NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
618101 |
5ix9   |
30040 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5ix9
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 1687
_Distance_constraint_stats_list.Viol_count 3876
_Distance_constraint_stats_list.Viol_total 6935.513
_Distance_constraint_stats_list.Viol_max 0.966
_Distance_constraint_stats_list.Viol_rms 0.0455
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0103
_Distance_constraint_stats_list.Viol_average_violations_only 0.0895
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 13 ASN 3.196 0.422 10 0 "[ . 1 . 2]"
1 14 ALA 6.283 0.422 10 0 "[ . 1 . 2]"
1 15 ILE 8.501 0.211 20 0 "[ . 1 . 2]"
1 16 GLY 5.801 0.260 20 0 "[ . 1 . 2]"
1 17 PHE 16.317 0.260 20 0 "[ . 1 . 2]"
1 18 ILE 15.615 0.217 12 0 "[ . 1 . 2]"
1 19 THR 10.259 0.177 11 0 "[ . 1 . 2]"
1 20 LYS 17.453 0.966 4 12 "[ *+.****-* ** * *]"
1 21 LEU 12.188 0.966 4 1 "[ +. 1 . 2]"
1 22 ASP 5.815 0.250 8 0 "[ . 1 . 2]"
1 23 GLY 0.465 0.140 19 0 "[ . 1 . 2]"
1 24 SER 6.280 0.465 14 0 "[ . 1 . 2]"
1 25 VAL 4.905 0.210 13 0 "[ . 1 . 2]"
1 26 THR 21.343 0.789 1 6 "[+ . 1 **-.** 2]"
1 27 VAL 15.782 0.231 12 0 "[ . 1 . 2]"
1 28 GLN 9.108 0.186 20 0 "[ . 1 . 2]"
1 29 SER 16.659 0.775 9 2 "[ . +1 . - 2]"
1 30 ILE 5.688 0.775 9 2 "[ . +1 . - 2]"
1 31 ASN 0.206 0.114 5 0 "[ . 1 . 2]"
1 32 GLY 5.876 0.182 10 0 "[ . 1 . 2]"
1 33 GLN 7.560 0.466 20 0 "[ . 1 . 2]"
1 34 GLU 15.988 0.789 1 6 "[+ . 1 **-.** 2]"
1 35 ARG 20.297 0.803 13 7 "[* . * *+*. * -2]"
1 36 VAL 19.711 0.806 17 11 "[* * .* * * ***.-+ *2]"
1 37 LEU 6.131 0.307 19 0 "[ . 1 . 2]"
1 38 LYS 14.124 0.806 17 8 "[ * .* * * *.-+ *2]"
1 39 LEU 12.442 0.316 1 0 "[ . 1 . 2]"
1 40 GLY 4.620 0.192 11 0 "[ . 1 . 2]"
1 41 ASP 2.299 0.307 19 0 "[ . 1 . 2]"
1 42 PRO 1.829 0.135 11 0 "[ . 1 . 2]"
1 43 ILE 10.340 0.191 6 0 "[ . 1 . 2]"
1 44 PHE 9.047 0.146 3 0 "[ . 1 . 2]"
1 45 PHE 12.029 0.756 12 6 "[ . * * + *. - *]"
1 46 GLY 2.932 0.350 1 0 "[ . 1 . 2]"
1 47 GLU 12.589 0.231 12 0 "[ . 1 . 2]"
1 48 THR 10.506 0.262 14 0 "[ . 1 . 2]"
1 49 VAL 4.007 0.103 8 0 "[ . 1 . 2]"
1 50 LEU 6.147 0.161 16 0 "[ . 1 . 2]"
1 51 THR 3.980 0.451 5 0 "[ . 1 . 2]"
1 52 GLY 6.031 0.465 14 0 "[ . 1 . 2]"
1 53 GLY 1.868 0.873 5 1 "[ + 1 . 2]"
1 54 SER 0.723 0.276 18 0 "[ . 1 . 2]"
1 55 GLY 5.865 0.276 18 0 "[ . 1 . 2]"
1 56 SER 6.988 0.271 16 0 "[ . 1 . 2]"
1 57 VAL 13.649 0.250 8 0 "[ . 1 . 2]"
1 58 THR 10.943 0.681 18 8 "[ * .* **- *. + *]"
1 59 ILE 10.464 0.132 18 0 "[ . 1 . 2]"
1 60 ALA 4.209 0.150 11 0 "[ . 1 . 2]"
1 61 PHE 16.107 0.384 20 0 "[ . 1 . 2]"
1 62 VAL 9.294 0.251 5 0 "[ . 1 . 2]"
1 63 ASP 1.992 0.532 15 1 "[ . 1 + 2]"
1 64 GLY 0.106 0.061 12 0 "[ . 1 . 2]"
1 65 THR 0.460 0.089 12 0 "[ . 1 . 2]"
1 66 ASP 1.037 0.123 12 0 "[ . 1 . 2]"
1 67 VAL 14.735 0.384 20 0 "[ . 1 . 2]"
1 68 VAL 3.893 0.271 16 0 "[ . 1 . 2]"
1 69 ILE 4.899 0.106 5 0 "[ . 1 . 2]"
1 70 GLY 0.995 0.118 5 0 "[ . 1 . 2]"
1 71 GLY 5.500 0.562 5 1 "[ + 1 . 2]"
1 72 ASP 7.589 0.873 5 1 "[ + 1 . 2]"
1 73 SER 5.436 0.312 16 0 "[ . 1 . 2]"
1 74 ILE 2.466 0.129 3 0 "[ . 1 . 2]"
1 75 VAL 6.805 0.870 3 3 "[ + . * . *2]"
1 76 GLU 6.875 0.870 3 4 "[ + . - *. *2]"
1 77 MET 14.679 0.636 19 3 "[ - . * . +2]"
1 78 THR 8.142 0.556 15 1 "[ . 1 + 2]"
1 79 ASP 10.930 0.756 12 6 "[ . * * + *. - *]"
1 80 GLU 11.958 0.736 12 2 "[ . 1 + - 2]"
1 81 ILE 16.090 0.152 14 0 "[ . 1 . 2]"
1 82 TYR 23.467 0.532 15 1 "[ . 1 + 2]"
1 83 ASN 1.831 0.111 10 0 "[ . 1 . 2]"
1 84 THR 0.760 0.119 5 0 "[ . 1 . 2]"
1 85 GLY 2.820 0.282 8 0 "[ . 1 . 2]"
1 86 ASP 1.935 0.282 8 0 "[ . 1 . 2]"
1 87 ASN 6.766 0.629 15 4 "[ . 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 48 THR H 1 49 VAL H 3.393 . 4.832 3.967 3.945 3.993 . 0 0 "[ . 1 . 2]" 1
2 1 17 PHE H 1 19 THR MG 3.318 . 4.694 4.052 4.002 4.099 . 0 0 "[ . 1 . 2]" 1
3 1 17 PHE H 1 18 ILE MD 3.534 . 5.095 4.483 4.404 4.544 . 0 0 "[ . 1 . 2]" 1
4 1 17 PHE H 1 17 PHE HA 2.669 . 3.559 2.757 2.721 2.784 . 0 0 "[ . 1 . 2]" 1
5 1 23 GLY HA2 1 24 SER H 2.242 . 2.870 2.452 2.319 2.621 . 0 0 "[ . 1 . 2]" 1
6 1 43 ILE H 1 43 ILE MD 2.827 . 3.826 3.335 3.292 3.357 . 0 0 "[ . 1 . 2]" 1
7 1 39 LEU QB 1 40 GLY H 2.785 . 3.754 3.366 3.259 3.490 . 0 0 "[ . 1 . 2]" 1
8 1 39 LEU QD 1 40 GLY H 2.656 . 3.538 3.233 3.138 3.340 . 0 0 "[ . 1 . 2]" 1
9 1 36 VAL H 1 37 LEU H 2.979 . 4.088 3.993 3.882 4.040 . 0 0 "[ . 1 . 2]" 1
10 1 15 ILE H 1 15 ILE HG12 2.497 . 3.277 1.907 1.877 1.944 . 0 0 "[ . 1 . 2]" 1
11 1 15 ILE MD 1 16 GLY H 2.841 . 3.850 3.555 3.463 3.598 . 0 0 "[ . 1 . 2]" 1
12 1 28 GLN HE21 1 50 LEU QD 3.507 . 5.045 2.967 2.318 3.587 . 0 0 "[ . 1 . 2]" 1
13 1 27 VAL H 1 28 GLN H 3.150 . 4.390 3.749 3.724 3.784 . 0 0 "[ . 1 . 2]" 1
14 1 27 VAL QG 1 29 SER H 3.350 . 4.753 3.166 3.063 3.288 . 0 0 "[ . 1 . 2]" 1
15 1 49 VAL MG1 1 51 THR H 2.982 . 4.094 3.838 3.611 4.004 . 0 0 "[ . 1 . 2]" 1
16 1 45 PHE QB 1 46 GLY H 3.205 . 4.489 3.800 3.665 3.850 . 0 0 "[ . 1 . 2]" 1
17 1 20 LYS H 1 21 LEU QB 3.445 . 4.929 4.195 4.095 4.344 . 0 0 "[ . 1 . 2]" 1
18 1 62 VAL QG 1 64 GLY H 3.650 . 5.316 4.212 4.060 4.331 . 0 0 "[ . 1 . 2]" 1
19 1 45 PHE H 1 45 PHE QE 3.505 . 5.041 4.760 4.639 4.864 . 0 0 "[ . 1 . 2]" 1
20 1 19 THR H 1 19 THR MG 2.252 . 2.886 2.504 2.443 2.550 . 0 0 "[ . 1 . 2]" 1
21 1 22 ASP H 1 57 VAL HA 2.530 . 3.330 2.759 2.721 2.835 . 0 0 "[ . 1 . 2]" 1
22 1 14 ALA HA 1 15 ILE HG12 2.674 . 3.567 3.185 3.145 3.222 . 0 0 "[ . 1 . 2]" 1
23 1 35 ARG HB3 1 35 ARG HD3 2.073 . 2.610 2.350 2.237 2.415 . 0 0 "[ . 1 . 2]" 1
24 1 39 LEU HA 1 39 LEU QB 2.415 . 3.144 2.495 2.490 2.501 . 0 0 "[ . 1 . 2]" 1
25 1 61 PHE QE 1 67 VAL QG 2.326 . 3.002 1.741 1.556 2.068 0.094 17 0 "[ . 1 . 2]" 1
26 1 14 ALA MB 1 16 GLY H 2.238 . 2.864 2.550 2.367 2.775 . 0 0 "[ . 1 . 2]" 1
27 1 49 VAL HB 1 74 ILE HA 2.873 . 3.905 3.930 3.864 3.995 0.090 10 0 "[ . 1 . 2]" 1
28 1 18 ILE H 1 18 ILE HA 1.922 . 2.384 2.092 2.071 2.106 . 0 0 "[ . 1 . 2]" 1
29 1 27 VAL QG 1 29 SER HA 2.647 . 3.523 3.400 3.226 3.540 0.017 5 0 "[ . 1 . 2]" 1
30 1 39 LEU HA 1 39 LEU HB2 2.043 . 2.565 2.166 2.124 2.213 . 0 0 "[ . 1 . 2]" 1
31 1 42 PRO HG2 1 44 PHE QE 2.614 . 3.468 1.959 1.836 2.095 . 0 0 "[ . 1 . 2]" 1
32 1 43 ILE HA 1 43 ILE MD 2.173 . 2.763 1.914 1.895 1.930 . 0 0 "[ . 1 . 2]" 1
33 1 39 LEU HB2 1 39 LEU MD1 1.830 . 2.249 1.912 1.904 1.925 . 0 0 "[ . 1 . 2]" 1
34 1 42 PRO QB 1 44 PHE QE 2.633 . 3.500 2.635 2.298 3.179 . 0 0 "[ . 1 . 2]" 1
35 1 62 VAL HB 1 62 VAL QG 1.996 . 2.494 1.880 1.876 1.883 . 0 0 "[ . 1 . 2]" 1
36 1 43 ILE MD 1 43 ILE HG13 2.147 . 2.723 1.983 1.976 1.988 . 0 0 "[ . 1 . 2]" 1
37 1 21 LEU HA 1 21 LEU HB2 2.102 . 2.655 2.206 2.196 2.211 . 0 0 "[ . 1 . 2]" 1
38 1 27 VAL HB 1 27 VAL QG 2.056 . 2.584 1.884 1.875 1.894 . 0 0 "[ . 1 . 2]" 1
39 1 27 VAL QG 1 47 GLU HG2 2.905 . 3.960 3.485 3.378 3.570 . 0 0 "[ . 1 . 2]" 1
40 1 43 ILE HB 1 43 ILE MD 2.088 . 2.633 2.093 2.092 2.096 . 0 0 "[ . 1 . 2]" 1
41 1 26 THR H 1 26 THR HB 2.165 . 2.751 2.782 2.742 2.810 0.059 2 0 "[ . 1 . 2]" 1
42 1 19 THR H 1 59 ILE HG13 3.111 . 4.321 4.422 4.401 4.453 0.132 18 0 "[ . 1 . 2]" 1
43 1 26 THR H 1 50 LEU HB3 2.988 . 4.104 3.600 3.280 3.720 . 0 0 "[ . 1 . 2]" 1
44 1 59 ILE MD 1 61 PHE QE 2.641 . 3.513 3.484 3.328 3.598 0.085 7 0 "[ . 1 . 2]" 1
45 1 51 THR H 1 74 ILE MG 3.263 . 4.594 4.179 4.053 4.345 . 0 0 "[ . 1 . 2]" 1
46 1 49 VAL H 1 74 ILE MG 3.349 . 4.751 3.943 3.843 4.100 . 0 0 "[ . 1 . 2]" 1
47 1 29 SER HB2 1 30 ILE MG 3.073 . 4.253 3.563 3.387 3.755 . 0 0 "[ . 1 . 2]" 1
48 1 17 PHE H 1 43 ILE MG 3.576 . 5.174 4.377 4.281 4.543 . 0 0 "[ . 1 . 2]" 1
49 1 62 VAL MG1 1 82 TYR QE 2.233 . 2.856 2.516 2.339 2.644 . 0 0 "[ . 1 . 2]" 1
50 1 61 PHE QE 1 67 VAL QG 2.373 . 3.077 1.752 1.559 2.068 0.110 17 0 "[ . 1 . 2]" 1
51 1 82 TYR H 1 82 TYR HB2 2.747 . 3.690 2.825 2.726 2.947 . 0 0 "[ . 1 . 2]" 1
52 1 82 TYR H 1 82 TYR HB3 2.723 . 3.650 2.580 2.480 2.636 . 0 0 "[ . 1 . 2]" 1
53 1 82 TYR H 1 82 TYR QD 3.570 . 5.163 4.241 4.208 4.289 . 0 0 "[ . 1 . 2]" 1
54 1 61 PHE H 1 67 VAL H 3.419 . 4.880 3.954 3.685 4.446 . 0 0 "[ . 1 . 2]" 1
55 1 60 ALA H 1 61 PHE H 3.477 . 4.988 4.268 4.187 4.347 . 0 0 "[ . 1 . 2]" 1
56 1 41 ASP H 1 41 ASP QB 2.258 . 2.895 2.207 2.117 2.373 . 0 0 "[ . 1 . 2]" 1
57 1 87 ASN HA 1 87 ASN HD22 3.095 . 4.292 2.646 1.739 3.700 0.159 20 0 "[ . 1 . 2]" 1
58 1 87 ASN HA 1 87 ASN HD21 2.699 . 3.610 3.743 3.160 4.239 0.629 15 4 "[ . 1 -*+ * 2]" 1
59 1 13 ASN H 1 13 ASN HB3 3.131 . 4.356 3.507 2.749 4.121 . 0 0 "[ . 1 . 2]" 1
60 1 13 ASN H 1 13 ASN HB2 2.704 . 3.618 3.007 2.321 3.805 0.187 19 0 "[ . 1 . 2]" 1
61 1 47 GLU HG3 1 48 THR H 3.454 . 4.945 5.011 4.978 5.060 0.115 14 0 "[ . 1 . 2]" 1
62 1 47 GLU HB2 1 48 THR H 2.971 . 4.074 3.737 3.611 3.931 . 0 0 "[ . 1 . 2]" 1
63 1 47 GLU HB3 1 48 THR H 2.486 . 3.258 2.772 2.629 2.995 . 0 0 "[ . 1 . 2]" 1
64 1 27 VAL MG2 1 48 THR H 2.712 . 3.631 2.846 2.649 3.141 . 0 0 "[ . 1 . 2]" 1
65 1 27 VAL HA 1 48 THR H 3.553 . 5.131 4.400 4.248 4.715 . 0 0 "[ . 1 . 2]" 1
66 1 29 SER HA 1 48 THR H 3.509 . 5.048 3.508 3.301 3.769 . 0 0 "[ . 1 . 2]" 1
67 1 28 GLN H 1 48 THR H 2.700 . 3.611 2.744 2.576 3.012 . 0 0 "[ . 1 . 2]" 1
68 1 25 VAL H 1 25 VAL HA 2.722 . 3.648 2.929 2.917 2.936 . 0 0 "[ . 1 . 2]" 1
69 1 24 SER HB3 1 25 VAL H 3.348 . 4.749 3.890 3.428 4.248 . 0 0 "[ . 1 . 2]" 1
70 1 25 VAL H 1 37 LEU H 3.521 . 5.070 4.655 4.416 4.920 . 0 0 "[ . 1 . 2]" 1
71 1 83 ASN H 1 83 ASN HA 2.551 . 3.365 2.871 2.817 2.900 . 0 0 "[ . 1 . 2]" 1
72 1 82 TYR HA 1 83 ASN H 2.126 . 2.691 2.327 2.214 2.447 . 0 0 "[ . 1 . 2]" 1
73 1 81 ILE HA 1 83 ASN H 3.314 . 4.687 4.722 4.658 4.764 0.077 10 0 "[ . 1 . 2]" 1
74 1 83 ASN H 1 83 ASN HB3 2.531 . 3.332 2.526 2.450 2.624 . 0 0 "[ . 1 . 2]" 1
75 1 83 ASN H 1 83 ASN HB2 2.496 . 3.275 2.609 2.440 2.720 . 0 0 "[ . 1 . 2]" 1
76 1 82 TYR H 1 83 ASN H 2.774 . 3.736 3.715 3.501 3.847 0.111 10 0 "[ . 1 . 2]" 1
77 1 83 ASN H 1 83 ASN HD22 3.260 . 4.589 4.577 4.399 4.682 0.093 12 0 "[ . 1 . 2]" 1
78 1 17 PHE H 1 17 PHE HB2 2.672 . 3.564 2.793 2.780 2.805 . 0 0 "[ . 1 . 2]" 1
79 1 17 PHE H 1 43 ILE HG12 3.390 . 4.827 4.852 4.829 4.876 0.049 1 0 "[ . 1 . 2]" 1
80 1 17 PHE H 1 60 ALA H 2.586 . 3.422 3.201 3.081 3.305 . 0 0 "[ . 1 . 2]" 1
81 1 24 SER H 1 24 SER HA 2.711 . 3.630 2.928 2.901 2.946 . 0 0 "[ . 1 . 2]" 1
82 1 23 GLY HA3 1 24 SER H 2.260 . 2.899 2.261 2.153 2.394 . 0 0 "[ . 1 . 2]" 1
83 1 24 SER H 1 24 SER HB3 2.535 . 3.339 3.074 2.528 3.635 0.296 3 0 "[ . 1 . 2]" 1
84 1 24 SER H 1 55 GLY HA2 2.987 . 4.103 3.063 2.768 3.385 . 0 0 "[ . 1 . 2]" 1
85 1 24 SER H 1 25 VAL MG1 3.316 . 4.691 3.686 3.566 3.833 . 0 0 "[ . 1 . 2]" 1
86 1 24 SER H 1 52 GLY H 3.503 . 5.037 3.549 3.250 3.784 . 0 0 "[ . 1 . 2]" 1
87 1 24 SER H 1 25 VAL H 3.135 . 4.363 4.372 4.281 4.430 0.067 13 0 "[ . 1 . 2]" 1
88 1 23 GLY H 1 24 SER H 3.337 . 4.729 4.595 4.553 4.616 . 0 0 "[ . 1 . 2]" 1
89 1 18 ILE H 1 18 ILE HB 2.351 . 3.042 2.642 2.598 2.687 . 0 0 "[ . 1 . 2]" 1
90 1 18 ILE HA 1 19 THR H 2.119 . 2.680 2.148 2.122 2.166 . 0 0 "[ . 1 . 2]" 1
91 1 19 THR H 1 19 THR HB 2.792 . 3.766 3.726 3.693 3.748 . 0 0 "[ . 1 . 2]" 1
92 1 19 THR H 1 59 ILE HA 2.806 . 3.790 3.410 3.279 3.512 . 0 0 "[ . 1 . 2]" 1
93 1 19 THR H 1 58 THR HB 3.266 . 4.600 3.352 3.191 3.492 . 0 0 "[ . 1 . 2]" 1
94 1 19 THR H 1 19 THR MG 2.642 . 3.514 2.729 2.662 2.779 . 0 0 "[ . 1 . 2]" 1
95 1 18 ILE H 1 41 ASP H 3.247 . 4.565 3.379 3.106 3.761 . 0 0 "[ . 1 . 2]" 1
96 1 49 VAL H 1 76 GLU HA 2.926 . 3.996 3.105 2.865 3.276 . 0 0 "[ . 1 . 2]" 1
97 1 49 VAL H 1 49 VAL HA 2.806 . 3.791 2.895 2.884 2.902 . 0 0 "[ . 1 . 2]" 1
98 1 49 VAL H 1 49 VAL HB 2.305 . 2.969 2.767 2.717 2.838 . 0 0 "[ . 1 . 2]" 1
99 1 76 GLU H 1 76 GLU HB2 2.258 . 2.895 2.819 2.689 3.678 0.783 14 1 "[ . 1 +. 2]" 1
100 1 74 ILE MG 1 76 GLU H 3.452 . 4.942 4.629 4.369 4.948 0.006 19 0 "[ . 1 . 2]" 1
101 1 43 ILE H 1 43 ILE HB 2.601 . 3.446 2.415 2.389 2.453 . 0 0 "[ . 1 . 2]" 1
102 1 43 ILE H 1 43 ILE HG12 2.712 . 3.631 2.733 2.583 2.784 . 0 0 "[ . 1 . 2]" 1
103 1 43 ILE H 1 44 PHE H 3.445 . 4.929 4.454 4.414 4.484 . 0 0 "[ . 1 . 2]" 1
104 1 47 GLU H 1 47 GLU HG3 2.357 . 3.052 2.295 2.047 2.401 . 0 0 "[ . 1 . 2]" 1
105 1 47 GLU H 1 77 MET HG2 3.151 . 4.392 3.390 3.062 4.354 . 0 0 "[ . 1 . 2]" 1
106 1 47 GLU H 1 47 GLU HB2 2.489 . 3.264 2.684 2.611 2.733 . 0 0 "[ . 1 . 2]" 1
107 1 47 GLU H 1 47 GLU HB3 2.756 . 3.706 3.692 3.662 3.719 0.013 13 0 "[ . 1 . 2]" 1
108 1 27 VAL MG2 1 47 GLU H 3.395 . 4.835 4.474 4.410 4.525 . 0 0 "[ . 1 . 2]" 1
109 1 43 ILE MG 1 47 GLU H 3.421 . 4.884 4.120 3.956 4.277 . 0 0 "[ . 1 . 2]" 1
110 1 59 ILE HB 1 67 VAL H 3.061 . 4.232 3.561 3.407 4.033 . 0 0 "[ . 1 . 2]" 1
111 1 67 VAL H 1 67 VAL QG 2.539 . 3.345 2.467 1.934 3.101 . 0 0 "[ . 1 . 2]" 1
112 1 66 ASP H 1 67 VAL H 3.471 . 4.977 4.393 4.308 4.465 . 0 0 "[ . 1 . 2]" 1
113 1 58 THR HA 1 67 VAL H 3.527 . 5.082 4.196 3.810 4.450 . 0 0 "[ . 1 . 2]" 1
114 1 83 ASN HA 1 84 THR H 2.376 . 3.081 2.164 2.130 2.272 . 0 0 "[ . 1 . 2]" 1
115 1 84 THR H 1 84 THR HA 2.835 . 3.840 2.873 2.795 2.918 . 0 0 "[ . 1 . 2]" 1
116 1 83 ASN HB3 1 84 THR H 3.532 . 5.091 4.381 4.287 4.444 . 0 0 "[ . 1 . 2]" 1
117 1 83 ASN HB2 1 84 THR H 3.436 . 4.912 4.466 4.346 4.605 . 0 0 "[ . 1 . 2]" 1
118 1 84 THR H 1 84 THR MG 2.695 . 3.603 2.549 2.260 2.961 . 0 0 "[ . 1 . 2]" 1
119 1 40 GLY HA3 1 41 ASP H 2.829 . 3.830 3.274 3.160 3.382 . 0 0 "[ . 1 . 2]" 1
120 1 40 GLY HA2 1 41 ASP H 2.926 . 3.996 3.303 3.224 3.425 . 0 0 "[ . 1 . 2]" 1
121 1 18 ILE HB 1 41 ASP H 2.446 . 3.194 2.369 2.183 2.777 . 0 0 "[ . 1 . 2]" 1
122 1 18 ILE HG12 1 41 ASP H 2.968 . 4.069 3.096 2.782 3.465 . 0 0 "[ . 1 . 2]" 1
123 1 18 ILE HG13 1 41 ASP H 3.290 . 4.643 3.241 2.880 3.562 . 0 0 "[ . 1 . 2]" 1
124 1 18 ILE MG 1 41 ASP H 3.001 . 4.127 3.789 3.643 4.069 . 0 0 "[ . 1 . 2]" 1
125 1 40 GLY H 1 41 ASP H 2.392 . 3.107 2.606 2.511 2.716 . 0 0 "[ . 1 . 2]" 1
126 1 38 LYS H 1 41 ASP H 3.113 . 4.324 4.003 3.811 4.329 0.005 6 0 "[ . 1 . 2]" 1
127 1 19 THR HA 1 40 GLY H 3.444 . 4.926 3.818 3.601 4.125 . 0 0 "[ . 1 . 2]" 1
128 1 59 ILE HB 1 60 ALA H 3.214 . 4.506 4.416 4.379 4.453 . 0 0 "[ . 1 . 2]" 1
129 1 19 THR MG 1 60 ALA H 2.853 . 3.871 2.914 2.833 2.989 . 0 0 "[ . 1 . 2]" 1
130 1 58 THR MG 1 60 ALA H 3.320 . 4.698 3.452 3.329 3.599 . 0 0 "[ . 1 . 2]" 1
131 1 18 ILE MD 1 60 ALA H 3.364 . 4.778 4.282 4.131 4.448 . 0 0 "[ . 1 . 2]" 1
132 1 59 ILE MG 1 60 ALA H 2.615 . 3.470 3.218 3.086 3.327 . 0 0 "[ . 1 . 2]" 1
133 1 84 THR HA 1 85 GLY H 2.721 . 3.647 2.179 2.136 2.314 . 0 0 "[ . 1 . 2]" 1
134 1 85 GLY H 1 85 GLY HA2 2.221 . 2.838 2.770 2.318 2.959 0.121 20 0 "[ . 1 . 2]" 1
135 1 84 THR MG 1 85 GLY H 3.513 . 5.055 3.767 3.598 3.923 . 0 0 "[ . 1 . 2]" 1
136 1 50 LEU H 1 50 LEU HB2 2.603 . 3.450 2.595 2.517 2.650 . 0 0 "[ . 1 . 2]" 1
137 1 50 LEU H 1 50 LEU HB3 2.886 . 3.927 3.719 3.666 3.751 . 0 0 "[ . 1 . 2]" 1
138 1 50 LEU H 1 50 LEU MD1 2.288 . 2.943 2.519 2.322 2.974 0.031 19 0 "[ . 1 . 2]" 1
139 1 35 ARG HG3 1 36 VAL H 2.392 . 3.107 3.062 2.700 3.199 0.092 2 0 "[ . 1 . 2]" 1
140 1 35 ARG HG2 1 36 VAL H 3.256 . 4.582 4.080 3.631 4.322 . 0 0 "[ . 1 . 2]" 1
141 1 35 ARG H 1 36 VAL H 3.455 . 4.947 4.459 4.402 4.508 . 0 0 "[ . 1 . 2]" 1
142 1 25 VAL HB 1 37 LEU H 3.532 . 5.091 4.641 4.214 4.895 . 0 0 "[ . 1 . 2]" 1
143 1 27 VAL HB 1 37 LEU H 3.572 . 5.167 5.191 5.113 5.232 0.065 16 0 "[ . 1 . 2]" 1
144 1 37 LEU H 1 37 LEU HB2 2.351 . 3.042 2.450 2.398 2.527 . 0 0 "[ . 1 . 2]" 1
145 1 37 LEU H 1 37 LEU QD 2.932 . 4.007 3.241 3.058 3.427 . 0 0 "[ . 1 . 2]" 1
146 1 25 VAL MG2 1 37 LEU H 2.811 . 3.799 2.251 1.916 2.457 . 0 0 "[ . 1 . 2]" 1
147 1 27 VAL H 1 37 LEU H 3.436 . 4.912 4.484 4.341 4.667 . 0 0 "[ . 1 . 2]" 1
148 1 22 ASP H 1 56 SER HB3 3.542 . 5.111 4.860 3.761 5.189 0.078 18 0 "[ . 1 . 2]" 1
149 1 22 ASP H 1 22 ASP QB 2.698 . 3.608 2.727 2.629 2.789 . 0 0 "[ . 1 . 2]" 1
150 1 21 LEU HG 1 22 ASP H 2.649 . 3.526 2.274 2.156 2.391 . 0 0 "[ . 1 . 2]" 1
151 1 22 ASP H 1 57 VAL MG1 3.405 . 4.854 4.133 3.923 4.334 . 0 0 "[ . 1 . 2]" 1
152 1 21 LEU MD2 1 22 ASP H 2.700 . 3.612 3.072 2.943 3.317 . 0 0 "[ . 1 . 2]" 1
153 1 22 ASP H 1 57 VAL HA 2.887 . 3.929 3.361 3.196 3.707 . 0 0 "[ . 1 . 2]" 1
154 1 21 LEU HA 1 22 ASP H 2.038 . 2.557 2.189 2.139 2.236 . 0 0 "[ . 1 . 2]" 1
155 1 80 GLU HG2 1 81 ILE H 3.538 . 5.103 4.849 4.372 5.149 0.046 19 0 "[ . 1 . 2]" 1
156 1 81 ILE H 1 81 ILE HG13 2.739 . 3.677 3.736 3.670 3.779 0.102 11 0 "[ . 1 . 2]" 1
157 1 78 THR MG 1 81 ILE H 3.736 . 5.481 4.738 4.483 4.943 . 0 0 "[ . 1 . 2]" 1
158 1 78 THR H 1 81 ILE H 3.225 . 4.525 3.143 3.026 3.307 . 0 0 "[ . 1 . 2]" 1
159 1 21 LEU H 1 21 LEU HB3 2.492 . 3.268 2.873 2.788 2.960 . 0 0 "[ . 1 . 2]" 1
160 1 20 LYS HG3 1 21 LEU H 2.666 . 3.554 2.953 2.642 4.520 0.966 4 1 "[ +. 1 . 2]" 1
161 1 20 LYS H 1 21 LEU H 3.370 . 4.790 4.305 4.257 4.348 . 0 0 "[ . 1 . 2]" 1
162 1 21 LEU H 1 22 ASP H 3.296 . 4.654 4.239 4.179 4.323 . 0 0 "[ . 1 . 2]" 1
163 1 15 ILE H 1 15 ILE HG13 2.462 . 3.220 3.099 2.985 3.209 . 0 0 "[ . 1 . 2]" 1
164 1 15 ILE H 1 43 ILE H 3.427 . 4.895 4.255 4.047 4.459 . 0 0 "[ . 1 . 2]" 1
165 1 67 VAL HB 1 68 VAL H 2.973 . 4.078 3.120 2.106 4.213 0.135 19 0 "[ . 1 . 2]" 1
166 1 68 VAL H 1 69 ILE H 3.480 . 4.993 4.290 4.190 4.408 . 0 0 "[ . 1 . 2]" 1
167 1 67 VAL H 1 68 VAL H 3.277 . 4.620 4.405 4.284 4.455 . 0 0 "[ . 1 . 2]" 1
168 1 57 VAL H 1 70 GLY HA2 3.352 . 4.756 4.677 4.559 4.783 0.027 15 0 "[ . 1 . 2]" 1
169 1 57 VAL H 1 69 ILE HB 2.927 . 3.998 2.739 2.394 2.960 . 0 0 "[ . 1 . 2]" 1
170 1 57 VAL H 1 57 VAL HA 2.756 . 3.705 2.936 2.909 2.955 . 0 0 "[ . 1 . 2]" 1
171 1 56 SER H 1 57 VAL H 3.300 . 4.661 4.228 4.019 4.384 . 0 0 "[ . 1 . 2]" 1
172 1 73 SER QB 1 74 ILE H 2.566 . 3.389 2.920 2.427 3.296 . 0 0 "[ . 1 . 2]" 1
173 1 74 ILE H 1 74 ILE HB 2.540 . 3.347 2.814 2.696 2.882 . 0 0 "[ . 1 . 2]" 1
174 1 74 ILE H 1 74 ILE HG13 2.734 . 3.669 3.162 2.979 3.256 . 0 0 "[ . 1 . 2]" 1
175 1 74 ILE H 1 74 ILE HA 2.719 . 3.643 2.922 2.907 2.937 . 0 0 "[ . 1 . 2]" 1
176 1 86 ASP H 1 86 ASP HA 2.884 . 3.924 2.858 2.272 2.949 . 0 0 "[ . 1 . 2]" 1
177 1 85 GLY HA2 1 86 ASP H 2.517 . 3.309 3.159 2.224 3.591 0.282 8 0 "[ . 1 . 2]" 1
178 1 86 ASP H 1 86 ASP HB3 3.163 . 4.414 2.902 2.344 3.659 . 0 0 "[ . 1 . 2]" 1
179 1 86 ASP H 1 86 ASP HB2 2.899 . 3.950 2.948 2.304 4.101 0.151 17 0 "[ . 1 . 2]" 1
180 1 15 ILE HA 1 62 VAL H 3.374 . 4.797 3.966 3.836 4.129 . 0 0 "[ . 1 . 2]" 1
181 1 61 PHE HB2 1 62 VAL H 2.984 . 4.097 3.895 3.767 3.966 . 0 0 "[ . 1 . 2]" 1
182 1 61 PHE HB3 1 62 VAL H 2.615 . 3.470 2.681 2.538 2.778 . 0 0 "[ . 1 . 2]" 1
