NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
430550 |
2joo   |
15405 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2joo
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 1063
_Distance_constraint_stats_list.Viol_count 2055
_Distance_constraint_stats_list.Viol_total 3085.081
_Distance_constraint_stats_list.Viol_max 0.919
_Distance_constraint_stats_list.Viol_rms 0.0355
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0073
_Distance_constraint_stats_list.Viol_average_violations_only 0.0751
_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 1 VAL 1.314 0.200 7 0 "[ . 1 . 2]"
1 2 VAL 0.233 0.103 14 0 "[ . 1 . 2]"
1 3 TYR 3.419 0.734 15 2 "[ . 1 + - 2]"
1 4 THR 2.808 0.144 2 0 "[ . 1 . 2]"
1 5 ASP 2.814 0.157 7 0 "[ . 1 . 2]"
1 6 CYS 4.901 0.343 6 0 "[ . 1 . 2]"
1 7 THR 5.760 0.343 6 0 "[ . 1 . 2]"
1 8 GLU 6.008 0.302 16 0 "[ . 1 . 2]"
1 9 SER 3.270 0.226 7 0 "[ . 1 . 2]"
1 10 GLY 5.508 0.157 18 0 "[ . 1 . 2]"
1 11 GLN 15.089 0.868 14 1 "[ . 1 +. 2]"
1 12 ASN 6.265 0.142 20 0 "[ . 1 . 2]"
1 13 LEU 8.061 0.167 20 0 "[ . 1 . 2]"
1 14 CYS 6.296 0.258 14 0 "[ . 1 . 2]"
1 15 LEU 7.855 0.387 14 0 "[ . 1 . 2]"
1 16 CYS 4.604 0.153 20 0 "[ . 1 . 2]"
1 17 GLU 16.697 0.733 8 2 "[ . + 1 - . 2]"
1 18 GLY 6.528 0.733 8 1 "[ . + 1 . 2]"
1 19 SER 8.745 0.543 12 1 "[ . 1 + . 2]"
1 20 ASN 4.143 0.193 12 0 "[ . 1 . 2]"
1 21 VAL 7.001 0.734 15 2 "[ . 1 + - 2]"
1 22 CYS 5.004 0.198 18 0 "[ . 1 . 2]"
1 23 GLY 2.035 0.168 5 0 "[ . 1 . 2]"
1 24 GLN 1.862 0.111 12 0 "[ . 1 . 2]"
1 25 GLY 1.814 0.162 2 0 "[ . 1 . 2]"
1 26 ASN 3.943 0.168 5 0 "[ . 1 . 2]"
1 27 LYS 3.632 0.162 2 0 "[ . 1 . 2]"
1 28 CYS 2.889 0.189 4 0 "[ . 1 . 2]"
1 29 ILE 4.382 0.170 19 0 "[ . 1 . 2]"
1 30 LEU 10.098 0.851 3 3 "[ + . 1 * . -]"
1 31 GLY 3.656 0.271 2 0 "[ . 1 . 2]"
1 32 ARG 2.920 0.514 4 1 "[ +. 1 . 2]"
1 33 GLY 1.702 0.329 18 0 "[ . 1 . 2]"
1 34 ASP 0.022 0.022 8 0 "[ . 1 . 2]"
1 35 SER 4.111 0.329 18 0 "[ . 1 . 2]"
1 36 LYS 8.992 0.851 3 5 "[ +-. * * . *]"
1 37 ASN 11.301 0.538 10 1 "[ . + . 2]"
1 38 GLN 6.303 0.696 9 2 "[ . +1 - . 2]"
1 39 CYS 8.751 0.655 12 1 "[ . 1 + . 2]"
1 40 VAL 6.922 0.696 9 1 "[ . +1 . 2]"
1 41 THR 1.999 0.159 16 0 "[ . 1 . 2]"
1 42 GLY 1.960 0.099 10 0 "[ . 1 . 2]"
1 43 GLU 2.625 0.159 16 0 "[ . 1 . 2]"
1 44 GLY 2.542 0.130 2 0 "[ . 1 . 2]"
1 45 THR 4.513 0.218 16 0 "[ . 1 . 2]"
1 46 PRO 1.036 0.098 2 0 "[ . 1 . 2]"
1 47 LYS 20.039 0.919 14 2 "[ . 1 +.- 2]"
1 48 PRO 10.394 0.919 14 5 "[ *- 1* +.* 2]"
1 49 GLN 9.081 0.577 5 3 "[ +- 1* . 2]"
1 50 SER 1.601 0.222 4 0 "[ . 1 . 2]"
1 51 HIS 0.442 0.311 2 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 1 VAL HA 1 1 VAL HB 2.215 . 2.804 2.613 2.455 3.004 0.200 7 0 "[ . 1 . 2]" 1
2 1 1 VAL HA 1 1 VAL MG1 2.782 . 3.710 2.336 2.258 2.428 . 0 0 "[ . 1 . 2]" 1
3 1 1 VAL HA 1 1 VAL MG2 3.120 . 4.288 3.014 2.361 3.219 . 0 0 "[ . 1 . 2]" 1
4 1 1 VAL HA 1 2 VAL H 2.264 . 2.879 2.421 2.153 2.982 0.103 14 0 "[ . 1 . 2]" 1
5 1 1 VAL HA 1 2 VAL MG2 3.572 2.041 5.103 3.750 3.216 4.589 . 0 0 "[ . 1 . 2]" 1
6 1 1 VAL HA 1 3 TYR HA 4.656 2.054 7.258 6.496 5.691 7.173 . 0 0 "[ . 1 . 2]" 1
7 1 1 VAL HB 1 1 VAL MG1 2.430 . 3.138 2.126 2.122 2.130 . 0 0 "[ . 1 . 2]" 1
8 1 1 VAL HB 1 1 VAL MG2 2.438 . 3.151 2.129 2.124 2.134 . 0 0 "[ . 1 . 2]" 1
9 1 1 VAL HB 1 2 VAL MG2 4.777 2.038 7.516 4.901 4.319 5.292 . 0 0 "[ . 1 . 2]" 1
10 1 1 VAL HB 1 3 TYR QE 4.110 2.083 6.137 3.681 2.050 5.346 0.033 10 0 "[ . 1 . 2]" 1
11 1 1 VAL MG1 1 2 VAL HB 4.857 2.026 7.688 5.822 4.509 6.502 . 0 0 "[ . 1 . 2]" 1
12 1 1 VAL MG1 1 3 TYR HA 5.083 . 8.184 6.268 3.851 7.732 . 0 0 "[ . 1 . 2]" 1
13 1 1 VAL MG1 1 3 TYR QD 4.576 2.063 7.089 4.525 2.151 6.645 . 0 0 "[ . 1 . 2]" 1
14 1 1 VAL MG1 1 3 TYR QE 4.576 2.063 7.089 3.535 2.061 6.142 0.002 13 0 "[ . 1 . 2]" 1
15 1 1 VAL MG2 1 2 VAL H 4.024 2.081 5.967 3.843 3.499 4.373 . 0 0 "[ . 1 . 2]" 1
16 1 1 VAL MG2 1 3 TYR QD 4.576 2.063 7.089 4.199 2.568 5.942 . 0 0 "[ . 1 . 2]" 1
17 1 1 VAL MG2 1 3 TYR QE 4.576 2.063 7.089 3.680 2.025 5.580 0.038 10 0 "[ . 1 . 2]" 1
18 1 2 VAL H 1 2 VAL HA 2.458 . 3.183 2.939 2.906 2.954 . 0 0 "[ . 1 . 2]" 1
19 1 2 VAL H 1 2 VAL HB 2.426 . 3.132 2.640 2.515 2.765 . 0 0 "[ . 1 . 2]" 1
20 1 2 VAL H 1 2 VAL MG1 3.572 2.041 5.103 3.850 3.789 3.912 . 0 0 "[ . 1 . 2]" 1
21 1 2 VAL H 1 2 VAL MG2 3.539 2.036 5.042 2.523 2.113 2.805 . 0 0 "[ . 1 . 2]" 1
22 1 2 VAL H 1 4 THR H 4.872 2.024 7.720 7.260 6.802 7.637 . 0 0 "[ . 1 . 2]" 1
23 1 2 VAL HA 1 2 VAL HB 2.442 . 3.157 3.026 3.017 3.031 . 0 0 "[ . 1 . 2]" 1
24 1 2 VAL HA 1 2 VAL MG1 3.175 . 4.384 2.373 2.316 2.446 . 0 0 "[ . 1 . 2]" 1
25 1 2 VAL HA 1 2 VAL MG2 3.096 . 4.246 2.425 2.334 2.493 . 0 0 "[ . 1 . 2]" 1
26 1 2 VAL HA 1 3 TYR H 2.273 . 2.893 2.214 2.116 2.394 . 0 0 "[ . 1 . 2]" 1
27 1 2 VAL HA 1 3 TYR QD 4.603 2.061 7.145 4.414 3.236 5.019 . 0 0 "[ . 1 . 2]" 1
28 1 2 VAL HA 1 3 TYR QE 4.583 2.063 7.103 5.769 4.675 6.366 . 0 0 "[ . 1 . 2]" 1
29 1 2 VAL HB 1 2 VAL MG1 2.422 . 3.126 2.129 2.126 2.134 . 0 0 "[ . 1 . 2]" 1
30 1 2 VAL HB 1 2 VAL MG2 2.497 . 3.245 2.129 2.125 2.132 . 0 0 "[ . 1 . 2]" 1
31 1 2 VAL MG1 1 3 TYR H 3.550 2.038 5.062 3.192 2.235 3.732 . 0 0 "[ . 1 . 2]" 1
32 1 2 VAL MG1 1 3 TYR HB3 4.809 2.034 7.584 5.498 4.796 5.920 . 0 0 "[ . 1 . 2]" 1
33 1 3 TYR H 1 3 TYR HA 2.434 . 3.145 2.927 2.902 2.951 . 0 0 "[ . 1 . 2]" 1
34 1 3 TYR H 1 3 TYR HB2 2.971 . 4.030 2.505 2.276 2.844 . 0 0 "[ . 1 . 2]" 1
35 1 3 TYR H 1 3 TYR HB3 2.960 . 4.012 3.683 3.543 3.886 . 0 0 "[ . 1 . 2]" 1
36 1 3 TYR H 1 3 TYR QD 3.566 2.040 5.092 3.073 2.188 3.618 . 0 0 "[ . 1 . 2]" 1
37 1 3 TYR H 1 15 LEU MD1 4.354 2.079 6.629 5.339 3.926 6.118 . 0 0 "[ . 1 . 2]" 1
38 1 3 TYR H 1 15 LEU MD2 3.584 2.043 5.125 3.944 2.690 4.628 . 0 0 "[ . 1 . 2]" 1
