NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
635801 |
6fzk   |
34246 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6fzk
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 1769
_Distance_constraint_stats_list.Viol_count 6742
_Distance_constraint_stats_list.Viol_total 20509.051
_Distance_constraint_stats_list.Viol_max 2.499
_Distance_constraint_stats_list.Viol_rms 0.0958
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0290
_Distance_constraint_stats_list.Viol_average_violations_only 0.1521
_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 20 HIS 0.020 0.020 15 0 "[ . 1 . 2]"
1 21 MET 0.020 0.020 15 0 "[ . 1 . 2]"
1 23 ARG 34.854 1.348 11 6 "[ * *. 1+ * . -* 2]"
1 24 MET 39.938 1.441 14 13 "[** *.*- *** *+.* **2]"
1 25 VAL 20.397 1.033 2 2 "[ + . 1 . - 2]"
1 26 ASN 16.748 0.433 20 0 "[ . 1 . 2]"
1 27 LEU 9.073 0.260 15 0 "[ . 1 . 2]"
1 28 GLU 18.260 1.163 14 1 "[ . 1 +. 2]"
1 29 PRO 34.814 1.673 6 4 "[ * *+ 1 - 2]"
1 30 ASP 9.822 0.248 1 0 "[ . 1 . 2]"
1 31 MET 25.524 0.880 14 3 "[ . * +. - 2]"
1 32 THR 34.970 0.673 18 5 "[ * -. * . *+ 2]"
1 33 ILE 62.089 1.075 2 14 "[*+*-* ** *** *. * **]"
1 34 SER 26.321 1.705 14 6 "[ * . ** 1* +. -]"
1 35 LYS 13.493 0.673 18 2 "[ - . 1 . + 2]"
1 36 ASN 36.954 1.441 14 13 "[** *.*- *** *+.* **2]"
1 37 GLU 24.569 0.813 17 1 "[ . 1 . + 2]"
1 38 MET 28.326 1.001 7 5 "[ * . +- 1 . * *]"
1 39 VAL 36.729 1.033 2 2 "[ + . 1 . - 2]"
1 40 LYS 61.225 1.348 11 6 "[ * *. 1+ * . *- 2]"
1 41 LEU 31.893 0.731 5 4 "[ + * 1 - * 2]"
1 42 LEU 35.594 0.798 15 3 "[ * . 1 +- 2]"
1 43 GLU 6.181 0.244 14 0 "[ . 1 . 2]"
1 44 ALA 14.976 0.398 16 0 "[ . 1 . 2]"
1 45 THR 40.652 2.014 13 9 "[* .* *1 +*-* **2]"
1 46 GLN 26.206 0.370 10 0 "[ . 1 . 2]"
1 47 TYR 29.978 0.391 7 0 "[ . 1 . 2]"
1 48 ARG 26.056 0.585 17 3 "[ -. * . + 2]"
1 49 GLN 48.641 2.499 2 6 "[*+ -. ** . * 2]"
1 50 VAL 45.152 2.499 2 10 "[*+ *. -*1* * * * *2]"
1 51 SER 3.922 0.217 9 0 "[ . 1 . 2]"
1 52 LYS 34.879 0.976 8 7 "[* . -+*1 * . * *2]"
1 53 MET 6.388 0.227 7 0 "[ . 1 . 2]"
1 54 THR 34.225 0.988 1 13 "[+- . ***1***** ***2]"
1 55 ARG 38.691 0.988 1 5 "[+ -. * * * 2]"
1 56 PRO 2.602 0.284 5 0 "[ . 1 . 2]"
1 57 GLY 32.060 2.014 13 9 "[* .* *- +*.* **2]"
1 58 GLU 30.365 0.820 13 12 "[*- . **1**+** ***2]"
1 59 PHE 45.117 1.468 7 7 "[ -. + 1** *. * *]"
1 60 THR 46.628 1.072 7 11 "[*- . + *1****. ** *]"
1 61 VAL 18.191 0.334 2 0 "[ . 1 . 2]"
1 64 ASN 8.027 0.407 1 0 "[ . 1 . 2]"
1 65 SER 15.469 0.659 8 1 "[ . + 1 . 2]"
1 66 ILE 52.026 1.705 14 12 "[*** * ** 1** +. *-*]"
1 67 GLU 15.412 0.419 12 0 "[ . 1 . 2]"
1 68 MET 31.618 1.468 7 8 "[ -. + 1** *.** *]"
1 69 ILE 24.684 0.523 13 2 "[ - . 1 + . 2]"
1 70 ARG 4.706 0.757 4 1 "[ +. 1 . 2]"
1 71 ARG 0.489 0.190 12 0 "[ . 1 . 2]"
1 72 PRO 12.584 1.264 19 2 "[ - 1 . +2]"
1 73 PHE 20.854 1.213 9 2 "[ . +- . 2]"
1 74 ASP 9.002 0.579 10 1 "[ . + . 2]"
1 75 PHE 26.106 0.352 16 0 "[ . 1 . 2]"
1 76 PRO 33.399 0.333 7 0 "[ . 1 . 2]"
1 77 ASP 18.820 0.280 3 0 "[ . 1 . 2]"
1 78 SER 5.632 0.225 5 0 "[ . 1 . 2]"
1 79 LYS 6.469 0.579 10 1 "[ . + . 2]"
1 80 GLU 10.074 0.677 9 5 "[ * * +1 .*- 2]"
1 81 GLY 8.247 1.198 19 2 "[ - 1 . +2]"
1 82 GLN 15.519 1.264 19 3 "[ * -1 . +2]"
1 83 VAL 17.943 0.755 13 10 "[** . *-**+*. ** 2]"
1 84 ARG 26.869 0.523 13 2 "[ - . 1 + . 2]"
1 85 ALA 35.035 0.731 5 4 "[* + 1 * . -2]"
1 86 ARG 23.597 0.710 8 1 "[ . + 1 . 2]"
1 87 LEU 7.208 0.266 5 0 "[ . 1 . 2]"
1 88 THR 24.700 2.411 2 1 "[ + . 1 . 2]"
1 89 PHE 10.444 0.247 16 0 "[ . 1 . 2]"
1 90 ASP 10.757 0.282 4 0 "[ . 1 . 2]"
1 91 GLY 13.666 0.430 18 0 "[ . 1 . 2]"
1 92 ASP 12.705 0.276 10 0 "[ . 1 . 2]"
1 93 HIS 39.718 0.463 10 0 "[ . 1 . 2]"
1 94 LEU 26.730 2.411 2 4 "[ + . * *. - 2]"
1 95 ALA 12.368 0.463 10 0 "[ . 1 . 2]"
1 96 THR 25.665 0.633 5 4 "[* + 1 * . -2]"
1 97 ILE 34.764 1.163 14 1 "[ . 1 +. 2]"
1 98 VAL 28.913 0.633 5 4 "[* + 1 * . -2]"
1 99 ASN 11.266 0.320 11 0 "[ . 1 . 2]"
1 100 MET 18.329 0.404 18 0 "[ . 1 . 2]"
1 101 GLU 35.659 0.646 9 3 "[- . +* . 2]"
1 102 ASN 18.790 0.294 9 0 "[ . 1 . 2]"
1 103 ASN 25.067 0.646 9 3 "[- . +* . 2]"
1 104 ARG 12.084 0.306 20 0 "[ . 1 . 2]"
1 105 GLN 11.831 0.314 19 0 "[ . 1 . 2]"
1 106 PHE 25.911 0.623 6 1 "[ .+ 1 . 2]"
1 107 GLY 6.622 0.346 6 0 "[ . 1 . 2]"
1 108 PHE 17.435 0.623 6 1 "[ .+ 1 . 2]"
1 109 PHE 32.793 1.673 6 6 "[ * *-+ 1 ** 2]"
1 110 ARG 13.556 1.015 14 4 "[ . ** +.- 2]"
1 111 LEU 7.468 0.419 13 0 "[ . 1 . 2]"
1 112 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 PRO 10.985 0.631 17 2 "[ . 1 . + -2]"
1 114 ARG 15.128 1.348 11 6 "[ * *. 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 20 HIS HA 1 21 MET H 3.600 . 5.220 2.887 2.150 3.552 . 0 0 "[ . 1 . 2]" 1
2 1 20 HIS QB 1 21 MET H 3.676 . 5.365 3.398 1.967 3.961 0.020 15 0 "[ . 1 . 2]" 1
3 1 23 ARG H 1 23 ARG HB2 3.010 . 4.143 3.328 2.685 3.854 . 0 0 "[ . 1 . 2]" 1
4 1 23 ARG H 1 23 ARG HB3 2.426 . 3.162 3.206 2.534 3.535 0.373 12 0 "[ . 1 . 2]" 1
5 1 23 ARG H 1 39 VAL MG1 2.059 . 2.589 2.881 2.502 3.027 0.438 17 0 "[ . 1 . 2]" 1
6 1 23 ARG H 1 24 MET HA 4.156 . 6.315 5.194 4.317 5.869 . 0 0 "[ . 1 . 2]" 1
7 1 23 ARG H 1 37 GLU HA 2.845 . 3.857 3.689 3.289 3.962 0.105 17 0 "[ . 1 . 2]" 1
8 1 23 ARG H 1 37 GLU HA 2.816 . 3.807 3.975 3.398 4.620 0.813 17 1 "[ . 1 . + 2]" 1
9 1 23 ARG HA 1 24 MET H 2.353 . 3.045 2.252 2.100 2.401 . 0 0 "[ . 1 . 2]" 1
10 1 23 ARG HA 1 25 VAL H 4.442 . 6.908 4.844 4.322 5.327 . 0 0 "[ . 1 . 2]" 1
11 1 23 ARG HA 1 37 GLU H 3.131 . 4.356 4.071 3.856 4.249 . 0 0 "[ . 1 . 2]" 1
12 1 23 ARG HA 1 40 LYS HA 2.933 . 4.008 4.426 3.744 5.356 1.348 11 5 "[ * -. 1+ * . * 2]" 1
13 1 23 ARG HA 1 40 LYS HD2 3.317 . 4.693 4.275 3.844 4.728 0.035 17 0 "[ . 1 . 2]" 1
14 1 23 ARG HA 1 40 LYS QE 2.990 . 4.107 3.838 3.145 4.362 0.255 6 0 "[ . 1 . 2]" 1
15 1 23 ARG HB2 1 25 VAL MG1 3.018 . 4.157 3.824 3.367 4.160 0.003 12 0 "[ . 1 . 2]" 1
16 1 23 ARG HB2 1 24 MET H 2.825 . 3.823 4.080 3.817 4.264 0.441 12 0 "[ . 1 . 2]" 1
17 1 23 ARG HB2 1 40 LYS HG3 2.398 . 3.117 2.518 1.780 3.180 0.063 17 0 "[ . 1 . 2]" 1
18 1 23 ARG HB3 1 24 MET H 2.409 . 3.134 3.243 2.994 3.446 0.312 18 0 "[ . 1 . 2]" 1
19 1 23 ARG HB3 1 40 LYS H 2.513 . 3.302 3.421 3.249 3.523 0.221 20 0 "[ . 1 . 2]" 1
20 1 23 ARG HB3 1 40 LYS HD3 2.748 . 3.692 3.792 3.597 4.593 0.901 18 1 "[ . 1 . + 2]" 1
21 1 23 ARG HB3 1 40 LYS QE 2.547 . 3.358 2.860 1.885 3.396 0.038 9 0 "[ . 1 . 2]" 1
22 1 23 ARG HB3 1 40 LYS HG2 3.585 . 5.192 2.118 1.890 2.617 0.088 13 0 "[ . 1 . 2]" 1
23 1 24 MET H 1 24 MET HB3 2.418 . 3.149 3.005 2.692 3.914 0.765 16 2 "[ . 1 -.+ 2]" 1
24 1 24 MET H 1 25 VAL QG 2.801 . 3.781 3.784 3.601 4.021 0.240 6 0 "[ . 1 . 2]" 1
25 1 24 MET H 1 36 ASN QB 3.311 . 4.682 5.463 4.870 6.123 1.441 14 13 "[** *.*- *** *+.* **2]" 1
26 1 24 MET H 1 37 GLU H 3.494 . 5.020 4.601 4.250 4.986 . 0 0 "[ . 1 . 2]" 1
27 1 24 MET H 1 38 MET H 3.080 . 4.266 4.433 4.328 4.529 0.263 20 0 "[ . 1 . 2]" 1
28 1 24 MET H 1 39 VAL MG1 2.323 . 2.998 3.092 2.949 3.256 0.258 5 0 "[ . 1 . 2]" 1
29 1 24 MET H 1 40 LYS H 2.751 . 3.697 3.503 2.746 3.827 0.130 15 0 "[ . 1 . 2]" 1
30 1 25 VAL H 1 25 VAL HA 2.929 . 4.002 2.919 2.906 2.929 . 0 0 "[ . 1 . 2]" 1
31 1 25 VAL H 1 25 VAL HB 2.961 . 4.057 3.721 3.005 3.924 . 0 0 "[ . 1 . 2]" 1
32 1 25 VAL H 1 25 VAL QG 2.275 . 2.922 2.085 1.875 2.351 . 0 0 "[ . 1 . 2]" 1
33 1 25 VAL H 1 26 ASN H 3.142 . 4.376 3.955 3.806 4.144 . 0 0 "[ . 1 . 2]" 1
34 1 25 VAL H 1 111 LEU H 4.319 . 6.651 5.256 5.011 5.425 . 0 0 "[ . 1 . 2]" 1
35 1 25 VAL H 1 40 LYS HG3 3.589 . 5.199 4.423 4.084 4.688 . 0 0 "[ . 1 . 2]" 1
36 1 25 VAL H 1 111 LEU QD 4.076 . 6.152 5.780 4.676 6.425 0.273 6 0 "[ . 1 . 2]" 1
37 1 25 VAL HA 1 25 VAL HB 2.314 . 2.983 2.549 2.344 2.955 . 0 0 "[ . 1 . 2]" 1
38 1 25 VAL HA 1 25 VAL QG 2.220 . 2.279 2.184 2.038 2.345 0.066 6 0 "[ . 1 . 2]" 1
39 1 25 VAL HA 1 26 ASN H 2.276 . 2.923 2.054 2.010 2.115 . 0 0 "[ . 1 . 2]" 1
40 1 25 VAL HA 1 26 ASN HA 2.998 . 4.121 4.132 4.045 4.230 0.109 6 0 "[ . 1 . 2]" 1
41 1 25 VAL HA 1 26 ASN QB 2.902 . 3.955 4.239 4.175 4.388 0.433 20 0 "[ . 1 . 2]" 1
42 1 25 VAL HA 1 38 MET HA 2.859 . 3.881 3.727 3.329 3.951 0.070 6 0 "[ . 1 . 2]" 1
43 1 25 VAL HA 1 111 LEU QD 3.345 . 4.744 4.225 2.613 4.764 0.020 10 0 "[ . 1 . 2]" 1
44 1 25 VAL HB 1 25 VAL QG 1.978 . 2.467 1.886 1.881 1.894 . 0 0 "[ . 1 . 2]" 1
45 1 25 VAL HB 1 26 ASN H 2.957 . 4.050 3.774 3.677 4.104 0.054 3 0 "[ . 1 . 2]" 1
46 1 25 VAL HB 1 26 ASN HA 3.321 . 4.699 4.085 3.828 4.651 . 0 0 "[ . 1 . 2]" 1
47 1 25 VAL HB 1 111 LEU H 3.375 . 4.799 3.523 3.298 3.758 . 0 0 "[ . 1 . 2]" 1
48 1 25 VAL HB 1 111 LEU HB2 2.223 . 2.841 2.081 1.805 2.443 . 0 0 "[ . 1 . 2]" 1
49 1 25 VAL HB 1 111 LEU HB3 2.613 . 3.466 3.383 2.388 3.628 0.162 3 0 "[ . 1 . 2]" 1
50 1 25 VAL HB 1 111 LEU QD 2.659 . 3.543 3.045 1.799 3.609 0.066 3 0 "[ . 1 . 2]" 1
51 1 25 VAL QG 1 44 ALA MB 2.363 . 3.061 2.935 2.128 3.428 0.367 5 0 "[ . 1 . 2]" 1
52 1 25 VAL QG 1 26 ASN H 2.501 . 3.283 2.974 2.494 3.229 . 0 0 "[ . 1 . 2]" 1
53 1 25 VAL QG 1 26 ASN HA 3.093 . 4.289 3.961 3.375 4.153 . 0 0 "[ . 1 . 2]" 1
54 1 25 VAL QG 1 26 ASN QB 3.253 . 4.576 4.165 3.878 4.311 . 0 0 "[ . 1 . 2]" 1
55 1 25 VAL QG 1 27 LEU H 3.043 . 4.201 3.945 3.460 4.101 . 0 0 "[ . 1 . 2]" 1
56 1 25 VAL QG 1 38 MET HA 2.115 . 2.674 2.548 1.978 2.895 0.221 9 0 "[ . 1 . 2]" 1
57 1 25 VAL QG 1 39 VAL HA 2.960 . 4.055 4.485 4.201 5.088 1.033 2 2 "[ + . 1 . - 2]" 1
58 1 25 VAL QG 1 40 LYS H 3.799 . 5.603 3.493 2.988 3.857 . 0 0 "[ . 1 . 2]" 1
59 1 25 VAL QG 1 110 ARG H 3.869 . 5.740 5.226 4.601 5.629 . 0 0 "[ . 1 . 2]" 1
60 1 25 VAL QG 1 111 LEU H 3.275 . 4.616 3.747 2.820 4.180 . 0 0 "[ . 1 . 2]" 1
61 1 25 VAL QG 1 111 LEU HB2 2.344 . 3.031 2.646 1.911 2.955 . 0 0 "[ . 1 . 2]" 1
62 1 25 VAL QG 1 111 LEU HB3 2.634 . 3.501 3.012 2.514 3.222 . 0 0 "[ . 1 . 2]" 1
63 1 26 ASN H 1 26 ASN HA 2.623 . 3.483 2.852 2.834 2.867 . 0 0 "[ . 1 . 2]" 1
64 1 26 ASN H 1 26 ASN QB 2.456 . 3.210 2.798 2.737 3.124 . 0 0 "[ . 1 . 2]" 1
65 1 26 ASN H 1 27 LEU H 3.605 . 5.230 3.774 3.700 4.091 . 0 0 "[ . 1 . 2]" 1
66 1 26 ASN H 1 27 LEU QD 3.536 . 5.098 2.726 2.375 3.660 . 0 0 "[ . 1 . 2]" 1
67 1 26 ASN H 1 28 GLU HB2 4.107 . 6.215 6.348 6.242 6.500 0.285 20 0 "[ . 1 . 2]" 1
68 1 26 ASN H 1 110 ARG HB3 3.924 . 5.849 5.052 4.731 5.296 . 0 0 "[ . 1 . 2]" 1
69 1 26 ASN HA 1 26 ASN QB 2.481 . 3.251 2.392 2.184 2.457 . 0 0 "[ . 1 . 2]" 1
70 1 26 ASN HA 1 27 LEU H 2.168 . 2.756 2.163 2.100 2.212 . 0 0 "[ . 1 . 2]" 1
71 1 26 ASN HA 1 27 LEU HB2 3.338 . 4.731 4.451 4.239 4.669 . 0 0 "[ . 1 . 2]" 1
72 1 26 ASN HA 1 27 LEU HG 3.793 . 5.591 5.200 3.626 5.810 0.219 7 0 "[ . 1 . 2]" 1
73 1 26 ASN HA 1 109 PHE H 4.279 . 6.567 5.557 5.046 5.789 . 0 0 "[ . 1 . 2]" 1
74 1 26 ASN HA 1 110 ARG HA 2.460 . 3.216 3.262 3.072 3.374 0.158 4 0 "[ . 1 . 2]" 1
75 1 26 ASN HA 1 110 ARG QB 2.726 . 3.655 3.836 3.473 4.074 0.419 13 0 "[ . 1 . 2]" 1
76 1 26 ASN HA 1 111 LEU H 3.363 . 4.777 3.710 3.189 4.110 . 0 0 "[ . 1 . 2]" 1
77 1 26 ASN QB 1 27 LEU H 3.151 . 4.392 3.853 3.488 3.925 . 0 0 "[ . 1 . 2]" 1
78 1 26 ASN QB 1 28 GLU HB2 3.168 . 4.422 4.486 4.198 4.591 0.169 19 0 "[ . 1 . 2]" 1
79 1 27 LEU H 1 27 LEU HB2 3.568 . 5.160 2.376 2.212 2.541 . 0 0 "[ . 1 . 2]" 1
80 1 27 LEU H 1 27 LEU HB3 3.254 . 4.578 3.598 3.496 3.671 . 0 0 "[ . 1 . 2]" 1
81 1 27 LEU H 1 27 LEU QD 3.220 . 4.516 2.557 2.192 3.389 . 0 0 "[ . 1 . 2]" 1
82 1 27 LEU H 1 27 LEU HG 3.157 . 4.403 3.744 2.353 4.394 . 0 0 "[ . 1 . 2]" 1
83 1 27 LEU H 1 28 GLU H 3.485 . 5.003 4.204 3.745 4.375 . 0 0 "[ . 1 . 2]" 1
84 1 27 LEU H 1 94 LEU MD1 3.278 . 4.621 4.662 4.286 4.717 0.096 13 0 "[ . 1 . 2]" 1
85 1 27 LEU H 1 110 ARG QD 3.639 . 5.294 3.768 2.825 4.829 . 0 0 "[ . 1 . 2]" 1
86 1 27 LEU H 1 97 ILE MD 4.094 . 6.189 4.583 4.412 4.824 . 0 0 "[ . 1 . 2]" 1
87 1 27 LEU H 1 109 PHE H 3.294 . 4.650 3.561 3.164 3.853 . 0 0 "[ . 1 . 2]" 1
88 1 27 LEU H 1 109 PHE QB 4.031 . 6.062 3.934 3.502 4.105 . 0 0 "[ . 1 . 2]" 1
89 1 27 LEU H 1 110 ARG H 4.573 . 7.187 4.878 4.724 5.176 . 0 0 "[ . 1 . 2]" 1
90 1 27 LEU H 1 110 ARG HA 3.511 . 5.052 2.977 2.725 3.455 . 0 0 "[ . 1 . 2]" 1
91 1 27 LEU H 1 111 LEU H 3.469 . 4.973 4.285 3.671 4.923 . 0 0 "[ . 1 . 2]" 1
92 1 27 LEU HA 1 27 LEU HB2 2.727 . 3.657 2.992 2.968 3.012 . 0 0 "[ . 1 . 2]" 1
93 1 27 LEU HA 1 27 LEU HB3 2.703 . 3.616 2.539 2.416 2.635 . 0 0 "[ . 1 . 2]" 1
94 1 27 LEU HA 1 27 LEU QD 2.099 . 2.650 2.207 1.816 2.593 . 0 0 "[ . 1 . 2]" 1
95 1 27 LEU HA 1 28 GLU H 2.354 . 3.047 2.138 2.041 2.292 . 0 0 "[ . 1 . 2]" 1
96 1 27 LEU HB2 1 27 LEU QD 1.976 . 2.464 2.214 2.075 2.510 0.046 6 0 "[ . 1 . 2]" 1
97 1 27 LEU HB2 1 109 PHE H 1.919 . 2.379 2.452 2.110 2.639 0.260 15 0 "[ . 1 . 2]" 1
98 1 27 LEU HB2 1 109 PHE QB 3.148 . 4.387 1.853 1.671 2.031 0.238 2 0 "[ . 1 . 2]" 1
99 1 27 LEU HB2 1 109 PHE QD 2.946 . 4.031 3.663 3.414 3.905 . 0 0 "[ . 1 . 2]" 1
100 1 27 LEU HB3 1 27 LEU QD 3.061 . 4.232 2.273 2.068 2.418 . 0 0 "[ . 1 . 2]" 1
101 1 27 LEU HB3 1 27 LEU HG 2.922 . 3.989 2.569 2.337 3.017 . 0 0 "[ . 1 . 2]" 1
102 1 27 LEU HB3 1 28 GLU H 3.098 . 4.297 3.672 3.292 4.107 . 0 0 "[ . 1 . 2]" 1
103 1 27 LEU HB3 1 109 PHE H 2.296 . 2.955 3.006 2.707 3.203 0.248 1 0 "[ . 1 . 2]" 1
104 1 27 LEU HB3 1 109 PHE QB 3.477 . 4.988 2.443 2.261 2.592 . 0 0 "[ . 1 . 2]" 1
105 1 27 LEU HB3 1 109 PHE QD 3.493 . 5.019 4.275 3.771 4.509 . 0 0 "[ . 1 . 2]" 1
106 1 27 LEU QD 1 27 LEU HG 2.019 . 2.528 1.888 1.871 1.894 . 0 0 "[ . 1 . 2]" 1
107 1 27 LEU QD 1 28 GLU H 2.899 . 3.949 3.885 3.239 4.172 0.223 10 0 "[ . 1 . 2]" 1
108 1 27 LEU QD 1 68 MET QG 2.758 . 3.709 3.571 2.851 3.735 0.026 3 0 "[ . 1 . 2]" 1
109 1 27 LEU QD 1 109 PHE QD 2.272 . 2.917 1.846 1.655 2.679 . 0 0 "[ . 1 . 2]" 1
110 1 27 LEU HG 1 28 GLU H 3.931 . 5.862 4.740 4.169 5.530 . 0 0 "[ . 1 . 2]" 1
111 1 28 GLU H 1 28 GLU HB2 2.846 . 3.858 3.062 2.770 3.281 . 0 0 "[ . 1 . 2]" 1
112 1 28 GLU H 1 28 GLU QG 3.557 . 5.138 4.210 4.082 4.367 . 0 0 "[ . 1 . 2]" 1
113 1 28 GLU H 1 29 PRO HA 3.412 . 4.867 4.672 4.344 4.972 0.105 10 0 "[ . 1 . 2]" 1
114 1 28 GLU H 1 31 MET H 3.564 . 5.152 5.068 4.864 5.240 0.088 19 0 "[ . 1 . 2]" 1
115 1 28 GLU H 1 31 MET ME 1.823 . 2.238 1.994 1.615 2.263 0.025 15 0 "[ . 1 . 2]" 1
116 1 28 GLU H 1 31 MET QG 2.036 . 2.554 2.674 2.591 2.825 0.271 6 0 "[ . 1 . 2]" 1
117 1 28 GLU H 1 33 ILE MD 3.134 . 4.362 4.253 3.886 4.448 0.086 2 0 "[ . 1 . 2]" 1
118 1 28 GLU H 1 94 LEU QD 3.808 . 4.114 3.253 2.769 3.746 . 0 0 "[ . 1 . 2]" 1
119 1 28 GLU H 1 97 ILE MD 3.120 . 4.337 3.178 2.791 3.913 . 0 0 "[ . 1 . 2]" 1
120 1 28 GLU H 1 109 PHE H 3.871 . 5.744 4.610 4.271 5.049 . 0 0 "[ . 1 . 2]" 1
121 1 28 GLU HA 1 28 GLU HB2 2.116 . 2.676 2.580 2.440 2.677 0.001 8 0 "[ . 1 . 2]" 1
122 1 28 GLU HA 1 28 GLU HB3 2.548 . 3.360 3.010 2.981 3.029 . 0 0 "[ . 1 . 2]" 1
123 1 28 GLU HA 1 29 PRO QD 2.068 . 2.603 1.841 1.696 1.922 . 0 0 "[ . 1 . 2]" 1
124 1 28 GLU HA 1 29 PRO HG2 3.090 . 4.284 4.165 3.957 4.249 . 0 0 "[ . 1 . 2]" 1
125 1 28 GLU HA 1 29 PRO HG3 3.113 . 4.324 4.306 4.145 4.429 0.105 15 0 "[ . 1 . 2]" 1
126 1 28 GLU HA 1 97 ILE MD 2.271 . 2.916 3.199 2.963 4.079 1.163 14 1 "[ . 1 +. 2]" 1
127 1 28 GLU HA 1 108 PHE HA 2.555 . 3.371 2.770 2.324 3.465 0.094 6 0 "[ . 1 . 2]" 1
128 1 28 GLU HA 1 109 PHE H 3.203 . 4.485 3.526 3.191 4.248 . 0 0 "[ . 1 . 2]" 1
129 1 28 GLU HB2 1 108 PHE HA 2.637 . 3.506 3.680 3.563 3.856 0.350 12 0 "[ . 1 . 2]" 1
130 1 28 GLU QG 1 108 PHE HA 3.399 . 4.843 3.425 2.779 4.048 . 0 0 "[ . 1 . 2]" 1
131 1 28 GLU QG 1 108 PHE QB 3.171 . 4.428 3.201 1.976 4.485 0.057 6 0 "[ . 1 . 2]" 1
132 1 28 GLU QG 1 109 PHE H 3.879 . 5.759 4.717 4.311 5.310 . 0 0 "[ . 1 . 2]" 1
133 1 29 PRO HA 1 29 PRO HB3 2.140 . 2.712 2.317 2.311 2.332 . 0 0 "[ . 1 . 2]" 1
134 1 29 PRO HA 1 30 ASP H 1.962 . 2.443 2.107 2.071 2.157 . 0 0 "[ . 1 . 2]" 1
135 1 29 PRO HA 1 30 ASP HB3 3.221 . 4.517 4.710 4.671 4.765 0.248 1 0 "[ . 1 . 2]" 1
136 1 29 PRO HA 1 31 MET H 2.726 . 3.655 3.551 3.129 3.800 0.145 8 0 "[ . 1 . 2]" 1
137 1 29 PRO HA 1 94 LEU QD 2.590 . 3.428 1.899 1.699 2.197 0.053 19 0 "[ . 1 . 2]" 1
138 1 29 PRO HA 1 95 ALA HA 2.419 . 3.150 3.145 2.747 3.431 0.281 12 0 "[ . 1 . 2]" 1
139 1 29 PRO HA 1 97 ILE MD 2.643 . 3.516 3.572 3.396 3.720 0.204 20 0 "[ . 1 . 2]" 1
140 1 29 PRO HA 1 97 ILE HG13 3.449 . 4.936 4.059 2.931 5.026 0.090 18 0 "[ . 1 . 2]" 1
141 1 29 PRO HB2 1 29 PRO QD 3.027 . 4.172 2.961 2.855 3.132 . 0 0 "[ . 1 . 2]" 1
142 1 29 PRO HB2 1 30 ASP H 3.103 . 4.306 3.926 3.691 4.054 . 0 0 "[ . 1 . 2]" 1
143 1 29 PRO HB3 1 29 PRO QD 2.498 . 3.278 3.531 3.503 3.543 0.265 12 0 "[ . 1 . 2]" 1
144 1 29 PRO HB3 1 29 PRO HG2 2.557 . 3.374 2.645 2.609 2.688 . 0 0 "[ . 1 . 2]" 1
145 1 29 PRO HB3 1 30 ASP H 2.686 . 3.588 3.278 2.942 3.501 . 0 0 "[ . 1 . 2]" 1
146 1 29 PRO HB3 1 30 ASP HB2 3.334 . 4.723 4.444 4.055 4.621 . 0 0 "[ . 1 . 2]" 1
147 1 29 PRO HB3 1 31 MET H 3.859 . 5.721 5.421 4.940 5.698 . 0 0 "[ . 1 . 2]" 1
148 1 29 PRO HB3 1 96 THR H 4.136 . 6.275 4.241 3.848 4.437 . 0 0 "[ . 1 . 2]" 1
149 1 29 PRO HB3 1 96 THR HA 2.911 . 3.970 2.409 1.858 3.224 . 0 0 "[ . 1 . 2]" 1
150 1 29 PRO HB3 1 96 THR MG 2.940 . 4.020 3.435 3.075 3.838 . 0 0 "[ . 1 . 2]" 1
151 1 29 PRO HB3 1 97 ILE MD 3.830 . 5.663 4.583 4.425 4.779 . 0 0 "[ . 1 . 2]" 1
152 1 29 PRO QD 1 29 PRO HG2 2.103 . 2.656 2.178 2.165 2.202 . 0 0 "[ . 1 . 2]" 1
153 1 29 PRO QD 1 31 MET ME 2.855 . 3.874 4.001 3.573 4.284 0.410 9 0 "[ . 1 . 2]" 1
154 1 29 PRO QD 1 106 PHE HB3 3.104 . 4.309 4.266 3.437 4.706 0.397 6 0 "[ . 1 . 2]" 1
155 1 29 PRO QD 1 107 GLY HA2 3.107 . 4.314 3.258 1.627 4.369 0.273 5 0 "[ . 1 . 2]" 1
156 1 29 PRO QD 1 109 PHE H 2.424 . 3.158 3.621 3.266 4.831 1.673 6 4 "[ * *+ 1 - 2]" 1
157 1 29 PRO HD3 1 29 PRO HG3 2.606 . 3.455 2.272 2.230 2.303 . 0 0 "[ . 1 . 2]" 1
158 1 29 PRO HD3 1 97 ILE MD 2.480 . 3.249 1.940 1.633 2.601 0.078 20 0 "[ . 1 . 2]" 1
159 1 29 PRO HD3 1 97 ILE HG13 3.464 . 4.964 2.804 2.156 3.971 . 0 0 "[ . 1 . 2]" 1
160 1 29 PRO HG2 1 97 ILE MD 3.182 . 4.448 3.876 3.276 4.489 0.041 14 0 "[ . 1 . 2]" 1
161 1 29 PRO HG2 1 107 GLY HA2 3.229 . 4.532 2.938 1.877 3.827 0.049 12 0 "[ . 1 . 2]" 1
162 1 29 PRO HG3 1 30 ASP H 3.778 . 5.562 4.668 4.455 4.810 . 0 0 "[ . 1 . 2]" 1
163 1 29 PRO HG3 1 97 ILE H 3.565 . 5.154 2.594 2.183 3.423 . 0 0 "[ . 1 . 2]" 1
164 1 29 PRO HG3 1 97 ILE MD 3.420 . 4.882 2.949 2.525 3.335 . 0 0 "[ . 1 . 2]" 1
165 1 30 ASP H 1 30 ASP HA 2.037 . 2.556 2.254 2.244 2.263 . 0 0 "[ . 1 . 2]" 1
166 1 30 ASP H 1 30 ASP HB2 2.850 . 3.865 3.215 3.119 3.280 . 0 0 "[ . 1 . 2]" 1
167 1 30 ASP H 1 30 ASP HB3 2.759 . 3.711 3.600 3.547 3.653 . 0 0 "[ . 1 . 2]" 1
168 1 30 ASP H 1 31 MET H 2.458 . 3.213 2.429 2.322 2.574 . 0 0 "[ . 1 . 2]" 1
169 1 30 ASP H 1 94 LEU H 3.890 . 5.782 5.524 5.009 5.798 0.016 7 0 "[ . 1 . 2]" 1
170 1 30 ASP H 1 94 LEU HB2 4.084 . 6.168 5.326 4.833 5.586 . 0 0 "[ . 1 . 2]" 1
171 1 30 ASP H 1 94 LEU QD 3.428 . 4.897 2.305 1.931 2.978 0.068 17 0 "[ . 1 . 2]" 1
172 1 30 ASP H 1 95 ALA HA 3.146 . 4.384 2.651 2.216 3.265 . 0 0 "[ . 1 . 2]" 1
173 1 30 ASP H 1 95 ALA MB 3.536 . 5.099 4.148 3.906 4.588 . 0 0 "[ . 1 . 2]" 1
174 1 30 ASP H 1 96 THR MG 3.706 . 5.423 4.761 4.354 5.408 . 0 0 "[ . 1 . 2]" 1