183 1 17 PHE H 1 62 VAL H 3.684 . 5.381 4.725 4.634 4.845 . 0 0 "[ . 1 . 2]" 1
184 1 54 SER HA 1 55 GLY H 2.930 . 4.003 2.829 2.180 3.090 . 0 0 "[ . 1 . 2]" 1
185 1 51 THR HB 1 55 GLY H 2.893 . 3.939 3.716 3.027 4.049 0.110 9 0 "[ . 1 . 2]" 1
186 1 23 GLY HA3 1 55 GLY H 2.974 . 4.080 3.839 3.354 4.220 0.140 19 0 "[ . 1 . 2]" 1
187 1 55 GLY H 1 55 GLY HA2 2.364 . 3.063 2.836 2.731 2.933 . 0 0 "[ . 1 . 2]" 1
188 1 52 GLY H 1 55 GLY H 3.448 . 4.934 3.948 3.418 4.957 0.023 9 0 "[ . 1 . 2]" 1
189 1 55 GLY H 1 56 SER H 3.349 . 4.751 4.406 3.642 4.629 . 0 0 "[ . 1 . 2]" 1
190 1 54 SER H 1 55 GLY H 2.734 . 3.668 2.923 2.393 3.944 0.276 18 0 "[ . 1 . 2]" 1
191 1 79 ASP H 1 79 ASP HB2 2.456 . 3.210 2.933 2.500 3.633 0.423 16 0 "[ . 1 . 2]" 1
192 1 79 ASP H 1 81 ILE H 3.241 . 4.554 3.891 3.796 3.965 . 0 0 "[ . 1 . 2]" 1
193 1 79 ASP H 1 79 ASP HA 2.762 . 3.716 2.841 2.817 2.872 . 0 0 "[ . 1 . 2]" 1
194 1 33 GLN HB3 1 34 GLU H 2.646 . 3.521 3.466 3.258 3.560 0.039 8 0 "[ . 1 . 2]" 1
195 1 34 GLU H 1 34 GLU HB2 2.308 . 2.974 2.785 2.261 2.999 0.025 5 0 "[ . 1 . 2]" 1
196 1 33 GLN H 1 34 GLU H 3.488 . 5.009 4.446 4.389 4.536 . 0 0 "[ . 1 . 2]" 1
197 1 61 PHE H 1 61 PHE HB2 2.473 . 3.238 2.370 2.301 2.425 . 0 0 "[ . 1 . 2]" 1
198 1 61 PHE H 1 61 PHE HB3 2.785 . 3.755 3.580 3.557 3.599 . 0 0 "[ . 1 . 2]" 1
199 1 61 PHE H 1 66 ASP QB 3.163 . 4.414 4.098 3.469 4.227 . 0 0 "[ . 1 . 2]" 1
200 1 61 PHE H 1 62 VAL H 3.481 . 4.995 4.571 4.558 4.585 . 0 0 "[ . 1 . 2]" 1
201 1 16 GLY H 1 44 PHE HA 3.324 . 4.705 4.269 4.092 4.435 . 0 0 "[ . 1 . 2]" 1
202 1 15 ILE HB 1 16 GLY H 3.570 . 5.163 4.162 4.120 4.206 . 0 0 "[ . 1 . 2]" 1
203 1 16 GLY H 1 43 ILE HB 3.165 . 4.417 3.019 2.956 3.064 . 0 0 "[ . 1 . 2]" 1
204 1 16 GLY H 1 62 VAL MG1 3.175 . 4.435 4.392 4.242 4.477 0.042 12 0 "[ . 1 . 2]" 1
205 1 14 ALA MB 1 16 GLY H 2.518 . 3.311 3.302 3.189 3.351 0.040 17 0 "[ . 1 . 2]" 1
206 1 16 GLY H 1 61 PHE HA 3.496 . 5.024 4.381 4.283 4.500 . 0 0 "[ . 1 . 2]" 1
207 1 15 ILE H 1 16 GLY H 2.238 . 2.864 2.230 2.080 2.329 . 0 0 "[ . 1 . 2]" 1
208 1 16 GLY H 1 17 PHE H 3.544 . 5.114 4.361 4.349 4.371 . 0 0 "[ . 1 . 2]" 1
209 1 29 SER HB2 1 30 ILE H 2.583 . 3.417 2.984 2.087 3.596 0.179 9 0 "[ . 1 . 2]" 1
210 1 30 ILE H 1 31 ASN H 3.028 . 4.174 2.731 2.639 2.835 . 0 0 "[ . 1 . 2]" 1
211 1 61 PHE HB2 1 63 ASP H 2.897 . 3.946 3.380 3.151 3.630 . 0 0 "[ . 1 . 2]" 1
212 1 63 ASP H 1 63 ASP HB3 2.590 . 3.429 2.530 2.202 2.722 . 0 0 "[ . 1 . 2]" 1
213 1 63 ASP H 1 63 ASP HB2 2.679 . 3.576 2.649 2.483 2.906 . 0 0 "[ . 1 . 2]" 1
214 1 62 VAL H 1 63 ASP H 2.708 . 3.625 2.593 2.488 2.736 . 0 0 "[ . 1 . 2]" 1
215 1 79 ASP HB2 1 80 GLU H 2.967 . 4.068 3.971 3.832 4.114 0.046 12 0 "[ . 1 . 2]" 1
216 1 80 GLU H 1 80 GLU HG2 3.262 2.308 4.216 3.257 2.243 4.574 0.358 12 0 "[ . 1 . 2]" 1
217 1 80 GLU H 1 80 GLU HB2 2.418 . 3.149 2.417 2.300 2.556 . 0 0 "[ . 1 . 2]" 1
218 1 78 THR MG 1 80 GLU H 3.464 . 4.964 4.357 4.101 4.661 . 0 0 "[ . 1 . 2]" 1
219 1 80 GLU H 1 82 TYR H 3.253 . 4.576 4.166 3.947 4.278 . 0 0 "[ . 1 . 2]" 1
220 1 80 GLU H 1 81 ILE H 2.413 . 3.141 2.482 2.348 2.576 . 0 0 "[ . 1 . 2]" 1
221 1 78 THR H 1 80 GLU H 3.543 . 5.112 4.459 4.112 4.846 . 0 0 "[ . 1 . 2]" 1
222 1 79 ASP HA 1 80 GLU H 2.648 . 3.524 3.498 3.441 3.553 0.029 18 0 "[ . 1 . 2]" 1
223 1 79 ASP H 1 80 GLU H 2.697 . 3.606 2.560 2.464 2.707 . 0 0 "[ . 1 . 2]" 1
224 1 34 GLU HG3 1 35 ARG H 3.162 . 4.412 3.643 3.328 4.003 . 0 0 "[ . 1 . 2]" 1
225 1 35 ARG H 1 35 ARG HG2 3.042 . 4.199 2.717 2.211 3.754 . 0 0 "[ . 1 . 2]" 1
226 1 26 THR HB 1 35 ARG H 3.440 . 4.919 4.460 4.095 4.719 . 0 0 "[ . 1 . 2]" 1
227 1 77 MET H 1 77 MET HG2 2.544 . 3.353 2.224 2.118 2.509 . 0 0 "[ . 1 . 2]" 1
228 1 47 GLU HB2 1 77 MET H 3.446 . 4.930 4.228 4.125 4.353 . 0 0 "[ . 1 . 2]" 1
229 1 76 GLU HG2 1 77 MET H 3.089 . 4.282 3.070 2.754 4.178 . 0 0 "[ . 1 . 2]" 1
230 1 76 GLU HG3 1 77 MET H 2.586 . 3.422 3.054 2.899 3.289 . 0 0 "[ . 1 . 2]" 1
231 1 77 MET H 1 77 MET HB2 2.963 . 4.061 2.578 2.330 2.691 . 0 0 "[ . 1 . 2]" 1
232 1 48 THR MG 1 77 MET H 3.339 . 4.733 4.803 4.746 4.852 0.119 19 0 "[ . 1 . 2]" 1
233 1 75 VAL MG1 1 77 MET H 4.362 2.949 5.775 4.847 4.386 6.411 0.636 19 3 "[ - . * . +2]" 1
234 1 43 ILE MG 1 77 MET H 3.550 . 5.126 4.828 4.705 4.896 . 0 0 "[ . 1 . 2]" 1
235 1 47 GLU H 1 77 MET H 3.435 . 4.910 3.517 3.353 3.782 . 0 0 "[ . 1 . 2]" 1
236 1 77 MET H 1 78 THR H 3.474 . 4.982 4.133 4.106 4.162 . 0 0 "[ . 1 . 2]" 1
237 1 48 THR HA 1 77 MET H 2.776 . 3.739 3.237 3.150 3.366 . 0 0 "[ . 1 . 2]" 1
238 1 69 ILE H 1 69 ILE HA 2.865 . 3.891 2.937 2.918 2.947 . 0 0 "[ . 1 . 2]" 1
239 1 69 ILE H 1 69 ILE HB 2.471 . 3.234 2.656 2.606 2.725 . 0 0 "[ . 1 . 2]" 1
240 1 69 ILE H 1 69 ILE HG12 2.734 . 3.669 3.468 3.299 3.621 . 0 0 "[ . 1 . 2]" 1
241 1 69 ILE H 1 69 ILE HG13 2.615 . 3.470 2.347 2.114 2.491 . 0 0 "[ . 1 . 2]" 1
242 1 57 VAL H 1 69 ILE H 2.709 . 3.626 2.396 2.252 2.574 . 0 0 "[ . 1 . 2]" 1
243 1 69 ILE H 1 70 GLY H 3.467 . 4.970 4.476 4.372 4.531 . 0 0 "[ . 1 . 2]" 1
244 1 56 SER HA 1 69 ILE H 3.559 . 5.142 4.138 3.952 4.357 . 0 0 "[ . 1 . 2]" 1
245 1 58 THR MG 1 59 ILE H 2.426 . 3.161 3.127 2.996 3.210 0.049 7 0 "[ . 1 . 2]" 1
246 1 44 PHE HA 1 45 PHE H 2.368 . 3.069 2.318 2.242 2.392 . 0 0 "[ . 1 . 2]" 1
247 1 44 PHE HB3 1 45 PHE H 2.583 . 3.417 2.675 2.498 2.895 . 0 0 "[ . 1 . 2]" 1
248 1 45 PHE H 1 45 PHE HB2 2.299 . 2.960 2.212 2.173 2.272 . 0 0 "[ . 1 . 2]" 1
249 1 44 PHE HB2 1 45 PHE H 2.907 . 3.963 3.784 3.673 3.919 . 0 0 "[ . 1 . 2]" 1
250 1 15 ILE H 1 45 PHE H 3.534 . 5.095 3.824 3.669 3.943 . 0 0 "[ . 1 . 2]" 1
251 1 70 GLY HA2 1 71 GLY H 2.898 2.179 3.617 2.835 2.541 3.555 . 0 0 "[ . 1 . 2]" 1
252 1 71 GLY H 1 71 GLY HA3 2.462 . 3.219 2.470 2.359 2.948 . 0 0 "[ . 1 . 2]" 1
253 1 70 GLY HA3 1 71 GLY H 1.997 . 2.496 2.424 2.296 2.614 0.118 5 0 "[ . 1 . 2]" 1
254 1 23 GLY H 1 23 GLY HA2 2.168 . 2.756 2.298 2.283 2.316 . 0 0 "[ . 1 . 2]" 1
255 1 22 ASP QB 1 23 GLY H 2.888 . 3.931 3.172 2.440 3.549 . 0 0 "[ . 1 . 2]" 1
256 1 69 ILE MG 1 71 GLY H 3.509 . 5.048 4.703 2.460 5.054 0.006 20 0 "[ . 1 . 2]" 1
257 1 21 LEU MD2 1 23 GLY H 3.329 . 4.715 3.946 3.519 4.221 . 0 0 "[ . 1 . 2]" 1
258 1 22 ASP HA 1 23 GLY H 2.087 . 2.631 2.258 2.129 2.389 . 0 0 "[ . 1 . 2]" 1
259 1 22 ASP H 1 23 GLY H 3.280 . 4.625 4.335 4.262 4.391 . 0 0 "[ . 1 . 2]" 1
260 1 28 GLN H 1 28 GLN HG3 3.168 . 4.423 3.714 3.529 3.922 . 0 0 "[ . 1 . 2]" 1
261 1 28 GLN H 1 28 GLN HB2 2.645 . 3.519 2.209 2.172 2.279 . 0 0 "[ . 1 . 2]" 1
262 1 27 VAL MG2 1 28 GLN H 2.490 . 3.265 2.527 2.407 2.703 . 0 0 "[ . 1 . 2]" 1
263 1 28 GLN H 1 50 LEU H 3.345 . 4.744 4.247 4.053 4.475 . 0 0 "[ . 1 . 2]" 1
264 1 25 VAL HA 1 26 THR H 2.184 . 2.780 2.233 2.212 2.260 . 0 0 "[ . 1 . 2]" 1
265 1 26 THR H 1 26 THR HB 2.872 . 3.903 3.574 3.493 3.647 . 0 0 "[ . 1 . 2]" 1
266 1 26 THR H 1 50 LEU HB3 3.542 . 5.110 4.619 4.120 4.796 . 0 0 "[ . 1 . 2]" 1
267 1 26 THR H 1 26 THR MG 3.017 . 4.155 3.794 3.721 3.855 . 0 0 "[ . 1 . 2]" 1
268 1 25 VAL MG2 1 26 THR H 2.366 . 3.066 3.228 3.176 3.276 0.210 13 0 "[ . 1 . 2]" 1
269 1 26 THR H 1 51 THR MG 3.180 . 4.444 3.709 3.371 4.005 . 0 0 "[ . 1 . 2]" 1
270 1 25 VAL H 1 26 THR H 3.414 . 4.871 4.383 4.349 4.415 . 0 0 "[ . 1 . 2]" 1
271 1 26 THR H 1 26 THR HA 2.808 . 3.793 2.900 2.888 2.915 . 0 0 "[ . 1 . 2]" 1
272 1 21 LEU HB2 1 58 THR H 3.551 . 5.127 4.051 3.857 4.453 . 0 0 "[ . 1 . 2]" 1
273 1 20 LYS HG3 1 58 THR H 3.430 . 4.900 4.830 3.552 5.581 0.681 18 8 "[ * .* **- *. + *]" 1
274 1 57 VAL MG2 1 58 THR H 3.099 . 4.300 4.152 4.065 4.237 . 0 0 "[ . 1 . 2]" 1
275 1 20 LYS H 1 58 THR H 2.688 . 3.591 2.993 2.590 3.114 . 0 0 "[ . 1 . 2]" 1
276 1 21 LEU HA 1 58 THR H 2.938 . 4.017 3.302 3.190 3.669 . 0 0 "[ . 1 . 2]" 1
277 1 65 THR H 1 65 THR HA 2.723 . 3.650 2.893 2.866 2.914 . 0 0 "[ . 1 . 2]" 1
278 1 65 THR H 1 65 THR HB 2.791 . 3.765 3.553 3.491 3.602 . 0 0 "[ . 1 . 2]" 1
279 1 64 GLY HA3 1 65 THR H 2.871 . 3.901 3.130 3.044 3.219 . 0 0 "[ . 1 . 2]" 1
280 1 64 GLY HA2 1 65 THR H 2.963 . 4.060 3.384 3.334 3.433 . 0 0 "[ . 1 . 2]" 1
281 1 61 PHE HB2 1 65 THR H 2.921 . 3.988 3.055 2.953 3.280 . 0 0 "[ . 1 . 2]" 1
282 1 61 PHE HB3 1 65 THR H 3.203 . 4.485 4.015 3.787 4.253 . 0 0 "[ . 1 . 2]" 1
283 1 65 THR H 1 65 THR MG 2.494 . 3.272 2.768 2.598 2.921 . 0 0 "[ . 1 . 2]" 1
284 1 61 PHE H 1 65 THR H 3.334 . 4.724 4.431 4.158 4.628 . 0 0 "[ . 1 . 2]" 1
285 1 38 LYS H 1 41 ASP QB 2.840 . 3.848 2.352 1.892 2.862 . 0 0 "[ . 1 . 2]" 1
286 1 38 LYS H 1 38 LYS HG2 2.674 . 3.568 3.542 3.345 3.635 0.067 13 0 "[ . 1 . 2]" 1
287 1 38 LYS H 1 38 LYS HG3 2.583 . 3.417 2.624 2.258 2.953 . 0 0 "[ . 1 . 2]" 1
288 1 65 THR HA 1 66 ASP H 2.070 . 2.606 2.409 2.297 2.586 . 0 0 "[ . 1 . 2]" 1
289 1 65 THR HB 1 66 ASP H 2.192 . 2.793 2.541 2.104 2.821 0.028 12 0 "[ . 1 . 2]" 1
290 1 65 THR MG 1 66 ASP H 2.652 . 3.531 3.412 3.287 3.595 0.064 15 0 "[ . 1 . 2]" 1
291 1 37 LEU H 1 38 LYS H 3.307 . 4.674 4.440 4.248 4.548 . 0 0 "[ . 1 . 2]" 1
292 1 65 THR H 1 66 ASP H 3.267 . 4.601 4.591 4.519 4.615 0.014 2 0 "[ . 1 . 2]" 1
293 1 66 ASP H 1 66 ASP HA 2.704 . 3.618 2.939 2.895 2.953 . 0 0 "[ . 1 . 2]" 1
294 1 29 SER H 1 29 SER HB2 2.695 . 3.603 2.863 2.496 3.594 . 0 0 "[ . 1 . 2]" 1
295 1 29 SER H 1 29 SER HB3 2.534 . 3.337 3.194 2.492 3.595 0.258 11 0 "[ . 1 . 2]" 1
296 1 28 GLN HG2 1 29 SER H 3.164 . 4.415 4.096 3.936 4.296 . 0 0 "[ . 1 . 2]" 1
297 1 28 GLN HG3 1 29 SER H 3.277 . 4.620 4.658 4.547 4.730 0.110 5 0 "[ . 1 . 2]" 1
298 1 29 SER H 1 33 GLN HB3 3.181 . 4.446 4.427 4.131 4.509 0.063 10 0 "[ . 1 . 2]" 1
299 1 28 GLN HB3 1 29 SER H 2.917 . 3.980 3.985 3.940 4.043 0.063 1 0 "[ . 1 . 2]" 1
300 1 28 GLN HB2 1 29 SER H 3.277 . 4.620 4.620 4.602 4.639 0.019 9 0 "[ . 1 . 2]" 1
301 1 29 SER H 1 32 GLY H 3.512 . 5.054 4.007 3.785 4.378 . 0 0 "[ . 1 . 2]" 1
302 1 29 SER H 1 34 GLU HA 2.879 . 3.915 3.619 3.426 3.862 . 0 0 "[ . 1 . 2]" 1
303 1 28 GLN HA 1 29 SER H 2.054 . 2.581 2.188 2.160 2.219 . 0 0 "[ . 1 . 2]" 1
304 1 78 THR H 1 81 ILE HB 2.758 . 3.709 1.882 1.793 2.141 0.014 3 0 "[ . 1 . 2]" 1
305 1 77 MET HB2 1 78 THR H 3.461 . 4.958 4.430 4.390 4.533 . 0 0 "[ . 1 . 2]" 1
306 1 78 THR H 1 81 ILE HG13 3.191 . 4.464 2.411 2.270 2.647 . 0 0 "[ . 1 . 2]" 1
307 1 78 THR H 1 81 ILE MG 3.062 . 4.234 3.123 2.844 3.578 . 0 0 "[ . 1 . 2]" 1
308 1 78 THR H 1 79 ASP H 3.064 . 4.237 4.314 4.286 4.358 0.121 14 0 "[ . 1 . 2]" 1
309 1 38 LYS HB3 1 39 LEU H 2.350 . 3.040 2.437 2.217 2.991 . 0 0 "[ . 1 . 2]" 1
310 1 39 LEU H 1 39 LEU HB2 2.077 . 2.616 2.296 2.243 2.346 . 0 0 "[ . 1 . 2]" 1
311 1 38 LYS HG3 1 39 LEU H 3.337 . 4.729 4.866 4.506 5.045 0.316 1 0 "[ . 1 . 2]" 1
312 1 21 LEU MD2 1 39 LEU H 2.727 . 3.657 3.576 3.243 3.712 0.055 11 0 "[ . 1 . 2]" 1
313 1 26 THR HB 1 27 VAL H 2.444 . 3.191 2.903 2.846 2.960 . 0 0 "[ . 1 . 2]" 1
314 1 27 VAL H 1 27 VAL HB 2.570 . 3.396 2.969 2.915 3.008 . 0 0 "[ . 1 . 2]" 1
315 1 27 VAL H 1 37 LEU HG 3.509 . 5.049 3.352 3.212 3.443 . 0 0 "[ . 1 . 2]" 1
316 1 27 VAL H 1 37 LEU QD 3.125 . 4.346 3.620 3.392 3.810 . 0 0 "[ . 1 . 2]" 1
317 1 51 THR H 1 73 SER QB 3.347 . 4.747 3.992 3.649 4.160 . 0 0 "[ . 1 . 2]" 1
318 1 50 LEU HB2 1 51 THR H 3.384 . 4.815 4.347 4.245 4.406 . 0 0 "[ . 1 . 2]" 1
319 1 50 LEU HB3 1 51 THR H 3.005 . 4.134 3.759 3.445 3.907 . 0 0 "[ . 1 . 2]" 1
320 1 51 THR H 1 74 ILE MD 3.306 . 4.672 4.705 4.663 4.738 0.066 1 0 "[ . 1 . 2]" 1
321 1 51 THR H 1 51 THR HG1 3.242 . 4.556 3.500 2.950 3.628 . 0 0 "[ . 1 . 2]" 1
322 1 52 GLY HA2 1 73 SER H 3.462 . 4.960 4.378 3.998 4.559 . 0 0 "[ . 1 . 2]" 1
323 1 72 ASP HA 1 73 SER H 2.398 . 3.117 2.923 2.583 3.034 . 0 0 "[ . 1 . 2]" 1
324 1 71 GLY HA3 1 73 SER H 3.420 . 4.882 4.265 4.122 4.693 . 0 0 "[ . 1 . 2]" 1
325 1 71 GLY HA2 1 73 SER H 3.399 . 4.843 3.117 2.996 3.530 . 0 0 "[ . 1 . 2]" 1
326 1 51 THR MG 1 73 SER H 2.918 . 3.982 3.756 3.510 3.870 . 0 0 "[ . 1 . 2]" 1
327 1 51 THR HG1 1 73 SER H 2.385 . 3.096 2.203 2.054 2.541 . 0 0 "[ . 1 . 2]" 1
328 1 50 LEU HA 1 73 SER H 3.604 . 5.228 5.215 4.817 5.332 0.104 16 0 "[ . 1 . 2]" 1
329 1 73 SER H 1 73 SER HA 2.754 . 3.702 2.937 2.887 2.950 . 0 0 "[ . 1 . 2]" 1
330 1 51 THR H 1 73 SER H 2.651 . 3.530 3.304 2.916 3.406 . 0 0 "[ . 1 . 2]" 1
331 1 54 SER H 1 54 SER HB2 3.512 . 5.054 2.945 2.496 3.677 . 0 0 "[ . 1 . 2]" 1
332 1 53 GLY HA2 1 54 SER H 2.881 . 3.918 3.016 2.118 3.456 . 0 0 "[ . 1 . 2]" 1
333 1 72 ASP H 1 72 ASP HA 2.137 . 2.708 2.273 2.264 2.285 . 0 0 "[ . 1 . 2]" 1
334 1 52 GLY HA3 1 72 ASP H 2.852 . 3.869 3.947 3.896 3.995 0.126 5 0 "[ . 1 . 2]" 1
335 1 71 GLY HA2 1 72 ASP H 2.553 . 3.368 2.282 2.222 2.554 . 0 0 "[ . 1 . 2]" 1
336 1 55 GLY HA2 1 72 ASP H 3.581 . 5.184 5.237 4.881 5.365 0.181 18 0 "[ . 1 . 2]" 1
337 1 72 ASP H 1 72 ASP HB3 3.216 . 4.509 3.581 3.069 3.689 . 0 0 "[ . 1 . 2]" 1
338 1 72 ASP H 1 72 ASP HB2 3.117 . 4.332 3.124 2.993 3.994 . 0 0 "[ . 1 . 2]" 1
339 1 51 THR MG 1 72 ASP H 3.592 . 5.205 4.374 4.123 4.581 . 0 0 "[ . 1 . 2]" 1
340 1 55 GLY H 1 72 ASP H 3.436 . 4.912 3.348 2.356 4.085 . 0 0 "[ . 1 . 2]" 1
341 1 51 THR HG1 1 72 ASP H 3.015 . 4.151 3.324 3.052 4.030 . 0 0 "[ . 1 . 2]" 1
342 1 72 ASP H 1 73 SER H 2.623 . 3.483 2.662 2.573 2.979 . 0 0 "[ . 1 . 2]" 1
343 1 69 ILE HA 1 70 GLY H 2.080 . 2.621 2.197 2.160 2.253 . 0 0 "[ . 1 . 2]" 1
344 1 70 GLY H 1 73 SER QB 3.600 . 5.220 3.366 2.909 4.074 . 0 0 "[ . 1 . 2]" 1
345 1 69 ILE MG 1 70 GLY H 2.479 . 3.247 2.454 2.247 2.627 . 0 0 "[ . 1 . 2]" 1
346 1 68 VAL QG 1 70 GLY H 3.431 . 4.902 4.178 4.021 4.506 . 0 0 "[ . 1 . 2]" 1
347 1 25 VAL HA 1 52 GLY H 3.151 . 4.392 3.543 3.348 3.968 . 0 0 "[ . 1 . 2]" 1
348 1 52 GLY H 1 52 GLY HA2 2.488 . 3.262 2.946 2.916 2.957 . 0 0 "[ . 1 . 2]" 1
349 1 51 THR HB 1 52 GLY H 2.727 . 3.657 2.653 2.459 2.904 . 0 0 "[ . 1 . 2]" 1
350 1 52 GLY H 1 52 GLY HA3 2.347 . 3.036 2.522 2.443 2.630 . 0 0 "[ . 1 . 2]" 1
351 1 24 SER HB3 1 52 GLY H 3.035 . 4.186 3.613 2.799 4.651 0.465 14 0 "[ . 1 . 2]" 1
352 1 24 SER HB2 1 52 GLY H 3.292 . 4.647 3.945 2.597 4.748 0.101 17 0 "[ . 1 . 2]" 1
353 1 52 GLY H 1 55 GLY HA2 3.120 . 4.337 4.190 4.064 4.354 0.017 7 0 "[ . 1 . 2]" 1
354 1 51 THR MG 1 52 GLY H 3.045 . 4.204 3.791 3.710 3.908 . 0 0 "[ . 1 . 2]" 1
355 1 51 THR HA 1 52 GLY H 2.214 . 2.827 2.293 2.225 2.408 . 0 0 "[ . 1 . 2]" 1
356 1 52 GLY H 1 55 GLY HA3 3.041 . 4.197 3.023 2.717 3.373 . 0 0 "[ . 1 . 2]" 1
357 1 14 ALA H 1 44 PHE QD 3.182 . 4.448 3.394 3.097 3.671 . 0 0 "[ . 1 . 2]" 1
358 1 44 PHE H 1 44 PHE HB2 2.591 . 3.430 2.595 2.557 2.628 . 0 0 "[ . 1 . 2]" 1
359 1 44 PHE H 1 47 GLU HB2 3.310 . 4.679 3.567 3.379 3.753 . 0 0 "[ . 1 . 2]" 1
360 1 43 ILE HG12 1 44 PHE H 3.375 . 4.799 4.863 4.836 4.890 0.091 11 0 "[ . 1 . 2]" 1
361 1 15 ILE HG12 1 44 PHE H 3.436 . 4.912 4.024 3.936 4.107 . 0 0 "[ . 1 . 2]" 1
362 1 15 ILE HG13 1 44 PHE H 3.631 . 5.279 5.349 5.308 5.385 0.106 11 0 "[ . 1 . 2]" 1
363 1 23 GLY HA3 1 56 SER H 3.233 . 4.539 3.596 3.343 3.955 . 0 0 "[ . 1 . 2]" 1
364 1 56 SER H 1 56 SER HB3 2.844 . 3.855 3.766 2.634 3.960 0.105 9 0 "[ . 1 . 2]" 1
365 1 55 GLY HA2 1 56 SER H 2.472 . 3.236 2.204 2.162 2.299 . 0 0 "[ . 1 . 2]" 1
366 1 22 ASP QB 1 56 SER H 3.010 . 4.142 2.731 2.016 3.295 . 0 0 "[ . 1 . 2]" 1
367 1 56 SER H 1 57 VAL MG2 2.486 . 3.259 3.316 3.072 3.473 0.214 16 0 "[ . 1 . 2]" 1
368 1 56 SER H 1 56 SER HA 2.555 . 3.371 2.917 2.888 2.956 . 0 0 "[ . 1 . 2]" 1
369 1 22 ASP H 1 56 SER H 2.466 . 3.226 2.873 2.604 3.103 . 0 0 "[ . 1 . 2]" 1
370 1 33 GLN H 1 33 GLN HB2 2.357 . 3.051 2.319 2.198 2.520 . 0 0 "[ . 1 . 2]" 1
371 1 29 SER H 1 33 GLN H 2.851 . 3.867 3.348 2.946 3.607 . 0 0 "[ . 1 . 2]" 1
372 1 75 VAL H 1 76 GLU HA 3.539 . 5.105 4.665 4.540 4.797 . 0 0 "[ . 1 . 2]" 1
373 1 75 VAL H 1 75 VAL HB 2.946 2.198 3.694 3.365 3.225 3.734 0.040 19 0 "[ . 1 . 2]" 1
374 1 74 ILE HB 1 75 VAL H 3.408 . 4.860 4.303 4.211 4.416 . 0 0 "[ . 1 . 2]" 1
375 1 74 ILE HG12 1 75 VAL H 3.290 . 4.643 4.457 4.292 4.614 . 0 0 "[ . 1 . 2]" 1
376 1 75 VAL H 1 75 VAL MG1 2.427 . 3.163 2.539 2.251 3.376 0.213 3 0 "[ . 1 . 2]" 1
377 1 74 ILE MG 1 75 VAL H 2.682 . 3.581 2.874 2.643 3.155 . 0 0 "[ . 1 . 2]" 1
378 1 75 VAL H 1 76 GLU H 3.193 . 4.468 4.332 4.264 4.416 . 0 0 "[ . 1 . 2]" 1
379 1 74 ILE H 1 75 VAL H 3.431 . 4.903 4.089 3.861 4.231 . 0 0 "[ . 1 . 2]" 1
380 1 48 THR HA 1 75 VAL H 3.125 . 4.345 4.339 4.210 4.409 0.064 1 0 "[ . 1 . 2]" 1
381 1 32 GLY H 1 32 GLY HA2 2.262 . 2.901 2.357 2.321 2.401 . 0 0 "[ . 1 . 2]" 1
382 1 31 ASN HB2 1 32 GLY H 3.629 . 5.275 3.578 2.969 4.284 . 0 0 "[ . 1 . 2]" 1
383 1 32 GLY H 1 33 GLN QG 3.537 . 5.100 4.240 3.623 4.702 . 0 0 "[ . 1 . 2]" 1
384 1 30 ILE HB 1 32 GLY H 3.490 . 5.013 5.097 5.045 5.128 0.115 4 0 "[ . 1 . 2]" 1
385 1 32 GLY H 1 33 GLN H 2.450 . 3.200 2.254 2.082 2.343 . 0 0 "[ . 1 . 2]" 1
386 1 46 GLY H 1 77 MET HB3 2.637 . 3.506 3.323 2.566 3.514 0.008 16 0 "[ . 1 . 2]" 1
387 1 46 GLY H 1 77 MET HB2 2.941 . 4.022 2.109 1.975 2.309 . 0 0 "[ . 1 . 2]" 1
388 1 30 ILE MG 1 46 GLY H 3.561 . 5.146 4.341 4.184 4.511 . 0 0 "[ . 1 . 2]" 1
389 1 46 GLY H 1 47 GLU H 2.654 . 3.534 2.190 2.064 2.439 . 0 0 "[ . 1 . 2]" 1
390 1 46 GLY H 1 77 MET H 3.474 . 4.982 3.849 3.714 3.987 . 0 0 "[ . 1 . 2]" 1
391 1 29 SER HB2 1 31 ASN H 3.484 . 5.001 3.110 2.672 4.579 . 0 0 "[ . 1 . 2]" 1
392 1 29 SER HB3 1 31 ASN H 3.557 . 5.139 3.584 3.015 4.671 . 0 0 "[ . 1 . 2]" 1
393 1 30 ILE HA 1 31 ASN H 3.227 . 4.528 3.436 3.311 3.521 . 0 0 "[ . 1 . 2]" 1
394 1 31 ASN H 1 31 ASN HB2 3.234 . 4.541 2.836 2.415 3.659 . 0 0 "[ . 1 . 2]" 1
395 1 31 ASN H 1 31 ASN HB3 3.216 . 4.509 3.393 2.587 3.715 . 0 0 "[ . 1 . 2]" 1
396 1 30 ILE HB 1 31 ASN H 3.471 . 4.977 3.889 3.615 4.198 . 0 0 "[ . 1 . 2]" 1
397 1 30 ILE HG12 1 31 ASN H 3.563 . 5.150 3.075 2.794 3.462 . 0 0 "[ . 1 . 2]" 1
398 1 30 ILE MG 1 31 ASN H 3.402 . 4.849 4.174 4.060 4.306 . 0 0 "[ . 1 . 2]" 1
399 1 20 LYS H 1 20 LYS HA 2.464 . 3.223 2.919 2.907 2.938 . 0 0 "[ . 1 . 2]" 1
400 1 20 LYS H 1 20 LYS HG3 3.252 . 4.574 4.666 4.300 4.829 0.255 4 0 "[ . 1 . 2]" 1
401 1 20 LYS H 1 57 VAL HA 3.513 . 5.056 4.786 4.303 4.978 . 0 0 "[ . 1 . 2]" 1
402 1 19 THR H 1 20 LYS H 2.074 . 2.612 1.899 1.865 1.927 . 0 0 "[ . 1 . 2]" 1
403 1 52 GLY HA2 1 53 GLY H 2.879 . 3.915 2.289 2.105 2.906 . 0 0 "[ . 1 . 2]" 1
404 1 53 GLY H 1 53 GLY HA2 2.338 . 3.021 2.381 2.267 2.808 . 0 0 "[ . 1 . 2]" 1
405 1 53 GLY H 1 54 SER H 3.636 . 5.289 4.274 3.126 4.569 . 0 0 "[ . 1 . 2]" 1
406 1 87 ASN H 1 87 ASN HB3 3.599 . 5.218 3.289 2.499 4.147 . 0 0 "[ . 1 . 2]" 1
407 1 87 ASN H 1 87 ASN HB2 3.152 . 4.394 2.923 2.340 3.582 . 0 0 "[ . 1 . 2]" 1
