GLU HA . . 5.060 4.512 3.997 4.810 . 0 0 "[ . 1 . 2]" 1
210 1 19 ILE MG 1 57 GLU HB2 . . 3.870 1.997 1.943 2.143 . 0 0 "[ . 1 . 2]" 1
211 1 19 ILE MG 1 57 GLU HB3 . . 3.430 2.990 2.216 3.271 . 0 0 "[ . 1 . 2]" 1
212 1 19 ILE MG 1 57 GLU HG2 . . 4.220 4.127 3.638 4.669 0.449 15 0 "[ . 1 . 2]" 1
213 1 19 ILE MG 1 58 LEU H . . 4.140 2.510 2.013 3.329 . 0 0 "[ . 1 . 2]" 1
214 1 19 ILE MG 1 58 LEU HA . . 4.140 3.456 3.048 4.119 . 0 0 "[ . 1 . 2]" 1
215 1 19 ILE MG 1 58 LEU HB2 . . 4.220 2.017 1.764 2.389 . 0 0 "[ . 1 . 2]" 1
216 1 19 ILE MG 1 58 LEU HB3 . . 4.400 3.443 2.988 3.927 . 0 0 "[ . 1 . 2]" 1
217 1 19 ILE MG 1 58 LEU QD . . 3.760 2.415 1.935 2.813 . 0 0 "[ . 1 . 2]" 1
218 1 19 ILE MG 1 93 ILE HB . . 3.530 3.307 2.811 3.545 0.015 17 0 "[ . 1 . 2]" 1
219 1 20 ILE H 1 20 ILE HB . . 3.250 2.293 2.160 2.482 . 0 0 "[ . 1 . 2]" 1
220 1 20 ILE H 1 20 ILE MD . . 4.200 3.292 2.879 3.799 . 0 0 "[ . 1 . 2]" 1
221 1 20 ILE H 1 20 ILE HG13 . . 3.770 3.300 3.014 3.545 . 0 0 "[ . 1 . 2]" 1
222 1 20 ILE H 1 20 ILE MG . . 3.920 3.583 3.489 3.643 . 0 0 "[ . 1 . 2]" 1
223 1 20 ILE H 1 21 LEU QD . . 4.710 3.517 3.039 4.151 . 0 0 "[ . 1 . 2]" 1
224 1 20 ILE H 1 57 GLU HB2 . . 5.120 4.966 4.686 5.068 . 0 0 "[ . 1 . 2]" 1
225 1 20 ILE H 1 92 THR HA . . 5.370 4.580 4.344 4.782 . 0 0 "[ . 1 . 2]" 1
226 1 20 ILE H 1 93 ILE H . . 5.450 4.689 4.543 4.951 . 0 0 "[ . 1 . 2]" 1
227 1 20 ILE HA 1 20 ILE MD . . 3.760 3.683 3.612 3.753 . 0 0 "[ . 1 . 2]" 1
228 1 20 ILE HA 1 20 ILE HG12 . . 3.790 2.882 2.731 2.979 . 0 0 "[ . 1 . 2]" 1
229 1 20 ILE HA 1 20 ILE HG13 . . 3.790 2.265 2.155 2.382 . 0 0 "[ . 1 . 2]" 1
230 1 20 ILE HA 1 20 ILE MG . . 3.000 2.601 2.523 2.679 . 0 0 "[ . 1 . 2]" 1
231 1 20 ILE HA 1 21 LEU H . . 2.900 2.206 2.177 2.261 . 0 0 "[ . 1 . 2]" 1
232 1 20 ILE HA 1 21 LEU HB2 . . 5.420 4.644 4.482 4.809 . 0 0 "[ . 1 . 2]" 1
233 1 20 ILE HA 1 92 THR HA . . 3.580 2.272 2.068 2.615 . 0 0 "[ . 1 . 2]" 1
234 1 20 ILE HA 1 92 THR MG . . 4.510 3.599 3.110 3.873 . 0 0 "[ . 1 . 2]" 1
235 1 20 ILE HA 1 93 ILE H . . 4.400 2.978 2.692 3.321 . 0 0 "[ . 1 . 2]" 1
236 1 20 ILE HB 1 20 ILE MD . . 3.080 2.117 1.964 2.184 . 0 0 "[ . 1 . 2]" 1
237 1 20 ILE HB 1 21 LEU H . . 4.610 4.623 4.531 4.670 0.060 13 0 "[ . 1 . 2]" 1
238 1 20 ILE HB 1 92 THR HA . . 5.060 4.597 4.397 4.886 . 0 0 "[ . 1 . 2]" 1
239 1 20 ILE MD 1 20 ILE MG . . 2.760 2.499 2.314 2.668 . 0 0 "[ . 1 . 2]" 1
240 1 20 ILE MD 1 92 THR HA . . 4.020 3.937 3.647 4.039 0.019 12 0 "[ . 1 . 2]" 1
241 1 20 ILE MD 1 92 THR HB . . 5.060 4.717 4.425 5.059 . 0 0 "[ . 1 . 2]" 1
242 1 20 ILE MD 1 93 ILE H . . 5.420 5.253 4.982 5.400 . 0 0 "[ . 1 . 2]" 1
243 1 20 ILE HG12 1 20 ILE MG . . 3.050 2.197 2.129 2.249 . 0 0 "[ . 1 . 2]" 1
244 1 20 ILE HG12 1 21 LEU H . . 4.810 4.775 4.734 4.885 0.075 18 0 "[ . 1 . 2]" 1
245 1 20 ILE HG12 1 92 THR HA . . 4.220 3.025 2.614 3.470 . 0 0 "[ . 1 . 2]" 1
246 1 20 ILE HG12 1 92 THR MG . . 3.920 2.962 2.593 3.445 . 0 0 "[ . 1 . 2]" 1
247 1 20 ILE HG12 1 93 ILE H . . 5.420 4.989 4.567 5.372 . 0 0 "[ . 1 . 2]" 1
248 1 20 ILE HG13 1 20 ILE MG . . 3.290 3.130 3.080 3.181 . 0 0 "[ . 1 . 2]" 1
249 1 20 ILE HG13 1 21 LEU H . . 4.790 4.456 4.323 4.593 . 0 0 "[ . 1 . 2]" 1
250 1 20 ILE HG13 1 92 THR HA . . 4.400 2.300 2.008 2.445 . 0 0 "[ . 1 . 2]" 1
251 1 20 ILE HG13 1 92 THR MG . . 3.970 2.087 1.838 2.446 . 0 0 "[ . 1 . 2]" 1
252 1 20 ILE MG 1 21 LEU H . . 3.410 3.253 2.992 3.441 0.031 13 0 "[ . 1 . 2]" 1
253 1 20 ILE MG 1 22 HIS H . . 5.060 4.476 4.118 4.675 . 0 0 "[ . 1 . 2]" 1
254 1 20 ILE MG 1 22 HIS HA . . 4.830 4.323 4.212 4.542 . 0 0 "[ . 1 . 2]" 1
255 1 20 ILE MG 1 22 HIS HD2 . . 4.830 3.174 2.310 4.291 . 0 0 "[ . 1 . 2]" 1
256 1 20 ILE MG 1 22 HIS HE1 . . 4.220 3.541 2.740 4.179 . 0 0 "[ . 1 . 2]" 1
257 1 20 ILE MG 1 90 SER HA . . 4.510 3.388 3.051 3.795 . 0 0 "[ . 1 . 2]" 1
258 1 20 ILE MG 1 90 SER QB . . 4.020 3.106 2.749 3.331 . 0 0 "[ . 1 . 2]" 1
259 1 20 ILE MG 1 91 VAL H . . 4.270 3.540 3.140 3.951 . 0 0 "[ . 1 . 2]" 1
260 1 20 ILE MG 1 91 VAL HA . . 5.060 4.961 4.564 5.089 0.029 12 0 "[ . 1 . 2]" 1
261 1 20 ILE MG 1 93 ILE H . . 5.420 5.057 4.720 5.388 . 0 0 "[ . 1 . 2]" 1
262 1 21 LEU H 1 21 LEU HB2 . . 3.350 2.467 2.340 2.607 . 0 0 "[ . 1 . 2]" 1
263 1 21 LEU H 1 21 LEU HB3 . . 4.120 3.627 3.571 3.695 . 0 0 "[ . 1 . 2]" 1
264 1 21 LEU H 1 21 LEU QD . . 3.920 2.619 2.037 3.323 . 0 0 "[ . 1 . 2]" 1
265 1 21 LEU H 1 21 LEU HG . . 4.400 3.546 2.428 4.375 . 0 0 "[ . 1 . 2]" 1
266 1 21 LEU H 1 91 VAL HB . . 4.290 3.816 3.566 4.085 . 0 0 "[ . 1 . 2]" 1
267 1 21 LEU H 1 92 THR MG . . 5.500 5.271 4.790 5.469 . 0 0 "[ . 1 . 2]" 1
268 1 21 LEU H 1 93 ILE H . . 4.750 3.473 3.074 3.911 . 0 0 "[ . 1 . 2]" 1
269 1 21 LEU HA 1 22 HIS H . . 3.120 2.251 2.198 2.306 . 0 0 "[ . 1 . 2]" 1
270 1 21 LEU HB2 1 22 HIS H . . 4.180 4.100 3.930 4.224 0.044 20 0 "[ . 1 . 2]" 1
271 1 21 LEU HB2 1 22 HIS HA . . 5.060 4.955 4.802 5.084 0.024 6 0 "[ . 1 . 2]" 1
272 1 21 LEU HB2 1 28 LEU QD . . 3.560 2.002 1.766 2.483 . 0 0 "[ . 1 . 2]" 1
273 1 21 LEU HB2 1 51 PRO HB3 . . 5.420 5.284 5.105 5.420 0.000 15 0 "[ . 1 . 2]" 1
274 1 21 LEU HB2 1 91 VAL H . . 4.850 4.522 4.329 4.646 . 0 0 "[ . 1 . 2]" 1
275 1 21 LEU HB2 1 91 VAL HB . . 3.870 3.822 3.629 3.899 0.029 20 0 "[ . 1 . 2]" 1
276 1 21 LEU HB3 1 21 LEU QD . . 3.190 2.330 2.068 2.572 . 0 0 "[ . 1 . 2]" 1
277 1 21 LEU HB3 1 22 HIS H . . 3.850 3.081 2.887 3.319 . 0 0 "[ . 1 . 2]" 1
278 1 21 LEU HB3 1 28 LEU QD . . 3.510 2.263 1.941 2.852 . 0 0 "[ . 1 . 2]" 1
279 1 21 LEU HB3 1 30 PHE QE . . 4.830 4.329 3.589 4.750 . 0 0 "[ . 1 . 2]" 1
280 1 21 LEU HB3 1 51 PRO HB2 . . 4.830 2.109 1.975 2.405 . 0 0 "[ . 1 . 2]" 1
281 1 21 LEU HB3 1 51 PRO HB3 . . 4.830 3.682 3.543 3.887 . 0 0 "[ . 1 . 2]" 1
282 1 21 LEU HB3 1 93 ILE MD . . 4.300 3.906 3.379 4.301 0.001 8 0 "[ . 1 . 2]" 1
283 1 21 LEU QD 1 22 HIS H . . 3.830 3.479 3.202 3.713 . 0 0 "[ . 1 . 2]" 1
284 1 21 LEU QD 1 30 PHE QE . . 3.320 2.373 1.949 3.161 . 0 0 "[ . 1 . 2]" 1
285 1 21 LEU QD 1 51 PRO HB2 . . 4.220 2.408 2.047 2.680 . 0 0 "[ . 1 . 2]" 1
286 1 21 LEU QD 1 51 PRO HB3 . . 4.140 3.763 3.449 4.006 . 0 0 "[ . 1 . 2]" 1
287 1 21 LEU QD 1 51 PRO HG3 . . 4.510 4.528 4.117 4.851 0.341 8 0 "[ . 1 . 2]" 1
288 1 21 LEU QD 1 52 ALA H . . 4.200 3.207 2.784 3.525 . 0 0 "[ . 1 . 2]" 1
289 1 21 LEU QD 1 52 ALA HA . . 2.910 1.843 1.704 1.978 . 0 0 "[ . 1 . 2]" 1
290 1 21 LEU QD 1 52 ALA MB . . 3.120 2.445 1.779 2.937 . 0 0 "[ . 1 . 2]" 1
291 1 21 LEU QD 1 55 SER H . . 4.300 3.616 3.516 3.711 . 0 0 "[ . 1 . 2]" 1
292 1 21 LEU QD 1 55 SER HA . . 4.400 4.356 4.321 4.405 0.005 19 0 "[ . 1 . 2]" 1
293 1 21 LEU QD 1 55 SER QB . . 3.250 2.308 2.080 2.530 . 0 0 "[ . 1 . 2]" 1
294 1 21 LEU QD 1 55 SER HG . . 4.300 2.573 1.845 3.724 . 0 0 "[ . 1 . 2]" 1
295 1 21 LEU QD 1 56 GLY H . . 5.500 4.482 3.998 4.722 . 0 0 "[ . 1 . 2]" 1
296 1 21 LEU QD 1 58 LEU H . . 4.830 3.230 2.669 4.471 . 0 0 "[ . 1 . 2]" 1
297 1 21 LEU QD 1 58 LEU QD . . 3.830 1.753 1.621 1.913 . 0 0 "[ . 1 . 2]" 1
298 1 21 LEU HG 1 30 PHE QD . . 5.060 3.697 2.632 5.181 0.121 17 0 "[ . 1 . 2]" 1
299 1 22 HIS H 1 22 HIS HB2 . . 3.850 2.423 2.323 2.550 . 0 0 "[ . 1 . 2]" 1
300 1 22 HIS H 1 22 HIS HB3 . . 3.550 3.620 3.564 3.702 0.152 12 0 "[ . 1 . 2]" 1
301 1 22 HIS H 1 22 HIS HD2 . . 5.060 3.706 2.276 4.973 . 0 0 "[ . 1 . 2]" 1
302 1 22 HIS H 1 28 LEU QD . . 4.650 3.843 3.499 4.113 . 0 0 "[ . 1 . 2]" 1
303 1 22 HIS H 1 51 PRO HB2 . . 5.500 2.290 1.948 2.672 . 0 0 "[ . 1 . 2]" 1
304 1 22 HIS H 1 51 PRO HB3 . . 4.830 2.435 1.926 2.908 . 0 0 "[ . 1 . 2]" 1
305 1 22 HIS HA 1 22 HIS HD2 . . 5.060 2.993 2.304 3.754 . 0 0 "[ . 1 . 2]" 1
306 1 22 HIS HA 1 23 LYS H . . 2.940 2.220 2.198 2.262 . 0 0 "[ . 1 . 2]" 1
307 1 22 HIS HA 1 23 LYS HA . . 4.510 4.430 4.402 4.476 . 0 0 "[ . 1 . 2]" 1
308 1 22 HIS HA 1 23 LYS HB2 . . 4.650 4.218 4.178 4.257 . 0 0 "[ . 1 . 2]" 1
309 1 22 HIS HA 1 23 LYS HG3 . . 5.060 4.916 4.696 5.026 . 0 0 "[ . 1 . 2]" 1
310 1 22 HIS HA 1 28 LEU QD . . 4.650 3.678 3.353 3.948 . 0 0 "[ . 1 . 2]" 1
311 1 22 HIS HA 1 89 GLN HA . . 4.650 4.298 4.187 4.469 . 0 0 "[ . 1 . 2]" 1
312 1 22 HIS HA 1 89 GLN QB . . 5.060 4.420 4.051 5.175 0.115 17 0 "[ . 1 . 2]" 1
313 1 22 HIS HA 1 90 SER H . . 5.190 5.027 4.714 5.155 . 0 0 "[ . 1 . 2]" 1
314 1 22 HIS HA 1 90 SER HA . . 3.300 2.993 2.630 3.186 . 0 0 "[ . 1 . 2]" 1
315 1 22 HIS HA 1 90 SER QB . . 5.060 4.542 4.209 4.741 . 0 0 "[ . 1 . 2]" 1
316 1 22 HIS HA 1 91 VAL H . . 4.140 3.587 3.237 3.727 . 0 0 "[ . 1 . 2]" 1
317 1 22 HIS HA 1 91 VAL HB . . 5.420 5.390 5.165 5.461 0.041 13 0 "[ . 1 . 2]" 1
318 1 22 HIS HA 1 91 VAL QG . . 4.510 4.291 3.897 4.431 . 0 0 "[ . 1 . 2]" 1
319 1 22 HIS HB2 1 23 LYS H . . 4.300 4.555 4.455 4.600 0.300 17 0 "[ . 1 . 2]" 1
320 1 22 HIS HB3 1 23 LYS H . . 4.660 3.892 3.772 4.030 . 0 0 "[ . 1 . 2]" 1
321 1 22 HIS HD2 1 90 SER HA . . 5.060 3.332 2.014 5.017 . 0 0 "[ . 1 . 2]" 1
322 1 22 HIS HE1 1 90 SER QB . . 5.420 4.303 2.537 5.237 . 0 0 "[ . 1 . 2]" 1
323 1 23 LYS H 1 23 LYS HB2 . . 3.720 2.181 2.104 2.256 . 0 0 "[ . 1 . 2]" 1
324 1 23 LYS H 1 23 LYS HB3 . . 3.920 3.466 3.414 3.507 . 0 0 "[ . 1 . 2]" 1
325 1 23 LYS H 1 23 LYS QD . . 5.060 4.472 4.209 4.603 . 0 0 "[ . 1 . 2]" 1
326 1 23 LYS H 1 23 LYS HG3 . . 3.880 2.857 2.634 3.003 . 0 0 "[ . 1 . 2]" 1
327 1 23 LYS H 1 24 GLY H . . 4.470 4.438 4.318 4.498 0.028 12 0 "[ . 1 . 2]" 1
328 1 23 LYS H 1 28 LEU QD . . 4.220 2.679 2.305 2.949 . 0 0 "[ . 1 . 2]" 1
329 1 23 LYS H 1 89 GLN HA . . 4.020 3.185 2.926 3.445 . 0 0 "[ . 1 . 2]" 1
330 1 23 LYS H 1 90 SER HA . . 4.220 4.173 3.962 4.242 0.022 13 0 "[ . 1 . 2]" 1
331 1 23 LYS H 1 91 VAL QG . . 4.830 3.480 3.229 3.961 . 0 0 "[ . 1 . 2]" 1
332 1 23 LYS HA 1 23 LYS QD . . 4.830 3.651 3.511 3.856 . 0 0 "[ . 1 . 2]" 1
333 1 23 LYS HA 1 23 LYS HE3 . . 5.060 5.025 4.801 5.813 0.753 4 4 "[ -+. 1 * . *2]" 1
334 1 23 LYS HA 1 23 LYS HG2 . . 3.350 2.058 1.998 2.222 . 0 0 "[ . 1 . 2]" 1
335 1 23 LYS HA 1 24 GLY H . . 2.860 2.182 2.177 2.211 . 0 0 "[ . 1 . 2]" 1
336 1 23 LYS HA 1 27 GLY H . . 5.030 4.306 3.235 4.979 . 0 0 "[ . 1 . 2]" 1
337 1 23 LYS HA 1 28 LEU HA . . 4.080 2.836 1.989 3.133 . 0 0 "[ . 1 . 2]" 1
338 1 23 LYS HA 1 28 LEU QD . . 3.270 2.504 2.322 2.637 . 0 0 "[ . 1 . 2]" 1
339 1 23 LYS HA 1 51 PRO HB2 . . 4.830 5.049 4.539 5.342 0.512 16 1 "[ . 1 .+ 2]" 1
340 1 23 LYS HA 1 51 PRO HG2 . . 4.220 3.654 3.181 3.918 . 0 0 "[ . 1 . 2]" 1
341 1 23 LYS HA 1 51 PRO HG3 . . 4.650 3.009 2.429 3.414 . 0 0 "[ . 1 . 2]" 1
342 1 23 LYS HB2 1 23 LYS HE3 . . 3.830 2.984 2.473 4.038 0.208 4 0 "[ . 1 . 2]" 1
343 1 23 LYS HB2 1 24 GLY H . . 4.650 4.631 4.559 4.705 0.055 5 0 "[ . 1 . 2]" 1
344 1 23 LYS HB2 1 28 LEU QD . . 4.220 3.377 3.164 3.527 . 0 0 "[ . 1 . 2]" 1
345 1 23 LYS HB2 1 89 GLN HA . . 3.410 2.248 1.993 2.364 . 0 0 "[ . 1 . 2]" 1
346 1 23 LYS HB2 1 91 VAL QG . . 4.510 3.739 3.453 4.158 . 0 0 "[ . 1 . 2]" 1
347 1 23 LYS HB3 1 23 LYS QD . . 3.470 2.130 2.026 2.312 . 0 0 "[ . 1 . 2]" 1
348 1 23 LYS HB3 1 23 LYS HE3 . . 4.650 3.508 2.828 4.466 . 0 0 "[ . 1 . 2]" 1
349 1 23 LYS HB3 1 24 GLY H . . 4.110 3.824 3.653 4.044 . 0 0 "[ . 1 . 2]" 1
350 1 23 LYS HB3 1 27 GLY H . . 5.500 4.673 2.917 5.515 0.015 16 0 "[ . 1 . 2]" 1
351 1 23 LYS HB3 1 27 GLY HA2 . . 4.650 4.468 3.994 4.714 0.064 18 0 "[ . 1 . 2]" 1
352 1 23 LYS HB3 1 28 LEU QD . . 4.020 3.859 3.694 3.976 . 0 0 "[ . 1 . 2]" 1
353 1 23 LYS HB3 1 89 GLN HA . . 3.790 3.667 3.452 3.790 . 0 0 "[ . 1 . 2]" 1
354 1 23 LYS QD 1 27 GLY H . . 5.060 4.022 2.426 4.716 . 0 0 "[ . 1 . 2]" 1
355 1 23 LYS QD 1 27 GLY HA2 . . 4.020 2.439 2.066 2.661 . 0 0 "[ . 1 . 2]" 1
356 1 23 LYS QD 1 28 LEU QD . . 4.510 2.991 2.226 3.510 . 0 0 "[ . 1 . 2]" 1
357 1 23 LYS QD 1 89 GLN HA . . 3.970 4.490 3.544 4.931 0.961 17 15 "[ * ******* ***-+* *]" 1
358 1 23 LYS QD 1 91 VAL QG . . 4.510 4.084 3.784 4.668 0.158 20 0 "[ . 1 . 2]" 1
359 1 23 LYS HE3 1 23 LYS HG3 . . 3.240 2.588 2.034 3.330 0.090 4 0 "[ . 1 . 2]" 1
360 1 23 LYS HE3 1 27 GLY HA2 . . 5.060 5.330 5.053 5.604 0.544 13 1 "[ . 1 + . 2]" 1
361 1 23 LYS HE3 1 28 LEU QD . . 4.080 3.639 2.902 4.225 0.145 8 0 "[ . 1 . 2]" 1
362 1 23 LYS HE3 1 91 VAL QG . . 3.490 3.172 2.275 3.452 . 0 0 "[ . 1 . 2]" 1
363 1 23 LYS HG2 1 24 GLY H . . 3.860 3.849 3.794 3.909 0.049 18 0 "[ . 1 . 2]" 1
364 1 23 LYS HG2 1 27 GLY H . . 4.920 4.091 2.988 4.639 . 0 0 "[ . 1 . 2]" 1
365 1 23 LYS HG2 1 27 GLY HA2 . . 4.020 3.004 2.054 3.470 . 0 0 "[ . 1 . 2]" 1
366 1 23 LYS HG2 1 27 GLY HA3 . . 4.400 4.162 3.531 4.453 0.053 13 0 "[ . 1 . 2]" 1
367 1 23 LYS HG2 1 28 LEU HA . . 4.830 2.918 2.202 3.621 . 0 0 "[ . 1 . 2]" 1
368 1 23 LYS HG2 1 28 LEU QD . . 3.060 2.034 1.859 2.479 . 0 0 "[ . 1 . 2]" 1
369 1 23 LYS HG3 1 89 GLN HA . . 4.140 4.106 3.897 4.171 0.031 13 0 "[ . 1 . 2]" 1
370 1 23 LYS HG3 1 91 VAL H . . 5.410 4.978 4.607 5.335 . 0 0 "[ . 1 . 2]" 1
371 1 23 LYS HG3 1 91 VAL QG . . 3.790 2.800 2.482 3.516 . 0 0 "[ . 1 . 2]" 1
372 1 24 GLY H 1 28 LEU HA . . 4.490 3.906 3.122 4.295 . 0 0 "[ . 1 . 2]" 1
373 1 24 GLY H 1 28 LEU QD . . 4.370 4.123 3.776 4.328 . 0 0 "[ . 1 . 2]" 1
374 1 24 GLY H 1 51 PRO HG2 . . 3.900 3.880 3.124 4.318 0.418 13 0 "[ . 1 . 2]" 1
375 1 24 GLY H 1 51 PRO HG3 . . 4.360 2.560 1.929 2.934 . 0 0 "[ . 1 . 2]" 1
376 1 25 SER HA 1 25 SER HB2 . . 2.930 2.888 2.534 3.005 0.075 12 0 "[ . 1 . 2]" 1
377 1 25 SER HA 1 25 SER HB3 . . 3.020 2.761 2.281 2.991 . 0 0 "[ . 1 . 2]" 1
378 1 25 SER HA 1 26 THR MG . . 5.060 4.388 2.888 5.047 . 0 0 "[ . 1 . 2]" 1
379 1 25 SER HA 1 27 GLY H . . 5.160 4.613 3.166 5.089 . 0 0 "[ . 1 . 2]" 1
380 1 25 SER HB2 1 26 THR MG . . 4.300 3.545 3.115 4.366 0.066 20 0 "[ . 1 . 2]" 1
381 1 25 SER HB3 1 26 THR H . . 5.270 2.952 2.283 4.614 . 0 0 "[ . 1 . 2]" 1
382 1 25 SER HB3 1 26 THR MG . . 4.400 2.925 2.083 4.251 . 0 0 "[ . 1 . 2]" 1
383 1 26 THR H 1 26 THR MG . . 4.080 2.201 1.874 2.759 . 0 0 "[ . 1 . 2]" 1
384 1 26 THR H 1 27 GLY H . . 4.130 2.703 1.892 3.514 . 0 0 "[ . 1 . 2]" 1
385 1 26 THR HA 1 26 THR MG . . 2.920 2.535 2.289 3.228 0.308 18 0 "[ . 1 . 2]" 1
386 1 26 THR HB 1 27 GLY H . . 5.060 4.053 3.501 4.676 . 0 0 "[ . 1 . 2]" 1
387 1 26 THR MG 1 27 GLY H . . 5.120 3.912 3.465 4.388 . 0 0 "[ . 1 . 2]" 1
388 1 27 GLY H 1 28 LEU H . . 5.500 4.243 4.046 4.629 . 0 0 "[ . 1 . 2]" 1
389 1 27 GLY HA2 1 29 GLY H . . 5.060 4.297 3.705 5.090 0.030 8 0 "[ . 1 . 2]" 1
390 1 27 GLY HA3 1 28 LEU HB2 . . 4.300 4.621 4.396 5.158 0.858 18 5 "[ . - 1 * *+ *]" 1
391 1 27 GLY HA3 1 29 GLY H . . 4.610 3.178 2.985 4.465 . 0 0 "[ . 1 . 2]" 1
392 1 28 LEU H 1 28 LEU QD . . 4.650 2.732 2.265 3.582 . 0 0 "[ . 1 . 2]" 1
393 1 28 LEU H 1 29 GLY H . . 4.400 2.316 2.195 2.994 . 0 0 "[ . 1 . 2]" 1
394 1 28 LEU HA 1 28 LEU QD . . 2.900 1.929 1.825 2.345 . 0 0 "[ . 1 . 2]" 1
395 1 28 LEU HA 1 28 LEU HG . . 3.660 3.313 2.727 3.601 . 0 0 "[ . 1 . 2]" 1
396 1 28 LEU HA 1 30 PHE QE . . 4.830 4.469 4.351 4.833 0.003 8 0 "[ . 1 . 2]" 1
397 1 28 LEU HA 1 51 PRO HB2 . . 4.080 4.288 3.968 4.662 0.582 8 2 "[ - . + 1 . 2]" 1
398 1 28 LEU HA 1 51 PRO HD3 . . 4.650 4.329 4.053 4.759 0.109 8 0 "[ . 1 . 2]" 1
399 1 28 LEU HA 1 51 PRO HG2 . . 3.580 2.270 1.977 2.828 . 0 0 "[ . 1 . 2]" 1
400 1 28 LEU HA 1 51 PRO HG3 . . 3.720 3.169 2.874 3.463 . 0 0 "[ . 1 . 2]" 1
401 1 28 LEU HB2 1 28 LEU QD . . 2.890 2.188 1.979 2.312 . 0 0 "[ . 1 . 2]" 1
402 1 28 LEU HB2 1 29 GLY H . . 4.570 3.454 2.255 3.578 . 0 0 "[ . 1 . 2]" 1
403 1 28 LEU HB2 1 30 PHE H . . 4.610 3.724 3.296 3.986 . 0 0 "[ . 1 . 2]" 1
404 1 28 LEU HB2 1 30 PHE QD . . 4.020 3.095 2.735 3.699 . 0 0 "[ . 1 . 2]" 1
405 1 28 LEU HB2 1 30 PHE QE . . 3.870 2.570 2.214 3.237 . 0 0 "[ . 1 . 2]" 1
406 1 28 LEU HB3 1 29 GLY H . . 4.640 4.068 2.899 4.198 . 0 0 "[ . 1 . 2]" 1
407 1 28 LEU HB3 1 30 PHE H . . 4.700 4.472 3.968 4.674 . 0 0 "[ . 1 . 2]" 1
408 1 28 LEU HB3 1 30 PHE QE . . 3.870 2.023 1.957 2.454 . 0 0 "[ . 1 . 2]" 1
409 1 28 LEU QD 1 29 GLY H . . 5.350 4.076 3.750 4.481 . 0 0 "[ . 1 . 2]" 1
410 1 28 LEU QD 1 30 PHE QE . . 3.330 2.599 1.824 3.057 . 0 0 "[ . 1 . 2]" 1
411 1 28 LEU QD 1 30 PHE HZ . . 4.140 2.849 1.956 3.669 . 0 0 "[ . 1 . 2]" 1
412 1 28 LEU QD 1 51 PRO HB2 . . 4.220 3.662 3.358 3.840 . 0 0 "[ . 1 . 2]" 1
413 1 28 LEU QD 1 51 PRO HB3 . . 4.510 4.484 4.282 4.555 0.045 20 0 "[ . 1 . 2]" 1
414 1 28 LEU QD 1 51 PRO HG2 . . 4.400 2.825 2.658 3.007 . 0 0 "[ . 1 . 2]" 1
415 1 28 LEU QD 1 52 ALA H . . 5.160 4.773 4.531 4.933 . 0 0 "[ . 1 . 2]" 1
416 1 28 LEU QD 1 84 LEU HB2 . . 4.650 4.251 3.805 4.578 . 0 0 "[ . 1 . 2]" 1
417 1 28 LEU QD 1 84 LEU HB3 . . 4.300 3.087 2.549 3.527 . 0 0 "[ . 1 . 2]" 1
418 1 28 LEU HG 1 30 PHE QE . . 4.830 2.916 2.144 4.272 . 0 0 "[ . 1 . 2]" 1
419 1 29 GLY H 1 30 PHE H . . 3.450 2.391 2.005 2.550 . 0 0 "[ . 1 . 2]" 1
420 1 29 GLY H 1 30 PHE QD . . 5.480 4.391 3.189 4.674 . 0 0 "[ . 1 . 2]" 1
421 1 29 GLY H 1 47 LEU QD . . 5.170 4.431 3.877 4.905 . 0 0 "[ . 1 . 2]" 1