175 1 30 ASP HA 1 30 ASP HB2 2.054 . 2.581 2.431 2.401 2.471 . 0 0 "[ . 1 . 2]" 1
176 1 30 ASP HA 1 30 ASP HB3 2.257 . 2.894 3.000 2.997 3.004 0.110 7 0 "[ . 1 . 2]" 1
177 1 30 ASP HA 1 31 MET H 2.363 . 3.061 2.691 2.549 2.865 . 0 0 "[ . 1 . 2]" 1
178 1 30 ASP HB2 1 31 MET H 3.128 . 4.351 4.534 4.503 4.569 0.218 14 0 "[ . 1 . 2]" 1
179 1 30 ASP HB3 1 31 MET H 3.141 . 4.375 4.213 4.084 4.308 . 0 0 "[ . 1 . 2]" 1
180 1 31 MET H 1 31 MET HA 2.211 . 2.822 2.924 2.916 2.934 0.112 8 0 "[ . 1 . 2]" 1
181 1 31 MET H 1 31 MET HB3 2.458 . 3.213 3.163 2.947 3.227 0.014 20 0 "[ . 1 . 2]" 1
182 1 31 MET H 1 31 MET QG 2.644 . 3.518 2.412 2.194 3.271 . 0 0 "[ . 1 . 2]" 1
183 1 31 MET H 1 32 THR H 3.440 . 4.920 4.455 4.428 4.480 . 0 0 "[ . 1 . 2]" 1
184 1 31 MET H 1 33 ILE MG 3.205 . 4.489 4.493 4.088 4.679 0.190 5 0 "[ . 1 . 2]" 1
185 1 31 MET H 1 93 HIS HA 3.978 . 5.956 5.509 5.250 5.705 . 0 0 "[ . 1 . 2]" 1
186 1 31 MET H 1 94 LEU H 3.088 . 4.280 4.090 3.837 4.253 . 0 0 "[ . 1 . 2]" 1
187 1 31 MET H 1 94 LEU HB2 3.138 . 4.369 4.315 4.100 4.445 0.076 11 0 "[ . 1 . 2]" 1
188 1 31 MET H 1 94 LEU HB3 3.044 . 4.202 2.615 2.366 2.760 . 0 0 "[ . 1 . 2]" 1
189 1 31 MET H 1 94 LEU QD 2.843 . 3.853 2.842 2.584 3.188 . 0 0 "[ . 1 . 2]" 1
190 1 31 MET H 1 97 ILE MD 3.942 . 5.885 5.578 5.365 5.823 . 0 0 "[ . 1 . 2]" 1
191 1 31 MET HA 1 31 MET HB2 2.209 . 2.819 2.434 2.316 2.476 . 0 0 "[ . 1 . 2]" 1
192 1 31 MET HA 1 31 MET HB3 2.179 . 2.773 2.407 2.360 2.507 . 0 0 "[ . 1 . 2]" 1
193 1 31 MET HA 1 31 MET QG 2.532 . 3.333 3.313 3.268 3.424 0.091 10 0 "[ . 1 . 2]" 1
194 1 31 MET HA 1 32 THR H 1.822 . 2.237 2.341 2.311 2.358 0.121 3 0 "[ . 1 . 2]" 1
195 1 31 MET HB2 1 32 THR H 1.890 . 2.337 2.448 2.402 2.474 0.137 12 0 "[ . 1 . 2]" 1
196 1 31 MET HB2 1 33 ILE HB 3.247 . 4.565 3.564 3.126 4.191 . 0 0 "[ . 1 . 2]" 1
197 1 31 MET HB2 1 33 ILE MG 3.237 . 4.547 4.432 3.824 4.768 0.221 17 0 "[ . 1 . 2]" 1
198 1 31 MET HB2 1 94 LEU QD 3.148 . 4.387 4.564 4.367 5.267 0.880 14 3 "[ . * +. - 2]" 1
199 1 31 MET HB3 1 32 THR H 2.711 . 3.630 3.730 3.675 3.821 0.191 14 0 "[ . 1 . 2]" 1
200 1 31 MET QG 1 32 THR H 2.890 . 3.934 3.645 3.186 3.815 . 0 0 "[ . 1 . 2]" 1
201 1 31 MET QG 1 33 ILE HA 3.531 . 5.089 4.684 3.670 5.009 . 0 0 "[ . 1 . 2]" 1
202 1 31 MET QG 1 33 ILE HB 2.947 . 4.032 2.648 2.125 2.918 . 0 0 "[ . 1 . 2]" 1
203 1 31 MET QG 1 33 ILE MD 3.164 . 4.415 3.009 2.330 3.518 . 0 0 "[ . 1 . 2]" 1
204 1 31 MET QG 1 33 ILE MG 2.283 . 2.935 2.732 2.323 2.918 . 0 0 "[ . 1 . 2]" 1
205 1 31 MET QG 1 94 LEU HB2 3.263 . 4.594 3.058 2.700 3.900 . 0 0 "[ . 1 . 2]" 1
206 1 31 MET QG 1 94 LEU HB3 3.034 . 4.185 2.077 1.773 3.376 0.110 2 0 "[ . 1 . 2]" 1
207 1 31 MET QG 1 94 LEU QD 3.214 . 4.505 2.305 1.985 3.579 . 0 0 "[ . 1 . 2]" 1
208 1 32 THR H 1 32 THR HA 2.258 . 2.896 2.925 2.914 2.933 0.037 5 0 "[ . 1 . 2]" 1
209 1 32 THR H 1 32 THR HB 1.992 . 2.488 2.643 2.605 2.684 0.196 18 0 "[ . 1 . 2]" 1
210 1 32 THR H 1 32 THR MG 2.817 . 3.809 3.839 3.818 3.849 0.040 8 0 "[ . 1 . 2]" 1
211 1 32 THR H 1 33 ILE H 3.446 . 4.930 3.930 3.662 4.325 . 0 0 "[ . 1 . 2]" 1
212 1 32 THR H 1 33 ILE HG13 3.519 . 5.067 5.405 5.271 5.526 0.459 17 0 "[ . 1 . 2]" 1
213 1 32 THR H 1 33 ILE HG13 3.502 . 5.035 5.479 5.402 5.620 0.585 17 3 "[ -. * . + 2]" 1
214 1 32 THR HA 1 32 THR MG 1.986 . 2.479 2.291 2.259 2.322 . 0 0 "[ . 1 . 2]" 1
215 1 32 THR HA 1 33 ILE H 1.912 . 2.369 2.158 2.119 2.227 . 0 0 "[ . 1 . 2]" 1
216 1 32 THR HA 1 33 ILE MG 3.041 . 4.197 3.696 3.459 3.842 . 0 0 "[ . 1 . 2]" 1
217 1 32 THR HA 1 93 HIS HA 2.095 . 2.644 2.247 2.071 2.353 . 0 0 "[ . 1 . 2]" 1
218 1 32 THR HA 1 93 HIS HB2 2.594 . 3.435 2.324 2.021 2.743 . 0 0 "[ . 1 . 2]" 1
219 1 32 THR HA 1 93 HIS HB3 2.577 . 3.407 2.511 2.181 2.761 . 0 0 "[ . 1 . 2]" 1
220 1 32 THR HB 1 32 THR MG 1.787 . 2.186 2.144 2.140 2.147 . 0 0 "[ . 1 . 2]" 1
221 1 32 THR MG 1 33 ILE H 2.602 . 3.448 3.356 2.882 3.569 0.121 17 0 "[ . 1 . 2]" 1
222 1 32 THR MG 1 35 LYS H 3.374 . 4.797 5.046 4.902 5.470 0.673 18 2 "[ - . 1 . + 2]" 1
223 1 32 THR MG 1 92 ASP HB2 2.990 . 4.107 4.069 3.790 4.182 0.075 18 0 "[ . 1 . 2]" 1
224 1 32 THR MG 1 92 ASP HB3 3.015 . 4.151 3.352 2.967 3.625 . 0 0 "[ . 1 . 2]" 1
225 1 32 THR MG 1 93 HIS H 3.150 . 4.390 4.535 4.480 4.564 0.174 12 0 "[ . 1 . 2]" 1
226 1 32 THR MG 1 93 HIS HA 2.546 . 3.356 3.011 2.872 3.145 . 0 0 "[ . 1 . 2]" 1
227 1 32 THR MG 1 93 HIS HB2 3.043 . 4.201 3.229 2.917 3.665 . 0 0 "[ . 1 . 2]" 1
228 1 32 THR MG 1 93 HIS HB3 2.847 . 3.860 2.060 1.921 2.353 . 0 0 "[ . 1 . 2]" 1
229 1 33 ILE H 1 33 ILE HB 2.882 . 3.920 2.907 2.732 3.148 . 0 0 "[ . 1 . 2]" 1
230 1 33 ILE H 1 33 ILE MD 3.371 . 4.792 4.532 4.347 4.741 . 0 0 "[ . 1 . 2]" 1
231 1 33 ILE H 1 33 ILE HG12 3.715 . 5.440 4.578 4.444 4.718 . 0 0 "[ . 1 . 2]" 1
232 1 33 ILE H 1 33 ILE HG13 3.536 . 5.099 4.408 4.336 4.533 . 0 0 "[ . 1 . 2]" 1
233 1 33 ILE H 1 33 ILE MG 1.730 . 2.104 2.009 1.772 2.249 0.145 14 0 "[ . 1 . 2]" 1
234 1 33 ILE H 1 93 HIS H 3.746 . 5.500 5.297 4.834 5.624 0.124 2 0 "[ . 1 . 2]" 1
235 1 33 ILE H 1 93 HIS HA 2.199 . 2.803 2.469 2.074 2.760 . 0 0 "[ . 1 . 2]" 1
236 1 33 ILE H 1 93 HIS HB2 3.049 . 4.211 3.934 3.694 4.248 0.037 5 0 "[ . 1 . 2]" 1
237 1 33 ILE H 1 93 HIS HB3 3.127 . 4.350 4.138 3.655 4.387 0.037 12 0 "[ . 1 . 2]" 1
238 1 33 ILE H 1 94 LEU H 2.815 . 3.805 2.332 2.124 2.588 . 0 0 "[ . 1 . 2]" 1
239 1 33 ILE H 1 94 LEU HA 4.220 . 6.447 4.904 4.695 5.168 . 0 0 "[ . 1 . 2]" 1
240 1 33 ILE HA 1 33 ILE HB 2.186 . 2.783 2.472 2.403 2.504 . 0 0 "[ . 1 . 2]" 1
241 1 33 ILE HA 1 33 ILE MD 2.209 . 2.819 3.227 2.919 3.601 0.782 14 6 "[ - . ** 1* +. *]" 1
242 1 33 ILE HA 1 33 ILE HG12 2.634 . 3.501 3.334 3.018 3.557 0.056 17 0 "[ . 1 . 2]" 1
243 1 33 ILE HA 1 33 ILE HG13 2.465 . 3.224 2.165 2.035 2.333 . 0 0 "[ . 1 . 2]" 1
244 1 33 ILE HA 1 33 ILE MG 2.297 . 2.957 3.155 3.136 3.163 0.206 4 0 "[ . 1 . 2]" 1
245 1 33 ILE HA 1 37 GLU QB 3.004 . 4.132 2.869 2.398 3.342 . 0 0 "[ . 1 . 2]" 1
246 1 33 ILE HA 1 37 GLU QB 2.820 . 3.814 2.786 2.386 3.200 . 0 0 "[ . 1 . 2]" 1
247 1 33 ILE HB 1 33 ILE MD 1.895 . 2.344 2.208 2.117 2.347 0.003 11 0 "[ . 1 . 2]" 1
248 1 33 ILE HB 1 33 ILE HG12 2.493 . 3.270 2.930 2.848 3.001 . 0 0 "[ . 1 . 2]" 1
249 1 33 ILE HB 1 33 ILE MG 1.912 . 2.369 2.110 2.095 2.117 . 0 0 "[ . 1 . 2]" 1
250 1 33 ILE MD 1 94 LEU MD1 2.347 . 3.035 3.271 3.086 4.110 1.075 2 1 "[ + . 1 . 2]" 1
251 1 33 ILE MD 1 33 ILE HG12 2.085 . 2.629 2.110 2.100 2.123 . 0 0 "[ . 1 . 2]" 1
252 1 33 ILE MD 1 33 ILE HG13 2.029 . 2.544 2.094 2.081 2.108 . 0 0 "[ . 1 . 2]" 1
253 1 33 ILE MD 1 37 GLU H 3.161 . 4.410 4.554 4.469 4.619 0.209 6 0 "[ . 1 . 2]" 1
254 1 33 ILE MD 1 37 GLU HA 3.126 . 4.348 4.466 4.249 4.577 0.229 11 0 "[ . 1 . 2]" 1
255 1 33 ILE MD 1 37 GLU QB 2.841 . 3.850 2.200 1.983 2.527 . 0 0 "[ . 1 . 2]" 1
256 1 33 ILE MD 1 38 MET H 2.871 . 3.902 2.902 2.617 3.297 . 0 0 "[ . 1 . 2]" 1
257 1 33 ILE MD 1 109 PHE H 3.572 . 5.167 5.400 5.217 5.898 0.731 5 1 "[ + 1 . 2]" 1
258 1 33 ILE MD 1 96 THR H 4.084 . 6.168 6.636 6.459 6.801 0.633 5 4 "[* + 1 * . -2]" 1
259 1 33 ILE HG12 1 33 ILE MG 2.025 . 2.538 2.185 2.134 2.338 . 0 0 "[ . 1 . 2]" 1
260 1 33 ILE HG12 1 37 GLU H 3.282 . 4.628 4.298 3.661 4.734 0.106 2 0 "[ . 1 . 2]" 1
261 1 33 ILE HG12 1 37 GLU QB 2.603 . 3.450 2.752 2.128 3.216 . 0 0 "[ . 1 . 2]" 1
262 1 33 ILE HG12 1 38 MET H 3.277 . 4.619 3.023 2.652 3.277 . 0 0 "[ . 1 . 2]" 1
263 1 33 ILE HG13 1 34 SER H 1.760 . 2.147 1.877 1.585 2.303 0.156 14 0 "[ . 1 . 2]" 1
264 1 33 ILE HG13 1 37 GLU H 3.147 . 4.385 3.756 3.489 4.130 . 0 0 "[ . 1 . 2]" 1
265 1 33 ILE HG13 1 37 GLU QB 3.551 . 5.127 1.808 1.700 2.004 0.275 6 0 "[ . 1 . 2]" 1
266 1 33 ILE HG13 1 38 MET H 3.397 . 4.840 3.104 2.449 4.141 . 0 0 "[ . 1 . 2]" 1
267 1 33 ILE MG 1 37 GLU H 3.765 . 5.537 5.266 4.984 5.518 . 0 0 "[ . 1 . 2]" 1
268 1 33 ILE MG 1 38 MET H 3.468 . 4.972 4.542 4.312 4.812 . 0 0 "[ . 1 . 2]" 1
269 1 33 ILE MG 1 89 PHE QD 3.048 . 4.209 3.470 2.387 3.729 . 0 0 "[ . 1 . 2]" 1
270 1 33 ILE MG 1 89 PHE QE 2.353 . 3.045 2.559 1.802 2.877 . 0 0 "[ . 1 . 2]" 1
271 1 33 ILE MG 1 93 HIS H 3.947 . 5.894 5.426 5.107 5.771 . 0 0 "[ . 1 . 2]" 1
272 1 33 ILE MG 1 93 HIS HA 2.794 . 3.770 3.386 3.131 3.663 . 0 0 "[ . 1 . 2]" 1
273 1 33 ILE MG 1 93 HIS HB3 3.611 . 5.241 5.262 4.955 5.372 0.131 18 0 "[ . 1 . 2]" 1
274 1 33 ILE MG 1 94 LEU H 2.958 . 4.051 2.167 1.975 2.319 . 0 0 "[ . 1 . 2]" 1
275 1 33 ILE MG 1 94 LEU HB2 1.863 . 2.297 1.697 1.590 1.835 . 0 0 "[ . 1 . 2]" 1
276 1 34 SER H 1 35 LYS H 3.849 . 5.700 4.364 4.334 4.404 . 0 0 "[ . 1 . 2]" 1
277 1 34 SER H 1 37 GLU H 1.960 . 2.440 2.586 2.478 2.695 0.255 7 0 "[ . 1 . 2]" 1
278 1 34 SER H 1 37 GLU QB 1.642 . 1.979 1.672 1.463 1.917 . 0 0 "[ . 1 . 2]" 1
279 1 34 SER H 1 38 MET H 1.997 . 2.496 2.894 2.617 3.497 1.001 7 4 "[ * . +* 1 . -]" 1
280 1 34 SER H 1 66 ILE MD 2.776 . 3.739 4.367 3.906 5.444 1.705 14 6 "[ - . ** 1* +. *]" 1
281 1 34 SER HA 1 34 SER HB2 2.300 . 2.961 3.011 3.000 3.019 0.058 1 0 "[ . 1 . 2]" 1
282 1 34 SER HA 1 35 LYS H 2.203 . 2.810 2.480 2.352 2.563 . 0 0 "[ . 1 . 2]" 1
283 1 34 SER HA 1 36 ASN H 3.059 . 4.229 3.844 3.710 4.051 . 0 0 "[ . 1 . 2]" 1
284 1 34 SER HA 1 37 GLU H 3.389 . 4.825 4.135 4.078 4.245 . 0 0 "[ . 1 . 2]" 1
285 1 34 SER HB2 1 35 LYS H 2.539 . 3.345 3.306 3.198 3.448 0.103 7 0 "[ . 1 . 2]" 1
286 1 34 SER HB2 1 35 LYS QB 3.546 . 5.117 4.578 4.299 4.975 . 0 0 "[ . 1 . 2]" 1
287 1 34 SER HB2 1 36 ASN H 1.868 . 2.304 2.200 1.959 2.345 0.041 2 0 "[ . 1 . 2]" 1
288 1 34 SER HB3 1 35 LYS H 2.304 . 2.968 2.396 2.173 2.622 . 0 0 "[ . 1 . 2]" 1
289 1 34 SER HB3 1 35 LYS QB 2.953 . 4.043 4.028 3.727 4.193 0.150 14 0 "[ . 1 . 2]" 1
290 1 34 SER HB3 1 35 LYS QG 3.421 . 4.884 4.139 3.157 4.658 . 0 0 "[ . 1 . 2]" 1
291 1 34 SER HB3 1 36 ASN H 2.661 . 3.546 2.518 2.318 2.762 . 0 0 "[ . 1 . 2]" 1
292 1 34 SER HB3 1 37 GLU H 3.526 . 5.080 3.775 3.595 3.967 . 0 0 "[ . 1 . 2]" 1
293 1 35 LYS H 1 35 LYS QB 2.850 . 3.865 2.598 2.137 2.858 . 0 0 "[ . 1 . 2]" 1
294 1 35 LYS H 1 35 LYS QE 4.435 . 6.894 4.029 2.949 5.445 . 0 0 "[ . 1 . 2]" 1
295 1 35 LYS H 1 35 LYS QG 2.970 . 3.794 2.094 1.747 2.792 0.120 11 0 "[ . 1 . 2]" 1
296 1 35 LYS H 1 36 ASN H 2.855 . 3.874 2.510 2.370 2.708 . 0 0 "[ . 1 . 2]" 1
297 1 35 LYS H 1 36 ASN QB 3.472 . 4.979 4.206 3.880 4.848 . 0 0 "[ . 1 . 2]" 1
298 1 35 LYS H 1 37 GLU H 3.596 . 5.213 4.138 4.055 4.208 . 0 0 "[ . 1 . 2]" 1
299 1 35 LYS H 1 37 GLU QB 3.815 . 5.635 4.979 4.875 5.065 . 0 0 "[ . 1 . 2]" 1
300 1 35 LYS QB 1 35 LYS QG 2.744 . 3.685 2.036 2.001 2.070 . 0 0 "[ . 1 . 2]" 1
301 1 35 LYS QB 1 38 MET HB2 2.694 . 3.601 3.566 3.358 3.836 0.235 6 0 "[ . 1 . 2]" 1
302 1 35 LYS HB3 1 36 ASN H 2.729 . 3.660 3.886 3.692 4.138 0.478 3 0 "[ . 1 . 2]" 1
303 1 35 LYS HB3 1 36 ASN HB3 2.936 . 4.014 3.833 3.508 3.908 . 0 0 "[ . 1 . 2]" 1
304 1 35 LYS QG 1 36 ASN H 2.858 . 3.879 3.837 2.399 4.097 0.218 8 0 "[ . 1 . 2]" 1
305 1 35 LYS QG 1 61 VAL QG 1.812 . 2.222 1.821 1.625 2.396 0.174 14 0 "[ . 1 . 2]" 1
306 1 35 LYS QG 1 61 VAL QG 2.127 . 2.693 1.781 1.618 2.180 . 0 0 "[ . 1 . 2]" 1
307 1 36 ASN H 1 36 ASN HA 2.366 . 3.066 2.882 2.865 2.899 . 0 0 "[ . 1 . 2]" 1
308 1 36 ASN H 1 36 ASN QB 2.169 . 2.757 2.160 1.982 2.727 . 0 0 "[ . 1 . 2]" 1
309 1 36 ASN H 1 37 GLU H 2.646 . 3.521 2.587 2.509 2.666 . 0 0 "[ . 1 . 2]" 1
310 1 36 ASN H 1 37 GLU QB 3.447 . 4.932 4.290 4.199 4.410 . 0 0 "[ . 1 . 2]" 1
311 1 36 ASN H 1 38 MET H 3.925 . 5.851 4.377 3.764 4.691 . 0 0 "[ . 1 . 2]" 1
312 1 36 ASN HA 1 36 ASN QB 2.149 . 2.726 2.435 2.202 2.489 . 0 0 "[ . 1 . 2]" 1
313 1 36 ASN HA 1 37 GLU H 2.624 . 3.485 3.521 3.496 3.565 0.080 6 0 "[ . 1 . 2]" 1
314 1 36 ASN HA 1 38 MET H 3.577 . 5.176 4.974 4.198 5.183 0.007 15 0 "[ . 1 . 2]" 1
315 1 36 ASN HA 1 39 VAL HA 3.655 . 5.325 4.173 3.914 4.351 . 0 0 "[ . 1 . 2]" 1
316 1 36 ASN HA 1 39 VAL HB 2.056 . 2.584 1.821 1.724 1.912 . 0 0 "[ . 1 . 2]" 1
317 1 36 ASN HA 1 39 VAL MG1 2.315 . 2.985 2.493 2.219 2.870 . 0 0 "[ . 1 . 2]" 1
318 1 36 ASN HA 1 39 VAL QG 2.131 . 2.698 2.406 2.186 2.710 0.012 14 0 "[ . 1 . 2]" 1
319 1 36 ASN HA 1 40 LYS H 3.284 . 4.632 4.899 4.705 5.001 0.369 14 0 "[ . 1 . 2]" 1
320 1 36 ASN QB 1 37 GLU H 2.221 . 2.838 2.860 2.733 2.942 0.104 7 0 "[ . 1 . 2]" 1
321 1 36 ASN QB 1 37 GLU HA 3.384 . 4.815 3.915 3.678 4.150 . 0 0 "[ . 1 . 2]" 1
322 1 36 ASN QB 1 37 GLU QB 3.139 . 4.370 4.080 3.873 4.193 . 0 0 "[ . 1 . 2]" 1
323 1 36 ASN QB 1 39 VAL HB 2.683 . 3.583 3.893 3.710 4.002 0.419 15 0 "[ . 1 . 2]" 1
324 1 36 ASN QB 1 39 VAL MG1 2.716 . 3.638 3.700 3.207 3.868 0.230 14 0 "[ . 1 . 2]" 1
325 1 37 GLU H 1 37 GLU HA 2.386 . 3.098 2.870 2.838 2.911 . 0 0 "[ . 1 . 2]" 1
326 1 37 GLU H 1 37 GLU QB 2.270 . 2.914 2.028 1.957 2.211 . 0 0 "[ . 1 . 2]" 1
327 1 37 GLU H 1 38 MET H 2.542 . 3.349 2.415 2.145 2.636 . 0 0 "[ . 1 . 2]" 1
328 1 37 GLU HA 1 37 GLU QB 2.059 . 2.589 2.474 2.403 2.523 . 0 0 "[ . 1 . 2]" 1
329 1 37 GLU HA 1 38 MET H 2.738 . 3.675 3.459 3.377 3.504 . 0 0 "[ . 1 . 2]" 1
330 1 37 GLU HA 1 40 LYS H 2.937 . 4.015 4.217 4.078 4.316 0.301 12 0 "[ . 1 . 2]" 1
331 1 37 GLU HA 1 40 LYS HG2 3.560 . 5.145 4.544 4.324 4.935 . 0 0 "[ . 1 . 2]" 1
332 1 37 GLU QB 1 38 MET H 2.720 . 3.645 2.169 1.916 2.810 . 0 0 "[ . 1 . 2]" 1
333 1 38 MET H 1 38 MET HA 2.363 . 3.061 2.807 2.766 2.893 . 0 0 "[ . 1 . 2]" 1
334 1 38 MET H 1 38 MET HB2 3.004 . 4.132 2.542 2.016 3.637 . 0 0 "[ . 1 . 2]" 1
335 1 38 MET H 1 39 VAL HA 4.077 . 6.155 5.154 4.690 5.330 . 0 0 "[ . 1 . 2]" 1
336 1 38 MET H 1 39 VAL MG1 3.893 . 5.787 4.247 4.143 4.369 . 0 0 "[ . 1 . 2]" 1
337 1 38 MET H 1 40 LYS H 3.220 . 4.516 4.633 4.570 4.717 0.201 3 0 "[ . 1 . 2]" 1
338 1 38 MET H 1 66 ILE MD 3.472 . 4.979 3.668 3.371 4.230 . 0 0 "[ . 1 . 2]" 1
339 1 38 MET H 1 87 LEU QD 4.143 . 6.289 4.892 4.258 5.524 . 0 0 "[ . 1 . 2]" 1
340 1 38 MET H 1 89 PHE HZ 3.661 . 5.336 4.799 4.537 5.362 0.026 2 0 "[ . 1 . 2]" 1
341 1 38 MET HA 1 40 LYS H 3.863 . 5.728 3.780 3.525 4.074 . 0 0 "[ . 1 . 2]" 1
342 1 38 MET HA 1 41 LEU H 2.488 . 3.262 2.768 2.437 3.206 . 0 0 "[ . 1 . 2]" 1
343 1 38 MET HA 1 41 LEU HB2 2.102 . 2.654 2.738 2.370 3.217 0.563 8 1 "[ . + 1 . 2]" 1
344 1 38 MET HA 1 41 LEU HB3 2.332 . 3.012 2.812 2.694 3.009 . 0 0 "[ . 1 . 2]" 1
345 1 38 MET HA 1 42 LEU H 3.132 . 4.358 4.466 4.384 4.540 0.182 8 0 "[ . 1 . 2]" 1
346 1 38 MET HA 1 87 LEU QD 3.503 . 5.037 3.928 3.363 4.485 . 0 0 "[ . 1 . 2]" 1
347 1 38 MET QB 1 40 LYS H 3.956 . 5.912 4.793 4.676 5.036 . 0 0 "[ . 1 . 2]" 1
348 1 38 MET QB 1 41 LEU HB3 2.836 . 3.842 2.879 2.343 3.706 . 0 0 "[ . 1 . 2]" 1
349 1 38 MET QB 1 42 LEU QD 3.609 . 5.237 2.688 2.249 3.461 . 0 0 "[ . 1 . 2]" 1
350 1 38 MET QB 1 42 LEU HG 3.327 . 4.710 3.359 2.589 4.373 . 0 0 "[ . 1 . 2]" 1
351 1 38 MET QB 1 66 ILE MD 2.593 . 3.433 2.021 1.757 3.445 0.012 7 0 "[ . 1 . 2]" 1
352 1 38 MET HB3 1 41 LEU QD 3.008 . 4.139 3.456 2.525 4.705 0.566 17 1 "[ . 1 . + 2]" 1
353 1 38 MET HB3 1 87 LEU QD 2.461 . 3.218 3.015 2.701 3.484 0.266 5 0 "[ . 1 . 2]" 1
354 1 39 VAL HA 1 39 VAL HB 2.339 . 3.023 2.481 2.463 2.504 . 0 0 "[ . 1 . 2]" 1
355 1 39 VAL HA 1 39 VAL MG2 1.878 . 2.319 2.308 2.272 2.334 0.015 11 0 "[ . 1 . 2]" 1
356 1 39 VAL HA 1 40 LYS H 3.304 . 4.669 3.463 3.439 3.491 . 0 0 "[ . 1 . 2]" 1
357 1 39 VAL HA 1 40 LYS QE 3.120 . 4.336 4.335 4.243 4.431 0.095 14 0 "[ . 1 . 2]" 1
358 1 39 VAL HA 1 42 LEU H 2.618 . 3.475 3.394 3.192 3.507 0.032 18 0 "[ . 1 . 2]" 1
359 1 39 VAL HA 1 42 LEU HB2 2.961 . 4.057 2.950 2.545 3.291 . 0 0 "[ . 1 . 2]" 1
360 1 39 VAL HA 1 42 LEU QD . . 2.932 1.931 1.832 2.052 0.035 7 0 "[ . 1 . 2]" 1
361 1 39 VAL HA 1 42 LEU HG 3.496 . 5.024 2.466 2.089 2.660 . 0 0 "[ . 1 . 2]" 1
362 1 39 VAL HA 1 43 GLU H 4.188 . 6.380 4.148 3.851 4.397 . 0 0 "[ . 1 . 2]" 1
363 1 39 VAL HB 1 39 VAL MG1 1.927 . 2.391 2.101 2.081 2.126 . 0 0 "[ . 1 . 2]" 1
364 1 39 VAL HB 1 39 VAL MG2 1.973 . 2.460 2.131 2.128 2.135 . 0 0 "[ . 1 . 2]" 1
365 1 39 VAL HB 1 40 LYS H 2.605 . 3.453 3.679 3.634 3.764 0.311 6 0 "[ . 1 . 2]" 1
366 1 39 VAL HB 1 41 LEU H 4.003 . 6.006 5.877 5.759 6.009 0.003 2 0 "[ . 1 . 2]" 1
367 1 39 VAL MG2 1 40 LYS H 2.630 . 3.494 3.528 3.457 3.632 0.138 6 0 "[ . 1 . 2]" 1
368 1 39 VAL MG2 1 40 LYS HA 2.607 . 3.457 3.635 3.578 3.684 0.227 6 0 "[ . 1 . 2]" 1
369 1 39 VAL MG2 1 40 LYS HD2 3.644 . 5.304 4.903 4.538 5.147 . 0 0 "[ . 1 . 2]" 1
370 1 39 VAL MG2 1 40 LYS QE 2.951 . 4.039 2.478 2.362 2.616 . 0 0 "[ . 1 . 2]" 1
371 1 39 VAL MG2 1 43 GLU H 3.227 . 4.528 3.858 3.563 4.133 . 0 0 "[ . 1 . 2]" 1
372 1 40 LYS H 1 40 LYS HA 2.324 . 2.999 2.820 2.787 2.849 . 0 0 "[ . 1 . 2]" 1
373 1 40 LYS H 1 40 LYS HB2 2.443 . 3.189 2.376 2.286 2.463 . 0 0 "[ . 1 . 2]" 1
374 1 40 LYS H 1 40 LYS HD2 3.571 . 5.165 4.650 4.407 4.874 . 0 0 "[ . 1 . 2]" 1
375 1 40 LYS H 1 40 LYS HD3 3.155 . 4.400 4.381 4.177 4.547 0.147 4 0 "[ . 1 . 2]" 1
376 1 40 LYS H 1 40 LYS QE 3.553 . 5.131 2.861 2.760 2.952 . 0 0 "[ . 1 . 2]" 1
377 1 40 LYS H 1 40 LYS HG2 2.617 . 3.473 2.287 2.129 2.481 . 0 0 "[ . 1 . 2]" 1
378 1 40 LYS H 1 40 LYS HG3 2.622 . 3.482 3.653 3.533 3.793 0.311 18 0 "[ . 1 . 2]" 1
379 1 40 LYS H 1 41 LEU H 2.690 . 3.594 2.750 2.662 2.820 . 0 0 "[ . 1 . 2]" 1
380 1 40 LYS H 1 42 LEU H 3.589 . 5.199 3.782 3.637 3.905 . 0 0 "[ . 1 . 2]" 1
381 1 40 LYS H 1 44 ALA H 4.335 . 6.684 5.332 5.152 5.482 . 0 0 "[ . 1 . 2]" 1
382 1 40 LYS HA 1 40 LYS HB3 2.080 . 2.621 2.493 2.439 2.551 . 0 0 "[ . 1 . 2]" 1
383 1 40 LYS HA 1 40 LYS HD2 2.937 . 4.016 3.606 3.423 3.756 . 0 0 "[ . 1 . 2]" 1
384 1 40 LYS HA 1 40 LYS HD3 2.851 . 3.867 2.475 2.131 2.923 . 0 0 "[ . 1 . 2]" 1
385 1 40 LYS HA 1 40 LYS QE 2.910 . 3.968 1.784 1.621 1.919 0.231 4 0 "[ . 1 . 2]" 1
386 1 40 LYS HA 1 40 LYS HG2 2.578 . 3.409 2.938 2.769 3.029 . 0 0 "[ . 1 . 2]" 1
387 1 40 LYS HA 1 40 LYS HG3 2.607 . 3.457 3.606 3.491 3.682 0.225 6 0 "[ . 1 . 2]" 1
388 1 40 LYS HA 1 41 LEU H 3.006 . 4.136 3.504 3.483 3.526 . 0 0 "[ . 1 . 2]" 1
389 1 40 LYS HA 1 42 LEU H 2.596 . 3.438 3.565 3.527 3.614 0.176 8 0 "[ . 1 . 2]" 1
390 1 40 LYS HA 1 42 LEU HA 3.928 . 5.856 6.037 5.953 6.076 0.220 2 0 "[ . 1 . 2]" 1
391 1 40 LYS HA 1 43 GLU H 3.040 . 4.195 2.974 2.817 3.084 . 0 0 "[ . 1 . 2]" 1
392 1 40 LYS HA 1 43 GLU HA 3.437 . 4.914 4.869 4.518 5.059 0.145 17 0 "[ . 1 . 2]" 1
393 1 40 LYS HA 1 43 GLU QB 2.848 . 3.862 2.114 1.873 2.268 . 0 0 "[ . 1 . 2]" 1
394 1 40 LYS HA 1 44 ALA H 2.763 . 3.717 3.770 3.639 3.845 0.128 13 0 "[ . 1 . 2]" 1
395 1 40 LYS HB3 1 40 LYS HD3 1.979 . 2.468 2.445 2.405 2.503 0.035 19 0 "[ . 1 . 2]" 1
396 1 40 LYS HB3 1 40 LYS QE 2.923 . 3.991 3.405 3.089 3.647 . 0 0 "[ . 1 . 2]" 1
397 1 40 LYS HB3 1 40 LYS HG2 2.181 . 2.775 2.962 2.949 2.970 0.195 2 0 "[ . 1 . 2]" 1
398 1 40 LYS HB3 1 41 LEU H 2.456 . 3.210 3.461 3.373 3.532 0.322 15 0 "[ . 1 . 2]" 1
399 1 40 LYS HB3 1 42 LEU H 3.490 . 5.013 2.773 2.687 2.825 . 0 0 "[ . 1 . 2]" 1
400 1 40 LYS HD2 1 40 LYS QE 2.372 . 3.075 2.455 2.311 2.521 . 0 0 "[ . 1 . 2]" 1
401 1 40 LYS HD3 1 40 LYS QE 2.054 . 2.581 2.201 2.124 2.383 . 0 0 "[ . 1 . 2]" 1
402 1 40 LYS HD3 1 43 GLU QG 3.191 . 4.463 3.802 2.815 4.380 . 0 0 "[ . 1 . 2]" 1
403 1 40 LYS QE 1 40 LYS HG2 2.580 . 3.412 2.246 2.121 2.399 . 0 0 "[ . 1 . 2]" 1