39 1 3 TYR HA 1 3 TYR HB2 2.738 . 3.638 3.020 2.989 3.029 . 0 0 "[ . 1 . 2]" 1
40 1 3 TYR HA 1 3 TYR HB3 2.286 . 2.913 2.511 2.406 2.632 . 0 0 "[ . 1 . 2]" 1
41 1 3 TYR HA 1 3 TYR QD 2.978 . 4.042 2.546 1.887 3.168 0.027 11 0 "[ . 1 . 2]" 1
42 1 3 TYR HA 1 3 TYR QE 3.827 2.069 5.585 4.503 4.254 4.817 . 0 0 "[ . 1 . 2]" 1
43 1 3 TYR HA 1 4 THR H 2.321 . 2.967 2.429 2.267 2.692 . 0 0 "[ . 1 . 2]" 1
44 1 3 TYR HA 1 4 THR MG 5.186 . 8.413 3.842 3.290 4.534 . 0 0 "[ . 1 . 2]" 1
45 1 3 TYR HA 1 15 LEU HG 4.505 2.070 6.940 5.653 5.142 6.192 . 0 0 "[ . 1 . 2]" 1
46 1 3 TYR HB2 1 3 TYR QD 3.027 . 4.127 2.389 2.269 2.644 . 0 0 "[ . 1 . 2]" 1
47 1 3 TYR HB2 1 4 THR H 2.737 . 3.636 3.532 3.037 3.750 0.114 1 0 "[ . 1 . 2]" 1
48 1 3 TYR HB2 1 14 CYS HA 3.544 2.037 5.051 4.215 2.878 5.192 0.141 9 0 "[ . 1 . 2]" 1
49 1 3 TYR HB2 1 15 LEU MD1 4.610 2.060 7.160 4.426 3.855 4.955 . 0 0 "[ . 1 . 2]" 1
50 1 3 TYR HB2 1 15 LEU MD2 4.202 2.084 6.320 2.459 2.147 2.881 . 0 0 "[ . 1 . 2]" 1
51 1 3 TYR HB2 1 15 LEU HG 3.406 2.014 4.798 4.424 3.006 4.875 0.077 15 0 "[ . 1 . 2]" 1
52 1 3 TYR HB2 1 21 VAL QG 4.649 2.056 7.242 3.215 2.548 3.875 . 0 0 "[ . 1 . 2]" 1
53 1 3 TYR HB3 1 3 TYR QD 2.944 . 3.984 2.545 2.270 2.770 . 0 0 "[ . 1 . 2]" 1
54 1 3 TYR HB3 1 4 THR H 2.049 . 2.553 2.300 1.869 2.623 0.070 9 0 "[ . 1 . 2]" 1
55 1 3 TYR HB3 1 14 CYS HA 3.355 2.004 4.706 2.752 2.220 3.451 . 0 0 "[ . 1 . 2]" 1
56 1 3 TYR HB3 1 14 CYS HB3 3.555 2.038 5.072 4.458 3.716 5.111 0.039 13 0 "[ . 1 . 2]" 1
57 1 3 TYR HB3 1 15 LEU H 3.561 2.040 5.082 3.621 3.216 4.020 . 0 0 "[ . 1 . 2]" 1
58 1 3 TYR HB3 1 15 LEU MD1 4.137 2.083 6.191 4.658 3.999 5.528 . 0 0 "[ . 1 . 2]" 1
59 1 3 TYR HB3 1 15 LEU MD2 2.842 . 3.811 2.679 1.987 3.574 . 0 0 "[ . 1 . 2]" 1
60 1 3 TYR HB3 1 15 LEU HG 3.454 2.022 4.886 3.980 3.451 4.761 . 0 0 "[ . 1 . 2]" 1
61 1 3 TYR HB3 1 21 VAL QG 4.040 2.081 5.999 3.289 2.474 4.339 . 0 0 "[ . 1 . 2]" 1
62 1 3 TYR QD 1 4 THR H 5.202 . 8.449 3.639 2.942 3.995 . 0 0 "[ . 1 . 2]" 1
63 1 3 TYR QD 1 4 THR MG 5.057 . 8.125 5.421 4.275 6.047 . 0 0 "[ . 1 . 2]" 1
64 1 3 TYR QD 1 13 LEU HA 4.260 2.082 6.438 4.744 3.937 5.220 . 0 0 "[ . 1 . 2]" 1
65 1 3 TYR QD 1 13 LEU MD2 5.057 . 8.125 4.475 4.078 5.121 . 0 0 "[ . 1 . 2]" 1
66 1 3 TYR QD 1 15 LEU MD2 3.167 . 4.371 3.526 2.572 4.065 . 0 0 "[ . 1 . 2]" 1
67 1 3 TYR HD2 1 21 VAL HB 3.544 2.037 5.051 4.957 4.406 5.785 0.734 15 2 "[ . 1 + - 2]" 1
68 1 3 TYR HD2 1 21 VAL QG 3.382 2.009 4.755 2.386 1.946 3.484 0.063 17 0 "[ . 1 . 2]" 1
69 1 3 TYR QE 1 13 LEU HA 3.539 2.036 5.042 4.502 3.671 5.014 . 0 0 "[ . 1 . 2]" 1
70 1 3 TYR QE 1 13 LEU QB 4.606 2.060 7.152 3.269 2.564 4.467 . 0 0 "[ . 1 . 2]" 1
71 1 3 TYR QE 1 13 LEU MD2 4.352 2.079 6.625 3.226 2.641 4.009 . 0 0 "[ . 1 . 2]" 1
72 1 3 TYR QE 1 15 LEU MD1 7.482 . 14.199 7.331 6.610 7.885 . 0 0 "[ . 1 . 2]" 1
73 1 3 TYR QE 1 15 LEU MD2 5.063 . 8.139 5.222 4.406 5.866 . 0 0 "[ . 1 . 2]" 1
74 1 3 TYR QE 1 21 VAL HB 4.242 2.082 6.402 5.230 4.456 5.826 . 0 0 "[ . 1 . 2]" 1
75 1 3 TYR QE 1 21 VAL QG 3.337 2.001 4.673 2.997 2.050 3.545 . 0 0 "[ . 1 . 2]" 1
76 1 4 THR H 1 4 THR HA 2.271 . 2.890 2.918 2.891 2.932 0.042 7 0 "[ . 1 . 2]" 1
77 1 4 THR H 1 4 THR HB 3.175 . 4.384 3.712 3.598 3.828 . 0 0 "[ . 1 . 2]" 1
78 1 4 THR H 1 4 THR MG 3.172 . 4.380 3.335 2.841 3.758 . 0 0 "[ . 1 . 2]" 1
79 1 4 THR H 1 5 ASP H 3.292 . 4.593 4.304 4.179 4.408 . 0 0 "[ . 1 . 2]" 1
80 1 4 THR H 1 5 ASP HA 3.406 2.014 4.798 4.855 4.770 4.942 0.144 2 0 "[ . 1 . 2]" 1
81 1 4 THR H 1 15 LEU MD1 4.465 2.072 6.858 4.623 4.252 4.870 . 0 0 "[ . 1 . 2]" 1
82 1 4 THR H 1 15 LEU MD2 4.116 2.083 6.149 3.584 2.823 4.197 . 0 0 "[ . 1 . 2]" 1
83 1 4 THR H 1 15 LEU HG 2.970 . 4.028 3.851 3.431 4.112 0.084 14 0 "[ . 1 . 2]" 1
84 1 4 THR HA 1 4 THR HB 2.379 . 3.058 2.618 2.467 2.774 . 0 0 "[ . 1 . 2]" 1
85 1 4 THR HA 1 4 THR MG 2.422 . 3.126 2.243 2.165 2.383 . 0 0 "[ . 1 . 2]" 1
86 1 4 THR HA 1 5 ASP H 2.291 . 2.921 2.737 2.434 2.918 . 0 0 "[ . 1 . 2]" 1
87 1 4 THR HA 1 15 LEU HB2 4.380 2.078 6.682 5.535 4.617 6.639 . 0 0 "[ . 1 . 2]" 1
88 1 4 THR HA 1 15 LEU MD1 3.523 2.034 5.012 3.095 2.629 3.918 . 0 0 "[ . 1 . 2]" 1
89 1 4 THR HA 1 15 LEU MD2 4.089 2.083 6.095 3.517 2.442 4.438 . 0 0 "[ . 1 . 2]" 1
90 1 4 THR HB 1 5 ASP H 2.058 . 2.566 1.904 1.638 2.325 . 0 0 "[ . 1 . 2]" 1
91 1 4 THR MG 1 5 ASP H 3.450 2.022 4.878 3.240 2.712 3.591 . 0 0 "[ . 1 . 2]" 1
92 1 5 ASP H 1 5 ASP HA 2.426 . 3.132 2.911 2.896 2.920 . 0 0 "[ . 1 . 2]" 1
93 1 5 ASP H 1 5 ASP QB 2.456 . 3.180 2.520 2.285 2.990 . 0 0 "[ . 1 . 2]" 1
94 1 5 ASP H 1 7 THR HA 4.652 2.055 7.249 6.811 6.554 7.055 . 0 0 "[ . 1 . 2]" 1
95 1 5 ASP H 1 15 LEU MD1 4.096 2.083 6.109 3.915 3.650 4.079 . 0 0 "[ . 1 . 2]" 1
96 1 5 ASP H 1 15 LEU HG 3.027 . 4.127 3.939 3.699 4.147 0.020 2 0 "[ . 1 . 2]" 1
97 1 5 ASP HA 1 5 ASP QB 2.415 . 3.115 2.347 2.170 2.466 . 0 0 "[ . 1 . 2]" 1
98 1 5 ASP HA 1 6 CYS H 2.088 . 2.611 2.319 2.240 2.525 . 0 0 "[ . 1 . 2]" 1
99 1 5 ASP HA 1 14 CYS HB2 3.035 . 4.140 3.048 2.845 3.392 . 0 0 "[ . 1 . 2]" 1
100 1 5 ASP HA 1 15 LEU H 2.759 . 3.673 2.768 2.360 3.154 . 0 0 "[ . 1 . 2]" 1
101 1 5 ASP HA 1 15 LEU HB2 2.926 . 3.953 3.332 2.549 3.947 . 0 0 "[ . 1 . 2]" 1
102 1 5 ASP HA 1 15 LEU HB3 3.394 2.012 4.776 4.669 4.160 4.876 0.100 19 0 "[ . 1 . 2]" 1
103 1 5 ASP HA 1 15 LEU MD1 3.237 . 4.494 3.480 3.083 3.759 . 0 0 "[ . 1 . 2]" 1
104 1 5 ASP HA 1 15 LEU MD2 4.099 2.083 6.115 4.263 3.731 4.573 . 0 0 "[ . 1 . 2]" 1
105 1 5 ASP HA 1 15 LEU HG 2.446 . 3.164 2.759 2.116 3.184 0.020 2 0 "[ . 1 . 2]" 1
106 1 5 ASP HA 1 21 VAL HA 4.239 2.083 6.395 6.430 6.265 6.552 0.157 7 0 "[ . 1 . 2]" 1
107 1 5 ASP QB 1 6 CYS H 2.987 . 4.058 2.695 2.187 2.963 . 0 0 "[ . 1 . 2]" 1
