NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
586399 |
4crp   |
19824 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_4crp
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 1453
_Distance_constraint_stats_list.Viol_count 1543
_Distance_constraint_stats_list.Viol_total 3723.169
_Distance_constraint_stats_list.Viol_max 0.876
_Distance_constraint_stats_list.Viol_rms 0.0370
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0041
_Distance_constraint_stats_list.Viol_average_violations_only 0.0965
_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 VAL 1.020 0.083 11 0 "[ . 1 . 2 .]"
1 7 SER 0.044 0.032 19 0 "[ . 1 . 2 .]"
1 8 PHE 3.445 0.690 1 1 "[+ . 1 . 2 .]"
1 9 CYS 0.476 0.158 8 0 "[ . 1 . 2 .]"
1 10 ALA 1.625 0.158 8 0 "[ . 1 . 2 .]"
1 11 SER 1.094 0.087 16 0 "[ . 1 . 2 .]"
1 12 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 13 GLN 5.960 0.726 23 1 "[ . 1 . 2 + .]"
1 14 LEU 3.139 0.115 20 0 "[ . 1 . 2 .]"
1 15 HIS 0.435 0.081 16 0 "[ . 1 . 2 .]"
1 16 THR 0.935 0.081 16 0 "[ . 1 . 2 .]"
1 17 ALA 0.898 0.099 18 0 "[ . 1 . 2 .]"
1 18 VAL 0.021 0.020 21 0 "[ . 1 . 2 .]"
1 19 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 20 MET 0.175 0.103 24 0 "[ . 1 . 2 .]"
1 21 HIS 3.078 0.838 4 3 "[ +- 1 * . 2 .]"
1 22 HIS 3.078 0.838 4 3 "[ +- 1 * . 2 .]"
1 23 TRP 1.399 0.393 8 0 "[ . 1 . 2 .]"
1 24 CYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 25 ILE 0.593 0.058 17 0 "[ . 1 . 2 .]"
1 26 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 27 PHE 1.107 0.504 23 1 "[ . 1 . 2 + .]"
1 28 SER 2.038 0.726 23 1 "[ . 1 . 2 + .]"
1 29 VAL 6.083 0.645 16 5 "[ ** 1 -+ 2 * .]"
1 30 ASP 0.467 0.374 5 0 "[ . 1 . 2 .]"
1 31 GLY 1.674 0.310 7 0 "[ . 1 . 2 .]"
1 32 GLN 16.062 0.805 9 6 "[* . * +1 *.*- 2 .]"
1 33 PRO 0.141 0.141 2 0 "[ . 1 . 2 .]"
1 34 ALA 1.017 0.133 24 0 "[ . 1 . 2 .]"
1 35 PRO 0.981 0.067 20 0 "[ . 1 . 2 .]"
1 36 SER 0.061 0.045 16 0 "[ . 1 . 2 .]"
1 37 LEU 5.421 0.113 16 0 "[ . 1 . 2 .]"
1 38 ARG 20.613 0.722 19 16 "[* -***** ** .* *+* ***.]"
1 39 TRP 2.744 0.274 16 0 "[ . 1 . 2 .]"
1 40 LEU 17.659 0.876 18 13 "[- **.*** 1* .* +** ** .]"
1 41 PHE 3.135 0.485 16 0 "[ . 1 . 2 .]"
1 42 ASN 4.753 0.680 23 4 "[ . 1** *. 2 + .]"
1 43 GLY 5.264 0.507 3 2 "[- + . 1 . 2 .]"
1 44 SER 1.776 0.447 22 0 "[ . 1 . 2 .]"
1 45 VAL 0.054 0.037 24 0 "[ . 1 . 2 .]"
1 46 LEU 4.531 0.485 16 0 "[ . 1 . 2 .]"
1 47 ASN 0.041 0.012 1 0 "[ . 1 . 2 .]"
1 48 GLU 1.991 0.625 4 1 "[ +. 1 . 2 .]"
1 49 THR 0.503 0.046 7 0 "[ . 1 . 2 .]"
1 50 SER 0.045 0.016 9 0 "[ . 1 . 2 .]"
1 51 PHE 0.175 0.046 7 0 "[ . 1 . 2 .]"
1 52 ILE 0.765 0.057 17 0 "[ . 1 . 2 .]"
1 53 PHE 3.347 0.820 23 4 "[ -*. 1 . 2 + *]"
1 54 THR 0.945 0.416 5 0 "[ . 1 . 2 .]"
1 55 GLU 2.861 0.820 23 3 "[ - . 1 . 2 + *]"
1 56 PHE 1.086 0.100 3 0 "[ . 1 . 2 .]"
1 57 LEU 3.677 0.725 13 3 "[ . 1 + . - 2 * .]"
1 58 GLU 3.368 0.725 13 3 "[ . 1 + . - 2 * .]"
1 59 PRO 5.297 0.313 15 0 "[ . 1 . 2 .]"
1 60 ALA 0.560 0.073 16 0 "[ . 1 . 2 .]"
1 61 ALA 2.048 0.611 22 1 "[ . 1 . 2 + .]"
1 62 ASN 1.648 0.611 22 1 "[ . 1 . 2 + .]"
1 63 GLU 0.126 0.092 21 0 "[ . 1 . 2 .]"
1 64 THR 4.898 0.805 9 4 "[ . - +1 *.* 2 .]"
1 65 VAL 0.126 0.092 21 0 "[ . 1 . 2 .]"
1 66 ARG 7.697 0.645 16 5 "[ ** 1 -+ 2 * .]"
1 67 HIS 1.376 0.405 4 0 "[ . 1 . 2 .]"
1 68 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 69 CYS 0.056 0.054 21 0 "[ . 1 . 2 .]"
1 70 LEU 2.642 0.250 10 0 "[ . 1 . 2 .]"
1 71 ARG 0.163 0.066 19 0 "[ . 1 . 2 .]"
1 72 LEU 3.434 0.151 23 0 "[ . 1 . 2 .]"
1 73 ASN 1.092 0.101 7 0 "[ . 1 . 2 .]"
1 74 GLN 1.835 0.279 12 0 "[ . 1 . 2 .]"
1 75 PRO 0.772 0.111 2 0 "[ . 1 . 2 .]"
1 76 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 77 HIS 2.477 0.813 13 1 "[ . 1 + . 2 .]"
1 78 VAL 1.038 0.163 9 0 "[ . 1 . 2 .]"
1 79 ASN 1.660 0.544 19 1 "[ . 1 . +2 .]"
1 80 ASN 4.316 0.560 24 2 "[ . 1 . - +.]"
1 81 GLY 1.220 0.680 23 1 "[ . 1 . 2 + .]"
1 82 ASN 9.564 0.667 14 4 "[ . 1** +. 2 - .]"
1 83 TYR 2.985 0.186 15 0 "[ . 1 . 2 .]"
1 84 THR 0.354 0.031 16 0 "[ . 1 . 2 .]"
1 85 LEU 4.468 0.115 20 0 "[ . 1 . 2 .]"
1 86 LEU 1.825 0.876 18 1 "[ . 1 . + 2 .]"
1 87 ALA 0.968 0.067 20 0 "[ . 1 . 2 .]"
1 88 ALA 0.317 0.071 22 0 "[ . 1 . 2 .]"
1 89 ASN 1.042 0.321 11 0 "[ . 1 . 2 .]"
1 90 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 91 CYS 2.817 0.466 25 0 "[ . 1 . 2 .]"
1 92 GLY 0.938 0.389 25 0 "[ . 1 . 2 .]"
1 93 GLN 0.408 0.116 9 0 "[ . 1 . 2 .]"
1 94 ALA 0.229 0.046 17 0 "[ . 1 . 2 .]"
1 95 SER 0.072 0.019 4 0 "[ . 1 . 2 .]"
1 96 ALA 0.202 0.042 3 0 "[ . 1 . 2 .]"
1 97 SER 0.000 0.000 15 0 "[ . 1 . 2 .]"
1 98 ILE 1.528 0.186 15 0 "[ . 1 . 2 .]"
1 99 MET 4.715 0.710 16 1 "[ . 1 .+ 2 .]"
1 100 ALA 2.308 0.414 16 0 "[ . 1 . 2 .]"
1 101 ALA 0.432 0.044 19 0 "[ . 1 . 2 .]"
1 102 PHE 3.661 0.544 19 1 "[ . 1 . +2 .]"
1 103 MET 2.160 0.464 17 0 "[ . 1 . 2 .]"
1 104 ASP 3.758 0.370 18 0 "[ . 1 . 2 .]"
1 105 ASN 3.925 0.719 18 6 "[* . * 1 - + 2 ** .]"
1 106 PRO 3.385 0.813 13 2 "[ . 1 + . - .]"
1 107 PHE 2.386 0.584 20 1 "[ . 1 . + .]"
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 VAL H 1 6 VAL HA 2.494 . 3.271 2.844 2.715 2.895 . 0 0 "[ . 1 . 2 .]" 1
2 1 6 VAL H 1 6 VAL HB 2.842 2.097 3.587 3.628 3.597 3.670 0.083 11 0 "[ . 1 . 2 .]" 1
3 1 6 VAL H 1 7 SER QB 3.647 . 5.497 5.222 4.827 5.418 . 0 0 "[ . 1 . 2 .]" 1
4 1 6 VAL HA 1 6 VAL HB 2.212 . 2.824 2.549 2.463 2.618 . 0 0 "[ . 1 . 2 .]" 1
5 1 6 VAL HA 1 7 SER H 2.089 . 2.635 2.064 1.980 2.127 . 0 0 "[ . 1 . 2 .]" 1
6 1 6 VAL HA 1 7 SER QB 4.484 . 6.997 4.115 3.850 4.516 . 0 0 "[ . 1 . 2 .]" 1
7 1 6 VAL HB 1 7 SER H 3.871 . 5.744 3.746 3.262 3.867 . 0 0 "[ . 1 . 2 .]" 1
8 1 6 VAL HB 1 8 PHE QD 3.542 2.602 4.482 3.472 2.689 3.852 . 0 0 "[ . 1 . 2 .]" 1
9 1 7 SER H 1 7 SER HA 2.993 . 4.113 2.892 2.854 2.920 . 0 0 "[ . 1 . 2 .]" 1
10 1 7 SER H 1 7 SER QB 2.731 . 3.663 2.377 2.027 2.824 . 0 0 "[ . 1 . 2 .]" 1
11 1 7 SER H 1 8 PHE H 4.655 . 7.364 3.991 3.872 4.154 . 0 0 "[ . 1 . 2 .]" 1
12 1 7 SER H 1 8 PHE HA 3.746 . 5.500 4.877 4.620 5.194 . 0 0 "[ . 1 . 2 .]" 1
13 1 7 SER HA 1 7 SER QB 2.463 . 3.221 2.350 2.145 2.456 . 0 0 "[ . 1 . 2 .]" 1
14 1 7 SER HA 1 8 PHE H 2.425 . 3.160 2.125 2.028 2.201 . 0 0 "[ . 1 . 2 .]" 1
15 1 7 SER HA 1 32 GLN HB2 3.510 . 5.050 3.643 2.814 5.061 0.011 8 0 "[ . 1 . 2 .]" 1
16 1 7 SER HA 1 32 GLN HB3 3.640 2.093 5.187 3.457 2.208 5.067 . 0 0 "[ . 1 . 2 .]" 1
17 1 7 SER HA 1 32 GLN HG3 4.240 . 6.487 4.539 2.593 6.519 0.032 19 0 "[ . 1 . 2 .]" 1
18 1 7 SER QB 1 8 PHE H 4.122 . 6.246 3.808 3.486 3.982 . 0 0 "[ . 1 . 2 .]" 1
19 1 7 SER QB 1 8 PHE HB3 5.766 . 9.921 6.400 5.322 6.611 . 0 0 "[ . 1 . 2 .]" 1
20 1 8 PHE H 1 8 PHE HB2 3.908 . 5.817 2.541 2.381 3.756 . 0 0 "[ . 1 . 2 .]" 1
21 1 8 PHE H 1 8 PHE HB3 3.095 . 4.292 3.617 3.354 3.714 . 0 0 "[ . 1 . 2 .]" 1
22 1 8 PHE H 1 8 PHE QD 3.404 . 4.852 2.851 2.066 3.281 . 0 0 "[ . 1 . 2 .]" 1
23 1 8 PHE H 1 8 PHE HZ 4.523 2.882 6.164 5.986 5.397 6.230 0.066 11 0 "[ . 1 . 2 .]" 1
24 1 8 PHE H 1 32 GLN H 3.282 . 4.629 3.139 2.559 4.001 . 0 0 "[ . 1 . 2 .]" 1
25 1 8 PHE H 1 32 GLN HB2 3.417 . 4.877 2.521 1.813 4.040 0.144 25 0 "[ . 1 . 2 .]" 1
26 1 8 PHE H 1 32 GLN HB3 2.817 . 3.809 3.053 1.940 4.499 0.690 1 1 "[+ . 1 . 2 .]" 1
27 1 8 PHE HA 1 9 CYS H 2.861 . 3.884 2.119 2.031 2.188 . 0 0 "[ . 1 . 2 .]" 1
28 1 8 PHE HB2 1 8 PHE QD 3.415 . 4.873 2.343 2.250 2.597 . 0 0 "[ . 1 . 2 .]" 1
29 1 8 PHE HB3 1 8 PHE QD 3.129 . 4.353 2.517 2.249 2.719 . 0 0 "[ . 1 . 2 .]" 1
30 1 8 PHE QD 1 31 GLY H 4.012 2.641 5.383 5.074 4.417 5.470 0.087 2 0 "[ . 1 . 2 .]" 1
31 1 8 PHE QD 1 32 GLN HB2 4.020 . 6.040 2.525 1.974 4.145 0.026 9 0 "[ . 1 . 2 .]" 1
32 1 8 PHE QD 1 32 GLN HB3 4.231 . 6.468 3.848 2.936 5.163 . 0 0 "[ . 1 . 2 .]" 1
33 1 8 PHE QD 1 32 GLN HG3 4.948 . 8.009 3.428 2.061 5.806 . 0 0 "[ . 1 . 2 .]" 1
34 1 8 PHE HZ 1 64 THR MG 4.034 2.806 5.262 4.483 2.780 5.278 0.026 8 0 "[ . 1 . 2 .]" 1
35 1 9 CYS H 1 9 CYS HB3 2.657 . 3.540 3.197 2.464 3.592 0.052 12 0 "[ . 1 . 2 .]" 1
36 1 9 CYS HB3 1 10 ALA H 4.191 . 6.386 2.597 1.838 3.581 0.158 8 0 "[ . 1 . 2 .]" 1
37 1 9 CYS HB3 1 91 CYS HB2 4.640 . 7.331 4.125 2.088 5.807 . 0 0 "[ . 1 . 2 .]" 1
38 1 10 ALA H 1 10 ALA MB 2.197 . 2.800 2.325 2.279 2.391 . 0 0 "[ . 1 . 2 .]" 1
39 1 10 ALA HA 1 10 ALA MB 2.035 . 2.553 2.122 2.111 2.134 . 0 0 "[ . 1 . 2 .]" 1
40 1 10 ALA HA 1 11 SER H 2.486 . 3.258 2.050 2.004 2.114 . 0 0 "[ . 1 . 2 .]" 1
41 1 10 ALA MB 1 11 SER H 2.761 . 3.714 3.103 2.956 3.357 . 0 0 "[ . 1 . 2 .]" 1
42 1 10 ALA MB 1 11 SER HA 2.888 . 3.930 3.971 3.920 4.017 0.087 16 0 "[ . 1 . 2 .]" 1
43 1 10 ALA MB 1 31 GLY HA3 3.576 2.469 4.683 3.618 3.035 4.450 . 0 0 "[ . 1 . 2 .]" 1
44 1 10 ALA MB 1 35 PRO HB3 2.350 . 3.040 2.415 2.134 2.884 . 0 0 "[ . 1 . 2 .]" 1
45 1 10 ALA MB 1 35 PRO HG3 2.340 . 3.025 2.462 2.124 2.931 . 0 0 "[ . 1 . 2 .]" 1
46 1 10 ALA MB 1 87 ALA MB 2.850 2.160 3.540 2.461 2.160 2.871 . 0 0 "[ . 1 . 2 .]" 1
47 1 10 ALA MB 1 89 ASN HB2 3.430 . 4.900 3.747 2.063 4.489 . 0 0 "[ . 1 . 2 .]" 1
48 1 10 ALA MB 1 89 ASN HB3 2.584 . 3.419 3.190 2.471 3.483 0.064 11 0 "[ . 1 . 2 .]" 1
49 1 10 ALA MB 1 89 ASN HD21 3.039 . 4.193 2.739 1.889 4.235 0.042 8 0 "[ . 1 . 2 .]" 1
50 1 10 ALA MB 1 89 ASN HD22 3.408 . 4.860 2.828 2.113 4.908 0.048 8 0 "[ . 1 . 2 .]" 1
51 1 10 ALA MB 1 93 GLN HA 3.693 2.718 4.768 3.966 3.377 4.605 . 0 0 "[ . 1 . 2 .]" 1
52 1 10 ALA MB 1 94 ALA H 2.776 . 3.739 3.481 3.015 3.785 0.046 17 0 "[ . 1 . 2 .]" 1
53 1 10 ALA MB 1 94 ALA MB 2.866 2.331 3.401 2.734 2.325 3.037 0.006 25 0 "[ . 1 . 2 .]" 1
54 1 11 SER H 1 11 SER HA 2.958 . 4.052 2.918 2.902 2.941 . 0 0 "[ . 1 . 2 .]" 1
55 1 11 SER H 1 11 SER HB3 3.081 . 4.268 3.371 2.470 3.765 . 0 0 "[ . 1 . 2 .]" 1
56 1 11 SER H 1 12 VAL H 4.290 . 6.591 4.355 4.277 4.420 . 0 0 "[ . 1 . 2 .]" 1
57 1 11 SER H 1 30 ASP H 2.792 . 3.766 2.825 2.487 3.102 . 0 0 "[ . 1 . 2 .]" 1
58 1 11 SER H 1 30 ASP HA 3.963 . 5.926 4.746 4.519 5.378 . 0 0 "[ . 1 . 2 .]" 1
59 1 11 SER H 1 30 ASP HB2 4.643 . 7.337 5.033 4.107 5.549 . 0 0 "[ . 1 . 2 .]" 1
60 1 11 SER H 1 94 ALA MB 3.459 . 4.955 4.107 3.811 4.553 . 0 0 "[ . 1 . 2 .]" 1
61 1 11 SER HA 1 11 SER HB3 2.911 . 3.971 2.632 2.354 3.048 . 0 0 "[ . 1 . 2 .]" 1
62 1 11 SER HA 1 12 VAL H 2.178 . 2.771 2.238 2.173 2.359 . 0 0 "[ . 1 . 2 .]" 1
63 1 11 SER HA 1 12 VAL HB 3.951 . 5.902 4.519 4.425 4.601 . 0 0 "[ . 1 . 2 .]" 1
64 1 11 SER HA 1 94 ALA MB 2.504 2.002 3.006 2.604 2.160 3.034 0.028 21 0 "[ . 1 . 2 .]" 1
65 1 11 SER HB2 1 30 ASP H 4.967 . 8.050 3.787 2.918 4.932 . 0 0 "[ . 1 . 2 .]" 1
66 1 11 SER HB2 1 94 ALA MB 4.238 . 6.483 4.875 4.309 5.418 . 0 0 "[ . 1 . 2 .]" 1
67 1 11 SER HB3 1 12 VAL H 3.609 . 5.237 3.440 2.915 4.181 . 0 0 "[ . 1 . 2 .]" 1
68 1 11 SER HB3 1 13 GLN H 4.184 . 6.372 5.521 5.091 5.964 . 0 0 "[ . 1 . 2 .]" 1
69 1 12 VAL H 1 12 VAL HA 2.903 . 3.957 2.937 2.925 2.953 . 0 0 "[ . 1 . 2 .]" 1
70 1 12 VAL H 1 12 VAL HB 2.715 . 3.636 2.612 2.556 2.740 . 0 0 "[ . 1 . 2 .]" 1
71 1 12 VAL H 1 94 ALA MB 2.617 . 3.473 2.570 2.287 3.079 . 0 0 "[ . 1 . 2 .]" 1
72 1 12 VAL HA 1 12 VAL HB 2.692 . 3.598 3.041 3.033 3.047 . 0 0 "[ . 1 . 2 .]" 1
73 1 12 VAL HA 1 13 GLN H 2.163 . 2.748 2.124 2.067 2.188 . 0 0 "[ . 1 . 2 .]" 1
74 1 12 VAL HA 1 13 GLN HG2 3.926 . 5.853 4.817 3.813 5.620 . 0 0 "[ . 1 . 2 .]" 1
75 1 12 VAL HA 1 14 LEU HA 4.393 . 6.805 6.112 5.943 6.347 . 0 0 "[ . 1 . 2 .]" 1
76 1 12 VAL HA 1 29 VAL HA 2.615 . 3.470 2.513 2.390 2.790 . 0 0 "[ . 1 . 2 .]" 1
77 1 12 VAL HA 1 29 VAL HB 3.309 . 4.678 3.171 2.971 3.336 . 0 0 "[ . 1 . 2 .]" 1
78 1 12 VAL HB 1 13 GLN H 3.569 . 5.161 4.328 4.175 4.413 . 0 0 "[ . 1 . 2 .]" 1
79 1 12 VAL HB 1 29 VAL HA 4.401 . 6.822 5.448 5.275 5.714 . 0 0 "[ . 1 . 2 .]" 1
80 1 12 VAL HB 1 96 ALA MB 3.392 2.273 4.511 2.839 2.372 3.239 . 0 0 "[ . 1 . 2 .]" 1
81 1 13 GLN H 1 13 GLN HA 2.255 . 2.890 2.914 2.898 2.924 0.034 17 0 "[ . 1 . 2 .]" 1
82 1 13 GLN H 1 13 GLN HB3 2.994 . 4.115 3.661 3.215 3.759 . 0 0 "[ . 1 . 2 .]" 1
83 1 13 GLN H 1 13 GLN HG2 3.055 . 4.222 3.498 2.240 4.068 . 0 0 "[ . 1 . 2 .]" 1
84 1 13 GLN H 1 28 SER H 2.864 . 3.889 3.174 2.981 3.319 . 0 0 "[ . 1 . 2 .]" 1
85 1 13 GLN H 1 29 VAL HA 3.549 . 5.123 3.249 2.979 3.493 . 0 0 "[ . 1 . 2 .]" 1
86 1 13 GLN HA 1 13 GLN HG2 2.895 . 3.943 2.813 2.410 3.734 . 0 0 "[ . 1 . 2 .]" 1
87 1 13 GLN HA 1 14 LEU H 2.293 . 2.950 2.122 2.025 2.198 . 0 0 "[ . 1 . 2 .]" 1
88 1 13 GLN HA 1 96 ALA MB 2.607 . 3.456 3.288 2.788 3.498 0.042 3 0 "[ . 1 . 2 .]" 1
89 1 13 GLN QB 1 15 HIS HD2 2.918 . 3.982 3.768 2.939 4.014 0.032 14 0 "[ . 1 . 2 .]" 1
90 1 13 GLN HB2 1 28 SER HB2 5.799 . 10.003 2.607 1.901 4.506 . 0 0 "[ . 1 . 2 .]" 1
91 1 13 GLN HB3 1 13 GLN HG2 2.061 . 2.592 2.614 2.397 3.016 0.424 11 0 "[ . 1 . 2 .]" 1
92 1 13 GLN HB3 1 14 LEU H 4.137 . 6.277 3.468 3.010 4.172 . 0 0 "[ . 1 . 2 .]" 1
93 1 13 GLN HB3 1 14 LEU HB3 4.773 . 7.620 6.558 6.300 7.605 . 0 0 "[ . 1 . 2 .]" 1
94 1 13 GLN HB3 1 27 PHE HA 4.212 . 6.430 5.573 4.889 6.934 0.504 23 1 "[ . 1 . 2 + .]" 1
95 1 13 GLN HB3 1 28 SER H 3.350 . 4.753 4.533 4.002 5.479 0.726 23 1 "[ . 1 . 2 + .]" 1
96 1 13 GLN HE22 1 13 GLN HG2 3.957 . 5.915 3.705 3.461 4.063 . 0 0 "[ . 1 . 2 .]" 1
97 1 13 GLN QG 1 14 LEU H 5.725 . 9.822 4.339 3.993 4.803 . 0 0 "[ . 1 . 2 .]" 1
98 1 13 GLN HG2 1 14 LEU H 4.744 . 7.558 4.693 4.198 5.247 . 0 0 "[ . 1 . 2 .]" 1
99 1 13 GLN HG2 1 28 SER H 4.592 . 7.228 5.648 3.370 6.394 . 0 0 "[ . 1 . 2 .]" 1
100 1 13 GLN HG2 1 28 SER HB2 4.872 . 7.839 4.743 2.358 6.144 . 0 0 "[ . 1 . 2 .]" 1
101 1 13 GLN HG2 1 96 ALA MB 4.016 . 6.032 5.260 4.863 5.906 . 0 0 "[ . 1 . 2 .]" 1
102 1 13 GLN HG3 1 14 LEU H 5.183 . 8.541 5.176 4.495 5.587 . 0 0 "[ . 1 . 2 .]" 1
103 1 13 GLN HG3 1 28 SER HB3 4.689 . 7.438 5.178 3.656 6.149 . 0 0 "[ . 1 . 2 .]" 1
104 1 14 LEU H 1 14 LEU HB2 2.572 . 3.399 2.430 2.356 2.590 . 0 0 "[ . 1 . 2 .]" 1
105 1 14 LEU H 1 14 LEU HB3 3.352 . 4.756 3.619 3.577 3.701 . 0 0 "[ . 1 . 2 .]" 1
106 1 14 LEU H 1 14 LEU MD1 3.652 . 5.319 3.959 3.822 4.213 . 0 0 "[ . 1 . 2 .]" 1
107 1 14 LEU H 1 14 LEU MD2 3.899 . 5.799 4.083 3.966 4.250 . 0 0 "[ . 1 . 2 .]" 1
108 1 14 LEU H 1 96 ALA MB 2.417 . 3.147 2.869 2.531 3.167 0.020 17 0 "[ . 1 . 2 .]" 1
109 1 14 LEU HA 1 14 LEU MD1 3.092 . 4.287 3.825 3.802 3.857 . 0 0 "[ . 1 . 2 .]" 1
110 1 14 LEU HA 1 14 LEU MD2 2.375 . 3.080 2.007 1.948 2.152 . 0 0 "[ . 1 . 2 .]" 1
111 1 14 LEU HA 1 15 HIS H 2.319 . 2.991 2.318 2.225 2.376 . 0 0 "[ . 1 . 2 .]" 1
112 1 14 LEU HA 1 27 PHE HA 2.962 . 4.059 2.577 2.412 2.716 . 0 0 "[ . 1 . 2 .]" 1
113 1 14 LEU HA 1 85 LEU MD1 6.104 . 10.761 6.591 6.463 6.708 . 0 0 "[ . 1 . 2 .]" 1
114 1 14 LEU HA 1 96 ALA MB 3.916 . 5.833 4.345 4.129 4.606 . 0 0 "[ . 1 . 2 .]" 1
115 1 14 LEU HB2 1 14 LEU MD1 1.865 . 2.300 2.293 2.243 2.312 0.012 11 0 "[ . 1 . 2 .]" 1
116 1 14 LEU HB2 1 14 LEU MD2 2.418 . 3.149 3.158 3.143 3.171 0.022 2 0 "[ . 1 . 2 .]" 1
117 1 14 LEU HB2 1 15 HIS H 3.634 . 5.285 3.899 3.815 4.063 . 0 0 "[ . 1 . 2 .]" 1
118 1 14 LEU HB3 1 14 LEU MD1 2.090 . 2.636 2.451 2.385 2.518 . 0 0 "[ . 1 . 2 .]" 1
119 1 14 LEU HB3 1 14 LEU MD2 1.933 . 2.400 2.254 2.204 2.299 . 0 0 "[ . 1 . 2 .]" 1
120 1 14 LEU HB3 1 15 HIS H 3.145 . 4.381 2.605 2.476 2.868 . 0 0 "[ . 1 . 2 .]" 1
121 1 14 LEU MD1 1 15 HIS H 4.086 . 6.172 4.495 4.318 4.717 . 0 0 "[ . 1 . 2 .]" 1
122 1 14 LEU MD1 1 27 PHE HA 4.332 . 6.678 5.331 4.934 5.685 . 0 0 "[ . 1 . 2 .]" 1
123 1 14 LEU MD1 1 27 PHE QB 3.037 . 4.190 4.016 3.853 4.190 . 0 0 "[ . 1 . 2 .]" 1
124 1 14 LEU MD1 1 39 TRP HH2 2.883 . 3.922 3.773 3.571 3.935 0.013 18 0 "[ . 1 . 2 .]" 1
125 1 14 LEU MD1 1 83 TYR HD1 4.694 . 7.448 5.956 5.525 6.440 . 0 0 "[ . 1 . 2 .]" 1
126 1 14 LEU MD1 1 85 LEU HB2 2.371 . 3.073 2.084 2.039 2.139 . 0 0 "[ . 1 . 2 .]" 1
127 1 14 LEU MD1 1 85 LEU MD1 2.888 . 3.791 3.882 3.855 3.906 0.115 20 0 "[ . 1 . 2 .]" 1
128 1 14 LEU MD1 1 85 LEU MD2 2.428 . 3.165 3.076 2.939 3.181 0.016 8 0 "[ . 1 . 2 .]" 1
129 1 14 LEU MD1 1 97 SER HA 2.996 . 4.118 2.857 2.346 3.328 . 0 0 "[ . 1 . 2 .]" 1
130 1 14 LEU MD2 1 15 HIS H 2.777 . 3.741 2.899 2.691 3.105 . 0 0 "[ . 1 . 2 .]" 1
131 1 14 LEU MD2 1 25 ILE MD 2.409 . 3.134 2.527 2.400 2.652 . 0 0 "[ . 1 . 2 .]" 1
132 1 14 LEU MD2 1 27 PHE HA 3.160 . 4.408 2.708 2.361 3.420 . 0 0 "[ . 1 . 2 .]" 1