408 1 61 PHE HB2 1 64 GLY H 3.419 . 4.880 3.657 3.507 3.836 . 0 0 "[ . 1 . 2]" 1
409 1 63 ASP HB3 1 64 GLY H 3.341 . 4.736 3.133 3.044 3.533 . 0 0 "[ . 1 . 2]" 1
410 1 63 ASP H 1 64 GLY H 2.353 . 3.045 2.322 2.137 2.477 . 0 0 "[ . 1 . 2]" 1
411 1 28 GLN HB3 1 28 GLN HE22 3.749 . 5.505 4.397 3.927 4.491 . 0 0 "[ . 1 . 2]" 1
412 1 26 THR H 1 51 THR HA 2.962 . 4.059 3.486 3.288 3.692 . 0 0 "[ . 1 . 2]" 1
413 1 25 VAL HB 1 26 THR H 3.330 . 4.716 2.602 2.567 2.658 . 0 0 "[ . 1 . 2]" 1
414 1 61 PHE QD 1 67 VAL H 3.694 . 5.400 3.893 3.485 4.651 . 0 0 "[ . 1 . 2]" 1
415 1 64 GLY H 1 65 THR H 2.382 . 3.091 2.256 2.112 2.450 . 0 0 "[ . 1 . 2]" 1
416 1 58 THR H 1 59 ILE H 2.981 . 4.092 4.135 4.080 4.170 0.078 4 0 "[ . 1 . 2]" 1
417 1 20 LYS HA 1 58 THR H 3.691 . 5.394 4.461 4.020 4.579 . 0 0 "[ . 1 . 2]" 1
418 1 20 LYS H 1 21 LEU HA 3.974 . 5.948 4.829 4.728 4.907 . 0 0 "[ . 1 . 2]" 1
419 1 17 PHE HA 1 60 ALA H 3.800 . 5.605 4.932 4.788 5.072 . 0 0 "[ . 1 . 2]" 1
420 1 47 GLU H 1 48 THR H 3.819 . 5.642 4.549 4.495 4.582 . 0 0 "[ . 1 . 2]" 1
421 1 26 THR H 1 50 LEU H 2.754 . 3.702 2.910 2.710 3.093 . 0 0 "[ . 1 . 2]" 1
422 1 24 SER H 1 55 GLY HA3 2.653 . 3.533 3.606 3.545 3.697 0.164 3 0 "[ . 1 . 2]" 1
423 1 51 THR HG1 1 52 GLY H 3.805 . 5.615 4.650 4.398 5.046 . 0 0 "[ . 1 . 2]" 1
424 1 35 ARG H 1 35 ARG HD3 3.595 . 5.210 4.429 4.060 5.265 0.055 12 0 "[ . 1 . 2]" 1
425 1 27 VAL H 1 28 GLN H 3.641 . 5.298 4.293 4.249 4.331 . 0 0 "[ . 1 . 2]" 1
426 1 27 VAL H 1 35 ARG H 2.450 . 3.200 2.654 2.490 2.831 . 0 0 "[ . 1 . 2]" 1
427 1 61 PHE QE 1 67 VAL H 3.628 . 5.273 3.926 3.622 4.513 . 0 0 "[ . 1 . 2]" 1
428 1 59 ILE MG 1 67 VAL H 3.754 . 5.516 4.135 3.889 4.612 . 0 0 "[ . 1 . 2]" 1
429 1 60 ALA MB 1 67 VAL H 3.666 . 5.346 4.690 4.387 4.863 . 0 0 "[ . 1 . 2]" 1
430 1 59 ILE H 1 69 ILE H 3.860 . 5.722 4.563 4.269 4.720 . 0 0 "[ . 1 . 2]" 1
431 1 59 ILE H 1 68 VAL HA 3.102 . 4.305 3.359 3.010 3.576 . 0 0 "[ . 1 . 2]" 1
432 1 59 ILE H 1 66 ASP QB 3.731 . 5.471 4.635 4.381 4.949 . 0 0 "[ . 1 . 2]" 1
433 1 16 GLY HA3 1 60 ALA H 3.970 . 5.940 4.976 4.863 5.078 . 0 0 "[ . 1 . 2]" 1
434 1 68 VAL HA 1 69 ILE H 2.129 . 2.696 2.148 2.102 2.216 . 0 0 "[ . 1 . 2]" 1
435 1 48 THR H 1 49 VAL H 3.789 . 5.584 4.270 4.234 4.319 . 0 0 "[ . 1 . 2]" 1
436 1 28 GLN H 1 49 VAL H 3.579 . 5.180 4.475 4.370 4.555 . 0 0 "[ . 1 . 2]" 1
437 1 49 VAL H 1 77 MET HG2 3.921 . 5.843 4.068 3.929 4.363 . 0 0 "[ . 1 . 2]" 1
438 1 50 LEU H 1 51 THR H 3.179 . 4.443 4.111 3.955 4.305 . 0 0 "[ . 1 . 2]" 1
439 1 52 GLY H 1 73 SER H 3.381 . 4.810 4.873 4.737 4.956 0.146 17 0 "[ . 1 . 2]" 1
440 1 71 GLY H 1 73 SER H 3.057 . 4.225 4.391 4.247 4.537 0.312 16 0 "[ . 1 . 2]" 1
441 1 72 ASP HB2 1 73 SER H 3.711 . 5.433 4.516 4.379 4.622 . 0 0 "[ . 1 . 2]" 1
442 1 17 PHE H 1 18 ILE H 3.645 . 5.306 4.355 4.324 4.375 . 0 0 "[ . 1 . 2]" 1
443 1 77 MET H 1 77 MET HA 2.722 . 3.648 2.834 2.812 2.858 . 0 0 "[ . 1 . 2]" 1
444 1 55 GLY HA3 1 72 ASP H 2.816 . 3.807 3.699 3.595 3.822 0.015 17 0 "[ . 1 . 2]" 1
445 1 85 GLY H 1 86 ASP H 2.624 . 3.485 2.275 1.718 3.241 0.045 9 0 "[ . 1 . 2]" 1
446 1 24 SER H 1 55 GLY H 3.282 . 4.629 3.981 3.502 4.664 0.035 18 0 "[ . 1 . 2]" 1
447 1 76 GLU H 1 77 MET H 3.474 . 4.983 4.460 4.398 4.499 . 0 0 "[ . 1 . 2]" 1
448 1 61 PHE H 1 67 VAL QG 3.781 . 5.568 4.347 3.752 5.008 . 0 0 "[ . 1 . 2]" 1
449 1 19 THR MG 1 61 PHE H 3.882 . 5.765 5.724 5.651 5.778 0.013 17 0 "[ . 1 . 2]" 1
450 1 61 PHE QD 1 66 ASP H 4.076 . 6.152 4.008 3.432 4.429 . 0 0 "[ . 1 . 2]" 1
451 1 81 ILE H 1 82 TYR H 2.271 . 2.916 2.431 2.228 2.594 . 0 0 "[ . 1 . 2]" 1
452 1 55 GLY H 1 55 GLY HA3 2.486 . 3.259 2.343 2.285 2.653 . 0 0 "[ . 1 . 2]" 1
453 1 77 MET H 1 81 ILE MD 3.489 . 5.011 5.041 4.962 5.071 0.060 12 0 "[ . 1 . 2]" 1
454 1 87 ASN H 1 87 ASN HA 2.116 . 2.676 2.661 2.253 2.903 0.227 15 0 "[ . 1 . 2]" 1
455 1 15 ILE H 1 44 PHE H 4.032 . 6.064 4.456 4.383 4.560 . 0 0 "[ . 1 . 2]" 1
456 1 44 PHE H 1 45 PHE H 3.712 . 5.435 4.489 4.468 4.523 . 0 0 "[ . 1 . 2]" 1
457 1 35 ARG HB3 1 35 ARG HE 3.432 2.358 4.506 4.116 2.102 4.650 0.256 12 0 "[ . 1 . 2]" 1
458 1 35 ARG HE 1 35 ARG HG2 3.075 . 4.257 3.053 2.533 3.336 . 0 0 "[ . 1 . 2]" 1
459 1 15 ILE HB 1 45 PHE H 3.862 . 5.726 5.070 4.981 5.157 . 0 0 "[ . 1 . 2]" 1
460 1 13 ASN HB3 1 14 ALA H 2.766 . 3.722 3.045 2.154 3.830 0.108 18 0 "[ . 1 . 2]" 1
461 1 51 THR HG1 1 55 GLY H 4.107 . 6.216 4.914 4.358 5.200 . 0 0 "[ . 1 . 2]" 1
462 1 51 THR HG1 1 70 GLY H 4.428 . 6.879 4.345 4.074 4.884 . 0 0 "[ . 1 . 2]" 1
463 1 51 THR HG1 1 71 GLY H 3.640 . 5.296 3.937 3.085 4.146 . 0 0 "[ . 1 . 2]" 1
464 1 60 ALA H 1 66 ASP HA 4.088 . 6.177 4.703 4.536 4.799 . 0 0 "[ . 1 . 2]" 1
465 1 13 ASN H 1 13 ASN HD22 3.965 . 5.930 4.436 2.731 5.409 . 0 0 "[ . 1 . 2]" 1
466 1 13 ASN H 1 13 ASN HD21 4.328 . 6.670 4.747 3.447 6.142 . 0 0 "[ . 1 . 2]" 1
467 1 13 ASN H 1 13 ASN HA 2.805 . 3.789 2.832 2.257 2.954 . 0 0 "[ . 1 . 2]" 1
468 1 13 ASN HB2 1 13 ASN HD21 3.416 . 4.875 3.697 3.470 4.076 . 0 0 "[ . 1 . 2]" 1
469 1 16 GLY HA2 1 61 PHE H 3.820 . 5.644 4.738 4.626 4.884 . 0 0 "[ . 1 . 2]" 1
470 1 59 ILE HA 1 61 PHE H 4.001 . 6.002 5.367 5.246 5.526 . 0 0 "[ . 1 . 2]" 1
471 1 28 GLN HB3 1 28 GLN HE21 3.955 . 5.910 4.671 4.382 4.771 . 0 0 "[ . 1 . 2]" 1
472 1 51 THR MG 1 55 GLY H 3.693 . 5.398 4.925 4.400 5.176 . 0 0 "[ . 1 . 2]" 1
473 1 31 ASN QD 1 33 GLN QG 4.239 . 5.715 3.402 2.748 4.176 . 0 0 "[ . 1 . 2]" 1
474 1 30 ILE MG 1 31 ASN QD 4.454 . 6.564 5.393 4.705 5.934 . 0 0 "[ . 1 . 2]" 1
475 1 31 ASN QD 1 33 GLN HB2 3.942 . 5.885 3.639 2.330 4.167 . 0 0 "[ . 1 . 2]" 1
476 1 77 MET HA 1 78 THR H 2.198 . 2.802 2.234 2.204 2.275 . 0 0 "[ . 1 . 2]" 1
477 1 23 GLY H 1 23 GLY HA3 2.321 . 2.994 2.861 2.829 2.886 . 0 0 "[ . 1 . 2]" 1
478 1 31 ASN HB2 1 33 GLN H 3.768 . 5.543 3.166 2.472 4.589 . 0 0 "[ . 1 . 2]" 1
479 1 63 ASP H 1 63 ASP HA 2.643 . 3.516 2.895 2.861 2.936 . 0 0 "[ . 1 . 2]" 1
480 1 37 LEU H 1 37 LEU HG 2.570 . 3.395 3.096 2.938 3.211 . 0 0 "[ . 1 . 2]" 1
481 1 21 LEU MD1 1 38 LYS H 3.019 . 4.159 3.585 3.177 3.966 . 0 0 "[ . 1 . 2]" 1
482 1 61 PHE H 1 66 ASP H 3.997 . 5.994 4.519 4.268 4.685 . 0 0 "[ . 1 . 2]" 1
483 1 21 LEU MD1 1 22 ASP H 2.839 . 3.847 3.922 3.848 3.988 0.141 15 0 "[ . 1 . 2]" 1
484 1 30 ILE HG13 1 31 ASN H 3.904 . 5.809 2.726 2.339 3.316 . 0 0 "[ . 1 . 2]" 1
485 1 54 SER HB2 1 55 GLY H 3.625 . 5.268 4.228 3.876 4.606 . 0 0 "[ . 1 . 2]" 1
486 1 21 LEU H 1 21 LEU MD1 3.347 . 4.747 4.818 4.785 4.853 0.106 20 0 "[ . 1 . 2]" 1
487 1 63 ASP HB2 1 65 THR H 4.203 . 6.411 4.409 4.166 4.603 . 0 0 "[ . 1 . 2]" 1
488 1 68 VAL H 1 68 VAL HA 2.687 . 3.590 2.930 2.919 2.941 . 0 0 "[ . 1 . 2]" 1
489 1 63 ASP HB2 1 64 GLY H 3.673 . 5.359 4.115 4.009 4.253 . 0 0 "[ . 1 . 2]" 1
490 1 50 LEU H 1 50 LEU HG 2.977 . 4.085 3.150 2.827 3.353 . 0 0 "[ . 1 . 2]" 1
491 1 56 SER HB2 1 57 VAL H 2.915 . 3.977 4.044 3.869 4.149 0.172 5 0 "[ . 1 . 2]" 1
492 1 31 ASN HA 1 32 GLY H 2.756 . 3.705 3.329 3.164 3.435 . 0 0 "[ . 1 . 2]" 1
493 1 63 ASP HB2 1 85 GLY H 3.945 . 5.890 4.121 3.723 4.768 . 0 0 "[ . 1 . 2]" 1
494 1 63 ASP HA 1 64 GLY H 2.691 . 3.596 3.415 3.266 3.443 . 0 0 "[ . 1 . 2]" 1
495 1 53 GLY H 1 72 ASP H 4.351 . 6.718 3.291 2.458 4.429 . 0 0 "[ . 1 . 2]" 1
496 1 55 GLY H 1 71 GLY HA2 3.149 . 4.389 2.883 2.308 3.199 . 0 0 "[ . 1 . 2]" 1
497 1 28 GLN HE21 1 32 GLY HA2 4.551 . 7.140 5.650 5.013 6.126 . 0 0 "[ . 1 . 2]" 1
498 1 78 THR H 1 82 TYR H 4.040 . 6.081 3.927 3.602 4.169 . 0 0 "[ . 1 . 2]" 1
499 1 77 MET HB3 1 78 THR H 3.786 . 5.578 4.017 3.978 4.066 . 0 0 "[ . 1 . 2]" 1
500 1 21 LEU HG 1 23 GLY H 3.909 . 5.819 5.321 4.968 5.529 . 0 0 "[ . 1 . 2]" 1
501 1 57 VAL H 1 68 VAL HA 3.262 . 4.592 4.021 3.808 4.372 . 0 0 "[ . 1 . 2]" 1
502 1 58 THR H 1 68 VAL QG 3.337 . 4.729 4.284 3.607 4.605 . 0 0 "[ . 1 . 2]" 1
503 1 19 THR H 1 60 ALA MB 3.315 . 4.688 3.924 3.808 4.018 . 0 0 "[ . 1 . 2]" 1
504 1 25 VAL H 1 25 VAL MG2 2.835 . 3.840 2.521 2.473 2.591 . 0 0 "[ . 1 . 2]" 1
505 1 43 ILE H 1 59 ILE MG 4.098 . 6.197 4.017 3.902 4.160 . 0 0 "[ . 1 . 2]" 1
506 1 45 PHE QE 1 82 TYR H 3.538 . 5.102 4.331 4.249 4.431 . 0 0 "[ . 1 . 2]" 1
507 1 52 GLY H 1 72 ASP H 4.105 . 6.211 3.310 3.020 3.564 . 0 0 "[ . 1 . 2]" 1
508 1 17 PHE H 1 59 ILE HA 3.214 . 4.506 4.003 3.859 4.093 . 0 0 "[ . 1 . 2]" 1
509 1 17 PHE H 1 43 ILE HB 3.555 . 5.135 4.369 4.224 4.456 . 0 0 "[ . 1 . 2]" 1
510 1 74 ILE H 1 75 VAL HB 3.882 . 5.766 4.499 4.141 5.895 0.129 3 0 "[ . 1 . 2]" 1
511 1 49 VAL HB 1 50 LEU H 3.215 . 4.507 3.909 3.720 4.051 . 0 0 "[ . 1 . 2]" 1
512 1 32 GLY H 1 33 GLN HB3 3.796 . 5.597 5.726 5.644 5.779 0.182 10 0 "[ . 1 . 2]" 1
513 1 46 GLY HA3 1 77 MET H 4.408 . 6.836 5.624 5.431 5.785 . 0 0 "[ . 1 . 2]" 1
514 1 17 PHE HB3 1 60 ALA H 4.424 . 6.871 5.336 5.251 5.437 . 0 0 "[ . 1 . 2]" 1
515 1 18 ILE H 1 41 ASP QB 3.791 . 5.587 4.183 3.861 4.743 . 0 0 "[ . 1 . 2]" 1
516 1 35 ARG HD3 1 36 VAL H 3.580 . 5.182 5.304 4.917 5.605 0.423 17 0 "[ . 1 . 2]" 1
517 1 17 PHE H 1 43 ILE H 4.413 . 6.848 4.406 4.322 4.541 . 0 0 "[ . 1 . 2]" 1
518 1 38 LYS QE 1 39 LEU H 4.508 . 7.049 5.953 4.956 6.209 . 0 0 "[ . 1 . 2]" 1
519 1 15 ILE H 1 43 ILE HB 3.897 . 5.795 4.126 3.999 4.299 . 0 0 "[ . 1 . 2]" 1
520 1 15 ILE H 1 62 VAL MG1 3.611 . 5.241 4.786 4.609 4.914 . 0 0 "[ . 1 . 2]" 1
521 1 49 VAL H 1 49 VAL MG1 2.959 . 4.053 3.805 3.789 3.814 . 0 0 "[ . 1 . 2]" 1
522 1 79 ASP HB2 1 81 ILE H 3.750 . 5.508 5.452 5.268 5.537 0.029 1 0 "[ . 1 . 2]" 1
523 1 81 ILE H 1 82 TYR HB3 3.982 . 5.964 4.865 4.582 5.060 . 0 0 "[ . 1 . 2]" 1
524 1 18 ILE H 1 59 ILE MG 3.668 . 5.350 4.503 4.383 4.684 . 0 0 "[ . 1 . 2]" 1
525 1 48 THR H 1 50 LEU MD1 3.579 . 5.180 4.632 4.493 4.825 . 0 0 "[ . 1 . 2]" 1
526 1 15 ILE H 1 44 PHE HB3 3.652 . 5.319 4.738 4.559 5.014 . 0 0 "[ . 1 . 2]" 1
527 1 63 ASP H 1 64 GLY HA2 3.729 . 5.468 4.760 4.600 4.917 . 0 0 "[ . 1 . 2]" 1
528 1 18 ILE MD 1 58 THR H 3.683 . 5.379 4.262 3.903 4.608 . 0 0 "[ . 1 . 2]" 1
529 1 53 GLY H 1 55 GLY H 4.009 . 6.018 4.526 3.948 6.093 0.075 9 0 "[ . 1 . 2]" 1
530 1 27 VAL HA 1 49 VAL H 3.869 . 5.740 4.506 4.452 4.641 . 0 0 "[ . 1 . 2]" 1
531 1 16 GLY H 1 59 ILE MG 3.721 . 5.452 4.315 4.204 4.390 . 0 0 "[ . 1 . 2]" 1
532 1 79 ASP H 1 80 GLU HB2 3.851 . 5.705 4.686 4.500 4.946 . 0 0 "[ . 1 . 2]" 1
533 1 17 PHE H 1 61 PHE H 4.100 . 6.201 4.567 4.461 4.685 . 0 0 "[ . 1 . 2]" 1
534 1 42 PRO HG2 1 43 ILE H 3.836 . 5.675 4.832 4.573 5.089 . 0 0 "[ . 1 . 2]" 1
535 1 81 ILE MG 1 83 ASN H 3.816 . 5.636 4.557 4.372 4.719 . 0 0 "[ . 1 . 2]" 1
536 1 30 ILE MG 1 32 GLY H 3.938 . 5.877 5.056 4.972 5.191 . 0 0 "[ . 1 . 2]" 1
537 1 31 ASN H 1 32 GLY HA2 4.155 . 6.313 4.743 4.493 4.960 . 0 0 "[ . 1 . 2]" 1
538 1 46 GLY H 1 76 GLU HG3 3.701 . 5.413 4.754 4.424 5.025 . 0 0 "[ . 1 . 2]" 1
539 1 78 THR HA 1 81 ILE H 3.785 . 5.576 4.564 4.495 4.709 . 0 0 "[ . 1 . 2]" 1
540 1 45 PHE H 1 46 GLY H 4.097 . 6.196 4.420 4.373 4.526 . 0 0 "[ . 1 . 2]" 1
541 1 84 THR MG 1 86 ASP H 4.239 . 6.486 4.844 3.929 6.418 . 0 0 "[ . 1 . 2]" 1
542 1 25 VAL MG1 1 26 THR H 3.078 . 4.262 3.881 3.840 3.935 . 0 0 "[ . 1 . 2]" 1
543 1 21 LEU H 1 22 ASP QB 4.377 . 6.772 4.481 4.151 5.041 . 0 0 "[ . 1 . 2]" 1
544 1 61 PHE QD 1 63 ASP H 4.066 . 6.132 4.526 4.430 4.665 . 0 0 "[ . 1 . 2]" 1
545 1 17 PHE H 1 60 ALA HA 3.998 . 5.996 4.553 4.465 4.631 . 0 0 "[ . 1 . 2]" 1
546 1 57 VAL H 1 69 ILE HA 3.647 . 5.309 4.491 4.224 4.594 . 0 0 "[ . 1 . 2]" 1
547 1 26 THR H 1 50 LEU HA 3.870 . 5.742 4.705 4.581 4.796 . 0 0 "[ . 1 . 2]" 1
548 1 15 ILE HB 1 62 VAL H 4.020 . 6.040 4.415 4.299 4.506 . 0 0 "[ . 1 . 2]" 1
549 1 77 MET HA 1 81 ILE H 3.611 . 5.241 4.803 4.608 5.016 . 0 0 "[ . 1 . 2]" 1
550 1 17 PHE HB2 1 60 ALA H 3.881 . 5.764 4.467 4.381 4.553 . 0 0 "[ . 1 . 2]" 1
551 1 21 LEU H 1 57 VAL HA 3.730 . 5.469 4.462 4.148 4.625 . 0 0 "[ . 1 . 2]" 1
552 1 18 ILE MD 1 38 LYS H 3.762 . 5.531 4.960 4.373 5.548 0.017 6 0 "[ . 1 . 2]" 1
553 1 78 THR H 1 81 ILE HA 4.135 . 6.272 4.627 4.513 4.789 . 0 0 "[ . 1 . 2]" 1
554 1 77 MET HG3 1 78 THR H 4.055 . 6.110 5.819 5.767 5.877 . 0 0 "[ . 1 . 2]" 1
555 1 77 MET HG2 1 78 THR H 4.034 . 6.068 5.317 4.934 5.443 . 0 0 "[ . 1 . 2]" 1
556 1 79 ASP H 1 82 TYR H 4.318 . 6.649 4.562 4.432 4.712 . 0 0 "[ . 1 . 2]" 1
557 1 28 GLN HA 1 33 GLN H 3.800 . 5.605 4.262 3.867 4.547 . 0 0 "[ . 1 . 2]" 1
558 1 27 VAL H 1 37 LEU HB2 3.602 . 5.224 5.185 4.974 5.295 0.071 8 0 "[ . 1 . 2]" 1
559 1 47 GLU HA 1 77 MET H 3.658 . 5.330 4.598 4.534 4.694 . 0 0 "[ . 1 . 2]" 1
560 1 61 PHE QD 1 65 THR H 3.943 . 5.886 4.552 4.276 4.769 . 0 0 "[ . 1 . 2]" 1
561 1 35 ARG H 1 35 ARG HE 4.147 . 6.296 5.309 4.230 6.255 . 0 0 "[ . 1 . 2]" 1
562 1 59 ILE HA 1 67 VAL H 3.929 . 5.859 4.665 4.582 4.795 . 0 0 "[ . 1 . 2]" 1
563 1 15 ILE MD 1 82 TYR H 4.130 . 6.263 4.470 4.340 4.592 . 0 0 "[ . 1 . 2]" 1
564 1 58 THR HA 1 68 VAL H 3.852 . 5.707 4.703 4.558 4.813 . 0 0 "[ . 1 . 2]" 1
565 1 66 ASP HA 1 68 VAL H 4.407 . 6.835 6.409 6.286 6.570 . 0 0 "[ . 1 . 2]" 1
566 1 25 VAL H 1 37 LEU HB2 3.744 . 5.496 5.249 5.140 5.451 . 0 0 "[ . 1 . 2]" 1
567 1 27 VAL H 1 36 VAL H 4.041 . 6.082 4.894 4.749 5.053 . 0 0 "[ . 1 . 2]" 1
568 1 18 ILE HB 1 20 LYS H 4.104 . 6.210 4.931 4.715 5.076 . 0 0 "[ . 1 . 2]" 1
569 1 20 LYS H 1 57 VAL HB 4.506 . 7.044 6.572 6.157 6.693 . 0 0 "[ . 1 . 2]" 1
570 1 22 ASP H 1 57 VAL HB 3.647 . 5.310 5.476 5.385 5.560 0.250 8 0 "[ . 1 . 2]" 1
571 1 14 ALA HA 1 44 PHE H 4.195 . 6.395 4.497 4.407 4.567 . 0 0 "[ . 1 . 2]" 1
572 1 21 LEU H 1 58 THR HB 4.108 . 6.217 5.180 5.009 5.434 . 0 0 "[ . 1 . 2]" 1
573 1 21 LEU H 1 39 LEU HA 4.345 . 6.705 5.536 5.312 5.793 . 0 0 "[ . 1 . 2]" 1
574 1 29 SER H 1 31 ASN QD 4.096 . 6.194 5.592 4.682 6.002 . 0 0 "[ . 1 . 2]" 1
575 1 29 SER H 1 32 GLY HA2 4.095 . 6.191 4.497 4.302 4.802 . 0 0 "[ . 1 . 2]" 1
576 1 30 ILE H 1 47 GLU HG2 3.141 . 4.374 3.091 2.700 3.319 . 0 0 "[ . 1 . 2]" 1
577 1 30 ILE H 1 47 GLU H 4.270 . 6.549 5.205 4.951 5.448 . 0 0 "[ . 1 . 2]" 1
578 1 30 ILE H 1 32 GLY H 3.784 . 5.574 4.039 3.892 4.205 . 0 0 "[ . 1 . 2]" 1
579 1 31 ASN H 1 32 GLY H 2.772 . 3.732 2.398 2.197 2.587 . 0 0 "[ . 1 . 2]" 1
580 1 31 ASN H 1 31 ASN QD 4.373 . 6.006 2.898 2.270 3.517 . 0 0 "[ . 1 . 2]" 1
581 1 30 ILE HG12 1 32 GLY H 4.468 . 6.963 5.101 4.916 5.291 . 0 0 "[ . 1 . 2]" 1
582 1 30 ILE HG13 1 32 GLY H 4.390 . 6.799 4.858 4.682 5.127 . 0 0 "[ . 1 . 2]" 1
583 1 31 ASN HB3 1 32 GLY H 3.745 . 5.498 4.233 3.915 4.434 . 0 0 "[ . 1 . 2]" 1
584 1 31 ASN QD 1 32 GLY H 3.634 . 5.284 4.542 3.650 5.022 . 0 0 "[ . 1 . 2]" 1
585 1 31 ASN H 1 33 GLN H 2.969 . 4.071 3.424 2.877 3.689 . 0 0 "[ . 1 . 2]" 1
586 1 30 ILE H 1 33 GLN H 4.052 . 6.104 5.190 4.987 5.347 . 0 0 "[ . 1 . 2]" 1
587 1 31 ASN QD 1 33 GLN H 3.969 . 5.938 4.176 3.023 4.424 . 0 0 "[ . 1 . 2]" 1
588 1 33 GLN H 1 34 GLU HA 4.332 . 6.678 5.280 5.091 5.436 . 0 0 "[ . 1 . 2]" 1
589 1 31 ASN HB3 1 33 GLN H 4.067 . 6.134 4.187 3.653 5.068 . 0 0 "[ . 1 . 2]" 1
590 1 26 THR MG 1 34 GLU H 4.456 . 6.938 5.663 5.437 5.763 . 0 0 "[ . 1 . 2]" 1
591 1 33 GLN HE22 1 34 GLU H 4.261 . 6.531 5.120 2.981 6.482 . 0 0 "[ . 1 . 2]" 1
592 1 35 ARG H 1 50 LEU MD1 4.058 . 6.117 4.595 4.202 4.823 . 0 0 "[ . 1 . 2]" 1
593 1 51 THR H 1 72 ASP H 4.046 . 6.092 4.671 4.452 4.900 . 0 0 "[ . 1 . 2]" 1
594 1 51 THR H 1 75 VAL H 3.845 . 5.693 5.039 4.884 5.223 . 0 0 "[ . 1 . 2]" 1
595 1 50 LEU HA 1 52 GLY H 4.063 . 6.127 6.180 6.098 6.227 0.100 18 0 "[ . 1 . 2]" 1
596 1 50 LEU HB3 1 52 GLY H 4.102 . 6.205 6.123 5.797 6.235 0.030 3 0 "[ . 1 . 2]" 1
597 1 15 ILE MD 1 62 VAL H 4.157 . 6.317 5.535 5.435 5.618 . 0 0 "[ . 1 . 2]" 1
598 1 59 ILE MG 1 62 VAL H 4.249 . 6.506 5.062 4.983 5.210 . 0 0 "[ . 1 . 2]" 1
599 1 63 ASP H 1 65 THR MG 4.009 . 6.018 5.392 5.102 5.660 . 0 0 "[ . 1 . 2]" 1
600 1 61 PHE H 1 63 ASP H 3.890 . 5.781 4.903 4.681 5.206 . 0 0 "[ . 1 . 2]" 1
601 1 61 PHE H 1 64 GLY H 3.768 . 5.542 4.605 4.444 4.875 . 0 0 "[ . 1 . 2]" 1
602 1 28 GLN HE22 1 32 GLY HA2 4.505 . 7.041 5.434 4.082 6.040 . 0 0 "[ . 1 . 2]" 1
603 1 30 ILE HG12 1 31 ASN QD 4.883 . 7.864 3.953 3.077 4.643 . 0 0 "[ . 1 . 2]" 1
604 1 13 ASN HA 1 13 ASN HD21 4.283 . 6.576 4.576 3.526 5.375 . 0 0 "[ . 1 . 2]" 1
605 1 77 MET ME 1 77 MET HG3 2.493 . 3.270 2.560 2.405 3.069 . 0 0 "[ . 1 . 2]" 1
606 1 15 ILE MD 1 45 PHE HB2 2.709 . 3.626 2.805 2.647 3.007 . 0 0 "[ . 1 . 2]" 1
607 1 15 ILE MD 1 77 MET HG3 2.760 . 3.712 3.276 2.829 3.510 . 0 0 "[ . 1 . 2]" 1
608 1 15 ILE MD 1 77 MET HB3 2.484 . 3.255 2.202 2.025 2.322 . 0 0 "[ . 1 . 2]" 1
609 1 15 ILE MD 1 82 TYR HB2 2.692 . 3.598 2.340 2.176 2.513 . 0 0 "[ . 1 . 2]" 1
610 1 15 ILE HB 1 15 ILE MD 2.082 . 2.624 2.445 2.429 2.461 . 0 0 "[ . 1 . 2]" 1
611 1 15 ILE H 1 15 ILE MD 2.753 . 3.700 3.664 3.622 3.718 0.018 19 0 "[ . 1 . 2]" 1
612 1 15 ILE MD 1 61 PHE QD 2.465 . 3.225 3.229 3.170 3.294 0.069 19 0 "[ . 1 . 2]" 1
613 1 15 ILE MD 1 61 PHE QE 2.349 . 3.039 2.328 2.103 2.681 . 0 0 "[ . 1 . 2]" 1
614 1 18 ILE MG 1 39 LEU HA 2.207 . 2.816 2.218 2.150 2.292 . 0 0 "[ . 1 . 2]" 1
615 1 18 ILE HB 1 18 ILE MG 2.082 . 2.624 2.128 2.124 2.132 . 0 0 "[ . 1 . 2]" 1
616 1 18 ILE MG 1 19 THR H 2.157 . 2.739 2.780 2.741 2.814 0.075 8 0 "[ . 1 . 2]" 1
617 1 18 ILE MG 1 21 LEU H 2.915 . 3.977 4.045 3.965 4.121 0.144 3 0 "[ . 1 . 2]" 1
618 1 18 ILE MG 1 20 LYS H 2.335 . 3.016 2.707 2.523 2.826 . 0 0 "[ . 1 . 2]" 1
619 1 18 ILE HA 1 19 THR MG 2.690 . 3.594 3.727 3.694 3.759 0.165 20 0 "[ . 1 . 2]" 1
620 1 17 PHE HB2 1 19 THR MG 2.813 . 3.802 3.551 3.389 3.718 . 0 0 "[ . 1 . 2]" 1
621 1 70 GLY H 1 70 GLY HA2 2.481 . 3.251 2.890 2.868 2.918 . 0 0 "[ . 1 . 2]" 1
622 1 57 VAL HA 1 57 VAL HB 2.243 . 2.872 2.991 2.983 3.001 0.129 4 0 "[ . 1 . 2]" 1
623 1 21 LEU HB2 1 57 VAL HA 2.833 . 3.836 3.624 3.543 3.733 . 0 0 "[ . 1 . 2]" 1
624 1 57 VAL HA 1 57 VAL MG1 2.241 . 2.869 2.294 2.262 2.324 . 0 0 "[ . 1 . 2]" 1
625 1 57 VAL HA 1 57 VAL MG2 2.449 . 3.199 2.536 2.505 2.559 . 0 0 "[ . 1 . 2]" 1
626 1 57 VAL HA 1 58 THR H 1.980 . 2.470 2.160 2.103 2.221 . 0 0 "[ . 1 . 2]" 1
627 1 20 LYS QB 1 20 LYS HG3 1.954 . 2.431 2.330 2.149 2.417 . 0 0 "[ . 1 . 2]" 1
628 1 20 LYS HA 1 20 LYS QB 2.403 . 3.125 2.404 2.315 2.537 . 0 0 "[ . 1 . 2]" 1
629 1 20 LYS QB 1 58 THR H 2.657 . 3.539 2.825 2.291 3.025 . 0 0 "[ . 1 . 2]" 1
630 1 20 LYS H 1 20 LYS QB 2.633 . 3.500 2.670 2.588 2.717 . 0 0 "[ . 1 . 2]" 1
631 1 15 ILE HG13 1 43 ILE HB 2.737 . 3.674 3.381 3.224 3.589 . 0 0 "[ . 1 . 2]" 1
632 1 43 ILE HB 1 44 PHE H 2.930 . 4.003 4.098 4.064 4.130 0.127 17 0 "[ . 1 . 2]" 1