422 1 29 GLY H 1 51 PRO HD3 . . 5.090 4.788 4.462 5.587 0.497 8 0 "[ . 1 . 2]" 1
423 1 29 GLY H 1 52 ALA H . . 5.500 4.919 4.718 5.072 . 0 0 "[ . 1 . 2]" 1
424 1 29 GLY H 1 52 ALA MB . . 4.840 4.251 3.550 4.448 . 0 0 "[ . 1 . 2]" 1
425 1 29 GLY HA2 1 47 LEU HB2 . . 4.140 2.597 2.411 2.897 . 0 0 "[ . 1 . 2]" 1
426 1 29 GLY HA2 1 47 LEU HB3 . . 4.220 2.163 1.898 2.791 . 0 0 "[ . 1 . 2]" 1
427 1 29 GLY HA2 1 47 LEU QD . . 4.020 2.853 2.421 3.344 . 0 0 "[ . 1 . 2]" 1
428 1 29 GLY HA2 1 51 PRO HD3 . . 4.510 4.523 4.366 4.666 0.156 8 0 "[ . 1 . 2]" 1
429 1 29 GLY HA2 1 52 ALA H . . 4.700 4.603 4.379 4.753 0.053 8 0 "[ . 1 . 2]" 1
430 1 29 GLY HA2 1 52 ALA MB . . 4.650 4.127 3.893 4.294 . 0 0 "[ . 1 . 2]" 1
431 1 29 GLY HA3 1 47 LEU HB2 . . 4.220 3.764 3.141 4.088 . 0 0 "[ . 1 . 2]" 1
432 1 29 GLY HA3 1 47 LEU HB3 . . 4.400 2.511 2.242 2.760 . 0 0 "[ . 1 . 2]" 1
433 1 29 GLY HA3 1 47 LEU QD . . 4.400 3.085 2.494 3.755 . 0 0 "[ . 1 . 2]" 1
434 1 29 GLY HA3 1 51 PRO HD3 . . 3.630 3.453 3.354 3.584 . 0 0 "[ . 1 . 2]" 1
435 1 29 GLY HA3 1 52 ALA H . . 3.810 2.882 2.642 3.038 . 0 0 "[ . 1 . 2]" 1
436 1 30 PHE H 1 30 PHE HD1 . . 3.800 4.166 4.009 4.322 0.522 13 2 "[ . - + . 2]" 1
437 1 30 PHE H 1 30 PHE QD . . 4.130 3.509 3.432 3.628 . 0 0 "[ . 1 . 2]" 1
438 1 30 PHE H 1 30 PHE HD2 . . 3.800 3.778 3.731 3.929 0.129 18 0 "[ . 1 . 2]" 1
439 1 30 PHE H 1 31 ASN H . . 4.720 4.253 4.206 4.293 . 0 0 "[ . 1 . 2]" 1
440 1 30 PHE HA 1 30 PHE QD . . 4.140 3.628 3.584 3.713 . 0 0 "[ . 1 . 2]" 1
441 1 30 PHE HA 1 31 ASN H . . 3.130 2.308 2.276 2.355 . 0 0 "[ . 1 . 2]" 1
442 1 30 PHE HA 1 43 VAL MG1 . . 4.300 3.720 3.554 3.914 . 0 0 "[ . 1 . 2]" 1
443 1 30 PHE HA 1 45 PHE H . . 4.950 4.275 4.133 4.599 . 0 0 "[ . 1 . 2]" 1
444 1 30 PHE HA 1 45 PHE QD . . 4.650 3.694 3.026 3.964 . 0 0 "[ . 1 . 2]" 1
445 1 30 PHE HA 1 46 ILE HA . . 3.300 1.967 1.915 2.169 . 0 0 "[ . 1 . 2]" 1
446 1 30 PHE HA 1 46 ILE MD . . 4.400 3.325 3.026 4.023 . 0 0 "[ . 1 . 2]" 1
447 1 30 PHE HA 1 46 ILE MG . . 4.020 3.669 3.495 3.867 . 0 0 "[ . 1 . 2]" 1
448 1 30 PHE HA 1 47 LEU H . . 3.970 2.708 2.354 2.933 . 0 0 "[ . 1 . 2]" 1
449 1 30 PHE HA 1 52 ALA MB . . 4.300 3.784 3.699 3.935 . 0 0 "[ . 1 . 2]" 1
450 1 30 PHE HB2 1 31 ASN H . . 3.520 3.044 2.853 3.169 . 0 0 "[ . 1 . 2]" 1
451 1 30 PHE HB2 1 31 ASN HA . . 5.420 4.945 4.811 5.004 . 0 0 "[ . 1 . 2]" 1
452 1 30 PHE HB2 1 43 VAL MG1 . . 3.400 2.550 2.406 2.754 . 0 0 "[ . 1 . 2]" 1
453 1 30 PHE HB2 1 45 PHE H . . 4.670 4.380 4.074 4.603 . 0 0 "[ . 1 . 2]" 1
454 1 30 PHE HB2 1 46 ILE HA . . 4.220 3.141 2.795 3.397 . 0 0 "[ . 1 . 2]" 1
455 1 30 PHE HB2 1 46 ILE MD . . 3.790 2.197 1.891 2.835 . 0 0 "[ . 1 . 2]" 1
456 1 30 PHE HB2 1 46 ILE HG12 . . 4.510 2.933 2.465 3.325 . 0 0 "[ . 1 . 2]" 1
457 1 30 PHE HB2 1 46 ILE HG13 . . 4.830 4.279 4.106 4.618 . 0 0 "[ . 1 . 2]" 1
458 1 30 PHE HB2 1 46 ILE MG . . 4.650 3.769 3.660 3.962 . 0 0 "[ . 1 . 2]" 1
459 1 30 PHE HB2 1 47 LEU H . . 5.500 4.627 4.205 4.919 . 0 0 "[ . 1 . 2]" 1
460 1 30 PHE HB2 1 52 ALA MB . . 4.020 3.200 3.101 3.357 . 0 0 "[ . 1 . 2]" 1
461 1 30 PHE HB2 1 58 LEU QD . . 4.650 3.025 2.539 3.470 . 0 0 "[ . 1 . 2]" 1
462 1 30 PHE HB3 1 31 ASN H . . 4.220 4.229 4.072 4.312 0.092 12 0 "[ . 1 . 2]" 1
463 1 30 PHE HB3 1 46 ILE HA . . 3.920 3.170 2.771 3.418 . 0 0 "[ . 1 . 2]" 1
464 1 30 PHE HB3 1 46 ILE HB . . 5.420 5.281 5.130 5.374 . 0 0 "[ . 1 . 2]" 1
465 1 30 PHE HB3 1 46 ILE MD . . 3.580 2.054 1.939 2.650 . 0 0 "[ . 1 . 2]" 1
466 1 30 PHE HB3 1 46 ILE HG12 . . 4.220 3.831 3.297 4.137 . 0 0 "[ . 1 . 2]" 1
467 1 30 PHE HB3 1 46 ILE HG13 . . 4.650 4.870 4.811 4.907 0.257 13 0 "[ . 1 . 2]" 1
468 1 30 PHE HB3 1 46 ILE MG . . 2.970 3.037 2.997 3.089 0.119 12 0 "[ . 1 . 2]" 1
469 1 30 PHE HB3 1 47 LEU H . . 5.050 3.952 3.430 4.297 . 0 0 "[ . 1 . 2]" 1
470 1 30 PHE HB3 1 52 ALA H . . 5.050 4.429 4.274 4.612 . 0 0 "[ . 1 . 2]" 1
471 1 30 PHE HB3 1 52 ALA MB . . 3.400 2.010 1.931 2.096 . 0 0 "[ . 1 . 2]" 1
472 1 30 PHE HB3 1 58 LEU QD . . 4.220 2.933 2.562 3.359 . 0 0 "[ . 1 . 2]" 1
473 1 30 PHE QD 1 31 ASN H . . 4.210 3.143 2.919 3.360 . 0 0 "[ . 1 . 2]" 1
474 1 30 PHE QD 1 31 ASN HA . . 4.400 3.288 3.171 3.513 . 0 0 "[ . 1 . 2]" 1
475 1 30 PHE QD 1 32 ILE HA . . 4.650 4.166 4.057 4.290 . 0 0 "[ . 1 . 2]" 1
476 1 30 PHE QD 1 32 ILE MG . . 3.400 2.406 2.240 2.641 . 0 0 "[ . 1 . 2]" 1
477 1 30 PHE QD 1 43 VAL HA . . 4.300 3.945 3.783 4.087 . 0 0 "[ . 1 . 2]" 1
478 1 30 PHE QD 1 43 VAL MG1 . . 3.410 3.232 3.089 3.379 . 0 0 "[ . 1 . 2]" 1
479 1 30 PHE QD 1 43 VAL MG2 . . 3.300 3.039 2.709 3.277 . 0 0 "[ . 1 . 2]" 1
480 1 30 PHE QD 1 45 PHE H . . 5.000 4.666 4.440 4.860 . 0 0 "[ . 1 . 2]" 1
481 1 30 PHE QD 1 46 ILE MD . . 4.300 3.479 3.288 3.943 . 0 0 "[ . 1 . 2]" 1
482 1 30 PHE QD 1 46 ILE MG . . 4.830 4.473 4.311 4.573 . 0 0 "[ . 1 . 2]" 1
483 1 30 PHE QD 1 52 ALA H . . 5.030 4.034 3.781 4.234 . 0 0 "[ . 1 . 2]" 1
484 1 30 PHE QD 1 52 ALA HA . . 5.060 3.975 3.599 4.192 . 0 0 "[ . 1 . 2]" 1
485 1 30 PHE QD 1 52 ALA MB . . 2.990 1.873 1.757 1.929 . 0 0 "[ . 1 . 2]" 1
486 1 30 PHE QD 1 58 LEU QD . . 3.630 2.257 2.034 2.550 . 0 0 "[ . 1 . 2]" 1
487 1 30 PHE QD 1 58 LEU HG . . 4.830 4.388 3.593 5.017 0.187 18 0 "[ . 1 . 2]" 1
488 1 30 PHE QD 1 64 ILE MD . . 4.400 4.206 3.976 4.426 0.026 17 0 "[ . 1 . 2]" 1
489 1 30 PHE QE 1 32 ILE MD . . 4.650 4.006 3.632 4.307 . 0 0 "[ . 1 . 2]" 1
490 1 30 PHE QE 1 32 ILE MG . . 2.780 1.824 1.757 1.962 . 0 0 "[ . 1 . 2]" 1
491 1 30 PHE QE 1 52 ALA MB . . 4.220 3.751 3.486 3.889 . 0 0 "[ . 1 . 2]" 1
492 1 30 PHE QE 1 58 LEU QD . . 4.650 2.825 2.606 3.046 . 0 0 "[ . 1 . 2]" 1
493 1 30 PHE QE 1 64 ILE MD . . 3.870 3.334 3.086 3.595 . 0 0 "[ . 1 . 2]" 1
494 1 30 PHE QE 1 93 ILE MD . . 3.090 2.320 2.018 2.818 . 0 0 "[ . 1 . 2]" 1
495 1 30 PHE HZ 1 64 ILE MD . . 4.400 3.581 3.249 3.916 . 0 0 "[ . 1 . 2]" 1
496 1 30 PHE HZ 1 64 ILE MG . . 5.060 4.557 4.164 4.901 . 0 0 "[ . 1 . 2]" 1
497 1 30 PHE HZ 1 84 LEU HB3 . . 5.420 5.130 4.484 5.417 . 0 0 "[ . 1 . 2]" 1
498 1 30 PHE HZ 1 84 LEU QD . . 3.100 2.225 1.708 2.542 . 0 0 "[ . 1 . 2]" 1
499 1 30 PHE HZ 1 84 LEU HG . . 5.420 3.441 2.646 4.762 . 0 0 "[ . 1 . 2]" 1
500 1 30 PHE HZ 1 93 ILE HG12 . . 5.060 2.345 1.987 2.693 . 0 0 "[ . 1 . 2]" 1
501 1 30 PHE HZ 1 93 ILE HG13 . . 5.420 3.840 3.520 4.186 . 0 0 "[ . 1 . 2]" 1
502 1 30 PHE HZ 1 93 ILE MG . . 4.510 3.154 2.814 3.658 . 0 0 "[ . 1 . 2]" 1
503 1 31 ASN H 1 31 ASN HB2 . . 3.770 2.267 2.220 2.348 . 0 0 "[ . 1 . 2]" 1
504 1 31 ASN H 1 31 ASN HB3 . . 4.110 3.039 2.961 3.154 . 0 0 "[ . 1 . 2]" 1
505 1 31 ASN H 1 43 VAL MG1 . . 4.170 2.784 2.636 2.965 . 0 0 "[ . 1 . 2]" 1
506 1 31 ASN H 1 45 PHE H . . 3.700 2.428 2.291 2.782 . 0 0 "[ . 1 . 2]" 1
507 1 31 ASN H 1 45 PHE HB2 . . 5.060 4.812 4.644 4.943 . 0 0 "[ . 1 . 2]" 1
508 1 31 ASN H 1 45 PHE HB3 . . 4.130 3.365 3.135 3.529 . 0 0 "[ . 1 . 2]" 1
509 1 31 ASN H 1 45 PHE QD . . 4.750 3.688 3.072 3.946 . 0 0 "[ . 1 . 2]" 1
510 1 31 ASN H 1 46 ILE HA . . 4.500 3.538 3.399 3.645 . 0 0 "[ . 1 . 2]" 1
511 1 31 ASN H 1 46 ILE MD . . 5.060 4.351 4.059 5.004 . 0 0 "[ . 1 . 2]" 1
512 1 31 ASN H 1 47 LEU H . . 5.450 4.741 4.455 4.963 . 0 0 "[ . 1 . 2]" 1
513 1 31 ASN H 1 52 ALA MB . . 5.380 5.361 5.317 5.415 0.035 4 0 "[ . 1 . 2]" 1
514 1 31 ASN HA 1 31 ASN HD21 . . 4.830 4.072 3.534 4.366 . 0 0 "[ . 1 . 2]" 1
515 1 31 ASN HA 1 32 ILE H . . 3.150 2.642 2.588 2.679 . 0 0 "[ . 1 . 2]" 1
516 1 31 ASN HA 1 32 ILE HA . . 5.060 4.552 4.519 4.576 . 0 0 "[ . 1 . 2]" 1
517 1 31 ASN HA 1 32 ILE HG12 . . 4.510 3.796 3.641 4.000 . 0 0 "[ . 1 . 2]" 1
518 1 31 ASN HA 1 32 ILE HG13 . . 4.830 4.276 3.834 4.685 . 0 0 "[ . 1 . 2]" 1
519 1 31 ASN HA 1 32 ILE MG . . 4.400 3.679 3.406 4.060 . 0 0 "[ . 1 . 2]" 1
520 1 31 ASN HA 1 45 PHE HB3 . . 5.060 5.058 4.779 5.102 0.042 3 0 "[ . 1 . 2]" 1
521 1 31 ASN HB2 1 32 ILE H . . 4.140 3.918 3.857 3.995 . 0 0 "[ . 1 . 2]" 1
522 1 31 ASN HB2 1 43 VAL MG1 . . 5.420 4.235 4.025 4.446 . 0 0 "[ . 1 . 2]" 1
523 1 31 ASN HB2 1 44 SER H . . 5.290 3.655 3.457 3.804 . 0 0 "[ . 1 . 2]" 1
524 1 31 ASN HB2 1 44 SER HB3 . . 5.420 3.817 3.664 3.978 . 0 0 "[ . 1 . 2]" 1
525 1 31 ASN HB2 1 45 PHE H . . 4.290 2.884 2.524 3.249 . 0 0 "[ . 1 . 2]" 1
526 1 31 ASN HB2 1 45 PHE HB2 . . 3.970 3.919 3.722 3.983 0.013 15 0 "[ . 1 . 2]" 1
527 1 31 ASN HB2 1 45 PHE HB3 . . 3.720 2.318 2.058 2.414 . 0 0 "[ . 1 . 2]" 1
528 1 31 ASN HB2 1 45 PHE QD . . 4.650 3.297 2.993 3.564 . 0 0 "[ . 1 . 2]" 1
529 1 31 ASN HB3 1 32 ILE H . . 3.720 2.707 2.539 2.849 . 0 0 "[ . 1 . 2]" 1
530 1 31 ASN HB3 1 32 ILE HG12 . . 5.420 5.377 5.288 5.411 . 0 0 "[ . 1 . 2]" 1
531 1 31 ASN HB3 1 32 ILE MG . . 5.420 4.640 4.509 4.854 . 0 0 "[ . 1 . 2]" 1
532 1 31 ASN HB3 1 33 VAL MG1 . . 5.060 3.513 3.427 3.621 . 0 0 "[ . 1 . 2]" 1
533 1 31 ASN HB3 1 45 PHE H . . 4.840 2.837 2.567 3.274 . 0 0 "[ . 1 . 2]" 1
534 1 31 ASN HB3 1 45 PHE HB2 . . 4.220 4.620 4.437 4.676 0.456 10 0 "[ . 1 . 2]" 1
535 1 31 ASN HB3 1 45 PHE HB3 . . 3.920 3.452 3.176 3.554 . 0 0 "[ . 1 . 2]" 1
536 1 31 ASN HB3 1 45 PHE QD . . 5.060 4.886 4.587 5.065 0.005 12 0 "[ . 1 . 2]" 1
537 1 31 ASN HD21 1 45 PHE HB2 . . 5.360 4.413 4.024 4.840 . 0 0 "[ . 1 . 2]" 1
538 1 31 ASN HD21 1 45 PHE HB3 . . 5.160 3.186 2.860 3.506 . 0 0 "[ . 1 . 2]" 1
539 1 31 ASN HD22 1 32 ILE H . . 5.290 4.602 4.192 4.884 . 0 0 "[ . 1 . 2]" 1
540 1 31 ASN HD22 1 45 PHE HB3 . . 5.060 4.816 4.556 4.999 . 0 0 "[ . 1 . 2]" 1
541 1 32 ILE H 1 32 ILE MD . . 4.300 3.934 3.750 4.054 . 0 0 "[ . 1 . 2]" 1
542 1 32 ILE H 1 32 ILE HG12 . . 3.560 2.883 2.670 3.058 . 0 0 "[ . 1 . 2]" 1
543 1 32 ILE H 1 32 ILE HG13 . . 3.780 2.285 2.000 2.512 . 0 0 "[ . 1 . 2]" 1
544 1 32 ILE H 1 32 ILE MG . . 3.830 3.283 3.088 3.466 . 0 0 "[ . 1 . 2]" 1
545 1 32 ILE H 1 33 VAL H . . 5.160 4.406 4.373 4.448 . 0 0 "[ . 1 . 2]" 1
546 1 32 ILE HA 1 32 ILE MD . . 4.510 4.074 4.026 4.101 . 0 0 "[ . 1 . 2]" 1
547 1 32 ILE HA 1 32 ILE MG . . 3.060 2.255 2.094 2.350 . 0 0 "[ . 1 . 2]" 1
548 1 32 ILE HA 1 33 VAL H . . 3.270 2.388 2.333 2.510 . 0 0 "[ . 1 . 2]" 1
549 1 32 ILE HA 1 33 VAL MG1 . . 4.220 3.110 2.830 3.330 . 0 0 "[ . 1 . 2]" 1
550 1 32 ILE HA 1 33 VAL MG2 . . 4.400 4.042 3.825 4.277 . 0 0 "[ . 1 . 2]" 1
551 1 32 ILE HA 1 41 ILE MG . . 4.020 3.608 3.391 3.849 . 0 0 "[ . 1 . 2]" 1
552 1 32 ILE HA 1 43 VAL HA . . 3.610 2.209 2.017 2.358 . 0 0 "[ . 1 . 2]" 1
553 1 32 ILE HA 1 44 SER H . . 3.540 2.813 2.374 2.915 . 0 0 "[ . 1 . 2]" 1
554 1 32 ILE HA 1 44 SER HB3 . . 5.420 3.556 3.224 3.685 . 0 0 "[ . 1 . 2]" 1
555 1 32 ILE HA 1 45 PHE H . . 4.850 4.760 4.417 4.855 0.005 4 0 "[ . 1 . 2]" 1
556 1 32 ILE HB 1 32 ILE MD . . 3.250 2.030 1.962 2.169 . 0 0 "[ . 1 . 2]" 1
557 1 32 ILE HB 1 33 VAL H . . 3.700 2.683 2.399 2.850 . 0 0 "[ . 1 . 2]" 1
558 1 32 ILE HB 1 41 ILE MG . . 3.140 2.296 2.111 2.505 . 0 0 "[ . 1 . 2]" 1
559 1 32 ILE HB 1 42 PHE H . . 4.880 3.996 3.636 4.494 . 0 0 "[ . 1 . 2]" 1
560 1 32 ILE HB 1 44 SER H . . 5.420 5.326 4.929 5.435 0.015 10 0 "[ . 1 . 2]" 1
561 1 32 ILE MD 1 32 ILE MG . . 2.920 2.438 2.300 2.580 . 0 0 "[ . 1 . 2]" 1
562 1 32 ILE MD 1 33 VAL H . . 4.870 4.102 3.777 4.410 . 0 0 "[ . 1 . 2]" 1
563 1 32 ILE MD 1 41 ILE MG . . 2.980 2.586 2.256 2.961 . 0 0 "[ . 1 . 2]" 1
564 1 32 ILE MD 1 77 HIS HD2 . . 4.140 1.986 1.825 2.385 . 0 0 "[ . 1 . 2]" 1
565 1 32 ILE MD 1 77 HIS HE1 . . 4.830 4.791 4.646 4.822 . 0 0 "[ . 1 . 2]" 1
566 1 32 ILE MD 1 80 ALA H . . 4.830 4.185 3.796 4.515 . 0 0 "[ . 1 . 2]" 1
567 1 32 ILE MD 1 80 ALA HA . . 4.510 4.187 3.911 4.506 . 0 0 "[ . 1 . 2]" 1
568 1 32 ILE MD 1 80 ALA MB . . 2.880 2.173 1.944 2.496 . 0 0 "[ . 1 . 2]" 1
569 1 32 ILE MD 1 81 ALA H . . 4.010 3.317 2.991 3.647 . 0 0 "[ . 1 . 2]" 1
570 1 32 ILE MD 1 81 ALA HA . . 3.630 2.750 2.473 3.007 . 0 0 "[ . 1 . 2]" 1
571 1 32 ILE MD 1 81 ALA MB . . 3.510 2.640 2.382 2.903 . 0 0 "[ . 1 . 2]" 1
572 1 32 ILE MD 1 84 LEU HB2 . . 4.650 4.386 3.997 4.646 . 0 0 "[ . 1 . 2]" 1
573 1 32 ILE MD 1 84 LEU QD . . 3.250 2.773 2.164 3.154 . 0 0 "[ . 1 . 2]" 1
574 1 32 ILE HG12 1 33 VAL H . . 5.420 5.175 5.015 5.313 . 0 0 "[ . 1 . 2]" 1
575 1 32 ILE HG12 1 77 HIS HD2 . . 5.420 4.346 3.868 4.925 . 0 0 "[ . 1 . 2]" 1
576 1 32 ILE HG12 1 81 ALA HA . . 5.420 4.504 4.165 4.814 . 0 0 "[ . 1 . 2]" 1
577 1 32 ILE HG13 1 32 ILE MG . . 3.510 3.168 3.117 3.204 . 0 0 "[ . 1 . 2]" 1
578 1 32 ILE HG13 1 33 VAL H . . 5.410 4.298 4.020 4.621 . 0 0 "[ . 1 . 2]" 1
579 1 32 ILE HG13 1 77 HIS HD2 . . 5.420 3.174 2.631 3.736 . 0 0 "[ . 1 . 2]" 1
580 1 32 ILE HG13 1 77 HIS HE1 . . 4.650 4.392 4.017 4.657 0.007 15 0 "[ . 1 . 2]" 1
581 1 32 ILE MG 1 33 VAL H . . 3.970 3.554 3.307 3.711 . 0 0 "[ . 1 . 2]" 1
582 1 32 ILE MG 1 41 ILE MG . . 2.860 2.685 2.217 2.881 0.021 9 0 "[ . 1 . 2]" 1
583 1 32 ILE MG 1 42 PHE H . . 5.080 4.341 3.969 4.710 . 0 0 "[ . 1 . 2]" 1
584 1 32 ILE MG 1 43 VAL H . . 5.270 4.508 3.918 4.964 . 0 0 "[ . 1 . 2]" 1
585 1 32 ILE MG 1 43 VAL HA . . 3.490 2.953 2.501 3.241 . 0 0 "[ . 1 . 2]" 1
586 1 32 ILE MG 1 44 SER H . . 4.330 4.034 3.651 4.126 . 0 0 "[ . 1 . 2]" 1
587 1 32 ILE MG 1 81 ALA HA . . 5.420 4.949 4.603 5.386 . 0 0 "[ . 1 . 2]" 1
588 1 33 VAL H 1 33 VAL MG1 . . 3.970 2.753 2.512 2.928 . 0 0 "[ . 1 . 2]" 1
589 1 33 VAL H 1 33 VAL MG2 . . 3.630 2.519 2.335 2.689 . 0 0 "[ . 1 . 2]" 1
590 1 33 VAL H 1 34 GLY H . . 5.500 4.393 4.373 4.421 . 0 0 "[ . 1 . 2]" 1
591 1 33 VAL H 1 41 ILE MG . . 4.400 2.628 2.453 2.781 . 0 0 "[ . 1 . 2]" 1
592 1 33 VAL H 1 42 PHE H . . 4.040 2.243 2.091 2.382 . 0 0 "[ . 1 . 2]" 1
593 1 33 VAL H 1 42 PHE HB2 . . 5.500 3.849 3.687 4.128 . 0 0 "[ . 1 . 2]" 1
594 1 33 VAL H 1 43 VAL HA . . 5.280 3.813 3.662 3.928 . 0 0 "[ . 1 . 2]" 1
595 1 33 VAL H 1 44 SER H . . 4.530 4.424 4.202 4.495 . 0 0 "[ . 1 . 2]" 1
596 1 33 VAL H 1 44 SER HB3 . . 5.370 4.309 4.128 4.485 . 0 0 "[ . 1 . 2]" 1
597 1 33 VAL HA 1 33 VAL MG1 . . 3.380 2.490 2.377 2.625 . 0 0 "[ . 1 . 2]" 1
598 1 33 VAL HA 1 33 VAL MG2 . . 3.580 3.185 3.160 3.208 . 0 0 "[ . 1 . 2]" 1
599 1 33 VAL HA 1 34 GLY H . . 3.330 2.592 2.435 2.649 . 0 0 "[ . 1 . 2]" 1
600 1 33 VAL HA 1 77 HIS HD2 . . 4.300 4.185 4.054 4.273 . 0 0 "[ . 1 . 2]" 1
601 1 33 VAL HA 1 77 HIS HE1 . . 4.220 3.594 2.433 4.191 . 0 0 "[ . 1 . 2]" 1
602 1 33 VAL HB 1 34 GLY H . . 3.630 2.421 2.272 2.706 . 0 0 "[ . 1 . 2]" 1
603 1 33 VAL HB 1 34 GLY HA2 . . 4.830 4.401 4.265 4.555 . 0 0 "[ . 1 . 2]" 1
604 1 33 VAL HB 1 44 SER HB2 . . 4.650 4.243 4.011 4.389 . 0 0 "[ . 1 . 2]" 1
605 1 33 VAL HB 1 44 SER HB3 . . 4.400 4.482 4.360 4.633 0.233 8 0 "[ . 1 . 2]" 1
606 1 33 VAL HB 1 105 PHE QE . . 5.420 3.928 3.321 4.353 . 0 0 "[ . 1 . 2]" 1
607 1 33 VAL MG1 1 34 GLY H . . 4.140 3.930 3.841 4.092 . 0 0 "[ . 1 . 2]" 1
608 1 33 VAL MG1 1 42 PHE H . . 4.900 4.151 3.962 4.336 . 0 0 "[ . 1 . 2]" 1
609 1 33 VAL MG1 1 42 PHE HB2 . . 4.080 3.946 3.845 4.048 . 0 0 "[ . 1 . 2]" 1
610 1 33 VAL MG1 1 42 PHE HB3 . . 4.650 4.619 4.535 4.686 0.036 8 0 "[ . 1 . 2]" 1
611 1 33 VAL MG1 1 42 PHE QD . . 5.420 5.320 5.213 5.422 0.002 14 0 "[ . 1 . 2]" 1
612 1 33 VAL MG1 1 44 SER H . . 4.900 2.926 2.720 3.143 . 0 0 "[ . 1 . 2]" 1
613 1 33 VAL MG1 1 44 SER HA . . 4.510 2.593 2.337 2.890 . 0 0 "[ . 1 . 2]" 1
614 1 33 VAL MG1 1 44 SER HB2 . . 3.690 1.853 1.806 1.941 . 0 0 "[ . 1 . 2]" 1
615 1 33 VAL MG1 1 44 SER HB3 . . 3.410 1.835 1.795 1.904 . 0 0 "[ . 1 . 2]" 1
616 1 33 VAL MG1 1 45 PHE H . . 5.420 4.448 4.290 4.571 . 0 0 "[ . 1 . 2]" 1
617 1 33 VAL MG1 1 77 HIS HE1 . . 5.060 4.129 2.951 4.665 . 0 0 "[ . 1 . 2]" 1
618 1 33 VAL MG1 1 102 TYR QD . . 4.650 4.337 3.941 4.559 . 0 0 "[ . 1 . 2]" 1
619 1 33 VAL MG1 1 102 TYR QE . . 3.870 2.945 2.377 3.292 . 0 0 "[ . 1 . 2]" 1
620 1 33 VAL MG1 1 105 PHE QB . . 4.400 3.755 3.400 4.058 . 0 0 "[ . 1 . 2]" 1
621 1 33 VAL MG1 1 105 PHE QD . . 4.510 4.180 3.755 4.399 . 0 0 "[ . 1 . 2]" 1
622 1 33 VAL MG1 1 105 PHE QE . . 5.060 4.743 4.529 4.958 . 0 0 "[ . 1 . 2]" 1
623 1 33 VAL MG2 1 34 GLY H . . 3.760 2.782 2.448 3.166 . 0 0 "[ . 1 . 2]" 1
624 1 33 VAL MG2 1 34 GLY HA2 . . 5.060 3.416 3.070 3.916 . 0 0 "[ . 1 . 2]" 1
625 1 33 VAL MG2 1 42 PHE H . . 4.400 2.497 1.919 2.790 . 0 0 "[ . 1 . 2]" 1
626 1 33 VAL MG2 1 42 PHE HB2 . . 3.660 1.918 1.808 2.049 . 0 0 "[ . 1 . 2]" 1
627 1 33 VAL MG2 1 42 PHE HB3 . . 3.970 3.103 2.786 3.376 . 0 0 "[ . 1 . 2]" 1
628 1 33 VAL MG2 1 42 PHE QD . . 5.060 3.110 2.721 3.312 . 0 0 "[ . 1 . 2]" 1
629 1 33 VAL MG2 1 43 VAL HA . . 5.060 4.371 3.993 4.813 . 0 0 "[ . 1 . 2]" 1
630 1 33 VAL MG2 1 44 SER HA . . 4.510 3.758 3.495 4.118 . 0 0 "[ . 1 . 2]" 1
631 1 33 VAL MG2 1 44 SER HB2 . . 3.970 3.900 3.691 3.987 0.017 6 0 "[ . 1 . 2]" 1
632 1 33 VAL MG2 1 102 TYR QD . . 4.080 3.048 2.640 3.400 . 0 0 "[ . 1 . 2]" 1
633 1 33 VAL MG2 1 102 TYR QE . . 3.490 2.862 2.014 3.340 . 0 0 "[ . 1 . 2]" 1
634 1 33 VAL MG2 1 105 PHE QB . . 4.220 2.992 2.720 3.237 . 0 0 "[ . 1 . 2]" 1
