NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
633241 |
6c2v   |
30395 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6c2v
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 2151
_Distance_constraint_stats_list.Viol_count 6798
_Distance_constraint_stats_list.Viol_total 8060.453
_Distance_constraint_stats_list.Viol_max 1.452
_Distance_constraint_stats_list.Viol_rms 0.0482
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0094
_Distance_constraint_stats_list.Viol_average_violations_only 0.0593
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.184 0.024 3 0 "[ . 1 . 2]"
1 2 ARG 3.761 0.174 12 0 "[ . 1 . 2]"
1 3 VAL 48.059 1.187 7 20 [******+**-**********]
1 4 ILE 8.280 0.133 19 0 "[ . 1 . 2]"
1 5 VAL 9.751 0.639 19 1 "[ . 1 . +2]"
1 6 VAL 8.039 0.374 7 0 "[ . 1 . 2]"
1 7 ILE 12.994 0.345 19 0 "[ . 1 . 2]"
1 8 VAL 0.641 0.055 4 0 "[ . 1 . 2]"
1 9 GLY 1.151 0.128 4 0 "[ . 1 . 2]"
1 10 PRO 0.465 0.051 19 0 "[ . 1 . 2]"
1 11 SER 0.423 0.131 8 0 "[ . 1 . 2]"
1 12 GLY 0.384 0.131 8 0 "[ . 1 . 2]"
1 13 ALA 0.252 0.079 13 0 "[ . 1 . 2]"
1 14 GLY 0.357 0.076 16 0 "[ . 1 . 2]"
1 15 LYS 0.385 0.076 16 0 "[ . 1 . 2]"
1 16 THR 0.204 0.025 10 0 "[ . 1 . 2]"
1 17 THR 1.834 0.143 10 0 "[ . 1 . 2]"
1 18 LEU 1.152 0.047 13 0 "[ . 1 . 2]"
1 19 ASP 7.320 0.216 17 0 "[ . 1 . 2]"
1 20 GLU 3.952 0.099 11 0 "[ . 1 . 2]"
1 21 LEU 6.945 0.216 17 0 "[ . 1 . 2]"
1 22 ALA 2.006 0.059 1 0 "[ . 1 . 2]"
1 23 ARG 1.432 0.106 14 0 "[ . 1 . 2]"
1 24 LYS 0.040 0.040 12 0 "[ . 1 . 2]"
1 25 ALA 2.013 0.122 11 0 "[ . 1 . 2]"
1 26 LYS 13.641 0.374 9 0 "[ . 1 . 2]"
1 27 GLU 1.650 0.222 14 0 "[ . 1 . 2]"
1 28 GLU 6.422 0.338 14 0 "[ . 1 . 2]"
1 29 VAL 41.484 0.471 8 0 "[ . 1 . 2]"
1 30 PRO 9.625 0.178 2 0 "[ . 1 . 2]"
1 31 ASP 37.515 1.062 8 20 [*******+*******-****]
1 32 ALA 35.453 1.187 7 20 [******+**-**********]
1 33 GLU 4.503 0.092 20 0 "[ . 1 . 2]"
1 34 ILE 11.631 0.086 1 0 "[ . 1 . 2]"
1 35 ARG 13.280 0.158 1 0 "[ . 1 . 2]"
1 36 THR 4.608 0.057 1 0 "[ . 1 . 2]"
1 37 VAL 27.687 0.421 11 0 "[ . 1 . 2]"
1 38 THR 3.833 0.315 15 0 "[ . 1 . 2]"
1 39 THR 8.283 0.422 17 0 "[ . 1 . 2]"
1 40 LYS 3.064 0.072 7 0 "[ . 1 . 2]"
1 41 GLU 15.613 0.421 11 0 "[ . 1 . 2]"
1 42 ASP 24.275 0.407 13 0 "[ . 1 . 2]"
1 43 ALA 8.254 0.581 3 3 "[ + .- 1 * . 2]"
1 44 LYS 4.527 0.234 13 0 "[ . 1 . 2]"
1 45 ARG 3.521 0.422 13 0 "[ . 1 . 2]"
1 46 VAL 13.746 0.581 3 3 "[ + .- 1 * . 2]"
1 47 ALA 4.914 0.143 14 0 "[ . 1 . 2]"
1 48 GLU 6.556 0.167 13 0 "[ . 1 . 2]"
1 49 GLU 7.999 0.162 7 0 "[ . 1 . 2]"
1 50 ALA 7.883 0.162 7 0 "[ . 1 . 2]"
1 51 GLU 6.390 0.127 15 0 "[ . 1 . 2]"
1 52 ARG 7.113 0.127 15 0 "[ . 1 . 2]"
1 53 ARG 7.125 0.131 17 0 "[ . 1 . 2]"
1 54 ASN 12.775 0.131 17 0 "[ . 1 . 2]"
1 55 ALA 4.855 0.087 4 0 "[ . 1 . 2]"
1 56 ASP 4.051 0.174 12 0 "[ . 1 . 2]"
1 57 ILE 3.889 0.059 1 0 "[ . 1 . 2]"
1 58 VAL 7.293 0.241 4 0 "[ . 1 . 2]"
1 59 VAL 13.001 0.639 19 1 "[ . 1 . +2]"
1 60 ILE 8.907 0.160 7 0 "[ . 1 . 2]"
1 61 VAL 8.146 0.374 7 0 "[ . 1 . 2]"
1 62 GLY 0.864 0.052 4 0 "[ . 1 . 2]"
1 63 PRO 2.915 0.098 3 0 "[ . 1 . 2]"
1 64 SER 1.830 0.098 3 0 "[ . 1 . 2]"
1 66 SER 0.210 0.042 13 0 "[ . 1 . 2]"
1 67 GLY 0.957 0.169 11 0 "[ . 1 . 2]"
1 68 LYS 3.233 0.169 11 0 "[ . 1 . 2]"
1 69 SER 2.156 0.109 3 0 "[ . 1 . 2]"
1 70 THR 3.493 0.075 18 0 "[ . 1 . 2]"
1 71 LEU 20.339 0.591 8 4 "[ **- + 1 . 2]"
1 72 ALA 2.121 0.060 4 0 "[ . 1 . 2]"
1 73 LYS 3.247 0.148 14 0 "[ . 1 . 2]"
1 74 ILE 9.682 0.591 8 4 "[ **- + 1 . 2]"
1 75 VAL 3.126 0.065 7 0 "[ . 1 . 2]"
1 76 LYS 1.113 0.071 11 0 "[ . 1 . 2]"
1 77 LYS 2.800 0.220 1 0 "[ . 1 . 2]"
1 78 ILE 8.608 0.073 7 0 "[ . 1 . 2]"
1 79 ILE 10.237 0.126 6 0 "[ . 1 . 2]"
1 80 ALA 3.705 0.121 20 0 "[ . 1 . 2]"
1 81 ARG 4.713 0.103 8 0 "[ . 1 . 2]"
1 82 ALA 3.627 0.094 7 0 "[ . 1 . 2]"
1 83 GLY 3.641 0.083 4 0 "[ . 1 . 2]"
1 84 ALA 3.339 0.074 20 0 "[ . 1 . 2]"
1 85 LYS 8.319 0.241 4 0 "[ . 1 . 2]"
1 86 THR 9.840 0.135 15 0 "[ . 1 . 2]"
1 87 ILE 9.934 0.121 1 0 "[ . 1 . 2]"
1 88 GLU 6.962 0.289 3 0 "[ . 1 . 2]"
1 89 VAL 17.143 0.853 15 9 "[* *.* *1 *+* *-]"
1 90 THR 2.895 0.205 8 0 "[ . 1 . 2]"
1 91 THR 8.074 0.853 15 9 "[* *.* *1 *+* *-]"
1 95 LEU 14.289 1.452 13 4 "[ *. * 1 + * 2]"
1 96 ARG 0.630 0.288 7 0 "[ . 1 . 2]"
1 98 ALA 5.524 0.325 13 0 "[ . 1 . 2]"
1 99 VAL 13.237 1.452 13 4 "[ *. * 1 +-. 2]"
1 100 ALA 2.046 0.642 14 1 "[ . 1 +. 2]"
1 101 LYS 1.769 0.082 10 0 "[ . 1 . 2]"
1 102 ALA 3.624 0.080 10 0 "[ . 1 . 2]"
1 103 ARG 1.290 0.433 2 0 "[ . 1 . 2]"
1 104 GLY 6.824 0.579 5 1 "[ + 1 . 2]"
1 105 SER 3.149 0.381 4 0 "[ . 1 . 2]"
1 106 TRP 5.645 0.100 19 0 "[ . 1 . 2]"
1 107 SER 8.394 1.027 2 2 "[ + . -1 . 2]"
1 108 LEU 17.236 1.027 2 3 "[ + - *1 . 2]"
1 109 GLU 4.891 0.112 13 0 "[ . 1 . 2]"
1 110 HIS 0.620 0.043 18 0 "[ . 1 . 2]"
1 111 HIS 1.874 0.112 13 0 "[ . 1 . 2]"
1 112 HIS 0.399 0.099 13 0 "[ . 1 . 2]"
1 114 HIS 0.028 0.017 5 0 "[ . 1 . 2]"
1 115 HIS 0.028 0.017 5 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ARG HB2 1 3 VAL H . . 4.410 4.110 4.004 4.327 . 0 0 "[ . 1 . 2]" 1
2 1 2 ARG HB3 1 3 VAL H . . 4.260 3.882 3.790 4.132 . 0 0 "[ . 1 . 2]" 1
3 1 2 ARG HB2 1 56 ASP H . . 3.960 3.489 3.433 3.540 . 0 0 "[ . 1 . 2]" 1
4 1 2 ARG HB3 1 2 ARG HD3 . . 4.080 3.905 3.808 4.032 . 0 0 "[ . 1 . 2]" 1
5 1 2 ARG HB3 1 2 ARG HD2 . . 4.080 2.781 2.628 3.006 . 0 0 "[ . 1 . 2]" 1
6 1 2 ARG HA 1 2 ARG HG2 . . 3.820 3.072 2.942 3.246 . 0 0 "[ . 1 . 2]" 1
7 1 1 MET HG3 1 57 ILE MD . . 3.710 2.783 2.473 3.525 . 0 0 "[ . 1 . 2]" 1
8 1 2 ARG HB3 1 55 ALA MB . . 4.130 3.769 3.730 3.821 . 0 0 "[ . 1 . 2]" 1
9 1 2 ARG HA 1 55 ALA MB . . 5.500 5.532 5.512 5.565 0.065 10 0 "[ . 1 . 2]" 1
10 1 2 ARG HA 1 32 ALA MB . . 5.370 5.204 5.031 5.342 . 0 0 "[ . 1 . 2]" 1
11 1 3 VAL H 1 3 VAL HB . . 3.560 2.567 2.472 2.625 . 0 0 "[ . 1 . 2]" 1
12 1 3 VAL HB 1 32 ALA H . . 5.110 4.326 4.183 4.481 . 0 0 "[ . 1 . 2]" 1
13 1 3 VAL HB 1 33 GLU H . . 5.410 4.580 4.467 4.717 . 0 0 "[ . 1 . 2]" 1
14 1 57 ILE H 1 58 VAL MG1 . . 4.530 4.244 4.143 4.310 . 0 0 "[ . 1 . 2]" 1
15 1 58 VAL MG1 1 79 ILE HG13 . . 2.750 2.255 2.204 2.320 . 0 0 "[ . 1 . 2]" 1
16 1 58 VAL MG2 1 84 ALA MB . . 2.760 2.567 2.511 2.626 . 0 0 "[ . 1 . 2]" 1
17 1 55 ALA MB 1 58 VAL MG1 . . 2.820 2.022 1.982 2.056 . 0 0 "[ . 1 . 2]" 1
18 1 4 ILE MD 1 5 VAL H . . 4.480 4.368 4.330 4.414 . 0 0 "[ . 1 . 2]" 1
19 1 4 ILE MG 1 35 ARG H . . 4.110 4.120 4.047 4.158 0.048 7 0 "[ . 1 . 2]" 1
20 1 4 ILE MG 1 6 VAL H . . 4.480 3.291 3.228 3.367 . 0 0 "[ . 1 . 2]" 1
21 1 4 ILE HB 1 58 VAL MG1 . . 3.300 2.038 2.020 2.065 . 0 0 "[ . 1 . 2]" 1
22 1 4 ILE H 1 4 ILE HG12 . . 4.650 4.080 4.007 4.119 . 0 0 "[ . 1 . 2]" 1
23 1 4 ILE HG13 1 5 VAL H . . 5.210 4.875 4.827 4.953 . 0 0 "[ . 1 . 2]" 1
24 1 4 ILE HA 1 4 ILE MG . . 3.180 2.608 2.560 2.636 . 0 0 "[ . 1 . 2]" 1
25 1 4 ILE MG 1 5 VAL HA . . 3.960 3.265 3.199 3.442 . 0 0 "[ . 1 . 2]" 1
26 1 4 ILE HA 1 4 ILE MD . . 3.620 3.556 3.527 3.573 . 0 0 "[ . 1 . 2]" 1
27 1 4 ILE HG13 1 33 GLU H . . 4.750 3.438 3.304 3.610 . 0 0 "[ . 1 . 2]" 1
28 1 4 ILE HA 1 4 ILE HG13 . . 3.890 3.016 2.996 3.063 . 0 0 "[ . 1 . 2]" 1
29 1 4 ILE HG12 1 33 GLU HB2 . . 3.880 2.234 2.199 2.283 . 0 0 "[ . 1 . 2]" 1
30 1 4 ILE HG12 1 50 ALA HA . . 5.460 5.181 5.108 5.242 . 0 0 "[ . 1 . 2]" 1
31 1 4 ILE HA 1 4 ILE HG12 . . 3.990 2.099 2.082 2.117 . 0 0 "[ . 1 . 2]" 1
32 1 3 VAL H 1 4 ILE HG12 . . 5.330 5.046 4.930 5.208 . 0 0 "[ . 1 . 2]" 1
33 1 4 ILE MG 1 35 ARG HE . . 4.060 3.041 2.626 4.082 0.022 14 0 "[ . 1 . 2]" 1
34 1 4 ILE MG 1 58 VAL H . . 5.500 5.565 5.547 5.591 0.091 12 0 "[ . 1 . 2]" 1
35 1 4 ILE H 1 4 ILE MG . . 3.940 3.784 3.756 3.803 . 0 0 "[ . 1 . 2]" 1
36 1 4 ILE MG 1 50 ALA H . . 5.340 5.145 5.054 5.288 . 0 0 "[ . 1 . 2]" 1
37 1 4 ILE MG 1 55 ALA HA . . 5.490 5.505 5.457 5.536 0.046 4 0 "[ . 1 . 2]" 1
38 1 4 ILE MG 1 33 GLU HB2 . . 3.440 2.944 2.875 2.979 . 0 0 "[ . 1 . 2]" 1
39 1 4 ILE MG 1 33 GLU HB3 . . 4.380 4.365 4.267 4.408 0.028 13 0 "[ . 1 . 2]" 1
40 1 4 ILE HG13 1 4 ILE MG . . 3.310 3.215 3.204 3.222 . 0 0 "[ . 1 . 2]" 1
41 1 4 ILE MG 1 50 ALA MB . . 3.270 2.812 2.722 2.886 . 0 0 "[ . 1 . 2]" 1
42 1 4 ILE HG12 1 4 ILE MG . . 3.070 2.656 2.615 2.698 . 0 0 "[ . 1 . 2]" 1
43 1 4 ILE MD 1 55 ALA MB . . 2.720 1.936 1.905 1.959 . 0 0 "[ . 1 . 2]" 1
44 1 51 GLU HB3 1 79 ILE MD . . 4.120 2.568 2.310 2.832 . 0 0 "[ . 1 . 2]" 1
45 1 4 ILE MD 1 50 ALA HA . . 3.090 2.470 2.408 2.538 . 0 0 "[ . 1 . 2]" 1
46 1 4 ILE MD 1 33 GLU HA . . 4.840 4.733 4.680 4.780 . 0 0 "[ . 1 . 2]" 1
47 1 4 ILE MD 1 55 ALA H . . 3.990 3.772 3.718 3.861 . 0 0 "[ . 1 . 2]" 1
48 1 4 ILE MD 1 35 ARG HE . . 4.450 3.000 2.651 3.519 . 0 0 "[ . 1 . 2]" 1
49 1 5 VAL HA 1 59 VAL HB . . 4.290 2.777 2.606 4.386 0.096 19 0 "[ . 1 . 2]" 1
50 1 6 VAL HA 1 35 ARG HG2 . . 4.320 3.030 2.943 3.102 . 0 0 "[ . 1 . 2]" 1
51 1 6 VAL HA 1 6 VAL MG1 . . 3.220 2.284 2.232 2.344 . 0 0 "[ . 1 . 2]" 1
52 1 5 VAL HB 1 35 ARG H . . 4.460 4.179 3.986 4.241 . 0 0 "[ . 1 . 2]" 1
53 1 5 VAL HB 1 34 ILE HA . . 3.750 2.945 2.636 3.049 . 0 0 "[ . 1 . 2]" 1
54 1 61 VAL HA 1 89 VAL H . . 3.930 3.270 3.112 3.408 . 0 0 "[ . 1 . 2]" 1
55 1 7 ILE HG13 1 61 VAL HA . . 4.780 4.877 4.843 4.901 0.121 4 0 "[ . 1 . 2]" 1
56 1 6 VAL HB 1 60 ILE HA . . 3.890 2.597 2.520 2.671 . 0 0 "[ . 1 . 2]" 1
57 1 6 VAL HA 1 6 VAL MG2 . . 3.220 2.406 2.322 2.468 . 0 0 "[ . 1 . 2]" 1
58 1 37 VAL MG2 1 43 ALA MB . . 2.820 1.997 1.948 2.052 . 0 0 "[ . 1 . 2]" 1
59 1 7 ILE HA 1 8 VAL H . . 3.360 2.213 2.156 2.253 . 0 0 "[ . 1 . 2]" 1
60 1 7 ILE H 1 7 ILE HB . . 3.810 2.782 2.726 2.830 . 0 0 "[ . 1 . 2]" 1
61 1 7 ILE H 1 7 ILE HG12 . . 4.610 4.465 4.429 4.550 . 0 0 "[ . 1 . 2]" 1
62 1 7 ILE H 1 7 ILE MG . . 4.070 3.945 3.919 3.965 . 0 0 "[ . 1 . 2]" 1
63 1 7 ILE H 1 7 ILE MD . . 3.770 2.524 2.485 2.590 . 0 0 "[ . 1 . 2]" 1
64 1 7 ILE HA 1 7 ILE MG . . 3.170 2.315 2.224 2.356 . 0 0 "[ . 1 . 2]" 1
65 1 7 ILE HA 1 7 ILE HG13 . . 4.030 2.547 2.511 2.583 . 0 0 "[ . 1 . 2]" 1
66 1 7 ILE HA 1 7 ILE HG12 . . 4.090 3.656 3.640 3.683 . 0 0 "[ . 1 . 2]" 1
67 1 7 ILE HA 1 13 ALA MB . . 5.180 5.001 4.549 5.259 0.079 13 0 "[ . 1 . 2]" 1
68 1 7 ILE HA 1 61 VAL HB . . 3.460 2.269 2.189 2.360 . 0 0 "[ . 1 . 2]" 1
69 1 7 ILE HB 1 8 VAL H . . 4.790 4.111 3.987 4.243 . 0 0 "[ . 1 . 2]" 1
70 1 7 ILE HB 1 8 VAL HA . . 5.150 5.099 5.047 5.153 0.003 7 0 "[ . 1 . 2]" 1
71 1 7 ILE HG13 1 36 THR HA . . 5.340 5.363 5.342 5.379 0.039 13 0 "[ . 1 . 2]" 1
72 1 35 ARG HG3 1 36 THR H . . 4.750 4.272 4.226 4.331 . 0 0 "[ . 1 . 2]" 1
73 1 7 ILE HG13 1 8 VAL H . . 4.770 4.547 4.476 4.608 . 0 0 "[ . 1 . 2]" 1
74 1 87 ILE HG13 1 99 VAL H . . 5.270 5.052 4.768 5.273 0.003 13 0 "[ . 1 . 2]" 1
75 1 7 ILE HG12 1 22 ALA H . . 5.160 4.628 4.469 4.820 . 0 0 "[ . 1 . 2]" 1
76 1 87 ILE H 1 87 ILE HG13 . . 4.010 4.030 4.020 4.040 0.030 5 0 "[ . 1 . 2]" 1
77 1 60 ILE H 1 87 ILE HG13 . . 4.850 4.823 4.737 4.860 0.010 11 0 "[ . 1 . 2]" 1
78 1 6 VAL H 1 60 ILE MG . . 4.430 4.224 4.156 4.321 . 0 0 "[ . 1 . 2]" 1
79 1 58 VAL H 1 79 ILE MG . . 4.430 4.455 4.442 4.477 0.047 2 0 "[ . 1 . 2]" 1
80 1 7 ILE MG 1 8 VAL H . . 3.380 2.512 2.354 2.711 . 0 0 "[ . 1 . 2]" 1
81 1 79 ILE H 1 79 ILE MG . . 4.220 3.849 3.822 3.877 . 0 0 "[ . 1 . 2]" 1
82 1 79 ILE MG 1 80 ALA H . . 4.530 3.911 3.871 3.956 . 0 0 "[ . 1 . 2]" 1
83 1 79 ILE MG 1 86 THR HA . . 4.710 4.720 4.674 4.736 0.026 4 0 "[ . 1 . 2]" 1
84 1 7 ILE MG 1 36 THR HA . . 4.420 4.255 4.195 4.341 . 0 0 "[ . 1 . 2]" 1
85 1 60 ILE HA 1 60 ILE MG . . 3.210 2.271 2.237 2.319 . 0 0 "[ . 1 . 2]" 1
86 1 7 ILE MG 1 18 LEU HA . . 3.600 2.391 2.256 2.660 . 0 0 "[ . 1 . 2]" 1
87 1 7 ILE HG12 1 7 ILE MG . . 2.840 2.123 2.110 2.152 . 0 0 "[ . 1 . 2]" 1
88 1 79 ILE MG 1 84 ALA MB . . 2.720 1.955 1.937 1.969 . 0 0 "[ . 1 . 2]" 1
89 1 79 ILE HG13 1 79 ILE MG . . 2.770 2.279 2.258 2.296 . 0 0 "[ . 1 . 2]" 1
90 1 60 ILE MG 1 72 ALA MB . . 2.850 2.076 2.026 2.128 . 0 0 "[ . 1 . 2]" 1
91 1 7 ILE MD 1 36 THR MG . . 3.330 2.427 2.282 2.574 . 0 0 "[ . 1 . 2]" 1
92 1 7 ILE MD 1 22 ALA MB . . 3.270 3.273 3.248 3.299 0.029 4 0 "[ . 1 . 2]" 1
93 1 7 ILE HB 1 7 ILE MD . . 2.960 2.283 2.256 2.328 . 0 0 "[ . 1 . 2]" 1
94 1 7 ILE MD 1 35 ARG HD3 . . 4.930 4.692 4.603 4.846 . 0 0 "[ . 1 . 2]" 1
95 1 7 ILE MD 1 22 ALA HA . . 3.790 3.822 3.795 3.847 0.057 19 0 "[ . 1 . 2]" 1
96 1 7 ILE HA 1 7 ILE MD . . 3.440 3.480 3.465 3.496 0.056 3 0 "[ . 1 . 2]" 1
97 1 7 ILE MD 1 22 ALA H . . 4.050 3.927 3.834 4.047 . 0 0 "[ . 1 . 2]" 1
98 1 7 ILE MD 1 36 THR H . . 4.560 4.584 4.569 4.599 0.039 15 0 "[ . 1 . 2]" 1
99 1 7 ILE MD 1 61 VAL H . . 4.460 4.490 4.351 4.513 0.053 17 0 "[ . 1 . 2]" 1
100 1 6 VAL H 1 7 ILE MD . . 4.760 3.823 3.744 4.035 . 0 0 "[ . 1 . 2]" 1
101 1 22 ALA HA 1 34 ILE HA . . 5.230 4.995 4.949 5.056 . 0 0 "[ . 1 . 2]" 1
102 1 22 ALA HA 1 34 ILE MD . . 4.540 3.997 3.879 4.078 . 0 0 "[ . 1 . 2]" 1
103 1 25 ALA HA 1 29 VAL MG2 . . 3.930 2.633 2.534 2.749 . 0 0 "[ . 1 . 2]" 1
104 1 25 ALA MB 1 34 ILE MG . . 3.160 2.402 2.317 2.522 . 0 0 "[ . 1 . 2]" 1
105 1 57 ILE MG 1 102 ALA MB . . 2.600 2.314 2.180 2.435 . 0 0 "[ . 1 . 2]" 1
106 1 87 ILE HG13 1 102 ALA MB . . 2.990 2.657 2.506 2.868 . 0 0 "[ . 1 . 2]" 1
107 1 46 VAL HB 1 47 ALA HA . . 4.610 4.563 4.460 4.647 0.037 13 0 "[ . 1 . 2]" 1
108 1 22 ALA MB 1 35 ARG H . . 5.180 4.969 4.879 5.053 . 0 0 "[ . 1 . 2]" 1
109 1 61 VAL H 1 72 ALA MB . . 5.500 4.791 4.618 5.352 . 0 0 "[ . 1 . 2]" 1
110 1 25 ALA MB 1 34 ILE MD . . 2.610 2.096 2.032 2.140 . 0 0 "[ . 1 . 2]" 1
111 1 22 ALA MB 1 34 ILE HB . . 3.220 2.938 2.872 2.982 . 0 0 "[ . 1 . 2]" 1
112 1 22 ALA MB 1 34 ILE HA . . 4.910 4.929 4.906 4.952 0.042 12 0 "[ . 1 . 2]" 1
113 1 22 ALA MB 1 35 ARG HA . . 5.210 4.501 4.304 4.676 . 0 0 "[ . 1 . 2]" 1
114 1 25 ALA MB 1 26 LYS H . . 4.000 2.367 2.315 2.395 . 0 0 "[ . 1 . 2]" 1
115 1 25 ALA MB 1 34 ILE H . . 5.390 5.361 5.316 5.392 0.002 13 0 "[ . 1 . 2]" 1
116 1 3 VAL H 1 32 ALA HA . . 4.450 2.928 2.695 3.058 . 0 0 "[ . 1 . 2]" 1
117 1 31 ASP H 1 32 ALA HA . . 5.040 4.824 4.713 4.909 . 0 0 "[ . 1 . 2]" 1
118 1 4 ILE HA 1 32 ALA HA . . 4.200 4.098 4.006 4.171 . 0 0 "[ . 1 . 2]" 1
119 1 3 VAL HB 1 32 ALA HA . . 3.850 3.173 3.019 3.376 . 0 0 "[ . 1 . 2]" 1
120 1 29 VAL MG2 1 32 ALA MB . . 3.500 2.017 1.974 2.076 . 0 0 "[ . 1 . 2]" 1
121 1 3 VAL HB 1 32 ALA MB . . 3.210 2.135 2.060 2.263 . 0 0 "[ . 1 . 2]" 1
122 1 32 ALA MB 1 34 ILE HG12 . . 3.820 3.690 3.477 3.834 0.014 18 0 "[ . 1 . 2]" 1
123 1 29 VAL HB 1 32 ALA MB . . 3.210 2.167 2.089 2.238 . 0 0 "[ . 1 . 2]" 1
124 1 31 ASP HB2 1 32 ALA MB . . 5.030 5.029 4.858 5.066 0.036 20 0 "[ . 1 . 2]" 1
125 1 4 ILE HA 1 32 ALA MB . . 3.630 2.992 2.845 3.102 . 0 0 "[ . 1 . 2]" 1
126 1 32 ALA H 1 32 ALA MB . . 2.940 2.208 2.175 2.264 . 0 0 "[ . 1 . 2]" 1
127 1 4 ILE H 1 32 ALA MB . . 4.460 4.024 3.928 4.129 . 0 0 "[ . 1 . 2]" 1
128 1 4 ILE H 1 32 ALA HA . . 5.170 5.172 5.128 5.194 0.024 11 0 "[ . 1 . 2]" 1
129 1 31 ASP H 1 32 ALA MB . . 4.010 3.761 3.676 3.865 . 0 0 "[ . 1 . 2]" 1
130 1 3 VAL H 1 32 ALA MB . . 4.010 3.565 3.443 3.649 . 0 0 "[ . 1 . 2]" 1
131 1 43 ALA H 1 43 ALA MB . . 2.820 2.185 2.117 2.243 . 0 0 "[ . 1 . 2]" 1
132 1 42 ASP HB3 1 43 ALA HA . . 4.870 4.465 4.347 4.529 . 0 0 "[ . 1 . 2]" 1
133 1 42 ASP HB2 1 43 ALA HA . . 4.910 4.574 4.290 4.761 . 0 0 "[ . 1 . 2]" 1
134 1 37 VAL HB 1 43 ALA HA . . 3.900 3.077 2.919 3.169 . 0 0 "[ . 1 . 2]" 1
135 1 22 ALA HA 1 34 ILE MG . . 3.070 1.911 1.888 1.935 . 0 0 "[ . 1 . 2]" 1
136 1 37 VAL MG2 1 43 ALA HA . . 3.110 2.844 2.738 2.930 . 0 0 "[ . 1 . 2]" 1
137 1 37 VAL MG1 1 43 ALA MB . . 2.820 2.895 2.876 2.914 0.094 1 0 "[ . 1 . 2]" 1
138 1 42 ASP HB3 1 43 ALA MB . . 4.820 4.758 4.654 4.843 0.023 6 0 "[ . 1 . 2]" 1
139 1 42 ASP HB2 1 43 ALA MB . . 4.140 4.152 3.969 4.226 0.086 11 0 "[ . 1 . 2]" 1
140 1 43 ALA MB 1 75 VAL HA . . 3.570 3.420 3.267 3.495 . 0 0 "[ . 1 . 2]" 1
141 1 40 LYS H 1 43 ALA MB . . 4.820 4.626 4.554 4.719 . 0 0 "[ . 1 . 2]" 1
142 1 38 THR H 1 43 ALA MB . . 5.470 5.117 5.021 5.292 . 0 0 "[ . 1 . 2]" 1
143 1 25 ALA HA 1 28 GLU H . . 4.120 3.593 3.488 3.664 . 0 0 "[ . 1 . 2]" 1
144 1 47 ALA HA 1 75 VAL HA . . 4.910 4.689 4.619 4.732 . 0 0 "[ . 1 . 2]" 1
145 1 47 ALA MB 1 79 ILE HG12 . . 3.040 2.274 2.211 2.337 . 0 0 "[ . 1 . 2]" 1
146 1 51 GLU HB3 1 82 ALA MB . . 3.310 2.403 2.282 2.511 . 0 0 "[ . 1 . 2]" 1
147 1 51 GLU HA 1 82 ALA MB . . 3.410 3.010 2.657 3.210 . 0 0 "[ . 1 . 2]" 1
148 1 81 ARG H 1 82 ALA MB . . 4.060 4.081 4.067 4.101 0.041 1 0 "[ . 1 . 2]" 1
149 1 50 ALA HA 1 52 ARG H . . 4.470 3.888 3.823 3.973 . 0 0 "[ . 1 . 2]" 1
150 1 50 ALA HA 1 55 ALA H . . 4.480 3.854 3.772 3.936 . 0 0 "[ . 1 . 2]" 1
151 1 50 ALA HA 1 51 GLU HA . . 5.030 4.684 4.632 4.729 . 0 0 "[ . 1 . 2]" 1
152 1 49 GLU HB2 1 50 ALA HA . . 5.500 5.457 5.407 5.539 0.039 16 0 "[ . 1 . 2]" 1
153 1 50 ALA HA 1 53 ARG HG2 . . 4.220 2.382 2.273 2.515 . 0 0 "[ . 1 . 2]" 1
154 1 50 ALA HA 1 55 ALA MB . . 3.480 3.183 3.116 3.235 . 0 0 "[ . 1 . 2]" 1
155 1 4 ILE MD 1 50 ALA MB . . 2.800 1.885 1.867 1.906 . 0 0 "[ . 1 . 2]" 1
156 1 50 ALA MB 1 79 ILE MD . . 3.170 1.964 1.928 1.998 . 0 0 "[ . 1 . 2]" 1
157 1 50 ALA MB 1 79 ILE MG . . 3.330 3.361 3.348 3.371 0.041 12 0 "[ . 1 . 2]" 1
158 1 50 ALA MB 1 55 ALA MB . . 2.970 2.169 2.082 2.213 . 0 0 "[ . 1 . 2]" 1
159 1 50 ALA MB 1 79 ILE HG13 . . 3.210 3.082 3.030 3.213 0.003 17 0 "[ . 1 . 2]" 1
160 1 50 ALA MB 1 53 ARG HG2 . . 3.820 3.862 3.838 3.885 0.065 17 0 "[ . 1 . 2]" 1
161 1 50 ALA MB 1 51 GLU HB3 . . 4.160 4.043 3.944 4.179 0.019 7 0 "[ . 1 . 2]" 1
162 1 47 ALA HA 1 50 ALA MB . . 3.180 2.369 2.287 2.528 . 0 0 "[ . 1 . 2]" 1
163 1 50 ALA MB 1 51 GLU HA . . 3.910 3.941 3.923 3.955 0.045 12 0 "[ . 1 . 2]" 1
164 1 50 ALA MB 1 54 ASN HA . . 5.000 4.970 4.909 5.029 0.029 10 0 "[ . 1 . 2]" 1
165 1 50 ALA MB 1 58 VAL HA . . 5.400 5.364 5.298 5.414 0.014 6 0 "[ . 1 . 2]" 1
166 1 4 ILE HA 1 50 ALA MB . . 5.500 5.597 5.572 5.619 0.119 1 0 "[ . 1 . 2]" 1
167 1 50 ALA MB 1 55 ALA H . . 3.710 3.303 3.189 3.371 . 0 0 "[ . 1 . 2]" 1
168 1 50 ALA MB 1 52 ARG H . . 4.270 4.350 4.331 4.379 0.109 17 0 "[ . 1 . 2]" 1
169 1 55 ALA HA 1 56 ASP H . . 3.550 2.273 2.213 2.300 . 0 0 "[ . 1 . 2]" 1
170 1 55 ALA MB 1 56 ASP H . . 3.760 3.592 3.561 3.615 . 0 0 "[ . 1 . 2]" 1
171 1 2 ARG H 1 55 ALA HA . . 5.410 4.517 4.385 4.692 . 0 0 "[ . 1 . 2]" 1
172 1 54 ASN H 1 55 ALA HA . . 5.080 5.092 5.065 5.106 0.026 16 0 "[ . 1 . 2]" 1
173 1 55 ALA HA 1 56 ASP HA . . 4.810 4.548 4.514 4.598 . 0 0 "[ . 1 . 2]" 1
174 1 54 ASN HA 1 55 ALA HA . . 4.570 4.582 4.554 4.597 0.027 3 0 "[ . 1 . 2]" 1
175 1 2 ARG HD3 1 55 ALA HA . . 4.610 3.921 3.744 4.067 . 0 0 "[ . 1 . 2]" 1
176 1 55 ALA HA 1 56 ASP HB2 . . 4.750 4.278 4.130 4.350 . 0 0 "[ . 1 . 2]" 1
177 1 50 ALA MB 1 55 ALA HA . . 4.700 4.594 4.454 4.662 . 0 0 "[ . 1 . 2]" 1
178 1 55 ALA HA 1 79 ILE MG . . 5.500 5.459 5.372 5.516 0.016 2 0 "[ . 1 . 2]" 1
179 1 4 ILE MD 1 55 ALA HA . . 4.130 3.795 3.701 3.862 . 0 0 "[ . 1 . 2]" 1
180 1 4 ILE HG13 1 55 ALA MB . . 3.260 2.115 2.079 2.144 . 0 0 "[ . 1 . 2]" 1
181 1 4 ILE HB 1 55 ALA MB . . 3.400 2.376 2.319 2.450 . 0 0 "[ . 1 . 2]" 1
182 1 53 ARG HG2 1 55 ALA MB . . 3.900 3.633 3.355 3.855 . 0 0 "[ . 1 . 2]" 1
183 1 2 ARG HD2 1 55 ALA MB . . 4.400 3.314 3.187 3.517 . 0 0 "[ . 1 . 2]" 1
184 1 54 ASN HA 1 55 ALA MB . . 4.300 4.085 4.044 4.109 . 0 0 "[ . 1 . 2]" 1
185 1 55 ALA MB 1 56 ASP HA . . 4.890 4.673 4.614 4.760 . 0 0 "[ . 1 . 2]" 1
186 1 3 VAL HA 1 55 ALA MB . . 4.100 4.070 3.973 4.134 0.034 12 0 "[ . 1 . 2]" 1
187 1 54 ASN H 1 55 ALA MB . . 4.500 4.258 4.208 4.335 . 0 0 "[ . 1 . 2]" 1
188 1 53 ARG H 1 55 ALA MB . . 5.170 5.063 4.910 5.183 0.013 12 0 "[ . 1 . 2]" 1
189 1 4 ILE H 1 55 ALA MB . . 4.190 3.661 3.576 3.741 . 0 0 "[ . 1 . 2]" 1
190 1 55 ALA MB 1 59 VAL H . . 5.500 5.502 5.471 5.521 0.021 7 0 "[ . 1 . 2]" 1
191 1 55 ALA MB 1 58 VAL H . . 4.670 4.686 4.646 4.704 0.034 16 0 "[ . 1 . 2]" 1
192 1 72 ALA HA 1 75 VAL H . . 4.110 3.698 3.617 3.754 . 0 0 "[ . 1 . 2]" 1
193 1 43 ALA HA 1 75 VAL HA . . 4.840 4.521 4.444 4.581 . 0 0 "[ . 1 . 2]" 1
194 1 72 ALA HA 1 75 VAL HB . . 3.720 3.176 3.105 3.238 . 0 0 "[ . 1 . 2]" 1
195 1 60 ILE MG 1 72 ALA HA . . 3.170 2.254 2.083 2.522 . 0 0 "[ . 1 . 2]" 1
196 1 98 ALA MB 1 99 VAL HA . . 3.750 3.844 3.823 3.873 0.123 9 0 "[ . 1 . 2]" 1
197 1 63 PRO HD2 1 72 ALA MB . . 4.100 4.108 3.984 4.151 0.051 10 0 "[ . 1 . 2]" 1
198 1 72 ALA MB 1 88 GLU HA . . 4.960 4.511 4.140 4.882 . 0 0 "[ . 1 . 2]" 1
199 1 102 ALA H 1 102 ALA MB . . 2.890 2.438 2.375 2.532 . 0 0 "[ . 1 . 2]" 1
200 1 80 ALA HA 1 84 ALA H . . 4.710 3.883 3.701 4.418 . 0 0 "[ . 1 . 2]" 1
201 1 79 ILE HA 1 80 ALA HA . . 5.190 4.802 4.764 4.842 . 0 0 "[ . 1 . 2]" 1
202 1 80 ALA HA 1 86 THR MG . . 5.050 5.072 5.053 5.090 0.040 15 0 "[ . 1 . 2]" 1
203 1 79 ILE MG 1 80 ALA HA . . 4.000 3.969 3.882 4.007 0.007 12 0 "[ . 1 . 2]" 1
204 1 100 ALA H 1 100 ALA MB . . 2.720 2.230 2.209 2.259 . 0 0 "[ . 1 . 2]" 1
205 1 100 ALA MB 1 101 LYS H . . 3.030 2.648 2.539 2.715 . 0 0 "[ . 1 . 2]" 1
206 1 82 ALA HA 1 83 GLY HA3 . . 4.540 4.574 4.565 4.586 0.046 20 0 "[ . 1 . 2]" 1
207 1 82 ALA HA 1 84 ALA H . . 5.350 5.219 4.985 5.278 . 0 0 "[ . 1 . 2]" 1
208 1 51 GLU HB3 1 82 ALA HA . . 4.680 4.518 4.349 4.681 0.001 20 0 "[ . 1 . 2]" 1
209 1 51 GLU HB2 1 82 ALA HA . . 4.250 3.813 3.599 4.095 . 0 0 "[ . 1 . 2]" 1
210 1 13 ALA HA 1 63 PRO HB3 . . 4.250 3.124 2.176 4.216 . 0 0 "[ . 1 . 2]" 1
211 1 79 ILE MD 1 82 ALA HA . . 5.280 5.049 4.991 5.134 . 0 0 "[ . 1 . 2]" 1
212 1 79 ILE MG 1 82 ALA HA . . 5.020 5.007 4.949 5.031 0.011 9 0 "[ . 1 . 2]" 1
213 1 47 ALA MB 1 78 ILE HG13 . . 3.500 3.009 2.967 3.074 . 0 0 "[ . 1 . 2]" 1
214 1 81 ARG H 1 82 ALA HA . . 5.050 5.021 4.993 5.051 0.001 17 0 "[ . 1 . 2]" 1
215 1 84 ALA H 1 84 ALA MB . . 3.150 2.333 2.120 2.394 . 0 0 "[ . 1 . 2]" 1
216 1 84 ALA MB 1 85 LYS H . . 3.310 2.152 1.978 2.264 . 0 0 "[ . 1 . 2]" 1
217 1 82 ALA MB 1 84 ALA HA . . 5.500 5.528 5.510 5.542 0.042 7 0 "[ . 1 . 2]" 1
218 1 84 ALA HA 1 85 LYS HG3 . . 5.500 5.409 5.298 5.534 0.034 4 0 "[ . 1 . 2]" 1
219 1 82 ALA MB 1 84 ALA MB . . 3.360 3.354 3.290 3.379 0.019 4 0 "[ . 1 . 2]" 1
220 1 84 ALA HA 1 85 LYS HB3 . . 4.760 4.412 4.190 4.556 . 0 0 "[ . 1 . 2]" 1
221 1 79 ILE HB 1 84 ALA MB . . 4.310 4.186 4.154 4.209 . 0 0 "[ . 1 . 2]" 1
222 1 83 GLY HA3 1 84 ALA HA . . 4.900 4.632 4.574 4.682 . 0 0 "[ . 1 . 2]" 1
223 1 56 ASP HA 1 84 ALA MB . . 4.020 2.689 2.538 3.043 . 0 0 "[ . 1 . 2]" 1
224 1 57 ILE HA 1 84 ALA MB . . 3.950 3.531 3.481 3.625 . 0 0 "[ . 1 . 2]" 1