108 1 5 ASP QB 1 6 CYS HA 4.012 2.080 5.944 4.512 4.352 4.624 . 0 0 "[ . 1 . 2]" 1
109 1 5 ASP QB 1 6 CYS HB2 4.375 2.078 6.672 4.499 4.192 4.683 . 0 0 "[ . 1 . 2]" 1
110 1 5 ASP QB 1 7 THR MG 5.057 . 8.125 5.566 4.463 6.090 . 0 0 "[ . 1 . 2]" 1
111 1 5 ASP QB 1 15 LEU HB3 4.679 2.052 7.306 5.873 5.212 6.347 . 0 0 "[ . 1 . 2]" 1
112 1 6 CYS H 1 6 CYS HA 2.487 . 3.229 2.806 2.746 2.846 . 0 0 "[ . 1 . 2]" 1
113 1 6 CYS H 1 6 CYS HB2 2.520 . 3.282 2.712 2.600 2.822 . 0 0 "[ . 1 . 2]" 1
114 1 6 CYS H 1 6 CYS HB3 2.954 . 4.001 3.585 3.544 3.630 . 0 0 "[ . 1 . 2]" 1
115 1 6 CYS H 1 7 THR H 3.647 2.051 5.243 4.563 4.521 4.614 . 0 0 "[ . 1 . 2]" 1
116 1 6 CYS H 1 8 GLU H 4.138 2.083 6.193 5.885 5.560 6.130 . 0 0 "[ . 1 . 2]" 1
117 1 6 CYS H 1 14 CYS HA 3.990 2.079 5.901 5.327 5.016 5.558 . 0 0 "[ . 1 . 2]" 1
118 1 6 CYS H 1 14 CYS HB2 2.925 . 3.951 2.807 2.621 2.991 . 0 0 "[ . 1 . 2]" 1
119 1 6 CYS H 1 14 CYS HB3 3.134 . 4.312 4.324 4.115 4.408 0.096 14 0 "[ . 1 . 2]" 1
120 1 6 CYS H 1 15 LEU HB2 3.590 2.044 5.136 4.823 4.105 5.182 0.046 19 0 "[ . 1 . 2]" 1
121 1 6 CYS HA 1 6 CYS HB2 2.520 . 3.282 3.009 2.990 3.018 . 0 0 "[ . 1 . 2]" 1
122 1 6 CYS HA 1 6 CYS HB3 2.493 . 3.239 2.372 2.307 2.413 . 0 0 "[ . 1 . 2]" 1
123 1 6 CYS HA 1 7 THR H 2.404 . 3.097 2.153 2.109 2.205 . 0 0 "[ . 1 . 2]" 1
124 1 6 CYS HA 1 7 THR MG 4.415 2.076 6.754 5.094 3.867 5.426 . 0 0 "[ . 1 . 2]" 1
125 1 6 CYS HA 1 8 GLU H 3.010 . 4.097 3.670 3.477 3.823 . 0 0 "[ . 1 . 2]" 1
126 1 6 CYS HA 1 14 CYS HB2 2.463 . 3.191 2.862 2.467 3.055 . 0 0 "[ . 1 . 2]" 1
127 1 6 CYS HA 1 14 CYS HB3 2.912 . 3.930 3.280 2.928 3.535 . 0 0 "[ . 1 . 2]" 1
128 1 6 CYS HA 1 30 LEU QD 4.617 2.059 7.175 4.138 3.809 4.820 . 0 0 "[ . 1 . 2]" 1
129 1 6 CYS HA 1 47 LYS HD2 2.711 . 3.593 2.415 1.953 3.696 0.103 14 0 "[ . 1 . 2]" 1
130 1 6 CYS HA 1 47 LYS HD3 3.220 . 4.464 3.680 1.962 4.496 0.032 16 0 "[ . 1 . 2]" 1
131 1 6 CYS HB2 1 7 THR H 2.889 . 3.891 3.935 3.817 3.994 0.103 19 0 "[ . 1 . 2]" 1
132 1 6 CYS HB2 1 12 ASN HB2 5.543 . 9.230 9.187 8.927 9.339 0.109 12 0 "[ . 1 . 2]" 1
133 1 6 CYS HB3 1 7 THR H 2.418 . 3.120 3.101 2.833 3.195 0.075 9 0 "[ . 1 . 2]" 1
134 1 6 CYS HB3 1 7 THR HB 3.809 2.068 5.550 5.651 5.507 5.893 0.343 6 0 "[ . 1 . 2]" 1
135 1 6 CYS HB3 1 7 THR MG 4.638 2.057 7.219 5.835 4.677 6.152 . 0 0 "[ . 1 . 2]" 1
136 1 6 CYS HB3 1 8 GLU H 2.638 . 3.473 3.235 2.899 3.533 0.060 15 0 "[ . 1 . 2]" 1
137 1 6 CYS HB3 1 8 GLU HG3 5.083 . 8.184 7.442 6.239 8.097 . 0 0 "[ . 1 . 2]" 1
138 1 6 CYS HB3 1 11 GLN H 3.612 2.047 5.177 4.584 4.304 5.006 . 0 0 "[ . 1 . 2]" 1
139 1 6 CYS HB3 1 11 GLN HB3 3.337 2.001 4.673 3.684 3.180 4.051 . 0 0 "[ . 1 . 2]" 1
140 1 6 CYS HB3 1 14 CYS HB2 3.427 2.017 4.837 4.303 4.149 4.478 . 0 0 "[ . 1 . 2]" 1
141 1 6 CYS HB3 1 30 LEU QD 3.249 . 4.516 2.747 2.236 3.729 . 0 0 "[ . 1 . 2]" 1
142 1 6 CYS HB3 1 47 LYS HD2 3.877 2.073 5.681 4.588 4.094 5.566 . 0 0 "[ . 1 . 2]" 1
143 1 7 THR H 1 7 THR HA 2.389 . 3.074 2.937 2.920 2.951 . 0 0 "[ . 1 . 2]" 1
144 1 7 THR H 1 7 THR HB 2.537 . 3.309 2.704 2.557 3.445 0.136 6 0 "[ . 1 . 2]" 1
145 1 7 THR H 1 7 THR MG 3.517 2.032 5.002 3.562 2.156 3.862 . 0 0 "[ . 1 . 2]" 1
146 1 7 THR H 1 8 GLU H 2.030 . 2.524 2.016 1.904 2.169 . 0 0 "[ . 1 . 2]" 1
147 1 7 THR H 1 11 GLN HB2 3.367 2.007 4.727 4.083 3.915 4.331 . 0 0 "[ . 1 . 2]" 1
148 1 7 THR H 1 11 GLN HB3 3.330 . 4.660 4.459 4.163 4.686 0.026 18 0 "[ . 1 . 2]" 1
149 1 7 THR H 1 11 GLN HE21 2.347 . 3.008 2.985 2.534 3.196 0.188 13 0 "[ . 1 . 2]" 1
150 1 7 THR H 1 11 GLN HE22 2.976 . 4.039 3.703 3.009 4.061 0.022 3 0 "[ . 1 . 2]" 1
151 1 7 THR H 1 30 LEU QD 5.306 . 8.684 3.820 3.457 4.177 . 0 0 "[ . 1 . 2]" 1
152 1 7 THR H 1 47 LYS HD2 3.309 . 4.623 2.963 2.054 3.918 . 0 0 "[ . 1 . 2]" 1
153 1 7 THR H 1 47 LYS HD3 3.482 2.027 4.937 4.344 2.001 4.958 0.026 14 0 "[ . 1 . 2]" 1
154 1 7 THR H 1 47 LYS HE2 2.987 . 4.058 3.765 2.769 4.133 0.075 1 0 "[ . 1 . 2]" 1
155 1 7 THR H 1 47 LYS HE3 4.096 2.083 6.109 3.751 2.398 4.905 . 0 0 "[ . 1 . 2]" 1
156 1 7 THR H 1 47 LYS HG2 3.802 2.067 5.537 3.945 3.204 4.538 . 0 0 "[ . 1 . 2]" 1
157 1 7 THR H 1 47 LYS HG3 3.906 2.076 5.736 2.925 2.330 4.105 . 0 0 "[ . 1 . 2]" 1
158 1 7 THR HA 1 7 THR HB 2.434 . 3.145 2.924 2.509 3.031 . 0 0 "[ . 1 . 2]" 1
159 1 7 THR HA 1 7 THR MG 3.386 2.010 4.762 2.450 2.196 3.213 . 0 0 "[ . 1 . 2]" 1
160 1 7 THR HA 1 8 GLU H 2.752 . 3.661 3.421 3.321 3.484 . 0 0 "[ . 1 . 2]" 1
161 1 7 THR HA 1 9 SER H 4.361 2.079 6.643 6.623 6.504 6.750 0.107 19 0 "[ . 1 . 2]" 1
162 1 7 THR HA 1 14 CYS HB2 4.631 2.058 7.204 6.961 6.612 7.152 . 0 0 "[ . 1 . 2]" 1
163 1 7 THR HA 1 30 LEU QD 4.679 2.052 7.306 3.151 2.662 3.700 . 0 0 "[ . 1 . 2]" 1
164 1 7 THR HA 1 47 LYS HE2 4.142 2.084 6.200 5.305 4.356 5.981 . 0 0 "[ . 1 . 2]" 1
165 1 7 THR HB 1 8 GLU H 2.948 . 3.991 3.253 2.852 4.072 0.081 2 0 "[ . 1 . 2]" 1
166 1 7 THR HB 1 8 GLU HB2 3.909 2.076 5.742 3.880 3.205 5.451 . 0 0 "[ . 1 . 2]" 1
167 1 7 THR HB 1 11 GLN HE21 3.478 2.027 4.929 3.665 2.544 4.695 . 0 0 "[ . 1 . 2]" 1
168 1 7 THR HB 1 11 GLN HG3 5.012 . 8.026 6.991 5.961 8.065 0.039 15 0 "[ . 1 . 2]" 1
169 1 7 THR HB 1 30 LEU QD 4.818 2.032 7.604 4.841 4.465 5.241 . 0 0 "[ . 1 . 2]" 1
170 1 7 THR MG 1 11 GLN HE22 4.096 2.083 6.109 4.090 2.107 4.939 . 0 0 "[ . 1 . 2]" 1
171 1 7 THR MG 1 47 LYS HE2 3.841 2.070 5.612 3.983 2.054 5.735 0.123 14 0 "[ . 1 . 2]" 1
172 1 7 THR MG 1 47 LYS HE3 4.278 2.082 6.474 4.334 2.393 5.908 . 0 0 "[ . 1 . 2]" 1
173 1 8 GLU H 1 8 GLU HA 2.565 . 3.355 2.925 2.892 2.944 . 0 0 "[ . 1 . 2]" 1
174 1 8 GLU H 1 8 GLU HB2 2.784 . 3.714 2.617 2.399 3.064 . 0 0 "[ . 1 . 2]" 1
175 1 8 GLU H 1 8 GLU HG2 3.555 2.038 5.072 4.230 3.491 4.758 . 0 0 "[ . 1 . 2]" 1