404 1 40 LYS QE 1 40 LYS HG3 2.843 . 3.854 3.300 3.204 3.429 . 0 0 "[ . 1 . 2]" 1
405 1 40 LYS QE 1 42 LEU H 3.302 . 4.665 4.205 3.794 4.425 . 0 0 "[ . 1 . 2]" 1
406 1 40 LYS QE 1 43 GLU H 2.722 . 3.648 3.101 2.453 3.507 . 0 0 "[ . 1 . 2]" 1
407 1 41 LEU H 1 41 LEU HA 2.354 . 3.047 2.750 2.734 2.769 . 0 0 "[ . 1 . 2]" 1
408 1 41 LEU H 1 41 LEU HB2 2.448 . 3.197 2.411 2.171 2.761 . 0 0 "[ . 1 . 2]" 1
409 1 41 LEU H 1 41 LEU HB3 2.309 . 2.976 2.572 2.446 2.663 . 0 0 "[ . 1 . 2]" 1
410 1 41 LEU H 1 41 LEU HG 3.107 . 4.314 4.425 4.331 4.535 0.221 12 0 "[ . 1 . 2]" 1
411 1 41 LEU H 1 42 LEU H 2.696 . 3.604 2.723 2.670 2.778 . 0 0 "[ . 1 . 2]" 1
412 1 41 LEU H 1 42 LEU QD 4.128 . 6.258 4.219 4.128 4.334 . 0 0 "[ . 1 . 2]" 1
413 1 41 LEU H 1 42 LEU HG 3.572 . 5.167 3.852 3.765 4.025 . 0 0 "[ . 1 . 2]" 1
414 1 41 LEU H 1 43 GLU H 4.029 . 6.058 4.262 4.137 4.406 . 0 0 "[ . 1 . 2]" 1
415 1 41 LEU HA 1 41 LEU HB2 2.337 . 3.020 2.448 2.365 2.560 . 0 0 "[ . 1 . 2]" 1
416 1 41 LEU HA 1 41 LEU HB3 2.483 . 3.254 3.003 2.981 3.025 . 0 0 "[ . 1 . 2]" 1
417 1 41 LEU HA 1 41 LEU QD 2.029 . 2.543 2.398 1.945 3.047 0.504 15 1 "[ . 1 + 2]" 1
418 1 41 LEU HA 1 41 LEU HG 2.751 . 3.697 3.011 2.295 3.821 0.124 6 0 "[ . 1 . 2]" 1
419 1 41 LEU HA 1 42 LEU H 3.032 . 4.181 3.449 3.425 3.482 . 0 0 "[ . 1 . 2]" 1
420 1 41 LEU HA 1 44 ALA H 3.144 . 4.379 3.405 3.284 3.513 . 0 0 "[ . 1 . 2]" 1
421 1 41 LEU HA 1 44 ALA MB 1.606 . 1.928 1.983 1.824 2.137 0.209 6 0 "[ . 1 . 2]" 1
422 1 41 LEU HA 1 45 THR H 3.118 . 4.333 3.995 3.869 4.396 0.063 6 0 "[ . 1 . 2]" 1
423 1 41 LEU HB2 1 41 LEU QD 2.046 . 2.569 2.230 2.024 2.490 . 0 0 "[ . 1 . 2]" 1
424 1 41 LEU HB2 1 41 LEU HG 2.305 . 2.969 2.585 2.251 3.021 0.052 8 0 "[ . 1 . 2]" 1
425 1 41 LEU HB2 1 42 LEU H 2.716 . 3.638 3.915 3.739 3.986 0.348 8 0 "[ . 1 . 2]" 1
426 1 41 LEU HB2 1 47 TYR H 3.777 . 5.561 5.696 5.616 5.772 0.211 6 0 "[ . 1 . 2]" 1
427 1 41 LEU HB3 1 41 LEU QD 2.238 . 2.709 2.098 1.952 2.311 . 0 0 "[ . 1 . 2]" 1
428 1 41 LEU HB3 1 42 LEU H 2.835 . 3.840 2.787 2.698 2.840 . 0 0 "[ . 1 . 2]" 1
429 1 41 LEU HB3 1 42 LEU QD 2.952 . 4.041 2.687 2.603 2.865 . 0 0 "[ . 1 . 2]" 1
430 1 41 LEU QD 1 41 LEU HG 2.026 . 2.539 1.873 1.855 1.890 . 0 0 "[ . 1 . 2]" 1
431 1 41 LEU QD 1 42 LEU H 3.234 . 4.541 3.426 3.135 3.696 . 0 0 "[ . 1 . 2]" 1
432 1 41 LEU QD 1 42 LEU HB2 4.017 . 6.035 4.615 4.348 4.926 . 0 0 "[ . 1 . 2]" 1
433 1 41 LEU QD 1 42 LEU QD 1.499 . 1.780 1.756 1.662 1.860 0.080 6 0 "[ . 1 . 2]" 1
434 1 41 LEU QD 1 43 GLU H 4.222 . 6.451 4.764 4.393 5.155 . 0 0 "[ . 1 . 2]" 1
435 1 41 LEU QD 1 45 THR H 3.531 . 5.090 3.625 2.922 4.298 . 0 0 "[ . 1 . 2]" 1
436 1 41 LEU QD 1 45 THR HB 3.563 . 4.391 2.931 2.189 3.748 . 0 0 "[ . 1 . 2]" 1
437 1 41 LEU QD 1 45 THR MG 2.150 . 2.728 2.708 2.327 2.936 0.208 11 0 "[ . 1 . 2]" 1
438 1 41 LEU QD 1 109 PHE HA 3.764 . 5.535 4.966 4.742 5.642 0.107 5 0 "[ . 1 . 2]" 1
439 1 41 LEU QD 1 111 LEU QD 1.625 . 1.955 1.783 1.565 1.968 0.013 10 0 "[ . 1 . 2]" 1
440 1 41 LEU HG 1 42 LEU H 3.832 . 5.667 4.604 3.331 5.158 . 0 0 "[ . 1 . 2]" 1
441 1 42 LEU H 1 42 LEU HA 2.442 . 3.188 2.897 2.887 2.907 . 0 0 "[ . 1 . 2]" 1
442 1 42 LEU H 1 42 LEU HB2 2.563 . 3.384 2.696 2.603 2.806 . 0 0 "[ . 1 . 2]" 1
443 1 42 LEU H 1 42 LEU HB3 2.716 . 3.638 3.637 3.622 3.651 0.013 2 0 "[ . 1 . 2]" 1
444 1 42 LEU H 1 42 LEU QD 2.560 . 3.345 2.892 2.758 2.943 . 0 0 "[ . 1 . 2]" 1
445 1 42 LEU H 1 42 LEU HG 2.443 . 3.189 2.081 1.989 2.170 . 0 0 "[ . 1 . 2]" 1
446 1 42 LEU H 1 43 GLU HA 3.935 . 5.870 4.883 4.832 4.967 . 0 0 "[ . 1 . 2]" 1
447 1 42 LEU H 1 43 GLU QB 2.683 . 3.583 3.710 3.641 3.827 0.244 14 0 "[ . 1 . 2]" 1
448 1 42 LEU H 1 44 ALA H 4.182 . 6.368 3.279 3.171 3.422 . 0 0 "[ . 1 . 2]" 1
449 1 42 LEU H 1 44 ALA MB 2.654 . 3.534 3.870 3.825 3.932 0.398 16 0 "[ . 1 . 2]" 1
450 1 42 LEU HA 1 42 LEU HB3 2.356 . 3.050 2.343 2.301 2.373 . 0 0 "[ . 1 . 2]" 1
451 1 42 LEU HA 1 42 LEU QD 2.095 . 2.644 2.103 1.951 2.398 . 0 0 "[ . 1 . 2]" 1
452 1 42 LEU HA 1 42 LEU HG 2.756 . 3.706 3.295 3.250 3.380 . 0 0 "[ . 1 . 2]" 1
453 1 42 LEU HA 1 43 GLU H 3.526 . 5.080 3.447 3.416 3.483 . 0 0 "[ . 1 . 2]" 1
454 1 42 LEU HA 1 44 ALA H 3.771 . 5.548 3.872 3.715 4.082 . 0 0 "[ . 1 . 2]" 1
455 1 42 LEU HA 1 45 THR H 3.263 . 4.594 2.974 2.874 3.109 . 0 0 "[ . 1 . 2]" 1
456 1 42 LEU HA 1 45 THR HB 2.918 . 3.983 3.632 2.891 4.068 0.085 13 0 "[ . 1 . 2]" 1
457 1 42 LEU HA 1 47 TYR H 3.518 . 5.065 3.435 3.241 3.767 . 0 0 "[ . 1 . 2]" 1
458 1 42 LEU HA 1 47 TYR HB3 3.498 . 5.028 4.291 4.135 4.709 . 0 0 "[ . 1 . 2]" 1
459 1 42 LEU HA 1 59 PHE QD 2.672 . 3.564 3.142 2.976 3.223 . 0 0 "[ . 1 . 2]" 1
460 1 42 LEU HB2 1 42 LEU QD 2.814 . 3.452 2.250 2.154 2.298 . 0 0 "[ . 1 . 2]" 1
461 1 42 LEU HB2 1 43 GLU H 3.332 . 4.720 2.591 2.493 2.731 . 0 0 "[ . 1 . 2]" 1
462 1 42 LEU HB2 1 47 TYR HB2 3.432 . 4.905 5.096 4.983 5.275 0.370 13 0 "[ . 1 . 2]" 1
463 1 42 LEU HB2 1 48 ARG H 3.393 . 4.832 4.333 3.887 4.491 . 0 0 "[ . 1 . 2]" 1
464 1 42 LEU HB2 1 49 GLN H 3.588 . 5.197 4.766 4.416 4.907 . 0 0 "[ . 1 . 2]" 1
465 1 42 LEU HB2 1 59 PHE QE 2.959 . 4.054 3.623 3.410 3.800 . 0 0 "[ . 1 . 2]" 1
466 1 42 LEU HB3 1 42 LEU QD 2.218 . 2.372 2.130 2.097 2.155 . 0 0 "[ . 1 . 2]" 1
467 1 42 LEU HB3 1 43 GLU H 3.354 . 4.760 3.838 3.787 3.930 . 0 0 "[ . 1 . 2]" 1
468 1 42 LEU HB3 1 47 TYR H 3.302 . 4.665 3.640 3.348 3.732 . 0 0 "[ . 1 . 2]" 1
469 1 42 LEU HB3 1 47 TYR HB3 2.994 . 4.114 4.066 3.844 4.179 0.065 6 0 "[ . 1 . 2]" 1
470 1 42 LEU HB3 1 59 PHE QD 3.173 . 4.431 3.329 3.091 3.585 . 0 0 "[ . 1 . 2]" 1
471 1 42 LEU HB3 1 59 PHE QE 2.897 . 3.946 2.090 1.863 2.245 . 0 0 "[ . 1 . 2]" 1
472 1 42 LEU MD1 1 42 LEU MD2 2.019 . 2.528 2.095 2.071 2.117 . 0 0 "[ . 1 . 2]" 1
473 1 42 LEU QD 1 42 LEU HG 2.186 . 2.656 1.889 1.883 1.897 . 0 0 "[ . 1 . 2]" 1
474 1 42 LEU QD 1 43 GLU H 3.378 . 4.679 3.866 3.744 3.925 . 0 0 "[ . 1 . 2]" 1
475 1 42 LEU QD 1 44 ALA H 3.883 . 5.768 4.805 4.704 4.894 . 0 0 "[ . 1 . 2]" 1
476 1 42 LEU QD 1 45 THR H 3.414 . 4.871 4.354 4.263 4.516 . 0 0 "[ . 1 . 2]" 1
477 1 42 LEU QD 1 45 THR MG 2.080 . 2.621 2.866 2.607 3.419 0.798 15 1 "[ . 1 + 2]" 1
478 1 42 LEU QD 1 47 TYR H 3.320 . 4.697 4.446 4.262 4.521 . 0 0 "[ . 1 . 2]" 1
479 1 42 LEU QD 1 47 TYR HB3 3.220 . 4.516 4.113 3.919 4.237 . 0 0 "[ . 1 . 2]" 1
480 1 42 LEU QD 1 47 TYR QD 3.697 . 5.405 4.763 4.600 4.939 . 0 0 "[ . 1 . 2]" 1
481 1 42 LEU QD 1 59 PHE HB3 3.223 . 4.521 2.931 2.713 3.261 . 0 0 "[ . 1 . 2]" 1
482 1 42 LEU QD 1 59 PHE QD 2.830 . 3.202 2.531 2.428 2.657 . 0 0 "[ . 1 . 2]" 1
483 1 42 LEU QD 1 59 PHE QE 2.459 . 3.215 2.442 2.351 2.510 . 0 0 "[ . 1 . 2]" 1
484 1 42 LEU QD 1 60 THR H 3.652 . 5.319 4.626 4.323 4.859 . 0 0 "[ . 1 . 2]" 1
485 1 42 LEU QD 1 66 ILE MD 2.270 . 2.914 2.579 1.869 3.583 0.669 2 1 "[ + . 1 . 2]" 1
486 1 42 LEU QD 1 66 ILE MG 2.079 . 2.619 2.185 1.767 2.691 0.072 2 0 "[ . 1 . 2]" 1
487 1 42 LEU QD 1 67 GLU H 3.753 . 5.514 5.159 4.846 5.383 . 0 0 "[ . 1 . 2]" 1
488 1 42 LEU QD 1 68 MET QB 2.529 . 3.328 3.368 3.118 3.957 0.629 16 1 "[ . 1 .+ 2]" 1
489 1 43 GLU H 1 43 GLU HA 2.845 . 3.857 2.803 2.771 2.856 . 0 0 "[ . 1 . 2]" 1
490 1 43 GLU H 1 43 GLU QB 2.798 . 3.776 2.021 1.922 2.177 . 0 0 "[ . 1 . 2]" 1
491 1 43 GLU H 1 44 ALA H 2.778 . 3.742 2.481 2.298 2.615 . 0 0 "[ . 1 . 2]" 1
492 1 43 GLU H 1 44 ALA HA 3.863 . 5.729 5.160 4.993 5.281 . 0 0 "[ . 1 . 2]" 1
493 1 43 GLU H 1 44 ALA MB 2.962 . 4.059 4.016 3.889 4.106 0.047 19 0 "[ . 1 . 2]" 1
494 1 43 GLU H 1 45 THR H 3.547 . 5.120 4.099 3.979 4.168 . 0 0 "[ . 1 . 2]" 1
495 1 43 GLU H 1 49 GLN H 4.657 . 7.368 6.299 6.020 6.457 . 0 0 "[ . 1 . 2]" 1
496 1 43 GLU H 1 59 PHE HZ 4.176 . 6.356 6.451 6.375 6.541 0.185 2 0 "[ . 1 . 2]" 1
497 1 43 GLU HA 1 43 GLU QB 2.347 . 2.881 2.458 2.274 2.527 . 0 0 "[ . 1 . 2]" 1
498 1 43 GLU HA 1 43 GLU QG 2.230 . 2.851 2.427 2.063 2.830 . 0 0 "[ . 1 . 2]" 1
499 1 43 GLU HA 1 44 ALA H 2.837 . 3.843 3.421 3.367 3.471 . 0 0 "[ . 1 . 2]" 1
500 1 43 GLU HA 1 45 THR H 3.179 . 4.442 4.498 4.365 4.585 0.143 15 0 "[ . 1 . 2]" 1
501 1 43 GLU HA 1 46 GLN H 2.878 . 3.913 3.602 3.307 3.772 . 0 0 "[ . 1 . 2]" 1
502 1 43 GLU HA 1 46 GLN HA 3.477 . 4.988 2.862 2.406 3.100 . 0 0 "[ . 1 . 2]" 1
503 1 43 GLU HA 1 47 TYR H 3.065 . 4.239 3.880 3.581 4.161 . 0 0 "[ . 1 . 2]" 1
504 1 43 GLU QB 1 44 ALA H 2.729 . 3.660 2.593 2.443 2.848 . 0 0 "[ . 1 . 2]" 1
505 1 43 GLU QB 1 47 TYR H 4.168 . 6.340 5.322 5.193 5.489 . 0 0 "[ . 1 . 2]" 1
506 1 43 GLU QG 1 44 ALA H 3.805 . 4.433 4.091 3.335 4.276 . 0 0 "[ . 1 . 2]" 1
507 1 43 GLU QG 1 46 GLN HA 3.320 . 4.698 4.579 4.325 4.673 . 0 0 "[ . 1 . 2]" 1
508 1 44 ALA H 1 44 ALA HA 2.279 . 2.928 2.837 2.804 2.871 . 0 0 "[ . 1 . 2]" 1
509 1 44 ALA H 1 44 ALA MB 1.948 . 2.422 2.084 2.031 2.137 . 0 0 "[ . 1 . 2]" 1
510 1 44 ALA H 1 45 THR H 2.559 . 3.378 2.577 2.465 2.687 . 0 0 "[ . 1 . 2]" 1
511 1 44 ALA H 1 45 THR MG 3.457 . 4.951 4.516 3.839 4.983 0.032 5 0 "[ . 1 . 2]" 1
512 1 44 ALA H 1 46 GLN H 3.281 . 4.627 3.365 3.198 3.502 . 0 0 "[ . 1 . 2]" 1
513 1 44 ALA H 1 47 TYR H 3.543 . 5.112 5.126 4.969 5.223 0.111 19 0 "[ . 1 . 2]" 1
514 1 44 ALA HA 1 44 ALA MB 1.807 . 2.215 2.111 2.101 2.116 . 0 0 "[ . 1 . 2]" 1
515 1 44 ALA HA 1 45 THR H 2.810 . 3.797 3.535 3.486 3.572 . 0 0 "[ . 1 . 2]" 1
516 1 44 ALA HA 1 46 GLN H 3.025 . 4.169 3.709 3.523 3.936 . 0 0 "[ . 1 . 2]" 1
517 1 44 ALA MB 1 45 THR H 2.459 . 3.215 2.522 2.452 2.640 . 0 0 "[ . 1 . 2]" 1
518 1 44 ALA MB 1 46 GLN H 3.006 . 4.135 3.813 3.771 3.868 . 0 0 "[ . 1 . 2]" 1
519 1 44 ALA MB 1 46 GLN QG 3.070 . 4.248 4.205 4.139 4.279 0.031 16 0 "[ . 1 . 2]" 1
520 1 45 THR H 1 45 THR HA 2.607 . 3.457 2.914 2.903 2.925 . 0 0 "[ . 1 . 2]" 1
521 1 45 THR H 1 45 THR HB 2.731 . 3.664 2.497 2.172 2.828 . 0 0 "[ . 1 . 2]" 1
522 1 45 THR H 1 45 THR MG 2.607 . 3.456 2.633 2.055 3.100 . 0 0 "[ . 1 . 2]" 1
523 1 45 THR H 1 46 GLN H 2.552 . 3.366 1.991 1.905 2.113 . 0 0 "[ . 1 . 2]" 1
524 1 45 THR H 1 46 GLN HA 2.802 . 3.783 4.064 4.001 4.129 0.346 1 0 "[ . 1 . 2]" 1
525 1 45 THR H 1 46 GLN QG 3.260 . 4.589 3.665 3.499 3.817 . 0 0 "[ . 1 . 2]" 1
526 1 45 THR H 1 47 TYR H 2.935 . 4.012 3.993 3.878 4.073 0.061 10 0 "[ . 1 . 2]" 1
527 1 45 THR H 1 47 TYR HB3 3.920 . 5.841 5.756 5.589 5.900 0.059 10 0 "[ . 1 . 2]" 1
528 1 45 THR H 1 59 PHE QD 3.569 . 5.161 5.071 4.864 5.220 0.059 15 0 "[ . 1 . 2]" 1
529 1 45 THR H 1 111 LEU QD 3.935 . 5.871 4.396 3.186 5.805 . 0 0 "[ . 1 . 2]" 1
530 1 45 THR HA 1 45 THR MG 2.503 . 3.286 3.143 3.040 3.206 . 0 0 "[ . 1 . 2]" 1
531 1 45 THR HA 1 46 GLN H 2.529 . 3.328 3.079 3.014 3.128 . 0 0 "[ . 1 . 2]" 1
532 1 45 THR HA 1 46 GLN QG 2.593 . 3.433 3.316 3.024 3.468 0.035 16 0 "[ . 1 . 2]" 1
533 1 45 THR HA 1 47 TYR H 3.308 . 4.676 4.930 4.845 5.011 0.335 10 0 "[ . 1 . 2]" 1
534 1 45 THR HB 1 45 THR MG 1.894 . 2.342 2.097 2.084 2.120 . 0 0 "[ . 1 . 2]" 1
535 1 45 THR HB 1 46 GLN H 3.082 . 4.270 3.875 3.509 4.141 . 0 0 "[ . 1 . 2]" 1
536 1 45 THR HB 1 59 PHE QD 3.151 . 4.392 4.476 4.261 4.600 0.208 6 0 "[ . 1 . 2]" 1
537 1 45 THR HB 1 73 PHE HZ 2.549 . 3.361 3.343 2.739 3.517 0.156 18 0 "[ . 1 . 2]" 1
538 1 45 THR MG 1 46 GLN H 3.107 . 4.313 2.930 2.695 3.278 . 0 0 "[ . 1 . 2]" 1
539 1 45 THR MG 1 46 GLN QG 3.211 . 4.499 4.382 4.183 4.480 . 0 0 "[ . 1 . 2]" 1
540 1 45 THR MG 1 47 TYR H 3.228 . 4.531 2.666 2.460 2.954 . 0 0 "[ . 1 . 2]" 1
541 1 45 THR MG 1 57 GLY H 2.444 . 3.191 4.118 3.444 5.205 2.014 13 8 "[* .* *1 +*.* *-2]" 1
542 1 45 THR MG 1 59 PHE HB3 3.293 . 4.648 2.629 2.338 2.969 . 0 0 "[ . 1 . 2]" 1
543 1 45 THR MG 1 59 PHE QD 2.269 . 2.913 2.075 1.883 2.306 . 0 0 "[ . 1 . 2]" 1
544 1 45 THR MG 1 68 MET HA 3.178 . 4.440 3.919 3.581 4.358 . 0 0 "[ . 1 . 2]" 1
545 1 45 THR MG 1 68 MET QB 3.005 . 4.134 3.275 2.902 3.629 . 0 0 "[ . 1 . 2]" 1
546 1 46 GLN H 1 46 GLN HA 1.975 . 2.462 2.185 2.162 2.210 . 0 0 "[ . 1 . 2]" 1
547 1 46 GLN H 1 46 GLN HB3 2.637 . 3.506 3.831 3.747 3.876 0.370 10 0 "[ . 1 . 2]" 1
548 1 46 GLN H 1 46 GLN QG 2.213 . 2.825 2.243 2.060 2.335 . 0 0 "[ . 1 . 2]" 1
549 1 46 GLN H 1 47 TYR H 2.594 . 3.435 2.938 2.840 3.081 . 0 0 "[ . 1 . 2]" 1
550 1 46 GLN H 1 47 TYR HB3 3.647 . 5.310 5.341 5.293 5.416 0.106 8 0 "[ . 1 . 2]" 1
551 1 46 GLN H 1 59 PHE H 4.873 . 7.841 6.020 5.804 6.194 . 0 0 "[ . 1 . 2]" 1
552 1 46 GLN H 1 58 GLU H 4.351 . 6.718 6.951 6.824 7.056 0.338 3 0 "[ . 1 . 2]" 1
553 1 46 GLN H 1 73 PHE HZ 3.234 . 4.541 4.788 4.633 4.861 0.320 4 0 "[ . 1 . 2]" 1
554 1 46 GLN HA 1 46 GLN HB3 1.809 . 2.218 2.341 2.274 2.372 0.154 2 0 "[ . 1 . 2]" 1
555 1 46 GLN HA 1 46 GLN QG 2.027 . 2.541 2.511 2.416 2.712 0.171 7 0 "[ . 1 . 2]" 1
556 1 46 GLN HA 1 47 TYR H 2.683 . 3.583 2.625 2.567 2.713 . 0 0 "[ . 1 . 2]" 1
557 1 46 GLN QB 1 58 GLU H 4.315 . 6.642 6.662 6.532 6.780 0.138 12 0 "[ . 1 . 2]" 1
558 1 47 TYR H 1 47 TYR HA 2.268 . 2.911 2.915 2.892 2.927 0.016 13 0 "[ . 1 . 2]" 1
559 1 47 TYR H 1 47 TYR HB2 3.140 . 4.373 3.021 2.964 3.077 . 0 0 "[ . 1 . 2]" 1
560 1 47 TYR H 1 47 TYR HB3 2.774 . 3.736 3.009 2.920 3.087 . 0 0 "[ . 1 . 2]" 1
561 1 47 TYR H 1 48 ARG H 3.252 . 4.574 4.408 4.380 4.442 . 0 0 "[ . 1 . 2]" 1
562 1 47 TYR H 1 48 ARG HA 3.287 . 4.637 4.812 4.746 4.902 0.265 2 0 "[ . 1 . 2]" 1
563 1 47 TYR H 1 48 ARG QB 3.674 . 5.361 5.197 5.099 5.275 . 0 0 "[ . 1 . 2]" 1
564 1 47 TYR H 1 49 GLN H 3.900 . 5.801 4.983 4.799 5.109 . 0 0 "[ . 1 . 2]" 1
565 1 47 TYR HA 1 47 TYR QD 2.666 . 3.554 1.855 1.775 2.005 0.003 7 0 "[ . 1 . 2]" 1
566 1 47 TYR HA 1 48 ARG H 2.476 . 3.242 2.510 2.456 2.561 . 0 0 "[ . 1 . 2]" 1
567 1 47 TYR HA 1 59 PHE H 4.173 . 6.349 5.385 5.303 5.418 . 0 0 "[ . 1 . 2]" 1
568 1 47 TYR HA 1 59 PHE QE 2.925 . 3.994 3.874 3.788 4.092 0.098 7 0 "[ . 1 . 2]" 1
569 1 47 TYR HB2 1 47 TYR QD 2.521 . 3.315 2.720 2.657 2.752 . 0 0 "[ . 1 . 2]" 1
570 1 47 TYR HB2 1 48 ARG H 3.330 . 4.716 3.687 3.646 3.723 . 0 0 "[ . 1 . 2]" 1
571 1 47 TYR HB3 1 47 TYR QD 2.475 . 3.241 2.296 2.234 2.340 . 0 0 "[ . 1 . 2]" 1
572 1 47 TYR HB3 1 48 ARG H 3.316 . 4.690 2.930 2.863 2.983 . 0 0 "[ . 1 . 2]" 1
573 1 47 TYR HB3 1 49 GLN H 4.548 . 7.133 5.166 5.061 5.270 . 0 0 "[ . 1 . 2]" 1
574 1 47 TYR QD 1 48 ARG H 2.865 . 3.891 2.692 2.620 2.748 . 0 0 "[ . 1 . 2]" 1
575 1 47 TYR QD 1 50 VAL QG 2.660 . 3.545 2.839 2.554 3.156 . 0 0 "[ . 1 . 2]" 1
576 1 47 TYR QD 1 58 GLU HA 3.070 . 4.248 2.348 2.205 2.547 . 0 0 "[ . 1 . 2]" 1
577 1 47 TYR QD 1 59 PHE HB3 3.012 . 4.146 4.262 4.170 4.347 0.201 7 0 "[ . 1 . 2]" 1
578 1 47 TYR QD 1 59 PHE HZ 3.631 . 5.279 4.816 4.630 5.084 . 0 0 "[ . 1 . 2]" 1
579 1 47 TYR QD 1 60 THR H 3.558 . 5.140 5.416 5.342 5.531 0.391 7 0 "[ . 1 . 2]" 1
580 1 47 TYR QE 1 48 ARG H 2.504 . 3.288 3.533 3.454 3.589 0.301 5 0 "[ . 1 . 2]" 1
581 1 48 ARG H 1 49 GLN H 3.773 . 5.552 4.309 4.244 4.368 . 0 0 "[ . 1 . 2]" 1
582 1 48 ARG H 1 50 VAL QG 3.592 . 5.205 4.385 3.908 4.553 . 0 0 "[ . 1 . 2]" 1
583 1 48 ARG H 1 59 PHE H 3.280 . 4.625 4.628 4.482 4.704 0.079 16 0 "[ . 1 . 2]" 1
584 1 48 ARG H 1 58 GLU HA 3.232 . 4.538 4.499 4.288 4.687 0.149 3 0 "[ . 1 . 2]" 1
585 1 48 ARG H 1 59 PHE H 3.759 . 5.525 4.776 4.570 4.891 . 0 0 "[ . 1 . 2]" 1
586 1 48 ARG HA 1 49 GLN H 2.473 . 3.237 2.368 2.274 2.460 . 0 0 "[ . 1 . 2]" 1
587 1 48 ARG QB 1 49 GLN H 2.351 . 3.042 2.910 2.472 3.205 0.163 2 0 "[ . 1 . 2]" 1
588 1 49 GLN H 1 49 GLN HA 2.810 . 3.797 2.733 2.709 2.746 . 0 0 "[ . 1 . 2]" 1
589 1 49 GLN H 1 49 GLN HB2 2.636 . 3.505 2.348 2.288 2.442 . 0 0 "[ . 1 . 2]" 1
590 1 49 GLN H 1 49 GLN HB3 2.953 . 4.043 2.577 2.476 2.678 . 0 0 "[ . 1 . 2]" 1
591 1 49 GLN H 1 49 GLN HG2 3.226 . 4.527 4.350 4.301 4.387 . 0 0 "[ . 1 . 2]" 1
592 1 49 GLN H 1 50 VAL HB 3.491 . 5.015 5.683 5.196 7.514 2.499 2 4 "[*+ *. -1 . 2]" 1
593 1 49 GLN H 1 59 PHE QE 2.891 . 3.936 3.260 3.022 3.419 . 0 0 "[ . 1 . 2]" 1
594 1 49 GLN HA 1 49 GLN HG2 2.594 . 3.435 2.384 2.284 2.487 . 0 0 "[ . 1 . 2]" 1
595 1 49 GLN HA 1 49 GLN HG3 2.780 . 3.746 3.333 3.095 3.452 . 0 0 "[ . 1 . 2]" 1
596 1 49 GLN HA 1 50 VAL H 1.976 . 2.464 2.084 2.038 2.140 . 0 0 "[ . 1 . 2]" 1
597 1 49 GLN HA 1 50 VAL HA 3.012 . 4.146 4.303 4.263 4.362 0.216 2 0 "[ . 1 . 2]" 1
598 1 49 GLN HA 1 50 VAL QG 2.693 . 3.599 3.072 2.869 3.219 . 0 0 "[ . 1 . 2]" 1
599 1 49 GLN HA 1 59 PHE QE 2.756 . 3.705 2.929 2.679 3.094 . 0 0 "[ . 1 . 2]" 1
600 1 49 GLN HA 1 59 PHE HZ 3.301 . 4.663 3.786 3.620 3.977 . 0 0 "[ . 1 . 2]" 1
601 1 49 GLN HA 1 60 THR HA 3.646 . 5.308 2.939 2.753 3.121 . 0 0 "[ . 1 . 2]" 1
602 1 49 GLN HA 1 61 VAL H 2.255 . 2.891 3.087 2.998 3.175 0.284 9 0 "[ . 1 . 2]" 1
603 1 49 GLN HA 1 61 VAL QG 3.224 . 4.523 3.058 2.842 3.376 . 0 0 "[ . 1 . 2]" 1
604 1 49 GLN HB2 1 50 VAL H 2.846 . 3.858 3.877 3.809 3.933 0.075 14 0 "[ . 1 . 2]" 1
605 1 49 GLN HB2 1 59 PHE H 3.608 . 5.235 5.346 4.733 5.531 0.296 1 0 "[ . 1 . 2]" 1
606 1 49 GLN HB2 1 59 PHE HZ 2.762 . 3.716 3.732 3.560 3.843 0.127 12 0 "[ . 1 . 2]" 1
607 1 49 GLN HB3 1 49 GLN HG2 2.818 . 3.811 2.891 2.779 2.942 . 0 0 "[ . 1 . 2]" 1
608 1 49 GLN HB3 1 50 VAL H 2.723 . 3.650 3.813 3.739 3.886 0.236 9 0 "[ . 1 . 2]" 1
609 1 49 GLN HB3 1 61 VAL QG 2.366 . 3.066 3.157 3.082 3.203 0.137 15 0 "[ . 1 . 2]" 1
610 1 49 GLN HG2 1 50 VAL H 2.542 . 3.350 1.965 1.879 2.161 . 0 0 "[ . 1 . 2]" 1
611 1 49 GLN HG2 1 59 PHE QE 3.006 . 4.136 4.145 3.893 4.304 0.168 17 0 "[ . 1 . 2]" 1
612 1 49 GLN HG2 1 60 THR HA 2.571 . 3.397 2.819 2.553 3.373 . 0 0 "[ . 1 . 2]" 1
613 1 49 GLN HG2 1 60 THR HB 3.043 . 4.201 3.692 3.364 4.251 0.050 13 0 "[ . 1 . 2]" 1
614 1 49 GLN HG3 1 50 VAL H 2.849 . 3.864 3.661 3.470 3.872 0.008 9 0 "[ . 1 . 2]" 1
615 1 49 GLN HG3 1 59 PHE QE 2.943 . 4.026 3.875 3.675 4.118 0.092 12 0 "[ . 1 . 2]" 1
616 1 49 GLN HG3 1 60 THR HA 2.821 . 3.816 3.866 3.624 3.985 0.169 16 0 "[ . 1 . 2]" 1
617 1 49 GLN HG3 1 61 VAL H 3.593 . 5.207 2.157 1.964 2.284 0.015 1 0 "[ . 1 . 2]" 1
618 1 50 VAL H 1 50 VAL HB 3.356 . 4.764 3.109 2.871 3.688 . 0 0 "[ . 1 . 2]" 1
619 1 50 VAL H 1 50 VAL QG . . 2.029 2.035 1.822 2.106 0.077 15 0 "[ . 1 . 2]" 1
620 1 50 VAL H 1 53 MET QG 4.566 . 7.172 6.356 5.979 6.612 . 0 0 "[ . 1 . 2]" 1
621 1 50 VAL H 1 58 GLU HA 4.242 . 6.492 6.610 6.496 6.692 0.200 14 0 "[ . 1 . 2]" 1
622 1 50 VAL H 1 59 PHE H 3.889 . 5.779 5.035 4.884 5.139 . 0 0 "[ . 1 . 2]" 1
623 1 50 VAL H 1 59 PHE QE 3.338 . 4.731 4.700 4.451 4.868 0.137 7 0 "[ . 1 . 2]" 1
624 1 50 VAL H 1 60 THR HA 2.505 . 3.290 2.614 2.432 2.736 . 0 0 "[ . 1 . 2]" 1
625 1 50 VAL H 1 60 THR HB 3.056 . 4.223 3.738 3.129 4.258 0.035 13 0 "[ . 1 . 2]" 1
626 1 50 VAL H 1 60 THR MG 2.869 . 3.898 3.064 2.407 3.427 . 0 0 "[ . 1 . 2]" 1
627 1 50 VAL H 1 61 VAL H 3.237 . 4.547 3.363 3.230 3.576 . 0 0 "[ . 1 . 2]" 1
628 1 50 VAL HA 1 50 VAL HB 1.966 . 2.449 2.458 2.398 2.578 0.129 4 0 "[ . 1 . 2]" 1
629 1 50 VAL HA 1 50 VAL QG 1.901 . 2.353 2.326 2.211 2.390 0.037 20 0 "[ . 1 . 2]" 1
630 1 50 VAL HA 1 52 LYS H 2.631 . 3.496 3.792 3.738 3.841 0.345 5 0 "[ . 1 . 2]" 1
631 1 50 VAL HB 1 50 VAL QG . . 1.892 1.850 1.836 1.868 . 0 0 "[ . 1 . 2]" 1
632 1 50 VAL HB 1 52 LYS H 3.644 . 5.304 4.099 1.950 4.745 0.034 4 0 "[ . 1 . 2]" 1
633 1 50 VAL MG1 1 50 VAL MG2 1.507 . 1.791 1.939 1.881 2.006 0.215 4 0 "[ . 1 . 2]" 1
634 1 50 VAL QG 1 52 LYS H . . 3.115 2.145 1.832 2.977 0.149 5 0 "[ . 1 . 2]" 1