633 1 76 GLU HA 1 76 GLU HG2 2.674 . 3.568 3.146 3.014 3.695 0.127 14 0 "[ . 1 . 2]" 1
634 1 76 GLU HA 1 76 GLU HB2 2.242 . 2.870 2.465 2.239 2.519 . 0 0 "[ . 1 . 2]" 1
635 1 76 GLU HA 1 77 MET H 2.165 . 2.751 2.130 2.115 2.147 . 0 0 "[ . 1 . 2]" 1
636 1 76 GLU H 1 76 GLU HA 2.612 . 3.465 2.921 2.906 2.942 . 0 0 "[ . 1 . 2]" 1
637 1 48 THR HA 1 76 GLU HA 2.366 . 3.066 1.877 1.745 2.034 . 0 0 "[ . 1 . 2]" 1
638 1 18 ILE MG 1 21 LEU HB2 2.242 . 2.870 2.010 1.920 2.066 . 0 0 "[ . 1 . 2]" 1
639 1 30 ILE HA 1 30 ILE HB 2.088 . 2.633 2.508 2.466 2.571 . 0 0 "[ . 1 . 2]" 1
640 1 30 ILE HA 1 30 ILE MG 2.196 . 2.799 2.249 2.198 2.278 . 0 0 "[ . 1 . 2]" 1
641 1 30 ILE HA 1 30 ILE HG12 2.768 . 3.726 3.639 3.570 3.690 . 0 0 "[ . 1 . 2]" 1
642 1 30 ILE HA 1 30 ILE HG13 2.798 . 3.776 3.785 3.757 3.811 0.035 12 0 "[ . 1 . 2]" 1
643 1 30 ILE H 1 30 ILE HA 2.597 . 3.440 2.805 2.774 2.840 . 0 0 "[ . 1 . 2]" 1
644 1 79 ASP HA 1 79 ASP HB2 2.154 . 2.734 2.444 2.362 2.502 . 0 0 "[ . 1 . 2]" 1
645 1 79 ASP HA 1 82 TYR H 2.905 . 3.960 3.113 2.875 3.416 . 0 0 "[ . 1 . 2]" 1
646 1 79 ASP HA 1 81 ILE H 3.069 . 4.246 3.849 3.596 4.075 . 0 0 "[ . 1 . 2]" 1
647 1 28 GLN HB2 1 28 GLN HG2 2.465 . 3.225 3.001 2.997 3.005 . 0 0 "[ . 1 . 2]" 1
648 1 26 THR MG 1 36 VAL HA 2.287 . 2.941 2.552 2.312 2.767 . 0 0 "[ . 1 . 2]" 1
649 1 26 THR MG 1 34 GLU HG2 2.758 . 3.709 2.239 2.086 2.310 . 0 0 "[ . 1 . 2]" 1
650 1 26 THR MG 1 34 GLU HG3 2.505 . 3.290 2.724 2.248 3.737 0.447 16 0 "[ . 1 . 2]" 1
651 1 26 THR MG 1 35 ARG H 2.847 . 3.860 3.690 3.426 3.881 0.021 19 0 "[ . 1 . 2]" 1
652 1 26 THR MG 1 27 VAL H 2.378 . 3.085 2.869 2.709 2.998 . 0 0 "[ . 1 . 2]" 1
653 1 26 THR MG 1 34 GLU HA 3.026 . 4.171 4.169 4.015 4.203 0.032 9 0 "[ . 1 . 2]" 1
654 1 75 VAL HA 1 75 VAL MG2 2.308 . 2.974 2.465 2.297 3.172 0.198 19 0 "[ . 1 . 2]" 1
655 1 75 VAL HB 1 75 VAL MG1 1.889 . 2.335 2.123 2.116 2.126 . 0 0 "[ . 1 . 2]" 1
656 1 75 VAL MG2 1 76 GLU H 2.415 . 3.144 2.588 2.239 4.014 0.870 3 3 "[ + . - . *2]" 1
657 1 15 ILE HB 1 15 ILE HG12 2.404 . 3.126 3.024 3.022 3.027 . 0 0 "[ . 1 . 2]" 1
658 1 15 ILE H 1 15 ILE HG12 2.703 . 3.616 2.032 1.961 2.114 . 0 0 "[ . 1 . 2]" 1
659 1 15 ILE HG12 1 16 GLY H 2.705 . 3.620 3.032 2.973 3.099 . 0 0 "[ . 1 . 2]" 1
660 1 55 GLY HA3 1 71 GLY HA2 2.520 . 3.314 2.816 2.547 3.184 . 0 0 "[ . 1 . 2]" 1
661 1 25 VAL HA 1 25 VAL MG2 3.047 . 4.208 3.171 3.168 3.178 . 0 0 "[ . 1 . 2]" 1
662 1 25 VAL MG2 1 37 LEU HB2 2.477 . 3.244 1.772 1.728 1.812 . 0 0 "[ . 1 . 2]" 1
663 1 49 VAL HA 1 50 LEU MD1 3.003 . 4.131 3.243 3.033 3.733 . 0 0 "[ . 1 . 2]" 1
664 1 28 GLN HG3 1 50 LEU MD1 2.400 . 3.120 2.362 2.099 2.647 . 0 0 "[ . 1 . 2]" 1
665 1 28 GLN HB2 1 50 LEU MD1 2.117 . 2.677 2.185 2.019 2.341 . 0 0 "[ . 1 . 2]" 1
666 1 28 GLN H 1 50 LEU MD1 2.691 . 3.596 2.602 2.415 2.922 . 0 0 "[ . 1 . 2]" 1
667 1 15 ILE HG13 1 16 GLY H 2.875 . 3.908 2.926 2.847 3.027 . 0 0 "[ . 1 . 2]" 1
668 1 28 GLN HA 1 50 LEU MD1 2.833 . 3.836 3.623 3.403 3.781 . 0 0 "[ . 1 . 2]" 1
669 1 47 GLU HA 1 47 GLU HG3 2.533 . 3.335 3.231 3.157 3.307 . 0 0 "[ . 1 . 2]" 1
670 1 47 GLU HA 1 47 GLU HB2 2.523 . 3.319 3.016 3.012 3.020 . 0 0 "[ . 1 . 2]" 1
671 1 47 GLU HA 1 47 GLU HG2 2.326 . 3.002 2.607 2.526 2.725 . 0 0 "[ . 1 . 2]" 1
672 1 47 GLU HA 1 47 GLU HB3 2.311 . 2.978 2.385 2.353 2.412 . 0 0 "[ . 1 . 2]" 1
673 1 20 LYS HA 1 20 LYS HG3 2.370 . 3.072 2.764 2.324 3.537 0.465 4 0 "[ . 1 . 2]" 1
674 1 20 LYS HA 1 39 LEU MD1 2.176 . 2.768 2.025 1.940 2.223 . 0 0 "[ . 1 . 2]" 1
675 1 47 GLU H 1 47 GLU HA 2.614 . 3.468 2.907 2.870 2.925 . 0 0 "[ . 1 . 2]" 1
676 1 18 ILE MD 1 57 VAL MG1 2.030 . 2.545 1.945 1.850 2.018 . 0 0 "[ . 1 . 2]" 1
677 1 51 THR MG 1 73 SER QB 2.695 . 3.603 3.534 2.814 3.652 0.049 5 0 "[ . 1 . 2]" 1
678 1 57 VAL HB 1 57 VAL MG1 2.171 . 2.760 2.119 2.115 2.123 . 0 0 "[ . 1 . 2]" 1
679 1 25 VAL HB 1 51 THR MG 2.541 . 3.348 2.700 2.451 2.982 . 0 0 "[ . 1 . 2]" 1
680 1 21 LEU HB2 1 57 VAL MG1 2.279 . 2.928 2.553 2.375 2.847 . 0 0 "[ . 1 . 2]" 1
681 1 57 VAL MG1 1 59 ILE HG13 2.230 . 2.852 2.354 2.132 2.661 . 0 0 "[ . 1 . 2]" 1
682 1 51 THR H 1 51 THR MG 2.338 . 3.021 2.604 2.371 2.802 . 0 0 "[ . 1 . 2]" 1
683 1 51 THR HG1 1 51 THR MG 2.439 . 3.182 2.231 2.038 2.329 . 0 0 "[ . 1 . 2]" 1
684 1 57 VAL MG1 1 58 THR H 2.248 . 2.880 2.529 2.252 2.888 0.008 5 0 "[ . 1 . 2]" 1
685 1 30 ILE MG 1 46 GLY HA2 2.821 . 3.815 3.247 3.040 3.431 . 0 0 "[ . 1 . 2]" 1
686 1 46 GLY H 1 46 GLY HA2 2.344 . 3.031 2.453 2.410 2.503 . 0 0 "[ . 1 . 2]" 1
687 1 14 ALA HA 1 14 ALA MB 2.062 . 2.593 2.125 2.119 2.132 . 0 0 "[ . 1 . 2]" 1
688 1 14 ALA H 1 14 ALA HA 2.620 . 3.478 2.872 2.851 2.896 . 0 0 "[ . 1 . 2]" 1
689 1 14 ALA HA 1 15 ILE H 2.096 . 2.645 2.090 2.059 2.107 . 0 0 "[ . 1 . 2]" 1
690 1 14 ALA HA 1 16 GLY H 2.734 . 3.668 3.561 3.504 3.626 . 0 0 "[ . 1 . 2]" 1
691 1 51 THR HB 1 55 GLY HA2 2.816 . 3.807 3.673 3.445 3.803 . 0 0 "[ . 1 . 2]" 1
692 1 51 THR HB 1 51 THR MG 2.102 . 2.654 2.132 2.127 2.135 . 0 0 "[ . 1 . 2]" 1
693 1 25 VAL MG1 1 51 THR HB 2.784 . 3.753 3.063 2.747 3.385 . 0 0 "[ . 1 . 2]" 1
694 1 43 ILE HG13 1 77 MET ME 2.827 . 3.826 3.338 3.037 3.846 0.020 9 0 "[ . 1 . 2]" 1
695 1 77 MET ME 1 81 ILE MD 1.740 . 2.118 2.228 2.169 2.258 0.140 10 0 "[ . 1 . 2]" 1
696 1 59 ILE MD 1 77 MET ME 1.896 . 2.345 1.837 1.760 2.025 . 0 0 "[ . 1 . 2]" 1
697 1 59 ILE MG 1 77 MET ME 2.947 . 4.033 2.664 2.331 3.247 . 0 0 "[ . 1 . 2]" 1
698 1 77 MET ME 1 77 MET HG2 2.689 2.090 3.288 3.151 2.251 3.381 0.093 18 0 "[ . 1 . 2]" 1
699 1 61 PHE QE 1 77 MET ME 2.488 . 3.262 2.755 2.304 3.400 0.138 14 0 "[ . 1 . 2]" 1
700 1 65 THR HA 1 65 THR MG 2.211 . 2.822 2.237 2.198 2.288 . 0 0 "[ . 1 . 2]" 1
701 1 25 VAL HA 1 51 THR MG 2.898 . 3.947 3.052 2.773 3.352 . 0 0 "[ . 1 . 2]" 1
702 1 24 SER H 1 24 SER HB2 2.594 . 3.435 2.663 2.455 2.906 . 0 0 "[ . 1 . 2]" 1
703 1 27 VAL MG1 1 35 ARG HD3 2.891 . 3.936 3.257 2.353 4.035 0.099 12 0 "[ . 1 . 2]" 1
704 1 35 ARG HD3 1 35 ARG HE 2.318 . 2.990 2.782 2.369 2.946 . 0 0 "[ . 1 . 2]" 1
705 1 28 GLN HB2 1 28 GLN HG3 2.460 . 3.216 2.435 2.378 2.479 . 0 0 "[ . 1 . 2]" 1
706 1 28 GLN HE22 1 28 GLN HG3 2.833 . 3.836 2.266 2.185 2.895 . 0 0 "[ . 1 . 2]" 1
707 1 25 VAL MG2 1 37 LEU HB3 2.237 . 2.862 2.920 2.875 2.947 0.085 8 0 "[ . 1 . 2]" 1
708 1 43 ILE MG 1 59 ILE MG 2.447 . 3.195 2.563 2.372 2.827 . 0 0 "[ . 1 . 2]" 1
709 1 43 ILE HA 1 43 ILE MG 2.560 . 3.379 2.483 2.453 2.504 . 0 0 "[ . 1 . 2]" 1
710 1 43 ILE MG 1 77 MET HB3 2.874 . 3.906 3.028 2.888 3.303 . 0 0 "[ . 1 . 2]" 1
711 1 43 ILE MG 1 47 GLU HB2 2.855 . 3.874 3.278 2.992 3.512 . 0 0 "[ . 1 . 2]" 1
712 1 43 ILE MG 1 77 MET ME 2.619 . 3.477 2.310 2.026 3.035 . 0 0 "[ . 1 . 2]" 1
713 1 43 ILE MG 1 77 MET HB2 2.740 . 3.678 3.441 3.363 3.568 . 0 0 "[ . 1 . 2]" 1
714 1 43 ILE HB 1 43 ILE MG 2.000 . 2.500 2.116 2.111 2.119 . 0 0 "[ . 1 . 2]" 1
715 1 43 ILE MG 1 44 PHE H 2.553 . 3.368 2.447 2.364 2.505 . 0 0 "[ . 1 . 2]" 1
716 1 43 ILE H 1 43 ILE MG 2.693 . 3.600 3.729 3.713 3.742 0.142 6 0 "[ . 1 . 2]" 1
717 1 16 GLY H 1 43 ILE MG 2.817 . 3.809 3.783 3.654 3.837 0.028 10 0 "[ . 1 . 2]" 1
718 1 49 VAL HB 1 49 VAL MG1 1.914 . 2.372 2.132 2.129 2.134 . 0 0 "[ . 1 . 2]" 1
719 1 75 VAL HA 1 75 VAL HB 2.416 . 3.146 2.486 2.445 2.606 . 0 0 "[ . 1 . 2]" 1
720 1 15 ILE HA 1 15 ILE HB 2.165 . 2.751 2.417 2.393 2.438 . 0 0 "[ . 1 . 2]" 1
721 1 15 ILE HA 1 62 VAL MG1 2.270 . 2.914 2.540 2.372 2.706 . 0 0 "[ . 1 . 2]" 1
722 1 75 VAL H 1 75 VAL HA 2.683 . 3.583 2.918 2.903 2.934 . 0 0 "[ . 1 . 2]" 1
723 1 75 VAL HA 1 76 GLU H 1.936 . 2.404 2.229 2.184 2.280 . 0 0 "[ . 1 . 2]" 1
724 1 15 ILE H 1 15 ILE HA 2.752 . 3.699 2.919 2.902 2.940 . 0 0 "[ . 1 . 2]" 1
725 1 15 ILE HA 1 16 GLY H 2.893 . 3.939 3.384 3.355 3.408 . 0 0 "[ . 1 . 2]" 1
726 1 39 LEU HB2 1 39 LEU MD1 2.060 . 2.591 2.178 2.158 2.210 . 0 0 "[ . 1 . 2]" 1
727 1 81 ILE HA 1 81 ILE HB 2.327 . 3.004 2.972 2.959 2.993 . 0 0 "[ . 1 . 2]" 1
728 1 81 ILE HA 1 81 ILE HG12 2.723 . 3.650 2.402 2.327 2.462 . 0 0 "[ . 1 . 2]" 1
729 1 81 ILE HA 1 81 ILE MG 2.290 . 2.945 2.651 2.557 2.713 . 0 0 "[ . 1 . 2]" 1
730 1 81 ILE HA 1 81 ILE MD 2.305 . 2.969 2.344 2.189 2.618 . 0 0 "[ . 1 . 2]" 1
731 1 81 ILE HA 1 82 TYR H 2.576 . 3.406 3.524 3.513 3.533 0.127 4 0 "[ . 1 . 2]" 1
732 1 81 ILE H 1 81 ILE HA 2.442 . 3.188 2.873 2.835 2.913 . 0 0 "[ . 1 . 2]" 1
733 1 16 GLY HA3 1 17 PHE H 2.428 . 3.165 2.564 2.530 2.617 . 0 0 "[ . 1 . 2]" 1
734 1 16 GLY H 1 16 GLY HA3 2.498 . 3.278 2.748 2.726 2.763 . 0 0 "[ . 1 . 2]" 1
735 1 51 THR HA 1 51 THR MG 2.239 . 2.866 2.374 2.331 2.466 . 0 0 "[ . 1 . 2]" 1
736 1 25 VAL MG1 1 51 THR HA 2.392 . 3.107 2.988 2.678 3.135 0.028 18 0 "[ . 1 . 2]" 1
737 1 51 THR H 1 51 THR HA 2.711 . 3.629 2.944 2.934 2.952 . 0 0 "[ . 1 . 2]" 1
738 1 40 GLY H 1 40 GLY HA2 2.196 . 2.799 2.314 2.300 2.360 . 0 0 "[ . 1 . 2]" 1
739 1 25 VAL HB 1 37 LEU HB2 2.836 . 3.841 3.466 3.175 3.737 . 0 0 "[ . 1 . 2]" 1
740 1 59 ILE HA 1 59 ILE MD 2.808 . 3.794 3.832 3.820 3.846 0.052 5 0 "[ . 1 . 2]" 1
741 1 59 ILE MD 1 69 ILE HG12 2.549 . 3.361 3.385 3.322 3.417 0.056 8 0 "[ . 1 . 2]" 1
742 1 59 ILE MD 1 59 ILE HG13 1.963 . 2.445 2.120 2.116 2.123 . 0 0 "[ . 1 . 2]" 1
743 1 59 ILE HB 1 59 ILE MD 2.033 . 2.550 2.309 2.285 2.340 . 0 0 "[ . 1 . 2]" 1
744 1 59 ILE MD 1 67 VAL QG 2.017 . 2.526 2.499 2.374 2.578 0.052 12 0 "[ . 1 . 2]" 1
745 1 59 ILE H 1 59 ILE MD 2.826 . 3.824 3.540 3.475 3.610 . 0 0 "[ . 1 . 2]" 1
746 1 67 VAL HA 1 67 VAL HB 2.254 . 2.889 2.654 2.488 2.865 . 0 0 "[ . 1 . 2]" 1
747 1 67 VAL HA 1 67 VAL QG 2.265 . 2.906 2.162 2.089 2.228 . 0 0 "[ . 1 . 2]" 1
748 1 67 VAL H 1 67 VAL HA 2.561 . 3.381 2.929 2.869 2.942 . 0 0 "[ . 1 . 2]" 1
749 1 67 VAL HA 1 68 VAL H 1.956 . 2.434 2.334 2.213 2.437 0.003 17 0 "[ . 1 . 2]" 1
750 1 81 ILE MD 1 81 ILE HG12 2.277 . 2.925 2.117 2.113 2.120 . 0 0 "[ . 1 . 2]" 1
751 1 81 ILE MD 1 81 ILE HG13 2.213 . 2.825 2.123 2.120 2.126 . 0 0 "[ . 1 . 2]" 1
752 1 38 LYS HB3 1 38 LYS HG3 2.242 . 2.870 2.994 2.958 3.014 0.144 2 0 "[ . 1 . 2]" 1
753 1 38 LYS HB3 1 38 LYS QE 3.256 2.306 4.206 3.910 3.206 4.230 0.024 2 0 "[ . 1 . 2]" 1
754 1 43 ILE MG 1 77 MET HG3 2.437 . 3.179 1.871 1.811 1.923 . 0 0 "[ . 1 . 2]" 1
755 1 77 MET H 1 77 MET HG3 2.845 . 3.857 3.666 3.611 3.708 . 0 0 "[ . 1 . 2]" 1
756 1 59 ILE HG13 1 59 ILE MG 2.638 . 3.508 3.184 3.177 3.192 . 0 0 "[ . 1 . 2]" 1
757 1 81 ILE HA 1 81 ILE HG13 2.644 . 3.518 3.590 3.569 3.621 0.103 19 0 "[ . 1 . 2]" 1
758 1 81 ILE HB 1 81 ILE HG13 2.415 . 3.144 2.302 2.260 2.333 . 0 0 "[ . 1 . 2]" 1
759 1 59 ILE H 1 59 ILE HG13 2.689 . 3.593 2.586 2.517 2.638 . 0 0 "[ . 1 . 2]" 1
760 1 83 ASN HB2 1 83 ASN HD22 2.855 . 3.874 2.494 2.171 3.470 . 0 0 "[ . 1 . 2]" 1
761 1 66 ASP HA 1 66 ASP QB 2.068 . 2.603 2.286 2.181 2.322 . 0 0 "[ . 1 . 2]" 1
762 1 60 ALA MB 1 66 ASP HA 2.988 . 4.104 3.819 3.620 3.909 . 0 0 "[ . 1 . 2]" 1
763 1 61 PHE H 1 66 ASP HA 2.643 . 3.516 2.347 2.061 2.479 . 0 0 "[ . 1 . 2]" 1
764 1 66 ASP HA 1 67 VAL H 2.071 . 2.607 2.296 2.178 2.619 0.012 1 0 "[ . 1 . 2]" 1
765 1 46 GLY HA2 1 78 THR MG 2.701 . 3.613 3.577 3.314 3.662 0.049 14 0 "[ . 1 . 2]" 1
766 1 36 VAL MG1 1 38 LYS QE 2.909 . 3.967 2.630 2.082 3.593 . 0 0 "[ . 1 . 2]" 1
767 1 62 VAL HB 1 62 VAL MG2 1.931 . 2.397 2.107 2.101 2.112 . 0 0 "[ . 1 . 2]" 1
768 1 36 VAL HB 1 36 VAL MG1 1.815 . 2.227 2.128 2.125 2.130 . 0 0 "[ . 1 . 2]" 1
769 1 36 VAL MG1 1 38 LYS HG2 2.261 . 2.900 3.250 2.925 3.706 0.806 17 8 "[ * .* * * *.-+ *2]" 1
770 1 36 VAL H 1 36 VAL MG1 1.908 . 2.363 2.147 2.072 2.335 . 0 0 "[ . 1 . 2]" 1
771 1 17 PHE QE 1 62 VAL MG2 2.302 . 2.964 2.542 2.332 2.741 . 0 0 "[ . 1 . 2]" 1
772 1 78 THR MG 1 79 ASP H 2.740 . 3.678 3.348 3.139 3.490 . 0 0 "[ . 1 . 2]" 1
773 1 77 MET H 1 77 MET HB3 2.797 . 3.775 3.592 3.554 3.615 . 0 0 "[ . 1 . 2]" 1
774 1 47 GLU H 1 77 MET HB3 2.921 . 3.987 4.017 3.574 4.129 0.142 17 0 "[ . 1 . 2]" 1
775 1 31 ASN HA 1 31 ASN HB2 2.488 . 3.262 2.877 2.380 3.031 . 0 0 "[ . 1 . 2]" 1
776 1 31 ASN HA 1 31 ASN HB3 2.493 . 3.270 2.444 2.346 2.528 . 0 0 "[ . 1 . 2]" 1
777 1 74 ILE HB 1 74 ILE HG13 2.420 . 3.152 2.490 2.475 2.503 . 0 0 "[ . 1 . 2]" 1
778 1 44 PHE H 1 44 PHE HA 2.939 . 4.018 2.948 2.940 2.956 . 0 0 "[ . 1 . 2]" 1
779 1 44 PHE H 1 44 PHE HB3 2.825 . 3.823 3.741 3.727 3.755 . 0 0 "[ . 1 . 2]" 1
780 1 50 LEU HB2 1 50 LEU MD2 2.437 . 3.180 2.857 2.795 3.011 . 0 0 "[ . 1 . 2]" 1
781 1 50 LEU HB3 1 50 LEU MD2 2.302 . 2.964 2.130 2.120 2.145 . 0 0 "[ . 1 . 2]" 1
782 1 18 ILE HG12 1 41 ASP QB 2.936 . 4.014 2.986 2.638 3.653 . 0 0 "[ . 1 . 2]" 1
783 1 60 ALA HA 1 66 ASP QB 2.439 . 3.182 2.851 2.358 2.992 . 0 0 "[ . 1 . 2]" 1
784 1 60 ALA HA 1 60 ALA MB 2.091 . 2.638 2.130 2.125 2.134 . 0 0 "[ . 1 . 2]" 1
785 1 60 ALA HA 1 61 PHE H 2.110 . 2.667 2.157 2.135 2.184 . 0 0 "[ . 1 . 2]" 1
786 1 60 ALA HA 1 67 VAL H 2.971 . 4.074 3.454 3.131 3.657 . 0 0 "[ . 1 . 2]" 1
787 1 60 ALA H 1 60 ALA HA 2.722 . 3.648 2.881 2.874 2.894 . 0 0 "[ . 1 . 2]" 1
788 1 60 ALA HA 1 66 ASP HA 2.360 . 3.056 2.222 1.996 2.307 . 0 0 "[ . 1 . 2]" 1
789 1 64 GLY H 1 64 GLY HA2 2.148 . 2.725 2.475 2.394 2.529 . 0 0 "[ . 1 . 2]" 1
790 1 67 VAL HB 1 67 VAL QG 2.167 . 2.754 1.878 1.867 1.889 . 0 0 "[ . 1 . 2]" 1
791 1 67 VAL QG 1 68 VAL H 2.433 . 3.173 2.709 2.225 3.086 . 0 0 "[ . 1 . 2]" 1
792 1 20 LYS HD3 1 20 LYS HE2 2.270 . 2.914 2.492 2.400 3.018 0.104 16 0 "[ . 1 . 2]" 1
793 1 20 LYS HE2 1 20 LYS HG3 2.339 . 3.023 3.157 2.512 3.746 0.723 15 5 "[ . * -** + 2]" 1
794 1 45 PHE HB2 1 45 PHE QD 2.496 . 3.275 2.324 2.294 2.372 . 0 0 "[ . 1 . 2]" 1
795 1 82 TYR HA 1 82 TYR HB3 2.377 . 3.083 3.030 3.023 3.035 . 0 0 "[ . 1 . 2]" 1
796 1 82 TYR HA 1 82 TYR HB2 2.276 . 2.923 2.494 2.460 2.516 . 0 0 "[ . 1 . 2]" 1
797 1 82 TYR H 1 82 TYR HA 2.555 . 3.371 2.932 2.916 2.943 . 0 0 "[ . 1 . 2]" 1
798 1 42 PRO HA 1 42 PRO QB 2.376 . 3.081 2.179 2.166 2.192 . 0 0 "[ . 1 . 2]" 1
799 1 42 PRO HA 1 43 ILE H 2.117 . 2.677 2.143 2.099 2.206 . 0 0 "[ . 1 . 2]" 1
800 1 17 PHE QE 1 42 PRO HA 3.023 . 4.165 3.332 3.135 3.615 . 0 0 "[ . 1 . 2]" 1
801 1 17 PHE QD 1 42 PRO HA 2.659 . 3.543 2.394 2.205 2.553 . 0 0 "[ . 1 . 2]" 1
802 1 17 PHE HA 1 42 PRO HA 2.414 . 3.143 2.490 2.193 2.623 . 0 0 "[ . 1 . 2]" 1
803 1 68 VAL HB 1 68 VAL QG 1.921 . 2.382 1.896 1.893 1.902 . 0 0 "[ . 1 . 2]" 1
804 1 68 VAL QG 1 69 ILE H 2.861 . 3.259 2.494 2.299 2.658 . 0 0 "[ . 1 . 2]" 1
805 1 68 VAL H 1 68 VAL QG 2.287 . 2.941 2.355 2.208 2.889 . 0 0 "[ . 1 . 2]" 1
806 1 58 THR MG 1 60 ALA HA 2.754 . 3.702 3.784 3.700 3.852 0.150 11 0 "[ . 1 . 2]" 1
807 1 38 LYS QD 1 38 LYS HG3 2.183 . 2.779 2.363 2.313 2.438 . 0 0 "[ . 1 . 2]" 1
808 1 60 ALA MB 1 66 ASP QB 2.651 . 3.529 3.434 2.946 3.539 0.010 4 0 "[ . 1 . 2]" 1
809 1 60 ALA MB 1 61 PHE H 2.752 . 3.698 3.416 3.324 3.478 . 0 0 "[ . 1 . 2]" 1
810 1 60 ALA H 1 60 ALA MB 2.173 . 2.763 2.256 2.242 2.276 . 0 0 "[ . 1 . 2]" 1
811 1 17 PHE H 1 60 ALA MB 2.903 . 3.956 3.337 3.196 3.454 . 0 0 "[ . 1 . 2]" 1
812 1 14 ALA MB 1 42 PRO QB 2.499 . 2.717 2.268 2.096 2.397 . 0 0 "[ . 1 . 2]" 1
813 1 14 ALA H 1 14 ALA MB 2.146 . 2.722 2.260 2.241 2.305 . 0 0 "[ . 1 . 2]" 1
814 1 14 ALA MB 1 15 ILE H 2.523 . 3.319 3.250 3.150 3.319 . 0 0 "[ . 1 . 2]" 1
815 1 14 ALA MB 1 43 ILE H 2.721 . 3.646 3.594 3.391 3.718 0.072 10 0 "[ . 1 . 2]" 1
816 1 48 THR MG 1 49 VAL H 2.358 . 3.053 3.110 3.087 3.132 0.079 8 0 "[ . 1 . 2]" 1
817 1 48 THR MG 1 75 VAL H 2.690 . 3.595 3.346 3.076 3.544 . 0 0 "[ . 1 . 2]" 1
818 1 20 LYS HA 1 21 LEU H 1.920 . 2.381 2.248 2.197 2.277 . 0 0 "[ . 1 . 2]" 1
819 1 69 ILE MG 1 73 SER QB 2.197 . 2.801 2.587 2.038 2.773 . 0 0 "[ . 1 . 2]" 1
820 1 73 SER H 1 73 SER QB 2.414 . 3.142 2.496 2.108 2.628 . 0 0 "[ . 1 . 2]" 1
821 1 51 THR HG1 1 73 SER QB 2.715 . 3.637 2.544 1.969 2.761 . 0 0 "[ . 1 . 2]" 1
822 1 26 THR HA 1 36 VAL HA 2.418 . 3.149 2.447 2.200 2.662 . 0 0 "[ . 1 . 2]" 1
823 1 26 THR HA 1 26 THR HB 2.459 . 3.215 2.804 2.769 2.846 . 0 0 "[ . 1 . 2]" 1
824 1 26 THR HA 1 26 THR MG 2.300 . 2.961 2.168 2.151 2.177 . 0 0 "[ . 1 . 2]" 1
825 1 25 VAL MG2 1 26 THR HA 2.686 . 3.588 3.300 3.199 3.388 . 0 0 "[ . 1 . 2]" 1
826 1 26 THR HA 1 37 LEU H 2.526 . 3.324 2.929 2.767 3.172 . 0 0 "[ . 1 . 2]" 1
827 1 26 THR HA 1 27 VAL H 2.063 . 2.595 2.395 2.376 2.413 . 0 0 "[ . 1 . 2]" 1
828 1 36 VAL H 1 36 VAL HB 2.743 2.114 3.372 2.699 2.526 2.838 . 0 0 "[ . 1 . 2]" 1
829 1 71 GLY H 1 71 GLY HA2 2.414 . 3.143 2.905 2.553 2.951 . 0 0 "[ . 1 . 2]" 1
830 1 59 ILE HA 1 59 ILE MG 2.279 . 2.928 2.443 2.415 2.476 . 0 0 "[ . 1 . 2]" 1
831 1 16 GLY HA3 1 59 ILE MG 2.499 . 3.279 2.580 2.511 2.622 . 0 0 "[ . 1 . 2]" 1
832 1 59 ILE HB 1 59 ILE MG 1.966 . 2.449 2.135 2.127 2.141 . 0 0 "[ . 1 . 2]" 1
833 1 43 ILE HG12 1 59 ILE MG 2.543 . 3.351 2.922 2.814 3.051 . 0 0 "[ . 1 . 2]" 1
834 1 59 ILE MG 1 67 VAL QG 2.458 . 3.213 2.992 2.745 3.275 0.062 19 0 "[ . 1 . 2]" 1
835 1 59 ILE MD 1 59 ILE MG 1.890 . 2.337 2.150 2.083 2.204 . 0 0 "[ . 1 . 2]" 1
836 1 59 ILE HG12 1 59 ILE MG 2.176 . 2.768 2.266 2.251 2.291 . 0 0 "[ . 1 . 2]" 1
837 1 59 ILE H 1 59 ILE MG 2.809 . 3.795 3.769 3.746 3.787 . 0 0 "[ . 1 . 2]" 1
838 1 17 PHE H 1 59 ILE MG 2.588 . 3.426 2.883 2.815 3.044 . 0 0 "[ . 1 . 2]" 1
839 1 59 ILE MG 1 61 PHE QD 2.689 . 3.593 3.255 2.951 3.446 . 0 0 "[ . 1 . 2]" 1
840 1 59 ILE MG 1 61 PHE HA 2.871 . 3.901 3.291 3.213 3.431 . 0 0 "[ . 1 . 2]" 1
841 1 17 PHE HA 1 17 PHE HB3 2.387 . 3.099 2.479 2.460 2.499 . 0 0 "[ . 1 . 2]" 1
842 1 17 PHE HA 1 17 PHE HB2 2.587 . 3.423 3.018 3.015 3.021 . 0 0 "[ . 1 . 2]" 1
843 1 17 PHE HA 1 18 ILE H 2.048 . 2.572 2.261 2.221 2.290 . 0 0 "[ . 1 . 2]" 1
844 1 17 PHE H 1 17 PHE HA 2.714 . 3.635 2.919 2.914 2.925 . 0 0 "[ . 1 . 2]" 1
845 1 17 PHE HA 1 43 ILE H 2.907 . 3.963 2.796 2.680 2.956 . 0 0 "[ . 1 . 2]" 1
846 1 73 SER HA 1 73 SER QB 2.288 . 2.942 2.366 2.281 2.460 . 0 0 "[ . 1 . 2]" 1
847 1 73 SER HA 1 74 ILE H 2.021 . 2.532 2.318 2.143 2.386 . 0 0 "[ . 1 . 2]" 1
848 1 50 LEU HA 1 50 LEU HG 2.631 . 3.496 2.590 2.490 2.734 . 0 0 "[ . 1 . 2]" 1
849 1 16 GLY HA2 1 59 ILE MG 2.800 . 3.780 3.837 3.798 3.876 0.096 5 0 "[ . 1 . 2]" 1
850 1 16 GLY HA2 1 17 PHE H 2.329 . 3.007 2.543 2.495 2.571 . 0 0 "[ . 1 . 2]" 1
851 1 16 GLY H 1 16 GLY HA2 2.509 . 3.296 2.856 2.841 2.870 . 0 0 "[ . 1 . 2]" 1
852 1 16 GLY HA2 1 61 PHE HA 2.367 . 3.067 2.224 2.085 2.346 . 0 0 "[ . 1 . 2]" 1
853 1 56 SER HB3 1 57 VAL H 2.755 . 3.704 3.334 2.972 3.950 0.246 16 0 "[ . 1 . 2]" 1
854 1 30 ILE HB 1 30 ILE HG12 2.452 . 3.204 3.022 3.018 3.025 . 0 0 "[ . 1 . 2]" 1
855 1 38 LYS HA 1 38 LYS HB3 2.071 . 2.607 2.352 2.221 2.413 . 0 0 "[ . 1 . 2]" 1
