NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
400774 |
1v5j   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1v5j
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 2131
_Distance_constraint_stats_list.Viol_count 2938
_Distance_constraint_stats_list.Viol_total 5763.128
_Distance_constraint_stats_list.Viol_max 1.467
_Distance_constraint_stats_list.Viol_rms 0.0465
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0068
_Distance_constraint_stats_list.Viol_average_violations_only 0.0981
_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 6 SER 0.322 0.083 9 0 "[ . 1 . 2]"
1 7 GLY 1.228 0.115 11 0 "[ . 1 . 2]"
1 8 LEU 2.147 0.148 1 0 "[ . 1 . 2]"
1 9 SER 0.776 0.115 11 0 "[ . 1 . 2]"
1 10 PRO 6.220 0.532 17 2 "[ .- 1 . + 2]"
1 11 PRO 11.041 0.400 18 0 "[ . 1 . 2]"
1 12 ARG 19.443 0.908 13 7 "[ * . * * + .* *-]"
1 13 GLY 4.909 0.777 19 7 "[ * . * * * .* +-]"
1 14 LEU 2.193 0.473 20 0 "[ . 1 . 2]"
1 15 VAL 2.704 0.405 14 0 "[ . 1 . 2]"
1 16 ALA 1.717 0.405 14 0 "[ . 1 . 2]"
1 17 VAL 3.958 0.270 11 0 "[ . 1 . 2]"
1 18 ARG 6.266 0.315 20 0 "[ . 1 . 2]"
1 19 THR 4.234 0.212 4 0 "[ . 1 . 2]"
1 20 PRO 6.548 0.430 11 0 "[ . 1 . 2]"
1 21 ARG 7.057 0.430 11 0 "[ . 1 . 2]"
1 22 GLY 2.267 0.264 18 0 "[ . 1 . 2]"
1 23 VAL 2.086 0.290 20 0 "[ . 1 . 2]"
1 24 LEU 2.896 0.184 7 0 "[ . 1 . 2]"
1 25 LEU 3.469 0.197 12 0 "[ . 1 . 2]"
1 26 HIS 5.905 0.150 12 0 "[ . 1 . 2]"
1 27 TRP 4.475 0.180 13 0 "[ . 1 . 2]"
1 28 ASP 3.198 0.148 14 0 "[ . 1 . 2]"
1 29 PRO 3.522 0.132 11 0 "[ . 1 . 2]"
1 30 PRO 5.224 0.260 13 0 "[ . 1 . 2]"
1 31 GLU 8.145 0.908 13 5 "[ - . * * + . *]"
1 32 LEU 2.620 0.221 5 0 "[ . 1 . 2]"
1 33 VAL 6.726 0.220 8 0 "[ . 1 . 2]"
1 34 PRO 7.991 0.220 8 0 "[ . 1 . 2]"
1 35 LYS 4.353 0.364 4 0 "[ . 1 . 2]"
1 36 ARG 1.443 0.223 20 0 "[ . 1 . 2]"
1 37 LEU 2.521 0.230 1 0 "[ . 1 . 2]"
1 38 ASP 0.120 0.040 1 0 "[ . 1 . 2]"
1 39 GLY 2.104 0.125 1 0 "[ . 1 . 2]"
1 40 TYR 7.445 0.399 7 0 "[ . 1 . 2]"
1 41 VAL 2.104 0.273 7 0 "[ . 1 . 2]"
1 42 LEU 3.632 0.296 16 0 "[ . 1 . 2]"
1 43 GLU 2.672 0.231 19 0 "[ . 1 . 2]"
1 44 GLY 1.217 0.127 12 0 "[ . 1 . 2]"
1 45 ARG 17.124 0.583 13 1 "[ . 1 + . 2]"
1 46 GLN 13.497 0.952 12 7 "[-* *. * 1 + .* *]"
1 47 GLY 2.511 0.686 20 2 "[ . - 1 . +]"
1 48 SER 1.281 0.667 9 1 "[ . +1 . 2]"
1 49 GLN 8.560 0.815 9 3 "[ . -+1 . *]"
1 50 GLY 5.744 0.815 9 1 "[ . +1 . 2]"
1 51 TRP 31.070 1.467 1 19 "[+** ********-*******]"
1 52 GLU 3.866 0.807 16 4 "[ . 1 *+ -*2]"
1 53 VAL 2.744 0.563 19 2 "[ . 1 . -+2]"
1 54 LEU 0.865 0.231 19 0 "[ . 1 . 2]"
1 55 ASP 2.231 0.296 16 0 "[ . 1 . 2]"
1 56 PRO 0.051 0.020 20 0 "[ . 1 . 2]"
1 57 ALA 1.367 0.118 14 0 "[ . 1 . 2]"
1 58 VAL 4.989 0.267 15 0 "[ . 1 . 2]"
1 59 ALA 7.175 0.288 6 0 "[ . 1 . 2]"
1 60 GLY 7.310 0.288 6 0 "[ . 1 . 2]"
1 61 THR 0.787 0.466 15 0 "[ . 1 . 2]"
1 62 GLU 7.745 0.684 16 3 "[ . 1 -* .+ 2]"
1 63 THR 6.958 0.470 18 0 "[ . 1 . 2]"
1 64 GLU 12.262 0.684 16 3 "[ . 1 -* .+ 2]"
1 65 LEU 10.862 0.351 13 0 "[ . 1 . 2]"
1 66 LEU 8.761 0.351 13 0 "[ . 1 . 2]"
1 67 VAL 3.890 0.377 19 0 "[ . 1 . 2]"
1 68 PRO 6.163 0.322 9 0 "[ . 1 . 2]"
1 69 GLY 5.080 0.322 9 0 "[ . 1 . 2]"
1 70 LEU 3.742 0.377 19 0 "[ . 1 . 2]"
1 71 ILE 5.053 0.639 12 1 "[ . 1 + . 2]"
1 72 LYS 4.526 0.735 12 1 "[ . 1 + . 2]"
1 73 ASP 3.299 0.735 12 1 "[ . 1 + . 2]"
1 74 VAL 15.002 0.952 12 7 "[-* *. * 1 + .* *]"
1 75 LEU 8.614 0.417 6 0 "[ . 1 . 2]"
1 76 TYR 12.356 0.368 9 0 "[ . 1 . 2]"
1 77 GLU 2.909 0.245 9 0 "[ . 1 . 2]"
1 78 PHE 4.705 0.248 19 0 "[ . 1 . 2]"
1 79 ARG 27.356 1.467 1 20 [+**-****************]
1 80 LEU 21.337 0.575 2 8 "[*+**.- 1* * * 2]"
1 81 VAL 2.227 0.310 7 0 "[ . 1 . 2]"
1 82 ALA 1.976 0.134 4 0 "[ . 1 . 2]"
1 83 PHE 2.221 0.131 15 0 "[ . 1 . 2]"
1 84 ALA 3.143 0.236 19 0 "[ . 1 . 2]"
1 85 GLY 0.704 0.236 19 0 "[ . 1 . 2]"
1 86 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 PHE 1.767 0.148 1 0 "[ . 1 . 2]"
1 88 VAL 0.565 0.142 1 0 "[ . 1 . 2]"
1 89 SER 3.814 0.322 10 0 "[ . 1 . 2]"
1 90 ASP 14.337 0.808 6 3 "[ .+ * . * 2]"
1 91 PRO 12.286 0.808 6 4 "[ -.+ * . * 2]"
1 92 SER 19.116 0.575 2 8 "[*+**.- 1* * * 2]"
1 93 ASN 4.733 0.473 20 0 "[ . 1 . 2]"
1 94 THR 4.819 0.671 6 1 "[ .+ 1 . 2]"
1 95 ALA 2.033 0.133 20 0 "[ . 1 . 2]"
1 96 ASN 2.259 0.671 6 1 "[ .+ 1 . 2]"
1 97 VAL 3.276 0.315 20 0 "[ . 1 . 2]"
1 98 SER 1.974 0.155 17 0 "[ . 1 . 2]"
1 99 THR 2.320 0.186 9 0 "[ . 1 . 2]"
1 100 SER 2.266 0.134 9 0 "[ . 1 . 2]"
1 101 GLY 0.349 0.115 20 0 "[ . 1 . 2]"
1 102 LEU 0.938 0.124 5 0 "[ . 1 . 2]"
1 103 SER 0.247 0.038 4 0 "[ . 1 . 2]"
1 104 GLY 0.593 0.156 18 0 "[ . 1 . 2]"
1 105 PRO 0.313 0.156 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER H 1 7 GLY H . . 4.610 3.977 2.016 4.630 0.020 20 0 "[ . 1 . 2]" 1
2 1 6 SER HA 1 7 GLY H . . 3.560 2.526 2.217 3.643 0.083 9 0 "[ . 1 . 2]" 1
3 1 6 SER HA 1 8 LEU H . . 5.230 4.226 3.345 5.241 0.011 7 0 "[ . 1 . 2]" 1
4 1 6 SER QB 1 7 GLY H . . 4.440 3.027 1.967 4.017 . 0 0 "[ . 1 . 2]" 1
5 1 6 SER QB 1 8 LEU H . . 5.090 3.623 2.570 5.125 0.035 19 0 "[ . 1 . 2]" 1
6 1 6 SER QB 1 87 PHE HB3 . . 5.300 4.454 2.400 5.312 0.012 10 0 "[ . 1 . 2]" 1
7 1 6 SER QB 1 87 PHE QD . . 4.760 3.518 2.632 4.775 0.015 17 0 "[ . 1 . 2]" 1
8 1 7 GLY H 1 8 LEU H . . 3.640 2.383 1.875 3.341 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLY H 1 8 LEU HA . . 5.020 4.401 4.109 4.889 . 0 0 "[ . 1 . 2]" 1
10 1 7 GLY H 1 34 PRO QB . . 5.410 3.674 2.824 5.499 0.089 3 0 "[ . 1 . 2]" 1
11 1 7 GLY H 1 34 PRO HG3 . . 5.470 3.585 2.963 5.300 . 0 0 "[ . 1 . 2]" 1
12 1 7 GLY QA 1 8 LEU H . . 3.190 2.780 2.418 2.970 . 0 0 "[ . 1 . 2]" 1
13 1 7 GLY QA 1 8 LEU HB3 . . 4.950 4.805 4.612 4.958 0.008 18 0 "[ . 1 . 2]" 1
14 1 7 GLY QA 1 9 SER H . . 5.120 5.129 4.946 5.235 0.115 11 0 "[ . 1 . 2]" 1
15 1 7 GLY QA 1 34 PRO QB . . 4.730 3.502 2.706 4.620 . 0 0 "[ . 1 . 2]" 1
16 1 7 GLY QA 1 34 PRO HG3 . . 4.790 4.237 3.607 4.841 0.051 19 0 "[ . 1 . 2]" 1
17 1 7 GLY QA 1 87 PHE QD . . 4.880 4.556 3.616 4.939 0.059 7 0 "[ . 1 . 2]" 1
18 1 8 LEU H 1 8 LEU HB2 . . 3.810 3.005 2.724 3.244 . 0 0 "[ . 1 . 2]" 1
19 1 8 LEU H 1 8 LEU HB3 . . 3.420 2.420 2.237 2.541 . 0 0 "[ . 1 . 2]" 1
20 1 8 LEU H 1 8 LEU QD . . 4.350 3.849 3.718 3.929 . 0 0 "[ . 1 . 2]" 1
21 1 8 LEU H 1 9 SER H . . 4.740 4.361 4.207 4.508 . 0 0 "[ . 1 . 2]" 1
22 1 8 LEU H 1 34 PRO HG3 . . 4.890 3.803 3.443 4.156 . 0 0 "[ . 1 . 2]" 1
23 1 8 LEU H 1 89 SER HA . . 5.310 5.301 5.133 5.395 0.085 10 0 "[ . 1 . 2]" 1
24 1 8 LEU HA 1 8 LEU QD . . 3.150 2.147 1.955 2.342 . 0 0 "[ . 1 . 2]" 1
25 1 8 LEU HA 1 9 SER H . . 3.090 2.180 2.176 2.190 . 0 0 "[ . 1 . 2]" 1
26 1 8 LEU HA 1 32 LEU HB3 . . 4.870 4.360 3.938 4.862 . 0 0 "[ . 1 . 2]" 1
27 1 8 LEU HA 1 34 PRO HD2 . . 4.250 3.635 3.396 3.865 . 0 0 "[ . 1 . 2]" 1
28 1 8 LEU HA 1 34 PRO HD3 . . 3.880 1.985 1.820 2.180 . 0 0 "[ . 1 . 2]" 1
29 1 8 LEU HA 1 34 PRO HG3 . . 5.460 3.426 3.097 3.625 . 0 0 "[ . 1 . 2]" 1
30 1 8 LEU HB2 1 9 SER H . . 4.730 4.304 4.218 4.419 . 0 0 "[ . 1 . 2]" 1
31 1 8 LEU HB2 1 33 VAL HA . . 4.970 3.876 3.689 4.085 . 0 0 "[ . 1 . 2]" 1
32 1 8 LEU HB2 1 34 PRO HD2 . . 4.420 3.150 2.977 3.257 . 0 0 "[ . 1 . 2]" 1
33 1 8 LEU HB2 1 34 PRO HD3 . . 4.070 2.182 1.986 2.388 . 0 0 "[ . 1 . 2]" 1
34 1 8 LEU HB2 1 34 PRO HG3 . . 4.360 2.009 1.925 2.232 . 0 0 "[ . 1 . 2]" 1
35 1 8 LEU HB2 1 87 PHE HB2 . . 4.530 3.676 3.018 4.048 . 0 0 "[ . 1 . 2]" 1
36 1 8 LEU HB2 1 87 PHE HB3 . . 4.370 3.127 2.763 3.532 . 0 0 "[ . 1 . 2]" 1
37 1 8 LEU HB2 1 87 PHE QD . . 5.340 3.552 2.080 4.087 . 0 0 "[ . 1 . 2]" 1
38 1 8 LEU HB2 1 87 PHE QE . . 5.390 5.332 4.102 5.538 0.148 1 0 "[ . 1 . 2]" 1
39 1 8 LEU HB3 1 9 SER H . . 4.700 4.440 4.369 4.528 . 0 0 "[ . 1 . 2]" 1
40 1 8 LEU HB3 1 34 PRO HD2 . . 4.830 4.832 4.663 4.877 0.047 2 0 "[ . 1 . 2]" 1
41 1 8 LEU HB3 1 34 PRO HD3 . . 4.210 3.734 3.560 3.911 . 0 0 "[ . 1 . 2]" 1
42 1 8 LEU HB3 1 87 PHE HB2 . . 4.540 3.890 3.236 4.552 0.012 9 0 "[ . 1 . 2]" 1
43 1 8 LEU HB3 1 87 PHE HB3 . . 4.260 2.736 2.251 3.143 . 0 0 "[ . 1 . 2]" 1
44 1 8 LEU HB3 1 89 SER HA . . 4.410 4.222 3.898 4.450 0.040 12 0 "[ . 1 . 2]" 1
45 1 8 LEU QD 1 9 SER H . . 3.490 2.576 2.144 2.882 . 0 0 "[ . 1 . 2]" 1
46 1 8 LEU QD 1 30 PRO HB2 . . 4.220 3.166 2.877 3.394 . 0 0 "[ . 1 . 2]" 1
47 1 8 LEU QD 1 30 PRO HB3 . . 4.470 3.849 3.640 4.113 . 0 0 "[ . 1 . 2]" 1
48 1 8 LEU QD 1 30 PRO HD2 . . 5.360 4.769 4.451 5.212 . 0 0 "[ . 1 . 2]" 1
49 1 8 LEU QD 1 30 PRO HG2 . . 3.540 2.957 2.706 3.380 . 0 0 "[ . 1 . 2]" 1
50 1 8 LEU QD 1 30 PRO HG3 . . 4.950 3.280 3.066 3.499 . 0 0 "[ . 1 . 2]" 1
51 1 8 LEU QD 1 33 VAL H . . 4.810 4.524 4.322 4.719 . 0 0 "[ . 1 . 2]" 1
52 1 8 LEU QD 1 33 VAL HA . . 3.190 2.154 1.936 2.356 . 0 0 "[ . 1 . 2]" 1
53 1 8 LEU QD 1 33 VAL HB . . 4.130 3.309 2.091 4.197 0.067 2 0 "[ . 1 . 2]" 1
54 1 8 LEU QD 1 33 VAL QG . . 2.640 2.166 1.775 2.657 0.017 8 0 "[ . 1 . 2]" 1
55 1 8 LEU QD 1 34 PRO HD2 . . 3.310 2.076 1.882 2.396 . 0 0 "[ . 1 . 2]" 1
56 1 8 LEU QD 1 34 PRO HD3 . . 3.280 2.015 1.898 2.214 . 0 0 "[ . 1 . 2]" 1
57 1 8 LEU QD 1 34 PRO HG3 . . 3.650 3.119 3.024 3.189 . 0 0 "[ . 1 . 2]" 1
58 1 8 LEU QD 1 37 LEU QD . . 3.640 2.443 2.192 2.674 . 0 0 "[ . 1 . 2]" 1
59 1 8 LEU QD 1 82 ALA HA . . 4.560 3.966 3.617 4.290 . 0 0 "[ . 1 . 2]" 1
60 1 8 LEU QD 1 82 ALA MB . . 2.870 2.484 2.234 2.660 . 0 0 "[ . 1 . 2]" 1
61 1 8 LEU QD 1 83 PHE H . . 4.070 3.239 2.818 3.670 . 0 0 "[ . 1 . 2]" 1
62 1 8 LEU QD 1 83 PHE HA . . 3.520 1.932 1.788 2.178 . 0 0 "[ . 1 . 2]" 1
63 1 8 LEU QD 1 83 PHE HB2 . . 5.130 3.839 3.656 4.064 . 0 0 "[ . 1 . 2]" 1
64 1 8 LEU QD 1 83 PHE HB3 . . 5.100 3.900 3.722 4.137 . 0 0 "[ . 1 . 2]" 1
65 1 8 LEU QD 1 83 PHE QD . . 5.450 4.297 4.151 4.553 . 0 0 "[ . 1 . 2]" 1
66 1 8 LEU QD 1 84 ALA H . . 3.760 1.963 1.857 2.100 . 0 0 "[ . 1 . 2]" 1
67 1 8 LEU QD 1 84 ALA MB . . 2.930 1.990 1.798 2.247 . 0 0 "[ . 1 . 2]" 1
68 1 8 LEU QD 1 85 GLY H . . 5.500 4.972 4.792 5.260 . 0 0 "[ . 1 . 2]" 1
69 1 8 LEU QD 1 87 PHE H . . 4.870 4.377 3.893 4.748 . 0 0 "[ . 1 . 2]" 1
70 1 8 LEU QD 1 87 PHE HB2 . . 3.780 2.693 2.343 3.166 . 0 0 "[ . 1 . 2]" 1
71 1 8 LEU QD 1 87 PHE HB3 . . 3.800 2.752 2.240 3.338 . 0 0 "[ . 1 . 2]" 1
72 1 8 LEU QD 1 87 PHE QD . . 5.190 3.852 3.104 4.065 . 0 0 "[ . 1 . 2]" 1
73 1 8 LEU QD 1 88 VAL H . . 5.120 3.982 3.368 4.492 . 0 0 "[ . 1 . 2]" 1
74 1 8 LEU QD 1 89 SER H . . 3.870 2.716 2.326 3.089 . 0 0 "[ . 1 . 2]" 1
75 1 8 LEU QD 1 89 SER HA . . 4.330 3.724 3.273 4.213 . 0 0 "[ . 1 . 2]" 1
76 1 8 LEU QD 1 89 SER HB2 . . 4.140 3.710 3.389 3.934 . 0 0 "[ . 1 . 2]" 1
77 1 8 LEU QD 1 89 SER HB3 . . 3.450 2.400 1.998 2.601 . 0 0 "[ . 1 . 2]" 1
78 1 8 LEU HG 1 9 SER H . . 4.640 3.444 3.273 3.594 . 0 0 "[ . 1 . 2]" 1
79 1 8 LEU HG 1 82 ALA MB . . 4.390 3.188 2.739 3.515 . 0 0 "[ . 1 . 2]" 1
80 1 8 LEU HG 1 89 SER H . . 5.180 4.169 3.869 4.636 . 0 0 "[ . 1 . 2]" 1
81 1 8 LEU HG 1 89 SER HA . . 4.330 4.142 3.811 4.358 0.028 18 0 "[ . 1 . 2]" 1
82 1 8 LEU HG 1 89 SER HB2 . . 4.000 3.304 2.897 3.584 . 0 0 "[ . 1 . 2]" 1
83 1 8 LEU HG 1 89 SER HB3 . . 3.660 2.159 2.036 2.293 . 0 0 "[ . 1 . 2]" 1
84 1 9 SER H 1 10 PRO HD2 . . 5.490 5.017 4.972 5.046 . 0 0 "[ . 1 . 2]" 1
85 1 9 SER H 1 10 PRO HD3 . . 5.340 4.718 4.649 4.778 . 0 0 "[ . 1 . 2]" 1
86 1 9 SER H 1 30 PRO HB2 . . 4.320 3.365 3.063 3.619 . 0 0 "[ . 1 . 2]" 1
87 1 9 SER H 1 30 PRO HB3 . . 4.680 4.186 3.920 4.546 . 0 0 "[ . 1 . 2]" 1
88 1 9 SER H 1 32 LEU H . . 4.290 4.083 3.804 4.329 0.039 14 0 "[ . 1 . 2]" 1
89 1 9 SER H 1 32 LEU HA . . 5.040 4.746 4.588 4.923 . 0 0 "[ . 1 . 2]" 1
90 1 9 SER H 1 32 LEU HB2 . . 4.120 3.677 3.257 4.126 0.006 19 0 "[ . 1 . 2]" 1
91 1 9 SER H 1 32 LEU HB3 . . 3.810 3.311 2.745 3.792 . 0 0 "[ . 1 . 2]" 1
92 1 9 SER H 1 32 LEU QD . . 5.000 4.348 3.960 4.540 . 0 0 "[ . 1 . 2]" 1
93 1 9 SER H 1 33 VAL HA . . 4.820 3.133 2.739 3.551 . 0 0 "[ . 1 . 2]" 1
94 1 9 SER H 1 33 VAL QG . . 4.600 3.910 3.494 4.186 . 0 0 "[ . 1 . 2]" 1
95 1 9 SER H 1 34 PRO HD2 . . 5.400 5.117 4.725 5.407 0.007 17 0 "[ . 1 . 2]" 1
96 1 9 SER H 1 34 PRO HD3 . . 4.880 3.770 3.462 3.969 . 0 0 "[ . 1 . 2]" 1
97 1 9 SER HA 1 10 PRO HD2 . . 3.500 2.625 2.510 2.756 . 0 0 "[ . 1 . 2]" 1
98 1 9 SER HA 1 10 PRO HD3 . . 3.240 1.977 1.944 2.033 . 0 0 "[ . 1 . 2]" 1
99 1 9 SER HA 1 10 PRO HG2 . . 4.710 4.588 4.509 4.682 . 0 0 "[ . 1 . 2]" 1
100 1 9 SER HA 1 10 PRO HG3 . . 4.620 4.250 4.218 4.298 . 0 0 "[ . 1 . 2]" 1
101 1 9 SER HA 1 89 SER HB2 . . 4.980 3.829 3.619 4.091 . 0 0 "[ . 1 . 2]" 1
102 1 9 SER HA 1 89 SER HB3 . . 5.370 4.730 4.333 5.116 . 0 0 "[ . 1 . 2]" 1
103 1 9 SER QB 1 10 PRO HD2 . . 3.510 2.427 2.105 2.689 . 0 0 "[ . 1 . 2]" 1
104 1 9 SER QB 1 10 PRO HD3 . . 3.670 3.293 2.954 3.549 . 0 0 "[ . 1 . 2]" 1
105 1 9 SER QB 1 10 PRO HG2 . . 4.860 4.491 4.280 4.644 . 0 0 "[ . 1 . 2]" 1
106 1 9 SER QB 1 32 LEU H . . 4.840 2.805 2.210 3.472 . 0 0 "[ . 1 . 2]" 1
107 1 9 SER QB 1 32 LEU HB2 . . 4.100 1.975 1.863 2.133 . 0 0 "[ . 1 . 2]" 1
108 1 9 SER QB 1 32 LEU HB3 . . 3.890 2.602 2.122 3.216 . 0 0 "[ . 1 . 2]" 1
109 1 9 SER QB 1 32 LEU QD . . 3.870 3.125 2.590 3.511 . 0 0 "[ . 1 . 2]" 1
110 1 9 SER QB 1 32 LEU HG . . 4.970 4.139 3.871 4.671 . 0 0 "[ . 1 . 2]" 1
111 1 10 PRO HA 1 11 PRO HD2 . . 3.450 2.910 2.818 2.969 . 0 0 "[ . 1 . 2]" 1
112 1 10 PRO HA 1 11 PRO HD3 . . 3.210 2.150 2.084 2.195 . 0 0 "[ . 1 . 2]" 1
113 1 10 PRO HA 1 11 PRO HG2 . . 4.740 4.793 4.717 4.842 0.102 14 0 "[ . 1 . 2]" 1
114 1 10 PRO HA 1 82 ALA H . . 4.680 3.316 3.051 3.636 . 0 0 "[ . 1 . 2]" 1
115 1 10 PRO HA 1 82 ALA MB . . 4.790 2.835 2.310 3.218 . 0 0 "[ . 1 . 2]" 1
116 1 10 PRO HA 1 89 SER HA . . 4.580 4.614 4.422 4.747 0.167 13 0 "[ . 1 . 2]" 1
117 1 10 PRO HA 1 89 SER HB2 . . 3.600 2.312 2.083 2.455 . 0 0 "[ . 1 . 2]" 1
118 1 10 PRO HA 1 89 SER HB3 . . 4.090 3.292 3.007 3.447 . 0 0 "[ . 1 . 2]" 1
119 1 10 PRO HA 1 89 SER HG . . 3.620 3.113 2.223 3.528 . 0 0 "[ . 1 . 2]" 1
120 1 10 PRO HA 1 90 ASP H . . 4.510 3.957 3.588 4.255 . 0 0 "[ . 1 . 2]" 1
121 1 10 PRO HA 1 92 SER H . . 5.440 5.081 4.883 5.275 . 0 0 "[ . 1 . 2]" 1
122 1 10 PRO HB2 1 11 PRO HD2 . . 4.350 2.093 1.958 2.304 . 0 0 "[ . 1 . 2]" 1
123 1 10 PRO HB2 1 11 PRO HD3 . . 4.540 3.175 3.054 3.358 . 0 0 "[ . 1 . 2]" 1
124 1 10 PRO HB2 1 89 SER HG . . 5.360 4.617 3.360 5.253 . 0 0 "[ . 1 . 2]" 1
125 1 10 PRO HB2 1 90 ASP H . . 5.030 4.066 3.719 4.329 . 0 0 "[ . 1 . 2]" 1
126 1 10 PRO HB2 1 90 ASP HB2 . . 5.000 3.884 3.450 4.991 . 0 0 "[ . 1 . 2]" 1
127 1 10 PRO HB2 1 90 ASP HB3 . . 4.840 4.232 3.230 4.577 . 0 0 "[ . 1 . 2]" 1
128 1 10 PRO HB2 1 92 SER H . . 4.050 3.673 3.417 3.886 . 0 0 "[ . 1 . 2]" 1
129 1 10 PRO HB2 1 92 SER HA . . 3.520 3.255 3.115 3.375 . 0 0 "[ . 1 . 2]" 1
130 1 10 PRO HB2 1 93 ASN H . . 5.490 5.549 5.363 5.675 0.185 12 0 "[ . 1 . 2]" 1
131 1 10 PRO HB3 1 11 PRO HD2 . . 4.030 2.791 2.742 2.873 . 0 0 "[ . 1 . 2]" 1
132 1 10 PRO HB3 1 11 PRO HD3 . . 4.290 3.191 3.111 3.319 . 0 0 "[ . 1 . 2]" 1
133 1 10 PRO HB3 1 89 SER HB2 . . 4.800 2.714 2.395 2.964 . 0 0 "[ . 1 . 2]" 1
134 1 10 PRO HB3 1 89 SER HG . . 4.730 3.359 2.089 4.034 . 0 0 "[ . 1 . 2]" 1
135 1 10 PRO HB3 1 90 ASP H . . 4.670 2.404 2.033 2.633 . 0 0 "[ . 1 . 2]" 1
136 1 10 PRO HB3 1 91 PRO HA . . 5.200 4.673 4.595 4.776 . 0 0 "[ . 1 . 2]" 1
137 1 10 PRO HB3 1 92 SER H . . 5.180 4.217 3.969 4.323 . 0 0 "[ . 1 . 2]" 1
138 1 10 PRO HD3 1 90 ASP HB2 . . 5.030 4.311 3.907 5.312 0.282 10 0 "[ . 1 . 2]" 1
139 1 10 PRO HG2 1 90 ASP H . . 4.990 4.384 4.005 4.707 . 0 0 "[ . 1 . 2]" 1
140 1 10 PRO HG2 1 90 ASP HB2 . . 4.390 3.759 3.279 4.922 0.532 17 2 "[ .- 1 . + 2]" 1
141 1 10 PRO HG2 1 90 ASP HB3 . . 4.780 4.480 3.219 4.832 0.052 20 0 "[ . 1 . 2]" 1
142 1 10 PRO HG2 1 92 SER HA . . 5.090 4.582 4.312 4.852 . 0 0 "[ . 1 . 2]" 1
143 1 10 PRO HG3 1 89 SER HB2 . . 4.970 3.779 3.282 4.063 . 0 0 "[ . 1 . 2]" 1
144 1 10 PRO HG3 1 90 ASP H . . 4.530 2.811 2.354 3.139 . 0 0 "[ . 1 . 2]" 1
145 1 10 PRO HG3 1 90 ASP HB2 . . 3.720 2.352 1.976 3.465 . 0 0 "[ . 1 . 2]" 1
146 1 10 PRO HG3 1 90 ASP HB3 . . 3.990 3.424 1.885 3.829 . 0 0 "[ . 1 . 2]" 1
147 1 11 PRO HA 1 12 ARG H . . 3.030 2.524 2.422 2.609 . 0 0 "[ . 1 . 2]" 1
148 1 11 PRO HA 1 12 ARG HG3 . . 3.460 2.972 2.825 3.077 . 0 0 "[ . 1 . 2]" 1
149 1 11 PRO HA 1 27 TRP HD1 . . 4.900 4.796 4.450 5.025 0.125 15 0 "[ . 1 . 2]" 1
150 1 11 PRO HA 1 29 PRO HA . . 4.290 4.337 4.261 4.401 0.111 19 0 "[ . 1 . 2]" 1
151 1 11 PRO HA 1 30 PRO HA . . 3.740 3.849 3.752 4.000 0.260 13 0 "[ . 1 . 2]" 1
152 1 11 PRO HA 1 30 PRO HD3 . . 4.240 3.821 3.541 4.137 . 0 0 "[ . 1 . 2]" 1
153 1 11 PRO HA 1 30 PRO HG3 . . 4.830 4.186 3.815 4.604 . 0 0 "[ . 1 . 2]" 1
154 1 11 PRO HA 1 40 TYR QE . . 5.120 3.969 3.732 4.214 . 0 0 "[ . 1 . 2]" 1
155 1 11 PRO HA 1 82 ALA MB . . 4.890 4.049 3.830 4.214 . 0 0 "[ . 1 . 2]" 1
156 1 11 PRO HB2 1 12 ARG H . . 4.480 2.501 2.307 2.748 . 0 0 "[ . 1 . 2]" 1
157 1 11 PRO HB2 1 27 TRP HD1 . . 4.650 3.821 3.481 4.083 . 0 0 "[ . 1 . 2]" 1
158 1 11 PRO HB2 1 40 TYR QD . . 5.180 4.667 4.300 4.893 . 0 0 "[ . 1 . 2]" 1
159 1 11 PRO HB2 1 40 TYR QE . . 5.280 4.408 4.104 4.609 . 0 0 "[ . 1 . 2]" 1
160 1 11 PRO HB2 1 80 LEU HB2 . . 4.550 4.347 4.001 4.716 0.166 18 0 "[ . 1 . 2]" 1
161 1 11 PRO HB2 1 80 LEU HB3 . . 4.890 3.244 3.041 3.565 . 0 0 "[ . 1 . 2]" 1
162 1 11 PRO HB2 1 80 LEU QD . . 3.980 3.540 3.000 3.796 . 0 0 "[ . 1 . 2]" 1
163 1 11 PRO HB2 1 82 ALA MB . . 5.180 4.742 4.498 4.983 . 0 0 "[ . 1 . 2]" 1
164 1 11 PRO HB2 1 92 SER HA . . 5.190 5.163 4.902 5.362 0.172 14 0 "[ . 1 . 2]" 1
165 1 11 PRO HB2 1 92 SER HB2 . . 4.280 3.599 3.496 3.672 . 0 0 "[ . 1 . 2]" 1
166 1 11 PRO HB2 1 92 SER HB3 . . 4.100 2.767 2.510 2.972 . 0 0 "[ . 1 . 2]" 1
167 1 11 PRO HB3 1 12 ARG H . . 4.270 3.301 3.219 3.417 . 0 0 "[ . 1 . 2]" 1
168 1 11 PRO HB3 1 27 TRP HB2 . . 5.280 3.679 3.336 3.949 . 0 0 "[ . 1 . 2]" 1
169 1 11 PRO HB3 1 27 TRP HD1 . . 4.270 3.388 3.003 3.662 . 0 0 "[ . 1 . 2]" 1
170 1 11 PRO HB3 1 30 PRO HD3 . . 5.170 3.754 3.385 4.095 . 0 0 "[ . 1 . 2]" 1
171 1 11 PRO HB3 1 40 TYR QD . . 4.920 3.457 3.149 3.763 . 0 0 "[ . 1 . 2]" 1
172 1 11 PRO HB3 1 40 TYR QE . . 4.430 2.693 2.377 2.890 . 0 0 "[ . 1 . 2]" 1
173 1 11 PRO HB3 1 80 LEU HB2 . . 5.030 5.080 4.716 5.430 0.400 18 0 "[ . 1 . 2]" 1
174 1 11 PRO HB3 1 80 LEU HB3 . . 5.420 3.641 3.370 3.986 . 0 0 "[ . 1 . 2]" 1
175 1 11 PRO HB3 1 80 LEU QD . . 3.880 3.529 2.638 3.858 . 0 0 "[ . 1 . 2]" 1
176 1 11 PRO HB3 1 82 ALA MB . . 4.770 3.496 3.279 3.721 . 0 0 "[ . 1 . 2]" 1
177 1 11 PRO HB3 1 92 SER HB2 . . 5.050 5.180 5.126 5.245 0.195 13 0 "[ . 1 . 2]" 1
178 1 11 PRO HB3 1 92 SER HB3 . . 4.520 3.965 3.819 4.088 . 0 0 "[ . 1 . 2]" 1
179 1 11 PRO HD2 1 81 VAL HA . . 4.660 3.420 2.994 3.704 . 0 0 "[ . 1 . 2]" 1
180 1 11 PRO HD2 1 82 ALA H . . 4.930 3.383 3.255 3.573 . 0 0 "[ . 1 . 2]" 1
181 1 11 PRO HD2 1 82 ALA MB . . 4.050 3.856 3.569 4.184 0.134 4 0 "[ . 1 . 2]" 1
182 1 11 PRO HD2 1 89 SER HG . . 4.590 3.977 3.006 4.452 . 0 0 "[ . 1 . 2]" 1
183 1 11 PRO HD2 1 91 PRO HA . . 5.180 3.819 3.665 4.024 . 0 0 "[ . 1 . 2]" 1
184 1 11 PRO HD2 1 92 SER H . . 4.280 2.325 2.231 2.501 . 0 0 "[ . 1 . 2]" 1
185 1 11 PRO HD2 1 92 SER HA . . 4.330 3.304 3.183 3.405 . 0 0 "[ . 1 . 2]" 1
186 1 11 PRO HD2 1 92 SER HB2 . . 4.560 4.080 3.889 4.314 . 0 0 "[ . 1 . 2]" 1
187 1 11 PRO HD2 1 92 SER HB3 . . 4.180 2.389 2.162 2.663 . 0 0 "[ . 1 . 2]" 1
188 1 11 PRO HD3 1 40 TYR QD . . 5.360 3.949 3.739 4.135 . 0 0 "[ . 1 . 2]" 1
189 1 11 PRO HD3 1 81 VAL HA . . 4.130 3.069 2.496 3.339 . 0 0 "[ . 1 . 2]" 1
190 1 11 PRO HD3 1 82 ALA H . . 4.330 1.968 1.868 2.208 . 0 0 "[ . 1 . 2]" 1
191 1 11 PRO HD3 1 82 ALA MB . . 3.840 2.262 1.961 2.609 . 0 0 "[ . 1 . 2]" 1
192 1 11 PRO HD3 1 89 SER HB2 . . 4.240 3.903 3.571 4.074 . 0 0 "[ . 1 . 2]" 1
193 1 11 PRO HD3 1 89 SER HB3 . . 4.630 4.422 4.224 4.553 . 0 0 "[ . 1 . 2]" 1
194 1 11 PRO HD3 1 89 SER HG . . 4.290 2.985 2.151 3.379 . 0 0 "[ . 1 . 2]" 1
195 1 11 PRO HD3 1 91 PRO HA . . 5.310 4.638 4.439 4.900 . 0 0 "[ . 1 . 2]" 1
196 1 11 PRO HD3 1 92 SER H . . 4.720 3.661 3.544 3.856 . 0 0 "[ . 1 . 2]" 1
197 1 11 PRO HD3 1 92 SER HA . . 5.140 5.055 4.935 5.155 0.015 13 0 "[ . 1 . 2]" 1
198 1 11 PRO HD3 1 92 SER HB3 . . 4.580 3.785 3.633 3.963 . 0 0 "[ . 1 . 2]" 1
199 1 11 PRO HG2 1 40 TYR QD . . 4.260 4.260 3.874 4.366 0.106 13 0 "[ . 1 . 2]" 1
200 1 11 PRO HG2 1 40 TYR QE . . 5.500 4.969 4.750 5.174 . 0 0 "[ . 1 . 2]" 1
201 1 11 PRO HG2 1 80 LEU HB2 . . 4.010 3.692 3.332 3.962 . 0 0 "[ . 1 . 2]" 1
202 1 11 PRO HG2 1 80 LEU HB3 . . 4.550 2.305 1.972 2.494 . 0 0 "[ . 1 . 2]" 1
203 1 11 PRO HG2 1 80 LEU QD . . 4.130 3.813 2.850 4.021 . 0 0 "[ . 1 . 2]" 1
204 1 11 PRO HG2 1 80 LEU HG . . 4.620 4.369 3.939 4.805 0.185 7 0 "[ . 1 . 2]" 1
205 1 11 PRO HG2 1 81 VAL H . . 5.010 4.741 4.521 5.016 0.006 18 0 "[ . 1 . 2]" 1
206 1 11 PRO HG2 1 81 VAL HA . . 4.800 3.823 3.486 4.210 . 0 0 "[ . 1 . 2]" 1
207 1 11 PRO HG2 1 82 ALA H . . 5.390 4.014 3.831 4.183 . 0 0 "[ . 1 . 2]" 1
208 1 11 PRO HG2 1 92 SER HB2 . . 5.200 3.332 3.229 3.431 . 0 0 "[ . 1 . 2]" 1
209 1 11 PRO HG2 1 92 SER HB3 . . 4.910 1.935 1.891 1.967 . 0 0 "[ . 1 . 2]" 1
210 1 11 PRO HG3 1 27 TRP HD1 . . 5.500 5.196 4.640 5.546 0.046 9 0 "[ . 1 . 2]" 1
211 1 11 PRO HG3 1 40 TYR QD . . 4.130 2.587 2.211 2.708 . 0 0 "[ . 1 . 2]" 1
212 1 11 PRO HG3 1 40 TYR QE . . 4.390 3.492 3.265 3.721 . 0 0 "[ . 1 . 2]" 1
213 1 11 PRO HG3 1 80 LEU HB2 . . 4.620 4.133 3.803 4.406 . 0 0 "[ . 1 . 2]" 1
214 1 11 PRO HG3 1 80 LEU HB3 . . 4.950 2.404 2.102 2.658 . 0 0 "[ . 1 . 2]" 1
215 1 11 PRO HG3 1 80 LEU QD . . 4.280 3.450 1.987 3.759 . 0 0 "[ . 1 . 2]" 1
216 1 11 PRO HG3 1 80 LEU HG . . 5.050 3.512 2.999 4.624 . 0 0 "[ . 1 . 2]" 1
217 1 11 PRO HG3 1 81 VAL HA . . 4.860 3.394 2.957 3.831 . 0 0 "[ . 1 . 2]" 1
218 1 11 PRO HG3 1 82 ALA H . . 5.130 2.845 2.660 3.122 . 0 0 "[ . 1 . 2]" 1
219 1 11 PRO HG3 1 82 ALA MB . . 3.480 3.012 2.757 3.389 . 0 0 "[ . 1 . 2]" 1