635 1 50 VAL QG 1 52 LYS HA 2.879 . 3.915 3.329 3.115 3.486 . 0 0 "[ . 1 . 2]" 1
636 1 50 VAL QG 1 53 MET H . . 3.972 3.006 2.864 3.236 . 0 0 "[ . 1 . 2]" 1
637 1 50 VAL QG 1 53 MET HA 2.024 . 2.536 2.407 2.170 2.561 0.025 1 0 "[ . 1 . 2]" 1
638 1 50 VAL QG 1 53 MET HB2 2.774 . 2.987 1.908 1.770 2.209 0.042 1 0 "[ . 1 . 2]" 1
639 1 50 VAL QG 1 53 MET HB3 1.579 . 1.891 1.984 1.740 2.104 0.213 3 0 "[ . 1 . 2]" 1
640 1 50 VAL QG 1 53 MET QG 2.894 . 3.941 3.316 3.171 3.452 . 0 0 "[ . 1 . 2]" 1
641 1 50 VAL QG 1 54 THR H 3.695 . 5.402 3.979 3.473 4.256 . 0 0 "[ . 1 . 2]" 1
642 1 50 VAL QG 1 54 THR H 2.797 . 3.775 3.524 3.374 3.702 . 0 0 "[ . 1 . 2]" 1
643 1 50 VAL QG 1 58 GLU HB3 2.692 . 3.598 3.101 2.799 4.418 0.820 13 1 "[ . 1 + . 2]" 1
644 1 50 VAL QG 1 58 GLU HG3 2.780 . 3.746 3.679 2.616 4.514 0.768 1 6 "[+ . - 1* * * *2]" 1
645 1 50 VAL QG 1 59 PHE H 2.978 . 3.456 2.709 2.392 3.223 . 0 0 "[ . 1 . 2]" 1
646 1 50 VAL QG 1 60 THR H 3.731 . 5.471 4.081 3.815 4.481 . 0 0 "[ . 1 . 2]" 1
647 1 50 VAL QG 1 60 THR HA 3.469 . 4.973 2.638 2.427 3.020 . 0 0 "[ . 1 . 2]" 1
648 1 50 VAL QG 1 60 THR HB 3.130 . 4.355 3.319 2.672 3.768 . 0 0 "[ . 1 . 2]" 1
649 1 50 VAL QG 1 60 THR MG 1.596 . 1.914 1.676 1.647 1.730 . 0 0 "[ . 1 . 2]" 1
650 1 50 VAL QG 1 61 VAL H 3.802 . 5.609 4.129 4.026 4.400 . 0 0 "[ . 1 . 2]" 1
651 1 51 SER HA 1 52 LYS H 2.434 . 3.175 3.370 3.348 3.392 0.217 9 0 "[ . 1 . 2]" 1
652 1 51 SER QB 1 52 LYS H 2.146 . 2.722 2.580 2.493 2.677 . 0 0 "[ . 1 . 2]" 1
653 1 51 SER QB 1 52 LYS QB 2.408 . 3.133 3.098 3.028 3.144 0.011 12 0 "[ . 1 . 2]" 1
654 1 52 LYS H 1 52 LYS HA 2.376 . 3.082 2.851 2.822 2.906 . 0 0 "[ . 1 . 2]" 1
655 1 52 LYS H 1 52 LYS QB 2.264 . 2.905 2.764 2.647 2.804 . 0 0 "[ . 1 . 2]" 1
656 1 52 LYS H 1 52 LYS HG3 3.437 . 4.914 5.024 4.733 5.130 0.216 1 0 "[ . 1 . 2]" 1
657 1 52 LYS H 1 53 MET H 4.123 . 6.248 3.981 3.866 4.078 . 0 0 "[ . 1 . 2]" 1
658 1 52 LYS HA 1 52 LYS QB 2.064 . 2.597 2.296 2.266 2.359 . 0 0 "[ . 1 . 2]" 1
659 1 52 LYS HA 1 52 LYS HG2 2.456 . 3.210 2.719 2.451 3.162 . 0 0 "[ . 1 . 2]" 1
660 1 52 LYS HA 1 52 LYS HG3 2.596 . 3.438 3.129 2.426 3.576 0.138 7 0 "[ . 1 . 2]" 1
661 1 52 LYS HA 1 53 MET H 1.844 . 2.269 2.070 1.991 2.120 . 0 0 "[ . 1 . 2]" 1
662 1 52 LYS HA 1 60 THR MG 2.152 . 2.731 2.851 2.728 3.073 0.342 13 0 "[ . 1 . 2]" 1
663 1 52 LYS QB 1 52 LYS HD3 2.092 . 2.639 2.830 2.365 3.473 0.834 7 7 "[* . +-*1 * . * *2]" 1
664 1 52 LYS QB 1 52 LYS QE 2.093 . 2.641 1.966 1.780 2.472 . 0 0 "[ . 1 . 2]" 1
665 1 52 LYS QB 1 52 LYS HG3 2.052 . 2.578 2.196 2.121 2.391 . 0 0 "[ . 1 . 2]" 1
666 1 52 LYS QB 1 53 MET H 2.832 . 3.834 3.631 3.560 3.702 . 0 0 "[ . 1 . 2]" 1
667 1 52 LYS HD2 1 54 THR MG 1.697 . 2.057 2.534 2.250 3.033 0.976 8 7 "[* . -+*1 * . * *2]" 1
668 1 52 LYS QE 1 52 LYS HG2 2.798 . 3.777 2.776 2.322 3.522 . 0 0 "[ . 1 . 2]" 1
669 1 52 LYS QE 1 52 LYS HG3 2.415 . 3.144 3.050 2.256 3.328 0.184 20 0 "[ . 1 . 2]" 1
670 1 52 LYS QE 1 53 MET H 4.054 . 6.108 4.581 3.874 5.139 . 0 0 "[ . 1 . 2]" 1
671 1 52 LYS QE 1 54 THR MG 2.537 . 3.341 3.052 2.446 3.377 0.036 8 0 "[ . 1 . 2]" 1
672 1 52 LYS HG2 1 53 MET H 2.819 . 3.812 2.623 2.320 3.319 . 0 0 "[ . 1 . 2]" 1
673 1 52 LYS HG3 1 53 MET H 2.892 . 3.937 3.708 3.162 4.164 0.227 7 0 "[ . 1 . 2]" 1
674 1 53 MET H 1 53 MET HA 2.511 . 3.299 2.917 2.908 2.934 . 0 0 "[ . 1 . 2]" 1
675 1 53 MET H 1 53 MET HB2 2.892 . 3.937 3.562 3.483 3.654 . 0 0 "[ . 1 . 2]" 1
676 1 53 MET H 1 53 MET ME 2.889 . 3.932 2.924 2.166 4.145 0.213 7 0 "[ . 1 . 2]" 1
677 1 53 MET H 1 53 MET QG 2.729 . 3.660 3.333 2.261 3.552 . 0 0 "[ . 1 . 2]" 1
678 1 53 MET H 1 54 THR H 3.481 . 4.996 4.295 4.199 4.378 . 0 0 "[ . 1 . 2]" 1
679 1 53 MET H 1 55 ARG H 4.329 . 6.671 6.462 6.328 6.611 . 0 0 "[ . 1 . 2]" 1
680 1 53 MET H 1 55 ARG H 4.447 . 6.919 5.124 4.772 5.523 . 0 0 "[ . 1 . 2]" 1
681 1 53 MET H 1 60 THR HA 4.249 . 6.506 5.937 5.570 6.391 . 0 0 "[ . 1 . 2]" 1
682 1 53 MET H 1 60 THR HB 4.141 . 6.284 5.157 4.719 5.721 . 0 0 "[ . 1 . 2]" 1
683 1 53 MET H 1 60 THR MG 2.401 . 3.121 2.569 2.333 3.003 . 0 0 "[ . 1 . 2]" 1
684 1 53 MET HA 1 53 MET HB2 2.705 . 3.620 2.225 2.200 2.295 . 0 0 "[ . 1 . 2]" 1
685 1 53 MET HA 1 53 MET HB3 2.160 . 2.743 2.764 2.552 2.848 0.105 4 0 "[ . 1 . 2]" 1
686 1 53 MET HA 1 54 THR H 2.562 . 3.382 2.224 2.145 2.297 . 0 0 "[ . 1 . 2]" 1
687 1 53 MET HB2 1 53 MET QG 3.106 . 4.312 2.173 2.135 2.331 . 0 0 "[ . 1 . 2]" 1
688 1 53 MET HB2 1 54 THR H 3.343 . 4.740 3.852 3.522 4.072 . 0 0 "[ . 1 . 2]" 1
689 1 53 MET HB2 1 54 THR H 3.680 . 5.373 3.601 3.180 3.818 . 0 0 "[ . 1 . 2]" 1
690 1 53 MET HB2 1 60 THR MG 2.849 . 3.863 2.985 2.728 3.321 . 0 0 "[ . 1 . 2]" 1
691 1 53 MET HB3 1 59 PHE H 3.180 . 4.444 3.954 3.626 4.564 0.120 13 0 "[ . 1 . 2]" 1
692 1 53 MET ME 1 55 ARG H 3.887 . 5.776 4.005 3.382 4.670 . 0 0 "[ . 1 . 2]" 1
693 1 53 MET ME 1 60 THR MG 2.511 . 3.299 2.337 1.839 3.418 0.119 20 0 "[ . 1 . 2]" 1
694 1 53 MET QG 1 54 THR H 3.573 . 5.169 3.480 3.172 3.810 . 0 0 "[ . 1 . 2]" 1
695 1 53 MET QG 1 54 THR HA 3.039 . 4.194 2.622 2.264 3.026 . 0 0 "[ . 1 . 2]" 1
696 1 53 MET QG 1 54 THR MG 3.157 . 4.403 4.261 4.136 4.420 0.017 11 0 "[ . 1 . 2]" 1
697 1 53 MET QG 1 54 THR MG 2.590 . 3.429 3.077 2.706 3.316 . 0 0 "[ . 1 . 2]" 1
698 1 53 MET QG 1 69 ILE MD 2.446 . 3.194 2.279 1.931 3.145 . 0 0 "[ . 1 . 2]" 1
699 1 53 MET QG 1 69 ILE HG12 3.645 . 5.306 3.777 3.397 4.841 . 0 0 "[ . 1 . 2]" 1
700 1 54 THR H 1 54 THR HB 3.240 . 4.552 3.608 3.551 3.729 . 0 0 "[ . 1 . 2]" 1
701 1 54 THR H 1 54 THR MG 2.759 . 3.711 2.471 2.306 2.573 . 0 0 "[ . 1 . 2]" 1
702 1 54 THR H 1 55 ARG H 2.514 . 3.304 3.323 3.214 3.400 0.096 9 0 "[ . 1 . 2]" 1
703 1 54 THR H 1 55 ARG HA 3.555 . 5.134 5.081 4.965 5.129 . 0 0 "[ . 1 . 2]" 1
704 1 54 THR H 1 55 ARG HD3 3.762 . 5.531 3.141 2.586 3.412 . 0 0 "[ . 1 . 2]" 1
705 1 54 THR H 1 55 ARG HG3 3.252 . 4.574 4.694 4.603 4.798 0.224 13 0 "[ . 1 . 2]" 1
706 1 54 THR HA 1 54 THR HB 1.812 . 2.223 2.330 2.301 2.351 0.128 12 0 "[ . 1 . 2]" 1
707 1 54 THR HA 1 55 ARG H 1.680 . 2.033 2.117 2.081 2.157 0.124 3 0 "[ . 1 . 2]" 1
708 1 54 THR HA 1 69 ILE MD 2.857 . 3.878 1.896 1.754 2.620 0.082 3 0 "[ . 1 . 2]" 1
709 1 54 THR HB 1 54 THR MG 1.821 . 2.235 2.132 2.125 2.139 . 0 0 "[ . 1 . 2]" 1
710 1 54 THR HB 1 55 ARG H 3.197 . 4.475 4.337 4.293 4.372 . 0 0 "[ . 1 . 2]" 1
711 1 54 THR MG 1 55 ARG QB 3.268 . 4.603 4.638 4.527 4.696 0.093 15 0 "[ . 1 . 2]" 1
712 1 54 THR MG 1 55 ARG HB3 2.696 . 3.605 3.847 3.753 4.035 0.430 3 0 "[ . 1 . 2]" 1
713 1 54 THR MG 1 55 ARG HD2 2.662 . 3.548 3.626 3.261 4.536 0.988 1 2 "[+ . 1 - 2]" 1
714 1 54 THR MG 1 58 GLU H 3.821 . 5.646 6.125 5.979 6.401 0.755 13 9 "[*- . *1**+*. ** 2]" 1
715 1 55 ARG H 1 55 ARG HA 2.832 . 3.835 2.825 2.806 2.843 . 0 0 "[ . 1 . 2]" 1
716 1 55 ARG H 1 55 ARG HD3 2.990 . 4.108 4.175 3.153 4.364 0.256 5 0 "[ . 1 . 2]" 1
717 1 55 ARG H 1 58 GLU H 3.529 . 5.086 4.557 4.108 5.137 0.051 13 0 "[ . 1 . 2]" 1
718 1 55 ARG H 1 58 GLU HB2 3.795 . 5.595 2.786 2.376 4.224 . 0 0 "[ . 1 . 2]" 1
719 1 55 ARG H 1 58 GLU HB3 3.663 . 5.340 3.865 3.139 4.431 . 0 0 "[ . 1 . 2]" 1
720 1 55 ARG H 1 69 ILE MD 2.641 . 3.513 1.788 1.678 2.119 0.091 2 0 "[ . 1 . 2]" 1
721 1 55 ARG HA 1 55 ARG QB 2.269 . 2.912 2.171 2.165 2.182 . 0 0 "[ . 1 . 2]" 1
722 1 55 ARG HA 1 55 ARG HD2 3.099 . 4.300 3.828 3.648 4.298 . 0 0 "[ . 1 . 2]" 1
723 1 55 ARG HA 1 55 ARG HG2 2.504 . 3.288 3.440 3.394 3.517 0.229 1 0 "[ . 1 . 2]" 1
724 1 55 ARG HA 1 69 ILE MD 2.773 . 3.734 3.606 3.110 3.863 0.129 13 0 "[ . 1 . 2]" 1
725 1 55 ARG QB 1 55 ARG HG2 2.179 . 2.773 2.507 2.478 2.519 . 0 0 "[ . 1 . 2]" 1
726 1 55 ARG HB3 1 55 ARG HD2 2.168 . 2.756 2.321 2.227 2.514 . 0 0 "[ . 1 . 2]" 1
727 1 55 ARG HD2 1 55 ARG HG2 2.082 . 2.624 2.542 2.428 2.996 0.372 1 0 "[ . 1 . 2]" 1
728 1 55 ARG HG2 1 58 GLU HG3 3.060 . 4.230 3.226 2.218 3.923 . 0 0 "[ . 1 . 2]" 1
729 1 56 PRO HA 1 56 PRO HB2 2.332 . 3.012 2.863 2.699 2.969 . 0 0 "[ . 1 . 2]" 1
730 1 56 PRO HA 1 57 GLY H 2.912 . 3.972 2.274 2.207 2.309 . 0 0 "[ . 1 . 2]" 1
731 1 56 PRO HA 1 58 GLU H 2.952 . 4.042 3.880 3.506 4.112 0.070 19 0 "[ . 1 . 2]" 1
732 1 56 PRO HA 1 69 ILE H 3.866 . 5.734 5.545 5.208 5.807 0.073 19 0 "[ . 1 . 2]" 1
733 1 56 PRO HA 1 69 ILE HB 2.540 . 3.347 3.201 2.851 3.382 0.035 12 0 "[ . 1 . 2]" 1
734 1 56 PRO HA 1 69 ILE HB 2.763 . 3.718 2.957 2.353 3.269 . 0 0 "[ . 1 . 2]" 1
735 1 56 PRO HA 1 69 ILE MG 1.692 . 2.050 1.922 1.769 2.055 0.005 16 0 "[ . 1 . 2]" 1
736 1 56 PRO HA 1 82 GLN H 3.355 . 4.762 4.769 4.320 5.046 0.284 5 0 "[ . 1 . 2]" 1
737 1 56 PRO HB2 1 57 GLY H 3.555 . 5.135 3.857 3.580 4.175 . 0 0 "[ . 1 . 2]" 1
738 1 56 PRO HB2 1 69 ILE MG 2.879 . 3.915 3.950 3.611 4.051 0.136 8 0 "[ . 1 . 2]" 1
739 1 56 PRO HB3 1 57 GLY H 3.995 . 5.990 3.930 3.582 4.171 . 0 0 "[ . 1 . 2]" 1
740 1 56 PRO HB3 1 69 ILE MG 2.758 . 3.709 3.385 3.007 3.582 . 0 0 "[ . 1 . 2]" 1
741 1 57 GLY H 1 58 GLU H 2.568 . 3.393 2.325 2.046 2.639 . 0 0 "[ . 1 . 2]" 1
742 1 57 GLY H 1 69 ILE H 3.515 . 5.060 4.287 3.972 4.524 . 0 0 "[ . 1 . 2]" 1
743 1 57 GLY H 1 69 ILE HA 3.989 . 5.978 4.805 4.528 5.610 . 0 0 "[ . 1 . 2]" 1
744 1 57 GLY H 1 69 ILE HB 3.031 . 4.180 2.788 2.362 3.125 . 0 0 "[ . 1 . 2]" 1
745 1 57 GLY H 1 69 ILE MD 3.473 . 4.981 4.420 3.849 4.759 . 0 0 "[ . 1 . 2]" 1
746 1 57 GLY H 1 69 ILE MG 3.001 . 4.127 2.702 2.413 2.983 . 0 0 "[ . 1 . 2]" 1
747 1 57 GLY H 1 73 PHE HZ 3.054 . 4.220 4.597 4.276 5.433 1.213 9 2 "[ . +- . 2]" 1
748 1 57 GLY HA2 1 58 GLU H 2.923 . 3.991 2.884 2.684 3.072 . 0 0 "[ . 1 . 2]" 1
749 1 57 GLY HA2 1 73 PHE HZ 2.727 . 3.656 3.530 3.113 3.814 0.158 7 0 "[ . 1 . 2]" 1
750 1 57 GLY HA3 1 58 GLU H 3.055 . 4.221 3.524 3.424 3.575 . 0 0 "[ . 1 . 2]" 1
751 1 58 GLU H 1 58 GLU HA 2.719 . 3.643 2.919 2.896 2.943 . 0 0 "[ . 1 . 2]" 1
752 1 58 GLU H 1 58 GLU HB2 2.793 . 3.768 2.701 2.483 3.829 0.061 13 0 "[ . 1 . 2]" 1
753 1 58 GLU H 1 58 GLU HB3 2.853 . 3.871 3.618 2.738 3.818 . 0 0 "[ . 1 . 2]" 1
754 1 58 GLU H 1 58 GLU HG2 3.316 . 4.691 4.437 3.187 4.740 0.049 20 0 "[ . 1 . 2]" 1
755 1 58 GLU H 1 58 GLU HG3 3.034 . 4.185 4.159 3.482 4.455 0.270 5 0 "[ . 1 . 2]" 1
756 1 58 GLU H 1 59 PHE H 3.232 . 4.538 4.398 4.298 4.449 . 0 0 "[ . 1 . 2]" 1
757 1 58 GLU H 1 59 PHE HA 3.860 . 5.722 4.942 4.781 5.126 . 0 0 "[ . 1 . 2]" 1
758 1 58 GLU H 1 69 ILE H 3.288 . 4.639 3.058 2.720 3.577 . 0 0 "[ . 1 . 2]" 1
759 1 58 GLU H 1 69 ILE HA 3.778 . 5.562 4.763 4.492 5.452 . 0 0 "[ . 1 . 2]" 1
760 1 58 GLU H 1 69 ILE HB 3.101 . 4.303 2.184 1.907 2.624 . 0 0 "[ . 1 . 2]" 1
761 1 58 GLU H 1 69 ILE MD 2.784 . 3.753 3.779 3.328 3.945 0.192 14 0 "[ . 1 . 2]" 1
762 1 58 GLU H 1 69 ILE MG 2.581 . 3.414 3.567 3.433 3.692 0.278 3 0 "[ . 1 . 2]" 1
763 1 58 GLU HA 1 58 GLU HB2 2.885 . 3.926 2.942 2.221 3.007 . 0 0 "[ . 1 . 2]" 1
764 1 58 GLU HA 1 58 GLU HB3 2.455 . 3.208 2.661 2.536 2.861 . 0 0 "[ . 1 . 2]" 1
765 1 58 GLU HA 1 58 GLU HG2 2.761 . 3.714 3.048 2.235 3.672 . 0 0 "[ . 1 . 2]" 1
766 1 58 GLU HA 1 58 GLU HG3 2.745 . 3.687 2.672 2.337 3.367 . 0 0 "[ . 1 . 2]" 1
767 1 58 GLU HA 1 59 PHE H 2.179 . 2.772 2.447 2.268 2.595 . 0 0 "[ . 1 . 2]" 1
768 1 58 GLU HB2 1 58 GLU HG2 2.287 . 2.941 2.713 2.412 2.994 0.053 13 0 "[ . 1 . 2]" 1
769 1 58 GLU HB2 1 59 PHE H 3.206 . 4.491 3.745 2.830 4.240 . 0 0 "[ . 1 . 2]" 1
770 1 58 GLU HB3 1 59 PHE H 3.243 . 4.558 2.504 2.076 3.896 . 0 0 "[ . 1 . 2]" 1
771 1 58 GLU HG3 1 59 PHE H 3.304 . 4.668 3.826 1.971 4.687 0.019 19 0 "[ . 1 . 2]" 1
772 1 59 PHE H 1 59 PHE HB2 3.536 . 5.099 4.014 3.966 4.054 . 0 0 "[ . 1 . 2]" 1
773 1 59 PHE H 1 59 PHE HB3 3.298 . 4.657 3.441 3.297 3.503 . 0 0 "[ . 1 . 2]" 1
774 1 59 PHE H 1 59 PHE QE 3.046 . 4.206 4.541 4.414 4.607 0.401 5 0 "[ . 1 . 2]" 1
775 1 59 PHE H 1 60 THR H 3.686 . 5.384 4.289 4.246 4.322 . 0 0 "[ . 1 . 2]" 1
776 1 59 PHE H 1 60 THR HA 4.008 . 6.016 4.446 4.365 4.515 . 0 0 "[ . 1 . 2]" 1
777 1 59 PHE H 1 60 THR MG 3.213 . 4.503 3.892 3.623 4.086 . 0 0 "[ . 1 . 2]" 1
778 1 59 PHE HA 1 59 PHE HB2 2.356 . 3.050 2.406 2.375 2.433 . 0 0 "[ . 1 . 2]" 1
779 1 59 PHE HA 1 59 PHE HB3 2.345 . 3.032 2.510 2.490 2.540 . 0 0 "[ . 1 . 2]" 1
780 1 59 PHE HA 1 60 THR H 2.203 . 2.810 2.402 2.259 2.501 . 0 0 "[ . 1 . 2]" 1
781 1 59 PHE HA 1 60 THR MG 3.073 . 4.253 3.499 3.269 3.969 . 0 0 "[ . 1 . 2]" 1
782 1 59 PHE HA 1 67 GLU H 3.651 . 5.317 4.719 4.555 4.921 . 0 0 "[ . 1 . 2]" 1
783 1 59 PHE HA 1 68 MET H 2.348 . 3.037 3.700 3.375 4.505 1.468 7 7 "[ -. + 1** *. * *]" 1
784 1 59 PHE HA 1 68 MET QB 2.786 . 3.756 3.576 3.489 3.690 . 0 0 "[ . 1 . 2]" 1
785 1 59 PHE HA 1 69 ILE H 2.897 . 3.946 3.300 2.979 3.520 . 0 0 "[ . 1 . 2]" 1
786 1 59 PHE HB2 1 59 PHE QD 2.977 . 4.085 2.367 2.321 2.411 . 0 0 "[ . 1 . 2]" 1
787 1 59 PHE HB2 1 60 THR H 3.026 . 4.170 2.397 2.188 2.552 . 0 0 "[ . 1 . 2]" 1
788 1 59 PHE HB2 1 66 ILE MG 2.627 . 3.490 2.727 2.359 2.950 . 0 0 "[ . 1 . 2]" 1
789 1 59 PHE HB2 1 68 MET H 3.941 . 5.883 4.265 4.099 4.434 . 0 0 "[ . 1 . 2]" 1
790 1 59 PHE HB2 1 68 MET HA 2.602 . 3.449 2.529 2.452 2.625 . 0 0 "[ . 1 . 2]" 1
791 1 59 PHE HB2 1 68 MET QB 2.923 . 3.991 2.785 2.449 3.012 . 0 0 "[ . 1 . 2]" 1
792 1 59 PHE HB2 1 69 ILE H 3.318 . 4.694 4.486 4.243 4.708 0.014 13 0 "[ . 1 . 2]" 1
793 1 59 PHE HB3 1 60 THR H 2.788 . 3.760 3.778 3.639 3.869 0.109 3 0 "[ . 1 . 2]" 1
794 1 59 PHE HB3 1 66 ILE MG 2.820 . 3.814 3.852 3.494 4.041 0.227 2 0 "[ . 1 . 2]" 1
795 1 59 PHE HB3 1 67 GLU H 3.628 . 5.274 5.593 5.476 5.693 0.419 12 0 "[ . 1 . 2]" 1
796 1 59 PHE HB3 1 68 MET HA 2.651 . 3.530 2.230 2.107 2.454 . 0 0 "[ . 1 . 2]" 1
797 1 59 PHE HB3 1 68 MET QB 3.313 . 4.183 2.636 2.333 2.823 . 0 0 "[ . 1 . 2]" 1
798 1 59 PHE HB3 1 69 ILE H 3.287 . 4.638 3.368 3.141 3.518 . 0 0 "[ . 1 . 2]" 1
799 1 59 PHE QD 1 61 VAL H 2.333 . 3.013 3.110 3.046 3.196 0.183 7 0 "[ . 1 . 2]" 1
800 1 59 PHE QE 1 60 THR HA 2.877 . 3.911 4.015 3.915 4.239 0.328 7 0 "[ . 1 . 2]" 1
801 1 59 PHE QE 1 61 VAL H 3.499 . 5.029 3.288 3.086 3.495 . 0 0 "[ . 1 . 2]" 1
802 1 59 PHE QE 1 61 VAL HB 3.667 . 5.348 2.867 2.414 3.182 . 0 0 "[ . 1 . 2]" 1
803 1 59 PHE QE 1 61 VAL QG 1.930 . 2.396 1.907 1.791 1.999 . 0 0 "[ . 1 . 2]" 1
804 1 59 PHE HZ 1 61 VAL QG 2.838 . 3.845 3.686 3.523 3.881 0.036 2 0 "[ . 1 . 2]" 1
805 1 60 THR H 1 60 THR HA 2.613 . 3.467 2.901 2.865 2.927 . 0 0 "[ . 1 . 2]" 1
806 1 60 THR H 1 60 THR HB 2.833 . 3.836 3.883 3.785 3.952 0.116 4 0 "[ . 1 . 2]" 1
807 1 60 THR H 1 60 THR MG 2.567 . 3.391 2.892 2.631 3.300 . 0 0 "[ . 1 . 2]" 1
808 1 60 THR H 1 61 VAL H 3.370 . 4.789 4.206 4.102 4.282 . 0 0 "[ . 1 . 2]" 1
809 1 60 THR H 1 61 VAL HB 4.156 . 6.315 4.414 4.188 4.694 . 0 0 "[ . 1 . 2]" 1
810 1 60 THR H 1 66 ILE HA 3.045 . 4.204 4.185 3.990 4.287 0.083 15 0 "[ . 1 . 2]" 1
811 1 60 THR H 1 66 ILE MG 2.598 . 3.441 3.525 3.436 3.589 0.148 19 0 "[ . 1 . 2]" 1
812 1 60 THR H 1 67 GLU H 2.929 . 4.002 2.629 2.540 2.739 . 0 0 "[ . 1 . 2]" 1
813 1 60 THR H 1 68 MET HA 2.668 . 3.558 3.476 3.353 3.573 0.015 3 0 "[ . 1 . 2]" 1
814 1 60 THR H 1 68 MET QB 3.274 . 4.613 4.337 4.238 4.461 . 0 0 "[ . 1 . 2]" 1
815 1 60 THR H 1 69 ILE H 3.969 . 5.938 5.517 5.016 5.707 . 0 0 "[ . 1 . 2]" 1
816 1 60 THR HA 1 60 THR HB 1.876 . 2.316 2.390 2.277 2.505 0.189 13 0 "[ . 1 . 2]" 1
817 1 60 THR HA 1 60 THR MG 1.979 . 2.469 2.437 2.285 2.569 0.100 15 0 "[ . 1 . 2]" 1
818 1 60 THR HA 1 61 VAL H 1.957 . 2.436 2.097 2.058 2.135 . 0 0 "[ . 1 . 2]" 1
819 1 60 THR HA 1 61 VAL HA 3.278 . 4.621 4.307 4.285 4.345 . 0 0 "[ . 1 . 2]" 1
820 1 60 THR HA 1 61 VAL HB 3.076 . 4.259 4.492 4.391 4.573 0.314 6 0 "[ . 1 . 2]" 1
821 1 60 THR HA 1 68 MET H 4.211 . 6.428 6.926 6.688 7.500 1.072 7 5 "[ . + 1* -. * *]" 1
822 1 60 THR HB 1 60 THR MG 1.678 . 2.030 2.119 2.113 2.133 0.103 7 0 "[ . 1 . 2]" 1
823 1 60 THR HB 1 61 VAL H 2.366 . 3.066 3.222 3.179 3.259 0.193 7 0 "[ . 1 . 2]" 1
824 1 60 THR HB 1 67 GLU H 3.650 . 5.315 4.541 4.254 4.890 . 0 0 "[ . 1 . 2]" 1
825 1 60 THR MG 1 67 GLU H 3.582 . 5.186 3.959 3.749 4.112 . 0 0 "[ . 1 . 2]" 1
826 1 61 VAL H 1 61 VAL HA 2.927 . 3.998 2.929 2.922 2.949 . 0 0 "[ . 1 . 2]" 1
827 1 61 VAL H 1 61 VAL HB 2.385 . 3.096 3.086 3.016 3.133 0.037 13 0 "[ . 1 . 2]" 1
828 1 61 VAL H 1 61 VAL QG 2.164 . 2.749 2.128 2.010 2.263 . 0 0 "[ . 1 . 2]" 1
829 1 61 VAL H 1 66 ILE MG 3.505 . 5.041 4.496 4.139 4.816 . 0 0 "[ . 1 . 2]" 1
830 1 61 VAL HA 1 61 VAL HB 2.620 . 3.478 2.411 2.359 2.484 . 0 0 "[ . 1 . 2]" 1
831 1 61 VAL HA 1 61 VAL QG 1.968 . 2.452 2.221 2.149 2.331 . 0 0 "[ . 1 . 2]" 1
832 1 61 VAL HA 1 65 SER H 3.568 . 5.159 4.721 4.485 4.873 . 0 0 "[ . 1 . 2]" 1
833 1 61 VAL HA 1 66 ILE HA 2.464 . 3.223 2.404 2.135 2.547 . 0 0 "[ . 1 . 2]" 1
834 1 61 VAL HA 1 66 ILE HG12 2.875 . 3.908 2.949 2.496 3.356 . 0 0 "[ . 1 . 2]" 1
835 1 61 VAL HA 1 66 ILE HG13 3.277 . 4.620 4.081 3.490 4.470 . 0 0 "[ . 1 . 2]" 1
836 1 61 VAL HA 1 67 GLU H 3.101 . 4.303 3.511 3.331 3.768 . 0 0 "[ . 1 . 2]" 1
837 1 61 VAL HB 1 61 VAL QG 1.928 . 2.331 1.893 1.889 1.899 . 0 0 "[ . 1 . 2]" 1
838 1 61 VAL QG 1 65 SER H 3.159 . 4.407 4.368 4.105 4.496 0.089 19 0 "[ . 1 . 2]" 1
839 1 61 VAL QG 1 66 ILE MD 1.972 . 2.458 2.464 2.142 2.792 0.334 2 0 "[ . 1 . 2]" 1
840 1 64 ASN HA 1 64 ASN HB2 2.246 . 2.876 2.975 2.610 3.005 0.129 6 0 "[ . 1 . 2]" 1
841 1 64 ASN HA 1 64 ASN HB3 2.047 . 2.571 2.520 2.359 2.978 0.407 1 0 "[ . 1 . 2]" 1
842 1 64 ASN HA 1 65 SER H 2.445 . 3.192 3.249 3.054 3.357 0.165 10 0 "[ . 1 . 2]" 1
843 1 64 ASN HA 1 88 THR MG 3.260 . 4.588 4.666 4.508 4.710 0.122 5 0 "[ . 1 . 2]" 1
844 1 64 ASN HA 1 89 PHE H 3.100 . 4.302 3.698 3.211 4.289 . 0 0 "[ . 1 . 2]" 1
845 1 64 ASN HA 1 89 PHE HB2 3.793 . 5.591 2.761 2.083 3.671 . 0 0 "[ . 1 . 2]" 1
846 1 64 ASN HB2 1 65 SER H 3.042 . 4.199 3.562 3.101 4.202 0.003 1 0 "[ . 1 . 2]" 1
847 1 64 ASN HB2 1 88 THR MG 3.007 . 4.138 4.142 3.773 4.292 0.154 3 0 "[ . 1 . 2]" 1
848 1 64 ASN HB3 1 65 SER H 2.994 . 4.115 4.156 3.611 4.297 0.182 5 0 "[ . 1 . 2]" 1
849 1 64 ASN HB3 1 65 SER HA 3.055 . 4.222 3.939 3.758 4.063 . 0 0 "[ . 1 . 2]" 1
850 1 64 ASN HB3 1 88 THR MG 2.852 . 3.869 3.353 2.565 3.877 0.008 10 0 "[ . 1 . 2]" 1
851 1 65 SER H 1 65 SER HA 2.749 . 3.694 2.848 2.819 2.903 . 0 0 "[ . 1 . 2]" 1
852 1 65 SER H 1 65 SER HB2 3.249 . 4.569 3.926 3.802 3.989 . 0 0 "[ . 1 . 2]" 1
853 1 65 SER H 1 65 SER HB3 3.398 . 4.841 3.626 3.507 3.744 . 0 0 "[ . 1 . 2]" 1
854 1 65 SER H 1 66 ILE H 3.311 . 4.681 4.239 4.151 4.362 . 0 0 "[ . 1 . 2]" 1
855 1 65 SER H 1 88 THR HA 4.041 . 6.082 4.700 4.563 4.805 . 0 0 "[ . 1 . 2]" 1
856 1 65 SER H 1 89 PHE H 3.848 . 5.698 4.292 3.916 4.703 . 0 0 "[ . 1 . 2]" 1
857 1 65 SER HA 1 65 SER HB2 2.410 . 3.136 2.549 2.507 2.629 . 0 0 "[ . 1 . 2]" 1
858 1 65 SER HA 1 65 SER HB3 2.133 . 2.702 2.337 2.277 2.376 . 0 0 "[ . 1 . 2]" 1
859 1 65 SER HA 1 66 ILE H 2.250 . 2.883 2.140 2.063 2.223 . 0 0 "[ . 1 . 2]" 1
860 1 65 SER HA 1 67 GLU H 3.621 . 5.260 5.474 5.339 5.618 0.358 18 0 "[ . 1 . 2]" 1
861 1 65 SER HA 1 86 ARG QD 3.239 . 4.550 4.334 4.004 4.513 . 0 0 "[ . 1 . 2]" 1
862 1 65 SER HA 1 87 LEU H 3.855 . 5.713 4.743 4.524 4.901 . 0 0 "[ . 1 . 2]" 1
863 1 65 SER HA 1 88 THR HA 2.411 . 3.138 2.403 2.215 2.488 . 0 0 "[ . 1 . 2]" 1
