NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
442025 |
2kbz   |
16057 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kbz
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 1526
_Distance_constraint_stats_list.Viol_count 1627
_Distance_constraint_stats_list.Viol_total 2579.257
_Distance_constraint_stats_list.Viol_max 0.967
_Distance_constraint_stats_list.Viol_rms 0.0310
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.0793
_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 3 VAL 0.921 0.921 9 1 "[ . +1 . 2]"
1 4 LYS 1.986 0.887 4 2 "[ +. 1 . -2]"
1 5 ARG 2.309 0.474 4 0 "[ . 1 . 2]"
1 6 LEU 3.035 0.887 4 2 "[ +. 1 . -2]"
1 7 LEU 5.162 0.921 9 1 "[ . +1 . 2]"
1 8 SER 1.811 0.145 16 0 "[ . 1 . 2]"
1 9 ILE 4.963 0.612 1 1 "[+ . 1 . 2]"
1 10 THR 1.370 0.674 13 2 "[ . 1 +-. 2]"
1 11 ASN 5.953 0.324 7 0 "[ . 1 . 2]"
1 12 ASP 2.573 0.197 5 0 "[ . 1 . 2]"
1 13 LYS 1.843 0.324 7 0 "[ . 1 . 2]"
1 14 HIS 4.476 0.674 13 3 "[- . 1 +*. 2]"
1 15 ASP 0.707 0.231 17 0 "[ . 1 . 2]"
1 16 GLU 1.268 0.231 17 0 "[ . 1 . 2]"
1 17 TYR 2.918 0.136 1 0 "[ . 1 . 2]"
1 18 LEU 2.359 0.192 13 0 "[ . 1 . 2]"
1 19 THR 11.280 0.384 15 0 "[ . 1 . 2]"
1 20 GLU 0.316 0.083 15 0 "[ . 1 . 2]"
1 21 MET 6.213 0.777 11 2 "[ . 1+ *. 2]"
1 22 VAL 2.426 0.192 13 0 "[ . 1 . 2]"
1 23 PRO 0.924 0.085 19 0 "[ . 1 . 2]"
1 24 LEU 3.623 0.777 11 2 "[ . 1+ *. 2]"
1 25 LEU 2.431 0.796 9 3 "[ *. +1 .- 2]"
1 26 VAL 1.491 0.407 12 0 "[ . 1 . 2]"
1 27 GLU 2.380 0.125 12 0 "[ . 1 . 2]"
1 28 PHE 2.762 0.158 8 0 "[ . 1 . 2]"
1 29 ALA 1.280 0.116 8 0 "[ . 1 . 2]"
1 30 LYS 4.986 0.810 15 1 "[ . 1 + 2]"
1 31 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 GLU 5.020 0.776 8 2 "[ . + 1 - . 2]"
1 33 CYS 7.549 0.810 15 5 "[ . * 1** + - 2]"
1 34 HIS 0.497 0.116 15 0 "[ . 1 . 2]"
1 35 ASN 5.859 0.967 9 4 "[ . * +1 * . - 2]"
1 36 PRO 4.621 0.474 4 0 "[ . 1 . 2]"
1 37 PHE 4.039 0.605 15 1 "[ . 1 + 2]"
1 38 ILE 2.312 0.474 4 0 "[ . 1 . 2]"
1 39 ASP 2.654 0.151 7 0 "[ . 1 . 2]"
1 40 LYS 0.004 0.004 13 0 "[ . 1 . 2]"
1 41 ASP 1.242 0.171 18 0 "[ . 1 . 2]"
1 42 GLY 3.055 0.151 7 0 "[ . 1 . 2]"
1 43 ASN 1.071 0.171 18 0 "[ . 1 . 2]"
1 44 GLU 0.558 0.078 3 0 "[ . 1 . 2]"
1 45 SER 1.463 0.108 16 0 "[ . 1 . 2]"
1 46 ILE 2.234 0.415 4 0 "[ . 1 . 2]"
1 47 PRO 4.143 0.605 15 1 "[ . 1 + 2]"
1 48 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 GLY 2.975 0.135 18 0 "[ . 1 . 2]"
1 50 VAL 6.488 0.347 19 0 "[ . 1 . 2]"
1 51 LEU 5.014 0.164 10 0 "[ . 1 . 2]"
1 52 ILE 3.211 0.218 15 0 "[ . 1 . 2]"
1 53 PHE 3.927 0.190 13 0 "[ . 1 . 2]"
1 54 VAL 2.045 0.110 9 0 "[ . 1 . 2]"
1 55 ALA 4.199 0.282 13 0 "[ . 1 . 2]"
1 56 LYS 5.515 0.280 12 0 "[ . 1 . 2]"
1 57 ALA 5.516 0.210 8 0 "[ . 1 . 2]"
1 58 ALA 1.277 0.657 4 2 "[ +. 1 .- 2]"
1 59 GLN 0.206 0.051 17 0 "[ . 1 . 2]"
1 60 PHE 0.418 0.042 17 0 "[ . 1 . 2]"
1 61 TYR 3.764 0.894 19 1 "[ . 1 . +2]"
1 62 MET 5.070 0.661 14 1 "[ . 1 +. 2]"
1 63 THR 1.261 0.195 14 0 "[ . 1 . 2]"
1 64 ASN 1.888 0.143 18 0 "[ . 1 . 2]"
1 65 ALA 4.070 0.296 8 0 "[ . 1 . 2]"
1 66 GLY 1.250 0.137 11 0 "[ . 1 . 2]"
1 67 LEU 5.496 0.296 8 0 "[ . 1 . 2]"
1 68 THR 2.727 0.867 20 1 "[ . 1 . +]"
1 69 GLY 5.459 0.218 15 0 "[ . 1 . 2]"
1 70 ARG 3.287 0.867 20 1 "[ . 1 . +]"
1 71 SER 1.360 0.580 17 2 "[ . 1 . + -]"
1 72 MET 1.452 0.212 19 0 "[ . 1 . 2]"
1 73 ASP 1.598 0.833 17 1 "[ . 1 . + 2]"
1 74 THR 0.665 0.109 18 0 "[ . 1 . 2]"
1 75 VAL 6.328 0.833 17 2 "[ . 1 . + *]"
1 76 SER 0.368 0.058 2 0 "[ . 1 . 2]"
1 77 TYR 3.067 0.426 19 0 "[ . 1 . 2]"
1 78 ASN 0.464 0.137 14 0 "[ . 1 . 2]"
1 79 PHE 4.799 0.563 20 3 "[ . * 1 . - +]"
1 80 ALA 0.425 0.079 6 0 "[ . 1 . 2]"
1 81 THR 0.937 0.796 9 1 "[ . +1 . 2]"
1 82 GLU 1.277 0.543 7 1 "[ . + 1 . 2]"
1 83 ILE 5.763 0.384 15 0 "[ . 1 . 2]"
1 84 PRO 3.495 0.894 19 1 "[ . 1 . +2]"
1 86 THR 0.808 0.174 11 0 "[ . 1 . 2]"
1 87 ILE 0.199 0.045 1 0 "[ . 1 . 2]"
1 88 LEU 1.933 0.460 7 0 "[ . 1 . 2]"
1 89 LYS 0.270 0.062 3 0 "[ . 1 . 2]"
1 90 LYS 0.513 0.263 1 0 "[ . 1 . 2]"
1 91 LEU 2.031 0.407 12 0 "[ . 1 . 2]"
1 92 ASN 3.865 0.460 7 0 "[ . 1 . 2]"
1 93 PRO 0.057 0.055 19 0 "[ . 1 . 2]"
1 94 TYR 2.282 0.190 13 0 "[ . 1 . 2]"
1 95 ARG 10.411 0.967 9 5 "[ . * +1** . - 2]"
1 96 LYS 3.514 0.228 2 0 "[ . 1 . 2]"
1 97 MET 1.685 0.230 2 0 "[ . 1 . 2]"
1 98 ALA 0.331 0.078 15 0 "[ . 1 . 2]"
1 99 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 VAL H 1 3 VAL HB 4.160 . 7.810 2.431 2.117 2.722 . 0 0 "[ . 1 . 2]" 1
2 1 3 VAL HA 1 3 VAL MG1 3.420 . 5.950 2.368 2.026 3.255 . 0 0 "[ . 1 . 2]" 1
3 1 3 VAL HA 1 3 VAL MG1 3.270 . 5.580 2.383 2.021 3.008 . 0 0 "[ . 1 . 2]" 1
4 1 3 VAL HA 1 3 VAL MG2 3.340 . 5.820 2.635 2.212 3.280 . 0 0 "[ . 1 . 2]" 1
5 1 3 VAL HA 1 4 LYS QB 4.460 . 6.920 5.590 5.496 5.658 . 0 0 "[ . 1 . 2]" 1
6 1 3 VAL HA 1 5 ARG QG 4.310 . 8.230 6.534 5.504 7.168 . 0 0 "[ . 1 . 2]" 1
7 1 3 VAL HA 1 6 LEU QB 3.950 . 7.330 4.248 3.659 5.503 . 0 0 "[ . 1 . 2]" 1
8 1 3 VAL HA 1 6 LEU MD1 3.570 . 6.330 3.553 2.314 6.319 . 0 0 "[ . 1 . 2]" 1
9 1 3 VAL HA 1 7 LEU MD2 3.540 . 6.180 4.590 4.168 7.101 0.921 9 1 "[ . +1 . 2]" 1
10 1 3 VAL HB 1 7 LEU MD1 3.420 . 5.950 3.279 2.817 3.714 . 0 0 "[ . 1 . 2]" 1
11 1 3 VAL MG2 1 4 LYS H 4.700 . 9.350 3.456 2.279 4.025 . 0 0 "[ . 1 . 2]" 1
12 1 3 VAL MG2 1 5 ARG H 3.770 . 6.300 5.040 4.396 5.337 . 0 0 "[ . 1 . 2]" 1
13 1 3 VAL MG2 1 6 LEU QB 3.620 . 6.380 4.398 3.250 4.957 . 0 0 "[ . 1 . 2]" 1
14 1 4 LYS H 1 4 LYS HA 4.030 2.710 5.350 2.823 2.788 2.841 . 0 0 "[ . 1 . 2]" 1
15 1 4 LYS HA 1 4 LYS QG 3.340 . 5.760 2.366 2.082 2.579 . 0 0 "[ . 1 . 2]" 1
16 1 4 LYS HA 1 6 LEU MD1 3.490 . 6.130 5.546 4.634 7.017 0.887 4 2 "[ +. 1 . -2]" 1
17 1 4 LYS HA 1 7 LEU MD1 3.340 . 5.760 2.797 2.414 3.212 . 0 0 "[ . 1 . 2]" 1
18 1 4 LYS QB 1 4 LYS HE3 3.720 . 6.720 3.400 2.178 4.684 . 0 0 "[ . 1 . 2]" 1
19 1 4 LYS QB 1 5 ARG H 3.180 . 4.980 2.908 2.032 3.507 . 0 0 "[ . 1 . 2]" 1
20 1 4 LYS QB 1 7 LEU H 3.520 . 5.730 4.737 4.454 5.242 . 0 0 "[ . 1 . 2]" 1
21 1 4 LYS QB 1 8 SER HA 2.880 . 4.680 4.643 4.600 4.693 0.013 11 0 "[ . 1 . 2]" 1
22 1 5 ARG H 1 5 ARG HA 3.540 2.390 4.690 2.783 2.721 2.824 . 0 0 "[ . 1 . 2]" 1
23 1 5 ARG H 1 5 ARG QB 3.040 . 4.990 2.220 2.020 2.482 . 0 0 "[ . 1 . 2]" 1
24 1 5 ARG H 1 9 ILE MG 3.950 . 7.330 6.370 5.492 7.036 . 0 0 "[ . 1 . 2]" 1
25 1 5 ARG HA 1 5 ARG QD 3.870 . 7.120 3.788 2.150 4.326 . 0 0 "[ . 1 . 2]" 1
26 1 5 ARG HA 1 5 ARG QG 3.230 . 5.440 2.337 2.112 2.789 . 0 0 "[ . 1 . 2]" 1
27 1 5 ARG HA 1 7 LEU HG 3.800 . 6.920 5.211 4.877 6.990 0.070 9 0 "[ . 1 . 2]" 1
28 1 5 ARG HA 1 8 SER H 2.680 . 3.960 2.405 2.197 2.721 . 0 0 "[ . 1 . 2]" 1
29 1 5 ARG HA 1 9 ILE H 3.930 2.660 5.200 4.485 3.575 5.235 0.035 9 0 "[ . 1 . 2]" 1
30 1 5 ARG QB 1 6 LEU H 3.850 . 6.970 3.112 2.898 3.367 . 0 0 "[ . 1 . 2]" 1
31 1 5 ARG QB 1 6 LEU MD2 3.150 . 5.250 4.409 2.901 5.724 0.474 4 0 "[ . 1 . 2]" 1
32 1 5 ARG QB 1 8 SER H 3.520 . 5.730 5.097 4.898 5.302 . 0 0 "[ . 1 . 2]" 1
33 1 5 ARG QB 1 9 ILE MG 3.690 . 6.570 5.162 3.558 6.003 . 0 0 "[ . 1 . 2]" 1
34 1 5 ARG QD 1 6 LEU HA 3.490 . 6.130 3.886 2.310 4.514 . 0 0 "[ . 1 . 2]" 1
35 1 5 ARG QG 1 6 LEU QB 3.620 . 6.380 5.679 4.881 6.087 . 0 0 "[ . 1 . 2]" 1
36 1 5 ARG QG 1 8 SER HA 3.690 . 6.570 6.577 5.815 6.715 0.145 16 0 "[ . 1 . 2]" 1
37 1 6 LEU H 1 6 LEU HA 3.650 2.450 4.850 2.856 2.812 2.902 . 0 0 "[ . 1 . 2]" 1
38 1 6 LEU H 1 6 LEU MD1 3.870 . 7.120 3.114 1.970 4.164 . 0 0 "[ . 1 . 2]" 1
39 1 6 LEU H 1 6 LEU MD2 3.770 . 6.300 3.119 1.981 3.954 . 0 0 "[ . 1 . 2]" 1
40 1 6 LEU H 1 6 LEU MD2 3.540 . 6.180 2.510 1.634 3.386 . 0 0 "[ . 1 . 2]" 1
41 1 6 LEU H 1 6 LEU MD2 3.620 . 6.380 2.527 1.634 3.453 . 0 0 "[ . 1 . 2]" 1
42 1 6 LEU H 1 7 LEU HG 3.720 . 6.720 4.036 3.658 4.700 . 0 0 "[ . 1 . 2]" 1
43 1 6 LEU HA 1 6 LEU MD1 3.720 . 6.720 3.304 2.041 3.946 . 0 0 "[ . 1 . 2]" 1
44 1 6 LEU HA 1 6 LEU MD2 2.960 . 4.860 3.132 2.121 4.013 . 0 0 "[ . 1 . 2]" 1
45 1 6 LEU HA 1 6 LEU HG 3.190 . 5.390 2.902 2.290 3.685 . 0 0 "[ . 1 . 2]" 1
46 1 6 LEU HA 1 7 LEU H 4.460 3.010 5.910 3.595 3.446 3.734 . 0 0 "[ . 1 . 2]" 1
47 1 6 LEU QB 1 6 LEU MD1 2.960 . 4.860 2.245 2.014 2.555 . 0 0 "[ . 1 . 2]" 1
48 1 6 LEU QB 1 6 LEU MD2 2.810 . 4.550 2.249 2.044 2.530 . 0 0 "[ . 1 . 2]" 1
49 1 6 LEU QB 1 6 LEU MD2 2.880 . 4.680 2.048 1.879 2.391 . 0 0 "[ . 1 . 2]" 1
50 1 6 LEU QB 1 7 LEU H 4.310 . 7.660 2.517 2.207 2.827 . 0 0 "[ . 1 . 2]" 1
51 1 6 LEU QB 1 7 LEU QB 3.540 . 6.180 3.743 3.393 4.068 . 0 0 "[ . 1 . 2]" 1
52 1 6 LEU QB 1 7 LEU MD1 3.040 . 5.040 4.722 2.401 4.933 . 0 0 "[ . 1 . 2]" 1
53 1 6 LEU QB 1 7 LEU MD2 2.880 . 4.650 2.511 2.077 4.120 . 0 0 "[ . 1 . 2]" 1
54 1 6 LEU QB 1 8 SER H 3.860 . 6.500 4.570 4.239 4.935 . 0 0 "[ . 1 . 2]" 1
55 1 6 LEU MD2 1 7 LEU H 3.850 . 7.040 3.378 2.285 3.632 . 0 0 "[ . 1 . 2]" 1
56 1 7 LEU H 1 7 LEU HA 3.870 2.610 5.130 2.892 2.761 2.965 . 0 0 "[ . 1 . 2]" 1
57 1 7 LEU H 1 7 LEU QB 3.570 . 6.370 2.766 2.376 3.070 . 0 0 "[ . 1 . 2]" 1
58 1 7 LEU H 1 7 LEU MD2 3.850 . 6.930 2.372 1.856 4.097 . 0 0 "[ . 1 . 2]" 1
59 1 7 LEU H 1 7 LEU HG 3.950 . 7.330 1.977 1.709 2.683 . 0 0 "[ . 1 . 2]" 1
60 1 7 LEU H 1 8 SER H 3.520 2.460 4.580 2.466 2.342 2.632 0.118 16 0 "[ . 1 . 2]" 1
61 1 7 LEU H 1 11 ASN HD21 2.690 . 4.180 4.216 3.920 4.366 0.186 13 0 "[ . 1 . 2]" 1
62 1 7 LEU HA 1 7 LEU MD1 3.490 . 6.130 4.021 3.639 4.169 . 0 0 "[ . 1 . 2]" 1
63 1 7 LEU HA 1 7 LEU QD 3.110 . 5.210 3.420 2.838 3.526 . 0 0 "[ . 1 . 2]" 1
64 1 7 LEU HA 1 7 LEU MD2 3.080 . 5.130 3.720 2.961 4.037 . 0 0 "[ . 1 . 2]" 1
65 1 7 LEU HA 1 7 LEU MD2 2.880 . 4.680 3.577 2.942 3.810 . 0 0 "[ . 1 . 2]" 1
66 1 7 LEU HA 1 8 SER H 3.690 2.480 4.900 3.537 3.336 3.646 . 0 0 "[ . 1 . 2]" 1
67 1 7 LEU HA 1 9 ILE MD 3.850 . 6.970 6.384 4.772 7.104 0.134 8 0 "[ . 1 . 2]" 1
68 1 7 LEU HA 1 11 ASN HD21 3.690 . 6.570 2.135 1.885 2.821 . 0 0 "[ . 1 . 2]" 1
69 1 7 LEU QB 1 7 LEU MD1 2.960 . 4.890 2.153 2.103 2.197 . 0 0 "[ . 1 . 2]" 1
70 1 7 LEU QB 1 7 LEU MD1 2.850 . 4.560 1.881 1.739 2.154 . 0 0 "[ . 1 . 2]" 1
71 1 7 LEU QB 1 8 SER H 3.420 . 5.950 3.814 3.105 4.018 . 0 0 "[ . 1 . 2]" 1
72 1 7 LEU QB 1 8 SER HA 2.810 . 4.520 3.731 2.914 4.190 . 0 0 "[ . 1 . 2]" 1
73 1 7 LEU QB 1 8 SER HA 3.390 . 5.810 3.965 3.779 4.312 . 0 0 "[ . 1 . 2]" 1
74 1 7 LEU QD 1 8 SER HA 3.190 . 5.400 2.220 1.835 3.004 . 0 0 "[ . 1 . 2]" 1
75 1 7 LEU MD1 1 8 SER H 3.520 . 5.730 3.661 3.008 4.188 . 0 0 "[ . 1 . 2]" 1
76 1 7 LEU MD2 1 8 SER H 3.420 . 5.950 3.605 2.926 5.039 . 0 0 "[ . 1 . 2]" 1
77 1 7 LEU HG 1 8 SER H 3.570 . 6.270 2.687 2.428 4.477 . 0 0 "[ . 1 . 2]" 1
78 1 7 LEU HG 1 9 ILE H 3.020 . 4.640 4.748 4.688 4.845 0.205 9 0 "[ . 1 . 2]" 1
79 1 8 SER H 1 8 SER HA 2.730 . 3.640 2.812 2.734 2.900 . 0 0 "[ . 1 . 2]" 1
80 1 8 SER H 1 9 ILE H 3.270 2.300 4.240 2.506 2.359 2.740 . 0 0 "[ . 1 . 2]" 1
81 1 8 SER H 1 9 ILE HA 3.850 . 6.970 3.976 2.814 4.331 . 0 0 "[ . 1 . 2]" 1
82 1 8 SER H 1 9 ILE HA 3.930 . 7.180 4.626 4.474 4.721 . 0 0 "[ . 1 . 2]" 1
83 1 8 SER H 1 9 ILE QG 4.160 . 7.810 3.243 2.808 3.648 . 0 0 "[ . 1 . 2]" 1
84 1 8 SER HA 1 9 ILE H 3.690 2.480 4.900 3.322 3.121 3.512 . 0 0 "[ . 1 . 2]" 1
85 1 8 SER HA 1 12 ASP H 4.160 2.810 5.510 4.270 3.680 5.557 0.047 7 0 "[ . 1 . 2]" 1
86 1 8 SER QB 1 9 ILE H 2.850 . 4.290 3.341 2.939 3.892 . 0 0 "[ . 1 . 2]" 1
87 1 8 SER QB 1 9 ILE QG 3.230 . 5.490 2.060 1.933 2.370 . 0 0 "[ . 1 . 2]" 1
88 1 9 ILE H 1 9 ILE HA 3.180 2.230 4.130 2.966 2.920 3.010 . 0 0 "[ . 1 . 2]" 1
89 1 9 ILE H 1 9 ILE MD 3.720 . 6.720 4.104 3.396 5.000 . 0 0 "[ . 1 . 2]" 1
90 1 9 ILE H 1 9 ILE QG 3.720 . 6.720 2.630 1.959 4.302 . 0 0 "[ . 1 . 2]" 1
91 1 9 ILE H 1 9 ILE MG 3.490 . 6.080 3.487 2.431 4.074 . 0 0 "[ . 1 . 2]" 1
92 1 9 ILE H 1 12 ASP QB 2.760 . 4.120 3.916 3.571 4.125 0.005 14 0 "[ . 1 . 2]" 1
93 1 9 ILE HA 1 9 ILE MD 3.720 . 6.720 4.039 3.640 4.237 . 0 0 "[ . 1 . 2]" 1
94 1 9 ILE HA 1 9 ILE QG 3.490 . 6.130 2.961 2.130 3.418 . 0 0 "[ . 1 . 2]" 1
95 1 9 ILE HA 1 9 ILE QG 3.040 . 5.040 2.768 2.128 3.384 . 0 0 "[ . 1 . 2]" 1
96 1 9 ILE HA 1 9 ILE MG 3.490 . 6.130 2.282 2.034 3.250 . 0 0 "[ . 1 . 2]" 1
97 1 9 ILE HA 1 10 THR H 3.180 2.230 4.130 3.555 2.391 3.708 . 0 0 "[ . 1 . 2]" 1
98 1 9 ILE HA 1 11 ASN H 3.520 2.470 4.570 4.447 4.232 4.620 0.050 11 0 "[ . 1 . 2]" 1
99 1 9 ILE HA 1 12 ASP H 4.100 2.750 5.450 4.583 3.904 5.288 . 0 0 "[ . 1 . 2]" 1
100 1 9 ILE HB 1 9 ILE MD 3.490 . 6.130 2.370 2.166 2.582 . 0 0 "[ . 1 . 2]" 1
101 1 9 ILE HB 1 15 ASP HA 4.230 . 8.010 4.873 3.361 6.237 . 0 0 "[ . 1 . 2]" 1
102 1 9 ILE MD 1 9 ILE MG 2.960 . 4.860 2.067 1.978 2.388 . 0 0 "[ . 1 . 2]" 1
103 1 9 ILE MD 1 14 HIS HA 4.180 . 7.960 4.578 3.653 5.208 . 0 0 "[ . 1 . 2]" 1
104 1 9 ILE MD 1 14 HIS HB2 4.230 . 8.010 4.963 4.032 6.176 . 0 0 "[ . 1 . 2]" 1
105 1 9 ILE MD 1 14 HIS HB3 3.850 . 6.970 4.808 3.742 7.582 0.612 1 1 "[+ . 1 . 2]" 1
106 1 9 ILE MD 1 14 HIS HD2 3.690 . 6.570 5.306 3.288 6.596 0.026 14 0 "[ . 1 . 2]" 1
107 1 9 ILE MD 1 14 HIS HD2 3.270 . 5.580 3.020 2.028 4.036 . 0 0 "[ . 1 . 2]" 1
108 1 9 ILE MD 1 59 GLN QB 3.850 . 6.970 2.066 1.748 2.825 . 0 0 "[ . 1 . 2]" 1
109 1 9 ILE MD 1 59 GLN HE21 3.440 . 5.540 3.263 2.044 4.692 . 0 0 "[ . 1 . 2]" 1
110 1 9 ILE MD 1 59 GLN HE22 3.440 . 5.540 4.138 3.063 4.842 . 0 0 "[ . 1 . 2]" 1
111 1 9 ILE MD 1 59 GLN QG 3.800 . 6.920 2.850 1.857 3.394 . 0 0 "[ . 1 . 2]" 1
112 1 9 ILE MD 1 62 MET ME 2.430 . 3.710 2.874 2.094 3.653 . 0 0 "[ . 1 . 2]" 1
113 1 9 ILE QG 1 10 THR H 3.690 . 6.110 2.914 1.699 4.381 . 0 0 "[ . 1 . 2]" 1
114 1 9 ILE QG 1 14 HIS HD2 4.160 . 7.810 5.141 2.407 7.008 . 0 0 "[ . 1 . 2]" 1
115 1 9 ILE QG 1 15 ASP H 4.230 . 8.080 3.750 3.499 3.969 . 0 0 "[ . 1 . 2]" 1
116 1 9 ILE QG 1 15 ASP HA 3.930 . 7.120 5.910 3.901 6.909 . 0 0 "[ . 1 . 2]" 1
117 1 9 ILE MG 1 10 THR H 3.180 . 4.980 3.648 1.710 4.332 . 0 0 "[ . 1 . 2]" 1
118 1 9 ILE MG 1 11 ASN H 3.230 . 5.490 5.248 4.593 5.666 0.176 4 0 "[ . 1 . 2]" 1
119 1 9 ILE MG 1 11 ASN H 4.160 . 7.810 4.905 4.447 5.504 . 0 0 "[ . 1 . 2]" 1
120 1 9 ILE MG 1 14 HIS HD2 3.420 . 5.910 3.759 2.413 5.320 . 0 0 "[ . 1 . 2]" 1
121 1 9 ILE MG 1 15 ASP H 3.770 . 6.300 4.425 3.532 6.093 . 0 0 "[ . 1 . 2]" 1
122 1 9 ILE MG 1 63 THR HA 2.810 . 4.520 4.282 2.897 4.644 0.124 5 0 "[ . 1 . 2]" 1
123 1 10 THR H 1 10 THR HB 3.520 . 5.730 2.972 2.388 3.773 . 0 0 "[ . 1 . 2]" 1
124 1 10 THR H 1 10 THR MG 3.350 . 5.350 3.087 1.921 4.173 . 0 0 "[ . 1 . 2]" 1
125 1 10 THR H 1 11 ASN H 3.600 2.510 4.690 3.590 2.820 3.875 . 0 0 "[ . 1 . 2]" 1
126 1 10 THR HA 1 10 THR MG 3.110 . 5.210 2.596 2.092 3.284 . 0 0 "[ . 1 . 2]" 1
127 1 10 THR HA 1 14 HIS HB3 3.650 . 6.530 5.881 3.725 7.204 0.674 13 2 "[ . 1 +-. 2]" 1
128 1 10 THR HB 1 11 ASN H 3.270 . 5.170 4.265 2.467 4.632 . 0 0 "[ . 1 . 2]" 1
129 1 10 THR MG 1 15 ASP HA 3.850 . 6.910 3.817 2.730 4.967 . 0 0 "[ . 1 . 2]" 1
130 1 11 ASN H 1 11 ASN HA 3.850 2.600 5.100 2.716 2.583 3.016 0.017 3 0 "[ . 1 . 2]" 1
131 1 11 ASN H 1 11 ASN HB2 3.600 . 5.910 3.491 2.910 4.210 . 0 0 "[ . 1 . 2]" 1
132 1 11 ASN H 1 11 ASN HB3 3.930 . 7.180 4.102 3.551 4.263 . 0 0 "[ . 1 . 2]" 1
133 1 11 ASN H 1 12 ASP H 4.190 2.940 5.440 2.818 2.743 2.889 0.197 5 0 "[ . 1 . 2]" 1
134 1 11 ASN H 1 13 LYS HA 4.330 2.900 5.760 5.755 5.211 6.084 0.324 7 0 "[ . 1 . 2]" 1
135 1 11 ASN H 1 13 LYS HB3 4.230 . 8.010 3.211 2.120 4.267 . 0 0 "[ . 1 . 2]" 1
136 1 11 ASN HA 1 12 ASP H 3.850 2.590 5.110 3.595 2.518 3.737 0.072 13 0 "[ . 1 . 2]" 1
137 1 11 ASN HB2 1 11 ASN HD21 3.440 . 5.540 2.458 2.257 3.534 . 0 0 "[ . 1 . 2]" 1
138 1 11 ASN HB2 1 12 ASP H 3.270 . 5.170 2.812 2.002 4.856 . 0 0 "[ . 1 . 2]" 1
139 1 11 ASN HB2 1 13 LYS H 4.310 . 8.230 4.630 3.405 5.690 . 0 0 "[ . 1 . 2]" 1
140 1 11 ASN HB3 1 11 ASN HD22 3.690 . 6.110 3.915 3.545 4.151 . 0 0 "[ . 1 . 2]" 1
141 1 11 ASN HB3 1 12 ASP H 3.600 . 5.910 3.283 2.629 4.740 . 0 0 "[ . 1 . 2]" 1
142 1 12 ASP H 1 13 LYS H 3.690 2.590 4.790 4.167 2.681 4.732 . 0 0 "[ . 1 . 2]" 1
143 1 12 ASP HA 1 13 LYS H 2.930 2.050 3.810 3.067 2.340 3.752 . 0 0 "[ . 1 . 2]" 1
144 1 12 ASP QB 1 13 LYS H 3.100 . 4.810 2.563 1.794 4.070 . 0 0 "[ . 1 . 2]" 1
145 1 13 LYS H 1 13 LYS HA 3.540 2.390 4.690 2.790 2.550 2.918 . 0 0 "[ . 1 . 2]" 1
146 1 13 LYS H 1 13 LYS HB2 3.570 . 6.330 2.998 2.245 3.607 . 0 0 "[ . 1 . 2]" 1
147 1 13 LYS H 1 13 LYS HB2 3.770 . 6.830 2.856 2.234 3.388 . 0 0 "[ . 1 . 2]" 1
148 1 13 LYS H 1 13 LYS HB3 3.870 . 7.160 2.711 2.208 3.652 . 0 0 "[ . 1 . 2]" 1
149 1 13 LYS H 1 13 LYS QG 3.490 . 6.160 2.747 1.876 4.039 . 0 0 "[ . 1 . 2]" 1