220 1 12 ARG H 1 12 ARG HB2 . . 3.610 3.287 3.214 3.371 . 0 0 "[ . 1 . 2]" 1
221 1 12 ARG H 1 12 ARG HD2 . . 4.820 4.884 4.697 5.171 0.351 2 0 "[ . 1 . 2]" 1
222 1 12 ARG H 1 12 ARG HD3 . . 5.180 5.126 4.908 5.268 0.088 14 0 "[ . 1 . 2]" 1
223 1 12 ARG H 1 12 ARG HE . . 4.920 4.823 4.234 5.006 0.086 17 0 "[ . 1 . 2]" 1
224 1 12 ARG H 1 12 ARG HG2 . . 4.380 3.389 3.242 3.532 . 0 0 "[ . 1 . 2]" 1
225 1 12 ARG H 1 12 ARG HG3 . . 4.410 2.488 2.351 2.620 . 0 0 "[ . 1 . 2]" 1
226 1 12 ARG H 1 27 TRP HB2 . . 4.820 3.462 3.170 3.587 . 0 0 "[ . 1 . 2]" 1
227 1 12 ARG H 1 27 TRP HB3 . . 5.160 5.138 4.818 5.269 0.109 10 0 "[ . 1 . 2]" 1
228 1 12 ARG H 1 27 TRP HD1 . . 4.950 4.231 4.063 4.452 . 0 0 "[ . 1 . 2]" 1
229 1 12 ARG H 1 28 ASP H . . 4.160 2.276 2.036 2.361 . 0 0 "[ . 1 . 2]" 1
230 1 12 ARG H 1 28 ASP HB2 . . 4.560 2.930 2.771 3.177 . 0 0 "[ . 1 . 2]" 1
231 1 12 ARG H 1 28 ASP HB3 . . 5.060 3.399 3.255 3.620 . 0 0 "[ . 1 . 2]" 1
232 1 12 ARG HA 1 12 ARG HD2 . . 5.200 4.749 4.468 4.961 . 0 0 "[ . 1 . 2]" 1
233 1 12 ARG HA 1 12 ARG HD3 . . 5.290 4.764 4.379 5.223 . 0 0 "[ . 1 . 2]" 1
234 1 12 ARG HA 1 12 ARG HG2 . . 3.340 3.013 2.894 3.143 . 0 0 "[ . 1 . 2]" 1
235 1 12 ARG HA 1 12 ARG HG3 . . 4.130 3.493 3.396 3.569 . 0 0 "[ . 1 . 2]" 1
236 1 12 ARG HA 1 13 GLY H . . 3.070 2.670 2.552 2.851 . 0 0 "[ . 1 . 2]" 1
237 1 12 ARG HA 1 14 LEU H . . 4.450 3.522 2.962 4.351 . 0 0 "[ . 1 . 2]" 1
238 1 12 ARG HA 1 92 SER HB3 . . 4.080 3.552 3.382 3.716 . 0 0 "[ . 1 . 2]" 1
239 1 12 ARG HA 1 93 ASN H . . 3.900 3.915 3.730 4.020 0.120 12 0 "[ . 1 . 2]" 1
240 1 12 ARG HB2 1 12 ARG HE . . 4.590 4.057 3.326 4.522 . 0 0 "[ . 1 . 2]" 1
241 1 12 ARG HB2 1 13 GLY H . . 4.240 2.682 2.271 2.979 . 0 0 "[ . 1 . 2]" 1
242 1 12 ARG HB2 1 13 GLY HA2 . . 5.190 4.408 4.181 4.676 . 0 0 "[ . 1 . 2]" 1
243 1 12 ARG HB2 1 28 ASP H . . 5.170 4.266 4.044 4.400 . 0 0 "[ . 1 . 2]" 1
244 1 12 ARG HB2 1 28 ASP HB2 . . 3.580 2.647 2.541 2.750 . 0 0 "[ . 1 . 2]" 1
245 1 12 ARG HB2 1 28 ASP HB3 . . 3.930 3.284 3.221 3.381 . 0 0 "[ . 1 . 2]" 1
246 1 12 ARG HB3 1 12 ARG HD2 . . 3.720 2.884 2.425 3.299 . 0 0 "[ . 1 . 2]" 1
247 1 12 ARG HB3 1 12 ARG HD3 . . 3.770 2.991 2.438 3.758 . 0 0 "[ . 1 . 2]" 1
248 1 12 ARG HB3 1 12 ARG HE . . 4.970 4.452 4.338 4.623 . 0 0 "[ . 1 . 2]" 1
249 1 12 ARG HB3 1 13 GLY H . . 4.130 2.612 2.454 2.732 . 0 0 "[ . 1 . 2]" 1
250 1 12 ARG HB3 1 13 GLY HA2 . . 4.810 4.795 4.711 4.840 0.030 19 0 "[ . 1 . 2]" 1
251 1 12 ARG HB3 1 13 GLY HA3 . . 4.790 4.783 4.667 4.847 0.057 17 0 "[ . 1 . 2]" 1
252 1 12 ARG HB3 1 28 ASP H . . 5.500 5.413 5.240 5.517 0.017 11 0 "[ . 1 . 2]" 1
253 1 12 ARG HB3 1 28 ASP HB2 . . 4.260 4.275 4.165 4.360 0.100 14 0 "[ . 1 . 2]" 1
254 1 12 ARG HB3 1 28 ASP HB3 . . 4.830 4.900 4.851 4.978 0.148 14 0 "[ . 1 . 2]" 1
255 1 12 ARG HD2 1 31 GLU H . . 5.010 5.233 4.877 5.918 0.908 13 5 "[ - . * * + . *]" 1
256 1 12 ARG HD3 1 13 GLY H . . 5.500 5.423 4.599 6.277 0.777 19 7 "[ * . * * * .* +-]" 1
257 1 12 ARG HE 1 30 PRO HA . . 4.270 3.506 2.530 4.311 0.041 19 0 "[ . 1 . 2]" 1
258 1 12 ARG HE 1 31 GLU H . . 5.000 3.647 2.692 4.624 . 0 0 "[ . 1 . 2]" 1
259 1 12 ARG HE 1 31 GLU QB . . 5.240 4.299 3.612 4.787 . 0 0 "[ . 1 . 2]" 1
260 1 12 ARG HG2 1 13 GLY H . . 5.180 4.750 4.628 4.820 . 0 0 "[ . 1 . 2]" 1
261 1 12 ARG HG2 1 28 ASP HB2 . . 4.800 4.852 4.798 4.883 0.083 16 0 "[ . 1 . 2]" 1
262 1 12 ARG HG2 1 30 PRO HA . . 5.180 4.760 4.612 4.922 . 0 0 "[ . 1 . 2]" 1
263 1 12 ARG HG3 1 13 GLY H . . 5.100 4.790 4.532 4.959 . 0 0 "[ . 1 . 2]" 1
264 1 12 ARG HG3 1 28 ASP HB2 . . 4.750 3.491 3.446 3.535 . 0 0 "[ . 1 . 2]" 1
265 1 12 ARG HG3 1 30 PRO HA . . 3.870 3.978 3.874 4.067 0.197 17 0 "[ . 1 . 2]" 1
266 1 13 GLY H 1 14 LEU H . . 3.720 2.920 2.719 3.263 . 0 0 "[ . 1 . 2]" 1
267 1 13 GLY H 1 14 LEU HB2 . . 5.440 4.876 4.559 5.165 . 0 0 "[ . 1 . 2]" 1
268 1 13 GLY HA2 1 14 LEU HA . . 5.260 4.621 4.448 4.848 . 0 0 "[ . 1 . 2]" 1
269 1 13 GLY HA2 1 15 VAL QG . . 4.640 3.835 3.493 4.578 . 0 0 "[ . 1 . 2]" 1
270 1 13 GLY HA2 1 93 ASN HD22 . . 5.340 3.918 3.343 5.202 . 0 0 "[ . 1 . 2]" 1
271 1 13 GLY HA3 1 14 LEU HA . . 5.470 4.576 4.562 4.589 . 0 0 "[ . 1 . 2]" 1
272 1 13 GLY HA3 1 15 VAL QG . . 4.730 4.228 3.969 4.689 . 0 0 "[ . 1 . 2]" 1
273 1 14 LEU H 1 14 LEU HB2 . . 3.490 2.516 2.125 3.024 . 0 0 "[ . 1 . 2]" 1
274 1 14 LEU H 1 14 LEU HB3 . . 3.460 2.574 2.337 2.921 . 0 0 "[ . 1 . 2]" 1
275 1 14 LEU H 1 14 LEU QD . . 4.460 3.705 3.551 3.824 . 0 0 "[ . 1 . 2]" 1
276 1 14 LEU H 1 14 LEU HG . . 4.530 4.350 4.107 4.604 0.074 10 0 "[ . 1 . 2]" 1
277 1 14 LEU H 1 15 VAL HA . . 5.450 5.284 4.967 5.499 0.049 8 0 "[ . 1 . 2]" 1
278 1 14 LEU H 1 27 TRP HA . . 5.150 3.845 3.305 4.348 . 0 0 "[ . 1 . 2]" 1
279 1 14 LEU H 1 92 SER HB2 . . 4.980 3.877 3.456 4.342 . 0 0 "[ . 1 . 2]" 1
280 1 14 LEU H 1 92 SER HG . . 5.310 5.010 4.335 5.344 0.034 12 0 "[ . 1 . 2]" 1
281 1 14 LEU H 1 93 ASN H . . 4.850 4.578 4.337 4.755 . 0 0 "[ . 1 . 2]" 1
282 1 14 LEU H 1 93 ASN HB2 . . 5.150 5.028 4.677 5.623 0.473 20 0 "[ . 1 . 2]" 1
283 1 14 LEU H 1 93 ASN HD21 . . 4.070 3.459 1.997 4.086 0.016 9 0 "[ . 1 . 2]" 1
284 1 14 LEU H 1 93 ASN HD22 . . 3.570 2.036 1.872 3.051 . 0 0 "[ . 1 . 2]" 1
285 1 14 LEU HA 1 14 LEU QD . . 3.110 1.957 1.845 2.359 . 0 0 "[ . 1 . 2]" 1
286 1 14 LEU HA 1 14 LEU HG . . 4.020 3.117 2.739 3.780 . 0 0 "[ . 1 . 2]" 1
287 1 14 LEU HA 1 15 VAL H . . 2.940 2.191 2.176 2.232 . 0 0 "[ . 1 . 2]" 1
288 1 14 LEU HA 1 15 VAL QG . . 4.370 3.388 3.158 4.098 . 0 0 "[ . 1 . 2]" 1
289 1 14 LEU HA 1 26 HIS H . . 4.750 4.329 3.918 4.721 . 0 0 "[ . 1 . 2]" 1
290 1 14 LEU HA 1 27 TRP H . . 5.100 4.363 4.011 4.627 . 0 0 "[ . 1 . 2]" 1
291 1 14 LEU HA 1 27 TRP HA . . 3.880 2.206 1.974 2.507 . 0 0 "[ . 1 . 2]" 1
292 1 14 LEU HA 1 27 TRP HB2 . . 4.120 3.458 3.118 3.900 . 0 0 "[ . 1 . 2]" 1
293 1 14 LEU HA 1 27 TRP HB3 . . 3.740 2.759 2.356 3.222 . 0 0 "[ . 1 . 2]" 1
294 1 14 LEU HA 1 27 TRP HE3 . . 4.960 4.400 4.007 4.728 . 0 0 "[ . 1 . 2]" 1
295 1 14 LEU HA 1 28 ASP H . . 5.500 4.386 4.100 4.610 . 0 0 "[ . 1 . 2]" 1
296 1 14 LEU HB2 1 15 VAL H . . 5.050 4.460 4.245 4.660 . 0 0 "[ . 1 . 2]" 1
297 1 14 LEU HB2 1 92 SER HB2 . . 4.800 2.905 2.462 3.474 . 0 0 "[ . 1 . 2]" 1
298 1 14 LEU HB2 1 92 SER HB3 . . 5.220 3.972 3.512 4.406 . 0 0 "[ . 1 . 2]" 1
299 1 14 LEU HB2 1 92 SER HG . . 4.700 2.998 2.185 3.443 . 0 0 "[ . 1 . 2]" 1
300 1 14 LEU HB2 1 93 ASN HD21 . . 5.300 4.460 3.397 5.107 . 0 0 "[ . 1 . 2]" 1
301 1 14 LEU HB2 1 93 ASN HD22 . . 4.550 3.436 2.898 3.929 . 0 0 "[ . 1 . 2]" 1
302 1 14 LEU HB3 1 15 VAL H . . 5.100 4.307 3.914 4.565 . 0 0 "[ . 1 . 2]" 1
303 1 14 LEU HB3 1 92 SER HB2 . . 4.690 3.453 2.735 4.175 . 0 0 "[ . 1 . 2]" 1
304 1 14 LEU HB3 1 92 SER HG . . 4.800 3.262 2.645 3.710 . 0 0 "[ . 1 . 2]" 1
305 1 14 LEU HB3 1 93 ASN HD21 . . 4.810 3.040 1.902 3.579 . 0 0 "[ . 1 . 2]" 1
306 1 14 LEU HB3 1 93 ASN HD22 . . 4.190 2.384 2.067 2.765 . 0 0 "[ . 1 . 2]" 1
307 1 14 LEU HB3 1 94 THR HA . . 5.220 4.869 4.378 5.249 0.029 20 0 "[ . 1 . 2]" 1
308 1 14 LEU HB3 1 95 ALA MB . . 3.750 3.477 2.788 3.850 0.100 7 0 "[ . 1 . 2]" 1
309 1 14 LEU QD 1 15 VAL H . . 3.440 2.414 2.016 3.288 . 0 0 "[ . 1 . 2]" 1
310 1 14 LEU QD 1 25 LEU HA . . 4.500 3.818 3.469 4.262 . 0 0 "[ . 1 . 2]" 1
311 1 14 LEU QD 1 25 LEU HB3 . . 3.460 2.432 1.910 2.762 . 0 0 "[ . 1 . 2]" 1
312 1 14 LEU QD 1 25 LEU QD . . 3.360 2.925 2.793 3.171 . 0 0 "[ . 1 . 2]" 1
313 1 14 LEU QD 1 26 HIS H . . 3.920 3.487 3.072 3.910 . 0 0 "[ . 1 . 2]" 1
314 1 14 LEU QD 1 26 HIS HA . . 4.430 4.295 4.051 4.521 0.091 5 0 "[ . 1 . 2]" 1
315 1 14 LEU QD 1 27 TRP H . . 5.100 3.875 3.635 4.256 . 0 0 "[ . 1 . 2]" 1
316 1 14 LEU QD 1 27 TRP HA . . 3.960 3.070 2.808 3.440 . 0 0 "[ . 1 . 2]" 1
317 1 14 LEU QD 1 27 TRP HB2 . . 3.780 3.086 2.756 3.344 . 0 0 "[ . 1 . 2]" 1
318 1 14 LEU QD 1 27 TRP HB3 . . 3.390 1.868 1.753 1.963 . 0 0 "[ . 1 . 2]" 1
319 1 14 LEU QD 1 27 TRP HE3 . . 3.360 2.466 2.372 2.583 . 0 0 "[ . 1 . 2]" 1
320 1 14 LEU QD 1 27 TRP HZ3 . . 4.160 4.117 4.004 4.238 0.078 19 0 "[ . 1 . 2]" 1
321 1 14 LEU QD 1 78 PHE H . . 5.030 4.480 3.952 4.814 . 0 0 "[ . 1 . 2]" 1
322 1 14 LEU QD 1 78 PHE HB2 . . 3.920 3.190 2.726 3.470 . 0 0 "[ . 1 . 2]" 1
323 1 14 LEU QD 1 78 PHE HB3 . . 4.120 3.020 2.711 3.383 . 0 0 "[ . 1 . 2]" 1
324 1 14 LEU QD 1 78 PHE QD . . 5.020 4.251 3.913 4.511 . 0 0 "[ . 1 . 2]" 1
325 1 14 LEU QD 1 79 ARG H . . 4.560 3.560 3.183 3.965 . 0 0 "[ . 1 . 2]" 1
326 1 14 LEU QD 1 79 ARG HA . . 3.350 2.214 1.856 3.039 . 0 0 "[ . 1 . 2]" 1
327 1 14 LEU QD 1 79 ARG QB . . 4.800 3.613 3.303 4.301 . 0 0 "[ . 1 . 2]" 1
328 1 14 LEU QD 1 80 LEU H . . 3.830 2.067 1.814 3.255 . 0 0 "[ . 1 . 2]" 1
329 1 14 LEU QD 1 80 LEU HB2 . . 4.260 2.152 1.865 2.942 . 0 0 "[ . 1 . 2]" 1
330 1 14 LEU QD 1 80 LEU HB3 . . 4.180 3.196 2.662 4.089 . 0 0 "[ . 1 . 2]" 1
331 1 14 LEU QD 1 80 LEU QD . . 3.480 2.604 2.064 3.127 . 0 0 "[ . 1 . 2]" 1
332 1 14 LEU QD 1 92 SER HB2 . . 4.860 3.497 3.177 3.981 . 0 0 "[ . 1 . 2]" 1
333 1 14 LEU QD 1 92 SER HG . . 3.630 2.009 1.758 3.026 . 0 0 "[ . 1 . 2]" 1
334 1 14 LEU QD 1 93 ASN HD21 . . 5.500 3.849 2.957 4.419 . 0 0 "[ . 1 . 2]" 1
335 1 14 LEU QD 1 94 THR HA . . 4.280 3.159 2.578 3.480 . 0 0 "[ . 1 . 2]" 1
336 1 14 LEU QD 1 95 ALA H . . 4.150 3.016 2.543 3.373 . 0 0 "[ . 1 . 2]" 1
337 1 14 LEU QD 1 95 ALA HA . . 5.120 4.304 3.554 4.795 . 0 0 "[ . 1 . 2]" 1
338 1 14 LEU QD 1 95 ALA MB . . 3.330 2.306 1.649 2.709 . 0 0 "[ . 1 . 2]" 1
339 1 14 LEU HG 1 15 VAL H . . 4.820 4.166 3.207 4.992 0.172 5 0 "[ . 1 . 2]" 1
340 1 15 VAL H 1 15 VAL HB . . 3.910 3.556 2.895 3.815 . 0 0 "[ . 1 . 2]" 1
341 1 15 VAL H 1 15 VAL QG . . 3.350 2.185 1.905 2.370 . 0 0 "[ . 1 . 2]" 1
342 1 15 VAL H 1 16 ALA H . . 4.820 4.429 4.381 4.473 . 0 0 "[ . 1 . 2]" 1
343 1 15 VAL H 1 25 LEU QD . . 4.540 4.309 4.070 4.483 . 0 0 "[ . 1 . 2]" 1
344 1 15 VAL H 1 26 HIS H . . 3.670 2.650 2.399 2.949 . 0 0 "[ . 1 . 2]" 1
345 1 15 VAL H 1 26 HIS HA . . 5.360 4.472 4.260 4.583 . 0 0 "[ . 1 . 2]" 1
346 1 15 VAL H 1 26 HIS HB3 . . 5.060 4.869 4.428 5.122 0.062 4 0 "[ . 1 . 2]" 1
347 1 15 VAL H 1 27 TRP HA . . 4.580 3.671 3.363 3.947 . 0 0 "[ . 1 . 2]" 1
348 1 15 VAL H 1 27 TRP HB3 . . 4.830 4.161 3.796 4.647 . 0 0 "[ . 1 . 2]" 1
349 1 15 VAL HA 1 15 VAL QG . . 3.180 2.123 2.064 2.192 . 0 0 "[ . 1 . 2]" 1
350 1 15 VAL HA 1 16 ALA H . . 2.730 2.496 2.329 2.535 . 0 0 "[ . 1 . 2]" 1
351 1 15 VAL HA 1 16 ALA MB . . 4.210 3.816 3.732 3.886 . 0 0 "[ . 1 . 2]" 1
352 1 15 VAL HA 1 95 ALA HA . . 4.290 3.939 3.500 4.299 0.009 5 0 "[ . 1 . 2]" 1
353 1 15 VAL HA 1 95 ALA MB . . 3.340 2.139 1.809 2.596 . 0 0 "[ . 1 . 2]" 1
354 1 15 VAL HA 1 96 ASN H . . 5.400 4.753 4.552 5.241 . 0 0 "[ . 1 . 2]" 1
355 1 15 VAL HB 1 16 ALA H . . 3.710 2.744 2.357 4.115 0.405 14 0 "[ . 1 . 2]" 1
356 1 15 VAL HB 1 26 HIS H . . 5.110 4.343 3.926 4.848 . 0 0 "[ . 1 . 2]" 1
357 1 15 VAL HB 1 26 HIS HB2 . . 4.920 4.391 4.075 4.664 . 0 0 "[ . 1 . 2]" 1
358 1 15 VAL QG 1 16 ALA H . . 3.640 2.891 1.856 3.342 . 0 0 "[ . 1 . 2]" 1
359 1 15 VAL QG 1 16 ALA HA . . 4.900 3.914 3.340 4.160 . 0 0 "[ . 1 . 2]" 1
360 1 15 VAL QG 1 25 LEU HA . . 5.120 3.864 3.524 4.166 . 0 0 "[ . 1 . 2]" 1
361 1 15 VAL QG 1 26 HIS HB2 . . 3.870 1.914 1.779 2.070 . 0 0 "[ . 1 . 2]" 1
362 1 15 VAL QG 1 26 HIS HB3 . . 3.590 3.323 3.154 3.478 . 0 0 "[ . 1 . 2]" 1
363 1 15 VAL QG 1 26 HIS HD2 . . 4.230 4.245 4.013 4.380 0.150 12 0 "[ . 1 . 2]" 1
364 1 15 VAL QG 1 26 HIS HE1 . . 4.900 4.443 3.832 4.878 . 0 0 "[ . 1 . 2]" 1
365 1 15 VAL QG 1 27 TRP H . . 5.150 4.674 4.486 4.964 . 0 0 "[ . 1 . 2]" 1
366 1 15 VAL QG 1 95 ALA MB . . 4.640 3.331 2.989 3.721 . 0 0 "[ . 1 . 2]" 1
367 1 15 VAL QG 1 96 ASN H . . 5.140 5.052 4.692 5.221 0.081 6 0 "[ . 1 . 2]" 1
368 1 16 ALA H 1 16 ALA MB . . 3.250 2.527 2.343 2.626 . 0 0 "[ . 1 . 2]" 1
369 1 16 ALA H 1 25 LEU HA . . 5.500 4.627 4.505 4.774 . 0 0 "[ . 1 . 2]" 1
370 1 16 ALA H 1 25 LEU QD . . 4.500 3.831 3.478 4.103 . 0 0 "[ . 1 . 2]" 1
371 1 16 ALA H 1 95 ALA HA . . 5.500 4.680 4.361 5.029 . 0 0 "[ . 1 . 2]" 1
372 1 16 ALA H 1 95 ALA MB . . 3.600 2.828 2.320 3.320 . 0 0 "[ . 1 . 2]" 1
373 1 16 ALA HA 1 17 VAL H . . 2.920 2.271 2.186 2.522 . 0 0 "[ . 1 . 2]" 1
374 1 16 ALA HA 1 17 VAL HA . . 4.550 4.422 4.376 4.559 0.009 6 0 "[ . 1 . 2]" 1
375 1 16 ALA HA 1 17 VAL QG . . 4.040 3.412 2.763 3.949 . 0 0 "[ . 1 . 2]" 1
376 1 16 ALA HA 1 23 VAL QG . . 4.090 3.237 2.598 3.847 . 0 0 "[ . 1 . 2]" 1
377 1 16 ALA HA 1 25 LEU HA . . 3.300 2.231 1.970 2.400 . 0 0 "[ . 1 . 2]" 1
378 1 16 ALA HA 1 25 LEU QD . . 3.250 1.991 1.808 2.325 . 0 0 "[ . 1 . 2]" 1
379 1 16 ALA HA 1 25 LEU HG . . 4.400 3.909 3.663 4.519 0.119 14 0 "[ . 1 . 2]" 1
380 1 16 ALA HA 1 26 HIS H . . 4.270 3.503 3.227 3.773 . 0 0 "[ . 1 . 2]" 1
381 1 16 ALA HA 1 95 ALA MB . . 5.050 3.841 3.671 4.053 . 0 0 "[ . 1 . 2]" 1
382 1 16 ALA MB 1 17 VAL H . . 3.610 3.085 2.401 3.457 . 0 0 "[ . 1 . 2]" 1
383 1 16 ALA MB 1 17 VAL HA . . 4.360 4.121 3.862 4.309 . 0 0 "[ . 1 . 2]" 1
384 1 16 ALA MB 1 23 VAL QG . . 2.990 2.236 1.865 2.645 . 0 0 "[ . 1 . 2]" 1
385 1 16 ALA MB 1 24 LEU H . . 5.020 4.924 4.629 5.140 0.120 18 0 "[ . 1 . 2]" 1
386 1 16 ALA MB 1 25 LEU HA . . 4.280 3.529 3.397 3.656 . 0 0 "[ . 1 . 2]" 1
387 1 16 ALA MB 1 25 LEU QD . . 2.890 1.708 1.640 1.891 . 0 0 "[ . 1 . 2]" 1
388 1 16 ALA MB 1 78 PHE QD . . 3.590 2.360 1.899 2.904 . 0 0 "[ . 1 . 2]" 1
389 1 16 ALA MB 1 78 PHE QE . . 3.910 2.720 2.215 3.286 . 0 0 "[ . 1 . 2]" 1
390 1 16 ALA MB 1 95 ALA HA . . 4.480 4.075 3.841 4.336 . 0 0 "[ . 1 . 2]" 1
391 1 16 ALA MB 1 95 ALA MB . . 3.080 2.202 1.801 2.588 . 0 0 "[ . 1 . 2]" 1
392 1 16 ALA MB 1 96 ASN H . . 4.670 3.181 2.718 3.799 . 0 0 "[ . 1 . 2]" 1
393 1 16 ALA MB 1 96 ASN HA . . 4.960 3.324 2.695 4.112 . 0 0 "[ . 1 . 2]" 1
394 1 17 VAL H 1 17 VAL HB . . 3.550 3.227 2.934 3.503 . 0 0 "[ . 1 . 2]" 1
395 1 17 VAL H 1 17 VAL QG . . 3.300 2.064 1.847 2.429 . 0 0 "[ . 1 . 2]" 1
396 1 17 VAL H 1 23 VAL HA . . 5.000 4.141 3.602 4.869 . 0 0 "[ . 1 . 2]" 1
397 1 17 VAL H 1 23 VAL QG . . 3.770 2.903 2.237 3.552 . 0 0 "[ . 1 . 2]" 1
398 1 17 VAL H 1 24 LEU H . . 3.860 3.067 2.631 3.346 . 0 0 "[ . 1 . 2]" 1
399 1 17 VAL H 1 24 LEU HB2 . . 4.740 4.651 4.098 4.924 0.184 7 0 "[ . 1 . 2]" 1
400 1 17 VAL H 1 25 LEU HA . . 4.130 3.550 3.157 3.938 . 0 0 "[ . 1 . 2]" 1
401 1 17 VAL H 1 25 LEU QD . . 4.070 3.352 2.958 3.703 . 0 0 "[ . 1 . 2]" 1
402 1 17 VAL HA 1 17 VAL QG . . 3.190 2.336 2.023 2.475 . 0 0 "[ . 1 . 2]" 1
403 1 17 VAL HA 1 18 ARG H . . 2.740 2.199 2.182 2.266 . 0 0 "[ . 1 . 2]" 1
404 1 17 VAL HA 1 18 ARG HB2 . . 4.310 4.281 4.210 4.418 0.108 17 0 "[ . 1 . 2]" 1
405 1 17 VAL HA 1 18 ARG HB3 . . 4.920 5.027 4.914 5.190 0.270 11 0 "[ . 1 . 2]" 1
406 1 17 VAL HA 1 23 VAL QG . . 5.040 4.321 3.362 4.923 . 0 0 "[ . 1 . 2]" 1
407 1 17 VAL HA 1 97 VAL QG . . 4.220 3.477 3.163 3.933 . 0 0 "[ . 1 . 2]" 1
408 1 17 VAL HB 1 19 THR MG . . 4.690 4.523 2.518 4.797 0.107 2 0 "[ . 1 . 2]" 1
409 1 17 VAL HB 1 24 LEU H . . 5.140 4.875 2.846 5.234 0.094 19 0 "[ . 1 . 2]" 1
410 1 17 VAL HB 1 24 LEU HB3 . . 4.930 4.648 3.072 5.045 0.115 13 0 "[ . 1 . 2]" 1
411 1 17 VAL QG 1 18 ARG H . . 3.540 2.992 2.726 3.413 . 0 0 "[ . 1 . 2]" 1
412 1 17 VAL QG 1 18 ARG HA . . 4.790 3.936 3.791 4.636 . 0 0 "[ . 1 . 2]" 1
413 1 17 VAL QG 1 18 ARG HB3 . . 5.050 4.527 4.275 5.121 0.071 17 0 "[ . 1 . 2]" 1
414 1 17 VAL QG 1 19 THR HA . . 4.950 4.277 3.871 4.769 . 0 0 "[ . 1 . 2]" 1
415 1 17 VAL QG 1 19 THR MG . . 2.970 2.239 1.933 2.923 . 0 0 "[ . 1 . 2]" 1
416 1 17 VAL QG 1 24 LEU H . . 3.980 2.279 1.875 3.294 . 0 0 "[ . 1 . 2]" 1
417 1 17 VAL QG 1 24 LEU HA . . 5.150 3.761 3.576 4.149 . 0 0 "[ . 1 . 2]" 1
418 1 17 VAL QG 1 24 LEU HB2 . . 3.540 2.720 2.195 3.189 . 0 0 "[ . 1 . 2]" 1
419 1 17 VAL QG 1 24 LEU HB3 . . 4.310 2.036 1.734 2.440 . 0 0 "[ . 1 . 2]" 1
420 1 17 VAL QG 1 25 LEU H . . 5.350 4.350 4.069 4.552 . 0 0 "[ . 1 . 2]" 1
421 1 17 VAL QG 1 25 LEU HA . . 5.320 3.756 3.203 4.330 . 0 0 "[ . 1 . 2]" 1
422 1 17 VAL QG 1 26 HIS HD2 . . 4.540 3.474 3.045 3.825 . 0 0 "[ . 1 . 2]" 1
423 1 17 VAL QG 1 26 HIS HE1 . . 5.180 2.249 1.908 2.746 . 0 0 "[ . 1 . 2]" 1
424 1 18 ARG H 1 18 ARG HB2 . . 3.490 2.150 2.053 2.232 . 0 0 "[ . 1 . 2]" 1
425 1 18 ARG H 1 18 ARG HB3 . . 3.580 2.896 2.799 3.070 . 0 0 "[ . 1 . 2]" 1
426 1 18 ARG H 1 18 ARG HG2 . . 4.170 4.164 3.863 4.337 0.167 17 0 "[ . 1 . 2]" 1
427 1 18 ARG H 1 18 ARG HG3 . . 4.200 4.243 4.157 4.357 0.157 7 0 "[ . 1 . 2]" 1
428 1 18 ARG H 1 19 THR H . . 4.880 4.578 4.296 4.659 . 0 0 "[ . 1 . 2]" 1
429 1 18 ARG H 1 19 THR MG . . 5.310 4.100 3.938 4.504 . 0 0 "[ . 1 . 2]" 1
430 1 18 ARG H 1 23 VAL QG . . 5.390 3.835 3.062 4.344 . 0 0 "[ . 1 . 2]" 1
431 1 18 ARG H 1 97 VAL HA . . 4.500 4.490 4.301 4.598 0.098 17 0 "[ . 1 . 2]" 1
432 1 18 ARG H 1 97 VAL QG . . 3.950 2.995 2.695 3.327 . 0 0 "[ . 1 . 2]" 1
433 1 18 ARG HA 1 18 ARG HD2 . . 4.470 4.142 2.893 4.676 0.206 17 0 "[ . 1 . 2]" 1
434 1 18 ARG HA 1 18 ARG HD3 . . 4.540 4.063 3.229 4.553 0.013 15 0 "[ . 1 . 2]" 1
435 1 18 ARG HA 1 18 ARG HG2 . . 4.100 2.129 2.063 2.323 . 0 0 "[ . 1 . 2]" 1
436 1 18 ARG HA 1 18 ARG HG3 . . 3.820 3.212 2.856 3.472 . 0 0 "[ . 1 . 2]" 1
437 1 18 ARG HA 1 19 THR H . . 2.940 2.275 2.227 2.367 . 0 0 "[ . 1 . 2]" 1
438 1 18 ARG HA 1 19 THR HA . . 4.660 4.457 4.426 4.521 . 0 0 "[ . 1 . 2]" 1
439 1 18 ARG HA 1 19 THR MG . . 4.050 3.142 2.825 3.993 . 0 0 "[ . 1 . 2]" 1
440 1 18 ARG HA 1 23 VAL QG . . 3.700 2.388 1.829 2.999 . 0 0 "[ . 1 . 2]" 1
441 1 18 ARG HA 1 24 LEU H . . 4.110 3.818 3.524 4.137 0.027 10 0 "[ . 1 . 2]" 1
442 1 18 ARG HA 1 97 VAL QG . . 4.720 2.910 2.537 3.435 . 0 0 "[ . 1 . 2]" 1
443 1 18 ARG HB2 1 19 THR H . . 4.700 4.458 4.234 4.696 . 0 0 "[ . 1 . 2]" 1
444 1 18 ARG HB2 1 97 VAL QG . . 3.960 2.413 2.035 2.720 . 0 0 "[ . 1 . 2]" 1
445 1 18 ARG HB3 1 18 ARG HD2 . . 4.020 2.703 2.156 3.559 . 0 0 "[ . 1 . 2]" 1
446 1 18 ARG HB3 1 18 ARG HD3 . . 4.000 2.817 2.136 3.644 . 0 0 "[ . 1 . 2]" 1
447 1 18 ARG HB3 1 19 THR H . . 4.530 3.860 3.475 4.335 . 0 0 "[ . 1 . 2]" 1
448 1 18 ARG HB3 1 19 THR HA . . 4.910 4.323 4.101 4.616 . 0 0 "[ . 1 . 2]" 1
449 1 18 ARG HB3 1 97 VAL QG . . 4.370 3.549 3.193 3.752 . 0 0 "[ . 1 . 2]" 1
450 1 18 ARG HD2 1 23 VAL QG . . 4.650 4.329 3.663 4.728 0.078 19 0 "[ . 1 . 2]" 1
451 1 18 ARG HD2 1 97 VAL QG . . 4.760 3.833 2.678 4.535 . 0 0 "[ . 1 . 2]" 1
452 1 18 ARG HD3 1 19 THR H . . 5.440 3.944 2.730 5.348 . 0 0 "[ . 1 . 2]" 1
453 1 18 ARG HD3 1 23 VAL QG . . 4.690 4.250 3.541 4.751 0.061 15 0 "[ . 1 . 2]" 1
454 1 18 ARG HD3 1 97 VAL QG . . 4.560 4.004 3.495 4.500 . 0 0 "[ . 1 . 2]" 1
455 1 18 ARG HG2 1 19 THR H . . 4.670 2.888 2.084 3.459 . 0 0 "[ . 1 . 2]" 1
456 1 18 ARG HG2 1 23 VAL QG . . 4.480 2.323 1.815 3.158 . 0 0 "[ . 1 . 2]" 1
457 1 18 ARG HG2 1 97 VAL HB . . 4.950 4.377 3.575 5.265 0.315 20 0 "[ . 1 . 2]" 1
458 1 18 ARG HG2 1 97 VAL QG . . 4.500 2.638 1.993 3.220 . 0 0 "[ . 1 . 2]" 1
459 1 18 ARG HG3 1 19 THR H . . 4.660 4.443 3.769 4.744 0.084 17 0 "[ . 1 . 2]" 1
460 1 18 ARG HG3 1 23 VAL QG . . 4.370 3.032 2.383 4.179 . 0 0 "[ . 1 . 2]" 1
461 1 18 ARG HG3 1 97 VAL HB . . 5.210 3.607 2.923 4.994 . 0 0 "[ . 1 . 2]" 1
462 1 18 ARG HG3 1 97 VAL QG . . 4.080 1.901 1.772 2.151 . 0 0 "[ . 1 . 2]" 1
463 1 19 THR H 1 19 THR MG . . 3.470 2.371 1.911 3.084 . 0 0 "[ . 1 . 2]" 1
464 1 19 THR H 1 21 ARG H . . 5.210 4.525 3.766 5.135 . 0 0 "[ . 1 . 2]" 1
465 1 19 THR H 1 22 GLY H . . 4.280 3.264 2.893 3.597 . 0 0 "[ . 1 . 2]" 1
466 1 19 THR H 1 23 VAL HA . . 4.110 2.710 2.129 3.143 . 0 0 "[ . 1 . 2]" 1
467 1 19 THR H 1 23 VAL QG . . 4.480 3.204 2.597 4.083 . 0 0 "[ . 1 . 2]" 1
468 1 19 THR H 1 24 LEU H . . 4.700 4.202 3.267 4.711 0.011 15 0 "[ . 1 . 2]" 1
469 1 19 THR HA 1 19 THR MG . . 3.210 2.737 2.320 2.835 . 0 0 "[ . 1 . 2]" 1
470 1 19 THR HA 1 20 PRO HD2 . . 3.020 3.095 2.881 3.232 0.212 4 0 "[ . 1 . 2]" 1
471 1 19 THR HA 1 20 PRO HD3 . . 3.420 2.266 2.087 2.392 . 0 0 "[ . 1 . 2]" 1
472 1 19 THR HA 1 20 PRO HG3 . . 4.440 4.483 4.330 4.591 0.151 4 0 "[ . 1 . 2]" 1
473 1 19 THR HA 1 21 ARG H . . 4.520 4.300 3.886 4.647 0.127 17 0 "[ . 1 . 2]" 1
474 1 19 THR HB 1 20 PRO HD2 . . 3.280 1.908 1.622 1.995 . 0 0 "[ . 1 . 2]" 1
475 1 19 THR HB 1 20 PRO HD3 . . 3.100 2.445 2.176 2.996 . 0 0 "[ . 1 . 2]" 1
476 1 19 THR HB 1 20 PRO HG2 . . 4.520 4.160 3.906 4.268 . 0 0 "[ . 1 . 2]" 1
477 1 19 THR HB 1 20 PRO HG3 . . 4.810 4.408 4.186 4.719 . 0 0 "[ . 1 . 2]" 1
478 1 19 THR HB 1 21 ARG H . . 4.180 3.430 2.367 3.730 . 0 0 "[ . 1 . 2]" 1
479 1 19 THR HB 1 22 GLY H . . 5.030 4.219 3.333 5.001 . 0 0 "[ . 1 . 2]" 1
480 1 19 THR HG1 1 21 ARG H . . 4.290 2.532 1.930 3.262 . 0 0 "[ . 1 . 2]" 1
481 1 19 THR HG1 1 22 GLY H . . 4.320 2.435 1.928 2.971 . 0 0 "[ . 1 . 2]" 1
482 1 19 THR HG1 1 22 GLY HA2 . . 5.280 4.465 3.648 5.223 . 0 0 "[ . 1 . 2]" 1
483 1 19 THR HG1 1 66 LEU MD1 . . 4.570 3.028 2.037 3.491 . 0 0 "[ . 1 . 2]" 1
484 1 19 THR MG 1 20 PRO HD2 . . 4.070 3.550 2.969 3.764 . 0 0 "[ . 1 . 2]" 1
485 1 19 THR MG 1 20 PRO HD3 . . 4.100 3.896 3.199 4.047 . 0 0 "[ . 1 . 2]" 1
486 1 19 THR MG 1 21 ARG H . . 4.320 4.101 3.688 4.384 0.064 20 0 "[ . 1 . 2]" 1
487 1 19 THR MG 1 22 GLY H . . 4.780 3.770 3.300 4.520 . 0 0 "[ . 1 . 2]" 1
488 1 19 THR MG 1 23 VAL HA . . 4.010 2.533 2.205 3.942 . 0 0 "[ . 1 . 2]" 1
489 1 19 THR MG 1 24 LEU H . . 3.960 2.471 2.022 3.069 . 0 0 "[ . 1 . 2]" 1
490 1 19 THR MG 1 24 LEU HA . . 4.670 4.390 3.904 4.659 . 0 0 "[ . 1 . 2]" 1
491 1 19 THR MG 1 24 LEU HB2 . . 3.360 2.639 2.104 3.051 . 0 0 "[ . 1 . 2]" 1
492 1 19 THR MG 1 24 LEU QD . . 3.600 3.304 2.685 3.577 . 0 0 "[ . 1 . 2]" 1
493 1 20 PRO HA 1 21 ARG QG . . 5.390 4.672 4.099 4.996 . 0 0 "[ . 1 . 2]" 1
494 1 20 PRO HB2 1 21 ARG H . . 4.620 3.601 3.214 4.108 . 0 0 "[ . 1 . 2]" 1