864 1 65 SER HA 1 88 THR MG 2.596 . 3.439 3.508 3.390 3.576 0.137 18 0 "[ . 1 . 2]" 1
865 1 65 SER HA 1 89 PHE H 2.664 . 3.551 2.612 2.349 2.842 . 0 0 "[ . 1 . 2]" 1
866 1 65 SER HA 1 89 PHE HB2 3.445 . 4.929 3.929 3.667 4.355 . 0 0 "[ . 1 . 2]" 1
867 1 65 SER HA 1 89 PHE QD 2.174 . 2.765 2.519 1.958 2.792 0.027 6 0 "[ . 1 . 2]" 1
868 1 65 SER HB2 1 66 ILE H 2.539 . 3.345 2.760 2.607 3.031 . 0 0 "[ . 1 . 2]" 1
869 1 65 SER HB2 1 86 ARG HB2 3.793 . 5.592 5.429 5.067 6.149 0.557 8 1 "[ . + 1 . 2]" 1
870 1 65 SER HB2 1 86 ARG QD 2.925 . 3.994 2.384 2.197 2.552 . 0 0 "[ . 1 . 2]" 1
871 1 65 SER HB2 1 88 THR HA 2.652 . 3.531 3.383 3.095 3.632 0.101 14 0 "[ . 1 . 2]" 1
872 1 65 SER HB2 1 88 THR MG 2.472 . 3.236 3.180 2.985 3.343 0.107 20 0 "[ . 1 . 2]" 1
873 1 65 SER HB2 1 89 PHE QD 3.386 . 4.819 4.756 4.502 4.894 0.075 11 0 "[ . 1 . 2]" 1
874 1 65 SER HB3 1 66 ILE H 2.657 . 3.539 3.686 3.527 3.758 0.219 20 0 "[ . 1 . 2]" 1
875 1 65 SER HB3 1 86 ARG QD 2.099 . 2.650 2.712 2.434 2.916 0.266 8 0 "[ . 1 . 2]" 1
876 1 65 SER HB3 1 86 ARG QG 3.123 . 4.342 3.879 3.414 5.001 0.659 8 1 "[ . + 1 . 2]" 1
877 1 65 SER HB3 1 87 LEU H 3.457 . 4.951 4.819 4.387 4.969 0.018 15 0 "[ . 1 . 2]" 1
878 1 65 SER HB3 1 88 THR HA 3.118 . 4.333 2.295 2.081 2.607 . 0 0 "[ . 1 . 2]" 1
879 1 65 SER HB3 1 88 THR MG 2.521 . 3.315 2.030 1.884 2.202 . 0 0 "[ . 1 . 2]" 1
880 1 65 SER HB3 1 89 PHE H 3.445 . 4.929 3.506 3.266 3.773 . 0 0 "[ . 1 . 2]" 1
881 1 65 SER HB3 1 89 PHE QD 3.333 . 4.721 4.345 3.967 4.524 . 0 0 "[ . 1 . 2]" 1
882 1 66 ILE H 1 66 ILE HB 2.780 . 3.746 2.660 2.531 2.810 . 0 0 "[ . 1 . 2]" 1
883 1 66 ILE H 1 66 ILE MD 3.294 . 4.650 4.191 3.829 4.342 . 0 0 "[ . 1 . 2]" 1
884 1 66 ILE H 1 66 ILE HG13 3.459 . 4.955 3.035 2.768 3.203 . 0 0 "[ . 1 . 2]" 1
885 1 66 ILE H 1 66 ILE MG 3.195 . 4.471 3.829 3.742 3.906 . 0 0 "[ . 1 . 2]" 1
886 1 66 ILE H 1 67 GLU H 3.684 . 5.380 4.076 4.006 4.141 . 0 0 "[ . 1 . 2]" 1
887 1 66 ILE H 1 86 ARG HA 3.943 . 5.886 5.054 4.841 5.342 . 0 0 "[ . 1 . 2]" 1
888 1 66 ILE H 1 86 ARG QD 4.225 . 6.456 4.415 4.091 4.683 . 0 0 "[ . 1 . 2]" 1
889 1 66 ILE H 1 87 LEU H 3.228 . 4.530 3.358 3.193 3.607 . 0 0 "[ . 1 . 2]" 1
890 1 66 ILE H 1 87 LEU HB3 3.741 . 5.491 3.288 3.068 3.548 . 0 0 "[ . 1 . 2]" 1
891 1 66 ILE H 1 87 LEU QD 3.062 . 4.234 3.714 3.558 4.005 . 0 0 "[ . 1 . 2]" 1
892 1 66 ILE H 1 88 THR HA 3.502 . 5.035 3.806 3.606 3.987 . 0 0 "[ . 1 . 2]" 1
893 1 66 ILE H 1 88 THR MG 3.307 . 4.674 4.698 4.525 4.780 0.106 19 0 "[ . 1 . 2]" 1
894 1 66 ILE H 1 89 PHE H 3.736 . 5.481 4.387 4.098 4.626 . 0 0 "[ . 1 . 2]" 1
895 1 66 ILE H 1 89 PHE HA 4.514 . 7.061 6.228 5.973 6.504 . 0 0 "[ . 1 . 2]" 1
896 1 66 ILE H 1 89 PHE QD 3.201 . 4.482 3.351 2.879 3.571 . 0 0 "[ . 1 . 2]" 1
897 1 66 ILE H 1 89 PHE QE 3.033 . 4.183 2.668 2.216 3.104 . 0 0 "[ . 1 . 2]" 1
898 1 66 ILE H 1 94 LEU QD 3.784 . 5.574 4.161 3.940 4.402 . 0 0 "[ . 1 . 2]" 1
899 1 66 ILE HA 1 66 ILE MD 3.144 . 4.380 3.831 3.757 3.927 . 0 0 "[ . 1 . 2]" 1
900 1 66 ILE HA 1 66 ILE HG12 2.897 . 3.946 2.516 2.407 2.762 . 0 0 "[ . 1 . 2]" 1
901 1 66 ILE HA 1 66 ILE HG13 2.767 . 3.724 3.059 2.789 3.184 . 0 0 "[ . 1 . 2]" 1
902 1 66 ILE HA 1 66 ILE MG 2.353 . 3.045 2.402 2.249 2.516 . 0 0 "[ . 1 . 2]" 1
903 1 66 ILE HA 1 67 GLU H 2.102 . 2.654 2.090 2.058 2.120 . 0 0 "[ . 1 . 2]" 1
904 1 66 ILE HB 1 66 ILE MD 2.466 . 3.226 2.492 2.335 2.630 . 0 0 "[ . 1 . 2]" 1
905 1 66 ILE HB 1 66 ILE MG 2.480 . 3.249 2.133 2.101 2.140 . 0 0 "[ . 1 . 2]" 1
906 1 66 ILE HB 1 67 GLU H 3.285 . 4.634 4.312 4.185 4.404 . 0 0 "[ . 1 . 2]" 1
907 1 66 ILE HB 1 68 MET H 3.866 . 5.734 4.516 3.873 4.759 . 0 0 "[ . 1 . 2]" 1
908 1 66 ILE HB 1 87 LEU H 3.318 . 4.694 4.143 3.857 4.432 . 0 0 "[ . 1 . 2]" 1
909 1 66 ILE HB 1 87 LEU HB2 3.015 . 4.151 2.259 2.001 2.752 . 0 0 "[ . 1 . 2]" 1
910 1 66 ILE HB 1 87 LEU QD 2.696 . 3.605 2.358 1.953 3.264 . 0 0 "[ . 1 . 2]" 1
911 1 66 ILE HB 1 89 PHE QE 2.964 . 4.062 2.895 2.338 3.246 . 0 0 "[ . 1 . 2]" 1
912 1 66 ILE MD 1 66 ILE HG12 2.393 . 3.109 2.116 2.099 2.128 . 0 0 "[ . 1 . 2]" 1
913 1 66 ILE MD 1 67 GLU H 3.643 . 5.302 5.242 5.108 5.317 0.015 1 0 "[ . 1 . 2]" 1
914 1 66 ILE MD 1 89 PHE QE 2.432 . 3.171 3.009 2.171 3.253 0.082 11 0 "[ . 1 . 2]" 1
915 1 66 ILE MD 1 89 PHE HZ 2.297 . 2.956 2.196 1.792 2.794 . 0 0 "[ . 1 . 2]" 1
916 1 66 ILE MD 1 94 LEU QD 3.406 . 4.856 4.480 3.777 4.804 . 0 0 "[ . 1 . 2]" 1
917 1 66 ILE HG12 1 67 GLU H 3.330 . 4.716 4.451 4.311 4.641 . 0 0 "[ . 1 . 2]" 1
918 1 66 ILE HG13 1 67 GLU H 3.485 . 5.003 5.079 4.826 5.147 0.144 17 0 "[ . 1 . 2]" 1
919 1 66 ILE HG13 1 89 PHE QE 3.096 . 4.294 2.738 1.914 3.108 . 0 0 "[ . 1 . 2]" 1
920 1 66 ILE MG 1 67 GLU H 2.322 . 2.996 2.944 2.739 3.040 0.044 11 0 "[ . 1 . 2]" 1
921 1 66 ILE MG 1 68 MET H 3.632 . 5.281 4.400 3.343 4.876 . 0 0 "[ . 1 . 2]" 1
922 1 66 ILE MG 1 87 LEU H 4.046 . 6.092 4.321 3.892 4.724 . 0 0 "[ . 1 . 2]" 1
923 1 67 GLU H 1 67 GLU HB2 3.192 . 4.466 2.385 2.285 2.488 . 0 0 "[ . 1 . 2]" 1
924 1 67 GLU H 1 67 GLU HB3 3.120 . 4.337 3.606 3.530 3.657 . 0 0 "[ . 1 . 2]" 1
925 1 67 GLU H 1 67 GLU HG2 3.520 . 5.069 4.321 4.091 4.486 . 0 0 "[ . 1 . 2]" 1
926 1 67 GLU H 1 67 GLU HG3 3.090 . 4.283 3.433 3.060 3.868 . 0 0 "[ . 1 . 2]" 1
927 1 67 GLU H 1 68 MET H 3.477 . 4.988 4.359 4.130 4.446 . 0 0 "[ . 1 . 2]" 1
928 1 67 GLU H 1 87 LEU QD 3.573 . 5.168 4.571 4.204 4.916 . 0 0 "[ . 1 . 2]" 1
929 1 67 GLU H 1 100 MET ME 3.536 . 5.099 5.128 4.660 5.242 0.143 18 0 "[ . 1 . 2]" 1
930 1 67 GLU HA 1 67 GLU HG2 2.860 . 3.882 3.239 2.555 3.705 . 0 0 "[ . 1 . 2]" 1
931 1 67 GLU HA 1 67 GLU HG3 2.857 . 3.877 2.386 2.234 2.756 . 0 0 "[ . 1 . 2]" 1
932 1 67 GLU HA 1 68 MET H 2.247 . 2.878 2.408 2.082 2.623 . 0 0 "[ . 1 . 2]" 1
933 1 67 GLU HA 1 85 ALA H 3.984 . 5.968 4.551 4.413 4.712 . 0 0 "[ . 1 . 2]" 1
934 1 67 GLU HA 1 85 ALA H 3.049 . 4.211 4.165 4.068 4.247 0.036 13 0 "[ . 1 . 2]" 1
935 1 67 GLU HA 1 86 ARG HA 2.679 . 3.576 2.564 2.350 2.756 . 0 0 "[ . 1 . 2]" 1
936 1 67 GLU HA 1 87 LEU H 2.682 . 3.581 2.779 2.524 3.075 . 0 0 "[ . 1 . 2]" 1
937 1 67 GLU HB2 1 68 MET H 3.571 . 5.165 3.740 3.235 4.502 . 0 0 "[ . 1 . 2]" 1
938 1 67 GLU HB3 1 67 GLU HG3 2.728 . 3.658 2.775 2.464 3.014 . 0 0 "[ . 1 . 2]" 1
939 1 67 GLU HG2 1 86 ARG HA 3.183 . 4.449 3.359 2.323 4.422 . 0 0 "[ . 1 . 2]" 1
940 1 67 GLU HG2 1 87 LEU H 4.023 . 6.046 4.952 4.094 5.814 . 0 0 "[ . 1 . 2]" 1
941 1 67 GLU HG2 1 100 MET ME 2.206 . 2.814 2.552 2.105 2.886 0.072 7 0 "[ . 1 . 2]" 1
942 1 67 GLU HG3 1 68 MET H 3.497 . 5.025 4.199 3.799 4.760 . 0 0 "[ . 1 . 2]" 1
943 1 67 GLU HG3 1 86 ARG H 4.179 . 6.362 5.254 4.776 5.975 . 0 0 "[ . 1 . 2]" 1
944 1 67 GLU HG3 1 86 ARG HA 3.271 . 4.608 2.485 2.043 3.158 . 0 0 "[ . 1 . 2]" 1
945 1 67 GLU HG3 1 86 ARG HB2 2.807 . 3.792 3.759 3.332 4.155 0.363 8 0 "[ . 1 . 2]" 1
946 1 67 GLU HG3 1 86 ARG QG 3.730 . 5.469 4.029 2.108 4.375 . 0 0 "[ . 1 . 2]" 1
947 1 67 GLU HG3 1 87 LEU H 3.472 . 4.979 3.583 3.152 4.172 . 0 0 "[ . 1 . 2]" 1
948 1 68 MET H 1 68 MET HA 2.799 . 3.779 2.828 2.775 2.929 . 0 0 "[ . 1 . 2]" 1
949 1 68 MET H 1 68 MET QB 2.977 . 4.085 3.178 2.691 3.361 . 0 0 "[ . 1 . 2]" 1
950 1 68 MET H 1 68 MET QG 3.279 . 3.932 2.605 2.001 2.958 . 0 0 "[ . 1 . 2]" 1
951 1 68 MET H 1 69 ILE H 3.479 . 4.992 4.279 4.161 4.496 . 0 0 "[ . 1 . 2]" 1
952 1 68 MET H 1 84 ARG HA 3.369 . 4.787 4.139 3.784 4.669 . 0 0 "[ . 1 . 2]" 1
953 1 68 MET H 1 85 ALA H 3.001 . 4.127 2.938 2.797 3.175 . 0 0 "[ . 1 . 2]" 1
954 1 68 MET H 1 85 ALA MB 2.957 . 4.050 3.970 3.528 4.185 0.135 3 0 "[ . 1 . 2]" 1
955 1 68 MET H 1 86 ARG HA 3.009 . 4.141 4.144 3.753 4.348 0.207 2 0 "[ . 1 . 2]" 1
956 1 68 MET H 1 87 LEU H 3.722 . 5.453 4.649 3.832 4.989 . 0 0 "[ . 1 . 2]" 1
957 1 68 MET H 1 87 LEU QD 2.958 . 4.051 3.841 3.011 4.223 0.172 4 0 "[ . 1 . 2]" 1
958 1 68 MET H 1 100 MET ME 2.886 . 3.927 2.831 1.947 3.622 . 0 0 "[ . 1 . 2]" 1
959 1 68 MET HA 1 68 MET QB 2.414 . 3.143 2.163 2.146 2.173 . 0 0 "[ . 1 . 2]" 1
960 1 68 MET HA 1 69 ILE H 2.527 . 3.325 2.261 2.110 2.339 . 0 0 "[ . 1 . 2]" 1
961 1 68 MET HA 1 87 LEU QD 3.581 . 5.184 4.909 4.456 5.176 . 0 0 "[ . 1 . 2]" 1
962 1 68 MET QB 1 68 MET QG . . 2.914 2.086 2.029 2.111 . 0 0 "[ . 1 . 2]" 1
963 1 68 MET QB 1 69 ILE H 3.253 . 4.575 2.628 2.388 2.980 . 0 0 "[ . 1 . 2]" 1
964 1 68 MET QG 1 84 ARG H 4.013 . 6.026 5.020 4.625 5.502 . 0 0 "[ . 1 . 2]" 1
965 1 68 MET QG 1 85 ALA H 2.010 . 2.515 2.459 2.173 2.718 0.203 15 0 "[ . 1 . 2]" 1
966 1 68 MET QG 1 85 ALA H 1.977 . 2.465 2.415 2.162 2.640 0.175 15 0 "[ . 1 . 2]" 1
967 1 68 MET QG 1 85 ALA MB 2.777 . 2.984 2.085 1.877 2.296 . 0 0 "[ . 1 . 2]" 1
968 1 68 MET QG 1 87 LEU QD 2.908 . 3.965 2.334 1.908 2.734 0.016 20 0 "[ . 1 . 2]" 1
969 1 69 ILE H 1 69 ILE HB 3.483 . 4.999 2.663 2.378 2.775 . 0 0 "[ . 1 . 2]" 1
970 1 69 ILE H 1 69 ILE HG12 2.752 . 3.699 3.757 3.595 4.001 0.302 12 0 "[ . 1 . 2]" 1
971 1 69 ILE H 1 69 ILE HG13 2.683 . 3.583 2.852 2.456 3.059 . 0 0 "[ . 1 . 2]" 1
972 1 69 ILE H 1 70 ARG H 3.527 . 5.082 4.084 3.822 4.302 . 0 0 "[ . 1 . 2]" 1
973 1 69 ILE H 1 85 ALA H 4.413 . 6.848 4.790 4.599 4.918 . 0 0 "[ . 1 . 2]" 1
974 1 69 ILE HA 1 69 ILE HG12 3.142 . 4.376 2.373 2.124 2.498 . 0 0 "[ . 1 . 2]" 1
975 1 69 ILE HA 1 69 ILE HG13 2.593 . 3.433 3.113 2.693 3.265 . 0 0 "[ . 1 . 2]" 1
976 1 69 ILE HA 1 69 ILE MG 1.818 . 2.231 2.335 2.271 2.504 0.273 12 0 "[ . 1 . 2]" 1
977 1 69 ILE HA 1 70 ARG H 2.985 . 4.099 2.109 2.019 2.169 . 0 0 "[ . 1 . 2]" 1
978 1 69 ILE HA 1 84 ARG HA 2.282 . 2.933 2.402 2.170 2.590 . 0 0 "[ . 1 . 2]" 1
979 1 69 ILE HA 1 85 ALA H 3.111 . 4.321 3.423 3.111 3.635 . 0 0 "[ . 1 . 2]" 1
980 1 69 ILE HB 1 69 ILE MD 1.907 . 2.361 2.480 2.411 2.588 0.227 5 0 "[ . 1 . 2]" 1
981 1 69 ILE HB 1 69 ILE MG 2.251 . 2.884 2.126 2.105 2.137 . 0 0 "[ . 1 . 2]" 1
982 1 69 ILE MD 1 69 ILE HG13 2.090 . 2.636 2.106 2.095 2.114 . 0 0 "[ . 1 . 2]" 1
983 1 69 ILE MD 1 70 ARG H 3.528 . 5.084 5.160 5.040 5.255 0.171 7 0 "[ . 1 . 2]" 1
984 1 69 ILE MD 1 83 VAL H 4.143 . 6.288 5.162 4.410 5.751 . 0 0 "[ . 1 . 2]" 1
985 1 69 ILE MD 1 84 ARG QD 2.833 . 3.836 2.718 2.313 3.571 . 0 0 "[ . 1 . 2]" 1
986 1 69 ILE MD 1 84 ARG HG2 2.626 . 3.488 3.154 2.470 4.011 0.523 13 2 "[ - . 1 + . 2]" 1
987 1 69 ILE MD 1 84 ARG HG3 2.889 . 3.932 2.487 2.063 3.232 . 0 0 "[ . 1 . 2]" 1
988 1 69 ILE HG12 1 84 ARG HA 2.833 . 3.836 2.426 1.909 3.115 . 0 0 "[ . 1 . 2]" 1
989 1 69 ILE HG13 1 84 ARG HA 2.301 . 2.963 3.171 2.951 3.462 0.499 7 0 "[ . 1 . 2]" 1
990 1 69 ILE MG 1 70 ARG H 3.142 . 4.376 2.975 2.774 3.288 . 0 0 "[ . 1 . 2]" 1
991 1 69 ILE MG 1 82 GLN H 3.500 . 5.031 5.177 4.556 5.351 0.320 18 0 "[ . 1 . 2]" 1
992 1 69 ILE MG 1 82 GLN QB 2.854 . 3.872 3.113 1.891 3.610 0.072 19 0 "[ . 1 . 2]" 1
993 1 69 ILE MG 1 82 GLN QG 2.664 . 3.551 1.778 1.696 1.897 0.113 4 0 "[ . 1 . 2]" 1
994 1 69 ILE MG 1 83 VAL H 3.169 . 4.424 2.707 2.065 3.136 . 0 0 "[ . 1 . 2]" 1
995 1 69 ILE MG 1 84 ARG H 3.562 . 5.148 4.008 3.621 4.627 . 0 0 "[ . 1 . 2]" 1
996 1 70 ARG H 1 70 ARG QB 3.408 . 4.860 2.301 2.132 2.479 . 0 0 "[ . 1 . 2]" 1
997 1 70 ARG H 1 70 ARG QG 3.716 . 4.489 3.200 2.412 4.205 . 0 0 "[ . 1 . 2]" 1
998 1 70 ARG H 1 71 ARG H 3.948 . 5.896 4.159 3.471 4.413 . 0 0 "[ . 1 . 2]" 1
999 1 70 ARG H 1 82 GLN HA 4.013 . 6.026 4.236 3.782 5.346 . 0 0 "[ . 1 . 2]" 1
1000 1 70 ARG H 1 83 VAL H 3.131 . 4.356 2.617 2.342 3.336 . 0 0 "[ . 1 . 2]" 1
1001 1 70 ARG H 1 83 VAL QG 3.404 . 4.853 3.711 2.972 3.999 . 0 0 "[ . 1 . 2]" 1
1002 1 70 ARG H 1 84 ARG H 3.390 . 4.827 4.869 4.667 4.956 0.129 19 0 "[ . 1 . 2]" 1
1003 1 70 ARG H 1 84 ARG HA 3.652 . 5.319 3.844 3.501 4.080 . 0 0 "[ . 1 . 2]" 1
1004 1 70 ARG H 1 109 PHE HZ 4.019 . 6.038 3.910 3.190 4.461 . 0 0 "[ . 1 . 2]" 1
1005 1 70 ARG HA 1 70 ARG QB 3.108 . 4.315 2.395 2.243 2.474 . 0 0 "[ . 1 . 2]" 1
1006 1 70 ARG HA 1 70 ARG HD3 3.455 . 4.947 4.129 2.368 4.764 . 0 0 "[ . 1 . 2]" 1
1007 1 70 ARG HA 1 70 ARG QG 3.505 . 4.801 2.511 2.169 3.235 . 0 0 "[ . 1 . 2]" 1
1008 1 70 ARG HA 1 71 ARG H 3.572 . 5.167 2.194 2.015 2.304 . 0 0 "[ . 1 . 2]" 1
1009 1 70 ARG QB 1 71 ARG H 3.956 . 5.912 3.756 3.418 4.002 . 0 0 "[ . 1 . 2]" 1
1010 1 70 ARG QB 1 73 PHE H 3.436 . 4.911 4.770 4.246 5.116 0.205 5 0 "[ . 1 . 2]" 1
1011 1 70 ARG QB 1 83 VAL H 3.893 . 5.787 2.762 2.190 5.106 . 0 0 "[ . 1 . 2]" 1
1012 1 70 ARG QB 1 83 VAL HB 3.329 . 4.714 2.760 1.900 4.594 0.044 12 0 "[ . 1 . 2]" 1
1013 1 70 ARG QB 1 83 VAL QG 2.676 . 3.571 3.260 2.850 3.762 0.191 5 0 "[ . 1 . 2]" 1
1014 1 70 ARG QB 1 109 PHE HZ 3.416 . 3.802 3.016 1.822 3.758 0.135 12 0 "[ . 1 . 2]" 1
1015 1 70 ARG HD2 1 70 ARG QG 2.933 . 4.008 2.231 2.128 2.436 . 0 0 "[ . 1 . 2]" 1
1016 1 70 ARG HD2 1 83 VAL QG 4.239 . 6.486 4.729 3.783 6.173 . 0 0 "[ . 1 . 2]" 1
1017 1 70 ARG HD2 1 111 LEU HA 3.475 . 4.984 3.950 2.503 4.847 . 0 0 "[ . 1 . 2]" 1
1018 1 70 ARG HD2 1 111 LEU QD 2.975 . 4.081 2.569 1.950 3.383 . 0 0 "[ . 1 . 2]" 1
1019 1 70 ARG HD3 1 70 ARG QG 3.084 . 4.273 2.333 2.173 2.499 . 0 0 "[ . 1 . 2]" 1
1020 1 70 ARG HD3 1 109 PHE HZ 3.177 . 4.439 3.284 2.362 5.196 0.757 4 1 "[ +. 1 . 2]" 1
1021 1 70 ARG HD3 1 111 LEU QD 3.044 . 4.202 3.167 1.817 4.050 0.069 6 0 "[ . 1 . 2]" 1
1022 1 70 ARG QG 1 71 ARG H 3.294 . 4.651 4.017 3.622 4.390 . 0 0 "[ . 1 . 2]" 1
1023 1 70 ARG QG 1 109 PHE HZ 2.797 . 3.775 2.968 2.114 3.742 . 0 0 "[ . 1 . 2]" 1
1024 1 70 ARG QG 1 111 LEU QD 2.851 . 3.867 2.503 1.605 3.646 0.230 5 0 "[ . 1 . 2]" 1
1025 1 71 ARG H 1 72 PRO QD 3.658 . 5.331 4.367 3.744 4.486 . 0 0 "[ . 1 . 2]" 1
1026 1 71 ARG H 1 73 PHE HZ 3.285 . 4.634 2.950 2.257 4.824 0.190 12 0 "[ . 1 . 2]" 1
1027 1 71 ARG H 1 111 LEU QD 3.853 . 5.709 5.093 2.896 5.842 0.133 5 0 "[ . 1 . 2]" 1
1028 1 72 PRO HA 1 72 PRO HB3 2.190 . 2.790 2.251 2.240 2.297 . 0 0 "[ . 1 . 2]" 1
1029 1 72 PRO HA 1 72 PRO QD 2.347 . 3.035 2.982 2.880 3.433 0.398 12 0 "[ . 1 . 2]" 1
1030 1 72 PRO HA 1 72 PRO QG 2.446 . 3.194 3.357 2.875 3.430 0.236 6 0 "[ . 1 . 2]" 1
1031 1 72 PRO HA 1 73 PHE H 2.060 . 2.590 2.031 1.948 2.148 . 0 0 "[ . 1 . 2]" 1
1032 1 72 PRO HA 1 73 PHE QB 3.470 . 4.975 4.480 4.175 4.648 . 0 0 "[ . 1 . 2]" 1
1033 1 72 PRO HA 1 80 GLU H 4.656 . 7.365 3.607 2.856 4.835 . 0 0 "[ . 1 . 2]" 1
1034 1 72 PRO HA 1 81 GLY H 4.282 . 6.574 5.626 4.724 7.772 1.198 19 1 "[ . 1 . +2]" 1
1035 1 72 PRO HB2 1 73 PHE H 2.729 . 3.660 3.709 3.665 3.811 0.151 5 0 "[ . 1 . 2]" 1
1036 1 72 PRO HB3 1 73 PHE H 2.809 . 3.795 3.748 3.262 3.942 0.147 12 0 "[ . 1 . 2]" 1
1037 1 72 PRO HB3 1 81 GLY HA2 3.435 . 4.910 3.385 2.393 4.834 . 0 0 "[ . 1 . 2]" 1
1038 1 72 PRO HB3 1 81 GLY HA3 3.170 . 4.426 4.377 3.533 5.047 0.621 5 1 "[ + 1 . 2]" 1
1039 1 72 PRO QD 1 72 PRO QG 2.022 . 2.533 1.978 1.931 1.994 . 0 0 "[ . 1 . 2]" 1
1040 1 72 PRO QD 1 73 PHE H 3.240 . 4.552 4.637 4.466 4.679 0.127 14 0 "[ . 1 . 2]" 1
1041 1 72 PRO QD 1 82 GLN H 3.785 . 5.575 3.338 2.283 6.839 1.264 19 1 "[ . 1 . +2]" 1
1042 1 72 PRO QG 1 73 PHE H 3.515 . 5.060 4.758 4.458 4.868 . 0 0 "[ . 1 . 2]" 1
1043 1 73 PHE H 1 73 PHE HA 2.695 . 3.603 2.943 2.874 2.956 . 0 0 "[ . 1 . 2]" 1
1044 1 73 PHE H 1 73 PHE HB2 2.522 . 3.317 2.778 2.440 3.060 . 0 0 "[ . 1 . 2]" 1
1045 1 73 PHE H 1 73 PHE QE 3.786 . 5.578 4.918 4.189 5.201 . 0 0 "[ . 1 . 2]" 1
1046 1 73 PHE H 1 74 ASP H 3.759 . 5.525 4.399 4.260 4.601 . 0 0 "[ . 1 . 2]" 1
1047 1 73 PHE H 1 74 ASP HA 3.440 . 4.919 3.445 2.804 4.646 . 0 0 "[ . 1 . 2]" 1
1048 1 73 PHE H 1 75 PHE QD 4.158 . 6.319 4.765 3.135 5.638 . 0 0 "[ . 1 . 2]" 1
1049 1 73 PHE H 1 80 GLU H 2.919 . 3.984 3.225 2.808 3.997 0.013 19 0 "[ . 1 . 2]" 1
1050 1 73 PHE HA 1 73 PHE QB 2.178 . 2.771 2.325 2.269 2.403 . 0 0 "[ . 1 . 2]" 1
1051 1 73 PHE HA 1 73 PHE QD 2.482 . 3.252 2.465 2.171 3.158 . 0 0 "[ . 1 . 2]" 1
1052 1 73 PHE HA 1 74 ASP H 2.605 . 3.453 2.292 2.158 2.516 . 0 0 "[ . 1 . 2]" 1
1053 1 73 PHE QB 1 73 PHE QD 2.185 . 2.782 2.151 2.112 2.184 . 0 0 "[ . 1 . 2]" 1
1054 1 73 PHE QB 1 75 PHE H 3.001 . 4.127 3.588 3.375 3.969 . 0 0 "[ . 1 . 2]" 1
1055 1 73 PHE QB 1 80 GLU H 3.624 . 5.266 4.848 4.163 5.339 0.073 19 0 "[ . 1 . 2]" 1
1056 1 73 PHE HB3 1 74 ASP H 2.950 . 4.038 3.001 2.362 3.432 . 0 0 "[ . 1 . 2]" 1
1057 1 73 PHE QD 1 75 PHE H 3.713 . 5.436 5.526 5.276 5.730 0.294 19 0 "[ . 1 . 2]" 1
1058 1 73 PHE QD 1 75 PHE QD 3.194 . 4.469 3.880 2.918 4.565 0.096 7 0 "[ . 1 . 2]" 1
1059 1 74 ASP H 1 74 ASP HB2 2.984 . 4.097 3.677 3.565 3.734 . 0 0 "[ . 1 . 2]" 1
1060 1 74 ASP H 1 74 ASP HB3 2.977 . 4.085 2.950 2.727 3.154 . 0 0 "[ . 1 . 2]" 1
1061 1 74 ASP H 1 75 PHE QD 3.810 . 5.625 4.241 2.909 5.288 . 0 0 "[ . 1 . 2]" 1
1062 1 74 ASP HA 1 74 ASP HB2 2.562 . 3.383 2.485 2.421 2.632 . 0 0 "[ . 1 . 2]" 1
1063 1 74 ASP HA 1 74 ASP HB3 2.309 . 2.976 2.348 2.245 2.404 . 0 0 "[ . 1 . 2]" 1
1064 1 74 ASP HA 1 75 PHE H 2.133 . 2.702 2.250 2.165 2.310 . 0 0 "[ . 1 . 2]" 1
1065 1 74 ASP HB2 1 75 PHE H 3.000 . 4.125 4.131 4.024 4.177 0.052 7 0 "[ . 1 . 2]" 1
1066 1 74 ASP HB2 1 79 LYS QD 2.760 . 3.712 3.142 2.485 4.291 0.579 10 1 "[ . + . 2]" 1
1067 1 74 ASP HB2 1 79 LYS QE 2.233 . 2.856 2.849 2.475 2.989 0.133 7 0 "[ . 1 . 2]" 1
1068 1 74 ASP HB3 1 75 PHE H 2.996 . 4.118 4.446 4.403 4.470 0.352 16 0 "[ . 1 . 2]" 1
1069 1 74 ASP HB3 1 79 LYS QE 2.183 . 2.779 2.372 1.983 2.985 0.206 5 0 "[ . 1 . 2]" 1
1070 1 75 PHE H 1 75 PHE HA 2.654 . 3.534 2.922 2.879 2.943 . 0 0 "[ . 1 . 2]" 1
1071 1 75 PHE H 1 75 PHE HB2 2.744 . 3.685 2.573 2.465 2.672 . 0 0 "[ . 1 . 2]" 1
1072 1 75 PHE H 1 75 PHE HB3 2.792 . 3.767 3.719 3.640 3.771 0.004 1 0 "[ . 1 . 2]" 1
1073 1 75 PHE H 1 75 PHE QD 2.933 . 4.009 3.070 2.423 3.521 . 0 0 "[ . 1 . 2]" 1
1074 1 75 PHE H 1 76 PRO HD2 3.328 . 4.713 4.994 4.929 5.028 0.315 20 0 "[ . 1 . 2]" 1
1075 1 75 PHE H 1 76 PRO HD3 3.237 . 4.547 4.472 4.388 4.564 0.017 5 0 "[ . 1 . 2]" 1
1076 1 75 PHE H 1 77 ASP H 4.001 . 6.002 5.038 4.886 5.337 . 0 0 "[ . 1 . 2]" 1
1077 1 75 PHE H 1 78 SER H 3.446 . 4.930 3.871 3.600 4.053 . 0 0 "[ . 1 . 2]" 1
1078 1 75 PHE H 1 78 SER QB 3.175 . 4.435 4.192 3.654 4.462 0.027 3 0 "[ . 1 . 2]" 1
1079 1 75 PHE H 1 79 LYS QB 2.308 . 2.974 2.707 2.335 3.044 0.070 19 0 "[ . 1 . 2]" 1
1080 1 75 PHE H 1 79 LYS HG2 3.851 . 5.705 5.057 4.578 5.434 . 0 0 "[ . 1 . 2]" 1
1081 1 75 PHE HA 1 75 PHE HB2 2.471 . 3.234 3.005 2.988 3.019 . 0 0 "[ . 1 . 2]" 1
1082 1 75 PHE HA 1 75 PHE HB3 2.326 . 3.002 2.482 2.387 2.576 . 0 0 "[ . 1 . 2]" 1
1083 1 75 PHE HA 1 75 PHE QD 2.597 . 3.440 2.675 2.229 3.100 . 0 0 "[ . 1 . 2]" 1
1084 1 75 PHE HA 1 76 PRO HD2 2.248 . 2.879 2.564 2.403 2.696 . 0 0 "[ . 1 . 2]" 1
1085 1 75 PHE HA 1 76 PRO HD3 2.139 . 2.711 1.724 1.690 1.782 . 0 0 "[ . 1 . 2]" 1
1086 1 75 PHE HA 1 76 PRO HG2 2.966 . 4.066 4.272 4.213 4.347 0.281 9 0 "[ . 1 . 2]" 1
1087 1 75 PHE HA 1 76 PRO HG3 2.926 . 3.996 3.894 3.843 3.958 . 0 0 "[ . 1 . 2]" 1
1088 1 75 PHE HB2 1 75 PHE QD 2.397 . 3.115 2.334 2.266 2.525 . 0 0 "[ . 1 . 2]" 1
1089 1 75 PHE HB2 1 76 PRO HD2 2.848 . 3.862 3.847 3.685 3.944 0.082 14 0 "[ . 1 . 2]" 1
1090 1 75 PHE HB2 1 76 PRO HD3 2.945 . 4.029 4.283 4.189 4.362 0.333 7 0 "[ . 1 . 2]" 1
1091 1 75 PHE HB2 1 77 ASP H 3.239 . 4.550 3.467 3.063 3.770 . 0 0 "[ . 1 . 2]" 1
1092 1 75 PHE HB2 1 78 SER H 3.003 . 4.130 2.668 2.130 3.041 . 0 0 "[ . 1 . 2]" 1