225 1 57 ILE HA 1 84 ALA HA . . 5.280 5.297 5.281 5.312 0.032 1 0 "[ . 1 . 2]" 1
226 1 57 ILE H 1 84 ALA MB . . 4.500 4.146 4.045 4.231 . 0 0 "[ . 1 . 2]" 1
227 1 83 GLY H 1 84 ALA MB . . 4.070 3.875 3.822 3.917 . 0 0 "[ . 1 . 2]" 1
228 1 84 ALA MB 1 86 THR H . . 4.800 4.861 4.844 4.874 0.074 20 0 "[ . 1 . 2]" 1
229 1 56 ASP H 1 84 ALA MB . . 4.640 4.300 4.133 4.489 . 0 0 "[ . 1 . 2]" 1
230 1 87 ILE HB 1 98 ALA HA . . 3.920 3.798 3.516 3.967 0.047 3 0 "[ . 1 . 2]" 1
231 1 87 ILE MD 1 102 ALA MB . . 2.490 1.887 1.852 1.911 . 0 0 "[ . 1 . 2]" 1
232 1 99 VAL HB 1 100 ALA HA . . 4.370 4.358 3.753 4.418 0.048 3 0 "[ . 1 . 2]" 1
233 1 102 ALA HA 1 105 SER H . . 3.840 3.442 3.325 3.589 . 0 0 "[ . 1 . 2]" 1
234 1 102 ALA HA 1 106 TRP HB3 . . 5.450 5.213 4.989 5.420 . 0 0 "[ . 1 . 2]" 1
235 1 87 ILE MD 1 102 ALA HA . . 4.510 4.300 4.218 4.365 . 0 0 "[ . 1 . 2]" 1
236 1 57 ILE MG 1 102 ALA HA . . 4.210 4.100 3.944 4.243 0.033 6 0 "[ . 1 . 2]" 1
237 1 87 ILE HB 1 98 ALA MB . . 3.550 2.895 2.525 3.175 . 0 0 "[ . 1 . 2]" 1
238 1 54 ASN H 1 54 ASN HB3 . . 4.160 4.099 4.081 4.118 . 0 0 "[ . 1 . 2]" 1
239 1 54 ASN HA 1 79 ILE MD . . 5.500 5.228 5.100 5.397 . 0 0 "[ . 1 . 2]" 1
240 1 54 ASN HB3 1 55 ALA MB . . 5.500 5.475 5.439 5.502 0.002 18 0 "[ . 1 . 2]" 1
241 1 2 ARG HB2 1 54 ASN HB3 . . 5.170 5.239 5.193 5.262 0.092 12 0 "[ . 1 . 2]" 1
242 1 53 ARG HG2 1 54 ASN HB2 . . 5.260 5.344 5.312 5.391 0.131 17 0 "[ . 1 . 2]" 1
243 1 54 ASN HB3 1 55 ALA HA . . 5.160 5.165 5.011 5.209 0.049 18 0 "[ . 1 . 2]" 1
244 1 54 ASN HB2 1 55 ALA HA . . 5.500 5.515 5.480 5.587 0.087 4 0 "[ . 1 . 2]" 1
245 1 51 GLU HA 1 54 ASN HB2 . . 5.500 5.551 5.527 5.572 0.072 5 0 "[ . 1 . 2]" 1
246 1 2 ARG HE 1 54 ASN HB3 . . 5.500 5.101 4.771 5.496 . 0 0 "[ . 1 . 2]" 1
247 1 2 ARG HE 1 54 ASN HB2 . . 5.500 4.129 3.975 4.412 . 0 0 "[ . 1 . 2]" 1
248 1 53 ARG H 1 54 ASN HB2 . . 5.020 5.070 5.036 5.106 0.086 15 0 "[ . 1 . 2]" 1
249 1 19 ASP HA 1 23 ARG H . . 4.380 4.005 3.932 4.117 . 0 0 "[ . 1 . 2]" 1
250 1 31 ASP HB3 1 32 ALA H . . 3.840 3.103 2.708 3.839 . 0 0 "[ . 1 . 2]" 1
251 1 31 ASP HB2 1 32 ALA H . . 3.840 3.895 3.788 3.928 0.088 7 0 "[ . 1 . 2]" 1
252 1 19 ASP HA 1 22 ALA MB . . 3.740 2.990 2.825 3.117 . 0 0 "[ . 1 . 2]" 1
253 1 19 ASP HA 1 36 THR MG . . 5.330 5.198 5.002 5.339 0.009 10 0 "[ . 1 . 2]" 1
254 1 31 ASP HB3 1 32 ALA MB . . 5.030 3.913 3.630 4.605 . 0 0 "[ . 1 . 2]" 1
255 1 31 ASP H 1 31 ASP HB3 . . 3.420 2.642 2.305 3.307 . 0 0 "[ . 1 . 2]" 1
256 1 19 ASP HB3 1 21 LEU H . . 4.840 4.491 4.345 4.793 . 0 0 "[ . 1 . 2]" 1
257 1 30 PRO HB2 1 31 ASP HA . . 4.750 4.578 4.536 4.626 . 0 0 "[ . 1 . 2]" 1
258 1 30 PRO HG2 1 31 ASP HA . . 4.700 4.676 4.642 4.713 0.013 9 0 "[ . 1 . 2]" 1
259 1 31 ASP HA 1 32 ALA MB . . 5.010 4.937 4.893 4.975 . 0 0 "[ . 1 . 2]" 1
260 1 38 THR H 1 42 ASP HA . . 4.920 4.859 4.749 4.952 0.032 3 0 "[ . 1 . 2]" 1
261 1 38 THR H 1 42 ASP HB2 . . 4.210 2.094 1.955 2.276 . 0 0 "[ . 1 . 2]" 1
262 1 38 THR H 1 42 ASP HB3 . . 4.330 2.793 2.698 2.882 . 0 0 "[ . 1 . 2]" 1
263 1 42 ASP HA 1 45 ARG HE . . 5.120 4.295 2.086 5.189 0.069 18 0 "[ . 1 . 2]" 1
264 1 42 ASP HA 1 43 ALA HA . . 4.910 4.803 4.761 4.842 . 0 0 "[ . 1 . 2]" 1
265 1 37 VAL MG2 1 42 ASP HA . . 4.900 4.987 4.926 5.033 0.133 1 0 "[ . 1 . 2]" 1
266 1 37 VAL MG1 1 42 ASP HA . . 4.900 4.609 4.339 4.876 . 0 0 "[ . 1 . 2]" 1
267 1 39 THR MG 1 42 ASP HB2 . . 5.360 4.994 4.693 5.376 0.016 16 0 "[ . 1 . 2]" 1
268 1 39 THR HA 1 42 ASP HB2 . . 4.860 4.847 4.756 4.908 0.048 15 0 "[ . 1 . 2]" 1
269 1 41 GLU H 1 42 ASP HB2 . . 5.270 4.622 4.573 4.668 . 0 0 "[ . 1 . 2]" 1
270 1 2 ARG HB3 1 56 ASP HA . . 4.610 4.662 4.630 4.699 0.089 16 0 "[ . 1 . 2]" 1
271 1 56 ASP HB3 1 57 ILE MD . . 5.280 3.715 3.641 3.949 . 0 0 "[ . 1 . 2]" 1
272 1 56 ASP HB2 1 57 ILE MD . . 5.030 5.032 4.522 5.072 0.042 3 0 "[ . 1 . 2]" 1
273 1 56 ASP HB3 1 57 ILE HG12 . . 5.500 3.039 2.974 3.194 . 0 0 "[ . 1 . 2]" 1
274 1 55 ALA MB 1 56 ASP HB2 . . 5.500 5.210 4.989 5.261 . 0 0 "[ . 1 . 2]" 1
275 1 56 ASP HB3 1 57 ILE HG13 . . 5.500 2.528 2.369 2.983 . 0 0 "[ . 1 . 2]" 1
276 1 1 MET HG3 1 56 ASP HB2 . . 4.940 4.420 4.061 4.955 0.015 20 0 "[ . 1 . 2]" 1
277 1 2 ARG HB3 1 56 ASP HB2 . . 5.300 3.201 2.941 3.306 . 0 0 "[ . 1 . 2]" 1
278 1 1 MET HG3 1 56 ASP HB3 . . 5.400 3.461 3.168 4.244 . 0 0 "[ . 1 . 2]" 1
279 1 1 MET HG2 1 56 ASP HB2 . . 4.940 3.789 2.985 4.832 . 0 0 "[ . 1 . 2]" 1
280 1 1 MET HG2 1 56 ASP HB3 . . 5.400 3.184 2.347 4.017 . 0 0 "[ . 1 . 2]" 1
281 1 2 ARG HA 1 56 ASP HB2 . . 5.500 4.487 4.035 4.601 . 0 0 "[ . 1 . 2]" 1
282 1 8 VAL HB 1 62 GLY HA2 . . 4.340 2.678 2.302 2.959 . 0 0 "[ . 1 . 2]" 1
283 1 82 ALA MB 1 83 GLY HA2 . . 4.760 4.668 4.644 4.704 . 0 0 "[ . 1 . 2]" 1
284 1 83 GLY HA3 1 84 ALA MB . . 4.790 4.306 4.253 4.422 . 0 0 "[ . 1 . 2]" 1
285 1 79 ILE MG 1 83 GLY HA3 . . 5.500 5.533 5.520 5.547 0.047 14 0 "[ . 1 . 2]" 1
286 1 82 ALA MB 1 83 GLY HA3 . . 4.480 4.241 4.209 4.280 . 0 0 "[ . 1 . 2]" 1
287 1 104 GLY HA3 1 105 SER H . . 3.480 2.621 2.560 2.683 . 0 0 "[ . 1 . 2]" 1
288 1 104 GLY HA3 1 106 TRP H . . 5.170 4.843 4.765 4.988 . 0 0 "[ . 1 . 2]" 1
289 1 102 ALA H 1 104 GLY HA3 . . 5.410 4.992 4.799 5.132 . 0 0 "[ . 1 . 2]" 1
290 1 104 GLY HA3 1 105 SER HA . . 4.310 4.214 4.116 4.278 . 0 0 "[ . 1 . 2]" 1
291 1 100 ALA MB 1 104 GLY HA3 . . 4.890 3.642 3.395 3.791 . 0 0 "[ . 1 . 2]" 1
292 1 109 GLU H 1 110 HIS HA . . 5.270 5.221 5.046 5.309 0.039 13 0 "[ . 1 . 2]" 1
293 1 110 HIS HA 1 110 HIS HD2 . . 4.710 4.249 4.009 4.557 . 0 0 "[ . 1 . 2]" 1
294 1 106 TRP HZ3 1 110 HIS HB3 . . 5.500 4.370 3.527 5.066 . 0 0 "[ . 1 . 2]" 1
295 1 106 TRP HH2 1 110 HIS HB3 . . 5.500 3.994 3.360 4.648 . 0 0 "[ . 1 . 2]" 1
296 1 106 TRP HZ3 1 110 HIS HB2 . . 5.500 3.888 2.931 5.501 0.001 18 0 "[ . 1 . 2]" 1
297 1 106 TRP HH2 1 110 HIS HB2 . . 5.500 4.045 3.531 4.833 . 0 0 "[ . 1 . 2]" 1
298 1 110 HIS HB2 1 111 HIS H . . 5.500 3.777 2.583 4.457 . 0 0 "[ . 1 . 2]" 1
299 1 110 HIS HB3 1 111 HIS H . . 5.500 4.177 3.512 4.447 . 0 0 "[ . 1 . 2]" 1
300 1 2 ARG HA 1 57 ILE H . . 5.440 5.246 5.211 5.293 . 0 0 "[ . 1 . 2]" 1
301 1 111 HIS HA 1 111 HIS HD2 . . 4.420 3.878 2.783 4.516 0.096 12 0 "[ . 1 . 2]" 1
302 1 112 HIS HA 1 112 HIS HD2 . . 3.920 3.329 2.454 4.019 0.099 13 0 "[ . 1 . 2]" 1
303 1 64 SER HA 1 90 THR MG . . 3.790 2.119 1.953 2.380 . 0 0 "[ . 1 . 2]" 1
304 1 64 SER HA 1 91 THR H . . 5.500 5.173 4.634 5.531 0.031 17 0 "[ . 1 . 2]" 1
305 1 106 TRP HE3 1 107 SER HB2 . . 4.600 4.197 4.030 4.440 . 0 0 "[ . 1 . 2]" 1
306 1 69 SER HA 1 72 ALA MB . . 4.390 3.956 3.566 4.378 . 0 0 "[ . 1 . 2]" 1
307 1 63 PRO HD2 1 69 SER HA . . 4.740 3.976 3.198 4.662 . 0 0 "[ . 1 . 2]" 1
308 1 68 LYS HD3 1 69 SER HA . . 5.150 4.026 2.633 5.251 0.101 11 0 "[ . 1 . 2]" 1
309 1 69 SER HA 1 71 LEU HB2 . . 4.690 4.600 3.992 4.727 0.037 10 0 "[ . 1 . 2]" 1
310 1 106 TRP HA 1 106 TRP HE3 . . 4.310 4.228 4.022 4.322 0.012 7 0 "[ . 1 . 2]" 1
311 1 106 TRP HZ3 1 107 SER HB2 . . 5.500 5.407 4.934 5.574 0.074 3 0 "[ . 1 . 2]" 1
312 1 106 TRP HA 1 106 TRP HD1 . . 4.340 3.496 3.355 3.636 . 0 0 "[ . 1 . 2]" 1
313 1 106 TRP HA 1 110 HIS HD2 . . 4.830 3.447 2.394 4.873 0.043 18 0 "[ . 1 . 2]" 1
314 1 105 SER HA 1 108 LEU HB3 . . 4.180 3.143 2.844 3.372 . 0 0 "[ . 1 . 2]" 1
315 1 105 SER HA 1 109 GLU HG3 . . 4.750 4.143 3.785 4.508 . 0 0 "[ . 1 . 2]" 1
316 1 106 TRP HA 1 109 GLU HG3 . . 5.350 2.523 2.102 2.994 . 0 0 "[ . 1 . 2]" 1
317 1 106 TRP HE3 1 107 SER HA . . 3.830 2.536 2.400 2.627 . 0 0 "[ . 1 . 2]" 1
318 1 107 SER HB3 1 108 LEU H . . 4.280 4.214 4.008 4.335 0.055 9 0 "[ . 1 . 2]" 1
319 1 106 TRP HE3 1 107 SER HB3 . . 4.600 3.643 2.832 4.175 . 0 0 "[ . 1 . 2]" 1
320 1 106 TRP HZ3 1 107 SER HA . . 4.510 3.411 3.184 3.803 . 0 0 "[ . 1 . 2]" 1
321 1 107 SER HA 1 110 HIS HD2 . . 5.500 4.048 2.152 5.172 . 0 0 "[ . 1 . 2]" 1
322 1 106 TRP HB3 1 107 SER HA . . 4.940 4.357 4.274 4.417 . 0 0 "[ . 1 . 2]" 1
323 1 106 TRP HZ3 1 107 SER HB3 . . 5.500 4.617 4.029 5.151 . 0 0 "[ . 1 . 2]" 1
324 1 57 ILE MD 1 106 TRP HB2 . . 4.470 2.623 2.474 2.771 . 0 0 "[ . 1 . 2]" 1
325 1 57 ILE HG12 1 106 TRP HB3 . . 5.240 4.224 3.965 4.449 . 0 0 "[ . 1 . 2]" 1
326 1 57 ILE HG12 1 106 TRP HB2 . . 5.210 3.646 3.402 3.884 . 0 0 "[ . 1 . 2]" 1
327 1 57 ILE HG13 1 106 TRP HB3 . . 5.500 5.118 4.963 5.347 . 0 0 "[ . 1 . 2]" 1
328 1 57 ILE HG13 1 106 TRP HB2 . . 5.500 5.035 4.852 5.255 . 0 0 "[ . 1 . 2]" 1
329 1 102 ALA MB 1 106 TRP HB3 . . 5.110 5.109 4.972 5.167 0.057 9 0 "[ . 1 . 2]" 1
330 1 102 ALA MB 1 106 TRP HB2 . . 4.920 3.982 3.772 4.118 . 0 0 "[ . 1 . 2]" 1
331 1 85 LYS HG3 1 106 TRP HB2 . . 5.130 4.533 4.333 4.660 . 0 0 "[ . 1 . 2]" 1
332 1 1 MET ME 1 106 TRP HB3 . . 4.670 3.852 3.171 4.688 0.018 16 0 "[ . 1 . 2]" 1
333 1 103 ARG HA 1 106 TRP HB2 . . 4.170 3.963 3.618 4.177 0.007 16 0 "[ . 1 . 2]" 1
334 1 106 TRP HB3 1 106 TRP HZ3 . . 5.380 5.255 5.166 5.362 . 0 0 "[ . 1 . 2]" 1
335 1 106 TRP HB2 1 108 LEU H . . 5.500 5.361 5.269 5.529 0.029 15 0 "[ . 1 . 2]" 1
336 1 106 TRP HB3 1 108 LEU H . . 5.500 4.657 4.575 4.825 . 0 0 "[ . 1 . 2]" 1
337 1 104 GLY H 1 106 TRP HB3 . . 5.500 5.459 5.338 5.525 0.025 15 0 "[ . 1 . 2]" 1
338 1 105 SER H 1 106 TRP HB3 . . 5.500 5.311 5.255 5.374 . 0 0 "[ . 1 . 2]" 1
339 1 106 TRP H 1 106 TRP HB3 . . 3.600 2.702 2.643 2.844 . 0 0 "[ . 1 . 2]" 1
340 1 106 TRP H 1 106 TRP HB2 . . 3.620 2.237 2.182 2.295 . 0 0 "[ . 1 . 2]" 1
341 1 20 GLU HA 1 23 ARG H . . 3.630 3.586 3.496 3.650 0.020 12 0 "[ . 1 . 2]" 1
342 1 27 GLU HB3 1 28 GLU H . . 3.210 3.133 2.450 3.263 0.053 1 0 "[ . 1 . 2]" 1
343 1 27 GLU HB2 1 28 GLU H . . 3.210 2.822 2.636 3.297 0.087 17 0 "[ . 1 . 2]" 1
344 1 48 GLU HB3 1 78 ILE MG . . 3.900 3.176 3.020 3.345 . 0 0 "[ . 1 . 2]" 1
345 1 49 GLU HB3 1 50 ALA MB . . 4.110 3.788 3.752 3.850 . 0 0 "[ . 1 . 2]" 1
346 1 51 GLU HB3 1 52 ARG H . . 4.060 4.160 4.126 4.187 0.127 15 0 "[ . 1 . 2]" 1
347 1 106 TRP H 1 109 GLU HG2 . . 5.500 5.351 5.208 5.523 0.023 5 0 "[ . 1 . 2]" 1
348 1 27 GLU HA 1 30 PRO HA . . 5.270 5.018 4.874 5.187 . 0 0 "[ . 1 . 2]" 1
349 1 27 GLU HA 1 27 GLU HG2 . . 3.230 2.404 2.257 2.551 . 0 0 "[ . 1 . 2]" 1
350 1 27 GLU HA 1 27 GLU HG3 . . 3.230 2.840 2.399 3.452 0.222 14 0 "[ . 1 . 2]" 1
351 1 28 GLU HA 1 30 PRO HD2 . . 4.970 4.630 4.456 4.854 . 0 0 "[ . 1 . 2]" 1
352 1 4 ILE MG 1 33 GLU HA . . 5.080 4.962 4.922 4.985 . 0 0 "[ . 1 . 2]" 1
353 1 4 ILE HG12 1 33 GLU HA . . 4.630 4.202 4.144 4.297 . 0 0 "[ . 1 . 2]" 1
354 1 33 GLU HA 1 34 ILE HG12 . . 3.760 3.623 3.490 3.690 . 0 0 "[ . 1 . 2]" 1
355 1 33 GLU HA 1 34 ILE HA . . 4.500 4.387 4.359 4.408 . 0 0 "[ . 1 . 2]" 1
356 1 5 VAL H 1 33 GLU HA . . 4.980 4.972 4.882 5.024 0.044 15 0 "[ . 1 . 2]" 1
357 1 89 VAL H 1 89 VAL HB . . 3.970 3.706 3.630 3.732 . 0 0 "[ . 1 . 2]" 1
358 1 109 GLU HG3 1 110 HIS HD2 . . 5.500 4.513 3.869 5.542 0.042 3 0 "[ . 1 . 2]" 1
359 1 4 ILE HA 1 33 GLU HB2 . . 4.150 3.538 3.448 3.588 . 0 0 "[ . 1 . 2]" 1
360 1 33 GLU HB3 1 34 ILE H . . 3.940 3.689 3.608 3.795 . 0 0 "[ . 1 . 2]" 1
361 1 33 GLU HB2 1 35 ARG HE . . 5.430 3.661 3.091 3.893 . 0 0 "[ . 1 . 2]" 1
362 1 5 VAL H 1 33 GLU HB2 . . 4.880 4.202 4.115 4.244 . 0 0 "[ . 1 . 2]" 1
363 1 5 VAL H 1 33 GLU HB3 . . 5.500 5.451 5.312 5.514 0.014 15 0 "[ . 1 . 2]" 1
364 1 40 LYS H 1 41 GLU HA . . 5.430 5.461 5.439 5.479 0.049 13 0 "[ . 1 . 2]" 1
365 1 41 GLU HA 1 42 ASP HA . . 4.930 4.790 4.764 4.821 . 0 0 "[ . 1 . 2]" 1
366 1 41 GLU HA 1 41 GLU HG2 . . 3.780 3.748 3.687 3.793 0.013 12 0 "[ . 1 . 2]" 1
367 1 41 GLU HA 1 74 ILE MG . . 5.490 5.089 5.004 5.186 . 0 0 "[ . 1 . 2]" 1
368 1 41 GLU HG3 1 42 ASP HB3 . . 4.780 4.875 4.802 4.925 0.145 10 0 "[ . 1 . 2]" 1
369 1 41 GLU HG3 1 42 ASP HA . . 4.960 3.746 3.671 3.815 . 0 0 "[ . 1 . 2]" 1
370 1 41 GLU HG3 1 43 ALA H . . 4.720 4.755 4.720 4.779 0.059 14 0 "[ . 1 . 2]" 1
371 1 40 LYS H 1 41 GLU HG3 . . 5.500 5.401 5.270 5.510 0.010 4 0 "[ . 1 . 2]" 1
372 1 40 LYS H 1 41 GLU HB3 . . 5.410 5.229 5.102 5.321 . 0 0 "[ . 1 . 2]" 1
373 1 41 GLU HB2 1 42 ASP H . . 3.840 3.709 3.645 3.763 . 0 0 "[ . 1 . 2]" 1
374 1 41 GLU HB2 1 42 ASP HA . . 4.610 4.611 4.577 4.624 0.014 17 0 "[ . 1 . 2]" 1
375 1 48 GLU HA 1 50 ALA H . . 4.630 4.618 4.552 4.653 0.023 19 0 "[ . 1 . 2]" 1
376 1 103 ARG HA 1 106 TRP HB3 . . 3.860 3.711 3.363 3.892 0.032 4 0 "[ . 1 . 2]" 1
377 1 48 GLU HA 1 48 GLU HB3 . . 2.730 2.533 2.509 2.556 . 0 0 "[ . 1 . 2]" 1
378 1 48 GLU HA 1 78 ILE MG . . 3.550 2.889 2.792 2.986 . 0 0 "[ . 1 . 2]" 1
379 1 57 ILE MD 1 103 ARG HA . . 3.630 2.724 2.318 2.999 . 0 0 "[ . 1 . 2]" 1
380 1 48 GLU H 1 48 GLU HG3 . . 3.630 3.591 2.688 3.717 0.087 4 0 "[ . 1 . 2]" 1
381 1 48 GLU H 1 48 GLU HB2 . . 3.580 3.594 3.579 3.607 0.027 17 0 "[ . 1 . 2]" 1
382 1 35 ARG HE 1 49 GLU HB2 . . 5.500 5.579 5.448 5.628 0.128 20 0 "[ . 1 . 2]" 1
383 1 4 ILE MD 1 49 GLU HB3 . . 4.850 4.494 4.366 4.658 . 0 0 "[ . 1 . 2]" 1
384 1 49 GLU HA 1 52 ARG H . . 3.640 3.628 3.446 3.668 0.028 14 0 "[ . 1 . 2]" 1
385 1 73 LYS HA 1 76 LYS H . . 3.780 3.250 3.111 3.756 . 0 0 "[ . 1 . 2]" 1
386 1 73 LYS HA 1 73 LYS HB2 . . 2.920 2.377 2.228 2.670 . 0 0 "[ . 1 . 2]" 1
387 1 73 LYS HA 1 73 LYS HB3 . . 2.920 2.471 2.329 3.006 0.086 14 0 "[ . 1 . 2]" 1
388 1 23 ARG HA 1 23 ARG HG2 . . 2.940 2.709 2.668 2.745 . 0 0 "[ . 1 . 2]" 1
389 1 77 LYS HA 1 80 ALA MB . . 2.740 2.619 2.447 2.742 0.002 1 0 "[ . 1 . 2]" 1
390 1 105 SER HA 1 109 GLU HG2 . . 4.480 4.223 3.897 4.483 0.003 5 0 "[ . 1 . 2]" 1
391 1 51 GLU HA 1 54 ASN H . . 3.540 3.097 2.939 3.214 . 0 0 "[ . 1 . 2]" 1
392 1 51 GLU HA 1 51 GLU HB3 . . 2.860 2.473 2.403 2.547 . 0 0 "[ . 1 . 2]" 1
393 1 52 ARG HA 1 52 ARG HB3 . . 2.470 2.380 2.354 2.403 . 0 0 "[ . 1 . 2]" 1
394 1 88 GLU HA 1 89 VAL H . . 3.320 2.211 2.172 2.256 . 0 0 "[ . 1 . 2]" 1
395 1 60 ILE MG 1 88 GLU HA . . 3.710 3.693 3.621 3.729 0.019 8 0 "[ . 1 . 2]" 1
396 1 76 LYS H 1 76 LYS HB2 . . 2.780 2.575 2.539 2.621 . 0 0 "[ . 1 . 2]" 1
397 1 86 THR MG 1 88 GLU HA . . 5.500 5.410 5.277 5.470 . 0 0 "[ . 1 . 2]" 1
398 1 88 GLU HA 1 98 ALA MB . . 5.500 4.348 4.141 4.583 . 0 0 "[ . 1 . 2]" 1
399 1 109 GLU HB2 1 110 HIS HD2 . . 4.720 3.067 2.567 4.299 . 0 0 "[ . 1 . 2]" 1
400 1 109 GLU HA 1 110 HIS HD2 . . 5.500 5.450 5.286 5.528 0.028 13 0 "[ . 1 . 2]" 1
401 1 109 GLU HA 1 109 GLU HG3 . . 3.810 3.665 3.553 3.751 . 0 0 "[ . 1 . 2]" 1
402 1 109 GLU HA 1 109 GLU HG2 . . 3.260 2.620 2.523 2.732 . 0 0 "[ . 1 . 2]" 1
403 1 109 GLU HB2 1 111 HIS H . . 4.670 4.723 4.651 4.782 0.112 13 0 "[ . 1 . 2]" 1
404 1 106 TRP HA 1 109 GLU HB2 . . 3.780 3.060 2.618 3.447 . 0 0 "[ . 1 . 2]" 1
405 1 40 LYS HA 1 70 THR HB . . 5.500 5.528 5.480 5.560 0.060 15 0 "[ . 1 . 2]" 1
406 1 70 THR HB 1 74 ILE MD . . 3.940 3.022 2.868 3.161 . 0 0 "[ . 1 . 2]" 1
407 1 70 THR HB 1 71 LEU MD1 . . 4.020 2.388 2.234 2.498 . 0 0 "[ . 1 . 2]" 1
408 1 38 THR H 1 39 THR MG . . 4.990 4.660 4.347 5.029 0.039 17 0 "[ . 1 . 2]" 1
409 1 39 THR MG 1 41 GLU H . . 4.190 4.218 4.182 4.249 0.059 10 0 "[ . 1 . 2]" 1
410 1 39 THR H 1 39 THR MG . . 3.580 3.455 3.233 3.606 0.026 14 0 "[ . 1 . 2]" 1
411 1 39 THR HA 1 39 THR MG . . 2.770 2.310 2.180 2.444 . 0 0 "[ . 1 . 2]" 1
412 1 16 THR MG 1 19 ASP HB3 . . 4.500 2.994 2.573 3.435 . 0 0 "[ . 1 . 2]" 1
413 1 16 THR MG 1 19 ASP HB2 . . 4.500 3.590 3.134 4.145 . 0 0 "[ . 1 . 2]" 1
414 1 39 THR MG 1 41 GLU HG3 . . 4.920 4.614 4.288 4.930 0.010 14 0 "[ . 1 . 2]" 1
415 1 16 THR MG 1 20 GLU HB3 . . 3.740 3.057 2.624 3.411 . 0 0 "[ . 1 . 2]" 1
416 1 36 THR HA 1 36 THR MG . . 3.170 2.537 2.500 2.581 . 0 0 "[ . 1 . 2]" 1
417 1 8 VAL HA 1 36 THR HA . . 4.600 4.630 4.611 4.655 0.055 4 0 "[ . 1 . 2]" 1
418 1 7 ILE HG12 1 36 THR HA . . 5.500 5.515 5.492 5.526 0.026 16 0 "[ . 1 . 2]" 1
419 1 35 ARG HG3 1 36 THR HA . . 5.500 5.533 5.516 5.556 0.056 7 0 "[ . 1 . 2]" 1
420 1 35 ARG HB2 1 36 THR HA . . 5.500 4.389 4.310 4.445 . 0 0 "[ . 1 . 2]" 1
421 1 35 ARG HG2 1 36 THR HA . . 5.500 4.297 4.238 4.389 . 0 0 "[ . 1 . 2]" 1
422 1 7 ILE HB 1 36 THR HA . . 3.660 3.057 2.996 3.131 . 0 0 "[ . 1 . 2]" 1
423 1 7 ILE MG 1 36 THR HB . . 3.780 3.791 3.762 3.808 0.028 5 0 "[ . 1 . 2]" 1
424 1 7 ILE HB 1 36 THR HB . . 3.950 3.341 3.221 3.403 . 0 0 "[ . 1 . 2]" 1
425 1 10 PRO HA 1 36 THR HB . . 4.890 4.587 4.046 4.902 0.012 17 0 "[ . 1 . 2]" 1
426 1 36 THR HB 1 37 VAL HA . . 5.270 4.598 4.521 4.691 . 0 0 "[ . 1 . 2]" 1
427 1 7 ILE H 1 36 THR HB . . 4.530 4.213 4.105 4.303 . 0 0 "[ . 1 . 2]" 1
428 1 7 ILE H 1 36 THR MG . . 3.790 3.413 3.308 3.535 . 0 0 "[ . 1 . 2]" 1
429 1 22 ALA H 1 36 THR MG . . 5.160 5.165 5.095 5.189 0.029 2 0 "[ . 1 . 2]" 1
430 1 38 THR MG 1 42 ASP H . . 4.510 4.423 4.075 4.564 0.054 6 0 "[ . 1 . 2]" 1
431 1 38 THR MG 1 43 ALA H . . 5.500 5.499 5.301 5.566 0.066 6 0 "[ . 1 . 2]" 1
432 1 7 ILE HB 1 36 THR MG . . 2.970 2.065 2.043 2.104 . 0 0 "[ . 1 . 2]" 1
433 1 38 THR H 1 38 THR MG . . 3.600 2.245 2.122 2.339 . 0 0 "[ . 1 . 2]" 1
434 1 37 VAL HA 1 38 THR HB . . 4.580 4.251 4.094 4.418 . 0 0 "[ . 1 . 2]" 1
435 1 38 THR HA 1 38 THR MG . . 3.230 3.239 3.220 3.251 0.021 4 0 "[ . 1 . 2]" 1
436 1 37 VAL HA 1 38 THR MG . . 3.660 3.596 3.450 3.695 0.035 15 0 "[ . 1 . 2]" 1
437 1 38 THR MG 1 42 ASP HB2 . . 4.640 3.360 3.039 3.635 . 0 0 "[ . 1 . 2]" 1
438 1 39 THR HB 1 41 GLU HB3 . . 4.680 4.495 4.304 4.698 0.018 10 0 "[ . 1 . 2]" 1
439 1 39 THR HB 1 41 GLU HG3 . . 4.870 3.934 3.795 4.084 . 0 0 "[ . 1 . 2]" 1
440 1 70 THR HA 1 70 THR MG . . 2.740 2.263 2.212 2.305 . 0 0 "[ . 1 . 2]" 1
441 1 70 THR MG 1 71 LEU H . . 4.010 3.944 3.837 3.999 . 0 0 "[ . 1 . 2]" 1
442 1 70 THR HA 1 74 ILE MD . . 4.560 4.424 4.276 4.579 0.019 12 0 "[ . 1 . 2]" 1
443 1 70 THR HA 1 71 LEU MD1 . . 5.500 4.556 4.496 4.629 . 0 0 "[ . 1 . 2]" 1
444 1 70 THR HA 1 71 LEU MD2 . . 5.500 4.718 4.566 4.932 . 0 0 "[ . 1 . 2]" 1
445 1 70 THR H 1 70 THR MG . . 4.070 3.665 3.614 3.808 . 0 0 "[ . 1 . 2]" 1
446 1 70 THR MG 1 74 ILE HA . . 4.820 4.728 4.576 4.839 0.019 6 0 "[ . 1 . 2]" 1
447 1 86 THR HB 1 87 ILE H . . 4.030 3.766 3.728 3.854 . 0 0 "[ . 1 . 2]" 1
448 1 86 THR HA 1 86 THR MG . . 3.340 2.269 2.210 2.315 . 0 0 "[ . 1 . 2]" 1
449 1 85 LYS H 1 86 THR HA . . 5.500 5.119 4.981 5.195 . 0 0 "[ . 1 . 2]" 1
450 1 86 THR HA 1 87 ILE HA . . 4.670 4.430 4.396 4.463 . 0 0 "[ . 1 . 2]" 1
451 1 58 VAL HB 1 86 THR HA . . 4.040 3.558 3.477 3.592 . 0 0 "[ . 1 . 2]" 1
452 1 86 THR HA 1 87 ILE HG12 . . 4.520 4.630 4.610 4.641 0.121 1 0 "[ . 1 . 2]" 1
453 1 60 ILE HG12 1 86 THR HB . . 4.670 4.449 4.405 4.510 . 0 0 "[ . 1 . 2]" 1
454 1 60 ILE HG13 1 86 THR HB . . 4.670 4.498 4.447 4.538 . 0 0 "[ . 1 . 2]" 1
455 1 80 ALA MB 1 86 THR HB . . 5.000 4.087 3.914 4.183 . 0 0 "[ . 1 . 2]" 1
456 1 76 LYS HB3 1 86 THR HB . . 4.640 4.552 4.419 4.634 . 0 0 "[ . 1 . 2]" 1
457 1 79 ILE HB 1 86 THR HB . . 5.070 4.429 4.339 4.518 . 0 0 "[ . 1 . 2]" 1
458 1 80 ALA HA 1 86 THR HB . . 4.880 4.884 4.761 4.913 0.033 6 0 "[ . 1 . 2]" 1
459 1 76 LYS H 1 86 THR HB . . 5.500 5.428 5.255 5.514 0.014 3 0 "[ . 1 . 2]" 1
460 1 86 THR MG 1 87 ILE H . . 3.550 2.761 2.670 2.788 . 0 0 "[ . 1 . 2]" 1
461 1 86 THR H 1 86 THR MG . . 4.010 3.895 3.816 3.942 . 0 0 "[ . 1 . 2]" 1
462 1 58 VAL H 1 86 THR MG . . 4.030 3.940 3.899 3.968 . 0 0 "[ . 1 . 2]" 1
463 1 60 ILE H 1 86 THR MG . . 4.640 3.796 3.585 4.079 . 0 0 "[ . 1 . 2]" 1
464 1 76 LYS H 1 86 THR MG . . 4.410 3.673 3.599 3.720 . 0 0 "[ . 1 . 2]" 1
465 1 78 ILE H 1 86 THR MG . . 5.500 5.530 5.506 5.546 0.046 12 0 "[ . 1 . 2]" 1
466 1 77 LYS H 1 86 THR MG . . 4.960 4.943 4.876 4.982 0.022 1 0 "[ . 1 . 2]" 1
467 1 58 VAL HA 1 86 THR MG . . 4.430 4.204 4.162 4.232 . 0 0 "[ . 1 . 2]" 1
468 1 86 THR MG 1 87 ILE HA . . 4.740 4.371 4.268 4.427 . 0 0 "[ . 1 . 2]" 1
469 1 76 LYS HA 1 86 THR MG . . 3.800 1.972 1.950 1.996 . 0 0 "[ . 1 . 2]" 1
470 1 58 VAL HB 1 86 THR MG . . 3.150 2.127 2.084 2.150 . 0 0 "[ . 1 . 2]" 1
471 1 63 PRO HB2 1 64 SER H . . 3.870 2.411 2.096 2.612 . 0 0 "[ . 1 . 2]" 1
472 1 10 PRO HA 1 18 LEU HB3 . . 5.500 4.727 4.502 4.934 . 0 0 "[ . 1 . 2]" 1
473 1 10 PRO HA 1 18 LEU HG . . 5.500 4.617 4.335 4.747 . 0 0 "[ . 1 . 2]" 1
474 1 27 GLU HA 1 30 PRO HD3 . . 4.600 4.266 4.074 4.559 . 0 0 "[ . 1 . 2]" 1
475 1 28 GLU HA 1 30 PRO HD3 . . 4.000 3.683 3.525 3.865 . 0 0 "[ . 1 . 2]" 1
476 1 63 PRO HB3 1 64 SER H . . 3.600 3.654 3.598 3.698 0.098 3 0 "[ . 1 . 2]" 1
477 1 30 PRO HG3 1 31 ASP H . . 4.470 4.492 4.463 4.520 0.050 13 0 "[ . 1 . 2]" 1
478 1 30 PRO HA 1 32 ALA H . . 4.460 3.852 3.699 3.948 . 0 0 "[ . 1 . 2]" 1
479 1 30 PRO HA 1 32 ALA MB . . 5.170 4.659 4.477 4.772 . 0 0 "[ . 1 . 2]" 1
480 1 30 PRO HA 1 34 ILE MD . . 5.500 5.516 5.502 5.536 0.036 20 0 "[ . 1 . 2]" 1
481 1 30 PRO HD2 1 31 ASP HB3 . . 5.490 4.890 4.527 5.520 0.030 5 0 "[ . 1 . 2]" 1
482 1 29 VAL HA 1 30 PRO HD3 . . 3.200 2.926 2.759 2.991 . 0 0 "[ . 1 . 2]" 1
483 1 29 VAL HA 1 30 PRO HD2 . . 3.130 2.002 1.978 2.027 . 0 0 "[ . 1 . 2]" 1
484 1 29 VAL HA 1 30 PRO HB2 . . 5.500 5.588 5.573 5.603 0.103 8 0 "[ . 1 . 2]" 1
485 1 29 VAL HA 1 30 PRO HG3 . . 4.770 4.653 4.587 4.682 . 0 0 "[ . 1 . 2]" 1
486 1 30 PRO HG2 1 32 ALA H . . 5.500 5.204 5.108 5.289 . 0 0 "[ . 1 . 2]" 1
487 1 63 PRO HA 1 91 THR H . . 5.380 3.416 3.073 4.084 . 0 0 "[ . 1 . 2]" 1
488 1 63 PRO HA 1 91 THR MG . . 3.970 2.932 2.204 3.844 . 0 0 "[ . 1 . 2]" 1
489 1 63 PRO HD2 1 90 THR MG . . 4.990 4.842 4.486 5.034 0.044 4 0 "[ . 1 . 2]" 1
490 1 13 ALA MB 1 63 PRO HD2 . . 4.340 3.941 3.637 4.337 . 0 0 "[ . 1 . 2]" 1
491 1 62 GLY HA2 1 63 PRO HD2 . . 3.180 2.889 2.549 3.197 0.017 4 0 "[ . 1 . 2]" 1
492 1 62 GLY HA3 1 63 PRO HD2 . . 3.180 2.397 2.278 2.587 . 0 0 "[ . 1 . 2]" 1
493 1 63 PRO HD2 1 69 SER H . . 5.500 5.218 4.530 5.549 0.049 2 0 "[ . 1 . 2]" 1
494 1 63 PRO HB2 1 90 THR MG . . 4.990 5.027 4.787 5.064 0.074 16 0 "[ . 1 . 2]" 1
495 1 8 VAL HB 1 62 GLY HA3 . . 4.340 3.764 3.437 4.342 0.002 8 0 "[ . 1 . 2]" 1
496 1 8 VAL H 1 8 VAL HB . . 3.480 2.568 2.475 2.732 . 0 0 "[ . 1 . 2]" 1
497 1 8 VAL HB 1 63 PRO HD2 . . 4.360 3.771 2.960 4.292 . 0 0 "[ . 1 . 2]" 1
498 1 7 ILE MG 1 61 VAL HB . . 2.820 2.275 2.179 2.347 . 0 0 "[ . 1 . 2]" 1
499 1 29 VAL HA 1 30 PRO HG2 . . 4.190 4.152 4.122 4.189 . 0 0 "[ . 1 . 2]" 1
500 1 29 VAL HA 1 29 VAL MG1 . . 3.250 2.335 2.306 2.360 . 0 0 "[ . 1 . 2]" 1
501 1 25 ALA MB 1 29 VAL HB . . 5.480 5.187 5.096 5.252 . 0 0 "[ . 1 . 2]" 1
502 1 29 VAL HB 1 30 PRO HD3 . . 5.050 5.028 4.914 5.063 0.013 1 0 "[ . 1 . 2]" 1
503 1 29 VAL HB 1 30 PRO HD2 . . 4.850 4.203 4.099 4.256 . 0 0 "[ . 1 . 2]" 1
504 1 26 LYS HA 1 29 VAL HB . . 5.030 4.973 4.866 5.035 0.005 9 0 "[ . 1 . 2]" 1
505 1 29 VAL HB 1 32 ALA HA . . 4.910 4.522 4.370 4.626 . 0 0 "[ . 1 . 2]" 1