495 1 20 PRO HB2 1 21 ARG QG . . 5.100 3.374 3.012 3.647 . 0 0 "[ . 1 . 2]" 1
496 1 20 PRO HB3 1 21 ARG H . . 4.220 4.382 4.172 4.650 0.430 11 0 "[ . 1 . 2]" 1
497 1 20 PRO HD2 1 21 ARG H . . 4.550 2.434 2.253 2.846 . 0 0 "[ . 1 . 2]" 1
498 1 20 PRO HD3 1 21 ARG H . . 4.230 3.729 3.655 3.897 . 0 0 "[ . 1 . 2]" 1
499 1 20 PRO HG2 1 21 ARG H . . 5.010 3.256 2.743 4.012 . 0 0 "[ . 1 . 2]" 1
500 1 20 PRO HG3 1 21 ARG H . . 5.130 4.357 4.022 4.862 . 0 0 "[ . 1 . 2]" 1
501 1 21 ARG H 1 21 ARG HB2 . . 3.500 2.535 2.298 2.927 . 0 0 "[ . 1 . 2]" 1
502 1 21 ARG H 1 21 ARG HB3 . . 3.900 3.640 3.541 3.854 . 0 0 "[ . 1 . 2]" 1
503 1 21 ARG H 1 21 ARG QD . . 4.770 4.281 3.401 4.605 . 0 0 "[ . 1 . 2]" 1
504 1 21 ARG H 1 21 ARG QG . . 3.850 2.574 2.170 3.008 . 0 0 "[ . 1 . 2]" 1
505 1 21 ARG H 1 66 LEU MD1 . . 4.890 4.225 3.766 4.702 . 0 0 "[ . 1 . 2]" 1
506 1 21 ARG H 1 66 LEU MD2 . . 5.110 4.891 4.455 5.126 0.016 5 0 "[ . 1 . 2]" 1
507 1 21 ARG HA 1 21 ARG QD . . 4.060 3.583 2.664 4.122 0.062 19 0 "[ . 1 . 2]" 1
508 1 21 ARG HA 1 21 ARG QG . . 3.330 2.391 2.163 2.627 . 0 0 "[ . 1 . 2]" 1
509 1 21 ARG HA 1 66 LEU MD1 . . 5.190 4.827 4.454 5.191 0.001 2 0 "[ . 1 . 2]" 1
510 1 21 ARG HB2 1 22 GLY H . . 4.470 3.434 3.054 3.998 . 0 0 "[ . 1 . 2]" 1
511 1 21 ARG HB2 1 22 GLY HA2 . . 5.250 5.327 5.215 5.514 0.264 18 0 "[ . 1 . 2]" 1
512 1 21 ARG HB2 1 66 LEU MD1 . . 3.850 2.873 2.457 3.063 . 0 0 "[ . 1 . 2]" 1
513 1 21 ARG HB2 1 66 LEU MD2 . . 4.010 3.153 2.327 3.787 . 0 0 "[ . 1 . 2]" 1
514 1 21 ARG HB3 1 21 ARG QD . . 3.640 2.161 2.006 2.738 . 0 0 "[ . 1 . 2]" 1
515 1 21 ARG HB3 1 22 GLY H . . 4.830 4.257 3.804 4.635 . 0 0 "[ . 1 . 2]" 1
516 1 21 ARG HB3 1 66 LEU MD1 . . 3.880 3.572 3.038 4.008 0.128 11 0 "[ . 1 . 2]" 1
517 1 21 ARG HB3 1 66 LEU MD2 . . 3.330 2.844 1.965 3.080 . 0 0 "[ . 1 . 2]" 1
518 1 21 ARG QD 1 66 LEU MD1 . . 4.640 4.433 3.641 4.684 0.044 16 0 "[ . 1 . 2]" 1
519 1 21 ARG QD 1 66 LEU MD2 . . 3.890 3.839 3.133 3.973 0.083 17 0 "[ . 1 . 2]" 1
520 1 21 ARG QG 1 22 GLY H . . 5.060 4.242 4.121 4.389 . 0 0 "[ . 1 . 2]" 1
521 1 21 ARG QG 1 66 LEU MD1 . . 4.550 4.490 3.997 4.608 0.058 16 0 "[ . 1 . 2]" 1
522 1 22 GLY H 1 23 VAL H . . 4.690 4.362 4.193 4.526 . 0 0 "[ . 1 . 2]" 1
523 1 22 GLY H 1 23 VAL QG . . 4.960 4.570 4.319 4.973 0.013 18 0 "[ . 1 . 2]" 1
524 1 22 GLY H 1 66 LEU MD1 . . 4.010 3.632 3.130 4.058 0.048 15 0 "[ . 1 . 2]" 1
525 1 22 GLY H 1 66 LEU MD2 . . 4.610 4.356 3.977 4.785 0.175 11 0 "[ . 1 . 2]" 1
526 1 22 GLY HA2 1 23 VAL H . . 3.420 2.905 2.447 3.165 . 0 0 "[ . 1 . 2]" 1
527 1 22 GLY HA2 1 23 VAL HB . . 5.480 4.974 4.568 5.464 . 0 0 "[ . 1 . 2]" 1
528 1 22 GLY HA2 1 23 VAL QG . . 4.240 3.360 2.984 3.750 . 0 0 "[ . 1 . 2]" 1
529 1 22 GLY HA2 1 66 LEU MD1 . . 4.310 4.109 3.400 4.335 0.025 1 0 "[ . 1 . 2]" 1
530 1 22 GLY HA2 1 66 LEU HG . . 5.000 4.418 3.965 5.045 0.045 11 0 "[ . 1 . 2]" 1
531 1 22 GLY HA3 1 23 VAL H . . 3.360 2.402 2.228 2.809 . 0 0 "[ . 1 . 2]" 1
532 1 22 GLY HA3 1 23 VAL QG . . 4.400 3.839 3.399 4.215 . 0 0 "[ . 1 . 2]" 1
533 1 22 GLY HA3 1 66 LEU MD1 . . 3.710 2.862 2.060 3.100 . 0 0 "[ . 1 . 2]" 1
534 1 22 GLY HA3 1 66 LEU MD2 . . 4.230 2.915 2.103 3.929 . 0 0 "[ . 1 . 2]" 1
535 1 22 GLY HA3 1 66 LEU HG . . 4.690 2.731 2.359 3.311 . 0 0 "[ . 1 . 2]" 1
536 1 23 VAL H 1 23 VAL HB . . 3.490 3.055 2.347 3.682 0.192 6 0 "[ . 1 . 2]" 1
537 1 23 VAL H 1 23 VAL QG . . 3.470 2.382 1.643 3.087 . 0 0 "[ . 1 . 2]" 1
538 1 23 VAL H 1 66 LEU MD1 . . 4.160 3.110 1.932 4.160 . 0 0 "[ . 1 . 2]" 1
539 1 23 VAL H 1 66 LEU MD2 . . 5.060 4.286 3.551 5.060 0.000 16 0 "[ . 1 . 2]" 1
540 1 23 VAL H 1 67 VAL H . . 4.230 2.390 1.760 3.383 . 0 0 "[ . 1 . 2]" 1
541 1 23 VAL H 1 67 VAL HB . . 4.490 3.996 2.861 4.780 0.290 20 0 "[ . 1 . 2]" 1
542 1 23 VAL H 1 67 VAL QG . . 4.680 3.809 2.431 4.446 . 0 0 "[ . 1 . 2]" 1
543 1 23 VAL H 1 70 LEU QD . . 4.880 3.902 2.922 4.491 . 0 0 "[ . 1 . 2]" 1
544 1 23 VAL HA 1 23 VAL QG . . 3.220 2.328 1.986 2.622 . 0 0 "[ . 1 . 2]" 1
545 1 23 VAL HA 1 24 LEU H . . 2.970 2.190 2.182 2.256 . 0 0 "[ . 1 . 2]" 1
546 1 23 VAL HA 1 24 LEU HB2 . . 5.010 4.200 4.037 4.385 . 0 0 "[ . 1 . 2]" 1
547 1 23 VAL HA 1 66 LEU MD1 . . 4.690 3.706 3.203 4.070 . 0 0 "[ . 1 . 2]" 1
548 1 23 VAL HA 1 97 VAL QG . . 4.630 3.713 3.396 4.060 . 0 0 "[ . 1 . 2]" 1
549 1 23 VAL HB 1 70 LEU QD . . 3.880 2.686 1.729 3.666 . 0 0 "[ . 1 . 2]" 1
550 1 23 VAL QG 1 24 LEU H . . 3.510 3.009 2.368 3.439 . 0 0 "[ . 1 . 2]" 1
551 1 23 VAL QG 1 24 LEU HA . . 4.490 3.697 3.563 3.905 . 0 0 "[ . 1 . 2]" 1
552 1 23 VAL QG 1 25 LEU HA . . 4.800 3.899 3.468 4.310 . 0 0 "[ . 1 . 2]" 1
553 1 23 VAL QG 1 25 LEU HB3 . . 5.000 4.690 4.178 5.018 0.018 17 0 "[ . 1 . 2]" 1
554 1 23 VAL QG 1 25 LEU QD . . 3.050 2.022 1.618 2.506 . 0 0 "[ . 1 . 2]" 1
555 1 23 VAL QG 1 25 LEU HG . . 3.660 2.810 2.089 3.857 0.197 12 0 "[ . 1 . 2]" 1
556 1 23 VAL QG 1 67 VAL HB . . 4.320 2.652 1.790 3.674 . 0 0 "[ . 1 . 2]" 1
557 1 23 VAL QG 1 70 LEU HB2 . . 4.230 2.941 2.226 3.992 . 0 0 "[ . 1 . 2]" 1
558 1 23 VAL QG 1 70 LEU HB3 . . 4.910 3.527 3.106 4.382 . 0 0 "[ . 1 . 2]" 1
559 1 23 VAL QG 1 70 LEU QD . . 3.340 1.668 1.536 2.101 . 0 0 "[ . 1 . 2]" 1
560 1 23 VAL QG 1 78 PHE QD . . 4.360 3.625 3.248 4.016 . 0 0 "[ . 1 . 2]" 1
561 1 23 VAL QG 1 78 PHE QE . . 3.600 2.228 1.872 2.590 . 0 0 "[ . 1 . 2]" 1
562 1 23 VAL QG 1 78 PHE HZ . . 3.840 2.325 1.921 2.843 . 0 0 "[ . 1 . 2]" 1
563 1 23 VAL QG 1 97 VAL HB . . 4.890 3.443 3.044 3.775 . 0 0 "[ . 1 . 2]" 1
564 1 23 VAL QG 1 97 VAL QG . . 3.320 1.704 1.524 1.997 . 0 0 "[ . 1 . 2]" 1
565 1 24 LEU H 1 24 LEU HB2 . . 3.700 2.341 2.074 2.581 . 0 0 "[ . 1 . 2]" 1
566 1 24 LEU H 1 24 LEU HB3 . . 3.930 2.868 2.530 3.236 . 0 0 "[ . 1 . 2]" 1
567 1 24 LEU H 1 24 LEU QD . . 4.510 3.709 3.563 3.851 . 0 0 "[ . 1 . 2]" 1
568 1 24 LEU H 1 66 LEU MD1 . . 4.860 3.441 2.879 3.876 . 0 0 "[ . 1 . 2]" 1
569 1 24 LEU HA 1 24 LEU QD . . 2.890 2.122 1.790 2.505 . 0 0 "[ . 1 . 2]" 1
570 1 24 LEU HA 1 24 LEU HG . . 4.080 2.801 2.334 3.440 . 0 0 "[ . 1 . 2]" 1
571 1 24 LEU HA 1 25 LEU H . . 2.780 2.212 2.177 2.343 . 0 0 "[ . 1 . 2]" 1
572 1 24 LEU HA 1 25 LEU QD . . 4.550 3.942 2.921 4.259 . 0 0 "[ . 1 . 2]" 1
573 1 24 LEU HA 1 65 LEU H . . 4.480 3.855 3.510 4.184 . 0 0 "[ . 1 . 2]" 1
574 1 24 LEU HB2 1 66 LEU MD1 . . 4.380 2.968 2.512 3.247 . 0 0 "[ . 1 . 2]" 1
575 1 24 LEU HB3 1 25 LEU H . . 4.740 3.970 3.221 4.459 . 0 0 "[ . 1 . 2]" 1
576 1 24 LEU HB3 1 66 LEU MD1 . . 4.340 4.210 3.964 4.428 0.088 15 0 "[ . 1 . 2]" 1
577 1 24 LEU QD 1 25 LEU H . . 3.370 2.240 1.895 2.859 . 0 0 "[ . 1 . 2]" 1
578 1 24 LEU QD 1 25 LEU QD . . 5.170 4.129 3.761 4.352 . 0 0 "[ . 1 . 2]" 1
579 1 24 LEU QD 1 26 HIS H . . 5.190 4.619 4.191 4.995 . 0 0 "[ . 1 . 2]" 1
580 1 24 LEU QD 1 26 HIS HA . . 5.110 4.202 3.859 4.569 . 0 0 "[ . 1 . 2]" 1
581 1 24 LEU QD 1 26 HIS HD2 . . 5.080 2.477 1.923 3.028 . 0 0 "[ . 1 . 2]" 1
582 1 24 LEU QD 1 26 HIS HE1 . . 4.420 3.944 3.494 4.305 . 0 0 "[ . 1 . 2]" 1
583 1 24 LEU QD 1 27 TRP HH2 . . 5.410 5.307 4.982 5.416 0.006 6 0 "[ . 1 . 2]" 1
584 1 24 LEU QD 1 64 GLU HA . . 4.450 3.814 3.439 4.037 . 0 0 "[ . 1 . 2]" 1
585 1 24 LEU QD 1 64 GLU HB2 . . 3.240 2.153 1.785 2.776 . 0 0 "[ . 1 . 2]" 1
586 1 24 LEU QD 1 64 GLU HB3 . . 3.720 2.941 1.790 3.608 . 0 0 "[ . 1 . 2]" 1
587 1 24 LEU QD 1 64 GLU HG2 . . 3.860 3.499 2.916 3.906 0.046 11 0 "[ . 1 . 2]" 1
588 1 24 LEU QD 1 64 GLU HG3 . . 3.750 3.132 2.432 3.872 0.122 9 0 "[ . 1 . 2]" 1
589 1 24 LEU QD 1 65 LEU H . . 3.590 2.383 2.083 2.592 . 0 0 "[ . 1 . 2]" 1
590 1 24 LEU QD 1 65 LEU HA . . 4.400 3.303 2.991 3.749 . 0 0 "[ . 1 . 2]" 1
591 1 24 LEU QD 1 66 LEU H . . 4.040 3.744 3.337 4.026 . 0 0 "[ . 1 . 2]" 1
592 1 24 LEU QD 1 66 LEU MD1 . . 3.410 2.697 2.130 3.097 . 0 0 "[ . 1 . 2]" 1
593 1 24 LEU HG 1 25 LEU H . . 4.430 4.048 3.529 4.424 . 0 0 "[ . 1 . 2]" 1
594 1 24 LEU HG 1 65 LEU H . . 4.800 4.622 4.012 4.861 0.061 18 0 "[ . 1 . 2]" 1
595 1 25 LEU H 1 25 LEU HB2 . . 3.810 2.529 2.208 2.680 . 0 0 "[ . 1 . 2]" 1
596 1 25 LEU H 1 25 LEU HB3 . . 4.130 3.649 3.488 3.764 . 0 0 "[ . 1 . 2]" 1
597 1 25 LEU H 1 25 LEU QD . . 3.910 3.021 2.196 3.537 . 0 0 "[ . 1 . 2]" 1
598 1 25 LEU H 1 25 LEU HG . . 4.140 2.994 2.133 4.293 0.153 10 0 "[ . 1 . 2]" 1
599 1 25 LEU H 1 27 TRP HZ3 . . 5.500 4.086 3.707 4.343 . 0 0 "[ . 1 . 2]" 1
600 1 25 LEU H 1 64 GLU HA . . 5.340 4.336 3.926 4.627 . 0 0 "[ . 1 . 2]" 1
601 1 25 LEU H 1 65 LEU H . . 3.700 2.383 2.022 2.625 . 0 0 "[ . 1 . 2]" 1
602 1 25 LEU H 1 65 LEU QB . . 4.620 4.107 3.633 4.473 . 0 0 "[ . 1 . 2]" 1
603 1 25 LEU H 1 66 LEU H . . 5.210 4.956 4.779 5.217 0.007 14 0 "[ . 1 . 2]" 1
604 1 25 LEU HA 1 25 LEU QD . . 3.170 2.220 1.804 2.596 . 0 0 "[ . 1 . 2]" 1
605 1 25 LEU HA 1 25 LEU HG . . 3.850 3.084 2.916 3.535 . 0 0 "[ . 1 . 2]" 1
606 1 25 LEU HA 1 26 HIS H . . 3.010 2.194 2.177 2.224 . 0 0 "[ . 1 . 2]" 1
607 1 25 LEU HB2 1 26 HIS H . . 4.580 4.280 3.991 4.567 . 0 0 "[ . 1 . 2]" 1
608 1 25 LEU HB2 1 27 TRP HE3 . . 4.420 3.204 2.885 3.585 . 0 0 "[ . 1 . 2]" 1
609 1 25 LEU HB2 1 27 TRP HH2 . . 4.860 4.831 4.562 4.965 0.105 6 0 "[ . 1 . 2]" 1
610 1 25 LEU HB2 1 27 TRP HZ3 . . 3.840 2.497 2.191 2.648 . 0 0 "[ . 1 . 2]" 1
611 1 25 LEU HB2 1 65 LEU H . . 4.280 2.952 2.641 3.220 . 0 0 "[ . 1 . 2]" 1
612 1 25 LEU HB3 1 26 HIS H . . 4.060 3.454 3.176 3.768 . 0 0 "[ . 1 . 2]" 1
613 1 25 LEU HB3 1 27 TRP HE3 . . 4.340 3.036 2.537 3.315 . 0 0 "[ . 1 . 2]" 1
614 1 25 LEU HB3 1 27 TRP HZ3 . . 4.070 3.622 2.897 3.812 . 0 0 "[ . 1 . 2]" 1
615 1 25 LEU HB3 1 65 LEU H . . 4.430 4.413 3.942 4.621 0.191 6 0 "[ . 1 . 2]" 1
616 1 25 LEU QD 1 26 HIS H . . 4.030 3.684 3.222 3.982 . 0 0 "[ . 1 . 2]" 1
617 1 25 LEU QD 1 27 TRP HE3 . . 4.810 4.048 3.727 4.415 . 0 0 "[ . 1 . 2]" 1
618 1 25 LEU QD 1 27 TRP HZ3 . . 4.270 3.466 3.034 3.899 . 0 0 "[ . 1 . 2]" 1
619 1 25 LEU QD 1 42 LEU QD . . 2.990 1.774 1.529 2.356 . 0 0 "[ . 1 . 2]" 1
620 1 25 LEU QD 1 42 LEU HG . . 3.240 2.708 1.799 3.392 0.152 4 0 "[ . 1 . 2]" 1
621 1 25 LEU QD 1 65 LEU H . . 5.030 3.910 3.394 4.334 . 0 0 "[ . 1 . 2]" 1
622 1 25 LEU QD 1 65 LEU QB . . 3.840 3.175 2.592 3.831 . 0 0 "[ . 1 . 2]" 1
623 1 25 LEU QD 1 65 LEU QD . . 3.870 2.974 2.144 3.524 . 0 0 "[ . 1 . 2]" 1
624 1 25 LEU QD 1 67 VAL QG . . 3.110 1.839 1.664 2.361 . 0 0 "[ . 1 . 2]" 1
625 1 25 LEU QD 1 78 PHE H . . 5.500 4.924 4.633 5.277 . 0 0 "[ . 1 . 2]" 1
626 1 25 LEU QD 1 78 PHE HB2 . . 3.880 2.865 2.463 3.286 . 0 0 "[ . 1 . 2]" 1
627 1 25 LEU QD 1 78 PHE HB3 . . 4.010 2.644 2.360 3.138 . 0 0 "[ . 1 . 2]" 1
628 1 25 LEU QD 1 78 PHE QD . . 3.590 2.283 2.104 2.436 . 0 0 "[ . 1 . 2]" 1
629 1 25 LEU QD 1 78 PHE QE . . 4.270 2.604 2.343 2.934 . 0 0 "[ . 1 . 2]" 1
630 1 25 LEU QD 1 79 ARG H . . 5.250 4.526 4.101 4.930 . 0 0 "[ . 1 . 2]" 1
631 1 25 LEU QD 1 80 LEU QD . . 4.080 3.696 3.435 4.025 . 0 0 "[ . 1 . 2]" 1
632 1 25 LEU HG 1 67 VAL QG . . 3.780 3.316 2.047 3.949 0.169 12 0 "[ . 1 . 2]" 1
633 1 26 HIS H 1 26 HIS HB2 . . 4.050 2.767 2.620 2.993 . 0 0 "[ . 1 . 2]" 1
634 1 26 HIS H 1 26 HIS HB3 . . 3.910 3.724 3.635 3.799 . 0 0 "[ . 1 . 2]" 1
635 1 26 HIS H 1 27 TRP H . . 4.780 4.358 4.165 4.500 . 0 0 "[ . 1 . 2]" 1
636 1 26 HIS H 1 27 TRP HB3 . . 5.460 5.021 4.819 5.227 . 0 0 "[ . 1 . 2]" 1
637 1 26 HIS H 1 27 TRP HE3 . . 4.640 4.334 4.035 4.600 . 0 0 "[ . 1 . 2]" 1
638 1 26 HIS HA 1 26 HIS HD2 . . 5.200 2.764 2.611 2.974 . 0 0 "[ . 1 . 2]" 1
639 1 26 HIS HA 1 27 TRP H . . 2.980 2.195 2.186 2.211 . 0 0 "[ . 1 . 2]" 1
640 1 26 HIS HA 1 27 TRP HE3 . . 4.000 3.754 3.318 3.915 . 0 0 "[ . 1 . 2]" 1
641 1 26 HIS HA 1 27 TRP HZ3 . . 4.970 4.829 4.286 5.026 0.056 9 0 "[ . 1 . 2]" 1
642 1 26 HIS HA 1 63 THR HA . . 5.280 5.323 5.198 5.408 0.128 4 0 "[ . 1 . 2]" 1
643 1 26 HIS HA 1 63 THR HB . . 4.770 4.813 4.678 4.903 0.133 10 0 "[ . 1 . 2]" 1
644 1 26 HIS HA 1 64 GLU H . . 5.500 5.041 4.863 5.200 . 0 0 "[ . 1 . 2]" 1
645 1 26 HIS HA 1 64 GLU HA . . 3.270 2.870 2.586 3.022 . 0 0 "[ . 1 . 2]" 1
646 1 26 HIS HA 1 64 GLU HB2 . . 4.680 3.668 3.200 4.793 0.113 6 0 "[ . 1 . 2]" 1
647 1 26 HIS HA 1 64 GLU HB3 . . 4.190 2.415 1.981 3.868 . 0 0 "[ . 1 . 2]" 1
648 1 26 HIS HA 1 64 GLU HG2 . . 4.760 4.386 2.683 4.902 0.142 13 0 "[ . 1 . 2]" 1
649 1 26 HIS HA 1 64 GLU HG3 . . 4.980 4.330 1.869 5.020 0.040 20 0 "[ . 1 . 2]" 1
650 1 26 HIS HA 1 65 LEU H . . 4.400 4.429 4.209 4.547 0.147 20 0 "[ . 1 . 2]" 1
651 1 26 HIS HB2 1 27 TRP H . . 4.290 4.167 3.997 4.359 0.069 12 0 "[ . 1 . 2]" 1
652 1 26 HIS HB3 1 27 TRP H . . 3.970 3.530 3.316 3.763 . 0 0 "[ . 1 . 2]" 1
653 1 26 HIS HB3 1 64 GLU HB3 . . 5.200 3.867 3.391 5.343 0.143 19 0 "[ . 1 . 2]" 1
654 1 26 HIS HD2 1 27 TRP H . . 5.070 4.926 4.749 5.158 0.088 18 0 "[ . 1 . 2]" 1
655 1 26 HIS HD2 1 64 GLU HB3 . . 4.760 2.745 2.357 3.225 . 0 0 "[ . 1 . 2]" 1
656 1 27 TRP H 1 27 TRP HD1 . . 5.390 4.224 4.105 4.360 . 0 0 "[ . 1 . 2]" 1
657 1 27 TRP H 1 27 TRP HE3 . . 4.090 3.254 2.900 3.600 . 0 0 "[ . 1 . 2]" 1
658 1 27 TRP H 1 28 ASP H . . 4.740 4.407 4.376 4.456 . 0 0 "[ . 1 . 2]" 1
659 1 27 TRP H 1 63 THR HA . . 4.440 3.814 3.630 3.924 . 0 0 "[ . 1 . 2]" 1
660 1 27 TRP H 1 63 THR HB . . 3.980 3.849 3.560 4.071 0.091 14 0 "[ . 1 . 2]" 1
661 1 27 TRP H 1 63 THR MG . . 4.820 4.730 4.428 5.000 0.180 13 0 "[ . 1 . 2]" 1
662 1 27 TRP H 1 64 GLU HA . . 4.280 3.256 3.032 3.482 . 0 0 "[ . 1 . 2]" 1
663 1 27 TRP HA 1 27 TRP HD1 . . 4.500 4.356 4.304 4.463 . 0 0 "[ . 1 . 2]" 1
664 1 27 TRP HA 1 28 ASP H . . 3.150 2.627 2.554 2.656 . 0 0 "[ . 1 . 2]" 1
665 1 27 TRP HA 1 28 ASP HA . . 5.280 4.395 4.369 4.414 . 0 0 "[ . 1 . 2]" 1
666 1 27 TRP HB2 1 28 ASP H . . 3.780 2.276 2.227 2.394 . 0 0 "[ . 1 . 2]" 1
667 1 27 TRP HB3 1 28 ASP H . . 3.980 3.745 3.715 3.813 . 0 0 "[ . 1 . 2]" 1
668 1 27 TRP HB3 1 80 LEU QD . . 5.160 2.563 2.236 3.334 . 0 0 "[ . 1 . 2]" 1
669 1 27 TRP HD1 1 28 ASP H . . 4.730 3.062 2.932 3.250 . 0 0 "[ . 1 . 2]" 1
670 1 27 TRP HD1 1 28 ASP HA . . 4.990 3.669 3.557 3.996 . 0 0 "[ . 1 . 2]" 1
671 1 27 TRP HD1 1 29 PRO HA . . 3.660 3.681 3.563 3.754 0.094 10 0 "[ . 1 . 2]" 1
672 1 27 TRP HD1 1 29 PRO HB3 . . 5.340 4.988 4.851 5.119 . 0 0 "[ . 1 . 2]" 1
673 1 27 TRP HD1 1 29 PRO HD3 . . 5.450 4.427 4.247 4.689 . 0 0 "[ . 1 . 2]" 1
674 1 27 TRP HD1 1 40 TYR QE . . 4.940 4.118 3.786 4.498 . 0 0 "[ . 1 . 2]" 1
675 1 27 TRP HD1 1 40 TYR HH . . 5.170 3.905 3.624 4.209 . 0 0 "[ . 1 . 2]" 1
676 1 27 TRP HD1 1 63 THR HA . . 4.960 3.361 3.029 3.786 . 0 0 "[ . 1 . 2]" 1
677 1 27 TRP HD1 1 63 THR MG . . 4.660 4.053 3.763 4.321 . 0 0 "[ . 1 . 2]" 1
678 1 27 TRP HD1 1 80 LEU QD . . 4.130 3.211 2.959 3.441 . 0 0 "[ . 1 . 2]" 1
679 1 27 TRP HE1 1 29 PRO HA . . 4.680 4.576 4.287 4.745 0.065 11 0 "[ . 1 . 2]" 1
680 1 27 TRP HE1 1 29 PRO HB3 . . 5.320 4.969 4.655 5.157 . 0 0 "[ . 1 . 2]" 1
681 1 27 TRP HE1 1 30 PRO HD3 . . 5.480 5.150 4.763 5.363 . 0 0 "[ . 1 . 2]" 1
682 1 27 TRP HE1 1 40 TYR QD . . 4.470 4.102 3.838 4.400 . 0 0 "[ . 1 . 2]" 1
683 1 27 TRP HE1 1 40 TYR QE . . 4.020 3.511 3.298 3.745 . 0 0 "[ . 1 . 2]" 1
684 1 27 TRP HE1 1 40 TYR HH . . 3.440 3.286 3.058 3.476 0.036 17 0 "[ . 1 . 2]" 1
685 1 27 TRP HE1 1 58 VAL MG1 . . 5.350 4.290 4.092 4.518 . 0 0 "[ . 1 . 2]" 1
686 1 27 TRP HE1 1 62 GLU HB2 . . 5.030 4.500 3.790 4.927 . 0 0 "[ . 1 . 2]" 1
687 1 27 TRP HE1 1 63 THR HA . . 3.770 2.517 2.364 2.843 . 0 0 "[ . 1 . 2]" 1
688 1 27 TRP HE1 1 63 THR HB . . 5.460 5.114 4.904 5.475 0.015 18 0 "[ . 1 . 2]" 1
689 1 27 TRP HE1 1 63 THR MG . . 4.490 3.587 3.215 3.838 . 0 0 "[ . 1 . 2]" 1
690 1 27 TRP HE1 1 80 LEU QD . . 4.390 3.202 2.951 3.467 . 0 0 "[ . 1 . 2]" 1
691 1 27 TRP HE3 1 80 LEU QD . . 4.720 2.590 2.306 3.477 . 0 0 "[ . 1 . 2]" 1
692 1 27 TRP HH2 1 58 VAL MG1 . . 3.860 2.656 2.336 2.962 . 0 0 "[ . 1 . 2]" 1
693 1 27 TRP HH2 1 58 VAL MG2 . . 4.570 4.127 3.724 4.400 . 0 0 "[ . 1 . 2]" 1
694 1 27 TRP HH2 1 62 GLU HB2 . . 5.060 4.282 3.569 4.676 . 0 0 "[ . 1 . 2]" 1
695 1 27 TRP HH2 1 62 GLU HB3 . . 5.490 3.339 2.982 4.877 . 0 0 "[ . 1 . 2]" 1
696 1 27 TRP HH2 1 64 GLU H . . 5.180 3.303 3.133 3.568 . 0 0 "[ . 1 . 2]" 1
697 1 27 TRP HH2 1 64 GLU HA . . 5.480 3.454 3.295 4.025 . 0 0 "[ . 1 . 2]" 1
698 1 27 TRP HH2 1 65 LEU H . . 5.250 3.806 3.548 4.344 . 0 0 "[ . 1 . 2]" 1
699 1 27 TRP HH2 1 65 LEU HA . . 4.470 3.722 3.453 3.903 . 0 0 "[ . 1 . 2]" 1
700 1 27 TRP HH2 1 65 LEU QB . . 3.260 1.908 1.805 2.007 . 0 0 "[ . 1 . 2]" 1
701 1 27 TRP HH2 1 65 LEU QD . . 3.960 3.203 3.119 3.288 . 0 0 "[ . 1 . 2]" 1
702 1 27 TRP HH2 1 65 LEU HG . . 4.820 4.607 2.901 4.882 0.062 16 0 "[ . 1 . 2]" 1
703 1 27 TRP HH2 1 80 LEU QD . . 4.530 3.445 3.187 3.943 . 0 0 "[ . 1 . 2]" 1
704 1 27 TRP HZ2 1 40 TYR QD . . 4.450 4.150 3.793 4.454 0.004 15 0 "[ . 1 . 2]" 1
705 1 27 TRP HZ2 1 40 TYR QE . . 4.820 4.701 4.307 4.891 0.071 17 0 "[ . 1 . 2]" 1
706 1 27 TRP HZ2 1 58 VAL HB . . 5.500 4.886 4.669 5.267 . 0 0 "[ . 1 . 2]" 1
707 1 27 TRP HZ2 1 58 VAL MG1 . . 3.040 2.511 2.385 2.788 . 0 0 "[ . 1 . 2]" 1
708 1 27 TRP HZ2 1 58 VAL MG2 . . 4.830 4.818 4.706 4.910 0.080 15 0 "[ . 1 . 2]" 1
709 1 27 TRP HZ2 1 62 GLU H . . 4.900 4.248 3.852 4.574 . 0 0 "[ . 1 . 2]" 1
710 1 27 TRP HZ2 1 62 GLU HA . . 5.030 4.376 4.012 4.556 . 0 0 "[ . 1 . 2]" 1
711 1 27 TRP HZ2 1 62 GLU HB2 . . 4.030 2.722 1.975 3.105 . 0 0 "[ . 1 . 2]" 1
712 1 27 TRP HZ2 1 62 GLU HB3 . . 4.210 2.248 1.974 3.572 . 0 0 "[ . 1 . 2]" 1
713 1 27 TRP HZ2 1 62 GLU HG2 . . 5.210 4.866 2.911 5.245 0.035 6 0 "[ . 1 . 2]" 1
714 1 27 TRP HZ2 1 62 GLU HG3 . . 4.810 4.398 3.858 4.745 . 0 0 "[ . 1 . 2]" 1
715 1 27 TRP HZ2 1 63 THR H . . 5.450 3.885 3.627 4.170 . 0 0 "[ . 1 . 2]" 1
716 1 27 TRP HZ2 1 63 THR HA . . 3.950 3.648 3.310 3.867 . 0 0 "[ . 1 . 2]" 1
717 1 27 TRP HZ2 1 63 THR MG . . 4.980 4.924 4.650 5.089 0.109 15 0 "[ . 1 . 2]" 1
718 1 27 TRP HZ2 1 64 GLU H . . 4.440 3.084 2.724 3.483 . 0 0 "[ . 1 . 2]" 1
719 1 27 TRP HZ2 1 65 LEU QB . . 4.300 4.093 3.881 4.214 . 0 0 "[ . 1 . 2]" 1
720 1 27 TRP HZ2 1 80 LEU QD . . 4.210 3.289 3.089 3.472 . 0 0 "[ . 1 . 2]" 1
721 1 27 TRP HZ3 1 64 GLU HA . . 4.670 2.601 2.457 3.257 . 0 0 "[ . 1 . 2]" 1
722 1 27 TRP HZ3 1 65 LEU H . . 4.090 2.682 2.345 3.261 . 0 0 "[ . 1 . 2]" 1
723 1 27 TRP HZ3 1 65 LEU QB . . 4.200 2.145 1.835 2.424 . 0 0 "[ . 1 . 2]" 1
724 1 27 TRP HZ3 1 65 LEU QD . . 5.500 3.559 3.276 3.812 . 0 0 "[ . 1 . 2]" 1
725 1 28 ASP H 1 28 ASP HB2 . . 3.750 2.382 2.324 2.430 . 0 0 "[ . 1 . 2]" 1
726 1 28 ASP H 1 28 ASP HB3 . . 4.040 3.336 3.290 3.393 . 0 0 "[ . 1 . 2]" 1
727 1 28 ASP HA 1 29 PRO HD2 . . 3.070 2.697 2.646 2.759 . 0 0 "[ . 1 . 2]" 1
728 1 28 ASP HA 1 29 PRO HD3 . . 2.980 2.023 2.003 2.053 . 0 0 "[ . 1 . 2]" 1
729 1 28 ASP HA 1 29 PRO QG . . 4.170 3.965 3.942 3.994 . 0 0 "[ . 1 . 2]" 1
730 1 28 ASP HA 1 63 THR HB . . 4.970 4.240 3.694 4.648 . 0 0 "[ . 1 . 2]" 1
731 1 28 ASP HA 1 63 THR MG . . 4.080 3.290 3.070 3.586 . 0 0 "[ . 1 . 2]" 1
732 1 28 ASP HB2 1 29 PRO HD2 . . 4.130 4.102 4.005 4.185 0.055 6 0 "[ . 1 . 2]" 1
733 1 28 ASP HB2 1 29 PRO HD3 . . 4.590 4.563 4.505 4.608 0.018 6 0 "[ . 1 . 2]" 1
734 1 28 ASP HB3 1 29 PRO HD2 . . 3.590 2.773 2.627 2.915 . 0 0 "[ . 1 . 2]" 1
735 1 28 ASP HB3 1 29 PRO HD3 . . 3.960 3.728 3.618 3.834 . 0 0 "[ . 1 . 2]" 1
736 1 28 ASP HB3 1 29 PRO QG . . 4.660 4.488 4.369 4.603 . 0 0 "[ . 1 . 2]" 1
737 1 29 PRO HA 1 30 PRO HD2 . . 3.280 2.567 2.470 2.665 . 0 0 "[ . 1 . 2]" 1
738 1 29 PRO HA 1 30 PRO HD3 . . 3.060 1.961 1.938 1.997 . 0 0 "[ . 1 . 2]" 1
739 1 29 PRO HA 1 30 PRO HG2 . . 4.770 4.529 4.464 4.599 . 0 0 "[ . 1 . 2]" 1
740 1 29 PRO HA 1 30 PRO HG3 . . 4.700 4.218 4.195 4.251 . 0 0 "[ . 1 . 2]" 1
741 1 29 PRO HA 1 37 LEU QD . . 4.390 3.864 3.596 4.111 . 0 0 "[ . 1 . 2]" 1
742 1 29 PRO HA 1 40 TYR QE . . 4.630 3.693 3.383 3.922 . 0 0 "[ . 1 . 2]" 1
743 1 29 PRO HA 1 40 TYR HH . . 4.110 2.451 2.219 2.711 . 0 0 "[ . 1 . 2]" 1
744 1 29 PRO HA 1 63 THR MG . . 4.910 4.374 4.141 4.488 . 0 0 "[ . 1 . 2]" 1
745 1 29 PRO HB2 1 30 PRO HD2 . . 3.830 2.906 2.664 3.152 . 0 0 "[ . 1 . 2]" 1
746 1 29 PRO HB2 1 30 PRO HD3 . . 4.090 3.836 3.652 4.018 . 0 0 "[ . 1 . 2]" 1
747 1 29 PRO HB2 1 37 LEU QD . . 4.450 4.335 4.243 4.436 . 0 0 "[ . 1 . 2]" 1
748 1 29 PRO HB2 1 40 TYR HH . . 4.580 4.062 3.843 4.296 . 0 0 "[ . 1 . 2]" 1
749 1 29 PRO HB2 1 63 THR MG . . 5.040 4.697 4.549 4.894 . 0 0 "[ . 1 . 2]" 1
750 1 29 PRO HB3 1 30 PRO HD2 . . 3.790 3.178 3.044 3.323 . 0 0 "[ . 1 . 2]" 1
751 1 29 PRO HB3 1 30 PRO HD3 . . 4.030 3.682 3.536 3.831 . 0 0 "[ . 1 . 2]" 1
752 1 29 PRO HB3 1 37 LEU QD . . 4.260 4.163 4.029 4.239 . 0 0 "[ . 1 . 2]" 1
753 1 29 PRO HB3 1 40 TYR HH . . 4.010 2.882 2.621 3.098 . 0 0 "[ . 1 . 2]" 1
754 1 29 PRO HB3 1 63 THR MG . . 4.690 3.503 3.333 3.699 . 0 0 "[ . 1 . 2]" 1
755 1 29 PRO HD2 1 63 THR MG . . 3.840 3.883 3.708 3.972 0.132 11 0 "[ . 1 . 2]" 1
756 1 29 PRO HD3 1 63 THR MG . . 3.520 2.333 2.188 2.420 . 0 0 "[ . 1 . 2]" 1
757 1 29 PRO QG 1 30 PRO HD2 . . 5.060 4.619 4.457 4.777 . 0 0 "[ . 1 . 2]" 1
758 1 29 PRO QG 1 30 PRO HD3 . . 5.140 5.027 4.948 5.100 . 0 0 "[ . 1 . 2]" 1
759 1 29 PRO QG 1 40 TYR HH . . 4.710 4.662 4.463 4.805 0.095 12 0 "[ . 1 . 2]" 1
760 1 29 PRO QG 1 63 THR MG . . 3.580 2.746 2.576 2.971 . 0 0 "[ . 1 . 2]" 1
761 1 30 PRO HA 1 31 GLU H . . 3.060 2.159 2.148 2.210 . 0 0 "[ . 1 . 2]" 1
762 1 30 PRO HA 1 31 GLU QB . . 4.150 4.050 4.032 4.063 . 0 0 "[ . 1 . 2]" 1
763 1 30 PRO HA 1 32 LEU H . . 4.460 3.571 3.278 4.171 . 0 0 "[ . 1 . 2]" 1
764 1 30 PRO HA 1 33 VAL QG . . 4.720 4.378 4.106 4.553 . 0 0 "[ . 1 . 2]" 1
765 1 30 PRO HB2 1 31 GLU H . . 4.430 3.839 3.380 4.024 . 0 0 "[ . 1 . 2]" 1
766 1 30 PRO HB2 1 32 LEU H . . 4.580 3.284 2.832 3.811 . 0 0 "[ . 1 . 2]" 1
767 1 30 PRO HB2 1 33 VAL QG . . 3.770 2.840 2.455 3.026 . 0 0 "[ . 1 . 2]" 1
768 1 30 PRO HB3 1 32 LEU H . . 4.690 4.253 3.891 4.749 0.059 17 0 "[ . 1 . 2]" 1
769 1 30 PRO HD2 1 33 VAL QG . . 4.070 3.749 3.416 3.966 . 0 0 "[ . 1 . 2]" 1