1093 1 75 PHE HB3 1 75 PHE QD 2.457 . 3.212 2.494 2.295 2.719 . 0 0 "[ . 1 . 2]" 1
1094 1 75 PHE HB3 1 76 PRO HD2 2.488 . 3.262 2.319 2.100 2.500 . 0 0 "[ . 1 . 2]" 1
1095 1 75 PHE HB3 1 76 PRO HD3 2.715 . 3.636 3.203 2.996 3.402 . 0 0 "[ . 1 . 2]" 1
1096 1 75 PHE HB3 1 76 PRO HG2 3.472 . 4.979 4.605 4.389 4.777 . 0 0 "[ . 1 . 2]" 1
1097 1 75 PHE HB3 1 77 ASP H 3.066 . 4.241 2.680 2.555 2.861 . 0 0 "[ . 1 . 2]" 1
1098 1 75 PHE HB3 1 77 ASP QB 2.629 . 3.493 3.571 3.504 3.654 0.161 5 0 "[ . 1 . 2]" 1
1099 1 75 PHE HB3 1 78 SER H 3.030 . 4.177 3.186 2.691 3.523 . 0 0 "[ . 1 . 2]" 1
1100 1 75 PHE QD 1 76 PRO HD2 2.888 . 3.930 3.057 2.631 3.561 . 0 0 "[ . 1 . 2]" 1
1101 1 75 PHE QD 1 76 PRO HD3 3.084 . 4.273 3.271 2.954 3.751 . 0 0 "[ . 1 . 2]" 1
1102 1 75 PHE QD 1 77 ASP H 3.758 . 5.524 4.597 4.257 4.783 . 0 0 "[ . 1 . 2]" 1
1103 1 75 PHE QD 1 78 SER H 3.627 . 5.271 4.542 3.960 4.904 . 0 0 "[ . 1 . 2]" 1
1104 1 76 PRO HA 1 76 PRO HB3 2.001 . 2.502 2.274 2.267 2.296 . 0 0 "[ . 1 . 2]" 1
1105 1 76 PRO HA 1 76 PRO HD2 3.011 . 4.144 3.892 3.883 3.898 . 0 0 "[ . 1 . 2]" 1
1106 1 76 PRO HA 1 77 ASP H 2.463 . 3.221 3.414 3.391 3.438 0.217 7 0 "[ . 1 . 2]" 1
1107 1 76 PRO HA 1 77 ASP HA 3.078 . 4.263 4.507 4.483 4.543 0.280 3 0 "[ . 1 . 2]" 1
1108 1 76 PRO HA 1 77 ASP QB 3.560 . 5.144 5.062 5.006 5.279 0.135 5 0 "[ . 1 . 2]" 1
1109 1 76 PRO HA 1 78 SER H 2.848 . 3.862 4.018 3.959 4.087 0.225 5 0 "[ . 1 . 2]" 1
1110 1 76 PRO HB2 1 76 PRO HD2 3.018 . 4.156 2.974 2.931 3.013 . 0 0 "[ . 1 . 2]" 1
1111 1 76 PRO HB2 1 76 PRO HD3 3.037 . 4.190 3.871 3.850 3.884 . 0 0 "[ . 1 . 2]" 1
1112 1 76 PRO HB2 1 77 ASP H 2.836 . 3.842 2.725 2.580 2.826 . 0 0 "[ . 1 . 2]" 1
1113 1 76 PRO HB2 1 77 ASP QB 2.751 . 3.697 3.586 3.425 3.863 0.166 5 0 "[ . 1 . 2]" 1
1114 1 76 PRO HB2 1 78 SER H 3.582 . 5.186 4.712 4.558 4.775 . 0 0 "[ . 1 . 2]" 1
1115 1 76 PRO HB3 1 77 ASP H 2.868 . 3.896 4.000 3.906 4.055 0.159 20 0 "[ . 1 . 2]" 1
1116 1 76 PRO HB3 1 78 SER H 4.120 . 6.242 5.536 5.493 5.581 . 0 0 "[ . 1 . 2]" 1
1117 1 76 PRO HD2 1 76 PRO HG2 2.419 . 3.151 2.294 2.276 2.301 . 0 0 "[ . 1 . 2]" 1
1118 1 76 PRO HD2 1 76 PRO HG3 2.186 . 2.784 2.961 2.956 2.966 0.182 10 0 "[ . 1 . 2]" 1
1119 1 76 PRO HD2 1 77 ASP H 3.102 . 4.305 2.607 2.498 2.693 . 0 0 "[ . 1 . 2]" 1
1120 1 76 PRO HD2 1 78 SER H 3.520 . 5.069 4.244 4.075 4.441 . 0 0 "[ . 1 . 2]" 1
1121 1 76 PRO HD3 1 76 PRO HG2 2.405 . 3.128 2.668 2.651 2.684 . 0 0 "[ . 1 . 2]" 1
1122 1 76 PRO HD3 1 77 ASP H 3.195 . 4.471 3.846 3.769 3.902 . 0 0 "[ . 1 . 2]" 1
1123 1 76 PRO HD3 1 78 SER H 3.546 . 5.118 4.928 4.787 5.094 . 0 0 "[ . 1 . 2]" 1
1124 1 76 PRO HG2 1 77 ASP H 3.187 . 4.457 3.980 3.885 4.059 . 0 0 "[ . 1 . 2]" 1
1125 1 76 PRO HG3 1 77 ASP H 3.194 . 4.469 4.460 4.426 4.489 0.020 3 0 "[ . 1 . 2]" 1
1126 1 76 PRO HG3 1 78 SER H 4.077 . 6.155 5.914 5.821 6.011 . 0 0 "[ . 1 . 2]" 1
1127 1 77 ASP H 1 77 ASP HA 2.196 . 2.799 2.877 2.844 2.891 0.092 7 0 "[ . 1 . 2]" 1
1128 1 77 ASP H 1 77 ASP QB 2.425 . 3.160 2.300 2.239 2.347 . 0 0 "[ . 1 . 2]" 1
1129 1 77 ASP H 1 78 SER H 2.453 . 3.205 2.266 2.169 2.361 . 0 0 "[ . 1 . 2]" 1
1130 1 77 ASP H 1 78 SER QB 3.409 . 4.861 4.366 4.095 4.699 . 0 0 "[ . 1 . 2]" 1
1131 1 77 ASP HA 1 77 ASP QB 1.862 . 2.296 2.339 2.287 2.427 0.131 13 0 "[ . 1 . 2]" 1
1132 1 77 ASP HA 1 78 SER H 2.450 . 3.200 3.306 3.266 3.362 0.162 3 0 "[ . 1 . 2]" 1
1133 1 77 ASP HA 1 79 LYS H 3.843 . 5.689 5.734 5.508 5.904 0.215 5 0 "[ . 1 . 2]" 1
1134 1 77 ASP QB 1 78 SER H 2.742 . 3.682 3.235 3.061 3.350 . 0 0 "[ . 1 . 2]" 1
1135 1 78 SER H 1 78 SER QB 2.344 . 3.031 2.930 2.845 3.225 0.194 9 0 "[ . 1 . 2]" 1
1136 1 78 SER H 1 79 LYS H 3.327 . 4.710 3.715 3.593 3.850 . 0 0 "[ . 1 . 2]" 1
1137 1 78 SER H 1 80 GLU H 4.302 . 6.616 6.435 6.085 6.650 0.034 7 0 "[ . 1 . 2]" 1
1138 1 78 SER QB 1 79 LYS H 3.075 . 4.257 3.603 3.435 3.964 . 0 0 "[ . 1 . 2]" 1
1139 1 78 SER QB 1 80 GLU H 3.449 . 4.936 4.661 4.298 4.999 0.063 17 0 "[ . 1 . 2]" 1
1140 1 79 LYS H 1 79 LYS QB 2.603 . 3.450 2.720 2.576 3.205 . 0 0 "[ . 1 . 2]" 1
1141 1 79 LYS H 1 79 LYS QG 3.368 . 4.786 4.045 2.301 4.195 . 0 0 "[ . 1 . 2]" 1
1142 1 79 LYS H 1 80 GLU H 3.291 . 4.645 3.679 3.391 3.912 . 0 0 "[ . 1 . 2]" 1
1143 1 79 LYS H 1 80 GLU QG 4.097 . 6.195 3.257 2.638 4.533 . 0 0 "[ . 1 . 2]" 1
1144 1 79 LYS H 1 81 GLY H 4.319 . 6.651 6.749 6.534 7.001 0.350 5 0 "[ . 1 . 2]" 1
1145 1 79 LYS HA 1 79 LYS QB 2.543 . 3.316 2.313 2.154 2.378 . 0 0 "[ . 1 . 2]" 1
1146 1 79 LYS HA 1 79 LYS HG2 2.763 . 3.717 3.358 3.050 3.912 0.195 19 0 "[ . 1 . 2]" 1
1147 1 79 LYS HA 1 80 GLU H 2.229 . 2.850 2.106 2.055 2.184 . 0 0 "[ . 1 . 2]" 1
1148 1 79 LYS QB 1 79 LYS QD 1.973 . 2.460 2.163 2.059 2.424 . 0 0 "[ . 1 . 2]" 1
1149 1 79 LYS QB 1 79 LYS QE 3.494 . 5.020 3.416 1.893 3.826 0.075 5 0 "[ . 1 . 2]" 1
1150 1 79 LYS QB 1 80 GLU H 2.969 . 4.071 3.880 3.430 3.939 . 0 0 "[ . 1 . 2]" 1
1151 1 79 LYS QD 1 79 LYS HG3 1.815 . 2.227 2.127 2.109 2.132 . 0 0 "[ . 1 . 2]" 1
1152 1 79 LYS QE 1 80 GLU H 4.127 . 6.256 5.539 4.877 6.261 0.005 14 0 "[ . 1 . 2]" 1
1153 1 79 LYS QG 1 80 GLU H 3.179 . 4.442 3.549 3.217 4.465 0.023 5 0 "[ . 1 . 2]" 1
1154 1 80 GLU H 1 80 GLU HA 2.278 . 2.927 2.900 2.796 2.934 0.007 11 0 "[ . 1 . 2]" 1
1155 1 80 GLU H 1 80 GLU HB2 2.511 . 3.299 2.920 2.500 3.976 0.677 9 4 "[ * . +1 .*- 2]" 1
1156 1 80 GLU H 1 80 GLU HB3 2.938 . 4.017 3.673 3.326 3.830 . 0 0 "[ . 1 . 2]" 1
1157 1 80 GLU H 1 80 GLU QG 2.620 . 3.478 3.139 2.152 3.502 0.024 10 0 "[ . 1 . 2]" 1
1158 1 80 GLU H 1 81 GLY HA3 4.203 . 6.411 5.847 5.472 6.103 . 0 0 "[ . 1 . 2]" 1
1159 1 80 GLU H 1 82 GLN H 4.172 . 6.347 6.474 5.881 6.886 0.539 9 1 "[ . +1 . 2]" 1
1160 1 80 GLU HA 1 80 GLU HB3 2.889 . 3.933 2.539 2.380 2.680 . 0 0 "[ . 1 . 2]" 1
1161 1 80 GLU HA 1 80 GLU QG 2.256 . 2.892 2.526 2.178 3.370 0.478 2 0 "[ . 1 . 2]" 1
1162 1 80 GLU HA 1 81 GLY H 2.299 . 2.960 2.454 2.231 2.695 . 0 0 "[ . 1 . 2]" 1
1163 1 80 GLU HA 1 82 GLN H 4.466 . 6.959 6.237 5.925 6.472 . 0 0 "[ . 1 . 2]" 1
1164 1 80 GLU HB2 1 81 GLY H 2.977 . 4.085 3.185 1.890 3.785 . 0 0 "[ . 1 . 2]" 1
1165 1 80 GLU HB3 1 81 GLY H 3.030 . 4.177 2.399 1.794 3.913 0.089 7 0 "[ . 1 . 2]" 1
1166 1 80 GLU QG 1 81 GLY H 2.867 . 3.895 3.415 2.817 3.889 . 0 0 "[ . 1 . 2]" 1
1167 1 81 GLY H 1 81 GLY HA2 2.657 . 3.539 2.889 2.849 2.906 . 0 0 "[ . 1 . 2]" 1
1168 1 81 GLY H 1 81 GLY HA3 2.354 . 3.047 2.325 2.290 2.356 . 0 0 "[ . 1 . 2]" 1
1169 1 81 GLY H 1 82 GLN HA 3.808 . 5.621 5.637 5.310 5.746 0.125 8 0 "[ . 1 . 2]" 1
1170 1 81 GLY H 1 83 VAL QG 3.924 . 5.848 4.872 4.318 5.967 0.119 5 0 "[ . 1 . 2]" 1
1171 1 81 GLY HA2 1 82 GLN H 2.198 . 2.802 2.286 2.059 3.077 0.275 17 0 "[ . 1 . 2]" 1
1172 1 81 GLY HA2 1 82 GLN QB 2.879 . 3.915 3.964 3.755 4.315 0.400 17 0 "[ . 1 . 2]" 1
1173 1 81 GLY HA3 1 82 GLN H 2.623 . 3.483 2.708 1.940 3.137 . 0 0 "[ . 1 . 2]" 1
1174 1 81 GLY HA3 1 82 GLN QB 3.387 . 4.821 4.288 3.624 4.846 0.025 19 0 "[ . 1 . 2]" 1
1175 1 82 GLN H 1 82 GLN HA 2.806 . 3.790 2.709 2.620 2.840 . 0 0 "[ . 1 . 2]" 1
1176 1 82 GLN H 1 82 GLN QB 2.706 . 3.621 1.999 1.894 2.148 0.039 2 0 "[ . 1 . 2]" 1
1177 1 82 GLN H 1 82 GLN QG 2.811 . 3.799 3.691 3.059 3.785 . 0 0 "[ . 1 . 2]" 1
1178 1 82 GLN H 1 83 VAL H 3.542 . 5.111 4.513 4.420 4.571 . 0 0 "[ . 1 . 2]" 1
1179 1 82 GLN H 1 83 VAL QG 3.520 . 5.069 4.605 4.230 4.965 . 0 0 "[ . 1 . 2]" 1
1180 1 82 GLN HA 1 82 GLN QB 1.957 . 2.436 2.240 2.120 2.445 0.009 5 0 "[ . 1 . 2]" 1
1181 1 82 GLN HA 1 82 GLN QG 2.834 . 3.838 2.587 1.930 3.197 . 0 0 "[ . 1 . 2]" 1
1182 1 82 GLN HA 1 83 VAL H 2.357 . 3.051 2.250 2.073 2.640 . 0 0 "[ . 1 . 2]" 1
1183 1 82 GLN QB 1 83 VAL H 3.200 . 4.480 3.260 2.124 3.491 . 0 0 "[ . 1 . 2]" 1
1184 1 82 GLN QG 1 83 VAL H 1.882 . 2.325 2.246 2.155 2.355 0.030 19 0 "[ . 1 . 2]" 1
1185 1 82 GLN QG 1 84 ARG H 3.887 . 5.775 3.814 3.423 5.140 . 0 0 "[ . 1 . 2]" 1
1186 1 83 VAL H 1 83 VAL HB 2.664 . 3.551 2.976 2.616 3.045 . 0 0 "[ . 1 . 2]" 1
1187 1 83 VAL H 1 83 VAL QG 2.545 . 3.354 3.156 3.097 3.257 . 0 0 "[ . 1 . 2]" 1
1188 1 83 VAL H 1 84 ARG H 3.387 . 4.821 4.038 3.904 4.307 . 0 0 "[ . 1 . 2]" 1
1189 1 83 VAL HA 1 83 VAL HB 2.578 . 3.409 3.023 2.951 3.032 . 0 0 "[ . 1 . 2]" 1
1190 1 83 VAL HA 1 83 VAL QG 1.954 . 2.431 2.135 2.101 2.146 . 0 0 "[ . 1 . 2]" 1
1191 1 83 VAL HA 1 84 ARG H 2.058 . 2.587 2.150 2.093 2.201 . 0 0 "[ . 1 . 2]" 1
1192 1 83 VAL HB 1 83 VAL QG 2.064 . 2.597 1.902 1.894 1.906 . 0 0 "[ . 1 . 2]" 1
1193 1 83 VAL HB 1 84 ARG H 3.148 . 4.387 4.251 4.128 4.368 . 0 0 "[ . 1 . 2]" 1
1194 1 83 VAL HB 1 109 PHE HZ 2.840 . 3.848 2.206 1.844 3.106 . 0 0 "[ . 1 . 2]" 1
1195 1 83 VAL QG 1 84 ARG H 2.437 . 3.179 2.606 2.493 2.846 . 0 0 "[ . 1 . 2]" 1
1196 1 83 VAL QG 1 84 ARG HA 3.310 . 4.680 3.517 3.367 3.680 . 0 0 "[ . 1 . 2]" 1
1197 1 83 VAL QG 1 85 ALA H 3.132 . 4.358 3.430 3.286 3.643 . 0 0 "[ . 1 . 2]" 1
1198 1 83 VAL QG 1 85 ALA HA 3.387 . 4.821 3.336 3.171 3.467 . 0 0 "[ . 1 . 2]" 1
1199 1 83 VAL QG 1 86 ARG H 3.407 . 4.858 4.978 4.842 5.082 0.224 10 0 "[ . 1 . 2]" 1
1200 1 83 VAL QG 1 99 ASN H 3.908 . 5.817 5.560 5.099 5.727 . 0 0 "[ . 1 . 2]" 1
1201 1 83 VAL QG 1 99 ASN HA 2.771 . 3.731 3.478 3.096 3.684 . 0 0 "[ . 1 . 2]" 1
1202 1 83 VAL QG 1 99 ASN QB 3.402 . 4.849 4.060 3.528 4.403 . 0 0 "[ . 1 . 2]" 1
1203 1 83 VAL QG 1 100 MET H 3.479 . 4.992 3.896 3.573 4.044 . 0 0 "[ . 1 . 2]" 1
1204 1 83 VAL QG 1 101 GLU H 3.539 . 5.104 4.429 3.880 4.826 . 0 0 "[ . 1 . 2]" 1
1205 1 83 VAL QG 1 101 GLU HB2 3.791 . 5.587 5.399 4.796 6.098 0.511 10 1 "[ . + . 2]" 1
1206 1 83 VAL QG 1 102 ASN H 4.121 . 6.244 5.672 4.997 6.002 . 0 0 "[ . 1 . 2]" 1
1207 1 83 VAL QG 1 109 PHE QE 2.358 . 3.053 2.209 1.834 2.944 . 0 0 "[ . 1 . 2]" 1
1208 1 83 VAL QG 1 109 PHE HZ 2.487 . 3.260 2.359 2.091 2.933 . 0 0 "[ . 1 . 2]" 1
1209 1 84 ARG H 1 84 ARG HA 2.617 . 3.473 2.875 2.843 2.894 . 0 0 "[ . 1 . 2]" 1
1210 1 84 ARG H 1 84 ARG HB2 2.777 . 3.741 2.137 2.003 2.383 . 0 0 "[ . 1 . 2]" 1
1211 1 84 ARG H 1 84 ARG HB3 2.757 . 3.707 3.170 2.516 3.475 . 0 0 "[ . 1 . 2]" 1
1212 1 84 ARG H 1 84 ARG QD 4.024 . 6.049 4.293 3.363 4.663 . 0 0 "[ . 1 . 2]" 1
1213 1 84 ARG H 1 84 ARG HG2 3.026 . 4.170 4.294 4.163 4.423 0.253 4 0 "[ . 1 . 2]" 1
1214 1 84 ARG H 1 84 ARG HG3 3.116 . 4.330 3.483 2.988 4.304 . 0 0 "[ . 1 . 2]" 1
1215 1 84 ARG H 1 85 ALA H 3.470 . 4.975 4.358 4.277 4.439 . 0 0 "[ . 1 . 2]" 1
1216 1 84 ARG H 1 100 MET ME 3.082 . 4.269 4.494 4.418 4.673 0.404 18 0 "[ . 1 . 2]" 1
1217 1 84 ARG HA 1 84 ARG HB3 2.665 . 3.552 2.755 2.586 2.995 . 0 0 "[ . 1 . 2]" 1
1218 1 84 ARG HA 1 84 ARG QD 2.982 . 4.094 3.920 3.770 4.066 . 0 0 "[ . 1 . 2]" 1
1219 1 84 ARG HA 1 84 ARG HG2 2.925 . 3.994 2.550 2.348 3.035 . 0 0 "[ . 1 . 2]" 1
1220 1 84 ARG HA 1 84 ARG HG3 3.219 . 4.515 2.361 2.222 2.524 . 0 0 "[ . 1 . 2]" 1
1221 1 84 ARG HA 1 85 ALA H 2.046 . 2.569 2.183 2.094 2.345 . 0 0 "[ . 1 . 2]" 1
1222 1 84 ARG HB2 1 85 ALA H 3.273 . 4.612 4.527 4.327 4.689 0.077 13 0 "[ . 1 . 2]" 1
1223 1 84 ARG HB3 1 84 ARG QD 2.932 . 4.007 2.482 2.192 3.006 . 0 0 "[ . 1 . 2]" 1
1224 1 84 ARG QD 1 84 ARG HG2 2.381 . 3.089 2.213 2.138 2.503 . 0 0 "[ . 1 . 2]" 1
1225 1 84 ARG QD 1 84 ARG HG3 2.251 . 2.884 2.336 2.128 2.397 . 0 0 "[ . 1 . 2]" 1
1226 1 84 ARG HD2 1 100 MET HG2 3.012 . 4.146 3.783 3.343 4.325 0.179 8 0 "[ . 1 . 2]" 1
1227 1 84 ARG QD 1 100 MET HB2 3.203 . 4.485 3.140 2.394 3.706 . 0 0 "[ . 1 . 2]" 1
1228 1 84 ARG QD 1 100 MET ME 2.052 . 2.578 2.416 2.059 2.747 0.169 3 0 "[ . 1 . 2]" 1
1229 1 84 ARG HG2 1 85 ALA H 3.122 . 4.341 3.844 3.433 4.300 . 0 0 "[ . 1 . 2]" 1
1230 1 84 ARG HG2 1 100 MET ME 2.078 . 2.618 1.983 1.616 2.224 . 0 0 "[ . 1 . 2]" 1
1231 1 84 ARG HG3 1 85 ALA H 2.913 . 3.974 4.332 3.832 4.445 0.471 20 0 "[ . 1 . 2]" 1
1232 1 84 ARG HG3 1 100 MET ME 2.572 . 3.399 3.262 2.191 3.456 0.057 7 0 "[ . 1 . 2]" 1
1233 1 85 ALA H 1 85 ALA MB 2.104 . 2.657 2.532 2.431 2.616 . 0 0 "[ . 1 . 2]" 1
1234 1 85 ALA H 1 101 GLU H 4.479 . 6.987 5.927 5.693 6.177 . 0 0 "[ . 1 . 2]" 1
1235 1 85 ALA H 1 87 LEU QD 3.286 . 4.636 4.289 4.030 4.546 . 0 0 "[ . 1 . 2]" 1
1236 1 85 ALA H 1 100 MET ME 2.997 . 4.120 2.874 2.284 3.876 . 0 0 "[ . 1 . 2]" 1
1237 1 85 ALA HA 1 85 ALA MB 2.045 . 2.568 2.123 2.115 2.131 . 0 0 "[ . 1 . 2]" 1
1238 1 85 ALA HA 1 86 ARG H 2.057 . 2.586 2.081 1.986 2.225 . 0 0 "[ . 1 . 2]" 1
1239 1 85 ALA HA 1 86 ARG HA 3.378 . 4.805 4.312 4.284 4.348 . 0 0 "[ . 1 . 2]" 1
1240 1 85 ALA HA 1 86 ARG HB2 2.899 . 3.949 3.794 3.445 3.960 0.011 15 0 "[ . 1 . 2]" 1
1241 1 85 ALA HA 1 87 LEU QD 3.092 . 4.287 4.121 3.870 4.280 . 0 0 "[ . 1 . 2]" 1
1242 1 85 ALA HA 1 97 ILE MG 3.728 . 5.466 3.630 3.446 3.882 . 0 0 "[ . 1 . 2]" 1
1243 1 85 ALA HA 1 98 VAL H 3.485 . 5.003 4.180 4.017 4.387 . 0 0 "[ . 1 . 2]" 1
1244 1 85 ALA HA 1 99 ASN HA 2.538 . 3.343 2.920 2.704 3.338 . 0 0 "[ . 1 . 2]" 1
1245 1 85 ALA HA 1 100 MET H 2.961 . 4.057 2.854 2.712 2.957 . 0 0 "[ . 1 . 2]" 1
1246 1 85 ALA HA 1 100 MET HB2 3.684 . 5.380 4.241 3.839 4.550 . 0 0 "[ . 1 . 2]" 1
1247 1 85 ALA HA 1 100 MET QG 2.859 . 3.880 2.867 2.378 3.920 0.040 5 0 "[ . 1 . 2]" 1
1248 1 85 ALA HA 1 101 GLU H 3.812 . 5.629 5.434 5.286 5.574 . 0 0 "[ . 1 . 2]" 1
1249 1 85 ALA HA 1 106 PHE QE 3.607 . 5.234 4.047 3.043 4.540 . 0 0 "[ . 1 . 2]" 1
1250 1 85 ALA MB 1 86 ARG H 2.471 . 3.234 2.758 2.451 2.952 . 0 0 "[ . 1 . 2]" 1
1251 1 85 ALA MB 1 86 ARG HA 3.179 . 4.442 4.271 4.173 4.330 . 0 0 "[ . 1 . 2]" 1
1252 1 85 ALA MB 1 86 ARG HB2 3.560 . 5.144 5.050 4.440 5.205 0.061 10 0 "[ . 1 . 2]" 1
1253 1 85 ALA MB 1 87 LEU H 3.537 . 5.101 4.367 4.144 4.777 . 0 0 "[ . 1 . 2]" 1
1254 1 85 ALA MB 1 87 LEU QD 2.043 . 2.565 2.407 2.142 2.579 0.014 14 0 "[ . 1 . 2]" 1
1255 1 85 ALA MB 1 97 ILE MG 1.803 . 2.209 2.307 2.240 2.412 0.203 9 0 "[ . 1 . 2]" 1
1256 1 85 ALA MB 1 100 MET H 3.031 . 4.180 4.330 4.205 4.397 0.217 18 0 "[ . 1 . 2]" 1
1257 1 85 ALA MB 1 106 PHE QD 2.805 . 3.788 3.170 2.821 3.472 . 0 0 "[ . 1 . 2]" 1
1258 1 85 ALA MB 1 106 PHE QE 2.601 . 3.446 3.410 2.930 3.686 0.240 16 0 "[ . 1 . 2]" 1
1259 1 85 ALA MB 1 109 PHE QD 3.132 . 4.358 3.009 2.532 3.580 . 0 0 "[ . 1 . 2]" 1
1260 1 85 ALA MB 1 109 PHE QE 2.420 . 3.152 2.649 1.789 2.990 . 0 0 "[ . 1 . 2]" 1
1261 1 85 ALA MB 1 109 PHE HZ 2.198 . 2.802 2.974 2.866 3.197 0.395 5 0 "[ . 1 . 2]" 1
1262 1 86 ARG H 1 86 ARG HA 2.755 . 3.704 2.935 2.908 2.962 . 0 0 "[ . 1 . 2]" 1
1263 1 86 ARG H 1 86 ARG HB2 2.914 . 3.975 2.854 2.329 3.061 . 0 0 "[ . 1 . 2]" 1
1264 1 86 ARG H 1 86 ARG HB3 3.157 . 4.403 2.348 2.194 3.156 . 0 0 "[ . 1 . 2]" 1
1265 1 86 ARG H 1 86 ARG QD 3.365 . 4.780 4.495 4.336 4.634 . 0 0 "[ . 1 . 2]" 1
1266 1 86 ARG H 1 86 ARG QG 3.519 . 5.067 3.912 3.801 4.016 . 0 0 "[ . 1 . 2]" 1
1267 1 86 ARG H 1 87 LEU H 3.757 . 5.522 4.134 4.009 4.377 . 0 0 "[ . 1 . 2]" 1
1268 1 86 ARG H 1 87 LEU QD 3.106 . 4.312 3.471 3.167 3.810 . 0 0 "[ . 1 . 2]" 1
1269 1 86 ARG H 1 97 ILE HA 3.622 . 5.262 4.257 3.849 4.519 . 0 0 "[ . 1 . 2]" 1
1270 1 86 ARG H 1 97 ILE HB 3.775 . 5.556 3.720 3.548 3.884 . 0 0 "[ . 1 . 2]" 1
1271 1 86 ARG H 1 97 ILE MG 3.520 . 5.068 2.852 2.399 3.116 . 0 0 "[ . 1 . 2]" 1
1272 1 86 ARG H 1 98 VAL H 2.924 . 3.992 2.426 2.082 2.592 . 0 0 "[ . 1 . 2]" 1
1273 1 86 ARG H 1 98 VAL HA 4.196 . 6.397 4.471 4.375 4.575 . 0 0 "[ . 1 . 2]" 1
1274 1 86 ARG H 1 99 ASN HA 3.667 . 5.348 3.784 3.525 4.202 . 0 0 "[ . 1 . 2]" 1
1275 1 86 ARG H 1 100 MET H 3.025 . 4.169 3.749 3.516 4.191 0.022 8 0 "[ . 1 . 2]" 1
1276 1 86 ARG H 1 100 MET HA 4.013 . 6.026 5.162 4.512 5.622 . 0 0 "[ . 1 . 2]" 1
1277 1 86 ARG H 1 100 MET QG 2.909 . 3.966 2.901 2.544 3.544 . 0 0 "[ . 1 . 2]" 1
1278 1 86 ARG H 1 106 PHE QD 3.809 . 5.623 4.049 3.562 4.370 . 0 0 "[ . 1 . 2]" 1
1279 1 86 ARG HA 1 86 ARG HB2 2.512 . 3.301 2.424 2.317 2.826 . 0 0 "[ . 1 . 2]" 1
1280 1 86 ARG HA 1 86 ARG HB3 2.726 . 3.655 2.998 2.830 3.024 . 0 0 "[ . 1 . 2]" 1
1281 1 86 ARG HA 1 86 ARG QD 2.417 . 3.147 2.328 2.041 2.561 . 0 0 "[ . 1 . 2]" 1
1282 1 86 ARG HA 1 86 ARG QG 3.056 . 4.223 2.989 2.321 3.104 . 0 0 "[ . 1 . 2]" 1
1283 1 86 ARG HA 1 87 LEU H 2.229 . 2.850 2.230 2.167 2.270 . 0 0 "[ . 1 . 2]" 1
1284 1 86 ARG HA 1 87 LEU QD 2.783 . 3.751 3.318 3.144 3.595 . 0 0 "[ . 1 . 2]" 1
1285 1 86 ARG HB2 1 86 ARG QD 2.034 . 2.551 2.520 2.225 3.261 0.710 8 1 "[ . + 1 . 2]" 1
1286 1 86 ARG HB2 1 86 ARG QG 2.260 . 2.899 2.368 2.159 2.415 . 0 0 "[ . 1 . 2]" 1
1287 1 86 ARG HB2 1 87 LEU H 3.235 . 4.543 4.465 4.302 4.612 0.069 8 0 "[ . 1 . 2]" 1
1288 1 86 ARG HB2 1 98 VAL H 3.637 . 5.291 3.853 2.573 4.196 . 0 0 "[ . 1 . 2]" 1
1289 1 86 ARG HB2 1 98 VAL MG1 3.119 . 4.335 3.547 2.781 3.935 . 0 0 "[ . 1 . 2]" 1
1290 1 86 ARG HB2 1 99 ASN HA 2.895 . 3.943 4.192 4.031 4.263 0.320 11 0 "[ . 1 . 2]" 1
1291 1 86 ARG HB3 1 86 ARG QD 2.548 . 3.360 3.328 2.276 3.473 0.113 14 0 "[ . 1 . 2]" 1
1292 1 86 ARG HB3 1 87 LEU H 3.553 . 5.131 4.427 3.983 4.509 . 0 0 "[ . 1 . 2]" 1
1293 1 86 ARG HB3 1 97 ILE HB 3.848 . 5.699 5.892 5.803 5.986 0.287 13 0 "[ . 1 . 2]" 1
1294 1 86 ARG HB3 1 97 ILE MG 2.886 . 3.927 3.888 3.673 4.137 0.210 8 0 "[ . 1 . 2]" 1
1295 1 86 ARG HB3 1 98 VAL HB 3.195 . 4.471 1.870 1.753 2.031 0.166 11 0 "[ . 1 . 2]" 1
1296 1 86 ARG HB3 1 98 VAL MG1 2.847 . 3.860 3.060 2.690 3.534 . 0 0 "[ . 1 . 2]" 1
1297 1 86 ARG HB3 1 100 MET QG 3.003 . 4.130 2.994 2.766 3.797 . 0 0 "[ . 1 . 2]" 1
1298 1 86 ARG QD 1 86 ARG QG 1.789 . 2.189 2.044 1.999 2.082 . 0 0 "[ . 1 . 2]" 1
1299 1 86 ARG QD 1 87 LEU H 3.441 . 4.921 3.311 2.940 3.570 . 0 0 "[ . 1 . 2]" 1
1300 1 86 ARG QD 1 87 LEU QD 3.277 . 4.619 4.534 4.426 4.649 0.030 20 0 "[ . 1 . 2]" 1
1301 1 86 ARG QD 1 88 THR H 3.983 . 5.966 4.508 3.938 4.749 . 0 0 "[ . 1 . 2]" 1
1302 1 86 ARG QD 1 88 THR MG 2.170 . 2.759 2.375 1.964 2.795 0.036 1 0 "[ . 1 . 2]" 1
1303 1 86 ARG QD 1 98 VAL H 3.963 . 5.926 4.941 4.440 5.183 . 0 0 "[ . 1 . 2]" 1
1304 1 86 ARG QG 1 87 LEU H 3.071 . 4.250 3.726 3.285 4.255 0.005 8 0 "[ . 1 . 2]" 1
1305 1 86 ARG QG 1 98 VAL H 3.212 . 4.501 3.494 3.140 4.224 . 0 0 "[ . 1 . 2]" 1
1306 1 86 ARG QG 1 98 VAL HB 3.148 . 4.386 2.401 2.090 2.767 . 0 0 "[ . 1 . 2]" 1
1307 1 86 ARG QG 1 98 VAL MG1 2.790 . 3.763 3.352 2.904 3.754 . 0 0 "[ . 1 . 2]" 1
1308 1 86 ARG QG 1 98 VAL MG2 2.531 . 3.332 3.257 2.968 3.567 0.235 8 0 "[ . 1 . 2]" 1
1309 1 87 LEU H 1 87 LEU HA 2.770 . 3.729 2.902 2.884 2.929 . 0 0 "[ . 1 . 2]" 1
1310 1 87 LEU H 1 87 LEU HB2 3.001 . 4.127 2.326 2.247 2.465 . 0 0 "[ . 1 . 2]" 1
1311 1 87 LEU H 1 87 LEU QD 2.769 . 3.728 2.182 1.985 2.535 . 0 0 "[ . 1 . 2]" 1
1312 1 87 LEU H 1 87 LEU HG 2.816 . 3.808 3.930 3.862 4.009 0.201 14 0 "[ . 1 . 2]" 1
1313 1 87 LEU H 1 88 THR H 3.521 . 5.070 4.183 4.104 4.292 . 0 0 "[ . 1 . 2]" 1
1314 1 87 LEU H 1 94 LEU QD 3.689 . 5.390 4.323 4.143 4.489 . 0 0 "[ . 1 . 2]" 1
1315 1 87 LEU H 1 98 VAL H 4.084 . 6.168 4.761 4.674 4.856 . 0 0 "[ . 1 . 2]" 1
1316 1 87 LEU HA 1 87 LEU HB2 2.409 . 3.134 3.007 2.984 3.027 . 0 0 "[ . 1 . 2]" 1
1317 1 87 LEU HA 1 87 LEU HB3 2.893 . 3.939 2.544 2.486 2.592 . 0 0 "[ . 1 . 2]" 1
1318 1 87 LEU HA 1 87 LEU QD 2.303 . 2.966 2.560 2.425 2.785 . 0 0 "[ . 1 . 2]" 1
1319 1 87 LEU HA 1 87 LEU HG 2.654 . 3.534 2.595 2.211 2.875 . 0 0 "[ . 1 . 2]" 1
1320 1 87 LEU HA 1 88 THR H 2.170 . 2.759 2.210 2.066 2.284 . 0 0 "[ . 1 . 2]" 1