506 1 29 VAL HA 1 29 VAL MG2 . . 3.250 3.258 3.251 3.263 0.013 14 0 "[ . 1 . 2]" 1
507 1 29 VAL MG2 1 30 PRO HD2 . . 4.580 4.657 4.648 4.670 0.090 8 0 "[ . 1 . 2]" 1
508 1 29 VAL MG1 1 32 ALA MB . . 3.500 3.314 3.222 3.414 . 0 0 "[ . 1 . 2]" 1
509 1 29 VAL MG1 1 30 PRO HD3 . . 4.610 4.544 4.417 4.583 . 0 0 "[ . 1 . 2]" 1
510 1 29 VAL MG1 1 30 PRO HD2 . . 4.580 3.936 3.891 3.974 . 0 0 "[ . 1 . 2]" 1
511 1 25 ALA HA 1 29 VAL MG1 . . 3.930 4.029 4.014 4.052 0.122 11 0 "[ . 1 . 2]" 1
512 1 28 GLU H 1 29 VAL MG1 . . 5.500 4.573 4.482 4.625 . 0 0 "[ . 1 . 2]" 1
513 1 29 VAL MG1 1 31 ASP H . . 4.930 4.589 4.484 4.703 . 0 0 "[ . 1 . 2]" 1
514 1 37 VAL HA 1 38 THR H . . 3.390 2.123 2.020 2.205 . 0 0 "[ . 1 . 2]" 1
515 1 37 VAL HB 1 38 THR H . . 4.640 2.936 2.779 3.214 . 0 0 "[ . 1 . 2]" 1
516 1 37 VAL HA 1 42 ASP H . . 5.050 5.136 5.101 5.164 0.114 19 0 "[ . 1 . 2]" 1
517 1 37 VAL HA 1 42 ASP HB2 . . 3.810 2.777 2.690 2.868 . 0 0 "[ . 1 . 2]" 1
518 1 37 VAL HA 1 37 VAL MG2 . . 3.090 3.045 3.008 3.079 . 0 0 "[ . 1 . 2]" 1
519 1 37 VAL HB 1 38 THR MG . . 4.960 4.710 4.609 4.852 . 0 0 "[ . 1 . 2]" 1
520 1 37 VAL HB 1 42 ASP HB3 . . 4.440 2.123 2.048 2.230 . 0 0 "[ . 1 . 2]" 1
521 1 37 VAL HB 1 42 ASP HB2 . . 4.560 2.312 2.217 2.397 . 0 0 "[ . 1 . 2]" 1
522 1 36 THR HA 1 37 VAL HB . . 5.420 5.426 5.339 5.477 0.057 1 0 "[ . 1 . 2]" 1
523 1 37 VAL HB 1 42 ASP H . . 5.420 4.278 4.158 4.450 . 0 0 "[ . 1 . 2]" 1
524 1 37 VAL MG1 1 38 THR H . . 4.490 4.170 4.094 4.350 . 0 0 "[ . 1 . 2]" 1
525 1 37 VAL HA 1 37 VAL MG1 . . 3.090 2.858 2.780 2.970 . 0 0 "[ . 1 . 2]" 1
526 1 37 VAL MG1 1 43 ALA HA . . 3.110 2.076 1.987 2.169 . 0 0 "[ . 1 . 2]" 1
527 1 37 VAL MG1 1 42 ASP HB2 . . 3.840 3.917 3.864 3.939 0.099 19 0 "[ . 1 . 2]" 1
528 1 37 VAL MG1 1 42 ASP HB3 . . 3.510 3.273 3.012 3.551 0.041 17 0 "[ . 1 . 2]" 1
529 1 46 VAL H 1 46 VAL MG2 . . 3.520 2.387 2.297 2.549 . 0 0 "[ . 1 . 2]" 1
530 1 46 VAL H 1 46 VAL MG1 . . 3.520 2.422 2.175 3.606 0.086 3 0 "[ . 1 . 2]" 1
531 1 46 VAL HA 1 46 VAL MG2 . . 3.210 3.097 2.198 3.264 0.054 8 0 "[ . 1 . 2]" 1
532 1 46 VAL HA 1 50 ALA H . . 4.700 4.146 4.061 4.213 . 0 0 "[ . 1 . 2]" 1
533 1 46 VAL HA 1 49 GLU H . . 3.860 3.685 3.600 3.751 . 0 0 "[ . 1 . 2]" 1
534 1 35 ARG HD2 1 46 VAL HA . . 5.500 5.578 5.534 5.658 0.158 1 0 "[ . 1 . 2]" 1
535 1 46 VAL HA 1 49 GLU HB2 . . 3.520 3.025 2.756 3.294 . 0 0 "[ . 1 . 2]" 1
536 1 35 ARG HB2 1 46 VAL HA . . 5.500 5.266 5.168 5.323 . 0 0 "[ . 1 . 2]" 1
537 1 46 VAL HA 1 47 ALA MB . . 5.500 4.972 4.947 5.002 . 0 0 "[ . 1 . 2]" 1
538 1 35 ARG HG3 1 46 VAL HA . . 4.350 3.459 3.424 3.509 . 0 0 "[ . 1 . 2]" 1
539 1 46 VAL HA 1 46 VAL MG1 . . 3.210 2.402 2.347 2.595 . 0 0 "[ . 1 . 2]" 1
540 1 35 ARG HG3 1 46 VAL HB . . 4.300 2.557 2.190 4.271 . 0 0 "[ . 1 . 2]" 1
541 1 35 ARG HE 1 46 VAL MG2 . . 5.120 4.163 3.744 5.202 0.082 16 0 "[ . 1 . 2]" 1
542 1 99 VAL MG2 1 100 ALA H . . 4.060 3.780 2.095 3.976 . 0 0 "[ . 1 . 2]" 1
543 1 35 ARG HD3 1 46 VAL MG2 . . 5.060 4.772 4.475 4.912 . 0 0 "[ . 1 . 2]" 1
544 1 75 VAL H 1 75 VAL MG1 . . 3.770 3.818 3.807 3.827 0.057 13 0 "[ . 1 . 2]" 1
545 1 58 VAL H 1 58 VAL MG2 . . 3.380 1.998 1.954 2.030 . 0 0 "[ . 1 . 2]" 1
546 1 4 ILE H 1 58 VAL HA . . 4.030 3.087 3.015 3.135 . 0 0 "[ . 1 . 2]" 1
547 1 58 VAL HA 1 86 THR HA . . 4.910 4.666 4.647 4.688 . 0 0 "[ . 1 . 2]" 1
548 1 5 VAL HA 1 58 VAL HA . . 4.320 4.305 4.171 4.360 0.040 19 0 "[ . 1 . 2]" 1
549 1 4 ILE HB 1 58 VAL HA . . 4.030 2.636 2.560 2.694 . 0 0 "[ . 1 . 2]" 1
550 1 55 ALA MB 1 58 VAL HA . . 4.160 3.840 3.808 3.863 . 0 0 "[ . 1 . 2]" 1
551 1 58 VAL HA 1 58 VAL MG1 . . 2.800 2.198 2.176 2.215 . 0 0 "[ . 1 . 2]" 1
552 1 58 VAL H 1 58 VAL HB . . 3.690 3.590 3.564 3.612 . 0 0 "[ . 1 . 2]" 1
553 1 58 VAL MG2 1 87 ILE H . . 3.950 3.748 3.723 3.776 . 0 0 "[ . 1 . 2]" 1
554 1 58 VAL MG2 1 85 LYS H . . 4.260 3.583 3.296 3.748 . 0 0 "[ . 1 . 2]" 1
555 1 57 ILE H 1 58 VAL MG2 . . 4.570 4.391 4.311 4.454 . 0 0 "[ . 1 . 2]" 1
556 1 58 VAL MG2 1 84 ALA H . . 4.930 4.833 4.728 4.930 . 0 0 "[ . 1 . 2]" 1
557 1 58 VAL MG2 1 86 THR HA . . 4.310 2.008 1.989 2.022 . 0 0 "[ . 1 . 2]" 1
558 1 58 VAL HA 1 58 VAL MG2 . . 3.290 3.166 3.155 3.177 . 0 0 "[ . 1 . 2]" 1
559 1 58 VAL MG2 1 79 ILE HG13 . . 2.950 2.957 2.906 2.969 0.019 15 0 "[ . 1 . 2]" 1
560 1 75 VAL H 1 75 VAL HB . . 3.450 2.507 2.475 2.540 . 0 0 "[ . 1 . 2]" 1
561 1 75 VAL H 1 75 VAL MG2 . . 3.770 2.180 2.136 2.225 . 0 0 "[ . 1 . 2]" 1
562 1 44 LYS HA 1 75 VAL HA . . 5.500 4.628 4.563 4.715 . 0 0 "[ . 1 . 2]" 1
563 1 75 VAL HA 1 78 ILE H . . 4.070 3.385 3.359 3.416 . 0 0 "[ . 1 . 2]" 1
564 1 75 VAL HA 1 78 ILE HB . . 3.560 2.836 2.783 2.873 . 0 0 "[ . 1 . 2]" 1
565 1 47 ALA MB 1 75 VAL HA . . 3.290 2.225 2.180 2.257 . 0 0 "[ . 1 . 2]" 1
566 1 75 VAL HA 1 78 ILE HG13 . . 4.220 3.076 3.054 3.102 . 0 0 "[ . 1 . 2]" 1
567 1 75 VAL HA 1 79 ILE HG12 . . 4.480 3.898 3.849 3.944 . 0 0 "[ . 1 . 2]" 1
568 1 75 VAL HA 1 75 VAL MG1 . . 3.140 2.523 2.501 2.542 . 0 0 "[ . 1 . 2]" 1
569 1 43 ALA MB 1 75 VAL HB . . 3.880 3.930 3.915 3.945 0.065 7 0 "[ . 1 . 2]" 1
570 1 75 VAL HA 1 75 VAL MG2 . . 3.140 2.434 2.394 2.464 . 0 0 "[ . 1 . 2]" 1
571 1 99 VAL HA 1 99 VAL MG2 . . 3.100 2.482 2.371 3.238 0.138 2 0 "[ . 1 . 2]" 1
572 1 98 ALA HA 1 99 VAL HA . . 5.190 4.808 4.672 4.871 . 0 0 "[ . 1 . 2]" 1
573 1 99 VAL HA 1 100 ALA HA . . 5.500 4.841 4.822 4.874 . 0 0 "[ . 1 . 2]" 1
574 1 99 VAL HA 1 99 VAL MG1 . . 3.100 2.543 2.149 2.654 . 0 0 "[ . 1 . 2]" 1
575 1 99 VAL H 1 99 VAL MG1 . . 3.780 3.720 2.387 3.827 0.047 9 0 "[ . 1 . 2]" 1
576 1 18 LEU HA 1 21 LEU H . . 3.670 3.699 3.677 3.713 0.043 20 0 "[ . 1 . 2]" 1
577 1 7 ILE HG12 1 18 LEU HA . . 3.850 2.753 2.591 2.958 . 0 0 "[ . 1 . 2]" 1
578 1 18 LEU HA 1 36 THR MG . . 4.110 4.107 3.994 4.157 0.047 13 0 "[ . 1 . 2]" 1
579 1 18 LEU HA 1 18 LEU HG . . 3.860 3.738 3.700 3.765 . 0 0 "[ . 1 . 2]" 1
580 1 18 LEU HG 1 36 THR MG . . 4.710 4.348 4.151 4.505 . 0 0 "[ . 1 . 2]" 1
581 1 18 LEU MD2 1 36 THR MG . . 2.850 2.657 2.341 2.863 0.013 1 0 "[ . 1 . 2]" 1
582 1 40 LYS H 1 71 LEU MD2 . . 5.170 4.895 4.613 5.181 0.011 4 0 "[ . 1 . 2]" 1
583 1 70 THR HB 1 71 LEU MD2 . . 4.020 3.561 3.342 4.025 0.005 8 0 "[ . 1 . 2]" 1
584 1 18 LEU MD1 1 36 THR MG . . 2.850 2.210 2.097 2.338 . 0 0 "[ . 1 . 2]" 1
585 1 21 LEU H 1 21 LEU MD2 . . 4.260 2.720 2.629 2.765 . 0 0 "[ . 1 . 2]" 1
586 1 21 LEU HA 1 21 LEU MD2 . . 3.020 2.153 2.126 2.202 . 0 0 "[ . 1 . 2]" 1
587 1 19 ASP H 1 21 LEU HG . . 5.500 5.544 5.525 5.572 0.072 12 0 "[ . 1 . 2]" 1
588 1 39 THR HA 1 71 LEU HA . . 5.500 5.315 5.024 5.500 0.000 16 0 "[ . 1 . 2]" 1
589 1 40 LYS HA 1 71 LEU HA . . 4.050 3.503 3.419 3.603 . 0 0 "[ . 1 . 2]" 1
590 1 70 THR MG 1 71 LEU HA . . 4.520 4.174 4.002 4.286 . 0 0 "[ . 1 . 2]" 1
591 1 21 LEU HA 1 21 LEU MD1 . . 3.020 2.515 2.354 2.630 . 0 0 "[ . 1 . 2]" 1
592 1 71 LEU HA 1 74 ILE MD . . 3.230 2.109 2.085 2.136 . 0 0 "[ . 1 . 2]" 1
593 1 7 ILE MD 1 21 LEU HB3 . . 4.130 3.031 2.831 3.145 . 0 0 "[ . 1 . 2]" 1
594 1 7 ILE MD 1 21 LEU HB2 . . 4.130 3.888 3.722 3.990 . 0 0 "[ . 1 . 2]" 1
595 1 7 ILE HG13 1 21 LEU HB3 . . 5.010 4.115 3.964 4.290 . 0 0 "[ . 1 . 2]" 1
596 1 7 ILE HG13 1 21 LEU HB2 . . 5.010 4.832 4.641 5.019 0.009 4 0 "[ . 1 . 2]" 1
597 1 21 LEU HB3 1 23 ARG H . . 5.380 5.295 5.237 5.337 . 0 0 "[ . 1 . 2]" 1
598 1 21 LEU HB2 1 23 ARG H . . 5.380 5.073 5.013 5.139 . 0 0 "[ . 1 . 2]" 1
599 1 21 LEU HA 1 21 LEU HG . . 3.830 3.704 3.678 3.725 . 0 0 "[ . 1 . 2]" 1
600 1 7 ILE HG12 1 21 LEU HG . . 4.000 3.455 3.201 3.645 . 0 0 "[ . 1 . 2]" 1
601 1 7 ILE HG13 1 21 LEU HG . . 4.930 4.392 4.112 4.671 . 0 0 "[ . 1 . 2]" 1
602 1 7 ILE MD 1 21 LEU HG . . 4.600 4.483 4.274 4.608 0.008 11 0 "[ . 1 . 2]" 1
603 1 10 PRO HA 1 18 LEU MD2 . . 3.780 2.014 1.876 2.167 . 0 0 "[ . 1 . 2]" 1
604 1 39 THR H 1 71 LEU HB3 . . 5.500 4.260 3.929 4.714 . 0 0 "[ . 1 . 2]" 1
605 1 71 LEU HB3 1 74 ILE H . . 5.500 5.299 5.035 5.398 . 0 0 "[ . 1 . 2]" 1
606 1 43 ALA HA 1 71 LEU HB3 . . 5.500 4.449 4.288 4.550 . 0 0 "[ . 1 . 2]" 1
607 1 71 LEU HB3 1 72 ALA HA . . 5.380 4.921 4.799 5.001 . 0 0 "[ . 1 . 2]" 1
608 1 4 ILE HB 1 55 ALA HA . . 5.290 4.616 4.575 4.670 . 0 0 "[ . 1 . 2]" 1
609 1 71 LEU HB2 1 72 ALA HA . . 5.500 4.273 4.100 4.394 . 0 0 "[ . 1 . 2]" 1
610 1 71 LEU HB3 1 72 ALA H . . 4.000 3.994 3.911 4.035 0.035 8 0 "[ . 1 . 2]" 1
611 1 37 VAL HA 1 71 LEU HB3 . . 5.500 5.592 5.565 5.631 0.131 18 0 "[ . 1 . 2]" 1
612 1 10 PRO HA 1 18 LEU HB2 . . 5.500 4.965 4.513 5.211 . 0 0 "[ . 1 . 2]" 1
613 1 2 ARG HA 1 2 ARG HG3 . . 3.820 2.283 2.215 2.361 . 0 0 "[ . 1 . 2]" 1
614 1 71 LEU H 1 71 LEU MD2 . . 3.840 1.762 1.680 1.926 . 0 0 "[ . 1 . 2]" 1
615 1 39 THR H 1 71 LEU MD2 . . 4.760 4.578 4.353 4.784 0.024 17 0 "[ . 1 . 2]" 1
616 1 39 THR HA 1 71 LEU MD2 . . 3.910 3.465 3.192 3.685 . 0 0 "[ . 1 . 2]" 1
617 1 39 THR HA 1 71 LEU MD1 . . 3.910 2.115 2.055 2.193 . 0 0 "[ . 1 . 2]" 1
618 1 38 THR H 1 71 LEU MD1 . . 5.500 5.366 5.282 5.505 0.005 15 0 "[ . 1 . 2]" 1
619 1 38 THR H 1 71 LEU MD2 . . 5.500 5.239 4.926 5.481 . 0 0 "[ . 1 . 2]" 1
620 1 108 LEU H 1 108 LEU HB2 . . 3.440 2.103 1.960 2.252 . 0 0 "[ . 1 . 2]" 1
621 1 107 SER H 1 108 LEU HA . . 5.140 5.186 5.164 5.204 0.064 17 0 "[ . 1 . 2]" 1
622 1 108 LEU HA 1 108 LEU MD2 . . 3.950 3.180 1.995 3.815 . 0 0 "[ . 1 . 2]" 1
623 1 108 LEU H 1 108 LEU MD2 . . 3.980 3.726 2.807 4.071 0.091 2 0 "[ . 1 . 2]" 1
624 1 108 LEU HA 1 110 HIS H . . 5.500 4.840 4.466 5.144 . 0 0 "[ . 1 . 2]" 1
625 1 108 LEU HA 1 108 LEU HG . . 3.610 2.903 2.503 3.657 0.047 5 0 "[ . 1 . 2]" 1
626 1 108 LEU HB3 1 109 GLU HG3 . . 4.790 4.738 4.414 4.861 0.071 9 0 "[ . 1 . 2]" 1
627 1 108 LEU HB2 1 109 GLU HG3 . . 4.790 4.714 4.539 4.823 0.033 5 0 "[ . 1 . 2]" 1
628 1 105 SER HA 1 108 LEU HB2 . . 4.180 2.323 2.207 2.591 . 0 0 "[ . 1 . 2]" 1
629 1 108 LEU HA 1 108 LEU MD1 . . 3.950 2.321 1.985 3.842 . 0 0 "[ . 1 . 2]" 1
630 1 4 ILE HB 1 6 VAL H . . 5.500 5.574 5.546 5.607 0.107 11 0 "[ . 1 . 2]" 1
631 1 47 ALA MB 1 79 ILE MD . . 2.950 2.278 2.230 2.339 . 0 0 "[ . 1 . 2]" 1
632 1 6 VAL H 1 7 ILE HG13 . . 5.500 4.678 4.564 4.879 . 0 0 "[ . 1 . 2]" 1
633 1 79 ILE MG 1 84 ALA H . . 4.420 3.203 3.069 3.271 . 0 0 "[ . 1 . 2]" 1
634 1 79 ILE MG 1 82 ALA H . . 4.110 3.913 3.847 3.961 . 0 0 "[ . 1 . 2]" 1
635 1 7 ILE MD 1 35 ARG HD2 . . 5.500 5.544 5.531 5.569 0.069 13 0 "[ . 1 . 2]" 1
636 1 34 ILE MD 1 35 ARG H . . 4.360 4.361 4.325 4.379 0.019 20 0 "[ . 1 . 2]" 1
637 1 34 ILE HA 1 35 ARG HB3 . . 4.880 4.831 4.779 4.898 0.018 12 0 "[ . 1 . 2]" 1
638 1 34 ILE HA 1 34 ILE HG12 . . 4.210 3.521 3.499 3.544 . 0 0 "[ . 1 . 2]" 1
639 1 34 ILE HA 1 34 ILE HG13 . . 4.140 3.956 3.940 3.972 . 0 0 "[ . 1 . 2]" 1
640 1 34 ILE HB 1 34 ILE MD . . 3.490 3.292 3.275 3.307 . 0 0 "[ . 1 . 2]" 1
641 1 34 ILE HB 1 35 ARG HD3 . . 5.500 5.540 5.514 5.575 0.075 11 0 "[ . 1 . 2]" 1
642 1 26 LYS HA 1 34 ILE HB . . 5.440 5.472 5.441 5.505 0.065 19 0 "[ . 1 . 2]" 1
643 1 22 ALA H 1 34 ILE HB . . 5.500 5.530 5.504 5.559 0.059 1 0 "[ . 1 . 2]" 1
644 1 5 VAL H 1 34 ILE HB . . 5.500 5.448 5.393 5.479 . 0 0 "[ . 1 . 2]" 1
645 1 5 VAL H 1 34 ILE HG12 . . 5.340 4.981 4.952 5.020 . 0 0 "[ . 1 . 2]" 1
646 1 5 VAL H 1 34 ILE HG13 . . 5.450 5.453 5.392 5.487 0.037 19 0 "[ . 1 . 2]" 1
647 1 33 GLU HA 1 34 ILE HG13 . . 5.280 5.308 5.196 5.366 0.086 1 0 "[ . 1 . 2]" 1
648 1 26 LYS HA 1 34 ILE HG13 . . 4.210 3.481 3.426 3.540 . 0 0 "[ . 1 . 2]" 1
649 1 47 ALA HA 1 79 ILE HG12 . . 4.620 3.491 3.411 3.538 . 0 0 "[ . 1 . 2]" 1
650 1 7 ILE MD 1 34 ILE MG . . 2.830 2.179 2.130 2.232 . 0 0 "[ . 1 . 2]" 1
651 1 87 ILE HG13 1 87 ILE MG . . 2.770 2.457 2.428 2.499 . 0 0 "[ . 1 . 2]" 1
652 1 5 VAL HB 1 34 ILE MG . . 2.820 2.044 2.022 2.064 . 0 0 "[ . 1 . 2]" 1
653 1 87 ILE HA 1 87 ILE MG . . 3.180 2.268 2.248 2.286 . 0 0 "[ . 1 . 2]" 1
654 1 59 VAL HA 1 87 ILE MG . . 4.630 4.683 4.666 4.698 0.068 4 0 "[ . 1 . 2]" 1
655 1 34 ILE HA 1 34 ILE MG . . 3.090 2.054 2.040 2.074 . 0 0 "[ . 1 . 2]" 1
656 1 26 LYS H 1 34 ILE MG . . 4.810 3.833 3.753 3.919 . 0 0 "[ . 1 . 2]" 1
657 1 87 ILE MG 1 101 LYS H . . 4.860 4.204 4.002 4.372 . 0 0 "[ . 1 . 2]" 1
658 1 22 ALA H 1 34 ILE MG . . 4.000 3.604 3.523 3.702 . 0 0 "[ . 1 . 2]" 1
659 1 6 VAL H 1 34 ILE MD . . 5.500 5.565 5.550 5.585 0.085 3 0 "[ . 1 . 2]" 1
660 1 5 VAL H 1 34 ILE MD . . 3.610 2.614 2.582 2.644 . 0 0 "[ . 1 . 2]" 1
661 1 26 LYS H 1 34 ILE MD . . 4.330 3.577 3.456 3.645 . 0 0 "[ . 1 . 2]" 1
662 1 34 ILE HA 1 34 ILE MD . . 3.140 2.557 2.533 2.601 . 0 0 "[ . 1 . 2]" 1
663 1 5 VAL HA 1 34 ILE MD . . 4.330 4.260 4.226 4.306 . 0 0 "[ . 1 . 2]" 1
664 1 32 ALA HA 1 34 ILE MD . . 4.300 4.322 4.301 4.355 0.055 14 0 "[ . 1 . 2]" 1
665 1 34 ILE MD 1 35 ARG HD2 . . 5.240 5.251 5.224 5.271 0.031 12 0 "[ . 1 . 2]" 1
666 1 5 VAL HB 1 34 ILE MD . . 2.740 2.167 2.095 2.206 . 0 0 "[ . 1 . 2]" 1
667 1 26 LYS HB2 1 34 ILE MD . . 3.750 3.767 3.751 3.785 0.035 14 0 "[ . 1 . 2]" 1
668 1 32 ALA MB 1 34 ILE MD . . 2.820 2.125 2.067 2.196 . 0 0 "[ . 1 . 2]" 1
669 1 34 ILE MD 1 34 ILE MG . . 2.610 2.295 2.259 2.322 . 0 0 "[ . 1 . 2]" 1
670 1 57 ILE HB 1 58 VAL H . . 4.570 3.977 3.914 4.049 . 0 0 "[ . 1 . 2]" 1
671 1 57 ILE HG12 1 58 VAL H . . 5.110 4.946 4.906 4.997 . 0 0 "[ . 1 . 2]" 1
672 1 3 VAL H 1 57 ILE HG13 . . 5.500 5.448 5.285 5.526 0.026 4 0 "[ . 1 . 2]" 1
673 1 57 ILE HB 1 57 ILE MD . . 3.470 2.493 2.449 2.548 . 0 0 "[ . 1 . 2]" 1
674 1 3 VAL HA 1 57 ILE HB . . 4.430 2.892 2.821 3.006 . 0 0 "[ . 1 . 2]" 1
675 1 57 ILE HG12 1 85 LYS H . . 5.230 4.784 4.665 4.946 . 0 0 "[ . 1 . 2]" 1
676 1 3 VAL HA 1 57 ILE HG13 . . 4.610 3.565 3.384 3.763 . 0 0 "[ . 1 . 2]" 1
677 1 57 ILE HA 1 57 ILE HG12 . . 4.030 2.905 2.852 2.963 . 0 0 "[ . 1 . 2]" 1
678 1 56 ASP HB2 1 57 ILE HG12 . . 4.820 4.700 4.146 4.814 . 0 0 "[ . 1 . 2]" 1
679 1 56 ASP HB2 1 57 ILE HG13 . . 4.770 3.944 3.230 4.022 . 0 0 "[ . 1 . 2]" 1
680 1 57 ILE HG12 1 57 ILE MG . . 3.280 2.510 2.470 2.560 . 0 0 "[ . 1 . 2]" 1
681 1 57 ILE H 1 57 ILE MG . . 4.120 3.999 3.971 4.040 . 0 0 "[ . 1 . 2]" 1
682 1 57 ILE H 1 57 ILE MD . . 4.280 4.126 4.059 4.263 . 0 0 "[ . 1 . 2]" 1
683 1 57 ILE MD 1 58 VAL H . . 5.300 5.318 5.299 5.336 0.036 9 0 "[ . 1 . 2]" 1
684 1 57 ILE MG 1 59 VAL H . . 4.190 3.933 3.793 4.046 . 0 0 "[ . 1 . 2]" 1
685 1 4 ILE H 1 57 ILE MG . . 4.800 4.589 4.505 4.699 . 0 0 "[ . 1 . 2]" 1
686 1 57 ILE MG 1 102 ALA H . . 4.970 4.985 4.869 5.015 0.045 13 0 "[ . 1 . 2]" 1
687 1 57 ILE MG 1 86 THR HA . . 4.550 4.315 4.271 4.381 . 0 0 "[ . 1 . 2]" 1
688 1 57 ILE HA 1 57 ILE MG . . 3.270 2.219 2.182 2.259 . 0 0 "[ . 1 . 2]" 1
689 1 57 ILE MG 1 106 TRP HB3 . . 4.280 4.075 3.954 4.212 . 0 0 "[ . 1 . 2]" 1
690 1 57 ILE MG 1 85 LYS HG3 . . 3.450 2.246 2.152 2.502 . 0 0 "[ . 1 . 2]" 1
691 1 57 ILE HG13 1 57 ILE MG . . 3.360 3.260 3.246 3.270 . 0 0 "[ . 1 . 2]" 1
692 1 57 ILE MD 1 106 TRP HD1 . . 4.740 3.275 3.070 3.524 . 0 0 "[ . 1 . 2]" 1
693 1 57 ILE MD 1 106 TRP HZ3 . . 4.950 4.915 4.809 4.980 0.030 12 0 "[ . 1 . 2]" 1
694 1 57 ILE MD 1 102 ALA HA . . 5.500 5.150 4.801 5.434 . 0 0 "[ . 1 . 2]" 1
695 1 57 ILE MD 1 107 SER HA . . 5.500 5.520 5.471 5.559 0.059 1 0 "[ . 1 . 2]" 1
696 1 57 ILE MD 1 106 TRP HB3 . . 3.890 2.447 2.349 2.538 . 0 0 "[ . 1 . 2]" 1
697 1 1 MET ME 1 57 ILE MD . . 3.320 2.201 2.040 2.740 . 0 0 "[ . 1 . 2]" 1
698 1 60 ILE H 1 60 ILE MD . . 3.640 3.439 3.346 3.629 . 0 0 "[ . 1 . 2]" 1
699 1 47 ALA MB 1 78 ILE HB . . 3.420 1.955 1.935 1.970 . 0 0 "[ . 1 . 2]" 1
700 1 59 VAL HA 1 60 ILE HB . . 4.850 4.811 4.675 4.852 0.002 11 0 "[ . 1 . 2]" 1
701 1 60 ILE HB 1 88 GLU HA . . 4.040 2.368 2.329 2.392 . 0 0 "[ . 1 . 2]" 1
702 1 60 ILE HB 1 88 GLU H . . 4.950 4.754 4.704 4.825 . 0 0 "[ . 1 . 2]" 1
703 1 60 ILE HG13 1 88 GLU HA . . 5.500 4.280 4.158 4.378 . 0 0 "[ . 1 . 2]" 1
704 1 60 ILE HG12 1 88 GLU HA . . 5.500 4.263 4.216 4.290 . 0 0 "[ . 1 . 2]" 1
705 1 60 ILE HA 1 60 ILE HG12 . . 4.210 3.346 3.330 3.363 . 0 0 "[ . 1 . 2]" 1
706 1 60 ILE HA 1 60 ILE HG13 . . 4.210 4.014 3.990 4.040 . 0 0 "[ . 1 . 2]" 1
707 1 60 ILE MD 1 86 THR MG . . 2.940 2.107 2.071 2.145 . 0 0 "[ . 1 . 2]" 1
708 1 58 VAL HB 1 60 ILE MD . . 2.860 2.853 2.756 2.893 0.033 4 0 "[ . 1 . 2]" 1
709 1 60 ILE MD 1 75 VAL HA . . 4.690 4.427 4.383 4.497 . 0 0 "[ . 1 . 2]" 1
710 1 60 ILE MD 1 86 THR HB . . 4.460 4.382 4.333 4.432 . 0 0 "[ . 1 . 2]" 1
711 1 60 ILE HA 1 60 ILE MD . . 3.570 2.649 2.547 2.759 . 0 0 "[ . 1 . 2]" 1
712 1 58 VAL HA 1 60 ILE MD . . 4.750 4.518 4.434 4.577 . 0 0 "[ . 1 . 2]" 1
713 1 60 ILE MD 1 88 GLU HA . . 5.110 5.134 5.119 5.149 0.039 20 0 "[ . 1 . 2]" 1
714 1 60 ILE MD 1 86 THR HA . . 4.630 4.505 4.420 4.566 . 0 0 "[ . 1 . 2]" 1
715 1 60 ILE MD 1 77 LYS H . . 5.440 5.504 5.487 5.523 0.083 7 0 "[ . 1 . 2]" 1
716 1 60 ILE MD 1 76 LYS H . . 3.920 3.287 3.254 3.332 . 0 0 "[ . 1 . 2]" 1
717 1 60 ILE MD 1 87 ILE H . . 4.310 4.268 4.225 4.324 0.014 20 0 "[ . 1 . 2]" 1
718 1 59 VAL H 1 60 ILE MD . . 5.040 4.797 4.722 4.842 . 0 0 "[ . 1 . 2]" 1
719 1 6 VAL H 1 60 ILE MD . . 4.720 3.509 3.418 3.564 . 0 0 "[ . 1 . 2]" 1
720 1 74 ILE H 1 74 ILE MG . . 3.880 3.805 3.787 3.826 . 0 0 "[ . 1 . 2]" 1
721 1 74 ILE MG 1 75 VAL H . . 3.760 3.158 3.112 3.237 . 0 0 "[ . 1 . 2]" 1
722 1 74 ILE HA 1 75 VAL HA . . 5.020 4.852 4.797 4.915 . 0 0 "[ . 1 . 2]" 1
723 1 74 ILE HA 1 74 ILE HG13 . . 3.400 2.754 2.690 2.798 . 0 0 "[ . 1 . 2]" 1
724 1 74 ILE HA 1 74 ILE HG12 . . 3.400 2.580 2.514 2.622 . 0 0 "[ . 1 . 2]" 1
725 1 74 ILE HA 1 74 ILE MG . . 3.050 2.551 2.530 2.589 . 0 0 "[ . 1 . 2]" 1
726 1 43 ALA MB 1 74 ILE HB . . 3.920 2.369 2.253 2.423 . 0 0 "[ . 1 . 2]" 1
727 1 74 ILE HB 1 75 VAL HA . . 5.060 4.686 4.645 4.738 . 0 0 "[ . 1 . 2]" 1
728 1 71 LEU HA 1 74 ILE HB . . 3.780 2.394 2.317 2.447 . 0 0 "[ . 1 . 2]" 1
729 1 74 ILE HG12 1 74 ILE MG . . 3.350 2.327 2.297 2.389 . 0 0 "[ . 1 . 2]" 1
730 1 74 ILE HG13 1 74 ILE MG . . 3.350 3.226 3.215 3.240 . 0 0 "[ . 1 . 2]" 1
731 1 74 ILE MG 1 75 VAL HA . . 3.810 3.445 3.374 3.529 . 0 0 "[ . 1 . 2]" 1
732 1 40 LYS HA 1 74 ILE MG . . 3.290 2.895 2.809 2.990 . 0 0 "[ . 1 . 2]" 1
733 1 71 LEU HA 1 74 ILE MG . . 3.740 3.743 3.726 3.761 0.021 14 0 "[ . 1 . 2]" 1
734 1 44 LYS H 1 74 ILE MG . . 3.910 3.298 3.166 3.417 . 0 0 "[ . 1 . 2]" 1
735 1 39 THR HA 1 74 ILE MD . . 4.850 4.924 4.906 4.952 0.102 14 0 "[ . 1 . 2]" 1
736 1 40 LYS HA 1 74 ILE MD . . 3.240 2.185 2.106 2.266 . 0 0 "[ . 1 . 2]" 1
737 1 74 ILE HB 1 74 ILE MD . . 3.140 2.390 2.369 2.406 . 0 0 "[ . 1 . 2]" 1
738 1 78 ILE HB 1 79 ILE H . . 3.910 2.908 2.867 2.945 . 0 0 "[ . 1 . 2]" 1
739 1 78 ILE H 1 78 ILE HG13 . . 4.010 2.603 2.561 2.645 . 0 0 "[ . 1 . 2]" 1
740 1 78 ILE HA 1 78 ILE HG13 . . 3.590 3.498 3.475 3.527 . 0 0 "[ . 1 . 2]" 1
741 1 75 VAL HA 1 78 ILE HG12 . . 4.620 4.663 4.650 4.680 0.060 10 0 "[ . 1 . 2]" 1
742 1 47 ALA H 1 78 ILE MD . . 4.330 4.293 4.173 4.348 0.018 14 0 "[ . 1 . 2]" 1
743 1 78 ILE H 1 78 ILE MD . . 4.050 4.043 4.014 4.071 0.021 20 0 "[ . 1 . 2]" 1
744 1 75 VAL HA 1 78 ILE HA . . 5.500 5.497 5.458 5.523 0.023 17 0 "[ . 1 . 2]" 1
745 1 78 ILE HA 1 78 ILE HG12 . . 3.170 2.364 2.343 2.400 . 0 0 "[ . 1 . 2]" 1
746 1 47 ALA MB 1 78 ILE HA . . 4.320 4.320 4.301 4.338 0.018 9 0 "[ . 1 . 2]" 1
747 1 78 ILE HB 1 79 ILE HG12 . . 4.500 3.158 3.082 3.213 . 0 0 "[ . 1 . 2]" 1
748 1 76 LYS H 1 78 ILE HB . . 5.500 5.523 5.510 5.537 0.037 1 0 "[ . 1 . 2]" 1
749 1 47 ALA MB 1 78 ILE MD . . 2.880 2.397 2.333 2.447 . 0 0 "[ . 1 . 2]" 1
750 1 48 GLU HB3 1 78 ILE MD . . 4.210 3.115 3.016 3.210 . 0 0 "[ . 1 . 2]" 1
751 1 75 VAL HA 1 78 ILE MD . . 4.190 4.132 4.081 4.194 0.004 1 0 "[ . 1 . 2]" 1
752 1 49 GLU H 1 78 ILE MD . . 5.500 5.546 5.525 5.566 0.066 10 0 "[ . 1 . 2]" 1
753 1 50 ALA H 1 78 ILE MG . . 5.260 5.233 5.153 5.291 0.031 7 0 "[ . 1 . 2]" 1
754 1 49 GLU H 1 78 ILE MG . . 4.790 4.770 4.688 4.816 0.026 18 0 "[ . 1 . 2]" 1
755 1 78 ILE MG 1 81 ARG H . . 5.370 5.204 5.039 5.299 . 0 0 "[ . 1 . 2]" 1
756 1 78 ILE MG 1 79 ILE HA . . 3.550 3.450 3.377 3.532 . 0 0 "[ . 1 . 2]" 1
757 1 75 VAL HA 1 78 ILE MG . . 4.460 4.275 4.225 4.314 . 0 0 "[ . 1 . 2]" 1
758 1 51 GLU HB3 1 78 ILE MG . . 4.360 3.501 3.342 3.745 . 0 0 "[ . 1 . 2]" 1
759 1 47 ALA MB 1 78 ILE MG . . 2.680 2.059 2.041 2.086 . 0 0 "[ . 1 . 2]" 1
760 1 78 ILE HG13 1 78 ILE MG . . 3.070 3.117 3.109 3.130 0.060 7 0 "[ . 1 . 2]" 1
761 1 79 ILE H 1 79 ILE HG13 . . 3.990 3.789 3.759 3.814 . 0 0 "[ . 1 . 2]" 1
762 1 78 ILE H 1 79 ILE HB . . 5.500 5.273 5.198 5.369 . 0 0 "[ . 1 . 2]" 1
763 1 79 ILE HB 1 82 ALA H . . 5.500 5.226 5.167 5.265 . 0 0 "[ . 1 . 2]" 1
764 1 79 ILE HA 1 81 ARG H . . 4.860 3.997 3.953 4.035 . 0 0 "[ . 1 . 2]" 1
765 1 79 ILE HA 1 82 ALA MB . . 3.120 2.029 2.001 2.077 . 0 0 "[ . 1 . 2]" 1
766 1 79 ILE HA 1 79 ILE HG12 . . 3.760 3.233 3.209 3.261 . 0 0 "[ . 1 . 2]" 1
767 1 79 ILE HA 1 84 ALA MB . . 4.450 4.259 4.177 4.307 . 0 0 "[ . 1 . 2]" 1
768 1 79 ILE HB 1 86 THR MG . . 4.020 2.561 2.497 2.677 . 0 0 "[ . 1 . 2]" 1
769 1 79 ILE HB 1 80 ALA HA . . 5.130 4.482 4.421 4.527 . 0 0 "[ . 1 . 2]" 1
770 1 79 ILE HB 1 81 ARG H . . 5.480 5.459 5.348 5.502 0.022 8 0 "[ . 1 . 2]" 1
771 1 79 ILE HA 1 79 ILE HG13 . . 3.850 3.768 3.756 3.783 . 0 0 "[ . 1 . 2]" 1
772 1 75 VAL HA 1 79 ILE HG13 . . 5.330 5.220 5.165 5.261 . 0 0 "[ . 1 . 2]" 1
773 1 34 ILE HG13 1 34 ILE MG . . 3.260 2.370 2.344 2.394 . 0 0 "[ . 1 . 2]" 1
774 1 79 ILE HA 1 79 ILE MG . . 3.080 2.219 2.192 2.246 . 0 0 "[ . 1 . 2]" 1
775 1 79 ILE HA 1 79 ILE MD . . 3.110 2.131 2.107 2.172 . 0 0 "[ . 1 . 2]" 1
776 1 4 ILE MD 1 33 GLU HB2 . . 2.950 2.209 2.157 2.279 . 0 0 "[ . 1 . 2]" 1
777 1 87 ILE HB 1 88 GLU H . . 3.700 2.312 2.255 2.366 . 0 0 "[ . 1 . 2]" 1
778 1 87 ILE H 1 87 ILE HG12 . . 3.930 2.837 2.790 2.863 . 0 0 "[ . 1 . 2]" 1
779 1 87 ILE MG 1 88 GLU H . . 3.410 3.333 3.297 3.372 . 0 0 "[ . 1 . 2]" 1
780 1 86 THR HA 1 87 ILE MG . . 4.460 3.875 3.816 3.934 . 0 0 "[ . 1 . 2]" 1
781 1 86 THR HA 1 87 ILE MD . . 4.790 2.673 2.608 2.754 . 0 0 "[ . 1 . 2]" 1
782 1 87 ILE HA 1 87 ILE MD . . 3.760 3.632 3.609 3.656 . 0 0 "[ . 1 . 2]" 1
783 1 87 ILE HA 1 88 GLU HA . . 4.530 4.451 4.393 4.479 . 0 0 "[ . 1 . 2]" 1
784 1 87 ILE HA 1 87 ILE HG12 . . 3.920 3.744 3.723 3.758 . 0 0 "[ . 1 . 2]" 1
785 1 59 VAL HA 1 87 ILE HB . . 4.450 4.486 4.465 4.513 0.063 8 0 "[ . 1 . 2]" 1
786 1 87 ILE HB 1 88 GLU HA . . 5.450 4.473 4.402 4.506 . 0 0 "[ . 1 . 2]" 1
787 1 60 ILE H 1 87 ILE HB . . 4.750 4.755 4.671 4.781 0.031 20 0 "[ . 1 . 2]" 1
788 1 60 ILE H 1 87 ILE HG12 . . 4.770 3.056 2.969 3.090 . 0 0 "[ . 1 . 2]" 1