176 1 8 GLU H 1 8 GLU HG3 3.309 . 4.623 4.377 3.247 4.925 0.302 16 0 "[ . 1 . 2]" 1
177 1 8 GLU H 1 9 SER H 3.341 2.002 4.680 4.397 4.340 4.473 . 0 0 "[ . 1 . 2]" 1
178 1 8 GLU H 1 10 GLY HA2 4.988 2.003 7.973 7.744 7.500 7.889 . 0 0 "[ . 1 . 2]" 1
179 1 8 GLU H 1 10 GLY HA3 4.760 2.041 7.479 7.100 6.903 7.367 . 0 0 "[ . 1 . 2]" 1
180 1 8 GLU H 1 11 GLN HB2 3.309 . 4.623 3.287 2.913 3.424 . 0 0 "[ . 1 . 2]" 1
181 1 8 GLU H 1 11 GLN HB3 3.512 2.032 4.992 4.417 4.026 4.707 . 0 0 "[ . 1 . 2]" 1
182 1 8 GLU H 1 11 GLN HE21 2.743 . 3.646 3.149 2.882 3.380 . 0 0 "[ . 1 . 2]" 1
183 1 8 GLU H 1 11 GLN HE22 3.010 . 4.097 3.097 2.654 3.685 . 0 0 "[ . 1 . 2]" 1
184 1 8 GLU H 1 11 GLN HG2 3.351 2.003 4.699 4.682 4.195 4.814 0.115 5 0 "[ . 1 . 2]" 1
185 1 8 GLU H 1 30 LEU H 4.161 2.083 6.239 6.234 6.126 6.297 0.058 15 0 "[ . 1 . 2]" 1
186 1 8 GLU H 1 30 LEU QD 4.156 2.083 6.229 3.139 2.912 3.333 . 0 0 "[ . 1 . 2]" 1
187 1 8 GLU HA 1 8 GLU HB2 2.467 . 3.197 2.904 2.577 3.008 . 0 0 "[ . 1 . 2]" 1
188 1 8 GLU HA 1 8 GLU HG2 2.984 . 4.053 2.647 2.372 3.590 . 0 0 "[ . 1 . 2]" 1
189 1 8 GLU HA 1 8 GLU HG3 3.001 . 4.082 3.232 2.316 3.692 . 0 0 "[ . 1 . 2]" 1
190 1 8 GLU HA 1 9 SER H 2.407 . 3.102 2.303 2.256 2.361 . 0 0 "[ . 1 . 2]" 1
191 1 8 GLU HA 1 30 LEU QD 4.563 2.064 7.062 3.019 2.684 3.441 . 0 0 "[ . 1 . 2]" 1
192 1 8 GLU HB2 1 9 SER H 3.309 . 4.623 4.013 3.898 4.132 . 0 0 "[ . 1 . 2]" 1
193 1 8 GLU HB2 1 11 GLN H 3.578 2.042 5.114 4.825 4.237 5.203 0.089 18 0 "[ . 1 . 2]" 1
194 1 8 GLU HB2 1 11 GLN HE21 3.237 . 4.494 3.117 2.669 3.459 . 0 0 "[ . 1 . 2]" 1
195 1 8 GLU HB2 1 11 GLN HE22 2.686 . 3.552 1.818 1.719 2.035 0.101 17 0 "[ . 1 . 2]" 1
196 1 8 GLU HB2 1 11 GLN HG2 3.487 2.028 4.946 4.578 4.041 5.021 0.075 7 0 "[ . 1 . 2]" 1
197 1 8 GLU HB3 1 9 SER H 2.979 . 4.044 2.840 2.644 3.502 . 0 0 "[ . 1 . 2]" 1
198 1 8 GLU HB3 1 9 SER HA 4.010 2.081 5.939 4.542 4.443 4.726 . 0 0 "[ . 1 . 2]" 1
199 1 8 GLU HB3 1 11 GLN H 3.685 2.055 5.315 4.211 3.508 4.642 . 0 0 "[ . 1 . 2]" 1
200 1 8 GLU HB3 1 11 GLN HE21 3.367 2.007 4.727 4.376 3.287 4.640 . 0 0 "[ . 1 . 2]" 1
201 1 8 GLU HB3 1 11 GLN HE22 3.003 . 4.085 3.187 2.478 3.439 . 0 0 "[ . 1 . 2]" 1
202 1 8 GLU HB3 1 11 GLN HG2 3.692 2.056 5.328 5.323 4.248 5.546 0.218 13 0 "[ . 1 . 2]" 1
203 1 8 GLU HG2 1 11 GLN HE22 3.999 2.080 5.918 3.889 3.063 4.607 . 0 0 "[ . 1 . 2]" 1
204 1 8 GLU HG3 1 11 GLN HE22 3.988 2.080 5.896 3.555 2.612 4.713 . 0 0 "[ . 1 . 2]" 1
205 1 9 SER H 1 9 SER HA 2.353 . 3.018 2.905 2.898 2.911 . 0 0 "[ . 1 . 2]" 1
206 1 9 SER H 1 9 SER HB2 2.716 . 3.601 2.510 2.433 2.620 . 0 0 "[ . 1 . 2]" 1
207 1 9 SER H 1 9 SER HB3 2.944 . 3.984 3.628 3.611 3.650 . 0 0 "[ . 1 . 2]" 1
208 1 9 SER H 1 10 GLY H 3.423 2.017 4.829 4.439 4.292 4.497 . 0 0 "[ . 1 . 2]" 1
209 1 9 SER H 1 10 GLY HA2 4.111 2.082 6.140 6.038 5.900 6.122 . 0 0 "[ . 1 . 2]" 1
210 1 9 SER H 1 11 GLN H 3.523 2.034 5.012 4.691 4.516 4.839 . 0 0 "[ . 1 . 2]" 1
211 1 9 SER H 1 11 GLN HG3 4.600 2.061 7.139 7.156 6.968 7.365 0.226 7 0 "[ . 1 . 2]" 1
212 1 9 SER H 1 30 LEU H 3.309 . 4.623 4.255 3.972 4.435 . 0 0 "[ . 1 . 2]" 1
213 1 9 SER HA 1 9 SER HB2 2.400 . 3.091 3.034 3.026 3.039 . 0 0 "[ . 1 . 2]" 1
214 1 9 SER HA 1 9 SER HB3 2.350 . 3.013 2.446 2.396 2.482 . 0 0 "[ . 1 . 2]" 1
215 1 9 SER HA 1 10 GLY H 2.335 . 2.989 2.153 2.127 2.174 . 0 0 "[ . 1 . 2]" 1
216 1 9 SER HA 1 11 GLN H 2.741 . 3.642 3.244 3.081 3.367 . 0 0 "[ . 1 . 2]" 1
217 1 9 SER HA 1 29 ILE HA 2.540 . 3.314 2.155 1.861 2.357 . 0 0 "[ . 1 . 2]" 1
218 1 9 SER HA 1 29 ILE MD 4.627 2.058 7.196 5.808 5.422 6.020 . 0 0 "[ . 1 . 2]" 1
219 1 9 SER HA 1 29 ILE MG 3.450 2.022 4.878 3.237 2.861 3.487 . 0 0 "[ . 1 . 2]" 1
220 1 9 SER HA 1 30 LEU H 2.091 . 2.616 2.598 2.434 2.728 0.112 9 0 "[ . 1 . 2]" 1
221 1 9 SER HA 1 30 LEU QB 3.539 2.036 5.042 4.013 3.001 4.307 . 0 0 "[ . 1 . 2]" 1
222 1 9 SER HA 1 30 LEU QD 3.427 2.017 4.837 2.773 2.424 4.203 . 0 0 "[ . 1 . 2]" 1
223 1 9 SER HA 1 30 LEU HG 3.566 2.040 5.092 4.901 3.401 5.215 0.123 6 0 "[ . 1 . 2]" 1
224 1 9 SER HB2 1 10 GLY H 3.175 . 4.384 4.219 4.117 4.347 . 0 0 "[ . 1 . 2]" 1
225 1 9 SER HB2 1 29 ILE HA 3.206 . 4.440 3.936 3.748 4.112 . 0 0 "[ . 1 . 2]" 1
226 1 9 SER HB2 1 29 ILE HB 3.363 2.006 4.720 4.586 4.105 4.766 0.046 6 0 "[ . 1 . 2]" 1
227 1 9 SER HB2 1 29 ILE MD 4.872 2.024 7.720 5.976 5.521 6.227 . 0 0 "[ . 1 . 2]" 1
228 1 9 SER HB2 1 29 ILE MG 4.129 2.083 6.175 3.483 3.305 3.878 . 0 0 "[ . 1 . 2]" 1
229 1 9 SER HB2 1 30 LEU QB 4.329 2.080 6.578 4.546 4.265 4.840 . 0 0 "[ . 1 . 2]" 1
230 1 9 SER HB2 1 30 LEU QD 4.842 2.028 7.656 4.312 3.591 5.368 . 0 0 "[ . 1 . 2]" 1
231 1 9 SER HB3 1 10 GLY H 2.704 . 3.582 3.422 3.273 3.627 0.045 7 0 "[ . 1 . 2]" 1
232 1 9 SER HB3 1 11 GLN HA 5.031 . 8.068 7.960 7.770 8.074 0.006 17 0 "[ . 1 . 2]" 1
233 1 9 SER HB3 1 29 ILE HA 2.605 . 3.420 2.387 2.094 2.661 . 0 0 "[ . 1 . 2]" 1
234 1 9 SER HB3 1 29 ILE MD 4.135 2.083 6.187 4.623 4.169 4.877 . 0 0 "[ . 1 . 2]" 1
235 1 9 SER HB3 1 29 ILE MG 3.306 . 4.617 2.076 1.944 2.548 0.051 18 0 "[ . 1 . 2]" 1
236 1 9 SER HB3 1 30 LEU H 2.890 . 3.893 2.734 2.361 2.955 . 0 0 "[ . 1 . 2]" 1
237 1 10 GLY H 1 10 GLY HA2 2.312 . 2.954 2.459 2.412 2.511 . 0 0 "[ . 1 . 2]" 1
238 1 10 GLY H 1 10 GLY HA3 2.418 . 3.120 2.962 2.956 2.969 . 0 0 "[ . 1 . 2]" 1
239 1 10 GLY H 1 11 GLN H 1.818 . 2.215 2.126 1.950 2.222 0.007 5 0 "[ . 1 . 2]" 1
240 1 10 GLY H 1 12 ASN H 4.354 2.079 6.629 6.288 6.061 6.383 . 0 0 "[ . 1 . 2]" 1
241 1 10 GLY H 1 27 LYS QB 4.415 2.076 6.754 5.343 5.179 5.613 . 0 0 "[ . 1 . 2]" 1
242 1 10 GLY H 1 27 LYS HG2 3.801 2.068 5.534 3.928 3.561 5.014 . 0 0 "[ . 1 . 2]" 1
243 1 10 GLY H 1 27 LYS HG3 3.394 2.012 4.776 3.515 3.093 3.774 . 0 0 "[ . 1 . 2]" 1