635 1 33 VAL MG2 1 105 PHE QD . . 3.970 2.752 2.447 3.043 . 0 0 "[ . 1 . 2]" 1
636 1 33 VAL MG2 1 105 PHE QE . . 4.220 2.746 2.390 3.190 . 0 0 "[ . 1 . 2]" 1
637 1 33 VAL MG2 1 105 PHE HZ . . 4.830 3.180 2.852 3.816 . 0 0 "[ . 1 . 2]" 1
638 1 34 GLY H 1 41 ILE MD . . 5.500 4.317 4.130 4.720 . 0 0 "[ . 1 . 2]" 1
639 1 34 GLY H 1 77 HIS HB2 . . 5.500 4.501 4.181 4.878 . 0 0 "[ . 1 . 2]" 1
640 1 34 GLY H 1 105 PHE QD . . 5.320 4.775 4.143 5.257 . 0 0 "[ . 1 . 2]" 1
641 1 34 GLY H 1 105 PHE QE . . 5.500 3.452 2.597 4.118 . 0 0 "[ . 1 . 2]" 1
642 1 34 GLY H 1 105 PHE HZ . . 5.500 3.743 3.461 4.148 . 0 0 "[ . 1 . 2]" 1
643 1 34 GLY HA2 1 35 GLY H . . 3.630 2.787 2.460 3.015 . 0 0 "[ . 1 . 2]" 1
644 1 34 GLY HA2 1 36 GLU H . . 4.830 3.763 3.017 4.681 . 0 0 "[ . 1 . 2]" 1
645 1 34 GLY HA2 1 41 ILE MD . . 4.400 3.939 3.711 4.132 . 0 0 "[ . 1 . 2]" 1
646 1 34 GLY HA2 1 42 PHE QD . . 4.830 4.458 4.132 4.740 . 0 0 "[ . 1 . 2]" 1
647 1 34 GLY HA2 1 105 PHE QE . . 4.510 3.132 2.479 3.772 . 0 0 "[ . 1 . 2]" 1
648 1 34 GLY HA2 1 105 PHE HZ . . 4.510 2.292 1.996 2.784 . 0 0 "[ . 1 . 2]" 1
649 1 34 GLY HA3 1 36 GLU H . . 5.420 4.253 3.784 5.059 . 0 0 "[ . 1 . 2]" 1
650 1 34 GLY HA3 1 40 GLY H . . 5.380 4.361 3.775 4.751 . 0 0 "[ . 1 . 2]" 1
651 1 34 GLY HA3 1 41 ILE HA . . 4.080 2.515 2.419 2.916 . 0 0 "[ . 1 . 2]" 1
652 1 34 GLY HA3 1 41 ILE MD . . 4.020 2.525 2.184 3.430 . 0 0 "[ . 1 . 2]" 1
653 1 34 GLY HA3 1 42 PHE H . . 4.830 3.779 3.588 4.239 . 0 0 "[ . 1 . 2]" 1
654 1 34 GLY HA3 1 42 PHE HB2 . . 5.060 4.927 4.489 5.117 0.057 16 0 "[ . 1 . 2]" 1
655 1 34 GLY HA3 1 42 PHE QD . . 4.830 3.603 3.075 3.843 . 0 0 "[ . 1 . 2]" 1
656 1 34 GLY HA3 1 105 PHE QE . . 4.830 4.009 3.258 4.574 . 0 0 "[ . 1 . 2]" 1
657 1 34 GLY HA3 1 105 PHE HZ . . 4.650 3.311 2.777 4.085 . 0 0 "[ . 1 . 2]" 1
658 1 35 GLY H 1 36 GLU H . . 3.910 2.148 1.938 2.456 . 0 0 "[ . 1 . 2]" 1
659 1 35 GLY H 1 39 GLU QB . . 5.210 4.741 2.476 5.338 0.128 7 0 "[ . 1 . 2]" 1
660 1 35 GLY H 1 39 GLU HG2 . . 4.450 3.146 2.462 4.055 . 0 0 "[ . 1 . 2]" 1
661 1 35 GLY H 1 41 ILE MD . . 4.020 2.975 2.216 3.431 . 0 0 "[ . 1 . 2]" 1
662 1 35 GLY H 1 42 PHE QD . . 5.500 5.484 5.361 5.526 0.026 10 0 "[ . 1 . 2]" 1
663 1 35 GLY H 1 105 PHE HZ . . 5.500 4.530 4.001 5.201 . 0 0 "[ . 1 . 2]" 1
664 1 35 GLY HA2 1 40 GLY H . . 5.380 4.417 3.194 4.960 . 0 0 "[ . 1 . 2]" 1
665 1 35 GLY HA2 1 41 ILE MD . . 3.690 3.049 2.117 3.437 . 0 0 "[ . 1 . 2]" 1
666 1 35 GLY HA2 1 76 THR HA . . 4.080 2.132 1.992 3.022 . 0 0 "[ . 1 . 2]" 1
667 1 35 GLY HA2 1 77 HIS H . . 4.460 3.293 2.873 4.316 . 0 0 "[ . 1 . 2]" 1
668 1 35 GLY HA2 1 77 HIS HB2 . . 5.060 4.473 3.945 4.841 . 0 0 "[ . 1 . 2]" 1
669 1 35 GLY HA3 1 41 ILE MD . . 3.580 3.336 2.026 3.580 . 11 0 "[ . 1 . 2]" 1
670 1 35 GLY HA3 1 76 THR HA . . 3.970 2.502 2.025 3.064 . 0 0 "[ . 1 . 2]" 1
671 1 35 GLY HA3 1 77 HIS H . . 4.060 2.096 1.942 3.048 . 0 0 "[ . 1 . 2]" 1
672 1 35 GLY HA3 1 77 HIS HB2 . . 5.060 2.866 2.379 3.200 . 0 0 "[ . 1 . 2]" 1
673 1 35 GLY HA3 1 77 HIS HB3 . . 5.060 4.136 3.640 4.602 . 0 0 "[ . 1 . 2]" 1
674 1 36 GLU H 1 36 GLU HB2 . . 3.580 2.707 2.408 3.854 0.274 19 0 "[ . 1 . 2]" 1
675 1 36 GLU H 1 36 GLU HB3 . . 3.940 3.732 3.340 3.863 . 0 0 "[ . 1 . 2]" 1
676 1 36 GLU H 1 36 GLU HG2 . . 3.980 3.333 2.506 3.755 . 0 0 "[ . 1 . 2]" 1
677 1 36 GLU H 1 36 GLU HG3 . . 4.510 3.347 2.130 4.028 . 0 0 "[ . 1 . 2]" 1
678 1 36 GLU H 1 39 GLU HG2 . . 4.130 2.931 2.345 4.098 . 0 0 "[ . 1 . 2]" 1
679 1 36 GLU H 1 41 ILE MD . . 5.500 4.678 4.200 4.968 . 0 0 "[ . 1 . 2]" 1
680 1 36 GLU HA 1 36 GLU HG2 . . 3.580 2.476 2.148 4.092 0.512 19 1 "[ . 1 . +2]" 1
681 1 36 GLU HA 1 37 ASP H . . 3.240 2.209 2.202 2.233 . 0 0 "[ . 1 . 2]" 1
682 1 36 GLU HA 1 38 GLY H . . 5.060 3.672 3.360 4.534 . 0 0 "[ . 1 . 2]" 1
683 1 36 GLU HB2 1 37 ASP H . . 4.400 4.323 3.432 4.474 0.074 7 0 "[ . 1 . 2]" 1
684 1 36 GLU HB2 1 39 GLU HG2 . . 4.830 3.680 2.393 4.898 0.068 19 0 "[ . 1 . 2]" 1
685 1 36 GLU HB2 1 39 GLU HG3 . . 5.420 4.548 3.925 6.407 0.987 19 1 "[ . 1 . +2]" 1
686 1 36 GLU HB3 1 36 GLU HG3 . . 3.040 2.911 2.702 3.028 . 0 0 "[ . 1 . 2]" 1
687 1 36 GLU HB3 1 37 ASP H . . 4.400 3.578 3.336 4.287 . 0 0 "[ . 1 . 2]" 1
688 1 36 GLU HB3 1 37 ASP HB2 . . 4.830 3.970 3.540 5.207 0.377 19 0 "[ . 1 . 2]" 1
689 1 36 GLU HB3 1 38 GLY H . . 5.500 5.137 4.921 5.486 . 0 0 "[ . 1 . 2]" 1
690 1 36 GLU HG2 1 37 ASP H . . 5.240 4.582 4.111 5.613 0.373 19 0 "[ . 1 . 2]" 1
691 1 37 ASP H 1 38 GLY H . . 3.740 2.905 2.626 3.789 0.049 15 0 "[ . 1 . 2]" 1
692 1 37 ASP H 1 39 GLU H . . 5.330 4.797 4.515 5.120 . 0 0 "[ . 1 . 2]" 1
693 1 37 ASP HA 1 38 GLY H . . 3.640 3.046 2.879 3.654 0.014 15 0 "[ . 1 . 2]" 1
694 1 37 ASP HB2 1 38 GLY H . . 4.700 4.017 1.954 4.539 . 0 0 "[ . 1 . 2]" 1
695 1 37 ASP HB2 1 39 GLU QB . . 4.650 3.887 3.379 4.944 0.294 9 0 "[ . 1 . 2]" 1
696 1 37 ASP HB3 1 38 GLY H . . 4.690 4.254 3.229 4.528 . 0 0 "[ . 1 . 2]" 1
697 1 38 GLY H 1 39 GLU HA . . 5.500 5.076 3.815 5.293 . 0 0 "[ . 1 . 2]" 1
698 1 38 GLY H 1 39 GLU HG2 . . 5.470 5.006 3.597 5.809 0.339 10 0 "[ . 1 . 2]" 1
699 1 38 GLY H 1 74 ASN HA . . 5.350 5.129 4.672 5.282 . 0 0 "[ . 1 . 2]" 1
700 1 38 GLY H 1 76 THR HA . . 5.500 5.256 4.741 5.540 0.040 15 0 "[ . 1 . 2]" 1
701 1 38 GLY H 1 76 THR MG . . 5.500 4.739 4.278 5.505 0.005 15 0 "[ . 1 . 2]" 1
702 1 38 GLY HA2 1 74 ASN HA . . 4.510 2.883 2.221 3.095 . 0 0 "[ . 1 . 2]" 1
703 1 38 GLY HA2 1 74 ASN HB2 . . 5.060 4.782 3.326 5.387 0.327 10 0 "[ . 1 . 2]" 1
704 1 38 GLY HA2 1 74 ASN HB3 . . 5.420 3.512 2.886 4.294 . 0 0 "[ . 1 . 2]" 1
705 1 38 GLY HA3 1 40 GLY H . . 5.230 4.652 4.055 5.948 0.718 15 1 "[ . 1 + 2]" 1
706 1 38 GLY HA3 1 74 ASN HA . . 4.220 3.327 2.981 3.788 . 0 0 "[ . 1 . 2]" 1
707 1 38 GLY HA3 1 74 ASN HB2 . . 4.830 4.260 2.459 5.064 0.234 15 0 "[ . 1 . 2]" 1
708 1 38 GLY HA3 1 74 ASN HB3 . . 5.420 2.800 2.163 3.785 . 0 0 "[ . 1 . 2]" 1
709 1 39 GLU H 1 39 GLU HG2 . . 4.080 2.508 1.943 4.250 0.170 15 0 "[ . 1 . 2]" 1
710 1 39 GLU HA 1 39 GLU HG2 . . 3.470 3.740 3.543 4.237 0.767 10 5 "[* . * +* . -]" 1
711 1 39 GLU QB 1 40 GLY H . . 4.720 3.564 1.832 3.843 . 0 0 "[ . 1 . 2]" 1
712 1 39 GLU QB 1 105 PHE HZ . . 4.830 4.670 3.989 4.956 0.126 7 0 "[ . 1 . 2]" 1
713 1 39 GLU HG2 1 40 GLY H . . 4.340 2.658 1.939 4.353 0.013 15 0 "[ . 1 . 2]" 1
714 1 39 GLU HG3 1 42 PHE QE . . 5.060 3.684 2.985 5.069 0.009 15 0 "[ . 1 . 2]" 1
715 1 39 GLU HG3 1 105 PHE HZ . . 4.510 3.375 2.510 4.441 . 0 0 "[ . 1 . 2]" 1
716 1 40 GLY H 1 41 ILE H . . 5.090 4.272 3.769 4.463 . 0 0 "[ . 1 . 2]" 1
717 1 40 GLY H 1 42 PHE QE . . 5.480 4.387 3.942 4.763 . 0 0 "[ . 1 . 2]" 1
718 1 40 GLY HA2 1 41 ILE HB . . 5.420 4.703 4.588 4.810 . 0 0 "[ . 1 . 2]" 1
719 1 40 GLY HA2 1 41 ILE HG12 . . 5.060 3.259 3.028 3.471 . 0 0 "[ . 1 . 2]" 1
720 1 40 GLY HA2 1 42 PHE QE . . 4.650 4.069 3.741 4.622 . 0 0 "[ . 1 . 2]" 1
721 1 40 GLY HA2 1 63 ARG HE . . 4.300 3.857 3.237 4.314 0.014 15 0 "[ . 1 . 2]" 1
722 1 40 GLY HA2 1 63 ARG HG3 . . 5.420 4.973 4.574 5.393 . 0 0 "[ . 1 . 2]" 1
723 1 40 GLY HA3 1 41 ILE MD . . 5.420 5.132 4.773 5.351 . 0 0 "[ . 1 . 2]" 1
724 1 40 GLY HA3 1 41 ILE HG12 . . 5.420 4.446 4.088 4.866 . 0 0 "[ . 1 . 2]" 1
725 1 40 GLY HA3 1 42 PHE QE . . 4.300 2.518 2.256 3.085 . 0 0 "[ . 1 . 2]" 1
726 1 40 GLY HA3 1 42 PHE HZ . . 4.650 4.015 3.397 4.497 . 0 0 "[ . 1 . 2]" 1
727 1 40 GLY HA3 1 63 ARG HE . . 4.220 3.071 2.343 4.056 . 0 0 "[ . 1 . 2]" 1
728 1 40 GLY HA3 1 63 ARG HG3 . . 5.060 3.922 3.485 5.067 0.007 15 0 "[ . 1 . 2]" 1
729 1 41 ILE H 1 41 ILE HB . . 3.830 2.573 2.427 2.753 . 0 0 "[ . 1 . 2]" 1
730 1 41 ILE H 1 41 ILE MD . . 4.830 3.768 3.113 4.076 . 0 0 "[ . 1 . 2]" 1
731 1 41 ILE H 1 41 ILE HG12 . . 4.430 2.509 1.875 2.877 . 0 0 "[ . 1 . 2]" 1
732 1 41 ILE H 1 41 ILE HG13 . . 4.930 3.721 3.333 4.031 . 0 0 "[ . 1 . 2]" 1
733 1 41 ILE H 1 41 ILE MG . . 4.510 3.804 3.732 3.893 . 0 0 "[ . 1 . 2]" 1
734 1 41 ILE H 1 42 PHE QD . . 4.740 3.909 3.379 4.545 . 0 0 "[ . 1 . 2]" 1
735 1 41 ILE H 1 63 ARG HE . . 5.240 3.649 2.743 4.946 . 0 0 "[ . 1 . 2]" 1
736 1 41 ILE H 1 63 ARG HG2 . . 5.120 3.562 2.901 4.318 . 0 0 "[ . 1 . 2]" 1
737 1 41 ILE H 1 63 ARG HG3 . . 5.060 3.579 2.774 4.570 . 0 0 "[ . 1 . 2]" 1
738 1 41 ILE HA 1 41 ILE MD . . 3.790 2.195 1.994 2.299 . 0 0 "[ . 1 . 2]" 1
739 1 41 ILE HA 1 41 ILE MG . . 3.260 2.368 2.241 2.430 . 0 0 "[ . 1 . 2]" 1
740 1 41 ILE HA 1 42 PHE H . . 3.340 2.303 2.229 2.444 . 0 0 "[ . 1 . 2]" 1
741 1 41 ILE HA 1 42 PHE QD . . 4.830 2.822 2.628 3.293 . 0 0 "[ . 1 . 2]" 1
742 1 41 ILE HB 1 42 PHE H . . 5.190 3.939 3.601 4.164 . 0 0 "[ . 1 . 2]" 1
743 1 41 ILE HB 1 64 ILE H . . 4.920 3.542 2.534 4.127 . 0 0 "[ . 1 . 2]" 1
744 1 41 ILE HB 1 64 ILE HB . . 3.870 2.221 1.997 2.496 . 0 0 "[ . 1 . 2]" 1
745 1 41 ILE HB 1 64 ILE MG . . 4.510 3.145 2.504 3.795 . 0 0 "[ . 1 . 2]" 1
746 1 41 ILE HB 1 80 ALA MB . . 4.400 3.784 3.659 4.087 . 0 0 "[ . 1 . 2]" 1
747 1 41 ILE MD 1 41 ILE MG . . 2.670 1.872 1.816 1.967 . 0 0 "[ . 1 . 2]" 1
748 1 41 ILE MD 1 42 PHE H . . 4.020 3.695 3.570 3.840 . 0 0 "[ . 1 . 2]" 1
749 1 41 ILE MD 1 64 ILE HB . . 5.060 4.537 4.350 4.845 . 0 0 "[ . 1 . 2]" 1
750 1 41 ILE MD 1 75 ALA H . . 5.140 3.986 3.507 4.589 . 0 0 "[ . 1 . 2]" 1
751 1 41 ILE MD 1 75 ALA MB . . 3.660 3.634 3.550 3.741 0.081 15 0 "[ . 1 . 2]" 1
752 1 41 ILE MD 1 76 THR HA . . 4.510 3.593 3.221 3.845 . 0 0 "[ . 1 . 2]" 1
753 1 41 ILE MD 1 77 HIS H . . 4.780 3.769 3.332 4.137 . 0 0 "[ . 1 . 2]" 1
754 1 41 ILE MD 1 77 HIS HA . . 3.290 2.516 2.265 2.678 . 0 0 "[ . 1 . 2]" 1
755 1 41 ILE MD 1 77 HIS HB2 . . 4.650 3.969 3.603 4.159 . 0 0 "[ . 1 . 2]" 1
756 1 41 ILE MD 1 77 HIS HB3 . . 5.060 4.884 4.582 5.026 . 0 0 "[ . 1 . 2]" 1
757 1 41 ILE MD 1 77 HIS HD2 . . 4.830 3.497 3.166 3.943 . 0 0 "[ . 1 . 2]" 1
758 1 41 ILE MD 1 80 ALA H . . 4.310 3.747 3.578 4.160 . 0 0 "[ . 1 . 2]" 1
759 1 41 ILE MD 1 80 ALA MB . . 3.070 2.139 1.855 2.647 . 0 0 "[ . 1 . 2]" 1
760 1 41 ILE MD 1 81 ALA H . . 5.420 5.051 4.798 5.400 . 0 0 "[ . 1 . 2]" 1
761 1 41 ILE HG13 1 41 ILE MG . . 3.320 2.559 2.432 2.651 . 0 0 "[ . 1 . 2]" 1
762 1 41 ILE HG13 1 75 ALA H . . 5.090 4.139 3.538 4.996 . 0 0 "[ . 1 . 2]" 1
763 1 41 ILE HG13 1 75 ALA MB . . 4.300 3.581 3.119 3.976 . 0 0 "[ . 1 . 2]" 1
764 1 41 ILE HG13 1 80 ALA MB . . 3.470 2.296 2.053 2.808 . 0 0 "[ . 1 . 2]" 1
765 1 41 ILE MG 1 42 PHE H . . 3.720 2.233 1.912 2.540 . 0 0 "[ . 1 . 2]" 1
766 1 41 ILE MG 1 42 PHE HA . . 4.020 3.514 3.340 3.770 . 0 0 "[ . 1 . 2]" 1
767 1 41 ILE MG 1 42 PHE QD . . 5.060 4.189 4.041 4.467 . 0 0 "[ . 1 . 2]" 1
768 1 41 ILE MG 1 64 ILE H . . 4.220 3.312 2.801 3.585 . 0 0 "[ . 1 . 2]" 1
769 1 41 ILE MG 1 64 ILE HB . . 3.360 2.197 1.961 2.683 . 0 0 "[ . 1 . 2]" 1
770 1 41 ILE MG 1 77 HIS HA . . 4.650 3.922 3.653 4.203 . 0 0 "[ . 1 . 2]" 1
771 1 41 ILE MG 1 80 ALA HA . . 4.650 4.597 4.399 4.662 0.012 16 0 "[ . 1 . 2]" 1
772 1 41 ILE MG 1 80 ALA MB . . 2.940 2.338 2.134 2.480 . 0 0 "[ . 1 . 2]" 1
773 1 42 PHE H 1 42 PHE HB2 . . 4.070 2.680 2.517 2.878 . 0 0 "[ . 1 . 2]" 1
774 1 42 PHE H 1 42 PHE QD . . 3.910 2.861 2.622 3.471 . 0 0 "[ . 1 . 2]" 1
775 1 42 PHE HA 1 42 PHE QD . . 3.970 3.157 2.852 3.214 . 0 0 "[ . 1 . 2]" 1
776 1 42 PHE HA 1 43 VAL H . . 3.250 2.377 2.272 2.508 . 0 0 "[ . 1 . 2]" 1
777 1 42 PHE HA 1 43 VAL HB . . 4.650 4.577 4.484 4.643 . 0 0 "[ . 1 . 2]" 1
778 1 42 PHE HA 1 43 VAL MG2 . . 4.300 3.749 3.582 3.922 . 0 0 "[ . 1 . 2]" 1
779 1 42 PHE HA 1 63 ARG H . . 5.500 4.547 4.276 4.703 . 0 0 "[ . 1 . 2]" 1
780 1 42 PHE HA 1 63 ARG HA . . 3.430 2.024 1.953 2.477 . 0 0 "[ . 1 . 2]" 1
781 1 42 PHE HA 1 63 ARG HB2 . . 5.060 4.280 3.764 4.875 . 0 0 "[ . 1 . 2]" 1
782 1 42 PHE HA 1 63 ARG HG3 . . 4.650 3.940 3.639 4.637 . 0 0 "[ . 1 . 2]" 1
783 1 42 PHE HA 1 64 ILE H . . 4.220 2.297 1.981 3.024 . 0 0 "[ . 1 . 2]" 1
784 1 42 PHE HA 1 64 ILE HG12 . . 5.060 3.169 2.836 3.634 . 0 0 "[ . 1 . 2]" 1
785 1 42 PHE HA 1 64 ILE HG13 . . 5.420 4.329 3.853 5.116 . 0 0 "[ . 1 . 2]" 1
786 1 42 PHE HA 1 102 TYR QD . . 5.500 4.878 4.534 5.252 . 0 0 "[ . 1 . 2]" 1
787 1 42 PHE HB2 1 43 VAL H . . 4.540 3.922 3.685 4.141 . 0 0 "[ . 1 . 2]" 1
788 1 42 PHE HB2 1 102 TYR QD . . 4.140 2.845 2.264 3.234 . 0 0 "[ . 1 . 2]" 1
789 1 42 PHE HB2 1 102 TYR QE . . 4.300 4.109 3.352 4.299 . 0 0 "[ . 1 . 2]" 1
790 1 42 PHE HB3 1 43 VAL H . . 3.970 2.785 2.447 3.095 . 0 0 "[ . 1 . 2]" 1
791 1 42 PHE HB3 1 102 TYR QD . . 3.720 2.368 2.075 2.819 . 0 0 "[ . 1 . 2]" 1
792 1 42 PHE HB3 1 102 TYR QE . . 4.510 3.978 3.526 4.358 . 0 0 "[ . 1 . 2]" 1
793 1 42 PHE QD 1 43 VAL H . . 4.700 3.992 3.751 4.311 . 0 0 "[ . 1 . 2]" 1
794 1 42 PHE QD 1 61 GLY H . . 5.500 5.429 4.730 5.885 0.385 9 0 "[ . 1 . 2]" 1
795 1 42 PHE QD 1 63 ARG H . . 4.600 4.117 3.594 4.543 . 0 0 "[ . 1 . 2]" 1
796 1 42 PHE QD 1 63 ARG HA . . 4.400 2.908 2.614 3.197 . 0 0 "[ . 1 . 2]" 1
797 1 42 PHE QD 1 63 ARG HB2 . . 4.830 2.873 2.470 3.288 . 0 0 "[ . 1 . 2]" 1
798 1 42 PHE QD 1 63 ARG HB3 . . 5.420 4.403 4.099 4.771 . 0 0 "[ . 1 . 2]" 1
799 1 42 PHE QD 1 102 TYR HB2 . . 4.650 2.648 2.384 2.928 . 0 0 "[ . 1 . 2]" 1
800 1 42 PHE QD 1 102 TYR HB3 . . 4.830 4.284 3.922 4.627 . 0 0 "[ . 1 . 2]" 1
801 1 42 PHE QD 1 102 TYR QD . . 3.970 3.557 3.281 3.898 . 0 0 "[ . 1 . 2]" 1
802 1 42 PHE QE 1 63 ARG H . . 5.500 4.631 3.947 5.173 . 0 0 "[ . 1 . 2]" 1
803 1 42 PHE QE 1 63 ARG HB2 . . 4.510 2.288 2.093 2.647 . 0 0 "[ . 1 . 2]" 1
804 1 42 PHE QE 1 63 ARG HB3 . . 4.830 3.818 3.460 4.215 . 0 0 "[ . 1 . 2]" 1
805 1 42 PHE QE 1 63 ARG HD2 . . 4.400 3.195 2.487 4.379 . 0 0 "[ . 1 . 2]" 1
806 1 42 PHE QE 1 63 ARG HD3 . . 4.650 4.160 2.995 4.719 0.069 4 0 "[ . 1 . 2]" 1
807 1 42 PHE QE 1 63 ARG HG3 . . 5.420 2.913 2.652 4.778 . 0 0 "[ . 1 . 2]" 1
808 1 42 PHE QE 1 98 ARG HB2 . . 4.400 3.640 2.812 4.275 . 0 0 "[ . 1 . 2]" 1
809 1 42 PHE QE 1 98 ARG HB3 . . 4.510 2.677 1.994 3.987 . 0 0 "[ . 1 . 2]" 1
810 1 42 PHE QE 1 101 GLU HA . . 5.060 4.839 4.654 5.071 0.011 11 0 "[ . 1 . 2]" 1
811 1 42 PHE QE 1 101 GLU HB2 . . 4.080 2.197 1.988 2.697 . 0 0 "[ . 1 . 2]" 1
812 1 42 PHE QE 1 101 GLU HG3 . . 4.510 3.442 3.037 3.797 . 0 0 "[ . 1 . 2]" 1
813 1 42 PHE QE 1 102 TYR HB2 . . 5.420 4.127 3.676 4.299 . 0 0 "[ . 1 . 2]" 1
814 1 42 PHE HZ 1 63 ARG HD2 . . 4.510 2.803 2.049 4.392 . 0 0 "[ . 1 . 2]" 1
815 1 42 PHE HZ 1 63 ARG HD3 . . 5.060 4.095 2.880 4.947 . 0 0 "[ . 1 . 2]" 1
816 1 42 PHE HZ 1 101 GLU HB3 . . 3.920 2.805 2.409 3.222 . 0 0 "[ . 1 . 2]" 1
817 1 43 VAL H 1 43 VAL HB . . 3.450 2.249 2.177 2.318 . 0 0 "[ . 1 . 2]" 1
818 1 43 VAL H 1 43 VAL MG2 . . 3.270 2.507 2.281 2.741 . 0 0 "[ . 1 . 2]" 1
819 1 43 VAL H 1 60 ARG HA . . 5.470 4.931 4.159 5.387 . 0 0 "[ . 1 . 2]" 1
820 1 43 VAL H 1 62 ASP H . . 4.520 3.404 2.352 4.208 . 0 0 "[ . 1 . 2]" 1
821 1 43 VAL H 1 62 ASP HB2 . . 4.900 4.243 3.768 4.704 . 0 0 "[ . 1 . 2]" 1
822 1 43 VAL H 1 62 ASP HB3 . . 5.410 4.198 3.743 4.499 . 0 0 "[ . 1 . 2]" 1
823 1 43 VAL H 1 63 ARG HA . . 4.800 3.578 3.357 4.007 . 0 0 "[ . 1 . 2]" 1
824 1 43 VAL H 1 64 ILE MD . . 4.850 4.533 3.924 4.784 . 0 0 "[ . 1 . 2]" 1
825 1 43 VAL H 1 64 ILE HG12 . . 5.340 3.604 3.083 4.138 . 0 0 "[ . 1 . 2]" 1
826 1 43 VAL H 1 102 TYR QD . . 5.500 4.462 4.138 4.784 . 0 0 "[ . 1 . 2]" 1
827 1 43 VAL H 1 102 TYR QE . . 5.500 4.915 4.656 5.255 . 0 0 "[ . 1 . 2]" 1
828 1 43 VAL HA 1 43 VAL MG1 . . 3.200 2.542 2.478 2.612 . 0 0 "[ . 1 . 2]" 1
829 1 43 VAL HA 1 43 VAL MG2 . . 3.100 2.247 2.146 2.361 . 0 0 "[ . 1 . 2]" 1
830 1 43 VAL HA 1 44 SER H . . 3.020 2.230 2.198 2.270 . 0 0 "[ . 1 . 2]" 1
831 1 43 VAL HA 1 45 PHE H . . 4.130 3.758 3.533 3.977 . 0 0 "[ . 1 . 2]" 1
832 1 43 VAL HA 1 61 GLY H . . 5.500 4.686 4.341 5.307 . 0 0 "[ . 1 . 2]" 1
833 1 43 VAL HA 1 64 ILE MD . . 4.830 4.607 4.297 4.804 . 0 0 "[ . 1 . 2]" 1
834 1 43 VAL HB 1 44 SER H . . 5.220 4.277 4.160 4.377 . 0 0 "[ . 1 . 2]" 1
835 1 43 VAL HB 1 45 PHE H . . 5.450 4.661 4.277 5.058 . 0 0 "[ . 1 . 2]" 1
836 1 43 VAL HB 1 46 ILE MD . . 4.650 4.188 3.953 4.391 . 0 0 "[ . 1 . 2]" 1
837 1 43 VAL HB 1 46 ILE HG13 . . 5.420 4.911 4.562 5.147 . 0 0 "[ . 1 . 2]" 1
838 1 43 VAL HB 1 58 LEU QD . . 4.650 3.612 3.381 4.232 . 0 0 "[ . 1 . 2]" 1
839 1 43 VAL HB 1 60 ARG HA . . 3.760 2.849 2.128 3.281 . 0 0 "[ . 1 . 2]" 1
840 1 43 VAL HB 1 61 GLY H . . 4.040 2.088 1.928 2.623 . 0 0 "[ . 1 . 2]" 1
841 1 43 VAL HB 1 62 ASP H . . 3.920 2.538 1.940 3.095 . 0 0 "[ . 1 . 2]" 1
842 1 43 VAL HB 1 62 ASP HB2 . . 4.140 3.353 2.753 4.400 0.260 17 0 "[ . 1 . 2]" 1
843 1 43 VAL HB 1 62 ASP HB3 . . 4.400 4.079 2.976 4.386 . 0 0 "[ . 1 . 2]" 1
844 1 43 VAL MG1 1 44 SER H . . 3.730 2.593 2.413 2.776 . 0 0 "[ . 1 . 2]" 1
845 1 43 VAL MG1 1 44 SER HA . . 4.830 3.734 3.635 3.961 . 0 0 "[ . 1 . 2]" 1
846 1 43 VAL MG1 1 45 PHE H . . 3.450 2.158 1.832 2.479 . 0 0 "[ . 1 . 2]" 1
847 1 43 VAL MG1 1 45 PHE HA . . 4.510 3.201 3.063 3.377 . 0 0 "[ . 1 . 2]" 1