856 1 38 LYS HA 1 38 LYS HG3 2.772 . 3.732 3.412 3.122 3.715 . 0 0 "[ . 1 . 2]" 1
857 1 21 LEU MD1 1 38 LYS HA 2.364 . 3.063 2.530 1.995 2.801 . 0 0 "[ . 1 . 2]" 1
858 1 38 LYS HA 1 39 LEU H 2.022 . 2.533 2.591 2.513 2.669 0.136 8 0 "[ . 1 . 2]" 1
859 1 18 ILE MD 1 59 ILE MG 2.614 . 3.468 2.978 2.809 3.191 . 0 0 "[ . 1 . 2]" 1
860 1 18 ILE HB 1 18 ILE MD 2.646 . 3.521 3.234 3.230 3.239 . 0 0 "[ . 1 . 2]" 1
861 1 18 ILE MD 1 57 VAL HB 2.973 . 4.078 4.077 3.925 4.117 0.039 1 0 "[ . 1 . 2]" 1
862 1 18 ILE MD 1 18 ILE HG12 2.299 . 2.960 2.108 2.104 2.112 . 0 0 "[ . 1 . 2]" 1
863 1 18 ILE MD 1 18 ILE HG13 2.188 . 2.787 2.111 2.106 2.117 . 0 0 "[ . 1 . 2]" 1
864 1 18 ILE MD 1 18 ILE MG 1.953 . 2.430 1.986 1.970 2.010 . 0 0 "[ . 1 . 2]" 1
865 1 18 ILE H 1 18 ILE MD 2.363 . 3.061 3.063 2.994 3.113 0.052 6 0 "[ . 1 . 2]" 1
866 1 43 ILE MG 1 77 MET HG2 2.598 . 3.442 3.158 3.016 3.260 . 0 0 "[ . 1 . 2]" 1
867 1 23 GLY HA2 1 24 SER H 2.514 . 3.304 2.886 2.766 3.027 . 0 0 "[ . 1 . 2]" 1
868 1 74 ILE HA 1 74 ILE HG12 2.494 . 3.271 2.541 2.492 2.577 . 0 0 "[ . 1 . 2]" 1
869 1 74 ILE HA 1 74 ILE HG13 2.279 . 2.928 2.961 2.942 2.979 0.051 3 0 "[ . 1 . 2]" 1
870 1 74 ILE HA 1 74 ILE MG 2.199 . 2.803 2.432 2.395 2.468 . 0 0 "[ . 1 . 2]" 1
871 1 74 ILE HA 1 74 ILE HB 2.862 . 3.886 3.029 3.026 3.034 . 0 0 "[ . 1 . 2]" 1
872 1 74 ILE HA 1 75 VAL H 2.140 . 2.713 2.165 2.152 2.189 . 0 0 "[ . 1 . 2]" 1
873 1 51 THR H 1 74 ILE HA 2.732 . 3.665 3.432 3.298 3.587 . 0 0 "[ . 1 . 2]" 1
874 1 50 LEU HA 1 74 ILE HA 2.486 . 3.259 2.692 2.578 2.785 . 0 0 "[ . 1 . 2]" 1
875 1 39 LEU HA 1 39 LEU HG 2.836 . 3.842 2.285 2.225 2.353 . 0 0 "[ . 1 . 2]" 1
876 1 19 THR HA 1 19 THR MG 2.065 . 2.598 2.331 2.310 2.362 . 0 0 "[ . 1 . 2]" 1
877 1 19 THR HA 1 39 LEU MD2 2.299 . 2.960 3.100 3.064 3.137 0.177 11 0 "[ . 1 . 2]" 1
878 1 19 THR H 1 19 THR HA 2.465 . 3.224 2.959 2.955 2.962 . 0 0 "[ . 1 . 2]" 1
879 1 19 THR HA 1 20 LYS H 2.814 . 3.804 3.439 3.393 3.467 . 0 0 "[ . 1 . 2]" 1
880 1 18 ILE HA 1 18 ILE HB 2.619 . 3.476 3.015 3.010 3.022 . 0 0 "[ . 1 . 2]" 1
881 1 18 ILE HA 1 18 ILE HG12 2.839 . 3.846 3.213 3.166 3.252 . 0 0 "[ . 1 . 2]" 1
882 1 18 ILE HA 1 59 ILE HG13 2.929 . 4.002 4.056 4.027 4.097 0.095 12 0 "[ . 1 . 2]" 1
883 1 18 ILE HA 1 18 ILE HG13 2.767 . 3.724 3.789 3.765 3.812 0.088 13 0 "[ . 1 . 2]" 1
884 1 78 THR HA 1 78 THR MG 2.187 . 2.785 2.275 2.206 2.346 . 0 0 "[ . 1 . 2]" 1
885 1 18 ILE HA 1 18 ILE MG 2.238 . 2.864 2.322 2.296 2.346 . 0 0 "[ . 1 . 2]" 1
886 1 18 ILE HA 1 18 ILE MD 2.232 . 2.855 2.153 2.088 2.223 . 0 0 "[ . 1 . 2]" 1
887 1 18 ILE HA 1 59 ILE HG12 2.921 . 3.988 3.627 3.459 3.744 . 0 0 "[ . 1 . 2]" 1
888 1 78 THR HA 1 79 ASP H 2.345 . 3.033 2.775 2.711 2.848 . 0 0 "[ . 1 . 2]" 1
889 1 45 PHE QE 1 78 THR HA 2.531 . 3.332 2.595 2.310 2.796 . 0 0 "[ . 1 . 2]" 1
890 1 78 THR H 1 78 THR HA 2.646 . 3.521 2.939 2.934 2.946 . 0 0 "[ . 1 . 2]" 1
891 1 57 VAL MG2 1 69 ILE HB 2.027 . 2.541 2.573 2.508 2.621 0.080 4 0 "[ . 1 . 2]" 1
892 1 57 VAL H 1 57 VAL MG2 2.301 . 2.963 2.688 2.388 2.914 . 0 0 "[ . 1 . 2]" 1
893 1 57 VAL MG2 1 69 ILE H 2.913 . 3.974 4.035 4.001 4.073 0.099 18 0 "[ . 1 . 2]" 1
894 1 81 ILE HB 1 81 ILE MD 2.602 . 3.448 3.186 3.129 3.208 . 0 0 "[ . 1 . 2]" 1
895 1 81 ILE HB 1 82 TYR H 2.587 . 3.423 2.535 2.343 2.742 . 0 0 "[ . 1 . 2]" 1
896 1 81 ILE H 1 81 ILE HB 2.333 . 3.013 2.179 2.122 2.303 . 0 0 "[ . 1 . 2]" 1
897 1 29 SER HA 1 29 SER HB2 2.132 . 2.700 2.816 2.427 3.031 0.331 5 0 "[ . 1 . 2]" 1
898 1 29 SER HA 1 47 GLU HG3 2.615 . 3.470 3.484 3.420 3.519 0.049 16 0 "[ . 1 . 2]" 1
899 1 29 SER HA 1 47 GLU HB2 2.840 . 3.848 3.929 3.880 4.003 0.155 3 0 "[ . 1 . 2]" 1
900 1 29 SER HA 1 47 GLU HG2 2.324 . 2.999 1.829 1.776 1.902 . 0 0 "[ . 1 . 2]" 1
901 1 29 SER HA 1 47 GLU HB3 2.727 . 3.657 2.595 2.475 2.726 . 0 0 "[ . 1 . 2]" 1
902 1 29 SER HA 1 30 ILE H 2.351 . 3.042 2.617 2.569 2.673 . 0 0 "[ . 1 . 2]" 1
903 1 29 SER H 1 29 SER HA 2.728 . 3.658 2.817 2.805 2.833 . 0 0 "[ . 1 . 2]" 1
904 1 15 ILE MD 1 77 MET HB2 2.610 . 3.461 3.144 3.012 3.435 . 0 0 "[ . 1 . 2]" 1
905 1 77 MET HB2 1 77 MET HG3 2.342 . 3.027 2.502 2.353 2.554 . 0 0 "[ . 1 . 2]" 1
906 1 77 MET HB2 1 77 MET HG2 2.360 . 3.056 2.360 2.313 2.506 . 0 0 "[ . 1 . 2]" 1
907 1 41 ASP HA 1 42 PRO HD3 2.112 . 2.670 1.984 1.890 2.091 . 0 0 "[ . 1 . 2]" 1
908 1 41 ASP HA 1 42 PRO HD2 2.156 . 2.737 2.421 2.241 2.634 . 0 0 "[ . 1 . 2]" 1
909 1 41 ASP HA 1 41 ASP QB 2.543 . 3.096 2.306 2.149 2.514 . 0 0 "[ . 1 . 2]" 1
910 1 41 ASP H 1 41 ASP HA 2.503 . 3.286 2.858 2.813 2.892 . 0 0 "[ . 1 . 2]" 1
911 1 53 GLY HA2 1 72 ASP HB2 2.973 . 4.078 3.159 2.420 4.951 0.873 5 1 "[ + 1 . 2]" 1
912 1 37 LEU H 1 37 LEU HA 2.544 . 3.353 2.924 2.903 2.940 . 0 0 "[ . 1 . 2]" 1
913 1 28 GLN HG2 1 50 LEU MD1 2.868 . 3.897 3.741 3.513 3.949 0.052 1 0 "[ . 1 . 2]" 1
914 1 33 GLN H 1 33 GLN QG 2.563 . 3.384 2.557 2.213 2.864 . 0 0 "[ . 1 . 2]" 1
915 1 28 GLN HE22 1 28 GLN HG2 2.712 . 3.631 2.942 2.240 3.434 . 0 0 "[ . 1 . 2]" 1
916 1 32 GLY H 1 32 GLY HA3 2.445 . 3.192 2.924 2.899 2.947 . 0 0 "[ . 1 . 2]" 1
917 1 32 GLY HA3 1 33 GLN H 2.893 . 3.939 3.324 3.268 3.404 . 0 0 "[ . 1 . 2]" 1
918 1 19 THR HB 1 19 THR MG 1.883 . 2.326 2.136 2.131 2.138 . 0 0 "[ . 1 . 2]" 1
919 1 46 GLY H 1 46 GLY HA3 2.501 . 3.283 2.951 2.944 2.954 . 0 0 "[ . 1 . 2]" 1
920 1 46 GLY HA3 1 47 GLU H 2.918 . 3.983 3.328 3.197 3.405 . 0 0 "[ . 1 . 2]" 1
921 1 30 ILE MD 1 46 GLY HA3 2.912 . 3.972 4.054 4.000 4.080 0.108 12 0 "[ . 1 . 2]" 1
922 1 30 ILE HB 1 30 ILE MD 2.270 . 2.914 2.489 2.434 2.532 . 0 0 "[ . 1 . 2]" 1
923 1 30 ILE MD 1 30 ILE HG12 2.040 . 2.560 2.117 2.114 2.120 . 0 0 "[ . 1 . 2]" 1
924 1 30 ILE MD 1 30 ILE HG13 1.863 . 2.297 2.120 2.119 2.122 . 0 0 "[ . 1 . 2]" 1
925 1 84 THR HA 1 84 THR MG 2.320 . 2.993 2.278 2.224 2.322 . 0 0 "[ . 1 . 2]" 1
926 1 59 ILE HB 1 59 ILE HG12 2.553 . 3.368 3.007 3.004 3.012 . 0 0 "[ . 1 . 2]" 1
927 1 34 GLU HA 1 34 GLU HG2 2.567 . 3.391 3.088 2.782 3.273 . 0 0 "[ . 1 . 2]" 1
928 1 34 GLU HA 1 34 GLU HG3 2.530 . 3.330 2.668 2.268 2.895 . 0 0 "[ . 1 . 2]" 1
929 1 34 GLU HA 1 34 GLU HB2 2.169 . 2.757 2.455 2.338 2.726 . 0 0 "[ . 1 . 2]" 1
930 1 34 GLU HA 1 35 ARG H 2.044 . 2.566 2.124 2.072 2.181 . 0 0 "[ . 1 . 2]" 1
931 1 34 GLU H 1 34 GLU HA 2.469 . 3.231 2.909 2.882 2.937 . 0 0 "[ . 1 . 2]" 1
932 1 71 GLY HA3 1 72 ASP H 2.490 . 3.265 2.890 2.633 2.984 . 0 0 "[ . 1 . 2]" 1
933 1 51 THR HG1 1 71 GLY HA3 2.863 . 3.888 3.950 3.912 4.339 0.451 5 0 "[ . 1 . 2]" 1
934 1 58 THR MG 1 66 ASP QB 2.275 . 2.922 2.655 2.402 2.850 . 0 0 "[ . 1 . 2]" 1
935 1 20 LYS QB 1 58 THR MG 2.436 . 3.178 3.035 2.950 3.152 . 0 0 "[ . 1 . 2]" 1
936 1 19 THR H 1 58 THR MG 2.568 . 3.392 3.478 3.436 3.524 0.132 4 0 "[ . 1 . 2]" 1
937 1 21 LEU MD2 1 38 LYS HA 2.916 . 3.979 2.934 2.445 3.283 . 0 0 "[ . 1 . 2]" 1
938 1 21 LEU MD2 1 39 LEU HA 3.187 . 4.456 4.493 4.341 4.585 0.129 4 0 "[ . 1 . 2]" 1
939 1 41 ASP QB 1 42 PRO HD3 2.755 . 3.703 3.538 3.180 3.619 . 0 0 "[ . 1 . 2]" 1
940 1 42 PRO HD3 1 42 PRO HG3 2.412 . 3.139 2.270 2.232 2.298 . 0 0 "[ . 1 . 2]" 1
941 1 42 PRO HD3 1 42 PRO HG2 2.557 . 3.374 2.947 2.875 2.976 . 0 0 "[ . 1 . 2]" 1
942 1 42 PRO QB 1 42 PRO HD3 2.878 . 3.913 2.983 2.878 3.215 . 0 0 "[ . 1 . 2]" 1
943 1 19 THR HB 1 60 ALA MB 2.869 . 3.898 3.880 3.775 3.944 0.046 1 0 "[ . 1 . 2]" 1
944 1 28 GLN HA 1 28 GLN HG2 2.538 . 3.343 2.487 2.384 2.559 . 0 0 "[ . 1 . 2]" 1
945 1 28 GLN HA 1 28 GLN HG3 2.584 . 3.419 2.522 2.443 2.602 . 0 0 "[ . 1 . 2]" 1
946 1 28 GLN HA 1 28 GLN HB3 2.406 . 3.130 2.809 2.767 2.863 . 0 0 "[ . 1 . 2]" 1
947 1 28 GLN HA 1 28 GLN HB2 2.519 . 3.312 2.897 2.840 2.932 . 0 0 "[ . 1 . 2]" 1
948 1 28 GLN H 1 28 GLN HA 2.732 . 3.665 2.927 2.911 2.937 . 0 0 "[ . 1 . 2]" 1
949 1 28 GLN HA 1 35 ARG H 2.940 . 4.020 3.716 3.346 3.986 . 0 0 "[ . 1 . 2]" 1
950 1 28 GLN HA 1 34 GLU HA 2.317 . 2.988 2.295 2.141 2.525 . 0 0 "[ . 1 . 2]" 1
951 1 27 VAL MG2 1 49 VAL HA 2.717 . 3.640 2.121 2.006 2.327 . 0 0 "[ . 1 . 2]" 1
952 1 27 VAL MG2 1 47 GLU HG2 2.761 . 3.714 3.886 3.844 3.932 0.218 16 0 "[ . 1 . 2]" 1
953 1 27 VAL MG2 1 47 GLU HB3 2.339 . 3.023 1.832 1.805 1.864 . 0 0 "[ . 1 . 2]" 1
954 1 27 VAL HB 1 27 VAL MG2 2.129 . 2.696 2.125 2.120 2.130 . 0 0 "[ . 1 . 2]" 1
955 1 27 VAL HA 1 27 VAL HB 2.356 . 3.050 2.627 2.610 2.653 . 0 0 "[ . 1 . 2]" 1
956 1 27 VAL HA 1 27 VAL MG2 2.138 . 2.710 2.193 2.148 2.213 . 0 0 "[ . 1 . 2]" 1
957 1 27 VAL HA 1 50 LEU MD1 2.462 . 3.220 2.494 2.368 2.915 . 0 0 "[ . 1 . 2]" 1
958 1 27 VAL HA 1 28 GLN H 1.971 . 2.457 2.114 2.090 2.142 . 0 0 "[ . 1 . 2]" 1
959 1 27 VAL HA 1 50 LEU H 2.659 . 3.543 2.836 2.666 3.073 . 0 0 "[ . 1 . 2]" 1
960 1 27 VAL H 1 27 VAL HA 2.627 . 3.489 2.932 2.926 2.938 . 0 0 "[ . 1 . 2]" 1
961 1 80 GLU HA 1 80 GLU HG2 2.358 . 3.053 2.824 2.404 3.789 0.736 12 2 "[ . 1 + - 2]" 1
962 1 80 GLU HA 1 80 GLU HB3 2.199 . 2.803 2.566 2.467 3.023 0.220 12 0 "[ . 1 . 2]" 1
963 1 80 GLU HA 1 80 GLU HB2 2.331 . 3.010 2.958 2.454 3.021 0.011 19 0 "[ . 1 . 2]" 1
964 1 80 GLU H 1 80 GLU HA 2.478 . 3.246 2.822 2.802 2.856 . 0 0 "[ . 1 . 2]" 1
965 1 80 GLU HA 1 81 ILE H 2.509 . 3.296 3.408 3.365 3.433 0.137 13 0 "[ . 1 . 2]" 1
966 1 69 ILE HB 1 69 ILE MG 2.054 . 2.581 2.133 2.130 2.136 . 0 0 "[ . 1 . 2]" 1
967 1 69 ILE HG12 1 69 ILE MG 2.304 . 2.968 2.421 2.410 2.441 . 0 0 "[ . 1 . 2]" 1
968 1 30 ILE HB 1 30 ILE MG 2.120 . 2.682 2.125 2.123 2.128 . 0 0 "[ . 1 . 2]" 1
969 1 51 THR HG1 1 69 ILE MG 2.998 . 4.121 2.681 2.124 2.859 . 0 0 "[ . 1 . 2]" 1
970 1 30 ILE H 1 30 ILE MG 2.424 . 3.159 2.379 2.244 2.569 . 0 0 "[ . 1 . 2]" 1
971 1 18 ILE HB 1 39 LEU HA 2.515 . 3.306 2.332 2.214 2.564 . 0 0 "[ . 1 . 2]" 1
972 1 39 LEU HA 1 39 LEU MD1 2.069 . 2.604 2.491 2.327 2.617 0.013 2 0 "[ . 1 . 2]" 1
973 1 21 LEU MD1 1 39 LEU HA 2.858 . 3.879 3.522 3.397 3.628 . 0 0 "[ . 1 . 2]" 1
974 1 39 LEU HA 1 40 GLY H 1.943 . 2.415 2.224 2.177 2.254 . 0 0 "[ . 1 . 2]" 1
975 1 39 LEU H 1 39 LEU HA 2.343 . 3.029 2.846 2.810 2.879 . 0 0 "[ . 1 . 2]" 1
976 1 39 LEU HA 1 41 ASP H 2.831 . 3.833 3.239 3.129 3.398 . 0 0 "[ . 1 . 2]" 1
977 1 81 ILE MG 1 82 TYR HB2 2.818 . 3.811 2.496 2.356 2.762 . 0 0 "[ . 1 . 2]" 1
978 1 81 ILE HB 1 81 ILE MG 2.111 . 2.668 2.112 2.109 2.116 . 0 0 "[ . 1 . 2]" 1
979 1 81 ILE HG12 1 81 ILE MG 2.371 . 3.074 3.143 3.092 3.165 0.091 8 0 "[ . 1 . 2]" 1
980 1 81 ILE HG13 1 81 ILE MG 2.394 . 3.110 2.584 2.523 2.706 . 0 0 "[ . 1 . 2]" 1
981 1 81 ILE MG 1 82 TYR H 2.701 . 3.613 2.615 2.490 2.772 . 0 0 "[ . 1 . 2]" 1
982 1 81 ILE H 1 81 ILE MG 2.624 . 3.485 3.555 3.522 3.622 0.137 9 0 "[ . 1 . 2]" 1
983 1 61 PHE HZ 1 81 ILE MG 2.430 . 3.168 1.845 1.756 1.895 . 0 0 "[ . 1 . 2]" 1
984 1 50 LEU HA 1 50 LEU HB2 2.513 . 3.303 3.020 3.017 3.024 . 0 0 "[ . 1 . 2]" 1
985 1 50 LEU HA 1 50 LEU HB3 2.230 . 2.852 2.440 2.414 2.474 . 0 0 "[ . 1 . 2]" 1
986 1 50 LEU HA 1 74 ILE HG13 2.713 . 3.633 3.453 3.350 3.546 . 0 0 "[ . 1 . 2]" 1
987 1 50 LEU HA 1 50 LEU MD2 2.445 . 3.192 3.185 2.867 3.284 0.092 12 0 "[ . 1 . 2]" 1
988 1 50 LEU H 1 50 LEU HA 2.707 . 3.623 2.945 2.937 2.950 . 0 0 "[ . 1 . 2]" 1
989 1 50 LEU HA 1 51 THR H 2.077 . 2.616 2.193 2.160 2.241 . 0 0 "[ . 1 . 2]" 1
990 1 18 ILE HG13 1 37 LEU QD 2.437 . 3.179 2.988 2.743 3.112 . 0 0 "[ . 1 . 2]" 1
991 1 18 ILE HB 1 18 ILE HG13 2.503 . 3.286 2.448 2.425 2.462 . 0 0 "[ . 1 . 2]" 1
992 1 18 ILE H 1 18 ILE HG13 2.620 . 3.478 3.574 3.535 3.617 0.139 3 0 "[ . 1 . 2]" 1
993 1 45 PHE HA 1 45 PHE HB2 2.315 . 2.985 2.691 2.667 2.708 . 0 0 "[ . 1 . 2]" 1
994 1 45 PHE HA 1 77 MET HB3 2.681 . 3.579 3.327 2.613 3.590 0.011 11 0 "[ . 1 . 2]" 1
995 1 45 PHE HA 1 77 MET HB2 2.727 . 3.656 3.071 2.986 3.281 . 0 0 "[ . 1 . 2]" 1
996 1 15 ILE MG 1 45 PHE HA 2.851 . 3.867 2.947 2.779 3.067 . 0 0 "[ . 1 . 2]" 1
997 1 15 ILE MD 1 45 PHE HA 2.363 . 3.061 1.982 1.904 2.053 . 0 0 "[ . 1 . 2]" 1
998 1 45 PHE H 1 45 PHE HA 2.692 . 3.598 2.848 2.836 2.870 . 0 0 "[ . 1 . 2]" 1
999 1 45 PHE HA 1 46 GLY H 2.079 . 2.619 2.147 2.122 2.165 . 0 0 "[ . 1 . 2]" 1
1000 1 45 PHE HA 1 47 GLU H 2.924 . 3.993 3.636 3.519 3.709 . 0 0 "[ . 1 . 2]" 1
1001 1 28 GLN HB3 1 50 LEU MD1 2.796 . 3.773 3.661 3.549 3.760 . 0 0 "[ . 1 . 2]" 1
1002 1 28 GLN H 1 28 GLN HB3 2.698 . 3.608 3.303 3.191 3.365 . 0 0 "[ . 1 . 2]" 1
1003 1 33 GLN HA 1 33 GLN QG 2.335 . 3.016 2.640 2.296 2.917 . 0 0 "[ . 1 . 2]" 1
1004 1 33 GLN HA 1 33 GLN HB3 2.176 . 2.768 2.543 2.440 2.651 . 0 0 "[ . 1 . 2]" 1
1005 1 33 GLN HA 1 34 GLU H 2.014 . 2.521 2.135 2.102 2.165 . 0 0 "[ . 1 . 2]" 1
1006 1 33 GLN H 1 33 GLN HA 2.510 . 3.298 2.865 2.820 2.906 . 0 0 "[ . 1 . 2]" 1
1007 1 25 VAL HB 1 25 VAL MG2 1.942 . 2.413 2.116 2.113 2.119 . 0 0 "[ . 1 . 2]" 1
1008 1 35 ARG HA 1 35 ARG HB3 2.019 . 2.529 2.657 2.498 2.945 0.416 19 0 "[ . 1 . 2]" 1
1009 1 35 ARG HA 1 35 ARG HG2 2.947 . 4.033 3.718 3.593 3.783 . 0 0 "[ . 1 . 2]" 1
1010 1 35 ARG H 1 35 ARG HA 2.647 . 3.523 2.949 2.936 2.956 . 0 0 "[ . 1 . 2]" 1
1011 1 35 ARG HA 1 36 VAL H 2.024 . 2.536 2.370 2.207 2.504 . 0 0 "[ . 1 . 2]" 1
1012 1 26 THR MG 1 34 GLU HB2 3.155 2.274 4.036 4.275 4.139 4.569 0.533 13 3 "[ . 1 *+-. 2]" 1
1013 1 36 VAL HA 1 36 VAL HB 2.374 . 3.079 2.501 2.469 2.543 . 0 0 "[ . 1 . 2]" 1
1014 1 36 VAL H 1 36 VAL HA 2.552 . 3.366 2.902 2.855 2.935 . 0 0 "[ . 1 . 2]" 1
1015 1 36 VAL HA 1 37 LEU H 1.977 . 2.466 2.185 2.130 2.226 . 0 0 "[ . 1 . 2]" 1
1016 1 17 PHE HB3 1 18 ILE H 2.654 . 3.535 2.737 2.711 2.797 . 0 0 "[ . 1 . 2]" 1
1017 1 17 PHE H 1 17 PHE HB3 2.895 . 3.943 3.864 3.852 3.870 . 0 0 "[ . 1 . 2]" 1
1018 1 86 ASP HA 1 86 ASP HB3 2.430 . 3.168 2.809 2.445 3.030 . 0 0 "[ . 1 . 2]" 1
1019 1 86 ASP HA 1 86 ASP HB2 2.466 . 3.226 2.557 2.369 3.026 . 0 0 "[ . 1 . 2]" 1
1020 1 48 THR HA 1 76 GLU HB2 2.584 . 3.419 3.376 2.702 3.472 0.053 10 0 "[ . 1 . 2]" 1
1021 1 48 THR HA 1 48 THR MG 2.262 . 2.902 2.325 2.283 2.355 . 0 0 "[ . 1 . 2]" 1
1022 1 48 THR HA 1 49 VAL MG2 2.603 . 3.450 3.477 3.444 3.490 0.040 15 0 "[ . 1 . 2]" 1
1023 1 48 THR HA 1 49 VAL H 2.035 . 2.553 2.192 2.180 2.204 . 0 0 "[ . 1 . 2]" 1
1024 1 48 THR H 1 48 THR HA 2.728 . 3.659 2.933 2.913 2.948 . 0 0 "[ . 1 . 2]" 1
1025 1 83 ASN HA 1 83 ASN HB3 2.461 . 3.218 3.028 3.025 3.031 . 0 0 "[ . 1 . 2]" 1
1026 1 83 ASN HA 1 83 ASN HB2 2.416 . 3.146 2.484 2.439 2.532 . 0 0 "[ . 1 . 2]" 1
1027 1 50 LEU HB2 1 50 LEU MD1 2.333 . 3.014 2.127 2.108 2.140 . 0 0 "[ . 1 . 2]" 1
1028 1 62 VAL HA 1 62 VAL HB 2.019 . 2.528 2.541 2.529 2.554 0.026 12 0 "[ . 1 . 2]" 1
1029 1 62 VAL HA 1 62 VAL MG2 2.033 . 2.549 2.280 2.268 2.295 . 0 0 "[ . 1 . 2]" 1
1030 1 62 VAL H 1 62 VAL HA 2.407 . 3.131 2.846 2.828 2.868 . 0 0 "[ . 1 . 2]" 1
1031 1 62 VAL HA 1 64 GLY H 2.975 . 4.081 3.646 3.407 3.836 . 0 0 "[ . 1 . 2]" 1
1032 1 62 VAL HA 1 63 ASP H 2.755 . 3.704 3.307 3.209 3.396 . 0 0 "[ . 1 . 2]" 1
1033 1 40 GLY H 1 40 GLY HA3 2.331 . 3.010 2.871 2.853 2.912 . 0 0 "[ . 1 . 2]" 1
1034 1 18 ILE HG12 1 18 ILE MG 2.495 . 3.273 3.205 3.198 3.211 . 0 0 "[ . 1 . 2]" 1
1035 1 18 ILE HG12 1 37 LEU QD 2.713 . 3.633 3.484 3.305 3.589 . 0 0 "[ . 1 . 2]" 1
1036 1 18 ILE H 1 18 ILE HG12 2.395 . 3.112 2.054 2.001 2.111 . 0 0 "[ . 1 . 2]" 1
1037 1 74 ILE MD 1 74 ILE HG12 1.896 . 2.345 2.115 2.113 2.117 . 0 0 "[ . 1 . 2]" 1
1038 1 36 VAL MG1 1 38 LYS HG3 2.831 . 3.833 3.161 2.577 3.980 0.147 2 0 "[ . 1 . 2]" 1
1039 1 33 GLN HA 1 33 GLN HB2 2.697 . 3.606 3.007 2.975 3.021 . 0 0 "[ . 1 . 2]" 1
1040 1 61 PHE HA 1 61 PHE HB2 2.689 . 3.593 3.012 3.006 3.018 . 0 0 "[ . 1 . 2]" 1
1041 1 16 GLY HA3 1 61 PHE HA 2.324 . 2.999 2.134 2.034 2.218 . 0 0 "[ . 1 . 2]" 1
1042 1 61 PHE HA 1 61 PHE HB3 2.424 . 3.159 2.533 2.503 2.573 . 0 0 "[ . 1 . 2]" 1
1043 1 61 PHE H 1 61 PHE HA 2.878 . 3.914 2.841 2.805 2.859 . 0 0 "[ . 1 . 2]" 1
1044 1 61 PHE HA 1 62 VAL H 2.158 . 2.740 2.215 2.169 2.275 . 0 0 "[ . 1 . 2]" 1
1045 1 74 ILE HB 1 74 ILE MD 2.144 . 2.719 2.414 2.398 2.431 . 0 0 "[ . 1 . 2]" 1
1046 1 54 SER HA 1 54 SER HB2 2.380 . 3.088 2.869 2.440 3.032 . 0 0 "[ . 1 . 2]" 1
1047 1 54 SER HA 1 54 SER HB3 2.306 . 2.970 2.548 2.366 3.032 0.062 9 0 "[ . 1 . 2]" 1
1048 1 14 ALA HA 1 44 PHE HA 2.741 . 3.680 2.369 2.282 2.489 . 0 0 "[ . 1 . 2]" 1
1049 1 44 PHE HA 1 44 PHE HB3 2.593 . 3.433 2.470 2.440 2.495 . 0 0 "[ . 1 . 2]" 1
1050 1 44 PHE HA 1 44 PHE HB2 2.739 . 3.677 3.030 3.027 3.033 . 0 0 "[ . 1 . 2]" 1
1051 1 15 ILE H 1 44 PHE HA 2.690 . 3.595 2.368 2.175 2.643 . 0 0 "[ . 1 . 2]" 1
1052 1 45 PHE HA 1 45 PHE HB3 2.584 . 3.419 2.975 2.967 2.989 . 0 0 "[ . 1 . 2]" 1
1053 1 45 PHE H 1 45 PHE HB3 2.434 . 3.175 2.925 2.888 2.973 . 0 0 "[ . 1 . 2]" 1
1054 1 81 ILE HB 1 81 ILE HG12 2.271 . 2.915 2.613 2.564 2.704 . 0 0 "[ . 1 . 2]" 1
1055 1 81 ILE H 1 81 ILE HG12 2.784 . 3.753 3.005 2.914 3.167 . 0 0 "[ . 1 . 2]" 1
1056 1 30 ILE H 1 30 ILE HG12 2.875 . 3.908 1.884 1.748 2.028 0.094 13 0 "[ . 1 . 2]" 1
1057 1 17 PHE HB2 1 18 ILE H 2.777 . 3.741 3.850 3.810 3.889 0.148 5 0 "[ . 1 . 2]" 1
1058 1 43 ILE HA 1 43 ILE HB 2.391 . 3.106 3.014 3.009 3.020 . 0 0 "[ . 1 . 2]" 1
1059 1 43 ILE HA 1 43 ILE HG12 3.648 . 5.311 2.893 2.858 2.920 . 0 0 "[ . 1 . 2]" 1
1060 1 43 ILE HA 1 44 PHE H 2.085 . 2.628 2.156 2.129 2.181 . 0 0 "[ . 1 . 2]" 1
1061 1 43 ILE H 1 43 ILE HA 2.507 . 3.293 2.923 2.911 2.933 . 0 0 "[ . 1 . 2]" 1
1062 1 19 THR HA 1 39 LEU MD1 2.825 . 3.822 3.415 3.162 3.666 . 0 0 "[ . 1 . 2]" 1
1063 1 39 LEU H 1 39 LEU MD1 2.777 . 3.741 3.709 3.615 3.789 0.048 11 0 "[ . 1 . 2]" 1
1064 1 20 LYS H 1 39 LEU MD1 2.803 . 3.785 3.303 3.104 3.482 . 0 0 "[ . 1 . 2]" 1
1065 1 42 PRO QB 1 43 ILE H 2.825 . 3.823 3.251 3.094 3.420 . 0 0 "[ . 1 . 2]" 1
1066 1 62 VAL H 1 62 VAL HB 2.780 . 3.746 2.357 2.292 2.408 . 0 0 "[ . 1 . 2]" 1
1067 1 15 ILE HB 1 62 VAL MG1 2.836 . 3.841 3.689 3.541 3.804 . 0 0 "[ . 1 . 2]" 1
1068 1 15 ILE HB 1 15 ILE HG13 2.578 . 3.409 2.455 2.445 2.464 . 0 0 "[ . 1 . 2]" 1
1069 1 59 ILE HA 1 59 ILE HG13 2.486 . 3.259 2.726 2.684 2.783 . 0 0 "[ . 1 . 2]" 1
1070 1 18 ILE MD 1 59 ILE HA 2.538 . 3.343 2.766 2.676 2.908 . 0 0 "[ . 1 . 2]" 1
1071 1 59 ILE HA 1 59 ILE HG12 2.529 . 3.328 2.615 2.578 2.645 . 0 0 "[ . 1 . 2]" 1
1072 1 59 ILE HA 1 59 ILE HB 2.736 . 3.672 3.019 3.015 3.023 . 0 0 "[ . 1 . 2]" 1
1073 1 58 THR MG 1 59 ILE HA 3.046 . 4.206 3.856 3.780 3.956 . 0 0 "[ . 1 . 2]" 1
1074 1 59 ILE H 1 59 ILE HA 2.726 . 3.655 2.921 2.914 2.929 . 0 0 "[ . 1 . 2]" 1
1075 1 59 ILE HA 1 60 ALA H 1.972 . 2.458 2.129 2.095 2.157 . 0 0 "[ . 1 . 2]" 1
1076 1 35 ARG HB3 1 35 ARG HG2 2.299 . 2.960 2.486 2.404 2.524 . 0 0 "[ . 1 . 2]" 1