133 1 14 LEU MD2 1 27 PHE HB2 3.575 . 5.172 2.470 2.230 2.943 . 0 0 "[ . 1 . 2 .]" 1
134 1 14 LEU MD2 1 27 PHE HB3 2.046 . 2.569 1.922 1.805 2.109 . 0 0 "[ . 1 . 2 .]" 1
135 1 14 LEU MD2 1 27 PHE HD1 4.154 . 6.311 4.365 3.694 4.697 . 0 0 "[ . 1 . 2 .]" 1
136 1 14 LEU MD2 1 28 SER H 4.165 . 6.333 3.871 3.504 4.661 . 0 0 "[ . 1 . 2 .]" 1
137 1 14 LEU MD2 1 39 TRP HH2 2.058 . 2.587 2.205 2.033 2.369 . 0 0 "[ . 1 . 2 .]" 1
138 1 14 LEU MD2 1 85 LEU MD1 2.888 2.115 3.561 3.573 3.458 3.609 0.048 17 0 "[ . 1 . 2 .]" 1
139 1 14 LEU MD2 1 85 LEU MD2 2.329 . 3.007 2.154 1.970 2.290 . 0 0 "[ . 1 . 2 .]" 1
140 1 14 LEU MD2 1 97 SER HA 3.850 . 5.703 5.233 4.808 5.703 0.000 15 0 "[ . 1 . 2 .]" 1
141 1 14 LEU MD2 1 98 ILE HB 3.506 . 5.043 3.616 3.204 3.969 . 0 0 "[ . 1 . 2 .]" 1
142 1 15 HIS H 1 15 HIS HB2 3.817 . 5.638 2.644 2.555 2.708 . 0 0 "[ . 1 . 2 .]" 1
143 1 15 HIS H 1 15 HIS HB3 3.112 . 4.323 3.756 3.697 3.797 . 0 0 "[ . 1 . 2 .]" 1
144 1 15 HIS H 1 15 HIS HD2 3.491 . 5.015 3.381 2.975 3.859 . 0 0 "[ . 1 . 2 .]" 1
145 1 15 HIS H 1 16 THR H 4.319 . 6.651 4.313 4.248 4.372 . 0 0 "[ . 1 . 2 .]" 1
146 1 15 HIS H 1 26 PRO QB 4.415 . 6.851 4.375 4.037 4.680 . 0 0 "[ . 1 . 2 .]" 1
147 1 15 HIS H 1 27 PHE HA 3.840 . 5.684 3.544 3.351 3.806 . 0 0 "[ . 1 . 2 .]" 1
148 1 15 HIS HA 1 16 THR H 2.412 . 3.139 2.219 2.131 2.291 . 0 0 "[ . 1 . 2 .]" 1
149 1 15 HIS HA 1 16 THR HA 4.602 . 7.249 3.839 3.799 3.879 . 0 0 "[ . 1 . 2 .]" 1
150 1 15 HIS HB2 1 16 THR H 2.893 . 3.940 3.891 3.718 4.021 0.081 16 0 "[ . 1 . 2 .]" 1
151 1 15 HIS HB2 1 26 PRO QB 5.769 . 7.689 2.512 2.274 2.873 . 0 0 "[ . 1 . 2 .]" 1
152 1 15 HIS HB2 1 98 ILE MD 5.021 . 8.172 6.028 5.677 6.338 . 0 0 "[ . 1 . 2 .]" 1
153 1 15 HIS HB3 1 15 HIS HD2 3.301 . 4.663 3.933 3.689 3.995 . 0 0 "[ . 1 . 2 .]" 1
154 1 15 HIS HB3 1 16 THR H 3.702 . 5.415 2.776 2.546 2.993 . 0 0 "[ . 1 . 2 .]" 1
155 1 15 HIS HB3 1 26 PRO HG2 3.675 . 5.363 3.446 2.978 4.166 . 0 0 "[ . 1 . 2 .]" 1
156 1 15 HIS HB3 1 98 ILE MD 4.271 . 6.551 6.127 5.736 6.330 . 0 0 "[ . 1 . 2 .]" 1
157 1 15 HIS HD2 1 26 PRO QB 3.751 . 5.509 3.577 2.794 4.987 . 0 0 "[ . 1 . 2 .]" 1
158 1 15 HIS HD2 1 27 PHE HA 3.672 . 5.357 2.857 2.146 5.383 0.026 17 0 "[ . 1 . 2 .]" 1
159 1 16 THR H 1 16 THR HA 2.776 . 3.739 2.760 2.707 2.814 . 0 0 "[ . 1 . 2 .]" 1
160 1 16 THR H 1 16 THR HB 2.665 . 3.553 2.575 2.386 2.683 . 0 0 "[ . 1 . 2 .]" 1
161 1 16 THR H 1 16 THR MG 3.586 . 5.193 3.651 3.544 3.715 . 0 0 "[ . 1 . 2 .]" 1
162 1 16 THR H 1 98 ILE MD 3.515 . 5.059 4.582 4.269 4.896 . 0 0 "[ . 1 . 2 .]" 1
163 1 16 THR HA 1 16 THR MG 2.094 . 2.642 2.309 2.213 2.391 . 0 0 "[ . 1 . 2 .]" 1
164 1 16 THR HA 1 17 ALA H 2.074 . 2.612 2.161 2.105 2.231 . 0 0 "[ . 1 . 2 .]" 1
165 1 16 THR HA 1 17 ALA MB 3.526 . 5.080 3.961 3.883 4.033 . 0 0 "[ . 1 . 2 .]" 1
166 1 16 THR HA 1 98 ILE MD . 2.278 3.366 2.315 2.238 2.602 0.040 19 0 "[ . 1 . 2 .]" 1
167 1 16 THR HB 1 16 THR MG 1.920 . 2.381 2.149 2.134 2.157 . 0 0 "[ . 1 . 2 .]" 1
168 1 16 THR HB 1 17 ALA H 3.231 . 4.536 3.995 3.854 4.069 . 0 0 "[ . 1 . 2 .]" 1
169 1 16 THR MG 1 17 ALA H 2.024 . 2.536 2.541 2.430 2.572 0.036 15 0 "[ . 1 . 2 .]" 1
170 1 16 THR MG 1 17 ALA HA 3.762 . 5.531 4.326 4.170 4.464 . 0 0 "[ . 1 . 2 .]" 1
171 1 16 THR MG 1 98 ILE MD 2.599 . 3.443 3.063 2.593 3.401 . 0 0 "[ . 1 . 2 .]" 1
172 1 17 ALA H 1 17 ALA HA 2.847 . 3.860 2.785 2.722 2.841 . 0 0 "[ . 1 . 2 .]" 1
173 1 17 ALA H 1 17 ALA MB 1.982 . 2.473 2.194 2.167 2.233 . 0 0 "[ . 1 . 2 .]" 1
174 1 17 ALA H 1 18 VAL H 4.521 . 7.076 4.550 4.482 4.585 . 0 0 "[ . 1 . 2 .]" 1
175 1 17 ALA H 1 25 ILE HA 4.245 . 6.497 4.261 3.888 4.572 . 0 0 "[ . 1 . 2 .]" 1
176 1 17 ALA H 1 98 ILE MD 2.735 . 3.670 2.265 1.925 2.953 . 0 0 "[ . 1 . 2 .]" 1
177 1 17 ALA HA 1 17 ALA MB 1.987 . 2.480 2.127 2.103 2.144 . 0 0 "[ . 1 . 2 .]" 1
178 1 17 ALA HA 1 18 VAL H 2.340 . 3.024 2.179 2.110 2.257 . 0 0 "[ . 1 . 2 .]" 1
179 1 17 ALA HA 1 18 VAL HA 4.628 . 7.305 4.286 4.245 4.345 . 0 0 "[ . 1 . 2 .]" 1
180 1 17 ALA MB 1 18 VAL H 2.890 . 3.934 2.825 2.600 3.027 . 0 0 "[ . 1 . 2 .]" 1
181 1 17 ALA MB 1 18 VAL HA 3.328 . 4.713 4.211 4.133 4.276 . 0 0 "[ . 1 . 2 .]" 1
182 1 17 ALA MB 1 18 VAL HB 3.860 . 5.722 5.663 5.515 5.742 0.020 21 0 "[ . 1 . 2 .]" 1
183 1 17 ALA MB 1 23 TRP HB2 4.743 . 7.555 4.574 3.789 5.372 . 0 0 "[ . 1 . 2 .]" 1
184 1 17 ALA MB 1 23 TRP HB3 3.819 . 5.642 3.065 2.312 3.852 . 0 0 "[ . 1 . 2 .]" 1
185 1 17 ALA MB 1 23 TRP HE3 2.407 2.253 3.131 2.288 2.154 2.853 0.099 18 0 "[ . 1 . 2 .]" 1
186 1 17 ALA MB 1 23 TRP HZ3 2.646 . 3.521 3.164 2.690 3.532 0.011 23 0 "[ . 1 . 2 .]" 1
187 1 17 ALA MB 1 25 ILE HA 3.013 . 4.148 3.038 2.734 3.261 . 0 0 "[ . 1 . 2 .]" 1
188 1 17 ALA MB 1 25 ILE MD 2.672 . 3.564 3.056 2.826 3.228 . 0 0 "[ . 1 . 2 .]" 1
189 1 17 ALA MB 1 100 ALA MB 2.870 2.321 3.419 2.651 2.306 3.235 0.015 1 0 "[ . 1 . 2 .]" 1
190 1 18 VAL H 1 18 VAL HA 2.715 . 3.636 2.899 2.888 2.911 . 0 0 "[ . 1 . 2 .]" 1
191 1 18 VAL H 1 18 VAL HB 2.889 . 3.932 3.701 3.670 3.735 . 0 0 "[ . 1 . 2 .]" 1
192 1 18 VAL H 1 19 GLU H 4.322 . 6.657 4.471 4.406 4.565 . 0 0 "[ . 1 . 2 .]" 1
193 1 18 VAL HA 1 18 VAL HB 2.544 . 3.353 2.498 2.473 2.537 . 0 0 "[ . 1 . 2 .]" 1
194 1 18 VAL HA 1 19 GLU H 2.446 . 3.194 2.113 2.039 2.258 . 0 0 "[ . 1 . 2 .]" 1
195 1 18 VAL HA 1 19 GLU HA 4.508 . 7.048 4.251 4.181 4.318 . 0 0 "[ . 1 . 2 .]" 1
196 1 18 VAL HA 1 19 GLU HB3 4.813 . 7.708 5.122 4.308 5.671 . 0 0 "[ . 1 . 2 .]" 1
197 1 18 VAL HB 1 19 GLU H 2.663 . 3.549 3.030 2.761 3.229 . 0 0 "[ . 1 . 2 .]" 1
198 1 18 VAL HB 1 19 GLU HA 4.563 . 7.165 4.956 4.763 5.055 . 0 0 "[ . 1 . 2 .]" 1
199 1 18 VAL HB 1 24 CYS HB2 4.708 . 7.479 5.051 4.595 5.751 . 0 0 "[ . 1 . 2 .]" 1
200 1 18 VAL HB 1 24 CYS HB2 5.221 . 8.628 6.404 6.092 6.980 . 0 0 "[ . 1 . 2 .]" 1
201 1 18 VAL HB 1 24 CYS HB3 4.765 . 7.603 4.876 4.657 5.511 . 0 0 "[ . 1 . 2 .]" 1
202 1 19 GLU H 1 19 GLU HB2 3.097 . 4.296 2.534 2.355 2.874 . 0 0 "[ . 1 . 2 .]" 1
203 1 19 GLU H 1 19 GLU HB3 2.816 . 3.807 3.112 2.294 3.640 . 0 0 "[ . 1 . 2 .]" 1
204 1 19 GLU H 1 19 GLU HG2 3.963 . 5.927 3.792 2.098 4.633 . 0 0 "[ . 1 . 2 .]" 1
205 1 19 GLU H 1 19 GLU HG3 4.797 . 7.673 3.332 2.249 4.553 . 0 0 "[ . 1 . 2 .]" 1
206 1 19 GLU HA 1 19 GLU HG2 3.221 . 4.518 2.937 2.428 3.919 . 0 0 "[ . 1 . 2 .]" 1
207 1 19 GLU HA 1 19 GLU HG3 3.497 . 5.025 3.005 2.505 3.843 . 0 0 "[ . 1 . 2 .]" 1
208 1 19 GLU HA 1 20 MET H 2.595 . 3.437 2.121 2.030 2.295 . 0 0 "[ . 1 . 2 .]" 1
209 1 19 GLU HA 1 20 MET HG2 5.950 . 10.376 4.541 3.742 5.957 . 0 0 "[ . 1 . 2 .]" 1
210 1 19 GLU HA 1 20 MET HG3 5.115 . 8.385 4.985 4.035 5.632 . 0 0 "[ . 1 . 2 .]" 1
211 1 19 GLU HG3 1 20 MET H 4.819 . 7.722 4.581 2.891 5.929 . 0 0 "[ . 1 . 2 .]" 1
212 1 20 MET H 1 20 MET ME 4.266 . 6.541 4.641 3.973 5.024 . 0 0 "[ . 1 . 2 .]" 1
213 1 20 MET H 1 20 MET HG2 3.993 . 5.986 3.236 2.685 4.308 . 0 0 "[ . 1 . 2 .]" 1
214 1 20 MET H 1 20 MET HG3 3.549 . 5.124 3.328 2.704 3.568 . 0 0 "[ . 1 . 2 .]" 1
215 1 20 MET HA 1 20 MET HB2 2.789 . 3.761 2.613 2.474 3.042 . 0 0 "[ . 1 . 2 .]" 1
216 1 20 MET HA 1 20 MET ME 4.266 . 6.541 5.263 4.463 5.507 . 0 0 "[ . 1 . 2 .]" 1
217 1 20 MET HA 1 20 MET HG2 3.033 . 4.183 3.583 2.564 4.286 0.103 24 0 "[ . 1 . 2 .]" 1
218 1 20 MET HA 1 20 MET HG3 4.321 . 6.655 3.696 3.195 3.863 . 0 0 "[ . 1 . 2 .]" 1
219 1 20 MET HB2 1 20 MET HG2 2.882 . 3.920 2.967 2.530 3.010 . 0 0 "[ . 1 . 2 .]" 1
220 1 20 MET HB2 1 70 LEU HA 7.156 . 13.556 8.539 7.905 9.044 . 0 0 "[ . 1 . 2 .]" 1
221 1 20 MET HB3 1 20 MET HG3 2.585 . 3.420 2.975 2.557 3.012 . 0 0 "[ . 1 . 2 .]" 1
222 1 20 MET ME 1 24 CYS H 4.123 . 6.247 3.364 3.081 3.761 . 0 0 "[ . 1 . 2 .]" 1
223 1 20 MET ME 1 24 CYS HB2 2.520 . 3.314 2.669 2.215 3.308 . 0 0 "[ . 1 . 2 .]" 1
224 1 20 MET ME 1 24 CYS HB3 2.510 . 3.297 2.517 2.051 3.148 . 0 0 "[ . 1 . 2 .]" 1
225 1 21 HIS H 1 21 HIS HD2 4.397 . 6.814 4.046 2.422 5.304 . 0 0 "[ . 1 . 2 .]" 1
226 1 21 HIS HA 1 21 HIS HB3 2.734 . 3.669 2.643 2.474 3.040 . 0 0 "[ . 1 . 2 .]" 1
227 1 21 HIS HA 1 21 HIS HE1 5.238 . 8.668 5.382 4.667 5.826 . 0 0 "[ . 1 . 2 .]" 1
228 1 21 HIS HA 1 22 HIS H 3.852 . 5.707 3.479 3.411 3.562 . 0 0 "[ . 1 . 2 .]" 1
229 1 21 HIS HB2 1 22 HIS H 2.645 2.122 3.168 3.046 2.550 4.006 0.838 4 3 "[ +- 1 * . 2 .]" 1
230 1 21 HIS HB3 1 21 HIS HD2 3.509 . 5.048 3.427 2.818 3.982 . 0 0 "[ . 1 . 2 .]" 1
231 1 21 HIS HB3 1 22 HIS H 4.065 . 6.130 3.428 2.310 3.881 . 0 0 "[ . 1 . 2 .]" 1
232 1 22 HIS H 1 22 HIS HA 2.968 . 4.069 2.923 2.897 2.953 . 0 0 "[ . 1 . 2 .]" 1
233 1 22 HIS H 1 22 HIS HB2 2.880 . 3.917 2.787 2.390 3.903 . 0 0 "[ . 1 . 2 .]" 1
234 1 22 HIS H 1 23 TRP H 4.210 . 6.425 4.330 4.111 4.478 . 0 0 "[ . 1 . 2 .]" 1
235 1 22 HIS HA 1 23 TRP H 3.297 . 4.656 2.186 2.081 2.459 . 0 0 "[ . 1 . 2 .]" 1
236 1 22 HIS HB2 1 23 TRP H 3.219 . 4.515 3.979 2.938 4.424 . 0 0 "[ . 1 . 2 .]" 1
237 1 22 HIS HB3 1 23 TRP H 4.669 . 7.394 3.480 2.405 4.195 . 0 0 "[ . 1 . 2 .]" 1
238 1 23 TRP H 1 23 TRP HB2 2.383 . 3.093 2.410 2.302 2.583 . 0 0 "[ . 1 . 2 .]" 1
239 1 23 TRP H 1 23 TRP HB3 3.592 . 5.205 3.619 3.570 3.731 . 0 0 "[ . 1 . 2 .]" 1
240 1 23 TRP H 1 23 TRP HD1 3.438 . 4.916 2.611 2.322 3.254 . 0 0 "[ . 1 . 2 .]" 1
241 1 23 TRP H 1 24 CYS H 4.168 . 6.339 4.424 4.101 4.552 . 0 0 "[ . 1 . 2 .]" 1
242 1 23 TRP H 1 72 LEU H 3.689 . 5.390 3.627 3.224 4.188 . 0 0 "[ . 1 . 2 .]" 1
243 1 23 TRP H 1 72 LEU HB2 3.797 . 5.600 3.221 2.613 4.726 . 0 0 "[ . 1 . 2 .]" 1
244 1 23 TRP HA 1 24 CYS H 2.605 . 3.453 2.083 1.996 2.226 . 0 0 "[ . 1 . 2 .]" 1
245 1 23 TRP HA 1 24 CYS HA 4.629 . 7.307 4.335 4.272 4.388 . 0 0 "[ . 1 . 2 .]" 1
246 1 23 TRP HA 1 24 CYS HB2 5.002 . 8.130 4.393 4.196 4.564 . 0 0 "[ . 1 . 2 .]" 1
247 1 23 TRP HA 1 24 CYS HB3 4.511 . 7.055 4.317 4.195 4.487 . 0 0 "[ . 1 . 2 .]" 1
248 1 23 TRP HB2 1 23 TRP HD1 2.779 . 3.744 2.704 2.572 2.868 . 0 0 "[ . 1 . 2 .]" 1
249 1 23 TRP HB2 1 70 LEU HB2 4.970 . 8.057 5.978 5.529 6.318 . 0 0 "[ . 1 . 2 .]" 1
250 1 23 TRP HB2 1 72 LEU HB2 3.698 . 5.407 2.415 1.990 2.890 . 0 0 "[ . 1 . 2 .]" 1
251 1 23 TRP HB2 1 72 LEU MD1 3.027 . 4.172 2.630 1.873 3.506 0.009 19 0 "[ . 1 . 2 .]" 1
252 1 23 TRP HB2 1 72 LEU MD2 4.628 . 7.306 4.062 3.641 4.667 . 0 0 "[ . 1 . 2 .]" 1
253 1 23 TRP HB3 1 23 TRP HD1 3.730 . 5.469 3.825 3.651 3.887 . 0 0 "[ . 1 . 2 .]" 1
254 1 23 TRP HB3 1 23 TRP HE3 3.625 . 5.268 2.528 2.413 2.879 . 0 0 "[ . 1 . 2 .]" 1
255 1 23 TRP HB3 1 23 TRP HZ3 5.242 . 8.677 4.918 4.825 5.191 . 0 0 "[ . 1 . 2 .]" 1
256 1 23 TRP HB3 1 72 LEU H 4.018 . 6.036 4.363 3.951 4.774 . 0 0 "[ . 1 . 2 .]" 1
257 1 23 TRP HB3 1 72 LEU HB2 4.251 . 6.510 3.938 3.520 4.423 . 0 0 "[ . 1 . 2 .]" 1
258 1 23 TRP HB3 1 72 LEU MD1 2.922 . 3.989 3.113 2.249 3.839 . 0 0 "[ . 1 . 2 .]" 1
259 1 23 TRP HB3 1 72 LEU MD2 4.373 . 6.763 4.871 4.386 5.526 . 0 0 "[ . 1 . 2 .]" 1
260 1 23 TRP HD1 1 72 LEU HB2 3.468 . 4.972 3.836 2.925 4.462 . 0 0 "[ . 1 . 2 .]" 1
261 1 23 TRP HD1 1 72 LEU MD2 3.677 . 5.367 5.264 4.937 5.448 0.081 4 0 "[ . 1 . 2 .]" 1
262 1 23 TRP HE1 1 102 PHE HB3 4.381 . 6.780 4.692 3.051 7.173 0.393 8 0 "[ . 1 . 2 .]" 1
263 1 23 TRP HE3 1 102 PHE HA 3.994 . 5.988 4.263 2.858 5.994 0.006 20 0 "[ . 1 . 2 .]" 1
264 1 23 TRP HE3 1 24 CYS H 4.029 . 6.058 3.765 2.979 4.286 . 0 0 "[ . 1 . 2 .]" 1
265 1 23 TRP HE3 1 72 LEU MD1 4.461 . 6.949 5.025 3.979 5.792 . 0 0 "[ . 1 . 2 .]" 1
266 1 23 TRP HZ2 1 72 LEU HB2 5.534 . 9.362 8.343 7.453 9.053 . 0 0 "[ . 1 . 2 .]" 1
267 1 23 TRP HZ2 1 102 PHE QD 5.766 . 9.922 3.964 2.335 5.052 . 0 0 "[ . 1 . 2 .]" 1
268 1 24 CYS H 1 24 CYS HB2 2.950 . 4.038 3.106 2.846 3.342 . 0 0 "[ . 1 . 2 .]" 1
269 1 24 CYS H 1 24 CYS HB3 3.246 . 4.563 2.577 2.418 2.680 . 0 0 "[ . 1 . 2 .]" 1
270 1 24 CYS H 1 25 ILE HB 4.334 . 6.682 6.286 6.104 6.495 . 0 0 "[ . 1 . 2 .]" 1
271 1 24 CYS H 1 72 LEU MD1 4.227 . 6.460 5.001 4.148 5.566 . 0 0 "[ . 1 . 2 .]" 1
272 1 24 CYS HA 1 24 CYS HB3 2.881 . 3.919 3.028 3.012 3.037 . 0 0 "[ . 1 . 2 .]" 1
273 1 24 CYS HA 1 25 ILE H 2.438 . 3.181 2.124 2.083 2.158 . 0 0 "[ . 1 . 2 .]" 1
274 1 24 CYS HA 1 69 CYS HB2 4.110 . 6.222 5.066 4.832 5.627 . 0 0 "[ . 1 . 2 .]" 1
275 1 24 CYS HA 1 70 LEU H 4.165 . 6.333 4.584 4.213 4.802 . 0 0 "[ . 1 . 2 .]" 1
276 1 24 CYS HB2 1 25 ILE H 4.073 . 6.147 4.295 4.072 4.373 . 0 0 "[ . 1 . 2 .]" 1
277 1 25 ILE H 1 25 ILE HB 2.724 . 3.651 2.556 2.488 2.629 . 0 0 "[ . 1 . 2 .]" 1
278 1 25 ILE H 1 25 ILE MD 3.763 . 5.533 3.890 3.811 3.996 . 0 0 "[ . 1 . 2 .]" 1
279 1 25 ILE H 1 70 LEU H 2.686 . 3.588 3.028 2.828 3.249 . 0 0 "[ . 1 . 2 .]" 1
280 1 25 ILE H 1 70 LEU HB3 4.565 . 7.170 3.228 2.613 3.514 . 0 0 "[ . 1 . 2 .]" 1
281 1 25 ILE H 1 70 LEU MD1 4.830 . 7.746 5.405 5.101 5.513 . 0 0 "[ . 1 . 2 .]" 1
282 1 25 ILE H 1 70 LEU MD2 4.658 . 7.370 4.707 4.110 4.972 . 0 0 "[ . 1 . 2 .]" 1
283 1 25 ILE H 1 70 LEU HG 4.550 . 7.138 4.675 4.267 4.890 . 0 0 "[ . 1 . 2 .]" 1
284 1 25 ILE HA 1 25 ILE MD 3.974 . 5.948 3.879 3.862 3.899 . 0 0 "[ . 1 . 2 .]" 1
285 1 25 ILE HB 1 25 ILE MD 2.217 . 2.831 2.462 2.437 2.487 . 0 0 "[ . 1 . 2 .]" 1
286 1 25 ILE HB 1 70 LEU H 3.039 . 4.194 2.831 2.532 3.242 . 0 0 "[ . 1 . 2 .]" 1
287 1 25 ILE HB 1 70 LEU HB2 2.666 . 3.554 3.312 3.143 3.504 . 0 0 "[ . 1 . 2 .]" 1
288 1 25 ILE HB 1 70 LEU MD1 4.419 . 6.860 4.775 4.663 4.831 . 0 0 "[ . 1 . 2 .]" 1
289 1 25 ILE HB 1 70 LEU MD2 3.242 . 4.556 3.276 2.945 3.482 . 0 0 "[ . 1 . 2 .]" 1
290 1 25 ILE MD 1 39 TRP HH2 3.141 . 4.374 4.343 4.030 4.398 0.024 25 0 "[ . 1 . 2 .]" 1
291 1 25 ILE MD 1 70 LEU H 4.519 . 7.071 4.668 4.388 5.076 . 0 0 "[ . 1 . 2 .]" 1
292 1 25 ILE MD 1 70 LEU HA 5.083 . 8.312 5.384 5.101 5.744 . 0 0 "[ . 1 . 2 .]" 1
293 1 25 ILE MD 1 70 LEU HB3 3.265 . 4.598 2.809 2.464 3.199 . 0 0 "[ . 1 . 2 .]" 1
294 1 25 ILE MD 1 70 LEU MD2 1.634 . 1.968 1.963 1.911 2.013 0.045 17 0 "[ . 1 . 2 .]" 1
295 1 25 ILE MD 1 70 LEU HG 3.390 2.615 4.165 3.605 3.233 3.995 . 0 0 "[ . 1 . 2 .]" 1
296 1 25 ILE MD 1 83 TYR HB2 2.616 . 3.472 3.218 2.853 3.470 . 0 0 "[ . 1 . 2 .]" 1
297 1 25 ILE MD 1 83 TYR HB3 3.209 . 4.496 3.629 2.970 3.998 . 0 0 "[ . 1 . 2 .]" 1
298 1 25 ILE MD 1 83 TYR QD 3.227 . 4.529 3.082 2.629 3.628 . 0 0 "[ . 1 . 2 .]" 1
299 1 25 ILE MD 1 98 ILE MD 2.831 2.316 3.346 2.833 2.318 3.404 0.058 17 0 "[ . 1 . 2 .]" 1
300 1 25 ILE MD 1 100 ALA MB . 2.115 2.839 2.582 2.147 2.881 0.042 1 0 "[ . 1 . 2 .]" 1
301 1 26 PRO HA 1 26 PRO QB 3.687 . 4.738 2.198 2.183 2.210 . 0 0 "[ . 1 . 2 .]" 1
302 1 26 PRO HA 1 27 PHE H 2.422 . 3.155 2.171 2.112 2.222 . 0 0 "[ . 1 . 2 .]" 1
303 1 26 PRO HA 1 27 PHE HA 4.050 . 6.100 4.367 4.321 4.410 . 0 0 "[ . 1 . 2 .]" 1
304 1 26 PRO HA 1 69 CYS H 4.716 . 7.496 4.808 4.524 5.132 . 0 0 "[ . 1 . 2 .]" 1
305 1 26 PRO HA 1 69 CYS HA 3.267 . 4.601 2.378 2.144 2.670 . 0 0 "[ . 1 . 2 .]" 1
306 1 26 PRO HA 1 70 LEU HA 6.478 . 11.724 6.587 6.388 6.947 . 0 0 "[ . 1 . 2 .]" 1
307 1 26 PRO QB 1 26 PRO HD3 4.239 . 6.485 3.538 3.528 3.544 . 0 0 "[ . 1 . 2 .]" 1
308 1 26 PRO QB 1 27 PHE H 4.187 . 5.668 3.254 3.115 3.347 . 0 0 "[ . 1 . 2 .]" 1
309 1 26 PRO QB 1 69 CYS HB2 4.893 . 6.536 3.741 3.184 4.326 . 0 0 "[ . 1 . 2 .]" 1
310 1 26 PRO HG2 1 69 CYS HA 5.196 . 8.570 6.222 5.938 6.558 . 0 0 "[ . 1 . 2 .]" 1
311 1 26 PRO HG3 1 69 CYS HB2 3.583 . 5.188 4.258 3.645 4.977 . 0 0 "[ . 1 . 2 .]" 1
312 1 26 PRO HG3 1 69 CYS HB3 4.612 . 7.270 5.852 5.247 6.644 . 0 0 "[ . 1 . 2 .]" 1
313 1 27 PHE H 1 27 PHE HB3 3.298 . 4.657 3.216 3.083 3.349 . 0 0 "[ . 1 . 2 .]" 1
314 1 27 PHE H 1 27 PHE HD1 3.661 . 5.337 4.135 2.768 4.595 . 0 0 "[ . 1 . 2 .]" 1
315 1 27 PHE H 1 28 SER H 4.459 . 6.944 4.373 4.301 4.433 . 0 0 "[ . 1 . 2 .]" 1
316 1 27 PHE H 1 68 GLY H 3.138 . 4.369 3.132 2.913 3.858 . 0 0 "[ . 1 . 2 .]" 1
317 1 27 PHE H 1 68 GLY HA2 4.782 . 7.641 4.877 4.640 5.470 . 0 0 "[ . 1 . 2 .]" 1
318 1 27 PHE H 1 69 CYS HA 3.560 . 5.145 3.011 2.808 3.508 . 0 0 "[ . 1 . 2 .]" 1
319 1 27 PHE HA 1 27 PHE HB3 2.646 . 3.521 2.455 2.409 2.502 . 0 0 "[ . 1 . 2 .]" 1
320 1 27 PHE HA 1 27 PHE QD 4.546 . 7.129 3.766 3.748 3.799 . 0 0 "[ . 1 . 2 .]" 1
321 1 27 PHE HA 1 28 SER H 2.463 . 3.221 2.244 2.160 2.324 . 0 0 "[ . 1 . 2 .]" 1
322 1 27 PHE HA 1 28 SER HB2 5.995 . 10.488 4.590 4.384 5.567 . 0 0 "[ . 1 . 2 .]" 1