848 1 43 VAL MG1 1 46 ILE HG12 . . 3.380 2.099 1.969 2.251 . 0 0 "[ . 1 . 2]" 1
849 1 43 VAL MG1 1 46 ILE HG13 . . 3.290 2.737 2.378 2.969 . 0 0 "[ . 1 . 2]" 1
850 1 43 VAL MG1 1 60 ARG H . . 4.510 3.754 3.350 4.184 . 0 0 "[ . 1 . 2]" 1
851 1 43 VAL MG1 1 60 ARG HA . . 3.320 1.949 1.775 2.376 . 0 0 "[ . 1 . 2]" 1
852 1 43 VAL MG1 1 60 ARG HG2 . . 4.830 3.858 3.227 4.831 0.001 6 0 "[ . 1 . 2]" 1
853 1 43 VAL MG1 1 61 GLY H . . 4.220 2.842 2.555 3.261 . 0 0 "[ . 1 . 2]" 1
854 1 43 VAL MG1 1 62 ASP H . . 4.300 3.789 3.388 4.217 . 0 0 "[ . 1 . 2]" 1
855 1 43 VAL MG2 1 58 LEU QD . . 3.080 1.905 1.661 2.478 . 0 0 "[ . 1 . 2]" 1
856 1 43 VAL MG2 1 59 ARG H . . 4.670 3.934 3.287 4.394 . 0 0 "[ . 1 . 2]" 1
857 1 43 VAL MG2 1 62 ASP H . . 4.020 3.307 2.812 3.727 . 0 0 "[ . 1 . 2]" 1
858 1 43 VAL MG2 1 62 ASP HB2 . . 3.430 2.686 2.016 3.695 0.265 17 0 "[ . 1 . 2]" 1
859 1 43 VAL MG2 1 62 ASP HB3 . . 3.560 2.842 2.289 3.224 . 0 0 "[ . 1 . 2]" 1
860 1 43 VAL MG2 1 63 ARG H . . 5.430 5.010 4.640 5.335 . 0 0 "[ . 1 . 2]" 1
861 1 43 VAL MG2 1 64 ILE HG12 . . 3.210 2.528 2.234 3.010 . 0 0 "[ . 1 . 2]" 1
862 1 44 SER H 1 44 SER HB3 . . 4.060 2.276 2.155 2.373 . 0 0 "[ . 1 . 2]" 1
863 1 44 SER H 1 45 PHE H . . 3.150 2.134 2.039 2.310 . 0 0 "[ . 1 . 2]" 1
864 1 44 SER H 1 45 PHE HA . . 5.500 4.715 4.612 4.857 . 0 0 "[ . 1 . 2]" 1
865 1 44 SER HA 1 60 ARG HG2 . . 4.830 4.695 3.928 5.781 0.951 6 1 "[ .+ 1 . 2]" 1
866 1 44 SER HA 1 102 TYR QE . . 4.080 2.142 1.972 2.765 . 0 0 "[ . 1 . 2]" 1
867 1 44 SER HB2 1 45 PHE H . . 4.990 4.365 4.201 4.538 . 0 0 "[ . 1 . 2]" 1
868 1 44 SER HB2 1 102 TYR QE . . 4.510 3.630 3.249 3.885 . 0 0 "[ . 1 . 2]" 1
869 1 44 SER HB3 1 45 PHE H . . 4.730 3.585 3.439 3.773 . 0 0 "[ . 1 . 2]" 1
870 1 44 SER HB3 1 102 TYR QE . . 4.400 4.374 4.126 4.514 0.114 6 0 "[ . 1 . 2]" 1
871 1 45 PHE H 1 45 PHE HB2 . . 3.940 3.545 3.408 3.667 . 0 0 "[ . 1 . 2]" 1
872 1 45 PHE H 1 45 PHE HB3 . . 3.790 2.889 2.756 3.041 . 0 0 "[ . 1 . 2]" 1
873 1 45 PHE H 1 46 ILE H . . 4.680 4.353 4.310 4.389 . 0 0 "[ . 1 . 2]" 1
874 1 45 PHE H 1 46 ILE MD . . 5.190 4.835 4.465 5.196 0.006 15 0 "[ . 1 . 2]" 1
875 1 45 PHE H 1 46 ILE HG12 . . 5.400 3.787 3.684 3.922 . 0 0 "[ . 1 . 2]" 1
876 1 45 PHE H 1 46 ILE HG13 . . 5.380 5.202 4.513 5.335 . 0 0 "[ . 1 . 2]" 1
877 1 45 PHE HA 1 45 PHE QD . . 3.660 2.878 2.676 3.065 . 0 0 "[ . 1 . 2]" 1
878 1 45 PHE HA 1 45 PHE QE . . 5.060 4.848 4.758 4.955 . 0 0 "[ . 1 . 2]" 1
879 1 45 PHE HA 1 46 ILE H . . 2.930 2.481 2.435 2.514 . 0 0 "[ . 1 . 2]" 1
880 1 45 PHE HA 1 46 ILE HB . . 4.430 4.425 4.386 4.466 0.036 11 0 "[ . 1 . 2]" 1
881 1 45 PHE HA 1 46 ILE HG12 . . 4.830 3.656 3.456 4.109 . 0 0 "[ . 1 . 2]" 1
882 1 45 PHE HA 1 46 ILE HG13 . . 4.830 4.422 3.885 4.701 . 0 0 "[ . 1 . 2]" 1
883 1 45 PHE HA 1 60 ARG HD3 . . 4.220 3.439 2.178 4.618 0.398 6 0 "[ . 1 . 2]" 1
884 1 45 PHE HA 1 60 ARG HG2 . . 4.830 4.147 3.547 5.362 0.532 6 1 "[ .+ 1 . 2]" 1
885 1 45 PHE HB2 1 46 ILE H . . 4.320 3.763 3.692 3.811 . 0 0 "[ . 1 . 2]" 1
886 1 45 PHE HB3 1 46 ILE H . . 4.720 3.839 3.743 3.968 . 0 0 "[ . 1 . 2]" 1
887 1 45 PHE QD 1 46 ILE H . . 4.300 2.778 2.564 2.933 . 0 0 "[ . 1 . 2]" 1
888 1 45 PHE QD 1 47 LEU H . . 5.370 3.797 3.647 4.014 . 0 0 "[ . 1 . 2]" 1
889 1 45 PHE QD 1 47 LEU HA . . 4.830 3.964 3.824 4.177 . 0 0 "[ . 1 . 2]" 1
890 1 45 PHE QD 1 47 LEU QD . . 4.510 4.400 4.124 4.450 . 0 0 "[ . 1 . 2]" 1
891 1 45 PHE QE 1 46 ILE H . . 5.500 3.591 3.428 3.750 . 0 0 "[ . 1 . 2]" 1
892 1 45 PHE QE 1 47 LEU HA . . 3.790 2.035 1.982 2.264 . 0 0 "[ . 1 . 2]" 1
893 1 45 PHE QE 1 47 LEU HB2 . . 4.510 3.036 2.777 3.456 . 0 0 "[ . 1 . 2]" 1
894 1 45 PHE QE 1 47 LEU HB3 . . 5.060 4.363 4.156 4.698 . 0 0 "[ . 1 . 2]" 1
895 1 45 PHE QE 1 47 LEU QD . . 3.250 2.641 2.411 2.813 . 0 0 "[ . 1 . 2]" 1
896 1 45 PHE QE 1 48 ALA H . . 5.500 3.873 3.602 4.183 . 0 0 "[ . 1 . 2]" 1
897 1 45 PHE HZ 1 47 LEU HA . . 4.510 2.749 2.248 3.209 . 0 0 "[ . 1 . 2]" 1
898 1 45 PHE HZ 1 47 LEU HB2 . . 5.500 4.911 4.502 5.414 . 0 0 "[ . 1 . 2]" 1
899 1 45 PHE HZ 1 47 LEU QD . . 4.300 3.647 3.179 3.975 . 0 0 "[ . 1 . 2]" 1
900 1 45 PHE HZ 1 48 ALA H . . 4.870 3.406 3.018 3.764 . 0 0 "[ . 1 . 2]" 1
901 1 46 ILE H 1 46 ILE HB . . 3.160 2.667 2.619 2.708 . 0 0 "[ . 1 . 2]" 1
902 1 46 ILE H 1 46 ILE MD . . 4.550 4.424 4.284 4.542 . 0 0 "[ . 1 . 2]" 1
903 1 46 ILE H 1 46 ILE HG12 . . 4.240 3.246 3.072 3.556 . 0 0 "[ . 1 . 2]" 1
904 1 46 ILE H 1 46 ILE HG13 . . 4.090 3.841 3.433 4.056 . 0 0 "[ . 1 . 2]" 1
905 1 46 ILE H 1 46 ILE MG . . 3.990 3.816 3.792 3.839 . 0 0 "[ . 1 . 2]" 1
906 1 46 ILE HA 1 46 ILE MD . . 3.410 2.701 2.422 3.311 . 0 0 "[ . 1 . 2]" 1
907 1 46 ILE HA 1 46 ILE HG12 . . 3.790 2.493 2.286 2.637 . 0 0 "[ . 1 . 2]" 1
908 1 46 ILE HA 1 46 ILE HG13 . . 3.970 3.667 3.473 3.732 . 0 0 "[ . 1 . 2]" 1
909 1 46 ILE HA 1 46 ILE MG . . 3.130 2.446 2.375 2.531 . 0 0 "[ . 1 . 2]" 1
910 1 46 ILE HA 1 47 LEU H . . 3.160 2.180 2.176 2.190 . 0 0 "[ . 1 . 2]" 1
911 1 46 ILE HA 1 47 LEU HB3 . . 4.400 4.549 4.519 4.645 0.245 2 0 "[ . 1 . 2]" 1
912 1 46 ILE HA 1 52 ALA MB . . 4.220 3.576 3.312 3.733 . 0 0 "[ . 1 . 2]" 1
913 1 46 ILE HB 1 46 ILE MD . . 3.260 3.052 2.769 3.144 . 0 0 "[ . 1 . 2]" 1
914 1 46 ILE HB 1 47 LEU H . . 5.420 4.410 4.335 4.507 . 0 0 "[ . 1 . 2]" 1
915 1 46 ILE MD 1 46 ILE MG . . 2.610 1.749 1.701 1.808 . 0 0 "[ . 1 . 2]" 1
916 1 46 ILE MD 1 47 LEU H . . 5.040 4.022 3.686 4.702 . 0 0 "[ . 1 . 2]" 1
917 1 46 ILE MD 1 52 ALA MB . . 3.210 1.959 1.839 2.135 . 0 0 "[ . 1 . 2]" 1
918 1 46 ILE MD 1 53 ASP HA . . 5.060 3.887 3.154 4.186 . 0 0 "[ . 1 . 2]" 1
919 1 46 ILE MD 1 58 LEU H . . 5.030 4.506 4.241 5.021 . 0 0 "[ . 1 . 2]" 1
920 1 46 ILE MD 1 58 LEU HB2 . . 3.690 3.727 3.574 3.836 0.146 3 0 "[ . 1 . 2]" 1
921 1 46 ILE MD 1 58 LEU HB3 . . 3.320 2.407 2.157 2.656 . 0 0 "[ . 1 . 2]" 1
922 1 46 ILE MD 1 58 LEU QD . . 3.580 2.149 1.725 2.519 . 0 0 "[ . 1 . 2]" 1
923 1 46 ILE MD 1 59 ARG H . . 4.570 3.175 2.592 3.502 . 0 0 "[ . 1 . 2]" 1
924 1 46 ILE MD 1 59 ARG HA . . 3.190 2.604 1.955 2.958 . 0 0 "[ . 1 . 2]" 1
925 1 46 ILE MD 1 59 ARG HB2 . . 5.420 4.785 4.030 5.192 . 0 0 "[ . 1 . 2]" 1
926 1 46 ILE MD 1 59 ARG HB3 . . 5.420 4.673 3.775 5.118 . 0 0 "[ . 1 . 2]" 1
927 1 46 ILE MD 1 60 ARG H . . 3.720 3.667 3.232 3.795 0.075 6 0 "[ . 1 . 2]" 1
928 1 46 ILE MD 1 60 ARG HA . . 4.400 3.734 3.423 4.173 . 0 0 "[ . 1 . 2]" 1
929 1 46 ILE HG12 1 47 LEU H . . 5.270 4.654 4.446 4.793 . 0 0 "[ . 1 . 2]" 1
930 1 46 ILE HG12 1 52 ALA MB . . 4.220 4.155 3.738 4.255 0.035 5 0 "[ . 1 . 2]" 1
931 1 46 ILE HG12 1 58 LEU QD . . 5.420 3.977 3.507 4.431 . 0 0 "[ . 1 . 2]" 1
932 1 46 ILE HG12 1 59 ARG HA . . 4.830 4.201 3.494 4.661 . 0 0 "[ . 1 . 2]" 1
933 1 46 ILE HG12 1 60 ARG H . . 5.030 3.762 3.164 4.228 . 0 0 "[ . 1 . 2]" 1
934 1 46 ILE HG13 1 46 ILE MG . . 3.410 2.817 2.656 3.102 . 0 0 "[ . 1 . 2]" 1
935 1 46 ILE HG13 1 47 LEU H . . 5.500 5.626 5.534 5.671 0.171 4 0 "[ . 1 . 2]" 1
936 1 46 ILE HG13 1 59 ARG HA . . 4.400 2.600 1.988 3.043 . 0 0 "[ . 1 . 2]" 1
937 1 46 ILE HG13 1 60 ARG H . . 5.420 2.302 2.054 2.524 . 0 0 "[ . 1 . 2]" 1
938 1 46 ILE MG 1 47 LEU H . . 3.530 2.894 2.644 3.139 . 0 0 "[ . 1 . 2]" 1
939 1 46 ILE MG 1 47 LEU HA . . 4.300 4.271 4.166 4.355 0.055 15 0 "[ . 1 . 2]" 1
940 1 46 ILE MG 1 48 ALA H . . 5.340 4.997 4.808 5.163 . 0 0 "[ . 1 . 2]" 1
941 1 46 ILE MG 1 48 ALA HA . . 5.060 4.073 3.923 4.281 . 0 0 "[ . 1 . 2]" 1
942 1 46 ILE MG 1 49 GLY H . . 5.060 4.669 4.580 4.871 . 0 0 "[ . 1 . 2]" 1
943 1 46 ILE MG 1 50 GLY H . . 5.240 4.502 4.304 4.660 . 0 0 "[ . 1 . 2]" 1
944 1 46 ILE MG 1 52 ALA H . . 4.870 4.007 3.790 4.261 . 0 0 "[ . 1 . 2]" 1
945 1 46 ILE MG 1 52 ALA HA . . 4.830 4.129 3.955 4.371 . 0 0 "[ . 1 . 2]" 1
946 1 46 ILE MG 1 52 ALA MB . . 3.060 1.962 1.894 2.059 . 0 0 "[ . 1 . 2]" 1
947 1 46 ILE MG 1 53 ASP H . . 3.690 3.195 2.840 3.670 . 0 0 "[ . 1 . 2]" 1
948 1 46 ILE MG 1 53 ASP HA . . 3.070 2.520 2.003 2.927 . 0 0 "[ . 1 . 2]" 1
949 1 46 ILE MG 1 53 ASP HB2 . . 3.660 2.116 1.929 2.600 . 0 0 "[ . 1 . 2]" 1
950 1 46 ILE MG 1 54 LEU H . . 5.170 4.746 4.392 5.051 . 0 0 "[ . 1 . 2]" 1
951 1 46 ILE MG 1 58 LEU HB3 . . 4.220 3.604 3.451 3.736 . 0 0 "[ . 1 . 2]" 1
952 1 46 ILE MG 1 58 LEU QD . . 4.650 3.859 3.540 4.058 . 0 0 "[ . 1 . 2]" 1
953 1 46 ILE MG 1 59 ARG HA . . 4.400 3.339 2.765 3.768 . 0 0 "[ . 1 . 2]" 1
954 1 47 LEU H 1 47 LEU HB2 . . 3.590 2.439 2.341 2.528 . 0 0 "[ . 1 . 2]" 1
955 1 47 LEU H 1 47 LEU HB3 . . 3.740 2.436 2.381 2.548 . 0 0 "[ . 1 . 2]" 1
956 1 47 LEU H 1 47 LEU QD . . 4.300 3.605 3.577 3.644 . 0 0 "[ . 1 . 2]" 1
957 1 47 LEU H 1 47 LEU HG . . 4.440 4.446 4.378 4.553 0.113 20 0 "[ . 1 . 2]" 1
958 1 47 LEU H 1 48 ALA H . . 4.940 4.656 4.630 4.673 . 0 0 "[ . 1 . 2]" 1
959 1 47 LEU HA 1 47 LEU QD . . 2.960 2.344 1.881 2.749 . 0 0 "[ . 1 . 2]" 1
960 1 47 LEU HA 1 47 LEU HG . . 4.140 3.132 2.730 3.704 . 0 0 "[ . 1 . 2]" 1
961 1 47 LEU HA 1 48 ALA H . . 2.930 2.313 2.243 2.387 . 0 0 "[ . 1 . 2]" 1
962 1 47 LEU HB2 1 48 ALA H . . 4.220 4.062 3.985 4.170 . 0 0 "[ . 1 . 2]" 1
963 1 47 LEU HB2 1 50 GLY H . . 4.990 4.983 4.949 5.015 0.025 8 0 "[ . 1 . 2]" 1
964 1 47 LEU HB2 1 50 GLY HA3 . . 5.060 4.565 4.194 4.736 . 0 0 "[ . 1 . 2]" 1
965 1 47 LEU HB3 1 48 ALA H . . 4.670 3.999 3.814 4.167 . 0 0 "[ . 1 . 2]" 1
966 1 47 LEU QD 1 48 ALA H . . 3.560 2.422 1.757 2.904 . 0 0 "[ . 1 . 2]" 1
967 1 47 LEU QD 1 48 ALA MB . . 4.220 3.415 2.811 3.850 . 0 0 "[ . 1 . 2]" 1
968 1 47 LEU QD 1 50 GLY H . . 4.890 2.379 1.817 3.080 . 0 0 "[ . 1 . 2]" 1
969 1 47 LEU QD 1 50 GLY HA2 . . 4.300 2.697 2.327 3.168 . 0 0 "[ . 1 . 2]" 1
970 1 47 LEU QD 1 50 GLY HA3 . . 4.080 2.276 1.943 2.655 . 0 0 "[ . 1 . 2]" 1
971 1 47 LEU HG 1 48 ALA H . . 4.200 2.888 1.937 4.298 0.098 14 0 "[ . 1 . 2]" 1
972 1 47 LEU HG 1 50 GLY H . . 4.790 3.873 3.305 4.585 . 0 0 "[ . 1 . 2]" 1
973 1 48 ALA H 1 48 ALA MB . . 2.900 2.159 2.102 2.248 . 0 0 "[ . 1 . 2]" 1
974 1 48 ALA H 1 49 GLY H . . 4.780 4.385 4.311 4.485 . 0 0 "[ . 1 . 2]" 1
975 1 48 ALA HA 1 49 GLY H . . 2.920 2.192 2.186 2.204 . 0 0 "[ . 1 . 2]" 1
976 1 48 ALA HA 1 50 GLY H . . 4.400 3.471 3.319 3.542 . 0 0 "[ . 1 . 2]" 1
977 1 48 ALA HA 1 53 ASP HB3 . . 3.870 3.577 3.307 3.760 . 0 0 "[ . 1 . 2]" 1
978 1 48 ALA MB 1 49 GLY H . . 3.450 3.411 3.251 3.490 0.040 20 0 "[ . 1 . 2]" 1
979 1 48 ALA MB 1 49 GLY HA2 . . 4.650 4.540 4.501 4.598 . 0 0 "[ . 1 . 2]" 1
980 1 48 ALA MB 1 49 GLY HA3 . . 4.650 4.131 4.042 4.207 . 0 0 "[ . 1 . 2]" 1
981 1 48 ALA MB 1 50 GLY H . . 5.050 4.430 4.194 4.559 . 0 0 "[ . 1 . 2]" 1
982 1 49 GLY H 1 50 GLY H . . 3.690 2.431 2.265 2.645 . 0 0 "[ . 1 . 2]" 1
983 1 49 GLY H 1 50 GLY HA3 . . 5.420 4.566 4.423 4.865 . 0 0 "[ . 1 . 2]" 1
984 1 49 GLY H 1 53 ASP H . . 5.500 4.641 4.338 5.055 . 0 0 "[ . 1 . 2]" 1
985 1 49 GLY H 1 53 ASP HB3 . . 3.930 2.400 2.193 2.922 . 0 0 "[ . 1 . 2]" 1
986 1 49 GLY H 1 54 LEU H . . 5.180 4.010 3.662 4.422 . 0 0 "[ . 1 . 2]" 1
987 1 49 GLY H 1 54 LEU MD2 . . 4.650 3.511 3.251 3.797 . 0 0 "[ . 1 . 2]" 1
988 1 49 GLY H 1 54 LEU HG . . 5.480 3.876 3.599 4.358 . 0 0 "[ . 1 . 2]" 1
989 1 49 GLY HA2 1 53 ASP HB3 . . 5.060 3.888 3.631 4.218 . 0 0 "[ . 1 . 2]" 1
990 1 49 GLY HA2 1 54 LEU MD2 . . 3.720 2.349 2.253 2.434 . 0 0 "[ . 1 . 2]" 1
991 1 49 GLY HA2 1 54 LEU HG . . 4.400 2.811 2.661 3.108 . 0 0 "[ . 1 . 2]" 1
992 1 49 GLY HA3 1 53 ASP HB3 . . 4.650 4.798 4.680 4.943 0.293 9 0 "[ . 1 . 2]" 1
993 1 49 GLY HA3 1 54 LEU MD1 . . 4.510 4.147 3.823 4.448 . 0 0 "[ . 1 . 2]" 1
994 1 49 GLY HA3 1 54 LEU MD2 . . 3.580 3.760 3.714 3.804 0.224 16 0 "[ . 1 . 2]" 1
995 1 49 GLY HA3 1 54 LEU HG . . 4.510 4.020 3.887 4.252 . 0 0 "[ . 1 . 2]" 1
996 1 50 GLY H 1 51 PRO HD3 . . 5.290 4.759 4.745 4.769 . 0 0 "[ . 1 . 2]" 1
997 1 50 GLY H 1 53 ASP H . . 5.070 3.893 3.677 4.101 . 0 0 "[ . 1 . 2]" 1
998 1 50 GLY H 1 53 ASP HB3 . . 3.810 2.788 2.415 3.392 . 0 0 "[ . 1 . 2]" 1
999 1 50 GLY H 1 54 LEU H . . 5.310 4.022 3.798 4.195 . 0 0 "[ . 1 . 2]" 1
1000 1 50 GLY H 1 54 LEU MD2 . . 4.650 4.600 4.493 4.669 0.019 19 0 "[ . 1 . 2]" 1
1001 1 50 GLY H 1 54 LEU HG . . 4.780 3.936 3.737 4.150 . 0 0 "[ . 1 . 2]" 1
1002 1 50 GLY HA2 1 51 PRO HD2 . . 3.300 3.122 3.051 3.188 . 0 0 "[ . 1 . 2]" 1
1003 1 50 GLY HA2 1 51 PRO HD3 . . 3.530 2.300 2.236 2.361 . 0 0 "[ . 1 . 2]" 1
1004 1 50 GLY HA2 1 51 PRO HG2 . . 4.650 4.983 4.921 5.043 0.393 12 0 "[ . 1 . 2]" 1
1005 1 50 GLY HA2 1 51 PRO HG3 . . 4.830 4.522 4.468 4.574 . 0 0 "[ . 1 . 2]" 1
1006 1 50 GLY HA2 1 52 ALA H . . 5.360 4.471 4.379 4.572 . 0 0 "[ . 1 . 2]" 1
1007 1 50 GLY HA2 1 54 LEU HG . . 4.650 4.077 3.897 4.188 . 0 0 "[ . 1 . 2]" 1
1008 1 50 GLY HA3 1 51 PRO HD3 . . 3.790 2.748 2.681 2.821 . 0 0 "[ . 1 . 2]" 1
1009 1 50 GLY HA3 1 51 PRO HG3 . . 5.060 4.841 4.779 4.907 . 0 0 "[ . 1 . 2]" 1
1010 1 50 GLY HA3 1 53 ASP HB3 . . 5.420 3.903 3.478 4.680 . 0 0 "[ . 1 . 2]" 1
1011 1 50 GLY HA3 1 54 LEU HG . . 4.650 4.650 4.534 4.724 0.074 17 0 "[ . 1 . 2]" 1
1012 1 51 PRO HA 1 54 LEU H . . 4.020 3.440 3.207 3.713 . 0 0 "[ . 1 . 2]" 1
1013 1 51 PRO HA 1 54 LEU HB2 . . 3.510 2.505 2.402 2.639 . 0 0 "[ . 1 . 2]" 1
1014 1 51 PRO HA 1 54 LEU HB3 . . 4.430 4.114 3.948 4.331 . 0 0 "[ . 1 . 2]" 1
1015 1 51 PRO HA 1 54 LEU MD1 . . 3.660 3.678 3.657 3.726 0.066 3 0 "[ . 1 . 2]" 1
1016 1 51 PRO HA 1 55 SER H . . 4.410 2.990 2.684 3.242 . 0 0 "[ . 1 . 2]" 1
1017 1 51 PRO HB2 1 52 ALA H . . 3.660 3.386 3.304 3.483 . 0 0 "[ . 1 . 2]" 1
1018 1 51 PRO HB2 1 52 ALA HA . . 5.420 4.121 4.094 4.153 . 0 0 "[ . 1 . 2]" 1
1019 1 51 PRO HB2 1 52 ALA MB . . 4.400 4.328 4.262 4.421 0.021 18 0 "[ . 1 . 2]" 1
1020 1 51 PRO HB3 1 52 ALA H . . 4.210 4.268 4.222 4.323 0.113 9 0 "[ . 1 . 2]" 1
1021 1 51 PRO HD2 1 52 ALA H . . 4.350 2.257 2.253 2.270 . 0 0 "[ . 1 . 2]" 1
1022 1 51 PRO HD3 1 52 ALA H . . 4.210 3.659 3.655 3.667 . 0 0 "[ . 1 . 2]" 1
1023 1 51 PRO HG2 1 52 ALA H . . 4.650 2.933 2.840 3.050 . 0 0 "[ . 1 . 2]" 1
1024 1 51 PRO HG3 1 52 ALA H . . 4.640 4.142 4.082 4.217 . 0 0 "[ . 1 . 2]" 1
1025 1 52 ALA H 1 52 ALA MB . . 3.050 2.103 1.947 2.179 . 0 0 "[ . 1 . 2]" 1
1026 1 52 ALA H 1 53 ASP H . . 3.830 2.513 2.473 2.568 . 0 0 "[ . 1 . 2]" 1
1027 1 52 ALA H 1 54 LEU H . . 5.330 4.317 4.221 4.408 . 0 0 "[ . 1 . 2]" 1
1028 1 52 ALA HA 1 58 LEU QD . . 5.420 3.116 2.547 3.500 . 0 0 "[ . 1 . 2]" 1
1029 1 52 ALA MB 1 53 ASP H . . 3.720 2.964 2.637 3.237 . 0 0 "[ . 1 . 2]" 1
1030 1 52 ALA MB 1 53 ASP HA . . 4.400 3.921 3.756 4.084 . 0 0 "[ . 1 . 2]" 1
1031 1 52 ALA MB 1 58 LEU HA . . 4.830 4.675 4.470 4.862 0.032 11 0 "[ . 1 . 2]" 1
1032 1 52 ALA MB 1 58 LEU HB2 . . 3.920 3.079 2.773 3.386 . 0 0 "[ . 1 . 2]" 1
1033 1 52 ALA MB 1 58 LEU HB3 . . 3.720 2.161 1.958 2.449 . 0 0 "[ . 1 . 2]" 1
1034 1 52 ALA MB 1 58 LEU QD . . 3.350 2.065 1.775 2.524 . 0 0 "[ . 1 . 2]" 1
1035 1 53 ASP H 1 53 ASP HB2 . . 3.830 2.765 2.230 3.092 . 0 0 "[ . 1 . 2]" 1
1036 1 53 ASP H 1 54 LEU H . . 4.110 2.376 2.116 2.643 . 0 0 "[ . 1 . 2]" 1
1037 1 53 ASP H 1 54 LEU HG . . 5.500 4.400 4.092 4.681 . 0 0 "[ . 1 . 2]" 1
1038 1 53 ASP H 1 55 SER H . . 5.020 3.804 3.450 4.136 . 0 0 "[ . 1 . 2]" 1
1039 1 53 ASP HA 1 54 LEU HA . . 4.830 4.877 4.822 4.899 0.069 18 0 "[ . 1 . 2]" 1
1040 1 53 ASP HA 1 55 SER H . . 4.830 4.725 4.413 4.826 . 0 0 "[ . 1 . 2]" 1
1041 1 53 ASP HA 1 56 GLY H . . 4.450 3.563 3.298 3.794 . 0 0 "[ . 1 . 2]" 1
1042 1 53 ASP HB3 1 54 LEU H . . 3.720 2.288 2.116 2.457 . 0 0 "[ . 1 . 2]" 1
1043 1 53 ASP HB3 1 54 LEU HB2 . . 5.420 4.548 4.404 4.677 . 0 0 "[ . 1 . 2]" 1
1044 1 53 ASP HB3 1 54 LEU MD2 . . 4.830 3.709 3.054 4.222 . 0 0 "[ . 1 . 2]" 1
1045 1 53 ASP HB3 1 54 LEU HG . . 4.650 3.567 3.175 3.921 . 0 0 "[ . 1 . 2]" 1
1046 1 53 ASP HB3 1 55 SER H . . 5.450 4.971 4.809 5.151 . 0 0 "[ . 1 . 2]" 1
1047 1 54 LEU H 1 54 LEU HB2 . . 3.720 2.359 2.304 2.425 . 0 0 "[ . 1 . 2]" 1
1048 1 54 LEU H 1 54 LEU HB3 . . 3.850 3.522 3.509 3.532 . 0 0 "[ . 1 . 2]" 1
1049 1 54 LEU H 1 54 LEU MD1 . . 4.400 3.788 3.638 3.867 . 0 0 "[ . 1 . 2]" 1
1050 1 54 LEU H 1 54 LEU MD2 . . 3.860 3.109 2.940 3.333 . 0 0 "[ . 1 . 2]" 1
1051 1 54 LEU H 1 54 LEU HG . . 3.190 2.395 2.241 2.500 . 0 0 "[ . 1 . 2]" 1
1052 1 54 LEU H 1 55 SER H . . 3.630 2.934 2.780 3.036 . 0 0 "[ . 1 . 2]" 1
1053 1 54 LEU H 1 55 SER QB . . 5.230 4.839 4.437 5.154 . 0 0 "[ . 1 . 2]" 1
1054 1 54 LEU HA 1 54 LEU MD1 . . 4.140 3.750 3.691 3.829 . 0 0 "[ . 1 . 2]" 1
1055 1 54 LEU HA 1 54 LEU MD2 . . 2.720 1.919 1.873 2.008 . 0 0 "[ . 1 . 2]" 1
1056 1 54 LEU HA 1 54 LEU HG . . 3.920 3.137 3.061 3.217 . 0 0 "[ . 1 . 2]" 1
1057 1 54 LEU HA 1 56 GLY H . . 4.830 4.095 3.670 4.399 . 0 0 "[ . 1 . 2]" 1
1058 1 54 LEU HB2 1 54 LEU MD1 . . 3.320 2.462 2.379 2.523 . 0 0 "[ . 1 . 2]" 1
1059 1 54 LEU HB2 1 55 SER H . . 3.800 2.531 2.466 2.705 . 0 0 "[ . 1 . 2]" 1
1060 1 54 LEU HB2 1 55 SER HA . . 4.650 4.364 4.255 4.430 . 0 0 "[ . 1 . 2]" 1