1077 1 35 ARG HB3 1 35 ARG HD3 2.346 . 3.034 2.560 2.307 3.160 0.126 12 0 "[ . 1 . 2]" 1
1078 1 35 ARG H 1 35 ARG HB3 2.872 . 3.903 2.715 2.260 3.001 . 0 0 "[ . 1 . 2]" 1
1079 1 35 ARG HB3 1 36 VAL H 2.721 . 3.646 3.999 3.733 4.449 0.803 13 7 "[* . * *+*. * -2]" 1
1080 1 83 ASN HB3 1 83 ASN HD22 2.810 . 3.797 3.102 2.193 3.521 . 0 0 "[ . 1 . 2]" 1
1081 1 66 ASP QB 1 67 VAL H 2.315 . 2.985 2.692 2.055 2.928 . 0 0 "[ . 1 . 2]" 1
1082 1 25 VAL MG1 1 55 GLY HA2 2.748 . 3.692 3.091 2.759 3.400 . 0 0 "[ . 1 . 2]" 1
1083 1 49 VAL HB 1 49 VAL MG2 1.777 . 2.172 2.131 2.128 2.134 . 0 0 "[ . 1 . 2]" 1
1084 1 25 VAL H 1 25 VAL MG1 2.290 . 2.945 2.753 2.630 2.881 . 0 0 "[ . 1 . 2]" 1
1085 1 25 VAL MG1 1 52 GLY H 2.888 . 3.930 3.661 3.358 3.936 0.006 9 0 "[ . 1 . 2]" 1
1086 1 27 VAL MG1 1 47 GLU HB3 2.405 . 3.128 2.794 2.678 2.898 . 0 0 "[ . 1 . 2]" 1
1087 1 47 GLU HB3 1 47 GLU HG3 2.483 . 3.253 2.992 2.986 2.997 . 0 0 "[ . 1 . 2]" 1
1088 1 74 ILE HB 1 74 ILE MG 2.016 . 2.524 2.129 2.127 2.133 . 0 0 "[ . 1 . 2]" 1
1089 1 50 LEU HG 1 74 ILE MG 2.168 . 2.755 2.587 2.302 2.785 0.030 3 0 "[ . 1 . 2]" 1
1090 1 74 ILE H 1 74 ILE MG 2.982 . 4.093 3.893 3.860 3.916 . 0 0 "[ . 1 . 2]" 1
1091 1 69 ILE HA 1 69 ILE MD 2.786 . 3.756 3.831 3.812 3.862 0.106 5 0 "[ . 1 . 2]" 1
1092 1 57 VAL HB 1 69 ILE MD 2.954 . 4.045 2.250 2.093 2.363 . 0 0 "[ . 1 . 2]" 1
1093 1 69 ILE HB 1 69 ILE MD 2.067 . 2.601 2.461 2.429 2.488 . 0 0 "[ . 1 . 2]" 1
1094 1 69 ILE MD 1 69 ILE HG12 2.064 . 2.596 2.110 2.108 2.112 . 0 0 "[ . 1 . 2]" 1
1095 1 59 ILE HG13 1 69 ILE MD 2.614 . 3.468 3.343 3.226 3.516 0.048 7 0 "[ . 1 . 2]" 1
1096 1 69 ILE MD 1 69 ILE MG 1.732 . 2.107 1.878 1.851 1.940 . 0 0 "[ . 1 . 2]" 1
1097 1 27 VAL MG2 1 47 GLU HB2 2.662 . 3.548 2.342 2.237 2.414 . 0 0 "[ . 1 . 2]" 1
1098 1 72 ASP HA 1 72 ASP HB3 2.261 . 2.900 2.986 2.326 3.034 0.134 16 0 "[ . 1 . 2]" 1
1099 1 72 ASP HA 1 72 ASP HB2 2.420 . 3.152 2.503 2.466 2.578 . 0 0 "[ . 1 . 2]" 1
1100 1 70 GLY H 1 70 GLY HA3 2.297 . 2.956 2.324 2.306 2.350 . 0 0 "[ . 1 . 2]" 1
1101 1 41 ASP QB 1 42 PRO HD2 2.894 . 3.389 2.694 2.434 2.876 . 0 0 "[ . 1 . 2]" 1
1102 1 42 PRO HD2 1 42 PRO HG3 2.444 . 3.191 2.762 2.731 2.837 . 0 0 "[ . 1 . 2]" 1
1103 1 42 PRO HD2 1 42 PRO HG2 2.464 . 3.223 2.287 2.260 2.307 . 0 0 "[ . 1 . 2]" 1
1104 1 35 ARG HD3 1 35 ARG HG3 2.483 . 3.254 2.907 2.396 3.017 . 0 0 "[ . 1 . 2]" 1
1105 1 43 ILE H 1 43 ILE HG13 2.896 . 3.944 3.964 3.866 4.005 0.061 16 0 "[ . 1 . 2]" 1
1106 1 59 ILE HB 1 67 VAL QG 2.349 . 3.039 1.861 1.776 2.027 . 0 0 "[ . 1 . 2]" 1
1107 1 59 ILE H 1 59 ILE HB 2.369 . 3.071 2.457 2.416 2.491 . 0 0 "[ . 1 . 2]" 1
1108 1 30 ILE HB 1 30 ILE HG13 2.652 . 3.531 2.421 2.392 2.454 . 0 0 "[ . 1 . 2]" 1
1109 1 30 ILE H 1 30 ILE HG13 2.568 . 3.392 3.106 2.890 3.278 . 0 0 "[ . 1 . 2]" 1
1110 1 21 LEU HA 1 57 VAL MG1 2.464 . 3.223 2.874 2.721 3.115 . 0 0 "[ . 1 . 2]" 1
1111 1 21 LEU H 1 21 LEU HA 2.535 . 3.338 2.873 2.852 2.898 . 0 0 "[ . 1 . 2]" 1
1112 1 29 SER HB3 1 33 GLN HB2 2.940 . 4.020 3.964 2.598 4.486 0.466 20 0 "[ . 1 . 2]" 1
1113 1 29 SER HB3 1 30 ILE H 2.717 . 3.640 2.754 2.142 3.624 . 0 0 "[ . 1 . 2]" 1
1114 1 29 SER HA 1 29 SER HB3 2.887 . 3.929 2.491 2.359 3.034 . 0 0 "[ . 1 . 2]" 1
1115 1 27 VAL MG1 1 47 GLU HB2 2.618 . 3.475 3.638 3.583 3.706 0.231 12 0 "[ . 1 . 2]" 1
1116 1 27 VAL MG1 1 28 GLN H 2.603 . 3.450 3.467 3.375 3.574 0.124 17 0 "[ . 1 . 2]" 1
1117 1 27 VAL MG1 1 35 ARG H 2.867 . 3.894 2.845 2.688 2.946 . 0 0 "[ . 1 . 2]" 1
1118 1 27 VAL H 1 27 VAL MG1 2.505 . 3.289 2.739 2.642 2.827 . 0 0 "[ . 1 . 2]" 1
1119 1 27 VAL MG1 1 35 ARG HE 2.738 . 3.675 2.952 2.073 3.786 0.111 17 0 "[ . 1 . 2]" 1
1120 1 27 VAL HA 1 27 VAL MG1 2.611 . 3.463 3.168 3.148 3.190 . 0 0 "[ . 1 . 2]" 1
1121 1 69 ILE MD 1 69 ILE HG13 2.184 . 2.780 2.113 2.111 2.116 . 0 0 "[ . 1 . 2]" 1
1122 1 69 ILE HA 1 69 ILE HG13 2.626 . 3.488 3.212 3.144 3.251 . 0 0 "[ . 1 . 2]" 1
1123 1 69 ILE HB 1 69 ILE HG13 2.562 . 3.382 2.447 2.433 2.465 . 0 0 "[ . 1 . 2]" 1
1124 1 59 ILE HG13 1 69 ILE HG13 2.744 . 3.685 3.683 3.510 3.725 0.040 12 0 "[ . 1 . 2]" 1
1125 1 57 VAL HB 1 57 VAL MG2 2.034 . 2.551 2.116 2.110 2.123 . 0 0 "[ . 1 . 2]" 1
1126 1 18 ILE HB 1 18 ILE HG12 2.446 . 3.194 2.451 2.442 2.465 . 0 0 "[ . 1 . 2]" 1
1127 1 15 ILE HA 1 15 ILE MG 2.344 . 3.031 2.420 2.395 2.458 . 0 0 "[ . 1 . 2]" 1
1128 1 15 ILE MG 1 45 PHE HB2 2.385 . 3.096 1.829 1.780 1.866 . 0 0 "[ . 1 . 2]" 1
1129 1 15 ILE HB 1 15 ILE MG 2.080 . 2.621 2.115 2.109 2.118 . 0 0 "[ . 1 . 2]" 1
1130 1 15 ILE MG 1 45 PHE H 2.645 . 3.520 2.399 2.270 2.514 . 0 0 "[ . 1 . 2]" 1
1131 1 15 ILE H 1 15 ILE MG 2.545 . 3.354 2.327 2.216 2.510 . 0 0 "[ . 1 . 2]" 1
1132 1 37 LEU HA 1 37 LEU HB2 2.480 . 3.249 3.002 2.991 3.012 . 0 0 "[ . 1 . 2]" 1
1133 1 37 LEU HA 1 37 LEU HB3 2.450 . 3.200 2.529 2.495 2.545 . 0 0 "[ . 1 . 2]" 1
1134 1 37 LEU HA 1 37 LEU QD 2.163 . 2.748 1.873 1.787 1.934 . 0 0 "[ . 1 . 2]" 1
1135 1 37 LEU HA 1 38 LYS H 2.081 . 2.622 2.181 2.039 2.333 . 0 0 "[ . 1 . 2]" 1
1136 1 37 LEU QD 1 41 ASP QB 2.940 2.386 3.327 2.610 2.079 3.006 0.307 19 0 "[ . 1 . 2]" 1
1137 1 27 VAL HB 1 37 LEU QD 2.277 . 2.740 2.077 2.027 2.150 . 0 0 "[ . 1 . 2]" 1
1138 1 37 LEU HB2 1 37 LEU QD 2.111 . 2.668 2.418 2.340 2.488 . 0 0 "[ . 1 . 2]" 1
1139 1 37 LEU HB3 1 37 LEU QD 2.225 . 2.598 2.082 2.055 2.109 . 0 0 "[ . 1 . 2]" 1
1140 1 42 PRO HG3 1 44 PHE QE 2.620 . 3.478 3.395 3.181 3.545 0.067 10 0 "[ . 1 . 2]" 1
1141 1 21 LEU HG 1 22 ASP HA 2.948 . 4.034 4.055 3.941 4.108 0.074 8 0 "[ . 1 . 2]" 1
1142 1 21 LEU MD2 1 22 ASP HA 2.709 . 3.627 2.779 2.614 3.008 . 0 0 "[ . 1 . 2]" 1
1143 1 49 VAL H 1 49 VAL MG2 2.354 . 3.046 1.939 1.883 1.989 . 0 0 "[ . 1 . 2]" 1
1144 1 27 VAL HA 1 49 VAL MG2 2.992 . 4.111 3.792 3.673 3.902 . 0 0 "[ . 1 . 2]" 1
1145 1 64 GLY H 1 64 GLY HA3 2.534 . 3.337 2.954 2.941 2.958 . 0 0 "[ . 1 . 2]" 1
1146 1 27 VAL HB 1 49 VAL HA 2.859 . 3.881 3.584 3.494 3.795 . 0 0 "[ . 1 . 2]" 1
1147 1 49 VAL HA 1 49 VAL MG1 2.177 . 2.769 2.235 2.195 2.255 . 0 0 "[ . 1 . 2]" 1
1148 1 49 VAL HA 1 50 LEU H 1.984 . 2.476 2.106 2.064 2.150 . 0 0 "[ . 1 . 2]" 1
1149 1 27 VAL HA 1 49 VAL HA 2.345 . 3.033 2.125 2.039 2.184 . 0 0 "[ . 1 . 2]" 1
1150 1 58 THR HA 1 58 THR MG 2.125 . 2.690 2.407 2.377 2.434 . 0 0 "[ . 1 . 2]" 1
1151 1 58 THR HA 1 58 THR HB 2.839 . 3.847 3.020 3.017 3.024 . 0 0 "[ . 1 . 2]" 1
1152 1 58 THR HA 1 59 ILE H 1.987 . 2.481 2.127 2.088 2.154 . 0 0 "[ . 1 . 2]" 1
1153 1 58 THR H 1 58 THR HA 2.659 . 3.543 2.934 2.904 2.944 . 0 0 "[ . 1 . 2]" 1
1154 1 69 ILE HA 1 69 ILE HB 2.702 . 3.615 3.018 3.011 3.023 . 0 0 "[ . 1 . 2]" 1
1155 1 69 ILE HA 1 69 ILE HG12 2.627 . 3.489 2.597 2.551 2.646 . 0 0 "[ . 1 . 2]" 1
1156 1 69 ILE HA 1 69 ILE MG 2.123 . 2.686 2.303 2.257 2.344 . 0 0 "[ . 1 . 2]" 1
1157 1 21 LEU H 1 39 LEU MD1 2.457 . 3.212 2.679 2.508 2.884 . 0 0 "[ . 1 . 2]" 1
1158 1 13 ASN HA 1 14 ALA MB 2.923 . 3.991 4.016 3.962 4.121 0.130 4 0 "[ . 1 . 2]" 1
1159 1 13 ASN HA 1 14 ALA H 2.097 . 2.647 2.301 2.183 2.507 . 0 0 "[ . 1 . 2]" 1
1160 1 13 ASN HA 1 44 PHE QE 2.864 . 3.889 3.485 3.254 3.783 . 0 0 "[ . 1 . 2]" 1
1161 1 32 GLY HA2 1 33 GLN H 2.880 . 3.917 3.146 2.991 3.243 . 0 0 "[ . 1 . 2]" 1
1162 1 56 SER HA 1 70 GLY HA2 2.600 . 3.445 3.457 3.324 3.506 0.061 17 0 "[ . 1 . 2]" 1
1163 1 56 SER HA 1 56 SER HB3 2.216 . 2.830 2.473 2.308 3.031 0.201 19 0 "[ . 1 . 2]" 1
1164 1 56 SER HA 1 57 VAL MG2 2.580 . 3.412 3.264 2.957 3.404 . 0 0 "[ . 1 . 2]" 1
1165 1 56 SER HA 1 57 VAL H 2.072 . 2.609 2.202 2.131 2.293 . 0 0 "[ . 1 . 2]" 1
1166 1 24 SER HA 1 24 SER HB3 2.453 . 3.205 2.758 2.400 3.033 . 0 0 "[ . 1 . 2]" 1
1167 1 24 SER HA 1 24 SER HB2 2.385 . 3.096 2.753 2.476 3.030 . 0 0 "[ . 1 . 2]" 1
1168 1 24 SER HA 1 25 VAL MG1 2.856 . 3.876 3.490 3.395 3.601 . 0 0 "[ . 1 . 2]" 1
1169 1 24 SER HA 1 25 VAL H 1.979 . 2.469 2.172 2.142 2.200 . 0 0 "[ . 1 . 2]" 1
1170 1 47 GLU H 1 47 GLU HG2 2.754 . 3.702 3.391 3.218 3.517 . 0 0 "[ . 1 . 2]" 1
1171 1 67 VAL H 1 67 VAL HB 2.661 . 3.546 3.265 2.504 3.744 0.198 11 0 "[ . 1 . 2]" 1
1172 1 76 GLU HG3 1 78 THR MG 2.709 . 3.626 3.634 2.016 3.889 0.263 1 0 "[ . 1 . 2]" 1
1173 1 84 THR HB 1 84 THR MG 2.164 . 2.750 2.134 2.129 2.137 . 0 0 "[ . 1 . 2]" 1
1174 1 82 TYR QE 1 84 THR MG 2.890 . 3.934 2.728 2.448 2.901 . 0 0 "[ . 1 . 2]" 1
1175 1 61 PHE HB3 1 63 ASP H 2.798 . 3.777 2.587 2.497 2.698 . 0 0 "[ . 1 . 2]" 1
1176 1 80 GLU H 1 80 GLU HB3 2.646 . 3.521 3.460 2.447 3.591 0.070 2 0 "[ . 1 . 2]" 1
1177 1 43 ILE MD 1 59 ILE MG 2.874 . 3.907 3.446 3.342 3.586 . 0 0 "[ . 1 . 2]" 1
1178 1 43 ILE MD 1 77 MET ME 2.772 . 3.733 3.356 3.166 3.636 . 0 0 "[ . 1 . 2]" 1
1179 1 43 ILE HA 1 43 ILE MD 2.413 . 3.141 1.991 1.963 2.019 . 0 0 "[ . 1 . 2]" 1
1180 1 43 ILE MD 1 43 ILE HG12 2.117 . 2.677 2.115 2.113 2.116 . 0 0 "[ . 1 . 2]" 1
1181 1 43 ILE MD 1 44 PHE H 2.750 . 3.695 3.379 3.330 3.430 . 0 0 "[ . 1 . 2]" 1
1182 1 80 GLU HB2 1 80 GLU HG2 2.051 . 2.577 2.756 2.432 3.009 0.432 5 0 "[ . 1 . 2]" 1
1183 1 58 THR HA 1 68 VAL HA 2.890 . 3.934 2.384 2.168 2.551 . 0 0 "[ . 1 . 2]" 1
1184 1 69 ILE MG 1 70 GLY HA2 3.015 . 4.152 4.085 3.948 4.186 0.034 5 0 "[ . 1 . 2]" 1
1185 1 69 ILE MG 1 70 GLY HA3 3.092 . 4.287 3.953 3.820 4.067 . 0 0 "[ . 1 . 2]" 1
1186 1 21 LEU HA 1 57 VAL HA 2.309 . 2.975 2.059 2.000 2.152 . 0 0 "[ . 1 . 2]" 1
1187 1 77 MET HA 1 78 THR HA 4.049 . 6.098 4.414 4.379 4.432 . 0 0 "[ . 1 . 2]" 1
1188 1 19 THR HA 1 19 THR HB 2.165 . 2.751 2.491 2.471 2.508 . 0 0 "[ . 1 . 2]" 1
1189 1 65 THR HA 1 65 THR HB 2.583 . 3.417 2.595 2.537 2.648 . 0 0 "[ . 1 . 2]" 1
1190 1 18 ILE HA 1 59 ILE HA 2.309 . 2.975 2.569 2.496 2.655 . 0 0 "[ . 1 . 2]" 1
1191 1 81 ILE MG 1 82 TYR HB3 2.986 . 4.101 3.636 3.483 3.882 . 0 0 "[ . 1 . 2]" 1
1192 1 58 THR HA 1 68 VAL QG 3.072 . 4.251 3.218 2.529 3.599 . 0 0 "[ . 1 . 2]" 1
1193 1 68 VAL QG 1 69 ILE HA 3.294 . 4.650 3.567 3.470 3.809 . 0 0 "[ . 1 . 2]" 1
1194 1 56 SER HB3 1 68 VAL QG 3.085 . 4.275 3.493 3.202 4.546 0.271 16 0 "[ . 1 . 2]" 1
1195 1 57 VAL H 1 68 VAL QG 3.192 . 4.466 3.044 2.851 3.317 . 0 0 "[ . 1 . 2]" 1
1196 1 62 VAL HB 1 62 VAL MG1 2.004 . 2.506 2.115 2.111 2.117 . 0 0 "[ . 1 . 2]" 1
1197 1 62 VAL HA 1 62 VAL MG1 2.557 . 3.374 3.201 3.196 3.206 . 0 0 "[ . 1 . 2]" 1
1198 1 61 PHE HA 1 62 VAL MG1 2.980 . 4.090 4.152 4.118 4.177 0.087 15 0 "[ . 1 . 2]" 1
1199 1 62 VAL MG1 1 82 TYR QE 2.747 . 3.691 2.964 2.852 3.062 . 0 0 "[ . 1 . 2]" 1
1200 1 62 VAL MG1 1 63 ASP H 2.703 . 3.617 2.907 2.698 3.095 . 0 0 "[ . 1 . 2]" 1
1201 1 62 VAL H 1 62 VAL MG1 2.074 . 2.611 2.237 2.192 2.291 . 0 0 "[ . 1 . 2]" 1
1202 1 61 PHE HB3 1 62 VAL MG1 3.007 . 4.137 3.853 3.694 3.970 . 0 0 "[ . 1 . 2]" 1
1203 1 62 VAL MG1 1 63 ASP HB2 3.097 . 4.296 3.611 3.414 3.836 . 0 0 "[ . 1 . 2]" 1
1204 1 15 ILE MD 1 15 ILE MG 1.719 . 2.089 1.814 1.793 1.843 . 0 0 "[ . 1 . 2]" 1
1205 1 16 GLY HA2 1 62 VAL H 2.770 . 3.729 2.498 2.403 2.596 . 0 0 "[ . 1 . 2]" 1
1206 1 46 GLY HA2 1 47 GLU H 2.964 . 4.062 3.316 3.218 3.416 . 0 0 "[ . 1 . 2]" 1
1207 1 35 ARG HE 1 35 ARG HG3 3.131 . 4.356 2.953 2.435 3.850 . 0 0 "[ . 1 . 2]" 1
1208 1 81 ILE MG 1 82 TYR QD 3.137 . 4.367 4.248 4.159 4.401 0.034 19 0 "[ . 1 . 2]" 1
1209 1 61 PHE HB3 1 82 TYR QE 3.017 . 4.155 2.451 2.259 2.684 . 0 0 "[ . 1 . 2]" 1
1210 1 61 PHE HB2 1 61 PHE QE 3.289 . 4.641 4.372 4.358 4.398 . 0 0 "[ . 1 . 2]" 1
1211 1 61 PHE HB3 1 61 PHE QE 3.229 . 4.532 4.444 4.421 4.465 . 0 0 "[ . 1 . 2]" 1
1212 1 61 PHE HB3 1 64 GLY H 3.730 . 5.470 3.969 3.842 4.195 . 0 0 "[ . 1 . 2]" 1
1213 1 15 ILE MD 1 45 PHE HB3 3.035 . 4.187 3.903 3.765 4.073 . 0 0 "[ . 1 . 2]" 1
1214 1 15 ILE MG 1 45 PHE HB3 2.538 . 3.343 3.349 3.305 3.372 0.029 17 0 "[ . 1 . 2]" 1
1215 1 14 ALA HA 1 15 ILE MG 3.082 . 4.270 3.396 3.298 3.477 . 0 0 "[ . 1 . 2]" 1
1216 1 14 ALA MB 1 42 PRO HG2 3.065 . 4.239 4.140 3.824 4.278 0.039 16 0 "[ . 1 . 2]" 1
1217 1 14 ALA MB 1 44 PHE QE 2.396 . 3.113 2.683 2.470 2.824 . 0 0 "[ . 1 . 2]" 1
1218 1 14 ALA HA 1 42 PRO QB 3.538 . 5.103 3.772 3.592 3.951 . 0 0 "[ . 1 . 2]" 1
1219 1 42 PRO QB 1 42 PRO HD2 3.167 . 4.421 3.497 3.459 3.512 . 0 0 "[ . 1 . 2]" 1
1220 1 17 PHE HA 1 42 PRO QB 3.760 . 5.527 4.281 3.969 4.428 . 0 0 "[ . 1 . 2]" 1
1221 1 17 PHE QE 1 42 PRO QB 2.621 . 3.480 1.984 1.904 2.089 . 0 0 "[ . 1 . 2]" 1
1222 1 17 PHE HB3 1 19 THR MG 3.092 . 4.287 4.061 3.956 4.214 . 0 0 "[ . 1 . 2]" 1
1223 1 17 PHE HB2 1 60 ALA MB 3.060 . 4.231 3.489 3.297 3.630 . 0 0 "[ . 1 . 2]" 1
1224 1 17 PHE HB3 1 60 ALA MB 3.347 . 4.748 4.731 4.566 4.787 0.039 19 0 "[ . 1 . 2]" 1
1225 1 14 ALA MB 1 42 PRO HG3 3.008 . 4.139 4.136 3.829 4.274 0.135 11 0 "[ . 1 . 2]" 1
1226 1 37 LEU QD 1 38 LYS H 2.613 . 3.467 3.127 2.839 3.433 . 0 0 "[ . 1 . 2]" 1
1227 1 59 ILE H 1 77 MET ME 3.768 2.433 5.103 5.174 5.112 5.214 0.111 3 0 "[ . 1 . 2]" 1
1228 1 77 MET ME 1 78 THR H 3.159 . 4.407 4.406 4.208 4.489 0.082 5 0 "[ . 1 . 2]" 1
1229 1 35 ARG HD3 1 37 LEU QD 3.082 . 4.269 3.891 3.434 4.478 0.209 3 0 "[ . 1 . 2]" 1
1230 1 27 VAL HA 1 49 VAL MG1 3.013 . 4.147 3.416 3.252 3.495 . 0 0 "[ . 1 . 2]" 1
1231 1 75 VAL H 1 75 VAL MG2 2.960 . 4.055 3.709 2.149 4.010 . 0 0 "[ . 1 . 2]" 1
1232 1 18 ILE HA 1 20 LYS H 2.659 . 3.543 3.551 3.484 3.586 0.043 1 0 "[ . 1 . 2]" 1
1233 1 17 PHE QD 1 62 VAL MG2 2.573 . 3.400 3.581 3.506 3.651 0.251 5 0 "[ . 1 . 2]" 1
1234 1 78 THR H 1 78 THR MG 2.483 . 3.254 2.952 2.692 3.201 . 0 0 "[ . 1 . 2]" 1
1235 1 27 VAL HA 1 37 LEU QD 3.618 . 5.254 3.959 3.880 4.075 . 0 0 "[ . 1 . 2]" 1
1236 1 26 THR HA 1 37 LEU QD 3.514 . 4.625 3.947 3.761 4.086 . 0 0 "[ . 1 . 2]" 1
1237 1 59 ILE MG 1 60 ALA MB 3.199 . 4.478 4.220 4.126 4.314 . 0 0 "[ . 1 . 2]" 1
1238 1 17 PHE QD 1 60 ALA MB 3.396 . 4.838 4.384 4.185 4.629 . 0 0 "[ . 1 . 2]" 1
1239 1 47 GLU HB2 1 47 GLU HG2 2.277 . 2.925 2.982 2.978 2.986 0.061 11 0 "[ . 1 . 2]" 1
1240 1 47 GLU HB2 1 47 GLU HG3 2.330 . 3.008 2.422 2.381 2.487 . 0 0 "[ . 1 . 2]" 1
1241 1 44 PHE HB3 1 47 GLU HG2 3.584 . 5.189 4.695 4.473 4.829 . 0 0 "[ . 1 . 2]" 1
1242 1 30 ILE H 1 47 GLU HG3 3.590 . 5.201 4.347 4.011 4.551 . 0 0 "[ . 1 . 2]" 1
1243 1 44 PHE H 1 47 GLU HG2 3.544 . 5.114 4.249 3.947 4.421 . 0 0 "[ . 1 . 2]" 1
1244 1 47 GLU HG2 1 48 THR H 3.321 . 4.700 4.310 4.218 4.430 . 0 0 "[ . 1 . 2]" 1
1245 1 51 THR HG1 1 71 GLY HA2 3.101 . 4.303 2.303 2.240 2.648 . 0 0 "[ . 1 . 2]" 1
1246 1 51 THR HB 1 51 THR HG1 2.435 . 3.176 2.341 2.257 2.640 . 0 0 "[ . 1 . 2]" 1
1247 1 28 GLN HE21 1 28 GLN HG2 3.068 . 4.245 3.793 3.482 4.035 . 0 0 "[ . 1 . 2]" 1
1248 1 28 GLN HE21 1 28 GLN HG3 3.119 . 4.335 3.495 3.460 3.766 . 0 0 "[ . 1 . 2]" 1
1249 1 33 GLN HE21 1 33 GLN QG 3.324 . 4.705 3.355 3.212 3.493 . 0 0 "[ . 1 . 2]" 1
1250 1 28 GLN H 1 28 GLN HG2 3.385 . 4.817 4.481 4.428 4.535 . 0 0 "[ . 1 . 2]" 1
1251 1 28 GLN HG2 1 48 THR HB 3.450 . 4.938 4.549 4.402 4.626 . 0 0 "[ . 1 . 2]" 1
1252 1 28 GLN HG3 1 34 GLU HA 3.384 . 4.815 3.033 2.856 3.345 . 0 0 "[ . 1 . 2]" 1
1253 1 28 GLN HG2 1 34 GLU HA 3.166 . 4.419 3.652 3.473 3.865 . 0 0 "[ . 1 . 2]" 1
1254 1 58 THR HB 1 59 ILE H 3.212 . 4.501 4.360 4.301 4.397 . 0 0 "[ . 1 . 2]" 1
1255 1 58 THR H 1 58 THR HB 2.342 . 3.028 2.551 2.489 2.623 . 0 0 "[ . 1 . 2]" 1
1256 1 20 LYS H 1 58 THR HB 2.444 . 3.190 2.247 2.122 2.371 . 0 0 "[ . 1 . 2]" 1
1257 1 57 VAL HA 1 58 THR HB 3.261 . 4.591 4.590 4.560 4.623 0.032 8 0 "[ . 1 . 2]" 1
1258 1 58 THR HB 1 58 THR MG 2.035 . 2.553 2.129 2.122 2.133 . 0 0 "[ . 1 . 2]" 1
1259 1 20 LYS QB 1 58 THR HB 2.050 . 2.575 1.804 1.739 1.885 . 0 0 "[ . 1 . 2]" 1
1260 1 51 THR HB 1 72 ASP H 3.341 . 4.737 3.046 2.766 3.407 . 0 0 "[ . 1 . 2]" 1
1261 1 51 THR H 1 51 THR HB 3.149 . 4.389 3.735 3.714 3.790 . 0 0 "[ . 1 . 2]" 1
1262 1 51 THR HB 1 73 SER H 3.200 . 4.480 3.596 3.475 3.727 . 0 0 "[ . 1 . 2]" 1
1263 1 48 THR H 1 48 THR HB 2.417 . 3.147 2.595 2.524 2.650 . 0 0 "[ . 1 . 2]" 1
1264 1 28 GLN H 1 48 THR HB 2.832 . 3.834 2.929 2.763 3.134 . 0 0 "[ . 1 . 2]" 1
1265 1 48 THR HB 1 49 VAL H 3.413 . 4.869 4.315 4.284 4.340 . 0 0 "[ . 1 . 2]" 1
1266 1 27 VAL HA 1 48 THR HB 3.580 . 5.182 4.725 4.556 4.973 . 0 0 "[ . 1 . 2]" 1
1267 1 48 THR HB 1 50 LEU MD1 2.656 . 3.538 3.400 3.197 3.567 0.029 3 0 "[ . 1 . 2]" 1
1268 1 48 THR HB 1 48 THR MG 2.101 . 2.653 2.128 2.126 2.131 . 0 0 "[ . 1 . 2]" 1
1269 1 28 GLN HB3 1 48 THR HB 2.394 . 3.110 2.420 2.315 2.467 . 0 0 "[ . 1 . 2]" 1
1270 1 28 GLN HB2 1 48 THR HB 2.327 . 3.004 1.933 1.858 2.005 . 0 0 "[ . 1 . 2]" 1
1271 1 28 GLN HG3 1 48 THR HB 3.047 . 4.208 4.322 4.277 4.362 0.154 18 0 "[ . 1 . 2]" 1
1272 1 78 THR HB 1 79 ASP H 2.248 . 2.880 1.764 1.693 1.876 . 0 0 "[ . 1 . 2]" 1
1273 1 78 THR HB 1 80 GLU H 2.829 . 3.829 2.948 2.627 3.151 . 0 0 "[ . 1 . 2]" 1
1274 1 45 PHE HZ 1 78 THR HB 3.294 . 4.650 4.567 4.305 4.699 0.049 16 0 "[ . 1 . 2]" 1
1275 1 78 THR H 1 78 THR HB 3.168 . 4.422 3.666 3.580 3.760 . 0 0 "[ . 1 . 2]" 1
1276 1 78 THR HB 1 81 ILE H 3.652 . 5.319 4.086 3.886 4.349 . 0 0 "[ . 1 . 2]" 1
1277 1 78 THR HB 1 80 GLU HB2 3.132 . 4.358 4.287 3.810 4.914 0.556 15 1 "[ . 1 + 2]" 1
1278 1 78 THR HB 1 78 THR MG 2.089 . 2.635 2.135 2.132 2.137 . 0 0 "[ . 1 . 2]" 1
1279 1 61 PHE QD 1 65 THR HB 3.241 . 4.554 3.165 2.571 3.585 . 0 0 "[ . 1 . 2]" 1
1280 1 65 THR HB 1 65 THR MG 2.080 . 2.621 2.133 2.130 2.136 . 0 0 "[ . 1 . 2]" 1
1281 1 61 PHE HB2 1 65 THR HB 3.168 . 4.423 3.702 3.541 3.819 . 0 0 "[ . 1 . 2]" 1
1282 1 61 PHE HB3 1 65 THR HB 3.617 . 5.252 5.139 4.930 5.270 0.018 12 0 "[ . 1 . 2]" 1
1283 1 65 THR HB 1 66 ASP HA 3.677 . 5.367 4.231 4.098 4.361 . 0 0 "[ . 1 . 2]" 1
1284 1 26 THR HB 1 26 THR MG 2.157 . 2.739 2.133 2.130 2.138 . 0 0 "[ . 1 . 2]" 1
1285 1 26 THR HB 1 50 LEU MD1 2.767 . 3.724 2.276 2.218 2.344 . 0 0 "[ . 1 . 2]" 1
1286 1 26 THR HB 1 34 GLU HG2 2.728 . 3.658 3.018 1.991 3.634 . 0 0 "[ . 1 . 2]" 1
1287 1 26 THR HB 1 34 GLU HG3 2.737 . 3.673 2.388 2.054 3.073 . 0 0 "[ . 1 . 2]" 1
1288 1 26 THR HB 1 34 GLU HB2 3.016 . 4.153 4.460 4.224 4.942 0.789 1 6 "[+ . 1 *-*.** 2]" 1
1289 1 26 THR HB 1 50 LEU HB2 2.586 . 3.422 2.656 2.579 2.793 . 0 0 "[ . 1 . 2]" 1
1290 1 26 THR HB 1 50 LEU HB3 3.008 . 4.139 4.248 4.203 4.300 0.161 16 0 "[ . 1 . 2]" 1
1291 1 26 THR HB 1 27 VAL HA 3.349 . 4.751 3.918 3.841 3.988 . 0 0 "[ . 1 . 2]" 1
1292 1 26 THR HB 1 50 LEU H 2.960 . 4.055 3.832 3.680 4.101 0.046 12 0 "[ . 1 . 2]" 1
1293 1 13 ASN HA 1 13 ASN HB3 2.239 . 2.865 2.500 2.339 2.996 0.131 10 0 "[ . 1 . 2]" 1
1294 1 13 ASN HA 1 13 ASN HB2 2.421 . 3.154 2.832 2.425 3.031 . 0 0 "[ . 1 . 2]" 1
1295 1 13 ASN HA 1 13 ASN HD22 3.804 . 5.612 3.868 1.922 4.540 0.074 7 0 "[ . 1 . 2]" 1