323 1 27 PHE HB2 1 27 PHE QD 3.345 . 4.743 2.420 2.396 2.440 . 0 0 "[ . 1 . 2 .]" 1
324 1 27 PHE HB2 1 28 SER H 2.648 . 3.524 2.642 2.472 2.838 . 0 0 "[ . 1 . 2 .]" 1
325 1 27 PHE HB2 1 85 LEU MD2 2.577 . 3.407 2.458 2.244 2.757 . 0 0 "[ . 1 . 2 .]" 1
326 1 27 PHE HB3 1 27 PHE QD 3.608 . 5.235 2.357 2.318 2.421 . 0 0 "[ . 1 . 2 .]" 1
327 1 27 PHE HB3 1 85 LEU MD2 2.898 . 3.948 2.894 2.637 3.287 . 0 0 "[ . 1 . 2 .]" 1
328 1 27 PHE QD 1 28 SER H 4.140 . 6.283 3.524 3.221 3.838 . 0 0 "[ . 1 . 2 .]" 1
329 1 27 PHE QD 1 28 SER HA 4.132 . 6.266 3.427 2.972 3.853 . 0 0 "[ . 1 . 2 .]" 1
330 1 27 PHE QD 1 29 VAL HB 3.851 . 5.705 3.402 3.295 3.534 . 0 0 "[ . 1 . 2 .]" 1
331 1 27 PHE QD 1 37 LEU MD1 2.598 . 3.442 3.439 3.222 3.520 0.078 21 0 "[ . 1 . 2 .]" 1
332 1 27 PHE QD 1 69 CYS HA 4.423 . 6.869 2.859 2.603 3.383 . 0 0 "[ . 1 . 2 .]" 1
333 1 27 PHE QD 1 85 LEU MD2 3.806 . 5.616 2.857 2.580 3.257 . 0 0 "[ . 1 . 2 .]" 1
334 1 27 PHE HD1 1 68 GLY H 3.756 . 5.519 4.345 3.756 5.137 . 0 0 "[ . 1 . 2 .]" 1
335 1 27 PHE QE 1 37 LEU MD2 3.281 2.170 4.392 3.831 3.497 4.202 . 0 0 "[ . 1 . 2 .]" 1
336 1 27 PHE QE 1 69 CYS HA 4.024 . 6.048 3.426 2.944 3.754 . 0 0 "[ . 1 . 2 .]" 1
337 1 27 PHE HE1 1 39 TRP HE1 3.769 . 5.545 4.710 3.938 4.900 . 0 0 "[ . 1 . 2 .]" 1
338 1 28 SER H 1 28 SER HB2 4.057 . 6.114 2.855 2.621 3.714 . 0 0 "[ . 1 . 2 .]" 1
339 1 28 SER H 1 28 SER HB3 3.244 . 4.559 3.751 3.196 3.873 . 0 0 "[ . 1 . 2 .]" 1
340 1 28 SER H 1 29 VAL H 4.411 . 6.843 3.993 3.855 4.146 . 0 0 "[ . 1 . 2 .]" 1
341 1 28 SER HA 1 28 SER HB2 2.936 . 4.014 2.976 2.512 3.049 . 0 0 "[ . 1 . 2 .]" 1
342 1 28 SER HA 1 29 VAL H 2.203 . 2.810 2.116 2.040 2.214 . 0 0 "[ . 1 . 2 .]" 1
343 1 28 SER HA 1 29 VAL HB 4.416 . 6.853 4.843 4.682 5.010 . 0 0 "[ . 1 . 2 .]" 1
344 1 28 SER HA 1 68 GLY HA2 5.124 . 8.406 6.654 6.173 7.259 . 0 0 "[ . 1 . 2 .]" 1
345 1 28 SER HB2 1 29 VAL H 3.856 . 5.715 4.205 3.487 4.379 . 0 0 "[ . 1 . 2 .]" 1
346 1 28 SER HB2 1 30 ASP HB3 4.471 . 6.970 5.996 4.327 7.344 0.374 5 0 "[ . 1 . 2 .]" 1
347 1 28 SER HB3 1 29 VAL H 4.421 . 6.864 3.669 3.294 4.224 . 0 0 "[ . 1 . 2 .]" 1
348 1 29 VAL H 1 29 VAL HA 2.872 . 3.903 2.915 2.897 2.931 . 0 0 "[ . 1 . 2 .]" 1
349 1 29 VAL H 1 29 VAL HB 2.933 . 4.008 3.289 3.183 3.388 . 0 0 "[ . 1 . 2 .]" 1
350 1 29 VAL H 1 65 VAL HA 4.299 . 6.609 4.581 4.248 4.872 . 0 0 "[ . 1 . 2 .]" 1
351 1 29 VAL H 1 66 ARG H 2.609 . 3.460 3.227 3.020 3.449 . 0 0 "[ . 1 . 2 .]" 1
352 1 29 VAL H 1 66 ARG HD3 3.908 . 5.817 5.588 4.876 6.462 0.645 16 5 "[ ** 1 -+ 2 * .]" 1
353 1 29 VAL HA 1 29 VAL HB 2.458 . 3.213 2.459 2.409 2.535 . 0 0 "[ . 1 . 2 .]" 1
354 1 29 VAL HA 1 30 ASP H 2.348 . 3.037 2.120 2.035 2.257 . 0 0 "[ . 1 . 2 .]" 1
355 1 29 VAL HB 1 30 ASP H 4.072 . 6.144 4.228 4.062 4.358 . 0 0 "[ . 1 . 2 .]" 1
356 1 29 VAL HB 1 37 LEU MD2 2.126 . 2.691 2.754 2.707 2.797 0.106 11 0 "[ . 1 . 2 .]" 1
357 1 29 VAL HB 1 87 ALA MB 2.917 . 3.980 3.643 3.449 3.953 . 0 0 "[ . 1 . 2 .]" 1
358 1 30 ASP H 1 30 ASP HA 2.746 . 3.689 2.930 2.905 2.961 . 0 0 "[ . 1 . 2 .]" 1
359 1 30 ASP H 1 30 ASP HB2 3.335 . 4.725 3.578 2.656 3.878 . 0 0 "[ . 1 . 2 .]" 1
360 1 30 ASP H 1 30 ASP HB3 3.327 . 4.711 2.851 2.441 3.154 . 0 0 "[ . 1 . 2 .]" 1
361 1 30 ASP HA 1 30 ASP HB2 2.824 . 3.821 2.416 2.346 2.579 . 0 0 "[ . 1 . 2 .]" 1
362 1 30 ASP HA 1 30 ASP HB3 2.994 . 4.114 2.642 2.408 3.035 . 0 0 "[ . 1 . 2 .]" 1
363 1 30 ASP HA 1 31 GLY H 2.377 . 3.083 2.187 2.074 2.337 . 0 0 "[ . 1 . 2 .]" 1
364 1 30 ASP HA 1 65 VAL H 4.009 . 6.018 4.585 4.247 4.846 . 0 0 "[ . 1 . 2 .]" 1
365 1 30 ASP HA 1 65 VAL HA 2.631 . 3.496 2.013 1.881 2.183 . 0 0 "[ . 1 . 2 .]" 1
366 1 30 ASP HA 1 66 ARG H 3.068 . 4.244 2.841 2.328 3.338 . 0 0 "[ . 1 . 2 .]" 1
367 1 30 ASP HB2 1 31 GLY H 3.720 . 5.450 3.023 2.304 4.200 . 0 0 "[ . 1 . 2 .]" 1
368 1 30 ASP HB2 1 31 GLY HA2 5.090 3.593 6.587 4.607 4.023 5.646 . 0 0 "[ . 1 . 2 .]" 1
369 1 30 ASP HB2 1 65 VAL HA 4.177 . 6.358 2.956 2.449 3.774 . 0 0 "[ . 1 . 2 .]" 1
370 1 31 GLY H 1 31 GLY HA2 2.678 . 3.575 2.692 2.607 2.804 . 0 0 "[ . 1 . 2 .]" 1
371 1 31 GLY H 1 32 GLN H 3.909 2.096 5.722 4.116 3.887 4.332 . 0 0 "[ . 1 . 2 .]" 1
372 1 31 GLY H 1 32 GLN HG3 4.659 . 7.372 6.860 5.975 7.682 0.310 7 0 "[ . 1 . 2 .]" 1
373 1 31 GLY H 1 35 PRO HD2 4.215 . 6.435 3.417 3.010 3.783 . 0 0 "[ . 1 . 2 .]" 1
374 1 31 GLY HA2 1 32 GLN H 2.413 . 3.082 2.326 2.147 2.695 . 0 0 "[ . 1 . 2 .]" 1
375 1 31 GLY HA2 1 32 GLN HG3 5.346 . 8.919 6.268 5.356 6.793 . 0 0 "[ . 1 . 2 .]" 1
376 1 31 GLY HA3 1 32 GLN H 3.157 . 4.738 2.872 2.478 3.122 . 0 0 "[ . 1 . 2 .]" 1
377 1 31 GLY HA3 1 32 GLN HG3 6.323 . 11.320 7.043 6.373 7.622 . 0 0 "[ . 1 . 2 .]" 1
378 1 31 GLY HA3 1 35 PRO HG2 4.401 . 6.822 5.680 5.218 6.522 . 0 0 "[ . 1 . 2 .]" 1
379 1 31 GLY HA3 1 35 PRO HG3 3.801 2.439 5.163 4.163 3.621 4.933 . 0 0 "[ . 1 . 2 .]" 1
380 1 32 GLN H 1 32 GLN HB2 3.267 . 4.601 2.643 2.351 2.863 . 0 0 "[ . 1 . 2 .]" 1
381 1 32 GLN H 1 32 GLN HB3 2.507 . 3.292 3.031 2.568 3.794 0.502 17 1 "[ . 1 . + 2 .]" 1
382 1 32 GLN H 1 32 GLN HG3 4.189 . 6.383 4.580 4.085 4.825 . 0 0 "[ . 1 . 2 .]" 1
383 1 32 GLN HA 1 32 GLN HG3 2.668 . 3.558 3.358 2.331 3.793 0.235 7 0 "[ . 1 . 2 .]" 1
384 1 32 GLN HA 1 33 PRO HB3 4.768 . 7.610 6.346 6.163 6.532 . 0 0 "[ . 1 . 2 .]" 1
385 1 32 GLN HA 1 34 ALA MB 4.233 2.760 5.706 5.494 4.994 5.769 0.063 14 0 "[ . 1 . 2 .]" 1
386 1 32 GLN HB2 1 32 GLN HG2 2.665 . 3.553 2.631 2.395 3.009 . 0 0 "[ . 1 . 2 .]" 1
387 1 32 GLN HB2 1 32 GLN HG3 2.978 . 4.087 2.391 2.294 2.489 . 0 0 "[ . 1 . 2 .]" 1
388 1 32 GLN HB2 1 64 THR MG 4.629 . 7.308 3.373 2.107 5.414 . 0 0 "[ . 1 . 2 .]" 1
389 1 32 GLN HB3 1 32 GLN HG3 2.413 . 3.141 2.627 2.387 3.007 . 0 0 "[ . 1 . 2 .]" 1
390 1 32 GLN HB3 1 64 THR MG 4.276 . 6.561 4.374 3.561 5.487 . 0 0 "[ . 1 . 2 .]" 1
391 1 32 GLN HE21 1 32 GLN HG3 2.701 . 3.613 3.154 2.200 3.530 . 0 0 "[ . 1 . 2 .]" 1
392 1 32 GLN HE21 1 34 ALA MB 4.661 . 7.376 7.036 5.858 7.509 0.133 24 0 "[ . 1 . 2 .]" 1
393 1 32 GLN HG3 1 33 PRO HD3 5.605 . 9.532 4.516 4.146 5.086 . 0 0 "[ . 1 . 2 .]" 1
394 1 32 GLN HG3 1 64 THR MG 2.582 . 3.416 3.355 2.191 4.221 0.805 9 4 "[ . - +1 *.* 2 .]" 1
395 1 33 PRO HA 1 33 PRO HB3 2.545 . 3.355 2.325 2.297 2.347 . 0 0 "[ . 1 . 2 .]" 1
396 1 33 PRO HA 1 33 PRO HD2 4.557 . 7.153 4.012 3.875 4.099 . 0 0 "[ . 1 . 2 .]" 1
397 1 33 PRO HA 1 34 ALA MB 3.771 . 5.549 3.946 3.798 4.002 . 0 0 "[ . 1 . 2 .]" 1
398 1 33 PRO HB2 1 33 PRO HD2 4.045 . 6.090 3.550 2.904 4.052 . 0 0 "[ . 1 . 2 .]" 1
399 1 33 PRO HB2 1 33 PRO HD3 4.160 . 6.323 3.882 3.843 3.933 . 0 0 "[ . 1 . 2 .]" 1
400 1 33 PRO HB2 1 34 ALA H 3.202 . 4.484 3.776 3.649 4.020 . 0 0 "[ . 1 . 2 .]" 1
401 1 33 PRO HB2 1 34 ALA HA 4.189 . 6.382 4.973 4.747 5.054 . 0 0 "[ . 1 . 2 .]" 1
402 1 33 PRO HB2 1 34 ALA MB 3.918 . 5.837 5.052 4.907 5.238 . 0 0 "[ . 1 . 2 .]" 1
403 1 33 PRO HB3 1 33 PRO HD2 3.670 . 5.354 3.883 3.839 3.924 . 0 0 "[ . 1 . 2 .]" 1
404 1 33 PRO HB3 1 33 PRO HD3 3.613 . 5.245 3.444 2.883 4.048 . 0 0 "[ . 1 . 2 .]" 1
405 1 33 PRO HB3 1 33 PRO HG2 2.557 . 3.374 2.847 2.646 2.988 . 0 0 "[ . 1 . 2 .]" 1
406 1 33 PRO HB3 1 34 ALA H 4.104 . 6.209 3.923 3.624 4.095 . 0 0 "[ . 1 . 2 .]" 1
407 1 33 PRO HB3 1 34 ALA HA 5.072 . 8.288 5.862 5.623 6.038 . 0 0 "[ . 1 . 2 .]" 1
408 1 33 PRO HB3 1 34 ALA MB 4.728 . 7.523 5.403 5.121 5.604 . 0 0 "[ . 1 . 2 .]" 1
409 1 33 PRO HD2 1 33 PRO HG2 2.350 . 3.040 2.309 2.286 2.327 . 0 0 "[ . 1 . 2 .]" 1
410 1 33 PRO HD2 1 33 PRO HG3 2.887 . 3.929 2.819 2.660 2.994 . 0 0 "[ . 1 . 2 .]" 1
411 1 33 PRO HD2 1 89 ASN HD21 4.482 . 6.993 4.511 3.142 7.134 0.141 2 0 "[ . 1 . 2 .]" 1
412 1 33 PRO HD3 1 33 PRO HG2 2.829 . 3.829 2.844 2.643 2.992 . 0 0 "[ . 1 . 2 .]" 1
413 1 33 PRO HD3 1 33 PRO HG3 2.242 . 2.870 2.303 2.262 2.323 . 0 0 "[ . 1 . 2 .]" 1
414 1 33 PRO HG2 1 34 ALA H 4.552 . 7.142 5.329 4.984 5.735 . 0 0 "[ . 1 . 2 .]" 1
415 1 33 PRO HG3 1 34 ALA H 4.931 . 7.970 5.468 5.072 5.709 . 0 0 "[ . 1 . 2 .]" 1
416 1 34 ALA H 1 34 ALA HA 2.876 . 3.910 2.808 2.760 2.853 . 0 0 "[ . 1 . 2 .]" 1
417 1 34 ALA H 1 34 ALA MB 1.956 . 2.434 2.208 2.133 2.256 . 0 0 "[ . 1 . 2 .]" 1
418 1 34 ALA H 1 35 PRO HD2 3.709 . 5.429 4.941 4.742 5.099 . 0 0 "[ . 1 . 2 .]" 1
419 1 34 ALA HA 1 34 ALA MB 1.759 . 2.146 2.120 2.102 2.138 . 0 0 "[ . 1 . 2 .]" 1
420 1 34 ALA HA 1 35 PRO HD2 2.053 . 2.580 2.213 1.997 2.399 . 0 0 "[ . 1 . 2 .]" 1
421 1 34 ALA HA 1 35 PRO HG3 4.421 . 6.864 4.391 4.288 4.468 . 0 0 "[ . 1 . 2 .]" 1
422 1 34 ALA MB 1 35 PRO HB3 4.123 . 6.248 5.487 5.357 5.646 . 0 0 "[ . 1 . 2 .]" 1
423 1 34 ALA MB 1 35 PRO HD2 3.144 . 4.380 3.171 3.070 3.286 . 0 0 "[ . 1 . 2 .]" 1
424 1 34 ALA MB 1 35 PRO HG2 4.982 . 8.085 4.826 4.591 5.067 . 0 0 "[ . 1 . 2 .]" 1
425 1 34 ALA MB 1 35 PRO HG3 4.615 . 7.278 5.363 5.286 5.450 . 0 0 "[ . 1 . 2 .]" 1
426 1 35 PRO HA 1 88 ALA H 4.608 . 7.263 4.055 3.581 4.672 . 0 0 "[ . 1 . 2 .]" 1
427 1 35 PRO HB2 1 36 SER H 2.707 . 3.623 3.065 2.638 3.389 . 0 0 "[ . 1 . 2 .]" 1
428 1 35 PRO HB2 1 36 SER HA 3.773 . 5.553 4.610 4.389 4.838 . 0 0 "[ . 1 . 2 .]" 1
429 1 35 PRO HB2 1 87 ALA MB 2.550 . 3.363 1.982 1.877 2.134 . 0 0 "[ . 1 . 2 .]" 1
430 1 35 PRO HB2 1 88 ALA H 3.166 . 4.419 2.902 2.662 3.280 . 0 0 "[ . 1 . 2 .]" 1
431 1 35 PRO HB3 1 35 PRO HD2 3.493 . 5.018 3.862 3.810 3.901 . 0 0 "[ . 1 . 2 .]" 1
432 1 35 PRO HB3 1 36 SER H 3.641 . 5.298 3.815 3.646 4.008 . 0 0 "[ . 1 . 2 .]" 1
433 1 35 PRO HB3 1 36 SER HA 4.603 . 7.252 5.831 5.709 5.942 . 0 0 "[ . 1 . 2 .]" 1
434 1 35 PRO HB3 1 87 ALA MB 3.191 . 4.464 2.965 2.704 3.204 . 0 0 "[ . 1 . 2 .]" 1
435 1 35 PRO HB3 1 88 ALA H 3.856 . 5.714 4.085 3.805 4.689 . 0 0 "[ . 1 . 2 .]" 1
436 1 35 PRO HD2 1 35 PRO HG3 2.526 . 3.324 2.750 2.671 2.803 . 0 0 "[ . 1 . 2 .]" 1
437 1 35 PRO HD3 1 35 PRO HG2 2.868 . 3.896 2.976 2.937 2.995 . 0 0 "[ . 1 . 2 .]" 1
438 1 35 PRO HG2 1 36 SER HA 4.018 . 6.036 5.018 4.656 5.312 . 0 0 "[ . 1 . 2 .]" 1
439 1 35 PRO HG2 1 37 LEU MD2 3.263 2.623 3.903 2.866 2.587 3.171 0.036 5 0 "[ . 1 . 2 .]" 1
440 1 35 PRO HG2 1 87 ALA MB 2.224 . 2.842 2.801 2.516 2.879 0.037 12 0 "[ . 1 . 2 .]" 1
441 1 35 PRO HG3 1 36 SER HA 4.714 . 7.492 6.486 6.187 6.708 . 0 0 "[ . 1 . 2 .]" 1
442 1 35 PRO HG3 1 87 ALA MB 2.203 . 2.810 2.828 2.691 2.877 0.067 20 0 "[ . 1 . 2 .]" 1
443 1 35 PRO HG3 1 88 ALA H 4.315 . 6.642 5.495 5.282 5.801 . 0 0 "[ . 1 . 2 .]" 1
444 1 35 PRO HG3 1 89 ASN HB2 5.206 . 8.594 5.072 3.683 6.057 . 0 0 "[ . 1 . 2 .]" 1
445 1 35 PRO HG3 1 89 ASN HB3 4.101 . 6.203 4.550 3.697 5.556 . 0 0 "[ . 1 . 2 .]" 1
446 1 36 SER H 1 36 SER HA 2.490 . 3.265 2.864 2.802 2.934 . 0 0 "[ . 1 . 2 .]" 1
447 1 36 SER H 1 36 SER HB3 3.624 . 5.266 3.041 2.472 3.655 . 0 0 "[ . 1 . 2 .]" 1
448 1 36 SER H 1 37 LEU H 4.250 . 6.508 4.399 4.242 4.539 . 0 0 "[ . 1 . 2 .]" 1
449 1 36 SER H 1 37 LEU MD2 4.121 . 6.244 4.977 4.717 5.137 . 0 0 "[ . 1 . 2 .]" 1
450 1 36 SER H 1 87 ALA HA 4.168 . 6.340 4.335 3.929 4.660 . 0 0 "[ . 1 . 2 .]" 1
451 1 36 SER H 1 88 ALA H 2.612 . 3.465 2.871 2.465 3.293 . 0 0 "[ . 1 . 2 .]" 1
452 1 36 SER H 1 88 ALA MB 3.163 . 4.413 3.373 2.831 4.130 . 0 0 "[ . 1 . 2 .]" 1
453 1 36 SER H 1 89 ASN HB2 4.856 . 7.803 5.100 3.972 5.646 . 0 0 "[ . 1 . 2 .]" 1
454 1 36 SER H 1 89 ASN HB3 4.281 . 6.572 4.672 3.777 6.576 0.004 20 0 "[ . 1 . 2 .]" 1
455 1 36 SER HA 1 36 SER HB3 2.349 . 3.039 2.576 2.322 3.046 0.007 25 0 "[ . 1 . 2 .]" 1
456 1 36 SER HA 1 37 LEU H 2.150 . 2.728 2.169 2.087 2.268 . 0 0 "[ . 1 . 2 .]" 1
457 1 36 SER HA 1 37 LEU HB2 5.050 . 8.237 4.568 4.455 4.664 . 0 0 "[ . 1 . 2 .]" 1
458 1 36 SER HA 1 37 LEU HB3 6.024 . 10.560 5.669 5.595 5.745 . 0 0 "[ . 1 . 2 .]" 1
459 1 36 SER HA 1 37 LEU MD1 5.111 . 8.376 5.141 4.872 5.415 . 0 0 "[ . 1 . 2 .]" 1
460 1 36 SER HA 1 37 LEU MD2 4.300 . 6.611 4.654 4.298 4.896 . 0 0 "[ . 1 . 2 .]" 1
461 1 36 SER HB3 1 37 LEU H 3.316 . 4.691 3.933 3.111 4.329 . 0 0 "[ . 1 . 2 .]" 1
462 1 36 SER HB3 1 88 ALA H 4.512 . 7.057 4.387 3.125 5.216 . 0 0 "[ . 1 . 2 .]" 1
463 1 36 SER HB3 1 88 ALA MB 4.166 . 6.336 3.948 1.951 5.292 0.045 16 0 "[ . 1 . 2 .]" 1
464 1 37 LEU H 1 37 LEU HB2 2.308 . 2.974 2.460 2.408 2.558 . 0 0 "[ . 1 . 2 .]" 1
465 1 37 LEU H 1 37 LEU HB3 3.697 . 5.405 3.617 3.575 3.668 . 0 0 "[ . 1 . 2 .]" 1
466 1 37 LEU H 1 37 LEU MD1 3.669 . 5.352 3.748 3.566 3.959 . 0 0 "[ . 1 . 2 .]" 1
467 1 37 LEU H 1 37 LEU MD2 3.304 . 4.668 3.599 3.467 3.799 . 0 0 "[ . 1 . 2 .]" 1
468 1 37 LEU H 1 37 LEU HG 2.608 . 3.458 2.642 2.464 2.897 . 0 0 "[ . 1 . 2 .]" 1
469 1 37 LEU H 1 38 ARG H 4.227 . 6.461 4.412 4.276 4.543 . 0 0 "[ . 1 . 2 .]" 1
470 1 37 LEU HA 1 37 LEU HB3 2.822 . 3.818 2.458 2.407 2.504 . 0 0 "[ . 1 . 2 .]" 1
471 1 37 LEU HA 1 37 LEU MD1 3.797 . 5.599 3.853 3.807 3.891 . 0 0 "[ . 1 . 2 .]" 1
472 1 37 LEU HA 1 37 LEU MD2 2.021 . 2.532 2.097 2.032 2.186 . 0 0 "[ . 1 . 2 .]" 1
473 1 37 LEU HA 1 37 LEU HG 3.273 . 4.612 3.119 3.022 3.268 . 0 0 "[ . 1 . 2 .]" 1
474 1 37 LEU HA 1 38 ARG H 2.135 . 2.705 2.113 2.020 2.294 . 0 0 "[ . 1 . 2 .]" 1
475 1 37 LEU HA 1 85 LEU MD1 3.232 . 4.538 3.308 3.068 3.599 . 0 0 "[ . 1 . 2 .]" 1
476 1 37 LEU HA 1 87 ALA HA 2.546 . 3.356 2.583 2.287 2.782 . 0 0 "[ . 1 . 2 .]" 1
477 1 37 LEU HA 1 87 ALA MB 3.378 2.270 4.486 3.452 3.291 3.627 . 0 0 "[ . 1 . 2 .]" 1
478 1 37 LEU HB2 1 37 LEU MD1 2.461 . 3.218 2.260 2.194 2.311 . 0 0 "[ . 1 . 2 .]" 1
479 1 37 LEU HB2 1 37 LEU MD2 3.106 . 4.312 3.183 3.172 3.190 . 0 0 "[ . 1 . 2 .]" 1
480 1 37 LEU HB2 1 38 ARG H 3.342 . 4.738 4.095 3.679 4.236 . 0 0 "[ . 1 . 2 .]" 1
481 1 37 LEU HB2 1 85 LEU MD1 3.166 . 4.419 3.616 3.364 3.849 . 0 0 "[ . 1 . 2 .]" 1
482 1 37 LEU HB3 1 37 LEU MD1 2.062 . 2.594 2.368 2.283 2.417 . 0 0 "[ . 1 . 2 .]" 1
483 1 37 LEU HB3 1 37 LEU MD2 1.849 . 2.277 2.308 2.286 2.341 0.064 3 0 "[ . 1 . 2 .]" 1
484 1 37 LEU HB3 1 37 LEU HG 2.777 . 3.741 3.017 3.008 3.023 . 0 0 "[ . 1 . 2 .]" 1
485 1 37 LEU HB3 1 38 ARG H 2.520 . 3.314 3.156 2.467 3.379 0.065 5 0 "[ . 1 . 2 .]" 1
486 1 37 LEU HB3 1 56 PHE HZ 3.155 . 4.400 4.389 4.282 4.459 0.059 5 0 "[ . 1 . 2 .]" 1
487 1 37 LEU HB3 1 85 LEU MD1 2.313 . 2.982 2.079 1.854 2.288 . 0 0 "[ . 1 . 2 .]" 1
488 1 37 LEU MD1 1 38 ARG H 4.345 . 6.705 4.940 4.374 5.111 . 0 0 "[ . 1 . 2 .]" 1
489 1 37 LEU MD1 1 56 PHE QD 2.881 . 3.919 3.797 3.318 3.954 0.035 5 0 "[ . 1 . 2 .]" 1
490 1 37 LEU MD1 1 56 PHE QE 3.807 . 5.619 1.983 1.895 2.094 0.100 3 0 "[ . 1 . 2 .]" 1
491 1 37 LEU MD1 1 56 PHE HZ 2.664 . 3.551 2.350 1.996 2.974 . 0 0 "[ . 1 . 2 .]" 1
492 1 37 LEU MD2 1 37 LEU HG 2.003 . 2.324 2.132 2.122 2.144 . 0 0 "[ . 1 . 2 .]" 1
493 1 37 LEU MD2 1 38 ARG H 2.909 . 3.967 3.546 3.275 3.720 . 0 0 "[ . 1 . 2 .]" 1
494 1 37 LEU MD2 1 38 ARG HB3 4.121 . 6.244 5.696 5.387 5.953 . 0 0 "[ . 1 . 2 .]" 1
495 1 37 LEU MD2 1 56 PHE HZ 4.105 2.999 5.211 4.982 4.570 5.235 0.024 1 0 "[ . 1 . 2 .]" 1
496 1 37 LEU MD2 1 66 ARG HE 3.736 . 5.481 5.493 4.853 5.594 0.113 16 0 "[ . 1 . 2 .]" 1
497 1 37 LEU MD2 1 85 LEU MD1 1.924 . 2.387 2.274 2.056 2.409 0.022 23 0 "[ . 1 . 2 .]" 1
498 1 37 LEU MD2 1 85 LEU MD2 2.053 . 2.482 2.380 2.183 2.501 0.019 12 0 "[ . 1 . 2 .]" 1
499 1 37 LEU MD2 1 87 ALA HA 2.256 . 2.892 2.554 2.309 2.779 . 0 0 "[ . 1 . 2 .]" 1
500 1 37 LEU MD2 1 87 ALA MB 2.098 . 2.542 2.030 1.945 2.217 . 0 0 "[ . 1 . 2 .]" 1
501 1 37 LEU HG 1 38 ARG H 4.765 . 7.604 5.053 4.842 5.205 . 0 0 "[ . 1 . 2 .]" 1
502 1 37 LEU HG 1 87 ALA HA 3.335 . 4.725 4.500 4.159 4.735 0.010 3 0 "[ . 1 . 2 .]" 1
503 1 38 ARG H 1 38 ARG HA 2.758 . 3.709 2.918 2.868 2.953 . 0 0 "[ . 1 . 2 .]" 1
504 1 38 ARG H 1 38 ARG HB2 3.075 . 4.257 3.243 3.049 3.444 . 0 0 "[ . 1 . 2 .]" 1
505 1 38 ARG H 1 38 ARG HD3 6.033 . 10.583 5.331 4.779 6.231 . 0 0 "[ . 1 . 2 .]" 1
506 1 38 ARG H 1 38 ARG HG2 4.645 . 7.342 4.762 4.291 5.093 . 0 0 "[ . 1 . 2 .]" 1
507 1 38 ARG H 1 38 ARG HG3 4.601 . 7.247 4.562 4.312 4.803 . 0 0 "[ . 1 . 2 .]" 1
508 1 38 ARG H 1 85 LEU HA 3.507 . 5.044 4.309 4.080 4.501 . 0 0 "[ . 1 . 2 .]" 1
509 1 38 ARG H 1 85 LEU MD1 2.309 . 2.975 2.785 2.527 2.960 . 0 0 "[ . 1 . 2 .]" 1
510 1 38 ARG H 1 86 LEU H 2.806 . 3.790 2.921 2.616 3.061 . 0 0 "[ . 1 . 2 .]" 1
511 1 38 ARG HA 1 38 ARG HB2 2.303 . 2.966 2.425 2.351 2.531 . 0 0 "[ . 1 . 2 .]" 1