770 1 30 PRO HD2 1 37 LEU QD . . 3.610 2.215 1.957 2.456 . 0 0 "[ . 1 . 2]" 1
771 1 30 PRO HD2 1 40 TYR QE . . 4.460 3.750 3.330 4.025 . 0 0 "[ . 1 . 2]" 1
772 1 30 PRO HD2 1 40 TYR HH . . 4.770 2.888 2.589 3.216 . 0 0 "[ . 1 . 2]" 1
773 1 30 PRO HD2 1 82 ALA MB . . 4.950 4.259 4.044 4.439 . 0 0 "[ . 1 . 2]" 1
774 1 30 PRO HD3 1 37 LEU QD . . 3.890 2.686 2.261 3.166 . 0 0 "[ . 1 . 2]" 1
775 1 30 PRO HD3 1 40 TYR QE . . 4.160 2.420 2.083 2.631 . 0 0 "[ . 1 . 2]" 1
776 1 30 PRO HD3 1 40 TYR HH . . 4.750 2.469 2.079 2.797 . 0 0 "[ . 1 . 2]" 1
777 1 30 PRO HD3 1 82 ALA MB . . 4.700 3.465 3.280 3.619 . 0 0 "[ . 1 . 2]" 1
778 1 30 PRO HG2 1 33 VAL QG . . 4.380 2.902 2.437 3.096 . 0 0 "[ . 1 . 2]" 1
779 1 30 PRO HG2 1 37 LEU QD . . 3.950 1.899 1.792 2.103 . 0 0 "[ . 1 . 2]" 1
780 1 30 PRO HG2 1 82 ALA MB . . 3.470 3.388 3.111 3.569 0.099 10 0 "[ . 1 . 2]" 1
781 1 30 PRO HG3 1 33 VAL QG . . 4.500 4.159 3.710 4.370 . 0 0 "[ . 1 . 2]" 1
782 1 30 PRO HG3 1 37 LEU QD . . 4.540 2.184 1.807 2.800 . 0 0 "[ . 1 . 2]" 1
783 1 30 PRO HG3 1 82 ALA H . . 5.500 4.967 4.556 5.292 . 0 0 "[ . 1 . 2]" 1
784 1 30 PRO HG3 1 82 ALA MB . . 4.570 2.331 2.082 2.458 . 0 0 "[ . 1 . 2]" 1
785 1 31 GLU H 1 31 GLU QB . . 3.420 2.209 2.172 2.232 . 0 0 "[ . 1 . 2]" 1
786 1 31 GLU H 1 31 GLU HG2 . . 5.140 4.476 4.267 4.584 . 0 0 "[ . 1 . 2]" 1
787 1 31 GLU H 1 31 GLU HG3 . . 4.920 4.360 4.325 4.388 . 0 0 "[ . 1 . 2]" 1
788 1 31 GLU HA 1 31 GLU HG2 . . 3.660 3.706 3.574 3.806 0.146 18 0 "[ . 1 . 2]" 1
789 1 31 GLU HA 1 31 GLU HG3 . . 4.020 2.552 2.420 2.798 . 0 0 "[ . 1 . 2]" 1
790 1 31 GLU QB 1 32 LEU H . . 3.770 2.934 2.504 3.318 . 0 0 "[ . 1 . 2]" 1
791 1 31 GLU QB 1 32 LEU HA . . 4.920 4.427 4.278 4.604 . 0 0 "[ . 1 . 2]" 1
792 1 31 GLU QB 1 32 LEU QD . . 4.510 3.943 1.973 4.278 . 0 0 "[ . 1 . 2]" 1
793 1 31 GLU QB 1 32 LEU HG . . 4.120 3.938 3.681 4.341 0.221 5 0 "[ . 1 . 2]" 1
794 1 31 GLU HG2 1 32 LEU H . . 5.030 4.382 3.880 4.956 . 0 0 "[ . 1 . 2]" 1
795 1 31 GLU HG2 1 32 LEU QD . . 4.430 3.688 2.900 3.938 . 0 0 "[ . 1 . 2]" 1
796 1 31 GLU HG2 1 32 LEU HG . . 4.740 3.878 3.104 4.756 0.016 5 0 "[ . 1 . 2]" 1
797 1 31 GLU HG3 1 32 LEU H . . 5.410 4.280 3.823 4.664 . 0 0 "[ . 1 . 2]" 1
798 1 31 GLU HG3 1 32 LEU QD . . 4.010 3.912 3.157 4.219 0.209 15 0 "[ . 1 . 2]" 1
799 1 31 GLU HG3 1 32 LEU HG . . 4.710 4.646 4.442 4.822 0.112 5 0 "[ . 1 . 2]" 1
800 1 32 LEU H 1 32 LEU HB2 . . 3.280 2.257 2.067 2.475 . 0 0 "[ . 1 . 2]" 1
801 1 32 LEU H 1 32 LEU HB3 . . 3.610 3.444 3.302 3.634 0.024 14 0 "[ . 1 . 2]" 1
802 1 32 LEU H 1 32 LEU QD . . 4.540 3.497 2.273 3.758 . 0 0 "[ . 1 . 2]" 1
803 1 32 LEU H 1 32 LEU HG . . 3.920 3.568 3.279 3.954 0.034 5 0 "[ . 1 . 2]" 1
804 1 32 LEU H 1 33 VAL H . . 4.800 4.146 3.751 4.467 . 0 0 "[ . 1 . 2]" 1
805 1 32 LEU H 1 33 VAL QG . . 4.540 3.475 3.201 3.679 . 0 0 "[ . 1 . 2]" 1
806 1 32 LEU HA 1 32 LEU QD . . 3.290 1.965 1.828 2.759 . 0 0 "[ . 1 . 2]" 1
807 1 32 LEU HA 1 33 VAL H . . 2.730 2.232 2.176 2.352 . 0 0 "[ . 1 . 2]" 1
808 1 32 LEU HA 1 33 VAL QG . . 4.270 3.394 3.248 3.489 . 0 0 "[ . 1 . 2]" 1
809 1 32 LEU HB2 1 33 VAL H . . 4.710 4.649 4.588 4.702 . 0 0 "[ . 1 . 2]" 1
810 1 32 LEU HB3 1 33 VAL H . . 4.240 3.984 3.762 4.245 0.005 8 0 "[ . 1 . 2]" 1
811 1 32 LEU QD 1 33 VAL H . . 4.160 3.277 2.705 4.378 0.218 5 0 "[ . 1 . 2]" 1
812 1 33 VAL H 1 33 VAL HB . . 3.610 3.216 2.859 3.686 0.076 3 0 "[ . 1 . 2]" 1
813 1 33 VAL H 1 33 VAL QG . . 3.310 2.220 1.890 2.583 . 0 0 "[ . 1 . 2]" 1
814 1 33 VAL H 1 34 PRO HA . . 4.860 4.909 4.764 5.080 0.220 8 0 "[ . 1 . 2]" 1
815 1 33 VAL H 1 34 PRO HD2 . . 5.110 5.000 4.978 5.019 . 0 0 "[ . 1 . 2]" 1
816 1 33 VAL H 1 34 PRO HD3 . . 4.980 4.633 4.534 4.726 . 0 0 "[ . 1 . 2]" 1
817 1 33 VAL HA 1 33 VAL QG . . 3.150 2.293 1.991 2.631 . 0 0 "[ . 1 . 2]" 1
818 1 33 VAL HA 1 34 PRO QB . . 4.810 4.624 4.616 4.641 . 0 0 "[ . 1 . 2]" 1
819 1 33 VAL HA 1 34 PRO HD2 . . 3.300 2.599 2.537 2.712 . 0 0 "[ . 1 . 2]" 1
820 1 33 VAL HA 1 34 PRO HD3 . . 3.110 1.948 1.926 1.994 . 0 0 "[ . 1 . 2]" 1
821 1 33 VAL HA 1 34 PRO HG2 . . 4.550 4.556 4.513 4.637 0.087 3 0 "[ . 1 . 2]" 1
822 1 33 VAL HA 1 34 PRO HG3 . . 4.100 4.219 4.199 4.260 0.160 3 0 "[ . 1 . 2]" 1
823 1 33 VAL HA 1 35 LYS H . . 4.840 3.947 3.737 4.267 . 0 0 "[ . 1 . 2]" 1
824 1 33 VAL HB 1 34 PRO HD2 . . 3.840 3.340 2.774 3.710 . 0 0 "[ . 1 . 2]" 1
825 1 33 VAL HB 1 34 PRO HD3 . . 4.300 3.936 3.287 4.377 0.077 7 0 "[ . 1 . 2]" 1
826 1 33 VAL HB 1 35 LYS H . . 4.030 3.465 2.840 4.140 0.110 10 0 "[ . 1 . 2]" 1
827 1 33 VAL QG 1 34 PRO HA . . 4.550 3.975 3.530 4.364 . 0 0 "[ . 1 . 2]" 1
828 1 33 VAL QG 1 34 PRO QB . . 4.990 4.099 3.887 4.273 . 0 0 "[ . 1 . 2]" 1
829 1 33 VAL QG 1 34 PRO HD2 . . 3.690 1.772 1.740 1.831 . 0 0 "[ . 1 . 2]" 1
830 1 33 VAL QG 1 34 PRO HD3 . . 3.900 2.788 2.478 3.083 . 0 0 "[ . 1 . 2]" 1
831 1 33 VAL QG 1 34 PRO HG2 . . 5.020 3.515 3.450 3.551 . 0 0 "[ . 1 . 2]" 1
832 1 33 VAL QG 1 35 LYS H . . 3.550 1.884 1.749 2.158 . 0 0 "[ . 1 . 2]" 1
833 1 33 VAL QG 1 35 LYS HA . . 4.290 3.630 3.021 4.165 . 0 0 "[ . 1 . 2]" 1
834 1 33 VAL QG 1 36 ARG H . . 3.580 3.528 3.247 3.673 0.093 10 0 "[ . 1 . 2]" 1
835 1 33 VAL QG 1 36 ARG HA . . 3.680 3.009 2.632 3.252 . 0 0 "[ . 1 . 2]" 1
836 1 33 VAL QG 1 37 LEU H . . 3.830 3.610 3.187 3.781 . 0 0 "[ . 1 . 2]" 1
837 1 33 VAL QG 1 37 LEU HA . . 4.200 3.636 3.169 4.060 . 0 0 "[ . 1 . 2]" 1
838 1 33 VAL QG 1 37 LEU HB2 . . 4.280 3.513 2.983 3.971 . 0 0 "[ . 1 . 2]" 1
839 1 33 VAL QG 1 84 ALA MB . . 3.500 3.226 2.896 3.493 . 0 0 "[ . 1 . 2]" 1
840 1 34 PRO HA 1 35 LYS H . . 3.330 3.420 3.344 3.502 0.172 15 0 "[ . 1 . 2]" 1
841 1 34 PRO QB 1 35 LYS H . . 3.630 3.419 3.134 3.630 0.000 6 0 "[ . 1 . 2]" 1
842 1 34 PRO QB 1 84 ALA MB . . 3.980 3.948 3.650 4.114 0.134 11 0 "[ . 1 . 2]" 1
843 1 34 PRO QB 1 87 PHE QD . . 4.710 3.658 2.546 4.401 . 0 0 "[ . 1 . 2]" 1
844 1 34 PRO QB 1 87 PHE QE . . 4.410 3.375 2.426 4.064 . 0 0 "[ . 1 . 2]" 1
845 1 34 PRO HD2 1 35 LYS H . . 3.910 2.347 2.253 2.470 . 0 0 "[ . 1 . 2]" 1
846 1 34 PRO HD2 1 36 ARG H . . 5.160 4.675 4.292 5.090 . 0 0 "[ . 1 . 2]" 1
847 1 34 PRO HD2 1 84 ALA MB . . 3.650 2.981 2.748 3.110 . 0 0 "[ . 1 . 2]" 1
848 1 34 PRO HD3 1 35 LYS H . . 4.710 3.685 3.659 3.720 . 0 0 "[ . 1 . 2]" 1
849 1 34 PRO HD3 1 84 ALA MB . . 4.250 3.774 3.467 4.088 . 0 0 "[ . 1 . 2]" 1
850 1 34 PRO HG2 1 35 LYS H . . 4.140 3.187 2.767 3.531 . 0 0 "[ . 1 . 2]" 1
851 1 34 PRO HG2 1 84 ALA MB . . 3.470 2.411 2.138 2.622 . 0 0 "[ . 1 . 2]" 1
852 1 34 PRO HG2 1 87 PHE QD . . 4.640 3.575 2.427 4.281 . 0 0 "[ . 1 . 2]" 1
853 1 34 PRO HG2 1 87 PHE QE . . 4.900 4.495 3.659 4.918 0.018 2 0 "[ . 1 . 2]" 1
854 1 34 PRO HG3 1 35 LYS H . . 4.810 4.308 4.036 4.533 . 0 0 "[ . 1 . 2]" 1
855 1 34 PRO HG3 1 87 PHE HB3 . . 5.320 3.664 3.156 4.144 . 0 0 "[ . 1 . 2]" 1
856 1 34 PRO HG3 1 87 PHE QD . . 4.520 2.973 1.977 3.876 . 0 0 "[ . 1 . 2]" 1
857 1 35 LYS H 1 35 LYS HG2 . . 4.710 4.409 3.745 4.727 0.017 17 0 "[ . 1 . 2]" 1
858 1 35 LYS H 1 35 LYS HG3 . . 4.380 4.256 3.637 4.744 0.364 4 0 "[ . 1 . 2]" 1
859 1 35 LYS H 1 36 ARG H . . 3.890 3.279 3.111 3.455 . 0 0 "[ . 1 . 2]" 1
860 1 35 LYS H 1 84 ALA MB . . 4.190 3.951 3.443 4.282 0.092 4 0 "[ . 1 . 2]" 1
861 1 35 LYS HA 1 35 LYS QD . . 4.050 3.706 2.998 3.981 . 0 0 "[ . 1 . 2]" 1
862 1 35 LYS HA 1 35 LYS HG2 . . 4.260 2.375 2.022 3.772 . 0 0 "[ . 1 . 2]" 1
863 1 35 LYS HA 1 35 LYS HG3 . . 4.070 2.854 2.457 3.480 . 0 0 "[ . 1 . 2]" 1
864 1 35 LYS HB2 1 35 LYS QE . . 4.530 3.390 2.397 4.327 . 0 0 "[ . 1 . 2]" 1
865 1 35 LYS HB2 1 36 ARG H . . 3.550 2.646 2.193 3.572 0.022 18 0 "[ . 1 . 2]" 1
866 1 35 LYS HB3 1 35 LYS QE . . 4.080 3.351 2.302 4.036 . 0 0 "[ . 1 . 2]" 1
867 1 35 LYS HB3 1 36 ARG H . . 3.280 1.991 1.911 2.258 . 0 0 "[ . 1 . 2]" 1
868 1 35 LYS HG2 1 36 ARG H . . 4.420 4.000 1.949 4.556 0.136 4 0 "[ . 1 . 2]" 1
869 1 35 LYS HG3 1 36 ARG H . . 4.720 4.324 2.672 4.686 . 0 0 "[ . 1 . 2]" 1
870 1 36 ARG H 1 36 ARG QB . . 3.150 2.675 2.280 3.052 . 0 0 "[ . 1 . 2]" 1
871 1 36 ARG H 1 36 ARG QD . . 4.930 4.291 3.384 4.827 . 0 0 "[ . 1 . 2]" 1
872 1 36 ARG H 1 36 ARG QG . . 3.640 2.821 1.943 3.863 0.223 20 0 "[ . 1 . 2]" 1
873 1 36 ARG H 1 84 ALA MB . . 4.150 3.708 3.276 4.113 . 0 0 "[ . 1 . 2]" 1
874 1 36 ARG HA 1 36 ARG QG . . 3.310 2.855 2.039 3.338 0.028 3 0 "[ . 1 . 2]" 1
875 1 36 ARG HA 1 37 LEU H . . 2.630 2.430 2.296 2.643 0.013 7 0 "[ . 1 . 2]" 1
876 1 36 ARG HA 1 37 LEU HB2 . . 4.660 4.181 4.127 4.251 . 0 0 "[ . 1 . 2]" 1
877 1 36 ARG QB 1 36 ARG QD . . 3.130 2.124 1.996 2.307 . 0 0 "[ . 1 . 2]" 1
878 1 36 ARG QB 1 36 ARG QG . . 2.400 2.109 2.050 2.134 . 0 0 "[ . 1 . 2]" 1
879 1 36 ARG QB 1 37 LEU H . . 3.740 2.790 2.185 3.668 . 0 0 "[ . 1 . 2]" 1
880 1 36 ARG QB 1 37 LEU HA . . 5.030 4.558 4.129 5.012 . 0 0 "[ . 1 . 2]" 1
881 1 36 ARG QD 1 37 LEU H . . 5.080 4.146 1.908 5.091 0.011 4 0 "[ . 1 . 2]" 1
882 1 36 ARG QG 1 37 LEU H . . 3.890 3.406 2.104 3.888 . 0 0 "[ . 1 . 2]" 1
883 1 37 LEU H 1 37 LEU HB2 . . 3.550 2.199 2.088 2.400 . 0 0 "[ . 1 . 2]" 1
884 1 37 LEU H 1 37 LEU HB3 . . 3.320 2.909 2.778 3.028 . 0 0 "[ . 1 . 2]" 1
885 1 37 LEU H 1 37 LEU QD . . 3.830 3.516 3.402 3.633 . 0 0 "[ . 1 . 2]" 1
886 1 37 LEU HA 1 37 LEU HB3 . . 2.970 2.948 2.910 2.983 0.013 16 0 "[ . 1 . 2]" 1
887 1 37 LEU HA 1 37 LEU QD . . 3.280 2.369 1.801 2.919 . 0 0 "[ . 1 . 2]" 1
888 1 37 LEU HA 1 37 LEU HG . . 4.050 2.824 2.077 3.648 . 0 0 "[ . 1 . 2]" 1
889 1 37 LEU HA 1 38 ASP H . . 2.930 2.196 2.176 2.223 . 0 0 "[ . 1 . 2]" 1
890 1 37 LEU HA 1 38 ASP HB2 . . 4.830 4.231 4.115 4.391 . 0 0 "[ . 1 . 2]" 1
891 1 37 LEU HA 1 39 GLY H . . 4.060 3.634 3.473 3.810 . 0 0 "[ . 1 . 2]" 1
892 1 37 LEU HA 1 84 ALA HA . . 4.000 3.729 3.266 4.018 0.018 15 0 "[ . 1 . 2]" 1
893 1 37 LEU HA 1 84 ALA MB . . 3.010 2.918 2.529 3.104 0.094 16 0 "[ . 1 . 2]" 1
894 1 37 LEU HB2 1 37 LEU QD . . 3.270 2.078 1.925 2.202 . 0 0 "[ . 1 . 2]" 1
895 1 37 LEU HB2 1 60 GLY HA2 . . 4.480 4.342 3.912 4.535 0.055 4 0 "[ . 1 . 2]" 1
896 1 37 LEU HB2 1 60 GLY HA3 . . 4.590 3.838 3.388 4.123 . 0 0 "[ . 1 . 2]" 1
897 1 37 LEU HB3 1 39 GLY H . . 4.170 3.878 3.244 4.218 0.048 9 0 "[ . 1 . 2]" 1
898 1 37 LEU HB3 1 60 GLY HA2 . . 4.540 2.787 2.381 3.001 . 0 0 "[ . 1 . 2]" 1
899 1 37 LEU HB3 1 60 GLY HA3 . . 4.590 2.160 1.922 2.407 . 0 0 "[ . 1 . 2]" 1
900 1 37 LEU QD 1 38 ASP H . . 3.760 2.697 2.003 3.487 . 0 0 "[ . 1 . 2]" 1
901 1 37 LEU QD 1 39 GLY H . . 4.150 1.971 1.805 2.250 . 0 0 "[ . 1 . 2]" 1
902 1 37 LEU QD 1 40 TYR QD . . 4.670 3.085 2.730 3.383 . 0 0 "[ . 1 . 2]" 1
903 1 37 LEU QD 1 40 TYR QE . . 4.310 2.263 2.003 2.673 . 0 0 "[ . 1 . 2]" 1
904 1 37 LEU QD 1 40 TYR HH . . 4.010 2.845 2.745 3.061 . 0 0 "[ . 1 . 2]" 1
905 1 37 LEU QD 1 60 GLY HA2 . . 4.180 2.559 1.899 3.690 . 0 0 "[ . 1 . 2]" 1
906 1 37 LEU QD 1 60 GLY HA3 . . 4.630 3.046 2.165 3.839 . 0 0 "[ . 1 . 2]" 1
907 1 37 LEU QD 1 82 ALA H . . 5.110 4.544 4.202 4.826 . 0 0 "[ . 1 . 2]" 1
908 1 37 LEU QD 1 82 ALA MB . . 3.180 2.033 1.790 2.284 . 0 0 "[ . 1 . 2]" 1
909 1 37 LEU QD 1 83 PHE H . . 4.190 2.750 2.145 3.350 . 0 0 "[ . 1 . 2]" 1
910 1 37 LEU QD 1 84 ALA HA . . 4.950 4.099 3.329 4.681 . 0 0 "[ . 1 . 2]" 1
911 1 37 LEU HG 1 39 GLY H . . 4.330 3.706 3.221 4.348 0.018 17 0 "[ . 1 . 2]" 1
912 1 37 LEU HG 1 60 GLY HA2 . . 4.460 3.654 2.599 4.690 0.230 1 0 "[ . 1 . 2]" 1
913 1 37 LEU HG 1 60 GLY HA3 . . 4.630 4.058 3.313 4.728 0.098 12 0 "[ . 1 . 2]" 1
914 1 38 ASP H 1 38 ASP HB2 . . 3.780 2.176 2.044 2.553 . 0 0 "[ . 1 . 2]" 1
915 1 38 ASP H 1 38 ASP HB3 . . 3.930 3.076 2.484 3.416 . 0 0 "[ . 1 . 2]" 1
916 1 38 ASP H 1 39 GLY H . . 3.030 2.380 2.166 2.705 . 0 0 "[ . 1 . 2]" 1
917 1 38 ASP H 1 83 PHE QE . . 5.220 4.694 4.390 5.160 . 0 0 "[ . 1 . 2]" 1
918 1 38 ASP H 1 84 ALA HA . . 3.220 2.392 1.959 2.604 . 0 0 "[ . 1 . 2]" 1
919 1 38 ASP H 1 84 ALA MB . . 3.350 3.071 2.782 3.309 . 0 0 "[ . 1 . 2]" 1
920 1 38 ASP H 1 85 GLY H . . 4.480 3.895 3.475 4.167 . 0 0 "[ . 1 . 2]" 1
921 1 38 ASP HB2 1 39 GLY H . . 3.960 3.354 2.891 3.984 0.024 20 0 "[ . 1 . 2]" 1
922 1 38 ASP HB2 1 83 PHE QD . . 3.980 3.049 2.499 3.614 . 0 0 "[ . 1 . 2]" 1
923 1 38 ASP HB2 1 83 PHE QE . . 4.040 3.415 3.019 4.028 . 0 0 "[ . 1 . 2]" 1
924 1 38 ASP HB2 1 84 ALA HA . . 3.540 2.059 1.979 2.385 . 0 0 "[ . 1 . 2]" 1
925 1 38 ASP HB2 1 84 ALA MB . . 4.560 3.622 3.399 3.844 . 0 0 "[ . 1 . 2]" 1
926 1 38 ASP HB2 1 85 GLY H . . 4.350 2.197 1.927 3.165 . 0 0 "[ . 1 . 2]" 1
927 1 38 ASP HB3 1 39 GLY H . . 4.270 3.148 2.736 3.566 . 0 0 "[ . 1 . 2]" 1
928 1 38 ASP HB3 1 83 PHE QD . . 3.950 2.862 2.148 3.488 . 0 0 "[ . 1 . 2]" 1
929 1 38 ASP HB3 1 83 PHE QE . . 3.830 2.133 1.989 2.592 . 0 0 "[ . 1 . 2]" 1
930 1 38 ASP HB3 1 83 PHE HZ . . 5.500 4.160 3.637 4.711 . 0 0 "[ . 1 . 2]" 1
931 1 38 ASP HB3 1 84 ALA HA . . 4.050 3.405 2.422 3.769 . 0 0 "[ . 1 . 2]" 1
932 1 38 ASP HB3 1 84 ALA MB . . 5.110 4.842 3.990 5.150 0.040 1 0 "[ . 1 . 2]" 1
933 1 38 ASP HB3 1 85 GLY H . . 4.790 3.194 2.739 4.203 . 0 0 "[ . 1 . 2]" 1
934 1 39 GLY H 1 40 TYR H . . 4.450 4.236 4.135 4.337 . 0 0 "[ . 1 . 2]" 1
935 1 39 GLY H 1 60 GLY HA2 . . 5.160 3.868 3.494 4.384 . 0 0 "[ . 1 . 2]" 1
936 1 39 GLY H 1 60 GLY HA3 . . 5.080 3.909 3.424 4.363 . 0 0 "[ . 1 . 2]" 1
937 1 39 GLY H 1 83 PHE H . . 4.040 3.494 3.263 3.889 . 0 0 "[ . 1 . 2]" 1
938 1 39 GLY H 1 83 PHE QD . . 4.030 4.042 3.818 4.126 0.096 4 0 "[ . 1 . 2]" 1
939 1 39 GLY H 1 83 PHE QE . . 4.860 3.859 3.747 3.983 . 0 0 "[ . 1 . 2]" 1
940 1 39 GLY H 1 84 ALA HA . . 4.280 4.123 4.008 4.297 0.017 10 0 "[ . 1 . 2]" 1
941 1 39 GLY H 1 84 ALA MB . . 4.800 4.769 4.409 4.925 0.125 1 0 "[ . 1 . 2]" 1
942 1 39 GLY HA2 1 40 TYR H . . 3.410 2.389 2.306 2.510 . 0 0 "[ . 1 . 2]" 1
943 1 39 GLY HA2 1 40 TYR HB2 . . 5.040 4.588 4.495 4.744 . 0 0 "[ . 1 . 2]" 1
944 1 39 GLY HA2 1 40 TYR QD . . 5.110 2.952 2.515 3.140 . 0 0 "[ . 1 . 2]" 1
945 1 39 GLY HA2 1 59 ALA HA . . 4.740 4.170 3.879 4.332 . 0 0 "[ . 1 . 2]" 1
946 1 39 GLY HA2 1 60 GLY HA3 . . 4.840 3.184 2.901 3.567 . 0 0 "[ . 1 . 2]" 1
947 1 39 GLY HA2 1 83 PHE QE . . 4.710 4.578 4.375 4.718 0.008 16 0 "[ . 1 . 2]" 1
948 1 39 GLY HA2 1 83 PHE HZ . . 4.600 4.581 4.388 4.717 0.117 1 0 "[ . 1 . 2]" 1
949 1 39 GLY HA3 1 40 TYR H . . 3.450 2.888 2.735 3.004 . 0 0 "[ . 1 . 2]" 1
950 1 39 GLY HA3 1 40 TYR QD . . 5.380 4.271 3.850 4.522 . 0 0 "[ . 1 . 2]" 1
951 1 39 GLY HA3 1 58 VAL HB . . 5.370 4.547 4.286 4.750 . 0 0 "[ . 1 . 2]" 1
952 1 39 GLY HA3 1 58 VAL MG1 . . 5.240 5.171 4.897 5.323 0.083 17 0 "[ . 1 . 2]" 1
953 1 39 GLY HA3 1 59 ALA HA . . 4.930 4.727 4.319 4.976 0.046 17 0 "[ . 1 . 2]" 1
954 1 39 GLY HA3 1 60 GLY HA3 . . 4.960 4.600 4.343 4.967 0.007 15 0 "[ . 1 . 2]" 1
955 1 39 GLY HA3 1 83 PHE QE . . 5.200 3.462 3.267 3.628 . 0 0 "[ . 1 . 2]" 1
956 1 39 GLY HA3 1 83 PHE HZ . . 4.180 2.980 2.780 3.263 . 0 0 "[ . 1 . 2]" 1
957 1 40 TYR H 1 40 TYR QD . . 4.060 2.074 1.888 2.362 . 0 0 "[ . 1 . 2]" 1
958 1 40 TYR H 1 41 VAL H . . 5.080 4.501 4.467 4.531 . 0 0 "[ . 1 . 2]" 1
959 1 40 TYR H 1 41 VAL QG . . 5.500 4.721 4.452 5.167 . 0 0 "[ . 1 . 2]" 1
960 1 40 TYR H 1 57 ALA HA . . 5.140 4.679 4.394 4.857 . 0 0 "[ . 1 . 2]" 1
961 1 40 TYR H 1 58 VAL HA . . 5.290 4.385 4.246 4.538 . 0 0 "[ . 1 . 2]" 1
962 1 40 TYR H 1 58 VAL HB . . 3.490 2.234 1.949 2.432 . 0 0 "[ . 1 . 2]" 1
963 1 40 TYR H 1 58 VAL MG1 . . 4.340 3.280 3.018 3.544 . 0 0 "[ . 1 . 2]" 1
964 1 40 TYR H 1 58 VAL MG2 . . 4.380 3.837 3.585 4.079 . 0 0 "[ . 1 . 2]" 1
965 1 40 TYR H 1 59 ALA H . . 5.280 5.015 4.799 5.153 . 0 0 "[ . 1 . 2]" 1
966 1 40 TYR H 1 59 ALA HA . . 5.500 5.215 4.908 5.373 . 0 0 "[ . 1 . 2]" 1
967 1 40 TYR H 1 60 GLY HA3 . . 5.370 5.185 4.884 5.401 0.031 15 0 "[ . 1 . 2]" 1
968 1 40 TYR H 1 82 ALA HA . . 5.430 4.725 4.463 4.916 . 0 0 "[ . 1 . 2]" 1
969 1 40 TYR H 1 82 ALA MB . . 5.470 5.405 4.995 5.580 0.110 16 0 "[ . 1 . 2]" 1
970 1 40 TYR H 1 83 PHE QD . . 5.400 5.181 4.619 5.469 0.069 16 0 "[ . 1 . 2]" 1
971 1 40 TYR H 1 83 PHE QE . . 4.420 4.059 3.393 4.394 . 0 0 "[ . 1 . 2]" 1
972 1 40 TYR H 1 83 PHE HZ . . 5.500 4.604 4.238 5.097 . 0 0 "[ . 1 . 2]" 1
973 1 40 TYR HA 1 40 TYR QD . . 3.960 3.171 3.063 3.272 . 0 0 "[ . 1 . 2]" 1
974 1 40 TYR HA 1 41 VAL H . . 3.260 2.609 2.578 2.640 . 0 0 "[ . 1 . 2]" 1
975 1 40 TYR HA 1 41 VAL HB . . 4.790 4.472 4.384 4.626 . 0 0 "[ . 1 . 2]" 1
976 1 40 TYR HA 1 41 VAL QG . . 4.500 3.290 3.084 3.440 . 0 0 "[ . 1 . 2]" 1
977 1 40 TYR HA 1 58 VAL HB . . 5.320 4.231 4.037 4.402 . 0 0 "[ . 1 . 2]" 1
978 1 40 TYR HA 1 80 LEU QD . . 4.850 4.253 3.372 4.483 . 0 0 "[ . 1 . 2]" 1
979 1 40 TYR HA 1 81 VAL H . . 5.090 3.991 3.743 4.169 . 0 0 "[ . 1 . 2]" 1
980 1 40 TYR HA 1 82 ALA HA . . 3.320 2.370 1.978 2.729 . 0 0 "[ . 1 . 2]" 1
981 1 40 TYR HA 1 82 ALA MB . . 4.330 3.932 3.585 4.289 . 0 0 "[ . 1 . 2]" 1
982 1 40 TYR HA 1 83 PHE H . . 4.000 3.074 2.843 3.257 . 0 0 "[ . 1 . 2]" 1
983 1 40 TYR HA 1 83 PHE QD . . 4.190 3.069 2.590 3.331 . 0 0 "[ . 1 . 2]" 1
984 1 40 TYR HA 1 83 PHE QE . . 4.760 3.271 2.974 3.775 . 0 0 "[ . 1 . 2]" 1
985 1 40 TYR HB2 1 41 VAL H . . 4.300 3.379 3.199 3.502 . 0 0 "[ . 1 . 2]" 1
986 1 40 TYR HB2 1 41 VAL HA . . 4.930 4.451 4.317 4.513 . 0 0 "[ . 1 . 2]" 1
987 1 40 TYR HB2 1 58 VAL MG1 . . 4.310 2.467 2.156 2.904 . 0 0 "[ . 1 . 2]" 1
988 1 40 TYR HB2 1 80 LEU QD . . 3.630 2.793 2.011 3.094 . 0 0 "[ . 1 . 2]" 1
989 1 40 TYR HB2 1 80 LEU HG . . 4.020 3.140 2.394 4.313 0.293 7 0 "[ . 1 . 2]" 1
990 1 40 TYR HB2 1 82 ALA HA . . 5.060 4.689 4.360 4.993 . 0 0 "[ . 1 . 2]" 1
991 1 40 TYR HB3 1 41 VAL H . . 3.890 2.274 2.221 2.325 . 0 0 "[ . 1 . 2]" 1
992 1 40 TYR HB3 1 58 VAL HB . . 4.190 3.674 3.489 3.917 . 0 0 "[ . 1 . 2]" 1
993 1 40 TYR HB3 1 58 VAL MG1 . . 4.570 3.895 3.570 4.366 . 0 0 "[ . 1 . 2]" 1
994 1 40 TYR HB3 1 58 VAL MG2 . . 4.380 4.200 3.993 4.409 0.029 6 0 "[ . 1 . 2]" 1
995 1 40 TYR HB3 1 80 LEU QD . . 3.550 2.508 1.648 2.814 . 0 0 "[ . 1 . 2]" 1
996 1 40 TYR HB3 1 80 LEU HG . . 3.850 2.005 1.822 3.866 0.016 7 0 "[ . 1 . 2]" 1
997 1 40 TYR HB3 1 82 ALA HA . . 4.670 3.664 3.309 3.986 . 0 0 "[ . 1 . 2]" 1
998 1 40 TYR HB3 1 82 ALA MB . . 4.510 4.345 3.937 4.539 0.029 16 0 "[ . 1 . 2]" 1
999 1 40 TYR HB3 1 83 PHE H . . 5.340 5.301 4.926 5.471 0.131 15 0 "[ . 1 . 2]" 1
1000 1 40 TYR QD 1 41 VAL H . . 4.880 3.878 3.749 4.100 . 0 0 "[ . 1 . 2]" 1
1001 1 40 TYR QD 1 58 VAL HB . . 4.230 3.134 2.679 3.423 . 0 0 "[ . 1 . 2]" 1
1002 1 40 TYR QD 1 58 VAL MG1 . . 3.310 2.827 2.325 3.110 . 0 0 "[ . 1 . 2]" 1
1003 1 40 TYR QD 1 58 VAL MG2 . . 4.520 4.498 4.195 4.658 0.138 13 0 "[ . 1 . 2]" 1
1004 1 40 TYR QD 1 60 GLY HA2 . . 4.320 2.754 2.554 2.989 . 0 0 "[ . 1 . 2]" 1
1005 1 40 TYR QD 1 60 GLY HA3 . . 5.030 4.419 4.225 4.629 . 0 0 "[ . 1 . 2]" 1
1006 1 40 TYR QD 1 80 LEU HB2 . . 4.900 5.059 4.758 5.209 0.309 2 0 "[ . 1 . 2]" 1
1007 1 40 TYR QD 1 80 LEU HB3 . . 5.130 3.664 3.179 3.923 . 0 0 "[ . 1 . 2]" 1
1008 1 40 TYR QD 1 80 LEU QD . . 3.810 3.037 1.768 3.415 . 0 0 "[ . 1 . 2]" 1
1009 1 40 TYR QD 1 80 LEU HG . . 3.970 2.825 2.378 4.369 0.399 7 0 "[ . 1 . 2]" 1
1010 1 40 TYR QD 1 82 ALA H . . 5.270 3.247 2.953 3.599 . 0 0 "[ . 1 . 2]" 1
1011 1 40 TYR QD 1 82 ALA HA . . 3.490 2.648 2.337 2.973 . 0 0 "[ . 1 . 2]" 1
1012 1 40 TYR QD 1 82 ALA MB . . 3.420 2.545 2.336 2.721 . 0 0 "[ . 1 . 2]" 1
1013 1 40 TYR QD 1 83 PHE H . . 4.760 4.556 4.290 4.746 . 0 0 "[ . 1 . 2]" 1
1014 1 40 TYR QE 1 58 VAL MG1 . . 4.820 4.385 4.098 4.577 . 0 0 "[ . 1 . 2]" 1
1015 1 40 TYR QE 1 60 GLY HA2 . . 4.530 2.058 1.960 2.260 . 0 0 "[ . 1 . 2]" 1
1016 1 40 TYR QE 1 60 GLY HA3 . . 5.170 3.523 3.394 3.711 . 0 0 "[ . 1 . 2]" 1
1017 1 40 TYR QE 1 80 LEU QD . . 4.640 3.940 3.085 4.295 . 0 0 "[ . 1 . 2]" 1
1018 1 40 TYR QE 1 82 ALA HA . . 4.950 3.810 3.483 4.201 . 0 0 "[ . 1 . 2]" 1
1019 1 40 TYR QE 1 82 ALA MB . . 3.790 2.099 1.907 2.397 . 0 0 "[ . 1 . 2]" 1
1020 1 40 TYR HH 1 82 ALA MB . . 4.960 4.296 4.049 4.452 . 0 0 "[ . 1 . 2]" 1
1021 1 41 VAL H 1 41 VAL HB . . 3.560 2.873 2.601 3.508 . 0 0 "[ . 1 . 2]" 1
1022 1 41 VAL H 1 41 VAL QG . . 3.570 2.599 1.859 2.966 . 0 0 "[ . 1 . 2]" 1
1023 1 41 VAL H 1 42 LEU H . . 5.210 4.010 3.942 4.078 . 0 0 "[ . 1 . 2]" 1
1024 1 41 VAL H 1 80 LEU HA . . 4.860 3.518 3.373 3.655 . 0 0 "[ . 1 . 2]" 1
1025 1 41 VAL H 1 80 LEU QD . . 4.490 2.802 1.983 3.228 . 0 0 "[ . 1 . 2]" 1
1026 1 41 VAL H 1 80 LEU HG . . 4.680 3.363 2.960 4.953 0.273 7 0 "[ . 1 . 2]" 1
1027 1 41 VAL H 1 81 VAL H . . 3.930 1.979 1.884 2.164 . 0 0 "[ . 1 . 2]" 1
1028 1 41 VAL H 1 81 VAL QG . . 4.430 3.394 2.660 3.942 . 0 0 "[ . 1 . 2]" 1
1029 1 41 VAL H 1 82 ALA H . . 5.350 4.877 4.502 5.158 . 0 0 "[ . 1 . 2]" 1
1030 1 41 VAL H 1 82 ALA HA . . 4.450 4.106 3.741 4.528 0.078 10 0 "[ . 1 . 2]" 1
1031 1 41 VAL H 1 83 PHE QD . . 4.640 3.898 3.686 4.084 . 0 0 "[ . 1 . 2]" 1
1032 1 41 VAL H 1 83 PHE QE . . 4.980 3.980 3.433 4.626 . 0 0 "[ . 1 . 2]" 1
1033 1 41 VAL HA 1 41 VAL QG . . 3.220 2.222 2.066 2.482 . 0 0 "[ . 1 . 2]" 1
1034 1 41 VAL HA 1 42 LEU H . . 3.040 2.199 2.184 2.208 . 0 0 "[ . 1 . 2]" 1
1035 1 41 VAL HA 1 42 LEU HB2 . . 5.320 4.544 4.385 4.644 . 0 0 "[ . 1 . 2]" 1
1036 1 41 VAL HA 1 42 LEU HB3 . . 4.680 4.638 4.546 4.772 0.092 18 0 "[ . 1 . 2]" 1
1037 1 41 VAL HA 1 55 ASP H . . 5.500 4.562 4.271 4.771 . 0 0 "[ . 1 . 2]" 1
1038 1 41 VAL HB 1 42 LEU H . . 4.820 4.458 4.212 4.547 . 0 0 "[ . 1 . 2]" 1
1039 1 41 VAL HB 1 81 VAL H . . 4.730 3.676 2.967 4.967 0.237 1 0 "[ . 1 . 2]" 1
1040 1 41 VAL HB 1 81 VAL QG . . 3.960 3.050 1.880 4.163 0.203 10 0 "[ . 1 . 2]" 1
1041 1 41 VAL HB 1 83 PHE QD . . 5.070 3.676 3.523 3.863 . 0 0 "[ . 1 . 2]" 1
1042 1 41 VAL HB 1 83 PHE QE . . 5.170 3.688 2.267 4.689 . 0 0 "[ . 1 . 2]" 1
1043 1 41 VAL QG 1 42 LEU H . . 3.460 3.087 2.924 3.194 . 0 0 "[ . 1 . 2]" 1
1044 1 41 VAL QG 1 42 LEU HA . . 4.740 3.883 3.745 4.040 . 0 0 "[ . 1 . 2]" 1