150 1 13 LYS H 1 14 HIS HB2 3.520 . 5.730 4.593 4.137 5.377 . 0 0 "[ . 1 . 2]" 1
151 1 13 LYS HA 1 13 LYS QD 3.490 . 6.130 4.038 2.108 4.573 . 0 0 "[ . 1 . 2]" 1
152 1 13 LYS HA 1 13 LYS QG 3.650 . 6.530 2.988 2.319 3.431 . 0 0 "[ . 1 . 2]" 1
153 1 13 LYS HA 1 14 HIS H 4.540 3.060 6.020 3.445 3.325 3.607 . 0 0 "[ . 1 . 2]" 1
154 1 13 LYS HA 1 17 TYR HA 3.650 . 6.530 6.505 6.224 6.666 0.136 1 0 "[ . 1 . 2]" 1
155 1 13 LYS HB2 1 14 HIS HA 4.250 . 8.170 4.056 3.395 5.068 . 0 0 "[ . 1 . 2]" 1
156 1 13 LYS HB2 1 16 GLU H 4.330 . 8.390 6.355 5.034 8.190 . 0 0 "[ . 1 . 2]" 1
157 1 13 LYS HB3 1 15 ASP H 4.620 . 9.120 3.383 2.368 4.345 . 0 0 "[ . 1 . 2]" 1
158 1 13 LYS QG 1 14 HIS HD2 4.080 . 7.590 5.280 3.182 7.315 . 0 0 "[ . 1 . 2]" 1
159 1 14 HIS H 1 14 HIS HA 4.100 2.750 5.450 2.831 2.733 2.967 0.017 8 0 "[ . 1 . 2]" 1
160 1 14 HIS H 1 14 HIS HD2 4.230 . 8.010 4.455 3.112 5.296 . 0 0 "[ . 1 . 2]" 1
161 1 14 HIS H 1 15 ASP H 3.850 2.610 5.090 2.747 2.539 3.476 0.071 10 0 "[ . 1 . 2]" 1
162 1 14 HIS H 1 16 GLU QB 3.720 . 6.720 6.329 5.565 6.816 0.096 13 0 "[ . 1 . 2]" 1
163 1 14 HIS H 1 17 TYR H 3.940 2.760 5.120 5.202 5.130 5.249 0.129 8 0 "[ . 1 . 2]" 1
164 1 14 HIS HA 1 14 HIS HD2 4.460 . 8.670 4.242 2.553 4.986 . 0 0 "[ . 1 . 2]" 1
165 1 14 HIS HA 1 15 ASP H 4.000 2.700 5.300 3.317 2.818 3.529 . 0 0 "[ . 1 . 2]" 1
166 1 14 HIS HA 1 17 TYR H 4.100 2.740 5.460 2.944 2.723 3.266 0.017 13 0 "[ . 1 . 2]" 1
167 1 14 HIS HA 1 17 TYR QD 4.930 . 10.050 4.330 3.401 5.590 . 0 0 "[ . 1 . 2]" 1
168 1 14 HIS HA 1 18 LEU QB 4.250 . 8.170 4.940 4.407 5.838 . 0 0 "[ . 1 . 2]" 1
169 1 14 HIS HB2 1 14 HIS HD2 3.690 . 6.570 3.194 2.682 4.047 . 0 0 "[ . 1 . 2]" 1
170 1 14 HIS HB2 1 15 ASP H 3.690 . 6.110 3.780 2.990 4.371 . 0 0 "[ . 1 . 2]" 1
171 1 14 HIS HB2 1 18 LEU QB 3.650 . 6.530 4.491 3.650 5.394 . 0 0 "[ . 1 . 2]" 1
172 1 14 HIS HB2 1 62 MET ME 3.570 . 6.330 3.564 2.692 4.433 . 0 0 "[ . 1 . 2]" 1
173 1 14 HIS HB3 1 18 LEU HG 4.100 . 7.750 5.610 3.928 6.581 . 0 0 "[ . 1 . 2]" 1
174 1 14 HIS HB3 1 62 MET ME 3.420 . 5.950 2.898 2.041 5.340 . 0 0 "[ . 1 . 2]" 1
175 1 14 HIS HD2 1 62 MET ME 3.620 . 6.320 3.001 2.114 4.306 . 0 0 "[ . 1 . 2]" 1
176 1 14 HIS HD2 1 63 THR H 4.540 . 8.890 7.990 6.211 8.920 0.030 16 0 "[ . 1 . 2]" 1
177 1 15 ASP H 1 15 ASP HA 3.460 2.350 4.570 2.758 2.669 2.864 . 0 0 "[ . 1 . 2]" 1
178 1 15 ASP H 1 15 ASP HB2 3.460 . 5.940 2.848 2.146 3.670 . 0 0 "[ . 1 . 2]" 1
179 1 15 ASP H 1 15 ASP HB3 3.460 . 6.050 2.656 2.372 3.656 . 0 0 "[ . 1 . 2]" 1
180 1 15 ASP H 1 16 GLU H 3.520 2.470 4.570 2.709 2.444 2.967 0.026 14 0 "[ . 1 . 2]" 1
181 1 15 ASP H 1 16 GLU HG3 4.310 . 8.230 5.666 3.223 7.414 . 0 0 "[ . 1 . 2]" 1
182 1 15 ASP HA 1 16 GLU H 3.600 2.530 4.670 3.506 3.312 3.616 . 0 0 "[ . 1 . 2]" 1
183 1 15 ASP HA 1 16 GLU H 3.650 . 6.530 3.190 3.033 3.344 . 0 0 "[ . 1 . 2]" 1
184 1 15 ASP HA 1 18 LEU QB 4.100 . 7.750 3.212 2.347 3.693 . 0 0 "[ . 1 . 2]" 1
185 1 15 ASP HA 1 18 LEU QD 3.190 . 5.400 2.159 1.912 2.796 . 0 0 "[ . 1 . 2]" 1
186 1 15 ASP HB2 1 16 GLU H 3.520 . 5.730 3.846 2.713 4.112 . 0 0 "[ . 1 . 2]" 1
187 1 15 ASP HB2 1 16 GLU QB 3.460 . 5.990 5.367 3.799 6.221 0.231 17 0 "[ . 1 . 2]" 1
188 1 15 ASP HB2 1 18 LEU QB 3.310 . 5.620 4.988 4.290 5.553 . 0 0 "[ . 1 . 2]" 1
189 1 15 ASP HB3 1 16 GLU H 3.440 . 5.540 3.367 2.613 4.290 . 0 0 "[ . 1 . 2]" 1
190 1 16 GLU H 1 16 GLU HA 3.870 2.600 5.140 2.874 2.818 2.904 . 0 0 "[ . 1 . 2]" 1
191 1 16 GLU H 1 16 GLU QB 3.390 . 5.810 2.499 2.185 2.774 . 0 0 "[ . 1 . 2]" 1
192 1 16 GLU H 1 16 GLU HG2 3.350 . 5.350 3.074 1.875 4.732 . 0 0 "[ . 1 . 2]" 1
193 1 16 GLU H 1 16 GLU HG3 3.440 . 5.540 3.437 1.786 4.611 . 0 0 "[ . 1 . 2]" 1
194 1 16 GLU H 1 17 TYR H 3.440 2.420 4.460 2.591 2.493 2.782 . 0 0 "[ . 1 . 2]" 1
195 1 16 GLU H 1 18 LEU QB 4.110 . 7.110 5.636 4.540 6.585 . 0 0 "[ . 1 . 2]" 1
196 1 16 GLU H 1 18 LEU QD 3.770 . 6.300 4.476 3.917 5.041 . 0 0 "[ . 1 . 2]" 1
197 1 16 GLU HA 1 16 GLU HG2 3.420 . 6.010 3.746 2.713 4.256 . 0 0 "[ . 1 . 2]" 1
198 1 16 GLU HA 1 16 GLU HG3 3.650 . 6.530 3.647 3.062 4.268 . 0 0 "[ . 1 . 2]" 1
199 1 16 GLU HA 1 17 TYR H 3.460 2.340 4.580 3.594 3.528 3.695 . 0 0 "[ . 1 . 2]" 1
200 1 16 GLU HA 1 19 THR H 3.930 2.670 5.190 4.156 3.678 4.851 . 0 0 "[ . 1 . 2]" 1
201 1 16 GLU HA 1 19 THR HB 3.570 . 6.330 4.959 3.918 6.358 0.028 10 0 "[ . 1 . 2]" 1
202 1 16 GLU HA 1 19 THR MG 3.770 . 6.830 4.899 4.235 5.719 . 0 0 "[ . 1 . 2]" 1
203 1 16 GLU HA 1 20 GLU QB 3.110 . 5.210 5.073 4.379 5.293 0.083 15 0 "[ . 1 . 2]" 1
204 1 16 GLU QB 1 17 TYR H 3.420 . 5.920 3.262 2.461 3.751 . 0 0 "[ . 1 . 2]" 1
205 1 16 GLU QB 1 17 TYR HB3 4.100 . 7.750 4.327 3.668 4.957 . 0 0 "[ . 1 . 2]" 1
206 1 16 GLU QB 1 20 GLU H 3.540 . 6.180 5.078 4.609 5.554 . 0 0 "[ . 1 . 2]" 1
207 1 16 GLU QB 1 20 GLU QG 2.920 . 4.720 4.181 3.556 4.616 . 0 0 "[ . 1 . 2]" 1
208 1 16 GLU HG2 1 17 TYR H 3.520 . 5.730 3.664 2.524 5.308 . 0 0 "[ . 1 . 2]" 1
209 1 16 GLU HG3 1 17 TYR H 3.770 . 6.300 3.263 2.328 4.454 . 0 0 "[ . 1 . 2]" 1
210 1 16 GLU HG3 1 17 TYR QD 3.720 . 6.720 5.554 4.397 6.816 0.096 17 0 "[ . 1 . 2]" 1
211 1 17 TYR H 1 17 TYR HA 3.650 2.450 4.850 2.875 2.803 2.927 . 0 0 "[ . 1 . 2]" 1
212 1 17 TYR H 1 17 TYR HB2 3.340 . 5.720 2.626 2.367 2.783 . 0 0 "[ . 1 . 2]" 1
213 1 17 TYR H 1 17 TYR HB3 3.310 . 5.620 2.594 2.316 2.919 . 0 0 "[ . 1 . 2]" 1
214 1 17 TYR H 1 17 TYR HB3 3.490 . 6.130 2.426 2.203 2.614 . 0 0 "[ . 1 . 2]" 1
215 1 17 TYR H 1 17 TYR QD 3.620 . 6.420 4.013 3.735 4.152 . 0 0 "[ . 1 . 2]" 1
216 1 17 TYR H 1 18 LEU H 3.770 2.550 4.990 2.741 2.528 3.182 0.022 6 0 "[ . 1 . 2]" 1
217 1 17 TYR H 1 18 LEU QB 4.410 . 8.620 4.702 3.954 5.442 . 0 0 "[ . 1 . 2]" 1
218 1 17 TYR HA 1 17 TYR QD 3.570 . 6.370 2.415 2.102 3.092 . 0 0 "[ . 1 . 2]" 1
219 1 17 TYR HA 1 17 TYR QE 4.390 . 8.450 4.505 4.254 4.763 . 0 0 "[ . 1 . 2]" 1
220 1 17 TYR HB2 1 18 LEU H 3.950 . 7.370 4.154 3.708 4.445 . 0 0 "[ . 1 . 2]" 1
221 1 17 TYR HB2 1 18 LEU QB 3.870 . 7.120 4.729 4.370 5.308 . 0 0 "[ . 1 . 2]" 1
222 1 17 TYR HB2 1 20 GLU QG 3.870 . 7.120 5.290 4.187 6.074 . 0 0 "[ . 1 . 2]" 1
223 1 17 TYR HB3 1 17 TYR QE 4.160 . 7.810 4.403 4.335 4.518 . 0 0 "[ . 1 . 2]" 1
224 1 17 TYR HB3 1 18 LEU H 4.180 . 7.920 2.925 2.491 3.207 . 0 0 "[ . 1 . 2]" 1
225 1 17 TYR HB3 1 18 LEU QB 4.250 . 8.170 4.034 3.585 4.506 . 0 0 "[ . 1 . 2]" 1
226 1 17 TYR HB3 1 21 MET QG 4.100 . 7.750 5.818 4.912 7.389 . 0 0 "[ . 1 . 2]" 1
227 1 17 TYR QD 1 18 LEU H 4.000 . 7.340 3.796 3.436 4.152 . 0 0 "[ . 1 . 2]" 1
228 1 17 TYR QD 1 18 LEU HA 3.950 . 7.330 4.392 3.282 5.133 . 0 0 "[ . 1 . 2]" 1
229 1 17 TYR QD 1 18 LEU QD 3.850 . 6.970 4.329 3.817 4.729 . 0 0 "[ . 1 . 2]" 1
230 1 17 TYR QD 1 21 MET QG 3.540 . 6.180 3.715 3.066 4.745 . 0 0 "[ . 1 . 2]" 1
231 1 17 TYR QD 1 21 MET HA 3.570 . 6.330 6.245 5.836 6.392 0.062 11 0 "[ . 1 . 2]" 1
232 1 17 TYR QD 1 62 MET ME 3.720 . 6.720 3.175 2.159 5.180 . 0 0 "[ . 1 . 2]" 1
233 1 17 TYR QE 1 18 LEU H 4.540 . 8.890 5.990 5.577 6.381 . 0 0 "[ . 1 . 2]" 1
234 1 17 TYR QE 1 18 LEU QD 4.310 . 8.230 6.415 5.784 7.052 . 0 0 "[ . 1 . 2]" 1
235 1 17 TYR QE 1 21 MET ME 3.690 . 6.630 4.849 3.409 6.542 . 0 0 "[ . 1 . 2]" 1
236 1 17 TYR QE 1 21 MET QG 4.390 . 7.590 4.107 2.959 6.197 . 0 0 "[ . 1 . 2]" 1
237 1 17 TYR QE 1 58 ALA MB 4.160 . 7.810 6.223 5.345 7.066 . 0 0 "[ . 1 . 2]" 1
238 1 17 TYR QE 1 62 MET H 4.620 . 9.120 7.308 5.790 8.548 . 0 0 "[ . 1 . 2]" 1
239 1 17 TYR QE 1 62 MET HB3 3.850 . 6.970 5.684 3.434 7.014 0.044 18 0 "[ . 1 . 2]" 1
240 1 17 TYR QE 1 62 MET ME 3.650 . 6.570 3.926 2.854 5.329 . 0 0 "[ . 1 . 2]" 1
241 1 17 TYR QE 1 62 MET QG 4.080 . 7.590 3.996 2.657 5.359 . 0 0 "[ . 1 . 2]" 1
242 1 18 LEU H 1 18 LEU QD 3.570 . 6.370 2.848 2.054 3.448 . 0 0 "[ . 1 . 2]" 1
243 1 18 LEU H 1 18 LEU HG 3.600 . 5.910 4.332 2.874 4.729 . 0 0 "[ . 1 . 2]" 1
244 1 18 LEU H 1 18 LEU HG 3.950 . 7.370 3.713 2.871 4.096 . 0 0 "[ . 1 . 2]" 1
245 1 18 LEU H 1 19 THR H 3.690 2.490 4.890 2.991 2.723 3.341 . 0 0 "[ . 1 . 2]" 1
246 1 18 LEU H 1 21 MET ME 4.390 . 8.450 4.280 3.319 5.353 . 0 0 "[ . 1 . 2]" 1
247 1 18 LEU H 1 58 ALA MB 3.860 . 6.500 4.523 4.207 4.756 . 0 0 "[ . 1 . 2]" 1
248 1 18 LEU HA 1 18 LEU QD 3.190 . 5.400 3.354 3.082 3.457 . 0 0 "[ . 1 . 2]" 1
249 1 18 LEU HA 1 18 LEU QD 2.880 . 4.680 2.113 1.857 2.836 . 0 0 "[ . 1 . 2]" 1
250 1 18 LEU HA 1 18 LEU HG 3.650 . 6.530 3.451 2.874 3.966 . 0 0 "[ . 1 . 2]" 1
251 1 18 LEU HA 1 19 THR H 3.950 . 7.330 3.300 3.076 3.521 . 0 0 "[ . 1 . 2]" 1
252 1 18 LEU HA 1 21 MET QB 4.100 . 7.540 3.355 2.622 4.300 . 0 0 "[ . 1 . 2]" 1
253 1 18 LEU HA 1 22 VAL H 3.690 2.590 4.790 4.902 4.734 4.982 0.192 13 0 "[ . 1 . 2]" 1
254 1 18 LEU HA 1 60 PHE H 4.030 . 7.540 6.760 6.505 7.198 . 0 0 "[ . 1 . 2]" 1
255 1 18 LEU QB 1 60 PHE H 3.940 . 6.700 5.881 5.274 6.458 . 0 0 "[ . 1 . 2]" 1
256 1 18 LEU QD 1 19 THR MG 3.540 . 6.180 2.205 1.854 3.347 . 0 0 "[ . 1 . 2]" 1
257 1 18 LEU QD 1 20 GLU H 4.080 . 7.660 4.639 3.969 5.547 . 0 0 "[ . 1 . 2]" 1
258 1 18 LEU QD 1 21 MET QB 3.870 . 7.120 4.838 4.006 5.952 . 0 0 "[ . 1 . 2]" 1
259 1 18 LEU QD 1 22 VAL HA 3.570 . 6.330 5.640 5.219 6.109 . 0 0 "[ . 1 . 2]" 1
260 1 18 LEU QD 1 43 ASN H 4.000 . 7.320 2.588 2.082 3.143 . 0 0 "[ . 1 . 2]" 1
261 1 18 LEU QD 1 55 ALA HA 3.390 . 5.810 2.151 1.865 3.046 . 0 0 "[ . 1 . 2]" 1
262 1 18 LEU QD 1 55 ALA MB 2.500 . 3.860 3.020 2.570 3.552 . 0 0 "[ . 1 . 2]" 1
263 1 18 LEU QD 1 58 ALA H 3.270 . 5.170 3.607 2.539 4.537 . 0 0 "[ . 1 . 2]" 1
264 1 18 LEU QD 1 58 ALA HA 3.650 . 6.530 3.813 2.919 4.394 . 0 0 "[ . 1 . 2]" 1
265 1 18 LEU QD 1 58 ALA MB 2.880 . 4.650 2.395 1.882 2.871 . 0 0 "[ . 1 . 2]" 1
266 1 18 LEU QD 1 59 GLN H 3.930 . 5.730 2.711 2.097 3.395 . 0 0 "[ . 1 . 2]" 1
267 1 18 LEU QD 1 59 GLN HA 3.460 . 5.990 2.392 1.918 3.002 . 0 0 "[ . 1 . 2]" 1
268 1 18 LEU QD 1 59 GLN QB 3.720 . 6.330 2.270 1.818 3.343 . 0 0 "[ . 1 . 2]" 1
269 1 18 LEU QD 1 59 GLN QB 3.690 . 6.570 2.169 1.805 2.608 . 0 0 "[ . 1 . 2]" 1
270 1 18 LEU QD 1 59 GLN HE21 3.850 . 6.910 4.136 2.709 5.414 . 0 0 "[ . 1 . 2]" 1
271 1 18 LEU QD 1 59 GLN HE22 3.600 . 5.910 4.930 4.070 5.702 . 0 0 "[ . 1 . 2]" 1
272 1 18 LEU QD 1 59 GLN QG 3.800 . 6.920 3.291 2.075 4.098 . 0 0 "[ . 1 . 2]" 1
273 1 18 LEU HG 1 19 THR H 3.650 . 6.470 4.173 3.498 4.852 . 0 0 "[ . 1 . 2]" 1
274 1 18 LEU HG 1 20 GLU H 4.100 . 7.750 6.791 6.051 7.495 . 0 0 "[ . 1 . 2]" 1
275 1 18 LEU HG 1 22 VAL H 4.020 . 6.900 4.746 4.558 5.067 . 0 0 "[ . 1 . 2]" 1
276 1 18 LEU HG 1 58 ALA HA 3.950 . 7.330 3.574 2.503 4.301 . 0 0 "[ . 1 . 2]" 1
277 1 18 LEU HG 1 55 ALA HA 4.100 . 7.750 3.893 2.289 5.440 . 0 0 "[ . 1 . 2]" 1
278 1 18 LEU HG 1 58 ALA MB 4.000 . 7.380 2.661 1.913 4.101 . 0 0 "[ . 1 . 2]" 1
279 1 18 LEU HG 1 59 GLN QG 2.920 . 4.720 4.437 3.822 4.736 0.016 15 0 "[ . 1 . 2]" 1
280 1 19 THR H 1 19 THR HA 3.570 2.390 4.750 2.701 2.556 2.786 . 0 0 "[ . 1 . 2]" 1
281 1 19 THR H 1 19 THR HB 3.420 . 5.950 3.543 3.070 3.727 . 0 0 "[ . 1 . 2]" 1
282 1 19 THR H 1 19 THR HB 4.000 . 7.380 3.447 3.031 3.711 . 0 0 "[ . 1 . 2]" 1
283 1 19 THR H 1 19 THR MG 3.490 . 6.130 2.579 2.044 3.421 . 0 0 "[ . 1 . 2]" 1
284 1 19 THR H 1 20 GLU H 3.460 2.320 4.600 3.255 2.999 3.490 . 0 0 "[ . 1 . 2]" 1
285 1 19 THR H 1 56 LYS H 4.460 . 8.670 7.233 6.811 7.714 . 0 0 "[ . 1 . 2]" 1
286 1 19 THR H 1 55 ALA H 4.620 3.120 6.120 6.327 6.230 6.402 0.282 13 0 "[ . 1 . 2]" 1
287 1 19 THR HA 1 19 THR MG 3.190 . 5.390 2.023 1.909 2.158 . 0 0 "[ . 1 . 2]" 1
288 1 19 THR HA 1 57 ALA MB 3.270 . 5.580 5.557 5.253 5.666 0.086 12 0 "[ . 1 . 2]" 1
289 1 19 THR HA 1 83 ILE MG 3.310 . 5.620 5.723 5.297 6.004 0.384 15 0 "[ . 1 . 2]" 1
290 1 19 THR HB 1 20 GLU H 4.100 . 7.810 4.032 3.514 4.408 . 0 0 "[ . 1 . 2]" 1
291 1 19 THR HB 1 20 GLU QB 4.100 . 7.750 4.661 4.058 5.301 . 0 0 "[ . 1 . 2]" 1
292 1 19 THR HB 1 59 GLN QB 4.000 . 7.380 6.337 4.754 7.111 . 0 0 "[ . 1 . 2]" 1
293 1 19 THR MG 1 20 GLU H 3.690 . 6.610 4.193 4.071 4.383 . 0 0 "[ . 1 . 2]" 1
294 1 19 THR MG 1 20 GLU HA 4.000 . 7.380 4.512 4.104 4.841 . 0 0 "[ . 1 . 2]" 1
295 1 19 THR MG 1 20 GLU QB 3.420 . 5.950 4.821 3.969 5.245 . 0 0 "[ . 1 . 2]" 1
296 1 19 THR MG 1 51 LEU QD 3.270 . 5.580 3.228 2.340 4.654 . 0 0 "[ . 1 . 2]" 1
297 1 19 THR MG 1 55 ALA HA 3.460 . 5.990 2.596 1.999 3.608 . 0 0 "[ . 1 . 2]" 1
298 1 19 THR MG 1 57 ALA MB 3.040 . 5.040 5.213 5.170 5.250 0.210 8 0 "[ . 1 . 2]" 1
299 1 19 THR MG 1 59 GLN QG 3.720 . 6.720 4.764 3.733 5.737 . 0 0 "[ . 1 . 2]" 1
300 1 20 GLU H 1 20 GLU HA 3.390 2.300 4.480 2.832 2.720 2.913 . 0 0 "[ . 1 . 2]" 1
301 1 20 GLU H 1 20 GLU QB 2.880 . 4.640 2.325 2.116 2.657 . 0 0 "[ . 1 . 2]" 1
302 1 20 GLU H 1 20 GLU QG 4.030 . 5.640 2.572 2.060 3.749 . 0 0 "[ . 1 . 2]" 1
303 1 20 GLU H 1 20 GLU QG 4.160 . 7.810 2.546 2.059 3.567 . 0 0 "[ . 1 . 2]" 1
304 1 20 GLU H 1 21 MET H 3.520 2.470 4.570 2.917 2.642 3.274 . 0 0 "[ . 1 . 2]" 1
305 1 20 GLU H 1 23 PRO HD3 4.160 . 7.810 5.160 4.801 5.343 . 0 0 "[ . 1 . 2]" 1
306 1 20 GLU HA 1 20 GLU QG 3.190 . 5.340 2.670 2.245 3.410 . 0 0 "[ . 1 . 2]" 1
307 1 20 GLU HA 1 21 MET QG 3.080 . 5.030 2.425 1.926 3.234 . 0 0 "[ . 1 . 2]" 1
308 1 20 GLU HA 1 22 VAL H 4.160 . 7.810 3.317 3.179 3.401 . 0 0 "[ . 1 . 2]" 1
309 1 20 GLU HA 1 23 PRO HD2 3.950 . 7.330 2.332 1.992 2.671 . 0 0 "[ . 1 . 2]" 1
310 1 20 GLU HA 1 23 PRO HD3 4.100 . 7.750 3.733 2.888 4.092 . 0 0 "[ . 1 . 2]" 1
311 1 20 GLU HA 1 23 PRO HG2 3.720 . 6.720 3.352 2.332 3.827 . 0 0 "[ . 1 . 2]" 1
312 1 20 GLU QB 1 21 MET H 3.490 . 6.130 3.029 2.796 3.968 . 0 0 "[ . 1 . 2]" 1
313 1 20 GLU QG 1 21 MET H 4.180 . 7.750 4.410 2.704 4.951 . 0 0 "[ . 1 . 2]" 1
314 1 20 GLU QG 1 23 PRO HG2 3.390 . 5.810 4.944 3.997 5.512 . 0 0 "[ . 1 . 2]" 1
315 1 20 GLU QG 1 24 LEU QD 3.950 . 7.330 4.837 3.955 5.856 . 0 0 "[ . 1 . 2]" 1
316 1 21 MET H 1 21 MET HA 3.420 2.300 4.540 2.798 2.745 2.855 . 0 0 "[ . 1 . 2]" 1
317 1 21 MET H 1 21 MET QB 3.570 . 6.330 2.353 1.802 2.834 . 0 0 "[ . 1 . 2]" 1
318 1 21 MET H 1 21 MET QG 3.690 . 5.810 2.311 1.803 3.936 . 0 0 "[ . 1 . 2]" 1
319 1 21 MET H 1 22 VAL H 3.850 2.590 5.110 2.662 2.538 2.877 0.052 12 0 "[ . 1 . 2]" 1
320 1 21 MET H 1 22 VAL QG 3.600 . 5.910 3.580 3.225 3.992 . 0 0 "[ . 1 . 2]" 1
321 1 21 MET H 1 83 ILE MG 4.000 . 7.380 6.808 5.771 7.442 0.062 20 0 "[ . 1 . 2]" 1
322 1 21 MET HA 1 21 MET ME 3.490 . 6.130 3.995 2.520 4.336 . 0 0 "[ . 1 . 2]" 1
323 1 21 MET HA 1 21 MET QG 2.880 . 4.350 2.530 2.053 3.582 . 0 0 "[ . 1 . 2]" 1
324 1 21 MET HA 1 22 VAL H 3.490 2.340 4.640 3.485 3.415 3.598 . 0 0 "[ . 1 . 2]" 1
325 1 21 MET HA 1 24 LEU H 4.000 . 7.450 3.353 3.199 3.530 . 0 0 "[ . 1 . 2]" 1
326 1 21 MET HA 1 24 LEU H 3.490 2.340 4.640 3.973 3.521 4.540 . 0 0 "[ . 1 . 2]" 1
327 1 21 MET HA 1 24 LEU QD 3.110 . 5.210 2.276 1.894 2.685 . 0 0 "[ . 1 . 2]" 1
328 1 21 MET HA 1 24 LEU QD 3.190 . 5.400 2.811 1.945 4.561 . 0 0 "[ . 1 . 2]" 1
329 1 21 MET HA 1 24 LEU MD2 3.310 . 5.680 4.346 2.262 6.457 0.777 11 1 "[ . 1+ . 2]" 1
330 1 21 MET HA 1 78 ASN QD 3.570 . 6.330 5.938 4.723 6.231 . 0 0 "[ . 1 . 2]" 1
331 1 21 MET QB 1 22 VAL H 4.390 . 6.500 2.374 1.983 3.460 . 0 0 "[ . 1 . 2]" 1
332 1 21 MET QB 1 25 LEU H 3.690 . 6.110 5.127 4.925 5.633 . 0 0 "[ . 1 . 2]" 1
333 1 21 MET QB 1 25 LEU QD 4.030 . 7.540 3.848 2.108 4.668 . 0 0 "[ . 1 . 2]" 1
334 1 21 MET QB 1 54 VAL MG1 3.230 . 5.440 4.944 4.036 5.316 . 0 0 "[ . 1 . 2]" 1
335 1 21 MET QB 1 79 PHE HB2 3.620 . 6.380 4.889 3.707 5.849 . 0 0 "[ . 1 . 2]" 1
336 1 21 MET QB 1 60 PHE H 4.390 . 8.450 7.637 7.299 8.001 . 0 0 "[ . 1 . 2]" 1
337 1 21 MET QB 1 62 MET HB2 3.540 . 6.180 5.018 4.011 6.841 0.661 14 1 "[ . 1 +. 2]" 1
338 1 21 MET QB 1 78 ASN H 4.230 . 8.010 5.383 2.827 6.159 . 0 0 "[ . 1 . 2]" 1
339 1 21 MET QB 1 79 PHE HB2 3.620 . 6.380 5.347 3.879 6.696 0.316 9 0 "[ . 1 . 2]" 1
340 1 21 MET ME 1 21 MET QG 3.190 . 5.340 2.526 1.905 2.936 . 0 0 "[ . 1 . 2]" 1
341 1 21 MET ME 1 24 LEU MD2 3.930 . 7.180 6.437 1.923 7.843 0.663 14 2 "[ . 1- +. 2]" 1
342 1 21 MET ME 1 25 LEU H 3.720 . 6.720 6.342 4.715 6.876 0.156 19 0 "[ . 1 . 2]" 1
343 1 21 MET ME 1 25 LEU QD 3.310 . 5.620 3.368 2.659 3.832 . 0 0 "[ . 1 . 2]" 1
344 1 21 MET ME 1 61 TYR HB3 3.800 . 6.860 3.291 1.955 7.269 0.409 19 0 "[ . 1 . 2]" 1
345 1 21 MET ME 1 61 TYR QD 3.420 . 5.990 2.770 2.073 5.103 . 0 0 "[ . 1 . 2]" 1
346 1 21 MET ME 1 77 TYR QD 4.000 . 7.380 4.398 2.551 5.396 . 0 0 "[ . 1 . 2]" 1
347 1 21 MET ME 1 77 TYR QE 3.850 . 7.040 3.595 2.123 4.777 . 0 0 "[ . 1 . 2]" 1