512 1 38 ARG HA 1 38 ARG HD3 4.902 . 7.906 3.303 2.151 4.959 . 0 0 "[ . 1 . 2 .]" 1
513 1 38 ARG HA 1 38 ARG HG2 3.624 . 5.266 3.592 2.986 3.886 . 0 0 "[ . 1 . 2 .]" 1
514 1 38 ARG HA 1 38 ARG HG3 3.140 . 4.372 3.096 2.605 3.513 . 0 0 "[ . 1 . 2 .]" 1
515 1 38 ARG HA 1 39 TRP H 2.312 . 2.980 2.158 2.070 2.252 . 0 0 "[ . 1 . 2 .]" 1
516 1 38 ARG HA 1 85 LEU MD1 3.885 . 5.771 4.087 3.797 4.274 . 0 0 "[ . 1 . 2 .]" 1
517 1 38 ARG HB2 1 38 ARG HD3 3.286 . 4.636 3.300 2.443 3.762 . 0 0 "[ . 1 . 2 .]" 1
518 1 38 ARG HB2 1 38 ARG HG3 2.003 . 2.504 2.811 2.382 3.021 0.517 8 12 "[ -****+ ** . * * * *.]" 1
519 1 38 ARG HB3 1 38 ARG HE 2.706 . 3.621 3.358 1.876 4.072 0.451 10 0 "[ . 1 . 2 .]" 1
520 1 38 ARG HB3 1 39 TRP H 3.916 . 5.832 4.183 3.942 4.315 . 0 0 "[ . 1 . 2 .]" 1
521 1 38 ARG HB3 1 86 LEU MD2 2.668 . 3.558 3.281 2.067 3.569 0.011 11 0 "[ . 1 . 2 .]" 1
522 1 38 ARG HD3 1 38 ARG HG3 2.238 . 2.864 2.391 2.255 2.497 . 0 0 "[ . 1 . 2 .]" 1
523 1 38 ARG HD3 1 39 TRP H 3.756 . 5.520 3.254 1.718 5.447 0.274 16 0 "[ . 1 . 2 .]" 1
524 1 38 ARG HD3 1 40 LEU QD 3.819 2.961 4.677 4.601 3.186 5.399 0.722 19 4 "[ *. * 1 . +- .]" 1
525 1 38 ARG HD3 1 86 LEU MD2 3.613 . 5.244 4.709 3.898 5.262 0.018 19 0 "[ . 1 . 2 .]" 1
526 1 38 ARG HE 1 38 ARG HG2 4.176 . 6.356 2.866 2.390 3.872 . 0 0 "[ . 1 . 2 .]" 1
527 1 38 ARG HE 1 38 ARG HG3 3.656 . 5.326 2.802 2.147 3.140 . 0 0 "[ . 1 . 2 .]" 1
528 1 38 ARG HE 1 38 ARG HG3 3.901 . 5.803 3.381 2.289 3.690 . 0 0 "[ . 1 . 2 .]" 1
529 1 38 ARG QG 1 40 LEU QD 3.162 . 4.411 3.141 2.633 3.516 . 0 0 "[ . 1 . 2 .]" 1
530 1 38 ARG HG2 1 40 LEU QD 2.965 . 4.064 4.176 3.395 4.677 0.613 11 8 "[- *.** 1+ .* 2 ** .]" 1
531 1 38 ARG HG3 1 39 TRP H 3.246 . 4.563 3.211 2.588 3.563 . 0 0 "[ . 1 . 2 .]" 1
532 1 38 ARG HG3 1 40 LEU QD 3.485 . 5.004 4.096 2.783 4.913 . 0 0 "[ . 1 . 2 .]" 1
533 1 39 TRP H 1 39 TRP HB3 3.209 . 4.496 3.625 3.584 3.663 . 0 0 "[ . 1 . 2 .]" 1
534 1 39 TRP H 1 39 TRP HD1 2.953 . 4.043 2.901 2.597 3.160 . 0 0 "[ . 1 . 2 .]" 1
535 1 39 TRP H 1 39 TRP HE3 4.630 . 7.310 5.331 5.212 5.465 . 0 0 "[ . 1 . 2 .]" 1
536 1 39 TRP H 1 40 LEU H 4.845 . 7.780 4.363 4.238 4.499 . 0 0 "[ . 1 . 2 .]" 1
537 1 39 TRP H 1 46 LEU MD2 3.840 . 5.684 4.579 3.968 5.048 . 0 0 "[ . 1 . 2 .]" 1
538 1 39 TRP HA 1 40 LEU H 2.519 . 3.312 2.110 2.071 2.266 . 0 0 "[ . 1 . 2 .]" 1
539 1 39 TRP HA 1 46 LEU MD2 3.821 . 5.646 4.440 4.227 4.717 . 0 0 "[ . 1 . 2 .]" 1
540 1 39 TRP HA 1 85 LEU MD1 3.182 . 4.448 3.141 3.011 3.372 . 0 0 "[ . 1 . 2 .]" 1
541 1 39 TRP HA 1 86 LEU H 3.644 . 5.303 3.427 3.246 3.653 . 0 0 "[ . 1 . 2 .]" 1
542 1 39 TRP HB2 1 46 LEU HB2 4.417 . 6.856 3.755 3.079 4.359 . 0 0 "[ . 1 . 2 .]" 1
543 1 39 TRP HB2 1 46 LEU HB3 3.810 . 5.625 2.229 1.951 2.663 0.044 11 0 "[ . 1 . 2 .]" 1
544 1 39 TRP HB2 1 46 LEU HG 3.927 . 5.855 3.652 3.200 3.950 . 0 0 "[ . 1 . 2 .]" 1
545 1 39 TRP HB2 1 70 LEU MD2 3.155 . 4.400 4.307 3.955 4.650 0.250 10 0 "[ . 1 . 2 .]" 1
546 1 39 TRP HB2 1 85 LEU MD1 4.008 . 6.016 4.724 4.551 4.939 . 0 0 "[ . 1 . 2 .]" 1
547 1 39 TRP HB3 1 39 TRP HD1 2.852 . 3.869 3.767 3.716 3.808 . 0 0 "[ . 1 . 2 .]" 1
548 1 39 TRP HB3 1 39 TRP HZ3 5.958 . 10.395 4.998 4.931 5.081 . 0 0 "[ . 1 . 2 .]" 1
549 1 39 TRP HB3 1 40 LEU H 4.076 . 6.152 3.184 2.531 3.500 . 0 0 "[ . 1 . 2 .]" 1
550 1 39 TRP HB3 1 46 LEU HB2 4.030 . 6.060 3.657 3.177 4.126 . 0 0 "[ . 1 . 2 .]" 1
551 1 39 TRP HB3 1 46 LEU MD1 3.345 . 4.743 4.675 4.350 4.964 0.221 18 0 "[ . 1 . 2 .]" 1
552 1 39 TRP HB3 1 46 LEU MD2 2.334 . 3.015 2.331 2.031 2.678 . 0 0 "[ . 1 . 2 .]" 1
553 1 39 TRP HD1 1 46 LEU MD2 3.752 . 5.512 3.780 2.909 4.394 . 0 0 "[ . 1 . 2 .]" 1
554 1 39 TRP HD1 1 54 THR MG 4.727 . 7.520 4.166 3.587 4.792 . 0 0 "[ . 1 . 2 .]" 1
555 1 39 TRP HD1 1 70 LEU MD1 3.138 . 4.369 3.491 3.283 3.924 . 0 0 "[ . 1 . 2 .]" 1
556 1 39 TRP HE1 1 54 THR HB 4.433 . 6.890 3.633 3.456 3.964 . 0 0 "[ . 1 . 2 .]" 1
557 1 39 TRP HE1 1 54 THR MG 3.105 . 4.310 2.278 1.951 2.806 . 0 0 "[ . 1 . 2 .]" 1
558 1 39 TRP HE3 1 40 LEU H 3.647 . 5.310 3.685 3.147 4.000 . 0 0 "[ . 1 . 2 .]" 1
559 1 39 TRP HE3 1 46 LEU MD2 4.167 . 6.338 3.952 3.332 4.273 . 0 0 "[ . 1 . 2 .]" 1
560 1 39 TRP HH2 1 70 LEU MD1 3.863 2.364 5.362 4.716 4.484 5.053 . 0 0 "[ . 1 . 2 .]" 1
561 1 39 TRP HH2 1 70 LEU MD2 3.041 . 4.197 3.707 3.343 4.017 . 0 0 "[ . 1 . 2 .]" 1
562 1 39 TRP HH2 1 83 TYR HB2 5.329 . 8.879 5.850 5.338 6.688 . 0 0 "[ . 1 . 2 .]" 1
563 1 39 TRP HH2 1 83 TYR HB3 4.778 . 7.631 5.103 4.735 5.629 . 0 0 "[ . 1 . 2 .]" 1
564 1 39 TRP HH2 1 85 LEU MD1 2.865 . 3.891 3.682 3.409 3.905 0.014 23 0 "[ . 1 . 2 .]" 1
565 1 39 TRP HH2 1 85 LEU MD2 2.794 . 3.769 3.009 2.790 3.250 . 0 0 "[ . 1 . 2 .]" 1
566 1 40 LEU H 1 40 LEU HB2 3.113 . 4.324 2.786 2.619 2.961 . 0 0 "[ . 1 . 2 .]" 1
567 1 40 LEU H 1 40 LEU HB3 3.268 . 4.603 2.725 2.554 3.730 . 0 0 "[ . 1 . 2 .]" 1
568 1 40 LEU H 1 40 LEU QD 3.764 . 5.535 3.795 3.469 3.891 . 0 0 "[ . 1 . 2 .]" 1
569 1 40 LEU H 1 40 LEU HG 3.964 . 5.929 4.422 3.063 4.622 . 0 0 "[ . 1 . 2 .]" 1
570 1 40 LEU H 1 83 TYR QD 4.924 . 7.954 5.287 3.734 6.110 . 0 0 "[ . 1 . 2 .]" 1
571 1 40 LEU H 1 84 THR H 3.021 . 4.162 2.964 2.586 3.288 . 0 0 "[ . 1 . 2 .]" 1
572 1 40 LEU H 1 84 THR HB 3.688 . 5.388 3.206 2.829 3.528 . 0 0 "[ . 1 . 2 .]" 1
573 1 40 LEU HA 1 40 LEU QD 2.074 . 2.612 2.093 2.008 2.189 . 0 0 "[ . 1 . 2 .]" 1
574 1 40 LEU HA 1 44 SER H 4.218 . 6.442 4.783 4.445 5.031 . 0 0 "[ . 1 . 2 .]" 1
575 1 40 LEU HA 1 45 VAL HA 3.317 2.271 4.363 2.759 2.367 3.151 . 0 0 "[ . 1 . 2 .]" 1
576 1 40 LEU HA 1 46 LEU H 2.982 . 4.093 2.650 2.213 2.909 . 0 0 "[ . 1 . 2 .]" 1
577 1 40 LEU HA 1 46 LEU HB2 3.992 2.983 5.001 3.815 3.214 4.349 . 0 0 "[ . 1 . 2 .]" 1
578 1 40 LEU HB2 1 40 LEU QD 1.796 . 2.199 2.077 2.049 2.271 0.072 18 0 "[ . 1 . 2 .]" 1
579 1 40 LEU HB2 1 44 SER H 4.131 . 6.264 6.071 5.158 6.297 0.033 23 0 "[ . 1 . 2 .]" 1
580 1 40 LEU HB2 1 84 THR H 3.740 . 5.489 4.665 3.589 5.167 . 0 0 "[ . 1 . 2 .]" 1
581 1 40 LEU HB2 1 84 THR HB 3.372 . 5.057 3.353 2.187 3.970 . 0 0 "[ . 1 . 2 .]" 1
582 1 40 LEU HB3 1 40 LEU QD 2.913 . 3.974 2.192 2.050 2.223 . 0 0 "[ . 1 . 2 .]" 1
583 1 40 LEU HB3 1 40 LEU HG 2.778 . 3.743 2.577 2.515 3.009 . 0 0 "[ . 1 . 2 .]" 1
584 1 40 LEU HB3 1 44 SER H 4.021 . 6.042 5.529 3.589 6.001 . 0 0 "[ . 1 . 2 .]" 1
585 1 40 LEU HB3 1 84 THR HB 3.058 . 4.227 2.130 1.868 3.836 0.021 8 0 "[ . 1 . 2 .]" 1
586 1 40 LEU HB3 1 86 LEU MD1 3.562 2.064 5.060 4.513 4.067 5.936 0.876 18 1 "[ . 1 . + 2 .]" 1
587 1 40 LEU QD 1 40 LEU HG 1.715 . 2.083 1.889 1.885 1.895 . 0 0 "[ . 1 . 2 .]" 1
588 1 40 LEU QD 1 41 PHE H 3.168 2.386 4.422 2.973 2.656 3.348 . 0 0 "[ . 1 . 2 .]" 1
589 1 40 LEU QD 1 41 PHE HB2 4.892 . 7.883 5.360 5.143 5.585 . 0 0 "[ . 1 . 2 .]" 1
590 1 40 LEU QD 1 41 PHE HB3 5.210 . 8.602 4.932 4.667 5.266 . 0 0 "[ . 1 . 2 .]" 1
591 1 40 LEU QD 1 41 PHE QD 6.209 . 11.028 5.713 5.529 6.012 . 0 0 "[ . 1 . 2 .]" 1
592 1 40 LEU QD 1 43 GLY HA2 3.638 2.559 4.717 2.358 2.052 2.669 0.507 3 2 "[- + . 1 . 2 .]" 1
593 1 40 LEU QD 1 43 GLY HA3 4.197 . 6.399 3.675 3.404 3.915 . 0 0 "[ . 1 . 2 .]" 1
594 1 40 LEU QD 1 44 SER H 4.024 2.943 5.105 3.528 3.278 3.858 . 0 0 "[ . 1 . 2 .]" 1
595 1 40 LEU QD 1 44 SER HA 3.803 . 5.611 3.395 3.166 3.608 . 0 0 "[ . 1 . 2 .]" 1
596 1 40 LEU QD 1 45 VAL H 3.306 2.022 4.590 3.386 3.042 3.687 . 0 0 "[ . 1 . 2 .]" 1
597 1 40 LEU QD 1 45 VAL HA 2.248 . 2.773 2.173 1.844 2.470 . 0 0 "[ . 1 . 2 .]" 1
598 1 40 LEU QD 1 45 VAL HB 3.592 2.473 4.711 4.280 2.941 4.667 . 0 0 "[ . 1 . 2 .]" 1
599 1 40 LEU QD 1 46 LEU H 3.006 2.378 3.829 3.423 2.887 3.838 0.009 2 0 "[ . 1 . 2 .]" 1
600 1 40 LEU QD 1 84 THR HB . . 3.746 3.056 2.536 3.467 . 0 0 "[ . 1 . 2 .]" 1
601 1 40 LEU HG 1 83 TYR HA 4.608 . 7.262 6.229 5.690 7.254 . 0 0 "[ . 1 . 2 .]" 1
602 1 41 PHE H 1 41 PHE HA 2.405 . 3.128 2.925 2.910 2.938 . 0 0 "[ . 1 . 2 .]" 1
603 1 41 PHE H 1 41 PHE HB2 3.215 . 4.507 3.101 2.914 3.225 . 0 0 "[ . 1 . 2 .]" 1
604 1 41 PHE H 1 41 PHE HB3 2.553 . 3.368 2.535 2.434 2.684 . 0 0 "[ . 1 . 2 .]" 1
605 1 41 PHE H 1 41 PHE QD 4.589 . 7.222 4.215 4.148 4.277 . 0 0 "[ . 1 . 2 .]" 1
606 1 41 PHE H 1 44 SER H 2.887 . 3.874 3.217 2.929 3.429 . 0 0 "[ . 1 . 2 .]" 1
607 1 41 PHE H 1 45 VAL HA 3.324 2.528 4.120 3.577 3.271 4.043 . 0 0 "[ . 1 . 2 .]" 1
608 1 41 PHE H 1 46 LEU H 4.095 2.999 5.191 3.336 3.075 3.722 . 0 0 "[ . 1 . 2 .]" 1
609 1 41 PHE HA 1 41 PHE QD 4.658 . 7.370 2.614 2.253 2.847 . 0 0 "[ . 1 . 2 .]" 1
610 1 41 PHE HA 1 41 PHE QE 5.280 . 8.765 4.608 4.480 4.712 . 0 0 "[ . 1 . 2 .]" 1
611 1 41 PHE HA 1 42 ASN H 2.692 . 3.598 2.108 2.058 2.154 . 0 0 "[ . 1 . 2 .]" 1
612 1 41 PHE HA 1 46 LEU MD1 3.923 . 5.847 5.037 4.573 5.425 . 0 0 "[ . 1 . 2 .]" 1
613 1 41 PHE HA 1 84 THR H 3.649 . 5.314 3.404 3.068 3.886 . 0 0 "[ . 1 . 2 .]" 1
614 1 41 PHE HB2 1 41 PHE QD 3.701 . 5.413 2.524 2.414 2.681 . 0 0 "[ . 1 . 2 .]" 1
615 1 41 PHE HB2 1 41 PHE QE 4.703 . 7.467 4.429 4.383 4.461 . 0 0 "[ . 1 . 2 .]" 1
616 1 41 PHE HB2 1 46 LEU MD1 2.534 . 3.336 2.908 2.422 3.301 . 0 0 "[ . 1 . 2 .]" 1
617 1 41 PHE HB2 1 46 LEU MD2 3.314 . 4.687 2.752 2.050 3.688 . 0 0 "[ . 1 . 2 .]" 1
618 1 41 PHE HB3 1 41 PHE QD 3.100 . 4.301 2.295 2.256 2.358 . 0 0 "[ . 1 . 2 .]" 1
619 1 41 PHE HB3 1 41 PHE QE 4.805 . 7.691 4.373 4.351 4.397 . 0 0 "[ . 1 . 2 .]" 1
620 1 41 PHE HB3 1 42 ASN H 4.476 . 6.981 4.415 4.309 4.492 . 0 0 "[ . 1 . 2 .]" 1
621 1 41 PHE HB3 1 42 ASN H 4.092 . 6.185 3.673 3.412 3.795 . 0 0 "[ . 1 . 2 .]" 1
622 1 41 PHE HB3 1 46 LEU MD1 2.477 . 3.244 3.098 2.714 3.370 0.126 16 0 "[ . 1 . 2 .]" 1
623 1 41 PHE HB3 1 46 LEU MD2 2.990 . 4.107 3.925 3.267 4.592 0.485 16 0 "[ . 1 . 2 .]" 1
624 1 41 PHE QD 1 42 ASN H 3.844 . 5.691 3.764 3.257 4.056 . 0 0 "[ . 1 . 2 .]" 1
625 1 41 PHE QD 1 46 LEU MD1 3.839 . 5.682 3.585 2.688 4.153 . 0 0 "[ . 1 . 2 .]" 1
626 1 41 PHE QE 1 42 ASN H 4.313 . 6.639 5.044 4.672 5.305 . 0 0 "[ . 1 . 2 .]" 1
627 1 41 PHE QE 1 46 LEU MD1 4.221 2.396 6.046 4.721 4.010 5.437 . 0 0 "[ . 1 . 2 .]" 1
628 1 41 PHE QE 1 81 GLY H 4.221 2.193 6.249 2.913 2.162 4.024 0.031 18 0 "[ . 1 . 2 .]" 1
629 1 41 PHE QE 1 82 ASN H 4.252 . 6.512 3.715 3.064 4.727 . 0 0 "[ . 1 . 2 .]" 1
630 1 42 ASN H 1 42 ASN HA 2.748 . 3.692 2.266 2.234 2.297 . 0 0 "[ . 1 . 2 .]" 1
631 1 42 ASN H 1 42 ASN HB2 3.298 . 4.658 3.374 2.971 3.622 . 0 0 "[ . 1 . 2 .]" 1
632 1 42 ASN H 1 42 ASN HD21 4.463 . 6.953 4.889 3.988 5.550 . 0 0 "[ . 1 . 2 .]" 1
633 1 42 ASN H 1 43 GLY H 4.270 . 6.550 2.724 2.517 2.946 . 0 0 "[ . 1 . 2 .]" 1
634 1 42 ASN H 1 82 ASN H 3.450 . 4.938 3.710 3.417 4.635 . 0 0 "[ . 1 . 2 .]" 1
635 1 42 ASN H 1 82 ASN HB3 3.278 2.243 4.313 3.663 2.951 4.891 0.578 14 1 "[ . 1 +. 2 .]" 1
636 1 42 ASN H 1 83 TYR HD1 5.641 . 9.618 4.954 4.523 5.735 . 0 0 "[ . 1 . 2 .]" 1
637 1 42 ASN HA 1 42 ASN HB3 2.765 . 3.720 2.696 2.493 3.051 . 0 0 "[ . 1 . 2 .]" 1
638 1 42 ASN HA 1 42 ASN HD21 5.111 . 8.376 3.796 1.887 4.490 . 0 0 "[ . 1 . 2 .]" 1
639 1 42 ASN HA 1 42 ASN HD22 4.897 . 7.894 4.354 3.479 4.768 . 0 0 "[ . 1 . 2 .]" 1
640 1 42 ASN HA 1 82 ASN H 4.412 . 6.845 3.901 3.130 4.924 . 0 0 "[ . 1 . 2 .]" 1
641 1 42 ASN HA 1 82 ASN HB2 4.350 . 6.716 3.826 2.375 5.803 . 0 0 "[ . 1 . 2 .]" 1
642 1 42 ASN HA 1 82 ASN HB3 3.232 . 4.538 3.739 2.616 5.205 0.667 14 3 "[ . 1*- +. 2 .]" 1
643 1 42 ASN HB2 1 42 ASN HD21 2.713 . 3.633 2.628 2.163 3.476 . 0 0 "[ . 1 . 2 .]" 1
644 1 42 ASN HB2 1 42 ASN HD22 3.818 . 5.640 3.648 3.434 4.046 . 0 0 "[ . 1 . 2 .]" 1
645 1 42 ASN HD22 1 81 GLY HA2 4.008 . 6.016 4.330 2.967 6.696 0.680 23 1 "[ . 1 . 2 + .]" 1
646 1 42 ASN HD22 1 82 ASN H 3.840 2.274 5.406 3.872 2.645 5.915 0.509 23 1 "[ . 1 . 2 + .]" 1
647 1 43 GLY H 1 44 SER H 3.387 . 5.374 2.609 2.388 2.852 . 0 0 "[ . 1 . 2 .]" 1
648 1 43 GLY H 1 44 SER HA 4.769 . 7.611 5.135 4.917 5.374 . 0 0 "[ . 1 . 2 .]" 1
649 1 43 GLY HA2 1 44 SER H 3.366 2.410 4.322 3.354 3.209 3.446 . 0 0 "[ . 1 . 2 .]" 1
650 1 43 GLY HA3 1 44 SER H 3.540 2.474 4.606 3.182 3.082 3.353 . 0 0 "[ . 1 . 2 .]" 1
651 1 44 SER H 1 44 SER HA 2.880 . 3.917 2.949 2.907 2.976 . 0 0 "[ . 1 . 2 .]" 1
652 1 44 SER H 1 44 SER HB2 2.489 . 3.264 2.796 2.441 3.711 0.447 22 0 "[ . 1 . 2 .]" 1
653 1 44 SER H 1 44 SER HB3 3.148 . 4.387 3.109 2.465 3.702 . 0 0 "[ . 1 . 2 .]" 1
654 1 44 SER HA 1 44 SER HB3 2.709 . 3.626 2.664 2.373 3.044 . 0 0 "[ . 1 . 2 .]" 1
655 1 44 SER HA 1 45 VAL H 2.453 . 3.205 2.159 2.062 2.277 . 0 0 "[ . 1 . 2 .]" 1
656 1 44 SER HA 1 45 VAL HB 4.654 . 7.361 4.557 4.303 4.678 . 0 0 "[ . 1 . 2 .]" 1
657 1 44 SER HB2 1 45 VAL H 3.373 . 4.796 3.795 2.633 4.130 . 0 0 "[ . 1 . 2 .]" 1
658 1 44 SER HB3 1 45 VAL H 3.039 . 4.193 3.454 2.744 3.964 . 0 0 "[ . 1 . 2 .]" 1
659 1 45 VAL H 1 45 VAL HA 2.373 . 3.077 2.835 2.790 2.874 . 0 0 "[ . 1 . 2 .]" 1
660 1 45 VAL H 1 45 VAL HB 2.400 . 3.120 2.433 2.286 2.513 . 0 0 "[ . 1 . 2 .]" 1
661 1 45 VAL HA 1 45 VAL HB 2.681 . 3.580 3.015 2.554 3.043 . 0 0 "[ . 1 . 2 .]" 1
662 1 45 VAL HA 1 46 LEU H 2.324 . 2.999 2.122 2.076 2.173 . 0 0 "[ . 1 . 2 .]" 1
663 1 45 VAL HB 1 46 LEU H 3.171 . 4.428 4.324 4.159 4.465 0.037 24 0 "[ . 1 . 2 .]" 1
664 1 45 VAL HB 1 46 LEU HA 3.405 . 4.854 3.962 3.606 4.256 . 0 0 "[ . 1 . 2 .]" 1
665 1 46 LEU H 1 46 LEU HB2 2.736 . 3.671 2.691 2.602 2.820 . 0 0 "[ . 1 . 2 .]" 1
666 1 46 LEU H 1 46 LEU HB3 3.519 . 5.067 2.445 2.399 2.558 . 0 0 "[ . 1 . 2 .]" 1
667 1 46 LEU H 1 46 LEU MD1 3.247 . 4.564 4.205 4.148 4.267 . 0 0 "[ . 1 . 2 .]" 1
668 1 46 LEU H 1 46 LEU MD2 4.382 . 6.782 4.283 4.223 4.388 . 0 0 "[ . 1 . 2 .]" 1
669 1 46 LEU HA 1 46 LEU MD1 2.163 . 2.748 2.138 2.092 2.186 . 0 0 "[ . 1 . 2 .]" 1
670 1 46 LEU HA 1 46 LEU MD2 4.000 . 6.000 3.902 3.878 3.920 . 0 0 "[ . 1 . 2 .]" 1
671 1 46 LEU HA 1 46 LEU HG 2.984 . 4.097 3.095 2.937 3.241 . 0 0 "[ . 1 . 2 .]" 1
672 1 46 LEU HA 1 47 ASN H 2.320 . 2.993 2.125 2.060 2.215 . 0 0 "[ . 1 . 2 .]" 1
673 1 46 LEU HA 1 47 ASN HB2 5.144 . 8.452 4.740 4.368 5.723 . 0 0 "[ . 1 . 2 .]" 1
674 1 46 LEU HA 1 47 ASN HB3 4.802 . 7.684 5.016 4.407 5.733 . 0 0 "[ . 1 . 2 .]" 1
675 1 46 LEU HB2 1 46 LEU MD1 2.127 . 2.692 2.353 2.314 2.423 . 0 0 "[ . 1 . 2 .]" 1
676 1 46 LEU HB2 1 46 LEU MD2 2.432 . 3.171 2.420 2.377 2.485 . 0 0 "[ . 1 . 2 .]" 1
677 1 46 LEU HB2 1 47 ASN H 4.093 . 6.188 4.328 4.147 4.475 . 0 0 "[ . 1 . 2 .]" 1
678 1 46 LEU HB3 1 46 LEU MD1 2.887 . 3.929 3.204 3.192 3.223 . 0 0 "[ . 1 . 2 .]" 1
679 1 46 LEU HB3 1 46 LEU MD2 2.342 . 3.027 2.302 2.250 2.374 . 0 0 "[ . 1 . 2 .]" 1
680 1 46 LEU HB3 1 46 LEU HG 2.705 . 3.620 2.496 2.466 2.537 . 0 0 "[ . 1 . 2 .]" 1
681 1 46 LEU MD1 1 47 ASN H 3.198 . 4.476 2.772 2.288 3.224 . 0 0 "[ . 1 . 2 .]" 1
682 1 46 LEU MD1 1 47 ASN HA 4.322 . 6.657 4.757 4.370 4.931 . 0 0 "[ . 1 . 2 .]" 1
683 1 46 LEU MD2 1 70 LEU MD1 3.038 2.419 3.657 2.972 2.401 3.551 0.018 12 0 "[ . 1 . 2 .]" 1
684 1 46 LEU MD2 1 83 TYR QD 3.585 2.236 4.934 2.580 2.177 3.031 0.059 24 0 "[ . 1 . 2 .]" 1
685 1 46 LEU MD2 1 83 TYR QE 3.359 2.321 4.397 2.393 2.234 2.752 0.087 14 0 "[ . 1 . 2 .]" 1
686 1 46 LEU HG 1 47 ASN H 3.395 . 4.836 3.386 2.839 3.938 . 0 0 "[ . 1 . 2 .]" 1
687 1 46 LEU HG 1 48 GLU QG 3.367 . 4.784 4.280 3.616 4.720 . 0 0 "[ . 1 . 2 .]" 1
688 1 47 ASN H 1 47 ASN HB2 3.345 . 4.744 2.801 2.420 3.764 . 0 0 "[ . 1 . 2 .]" 1
689 1 47 ASN H 1 47 ASN HB3 2.734 . 3.668 3.016 2.338 3.680 0.012 1 0 "[ . 1 . 2 .]" 1
690 1 47 ASN H 1 47 ASN HD22 5.331 . 8.884 4.997 3.253 5.952 . 0 0 "[ . 1 . 2 .]" 1
691 1 47 ASN HA 1 47 ASN HB2 2.987 . 4.102 2.694 2.380 3.047 . 0 0 "[ . 1 . 2 .]" 1
692 1 47 ASN HA 1 47 ASN HD21 2.993 . 4.113 3.234 1.868 4.121 0.008 11 0 "[ . 1 . 2 .]" 1
693 1 47 ASN HA 1 47 ASN HD22 3.894 . 5.789 4.176 3.467 5.169 . 0 0 "[ . 1 . 2 .]" 1
694 1 47 ASN HA 1 48 GLU H 2.272 . 2.917 2.182 2.104 2.248 . 0 0 "[ . 1 . 2 .]" 1
695 1 47 ASN HB2 1 47 ASN HD21 4.019 . 6.038 2.900 2.206 3.510 . 0 0 "[ . 1 . 2 .]" 1
696 1 47 ASN HB3 1 47 ASN HD21 2.708 . 3.625 2.813 2.201 3.538 . 0 0 "[ . 1 . 2 .]" 1
697 1 47 ASN HB3 1 47 ASN HD22 4.015 . 6.030 3.746 3.467 4.078 . 0 0 "[ . 1 . 2 .]" 1
698 1 48 GLU H 1 48 GLU HA 2.960 . 4.055 2.813 2.730 2.883 . 0 0 "[ . 1 . 2 .]" 1
699 1 48 GLU H 1 48 GLU HB2 2.521 . 3.315 2.640 2.402 3.587 0.272 4 0 "[ . 1 . 2 .]" 1
700 1 48 GLU H 1 48 GLU QG . . 3.010 2.402 1.862 2.839 0.096 11 0 "[ . 1 . 2 .]" 1