244 1 10 GLY H 1 28 CYS H 2.981 . 4.047 3.940 3.756 4.087 0.040 14 0 "[ . 1 . 2]" 1
245 1 10 GLY H 1 28 CYS HB3 3.572 2.041 5.103 4.312 4.034 5.018 . 0 0 "[ . 1 . 2]" 1
246 1 10 GLY H 1 29 ILE H 3.482 2.027 4.937 4.576 4.425 4.629 . 0 0 "[ . 1 . 2]" 1
247 1 10 GLY H 1 29 ILE HA 2.524 . 3.289 2.769 2.552 2.990 . 0 0 "[ . 1 . 2]" 1
248 1 10 GLY H 1 29 ILE MD 4.380 2.078 6.682 5.572 5.406 5.714 . 0 0 "[ . 1 . 2]" 1
249 1 10 GLY H 1 29 ILE HG12 3.578 2.042 5.114 5.203 5.136 5.241 0.127 19 0 "[ . 1 . 2]" 1
250 1 10 GLY H 1 29 ILE MG 4.683 2.052 7.314 2.798 2.522 3.067 . 0 0 "[ . 1 . 2]" 1
251 1 10 GLY H 1 30 LEU H 3.882 2.073 5.691 4.331 4.043 4.523 . 0 0 "[ . 1 . 2]" 1
252 1 10 GLY H 1 30 LEU QD 4.508 2.069 6.947 4.204 3.788 5.667 . 0 0 "[ . 1 . 2]" 1
253 1 10 GLY H 1 37 ASN HA 4.814 2.033 7.595 7.455 7.244 7.689 0.094 3 0 "[ . 1 . 2]" 1
254 1 10 GLY HA2 1 11 GLN H 2.459 . 3.184 3.303 3.256 3.341 0.157 18 0 "[ . 1 . 2]" 1
255 1 10 GLY HA2 1 12 ASN H 4.593 2.062 7.124 6.454 6.322 6.603 . 0 0 "[ . 1 . 2]" 1
256 1 10 GLY HA2 1 43 GLU H 4.400 2.077 6.723 6.741 6.441 6.825 0.102 8 0 "[ . 1 . 2]" 1
257 1 10 GLY HA3 1 11 GLN H 3.148 . 4.337 3.196 3.129 3.269 . 0 0 "[ . 1 . 2]" 1
258 1 10 GLY HA3 1 27 LYS QB 4.193 2.084 6.302 5.559 5.414 5.744 . 0 0 "[ . 1 . 2]" 1
259 1 10 GLY HA3 1 27 LYS HD2 3.309 . 4.623 3.171 2.868 3.577 . 0 0 "[ . 1 . 2]" 1
260 1 10 GLY HA3 1 27 LYS HD3 3.463 2.024 4.902 4.408 4.046 4.625 . 0 0 "[ . 1 . 2]" 1
261 1 10 GLY HA3 1 27 LYS HG2 3.492 2.029 4.955 4.457 4.150 4.993 0.038 7 0 "[ . 1 . 2]" 1
262 1 10 GLY HA3 1 27 LYS HG3 3.351 2.003 4.699 3.805 3.656 4.133 . 0 0 "[ . 1 . 2]" 1
263 1 10 GLY HA3 1 29 ILE MG 4.423 2.076 6.770 4.065 3.775 4.446 . 0 0 "[ . 1 . 2]" 1
264 1 11 GLN H 1 11 GLN HA 2.784 . 3.714 2.916 2.910 2.928 . 0 0 "[ . 1 . 2]" 1
265 1 11 GLN H 1 11 GLN HB2 2.041 . 2.541 2.189 2.148 2.235 . 0 0 "[ . 1 . 2]" 1
266 1 11 GLN H 1 11 GLN HB3 2.765 . 3.682 3.380 3.192 3.493 . 0 0 "[ . 1 . 2]" 1
267 1 11 GLN H 1 11 GLN HG2 3.423 2.017 4.829 4.590 4.445 4.680 . 0 0 "[ . 1 . 2]" 1
268 1 11 GLN H 1 12 ASN H 3.351 2.003 4.699 4.581 4.465 4.610 . 0 0 "[ . 1 . 2]" 1
269 1 11 GLN H 1 27 LYS QB 4.953 2.010 7.896 5.999 5.786 6.244 . 0 0 "[ . 1 . 2]" 1
270 1 11 GLN H 1 27 LYS HD3 4.544 2.066 7.022 5.855 5.130 6.222 . 0 0 "[ . 1 . 2]" 1
271 1 11 GLN H 1 28 CYS H 4.511 2.069 6.953 4.018 3.832 4.199 . 0 0 "[ . 1 . 2]" 1
272 1 11 GLN H 1 45 THR HA 4.743 2.044 7.442 7.036 6.912 7.116 . 0 0 "[ . 1 . 2]" 1
273 1 11 GLN HA 1 11 GLN HB2 2.538 . 3.311 2.925 2.842 2.972 . 0 0 "[ . 1 . 2]" 1
274 1 11 GLN HA 1 11 GLN HB3 2.422 . 3.126 2.773 2.675 2.867 . 0 0 "[ . 1 . 2]" 1
275 1 11 GLN HA 1 11 GLN HG2 2.711 . 3.593 3.261 3.176 3.388 . 0 0 "[ . 1 . 2]" 1
276 1 11 GLN HA 1 12 ASN H 2.156 . 2.714 2.468 2.366 2.735 0.021 7 0 "[ . 1 . 2]" 1
277 1 11 GLN HA 1 27 LYS HG3 4.380 2.078 6.682 4.747 4.352 5.809 . 0 0 "[ . 1 . 2]" 1
278 1 11 GLN HA 1 44 GLY HA2 3.478 2.027 4.929 4.367 4.151 4.545 . 0 0 "[ . 1 . 2]" 1
279 1 11 GLN HA 1 45 THR H 2.448 . 3.167 2.051 1.918 2.184 . 0 0 "[ . 1 . 2]" 1
280 1 11 GLN HA 1 45 THR HB 2.531 . 3.300 3.365 3.003 3.480 0.180 18 0 "[ . 1 . 2]" 1
281 1 11 GLN HA 1 45 THR MG 4.452 2.074 6.830 4.327 2.444 4.641 . 0 0 "[ . 1 . 2]" 1
282 1 11 GLN HA 1 46 PRO HA 3.780 2.065 5.495 5.134 5.014 5.348 . 0 0 "[ . 1 . 2]" 1
283 1 11 GLN HA 1 47 LYS HA 4.694 2.050 7.338 4.914 4.590 5.252 . 0 0 "[ . 1 . 2]" 1
284 1 11 GLN HB2 1 11 GLN HG2 2.430 . 3.138 2.774 2.712 2.816 . 0 0 "[ . 1 . 2]" 1
285 1 11 GLN HB2 1 12 ASN H 3.011 . 4.099 3.953 3.646 4.102 0.003 2 0 "[ . 1 . 2]" 1
286 1 11 GLN HB3 1 11 GLN HE21 3.155 . 4.349 3.414 3.231 3.618 . 0 0 "[ . 1 . 2]" 1
287 1 11 GLN HB3 1 11 GLN HG2 2.356 . 3.022 2.200 2.174 2.232 . 0 0 "[ . 1 . 2]" 1
288 1 11 GLN HB3 1 12 ASN H 2.201 . 2.783 2.592 2.134 2.825 0.042 2 0 "[ . 1 . 2]" 1
289 1 11 GLN HB3 1 22 CYS HB2 4.412 2.076 6.748 6.850 6.787 6.946 0.198 18 0 "[ . 1 . 2]" 1
290 1 11 GLN HB3 1 47 LYS HG3 3.378 2.009 4.747 3.300 3.144 3.495 . 0 0 "[ . 1 . 2]" 1
291 1 11 GLN HE21 1 11 GLN HG2 2.486 . 3.227 2.211 2.177 2.253 . 0 0 "[ . 1 . 2]" 1
292 1 11 GLN HE21 1 46 PRO HA 4.383 2.078 6.688 6.645 6.383 6.728 0.040 10 0 "[ . 1 . 2]" 1
293 1 11 GLN HE21 1 47 LYS HA 3.280 . 4.571 2.843 2.554 3.027 . 0 0 "[ . 1 . 2]" 1
294 1 11 GLN HE21 1 47 LYS HE2 3.299 . 4.605 3.935 3.355 4.714 0.109 14 0 "[ . 1 . 2]" 1
295 1 11 GLN HE21 1 47 LYS HE3 4.077 2.082 6.072 4.664 3.325 5.530 . 0 0 "[ . 1 . 2]" 1
296 1 11 GLN HE21 1 48 PRO HD2 3.572 2.041 5.103 2.979 2.369 3.760 . 0 0 "[ . 1 . 2]" 1
297 1 11 GLN HE21 1 48 PRO HD3 3.273 . 4.559 3.828 3.180 4.443 . 0 0 "[ . 1 . 2]" 1
298 1 11 GLN HE22 1 11 GLN HG2 2.683 . 3.547 3.456 3.434 3.482 . 0 0 "[ . 1 . 2]" 1
299 1 11 GLN HE22 1 47 LYS HA 2.919 . 3.941 3.916 3.593 4.061 0.120 1 0 "[ . 1 . 2]" 1
300 1 11 GLN HE22 1 47 LYS HG3 3.015 . 4.106 3.426 2.781 4.974 0.868 14 1 "[ . 1 +. 2]" 1
301 1 11 GLN HE22 1 48 PRO HD2 3.299 . 4.605 3.131 2.463 4.037 . 0 0 "[ . 1 . 2]" 1
302 1 11 GLN HE22 1 48 PRO HD3 3.673 2.054 5.292 4.084 2.995 4.974 . 0 0 "[ . 1 . 2]" 1
303 1 11 GLN HG2 1 12 ASN H 2.876 . 3.869 3.532 3.169 3.779 . 0 0 "[ . 1 . 2]" 1
304 1 11 GLN HG2 1 13 LEU QB 4.560 2.065 7.055 5.176 4.893 5.473 . 0 0 "[ . 1 . 2]" 1
305 1 11 GLN HG2 1 45 THR H 3.478 2.027 4.929 4.949 4.746 5.034 0.105 13 0 "[ . 1 . 2]" 1
306 1 11 GLN HG2 1 47 LYS H 3.195 . 4.420 3.657 3.213 3.976 . 0 0 "[ . 1 . 2]" 1
307 1 11 GLN HG2 1 47 LYS HA 2.978 . 4.042 2.026 1.745 2.487 0.169 19 0 "[ . 1 . 2]" 1
308 1 11 GLN HG2 1 47 LYS HD2 4.172 2.084 6.260 4.481 3.871 5.071 . 0 0 "[ . 1 . 2]" 1
309 1 12 ASN H 1 12 ASN HA 2.805 . 3.749 2.916 2.863 2.933 . 0 0 "[ . 1 . 2]" 1
310 1 12 ASN H 1 12 ASN HB2 3.092 . 4.239 3.807 3.728 3.910 . 0 0 "[ . 1 . 2]" 1