348 1 21 MET ME 1 78 ASN QD 4.080 . 7.590 4.268 2.453 6.693 . 0 0 "[ . 1 . 2]" 1
349 1 21 MET ME 1 79 PHE QE 3.230 . 5.490 2.685 1.981 4.343 . 0 0 "[ . 1 . 2]" 1
350 1 21 MET ME 1 79 PHE HZ 3.340 . 5.800 4.077 2.418 5.856 0.056 4 0 "[ . 1 . 2]" 1
351 1 21 MET ME 1 83 ILE MD 2.880 . 4.680 4.115 2.199 4.896 0.216 20 0 "[ . 1 . 2]" 1
352 1 21 MET ME 1 83 ILE MG 3.540 . 6.180 3.243 1.847 5.623 . 0 0 "[ . 1 . 2]" 1
353 1 21 MET QG 1 22 VAL HA 3.420 . 5.950 5.258 3.795 5.569 . 0 0 "[ . 1 . 2]" 1
354 1 21 MET QG 1 58 ALA MB 3.570 . 6.330 3.370 1.862 4.020 . 0 0 "[ . 1 . 2]" 1
355 1 21 MET QG 1 79 PHE HZ 4.160 . 7.810 3.198 2.167 5.368 . 0 0 "[ . 1 . 2]" 1
356 1 21 MET QG 1 79 PHE HZ 3.650 . 6.530 3.413 2.175 5.759 . 0 0 "[ . 1 . 2]" 1
357 1 22 VAL H 1 22 VAL HA 3.950 2.650 5.250 2.809 2.769 2.890 . 0 0 "[ . 1 . 2]" 1
358 1 22 VAL H 1 22 VAL HB 3.720 . 6.720 2.885 2.633 3.629 . 0 0 "[ . 1 . 2]" 1
359 1 22 VAL H 1 22 VAL QG 3.520 . 5.730 1.996 1.587 2.315 . 0 0 "[ . 1 . 2]" 1
360 1 22 VAL H 1 22 VAL QG 3.340 . 5.760 1.927 1.582 2.212 . 0 0 "[ . 1 . 2]" 1
361 1 22 VAL H 1 23 PRO HD2 3.800 . 6.990 3.321 2.831 3.713 . 0 0 "[ . 1 . 2]" 1
362 1 22 VAL H 1 23 PRO HD3 4.030 . 7.540 3.515 3.164 3.732 . 0 0 "[ . 1 . 2]" 1
363 1 22 VAL H 1 23 PRO HG3 4.540 . 8.890 4.535 3.986 5.020 . 0 0 "[ . 1 . 2]" 1
364 1 22 VAL H 1 25 LEU QD 3.950 . 7.330 4.445 3.481 4.794 . 0 0 "[ . 1 . 2]" 1
365 1 22 VAL HA 1 22 VAL QG 2.960 . 4.860 1.980 1.874 2.425 . 0 0 "[ . 1 . 2]" 1
366 1 22 VAL HA 1 22 VAL QG 2.960 . 4.860 1.977 1.869 2.407 . 0 0 "[ . 1 . 2]" 1
367 1 22 VAL HA 1 25 LEU HB2 4.250 . 8.170 3.638 3.218 4.978 . 0 0 "[ . 1 . 2]" 1
368 1 22 VAL HA 1 25 LEU HB2 3.870 . 7.120 3.532 3.186 4.359 . 0 0 "[ . 1 . 2]" 1
369 1 22 VAL HA 1 25 LEU HB3 3.870 . 7.120 2.388 1.964 4.428 . 0 0 "[ . 1 . 2]" 1
370 1 22 VAL HA 1 25 LEU QD 4.250 . 6.920 2.994 1.958 3.619 . 0 0 "[ . 1 . 2]" 1
371 1 22 VAL HA 1 25 LEU HG 4.250 . 8.170 4.226 2.366 5.051 . 0 0 "[ . 1 . 2]" 1
372 1 22 VAL HB 1 23 PRO HD2 3.650 . 6.530 4.061 3.523 5.589 . 0 0 "[ . 1 . 2]" 1
373 1 22 VAL HB 1 23 PRO HD3 3.650 . 6.530 2.871 2.336 4.529 . 0 0 "[ . 1 . 2]" 1
374 1 22 VAL HB 1 23 PRO HG2 3.800 . 6.920 5.557 4.990 6.939 0.019 12 0 "[ . 1 . 2]" 1
375 1 22 VAL HB 1 54 VAL HA 3.930 . 7.180 2.394 2.027 3.445 . 0 0 "[ . 1 . 2]" 1
376 1 22 VAL HB 1 54 VAL HB 3.720 . 6.720 2.539 1.871 4.848 . 0 0 "[ . 1 . 2]" 1
377 1 22 VAL HB 1 58 ALA H 4.230 . 8.010 5.025 3.754 6.036 . 0 0 "[ . 1 . 2]" 1
378 1 22 VAL QG 1 23 PRO HD2 3.570 . 6.330 3.518 2.896 3.823 . 0 0 "[ . 1 . 2]" 1
379 1 22 VAL QG 1 23 PRO HG2 3.650 . 6.530 3.774 3.053 4.669 . 0 0 "[ . 1 . 2]" 1
380 1 22 VAL QG 1 23 PRO HG3 3.420 . 5.950 2.808 2.123 3.859 . 0 0 "[ . 1 . 2]" 1
381 1 22 VAL QG 1 25 LEU H 3.520 . 5.730 3.393 3.190 3.697 . 0 0 "[ . 1 . 2]" 1
382 1 22 VAL QG 1 25 LEU H 4.460 . 8.670 3.632 3.398 4.191 . 0 0 "[ . 1 . 2]" 1
383 1 22 VAL QG 1 25 LEU HB2 3.800 . 6.920 3.607 3.154 4.429 . 0 0 "[ . 1 . 2]" 1
384 1 22 VAL QG 1 25 LEU HB3 3.570 . 6.330 2.539 2.035 4.050 . 0 0 "[ . 1 . 2]" 1
385 1 22 VAL QG 1 53 PHE HZ 4.390 . 8.450 3.399 2.880 5.482 . 0 0 "[ . 1 . 2]" 1
386 1 22 VAL QG 1 54 VAL HA 3.190 . 5.400 1.874 1.717 2.299 . 0 0 "[ . 1 . 2]" 1
387 1 22 VAL MG1 1 23 PRO HD3 3.490 . 6.130 2.436 1.820 3.789 . 0 0 "[ . 1 . 2]" 1
388 1 22 VAL MG1 1 25 LEU HG 2.880 . 4.680 2.771 1.878 4.163 . 0 0 "[ . 1 . 2]" 1
389 1 22 VAL MG1 1 46 ILE MD 3.270 . 5.620 3.379 2.140 4.738 . 0 0 "[ . 1 . 2]" 1
390 1 23 PRO HA 1 23 PRO HD2 4.100 . 7.750 3.801 3.734 3.841 . 0 0 "[ . 1 . 2]" 1
391 1 23 PRO HA 1 24 LEU H 3.950 2.650 5.250 3.634 3.578 3.686 . 0 0 "[ . 1 . 2]" 1
392 1 23 PRO HA 1 25 LEU H 4.250 2.850 5.650 4.268 4.003 4.868 . 0 0 "[ . 1 . 2]" 1
393 1 23 PRO HA 1 26 VAL H 4.080 2.750 5.410 2.927 2.684 3.844 0.066 7 0 "[ . 1 . 2]" 1
394 1 23 PRO HA 1 26 VAL MG1 3.690 . 6.510 2.834 1.889 4.454 . 0 0 "[ . 1 . 2]" 1
395 1 23 PRO HA 1 26 VAL MG2 3.420 . 5.950 3.593 1.882 5.210 . 0 0 "[ . 1 . 2]" 1
396 1 23 PRO HB2 1 23 PRO HD2 3.420 . 5.950 2.992 2.692 3.337 . 0 0 "[ . 1 . 2]" 1
397 1 23 PRO HB2 1 23 PRO HD3 3.800 . 6.920 3.984 3.855 4.116 . 0 0 "[ . 1 . 2]" 1
398 1 23 PRO HB2 1 24 LEU H 5.000 . 10.280 3.472 3.263 3.613 . 0 0 "[ . 1 . 2]" 1
399 1 23 PRO HB2 1 27 GLU HA 3.930 . 7.180 6.374 6.134 6.442 . 0 0 "[ . 1 . 2]" 1
400 1 23 PRO HB3 1 23 PRO HD3 3.340 . 5.760 4.117 3.948 4.217 . 0 0 "[ . 1 . 2]" 1
401 1 23 PRO HB3 1 24 LEU H 5.000 . 10.280 4.574 4.451 4.679 . 0 0 "[ . 1 . 2]" 1
402 1 23 PRO HB3 1 27 GLU HA 3.620 . 6.320 5.171 5.035 5.253 . 0 0 "[ . 1 . 2]" 1
403 1 23 PRO HB3 1 27 GLU QB 2.730 . 4.350 3.417 2.941 3.830 . 0 0 "[ . 1 . 2]" 1
404 1 23 PRO HD2 1 25 LEU H 4.020 . 6.900 4.509 4.313 4.829 . 0 0 "[ . 1 . 2]" 1
405 1 23 PRO HD3 1 24 LEU H 3.860 . 6.500 4.414 4.071 4.804 . 0 0 "[ . 1 . 2]" 1
406 1 23 PRO HG2 1 24 LEU H 3.620 . 6.380 4.876 4.499 5.017 . 0 0 "[ . 1 . 2]" 1
407 1 23 PRO HG3 1 27 GLU HA 3.770 . 6.770 6.773 6.322 6.855 0.085 19 0 "[ . 1 . 2]" 1
408 1 24 LEU H 1 24 LEU HA 3.690 2.480 4.900 2.927 2.887 3.008 . 0 0 "[ . 1 . 2]" 1
409 1 24 LEU H 1 24 LEU MD1 3.850 . 6.970 2.806 2.064 3.912 . 0 0 "[ . 1 . 2]" 1
410 1 24 LEU H 1 24 LEU QD 3.520 . 5.730 2.677 2.054 3.340 . 0 0 "[ . 1 . 2]" 1
411 1 24 LEU H 1 24 LEU MD2 3.850 . 6.970 4.010 3.331 4.414 . 0 0 "[ . 1 . 2]" 1
412 1 24 LEU H 1 24 LEU HG 3.570 . 6.330 3.323 2.111 4.268 . 0 0 "[ . 1 . 2]" 1
413 1 24 LEU H 1 25 LEU H 3.770 2.530 5.010 2.794 2.670 3.056 . 0 0 "[ . 1 . 2]" 1
414 1 24 LEU HA 1 24 LEU MD1 3.040 . 5.070 3.251 2.270 3.967 . 0 0 "[ . 1 . 2]" 1
415 1 24 LEU HA 1 24 LEU MD2 3.460 . 5.990 3.089 2.092 3.889 . 0 0 "[ . 1 . 2]" 1
416 1 24 LEU HA 1 24 LEU HG 3.570 . 6.330 2.499 2.061 3.099 . 0 0 "[ . 1 . 2]" 1
417 1 24 LEU HA 1 25 LEU H 3.860 2.710 5.010 3.620 3.521 3.691 . 0 0 "[ . 1 . 2]" 1
418 1 24 LEU QB 1 25 LEU H 3.950 . 7.330 2.744 2.411 3.133 . 0 0 "[ . 1 . 2]" 1
419 1 24 LEU QB 1 83 ILE MG 3.690 . 6.570 6.040 5.476 6.477 . 0 0 "[ . 1 . 2]" 1
420 1 24 LEU QB 1 28 PHE QD 4.080 . 7.660 3.040 2.512 3.853 . 0 0 "[ . 1 . 2]" 1
421 1 24 LEU QB 1 78 ASN QD 3.860 . 6.500 4.471 3.020 5.479 . 0 0 "[ . 1 . 2]" 1
422 1 24 LEU QB 1 79 PHE QE 4.000 . 7.450 3.208 2.345 4.633 . 0 0 "[ . 1 . 2]" 1
423 1 24 LEU QB 1 79 PHE HZ 4.030 . 7.500 4.682 3.528 5.837 . 0 0 "[ . 1 . 2]" 1
424 1 24 LEU QB 1 82 GLU H 4.390 . 8.450 7.673 7.079 7.966 . 0 0 "[ . 1 . 2]" 1
425 1 24 LEU QD 1 79 PHE HZ 3.190 . 5.400 3.504 2.035 5.176 . 0 0 "[ . 1 . 2]" 1
426 1 24 LEU MD1 1 25 LEU H 4.770 . 9.580 4.434 4.047 4.786 . 0 0 "[ . 1 . 2]" 1
427 1 24 LEU MD1 1 77 TYR QD 4.000 . 7.380 5.713 4.186 7.395 0.015 5 0 "[ . 1 . 2]" 1
428 1 24 LEU MD1 1 77 TYR QE 4.310 . 8.230 5.919 4.728 7.463 . 0 0 "[ . 1 . 2]" 1
429 1 24 LEU MD1 1 79 PHE QE 3.930 . 7.180 3.079 1.979 5.368 . 0 0 "[ . 1 . 2]" 1
430 1 24 LEU MD1 1 79 PHE HZ 3.850 . 6.970 4.243 2.644 6.324 . 0 0 "[ . 1 . 2]" 1
431 1 24 LEU MD2 1 25 LEU H 4.540 . 8.890 4.902 4.362 5.170 . 0 0 "[ . 1 . 2]" 1
432 1 24 LEU MD2 1 77 TYR QD 3.850 . 6.970 5.512 3.753 7.396 0.426 19 0 "[ . 1 . 2]" 1
433 1 24 LEU MD2 1 77 TYR QE 4.230 . 8.010 6.125 4.733 7.691 . 0 0 "[ . 1 . 2]" 1
434 1 24 LEU MD2 1 79 PHE QE 3.690 . 6.630 2.990 1.971 4.711 . 0 0 "[ . 1 . 2]" 1
435 1 24 LEU MD2 1 79 PHE HZ 3.770 . 6.770 4.571 2.044 6.218 . 0 0 "[ . 1 . 2]" 1
436 1 24 LEU HG 1 27 GLU QB 3.540 . 6.180 5.657 4.797 6.078 . 0 0 "[ . 1 . 2]" 1
437 1 25 LEU H 1 25 LEU HA 3.720 2.490 4.950 2.884 2.831 2.939 . 0 0 "[ . 1 . 2]" 1
438 1 25 LEU H 1 25 LEU HB2 3.870 . 7.080 2.696 2.436 3.804 . 0 0 "[ . 1 . 2]" 1
439 1 25 LEU H 1 25 LEU QD 3.870 . 7.120 3.615 2.317 3.772 . 0 0 "[ . 1 . 2]" 1
440 1 25 LEU H 1 25 LEU HG 4.230 . 8.080 4.260 2.631 4.526 . 0 0 "[ . 1 . 2]" 1
441 1 25 LEU H 1 26 VAL H 3.850 2.590 5.110 2.954 2.796 3.132 . 0 0 "[ . 1 . 2]" 1
442 1 25 LEU H 1 53 PHE QD 4.700 . 9.350 7.076 6.485 7.754 . 0 0 "[ . 1 . 2]" 1
443 1 25 LEU H 1 79 PHE QE 4.770 . 9.580 5.306 4.219 5.930 . 0 0 "[ . 1 . 2]" 1
444 1 25 LEU H 1 79 PHE HZ 4.620 . 9.120 6.898 6.247 7.439 . 0 0 "[ . 1 . 2]" 1
445 1 25 LEU HA 1 25 LEU QD 3.270 . 5.640 2.497 2.227 3.434 . 0 0 "[ . 1 . 2]" 1
446 1 25 LEU HA 1 25 LEU QD 3.800 . 6.920 2.487 2.225 3.339 . 0 0 "[ . 1 . 2]" 1
447 1 25 LEU HA 1 25 LEU QD 3.950 . 7.330 2.493 2.227 3.425 . 0 0 "[ . 1 . 2]" 1
448 1 25 LEU HA 1 25 LEU HG 3.870 . 7.120 3.490 3.306 3.671 . 0 0 "[ . 1 . 2]" 1
449 1 25 LEU HA 1 27 GLU H 3.690 2.490 4.890 4.635 4.233 4.908 0.018 11 0 "[ . 1 . 2]" 1
450 1 25 LEU HA 1 27 GLU H 3.930 . 7.180 3.672 3.276 4.029 . 0 0 "[ . 1 . 2]" 1
451 1 25 LEU HA 1 29 ALA H 3.690 . 6.110 3.682 3.494 3.964 . 0 0 "[ . 1 . 2]" 1
452 1 25 LEU HA 1 28 PHE H 4.000 2.700 5.300 3.852 3.398 4.282 . 0 0 "[ . 1 . 2]" 1
453 1 25 LEU HA 1 28 PHE HB2 3.950 . 7.330 4.634 3.788 5.738 . 0 0 "[ . 1 . 2]" 1
454 1 25 LEU HB2 1 25 LEU QD 3.110 . 5.210 2.047 1.756 2.152 . 0 0 "[ . 1 . 2]" 1
455 1 25 LEU HB2 1 26 VAL H 3.770 . 6.830 4.051 3.891 4.228 . 0 0 "[ . 1 . 2]" 1
456 1 25 LEU HB2 1 28 PHE QE 4.700 . 9.350 5.304 3.875 6.584 . 0 0 "[ . 1 . 2]" 1
457 1 25 LEU HB2 1 58 ALA MB 3.870 . 7.120 6.751 6.273 7.777 0.657 4 2 "[ +. 1 .- 2]" 1
458 1 25 LEU HB2 1 80 ALA H 3.690 . 6.510 3.979 3.609 4.252 . 0 0 "[ . 1 . 2]" 1
459 1 25 LEU HB2 1 81 THR H 3.690 . 6.110 5.126 4.787 6.019 . 0 0 "[ . 1 . 2]" 1
460 1 25 LEU HB2 1 88 LEU QD 3.110 . 5.210 4.597 4.043 5.050 . 0 0 "[ . 1 . 2]" 1
461 1 25 LEU HB2 1 80 ALA H 4.330 . 8.390 4.955 4.037 5.755 . 0 0 "[ . 1 . 2]" 1
462 1 25 LEU HB3 1 58 ALA HA 4.330 . 8.390 6.832 6.356 7.344 . 0 0 "[ . 1 . 2]" 1
463 1 25 LEU HB3 1 78 ASN QD 3.690 . 6.110 4.777 4.308 5.165 . 0 0 "[ . 1 . 2]" 1
464 1 25 LEU HB3 1 81 THR H 4.330 . 8.390 7.734 6.000 9.186 0.796 9 1 "[ . +1 . 2]" 1
465 1 25 LEU QD 1 26 VAL HA 3.110 . 5.210 1.834 1.709 2.008 . 0 0 "[ . 1 . 2]" 1
466 1 25 LEU QD 1 28 PHE QD 4.160 . 7.810 2.669 2.142 3.386 . 0 0 "[ . 1 . 2]" 1
467 1 25 LEU QD 1 28 PHE QE 3.110 . 5.210 2.129 1.863 2.611 . 0 0 "[ . 1 . 2]" 1
468 1 25 LEU QD 1 53 PHE QD 3.930 . 7.180 2.410 1.953 3.160 . 0 0 "[ . 1 . 2]" 1
469 1 25 LEU QD 1 53 PHE QE 3.040 . 5.040 2.121 1.908 2.525 . 0 0 "[ . 1 . 2]" 1
470 1 25 LEU QD 1 53 PHE QE 3.460 . 5.990 2.732 2.082 3.130 . 0 0 "[ . 1 . 2]" 1
471 1 25 LEU QD 1 53 PHE HZ 3.340 . 5.760 2.073 1.890 2.337 . 0 0 "[ . 1 . 2]" 1
472 1 25 LEU QD 1 54 VAL HA 3.540 . 6.180 4.853 3.790 5.413 . 0 0 "[ . 1 . 2]" 1
473 1 25 LEU QD 1 57 ALA MB 3.270 . 5.580 3.043 2.223 3.722 . 0 0 "[ . 1 . 2]" 1
474 1 25 LEU QD 1 58 ALA HA 3.870 . 7.120 3.762 3.322 4.161 . 0 0 "[ . 1 . 2]" 1
475 1 25 LEU QD 1 58 ALA MB 3.040 . 5.040 4.771 3.670 5.044 0.004 14 0 "[ . 1 . 2]" 1
476 1 25 LEU QD 1 61 TYR QE 3.950 . 7.330 4.841 3.381 5.520 . 0 0 "[ . 1 . 2]" 1
477 1 25 LEU QD 1 61 TYR QE 3.390 . 5.870 4.109 3.153 4.906 . 0 0 "[ . 1 . 2]" 1
478 1 25 LEU QD 1 79 PHE QD 3.930 . 7.180 3.883 2.585 4.493 . 0 0 "[ . 1 . 2]" 1
479 1 25 LEU QD 1 79 PHE HZ 4.030 . 7.540 6.827 4.822 7.216 . 0 0 "[ . 1 . 2]" 1
480 1 25 LEU QD 1 79 PHE HZ 4.460 . 8.590 6.236 4.658 6.905 . 0 0 "[ . 1 . 2]" 1
481 1 25 LEU QD 1 83 ILE MD 3.340 . 5.760 2.302 1.744 3.645 . 0 0 "[ . 1 . 2]" 1
482 1 25 LEU QD 1 91 LEU HB2 2.960 . 4.860 3.831 3.226 4.665 . 0 0 "[ . 1 . 2]" 1
483 1 25 LEU HG 1 26 VAL HA 3.570 . 6.330 2.679 2.108 3.269 . 0 0 "[ . 1 . 2]" 1
484 1 25 LEU HG 1 53 PHE QE 4.390 . 8.450 2.699 2.120 3.370 . 0 0 "[ . 1 . 2]" 1
485 1 26 VAL H 1 26 VAL HA 3.870 2.600 5.140 2.816 2.780 2.843 . 0 0 "[ . 1 . 2]" 1
486 1 26 VAL H 1 26 VAL HB 3.490 . 6.160 2.702 2.040 3.807 . 0 0 "[ . 1 . 2]" 1
487 1 26 VAL H 1 26 VAL MG1 3.620 . 6.380 2.970 1.997 3.846 . 0 0 "[ . 1 . 2]" 1
488 1 26 VAL H 1 26 VAL MG2 3.420 . 5.980 2.969 1.925 3.891 . 0 0 "[ . 1 . 2]" 1
489 1 26 VAL H 1 27 GLU H 3.690 2.490 4.890 2.801 2.703 2.897 . 0 0 "[ . 1 . 2]" 1
490 1 26 VAL H 1 29 ALA MB 3.940 . 6.700 4.562 4.369 4.918 . 0 0 "[ . 1 . 2]" 1
491 1 26 VAL H 1 54 VAL MG2 4.460 . 8.670 6.365 3.779 7.580 . 0 0 "[ . 1 . 2]" 1
492 1 26 VAL HA 1 26 VAL MG1 3.190 . 5.450 2.812 2.251 3.292 . 0 0 "[ . 1 . 2]" 1
493 1 26 VAL HA 1 26 VAL MG2 3.420 . 5.950 2.443 2.057 3.284 . 0 0 "[ . 1 . 2]" 1
494 1 26 VAL HA 1 26 VAL MG2 3.190 . 5.400 2.395 2.055 3.211 . 0 0 "[ . 1 . 2]" 1
495 1 26 VAL HA 1 92 ASN HD21 4.190 . 7.310 6.822 6.092 7.301 . 0 0 "[ . 1 . 2]" 1
496 1 26 VAL HA 1 91 LEU MD1 3.850 . 6.970 3.548 3.158 4.034 . 0 0 "[ . 1 . 2]" 1
497 1 26 VAL HA 1 91 LEU MD1 3.650 . 6.530 3.506 3.140 3.917 . 0 0 "[ . 1 . 2]" 1
498 1 26 VAL HA 1 92 ASN HD22 4.020 . 6.900 6.834 5.894 7.016 0.116 8 0 "[ . 1 . 2]" 1
499 1 26 VAL HA 1 30 LYS H 4.180 2.800 5.560 3.292 2.920 3.918 . 0 0 "[ . 1 . 2]" 1
500 1 26 VAL HA 1 37 PHE QD 4.160 . 7.810 4.432 3.820 4.848 . 0 0 "[ . 1 . 2]" 1
501 1 26 VAL HA 1 46 ILE MG 3.620 . 6.380 4.000 3.498 4.891 . 0 0 "[ . 1 . 2]" 1
502 1 26 VAL HA 1 91 LEU MD2 3.340 . 5.760 2.364 1.830 4.740 . 0 0 "[ . 1 . 2]" 1
503 1 26 VAL HB 1 27 GLU H 3.540 . 6.180 2.499 2.313 2.854 . 0 0 "[ . 1 . 2]" 1
504 1 26 VAL HB 1 50 VAL QG 3.800 . 6.920 3.453 2.216 4.720 . 0 0 "[ . 1 . 2]" 1
505 1 26 VAL HB 1 53 PHE HA 3.870 . 7.120 6.256 5.402 6.648 . 0 0 "[ . 1 . 2]" 1
506 1 26 VAL MG1 1 27 GLU H 4.030 . 7.590 3.379 2.549 4.377 . 0 0 "[ . 1 . 2]" 1
507 1 26 VAL MG1 1 28 PHE QE 4.310 . 8.230 7.461 6.011 8.024 . 0 0 "[ . 1 . 2]" 1
508 1 26 VAL MG1 1 29 ALA MB 4.540 . 8.890 4.591 3.805 5.221 . 0 0 "[ . 1 . 2]" 1
509 1 26 VAL MG1 1 50 VAL QG 3.420 . 6.010 2.287 1.825 3.371 . 0 0 "[ . 1 . 2]" 1
510 1 26 VAL MG1 1 91 LEU HB2 3.720 . 6.720 5.487 3.887 7.127 0.407 12 0 "[ . 1 . 2]" 1
511 1 26 VAL MG2 1 27 GLU H 4.250 . 8.170 3.896 2.738 4.549 . 0 0 "[ . 1 . 2]" 1
512 1 26 VAL MG2 1 28 PHE QD 4.540 . 8.890 4.500 4.075 4.936 . 0 0 "[ . 1 . 2]" 1
513 1 26 VAL MG2 1 28 PHE QE 3.690 . 6.630 3.888 3.244 4.251 . 0 0 "[ . 1 . 2]" 1
514 1 26 VAL MG2 1 29 ALA HA 3.390 . 5.810 4.417 3.732 4.865 . 0 0 "[ . 1 . 2]" 1
515 1 26 VAL MG2 1 29 ALA MB 4.160 . 7.810 3.188 2.700 3.499 . 0 0 "[ . 1 . 2]" 1
516 1 26 VAL MG2 1 46 ILE MD 3.930 . 7.180 3.988 2.391 5.334 . 0 0 "[ . 1 . 2]" 1
517 1 26 VAL MG2 1 50 VAL QG 3.650 . 6.570 2.189 1.700 3.229 . 0 0 "[ . 1 . 2]" 1
518 1 26 VAL MG2 1 53 PHE QD 3.770 . 6.770 2.770 1.906 4.256 . 0 0 "[ . 1 . 2]" 1
519 1 26 VAL MG2 1 83 ILE MG 3.460 . 5.990 4.306 3.826 4.781 . 0 0 "[ . 1 . 2]" 1
520 1 26 VAL MG2 1 91 LEU HB3 3.690 . 6.570 2.927 2.341 3.401 . 0 0 "[ . 1 . 2]" 1
521 1 27 GLU H 1 27 GLU QB 3.540 . 5.730 2.567 2.361 2.896 . 0 0 "[ . 1 . 2]" 1
522 1 27 GLU H 1 27 GLU QB 3.270 . 5.580 2.483 2.305 2.774 . 0 0 "[ . 1 . 2]" 1
523 1 27 GLU H 1 27 GLU QG 3.770 . 6.810 3.304 2.248 4.372 . 0 0 "[ . 1 . 2]" 1
524 1 27 GLU H 1 27 GLU QG 3.490 . 6.130 2.942 2.241 4.015 . 0 0 "[ . 1 . 2]" 1
525 1 27 GLU H 1 28 PHE HB3 3.180 . 4.980 4.420 4.041 4.991 0.011 8 0 "[ . 1 . 2]" 1
526 1 27 GLU H 1 28 PHE QD 3.270 . 5.170 5.174 4.730 5.295 0.125 12 0 "[ . 1 . 2]" 1
527 1 27 GLU H 1 29 ALA H 3.270 2.300 4.240 4.232 3.905 4.303 0.063 1 0 "[ . 1 . 2]" 1
528 1 27 GLU H 1 46 ILE QG 4.310 . 8.230 6.416 4.715 8.271 0.041 3 0 "[ . 1 . 2]" 1
529 1 27 GLU HA 1 28 PHE H 4.460 3.010 5.910 3.679 3.625 3.784 . 0 0 "[ . 1 . 2]" 1
530 1 27 GLU QB 1 45 SER H 3.270 . 5.170 5.100 4.923 5.205 0.035 12 0 "[ . 1 . 2]" 1
531 1 28 PHE H 1 28 PHE HA 3.540 2.390 4.690 2.803 2.759 2.853 . 0 0 "[ . 1 . 2]" 1
532 1 28 PHE H 1 28 PHE HB2 3.800 . 6.920 3.099 2.747 3.630 . 0 0 "[ . 1 . 2]" 1
533 1 28 PHE H 1 28 PHE HB3 3.800 . 6.920 2.115 1.933 2.433 . 0 0 "[ . 1 . 2]" 1
534 1 28 PHE H 1 28 PHE QD 4.000 . 7.380 3.548 2.956 3.787 . 0 0 "[ . 1 . 2]" 1
535 1 28 PHE H 1 29 ALA H 3.690 2.500 4.880 2.878 2.756 2.959 . 0 0 "[ . 1 . 2]" 1
536 1 28 PHE HA 1 28 PHE QD 3.490 . 6.130 3.525 3.227 3.775 . 0 0 "[ . 1 . 2]" 1
537 1 28 PHE HA 1 28 PHE QE 3.870 . 7.120 5.366 5.154 5.644 . 0 0 "[ . 1 . 2]" 1
538 1 28 PHE HA 1 29 ALA HA 4.030 2.710 5.350 4.849 4.749 4.949 . 0 0 "[ . 1 . 2]" 1
539 1 28 PHE HA 1 31 ASP H 4.390 2.960 5.820 4.112 3.537 4.660 . 0 0 "[ . 1 . 2]" 1
540 1 28 PHE HA 1 79 PHE QD 4.460 . 8.670 8.644 7.841 8.828 0.158 8 0 "[ . 1 . 2]" 1
541 1 28 PHE HB2 1 29 ALA H 3.690 . 6.630 4.096 3.899 4.312 . 0 0 "[ . 1 . 2]" 1
542 1 28 PHE HB3 1 29 ALA H 4.100 . 7.750 3.078 2.573 3.941 . 0 0 "[ . 1 . 2]" 1
543 1 28 PHE QD 1 29 ALA H 3.690 . 6.570 2.143 1.887 2.290 . 0 0 "[ . 1 . 2]" 1
544 1 28 PHE QD 1 29 ALA MB 4.030 . 7.540 2.363 2.143 2.750 . 0 0 "[ . 1 . 2]" 1
545 1 28 PHE QD 1 53 PHE QE 3.540 . 6.180 5.516 5.205 5.815 . 0 0 "[ . 1 . 2]" 1
546 1 28 PHE QD 1 80 ALA HA 3.800 . 6.920 3.942 2.958 4.892 . 0 0 "[ . 1 . 2]" 1