1045 1 41 VAL QG 1 43 GLU HA . . 4.710 4.086 3.935 4.341 . 0 0 "[ . 1 . 2]" 1
1046 1 41 VAL QG 1 43 GLU QG . . 3.970 2.863 2.524 3.634 . 0 0 "[ . 1 . 2]" 1
1047 1 41 VAL QG 1 53 VAL HA . . 4.100 3.695 3.453 3.920 . 0 0 "[ . 1 . 2]" 1
1048 1 41 VAL QG 1 53 VAL QG . . 3.000 2.256 1.699 2.711 . 0 0 "[ . 1 . 2]" 1
1049 1 41 VAL QG 1 54 LEU H . . 4.550 4.475 4.284 4.590 0.040 15 0 "[ . 1 . 2]" 1
1050 1 41 VAL QG 1 55 ASP H . . 4.440 3.928 3.670 4.304 . 0 0 "[ . 1 . 2]" 1
1051 1 41 VAL QG 1 56 PRO HA . . 2.910 2.118 1.942 2.301 . 0 0 "[ . 1 . 2]" 1
1052 1 41 VAL QG 1 56 PRO QB . . 3.270 2.790 2.297 3.016 . 0 0 "[ . 1 . 2]" 1
1053 1 41 VAL QG 1 80 LEU HA . . 4.660 4.223 3.522 4.504 . 0 0 "[ . 1 . 2]" 1
1054 1 41 VAL QG 1 81 VAL H . . 4.250 3.305 2.034 3.860 . 0 0 "[ . 1 . 2]" 1
1055 1 41 VAL QG 1 81 VAL QG . . 4.180 2.497 1.567 3.173 . 0 0 "[ . 1 . 2]" 1
1056 1 41 VAL QG 1 82 ALA HA . . 4.890 4.571 4.029 4.779 . 0 0 "[ . 1 . 2]" 1
1057 1 41 VAL QG 1 83 PHE QD . . 3.140 1.979 1.921 2.253 . 0 0 "[ . 1 . 2]" 1
1058 1 41 VAL QG 1 83 PHE QE . . 3.170 2.084 1.767 2.618 . 0 0 "[ . 1 . 2]" 1
1059 1 41 VAL QG 1 83 PHE HZ . . 4.730 3.957 3.434 4.577 . 0 0 "[ . 1 . 2]" 1
1060 1 42 LEU H 1 42 LEU HB2 . . 3.350 2.591 2.420 2.713 . 0 0 "[ . 1 . 2]" 1
1061 1 42 LEU H 1 42 LEU HB3 . . 3.640 2.451 2.359 2.585 . 0 0 "[ . 1 . 2]" 1
1062 1 42 LEU H 1 42 LEU QD . . 4.520 3.667 3.585 3.757 . 0 0 "[ . 1 . 2]" 1
1063 1 42 LEU H 1 55 ASP H . . 4.140 3.087 2.911 3.332 . 0 0 "[ . 1 . 2]" 1
1064 1 42 LEU H 1 55 ASP HB2 . . 4.550 4.133 3.719 4.503 . 0 0 "[ . 1 . 2]" 1
1065 1 42 LEU H 1 55 ASP HB3 . . 5.020 3.078 2.659 3.545 . 0 0 "[ . 1 . 2]" 1
1066 1 42 LEU H 1 56 PRO HA . . 4.700 3.744 3.300 4.092 . 0 0 "[ . 1 . 2]" 1
1067 1 42 LEU H 1 58 VAL HB . . 5.500 4.510 4.221 4.763 . 0 0 "[ . 1 . 2]" 1
1068 1 42 LEU H 1 58 VAL MG2 . . 3.980 2.616 2.236 2.893 . 0 0 "[ . 1 . 2]" 1
1069 1 42 LEU H 1 80 LEU QD . . 4.690 2.956 2.816 3.215 . 0 0 "[ . 1 . 2]" 1
1070 1 42 LEU HA 1 42 LEU QD . . 3.110 1.935 1.836 2.092 . 0 0 "[ . 1 . 2]" 1
1071 1 42 LEU HA 1 42 LEU HG . . 4.090 3.417 3.173 3.710 . 0 0 "[ . 1 . 2]" 1
1072 1 42 LEU HA 1 43 GLU H . . 3.170 2.180 2.176 2.200 . 0 0 "[ . 1 . 2]" 1
1073 1 42 LEU HA 1 79 ARG H . . 5.430 3.755 3.514 3.992 . 0 0 "[ . 1 . 2]" 1
1074 1 42 LEU HA 1 80 LEU HA . . 3.600 2.727 2.481 3.043 . 0 0 "[ . 1 . 2]" 1
1075 1 42 LEU HA 1 80 LEU QD . . 3.430 1.976 1.834 2.216 . 0 0 "[ . 1 . 2]" 1
1076 1 42 LEU HA 1 81 VAL H . . 4.740 4.260 4.062 4.525 . 0 0 "[ . 1 . 2]" 1
1077 1 42 LEU HB2 1 43 GLU H . . 4.360 4.420 4.317 4.545 0.185 11 0 "[ . 1 . 2]" 1
1078 1 42 LEU HB2 1 55 ASP H . . 4.540 4.288 3.885 4.578 0.038 13 0 "[ . 1 . 2]" 1
1079 1 42 LEU HB2 1 55 ASP HB2 . . 4.270 4.146 3.700 4.566 0.296 16 0 "[ . 1 . 2]" 1
1080 1 42 LEU HB2 1 55 ASP HB3 . . 4.540 3.611 3.100 4.372 . 0 0 "[ . 1 . 2]" 1
1081 1 42 LEU HB2 1 80 LEU QD . . 3.250 2.130 1.826 2.579 . 0 0 "[ . 1 . 2]" 1
1082 1 42 LEU HB3 1 55 ASP H . . 4.170 2.723 2.267 3.020 . 0 0 "[ . 1 . 2]" 1
1083 1 42 LEU HB3 1 55 ASP HB2 . . 3.990 2.931 2.369 3.568 . 0 0 "[ . 1 . 2]" 1
1084 1 42 LEU HB3 1 55 ASP HB3 . . 4.130 2.904 2.289 3.618 . 0 0 "[ . 1 . 2]" 1
1085 1 42 LEU HB3 1 58 VAL MG2 . . 4.080 3.314 2.934 3.568 . 0 0 "[ . 1 . 2]" 1
1086 1 42 LEU HB3 1 65 LEU QD . . 4.350 2.861 2.375 3.247 . 0 0 "[ . 1 . 2]" 1
1087 1 42 LEU HB3 1 67 VAL QG . . 5.040 4.069 3.731 4.278 . 0 0 "[ . 1 . 2]" 1
1088 1 42 LEU HB3 1 80 LEU QD . . 4.030 3.411 3.133 3.820 . 0 0 "[ . 1 . 2]" 1
1089 1 42 LEU QD 1 43 GLU H . . 3.370 2.122 1.974 2.436 . 0 0 "[ . 1 . 2]" 1
1090 1 42 LEU QD 1 43 GLU HA . . 5.270 3.564 2.918 4.218 . 0 0 "[ . 1 . 2]" 1
1091 1 42 LEU QD 1 43 GLU HB3 . . 5.140 4.715 4.401 5.129 . 0 0 "[ . 1 . 2]" 1
1092 1 42 LEU QD 1 54 LEU H . . 5.100 3.687 2.308 4.559 . 0 0 "[ . 1 . 2]" 1
1093 1 42 LEU QD 1 54 LEU HB2 . . 4.160 2.262 1.727 3.089 . 0 0 "[ . 1 . 2]" 1
1094 1 42 LEU QD 1 54 LEU HB3 . . 4.190 3.016 2.478 3.784 . 0 0 "[ . 1 . 2]" 1
1095 1 42 LEU QD 1 54 LEU QD . . 3.250 2.025 1.642 2.676 . 0 0 "[ . 1 . 2]" 1
1096 1 42 LEU QD 1 55 ASP H . . 4.480 3.634 3.112 4.174 . 0 0 "[ . 1 . 2]" 1
1097 1 42 LEU QD 1 55 ASP HB2 . . 4.340 3.355 2.843 3.982 . 0 0 "[ . 1 . 2]" 1
1098 1 42 LEU QD 1 55 ASP HB3 . . 4.390 3.920 3.408 4.301 . 0 0 "[ . 1 . 2]" 1
1099 1 42 LEU QD 1 67 VAL QG . . 3.250 1.817 1.635 2.161 . 0 0 "[ . 1 . 2]" 1
1100 1 42 LEU QD 1 78 PHE H . . 5.370 5.010 4.741 5.217 . 0 0 "[ . 1 . 2]" 1
1101 1 42 LEU QD 1 78 PHE HA . . 4.390 3.124 2.769 3.433 . 0 0 "[ . 1 . 2]" 1
1102 1 42 LEU QD 1 78 PHE HB2 . . 3.870 3.677 3.369 3.865 . 0 0 "[ . 1 . 2]" 1
1103 1 42 LEU QD 1 78 PHE HB3 . . 3.440 2.216 1.908 2.453 . 0 0 "[ . 1 . 2]" 1
1104 1 42 LEU QD 1 78 PHE QD . . 3.310 2.172 1.858 2.527 . 0 0 "[ . 1 . 2]" 1
1105 1 42 LEU QD 1 78 PHE QE . . 4.330 3.130 2.521 3.729 . 0 0 "[ . 1 . 2]" 1
1106 1 42 LEU QD 1 79 ARG H . . 3.940 2.316 1.977 2.629 . 0 0 "[ . 1 . 2]" 1
1107 1 42 LEU QD 1 80 LEU HA . . 3.740 3.304 3.079 3.528 . 0 0 "[ . 1 . 2]" 1
1108 1 42 LEU QD 1 80 LEU HB2 . . 4.810 3.419 3.202 3.755 . 0 0 "[ . 1 . 2]" 1
1109 1 42 LEU QD 1 80 LEU QD . . 2.900 1.912 1.656 2.672 . 0 0 "[ . 1 . 2]" 1
1110 1 42 LEU HG 1 43 GLU H . . 4.800 4.294 3.391 4.937 0.137 11 0 "[ . 1 . 2]" 1
1111 1 42 LEU HG 1 54 LEU QD . . 4.130 3.205 2.012 4.099 . 0 0 "[ . 1 . 2]" 1
1112 1 42 LEU HG 1 67 VAL QG . . 3.650 3.193 2.860 3.652 0.002 18 0 "[ . 1 . 2]" 1
1113 1 42 LEU HG 1 78 PHE QD . . 4.660 3.696 2.327 4.563 . 0 0 "[ . 1 . 2]" 1
1114 1 42 LEU HG 1 80 LEU QD . . 4.330 3.436 2.540 3.963 . 0 0 "[ . 1 . 2]" 1
1115 1 43 GLU H 1 43 GLU HB2 . . 4.060 2.432 2.331 2.572 . 0 0 "[ . 1 . 2]" 1
1116 1 43 GLU H 1 43 GLU HB3 . . 4.110 3.442 3.289 3.543 . 0 0 "[ . 1 . 2]" 1
1117 1 43 GLU H 1 43 GLU QG . . 4.670 3.730 3.499 4.147 . 0 0 "[ . 1 . 2]" 1
1118 1 43 GLU H 1 54 LEU HB2 . . 4.950 4.946 4.754 5.181 0.231 19 0 "[ . 1 . 2]" 1
1119 1 43 GLU H 1 78 PHE HA . . 4.860 4.081 3.835 4.285 . 0 0 "[ . 1 . 2]" 1
1120 1 43 GLU H 1 79 ARG H . . 3.820 2.384 2.165 2.582 . 0 0 "[ . 1 . 2]" 1
1121 1 43 GLU H 1 80 LEU HA . . 4.120 3.673 3.495 3.833 . 0 0 "[ . 1 . 2]" 1
1122 1 43 GLU H 1 80 LEU QD . . 4.410 3.526 3.295 3.738 . 0 0 "[ . 1 . 2]" 1
1123 1 43 GLU HA 1 43 GLU QG . . 3.540 2.137 1.981 2.383 . 0 0 "[ . 1 . 2]" 1
1124 1 43 GLU HA 1 44 GLY H . . 3.210 2.285 2.202 2.605 . 0 0 "[ . 1 . 2]" 1
1125 1 43 GLU HA 1 44 GLY HA3 . . 4.960 4.372 4.332 4.413 . 0 0 "[ . 1 . 2]" 1
1126 1 43 GLU HA 1 51 TRP HE3 . . 4.740 4.055 3.830 4.352 . 0 0 "[ . 1 . 2]" 1
1127 1 43 GLU HA 1 52 GLU H . . 4.870 4.714 4.252 4.935 0.065 16 0 "[ . 1 . 2]" 1
1128 1 43 GLU HA 1 53 VAL HA . . 3.360 2.435 1.965 2.814 . 0 0 "[ . 1 . 2]" 1
1129 1 43 GLU HA 1 53 VAL QG . . 4.130 3.609 3.278 3.882 . 0 0 "[ . 1 . 2]" 1
1130 1 43 GLU HA 1 54 LEU H . . 3.520 2.282 1.950 2.520 . 0 0 "[ . 1 . 2]" 1
1131 1 43 GLU HA 1 54 LEU QD . . 4.880 3.459 3.201 3.977 . 0 0 "[ . 1 . 2]" 1
1132 1 43 GLU HA 1 54 LEU HG . . 3.630 2.763 2.299 3.410 . 0 0 "[ . 1 . 2]" 1
1133 1 43 GLU HA 1 55 ASP H . . 4.970 4.134 3.716 4.471 . 0 0 "[ . 1 . 2]" 1
1134 1 43 GLU HB2 1 44 GLY H . . 4.920 4.423 3.825 4.640 . 0 0 "[ . 1 . 2]" 1
1135 1 43 GLU HB2 1 51 TRP HB3 . . 5.500 4.534 3.877 4.996 . 0 0 "[ . 1 . 2]" 1
1136 1 43 GLU HB2 1 51 TRP HE3 . . 4.410 4.013 3.606 4.254 . 0 0 "[ . 1 . 2]" 1
1137 1 43 GLU HB2 1 51 TRP HZ3 . . 5.210 4.673 4.214 4.985 . 0 0 "[ . 1 . 2]" 1
1138 1 43 GLU HB2 1 53 VAL HA . . 5.390 4.402 3.947 4.665 . 0 0 "[ . 1 . 2]" 1
1139 1 43 GLU HB2 1 53 VAL QG . . 4.640 4.260 3.765 4.593 . 0 0 "[ . 1 . 2]" 1
1140 1 43 GLU HB2 1 79 ARG H . . 4.680 3.848 3.343 4.218 . 0 0 "[ . 1 . 2]" 1
1141 1 43 GLU HB2 1 79 ARG QD . . 4.350 3.058 2.217 3.294 . 0 0 "[ . 1 . 2]" 1
1142 1 43 GLU HB2 1 79 ARG HE . . 5.500 2.691 2.357 4.572 . 0 0 "[ . 1 . 2]" 1
1143 1 43 GLU HB2 1 79 ARG HG2 . . 4.210 2.016 1.956 2.281 . 0 0 "[ . 1 . 2]" 1
1144 1 43 GLU HB2 1 79 ARG HG3 . . 4.070 2.253 1.981 2.559 . 0 0 "[ . 1 . 2]" 1
1145 1 43 GLU HB3 1 44 GLY H . . 3.830 3.417 2.382 3.837 0.007 20 0 "[ . 1 . 2]" 1
1146 1 43 GLU HB3 1 44 GLY HA3 . . 5.340 5.166 4.605 5.413 0.073 20 0 "[ . 1 . 2]" 1
1147 1 43 GLU HB3 1 51 TRP HB3 . . 4.630 3.116 2.370 3.639 . 0 0 "[ . 1 . 2]" 1
1148 1 43 GLU HB3 1 51 TRP HE3 . . 3.760 2.342 2.000 2.553 . 0 0 "[ . 1 . 2]" 1
1149 1 43 GLU HB3 1 51 TRP HZ3 . . 5.080 3.590 3.097 3.954 . 0 0 "[ . 1 . 2]" 1
1150 1 43 GLU HB3 1 53 VAL HA . . 4.910 4.301 3.988 4.862 . 0 0 "[ . 1 . 2]" 1
1151 1 43 GLU HB3 1 79 ARG H . . 5.060 4.250 3.705 4.770 . 0 0 "[ . 1 . 2]" 1
1152 1 43 GLU HB3 1 79 ARG HE . . 5.000 3.401 2.821 4.901 . 0 0 "[ . 1 . 2]" 1
1153 1 43 GLU HB3 1 79 ARG HG2 . . 4.230 2.375 2.002 2.738 . 0 0 "[ . 1 . 2]" 1
1154 1 43 GLU HB3 1 79 ARG HG3 . . 4.830 3.374 3.045 3.777 . 0 0 "[ . 1 . 2]" 1
1155 1 43 GLU QG 1 44 GLY H . . 4.330 3.536 2.918 3.948 . 0 0 "[ . 1 . 2]" 1
1156 1 43 GLU QG 1 51 TRP HB2 . . 4.670 4.291 3.796 4.607 . 0 0 "[ . 1 . 2]" 1
1157 1 43 GLU QG 1 51 TRP HB3 . . 4.710 2.881 2.503 3.125 . 0 0 "[ . 1 . 2]" 1
1158 1 43 GLU QG 1 51 TRP HE3 . . 4.430 3.623 3.293 3.846 . 0 0 "[ . 1 . 2]" 1
1159 1 43 GLU QG 1 52 GLU H . . 4.880 4.157 3.390 4.432 . 0 0 "[ . 1 . 2]" 1
1160 1 43 GLU QG 1 53 VAL HA . . 3.680 1.944 1.857 2.237 . 0 0 "[ . 1 . 2]" 1
1161 1 43 GLU QG 1 53 VAL QG . . 3.430 2.118 1.766 2.480 . 0 0 "[ . 1 . 2]" 1
1162 1 43 GLU QG 1 54 LEU H . . 4.900 3.325 3.095 3.698 . 0 0 "[ . 1 . 2]" 1
1163 1 44 GLY H 1 45 ARG H . . 5.110 4.429 4.361 4.487 . 0 0 "[ . 1 . 2]" 1
1164 1 44 GLY H 1 51 TRP HA . . 5.050 4.540 3.581 5.042 . 0 0 "[ . 1 . 2]" 1
1165 1 44 GLY H 1 51 TRP HE3 . . 4.280 3.196 2.256 3.625 . 0 0 "[ . 1 . 2]" 1
1166 1 44 GLY H 1 51 TRP HZ3 . . 5.190 4.042 3.509 4.282 . 0 0 "[ . 1 . 2]" 1
1167 1 44 GLY H 1 52 GLU H . . 3.810 3.321 2.598 3.738 . 0 0 "[ . 1 . 2]" 1
1168 1 44 GLY H 1 52 GLU HB3 . . 5.470 5.228 4.234 5.521 0.051 14 0 "[ . 1 . 2]" 1
1169 1 44 GLY H 1 53 VAL HA . . 4.470 3.851 3.457 4.180 . 0 0 "[ . 1 . 2]" 1
1170 1 44 GLY H 1 54 LEU H . . 4.700 3.263 2.887 3.948 . 0 0 "[ . 1 . 2]" 1
1171 1 44 GLY H 1 54 LEU QD . . 4.220 2.588 2.045 3.222 . 0 0 "[ . 1 . 2]" 1
1172 1 44 GLY H 1 54 LEU HG . . 3.830 2.210 1.927 3.083 . 0 0 "[ . 1 . 2]" 1
1173 1 44 GLY HA2 1 45 ARG H . . 3.490 2.576 2.453 2.640 . 0 0 "[ . 1 . 2]" 1
1174 1 44 GLY HA2 1 51 TRP HE3 . . 4.590 3.248 2.915 3.627 . 0 0 "[ . 1 . 2]" 1
1175 1 44 GLY HA2 1 51 TRP HH2 . . 5.000 4.194 4.041 4.285 . 0 0 "[ . 1 . 2]" 1
1176 1 44 GLY HA2 1 51 TRP HZ3 . . 3.580 2.066 2.002 2.122 . 0 0 "[ . 1 . 2]" 1
1177 1 44 GLY HA2 1 54 LEU QD . . 3.950 3.281 3.002 3.733 . 0 0 "[ . 1 . 2]" 1
1178 1 44 GLY HA2 1 78 PHE HA . . 3.530 2.231 1.992 2.421 . 0 0 "[ . 1 . 2]" 1
1179 1 44 GLY HA2 1 78 PHE QD . . 3.920 3.562 3.306 4.047 0.127 12 0 "[ . 1 . 2]" 1
1180 1 44 GLY HA2 1 78 PHE QE . . 5.250 4.764 4.375 5.024 . 0 0 "[ . 1 . 2]" 1
1181 1 44 GLY HA2 1 79 ARG H . . 4.550 3.975 3.582 4.227 . 0 0 "[ . 1 . 2]" 1
1182 1 44 GLY HA3 1 45 ARG H . . 3.560 2.666 2.598 2.802 . 0 0 "[ . 1 . 2]" 1
1183 1 44 GLY HA3 1 51 TRP HE3 . . 5.090 4.305 4.060 4.705 . 0 0 "[ . 1 . 2]" 1
1184 1 44 GLY HA3 1 51 TRP HZ3 . . 3.760 3.781 3.721 3.817 0.057 18 0 "[ . 1 . 2]" 1
1185 1 44 GLY HA3 1 54 LEU QD . . 3.430 2.171 1.931 2.553 . 0 0 "[ . 1 . 2]" 1
1186 1 44 GLY HA3 1 54 LEU HG . . 4.550 3.128 2.821 3.408 . 0 0 "[ . 1 . 2]" 1
1187 1 44 GLY HA3 1 76 TYR QD . . 4.700 3.462 3.245 4.053 . 0 0 "[ . 1 . 2]" 1
1188 1 44 GLY HA3 1 76 TYR QE . . 4.990 4.777 4.297 5.062 0.072 18 0 "[ . 1 . 2]" 1
1189 1 44 GLY HA3 1 78 PHE HA . . 3.880 3.219 3.038 3.568 . 0 0 "[ . 1 . 2]" 1
1190 1 44 GLY HA3 1 78 PHE QD . . 3.950 3.164 2.773 3.775 . 0 0 "[ . 1 . 2]" 1
1191 1 44 GLY HA3 1 78 PHE QE . . 5.020 3.642 3.266 4.058 . 0 0 "[ . 1 . 2]" 1
1192 1 44 GLY HA3 1 79 ARG H . . 5.090 4.913 4.703 5.185 0.095 17 0 "[ . 1 . 2]" 1
1193 1 45 ARG H 1 45 ARG HG2 . . 4.470 3.183 2.835 3.267 . 0 0 "[ . 1 . 2]" 1
1194 1 45 ARG H 1 45 ARG HG3 . . 4.720 3.165 3.046 3.499 . 0 0 "[ . 1 . 2]" 1
1195 1 45 ARG H 1 46 GLN H . . 5.440 4.217 4.183 4.319 . 0 0 "[ . 1 . 2]" 1
1196 1 45 ARG H 1 51 TRP HE3 . . 5.330 4.573 4.316 4.893 . 0 0 "[ . 1 . 2]" 1
1197 1 45 ARG H 1 51 TRP HZ3 . . 4.150 3.835 3.422 4.018 . 0 0 "[ . 1 . 2]" 1
1198 1 45 ARG H 1 76 TYR QD . . 4.400 2.964 2.228 3.915 . 0 0 "[ . 1 . 2]" 1
1199 1 45 ARG H 1 76 TYR QE . . 5.470 4.508 3.894 5.131 . 0 0 "[ . 1 . 2]" 1
1200 1 45 ARG H 1 77 GLU H . . 3.790 2.124 1.858 2.487 . 0 0 "[ . 1 . 2]" 1
1201 1 45 ARG H 1 77 GLU HB2 . . 4.760 3.134 2.612 3.517 . 0 0 "[ . 1 . 2]" 1
1202 1 45 ARG H 1 77 GLU HB3 . . 5.260 4.205 3.756 4.685 . 0 0 "[ . 1 . 2]" 1
1203 1 45 ARG H 1 78 PHE HA . . 4.570 4.404 4.236 4.556 . 0 0 "[ . 1 . 2]" 1
1204 1 45 ARG H 1 78 PHE QD . . 4.830 4.916 4.720 5.078 0.248 19 0 "[ . 1 . 2]" 1
1205 1 45 ARG HA 1 45 ARG HD2 . . 4.970 4.618 4.518 4.782 . 0 0 "[ . 1 . 2]" 1
1206 1 45 ARG HA 1 46 GLN H . . 2.940 2.384 2.351 2.444 . 0 0 "[ . 1 . 2]" 1
1207 1 45 ARG HA 1 46 GLN QG . . 4.860 4.128 3.757 4.669 . 0 0 "[ . 1 . 2]" 1
1208 1 45 ARG HA 1 52 GLU H . . 4.470 3.701 3.245 4.331 . 0 0 "[ . 1 . 2]" 1
1209 1 45 ARG HB2 1 45 ARG HE . . 4.900 4.270 4.069 4.459 . 0 0 "[ . 1 . 2]" 1
1210 1 45 ARG HB2 1 46 GLN H . . 4.080 2.806 2.688 2.899 . 0 0 "[ . 1 . 2]" 1
1211 1 45 ARG HB2 1 51 TRP HA . . 3.990 3.460 3.143 3.638 . 0 0 "[ . 1 . 2]" 1
1212 1 45 ARG HB2 1 51 TRP HE3 . . 5.220 4.966 4.581 5.245 0.025 14 0 "[ . 1 . 2]" 1
1213 1 45 ARG HB2 1 52 GLU H . . 5.420 4.235 3.658 4.707 . 0 0 "[ . 1 . 2]" 1
1214 1 45 ARG HB3 1 45 ARG HD2 . . 4.040 3.118 2.985 3.303 . 0 0 "[ . 1 . 2]" 1
1215 1 45 ARG HB3 1 45 ARG HD3 . . 4.110 2.889 2.602 3.090 . 0 0 "[ . 1 . 2]" 1
1216 1 45 ARG HB3 1 45 ARG HE . . 4.840 4.608 4.506 4.667 . 0 0 "[ . 1 . 2]" 1
1217 1 45 ARG HB3 1 46 GLN H . . 4.300 4.018 3.909 4.085 . 0 0 "[ . 1 . 2]" 1
1218 1 45 ARG HB3 1 51 TRP H . . 5.500 4.176 3.906 4.551 . 0 0 "[ . 1 . 2]" 1
1219 1 45 ARG HB3 1 51 TRP HA . . 3.460 2.039 1.941 2.288 . 0 0 "[ . 1 . 2]" 1
1220 1 45 ARG HB3 1 51 TRP HE3 . . 4.850 3.309 2.837 3.656 . 0 0 "[ . 1 . 2]" 1
1221 1 45 ARG HB3 1 51 TRP HZ3 . . 5.110 4.463 3.933 4.903 . 0 0 "[ . 1 . 2]" 1
1222 1 45 ARG HB3 1 52 GLU H . . 4.800 2.803 2.468 3.205 . 0 0 "[ . 1 . 2]" 1
1223 1 45 ARG HB3 1 77 GLU HB2 . . 4.900 4.663 4.235 4.912 0.012 17 0 "[ . 1 . 2]" 1
1224 1 45 ARG HD2 1 45 ARG QH2 . . 3.760 4.117 4.064 4.161 0.401 7 0 "[ . 1 . 2]" 1
1225 1 45 ARG HD2 1 46 GLN H . . 4.510 4.567 4.509 4.620 0.110 3 0 "[ . 1 . 2]" 1
1226 1 45 ARG HD2 1 48 SER HA . . 5.080 3.504 2.462 4.258 . 0 0 "[ . 1 . 2]" 1
1227 1 45 ARG HD2 1 49 GLN H . . 5.180 3.190 2.302 5.096 . 0 0 "[ . 1 . 2]" 1
1228 1 45 ARG HD2 1 50 GLY H . . 5.170 5.014 4.668 5.210 0.040 15 0 "[ . 1 . 2]" 1
1229 1 45 ARG HD2 1 50 GLY HA2 . . 4.770 4.481 4.250 4.805 0.035 18 0 "[ . 1 . 2]" 1
1230 1 45 ARG HD2 1 51 TRP H . . 5.410 4.560 3.981 4.929 . 0 0 "[ . 1 . 2]" 1
1231 1 45 ARG HD2 1 51 TRP HA . . 4.980 4.134 3.830 4.556 . 0 0 "[ . 1 . 2]" 1
1232 1 45 ARG HD2 1 51 TRP HD1 . . 5.330 5.175 5.043 5.334 0.004 6 0 "[ . 1 . 2]" 1
1233 1 45 ARG HD2 1 51 TRP HE1 . . 4.940 4.958 4.899 5.013 0.073 6 0 "[ . 1 . 2]" 1
1234 1 45 ARG HD2 1 51 TRP HZ2 . . 5.290 5.245 5.094 5.337 0.047 13 0 "[ . 1 . 2]" 1
1235 1 45 ARG HD3 1 45 ARG QH2 . . 3.860 4.100 4.060 4.155 0.295 2 0 "[ . 1 . 2]" 1
1236 1 45 ARG HD3 1 51 TRP H . . 5.500 3.812 3.371 4.263 . 0 0 "[ . 1 . 2]" 1
1237 1 45 ARG HD3 1 51 TRP HA . . 4.730 3.220 2.741 3.692 . 0 0 "[ . 1 . 2]" 1
1238 1 45 ARG HD3 1 51 TRP HD1 . . 5.080 3.786 3.656 3.955 . 0 0 "[ . 1 . 2]" 1
1239 1 45 ARG HD3 1 51 TRP HE1 . . 4.650 3.559 3.331 3.937 . 0 0 "[ . 1 . 2]" 1
1240 1 45 ARG HD3 1 51 TRP HZ2 . . 4.900 3.999 3.753 4.462 . 0 0 "[ . 1 . 2]" 1
1241 1 45 ARG HE 1 45 ARG HG2 . . 4.230 2.793 2.536 3.017 . 0 0 "[ . 1 . 2]" 1
1242 1 45 ARG HE 1 48 SER HA . . 4.810 4.158 2.562 4.830 0.020 17 0 "[ . 1 . 2]" 1
1243 1 45 ARG HE 1 51 TRP HE1 . . 4.920 4.633 3.659 4.922 0.002 13 0 "[ . 1 . 2]" 1
1244 1 45 ARG HE 1 51 TRP HZ2 . . 4.750 3.488 2.489 3.970 . 0 0 "[ . 1 . 2]" 1
1245 1 45 ARG HE 1 77 GLU HB2 . . 4.670 2.977 2.581 3.348 . 0 0 "[ . 1 . 2]" 1
1246 1 45 ARG HE 1 77 GLU HB3 . . 4.980 3.936 3.371 4.509 . 0 0 "[ . 1 . 2]" 1
1247 1 45 ARG HE 1 77 GLU QG . . 5.430 3.917 3.658 4.304 . 0 0 "[ . 1 . 2]" 1
1248 1 45 ARG HG2 1 46 GLN H . . 5.040 5.025 4.599 5.099 0.059 3 0 "[ . 1 . 2]" 1
1249 1 45 ARG HG2 1 51 TRP HA . . 5.000 3.517 3.153 4.020 . 0 0 "[ . 1 . 2]" 1
1250 1 45 ARG HG2 1 51 TRP HZ3 . . 4.870 3.009 2.693 3.349 . 0 0 "[ . 1 . 2]" 1
1251 1 45 ARG HG2 1 77 GLU H . . 5.400 3.801 3.413 4.017 . 0 0 "[ . 1 . 2]" 1
1252 1 45 ARG HG2 1 77 GLU HB2 . . 4.440 2.603 2.019 2.910 . 0 0 "[ . 1 . 2]" 1
1253 1 45 ARG HG2 1 77 GLU HB3 . . 4.910 3.618 3.283 3.977 . 0 0 "[ . 1 . 2]" 1
1254 1 45 ARG HG3 1 46 GLN H . . 4.660 3.960 3.436 4.108 . 0 0 "[ . 1 . 2]" 1
1255 1 45 ARG HG3 1 51 TRP HA . . 5.230 4.702 4.513 4.911 . 0 0 "[ . 1 . 2]" 1
1256 1 45 ARG HG3 1 51 TRP HZ3 . . 5.380 4.424 4.048 4.941 . 0 0 "[ . 1 . 2]" 1
1257 1 45 ARG HG3 1 77 GLU H . . 5.290 3.026 2.896 3.548 . 0 0 "[ . 1 . 2]" 1
1258 1 45 ARG HG3 1 77 GLU HB2 . . 4.490 2.323 2.002 2.858 . 0 0 "[ . 1 . 2]" 1
1259 1 45 ARG HG3 1 77 GLU HB3 . . 5.060 3.927 3.521 4.475 . 0 0 "[ . 1 . 2]" 1
1260 1 45 ARG QH2 1 48 SER HA . . 4.660 3.856 2.972 4.702 0.042 17 0 "[ . 1 . 2]" 1
1261 1 45 ARG QH2 1 51 TRP HE1 . . 4.610 3.951 2.521 5.193 0.583 13 1 "[ . 1 + . 2]" 1
1262 1 46 GLN H 1 46 GLN HB2 . . 4.150 3.278 2.245 3.823 . 0 0 "[ . 1 . 2]" 1
1263 1 46 GLN H 1 46 GLN QG . . 4.070 2.488 2.110 3.084 . 0 0 "[ . 1 . 2]" 1
1264 1 46 GLN H 1 76 TYR QE . . 5.500 4.253 3.366 5.033 . 0 0 "[ . 1 . 2]" 1
1265 1 46 GLN HA 1 46 GLN QG . . 4.000 2.962 2.164 3.348 . 0 0 "[ . 1 . 2]" 1
1266 1 46 GLN HA 1 47 GLY H . . 3.010 2.387 2.231 2.686 . 0 0 "[ . 1 . 2]" 1
1267 1 46 GLN HA 1 47 GLY HA2 . . 4.720 4.449 4.360 4.522 . 0 0 "[ . 1 . 2]" 1
1268 1 46 GLN HA 1 47 GLY HA3 . . 5.170 4.586 4.466 4.754 . 0 0 "[ . 1 . 2]" 1
1269 1 46 GLN HA 1 74 VAL MG2 . . 4.580 4.401 3.926 4.671 0.091 9 0 "[ . 1 . 2]" 1
1270 1 46 GLN HA 1 76 TYR HA . . 3.490 2.250 2.080 2.350 . 0 0 "[ . 1 . 2]" 1
1271 1 46 GLN HA 1 76 TYR HB3 . . 4.930 4.989 4.775 5.139 0.209 18 0 "[ . 1 . 2]" 1
1272 1 46 GLN HA 1 76 TYR QD . . 4.650 4.019 3.596 4.293 . 0 0 "[ . 1 . 2]" 1
1273 1 46 GLN HA 1 76 TYR QE . . 5.060 4.853 4.401 5.128 0.068 3 0 "[ . 1 . 2]" 1
1274 1 46 GLN HA 1 77 GLU H . . 4.650 3.461 3.250 3.695 . 0 0 "[ . 1 . 2]" 1
1275 1 46 GLN HB2 1 47 GLY H . . 4.110 3.240 2.342 4.304 0.194 1 0 "[ . 1 . 2]" 1
1276 1 46 GLN HB2 1 74 VAL HB . . 5.040 2.988 1.969 4.695 . 0 0 "[ . 1 . 2]" 1
1277 1 46 GLN HB2 1 74 VAL MG1 . . 4.270 3.964 3.428 4.988 0.718 8 1 "[ . + 1 . 2]" 1
1278 1 46 GLN HB2 1 74 VAL MG2 . . 3.880 3.334 2.187 4.832 0.952 12 7 "[-* *. * 1 + .* *]" 1
1279 1 46 GLN HB2 1 76 TYR QD . . 4.920 3.900 2.406 5.192 0.272 8 0 "[ . 1 . 2]" 1
1280 1 46 GLN HB2 1 76 TYR QE . . 5.010 3.999 3.059 4.742 . 0 0 "[ . 1 . 2]" 1
1281 1 46 GLN HB3 1 47 GLY H . . 4.680 3.633 2.075 4.392 . 0 0 "[ . 1 . 2]" 1
1282 1 46 GLN HB3 1 74 VAL MG1 . . 5.050 4.233 3.472 4.884 . 0 0 "[ . 1 . 2]" 1
1283 1 46 GLN HB3 1 74 VAL MG2 . . 4.780 3.265 2.702 3.893 . 0 0 "[ . 1 . 2]" 1
1284 1 46 GLN HB3 1 76 TYR QD . . 5.000 3.371 2.445 4.743 . 0 0 "[ . 1 . 2]" 1
1285 1 46 GLN HB3 1 76 TYR QE . . 4.780 3.447 2.368 4.637 . 0 0 "[ . 1 . 2]" 1
1286 1 46 GLN HE21 1 71 ILE MD . . 4.590 3.952 3.387 4.612 0.022 11 0 "[ . 1 . 2]" 1
1287 1 46 GLN HE22 1 71 ILE MD . . 4.340 3.264 2.051 4.423 0.083 12 0 "[ . 1 . 2]" 1
1288 1 46 GLN HE22 1 74 VAL MG1 . . 5.300 3.785 2.018 5.063 . 0 0 "[ . 1 . 2]" 1
1289 1 46 GLN QG 1 47 GLY H . . 5.120 3.687 2.916 4.126 . 0 0 "[ . 1 . 2]" 1
1290 1 46 GLN QG 1 71 ILE MD . . 5.180 4.691 3.441 5.008 . 0 0 "[ . 1 . 2]" 1
1291 1 46 GLN QG 1 74 VAL MG1 . . 4.400 3.540 3.003 4.044 . 0 0 "[ . 1 . 2]" 1
1292 1 46 GLN QG 1 74 VAL MG2 . . 4.140 3.056 1.963 3.891 . 0 0 "[ . 1 . 2]" 1
1293 1 46 GLN QG 1 76 TYR QD . . 5.070 3.597 2.363 4.614 . 0 0 "[ . 1 . 2]" 1
1294 1 46 GLN QG 1 76 TYR QE . . 4.670 2.996 2.079 3.920 . 0 0 "[ . 1 . 2]" 1
1295 1 47 GLY H 1 49 GLN H . . 4.890 4.685 3.927 5.197 0.307 3 0 "[ . 1 . 2]" 1
1296 1 47 GLY H 1 74 VAL MG1 . . 5.260 4.919 4.128 5.292 0.032 12 0 "[ . 1 . 2]" 1
1297 1 47 GLY HA2 1 49 GLN H . . 4.850 4.660 4.212 4.859 0.009 9 0 "[ . 1 . 2]" 1
1298 1 47 GLY HA3 1 48 SER H . . 3.480 2.744 2.199 3.611 0.131 3 0 "[ . 1 . 2]" 1
1299 1 47 GLY HA3 1 49 GLN H . . 4.210 4.032 3.616 4.896 0.686 20 2 "[ . - 1 . +]" 1
1300 1 48 SER H 1 49 GLN H . . 3.820 2.836 2.528 3.577 . 0 0 "[ . 1 . 2]" 1
1301 1 48 SER H 1 49 GLN HB2 . . 5.500 4.508 4.145 6.167 0.667 9 1 "[ . +1 . 2]" 1
1302 1 48 SER HB2 1 49 GLN H . . 4.680 4.331 2.274 4.707 0.027 13 0 "[ . 1 . 2]" 1
1303 1 48 SER HB3 1 49 GLN H . . 4.890 4.379 3.615 4.723 . 0 0 "[ . 1 . 2]" 1
1304 1 49 GLN H 1 49 GLN HB2 . . 3.430 2.262 2.087 3.633 0.203 9 0 "[ . 1 . 2]" 1
1305 1 49 GLN H 1 49 GLN HB3 . . 3.640 3.394 2.757 3.687 0.047 3 0 "[ . 1 . 2]" 1
1306 1 49 GLN H 1 49 GLN HG2 . . 3.770 3.512 2.238 3.962 0.192 3 0 "[ . 1 . 2]" 1
1307 1 49 GLN H 1 49 GLN HG3 . . 3.760 3.561 2.673 3.981 0.221 3 0 "[ . 1 . 2]" 1
1308 1 49 GLN H 1 50 GLY H . . 4.500 4.473 4.337 4.627 0.127 3 0 "[ . 1 . 2]" 1
1309 1 49 GLN HA 1 49 GLN HG2 . . 3.670 2.136 2.006 3.905 0.235 9 0 "[ . 1 . 2]" 1
1310 1 49 GLN HA 1 49 GLN HG3 . . 3.430 3.349 3.002 3.615 0.185 9 0 "[ . 1 . 2]" 1
1311 1 49 GLN HA 1 50 GLY H . . 3.080 2.795 2.733 3.126 0.046 3 0 "[ . 1 . 2]" 1
1312 1 49 GLN HA 1 50 GLY HA3 . . 4.610 4.668 4.614 4.799 0.189 9 0 "[ . 1 . 2]" 1
1313 1 49 GLN HB2 1 50 GLY H . . 3.650 3.439 1.897 3.621 . 0 0 "[ . 1 . 2]" 1
1314 1 49 GLN HB2 1 50 GLY HA2 . . 5.500 5.421 4.613 5.583 0.083 3 0 "[ . 1 . 2]" 1
1315 1 49 GLN HB3 1 49 GLN HG2 . . 2.840 2.868 2.356 2.920 0.080 18 0 "[ . 1 . 2]" 1
1316 1 49 GLN HB3 1 49 GLN HG3 . . 2.860 2.884 2.851 3.022 0.162 9 0 "[ . 1 . 2]" 1