789 1 87 ILE HG13 1 101 LYS H . . 5.500 5.404 5.263 5.509 0.009 1 0 "[ . 1 . 2]" 1
790 1 86 THR HA 1 87 ILE HG13 . . 5.500 5.438 5.407 5.489 . 0 0 "[ . 1 . 2]" 1
791 1 87 ILE HG12 1 88 GLU HA . . 5.500 4.435 4.342 4.504 . 0 0 "[ . 1 . 2]" 1
792 1 59 VAL HA 1 87 ILE HG12 . . 4.340 2.084 2.056 2.130 . 0 0 "[ . 1 . 2]" 1
793 1 59 VAL HA 1 87 ILE HG13 . . 4.530 3.508 3.442 3.596 . 0 0 "[ . 1 . 2]" 1
794 1 87 ILE MG 1 98 ALA HA . . 3.870 3.769 3.437 3.888 0.018 11 0 "[ . 1 . 2]" 1
795 1 60 ILE H 1 87 ILE MD . . 4.710 3.458 3.372 3.576 . 0 0 "[ . 1 . 2]" 1
796 1 85 LYS H 1 87 ILE MD . . 5.500 5.485 5.419 5.535 0.035 2 0 "[ . 1 . 2]" 1
797 1 87 ILE MD 1 104 GLY H . . 5.500 5.490 5.307 5.540 0.040 7 0 "[ . 1 . 2]" 1
798 1 87 ILE MD 1 102 ALA H . . 4.430 4.011 3.897 4.085 . 0 0 "[ . 1 . 2]" 1
799 1 87 ILE MD 1 88 GLU HA . . 5.410 5.440 5.416 5.454 0.044 7 0 "[ . 1 . 2]" 1
800 1 59 VAL HA 1 87 ILE MD . . 4.180 2.116 2.059 2.160 . 0 0 "[ . 1 . 2]" 1
801 1 87 ILE MD 1 99 VAL HA . . 4.670 4.230 3.893 4.510 . 0 0 "[ . 1 . 2]" 1
802 1 59 VAL HB 1 87 ILE MD . . 4.180 4.131 2.873 4.216 0.036 17 0 "[ . 1 . 2]" 1
803 1 87 ILE HB 1 87 ILE MD . . 3.220 3.252 3.241 3.261 0.041 10 0 "[ . 1 . 2]" 1
804 1 95 LEU HA 1 95 LEU MD2 . . 3.850 3.280 2.303 3.893 0.043 7 0 "[ . 1 . 2]" 1
805 1 2 ARG HA 1 56 ASP HB3 . . 5.420 5.258 4.912 5.594 0.174 12 0 "[ . 1 . 2]" 1
806 1 2 ARG HD3 1 55 ALA MB . . 4.400 4.003 3.782 4.163 . 0 0 "[ . 1 . 2]" 1
807 1 34 ILE H 1 35 ARG HA . . 5.470 5.382 5.337 5.417 . 0 0 "[ . 1 . 2]" 1
808 1 35 ARG HA 1 35 ARG HD2 . . 4.020 3.789 3.629 3.869 . 0 0 "[ . 1 . 2]" 1
809 1 35 ARG HA 1 35 ARG HD3 . . 4.120 4.231 4.209 4.259 0.139 14 0 "[ . 1 . 2]" 1
810 1 34 ILE HB 1 35 ARG HA . . 4.620 4.579 4.528 4.622 0.002 20 0 "[ . 1 . 2]" 1
811 1 35 ARG HA 1 36 THR MG . . 4.500 3.395 3.286 3.453 . 0 0 "[ . 1 . 2]" 1
812 1 4 ILE MG 1 35 ARG HD2 . . 4.550 3.803 3.657 4.000 . 0 0 "[ . 1 . 2]" 1
813 1 4 ILE MD 1 35 ARG HD2 . . 5.220 4.248 4.121 4.480 . 0 0 "[ . 1 . 2]" 1
814 1 35 ARG HD2 1 46 VAL MG1 . . 5.500 4.333 3.881 4.449 . 0 0 "[ . 1 . 2]" 1
815 1 35 ARG HD2 1 46 VAL MG2 . . 5.500 5.308 4.356 5.509 0.009 2 0 "[ . 1 . 2]" 1
816 1 4 ILE MG 1 35 ARG HD3 . . 3.750 2.687 2.647 2.753 . 0 0 "[ . 1 . 2]" 1
817 1 35 ARG HB3 1 35 ARG HD2 . . 4.230 2.171 2.113 2.201 . 0 0 "[ . 1 . 2]" 1
818 1 33 GLU HB3 1 35 ARG HD2 . . 4.910 3.425 3.155 3.731 . 0 0 "[ . 1 . 2]" 1
819 1 34 ILE HA 1 35 ARG HD2 . . 4.050 3.658 3.614 3.712 . 0 0 "[ . 1 . 2]" 1
820 1 34 ILE HA 1 35 ARG HD3 . . 3.630 3.082 3.028 3.113 . 0 0 "[ . 1 . 2]" 1
821 1 5 VAL H 1 35 ARG HD3 . . 5.310 3.718 3.628 3.794 . 0 0 "[ . 1 . 2]" 1
822 1 7 ILE H 1 35 ARG HB2 . . 5.500 5.330 5.257 5.381 . 0 0 "[ . 1 . 2]" 1
823 1 35 ARG HB3 1 46 VAL HA . . 5.500 5.587 5.561 5.604 0.104 7 0 "[ . 1 . 2]" 1
824 1 4 ILE HG13 1 55 ALA HA . . 3.810 3.280 3.178 3.374 . 0 0 "[ . 1 . 2]" 1
825 1 71 LEU HA 1 71 LEU HG . . 3.930 3.736 3.660 3.823 . 0 0 "[ . 1 . 2]" 1
826 1 71 LEU H 1 71 LEU HG . . 3.980 3.645 3.572 3.713 . 0 0 "[ . 1 . 2]" 1
827 1 4 ILE MD 1 53 ARG HG2 . . 3.730 3.301 3.082 3.510 . 0 0 "[ . 1 . 2]" 1
828 1 52 ARG H 1 52 ARG HB3 . . 3.770 3.740 3.699 3.776 0.006 15 0 "[ . 1 . 2]" 1
829 1 51 GLU HA 1 55 ALA MB . . 4.570 4.488 4.428 4.561 . 0 0 "[ . 1 . 2]" 1
830 1 53 ARG HG3 1 54 ASN H . . 4.490 4.008 3.558 4.380 . 0 0 "[ . 1 . 2]" 1
831 1 53 ARG HA 1 54 ASN HB3 . . 5.400 5.433 5.421 5.450 0.050 17 0 "[ . 1 . 2]" 1
832 1 53 ARG HA 1 54 ASN HB2 . . 4.690 3.774 3.737 3.876 . 0 0 "[ . 1 . 2]" 1
833 1 53 ARG HA 1 53 ARG HG2 . . 3.630 3.643 3.626 3.655 0.025 2 0 "[ . 1 . 2]" 1
834 1 81 ARG HA 1 82 ALA H . . 3.490 3.493 3.465 3.510 0.020 6 0 "[ . 1 . 2]" 1
835 1 80 ALA MB 1 81 ARG HA . . 4.050 4.071 4.061 4.080 0.030 2 0 "[ . 1 . 2]" 1
836 1 77 LYS HA 1 80 ALA H . . 3.530 3.507 3.409 3.567 0.037 1 0 "[ . 1 . 2]" 1
837 1 37 VAL HA 1 42 ASP HB3 . . 3.520 2.079 2.030 2.127 . 0 0 "[ . 1 . 2]" 1
838 1 44 LYS HB2 1 78 ILE MD . . 3.200 3.128 2.947 3.202 0.002 3 0 "[ . 1 . 2]" 1
839 1 68 LYS HD2 1 69 SER HA . . 5.150 4.263 2.521 5.210 0.060 1 0 "[ . 1 . 2]" 1
840 1 85 LYS HG2 1 86 THR H . . 5.500 4.996 4.864 5.073 . 0 0 "[ . 1 . 2]" 1
841 1 85 LYS H 1 85 LYS HG2 . . 3.360 2.050 1.915 2.255 . 0 0 "[ . 1 . 2]" 1
842 1 57 ILE HG12 1 85 LYS HG2 . . 4.000 3.549 3.393 3.736 . 0 0 "[ . 1 . 2]" 1
843 1 85 LYS HG2 1 106 TRP HD1 . . 5.360 2.976 2.799 3.106 . 0 0 "[ . 1 . 2]" 1
844 1 57 ILE HA 1 85 LYS HG2 . . 3.940 3.022 2.902 3.155 . 0 0 "[ . 1 . 2]" 1
845 1 26 LYS HA 1 31 ASP H . . 5.460 5.229 5.148 5.326 . 0 0 "[ . 1 . 2]" 1
846 1 26 LYS HA 1 34 ILE H . . 5.500 5.548 5.516 5.571 0.071 14 0 "[ . 1 . 2]" 1
847 1 26 LYS HA 1 30 PRO HA . . 4.670 3.269 3.208 3.388 . 0 0 "[ . 1 . 2]" 1
848 1 26 LYS HA 1 29 VAL HA . . 5.000 5.050 5.022 5.079 0.079 12 0 "[ . 1 . 2]" 1
849 1 26 LYS HA 1 30 PRO HD3 . . 5.380 4.801 4.705 4.966 . 0 0 "[ . 1 . 2]" 1
850 1 25 ALA MB 1 26 LYS HA . . 4.270 3.859 3.823 3.892 . 0 0 "[ . 1 . 2]" 1
851 1 26 LYS HA 1 34 ILE MD . . 3.390 3.334 3.208 3.404 0.014 3 0 "[ . 1 . 2]" 1
852 1 26 LYS HB2 1 34 ILE HG12 . . 3.330 2.782 2.706 2.877 . 0 0 "[ . 1 . 2]" 1
853 1 73 LYS HA 1 76 LYS HB3 . . 3.600 2.159 2.078 2.621 . 0 0 "[ . 1 . 2]" 1
854 1 58 VAL MG2 1 85 LYS HG3 . . 4.020 4.202 4.178 4.261 0.241 4 0 "[ . 1 . 2]" 1
855 1 40 LYS H 1 40 LYS HG2 . . 4.530 3.625 3.293 3.853 . 0 0 "[ . 1 . 2]" 1
856 1 44 LYS HA 1 48 GLU H . . 4.190 3.607 3.512 3.661 . 0 0 "[ . 1 . 2]" 1
857 1 39 THR HA 1 40 LYS HA . . 4.300 4.267 4.178 4.313 0.013 5 0 "[ . 1 . 2]" 1
858 1 40 LYS HA 1 43 ALA MB . . 2.860 2.541 2.459 2.650 . 0 0 "[ . 1 . 2]" 1
859 1 44 LYS HA 1 44 LYS HG3 . . 3.700 2.277 2.238 2.326 . 0 0 "[ . 1 . 2]" 1
860 1 44 LYS HA 1 78 ILE MD . . 2.970 2.053 1.995 2.089 . 0 0 "[ . 1 . 2]" 1
861 1 40 LYS HB2 1 41 GLU H . . 4.100 3.998 3.894 4.062 . 0 0 "[ . 1 . 2]" 1
862 1 44 LYS HG3 1 78 ILE MD . . 3.870 2.176 2.128 2.230 . 0 0 "[ . 1 . 2]" 1
863 1 38 THR MG 1 42 ASP HB3 . . 3.900 3.901 3.730 3.959 0.059 11 0 "[ . 1 . 2]" 1
864 1 37 VAL H 1 42 ASP HB3 . . 4.860 4.911 4.884 4.932 0.072 14 0 "[ . 1 . 2]" 1
865 1 44 LYS H 1 44 LYS HB2 . . 2.960 2.564 2.491 2.665 . 0 0 "[ . 1 . 2]" 1
866 1 44 LYS H 1 44 LYS HG2 . . 4.530 4.549 4.529 4.572 0.042 16 0 "[ . 1 . 2]" 1
867 1 85 LYS H 1 85 LYS HG3 . . 3.420 3.022 2.921 3.194 . 0 0 "[ . 1 . 2]" 1
868 1 57 ILE HA 1 85 LYS HG3 . . 4.210 2.786 2.619 3.119 . 0 0 "[ . 1 . 2]" 1
869 1 44 LYS HA 1 44 LYS HG2 . . 3.700 3.345 3.298 3.406 . 0 0 "[ . 1 . 2]" 1
870 1 44 LYS HG2 1 78 ILE MD . . 3.870 3.595 3.538 3.653 . 0 0 "[ . 1 . 2]" 1
871 1 44 LYS HA 1 47 ALA H . . 3.920 3.881 3.753 3.933 0.013 15 0 "[ . 1 . 2]" 1
872 1 44 LYS HA 1 48 GLU HB3 . . 4.160 4.177 4.121 4.213 0.053 17 0 "[ . 1 . 2]" 1
873 1 68 LYS HB2 1 69 SER H . . 4.800 4.265 3.164 4.563 . 0 0 "[ . 1 . 2]" 1
874 1 76 LYS HA 1 79 ILE H . . 4.410 3.457 3.374 3.591 . 0 0 "[ . 1 . 2]" 1
875 1 76 LYS HA 1 78 ILE H . . 4.910 4.464 4.372 4.579 . 0 0 "[ . 1 . 2]" 1
876 1 60 ILE MD 1 76 LYS HA . . 3.410 3.335 3.267 3.407 . 0 0 "[ . 1 . 2]" 1
877 1 76 LYS HA 1 79 ILE HB . . 3.610 3.334 3.261 3.465 . 0 0 "[ . 1 . 2]" 1
878 1 84 ALA MB 1 85 LYS HG2 . . 4.130 3.800 3.636 3.947 . 0 0 "[ . 1 . 2]" 1
879 1 85 LYS HA 1 85 LYS HG3 . . 3.840 3.716 3.677 3.737 . 0 0 "[ . 1 . 2]" 1
880 1 85 LYS HA 1 86 THR HA . . 4.700 4.391 4.358 4.416 . 0 0 "[ . 1 . 2]" 1
881 1 85 LYS HB3 1 106 TRP HD1 . . 4.860 4.702 4.582 4.877 0.017 15 0 "[ . 1 . 2]" 1
882 1 85 LYS HG3 1 106 TRP HD1 . . 5.360 3.918 3.771 4.030 . 0 0 "[ . 1 . 2]" 1
883 1 85 LYS HG3 1 86 THR HA . . 5.360 4.399 4.336 4.506 . 0 0 "[ . 1 . 2]" 1
884 1 90 THR H 1 90 THR MG . . 3.510 2.887 2.331 3.623 0.113 8 0 "[ . 1 . 2]" 1
885 1 9 GLY HA3 1 37 VAL H . . 5.500 4.425 4.128 4.764 . 0 0 "[ . 1 . 2]" 1
886 1 9 GLY HA2 1 37 VAL H . . 5.500 5.201 5.026 5.499 . 0 0 "[ . 1 . 2]" 1
887 1 9 GLY HA2 1 36 THR MG . . 5.500 4.784 4.225 5.156 . 0 0 "[ . 1 . 2]" 1
888 1 9 GLY HA3 1 36 THR MG . . 5.500 3.323 2.666 3.733 . 0 0 "[ . 1 . 2]" 1
889 1 16 THR HA 1 20 GLU H . . 5.500 4.065 3.919 4.184 . 0 0 "[ . 1 . 2]" 1
890 1 16 THR HA 1 20 GLU HB3 . . 5.500 5.357 5.090 5.518 0.018 8 0 "[ . 1 . 2]" 1
891 1 17 THR MG 1 19 ASP H . . 4.030 4.097 4.085 4.135 0.105 10 0 "[ . 1 . 2]" 1
892 1 17 THR MG 1 18 LEU H . . 4.560 2.038 1.920 2.889 . 0 0 "[ . 1 . 2]" 1
893 1 17 THR HA 1 17 THR MG . . 3.460 3.171 2.395 3.272 . 0 0 "[ . 1 . 2]" 1
894 1 10 PRO HA 1 36 THR MG . . 4.380 4.101 3.415 4.417 0.037 7 0 "[ . 1 . 2]" 1
895 1 4 ILE HB 1 58 VAL H . . 5.020 5.036 4.997 5.066 0.046 20 0 "[ . 1 . 2]" 1
896 1 95 LEU HA 1 95 LEU MD1 . . 3.850 3.356 2.196 3.941 0.091 13 0 "[ . 1 . 2]" 1
897 1 95 LEU HA 1 95 LEU HG . . 3.870 3.037 2.479 3.843 . 0 0 "[ . 1 . 2]" 1
898 1 1 MET HG2 1 57 ILE MD . . 3.710 3.174 2.796 3.716 0.006 10 0 "[ . 1 . 2]" 1
899 1 1 MET HB3 1 2 ARG H . . 5.500 4.081 3.681 4.583 . 0 0 "[ . 1 . 2]" 1
900 1 1 MET HB2 1 2 ARG H . . 5.500 3.313 2.205 4.760 . 0 0 "[ . 1 . 2]" 1
901 1 1 MET HB3 1 106 TRP HH2 . . 5.500 3.265 2.490 4.261 . 0 0 "[ . 1 . 2]" 1
902 1 1 MET HB2 1 106 TRP HH2 . . 5.500 3.659 2.394 4.504 . 0 0 "[ . 1 . 2]" 1
903 1 1 MET HB3 1 106 TRP HZ2 . . 5.500 3.406 2.448 4.997 . 0 0 "[ . 1 . 2]" 1
904 1 1 MET HB2 1 106 TRP HZ2 . . 5.500 3.070 2.614 3.372 . 0 0 "[ . 1 . 2]" 1
905 1 87 ILE MG 1 102 ALA MB . . 3.200 1.964 1.925 2.018 . 0 0 "[ . 1 . 2]" 1
906 1 54 ASN HB3 1 56 ASP H . . 5.500 4.633 4.372 4.710 . 0 0 "[ . 1 . 2]" 1
907 1 54 ASN HB2 1 56 ASP H . . 5.500 5.545 5.526 5.572 0.072 14 0 "[ . 1 . 2]" 1
908 1 56 ASP HB3 1 106 TRP HD1 . . 5.500 4.407 4.165 4.720 . 0 0 "[ . 1 . 2]" 1
909 1 56 ASP HB2 1 106 TRP HZ2 . . 5.500 4.870 4.408 5.154 . 0 0 "[ . 1 . 2]" 1
910 1 57 ILE MD 1 106 TRP HA . . 4.660 4.553 4.457 4.657 . 0 0 "[ . 1 . 2]" 1
911 1 88 GLU HA 1 89 VAL MG2 . . 4.740 4.146 3.941 4.445 . 0 0 "[ . 1 . 2]" 1
912 1 37 VAL MG2 1 43 ALA H . . 3.810 2.924 2.789 2.998 . 0 0 "[ . 1 . 2]" 1
913 1 37 VAL MG2 1 42 ASP HB2 . . 3.840 2.864 2.567 3.144 . 0 0 "[ . 1 . 2]" 1
914 1 37 VAL MG2 1 42 ASP HB3 . . 3.510 3.561 3.544 3.576 0.066 18 0 "[ . 1 . 2]" 1
915 1 89 VAL HA 1 98 ALA MB . . 3.720 2.064 1.976 2.161 . 0 0 "[ . 1 . 2]" 1
916 1 89 VAL HA 1 99 VAL H . . 4.310 4.306 4.065 4.385 0.075 2 0 "[ . 1 . 2]" 1
917 1 106 TRP H 1 109 GLU HG3 . . 4.000 4.019 3.923 4.049 0.049 13 0 "[ . 1 . 2]" 1
918 1 89 VAL H 1 89 VAL MG1 . . 3.610 2.217 2.001 2.502 . 0 0 "[ . 1 . 2]" 1
919 1 70 THR MG 1 74 ILE MD . . 2.660 2.403 2.205 2.555 . 0 0 "[ . 1 . 2]" 1
920 1 69 SER HA 1 70 THR HA . . 4.990 4.910 4.766 5.008 0.018 14 0 "[ . 1 . 2]" 1
921 1 22 ALA MB 1 34 ILE MG . . 2.560 2.324 2.256 2.403 . 0 0 "[ . 1 . 2]" 1
922 1 26 LYS HB2 1 34 ILE HG13 . . 3.580 2.497 2.450 2.543 . 0 0 "[ . 1 . 2]" 1
923 1 85 LYS HG2 1 86 THR HA . . 5.500 5.590 5.527 5.635 0.135 15 0 "[ . 1 . 2]" 1
924 1 4 ILE HG13 1 56 ASP H . . 5.500 5.271 5.093 5.345 . 0 0 "[ . 1 . 2]" 1
925 1 2 ARG HD2 1 55 ALA HA . . 4.610 2.710 2.485 3.012 . 0 0 "[ . 1 . 2]" 1
926 1 2 ARG HA 1 2 ARG HD2 . . 4.860 4.623 4.572 4.648 . 0 0 "[ . 1 . 2]" 1
927 1 2 ARG HA 1 2 ARG HD3 . . 4.860 4.625 4.507 4.718 . 0 0 "[ . 1 . 2]" 1
928 1 2 ARG HD3 1 3 VAL H . . 5.410 4.513 4.332 4.961 . 0 0 "[ . 1 . 2]" 1
929 1 64 SER H 1 90 THR MG . . 4.020 3.670 3.533 3.803 . 0 0 "[ . 1 . 2]" 1
930 1 2 ARG H 1 2 ARG HG3 . . 4.750 4.564 4.438 4.751 0.001 10 0 "[ . 1 . 2]" 1
931 1 58 VAL MG1 1 86 THR HA . . 4.570 4.582 4.542 4.596 0.026 19 0 "[ . 1 . 2]" 1
932 1 37 VAL MG2 1 38 THR H . . 4.490 2.758 2.642 2.928 . 0 0 "[ . 1 . 2]" 1
933 1 33 GLU H 1 34 ILE MD . . 3.880 3.301 3.197 3.441 . 0 0 "[ . 1 . 2]" 1
934 1 78 ILE HA 1 78 ILE MG . . 3.020 2.424 2.407 2.444 . 0 0 "[ . 1 . 2]" 1
935 1 39 THR HA 1 71 LEU HB3 . . 5.500 4.396 4.069 4.708 . 0 0 "[ . 1 . 2]" 1
936 1 2 ARG HB2 1 55 ALA HA . . 3.790 3.677 3.617 3.791 0.001 10 0 "[ . 1 . 2]" 1
937 1 2 ARG HB3 1 55 ALA HA . . 3.590 2.087 2.054 2.180 . 0 0 "[ . 1 . 2]" 1
938 1 2 ARG HA 1 55 ALA HA . . 4.920 4.617 4.569 4.743 . 0 0 "[ . 1 . 2]" 1
939 1 2 ARG HE 1 53 ARG HG3 . . 5.500 3.778 3.467 4.104 . 0 0 "[ . 1 . 2]" 1
940 1 10 PRO HA 1 18 LEU MD1 . . 3.780 3.506 2.783 3.818 0.038 18 0 "[ . 1 . 2]" 1
941 1 13 ALA MB 1 63 PRO HB2 . . 5.130 4.941 4.361 5.144 0.014 10 0 "[ . 1 . 2]" 1
942 1 23 ARG HA 1 23 ARG HG3 . . 2.940 2.715 2.603 2.820 . 0 0 "[ . 1 . 2]" 1
943 1 29 VAL MG2 1 30 PRO HD3 . . 4.610 4.645 4.631 4.654 0.044 12 0 "[ . 1 . 2]" 1
944 1 30 PRO HD2 1 31 ASP HB2 . . 5.490 4.303 3.962 4.568 . 0 0 "[ . 1 . 2]" 1
945 1 37 VAL HA 1 43 ALA H . . 4.850 4.710 4.608 4.775 . 0 0 "[ . 1 . 2]" 1
946 1 7 ILE MG 1 36 THR MG . . 3.140 3.150 3.105 3.164 0.024 2 0 "[ . 1 . 2]" 1
947 1 41 GLU HA 1 41 GLU HB2 . . 2.950 2.473 2.431 2.500 . 0 0 "[ . 1 . 2]" 1
948 1 41 GLU HA 1 41 GLU HG3 . . 3.840 3.827 3.777 3.865 0.025 20 0 "[ . 1 . 2]" 1
949 1 46 VAL H 1 46 VAL HB . . 3.940 3.438 2.175 3.679 . 0 0 "[ . 1 . 2]" 1
950 1 35 ARG HD3 1 46 VAL MG1 . . 5.060 4.315 3.380 4.555 . 0 0 "[ . 1 . 2]" 1
951 1 53 ARG H 1 53 ARG HG3 . . 3.650 3.620 3.406 3.681 0.031 14 0 "[ . 1 . 2]" 1
952 1 51 GLU HA 1 54 ASN HA . . 3.940 2.963 2.901 3.029 . 0 0 "[ . 1 . 2]" 1
953 1 57 ILE HG12 1 106 TRP HD1 . . 5.440 2.600 2.458 2.740 . 0 0 "[ . 1 . 2]" 1
954 1 57 ILE HG13 1 106 TRP HD1 . . 5.500 4.216 4.086 4.343 . 0 0 "[ . 1 . 2]" 1
955 1 56 ASP H 1 57 ILE HG13 . . 5.110 4.649 4.528 4.747 . 0 0 "[ . 1 . 2]" 1
956 1 56 ASP H 1 57 ILE HG12 . . 5.500 5.516 5.493 5.535 0.035 12 0 "[ . 1 . 2]" 1
957 1 57 ILE HA 1 57 ILE MD . . 4.120 3.997 3.942 4.024 . 0 0 "[ . 1 . 2]" 1
958 1 6 VAL H 1 60 ILE HB . . 5.500 5.609 5.589 5.660 0.160 7 0 "[ . 1 . 2]" 1
959 1 7 ILE HG13 1 61 VAL HB . . 4.210 2.128 2.093 2.162 . 0 0 "[ . 1 . 2]" 1
960 1 63 PRO HD2 1 64 SER H . . 4.410 3.104 2.612 3.676 . 0 0 "[ . 1 . 2]" 1
961 1 71 LEU HB2 1 73 LYS H . . 5.500 5.348 5.149 5.466 . 0 0 "[ . 1 . 2]" 1
962 1 71 LEU HB2 1 74 ILE H . . 5.500 5.455 5.278 5.535 0.035 14 0 "[ . 1 . 2]" 1
963 1 74 ILE H 1 75 VAL HB . . 5.080 4.926 4.864 5.074 . 0 0 "[ . 1 . 2]" 1
964 1 78 ILE HA 1 78 ILE MD . . 3.370 3.392 3.369 3.403 0.033 7 0 "[ . 1 . 2]" 1
965 1 79 ILE HB 1 79 ILE MD . . 3.300 3.285 3.279 3.292 . 0 0 "[ . 1 . 2]" 1
966 1 88 GLU HA 1 89 VAL MG1 . . 4.740 3.803 3.624 4.191 . 0 0 "[ . 1 . 2]" 1
967 1 96 ARG HA 1 99 VAL H . . 4.130 3.663 3.136 4.001 . 0 0 "[ . 1 . 2]" 1
968 1 40 LYS HA 1 42 ASP H . . 4.650 4.601 4.412 4.665 0.015 13 0 "[ . 1 . 2]" 1
969 1 99 VAL HA 1 100 ALA MB . . 5.100 5.055 5.027 5.076 . 0 0 "[ . 1 . 2]" 1
970 1 16 THR MG 1 17 THR HA . . 4.200 4.079 3.754 4.212 0.012 16 0 "[ . 1 . 2]" 1
971 1 14 GLY H 1 15 LYS H . . 5.500 4.210 2.251 4.403 . 0 0 "[ . 1 . 2]" 1
972 1 61 VAL H 1 61 VAL HB . . 3.650 2.687 2.622 2.735 . 0 0 "[ . 1 . 2]" 1
973 1 6 VAL HB 1 61 VAL H . . 3.880 3.870 3.778 3.904 0.024 10 0 "[ . 1 . 2]" 1
974 1 60 ILE HB 1 61 VAL H . . 4.440 3.880 3.790 4.217 . 0 0 "[ . 1 . 2]" 1
975 1 60 ILE MG 1 61 VAL H . . 3.120 2.555 2.435 3.125 0.005 7 0 "[ . 1 . 2]" 1
976 1 56 ASP HB3 1 106 TRP HE1 . . 4.420 3.105 2.871 3.440 . 0 0 "[ . 1 . 2]" 1
977 1 5 VAL H 1 5 VAL HB . . 3.400 2.901 2.694 2.943 . 0 0 "[ . 1 . 2]" 1
978 1 34 ILE HB 1 35 ARG H . . 4.170 4.065 4.026 4.097 . 0 0 "[ . 1 . 2]" 1
979 1 60 ILE H 1 60 ILE HB . . 3.360 2.625 2.548 2.674 . 0 0 "[ . 1 . 2]" 1
980 1 4 ILE HB 1 5 VAL H . . 4.130 4.086 4.045 4.115 . 0 0 "[ . 1 . 2]" 1
981 1 60 ILE H 1 60 ILE HG13 . . 3.770 3.541 3.501 3.630 . 0 0 "[ . 1 . 2]" 1
982 1 35 ARG H 1 35 ARG HG3 . . 4.210 4.245 4.225 4.259 0.049 17 0 "[ . 1 . 2]" 1
983 1 5 VAL H 1 25 ALA MB . . 5.250 5.172 5.028 5.259 0.009 8 0 "[ . 1 . 2]" 1
984 1 5 VAL H 1 32 ALA MB . . 4.120 3.969 3.878 4.086 . 0 0 "[ . 1 . 2]" 1
985 1 35 ARG H 1 36 THR MG . . 4.590 4.524 4.406 4.611 0.021 4 0 "[ . 1 . 2]" 1
986 1 4 ILE HG12 1 5 VAL H . . 4.290 3.734 3.689 3.827 . 0 0 "[ . 1 . 2]" 1
987 1 34 ILE MG 1 35 ARG H . . 3.180 2.721 2.660 2.793 . 0 0 "[ . 1 . 2]" 1
988 1 5 VAL H 1 34 ILE MG . . 3.780 3.685 3.612 3.770 . 0 0 "[ . 1 . 2]" 1
989 1 60 ILE H 1 60 ILE HG12 . . 3.770 2.176 2.121 2.340 . 0 0 "[ . 1 . 2]" 1
990 1 4 ILE MG 1 5 VAL H . . 2.810 2.378 2.334 2.453 . 0 0 "[ . 1 . 2]" 1
991 1 6 VAL H 1 6 VAL HB . . 3.420 2.701 2.592 2.760 . 0 0 "[ . 1 . 2]" 1
992 1 6 VAL HB 1 7 ILE H . . 3.900 3.952 3.935 3.972 0.072 5 0 "[ . 1 . 2]" 1
993 1 7 ILE H 1 35 ARG HG2 . . 4.350 4.127 4.038 4.232 . 0 0 "[ . 1 . 2]" 1
994 1 7 ILE H 1 7 ILE HG13 . . 4.170 3.696 3.661 3.760 . 0 0 "[ . 1 . 2]" 1
995 1 59 VAL H 1 59 VAL HB . . 3.560 2.443 2.347 2.599 . 0 0 "[ . 1 . 2]" 1
996 1 4 ILE HB 1 59 VAL H . . 4.260 4.187 4.084 4.272 0.012 19 0 "[ . 1 . 2]" 1
997 1 3 VAL HB 1 4 ILE H . . 4.150 4.101 4.057 4.152 0.002 3 0 "[ . 1 . 2]" 1
998 1 4 ILE H 1 4 ILE HB . . 3.750 2.668 2.631 2.701 . 0 0 "[ . 1 . 2]" 1
999 1 4 ILE H 1 4 ILE HG13 . . 4.190 3.487 3.440 3.538 . 0 0 "[ . 1 . 2]" 1
1000 1 4 ILE H 1 58 VAL MG1 . . 4.340 3.742 3.688 3.796 . 0 0 "[ . 1 . 2]" 1
1001 1 2 ARG HG2 1 3 VAL H . . 3.900 2.610 2.462 2.946 . 0 0 "[ . 1 . 2]" 1
1002 1 58 VAL H 1 85 LYS HG3 . . 4.280 3.570 3.481 3.820 . 0 0 "[ . 1 . 2]" 1
1003 1 57 ILE HG13 1 58 VAL H . . 5.500 5.358 5.323 5.401 . 0 0 "[ . 1 . 2]" 1
1004 1 58 VAL H 1 84 ALA MB . . 4.090 3.951 3.905 4.038 . 0 0 "[ . 1 . 2]" 1
1005 1 58 VAL H 1 87 ILE MD . . 4.060 3.227 3.186 3.272 . 0 0 "[ . 1 . 2]" 1
1006 1 88 GLU H 1 88 GLU HB3 . . 3.950 3.765 3.706 3.790 . 0 0 "[ . 1 . 2]" 1
1007 1 88 GLU H 1 88 GLU HB2 . . 3.950 2.642 2.578 2.689 . 0 0 "[ . 1 . 2]" 1
1008 1 87 ILE HG12 1 88 GLU H . . 4.220 3.880 3.833 3.936 . 0 0 "[ . 1 . 2]" 1
1009 1 87 ILE HG13 1 88 GLU H . . 4.510 4.453 4.369 4.518 0.008 8 0 "[ . 1 . 2]" 1
1010 1 34 ILE H 1 34 ILE HB . . 3.000 2.814 2.790 2.840 . 0 0 "[ . 1 . 2]" 1
1011 1 34 ILE H 1 34 ILE HG12 . . 3.390 2.124 2.102 2.144 . 0 0 "[ . 1 . 2]" 1
1012 1 34 ILE H 1 34 ILE HG13 . . 3.590 3.646 3.631 3.667 0.077 3 0 "[ . 1 . 2]" 1
1013 1 34 ILE H 1 34 ILE MG . . 3.820 3.838 3.831 3.846 0.026 15 0 "[ . 1 . 2]" 1
1014 1 34 ILE H 1 34 ILE MD . . 3.480 2.959 2.868 3.003 . 0 0 "[ . 1 . 2]" 1
1015 1 58 VAL HB 1 87 ILE H . . 4.470 4.355 4.304 4.404 . 0 0 "[ . 1 . 2]" 1
1016 1 87 ILE H 1 87 ILE HB . . 3.820 3.840 3.833 3.851 0.031 19 0 "[ . 1 . 2]" 1
1017 1 47 ALA H 1 78 ILE HB . . 4.920 4.940 4.890 4.958 0.038 7 0 "[ . 1 . 2]" 1
1018 1 47 ALA H 1 48 GLU HB3 . . 5.420 5.080 4.906 5.152 . 0 0 "[ . 1 . 2]" 1
1019 1 47 ALA H 1 49 GLU HB2 . . 5.500 5.197 5.018 5.450 . 0 0 "[ . 1 . 2]" 1
1020 1 46 VAL HB 1 47 ALA H . . 3.720 3.666 2.761 3.863 0.143 14 0 "[ . 1 . 2]" 1
1021 1 47 ALA H 1 79 ILE MD . . 4.600 4.581 4.502 4.615 0.015 12 0 "[ . 1 . 2]" 1
1022 1 47 ALA H 1 47 ALA MB . . 2.820 2.181 2.167 2.200 . 0 0 "[ . 1 . 2]" 1
1023 1 47 ALA H 1 50 ALA MB . . 4.990 4.678 4.619 4.783 . 0 0 "[ . 1 . 2]" 1
1024 1 85 LYS H 1 85 LYS HB3 . . 3.270 3.017 2.917 3.177 . 0 0 "[ . 1 . 2]" 1
1025 1 79 ILE MG 1 85 LYS H . . 4.800 4.307 4.027 4.503 . 0 0 "[ . 1 . 2]" 1
1026 1 57 ILE MG 1 85 LYS H . . 4.270 4.297 4.284 4.321 0.051 5 0 "[ . 1 . 2]" 1
1027 1 29 VAL HB 1 32 ALA H . . 4.020 3.070 2.901 3.266 . 0 0 "[ . 1 . 2]" 1
1028 1 80 ALA H 1 84 ALA MB . . 5.500 5.494 5.371 5.520 0.020 8 0 "[ . 1 . 2]" 1
1029 1 79 ILE HB 1 80 ALA H . . 3.410 3.183 3.118 3.242 . 0 0 "[ . 1 . 2]" 1
1030 1 80 ALA H 1 80 ALA MB . . 2.770 2.242 2.228 2.255 . 0 0 "[ . 1 . 2]" 1
1031 1 80 ALA H 1 86 THR MG . . 4.400 4.239 4.190 4.322 . 0 0 "[ . 1 . 2]" 1
1032 1 87 ILE MG 1 102 ALA H . . 3.590 2.970 2.822 3.142 . 0 0 "[ . 1 . 2]" 1
1033 1 99 VAL MG1 1 100 ALA H . . 4.060 3.271 3.019 4.102 0.042 14 0 "[ . 1 . 2]" 1
1034 1 99 VAL HB 1 100 ALA H . . 3.450 2.549 2.403 3.505 0.055 2 0 "[ . 1 . 2]" 1
1035 1 87 ILE HB 1 102 ALA H . . 4.880 4.941 4.919 4.960 0.080 10 0 "[ . 1 . 2]" 1
1036 1 108 LEU H 1 109 GLU HG3 . . 4.540 4.109 3.947 4.460 . 0 0 "[ . 1 . 2]" 1
1037 1 82 ALA MB 1 84 ALA H . . 3.810 3.383 3.104 3.425 . 0 0 "[ . 1 . 2]" 1
1038 1 108 LEU H 1 108 LEU HB3 . . 3.440 3.234 3.059 3.373 . 0 0 "[ . 1 . 2]" 1
1039 1 108 LEU H 1 108 LEU MD1 . . 3.980 3.494 3.025 4.161 0.181 5 0 "[ . 1 . 2]" 1
1040 1 108 LEU H 1 109 GLU HG2 . . 4.480 4.537 4.512 4.577 0.097 15 0 "[ . 1 . 2]" 1
1041 1 49 GLU H 1 49 GLU HB2 . . 2.980 2.442 2.377 2.524 . 0 0 "[ . 1 . 2]" 1
1042 1 49 GLU H 1 49 GLU HB3 . . 3.080 2.873 2.628 3.064 . 0 0 "[ . 1 . 2]" 1
1043 1 47 ALA MB 1 49 GLU H . . 4.190 4.205 4.179 4.227 0.037 16 0 "[ . 1 . 2]" 1
1044 1 49 GLU H 1 50 ALA MB . . 4.180 4.124 4.075 4.192 0.012 17 0 "[ . 1 . 2]" 1
1045 1 46 VAL MG2 1 49 GLU H . . 5.500 5.041 4.947 5.331 . 0 0 "[ . 1 . 2]" 1
1046 1 46 VAL MG1 1 49 GLU H . . 5.500 5.308 4.744 5.472 . 0 0 "[ . 1 . 2]" 1
1047 1 49 GLU H 1 79 ILE MD . . 4.590 4.689 4.672 4.716 0.126 6 0 "[ . 1 . 2]" 1
1048 1 49 GLU HB2 1 50 ALA H . . 3.410 3.470 3.414 3.572 0.162 7 0 "[ . 1 . 2]" 1
1049 1 49 GLU HB3 1 50 ALA H . . 3.380 2.397 2.267 2.480 . 0 0 "[ . 1 . 2]" 1
1050 1 40 LYS H 1 40 LYS HB2 . . 3.660 3.557 3.523 3.587 . 0 0 "[ . 1 . 2]" 1
1051 1 50 ALA H 1 53 ARG HG2 . . 5.230 4.929 4.738 5.152 . 0 0 "[ . 1 . 2]" 1
1052 1 47 ALA MB 1 50 ALA H . . 4.480 4.414 4.366 4.466 . 0 0 "[ . 1 . 2]" 1
1053 1 40 LYS H 1 40 LYS HG3 . . 4.530 3.207 2.054 3.973 . 0 0 "[ . 1 . 2]" 1
1054 1 22 ALA H 1 22 ALA MB . . 3.500 2.208 2.191 2.220 . 0 0 "[ . 1 . 2]" 1
1055 1 39 THR MG 1 40 LYS H . . 3.630 3.236 2.847 3.513 . 0 0 "[ . 1 . 2]" 1
1056 1 50 ALA H 1 50 ALA MB . . 2.980 2.212 2.182 2.261 . 0 0 "[ . 1 . 2]" 1
1057 1 50 ALA H 1 55 ALA MB . . 5.050 5.053 4.966 5.084 0.034 12 0 "[ . 1 . 2]" 1
1058 1 40 LYS H 1 74 ILE MD . . 4.380 3.858 3.808 3.901 . 0 0 "[ . 1 . 2]" 1
1059 1 37 VAL MG1 1 43 ALA H . . 3.810 3.735 3.664 3.830 0.020 16 0 "[ . 1 . 2]" 1
1060 1 40 LYS H 1 71 LEU MD1 . . 5.170 2.617 2.516 2.757 . 0 0 "[ . 1 . 2]" 1
1061 1 50 ALA H 1 79 ILE MD . . 3.730 3.642 3.581 3.706 . 0 0 "[ . 1 . 2]" 1
1062 1 20 GLU H 1 20 GLU HB3 . . 3.800 2.434 2.408 2.466 . 0 0 "[ . 1 . 2]" 1
1063 1 71 LEU H 1 74 ILE HB . . 5.010 4.942 4.884 4.986 . 0 0 "[ . 1 . 2]" 1
1064 1 37 VAL HB 1 43 ALA H . . 3.490 2.912 2.878 2.962 . 0 0 "[ . 1 . 2]" 1
1065 1 71 LEU H 1 71 LEU HB2 . . 3.440 2.819 2.640 3.005 . 0 0 "[ . 1 . 2]" 1
1066 1 71 LEU H 1 71 LEU HB3 . . 3.660 3.531 3.501 3.568 . 0 0 "[ . 1 . 2]" 1
1067 1 71 LEU H 1 74 ILE MD . . 3.860 3.699 3.540 3.785 . 0 0 "[ . 1 . 2]" 1
1068 1 71 LEU H 1 71 LEU MD1 . . 3.840 2.101 1.890 2.295 . 0 0 "[ . 1 . 2]" 1
1069 1 74 ILE H 1 74 ILE HB . . 3.050 2.426 2.391 2.466 . 0 0 "[ . 1 . 2]" 1
1070 1 74 ILE H 1 74 ILE HG13 . . 3.790 2.395 2.261 2.470 . 0 0 "[ . 1 . 2]" 1