701 1 48 GLU H 1 49 THR H 5.512 . 9.310 4.438 3.915 4.616 . 0 0 "[ . 1 . 2 .]" 1
702 1 48 GLU HA 1 48 GLU QG 3.513 . 4.071 2.604 2.405 3.363 . 0 0 "[ . 1 . 2 .]" 1
703 1 48 GLU HA 1 49 THR H 2.421 . 3.154 2.150 2.052 2.293 . 0 0 "[ . 1 . 2 .]" 1
704 1 48 GLU HA 1 49 THR MG 3.314 . 4.687 3.630 3.217 3.965 . 0 0 "[ . 1 . 2 .]" 1
705 1 48 GLU HA 1 52 ILE H 4.630 . 7.309 4.774 4.395 5.336 . 0 0 "[ . 1 . 2 .]" 1
706 1 48 GLU HA 1 52 ILE MD 3.815 . 5.634 4.835 4.155 5.591 . 0 0 "[ . 1 . 2 .]" 1
707 1 48 GLU HB2 1 49 THR H 4.065 . 6.130 4.002 2.851 4.370 . 0 0 "[ . 1 . 2 .]" 1
708 1 48 GLU HB2 1 49 THR MG 4.375 . 6.768 5.261 4.624 5.798 . 0 0 "[ . 1 . 2 .]" 1
709 1 48 GLU HB2 1 53 PHE HB3 5.230 . 8.649 5.431 3.894 7.610 . 0 0 "[ . 1 . 2 .]" 1
710 1 48 GLU HB2 1 54 THR H 5.222 . 8.630 4.558 3.110 5.366 . 0 0 "[ . 1 . 2 .]" 1
711 1 48 GLU HB3 1 48 GLU QG 3.083 . 4.271 2.267 2.143 2.441 . 0 0 "[ . 1 . 2 .]" 1
712 1 48 GLU HB3 1 49 THR H 2.998 . 4.121 3.320 2.587 4.048 . 0 0 "[ . 1 . 2 .]" 1
713 1 48 GLU HB3 1 49 THR MG 4.326 . 6.665 5.141 4.548 5.503 . 0 0 "[ . 1 . 2 .]" 1
714 1 48 GLU HB3 1 53 PHE HB2 3.888 2.618 5.158 4.082 3.059 5.783 0.625 4 1 "[ +. 1 . 2 .]" 1
715 1 48 GLU QG 1 49 THR H 5.553 . 9.407 4.250 3.715 4.675 . 0 0 "[ . 1 . 2 .]" 1
716 1 48 GLU QG 1 53 PHE HA 4.604 . 4.709 3.351 2.369 4.331 . 0 0 "[ . 1 . 2 .]" 1
717 1 48 GLU QG 1 54 THR HB 4.511 2.967 7.055 3.890 2.551 4.824 0.416 5 0 "[ . 1 . 2 .]" 1
718 1 49 THR H 1 49 THR MG 2.787 . 3.758 2.630 1.932 3.100 . 0 0 "[ . 1 . 2 .]" 1
719 1 49 THR H 1 51 PHE QD 5.792 . 9.986 6.025 5.243 6.943 . 0 0 "[ . 1 . 2 .]" 1
720 1 49 THR H 1 52 ILE H 2.981 . 4.092 3.078 2.810 3.538 . 0 0 "[ . 1 . 2 .]" 1
721 1 49 THR H 1 52 ILE HB 3.019 . 4.158 2.880 2.262 3.407 . 0 0 "[ . 1 . 2 .]" 1
722 1 49 THR H 1 53 PHE HB2 5.134 . 8.429 5.125 3.728 6.518 . 0 0 "[ . 1 . 2 .]" 1
723 1 49 THR HA 1 50 SER H 2.916 . 3.979 2.169 1.837 2.722 0.016 9 0 "[ . 1 . 2 .]" 1
724 1 49 THR HA 1 49 THR MG 2.451 . 3.202 2.656 2.281 3.237 0.035 7 0 "[ . 1 . 2 .]" 1
725 1 49 THR HB 1 49 THR MG 2.196 . 2.799 2.139 2.126 2.150 . 0 0 "[ . 1 . 2 .]" 1
726 1 49 THR MG 1 50 SER H 5.222 . 8.631 3.285 2.584 3.612 . 0 0 "[ . 1 . 2 .]" 1
727 1 49 THR MG 1 51 PHE H 4.342 . 6.698 3.275 1.940 4.232 0.046 7 0 "[ . 1 . 2 .]" 1
728 1 49 THR MG 1 51 PHE QD 4.861 . 7.814 3.607 2.079 5.205 . 0 0 "[ . 1 . 2 .]" 1
729 1 49 THR MG 1 52 ILE H 4.437 . 6.898 3.338 1.962 4.144 0.014 17 0 "[ . 1 . 2 .]" 1
730 1 49 THR MG 1 52 ILE HB 3.778 . 5.563 3.345 2.094 4.234 . 0 0 "[ . 1 . 2 .]" 1
731 1 49 THR MG 1 52 ILE MD 2.964 . 4.062 3.454 2.220 4.096 0.034 4 0 "[ . 1 . 2 .]" 1
732 1 50 SER HA 1 50 SER HB2 2.830 . 3.831 2.827 2.428 3.028 . 0 0 "[ . 1 . 2 .]" 1
733 1 50 SER HA 1 50 SER HB3 2.938 . 4.017 2.631 2.355 3.040 . 0 0 "[ . 1 . 2 .]" 1
734 1 50 SER HA 1 51 PHE H 3.292 . 4.646 3.428 3.195 3.584 . 0 0 "[ . 1 . 2 .]" 1
735 1 50 SER HB2 1 51 PHE H 4.590 . 7.224 3.428 2.401 4.374 . 0 0 "[ . 1 . 2 .]" 1
736 1 50 SER HB3 1 51 PHE H 4.069 . 6.139 3.718 2.597 4.321 . 0 0 "[ . 1 . 2 .]" 1
737 1 51 PHE H 1 51 PHE HA 2.796 . 3.773 2.914 2.882 2.955 . 0 0 "[ . 1 . 2 .]" 1
738 1 51 PHE H 1 51 PHE HB2 3.922 . 5.845 2.529 2.415 2.639 . 0 0 "[ . 1 . 2 .]" 1
739 1 51 PHE H 1 51 PHE HB3 2.924 . 3.993 3.673 3.608 3.769 . 0 0 "[ . 1 . 2 .]" 1
740 1 51 PHE H 1 51 PHE QD 3.456 . 4.949 2.798 2.176 3.442 . 0 0 "[ . 1 . 2 .]" 1
741 1 51 PHE H 1 52 ILE H 2.090 . 2.636 2.249 1.953 2.493 . 0 0 "[ . 1 . 2 .]" 1
742 1 51 PHE H 1 53 PHE QD 4.360 . 6.736 4.787 3.713 6.781 0.045 23 0 "[ . 1 . 2 .]" 1
743 1 51 PHE HA 1 52 ILE H 3.417 . 4.877 3.481 3.178 3.552 . 0 0 "[ . 1 . 2 .]" 1
744 1 51 PHE HB2 1 51 PHE QD 3.685 . 5.383 2.326 2.257 2.493 . 0 0 "[ . 1 . 2 .]" 1
745 1 51 PHE HB2 1 52 ILE H 4.152 . 6.306 2.850 2.550 3.800 . 0 0 "[ . 1 . 2 .]" 1
746 1 51 PHE HB2 1 52 ILE MD 4.492 . 7.014 3.978 3.549 4.664 . 0 0 "[ . 1 . 2 .]" 1
747 1 51 PHE HB3 1 51 PHE QD 3.461 . 4.958 2.501 2.314 2.765 . 0 0 "[ . 1 . 2 .]" 1
748 1 51 PHE HB3 1 52 ILE H 3.603 . 5.225 3.845 3.563 4.405 . 0 0 "[ . 1 . 2 .]" 1
749 1 52 ILE H 1 52 ILE HA 2.796 . 3.773 2.949 2.900 2.969 . 0 0 "[ . 1 . 2 .]" 1
750 1 52 ILE H 1 52 ILE HB 2.742 . 3.681 2.690 2.578 2.848 . 0 0 "[ . 1 . 2 .]" 1
751 1 52 ILE H 1 52 ILE MD 3.553 . 5.131 3.949 3.729 4.368 . 0 0 "[ . 1 . 2 .]" 1
752 1 52 ILE H 1 53 PHE QD 4.039 2.384 5.694 4.141 2.897 5.717 0.023 16 0 "[ . 1 . 2 .]" 1
753 1 52 ILE HA 1 52 ILE MD 3.678 . 5.369 3.919 3.879 3.975 . 0 0 "[ . 1 . 2 .]" 1
754 1 52 ILE HA 1 53 PHE H 2.269 . 2.912 2.255 2.155 2.324 . 0 0 "[ . 1 . 2 .]" 1
755 1 52 ILE HA 1 53 PHE QD 5.226 . 8.640 4.442 3.421 5.989 . 0 0 "[ . 1 . 2 .]" 1
756 1 52 ILE HB 1 52 ILE MD 2.229 . 2.850 2.424 2.364 2.513 . 0 0 "[ . 1 . 2 .]" 1
757 1 52 ILE HB 1 72 LEU MD2 3.924 . 5.849 4.266 3.923 4.545 . 0 0 "[ . 1 . 2 .]" 1
758 1 52 ILE MD 1 70 LEU MD1 4.226 3.364 5.288 4.672 4.511 4.762 . 0 0 "[ . 1 . 2 .]" 1
759 1 52 ILE MD 1 70 LEU MD2 3.624 2.889 4.359 4.368 4.137 4.416 0.057 17 0 "[ . 1 . 2 .]" 1
760 1 52 ILE MD 1 72 LEU MD2 2.885 2.441 3.329 2.663 2.424 3.085 0.017 2 0 "[ . 1 . 2 .]" 1
761 1 52 ILE MD 1 79 ASN HD21 2.671 . 3.563 2.846 2.124 3.595 0.032 23 0 "[ . 1 . 2 .]" 1
762 1 52 ILE MD 1 79 ASN HD22 2.229 . 2.850 2.057 1.711 2.510 . 0 0 "[ . 1 . 2 .]" 1
763 1 53 PHE H 1 53 PHE HA 2.488 . 3.262 2.908 2.880 2.943 . 0 0 "[ . 1 . 2 .]" 1
764 1 53 PHE H 1 53 PHE QD 3.906 . 5.813 3.357 2.764 4.412 . 0 0 "[ . 1 . 2 .]" 1
765 1 53 PHE H 1 54 THR H 4.690 . 7.439 4.360 4.277 4.437 . 0 0 "[ . 1 . 2 .]" 1
766 1 53 PHE HA 1 53 PHE QD 4.719 . 7.503 3.468 2.461 3.766 . 0 0 "[ . 1 . 2 .]" 1
767 1 53 PHE HA 1 54 THR H 2.619 . 3.476 2.229 2.128 2.367 . 0 0 "[ . 1 . 2 .]" 1
768 1 53 PHE HB2 1 53 PHE QD 3.851 . 5.705 2.422 2.325 2.568 . 0 0 "[ . 1 . 2 .]" 1
769 1 53 PHE HB2 1 54 THR H 3.572 . 5.167 3.063 2.441 4.238 . 0 0 "[ . 1 . 2 .]" 1
770 1 53 PHE HB2 1 54 THR MG 4.876 . 7.847 5.973 5.562 6.992 . 0 0 "[ . 1 . 2 .]" 1
771 1 53 PHE HB3 1 53 PHE QD 3.599 . 5.218 2.368 2.271 2.478 . 0 0 "[ . 1 . 2 .]" 1
772 1 53 PHE HB3 1 54 THR H 4.538 . 7.112 3.861 3.541 4.069 . 0 0 "[ . 1 . 2 .]" 1
773 1 53 PHE QD 1 54 THR H 4.820 . 7.724 3.731 2.975 4.294 . 0 0 "[ . 1 . 2 .]" 1
774 1 53 PHE QD 1 55 GLU HB2 4.001 2.949 5.053 3.868 2.129 4.917 0.820 23 3 "[ - . 1 . 2 + *]" 1
775 1 53 PHE QE 1 55 GLU QG 2.881 2.039 3.723 2.836 2.248 3.641 . 0 0 "[ . 1 . 2 .]" 1
776 1 54 THR H 1 54 THR HB 2.645 . 3.520 2.573 2.463 2.684 . 0 0 "[ . 1 . 2 .]" 1
777 1 54 THR H 1 54 THR MG 3.988 . 5.976 3.750 3.701 3.820 . 0 0 "[ . 1 . 2 .]" 1
778 1 54 THR H 1 55 GLU H 4.869 . 7.833 4.322 4.234 4.418 . 0 0 "[ . 1 . 2 .]" 1
779 1 54 THR H 1 70 LEU MD1 3.845 2.092 5.598 3.373 3.177 3.694 . 0 0 "[ . 1 . 2 .]" 1
780 1 54 THR H 1 70 LEU MD2 4.159 . 6.321 5.909 5.680 6.267 . 0 0 "[ . 1 . 2 .]" 1
781 1 54 THR HA 1 54 THR MG 2.498 . 3.278 2.302 2.257 2.355 . 0 0 "[ . 1 . 2 .]" 1
782 1 54 THR HA 1 55 GLU H 2.509 . 3.296 2.175 2.142 2.217 . 0 0 "[ . 1 . 2 .]" 1
783 1 54 THR HA 1 70 LEU MD1 2.819 . 3.813 2.480 2.323 2.725 . 0 0 "[ . 1 . 2 .]" 1
784 1 54 THR HB 1 54 THR MG 2.173 . 2.763 2.138 2.126 2.146 . 0 0 "[ . 1 . 2 .]" 1
785 1 54 THR HB 1 55 GLU H 3.900 . 5.801 4.257 4.152 4.326 . 0 0 "[ . 1 . 2 .]" 1
786 1 54 THR MG 1 55 GLU H 2.385 . 3.096 3.047 2.698 3.127 0.031 3 0 "[ . 1 . 2 .]" 1
787 1 54 THR MG 1 55 GLU HA 3.592 . 5.205 4.072 3.710 4.247 . 0 0 "[ . 1 . 2 .]" 1
788 1 54 THR MG 1 55 GLU HB3 4.459 . 6.944 5.286 4.616 5.683 . 0 0 "[ . 1 . 2 .]" 1
789 1 54 THR MG 1 56 PHE QD 2.903 . 3.956 3.577 3.313 3.880 . 0 0 "[ . 1 . 2 .]" 1
790 1 54 THR MG 1 56 PHE QE 3.051 . 4.214 2.918 2.739 3.075 . 0 0 "[ . 1 . 2 .]" 1
791 1 54 THR MG 1 56 PHE HZ 2.373 . 3.077 2.822 2.533 3.099 0.022 1 0 "[ . 1 . 2 .]" 1
792 1 55 GLU H 1 55 GLU HB2 4.158 . 6.319 2.585 2.300 2.983 . 0 0 "[ . 1 . 2 .]" 1
793 1 55 GLU H 1 55 GLU HB3 3.525 . 5.078 3.193 2.484 3.703 . 0 0 "[ . 1 . 2 .]" 1
794 1 55 GLU H 1 55 GLU QG 4.745 . 7.560 3.225 2.430 4.130 . 0 0 "[ . 1 . 2 .]" 1
795 1 55 GLU H 1 56 PHE QE 4.867 . 7.829 5.667 5.404 5.932 . 0 0 "[ . 1 . 2 .]" 1
796 1 55 GLU H 1 69 CYS H 2.954 . 4.044 3.236 2.848 3.476 . 0 0 "[ . 1 . 2 .]" 1
797 1 55 GLU HA 1 55 GLU QG 3.449 . 4.936 2.555 2.317 2.927 . 0 0 "[ . 1 . 2 .]" 1
798 1 55 GLU HA 1 56 PHE H 2.661 . 3.546 2.158 2.020 2.310 . 0 0 "[ . 1 . 2 .]" 1
799 1 55 GLU HA 1 56 PHE QD 5.377 . 8.991 3.683 3.002 4.339 . 0 0 "[ . 1 . 2 .]" 1
800 1 55 GLU HA 1 69 CYS HB2 5.995 . 10.488 7.471 7.118 7.851 . 0 0 "[ . 1 . 2 .]" 1
801 1 55 GLU HB2 1 55 GLU QG 3.428 . 4.897 2.265 2.128 2.375 . 0 0 "[ . 1 . 2 .]" 1
802 1 55 GLU HB3 1 55 GLU QG 3.158 . 4.405 2.344 2.169 2.415 . 0 0 "[ . 1 . 2 .]" 1
803 1 55 GLU HB3 1 56 PHE H 4.881 . 7.859 3.560 2.545 4.327 . 0 0 "[ . 1 . 2 .]" 1
804 1 55 GLU HB3 1 69 CYS H 3.479 . 4.992 3.994 3.306 5.046 0.054 21 0 "[ . 1 . 2 .]" 1
805 1 55 GLU QG 1 56 PHE H 4.203 . 6.411 3.758 2.596 4.621 . 0 0 "[ . 1 . 2 .]" 1
806 1 56 PHE H 1 56 PHE HA 2.853 . 3.871 2.921 2.885 2.950 . 0 0 "[ . 1 . 2 .]" 1
807 1 56 PHE H 1 56 PHE HB2 3.870 . 5.742 2.497 2.375 2.657 . 0 0 "[ . 1 . 2 .]" 1
808 1 56 PHE H 1 56 PHE HB3 3.037 . 4.190 3.664 3.586 3.760 . 0 0 "[ . 1 . 2 .]" 1
809 1 56 PHE H 1 56 PHE QD 3.554 . 5.133 2.697 2.134 3.244 . 0 0 "[ . 1 . 2 .]" 1
810 1 56 PHE HA 1 57 LEU H 2.442 . 3.188 2.234 2.084 2.375 . 0 0 "[ . 1 . 2 .]" 1
811 1 56 PHE HA 1 57 LEU QD 4.851 . 7.792 4.484 4.323 4.714 . 0 0 "[ . 1 . 2 .]" 1
812 1 56 PHE HA 1 57 LEU HG 5.308 . 8.830 4.229 3.852 4.526 . 0 0 "[ . 1 . 2 .]" 1
813 1 56 PHE HA 1 68 GLY H 4.532 . 7.099 4.857 4.489 5.637 . 0 0 "[ . 1 . 2 .]" 1
814 1 56 PHE HA 1 68 GLY HA2 3.843 . 5.689 2.653 2.034 3.814 . 0 0 "[ . 1 . 2 .]" 1
815 1 56 PHE HA 1 69 CYS H 4.129 . 6.260 3.483 2.959 4.478 . 0 0 "[ . 1 . 2 .]" 1
816 1 56 PHE HB2 1 56 PHE QD 3.392 . 4.830 2.375 2.268 2.482 . 0 0 "[ . 1 . 2 .]" 1
817 1 56 PHE HB2 1 57 LEU H 3.761 . 5.529 3.986 3.639 4.429 . 0 0 "[ . 1 . 2 .]" 1
818 1 56 PHE HB2 1 68 GLY HA2 5.150 . 8.465 5.584 4.916 6.718 . 0 0 "[ . 1 . 2 .]" 1
819 1 56 PHE HB3 1 56 PHE HD1 3.511 . 5.052 3.010 2.422 3.715 . 0 0 "[ . 1 . 2 .]" 1
820 1 56 PHE HB3 1 57 LEU H 4.132 . 6.266 2.955 2.424 3.753 . 0 0 "[ . 1 . 2 .]" 1
821 1 56 PHE HB3 1 68 GLY HA2 6.229 . 11.080 4.744 3.880 6.170 . 0 0 "[ . 1 . 2 .]" 1
822 1 56 PHE QD 1 57 LEU H 4.715 . 7.494 3.960 3.686 4.715 . 0 0 "[ . 1 . 2 .]" 1
823 1 56 PHE QD 1 66 ARG QB 3.561 . 5.146 3.871 2.732 5.055 . 0 0 "[ . 1 . 2 .]" 1
824 1 56 PHE QE 1 68 GLY HA2 5.765 . 9.920 6.039 4.734 7.543 . 0 0 "[ . 1 . 2 .]" 1
825 1 57 LEU H 1 57 LEU QB 2.983 . 4.095 2.859 2.197 3.097 . 0 0 "[ . 1 . 2 .]" 1
826 1 57 LEU H 1 57 LEU QD 3.270 . 4.606 3.165 2.955 3.590 . 0 0 "[ . 1 . 2 .]" 1
827 1 57 LEU H 1 57 LEU HG 2.595 . 3.436 2.357 2.019 3.455 0.019 4 0 "[ . 1 . 2 .]" 1
828 1 57 LEU H 1 67 HIS H 3.547 . 5.120 4.280 3.864 5.050 . 0 0 "[ . 1 . 2 .]" 1
829 1 57 LEU H 1 68 GLY HA2 3.063 . 4.236 2.737 2.228 3.711 . 0 0 "[ . 1 . 2 .]" 1
830 1 57 LEU H 1 68 GLY HA3 3.698 . 5.408 3.545 2.936 4.079 . 0 0 "[ . 1 . 2 .]" 1
831 1 57 LEU HA 1 57 LEU QB 3.431 . 4.346 2.203 2.177 2.476 . 0 0 "[ . 1 . 2 .]" 1
832 1 57 LEU HA 1 57 LEU QD 2.751 . 3.697 3.345 2.008 3.439 . 0 0 "[ . 1 . 2 .]" 1
833 1 57 LEU HA 1 57 LEU HG 3.580 . 5.182 3.744 2.662 3.832 . 0 0 "[ . 1 . 2 .]" 1
834 1 57 LEU HA 1 58 GLU H 2.369 . 3.071 2.379 2.075 2.547 . 0 0 "[ . 1 . 2 .]" 1
835 1 57 LEU QB 1 57 LEU QD 2.035 . 2.185 1.882 1.847 1.899 . 0 0 "[ . 1 . 2 .]" 1
836 1 57 LEU QB 1 58 GLU H . . 3.051 2.527 2.269 2.982 . 0 0 "[ . 1 . 2 .]" 1
837 1 57 LEU QB 1 58 GLU HB2 4.559 . 7.157 4.432 4.037 5.080 . 0 0 "[ . 1 . 2 .]" 1
838 1 57 LEU QB 1 67 HIS HB2 4.558 . 7.155 4.284 1.822 4.819 0.139 4 0 "[ . 1 . 2 .]" 1
839 1 57 LEU QB 1 67 HIS HD2 4.852 . 7.795 6.417 3.640 7.163 . 0 0 "[ . 1 . 2 .]" 1
840 1 57 LEU QB 1 68 GLY HA2 3.714 . 5.439 3.708 2.803 4.486 . 0 0 "[ . 1 . 2 .]" 1
841 1 57 LEU QD 1 57 LEU HG 1.739 . 2.117 1.897 1.888 1.913 . 0 0 "[ . 1 . 2 .]" 1
842 1 57 LEU QD 1 58 GLU H 2.584 . 3.418 2.907 2.552 3.192 . 0 0 "[ . 1 . 2 .]" 1
843 1 57 LEU QD 1 58 GLU HB2 2.904 . 3.958 3.971 3.251 4.683 0.725 13 3 "[ . 1 + . - 2 * .]" 1
844 1 57 LEU QD 1 58 GLU HG3 4.306 . 6.623 5.247 4.439 5.773 . 0 0 "[ . 1 . 2 .]" 1
845 1 57 LEU QD 1 67 HIS H 4.190 . 6.385 3.637 2.791 4.709 . 0 0 "[ . 1 . 2 .]" 1
846 1 57 LEU QD 1 67 HIS HA 4.330 . 6.674 4.029 3.835 4.217 . 0 0 "[ . 1 . 2 .]" 1
847 1 57 LEU QD 1 67 HIS HB2 2.616 . 3.471 2.048 1.861 2.744 0.129 1 0 "[ . 1 . 2 .]" 1
848 1 57 LEU QD 1 67 HIS HB3 2.865 . 3.061 2.370 2.125 2.560 . 0 0 "[ . 1 . 2 .]" 1
849 1 57 LEU QD 1 67 HIS HD2 . . 4.363 3.563 2.595 4.409 0.046 4 0 "[ . 1 . 2 .]" 1
850 1 57 LEU QD 1 68 GLY H 5.102 . 5.469 3.841 3.395 4.392 . 0 0 "[ . 1 . 2 .]" 1
851 1 57 LEU QD 1 68 GLY HA2 2.766 . 3.722 3.132 2.407 3.627 . 0 0 "[ . 1 . 2 .]" 1
852 1 57 LEU QD 1 68 GLY HA3 4.005 . 6.010 4.412 3.856 4.836 . 0 0 "[ . 1 . 2 .]" 1
853 1 57 LEU QD 1 69 CYS HB2 5.982 . 10.455 4.288 3.137 5.719 . 0 0 "[ . 1 . 2 .]" 1
854 1 57 LEU HG 1 58 GLU H 4.196 . 6.397 4.470 4.271 4.681 . 0 0 "[ . 1 . 2 .]" 1
855 1 57 LEU HG 1 67 HIS HB3 3.086 . 4.276 3.087 2.152 4.681 0.405 4 0 "[ . 1 . 2 .]" 1
856 1 57 LEU HG 1 68 GLY HA2 3.364 . 4.779 3.105 2.360 3.823 . 0 0 "[ . 1 . 2 .]" 1
857 1 57 LEU HG 1 68 GLY HA3 4.610 . 7.267 4.413 3.762 5.086 . 0 0 "[ . 1 . 2 .]" 1
858 1 58 GLU H 1 58 GLU HB2 2.236 . 2.861 2.380 2.164 2.547 . 0 0 "[ . 1 . 2 .]" 1
859 1 58 GLU H 1 58 GLU HG3 3.392 2.418 4.366 3.370 2.353 4.460 0.094 23 0 "[ . 1 . 2 .]" 1
860 1 58 GLU HA 1 58 GLU HB2 2.914 . 3.975 2.906 2.445 3.022 . 0 0 "[ . 1 . 2 .]" 1
861 1 58 GLU HA 1 58 GLU HG3 2.752 . 3.699 3.176 2.522 3.728 0.029 3 0 "[ . 1 . 2 .]" 1
862 1 58 GLU HA 1 59 PRO HB2 5.414 . 9.079 4.369 4.273 4.541 . 0 0 "[ . 1 . 2 .]" 1
863 1 58 GLU HA 1 59 PRO HB3 4.523 . 7.081 4.756 4.555 4.914 . 0 0 "[ . 1 . 2 .]" 1
864 1 58 GLU HA 1 59 PRO HD2 2.820 . 3.814 2.463 2.066 2.776 . 0 0 "[ . 1 . 2 .]" 1
865 1 58 GLU HA 1 59 PRO HD3 1.993 . 2.489 2.052 1.893 2.382 . 0 0 "[ . 1 . 2 .]" 1
866 1 58 GLU HA 1 59 PRO HG3 4.584 . 7.210 4.197 4.009 4.518 . 0 0 "[ . 1 . 2 .]" 1
867 1 58 GLU HB2 1 58 GLU HG3 2.116 . 2.676 2.491 2.381 3.016 0.340 25 0 "[ . 1 . 2 .]" 1
868 1 58 GLU HB2 1 59 PRO HD2 4.654 . 7.362 4.749 4.214 5.131 . 0 0 "[ . 1 . 2 .]" 1
869 1 58 GLU HB2 1 59 PRO HD3 4.801 . 7.682 4.765 4.427 4.981 . 0 0 "[ . 1 . 2 .]" 1
870 1 58 GLU HG3 1 59 PRO HD2 3.883 . 5.768 4.926 2.854 5.783 0.015 4 0 "[ . 1 . 2 .]" 1
871 1 58 GLU HG3 1 59 PRO HD3 4.555 . 7.148 5.084 4.011 5.885 . 0 0 "[ . 1 . 2 .]" 1
872 1 59 PRO HA 1 59 PRO HB2 2.490 . 3.265 2.790 2.640 2.968 . 0 0 "[ . 1 . 2 .]" 1
873 1 59 PRO HA 1 59 PRO HD3 4.138 . 6.278 3.885 3.739 4.007 . 0 0 "[ . 1 . 2 .]" 1
874 1 59 PRO HA 1 60 ALA H 2.178 . 2.771 2.260 2.083 2.454 . 0 0 "[ . 1 . 2 .]" 1
875 1 59 PRO HA 1 60 ALA MB 3.466 . 4.968 4.001 3.930 4.105 . 0 0 "[ . 1 . 2 .]" 1
876 1 59 PRO HB2 1 59 PRO HD2 4.116 . 6.234 3.496 2.860 3.997 . 0 0 "[ . 1 . 2 .]" 1
877 1 59 PRO HB2 1 59 PRO HG3 2.705 . 3.619 2.831 2.659 2.995 . 0 0 "[ . 1 . 2 .]" 1
878 1 59 PRO HB2 1 60 ALA H 3.255 . 4.580 3.176 2.550 3.882 . 0 0 "[ . 1 . 2 .]" 1
879 1 59 PRO HB3 1 59 PRO HD3 4.032 . 6.064 3.592 3.029 4.060 . 0 0 "[ . 1 . 2 .]" 1
880 1 59 PRO HB3 1 60 ALA H 2.980 . 4.090 3.599 3.221 4.075 . 0 0 "[ . 1 . 2 .]" 1
881 1 59 PRO HD2 1 59 PRO HG3 2.123 . 2.686 2.890 2.728 2.999 0.313 15 0 "[ . 1 . 2 .]" 1
882 1 59 PRO HD2 1 60 ALA HA 3.843 . 5.689 5.491 5.123 5.750 0.061 3 0 "[ . 1 . 2 .]" 1
883 1 59 PRO HD3 1 59 PRO HG3 2.525 . 3.322 2.280 2.251 2.323 . 0 0 "[ . 1 . 2 .]" 1
884 1 59 PRO HG3 1 60 ALA H 5.426 . 9.106 5.242 4.987 5.669 . 0 0 "[ . 1 . 2 .]" 1
885 1 60 ALA H 1 60 ALA MB 1.996 . 2.494 2.230 2.189 2.301 . 0 0 "[ . 1 . 2 .]" 1
886 1 60 ALA H 1 61 ALA HA 3.698 . 5.407 5.382 5.220 5.480 0.073 16 0 "[ . 1 . 2 .]" 1
887 1 60 ALA HA 1 60 ALA MB 1.805 . 2.212 2.140 2.127 2.152 . 0 0 "[ . 1 . 2 .]" 1
888 1 60 ALA HA 1 61 ALA H 2.288 . 2.942 2.283 2.099 2.649 . 0 0 "[ . 1 . 2 .]" 1
889 1 60 ALA HA 1 61 ALA HA 3.733 . 5.475 4.269 4.183 4.393 . 0 0 "[ . 1 . 2 .]" 1
890 1 60 ALA HA 1 61 ALA MB 3.684 . 5.381 4.019 3.911 4.268 . 0 0 "[ . 1 . 2 .]" 1