547 1 28 PHE QD 1 80 ALA MB 3.110 . 5.210 3.384 2.553 4.867 . 0 0 "[ . 1 . 2]" 1
548 1 28 PHE QD 1 88 LEU QD 4.000 . 7.380 4.981 4.402 5.540 . 0 0 "[ . 1 . 2]" 1
549 1 28 PHE QD 1 88 LEU HG 4.540 . 8.890 7.873 6.925 8.810 . 0 0 "[ . 1 . 2]" 1
550 1 28 PHE QD 1 91 LEU MD1 4.230 . 8.010 5.170 3.401 5.397 . 0 0 "[ . 1 . 2]" 1
551 1 28 PHE QD 1 91 LEU MD2 4.620 . 9.200 4.856 4.611 5.148 . 0 0 "[ . 1 . 2]" 1
552 1 28 PHE QE 1 29 ALA H 4.620 . 9.120 3.965 3.545 4.331 . 0 0 "[ . 1 . 2]" 1
553 1 28 PHE QE 1 29 ALA HA 4.410 . 8.620 3.891 3.645 4.270 . 0 0 "[ . 1 . 2]" 1
554 1 28 PHE QE 1 29 ALA MB 3.870 . 7.160 2.438 2.183 3.217 . 0 0 "[ . 1 . 2]" 1
555 1 28 PHE QE 1 32 GLU QB 4.180 . 7.960 6.360 5.887 7.073 . 0 0 "[ . 1 . 2]" 1
556 1 28 PHE QE 1 32 GLU HG2 4.710 . 9.520 7.763 6.522 9.147 . 0 0 "[ . 1 . 2]" 1
557 1 28 PHE QE 1 32 GLU HG3 4.480 . 8.830 7.555 6.547 8.731 . 0 0 "[ . 1 . 2]" 1
558 1 28 PHE QE 1 88 LEU QD 3.490 . 4.190 3.719 3.199 4.089 . 0 0 "[ . 1 . 2]" 1
559 1 28 PHE QE 1 91 LEU MD1 3.770 . 6.770 4.455 2.968 4.878 . 0 0 "[ . 1 . 2]" 1
560 1 28 PHE QE 1 91 LEU MD1 3.340 . 5.760 4.369 2.968 4.802 . 0 0 "[ . 1 . 2]" 1
561 1 28 PHE QE 1 91 LEU MD2 4.540 . 8.890 3.393 2.486 4.593 . 0 0 "[ . 1 . 2]" 1
562 1 28 PHE QE 1 91 LEU MD2 3.270 . 5.580 3.370 2.484 4.449 . 0 0 "[ . 1 . 2]" 1
563 1 28 PHE QE 1 80 ALA H 3.350 . 5.350 5.278 4.896 5.429 0.079 6 0 "[ . 1 . 2]" 1
564 1 28 PHE QE 1 80 ALA H 4.230 . 8.010 5.333 4.920 5.542 . 0 0 "[ . 1 . 2]" 1
565 1 28 PHE QE 1 80 ALA HA 3.800 . 6.970 3.337 2.722 4.025 . 0 0 "[ . 1 . 2]" 1
566 1 28 PHE QE 1 80 ALA MB 3.190 . 5.400 2.901 2.300 3.781 . 0 0 "[ . 1 . 2]" 1
567 1 28 PHE QE 1 88 LEU QD 3.230 . 5.380 3.912 3.252 4.296 . 0 0 "[ . 1 . 2]" 1
568 1 28 PHE QE 1 88 LEU HG 4.080 . 7.590 6.457 5.244 7.289 . 0 0 "[ . 1 . 2]" 1
569 1 28 PHE QE 1 91 LEU HG 3.490 . 6.130 5.177 4.834 5.410 . 0 0 "[ . 1 . 2]" 1
570 1 28 PHE HZ 1 29 ALA HA 4.330 . 8.390 5.109 4.376 5.548 . 0 0 "[ . 1 . 2]" 1
571 1 28 PHE HZ 1 29 ALA MB 3.420 . 5.950 4.050 3.767 4.659 . 0 0 "[ . 1 . 2]" 1
572 1 28 PHE HZ 1 32 GLU QB 4.180 . 7.960 7.314 6.541 8.004 0.044 7 0 "[ . 1 . 2]" 1
573 1 28 PHE HZ 1 80 ALA H 4.620 . 9.120 5.986 4.946 6.626 . 0 0 "[ . 1 . 2]" 1
574 1 28 PHE HZ 1 80 ALA HA 3.490 . 6.130 3.727 2.246 4.790 . 0 0 "[ . 1 . 2]" 1
575 1 28 PHE HZ 1 80 ALA MB 3.490 . 6.080 3.323 2.551 4.339 . 0 0 "[ . 1 . 2]" 1
576 1 28 PHE HZ 1 88 LEU QD 4.230 . 6.510 5.130 4.487 5.834 . 0 0 "[ . 1 . 2]" 1
577 1 29 ALA H 1 29 ALA HA 3.950 2.650 5.250 2.828 2.805 2.874 . 0 0 "[ . 1 . 2]" 1
578 1 29 ALA H 1 29 ALA MB 3.190 . 5.400 2.209 2.147 2.293 . 0 0 "[ . 1 . 2]" 1
579 1 29 ALA H 1 30 LYS QB 3.770 . 6.300 4.641 4.227 5.085 . 0 0 "[ . 1 . 2]" 1
580 1 29 ALA HA 1 32 GLU H 3.720 2.480 4.960 4.283 3.795 4.536 . 0 0 "[ . 1 . 2]" 1
581 1 29 ALA HA 1 91 LEU MD1 3.800 . 6.920 3.879 3.540 4.415 . 0 0 "[ . 1 . 2]" 1
582 1 29 ALA HA 1 91 LEU MD2 4.410 . 8.620 4.328 3.799 4.785 . 0 0 "[ . 1 . 2]" 1
583 1 29 ALA MB 1 30 LYS H 4.000 . 7.380 2.820 2.275 3.074 . 0 0 "[ . 1 . 2]" 1
584 1 29 ALA MB 1 88 LEU QD 2.730 . 4.350 3.490 2.875 4.204 . 0 0 "[ . 1 . 2]" 1
585 1 29 ALA MB 1 91 LEU HA 4.330 . 8.390 5.234 4.447 5.728 . 0 0 "[ . 1 . 2]" 1
586 1 29 ALA MB 1 91 LEU MD1 3.650 . 6.560 1.990 1.949 2.151 . 0 0 "[ . 1 . 2]" 1
587 1 29 ALA MB 1 91 LEU MD2 3.340 . 5.760 2.025 1.950 2.125 . 0 0 "[ . 1 . 2]" 1
588 1 29 ALA MB 1 91 LEU HG 3.420 . 5.950 2.348 2.119 2.589 . 0 0 "[ . 1 . 2]" 1
589 1 30 LYS H 1 30 LYS HA 3.800 2.550 5.050 2.836 2.758 2.872 . 0 0 "[ . 1 . 2]" 1
590 1 30 LYS H 1 30 LYS QG 4.030 . 7.540 4.045 3.783 4.384 . 0 0 "[ . 1 . 2]" 1
591 1 30 LYS H 1 31 ASP H 3.440 2.420 4.460 2.687 2.515 2.973 . 0 0 "[ . 1 . 2]" 1
592 1 30 LYS H 1 32 GLU HG2 4.230 . 8.010 6.336 5.384 6.973 . 0 0 "[ . 1 . 2]" 1
593 1 30 LYS H 1 37 PHE QD 4.230 . 8.010 5.318 4.342 6.125 . 0 0 "[ . 1 . 2]" 1
594 1 30 LYS HA 1 30 LYS QD 3.110 . 5.210 3.051 1.947 3.861 . 0 0 "[ . 1 . 2]" 1
595 1 30 LYS HA 1 30 LYS QE 3.420 . 5.950 4.109 1.887 5.029 . 0 0 "[ . 1 . 2]" 1
596 1 30 LYS HA 1 30 LYS QG 3.800 . 6.920 2.356 1.883 3.056 . 0 0 "[ . 1 . 2]" 1
597 1 30 LYS HA 1 31 ASP H 3.690 2.490 4.890 3.515 3.385 3.659 . 0 0 "[ . 1 . 2]" 1
598 1 30 LYS HA 1 32 GLU HG2 4.560 . 9.060 4.648 3.757 5.173 . 0 0 "[ . 1 . 2]" 1
599 1 30 LYS HA 1 33 CYS HB3 4.700 . 9.350 4.988 3.014 6.020 . 0 0 "[ . 1 . 2]" 1
600 1 30 LYS HA 1 37 PHE QD 3.490 . 6.130 4.945 3.768 5.644 . 0 0 "[ . 1 . 2]" 1
601 1 30 LYS HA 1 91 LEU MD1 4.100 . 7.810 4.101 3.194 6.432 . 0 0 "[ . 1 . 2]" 1
602 1 30 LYS HA 1 91 LEU HG 3.420 . 5.950 5.934 5.600 6.084 0.134 3 0 "[ . 1 . 2]" 1
603 1 30 LYS QB 1 31 ASP H 4.230 . 8.010 3.364 2.926 3.781 . 0 0 "[ . 1 . 2]" 1
604 1 30 LYS QB 1 37 PHE QD 4.390 . 8.450 3.068 2.041 4.207 . 0 0 "[ . 1 . 2]" 1
605 1 30 LYS QD 1 31 ASP H 3.620 . 6.320 5.126 4.383 5.907 . 0 0 "[ . 1 . 2]" 1
606 1 30 LYS QD 1 32 GLU QB 3.540 . 6.180 5.576 3.560 6.315 0.135 15 0 "[ . 1 . 2]" 1
607 1 30 LYS QD 1 33 CYS HB2 3.950 . 7.330 4.062 2.046 8.140 0.810 15 1 "[ . 1 + 2]" 1
608 1 30 LYS QD 1 33 CYS HB3 4.250 . 8.170 4.739 1.994 7.426 . 0 0 "[ . 1 . 2]" 1
609 1 30 LYS QD 1 37 PHE QD 3.540 . 6.180 3.350 1.979 5.631 . 0 0 "[ . 1 . 2]" 1
610 1 30 LYS QD 1 52 ILE HA 3.420 . 5.950 3.063 2.122 3.380 . 0 0 "[ . 1 . 2]" 1
611 1 30 LYS QD 1 97 MET H 3.800 . 6.920 6.470 4.781 7.074 0.154 13 0 "[ . 1 . 2]" 1
612 1 30 LYS QE 1 37 PHE QD 4.080 . 7.590 3.735 1.989 5.545 . 0 0 "[ . 1 . 2]" 1
613 1 30 LYS QE 1 91 LEU MD2 3.950 . 7.330 4.392 3.327 6.576 . 0 0 "[ . 1 . 2]" 1
614 1 30 LYS QE 1 96 LYS QD 3.110 . 5.210 5.158 4.401 5.319 0.109 14 0 "[ . 1 . 2]" 1
615 1 30 LYS QG 1 94 TYR QD 4.460 . 8.670 3.107 1.955 4.643 . 0 0 "[ . 1 . 2]" 1
616 1 30 LYS QG 1 96 LYS HA 3.570 . 6.330 6.201 5.189 6.483 0.153 5 0 "[ . 1 . 2]" 1
617 1 30 LYS QG 1 97 MET H 3.800 . 6.920 6.386 4.581 7.103 0.183 6 0 "[ . 1 . 2]" 1
618 1 31 ASP H 1 31 ASP HA 3.420 2.290 4.550 2.766 2.718 2.819 . 0 0 "[ . 1 . 2]" 1
619 1 31 ASP H 1 31 ASP HB2 3.270 . 5.620 2.505 2.251 3.789 . 0 0 "[ . 1 . 2]" 1
620 1 31 ASP H 1 31 ASP HB3 3.420 . 6.010 2.721 2.489 2.882 . 0 0 "[ . 1 . 2]" 1
621 1 31 ASP H 1 32 GLU H 3.620 2.440 4.800 2.741 2.586 2.939 . 0 0 "[ . 1 . 2]" 1
622 1 31 ASP H 1 37 PHE QD 3.860 . 6.500 4.912 3.593 5.665 . 0 0 "[ . 1 . 2]" 1
623 1 31 ASP HA 1 32 GLU H 4.620 3.120 6.120 3.345 3.274 3.461 . 0 0 "[ . 1 . 2]" 1
624 1 31 ASP HA 1 32 GLU HG3 3.690 . 6.570 4.852 4.547 5.150 . 0 0 "[ . 1 . 2]" 1
625 1 31 ASP HA 1 37 PHE QD 3.690 . 6.570 3.428 2.937 3.624 . 0 0 "[ . 1 . 2]" 1
626 1 31 ASP HA 1 46 ILE QG 3.850 . 6.970 6.072 4.720 6.677 . 0 0 "[ . 1 . 2]" 1
627 1 31 ASP HA 1 37 PHE QD 3.620 . 6.320 4.349 3.110 5.087 . 0 0 "[ . 1 . 2]" 1
628 1 31 ASP HB2 1 32 GLU H 3.570 . 6.290 4.072 3.889 4.276 . 0 0 "[ . 1 . 2]" 1
629 1 31 ASP HB3 1 32 GLU H 3.950 . 7.400 3.281 3.009 4.321 . 0 0 "[ . 1 . 2]" 1
630 1 31 ASP HB3 1 32 GLU QB 3.420 . 5.950 4.398 4.005 5.640 . 0 0 "[ . 1 . 2]" 1
631 1 32 GLU H 1 32 GLU HA 3.180 2.230 4.130 2.775 2.703 2.860 . 0 0 "[ . 1 . 2]" 1
632 1 32 GLU H 1 32 GLU QB 3.420 . 5.950 1.965 1.744 2.292 . 0 0 "[ . 1 . 2]" 1
633 1 32 GLU H 1 32 GLU HG2 3.650 . 6.470 4.153 3.424 4.409 . 0 0 "[ . 1 . 2]" 1
634 1 32 GLU H 1 32 GLU HG2 5.000 . 10.280 3.289 2.908 3.653 . 0 0 "[ . 1 . 2]" 1
635 1 32 GLU H 1 32 GLU HG3 4.030 . 7.500 3.946 2.696 4.453 . 0 0 "[ . 1 . 2]" 1
636 1 32 GLU H 1 33 CYS H 3.620 2.450 4.790 2.796 2.575 3.141 . 0 0 "[ . 1 . 2]" 1
637 1 32 GLU H 1 35 ASN HD21 3.690 . 6.110 5.947 4.919 6.198 0.088 16 0 "[ . 1 . 2]" 1
638 1 32 GLU HA 1 33 CYS H 3.520 2.470 4.570 3.588 3.449 3.753 . 0 0 "[ . 1 . 2]" 1
639 1 32 GLU QB 1 33 CYS H 4.460 . 8.740 2.981 2.376 3.854 . 0 0 "[ . 1 . 2]" 1
640 1 32 GLU QB 1 91 LEU MD1 4.250 . 8.170 4.861 3.905 6.295 . 0 0 "[ . 1 . 2]" 1
641 1 32 GLU QB 1 94 TYR QD 4.700 . 9.350 7.401 5.834 9.043 . 0 0 "[ . 1 . 2]" 1
642 1 32 GLU QB 1 94 TYR QE 4.000 . 7.380 6.200 3.914 7.540 0.160 2 0 "[ . 1 . 2]" 1
643 1 32 GLU HG2 1 33 CYS HA 3.080 . 5.080 5.160 3.811 5.856 0.776 8 2 "[ . + 1 - . 2]" 1
644 1 32 GLU HG2 1 91 LEU MD1 4.410 . 8.620 5.771 3.884 8.357 . 0 0 "[ . 1 . 2]" 1
645 1 32 GLU HG3 1 33 CYS HA 4.000 . 7.380 4.768 3.424 6.319 . 0 0 "[ . 1 . 2]" 1
646 1 32 GLU HG3 1 33 CYS HB2 3.950 . 7.330 3.541 1.990 4.937 . 0 0 "[ . 1 . 2]" 1
647 1 32 GLU HG3 1 91 LEU MD1 4.330 . 8.390 5.492 4.209 6.835 . 0 0 "[ . 1 . 2]" 1
648 1 33 CYS H 1 33 CYS HB2 4.030 . 7.510 2.574 2.185 3.642 . 0 0 "[ . 1 . 2]" 1
649 1 33 CYS H 1 34 HIS H 3.770 2.540 5.000 2.781 2.424 3.360 0.116 15 0 "[ . 1 . 2]" 1
650 1 33 CYS H 1 35 ASN H 3.020 2.120 3.920 3.937 3.616 4.037 0.117 7 0 "[ . 1 . 2]" 1
651 1 33 CYS H 1 37 PHE QD 3.520 . 5.730 5.563 4.579 5.808 0.078 3 0 "[ . 1 . 2]" 1
652 1 33 CYS HB2 1 34 HIS H 4.330 . 8.390 3.629 2.649 4.272 . 0 0 "[ . 1 . 2]" 1
653 1 33 CYS HB2 1 35 ASN H 3.600 . 5.910 4.139 2.898 5.409 . 0 0 "[ . 1 . 2]" 1
654 1 33 CYS HB2 1 35 ASN QB 3.870 . 7.120 5.131 3.269 6.655 . 0 0 "[ . 1 . 2]" 1
655 1 33 CYS HB2 1 37 PHE QD 4.250 . 8.170 5.572 4.017 7.677 . 0 0 "[ . 1 . 2]" 1
656 1 33 CYS HB3 1 35 ASN H 3.440 . 5.540 4.207 2.642 5.760 0.220 18 0 "[ . 1 . 2]" 1
657 1 33 CYS HB3 1 35 ASN QB 3.950 . 7.330 5.050 3.001 6.885 . 0 0 "[ . 1 . 2]" 1
658 1 33 CYS HB3 1 37 PHE QD 4.100 . 7.750 6.107 3.846 7.361 . 0 0 "[ . 1 . 2]" 1
659 1 33 CYS HB3 1 95 ARG HE 3.440 . 5.540 4.599 1.820 6.284 0.744 11 2 "[ . 1+ . - 2]" 1
660 1 33 CYS HB3 1 95 ARG QG 4.250 . 8.170 5.837 2.982 7.574 . 0 0 "[ . 1 . 2]" 1
661 1 34 HIS H 1 95 ARG HE 4.460 . 8.670 7.096 5.690 8.117 . 0 0 "[ . 1 . 2]" 1
662 1 34 HIS HA 1 35 ASN H 3.310 2.240 4.380 3.177 2.178 3.530 0.062 8 0 "[ . 1 . 2]" 1
663 1 34 HIS HA 1 96 LYS QG 3.420 . 5.950 5.592 4.808 5.810 . 0 0 "[ . 1 . 2]" 1
664 1 34 HIS QB 1 35 ASN H 3.440 . 5.540 3.327 2.731 4.108 . 0 0 "[ . 1 . 2]" 1
665 1 34 HIS QB 1 36 PRO HB3 4.030 . 7.540 6.506 6.011 7.050 . 0 0 "[ . 1 . 2]" 1
666 1 34 HIS QB 1 37 PHE H 4.080 . 7.590 6.983 6.278 7.298 . 0 0 "[ . 1 . 2]" 1
667 1 34 HIS QB 1 95 ARG HE 3.930 . 7.180 5.916 5.066 6.594 . 0 0 "[ . 1 . 2]" 1
668 1 34 HIS QB 1 96 LYS QB 3.870 . 7.120 4.824 3.227 6.736 . 0 0 "[ . 1 . 2]" 1
669 1 34 HIS QB 1 96 LYS HB3 4.390 . 8.450 5.598 3.326 8.406 . 0 0 "[ . 1 . 2]" 1
670 1 35 ASN H 1 35 ASN HA 3.720 2.500 4.940 2.899 2.769 2.987 . 0 0 "[ . 1 . 2]" 1
671 1 35 ASN H 1 35 ASN QB 3.690 . 6.570 2.710 1.724 3.423 . 0 0 "[ . 1 . 2]" 1
672 1 35 ASN H 1 35 ASN HD22 3.600 . 5.910 3.648 2.934 5.401 . 0 0 "[ . 1 . 2]" 1
673 1 35 ASN H 1 36 PRO QD 3.440 . 5.540 4.423 4.197 4.560 . 0 0 "[ . 1 . 2]" 1
674 1 35 ASN H 1 37 PHE HB2 4.480 . 8.830 4.445 4.284 4.562 . 0 0 "[ . 1 . 2]" 1
675 1 35 ASN H 1 37 PHE QD 3.600 . 5.910 4.527 2.936 5.874 . 0 0 "[ . 1 . 2]" 1
676 1 35 ASN H 1 95 ARG HA 3.490 . 6.130 5.507 4.493 6.063 . 0 0 "[ . 1 . 2]" 1
677 1 35 ASN H 1 96 LYS QB 3.940 . 6.700 4.712 3.536 6.529 . 0 0 "[ . 1 . 2]" 1
678 1 35 ASN HA 1 35 ASN HD22 4.460 . 8.670 4.984 3.719 5.175 . 0 0 "[ . 1 . 2]" 1
679 1 35 ASN HA 1 36 PRO QD 3.420 . 6.010 2.149 2.021 2.533 . 0 0 "[ . 1 . 2]" 1
680 1 35 ASN HA 1 37 PHE H 3.490 2.340 4.640 4.214 3.684 4.735 0.095 1 0 "[ . 1 . 2]" 1
681 1 35 ASN QB 1 36 PRO QD 3.720 . 6.720 2.496 1.934 3.587 . 0 0 "[ . 1 . 2]" 1
682 1 35 ASN QB 1 37 PHE HB2 4.330 . 8.390 5.739 4.691 7.231 . 0 0 "[ . 1 . 2]" 1
683 1 35 ASN QB 1 37 PHE QD 4.030 . 7.590 3.746 1.920 5.809 . 0 0 "[ . 1 . 2]" 1
684 1 35 ASN HD21 1 37 PHE QD 3.180 . 4.980 3.100 1.866 4.352 . 0 0 "[ . 1 . 2]" 1
685 1 35 ASN HD22 1 36 PRO HA 4.310 . 8.230 6.363 5.440 8.043 . 0 0 "[ . 1 . 2]" 1
686 1 35 ASN HD22 1 36 PRO HB3 4.310 . 8.230 7.886 7.228 8.306 0.076 7 0 "[ . 1 . 2]" 1
687 1 35 ASN HD22 1 36 PRO QD 4.250 . 8.170 5.327 3.652 6.114 . 0 0 "[ . 1 . 2]" 1
688 1 35 ASN HD22 1 37 PHE QD 3.540 . 6.130 3.165 1.608 5.395 . 0 0 "[ . 1 . 2]" 1
689 1 35 ASN HD22 1 95 ARG HB2 3.690 . 6.110 5.839 3.835 7.077 0.967 9 4 "[ . * +1 * . - 2]" 1
690 1 35 ASN HD22 1 96 LYS QB 3.490 . 6.130 3.960 1.583 6.157 0.027 12 0 "[ . 1 . 2]" 1
691 1 36 PRO HA 1 37 PHE H 4.160 2.810 5.510 3.186 2.713 3.552 0.097 1 0 "[ . 1 . 2]" 1
692 1 36 PRO HA 1 38 ILE MG 3.930 . 7.180 6.125 4.089 6.969 . 0 0 "[ . 1 . 2]" 1
693 1 36 PRO HB2 1 45 SER H 4.700 . 9.350 7.689 6.951 9.015 . 0 0 "[ . 1 . 2]" 1
694 1 36 PRO HB3 1 37 PHE H 3.100 . 4.810 3.361 2.532 4.101 . 0 0 "[ . 1 . 2]" 1
695 1 36 PRO HB3 1 38 ILE MD 3.110 . 5.210 4.292 2.778 5.252 0.042 15 0 "[ . 1 . 2]" 1
696 1 36 PRO HB3 1 38 ILE MG 3.690 . 6.570 6.208 3.629 6.620 0.050 3 0 "[ . 1 . 2]" 1
697 1 36 PRO QD 1 37 PHE H 3.690 . 5.730 3.052 2.287 4.236 . 0 0 "[ . 1 . 2]" 1
698 1 36 PRO QD 1 37 PHE QD 4.000 . 7.380 4.994 3.953 5.853 . 0 0 "[ . 1 . 2]" 1
699 1 36 PRO QD 1 95 ARG H 3.600 . 5.910 5.813 3.783 6.257 0.347 19 0 "[ . 1 . 2]" 1
700 1 36 PRO QG 1 37 PHE H 4.250 . 8.170 3.519 2.552 4.480 . 0 0 "[ . 1 . 2]" 1
701 1 36 PRO QG 1 38 ILE HA 3.950 . 7.330 5.901 4.447 7.426 0.096 3 0 "[ . 1 . 2]" 1
702 1 36 PRO QG 1 38 ILE MD 3.490 . 6.130 4.398 2.809 6.046 . 0 0 "[ . 1 . 2]" 1
703 1 37 PHE H 1 37 PHE HA 2.960 . 3.950 2.420 2.105 2.934 . 0 0 "[ . 1 . 2]" 1
704 1 37 PHE H 1 37 PHE HB2 3.620 . 6.320 3.923 3.524 4.172 . 0 0 "[ . 1 . 2]" 1
705 1 37 PHE H 1 37 PHE HB3 3.520 . 5.730 3.032 2.737 3.784 . 0 0 "[ . 1 . 2]" 1
706 1 37 PHE H 1 37 PHE QD 3.100 . 4.810 3.160 2.205 3.954 . 0 0 "[ . 1 . 2]" 1
707 1 37 PHE H 1 38 ILE H 3.620 2.440 4.800 3.130 2.584 3.488 . 0 0 "[ . 1 . 2]" 1
708 1 37 PHE H 1 38 ILE HB 3.600 . 5.910 5.106 4.413 5.610 . 0 0 "[ . 1 . 2]" 1
709 1 37 PHE H 1 38 ILE MD 3.770 . 6.300 4.758 3.760 5.378 . 0 0 "[ . 1 . 2]" 1
710 1 37 PHE H 1 45 SER QB 3.770 . 6.300 5.175 4.115 6.059 . 0 0 "[ . 1 . 2]" 1
711 1 37 PHE HA 1 37 PHE QD 3.490 . 6.130 3.646 3.072 3.764 . 0 0 "[ . 1 . 2]" 1
712 1 37 PHE HA 1 38 ILE H 3.420 2.300 4.540 2.756 2.346 3.299 . 0 0 "[ . 1 . 2]" 1
713 1 37 PHE HA 1 38 ILE H 3.690 . 6.570 2.650 2.282 3.056 . 0 0 "[ . 1 . 2]" 1
714 1 37 PHE HA 1 38 ILE MG 3.270 . 5.580 3.556 3.217 4.390 . 0 0 "[ . 1 . 2]" 1
715 1 37 PHE HB2 1 46 ILE MD 4.480 . 8.830 5.543 3.914 6.536 . 0 0 "[ . 1 . 2]" 1
716 1 37 PHE HB2 1 46 ILE MD 3.720 . 6.720 5.393 3.837 6.169 . 0 0 "[ . 1 . 2]" 1
717 1 37 PHE HB2 1 46 ILE MG 4.180 . 7.960 4.444 2.876 5.189 . 0 0 "[ . 1 . 2]" 1
718 1 37 PHE HB2 1 47 PRO HA 4.330 . 8.390 8.094 6.267 8.995 0.605 15 1 "[ . 1 + 2]" 1
719 1 37 PHE HB3 1 46 ILE MD 3.870 . 7.120 6.597 5.086 7.535 0.415 4 0 "[ . 1 . 2]" 1
720 1 37 PHE HB3 1 46 ILE MG 4.250 . 8.170 6.409 3.535 7.928 . 0 0 "[ . 1 . 2]" 1
721 1 37 PHE QD 1 38 ILE H 4.540 . 8.890 4.418 3.635 4.908 . 0 0 "[ . 1 . 2]" 1
722 1 37 PHE QD 1 38 ILE H 4.390 . 8.380 3.925 3.121 4.653 . 0 0 "[ . 1 . 2]" 1
723 1 37 PHE QD 1 46 ILE HA 4.390 . 8.450 5.277 4.405 5.770 . 0 0 "[ . 1 . 2]" 1
724 1 37 PHE QD 1 46 ILE HA 4.230 . 8.010 5.510 4.354 6.745 . 0 0 "[ . 1 . 2]" 1
725 1 37 PHE QD 1 46 ILE MD 4.230 . 6.530 5.781 4.492 6.554 0.024 5 0 "[ . 1 . 2]" 1
726 1 37 PHE QD 1 46 ILE MD 4.160 . 7.810 5.685 4.455 6.468 . 0 0 "[ . 1 . 2]" 1
727 1 37 PHE QD 1 46 ILE QG 3.950 . 7.330 5.812 4.822 7.398 0.068 5 0 "[ . 1 . 2]" 1
728 1 37 PHE QD 1 46 ILE MG 3.690 . 6.630 4.422 3.110 4.875 . 0 0 "[ . 1 . 2]" 1
729 1 37 PHE QD 1 47 PRO HD3 4.310 . 8.230 5.404 4.073 5.969 . 0 0 "[ . 1 . 2]" 1
730 1 37 PHE QD 1 47 PRO HG3 4.030 . 7.540 6.543 4.167 7.320 . 0 0 "[ . 1 . 2]" 1
731 1 37 PHE QD 1 94 TYR QD 3.310 . 5.620 5.591 5.143 5.810 0.190 13 0 "[ . 1 . 2]" 1
732 1 37 PHE QE 1 38 ILE HB 3.930 . 7.180 5.163 3.733 6.741 . 0 0 "[ . 1 . 2]" 1
733 1 37 PHE QE 1 38 ILE MD 3.870 . 7.120 3.947 2.484 5.920 . 0 0 "[ . 1 . 2]" 1
734 1 38 ILE H 1 38 ILE HA 3.950 2.640 5.260 2.909 2.836 2.944 . 0 0 "[ . 1 . 2]" 1
735 1 38 ILE H 1 38 ILE HB 3.720 . 6.720 2.558 2.291 3.203 . 0 0 "[ . 1 . 2]" 1
736 1 38 ILE H 1 38 ILE MD 4.180 . 7.960 3.849 3.375 4.870 . 0 0 "[ . 1 . 2]" 1
737 1 38 ILE H 1 38 ILE MD 3.520 . 5.730 3.343 2.613 3.561 . 0 0 "[ . 1 . 2]" 1
738 1 38 ILE H 1 38 ILE HG12 3.800 . 6.920 3.636 2.377 4.759 . 0 0 "[ . 1 . 2]" 1
739 1 38 ILE H 1 38 ILE HG13 3.800 . 6.990 3.165 2.278 4.642 . 0 0 "[ . 1 . 2]" 1
740 1 38 ILE H 1 38 ILE MG 4.030 . 7.540 3.761 2.623 3.926 . 0 0 "[ . 1 . 2]" 1
741 1 38 ILE H 1 39 ASP H 4.230 2.850 5.610 4.448 4.152 4.666 . 0 0 "[ . 1 . 2]" 1
742 1 38 ILE HA 1 38 ILE MD 3.800 . 6.920 3.474 2.069 4.030 . 0 0 "[ . 1 . 2]" 1
743 1 38 ILE HA 1 38 ILE MD 3.420 . 5.950 2.358 1.960 3.090 . 0 0 "[ . 1 . 2]" 1