1296 1 13 ASN HB2 1 14 ALA MB 3.550 . 5.125 4.930 4.123 5.547 0.422 10 0 "[ . 1 . 2]" 1
1297 1 13 ASN HB3 1 13 ASN HD22 3.096 . 4.294 2.703 2.201 3.460 . 0 0 "[ . 1 . 2]" 1
1298 1 13 ASN HB2 1 13 ASN HD22 2.992 . 4.111 2.708 2.210 3.531 . 0 0 "[ . 1 . 2]" 1
1299 1 13 ASN HB2 1 14 ALA H 2.904 . 3.958 3.447 2.405 3.948 . 0 0 "[ . 1 . 2]" 1
1300 1 14 ALA HA 1 45 PHE H 3.559 . 5.143 4.209 4.103 4.305 . 0 0 "[ . 1 . 2]" 1
1301 1 17 PHE QE 1 62 VAL MG1 3.026 . 4.171 4.070 3.885 4.182 0.011 9 0 "[ . 1 . 2]" 1
1302 1 25 VAL HA 1 25 VAL MG1 3.466 . 4.968 2.497 2.465 2.525 . 0 0 "[ . 1 . 2]" 1
1303 1 49 VAL MG2 1 77 MET HG3 2.900 . 3.951 3.415 3.248 3.744 . 0 0 "[ . 1 . 2]" 1
1304 1 49 VAL MG2 1 77 MET HG2 2.728 . 3.658 2.791 2.641 2.956 . 0 0 "[ . 1 . 2]" 1
1305 1 25 VAL MG1 1 55 GLY H 3.879 . 5.760 4.905 4.399 5.313 . 0 0 "[ . 1 . 2]" 1
1306 1 53 GLY HA2 1 72 ASP H 3.104 . 4.308 4.263 3.839 4.427 0.119 2 0 "[ . 1 . 2]" 1
1307 1 56 SER H 1 56 SER HB2 3.094 . 4.290 2.925 2.550 3.416 . 0 0 "[ . 1 . 2]" 1
1308 1 22 ASP QB 1 56 SER HB3 2.998 . 4.122 3.583 1.969 4.049 . 0 0 "[ . 1 . 2]" 1
1309 1 22 ASP QB 1 56 SER HB2 3.008 . 4.139 2.311 1.860 4.058 0.033 9 0 "[ . 1 . 2]" 1
1310 1 56 SER HB2 1 68 VAL QG 3.250 . 4.570 4.579 4.272 4.657 0.087 4 0 "[ . 1 . 2]" 1
1311 1 67 VAL HA 1 68 VAL HB 3.081 . 4.268 4.347 4.309 4.446 0.178 8 0 "[ . 1 . 2]" 1
1312 1 66 ASP QB 1 67 VAL HA 3.325 . 4.707 4.087 3.821 4.483 . 0 0 "[ . 1 . 2]" 1
1313 1 15 ILE HB 1 61 PHE QE 3.407 . 4.858 4.167 3.852 4.678 . 0 0 "[ . 1 . 2]" 1
1314 1 18 ILE HB 1 40 GLY H 2.103 . 2.656 1.947 1.669 2.086 . 0 0 "[ . 1 . 2]" 1
1315 1 80 GLU HB3 1 81 ILE H 3.046 . 4.206 3.702 2.797 3.976 . 0 0 "[ . 1 . 2]" 1
1316 1 80 GLU HB2 1 81 ILE H 3.029 . 4.176 3.002 2.707 4.032 . 0 0 "[ . 1 . 2]" 1
1317 1 21 LEU MD1 1 39 LEU H 2.750 . 3.695 3.602 3.291 3.739 0.044 18 0 "[ . 1 . 2]" 1
1318 1 83 ASN HB3 1 83 ASN HD21 3.183 . 4.450 3.881 3.462 4.072 . 0 0 "[ . 1 . 2]" 1
1319 1 83 ASN HB2 1 83 ASN HD21 3.166 . 4.419 3.596 3.446 4.053 . 0 0 "[ . 1 . 2]" 1
1320 1 47 GLU HA 1 48 THR H 2.149 . 2.726 2.196 2.107 2.257 . 0 0 "[ . 1 . 2]" 1
1321 1 15 ILE HG12 1 61 PHE QE 3.001 . 4.127 3.897 3.636 4.147 0.020 9 0 "[ . 1 . 2]" 1
1322 1 50 LEU H 1 50 LEU MD2 3.392 . 4.830 4.306 4.177 4.372 . 0 0 "[ . 1 . 2]" 1
1323 1 38 LYS QD 1 38 LYS QE 2.016 . 2.524 2.030 1.995 2.085 . 0 0 "[ . 1 . 2]" 1
1324 1 38 LYS QE 1 38 LYS HG2 2.765 . 3.721 2.580 2.321 3.481 . 0 0 "[ . 1 . 2]" 1
1325 1 38 LYS QE 1 38 LYS HG3 2.670 . 3.561 2.590 2.209 2.896 . 0 0 "[ . 1 . 2]" 1
1326 1 38 LYS H 1 38 LYS QE 3.726 . 5.461 4.808 3.545 5.263 . 0 0 "[ . 1 . 2]" 1
1327 1 78 THR H 1 81 ILE HG12 3.320 . 4.697 3.358 3.190 3.652 . 0 0 "[ . 1 . 2]" 1
1328 1 61 PHE HZ 1 81 ILE HG13 3.557 . 5.139 5.071 4.980 5.164 0.025 19 0 "[ . 1 . 2]" 1
1329 1 61 PHE HZ 1 81 ILE HG12 3.769 . 5.544 5.586 5.468 5.696 0.152 14 0 "[ . 1 . 2]" 1
1330 1 45 PHE HZ 1 79 ASP HA 2.862 . 3.886 2.243 1.975 2.637 . 0 0 "[ . 1 . 2]" 1
1331 1 25 VAL HA 1 25 VAL HB 2.843 . 3.853 2.352 2.333 2.372 . 0 0 "[ . 1 . 2]" 1
1332 1 48 THR MG 1 76 GLU HB2 2.224 . 2.842 2.782 2.643 3.104 0.262 14 0 "[ . 1 . 2]" 1
1333 1 18 ILE HG13 1 41 ASP QB 3.096 . 4.294 2.659 2.380 3.288 . 0 0 "[ . 1 . 2]" 1
1334 1 20 LYS HD3 1 21 LEU H 3.253 . 4.576 4.385 1.973 5.059 0.483 10 0 "[ . 1 . 2]" 1
1335 1 31 ASN HB3 1 31 ASN QD 3.102 . 4.304 2.838 2.195 3.261 . 0 0 "[ . 1 . 2]" 1
1336 1 28 GLN HE21 1 50 LEU MD2 3.183 . 4.449 3.128 2.374 3.863 . 0 0 "[ . 1 . 2]" 1
1337 1 28 GLN HE22 1 50 LEU MD2 3.278 . 4.622 3.254 2.121 4.535 . 0 0 "[ . 1 . 2]" 1
1338 1 28 GLN HE22 1 50 LEU MD1 3.028 . 4.174 3.051 1.980 4.215 0.041 13 0 "[ . 1 . 2]" 1
1339 1 28 GLN HE21 1 50 LEU MD1 3.162 . 4.412 3.738 3.236 4.254 . 0 0 "[ . 1 . 2]" 1
1340 1 76 GLU H 1 76 GLU HG2 3.453 2.363 4.543 4.370 2.956 4.517 . 0 0 "[ . 1 . 2]" 1
1341 1 43 ILE MG 1 61 PHE QE 2.891 . 3.936 2.973 2.800 3.139 . 0 0 "[ . 1 . 2]" 1
1342 1 37 LEU HB2 1 38 LYS H 3.088 . 4.280 4.020 3.631 4.301 0.021 3 0 "[ . 1 . 2]" 1
1343 1 37 LEU HB3 1 38 LYS H 2.944 . 4.028 2.910 2.375 3.457 . 0 0 "[ . 1 . 2]" 1
1344 1 23 GLY HA3 1 25 VAL MG1 3.193 . 4.468 3.920 3.723 4.148 . 0 0 "[ . 1 . 2]" 1
1345 1 51 THR HB 1 71 GLY HA2 3.172 . 4.430 2.521 2.005 3.091 . 0 0 "[ . 1 . 2]" 1
1346 1 77 MET HB3 1 77 MET ME 2.954 . 4.045 2.605 2.204 3.961 . 0 0 "[ . 1 . 2]" 1
1347 1 69 ILE HB 1 70 GLY H 3.498 . 5.028 3.949 3.797 4.045 . 0 0 "[ . 1 . 2]" 1
1348 1 22 ASP H 1 22 ASP HA 2.598 . 3.442 2.913 2.890 2.937 . 0 0 "[ . 1 . 2]" 1
1349 1 28 GLN HB2 1 48 THR H 3.339 . 4.733 3.385 3.208 3.548 . 0 0 "[ . 1 . 2]" 1
1350 1 28 GLN HB3 1 48 THR H 3.040 . 4.195 3.289 2.971 3.463 . 0 0 "[ . 1 . 2]" 1
1351 1 15 ILE MD 1 45 PHE H 3.074 . 4.255 3.227 3.080 3.393 . 0 0 "[ . 1 . 2]" 1
1352 1 15 ILE MD 1 46 GLY H 3.074 . 4.255 3.553 3.428 3.667 . 0 0 "[ . 1 . 2]" 1
1353 1 49 VAL HA 1 49 VAL HB 2.601 . 3.447 3.001 2.987 3.008 . 0 0 "[ . 1 . 2]" 1
1354 1 21 LEU HB3 1 22 ASP H 3.087 . 4.278 4.041 3.976 4.112 . 0 0 "[ . 1 . 2]" 1
1355 1 57 VAL H 1 57 VAL HB 2.960 . 4.055 2.931 2.844 3.029 . 0 0 "[ . 1 . 2]" 1
1356 1 57 VAL HB 1 58 THR H 2.976 . 4.083 3.914 3.741 4.104 0.021 7 0 "[ . 1 . 2]" 1
1357 1 27 VAL HB 1 28 GLN H 3.261 . 4.590 4.268 4.202 4.349 . 0 0 "[ . 1 . 2]" 1
1358 1 27 VAL HB 1 35 ARG H 3.307 . 4.674 4.713 4.622 4.746 0.072 9 0 "[ . 1 . 2]" 1
1359 1 59 ILE MG 1 61 PHE QE 2.551 . 3.365 2.918 2.537 3.203 . 0 0 "[ . 1 . 2]" 1
1360 1 84 THR HB 1 85 GLY H 3.545 . 5.116 3.185 2.680 3.561 . 0 0 "[ . 1 . 2]" 1
1361 1 84 THR H 1 84 THR HB 3.409 . 4.862 3.588 3.548 3.627 . 0 0 "[ . 1 . 2]" 1
1362 1 59 ILE HG12 1 60 ALA H 3.320 . 4.698 4.623 4.521 4.716 0.018 5 0 "[ . 1 . 2]" 1
1363 1 59 ILE H 1 59 ILE HG12 3.159 . 4.406 3.928 3.869 3.975 . 0 0 "[ . 1 . 2]" 1
1364 1 35 ARG HE 1 37 LEU QD 2.937 . 4.015 2.683 2.068 4.032 0.017 12 0 "[ . 1 . 2]" 1
1365 1 27 VAL H 1 35 ARG HG2 3.458 . 4.952 3.366 3.187 3.767 . 0 0 "[ . 1 . 2]" 1
1366 1 21 LEU HB3 1 39 LEU HA 3.259 . 4.587 3.786 3.644 3.980 . 0 0 "[ . 1 . 2]" 1
1367 1 20 LYS HA 1 21 LEU HB3 3.365 . 4.781 4.298 4.199 4.418 . 0 0 "[ . 1 . 2]" 1
1368 1 21 LEU HB3 1 57 VAL HA 3.341 . 4.736 4.819 4.782 4.860 0.124 17 0 "[ . 1 . 2]" 1
1369 1 27 VAL MG1 1 35 ARG HB3 2.869 . 3.898 3.431 2.229 3.922 0.024 6 0 "[ . 1 . 2]" 1
1370 1 27 VAL H 1 34 GLU HG3 3.115 . 4.328 3.648 3.262 4.140 . 0 0 "[ . 1 . 2]" 1
1371 1 34 GLU HG2 1 35 ARG H 3.143 . 4.377 3.498 3.182 3.743 . 0 0 "[ . 1 . 2]" 1
1372 1 27 VAL H 1 34 GLU HG2 2.987 . 4.102 3.935 3.377 4.183 0.081 10 0 "[ . 1 . 2]" 1
1373 1 17 PHE H 1 61 PHE HA 2.987 . 4.102 3.391 3.252 3.514 . 0 0 "[ . 1 . 2]" 1
1374 1 61 PHE HA 1 63 ASP H 3.331 . 4.718 3.891 3.729 4.036 . 0 0 "[ . 1 . 2]" 1
1375 1 27 VAL HB 1 35 ARG HG2 2.824 . 3.821 3.941 3.689 4.026 0.205 3 0 "[ . 1 . 2]" 1
1376 1 44 PHE H 1 47 GLU HB3 3.583 . 5.188 4.652 4.453 4.873 . 0 0 "[ . 1 . 2]" 1
1377 1 29 SER HB2 1 33 GLN H 3.289 . 4.641 3.593 2.973 4.585 . 0 0 "[ . 1 . 2]" 1
1378 1 29 SER HB3 1 33 GLN H 3.230 . 4.534 4.421 2.951 4.685 0.151 17 0 "[ . 1 . 2]" 1
1379 1 26 THR H 1 50 LEU HB2 3.002 . 4.129 3.322 2.927 3.492 . 0 0 "[ . 1 . 2]" 1
1380 1 49 VAL HB 1 75 VAL H 3.130 . 4.355 3.232 2.999 3.477 . 0 0 "[ . 1 . 2]" 1
1381 1 68 VAL HB 1 69 ILE H 3.458 . 4.953 4.156 4.083 4.208 . 0 0 "[ . 1 . 2]" 1
1382 1 45 PHE QD 1 46 GLY HA3 3.567 . 5.158 3.901 3.660 4.083 . 0 0 "[ . 1 . 2]" 1
1383 1 46 GLY HA3 1 76 GLU HG3 3.415 . 4.873 4.831 4.521 5.223 0.350 1 0 "[ . 1 . 2]" 1
1384 1 39 LEU HG 1 40 GLY H 3.086 . 4.276 2.301 2.136 2.463 . 0 0 "[ . 1 . 2]" 1
1385 1 24 SER HB2 1 25 VAL H 3.299 . 4.660 4.327 4.196 4.524 . 0 0 "[ . 1 . 2]" 1
1386 1 46 GLY H 1 77 MET HG3 3.251 . 4.572 4.433 3.979 4.591 0.019 13 0 "[ . 1 . 2]" 1
1387 1 46 GLY H 1 77 MET HG2 3.365 . 4.780 4.247 4.053 4.790 0.010 9 0 "[ . 1 . 2]" 1
1388 1 47 GLU H 1 77 MET HG3 3.246 . 4.563 3.834 3.499 3.957 . 0 0 "[ . 1 . 2]" 1
1389 1 47 GLU H 1 77 MET HB2 3.166 . 4.419 2.383 2.177 2.488 . 0 0 "[ . 1 . 2]" 1
1390 1 46 GLY HA3 1 77 MET HB2 3.754 . 5.515 4.789 4.545 4.894 . 0 0 "[ . 1 . 2]" 1
1391 1 45 PHE HA 1 77 MET HG3 3.372 . 4.793 4.688 4.238 4.838 0.045 6 0 "[ . 1 . 2]" 1
1392 1 77 MET HA 1 77 MET HG3 3.523 . 5.075 3.726 3.697 3.758 . 0 0 "[ . 1 . 2]" 1
1393 1 44 PHE H 1 47 GLU HG3 3.114 . 4.326 2.990 2.861 3.258 . 0 0 "[ . 1 . 2]" 1
1394 1 59 ILE MG 1 61 PHE H 3.345 . 4.744 3.623 3.423 3.866 . 0 0 "[ . 1 . 2]" 1
1395 1 26 THR HA 1 37 LEU HG 3.410 . 4.864 3.369 3.207 3.477 . 0 0 "[ . 1 . 2]" 1
1396 1 27 VAL H 1 36 VAL HA 3.037 . 4.190 3.781 3.592 4.038 . 0 0 "[ . 1 . 2]" 1
1397 1 30 ILE HA 1 32 GLY H 3.193 . 4.468 3.589 3.361 3.851 . 0 0 "[ . 1 . 2]" 1
1398 1 59 ILE HB 1 61 PHE QD 3.487 . 5.007 4.717 4.527 4.983 . 0 0 "[ . 1 . 2]" 1
1399 1 59 ILE HB 1 61 PHE QE 3.051 . 4.215 3.820 3.563 4.141 . 0 0 "[ . 1 . 2]" 1
1400 1 57 VAL MG1 1 69 ILE H 3.419 . 4.880 4.360 4.156 4.531 . 0 0 "[ . 1 . 2]" 1
1401 1 18 ILE HB 1 41 ASP QB 3.119 . 4.335 3.530 3.279 4.192 . 0 0 "[ . 1 . 2]" 1
1402 1 18 ILE H 1 42 PRO HA 2.916 . 3.979 3.920 3.675 4.058 0.079 1 0 "[ . 1 . 2]" 1
1403 1 74 ILE MG 1 75 VAL HA 3.496 . 5.024 3.462 3.280 3.654 . 0 0 "[ . 1 . 2]" 1
1404 1 48 THR HB 1 74 ILE MG 3.594 . 5.209 4.122 3.990 4.276 . 0 0 "[ . 1 . 2]" 1
1405 1 50 LEU HA 1 74 ILE MG 3.171 . 4.428 3.227 3.062 3.353 . 0 0 "[ . 1 . 2]" 1
1406 1 76 GLU HB2 1 77 MET H 3.271 . 4.609 4.141 3.192 4.244 . 0 0 "[ . 1 . 2]" 1
1407 1 45 PHE HB2 1 46 GLY H 3.339 . 4.732 4.546 4.457 4.593 . 0 0 "[ . 1 . 2]" 1
1408 1 45 PHE HB3 1 46 GLY H 3.379 . 4.806 4.074 3.898 4.140 . 0 0 "[ . 1 . 2]" 1
1409 1 17 PHE HB3 1 40 GLY HA2 3.176 . 4.437 3.486 3.145 3.707 . 0 0 "[ . 1 . 2]" 1
1410 1 18 ILE HB 1 40 GLY HA2 3.200 . 4.480 3.720 3.496 3.834 . 0 0 "[ . 1 . 2]" 1
1411 1 39 LEU HG 1 40 GLY HA2 3.152 . 4.394 4.097 3.957 4.200 . 0 0 "[ . 1 . 2]" 1
1412 1 39 LEU MD2 1 40 GLY HA2 3.130 . 4.354 4.330 4.156 4.411 0.057 19 0 "[ . 1 . 2]" 1
1413 1 39 LEU MD2 1 40 GLY HA3 3.353 . 4.759 4.137 3.926 4.344 . 0 0 "[ . 1 . 2]" 1
1414 1 39 LEU HG 1 40 GLY HA3 3.125 . 4.346 4.372 4.308 4.414 0.068 20 0 "[ . 1 . 2]" 1
1415 1 18 ILE HB 1 40 GLY HA3 3.615 . 5.249 4.422 4.274 4.519 . 0 0 "[ . 1 . 2]" 1
1416 1 46 GLY HA2 1 76 GLU HG3 3.259 . 4.587 3.568 3.228 4.069 . 0 0 "[ . 1 . 2]" 1
1417 1 51 THR MG 1 55 GLY HA2 3.074 . 4.255 4.193 3.952 4.281 0.026 20 0 "[ . 1 . 2]" 1
1418 1 17 PHE QD 1 40 GLY HA3 3.710 . 5.431 5.420 4.965 5.542 0.111 12 0 "[ . 1 . 2]" 1
1419 1 73 SER HA 1 74 ILE HB 3.219 . 4.515 4.472 4.410 4.555 0.040 20 0 "[ . 1 . 2]" 1
1420 1 28 GLN H 1 49 VAL HA 2.996 . 4.118 3.355 3.203 3.445 . 0 0 "[ . 1 . 2]" 1
1421 1 38 LYS HA 1 38 LYS HG2 3.144 . 4.379 2.782 2.579 3.431 . 0 0 "[ . 1 . 2]" 1
1422 1 51 THR MG 1 71 GLY HA2 3.059 . 4.228 3.506 2.872 3.861 . 0 0 "[ . 1 . 2]" 1
1423 1 50 LEU HA 1 51 THR MG 3.115 . 4.328 3.932 3.823 4.056 . 0 0 "[ . 1 . 2]" 1
1424 1 15 ILE MD 1 82 TYR HB3 3.000 . 4.125 3.091 2.755 3.273 . 0 0 "[ . 1 . 2]" 1
1425 1 82 TYR HB2 1 83 ASN H 3.295 . 4.652 4.604 4.548 4.645 . 0 0 "[ . 1 . 2]" 1
1426 1 82 TYR HB2 1 82 TYR QE 3.361 . 4.773 4.474 4.459 4.486 . 0 0 "[ . 1 . 2]" 1
1427 1 82 TYR HB3 1 82 TYR QE 3.249 . 4.568 4.442 4.399 4.473 . 0 0 "[ . 1 . 2]" 1
1428 1 30 ILE H 1 30 ILE MD 3.151 . 4.392 3.508 3.446 3.642 . 0 0 "[ . 1 . 2]" 1
1429 1 15 ILE H 1 15 ILE HB 3.290 . 4.643 3.652 3.632 3.681 . 0 0 "[ . 1 . 2]" 1
1430 1 55 GLY H 1 71 GLY HA3 3.413 . 4.869 2.601 1.944 3.068 0.013 6 0 "[ . 1 . 2]" 1
1431 1 45 PHE HA 1 77 MET HG2 3.575 . 5.173 5.237 5.191 5.305 0.132 19 0 "[ . 1 . 2]" 1
1432 1 77 MET HA 1 77 MET HG2 3.472 . 4.979 3.306 2.775 3.482 . 0 0 "[ . 1 . 2]" 1
1433 1 77 MET HG3 1 81 ILE MG 3.102 . 4.304 4.041 3.831 4.306 0.002 9 0 "[ . 1 . 2]" 1
1434 1 42 PRO HD2 1 44 PHE QE 3.415 . 4.872 3.888 3.541 4.074 . 0 0 "[ . 1 . 2]" 1
1435 1 21 LEU HB3 1 39 LEU H 3.196 . 4.473 4.154 3.704 4.372 . 0 0 "[ . 1 . 2]" 1
1436 1 49 VAL MG1 1 51 THR H 2.989 . 4.106 3.943 3.680 4.167 0.061 12 0 "[ . 1 . 2]" 1
1437 1 69 ILE H 1 69 ILE MD 3.090 . 4.284 3.810 3.652 3.893 . 0 0 "[ . 1 . 2]" 1
1438 1 57 VAL H 1 69 ILE MD 3.253 . 4.575 4.326 3.966 4.572 . 0 0 "[ . 1 . 2]" 1
1439 1 69 ILE MD 1 70 GLY H 3.545 . 5.115 4.987 4.852 5.108 . 0 0 "[ . 1 . 2]" 1
1440 1 43 ILE H 1 43 ILE MD 3.068 . 4.244 3.760 3.652 3.820 . 0 0 "[ . 1 . 2]" 1
1441 1 26 THR MG 1 37 LEU H 3.050 . 4.213 3.915 3.721 4.132 . 0 0 "[ . 1 . 2]" 1
1442 1 26 THR MG 1 36 VAL H 3.162 . 4.412 3.887 3.400 4.257 . 0 0 "[ . 1 . 2]" 1
1443 1 18 ILE H 1 43 ILE HG12 3.080 . 4.266 4.089 3.958 4.182 . 0 0 "[ . 1 . 2]" 1
1444 1 15 ILE H 1 43 ILE MG 3.276 . 4.618 3.687 3.586 3.759 . 0 0 "[ . 1 . 2]" 1
1445 1 50 LEU HA 1 74 ILE MD 3.438 . 4.916 3.764 3.617 3.861 . 0 0 "[ . 1 . 2]" 1
1446 1 15 ILE HG12 1 45 PHE H 3.676 . 5.365 3.512 3.319 3.789 . 0 0 "[ . 1 . 2]" 1
1447 1 27 VAL HB 1 49 VAL MG1 2.440 . 3.184 3.266 3.247 3.287 0.103 8 0 "[ . 1 . 2]" 1
1448 1 61 PHE QD 1 67 VAL HB 4.019 2.880 5.158 4.409 3.274 5.252 0.094 20 0 "[ . 1 . 2]" 1
1449 1 69 ILE H 1 69 ILE MG 3.211 . 4.500 3.838 3.801 3.874 . 0 0 "[ . 1 . 2]" 1
1450 1 36 VAL HB 1 37 LEU H 2.950 . 4.038 4.134 4.078 4.188 0.150 11 0 "[ . 1 . 2]" 1
1451 1 48 THR H 1 48 THR MG 2.966 . 4.066 3.802 3.768 3.827 . 0 0 "[ . 1 . 2]" 1
1452 1 18 ILE MD 1 41 ASP QB 3.206 2.435 4.491 3.855 3.499 4.305 . 0 0 "[ . 1 . 2]" 1
1453 1 35 ARG HG3 1 36 VAL HA 3.263 . 4.594 4.169 3.962 4.541 . 0 0 "[ . 1 . 2]" 1
1454 1 58 THR HA 1 69 ILE H 2.953 . 4.043 3.784 3.608 3.975 . 0 0 "[ . 1 . 2]" 1
1455 1 28 GLN HB3 1 48 THR MG 2.772 . 3.733 3.881 3.836 3.919 0.186 20 0 "[ . 1 . 2]" 1
1456 1 59 ILE MG 1 60 ALA HA 3.518 . 5.065 4.017 3.934 4.061 . 0 0 "[ . 1 . 2]" 1
1457 1 15 ILE MG 1 44 PHE HB3 3.309 . 4.678 4.284 4.069 4.558 . 0 0 "[ . 1 . 2]" 1
1458 1 14 ALA MB 1 44 PHE HB3 3.433 . 4.906 4.990 4.953 5.052 0.146 3 0 "[ . 1 . 2]" 1
1459 1 43 ILE MG 1 44 PHE HB3 3.700 . 5.411 5.063 5.007 5.128 . 0 0 "[ . 1 . 2]" 1
1460 1 19 THR HB 1 20 LYS H 3.242 . 4.556 3.931 3.821 4.022 . 0 0 "[ . 1 . 2]" 1
1461 1 49 VAL HA 1 49 VAL MG2 2.201 . 2.807 2.568 2.538 2.616 . 0 0 "[ . 1 . 2]" 1
1462 1 21 LEU H 1 21 LEU HG 3.265 . 4.598 4.635 4.620 4.659 0.061 20 0 "[ . 1 . 2]" 1
1463 1 50 LEU HA 1 75 VAL H 3.167 . 4.421 4.200 4.048 4.356 . 0 0 "[ . 1 . 2]" 1
1464 1 37 LEU QD 1 42 PRO HD2 3.462 . 4.960 4.095 3.864 4.269 . 0 0 "[ . 1 . 2]" 1
1465 1 16 GLY HA3 1 62 VAL HB 3.356 . 4.764 4.461 4.376 4.609 . 0 0 "[ . 1 . 2]" 1
1466 1 30 ILE MG 1 47 GLU H 3.464 . 4.964 3.931 3.695 4.163 . 0 0 "[ . 1 . 2]" 1
1467 1 30 ILE H 1 47 GLU HA 3.506 . 5.042 3.752 3.606 3.957 . 0 0 "[ . 1 . 2]" 1
1468 1 61 PHE HZ 1 81 ILE MD 3.067 . 4.243 3.421 3.183 3.681 . 0 0 "[ . 1 . 2]" 1
1469 1 77 MET HB3 1 81 ILE MG 3.244 . 4.559 2.959 2.513 3.769 . 0 0 "[ . 1 . 2]" 1
1470 1 61 PHE HB2 1 66 ASP HA 3.618 . 5.254 3.895 3.609 3.979 . 0 0 "[ . 1 . 2]" 1
1471 1 81 ILE HG13 1 82 TYR H 3.532 . 5.091 4.783 4.595 4.974 . 0 0 "[ . 1 . 2]" 1
1472 1 81 ILE HG12 1 82 TYR H 3.569 . 5.161 4.567 4.439 4.675 . 0 0 "[ . 1 . 2]" 1
1473 1 81 ILE MD 1 82 TYR H 3.605 . 5.229 4.676 4.634 4.737 . 0 0 "[ . 1 . 2]" 1
1474 1 81 ILE H 1 81 ILE MD 3.095 . 4.293 4.175 4.077 4.322 0.029 6 0 "[ . 1 . 2]" 1
1475 1 78 THR H 1 81 ILE MD 3.391 . 4.828 3.954 3.829 4.165 . 0 0 "[ . 1 . 2]" 1
1476 1 28 GLN HE21 1 48 THR MG 3.723 . 5.455 5.000 4.297 5.389 . 0 0 "[ . 1 . 2]" 1
1477 1 19 THR MG 1 20 LYS H 3.093 . 4.289 3.982 3.934 4.030 . 0 0 "[ . 1 . 2]" 1
1478 1 20 LYS H 1 57 VAL MG1 3.162 . 4.412 4.090 3.768 4.246 . 0 0 "[ . 1 . 2]" 1
1479 1 17 PHE H 1 19 THR MG 3.355 . 4.762 4.343 4.265 4.410 . 0 0 "[ . 1 . 2]" 1
1480 1 27 VAL HA 1 28 GLN HB2 3.388 . 4.823 4.048 3.987 4.095 . 0 0 "[ . 1 . 2]" 1
1481 1 27 VAL HA 1 28 GLN HB3 3.701 . 5.413 5.372 5.304 5.428 0.015 12 0 "[ . 1 . 2]" 1
1482 1 18 ILE MG 1 39 LEU H 3.140 . 4.373 4.107 3.859 4.213 . 0 0 "[ . 1 . 2]" 1
1483 1 20 LYS H 1 59 ILE HA 3.545 . 5.116 4.707 4.580 4.819 . 0 0 "[ . 1 . 2]" 1
1484 1 16 GLY HA3 1 43 ILE MG 3.021 . 4.162 4.080 3.816 4.179 0.017 4 0 "[ . 1 . 2]" 1
1485 1 16 GLY HA3 1 62 VAL H 2.966 . 4.066 3.427 3.310 3.524 . 0 0 "[ . 1 . 2]" 1
1486 1 74 ILE HG13 1 75 VAL H 3.522 . 5.073 5.040 4.999 5.071 . 0 0 "[ . 1 . 2]" 1
1487 1 27 VAL MG1 1 44 PHE QD 3.233 . 4.540 4.463 4.150 4.610 0.070 18 0 "[ . 1 . 2]" 1
1488 1 43 ILE HG13 1 77 MET HG3 3.415 . 4.873 4.291 4.181 4.389 . 0 0 "[ . 1 . 2]" 1
1489 1 43 ILE HG12 1 77 MET HG3 3.647 . 5.310 5.402 5.354 5.459 0.149 9 0 "[ . 1 . 2]" 1
1490 1 62 VAL HB 1 63 ASP H 3.404 . 4.852 4.179 4.091 4.303 . 0 0 "[ . 1 . 2]" 1
1491 1 19 THR MG 1 60 ALA HA 3.332 . 4.720 4.228 4.097 4.318 . 0 0 "[ . 1 . 2]" 1
1492 1 39 LEU HB3 1 40 GLY HA3 2.849 . 3.864 4.008 3.959 4.056 0.192 11 0 "[ . 1 . 2]" 1
1493 1 56 SER HA 1 56 SER HB2 2.712 . 3.631 2.956 2.409 3.032 . 0 0 "[ . 1 . 2]" 1
1494 1 26 THR HA 1 27 VAL HB 3.430 . 4.901 4.274 4.197 4.358 . 0 0 "[ . 1 . 2]" 1
1495 1 27 VAL HA 1 50 LEU HG 3.441 . 4.921 4.383 3.840 4.626 . 0 0 "[ . 1 . 2]" 1
1496 1 57 VAL HB 1 69 ILE HG12 2.978 . 4.087 4.099 4.020 4.146 0.059 16 0 "[ . 1 . 2]" 1
1497 1 40 GLY H 1 41 ASP QB 3.473 . 4.981 4.457 4.320 4.657 . 0 0 "[ . 1 . 2]" 1
1498 1 74 ILE H 1 74 ILE MD 3.137 . 4.367 4.267 4.090 4.343 . 0 0 "[ . 1 . 2]" 1
1499 1 74 ILE MD 1 75 VAL H 3.687 . 5.386 5.234 5.062 5.390 0.004 20 0 "[ . 1 . 2]" 1
1500 1 50 LEU H 1 51 THR MG 3.475 . 4.984 4.066 3.873 4.204 . 0 0 "[ . 1 . 2]" 1
1501 1 60 ALA HA 1 61 PHE QD 3.264 . 4.596 4.403 4.239 4.625 0.029 9 0 "[ . 1 . 2]" 1
1502 1 63 ASP HB3 1 65 THR MG 3.350 . 4.753 3.753 3.331 4.210 . 0 0 "[ . 1 . 2]" 1
1503 1 61 PHE HB2 1 65 THR MG 3.378 . 4.805 4.360 4.187 4.645 . 0 0 "[ . 1 . 2]" 1
1504 1 20 LYS HE2 1 21 LEU H 3.762 . 5.531 4.601 3.690 5.359 . 0 0 "[ . 1 . 2]" 1
1505 1 41 ASP QB 1 42 PRO HG3 3.581 . 5.184 5.139 4.950 5.263 0.079 18 0 "[ . 1 . 2]" 1
1506 1 41 ASP QB 1 42 PRO HG2 3.628 . 5.273 4.643 4.208 4.973 . 0 0 "[ . 1 . 2]" 1
1507 1 20 LYS QB 1 57 VAL HA 3.074 . 4.255 4.163 3.147 4.274 0.019 12 0 "[ . 1 . 2]" 1
1508 1 17 PHE HA 1 18 ILE HA 4.085 . 6.171 4.310 4.289 4.339 . 0 0 "[ . 1 . 2]" 1
1509 1 38 LYS HA 1 39 LEU HA 3.412 . 4.867 4.323 4.258 4.375 . 0 0 "[ . 1 . 2]" 1
1510 1 41 ASP H 1 42 PRO HD3 3.533 . 5.094 4.729 4.629 4.816 . 0 0 "[ . 1 . 2]" 1
1511 1 41 ASP H 1 42 PRO HD2 3.557 . 5.139 4.947 4.838 5.085 . 0 0 "[ . 1 . 2]" 1
1512 1 17 PHE QE 1 62 VAL HA 3.311 . 4.682 4.298 4.010 4.504 . 0 0 "[ . 1 . 2]" 1
1513 1 78 THR HA 1 80 GLU H 3.438 . 4.915 4.582 4.284 4.924 0.009 18 0 "[ . 1 . 2]" 1
1514 1 46 GLY H 1 78 THR HA 3.359 . 4.770 4.189 3.943 4.474 . 0 0 "[ . 1 . 2]" 1
1515 1 58 THR HA 1 59 ILE HA 4.074 . 6.149 4.389 4.369 4.403 . 0 0 "[ . 1 . 2]" 1