891 1 60 ALA MB 1 61 ALA H 2.633 . 3.500 2.713 2.131 3.206 . 0 0 "[ . 1 . 2 .]" 1
892 1 60 ALA MB 1 61 ALA H 2.115 . 2.674 2.119 1.947 2.214 . 0 0 "[ . 1 . 2 .]" 1
893 1 60 ALA MB 1 61 ALA HA 3.904 . 5.810 4.428 4.285 4.603 . 0 0 "[ . 1 . 2 .]" 1
894 1 60 ALA MB 1 63 GLU H 3.042 . 4.198 3.156 2.809 3.537 . 0 0 "[ . 1 . 2 .]" 1
895 1 60 ALA MB 1 63 GLU QB 2.700 . 3.612 3.178 2.242 3.558 . 0 0 "[ . 1 . 2 .]" 1
896 1 60 ALA MB 1 63 GLU QG 2.248 . 2.880 2.289 1.847 2.854 . 0 0 "[ . 1 . 2 .]" 1
897 1 61 ALA H 1 61 ALA HA 2.528 . 3.327 2.816 2.724 2.893 . 0 0 "[ . 1 . 2 .]" 1
898 1 61 ALA H 1 61 ALA MB 1.968 . 2.452 2.235 2.199 2.277 . 0 0 "[ . 1 . 2 .]" 1
899 1 61 ALA H 1 63 GLU H 3.727 . 5.464 4.186 3.892 4.400 . 0 0 "[ . 1 . 2 .]" 1
900 1 61 ALA HA 1 61 ALA MB 1.883 . 2.326 2.122 2.105 2.138 . 0 0 "[ . 1 . 2 .]" 1
901 1 61 ALA HA 1 62 ASN H 2.838 . 3.845 3.349 2.986 3.487 . 0 0 "[ . 1 . 2 .]" 1
902 1 61 ALA HA 1 62 ASN HB2 4.695 . 7.451 5.813 5.434 6.526 . 0 0 "[ . 1 . 2 .]" 1
903 1 61 ALA HA 1 63 GLU H 3.124 . 4.344 3.658 3.284 3.994 . 0 0 "[ . 1 . 2 .]" 1
904 1 61 ALA MB 1 62 ASN H 2.759 . 3.711 2.999 2.639 3.456 . 0 0 "[ . 1 . 2 .]" 1
905 1 61 ALA MB 1 62 ASN HA 3.586 . 5.193 4.010 3.798 4.256 . 0 0 "[ . 1 . 2 .]" 1
906 1 61 ALA MB 1 62 ASN HB2 3.420 . 4.882 4.655 4.038 5.493 0.611 22 1 "[ . 1 . 2 + .]" 1
907 1 61 ALA MB 1 63 GLU H 3.948 . 5.896 4.402 4.204 4.541 . 0 0 "[ . 1 . 2 .]" 1
908 1 61 ALA MB 1 63 GLU QB 4.334 . 6.682 5.884 5.568 6.290 . 0 0 "[ . 1 . 2 .]" 1
909 1 62 ASN H 1 62 ASN HB2 3.142 . 4.376 2.692 2.396 3.712 . 0 0 "[ . 1 . 2 .]" 1
910 1 62 ASN H 1 63 GLU H 2.550 . 3.363 2.422 2.041 2.643 . 0 0 "[ . 1 . 2 .]" 1
911 1 62 ASN HA 1 62 ASN HB2 2.492 . 3.268 2.747 2.384 3.027 . 0 0 "[ . 1 . 2 .]" 1
912 1 62 ASN HA 1 63 GLU H 2.867 . 3.895 3.330 3.022 3.492 . 0 0 "[ . 1 . 2 .]" 1
913 1 62 ASN HB2 1 63 GLU H 4.175 . 6.354 3.871 2.974 4.442 . 0 0 "[ . 1 . 2 .]" 1
914 1 62 ASN HB2 1 63 GLU QG 4.890 . 7.879 4.565 3.073 6.076 . 0 0 "[ . 1 . 2 .]" 1
915 1 63 GLU H 1 63 GLU HA 2.705 . 3.620 2.912 2.864 2.941 . 0 0 "[ . 1 . 2 .]" 1
916 1 63 GLU H 1 63 GLU QB . . 3.424 2.601 2.346 3.014 . 0 0 "[ . 1 . 2 .]" 1
917 1 63 GLU H 1 63 GLU QG 2.529 . 3.328 2.517 1.992 2.897 . 0 0 "[ . 1 . 2 .]" 1
918 1 63 GLU HA 1 63 GLU QB 3.376 . 4.078 2.300 2.171 2.419 . 0 0 "[ . 1 . 2 .]" 1
919 1 63 GLU HA 1 63 GLU QG 3.206 . 4.490 2.875 2.424 3.385 . 0 0 "[ . 1 . 2 .]" 1
920 1 63 GLU HA 1 64 THR H 2.399 . 3.118 2.262 2.124 2.514 . 0 0 "[ . 1 . 2 .]" 1
921 1 63 GLU HA 1 64 THR MG 3.880 . 5.762 4.348 3.425 5.440 . 0 0 "[ . 1 . 2 .]" 1
922 1 63 GLU QB 1 63 GLU QG . . 2.783 2.065 1.982 2.094 . 0 0 "[ . 1 . 2 .]" 1
923 1 63 GLU QB 1 64 THR H 2.856 . 3.875 2.867 2.425 3.441 . 0 0 "[ . 1 . 2 .]" 1
924 1 63 GLU QG 1 64 THR H 4.456 . 6.937 3.967 3.241 4.705 . 0 0 "[ . 1 . 2 .]" 1
925 1 63 GLU QG 1 64 THR MG 5.112 . 8.378 5.634 4.634 6.683 . 0 0 "[ . 1 . 2 .]" 1
926 1 63 GLU QG 1 65 VAL H 4.835 . 7.757 3.448 1.821 4.610 0.092 21 0 "[ . 1 . 2 .]" 1
927 1 64 THR H 1 64 THR MG 2.849 . 3.863 3.168 2.490 3.865 0.002 19 0 "[ . 1 . 2 .]" 1
928 1 64 THR H 1 65 VAL H 2.219 . 2.835 2.421 2.087 2.824 . 0 0 "[ . 1 . 2 .]" 1
929 1 64 THR H 1 65 VAL HA 3.931 . 5.863 4.636 4.285 4.934 . 0 0 "[ . 1 . 2 .]" 1
930 1 64 THR HA 1 64 THR MG 2.050 . 2.575 2.281 2.234 2.353 . 0 0 "[ . 1 . 2 .]" 1
931 1 64 THR HA 1 65 VAL H 3.241 . 4.554 3.013 2.707 3.236 . 0 0 "[ . 1 . 2 .]" 1
932 1 64 THR HB 1 64 THR MG 2.016 . 2.524 2.144 2.136 2.154 . 0 0 "[ . 1 . 2 .]" 1
933 1 64 THR MG 1 65 VAL H 4.056 . 6.113 4.284 4.141 4.403 . 0 0 "[ . 1 . 2 .]" 1
934 1 65 VAL H 1 65 VAL HA 2.663 . 3.550 2.925 2.895 2.941 . 0 0 "[ . 1 . 2 .]" 1
935 1 65 VAL H 1 65 VAL HB 2.253 . 2.887 2.700 2.617 2.779 . 0 0 "[ . 1 . 2 .]" 1
936 1 65 VAL H 1 66 ARG H 3.671 . 5.355 4.332 4.244 4.439 . 0 0 "[ . 1 . 2 .]" 1
937 1 65 VAL HA 1 65 VAL HB 2.595 . 3.437 3.014 2.981 3.031 . 0 0 "[ . 1 . 2 .]" 1
938 1 65 VAL HA 1 66 ARG H 2.167 . 2.754 2.108 2.036 2.198 . 0 0 "[ . 1 . 2 .]" 1
939 1 66 ARG H 1 66 ARG HB2 2.218 . 2.833 2.618 2.390 2.893 0.060 10 0 "[ . 1 . 2 .]" 1
940 1 66 ARG H 1 67 HIS HD2 4.355 . 6.726 5.096 4.210 5.690 . 0 0 "[ . 1 . 2 .]" 1
941 1 66 ARG HA 1 66 ARG HD2 4.851 . 7.793 4.792 4.344 5.004 . 0 0 "[ . 1 . 2 .]" 1
942 1 66 ARG HA 1 66 ARG HD3 5.083 . 8.313 4.752 4.325 5.019 . 0 0 "[ . 1 . 2 .]" 1
943 1 66 ARG HA 1 66 ARG HG2 3.308 . 4.676 2.866 2.557 3.380 . 0 0 "[ . 1 . 2 .]" 1
944 1 66 ARG HA 1 66 ARG HG3 3.904 . 5.809 2.976 2.628 3.308 . 0 0 "[ . 1 . 2 .]" 1
945 1 66 ARG HA 1 67 HIS H 2.573 . 3.401 2.180 2.081 2.277 . 0 0 "[ . 1 . 2 .]" 1
946 1 66 ARG HB2 1 66 ARG HD2 3.511 . 5.052 3.246 2.355 3.732 . 0 0 "[ . 1 . 2 .]" 1
947 1 66 ARG HB2 1 66 ARG HD3 2.632 . 3.498 2.986 2.409 3.785 0.287 10 0 "[ . 1 . 2 .]" 1
948 1 66 ARG HB2 1 66 ARG HE 3.633 . 5.282 3.057 1.860 4.390 0.124 23 0 "[ . 1 . 2 .]" 1
949 1 66 ARG HB2 1 66 ARG HG3 2.606 . 3.455 2.447 2.384 2.546 . 0 0 "[ . 1 . 2 .]" 1
950 1 66 ARG HB2 1 67 HIS H 3.598 . 5.216 4.157 3.834 4.397 . 0 0 "[ . 1 . 2 .]" 1
951 1 66 ARG HD2 1 66 ARG HG2 2.672 . 3.564 2.564 2.391 3.027 . 0 0 "[ . 1 . 2 .]" 1
952 1 66 ARG HD2 1 66 ARG HG2 2.220 . 2.836 2.126 2.070 2.248 . 0 0 "[ . 1 . 2 .]" 1
953 1 66 ARG HD2 1 66 ARG HG3 2.817 . 3.809 2.625 2.370 3.021 . 0 0 "[ . 1 . 2 .]" 1
954 1 66 ARG HD2 1 67 HIS H 5.758 . 9.903 6.148 5.191 6.861 . 0 0 "[ . 1 . 2 .]" 1
955 1 66 ARG HD3 1 66 ARG HG3 2.746 . 3.689 2.573 2.425 3.018 . 0 0 "[ . 1 . 2 .]" 1
956 1 66 ARG HD3 1 67 HIS H 5.590 . 9.496 5.825 5.110 6.382 . 0 0 "[ . 1 . 2 .]" 1
957 1 66 ARG HE 1 66 ARG HG2 3.385 . 4.818 2.940 2.441 3.717 . 0 0 "[ . 1 . 2 .]" 1
958 1 66 ARG HE 1 66 ARG HG3 4.092 . 6.185 3.112 2.375 3.894 . 0 0 "[ . 1 . 2 .]" 1
959 1 66 ARG HG2 1 67 HIS H 5.041 . 8.217 4.033 2.840 4.733 . 0 0 "[ . 1 . 2 .]" 1
960 1 67 HIS H 1 67 HIS HB2 3.976 . 5.952 2.595 2.499 2.722 . 0 0 "[ . 1 . 2 .]" 1
961 1 67 HIS H 1 67 HIS HB3 2.875 . 3.908 3.735 3.680 3.827 . 0 0 "[ . 1 . 2 .]" 1
962 1 67 HIS H 1 67 HIS HD2 3.261 . 4.591 3.103 2.702 4.590 . 0 0 "[ . 1 . 2 .]" 1
963 1 67 HIS H 1 68 GLY H 4.463 . 6.952 4.418 4.261 4.561 . 0 0 "[ . 1 . 2 .]" 1
964 1 67 HIS H 1 68 GLY HA2 4.177 . 6.358 5.103 4.882 5.282 . 0 0 "[ . 1 . 2 .]" 1
965 1 67 HIS HA 1 67 HIS HB2 2.991 . 4.109 3.025 3.007 3.049 . 0 0 "[ . 1 . 2 .]" 1
966 1 67 HIS HA 1 68 GLY H 2.392 . 3.107 2.232 2.113 2.375 . 0 0 "[ . 1 . 2 .]" 1
967 1 67 HIS HB2 1 67 HIS HD2 3.847 . 5.697 2.876 2.745 3.934 . 0 0 "[ . 1 . 2 .]" 1
968 1 67 HIS HB2 1 68 GLY H 3.162 . 4.411 3.995 3.668 4.320 . 0 0 "[ . 1 . 2 .]" 1
969 1 67 HIS HB3 1 67 HIS HD2 3.031 . 4.179 3.874 2.993 3.962 . 0 0 "[ . 1 . 2 .]" 1
970 1 67 HIS HB3 1 68 GLY H 4.173 . 6.350 3.000 2.494 3.578 . 0 0 "[ . 1 . 2 .]" 1
971 1 68 GLY H 1 69 CYS H 4.230 . 6.467 4.273 4.216 4.399 . 0 0 "[ . 1 . 2 .]" 1
972 1 68 GLY HA2 1 69 CYS H 3.363 . 4.777 2.564 2.328 2.710 . 0 0 "[ . 1 . 2 .]" 1
973 1 68 GLY HA3 1 69 CYS H 2.866 2.043 3.689 2.471 2.343 2.673 . 0 0 "[ . 1 . 2 .]" 1
974 1 69 CYS H 1 69 CYS HB2 4.081 . 6.163 3.441 3.313 3.578 . 0 0 "[ . 1 . 2 .]" 1
975 1 69 CYS H 1 69 CYS HB3 3.035 . 4.186 2.749 2.552 2.875 . 0 0 "[ . 1 . 2 .]" 1
976 1 69 CYS H 1 70 LEU MD1 4.415 . 6.851 5.878 5.612 6.021 . 0 0 "[ . 1 . 2 .]" 1
977 1 69 CYS H 1 70 LEU MD2 4.651 . 7.355 7.234 7.039 7.356 0.001 8 0 "[ . 1 . 2 .]" 1
978 1 69 CYS HA 1 70 LEU H 2.449 . 3.199 2.176 2.146 2.245 . 0 0 "[ . 1 . 2 .]" 1
979 1 69 CYS HA 1 70 LEU HA 4.821 . 7.726 4.396 4.370 4.421 . 0 0 "[ . 1 . 2 .]" 1
980 1 69 CYS HA 1 70 LEU HB3 4.470 . 6.968 4.684 4.594 4.761 . 0 0 "[ . 1 . 2 .]" 1
981 1 69 CYS HB2 1 70 LEU H 4.217 . 6.439 4.071 3.954 4.167 . 0 0 "[ . 1 . 2 .]" 1
982 1 69 CYS HB3 1 70 LEU H 4.285 . 6.581 4.225 4.050 4.345 . 0 0 "[ . 1 . 2 .]" 1
983 1 69 CYS HB3 1 70 LEU HA 5.257 . 8.712 5.048 4.911 5.140 . 0 0 "[ . 1 . 2 .]" 1
984 1 70 LEU H 1 70 LEU HB2 2.622 . 3.482 2.707 2.604 2.793 . 0 0 "[ . 1 . 2 .]" 1
985 1 70 LEU H 1 70 LEU HB3 3.000 . 4.125 2.518 2.462 2.569 . 0 0 "[ . 1 . 2 .]" 1
986 1 70 LEU H 1 70 LEU MD1 3.917 . 5.835 4.217 4.144 4.270 . 0 0 "[ . 1 . 2 .]" 1
987 1 70 LEU H 1 70 LEU MD2 4.474 . 6.976 4.342 4.295 4.388 . 0 0 "[ . 1 . 2 .]" 1
988 1 70 LEU H 1 70 LEU HG 4.661 . 7.376 4.470 4.424 4.512 . 0 0 "[ . 1 . 2 .]" 1
989 1 70 LEU H 1 71 ARG HG2 5.625 . 9.581 6.362 4.790 7.681 . 0 0 "[ . 1 . 2 .]" 1
990 1 70 LEU HA 1 70 LEU MD1 2.234 . 2.858 2.147 2.093 2.207 . 0 0 "[ . 1 . 2 .]" 1
991 1 70 LEU HA 1 70 LEU MD2 3.719 . 5.448 3.912 3.881 3.936 . 0 0 "[ . 1 . 2 .]" 1
992 1 70 LEU HA 1 71 ARG H 2.796 . 3.774 2.147 2.105 2.204 . 0 0 "[ . 1 . 2 .]" 1
993 1 70 LEU HB2 1 70 LEU MD1 3.067 . 4.243 2.343 2.281 2.376 . 0 0 "[ . 1 . 2 .]" 1
994 1 70 LEU HB2 1 70 LEU MD2 2.350 . 3.040 2.425 2.361 2.480 . 0 0 "[ . 1 . 2 .]" 1
995 1 70 LEU HB2 1 70 LEU HG 2.801 . 3.782 3.021 3.014 3.027 . 0 0 "[ . 1 . 2 .]" 1
996 1 70 LEU HB3 1 70 LEU MD1 2.503 . 3.286 3.197 3.182 3.206 . 0 0 "[ . 1 . 2 .]" 1
997 1 70 LEU HB3 1 70 LEU MD2 2.386 . 3.098 2.316 2.290 2.347 . 0 0 "[ . 1 . 2 .]" 1
998 1 70 LEU MD1 1 70 LEU MD2 1.665 . 2.012 2.048 2.042 2.054 0.042 5 0 "[ . 1 . 2 .]" 1
999 1 70 LEU MD1 1 70 LEU HG 1.916 . 2.375 2.114 2.107 2.126 . 0 0 "[ . 1 . 2 .]" 1
1000 1 70 LEU MD1 1 71 ARG H 3.495 . 5.022 3.002 2.705 3.438 . 0 0 "[ . 1 . 2 .]" 1
1001 1 70 LEU MD2 1 83 TYR QD 3.183 . 4.449 2.719 2.330 3.755 . 0 0 "[ . 1 . 2 .]" 1
1002 1 70 LEU MD2 1 83 TYR QE 3.300 . 4.662 2.863 2.098 4.190 . 0 0 "[ . 1 . 2 .]" 1
1003 1 71 ARG H 1 71 ARG HG2 4.004 . 6.008 3.731 2.052 4.518 . 0 0 "[ . 1 . 2 .]" 1
1004 1 71 ARG H 1 72 LEU MD1 4.187 . 6.378 4.858 3.728 6.444 0.066 19 0 "[ . 1 . 2 .]" 1
1005 1 71 ARG HA 1 72 LEU H 2.494 . 3.271 2.065 2.004 2.184 . 0 0 "[ . 1 . 2 .]" 1
1006 1 71 ARG HA 1 72 LEU MD1 3.632 . 5.281 3.686 2.716 5.073 . 0 0 "[ . 1 . 2 .]" 1
1007 1 72 LEU H 1 72 LEU MD1 2.582 . 3.416 2.724 1.955 3.521 0.105 24 0 "[ . 1 . 2 .]" 1
1008 1 72 LEU H 1 72 LEU MD2 4.476 . 6.981 4.004 3.352 4.454 . 0 0 "[ . 1 . 2 .]" 1
1009 1 72 LEU HA 1 72 LEU MD1 3.635 . 5.287 3.478 3.044 4.004 . 0 0 "[ . 1 . 2 .]" 1
1010 1 72 LEU HA 1 72 LEU MD2 3.583 . 5.188 3.101 2.053 3.726 . 0 0 "[ . 1 . 2 .]" 1
1011 1 72 LEU HA 1 73 ASN H 2.285 . 2.938 2.033 1.944 2.174 . 0 0 "[ . 1 . 2 .]" 1
1012 1 72 LEU HB2 1 72 LEU MD1 2.020 . 2.530 2.319 2.229 2.386 . 0 0 "[ . 1 . 2 .]" 1
1013 1 72 LEU HB2 1 72 LEU MD2 3.351 . 4.755 2.805 2.542 3.196 . 0 0 "[ . 1 . 2 .]" 1
1014 1 72 LEU HB2 1 75 PRO HA 2.828 . 3.828 3.813 3.309 3.939 0.111 2 0 "[ . 1 . 2 .]" 1
1015 1 72 LEU HB3 1 72 LEU MD1 2.821 . 3.816 2.939 2.414 3.233 . 0 0 "[ . 1 . 2 .]" 1
1016 1 72 LEU HB3 1 72 LEU MD2 2.217 . 2.832 2.218 2.131 2.335 . 0 0 "[ . 1 . 2 .]" 1
1017 1 72 LEU HB3 1 75 PRO HA 2.880 . 3.917 2.987 2.565 3.891 . 0 0 "[ . 1 . 2 .]" 1
1018 1 72 LEU MD1 1 72 LEU MD2 2.065 . 2.598 2.065 2.032 2.096 . 0 0 "[ . 1 . 2 .]" 1
1019 1 72 LEU MD1 1 73 ASN H 4.890 . 7.879 5.046 4.727 5.506 . 0 0 "[ . 1 . 2 .]" 1
1020 1 72 LEU MD1 1 75 PRO HA 3.602 . 5.224 4.307 2.908 5.196 . 0 0 "[ . 1 . 2 .]" 1
1021 1 72 LEU MD1 1 79 ASN HD21 4.524 2.966 6.082 5.069 3.392 6.162 0.080 21 0 "[ . 1 . 2 .]" 1
1022 1 72 LEU MD1 1 83 TYR QD 3.648 2.487 4.809 4.805 4.554 4.960 0.151 23 0 "[ . 1 . 2 .]" 1
1023 1 72 LEU MD1 1 102 PHE QE 3.738 . 5.485 3.861 2.188 5.563 0.078 15 0 "[ . 1 . 2 .]" 1
1024 1 72 LEU MD2 1 72 LEU HG 2.028 . 2.542 2.104 2.091 2.122 . 0 0 "[ . 1 . 2 .]" 1
1025 1 72 LEU MD2 1 73 ASN H 4.336 . 6.686 4.542 3.700 5.102 . 0 0 "[ . 1 . 2 .]" 1
1026 1 72 LEU MD2 1 73 ASN HA 5.770 . 9.932 6.278 5.824 6.635 . 0 0 "[ . 1 . 2 .]" 1
1027 1 72 LEU MD2 1 75 PRO HA 2.886 . 3.927 3.240 2.390 3.956 0.029 8 0 "[ . 1 . 2 .]" 1
1028 1 72 LEU MD2 1 79 ASN HD21 3.289 . 4.641 3.426 2.506 4.139 . 0 0 "[ . 1 . 2 .]" 1
1029 1 73 ASN H 1 73 ASN HB2 2.774 . 3.736 2.638 2.316 3.692 . 0 0 "[ . 1 . 2 .]" 1
1030 1 73 ASN H 1 73 ASN HB3 3.404 . 4.852 2.811 2.417 3.672 . 0 0 "[ . 1 . 2 .]" 1
1031 1 73 ASN H 1 74 GLN H 3.589 2.617 4.561 2.582 2.516 2.669 0.101 7 0 "[ . 1 . 2 .]" 1
1032 1 73 ASN HA 1 74 GLN H 3.267 . 4.601 3.509 3.348 3.554 . 0 0 "[ . 1 . 2 .]" 1
1033 1 73 ASN HB2 1 73 ASN HD21 3.371 . 4.792 2.715 2.203 3.547 . 0 0 "[ . 1 . 2 .]" 1
1034 1 73 ASN HB2 1 74 GLN H 3.057 2.174 3.940 3.521 2.242 4.023 0.083 21 0 "[ . 1 . 2 .]" 1
1035 1 73 ASN HB3 1 73 ASN HD21 4.083 . 6.167 2.690 2.174 3.517 . 0 0 "[ . 1 . 2 .]" 1
1036 1 73 ASN HB3 1 74 GLN H 3.950 . 5.900 2.910 2.200 4.146 . 0 0 "[ . 1 . 2 .]" 1
1037 1 74 GLN H 1 74 GLN HA 2.872 . 3.903 2.907 2.884 2.927 . 0 0 "[ . 1 . 2 .]" 1
1038 1 74 GLN H 1 74 GLN HB2 3.050 . 4.213 2.908 2.479 3.831 . 0 0 "[ . 1 . 2 .]" 1
1039 1 74 GLN H 1 74 GLN HB3 4.132 . 6.267 3.113 2.530 3.786 . 0 0 "[ . 1 . 2 .]" 1
1040 1 74 GLN H 1 74 GLN HG2 3.480 2.294 4.666 4.006 2.426 4.945 0.279 12 0 "[ . 1 . 2 .]" 1
1041 1 74 GLN H 1 74 GLN HG3 4.458 . 6.943 4.362 2.979 4.919 . 0 0 "[ . 1 . 2 .]" 1
1042 1 74 GLN HA 1 74 GLN HB3 2.829 . 3.829 2.806 2.479 3.034 . 0 0 "[ . 1 . 2 .]" 1
1043 1 74 GLN HA 1 74 GLN HG2 3.627 . 5.272 3.101 2.528 3.816 . 0 0 "[ . 1 . 2 .]" 1
1044 1 74 GLN HB2 1 74 GLN HG2 2.582 . 3.415 2.695 2.389 3.018 . 0 0 "[ . 1 . 2 .]" 1
1045 1 74 GLN HB2 1 74 GLN HG3 2.931 . 4.005 2.514 2.346 3.016 . 0 0 "[ . 1 . 2 .]" 1
1046 1 74 GLN HB3 1 74 GLN HG2 2.981 . 4.092 2.673 2.411 3.021 . 0 0 "[ . 1 . 2 .]" 1
1047 1 74 GLN HB3 1 74 GLN HG3 2.633 . 3.500 2.694 2.390 3.015 . 0 0 "[ . 1 . 2 .]" 1
1048 1 74 GLN HE21 1 74 GLN HG3 3.342 . 5.699 2.897 2.203 3.517 . 0 0 "[ . 1 . 2 .]" 1
1049 1 74 GLN HE22 1 74 GLN HG2 3.693 . 6.446 3.749 3.433 4.073 . 0 0 "[ . 1 . 2 .]" 1
1050 1 74 GLN HE22 1 74 GLN HG3 3.685 . 6.429 3.776 3.467 4.059 . 0 0 "[ . 1 . 2 .]" 1
1051 1 75 PRO HA 1 76 THR H 2.307 . 2.972 2.180 2.103 2.377 . 0 0 "[ . 1 . 2 .]" 1
1052 1 75 PRO HA 1 76 THR MG 3.156 . 4.401 3.854 3.553 4.100 . 0 0 "[ . 1 . 2 .]" 1
1053 1 76 THR H 1 76 THR HA 2.975 . 4.082 2.921 2.896 2.951 . 0 0 "[ . 1 . 2 .]" 1
1054 1 76 THR H 1 76 THR HB 3.861 . 5.724 3.684 3.540 3.798 . 0 0 "[ . 1 . 2 .]" 1
1055 1 76 THR H 1 76 THR MG 2.582 . 3.415 3.036 2.461 3.358 . 0 0 "[ . 1 . 2 .]" 1
1056 1 76 THR H 1 79 ASN H 3.391 . 4.828 3.906 3.417 4.529 . 0 0 "[ . 1 . 2 .]" 1
1057 1 76 THR H 1 79 ASN HB2 3.116 . 4.329 3.099 2.079 3.870 . 0 0 "[ . 1 . 2 .]" 1
1058 1 76 THR H 1 79 ASN HB3 3.921 . 5.843 4.369 3.554 5.483 . 0 0 "[ . 1 . 2 .]" 1
1059 1 76 THR H 1 102 PHE HB2 4.307 . 6.626 5.100 3.547 6.590 . 0 0 "[ . 1 . 2 .]" 1
1060 1 76 THR HA 1 76 THR HB 2.781 . 3.748 2.563 2.476 2.616 . 0 0 "[ . 1 . 2 .]" 1
1061 1 76 THR HA 1 76 THR MG 2.235 . 2.859 2.310 2.256 2.376 . 0 0 "[ . 1 . 2 .]" 1
1062 1 76 THR HA 1 77 HIS H 3.266 . 4.600 2.399 2.119 2.733 . 0 0 "[ . 1 . 2 .]" 1
1063 1 76 THR HA 1 78 VAL H 3.999 . 5.998 4.087 3.695 4.588 . 0 0 "[ . 1 . 2 .]" 1
1064 1 76 THR HA 1 79 ASN H 4.917 . 7.939 4.845 4.591 5.103 . 0 0 "[ . 1 . 2 .]" 1
1065 1 76 THR HB 1 76 THR MG 1.926 . 2.389 2.144 2.131 2.151 . 0 0 "[ . 1 . 2 .]" 1
1066 1 76 THR HB 1 78 VAL H 2.670 . 3.561 2.696 2.279 3.160 . 0 0 "[ . 1 . 2 .]" 1
1067 1 76 THR MG 1 78 VAL H 4.183 . 6.370 4.266 3.985 4.600 . 0 0 "[ . 1 . 2 .]" 1
1068 1 77 HIS H 1 77 HIS HA 2.989 . 4.106 2.845 2.755 2.903 . 0 0 "[ . 1 . 2 .]" 1
1069 1 77 HIS H 1 77 HIS QB 4.684 . 7.426 2.606 2.464 2.754 . 0 0 "[ . 1 . 2 .]" 1
1070 1 77 HIS H 1 78 VAL H 2.773 . 3.734 2.658 2.382 2.986 . 0 0 "[ . 1 . 2 .]" 1
1071 1 77 HIS HA 1 77 HIS QB 2.357 . 3.051 2.181 2.143 2.203 . 0 0 "[ . 1 . 2 .]" 1
1072 1 77 HIS HA 1 77 HIS HD2 4.578 . 7.197 4.513 4.212 4.752 . 0 0 "[ . 1 . 2 .]" 1
1073 1 77 HIS HA 1 80 ASN QD 4.033 2.766 4.962 3.903 2.281 4.772 0.485 19 0 "[ . 1 . 2 .]" 1
1074 1 77 HIS QB 1 78 VAL H 3.888 . 5.777 3.827 3.544 3.958 . 0 0 "[ . 1 . 2 .]" 1
1075 1 77 HIS QB 1 79 ASN HB2 5.137 . 8.436 6.140 5.726 6.770 . 0 0 "[ . 1 . 2 .]" 1
1076 1 77 HIS QB 1 80 ASN QD 3.516 . 5.062 3.803 2.666 4.575 . 0 0 "[ . 1 . 2 .]" 1
1077 1 77 HIS QB 1 105 ASN HA 3.882 . 5.766 3.416 1.951 5.536 0.047 10 0 "[ . 1 . 2 .]" 1
1078 1 77 HIS HD2 1 78 VAL HA 3.588 . 5.198 4.494 3.476 5.361 0.163 9 0 "[ . 1 . 2 .]" 1
1079 1 77 HIS HE1 1 106 PRO HG2 5.075 3.294 6.856 5.671 3.930 7.669 0.813 13 1 "[ . 1 + . 2 .]" 1