311 1 12 ASN H 1 12 ASN HB3 2.745 . 3.649 3.526 3.439 3.655 0.006 7 0 "[ . 1 . 2]" 1
312 1 12 ASN H 1 13 LEU H 2.711 . 3.593 2.273 2.216 2.392 . 0 0 "[ . 1 . 2]" 1
313 1 12 ASN H 1 26 ASN HB2 4.953 2.010 7.896 7.097 6.386 7.380 . 0 0 "[ . 1 . 2]" 1
314 1 12 ASN H 1 27 LYS HA 3.855 2.072 5.638 5.069 4.753 5.517 . 0 0 "[ . 1 . 2]" 1
315 1 12 ASN H 1 44 GLY H 4.187 2.083 6.291 5.886 5.642 6.168 . 0 0 "[ . 1 . 2]" 1
316 1 12 ASN H 1 46 PRO HA 3.124 . 4.295 3.851 3.635 4.162 . 0 0 "[ . 1 . 2]" 1
317 1 12 ASN H 1 47 LYS H 4.095 2.083 6.107 4.251 3.562 4.950 . 0 0 "[ . 1 . 2]" 1
318 1 12 ASN H 1 47 LYS HD2 4.617 2.059 7.175 6.513 5.941 7.177 0.002 9 0 "[ . 1 . 2]" 1
319 1 12 ASN H 1 47 LYS HD3 4.471 2.073 6.869 6.616 5.503 6.943 0.074 11 0 "[ . 1 . 2]" 1
320 1 12 ASN HA 1 12 ASN HB2 2.105 . 2.637 2.562 2.539 2.586 . 0 0 "[ . 1 . 2]" 1
321 1 12 ASN HA 1 12 ASN HB3 2.379 . 3.058 2.295 2.269 2.308 . 0 0 "[ . 1 . 2]" 1
322 1 12 ASN HA 1 13 LEU H 2.662 . 3.512 3.546 3.533 3.558 0.046 5 0 "[ . 1 . 2]" 1
323 1 12 ASN HA 1 14 CYS H 2.999 . 4.078 3.946 3.856 4.028 . 0 0 "[ . 1 . 2]" 1
324 1 12 ASN HA 1 24 GLN HA 4.387 2.077 6.697 6.490 5.973 6.790 0.093 1 0 "[ . 1 . 2]" 1
325 1 12 ASN HA 1 26 ASN HB2 3.544 2.037 5.051 4.864 4.238 5.110 0.059 1 0 "[ . 1 . 2]" 1
326 1 12 ASN HA 1 27 LYS HA 3.584 2.043 5.125 3.652 3.246 4.141 . 0 0 "[ . 1 . 2]" 1
327 1 12 ASN HA 1 28 CYS H 4.446 2.074 6.818 2.839 2.730 2.994 . 0 0 "[ . 1 . 2]" 1
328 1 12 ASN HB2 1 12 ASN QD 2.732 . 3.627 2.744 2.700 2.780 . 0 0 "[ . 1 . 2]" 1
329 1 12 ASN HB2 1 13 LEU H 2.353 . 3.018 3.120 3.064 3.160 0.142 20 0 "[ . 1 . 2]" 1
330 1 12 ASN HB2 1 23 GLY H 2.637 . 3.471 3.360 3.133 3.512 0.041 15 0 "[ . 1 . 2]" 1
331 1 12 ASN HB2 1 27 LYS HA 3.355 2.004 4.706 4.124 3.827 4.517 . 0 0 "[ . 1 . 2]" 1
332 1 12 ASN HB3 1 12 ASN QD 2.254 . 2.864 2.212 2.174 2.257 . 0 0 "[ . 1 . 2]" 1
333 1 12 ASN HB3 1 13 LEU H 2.861 . 3.843 3.890 3.863 3.915 0.072 8 0 "[ . 1 . 2]" 1
334 1 12 ASN HB3 1 14 CYS HB2 5.077 . 8.170 8.218 8.151 8.268 0.098 18 0 "[ . 1 . 2]" 1
335 1 12 ASN HB3 1 27 LYS HA 3.829 2.070 5.588 2.476 2.193 2.852 . 0 0 "[ . 1 . 2]" 1
336 1 12 ASN QD 1 13 LEU MD1 4.560 2.065 7.055 4.485 4.312 4.642 . 0 0 "[ . 1 . 2]" 1
337 1 12 ASN QD 1 13 LEU MD2 4.560 2.065 7.055 4.730 4.434 5.008 . 0 0 "[ . 1 . 2]" 1
338 1 12 ASN QD 1 13 LEU HG 3.885 2.073 5.697 3.962 3.773 4.159 . 0 0 "[ . 1 . 2]" 1
339 1 12 ASN QD 1 24 GLN HA 2.880 . 3.875 2.595 2.257 2.997 . 0 0 "[ . 1 . 2]" 1
340 1 12 ASN QD 1 24 GLN QG 4.150 2.083 5.891 3.351 2.081 4.235 0.002 15 0 "[ . 1 . 2]" 1
341 1 12 ASN QD 1 25 GLY H 3.296 2.038 4.599 3.386 3.025 3.694 . 0 0 "[ . 1 . 2]" 1
342 1 12 ASN QD 1 26 ASN H 3.220 2.050 4.464 3.317 3.041 3.551 . 0 0 "[ . 1 . 2]" 1
343 1 12 ASN QD 1 27 LYS HA 3.617 2.047 5.187 3.545 3.253 3.748 . 0 0 "[ . 1 . 2]" 1
344 1 12 ASN QD 1 27 LYS HD3 4.006 2.081 5.931 4.957 4.589 5.084 . 0 0 "[ . 1 . 2]" 1
345 1 12 ASN QD 1 43 GLU HA 3.512 2.032 4.420 3.520 3.205 3.710 . 0 0 "[ . 1 . 2]" 1
346 1 12 ASN QD 1 44 GLY H 2.490 . 2.760 1.963 1.778 2.133 . 0 0 "[ . 1 . 2]" 1
347 1 12 ASN QD 1 44 GLY HA2 3.209 . 4.445 3.745 3.660 3.822 . 0 0 "[ . 1 . 2]" 1
348 1 12 ASN QD 1 44 GLY HA3 3.394 2.067 4.776 2.516 2.350 2.710 . 0 0 "[ . 1 . 2]" 1
349 1 12 ASN QD 1 45 THR H 3.487 2.028 4.946 3.266 3.080 3.455 . 0 0 "[ . 1 . 2]" 1
350 1 13 LEU H 1 13 LEU HA 2.341 . 2.999 2.796 2.778 2.808 . 0 0 "[ . 1 . 2]" 1
351 1 13 LEU H 1 13 LEU QB 2.989 . 4.061 2.376 2.330 2.441 . 0 0 "[ . 1 . 2]" 1
352 1 13 LEU H 1 13 LEU MD1 3.044 . 4.156 3.500 3.416 3.590 . 0 0 "[ . 1 . 2]" 1
353 1 13 LEU H 1 13 LEU MD2 3.337 2.001 4.673 3.545 3.386 3.649 . 0 0 "[ . 1 . 2]" 1
354 1 13 LEU H 1 13 LEU HG 1.960 . 2.421 2.362 2.218 2.454 0.033 3 0 "[ . 1 . 2]" 1
355 1 13 LEU H 1 14 CYS H 2.688 . 3.555 3.670 3.613 3.722 0.167 20 0 "[ . 1 . 2]" 1
356 1 13 LEU H 1 21 VAL QG 5.037 . 8.082 5.643 5.272 6.153 . 0 0 "[ . 1 . 2]" 1
357 1 13 LEU H 1 22 CYS HB2 4.167 2.084 6.250 5.881 5.697 6.009 . 0 0 "[ . 1 . 2]" 1
358 1 13 LEU H 1 23 GLY HA2 2.927 . 3.955 3.703 3.190 4.014 0.059 5 0 "[ . 1 . 2]" 1
359 1 13 LEU H 1 23 GLY HA3 4.155 2.084 6.226 5.444 4.881 5.718 . 0 0 "[ . 1 . 2]" 1
360 1 13 LEU HA 1 13 LEU MD1 3.415 2.016 4.814 3.857 3.831 3.879 . 0 0 "[ . 1 . 2]" 1
361 1 13 LEU HA 1 13 LEU MD2 3.459 2.023 4.895 2.012 1.980 2.073 0.043 5 0 "[ . 1 . 2]" 1
362 1 13 LEU HA 1 13 LEU HG 2.366 . 3.038 2.909 2.826 3.003 . 0 0 "[ . 1 . 2]" 1
363 1 13 LEU HA 1 14 CYS H 2.434 . 3.145 2.477 2.375 2.561 . 0 0 "[ . 1 . 2]" 1
364 1 13 LEU HA 1 14 CYS HA 3.370 2.007 4.733 4.316 4.279 4.340 . 0 0 "[ . 1 . 2]" 1
365 1 13 LEU HA 1 15 LEU H 4.246 2.082 6.410 6.328 6.137 6.409 . 0 0 "[ . 1 . 2]" 1
366 1 13 LEU HA 1 21 VAL QG 4.004 2.080 5.928 3.455 3.014 3.970 . 0 0 "[ . 1 . 2]" 1
367 1 13 LEU HA 1 23 GLY HA2 2.919 . 3.941 2.741 2.340 3.024 . 0 0 "[ . 1 . 2]" 1
368 1 13 LEU HA 1 23 GLY HA3 3.668 2.054 5.282 4.179 3.682 4.569 . 0 0 "[ . 1 . 2]" 1
369 1 13 LEU QB 1 13 LEU MD1 3.555 2.038 5.072 2.094 2.086 2.106 . 0 0 "[ . 1 . 2]" 1
370 1 13 LEU QB 1 13 LEU MD2 3.129 . 4.304 2.270 2.247 2.298 . 0 0 "[ . 1 . 2]" 1
371 1 13 LEU QB 1 13 LEU HG 2.278 . 2.901 2.401 2.377 2.421 . 0 0 "[ . 1 . 2]" 1
372 1 13 LEU QB 1 14 CYS H 3.348 2.003 4.693 3.853 3.833 3.870 . 0 0 "[ . 1 . 2]" 1
373 1 13 LEU QB 1 14 CYS HA 3.517 2.032 5.002 4.385 4.360 4.422 . 0 0 "[ . 1 . 2]" 1
374 1 13 LEU MD1 1 13 LEU HG 2.188 . 2.763 2.128 2.125 2.132 . 0 0 "[ . 1 . 2]" 1
375 1 13 LEU MD1 1 14 CYS H 4.554 2.066 7.042 5.609 5.576 5.626 . 0 0 "[ . 1 . 2]" 1
376 1 13 LEU MD1 1 23 GLY HA2 4.596 2.061 7.131 4.197 3.952 4.464 . 0 0 "[ . 1 . 2]" 1
377 1 13 LEU MD1 1 23 GLY HA3 5.940 . 10.174 5.050 4.567 5.465 . 0 0 "[ . 1 . 2]" 1