1061 1 54 LEU HB2 1 56 GLY H . . 5.500 4.970 4.683 5.210 . 0 0 "[ . 1 . 2]" 1
1062 1 54 LEU HB3 1 54 LEU MD2 . . 3.180 2.495 2.388 2.565 . 0 0 "[ . 1 . 2]" 1
1063 1 54 LEU HB3 1 55 SER H . . 4.170 3.364 3.219 3.547 . 0 0 "[ . 1 . 2]" 1
1064 1 54 LEU HB3 1 55 SER HA . . 5.060 4.209 4.116 4.329 . 0 0 "[ . 1 . 2]" 1
1065 1 54 LEU HB3 1 56 GLY H . . 5.500 5.286 5.008 5.527 0.027 3 0 "[ . 1 . 2]" 1
1066 1 54 LEU MD2 1 55 SER H . . 4.580 4.597 4.559 4.651 0.071 19 0 "[ . 1 . 2]" 1
1067 1 55 SER H 1 55 SER QB . . 3.220 2.390 2.178 2.530 . 0 0 "[ . 1 . 2]" 1
1068 1 55 SER H 1 56 GLY H . . 3.370 2.946 2.769 3.049 . 0 0 "[ . 1 . 2]" 1
1069 1 55 SER QB 1 56 GLY H . . 4.220 3.049 2.445 3.612 . 0 0 "[ . 1 . 2]" 1
1070 1 55 SER QB 1 57 GLU H . . 4.300 2.655 2.312 3.709 . 0 0 "[ . 1 . 2]" 1
1071 1 55 SER QB 1 57 GLU HB2 . . 4.510 3.207 2.742 3.818 . 0 0 "[ . 1 . 2]" 1
1072 1 55 SER QB 1 57 GLU HG2 . . 4.510 3.348 2.010 4.356 . 0 0 "[ . 1 . 2]" 1
1073 1 55 SER HG 1 57 GLU H . . 4.850 3.270 1.943 4.827 . 0 0 "[ . 1 . 2]" 1
1074 1 56 GLY H 1 57 GLU H . . 3.720 2.597 2.367 2.919 . 0 0 "[ . 1 . 2]" 1
1075 1 57 GLU H 1 57 GLU HB2 . . 3.830 2.570 2.384 2.828 . 0 0 "[ . 1 . 2]" 1
1076 1 57 GLU H 1 57 GLU HG2 . . 3.920 2.619 2.002 3.960 0.040 4 0 "[ . 1 . 2]" 1
1077 1 57 GLU H 1 57 GLU HG3 . . 4.000 3.331 2.178 3.933 . 0 0 "[ . 1 . 2]" 1
1078 1 57 GLU HA 1 57 GLU HB3 . . 2.960 2.468 2.387 2.556 . 0 0 "[ . 1 . 2]" 1
1079 1 57 GLU HA 1 57 GLU HG2 . . 3.530 2.885 2.312 3.428 . 0 0 "[ . 1 . 2]" 1
1080 1 57 GLU HB2 1 58 LEU H . . 3.560 2.332 2.048 3.320 . 0 0 "[ . 1 . 2]" 1
1081 1 57 GLU HB3 1 58 LEU H . . 3.790 3.301 2.139 3.752 . 0 0 "[ . 1 . 2]" 1
1082 1 57 GLU HG2 1 58 LEU H . . 5.210 4.284 3.888 4.729 . 0 0 "[ . 1 . 2]" 1
1083 1 58 LEU H 1 58 LEU HB2 . . 3.420 2.271 1.989 3.025 . 0 0 "[ . 1 . 2]" 1
1084 1 58 LEU H 1 58 LEU HB3 . . 3.740 2.917 2.541 3.931 0.191 11 0 "[ . 1 . 2]" 1
1085 1 58 LEU H 1 58 LEU QD . . 4.830 3.621 3.216 3.889 . 0 0 "[ . 1 . 2]" 1
1086 1 58 LEU H 1 58 LEU HG . . 4.460 4.191 3.734 4.568 0.108 17 0 "[ . 1 . 2]" 1
1087 1 58 LEU H 1 59 ARG H . . 4.910 4.557 4.106 4.662 . 0 0 "[ . 1 . 2]" 1
1088 1 58 LEU HA 1 58 LEU QD . . 3.260 2.095 1.819 2.499 . 0 0 "[ . 1 . 2]" 1
1089 1 58 LEU HA 1 58 LEU HG . . 3.920 2.886 2.364 3.419 . 0 0 "[ . 1 . 2]" 1
1090 1 58 LEU HA 1 59 ARG H . . 3.030 2.234 2.181 2.378 . 0 0 "[ . 1 . 2]" 1
1091 1 58 LEU HA 1 95 ALA MB . . 4.830 4.452 4.140 4.739 . 0 0 "[ . 1 . 2]" 1
1092 1 58 LEU HB2 1 58 LEU QD . . 3.160 2.153 1.952 2.358 . 0 0 "[ . 1 . 2]" 1
1093 1 58 LEU HB2 1 59 ARG H . . 4.510 4.398 4.226 4.458 . 0 0 "[ . 1 . 2]" 1
1094 1 58 LEU HB3 1 59 ARG H . . 4.510 3.843 3.196 4.258 . 0 0 "[ . 1 . 2]" 1
1095 1 58 LEU QD 1 59 ARG H . . 4.020 1.947 1.788 2.766 . 0 0 "[ . 1 . 2]" 1
1096 1 58 LEU QD 1 59 ARG HA . . 5.060 3.692 3.289 4.672 . 0 0 "[ . 1 . 2]" 1
1097 1 58 LEU QD 1 62 ASP HB2 . . 4.140 2.536 2.196 3.114 . 0 0 "[ . 1 . 2]" 1
1098 1 58 LEU QD 1 62 ASP HB3 . . 4.140 2.801 2.562 3.259 . 0 0 "[ . 1 . 2]" 1
1099 1 58 LEU QD 1 93 ILE MG . . 3.580 2.297 1.962 2.479 . 0 0 "[ . 1 . 2]" 1
1100 1 58 LEU QD 1 95 ALA MB . . 3.490 2.785 2.364 2.993 . 0 0 "[ . 1 . 2]" 1
1101 1 58 LEU HG 1 59 ARG H . . 3.820 3.752 3.155 3.910 0.090 19 0 "[ . 1 . 2]" 1
1102 1 58 LEU HG 1 62 ASP HB2 . . 5.420 4.800 3.771 5.911 0.491 17 0 "[ . 1 . 2]" 1
1103 1 59 ARG H 1 59 ARG HB3 . . 3.870 3.747 2.955 3.901 0.031 14 0 "[ . 1 . 2]" 1
1104 1 59 ARG H 1 59 ARG HD2 . . 5.420 5.242 4.569 5.401 . 0 0 "[ . 1 . 2]" 1
1105 1 59 ARG H 1 59 ARG HD3 . . 5.420 5.304 5.032 5.430 0.010 13 0 "[ . 1 . 2]" 1
1106 1 59 ARG H 1 59 ARG HG2 . . 3.850 3.619 2.755 3.808 . 0 0 "[ . 1 . 2]" 1
1107 1 59 ARG H 1 59 ARG HG3 . . 3.800 3.215 2.551 3.422 . 0 0 "[ . 1 . 2]" 1
1108 1 59 ARG H 1 60 ARG H . . 4.850 4.382 4.295 4.438 . 0 0 "[ . 1 . 2]" 1
1109 1 59 ARG H 1 62 ASP H . . 4.920 4.209 3.775 4.878 . 0 0 "[ . 1 . 2]" 1
1110 1 59 ARG H 1 62 ASP HB2 . . 4.300 2.929 2.547 3.997 . 0 0 "[ . 1 . 2]" 1
1111 1 59 ARG H 1 62 ASP HB3 . . 4.870 4.114 3.077 4.500 . 0 0 "[ . 1 . 2]" 1
1112 1 59 ARG HA 1 59 ARG HD2 . . 4.830 4.681 3.759 4.863 0.033 14 0 "[ . 1 . 2]" 1
1113 1 59 ARG HA 1 59 ARG HD3 . . 4.830 4.061 3.785 4.808 . 0 0 "[ . 1 . 2]" 1
1114 1 59 ARG HA 1 59 ARG HG2 . . 4.080 2.710 2.323 4.242 0.162 7 0 "[ . 1 . 2]" 1
1115 1 59 ARG HA 1 59 ARG HG3 . . 3.830 3.468 3.342 3.843 0.013 11 0 "[ . 1 . 2]" 1
1116 1 59 ARG HA 1 60 ARG H . . 2.940 2.401 2.317 2.545 . 0 0 "[ . 1 . 2]" 1
1117 1 59 ARG HA 1 60 ARG HB2 . . 5.420 4.662 4.595 4.795 . 0 0 "[ . 1 . 2]" 1
1118 1 59 ARG HA 1 60 ARG HB3 . . 5.060 4.822 4.698 4.950 . 0 0 "[ . 1 . 2]" 1
1119 1 59 ARG HB2 1 59 ARG HD2 . . 3.870 3.080 2.443 3.373 . 0 0 "[ . 1 . 2]" 1
1120 1 59 ARG HB2 1 59 ARG HD3 . . 3.790 2.953 1.981 3.396 . 0 0 "[ . 1 . 2]" 1
1121 1 59 ARG HB2 1 59 ARG HE . . 5.420 4.675 4.334 5.087 . 0 0 "[ . 1 . 2]" 1
1122 1 59 ARG HB2 1 60 ARG H . . 4.080 3.629 2.481 4.045 . 0 0 "[ . 1 . 2]" 1
1123 1 59 ARG HB2 1 97 TYR QE . . 4.510 3.630 2.433 4.512 0.002 16 0 "[ . 1 . 2]" 1
1124 1 59 ARG HB3 1 59 ARG HE . . 5.420 4.182 3.825 4.709 . 0 0 "[ . 1 . 2]" 1
1125 1 59 ARG HB3 1 60 ARG H . . 3.770 3.036 2.454 4.083 0.313 7 0 "[ . 1 . 2]" 1
1126 1 59 ARG HB3 1 97 TYR QE . . 4.510 4.009 3.532 4.522 0.012 6 0 "[ . 1 . 2]" 1
1127 1 59 ARG HD2 1 59 ARG HH21 . . 4.510 4.486 4.475 4.522 0.012 5 0 "[ . 1 . 2]" 1
1128 1 59 ARG HD2 1 97 TYR QE . . 4.220 2.436 1.981 4.313 0.093 7 0 "[ . 1 . 2]" 1
1129 1 59 ARG HD3 1 59 ARG HH21 . . 4.400 4.490 4.475 4.523 0.123 2 0 "[ . 1 . 2]" 1
1130 1 59 ARG HD3 1 97 TYR QE . . 4.300 3.347 2.759 4.015 . 0 0 "[ . 1 . 2]" 1
1131 1 59 ARG HG2 1 60 ARG H . . 5.060 4.431 4.225 5.008 . 0 0 "[ . 1 . 2]" 1
1132 1 59 ARG HG2 1 97 TYR QE . . 4.830 4.416 2.204 4.839 0.009 13 0 "[ . 1 . 2]" 1
1133 1 59 ARG HG3 1 60 ARG H . . 5.420 4.969 3.739 5.319 . 0 0 "[ . 1 . 2]" 1
1134 1 59 ARG HG3 1 97 TYR QE . . 4.510 3.579 2.414 4.287 . 0 0 "[ . 1 . 2]" 1
1135 1 60 ARG H 1 60 ARG HB2 . . 3.340 2.530 2.379 2.689 . 0 0 "[ . 1 . 2]" 1
1136 1 60 ARG H 1 60 ARG HB3 . . 2.980 2.439 2.310 2.590 . 0 0 "[ . 1 . 2]" 1
1137 1 60 ARG H 1 60 ARG HD3 . . 5.380 4.815 4.508 5.810 0.430 5 0 "[ . 1 . 2]" 1
1138 1 60 ARG H 1 60 ARG HG2 . . 4.830 4.367 4.280 4.468 . 0 0 "[ . 1 . 2]" 1
1139 1 60 ARG H 1 60 ARG HG3 . . 4.400 4.454 4.355 4.538 0.138 2 0 "[ . 1 . 2]" 1
1140 1 60 ARG HA 1 60 ARG HG2 . . 4.080 3.058 2.773 3.276 . 0 0 "[ . 1 . 2]" 1
1141 1 60 ARG HA 1 60 ARG HG3 . . 4.020 2.704 2.486 2.931 . 0 0 "[ . 1 . 2]" 1
1142 1 60 ARG HA 1 61 GLY H . . 3.060 2.251 2.225 2.375 . 0 0 "[ . 1 . 2]" 1
1143 1 60 ARG HA 1 61 GLY HA2 . . 4.650 4.417 4.352 4.478 . 0 0 "[ . 1 . 2]" 1
1144 1 60 ARG HA 1 62 ASP H . . 4.080 3.622 3.313 4.071 . 0 0 "[ . 1 . 2]" 1
1145 1 60 ARG HB2 1 60 ARG HD3 . . 3.690 2.804 2.329 4.020 0.330 5 0 "[ . 1 . 2]" 1
1146 1 60 ARG HB2 1 61 GLY H . . 4.790 4.423 4.263 4.654 . 0 0 "[ . 1 . 2]" 1
1147 1 60 ARG HB3 1 60 ARG HD3 . . 3.240 2.655 2.189 3.462 0.222 5 0 "[ . 1 . 2]" 1
1148 1 60 ARG HB3 1 61 GLY H . . 5.420 4.423 4.178 4.587 . 0 0 "[ . 1 . 2]" 1
1149 1 60 ARG HD2 1 102 TYR QE . . 4.830 3.708 2.273 4.755 . 0 0 "[ . 1 . 2]" 1
1150 1 60 ARG HD3 1 102 TYR QE . . 4.830 4.139 1.996 4.773 . 0 0 "[ . 1 . 2]" 1
1151 1 60 ARG HG2 1 61 GLY H . . 4.530 3.303 2.497 4.037 . 0 0 "[ . 1 . 2]" 1
1152 1 60 ARG HG2 1 61 GLY HA3 . . 5.420 3.840 3.536 4.174 . 0 0 "[ . 1 . 2]" 1
1153 1 60 ARG HG2 1 62 ASP H . . 5.500 5.160 4.560 5.721 0.221 19 0 "[ . 1 . 2]" 1
1154 1 60 ARG HG2 1 102 TYR QE . . 4.650 2.782 1.995 3.386 . 0 0 "[ . 1 . 2]" 1
1155 1 60 ARG HG3 1 61 GLY H . . 4.080 3.615 3.036 4.286 0.206 16 0 "[ . 1 . 2]" 1
1156 1 60 ARG HG3 1 61 GLY HA3 . . 5.060 5.174 4.756 5.412 0.352 16 0 "[ . 1 . 2]" 1
1157 1 60 ARG HG3 1 102 TYR QE . . 4.830 3.653 2.551 4.274 . 0 0 "[ . 1 . 2]" 1
1158 1 61 GLY H 1 62 ASP H . . 3.550 2.143 1.872 2.676 . 0 0 "[ . 1 . 2]" 1
1159 1 61 GLY H 1 62 ASP HB2 . . 4.870 3.877 3.275 5.572 0.702 17 1 "[ . 1 . + 2]" 1
1160 1 61 GLY H 1 102 TYR QD . . 5.170 4.490 4.079 5.093 . 0 0 "[ . 1 . 2]" 1
1161 1 61 GLY H 1 102 TYR QE . . 5.320 4.460 3.891 4.888 . 0 0 "[ . 1 . 2]" 1
1162 1 61 GLY HA2 1 102 TYR HB2 . . 4.140 2.752 2.161 3.258 . 0 0 "[ . 1 . 2]" 1
1163 1 61 GLY HA2 1 102 TYR HB3 . . 4.080 3.150 2.532 3.848 . 0 0 "[ . 1 . 2]" 1
1164 1 61 GLY HA2 1 102 TYR QD . . 4.220 2.858 2.555 3.219 . 0 0 "[ . 1 . 2]" 1
1165 1 61 GLY HA2 1 102 TYR QE . . 4.020 3.757 3.264 4.000 . 0 0 "[ . 1 . 2]" 1
1166 1 61 GLY HA3 1 97 TYR QD . . 5.060 4.537 4.236 4.893 . 0 0 "[ . 1 . 2]" 1
1167 1 61 GLY HA3 1 97 TYR QE . . 4.140 4.003 3.559 4.170 0.030 13 0 "[ . 1 . 2]" 1
1168 1 61 GLY HA3 1 102 TYR QD . . 4.300 3.439 2.945 4.046 . 0 0 "[ . 1 . 2]" 1
1169 1 61 GLY HA3 1 102 TYR QE . . 5.060 4.457 3.818 4.919 . 0 0 "[ . 1 . 2]" 1
1170 1 62 ASP H 1 62 ASP HB2 . . 3.490 2.236 2.007 3.572 0.082 17 0 "[ . 1 . 2]" 1
1171 1 62 ASP H 1 62 ASP HB3 . . 3.760 3.250 2.356 3.480 . 0 0 "[ . 1 . 2]" 1
1172 1 62 ASP H 1 63 ARG H . . 4.750 4.537 4.087 4.673 . 0 0 "[ . 1 . 2]" 1
1173 1 62 ASP HA 1 63 ARG H . . 3.220 2.401 2.252 2.644 . 0 0 "[ . 1 . 2]" 1
1174 1 62 ASP HA 1 63 ARG HB2 . . 5.420 4.515 4.411 4.848 . 0 0 "[ . 1 . 2]" 1
1175 1 62 ASP HA 1 63 ARG HB3 . . 5.420 4.679 4.438 4.841 . 0 0 "[ . 1 . 2]" 1
1176 1 62 ASP HA 1 95 ALA MB . . 4.510 4.006 3.627 4.428 . 0 0 "[ . 1 . 2]" 1
1177 1 62 ASP HA 1 96 GLN H . . 5.240 4.456 4.060 5.168 . 0 0 "[ . 1 . 2]" 1
1178 1 62 ASP HA 1 97 TYR HB2 . . 4.830 4.753 4.325 4.933 0.103 13 0 "[ . 1 . 2]" 1
1179 1 62 ASP HA 1 97 TYR QD . . 3.790 3.723 3.597 3.870 0.080 17 0 "[ . 1 . 2]" 1
1180 1 62 ASP HB2 1 63 ARG H . . 5.090 4.209 2.759 4.659 . 0 0 "[ . 1 . 2]" 1
1181 1 62 ASP HB2 1 64 ILE MD . . 5.060 4.466 3.996 4.838 . 0 0 "[ . 1 . 2]" 1
1182 1 62 ASP HB2 1 95 ALA MB . . 3.830 3.391 2.887 3.632 . 0 0 "[ . 1 . 2]" 1
1183 1 62 ASP HB3 1 63 ARG H . . 4.300 3.224 2.388 4.049 . 0 0 "[ . 1 . 2]" 1
1184 1 62 ASP HB3 1 64 ILE MD . . 4.400 3.596 2.983 4.683 0.283 17 0 "[ . 1 . 2]" 1
1185 1 62 ASP HB3 1 95 ALA MB . . 3.360 2.164 1.897 3.905 0.545 17 1 "[ . 1 . + 2]" 1
1186 1 63 ARG H 1 63 ARG HB2 . . 4.180 2.819 2.329 3.180 . 0 0 "[ . 1 . 2]" 1
1187 1 63 ARG H 1 63 ARG HB3 . . 3.800 2.498 2.213 2.645 . 0 0 "[ . 1 . 2]" 1
1188 1 63 ARG H 1 63 ARG HD2 . . 5.500 5.198 4.533 5.936 0.436 15 0 "[ . 1 . 2]" 1
1189 1 63 ARG H 1 63 ARG HG3 . . 5.380 4.599 4.316 4.869 . 0 0 "[ . 1 . 2]" 1
1190 1 63 ARG H 1 64 ILE H . . 5.500 4.277 3.872 4.567 . 0 0 "[ . 1 . 2]" 1
1191 1 63 ARG H 1 95 ALA HA . . 5.500 4.450 3.824 5.140 . 0 0 "[ . 1 . 2]" 1
1192 1 63 ARG H 1 95 ALA MB . . 4.690 3.214 2.664 3.803 . 0 0 "[ . 1 . 2]" 1
1193 1 63 ARG H 1 96 GLN H . . 4.060 2.652 2.022 3.243 . 0 0 "[ . 1 . 2]" 1
1194 1 63 ARG H 1 96 GLN HG2 . . 5.420 3.648 2.863 5.851 0.431 13 0 "[ . 1 . 2]" 1
1195 1 63 ARG H 1 97 TYR H . . 4.000 4.683 4.254 5.068 1.068 15 18 "[***** *******-+* ***]" 1
1196 1 63 ARG HA 1 63 ARG HG2 . . 4.140 2.962 2.663 3.781 . 0 0 "[ . 1 . 2]" 1
1197 1 63 ARG HA 1 63 ARG HG3 . . 3.920 2.732 2.576 3.015 . 0 0 "[ . 1 . 2]" 1
1198 1 63 ARG HA 1 64 ILE H . . 3.410 2.244 2.225 2.339 . 0 0 "[ . 1 . 2]" 1
1199 1 63 ARG HA 1 64 ILE HB . . 5.060 4.586 4.514 4.661 . 0 0 "[ . 1 . 2]" 1
1200 1 63 ARG HB2 1 63 ARG HD2 . . 4.080 2.841 2.604 3.458 . 0 0 "[ . 1 . 2]" 1
1201 1 63 ARG HB2 1 63 ARG HD3 . . 4.080 3.165 2.114 4.022 . 0 0 "[ . 1 . 2]" 1
1202 1 63 ARG HB2 1 65 LEU QD . . 5.500 4.421 3.663 5.011 . 0 0 "[ . 1 . 2]" 1
1203 1 63 ARG HB3 1 63 ARG HD2 . . 4.220 2.972 2.023 4.084 . 0 0 "[ . 1 . 2]" 1
1204 1 63 ARG HB3 1 63 ARG HD3 . . 4.020 2.520 2.203 3.303 . 0 0 "[ . 1 . 2]" 1
1205 1 63 ARG HB3 1 65 LEU QD . . 4.830 3.230 2.241 3.959 . 0 0 "[ . 1 . 2]" 1
1206 1 63 ARG HB3 1 96 GLN H . . 5.060 2.899 2.605 3.223 . 0 0 "[ . 1 . 2]" 1
1207 1 63 ARG HB3 1 96 GLN HG2 . . 4.830 2.485 1.993 5.023 0.193 13 0 "[ . 1 . 2]" 1
1208 1 63 ARG HB3 1 98 ARG HB3 . . 4.650 4.182 3.444 5.334 0.684 14 2 "[ . 1- +. 2]" 1
1209 1 63 ARG HD2 1 65 LEU QD . . 4.400 3.660 2.806 4.134 . 0 0 "[ . 1 . 2]" 1
1210 1 63 ARG HD3 1 65 LEU QD . . 3.470 2.639 1.890 3.965 0.495 15 0 "[ . 1 . 2]" 1
1211 1 63 ARG HE 1 65 LEU QD . . 4.300 3.005 2.140 4.080 . 0 0 "[ . 1 . 2]" 1
1212 1 63 ARG HG2 1 64 ILE H . . 4.630 3.337 2.923 3.986 . 0 0 "[ . 1 . 2]" 1
1213 1 63 ARG HG2 1 65 LEU QD . . 3.920 2.945 1.756 3.790 . 0 0 "[ . 1 . 2]" 1
1214 1 64 ILE H 1 64 ILE HB . . 3.710 2.411 2.323 2.469 . 0 0 "[ . 1 . 2]" 1
1215 1 64 ILE H 1 64 ILE MD . . 4.400 3.457 3.068 3.882 . 0 0 "[ . 1 . 2]" 1
1216 1 64 ILE H 1 64 ILE HG12 . . 4.280 2.081 1.945 2.397 . 0 0 "[ . 1 . 2]" 1
1217 1 64 ILE H 1 64 ILE HG13 . . 4.090 3.363 3.210 3.556 . 0 0 "[ . 1 . 2]" 1
1218 1 64 ILE H 1 64 ILE MG . . 4.070 3.707 3.696 3.721 . 0 0 "[ . 1 . 2]" 1
1219 1 64 ILE HA 1 64 ILE MD . . 3.560 2.175 1.976 2.469 . 0 0 "[ . 1 . 2]" 1
1220 1 64 ILE HA 1 64 ILE HG12 . . 4.080 2.890 2.596 3.091 . 0 0 "[ . 1 . 2]" 1
1221 1 64 ILE HA 1 64 ILE HG13 . . 3.970 3.746 3.701 3.797 . 0 0 "[ . 1 . 2]" 1
1222 1 64 ILE HA 1 64 ILE MG . . 3.210 2.364 2.290 2.449 . 0 0 "[ . 1 . 2]" 1
1223 1 64 ILE HA 1 65 LEU H . . 3.170 2.208 2.178 2.295 . 0 0 "[ . 1 . 2]" 1
1224 1 64 ILE HA 1 65 LEU QD . . 5.060 3.999 3.045 4.610 . 0 0 "[ . 1 . 2]" 1
1225 1 64 ILE HA 1 66 SER H . . 4.400 4.064 3.859 4.219 . 0 0 "[ . 1 . 2]" 1
1226 1 64 ILE HA 1 93 ILE MG . . 4.140 3.539 3.354 3.863 . 0 0 "[ . 1 . 2]" 1
1227 1 64 ILE HA 1 95 ALA HA . . 3.490 2.619 2.424 2.937 . 0 0 "[ . 1 . 2]" 1
1228 1 64 ILE HA 1 95 ALA MB . . 3.760 1.997 1.797 2.368 . 0 0 "[ . 1 . 2]" 1
1229 1 64 ILE HA 1 96 GLN H . . 4.830 4.173 3.916 4.533 . 0 0 "[ . 1 . 2]" 1
1230 1 64 ILE HB 1 64 ILE MD . . 3.450 3.186 3.127 3.208 . 0 0 "[ . 1 . 2]" 1
1231 1 64 ILE MD 1 65 LEU H . . 4.830 3.673 3.353 4.033 . 0 0 "[ . 1 . 2]" 1
1232 1 64 ILE MD 1 66 SER H . . 5.480 4.577 4.221 4.732 . 0 0 "[ . 1 . 2]" 1
1233 1 64 ILE MD 1 93 ILE HB . . 4.220 4.012 3.764 4.225 0.005 13 0 "[ . 1 . 2]" 1
1234 1 64 ILE MD 1 93 ILE HG12 . . 5.060 3.479 3.093 3.938 . 0 0 "[ . 1 . 2]" 1
1235 1 64 ILE MD 1 95 ALA HA . . 4.830 3.798 3.477 4.068 . 0 0 "[ . 1 . 2]" 1
1236 1 64 ILE HG12 1 64 ILE MG . . 3.410 3.224 3.172 3.237 . 0 0 "[ . 1 . 2]" 1
1237 1 64 ILE HG13 1 64 ILE MG . . 3.290 2.475 2.298 2.723 . 0 0 "[ . 1 . 2]" 1
1238 1 64 ILE MG 1 65 LEU H . . 3.760 2.849 2.368 3.464 . 0 0 "[ . 1 . 2]" 1
1239 1 64 ILE MG 1 65 LEU HA . . 4.830 4.055 3.755 4.435 . 0 0 "[ . 1 . 2]" 1
1240 1 64 ILE MG 1 66 SER H . . 3.560 3.168 2.882 3.330 . 0 0 "[ . 1 . 2]" 1
1241 1 64 ILE MG 1 66 SER HA . . 4.510 3.731 3.552 3.901 . 0 0 "[ . 1 . 2]" 1
1242 1 64 ILE MG 1 67 VAL HA . . 4.650 4.129 3.856 4.586 . 0 0 "[ . 1 . 2]" 1
1243 1 64 ILE MG 1 94 VAL H . . 4.290 3.959 3.718 4.275 . 0 0 "[ . 1 . 2]" 1
1244 1 64 ILE MG 1 95 ALA HA . . 4.650 4.241 4.003 4.555 . 0 0 "[ . 1 . 2]" 1
1245 1 65 LEU H 1 65 LEU HB2 . . 3.560 2.292 2.159 2.407 . 0 0 "[ . 1 . 2]" 1
1246 1 65 LEU H 1 65 LEU QD . . 4.080 2.887 1.908 3.641 . 0 0 "[ . 1 . 2]" 1
1247 1 65 LEU H 1 65 LEU HG . . 3.920 3.605 3.068 4.141 0.221 13 0 "[ . 1 . 2]" 1
1248 1 65 LEU H 1 66 SER H . . 3.480 2.339 1.991 2.764 . 0 0 "[ . 1 . 2]" 1
1249 1 65 LEU H 1 66 SER HA . . 5.500 4.689 4.404 5.074 . 0 0 "[ . 1 . 2]" 1
1250 1 65 LEU H 1 93 ILE MG . . 4.830 4.246 3.949 4.681 . 0 0 "[ . 1 . 2]" 1
1251 1 65 LEU H 1 94 VAL H . . 4.940 4.358 3.897 4.922 . 0 0 "[ . 1 . 2]" 1
1252 1 65 LEU H 1 94 VAL HA . . 4.830 5.070 4.851 5.366 0.536 15 1 "[ . 1 + 2]" 1
1253 1 65 LEU H 1 94 VAL HB . . 5.060 4.174 3.873 4.745 . 0 0 "[ . 1 . 2]" 1
1254 1 65 LEU H 1 95 ALA HA . . 3.720 2.396 1.928 2.901 . 0 0 "[ . 1 . 2]" 1
1255 1 65 LEU H 1 95 ALA MB . . 4.080 3.257 2.990 3.640 . 0 0 "[ . 1 . 2]" 1
1256 1 65 LEU H 1 96 GLN H . . 5.080 4.336 3.645 5.017 . 0 0 "[ . 1 . 2]" 1
1257 1 65 LEU HA 1 65 LEU QD . . 3.000 2.029 1.886 2.175 . 0 0 "[ . 1 . 2]" 1
1258 1 65 LEU HA 1 65 LEU HG . . 4.220 3.153 2.676 3.685 . 0 0 "[ . 1 . 2]" 1
1259 1 65 LEU HA 1 72 LEU H . . 5.420 4.605 3.997 4.901 . 0 0 "[ . 1 . 2]" 1
1260 1 65 LEU HA 1 73 ARG H . . 4.810 4.606 4.424 4.768 . 0 0 "[ . 1 . 2]" 1
1261 1 65 LEU HA 1 73 ARG HA . . 4.020 3.396 2.713 3.860 . 0 0 "[ . 1 . 2]" 1
1262 1 65 LEU HA 1 73 ARG QG . . 4.400 3.323 2.959 3.686 . 0 0 "[ . 1 . 2]" 1
1263 1 65 LEU HB2 1 66 SER H . . 4.040 2.619 2.542 2.837 . 0 0 "[ . 1 . 2]" 1
1264 1 65 LEU HB2 1 94 VAL H . . 5.080 4.846 4.621 5.028 . 0 0 "[ . 1 . 2]" 1
1265 1 65 LEU HB2 1 94 VAL HB . . 4.020 3.388 2.913 3.727 . 0 0 "[ . 1 . 2]" 1
1266 1 65 LEU HB2 1 94 VAL MG1 . . 3.400 2.985 2.678 3.264 . 0 0 "[ . 1 . 2]" 1
1267 1 65 LEU HB3 1 65 LEU QD . . 3.210 2.219 2.112 2.405 . 0 0 "[ . 1 . 2]" 1
1268 1 65 LEU HB3 1 66 SER H . . 4.540 3.285 3.162 3.567 . 0 0 "[ . 1 . 2]" 1
1269 1 65 LEU HB3 1 94 VAL HB . . 4.400 4.293 3.822 4.411 0.011 14 0 "[ . 1 . 2]" 1