1071 1 74 ILE H 1 74 ILE HG12 . . 3.790 3.739 3.597 3.802 0.012 3 0 "[ . 1 . 2]" 1
1072 1 74 ILE H 1 74 ILE MD . . 3.550 3.516 3.396 3.569 0.019 16 0 "[ . 1 . 2]" 1
1073 1 82 ALA H 1 82 ALA MB . . 2.730 2.227 2.209 2.249 . 0 0 "[ . 1 . 2]" 1
1074 1 82 ALA H 1 84 ALA MB . . 5.320 5.016 4.903 5.082 . 0 0 "[ . 1 . 2]" 1
1075 1 52 ARG H 1 53 ARG HG2 . . 4.010 3.856 3.548 4.023 0.013 7 0 "[ . 1 . 2]" 1
1076 1 79 ILE MD 1 82 ALA H . . 4.730 4.312 4.245 4.360 . 0 0 "[ . 1 . 2]" 1
1077 1 20 GLU HB3 1 21 LEU H . . 4.000 4.036 4.015 4.062 0.062 18 0 "[ . 1 . 2]" 1
1078 1 20 GLU HB2 1 21 LEU H . . 4.310 4.103 4.065 4.139 . 0 0 "[ . 1 . 2]" 1
1079 1 21 LEU H 1 21 LEU HG . . 3.770 3.792 3.732 3.823 0.053 10 0 "[ . 1 . 2]" 1
1080 1 21 LEU H 1 21 LEU HB2 . . 3.560 2.178 2.145 2.208 . 0 0 "[ . 1 . 2]" 1
1081 1 21 LEU H 1 21 LEU MD1 . . 4.260 4.275 4.193 4.302 0.042 4 0 "[ . 1 . 2]" 1
1082 1 41 GLU H 1 41 GLU HG3 . . 3.760 3.047 2.912 3.170 . 0 0 "[ . 1 . 2]" 1
1083 1 41 GLU H 1 41 GLU HG2 . . 3.620 1.919 1.812 2.061 . 0 0 "[ . 1 . 2]" 1
1084 1 41 GLU H 1 41 GLU HB3 . . 3.240 2.690 2.609 2.767 . 0 0 "[ . 1 . 2]" 1
1085 1 41 GLU H 1 41 GLU HB2 . . 3.650 3.620 3.566 3.657 0.007 12 0 "[ . 1 . 2]" 1
1086 1 40 LYS HB3 1 41 GLU H . . 4.100 4.023 3.912 4.151 0.051 15 0 "[ . 1 . 2]" 1
1087 1 41 GLU H 1 74 ILE MD . . 5.500 4.961 4.865 5.037 . 0 0 "[ . 1 . 2]" 1
1088 1 56 ASP H 1 56 ASP HB2 . . 4.080 2.080 1.998 2.186 . 0 0 "[ . 1 . 2]" 1
1089 1 52 ARG H 1 52 ARG HB2 . . 2.960 2.815 2.769 2.893 . 0 0 "[ . 1 . 2]" 1
1090 1 2 ARG HB3 1 56 ASP H . . 3.760 1.943 1.909 1.997 . 0 0 "[ . 1 . 2]" 1
1091 1 41 GLU HG3 1 42 ASP H . . 4.020 2.177 2.037 2.335 . 0 0 "[ . 1 . 2]" 1
1092 1 41 GLU HG2 1 42 ASP H . . 3.780 2.683 2.482 2.894 . 0 0 "[ . 1 . 2]" 1
1093 1 41 GLU HB3 1 42 ASP H . . 3.900 3.983 3.959 4.007 0.107 19 0 "[ . 1 . 2]" 1
1094 1 46 VAL H 1 47 ALA MB . . 4.530 4.448 4.399 4.531 0.001 16 0 "[ . 1 . 2]" 1
1095 1 71 LEU HB2 1 72 ALA H . . 3.550 2.840 2.775 2.924 . 0 0 "[ . 1 . 2]" 1
1096 1 70 THR MG 1 72 ALA H . . 5.110 5.120 5.019 5.139 0.029 14 0 "[ . 1 . 2]" 1
1097 1 72 ALA H 1 72 ALA MB . . 2.760 2.243 2.208 2.284 . 0 0 "[ . 1 . 2]" 1
1098 1 22 ALA MB 1 23 ARG H . . 4.110 2.587 2.530 2.656 . 0 0 "[ . 1 . 2]" 1
1099 1 85 LYS HB3 1 86 THR H . . 4.440 4.096 4.019 4.149 . 0 0 "[ . 1 . 2]" 1
1100 1 85 LYS HG3 1 86 THR H . . 4.530 4.316 4.118 4.417 . 0 0 "[ . 1 . 2]" 1
1101 1 32 ALA MB 1 33 GLU H . . 3.340 2.456 2.301 2.600 . 0 0 "[ . 1 . 2]" 1
1102 1 4 ILE MG 1 33 GLU H . . 3.880 3.925 3.903 3.938 0.058 6 0 "[ . 1 . 2]" 1
1103 1 4 ILE MD 1 33 GLU H . . 4.180 3.820 3.714 3.901 . 0 0 "[ . 1 . 2]" 1
1104 1 70 THR H 1 72 ALA MB . . 5.500 5.172 5.096 5.265 . 0 0 "[ . 1 . 2]" 1
1105 1 4 ILE HG12 1 33 GLU H . . 3.880 2.204 2.083 2.315 . 0 0 "[ . 1 . 2]" 1
1106 1 109 GLU H 1 109 GLU HG3 . . 3.540 2.660 2.369 3.173 . 0 0 "[ . 1 . 2]" 1
1107 1 109 GLU H 1 109 GLU HG2 . . 3.530 2.890 2.656 3.127 . 0 0 "[ . 1 . 2]" 1
1108 1 78 ILE H 1 78 ILE HB . . 3.020 2.510 2.485 2.545 . 0 0 "[ . 1 . 2]" 1
1109 1 78 ILE H 1 78 ILE HG12 . . 3.350 2.809 2.776 2.850 . 0 0 "[ . 1 . 2]" 1
1110 1 47 ALA MB 1 78 ILE H . . 3.890 3.855 3.818 3.890 . 0 0 "[ . 1 . 2]" 1
1111 1 78 ILE H 1 78 ILE MG . . 3.830 3.830 3.819 3.844 0.014 7 0 "[ . 1 . 2]" 1
1112 1 109 GLU H 1 109 GLU HB2 . . 2.840 2.598 2.439 2.751 . 0 0 "[ . 1 . 2]" 1
1113 1 47 ALA MB 1 79 ILE H . . 3.440 3.472 3.450 3.488 0.048 20 0 "[ . 1 . 2]" 1
1114 1 55 ALA H 1 55 ALA MB . . 2.950 2.162 2.134 2.190 . 0 0 "[ . 1 . 2]" 1
1115 1 79 ILE H 1 86 THR MG . . 4.790 4.016 3.930 4.083 . 0 0 "[ . 1 . 2]" 1
1116 1 78 ILE MG 1 79 ILE H . . 3.490 3.514 3.498 3.530 0.040 12 0 "[ . 1 . 2]" 1
1117 1 79 ILE H 1 79 ILE HB . . 3.080 2.632 2.583 2.664 . 0 0 "[ . 1 . 2]" 1
1118 1 79 ILE H 1 79 ILE HG12 . . 3.660 2.336 2.319 2.357 . 0 0 "[ . 1 . 2]" 1
1119 1 78 ILE HG13 1 79 ILE H . . 4.590 4.594 4.545 4.620 0.030 8 0 "[ . 1 . 2]" 1
1120 1 79 ILE H 1 79 ILE MD . . 3.490 3.302 3.268 3.342 . 0 0 "[ . 1 . 2]" 1
1121 1 74 ILE HB 1 75 VAL H . . 3.580 2.617 2.583 2.671 . 0 0 "[ . 1 . 2]" 1
1122 1 43 ALA MB 1 75 VAL H . . 3.920 2.574 2.506 2.641 . 0 0 "[ . 1 . 2]" 1
1123 1 29 VAL H 1 32 ALA MB . . 5.480 4.560 4.463 4.618 . 0 0 "[ . 1 . 2]" 1
1124 1 75 VAL HB 1 76 LYS H . . 3.420 2.455 2.413 2.502 . 0 0 "[ . 1 . 2]" 1
1125 1 102 ALA MB 1 103 ARG H . . 3.400 2.334 2.259 2.401 . 0 0 "[ . 1 . 2]" 1
1126 1 57 ILE MG 1 103 ARG H . . 4.260 3.581 3.428 3.710 . 0 0 "[ . 1 . 2]" 1
1127 1 60 ILE HB 1 89 VAL H . . 4.260 3.930 3.708 4.020 . 0 0 "[ . 1 . 2]" 1
1128 1 109 GLU HB2 1 110 HIS H . . 4.080 2.388 2.261 2.475 . 0 0 "[ . 1 . 2]" 1
1129 1 87 ILE MG 1 103 ARG H . . 4.560 3.986 3.749 4.168 . 0 0 "[ . 1 . 2]" 1
1130 1 89 VAL H 1 89 VAL MG2 . . 3.610 2.322 2.127 2.663 . 0 0 "[ . 1 . 2]" 1
1131 1 43 ALA MB 1 44 LYS H . . 3.050 2.552 2.511 2.626 . 0 0 "[ . 1 . 2]" 1
1132 1 80 ALA MB 1 81 ARG H . . 3.120 2.673 2.618 2.714 . 0 0 "[ . 1 . 2]" 1
1133 1 44 LYS H 1 44 LYS HG3 . . 4.530 4.431 4.399 4.455 . 0 0 "[ . 1 . 2]" 1
1134 1 44 LYS H 1 78 ILE MD . . 5.000 4.359 4.278 4.427 . 0 0 "[ . 1 . 2]" 1
1135 1 51 GLU H 1 79 ILE MD . . 3.960 2.970 2.831 3.191 . 0 0 "[ . 1 . 2]" 1
1136 1 48 GLU H 1 48 GLU HG2 . . 3.630 2.580 2.426 3.452 . 0 0 "[ . 1 . 2]" 1
1137 1 48 GLU H 1 48 GLU HB3 . . 3.060 2.391 2.346 2.424 . 0 0 "[ . 1 . 2]" 1
1138 1 51 GLU H 1 51 GLU HB3 . . 2.990 2.563 2.469 2.654 . 0 0 "[ . 1 . 2]" 1
1139 1 99 VAL H 1 99 VAL HB . . 3.420 2.563 2.407 3.639 0.219 2 0 "[ . 1 . 2]" 1
1140 1 51 GLU H 1 51 GLU HB2 . . 3.710 3.683 3.652 3.728 0.018 16 0 "[ . 1 . 2]" 1
1141 1 48 GLU H 1 78 ILE HB . . 4.580 4.632 4.610 4.653 0.073 7 0 "[ . 1 . 2]" 1
1142 1 47 ALA MB 1 48 GLU H . . 3.290 2.408 2.375 2.451 . 0 0 "[ . 1 . 2]" 1
1143 1 98 ALA MB 1 99 VAL H . . 3.460 2.413 2.284 2.529 . 0 0 "[ . 1 . 2]" 1
1144 1 50 ALA MB 1 51 GLU H . . 3.300 2.775 2.736 2.823 . 0 0 "[ . 1 . 2]" 1
1145 1 99 VAL H 1 99 VAL MG2 . . 3.780 2.309 2.046 2.384 . 0 0 "[ . 1 . 2]" 1
1146 1 48 GLU H 1 79 ILE MD . . 4.550 4.314 4.234 4.359 . 0 0 "[ . 1 . 2]" 1
1147 1 51 GLU H 1 55 ALA MB . . 4.970 4.969 4.932 5.022 0.052 6 0 "[ . 1 . 2]" 1
1148 1 17 THR H 1 17 THR MG . . 3.870 2.435 2.182 3.741 . 0 0 "[ . 1 . 2]" 1
1149 1 60 ILE MG 1 73 LYS H . . 4.920 4.730 4.638 4.868 . 0 0 "[ . 1 . 2]" 1
1150 1 72 ALA MB 1 73 LYS H . . 3.210 2.497 2.409 2.563 . 0 0 "[ . 1 . 2]" 1
1151 1 27 GLU H 1 27 GLU HG2 . . 4.480 3.793 2.780 4.510 0.030 9 0 "[ . 1 . 2]" 1
1152 1 27 GLU H 1 27 GLU HG3 . . 4.480 3.053 2.666 3.939 . 0 0 "[ . 1 . 2]" 1
1153 1 26 LYS H 1 26 LYS HB3 . . 3.760 2.784 2.750 2.853 . 0 0 "[ . 1 . 2]" 1
1154 1 26 LYS HB3 1 27 GLU H . . 4.100 3.013 2.964 3.083 . 0 0 "[ . 1 . 2]" 1
1155 1 53 ARG HB2 1 54 ASN H . . 4.140 4.200 4.170 4.217 0.077 3 0 "[ . 1 . 2]" 1
1156 1 53 ARG HG2 1 54 ASN H . . 3.840 2.749 2.652 2.852 . 0 0 "[ . 1 . 2]" 1
1157 1 26 LYS H 1 26 LYS HB2 . . 3.710 2.320 2.273 2.349 . 0 0 "[ . 1 . 2]" 1
1158 1 18 LEU HG 1 19 ASP H . . 4.080 2.607 2.451 2.818 . 0 0 "[ . 1 . 2]" 1
1159 1 53 ARG HB3 1 54 ASN H . . 4.890 4.306 4.241 4.409 . 0 0 "[ . 1 . 2]" 1
1160 1 26 LYS H 1 34 ILE HG12 . . 3.810 3.840 3.814 3.860 0.050 6 0 "[ . 1 . 2]" 1
1161 1 26 LYS H 1 34 ILE HG13 . . 4.550 2.495 2.464 2.526 . 0 0 "[ . 1 . 2]" 1
1162 1 35 ARG HB3 1 35 ARG HE . . 4.440 4.219 3.453 4.476 0.036 6 0 "[ . 1 . 2]" 1
1163 1 35 ARG HE 1 35 ARG HG2 . . 3.890 3.275 3.027 3.900 0.010 12 0 "[ . 1 . 2]" 1
1164 1 68 LYS HB3 1 69 SER H . . 4.800 4.150 2.254 4.516 . 0 0 "[ . 1 . 2]" 1
1165 1 35 ARG HE 1 46 VAL MG1 . . 5.120 3.725 1.978 4.255 . 0 0 "[ . 1 . 2]" 1
1166 1 56 ASP HB2 1 57 ILE H . . 3.500 3.462 2.929 3.522 0.022 16 0 "[ . 1 . 2]" 1
1167 1 57 ILE H 1 57 ILE HG12 . . 3.870 3.419 3.352 3.525 . 0 0 "[ . 1 . 2]" 1
1168 1 2 ARG HB3 1 57 ILE H . . 4.150 4.110 4.061 4.154 0.004 16 0 "[ . 1 . 2]" 1
1169 1 57 ILE H 1 57 ILE HB . . 3.430 3.063 3.017 3.120 . 0 0 "[ . 1 . 2]" 1
1170 1 57 ILE H 1 57 ILE HG13 . . 3.930 2.580 2.503 2.747 . 0 0 "[ . 1 . 2]" 1
1171 1 55 ALA MB 1 57 ILE H . . 3.490 3.501 3.339 3.536 0.046 7 0 "[ . 1 . 2]" 1
1172 1 15 LYS HB3 1 16 THR H . . 4.620 3.881 2.774 4.366 . 0 0 "[ . 1 . 2]" 1
1173 1 4 ILE MD 1 53 ARG H . . 5.050 4.966 4.810 5.065 0.015 17 0 "[ . 1 . 2]" 1
1174 1 52 ARG HB2 1 53 ARG H . . 3.150 2.612 2.475 2.851 . 0 0 "[ . 1 . 2]" 1
1175 1 53 ARG H 1 53 ARG HG2 . . 3.270 2.080 1.862 2.169 . 0 0 "[ . 1 . 2]" 1
1176 1 53 ARG H 1 53 ARG HB3 . . 3.260 2.892 2.783 3.059 . 0 0 "[ . 1 . 2]" 1
1177 1 16 THR H 1 16 THR MG . . 4.580 3.900 3.718 4.031 . 0 0 "[ . 1 . 2]" 1
1178 1 50 ALA MB 1 53 ARG H . . 4.760 4.733 4.682 4.776 0.016 12 0 "[ . 1 . 2]" 1
1179 1 30 PRO HB2 1 31 ASP H . . 3.920 3.885 3.831 3.936 0.016 9 0 "[ . 1 . 2]" 1
1180 1 29 VAL HB 1 31 ASP H . . 4.440 3.558 3.450 3.674 . 0 0 "[ . 1 . 2]" 1
1181 1 30 PRO HG2 1 31 ASP H . . 3.280 3.100 3.051 3.137 . 0 0 "[ . 1 . 2]" 1
1182 1 29 VAL MG2 1 31 ASP H . . 4.930 4.375 4.323 4.441 . 0 0 "[ . 1 . 2]" 1
1183 1 35 ARG HB3 1 36 THR H . . 4.550 3.541 3.437 3.599 . 0 0 "[ . 1 . 2]" 1
1184 1 36 THR H 1 36 THR MG . . 4.400 2.817 2.712 2.906 . 0 0 "[ . 1 . 2]" 1
1185 1 61 VAL HB 1 62 GLY H . . 4.430 4.184 4.058 4.420 . 0 0 "[ . 1 . 2]" 1
1186 1 62 GLY H 1 90 THR MG . . 4.400 3.906 3.386 4.344 . 0 0 "[ . 1 . 2]" 1
1187 1 60 ILE MG 1 62 GLY H . . 4.440 4.358 3.963 4.455 0.015 7 0 "[ . 1 . 2]" 1
1188 1 89 VAL HB 1 90 THR H . . 3.980 3.569 2.624 4.185 0.205 8 0 "[ . 1 . 2]" 1
1189 1 89 VAL MG1 1 90 THR H . . 4.310 4.214 4.013 4.338 0.028 20 0 "[ . 1 . 2]" 1
1190 1 89 VAL MG2 1 90 THR H . . 4.310 3.920 3.063 4.340 0.030 1 0 "[ . 1 . 2]" 1
1191 1 7 ILE MG 1 9 GLY H . . 4.900 4.085 3.941 4.194 . 0 0 "[ . 1 . 2]" 1
1192 1 37 VAL HB 1 39 THR H . . 4.050 3.673 3.435 4.045 . 0 0 "[ . 1 . 2]" 1
1193 1 39 THR H 1 71 LEU HG . . 4.280 3.306 3.058 3.632 . 0 0 "[ . 1 . 2]" 1
1194 1 38 THR MG 1 39 THR H . . 3.890 2.703 2.485 2.858 . 0 0 "[ . 1 . 2]" 1
1195 1 39 THR H 1 71 LEU MD1 . . 4.760 4.042 3.785 4.249 . 0 0 "[ . 1 . 2]" 1
1196 1 91 THR H 1 91 THR MG . . 4.080 2.336 2.041 2.544 . 0 0 "[ . 1 . 2]" 1
1197 1 100 ALA MB 1 104 GLY H . . 4.320 4.300 4.151 4.346 0.026 7 0 "[ . 1 . 2]" 1
1198 1 102 ALA MB 1 104 GLY H . . 4.110 4.166 4.136 4.184 0.074 4 0 "[ . 1 . 2]" 1
1199 1 82 ALA MB 1 83 GLY H . . 3.470 2.828 2.785 2.873 . 0 0 "[ . 1 . 2]" 1
1200 1 60 ILE HA 1 61 VAL H . . 3.340 2.245 2.148 2.273 . 0 0 "[ . 1 . 2]" 1
1201 1 7 ILE HA 1 61 VAL H . . 4.040 2.605 2.481 2.888 . 0 0 "[ . 1 . 2]" 1
1202 1 34 ILE HA 1 35 ARG H . . 3.070 2.126 2.104 2.148 . 0 0 "[ . 1 . 2]" 1
1203 1 4 ILE HA 1 5 VAL H . . 3.160 2.135 2.102 2.164 . 0 0 "[ . 1 . 2]" 1
1204 1 60 ILE H 1 88 GLU HA . . 3.850 3.403 3.219 3.506 . 0 0 "[ . 1 . 2]" 1
1205 1 6 VAL H 1 58 VAL HA . . 5.070 4.869 4.781 4.930 . 0 0 "[ . 1 . 2]" 1
1206 1 59 VAL HA 1 60 ILE H . . 3.170 2.215 2.150 2.249 . 0 0 "[ . 1 . 2]" 1
1207 1 5 VAL HA 1 6 VAL H . . 3.380 2.131 2.114 2.203 . 0 0 "[ . 1 . 2]" 1
1208 1 7 ILE H 1 36 THR HA . . 3.830 2.241 2.164 2.308 . 0 0 "[ . 1 . 2]" 1
1209 1 2 ARG H 1 56 ASP HA . . 4.750 4.621 4.347 4.799 0.049 4 0 "[ . 1 . 2]" 1
1210 1 58 VAL HA 1 59 VAL H . . 3.200 2.115 2.096 2.139 . 0 0 "[ . 1 . 2]" 1
1211 1 5 VAL HA 1 59 VAL H . . 3.860 3.157 3.047 3.214 . 0 0 "[ . 1 . 2]" 1
1212 1 3 VAL HA 1 4 ILE H . . 3.400 2.184 2.140 2.214 . 0 0 "[ . 1 . 2]" 1
1213 1 2 ARG HA 1 3 VAL H . . 2.880 2.148 2.078 2.246 . 0 0 "[ . 1 . 2]" 1
1214 1 58 VAL H 1 86 THR HA . . 4.120 2.949 2.886 3.008 . 0 0 "[ . 1 . 2]" 1
1215 1 57 ILE HA 1 58 VAL H . . 3.370 2.132 2.101 2.192 . 0 0 "[ . 1 . 2]" 1
1216 1 59 VAL HA 1 88 GLU H . . 5.500 5.499 5.454 5.550 0.050 7 0 "[ . 1 . 2]" 1
1217 1 87 ILE HA 1 88 GLU H . . 3.070 2.354 2.290 2.404 . 0 0 "[ . 1 . 2]" 1
1218 1 114 HIS HA 1 115 HIS H . . 3.540 2.813 2.115 3.557 0.017 5 0 "[ . 1 . 2]" 1
1219 1 33 GLU HA 1 34 ILE H . . 2.860 2.143 2.093 2.182 . 0 0 "[ . 1 . 2]" 1
1220 1 86 THR HA 1 87 ILE H . . 3.320 2.133 2.098 2.174 . 0 0 "[ . 1 . 2]" 1
1221 1 59 VAL HA 1 87 ILE H . . 4.070 3.049 2.866 3.111 . 0 0 "[ . 1 . 2]" 1
1222 1 45 ARG HA 1 47 ALA H . . 4.740 4.589 4.517 4.675 . 0 0 "[ . 1 . 2]" 1
1223 1 57 ILE HA 1 85 LYS H . . 4.250 3.270 3.153 3.380 . 0 0 "[ . 1 . 2]" 1
1224 1 84 ALA HA 1 85 LYS H . . 3.190 2.501 2.426 2.652 . 0 0 "[ . 1 . 2]" 1
1225 1 29 VAL HA 1 32 ALA H . . 4.400 4.026 3.953 4.152 . 0 0 "[ . 1 . 2]" 1
1226 1 76 LYS HA 1 80 ALA H . . 4.160 3.694 3.594 3.819 . 0 0 "[ . 1 . 2]" 1
1227 1 96 ARG HA 1 100 ALA H . . 4.430 3.903 3.772 4.085 . 0 0 "[ . 1 . 2]" 1
1228 1 99 VAL HA 1 102 ALA H . . 4.200 3.961 3.690 4.101 . 0 0 "[ . 1 . 2]" 1
1229 1 84 ALA H 1 85 LYS HA . . 5.040 5.041 4.960 5.084 0.044 4 0 "[ . 1 . 2]" 1
1230 1 105 SER HA 1 108 LEU H . . 3.730 3.468 3.342 3.676 . 0 0 "[ . 1 . 2]" 1
1231 1 107 SER HB2 1 108 LEU H . . 4.280 3.689 3.036 4.235 . 0 0 "[ . 1 . 2]" 1
1232 1 19 ASP HA 1 22 ALA H . . 4.410 3.580 3.443 3.662 . 0 0 "[ . 1 . 2]" 1
1233 1 39 THR HA 1 40 LYS H . . 3.450 2.395 2.350 2.437 . 0 0 "[ . 1 . 2]" 1
1234 1 39 THR HB 1 40 LYS H . . 3.560 2.284 2.176 2.399 . 0 0 "[ . 1 . 2]" 1
1235 1 18 LEU HA 1 22 ALA H . . 4.560 3.811 3.737 3.920 . 0 0 "[ . 1 . 2]" 1
1236 1 47 ALA HA 1 50 ALA H . . 3.790 3.062 2.989 3.169 . 0 0 "[ . 1 . 2]" 1
1237 1 42 ASP HB2 1 43 ALA H . . 3.720 2.671 2.436 2.820 . 0 0 "[ . 1 . 2]" 1
1238 1 42 ASP HB3 1 43 ALA H . . 3.740 3.542 3.518 3.596 . 0 0 "[ . 1 . 2]" 1
1239 1 70 THR HB 1 71 LEU H . . 3.650 2.702 2.564 2.785 . 0 0 "[ . 1 . 2]" 1
1240 1 41 GLU HA 1 43 ALA H . . 4.450 4.467 4.428 4.499 0.049 16 0 "[ . 1 . 2]" 1
1241 1 71 LEU HA 1 74 ILE H . . 3.700 3.335 3.081 3.456 . 0 0 "[ . 1 . 2]" 1
1242 1 79 ILE HA 1 82 ALA H . . 3.630 2.761 2.725 2.806 . 0 0 "[ . 1 . 2]" 1
1243 1 39 THR HA 1 41 GLU H . . 4.480 4.257 4.220 4.299 . 0 0 "[ . 1 . 2]" 1
1244 1 39 THR HB 1 41 GLU H . . 3.420 2.611 2.557 2.721 . 0 0 "[ . 1 . 2]" 1
1245 1 41 GLU H 1 42 ASP HA . . 5.340 5.228 5.131 5.280 . 0 0 "[ . 1 . 2]" 1
1246 1 19 ASP HA 1 21 LEU H . . 4.400 4.198 4.155 4.262 . 0 0 "[ . 1 . 2]" 1
1247 1 39 THR HB 1 42 ASP H . . 3.810 3.814 3.703 3.900 0.090 6 0 "[ . 1 . 2]" 1
1248 1 42 ASP HA 1 46 VAL H . . 4.550 3.667 3.570 3.751 . 0 0 "[ . 1 . 2]" 1
1249 1 42 ASP H 1 42 ASP HB2 . . 3.310 2.402 2.308 2.521 . 0 0 "[ . 1 . 2]" 1
1250 1 42 ASP H 1 42 ASP HB3 . . 3.600 3.557 3.524 3.585 . 0 0 "[ . 1 . 2]" 1
1251 1 69 SER HA 1 72 ALA H . . 4.440 3.805 3.562 3.966 . 0 0 "[ . 1 . 2]" 1
1252 1 70 THR HB 1 72 ALA H . . 4.990 5.032 5.005 5.050 0.060 4 0 "[ . 1 . 2]" 1
1253 1 4 ILE HA 1 33 GLU H . . 3.880 2.189 2.157 2.216 . 0 0 "[ . 1 . 2]" 1
1254 1 32 ALA HA 1 33 GLU H . . 3.110 2.454 2.366 2.554 . 0 0 "[ . 1 . 2]" 1
1255 1 85 LYS HA 1 86 THR H . . 3.250 1.993 1.945 2.023 . 0 0 "[ . 1 . 2]" 1
1256 1 86 THR H 1 86 THR HB . . 4.030 2.898 2.864 2.951 . 0 0 "[ . 1 . 2]" 1
1257 1 42 ASP HA 1 45 ARG H . . 3.750 3.309 3.187 3.501 . 0 0 "[ . 1 . 2]" 1
1258 1 105 SER HA 1 109 GLU H . . 4.300 4.301 4.190 4.339 0.039 13 0 "[ . 1 . 2]" 1
1259 1 106 TRP HA 1 109 GLU H . . 4.610 3.415 3.302 3.616 . 0 0 "[ . 1 . 2]" 1
1260 1 54 ASN HA 1 55 ALA H . . 3.140 2.384 2.339 2.406 . 0 0 "[ . 1 . 2]" 1
1261 1 108 LEU HA 1 109 GLU H . . 3.480 3.484 3.423 3.523 0.043 6 0 "[ . 1 . 2]" 1
1262 1 77 LYS HA 1 79 ILE H . . 4.500 4.410 4.370 4.472 . 0 0 "[ . 1 . 2]" 1
1263 1 2 ARG HD2 1 55 ALA H . . 5.170 3.588 3.448 3.750 . 0 0 "[ . 1 . 2]" 1
1264 1 54 ASN HB3 1 55 ALA H . . 4.270 4.315 4.298 4.329 0.059 8 0 "[ . 1 . 2]" 1
1265 1 75 VAL HA 1 79 ILE H . . 4.350 4.196 4.159 4.226 . 0 0 "[ . 1 . 2]" 1
1266 1 42 ASP HA 1 44 LYS H . . 4.360 4.387 4.359 4.408 0.048 15 0 "[ . 1 . 2]" 1
1267 1 99 VAL HA 1 103 ARG H . . 4.450 3.545 3.393 3.642 . 0 0 "[ . 1 . 2]" 1
1268 1 78 ILE HA 1 81 ARG H . . 4.430 4.305 4.142 4.462 0.032 2 0 "[ . 1 . 2]" 1
1269 1 77 LYS HA 1 81 ARG H . . 4.490 4.420 4.286 4.516 0.026 2 0 "[ . 1 . 2]" 1
1270 1 41 GLU HA 1 44 LYS H . . 3.640 3.287 3.152 3.384 . 0 0 "[ . 1 . 2]" 1
1271 1 42 ASP HB3 1 44 LYS H . . 5.500 5.564 5.537 5.583 0.083 3 0 "[ . 1 . 2]" 1
1272 1 74 ILE HA 1 77 LYS H . . 3.970 3.426 3.375 3.495 . 0 0 "[ . 1 . 2]" 1
1273 1 16 THR HB 1 17 THR H . . 3.970 3.056 2.728 3.522 . 0 0 "[ . 1 . 2]" 1
1274 1 73 LYS H 1 73 LYS HA . . 2.880 2.889 2.742 2.906 0.026 13 0 "[ . 1 . 2]" 1
1275 1 70 THR HB 1 73 LYS H . . 5.500 5.483 5.304 5.524 0.024 1 0 "[ . 1 . 2]" 1
1276 1 50 ALA HA 1 54 ASN H . . 4.470 4.166 3.994 4.371 . 0 0 "[ . 1 . 2]" 1
1277 1 54 ASN H 1 54 ASN HA . . 2.670 2.268 2.250 2.302 . 0 0 "[ . 1 . 2]" 1
1278 1 53 ARG HA 1 54 ASN H . . 3.360 3.293 3.252 3.351 . 0 0 "[ . 1 . 2]" 1
1279 1 34 ILE HA 1 35 ARG HE . . 5.500 5.497 5.396 5.531 0.031 11 0 "[ . 1 . 2]" 1
1280 1 3 VAL HA 1 57 ILE H . . 3.640 2.934 2.864 3.059 . 0 0 "[ . 1 . 2]" 1
1281 1 55 ALA HA 1 57 ILE H . . 4.000 3.660 3.532 3.737 . 0 0 "[ . 1 . 2]" 1
1282 1 106 TRP HB3 1 107 SER H . . 3.680 2.501 2.413 2.581 . 0 0 "[ . 1 . 2]" 1
1283 1 106 TRP HB2 1 107 SER H . . 3.790 3.759 3.690 3.805 0.015 4 0 "[ . 1 . 2]" 1
1284 1 53 ARG H 1 54 ASN HA . . 4.520 4.481 4.353 4.556 0.036 14 0 "[ . 1 . 2]" 1
1285 1 52 ARG HA 1 53 ARG H . . 3.540 3.483 3.436 3.531 . 0 0 "[ . 1 . 2]" 1
1286 1 50 ALA HA 1 53 ARG H . . 4.080 3.564 3.514 3.606 . 0 0 "[ . 1 . 2]" 1
1287 1 30 PRO HD2 1 31 ASP H . . 3.820 2.947 2.900 2.978 . 0 0 "[ . 1 . 2]" 1
1288 1 30 PRO HD3 1 31 ASP H . . 4.000 4.009 3.983 4.019 0.019 18 0 "[ . 1 . 2]" 1
1289 1 29 VAL HA 1 31 ASP H . . 4.030 3.112 3.031 3.270 . 0 0 "[ . 1 . 2]" 1
1290 1 62 GLY H 1 90 THR HA . . 4.210 3.016 2.601 3.396 . 0 0 "[ . 1 . 2]" 1
1291 1 61 VAL HA 1 62 GLY H . . 3.240 2.179 2.114 2.232 . 0 0 "[ . 1 . 2]" 1
1292 1 7 ILE HA 1 62 GLY H . . 5.290 5.289 5.203 5.342 0.052 4 0 "[ . 1 . 2]" 1
1293 1 62 GLY H 1 63 PRO HD2 . . 4.900 4.790 4.708 4.940 0.040 4 0 "[ . 1 . 2]" 1
1294 1 54 ASN HA 1 54 ASN HD21 . . 3.790 3.601 2.614 3.838 0.048 16 0 "[ . 1 . 2]" 1
1295 1 54 ASN HA 1 54 ASN HD22 . . 4.000 3.569 3.440 3.910 . 0 0 "[ . 1 . 2]" 1
1296 1 53 ARG HA 1 54 ASN HD21 . . 4.640 4.496 3.602 4.739 0.099 12 0 "[ . 1 . 2]" 1
1297 1 51 GLU HA 1 54 ASN HD21 . . 4.580 4.497 3.631 4.616 0.036 14 0 "[ . 1 . 2]" 1
1298 1 51 GLU HA 1 54 ASN HD22 . . 4.870 4.817 4.518 4.896 0.026 19 0 "[ . 1 . 2]" 1
1299 1 67 GLY H 1 68 LYS HA . . 5.380 5.150 4.677 5.477 0.097 4 0 "[ . 1 . 2]" 1
1300 1 39 THR H 1 39 THR HB . . 4.180 3.766 3.656 3.875 . 0 0 "[ . 1 . 2]" 1
1301 1 37 VAL HA 1 39 THR H . . 3.990 3.847 3.761 3.992 0.002 12 0 "[ . 1 . 2]" 1
1302 1 38 THR HB 1 39 THR H . . 4.240 4.234 4.107 4.305 0.065 5 0 "[ . 1 . 2]" 1
1303 1 39 THR H 1 42 ASP HB2 . . 3.440 2.180 2.108 2.286 . 0 0 "[ . 1 . 2]" 1
1304 1 39 THR H 1 42 ASP HB3 . . 3.970 3.746 3.694 3.814 . 0 0 "[ . 1 . 2]" 1
1305 1 104 GLY H 1 105 SER HA . . 5.420 5.090 5.015 5.218 . 0 0 "[ . 1 . 2]" 1
1306 1 104 GLY H 1 104 GLY HA3 . . 2.690 2.443 2.410 2.481 . 0 0 "[ . 1 . 2]" 1
1307 1 82 ALA HA 1 83 GLY H . . 3.560 3.451 3.431 3.473 . 0 0 "[ . 1 . 2]" 1
1308 1 2 ARG H 1 2 ARG HG2 . . 4.750 4.590 4.558 4.638 . 0 0 "[ . 1 . 2]" 1
1309 1 2 ARG H 1 56 ASP HB2 . . 5.110 1.984 1.758 2.268 . 0 0 "[ . 1 . 2]" 1
1310 1 2 ARG H 1 56 ASP HB3 . . 5.070 3.048 2.149 3.577 . 0 0 "[ . 1 . 2]" 1
1311 1 2 ARG H 1 56 ASP H . . 5.180 2.926 2.716 3.110 . 0 0 "[ . 1 . 2]" 1
1312 1 3 VAL H 1 33 GLU H . . 4.580 4.471 4.344 4.591 0.011 16 0 "[ . 1 . 2]" 1
1313 1 3 VAL H 1 57 ILE H . . 5.120 4.867 4.800 4.959 . 0 0 "[ . 1 . 2]" 1
1314 1 3 VAL H 1 4 ILE H . . 4.630 4.450 4.404 4.540 . 0 0 "[ . 1 . 2]" 1
1315 1 2 ARG H 1 3 VAL H . . 4.960 4.485 4.243 4.611 . 0 0 "[ . 1 . 2]" 1
1316 1 5 VAL H 1 33 GLU H . . 4.240 3.733 3.678 3.786 . 0 0 "[ . 1 . 2]" 1
1317 1 4 ILE H 1 5 VAL H . . 4.700 4.328 4.304 4.367 . 0 0 "[ . 1 . 2]" 1
1318 1 5 VAL H 1 35 ARG H . . 4.070 4.004 3.974 4.036 . 0 0 "[ . 1 . 2]" 1
1319 1 6 VAL H 1 59 VAL H . . 4.190 4.185 4.115 4.215 0.025 14 0 "[ . 1 . 2]" 1
1320 1 5 VAL H 1 6 VAL H . . 4.580 4.112 4.081 4.139 . 0 0 "[ . 1 . 2]" 1
1321 1 6 VAL H 1 61 VAL H . . 4.290 3.939 3.644 4.076 . 0 0 "[ . 1 . 2]" 1
1322 1 7 ILE H 1 8 VAL H . . 4.490 4.457 4.341 4.504 0.014 1 0 "[ . 1 . 2]" 1
1323 1 6 VAL H 1 7 ILE H . . 4.580 4.534 4.516 4.561 . 0 0 "[ . 1 . 2]" 1
1324 1 7 ILE H 1 35 ARG H . . 4.370 4.119 4.079 4.154 . 0 0 "[ . 1 . 2]" 1
1325 1 12 GLY H 1 13 ALA MB . . 5.080 4.637 4.251 5.100 0.020 16 0 "[ . 1 . 2]" 1
1326 1 12 GLY H 1 14 GLY H . . 5.500 3.681 2.382 4.942 . 0 0 "[ . 1 . 2]" 1
1327 1 18 LEU H 1 19 ASP H . . 3.910 2.716 2.614 2.772 . 0 0 "[ . 1 . 2]" 1
1328 1 21 LEU H 1 21 LEU HB3 . . 3.560 3.482 3.458 3.500 . 0 0 "[ . 1 . 2]" 1
1329 1 19 ASP HB2 1 21 LEU H . . 4.840 4.986 4.791 5.056 0.216 17 0 "[ . 1 . 2]" 1
1330 1 19 ASP H 1 21 LEU H . . 3.800 3.337 3.214 3.419 . 0 0 "[ . 1 . 2]" 1
1331 1 31 ASP H 1 31 ASP HB2 . . 3.420 2.456 2.264 2.642 . 0 0 "[ . 1 . 2]" 1
1332 1 31 ASP H 1 32 ALA H . . 3.060 2.197 2.082 2.299 . 0 0 "[ . 1 . 2]" 1
1333 1 30 PRO HD2 1 32 ALA H . . 4.770 4.706 4.579 4.786 0.016 14 0 "[ . 1 . 2]" 1
1334 1 34 ILE H 1 35 ARG H . . 4.390 4.430 4.408 4.454 0.064 4 0 "[ . 1 . 2]" 1
1335 1 5 VAL H 1 34 ILE H . . 4.750 4.587 4.513 4.620 . 0 0 "[ . 1 . 2]" 1
1336 1 33 GLU H 1 34 ILE H . . 4.210 4.250 4.200 4.280 0.070 9 0 "[ . 1 . 2]" 1
1337 1 34 ILE H 1 35 ARG HD3 . . 4.750 4.601 4.509 4.692 . 0 0 "[ . 1 . 2]" 1
1338 1 33 GLU HB2 1 34 ILE H . . 4.290 4.166 4.125 4.218 . 0 0 "[ . 1 . 2]" 1
1339 1 35 ARG H 1 35 ARG HD3 . . 4.710 2.332 2.263 2.423 . 0 0 "[ . 1 . 2]" 1
1340 1 35 ARG H 1 35 ARG HD2 . . 4.800 3.097 3.015 3.164 . 0 0 "[ . 1 . 2]" 1
1341 1 60 ILE H 1 89 VAL H . . 3.990 3.838 3.388 4.010 0.020 11 0 "[ . 1 . 2]" 1
1342 1 60 ILE H 1 87 ILE H . . 3.990 2.974 2.870 3.207 . 0 0 "[ . 1 . 2]" 1
1343 1 39 THR H 1 40 LYS HA . . 5.260 5.224 5.122 5.289 0.029 14 0 "[ . 1 . 2]" 1
1344 1 38 THR H 1 39 THR H . . 3.050 1.957 1.893 2.052 . 0 0 "[ . 1 . 2]" 1
1345 1 39 THR H 1 40 LYS H . . 4.890 4.418 4.378 4.457 . 0 0 "[ . 1 . 2]" 1
1346 1 40 LYS H 1 43 ALA H . . 5.330 4.896 4.845 4.949 . 0 0 "[ . 1 . 2]" 1
1347 1 40 LYS H 1 41 GLU HG2 . . 5.440 4.021 3.852 4.169 . 0 0 "[ . 1 . 2]" 1
1348 1 40 LYS H 1 40 LYS HB3 . . 3.660 2.393 2.284 2.547 . 0 0 "[ . 1 . 2]" 1
1349 1 40 LYS H 1 41 GLU H . . 3.960 2.818 2.802 2.840 . 0 0 "[ . 1 . 2]" 1
1350 1 41 GLU H 1 43 ALA H . . 4.220 3.912 3.854 3.965 . 0 0 "[ . 1 . 2]" 1
1351 1 39 THR H 1 41 GLU H . . 4.550 4.480 4.376 4.555 0.005 5 0 "[ . 1 . 2]" 1
1352 1 39 THR H 1 42 ASP H . . 3.370 3.270 3.147 3.379 0.009 13 0 "[ . 1 . 2]" 1
1353 1 42 ASP H 1 43 ALA H . . 3.040 2.601 2.468 2.721 . 0 0 "[ . 1 . 2]" 1
1354 1 41 GLU H 1 42 ASP H . . 3.230 2.535 2.458 2.600 . 0 0 "[ . 1 . 2]" 1