1317 1 49 GLN HB3 1 50 GLY H . . 3.420 2.052 1.790 3.476 0.056 9 0 "[ . 1 . 2]" 1
1318 1 49 GLN HB3 1 50 GLY HA3 . . 4.880 4.150 3.915 5.695 0.815 9 1 "[ . +1 . 2]" 1
1319 1 49 GLN HG2 1 50 GLY H . . 4.480 3.691 2.706 4.072 . 0 0 "[ . 1 . 2]" 1
1320 1 49 GLN HG3 1 50 GLY H . . 4.400 4.335 2.843 4.514 0.114 20 0 "[ . 1 . 2]" 1
1321 1 50 GLY H 1 51 TRP H . . 4.570 4.587 4.350 4.641 0.071 15 0 "[ . 1 . 2]" 1
1322 1 50 GLY HA2 1 51 TRP H . . 3.180 2.242 2.200 2.332 . 0 0 "[ . 1 . 2]" 1
1323 1 50 GLY HA2 1 51 TRP HA . . 4.260 4.337 4.310 4.388 0.128 18 0 "[ . 1 . 2]" 1
1324 1 50 GLY HA2 1 51 TRP HD1 . . 5.130 4.573 4.095 4.985 . 0 0 "[ . 1 . 2]" 1
1325 1 50 GLY HA3 1 51 TRP H . . 3.390 3.146 2.964 3.333 . 0 0 "[ . 1 . 2]" 1
1326 1 51 TRP H 1 51 TRP HB2 . . 3.560 2.269 2.217 2.333 . 0 0 "[ . 1 . 2]" 1
1327 1 51 TRP H 1 51 TRP HB3 . . 3.970 3.507 3.486 3.529 . 0 0 "[ . 1 . 2]" 1
1328 1 51 TRP H 1 51 TRP HD1 . . 3.820 3.004 2.639 3.252 . 0 0 "[ . 1 . 2]" 1
1329 1 51 TRP H 1 51 TRP HE1 . . 5.280 5.142 4.889 5.328 0.048 8 0 "[ . 1 . 2]" 1
1330 1 51 TRP H 1 52 GLU H . . 5.270 4.469 4.329 4.627 . 0 0 "[ . 1 . 2]" 1
1331 1 51 TRP HA 1 51 TRP HD1 . . 5.080 4.250 4.147 4.376 . 0 0 "[ . 1 . 2]" 1
1332 1 51 TRP HA 1 51 TRP HE3 . . 3.700 2.646 2.355 2.972 . 0 0 "[ . 1 . 2]" 1
1333 1 51 TRP HA 1 52 GLU H . . 2.990 2.221 2.205 2.269 . 0 0 "[ . 1 . 2]" 1
1334 1 51 TRP HA 1 52 GLU HB3 . . 4.850 4.562 4.219 5.657 0.807 16 2 "[ . 1 -+ 2]" 1
1335 1 51 TRP HA 1 52 GLU QG . . 5.090 4.231 3.328 4.863 . 0 0 "[ . 1 . 2]" 1
1336 1 51 TRP HB2 1 52 GLU H . . 4.660 4.504 4.229 4.615 . 0 0 "[ . 1 . 2]" 1
1337 1 51 TRP HB3 1 51 TRP HE3 . . 4.080 2.734 2.573 2.870 . 0 0 "[ . 1 . 2]" 1
1338 1 51 TRP HB3 1 52 GLU H . . 4.370 3.646 3.126 3.930 . 0 0 "[ . 1 . 2]" 1
1339 1 51 TRP HD1 1 79 ARG QH1 . . 4.750 2.940 2.710 3.193 . 0 0 "[ . 1 . 2]" 1
1340 1 51 TRP HE1 1 79 ARG QH2 . . 4.510 5.671 3.289 5.977 1.467 1 19 "[+** ***********-****]" 1
1341 1 51 TRP HE3 1 52 GLU H . . 4.550 3.333 2.816 3.846 . 0 0 "[ . 1 . 2]" 1
1342 1 51 TRP HE3 1 78 PHE HA . . 5.200 4.692 4.342 5.151 . 0 0 "[ . 1 . 2]" 1
1343 1 51 TRP HE3 1 79 ARG H . . 5.500 5.123 4.744 5.558 0.058 4 0 "[ . 1 . 2]" 1
1344 1 51 TRP HE3 1 79 ARG HG2 . . 4.970 3.763 3.482 4.172 . 0 0 "[ . 1 . 2]" 1
1345 1 51 TRP HH2 1 77 GLU H . . 5.210 5.098 4.874 5.246 0.036 16 0 "[ . 1 . 2]" 1
1346 1 51 TRP HH2 1 77 GLU HB2 . . 4.060 3.098 2.836 3.330 . 0 0 "[ . 1 . 2]" 1
1347 1 51 TRP HH2 1 77 GLU HB3 . . 3.740 2.030 1.968 2.194 . 0 0 "[ . 1 . 2]" 1
1348 1 51 TRP HH2 1 77 GLU QG . . 3.900 3.641 3.372 3.946 0.046 4 0 "[ . 1 . 2]" 1
1349 1 51 TRP HH2 1 78 PHE H . . 4.630 3.059 2.751 3.311 . 0 0 "[ . 1 . 2]" 1
1350 1 51 TRP HH2 1 78 PHE HA . . 4.770 4.241 3.859 4.646 . 0 0 "[ . 1 . 2]" 1
1351 1 51 TRP HH2 1 79 ARG H . . 5.330 5.015 4.539 5.305 . 0 0 "[ . 1 . 2]" 1
1352 1 51 TRP HH2 1 79 ARG QB . . 4.500 3.315 3.054 3.574 . 0 0 "[ . 1 . 2]" 1
1353 1 51 TRP HH2 1 79 ARG QD . . 4.860 3.612 3.407 3.816 . 0 0 "[ . 1 . 2]" 1
1354 1 51 TRP HH2 1 79 ARG HG2 . . 5.300 4.600 4.074 4.876 . 0 0 "[ . 1 . 2]" 1
1355 1 51 TRP HH2 1 94 THR HA . . 4.870 4.387 4.231 4.669 . 0 0 "[ . 1 . 2]" 1
1356 1 51 TRP HH2 1 94 THR HB . . 4.660 4.656 4.494 4.722 0.062 13 0 "[ . 1 . 2]" 1
1357 1 51 TRP HH2 1 94 THR MG . . 3.170 1.979 1.870 2.145 . 0 0 "[ . 1 . 2]" 1
1358 1 51 TRP HZ2 1 77 GLU HB2 . . 5.500 4.513 4.216 4.816 . 0 0 "[ . 1 . 2]" 1
1359 1 51 TRP HZ2 1 77 GLU HB3 . . 5.040 4.089 3.912 4.302 . 0 0 "[ . 1 . 2]" 1
1360 1 51 TRP HZ2 1 77 GLU QG . . 4.920 4.817 4.627 4.941 0.021 4 0 "[ . 1 . 2]" 1
1361 1 51 TRP HZ2 1 79 ARG QD . . 4.720 3.794 3.506 3.983 . 0 0 "[ . 1 . 2]" 1
1362 1 51 TRP HZ2 1 94 THR HB . . 5.500 5.318 4.992 5.532 0.032 14 0 "[ . 1 . 2]" 1
1363 1 51 TRP HZ2 1 94 THR MG . . 3.690 2.716 2.388 3.038 . 0 0 "[ . 1 . 2]" 1
1364 1 51 TRP HZ3 1 77 GLU HB2 . . 5.470 3.531 3.215 3.780 . 0 0 "[ . 1 . 2]" 1
1365 1 51 TRP HZ3 1 77 GLU HB3 . . 4.960 3.104 2.767 3.437 . 0 0 "[ . 1 . 2]" 1
1366 1 51 TRP HZ3 1 78 PHE HA . . 3.360 2.760 2.369 3.145 . 0 0 "[ . 1 . 2]" 1
1367 1 51 TRP HZ3 1 79 ARG H . . 3.920 3.724 3.322 3.928 0.008 4 0 "[ . 1 . 2]" 1
1368 1 51 TRP HZ3 1 79 ARG QB . . 4.590 3.611 3.372 3.884 . 0 0 "[ . 1 . 2]" 1
1369 1 51 TRP HZ3 1 79 ARG QD . . 4.650 3.191 2.717 3.515 . 0 0 "[ . 1 . 2]" 1
1370 1 51 TRP HZ3 1 79 ARG HG2 . . 4.700 3.349 2.964 3.561 . 0 0 "[ . 1 . 2]" 1
1371 1 51 TRP HZ3 1 79 ARG HG3 . . 5.180 4.994 4.702 5.230 0.050 20 0 "[ . 1 . 2]" 1
1372 1 52 GLU H 1 52 GLU HB3 . . 3.910 2.809 2.530 3.795 . 0 0 "[ . 1 . 2]" 1
1373 1 52 GLU H 1 52 GLU QG . . 4.380 2.341 2.064 3.405 . 0 0 "[ . 1 . 2]" 1
1374 1 52 GLU H 1 53 VAL QG . . 5.460 4.933 4.649 5.100 . 0 0 "[ . 1 . 2]" 1
1375 1 52 GLU HA 1 52 GLU QG . . 3.700 3.201 2.054 3.328 . 0 0 "[ . 1 . 2]" 1
1376 1 52 GLU HA 1 53 VAL H . . 3.020 2.219 2.202 2.267 . 0 0 "[ . 1 . 2]" 1
1377 1 52 GLU HA 1 53 VAL HB . . 4.840 4.586 4.394 5.403 0.563 19 2 "[ . 1 . -+2]" 1
1378 1 52 GLU HA 1 53 VAL QG . . 4.070 3.627 3.058 3.847 . 0 0 "[ . 1 . 2]" 1
1379 1 52 GLU HB2 1 53 VAL H . . 4.010 3.669 3.188 4.412 0.402 16 0 "[ . 1 . 2]" 1
1380 1 52 GLU HB2 1 53 VAL QG . . 5.260 4.927 4.053 5.480 0.220 16 0 "[ . 1 . 2]" 1
1381 1 52 GLU HB2 1 54 LEU QD . . 4.320 3.690 2.220 4.147 . 0 0 "[ . 1 . 2]" 1
1382 1 52 GLU HB3 1 53 VAL H . . 4.790 4.382 3.358 4.590 . 0 0 "[ . 1 . 2]" 1
1383 1 52 GLU HB3 1 54 LEU QD . . 4.240 4.043 2.431 4.267 0.027 11 0 "[ . 1 . 2]" 1
1384 1 52 GLU QG 1 53 VAL H . . 4.730 3.944 3.272 4.369 . 0 0 "[ . 1 . 2]" 1
1385 1 52 GLU QG 1 54 LEU QD . . 4.240 1.991 1.666 3.966 . 0 0 "[ . 1 . 2]" 1
1386 1 53 VAL H 1 53 VAL HB . . 3.050 2.476 2.194 3.458 0.408 18 0 "[ . 1 . 2]" 1
1387 1 53 VAL H 1 53 VAL QG . . 3.030 2.126 1.729 2.618 . 0 0 "[ . 1 . 2]" 1
1388 1 53 VAL HA 1 53 VAL QG . . 3.130 2.153 2.042 2.576 . 0 0 "[ . 1 . 2]" 1
1389 1 53 VAL HA 1 54 LEU H . . 3.130 2.208 2.182 2.269 . 0 0 "[ . 1 . 2]" 1
1390 1 53 VAL HA 1 54 LEU QD . . 5.120 4.048 3.619 4.358 . 0 0 "[ . 1 . 2]" 1
1391 1 53 VAL HA 1 54 LEU HG . . 4.090 3.913 3.682 4.114 0.024 16 0 "[ . 1 . 2]" 1
1392 1 53 VAL HA 1 55 ASP H . . 4.150 3.741 3.389 4.020 . 0 0 "[ . 1 . 2]" 1
1393 1 53 VAL HB 1 54 LEU H . . 5.000 4.454 3.821 4.617 . 0 0 "[ . 1 . 2]" 1
1394 1 53 VAL QG 1 54 LEU H . . 3.750 3.107 2.736 3.456 . 0 0 "[ . 1 . 2]" 1
1395 1 53 VAL QG 1 54 LEU HA . . 4.630 4.069 3.795 4.248 . 0 0 "[ . 1 . 2]" 1
1396 1 53 VAL QG 1 55 ASP H . . 3.450 2.719 2.301 3.177 . 0 0 "[ . 1 . 2]" 1
1397 1 53 VAL QG 1 55 ASP HA . . 4.130 3.394 3.171 3.625 . 0 0 "[ . 1 . 2]" 1
1398 1 53 VAL QG 1 56 PRO HA . . 3.440 2.795 2.412 3.332 . 0 0 "[ . 1 . 2]" 1
1399 1 53 VAL QG 1 56 PRO QB . . 3.230 2.167 1.920 2.445 . 0 0 "[ . 1 . 2]" 1
1400 1 53 VAL QG 1 56 PRO HD2 . . 4.210 3.552 3.195 3.849 . 0 0 "[ . 1 . 2]" 1
1401 1 53 VAL QG 1 56 PRO HD3 . . 3.850 2.241 1.853 2.665 . 0 0 "[ . 1 . 2]" 1
1402 1 53 VAL QG 1 56 PRO HG2 . . 5.040 3.630 3.247 3.955 . 0 0 "[ . 1 . 2]" 1
1403 1 53 VAL QG 1 56 PRO HG3 . . 4.800 2.387 1.888 2.855 . 0 0 "[ . 1 . 2]" 1
1404 1 54 LEU H 1 54 LEU HB2 . . 4.100 2.544 2.376 2.666 . 0 0 "[ . 1 . 2]" 1
1405 1 54 LEU H 1 54 LEU QD . . 4.280 2.863 2.398 3.166 . 0 0 "[ . 1 . 2]" 1
1406 1 54 LEU H 1 54 LEU HG . . 4.040 2.158 1.986 2.480 . 0 0 "[ . 1 . 2]" 1
1407 1 54 LEU H 1 55 ASP H . . 3.580 2.533 2.271 2.685 . 0 0 "[ . 1 . 2]" 1
1408 1 54 LEU HA 1 54 LEU QD . . 2.820 1.954 1.910 2.023 . 0 0 "[ . 1 . 2]" 1
1409 1 54 LEU HA 1 54 LEU HG . . 3.910 3.286 3.079 3.512 . 0 0 "[ . 1 . 2]" 1
1410 1 54 LEU HB2 1 54 LEU QD . . 3.270 2.308 2.216 2.453 . 0 0 "[ . 1 . 2]" 1
1411 1 54 LEU HB2 1 55 ASP H . . 4.210 2.700 2.464 3.261 . 0 0 "[ . 1 . 2]" 1
1412 1 54 LEU HB2 1 55 ASP HB2 . . 5.170 3.570 3.381 3.811 . 0 0 "[ . 1 . 2]" 1
1413 1 54 LEU HB3 1 54 LEU QD . . 3.240 2.104 2.012 2.157 . 0 0 "[ . 1 . 2]" 1
1414 1 54 LEU HB3 1 55 ASP H . . 4.330 3.851 3.523 4.310 . 0 0 "[ . 1 . 2]" 1
1415 1 54 LEU QD 1 55 ASP H . . 4.790 4.075 3.941 4.211 . 0 0 "[ . 1 . 2]" 1
1416 1 54 LEU QD 1 70 LEU QD . . 3.660 2.776 2.160 3.066 . 0 0 "[ . 1 . 2]" 1
1417 1 54 LEU QD 1 76 TYR QD . . 4.620 3.264 3.093 3.411 . 0 0 "[ . 1 . 2]" 1
1418 1 54 LEU QD 1 76 TYR QE . . 4.230 3.274 3.045 3.489 . 0 0 "[ . 1 . 2]" 1
1419 1 54 LEU QD 1 78 PHE HA . . 4.530 3.537 3.243 3.968 . 0 0 "[ . 1 . 2]" 1
1420 1 54 LEU QD 1 78 PHE HB2 . . 5.140 5.108 5.020 5.208 0.068 16 0 "[ . 1 . 2]" 1
1421 1 54 LEU QD 1 78 PHE HB3 . . 5.000 4.208 4.091 4.344 . 0 0 "[ . 1 . 2]" 1
1422 1 54 LEU QD 1 78 PHE QD . . 3.430 2.015 1.923 2.216 . 0 0 "[ . 1 . 2]" 1
1423 1 54 LEU QD 1 78 PHE QE . . 3.260 1.876 1.810 2.247 . 0 0 "[ . 1 . 2]" 1
1424 1 54 LEU QD 1 78 PHE HZ . . 4.160 3.682 3.307 4.137 . 0 0 "[ . 1 . 2]" 1
1425 1 54 LEU HG 1 55 ASP H . . 4.920 4.161 3.953 4.430 . 0 0 "[ . 1 . 2]" 1
1426 1 55 ASP H 1 56 PRO HD2 . . 5.040 4.605 4.491 4.716 . 0 0 "[ . 1 . 2]" 1
1427 1 55 ASP H 1 56 PRO HD3 . . 4.970 3.646 3.468 3.819 . 0 0 "[ . 1 . 2]" 1
1428 1 55 ASP HA 1 56 PRO HD2 . . 3.040 2.253 2.243 2.262 . 0 0 "[ . 1 . 2]" 1
1429 1 55 ASP HA 1 56 PRO HD3 . . 3.160 2.127 2.099 2.167 . 0 0 "[ . 1 . 2]" 1
1430 1 55 ASP HA 1 56 PRO HG2 . . 4.430 4.410 4.408 4.414 . 0 0 "[ . 1 . 2]" 1
1431 1 55 ASP HA 1 56 PRO HG3 . . 4.400 4.342 4.322 4.372 . 0 0 "[ . 1 . 2]" 1
1432 1 55 ASP HA 1 57 ALA H . . 4.530 3.714 3.397 3.964 . 0 0 "[ . 1 . 2]" 1
1433 1 55 ASP HA 1 57 ALA MB . . 5.210 5.129 4.774 5.328 0.118 14 0 "[ . 1 . 2]" 1
1434 1 55 ASP HB2 1 56 PRO HD2 . . 5.210 4.773 4.603 4.901 . 0 0 "[ . 1 . 2]" 1
1435 1 55 ASP HB2 1 56 PRO HD3 . . 5.450 4.773 4.674 4.849 . 0 0 "[ . 1 . 2]" 1
1436 1 55 ASP HB2 1 58 VAL MG2 . . 3.460 3.219 3.004 3.546 0.086 11 0 "[ . 1 . 2]" 1
1437 1 55 ASP HB2 1 65 LEU QD . . 4.620 2.392 1.927 2.976 . 0 0 "[ . 1 . 2]" 1
1438 1 55 ASP HB3 1 56 PRO HD2 . . 4.900 4.426 4.173 4.629 . 0 0 "[ . 1 . 2]" 1
1439 1 55 ASP HB3 1 56 PRO HD3 . . 5.090 4.728 4.617 4.813 . 0 0 "[ . 1 . 2]" 1
1440 1 55 ASP HB3 1 58 VAL MG2 . . 3.720 2.004 1.822 2.227 . 0 0 "[ . 1 . 2]" 1
1441 1 55 ASP HB3 1 65 LEU QD . . 4.630 2.816 2.475 3.134 . 0 0 "[ . 1 . 2]" 1
1442 1 56 PRO HA 1 57 ALA MB . . 5.110 4.808 4.757 4.866 . 0 0 "[ . 1 . 2]" 1
1443 1 56 PRO HA 1 83 PHE QE . . 5.260 4.200 3.466 4.589 . 0 0 "[ . 1 . 2]" 1
1444 1 56 PRO QB 1 57 ALA H . . 4.630 3.215 2.981 3.550 . 0 0 "[ . 1 . 2]" 1
1445 1 56 PRO QB 1 57 ALA MB . . 4.110 3.769 3.643 4.002 . 0 0 "[ . 1 . 2]" 1
1446 1 56 PRO HD2 1 57 ALA H . . 3.900 2.296 2.254 2.387 . 0 0 "[ . 1 . 2]" 1
1447 1 56 PRO HD2 1 57 ALA MB . . 4.230 3.631 3.432 3.753 . 0 0 "[ . 1 . 2]" 1
1448 1 56 PRO HD3 1 57 ALA H . . 4.390 3.684 3.656 3.718 . 0 0 "[ . 1 . 2]" 1
1449 1 56 PRO HD3 1 57 ALA MB . . 5.150 5.062 4.922 5.145 . 0 0 "[ . 1 . 2]" 1
1450 1 56 PRO HG2 1 57 ALA H . . 4.400 2.893 2.597 3.383 . 0 0 "[ . 1 . 2]" 1
1451 1 56 PRO HG2 1 57 ALA MB . . 3.790 3.503 3.394 3.675 . 0 0 "[ . 1 . 2]" 1
1452 1 56 PRO HG3 1 57 ALA H . . 4.900 4.118 3.930 4.435 . 0 0 "[ . 1 . 2]" 1
1453 1 56 PRO HG3 1 57 ALA MB . . 5.060 4.967 4.897 5.080 0.020 20 0 "[ . 1 . 2]" 1
1454 1 57 ALA H 1 57 ALA MB . . 3.350 2.167 2.069 2.250 . 0 0 "[ . 1 . 2]" 1
1455 1 57 ALA H 1 58 VAL MG2 . . 4.300 3.566 3.301 3.810 . 0 0 "[ . 1 . 2]" 1
1456 1 57 ALA HA 1 58 VAL H . . 3.470 2.212 2.193 2.253 . 0 0 "[ . 1 . 2]" 1
1457 1 57 ALA HA 1 58 VAL MG2 . . 4.570 3.865 3.679 4.129 . 0 0 "[ . 1 . 2]" 1
1458 1 57 ALA HA 1 83 PHE QE . . 4.000 3.747 3.429 3.921 . 0 0 "[ . 1 . 2]" 1
1459 1 57 ALA HA 1 83 PHE HZ . . 4.330 2.999 2.656 3.413 . 0 0 "[ . 1 . 2]" 1
1460 1 57 ALA MB 1 58 VAL H . . 4.330 3.522 3.446 3.616 . 0 0 "[ . 1 . 2]" 1
1461 1 57 ALA MB 1 58 VAL HA . . 4.680 4.115 4.101 4.127 . 0 0 "[ . 1 . 2]" 1
1462 1 57 ALA MB 1 83 PHE QE . . 4.940 4.705 4.531 4.801 . 0 0 "[ . 1 . 2]" 1
1463 1 57 ALA MB 1 83 PHE HZ . . 3.970 3.991 3.937 4.056 0.086 8 0 "[ . 1 . 2]" 1
1464 1 58 VAL H 1 58 VAL HB . . 3.530 2.581 2.486 2.649 . 0 0 "[ . 1 . 2]" 1
1465 1 58 VAL H 1 58 VAL MG1 . . 4.180 3.797 3.681 3.852 . 0 0 "[ . 1 . 2]" 1
1466 1 58 VAL H 1 58 VAL MG2 . . 3.140 2.913 2.769 3.168 0.028 6 0 "[ . 1 . 2]" 1
1467 1 58 VAL H 1 83 PHE QE . . 5.190 3.869 3.494 4.115 . 0 0 "[ . 1 . 2]" 1
1468 1 58 VAL HA 1 58 VAL MG1 . . 3.210 2.469 2.408 2.554 . 0 0 "[ . 1 . 2]" 1
1469 1 58 VAL HA 1 58 VAL MG2 . . 3.210 2.349 2.196 2.456 . 0 0 "[ . 1 . 2]" 1
1470 1 58 VAL HA 1 59 ALA H . . 2.910 2.203 2.183 2.238 . 0 0 "[ . 1 . 2]" 1
1471 1 58 VAL HA 1 59 ALA MB . . 3.870 3.928 3.896 3.963 0.093 2 0 "[ . 1 . 2]" 1
1472 1 58 VAL HA 1 65 LEU QD . . 4.570 4.211 4.049 4.386 . 0 0 "[ . 1 . 2]" 1
1473 1 58 VAL HB 1 59 ALA H . . 5.050 4.295 4.201 4.433 . 0 0 "[ . 1 . 2]" 1
1474 1 58 VAL HB 1 65 LEU QD . . 5.170 4.703 4.576 4.901 . 0 0 "[ . 1 . 2]" 1
1475 1 58 VAL HB 1 80 LEU QD . . 5.230 3.697 3.330 3.901 . 0 0 "[ . 1 . 2]" 1
1476 1 58 VAL MG1 1 59 ALA H . . 3.460 2.500 2.239 2.727 . 0 0 "[ . 1 . 2]" 1
1477 1 58 VAL MG1 1 59 ALA HA . . 4.910 4.210 4.049 4.348 . 0 0 "[ . 1 . 2]" 1
1478 1 58 VAL MG1 1 59 ALA MB . . 4.030 3.165 3.025 3.289 . 0 0 "[ . 1 . 2]" 1
1479 1 58 VAL MG1 1 62 GLU H . . 4.450 4.099 3.939 4.308 . 0 0 "[ . 1 . 2]" 1
1480 1 58 VAL MG1 1 62 GLU HA . . 5.070 5.076 4.908 5.337 0.267 15 0 "[ . 1 . 2]" 1
1481 1 58 VAL MG1 1 62 GLU HB2 . . 4.130 2.649 2.400 3.508 . 0 0 "[ . 1 . 2]" 1
1482 1 58 VAL MG1 1 62 GLU HB3 . . 3.930 3.182 3.018 3.862 . 0 0 "[ . 1 . 2]" 1
1483 1 58 VAL MG1 1 62 GLU HG2 . . 4.470 4.296 1.867 4.576 0.106 18 0 "[ . 1 . 2]" 1
1484 1 58 VAL MG1 1 62 GLU HG3 . . 3.780 3.344 2.859 3.542 . 0 0 "[ . 1 . 2]" 1
1485 1 58 VAL MG1 1 64 GLU H . . 5.500 4.644 4.480 4.965 . 0 0 "[ . 1 . 2]" 1
1486 1 58 VAL MG1 1 65 LEU HA . . 4.950 4.988 4.645 5.191 0.241 15 0 "[ . 1 . 2]" 1
1487 1 58 VAL MG1 1 65 LEU QB . . 4.010 3.015 2.877 3.297 . 0 0 "[ . 1 . 2]" 1
1488 1 58 VAL MG1 1 65 LEU QD . . 3.450 2.878 2.740 3.239 . 0 0 "[ . 1 . 2]" 1
1489 1 58 VAL MG1 1 80 LEU QD . . 4.240 2.950 2.751 3.135 . 0 0 "[ . 1 . 2]" 1
1490 1 58 VAL MG2 1 59 ALA H . . 4.300 4.038 3.842 4.167 . 0 0 "[ . 1 . 2]" 1
1491 1 58 VAL MG2 1 65 LEU QD . . 3.610 2.540 2.314 2.698 . 0 0 "[ . 1 . 2]" 1
1492 1 58 VAL MG2 1 80 LEU QD . . 4.110 3.007 2.801 3.229 . 0 0 "[ . 1 . 2]" 1
1493 1 58 VAL MG2 1 83 PHE QE . . 5.290 4.839 4.461 5.303 0.013 6 0 "[ . 1 . 2]" 1
1494 1 59 ALA H 1 59 ALA MB . . 2.820 2.015 1.962 2.117 . 0 0 "[ . 1 . 2]" 1
1495 1 59 ALA H 1 60 GLY H . . 4.930 4.571 4.511 4.660 . 0 0 "[ . 1 . 2]" 1
1496 1 59 ALA H 1 62 GLU HB2 . . 5.300 3.718 3.326 5.498 0.198 15 0 "[ . 1 . 2]" 1
1497 1 59 ALA H 1 62 GLU HB3 . . 5.500 4.852 4.529 5.552 0.052 13 0 "[ . 1 . 2]" 1
1498 1 59 ALA H 1 62 GLU HG2 . . 4.910 4.388 3.125 4.779 . 0 0 "[ . 1 . 2]" 1
1499 1 59 ALA H 1 62 GLU HG3 . . 4.740 3.389 3.131 3.796 . 0 0 "[ . 1 . 2]" 1
1500 1 59 ALA HA 1 60 GLY H . . 2.870 2.216 2.189 2.334 . 0 0 "[ . 1 . 2]" 1
1501 1 59 ALA HA 1 60 GLY HA2 . . 4.100 4.373 4.363 4.388 0.288 6 0 "[ . 1 . 2]" 1
1502 1 59 ALA HA 1 60 GLY HA3 . . 4.430 4.373 4.371 4.382 . 0 0 "[ . 1 . 2]" 1
1503 1 59 ALA HA 1 61 THR H . . 4.470 3.551 3.470 3.772 . 0 0 "[ . 1 . 2]" 1
1504 1 59 ALA MB 1 60 GLY H . . 3.290 3.184 2.847 3.315 0.025 6 0 "[ . 1 . 2]" 1
1505 1 59 ALA MB 1 60 GLY HA2 . . 4.550 4.472 4.262 4.546 . 0 0 "[ . 1 . 2]" 1
1506 1 59 ALA MB 1 60 GLY HA3 . . 4.860 4.706 4.521 4.787 . 0 0 "[ . 1 . 2]" 1
1507 1 59 ALA MB 1 61 THR H . . 3.320 2.436 2.168 2.637 . 0 0 "[ . 1 . 2]" 1
1508 1 59 ALA MB 1 62 GLU H . . 3.840 2.178 1.899 3.237 . 0 0 "[ . 1 . 2]" 1
1509 1 59 ALA MB 1 62 GLU HA . . 4.540 3.524 3.198 4.135 . 0 0 "[ . 1 . 2]" 1
1510 1 59 ALA MB 1 62 GLU HB2 . . 3.820 2.367 1.950 3.923 0.103 15 0 "[ . 1 . 2]" 1
1511 1 59 ALA MB 1 62 GLU HB3 . . 4.620 3.474 2.845 4.051 . 0 0 "[ . 1 . 2]" 1
1512 1 59 ALA MB 1 62 GLU HG2 . . 3.210 2.133 1.748 2.416 . 0 0 "[ . 1 . 2]" 1
1513 1 59 ALA MB 1 62 GLU HG3 . . 3.420 2.017 1.782 2.414 . 0 0 "[ . 1 . 2]" 1
1514 1 60 GLY H 1 61 THR H . . 3.690 2.643 2.374 2.773 . 0 0 "[ . 1 . 2]" 1
1515 1 60 GLY H 1 61 THR MG . . 5.040 3.557 3.187 3.805 . 0 0 "[ . 1 . 2]" 1
1516 1 60 GLY H 1 62 GLU H . . 5.190 4.102 3.967 4.451 . 0 0 "[ . 1 . 2]" 1
1517 1 60 GLY HA2 1 61 THR MG . . 5.200 4.417 4.217 4.596 . 0 0 "[ . 1 . 2]" 1
1518 1 60 GLY HA2 1 62 GLU H . . 4.930 3.999 3.725 4.369 . 0 0 "[ . 1 . 2]" 1
1519 1 60 GLY HA3 1 61 THR MG . . 5.130 3.530 3.340 3.734 . 0 0 "[ . 1 . 2]" 1
1520 1 60 GLY HA3 1 62 GLU H . . 5.160 4.704 4.559 4.938 . 0 0 "[ . 1 . 2]" 1
1521 1 61 THR H 1 61 THR MG . . 3.280 2.570 2.110 2.885 . 0 0 "[ . 1 . 2]" 1
1522 1 61 THR H 1 62 GLU H . . 3.300 2.010 1.873 2.570 . 0 0 "[ . 1 . 2]" 1
1523 1 61 THR H 1 62 GLU HB2 . . 4.930 3.921 3.715 5.396 0.466 15 0 "[ . 1 . 2]" 1
1524 1 61 THR H 1 62 GLU HB3 . . 5.330 5.282 4.518 5.389 0.059 4 0 "[ . 1 . 2]" 1
1525 1 61 THR H 1 62 GLU HG2 . . 4.580 4.230 3.008 4.522 . 0 0 "[ . 1 . 2]" 1
1526 1 61 THR H 1 62 GLU HG3 . . 5.310 4.947 2.652 5.331 0.021 9 0 "[ . 1 . 2]" 1
1527 1 61 THR HA 1 61 THR MG . . 2.900 2.461 2.351 2.666 . 0 0 "[ . 1 . 2]" 1
1528 1 61 THR HB 1 62 GLU H . . 5.020 4.307 4.005 4.580 . 0 0 "[ . 1 . 2]" 1
1529 1 61 THR MG 1 62 GLU H . . 4.550 4.050 3.704 4.372 . 0 0 "[ . 1 . 2]" 1
1530 1 62 GLU H 1 62 GLU HB2 . . 3.440 2.218 2.075 3.473 0.033 15 0 "[ . 1 . 2]" 1
1531 1 62 GLU H 1 62 GLU HB3 . . 3.790 3.427 3.363 3.591 . 0 0 "[ . 1 . 2]" 1
1532 1 62 GLU H 1 62 GLU HG2 . . 3.590 3.018 2.384 3.362 . 0 0 "[ . 1 . 2]" 1
1533 1 62 GLU H 1 62 GLU HG3 . . 3.950 3.664 1.936 3.983 0.033 3 0 "[ . 1 . 2]" 1
1534 1 62 GLU H 1 63 THR H . . 4.990 4.643 4.533 4.671 . 0 0 "[ . 1 . 2]" 1
1535 1 62 GLU HA 1 62 GLU HG2 . . 3.910 2.491 2.187 4.190 0.280 15 0 "[ . 1 . 2]" 1
1536 1 62 GLU HA 1 62 GLU HG3 . . 4.220 3.567 3.451 3.744 . 0 0 "[ . 1 . 2]" 1
1537 1 62 GLU HA 1 63 THR H . . 2.860 2.407 2.289 2.538 . 0 0 "[ . 1 . 2]" 1
1538 1 62 GLU HA 1 63 THR HA . . 4.960 4.458 4.407 4.516 . 0 0 "[ . 1 . 2]" 1
1539 1 62 GLU HA 1 63 THR MG . . 4.480 3.809 3.487 4.117 . 0 0 "[ . 1 . 2]" 1
1540 1 62 GLU HA 1 64 GLU H . . 3.870 3.823 3.645 4.005 0.135 15 0 "[ . 1 . 2]" 1
1541 1 62 GLU HB2 1 63 THR H . . 4.360 4.021 2.468 4.338 . 0 0 "[ . 1 . 2]" 1
1542 1 62 GLU HB2 1 64 GLU H . . 4.220 4.138 2.385 4.511 0.291 4 0 "[ . 1 . 2]" 1
1543 1 62 GLU HB3 1 63 THR H . . 4.030 2.867 2.477 3.345 . 0 0 "[ . 1 . 2]" 1
1544 1 62 GLU HB3 1 64 GLU H . . 3.830 2.637 2.454 3.816 . 0 0 "[ . 1 . 2]" 1
1545 1 62 GLU HG2 1 63 THR H . . 4.990 4.287 4.036 4.930 . 0 0 "[ . 1 . 2]" 1
1546 1 62 GLU HG2 1 64 GLU H . . 4.800 4.931 4.749 5.484 0.684 16 3 "[ . 1 -* .+ 2]" 1
1547 1 62 GLU HG3 1 63 THR H . . 4.890 4.788 4.548 5.009 0.119 4 0 "[ . 1 . 2]" 1
1548 1 63 THR H 1 63 THR MG . . 4.260 3.214 3.048 3.459 . 0 0 "[ . 1 . 2]" 1
1549 1 63 THR H 1 64 GLU H . . 2.920 1.938 1.784 2.159 . 0 0 "[ . 1 . 2]" 1
1550 1 63 THR H 1 64 GLU HB2 . . 5.500 5.097 3.905 5.495 . 0 0 "[ . 1 . 2]" 1
1551 1 63 THR H 1 64 GLU HB3 . . 5.050 4.925 4.646 5.493 0.443 4 0 "[ . 1 . 2]" 1
1552 1 63 THR H 1 64 GLU HG3 . . 4.840 4.170 2.791 4.815 . 0 0 "[ . 1 . 2]" 1
1553 1 63 THR HA 1 63 THR MG . . 3.130 2.285 2.198 2.394 . 0 0 "[ . 1 . 2]" 1
1554 1 63 THR HB 1 64 GLU H . . 5.090 4.301 4.002 4.440 . 0 0 "[ . 1 . 2]" 1
1555 1 63 THR HG1 1 64 GLU HB3 . . 5.240 4.871 4.037 5.710 0.470 18 0 "[ . 1 . 2]" 1
1556 1 63 THR HG1 1 64 GLU HG3 . . 4.870 4.103 2.457 4.933 0.063 11 0 "[ . 1 . 2]" 1
1557 1 63 THR MG 1 64 GLU H . . 4.670 4.375 4.274 4.472 . 0 0 "[ . 1 . 2]" 1
1558 1 64 GLU H 1 64 GLU HB3 . . 4.010 3.755 3.626 3.934 . 0 0 "[ . 1 . 2]" 1
1559 1 64 GLU H 1 64 GLU HG2 . . 4.670 3.201 2.158 4.703 0.033 6 0 "[ . 1 . 2]" 1
1560 1 64 GLU H 1 64 GLU HG3 . . 4.300 3.513 2.387 4.025 . 0 0 "[ . 1 . 2]" 1
1561 1 64 GLU H 1 65 LEU H . . 5.020 4.363 4.330 4.403 . 0 0 "[ . 1 . 2]" 1
1562 1 64 GLU HA 1 64 GLU HG2 . . 4.260 3.687 3.494 4.178 . 0 0 "[ . 1 . 2]" 1
1563 1 64 GLU HA 1 65 LEU H . . 3.210 2.564 2.495 2.612 . 0 0 "[ . 1 . 2]" 1
1564 1 64 GLU HB2 1 64 GLU HG2 . . 2.930 2.793 2.624 2.917 . 0 0 "[ . 1 . 2]" 1
1565 1 64 GLU HB2 1 65 LEU H . . 3.390 2.554 2.216 3.550 0.160 19 0 "[ . 1 . 2]" 1
1566 1 64 GLU HB3 1 64 GLU HG2 . . 2.850 2.635 2.282 2.937 0.087 13 0 "[ . 1 . 2]" 1
1567 1 64 GLU HB3 1 65 LEU H . . 3.530 3.313 2.345 3.632 0.102 10 0 "[ . 1 . 2]" 1
1568 1 64 GLU HG2 1 65 LEU H . . 4.470 4.549 4.307 4.801 0.331 3 0 "[ . 1 . 2]" 1
1569 1 64 GLU HG3 1 65 LEU H . . 4.750 4.308 3.973 4.534 . 0 0 "[ . 1 . 2]" 1
1570 1 65 LEU H 1 65 LEU QD . . 5.000 4.064 3.776 4.136 . 0 0 "[ . 1 . 2]" 1
1571 1 65 LEU HA 1 65 LEU QD . . 3.060 2.431 1.728 2.701 . 0 0 "[ . 1 . 2]" 1
1572 1 65 LEU HA 1 65 LEU HG . . 3.930 3.083 3.024 3.419 . 0 0 "[ . 1 . 2]" 1
1573 1 65 LEU HA 1 66 LEU H . . 2.810 2.347 2.243 2.376 . 0 0 "[ . 1 . 2]" 1
1574 1 65 LEU HA 1 66 LEU HA . . 4.430 4.342 4.321 4.373 . 0 0 "[ . 1 . 2]" 1
1575 1 65 LEU HA 1 66 LEU HB2 . . 4.800 4.233 4.133 4.488 . 0 0 "[ . 1 . 2]" 1
1576 1 65 LEU HA 1 66 LEU HB3 . . 4.620 4.752 4.354 4.913 0.293 20 0 "[ . 1 . 2]" 1
1577 1 65 LEU QB 1 66 LEU H . . 4.340 3.516 3.487 3.616 . 0 0 "[ . 1 . 2]" 1
1578 1 65 LEU QB 1 67 VAL QG . . 3.730 3.665 3.113 3.839 0.109 18 0 "[ . 1 . 2]" 1
1579 1 65 LEU QD 1 66 LEU H . . 3.420 2.184 1.727 2.379 . 0 0 "[ . 1 . 2]" 1
1580 1 65 LEU QD 1 66 LEU HA . . 4.680 4.248 3.745 4.360 . 0 0 "[ . 1 . 2]" 1
1581 1 65 LEU QD 1 67 VAL H . . 5.260 4.792 4.289 4.951 . 0 0 "[ . 1 . 2]" 1
1582 1 65 LEU QD 1 67 VAL HA . . 5.100 4.160 3.858 4.299 . 0 0 "[ . 1 . 2]" 1
1583 1 65 LEU QD 1 67 VAL QG . . 3.580 2.280 2.065 2.538 . 0 0 "[ . 1 . 2]" 1
1584 1 65 LEU QD 1 80 LEU QD . . 4.960 3.504 2.932 3.895 . 0 0 "[ . 1 . 2]" 1
1585 1 65 LEU HG 1 66 LEU H . . 4.100 2.458 2.160 4.451 0.351 13 0 "[ . 1 . 2]" 1
1586 1 65 LEU HG 1 67 VAL QG . . 4.410 2.949 2.406 4.585 0.175 6 0 "[ . 1 . 2]" 1
1587 1 66 LEU H 1 66 LEU HB2 . . 3.290 2.682 2.502 3.135 . 0 0 "[ . 1 . 2]" 1