1270 1 65 LEU HB3 1 94 VAL MG1 . . 3.970 3.829 3.502 3.976 0.006 13 0 "[ . 1 . 2]" 1
1271 1 65 LEU HB3 1 95 ALA HA . . 5.060 4.838 4.497 5.080 0.020 20 0 "[ . 1 . 2]" 1
1272 1 65 LEU QD 1 66 SER H . . 4.510 3.937 3.744 4.183 . 0 0 "[ . 1 . 2]" 1
1273 1 65 LEU QD 1 73 ARG H . . 4.630 4.465 4.047 4.528 . 0 0 "[ . 1 . 2]" 1
1274 1 65 LEU QD 1 73 ARG HA . . 3.790 3.155 2.402 3.592 . 0 0 "[ . 1 . 2]" 1
1275 1 65 LEU QD 1 73 ARG HB3 . . 5.060 4.273 3.359 4.734 . 0 0 "[ . 1 . 2]" 1
1276 1 65 LEU QD 1 73 ARG HD2 . . 4.020 3.620 3.037 4.728 0.708 10 1 "[ . + . 2]" 1
1277 1 65 LEU QD 1 73 ARG QG . . 3.690 2.178 1.847 2.487 . 0 0 "[ . 1 . 2]" 1
1278 1 65 LEU QD 1 95 ALA HA . . 3.830 2.674 1.908 3.537 . 0 0 "[ . 1 . 2]" 1
1279 1 65 LEU QD 1 96 GLN H . . 4.730 2.821 2.033 3.702 . 0 0 "[ . 1 . 2]" 1
1280 1 65 LEU QD 1 96 GLN HA . . 4.830 4.064 3.562 4.539 . 0 0 "[ . 1 . 2]" 1
1281 1 65 LEU QD 1 96 GLN HB2 . . 4.020 3.643 2.877 3.962 . 0 0 "[ . 1 . 2]" 1
1282 1 65 LEU QD 1 96 GLN HB3 . . 4.220 2.492 1.933 4.085 . 0 0 "[ . 1 . 2]" 1
1283 1 65 LEU QD 1 96 GLN HG2 . . 4.650 2.455 1.928 3.366 . 0 0 "[ . 1 . 2]" 1
1284 1 65 LEU HG 1 66 SER H . . 5.060 4.800 4.607 5.014 . 0 0 "[ . 1 . 2]" 1
1285 1 65 LEU HG 1 95 ALA HA . . 3.760 3.785 3.170 4.434 0.674 12 9 "[ . * **+- ** **2]" 1
1286 1 65 LEU HG 1 96 GLN H . . 4.590 4.082 3.167 4.632 0.042 13 0 "[ . 1 . 2]" 1
1287 1 66 SER H 1 67 VAL QG . . 4.830 4.290 4.049 4.758 . 0 0 "[ . 1 . 2]" 1
1288 1 66 SER H 1 72 LEU HB2 . . 5.500 5.011 4.331 5.441 . 0 0 "[ . 1 . 2]" 1
1289 1 66 SER H 1 93 ILE MG . . 4.510 4.364 4.076 4.513 0.003 11 0 "[ . 1 . 2]" 1
1290 1 66 SER H 1 94 VAL H . . 3.730 3.138 2.961 3.338 . 0 0 "[ . 1 . 2]" 1
1291 1 66 SER H 1 94 VAL HA . . 5.420 4.792 4.652 4.959 . 0 0 "[ . 1 . 2]" 1
1292 1 66 SER H 1 94 VAL HB . . 4.080 2.730 2.556 2.908 . 0 0 "[ . 1 . 2]" 1
1293 1 66 SER H 1 94 VAL MG2 . . 4.650 4.117 3.843 4.271 . 0 0 "[ . 1 . 2]" 1
1294 1 66 SER H 1 95 ALA HA . . 4.830 4.239 3.889 4.572 . 0 0 "[ . 1 . 2]" 1
1295 1 66 SER HA 1 67 VAL H . . 3.140 2.454 2.378 2.569 . 0 0 "[ . 1 . 2]" 1
1296 1 66 SER HA 1 67 VAL HA . . 4.510 4.452 4.432 4.476 . 0 0 "[ . 1 . 2]" 1
1297 1 66 SER HA 1 67 VAL HB . . 5.060 4.243 4.074 4.697 . 0 0 "[ . 1 . 2]" 1
1298 1 66 SER HA 1 67 VAL QG . . 4.300 3.781 2.986 4.071 . 0 0 "[ . 1 . 2]" 1
1299 1 66 SER HA 1 71 ASN HA . . 3.760 3.657 2.773 3.814 0.054 17 0 "[ . 1 . 2]" 1
1300 1 66 SER HA 1 72 LEU H . . 3.660 2.837 2.238 3.088 . 0 0 "[ . 1 . 2]" 1
1301 1 66 SER HA 1 72 LEU HB2 . . 4.080 3.092 2.349 3.498 . 0 0 "[ . 1 . 2]" 1
1302 1 66 SER HA 1 72 LEU HB3 . . 5.060 4.717 3.956 5.059 . 0 0 "[ . 1 . 2]" 1
1303 1 66 SER HA 1 72 LEU QD . . 3.870 2.802 2.484 3.297 . 0 0 "[ . 1 . 2]" 1
1304 1 66 SER HA 1 72 LEU HG . . 3.560 3.181 2.185 3.572 0.012 17 0 "[ . 1 . 2]" 1
1305 1 66 SER HA 1 73 ARG H . . 5.000 4.691 4.363 4.879 . 0 0 "[ . 1 . 2]" 1
1306 1 66 SER HB2 1 67 VAL H . . 3.970 2.648 2.314 3.595 . 0 0 "[ . 1 . 2]" 1
1307 1 66 SER HB2 1 70 VAL H . . 5.060 2.271 1.911 3.969 . 0 0 "[ . 1 . 2]" 1
1308 1 66 SER HB2 1 71 ASN HA . . 3.690 3.826 3.511 3.994 0.304 9 0 "[ . 1 . 2]" 1
1309 1 66 SER HB2 1 72 LEU H . . 4.510 4.480 4.178 4.675 0.165 7 0 "[ . 1 . 2]" 1
1310 1 66 SER HB2 1 72 LEU HG . . 4.830 4.780 4.577 4.858 0.028 10 0 "[ . 1 . 2]" 1
1311 1 66 SER HB3 1 67 VAL H . . 3.610 3.679 2.459 3.897 0.287 3 0 "[ . 1 . 2]" 1
1312 1 66 SER HB3 1 69 GLY H . . 5.250 5.086 3.847 5.479 0.229 8 0 "[ . 1 . 2]" 1
1313 1 66 SER HB3 1 70 VAL H . . 4.650 3.676 2.112 5.090 0.440 20 0 "[ . 1 . 2]" 1
1314 1 66 SER HB3 1 71 ASN HA . . 3.920 2.815 2.449 3.177 . 0 0 "[ . 1 . 2]" 1
1315 1 66 SER HB3 1 72 LEU H . . 4.650 3.422 2.999 3.721 . 0 0 "[ . 1 . 2]" 1
1316 1 66 SER HB3 1 72 LEU HG . . 4.830 4.708 3.665 4.851 0.021 3 0 "[ . 1 . 2]" 1
1317 1 66 SER HB3 1 94 VAL HB . . 4.830 4.394 4.148 4.512 . 0 0 "[ . 1 . 2]" 1
1318 1 66 SER HB3 1 94 VAL MG2 . . 4.830 4.820 4.603 4.978 0.148 1 0 "[ . 1 . 2]" 1
1319 1 67 VAL H 1 67 VAL HB . . 3.770 2.608 2.376 3.465 . 0 0 "[ . 1 . 2]" 1
1320 1 67 VAL H 1 67 VAL QG . . 3.970 2.876 1.782 3.085 . 0 0 "[ . 1 . 2]" 1
1321 1 67 VAL H 1 68 ASN H . . 5.130 4.283 4.071 4.412 . 0 0 "[ . 1 . 2]" 1
1322 1 67 VAL H 1 69 GLY H . . 5.330 3.608 3.004 4.269 . 0 0 "[ . 1 . 2]" 1
1323 1 67 VAL H 1 70 VAL H . . 3.900 2.238 1.892 3.135 . 0 0 "[ . 1 . 2]" 1
1324 1 67 VAL H 1 70 VAL HB . . 4.300 2.991 1.945 4.249 . 0 0 "[ . 1 . 2]" 1
1325 1 67 VAL H 1 70 VAL QG . . 4.400 2.495 1.704 3.571 . 0 0 "[ . 1 . 2]" 1
1326 1 67 VAL H 1 71 ASN HA . . 5.060 4.877 4.087 5.028 . 0 0 "[ . 1 . 2]" 1
1327 1 67 VAL H 1 72 LEU H . . 4.850 4.683 4.148 4.819 . 0 0 "[ . 1 . 2]" 1
1328 1 67 VAL H 1 72 LEU QD . . 4.080 2.658 2.393 3.234 . 0 0 "[ . 1 . 2]" 1
1329 1 67 VAL H 1 72 LEU HG . . 5.060 3.429 2.335 4.014 . 0 0 "[ . 1 . 2]" 1
1330 1 67 VAL H 1 83 ALA MB . . 5.370 3.929 3.669 4.287 . 0 0 "[ . 1 . 2]" 1
1331 1 67 VAL HA 1 67 VAL QG . . 3.240 2.070 1.955 2.500 . 0 0 "[ . 1 . 2]" 1
1332 1 67 VAL HA 1 68 ASN H . . 3.180 2.217 2.183 2.265 . 0 0 "[ . 1 . 2]" 1
1333 1 67 VAL HA 1 68 ASN HA . . 4.300 4.299 4.288 4.310 0.010 15 0 "[ . 1 . 2]" 1
1334 1 67 VAL HA 1 84 LEU QD . . 5.420 4.082 3.828 4.455 . 0 0 "[ . 1 . 2]" 1
1335 1 67 VAL HA 1 93 ILE MD . . 4.830 4.397 4.042 4.594 . 0 0 "[ . 1 . 2]" 1
1336 1 67 VAL HA 1 93 ILE HG12 . . 4.650 4.541 3.924 4.654 0.004 13 0 "[ . 1 . 2]" 1
1337 1 67 VAL HA 1 93 ILE MG . . 4.300 3.887 3.597 4.206 . 0 0 "[ . 1 . 2]" 1
1338 1 67 VAL HA 1 94 VAL H . . 4.450 3.262 2.983 3.934 . 0 0 "[ . 1 . 2]" 1
1339 1 67 VAL HB 1 68 ASN H . . 5.240 4.395 3.975 4.679 . 0 0 "[ . 1 . 2]" 1
1340 1 67 VAL HB 1 70 VAL H . . 5.120 4.443 4.066 5.070 . 0 0 "[ . 1 . 2]" 1
1341 1 67 VAL HB 1 70 VAL HB . . 4.300 3.929 3.094 4.532 0.232 20 0 "[ . 1 . 2]" 1
1342 1 67 VAL HB 1 70 VAL QG . . 4.400 2.951 1.837 4.293 . 0 0 "[ . 1 . 2]" 1
1343 1 67 VAL HB 1 83 ALA MB . . 3.090 2.433 1.952 3.462 0.372 19 0 "[ . 1 . 2]" 1
1344 1 67 VAL QG 1 68 ASN H . . 3.830 2.739 2.407 3.171 . 0 0 "[ . 1 . 2]" 1
1345 1 67 VAL QG 1 68 ASN HA . . 4.510 3.893 3.724 4.097 . 0 0 "[ . 1 . 2]" 1
1346 1 67 VAL QG 1 68 ASN HB2 . . 4.400 2.427 2.204 2.589 . 0 0 "[ . 1 . 2]" 1
1347 1 67 VAL QG 1 68 ASN HB3 . . 3.790 3.273 2.789 3.735 . 0 0 "[ . 1 . 2]" 1
1348 1 67 VAL QG 1 68 ASN QD . . 3.720 3.792 3.352 4.032 0.312 16 0 "[ . 1 . 2]" 1
1349 1 67 VAL QG 1 70 VAL H . . 5.070 3.984 3.177 4.385 . 0 0 "[ . 1 . 2]" 1
1350 1 67 VAL QG 1 70 VAL HB . . 4.300 3.400 1.736 4.230 . 0 0 "[ . 1 . 2]" 1
1351 1 67 VAL QG 1 83 ALA HA . . 4.400 3.606 3.041 4.044 . 0 0 "[ . 1 . 2]" 1
1352 1 67 VAL QG 1 83 ALA MB . . 3.020 1.972 1.547 2.420 . 0 0 "[ . 1 . 2]" 1
1353 1 67 VAL QG 1 84 LEU HA . . 3.400 2.780 2.524 3.006 . 0 0 "[ . 1 . 2]" 1
1354 1 67 VAL QG 1 87 ALA H . . 4.950 4.420 4.174 4.646 . 0 0 "[ . 1 . 2]" 1
1355 1 67 VAL QG 1 87 ALA HA . . 4.830 4.575 3.957 4.787 . 0 0 "[ . 1 . 2]" 1
1356 1 67 VAL QG 1 87 ALA MB . . 2.960 2.910 2.435 3.119 0.159 13 0 "[ . 1 . 2]" 1
1357 1 68 ASN H 1 69 GLY H . . 4.230 2.901 2.594 3.568 . 0 0 "[ . 1 . 2]" 1
1358 1 68 ASN H 1 91 VAL HA . . 5.030 4.633 4.175 4.996 . 0 0 "[ . 1 . 2]" 1
1359 1 68 ASN H 1 91 VAL QG . . 4.220 2.946 2.613 3.388 . 0 0 "[ . 1 . 2]" 1
1360 1 68 ASN H 1 92 THR H . . 4.230 2.954 2.387 3.455 . 0 0 "[ . 1 . 2]" 1
1361 1 68 ASN H 1 92 THR HB . . 3.870 3.250 2.749 3.749 . 0 0 "[ . 1 . 2]" 1
1362 1 68 ASN H 1 92 THR MG . . 4.940 4.173 3.571 4.814 . 0 0 "[ . 1 . 2]" 1
1363 1 68 ASN HA 1 92 THR H . . 4.650 2.191 1.930 2.392 . 0 0 "[ . 1 . 2]" 1
1364 1 68 ASN HA 1 92 THR HB . . 3.490 2.317 2.066 2.676 . 0 0 "[ . 1 . 2]" 1
1365 1 68 ASN HA 1 92 THR MG . . 4.300 3.966 3.468 4.281 . 0 0 "[ . 1 . 2]" 1
1366 1 68 ASN HB2 1 69 GLY H . . 4.640 4.273 3.089 4.617 . 0 0 "[ . 1 . 2]" 1
1367 1 68 ASN HB2 1 70 VAL QG . . 4.830 4.019 3.441 4.630 . 0 0 "[ . 1 . 2]" 1
1368 1 68 ASN HB2 1 87 ALA HA . . 5.500 3.991 3.541 4.318 . 0 0 "[ . 1 . 2]" 1
1369 1 68 ASN HB2 1 87 ALA MB . . 5.060 3.085 2.587 3.481 . 0 0 "[ . 1 . 2]" 1
1370 1 68 ASN HB3 1 69 GLY H . . 4.940 3.894 2.344 4.276 . 0 0 "[ . 1 . 2]" 1
1371 1 68 ASN HB3 1 70 VAL H . . 5.500 4.661 3.368 5.268 . 0 0 "[ . 1 . 2]" 1
1372 1 68 ASN HB3 1 70 VAL QG . . 4.300 3.423 2.508 4.430 0.130 9 0 "[ . 1 . 2]" 1
1373 1 68 ASN HB3 1 87 ALA HA . . 4.830 4.498 4.165 5.062 0.232 20 0 "[ . 1 . 2]" 1
1374 1 68 ASN HB3 1 87 ALA MB . . 3.790 4.160 3.660 4.631 0.841 1 7 "[+ * . - 1 *. * **]" 1
1375 1 68 ASN HB3 1 91 VAL QG . . 4.510 3.746 3.291 4.215 . 0 0 "[ . 1 . 2]" 1
1376 1 68 ASN QD 1 69 GLY H . . 5.310 5.790 4.698 6.004 0.694 17 17 "[ *-**** ********+**2]" 1
1377 1 68 ASN QD 1 87 ALA HA . . 4.020 2.112 1.859 2.674 . 0 0 "[ . 1 . 2]" 1
1378 1 68 ASN QD 1 87 ALA MB . . 3.330 2.296 1.840 3.124 . 0 0 "[ . 1 . 2]" 1
1379 1 68 ASN QD 1 91 VAL HA . . 3.970 3.079 2.531 3.580 . 0 0 "[ . 1 . 2]" 1
1380 1 68 ASN QD 1 91 VAL QG . . 4.220 2.518 2.168 3.127 . 0 0 "[ . 1 . 2]" 1
1381 1 68 ASN QD 1 92 THR H . . 4.740 3.920 3.472 4.258 . 0 0 "[ . 1 . 2]" 1
1382 1 69 GLY H 1 70 VAL H . . 4.010 2.419 1.708 2.716 . 0 0 "[ . 1 . 2]" 1
1383 1 69 GLY H 1 70 VAL QG . . 5.210 3.739 2.701 4.016 . 0 0 "[ . 1 . 2]" 1
1384 1 69 GLY HA2 1 70 VAL QG . . 4.830 4.382 4.135 4.604 . 0 0 "[ . 1 . 2]" 1
1385 1 69 GLY HA3 1 70 VAL QG . . 5.420 4.300 3.785 4.888 . 0 0 "[ . 1 . 2]" 1
1386 1 70 VAL H 1 70 VAL HB . . 3.370 2.756 2.494 3.503 0.133 20 0 "[ . 1 . 2]" 1
1387 1 70 VAL H 1 70 VAL QG . . 3.050 2.594 1.891 2.851 . 0 0 "[ . 1 . 2]" 1
1388 1 70 VAL H 1 71 ASN H . . 4.980 4.352 4.104 4.540 . 0 0 "[ . 1 . 2]" 1
1389 1 70 VAL HA 1 70 VAL QG . . 2.900 2.134 2.066 2.323 . 0 0 "[ . 1 . 2]" 1
1390 1 70 VAL HA 1 71 ASN H . . 2.820 2.266 2.182 2.774 . 0 0 "[ . 1 . 2]" 1
1391 1 70 VAL HA 1 71 ASN HA . . 4.650 4.311 4.283 4.434 . 0 0 "[ . 1 . 2]" 1
1392 1 70 VAL HA 1 71 ASN HB2 . . 4.020 4.260 4.173 4.370 0.350 18 0 "[ . 1 . 2]" 1
1393 1 70 VAL HB 1 71 ASN H . . 4.780 4.209 2.126 4.494 . 0 0 "[ . 1 . 2]" 1
1394 1 70 VAL HB 1 72 LEU QD . . 4.510 3.249 2.408 3.960 . 0 0 "[ . 1 . 2]" 1
1395 1 70 VAL HB 1 83 ALA MB . . 3.870 3.224 2.639 3.868 . 0 0 "[ . 1 . 2]" 1
1396 1 70 VAL QG 1 71 ASN H . . 3.510 2.578 2.368 2.995 . 0 0 "[ . 1 . 2]" 1
1397 1 70 VAL QG 1 71 ASN HA . . 4.650 3.842 3.335 4.171 . 0 0 "[ . 1 . 2]" 1
1398 1 70 VAL QG 1 71 ASN HB2 . . 4.510 4.286 4.025 4.586 0.076 20 0 "[ . 1 . 2]" 1
1399 1 70 VAL QG 1 72 LEU H . . 5.500 3.947 3.475 4.539 . 0 0 "[ . 1 . 2]" 1
1400 1 70 VAL QG 1 72 LEU HA . . 4.650 4.076 3.722 4.410 . 0 0 "[ . 1 . 2]" 1
1401 1 70 VAL QG 1 72 LEU QD . . 2.970 1.887 1.696 2.145 . 0 0 "[ . 1 . 2]" 1
1402 1 70 VAL QG 1 72 LEU HG . . 3.790 2.111 1.843 3.198 . 0 0 "[ . 1 . 2]" 1
1403 1 70 VAL QG 1 83 ALA HA . . 4.400 3.542 3.191 3.855 . 0 0 "[ . 1 . 2]" 1
1404 1 70 VAL QG 1 83 ALA MB . . 3.360 2.141 1.770 2.705 . 0 0 "[ . 1 . 2]" 1
1405 1 71 ASN H 1 71 ASN HB2 . . 3.100 2.323 2.032 3.119 0.019 20 0 "[ . 1 . 2]" 1
1406 1 71 ASN H 1 71 ASN HD21 . . 5.300 4.443 3.788 4.879 . 0 0 "[ . 1 . 2]" 1
1407 1 71 ASN HA 1 72 LEU H . . 3.140 2.261 2.252 2.293 . 0 0 "[ . 1 . 2]" 1
1408 1 71 ASN HA 1 72 LEU HB2 . . 5.060 4.765 4.643 4.930 . 0 0 "[ . 1 . 2]" 1
1409 1 71 ASN HA 1 72 LEU HG . . 4.400 3.946 3.652 4.412 0.012 10 0 "[ . 1 . 2]" 1
1410 1 71 ASN HA 1 73 ARG H . . 4.080 3.330 3.203 3.848 . 0 0 "[ . 1 . 2]" 1
1411 1 71 ASN HB3 1 72 LEU H . . 5.030 4.220 3.958 4.365 . 0 0 "[ . 1 . 2]" 1
1412 1 71 ASN HB3 1 73 ARG H . . 5.100 4.349 3.872 4.777 . 0 0 "[ . 1 . 2]" 1
1413 1 72 LEU H 1 72 LEU QD . . 4.140 3.441 3.160 3.628 . 0 0 "[ . 1 . 2]" 1
1414 1 72 LEU H 1 72 LEU HG . . 4.250 2.915 2.580 3.212 . 0 0 "[ . 1 . 2]" 1
1415 1 72 LEU H 1 73 ARG H . . 3.220 2.064 1.875 2.656 . 0 0 "[ . 1 . 2]" 1
1416 1 72 LEU H 1 73 ARG HA . . 5.500 4.042 3.853 4.315 . 0 0 "[ . 1 . 2]" 1
1417 1 72 LEU H 1 73 ARG QG . . 5.160 3.807 3.279 4.612 . 0 0 "[ . 1 . 2]" 1
1418 1 72 LEU H 1 75 ALA MB . . 5.500 4.318 4.114 4.680 . 0 0 "[ . 1 . 2]" 1
1419 1 72 LEU HA 1 72 LEU QD . . 2.900 2.201 1.912 2.374 . 0 0 "[ . 1 . 2]" 1
1420 1 72 LEU HA 1 74 ASN H . . 5.340 3.603 3.148 4.446 . 0 0 "[ . 1 . 2]" 1
1421 1 72 LEU HA 1 75 ALA H . . 4.070 3.482 2.652 4.029 . 0 0 "[ . 1 . 2]" 1
1422 1 72 LEU HA 1 75 ALA MB . . 2.920 1.969 1.766 2.351 . 0 0 "[ . 1 . 2]" 1
1423 1 72 LEU HB2 1 72 LEU QD . . 3.080 2.184 2.030 2.477 . 0 0 "[ . 1 . 2]" 1
1424 1 72 LEU HB2 1 73 ARG H . . 4.840 3.864 3.618 4.325 . 0 0 "[ . 1 . 2]" 1
1425 1 72 LEU HB2 1 75 ALA MB . . 4.140 3.461 3.370 3.587 . 0 0 "[ . 1 . 2]" 1
1426 1 72 LEU HB2 1 80 ALA MB . . 5.060 3.937 3.552 4.454 . 0 0 "[ . 1 . 2]" 1
1427 1 72 LEU HB2 1 83 ALA MB . . 5.060 4.955 4.550 5.144 0.084 17 0 "[ . 1 . 2]" 1
1428 1 72 LEU HB3 1 75 ALA H . . 4.600 3.734 3.507 4.007 . 0 0 "[ . 1 . 2]" 1
1429 1 72 LEU HB3 1 75 ALA MB . . 3.130 2.046 1.959 2.299 . 0 0 "[ . 1 . 2]" 1
1430 1 72 LEU HB3 1 80 ALA HA . . 4.300 3.410 2.937 4.086 . 0 0 "[ . 1 . 2]" 1
1431 1 72 LEU HB3 1 80 ALA MB . . 3.530 2.955 2.492 3.499 . 0 0 "[ . 1 . 2]" 1
1432 1 72 LEU QD 1 73 ARG H . . 5.060 4.451 4.217 4.540 . 0 0 "[ . 1 . 2]" 1
1433 1 72 LEU QD 1 75 ALA H . . 4.830 4.313 3.929 4.536 . 0 0 "[ . 1 . 2]" 1
1434 1 72 LEU QD 1 75 ALA HA . . 4.510 4.314 3.972 4.441 . 0 0 "[ . 1 . 2]" 1
1435 1 72 LEU QD 1 75 ALA MB . . 2.650 2.073 1.790 2.203 . 0 0 "[ . 1 . 2]" 1
1436 1 72 LEU QD 1 76 THR H . . 5.060 4.647 4.043 4.927 . 0 0 "[ . 1 . 2]" 1
1437 1 72 LEU QD 1 79 GLN HB2 . . 4.510 3.668 3.293 4.248 . 0 0 "[ . 1 . 2]" 1
1438 1 72 LEU QD 1 79 GLN HB3 . . 3.970 2.753 2.477 3.324 . 0 0 "[ . 1 . 2]" 1
1439 1 72 LEU QD 1 80 ALA H . . 4.400 3.471 3.180 3.779 . 0 0 "[ . 1 . 2]" 1
1440 1 72 LEU QD 1 80 ALA HA . . 3.120 1.867 1.755 1.964 . 0 0 "[ . 1 . 2]" 1
1441 1 72 LEU QD 1 80 ALA MB . . 3.450 2.564 2.006 2.941 . 0 0 "[ . 1 . 2]" 1
1442 1 72 LEU QD 1 81 ALA H . . 5.210 4.410 4.243 4.627 . 0 0 "[ . 1 . 2]" 1
1443 1 72 LEU QD 1 83 ALA H . . 4.650 3.582 3.374 3.845 . 0 0 "[ . 1 . 2]" 1
1444 1 72 LEU QD 1 83 ALA MB . . 3.150 1.949 1.774 2.233 . 0 0 "[ . 1 . 2]" 1
1445 1 72 LEU HG 1 80 ALA HA . . 4.830 4.383 4.124 4.688 . 0 0 "[ . 1 . 2]" 1
1446 1 73 ARG H 1 73 ARG HB2 . . 3.270 2.280 2.093 2.484 . 0 0 "[ . 1 . 2]" 1
1447 1 73 ARG H 1 73 ARG HB3 . . 3.320 3.508 3.384 3.574 0.254 11 0 "[ . 1 . 2]" 1
1448 1 73 ARG H 1 73 ARG HD3 . . 4.510 4.095 3.385 5.136 0.626 6 2 "[ .+ - . 2]" 1
1449 1 73 ARG H 1 73 ARG QG . . 4.300 2.628 2.176 3.130 . 0 0 "[ . 1 . 2]" 1
1450 1 73 ARG H 1 75 ALA MB . . 4.930 4.324 4.001 4.691 . 0 0 "[ . 1 . 2]" 1
1451 1 73 ARG HA 1 73 ARG HD3 . . 4.510 4.380 4.147 4.547 0.037 6 0 "[ . 1 . 2]" 1
1452 1 73 ARG HA 1 73 ARG QG . . 3.350 2.215 2.085 2.344 . 0 0 "[ . 1 . 2]" 1
1453 1 73 ARG HA 1 75 ALA H . . 5.370 4.494 3.999 5.014 . 0 0 "[ . 1 . 2]" 1
1454 1 73 ARG HB2 1 73 ARG HD3 . . 3.920 2.587 2.110 3.725 . 0 0 "[ . 1 . 2]" 1
1455 1 73 ARG HB2 1 74 ASN H . . 3.950 2.802 2.193 3.158 . 0 0 "[ . 1 . 2]" 1
1456 1 73 ARG HB2 1 74 ASN HA . . 5.420 4.991 4.659 5.239 . 0 0 "[ . 1 . 2]" 1
1457 1 73 ARG HB3 1 73 ARG HD3 . . 3.920 2.989 2.602 3.285 . 0 0 "[ . 1 . 2]" 1
1458 1 73 ARG HB3 1 74 ASN H . . 4.150 3.223 2.566 3.851 . 0 0 "[ . 1 . 2]" 1
1459 1 73 ARG QG 1 74 ASN H . . 5.410 4.355 4.093 4.533 . 0 0 "[ . 1 . 2]" 1
1460 1 74 ASN H 1 74 ASN HB3 . . 3.740 3.711 3.484 3.916 0.176 16 0 "[ . 1 . 2]" 1
1461 1 74 ASN H 1 75 ALA H . . 3.430 2.969 2.045 3.339 . 0 0 "[ . 1 . 2]" 1
1462 1 74 ASN H 1 75 ALA MB . . 4.540 3.686 3.446 4.032 . 0 0 "[ . 1 . 2]" 1
1463 1 74 ASN HA 1 74 ASN HD21 . . 4.220 3.258 2.012 4.169 . 0 0 "[ . 1 . 2]" 1
1464 1 74 ASN HA 1 74 ASN HD22 . . 4.830 4.133 3.584 4.799 . 0 0 "[ . 1 . 2]" 1
1465 1 74 ASN HA 1 75 ALA MB . . 4.830 4.486 4.347 4.637 . 0 0 "[ . 1 . 2]" 1
1466 1 74 ASN HB2 1 75 ALA H . . 5.000 4.368 4.124 4.494 . 0 0 "[ . 1 . 2]" 1
1467 1 74 ASN HB3 1 75 ALA H . . 4.900 4.481 4.341 4.716 . 0 0 "[ . 1 . 2]" 1
1468 1 74 ASN HB3 1 75 ALA HA . . 4.920 4.871 4.542 5.747 0.827 1 2 "[+ . 1 . - 2]" 1
1469 1 75 ALA H 1 75 ALA MB . . 3.040 2.271 2.112 2.426 . 0 0 "[ . 1 . 2]" 1
1470 1 75 ALA H 1 76 THR H . . 4.840 4.519 4.418 4.636 . 0 0 "[ . 1 . 2]" 1
1471 1 75 ALA HA 1 76 THR H . . 3.060 2.408 2.275 2.650 . 0 0 "[ . 1 . 2]" 1
1472 1 75 ALA HA 1 76 THR MG . . 3.830 3.457 3.135 3.752 . 0 0 "[ . 1 . 2]" 1
1473 1 75 ALA HA 1 79 GLN HB2 . . 4.400 3.813 3.433 4.297 . 0 0 "[ . 1 . 2]" 1
1474 1 75 ALA HA 1 79 GLN HB3 . . 4.650 4.234 3.483 4.575 . 0 0 "[ . 1 . 2]" 1
1475 1 75 ALA MB 1 76 THR H . . 3.320 2.617 2.128 2.910 . 0 0 "[ . 1 . 2]" 1
1476 1 75 ALA MB 1 79 GLN H . . 4.420 4.282 4.124 4.395 . 0 0 "[ . 1 . 2]" 1
1477 1 75 ALA MB 1 79 GLN HB2 . . 3.330 2.322 2.121 2.736 . 0 0 "[ . 1 . 2]" 1
1478 1 75 ALA MB 1 79 GLN HB3 . . 3.350 2.255 1.990 2.554 . 0 0 "[ . 1 . 2]" 1
1479 1 75 ALA MB 1 79 GLN HG2 . . 4.650 4.294 4.020 4.624 . 0 0 "[ . 1 . 2]" 1
1480 1 75 ALA MB 1 79 GLN HG3 . . 4.510 4.251 3.824 4.486 . 0 0 "[ . 1 . 2]" 1