744 1 38 ILE HA 1 38 ILE MG 3.270 . 5.580 2.487 2.227 3.279 . 0 0 "[ . 1 . 2]" 1
745 1 38 ILE HA 1 39 ASP H 3.110 2.080 4.140 2.338 2.170 2.505 . 0 0 "[ . 1 . 2]" 1
746 1 38 ILE HA 1 44 GLU H 4.460 3.010 5.910 4.777 3.739 5.127 . 0 0 "[ . 1 . 2]" 1
747 1 38 ILE HA 1 44 GLU HA 3.650 2.460 4.840 2.742 2.462 2.957 . 0 0 "[ . 1 . 2]" 1
748 1 38 ILE HA 1 45 SER H 3.460 2.320 4.600 3.655 3.057 4.342 . 0 0 "[ . 1 . 2]" 1
749 1 38 ILE HA 1 45 SER QB 4.180 . 7.960 3.630 3.219 4.237 . 0 0 "[ . 1 . 2]" 1
750 1 38 ILE HB 1 38 ILE MD 2.810 . 4.520 2.619 2.220 3.336 . 0 0 "[ . 1 . 2]" 1
751 1 38 ILE HB 1 39 ASP H 3.570 . 6.270 4.006 3.706 4.213 . 0 0 "[ . 1 . 2]" 1
752 1 38 ILE HB 1 42 GLY HA2 4.030 . 7.540 5.238 4.789 7.580 0.040 20 0 "[ . 1 . 2]" 1
753 1 38 ILE HB 1 43 ASN H 4.000 . 7.320 6.394 6.123 6.734 . 0 0 "[ . 1 . 2]" 1
754 1 38 ILE HB 1 43 ASN H 4.620 . 9.120 5.177 4.957 5.534 . 0 0 "[ . 1 . 2]" 1
755 1 38 ILE MD 1 39 ASP H 3.950 . 7.330 4.630 3.433 5.162 . 0 0 "[ . 1 . 2]" 1
756 1 38 ILE MD 1 42 GLY HA2 3.650 . 6.530 4.725 3.640 6.093 . 0 0 "[ . 1 . 2]" 1
757 1 38 ILE MD 1 42 GLY HA3 3.420 . 5.950 5.474 4.318 6.013 0.063 18 0 "[ . 1 . 2]" 1
758 1 38 ILE MD 1 44 GLU HA 3.850 . 6.910 4.339 2.442 5.823 . 0 0 "[ . 1 . 2]" 1
759 1 38 ILE MD 1 45 SER H 4.000 . 7.420 5.430 3.652 6.504 . 0 0 "[ . 1 . 2]" 1
760 1 38 ILE HG12 1 39 ASP H 3.860 . 6.500 4.494 2.465 5.212 . 0 0 "[ . 1 . 2]" 1
761 1 38 ILE HG12 1 41 ASP H 3.100 . 4.810 3.812 1.935 4.533 . 0 0 "[ . 1 . 2]" 1
762 1 38 ILE HG13 1 44 GLU H 5.080 . 10.520 6.628 2.420 8.087 . 0 0 "[ . 1 . 2]" 1
763 1 38 ILE HG13 1 44 GLU QB 3.690 . 6.570 5.540 2.924 6.589 0.019 2 0 "[ . 1 . 2]" 1
764 1 38 ILE MG 1 39 ASP H 3.420 . 5.920 2.357 2.123 3.106 . 0 0 "[ . 1 . 2]" 1
765 1 38 ILE MG 1 41 ASP H 3.520 . 5.730 4.843 4.567 5.747 0.017 20 0 "[ . 1 . 2]" 1
766 1 38 ILE MG 1 42 GLY H 3.650 . 6.530 3.538 3.295 4.640 . 0 0 "[ . 1 . 2]" 1
767 1 38 ILE MG 1 42 GLY HA2 3.490 . 6.140 2.560 2.039 6.088 . 0 0 "[ . 1 . 2]" 1
768 1 38 ILE MG 1 42 GLY HA3 3.800 . 6.860 3.622 3.234 5.157 . 0 0 "[ . 1 . 2]" 1
769 1 38 ILE MG 1 43 ASN H 3.440 . 5.540 3.570 3.192 5.698 0.158 20 0 "[ . 1 . 2]" 1
770 1 38 ILE MG 1 44 GLU QB 3.110 . 5.210 5.089 4.311 5.288 0.078 3 0 "[ . 1 . 2]" 1
771 1 39 ASP H 1 39 ASP HB2 3.850 . 6.910 2.899 2.431 3.894 . 0 0 "[ . 1 . 2]" 1
772 1 39 ASP H 1 39 ASP HB3 3.950 . 7.290 3.165 2.646 3.826 . 0 0 "[ . 1 . 2]" 1
773 1 39 ASP H 1 41 ASP H 3.940 2.780 5.100 4.447 4.164 5.186 0.086 18 0 "[ . 1 . 2]" 1
774 1 39 ASP H 1 42 GLY HA3 3.860 2.710 5.010 4.892 2.699 5.161 0.151 7 0 "[ . 1 . 2]" 1
775 1 39 ASP H 1 43 ASN H 3.270 2.280 4.260 3.139 2.871 4.389 0.129 20 0 "[ . 1 . 2]" 1
776 1 39 ASP H 1 44 GLU HA 3.770 2.530 5.010 4.127 3.767 4.623 . 0 0 "[ . 1 . 2]" 1
777 1 39 ASP H 1 45 SER H 4.460 3.010 5.910 5.202 4.632 5.964 0.054 16 0 "[ . 1 . 2]" 1
778 1 39 ASP H 1 45 SER QB 3.440 . 5.540 4.118 3.387 5.185 . 0 0 "[ . 1 . 2]" 1
779 1 39 ASP HA 1 39 ASP HB2 2.880 . 4.680 2.749 2.450 3.105 . 0 0 "[ . 1 . 2]" 1
780 1 39 ASP HA 1 40 LYS HA 3.570 2.390 4.750 4.336 4.255 4.446 . 0 0 "[ . 1 . 2]" 1
781 1 39 ASP HB2 1 45 SER QB 4.180 . 7.120 3.902 2.032 6.139 . 0 0 "[ . 1 . 2]" 1
782 1 39 ASP HB3 1 40 LYS H 4.100 . 7.750 2.998 1.807 3.643 . 0 0 "[ . 1 . 2]" 1
783 1 40 LYS H 1 40 LYS HA 3.870 2.590 5.150 2.713 2.586 2.860 0.004 13 0 "[ . 1 . 2]" 1
784 1 40 LYS H 1 40 LYS HB2 4.080 . 7.590 2.771 2.143 3.622 . 0 0 "[ . 1 . 2]" 1
785 1 40 LYS H 1 40 LYS HB3 4.160 . 7.810 2.833 2.237 3.607 . 0 0 "[ . 1 . 2]" 1
786 1 40 LYS H 1 41 ASP H 2.930 2.050 3.810 3.135 2.683 3.416 . 0 0 "[ . 1 . 2]" 1
787 1 40 LYS HA 1 40 LYS QB 2.580 . 4.020 2.324 2.168 2.435 . 0 0 "[ . 1 . 2]" 1
788 1 40 LYS HA 1 41 ASP H 3.620 2.440 4.800 3.464 3.310 3.618 . 0 0 "[ . 1 . 2]" 1
789 1 40 LYS QB 1 41 ASP H 2.850 . 4.290 3.431 2.301 3.901 . 0 0 "[ . 1 . 2]" 1
790 1 41 ASP H 1 41 ASP HB2 3.420 . 5.950 2.640 2.358 3.045 . 0 0 "[ . 1 . 2]" 1
791 1 41 ASP H 1 41 ASP HB3 3.150 . 5.250 3.178 2.577 3.986 . 0 0 "[ . 1 . 2]" 1
792 1 41 ASP H 1 41 ASP HB3 3.490 . 6.130 3.036 2.497 3.718 . 0 0 "[ . 1 . 2]" 1
793 1 41 ASP H 1 42 GLY HA2 3.180 2.230 4.130 4.153 4.047 4.182 0.052 3 0 "[ . 1 . 2]" 1
794 1 41 ASP HA 1 42 GLY H 3.020 2.120 3.920 3.298 3.092 3.416 . 0 0 "[ . 1 . 2]" 1
795 1 41 ASP HA 1 42 GLY HA3 3.800 2.550 5.050 4.730 4.565 5.070 0.020 20 0 "[ . 1 . 2]" 1
796 1 41 ASP HA 1 42 GLY HA3 4.410 . 8.620 4.192 4.103 4.451 . 0 0 "[ . 1 . 2]" 1
797 1 41 ASP HB2 1 42 GLY H 3.350 . 5.350 3.890 3.296 4.369 . 0 0 "[ . 1 . 2]" 1
798 1 41 ASP HB3 1 42 GLY H 3.270 . 5.170 3.925 3.343 4.447 . 0 0 "[ . 1 . 2]" 1
799 1 41 ASP HB3 1 43 ASN H 3.460 . 6.030 2.586 2.224 3.486 . 0 0 "[ . 1 . 2]" 1
800 1 41 ASP HB3 1 43 ASN HA 3.340 . 5.760 5.580 4.941 5.931 0.171 18 0 "[ . 1 . 2]" 1
801 1 41 ASP HB3 1 43 ASN HD22 3.390 . 5.810 3.564 3.137 4.024 . 0 0 "[ . 1 . 2]" 1
802 1 42 GLY H 1 43 ASN H 3.080 2.070 4.090 2.526 2.153 3.862 . 0 0 "[ . 1 . 2]" 1
803 1 42 GLY H 1 43 ASN HA 4.080 2.760 5.400 5.108 4.918 5.268 . 0 0 "[ . 1 . 2]" 1
804 1 42 GLY H 1 43 ASN HD21 4.230 . 8.080 5.822 3.859 7.205 . 0 0 "[ . 1 . 2]" 1
805 1 42 GLY HA2 1 43 ASN H 3.570 2.400 4.740 2.785 2.323 3.080 0.077 20 0 "[ . 1 . 2]" 1
806 1 42 GLY HA3 1 43 ASN H 3.950 2.650 5.250 3.452 3.400 3.535 . 0 0 "[ . 1 . 2]" 1
807 1 43 ASN H 1 43 ASN HB3 3.230 . 5.440 3.127 2.278 3.759 . 0 0 "[ . 1 . 2]" 1
808 1 43 ASN H 1 43 ASN HD21 3.860 . 6.500 3.904 2.147 4.923 . 0 0 "[ . 1 . 2]" 1
809 1 43 ASN H 1 44 GLU H 4.460 3.010 5.910 4.503 4.423 4.637 . 0 0 "[ . 1 . 2]" 1
810 1 43 ASN HA 1 43 ASN HD21 3.350 . 5.350 3.530 2.125 4.539 . 0 0 "[ . 1 . 2]" 1
811 1 43 ASN HA 1 43 ASN HD22 3.520 . 5.730 4.271 3.570 5.254 . 0 0 "[ . 1 . 2]" 1
812 1 43 ASN HA 1 44 GLU H 2.960 . 3.930 2.438 2.132 2.811 . 0 0 "[ . 1 . 2]" 1
813 1 43 ASN HA 1 44 GLU QB 3.570 . 6.330 4.263 3.839 4.975 . 0 0 "[ . 1 . 2]" 1
814 1 43 ASN HB2 1 43 ASN HD21 3.310 . 5.620 2.791 2.235 3.638 . 0 0 "[ . 1 . 2]" 1
815 1 43 ASN HB2 1 44 GLU H 3.690 . 6.570 3.680 2.447 4.187 . 0 0 "[ . 1 . 2]" 1
816 1 43 ASN HB3 1 43 ASN HD21 3.230 . 5.490 3.201 2.356 3.705 . 0 0 "[ . 1 . 2]" 1
817 1 43 ASN HB3 1 44 GLU H 3.930 . 7.180 3.125 2.331 4.054 . 0 0 "[ . 1 . 2]" 1
818 1 43 ASN HD21 1 44 GLU HA 3.870 . 7.120 6.313 4.405 7.146 0.026 8 0 "[ . 1 . 2]" 1
819 1 44 GLU H 1 44 GLU HA 3.690 2.500 4.880 2.804 2.464 2.930 0.036 20 0 "[ . 1 . 2]" 1
820 1 44 GLU H 1 44 GLU QB 3.340 . 5.730 2.369 1.961 2.720 . 0 0 "[ . 1 . 2]" 1
821 1 44 GLU H 1 44 GLU HG2 3.440 . 5.540 3.278 1.736 4.566 . 0 0 "[ . 1 . 2]" 1
822 1 44 GLU HA 1 44 GLU HG2 3.650 . 6.530 3.761 2.479 4.310 . 0 0 "[ . 1 . 2]" 1
823 1 44 GLU HA 1 44 GLU HG2 4.000 . 7.380 3.512 2.244 4.232 . 0 0 "[ . 1 . 2]" 1
824 1 44 GLU HA 1 44 GLU HG3 3.650 . 6.530 3.449 2.362 4.312 . 0 0 "[ . 1 . 2]" 1
825 1 44 GLU HA 1 45 SER H 3.190 2.150 4.230 2.339 2.186 2.501 . 0 0 "[ . 1 . 2]" 1
826 1 44 GLU QB 1 45 SER H 3.850 . 6.970 2.954 2.514 3.737 . 0 0 "[ . 1 . 2]" 1
827 1 44 GLU HG2 1 45 SER H 4.250 . 8.100 4.523 2.361 5.268 . 0 0 "[ . 1 . 2]" 1
828 1 44 GLU HG3 1 45 SER H 4.100 . 7.750 4.216 2.719 5.302 . 0 0 "[ . 1 . 2]" 1
829 1 44 GLU HG3 1 46 ILE MD 3.570 . 6.330 4.857 2.716 6.356 0.026 7 0 "[ . 1 . 2]" 1
830 1 45 SER H 1 45 SER HA 4.230 2.850 5.610 2.973 2.914 3.037 . 0 0 "[ . 1 . 2]" 1
831 1 45 SER H 1 45 SER QB 3.650 . 6.570 2.653 2.435 2.913 . 0 0 "[ . 1 . 2]" 1
832 1 45 SER H 1 46 ILE QG 3.860 . 6.500 4.496 3.579 5.996 . 0 0 "[ . 1 . 2]" 1
833 1 45 SER HA 1 46 ILE H 3.650 2.460 4.840 2.398 2.352 2.488 0.108 16 0 "[ . 1 . 2]" 1
834 1 46 ILE H 1 46 ILE HB 4.000 . 7.380 2.805 2.340 3.919 . 0 0 "[ . 1 . 2]" 1
835 1 46 ILE H 1 46 ILE MD 4.330 . 8.340 3.391 2.181 4.395 . 0 0 "[ . 1 . 2]" 1
836 1 46 ILE H 1 46 ILE QG 3.870 . 7.080 3.021 2.021 3.613 . 0 0 "[ . 1 . 2]" 1
837 1 46 ILE H 1 46 ILE MG 4.180 . 8.010 3.746 3.108 3.970 . 0 0 "[ . 1 . 2]" 1
838 1 46 ILE HA 1 46 ILE MD 3.490 . 6.130 3.324 2.046 4.204 . 0 0 "[ . 1 . 2]" 1
839 1 46 ILE HA 1 46 ILE QG 3.490 . 6.130 2.705 1.997 3.581 . 0 0 "[ . 1 . 2]" 1
840 1 46 ILE HA 1 51 LEU QD 3.800 . 6.920 4.754 4.150 5.030 . 0 0 "[ . 1 . 2]" 1
841 1 46 ILE HB 1 46 ILE MD 3.490 . 6.130 2.690 2.190 3.338 . 0 0 "[ . 1 . 2]" 1
842 1 46 ILE MD 1 50 VAL QG 4.180 . 7.960 3.696 1.997 5.521 . 0 0 "[ . 1 . 2]" 1
843 1 46 ILE MD 1 54 VAL MG2 3.650 . 6.490 3.245 1.987 4.256 . 0 0 "[ . 1 . 2]" 1
844 1 46 ILE QG 1 50 VAL H 3.950 . 7.330 6.699 5.383 7.376 0.046 8 0 "[ . 1 . 2]" 1
845 1 46 ILE QG 1 54 VAL MG2 2.960 . 4.860 3.633 2.263 4.864 0.004 10 0 "[ . 1 . 2]" 1
846 1 46 ILE MG 1 47 PRO HD2 3.490 . 6.130 2.958 2.125 3.775 . 0 0 "[ . 1 . 2]" 1
847 1 46 ILE MG 1 47 PRO HD2 3.870 . 7.120 2.031 1.893 2.278 . 0 0 "[ . 1 . 2]" 1
848 1 46 ILE MG 1 47 PRO HD3 3.420 . 5.950 4.077 3.355 4.695 . 0 0 "[ . 1 . 2]" 1
849 1 46 ILE MG 1 47 PRO HD3 3.950 . 7.330 3.258 2.802 3.408 . 0 0 "[ . 1 . 2]" 1
850 1 46 ILE MG 1 50 VAL H 3.720 . 6.720 4.409 3.614 5.772 . 0 0 "[ . 1 . 2]" 1
851 1 46 ILE MG 1 50 VAL HB 3.110 . 5.210 3.419 1.999 4.830 . 0 0 "[ . 1 . 2]" 1
852 1 46 ILE MG 1 50 VAL QG 3.720 . 4.350 2.189 1.874 2.773 . 0 0 "[ . 1 . 2]" 1
853 1 46 ILE MG 1 51 LEU H 4.000 . 7.380 2.735 2.558 2.937 . 0 0 "[ . 1 . 2]" 1
854 1 46 ILE MG 1 54 VAL MG1 4.080 . 7.590 2.458 1.947 3.770 . 0 0 "[ . 1 . 2]" 1
855 1 46 ILE MG 1 51 LEU H 3.650 . 6.530 3.359 2.722 5.090 . 0 0 "[ . 1 . 2]" 1
856 1 46 ILE MG 1 51 LEU HA 4.030 . 7.540 2.148 1.947 2.749 . 0 0 "[ . 1 . 2]" 1
857 1 46 ILE MG 1 54 VAL MG2 3.690 . 6.510 2.109 1.810 2.636 . 0 0 "[ . 1 . 2]" 1
858 1 46 ILE MG 1 54 VAL MG2 3.340 . 5.760 2.807 1.958 4.708 . 0 0 "[ . 1 . 2]" 1
859 1 47 PRO HA 1 47 PRO HG3 3.800 . 6.920 4.135 3.772 4.246 . 0 0 "[ . 1 . 2]" 1
860 1 47 PRO HA 1 49 GLY H 3.800 2.550 5.050 4.979 4.725 5.101 0.051 2 0 "[ . 1 . 2]" 1
861 1 47 PRO QB 1 48 SER HA 3.690 . 6.570 4.177 3.699 4.295 . 0 0 "[ . 1 . 2]" 1
862 1 47 PRO QB 1 51 LEU H 3.650 . 6.530 5.008 4.616 5.333 . 0 0 "[ . 1 . 2]" 1
863 1 47 PRO QB 1 52 ILE H 3.800 . 6.920 6.963 6.812 7.003 0.083 4 0 "[ . 1 . 2]" 1
864 1 47 PRO QB 1 95 ARG H 2.930 . 4.460 4.284 3.645 4.688 0.228 2 0 "[ . 1 . 2]" 1
865 1 47 PRO HG2 1 50 VAL QG 3.800 . 6.860 2.539 1.931 3.299 . 0 0 "[ . 1 . 2]" 1
866 1 47 PRO HG2 1 52 ILE MG 4.000 . 7.380 7.291 6.691 7.478 0.098 3 0 "[ . 1 . 2]" 1
867 1 47 PRO HG3 1 50 VAL H 4.390 . 8.450 4.651 3.500 5.308 . 0 0 "[ . 1 . 2]" 1
868 1 47 PRO HG3 1 50 VAL QG 3.420 . 5.950 3.453 2.703 4.188 . 0 0 "[ . 1 . 2]" 1
869 1 48 SER H 1 48 SER HA 3.460 2.340 4.580 2.670 2.579 2.844 . 0 0 "[ . 1 . 2]" 1
870 1 48 SER H 1 49 GLY HA3 4.460 3.020 5.900 5.568 5.312 5.809 . 0 0 "[ . 1 . 2]" 1
871 1 48 SER H 1 51 LEU HB3 4.080 . 7.590 4.920 4.412 5.950 . 0 0 "[ . 1 . 2]" 1
872 1 48 SER HA 1 52 ILE H 4.160 . 7.810 3.098 2.723 3.415 . 0 0 "[ . 1 . 2]" 1
873 1 49 GLY H 1 49 GLY HA2 3.570 2.390 4.750 2.942 2.916 2.961 . 0 0 "[ . 1 . 2]" 1
874 1 49 GLY H 1 49 GLY HA3 3.870 2.600 5.140 2.473 2.465 2.483 0.135 18 0 "[ . 1 . 2]" 1
875 1 49 GLY H 1 50 VAL H 3.770 2.650 4.890 2.674 2.606 2.852 0.044 12 0 "[ . 1 . 2]" 1
876 1 49 GLY HA2 1 50 VAL H 3.800 2.550 5.050 3.574 3.445 3.669 . 0 0 "[ . 1 . 2]" 1
877 1 49 GLY HA2 1 52 ILE H 3.770 2.650 4.890 3.367 3.142 3.615 . 0 0 "[ . 1 . 2]" 1
878 1 49 GLY HA2 1 52 ILE MD 3.650 . 6.530 3.137 2.144 4.964 . 0 0 "[ . 1 . 2]" 1
879 1 49 GLY HA2 1 52 ILE MG 3.570 . 6.330 2.760 2.159 3.555 . 0 0 "[ . 1 . 2]" 1
880 1 49 GLY HA2 1 53 PHE H 4.080 2.760 5.400 4.529 4.393 4.653 . 0 0 "[ . 1 . 2]" 1
881 1 49 GLY HA3 1 50 VAL H 4.100 2.750 5.450 2.876 2.744 3.005 0.006 6 0 "[ . 1 . 2]" 1
882 1 49 GLY HA3 1 94 TYR H 4.460 . 8.670 4.609 3.074 5.816 . 0 0 "[ . 1 . 2]" 1
883 1 50 VAL H 1 50 VAL HA 4.180 2.800 5.560 2.809 2.716 2.876 0.084 6 0 "[ . 1 . 2]" 1
884 1 50 VAL H 1 50 VAL HB 3.800 . 6.860 2.630 2.122 3.738 . 0 0 "[ . 1 . 2]" 1
885 1 50 VAL H 1 50 VAL QG 3.190 . 5.400 2.414 1.670 3.003 . 0 0 "[ . 1 . 2]" 1
886 1 50 VAL H 1 83 ILE HB 4.160 . 7.810 5.032 3.122 6.061 . 0 0 "[ . 1 . 2]" 1
887 1 50 VAL H 1 91 LEU HA 3.690 . 6.570 5.179 4.165 6.417 . 0 0 "[ . 1 . 2]" 1
888 1 50 VAL H 1 94 TYR H 3.860 . 6.500 4.257 3.565 5.509 . 0 0 "[ . 1 . 2]" 1
889 1 50 VAL H 1 94 TYR HA 4.460 3.010 5.910 4.493 2.980 6.024 0.114 8 0 "[ . 1 . 2]" 1
890 1 50 VAL H 1 94 TYR HB2 4.390 . 8.450 3.689 2.367 4.477 . 0 0 "[ . 1 . 2]" 1
891 1 50 VAL HA 1 51 LEU H 3.650 . 6.530 2.970 2.719 3.232 . 0 0 "[ . 1 . 2]" 1
892 1 50 VAL HA 1 51 LEU QD 3.340 . 5.760 5.874 5.828 5.924 0.164 10 0 "[ . 1 . 2]" 1
893 1 50 VAL HA 1 92 ASN HB2 3.950 . 7.330 7.132 6.398 7.464 0.134 17 0 "[ . 1 . 2]" 1
894 1 50 VAL HA 1 92 ASN HB3 3.950 . 7.330 6.480 5.859 7.135 . 0 0 "[ . 1 . 2]" 1
895 1 50 VAL HB 1 51 LEU H 3.860 . 6.500 3.692 2.905 4.196 . 0 0 "[ . 1 . 2]" 1
896 1 50 VAL HB 1 95 ARG H 4.030 . 7.540 5.481 3.654 7.617 0.077 3 0 "[ . 1 . 2]" 1
897 1 50 VAL QG 1 51 LEU H 3.190 . 5.400 3.187 2.708 3.590 . 0 0 "[ . 1 . 2]" 1
898 1 50 VAL QG 1 53 PHE H 4.850 . 9.810 3.954 3.729 4.238 . 0 0 "[ . 1 . 2]" 1
899 1 50 VAL QG 1 53 PHE QD 4.700 . 9.350 2.440 1.957 3.274 . 0 0 "[ . 1 . 2]" 1
900 1 50 VAL QG 1 53 PHE QD 3.420 . 5.950 2.371 1.945 3.039 . 0 0 "[ . 1 . 2]" 1
901 1 50 VAL QG 1 91 LEU HA 3.650 . 6.530 2.683 2.051 3.247 . 0 0 "[ . 1 . 2]" 1
902 1 50 VAL QG 1 91 LEU MD2 3.620 . 6.380 2.850 2.031 4.711 . 0 0 "[ . 1 . 2]" 1
903 1 50 VAL QG 1 92 ASN HB3 3.650 . 6.530 6.208 5.430 6.868 0.338 18 0 "[ . 1 . 2]" 1
904 1 50 VAL QG 1 94 TYR QD 4.770 . 9.500 2.317 1.941 3.629 . 0 0 "[ . 1 . 2]" 1
905 1 50 VAL QG 1 94 TYR QD 4.080 . 7.590 2.319 1.941 3.655 . 0 0 "[ . 1 . 2]" 1
906 1 51 LEU H 1 51 LEU HA 4.410 2.960 5.860 2.878 2.865 2.893 0.095 14 0 "[ . 1 . 2]" 1
907 1 51 LEU H 1 52 ILE MG 3.720 . 6.720 4.222 3.763 4.496 . 0 0 "[ . 1 . 2]" 1
908 1 51 LEU HA 1 51 LEU QD 3.800 . 6.920 2.250 2.075 2.711 . 0 0 "[ . 1 . 2]" 1
909 1 51 LEU HA 1 53 PHE H 3.180 . 4.980 3.349 3.277 3.464 . 0 0 "[ . 1 . 2]" 1
910 1 51 LEU HA 1 55 ALA H 3.690 . 6.110 3.549 3.296 3.682 . 0 0 "[ . 1 . 2]" 1
911 1 51 LEU HA 1 53 PHE H 3.460 2.340 4.580 4.251 4.117 4.461 . 0 0 "[ . 1 . 2]" 1
912 1 51 LEU HA 1 54 VAL HB 4.250 . 8.170 4.330 1.890 4.917 . 0 0 "[ . 1 . 2]" 1
913 1 51 LEU HA 1 54 VAL MG2 3.270 . 5.580 2.054 1.793 2.996 . 0 0 "[ . 1 . 2]" 1
914 1 51 LEU HB3 1 52 ILE H 3.600 . 5.910 2.794 2.613 3.105 . 0 0 "[ . 1 . 2]" 1
915 1 51 LEU HB3 1 53 PHE H 4.770 . 9.580 5.067 4.871 5.324 . 0 0 "[ . 1 . 2]" 1
916 1 51 LEU QD 1 53 PHE H 3.770 . 6.300 4.911 4.395 5.189 . 0 0 "[ . 1 . 2]" 1
917 1 51 LEU QD 1 56 LYS QG 3.460 . 5.990 5.946 5.259 6.131 0.141 18 0 "[ . 1 . 2]" 1
918 1 51 LEU HG 1 53 PHE QD 4.460 . 8.670 8.392 7.671 8.697 0.027 19 0 "[ . 1 . 2]" 1
919 1 52 ILE H 1 52 ILE HA 3.870 2.590 5.150 2.871 2.826 2.906 . 0 0 "[ . 1 . 2]" 1
920 1 52 ILE H 1 52 ILE HB 3.800 . 6.860 3.641 2.552 3.843 . 0 0 "[ . 1 . 2]" 1
921 1 52 ILE H 1 52 ILE MD 4.080 . 7.590 3.905 2.931 4.624 . 0 0 "[ . 1 . 2]" 1
922 1 52 ILE H 1 52 ILE QG 3.870 . 7.120 3.163 2.381 4.165 . 0 0 "[ . 1 . 2]" 1
923 1 52 ILE H 1 52 ILE MG 4.030 . 7.510 2.200 1.957 2.455 . 0 0 "[ . 1 . 2]" 1
924 1 52 ILE HA 1 52 ILE MD 3.270 . 5.580 4.087 3.660 4.238 . 0 0 "[ . 1 . 2]" 1
925 1 52 ILE HA 1 52 ILE MG 3.270 . 5.640 2.521 2.200 3.237 . 0 0 "[ . 1 . 2]" 1
926 1 52 ILE HA 1 55 ALA H 4.180 . 7.960 3.455 3.240 3.658 . 0 0 "[ . 1 . 2]" 1
927 1 52 ILE HB 1 52 ILE MD 3.040 . 5.040 2.631 2.282 3.321 . 0 0 "[ . 1 . 2]" 1
928 1 52 ILE HB 1 53 PHE H 3.650 . 6.570 4.233 4.056 4.516 . 0 0 "[ . 1 . 2]" 1
929 1 52 ILE HB 1 53 PHE HA 4.000 . 7.380 5.260 4.861 6.101 . 0 0 "[ . 1 . 2]" 1
930 1 52 ILE HB 1 56 LYS HA 3.540 . 6.180 6.119 3.765 6.398 0.218 15 0 "[ . 1 . 2]" 1
931 1 52 ILE MD 1 53 PHE HA 3.420 . 5.900 5.115 3.803 5.930 0.030 9 0 "[ . 1 . 2]" 1
932 1 52 ILE MD 1 53 PHE QD 4.080 . 7.660 6.153 4.890 7.072 . 0 0 "[ . 1 . 2]" 1
933 1 52 ILE MD 1 55 ALA MB 3.620 . 6.380 5.918 5.233 6.386 0.006 4 0 "[ . 1 . 2]" 1
934 1 52 ILE MD 1 56 LYS QE 3.190 . 5.400 3.961 2.207 5.416 0.016 20 0 "[ . 1 . 2]" 1
935 1 52 ILE QG 1 53 PHE H 3.860 . 6.500 2.877 2.370 4.353 . 0 0 "[ . 1 . 2]" 1
936 1 52 ILE QG 1 87 ILE MG 2.880 . 4.680 4.176 3.745 4.654 . 0 0 "[ . 1 . 2]" 1
937 1 52 ILE QG 1 90 LYS HB2 4.080 . 7.590 4.853 3.667 6.201 . 0 0 "[ . 1 . 2]" 1
938 1 52 ILE MG 1 53 PHE H 4.000 . 7.380 3.736 2.458 4.229 . 0 0 "[ . 1 . 2]" 1
939 1 52 ILE MG 1 56 LYS QE 3.340 . 5.760 4.517 3.214 5.773 0.013 5 0 "[ . 1 . 2]" 1
940 1 52 ILE MG 1 56 LYS QG 3.270 . 5.580 4.058 3.552 4.606 . 0 0 "[ . 1 . 2]" 1