1321 1 87 LEU HA 1 94 LEU QD 2.729 . 3.660 2.281 1.979 2.522 . 0 0 "[ . 1 . 2]" 1
1322 1 87 LEU HA 1 97 ILE HA 2.724 . 3.652 2.652 2.420 2.810 . 0 0 "[ . 1 . 2]" 1
1323 1 87 LEU HA 1 97 ILE HG12 3.582 . 5.185 3.375 2.118 5.097 . 0 0 "[ . 1 . 2]" 1
1324 1 87 LEU HA 1 98 VAL H 3.493 . 5.018 4.129 3.863 4.310 . 0 0 "[ . 1 . 2]" 1
1325 1 87 LEU HB2 1 87 LEU QD 2.274 . 2.920 2.089 2.040 2.135 . 0 0 "[ . 1 . 2]" 1
1326 1 87 LEU HB2 1 87 LEU HG 2.615 . 3.469 3.003 2.982 3.017 . 0 0 "[ . 1 . 2]" 1
1327 1 87 LEU HB2 1 89 PHE QE 2.588 . 3.425 2.995 2.503 3.458 0.033 14 0 "[ . 1 . 2]" 1
1328 1 87 LEU HB2 1 94 LEU QD 2.492 . 3.268 3.259 3.118 3.400 0.132 7 0 "[ . 1 . 2]" 1
1329 1 87 LEU HB3 1 87 LEU QD 2.546 . 3.356 2.299 2.127 2.442 . 0 0 "[ . 1 . 2]" 1
1330 1 87 LEU HB3 1 88 THR H 3.439 . 4.918 3.857 3.656 4.005 . 0 0 "[ . 1 . 2]" 1
1331 1 87 LEU HB3 1 94 LEU QD 2.551 . 3.364 1.871 1.730 1.999 0.008 10 0 "[ . 1 . 2]" 1
1332 1 87 LEU QD 1 87 LEU HG 2.116 . 2.676 1.887 1.876 1.893 . 0 0 "[ . 1 . 2]" 1
1333 1 87 LEU QD 1 88 THR H 3.134 . 4.361 4.236 4.167 4.293 . 0 0 "[ . 1 . 2]" 1
1334 1 87 LEU QD 1 109 PHE H 3.760 . 5.527 3.926 2.858 4.908 . 0 0 "[ . 1 . 2]" 1
1335 1 87 LEU QD 1 97 ILE MG 1.639 . 1.975 2.057 1.901 2.160 0.185 9 0 "[ . 1 . 2]" 1
1336 1 87 LEU HG 1 94 LEU QD 2.310 . 2.977 2.416 2.045 2.847 . 0 0 "[ . 1 . 2]" 1
1337 1 87 LEU HG 1 97 ILE HA 3.215 . 4.507 4.375 3.130 4.722 0.215 7 0 "[ . 1 . 2]" 1
1338 1 87 LEU HG 1 97 ILE MG 2.512 . 3.301 2.929 2.041 3.320 0.019 8 0 "[ . 1 . 2]" 1
1339 1 88 THR H 1 88 THR HB 2.493 . 3.270 3.328 3.265 3.372 0.102 1 0 "[ . 1 . 2]" 1
1340 1 88 THR H 1 88 THR MG 2.504 . 3.288 3.457 3.372 3.571 0.283 3 0 "[ . 1 . 2]" 1
1341 1 88 THR H 1 89 PHE H 2.982 . 4.093 4.275 4.194 4.340 0.247 16 0 "[ . 1 . 2]" 1
1342 1 88 THR H 1 89 PHE QE 3.988 . 5.976 5.036 4.548 5.590 . 0 0 "[ . 1 . 2]" 1
1343 1 88 THR H 1 94 LEU QD 2.656 . 3.059 2.930 2.350 3.084 0.025 5 0 "[ . 1 . 2]" 1
1344 1 88 THR H 1 94 LEU HG 3.467 . 4.970 3.326 3.068 5.020 0.050 2 0 "[ . 1 . 2]" 1
1345 1 88 THR H 1 95 ALA H 3.552 . 5.129 4.266 4.090 4.367 . 0 0 "[ . 1 . 2]" 1
1346 1 88 THR H 1 96 THR H 2.699 . 3.610 3.323 3.206 3.450 . 0 0 "[ . 1 . 2]" 1
1347 1 88 THR H 1 97 ILE H 3.692 . 5.396 4.821 4.638 5.075 . 0 0 "[ . 1 . 2]" 1
1348 1 88 THR H 1 97 ILE HA 3.412 . 4.867 2.980 2.770 3.363 . 0 0 "[ . 1 . 2]" 1
1349 1 88 THR H 1 97 ILE MG 3.503 . 5.037 4.287 4.082 4.640 . 0 0 "[ . 1 . 2]" 1
1350 1 88 THR H 1 98 VAL H 3.687 . 5.386 4.618 4.417 4.829 . 0 0 "[ . 1 . 2]" 1
1351 1 88 THR H 1 98 VAL MG2 3.385 . 4.817 4.780 4.440 4.976 0.159 5 0 "[ . 1 . 2]" 1
1352 1 88 THR HA 1 88 THR MG 2.161 . 2.745 2.073 2.038 2.107 . 0 0 "[ . 1 . 2]" 1
1353 1 88 THR HA 1 89 PHE H 2.169 . 2.757 1.938 1.914 1.963 . 0 0 "[ . 1 . 2]" 1
1354 1 88 THR HA 1 89 PHE HB2 3.114 . 4.326 4.302 4.224 4.437 0.111 14 0 "[ . 1 . 2]" 1
1355 1 88 THR HA 1 89 PHE QD 2.629 . 3.493 2.889 2.620 3.379 . 0 0 "[ . 1 . 2]" 1
1356 1 88 THR HA 1 91 GLY H 3.949 . 5.898 6.265 6.195 6.328 0.430 18 0 "[ . 1 . 2]" 1
1357 1 88 THR HB 1 88 THR MG 1.773 . 2.166 2.135 2.131 2.138 . 0 0 "[ . 1 . 2]" 1
1358 1 88 THR HB 1 89 PHE H 3.256 . 4.582 3.558 3.395 3.790 . 0 0 "[ . 1 . 2]" 1
1359 1 88 THR HB 1 94 LEU HG 3.570 . 5.163 4.993 4.716 7.574 2.411 2 1 "[ + . 1 . 2]" 1
1360 1 88 THR HB 1 95 ALA H 3.917 . 5.835 4.054 3.892 4.216 . 0 0 "[ . 1 . 2]" 1
1361 1 88 THR HB 1 96 THR H 2.685 . 3.586 3.537 3.228 3.668 0.082 10 0 "[ . 1 . 2]" 1
1362 1 88 THR MG 1 89 PHE H 2.465 . 3.224 3.046 2.878 3.235 0.011 20 0 "[ . 1 . 2]" 1
1363 1 89 PHE H 1 89 PHE HB2 2.647 . 3.523 2.409 2.320 2.532 . 0 0 "[ . 1 . 2]" 1
1364 1 89 PHE H 1 89 PHE HB3 2.697 . 3.606 3.596 3.553 3.626 0.020 10 0 "[ . 1 . 2]" 1
1365 1 89 PHE H 1 89 PHE QD 2.075 . 2.613 2.092 1.926 2.260 . 0 0 "[ . 1 . 2]" 1
1366 1 89 PHE H 1 89 PHE QE 3.377 . 4.802 4.342 4.165 4.540 . 0 0 "[ . 1 . 2]" 1
1367 1 89 PHE H 1 90 ASP H 3.609 . 5.238 4.443 4.391 4.505 . 0 0 "[ . 1 . 2]" 1
1368 1 89 PHE H 1 94 LEU QD 3.751 . 5.509 4.394 3.793 4.644 . 0 0 "[ . 1 . 2]" 1
1369 1 89 PHE H 1 95 ALA MB 3.717 . 5.444 4.996 4.666 5.173 . 0 0 "[ . 1 . 2]" 1
1370 1 89 PHE HA 1 89 PHE HB2 2.363 . 3.061 3.013 3.001 3.022 . 0 0 "[ . 1 . 2]" 1
1371 1 89 PHE HA 1 89 PHE HB3 2.564 . 3.386 2.493 2.416 2.536 . 0 0 "[ . 1 . 2]" 1
1372 1 89 PHE HA 1 89 PHE QD 2.338 . 3.021 2.833 2.579 3.157 0.136 8 0 "[ . 1 . 2]" 1
1373 1 89 PHE HA 1 90 ASP H 2.312 . 2.980 2.125 2.092 2.157 . 0 0 "[ . 1 . 2]" 1
1374 1 89 PHE HA 1 93 HIS H 3.041 . 4.197 3.966 3.799 4.118 . 0 0 "[ . 1 . 2]" 1
1375 1 89 PHE HA 1 94 LEU H 3.815 . 5.634 3.806 3.677 4.105 . 0 0 "[ . 1 . 2]" 1
1376 1 89 PHE HA 1 95 ALA H 3.000 . 4.125 2.596 2.445 2.698 . 0 0 "[ . 1 . 2]" 1
1377 1 89 PHE HA 1 96 THR H 3.081 . 4.268 4.339 4.255 4.402 0.134 4 0 "[ . 1 . 2]" 1
1378 1 89 PHE HB2 1 89 PHE QD 2.329 . 3.007 2.697 2.365 2.750 . 0 0 "[ . 1 . 2]" 1
1379 1 89 PHE HB2 1 89 PHE QE 3.188 . 4.458 4.467 4.382 4.487 0.029 5 0 "[ . 1 . 2]" 1
1380 1 89 PHE HB2 1 90 ASP H 3.015 . 4.151 4.188 4.141 4.216 0.065 6 0 "[ . 1 . 2]" 1
1381 1 89 PHE HB3 1 89 PHE QD 2.392 . 3.107 2.324 2.240 2.438 . 0 0 "[ . 1 . 2]" 1
1382 1 89 PHE HB3 1 89 PHE QE 3.084 . 4.273 4.372 4.335 4.413 0.140 4 0 "[ . 1 . 2]" 1
1383 1 89 PHE HB3 1 90 ASP H 2.925 . 3.995 3.258 3.166 3.432 . 0 0 "[ . 1 . 2]" 1
1384 1 89 PHE HB3 1 92 ASP H 3.663 . 5.340 4.443 4.203 4.992 . 0 0 "[ . 1 . 2]" 1
1385 1 89 PHE HB3 1 93 HIS H 3.850 . 5.703 3.274 2.968 3.687 . 0 0 "[ . 1 . 2]" 1
1386 1 89 PHE HB3 1 95 ALA H 4.017 . 6.034 5.040 4.890 5.139 . 0 0 "[ . 1 . 2]" 1
1387 1 89 PHE QD 1 90 ASP H 3.213 . 4.503 4.493 4.306 4.556 0.053 9 0 "[ . 1 . 2]" 1
1388 1 89 PHE QD 1 93 HIS H 3.669 . 5.352 4.119 3.513 4.714 . 0 0 "[ . 1 . 2]" 1
1389 1 89 PHE QD 1 94 LEU H 3.768 . 5.543 4.076 2.940 4.517 . 0 0 "[ . 1 . 2]" 1
1390 1 89 PHE QD 1 94 LEU HA 2.503 . 3.286 3.221 2.851 3.382 0.096 11 0 "[ . 1 . 2]" 1
1391 1 89 PHE QD 1 94 LEU QD 2.456 . 3.210 3.068 2.687 3.358 0.148 20 0 "[ . 1 . 2]" 1
1392 1 89 PHE QE 1 94 LEU HA 3.200 . 4.480 4.462 4.410 4.536 0.056 11 0 "[ . 1 . 2]" 1
1393 1 89 PHE QE 1 94 LEU QD 2.444 . 3.191 2.579 2.160 2.979 . 0 0 "[ . 1 . 2]" 1
1394 1 90 ASP H 1 90 ASP QB 3.040 . 4.195 2.266 2.247 2.303 . 0 0 "[ . 1 . 2]" 1
1395 1 90 ASP H 1 91 GLY H 2.735 . 3.670 3.566 3.503 3.635 . 0 0 "[ . 1 . 2]" 1
1396 1 90 ASP H 1 93 HIS H 3.103 . 4.307 3.380 3.278 3.566 . 0 0 "[ . 1 . 2]" 1
1397 1 90 ASP H 1 94 LEU H 3.993 . 5.986 4.368 4.283 4.496 . 0 0 "[ . 1 . 2]" 1
1398 1 90 ASP H 1 94 LEU HA 3.126 . 4.347 2.973 2.783 3.281 . 0 0 "[ . 1 . 2]" 1
1399 1 90 ASP H 1 95 ALA H 2.933 . 4.008 2.938 2.807 3.122 . 0 0 "[ . 1 . 2]" 1
1400 1 90 ASP H 1 95 ALA MB 2.848 . 3.862 2.537 2.401 2.709 . 0 0 "[ . 1 . 2]" 1
1401 1 90 ASP H 1 96 THR H 3.946 . 5.892 4.809 4.725 5.062 . 0 0 "[ . 1 . 2]" 1
1402 1 90 ASP HA 1 90 ASP QB 2.369 . 3.066 2.410 2.390 2.441 . 0 0 "[ . 1 . 2]" 1
1403 1 90 ASP HA 1 91 GLY H 1.950 . 2.425 2.443 2.415 2.476 0.051 8 0 "[ . 1 . 2]" 1
1404 1 90 ASP HA 1 91 GLY HA2 3.127 . 4.349 4.498 4.485 4.518 0.169 10 0 "[ . 1 . 2]" 1
1405 1 90 ASP HA 1 91 GLY HA3 3.329 . 4.714 4.285 4.255 4.313 . 0 0 "[ . 1 . 2]" 1
1406 1 90 ASP QB 1 91 GLY H 3.144 . 4.380 3.954 3.856 3.980 . 0 0 "[ . 1 . 2]" 1
1407 1 90 ASP QB 1 91 GLY HA3 3.694 . 5.400 4.593 4.228 4.677 . 0 0 "[ . 1 . 2]" 1
1408 1 90 ASP QB 1 93 HIS H 2.279 . 2.928 3.183 3.162 3.210 0.282 4 0 "[ . 1 . 2]" 1
1409 1 90 ASP QB 1 95 ALA H 3.767 . 5.541 4.078 3.872 4.767 . 0 0 "[ . 1 . 2]" 1
1410 1 90 ASP QB 1 95 ALA HA 4.599 . 7.243 3.837 3.544 4.424 . 0 0 "[ . 1 . 2]" 1
1411 1 90 ASP QB 1 95 ALA MB 2.347 . 3.035 1.928 1.760 3.023 . 0 0 "[ . 1 . 2]" 1
1412 1 91 GLY H 1 91 GLY HA2 2.107 . 2.662 2.320 2.304 2.334 . 0 0 "[ . 1 . 2]" 1
1413 1 91 GLY H 1 91 GLY HA3 2.222 . 2.839 2.886 2.861 2.903 0.064 9 0 "[ . 1 . 2]" 1
1414 1 91 GLY H 1 92 ASP HA 4.058 . 6.116 5.555 5.410 5.683 . 0 0 "[ . 1 . 2]" 1
1415 1 91 GLY H 1 93 HIS H 3.102 . 4.305 4.219 4.172 4.263 . 0 0 "[ . 1 . 2]" 1
1416 1 91 GLY H 1 95 ALA MB 3.747 . 5.502 5.034 4.812 5.211 . 0 0 "[ . 1 . 2]" 1
1417 1 91 GLY HA2 1 92 ASP H 2.807 . 3.792 3.428 3.419 3.444 . 0 0 "[ . 1 . 2]" 1
1418 1 91 GLY HA3 1 92 ASP H 2.741 . 3.680 2.179 2.161 2.201 . 0 0 "[ . 1 . 2]" 1
1419 1 91 GLY HA3 1 92 ASP HB2 3.529 . 5.085 4.440 4.411 4.498 . 0 0 "[ . 1 . 2]" 1
1420 1 91 GLY HA3 1 93 HIS H 2.820 . 3.814 3.916 3.869 3.971 0.157 10 0 "[ . 1 . 2]" 1
1421 1 92 ASP H 1 92 ASP HB2 1.769 . 2.160 2.304 2.278 2.341 0.181 18 0 "[ . 1 . 2]" 1
1422 1 92 ASP H 1 93 HIS H 2.339 . 3.023 2.534 2.464 2.610 . 0 0 "[ . 1 . 2]" 1
1423 1 92 ASP HA 1 92 ASP HB2 2.306 . 2.971 2.991 2.985 2.995 0.024 18 0 "[ . 1 . 2]" 1
1424 1 92 ASP HA 1 92 ASP HB3 2.252 . 2.886 2.532 2.499 2.565 . 0 0 "[ . 1 . 2]" 1
1425 1 92 ASP HA 1 93 HIS H 2.450 . 3.200 3.453 3.398 3.476 0.276 10 0 "[ . 1 . 2]" 1
1426 1 92 ASP HB2 1 93 HIS HB2 3.547 . 5.120 5.286 5.184 5.390 0.270 12 0 "[ . 1 . 2]" 1
1427 1 92 ASP HB3 1 93 HIS HB3 2.854 . 3.872 3.904 3.799 3.961 0.089 20 0 "[ . 1 . 2]" 1
1428 1 93 HIS H 1 93 HIS HA 2.575 . 3.404 2.902 2.893 2.909 . 0 0 "[ . 1 . 2]" 1
1429 1 93 HIS H 1 93 HIS HB2 2.764 . 3.719 3.802 3.746 3.845 0.126 17 0 "[ . 1 . 2]" 1
1430 1 93 HIS H 1 93 HIS HB3 2.641 . 3.513 3.320 3.206 3.445 . 0 0 "[ . 1 . 2]" 1
1431 1 93 HIS H 1 94 LEU H 2.848 . 3.862 4.144 4.092 4.173 0.311 11 0 "[ . 1 . 2]" 1
1432 1 93 HIS H 1 94 LEU HA 3.881 . 5.764 4.807 4.650 4.979 . 0 0 "[ . 1 . 2]" 1
1433 1 93 HIS H 1 95 ALA MB 3.432 . 4.905 5.221 5.124 5.368 0.463 10 0 "[ . 1 . 2]" 1
1434 1 93 HIS HA 1 93 HIS HB2 2.285 . 2.938 2.478 2.412 2.557 . 0 0 "[ . 1 . 2]" 1
1435 1 93 HIS HA 1 93 HIS HB3 2.314 . 2.983 2.363 2.307 2.411 . 0 0 "[ . 1 . 2]" 1
1436 1 93 HIS HA 1 94 LEU H 2.377 . 3.083 2.003 1.965 2.044 . 0 0 "[ . 1 . 2]" 1
1437 1 93 HIS HA 1 94 LEU HB2 3.495 . 5.022 4.311 4.201 4.446 . 0 0 "[ . 1 . 2]" 1
1438 1 93 HIS HA 1 94 LEU HB3 3.314 . 4.687 4.641 4.397 4.701 0.014 17 0 "[ . 1 . 2]" 1
1439 1 93 HIS HB2 1 94 LEU H 2.791 . 3.764 3.122 2.989 3.287 . 0 0 "[ . 1 . 2]" 1
1440 1 93 HIS HB3 1 94 LEU H 2.738 . 3.675 3.947 3.871 4.003 0.328 12 0 "[ . 1 . 2]" 1
1441 1 94 LEU H 1 94 LEU HB2 2.758 . 3.709 2.419 2.335 2.498 . 0 0 "[ . 1 . 2]" 1
1442 1 94 LEU H 1 94 LEU HB3 2.731 . 3.663 2.684 2.511 2.728 . 0 0 "[ . 1 . 2]" 1
1443 1 94 LEU H 1 94 LEU QD 3.047 . 4.208 3.717 3.628 3.768 . 0 0 "[ . 1 . 2]" 1
1444 1 94 LEU H 1 95 ALA H 3.560 . 5.144 4.496 4.456 4.529 . 0 0 "[ . 1 . 2]" 1
1445 1 94 LEU HA 1 94 LEU HB2 2.771 . 3.731 2.465 2.448 2.479 . 0 0 "[ . 1 . 2]" 1
1446 1 94 LEU HA 1 94 LEU HB3 2.544 . 3.353 2.980 2.965 3.002 . 0 0 "[ . 1 . 2]" 1
1447 1 94 LEU HA 1 94 LEU QD 2.757 . 2.867 2.869 2.104 2.952 0.085 11 0 "[ . 1 . 2]" 1
1448 1 94 LEU HA 1 94 LEU HG 2.879 . 3.915 2.331 2.219 3.810 . 0 0 "[ . 1 . 2]" 1
1449 1 94 LEU HA 1 95 ALA H 2.163 . 2.748 2.102 2.073 2.136 . 0 0 "[ . 1 . 2]" 1
1450 1 94 LEU HA 1 96 THR H 2.945 . 4.029 3.807 3.683 4.060 0.031 10 0 "[ . 1 . 2]" 1
1451 1 94 LEU HB2 1 94 LEU QD 1.919 . 2.379 2.068 1.994 2.290 . 0 0 "[ . 1 . 2]" 1
1452 1 94 LEU HB2 1 95 ALA H 3.265 . 4.597 4.147 4.035 4.317 . 0 0 "[ . 1 . 2]" 1
1453 1 94 LEU HB3 1 94 LEU QD 2.503 . 2.944 2.061 1.953 2.264 . 0 0 "[ . 1 . 2]" 1
1454 1 94 LEU HB3 1 94 LEU HG 2.491 . 3.267 2.885 2.448 2.929 . 0 0 "[ . 1 . 2]" 1
1455 1 94 LEU QD 1 94 LEU HG 1.953 . 2.430 1.873 1.859 1.881 . 0 0 "[ . 1 . 2]" 1
1456 1 94 LEU QD 1 95 ALA H 2.917 . 2.962 2.921 2.375 2.999 0.037 11 0 "[ . 1 . 2]" 1
1457 1 94 LEU QD 1 95 ALA MB 3.082 . 4.269 3.898 3.564 3.970 . 0 0 "[ . 1 . 2]" 1
1458 1 94 LEU QD 1 96 THR H 2.704 . 3.618 2.722 2.367 2.829 . 0 0 "[ . 1 . 2]" 1
1459 1 94 LEU QD 1 96 THR HB 3.339 . 4.733 4.633 4.336 4.729 . 0 0 "[ . 1 . 2]" 1
1460 1 94 LEU QD 1 97 ILE H 3.179 . 4.442 3.700 3.222 3.874 . 0 0 "[ . 1 . 2]" 1
1461 1 94 LEU QD 1 97 ILE MD 2.118 . 2.679 2.145 1.761 2.530 . 0 0 "[ . 1 . 2]" 1
1462 1 94 LEU HG 1 95 ALA H 3.407 . 4.858 2.492 2.084 4.876 0.018 2 0 "[ . 1 . 2]" 1
1463 1 95 ALA H 1 95 ALA HA 2.564 . 3.386 2.930 2.921 2.937 . 0 0 "[ . 1 . 2]" 1
1464 1 95 ALA H 1 95 ALA MB 2.089 . 2.634 2.352 2.291 2.386 . 0 0 "[ . 1 . 2]" 1
1465 1 95 ALA H 1 96 THR H 2.586 . 3.422 2.029 1.959 2.140 . 0 0 "[ . 1 . 2]" 1
1466 1 95 ALA H 1 96 THR MG 3.491 . 5.014 4.493 4.433 4.568 . 0 0 "[ . 1 . 2]" 1
1467 1 95 ALA HA 1 95 ALA MB 1.838 . 2.260 2.124 2.119 2.129 . 0 0 "[ . 1 . 2]" 1
1468 1 95 ALA MB 1 96 THR H 2.040 . 2.560 2.599 2.516 2.631 0.071 2 0 "[ . 1 . 2]" 1
1469 1 95 ALA MB 1 96 THR MG 2.019 . 2.529 2.697 2.639 2.750 0.221 17 0 "[ . 1 . 2]" 1
1470 1 96 THR H 1 96 THR HA 2.476 . 3.243 2.909 2.894 2.920 . 0 0 "[ . 1 . 2]" 1
1471 1 96 THR H 1 96 THR HB 2.732 . 3.665 3.809 3.784 3.833 0.168 12 0 "[ . 1 . 2]" 1
1472 1 96 THR H 1 96 THR MG 2.485 . 3.257 3.237 3.198 3.307 0.050 6 0 "[ . 1 . 2]" 1
1473 1 96 THR H 1 97 ILE H 3.273 . 4.612 4.376 4.322 4.412 . 0 0 "[ . 1 . 2]" 1
1474 1 96 THR HA 1 96 THR HB 1.948 . 2.422 2.516 2.500 2.537 0.115 8 0 "[ . 1 . 2]" 1
1475 1 96 THR HA 1 96 THR MG 2.046 . 2.569 2.291 2.262 2.322 . 0 0 "[ . 1 . 2]" 1
1476 1 96 THR HA 1 97 ILE H 2.008 . 2.512 2.348 2.294 2.418 . 0 0 "[ . 1 . 2]" 1
1477 1 96 THR HB 1 96 THR MG 1.815 . 2.227 2.138 2.133 2.144 . 0 0 "[ . 1 . 2]" 1
1478 1 96 THR HB 1 97 ILE H 2.111 . 2.668 2.512 2.350 2.677 0.009 8 0 "[ . 1 . 2]" 1
1479 1 96 THR HB 1 98 VAL H 3.517 . 5.063 5.117 5.043 5.170 0.107 17 0 "[ . 1 . 2]" 1
1480 1 96 THR HB 1 98 VAL MG2 2.146 . 2.722 2.803 2.652 2.958 0.236 2 0 "[ . 1 . 2]" 1
1481 1 96 THR HB 1 105 GLN HG2 2.906 . 3.962 3.546 2.841 4.081 0.119 12 0 "[ . 1 . 2]" 1
1482 1 96 THR MG 1 97 ILE H 2.651 . 3.529 3.546 3.462 3.598 0.069 15 0 "[ . 1 . 2]" 1
1483 1 96 THR MG 1 105 GLN HG2 3.058 . 4.227 3.630 2.813 4.193 . 0 0 "[ . 1 . 2]" 1
1484 1 97 ILE H 1 97 ILE HB 2.676 . 3.571 2.851 2.780 2.940 . 0 0 "[ . 1 . 2]" 1
1485 1 97 ILE H 1 97 ILE MD 2.830 . 3.831 3.687 3.168 3.986 0.155 15 0 "[ . 1 . 2]" 1
1486 1 97 ILE H 1 97 ILE HG12 3.310 . 4.680 3.429 2.182 4.542 . 0 0 "[ . 1 . 2]" 1
1487 1 97 ILE H 1 97 ILE HG13 2.870 . 3.899 3.143 2.516 3.815 . 0 0 "[ . 1 . 2]" 1
1488 1 97 ILE H 1 97 ILE MG 3.156 . 4.401 3.920 3.883 3.966 . 0 0 "[ . 1 . 2]" 1
1489 1 97 ILE H 1 98 VAL H 3.478 . 4.990 4.327 4.245 4.423 . 0 0 "[ . 1 . 2]" 1
1490 1 97 ILE H 1 98 VAL MG2 3.121 . 4.339 3.667 3.420 4.022 . 0 0 "[ . 1 . 2]" 1
1491 1 97 ILE H 1 106 PHE H 2.140 . 2.713 3.029 2.947 3.152 0.439 2 0 "[ . 1 . 2]" 1
1492 1 97 ILE H 1 106 PHE HB2 4.199 . 6.403 3.958 3.272 4.394 . 0 0 "[ . 1 . 2]" 1
1493 1 97 ILE HA 1 97 ILE HG12 2.506 . 3.291 2.957 2.651 3.316 0.025 8 0 "[ . 1 . 2]" 1
1494 1 97 ILE HA 1 97 ILE HG13 2.782 . 3.749 3.308 2.507 3.988 0.239 10 0 "[ . 1 . 2]" 1
1495 1 97 ILE HA 1 97 ILE MG 2.001 . 2.502 2.303 2.186 2.426 . 0 0 "[ . 1 . 2]" 1
1496 1 97 ILE HA 1 98 VAL H 2.505 . 3.290 2.297 2.241 2.360 . 0 0 "[ . 1 . 2]" 1
1497 1 97 ILE HA 1 98 VAL MG2 2.961 . 4.057 3.625 3.489 3.792 . 0 0 "[ . 1 . 2]" 1
1498 1 97 ILE HB 1 97 ILE MD 2.470 . 3.233 2.643 2.205 3.246 0.013 8 0 "[ . 1 . 2]" 1
1499 1 97 ILE HB 1 97 ILE HG13 2.501 . 3.283 2.491 2.328 2.823 . 0 0 "[ . 1 . 2]" 1
1500 1 97 ILE HB 1 97 ILE MG 2.151 . 2.729 2.123 2.112 2.132 . 0 0 "[ . 1 . 2]" 1
1501 1 97 ILE HB 1 98 VAL H 2.910 . 3.969 3.624 3.366 3.886 . 0 0 "[ . 1 . 2]" 1
1502 1 97 ILE HB 1 106 PHE H 2.757 . 3.707 3.024 2.441 3.575 . 0 0 "[ . 1 . 2]" 1
1503 1 97 ILE HB 1 106 PHE HB2 2.505 . 3.289 2.046 1.720 2.668 0.001 15 0 "[ . 1 . 2]" 1
1504 1 97 ILE HB 1 106 PHE HB3 2.666 . 3.554 2.053 1.799 2.500 . 0 0 "[ . 1 . 2]" 1
1505 1 97 ILE HB 1 106 PHE QD 2.841 . 3.850 3.623 3.160 4.004 0.154 13 0 "[ . 1 . 2]" 1
1506 1 97 ILE HB 1 108 PHE H 4.020 . 6.040 4.485 4.319 4.652 . 0 0 "[ . 1 . 2]" 1
1507 1 97 ILE MD 1 97 ILE HG13 2.177 . 2.769 2.106 2.097 2.118 . 0 0 "[ . 1 . 2]" 1
1508 1 97 ILE MD 1 97 ILE MG 2.079 . 2.619 2.104 1.903 2.728 0.109 5 0 "[ . 1 . 2]" 1
1509 1 97 ILE MD 1 106 PHE H 3.481 . 4.996 4.939 4.477 5.125 0.129 1 0 "[ . 1 . 2]" 1
1510 1 97 ILE MD 1 108 PHE H 3.529 . 5.086 4.362 3.781 5.252 0.166 14 0 "[ . 1 . 2]" 1
1511 1 97 ILE MD 1 108 PHE HA 2.924 . 3.993 3.557 2.366 4.226 0.233 6 0 "[ . 1 . 2]" 1
1512 1 97 ILE MD 1 109 PHE H 3.208 . 4.495 3.049 2.434 3.598 . 0 0 "[ . 1 . 2]" 1
1513 1 97 ILE MD 1 109 PHE QB 3.088 . 3.636 2.497 1.986 3.084 . 0 0 "[ . 1 . 2]" 1
1514 1 97 ILE MD 1 109 PHE QD 3.109 . 4.317 4.156 3.633 4.429 0.112 9 0 "[ . 1 . 2]" 1
1515 1 97 ILE HG12 1 97 ILE MG 2.554 . 3.369 2.604 2.115 3.217 . 0 0 "[ . 1 . 2]" 1
1516 1 97 ILE HG13 1 97 ILE MG 2.368 . 3.069 2.928 2.445 3.223 0.154 13 0 "[ . 1 . 2]" 1
1517 1 97 ILE MG 1 98 VAL H 2.723 . 3.650 2.178 2.088 2.289 . 0 0 "[ . 1 . 2]" 1
1518 1 97 ILE MG 1 98 VAL MG1 3.421 . 4.884 4.846 4.785 4.895 0.011 7 0 "[ . 1 . 2]" 1
1519 1 97 ILE MG 1 99 ASN H 3.885 . 5.772 4.627 4.497 4.783 . 0 0 "[ . 1 . 2]" 1
1520 1 97 ILE MG 1 106 PHE H 3.201 . 4.482 3.994 3.788 4.296 . 0 0 "[ . 1 . 2]" 1
1521 1 97 ILE MG 1 106 PHE HB2 2.058 . 2.588 2.532 2.167 2.710 0.122 8 0 "[ . 1 . 2]" 1
1522 1 97 ILE MG 1 106 PHE HB3 2.863 . 3.888 2.849 2.477 3.058 . 0 0 "[ . 1 . 2]" 1
1523 1 97 ILE MG 1 106 PHE QD 2.078 . 2.618 2.484 1.967 2.767 0.149 3 0 "[ . 1 . 2]" 1
1524 1 97 ILE MG 1 108 PHE H 3.478 . 4.990 4.976 4.804 5.148 0.158 19 0 "[ . 1 . 2]" 1
1525 1 97 ILE MG 1 109 PHE H 3.512 . 5.053 4.382 3.946 5.111 0.058 6 0 "[ . 1 . 2]" 1
1526 1 97 ILE MG 1 109 PHE QB 2.816 . 3.519 2.183 1.760 3.010 0.065 9 0 "[ . 1 . 2]" 1
1527 1 97 ILE MG 1 109 PHE QD 2.650 . 3.528 3.276 2.613 3.640 0.112 2 0 "[ . 1 . 2]" 1
1528 1 97 ILE MG 1 109 PHE QE 3.349 . 4.751 4.462 4.122 4.756 0.005 15 0 "[ . 1 . 2]" 1
1529 1 98 VAL H 1 98 VAL HA 2.596 . 3.438 2.909 2.896 2.930 . 0 0 "[ . 1 . 2]" 1
1530 1 98 VAL H 1 98 VAL HB 3.151 . 4.392 2.727 2.595 2.790 . 0 0 "[ . 1 . 2]" 1
1531 1 98 VAL H 1 98 VAL MG1 2.727 . 3.657 3.782 3.711 3.810 0.153 5 0 "[ . 1 . 2]" 1
1532 1 98 VAL H 1 98 VAL MG2 2.483 . 3.254 3.187 3.071 3.298 0.044 11 0 "[ . 1 . 2]" 1
1533 1 98 VAL H 1 99 ASN H 3.846 . 5.695 4.250 4.157 4.347 . 0 0 "[ . 1 . 2]" 1
1534 1 98 VAL H 1 106 PHE HB2 2.601 . 3.447 3.621 3.461 3.685 0.238 14 0 "[ . 1 . 2]" 1
1535 1 98 VAL H 1 106 PHE QD 3.173 . 4.431 3.821 3.066 4.235 . 0 0 "[ . 1 . 2]" 1
1536 1 98 VAL HA 1 98 VAL HB 2.654 . 3.535 3.016 2.991 3.026 . 0 0 "[ . 1 . 2]" 1
1537 1 98 VAL HA 1 98 VAL MG1 2.120 . 2.682 2.527 2.499 2.634 . 0 0 "[ . 1 . 2]" 1
1538 1 98 VAL HA 1 98 VAL MG2 2.002 . 2.503 2.298 2.228 2.336 . 0 0 "[ . 1 . 2]" 1
1539 1 98 VAL HA 1 99 ASN H 2.194 . 2.795 2.127 2.073 2.189 . 0 0 "[ . 1 . 2]" 1
1540 1 98 VAL HA 1 99 ASN QB 3.093 . 4.289 3.841 3.719 4.232 . 0 0 "[ . 1 . 2]" 1
1541 1 98 VAL HA 1 104 ARG H 3.595 . 5.211 4.300 4.118 4.477 . 0 0 "[ . 1 . 2]" 1
1542 1 98 VAL HA 1 106 PHE QD 3.083 . 4.271 3.767 2.895 4.363 0.092 8 0 "[ . 1 . 2]" 1
1543 1 98 VAL HB 1 98 VAL MG1 2.043 . 2.565 2.118 2.110 2.124 . 0 0 "[ . 1 . 2]" 1
1544 1 98 VAL HB 1 98 VAL MG2 1.991 . 2.486 2.128 2.116 2.138 . 0 0 "[ . 1 . 2]" 1
1545 1 98 VAL HB 1 99 ASN H 3.340 . 4.735 4.213 4.097 4.323 . 0 0 "[ . 1 . 2]" 1
1546 1 98 VAL MG1 1 99 ASN H 2.543 . 3.351 2.530 2.369 2.649 . 0 0 "[ . 1 . 2]" 1
1547 1 98 VAL MG1 1 99 ASN QB 3.619 . 5.256 3.690 3.559 3.812 . 0 0 "[ . 1 . 2]" 1