378 1 13 LEU MD1 1 24 GLN HA 4.274 2.082 6.466 5.347 4.927 5.722 . 0 0 "[ . 1 . 2]" 1
379 1 13 LEU MD1 1 24 GLN QB 4.627 2.058 7.196 4.656 3.730 5.544 . 0 0 "[ . 1 . 2]" 1
380 1 13 LEU MD1 1 24 GLN HE22 4.773 2.039 7.507 4.920 2.296 7.123 . 0 0 "[ . 1 . 2]" 1
381 1 13 LEU MD1 1 24 GLN QG 3.959 2.078 5.840 4.228 2.587 5.713 . 0 0 "[ . 1 . 2]" 1
382 1 13 LEU MD1 1 46 PRO HA 4.108 2.083 6.133 2.210 2.035 2.397 0.048 7 0 "[ . 1 . 2]" 1
383 1 13 LEU MD1 1 46 PRO HB2 4.163 2.083 6.243 3.652 3.486 4.107 . 0 0 "[ . 1 . 2]" 1
384 1 13 LEU MD1 1 46 PRO HB3 4.098 2.083 6.113 2.209 2.039 2.840 0.044 13 0 "[ . 1 . 2]" 1
385 1 13 LEU MD2 1 13 LEU HG 2.254 . 2.864 2.129 2.127 2.132 . 0 0 "[ . 1 . 2]" 1
386 1 13 LEU MD2 1 23 GLY HA2 4.573 2.064 7.082 2.022 1.986 2.059 0.078 5 0 "[ . 1 . 2]" 1
387 1 13 LEU MD2 1 23 GLY HA3 3.768 2.064 5.472 2.776 2.243 3.068 . 0 0 "[ . 1 . 2]" 1
388 1 13 LEU MD2 1 24 GLN H 3.720 2.059 5.381 3.359 2.924 3.786 . 0 0 "[ . 1 . 2]" 1
389 1 13 LEU MD2 1 24 GLN HA 4.773 2.039 7.507 4.760 4.237 5.145 . 0 0 "[ . 1 . 2]" 1
390 1 13 LEU MD2 1 24 GLN HE22 4.773 2.039 7.507 5.473 2.597 7.535 0.028 8 0 "[ . 1 . 2]" 1
391 1 13 LEU MD2 1 24 GLN QG 4.620 2.058 7.182 4.143 2.206 5.690 . 0 0 "[ . 1 . 2]" 1
392 1 13 LEU MD2 1 46 PRO HA 4.116 2.083 6.149 4.490 4.346 4.780 . 0 0 "[ . 1 . 2]" 1
393 1 13 LEU MD2 1 46 PRO HB2 5.070 . 8.155 6.297 6.058 6.742 . 0 0 "[ . 1 . 2]" 1
394 1 13 LEU HG 1 14 CYS H 3.693 2.057 5.329 5.009 4.946 5.052 . 0 0 "[ . 1 . 2]" 1
395 1 13 LEU HG 1 14 CYS HB2 5.063 . 8.139 8.143 8.088 8.180 0.041 20 0 "[ . 1 . 2]" 1
396 1 13 LEU HG 1 21 VAL QG 5.454 . 9.024 5.669 5.170 6.141 . 0 0 "[ . 1 . 2]" 1
397 1 13 LEU HG 1 24 GLN HA 4.075 2.082 6.068 4.879 4.399 5.303 . 0 0 "[ . 1 . 2]" 1
398 1 13 LEU HG 1 24 GLN QG 4.055 2.081 6.029 4.625 2.913 6.126 0.097 7 0 "[ . 1 . 2]" 1
399 1 13 LEU HG 1 46 PRO HA 3.602 2.045 5.159 3.356 3.020 3.812 . 0 0 "[ . 1 . 2]" 1
400 1 13 LEU HG 1 46 PRO HB3 5.235 . 8.523 4.559 4.301 5.247 . 0 0 "[ . 1 . 2]" 1
401 1 14 CYS H 1 14 CYS HA 2.659 . 3.508 2.891 2.881 2.902 . 0 0 "[ . 1 . 2]" 1
402 1 14 CYS H 1 14 CYS HB2 2.893 . 3.897 3.755 3.683 3.834 . 0 0 "[ . 1 . 2]" 1
403 1 14 CYS H 1 14 CYS HB3 3.165 . 4.367 3.702 3.602 3.785 . 0 0 "[ . 1 . 2]" 1
404 1 14 CYS H 1 15 LEU H 3.333 . 4.666 4.368 4.291 4.399 . 0 0 "[ . 1 . 2]" 1
405 1 14 CYS H 1 21 VAL HA 3.415 2.016 4.814 4.188 3.724 4.477 . 0 0 "[ . 1 . 2]" 1
406 1 14 CYS H 1 21 VAL QG 3.949 2.077 5.821 3.375 3.063 3.980 . 0 0 "[ . 1 . 2]" 1
407 1 14 CYS H 1 22 CYS H 2.774 . 3.697 3.253 3.010 3.449 . 0 0 "[ . 1 . 2]" 1
408 1 14 CYS H 1 22 CYS HB3 2.968 . 4.025 3.840 3.428 4.153 0.128 15 0 "[ . 1 . 2]" 1
409 1 14 CYS H 1 47 LYS H 5.269 . 8.601 5.661 5.195 6.383 . 0 0 "[ . 1 . 2]" 1
410 1 14 CYS HA 1 14 CYS HB2 2.201 . 2.783 2.677 2.624 2.743 . 0 0 "[ . 1 . 2]" 1
411 1 14 CYS HA 1 14 CYS HB3 1.916 . 2.357 2.295 2.268 2.340 . 0 0 "[ . 1 . 2]" 1
412 1 14 CYS HA 1 15 LEU H 2.466 . 3.196 2.456 2.350 2.563 . 0 0 "[ . 1 . 2]" 1
413 1 14 CYS HA 1 15 LEU HG 3.083 . 4.224 3.953 3.775 4.256 0.032 18 0 "[ . 1 . 2]" 1
414 1 14 CYS HA 1 16 CYS H 4.089 2.083 6.095 5.285 4.954 5.694 . 0 0 "[ . 1 . 2]" 1
415 1 14 CYS HA 1 21 VAL QG 3.620 2.048 5.192 3.196 2.770 3.968 . 0 0 "[ . 1 . 2]" 1
416 1 14 CYS HA 1 47 LYS HD2 4.055 2.081 6.029 4.824 4.158 6.028 . 0 0 "[ . 1 . 2]" 1
417 1 14 CYS HA 1 47 LYS HD3 3.824 2.069 5.579 4.308 3.558 5.147 . 0 0 "[ . 1 . 2]" 1
418 1 14 CYS HB2 1 15 LEU H 2.600 . 3.411 2.587 2.332 2.952 . 0 0 "[ . 1 . 2]" 1
419 1 14 CYS HB2 1 47 LYS HB2 3.555 2.038 5.072 4.493 4.174 4.970 . 0 0 "[ . 1 . 2]" 1
420 1 14 CYS HB2 1 47 LYS HB3 3.533 2.035 5.031 4.815 3.890 5.187 0.156 7 0 "[ . 1 . 2]" 1
421 1 14 CYS HB2 1 47 LYS HD2 3.201 . 4.430 3.396 2.892 4.688 0.258 14 0 "[ . 1 . 2]" 1
422 1 14 CYS HB2 1 47 LYS HD3 3.098 . 4.250 3.761 3.132 4.426 0.176 16 0 "[ . 1 . 2]" 1
423 1 14 CYS HB3 1 15 LEU H 3.065 . 4.192 3.517 3.268 3.870 . 0 0 "[ . 1 . 2]" 1
424 1 14 CYS HB3 1 16 CYS HB2 4.541 2.066 7.016 6.424 5.790 7.109 0.093 12 0 "[ . 1 . 2]" 1
425 1 14 CYS HB3 1 47 LYS HB2 3.561 2.040 5.082 3.094 2.737 3.869 . 0 0 "[ . 1 . 2]" 1
426 1 14 CYS HB3 1 47 LYS HB3 3.584 2.043 5.125 3.150 2.250 3.618 . 0 0 "[ . 1 . 2]" 1
427 1 14 CYS HB3 1 47 LYS HD2 3.134 . 4.312 2.644 1.934 3.873 0.022 6 0 "[ . 1 . 2]" 1
428 1 14 CYS HB3 1 47 LYS HD3 3.109 . 4.269 2.463 1.915 3.050 0.034 7 0 "[ . 1 . 2]" 1
429 1 15 LEU H 1 15 LEU HA 2.430 . 3.138 2.889 2.861 2.909 . 0 0 "[ . 1 . 2]" 1
430 1 15 LEU H 1 15 LEU HB2 2.795 . 3.732 3.212 2.895 3.546 . 0 0 "[ . 1 . 2]" 1
431 1 15 LEU H 1 15 LEU HB3 3.075 . 4.210 3.474 3.200 3.635 . 0 0 "[ . 1 . 2]" 1
432 1 15 LEU H 1 15 LEU MD1 3.306 . 4.617 3.564 3.497 3.628 . 0 0 "[ . 1 . 2]" 1
433 1 15 LEU H 1 15 LEU MD2 3.333 . 4.666 2.383 1.998 2.785 0.002 18 0 "[ . 1 . 2]" 1
434 1 15 LEU H 1 15 LEU HG 2.341 . 2.999 1.856 1.740 1.979 . 0 0 "[ . 1 . 2]" 1
435 1 15 LEU H 1 16 CYS H 3.124 . 4.295 4.120 3.874 4.338 0.043 2 0 "[ . 1 . 2]" 1
436 1 15 LEU HA 1 15 LEU HB2 2.434 . 3.145 2.859 2.667 2.984 . 0 0 "[ . 1 . 2]" 1
437 1 15 LEU HA 1 15 LEU HB3 2.833 . 3.796 2.249 2.215 2.306 . 0 0 "[ . 1 . 2]" 1
438 1 15 LEU HA 1 15 LEU MD1 3.787 2.066 5.508 4.078 3.977 4.143 . 0 0 "[ . 1 . 2]" 1
439 1 15 LEU HA 1 15 LEU MD2 2.728 . 3.621 2.849 2.428 3.397 . 0 0 "[ . 1 . 2]" 1
440 1 15 LEU HA 1 15 LEU HG 3.188 . 4.407 3.590 3.477 3.670 . 0 0 "[ . 1 . 2]" 1
441 1 15 LEU HA 1 16 CYS H 2.112 . 2.647 2.165 2.048 2.272 . 0 0 "[ . 1 . 2]" 1
442 1 15 LEU HA 1 17 GLU H 3.306 . 4.617 4.484 4.210 4.633 0.016 2 0 "[ . 1 . 2]" 1
443 1 15 LEU HA 1 21 VAL H 3.220 . 4.464 4.234 4.024 4.453 . 0 0 "[ . 1 . 2]" 1
444 1 15 LEU HA 1 21 VAL HA 1.969 . 2.434 2.059 1.684 2.464 0.030 17 0 "[ . 1 . 2]" 1