1355 1 38 THR H 1 42 ASP H . . 4.520 4.230 4.115 4.350 . 0 0 "[ . 1 . 2]" 1
1356 1 40 LYS H 1 42 ASP H . . 4.600 4.502 4.435 4.557 . 0 0 "[ . 1 . 2]" 1
1357 1 38 THR H 1 43 ALA H . . 4.890 4.403 4.311 4.559 . 0 0 "[ . 1 . 2]" 1
1358 1 41 GLU H 1 44 LYS H . . 4.700 4.458 4.398 4.538 . 0 0 "[ . 1 . 2]" 1
1359 1 45 ARG H 1 46 VAL H . . 3.230 2.956 2.841 3.053 . 0 0 "[ . 1 . 2]" 1
1360 1 45 ARG H 1 47 ALA H . . 4.210 4.264 4.242 4.286 0.076 20 0 "[ . 1 . 2]" 1
1361 1 48 GLU H 1 78 ILE MG . . 3.730 2.846 2.798 2.894 . 0 0 "[ . 1 . 2]" 1
1362 1 45 ARG H 1 48 GLU H . . 4.770 4.740 4.681 4.811 0.041 17 0 "[ . 1 . 2]" 1
1363 1 47 ALA H 1 48 GLU H . . 3.320 2.801 2.687 2.889 . 0 0 "[ . 1 . 2]" 1
1364 1 48 GLU H 1 50 ALA H . . 4.460 4.421 4.395 4.461 0.001 3 0 "[ . 1 . 2]" 1
1365 1 49 GLU H 1 50 ALA H . . 3.330 2.530 2.450 2.623 . 0 0 "[ . 1 . 2]" 1
1366 1 49 GLU H 1 51 GLU H . . 4.020 3.981 3.896 4.027 0.007 10 0 "[ . 1 . 2]" 1
1367 1 50 ALA H 1 51 GLU H . . 3.460 2.877 2.844 2.915 . 0 0 "[ . 1 . 2]" 1
1368 1 50 ALA H 1 52 ARG H . . 4.170 4.187 4.155 4.200 0.030 4 0 "[ . 1 . 2]" 1
1369 1 51 GLU H 1 52 ARG H . . 3.180 2.515 2.421 2.589 . 0 0 "[ . 1 . 2]" 1
1370 1 53 ARG H 1 55 ALA H . . 4.670 4.408 4.277 4.599 . 0 0 "[ . 1 . 2]" 1
1371 1 54 ASN H 1 55 ALA H . . 3.310 2.796 2.744 2.871 . 0 0 "[ . 1 . 2]" 1
1372 1 53 ARG H 1 54 ASN H . . 3.000 2.244 2.122 2.331 . 0 0 "[ . 1 . 2]" 1
1373 1 54 ASN H 1 54 ASN HD22 . . 4.710 3.321 2.841 4.396 . 0 0 "[ . 1 . 2]" 1
1374 1 54 ASN H 1 54 ASN HB2 . . 3.420 3.307 3.208 3.365 . 0 0 "[ . 1 . 2]" 1
1375 1 54 ASN HB2 1 55 ALA H . . 4.770 4.479 4.446 4.529 . 0 0 "[ . 1 . 2]" 1
1376 1 2 ARG HD3 1 55 ALA H . . 5.170 5.050 4.859 5.187 0.017 8 0 "[ . 1 . 2]" 1
1377 1 55 ALA H 1 56 ASP HA . . 5.490 5.438 5.300 5.520 0.030 12 0 "[ . 1 . 2]" 1
1378 1 55 ALA H 1 56 ASP H . . 4.220 4.210 4.164 4.247 0.027 17 0 "[ . 1 . 2]" 1
1379 1 3 VAL HA 1 56 ASP H . . 4.750 4.778 4.746 4.809 0.059 10 0 "[ . 1 . 2]" 1
1380 1 2 ARG HA 1 56 ASP H . . 4.850 4.390 4.330 4.482 . 0 0 "[ . 1 . 2]" 1
1381 1 4 ILE H 1 57 ILE H . . 4.090 4.042 3.952 4.110 0.020 9 0 "[ . 1 . 2]" 1
1382 1 57 ILE H 1 58 VAL H . . 4.430 4.278 4.228 4.343 . 0 0 "[ . 1 . 2]" 1
1383 1 56 ASP H 1 57 ILE H . . 3.250 2.908 2.830 2.959 . 0 0 "[ . 1 . 2]" 1
1384 1 2 ARG H 1 57 ILE H . . 4.940 4.373 3.655 4.842 . 0 0 "[ . 1 . 2]" 1
1385 1 58 VAL H 1 85 LYS H . . 4.900 4.114 3.889 4.240 . 0 0 "[ . 1 . 2]" 1
1386 1 58 VAL H 1 85 LYS HG2 . . 4.820 4.407 4.260 4.516 . 0 0 "[ . 1 . 2]" 1
1387 1 58 VAL H 1 102 ALA MB . . 5.360 4.380 4.221 4.498 . 0 0 "[ . 1 . 2]" 1
1388 1 59 VAL H 1 86 THR MG . . 4.880 4.867 4.823 4.893 0.013 12 0 "[ . 1 . 2]" 1
1389 1 4 ILE H 1 59 VAL H . . 4.440 3.553 3.469 3.633 . 0 0 "[ . 1 . 2]" 1
1390 1 59 VAL H 1 60 ILE H . . 4.470 4.320 4.252 4.475 0.005 7 0 "[ . 1 . 2]" 1
1391 1 60 ILE H 1 86 THR HA . . 4.930 4.707 4.586 4.960 0.030 8 0 "[ . 1 . 2]" 1
1392 1 8 VAL H 1 61 VAL H . . 4.450 3.920 3.740 4.301 . 0 0 "[ . 1 . 2]" 1
1393 1 61 VAL H 1 62 GLY H . . 4.660 4.347 4.110 4.550 . 0 0 "[ . 1 . 2]" 1
1394 1 62 GLY H 1 89 VAL H . . 4.460 4.330 3.833 4.470 0.010 4 0 "[ . 1 . 2]" 1
1395 1 62 GLY H 1 72 ALA MB . . 4.900 4.898 4.578 4.935 0.035 5 0 "[ . 1 . 2]" 1
1396 1 69 SER HA 1 71 LEU H . . 4.710 3.646 3.131 4.075 . 0 0 "[ . 1 . 2]" 1
1397 1 71 LEU H 1 73 LYS H . . 5.120 4.479 4.233 4.598 . 0 0 "[ . 1 . 2]" 1
1398 1 71 LEU H 1 74 ILE H . . 5.470 4.698 4.582 4.749 . 0 0 "[ . 1 . 2]" 1
1399 1 40 LYS HA 1 71 LEU H . . 5.500 5.542 5.515 5.572 0.072 7 0 "[ . 1 . 2]" 1
1400 1 71 LEU H 1 72 ALA HA . . 5.500 5.481 5.430 5.515 0.015 16 0 "[ . 1 . 2]" 1
1401 1 72 ALA H 1 73 LYS H . . 3.270 2.700 2.581 2.760 . 0 0 "[ . 1 . 2]" 1
1402 1 74 ILE H 1 75 VAL HA . . 5.450 5.461 5.440 5.498 0.048 14 0 "[ . 1 . 2]" 1
1403 1 74 ILE H 1 75 VAL H . . 3.500 2.880 2.857 2.970 . 0 0 "[ . 1 . 2]" 1
1404 1 77 LYS H 1 78 ILE HG13 . . 4.660 4.709 4.689 4.722 0.062 20 0 "[ . 1 . 2]" 1
1405 1 79 ILE H 1 81 ARG H . . 4.610 4.362 4.272 4.461 . 0 0 "[ . 1 . 2]" 1
1406 1 78 ILE H 1 79 ILE H . . 3.510 2.780 2.732 2.837 . 0 0 "[ . 1 . 2]" 1
1407 1 78 ILE H 1 80 ALA H . . 4.260 4.235 4.185 4.267 0.007 4 0 "[ . 1 . 2]" 1
1408 1 80 ALA H 1 82 ALA H . . 4.540 4.001 3.951 4.064 . 0 0 "[ . 1 . 2]" 1
1409 1 80 ALA H 1 81 ARG H . . 3.390 2.870 2.787 2.943 . 0 0 "[ . 1 . 2]" 1
1410 1 79 ILE MD 1 81 ARG H . . 5.500 5.447 5.369 5.503 0.003 7 0 "[ . 1 . 2]" 1
1411 1 81 ARG H 1 82 ALA H . . 3.150 2.391 2.347 2.424 . 0 0 "[ . 1 . 2]" 1
1412 1 82 ALA H 1 84 ALA H . . 4.320 4.161 4.068 4.271 . 0 0 "[ . 1 . 2]" 1
1413 1 83 GLY H 1 84 ALA H . . 3.380 2.137 2.078 2.211 . 0 0 "[ . 1 . 2]" 1
1414 1 81 ARG H 1 83 GLY H . . 4.350 4.163 4.078 4.257 . 0 0 "[ . 1 . 2]" 1
1415 1 83 GLY H 1 84 ALA HA . . 4.940 4.946 4.929 4.961 0.021 5 0 "[ . 1 . 2]" 1
1416 1 79 ILE MG 1 83 GLY H . . 4.800 3.992 3.935 4.047 . 0 0 "[ . 1 . 2]" 1
1417 1 79 ILE MD 1 83 GLY H . . 5.500 5.518 5.504 5.533 0.033 16 0 "[ . 1 . 2]" 1
1418 1 56 ASP HA 1 85 LYS H . . 4.960 4.316 4.147 4.566 . 0 0 "[ . 1 . 2]" 1
1419 1 85 LYS H 1 86 THR H . . 4.560 4.328 4.261 4.379 . 0 0 "[ . 1 . 2]" 1
1420 1 86 THR H 1 87 ILE H . . 4.520 4.485 4.444 4.517 . 0 0 "[ . 1 . 2]" 1
1421 1 60 ILE H 1 88 GLU H . . 4.740 4.760 4.702 4.788 0.048 10 0 "[ . 1 . 2]" 1
1422 1 89 VAL H 1 98 ALA MB . . 4.900 3.571 3.315 3.793 . 0 0 "[ . 1 . 2]" 1
1423 1 99 VAL H 1 100 ALA H . . 3.410 2.771 2.691 2.848 . 0 0 "[ . 1 . 2]" 1
1424 1 100 ALA H 1 101 LYS H . . 3.500 2.855 2.811 2.890 . 0 0 "[ . 1 . 2]" 1
1425 1 102 ALA H 1 103 ARG H . . 3.610 2.341 2.235 2.418 . 0 0 "[ . 1 . 2]" 1
1426 1 103 ARG H 1 106 TRP H . . 5.220 4.866 4.789 5.029 . 0 0 "[ . 1 . 2]" 1
1427 1 103 ARG H 1 104 GLY H . . 3.390 2.604 2.548 2.652 . 0 0 "[ . 1 . 2]" 1
1428 1 104 GLY H 1 106 TRP H . . 4.420 4.088 3.991 4.251 . 0 0 "[ . 1 . 2]" 1
1429 1 102 ALA H 1 104 GLY H . . 4.140 3.091 2.980 3.248 . 0 0 "[ . 1 . 2]" 1
1430 1 99 VAL HA 1 104 GLY H . . 4.840 4.868 4.763 4.909 0.069 14 0 "[ . 1 . 2]" 1
1431 1 104 GLY H 1 106 TRP HB2 . . 5.460 5.478 5.393 5.504 0.044 7 0 "[ . 1 . 2]" 1
1432 1 57 ILE MG 1 104 GLY H . . 5.170 5.122 4.957 5.197 0.027 15 0 "[ . 1 . 2]" 1
1433 1 100 ALA MB 1 105 SER H . . 4.980 4.493 4.345 4.673 . 0 0 "[ . 1 . 2]" 1
1434 1 102 ALA MB 1 105 SER H . . 4.680 4.532 4.468 4.630 . 0 0 "[ . 1 . 2]" 1
1435 1 105 SER H 1 106 TRP HB2 . . 5.000 5.048 5.008 5.072 0.072 8 0 "[ . 1 . 2]" 1
1436 1 105 SER H 1 106 TRP H . . 3.790 2.988 2.934 3.045 . 0 0 "[ . 1 . 2]" 1
1437 1 103 ARG H 1 105 SER H . . 4.880 4.263 4.173 4.353 . 0 0 "[ . 1 . 2]" 1
1438 1 47 ALA H 1 49 GLU H . . 4.010 3.803 3.712 3.898 . 0 0 "[ . 1 . 2]" 1
1439 1 57 ILE MD 1 106 TRP HE1 . . 4.950 4.026 3.735 4.242 . 0 0 "[ . 1 . 2]" 1
1440 1 57 ILE HG12 1 106 TRP HE1 . . 5.010 3.450 3.224 3.603 . 0 0 "[ . 1 . 2]" 1
1441 1 85 LYS HG2 1 106 TRP HE1 . . 4.870 4.525 4.215 4.637 . 0 0 "[ . 1 . 2]" 1
1442 1 56 ASP HB2 1 106 TRP HE1 . . 5.000 4.311 4.061 4.636 . 0 0 "[ . 1 . 2]" 1
1443 1 106 TRP HA 1 106 TRP HE1 . . 5.270 5.032 4.931 5.123 . 0 0 "[ . 1 . 2]" 1
1444 1 105 SER H 1 107 SER H . . 5.220 4.800 4.565 4.962 . 0 0 "[ . 1 . 2]" 1
1445 1 106 TRP HE3 1 107 SER H . . 4.090 3.138 2.969 3.467 . 0 0 "[ . 1 . 2]" 1
1446 1 107 SER H 1 108 LEU H . . 3.560 2.529 2.481 2.629 . 0 0 "[ . 1 . 2]" 1
1447 1 8 VAL HB 1 9 GLY H . . 5.210 4.422 4.191 4.512 . 0 0 "[ . 1 . 2]" 1
1448 1 9 GLY H 1 36 THR MG . . 5.010 4.419 4.198 4.788 . 0 0 "[ . 1 . 2]" 1
1449 1 13 ALA MB 1 14 GLY H . . 4.710 3.007 2.518 3.481 . 0 0 "[ . 1 . 2]" 1
1450 1 15 LYS HB2 1 16 THR H . . 4.620 3.116 2.118 4.295 . 0 0 "[ . 1 . 2]" 1
1451 1 19 ASP H 1 20 GLU H . . 4.050 2.554 2.467 2.604 . 0 0 "[ . 1 . 2]" 1
1452 1 25 ALA H 1 26 LYS H . . 4.330 3.154 3.093 3.196 . 0 0 "[ . 1 . 2]" 1
1453 1 27 GLU H 1 29 VAL H . . 4.330 4.044 3.984 4.106 . 0 0 "[ . 1 . 2]" 1
1454 1 27 GLU H 1 28 GLU H . . 3.810 2.907 2.856 2.964 . 0 0 "[ . 1 . 2]" 1
1455 1 28 GLU H 1 29 VAL H . . 3.920 2.509 2.447 2.575 . 0 0 "[ . 1 . 2]" 1
1456 1 35 ARG HD3 1 36 THR H . . 5.440 5.446 5.397 5.480 0.040 12 0 "[ . 1 . 2]" 1
1457 1 35 ARG HD2 1 36 THR H . . 5.320 5.263 5.135 5.336 0.016 17 0 "[ . 1 . 2]" 1
1458 1 35 ARG HB2 1 36 THR H . . 4.600 2.194 2.112 2.256 . 0 0 "[ . 1 . 2]" 1
1459 1 36 THR HB 1 37 VAL H . . 4.760 2.443 2.350 2.606 . 0 0 "[ . 1 . 2]" 1
1460 1 2 ARG HD2 1 3 VAL H . . 5.410 4.921 4.801 5.281 . 0 0 "[ . 1 . 2]" 1
1461 1 7 ILE HG12 1 18 LEU H . . 5.500 5.323 5.131 5.504 0.004 4 0 "[ . 1 . 2]" 1
1462 1 16 THR MG 1 18 LEU H . . 5.500 5.452 5.272 5.525 0.025 10 0 "[ . 1 . 2]" 1
1463 1 42 ASP HB3 1 45 ARG H . . 5.500 5.323 5.195 5.481 . 0 0 "[ . 1 . 2]" 1
1464 1 101 LYS H 1 102 ALA H . . 2.970 2.987 2.958 3.009 0.039 18 0 "[ . 1 . 2]" 1
1465 1 56 ASP HB3 1 57 ILE H . . 3.630 2.919 2.748 3.509 . 0 0 "[ . 1 . 2]" 1
1466 1 4 ILE H 1 58 VAL H . . 5.500 4.877 4.834 4.916 . 0 0 "[ . 1 . 2]" 1
1467 1 58 VAL H 1 86 THR H . . 5.500 4.881 4.831 4.910 . 0 0 "[ . 1 . 2]" 1
1468 1 57 ILE MG 1 58 VAL H . . 3.200 2.673 2.609 2.721 . 0 0 "[ . 1 . 2]" 1
1469 1 58 VAL H 1 59 VAL H . . 4.350 3.919 3.863 3.988 . 0 0 "[ . 1 . 2]" 1
1470 1 7 ILE HG12 1 61 VAL H . . 5.280 5.245 5.111 5.288 0.008 1 0 "[ . 1 . 2]" 1
1471 1 75 VAL HA 1 77 LYS H . . 4.760 4.322 4.269 4.366 . 0 0 "[ . 1 . 2]" 1
1472 1 77 LYS H 1 79 ILE H . . 4.440 4.188 4.146 4.246 . 0 0 "[ . 1 . 2]" 1
1473 1 80 ALA H 1 83 GLY H . . 5.350 5.354 5.250 5.408 0.058 7 0 "[ . 1 . 2]" 1
1474 1 84 ALA H 1 85 LYS H . . 4.480 4.453 4.394 4.485 0.005 2 0 "[ . 1 . 2]" 1
1475 1 87 ILE H 1 87 ILE MD . . 3.850 2.048 1.964 2.215 . 0 0 "[ . 1 . 2]" 1
1476 1 87 ILE MD 1 88 GLU H . . 4.630 4.703 4.693 4.724 0.094 19 0 "[ . 1 . 2]" 1
1477 1 98 ALA H 1 99 VAL H . . 4.300 2.852 2.731 3.008 . 0 0 "[ . 1 . 2]" 1
1478 1 57 ILE HG13 1 106 TRP HE1 . . 5.320 4.310 4.138 4.522 . 0 0 "[ . 1 . 2]" 1
1479 1 85 LYS H 1 106 TRP HE1 . . 5.500 5.481 5.179 5.549 0.049 16 0 "[ . 1 . 2]" 1
1480 1 9 GLY HA2 1 11 SER H . . 5.150 3.170 2.415 4.159 . 0 0 "[ . 1 . 2]" 1
1481 1 9 GLY HA3 1 11 SER H . . 5.150 4.073 3.775 4.843 . 0 0 "[ . 1 . 2]" 1
1482 1 28 GLU H 1 29 VAL MG2 . . 5.500 4.029 3.974 4.090 . 0 0 "[ . 1 . 2]" 1
1483 1 2 ARG HG3 1 3 VAL H . . 3.900 2.501 2.186 2.930 . 0 0 "[ . 1 . 2]" 1
1484 1 33 GLU HB3 1 35 ARG HE . . 4.750 4.314 3.039 4.795 0.045 17 0 "[ . 1 . 2]" 1
1485 1 35 ARG HE 1 49 GLU HB3 . . 4.870 4.395 4.213 4.508 . 0 0 "[ . 1 . 2]" 1
1486 1 90 THR H 1 91 THR H . . 4.570 4.578 4.493 4.640 0.070 7 0 "[ . 1 . 2]" 1
1487 1 54 ASN HB2 1 54 ASN HD21 . . 3.490 3.257 2.472 3.543 0.053 2 0 "[ . 1 . 2]" 1
1488 1 54 ASN HB2 1 54 ASN HD22 . . 3.760 2.718 2.293 3.765 0.005 4 0 "[ . 1 . 2]" 1
1489 1 43 ALA HA 1 47 ALA H . . 4.230 3.906 3.816 3.944 . 0 0 "[ . 1 . 2]" 1
1490 1 70 THR HA 1 73 LYS H . . 3.500 3.358 3.174 3.472 . 0 0 "[ . 1 . 2]" 1
1491 1 51 GLU HA 1 55 ALA H . . 3.970 3.567 3.515 3.624 . 0 0 "[ . 1 . 2]" 1
1492 1 98 ALA HA 1 101 LYS H . . 4.480 3.525 3.251 3.695 . 0 0 "[ . 1 . 2]" 1
1493 1 99 VAL HA 1 101 LYS H . . 4.780 4.470 4.323 4.611 . 0 0 "[ . 1 . 2]" 1
1494 1 100 ALA HA 1 104 GLY H . . 3.210 2.761 2.574 2.833 . 0 0 "[ . 1 . 2]" 1
1495 1 3 VAL H 1 55 ALA HA . . 4.970 4.554 4.378 4.907 . 0 0 "[ . 1 . 2]" 1
1496 1 7 ILE MG 1 18 LEU H . . 4.760 3.698 3.483 3.891 . 0 0 "[ . 1 . 2]" 1
1497 1 35 ARG HE 1 46 VAL HA . . 5.190 4.032 3.890 4.297 . 0 0 "[ . 1 . 2]" 1
1498 1 35 ARG H 1 35 ARG HE . . 5.290 4.848 4.737 5.098 . 0 0 "[ . 1 . 2]" 1
1499 1 45 ARG HE 1 46 VAL H . . 5.410 5.265 4.896 5.436 0.026 9 0 "[ . 1 . 2]" 1
1500 1 52 ARG H 1 52 ARG HE . . 5.500 4.992 3.566 5.519 0.019 14 0 "[ . 1 . 2]" 1
1501 1 48 GLU H 1 49 GLU H . . 3.170 2.747 2.712 2.778 . 0 0 "[ . 1 . 2]" 1
1502 1 48 GLU H 1 50 ALA MB . . 5.010 4.930 4.892 4.978 . 0 0 "[ . 1 . 2]" 1
1503 1 4 ILE MD 1 54 ASN H . . 5.360 5.047 4.912 5.233 . 0 0 "[ . 1 . 2]" 1
1504 1 6 VAL H 1 60 ILE H . . 4.710 4.594 4.541 4.733 0.023 7 0 "[ . 1 . 2]" 1
1505 1 7 ILE HG13 1 61 VAL H . . 4.970 3.588 3.408 3.626 . 0 0 "[ . 1 . 2]" 1
1506 1 68 LYS H 1 69 SER H . . 5.170 2.448 1.773 3.214 . 0 0 "[ . 1 . 2]" 1
1507 1 69 SER HA 1 73 LYS H . . 5.500 5.505 5.257 5.609 0.109 3 0 "[ . 1 . 2]" 1
1508 1 76 LYS H 1 77 LYS H . . 3.430 2.891 2.849 2.932 . 0 0 "[ . 1 . 2]" 1
1509 1 76 LYS HB3 1 77 LYS H . . 3.270 2.948 2.886 3.055 . 0 0 "[ . 1 . 2]" 1
1510 1 79 ILE H 1 80 ALA HA . . 4.980 5.070 5.042 5.101 0.121 20 0 "[ . 1 . 2]" 1
1511 1 79 ILE H 1 80 ALA H . . 2.700 2.510 2.479 2.543 . 0 0 "[ . 1 . 2]" 1
1512 1 79 ILE H 1 82 ALA H . . 4.650 4.710 4.677 4.744 0.094 7 0 "[ . 1 . 2]" 1
1513 1 82 ALA H 1 83 GLY H . . 2.970 2.653 2.573 2.755 . 0 0 "[ . 1 . 2]" 1
1514 1 79 ILE MD 1 84 ALA H . . 5.500 5.509 5.270 5.532 0.032 3 0 "[ . 1 . 2]" 1
1515 1 59 VAL H 1 87 ILE H . . 5.070 4.875 4.852 4.917 . 0 0 "[ . 1 . 2]" 1
1516 1 9 GLY H 1 37 VAL HB . . 5.500 5.556 5.466 5.628 0.128 4 0 "[ . 1 . 2]" 1
1517 1 22 ALA H 1 23 ARG H . . 4.230 2.869 2.807 2.922 . 0 0 "[ . 1 . 2]" 1
1518 1 54 ASN H 1 54 ASN HD21 . . 4.670 3.516 2.686 3.877 . 0 0 "[ . 1 . 2]" 1
1519 1 36 THR MG 1 37 VAL H . . 4.530 3.881 3.831 3.947 . 0 0 "[ . 1 . 2]" 1
1520 1 35 ARG H 1 36 THR H . . 5.380 4.500 4.463 4.516 . 0 0 "[ . 1 . 2]" 1
1521 1 24 LYS H 1 26 LYS H . . 5.500 4.780 4.679 4.860 . 0 0 "[ . 1 . 2]" 1
1522 1 24 LYS H 1 27 GLU H . . 5.500 4.825 4.735 4.903 . 0 0 "[ . 1 . 2]" 1
1523 1 23 ARG H 1 24 LYS H . . 4.050 3.024 2.972 3.082 . 0 0 "[ . 1 . 2]" 1
1524 1 1 MET QB 1 3 VAL QG . . 5.090 4.468 4.303 4.733 . 0 0 "[ . 1 . 2]" 1
1525 1 1 MET QB 1 56 ASP HB2 . . 5.160 3.262 2.403 4.861 . 0 0 "[ . 1 . 2]" 1
1526 1 1 MET QB 1 57 ILE MD . . 5.340 4.271 3.930 4.863 . 0 0 "[ . 1 . 2]" 1
1527 1 1 MET QB 1 106 TRP HE1 . . 5.340 4.173 3.514 5.337 . 0 0 "[ . 1 . 2]" 1
1528 1 1 MET QG 1 2 ARG H . . 4.910 3.263 2.459 4.011 . 0 0 "[ . 1 . 2]" 1
1529 1 1 MET QG 1 56 ASP HB2 . . 4.330 3.547 2.955 4.257 . 0 0 "[ . 1 . 2]" 1
1530 1 1 MET QG 1 56 ASP HB3 . . 4.590 2.882 2.327 3.411 . 0 0 "[ . 1 . 2]" 1
1531 1 1 MET QG 1 57 ILE HG12 . . 4.240 3.811 3.524 4.260 0.020 5 0 "[ . 1 . 2]" 1
1532 1 1 MET QG 1 57 ILE HG13 . . 4.050 2.980 2.647 3.466 . 0 0 "[ . 1 . 2]" 1
1533 1 1 MET QG 1 57 ILE MD . . 3.010 2.607 2.323 3.024 0.014 20 0 "[ . 1 . 2]" 1
1534 1 1 MET QG 1 106 TRP HB3 . . 5.160 4.802 4.244 5.184 0.024 3 0 "[ . 1 . 2]" 1
1535 1 1 MET QG 1 106 TRP HD1 . . 5.340 4.761 4.475 5.301 . 0 0 "[ . 1 . 2]" 1
1536 1 1 MET QG 1 106 TRP HE1 . . 4.650 3.760 3.321 4.218 . 0 0 "[ . 1 . 2]" 1
1537 1 2 ARG H 1 2 ARG QD . . 5.270 5.097 4.913 5.320 0.050 20 0 "[ . 1 . 2]" 1
1538 1 2 ARG H 1 3 VAL QG . . 5.130 4.403 3.784 4.715 . 0 0 "[ . 1 . 2]" 1
1539 1 2 ARG HA 1 2 ARG QG . . 3.320 2.224 2.172 2.290 . 0 0 "[ . 1 . 2]" 1
1540 1 2 ARG HA 1 2 ARG QD . . 4.160 4.119 4.056 4.168 0.008 5 0 "[ . 1 . 2]" 1
1541 1 2 ARG HA 1 3 VAL QG . . 3.650 3.485 3.328 3.630 . 0 0 "[ . 1 . 2]" 1
1542 1 2 ARG HB2 1 2 ARG QD . . 3.650 2.922 2.858 2.959 . 0 0 "[ . 1 . 2]" 1
1543 1 2 ARG QG 1 3 VAL H . . 3.420 2.261 2.082 2.617 . 0 0 "[ . 1 . 2]" 1
1544 1 2 ARG QG 1 32 ALA HA . . 4.580 3.364 3.210 3.556 . 0 0 "[ . 1 . 2]" 1
1545 1 2 ARG QG 1 33 GLU H . . 5.340 4.148 3.998 4.377 . 0 0 "[ . 1 . 2]" 1
1546 1 2 ARG QG 1 33 GLU QG . . 3.610 3.339 3.039 3.613 0.003 10 0 "[ . 1 . 2]" 1
1547 1 2 ARG QG 1 55 ALA HA . . 3.530 2.501 2.228 2.713 . 0 0 "[ . 1 . 2]" 1
1548 1 2 ARG QG 1 56 ASP H . . 4.140 3.746 3.620 3.840 . 0 0 "[ . 1 . 2]" 1
1549 1 2 ARG QD 1 3 VAL H . . 4.730 4.175 4.032 4.547 . 0 0 "[ . 1 . 2]" 1
1550 1 2 ARG QD 1 4 ILE MD . . 4.640 3.271 3.030 3.506 . 0 0 "[ . 1 . 2]" 1
1551 1 2 ARG QD 1 33 GLU QG . . 4.090 2.758 2.427 3.220 . 0 0 "[ . 1 . 2]" 1
1552 1 2 ARG QD 1 53 ARG H . . 5.190 4.773 4.665 4.846 . 0 0 "[ . 1 . 2]" 1
1553 1 2 ARG QD 1 53 ARG HB2 . . 3.040 2.825 2.482 3.048 0.008 16 0 "[ . 1 . 2]" 1
1554 1 2 ARG QD 1 53 ARG HG3 . . 3.260 2.168 2.078 2.308 . 0 0 "[ . 1 . 2]" 1
1555 1 2 ARG QD 1 54 ASN H . . 4.760 4.168 4.051 4.333 . 0 0 "[ . 1 . 2]" 1
1556 1 2 ARG QD 1 55 ALA H . . 4.550 3.516 3.380 3.666 . 0 0 "[ . 1 . 2]" 1
1557 1 2 ARG QD 1 55 ALA HA . . 3.780 2.663 2.451 2.936 . 0 0 "[ . 1 . 2]" 1
1558 1 2 ARG QD 1 55 ALA MB . . 3.860 3.163 3.044 3.330 . 0 0 "[ . 1 . 2]" 1
1559 1 2 ARG QD 1 56 ASP H . . 4.560 4.131 3.891 4.363 . 0 0 "[ . 1 . 2]" 1
1560 1 3 VAL H 1 3 VAL QG . . 2.950 2.778 2.648 2.888 . 0 0 "[ . 1 . 2]" 1
1561 1 3 VAL H 1 33 GLU QG . . 4.940 4.789 4.566 4.956 0.016 20 0 "[ . 1 . 2]" 1
1562 1 3 VAL QG 1 29 VAL HB . . 3.610 3.356 3.206 3.485 . 0 0 "[ . 1 . 2]" 1
1563 1 3 VAL QG 1 31 ASP H . . 4.460 5.465 5.423 5.522 1.062 8 20 [*******+*******-****] 1
1564 1 3 VAL QG 1 31 ASP QB . . 4.480 4.398 4.172 4.694 0.214 18 0 "[ . 1 . 2]" 1
1565 1 3 VAL QG 1 32 ALA H . . 3.550 4.581 4.460 4.737 1.187 7 20 [******+**-**********] 1
1566 1 3 VAL QG 1 32 ALA HA . . 3.460 3.757 3.673 3.889 0.429 7 0 "[ . 1 . 2]" 1
1567 1 3 VAL QG 1 32 ALA MB . . 2.500 2.250 2.086 2.397 . 0 0 "[ . 1 . 2]" 1
1568 1 4 ILE H 1 5 VAL QG . . 3.980 4.027 3.976 4.113 0.133 19 0 "[ . 1 . 2]" 1
1569 1 4 ILE MG 1 33 GLU QG . . 3.950 3.948 3.840 3.999 0.049 9 0 "[ . 1 . 2]" 1
1570 1 4 ILE HG12 1 33 GLU QG . . 4.410 2.207 2.122 2.326 . 0 0 "[ . 1 . 2]" 1
1571 1 4 ILE HG13 1 33 GLU QG . . 4.090 3.002 2.839 3.204 . 0 0 "[ . 1 . 2]" 1
1572 1 4 ILE MD 1 33 GLU QG . . 3.430 2.210 2.082 2.270 . 0 0 "[ . 1 . 2]" 1
1573 1 4 ILE MD 1 53 ARG QD . . 3.610 2.704 2.528 2.971 . 0 0 "[ . 1 . 2]" 1
1574 1 5 VAL H 1 5 VAL QG . . 3.320 2.884 2.792 2.916 . 0 0 "[ . 1 . 2]" 1
1575 1 5 VAL H 1 33 GLU QG . . 5.110 5.161 5.118 5.202 0.092 20 0 "[ . 1 . 2]" 1
1576 1 5 VAL HA 1 5 VAL QG . . 2.780 2.146 2.130 2.235 . 0 0 "[ . 1 . 2]" 1
1577 1 5 VAL QG 1 6 VAL H . . 4.080 2.935 2.884 3.119 . 0 0 "[ . 1 . 2]" 1
1578 1 5 VAL QG 1 59 VAL H . . 3.160 3.510 3.386 3.799 0.639 19 1 "[ . 1 . +2]" 1
1579 1 6 VAL H 1 6 VAL QG . . 2.880 2.580 2.531 2.649 . 0 0 "[ . 1 . 2]" 1
1580 1 6 VAL H 1 60 ILE QG . . 4.780 4.837 4.782 4.853 0.073 12 0 "[ . 1 . 2]" 1
1581 1 6 VAL H 1 61 VAL QG . . 3.740 3.702 3.542 4.114 0.374 7 0 "[ . 1 . 2]" 1
1582 1 6 VAL HA 1 6 VAL QG . . 2.670 2.083 2.062 2.107 . 0 0 "[ . 1 . 2]" 1
1583 1 6 VAL QG 1 7 ILE H . . 3.110 2.368 2.290 2.424 . 0 0 "[ . 1 . 2]" 1
1584 1 6 VAL QG 1 7 ILE HA . . 4.310 3.729 3.541 3.841 . 0 0 "[ . 1 . 2]" 1
1585 1 6 VAL QG 1 35 ARG HA . . 5.030 4.867 4.829 4.937 . 0 0 "[ . 1 . 2]" 1
1586 1 6 VAL QG 1 35 ARG HB2 . . 4.430 4.166 4.096 4.240 . 0 0 "[ . 1 . 2]" 1
1587 1 7 ILE HA 1 61 VAL QG . . 3.560 3.234 3.200 3.286 . 0 0 "[ . 1 . 2]" 1
1588 1 7 ILE HG13 1 21 LEU QB . . 4.320 3.899 3.772 4.057 . 0 0 "[ . 1 . 2]" 1
1589 1 7 ILE MD 1 21 LEU QB . . 3.580 2.930 2.749 3.033 . 0 0 "[ . 1 . 2]" 1
1590 1 7 ILE MD 1 61 VAL QG . . 2.950 3.185 3.072 3.295 0.345 19 0 "[ . 1 . 2]" 1
1591 1 8 VAL QG 1 9 GLY H . . 4.130 3.058 2.769 3.191 . 0 0 "[ . 1 . 2]" 1
1592 1 8 VAL QG 1 62 GLY QA . . 4.400 2.548 2.266 2.804 . 0 0 "[ . 1 . 2]" 1
1593 1 9 GLY H 1 18 LEU QD . . 5.190 4.404 4.251 4.552 . 0 0 "[ . 1 . 2]" 1
1594 1 9 GLY H 1 37 VAL QG . . 4.400 3.555 3.447 3.647 . 0 0 "[ . 1 . 2]" 1
1595 1 9 GLY QA 1 10 PRO QB . . 4.640 3.808 3.730 3.896 . 0 0 "[ . 1 . 2]" 1
1596 1 9 GLY QA 1 11 SER H . . 4.520 3.024 2.389 3.873 . 0 0 "[ . 1 . 2]" 1
1597 1 9 GLY QA 1 18 LEU QD . . 3.660 2.155 1.991 2.322 . 0 0 "[ . 1 . 2]" 1
1598 1 9 GLY QA 1 36 THR MG . . 4.760 3.263 2.639 3.649 . 0 0 "[ . 1 . 2]" 1
1599 1 10 PRO HA 1 18 LEU QD . . 3.190 1.997 1.868 2.099 . 0 0 "[ . 1 . 2]" 1
1600 1 10 PRO QB 1 36 THR MG . . 5.340 4.660 3.971 5.076 . 0 0 "[ . 1 . 2]" 1
1601 1 10 PRO QG 1 11 SER H . . 4.590 3.295 1.946 4.546 . 0 0 "[ . 1 . 2]" 1
1602 1 10 PRO QG 1 11 SER QB . . 4.760 4.024 3.523 4.811 0.051 19 0 "[ . 1 . 2]" 1
1603 1 10 PRO QD 1 36 THR MG . . 5.350 4.600 3.893 5.384 0.034 4 0 "[ . 1 . 2]" 1
1604 1 10 PRO QD 1 38 THR MG . . 4.340 3.257 2.831 3.726 . 0 0 "[ . 1 . 2]" 1
1605 1 11 SER H 1 18 LEU QD . . 5.050 3.834 2.315 4.525 . 0 0 "[ . 1 . 2]" 1
1606 1 11 SER QB 1 12 GLY H . . 3.530 3.314 2.606 3.661 0.131 8 0 "[ . 1 . 2]" 1
1607 1 12 GLY QA 1 13 ALA HA . . 4.420 4.098 4.015 4.142 . 0 0 "[ . 1 . 2]" 1
1608 1 12 GLY QA 1 14 GLY H . . 4.740 4.083 3.563 4.744 0.004 11 0 "[ . 1 . 2]" 1
1609 1 13 ALA MB 1 62 GLY QA . . 4.370 2.608 2.224 3.293 . 0 0 "[ . 1 . 2]" 1
1610 1 14 GLY QA 1 15 LYS HA . . 4.320 4.052 3.976 4.396 0.076 16 0 "[ . 1 . 2]" 1
1611 1 14 GLY QA 1 15 LYS QB . . 4.540 4.126 3.799 4.316 . 0 0 "[ . 1 . 2]" 1
1612 1 14 GLY QA 1 15 LYS QG . . 3.810 3.362 3.219 3.617 . 0 0 "[ . 1 . 2]" 1
1613 1 14 GLY QA 1 15 LYS QD . . 5.180 4.848 3.766 5.227 0.047 11 0 "[ . 1 . 2]" 1
1614 1 14 GLY QA 1 15 LYS QE . . 4.680 4.537 4.119 4.712 0.032 20 0 "[ . 1 . 2]" 1
1615 1 15 LYS QB 1 16 THR H . . 4.050 2.974 2.055 3.857 . 0 0 "[ . 1 . 2]" 1
1616 1 15 LYS QB 1 16 THR HA . . 5.320 4.353 3.974 4.871 . 0 0 "[ . 1 . 2]" 1
1617 1 15 LYS QB 1 16 THR HB . . 5.340 4.770 4.315 5.353 0.013 13 0 "[ . 1 . 2]" 1
1618 1 15 LYS QE 1 15 LYS QG . . 2.640 2.226 2.072 2.433 . 0 0 "[ . 1 . 2]" 1
1619 1 15 LYS QD 1 15 LYS QE . . 2.370 2.095 2.013 2.126 . 0 0 "[ . 1 . 2]" 1
1620 1 16 THR HA 1 19 ASP QB . . 5.290 2.486 2.225 2.837 . 0 0 "[ . 1 . 2]" 1
1621 1 16 THR MG 1 19 ASP QB . . 3.940 2.841 2.474 3.278 . 0 0 "[ . 1 . 2]" 1
1622 1 16 THR MG 1 20 GLU QG . . 4.220 3.508 3.233 3.710 . 0 0 "[ . 1 . 2]" 1
1623 1 17 THR MG 1 19 ASP QB . . 5.140 5.159 5.116 5.283 0.143 10 0 "[ . 1 . 2]" 1
1624 1 18 LEU H 1 18 LEU QD . . 4.980 2.905 2.780 3.003 . 0 0 "[ . 1 . 2]" 1
1625 1 18 LEU H 1 19 ASP QB . . 5.260 4.257 3.977 4.357 . 0 0 "[ . 1 . 2]" 1
1626 1 18 LEU HA 1 18 LEU QD . . 3.650 3.476 3.455 3.502 . 0 0 "[ . 1 . 2]" 1
1627 1 18 LEU HA 1 19 ASP QB . . 5.340 5.064 4.917 5.147 . 0 0 "[ . 1 . 2]" 1
1628 1 18 LEU HA 1 21 LEU QB . . 3.310 2.281 2.248 2.313 . 0 0 "[ . 1 . 2]" 1
1629 1 18 LEU QB 1 18 LEU QD . . 2.740 1.923 1.902 1.940 . 0 0 "[ . 1 . 2]" 1
1630 1 18 LEU QB 1 36 THR HB . . 4.910 4.019 3.877 4.140 . 0 0 "[ . 1 . 2]" 1
1631 1 18 LEU QB 1 36 THR MG . . 3.420 2.251 2.128 2.342 . 0 0 "[ . 1 . 2]" 1
1632 1 18 LEU HG 1 19 ASP QB . . 4.660 3.259 3.103 3.492 . 0 0 "[ . 1 . 2]" 1
1633 1 18 LEU QD 1 36 THR HA . . 5.440 4.948 4.785 5.068 . 0 0 "[ . 1 . 2]" 1
1634 1 18 LEU QD 1 36 THR HB . . 3.700 3.475 3.295 3.621 . 0 0 "[ . 1 . 2]" 1
1635 1 19 ASP H 1 19 ASP QB . . 3.430 2.148 2.058 2.204 . 0 0 "[ . 1 . 2]" 1
1636 1 19 ASP H 1 20 GLU QG . . 4.570 3.779 3.699 3.881 . 0 0 "[ . 1 . 2]" 1
1637 1 19 ASP H 1 21 LEU QB . . 4.290 3.984 3.832 4.057 . 0 0 "[ . 1 . 2]" 1
1638 1 19 ASP H 1 21 LEU QD . . 4.910 4.719 4.513 4.793 . 0 0 "[ . 1 . 2]" 1