1548 1 98 VAL MG1 1 100 MET H 3.304 . 4.669 3.815 3.481 3.991 . 0 0 "[ . 1 . 2]" 1
1549 1 98 VAL MG1 1 100 MET HA 2.458 . 3.213 2.778 2.427 3.064 . 0 0 "[ . 1 . 2]" 1
1550 1 98 VAL MG1 1 101 GLU H 3.613 . 5.245 4.757 4.517 4.942 . 0 0 "[ . 1 . 2]" 1
1551 1 98 VAL MG1 1 102 ASN H 3.729 . 5.467 4.728 4.475 4.906 . 0 0 "[ . 1 . 2]" 1
1552 1 98 VAL MG1 1 103 ASN H 3.319 . 4.696 3.487 3.326 3.649 . 0 0 "[ . 1 . 2]" 1
1553 1 98 VAL MG1 1 103 ASN HA 2.050 . 2.575 2.043 1.984 2.120 . 0 0 "[ . 1 . 2]" 1
1554 1 98 VAL MG1 1 103 ASN HB2 2.750 . 3.695 3.788 3.727 3.874 0.179 8 0 "[ . 1 . 2]" 1
1555 1 98 VAL MG1 1 103 ASN HB3 2.914 . 3.975 4.015 3.914 4.080 0.105 15 0 "[ . 1 . 2]" 1
1556 1 98 VAL MG1 1 104 ARG H 3.156 . 4.401 3.020 2.631 3.302 . 0 0 "[ . 1 . 2]" 1
1557 1 98 VAL MG1 1 106 PHE H 3.318 . 4.694 4.806 4.716 4.887 0.193 3 0 "[ . 1 . 2]" 1
1558 1 98 VAL MG2 1 99 ASN H 2.749 . 3.694 3.722 3.598 3.787 0.093 12 0 "[ . 1 . 2]" 1
1559 1 98 VAL MG2 1 105 GLN HG2 2.155 . 2.735 2.363 2.081 2.608 . 0 0 "[ . 1 . 2]" 1
1560 1 98 VAL MG2 1 105 GLN HG3 2.348 . 3.037 3.146 3.067 3.227 0.190 5 0 "[ . 1 . 2]" 1
1561 1 98 VAL MG2 1 106 PHE H 2.984 . 4.097 3.460 3.302 3.691 . 0 0 "[ . 1 . 2]" 1
1562 1 98 VAL MG2 1 106 PHE HB2 4.263 . 6.535 4.451 4.215 4.670 . 0 0 "[ . 1 . 2]" 1
1563 1 99 ASN H 1 99 ASN QB 2.610 . 3.457 2.221 2.131 2.451 . 0 0 "[ . 1 . 2]" 1
1564 1 99 ASN H 1 100 MET H 3.606 . 5.232 4.261 4.154 4.350 . 0 0 "[ . 1 . 2]" 1
1565 1 99 ASN H 1 101 GLU H 3.977 . 5.955 5.071 5.006 5.166 . 0 0 "[ . 1 . 2]" 1
1566 1 99 ASN H 1 102 ASN H 3.299 . 4.659 4.919 4.879 4.953 0.294 9 0 "[ . 1 . 2]" 1
1567 1 99 ASN H 1 103 ASN HA 3.630 . 5.277 3.891 3.632 4.295 . 0 0 "[ . 1 . 2]" 1
1568 1 99 ASN H 1 104 ARG H 2.874 . 3.907 3.034 2.894 3.152 . 0 0 "[ . 1 . 2]" 1
1569 1 99 ASN H 1 104 ARG QB 3.332 . 4.720 4.254 3.085 4.428 . 0 0 "[ . 1 . 2]" 1
1570 1 99 ASN H 1 106 PHE H 3.301 . 4.663 4.312 4.048 4.688 0.025 6 0 "[ . 1 . 2]" 1
1571 1 99 ASN H 1 106 PHE QD 3.040 . 4.195 3.572 3.139 3.928 . 0 0 "[ . 1 . 2]" 1
1572 1 99 ASN HA 1 99 ASN QB 2.315 . 2.985 2.441 2.337 2.490 . 0 0 "[ . 1 . 2]" 1
1573 1 99 ASN HA 1 100 MET H 2.163 . 2.748 2.159 2.115 2.247 . 0 0 "[ . 1 . 2]" 1
1574 1 99 ASN HA 1 100 MET HA 3.308 . 4.676 4.295 4.244 4.366 . 0 0 "[ . 1 . 2]" 1
1575 1 99 ASN HA 1 100 MET HB2 3.348 . 4.749 4.542 4.345 4.649 . 0 0 "[ . 1 . 2]" 1
1576 1 99 ASN HA 1 100 MET QG 3.263 . 4.594 3.784 3.488 4.454 . 0 0 "[ . 1 . 2]" 1
1577 1 99 ASN HA 1 101 GLU H 3.175 . 4.435 3.600 3.407 3.687 . 0 0 "[ . 1 . 2]" 1
1578 1 99 ASN HA 1 106 PHE QE 2.507 . 3.293 2.836 2.055 3.316 0.023 3 0 "[ . 1 . 2]" 1
1579 1 99 ASN QB 1 100 MET H 3.500 . 5.031 3.821 3.509 3.926 . 0 0 "[ . 1 . 2]" 1
1580 1 99 ASN QB 1 100 MET HA 3.275 . 4.616 4.606 4.416 4.694 0.078 10 0 "[ . 1 . 2]" 1
1581 1 99 ASN QB 1 101 GLU H 3.751 . 5.509 3.379 2.829 3.693 . 0 0 "[ . 1 . 2]" 1
1582 1 99 ASN QB 1 102 ASN H 3.223 . 4.522 2.854 2.723 3.053 . 0 0 "[ . 1 . 2]" 1
1583 1 99 ASN QB 1 103 ASN H 3.453 . 4.298 2.916 2.755 3.199 . 0 0 "[ . 1 . 2]" 1
1584 1 99 ASN QB 1 104 ARG H 2.663 . 3.549 2.469 2.156 2.666 . 0 0 "[ . 1 . 2]" 1
1585 1 99 ASN QB 1 104 ARG QB 3.043 . 4.200 3.533 2.372 3.718 . 0 0 "[ . 1 . 2]" 1
1586 1 99 ASN QB 1 104 ARG QD 2.190 . 2.790 2.568 2.364 2.853 0.063 14 0 "[ . 1 . 2]" 1
1587 1 99 ASN QB 1 106 PHE QD 3.495 . 5.021 3.370 2.842 4.219 . 0 0 "[ . 1 . 2]" 1
1588 1 99 ASN QB 1 106 PHE QE 3.471 . 4.706 2.995 2.338 4.201 . 0 0 "[ . 1 . 2]" 1
1589 1 100 MET H 1 100 MET HA 2.490 . 3.265 2.808 2.794 2.829 . 0 0 "[ . 1 . 2]" 1
1590 1 100 MET H 1 100 MET HB2 2.917 . 3.981 2.400 2.146 2.529 . 0 0 "[ . 1 . 2]" 1
1591 1 100 MET H 1 100 MET ME 3.051 . 4.215 3.792 3.107 4.233 0.018 9 0 "[ . 1 . 2]" 1
1592 1 100 MET H 1 100 MET QG 2.502 . 3.284 2.275 1.989 2.816 . 0 0 "[ . 1 . 2]" 1
1593 1 100 MET H 1 101 GLU H 2.767 . 3.724 2.751 2.653 2.818 . 0 0 "[ . 1 . 2]" 1
1594 1 100 MET H 1 101 GLU HA 3.601 . 5.222 5.200 5.128 5.261 0.039 13 0 "[ . 1 . 2]" 1
1595 1 100 MET H 1 102 ASN H 3.399 . 4.843 4.548 4.405 4.640 . 0 0 "[ . 1 . 2]" 1
1596 1 100 MET H 1 103 ASN H 3.748 . 5.504 4.566 4.470 4.635 . 0 0 "[ . 1 . 2]" 1
1597 1 100 MET H 1 104 ARG H 4.577 . 7.196 5.549 5.341 5.687 . 0 0 "[ . 1 . 2]" 1
1598 1 100 MET H 1 106 PHE QE 3.442 . 4.923 4.657 3.998 5.019 0.096 14 0 "[ . 1 . 2]" 1
1599 1 100 MET HA 1 100 MET HB2 2.310 . 2.977 2.979 2.923 2.996 0.019 6 0 "[ . 1 . 2]" 1
1600 1 100 MET HA 1 100 MET QG 1.900 . 2.351 2.306 2.171 2.364 0.013 15 0 "[ . 1 . 2]" 1
1601 1 100 MET HA 1 101 GLU H 2.798 . 3.777 3.280 3.238 3.319 . 0 0 "[ . 1 . 2]" 1
1602 1 100 MET HA 1 102 ASN H 3.116 . 4.330 4.165 3.955 4.374 0.044 10 0 "[ . 1 . 2]" 1
1603 1 100 MET HA 1 103 ASN H 2.891 . 3.936 3.413 3.081 3.730 . 0 0 "[ . 1 . 2]" 1
1604 1 100 MET QB 1 102 ASN H 3.098 . 4.298 4.385 4.272 4.479 0.181 20 0 "[ . 1 . 2]" 1
1605 1 100 MET HB2 1 100 MET QG 2.177 . 2.769 2.236 2.148 2.484 . 0 0 "[ . 1 . 2]" 1
1606 1 100 MET HB2 1 101 GLU H 3.267 . 4.601 3.508 3.328 3.679 . 0 0 "[ . 1 . 2]" 1
1607 1 100 MET HB3 1 103 ASN H 3.021 . 4.162 4.129 4.014 4.238 0.076 20 0 "[ . 1 . 2]" 1
1608 1 101 GLU H 1 101 GLU HA 2.295 . 2.953 2.854 2.824 2.885 . 0 0 "[ . 1 . 2]" 1
1609 1 101 GLU H 1 101 GLU HB2 2.474 . 3.239 3.511 3.466 3.541 0.302 9 0 "[ . 1 . 2]" 1
1610 1 101 GLU H 1 101 GLU HB3 2.467 . 3.228 2.450 2.372 2.723 . 0 0 "[ . 1 . 2]" 1
1611 1 101 GLU H 1 101 GLU HG2 2.599 . 3.443 2.173 1.873 2.395 . 0 0 "[ . 1 . 2]" 1
1612 1 101 GLU H 1 101 GLU HG3 3.241 . 4.554 3.271 3.178 3.393 . 0 0 "[ . 1 . 2]" 1
1613 1 101 GLU H 1 102 ASN H 2.398 . 3.117 2.299 2.110 2.417 . 0 0 "[ . 1 . 2]" 1
1614 1 101 GLU H 1 103 ASN H 2.901 . 3.953 3.201 3.076 3.268 . 0 0 "[ . 1 . 2]" 1
1615 1 101 GLU H 1 104 ARG H 3.601 . 5.222 4.837 4.724 4.949 . 0 0 "[ . 1 . 2]" 1
1616 1 101 GLU H 1 104 ARG H 2.835 . 3.839 4.112 4.063 4.145 0.306 20 0 "[ . 1 . 2]" 1
1617 1 101 GLU H 1 106 PHE QE 4.075 . 6.150 5.638 5.344 6.082 . 0 0 "[ . 1 . 2]" 1
1618 1 101 GLU HA 1 101 GLU HB2 2.263 . 2.903 2.364 2.322 2.427 . 0 0 "[ . 1 . 2]" 1
1619 1 101 GLU HA 1 101 GLU HB3 2.399 . 3.119 2.482 2.402 2.532 . 0 0 "[ . 1 . 2]" 1
1620 1 101 GLU HA 1 101 GLU HG3 3.119 . 4.335 3.685 3.606 3.857 . 0 0 "[ . 1 . 2]" 1
1621 1 101 GLU HA 1 102 ASN H 2.473 . 3.238 3.451 3.429 3.473 0.235 16 0 "[ . 1 . 2]" 1
1622 1 101 GLU HA 1 102 ASN QB 3.429 . 4.899 4.195 4.128 4.250 . 0 0 "[ . 1 . 2]" 1
1623 1 101 GLU HB2 1 101 GLU HG2 2.141 . 2.714 2.953 2.940 2.992 0.278 19 0 "[ . 1 . 2]" 1
1624 1 101 GLU HB2 1 102 ASN H 2.637 . 3.506 3.684 3.571 3.762 0.256 9 0 "[ . 1 . 2]" 1
1625 1 101 GLU HB2 1 103 ASN H 3.846 . 5.695 5.331 5.170 5.419 . 0 0 "[ . 1 . 2]" 1
1626 1 101 GLU HB3 1 101 GLU HG2 2.083 . 2.625 2.382 2.313 2.588 . 0 0 "[ . 1 . 2]" 1
1627 1 101 GLU HB3 1 102 ASN H 2.696 . 3.604 3.644 3.577 3.791 0.187 10 0 "[ . 1 . 2]" 1
1628 1 101 GLU HB3 1 103 ASN H 3.400 . 4.845 5.157 5.108 5.367 0.522 10 1 "[ . + . 2]" 1
1629 1 101 GLU HG2 1 102 ASN H 2.859 . 3.881 2.267 2.081 2.425 . 0 0 "[ . 1 . 2]" 1
1630 1 101 GLU HG2 1 102 ASN QB 2.551 . 3.365 3.357 3.090 3.413 0.048 11 0 "[ . 1 . 2]" 1
1631 1 101 GLU HG3 1 102 ASN H 3.126 . 4.347 2.205 2.073 2.566 . 0 0 "[ . 1 . 2]" 1
1632 1 101 GLU HG3 1 102 ASN QB 2.564 . 3.385 2.804 2.215 3.284 . 0 0 "[ . 1 . 2]" 1
1633 1 101 GLU HG3 1 103 ASN H 2.771 . 3.731 3.929 3.788 4.377 0.646 9 3 "[- . +* . 2]" 1
1634 1 102 ASN H 1 102 ASN HA 2.348 . 3.037 2.952 2.946 2.964 . 0 0 "[ . 1 . 2]" 1
1635 1 102 ASN H 1 102 ASN QB 2.917 . 3.862 2.294 2.246 2.352 . 0 0 "[ . 1 . 2]" 1
1636 1 102 ASN H 1 103 ASN H 2.181 . 2.776 1.771 1.688 1.859 . 0 0 "[ . 1 . 2]" 1
1637 1 102 ASN H 1 103 ASN HB2 3.392 . 4.830 4.668 4.521 4.828 . 0 0 "[ . 1 . 2]" 1
1638 1 102 ASN H 1 104 ARG H 2.674 . 3.568 3.370 3.168 3.542 . 0 0 "[ . 1 . 2]" 1
1639 1 102 ASN H 1 104 ARG QD 2.932 . 4.007 3.953 3.704 4.064 0.057 9 0 "[ . 1 . 2]" 1
1640 1 102 ASN H 1 104 ARG QG 3.445 . 4.928 4.256 3.394 4.782 . 0 0 "[ . 1 . 2]" 1
1641 1 102 ASN HA 1 102 ASN QB 1.969 . 2.454 2.431 2.384 2.450 . 0 0 "[ . 1 . 2]" 1
1642 1 102 ASN HA 1 103 ASN H 2.528 . 3.327 3.352 3.316 3.369 0.042 20 0 "[ . 1 . 2]" 1
1643 1 102 ASN HA 1 103 ASN HB2 3.595 . 5.210 4.601 4.427 4.768 . 0 0 "[ . 1 . 2]" 1
1644 1 102 ASN HA 1 104 ARG H 3.215 . 4.507 4.517 4.357 4.585 0.078 17 0 "[ . 1 . 2]" 1
1645 1 102 ASN QB 1 103 ASN H 2.077 . 2.616 2.685 2.629 2.706 0.090 2 0 "[ . 1 . 2]" 1
1646 1 102 ASN QB 1 104 ARG H 4.002 . 6.004 2.578 2.238 2.713 . 0 0 "[ . 1 . 2]" 1
1647 1 102 ASN QB 1 104 ARG QB 2.801 . 3.782 2.545 2.334 3.011 . 0 0 "[ . 1 . 2]" 1
1648 1 102 ASN QB 1 104 ARG QD 2.302 . 2.965 2.012 1.870 2.313 . 0 0 "[ . 1 . 2]" 1
1649 1 102 ASN QB 1 104 ARG QG 3.547 . 5.119 2.926 2.178 3.148 . 0 0 "[ . 1 . 2]" 1
1650 1 103 ASN H 1 103 ASN HA 1.986 . 2.479 2.259 2.241 2.275 . 0 0 "[ . 1 . 2]" 1
1651 1 103 ASN H 1 103 ASN HB2 2.613 . 3.467 3.283 3.193 3.339 . 0 0 "[ . 1 . 2]" 1
1652 1 103 ASN H 1 103 ASN HB3 2.635 . 3.503 3.685 3.652 3.730 0.227 8 0 "[ . 1 . 2]" 1
1653 1 103 ASN H 1 104 ARG H 2.421 . 3.153 2.216 2.144 2.309 . 0 0 "[ . 1 . 2]" 1
1654 1 103 ASN H 1 104 ARG HA 3.353 . 4.758 4.893 4.830 4.959 0.201 10 0 "[ . 1 . 2]" 1
1655 1 103 ASN H 1 104 ARG QG 3.490 . 5.013 3.878 2.925 4.231 . 0 0 "[ . 1 . 2]" 1
1656 1 103 ASN HA 1 103 ASN HB2 2.108 . 2.664 2.486 2.456 2.536 . 0 0 "[ . 1 . 2]" 1
1657 1 103 ASN HA 1 103 ASN HB3 2.206 . 2.814 2.989 2.979 2.998 0.184 19 0 "[ . 1 . 2]" 1
1658 1 103 ASN HA 1 104 ARG H 2.471 . 3.234 2.792 2.730 2.875 . 0 0 "[ . 1 . 2]" 1
1659 1 103 ASN HB3 1 104 ARG H 2.984 . 4.097 4.084 4.009 4.157 0.060 2 0 "[ . 1 . 2]" 1
1660 1 104 ARG H 1 104 ARG HA 2.436 . 3.178 2.888 2.836 2.918 . 0 0 "[ . 1 . 2]" 1
1661 1 104 ARG H 1 104 ARG QB 2.113 . 2.671 2.526 2.293 2.632 . 0 0 "[ . 1 . 2]" 1
1662 1 104 ARG H 1 104 ARG QD 2.537 . 3.341 3.232 3.035 3.481 0.140 20 0 "[ . 1 . 2]" 1
1663 1 104 ARG H 1 104 ARG QG 2.276 . 2.923 2.240 1.556 2.646 0.073 20 0 "[ . 1 . 2]" 1
1664 1 104 ARG H 1 105 GLN H 3.346 . 4.745 4.451 4.429 4.483 . 0 0 "[ . 1 . 2]" 1
1665 1 104 ARG HA 1 104 ARG QB 2.255 . 2.890 2.177 2.155 2.404 . 0 0 "[ . 1 . 2]" 1
1666 1 104 ARG HA 1 105 GLN H 1.856 . 2.287 2.301 2.227 2.443 0.156 2 0 "[ . 1 . 2]" 1
1667 1 104 ARG HA 1 105 GLN HG3 3.353 . 4.758 3.665 3.491 3.918 . 0 0 "[ . 1 . 2]" 1
1668 1 104 ARG QB 1 104 ARG QD 2.360 . 3.056 2.309 2.104 2.606 . 0 0 "[ . 1 . 2]" 1
1669 1 104 ARG QB 1 105 GLN H 2.568 . 3.392 2.433 2.336 2.563 . 0 0 "[ . 1 . 2]" 1
1670 1 104 ARG QD 1 104 ARG QG . . 2.024 1.973 1.889 2.043 0.019 9 0 "[ . 1 . 2]" 1
1671 1 104 ARG QG 1 105 GLN H 2.949 . 4.036 3.243 2.854 3.826 . 0 0 "[ . 1 . 2]" 1
1672 1 105 GLN H 1 105 GLN HA 2.808 . 3.794 2.893 2.866 2.926 . 0 0 "[ . 1 . 2]" 1
1673 1 105 GLN H 1 105 GLN HB2 2.472 . 3.236 2.418 2.324 2.500 . 0 0 "[ . 1 . 2]" 1
1674 1 105 GLN H 1 105 GLN HB3 2.856 . 3.876 3.622 3.575 3.667 . 0 0 "[ . 1 . 2]" 1
1675 1 105 GLN H 1 105 GLN HG2 2.673 . 3.566 3.726 3.612 3.880 0.314 19 0 "[ . 1 . 2]" 1
1676 1 105 GLN H 1 105 GLN HG3 2.416 . 3.145 2.600 2.412 2.828 . 0 0 "[ . 1 . 2]" 1
1677 1 105 GLN H 1 106 PHE H 3.556 . 5.137 4.539 4.443 4.614 . 0 0 "[ . 1 . 2]" 1
1678 1 105 GLN HA 1 105 GLN HB2 2.681 . 3.580 3.011 2.989 3.026 . 0 0 "[ . 1 . 2]" 1
1679 1 105 GLN HA 1 105 GLN HB3 2.396 . 3.114 2.511 2.462 2.567 . 0 0 "[ . 1 . 2]" 1
1680 1 105 GLN HA 1 105 GLN HG2 2.386 . 3.098 2.439 2.280 2.592 . 0 0 "[ . 1 . 2]" 1
1681 1 105 GLN HA 1 105 GLN HG3 2.461 . 3.218 2.967 2.775 3.136 . 0 0 "[ . 1 . 2]" 1
1682 1 105 GLN HA 1 106 PHE H 2.339 . 3.023 2.169 2.054 2.270 . 0 0 "[ . 1 . 2]" 1
1683 1 105 GLN HB2 1 105 GLN HG2 2.742 . 3.682 3.001 2.994 3.007 . 0 0 "[ . 1 . 2]" 1
1684 1 105 GLN HB2 1 105 GLN HG3 2.472 . 3.236 2.438 2.394 2.484 . 0 0 "[ . 1 . 2]" 1
1685 1 105 GLN HB2 1 106 PHE H 3.048 . 4.209 4.093 3.859 4.250 0.041 14 0 "[ . 1 . 2]" 1
1686 1 105 GLN HB3 1 105 GLN HG3 2.484 . 3.255 3.006 3.000 3.009 . 0 0 "[ . 1 . 2]" 1
1687 1 105 GLN HB3 1 106 PHE H 3.000 . 4.125 3.024 2.607 3.393 . 0 0 "[ . 1 . 2]" 1
1688 1 105 GLN HG2 1 106 PHE H 3.199 . 4.479 4.035 3.528 4.463 . 0 0 "[ . 1 . 2]" 1
1689 1 106 PHE H 1 106 PHE HB2 2.779 . 3.744 2.272 2.121 2.561 . 0 0 "[ . 1 . 2]" 1
1690 1 106 PHE H 1 106 PHE HB3 2.821 . 3.815 3.272 2.936 3.528 . 0 0 "[ . 1 . 2]" 1
1691 1 106 PHE H 1 108 PHE H 3.452 . 4.942 5.156 5.019 5.565 0.623 6 1 "[ .+ 1 . 2]" 1
1692 1 106 PHE HA 1 106 PHE HB2 2.442 . 3.187 2.908 2.793 2.975 . 0 0 "[ . 1 . 2]" 1
1693 1 106 PHE HA 1 106 PHE HB3 2.381 . 3.090 2.803 2.676 2.937 . 0 0 "[ . 1 . 2]" 1
1694 1 106 PHE HA 1 106 PHE QD 2.158 . 2.740 2.081 1.809 2.485 . 0 0 "[ . 1 . 2]" 1
1695 1 106 PHE HA 1 106 PHE QE 3.105 . 4.310 4.154 4.044 4.325 0.015 11 0 "[ . 1 . 2]" 1
1696 1 106 PHE HA 1 107 GLY HA3 2.841 . 3.850 3.926 3.866 4.196 0.346 6 0 "[ . 1 . 2]" 1
1697 1 106 PHE HA 1 108 PHE H 2.892 . 3.937 3.443 2.913 3.806 . 0 0 "[ . 1 . 2]" 1
1698 1 106 PHE HB2 1 106 PHE QD 2.321 . 2.995 2.314 2.246 2.413 . 0 0 "[ . 1 . 2]" 1
1699 1 106 PHE HB2 1 108 PHE H 3.222 . 4.520 3.998 3.650 4.189 . 0 0 "[ . 1 . 2]" 1
1700 1 106 PHE HB3 1 106 PHE QD 2.201 . 2.807 2.715 2.595 2.763 . 0 0 "[ . 1 . 2]" 1
1701 1 106 PHE HB3 1 108 PHE H 2.667 . 3.556 2.924 2.691 3.420 . 0 0 "[ . 1 . 2]" 1
1702 1 107 GLY HA2 1 108 PHE H 2.800 . 3.780 3.420 3.109 3.495 . 0 0 "[ . 1 . 2]" 1
1703 1 107 GLY HA3 1 108 PHE H 2.722 . 3.648 2.728 2.448 3.296 . 0 0 "[ . 1 . 2]" 1
1704 1 107 GLY HA3 1 108 PHE HA 3.144 . 4.379 4.559 4.448 4.593 0.214 12 0 "[ . 1 . 2]" 1
1705 1 108 PHE H 1 108 PHE HA 2.618 . 3.475 2.836 2.794 2.923 . 0 0 "[ . 1 . 2]" 1
1706 1 108 PHE H 1 108 PHE QB 2.602 . 3.448 3.238 2.790 3.408 . 0 0 "[ . 1 . 2]" 1
1707 1 108 PHE H 1 109 PHE H 3.294 . 4.651 4.077 3.631 4.355 . 0 0 "[ . 1 . 2]" 1
1708 1 108 PHE H 1 109 PHE HA 4.046 . 6.092 4.599 4.409 4.915 . 0 0 "[ . 1 . 2]" 1
1709 1 108 PHE HA 1 108 PHE QB 2.014 . 2.521 2.211 2.149 2.390 . 0 0 "[ . 1 . 2]" 1
1710 1 108 PHE HA 1 108 PHE QD 2.723 . 3.650 3.574 2.651 3.732 0.082 10 0 "[ . 1 . 2]" 1
1711 1 108 PHE HA 1 109 PHE H 2.430 . 3.168 2.421 2.172 2.567 . 0 0 "[ . 1 . 2]" 1
1712 1 108 PHE QB 1 108 PHE QD 1.822 . 2.237 2.121 2.107 2.137 . 0 0 "[ . 1 . 2]" 1
1713 1 108 PHE QB 1 109 PHE H 2.649 . 3.526 2.961 2.444 3.705 0.179 20 0 "[ . 1 . 2]" 1
1714 1 108 PHE QD 1 109 PHE H 3.224 . 4.523 3.974 3.277 4.749 0.226 19 0 "[ . 1 . 2]" 1
1715 1 109 PHE H 1 109 PHE HA 2.861 . 3.884 2.947 2.925 2.980 . 0 0 "[ . 1 . 2]" 1
1716 1 109 PHE H 1 109 PHE QB 3.108 . 4.316 2.637 2.463 2.765 . 0 0 "[ . 1 . 2]" 1
1717 1 109 PHE H 1 109 PHE QD 3.298 . 4.658 4.337 4.259 4.440 . 0 0 "[ . 1 . 2]" 1
1718 1 109 PHE H 1 110 ARG H 3.717 . 5.444 4.158 3.780 4.430 . 0 0 "[ . 1 . 2]" 1
1719 1 109 PHE HA 1 109 PHE QB 2.575 . 3.404 2.470 2.400 2.503 . 0 0 "[ . 1 . 2]" 1
1720 1 109 PHE HA 1 109 PHE QD 2.394 . 3.111 2.336 1.833 3.002 . 0 0 "[ . 1 . 2]" 1
1721 1 109 PHE HA 1 109 PHE QE 2.948 . 4.034 4.230 4.126 4.439 0.405 6 0 "[ . 1 . 2]" 1
1722 1 109 PHE HA 1 110 ARG H 2.177 . 2.769 2.248 2.138 2.428 . 0 0 "[ . 1 . 2]" 1
1723 1 109 PHE QB 1 109 PHE QD 2.345 . 2.381 2.136 2.087 2.241 . 0 0 "[ . 1 . 2]" 1
1724 1 109 PHE QB 1 109 PHE QE 3.120 . 4.337 3.910 3.877 3.941 . 0 0 "[ . 1 . 2]" 1
1725 1 109 PHE QB 1 110 ARG H 3.700 . 4.845 3.670 3.114 3.957 . 0 0 "[ . 1 . 2]" 1
1726 1 109 PHE QB 1 110 ARG QD 3.129 . 4.353 4.228 3.994 5.368 1.015 14 1 "[ . 1 +. 2]" 1
1727 1 109 PHE QD 1 110 ARG H 3.248 . 4.567 3.513 2.341 4.180 . 0 0 "[ . 1 . 2]" 1
1728 1 109 PHE QD 1 111 LEU QD 2.497 . 3.276 2.800 1.791 3.310 0.034 10 0 "[ . 1 . 2]" 1
1729 1 109 PHE QE 1 111 LEU QD 2.506 . 3.291 2.686 1.998 3.268 . 0 0 "[ . 1 . 2]" 1
1730 1 110 ARG H 1 110 ARG HB2 2.461 . 3.218 2.974 2.311 3.924 0.706 9 3 "[ . +* .- 2]" 1
1731 1 110 ARG H 1 110 ARG QD 2.154 . 2.734 2.352 1.532 2.781 0.047 1 0 "[ . 1 . 2]" 1
1732 1 110 ARG H 1 111 LEU H 3.568 . 5.159 4.458 4.260 4.599 . 0 0 "[ . 1 . 2]" 1
1733 1 110 ARG H 1 111 LEU QD 4.078 . 6.156 4.116 3.555 4.867 . 0 0 "[ . 1 . 2]" 1
1734 1 110 ARG HA 1 110 ARG HB2 2.154 . 2.734 2.817 2.379 2.991 0.257 13 0 "[ . 1 . 2]" 1
1735 1 110 ARG HA 1 110 ARG QD 3.017 . 4.154 2.823 2.168 3.564 . 0 0 "[ . 1 . 2]" 1
1736 1 110 ARG HA 1 111 LEU H 1.800 . 2.205 2.215 2.076 2.283 0.078 18 0 "[ . 1 . 2]" 1
1737 1 110 ARG HB2 1 110 ARG QD 2.710 . 3.628 2.915 2.359 3.467 . 0 0 "[ . 1 . 2]" 1
1738 1 110 ARG HB2 1 111 LEU H 3.279 . 4.623 3.669 2.803 4.355 . 0 0 "[ . 1 . 2]" 1
1739 1 110 ARG QD 1 110 ARG QG 2.180 . 2.774 2.072 2.002 2.096 . 0 0 "[ . 1 . 2]" 1
1740 1 110 ARG QD 1 111 LEU H 4.130 . 6.262 4.447 3.890 5.030 . 0 0 "[ . 1 . 2]" 1
1741 1 111 LEU H 1 111 LEU HA 2.639 . 3.510 2.926 2.858 2.942 . 0 0 "[ . 1 . 2]" 1
1742 1 111 LEU H 1 111 LEU HB2 2.538 . 3.343 2.460 2.021 2.686 . 0 0 "[ . 1 . 2]" 1
1743 1 111 LEU H 1 111 LEU QD 3.169 . 4.425 3.371 2.157 3.607 . 0 0 "[ . 1 . 2]" 1
1744 1 111 LEU H 1 111 LEU HG 2.697 . 3.607 3.332 2.470 4.015 0.408 2 0 "[ . 1 . 2]" 1
1745 1 111 LEU H 1 112 ASP H 3.864 . 5.730 4.436 4.378 4.528 . 0 0 "[ . 1 . 2]" 1
1746 1 111 LEU HA 1 111 LEU HB2 2.986 . 4.100 2.971 2.750 3.009 . 0 0 "[ . 1 . 2]" 1
1747 1 111 LEU HA 1 111 LEU HB3 2.215 . 2.828 2.562 2.397 2.874 0.046 2 0 "[ . 1 . 2]" 1
1748 1 111 LEU HA 1 111 LEU QD 2.098 . 2.648 1.897 1.644 2.148 . 0 0 "[ . 1 . 2]" 1
1749 1 111 LEU HA 1 111 LEU HG 3.361 . 4.773 3.157 2.850 3.679 . 0 0 "[ . 1 . 2]" 1
1750 1 111 LEU HA 1 112 ASP H 2.339 . 3.023 2.368 2.284 2.469 . 0 0 "[ . 1 . 2]" 1
1751 1 111 LEU HB2 1 111 LEU QD 2.435 . 3.176 2.370 2.156 2.595 . 0 0 "[ . 1 . 2]" 1
1752 1 111 LEU HB3 1 111 LEU QD 2.251 . 2.884 2.083 2.006 2.278 . 0 0 "[ . 1 . 2]" 1
1753 1 111 LEU HB3 1 112 ASP H 3.879 . 5.759 2.276 2.005 2.749 . 0 0 "[ . 1 . 2]" 1
1754 1 111 LEU QD 1 111 LEU HG 1.769 . 2.160 1.889 1.880 1.898 . 0 0 "[ . 1 . 2]" 1
1755 1 112 ASP H 1 112 ASP QB 4.179 . 4.542 2.352 2.170 2.666 . 0 0 "[ . 1 . 2]" 1
1756 1 113 PRO HA 1 113 PRO HD3 2.460 . 3.216 3.336 3.206 3.465 0.249 7 0 "[ . 1 . 2]" 1
1757 1 113 PRO HA 1 114 ARG H 2.027 . 2.541 2.152 2.078 2.345 . 0 0 "[ . 1 . 2]" 1
1758 1 113 PRO HB2 1 113 PRO HG3 2.062 . 2.594 2.787 2.660 2.994 0.400 4 0 "[ . 1 . 2]" 1
1759 1 113 PRO HB2 1 114 ARG H 3.066 . 4.241 3.626 2.879 4.088 . 0 0 "[ . 1 . 2]" 1
1760 1 113 PRO HB2 1 114 ARG QD 2.914 . 3.976 3.644 2.287 4.607 0.631 17 2 "[ . 1 . + -2]" 1
1761 1 113 PRO HB3 1 114 ARG H 2.776 . 3.739 3.646 2.513 4.063 0.324 7 0 "[ . 1 . 2]" 1
1762 1 113 PRO HD2 1 113 PRO HG2 2.561 . 3.381 2.303 2.267 2.333 . 0 0 "[ . 1 . 2]" 1
1763 1 113 PRO HD3 1 113 PRO HG2 2.591 . 3.430 2.920 2.747 2.998 . 0 0 "[ . 1 . 2]" 1
1764 1 114 ARG H 1 114 ARG HA 2.362 . 3.059 2.521 2.205 2.942 . 0 0 "[ . 1 . 2]" 1
1765 1 114 ARG H 1 114 ARG HB2 2.836 . 3.841 3.387 2.738 4.154 0.313 1 0 "[ . 1 . 2]" 1
1766 1 114 ARG H 1 114 ARG QD 3.546 . 5.118 3.376 2.246 4.804 . 0 0 "[ . 1 . 2]" 1
1767 1 114 ARG H 1 114 ARG QG 2.979 . 4.088 2.934 1.760 4.123 0.110 17 0 "[ . 1 . 2]" 1
1768 1 114 ARG HB2 1 114 ARG QG 1.883 . 2.326 2.314 2.129 2.522 0.196 5 0 "[ . 1 . 2]" 1
1769 1 114 ARG QD 1 114 ARG QG 2.953 . 4.043 2.046 1.984 2.097 . 0 0 "[ . 1 . 2]" 1
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