1080 1 78 VAL H 1 78 VAL HA 2.773 . 3.734 2.852 2.741 2.906 . 0 0 "[ . 1 . 2 .]" 1
1081 1 78 VAL H 1 78 VAL HB 2.981 . 4.092 3.688 3.647 3.723 . 0 0 "[ . 1 . 2 .]" 1
1082 1 78 VAL H 1 79 ASN H 2.394 . 3.111 2.461 2.293 2.737 . 0 0 "[ . 1 . 2 .]" 1
1083 1 78 VAL H 1 80 ASN H 3.746 . 5.500 4.533 3.855 4.917 . 0 0 "[ . 1 . 2 .]" 1
1084 1 78 VAL HA 1 78 VAL HB 2.319 . 2.991 2.486 2.391 2.544 . 0 0 "[ . 1 . 2 .]" 1
1085 1 78 VAL HA 1 79 ASN H 3.291 . 4.645 3.334 3.273 3.447 . 0 0 "[ . 1 . 2 .]" 1
1086 1 78 VAL HA 1 80 ASN H 3.197 . 4.474 3.510 3.194 3.880 . 0 0 "[ . 1 . 2 .]" 1
1087 1 79 ASN H 1 79 ASN HA 2.853 . 3.870 2.893 2.862 2.955 . 0 0 "[ . 1 . 2 .]" 1
1088 1 79 ASN H 1 79 ASN HB2 2.709 . 3.627 2.457 2.340 2.572 . 0 0 "[ . 1 . 2 .]" 1
1089 1 79 ASN H 1 79 ASN HB3 3.534 . 5.095 3.640 3.586 3.734 . 0 0 "[ . 1 . 2 .]" 1
1090 1 79 ASN H 1 102 PHE HB2 4.266 . 6.541 5.166 3.683 7.085 0.544 19 1 "[ . 1 . +2 .]" 1
1091 1 79 ASN HA 1 79 ASN HD21 2.646 . 3.521 2.353 1.762 3.659 0.138 14 0 "[ . 1 . 2 .]" 1
1092 1 79 ASN HA 1 79 ASN HD22 4.705 . 7.472 3.640 3.313 4.178 . 0 0 "[ . 1 . 2 .]" 1
1093 1 79 ASN HA 1 80 ASN H 2.854 . 3.872 2.977 2.818 3.337 . 0 0 "[ . 1 . 2 .]" 1
1094 1 79 ASN HB2 1 79 ASN HD21 3.485 . 5.003 3.179 2.064 3.541 . 0 0 "[ . 1 . 2 .]" 1
1095 1 79 ASN HB2 1 79 ASN HD22 3.853 . 5.709 3.904 3.420 4.076 . 0 0 "[ . 1 . 2 .]" 1
1096 1 79 ASN HB2 1 80 ASN H 3.630 . 5.277 3.946 3.185 4.315 . 0 0 "[ . 1 . 2 .]" 1
1097 1 79 ASN HB2 1 83 TYR QE 6.436 . 11.613 4.885 4.184 5.469 . 0 0 "[ . 1 . 2 .]" 1
1098 1 79 ASN HB3 1 80 ASN H 3.944 . 5.889 4.330 4.020 4.444 . 0 0 "[ . 1 . 2 .]" 1
1099 1 79 ASN HB3 1 83 TYR QE 4.903 . 7.907 3.582 2.901 4.182 . 0 0 "[ . 1 . 2 .]" 1
1100 1 80 ASN H 1 80 ASN HB2 2.517 . 3.309 2.975 2.421 3.869 0.560 24 2 "[ . 1 . - +.]" 1
1101 1 80 ASN H 1 80 ASN HB3 3.813 . 5.631 3.038 2.345 3.787 . 0 0 "[ . 1 . 2 .]" 1
1102 1 80 ASN H 1 80 ASN QD 4.415 . 6.851 3.920 2.593 4.728 . 0 0 "[ . 1 . 2 .]" 1
1103 1 80 ASN H 1 81 GLY H 4.760 . 7.592 3.948 3.171 4.484 . 0 0 "[ . 1 . 2 .]" 1
1104 1 80 ASN H 1 101 ALA HA 5.003 . 8.132 5.367 4.616 6.160 . 0 0 "[ . 1 . 2 .]" 1
1105 1 80 ASN HA 1 81 GLY H 2.335 . 3.017 2.257 2.083 2.625 . 0 0 "[ . 1 . 2 .]" 1
1106 1 80 ASN HA 1 81 GLY HA2 4.747 . 7.564 4.348 4.273 4.438 . 0 0 "[ . 1 . 2 .]" 1
1107 1 80 ASN HA 1 101 ALA MB 3.350 . 4.753 4.219 3.140 4.797 0.044 19 0 "[ . 1 . 2 .]" 1
1108 1 80 ASN HB2 1 80 ASN QD 4.220 . 4.416 2.584 2.131 3.302 . 0 0 "[ . 1 . 2 .]" 1
1109 1 80 ASN HB2 1 81 GLY H 4.636 . 7.323 4.298 3.375 4.656 . 0 0 "[ . 1 . 2 .]" 1
1110 1 80 ASN HB3 1 81 GLY H 3.536 . 5.099 4.263 3.427 4.576 . 0 0 "[ . 1 . 2 .]" 1
1111 1 80 ASN QD 1 102 PHE H 3.827 2.863 4.791 3.789 2.372 4.627 0.491 13 0 "[ . 1 . 2 .]" 1
1112 1 81 GLY H 1 82 ASN H 4.459 . 6.944 4.263 4.068 4.361 . 0 0 "[ . 1 . 2 .]" 1
1113 1 81 GLY H 1 83 TYR QE 3.565 2.391 4.739 3.157 2.567 4.096 . 0 0 "[ . 1 . 2 .]" 1
1114 1 81 GLY H 1 99 MET HB3 5.266 . 8.732 6.537 5.470 7.215 . 0 0 "[ . 1 . 2 .]" 1
1115 1 81 GLY H 1 99 MET ME 3.507 . 5.044 4.222 3.347 5.068 0.024 16 0 "[ . 1 . 2 .]" 1
1116 1 81 GLY H 1 100 ALA H 3.123 . 4.342 3.428 2.981 3.949 . 0 0 "[ . 1 . 2 .]" 1
1117 1 81 GLY H 1 100 ALA MB 3.199 . 4.478 3.842 3.074 4.315 . 0 0 "[ . 1 . 2 .]" 1
1118 1 81 GLY H 1 101 ALA HA 3.743 . 5.494 4.037 3.151 5.007 . 0 0 "[ . 1 . 2 .]" 1
1119 1 81 GLY HA2 1 82 ASN H 3.120 . 4.336 2.780 2.567 2.982 . 0 0 "[ . 1 . 2 .]" 1
1120 1 81 GLY HA2 1 82 ASN HB3 4.981 . 8.082 5.407 4.823 5.973 . 0 0 "[ . 1 . 2 .]" 1
1121 1 81 GLY HA2 1 99 MET HA 4.828 . 7.742 4.118 3.904 4.250 . 0 0 "[ . 1 . 2 .]" 1
1122 1 81 GLY HA2 1 99 MET HB2 4.428 . 6.879 5.809 4.679 6.745 . 0 0 "[ . 1 . 2 .]" 1
1123 1 81 GLY HA2 1 99 MET ME 2.346 . 3.034 2.529 2.049 3.068 0.034 16 0 "[ . 1 . 2 .]" 1
1124 1 81 GLY HA2 1 100 ALA H 4.819 . 7.722 4.824 4.390 5.342 . 0 0 "[ . 1 . 2 .]" 1
1125 1 81 GLY HA3 1 82 ASN H 2.557 . 3.374 2.302 2.191 2.423 . 0 0 "[ . 1 . 2 .]" 1
1126 1 81 GLY HA3 1 82 ASN HA 4.646 . 7.345 4.442 4.382 4.502 . 0 0 "[ . 1 . 2 .]" 1
1127 1 81 GLY HA3 1 82 ASN HB3 4.405 . 6.831 5.304 4.611 5.918 . 0 0 "[ . 1 . 2 .]" 1
1128 1 81 GLY HA3 1 99 MET ME 3.657 . 5.329 3.908 3.583 4.426 . 0 0 "[ . 1 . 2 .]" 1
1129 1 81 GLY HA3 1 100 ALA H 4.245 . 6.497 5.215 4.921 5.646 . 0 0 "[ . 1 . 2 .]" 1
1130 1 82 ASN H 1 82 ASN HB3 2.460 . 3.217 3.052 2.400 3.709 0.492 12 0 "[ . 1 . 2 .]" 1
1131 1 82 ASN H 1 99 MET ME 3.065 . 4.239 3.614 2.858 4.013 . 0 0 "[ . 1 . 2 .]" 1
1132 1 82 ASN HA 1 83 TYR H 2.252 . 2.886 2.144 2.054 2.236 . 0 0 "[ . 1 . 2 .]" 1
1133 1 82 ASN HA 1 83 TYR HB3 5.459 . 9.185 5.674 5.542 5.781 . 0 0 "[ . 1 . 2 .]" 1
1134 1 82 ASN HA 1 98 ILE H 3.674 . 5.362 3.272 2.934 3.551 . 0 0 "[ . 1 . 2 .]" 1
1135 1 82 ASN HA 1 98 ILE MD 3.878 . 5.758 5.096 4.709 5.692 . 0 0 "[ . 1 . 2 .]" 1
1136 1 82 ASN HA 1 99 MET HB3 3.709 . 5.429 4.576 3.510 5.411 . 0 0 "[ . 1 . 2 .]" 1
1137 1 82 ASN HA 1 99 MET ME 2.935 . 4.012 3.853 2.963 4.121 0.109 10 0 "[ . 1 . 2 .]" 1
1138 1 82 ASN HB2 1 83 TYR H 4.010 . 6.020 4.300 4.076 4.454 . 0 0 "[ . 1 . 2 .]" 1
1139 1 82 ASN HB3 1 82 ASN QD 3.735 . 5.479 2.698 2.165 3.310 . 0 0 "[ . 1 . 2 .]" 1
1140 1 82 ASN HB3 1 83 TYR H 4.211 . 6.427 3.919 3.292 4.381 . 0 0 "[ . 1 . 2 .]" 1
1141 1 82 ASN HB3 1 83 TYR HA 3.880 . 5.762 4.823 4.452 5.107 . 0 0 "[ . 1 . 2 .]" 1
1142 1 82 ASN HB3 1 99 MET ME 3.905 . 5.811 4.604 3.278 5.621 . 0 0 "[ . 1 . 2 .]" 1
1143 1 82 ASN QD 1 83 TYR HA 4.575 . 7.192 5.894 5.152 6.446 . 0 0 "[ . 1 . 2 .]" 1
1144 1 82 ASN QD 1 97 SER HB3 4.812 . 7.707 3.716 1.924 7.453 . 0 0 "[ . 1 . 2 .]" 1
1145 1 82 ASN QD 1 99 MET ME 4.074 . 4.476 3.595 1.969 4.399 0.030 12 0 "[ . 1 . 2 .]" 1
1146 1 83 TYR H 1 83 TYR HB2 2.843 . 3.854 2.387 2.256 2.548 . 0 0 "[ . 1 . 2 .]" 1
1147 1 83 TYR H 1 83 TYR HB3 3.791 . 5.587 3.603 3.531 3.705 . 0 0 "[ . 1 . 2 .]" 1
1148 1 83 TYR H 1 83 TYR QD 4.009 . 6.018 2.598 2.237 3.545 . 0 0 "[ . 1 . 2 .]" 1
1149 1 83 TYR H 1 83 TYR QE 4.733 . 7.534 4.746 4.399 5.256 . 0 0 "[ . 1 . 2 .]" 1
1150 1 83 TYR H 1 97 SER HA 5.030 . 8.192 4.828 4.382 5.328 . 0 0 "[ . 1 . 2 .]" 1
1151 1 83 TYR H 1 98 ILE H 3.125 . 4.345 3.215 2.760 3.541 . 0 0 "[ . 1 . 2 .]" 1
1152 1 83 TYR H 1 98 ILE MD 3.312 . 4.683 4.363 4.137 4.760 0.077 19 0 "[ . 1 . 2 .]" 1
1153 1 83 TYR HA 1 83 TYR QD 4.133 . 6.268 3.025 2.319 3.256 . 0 0 "[ . 1 . 2 .]" 1
1154 1 83 TYR HA 1 84 THR H 2.339 . 3.023 2.147 2.068 2.247 . 0 0 "[ . 1 . 2 .]" 1
1155 1 83 TYR HB2 1 83 TYR QD 4.227 . 6.460 2.451 2.262 2.649 . 0 0 "[ . 1 . 2 .]" 1
1156 1 83 TYR HB2 1 84 THR MG 5.034 . 8.202 6.457 6.297 6.665 . 0 0 "[ . 1 . 2 .]" 1
1157 1 83 TYR HB2 1 98 ILE MD 2.909 . 3.967 3.866 3.584 4.153 0.186 15 0 "[ . 1 . 2 .]" 1
1158 1 83 TYR HB3 1 83 TYR QD 3.920 . 5.841 2.387 2.237 2.633 . 0 0 "[ . 1 . 2 .]" 1
1159 1 83 TYR HB3 1 83 TYR QE 4.666 . 7.387 4.418 4.352 4.508 . 0 0 "[ . 1 . 2 .]" 1
1160 1 83 TYR HB3 1 84 THR MG 4.665 . 7.385 6.044 5.755 6.226 . 0 0 "[ . 1 . 2 .]" 1
1161 1 83 TYR HB3 1 98 ILE MD 3.709 . 5.429 5.152 4.886 5.387 . 0 0 "[ . 1 . 2 .]" 1
1162 1 83 TYR QD 1 84 THR H 4.934 . 7.976 4.370 3.583 4.859 . 0 0 "[ . 1 . 2 .]" 1
1163 1 83 TYR QD 1 100 ALA H 3.894 . 5.789 2.843 2.206 3.844 . 0 0 "[ . 1 . 2 .]" 1
1164 1 83 TYR QD 1 100 ALA MB 2.995 . 4.116 2.905 2.278 3.612 . 0 0 "[ . 1 . 2 .]" 1
1165 1 83 TYR QE 1 100 ALA MB 3.406 2.583 4.229 2.616 2.447 3.193 0.136 24 0 "[ . 1 . 2 .]" 1
1166 1 84 THR H 1 84 THR HB 2.640 . 3.511 2.569 2.410 2.795 . 0 0 "[ . 1 . 2 .]" 1
1167 1 84 THR HA 1 84 THR MG 2.501 . 3.283 2.382 2.320 2.454 . 0 0 "[ . 1 . 2 .]" 1
1168 1 84 THR HA 1 85 LEU H 2.158 . 2.740 2.156 2.100 2.242 . 0 0 "[ . 1 . 2 .]" 1
1169 1 84 THR HA 1 86 LEU MD1 3.827 . 5.657 4.763 4.583 4.897 . 0 0 "[ . 1 . 2 .]" 1
1170 1 84 THR HA 1 96 ALA H 3.632 . 5.281 4.235 3.854 4.667 . 0 0 "[ . 1 . 2 .]" 1
1171 1 84 THR HA 1 97 SER HA 2.768 . 3.726 2.120 1.927 2.652 . 0 0 "[ . 1 . 2 .]" 1
1172 1 84 THR HB 1 84 THR MG 2.085 . 2.628 2.149 2.141 2.157 . 0 0 "[ . 1 . 2 .]" 1
1173 1 84 THR HB 1 86 LEU MD2 3.383 2.387 4.379 2.896 2.520 3.343 . 0 0 "[ . 1 . 2 .]" 1
1174 1 84 THR MG 1 86 LEU MD2 1.841 . 2.300 2.291 2.164 2.331 0.031 16 0 "[ . 1 . 2 .]" 1
1175 1 84 THR MG 1 95 SER HA 3.466 . 4.968 3.706 3.135 4.211 . 0 0 "[ . 1 . 2 .]" 1
1176 1 84 THR MG 1 95 SER HB2 2.273 . 2.919 2.746 2.316 2.932 0.013 15 0 "[ . 1 . 2 .]" 1
1177 1 84 THR MG 1 96 ALA H 2.537 . 3.341 3.085 2.763 3.357 0.016 22 0 "[ . 1 . 2 .]" 1
1178 1 85 LEU H 1 85 LEU HB2 2.940 . 4.020 2.886 2.809 3.002 . 0 0 "[ . 1 . 2 .]" 1
1179 1 85 LEU H 1 85 LEU HB3 2.075 . 2.613 2.530 2.460 2.608 . 0 0 "[ . 1 . 2 .]" 1
1180 1 85 LEU H 1 85 LEU MD1 3.813 . 5.630 4.226 4.193 4.271 . 0 0 "[ . 1 . 2 .]" 1
1181 1 85 LEU H 1 85 LEU MD2 3.911 . 5.823 4.389 4.314 4.484 . 0 0 "[ . 1 . 2 .]" 1
1182 1 85 LEU H 1 86 LEU MD1 3.258 . 4.585 3.552 3.472 3.699 . 0 0 "[ . 1 . 2 .]" 1
1183 1 85 LEU H 1 86 LEU MD2 3.624 . 5.266 3.898 3.770 4.072 . 0 0 "[ . 1 . 2 .]" 1
1184 1 85 LEU H 1 96 ALA H 2.680 . 3.577 2.870 2.706 3.072 . 0 0 "[ . 1 . 2 .]" 1
1185 1 85 LEU H 1 96 ALA MB 3.121 . 4.339 3.611 3.398 3.959 . 0 0 "[ . 1 . 2 .]" 1
1186 1 85 LEU H 1 97 SER HA 3.805 . 5.615 3.328 3.029 3.967 . 0 0 "[ . 1 . 2 .]" 1
1187 1 85 LEU HA 1 85 LEU MD1 2.133 . 2.702 2.081 2.041 2.129 . 0 0 "[ . 1 . 2 .]" 1
1188 1 85 LEU HA 1 85 LEU MD2 3.708 . 5.426 3.863 3.840 3.894 . 0 0 "[ . 1 . 2 .]" 1
1189 1 85 LEU HA 1 86 LEU H 2.241 . 2.869 2.081 2.046 2.107 . 0 0 "[ . 1 . 2 .]" 1
1190 1 85 LEU HA 1 86 LEU MD1 4.197 . 6.399 4.593 4.356 4.765 . 0 0 "[ . 1 . 2 .]" 1
1191 1 85 LEU HA 1 86 LEU MD2 2.890 . 3.934 3.040 2.879 3.149 . 0 0 "[ . 1 . 2 .]" 1
1192 1 85 LEU HB2 1 85 LEU MD1 2.292 . 2.949 2.305 2.270 2.326 . 0 0 "[ . 1 . 2 .]" 1
1193 1 85 LEU HB2 1 85 LEU MD2 2.234 . 2.858 2.367 2.340 2.401 . 0 0 "[ . 1 . 2 .]" 1
1194 1 85 LEU HB2 1 86 LEU MD1 4.245 . 6.498 6.117 5.861 6.310 . 0 0 "[ . 1 . 2 .]" 1
1195 1 85 LEU HB3 1 85 LEU MD2 1.859 . 2.291 2.304 2.294 2.318 0.027 5 0 "[ . 1 . 2 .]" 1
1196 1 85 LEU HB3 1 85 LEU HG 2.397 . 3.115 2.460 2.443 2.479 . 0 0 "[ . 1 . 2 .]" 1
1197 1 85 LEU MD1 1 85 LEU MD2 2.079 . 2.391 2.033 2.014 2.050 . 0 0 "[ . 1 . 2 .]" 1
1198 1 85 LEU MD1 1 85 LEU HG 2.023 . 2.352 2.111 2.103 2.117 . 0 0 "[ . 1 . 2 .]" 1
1199 1 85 LEU MD1 1 86 LEU H 2.589 . 3.427 2.440 2.241 2.562 . 0 0 "[ . 1 . 2 .]" 1
1200 1 85 LEU MD1 1 86 LEU HA 4.185 . 6.374 4.530 4.413 4.621 . 0 0 "[ . 1 . 2 .]" 1
1201 1 85 LEU MD1 1 87 ALA MB 3.160 . 4.408 4.085 3.780 4.382 . 0 0 "[ . 1 . 2 .]" 1
1202 1 85 LEU MD2 1 85 LEU HG 1.698 . 2.059 2.109 2.103 2.115 0.056 5 0 "[ . 1 . 2 .]" 1
1203 1 85 LEU MD2 1 86 LEU H 4.073 . 6.147 4.679 4.535 4.783 . 0 0 "[ . 1 . 2 .]" 1
1204 1 86 LEU H 1 86 LEU HB2 2.393 . 3.109 2.506 2.426 2.612 . 0 0 "[ . 1 . 2 .]" 1
1205 1 86 LEU H 1 86 LEU HB3 3.699 . 5.410 3.666 3.618 3.717 . 0 0 "[ . 1 . 2 .]" 1
1206 1 86 LEU H 1 86 LEU MD1 3.086 . 4.277 3.619 3.507 3.700 . 0 0 "[ . 1 . 2 .]" 1
1207 1 86 LEU H 1 86 LEU MD2 2.511 . 3.299 2.287 2.190 2.377 . 0 0 "[ . 1 . 2 .]" 1
1208 1 86 LEU H 1 86 LEU HG 3.310 . 5.031 4.229 4.167 4.274 . 0 0 "[ . 1 . 2 .]" 1
1209 1 86 LEU HA 1 86 LEU HB3 2.844 . 3.855 2.489 2.441 2.516 . 0 0 "[ . 1 . 2 .]" 1
1210 1 86 LEU HA 1 86 LEU MD1 2.016 . 2.524 2.176 2.142 2.240 . 0 0 "[ . 1 . 2 .]" 1
1211 1 86 LEU HA 1 86 LEU MD2 2.979 . 4.088 3.173 3.062 3.286 . 0 0 "[ . 1 . 2 .]" 1
1212 1 86 LEU HA 1 87 ALA H 2.278 . 2.927 2.157 2.125 2.209 . 0 0 "[ . 1 . 2 .]" 1
1213 1 86 LEU HA 1 87 ALA HA 4.021 . 6.042 4.393 4.343 4.438 . 0 0 "[ . 1 . 2 .]" 1
1214 1 86 LEU HA 1 87 ALA MB 3.571 2.233 4.909 4.009 3.895 4.086 . 0 0 "[ . 1 . 2 .]" 1
1215 1 86 LEU HA 1 95 SER HA 2.770 . 3.729 2.639 2.405 2.842 . 0 0 "[ . 1 . 2 .]" 1
1216 1 86 LEU HA 1 95 SER HB2 3.688 . 5.388 4.114 3.358 4.600 . 0 0 "[ . 1 . 2 .]" 1
1217 1 86 LEU HB2 1 86 LEU MD1 2.635 . 3.503 3.202 3.179 3.216 . 0 0 "[ . 1 . 2 .]" 1
1218 1 86 LEU HB2 1 86 LEU MD2 2.050 . 2.575 2.325 2.294 2.354 . 0 0 "[ . 1 . 2 .]" 1
1219 1 86 LEU HB2 1 86 LEU HG 2.590 . 3.365 2.470 2.453 2.490 . 0 0 "[ . 1 . 2 .]" 1
1220 1 86 LEU HB2 1 95 SER H 5.263 . 8.725 7.882 7.617 8.058 . 0 0 "[ . 1 . 2 .]" 1
1221 1 86 LEU HB2 1 95 SER HA 4.462 . 6.950 5.550 5.331 5.814 . 0 0 "[ . 1 . 2 .]" 1
1222 1 86 LEU HB3 1 86 LEU MD1 2.291 . 2.947 2.462 2.413 2.488 . 0 0 "[ . 1 . 2 .]" 1
1223 1 86 LEU HB3 1 86 LEU MD2 2.541 . 3.348 3.209 3.188 3.225 . 0 0 "[ . 1 . 2 .]" 1
1224 1 86 LEU HB3 1 86 LEU HG 2.558 . 3.253 2.346 2.320 2.375 . 0 0 "[ . 1 . 2 .]" 1
1225 1 86 LEU HB3 1 87 ALA HA 3.581 . 5.184 4.340 4.202 4.504 . 0 0 "[ . 1 . 2 .]" 1
1226 1 86 LEU MD1 1 86 LEU MD2 1.825 . 2.242 2.086 2.055 2.109 . 0 0 "[ . 1 . 2 .]" 1
1227 1 86 LEU MD1 1 93 GLN HE21 3.594 . 5.209 2.857 1.863 4.251 0.116 9 0 "[ . 1 . 2 .]" 1
1228 1 86 LEU MD1 1 93 GLN HE22 2.938 . 4.017 3.207 2.213 3.883 . 0 0 "[ . 1 . 2 .]" 1
1229 1 86 LEU MD1 1 93 GLN HG2 2.885 . 3.925 3.180 2.675 3.917 . 0 0 "[ . 1 . 2 .]" 1
1230 1 86 LEU MD1 1 93 GLN HG3 3.373 . 4.795 3.851 3.223 4.377 . 0 0 "[ . 1 . 2 .]" 1
1231 1 86 LEU MD1 1 95 SER H 4.420 . 6.862 4.655 4.363 5.051 . 0 0 "[ . 1 . 2 .]" 1
1232 1 86 LEU MD1 1 95 SER HA 2.564 . 3.386 2.824 2.522 3.405 0.019 4 0 "[ . 1 . 2 .]" 1
1233 1 86 LEU MD1 1 95 SER HB2 2.304 . 2.968 2.554 2.250 2.863 . 0 0 "[ . 1 . 2 .]" 1
1234 1 86 LEU MD1 1 95 SER HB3 1.953 . 2.430 2.021 1.855 2.200 . 0 0 "[ . 1 . 2 .]" 1
1235 1 86 LEU MD1 1 96 ALA H 3.578 . 5.178 3.860 3.595 4.268 . 0 0 "[ . 1 . 2 .]" 1
1236 1 86 LEU MD2 1 93 GLN HE21 4.678 . 7.414 5.004 4.158 6.271 . 0 0 "[ . 1 . 2 .]" 1
1237 1 86 LEU MD2 1 93 GLN HG2 4.366 . 6.748 5.641 5.205 6.227 . 0 0 "[ . 1 . 2 .]" 1
1238 1 86 LEU MD2 1 93 GLN HG3 4.286 . 6.583 5.790 5.400 6.242 . 0 0 "[ . 1 . 2 .]" 1
1239 1 86 LEU MD2 1 95 SER HA 3.591 . 5.203 4.394 4.097 4.866 . 0 0 "[ . 1 . 2 .]" 1
1240 1 86 LEU HG 1 87 ALA H 4.843 . 7.775 5.271 5.122 5.582 . 0 0 "[ . 1 . 2 .]" 1
1241 1 87 ALA H 1 87 ALA MB 2.190 . 2.790 2.478 2.404 2.566 . 0 0 "[ . 1 . 2 .]" 1
1242 1 87 ALA H 1 93 GLN HA 3.426 . 4.893 3.151 2.722 3.605 . 0 0 "[ . 1 . 2 .]" 1
1243 1 87 ALA H 1 94 ALA H 2.837 . 3.843 2.882 2.666 3.179 . 0 0 "[ . 1 . 2 .]" 1
1244 1 87 ALA H 1 94 ALA MB 2.789 . 3.761 3.299 3.038 3.637 . 0 0 "[ . 1 . 2 .]" 1
1245 1 87 ALA HA 1 87 ALA MB 1.911 . 2.367 2.148 2.138 2.157 . 0 0 "[ . 1 . 2 .]" 1
1246 1 87 ALA HA 1 88 ALA H 2.111 . 2.668 2.125 2.072 2.173 . 0 0 "[ . 1 . 2 .]" 1
1247 1 87 ALA HA 1 88 ALA MB 3.390 . 4.826 3.966 3.905 4.001 . 0 0 "[ . 1 . 2 .]" 1
1248 1 87 ALA MB 1 88 ALA H 3.034 . 4.184 3.211 3.158 3.256 . 0 0 "[ . 1 . 2 .]" 1
1249 1 87 ALA MB 1 94 ALA MB 2.092 . 2.493 2.300 2.045 2.513 0.020 7 0 "[ . 1 . 2 .]" 1
1250 1 88 ALA H 1 88 ALA MB 2.087 . 2.631 2.422 2.273 2.520 . 0 0 "[ . 1 . 2 .]" 1
1251 1 88 ALA HA 1 88 ALA MB 2.011 . 2.517 2.127 2.118 2.137 . 0 0 "[ . 1 . 2 .]" 1
1252 1 88 ALA HA 1 89 ASN H 2.145 . 2.720 2.112 2.034 2.190 . 0 0 "[ . 1 . 2 .]" 1
1253 1 88 ALA HA 1 93 GLN H 4.184 . 6.372 4.810 4.356 5.253 . 0 0 "[ . 1 . 2 .]" 1
1254 1 88 ALA HA 1 93 GLN HB2 3.235 . 4.543 3.228 2.779 4.148 . 0 0 "[ . 1 . 2 .]" 1
1255 1 88 ALA MB 1 89 ASN H 2.613 . 3.466 3.095 2.945 3.298 . 0 0 "[ . 1 . 2 .]" 1
1256 1 88 ALA MB 1 92 GLY H 4.181 . 6.366 5.441 4.743 6.424 0.058 8 0 "[ . 1 . 2 .]" 1
1257 1 88 ALA MB 1 93 GLN HA 3.173 . 4.431 3.631 2.906 4.438 0.007 21 0 "[ . 1 . 2 .]" 1
1258 1 88 ALA MB 1 93 GLN HB2 3.140 . 4.373 3.222 2.398 3.809 . 0 0 "[ . 1 . 2 .]" 1
1259 1 88 ALA MB 1 93 GLN HB3 3.529 . 5.086 4.570 3.799 5.157 0.071 22 0 "[ . 1 . 2 .]" 1
1260 1 88 ALA MB 1 93 GLN HG2 3.845 . 5.693 4.236 3.476 5.014 . 0 0 "[ . 1 . 2 .]" 1
1261 1 88 ALA MB 1 93 GLN HG3 2.864 . 3.889 2.762 2.108 3.649 . 0 0 "[ . 1 . 2 .]" 1
1262 1 89 ASN H 1 89 ASN HB3 3.373 . 4.795 3.122 2.451 3.436 . 0 0 "[ . 1 . 2 .]" 1
1263 1 89 ASN H 1 92 GLY H 2.963 . 4.060 3.206 2.776 4.068 0.008 8 0 "[ . 1 . 2 .]" 1
1264 1 89 ASN HB2 1 91 CYS HB3 4.325 . 6.663 5.192 4.532 6.984 0.321 11 0 "[ . 1 . 2 .]" 1
1265 1 89 ASN HB3 1 89 ASN HD21 4.130 . 6.262 2.633 2.227 3.507 . 0 0 "[ . 1 . 2 .]" 1
1266 1 89 ASN HB3 1 89 ASN HD22 3.463 . 4.962 3.654 3.473 4.043 . 0 0 "[ . 1 . 2 .]" 1
1267 1 89 ASN HB3 1 91 CYS HB3 4.838 . 7.764 5.193 3.176 7.344 . 0 0 "[ . 1 . 2 .]" 1