1588 1 66 LEU H 1 66 LEU HB3 . . 3.560 2.576 2.422 2.687 . 0 0 "[ . 1 . 2]" 1
1589 1 66 LEU H 1 66 LEU MD1 . . 4.340 4.203 3.977 4.419 0.079 6 0 "[ . 1 . 2]" 1
1590 1 66 LEU H 1 66 LEU MD2 . . 4.430 4.284 4.204 4.407 . 0 0 "[ . 1 . 2]" 1
1591 1 66 LEU H 1 66 LEU HG . . 4.410 4.461 4.218 4.546 0.136 16 0 "[ . 1 . 2]" 1
1592 1 66 LEU H 1 67 VAL H . . 4.770 4.532 4.409 4.598 . 0 0 "[ . 1 . 2]" 1
1593 1 66 LEU HA 1 66 LEU MD1 . . 2.980 2.479 2.088 2.797 . 0 0 "[ . 1 . 2]" 1
1594 1 66 LEU HA 1 66 LEU MD2 . . 3.780 3.852 3.814 3.940 0.160 18 0 "[ . 1 . 2]" 1
1595 1 66 LEU HA 1 66 LEU HG . . 3.710 2.723 2.530 3.340 . 0 0 "[ . 1 . 2]" 1
1596 1 66 LEU HA 1 67 VAL H . . 2.820 2.250 2.191 2.313 . 0 0 "[ . 1 . 2]" 1
1597 1 66 LEU HA 1 67 VAL QG . . 4.020 3.451 3.064 3.780 . 0 0 "[ . 1 . 2]" 1
1598 1 66 LEU HB2 1 66 LEU MD2 . . 3.140 2.645 2.281 2.846 . 0 0 "[ . 1 . 2]" 1
1599 1 66 LEU HB2 1 67 VAL H . . 4.970 4.257 4.124 4.345 . 0 0 "[ . 1 . 2]" 1
1600 1 66 LEU HB3 1 66 LEU MD1 . . 3.250 3.140 3.058 3.219 . 0 0 "[ . 1 . 2]" 1
1601 1 66 LEU HB3 1 67 VAL H . . 4.800 4.014 3.795 4.378 . 0 0 "[ . 1 . 2]" 1
1602 1 66 LEU MD1 1 67 VAL H . . 3.500 3.102 1.970 3.506 0.006 5 0 "[ . 1 . 2]" 1
1603 1 66 LEU MD1 1 68 PRO HD3 . . 5.070 4.184 3.618 4.757 . 0 0 "[ . 1 . 2]" 1
1604 1 66 LEU MD2 1 67 VAL H . . 4.470 4.055 3.762 4.588 0.118 11 0 "[ . 1 . 2]" 1
1605 1 66 LEU MD2 1 68 PRO HB3 . . 4.530 3.218 2.785 4.334 . 0 0 "[ . 1 . 2]" 1
1606 1 66 LEU MD2 1 68 PRO HD3 . . 4.830 2.842 2.374 4.286 . 0 0 "[ . 1 . 2]" 1
1607 1 66 LEU HG 1 67 VAL H . . 4.370 2.513 2.242 3.422 . 0 0 "[ . 1 . 2]" 1
1608 1 66 LEU HG 1 67 VAL HA . . 4.520 4.125 3.911 4.249 . 0 0 "[ . 1 . 2]" 1
1609 1 66 LEU HG 1 68 PRO HD2 . . 4.770 4.336 3.679 4.841 0.071 18 0 "[ . 1 . 2]" 1
1610 1 66 LEU HG 1 68 PRO HD3 . . 4.320 2.645 1.957 3.259 . 0 0 "[ . 1 . 2]" 1
1611 1 66 LEU HG 1 68 PRO QG . . 4.570 3.560 2.618 4.227 . 0 0 "[ . 1 . 2]" 1
1612 1 67 VAL H 1 67 VAL HB . . 3.750 2.877 2.484 3.759 0.009 15 0 "[ . 1 . 2]" 1
1613 1 67 VAL H 1 67 VAL QG . . 3.330 2.694 1.871 3.100 . 0 0 "[ . 1 . 2]" 1
1614 1 67 VAL H 1 68 PRO HD3 . . 5.250 3.207 2.654 3.991 . 0 0 "[ . 1 . 2]" 1
1615 1 67 VAL HA 1 67 VAL QG . . 3.230 2.123 2.032 2.218 . 0 0 "[ . 1 . 2]" 1
1616 1 67 VAL HA 1 68 PRO HD2 . . 3.000 2.250 2.184 2.382 . 0 0 "[ . 1 . 2]" 1
1617 1 67 VAL HA 1 68 PRO HD3 . . 3.020 2.418 2.088 2.684 . 0 0 "[ . 1 . 2]" 1
1618 1 67 VAL HA 1 68 PRO QG . . 4.080 4.015 3.848 4.179 0.099 20 0 "[ . 1 . 2]" 1
1619 1 67 VAL HB 1 70 LEU QD . . 4.000 2.910 1.744 3.500 . 0 0 "[ . 1 . 2]" 1
1620 1 67 VAL HB 1 70 LEU HG . . 5.150 3.908 2.964 5.186 0.036 19 0 "[ . 1 . 2]" 1
1621 1 67 VAL HB 1 78 PHE QE . . 5.500 2.934 2.460 3.351 . 0 0 "[ . 1 . 2]" 1
1622 1 67 VAL QG 1 68 PRO HD2 . . 3.710 3.408 2.722 3.915 0.205 16 0 "[ . 1 . 2]" 1
1623 1 67 VAL QG 1 68 PRO HD3 . . 4.120 3.681 3.453 3.759 . 0 0 "[ . 1 . 2]" 1
1624 1 67 VAL QG 1 69 GLY H . . 4.580 2.643 1.911 3.987 . 0 0 "[ . 1 . 2]" 1
1625 1 67 VAL QG 1 70 LEU H . . 4.700 3.830 2.544 4.348 . 0 0 "[ . 1 . 2]" 1
1626 1 67 VAL QG 1 70 LEU HB2 . . 4.680 4.489 3.916 4.662 . 0 0 "[ . 1 . 2]" 1
1627 1 67 VAL QG 1 70 LEU HB3 . . 4.980 4.940 4.797 5.086 0.106 16 0 "[ . 1 . 2]" 1
1628 1 67 VAL QG 1 70 LEU QD . . 3.220 1.964 1.624 2.575 . 0 0 "[ . 1 . 2]" 1
1629 1 67 VAL QG 1 70 LEU HG . . 3.510 3.011 2.583 3.887 0.377 19 0 "[ . 1 . 2]" 1
1630 1 67 VAL QG 1 78 PHE QD . . 4.900 3.280 2.967 3.670 . 0 0 "[ . 1 . 2]" 1
1631 1 67 VAL QG 1 78 PHE QE . . 4.090 2.020 1.741 2.745 . 0 0 "[ . 1 . 2]" 1
1632 1 67 VAL QG 1 78 PHE HZ . . 4.620 2.540 1.934 3.810 . 0 0 "[ . 1 . 2]" 1
1633 1 68 PRO HB2 1 69 GLY H . . 3.740 3.856 3.579 4.062 0.322 9 0 "[ . 1 . 2]" 1
1634 1 68 PRO HB3 1 69 GLY H . . 4.530 4.524 4.376 4.628 0.098 9 0 "[ . 1 . 2]" 1
1635 1 68 PRO QG 1 69 GLY H . . 4.340 3.457 3.095 3.758 . 0 0 "[ . 1 . 2]" 1
1636 1 68 PRO QG 1 69 GLY HA2 . . 4.900 4.643 4.442 4.773 . 0 0 "[ . 1 . 2]" 1
1637 1 68 PRO QG 1 69 GLY HA3 . . 4.850 4.958 4.831 5.089 0.239 9 0 "[ . 1 . 2]" 1
1638 1 69 GLY H 1 70 LEU H . . 3.960 3.270 2.543 3.746 . 0 0 "[ . 1 . 2]" 1
1639 1 69 GLY H 1 70 LEU QD . . 5.260 3.424 2.671 4.211 . 0 0 "[ . 1 . 2]" 1
1640 1 70 LEU H 1 70 LEU HB2 . . 3.740 2.621 2.336 3.546 . 0 0 "[ . 1 . 2]" 1
1641 1 70 LEU H 1 70 LEU HB3 . . 4.150 3.656 3.516 3.938 . 0 0 "[ . 1 . 2]" 1
1642 1 70 LEU H 1 70 LEU QD . . 4.090 2.521 1.679 3.214 . 0 0 "[ . 1 . 2]" 1
1643 1 70 LEU H 1 70 LEU HG . . 3.650 3.163 2.199 3.853 0.203 20 0 "[ . 1 . 2]" 1
1644 1 70 LEU HA 1 70 LEU QD . . 3.020 1.907 1.787 2.740 . 0 0 "[ . 1 . 2]" 1
1645 1 70 LEU HA 1 70 LEU HG . . 3.980 3.389 2.593 3.722 . 0 0 "[ . 1 . 2]" 1
1646 1 70 LEU HA 1 71 ILE H . . 3.120 2.465 2.406 2.709 . 0 0 "[ . 1 . 2]" 1
1647 1 70 LEU HA 1 71 ILE HB . . 4.810 4.773 4.544 5.009 0.199 17 0 "[ . 1 . 2]" 1
1648 1 70 LEU HA 1 71 ILE MD . . 5.160 4.525 3.485 5.056 . 0 0 "[ . 1 . 2]" 1
1649 1 70 LEU HA 1 71 ILE QG . . 3.470 3.088 2.794 3.411 . 0 0 "[ . 1 . 2]" 1
1650 1 70 LEU HA 1 76 TYR QE . . 4.750 3.159 2.660 3.575 . 0 0 "[ . 1 . 2]" 1
1651 1 70 LEU HB2 1 71 ILE H . . 4.500 3.686 3.085 3.960 . 0 0 "[ . 1 . 2]" 1
1652 1 70 LEU HB3 1 71 ILE H . . 4.300 2.512 2.072 2.639 . 0 0 "[ . 1 . 2]" 1
1653 1 70 LEU HB3 1 76 TYR QD . . 5.150 3.345 2.549 3.855 . 0 0 "[ . 1 . 2]" 1
1654 1 70 LEU HB3 1 76 TYR QE . . 4.390 4.430 4.071 4.680 0.290 11 0 "[ . 1 . 2]" 1
1655 1 70 LEU QD 1 71 ILE H . . 4.100 3.410 3.191 3.876 . 0 0 "[ . 1 . 2]" 1
1656 1 70 LEU QD 1 76 TYR QD . . 3.830 2.399 2.074 2.682 . 0 0 "[ . 1 . 2]" 1
1657 1 70 LEU QD 1 76 TYR QE . . 3.750 3.124 2.496 3.469 . 0 0 "[ . 1 . 2]" 1
1658 1 70 LEU QD 1 78 PHE QE . . 3.870 2.192 1.753 2.527 . 0 0 "[ . 1 . 2]" 1
1659 1 70 LEU QD 1 78 PHE HZ . . 3.500 1.714 1.659 1.903 . 0 0 "[ . 1 . 2]" 1
1660 1 71 ILE H 1 71 ILE HB . . 3.550 2.729 2.481 3.121 . 0 0 "[ . 1 . 2]" 1
1661 1 71 ILE H 1 71 ILE MD . . 4.250 3.998 3.320 4.280 0.030 13 0 "[ . 1 . 2]" 1
1662 1 71 ILE H 1 71 ILE QG . . 3.730 2.492 2.088 2.812 . 0 0 "[ . 1 . 2]" 1
1663 1 71 ILE H 1 71 ILE MG . . 3.900 3.861 3.775 4.005 0.105 11 0 "[ . 1 . 2]" 1
1664 1 71 ILE H 1 74 VAL MG2 . . 5.150 2.644 2.314 2.970 . 0 0 "[ . 1 . 2]" 1
1665 1 71 ILE H 1 76 TYR QE . . 4.190 2.535 1.944 3.771 . 0 0 "[ . 1 . 2]" 1
1666 1 71 ILE HA 1 71 ILE MD . . 3.800 2.878 2.265 3.909 0.109 11 0 "[ . 1 . 2]" 1
1667 1 71 ILE HA 1 71 ILE QG . . 3.790 2.719 2.467 3.131 . 0 0 "[ . 1 . 2]" 1
1668 1 71 ILE HA 1 71 ILE MG . . 3.210 2.227 2.074 2.414 . 0 0 "[ . 1 . 2]" 1
1669 1 71 ILE HA 1 72 LYS H . . 2.930 2.672 2.352 3.317 0.387 19 0 "[ . 1 . 2]" 1
1670 1 71 ILE HA 1 72 LYS HB3 . . 5.120 4.498 4.223 5.759 0.639 12 1 "[ . 1 + . 2]" 1
1671 1 71 ILE HA 1 72 LYS QG . . 4.800 4.270 3.305 4.698 . 0 0 "[ . 1 . 2]" 1
1672 1 71 ILE HB 1 71 ILE MD . . 3.340 2.933 2.401 3.202 . 0 0 "[ . 1 . 2]" 1
1673 1 71 ILE HB 1 72 LYS H . . 4.270 3.072 1.890 3.873 . 0 0 "[ . 1 . 2]" 1
1674 1 71 ILE HB 1 74 VAL MG2 . . 4.060 1.868 1.748 2.172 . 0 0 "[ . 1 . 2]" 1
1675 1 71 ILE HB 1 76 TYR QE . . 4.010 2.562 1.960 3.764 . 0 0 "[ . 1 . 2]" 1
1676 1 71 ILE MD 1 71 ILE MG . . 2.970 1.833 1.725 1.931 . 0 0 "[ . 1 . 2]" 1
1677 1 71 ILE MD 1 72 LYS H . . 4.760 3.817 3.561 4.157 . 0 0 "[ . 1 . 2]" 1
1678 1 71 ILE MD 1 74 VAL MG2 . . 4.250 3.796 2.884 4.087 . 0 0 "[ . 1 . 2]" 1
1679 1 71 ILE MD 1 76 TYR QD . . 5.140 5.079 4.176 5.367 0.227 6 0 "[ . 1 . 2]" 1
1680 1 71 ILE MD 1 76 TYR QE . . 4.970 3.315 2.048 3.593 . 0 0 "[ . 1 . 2]" 1
1681 1 71 ILE QG 1 72 LYS H . . 4.710 4.227 3.719 4.438 . 0 0 "[ . 1 . 2]" 1
1682 1 71 ILE QG 1 74 VAL MG2 . . 4.770 2.989 2.604 3.261 . 0 0 "[ . 1 . 2]" 1
1683 1 71 ILE QG 1 76 TYR QD . . 4.400 3.754 3.536 3.934 . 0 0 "[ . 1 . 2]" 1
1684 1 71 ILE QG 1 76 TYR QE . . 3.910 1.876 1.804 1.940 . 0 0 "[ . 1 . 2]" 1
1685 1 71 ILE MG 1 72 LYS H . . 3.490 1.874 1.731 2.082 . 0 0 "[ . 1 . 2]" 1
1686 1 71 ILE MG 1 72 LYS HA . . 4.640 4.042 3.749 4.308 . 0 0 "[ . 1 . 2]" 1
1687 1 71 ILE MG 1 74 VAL MG1 . . 3.760 2.901 1.975 3.781 0.021 14 0 "[ . 1 . 2]" 1
1688 1 71 ILE MG 1 74 VAL MG2 . . 3.430 2.805 1.933 3.574 0.144 14 0 "[ . 1 . 2]" 1
1689 1 71 ILE MG 1 76 TYR QE . . 4.680 3.931 3.534 4.696 0.016 17 0 "[ . 1 . 2]" 1
1690 1 72 LYS H 1 72 LYS HB2 . . 3.630 3.619 2.534 3.805 0.175 18 0 "[ . 1 . 2]" 1
1691 1 72 LYS H 1 72 LYS HB3 . . 3.900 2.982 2.576 3.685 . 0 0 "[ . 1 . 2]" 1
1692 1 72 LYS H 1 72 LYS QD . . 4.790 3.450 2.425 4.676 . 0 0 "[ . 1 . 2]" 1
1693 1 72 LYS H 1 72 LYS QG . . 3.630 2.200 1.922 3.706 0.076 12 0 "[ . 1 . 2]" 1
1694 1 72 LYS H 1 74 VAL MG2 . . 5.150 3.268 2.333 3.521 . 0 0 "[ . 1 . 2]" 1
1695 1 72 LYS HA 1 72 LYS QD . . 4.180 4.031 3.808 4.251 0.071 19 0 "[ . 1 . 2]" 1
1696 1 72 LYS HA 1 72 LYS QE . . 5.010 4.766 3.840 4.993 . 0 0 "[ . 1 . 2]" 1
1697 1 72 LYS HA 1 72 LYS QG . . 3.580 3.267 2.126 3.371 . 0 0 "[ . 1 . 2]" 1
1698 1 72 LYS HA 1 73 ASP H . . 3.240 2.469 2.236 3.569 0.329 19 0 "[ . 1 . 2]" 1
1699 1 72 LYS HA 1 74 VAL H . . 4.670 3.229 2.880 4.693 0.023 6 0 "[ . 1 . 2]" 1
1700 1 72 LYS HA 1 99 THR HB . . 3.770 3.455 1.986 3.956 0.186 9 0 "[ . 1 . 2]" 1
1701 1 72 LYS HA 1 99 THR MG . . 4.640 2.363 1.732 3.826 . 0 0 "[ . 1 . 2]" 1
1702 1 72 LYS HB2 1 72 LYS QE . . 4.760 3.403 2.213 4.322 . 0 0 "[ . 1 . 2]" 1
1703 1 72 LYS HB2 1 73 ASP H . . 4.430 2.785 1.955 4.416 . 0 0 "[ . 1 . 2]" 1
1704 1 72 LYS HB2 1 73 ASP HA . . 5.240 4.555 3.886 5.975 0.735 12 1 "[ . 1 + . 2]" 1
1705 1 72 LYS HB2 1 74 VAL MG2 . . 5.290 5.186 4.947 5.346 0.056 8 0 "[ . 1 . 2]" 1
1706 1 72 LYS HB3 1 72 LYS QD . . 3.350 2.448 1.973 3.296 . 0 0 "[ . 1 . 2]" 1
1707 1 72 LYS HB3 1 74 VAL MG2 . . 5.200 5.099 4.953 5.296 0.096 6 0 "[ . 1 . 2]" 1
1708 1 72 LYS QE 1 72 LYS QG . . 3.170 2.088 1.937 2.521 . 0 0 "[ . 1 . 2]" 1
1709 1 72 LYS QG 1 73 ASP H . . 4.640 3.644 1.890 4.309 . 0 0 "[ . 1 . 2]" 1
1710 1 72 LYS QG 1 73 ASP QB . . 4.870 3.254 2.624 4.722 . 0 0 "[ . 1 . 2]" 1
1711 1 73 ASP HA 1 100 SER HA . . 3.790 3.898 3.885 3.924 0.134 9 0 "[ . 1 . 2]" 1
1712 1 73 ASP HA 1 100 SER QB . . 4.930 4.642 2.666 4.946 0.016 15 0 "[ . 1 . 2]" 1
1713 1 73 ASP QB 1 74 VAL H . . 4.930 3.688 3.308 4.034 . 0 0 "[ . 1 . 2]" 1
1714 1 74 VAL H 1 74 VAL HB . . 4.100 3.846 3.721 3.964 . 0 0 "[ . 1 . 2]" 1
1715 1 74 VAL H 1 74 VAL MG1 . . 4.000 2.961 2.708 3.186 . 0 0 "[ . 1 . 2]" 1
1716 1 74 VAL H 1 74 VAL MG2 . . 3.500 2.400 2.256 2.643 . 0 0 "[ . 1 . 2]" 1
1717 1 74 VAL H 1 75 LEU H . . 4.590 4.408 4.321 4.492 . 0 0 "[ . 1 . 2]" 1
1718 1 74 VAL H 1 75 LEU HA . . 5.480 4.641 4.493 4.852 . 0 0 "[ . 1 . 2]" 1
1719 1 74 VAL H 1 99 THR H . . 5.120 4.564 3.567 5.149 0.029 17 0 "[ . 1 . 2]" 1
1720 1 74 VAL H 1 99 THR HB . . 5.500 4.838 3.434 5.459 . 0 0 "[ . 1 . 2]" 1
1721 1 74 VAL HA 1 74 VAL MG1 . . 3.390 2.361 2.190 2.446 . 0 0 "[ . 1 . 2]" 1
1722 1 74 VAL HA 1 74 VAL MG2 . . 3.720 3.208 3.200 3.216 . 0 0 "[ . 1 . 2]" 1
1723 1 74 VAL HA 1 75 LEU H . . 3.070 2.514 2.344 2.653 . 0 0 "[ . 1 . 2]" 1
1724 1 74 VAL HA 1 75 LEU HB2 . . 5.080 4.035 3.942 4.201 . 0 0 "[ . 1 . 2]" 1
1725 1 74 VAL HA 1 75 LEU HB3 . . 4.690 4.923 4.656 5.107 0.417 6 0 "[ . 1 . 2]" 1
1726 1 74 VAL HA 1 99 THR MG . . 5.080 4.683 3.999 5.116 0.036 18 0 "[ . 1 . 2]" 1
1727 1 74 VAL HB 1 75 LEU H . . 3.400 2.436 2.129 2.800 . 0 0 "[ . 1 . 2]" 1
1728 1 74 VAL HB 1 75 LEU HB3 . . 5.250 5.272 4.985 5.576 0.326 9 0 "[ . 1 . 2]" 1
1729 1 74 VAL HB 1 76 TYR QE . . 4.770 4.219 3.765 4.724 . 0 0 "[ . 1 . 2]" 1
1730 1 74 VAL MG1 1 75 LEU H . . 3.870 3.809 3.586 3.916 0.046 18 0 "[ . 1 . 2]" 1
1731 1 74 VAL MG1 1 76 TYR QD . . 4.970 4.458 4.274 4.669 . 0 0 "[ . 1 . 2]" 1
1732 1 74 VAL MG1 1 76 TYR QE . . 4.610 3.979 3.614 4.423 . 0 0 "[ . 1 . 2]" 1
1733 1 74 VAL MG2 1 75 LEU H . . 4.030 3.325 3.016 3.624 . 0 0 "[ . 1 . 2]" 1
1734 1 74 VAL MG2 1 76 TYR QD . . 3.920 2.021 1.819 2.198 . 0 0 "[ . 1 . 2]" 1
1735 1 74 VAL MG2 1 76 TYR QE . . 3.690 2.216 1.916 2.637 . 0 0 "[ . 1 . 2]" 1
1736 1 74 VAL MG2 1 99 THR HB . . 5.430 5.025 4.240 5.438 0.008 19 0 "[ . 1 . 2]" 1
1737 1 74 VAL MG2 1 99 THR MG . . 4.450 3.017 2.398 3.639 . 0 0 "[ . 1 . 2]" 1
1738 1 75 LEU H 1 75 LEU HB2 . . 3.590 2.789 2.519 3.014 . 0 0 "[ . 1 . 2]" 1
1739 1 75 LEU H 1 75 LEU HB3 . . 3.410 2.868 2.618 3.041 . 0 0 "[ . 1 . 2]" 1
1740 1 75 LEU H 1 75 LEU MD1 . . 4.400 4.056 3.976 4.121 . 0 0 "[ . 1 . 2]" 1
1741 1 75 LEU H 1 75 LEU MD2 . . 4.680 4.219 3.952 4.451 . 0 0 "[ . 1 . 2]" 1
1742 1 75 LEU HA 1 75 LEU MD1 . . 3.660 1.984 1.782 2.613 . 0 0 "[ . 1 . 2]" 1
1743 1 75 LEU HA 1 75 LEU MD2 . . 3.690 2.694 1.987 3.117 . 0 0 "[ . 1 . 2]" 1
1744 1 75 LEU HA 1 76 TYR H . . 3.250 2.246 2.227 2.262 . 0 0 "[ . 1 . 2]" 1
1745 1 75 LEU HA 1 98 SER HA . . 3.910 3.734 3.550 3.941 0.031 4 0 "[ . 1 . 2]" 1
1746 1 75 LEU HB2 1 75 LEU MD1 . . 3.640 3.140 3.050 3.206 . 0 0 "[ . 1 . 2]" 1
1747 1 75 LEU HB2 1 75 LEU MD2 . . 3.450 2.094 1.953 2.381 . 0 0 "[ . 1 . 2]" 1
1748 1 75 LEU HB2 1 75 LEU HG . . 3.010 2.673 2.474 2.804 . 0 0 "[ . 1 . 2]" 1
1749 1 75 LEU HB3 1 76 TYR H . . 4.700 4.413 4.342 4.513 . 0 0 "[ . 1 . 2]" 1
1750 1 75 LEU HB3 1 96 ASN QB . . 4.930 4.458 3.967 4.951 0.021 12 0 "[ . 1 . 2]" 1
1751 1 75 LEU MD1 1 76 TYR H . . 4.230 2.602 2.448 3.100 . 0 0 "[ . 1 . 2]" 1
1752 1 75 LEU MD1 1 77 GLU QG . . 4.490 3.166 2.534 4.134 . 0 0 "[ . 1 . 2]" 1
1753 1 75 LEU MD1 1 96 ASN QB . . 3.630 1.756 1.632 1.842 . 0 0 "[ . 1 . 2]" 1
1754 1 75 LEU MD1 1 96 ASN HD21 . . 4.940 3.014 2.182 4.011 . 0 0 "[ . 1 . 2]" 1
1755 1 75 LEU MD1 1 96 ASN HD22 . . 5.190 3.745 2.798 5.144 . 0 0 "[ . 1 . 2]" 1
1756 1 75 LEU MD1 1 97 VAL H . . 4.660 2.428 1.795 2.893 . 0 0 "[ . 1 . 2]" 1
1757 1 75 LEU MD1 1 98 SER H . . 4.680 4.259 3.408 4.779 0.099 20 0 "[ . 1 . 2]" 1
1758 1 75 LEU MD1 1 98 SER HA . . 4.280 3.210 2.101 4.113 . 0 0 "[ . 1 . 2]" 1
1759 1 75 LEU MD1 1 98 SER HB2 . . 4.900 4.208 3.413 4.896 . 0 0 "[ . 1 . 2]" 1
1760 1 75 LEU MD2 1 76 TYR H . . 4.820 4.419 3.750 4.911 0.091 10 0 "[ . 1 . 2]" 1
1761 1 75 LEU MD2 1 96 ASN QB . . 4.600 3.640 2.667 4.114 . 0 0 "[ . 1 . 2]" 1
1762 1 75 LEU MD2 1 96 ASN HD21 . . 5.230 4.591 3.674 5.294 0.064 3 0 "[ . 1 . 2]" 1
1763 1 75 LEU MD2 1 97 VAL HA . . 4.950 4.516 3.660 5.112 0.162 6 0 "[ . 1 . 2]" 1
1764 1 75 LEU MD2 1 98 SER HA . . 4.330 2.364 1.961 2.764 . 0 0 "[ . 1 . 2]" 1
1765 1 75 LEU MD2 1 98 SER HB2 . . 4.370 2.940 2.454 3.482 . 0 0 "[ . 1 . 2]" 1
1766 1 75 LEU MD2 1 98 SER HB3 . . 4.210 4.148 3.863 4.259 0.049 16 0 "[ . 1 . 2]" 1
1767 1 75 LEU HG 1 76 TYR H . . 5.410 5.206 4.967 5.407 . 0 0 "[ . 1 . 2]" 1
1768 1 75 LEU HG 1 77 GLU QG . . 4.470 4.530 4.210 4.715 0.245 9 0 "[ . 1 . 2]" 1
1769 1 75 LEU HG 1 96 ASN QB . . 5.140 3.462 2.947 3.988 . 0 0 "[ . 1 . 2]" 1
1770 1 75 LEU HG 1 98 SER HA . . 5.260 5.058 4.695 5.299 0.039 19 0 "[ . 1 . 2]" 1
1771 1 76 TYR H 1 76 TYR HB2 . . 4.150 1.910 1.890 1.935 . 0 0 "[ . 1 . 2]" 1
1772 1 76 TYR H 1 76 TYR QD . . 4.710 2.925 2.787 3.152 . 0 0 "[ . 1 . 2]" 1
1773 1 76 TYR H 1 76 TYR QE . . 5.010 5.236 5.117 5.378 0.368 9 0 "[ . 1 . 2]" 1
1774 1 76 TYR H 1 97 VAL H . . 4.970 3.664 3.425 3.841 . 0 0 "[ . 1 . 2]" 1
1775 1 76 TYR H 1 98 SER HA . . 5.060 5.102 4.966 5.215 0.155 17 0 "[ . 1 . 2]" 1
1776 1 76 TYR HB2 1 77 GLU H . . 4.630 4.514 4.351 4.606 . 0 0 "[ . 1 . 2]" 1
1777 1 76 TYR HB2 1 78 PHE QE . . 4.570 4.045 3.488 4.428 . 0 0 "[ . 1 . 2]" 1
1778 1 76 TYR HB2 1 78 PHE HZ . . 5.280 4.068 3.463 4.551 . 0 0 "[ . 1 . 2]" 1
1779 1 76 TYR HB2 1 97 VAL QG . . 4.210 3.217 2.931 3.463 . 0 0 "[ . 1 . 2]" 1
1780 1 76 TYR HB3 1 77 GLU H . . 4.550 3.548 3.219 3.759 . 0 0 "[ . 1 . 2]" 1
1781 1 76 TYR HB3 1 78 PHE QD . . 5.500 4.522 4.121 4.731 . 0 0 "[ . 1 . 2]" 1
1782 1 76 TYR HB3 1 78 PHE QE . . 4.710 3.291 2.621 3.731 . 0 0 "[ . 1 . 2]" 1
1783 1 76 TYR HB3 1 78 PHE HZ . . 5.220 3.135 2.537 3.600 . 0 0 "[ . 1 . 2]" 1
1784 1 76 TYR HB3 1 97 VAL QG . . 4.910 3.807 3.377 4.063 . 0 0 "[ . 1 . 2]" 1
1785 1 76 TYR QD 1 77 GLU H . . 4.440 3.754 2.930 4.336 . 0 0 "[ . 1 . 2]" 1
1786 1 76 TYR QD 1 97 VAL QG . . 4.920 4.495 4.263 4.709 . 0 0 "[ . 1 . 2]" 1
1787 1 77 GLU H 1 77 GLU HB2 . . 3.990 2.235 2.174 2.292 . 0 0 "[ . 1 . 2]" 1
1788 1 77 GLU H 1 77 GLU QG . . 4.130 3.159 2.989 3.335 . 0 0 "[ . 1 . 2]" 1
1789 1 77 GLU H 1 78 PHE H . . 5.320 4.492 4.449 4.546 . 0 0 "[ . 1 . 2]" 1
1790 1 77 GLU HA 1 77 GLU QG . . 3.400 2.205 2.119 2.265 . 0 0 "[ . 1 . 2]" 1
1791 1 77 GLU HA 1 78 PHE H . . 2.990 2.704 2.625 2.734 . 0 0 "[ . 1 . 2]" 1
1792 1 77 GLU HA 1 78 PHE HA . . 5.140 4.605 4.555 4.622 . 0 0 "[ . 1 . 2]" 1
1793 1 77 GLU HA 1 78 PHE HB2 . . 4.950 4.276 4.137 4.395 . 0 0 "[ . 1 . 2]" 1
1794 1 77 GLU HA 1 78 PHE QD . . 4.480 3.519 2.871 3.955 . 0 0 "[ . 1 . 2]" 1
1795 1 77 GLU HA 1 78 PHE QE . . 5.460 4.548 3.843 4.876 . 0 0 "[ . 1 . 2]" 1
1796 1 77 GLU HA 1 94 THR MG . . 4.270 3.828 3.497 4.190 . 0 0 "[ . 1 . 2]" 1
1797 1 77 GLU HA 1 95 ALA H . . 4.700 4.542 4.153 4.814 0.114 17 0 "[ . 1 . 2]" 1
1798 1 77 GLU HA 1 95 ALA MB . . 5.340 4.808 4.368 5.124 . 0 0 "[ . 1 . 2]" 1
1799 1 77 GLU HA 1 96 ASN H . . 4.790 4.567 4.385 4.773 . 0 0 "[ . 1 . 2]" 1
1800 1 77 GLU HA 1 96 ASN HA . . 3.320 2.481 2.164 2.683 . 0 0 "[ . 1 . 2]" 1
1801 1 77 GLU HA 1 96 ASN QB . . 4.050 2.422 1.920 3.598 . 0 0 "[ . 1 . 2]" 1
1802 1 77 GLU HA 1 96 ASN HD21 . . 5.500 4.458 3.756 5.480 . 0 0 "[ . 1 . 2]" 1
1803 1 77 GLU HA 1 97 VAL H . . 4.460 4.191 3.629 4.476 0.016 16 0 "[ . 1 . 2]" 1
1804 1 77 GLU HB2 1 78 PHE H . . 4.630 3.559 3.491 3.651 . 0 0 "[ . 1 . 2]" 1
1805 1 77 GLU HB3 1 78 PHE H . . 4.150 2.072 2.000 2.213 . 0 0 "[ . 1 . 2]" 1
1806 1 77 GLU HB3 1 94 THR MG . . 3.220 2.320 2.092 2.541 . 0 0 "[ . 1 . 2]" 1
1807 1 77 GLU HB3 1 96 ASN QB . . 5.330 4.253 3.664 5.275 . 0 0 "[ . 1 . 2]" 1
1808 1 77 GLU QG 1 78 PHE H . . 4.220 3.255 3.028 3.384 . 0 0 "[ . 1 . 2]" 1
1809 1 77 GLU QG 1 78 PHE HA . . 5.480 5.495 5.360 5.580 0.100 13 0 "[ . 1 . 2]" 1
1810 1 77 GLU QG 1 94 THR HB . . 4.060 3.948 3.697 4.114 0.054 15 0 "[ . 1 . 2]" 1
1811 1 77 GLU QG 1 94 THR MG . . 3.310 2.376 1.950 2.803 . 0 0 "[ . 1 . 2]" 1
1812 1 77 GLU QG 1 96 ASN HA . . 4.370 3.757 3.002 4.164 . 0 0 "[ . 1 . 2]" 1
1813 1 77 GLU QG 1 96 ASN QB . . 3.580 2.322 2.019 2.840 . 0 0 "[ . 1 . 2]" 1
1814 1 77 GLU QG 1 96 ASN HD21 . . 5.020 3.065 2.405 4.684 . 0 0 "[ . 1 . 2]" 1
1815 1 77 GLU QG 1 97 VAL H . . 5.270 4.971 4.289 5.323 0.053 6 0 "[ . 1 . 2]" 1
1816 1 78 PHE H 1 78 PHE HB2 . . 3.890 2.831 2.744 2.912 . 0 0 "[ . 1 . 2]" 1
1817 1 78 PHE H 1 78 PHE QD . . 3.820 3.659 3.213 3.858 0.038 16 0 "[ . 1 . 2]" 1
1818 1 78 PHE H 1 94 THR HA . . 4.720 3.783 3.590 3.967 . 0 0 "[ . 1 . 2]" 1
1819 1 78 PHE H 1 94 THR HB . . 5.100 4.778 4.529 5.010 . 0 0 "[ . 1 . 2]" 1
1820 1 78 PHE H 1 94 THR MG . . 3.860 2.418 2.094 2.730 . 0 0 "[ . 1 . 2]" 1
1821 1 78 PHE H 1 95 ALA H . . 3.700 2.563 2.280 2.782 . 0 0 "[ . 1 . 2]" 1
1822 1 78 PHE H 1 95 ALA MB . . 4.340 3.922 3.456 4.216 . 0 0 "[ . 1 . 2]" 1
1823 1 78 PHE H 1 96 ASN HA . . 4.210 4.163 4.006 4.300 0.090 10 0 "[ . 1 . 2]" 1
1824 1 78 PHE H 1 96 ASN QB . . 5.150 4.302 3.706 5.236 0.086 20 0 "[ . 1 . 2]" 1
1825 1 78 PHE HA 1 78 PHE QD . . 3.510 2.591 2.303 2.989 . 0 0 "[ . 1 . 2]" 1
1826 1 78 PHE HA 1 78 PHE QE . . 4.880 4.572 4.458 4.775 . 0 0 "[ . 1 . 2]" 1
1827 1 78 PHE HA 1 79 ARG H . . 3.060 2.332 2.232 2.434 . 0 0 "[ . 1 . 2]" 1
1828 1 78 PHE HA 1 79 ARG HA . . 5.110 4.435 4.366 4.493 . 0 0 "[ . 1 . 2]" 1
1829 1 78 PHE HA 1 79 ARG QB . . 5.010 4.197 4.122 4.260 . 0 0 "[ . 1 . 2]" 1
1830 1 78 PHE HA 1 94 THR MG . . 5.070 4.275 4.112 4.496 . 0 0 "[ . 1 . 2]" 1
1831 1 78 PHE HA 1 95 ALA MB . . 5.350 4.859 4.244 5.257 . 0 0 "[ . 1 . 2]" 1
1832 1 78 PHE HB2 1 79 ARG H . . 4.240 4.014 3.803 4.191 . 0 0 "[ . 1 . 2]" 1
1833 1 78 PHE HB2 1 95 ALA H . . 4.870 2.735 2.488 3.174 . 0 0 "[ . 1 . 2]" 1
1834 1 78 PHE HB2 1 95 ALA MB . . 4.080 2.230 1.823 2.599 . 0 0 "[ . 1 . 2]" 1
1835 1 78 PHE HB3 1 79 ARG H . . 3.900 2.917 2.622 3.265 . 0 0 "[ . 1 . 2]" 1
1836 1 78 PHE HB3 1 95 ALA MB . . 4.390 3.364 2.637 3.686 . 0 0 "[ . 1 . 2]" 1
1837 1 78 PHE QD 1 79 ARG H . . 4.270 3.739 3.464 4.223 . 0 0 "[ . 1 . 2]" 1
1838 1 78 PHE QD 1 95 ALA H . . 5.370 4.209 3.938 4.429 . 0 0 "[ . 1 . 2]" 1
1839 1 78 PHE QD 1 95 ALA MB . . 3.960 2.860 2.119 3.434 . 0 0 "[ . 1 . 2]" 1
1840 1 78 PHE QD 1 96 ASN HA . . 4.720 2.597 2.014 3.525 . 0 0 "[ . 1 . 2]" 1
1841 1 78 PHE QD 1 97 VAL H . . 5.500 4.235 3.989 4.771 . 0 0 "[ . 1 . 2]" 1
1842 1 78 PHE QD 1 97 VAL QG . . 4.150 3.170 2.805 3.392 . 0 0 "[ . 1 . 2]" 1
1843 1 78 PHE QE 1 95 ALA MB . . 5.500 4.720 4.224 5.143 . 0 0 "[ . 1 . 2]" 1
1844 1 78 PHE QE 1 97 VAL HB . . 4.690 4.353 1.989 4.871 0.181 7 0 "[ . 1 . 2]" 1
1845 1 78 PHE QE 1 97 VAL QG . . 3.430 1.933 1.746 2.380 . 0 0 "[ . 1 . 2]" 1
1846 1 78 PHE HZ 1 97 VAL QG . . 3.970 3.378 2.692 3.779 . 0 0 "[ . 1 . 2]" 1
1847 1 79 ARG H 1 79 ARG QD . . 5.360 4.208 3.985 4.463 . 0 0 "[ . 1 . 2]" 1
1848 1 79 ARG H 1 79 ARG HG2 . . 4.130 2.502 2.266 2.707 . 0 0 "[ . 1 . 2]" 1
1849 1 79 ARG H 1 79 ARG HG3 . . 4.400 3.601 3.355 3.873 . 0 0 "[ . 1 . 2]" 1
1850 1 79 ARG H 1 94 THR HA . . 5.500 5.147 5.027 5.271 . 0 0 "[ . 1 . 2]" 1
1851 1 79 ARG HA 1 79 ARG HG3 . . 4.270 3.790 3.743 3.850 . 0 0 "[ . 1 . 2]" 1
1852 1 79 ARG HA 1 80 LEU H . . 3.180 2.244 2.231 2.270 . 0 0 "[ . 1 . 2]" 1
1853 1 79 ARG HA 1 80 LEU HB2 . . 5.290 4.143 4.092 4.177 . 0 0 "[ . 1 . 2]" 1
1854 1 79 ARG HA 1 92 SER H . . 5.030 5.038 4.912 5.146 0.116 17 0 "[ . 1 . 2]" 1
1855 1 79 ARG HA 1 94 THR HA . . 4.240 3.228 3.083 3.409 . 0 0 "[ . 1 . 2]" 1
1856 1 79 ARG HA 1 95 ALA H . . 4.650 3.878 3.657 4.168 . 0 0 "[ . 1 . 2]" 1
1857 1 79 ARG QB 1 80 LEU H . . 3.910 3.273 3.142 3.370 . 0 0 "[ . 1 . 2]" 1
1858 1 79 ARG QB 1 91 PRO HA . . 4.870 3.818 3.565 4.031 . 0 0 "[ . 1 . 2]" 1
1859 1 79 ARG QB 1 91 PRO HB2 . . 4.220 2.086 1.938 2.448 . 0 0 "[ . 1 . 2]" 1