1639 1 19 ASP QB 1 20 GLU H . . 4.140 2.058 1.920 2.287 . 0 0 "[ . 1 . 2]" 1
1640 1 19 ASP QB 1 20 GLU HA . . 3.760 3.830 3.796 3.859 0.099 11 0 "[ . 1 . 2]" 1
1641 1 19 ASP QB 1 20 GLU HB2 . . 5.070 5.024 4.954 5.086 0.016 1 0 "[ . 1 . 2]" 1
1642 1 19 ASP QB 1 20 GLU HB3 . . 5.030 3.675 3.558 3.808 . 0 0 "[ . 1 . 2]" 1
1643 1 19 ASP QB 1 20 GLU QG . . 4.340 4.002 3.870 4.188 . 0 0 "[ . 1 . 2]" 1
1644 1 19 ASP QB 1 21 LEU H . . 4.200 4.177 4.089 4.269 0.069 14 0 "[ . 1 . 2]" 1
1645 1 20 GLU H 1 23 ARG QD . . 3.620 3.672 3.652 3.703 0.083 14 0 "[ . 1 . 2]" 1
1646 1 20 GLU HA 1 20 GLU QG . . 3.470 3.379 3.368 3.391 . 0 0 "[ . 1 . 2]" 1
1647 1 20 GLU HA 1 23 ARG QB . . 3.060 2.333 2.270 2.388 . 0 0 "[ . 1 . 2]" 1
1648 1 20 GLU HA 1 23 ARG QG . . 4.190 3.863 3.705 3.996 . 0 0 "[ . 1 . 2]" 1
1649 1 20 GLU HA 1 23 ARG QD . . 3.350 2.329 2.051 2.528 . 0 0 "[ . 1 . 2]" 1
1650 1 20 GLU HA 1 24 LYS QG . . 4.280 3.819 3.574 3.983 . 0 0 "[ . 1 . 2]" 1
1651 1 20 GLU HA 1 24 LYS QE . . 5.040 3.569 3.357 5.080 0.040 12 0 "[ . 1 . 2]" 1
1652 1 20 GLU HB2 1 24 LYS QE . . 4.340 2.268 2.046 3.985 . 0 0 "[ . 1 . 2]" 1
1653 1 20 GLU QG 1 21 LEU H . . 3.520 2.498 2.439 2.524 . 0 0 "[ . 1 . 2]" 1
1654 1 20 GLU QG 1 21 LEU HA . . 3.730 3.509 3.413 3.565 . 0 0 "[ . 1 . 2]" 1
1655 1 20 GLU QG 1 21 LEU QB . . 3.760 3.791 3.773 3.808 0.048 16 0 "[ . 1 . 2]" 1
1656 1 20 GLU QG 1 24 LYS QE . . 4.260 2.870 2.447 3.798 . 0 0 "[ . 1 . 2]" 1
1657 1 21 LEU H 1 21 LEU QB . . 3.000 2.157 2.125 2.186 . 0 0 "[ . 1 . 2]" 1
1658 1 21 LEU H 1 21 LEU QD . . 3.060 2.691 2.603 2.733 . 0 0 "[ . 1 . 2]" 1
1659 1 21 LEU HA 1 21 LEU QD . . 2.600 2.035 2.020 2.060 . 0 0 "[ . 1 . 2]" 1
1660 1 21 LEU HA 1 24 LYS QE . . 4.610 3.369 2.848 3.969 . 0 0 "[ . 1 . 2]" 1
1661 1 21 LEU QB 1 21 LEU QD . . 2.510 2.044 2.030 2.062 . 0 0 "[ . 1 . 2]" 1
1662 1 21 LEU QD 1 22 ALA H . . 4.260 4.051 4.025 4.078 . 0 0 "[ . 1 . 2]" 1
1663 1 21 LEU QD 1 24 LYS QE . . 4.460 3.109 2.604 3.500 . 0 0 "[ . 1 . 2]" 1
1664 1 23 ARG H 1 23 ARG QB . . 3.430 2.332 2.294 2.386 . 0 0 "[ . 1 . 2]" 1
1665 1 23 ARG H 1 23 ARG QG . . 4.440 2.377 2.314 2.478 . 0 0 "[ . 1 . 2]" 1
1666 1 23 ARG HA 1 23 ARG QD . . 4.800 4.145 4.052 4.207 . 0 0 "[ . 1 . 2]" 1
1667 1 23 ARG QB 1 23 ARG QG . . 2.350 2.109 2.078 2.118 . 0 0 "[ . 1 . 2]" 1
1668 1 23 ARG QB 1 23 ARG QD . . 2.820 2.301 2.077 2.430 . 0 0 "[ . 1 . 2]" 1
1669 1 23 ARG QB 1 23 ARG HE . . 3.880 2.775 2.247 3.986 0.106 14 0 "[ . 1 . 2]" 1
1670 1 23 ARG QB 1 24 LYS H . . 3.650 2.278 2.173 2.359 . 0 0 "[ . 1 . 2]" 1
1671 1 23 ARG QD 1 23 ARG QG . . 2.320 2.034 1.988 2.131 . 0 0 "[ . 1 . 2]" 1
1672 1 23 ARG QG 1 24 LYS H . . 4.820 4.197 4.115 4.234 . 0 0 "[ . 1 . 2]" 1
1673 1 24 LYS H 1 24 LYS QB . . 3.240 2.390 2.354 2.438 . 0 0 "[ . 1 . 2]" 1
1674 1 24 LYS HA 1 24 LYS QG . . 2.970 2.286 2.236 2.386 . 0 0 "[ . 1 . 2]" 1
1675 1 24 LYS QB 1 24 LYS QG . . 2.300 2.127 2.104 2.133 . 0 0 "[ . 1 . 2]" 1
1676 1 24 LYS QB 1 24 LYS QE . . 2.840 2.207 2.033 2.716 . 0 0 "[ . 1 . 2]" 1
1677 1 24 LYS QE 1 24 LYS QG . . 2.560 2.298 2.247 2.542 . 0 0 "[ . 1 . 2]" 1
1678 1 24 LYS QG 1 25 ALA H . . 5.260 4.309 4.226 4.358 . 0 0 "[ . 1 . 2]" 1
1679 1 25 ALA HA 1 28 GLU QG . . 3.920 2.255 2.203 2.330 . 0 0 "[ . 1 . 2]" 1
1680 1 25 ALA HA 1 29 VAL QG . . 3.310 2.600 2.509 2.706 . 0 0 "[ . 1 . 2]" 1
1681 1 25 ALA MB 1 28 GLU QG . . 4.230 3.748 3.597 3.818 . 0 0 "[ . 1 . 2]" 1
1682 1 25 ALA MB 1 29 VAL QG . . 3.050 2.585 2.529 2.621 . 0 0 "[ . 1 . 2]" 1
1683 1 26 LYS H 1 26 LYS QD . . 3.990 3.939 3.777 4.006 0.016 8 0 "[ . 1 . 2]" 1
1684 1 26 LYS H 1 26 LYS QE . . 5.340 5.376 5.365 5.400 0.060 14 0 "[ . 1 . 2]" 1
1685 1 26 LYS H 1 29 VAL QG . . 4.720 3.959 3.840 4.007 . 0 0 "[ . 1 . 2]" 1
1686 1 26 LYS HA 1 26 LYS QG . . 3.050 2.556 2.522 2.597 . 0 0 "[ . 1 . 2]" 1
1687 1 26 LYS HA 1 26 LYS QD . . 3.250 2.416 2.234 2.573 . 0 0 "[ . 1 . 2]" 1
1688 1 26 LYS HA 1 26 LYS QE . . 3.580 3.193 3.165 3.217 . 0 0 "[ . 1 . 2]" 1
1689 1 26 LYS HA 1 28 GLU QG . . 4.920 4.958 4.920 4.978 0.058 12 0 "[ . 1 . 2]" 1
1690 1 26 LYS HA 1 29 VAL QG . . 3.120 2.841 2.689 2.916 . 0 0 "[ . 1 . 2]" 1
1691 1 26 LYS QE 1 26 LYS QG . . 2.540 2.029 1.971 2.312 . 0 0 "[ . 1 . 2]" 1
1692 1 26 LYS QG 1 30 PRO HA . . 3.700 2.404 2.362 2.452 . 0 0 "[ . 1 . 2]" 1
1693 1 26 LYS QG 1 30 PRO HB2 . . 4.570 4.537 4.481 4.580 0.010 11 0 "[ . 1 . 2]" 1
1694 1 26 LYS QG 1 30 PRO HD3 . . 5.340 5.016 4.908 5.241 . 0 0 "[ . 1 . 2]" 1
1695 1 26 LYS QG 1 31 ASP H . . 5.340 5.401 5.391 5.412 0.072 12 0 "[ . 1 . 2]" 1
1696 1 26 LYS QD 1 26 LYS QE . . 2.370 2.050 1.981 2.069 . 0 0 "[ . 1 . 2]" 1
1697 1 26 LYS QD 1 30 PRO HA . . 3.890 3.536 3.451 3.595 . 0 0 "[ . 1 . 2]" 1
1698 1 26 LYS QD 1 34 ILE HG12 . . 2.950 2.257 2.162 2.311 . 0 0 "[ . 1 . 2]" 1
1699 1 26 LYS QD 1 34 ILE MD . . 3.830 3.127 3.000 3.233 . 0 0 "[ . 1 . 2]" 1
1700 1 26 LYS QE 1 29 VAL QG . . 3.980 4.294 4.179 4.354 0.374 9 0 "[ . 1 . 2]" 1
1701 1 26 LYS QE 1 30 PRO HA . . 3.650 2.023 1.884 2.084 . 0 0 "[ . 1 . 2]" 1
1702 1 26 LYS QE 1 30 PRO HB2 . . 4.670 3.813 3.733 4.012 . 0 0 "[ . 1 . 2]" 1
1703 1 26 LYS QE 1 30 PRO HG2 . . 5.340 5.096 5.062 5.192 . 0 0 "[ . 1 . 2]" 1
1704 1 26 LYS QE 1 30 PRO HD2 . . 5.340 5.364 5.338 5.381 0.041 14 0 "[ . 1 . 2]" 1
1705 1 26 LYS QE 1 30 PRO HD3 . . 5.340 5.083 5.025 5.184 . 0 0 "[ . 1 . 2]" 1
1706 1 26 LYS QE 1 31 ASP H . . 5.060 3.785 3.712 3.829 . 0 0 "[ . 1 . 2]" 1
1707 1 26 LYS QE 1 31 ASP HA . . 4.640 4.183 3.931 4.340 . 0 0 "[ . 1 . 2]" 1
1708 1 26 LYS QE 1 32 ALA H . . 4.390 3.189 2.903 3.375 . 0 0 "[ . 1 . 2]" 1
1709 1 26 LYS QE 1 32 ALA MB . . 4.800 3.764 3.363 3.960 . 0 0 "[ . 1 . 2]" 1
1710 1 26 LYS QE 1 34 ILE HG13 . . 5.130 5.103 4.838 5.149 0.019 4 0 "[ . 1 . 2]" 1
1711 1 26 LYS QE 1 34 ILE MD . . 4.370 4.370 4.101 4.406 0.036 17 0 "[ . 1 . 2]" 1
1712 1 27 GLU H 1 27 GLU QB . . 3.670 2.246 2.096 2.308 . 0 0 "[ . 1 . 2]" 1
1713 1 27 GLU H 1 27 GLU QG . . 3.850 2.833 2.617 3.702 . 0 0 "[ . 1 . 2]" 1
1714 1 27 GLU H 1 28 GLU QG . . 4.710 4.479 4.385 4.544 . 0 0 "[ . 1 . 2]" 1
1715 1 27 GLU HA 1 27 GLU QG . . 2.780 2.259 2.184 2.392 . 0 0 "[ . 1 . 2]" 1
1716 1 28 GLU H 1 28 GLU QG . . 3.610 2.292 2.213 2.355 . 0 0 "[ . 1 . 2]" 1
1717 1 28 GLU H 1 29 VAL QG . . 4.010 3.779 3.748 3.816 . 0 0 "[ . 1 . 2]" 1
1718 1 28 GLU HA 1 28 GLU QG . . 3.410 3.368 3.348 3.413 0.003 4 0 "[ . 1 . 2]" 1
1719 1 28 GLU HA 1 29 VAL QG . . 4.160 4.145 4.059 4.203 0.043 14 0 "[ . 1 . 2]" 1
1720 1 28 GLU HB2 1 29 VAL QG . . 3.370 3.584 3.239 3.708 0.338 14 0 "[ . 1 . 2]" 1
1721 1 28 GLU QG 1 29 VAL HA . . 4.560 4.208 4.161 4.272 . 0 0 "[ . 1 . 2]" 1
1722 1 28 GLU QG 1 29 VAL QG . . 3.610 1.993 1.944 2.032 . 0 0 "[ . 1 . 2]" 1
1723 1 28 GLU QG 1 34 ILE MD . . 5.340 5.163 4.988 5.267 . 0 0 "[ . 1 . 2]" 1
1724 1 29 VAL H 1 29 VAL QG . . 3.780 2.429 2.390 2.448 . 0 0 "[ . 1 . 2]" 1
1725 1 29 VAL HA 1 29 VAL QG . . 2.750 2.286 2.260 2.307 . 0 0 "[ . 1 . 2]" 1
1726 1 29 VAL HB 1 31 ASP QB . . 4.610 3.959 3.582 4.508 . 0 0 "[ . 1 . 2]" 1
1727 1 29 VAL QG 1 30 PRO HA . . 4.280 4.425 4.387 4.458 0.178 2 0 "[ . 1 . 2]" 1
1728 1 29 VAL QG 1 30 PRO HD2 . . 3.910 3.737 3.707 3.764 . 0 0 "[ . 1 . 2]" 1
1729 1 29 VAL QG 1 30 PRO HD3 . . 4.060 4.091 4.031 4.110 0.050 3 0 "[ . 1 . 2]" 1
1730 1 29 VAL QG 1 31 ASP H . . 3.740 3.985 3.925 4.043 0.303 7 0 "[ . 1 . 2]" 1
1731 1 29 VAL QG 1 31 ASP HA . . 5.440 5.843 5.787 5.911 0.471 8 0 "[ . 1 . 2]" 1
1732 1 29 VAL QG 1 31 ASP QB . . 4.670 4.290 4.054 4.653 . 0 0 "[ . 1 . 2]" 1
1733 1 29 VAL QG 1 32 ALA H . . 3.200 3.396 3.350 3.448 0.248 7 0 "[ . 1 . 2]" 1
1734 1 29 VAL QG 1 32 ALA HA . . 4.180 4.322 4.173 4.384 0.204 8 0 "[ . 1 . 2]" 1
1735 1 29 VAL QG 1 32 ALA MB . . 2.600 2.000 1.960 2.059 . 0 0 "[ . 1 . 2]" 1
1736 1 30 PRO HB2 1 31 ASP QB . . 4.900 4.783 4.649 4.904 0.004 15 0 "[ . 1 . 2]" 1
1737 1 30 PRO HG2 1 31 ASP QB . . 4.280 3.666 3.489 3.856 . 0 0 "[ . 1 . 2]" 1
1738 1 30 PRO HD2 1 31 ASP QB . . 4.740 4.017 3.878 4.069 . 0 0 "[ . 1 . 2]" 1
1739 1 30 PRO HD3 1 31 ASP QB . . 5.340 5.360 5.342 5.381 0.041 4 0 "[ . 1 . 2]" 1
1740 1 31 ASP QB 1 32 ALA MB . . 4.430 3.771 3.552 4.207 . 0 0 "[ . 1 . 2]" 1
1741 1 32 ALA HA 1 33 GLU QG . . 4.240 3.461 3.280 3.637 . 0 0 "[ . 1 . 2]" 1
1742 1 33 GLU H 1 33 GLU QG . . 3.220 2.402 2.290 2.561 . 0 0 "[ . 1 . 2]" 1
1743 1 33 GLU HA 1 33 GLU QG . . 3.290 3.262 3.187 3.326 0.036 14 0 "[ . 1 . 2]" 1
1744 1 33 GLU QG 1 35 ARG HE . . 5.030 4.750 4.065 5.046 0.016 9 0 "[ . 1 . 2]" 1
1745 1 33 GLU QG 1 50 ALA HA . . 5.340 4.086 3.842 4.303 . 0 0 "[ . 1 . 2]" 1
1746 1 33 GLU QG 1 50 ALA MB . . 4.970 4.389 4.140 4.553 . 0 0 "[ . 1 . 2]" 1
1747 1 33 GLU QG 1 55 ALA MB . . 4.360 3.889 3.722 4.078 . 0 0 "[ . 1 . 2]" 1
1748 1 35 ARG H 1 46 VAL QG . . 5.240 4.740 4.305 4.897 . 0 0 "[ . 1 . 2]" 1
1749 1 35 ARG HA 1 46 VAL QG . . 4.960 4.574 4.441 4.635 . 0 0 "[ . 1 . 2]" 1
1750 1 35 ARG HB2 1 46 VAL QG . . 2.790 2.703 2.629 2.735 . 0 0 "[ . 1 . 2]" 1
1751 1 35 ARG HG2 1 46 VAL QG . . 2.960 2.503 2.132 2.668 . 0 0 "[ . 1 . 2]" 1
1752 1 35 ARG HD2 1 46 VAL QG . . 4.270 4.147 3.627 4.267 . 0 0 "[ . 1 . 2]" 1
1753 1 35 ARG HD3 1 46 VAL QG . . 4.230 3.998 3.285 4.196 . 0 0 "[ . 1 . 2]" 1
1754 1 35 ARG HE 1 46 VAL QG . . 4.260 3.379 1.973 4.073 . 0 0 "[ . 1 . 2]" 1
1755 1 36 THR H 1 46 VAL QG . . 3.900 3.635 3.546 3.721 . 0 0 "[ . 1 . 2]" 1
1756 1 36 THR HA 1 37 VAL QG . . 3.370 3.180 3.133 3.241 . 0 0 "[ . 1 . 2]" 1
1757 1 37 VAL H 1 37 VAL QG . . 4.130 2.489 2.413 2.536 . 0 0 "[ . 1 . 2]" 1
1758 1 37 VAL HA 1 46 VAL QG . . 4.010 3.750 3.666 3.941 . 0 0 "[ . 1 . 2]" 1
1759 1 37 VAL HB 1 46 VAL QG . . 3.590 3.239 3.043 3.619 0.029 13 0 "[ . 1 . 2]" 1
1760 1 37 VAL QG 1 38 THR H . . 3.480 2.721 2.615 2.877 . 0 0 "[ . 1 . 2]" 1
1761 1 37 VAL QG 1 38 THR HA . . 4.050 3.424 3.360 3.551 . 0 0 "[ . 1 . 2]" 1
1762 1 37 VAL QG 1 38 THR HB . . 4.890 4.613 4.552 4.714 . 0 0 "[ . 1 . 2]" 1
1763 1 37 VAL QG 1 39 THR H . . 3.310 2.723 2.512 2.965 . 0 0 "[ . 1 . 2]" 1
1764 1 37 VAL QG 1 41 GLU H . . 4.930 5.289 5.222 5.351 0.421 11 0 "[ . 1 . 2]" 1
1765 1 37 VAL QG 1 42 ASP H . . 3.830 4.168 4.078 4.237 0.407 13 0 "[ . 1 . 2]" 1
1766 1 37 VAL QG 1 42 ASP HA . . 4.220 4.246 4.097 4.370 0.150 17 0 "[ . 1 . 2]" 1
1767 1 37 VAL QG 1 42 ASP HB2 . . 3.150 2.794 2.532 3.024 . 0 0 "[ . 1 . 2]" 1
1768 1 37 VAL QG 1 42 ASP HB3 . . 3.040 3.019 2.861 3.163 0.123 16 0 "[ . 1 . 2]" 1
1769 1 37 VAL QG 1 43 ALA H . . 3.080 2.823 2.723 2.880 . 0 0 "[ . 1 . 2]" 1
1770 1 37 VAL QG 1 43 ALA MB . . 2.370 1.963 1.921 2.011 . 0 0 "[ . 1 . 2]" 1
1771 1 37 VAL QG 1 46 VAL H . . 4.450 3.958 3.697 4.238 . 0 0 "[ . 1 . 2]" 1
1772 1 37 VAL QG 1 71 LEU HG . . 3.220 2.620 2.504 2.764 . 0 0 "[ . 1 . 2]" 1
1773 1 38 THR H 1 46 VAL QG . . 5.440 5.087 5.009 5.401 . 0 0 "[ . 1 . 2]" 1
1774 1 38 THR H 1 71 LEU QD . . 4.770 4.718 4.546 4.871 0.101 15 0 "[ . 1 . 2]" 1
1775 1 38 THR HA 1 71 LEU QD . . 3.530 3.579 3.171 3.845 0.315 15 0 "[ . 1 . 2]" 1
1776 1 39 THR H 1 71 LEU QD . . 3.540 3.786 3.574 3.962 0.422 17 0 "[ . 1 . 2]" 1
1777 1 39 THR HA 1 40 LYS QB . . 4.570 4.390 4.315 4.473 . 0 0 "[ . 1 . 2]" 1
1778 1 39 THR HB 1 40 LYS QB . . 5.340 4.268 4.082 4.426 . 0 0 "[ . 1 . 2]" 1
1779 1 39 THR HB 1 71 LEU QD . . 4.220 3.935 3.799 4.015 . 0 0 "[ . 1 . 2]" 1
1780 1 40 LYS H 1 40 LYS QG . . 3.760 2.910 2.039 3.483 . 0 0 "[ . 1 . 2]" 1
1781 1 40 LYS H 1 40 LYS QD . . 4.730 2.856 2.169 3.872 . 0 0 "[ . 1 . 2]" 1
1782 1 40 LYS H 1 40 LYS QE . . 5.200 4.469 4.078 4.913 . 0 0 "[ . 1 . 2]" 1
1783 1 40 LYS H 1 71 LEU QD . . 3.950 2.607 2.505 2.747 . 0 0 "[ . 1 . 2]" 1
1784 1 40 LYS HA 1 40 LYS QG . . 3.510 3.528 3.511 3.543 0.033 1 0 "[ . 1 . 2]" 1
1785 1 40 LYS HA 1 71 LEU QD . . 3.260 2.556 2.257 2.948 . 0 0 "[ . 1 . 2]" 1
1786 1 40 LYS QB 1 40 LYS QG . . 2.370 1.991 1.973 2.018 . 0 0 "[ . 1 . 2]" 1
1787 1 40 LYS QB 1 41 GLU H . . 3.590 3.570 3.533 3.612 0.022 11 0 "[ . 1 . 2]" 1
1788 1 40 LYS QB 1 74 ILE MD . . 3.080 2.086 2.023 2.167 . 0 0 "[ . 1 . 2]" 1
1789 1 40 LYS QD 1 40 LYS QG . . 2.260 2.089 1.987 2.133 . 0 0 "[ . 1 . 2]" 1
1790 1 40 LYS QE 1 40 LYS QG . . 2.960 2.298 2.066 2.912 . 0 0 "[ . 1 . 2]" 1
1791 1 40 LYS QG 1 41 GLU H . . 3.740 2.826 2.613 3.046 . 0 0 "[ . 1 . 2]" 1
1792 1 40 LYS QD 1 40 LYS QE . . 2.340 2.083 2.012 2.131 . 0 0 "[ . 1 . 2]" 1
1793 1 40 LYS QD 1 41 GLU H . . 4.360 2.194 1.857 2.660 . 0 0 "[ . 1 . 2]" 1
1794 1 40 LYS QD 1 41 GLU HG3 . . 4.650 4.429 4.091 4.692 0.042 18 0 "[ . 1 . 2]" 1
1795 1 40 LYS QE 1 41 GLU H . . 4.370 3.794 3.500 4.378 0.008 18 0 "[ . 1 . 2]" 1
1796 1 40 LYS QE 1 41 GLU HA . . 4.700 4.136 3.117 4.713 0.013 9 0 "[ . 1 . 2]" 1
1797 1 41 GLU H 1 71 LEU QD . . 4.560 4.486 4.341 4.693 0.133 8 0 "[ . 1 . 2]" 1
1798 1 41 GLU HG2 1 71 LEU QD . . 5.440 5.482 5.214 5.681 0.241 5 0 "[ . 1 . 2]" 1
1799 1 41 GLU HG3 1 45 ARG QD . . 4.870 4.582 3.970 4.846 . 0 0 "[ . 1 . 2]" 1
1800 1 42 ASP H 1 45 ARG QD . . 4.780 4.705 4.059 4.836 0.056 13 0 "[ . 1 . 2]" 1
1801 1 42 ASP HA 1 45 ARG QB . . 3.490 2.666 2.076 3.545 0.055 16 0 "[ . 1 . 2]" 1
1802 1 42 ASP HA 1 45 ARG QG . . 4.400 3.189 2.117 3.982 . 0 0 "[ . 1 . 2]" 1
1803 1 42 ASP HA 1 45 ARG QD . . 3.770 2.400 1.968 2.723 . 0 0 "[ . 1 . 2]" 1
1804 1 42 ASP HA 1 46 VAL QG . . 4.040 3.516 3.438 3.625 . 0 0 "[ . 1 . 2]" 1
1805 1 42 ASP HB2 1 71 LEU QD . . 4.930 4.903 4.728 5.036 0.106 3 0 "[ . 1 . 2]" 1
1806 1 42 ASP HB3 1 46 VAL QG . . 4.100 3.272 3.139 3.441 . 0 0 "[ . 1 . 2]" 1
1807 1 43 ALA H 1 46 VAL QG . . 4.570 4.144 3.992 4.772 0.202 13 0 "[ . 1 . 2]" 1
1808 1 43 ALA H 1 71 LEU QD . . 4.290 4.307 4.109 4.527 0.237 4 0 "[ . 1 . 2]" 1
1809 1 43 ALA H 1 75 VAL QG . . 5.210 4.198 4.159 4.240 . 0 0 "[ . 1 . 2]" 1
1810 1 43 ALA HA 1 46 VAL QG . . 2.900 2.337 2.090 3.481 0.581 3 3 "[ + .- 1 * . 2]" 1
1811 1 43 ALA HA 1 75 VAL QG . . 3.340 2.119 2.073 2.154 . 0 0 "[ . 1 . 2]" 1
1812 1 43 ALA MB 1 75 VAL QG . . 2.590 1.961 1.944 1.990 . 0 0 "[ . 1 . 2]" 1
1813 1 44 LYS H 1 46 VAL QG . . 5.020 4.494 4.297 5.254 0.234 13 0 "[ . 1 . 2]" 1
1814 1 44 LYS H 1 75 VAL QG . . 4.610 4.342 4.307 4.396 . 0 0 "[ . 1 . 2]" 1
1815 1 44 LYS HA 1 44 LYS QG . . 3.110 2.242 2.203 2.288 . 0 0 "[ . 1 . 2]" 1
1816 1 44 LYS HA 1 44 LYS QD . . 3.560 3.593 3.581 3.606 0.046 11 0 "[ . 1 . 2]" 1
1817 1 44 LYS HA 1 44 LYS QE . . 4.260 4.192 4.122 4.272 0.012 6 0 "[ . 1 . 2]" 1
1818 1 44 LYS HA 1 48 GLU QG . . 5.340 4.611 4.382 4.676 . 0 0 "[ . 1 . 2]" 1
1819 1 44 LYS HB2 1 44 LYS QD . . 2.470 2.227 2.190 2.247 . 0 0 "[ . 1 . 2]" 1
1820 1 44 LYS QG 1 45 ARG H . . 4.440 3.580 3.453 3.720 . 0 0 "[ . 1 . 2]" 1
1821 1 44 LYS QG 1 48 GLU H . . 4.310 3.798 3.683 3.874 . 0 0 "[ . 1 . 2]" 1
1822 1 44 LYS QG 1 48 GLU QG . . 3.920 3.589 3.011 3.763 . 0 0 "[ . 1 . 2]" 1
1823 1 44 LYS QG 1 78 ILE MD . . 3.080 2.159 2.112 2.212 . 0 0 "[ . 1 . 2]" 1
1824 1 44 LYS QD 1 78 ILE MD . . 2.890 2.801 2.716 2.879 . 0 0 "[ . 1 . 2]" 1
1825 1 44 LYS QE 1 48 GLU HB3 . . 4.660 3.821 3.693 4.121 . 0 0 "[ . 1 . 2]" 1
1826 1 44 LYS QE 1 78 ILE MG . . 4.280 4.276 4.097 4.308 0.028 19 0 "[ . 1 . 2]" 1
1827 1 44 LYS QE 1 78 ILE HG13 . . 5.170 5.191 5.172 5.205 0.035 11 0 "[ . 1 . 2]" 1
1828 1 44 LYS QE 1 78 ILE MD . . 2.960 2.559 2.520 2.572 . 0 0 "[ . 1 . 2]" 1
1829 1 45 ARG H 1 45 ARG QB . . 2.810 2.169 2.012 2.399 . 0 0 "[ . 1 . 2]" 1
1830 1 45 ARG H 1 45 ARG QG . . 4.110 3.455 2.659 3.944 . 0 0 "[ . 1 . 2]" 1
1831 1 45 ARG H 1 45 ARG QD . . 3.990 3.880 3.437 4.021 0.031 18 0 "[ . 1 . 2]" 1
1832 1 45 ARG H 1 46 VAL QG . . 4.080 4.031 3.862 4.502 0.422 13 0 "[ . 1 . 2]" 1
1833 1 45 ARG HA 1 45 ARG QG . . 3.440 3.013 2.715 3.417 . 0 0 "[ . 1 . 2]" 1
1834 1 45 ARG HA 1 46 VAL QG . . 4.890 4.640 4.583 4.829 . 0 0 "[ . 1 . 2]" 1
1835 1 45 ARG HA 1 48 GLU QG . . 2.910 2.106 1.982 2.247 . 0 0 "[ . 1 . 2]" 1
1836 1 45 ARG QB 1 45 ARG QD . . 2.650 2.067 1.988 2.326 . 0 0 "[ . 1 . 2]" 1
1837 1 45 ARG QB 1 45 ARG HE . . 4.340 3.800 2.103 4.115 . 0 0 "[ . 1 . 2]" 1
1838 1 45 ARG QG 1 46 VAL QG . . 3.100 2.738 2.391 3.077 . 0 0 "[ . 1 . 2]" 1
1839 1 45 ARG QD 1 46 VAL H . . 4.190 3.855 3.543 4.235 0.045 4 0 "[ . 1 . 2]" 1
1840 1 45 ARG QD 1 46 VAL QG . . 4.200 3.460 2.889 4.217 0.017 16 0 "[ . 1 . 2]" 1
1841 1 46 VAL H 1 46 VAL QG . . 2.800 2.078 2.014 2.290 . 0 0 "[ . 1 . 2]" 1
1842 1 46 VAL HA 1 46 VAL QG . . 2.640 2.283 2.080 2.357 . 0 0 "[ . 1 . 2]" 1
1843 1 46 VAL HA 1 48 GLU QG . . 4.660 4.797 4.770 4.827 0.167 13 0 "[ . 1 . 2]" 1
1844 1 46 VAL QG 1 47 ALA H . . 3.290 2.395 2.247 3.032 . 0 0 "[ . 1 . 2]" 1
1845 1 46 VAL QG 1 49 GLU H . . 4.820 4.583 4.419 4.648 . 0 0 "[ . 1 . 2]" 1
1846 1 46 VAL QG 1 49 GLU HB2 . . 5.050 4.439 4.119 4.699 . 0 0 "[ . 1 . 2]" 1
1847 1 46 VAL QG 1 50 ALA H . . 5.040 4.601 4.098 4.710 . 0 0 "[ . 1 . 2]" 1
1848 1 47 ALA H 1 48 GLU QG . . 4.710 4.236 4.095 4.388 . 0 0 "[ . 1 . 2]" 1
1849 1 47 ALA H 1 75 VAL QG . . 3.630 3.069 2.992 3.146 . 0 0 "[ . 1 . 2]" 1
1850 1 47 ALA HA 1 48 GLU QG . . 5.340 5.360 5.340 5.388 0.048 17 0 "[ . 1 . 2]" 1
1851 1 47 ALA MB 1 48 GLU QG . . 4.680 4.369 4.318 4.421 . 0 0 "[ . 1 . 2]" 1
1852 1 48 GLU H 1 48 GLU QG . . 3.150 2.470 2.395 2.626 . 0 0 "[ . 1 . 2]" 1
1853 1 48 GLU H 1 75 VAL QG . . 5.250 4.783 4.738 4.819 . 0 0 "[ . 1 . 2]" 1
1854 1 48 GLU HA 1 48 GLU QG . . 3.410 3.308 3.268 3.417 0.007 6 0 "[ . 1 . 2]" 1
1855 1 48 GLU QG 1 49 GLU H . . 4.100 2.589 2.301 2.668 . 0 0 "[ . 1 . 2]" 1
1856 1 48 GLU QG 1 49 GLU HA . . 4.330 3.646 3.352 3.934 . 0 0 "[ . 1 . 2]" 1
1857 1 48 GLU QG 1 49 GLU HB2 . . 3.840 3.664 3.477 3.763 . 0 0 "[ . 1 . 2]" 1
1858 1 48 GLU QG 1 50 ALA H . . 5.340 4.799 4.702 4.847 . 0 0 "[ . 1 . 2]" 1
1859 1 48 GLU QG 1 51 GLU H . . 5.340 5.343 4.993 5.387 0.047 6 0 "[ . 1 . 2]" 1
1860 1 48 GLU QG 1 52 ARG QG . . 4.710 4.236 3.794 4.739 0.029 6 0 "[ . 1 . 2]" 1
1861 1 48 GLU QG 1 78 ILE MG . . 4.890 4.461 4.358 4.567 . 0 0 "[ . 1 . 2]" 1
1862 1 48 GLU QG 1 78 ILE MD . . 5.250 4.385 4.238 4.464 . 0 0 "[ . 1 . 2]" 1
1863 1 49 GLU H 1 49 GLU QG . . 4.510 3.981 3.926 4.135 . 0 0 "[ . 1 . 2]" 1
1864 1 49 GLU H 1 52 ARG QG . . 4.220 4.257 4.119 4.290 0.070 1 0 "[ . 1 . 2]" 1
1865 1 49 GLU H 1 52 ARG QD . . 5.340 5.319 5.199 5.404 0.064 2 0 "[ . 1 . 2]" 1
1866 1 49 GLU HA 1 49 GLU QG . . 3.380 2.295 2.196 2.793 . 0 0 "[ . 1 . 2]" 1
1867 1 49 GLU HA 1 52 ARG QD . . 3.860 3.824 3.666 3.910 0.050 15 0 "[ . 1 . 2]" 1
1868 1 49 GLU HA 1 53 ARG QD . . 5.070 4.181 3.900 4.932 . 0 0 "[ . 1 . 2]" 1
1869 1 49 GLU HB2 1 53 ARG QD . . 5.180 4.886 4.613 5.218 0.038 6 0 "[ . 1 . 2]" 1
1870 1 49 GLU HB3 1 53 ARG QD . . 4.000 3.655 3.353 3.979 . 0 0 "[ . 1 . 2]" 1
1871 1 49 GLU QG 1 50 ALA H . . 4.770 4.030 3.677 4.367 . 0 0 "[ . 1 . 2]" 1
1872 1 49 GLU QG 1 52 ARG H . . 5.340 4.630 4.516 5.119 . 0 0 "[ . 1 . 2]" 1
1873 1 49 GLU QG 1 53 ARG QD . . 3.750 2.827 2.219 3.830 0.080 17 0 "[ . 1 . 2]" 1
1874 1 50 ALA H 1 53 ARG QD . . 4.210 4.029 3.802 4.210 . 0 0 "[ . 1 . 2]" 1
1875 1 50 ALA HA 1 53 ARG QD . . 4.640 2.339 2.199 2.494 . 0 0 "[ . 1 . 2]" 1
1876 1 50 ALA MB 1 51 GLU QG . . 5.150 4.419 4.226 4.744 . 0 0 "[ . 1 . 2]" 1
1877 1 50 ALA MB 1 53 ARG QD . . 4.290 3.665 3.520 3.805 . 0 0 "[ . 1 . 2]" 1
1878 1 51 GLU H 1 51 GLU QG . . 3.570 2.356 2.198 2.831 . 0 0 "[ . 1 . 2]" 1
1879 1 51 GLU H 1 52 ARG QG . . 3.600 3.667 3.583 3.723 0.123 17 0 "[ . 1 . 2]" 1
1880 1 51 GLU H 1 52 ARG QD . . 4.960 4.410 4.153 5.047 0.087 7 0 "[ . 1 . 2]" 1
1881 1 51 GLU HB2 1 51 GLU QG . . 2.620 2.475 2.377 2.567 . 0 0 "[ . 1 . 2]" 1
1882 1 51 GLU QG 1 52 ARG H . . 4.020 2.801 2.518 3.063 . 0 0 "[ . 1 . 2]" 1
1883 1 51 GLU QG 1 52 ARG QD . . 4.420 2.445 2.127 3.065 . 0 0 "[ . 1 . 2]" 1
1884 1 51 GLU QG 1 78 ILE MG . . 4.390 3.447 2.746 3.676 . 0 0 "[ . 1 . 2]" 1
1885 1 51 GLU QG 1 78 ILE MD . . 5.340 5.193 4.664 5.356 0.016 19 0 "[ . 1 . 2]" 1
1886 1 51 GLU QG 1 79 ILE MD . . 4.550 3.617 3.127 3.970 . 0 0 "[ . 1 . 2]" 1
1887 1 51 GLU QG 1 82 ALA MB . . 3.980 3.748 3.455 3.958 . 0 0 "[ . 1 . 2]" 1
1888 1 52 ARG H 1 52 ARG QG . . 3.440 2.096 1.987 2.178 . 0 0 "[ . 1 . 2]" 1
1889 1 52 ARG H 1 52 ARG QD . . 3.760 3.072 2.853 3.800 0.040 7 0 "[ . 1 . 2]" 1
1890 1 52 ARG H 1 53 ARG QD . . 4.770 4.066 3.605 4.781 0.011 6 0 "[ . 1 . 2]" 1
1891 1 52 ARG HA 1 52 ARG QG . . 3.270 3.176 3.114 3.257 . 0 0 "[ . 1 . 2]" 1
1892 1 52 ARG HA 1 52 ARG QD . . 3.210 2.426 2.231 3.269 0.059 7 0 "[ . 1 . 2]" 1
1893 1 52 ARG HB2 1 52 ARG QG . . 2.520 2.149 2.131 2.172 . 0 0 "[ . 1 . 2]" 1
1894 1 52 ARG QD 1 52 ARG QG . . 2.340 2.029 1.953 2.090 . 0 0 "[ . 1 . 2]" 1
1895 1 52 ARG QD 1 53 ARG H . . 5.340 4.695 4.540 5.316 . 0 0 "[ . 1 . 2]" 1
1896 1 53 ARG H 1 53 ARG QD . . 3.830 2.865 2.362 3.675 . 0 0 "[ . 1 . 2]" 1
1897 1 53 ARG QD 1 53 ARG HG2 . . 2.540 2.213 2.190 2.330 . 0 0 "[ . 1 . 2]" 1
1898 1 53 ARG QD 1 54 ASN H . . 4.620 4.401 4.166 4.667 0.047 6 0 "[ . 1 . 2]" 1
1899 1 57 ILE MG 1 85 LYS QD . . 3.200 2.499 2.342 2.961 . 0 0 "[ . 1 . 2]" 1
1900 1 57 ILE MG 1 85 LYS QE . . 4.620 4.115 3.740 4.425 . 0 0 "[ . 1 . 2]" 1
1901 1 57 ILE MD 1 85 LYS QD . . 3.620 3.354 3.127 3.630 0.010 4 0 "[ . 1 . 2]" 1
1902 1 59 VAL H 1 60 ILE QG . . 5.060 5.012 4.906 5.064 0.004 11 0 "[ . 1 . 2]" 1
1903 1 59 VAL QG 1 87 ILE H . . 4.440 4.135 4.103 4.176 . 0 0 "[ . 1 . 2]" 1
1904 1 59 VAL QG 1 87 ILE HG12 . . 3.040 2.540 2.156 2.606 . 0 0 "[ . 1 . 2]" 1
1905 1 59 VAL QG 1 88 GLU HA . . 4.400 4.564 4.391 4.689 0.289 3 0 "[ . 1 . 2]" 1
1906 1 60 ILE H 1 60 ILE QG . . 3.150 2.157 2.104 2.313 . 0 0 "[ . 1 . 2]" 1
1907 1 60 ILE H 1 76 LYS QE . . 5.340 5.370 5.351 5.411 0.071 11 0 "[ . 1 . 2]" 1
1908 1 60 ILE H 1 88 GLU QG . . 4.520 4.227 4.122 4.332 . 0 0 "[ . 1 . 2]" 1
1909 1 60 ILE HA 1 60 ILE QG . . 3.640 3.189 3.173 3.206 . 0 0 "[ . 1 . 2]" 1
1910 1 60 ILE HB 1 88 GLU QG . . 3.650 2.304 2.176 2.495 . 0 0 "[ . 1 . 2]" 1
1911 1 60 ILE MG 1 62 GLY QA . . 4.070 3.876 3.699 3.987 . 0 0 "[ . 1 . 2]" 1
1912 1 60 ILE MG 1 88 GLU QG . . 3.780 2.792 2.721 2.933 . 0 0 "[ . 1 . 2]" 1
1913 1 60 ILE QG 1 61 VAL H . . 4.890 4.818 4.770 4.943 0.053 7 0 "[ . 1 . 2]" 1
1914 1 60 ILE QG 1 76 LYS HA . . 5.120 3.874 3.725 3.984 . 0 0 "[ . 1 . 2]" 1
1915 1 60 ILE QG 1 76 LYS HB2 . . 4.030 2.653 2.538 2.725 . 0 0 "[ . 1 . 2]" 1
1916 1 60 ILE QG 1 76 LYS QE . . 3.620 3.196 3.096 3.304 . 0 0 "[ . 1 . 2]" 1
1917 1 60 ILE QG 1 86 THR HA . . 4.830 3.911 3.873 3.962 . 0 0 "[ . 1 . 2]" 1
1918 1 60 ILE QG 1 86 THR HB . . 3.880 3.985 3.963 4.004 0.124 13 0 "[ . 1 . 2]" 1
1919 1 60 ILE QG 1 86 THR MG . . 4.150 2.092 2.014 2.133 . 0 0 "[ . 1 . 2]" 1