1481 1 75 ALA MB 1 80 ALA H . . 3.850 3.434 3.026 3.813 . 0 0 "[ . 1 . 2]" 1
1482 1 75 ALA MB 1 80 ALA HA . . 4.220 3.670 3.385 3.933 . 0 0 "[ . 1 . 2]" 1
1483 1 75 ALA MB 1 80 ALA MB . . 3.360 3.182 2.817 3.371 0.011 15 0 "[ . 1 . 2]" 1
1484 1 76 THR H 1 76 THR MG . . 3.170 2.181 1.888 2.522 . 0 0 "[ . 1 . 2]" 1
1485 1 76 THR H 1 77 HIS H . . 5.500 4.606 4.388 4.663 . 0 0 "[ . 1 . 2]" 1
1486 1 76 THR H 1 79 GLN H . . 4.380 3.681 3.384 3.925 . 0 0 "[ . 1 . 2]" 1
1487 1 76 THR H 1 79 GLN HA . . 5.500 5.105 4.849 5.377 . 0 0 "[ . 1 . 2]" 1
1488 1 76 THR H 1 79 GLN HB2 . . 3.590 2.192 1.934 2.510 . 0 0 "[ . 1 . 2]" 1
1489 1 76 THR H 1 79 GLN HB3 . . 4.020 3.481 3.069 3.868 . 0 0 "[ . 1 . 2]" 1
1490 1 76 THR H 1 79 GLN HG2 . . 4.830 4.497 4.238 4.782 . 0 0 "[ . 1 . 2]" 1
1491 1 76 THR H 1 79 GLN HG3 . . 4.480 3.490 2.911 3.885 . 0 0 "[ . 1 . 2]" 1
1492 1 76 THR HA 1 76 THR MG . . 3.100 2.434 2.242 2.622 . 0 0 "[ . 1 . 2]" 1
1493 1 76 THR HA 1 77 HIS H . . 3.430 2.460 2.292 2.829 . 0 0 "[ . 1 . 2]" 1
1494 1 76 THR HA 1 77 HIS HB2 . . 5.060 4.498 4.408 4.594 . 0 0 "[ . 1 . 2]" 1
1495 1 76 THR HA 1 77 HIS HB3 . . 5.420 5.104 4.881 5.263 . 0 0 "[ . 1 . 2]" 1
1496 1 76 THR HB 1 77 HIS H . . 3.520 2.597 2.100 2.978 . 0 0 "[ . 1 . 2]" 1
1497 1 76 THR HB 1 78 GLU H . . 4.400 3.229 2.891 3.600 . 0 0 "[ . 1 . 2]" 1
1498 1 76 THR MG 1 77 HIS H . . 4.220 3.886 3.572 4.161 . 0 0 "[ . 1 . 2]" 1
1499 1 76 THR MG 1 78 GLU H . . 4.830 4.608 4.405 4.758 . 0 0 "[ . 1 . 2]" 1
1500 1 76 THR MG 1 79 GLN H . . 4.490 4.072 3.709 4.482 . 0 0 "[ . 1 . 2]" 1
1501 1 76 THR MG 1 79 GLN HA . . 5.500 5.631 5.154 6.188 0.688 5 6 "[-** +* 1 . *2]" 1
1502 1 76 THR MG 1 79 GLN HB2 . . 4.140 3.619 3.005 4.200 0.060 2 0 "[ . 1 . 2]" 1
1503 1 76 THR MG 1 79 GLN HE21 . . 5.060 3.558 1.936 5.044 . 0 0 "[ . 1 . 2]" 1
1504 1 76 THR MG 1 79 GLN HE22 . . 4.650 3.633 2.458 4.592 . 0 0 "[ . 1 . 2]" 1
1505 1 76 THR MG 1 79 GLN HG3 . . 4.400 3.497 2.652 4.193 . 0 0 "[ . 1 . 2]" 1
1506 1 77 HIS H 1 77 HIS HB2 . . 3.610 2.270 2.089 2.592 . 0 0 "[ . 1 . 2]" 1
1507 1 77 HIS H 1 77 HIS HB3 . . 3.630 2.678 2.452 2.950 . 0 0 "[ . 1 . 2]" 1
1508 1 77 HIS H 1 78 GLU H . . 3.930 2.854 2.410 3.092 . 0 0 "[ . 1 . 2]" 1
1509 1 77 HIS H 1 79 GLN H . . 5.360 4.399 3.733 4.617 . 0 0 "[ . 1 . 2]" 1
1510 1 77 HIS HA 1 77 HIS HD2 . . 4.650 2.392 2.329 2.578 . 0 0 "[ . 1 . 2]" 1
1511 1 77 HIS HA 1 80 ALA H . . 4.300 3.564 3.332 3.704 . 0 0 "[ . 1 . 2]" 1
1512 1 77 HIS HA 1 80 ALA MB . . 3.580 2.626 2.429 2.891 . 0 0 "[ . 1 . 2]" 1
1513 1 77 HIS HA 1 81 ALA MB . . 4.830 4.689 4.475 4.814 . 0 0 "[ . 1 . 2]" 1
1514 1 77 HIS HB2 1 78 GLU H . . 4.570 3.760 3.545 3.959 . 0 0 "[ . 1 . 2]" 1
1515 1 77 HIS HB3 1 78 GLU H . . 3.990 2.552 2.331 2.818 . 0 0 "[ . 1 . 2]" 1
1516 1 77 HIS HB3 1 78 GLU HB2 . . 5.420 4.180 3.963 4.519 . 0 0 "[ . 1 . 2]" 1
1517 1 77 HIS HD2 1 78 GLU HA . . 4.830 4.735 4.392 4.807 . 0 0 "[ . 1 . 2]" 1
1518 1 77 HIS HD2 1 81 ALA MB . . 4.140 3.730 3.343 3.947 . 0 0 "[ . 1 . 2]" 1
1519 1 78 GLU H 1 78 GLU HB2 . . 3.510 2.332 2.039 2.837 . 0 0 "[ . 1 . 2]" 1
1520 1 78 GLU H 1 78 GLU HB3 . . 3.660 2.687 2.201 3.100 . 0 0 "[ . 1 . 2]" 1
1521 1 78 GLU H 1 78 GLU HG2 . . 4.140 4.379 4.130 4.527 0.387 1 0 "[ . 1 . 2]" 1
1522 1 78 GLU H 1 79 GLN H . . 3.650 2.819 2.601 3.004 . 0 0 "[ . 1 . 2]" 1
1523 1 78 GLU H 1 80 ALA H . . 4.630 4.111 3.829 4.429 . 0 0 "[ . 1 . 2]" 1
1524 1 78 GLU H 1 81 ALA MB . . 4.510 4.406 4.274 4.504 . 0 0 "[ . 1 . 2]" 1
1525 1 78 GLU HA 1 78 GLU HG2 . . 3.430 2.934 2.515 3.406 . 0 0 "[ . 1 . 2]" 1
1526 1 78 GLU HA 1 81 ALA H . . 3.920 3.153 2.926 3.298 . 0 0 "[ . 1 . 2]" 1
1527 1 78 GLU HA 1 81 ALA MB . . 3.270 2.281 2.219 2.398 . 0 0 "[ . 1 . 2]" 1
1528 1 78 GLU HA 1 82 ALA H . . 4.830 3.817 3.394 4.061 . 0 0 "[ . 1 . 2]" 1
1529 1 78 GLU HB2 1 79 GLN H . . 4.010 3.623 3.221 3.966 . 0 0 "[ . 1 . 2]" 1
1530 1 78 GLU HB2 1 81 ALA MB . . 4.650 4.555 4.186 4.765 0.115 19 0 "[ . 1 . 2]" 1
1531 1 78 GLU HB3 1 79 GLN H . . 3.920 2.504 2.228 2.828 . 0 0 "[ . 1 . 2]" 1
1532 1 78 GLU HB3 1 81 ALA MB . . 5.060 4.751 4.597 4.977 . 0 0 "[ . 1 . 2]" 1
1533 1 78 GLU HG2 1 81 ALA MB . . 4.510 3.976 3.565 4.509 . 0 0 "[ . 1 . 2]" 1
1534 1 78 GLU HG2 1 82 ALA MB . . 4.140 3.441 2.932 4.376 0.236 6 0 "[ . 1 . 2]" 1
1535 1 78 GLU HG3 1 79 GLN H . . 4.650 4.691 4.015 5.145 0.495 15 0 "[ . 1 . 2]" 1
1536 1 79 GLN H 1 79 GLN HB2 . . 3.320 2.281 2.107 2.515 . 0 0 "[ . 1 . 2]" 1
1537 1 79 GLN H 1 79 GLN HB3 . . 3.770 3.501 3.414 3.558 . 0 0 "[ . 1 . 2]" 1
1538 1 79 GLN H 1 79 GLN HG2 . . 3.920 3.566 3.341 3.821 . 0 0 "[ . 1 . 2]" 1
1539 1 79 GLN H 1 79 GLN HG3 . . 3.570 2.560 2.017 3.192 . 0 0 "[ . 1 . 2]" 1
1540 1 79 GLN H 1 80 ALA H . . 3.320 2.839 2.629 2.946 . 0 0 "[ . 1 . 2]" 1
1541 1 79 GLN H 1 80 ALA MB . . 4.770 4.406 4.251 4.497 . 0 0 "[ . 1 . 2]" 1
1542 1 79 GLN H 1 81 ALA H . . 4.900 4.002 3.799 4.304 . 0 0 "[ . 1 . 2]" 1
1543 1 79 GLN HA 1 79 GLN HG2 . . 3.220 2.314 1.994 2.625 . 0 0 "[ . 1 . 2]" 1
1544 1 79 GLN HA 1 79 GLN HG3 . . 3.530 2.865 2.593 3.216 . 0 0 "[ . 1 . 2]" 1
1545 1 79 GLN HA 1 82 ALA H . . 4.300 3.239 3.016 3.631 . 0 0 "[ . 1 . 2]" 1
1546 1 79 GLN HA 1 82 ALA MB . . 3.260 2.307 2.051 2.558 . 0 0 "[ . 1 . 2]" 1
1547 1 79 GLN HB2 1 80 ALA H . . 3.760 2.852 2.544 3.223 . 0 0 "[ . 1 . 2]" 1
1548 1 79 GLN HB2 1 80 ALA MB . . 4.830 4.159 3.979 4.357 . 0 0 "[ . 1 . 2]" 1
1549 1 79 GLN HB3 1 80 ALA H . . 4.070 3.485 3.175 3.991 . 0 0 "[ . 1 . 2]" 1
1550 1 79 GLN HB3 1 80 ALA HA . . 4.830 4.176 4.001 4.513 . 0 0 "[ . 1 . 2]" 1
1551 1 79 GLN HG3 1 82 ALA MB . . 4.650 4.605 4.361 5.013 0.363 15 0 "[ . 1 . 2]" 1
1552 1 80 ALA H 1 80 ALA MB . . 3.080 2.109 2.011 2.178 . 0 0 "[ . 1 . 2]" 1
1553 1 80 ALA H 1 81 ALA H . . 3.320 2.532 2.274 2.662 . 0 0 "[ . 1 . 2]" 1
1554 1 80 ALA H 1 81 ALA MB . . 4.230 4.063 3.807 4.189 . 0 0 "[ . 1 . 2]" 1
1555 1 80 ALA H 1 82 ALA H . . 5.140 4.099 3.871 4.301 . 0 0 "[ . 1 . 2]" 1
1556 1 80 ALA HA 1 83 ALA H . . 3.990 3.637 3.450 3.944 . 0 0 "[ . 1 . 2]" 1
1557 1 80 ALA HA 1 83 ALA MB . . 3.220 2.765 2.582 3.226 0.006 17 0 "[ . 1 . 2]" 1
1558 1 80 ALA MB 1 81 ALA H . . 3.390 2.867 2.660 3.034 . 0 0 "[ . 1 . 2]" 1
1559 1 80 ALA MB 1 82 ALA H . . 4.890 4.714 4.480 4.827 . 0 0 "[ . 1 . 2]" 1
1560 1 81 ALA H 1 81 ALA MB . . 2.920 2.006 1.952 2.081 . 0 0 "[ . 1 . 2]" 1
1561 1 81 ALA H 1 82 ALA H . . 3.380 2.409 2.220 2.589 . 0 0 "[ . 1 . 2]" 1
1562 1 81 ALA H 1 82 ALA MB . . 4.110 3.887 3.670 4.055 . 0 0 "[ . 1 . 2]" 1
1563 1 81 ALA H 1 83 ALA H . . 4.900 3.693 3.512 3.869 . 0 0 "[ . 1 . 2]" 1
1564 1 81 ALA H 1 84 LEU QD . . 5.180 4.533 3.951 4.989 . 0 0 "[ . 1 . 2]" 1
1565 1 81 ALA HA 1 84 LEU H . . 4.220 3.156 2.874 3.361 . 0 0 "[ . 1 . 2]" 1
1566 1 81 ALA HA 1 84 LEU HB2 . . 3.790 2.705 2.509 2.826 . 0 0 "[ . 1 . 2]" 1
1567 1 81 ALA HA 1 84 LEU QD . . 3.360 2.505 2.040 2.937 . 0 0 "[ . 1 . 2]" 1
1568 1 81 ALA HA 1 84 LEU HG . . 4.510 4.119 3.507 4.534 0.024 17 0 "[ . 1 . 2]" 1
1569 1 81 ALA MB 1 82 ALA H . . 3.250 2.697 2.548 2.926 . 0 0 "[ . 1 . 2]" 1
1570 1 81 ALA MB 1 84 LEU HB2 . . 3.920 3.888 3.597 4.004 0.084 19 0 "[ . 1 . 2]" 1
1571 1 81 ALA MB 1 84 LEU QD . . 3.970 3.777 3.537 3.903 . 0 0 "[ . 1 . 2]" 1
1572 1 82 ALA H 1 82 ALA MB . . 2.780 1.946 1.933 1.996 . 0 0 "[ . 1 . 2]" 1
1573 1 82 ALA H 1 83 ALA H . . 3.510 2.694 2.546 2.842 . 0 0 "[ . 1 . 2]" 1
1574 1 82 ALA HA 1 85 LYS H . . 3.690 3.045 2.886 3.580 . 0 0 "[ . 1 . 2]" 1
1575 1 82 ALA HA 1 85 LYS HB2 . . 3.220 2.310 2.006 3.890 0.670 9 1 "[ . +1 . 2]" 1
1576 1 82 ALA HA 1 85 LYS HD2 . . 4.080 3.180 2.439 4.203 0.123 1 0 "[ . 1 . 2]" 1
1577 1 83 ALA H 1 83 ALA MB . . 2.840 2.038 1.944 2.182 . 0 0 "[ . 1 . 2]" 1
1578 1 83 ALA H 1 84 LEU HB2 . . 4.980 4.374 4.154 4.608 . 0 0 "[ . 1 . 2]" 1
1579 1 83 ALA HA 1 86 ARG H . . 4.170 3.395 3.059 3.665 . 0 0 "[ . 1 . 2]" 1
1580 1 83 ALA HA 1 86 ARG HB3 . . 3.830 3.680 3.391 3.833 0.003 10 0 "[ . 1 . 2]" 1
1581 1 83 ALA HA 1 86 ARG QD . . 4.650 3.089 1.825 4.275 . 0 0 "[ . 1 . 2]" 1
1582 1 83 ALA HA 1 86 ARG HG2 . . 3.760 2.059 1.969 2.525 . 0 0 "[ . 1 . 2]" 1
1583 1 83 ALA HA 1 87 ALA H . . 4.440 4.577 4.128 4.665 0.225 10 0 "[ . 1 . 2]" 1
1584 1 83 ALA MB 1 84 LEU H . . 3.210 2.996 2.419 3.179 . 0 0 "[ . 1 . 2]" 1
1585 1 83 ALA MB 1 84 LEU HA . . 4.400 3.928 3.652 4.025 . 0 0 "[ . 1 . 2]" 1
1586 1 83 ALA MB 1 86 ARG QD . . 4.080 3.892 2.700 4.691 0.611 18 6 "[ . -1 * ** + *]" 1
1587 1 84 LEU H 1 84 LEU HB2 . . 3.530 2.235 2.164 2.299 . 0 0 "[ . 1 . 2]" 1
1588 1 84 LEU H 1 84 LEU HB3 . . 3.720 3.495 3.449 3.546 . 0 0 "[ . 1 . 2]" 1
1589 1 84 LEU H 1 84 LEU QD . . 3.830 2.832 2.094 3.475 . 0 0 "[ . 1 . 2]" 1
1590 1 84 LEU H 1 84 LEU HG . . 3.630 3.826 2.868 4.400 0.770 15 11 "[ * *** *1 ** + **-]" 1
1591 1 84 LEU HA 1 84 LEU QD . . 2.870 1.942 1.850 2.135 . 0 0 "[ . 1 . 2]" 1
1592 1 84 LEU HA 1 84 LEU HG . . 3.560 3.324 2.839 3.592 0.032 17 0 "[ . 1 . 2]" 1
1593 1 84 LEU HA 1 87 ALA H . . 4.490 3.209 2.958 3.370 . 0 0 "[ . 1 . 2]" 1
1594 1 84 LEU HA 1 87 ALA MB . . 3.450 2.368 1.994 2.673 . 0 0 "[ . 1 . 2]" 1
1595 1 84 LEU HB2 1 84 LEU QD . . 3.130 2.151 2.061 2.247 . 0 0 "[ . 1 . 2]" 1
1596 1 84 LEU HB3 1 84 LEU QD . . 3.100 2.314 2.110 2.452 . 0 0 "[ . 1 . 2]" 1
1597 1 84 LEU HB3 1 85 LYS H . . 4.030 3.894 3.707 4.019 . 0 0 "[ . 1 . 2]" 1
1598 1 84 LEU HB3 1 85 LYS HA . . 5.060 4.395 4.306 4.466 . 0 0 "[ . 1 . 2]" 1
1599 1 84 LEU QD 1 85 LYS H . . 5.500 4.109 3.928 4.398 . 0 0 "[ . 1 . 2]" 1
1600 1 85 LYS H 1 85 LYS HB2 . . 2.890 2.219 2.115 3.083 0.193 9 0 "[ . 1 . 2]" 1
1601 1 85 LYS H 1 85 LYS HD2 . . 4.260 2.683 2.217 3.685 . 0 0 "[ . 1 . 2]" 1
1602 1 85 LYS H 1 85 LYS QE . . 5.060 4.084 2.385 4.515 . 0 0 "[ . 1 . 2]" 1
1603 1 85 LYS H 1 85 LYS HG2 . . 4.210 4.326 4.073 4.449 0.239 14 0 "[ . 1 . 2]" 1
1604 1 85 LYS H 1 85 LYS HG3 . . 4.210 3.742 3.411 4.583 0.373 9 0 "[ . 1 . 2]" 1
1605 1 85 LYS H 1 86 ARG HA . . 5.290 4.884 4.757 5.021 . 0 0 "[ . 1 . 2]" 1
1606 1 85 LYS H 1 87 ALA H . . 5.180 3.672 3.366 3.910 . 0 0 "[ . 1 . 2]" 1
1607 1 85 LYS HA 1 85 LYS HB3 . . 2.930 2.689 2.638 2.955 0.025 9 0 "[ . 1 . 2]" 1
1608 1 85 LYS HA 1 85 LYS HD2 . . 3.970 3.441 2.593 3.952 . 0 0 "[ . 1 . 2]" 1
1609 1 85 LYS HA 1 85 LYS QE . . 4.300 3.746 2.403 4.340 0.040 9 0 "[ . 1 . 2]" 1
1610 1 85 LYS HA 1 85 LYS HG2 . . 3.630 3.278 2.850 3.549 . 0 0 "[ . 1 . 2]" 1
1611 1 85 LYS HA 1 85 LYS HG3 . . 3.830 2.178 1.995 3.762 . 0 0 "[ . 1 . 2]" 1
1612 1 85 LYS HA 1 87 ALA H . . 4.830 3.845 3.720 4.076 . 0 0 "[ . 1 . 2]" 1
1613 1 85 LYS HB2 1 85 LYS HD2 . . 3.430 2.481 2.080 3.816 0.386 9 0 "[ . 1 . 2]" 1
1614 1 85 LYS HB2 1 85 LYS QE . . 4.650 3.857 3.004 4.049 . 0 0 "[ . 1 . 2]" 1
1615 1 85 LYS HB2 1 86 ARG H . . 3.490 3.338 2.939 4.405 0.915 9 1 "[ . +1 . 2]" 1
1616 1 85 LYS HD2 1 85 LYS QE . . 2.670 2.226 2.181 2.528 . 0 0 "[ . 1 . 2]" 1
1617 1 85 LYS HD2 1 85 LYS HG2 . . 2.780 2.985 2.482 3.056 0.276 10 0 "[ . 1 . 2]" 1
1618 1 85 LYS HD3 1 85 LYS HG3 . . 2.820 2.985 2.482 3.056 0.236 1 0 "[ . 1 . 2]" 1
1619 1 85 LYS QE 1 85 LYS HG2 . . 3.350 2.833 2.450 3.367 0.017 9 0 "[ . 1 . 2]" 1
1620 1 85 LYS QE 1 85 LYS HG3 . . 3.410 2.198 1.997 2.504 . 0 0 "[ . 1 . 2]" 1
1621 1 86 ARG H 1 86 ARG HB2 . . 3.720 3.618 3.570 3.637 . 0 0 "[ . 1 . 2]" 1
1622 1 86 ARG H 1 86 ARG HB3 . . 3.610 2.558 2.396 2.679 . 0 0 "[ . 1 . 2]" 1
1623 1 86 ARG H 1 86 ARG QD . . 4.510 3.986 3.168 4.116 . 0 0 "[ . 1 . 2]" 1
1624 1 86 ARG H 1 86 ARG HG2 . . 3.530 2.637 2.294 3.139 . 0 0 "[ . 1 . 2]" 1
1625 1 86 ARG H 1 87 ALA H . . 3.250 2.279 2.163 2.430 . 0 0 "[ . 1 . 2]" 1
1626 1 86 ARG H 1 87 ALA HA . . 4.770 4.738 4.678 4.809 0.039 17 0 "[ . 1 . 2]" 1
1627 1 86 ARG H 1 87 ALA MB . . 4.470 3.837 3.709 3.957 . 0 0 "[ . 1 . 2]" 1
1628 1 86 ARG HA 1 86 ARG QD . . 4.400 4.079 3.726 4.415 0.015 12 0 "[ . 1 . 2]" 1
1629 1 86 ARG HA 1 86 ARG HG3 . . 3.350 3.610 3.563 3.856 0.506 14 1 "[ . 1 +. 2]" 1
1630 1 86 ARG HB2 1 86 ARG QD . . 3.380 2.177 1.967 3.046 . 0 0 "[ . 1 . 2]" 1
1631 1 86 ARG HB2 1 87 ALA H . . 4.200 4.374 4.198 4.460 0.260 17 0 "[ . 1 . 2]" 1
1632 1 86 ARG HB2 1 87 ALA HA . . 5.060 4.948 4.793 5.092 0.032 17 0 "[ . 1 . 2]" 1
1633 1 86 ARG HB3 1 86 ARG QD . . 3.360 2.800 2.095 3.215 . 0 0 "[ . 1 . 2]" 1
1634 1 86 ARG HB3 1 87 ALA H . . 4.260 4.173 4.087 4.218 . 0 0 "[ . 1 . 2]" 1
1635 1 86 ARG QD 1 86 ARG HG2 . . 2.770 2.360 2.191 2.573 . 0 0 "[ . 1 . 2]" 1
1636 1 86 ARG HG2 1 87 ALA H . . 4.400 3.526 2.698 4.259 . 0 0 "[ . 1 . 2]" 1
1637 1 86 ARG HG3 1 87 ALA HA . . 4.830 3.247 2.966 3.685 . 0 0 "[ . 1 . 2]" 1
1638 1 87 ALA H 1 87 ALA MB . . 2.910 2.145 2.078 2.188 . 0 0 "[ . 1 . 2]" 1
1639 1 87 ALA H 1 91 VAL QG . . 4.910 3.830 3.706 3.897 . 0 0 "[ . 1 . 2]" 1
1640 1 87 ALA HA 1 88 GLY H . . 3.170 3.042 2.186 3.203 0.033 16 0 "[ . 1 . 2]" 1
1641 1 87 ALA HA 1 91 VAL QG . . 4.510 3.251 2.545 3.575 . 0 0 "[ . 1 . 2]" 1
1642 1 87 ALA MB 1 88 GLY H . . 3.750 2.011 1.819 3.435 . 0 0 "[ . 1 . 2]" 1
1643 1 87 ALA MB 1 88 GLY HA3 . . 4.400 4.117 4.007 4.886 0.486 14 0 "[ . 1 . 2]" 1
1644 1 87 ALA MB 1 91 VAL H . . 4.650 4.677 4.547 4.768 0.118 20 0 "[ . 1 . 2]" 1
1645 1 87 ALA MB 1 91 VAL HA . . 3.920 3.288 2.888 3.929 0.009 20 0 "[ . 1 . 2]" 1
1646 1 87 ALA MB 1 91 VAL HB . . 3.870 3.576 3.168 3.784 . 0 0 "[ . 1 . 2]" 1
1647 1 87 ALA MB 1 91 VAL QG . . 2.890 1.575 1.534 1.668 . 0 0 "[ . 1 . 2]" 1
1648 1 87 ALA MB 1 92 THR H . . 5.360 4.539 4.089 4.990 . 0 0 "[ . 1 . 2]" 1
1649 1 88 GLY H 1 89 GLN H . . 4.780 4.094 3.839 4.392 . 0 0 "[ . 1 . 2]" 1
1650 1 88 GLY H 1 91 VAL QG . . 4.400 1.906 1.735 2.913 . 0 0 "[ . 1 . 2]" 1
1651 1 88 GLY HA2 1 91 VAL QG . . 5.060 3.877 3.724 4.108 . 0 0 "[ . 1 . 2]" 1
1652 1 88 GLY HA3 1 89 GLN H . . 3.160 2.266 2.201 2.415 . 0 0 "[ . 1 . 2]" 1
1653 1 89 GLN H 1 89 GLN QB . . 3.640 2.149 2.026 2.497 . 0 0 "[ . 1 . 2]" 1
1654 1 89 GLN H 1 89 GLN HG2 . . 4.400 3.702 2.684 4.361 . 0 0 "[ . 1 . 2]" 1
1655 1 89 GLN H 1 89 GLN HG3 . . 4.260 3.345 2.149 4.388 0.128 17 0 "[ . 1 . 2]" 1
1656 1 89 GLN H 1 90 SER H . . 3.480 2.635 2.352 2.863 . 0 0 "[ . 1 . 2]" 1
1657 1 89 GLN HA 1 91 VAL QG . . 4.650 3.855 3.720 4.031 . 0 0 "[ . 1 . 2]" 1
1658 1 89 GLN QB 1 90 SER H . . 3.900 2.599 2.488 3.499 . 0 0 "[ . 1 . 2]" 1
1659 1 89 GLN HG2 1 90 SER H . . 5.000 4.657 3.159 5.056 0.056 16 0 "[ . 1 . 2]" 1
1660 1 89 GLN HG3 1 90 SER H . . 5.080 4.615 1.912 4.993 . 0 0 "[ . 1 . 2]" 1
1661 1 90 SER H 1 90 SER QB . . 3.530 2.982 2.939 3.050 . 0 0 "[ . 1 . 2]" 1
1662 1 90 SER H 1 91 VAL H . . 4.650 4.164 4.085 4.293 . 0 0 "[ . 1 . 2]" 1
1663 1 90 SER H 1 91 VAL QG . . 4.510 3.697 3.573 3.840 . 0 0 "[ . 1 . 2]" 1
1664 1 90 SER HA 1 91 VAL H . . 2.990 2.262 2.221 2.292 . 0 0 "[ . 1 . 2]" 1
1665 1 90 SER HA 1 91 VAL HB . . 4.830 4.860 4.804 4.951 0.121 14 0 "[ . 1 . 2]" 1
1666 1 90 SER HA 1 91 VAL QG . . 3.920 3.644 3.414 3.778 . 0 0 "[ . 1 . 2]" 1
1667 1 90 SER QB 1 91 VAL H . . 4.220 3.686 3.535 3.756 . 0 0 "[ . 1 . 2]" 1
1668 1 91 VAL H 1 91 VAL HB . . 3.490 2.635 2.532 2.755 . 0 0 "[ . 1 . 2]" 1
1669 1 91 VAL H 1 91 VAL QG . . 3.380 2.425 2.044 2.563 . 0 0 "[ . 1 . 2]" 1
1670 1 91 VAL HA 1 91 VAL QG . . 3.060 2.097 2.052 2.183 . 0 0 "[ . 1 . 2]" 1
1671 1 91 VAL HA 1 92 THR H . . 3.000 2.220 2.183 2.263 . 0 0 "[ . 1 . 2]" 1
1672 1 91 VAL HB 1 92 THR H . . 4.960 4.082 3.914 4.256 . 0 0 "[ . 1 . 2]" 1
1673 1 91 VAL HB 1 93 ILE MD . . 4.220 2.133 1.990 2.391 . 0 0 "[ . 1 . 2]" 1
1674 1 91 VAL QG 1 92 THR H . . 3.470 2.594 2.376 2.910 . 0 0 "[ . 1 . 2]" 1
1675 1 91 VAL QG 1 93 ILE HG13 . . 3.150 2.707 2.366 3.061 . 0 0 "[ . 1 . 2]" 1
1676 1 92 THR H 1 92 THR HB . . 3.490 2.485 2.229 2.654 . 0 0 "[ . 1 . 2]" 1
1677 1 92 THR H 1 92 THR MG . . 4.300 3.762 3.672 3.802 . 0 0 "[ . 1 . 2]" 1
1678 1 92 THR H 1 93 ILE MD . . 4.970 3.837 3.618 4.026 . 0 0 "[ . 1 . 2]" 1
1679 1 92 THR H 1 93 ILE HG13 . . 5.420 4.823 4.504 5.183 . 0 0 "[ . 1 . 2]" 1
1680 1 92 THR HA 1 92 THR MG . . 3.110 2.290 2.137 2.487 . 0 0 "[ . 1 . 2]" 1
1681 1 92 THR HA 1 93 ILE H . . 3.220 2.193 2.187 2.199 . 0 0 "[ . 1 . 2]" 1
1682 1 92 THR HA 1 93 ILE HB . . 4.650 4.516 4.404 4.637 . 0 0 "[ . 1 . 2]" 1
1683 1 92 THR MG 1 93 ILE H . . 3.510 3.349 3.273 3.443 . 0 0 "[ . 1 . 2]" 1
1684 1 93 ILE H 1 93 ILE HB . . 3.690 2.350 2.260 2.462 . 0 0 "[ . 1 . 2]" 1
1685 1 93 ILE H 1 93 ILE MD . . 4.310 2.049 1.899 2.557 . 0 0 "[ . 1 . 2]" 1
1686 1 93 ILE H 1 93 ILE HG12 . . 4.510 4.190 4.017 4.378 . 0 0 "[ . 1 . 2]" 1
1687 1 93 ILE H 1 93 ILE HG13 . . 4.140 3.438 3.251 3.642 . 0 0 "[ . 1 . 2]" 1
1688 1 93 ILE H 1 93 ILE MG . . 4.400 3.697 3.604 3.767 . 0 0 "[ . 1 . 2]" 1
1689 1 93 ILE H 1 94 VAL H . . 4.920 4.351 4.252 4.465 . 0 0 "[ . 1 . 2]" 1
1690 1 93 ILE HA 1 94 VAL HA . . 4.650 4.376 4.366 4.391 . 0 0 "[ . 1 . 2]" 1
1691 1 93 ILE HB 1 93 ILE MD . . 3.210 2.134 2.054 2.190 . 0 0 "[ . 1 . 2]" 1