1268 1 89 ASN HB3 1 92 GLY HA2 5.008 . 8.142 6.555 4.703 7.634 . 0 0 "[ . 1 . 2 .]" 1
1269 1 89 ASN HD21 1 92 GLY HA3 5.523 . 9.336 7.495 5.092 8.414 . 0 0 "[ . 1 . 2 .]" 1
1270 1 90 PRO HA 1 90 PRO HB3 2.727 . 3.657 2.304 2.248 2.341 . 0 0 "[ . 1 . 2 .]" 1
1271 1 90 PRO HB3 1 91 CYS H 3.317 . 4.693 4.103 3.904 4.346 . 0 0 "[ . 1 . 2 .]" 1
1272 1 91 CYS H 1 91 CYS HA 2.888 . 3.930 2.860 2.784 2.911 . 0 0 "[ . 1 . 2 .]" 1
1273 1 91 CYS H 1 91 CYS HB2 2.791 . 3.765 2.707 2.374 3.689 . 0 0 "[ . 1 . 2 .]" 1
1274 1 91 CYS H 1 91 CYS HB3 2.423 . 3.157 2.616 2.327 3.623 0.466 25 0 "[ . 1 . 2 .]" 1
1275 1 91 CYS H 1 92 GLY H 2.527 . 3.325 2.551 2.216 2.788 . 0 0 "[ . 1 . 2 .]" 1
1276 1 91 CYS H 1 92 GLY HA2 5.262 . 8.723 4.982 4.854 5.142 . 0 0 "[ . 1 . 2 .]" 1
1277 1 91 CYS H 1 92 GLY HA3 4.515 . 7.063 5.134 4.825 5.353 . 0 0 "[ . 1 . 2 .]" 1
1278 1 91 CYS HA 1 92 GLY H 3.941 . 5.882 3.514 3.362 3.612 . 0 0 "[ . 1 . 2 .]" 1
1279 1 91 CYS HB2 1 92 GLY H 4.198 . 6.401 3.984 2.586 4.342 . 0 0 "[ . 1 . 2 .]" 1
1280 1 91 CYS HB3 1 92 GLY H 2.711 . 3.629 3.090 2.553 4.018 0.389 25 0 "[ . 1 . 2 .]" 1
1281 1 92 GLY H 1 92 GLY HA2 2.898 . 3.948 2.681 2.500 2.889 . 0 0 "[ . 1 . 2 .]" 1
1282 1 92 GLY H 1 92 GLY HA3 2.779 . 3.745 2.852 2.725 2.928 . 0 0 "[ . 1 . 2 .]" 1
1283 1 92 GLY H 1 93 GLN HA 3.613 . 5.245 4.592 4.356 4.891 . 0 0 "[ . 1 . 2 .]" 1
1284 1 92 GLY HA2 1 93 GLN H 2.641 . 3.513 2.593 2.103 2.959 . 0 0 "[ . 1 . 2 .]" 1
1285 1 92 GLY HA2 1 93 GLN HA 4.524 . 7.082 4.397 4.293 4.507 . 0 0 "[ . 1 . 2 .]" 1
1286 1 92 GLY HA3 1 93 GLN H 3.614 . 5.247 2.495 2.182 3.106 . 0 0 "[ . 1 . 2 .]" 1
1287 1 93 GLN H 1 93 GLN HB2 3.697 . 5.406 3.012 2.749 3.234 . 0 0 "[ . 1 . 2 .]" 1
1288 1 93 GLN H 1 93 GLN HB3 2.701 . 3.613 2.579 2.388 2.737 . 0 0 "[ . 1 . 2 .]" 1
1289 1 93 GLN H 1 93 GLN HG2 4.611 . 7.269 4.405 4.275 4.606 . 0 0 "[ . 1 . 2 .]" 1
1290 1 93 GLN H 1 94 ALA H 3.980 . 5.960 3.895 3.805 3.984 . 0 0 "[ . 1 . 2 .]" 1
1291 1 93 GLN HA 1 93 GLN HB2 2.635 . 3.503 2.457 2.369 2.522 . 0 0 "[ . 1 . 2 .]" 1
1292 1 93 GLN HA 1 93 GLN HG2 3.553 . 5.131 3.088 2.562 3.424 . 0 0 "[ . 1 . 2 .]" 1
1293 1 93 GLN HA 1 93 GLN HG3 2.888 . 3.931 2.666 2.537 3.610 . 0 0 "[ . 1 . 2 .]" 1
1294 1 93 GLN HA 1 94 ALA H 2.230 . 2.852 2.112 2.073 2.154 . 0 0 "[ . 1 . 2 .]" 1
1295 1 93 GLN HA 1 94 ALA MB 3.648 . 5.312 3.932 3.876 3.973 . 0 0 "[ . 1 . 2 .]" 1
1296 1 93 GLN HB2 1 94 ALA H 4.666 . 7.388 4.156 4.005 4.281 . 0 0 "[ . 1 . 2 .]" 1
1297 1 93 GLN HB3 1 94 ALA H 4.692 . 7.444 4.115 3.935 4.322 . 0 0 "[ . 1 . 2 .]" 1
1298 1 93 GLN HE22 1 93 GLN HG3 3.445 . 4.929 3.739 3.449 4.052 . 0 0 "[ . 1 . 2 .]" 1
1299 1 93 GLN HG2 1 94 ALA H 3.338 . 4.731 2.992 2.586 3.639 . 0 0 "[ . 1 . 2 .]" 1
1300 1 93 GLN HG2 1 95 SER H 4.063 . 6.127 4.976 4.418 5.468 . 0 0 "[ . 1 . 2 .]" 1
1301 1 93 GLN HG2 1 96 ALA H 4.946 . 8.003 6.978 6.683 7.386 . 0 0 "[ . 1 . 2 .]" 1
1302 1 93 GLN HG3 1 94 ALA H 3.112 . 4.322 3.198 2.800 4.260 . 0 0 "[ . 1 . 2 .]" 1
1303 1 94 ALA H 1 94 ALA HA 2.903 . 3.956 2.942 2.926 2.952 . 0 0 "[ . 1 . 2 .]" 1
1304 1 94 ALA H 1 94 ALA MB 2.174 . 2.765 2.333 2.279 2.404 . 0 0 "[ . 1 . 2 .]" 1
1305 1 94 ALA H 1 95 SER H 4.422 . 6.866 4.481 4.400 4.538 . 0 0 "[ . 1 . 2 .]" 1
1306 1 94 ALA HA 1 94 ALA MB 1.991 . 2.486 2.139 2.131 2.150 . 0 0 "[ . 1 . 2 .]" 1
1307 1 94 ALA HA 1 95 SER H 2.400 . 3.120 2.312 2.231 2.432 . 0 0 "[ . 1 . 2 .]" 1
1308 1 94 ALA MB 1 95 SER H 2.524 . 3.320 2.612 2.435 2.753 . 0 0 "[ . 1 . 2 .]" 1
1309 1 94 ALA MB 1 95 SER HA 4.128 . 5.001 3.837 3.686 3.925 . 0 0 "[ . 1 . 2 .]" 1
1310 1 95 SER H 1 95 SER HA 2.953 . 4.043 2.875 2.818 2.899 . 0 0 "[ . 1 . 2 .]" 1
1311 1 95 SER H 1 95 SER HB3 3.297 . 4.656 3.419 3.311 3.585 . 0 0 "[ . 1 . 2 .]" 1
1312 1 95 SER HA 1 95 SER HB2 2.606 . 3.455 2.529 2.496 2.571 . 0 0 "[ . 1 . 2 .]" 1
1313 1 95 SER HA 1 95 SER HB3 2.680 . 3.578 2.380 2.344 2.420 . 0 0 "[ . 1 . 2 .]" 1
1314 1 95 SER HA 1 96 ALA H 2.254 . 2.889 2.178 2.102 2.282 . 0 0 "[ . 1 . 2 .]" 1
1315 1 95 SER HA 1 96 ALA MB 3.798 . 5.601 3.960 3.861 4.060 . 0 0 "[ . 1 . 2 .]" 1
1316 1 95 SER HB2 1 96 ALA H 2.768 . 3.726 3.067 2.597 3.528 . 0 0 "[ . 1 . 2 .]" 1
1317 1 95 SER HB3 1 96 ALA H 4.115 . 6.232 3.988 3.759 4.240 . 0 0 "[ . 1 . 2 .]" 1
1318 1 96 ALA H 1 96 ALA HA 2.863 . 3.888 2.907 2.855 2.949 . 0 0 "[ . 1 . 2 .]" 1
1319 1 96 ALA H 1 96 ALA MB 2.388 . 3.101 2.592 2.448 2.732 . 0 0 "[ . 1 . 2 .]" 1
1320 1 96 ALA H 1 97 SER H 4.005 . 6.010 4.331 4.171 4.445 . 0 0 "[ . 1 . 2 .]" 1
1321 1 96 ALA HA 1 96 ALA MB 2.066 . 2.600 2.151 2.139 2.163 . 0 0 "[ . 1 . 2 .]" 1
1322 1 96 ALA HA 1 97 SER H 2.306 . 2.971 2.377 2.275 2.506 . 0 0 "[ . 1 . 2 .]" 1
1323 1 96 ALA HA 1 97 SER HB2 5.816 . 10.044 4.756 3.930 5.642 . 0 0 "[ . 1 . 2 .]" 1
1324 1 96 ALA MB 1 97 SER H 2.520 . 3.314 2.640 2.387 2.840 . 0 0 "[ . 1 . 2 .]" 1
1325 1 96 ALA MB 1 97 SER HA 3.581 . 5.184 4.024 3.904 4.169 . 0 0 "[ . 1 . 2 .]" 1
1326 1 96 ALA MB 1 98 ILE HB 3.654 . 5.323 4.779 4.406 5.334 0.011 19 0 "[ . 1 . 2 .]" 1
1327 1 97 SER H 1 97 SER HB2 4.091 . 6.184 3.026 2.596 3.767 . 0 0 "[ . 1 . 2 .]" 1
1328 1 97 SER H 1 97 SER HB3 2.899 . 3.950 3.474 2.578 3.890 . 0 0 "[ . 1 . 2 .]" 1
1329 1 97 SER H 1 98 ILE H 4.689 . 7.438 4.326 4.129 4.449 . 0 0 "[ . 1 . 2 .]" 1
1330 1 97 SER HA 1 97 SER HB2 2.933 . 4.009 2.810 2.439 3.027 . 0 0 "[ . 1 . 2 .]" 1
1331 1 97 SER HA 1 98 ILE H 2.337 . 3.020 2.172 2.054 2.284 . 0 0 "[ . 1 . 2 .]" 1
1332 1 97 SER HA 1 98 ILE HA 4.618 . 7.284 4.392 4.324 4.461 . 0 0 "[ . 1 . 2 .]" 1
1333 1 97 SER HB2 1 98 ILE H 3.525 . 5.078 3.773 2.803 4.468 . 0 0 "[ . 1 . 2 .]" 1
1334 1 97 SER HB3 1 98 ILE H 4.411 . 6.844 3.489 2.903 4.168 . 0 0 "[ . 1 . 2 .]" 1
1335 1 98 ILE H 1 98 ILE HA 2.929 . 4.002 2.904 2.876 2.929 . 0 0 "[ . 1 . 2 .]" 1
1336 1 98 ILE H 1 98 ILE HB 2.900 . 3.952 3.232 2.995 3.578 . 0 0 "[ . 1 . 2 .]" 1
1337 1 98 ILE H 1 98 ILE MD 3.871 . 5.744 4.229 4.152 4.346 . 0 0 "[ . 1 . 2 .]" 1
1338 1 98 ILE H 1 99 MET HB2 5.762 . 9.911 5.341 4.877 6.156 . 0 0 "[ . 1 . 2 .]" 1
1339 1 98 ILE HA 1 98 ILE HB 2.751 . 3.697 2.457 2.313 2.527 . 0 0 "[ . 1 . 2 .]" 1
1340 1 98 ILE HA 1 98 ILE MD 2.643 . 3.516 3.052 2.384 3.306 . 0 0 "[ . 1 . 2 .]" 1
1341 1 98 ILE HA 1 99 MET H 2.254 . 2.889 2.166 2.107 2.270 . 0 0 "[ . 1 . 2 .]" 1
1342 1 98 ILE HA 1 99 MET HB2 4.273 . 6.555 4.461 4.132 4.734 . 0 0 "[ . 1 . 2 .]" 1
1343 1 98 ILE HA 1 99 MET HB3 4.253 . 6.514 4.748 4.555 5.673 . 0 0 "[ . 1 . 2 .]" 1
1344 1 98 ILE HA 1 99 MET ME 4.274 . 6.557 5.463 5.044 5.985 . 0 0 "[ . 1 . 2 .]" 1
1345 1 98 ILE HB 1 99 MET H 3.469 . 4.973 4.251 3.923 4.406 . 0 0 "[ . 1 . 2 .]" 1
1346 1 98 ILE HB 1 99 MET HB3 5.156 . 8.479 6.890 6.488 7.732 . 0 0 "[ . 1 . 2 .]" 1
1347 1 98 ILE MD 1 99 MET H 2.591 . 3.430 2.568 1.984 2.890 . 0 0 "[ . 1 . 2 .]" 1
1348 1 98 ILE MD 1 99 MET HA 2.699 . 3.610 3.435 3.226 3.672 0.062 5 0 "[ . 1 . 2 .]" 1
1349 1 98 ILE MD 1 99 MET HB2 3.583 . 5.188 4.636 4.278 4.836 . 0 0 "[ . 1 . 2 .]" 1
1350 1 99 MET H 1 99 MET HA 2.929 . 4.001 2.923 2.898 2.941 . 0 0 "[ . 1 . 2 .]" 1
1351 1 99 MET H 1 99 MET HB2 2.426 . 3.162 2.808 2.535 3.111 . 0 0 "[ . 1 . 2 .]" 1
1352 1 99 MET H 1 99 MET HB3 2.784 . 3.753 2.671 2.475 3.719 . 0 0 "[ . 1 . 2 .]" 1
1353 1 99 MET H 1 99 MET ME 4.199 . 6.403 5.564 4.553 5.954 . 0 0 "[ . 1 . 2 .]" 1
1354 1 99 MET H 1 99 MET HG3 3.943 . 5.886 4.530 2.699 4.845 . 0 0 "[ . 1 . 2 .]" 1
1355 1 99 MET H 1 100 ALA H 4.443 . 6.911 4.282 4.058 4.478 . 0 0 "[ . 1 . 2 .]" 1
1356 1 99 MET H 1 100 ALA MB 4.217 . 6.440 4.845 4.472 5.175 . 0 0 "[ . 1 . 2 .]" 1
1357 1 99 MET HA 1 99 MET HB2 2.857 . 3.877 2.533 2.417 3.018 . 0 0 "[ . 1 . 2 .]" 1
1358 1 99 MET HA 1 99 MET HB3 2.572 . 3.399 3.000 2.447 3.035 . 0 0 "[ . 1 . 2 .]" 1
1359 1 99 MET HA 1 99 MET ME 3.127 . 4.349 4.080 3.685 4.389 0.040 15 0 "[ . 1 . 2 .]" 1
1360 1 99 MET HA 1 99 MET HG3 2.601 . 3.447 2.846 2.374 3.711 0.264 5 0 "[ . 1 . 2 .]" 1
1361 1 99 MET HA 1 100 ALA H 2.228 . 2.849 2.121 2.029 2.197 . 0 0 "[ . 1 . 2 .]" 1
1362 1 99 MET HA 1 100 ALA MB 3.477 . 4.988 3.960 3.894 4.023 . 0 0 "[ . 1 . 2 .]" 1
1363 1 99 MET HB2 1 100 ALA H 4.079 . 6.158 4.346 4.160 4.547 . 0 0 "[ . 1 . 2 .]" 1
1364 1 99 MET HB2 1 100 ALA MB 4.407 . 6.834 5.779 5.498 5.913 . 0 0 "[ . 1 . 2 .]" 1
1365 1 99 MET HB3 1 100 ALA H 3.749 . 5.506 4.188 3.513 4.412 . 0 0 "[ . 1 . 2 .]" 1
1366 1 99 MET ME 1 99 MET HG3 2.259 . 2.691 2.466 2.300 3.401 0.710 16 1 "[ . 1 .+ 2 .]" 1
1367 1 99 MET ME 1 100 ALA H 3.648 . 5.311 4.550 3.727 5.259 . 0 0 "[ . 1 . 2 .]" 1
1368 1 99 MET HG3 1 100 ALA H 3.353 . 4.758 3.694 2.897 5.172 0.414 16 0 "[ . 1 . 2 .]" 1
1369 1 100 ALA H 1 100 ALA HA 2.977 . 4.085 2.920 2.896 2.936 . 0 0 "[ . 1 . 2 .]" 1
1370 1 100 ALA H 1 100 ALA MB 2.350 . 3.040 2.418 2.272 2.598 . 0 0 "[ . 1 . 2 .]" 1
1371 1 100 ALA H 1 101 ALA H 3.949 . 5.898 4.314 4.154 4.485 . 0 0 "[ . 1 . 2 .]" 1
1372 1 100 ALA HA 1 100 ALA MB 1.903 . 2.356 2.133 2.119 2.154 . 0 0 "[ . 1 . 2 .]" 1
1373 1 100 ALA HA 1 101 ALA H 2.117 . 2.677 2.154 2.026 2.323 . 0 0 "[ . 1 . 2 .]" 1
1374 1 100 ALA HA 1 101 ALA MB 3.377 . 4.802 3.916 3.806 4.025 . 0 0 "[ . 1 . 2 .]" 1
1375 1 100 ALA MB 1 101 ALA H 2.765 . 3.721 2.998 2.543 3.319 . 0 0 "[ . 1 . 2 .]" 1
1376 1 101 ALA H 1 101 ALA HA 2.771 . 3.731 2.915 2.890 2.930 . 0 0 "[ . 1 . 2 .]" 1
1377 1 101 ALA H 1 101 ALA MB 2.031 . 2.546 2.387 2.233 2.563 0.017 23 0 "[ . 1 . 2 .]" 1
1378 1 101 ALA HA 1 101 ALA MB 1.743 . 2.123 2.134 2.118 2.144 0.021 22 0 "[ . 1 . 2 .]" 1
1379 1 101 ALA HA 1 102 PHE H 2.029 . 2.544 2.119 2.035 2.257 . 0 0 "[ . 1 . 2 .]" 1
1380 1 101 ALA HA 1 103 MET H 4.246 2.097 6.395 4.686 3.639 5.819 . 0 0 "[ . 1 . 2 .]" 1
1381 1 101 ALA MB 1 102 PHE H 2.862 2.222 3.502 3.303 2.756 3.487 . 0 0 "[ . 1 . 2 .]" 1
1382 1 101 ALA MB 1 102 PHE HA 3.224 . 4.523 4.251 3.953 4.536 0.013 8 0 "[ . 1 . 2 .]" 1
1383 1 101 ALA MB 1 103 MET H 3.968 2.287 5.649 4.548 3.508 5.399 . 0 0 "[ . 1 . 2 .]" 1
1384 1 101 ALA MB 1 103 MET HA 4.003 . 6.006 4.279 2.927 5.035 . 0 0 "[ . 1 . 2 .]" 1
1385 1 102 PHE H 1 102 PHE HA 2.938 . 4.017 2.879 2.818 2.946 . 0 0 "[ . 1 . 2 .]" 1
1386 1 102 PHE H 1 102 PHE HB2 4.145 . 6.293 2.828 2.440 3.911 . 0 0 "[ . 1 . 2 .]" 1
1387 1 102 PHE H 1 102 PHE HD1 3.460 . 4.957 4.145 2.407 5.175 0.218 13 0 "[ . 1 . 2 .]" 1
1388 1 102 PHE H 1 102 PHE QR 2.823 2.312 3.334 2.783 2.264 3.495 0.161 20 0 "[ . 1 . 2 .]" 1
1389 1 102 PHE H 1 103 MET H 3.427 2.963 3.891 3.101 2.779 3.958 0.184 17 0 "[ . 1 . 2 .]" 1
1390 1 102 PHE HA 1 102 PHE HB2 2.783 . 3.751 2.753 2.373 3.041 . 0 0 "[ . 1 . 2 .]" 1
1391 1 102 PHE HA 1 102 PHE HB3 2.850 . 3.865 2.683 2.366 3.036 . 0 0 "[ . 1 . 2 .]" 1
1392 1 102 PHE HA 1 102 PHE HD1 3.392 . 4.830 2.735 1.961 4.070 . 0 0 "[ . 1 . 2 .]" 1
1393 1 102 PHE HA 1 103 MET H 2.737 . 3.673 3.190 2.026 3.662 . 0 0 "[ . 1 . 2 .]" 1
1394 1 102 PHE HB2 1 102 PHE HD1 3.682 . 5.377 3.139 2.416 3.738 . 0 0 "[ . 1 . 2 .]" 1
1395 1 102 PHE HB3 1 102 PHE QD 3.020 . 4.160 2.449 2.254 2.773 . 0 0 "[ . 1 . 2 .]" 1
1396 1 102 PHE QD 1 103 MET H 4.427 . 6.877 3.842 2.729 4.936 . 0 0 "[ . 1 . 2 .]" 1
1397 1 103 MET H 1 103 MET HA 2.575 . 3.404 2.901 2.848 2.932 . 0 0 "[ . 1 . 2 .]" 1
1398 1 103 MET H 1 103 MET QB . . 3.196 2.833 2.446 3.092 . 0 0 "[ . 1 . 2 .]" 1
1399 1 103 MET H 1 103 MET HG3 2.842 . 3.852 3.298 2.661 4.316 0.464 17 0 "[ . 1 . 2 .]" 1
1400 1 103 MET H 1 104 ASP H 3.997 . 5.994 4.232 3.955 4.453 . 0 0 "[ . 1 . 2 .]" 1
1401 1 103 MET HA 1 103 MET QB 2.655 . 3.442 2.275 2.162 2.435 . 0 0 "[ . 1 . 2 .]" 1
1402 1 103 MET HA 1 103 MET HG3 3.221 . 4.518 3.536 2.502 4.307 . 0 0 "[ . 1 . 2 .]" 1
1403 1 103 MET HA 1 104 ASP H 2.622 2.005 3.239 2.279 2.008 2.658 . 0 0 "[ . 1 . 2 .]" 1
1404 1 103 MET QB 1 103 MET HG3 2.681 . 2.806 2.321 2.153 2.408 . 0 0 "[ . 1 . 2 .]" 1
1405 1 103 MET QB 1 104 ASP H 4.394 . 5.129 2.861 2.027 3.691 . 0 0 "[ . 1 . 2 .]" 1
1406 1 103 MET ME 1 103 MET HG3 3.012 . 4.146 2.715 2.428 3.423 . 0 0 "[ . 1 . 2 .]" 1
1407 1 103 MET HG3 1 104 ASP H 4.999 . 8.123 4.466 2.978 5.763 . 0 0 "[ . 1 . 2 .]" 1
1408 1 104 ASP H 1 104 ASP HB2 2.546 . 3.356 3.045 2.381 3.726 0.370 18 0 "[ . 1 . 2 .]" 1
1409 1 104 ASP H 1 104 ASP HB3 3.837 . 5.677 2.724 2.328 3.723 . 0 0 "[ . 1 . 2 .]" 1
1410 1 104 ASP HA 1 104 ASP HB2 2.843 . 3.853 2.533 2.329 3.033 . 0 0 "[ . 1 . 2 .]" 1
1411 1 104 ASP HA 1 104 ASP HB3 2.297 . 2.957 2.743 2.436 3.034 0.077 2 0 "[ . 1 . 2 .]" 1
1412 1 104 ASP HA 1 105 ASN H 2.266 . 2.908 2.119 1.974 2.271 . 0 0 "[ . 1 . 2 .]" 1
1413 1 104 ASP HB2 1 105 ASN H 4.790 . 7.658 3.626 2.528 4.376 . 0 0 "[ . 1 . 2 .]" 1
1414 1 104 ASP HB3 1 105 ASN H 4.456 . 6.938 3.869 2.371 4.416 . 0 0 "[ . 1 . 2 .]" 1
1415 1 105 ASN H 1 105 ASN HB2 3.438 . 4.915 2.911 2.365 3.792 . 0 0 "[ . 1 . 2 .]" 1
1416 1 105 ASN H 1 105 ASN HB3 2.339 . 3.023 2.827 2.389 3.742 0.719 18 6 "[* . * 1 - + 2 ** .]" 1
1417 1 105 ASN HA 1 105 ASN HB2 2.528 . 3.327 2.583 2.367 3.050 . 0 0 "[ . 1 . 2 .]" 1
1418 1 105 ASN HA 1 105 ASN HB3 2.780 . 3.746 2.792 2.387 3.039 . 0 0 "[ . 1 . 2 .]" 1
1419 1 105 ASN HA 1 106 PRO HD2 2.463 . 3.221 2.450 2.082 2.800 . 0 0 "[ . 1 . 2 .]" 1
1420 1 105 ASN HA 1 106 PRO HD3 1.940 . 2.411 2.080 1.901 2.504 0.093 18 0 "[ . 1 . 2 .]" 1
1421 1 105 ASN HB2 1 105 ASN HD21 3.020 . 4.160 3.012 2.159 3.494 . 0 0 "[ . 1 . 2 .]" 1
1422 1 105 ASN HB2 1 106 PRO HD2 4.363 . 6.742 4.329 3.040 5.268 . 0 0 "[ . 1 . 2 .]" 1
1423 1 105 ASN HB2 1 106 PRO HD3 3.996 . 5.992 4.494 3.529 5.137 . 0 0 "[ . 1 . 2 .]" 1
1424 1 105 ASN HB3 1 106 PRO HD2 4.842 . 7.773 4.446 3.211 5.198 . 0 0 "[ . 1 . 2 .]" 1
1425 1 105 ASN HB3 1 106 PRO HD3 4.648 . 7.349 4.627 3.882 5.147 . 0 0 "[ . 1 . 2 .]" 1
1426 1 106 PRO HA 1 106 PRO HB3 2.139 . 2.711 2.276 2.219 2.329 . 0 0 "[ . 1 . 2 .]" 1
1427 1 106 PRO HA 1 106 PRO HD2 4.031 . 6.063 3.959 3.890 4.095 . 0 0 "[ . 1 . 2 .]" 1
1428 1 106 PRO HA 1 106 PRO HD3 3.958 . 5.916 3.793 3.532 3.987 . 0 0 "[ . 1 . 2 .]" 1
1429 1 106 PRO HA 1 107 PHE H 2.174 . 2.765 2.239 2.077 2.510 . 0 0 "[ . 1 . 2 .]" 1
1430 1 106 PRO HA 1 107 PHE HB2 3.988 . 5.976 4.634 3.920 5.070 . 0 0 "[ . 1 . 2 .]" 1
1431 1 106 PRO HB2 1 106 PRO HD2 3.254 . 4.578 3.271 2.805 4.034 . 0 0 "[ . 1 . 2 .]" 1
1432 1 106 PRO HB2 1 106 PRO HD3 4.103 . 6.207 3.936 3.796 4.084 . 0 0 "[ . 1 . 2 .]" 1
1433 1 106 PRO HB2 1 106 PRO HG2 2.305 . 2.969 2.305 2.252 2.379 . 0 0 "[ . 1 . 2 .]" 1
1434 1 106 PRO HB2 1 107 PHE H 3.973 . 5.946 3.325 2.183 4.070 . 0 0 "[ . 1 . 2 .]" 1
1435 1 106 PRO HB2 1 107 PHE HB2 3.133 . 4.360 4.130 3.533 4.944 0.584 20 1 "[ . 1 . + .]" 1
1436 1 106 PRO HB2 1 107 PHE QD 4.420 . 6.862 4.249 2.274 5.948 . 0 0 "[ . 1 . 2 .]" 1
1437 1 106 PRO HB3 1 106 PRO HD2 4.105 . 6.212 3.913 3.837 3.995 . 0 0 "[ . 1 . 2 .]" 1
1438 1 106 PRO HB3 1 106 PRO HG2 2.777 . 3.741 2.784 2.636 3.003 . 0 0 "[ . 1 . 2 .]" 1
1439 1 106 PRO HB3 1 107 PHE H 4.529 . 7.092 3.484 2.766 4.078 . 0 0 "[ . 1 . 2 .]" 1
1440 1 106 PRO HB3 1 107 PHE HB2 3.597 . 5.215 5.158 4.643 5.675 0.460 20 0 "[ . 1 . 2 .]" 1
1441 1 106 PRO HD2 1 106 PRO HG2 2.410 . 3.136 2.298 2.254 2.342 . 0 0 "[ . 1 . 2 .]" 1
1442 1 106 PRO HD2 1 107 PHE H 4.914 . 7.932 5.253 4.816 5.621 . 0 0 "[ . 1 . 2 .]" 1
1443 1 106 PRO HD3 1 106 PRO HG2 2.725 . 3.653 2.748 2.648 2.988 . 0 0 "[ . 1 . 2 .]" 1
1444 1 106 PRO HD3 1 106 PRO HG3 2.359 . 3.055 2.287 2.244 2.321 . 0 0 "[ . 1 . 2 .]" 1
1445 1 106 PRO HD3 1 107 PHE H 3.971 . 5.942 5.593 5.378 5.759 . 0 0 "[ . 1 . 2 .]" 1
1446 1 107 PHE H 1 107 PHE HA 2.398 . 3.117 2.488 2.192 2.918 . 0 0 "[ . 1 . 2 .]" 1
1447 1 107 PHE H 1 107 PHE HB2 3.599 . 5.218 3.137 2.284 3.638 . 0 0 "[ . 1 . 2 .]" 1
1448 1 107 PHE H 1 107 PHE HB3 3.502 . 5.035 3.671 2.377 4.134 . 0 0 "[ . 1 . 2 .]" 1
1449 1 107 PHE HA 1 107 PHE HB2 2.981 . 4.092 2.794 2.372 3.036 . 0 0 "[ . 1 . 2 .]" 1
1450 1 107 PHE HA 1 107 PHE HB3 2.658 . 3.541 2.723 2.446 3.050 . 0 0 "[ . 1 . 2 .]" 1
1451 1 107 PHE HA 1 107 PHE QD 3.953 . 5.906 2.760 2.519 3.086 . 0 0 "[ . 1 . 2 .]" 1
1452 1 107 PHE HB2 1 107 PHE QD 3.353 . 4.758 2.371 2.254 2.568 . 0 0 "[ . 1 . 2 .]" 1
1453 1 107 PHE HB3 1 107 PHE QD 3.589 . 5.199 2.438 2.281 2.586 . 0 0 "[ . 1 . 2 .]" 1
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