941 1 53 PHE H 1 53 PHE HA 3.570 2.390 4.750 2.845 2.811 2.875 . 0 0 "[ . 1 . 2]" 1
942 1 53 PHE H 1 53 PHE HB2 3.420 . 5.950 2.749 2.452 2.913 . 0 0 "[ . 1 . 2]" 1
943 1 53 PHE H 1 53 PHE HB3 3.570 . 6.290 2.397 2.100 2.655 . 0 0 "[ . 1 . 2]" 1
944 1 53 PHE H 1 53 PHE QD 3.860 . 6.500 4.141 3.912 4.237 . 0 0 "[ . 1 . 2]" 1
945 1 53 PHE H 1 54 VAL H 4.020 2.820 5.220 2.887 2.815 2.959 0.005 4 0 "[ . 1 . 2]" 1
946 1 53 PHE H 1 54 VAL HA 4.330 2.900 5.760 5.381 5.313 5.522 . 0 0 "[ . 1 . 2]" 1
947 1 53 PHE H 1 54 VAL HB 3.860 . 6.500 6.279 4.497 6.610 0.110 9 0 "[ . 1 . 2]" 1
948 1 53 PHE H 1 55 ALA H 3.860 2.710 5.010 4.885 4.700 5.035 0.025 13 0 "[ . 1 . 2]" 1
949 1 53 PHE H 1 57 ALA MB 3.570 . 6.330 5.504 5.330 5.718 . 0 0 "[ . 1 . 2]" 1
950 1 53 PHE H 1 83 ILE QG 4.080 . 7.590 4.488 3.974 5.027 . 0 0 "[ . 1 . 2]" 1
951 1 53 PHE H 1 87 ILE MG 4.000 . 7.380 4.807 4.165 6.180 . 0 0 "[ . 1 . 2]" 1
952 1 53 PHE HA 1 54 VAL H 4.030 2.710 5.350 3.692 3.608 3.745 . 0 0 "[ . 1 . 2]" 1
953 1 53 PHE HA 1 67 LEU HG 3.460 . 5.990 4.402 3.775 5.183 . 0 0 "[ . 1 . 2]" 1
954 1 53 PHE HA 1 83 ILE HB 4.000 . 7.380 6.469 5.425 7.062 . 0 0 "[ . 1 . 2]" 1
955 1 53 PHE HA 1 87 ILE MD 3.770 . 6.770 4.341 4.050 4.547 . 0 0 "[ . 1 . 2]" 1
956 1 53 PHE HA 1 87 ILE QG 3.620 . 6.380 4.507 4.150 4.886 . 0 0 "[ . 1 . 2]" 1
957 1 53 PHE HA 1 87 ILE MG 2.960 . 4.860 1.998 1.764 2.131 . 0 0 "[ . 1 . 2]" 1
958 1 53 PHE HA 1 87 ILE MG 3.230 . 5.440 2.617 1.920 4.073 . 0 0 "[ . 1 . 2]" 1
959 1 53 PHE HA 1 90 LYS HB2 4.230 . 8.010 4.064 2.827 5.601 . 0 0 "[ . 1 . 2]" 1
960 1 53 PHE HA 1 91 LEU MD2 4.620 . 9.120 6.997 5.941 8.689 . 0 0 "[ . 1 . 2]" 1
961 1 53 PHE HB3 1 54 VAL H 3.860 . 6.500 2.778 2.456 3.087 . 0 0 "[ . 1 . 2]" 1
962 1 53 PHE QD 1 54 VAL HA 4.330 . 8.320 4.147 3.546 4.516 . 0 0 "[ . 1 . 2]" 1
963 1 53 PHE QD 1 54 VAL MG1 3.540 . 6.180 2.572 1.896 3.543 . 0 0 "[ . 1 . 2]" 1
964 1 53 PHE QD 1 54 VAL MG2 3.110 . 5.210 4.668 2.183 5.303 0.093 2 0 "[ . 1 . 2]" 1
965 1 53 PHE QD 1 56 LYS H 4.160 . 7.810 5.530 5.078 6.068 . 0 0 "[ . 1 . 2]" 1
966 1 53 PHE QD 1 56 LYS QG 4.390 . 8.450 5.402 3.747 6.578 . 0 0 "[ . 1 . 2]" 1
967 1 53 PHE QD 1 57 ALA MB 3.690 . 6.570 2.843 1.899 3.613 . 0 0 "[ . 1 . 2]" 1
968 1 53 PHE QD 1 58 ALA HA 3.620 . 6.380 3.722 2.055 4.434 . 0 0 "[ . 1 . 2]" 1
969 1 53 PHE QD 1 84 PRO HB3 4.850 . 9.810 4.552 3.481 6.053 . 0 0 "[ . 1 . 2]" 1
970 1 53 PHE QD 1 87 ILE MG 2.960 . 4.860 2.098 1.867 2.759 . 0 0 "[ . 1 . 2]" 1
971 1 53 PHE QD 1 87 ILE MG 3.390 . 5.810 2.202 1.871 3.851 . 0 0 "[ . 1 . 2]" 1
972 1 53 PHE QD 1 88 LEU HA 3.490 . 6.130 4.360 3.583 5.233 . 0 0 "[ . 1 . 2]" 1
973 1 53 PHE QD 1 88 LEU QD 3.150 . 5.250 4.762 4.190 5.209 . 0 0 "[ . 1 . 2]" 1
974 1 53 PHE QD 1 90 LYS QB 3.570 . 6.330 2.809 2.092 3.370 . 0 0 "[ . 1 . 2]" 1
975 1 53 PHE QD 1 91 LEU MD1 3.690 . 6.570 5.225 4.625 5.860 . 0 0 "[ . 1 . 2]" 1
976 1 53 PHE QD 1 91 LEU MD2 4.390 . 8.450 3.576 2.490 5.639 . 0 0 "[ . 1 . 2]" 1
977 1 53 PHE QE 1 91 LEU MD2 3.490 . 6.130 2.497 1.946 4.175 . 0 0 "[ . 1 . 2]" 1
978 1 53 PHE QE 1 83 ILE QG 3.690 . 6.570 3.300 2.412 4.147 . 0 0 "[ . 1 . 2]" 1
979 1 53 PHE QE 1 87 ILE MG 3.690 . 6.570 3.497 2.420 4.683 . 0 0 "[ . 1 . 2]" 1
980 1 53 PHE QE 1 88 LEU HA 4.460 . 8.670 2.816 2.243 3.754 . 0 0 "[ . 1 . 2]" 1
981 1 53 PHE QE 1 88 LEU QD 4.000 . 7.450 3.222 2.473 3.680 . 0 0 "[ . 1 . 2]" 1
982 1 53 PHE QE 1 91 LEU HB2 4.310 . 8.230 2.746 2.207 3.078 . 0 0 "[ . 1 . 2]" 1
983 1 53 PHE QE 1 91 LEU MD1 4.390 . 8.450 4.387 3.077 4.829 . 0 0 "[ . 1 . 2]" 1
984 1 53 PHE HZ 1 86 THR MG 4.390 . 8.450 8.439 8.108 8.624 0.174 11 0 "[ . 1 . 2]" 1
985 1 53 PHE HZ 1 88 LEU HA 3.690 . 6.630 3.230 2.663 3.804 . 0 0 "[ . 1 . 2]" 1
986 1 53 PHE HZ 1 88 LEU QD 3.040 . 5.040 2.642 2.125 3.261 . 0 0 "[ . 1 . 2]" 1
987 1 53 PHE HZ 1 91 LEU HB3 3.460 . 5.990 4.284 3.414 4.726 . 0 0 "[ . 1 . 2]" 1
988 1 53 PHE HZ 1 91 LEU MD1 4.930 . 10.050 4.811 2.289 5.539 . 0 0 "[ . 1 . 2]" 1
989 1 53 PHE HZ 1 91 LEU MD2 4.460 . 8.670 4.026 2.713 5.465 . 0 0 "[ . 1 . 2]" 1
990 1 54 VAL H 1 54 VAL HA 4.180 2.800 5.560 2.776 2.751 2.816 0.049 4 0 "[ . 1 . 2]" 1
991 1 54 VAL H 1 54 VAL HB 3.770 . 6.770 3.489 2.150 3.778 . 0 0 "[ . 1 . 2]" 1
992 1 54 VAL H 1 54 VAL MG1 4.000 . 7.340 2.468 2.118 3.697 . 0 0 "[ . 1 . 2]" 1
993 1 54 VAL H 1 54 VAL MG2 3.420 . 5.980 2.378 2.048 2.838 . 0 0 "[ . 1 . 2]" 1
994 1 54 VAL H 1 55 ALA H 3.940 2.760 5.120 3.194 3.085 3.365 . 0 0 "[ . 1 . 2]" 1
995 1 54 VAL HA 1 54 VAL MG1 3.420 . 5.990 2.388 2.140 2.741 . 0 0 "[ . 1 . 2]" 1
996 1 54 VAL HA 1 54 VAL MG2 3.340 . 5.790 3.106 2.327 3.304 . 0 0 "[ . 1 . 2]" 1
997 1 54 VAL HA 1 55 ALA H 4.390 2.960 5.820 3.586 3.521 3.657 . 0 0 "[ . 1 . 2]" 1
998 1 54 VAL HA 1 57 ALA H 4.250 2.850 5.650 4.000 3.714 4.248 . 0 0 "[ . 1 . 2]" 1
999 1 54 VAL HB 1 55 ALA H 3.620 . 6.320 3.459 2.492 3.785 . 0 0 "[ . 1 . 2]" 1
1000 1 54 VAL MG1 1 55 ALA H 3.540 . 6.180 3.824 2.625 4.188 . 0 0 "[ . 1 . 2]" 1
1001 1 54 VAL MG2 1 55 ALA H 4.390 . 8.450 2.351 1.925 4.116 . 0 0 "[ . 1 . 2]" 1
1002 1 55 ALA H 1 55 ALA HA 3.570 2.390 4.750 2.723 2.658 2.798 . 0 0 "[ . 1 . 2]" 1
1003 1 55 ALA H 1 55 ALA MB 3.310 . 5.620 2.173 2.121 2.250 . 0 0 "[ . 1 . 2]" 1
1004 1 55 ALA H 1 55 ALA MB 2.880 . 4.680 2.081 2.014 2.163 . 0 0 "[ . 1 . 2]" 1
1005 1 55 ALA H 1 57 ALA H 3.940 2.780 5.100 4.604 4.479 4.842 . 0 0 "[ . 1 . 2]" 1
1006 1 55 ALA HA 1 56 LYS H 4.310 2.910 5.710 3.785 3.729 3.870 . 0 0 "[ . 1 . 2]" 1
1007 1 55 ALA HA 1 57 ALA H 4.330 . 8.390 3.978 3.771 4.191 . 0 0 "[ . 1 . 2]" 1
1008 1 55 ALA HA 1 58 ALA H 3.520 2.470 4.570 4.263 3.958 4.572 0.002 3 0 "[ . 1 . 2]" 1
1009 1 55 ALA MB 1 56 LYS H 3.930 . 7.180 2.672 2.439 2.857 . 0 0 "[ . 1 . 2]" 1
1010 1 55 ALA MB 1 57 ALA HA 4.100 . 7.750 6.552 6.378 6.738 . 0 0 "[ . 1 . 2]" 1
1011 1 56 LYS H 1 56 LYS HA 3.950 2.660 5.240 2.828 2.785 2.867 . 0 0 "[ . 1 . 2]" 1
1012 1 56 LYS H 1 56 LYS QG 3.650 . 6.570 2.375 2.176 2.668 . 0 0 "[ . 1 . 2]" 1
1013 1 56 LYS H 1 57 ALA H 4.000 2.710 5.290 2.701 2.636 2.838 0.074 12 0 "[ . 1 . 2]" 1
1014 1 56 LYS H 1 84 PRO QG 3.930 . 7.180 7.282 6.951 7.460 0.280 12 0 "[ . 1 . 2]" 1
1015 1 56 LYS HA 1 56 LYS QE 3.340 . 5.760 4.573 4.063 5.521 . 0 0 "[ . 1 . 2]" 1
1016 1 56 LYS HA 1 56 LYS QG 3.270 . 5.580 2.898 2.301 3.377 . 0 0 "[ . 1 . 2]" 1
1017 1 56 LYS HA 1 60 PHE H 3.270 . 5.170 3.152 3.079 3.282 . 0 0 "[ . 1 . 2]" 1
1018 1 56 LYS HA 1 59 GLN H 4.230 2.850 5.610 3.370 3.135 3.673 . 0 0 "[ . 1 . 2]" 1
1019 1 56 LYS HA 1 59 GLN QG 3.340 . 5.760 2.091 1.813 2.786 . 0 0 "[ . 1 . 2]" 1
1020 1 56 LYS HA 1 59 GLN HE21 3.860 . 6.500 4.513 2.489 5.136 . 0 0 "[ . 1 . 2]" 1
1021 1 56 LYS QB 1 56 LYS QE 3.720 . 6.720 2.773 1.963 3.573 . 0 0 "[ . 1 . 2]" 1
1022 1 56 LYS QB 1 57 ALA H 4.000 . 5.730 3.494 2.973 3.958 . 0 0 "[ . 1 . 2]" 1
1023 1 56 LYS QB 1 58 ALA H 3.770 . 6.300 5.366 5.045 5.614 . 0 0 "[ . 1 . 2]" 1
1024 1 56 LYS QB 1 58 ALA H 3.600 . 5.910 4.810 4.401 5.115 . 0 0 "[ . 1 . 2]" 1
1025 1 56 LYS QB 1 59 GLN QB 3.420 . 5.950 4.550 3.285 5.125 . 0 0 "[ . 1 . 2]" 1
1026 1 56 LYS QB 1 59 GLN HE21 3.860 . 6.500 5.368 3.527 6.237 . 0 0 "[ . 1 . 2]" 1
1027 1 56 LYS QB 1 59 GLN HE22 3.520 . 5.730 5.104 3.694 5.526 . 0 0 "[ . 1 . 2]" 1
1028 1 56 LYS QB 1 59 GLN QG 3.720 . 6.720 3.781 2.865 5.492 . 0 0 "[ . 1 . 2]" 1
1029 1 56 LYS QB 1 87 ILE MG 2.660 . 4.190 2.145 1.869 2.480 . 0 0 "[ . 1 . 2]" 1
1030 1 56 LYS QE 1 57 ALA H 3.860 . 6.500 5.589 4.595 6.324 . 0 0 "[ . 1 . 2]" 1
1031 1 56 LYS QE 1 86 THR HA 3.720 . 6.720 4.557 2.236 6.727 0.007 12 0 "[ . 1 . 2]" 1
1032 1 57 ALA H 1 57 ALA HA 3.650 2.460 4.840 2.791 2.748 2.862 . 0 0 "[ . 1 . 2]" 1
1033 1 57 ALA H 1 57 ALA MB 3.150 . 5.290 2.104 2.018 2.281 . 0 0 "[ . 1 . 2]" 1
1034 1 57 ALA H 1 57 ALA MB 2.960 . 4.860 1.877 1.797 1.997 . 0 0 "[ . 1 . 2]" 1
1035 1 57 ALA H 1 60 PHE H 3.860 . 6.500 3.858 3.691 4.097 . 0 0 "[ . 1 . 2]" 1
1036 1 57 ALA H 1 87 ILE QG 3.850 . 6.970 3.022 2.295 3.504 . 0 0 "[ . 1 . 2]" 1
1037 1 57 ALA HA 1 58 ALA H 4.620 3.120 6.120 3.563 3.504 3.720 . 0 0 "[ . 1 . 2]" 1
1038 1 57 ALA HA 1 60 PHE H 3.870 . 7.120 3.680 3.507 3.861 . 0 0 "[ . 1 . 2]" 1
1039 1 57 ALA HA 1 60 PHE HB2 3.800 . 6.920 3.945 3.517 4.522 . 0 0 "[ . 1 . 2]" 1
1040 1 57 ALA HA 1 60 PHE HB3 3.800 . 6.920 3.563 2.975 5.889 . 0 0 "[ . 1 . 2]" 1
1041 1 57 ALA HA 1 60 PHE QD 4.230 . 8.010 4.370 2.351 5.355 . 0 0 "[ . 1 . 2]" 1
1042 1 57 ALA HA 1 83 ILE MG 3.040 . 5.040 4.168 2.936 5.201 0.161 20 0 "[ . 1 . 2]" 1
1043 1 57 ALA HA 1 84 PRO HB2 4.410 . 8.620 5.202 3.764 5.967 . 0 0 "[ . 1 . 2]" 1
1044 1 57 ALA HA 1 84 PRO HB3 4.180 . 7.960 5.643 4.932 6.246 . 0 0 "[ . 1 . 2]" 1
1045 1 57 ALA HA 1 84 PRO QG 4.030 . 7.540 2.241 1.966 2.754 . 0 0 "[ . 1 . 2]" 1
1046 1 57 ALA HA 1 87 ILE MD 3.570 . 6.270 2.618 2.000 3.059 . 0 0 "[ . 1 . 2]" 1
1047 1 57 ALA HA 1 87 ILE QG 3.800 . 6.920 2.409 2.006 3.658 . 0 0 "[ . 1 . 2]" 1
1048 1 57 ALA MB 1 58 ALA H 3.310 . 5.590 2.122 1.968 2.457 . 0 0 "[ . 1 . 2]" 1
1049 1 57 ALA MB 1 58 ALA HA 4.310 . 8.230 3.729 3.624 3.869 . 0 0 "[ . 1 . 2]" 1
1050 1 57 ALA MB 1 60 PHE H 4.620 . 9.120 4.755 4.550 4.930 . 0 0 "[ . 1 . 2]" 1
1051 1 57 ALA MB 1 61 TYR HA 3.770 . 6.770 6.739 6.512 6.898 0.128 15 0 "[ . 1 . 2]" 1
1052 1 57 ALA MB 1 61 TYR QD 3.420 . 5.950 5.524 3.409 5.984 0.034 11 0 "[ . 1 . 2]" 1
1053 1 57 ALA MB 1 87 ILE MD 3.770 . 6.770 4.254 2.287 5.032 . 0 0 "[ . 1 . 2]" 1
1054 1 58 ALA H 1 58 ALA HA 3.570 2.390 4.750 2.870 2.800 2.905 . 0 0 "[ . 1 . 2]" 1
1055 1 58 ALA H 1 58 ALA MB 2.960 . 4.860 2.183 1.999 2.303 . 0 0 "[ . 1 . 2]" 1
1056 1 58 ALA H 1 59 GLN H 3.620 2.450 4.790 2.686 2.495 2.967 . 0 0 "[ . 1 . 2]" 1
1057 1 58 ALA H 1 59 GLN QB 4.160 . 7.810 4.829 4.070 5.494 . 0 0 "[ . 1 . 2]" 1
1058 1 58 ALA H 1 59 GLN QB 3.600 . 5.910 4.149 4.006 4.393 . 0 0 "[ . 1 . 2]" 1
1059 1 58 ALA HA 1 61 TYR H 3.650 2.440 4.860 3.175 2.821 3.675 . 0 0 "[ . 1 . 2]" 1
1060 1 58 ALA MB 1 59 GLN H 3.570 . 6.270 3.072 2.668 3.328 . 0 0 "[ . 1 . 2]" 1
1061 1 59 GLN H 1 59 GLN HA 3.770 2.550 4.990 2.852 2.772 2.918 . 0 0 "[ . 1 . 2]" 1
1062 1 59 GLN H 1 59 GLN QG 3.800 . 6.990 2.827 2.147 3.997 . 0 0 "[ . 1 . 2]" 1
1063 1 59 GLN H 1 60 PHE H 3.620 2.440 4.800 2.664 2.434 2.878 0.006 4 0 "[ . 1 . 2]" 1
1064 1 59 GLN HA 1 62 MET ME 3.110 . 5.210 4.562 3.637 5.261 0.051 17 0 "[ . 1 . 2]" 1
1065 1 59 GLN QB 1 60 PHE H 3.540 . 6.180 2.658 2.350 2.798 . 0 0 "[ . 1 . 2]" 1
1066 1 59 GLN QB 1 60 PHE H 4.160 . 7.810 3.408 2.609 3.897 . 0 0 "[ . 1 . 2]" 1
1067 1 59 GLN HE21 1 60 PHE HA 4.460 . 8.670 4.041 2.213 4.630 . 0 0 "[ . 1 . 2]" 1
1068 1 59 GLN HE22 1 59 GLN QG 3.650 . 6.570 3.462 3.326 3.578 . 0 0 "[ . 1 . 2]" 1
1069 1 59 GLN QG 1 60 PHE HA 3.870 . 7.120 4.136 3.593 5.982 . 0 0 "[ . 1 . 2]" 1
1070 1 59 GLN QG 1 87 ILE QG 4.460 . 8.670 6.014 5.207 7.289 . 0 0 "[ . 1 . 2]" 1
1071 1 60 PHE H 1 60 PHE HA 3.490 2.330 4.650 2.905 2.857 2.982 . 0 0 "[ . 1 . 2]" 1
1072 1 60 PHE H 1 60 PHE HB2 3.460 . 6.050 2.424 2.117 2.729 . 0 0 "[ . 1 . 2]" 1
1073 1 60 PHE H 1 60 PHE HB2 3.800 . 6.920 2.337 2.056 2.537 . 0 0 "[ . 1 . 2]" 1
1074 1 60 PHE H 1 60 PHE HB3 3.620 . 6.420 2.687 2.364 3.828 . 0 0 "[ . 1 . 2]" 1
1075 1 60 PHE H 1 60 PHE HB3 4.030 . 7.540 2.289 2.091 3.183 . 0 0 "[ . 1 . 2]" 1
1076 1 60 PHE H 1 60 PHE QD 3.850 . 7.020 3.980 2.381 4.244 . 0 0 "[ . 1 . 2]" 1
1077 1 60 PHE H 1 61 TYR H 4.000 2.710 5.290 2.729 2.668 2.958 0.042 17 0 "[ . 1 . 2]" 1
1078 1 60 PHE H 1 87 ILE MD 4.700 . 9.350 5.197 3.284 5.904 . 0 0 "[ . 1 . 2]" 1
1079 1 60 PHE H 1 87 ILE QG 3.440 . 5.540 4.914 4.196 5.388 . 0 0 "[ . 1 . 2]" 1
1080 1 60 PHE HA 1 60 PHE QD 3.650 . 6.530 3.099 2.488 3.330 . 0 0 "[ . 1 . 2]" 1
1081 1 60 PHE HA 1 63 THR MG 3.080 . 5.080 2.515 2.176 3.024 . 0 0 "[ . 1 . 2]" 1
1082 1 60 PHE HB2 1 61 TYR H 4.460 . 8.670 3.581 2.134 4.261 . 0 0 "[ . 1 . 2]" 1
1083 1 60 PHE HB2 1 87 ILE MD 3.720 . 6.780 3.827 2.258 5.006 . 0 0 "[ . 1 . 2]" 1
1084 1 60 PHE HB3 1 61 TYR H 3.180 . 4.980 2.283 2.133 2.549 . 0 0 "[ . 1 . 2]" 1
1085 1 60 PHE HB3 1 87 ILE MD 3.570 . 6.330 4.018 2.341 5.375 . 0 0 "[ . 1 . 2]" 1
1086 1 60 PHE QD 1 61 TYR H 3.930 . 7.140 3.669 3.276 4.433 . 0 0 "[ . 1 . 2]" 1
1087 1 60 PHE QD 1 61 TYR HB3 4.080 . 7.590 4.821 3.607 5.896 . 0 0 "[ . 1 . 2]" 1
1088 1 60 PHE QD 1 61 TYR QD 3.850 . 7.040 4.343 2.428 5.748 . 0 0 "[ . 1 . 2]" 1
1089 1 60 PHE QD 1 84 PRO HB2 4.250 . 8.220 3.984 2.721 4.553 . 0 0 "[ . 1 . 2]" 1
1090 1 60 PHE QD 1 84 PRO HB3 4.160 . 7.810 3.368 2.784 4.262 . 0 0 "[ . 1 . 2]" 1
1091 1 60 PHE QD 1 84 PRO QD 4.540 . 8.970 3.212 2.130 4.341 . 0 0 "[ . 1 . 2]" 1
1092 1 60 PHE QD 1 84 PRO QG 4.390 . 8.380 2.774 2.223 3.192 . 0 0 "[ . 1 . 2]" 1
1093 1 60 PHE QD 1 87 ILE MD 4.030 . 7.540 2.701 1.971 4.760 . 0 0 "[ . 1 . 2]" 1
1094 1 60 PHE QE 1 61 TYR HB2 3.930 . 7.180 6.105 5.405 7.171 . 0 0 "[ . 1 . 2]" 1
1095 1 60 PHE QE 1 61 TYR HB3 4.310 . 8.230 7.064 5.246 7.978 . 0 0 "[ . 1 . 2]" 1
1096 1 60 PHE QE 1 61 TYR HB3 4.460 . 8.670 6.152 4.919 7.033 . 0 0 "[ . 1 . 2]" 1
1097 1 60 PHE QE 1 84 PRO QD 4.330 . 8.390 3.773 2.769 4.517 . 0 0 "[ . 1 . 2]" 1
1098 1 60 PHE QE 1 84 PRO HB2 4.180 . 8.010 3.822 2.781 4.628 . 0 0 "[ . 1 . 2]" 1
1099 1 60 PHE QE 1 84 PRO HB3 4.390 . 8.380 3.286 2.539 5.026 . 0 0 "[ . 1 . 2]" 1
1100 1 60 PHE QE 1 84 PRO QD 4.160 . 7.810 4.325 3.015 5.006 . 0 0 "[ . 1 . 2]" 1
1101 1 60 PHE QE 1 84 PRO QG 3.930 . 7.180 3.736 3.063 4.472 . 0 0 "[ . 1 . 2]" 1
1102 1 60 PHE QE 1 84 PRO QG 4.230 . 8.010 3.412 2.210 4.033 . 0 0 "[ . 1 . 2]" 1
1103 1 60 PHE QE 1 87 ILE MD 3.950 . 7.330 3.158 2.100 5.675 . 0 0 "[ . 1 . 2]" 1
1104 1 60 PHE HZ 1 84 PRO QD 4.620 . 9.120 5.718 4.804 6.545 . 0 0 "[ . 1 . 2]" 1
1105 1 60 PHE HZ 1 84 PRO QG 5.160 . 10.770 4.746 3.957 5.627 . 0 0 "[ . 1 . 2]" 1
1106 1 60 PHE HZ 1 87 ILE HB 4.620 . 9.120 8.207 6.350 9.161 0.041 8 0 "[ . 1 . 2]" 1
1107 1 61 TYR H 1 61 TYR HA 3.420 2.300 4.540 2.812 2.750 2.898 . 0 0 "[ . 1 . 2]" 1
1108 1 61 TYR H 1 61 TYR HB2 3.390 . 5.870 2.554 2.164 3.927 . 0 0 "[ . 1 . 2]" 1
1109 1 61 TYR H 1 61 TYR QD 3.540 . 6.150 3.730 1.854 4.216 . 0 0 "[ . 1 . 2]" 1
1110 1 61 TYR H 1 61 TYR QE 4.620 3.120 6.120 5.028 3.903 5.687 . 0 0 "[ . 1 . 2]" 1
1111 1 61 TYR H 1 62 MET H 3.690 2.490 4.890 2.894 2.750 3.100 . 0 0 "[ . 1 . 2]" 1
1112 1 61 TYR H 1 62 MET HA 3.490 . 6.130 5.078 3.111 5.476 . 0 0 "[ . 1 . 2]" 1
1113 1 61 TYR H 1 67 LEU QD 4.000 . 7.380 2.313 1.672 3.054 . 0 0 "[ . 1 . 2]" 1
1114 1 61 TYR H 1 82 GLU QG 4.460 . 8.670 2.693 2.182 3.235 . 0 0 "[ . 1 . 2]" 1
1115 1 61 TYR HA 1 61 TYR QD 3.570 . 6.330 2.731 2.177 3.632 . 0 0 "[ . 1 . 2]" 1
1116 1 61 TYR HA 1 62 MET H 3.350 2.350 4.350 3.600 3.506 3.666 . 0 0 "[ . 1 . 2]" 1
1117 1 61 TYR HA 1 64 ASN H 3.440 2.420 4.460 4.093 3.584 4.576 0.116 2 0 "[ . 1 . 2]" 1
1118 1 61 TYR HA 1 83 ILE MG 2.960 . 4.860 4.680 4.184 4.975 0.115 19 0 "[ . 1 . 2]" 1
1119 1 61 TYR HA 1 83 ILE MG 3.460 . 5.990 4.603 4.145 4.855 . 0 0 "[ . 1 . 2]" 1
1120 1 61 TYR HA 1 84 PRO QG 3.420 . 5.950 4.767 3.581 5.647 . 0 0 "[ . 1 . 2]" 1
1121 1 61 TYR HB2 1 61 TYR QE 4.310 . 8.230 4.329 4.129 4.410 . 0 0 "[ . 1 . 2]" 1
1122 1 61 TYR HB3 1 61 TYR QE 4.180 . 7.960 4.430 4.192 4.586 . 0 0 "[ . 1 . 2]" 1
1123 1 61 TYR HB3 1 84 PRO HB3 3.690 . 6.570 4.895 4.222 5.475 . 0 0 "[ . 1 . 2]" 1
1124 1 61 TYR HB3 1 84 PRO QD 3.570 . 6.330 2.395 1.878 2.969 . 0 0 "[ . 1 . 2]" 1
1125 1 61 TYR HB3 1 84 PRO QG 4.460 . 8.670 4.018 2.697 4.594 . 0 0 "[ . 1 . 2]" 1
1126 1 61 TYR HB3 1 83 ILE MD 4.100 . 7.750 4.649 2.134 6.501 . 0 0 "[ . 1 . 2]" 1
1127 1 61 TYR QD 1 83 ILE MD 3.110 . 5.210 4.208 2.652 5.229 0.019 12 0 "[ . 1 . 2]" 1
1128 1 61 TYR QD 1 83 ILE QG 3.420 . 5.950 4.770 2.887 5.502 . 0 0 "[ . 1 . 2]" 1
1129 1 61 TYR QD 1 83 ILE MG 3.490 . 6.140 3.037 2.086 3.937 . 0 0 "[ . 1 . 2]" 1
1130 1 61 TYR QE 1 79 PHE HA 4.080 . 7.590 4.225 3.320 5.096 . 0 0 "[ . 1 . 2]" 1
1131 1 61 TYR QE 1 83 ILE MD 3.770 . 6.770 4.022 2.173 5.351 . 0 0 "[ . 1 . 2]" 1
1132 1 61 TYR QE 1 83 ILE QG 3.190 . 5.400 4.690 3.187 5.493 0.093 11 0 "[ . 1 . 2]" 1
1133 1 61 TYR QE 1 82 GLU HB2 4.000 . 7.450 3.978 2.384 6.449 . 0 0 "[ . 1 . 2]" 1
1134 1 61 TYR QE 1 83 ILE HA 4.330 . 8.340 3.695 2.801 4.697 . 0 0 "[ . 1 . 2]" 1
1135 1 61 TYR QE 1 83 ILE MG 3.800 . 6.970 3.915 2.328 5.218 . 0 0 "[ . 1 . 2]" 1
1136 1 61 TYR QE 1 84 PRO HB3 3.930 . 7.180 6.050 4.541 8.074 0.894 19 1 "[ . 1 . +2]" 1
1137 1 62 MET H 1 62 MET HA 3.650 2.450 4.850 2.756 2.640 2.861 . 0 0 "[ . 1 . 2]" 1