1692 1 93 ILE HB 1 94 VAL H . . 4.790 4.497 4.362 4.544 . 0 0 "[ . 1 . 2]" 1
1693 1 93 ILE MD 1 94 VAL H . . 5.060 5.033 4.916 5.071 0.011 3 0 "[ . 1 . 2]" 1
1694 1 93 ILE HG12 1 93 ILE MG . . 2.820 2.044 2.008 2.165 . 0 0 "[ . 1 . 2]" 1
1695 1 93 ILE HG12 1 94 VAL H . . 5.500 5.317 4.996 5.488 . 0 0 "[ . 1 . 2]" 1
1696 1 93 ILE HG13 1 94 VAL H . . 5.000 4.358 4.131 4.510 . 0 0 "[ . 1 . 2]" 1
1697 1 93 ILE MG 1 94 VAL H . . 3.300 2.929 2.619 3.159 . 0 0 "[ . 1 . 2]" 1
1698 1 93 ILE MG 1 94 VAL HA . . 4.300 3.928 3.748 4.090 . 0 0 "[ . 1 . 2]" 1
1699 1 93 ILE MG 1 95 ALA HA . . 4.510 4.350 4.156 4.549 0.039 13 0 "[ . 1 . 2]" 1
1700 1 94 VAL H 1 94 VAL HB . . 3.720 2.488 2.362 2.619 . 0 0 "[ . 1 . 2]" 1
1701 1 94 VAL H 1 94 VAL MG1 . . 4.400 3.773 3.720 3.809 . 0 0 "[ . 1 . 2]" 1
1702 1 94 VAL H 1 94 VAL MG2 . . 3.660 2.512 2.287 2.681 . 0 0 "[ . 1 . 2]" 1
1703 1 94 VAL H 1 95 ALA H . . 4.870 4.194 4.131 4.248 . 0 0 "[ . 1 . 2]" 1
1704 1 94 VAL HA 1 94 VAL MG1 . . 2.960 2.352 2.194 2.490 . 0 0 "[ . 1 . 2]" 1
1705 1 94 VAL HA 1 94 VAL MG2 . . 3.120 2.384 2.258 2.475 . 0 0 "[ . 1 . 2]" 1
1706 1 94 VAL HA 1 95 ALA H . . 3.030 2.219 2.216 2.224 . 0 0 "[ . 1 . 2]" 1
1707 1 94 VAL HA 1 95 ALA HA . . 5.060 4.370 4.361 4.377 . 0 0 "[ . 1 . 2]" 1
1708 1 94 VAL HA 1 95 ALA MB . . 4.140 4.050 4.012 4.094 . 0 0 "[ . 1 . 2]" 1
1709 1 94 VAL HB 1 95 ALA H . . 5.140 4.482 4.415 4.530 . 0 0 "[ . 1 . 2]" 1
1710 1 94 VAL MG1 1 95 ALA H . . 3.400 3.238 3.156 3.355 . 0 0 "[ . 1 . 2]" 1
1711 1 94 VAL MG1 1 95 ALA HA . . 4.650 3.874 3.667 4.090 . 0 0 "[ . 1 . 2]" 1
1712 1 95 ALA H 1 95 ALA MB . . 3.130 2.468 2.369 2.561 . 0 0 "[ . 1 . 2]" 1
1713 1 95 ALA HA 1 96 GLN H . . 3.180 2.395 2.270 2.493 . 0 0 "[ . 1 . 2]" 1
1714 1 95 ALA HA 1 96 GLN HA . . 5.060 4.362 4.294 4.407 . 0 0 "[ . 1 . 2]" 1
1715 1 95 ALA HA 1 96 GLN HB3 . . 4.830 4.398 4.116 5.709 0.879 13 2 "[ . 1 +-. 2]" 1
1716 1 95 ALA MB 1 96 GLN H . . 3.800 2.713 2.466 3.001 . 0 0 "[ . 1 . 2]" 1
1717 1 95 ALA MB 1 96 GLN HA . . 4.830 4.051 3.911 4.270 . 0 0 "[ . 1 . 2]" 1
1718 1 96 GLN H 1 96 GLN HG2 . . 4.820 2.442 1.993 4.032 . 0 0 "[ . 1 . 2]" 1
1719 1 96 GLN HA 1 96 GLN HG2 . . 3.720 3.658 2.472 3.818 0.098 12 0 "[ . 1 . 2]" 1
1720 1 96 GLN HA 1 97 TYR H . . 3.200 2.229 2.203 2.416 . 0 0 "[ . 1 . 2]" 1
1721 1 96 GLN HA 1 97 TYR HB2 . . 4.650 4.112 4.053 4.172 . 0 0 "[ . 1 . 2]" 1
1722 1 96 GLN HA 1 97 TYR HB3 . . 5.060 4.882 4.749 5.047 . 0 0 "[ . 1 . 2]" 1
1723 1 96 GLN HB2 1 97 TYR H . . 5.060 3.509 3.266 4.394 . 0 0 "[ . 1 . 2]" 1
1724 1 96 GLN HB3 1 97 TYR H . . 5.270 4.268 2.654 4.551 . 0 0 "[ . 1 . 2]" 1
1725 1 96 GLN HG3 1 97 TYR H . . 4.710 4.239 3.823 5.673 0.963 14 1 "[ . 1 +. 2]" 1
1726 1 97 TYR H 1 97 TYR HB2 . . 3.980 1.985 1.883 2.474 . 0 0 "[ . 1 . 2]" 1
1727 1 97 TYR H 1 97 TYR HB3 . . 3.950 2.755 2.456 2.951 . 0 0 "[ . 1 . 2]" 1
1728 1 97 TYR H 1 97 TYR QD . . 5.000 3.934 3.695 4.132 . 0 0 "[ . 1 . 2]" 1
1729 1 97 TYR H 1 98 ARG H . . 5.500 4.313 3.787 4.674 . 0 0 "[ . 1 . 2]" 1
1730 1 97 TYR HA 1 97 TYR QD . . 3.320 2.449 2.145 3.062 . 0 0 "[ . 1 . 2]" 1
1731 1 97 TYR HA 1 97 TYR QE . . 4.400 4.439 4.377 4.652 0.252 6 0 "[ . 1 . 2]" 1
1732 1 97 TYR HA 1 98 ARG H . . 3.330 2.292 2.237 2.439 . 0 0 "[ . 1 . 2]" 1
1733 1 97 TYR HB2 1 98 ARG H . . 5.060 4.648 4.192 4.732 . 0 0 "[ . 1 . 2]" 1
1734 1 97 TYR HB3 1 98 ARG H . . 5.210 4.249 3.512 4.457 . 0 0 "[ . 1 . 2]" 1
1735 1 97 TYR QD 1 98 ARG H . . 4.170 3.013 1.854 4.189 0.019 6 0 "[ . 1 . 2]" 1
1736 1 97 TYR QD 1 98 ARG HA . . 4.830 3.722 3.233 4.116 . 0 0 "[ . 1 . 2]" 1
1737 1 97 TYR QD 1 99 PRO HD2 . . 4.300 3.817 3.560 4.163 . 0 0 "[ . 1 . 2]" 1
1738 1 97 TYR QD 1 99 PRO HD3 . . 4.220 2.114 1.914 2.440 . 0 0 "[ . 1 . 2]" 1
1739 1 97 TYR QD 1 99 PRO HG2 . . 4.830 4.510 4.048 4.826 . 0 0 "[ . 1 . 2]" 1
1740 1 97 TYR QD 1 99 PRO HG3 . . 4.830 3.192 2.569 3.471 . 0 0 "[ . 1 . 2]" 1
1741 1 97 TYR QE 1 98 ARG H . . 5.060 4.972 3.811 5.592 0.532 6 1 "[ .+ 1 . 2]" 1
1742 1 97 TYR QE 1 99 PRO HA . . 4.830 4.715 4.410 4.863 0.033 16 0 "[ . 1 . 2]" 1
1743 1 97 TYR QE 1 99 PRO HB2 . . 4.650 4.571 4.382 4.681 0.031 17 0 "[ . 1 . 2]" 1
1744 1 97 TYR QE 1 99 PRO HB3 . . 4.400 3.120 2.832 3.434 . 0 0 "[ . 1 . 2]" 1
1745 1 97 TYR QE 1 99 PRO HD2 . . 4.830 4.874 4.285 5.174 0.344 6 0 "[ . 1 . 2]" 1
1746 1 97 TYR QE 1 99 PRO HG2 . . 4.650 4.326 3.793 4.457 . 0 0 "[ . 1 . 2]" 1
1747 1 97 TYR QE 1 99 PRO HG3 . . 4.020 2.619 2.073 2.770 . 0 0 "[ . 1 . 2]" 1
1748 1 98 ARG H 1 98 ARG HG2 . . 4.830 4.425 3.196 4.825 . 0 0 "[ . 1 . 2]" 1
1749 1 98 ARG H 1 98 ARG HG3 . . 4.830 4.573 4.253 4.799 . 0 0 "[ . 1 . 2]" 1
1750 1 98 ARG H 1 99 PRO HA . . 5.330 4.418 4.068 4.648 . 0 0 "[ . 1 . 2]" 1
1751 1 98 ARG H 1 99 PRO HD2 . . 4.700 4.394 3.935 4.626 . 0 0 "[ . 1 . 2]" 1
1752 1 98 ARG H 1 99 PRO HD3 . . 5.060 3.296 2.684 3.630 . 0 0 "[ . 1 . 2]" 1
1753 1 98 ARG HA 1 98 ARG HD3 . . 3.660 3.434 2.146 4.506 0.846 19 5 "[ .* * 1 - . *+2]" 1
1754 1 98 ARG HA 1 98 ARG HG3 . . 3.830 2.800 2.086 3.720 . 0 0 "[ . 1 . 2]" 1
1755 1 98 ARG HA 1 99 PRO HD2 . . 3.260 2.240 2.220 2.255 . 0 0 "[ . 1 . 2]" 1
1756 1 98 ARG HA 1 99 PRO HD3 . . 3.720 2.352 2.263 2.403 . 0 0 "[ . 1 . 2]" 1
1757 1 98 ARG HA 1 99 PRO HG2 . . 4.650 4.453 4.418 4.474 . 0 0 "[ . 1 . 2]" 1
1758 1 98 ARG HA 1 99 PRO HG3 . . 5.420 4.508 4.437 4.549 . 0 0 "[ . 1 . 2]" 1
1759 1 98 ARG HA 1 100 GLU H . . 5.140 3.399 3.229 3.961 . 0 0 "[ . 1 . 2]" 1
1760 1 98 ARG HB2 1 98 ARG HD2 . . 3.970 3.161 1.980 3.758 . 0 0 "[ . 1 . 2]" 1
1761 1 98 ARG HB2 1 101 GLU H . . 4.830 4.736 4.010 4.985 0.155 9 0 "[ . 1 . 2]" 1
1762 1 98 ARG HB2 1 101 GLU HB2 . . 5.500 4.077 3.274 4.387 . 0 0 "[ . 1 . 2]" 1
1763 1 98 ARG HB3 1 98 ARG HD2 . . 3.760 3.205 2.127 4.184 0.424 4 0 "[ . 1 . 2]" 1
1764 1 98 ARG HB3 1 98 ARG HE . . 5.500 4.019 2.378 4.843 . 0 0 "[ . 1 . 2]" 1
1765 1 98 ARG HB3 1 101 GLU H . . 4.650 3.352 2.662 3.875 . 0 0 "[ . 1 . 2]" 1
1766 1 98 ARG HB3 1 101 GLU HB2 . . 4.080 2.666 1.986 2.991 . 0 0 "[ . 1 . 2]" 1
1767 1 98 ARG HB3 1 101 GLU HG3 . . 4.220 3.640 2.478 4.211 . 0 0 "[ . 1 . 2]" 1
1768 1 98 ARG HD2 1 101 GLU HB2 . . 5.420 4.319 2.668 5.297 . 0 0 "[ . 1 . 2]" 1
1769 1 99 PRO HA 1 101 GLU HB2 . . 5.420 5.152 4.779 5.413 . 0 0 "[ . 1 . 2]" 1
1770 1 99 PRO HA 1 102 TYR H . . 4.220 3.459 2.774 3.955 . 0 0 "[ . 1 . 2]" 1
1771 1 99 PRO HA 1 102 TYR HB2 . . 3.760 3.423 2.953 3.782 0.022 11 0 "[ . 1 . 2]" 1
1772 1 99 PRO HA 1 102 TYR HB3 . . 3.430 2.424 2.090 2.736 . 0 0 "[ . 1 . 2]" 1
1773 1 99 PRO HA 1 102 TYR QD . . 4.300 3.564 3.109 4.037 . 0 0 "[ . 1 . 2]" 1
1774 1 99 PRO HA 1 103 SER H . . 4.650 3.848 3.393 4.263 . 0 0 "[ . 1 . 2]" 1
1775 1 99 PRO HB2 1 102 TYR HB3 . . 5.420 4.640 4.314 5.224 . 0 0 "[ . 1 . 2]" 1
1776 1 99 PRO HD2 1 100 GLU H . . 4.460 2.314 2.253 2.389 . 0 0 "[ . 1 . 2]" 1
1777 1 99 PRO HD2 1 101 GLU H . . 5.500 4.550 4.154 4.813 . 0 0 "[ . 1 . 2]" 1
1778 1 99 PRO HD3 1 100 GLU H . . 4.890 3.675 3.656 3.755 . 0 0 "[ . 1 . 2]" 1
1779 1 99 PRO HG2 1 100 GLU H . . 3.930 3.093 2.498 3.388 . 0 0 "[ . 1 . 2]" 1
1780 1 99 PRO HG3 1 100 GLU H . . 4.450 4.246 3.869 4.437 . 0 0 "[ . 1 . 2]" 1
1781 1 100 GLU H 1 100 GLU HB2 . . 3.500 2.272 2.033 2.607 . 0 0 "[ . 1 . 2]" 1
1782 1 100 GLU H 1 100 GLU HG2 . . 4.220 3.882 2.331 4.533 0.313 7 0 "[ . 1 . 2]" 1
1783 1 100 GLU H 1 101 GLU H . . 3.630 2.766 2.470 3.080 . 0 0 "[ . 1 . 2]" 1
1784 1 100 GLU H 1 102 TYR H . . 5.240 4.562 4.291 4.917 . 0 0 "[ . 1 . 2]" 1
1785 1 100 GLU H 1 103 SER H . . 5.500 4.766 4.558 4.929 . 0 0 "[ . 1 . 2]" 1
1786 1 100 GLU HA 1 100 GLU HB2 . . 2.970 2.807 2.574 3.051 0.081 5 0 "[ . 1 . 2]" 1
1787 1 100 GLU HA 1 100 GLU HG2 . . 3.380 2.676 2.251 2.938 . 0 0 "[ . 1 . 2]" 1
1788 1 100 GLU HA 1 103 SER H . . 4.600 3.880 3.587 4.132 . 0 0 "[ . 1 . 2]" 1
1789 1 100 GLU HA 1 103 SER HB3 . . 3.490 3.759 3.299 4.303 0.813 7 4 "[ . + 1 * -. *2]" 1
1790 1 100 GLU HB3 1 100 GLU HG2 . . 2.990 2.579 2.300 3.027 0.037 3 0 "[ . 1 . 2]" 1
1791 1 100 GLU HB3 1 101 GLU H . . 4.070 3.091 2.299 4.003 . 0 0 "[ . 1 . 2]" 1
1792 1 100 GLU HB3 1 101 GLU HA . . 4.830 4.150 3.718 4.592 . 0 0 "[ . 1 . 2]" 1
1793 1 100 GLU HB3 1 101 GLU HG2 . . 4.400 3.888 3.289 4.372 . 0 0 "[ . 1 . 2]" 1
1794 1 100 GLU HG2 1 101 GLU H . . 4.510 4.611 4.412 5.277 0.767 13 1 "[ . 1 + . 2]" 1
1795 1 101 GLU H 1 101 GLU HB2 . . 3.400 2.208 2.070 2.376 . 0 0 "[ . 1 . 2]" 1
1796 1 101 GLU H 1 101 GLU HG2 . . 3.660 3.038 2.721 3.433 . 0 0 "[ . 1 . 2]" 1
1797 1 101 GLU H 1 102 TYR H . . 3.650 2.706 2.252 3.139 . 0 0 "[ . 1 . 2]" 1
1798 1 101 GLU H 1 102 TYR HB2 . . 5.480 4.772 4.475 5.143 . 0 0 "[ . 1 . 2]" 1
1799 1 101 GLU H 1 102 TYR HB3 . . 5.400 4.480 4.177 4.964 . 0 0 "[ . 1 . 2]" 1
1800 1 101 GLU HA 1 101 GLU HG2 . . 2.920 2.286 2.051 2.482 . 0 0 "[ . 1 . 2]" 1
1801 1 101 GLU HA 1 104 ARG H . . 5.060 3.848 3.614 4.327 . 0 0 "[ . 1 . 2]" 1
1802 1 101 GLU HA 1 104 ARG QB . . 5.420 4.276 3.556 5.222 . 0 0 "[ . 1 . 2]" 1
1803 1 101 GLU HA 1 104 ARG QD . . 4.830 3.359 2.668 4.676 . 0 0 "[ . 1 . 2]" 1
1804 1 101 GLU HB2 1 102 TYR H . . 4.150 2.503 2.271 2.827 . 0 0 "[ . 1 . 2]" 1
1805 1 101 GLU HB2 1 103 SER H . . 5.500 4.766 4.547 4.973 . 0 0 "[ . 1 . 2]" 1
1806 1 101 GLU HG2 1 102 TYR H . . 4.830 4.682 4.561 4.793 . 0 0 "[ . 1 . 2]" 1
1807 1 102 TYR H 1 102 TYR HB2 . . 3.880 2.263 2.068 2.404 . 0 0 "[ . 1 . 2]" 1
1808 1 102 TYR H 1 102 TYR HB3 . . 3.910 2.457 2.282 2.745 . 0 0 "[ . 1 . 2]" 1
1809 1 102 TYR H 1 102 TYR QD . . 4.800 4.043 3.884 4.090 . 0 0 "[ . 1 . 2]" 1
1810 1 102 TYR H 1 103 SER H . . 3.730 2.889 2.544 3.007 . 0 0 "[ . 1 . 2]" 1
1811 1 102 TYR H 1 104 ARG H . . 5.350 4.524 4.233 4.924 . 0 0 "[ . 1 . 2]" 1
1812 1 102 TYR HA 1 102 TYR QD . . 3.350 2.527 2.165 2.921 . 0 0 "[ . 1 . 2]" 1
1813 1 102 TYR HA 1 102 TYR QE . . 4.830 4.653 4.407 4.836 0.006 13 0 "[ . 1 . 2]" 1
1814 1 102 TYR HA 1 104 ARG H . . 4.080 3.798 3.513 4.099 0.019 20 0 "[ . 1 . 2]" 1
1815 1 102 TYR HA 1 105 PHE H . . 4.740 3.232 3.045 3.408 . 0 0 "[ . 1 . 2]" 1
1816 1 102 TYR HA 1 105 PHE QB . . 4.650 3.137 2.845 3.237 . 0 0 "[ . 1 . 2]" 1
1817 1 102 TYR HA 1 105 PHE QD . . 3.560 2.198 1.982 2.689 . 0 0 "[ . 1 . 2]" 1
1818 1 102 TYR HA 1 105 PHE QE . . 5.060 3.874 3.374 4.485 . 0 0 "[ . 1 . 2]" 1
1819 1 102 TYR HA 1 106 GLU H . . 4.830 4.435 4.015 4.717 . 0 0 "[ . 1 . 2]" 1
1820 1 102 TYR HB2 1 103 SER H . . 4.640 3.969 3.718 4.168 . 0 0 "[ . 1 . 2]" 1
1821 1 102 TYR HB3 1 103 SER H . . 4.360 2.762 2.593 3.073 . 0 0 "[ . 1 . 2]" 1
1822 1 102 TYR HB3 1 106 GLU H . . 5.420 5.134 4.594 5.469 0.049 8 0 "[ . 1 . 2]" 1
1823 1 102 TYR QD 1 103 SER H . . 5.020 3.983 3.402 4.322 . 0 0 "[ . 1 . 2]" 1
1824 1 102 TYR QD 1 103 SER HA . . 4.510 3.861 3.096 4.397 . 0 0 "[ . 1 . 2]" 1
1825 1 102 TYR QD 1 105 PHE H . . 5.310 4.397 4.053 4.584 . 0 0 "[ . 1 . 2]" 1
1826 1 102 TYR QD 1 105 PHE QB . . 5.060 3.045 2.551 3.628 . 0 0 "[ . 1 . 2]" 1
1827 1 102 TYR QD 1 105 PHE QD . . 4.510 2.668 1.996 3.586 . 0 0 "[ . 1 . 2]" 1
1828 1 102 TYR QD 1 105 PHE QE . . 5.060 4.324 3.690 5.075 0.015 13 0 "[ . 1 . 2]" 1
1829 1 102 TYR QD 1 106 GLU H . . 5.420 4.221 3.867 4.546 . 0 0 "[ . 1 . 2]" 1
1830 1 102 TYR QD 1 106 GLU HG3 . . 5.060 3.500 2.280 5.387 0.327 13 0 "[ . 1 . 2]" 1
1831 1 102 TYR QE 1 105 PHE H . . 5.500 5.367 5.051 5.565 0.065 6 0 "[ . 1 . 2]" 1
1832 1 102 TYR QE 1 105 PHE QB . . 5.060 3.207 2.485 3.845 . 0 0 "[ . 1 . 2]" 1
1833 1 102 TYR QE 1 105 PHE QD . . 5.060 4.078 3.452 4.773 . 0 0 "[ . 1 . 2]" 1
1834 1 102 TYR QE 1 106 GLU HA . . 4.650 4.150 3.321 4.631 . 0 0 "[ . 1 . 2]" 1
1835 1 102 TYR QE 1 106 GLU HB3 . . 5.420 4.904 2.594 5.391 . 0 0 "[ . 1 . 2]" 1
1836 1 102 TYR QE 1 106 GLU HG3 . . 4.400 3.452 2.809 5.372 0.972 13 2 "[ . 1- + . 2]" 1
1837 1 103 SER H 1 103 SER HB3 . . 3.190 2.695 2.356 2.985 . 0 0 "[ . 1 . 2]" 1
1838 1 103 SER H 1 104 ARG H . . 3.840 2.894 2.719 3.065 . 0 0 "[ . 1 . 2]" 1
1839 1 103 SER HA 1 103 SER HB2 . . 2.650 2.552 2.384 2.779 0.129 20 0 "[ . 1 . 2]" 1
1840 1 103 SER HA 1 105 PHE H . . 4.510 4.178 3.658 4.611 0.101 14 0 "[ . 1 . 2]" 1
1841 1 103 SER HA 1 106 GLU H . . 4.140 3.136 3.018 3.384 . 0 0 "[ . 1 . 2]" 1
1842 1 103 SER HA 1 106 GLU HB2 . . 4.020 2.260 1.979 4.087 0.067 13 0 "[ . 1 . 2]" 1
1843 1 103 SER HA 1 106 GLU HB3 . . 4.080 3.446 2.663 3.775 . 0 0 "[ . 1 . 2]" 1
1844 1 103 SER HA 1 106 GLU HG3 . . 4.020 3.322 2.719 3.822 . 0 0 "[ . 1 . 2]" 1
1845 1 103 SER HA 1 107 SER H . . 5.260 4.092 3.708 4.378 . 0 0 "[ . 1 . 2]" 1
1846 1 103 SER HB2 1 105 PHE H . . 5.440 5.699 5.258 6.155 0.715 8 6 "[* . + * - *. *2]" 1
1847 1 103 SER HB2 1 106 GLU H . . 5.410 5.416 5.110 5.687 0.277 7 0 "[ . 1 . 2]" 1
1848 1 103 SER HB2 1 106 GLU HB2 . . 4.830 4.618 4.044 5.758 0.928 11 2 "[ . 1+ - . 2]" 1
1849 1 103 SER HB3 1 104 ARG H . . 3.970 3.121 2.466 4.182 0.212 5 0 "[ . 1 . 2]" 1
1850 1 104 ARG H 1 104 ARG QB . . 3.730 2.393 2.042 2.578 . 0 0 "[ . 1 . 2]" 1
1851 1 104 ARG H 1 104 ARG HG2 . . 3.920 3.035 1.946 4.561 0.641 7 2 "[ . + 1 - . 2]" 1
1852 1 104 ARG H 1 104 ARG HG3 . . 4.140 3.177 1.907 4.468 0.328 16 0 "[ . 1 . 2]" 1
1853 1 104 ARG H 1 105 PHE H . . 3.330 2.771 2.523 3.028 . 0 0 "[ . 1 . 2]" 1
1854 1 104 ARG H 1 105 PHE HA . . 5.500 5.299 5.120 5.488 . 0 0 "[ . 1 . 2]" 1
1855 1 104 ARG H 1 105 PHE QB . . 5.500 4.553 4.288 4.853 . 0 0 "[ . 1 . 2]" 1
1856 1 104 ARG H 1 106 GLU H . . 4.510 4.120 3.802 4.404 . 0 0 "[ . 1 . 2]" 1
1857 1 104 ARG HA 1 104 ARG QD . . 4.400 4.107 3.799 4.336 . 0 0 "[ . 1 . 2]" 1
1858 1 104 ARG HA 1 104 ARG HG2 . . 3.970 3.313 2.488 3.814 . 0 0 "[ . 1 . 2]" 1
1859 1 104 ARG HA 1 104 ARG HG3 . . 4.140 3.262 2.153 4.021 . 0 0 "[ . 1 . 2]" 1
1860 1 104 ARG HA 1 106 GLU H . . 5.060 4.602 3.866 5.026 . 0 0 "[ . 1 . 2]" 1
1861 1 104 ARG QB 1 104 ARG QD . . 3.490 2.062 1.947 2.141 . 0 0 "[ . 1 . 2]" 1
1862 1 104 ARG QB 1 105 PHE H . . 4.300 3.005 2.282 3.663 . 0 0 "[ . 1 . 2]" 1
1863 1 104 ARG QD 1 105 PHE H . . 5.500 4.064 3.692 4.917 . 0 0 "[ . 1 . 2]" 1
1864 1 104 ARG QD 1 105 PHE HZ . . 5.420 5.037 4.096 5.247 . 0 0 "[ . 1 . 2]" 1
1865 1 104 ARG HG2 1 105 PHE H . . 4.780 3.386 1.944 5.026 0.246 19 0 "[ . 1 . 2]" 1
1866 1 104 ARG HG3 1 105 PHE H . . 4.650 3.800 2.362 4.904 0.254 12 0 "[ . 1 . 2]" 1
1867 1 105 PHE H 1 105 PHE QB . . 3.400 2.176 2.031 2.335 . 0 0 "[ . 1 . 2]" 1
1868 1 105 PHE H 1 105 PHE QD . . 3.710 2.891 1.985 3.482 . 0 0 "[ . 1 . 2]" 1
1869 1 105 PHE H 1 106 GLU H . . 3.190 2.469 2.251 2.664 . 0 0 "[ . 1 . 2]" 1
1870 1 105 PHE H 1 106 GLU HA . . 5.170 4.976 4.798 5.140 . 0 0 "[ . 1 . 2]" 1
1871 1 105 PHE H 1 106 GLU HB2 . . 5.390 4.391 4.047 5.721 0.331 13 0 "[ . 1 . 2]" 1
1872 1 105 PHE HA 1 105 PHE QD . . 3.470 2.476 2.033 3.025 . 0 0 "[ . 1 . 2]" 1
1873 1 105 PHE HA 1 105 PHE QE . . 4.640 4.485 4.250 4.742 0.102 10 0 "[ . 1 . 2]" 1
1874 1 105 PHE QB 1 106 GLU H . . 4.470 2.544 2.321 3.010 . 0 0 "[ . 1 . 2]" 1
1875 1 105 PHE QB 1 106 GLU HB2 . . 4.650 4.429 4.136 5.138 0.488 11 0 "[ . 1 . 2]" 1
1876 1 105 PHE QD 1 106 GLU H . . 4.870 4.311 3.934 4.601 . 0 0 "[ . 1 . 2]" 1
1877 1 106 GLU H 1 106 GLU HB2 . . 3.600 2.244 2.038 3.475 . 0 0 "[ . 1 . 2]" 1
1878 1 106 GLU H 1 106 GLU HB3 . . 3.970 3.276 2.179 3.495 . 0 0 "[ . 1 . 2]" 1
1879 1 106 GLU H 1 106 GLU HG2 . . 4.100 3.107 2.848 3.556 . 0 0 "[ . 1 . 2]" 1
1880 1 106 GLU H 1 107 SER H . . 4.190 2.958 2.592 3.140 . 0 0 "[ . 1 . 2]" 1
1881 1 106 GLU HA 1 106 GLU HG2 . . 3.380 2.655 2.192 4.249 0.869 11 2 "[ . 1+ - . 2]" 1
1882 1 106 GLU HB2 1 106 GLU HG3 . . 2.970 2.489 2.288 3.006 0.036 11 0 "[ . 1 . 2]" 1
1883 1 106 GLU HB2 1 107 SER H . . 4.800 2.972 2.672 4.180 . 0 0 "[ . 1 . 2]" 1
1884 1 106 GLU HB3 1 106 GLU HG3 . . 2.780 2.553 2.440 2.748 . 0 0 "[ . 1 . 2]" 1
1885 1 106 GLU HB3 1 107 SER H . . 4.700 2.978 2.586 3.887 . 0 0 "[ . 1 . 2]" 1
1886 1 106 GLU HB3 1 107 SER HA . . 4.650 3.990 3.705 5.548 0.898 13 2 "[ . 1- + . 2]" 1
1887 1 106 GLU HG2 1 107 SER H . . 5.040 4.764 3.685 4.992 . 0 0 "[ . 1 . 2]" 1
1888 1 107 SER H 1 107 SER HB2 . . 4.130 2.098 2.022 2.279 . 0 0 "[ . 1 . 2]" 1
1889 1 108 SER H 1 108 SER HB2 . . 3.850 2.580 2.075 3.243 . 0 0 "[ . 1 . 2]" 1
1890 1 108 SER H 1 109 GLY HA2 . . 5.500 5.244 4.619 6.205 0.705 18 1 "[ . 1 . + 2]" 1
1891 1 108 SER HB3 1 109 GLY H . . 4.260 3.659 2.266 4.147 . 0 0 "[ . 1 . 2]" 1
1892 1 109 GLY H 1 110 PRO HD3 . . 4.850 4.679 4.157 4.818 . 0 0 "[ . 1 . 2]" 1
1893 1 109 GLY HA2 1 110 PRO HB3 . . 5.420 5.135 4.974 5.402 . 0 0 "[ . 1 . 2]" 1
1894 1 109 GLY HA2 1 110 PRO HD3 . . 3.290 2.364 1.944 2.887 . 0 0 "[ . 1 . 2]" 1
1895 1 109 GLY HA3 1 110 PRO HD2 . . 3.270 2.465 2.195 2.965 . 0 0 "[ . 1 . 2]" 1
1896 1 109 GLY HA3 1 110 PRO HG2 . . 5.420 4.682 4.376 5.157 . 0 0 "[ . 1 . 2]" 1
1897 1 110 PRO HD2 1 111 SER H . . 5.500 4.906 2.388 5.445 . 0 0 "[ . 1 . 2]" 1
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