1516 1 48 THR HA 1 74 ILE MG 3.272 . 4.610 4.360 4.233 4.537 . 0 0 "[ . 1 . 2]" 1
1517 1 26 THR HA 1 27 VAL MG1 3.176 . 4.437 4.466 4.407 4.517 0.080 8 0 "[ . 1 . 2]" 1
1518 1 82 TYR HA 1 82 TYR QE 3.088 . 4.280 4.323 4.272 4.410 0.130 19 0 "[ . 1 . 2]" 1
1519 1 28 GLN HG2 1 32 GLY HA2 3.089 . 4.282 2.947 2.525 3.051 . 0 0 "[ . 1 . 2]" 1
1520 1 28 GLN HG3 1 32 GLY HA2 3.295 . 4.652 4.652 4.252 4.720 0.068 2 0 "[ . 1 . 2]" 1
1521 1 28 GLN HB3 1 32 GLY HA2 3.103 . 4.306 3.239 3.066 3.312 . 0 0 "[ . 1 . 2]" 1
1522 1 28 GLN HG2 1 32 GLY HA3 3.239 . 4.550 4.066 3.753 4.177 . 0 0 "[ . 1 . 2]" 1
1523 1 28 GLN HB3 1 32 GLY HA3 3.427 . 4.895 4.930 4.745 5.020 0.125 1 0 "[ . 1 . 2]" 1
1524 1 64 GLY H 1 65 THR MG 3.369 . 4.788 4.646 4.391 4.849 0.061 12 0 "[ . 1 . 2]" 1
1525 1 21 LEU MD2 1 22 ASP QB 3.379 . 4.807 4.249 4.176 4.358 . 0 0 "[ . 1 . 2]" 1
1526 1 44 PHE HB3 1 45 PHE HA 3.581 . 5.184 4.940 4.828 5.046 . 0 0 "[ . 1 . 2]" 1
1527 1 69 ILE MG 1 73 SER H 3.204 . 4.487 4.150 3.916 4.364 . 0 0 "[ . 1 . 2]" 1
1528 1 61 PHE HA 1 61 PHE QE 3.208 . 4.494 4.382 4.316 4.446 . 0 0 "[ . 1 . 2]" 1
1529 1 59 ILE MG 1 66 ASP HA 3.662 . 5.339 4.530 4.287 4.749 . 0 0 "[ . 1 . 2]" 1
1530 1 61 PHE QE 1 67 VAL HA 3.520 . 5.069 4.212 3.969 4.379 . 0 0 "[ . 1 . 2]" 1
1531 1 18 ILE MD 1 20 LYS H 3.411 . 4.865 4.606 4.502 4.717 . 0 0 "[ . 1 . 2]" 1
1532 1 61 PHE QE 1 66 ASP HA 3.181 . 4.446 4.473 4.308 4.569 0.123 12 0 "[ . 1 . 2]" 1
1533 1 28 GLN H 1 47 GLU HA 3.605 . 5.229 4.622 4.469 4.795 . 0 0 "[ . 1 . 2]" 1
1534 1 59 ILE MD 1 67 VAL HB 3.218 . 4.512 4.393 4.251 4.525 0.013 16 0 "[ . 1 . 2]" 1
1535 1 59 ILE HB 1 67 VAL HB 3.002 . 4.129 3.750 3.050 4.251 0.122 12 0 "[ . 1 . 2]" 1
1536 1 17 PHE HA 1 18 ILE MD 2.990 . 4.107 3.857 3.764 3.975 . 0 0 "[ . 1 . 2]" 1
1537 1 17 PHE HA 1 59 ILE MG 3.386 . 4.819 3.766 3.669 3.903 . 0 0 "[ . 1 . 2]" 1
1538 1 17 PHE HA 1 17 PHE QE 3.221 . 4.518 4.619 4.574 4.646 0.128 12 0 "[ . 1 . 2]" 1
1539 1 17 PHE QD 1 41 ASP HA 3.540 . 5.106 4.328 4.072 4.559 . 0 0 "[ . 1 . 2]" 1
1540 1 58 THR HA 1 59 ILE HG13 3.059 . 4.229 3.973 3.861 4.071 . 0 0 "[ . 1 . 2]" 1
1541 1 17 PHE H 1 18 ILE MD 3.536 . 5.099 4.748 4.665 4.831 . 0 0 "[ . 1 . 2]" 1
1542 1 18 ILE MD 1 41 ASP H 3.437 . 4.914 4.443 4.184 4.752 . 0 0 "[ . 1 . 2]" 1
1543 1 17 PHE HA 1 18 ILE HG12 3.441 . 4.921 3.538 3.481 3.612 . 0 0 "[ . 1 . 2]" 1
1544 1 14 ALA HA 1 43 ILE H 3.306 . 4.673 4.483 4.302 4.679 0.006 11 0 "[ . 1 . 2]" 1
1545 1 38 LYS QD 1 39 LEU H 3.411 . 4.866 4.401 4.230 4.755 . 0 0 "[ . 1 . 2]" 1
1546 1 27 VAL MG2 1 47 GLU HG3 3.039 . 4.194 4.080 3.966 4.185 . 0 0 "[ . 1 . 2]" 1
1547 1 61 PHE QD 1 65 THR MG 3.325 . 4.707 4.481 4.070 4.796 0.089 12 0 "[ . 1 . 2]" 1
1548 1 21 LEU HA 1 22 ASP QB 3.315 . 4.689 3.964 3.850 4.169 . 0 0 "[ . 1 . 2]" 1
1549 1 21 LEU HB3 1 21 LEU MD2 2.654 2.074 3.234 2.160 2.139 2.184 . 0 0 "[ . 1 . 2]" 1
1550 1 20 LYS H 1 21 LEU HB3 3.692 . 5.396 5.282 5.178 5.405 0.009 19 0 "[ . 1 . 2]" 1
1551 1 26 THR HA 1 50 LEU MD1 3.099 . 4.300 4.350 4.323 4.391 0.091 1 0 "[ . 1 . 2]" 1
1552 1 21 LEU MD2 1 57 VAL HA 3.719 . 5.448 5.051 4.938 5.278 . 0 0 "[ . 1 . 2]" 1
1553 1 21 LEU HA 1 21 LEU MD2 3.333 . 4.721 3.544 3.491 3.609 . 0 0 "[ . 1 . 2]" 1
1554 1 21 LEU HG 1 57 VAL HA 3.484 . 5.001 3.852 3.654 4.317 . 0 0 "[ . 1 . 2]" 1
1555 1 21 LEU HA 1 21 LEU HG 3.006 . 4.136 2.572 2.521 2.624 . 0 0 "[ . 1 . 2]" 1
1556 1 23 GLY HA2 1 25 VAL MG1 3.515 . 5.060 4.853 4.699 5.058 . 0 0 "[ . 1 . 2]" 1
1557 1 22 ASP QB 1 23 GLY HA3 3.665 2.413 4.917 3.967 3.625 4.460 . 0 0 "[ . 1 . 2]" 1
1558 1 22 ASP QB 1 23 GLY HA2 3.569 . 5.161 4.539 3.984 4.884 . 0 0 "[ . 1 . 2]" 1
1559 1 29 SER HA 1 47 GLU H 3.289 . 4.641 4.513 4.327 4.656 0.015 10 0 "[ . 1 . 2]" 1
1560 1 29 SER HB2 1 30 ILE HG13 3.614 . 5.247 4.875 3.891 6.022 0.775 9 2 "[ . +1 . - 2]" 1
1561 1 30 ILE MG 1 46 GLY HA3 2.424 . 3.159 2.108 1.941 2.241 . 0 0 "[ . 1 . 2]" 1
1562 1 31 ASN HB2 1 33 GLN QG 3.541 . 5.108 2.631 1.860 4.488 0.114 5 0 "[ . 1 . 2]" 1
1563 1 31 ASN HB3 1 33 GLN QG 3.436 . 4.912 3.335 2.506 5.004 0.092 13 0 "[ . 1 . 2]" 1
1564 1 26 THR HB 1 34 GLU HA 3.732 . 5.473 4.332 4.099 4.458 . 0 0 "[ . 1 . 2]" 1
1565 1 28 GLN HE22 1 34 GLU HB2 3.717 . 5.444 3.134 2.633 4.192 . 0 0 "[ . 1 . 2]" 1
1566 1 28 GLN HE22 1 34 GLU HG2 3.845 . 5.693 5.334 4.404 5.828 0.135 13 0 "[ . 1 . 2]" 1
1567 1 28 GLN HA 1 34 GLU HG3 3.660 . 5.334 4.113 3.064 4.741 . 0 0 "[ . 1 . 2]" 1
1568 1 34 GLU HB2 1 34 GLU HG3 1.878 . 2.319 2.391 2.309 2.530 0.211 14 0 "[ . 1 . 2]" 1
1569 1 34 GLU HG3 1 50 LEU MD1 3.304 . 4.669 2.472 1.986 2.956 . 0 0 "[ . 1 . 2]" 1
1570 1 34 GLU HG2 1 50 LEU MD1 3.448 . 4.934 3.710 2.644 4.473 . 0 0 "[ . 1 . 2]" 1
1571 1 35 ARG HA 1 35 ARG HD3 3.588 2.396 4.780 4.758 4.357 4.904 0.124 17 0 "[ . 1 . 2]" 1
1572 1 35 ARG HA 1 35 ARG HG3 3.429 . 4.899 3.542 2.994 3.763 . 0 0 "[ . 1 . 2]" 1
1573 1 35 ARG HD3 1 35 ARG HG2 2.416 . 3.146 2.552 2.388 3.010 . 0 0 "[ . 1 . 2]" 1
1574 1 51 THR HA 1 55 GLY HA2 3.495 . 5.022 5.095 4.994 5.192 0.170 6 0 "[ . 1 . 2]" 1
1575 1 51 THR HA 1 51 THR HB 2.559 . 3.378 2.443 2.379 2.473 . 0 0 "[ . 1 . 2]" 1
1576 1 51 THR HA 1 51 THR HG1 3.410 . 4.864 4.080 3.949 4.094 . 0 0 "[ . 1 . 2]" 1
1577 1 52 GLY HA3 1 53 GLY H 3.379 . 4.806 2.934 2.272 3.340 . 0 0 "[ . 1 . 2]" 1
1578 1 53 GLY HA2 1 72 ASP HB3 3.439 . 4.917 4.434 3.298 4.958 0.041 13 0 "[ . 1 . 2]" 1
1579 1 53 GLY HA2 1 55 GLY H 3.754 . 5.515 4.267 3.379 5.033 . 0 0 "[ . 1 . 2]" 1
1580 1 61 PHE HA 1 62 VAL HA 3.226 . 4.527 4.174 4.141 4.203 . 0 0 "[ . 1 . 2]" 1
1581 1 62 VAL MG2 1 82 TYR QE 3.551 . 5.127 5.326 5.275 5.371 0.244 8 0 "[ . 1 . 2]" 1
1582 1 62 VAL MG2 1 63 ASP H 3.128 . 4.351 4.218 4.145 4.287 . 0 0 "[ . 1 . 2]" 1
1583 1 77 MET H 1 78 THR MG 3.537 . 5.101 4.118 3.923 4.455 . 0 0 "[ . 1 . 2]" 1
1584 1 62 VAL MG1 1 82 TYR QD 3.361 . 4.773 4.689 4.585 4.760 . 0 0 "[ . 1 . 2]" 1
1585 1 16 GLY HA2 1 62 VAL MG1 3.015 . 4.151 3.860 3.755 3.937 . 0 0 "[ . 1 . 2]" 1
1586 1 63 ASP HB2 1 84 THR MG 3.114 . 4.326 2.571 2.188 3.003 . 0 0 "[ . 1 . 2]" 1
1587 1 63 ASP HB3 1 84 THR MG 3.313 . 4.685 3.576 3.072 3.952 . 0 0 "[ . 1 . 2]" 1
1588 1 61 PHE QE 1 65 THR HB 3.720 . 5.450 4.811 4.141 5.257 . 0 0 "[ . 1 . 2]" 1
1589 1 16 GLY HA3 1 43 ILE HB 3.285 . 4.634 3.117 2.910 3.205 . 0 0 "[ . 1 . 2]" 1
1590 1 16 GLY HA2 1 62 VAL HB 3.399 . 4.843 2.892 2.795 3.048 . 0 0 "[ . 1 . 2]" 1
1591 1 71 GLY HA2 1 72 ASP HB2 3.722 . 5.453 4.923 4.761 6.015 0.562 5 1 "[ + 1 . 2]" 1
1592 1 72 ASP HB3 1 73 SER H 3.472 . 4.979 4.074 3.939 4.603 . 0 0 "[ . 1 . 2]" 1
1593 1 73 SER HA 1 74 ILE HG13 2.807 . 3.792 3.583 3.476 3.778 . 0 0 "[ . 1 . 2]" 1
1594 1 78 THR HA 1 81 ILE HB 3.156 . 4.401 4.159 3.987 4.416 0.015 6 0 "[ . 1 . 2]" 1
1595 1 18 ILE HA 1 59 ILE MG 3.028 . 4.174 3.967 3.781 4.159 . 0 0 "[ . 1 . 2]" 1
1596 1 78 THR HB 1 79 ASP HB2 3.465 . 4.966 4.598 4.085 5.358 0.392 12 0 "[ . 1 . 2]" 1
1597 1 78 THR HA 1 78 THR HB 2.278 . 2.926 2.548 2.479 2.631 . 0 0 "[ . 1 . 2]" 1
1598 1 82 TYR HA 1 83 ASN HB3 3.408 . 4.859 4.734 4.527 4.900 0.041 5 0 "[ . 1 . 2]" 1
1599 1 61 PHE QE 1 82 TYR HB2 3.431 . 4.902 2.931 2.646 3.257 . 0 0 "[ . 1 . 2]" 1
1600 1 82 TYR HB2 1 84 THR MG 3.628 . 5.274 4.884 4.311 5.243 . 0 0 "[ . 1 . 2]" 1
1601 1 82 TYR HB2 1 82 TYR QD 2.057 . 2.586 2.676 2.608 2.745 0.159 9 0 "[ . 1 . 2]" 1
1602 1 82 TYR HB3 1 82 TYR QD 2.010 . 2.515 2.529 2.373 2.615 0.100 4 0 "[ . 1 . 2]" 1
1603 1 82 TYR QD 1 83 ASN H 2.775 . 3.738 3.109 2.812 3.570 . 0 0 "[ . 1 . 2]" 1
1604 1 61 PHE QD 1 82 TYR QD 2.492 . 3.268 3.346 3.302 3.410 0.142 1 0 "[ . 1 . 2]" 1
1605 1 61 PHE HB2 1 61 PHE QD 2.297 . 2.957 2.284 2.256 2.318 . 0 0 "[ . 1 . 2]" 1
1606 1 61 PHE HB3 1 61 PHE QD 2.301 . 2.963 2.547 2.478 2.628 . 0 0 "[ . 1 . 2]" 1
1607 1 61 PHE HA 1 61 PHE QD 2.415 . 3.144 2.461 2.264 2.628 . 0 0 "[ . 1 . 2]" 1
1608 1 61 PHE H 1 61 PHE QD 2.590 . 3.429 2.829 2.661 3.022 . 0 0 "[ . 1 . 2]" 1
1609 1 44 PHE H 1 44 PHE QD 2.243 . 2.872 2.529 2.441 2.632 . 0 0 "[ . 1 . 2]" 1
1610 1 17 PHE H 1 17 PHE QD 2.522 . 3.317 3.111 3.072 3.151 . 0 0 "[ . 1 . 2]" 1
1611 1 17 PHE HB3 1 17 PHE QD 2.100 . 2.651 2.400 2.352 2.432 . 0 0 "[ . 1 . 2]" 1
1612 1 17 PHE HB2 1 17 PHE QD 2.100 . 2.651 2.379 2.341 2.439 . 0 0 "[ . 1 . 2]" 1
1613 1 44 PHE HB2 1 44 PHE QD 2.108 . 2.664 2.457 2.366 2.516 . 0 0 "[ . 1 . 2]" 1
1614 1 17 PHE HA 1 17 PHE QD 2.532 . 3.333 2.908 2.860 2.962 . 0 0 "[ . 1 . 2]" 1
1615 1 45 PHE HZ 1 79 ASP H 2.961 . 4.057 3.110 2.854 3.257 . 0 0 "[ . 1 . 2]" 1
1616 1 16 GLY HA2 1 17 PHE QD 2.765 . 3.721 2.940 2.875 3.010 . 0 0 "[ . 1 . 2]" 1
1617 1 17 PHE QD 1 42 PRO QB 2.757 . 3.707 2.787 2.471 3.037 . 0 0 "[ . 1 . 2]" 1
1618 1 17 PHE QD 1 18 ILE H 2.736 . 3.672 3.811 3.736 3.889 0.217 12 0 "[ . 1 . 2]" 1
1619 1 44 PHE HA 1 44 PHE QD 2.768 . 3.725 3.073 2.933 3.146 . 0 0 "[ . 1 . 2]" 1
1620 1 43 ILE HA 1 44 PHE QD 2.571 . 3.398 3.180 2.947 3.424 0.026 10 0 "[ . 1 . 2]" 1
1621 1 14 ALA HA 1 44 PHE QD 2.334 . 3.015 2.988 2.832 3.101 0.086 5 0 "[ . 1 . 2]" 1
1622 1 44 PHE HB3 1 44 PHE QD 2.141 . 2.714 2.332 2.294 2.398 . 0 0 "[ . 1 . 2]" 1
1623 1 14 ALA MB 1 44 PHE QD 2.611 . 3.463 3.441 3.242 3.531 0.068 1 0 "[ . 1 . 2]" 1
1624 1 15 ILE HB 1 61 PHE QD 2.697 . 3.607 3.241 2.967 3.614 0.007 19 0 "[ . 1 . 2]" 1
1625 1 61 PHE QD 1 67 VAL QG 2.725 . 3.653 2.975 2.461 3.588 . 0 0 "[ . 1 . 2]" 1
1626 1 15 ILE HG13 1 61 PHE QD 2.716 . 3.638 2.453 2.321 2.562 . 0 0 "[ . 1 . 2]" 1
1627 1 61 PHE QD 1 66 ASP HA 2.584 . 3.419 3.110 2.773 3.322 . 0 0 "[ . 1 . 2]" 1
1628 1 61 PHE QD 1 62 VAL H 2.764 . 3.719 3.317 3.205 3.426 . 0 0 "[ . 1 . 2]" 1
1629 1 82 TYR HA 1 82 TYR QD 2.246 . 2.877 2.011 1.923 2.116 . 0 0 "[ . 1 . 2]" 1
1630 1 61 PHE HB3 1 82 TYR QD 2.589 . 3.427 3.307 3.066 3.488 0.061 15 0 "[ . 1 . 2]" 1
1631 1 63 ASP HB2 1 82 TYR QD 3.308 2.322 4.294 4.394 4.312 4.826 0.532 15 1 "[ . 1 + 2]" 1
1632 1 15 ILE HB 1 82 TYR QD 2.763 . 3.717 2.049 1.957 2.135 . 0 0 "[ . 1 . 2]" 1
1633 1 82 TYR QD 1 84 THR MG 2.457 . 3.212 3.200 2.931 3.331 0.119 5 0 "[ . 1 . 2]" 1
1634 1 15 ILE MG 1 82 TYR QD 2.372 . 3.075 2.691 2.634 2.745 . 0 0 "[ . 1 . 2]" 1
1635 1 15 ILE HG13 1 82 TYR QD 2.659 . 3.543 3.632 3.577 3.698 0.155 4 0 "[ . 1 . 2]" 1
1636 1 15 ILE MD 1 82 TYR QD 2.513 . 3.302 2.105 2.009 2.224 . 0 0 "[ . 1 . 2]" 1
1637 1 15 ILE HA 1 82 TYR QE 2.665 . 3.553 2.765 2.637 2.887 . 0 0 "[ . 1 . 2]" 1
1638 1 82 TYR QE 1 84 THR HA 2.663 . 3.549 3.325 2.943 3.598 0.049 16 0 "[ . 1 . 2]" 1
1639 1 61 PHE HB2 1 82 TYR QE 2.802 . 3.784 3.321 3.017 3.609 . 0 0 "[ . 1 . 2]" 1
1640 1 63 ASP HB3 1 82 TYR QE 2.431 . 3.170 1.989 1.788 2.122 . 0 0 "[ . 1 . 2]" 1
1641 1 15 ILE MG 1 82 TYR QE 2.250 . 2.883 2.577 2.402 2.651 . 0 0 "[ . 1 . 2]" 1
1642 1 15 ILE HG13 1 82 TYR QE 3.144 2.270 4.018 4.155 4.109 4.229 0.211 20 0 "[ . 1 . 2]" 1
1643 1 15 ILE MD 1 82 TYR QE 2.785 . 3.755 3.694 3.627 3.748 . 0 0 "[ . 1 . 2]" 1
1644 1 63 ASP H 1 82 TYR QE 2.638 . 3.508 2.874 2.667 3.150 . 0 0 "[ . 1 . 2]" 1
1645 1 45 PHE HB3 1 45 PHE QD 2.048 . 2.572 2.476 2.409 2.528 . 0 0 "[ . 1 . 2]" 1
1646 1 59 ILE MG 1 61 PHE HZ 3.155 . 4.399 3.368 3.231 3.593 . 0 0 "[ . 1 . 2]" 1
1647 1 43 ILE HB 1 61 PHE QE 2.981 . 4.092 4.145 3.948 4.283 0.191 6 0 "[ . 1 . 2]" 1
1648 1 61 PHE QE 1 67 VAL HB 2.386 . 3.098 2.779 1.903 3.482 0.384 20 0 "[ . 1 . 2]" 1
1649 1 15 ILE HG13 1 61 PHE QE 2.633 . 3.500 2.559 2.274 2.871 . 0 0 "[ . 1 . 2]" 1
1650 1 61 PHE QE 1 67 VAL QG 2.651 . 3.529 1.783 1.569 2.144 0.204 17 0 "[ . 1 . 2]" 1
1651 1 61 PHE HZ 1 77 MET ME 2.934 . 4.010 2.166 1.903 2.742 . 0 0 "[ . 1 . 2]" 1
1652 1 15 ILE MD 1 45 PHE QD 2.467 . 3.228 2.313 2.204 2.527 . 0 0 "[ . 1 . 2]" 1
1653 1 15 ILE MD 1 45 PHE QE 2.820 . 3.814 3.462 3.369 3.593 . 0 0 "[ . 1 . 2]" 1
1654 1 15 ILE MG 1 45 PHE QD 2.448 . 3.197 1.768 1.745 1.790 . 0 0 "[ . 1 . 2]" 1
1655 1 15 ILE MG 1 45 PHE QE 2.772 . 3.732 3.780 3.733 3.837 0.105 19 0 "[ . 1 . 2]" 1
1656 1 45 PHE QE 1 78 THR MG 2.837 . 3.843 3.580 3.203 3.877 0.034 20 0 "[ . 1 . 2]" 1
1657 1 15 ILE HB 1 45 PHE QD 3.042 . 4.199 3.135 3.021 3.230 . 0 0 "[ . 1 . 2]" 1
1658 1 45 PHE QE 1 79 ASP HB2 3.001 . 4.127 4.112 3.475 4.883 0.756 12 6 "[ . * * + *. - *]" 1
1659 1 45 PHE QE 1 82 TYR HB3 2.981 . 4.092 2.287 2.125 2.496 . 0 0 "[ . 1 . 2]" 1
1660 1 45 PHE QD 1 82 TYR HB3 2.777 . 3.741 3.796 3.711 3.842 0.101 10 0 "[ . 1 . 2]" 1
1661 1 45 PHE HA 1 45 PHE QD 2.328 . 3.006 3.048 3.023 3.063 0.057 14 0 "[ . 1 . 2]" 1
1662 1 45 PHE QD 1 78 THR HA 2.791 . 3.765 3.643 3.472 3.773 0.008 11 0 "[ . 1 . 2]" 1
1663 1 45 PHE QD 1 82 TYR QD 2.463 . 3.221 2.233 2.107 2.371 . 0 0 "[ . 1 . 2]" 1
1664 1 45 PHE QE 1 82 TYR QD 2.637 . 3.506 2.526 2.425 2.651 . 0 0 "[ . 1 . 2]" 1
1665 1 45 PHE QD 1 46 GLY H 2.799 . 3.778 3.502 3.263 3.725 . 0 0 "[ . 1 . 2]" 1
1666 1 45 PHE QE 1 79 ASP H 3.190 . 4.462 3.242 3.061 3.487 . 0 0 "[ . 1 . 2]" 1
1667 1 45 PHE H 1 45 PHE QD 3.015 . 4.151 3.985 3.922 4.062 . 0 0 "[ . 1 . 2]" 1
1668 1 14 ALA H 1 44 PHE QE 2.801 . 3.782 3.253 3.077 3.440 . 0 0 "[ . 1 . 2]" 1
1669 1 42 PRO HG2 1 44 PHE QE 2.601 . 3.447 1.987 1.851 2.149 . 0 0 "[ . 1 . 2]" 1
1670 1 14 ALA HA 1 44 PHE QE 2.840 . 3.848 3.723 3.691 3.757 . 0 0 "[ . 1 . 2]" 1
1671 1 42 PRO QB 1 44 PHE QE 2.778 . 3.743 2.865 2.376 3.562 . 0 0 "[ . 1 . 2]" 1
1672 1 14 ALA MB 1 17 PHE HZ 2.668 . 3.558 2.658 2.432 2.972 . 0 0 "[ . 1 . 2]" 1
1673 1 17 PHE QD 1 42 PRO HD3 3.105 . 4.310 3.904 3.651 4.170 . 0 0 "[ . 1 . 2]" 1
1674 1 17 PHE QD 1 40 GLY HA2 3.215 . 4.507 4.412 4.064 4.537 0.030 14 0 "[ . 1 . 2]" 1
1675 1 14 ALA MB 1 17 PHE QE 2.706 . 3.622 3.065 2.837 3.250 . 0 0 "[ . 1 . 2]" 1
1676 1 45 PHE HZ 1 78 THR HA 2.958 . 4.052 3.575 3.202 3.848 . 0 0 "[ . 1 . 2]" 1
1677 1 45 PHE HZ 1 79 ASP HB2 2.977 . 4.085 3.084 2.330 3.818 . 0 0 "[ . 1 . 2]" 1
1678 1 62 VAL H 1 82 TYR QE 3.038 . 4.192 3.883 3.758 4.023 . 0 0 "[ . 1 . 2]" 1
1679 1 61 PHE HB2 1 82 TYR QD 2.932 . 4.007 3.834 3.655 4.036 0.029 12 0 "[ . 1 . 2]" 1
1680 1 61 PHE QD 1 82 TYR QE 2.886 . 3.927 3.662 3.496 3.873 . 0 0 "[ . 1 . 2]" 1
1681 1 16 GLY HA3 1 17 PHE QD 2.992 . 4.111 4.316 4.282 4.371 0.260 20 0 "[ . 1 . 2]" 1
1682 1 44 PHE QD 1 45 PHE H 2.910 . 3.968 3.954 3.855 4.031 0.063 10 0 "[ . 1 . 2]" 1
1683 1 15 ILE H 1 44 PHE QD 3.141 . 4.374 4.421 4.379 4.471 0.097 10 0 "[ . 1 . 2]" 1
1684 1 42 PRO HG3 1 44 PHE HZ 2.945 . 4.029 3.349 3.026 3.629 . 0 0 "[ . 1 . 2]" 1
1685 1 45 PHE QD 1 46 GLY HA2 2.879 . 3.915 3.722 3.595 3.883 . 0 0 "[ . 1 . 2]" 1
1686 1 45 PHE QE 1 82 TYR QE 3.006 . 4.135 4.283 4.212 4.346 0.211 11 0 "[ . 1 . 2]" 1
1687 1 16 GLY HA2 1 61 PHE QD 2.906 . 3.962 3.638 3.346 3.792 . 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 28
_Distance_constraint_stats_list.Viol_count 132
_Distance_constraint_stats_list.Viol_total 171.204
_Distance_constraint_stats_list.Viol_max 0.296
_Distance_constraint_stats_list.Viol_rms 0.0419
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0153
_Distance_constraint_stats_list.Viol_average_violations_only 0.0648
_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 13 ASN 0.256 0.103 18 0 "[ . 1 . 2]"
1 15 ILE 0.027 0.024 10 0 "[ . 1 . 2]"
1 16 GLY 0.530 0.052 17 0 "[ . 1 . 2]"
1 17 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 LYS 0.821 0.071 16 0 "[ . 1 . 2]"
1 22 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 THR 1.265 0.095 17 0 "[ . 1 . 2]"
1 27 VAL 0.103 0.026 1 0 "[ . 1 . 2]"
1 28 GLN 2.551 0.098 16 0 "[ . 1 . 2]"
1 35 ARG 0.103 0.026 1 0 "[ . 1 . 2]"
1 38 LYS 2.888 0.296 7 0 "[ . 1 . 2]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 ASP 2.888 0.296 7 0 "[ . 1 . 2]"
1 43 ILE 0.557 0.052 17 0 "[ . 1 . 2]"
1 44 PHE 0.065 0.041 11 0 "[ . 1 . 2]"
1 45 PHE 0.256 0.103 18 0 "[ . 1 . 2]"
1 47 GLU 0.065 0.041 11 0 "[ . 1 . 2]"
1 48 THR 2.551 0.098 16 0 "[ . 1 . 2]"
1 49 VAL 0.020 0.011 19 0 "[ . 1 . 2]"
1 50 LEU 1.265 0.095 17 0 "[ . 1 . 2]"
1 56 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 VAL 0.035 0.021 16 0 "[ . 1 . 2]"
1 58 THR 0.821 0.071 16 0 "[ . 1 . 2]"
1 59 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ILE 0.035 0.021 16 0 "[ . 1 . 2]"
1 75 VAL 0.020 0.011 19 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 16 GLY H 1 43 ILE O 2.200 . 2.700 2.349 2.171 2.455 . 0 0 "[ . 1 . 2]" 2
2 1 15 ILE H 1 43 ILE O 2.200 . 2.700 1.766 1.706 1.860 0.024 10 0 "[ . 1 . 2]" 2
3 1 49 VAL O 1 75 VAL H 2.200 . 2.700 2.155 2.042 2.274 . 0 0 "[ . 1 . 2]" 2
4 1 49 VAL H 1 75 VAL O 2.200 . 2.700 1.771 1.719 1.854 0.011 19 0 "[ . 1 . 2]" 2
5 1 38 LYS O 1 41 ASP H 2.200 . 2.700 2.405 2.235 2.527 . 0 0 "[ . 1 . 2]" 2
6 1 18 ILE O 1 40 GLY H 2.200 . 2.700 1.935 1.801 2.157 . 0 0 "[ . 1 . 2]" 2
7 1 28 GLN H 1 48 THR O 2.200 . 2.700 1.660 1.632 1.681 0.098 16 0 "[ . 1 . 2]" 2
8 1 27 VAL H 1 35 ARG O 2.200 . 2.700 1.841 1.704 2.007 0.026 1 0 "[ . 1 . 2]" 2
9 1 26 THR H 1 50 LEU O 2.200 . 2.700 2.008 1.709 2.124 0.021 12 0 "[ . 1 . 2]" 2
10 1 20 LYS H 1 58 THR O 2.200 . 2.700 2.517 2.356 2.590 . 0 0 "[ . 1 . 2]" 2
11 1 19 THR H 1 58 THR O 2.200 . 2.700 1.952 1.766 2.059 . 0 0 "[ . 1 . 2]" 2
12 1 18 ILE H 1 41 ASP O 2.200 . 2.700 1.969 1.803 2.105 . 0 0 "[ . 1 . 2]" 2
13 1 17 PHE H 1 60 ALA O 2.200 . 2.700 1.967 1.885 2.134 . 0 0 "[ . 1 . 2]" 2
14 1 28 GLN O 1 48 THR H 2.200 . 2.700 1.672 1.637 1.717 0.093 12 0 "[ . 1 . 2]" 2
15 1 44 PHE O 1 47 GLU H 2.200 . 2.700 2.428 2.274 2.557 . 0 0 "[ . 1 . 2]" 2
16 1 16 GLY O 1 43 ILE H 2.200 . 2.700 1.704 1.678 1.733 0.052 17 0 "[ . 1 . 2]" 2
17 1 59 ILE H 1 67 VAL O 2.200 . 2.700 2.056 1.783 2.396 . 0 0 "[ . 1 . 2]" 2
18 1 20 LYS O 1 58 THR H 2.200 . 2.700 1.696 1.659 1.868 0.071 16 0 "[ . 1 . 2]" 2
19 1 57 VAL H 1 69 ILE O 2.200 . 2.700 2.314 2.184 2.476 . 0 0 "[ . 1 . 2]" 2
20 1 26 THR O 1 50 LEU H 2.200 . 2.700 1.668 1.635 1.704 0.095 17 0 "[ . 1 . 2]" 2
21 1 57 VAL O 1 69 ILE H 2.200 . 2.700 1.796 1.709 1.915 0.021 16 0 "[ . 1 . 2]" 2
22 1 59 ILE O 1 67 VAL H 2.200 . 2.700 2.047 1.898 2.576 . 0 0 "[ . 1 . 2]" 2
23 1 61 PHE H 1 65 THR O 2.200 . 2.700 1.965 1.793 2.243 . 0 0 "[ . 1 . 2]" 2
24 1 17 PHE O 1 60 ALA H 2.200 . 2.700 1.900 1.809 2.009 . 0 0 "[ . 1 . 2]" 2
25 1 22 ASP O 1 56 SER H 2.200 . 2.700 2.007 1.798 2.536 . 0 0 "[ . 1 . 2]" 2
26 1 44 PHE H 1 47 GLU OE1 2.200 . 2.700 1.819 1.689 1.969 0.041 11 0 "[ . 1 . 2]" 2
27 1 38 LYS H 1 41 ASP OD1 2.200 . 2.700 2.452 1.703 2.996 0.296 7 0 "[ . 1 . 2]" 2
28 1 13 ASN O 1 45 PHE H 2.200 . 2.700 2.602 2.277 2.803 0.103 18 0 "[ . 1 . 2]" 2
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