1138 1 62 MET H 1 62 MET HB2 3.720 . 6.720 2.788 2.089 3.815 . 0 0 "[ . 1 . 2]" 1
1139 1 62 MET H 1 62 MET HB3 3.420 . 5.990 2.566 2.188 2.992 . 0 0 "[ . 1 . 2]" 1
1140 1 62 MET H 1 62 MET ME 4.180 . 7.920 4.570 3.961 5.653 . 0 0 "[ . 1 . 2]" 1
1141 1 62 MET H 1 62 MET QG 3.650 . 6.490 3.615 2.415 4.107 . 0 0 "[ . 1 . 2]" 1
1142 1 62 MET H 1 63 THR H 3.690 2.490 4.890 2.738 2.516 3.085 . 0 0 "[ . 1 . 2]" 1
1143 1 62 MET HA 1 62 MET QG 3.800 . 6.860 2.836 2.134 3.535 . 0 0 "[ . 1 . 2]" 1
1144 1 62 MET HA 1 63 THR H 4.700 3.180 6.220 3.467 3.310 3.589 . 0 0 "[ . 1 . 2]" 1
1145 1 62 MET HA 1 64 ASN HD21 4.250 . 8.170 6.127 2.806 8.043 . 0 0 "[ . 1 . 2]" 1
1146 1 62 MET HB2 1 62 MET ME 2.810 . 4.520 3.088 2.124 4.049 . 0 0 "[ . 1 . 2]" 1
1147 1 62 MET HB2 1 63 THR H 4.460 . 8.670 4.160 3.722 4.422 . 0 0 "[ . 1 . 2]" 1
1148 1 62 MET HB3 1 62 MET ME 2.730 . 4.350 2.990 2.111 4.217 . 0 0 "[ . 1 . 2]" 1
1149 1 62 MET HB3 1 62 MET QG 2.500 . 3.860 2.376 2.139 2.623 . 0 0 "[ . 1 . 2]" 1
1150 1 62 MET HB3 1 63 THR H 3.690 . 6.630 3.461 2.748 4.591 . 0 0 "[ . 1 . 2]" 1
1151 1 62 MET ME 1 62 MET QG 3.270 . 5.580 2.228 2.007 2.532 . 0 0 "[ . 1 . 2]" 1
1152 1 62 MET ME 1 63 THR H 3.850 . 6.970 4.298 2.940 5.773 . 0 0 "[ . 1 . 2]" 1
1153 1 63 THR H 1 63 THR HA 3.770 2.530 5.010 2.817 2.682 2.925 . 0 0 "[ . 1 . 2]" 1
1154 1 63 THR H 1 63 THR HB 3.570 . 6.360 2.781 2.292 3.764 . 0 0 "[ . 1 . 2]" 1
1155 1 63 THR H 1 63 THR MG 3.490 . 6.100 2.909 1.960 3.938 . 0 0 "[ . 1 . 2]" 1
1156 1 63 THR H 1 65 ALA H 3.520 2.470 4.570 4.458 4.096 4.765 0.195 14 0 "[ . 1 . 2]" 1
1157 1 63 THR H 1 65 ALA MB 4.540 . 8.890 5.176 4.104 6.301 . 0 0 "[ . 1 . 2]" 1
1158 1 63 THR HA 1 63 THR MG 2.960 . 4.860 2.647 2.178 3.277 . 0 0 "[ . 1 . 2]" 1
1159 1 63 THR HA 1 64 ASN HD22 4.460 . 8.670 7.414 5.359 8.676 0.006 20 0 "[ . 1 . 2]" 1
1160 1 63 THR HA 1 65 ALA MB 4.310 . 8.230 5.050 3.558 5.872 . 0 0 "[ . 1 . 2]" 1
1161 1 63 THR HB 1 64 ASN H 3.020 . 4.640 3.734 2.672 4.562 . 0 0 "[ . 1 . 2]" 1
1162 1 63 THR MG 1 64 ASN H 3.600 . 5.910 3.693 2.553 4.386 . 0 0 "[ . 1 . 2]" 1
1163 1 64 ASN H 1 64 ASN QB 3.180 . 4.640 2.892 2.236 3.479 . 0 0 "[ . 1 . 2]" 1
1164 1 64 ASN H 1 64 ASN HD22 3.520 . 5.730 4.839 3.188 5.848 0.118 3 0 "[ . 1 . 2]" 1
1165 1 64 ASN H 1 65 ALA H 3.440 2.420 4.460 2.620 2.349 3.615 0.071 20 0 "[ . 1 . 2]" 1
1166 1 64 ASN HA 1 65 ALA H 3.180 2.230 4.130 3.048 2.163 3.764 0.067 12 0 "[ . 1 . 2]" 1
1167 1 64 ASN QB 1 64 ASN HD22 3.440 . 5.540 3.416 3.228 3.540 . 0 0 "[ . 1 . 2]" 1
1168 1 64 ASN QB 1 65 ALA H 3.600 . 5.910 3.663 1.657 4.264 . 0 0 "[ . 1 . 2]" 1
1169 1 64 ASN QB 1 69 GLY H 3.860 . 6.500 5.693 2.421 6.342 . 0 0 "[ . 1 . 2]" 1
1170 1 64 ASN HD21 1 65 ALA HA 3.860 . 6.500 5.183 3.530 6.511 0.011 10 0 "[ . 1 . 2]" 1
1171 1 64 ASN HD21 1 68 THR MG 3.770 . 6.300 4.751 1.958 6.278 . 0 0 "[ . 1 . 2]" 1
1172 1 64 ASN HD22 1 65 ALA H 3.930 . 7.180 5.043 3.257 6.478 . 0 0 "[ . 1 . 2]" 1
1173 1 64 ASN HD22 1 65 ALA HA 3.770 . 6.300 5.829 4.559 6.360 0.060 10 0 "[ . 1 . 2]" 1
1174 1 64 ASN HD22 1 68 THR MG 3.600 . 5.910 4.912 2.772 6.053 0.143 18 0 "[ . 1 . 2]" 1
1175 1 65 ALA H 1 65 ALA HA 3.420 2.300 4.540 2.871 2.564 2.989 . 0 0 "[ . 1 . 2]" 1
1176 1 65 ALA H 1 65 ALA MB 3.490 . 6.160 2.312 2.102 2.511 . 0 0 "[ . 1 . 2]" 1
1177 1 65 ALA HA 1 66 GLY H 3.100 2.170 4.030 3.286 2.751 3.626 . 0 0 "[ . 1 . 2]" 1
1178 1 65 ALA MB 1 66 GLY H 3.270 . 5.170 3.181 1.950 3.790 . 0 0 "[ . 1 . 2]" 1
1179 1 65 ALA MB 1 67 LEU HA 3.390 . 5.810 5.893 5.349 6.106 0.296 8 0 "[ . 1 . 2]" 1
1180 1 66 GLY H 1 67 LEU H 3.020 2.120 3.920 2.210 2.030 2.654 0.090 16 0 "[ . 1 . 2]" 1
1181 1 66 GLY H 1 68 THR H 3.180 2.230 4.130 4.168 4.016 4.267 0.137 11 0 "[ . 1 . 2]" 1
1182 1 67 LEU H 1 67 LEU HA 2.930 2.050 3.810 2.910 2.842 2.976 . 0 0 "[ . 1 . 2]" 1
1183 1 67 LEU H 1 67 LEU QB 2.680 . 3.960 3.104 2.746 3.292 . 0 0 "[ . 1 . 2]" 1
1184 1 67 LEU H 1 67 LEU HB3 3.650 . 6.530 3.119 2.755 3.250 . 0 0 "[ . 1 . 2]" 1
1185 1 67 LEU H 1 67 LEU QD 3.420 . 5.950 2.369 1.677 3.221 . 0 0 "[ . 1 . 2]" 1
1186 1 67 LEU H 1 67 LEU HG 2.600 . 3.800 2.776 1.936 3.687 . 0 0 "[ . 1 . 2]" 1
1187 1 67 LEU H 1 67 LEU HG 3.420 . 5.950 2.053 1.732 2.563 . 0 0 "[ . 1 . 2]" 1
1188 1 67 LEU H 1 69 GLY HA2 4.230 2.850 5.610 4.911 4.414 5.471 . 0 0 "[ . 1 . 2]" 1
1189 1 67 LEU H 1 69 GLY HA3 3.100 2.170 4.030 4.057 3.579 4.190 0.160 20 0 "[ . 1 . 2]" 1
1190 1 67 LEU HA 1 67 LEU HB2 2.730 . 4.350 2.502 2.338 2.731 . 0 0 "[ . 1 . 2]" 1
1191 1 67 LEU HA 1 67 LEU QD 2.960 . 4.860 3.459 3.330 3.522 . 0 0 "[ . 1 . 2]" 1
1192 1 67 LEU HA 1 67 LEU HG 2.810 . 4.520 3.737 3.546 3.960 . 0 0 "[ . 1 . 2]" 1
1193 1 67 LEU HA 1 67 LEU HG 3.040 . 5.040 2.750 2.165 3.222 . 0 0 "[ . 1 . 2]" 1
1194 1 67 LEU QB 1 68 THR H 3.020 . 4.640 3.229 2.346 3.585 . 0 0 "[ . 1 . 2]" 1
1195 1 67 LEU HB2 1 67 LEU QD 3.040 . 5.040 2.206 2.151 2.353 . 0 0 "[ . 1 . 2]" 1
1196 1 67 LEU HB2 1 67 LEU HG 1.900 . 2.680 2.125 1.972 2.300 . 0 0 "[ . 1 . 2]" 1
1197 1 67 LEU HB2 1 68 THR HA 3.490 . 6.130 4.245 3.580 4.632 . 0 0 "[ . 1 . 2]" 1
1198 1 67 LEU HB2 1 68 THR HB 3.870 . 7.120 4.957 3.745 6.089 . 0 0 "[ . 1 . 2]" 1
1199 1 67 LEU HB3 1 67 LEU QD 2.730 . 4.190 2.163 2.065 2.242 . 0 0 "[ . 1 . 2]" 1
1200 1 67 LEU HB3 1 68 THR HA 3.270 . 5.580 5.313 4.904 5.621 0.041 13 0 "[ . 1 . 2]" 1
1201 1 67 LEU QD 1 68 THR H 3.690 . 6.110 2.106 1.525 2.854 . 0 0 "[ . 1 . 2]" 1
1202 1 67 LEU QD 1 68 THR HA 3.570 . 6.330 4.078 3.529 4.691 . 0 0 "[ . 1 . 2]" 1
1203 1 67 LEU QD 1 69 GLY HA2 4.000 . 5.620 5.193 3.481 5.572 . 0 0 "[ . 1 . 2]" 1
1204 1 67 LEU HG 1 68 THR H 3.100 . 4.810 2.470 1.737 3.490 . 0 0 "[ . 1 . 2]" 1
1205 1 67 LEU HG 1 69 GLY H 3.860 . 6.500 4.115 3.094 4.900 . 0 0 "[ . 1 . 2]" 1
1206 1 67 LEU HG 1 69 GLY HA2 3.620 . 6.380 6.400 5.909 6.514 0.134 9 0 "[ . 1 . 2]" 1
1207 1 68 THR H 1 68 THR HA 2.600 . 3.380 2.948 2.885 2.998 . 0 0 "[ . 1 . 2]" 1
1208 1 68 THR H 1 68 THR HB 3.800 . 6.920 3.096 2.340 3.835 . 0 0 "[ . 1 . 2]" 1
1209 1 68 THR H 1 68 THR MG 3.190 . 5.400 2.631 1.986 3.837 . 0 0 "[ . 1 . 2]" 1
1210 1 68 THR H 1 69 GLY H 3.440 2.420 4.460 2.545 2.353 3.033 0.067 3 0 "[ . 1 . 2]" 1
1211 1 68 THR HA 1 68 THR MG 3.040 . 5.040 2.893 2.222 3.306 . 0 0 "[ . 1 . 2]" 1
1212 1 68 THR HA 1 69 GLY H 3.020 2.120 3.920 2.900 2.593 3.556 . 0 0 "[ . 1 . 2]" 1
1213 1 68 THR HA 1 70 ARG HB3 3.720 . 6.720 6.473 4.845 7.587 0.867 20 1 "[ . 1 . +]" 1
1214 1 68 THR MG 1 69 GLY H 3.690 . 6.110 3.851 2.322 4.363 . 0 0 "[ . 1 . 2]" 1
1215 1 69 GLY H 1 69 GLY HA3 2.760 . 3.580 2.154 2.055 2.276 . 0 0 "[ . 1 . 2]" 1
1216 1 69 GLY H 1 70 ARG H 3.520 2.470 4.570 3.377 2.448 4.614 0.044 19 0 "[ . 1 . 2]" 1
1217 1 69 GLY HA2 1 70 ARG H 4.160 2.810 5.510 3.096 2.672 3.585 0.138 11 0 "[ . 1 . 2]" 1
1218 1 69 GLY HA2 1 70 ARG HB3 3.770 . 6.770 5.436 4.439 6.479 . 0 0 "[ . 1 . 2]" 1
1219 1 69 GLY HA3 1 70 ARG H 3.310 2.220 4.400 3.149 2.212 3.752 0.008 1 0 "[ . 1 . 2]" 1
1220 1 69 GLY HA3 1 70 ARG QG 3.310 . 5.620 4.853 3.779 5.776 0.156 18 0 "[ . 1 . 2]" 1
1221 1 70 ARG H 1 70 ARG HA 3.420 2.300 4.540 2.710 2.237 2.959 0.063 1 0 "[ . 1 . 2]" 1
1222 1 70 ARG H 1 70 ARG HB2 3.800 . 6.920 3.554 2.502 4.251 . 0 0 "[ . 1 . 2]" 1
1223 1 70 ARG H 1 70 ARG HB3 3.270 . 5.580 3.490 2.488 4.218 . 0 0 "[ . 1 . 2]" 1
1224 1 70 ARG H 1 72 MET HA 4.160 2.810 5.510 5.513 4.833 5.722 0.212 19 0 "[ . 1 . 2]" 1
1225 1 70 ARG H 1 73 ASP H 3.180 . 4.980 3.435 2.476 4.603 . 0 0 "[ . 1 . 2]" 1
1226 1 70 ARG HA 1 70 ARG QD 3.190 . 5.400 3.336 2.196 3.976 . 0 0 "[ . 1 . 2]" 1
1227 1 70 ARG HA 1 70 ARG QG 3.340 . 5.820 2.907 2.176 3.602 . 0 0 "[ . 1 . 2]" 1
1228 1 70 ARG HA 1 71 SER H 3.190 2.140 4.240 3.075 2.227 3.634 . 0 0 "[ . 1 . 2]" 1
1229 1 70 ARG HA 1 71 SER H 2.760 . 4.120 2.495 1.963 2.831 . 0 0 "[ . 1 . 2]" 1
1230 1 70 ARG HB2 1 70 ARG QD 3.190 . 5.400 2.787 2.398 3.656 . 0 0 "[ . 1 . 2]" 1
1231 1 70 ARG HB2 1 71 SER H 3.340 . 5.820 3.682 1.937 4.579 . 0 0 "[ . 1 . 2]" 1
1232 1 70 ARG HB3 1 70 ARG QD 3.270 . 5.580 2.750 2.373 3.451 . 0 0 "[ . 1 . 2]" 1
1233 1 70 ARG HB3 1 71 SER H 4.100 . 7.750 3.687 1.758 4.653 . 0 0 "[ . 1 . 2]" 1
1234 1 71 SER H 1 71 SER QB 3.720 . 6.720 2.799 2.250 3.505 . 0 0 "[ . 1 . 2]" 1
1235 1 71 SER HA 1 72 MET H 3.180 2.230 4.130 2.695 2.250 3.680 . 0 0 "[ . 1 . 2]" 1
1236 1 71 SER HA 1 72 MET HB3 3.420 . 5.950 5.495 4.420 6.052 0.102 17 0 "[ . 1 . 2]" 1
1237 1 71 SER HA 1 75 VAL MG2 4.230 . 8.010 6.936 4.974 8.590 0.580 17 2 "[ . 1 . + -]" 1
1238 1 71 SER QB 1 72 MET H 3.860 . 6.500 3.564 2.179 4.066 . 0 0 "[ . 1 . 2]" 1
1239 1 72 MET H 1 72 MET HB2 4.110 . 7.110 2.907 2.267 3.882 . 0 0 "[ . 1 . 2]" 1
1240 1 72 MET H 1 72 MET HB3 3.520 . 5.730 3.457 2.480 4.297 . 0 0 "[ . 1 . 2]" 1
1241 1 72 MET H 1 73 ASP H 3.520 2.470 4.570 3.645 2.652 4.478 . 0 0 "[ . 1 . 2]" 1
1242 1 72 MET HA 1 72 MET HB2 2.960 . 4.860 2.840 2.449 3.082 . 0 0 "[ . 1 . 2]" 1
1243 1 72 MET HA 1 72 MET HB3 2.580 . 4.020 2.748 2.426 3.129 . 0 0 "[ . 1 . 2]" 1
1244 1 72 MET HB3 1 73 ASP H 3.100 . 4.810 3.706 2.081 4.715 . 0 0 "[ . 1 . 2]" 1
1245 1 72 MET HB3 1 75 VAL HB 2.150 . 3.130 2.949 2.174 3.192 0.062 5 0 "[ . 1 . 2]" 1
1246 1 73 ASP H 1 73 ASP HA 2.810 . 3.740 2.692 2.162 2.980 . 0 0 "[ . 1 . 2]" 1
1247 1 73 ASP H 1 73 ASP QB 3.040 . 5.040 2.817 2.118 3.529 . 0 0 "[ . 1 . 2]" 1
1248 1 73 ASP H 1 74 THR H 3.690 2.590 4.790 3.458 2.481 4.644 0.109 18 0 "[ . 1 . 2]" 1
1249 1 73 ASP H 1 75 VAL MG2 3.600 . 5.910 5.254 2.568 6.743 0.833 17 1 "[ . 1 . + 2]" 1
1250 1 73 ASP HA 1 73 ASP QB 2.430 . 3.750 2.333 2.128 2.438 . 0 0 "[ . 1 . 2]" 1
1251 1 73 ASP HA 1 74 THR H 3.350 2.350 4.350 2.910 2.294 3.634 0.056 7 0 "[ . 1 . 2]" 1
1252 1 73 ASP QB 1 74 THR H 3.440 . 5.540 3.272 1.854 4.117 . 0 0 "[ . 1 . 2]" 1
1253 1 74 THR H 1 74 THR HA 3.420 2.300 4.540 2.609 2.219 2.975 0.081 2 0 "[ . 1 . 2]" 1
1254 1 74 THR H 1 74 THR HB 3.420 . 5.950 3.617 2.256 4.298 . 0 0 "[ . 1 . 2]" 1
1255 1 74 THR H 1 74 THR MG 3.620 . 6.380 3.170 2.140 4.196 . 0 0 "[ . 1 . 2]" 1
1256 1 74 THR HA 1 74 THR MG 2.880 . 4.720 2.698 2.208 3.298 . 0 0 "[ . 1 . 2]" 1
1257 1 74 THR HA 1 75 VAL H 3.230 2.170 4.290 2.847 2.183 3.525 . 0 0 "[ . 1 . 2]" 1
1258 1 74 THR HA 1 75 VAL MG2 4.390 . 8.450 5.291 3.928 5.932 . 0 0 "[ . 1 . 2]" 1
1259 1 74 THR HA 1 77 TYR QD 4.540 . 8.890 5.041 2.397 7.444 . 0 0 "[ . 1 . 2]" 1
1260 1 74 THR HA 1 77 TYR QE 4.620 . 9.120 5.912 2.510 9.133 0.013 7 0 "[ . 1 . 2]" 1
1261 1 74 THR HB 1 75 VAL MG2 4.390 . 8.450 6.006 4.314 7.112 . 0 0 "[ . 1 . 2]" 1
1262 1 74 THR HB 1 77 TYR QD 4.930 . 10.050 5.676 2.779 9.423 . 0 0 "[ . 1 . 2]" 1
1263 1 74 THR MG 1 75 VAL H 4.100 . 7.750 3.717 2.456 4.479 . 0 0 "[ . 1 . 2]" 1
1264 1 74 THR MG 1 77 TYR QD 4.770 . 9.580 4.828 2.036 7.978 . 0 0 "[ . 1 . 2]" 1
1265 1 74 THR MG 1 77 TYR QE 5.000 . 10.280 5.586 2.939 9.154 . 0 0 "[ . 1 . 2]" 1
1266 1 75 VAL H 1 75 VAL HA 3.420 2.280 4.560 2.676 2.192 2.991 0.088 11 0 "[ . 1 . 2]" 1
1267 1 75 VAL H 1 75 VAL HB 3.420 . 5.990 3.149 2.516 3.671 . 0 0 "[ . 1 . 2]" 1
1268 1 75 VAL H 1 75 VAL MG1 4.100 . 7.700 3.330 1.875 4.079 . 0 0 "[ . 1 . 2]" 1
1269 1 75 VAL H 1 75 VAL MG2 3.420 . 5.920 3.681 2.733 4.143 . 0 0 "[ . 1 . 2]" 1
1270 1 75 VAL H 1 77 TYR HA 3.440 2.420 4.460 4.442 3.742 4.704 0.244 5 0 "[ . 1 . 2]" 1
1271 1 75 VAL HA 1 75 VAL MG1 3.190 . 5.430 3.047 2.323 3.321 . 0 0 "[ . 1 . 2]" 1
1272 1 75 VAL HA 1 75 VAL MG2 3.270 . 5.610 2.226 2.006 2.448 . 0 0 "[ . 1 . 2]" 1
1273 1 75 VAL HA 1 76 SER H 3.390 2.290 4.490 3.130 2.257 3.638 0.033 13 0 "[ . 1 . 2]" 1
1274 1 75 VAL HA 1 76 SER H 2.680 . 3.960 2.499 1.980 2.841 . 0 0 "[ . 1 . 2]" 1
1275 1 75 VAL HA 1 77 TYR H 4.080 2.760 5.400 4.126 2.931 5.404 0.004 7 0 "[ . 1 . 2]" 1
1276 1 75 VAL HB 1 76 SER H 3.690 . 6.630 3.846 2.049 4.557 . 0 0 "[ . 1 . 2]" 1
1277 1 75 VAL HB 1 77 TYR QE 4.540 . 8.890 5.206 3.840 6.654 . 0 0 "[ . 1 . 2]" 1
1278 1 75 VAL MG1 1 76 SER H 4.310 . 8.160 3.105 2.228 4.163 . 0 0 "[ . 1 . 2]" 1
1279 1 75 VAL MG1 1 77 TYR QE 4.310 . 8.230 4.598 2.538 5.374 . 0 0 "[ . 1 . 2]" 1
1280 1 75 VAL MG2 1 76 SER H 3.770 . 6.770 3.700 1.849 4.379 . 0 0 "[ . 1 . 2]" 1
1281 1 75 VAL MG2 1 77 TYR QE 4.620 . 9.120 4.196 2.425 5.395 . 0 0 "[ . 1 . 2]" 1
1282 1 75 VAL MG2 1 79 PHE QE 3.850 . 7.040 6.522 4.786 7.603 0.563 20 2 "[ . 1 . - +]" 1
1283 1 76 SER H 1 76 SER QB 3.390 . 5.810 2.812 2.167 3.562 . 0 0 "[ . 1 . 2]" 1
1284 1 76 SER H 1 77 TYR H 3.440 2.420 4.460 3.014 2.362 3.945 0.058 2 0 "[ . 1 . 2]" 1
1285 1 76 SER HA 1 77 TYR H 3.690 2.500 4.880 2.811 2.453 3.520 0.047 1 0 "[ . 1 . 2]" 1
1286 1 76 SER QB 1 77 TYR H 3.490 . 6.130 3.762 2.681 4.218 . 0 0 "[ . 1 . 2]" 1
1287 1 77 TYR H 1 77 TYR HA 3.770 2.540 5.000 2.663 2.386 2.881 0.154 14 0 "[ . 1 . 2]" 1
1288 1 77 TYR H 1 77 TYR HB2 3.800 . 6.920 3.196 1.960 4.189 . 0 0 "[ . 1 . 2]" 1
1289 1 77 TYR H 1 77 TYR HB3 3.870 . 7.080 3.214 2.432 4.296 . 0 0 "[ . 1 . 2]" 1
1290 1 77 TYR H 1 77 TYR QD 4.310 . 8.230 2.782 1.650 4.519 . 0 0 "[ . 1 . 2]" 1
1291 1 77 TYR H 1 79 PHE QE 3.690 . 6.110 5.100 2.824 6.159 0.049 10 0 "[ . 1 . 2]" 1
1292 1 77 TYR HA 1 77 TYR QD 3.490 . 6.100 3.084 2.059 3.777 . 0 0 "[ . 1 . 2]" 1
1293 1 77 TYR HA 1 77 TYR QE 4.540 . 8.890 4.987 3.847 5.690 . 0 0 "[ . 1 . 2]" 1
1294 1 77 TYR HA 1 78 ASN QD 3.860 . 6.110 4.436 3.089 5.240 . 0 0 "[ . 1 . 2]" 1
1295 1 77 TYR HA 1 82 GLU QG 3.850 . 6.910 5.830 3.376 6.705 . 0 0 "[ . 1 . 2]" 1
1296 1 77 TYR HB3 1 77 TYR QE 4.390 . 8.450 4.400 4.299 4.547 . 0 0 "[ . 1 . 2]" 1
1297 1 77 TYR HB3 1 79 PHE QE 3.850 . 6.970 4.619 2.163 6.669 . 0 0 "[ . 1 . 2]" 1
1298 1 78 ASN H 1 78 ASN HA 4.160 2.810 5.510 2.865 2.673 2.976 0.137 14 0 "[ . 1 . 2]" 1
1299 1 78 ASN HA 1 79 PHE H 3.040 2.030 4.050 2.763 1.972 3.612 0.058 12 0 "[ . 1 . 2]" 1
1300 1 78 ASN HB2 1 79 PHE H 4.850 . 9.810 4.285 2.649 4.624 . 0 0 "[ . 1 . 2]" 1
1301 1 78 ASN QD 1 80 ALA MB 4.020 . 6.900 5.336 3.962 5.899 . 0 0 "[ . 1 . 2]" 1
1302 1 78 ASN QD 1 81 THR H 3.940 . 6.700 5.149 4.024 6.064 . 0 0 "[ . 1 . 2]" 1
1303 1 78 ASN QD 1 81 THR MG 3.930 . 5.540 4.844 4.325 5.343 . 0 0 "[ . 1 . 2]" 1
1304 1 79 PHE H 1 79 PHE HA 3.620 2.440 4.800 2.756 2.502 2.937 . 0 0 "[ . 1 . 2]" 1
1305 1 79 PHE H 1 79 PHE HB2 3.620 . 6.320 2.717 1.881 3.685 . 0 0 "[ . 1 . 2]" 1
1306 1 79 PHE H 1 79 PHE HB3 3.850 . 6.980 3.501 3.128 3.714 . 0 0 "[ . 1 . 2]" 1
1307 1 79 PHE H 1 79 PHE QE 3.930 . 7.180 3.924 3.323 4.743 . 0 0 "[ . 1 . 2]" 1
1308 1 79 PHE H 1 80 ALA H 3.690 2.490 4.890 2.849 2.456 3.477 0.034 7 0 "[ . 1 . 2]" 1
1309 1 79 PHE H 1 81 THR HB 3.950 . 7.330 6.992 5.370 7.359 0.029 15 0 "[ . 1 . 2]" 1
1310 1 79 PHE H 1 82 GLU HB3 4.230 . 8.010 6.503 4.184 7.666 . 0 0 "[ . 1 . 2]" 1
1311 1 79 PHE H 1 82 GLU QG 3.770 . 6.300 5.204 3.898 6.005 . 0 0 "[ . 1 . 2]" 1
1312 1 79 PHE HA 1 79 PHE QD 3.690 . 6.630 2.525 2.127 3.621 . 0 0 "[ . 1 . 2]" 1
1313 1 79 PHE HA 1 80 ALA H 4.000 2.710 5.290 3.350 3.145 3.532 . 0 0 "[ . 1 . 2]" 1
1314 1 79 PHE HA 1 83 ILE H 3.940 2.760 5.120 4.893 3.849 5.211 0.091 3 0 "[ . 1 . 2]" 1
1315 1 79 PHE HB2 1 79 PHE QE 4.540 . 8.890 4.383 4.307 4.457 . 0 0 "[ . 1 . 2]" 1
1316 1 79 PHE HB2 1 80 ALA H 3.270 . 5.170 3.441 2.656 4.073 . 0 0 "[ . 1 . 2]" 1
1317 1 79 PHE HB3 1 79 PHE QE 4.230 . 8.010 4.432 4.246 4.553 . 0 0 "[ . 1 . 2]" 1
1318 1 79 PHE HB3 1 83 ILE MD 3.650 . 6.530 3.903 2.066 5.677 . 0 0 "[ . 1 . 2]" 1
1319 1 79 PHE HB3 1 83 ILE MD 3.720 . 6.720 3.326 2.045 5.508 . 0 0 "[ . 1 . 2]" 1
1320 1 79 PHE QD 1 80 ALA H 4.160 . 7.810 4.254 2.654 5.032 . 0 0 "[ . 1 . 2]" 1
1321 1 79 PHE QD 1 83 ILE H 3.690 . 6.110 4.965 4.297 5.864 . 0 0 "[ . 1 . 2]" 1
1322 1 79 PHE QD 1 82 GLU HB3 4.080 . 7.590 5.571 2.295 8.133 0.543 7 1 "[ . + 1 . 2]" 1
1323 1 79 PHE QD 1 83 ILE QG 3.690 . 6.570 4.276 2.310 6.408 . 0 0 "[ . 1 . 2]" 1
1324 1 80 ALA H 1 80 ALA HA 3.340 2.230 4.450 2.880 2.776 2.947 . 0 0 "[ . 1 . 2]" 1
1325 1 80 ALA H 1 80 ALA MB 2.880 . 4.680 2.159 2.010 2.361 . 0 0 "[ . 1 . 2]" 1
1326 1 80 ALA H 1 81 THR H 3.150 2.120 4.180 2.431 2.166 2.789 . 0 0 "[ . 1 . 2]" 1
1327 1 80 ALA H 1 82 GLU H 3.770 2.650 4.890 4.012 3.496 4.385 . 0 0 "[ . 1 . 2]" 1
1328 1 80 ALA HA 1 81 THR H 4.160 2.810 5.510 3.475 3.353 3.691 . 0 0 "[ . 1 . 2]" 1
1329 1 80 ALA HA 1 83 ILE MD 4.080 . 7.590 4.279 2.957 5.916 . 0 0 "[ . 1 . 2]" 1
1330 1 80 ALA HA 1 88 LEU QD 3.570 . 6.330 4.805 3.840 5.765 . 0 0 "[ . 1 . 2]" 1
1331 1 80 ALA MB 1 81 THR H 3.310 . 5.680 3.043 2.651 3.302 . 0 0 "[ . 1 . 2]" 1