1860 1 79 ARG QB 1 91 PRO HB3 . . 4.190 2.930 2.718 3.268 . 0 0 "[ . 1 . 2]" 1
1861 1 79 ARG QB 1 92 SER H . . 4.710 4.505 4.340 4.662 . 0 0 "[ . 1 . 2]" 1
1862 1 79 ARG QB 1 92 SER HG . . 4.910 4.220 3.918 4.755 . 0 0 "[ . 1 . 2]" 1
1863 1 79 ARG QB 1 94 THR HA . . 4.470 3.319 3.127 3.471 . 0 0 "[ . 1 . 2]" 1
1864 1 79 ARG QD 1 91 PRO HB2 . . 3.920 3.004 2.668 3.753 . 0 0 "[ . 1 . 2]" 1
1865 1 79 ARG QD 1 91 PRO HB3 . . 3.810 3.383 3.167 3.554 . 0 0 "[ . 1 . 2]" 1
1866 1 79 ARG QD 1 91 PRO HG2 . . 3.950 3.940 3.532 4.497 0.547 4 1 "[ +. 1 . 2]" 1
1867 1 79 ARG HE 1 79 ARG HG2 . . 4.190 3.124 2.986 3.527 . 0 0 "[ . 1 . 2]" 1
1868 1 79 ARG HE 1 81 VAL QG . . 5.010 2.932 2.585 4.334 . 0 0 "[ . 1 . 2]" 1
1869 1 79 ARG HE 1 91 PRO HB3 . . 5.230 2.971 2.726 3.286 . 0 0 "[ . 1 . 2]" 1
1870 1 79 ARG HG2 1 79 ARG QH1 . . 5.100 4.274 4.176 4.369 . 0 0 "[ . 1 . 2]" 1
1871 1 79 ARG HG2 1 80 LEU H . . 4.920 4.833 4.617 4.987 0.067 8 0 "[ . 1 . 2]" 1
1872 1 79 ARG HG2 1 91 PRO HB3 . . 5.080 4.509 4.183 4.798 . 0 0 "[ . 1 . 2]" 1
1873 1 79 ARG HG3 1 91 PRO HB3 . . 4.120 2.893 2.460 3.347 . 0 0 "[ . 1 . 2]" 1
1874 1 79 ARG QH1 1 81 VAL QG . . 5.470 4.906 4.612 5.233 . 0 0 "[ . 1 . 2]" 1
1875 1 79 ARG QH1 1 91 PRO HB2 . . 5.300 4.781 4.449 5.108 . 0 0 "[ . 1 . 2]" 1
1876 1 79 ARG QH1 1 91 PRO HB3 . . 5.450 4.806 4.397 5.224 . 0 0 "[ . 1 . 2]" 1
1877 1 79 ARG QH1 1 91 PRO HG2 . . 4.810 4.723 4.387 4.996 0.186 9 0 "[ . 1 . 2]" 1
1878 1 79 ARG QH1 1 91 PRO HG3 . . 5.140 4.299 3.895 4.598 . 0 0 "[ . 1 . 2]" 1
1879 1 80 LEU H 1 80 LEU HB2 . . 3.930 2.387 2.288 2.535 . 0 0 "[ . 1 . 2]" 1
1880 1 80 LEU H 1 80 LEU HB3 . . 3.960 2.958 2.837 3.127 . 0 0 "[ . 1 . 2]" 1
1881 1 80 LEU H 1 80 LEU QD . . 5.140 3.501 3.267 3.712 . 0 0 "[ . 1 . 2]" 1
1882 1 80 LEU H 1 80 LEU HG . . 5.490 4.655 4.390 4.721 . 0 0 "[ . 1 . 2]" 1
1883 1 80 LEU H 1 81 VAL QG . . 5.090 4.020 3.709 4.234 . 0 0 "[ . 1 . 2]" 1
1884 1 80 LEU H 1 91 PRO HA . . 5.120 4.120 3.876 4.377 . 0 0 "[ . 1 . 2]" 1
1885 1 80 LEU H 1 91 PRO HB2 . . 5.390 4.514 4.208 4.882 . 0 0 "[ . 1 . 2]" 1
1886 1 80 LEU H 1 92 SER H . . 3.810 3.486 3.204 3.611 . 0 0 "[ . 1 . 2]" 1
1887 1 80 LEU H 1 92 SER HB2 . . 4.720 4.496 4.198 4.648 . 0 0 "[ . 1 . 2]" 1
1888 1 80 LEU H 1 92 SER HB3 . . 4.590 4.404 4.167 4.552 . 0 0 "[ . 1 . 2]" 1
1889 1 80 LEU H 1 92 SER HG . . 3.710 2.119 1.933 2.546 . 0 0 "[ . 1 . 2]" 1
1890 1 80 LEU H 1 94 THR HA . . 5.460 5.067 4.907 5.271 . 0 0 "[ . 1 . 2]" 1
1891 1 80 LEU HA 1 80 LEU QD . . 3.380 1.900 1.711 2.016 . 0 0 "[ . 1 . 2]" 1
1892 1 80 LEU HA 1 81 VAL H . . 2.950 2.250 2.211 2.331 . 0 0 "[ . 1 . 2]" 1
1893 1 80 LEU HA 1 81 VAL HA . . 4.580 4.399 4.382 4.435 . 0 0 "[ . 1 . 2]" 1
1894 1 80 LEU HA 1 81 VAL QG . . 4.240 3.253 2.950 3.646 . 0 0 "[ . 1 . 2]" 1
1895 1 80 LEU HB2 1 81 VAL H . . 4.470 4.405 4.265 4.475 0.005 1 0 "[ . 1 . 2]" 1
1896 1 80 LEU HB2 1 92 SER H . . 5.120 4.852 4.627 5.009 . 0 0 "[ . 1 . 2]" 1
1897 1 80 LEU HB2 1 92 SER HB2 . . 4.920 5.201 4.714 5.405 0.485 4 0 "[ . 1 . 2]" 1
1898 1 80 LEU HB2 1 92 SER HB3 . . 4.510 4.928 4.527 5.085 0.575 2 8 "[*+**.- 1* * * 2]" 1
1899 1 80 LEU HB3 1 81 VAL H . . 4.590 3.671 3.424 3.832 . 0 0 "[ . 1 . 2]" 1
1900 1 80 LEU HB3 1 92 SER HB2 . . 5.370 4.787 4.418 5.005 . 0 0 "[ . 1 . 2]" 1
1901 1 80 LEU HB3 1 92 SER HB3 . . 4.980 3.964 3.602 4.161 . 0 0 "[ . 1 . 2]" 1
1902 1 80 LEU HB3 1 92 SER HG . . 5.150 3.497 3.187 3.877 . 0 0 "[ . 1 . 2]" 1
1903 1 80 LEU QD 1 81 VAL H . . 3.940 2.825 1.741 3.233 . 0 0 "[ . 1 . 2]" 1
1904 1 80 LEU QD 1 81 VAL QG . . 5.300 3.923 3.570 4.377 . 0 0 "[ . 1 . 2]" 1
1905 1 80 LEU QD 1 82 ALA MB . . 5.230 4.527 3.398 4.885 . 0 0 "[ . 1 . 2]" 1
1906 1 80 LEU HG 1 81 VAL H . . 4.250 3.070 2.549 4.560 0.310 7 0 "[ . 1 . 2]" 1
1907 1 81 VAL H 1 81 VAL HB . . 3.660 3.031 2.535 3.815 0.155 4 0 "[ . 1 . 2]" 1
1908 1 81 VAL H 1 81 VAL QG . . 3.330 2.516 1.945 3.018 . 0 0 "[ . 1 . 2]" 1
1909 1 81 VAL HA 1 81 VAL QG . . 3.260 2.238 1.964 2.603 . 0 0 "[ . 1 . 2]" 1
1910 1 81 VAL HA 1 82 ALA H . . 3.030 2.203 2.185 2.232 . 0 0 "[ . 1 . 2]" 1
1911 1 81 VAL HA 1 82 ALA MB . . 4.280 3.920 3.883 3.955 . 0 0 "[ . 1 . 2]" 1
1912 1 81 VAL HA 1 89 SER H . . 5.130 4.898 4.485 5.164 0.034 11 0 "[ . 1 . 2]" 1
1913 1 81 VAL HA 1 89 SER HG . . 3.670 2.853 2.689 3.025 . 0 0 "[ . 1 . 2]" 1
1914 1 81 VAL HA 1 91 PRO HA . . 3.770 2.718 2.394 2.905 . 0 0 "[ . 1 . 2]" 1
1915 1 81 VAL HA 1 92 SER H . . 4.820 3.300 2.986 3.536 . 0 0 "[ . 1 . 2]" 1
1916 1 81 VAL HB 1 82 ALA H . . 4.580 4.324 3.870 4.591 0.011 7 0 "[ . 1 . 2]" 1
1917 1 81 VAL QG 1 82 ALA H . . 3.580 3.158 2.993 3.376 . 0 0 "[ . 1 . 2]" 1
1918 1 81 VAL QG 1 82 ALA HA . . 4.960 4.113 3.792 4.574 . 0 0 "[ . 1 . 2]" 1
1919 1 81 VAL QG 1 82 ALA MB . . 4.420 4.106 3.982 4.293 . 0 0 "[ . 1 . 2]" 1
1920 1 81 VAL QG 1 83 PHE H . . 4.960 4.555 4.273 4.799 . 0 0 "[ . 1 . 2]" 1
1921 1 81 VAL QG 1 83 PHE HB2 . . 5.030 4.622 4.285 5.038 0.008 12 0 "[ . 1 . 2]" 1
1922 1 81 VAL QG 1 83 PHE HB3 . . 4.360 3.277 2.963 3.686 . 0 0 "[ . 1 . 2]" 1
1923 1 81 VAL QG 1 83 PHE QD . . 4.630 3.358 2.630 3.855 . 0 0 "[ . 1 . 2]" 1
1924 1 81 VAL QG 1 89 SER H . . 3.810 2.879 2.420 3.455 . 0 0 "[ . 1 . 2]" 1
1925 1 81 VAL QG 1 89 SER HA . . 5.320 4.263 4.001 4.527 . 0 0 "[ . 1 . 2]" 1
1926 1 81 VAL QG 1 89 SER HB2 . . 4.880 4.494 4.222 4.756 . 0 0 "[ . 1 . 2]" 1
1927 1 81 VAL QG 1 89 SER HB3 . . 4.720 4.313 4.046 4.623 . 0 0 "[ . 1 . 2]" 1
1928 1 81 VAL QG 1 89 SER HG . . 4.100 2.538 2.009 3.126 . 0 0 "[ . 1 . 2]" 1
1929 1 81 VAL QG 1 90 ASP HA . . 5.310 3.337 2.804 3.829 . 0 0 "[ . 1 . 2]" 1
1930 1 81 VAL QG 1 91 PRO HA . . 3.280 2.176 1.765 2.691 . 0 0 "[ . 1 . 2]" 1
1931 1 81 VAL QG 1 91 PRO HB2 . . 3.790 3.222 3.046 3.479 . 0 0 "[ . 1 . 2]" 1
1932 1 81 VAL QG 1 91 PRO HB3 . . 3.320 1.958 1.790 2.223 . 0 0 "[ . 1 . 2]" 1
1933 1 81 VAL QG 1 91 PRO HD2 . . 5.220 4.059 3.702 4.671 . 0 0 "[ . 1 . 2]" 1
1934 1 81 VAL QG 1 91 PRO HD3 . . 4.420 3.078 2.614 3.688 . 0 0 "[ . 1 . 2]" 1
1935 1 81 VAL QG 1 91 PRO HG2 . . 4.570 4.029 3.776 4.472 . 0 0 "[ . 1 . 2]" 1
1936 1 81 VAL QG 1 91 PRO HG3 . . 3.950 3.133 2.817 3.570 . 0 0 "[ . 1 . 2]" 1
1937 1 81 VAL QG 1 92 SER H . . 4.430 3.621 3.251 4.076 . 0 0 "[ . 1 . 2]" 1
1938 1 82 ALA H 1 82 ALA MB . . 3.280 1.993 1.966 2.056 . 0 0 "[ . 1 . 2]" 1
1939 1 82 ALA H 1 89 SER H . . 4.310 4.171 3.940 4.365 0.055 1 0 "[ . 1 . 2]" 1
1940 1 82 ALA H 1 89 SER HB2 . . 4.480 4.077 3.902 4.279 . 0 0 "[ . 1 . 2]" 1
1941 1 82 ALA H 1 89 SER HB3 . . 4.400 3.908 3.699 4.096 . 0 0 "[ . 1 . 2]" 1
1942 1 82 ALA H 1 89 SER HG . . 3.670 2.104 1.931 2.317 . 0 0 "[ . 1 . 2]" 1
1943 1 82 ALA H 1 91 PRO HA . . 5.460 4.686 4.389 4.862 . 0 0 "[ . 1 . 2]" 1
1944 1 82 ALA HA 1 83 PHE H . . 3.110 2.235 2.192 2.313 . 0 0 "[ . 1 . 2]" 1
1945 1 82 ALA HA 1 83 PHE HA . . 5.160 4.403 4.372 4.450 . 0 0 "[ . 1 . 2]" 1
1946 1 82 ALA HA 1 83 PHE QD . . 5.050 3.872 3.632 4.161 . 0 0 "[ . 1 . 2]" 1
1947 1 82 ALA MB 1 83 PHE H . . 3.570 3.179 2.910 3.471 . 0 0 "[ . 1 . 2]" 1
1948 1 82 ALA MB 1 83 PHE HA . . 5.060 3.992 3.862 4.130 . 0 0 "[ . 1 . 2]" 1
1949 1 82 ALA MB 1 83 PHE QD . . 5.140 4.954 4.733 5.128 . 0 0 "[ . 1 . 2]" 1
1950 1 82 ALA MB 1 89 SER H . . 4.420 4.025 3.861 4.259 . 0 0 "[ . 1 . 2]" 1
1951 1 82 ALA MB 1 89 SER HA . . 5.130 5.058 4.913 5.175 0.045 15 0 "[ . 1 . 2]" 1
1952 1 82 ALA MB 1 89 SER HB2 . . 3.870 3.641 3.474 3.833 . 0 0 "[ . 1 . 2]" 1
1953 1 82 ALA MB 1 89 SER HB3 . . 3.610 2.953 2.809 3.124 . 0 0 "[ . 1 . 2]" 1
1954 1 82 ALA MB 1 89 SER HG . . 4.280 3.054 2.898 3.203 . 0 0 "[ . 1 . 2]" 1
1955 1 83 PHE H 1 83 PHE QD . . 3.950 3.039 2.795 3.216 . 0 0 "[ . 1 . 2]" 1
1956 1 83 PHE H 1 83 PHE QE . . 5.140 4.300 4.074 4.476 . 0 0 "[ . 1 . 2]" 1
1957 1 83 PHE H 1 84 ALA MB . . 5.080 4.730 4.538 4.940 . 0 0 "[ . 1 . 2]" 1
1958 1 83 PHE HA 1 83 PHE QD . . 4.270 3.722 3.678 3.752 . 0 0 "[ . 1 . 2]" 1
1959 1 83 PHE HA 1 84 ALA H . . 3.000 2.248 2.210 2.293 . 0 0 "[ . 1 . 2]" 1
1960 1 83 PHE HA 1 84 ALA HA . . 5.260 4.398 4.385 4.413 . 0 0 "[ . 1 . 2]" 1
1961 1 83 PHE HA 1 84 ALA MB . . 4.460 3.875 3.830 3.931 . 0 0 "[ . 1 . 2]" 1
1962 1 83 PHE HA 1 87 PHE HB2 . . 5.150 4.221 3.927 4.774 . 0 0 "[ . 1 . 2]" 1
1963 1 83 PHE HA 1 88 VAL HA . . 3.520 2.269 1.811 2.470 . 0 0 "[ . 1 . 2]" 1
1964 1 83 PHE HA 1 88 VAL QG . . 4.220 3.432 3.135 3.613 . 0 0 "[ . 1 . 2]" 1
1965 1 83 PHE HA 1 89 SER H . . 4.430 2.689 2.365 3.147 . 0 0 "[ . 1 . 2]" 1
1966 1 83 PHE HB2 1 84 ALA H . . 3.960 3.216 3.027 3.420 . 0 0 "[ . 1 . 2]" 1
1967 1 83 PHE HB2 1 84 ALA HA . . 5.410 4.656 4.526 4.804 . 0 0 "[ . 1 . 2]" 1
1968 1 83 PHE HB2 1 84 ALA MB . . 5.320 4.963 4.852 5.084 . 0 0 "[ . 1 . 2]" 1
1969 1 83 PHE HB2 1 88 VAL HA . . 4.470 2.593 2.369 2.782 . 0 0 "[ . 1 . 2]" 1
1970 1 83 PHE HB2 1 88 VAL QG . . 3.700 2.205 1.873 2.445 . 0 0 "[ . 1 . 2]" 1
1971 1 83 PHE HB3 1 88 VAL HA . . 4.720 2.511 2.272 2.806 . 0 0 "[ . 1 . 2]" 1
1972 1 83 PHE HB3 1 88 VAL QG . . 3.930 2.242 1.925 2.462 . 0 0 "[ . 1 . 2]" 1
1973 1 83 PHE QD 1 84 ALA H . . 4.580 3.769 3.530 4.076 . 0 0 "[ . 1 . 2]" 1
1974 1 83 PHE QD 1 84 ALA HA . . 4.470 3.269 3.051 3.531 . 0 0 "[ . 1 . 2]" 1
1975 1 83 PHE QD 1 84 ALA MB . . 5.350 4.522 4.344 4.738 . 0 0 "[ . 1 . 2]" 1
1976 1 83 PHE QD 1 85 GLY H . . 4.840 3.276 2.899 4.484 . 0 0 "[ . 1 . 2]" 1
1977 1 83 PHE QD 1 88 VAL QG . . 4.580 3.408 3.182 3.532 . 0 0 "[ . 1 . 2]" 1
1978 1 83 PHE QE 1 85 GLY H . . 5.500 4.348 3.769 5.287 . 0 0 "[ . 1 . 2]" 1
1979 1 83 PHE QE 1 88 VAL QG . . 5.100 4.862 4.715 4.957 . 0 0 "[ . 1 . 2]" 1
1980 1 84 ALA H 1 84 ALA MB . . 3.470 2.413 2.278 2.539 . 0 0 "[ . 1 . 2]" 1
1981 1 84 ALA H 1 85 GLY H . . 4.740 4.163 4.036 4.479 . 0 0 "[ . 1 . 2]" 1
1982 1 84 ALA H 1 87 PHE HB2 . . 4.250 2.362 2.102 2.753 . 0 0 "[ . 1 . 2]" 1
1983 1 84 ALA H 1 87 PHE HB3 . . 4.700 3.345 2.863 4.069 . 0 0 "[ . 1 . 2]" 1
1984 1 84 ALA HA 1 85 GLY H . . 3.120 2.217 2.187 2.402 . 0 0 "[ . 1 . 2]" 1
1985 1 84 ALA HA 1 85 GLY HA2 . . 4.700 4.396 4.372 4.432 . 0 0 "[ . 1 . 2]" 1
1986 1 84 ALA HA 1 85 GLY HA3 . . 4.380 4.385 4.344 4.616 0.236 19 0 "[ . 1 . 2]" 1
1987 1 84 ALA MB 1 85 GLY H . . 4.030 3.404 2.651 3.532 . 0 0 "[ . 1 . 2]" 1
1988 1 84 ALA MB 1 85 GLY HA2 . . 5.370 4.869 4.430 4.992 . 0 0 "[ . 1 . 2]" 1
1989 1 84 ALA MB 1 85 GLY HA3 . . 5.190 4.212 3.893 4.392 . 0 0 "[ . 1 . 2]" 1
1990 1 84 ALA MB 1 87 PHE H . . 4.690 3.858 3.570 4.081 . 0 0 "[ . 1 . 2]" 1
1991 1 84 ALA MB 1 87 PHE HB2 . . 3.760 2.454 2.083 2.922 . 0 0 "[ . 1 . 2]" 1
1992 1 84 ALA MB 1 87 PHE HB3 . . 4.330 3.557 3.181 4.377 0.047 19 0 "[ . 1 . 2]" 1
1993 1 84 ALA MB 1 87 PHE QD . . 4.240 3.325 2.738 3.739 . 0 0 "[ . 1 . 2]" 1
1994 1 84 ALA MB 1 87 PHE QE . . 4.890 4.806 4.291 4.986 0.096 1 0 "[ . 1 . 2]" 1
1995 1 85 GLY HA2 1 87 PHE H . . 4.560 4.496 4.224 4.664 0.104 11 0 "[ . 1 . 2]" 1
1996 1 85 GLY HA3 1 87 PHE H . . 4.660 3.905 3.445 4.395 . 0 0 "[ . 1 . 2]" 1
1997 1 86 SER H 1 87 PHE H . . 4.320 2.872 2.099 3.620 . 0 0 "[ . 1 . 2]" 1
1998 1 86 SER QB 1 87 PHE H . . 4.500 2.970 2.163 3.853 . 0 0 "[ . 1 . 2]" 1
1999 1 86 SER QB 1 87 PHE QD . . 5.090 3.049 2.184 3.921 . 0 0 "[ . 1 . 2]" 1
2000 1 87 PHE H 1 87 PHE HB2 . . 3.410 2.330 2.176 2.541 . 0 0 "[ . 1 . 2]" 1
2001 1 87 PHE H 1 87 PHE HB3 . . 3.900 3.509 3.431 3.660 . 0 0 "[ . 1 . 2]" 1
2002 1 87 PHE H 1 87 PHE QD . . 3.820 2.211 1.909 3.049 . 0 0 "[ . 1 . 2]" 1
2003 1 87 PHE H 1 87 PHE QE . . 4.560 4.302 4.024 4.602 0.042 7 0 "[ . 1 . 2]" 1
2004 1 87 PHE HB2 1 88 VAL H . . 4.620 4.231 3.700 4.441 . 0 0 "[ . 1 . 2]" 1
2005 1 87 PHE HB3 1 88 VAL H . . 4.220 3.316 2.666 3.649 . 0 0 "[ . 1 . 2]" 1
2006 1 87 PHE QD 1 88 VAL H . . 5.150 4.345 4.122 4.658 . 0 0 "[ . 1 . 2]" 1
2007 1 88 VAL H 1 88 VAL HB . . 3.610 2.593 2.344 3.752 0.142 1 0 "[ . 1 . 2]" 1
2008 1 88 VAL H 1 88 VAL QG . . 3.550 2.886 2.078 3.137 . 0 0 "[ . 1 . 2]" 1
2009 1 88 VAL H 1 89 SER H . . 5.170 4.284 4.109 4.422 . 0 0 "[ . 1 . 2]" 1
2010 1 88 VAL HA 1 88 VAL QG . . 3.280 2.132 2.086 2.219 . 0 0 "[ . 1 . 2]" 1
2011 1 88 VAL HA 1 89 SER H . . 3.330 2.223 2.182 2.444 . 0 0 "[ . 1 . 2]" 1
2012 1 88 VAL HB 1 89 SER H . . 4.520 4.280 2.550 4.591 0.071 20 0 "[ . 1 . 2]" 1
2013 1 88 VAL QG 1 89 SER H . . 3.600 2.822 2.258 3.248 . 0 0 "[ . 1 . 2]" 1
2014 1 88 VAL QG 1 89 SER HA . . 4.680 3.820 3.505 4.057 . 0 0 "[ . 1 . 2]" 1
2015 1 89 SER H 1 89 SER HB3 . . 3.990 2.524 2.331 2.895 . 0 0 "[ . 1 . 2]" 1
2016 1 89 SER H 1 89 SER HG . . 4.670 2.686 2.167 3.606 . 0 0 "[ . 1 . 2]" 1
2017 1 89 SER HA 1 89 SER HG . . 4.000 3.532 3.450 3.714 . 0 0 "[ . 1 . 2]" 1
2018 1 89 SER HA 1 90 ASP H . . 3.120 2.511 2.447 2.561 . 0 0 "[ . 1 . 2]" 1
2019 1 89 SER HA 1 90 ASP HB2 . . 4.640 4.689 4.520 4.962 0.322 10 0 "[ . 1 . 2]" 1
2020 1 89 SER HB2 1 90 ASP H . . 3.710 2.594 2.453 2.797 . 0 0 "[ . 1 . 2]" 1
2021 1 89 SER HB3 1 90 ASP H . . 4.040 3.974 3.879 4.103 0.063 15 0 "[ . 1 . 2]" 1
2022 1 89 SER HG 1 90 ASP H . . 4.570 3.658 3.046 4.054 . 0 0 "[ . 1 . 2]" 1
2023 1 90 ASP H 1 90 ASP HB2 . . 3.480 2.273 2.083 2.888 . 0 0 "[ . 1 . 2]" 1
2024 1 90 ASP H 1 90 ASP HB3 . . 3.750 3.258 2.123 3.493 . 0 0 "[ . 1 . 2]" 1
2025 1 90 ASP H 1 91 PRO HD2 . . 5.300 4.961 4.937 4.978 . 0 0 "[ . 1 . 2]" 1
2026 1 90 ASP HA 1 91 PRO HD2 . . 3.220 2.777 2.739 2.826 . 0 0 "[ . 1 . 2]" 1
2027 1 90 ASP HA 1 91 PRO HD3 . . 2.990 2.063 2.042 2.091 . 0 0 "[ . 1 . 2]" 1
2028 1 90 ASP HA 1 91 PRO HG2 . . 4.500 4.712 4.683 4.751 0.251 7 0 "[ . 1 . 2]" 1
2029 1 90 ASP HA 1 91 PRO HG3 . . 4.680 4.331 4.313 4.355 . 0 0 "[ . 1 . 2]" 1
2030 1 90 ASP HB2 1 91 PRO HD2 . . 3.850 3.768 3.218 3.904 0.054 20 0 "[ . 1 . 2]" 1
2031 1 90 ASP HB2 1 91 PRO HD3 . . 4.370 4.345 3.687 4.485 0.115 20 0 "[ . 1 . 2]" 1
2032 1 90 ASP HB3 1 91 PRO HD2 . . 3.310 2.504 2.176 3.967 0.657 6 3 "[ .+ * . - 2]" 1
2033 1 90 ASP HB3 1 91 PRO HD3 . . 3.710 3.489 3.249 4.518 0.808 6 3 "[ .+ * . - 2]" 1
2034 1 91 PRO HA 1 92 SER H . . 2.930 2.173 2.156 2.197 . 0 0 "[ . 1 . 2]" 1
2035 1 91 PRO HB2 1 92 SER H . . 4.180 4.034 3.945 4.124 . 0 0 "[ . 1 . 2]" 1
2036 1 91 PRO HB3 1 92 SER H . . 4.330 4.265 4.192 4.341 0.011 6 0 "[ . 1 . 2]" 1
2037 1 92 SER H 1 92 SER HB2 . . 4.040 3.566 3.559 3.579 . 0 0 "[ . 1 . 2]" 1
2038 1 92 SER H 1 92 SER HB3 . . 3.730 2.525 2.463 2.592 . 0 0 "[ . 1 . 2]" 1
2039 1 92 SER H 1 92 SER HG . . 4.360 2.973 2.611 3.399 . 0 0 "[ . 1 . 2]" 1
2040 1 92 SER H 1 93 ASN H . . 5.480 4.663 4.632 4.674 . 0 0 "[ . 1 . 2]" 1
2041 1 92 SER HA 1 92 SER HG . . 3.940 3.599 3.464 3.749 . 0 0 "[ . 1 . 2]" 1
2042 1 92 SER HA 1 93 ASN H . . 3.150 2.542 2.429 2.655 . 0 0 "[ . 1 . 2]" 1
2043 1 92 SER HB2 1 93 ASN H . . 3.430 2.380 2.150 2.641 . 0 0 "[ . 1 . 2]" 1
2044 1 92 SER HB3 1 93 ASN H . . 3.980 3.709 3.593 3.840 . 0 0 "[ . 1 . 2]" 1
2045 1 92 SER HG 1 93 ASN H . . 3.950 3.797 3.517 4.028 0.078 17 0 "[ . 1 . 2]" 1
2046 1 92 SER HG 1 94 THR HA . . 4.900 4.902 4.783 4.962 0.062 14 0 "[ . 1 . 2]" 1
2047 1 92 SER HG 1 95 ALA MB . . 5.330 5.328 5.153 5.408 0.078 8 0 "[ . 1 . 2]" 1
2048 1 93 ASN H 1 93 ASN HB2 . . 4.100 3.549 3.259 3.593 . 0 0 "[ . 1 . 2]" 1
2049 1 93 ASN H 1 93 ASN HB3 . . 3.730 2.610 2.058 2.848 . 0 0 "[ . 1 . 2]" 1
2050 1 93 ASN H 1 94 THR H . . 4.670 4.665 4.647 4.675 0.005 2 0 "[ . 1 . 2]" 1
2051 1 93 ASN HA 1 93 ASN HD21 . . 4.510 4.417 4.245 4.541 0.031 7 0 "[ . 1 . 2]" 1
2052 1 93 ASN HA 1 94 THR H . . 2.920 2.466 2.367 2.638 . 0 0 "[ . 1 . 2]" 1
2053 1 93 ASN HB2 1 93 ASN HD21 . . 3.630 2.253 2.104 3.458 . 0 0 "[ . 1 . 2]" 1
2054 1 93 ASN HB2 1 94 THR H . . 3.720 2.706 2.275 2.974 . 0 0 "[ . 1 . 2]" 1
2055 1 93 ASN HB3 1 94 THR H . . 3.730 3.767 3.609 3.959 0.229 13 0 "[ . 1 . 2]" 1
2056 1 93 ASN HD21 1 94 THR H . . 4.500 4.260 3.528 4.623 0.123 20 0 "[ . 1 . 2]" 1
2057 1 93 ASN HD21 1 95 ALA MB . . 4.430 3.850 3.357 4.460 0.030 20 0 "[ . 1 . 2]" 1
2058 1 93 ASN HD22 1 95 ALA MB . . 4.410 3.957 2.563 4.431 0.021 1 0 "[ . 1 . 2]" 1
2059 1 94 THR H 1 94 THR HB . . 3.400 2.688 2.456 2.883 . 0 0 "[ . 1 . 2]" 1
2060 1 94 THR H 1 94 THR MG . . 3.790 3.700 3.602 3.770 . 0 0 "[ . 1 . 2]" 1
2061 1 94 THR H 1 95 ALA MB . . 5.390 5.180 4.854 5.430 0.040 1 0 "[ . 1 . 2]" 1
2062 1 94 THR HA 1 94 THR MG . . 3.180 2.172 2.027 2.303 . 0 0 "[ . 1 . 2]" 1
2063 1 94 THR HA 1 95 ALA H . . 2.930 2.201 2.165 2.297 . 0 0 "[ . 1 . 2]" 1
2064 1 94 THR HA 1 95 ALA MB . . 4.130 3.826 3.739 3.888 . 0 0 "[ . 1 . 2]" 1
2065 1 94 THR HB 1 95 ALA H . . 3.960 3.989 3.732 4.093 0.133 20 0 "[ . 1 . 2]" 1
2066 1 94 THR MG 1 95 ALA H . . 3.580 2.746 2.253 3.020 . 0 0 "[ . 1 . 2]" 1
2067 1 94 THR MG 1 95 ALA HA . . 5.230 4.385 3.920 4.629 . 0 0 "[ . 1 . 2]" 1
2068 1 94 THR MG 1 96 ASN QB . . 4.440 4.280 4.040 4.514 0.074 12 0 "[ . 1 . 2]" 1
2069 1 94 THR MG 1 96 ASN HD21 . . 5.500 4.932 3.692 6.171 0.671 6 1 "[ .+ 1 . 2]" 1
2070 1 95 ALA H 1 95 ALA MB . . 3.530 2.395 2.204 2.592 . 0 0 "[ . 1 . 2]" 1
2071 1 95 ALA HA 1 96 ASN H . . 2.800 2.304 2.193 2.429 . 0 0 "[ . 1 . 2]" 1
2072 1 95 ALA HA 1 96 ASN QB . . 4.720 4.409 4.141 4.747 0.027 12 0 "[ . 1 . 2]" 1
2073 1 95 ALA MB 1 96 ASN H . . 3.470 2.900 2.692 3.263 . 0 0 "[ . 1 . 2]" 1
2074 1 95 ALA MB 1 96 ASN HA . . 5.140 3.941 3.839 4.214 . 0 0 "[ . 1 . 2]" 1
2075 1 96 ASN H 1 96 ASN QB . . 3.700 3.160 3.010 3.286 . 0 0 "[ . 1 . 2]" 1
2076 1 96 ASN H 1 96 ASN HD21 . . 5.020 4.271 3.421 4.868 . 0 0 "[ . 1 . 2]" 1
2077 1 96 ASN HA 1 97 VAL H . . 3.070 2.487 2.336 2.580 . 0 0 "[ . 1 . 2]" 1
2078 1 96 ASN HA 1 97 VAL QG . . 4.930 3.155 2.841 4.217 . 0 0 "[ . 1 . 2]" 1
2079 1 96 ASN QB 1 97 VAL H . . 3.600 2.593 2.364 2.941 . 0 0 "[ . 1 . 2]" 1
2080 1 96 ASN QB 1 97 VAL HA . . 5.130 4.234 3.837 4.594 . 0 0 "[ . 1 . 2]" 1
2081 1 96 ASN QB 1 97 VAL QG . . 5.120 3.869 3.670 4.490 . 0 0 "[ . 1 . 2]" 1
2082 1 97 VAL H 1 97 VAL HB . . 4.100 3.598 2.354 3.907 . 0 0 "[ . 1 . 2]" 1
2083 1 97 VAL H 1 97 VAL QG . . 3.640 2.336 2.078 3.054 . 0 0 "[ . 1 . 2]" 1
2084 1 97 VAL H 1 98 SER HA . . 5.160 4.714 4.540 4.861 . 0 0 "[ . 1 . 2]" 1
2085 1 97 VAL HA 1 97 VAL QG . . 3.240 2.403 1.917 2.524 . 0 0 "[ . 1 . 2]" 1
2086 1 97 VAL HA 1 98 SER H . . 2.820 2.361 2.222 2.508 . 0 0 "[ . 1 . 2]" 1
2087 1 97 VAL HA 1 98 SER HB2 . . 4.760 4.365 4.076 4.698 . 0 0 "[ . 1 . 2]" 1
2088 1 97 VAL HB 1 98 SER H . . 4.190 3.122 2.544 4.337 0.147 20 0 "[ . 1 . 2]" 1
2089 1 97 VAL QG 1 98 SER H . . 3.480 2.899 2.215 3.331 . 0 0 "[ . 1 . 2]" 1
2090 1 97 VAL QG 1 98 SER HA . . 4.960 3.529 3.343 3.892 . 0 0 "[ . 1 . 2]" 1
2091 1 97 VAL QG 1 98 SER HB2 . . 4.990 4.743 4.428 4.930 . 0 0 "[ . 1 . 2]" 1
2092 1 97 VAL QG 1 98 SER HB3 . . 4.920 4.639 4.047 4.905 . 0 0 "[ . 1 . 2]" 1
2093 1 98 SER H 1 98 SER HB2 . . 3.310 2.820 2.138 3.320 0.010 14 0 "[ . 1 . 2]" 1
2094 1 98 SER H 1 98 SER HB3 . . 3.420 2.605 2.357 2.945 . 0 0 "[ . 1 . 2]" 1
2095 1 98 SER HA 1 99 THR MG . . 5.320 3.420 2.999 4.075 . 0 0 "[ . 1 . 2]" 1
2096 1 98 SER HB2 1 99 THR H . . 4.620 4.050 3.694 4.551 . 0 0 "[ . 1 . 2]" 1
2097 1 98 SER HB3 1 99 THR H . . 4.680 3.833 3.157 4.236 . 0 0 "[ . 1 . 2]" 1
2098 1 99 THR H 1 99 THR MG . . 3.850 2.418 1.894 2.822 . 0 0 "[ . 1 . 2]" 1
2099 1 99 THR H 1 100 SER H . . 5.020 2.688 1.923 3.605 . 0 0 "[ . 1 . 2]" 1
2100 1 99 THR HA 1 99 THR MG . . 3.100 3.018 2.363 3.235 0.135 7 0 "[ . 1 . 2]" 1
2101 1 99 THR HA 1 100 SER H . . 3.370 2.716 2.336 3.211 . 0 0 "[ . 1 . 2]" 1
2102 1 99 THR HA 1 102 LEU QB . . 4.410 3.051 2.312 4.399 . 0 0 "[ . 1 . 2]" 1
2103 1 99 THR HA 1 102 LEU QD . . 4.100 2.770 1.838 3.796 . 0 0 "[ . 1 . 2]" 1
2104 1 99 THR HB 1 102 LEU QB . . 4.350 3.955 2.473 4.361 0.011 11 0 "[ . 1 . 2]" 1
2105 1 99 THR HB 1 102 LEU QD . . 4.350 3.132 1.857 3.992 . 0 0 "[ . 1 . 2]" 1
2106 1 99 THR MG 1 100 SER H . . 4.960 4.063 3.404 4.374 . 0 0 "[ . 1 . 2]" 1
2107 1 100 SER H 1 100 SER QB . . 3.430 2.449 2.113 2.906 . 0 0 "[ . 1 . 2]" 1
2108 1 100 SER QB 1 101 GLY H . . 4.520 3.176 2.782 3.675 . 0 0 "[ . 1 . 2]" 1
2109 1 100 SER QB 1 102 LEU H . . 5.190 4.962 4.448 5.237 0.047 9 0 "[ . 1 . 2]" 1
2110 1 101 GLY H 1 102 LEU H . . 4.300 2.670 1.913 3.325 . 0 0 "[ . 1 . 2]" 1
2111 1 101 GLY HA2 1 102 LEU QB . . 5.160 4.906 4.530 5.275 0.115 20 0 "[ . 1 . 2]" 1
2112 1 101 GLY HA2 1 102 LEU QD . . 5.350 4.523 3.514 5.353 0.003 6 0 "[ . 1 . 2]" 1
2113 1 101 GLY HA3 1 102 LEU QB . . 5.430 5.021 4.290 5.350 . 0 0 "[ . 1 . 2]" 1
2114 1 102 LEU H 1 102 LEU QB . . 3.180 2.210 1.959 3.039 . 0 0 "[ . 1 . 2]" 1
2115 1 102 LEU H 1 102 LEU QD . . 4.710 2.648 1.809 3.270 . 0 0 "[ . 1 . 2]" 1
2116 1 102 LEU H 1 102 LEU HG . . 4.320 4.067 2.124 4.444 0.124 5 0 "[ . 1 . 2]" 1
2117 1 102 LEU HA 1 102 LEU QD . . 3.310 2.753 1.927 3.267 . 0 0 "[ . 1 . 2]" 1
2118 1 102 LEU HA 1 103 SER H . . 3.410 2.423 2.192 2.597 . 0 0 "[ . 1 . 2]" 1
2119 1 102 LEU QB 1 103 SER H . . 4.070 2.901 2.264 3.520 . 0 0 "[ . 1 . 2]" 1
2120 1 102 LEU QB 1 103 SER QB . . 5.030 3.719 3.071 4.389 . 0 0 "[ . 1 . 2]" 1
2121 1 102 LEU QB 1 104 GLY H . . 5.500 4.935 2.556 5.522 0.022 15 0 "[ . 1 . 2]" 1
2122 1 102 LEU QD 1 103 SER H . . 4.570 3.030 2.017 3.657 . 0 0 "[ . 1 . 2]" 1
2123 1 102 LEU QD 1 103 SER QB . . 4.410 2.856 1.698 4.219 . 0 0 "[ . 1 . 2]" 1
2124 1 103 SER H 1 103 SER QB . . 3.830 2.827 2.074 3.290 . 0 0 "[ . 1 . 2]" 1
2125 1 103 SER HA 1 104 GLY H . . 3.610 2.960 2.222 3.648 0.038 4 0 "[ . 1 . 2]" 1
2126 1 103 SER QB 1 104 GLY H . . 4.540 3.284 1.953 4.131 . 0 0 "[ . 1 . 2]" 1
2127 1 104 GLY H 1 105 PRO QD . . 5.500 3.995 3.041 4.323 . 0 0 "[ . 1 . 2]" 1
2128 1 104 GLY HA2 1 105 PRO QD . . 3.210 2.175 1.853 3.137 . 0 0 "[ . 1 . 2]" 1
2129 1 104 GLY HA2 1 105 PRO QG . . 5.430 4.129 3.830 4.996 . 0 0 "[ . 1 . 2]" 1
2130 1 104 GLY HA3 1 105 PRO QD . . 3.350 2.529 1.854 3.236 . 0 0 "[ . 1 . 2]" 1
2131 1 104 GLY HA3 1 105 PRO QG . . 4.960 4.458 3.826 5.116 0.156 18 0 "[ . 1 . 2]" 1
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