1920 1 60 ILE QG 1 87 ILE H . . 4.420 2.902 2.868 2.952 . 0 0 "[ . 1 . 2]" 1
1921 1 60 ILE QG 1 88 GLU HA . . 4.730 3.805 3.730 3.859 . 0 0 "[ . 1 . 2]" 1
1922 1 60 ILE QG 1 88 GLU QG . . 3.860 2.925 2.850 3.049 . 0 0 "[ . 1 . 2]" 1
1923 1 60 ILE MD 1 76 LYS QE . . 4.750 4.447 4.348 4.540 . 0 0 "[ . 1 . 2]" 1
1924 1 61 VAL HA 1 61 VAL QG . . 2.950 2.143 2.118 2.170 . 0 0 "[ . 1 . 2]" 1
1925 1 61 VAL QG 1 62 GLY H . . 4.760 2.817 2.602 3.229 . 0 0 "[ . 1 . 2]" 1
1926 1 62 GLY QA 1 63 PRO HB3 . . 5.020 4.656 4.523 5.061 0.041 10 0 "[ . 1 . 2]" 1
1927 1 62 GLY QA 1 63 PRO QG . . 4.130 3.765 3.559 3.825 . 0 0 "[ . 1 . 2]" 1
1928 1 62 GLY QA 1 72 ALA MB . . 3.600 3.313 3.141 3.405 . 0 0 "[ . 1 . 2]" 1
1929 1 62 GLY QA 1 90 THR MG . . 5.340 4.108 3.642 4.482 . 0 0 "[ . 1 . 2]" 1
1930 1 62 GLY QA 1 91 THR H . . 5.340 5.110 4.528 5.370 0.030 13 0 "[ . 1 . 2]" 1
1931 1 62 GLY QA 1 91 THR MG . . 5.340 4.266 3.704 5.031 . 0 0 "[ . 1 . 2]" 1
1932 1 63 PRO HB2 1 64 SER QB . . 4.030 3.546 3.324 3.802 . 0 0 "[ . 1 . 2]" 1
1933 1 63 PRO HB2 1 69 SER QB . . 5.340 4.788 3.910 5.376 0.036 6 0 "[ . 1 . 2]" 1
1934 1 63 PRO QG 1 64 SER H . . 3.750 2.049 1.791 3.577 . 0 0 "[ . 1 . 2]" 1
1935 1 63 PRO QG 1 69 SER HA . . 4.400 3.977 3.401 4.407 0.007 12 0 "[ . 1 . 2]" 1
1936 1 63 PRO QG 1 69 SER QB . . 4.360 2.740 2.184 4.355 . 0 0 "[ . 1 . 2]" 1
1937 1 63 PRO HD2 1 69 SER QB . . 4.120 2.719 2.135 3.663 . 0 0 "[ . 1 . 2]" 1
1938 1 64 SER H 1 64 SER QB . . 3.160 3.113 2.881 3.242 0.082 14 0 "[ . 1 . 2]" 1
1939 1 64 SER QB 1 90 THR MG . . 3.370 3.353 3.083 3.415 0.045 18 0 "[ . 1 . 2]" 1
1940 1 66 SER HA 1 66 SER QB . . 2.580 2.354 2.163 2.521 . 0 0 "[ . 1 . 2]" 1
1941 1 66 SER QB 1 67 GLY H . . 3.480 3.277 2.580 3.522 0.042 13 0 "[ . 1 . 2]" 1
1942 1 67 GLY QA 1 68 LYS HA . . 4.310 4.107 3.823 4.324 0.014 17 0 "[ . 1 . 2]" 1
1943 1 67 GLY QA 1 68 LYS QB . . 4.710 3.997 3.676 4.424 . 0 0 "[ . 1 . 2]" 1
1944 1 67 GLY QA 1 68 LYS QD . . 4.930 4.195 3.100 5.099 0.169 11 0 "[ . 1 . 2]" 1
1945 1 67 GLY QA 1 69 SER H . . 4.480 3.775 3.034 4.511 0.031 11 0 "[ . 1 . 2]" 1
1946 1 68 LYS H 1 68 LYS QB . . 3.470 2.706 2.106 3.512 0.042 17 0 "[ . 1 . 2]" 1
1947 1 68 LYS H 1 68 LYS QG . . 3.920 3.239 2.036 3.945 0.025 11 0 "[ . 1 . 2]" 1
1948 1 68 LYS H 1 68 LYS QD . . 4.330 2.818 2.001 4.261 . 0 0 "[ . 1 . 2]" 1
1949 1 68 LYS HA 1 68 LYS QG . . 3.440 3.457 3.225 3.499 0.059 13 0 "[ . 1 . 2]" 1
1950 1 68 LYS QB 1 68 LYS QG . . 2.240 1.998 1.964 2.040 . 0 0 "[ . 1 . 2]" 1
1951 1 68 LYS QB 1 69 SER H . . 4.090 3.718 2.234 4.013 . 0 0 "[ . 1 . 2]" 1
1952 1 68 LYS QD 1 68 LYS QG . . 2.330 2.084 1.946 2.126 . 0 0 "[ . 1 . 2]" 1
1953 1 68 LYS QG 1 69 SER H . . 4.290 3.365 1.995 4.101 . 0 0 "[ . 1 . 2]" 1
1954 1 68 LYS QG 1 69 SER HA . . 3.990 3.798 3.109 4.052 0.062 20 0 "[ . 1 . 2]" 1
1955 1 68 LYS QG 1 70 THR H . . 5.060 4.836 4.450 5.114 0.054 1 0 "[ . 1 . 2]" 1
1956 1 68 LYS QD 1 69 SER H . . 3.860 2.683 2.082 3.918 0.058 11 0 "[ . 1 . 2]" 1
1957 1 68 LYS QD 1 69 SER HA . . 4.320 3.333 2.501 4.336 0.016 15 0 "[ . 1 . 2]" 1
1958 1 68 LYS QD 1 70 THR H . . 4.570 4.394 3.163 4.645 0.075 18 0 "[ . 1 . 2]" 1
1959 1 68 LYS QE 1 69 SER QB . . 4.990 4.436 3.794 5.038 0.048 6 0 "[ . 1 . 2]" 1
1960 1 69 SER H 1 69 SER QB . . 3.710 2.626 2.224 3.131 . 0 0 "[ . 1 . 2]" 1
1961 1 69 SER HA 1 71 LEU QD . . 3.620 2.963 2.307 3.595 . 0 0 "[ . 1 . 2]" 1
1962 1 69 SER QB 1 71 LEU QD . . 5.280 4.264 3.383 4.782 . 0 0 "[ . 1 . 2]" 1
1963 1 69 SER QB 1 72 ALA MB . . 3.100 2.878 2.444 3.119 0.019 5 0 "[ . 1 . 2]" 1
1964 1 70 THR H 1 71 LEU QD . . 4.690 3.126 2.859 3.330 . 0 0 "[ . 1 . 2]" 1
1965 1 70 THR HA 1 71 LEU QD . . 4.700 4.125 4.055 4.185 . 0 0 "[ . 1 . 2]" 1
1966 1 70 THR HA 1 73 LYS QB . . 4.130 3.864 2.233 4.182 0.052 12 0 "[ . 1 . 2]" 1
1967 1 70 THR HA 1 73 LYS QG . . 3.940 2.346 2.075 4.008 0.068 14 0 "[ . 1 . 2]" 1
1968 1 70 THR HA 1 73 LYS QD . . 3.170 3.159 2.961 3.198 0.028 8 0 "[ . 1 . 2]" 1
1969 1 70 THR HA 1 73 LYS QE . . 4.670 4.120 3.724 4.383 . 0 0 "[ . 1 . 2]" 1
1970 1 70 THR HB 1 71 LEU QD . . 3.420 2.352 2.204 2.469 . 0 0 "[ . 1 . 2]" 1
1971 1 70 THR HB 1 73 LYS QE . . 5.340 5.238 4.650 5.376 0.036 1 0 "[ . 1 . 2]" 1
1972 1 70 THR MG 1 73 LYS QD . . 3.180 2.441 2.342 2.609 . 0 0 "[ . 1 . 2]" 1
1973 1 70 THR MG 1 73 LYS QE . . 3.830 2.761 2.137 2.911 . 0 0 "[ . 1 . 2]" 1
1974 1 71 LEU H 1 71 LEU QD . . 3.350 1.669 1.613 1.734 . 0 0 "[ . 1 . 2]" 1
1975 1 71 LEU HA 1 71 LEU QD . . 2.940 2.367 2.234 2.531 . 0 0 "[ . 1 . 2]" 1
1976 1 71 LEU HA 1 74 ILE QG . . 4.400 3.439 3.040 3.620 . 0 0 "[ . 1 . 2]" 1
1977 1 71 LEU HB2 1 71 LEU QD . . 3.100 2.212 2.183 2.227 . 0 0 "[ . 1 . 2]" 1
1978 1 71 LEU QD 1 72 ALA H . . 3.640 3.387 3.144 3.584 . 0 0 "[ . 1 . 2]" 1
1979 1 71 LEU QD 1 74 ILE HB . . 3.650 3.981 3.728 4.241 0.591 8 4 "[ **- + 1 . 2]" 1
1980 1 72 ALA MB 1 76 LYS QE . . 4.230 4.175 4.073 4.240 0.010 3 0 "[ . 1 . 2]" 1
1981 1 72 ALA MB 1 88 GLU QG . . 3.340 2.575 2.290 2.919 . 0 0 "[ . 1 . 2]" 1
1982 1 73 LYS H 1 73 LYS QG . . 3.430 2.581 2.262 3.578 0.148 14 0 "[ . 1 . 2]" 1
1983 1 73 LYS H 1 73 LYS QD . . 4.420 4.361 4.306 4.462 0.042 14 0 "[ . 1 . 2]" 1
1984 1 73 LYS H 1 73 LYS QE . . 5.020 4.526 3.882 5.070 0.050 15 0 "[ . 1 . 2]" 1
1985 1 73 LYS H 1 76 LYS QE . . 5.340 5.157 4.859 5.280 . 0 0 "[ . 1 . 2]" 1
1986 1 73 LYS HA 1 73 LYS QB . . 2.510 2.146 2.094 2.498 . 0 0 "[ . 1 . 2]" 1
1987 1 73 LYS HA 1 73 LYS QE . . 5.040 4.104 3.694 4.993 . 0 0 "[ . 1 . 2]" 1
1988 1 73 LYS HA 1 76 LYS QE . . 3.910 3.259 2.766 3.593 . 0 0 "[ . 1 . 2]" 1
1989 1 73 LYS QD 1 73 LYS QG . . 2.360 2.032 1.988 2.086 . 0 0 "[ . 1 . 2]" 1
1990 1 73 LYS QG 1 74 ILE H . . 3.720 2.549 2.352 3.846 0.126 14 0 "[ . 1 . 2]" 1
1991 1 73 LYS QE 1 74 ILE H . . 4.390 3.505 2.674 3.903 . 0 0 "[ . 1 . 2]" 1
1992 1 73 LYS QE 1 74 ILE HA . . 3.280 3.269 2.832 3.408 0.128 16 0 "[ . 1 . 2]" 1
1993 1 73 LYS QE 1 74 ILE MG . . 4.760 4.623 4.267 4.741 . 0 0 "[ . 1 . 2]" 1
1994 1 73 LYS QE 1 74 ILE QG . . 4.840 2.613 2.046 2.744 . 0 0 "[ . 1 . 2]" 1
1995 1 73 LYS QE 1 74 ILE MD . . 4.060 3.963 3.471 4.080 0.020 3 0 "[ . 1 . 2]" 1
1996 1 74 ILE H 1 74 ILE QG . . 3.090 2.368 2.238 2.441 . 0 0 "[ . 1 . 2]" 1
1997 1 74 ILE H 1 75 VAL QG . . 4.600 4.372 4.325 4.465 . 0 0 "[ . 1 . 2]" 1
1998 1 74 ILE HA 1 74 ILE QG . . 2.960 2.367 2.331 2.385 . 0 0 "[ . 1 . 2]" 1
1999 1 74 ILE HA 1 77 LYS QB . . 3.280 2.658 2.488 2.840 . 0 0 "[ . 1 . 2]" 1
2000 1 74 ILE QG 1 74 ILE MG . . 2.810 2.277 2.250 2.330 . 0 0 "[ . 1 . 2]" 1
2001 1 74 ILE QG 1 75 VAL H . . 4.810 4.273 4.206 4.323 . 0 0 "[ . 1 . 2]" 1
2002 1 75 VAL H 1 75 VAL QG . . 3.160 2.168 2.126 2.211 . 0 0 "[ . 1 . 2]" 1
2003 1 75 VAL HA 1 75 VAL QG . . 2.690 2.205 2.178 2.228 . 0 0 "[ . 1 . 2]" 1
2004 1 75 VAL QG 1 77 LYS H . . 4.770 4.613 4.559 4.650 . 0 0 "[ . 1 . 2]" 1
2005 1 75 VAL QG 1 79 ILE H . . 4.370 3.917 3.858 3.949 . 0 0 "[ . 1 . 2]" 1
2006 1 76 LYS H 1 76 LYS QE . . 4.540 4.210 4.124 4.272 . 0 0 "[ . 1 . 2]" 1
2007 1 76 LYS HA 1 76 LYS QG . . 3.270 2.497 2.460 2.529 . 0 0 "[ . 1 . 2]" 1
2008 1 76 LYS HA 1 76 LYS QD . . 3.830 3.638 3.552 3.839 0.009 11 0 "[ . 1 . 2]" 1
2009 1 76 LYS HA 1 76 LYS QE . . 4.680 4.301 4.206 4.350 . 0 0 "[ . 1 . 2]" 1
2010 1 76 LYS HB2 1 76 LYS QE . . 3.500 2.171 2.114 2.248 . 0 0 "[ . 1 . 2]" 1
2011 1 76 LYS QE 1 76 LYS QG . . 3.280 2.900 2.601 2.946 . 0 0 "[ . 1 . 2]" 1
2012 1 76 LYS QG 1 86 THR HB . . 4.100 2.225 2.176 2.254 . 0 0 "[ . 1 . 2]" 1
2013 1 76 LYS QG 1 86 THR MG . . 3.570 2.968 2.883 3.048 . 0 0 "[ . 1 . 2]" 1
2014 1 76 LYS QD 1 76 LYS QE . . 2.360 1.997 1.985 2.085 . 0 0 "[ . 1 . 2]" 1
2015 1 76 LYS QD 1 86 THR MG . . 3.750 2.613 2.447 2.935 . 0 0 "[ . 1 . 2]" 1
2016 1 76 LYS QD 1 87 ILE HA . . 4.230 3.290 3.138 3.502 . 0 0 "[ . 1 . 2]" 1
2017 1 76 LYS QD 1 88 GLU QG . . 3.840 3.480 3.323 3.765 . 0 0 "[ . 1 . 2]" 1
2018 1 76 LYS QE 1 86 THR HB . . 4.920 3.904 3.784 3.974 . 0 0 "[ . 1 . 2]" 1
2019 1 76 LYS QE 1 86 THR MG . . 4.090 3.480 3.324 3.574 . 0 0 "[ . 1 . 2]" 1
2020 1 76 LYS QE 1 87 ILE HA . . 4.420 3.302 3.130 3.969 . 0 0 "[ . 1 . 2]" 1
2021 1 76 LYS QE 1 88 GLU H . . 4.950 3.857 3.570 4.685 . 0 0 "[ . 1 . 2]" 1
2022 1 76 LYS QE 1 88 GLU QG . . 3.830 1.980 1.929 2.097 . 0 0 "[ . 1 . 2]" 1
2023 1 77 LYS H 1 77 LYS QB . . 2.820 2.321 1.994 2.386 . 0 0 "[ . 1 . 2]" 1
2024 1 77 LYS H 1 77 LYS QG . . 3.410 2.773 2.592 3.630 0.220 1 0 "[ . 1 . 2]" 1
2025 1 77 LYS HA 1 77 LYS QG . . 3.100 2.818 2.679 3.147 0.047 1 0 "[ . 1 . 2]" 1
2026 1 77 LYS HA 1 77 LYS QD . . 3.510 2.197 2.087 2.707 . 0 0 "[ . 1 . 2]" 1
2027 1 77 LYS HA 1 77 LYS QE . . 4.330 3.529 1.952 4.256 . 0 0 "[ . 1 . 2]" 1
2028 1 77 LYS QB 1 78 ILE HG13 . . 4.210 4.108 3.991 4.224 0.014 1 0 "[ . 1 . 2]" 1
2029 1 77 LYS QE 1 77 LYS QG . . 2.840 2.286 2.107 2.514 . 0 0 "[ . 1 . 2]" 1
2030 1 78 ILE HA 1 81 ARG QD . . 3.390 2.823 2.256 3.103 . 0 0 "[ . 1 . 2]" 1
2031 1 78 ILE HB 1 81 ARG QD . . 5.330 5.127 4.659 5.341 0.011 4 0 "[ . 1 . 2]" 1
2032 1 78 ILE MG 1 81 ARG QD . . 4.010 3.381 2.913 4.000 . 0 0 "[ . 1 . 2]" 1
2033 1 78 ILE MD 1 81 ARG QD . . 5.340 4.787 4.371 5.298 . 0 0 "[ . 1 . 2]" 1
2034 1 79 ILE MG 1 81 ARG QD . . 5.340 5.374 5.340 5.441 0.101 18 0 "[ . 1 . 2]" 1
2035 1 81 ARG H 1 81 ARG QB . . 2.830 2.645 2.514 2.710 . 0 0 "[ . 1 . 2]" 1
2036 1 81 ARG H 1 81 ARG QG . . 3.320 2.683 1.829 3.423 0.103 8 0 "[ . 1 . 2]" 1
2037 1 81 ARG H 1 81 ARG QD . . 3.500 2.672 1.823 3.557 0.057 15 0 "[ . 1 . 2]" 1
2038 1 81 ARG HA 1 81 ARG QG . . 3.490 3.416 3.358 3.453 . 0 0 "[ . 1 . 2]" 1
2039 1 81 ARG HA 1 81 ARG QD . . 4.030 3.928 3.750 4.034 0.004 1 0 "[ . 1 . 2]" 1
2040 1 81 ARG QB 1 81 ARG QG . . 2.310 2.025 2.012 2.038 . 0 0 "[ . 1 . 2]" 1
2041 1 81 ARG QB 1 81 ARG QD . . 2.880 2.581 2.307 2.802 . 0 0 "[ . 1 . 2]" 1
2042 1 81 ARG QB 1 82 ALA H . . 4.000 3.750 3.654 3.877 . 0 0 "[ . 1 . 2]" 1
2043 1 81 ARG QB 1 83 GLY H . . 5.340 4.903 4.741 5.009 . 0 0 "[ . 1 . 2]" 1
2044 1 81 ARG QG 1 82 ALA H . . 3.540 2.828 2.469 3.189 . 0 0 "[ . 1 . 2]" 1
2045 1 81 ARG QG 1 82 ALA HA . . 4.220 3.776 3.212 4.279 0.059 6 0 "[ . 1 . 2]" 1
2046 1 81 ARG QG 1 83 GLY H . . 4.740 4.809 4.778 4.823 0.083 4 0 "[ . 1 . 2]" 1
2047 1 81 ARG QD 1 82 ALA H . . 4.480 2.705 2.604 3.097 . 0 0 "[ . 1 . 2]" 1
2048 1 81 ARG QD 1 82 ALA HA . . 4.550 3.617 2.576 4.544 . 0 0 "[ . 1 . 2]" 1
2049 1 81 ARG QD 1 82 ALA MB . . 4.310 3.352 2.845 3.821 . 0 0 "[ . 1 . 2]" 1
2050 1 85 LYS H 1 85 LYS QD . . 4.480 4.060 3.801 4.193 . 0 0 "[ . 1 . 2]" 1
2051 1 85 LYS QD 1 102 ALA MB . . 3.360 2.279 2.086 2.771 . 0 0 "[ . 1 . 2]" 1
2052 1 85 LYS QD 1 106 TRP HB2 . . 4.020 2.235 2.075 2.341 . 0 0 "[ . 1 . 2]" 1
2053 1 85 LYS QD 1 106 TRP HB3 . . 4.350 3.805 3.619 3.966 . 0 0 "[ . 1 . 2]" 1
2054 1 85 LYS QD 1 106 TRP HD1 . . 4.700 2.065 2.003 2.208 . 0 0 "[ . 1 . 2]" 1
2055 1 85 LYS QD 1 106 TRP HE1 . . 4.310 4.333 3.979 4.406 0.096 19 0 "[ . 1 . 2]" 1
2056 1 85 LYS QE 1 102 ALA HA . . 4.870 3.519 1.957 4.255 . 0 0 "[ . 1 . 2]" 1
2057 1 85 LYS QE 1 102 ALA MB . . 4.210 3.609 2.133 4.151 . 0 0 "[ . 1 . 2]" 1
2058 1 85 LYS QE 1 106 TRP H . . 4.360 3.737 3.242 4.401 0.041 2 0 "[ . 1 . 2]" 1
2059 1 85 LYS QE 1 106 TRP HA . . 4.690 3.086 2.204 4.712 0.022 16 0 "[ . 1 . 2]" 1
2060 1 85 LYS QE 1 106 TRP HD1 . . 4.470 2.863 2.086 4.352 . 0 0 "[ . 1 . 2]" 1
2061 1 86 THR HB 1 88 GLU QG . . 5.280 5.298 5.231 5.315 0.035 6 0 "[ . 1 . 2]" 1
2062 1 86 THR MG 1 88 GLU QG . . 4.560 4.165 4.037 4.272 . 0 0 "[ . 1 . 2]" 1
2063 1 87 ILE H 1 88 GLU QG . . 5.000 4.777 4.709 4.911 . 0 0 "[ . 1 . 2]" 1
2064 1 87 ILE HA 1 88 GLU QB . . 4.200 4.152 4.077 4.200 0.000 9 0 "[ . 1 . 2]" 1
2065 1 87 ILE HA 1 88 GLU QG . . 4.260 3.826 3.708 3.970 . 0 0 "[ . 1 . 2]" 1
2066 1 87 ILE MG 1 101 LYS QG . . 4.220 3.174 2.608 4.256 0.036 10 0 "[ . 1 . 2]" 1
2067 1 88 GLU H 1 88 GLU QB . . 3.290 2.593 2.532 2.636 . 0 0 "[ . 1 . 2]" 1
2068 1 88 GLU H 1 88 GLU QG . . 3.660 3.369 3.302 3.428 . 0 0 "[ . 1 . 2]" 1
2069 1 88 GLU H 1 89 VAL QG . . 4.170 3.833 3.640 4.052 . 0 0 "[ . 1 . 2]" 1
2070 1 88 GLU HA 1 88 GLU QG . . 3.460 2.315 2.219 2.361 . 0 0 "[ . 1 . 2]" 1
2071 1 88 GLU HA 1 89 VAL QG . . 3.910 3.510 3.389 3.646 . 0 0 "[ . 1 . 2]" 1
2072 1 88 GLU QB 1 89 VAL H . . 4.010 3.752 3.708 3.799 . 0 0 "[ . 1 . 2]" 1
2073 1 89 VAL H 1 89 VAL QG . . 3.110 1.998 1.946 2.071 . 0 0 "[ . 1 . 2]" 1
2074 1 89 VAL H 1 99 VAL QG . . 5.000 4.902 4.841 4.943 . 0 0 "[ . 1 . 2]" 1
2075 1 89 VAL HA 1 99 VAL QG . . 4.420 4.024 3.651 4.270 . 0 0 "[ . 1 . 2]" 1
2076 1 89 VAL QG 1 91 THR H . . 5.090 5.432 4.875 5.943 0.853 15 9 "[* *.* *1 *+* *-]" 1
2077 1 89 VAL QG 1 95 LEU HA . . 3.270 3.458 3.080 3.885 0.615 15 1 "[ . 1 + 2]" 1
2078 1 89 VAL QG 1 98 ALA H . . 4.050 4.205 3.889 4.375 0.325 13 0 "[ . 1 . 2]" 1
2079 1 89 VAL QG 1 98 ALA HA . . 4.080 3.984 3.840 4.133 0.053 11 0 "[ . 1 . 2]" 1
2080 1 89 VAL QG 1 98 ALA MB . . 2.760 2.038 1.969 2.119 . 0 0 "[ . 1 . 2]" 1
2081 1 89 VAL QG 1 99 VAL H . . 4.080 2.728 2.322 2.899 . 0 0 "[ . 1 . 2]" 1
2082 1 89 VAL QG 1 99 VAL HA . . 3.410 2.630 2.389 2.882 . 0 0 "[ . 1 . 2]" 1
2083 1 89 VAL QG 1 99 VAL QG . . 2.480 1.924 1.859 1.978 . 0 0 "[ . 1 . 2]" 1
2084 1 89 VAL QG 1 100 ALA H . . 4.760 4.755 4.483 4.969 0.209 11 0 "[ . 1 . 2]" 1
2085 1 95 LEU HA 1 95 LEU QD . . 2.880 2.760 2.184 3.394 0.514 4 2 "[ +. 1 - . 2]" 1
2086 1 95 LEU QD 1 96 ARG HA . . 3.820 3.196 2.553 4.108 0.288 7 0 "[ . 1 . 2]" 1
2087 1 95 LEU QD 1 99 VAL H . . 3.630 3.957 3.394 5.082 1.452 13 3 "[ *. - 1 + . 2]" 1
2088 1 96 ARG HA 1 96 ARG QD . . 4.240 3.400 2.124 4.271 0.031 20 0 "[ . 1 . 2]" 1
2089 1 96 ARG QB 1 96 ARG QD . . 2.890 2.333 2.114 2.899 0.009 2 0 "[ . 1 . 2]" 1
2090 1 98 ALA HA 1 101 LYS QB . . 3.120 2.591 2.380 2.773 . 0 0 "[ . 1 . 2]" 1
2091 1 99 VAL H 1 99 VAL QG . . 3.090 2.284 1.979 2.360 . 0 0 "[ . 1 . 2]" 1
2092 1 99 VAL H 1 101 LYS QB . . 4.780 4.811 4.789 4.862 0.082 10 0 "[ . 1 . 2]" 1
2093 1 99 VAL HA 1 99 VAL QG . . 2.640 2.207 2.110 2.249 . 0 0 "[ . 1 . 2]" 1
2094 1 99 VAL QG 1 100 ALA H . . 3.480 2.991 2.087 3.128 . 0 0 "[ . 1 . 2]" 1
2095 1 99 VAL QG 1 100 ALA HA . . 3.570 3.307 3.089 4.212 0.642 14 1 "[ . 1 +. 2]" 1
2096 1 99 VAL QG 1 103 ARG H . . 4.060 3.729 3.379 4.493 0.433 2 0 "[ . 1 . 2]" 1
2097 1 99 VAL QG 1 103 ARG QB . . 3.550 2.178 2.051 3.231 . 0 0 "[ . 1 . 2]" 1
2098 1 99 VAL QG 1 103 ARG QD . . 4.530 3.091 2.198 4.132 . 0 0 "[ . 1 . 2]" 1
2099 1 99 VAL QG 1 104 GLY H . . 4.720 3.812 3.544 4.548 . 0 0 "[ . 1 . 2]" 1
2100 1 99 VAL QG 1 104 GLY HA3 . . 5.440 4.687 4.315 5.734 0.294 14 0 "[ . 1 . 2]" 1
2101 1 101 LYS H 1 101 LYS QB . . 2.750 2.117 2.060 2.224 . 0 0 "[ . 1 . 2]" 1
2102 1 101 LYS H 1 101 LYS QD . . 3.830 3.772 3.049 3.889 0.059 1 0 "[ . 1 . 2]" 1
2103 1 101 LYS HA 1 101 LYS QB . . 2.540 2.485 2.436 2.568 0.028 8 0 "[ . 1 . 2]" 1
2104 1 101 LYS HA 1 101 LYS QD . . 2.890 2.168 2.050 2.897 0.007 13 0 "[ . 1 . 2]" 1
2105 1 101 LYS HA 1 101 LYS QE . . 4.550 3.884 1.890 4.242 . 0 0 "[ . 1 . 2]" 1
2106 1 101 LYS QB 1 101 LYS QD . . 2.710 2.363 2.282 2.728 0.018 1 0 "[ . 1 . 2]" 1
2107 1 101 LYS QB 1 102 ALA H . . 3.380 3.013 2.856 3.204 . 0 0 "[ . 1 . 2]" 1
2108 1 101 LYS QE 1 101 LYS QG . . 3.070 2.242 2.105 2.801 . 0 0 "[ . 1 . 2]" 1
2109 1 101 LYS QG 1 102 ALA H . . 4.950 4.376 4.117 4.667 . 0 0 "[ . 1 . 2]" 1
2110 1 102 ALA HA 1 105 SER QB . . 3.540 2.402 2.009 3.571 0.031 16 0 "[ . 1 . 2]" 1
2111 1 103 ARG H 1 103 ARG QB . . 3.070 2.205 2.074 2.333 . 0 0 "[ . 1 . 2]" 1
2112 1 103 ARG HA 1 103 ARG QD . . 3.610 3.281 2.070 3.721 0.111 6 0 "[ . 1 . 2]" 1
2113 1 103 ARG QB 1 103 ARG QD . . 3.210 2.302 2.085 2.767 . 0 0 "[ . 1 . 2]" 1
2114 1 103 ARG QB 1 104 GLY H . . 3.270 2.944 2.704 3.063 . 0 0 "[ . 1 . 2]" 1
2115 1 103 ARG QB 1 104 GLY HA3 . . 4.820 4.698 4.451 4.830 0.010 11 0 "[ . 1 . 2]" 1
2116 1 103 ARG QB 1 105 SER H . . 5.340 5.089 4.957 5.214 . 0 0 "[ . 1 . 2]" 1
2117 1 103 ARG QD 1 104 GLY H . . 5.260 4.763 3.665 5.311 0.051 12 0 "[ . 1 . 2]" 1
2118 1 104 GLY HA3 1 108 LEU QB . . 4.670 4.777 4.727 4.809 0.139 9 0 "[ . 1 . 2]" 1
2119 1 104 GLY HA3 1 108 LEU QD . . 3.940 3.894 3.639 4.519 0.579 5 1 "[ + 1 . 2]" 1
2120 1 105 SER H 1 105 SER QB . . 3.260 2.387 2.174 2.569 . 0 0 "[ . 1 . 2]" 1
2121 1 105 SER H 1 108 LEU QB . . 4.650 4.383 4.308 4.469 . 0 0 "[ . 1 . 2]" 1
2122 1 105 SER H 1 108 LEU QD . . 5.100 4.441 4.148 5.162 0.062 5 0 "[ . 1 . 2]" 1
2123 1 105 SER HA 1 108 LEU QB . . 3.310 2.264 2.164 2.511 . 0 0 "[ . 1 . 2]" 1
2124 1 105 SER HA 1 108 LEU QD . . 3.490 3.167 2.785 3.871 0.381 4 0 "[ . 1 . 2]" 1
2125 1 105 SER QB 1 106 TRP H . . 3.210 2.729 2.525 3.310 0.100 19 0 "[ . 1 . 2]" 1
2126 1 106 TRP HE3 1 107 SER QB . . 4.020 3.369 2.793 3.667 . 0 0 "[ . 1 . 2]" 1
2127 1 106 TRP HZ3 1 107 SER QB . . 4.670 4.365 3.883 4.688 0.018 2 0 "[ . 1 . 2]" 1
2128 1 106 TRP HZ3 1 110 HIS QB . . 4.840 3.559 2.795 4.538 . 0 0 "[ . 1 . 2]" 1
2129 1 107 SER H 1 107 SER QB . . 3.160 2.508 2.336 2.721 . 0 0 "[ . 1 . 2]" 1
2130 1 107 SER H 1 108 LEU QB . . 4.200 4.040 3.916 4.114 . 0 0 "[ . 1 . 2]" 1
2131 1 107 SER H 1 108 LEU QD . . 4.080 4.237 3.852 4.942 0.862 2 2 "[ + . -1 . 2]" 1
2132 1 107 SER HA 1 110 HIS QB . . 4.560 3.777 2.904 4.571 0.011 11 0 "[ . 1 . 2]" 1
2133 1 107 SER HA 1 111 HIS QB . . 4.270 3.767 2.409 4.345 0.075 3 0 "[ . 1 . 2]" 1
2134 1 107 SER QB 1 108 LEU H . . 3.680 3.445 2.950 3.761 0.081 4 0 "[ . 1 . 2]" 1
2135 1 107 SER QB 1 108 LEU QD . . 3.800 3.496 2.757 4.827 1.027 2 2 "[ + . -1 . 2]" 1
2136 1 107 SER QB 1 111 HIS QB . . 4.920 4.006 2.371 4.650 . 0 0 "[ . 1 . 2]" 1
2137 1 108 LEU H 1 108 LEU QB . . 2.690 2.077 1.942 2.197 . 0 0 "[ . 1 . 2]" 1
2138 1 108 LEU H 1 108 LEU QD . . 3.270 3.052 2.759 3.573 0.303 2 0 "[ . 1 . 2]" 1
2139 1 108 LEU H 1 111 HIS QB . . 5.340 4.911 4.492 5.333 . 0 0 "[ . 1 . 2]" 1
2140 1 108 LEU HA 1 108 LEU QD . . 2.740 2.095 1.871 2.283 . 0 0 "[ . 1 . 2]" 1
2141 1 108 LEU HA 1 111 HIS QB . . 4.060 3.611 2.628 4.100 0.040 4 0 "[ . 1 . 2]" 1
2142 1 108 LEU QB 1 108 LEU QD . . 2.740 1.976 1.916 2.084 . 0 0 "[ . 1 . 2]" 1
2143 1 108 LEU QB 1 109 GLU HG2 . . 3.770 3.716 3.527 3.803 0.033 2 0 "[ . 1 . 2]" 1
2144 1 108 LEU QB 1 109 GLU HG3 . . 4.190 4.206 4.087 4.238 0.048 15 0 "[ . 1 . 2]" 1
2145 1 108 LEU QD 1 109 GLU HG2 . . 5.070 5.043 4.908 5.165 0.095 8 0 "[ . 1 . 2]" 1
2146 1 108 LEU QD 1 111 HIS QB . . 4.840 4.215 3.349 4.735 . 0 0 "[ . 1 . 2]" 1
2147 1 109 GLU H 1 110 HIS QB . . 5.340 4.530 4.300 4.715 . 0 0 "[ . 1 . 2]" 1
2148 1 109 GLU H 1 111 HIS QB . . 5.340 4.854 4.266 5.373 0.033 15 0 "[ . 1 . 2]" 1
2149 1 114 HIS HA 1 114 HIS QB . . 2.480 2.337 2.165 2.442 . 0 0 "[ . 1 . 2]" 1
2150 1 114 HIS QB 1 115 HIS H . . 4.360 3.416 2.179 4.084 . 0 0 "[ . 1 . 2]" 1
2151 1 115 HIS H 1 115 HIS QB . . 3.650 2.698 2.201 3.238 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 32
_Distance_constraint_stats_list.Viol_count 221
_Distance_constraint_stats_list.Viol_total 159.121
_Distance_constraint_stats_list.Viol_max 0.101
_Distance_constraint_stats_list.Viol_rms 0.0231
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0124
_Distance_constraint_stats_list.Viol_average_violations_only 0.0360
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ARG 1.061 0.081 15 0 "[ . 1 . 2]"
1 3 VAL 1.600 0.101 7 0 "[ . 1 . 2]"
1 4 ILE 0.122 0.026 7 0 "[ . 1 . 2]"
1 5 VAL 0.989 0.047 17 0 "[ . 1 . 2]"
1 6 VAL 0.110 0.026 18 0 "[ . 1 . 2]"
1 7 ILE 0.355 0.032 7 0 "[ . 1 . 2]"
1 8 VAL 0.011 0.011 1 0 "[ . 1 . 2]"
1 9 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 GLU 1.609 0.101 7 0 "[ . 1 . 2]"
1 35 ARG 1.320 0.047 17 0 "[ . 1 . 2]"
1 37 VAL 0.016 0.008 14 0 "[ . 1 . 2]"
1 57 ILE 1.062 0.081 15 0 "[ . 1 . 2]"
1 58 VAL 3.703 0.096 11 0 "[ . 1 . 2]"
1 59 VAL 0.230 0.026 18 0 "[ . 1 . 2]"
1 60 ILE 0.006 0.006 9 0 "[ . 1 . 2]"
1 61 VAL 0.011 0.011 1 0 "[ . 1 . 2]"
1 85 LYS 1.006 0.039 16 0 "[ . 1 . 2]"
1 87 ILE 2.697 0.096 11 0 "[ . 1 . 2]"
1 89 VAL 0.006 0.006 9 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ARG O 1 57 ILE H . . 2.000 2.053 2.016 2.081 0.081 15 0 "[ . 1 . 2]" 2
2 1 2 ARG O 1 57 ILE N . . 3.000 2.978 2.944 3.006 0.006 15 0 "[ . 1 . 2]" 2
3 1 3 VAL O 1 33 GLU H . . 2.000 2.076 2.043 2.101 0.101 7 0 "[ . 1 . 2]" 2
4 1 3 VAL O 1 33 GLU N . . 3.000 2.986 2.940 3.022 0.022 7 0 "[ . 1 . 2]" 2
5 1 4 ILE O 1 59 VAL H . . 2.000 1.996 1.943 2.026 0.026 7 0 "[ . 1 . 2]" 2
6 1 4 ILE O 1 59 VAL N . . 3.000 2.952 2.912 2.982 . 0 0 "[ . 1 . 2]" 2
7 1 5 VAL O 1 35 ARG H . . 2.000 2.032 2.020 2.047 0.047 17 0 "[ . 1 . 2]" 2
8 1 5 VAL O 1 35 ARG N . . 3.000 3.017 3.007 3.032 0.032 17 0 "[ . 1 . 2]" 2
9 1 6 VAL O 1 61 VAL H . . 2.000 1.795 1.761 1.823 . 0 0 "[ . 1 . 2]" 2
10 1 6 VAL O 1 61 VAL N . . 3.000 2.713 2.700 2.764 . 0 0 "[ . 1 . 2]" 2
11 1 7 ILE O 1 37 VAL H . . 2.000 1.959 1.900 2.008 0.008 14 0 "[ . 1 . 2]" 2
12 1 7 ILE O 1 37 VAL N . . 3.000 2.900 2.859 2.943 . 0 0 "[ . 1 . 2]" 2
13 1 5 VAL H 1 33 GLU O . . 2.000 1.959 1.912 2.008 0.008 12 0 "[ . 1 . 2]" 2
14 1 5 VAL N 1 33 GLU O . . 3.000 2.955 2.910 3.001 0.001 12 0 "[ . 1 . 2]" 2
15 1 7 ILE H 1 35 ARG O . . 2.000 2.017 2.006 2.032 0.032 7 0 "[ . 1 . 2]" 2
16 1 7 ILE N 1 35 ARG O . . 3.000 2.902 2.873 2.925 . 0 0 "[ . 1 . 2]" 2
17 1 9 GLY H 1 37 VAL O . . 2.000 1.841 1.777 1.911 . 0 0 "[ . 1 . 2]" 2
18 1 9 GLY N 1 37 VAL O . . 3.000 2.792 2.750 2.847 . 0 0 "[ . 1 . 2]" 2
19 1 4 ILE H 1 57 ILE O . . 2.000 1.970 1.928 2.001 0.001 12 0 "[ . 1 . 2]" 2
20 1 4 ILE N 1 57 ILE O . . 3.000 2.833 2.809 2.861 . 0 0 "[ . 1 . 2]" 2
21 1 58 VAL O 1 87 ILE H . . 2.000 2.078 2.057 2.096 0.096 11 0 "[ . 1 . 2]" 2
22 1 58 VAL O 1 87 ILE N . . 3.000 3.057 3.038 3.069 0.069 11 0 "[ . 1 . 2]" 2
23 1 6 VAL H 1 59 VAL O . . 2.000 1.976 1.842 2.026 0.026 18 0 "[ . 1 . 2]" 2
24 1 6 VAL N 1 59 VAL O . . 3.000 2.917 2.832 2.954 . 0 0 "[ . 1 . 2]" 2
25 1 60 ILE O 1 89 VAL H . . 2.000 1.956 1.870 2.006 0.006 9 0 "[ . 1 . 2]" 2
26 1 60 ILE O 1 89 VAL N . . 3.000 2.895 2.821 2.935 . 0 0 "[ . 1 . 2]" 2
27 1 8 VAL H 1 61 VAL O . . 2.000 1.928 1.861 2.011 0.011 1 0 "[ . 1 . 2]" 2
28 1 8 VAL N 1 61 VAL O . . 3.000 2.911 2.833 2.980 . 0 0 "[ . 1 . 2]" 2
29 1 58 VAL H 1 85 LYS O . . 2.000 2.021 2.007 2.030 0.030 16 0 "[ . 1 . 2]" 2
30 1 58 VAL N 1 85 LYS O . . 3.000 3.030 3.016 3.039 0.039 16 0 "[ . 1 . 2]" 2
31 1 60 ILE H 1 87 ILE O . . 2.000 1.813 1.784 1.856 . 0 0 "[ . 1 . 2]" 2
32 1 60 ILE N 1 87 ILE O . . 3.000 2.753 2.732 2.779 . 0 0 "[ . 1 . 2]" 2
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