1332 1 80 ALA MB 1 81 THR HA 4.310 . 8.230 4.276 3.937 4.480 . 0 0 "[ . 1 . 2]" 1
1333 1 80 ALA MB 1 81 THR MG 3.390 . 5.810 3.476 2.688 4.835 . 0 0 "[ . 1 . 2]" 1
1334 1 81 THR H 1 81 THR HA 3.870 2.600 5.140 2.954 2.875 2.994 . 0 0 "[ . 1 . 2]" 1
1335 1 81 THR H 1 81 THR HB 3.690 . 6.570 3.311 2.655 3.902 . 0 0 "[ . 1 . 2]" 1
1336 1 81 THR H 1 81 THR MG 3.420 . 5.910 2.603 2.018 4.005 . 0 0 "[ . 1 . 2]" 1
1337 1 81 THR H 1 82 GLU H 2.930 2.070 3.790 2.245 2.051 2.730 0.019 1 0 "[ . 1 . 2]" 1
1338 1 81 THR H 1 82 GLU QG 3.770 . 6.300 4.179 3.132 5.797 . 0 0 "[ . 1 . 2]" 1
1339 1 81 THR HA 1 81 THR MG 3.270 . 5.550 2.971 2.223 3.289 . 0 0 "[ . 1 . 2]" 1
1340 1 81 THR HA 1 82 GLU H 4.310 2.910 5.710 3.399 3.035 3.686 . 0 0 "[ . 1 . 2]" 1
1341 1 81 THR MG 1 82 GLU H 3.270 . 5.170 3.596 2.606 4.399 . 0 0 "[ . 1 . 2]" 1
1342 1 82 GLU H 1 82 GLU HB2 3.020 . 4.640 3.087 2.401 4.161 . 0 0 "[ . 1 . 2]" 1
1343 1 82 GLU H 1 82 GLU HB3 3.620 . 6.380 3.486 2.439 4.071 . 0 0 "[ . 1 . 2]" 1
1344 1 82 GLU H 1 82 GLU QG 3.100 . 4.810 3.087 2.215 4.308 . 0 0 "[ . 1 . 2]" 1
1345 1 82 GLU H 1 83 ILE H 3.350 2.350 4.350 3.872 2.318 4.362 0.032 15 0 "[ . 1 . 2]" 1
1346 1 82 GLU H 1 83 ILE MD 4.080 . 7.590 3.312 2.103 4.478 . 0 0 "[ . 1 . 2]" 1
1347 1 82 GLU HA 1 83 ILE H 3.770 2.650 4.890 2.960 2.501 3.484 0.149 9 0 "[ . 1 . 2]" 1
1348 1 82 GLU HB2 1 83 ILE H 3.930 . 7.220 2.980 1.771 4.649 . 0 0 "[ . 1 . 2]" 1
1349 1 82 GLU HB3 1 83 ILE H 4.000 . 7.380 2.813 1.778 4.822 . 0 0 "[ . 1 . 2]" 1
1350 1 82 GLU QG 1 83 ILE H 3.440 . 5.540 3.619 1.608 5.155 . 0 0 "[ . 1 . 2]" 1
1351 1 83 ILE H 1 83 ILE HB 3.420 . 5.900 3.840 3.368 4.106 . 0 0 "[ . 1 . 2]" 1
1352 1 83 ILE H 1 83 ILE HB 3.620 . 6.320 3.476 2.958 3.849 . 0 0 "[ . 1 . 2]" 1
1353 1 83 ILE H 1 83 ILE MD 3.720 . 6.720 3.301 1.637 4.972 . 0 0 "[ . 1 . 2]" 1
1354 1 83 ILE H 1 83 ILE MD 3.440 . 5.540 2.657 1.631 3.757 . 0 0 "[ . 1 . 2]" 1
1355 1 83 ILE H 1 83 ILE QG 3.800 . 6.920 3.160 1.775 3.948 . 0 0 "[ . 1 . 2]" 1
1356 1 83 ILE H 1 83 ILE MG 3.650 . 6.500 3.177 1.811 4.041 . 0 0 "[ . 1 . 2]" 1
1357 1 83 ILE H 1 84 PRO HB2 4.410 . 8.620 7.329 6.713 7.856 . 0 0 "[ . 1 . 2]" 1
1358 1 83 ILE H 1 88 LEU HB2 4.310 . 8.230 5.303 4.439 5.634 . 0 0 "[ . 1 . 2]" 1
1359 1 83 ILE H 1 88 LEU QD 4.540 . 8.890 3.855 3.368 4.177 . 0 0 "[ . 1 . 2]" 1
1360 1 83 ILE HA 1 83 ILE MD 3.870 . 7.120 3.429 2.223 4.077 . 0 0 "[ . 1 . 2]" 1
1361 1 83 ILE HA 1 83 ILE MG 3.340 . 5.760 2.228 2.031 2.408 . 0 0 "[ . 1 . 2]" 1
1362 1 83 ILE HA 1 84 PRO QD 3.190 . 5.400 2.497 2.129 3.236 . 0 0 "[ . 1 . 2]" 1
1363 1 83 ILE HA 1 84 PRO QG 3.650 . 6.530 4.344 4.011 4.968 . 0 0 "[ . 1 . 2]" 1
1364 1 83 ILE HB 1 83 ILE MD 2.960 . 4.860 2.771 2.010 3.326 . 0 0 "[ . 1 . 2]" 1
1365 1 83 ILE HB 1 84 PRO QD 3.570 . 6.330 2.502 1.817 4.052 . 0 0 "[ . 1 . 2]" 1
1366 1 83 ILE HB 1 87 ILE MD 3.770 . 6.770 6.005 2.945 6.815 0.045 1 0 "[ . 1 . 2]" 1
1367 1 83 ILE MD 1 84 PRO QD 3.110 . 5.210 3.668 2.090 4.622 . 0 0 "[ . 1 . 2]" 1
1368 1 83 ILE QG 1 88 LEU QD 3.460 . 5.990 3.469 2.341 5.293 . 0 0 "[ . 1 . 2]" 1
1369 1 83 ILE MG 1 84 PRO QD 3.620 . 6.320 2.423 1.705 3.097 . 0 0 "[ . 1 . 2]" 1
1370 1 83 ILE MG 1 88 LEU HB2 3.390 . 5.810 5.236 4.407 5.924 0.114 10 0 "[ . 1 . 2]" 1
1371 1 83 ILE MG 1 88 LEU QD 3.390 . 5.810 4.382 3.895 5.028 . 0 0 "[ . 1 . 2]" 1
1372 1 83 ILE MG 1 84 PRO QD 2.960 . 4.860 2.543 1.750 3.475 . 0 0 "[ . 1 . 2]" 1
1373 1 84 PRO HA 1 84 PRO QG 3.570 . 6.290 3.509 3.021 3.589 . 0 0 "[ . 1 . 2]" 1
1374 1 84 PRO HB2 1 84 PRO QD 3.650 . 6.470 3.409 2.357 3.586 . 0 0 "[ . 1 . 2]" 1
1375 1 84 PRO HB2 1 87 ILE H 4.460 . 8.670 3.072 2.270 3.890 . 0 0 "[ . 1 . 2]" 1
1376 1 84 PRO HB2 1 87 ILE HB 4.100 . 7.750 4.824 3.849 6.344 . 0 0 "[ . 1 . 2]" 1
1377 1 84 PRO HB2 1 87 ILE MD 3.690 . 6.570 3.017 2.195 4.060 . 0 0 "[ . 1 . 2]" 1
1378 1 84 PRO HB3 1 87 ILE MD 3.570 . 6.370 4.033 3.334 4.968 . 0 0 "[ . 1 . 2]" 1
1379 1 84 PRO QD 1 87 ILE MD 3.720 . 6.720 4.156 2.021 5.013 . 0 0 "[ . 1 . 2]" 1
1380 1 86 THR HA 1 86 THR MG 3.110 . 5.190 2.938 2.354 3.283 . 0 0 "[ . 1 . 2]" 1
1381 1 86 THR HA 1 87 ILE H 3.930 2.660 5.200 3.639 3.539 3.691 . 0 0 "[ . 1 . 2]" 1
1382 1 86 THR MG 1 87 ILE QG 3.310 . 5.620 3.361 2.165 4.941 . 0 0 "[ . 1 . 2]" 1
1383 1 87 ILE H 1 87 ILE HA 3.420 2.280 4.560 2.834 2.772 2.872 . 0 0 "[ . 1 . 2]" 1
1384 1 87 ILE H 1 87 ILE HB 3.270 . 5.640 3.160 2.626 3.744 . 0 0 "[ . 1 . 2]" 1
1385 1 87 ILE H 1 87 ILE MD 3.950 . 7.330 2.483 1.771 3.842 . 0 0 "[ . 1 . 2]" 1
1386 1 87 ILE H 1 87 ILE QG 3.390 . 4.980 2.340 1.838 3.232 . 0 0 "[ . 1 . 2]" 1
1387 1 87 ILE H 1 88 LEU HA 4.460 3.010 5.910 5.172 4.995 5.377 . 0 0 "[ . 1 . 2]" 1
1388 1 87 ILE H 1 88 LEU HB2 4.030 . 7.540 4.535 4.126 5.194 . 0 0 "[ . 1 . 2]" 1
1389 1 87 ILE H 1 88 LEU HB3 4.030 . 7.540 5.230 4.608 6.193 . 0 0 "[ . 1 . 2]" 1
1390 1 87 ILE H 1 88 LEU QD 4.460 . 8.670 5.246 4.454 5.695 . 0 0 "[ . 1 . 2]" 1
1391 1 87 ILE HA 1 87 ILE QG 2.960 . 4.860 3.222 2.293 3.582 . 0 0 "[ . 1 . 2]" 1
1392 1 87 ILE HB 1 88 LEU H 3.690 . 6.570 2.520 2.151 2.923 . 0 0 "[ . 1 . 2]" 1
1393 1 87 ILE HB 1 89 LYS H 4.000 . 7.380 3.935 2.782 4.463 . 0 0 "[ . 1 . 2]" 1
1394 1 87 ILE MD 1 88 LEU H 4.410 . 8.690 4.272 2.678 5.250 . 0 0 "[ . 1 . 2]" 1
1395 1 87 ILE MD 1 89 LYS H 3.950 . 7.330 5.578 4.967 6.700 . 0 0 "[ . 1 . 2]" 1
1396 1 87 ILE MG 1 88 LEU H 3.490 . 6.130 3.567 3.335 3.965 . 0 0 "[ . 1 . 2]" 1
1397 1 88 LEU H 1 88 LEU HB2 3.870 . 7.120 2.244 2.028 2.513 . 0 0 "[ . 1 . 2]" 1
1398 1 88 LEU H 1 88 LEU HB3 3.490 . 6.130 2.874 2.397 3.612 . 0 0 "[ . 1 . 2]" 1
1399 1 88 LEU H 1 88 LEU QD 4.310 . 8.230 3.542 2.952 3.733 . 0 0 "[ . 1 . 2]" 1
1400 1 88 LEU H 1 88 LEU QD 3.800 . 6.920 3.468 2.927 3.641 . 0 0 "[ . 1 . 2]" 1
1401 1 88 LEU H 1 88 LEU QD 3.570 . 6.330 3.330 2.864 3.649 . 0 0 "[ . 1 . 2]" 1
1402 1 88 LEU H 1 89 LYS H 3.690 . 6.570 2.321 2.192 2.412 . 0 0 "[ . 1 . 2]" 1
1403 1 88 LEU H 1 91 LEU HB2 4.080 . 7.590 4.721 4.402 5.574 . 0 0 "[ . 1 . 2]" 1
1404 1 88 LEU HA 1 88 LEU HB3 2.810 . 4.520 2.748 2.167 2.921 . 0 0 "[ . 1 . 2]" 1
1405 1 88 LEU HA 1 88 LEU QD 3.040 . 5.040 2.086 1.966 2.374 . 0 0 "[ . 1 . 2]" 1
1406 1 88 LEU HA 1 91 LEU HG 3.110 . 5.210 4.604 4.036 5.248 0.038 15 0 "[ . 1 . 2]" 1
1407 1 88 LEU HB2 1 88 LEU QD 3.040 . 5.070 2.264 2.122 2.541 . 0 0 "[ . 1 . 2]" 1
1408 1 88 LEU HB2 1 92 ASN HD21 3.600 . 5.910 4.315 3.507 5.387 . 0 0 "[ . 1 . 2]" 1
1409 1 88 LEU HB2 1 92 ASN HD22 3.600 . 5.910 5.604 4.459 6.370 0.460 7 0 "[ . 1 . 2]" 1
1410 1 88 LEU HB3 1 88 LEU QD 2.810 . 4.520 2.207 2.063 2.359 . 0 0 "[ . 1 . 2]" 1
1411 1 88 LEU HB3 1 89 LYS H 4.000 . 7.380 3.396 3.067 3.910 . 0 0 "[ . 1 . 2]" 1
1412 1 88 LEU QD 1 91 LEU H 4.110 . 7.110 3.794 3.534 4.002 . 0 0 "[ . 1 . 2]" 1
1413 1 88 LEU QD 1 91 LEU HB3 3.110 . 5.210 2.952 2.342 3.489 . 0 0 "[ . 1 . 2]" 1
1414 1 88 LEU QD 1 91 LEU MD1 3.650 . 6.490 3.085 1.916 3.836 . 0 0 "[ . 1 . 2]" 1
1415 1 88 LEU QD 1 91 LEU MD2 4.540 . 8.890 3.853 3.257 4.138 . 0 0 "[ . 1 . 2]" 1
1416 1 88 LEU QD 1 92 ASN H 3.600 . 5.910 4.567 4.244 5.123 . 0 0 "[ . 1 . 2]" 1
1417 1 88 LEU HG 1 89 LYS H 4.390 . 8.450 4.968 4.239 5.695 . 0 0 "[ . 1 . 2]" 1
1418 1 88 LEU HG 1 91 LEU MD1 4.000 . 7.380 4.967 2.249 6.477 . 0 0 "[ . 1 . 2]" 1
1419 1 89 LYS H 1 89 LYS HB2 3.490 . 6.130 2.468 2.218 2.625 . 0 0 "[ . 1 . 2]" 1
1420 1 89 LYS H 1 89 LYS HB3 3.650 . 6.570 3.047 2.353 3.711 . 0 0 "[ . 1 . 2]" 1
1421 1 89 LYS H 1 89 LYS QG 4.100 . 7.750 3.238 2.203 4.051 . 0 0 "[ . 1 . 2]" 1
1422 1 89 LYS H 1 91 LEU HB2 4.390 . 8.450 5.732 5.301 6.909 . 0 0 "[ . 1 . 2]" 1
1423 1 89 LYS H 1 93 PRO QG 4.160 . 7.810 6.806 6.430 7.383 . 0 0 "[ . 1 . 2]" 1
1424 1 89 LYS HA 1 89 LYS HB2 2.960 . 4.860 2.786 2.475 3.082 . 0 0 "[ . 1 . 2]" 1
1425 1 89 LYS HA 1 92 ASN H 3.270 2.300 4.240 3.861 3.504 4.265 0.025 12 0 "[ . 1 . 2]" 1
1426 1 89 LYS HA 1 92 ASN HD21 3.770 . 6.300 2.808 2.294 3.784 . 0 0 "[ . 1 . 2]" 1
1427 1 89 LYS HA 1 92 ASN HD22 3.600 . 5.910 4.078 3.080 4.634 . 0 0 "[ . 1 . 2]" 1
1428 1 89 LYS QB 1 92 ASN HD22 3.690 . 6.110 5.876 4.993 6.151 0.041 15 0 "[ . 1 . 2]" 1
1429 1 89 LYS HB2 1 89 LYS QE 3.720 . 6.720 3.699 2.169 4.631 . 0 0 "[ . 1 . 2]" 1
1430 1 89 LYS HB2 1 90 LYS H 4.310 . 8.230 3.604 2.744 4.218 . 0 0 "[ . 1 . 2]" 1
1431 1 89 LYS HB2 1 92 ASN HD21 3.860 . 6.500 5.433 4.820 6.562 0.062 3 0 "[ . 1 . 2]" 1
1432 1 89 LYS HB3 1 90 LYS H 4.310 . 8.230 3.559 2.850 4.333 . 0 0 "[ . 1 . 2]" 1
1433 1 89 LYS QD 1 92 ASN HB3 4.410 . 8.620 5.408 4.569 6.452 . 0 0 "[ . 1 . 2]" 1
1434 1 90 LYS H 1 90 LYS HA 3.650 2.450 4.850 2.858 2.807 2.920 . 0 0 "[ . 1 . 2]" 1
1435 1 90 LYS H 1 90 LYS HB3 3.850 . 6.970 3.437 2.660 3.726 . 0 0 "[ . 1 . 2]" 1
1436 1 90 LYS H 1 91 LEU H 3.620 2.440 4.800 2.483 2.395 2.657 0.045 18 0 "[ . 1 . 2]" 1
1437 1 90 LYS H 1 92 ASN H 3.690 2.480 4.900 4.270 3.858 4.494 . 0 0 "[ . 1 . 2]" 1
1438 1 90 LYS H 1 93 PRO QG 4.000 . 7.380 5.050 4.709 5.365 . 0 0 "[ . 1 . 2]" 1
1439 1 90 LYS HA 1 93 PRO QG 3.690 . 6.510 2.598 2.246 2.892 . 0 0 "[ . 1 . 2]" 1
1440 1 90 LYS QB 1 91 LEU MD2 3.650 . 6.530 6.123 5.726 6.793 0.263 1 0 "[ . 1 . 2]" 1
1441 1 90 LYS QB 1 92 ASN H 3.690 . 6.110 4.889 4.414 5.102 . 0 0 "[ . 1 . 2]" 1
1442 1 91 LEU H 1 91 LEU HA 3.620 2.440 4.800 2.880 2.843 2.955 . 0 0 "[ . 1 . 2]" 1
1443 1 91 LEU H 1 91 LEU HB2 3.950 . 7.270 2.750 2.509 3.519 . 0 0 "[ . 1 . 2]" 1
1444 1 91 LEU H 1 91 LEU HB3 3.650 . 6.530 2.508 2.234 2.754 . 0 0 "[ . 1 . 2]" 1
1445 1 91 LEU H 1 91 LEU MD1 4.270 . 7.520 4.235 3.396 4.541 . 0 0 "[ . 1 . 2]" 1
1446 1 91 LEU H 1 91 LEU MD1 3.720 . 6.720 3.347 2.723 4.003 . 0 0 "[ . 1 . 2]" 1
1447 1 91 LEU H 1 91 LEU MD1 4.310 . 8.230 4.106 3.384 4.387 . 0 0 "[ . 1 . 2]" 1
1448 1 91 LEU H 1 91 LEU MD2 3.940 . 6.700 4.457 4.058 4.715 . 0 0 "[ . 1 . 2]" 1
1449 1 91 LEU H 1 91 LEU MD2 3.650 . 6.530 3.861 2.801 4.081 . 0 0 "[ . 1 . 2]" 1
1450 1 91 LEU H 1 91 LEU MD2 4.230 . 8.010 4.267 3.697 4.506 . 0 0 "[ . 1 . 2]" 1
1451 1 91 LEU H 1 91 LEU HG 3.490 . 6.130 4.725 4.551 4.833 . 0 0 "[ . 1 . 2]" 1
1452 1 91 LEU HA 1 91 LEU MD1 4.330 . 8.440 3.732 3.530 4.110 . 0 0 "[ . 1 . 2]" 1
1453 1 91 LEU HA 1 91 LEU MD1 3.870 . 7.120 2.977 2.525 3.820 . 0 0 "[ . 1 . 2]" 1
1454 1 91 LEU HA 1 91 LEU MD2 3.490 . 6.170 2.722 2.341 3.824 . 0 0 "[ . 1 . 2]" 1
1455 1 91 LEU HA 1 91 LEU MD2 3.190 . 5.400 2.544 2.333 3.022 . 0 0 "[ . 1 . 2]" 1
1456 1 91 LEU HA 1 91 LEU HG 3.870 . 7.120 3.838 2.998 4.204 . 0 0 "[ . 1 . 2]" 1
1457 1 91 LEU HA 1 93 PRO HD2 4.410 . 8.620 3.639 3.525 3.771 . 0 0 "[ . 1 . 2]" 1
1458 1 91 LEU HA 1 94 TYR H 3.180 . 4.980 3.340 3.201 3.549 . 0 0 "[ . 1 . 2]" 1
1459 1 91 LEU HA 1 94 TYR QD 3.540 . 6.180 5.192 3.778 6.288 0.108 2 0 "[ . 1 . 2]" 1
1460 1 91 LEU HB2 1 92 ASN H 3.690 . 6.110 4.131 3.825 4.634 . 0 0 "[ . 1 . 2]" 1
1461 1 91 LEU HB3 1 92 ASN H 3.270 . 5.170 2.909 2.426 3.644 . 0 0 "[ . 1 . 2]" 1
1462 1 91 LEU MD1 1 94 TYR QD 4.310 . 8.230 4.833 3.077 7.030 . 0 0 "[ . 1 . 2]" 1
1463 1 91 LEU MD2 1 92 ASN H 3.690 . 6.110 4.288 2.855 4.653 . 0 0 "[ . 1 . 2]" 1
1464 1 91 LEU MD2 1 94 TYR QD 3.850 . 6.910 3.967 2.613 5.456 . 0 0 "[ . 1 . 2]" 1
1465 1 91 LEU MD2 1 94 TYR QE 4.390 . 8.450 3.874 2.199 6.404 . 0 0 "[ . 1 . 2]" 1
1466 1 92 ASN H 1 92 ASN HA 3.690 2.500 4.880 2.869 2.763 2.919 . 0 0 "[ . 1 . 2]" 1
1467 1 92 ASN H 1 92 ASN HB2 3.720 . 6.680 2.247 1.777 2.513 . 0 0 "[ . 1 . 2]" 1
1468 1 92 ASN H 1 92 ASN HB3 3.490 . 6.170 3.485 2.994 3.686 . 0 0 "[ . 1 . 2]" 1
1469 1 92 ASN H 1 92 ASN HD21 3.690 . 6.110 2.860 2.139 3.362 . 0 0 "[ . 1 . 2]" 1
1470 1 92 ASN H 1 92 ASN HD22 3.690 . 6.110 3.899 3.236 4.655 . 0 0 "[ . 1 . 2]" 1
1471 1 92 ASN H 1 93 PRO HD2 3.950 . 7.330 2.979 1.971 3.595 . 0 0 "[ . 1 . 2]" 1
1472 1 92 ASN H 1 93 PRO HD3 3.650 . 6.530 2.758 2.244 3.559 . 0 0 "[ . 1 . 2]" 1
1473 1 92 ASN H 1 93 PRO QG 3.180 . 4.980 4.254 3.812 4.576 . 0 0 "[ . 1 . 2]" 1
1474 1 92 ASN HB2 1 92 ASN HD22 3.720 . 6.780 3.570 3.426 4.040 . 0 0 "[ . 1 . 2]" 1
1475 1 92 ASN HB3 1 92 ASN HD22 3.600 . 5.910 4.054 3.872 4.226 . 0 0 "[ . 1 . 2]" 1
1476 1 93 PRO HA 1 93 PRO HD3 4.030 . 7.540 3.570 2.950 3.916 . 0 0 "[ . 1 . 2]" 1
1477 1 93 PRO HA 1 94 TYR H 3.950 2.660 5.240 3.380 3.250 3.577 . 0 0 "[ . 1 . 2]" 1
1478 1 93 PRO HA 1 94 TYR HB3 3.950 . 7.330 5.625 5.258 5.888 . 0 0 "[ . 1 . 2]" 1
1479 1 93 PRO HB3 1 97 MET ME 3.850 . 6.970 4.952 3.070 7.025 0.055 19 0 "[ . 1 . 2]" 1
1480 1 93 PRO HD2 1 94 TYR QD 4.160 . 7.810 5.366 4.156 7.008 . 0 0 "[ . 1 . 2]" 1
1481 1 94 TYR H 1 94 TYR HA 3.850 2.600 5.100 2.745 2.529 2.967 0.071 14 0 "[ . 1 . 2]" 1
1482 1 94 TYR H 1 94 TYR HB2 4.100 . 7.710 3.396 2.176 3.810 . 0 0 "[ . 1 . 2]" 1
1483 1 94 TYR H 1 94 TYR HB3 3.690 . 6.510 2.363 2.141 2.805 . 0 0 "[ . 1 . 2]" 1
1484 1 94 TYR H 1 94 TYR QD 3.460 . 5.950 2.965 1.958 4.153 . 0 0 "[ . 1 . 2]" 1
1485 1 94 TYR H 1 95 ARG H 3.390 2.290 4.490 3.732 2.495 4.450 . 0 0 "[ . 1 . 2]" 1
1486 1 94 TYR H 1 97 MET QG 3.720 . 6.720 4.965 3.903 6.379 . 0 0 "[ . 1 . 2]" 1
1487 1 94 TYR HA 1 94 TYR QD 3.390 . 5.810 3.486 2.451 3.819 . 0 0 "[ . 1 . 2]" 1
1488 1 94 TYR HA 1 95 ARG H 3.850 2.600 5.100 3.157 2.523 3.690 0.077 10 0 "[ . 1 . 2]" 1
1489 1 94 TYR HB2 1 94 TYR QD 3.340 . 5.760 2.571 2.213 2.855 . 0 0 "[ . 1 . 2]" 1
1490 1 94 TYR HB2 1 95 ARG H 3.460 . 5.940 2.610 1.640 4.341 . 0 0 "[ . 1 . 2]" 1
1491 1 94 TYR QE 1 97 MET QG 3.570 . 6.330 4.318 2.132 6.174 . 0 0 "[ . 1 . 2]" 1
1492 1 95 ARG H 1 95 ARG HA 3.620 2.440 4.800 2.749 2.334 3.013 0.106 6 0 "[ . 1 . 2]" 1
1493 1 95 ARG H 1 95 ARG HB2 3.020 . 4.640 3.122 2.285 4.095 . 0 0 "[ . 1 . 2]" 1
1494 1 95 ARG H 1 95 ARG HB3 3.850 . 6.970 3.129 2.339 4.282 . 0 0 "[ . 1 . 2]" 1
1495 1 95 ARG HA 1 95 ARG HE 3.270 . 5.640 4.666 3.616 5.371 . 0 0 "[ . 1 . 2]" 1
1496 1 95 ARG HA 1 96 LYS H 3.650 2.450 4.850 3.196 2.361 3.715 0.089 18 0 "[ . 1 . 2]" 1
1497 1 95 ARG HA 1 97 MET H 3.340 2.240 4.440 4.195 3.658 4.670 0.230 2 0 "[ . 1 . 2]" 1
1498 1 95 ARG HA 1 97 MET HB2 3.310 . 5.620 4.677 3.149 5.664 0.044 2 0 "[ . 1 . 2]" 1
1499 1 95 ARG HB2 1 95 ARG QD 3.420 . 5.950 3.054 2.445 3.690 . 0 0 "[ . 1 . 2]" 1
1500 1 95 ARG HB2 1 95 ARG HE 3.690 . 6.110 3.806 2.561 5.227 . 0 0 "[ . 1 . 2]" 1
1501 1 95 ARG HB2 1 96 LYS H 5.000 . 10.280 3.934 2.254 4.719 . 0 0 "[ . 1 . 2]" 1
1502 1 95 ARG HB2 1 97 MET H 3.860 . 6.500 4.269 3.228 5.137 . 0 0 "[ . 1 . 2]" 1
1503 1 95 ARG HB3 1 95 ARG QD 3.340 . 5.760 2.873 2.230 3.678 . 0 0 "[ . 1 . 2]" 1
1504 1 95 ARG HE 1 96 LYS QB 3.600 . 5.910 3.853 1.867 5.746 . 0 0 "[ . 1 . 2]" 1
1505 1 96 LYS H 1 96 LYS HB2 4.000 . 7.380 2.911 1.947 4.152 . 0 0 "[ . 1 . 2]" 1
1506 1 96 LYS H 1 96 LYS HB3 4.080 . 7.590 3.253 2.172 4.188 . 0 0 "[ . 1 . 2]" 1
1507 1 96 LYS HA 1 96 LYS QD 3.720 . 6.720 2.816 1.976 4.390 . 0 0 "[ . 1 . 2]" 1
1508 1 96 LYS HA 1 96 LYS QE 3.490 . 6.130 3.869 2.074 5.510 . 0 0 "[ . 1 . 2]" 1
1509 1 96 LYS HA 1 97 MET H 2.930 2.050 3.810 3.097 2.227 3.508 . 0 0 "[ . 1 . 2]" 1
1510 1 96 LYS HA 1 98 ALA H 3.020 . 4.640 3.111 2.747 3.392 . 0 0 "[ . 1 . 2]" 1
1511 1 96 LYS QB 1 97 MET H 3.020 . 4.640 3.419 2.241 4.037 . 0 0 "[ . 1 . 2]" 1
1512 1 96 LYS HB3 1 97 MET HA 3.690 . 6.570 5.032 4.063 6.458 . 0 0 "[ . 1 . 2]" 1
1513 1 96 LYS QE 1 98 ALA MB 3.270 . 5.580 5.122 3.016 5.658 0.078 15 0 "[ . 1 . 2]" 1
1514 1 96 LYS QG 1 97 MET H 3.860 . 6.500 4.335 2.690 5.037 . 0 0 "[ . 1 . 2]" 1
1515 1 97 MET H 1 97 MET HA 3.420 2.300 4.540 2.658 2.225 2.982 0.075 1 0 "[ . 1 . 2]" 1
1516 1 97 MET H 1 97 MET HB3 3.100 . 4.810 3.187 2.198 4.152 . 0 0 "[ . 1 . 2]" 1
1517 1 97 MET H 1 97 MET QG 3.690 . 6.110 2.987 1.980 4.074 . 0 0 "[ . 1 . 2]" 1
1518 1 97 MET HA 1 97 MET QG 3.190 . 5.400 2.838 2.234 3.543 . 0 0 "[ . 1 . 2]" 1
1519 1 97 MET HA 1 98 ALA H 4.230 2.850 5.610 3.353 2.785 3.612 0.065 10 0 "[ . 1 . 2]" 1
1520 1 97 MET QB 1 98 ALA MB 3.490 . 6.130 3.867 2.791 4.583 . 0 0 "[ . 1 . 2]" 1
1521 1 97 MET HB3 1 98 ALA H 3.600 . 5.910 3.940 2.411 4.716 . 0 0 "[ . 1 . 2]" 1
1522 1 98 ALA H 1 99 ARG QG 4.310 . 8.230 5.520 3.975 7.080 . 0 0 "[ . 1 . 2]" 1
1523 1 98 ALA HA 1 99 ARG H 2.960 . 3.930 2.952 2.196 3.622 . 0 0 "[ . 1 . 2]" 1
1524 1 98 ALA MB 1 99 ARG H 3.600 . 5.910 3.053 1.934 3.840 . 0 0 "[ . 1 . 2]" 1
1525 1 99 ARG H 1 99 ARG HB3 3.340 . 5.760 3.416 2.534 4.189 . 0 0 "[ . 1 . 2]" 1
1526 1 99 ARG HA 1 99 ARG HB2 2.960 . 4.860 2.723 2.319 3.077 . 0 0 "[ . 1 . 2]" 1
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