445 1 15 LEU HA 1 21 VAL QG 4.119 2.083 6.155 2.810 2.422 3.335 . 0 0 "[ . 1 . 2]" 1
446 1 15 LEU HA 1 22 CYS H 3.261 . 4.537 3.280 2.973 3.583 . 0 0 "[ . 1 . 2]" 1
447 1 15 LEU HA 1 22 CYS HA 4.048 2.081 6.015 5.972 5.678 6.189 0.174 12 0 "[ . 1 . 2]" 1
448 1 15 LEU HB2 1 15 LEU MD1 2.188 . 2.763 2.239 2.130 2.315 . 0 0 "[ . 1 . 2]" 1
449 1 15 LEU HB2 1 15 LEU MD2 3.398 2.012 4.784 3.172 3.071 3.206 . 0 0 "[ . 1 . 2]" 1
450 1 15 LEU HB2 1 15 LEU HG 2.646 . 3.486 2.570 2.483 2.714 . 0 0 "[ . 1 . 2]" 1
451 1 15 LEU HB2 1 16 CYS H 3.038 . 4.146 4.052 3.666 4.230 0.084 17 0 "[ . 1 . 2]" 1
452 1 15 LEU HB2 1 17 GLU H 3.906 2.076 5.736 5.536 4.963 5.897 0.161 12 0 "[ . 1 . 2]" 1
453 1 15 LEU HB2 1 19 SER H 4.428 2.075 6.781 6.050 5.445 6.441 . 0 0 "[ . 1 . 2]" 1
454 1 15 LEU HB2 1 19 SER HA 2.909 . 3.925 3.971 3.510 4.084 0.159 16 0 "[ . 1 . 2]" 1
455 1 15 LEU HB2 1 20 ASN H 3.856 2.072 5.640 5.189 4.503 5.658 0.018 13 0 "[ . 1 . 2]" 1
456 1 15 LEU HB3 1 15 LEU MD1 2.492 . 3.237 2.498 2.378 2.703 . 0 0 "[ . 1 . 2]" 1
457 1 15 LEU HB3 1 15 LEU MD2 2.332 . 2.985 2.280 2.148 2.364 . 0 0 "[ . 1 . 2]" 1
458 1 15 LEU HB3 1 16 CYS H 3.111 . 4.272 4.031 3.635 4.283 0.011 9 0 "[ . 1 . 2]" 1
459 1 15 LEU HB3 1 16 CYS HB2 4.499 2.070 6.928 6.539 6.053 6.829 . 0 0 "[ . 1 . 2]" 1
460 1 15 LEU HB3 1 17 GLU HB3 4.560 2.065 7.055 7.075 6.805 7.201 0.146 1 0 "[ . 1 . 2]" 1
461 1 15 LEU HB3 1 19 SER HA 2.853 . 3.830 3.237 2.431 3.865 0.035 14 0 "[ . 1 . 2]" 1
462 1 15 LEU HB3 1 19 SER HB3 3.960 2.078 5.842 5.437 4.240 6.229 0.387 14 0 "[ . 1 . 2]" 1
463 1 15 LEU HB3 1 20 ASN H 3.799 2.067 5.531 4.556 4.125 5.044 . 0 0 "[ . 1 . 2]" 1
464 1 15 LEU HB3 1 21 VAL HA 3.561 2.040 5.082 3.717 3.024 4.317 . 0 0 "[ . 1 . 2]" 1
465 1 15 LEU MD1 1 15 LEU MD2 2.518 . 3.279 2.074 2.065 2.081 . 0 0 "[ . 1 . 2]" 1
466 1 15 LEU MD1 1 15 LEU HG 2.430 . 3.138 2.128 2.122 2.135 . 0 0 "[ . 1 . 2]" 1
467 1 15 LEU MD1 1 19 SER HA 3.445 2.021 4.869 3.715 3.069 4.081 . 0 0 "[ . 1 . 2]" 1
468 1 15 LEU MD1 1 19 SER HB2 4.551 2.066 7.036 5.185 4.219 6.153 . 0 0 "[ . 1 . 2]" 1
469 1 15 LEU MD1 1 19 SER HB3 4.642 2.057 7.227 5.029 3.975 5.686 . 0 0 "[ . 1 . 2]" 1
470 1 15 LEU MD1 1 20 ASN H 4.988 2.003 7.973 5.766 5.497 6.138 . 0 0 "[ . 1 . 2]" 1
471 1 15 LEU MD1 1 21 VAL H 5.077 . 8.170 6.260 6.094 6.411 . 0 0 "[ . 1 . 2]" 1
472 1 15 LEU MD1 1 21 VAL HA 4.852 2.027 7.677 5.300 5.132 5.479 . 0 0 "[ . 1 . 2]" 1
473 1 15 LEU MD2 1 15 LEU HG 2.734 . 3.631 2.128 2.122 2.133 . 0 0 "[ . 1 . 2]" 1
474 1 15 LEU MD2 1 16 CYS H 4.156 2.083 6.229 4.621 4.285 5.035 . 0 0 "[ . 1 . 2]" 1
475 1 15 LEU MD2 1 19 SER HA 4.084 2.082 6.086 4.363 3.541 4.866 . 0 0 "[ . 1 . 2]" 1
476 1 15 LEU MD2 1 19 SER HB2 5.118 . 8.262 5.316 4.118 6.262 . 0 0 "[ . 1 . 2]" 1
477 1 15 LEU MD2 1 19 SER HB3 6.919 . 12.664 5.829 4.731 6.592 . 0 0 "[ . 1 . 2]" 1
478 1 15 LEU MD2 1 20 ASN H 4.837 2.029 7.645 5.742 4.894 6.333 . 0 0 "[ . 1 . 2]" 1
479 1 15 LEU MD2 1 20 ASN HA 4.872 2.024 7.720 5.737 4.621 6.701 . 0 0 "[ . 1 . 2]" 1
480 1 15 LEU MD2 1 21 VAL H 4.065 2.082 6.048 4.707 3.977 5.444 . 0 0 "[ . 1 . 2]" 1
481 1 15 LEU MD2 1 21 VAL HA 3.482 2.027 4.937 3.329 2.707 4.126 . 0 0 "[ . 1 . 2]" 1
482 1 15 LEU MD2 1 21 VAL HB 3.640 2.050 5.230 4.357 4.180 4.865 . 0 0 "[ . 1 . 2]" 1
483 1 15 LEU MD2 1 21 VAL QG 5.077 . 8.170 1.937 1.823 2.344 0.161 7 0 "[ . 1 . 2]" 1
484 1 15 LEU MD2 1 22 CYS H 4.407 2.076 6.738 4.893 4.414 5.651 . 0 0 "[ . 1 . 2]" 1
485 1 16 CYS H 1 16 CYS HA 2.184 . 2.757 2.847 2.774 2.904 0.147 13 0 "[ . 1 . 2]" 1
486 1 16 CYS H 1 16 CYS HB2 2.442 . 3.157 2.651 2.251 2.905 . 0 0 "[ . 1 . 2]" 1
487 1 16 CYS H 1 16 CYS HB3 2.680 . 3.542 2.494 2.294 3.499 . 0 0 "[ . 1 . 2]" 1
488 1 16 CYS H 1 17 GLU H 2.762 . 3.677 2.851 2.471 3.152 . 0 0 "[ . 1 . 2]" 1
489 1 16 CYS H 1 21 VAL H 3.990 2.079 5.901 5.084 4.797 5.414 . 0 0 "[ . 1 . 2]" 1
490 1 16 CYS H 1 21 VAL HA 2.709 . 3.589 3.123 2.689 3.563 . 0 0 "[ . 1 . 2]" 1
491 1 16 CYS H 1 21 VAL QG 4.698 2.049 7.347 4.142 3.766 4.557 . 0 0 "[ . 1 . 2]" 1
492 1 16 CYS H 1 22 CYS H 2.866 . 3.852 2.844 2.447 3.080 . 0 0 "[ . 1 . 2]" 1
493 1 16 CYS H 1 22 CYS HB2 4.405 2.077 6.733 3.507 3.275 3.764 . 0 0 "[ . 1 . 2]" 1
494 1 16 CYS HA 1 16 CYS HB2 2.291 . 2.921 2.471 2.376 2.993 0.072 12 0 "[ . 1 . 2]" 1
495 1 16 CYS HA 1 16 CYS HB3 2.338 . 2.994 2.965 2.529 3.020 0.026 11 0 "[ . 1 . 2]" 1
496 1 16 CYS HA 1 17 GLU H 3.006 . 4.090 3.525 3.495 3.541 . 0 0 "[ . 1 . 2]" 1
497 1 16 CYS HA 1 22 CYS H 3.847 2.071 5.623 5.324 4.854 5.650 0.027 7 0 "[ . 1 . 2]" 1
498 1 16 CYS HA 1 22 CYS HB3 4.649 2.056 7.242 6.556 6.002 6.999 . 0 0 "[ . 1 . 2]" 1
499 1 16 CYS HA 1 30 LEU QD 4.847 2.028 7.666 4.790 4.212 6.016 . 0 0 "[ . 1 . 2]" 1
500 1 16 CYS HA 1 37 ASN HD21 2.989 . 4.061 3.544 2.362 4.116 0.055 11 0 "[ . 1 . 2]" 1
501 1 16 CYS HB2 1 17 GLU H 2.626 . 3.454 3.351 1.941 3.572 0.118 13 0 "[ . 1 . 2]" 1
502 1 16 CYS HB2 1 20 ASN HB2 4.260 2.082 6.438 5.487 3.958 6.289 . 0 0 "[ . 1 . 2]" 1
503 1 16 CYS HB2 1 22 CYS HB2 2.474 . 3.209 2.948 2.426 3.254 0.045 14 0 "[ . 1 . 2]" 1
504 1 16 CYS HB2 1 38 GLN H 4.667 2.053 7.281 6.214 5.556 7.282 0.001 20 0 "[ . 1 . 2]" 1
505 1 16 CYS HB3 1 17 GLU H 2.020 . 2.510 2.052 1.851 2.663 0.153 20 0 "[ . 1 . 2]" 1
506 1 16 CYS HB3 1 22 CYS HB2 2.981 . 4.047 3.156 2.885 3.554 . 0 0 "[ . 1 . 2]" 1
507 1 16 CYS HB3 1 22 CYS HB3 3.441 2.020 4.862 4.766 4.541 4.950 0.088 12 0 "[ . 1 . 2]" 1
508 1 16 CYS HB3 1 39 CYS HB2 3.854 2.072 5.636 4.719 4.523 4.880 . 0 0 "[ . 1 . 2]" 1
509 1 17 GLU H 1 17 GLU HA 2.745 . 3.649 2.901 2.854 2.932 . 0 0 "[ . 1 . 2]" 1
510 1 17 GLU H 1 17 GLU HB3 2.488 . 3.231 2.781 2.481 3.221 . 0 0 "[ . 1 . 2]" 1
511 1 17 GLU H 1 17 GLU QG 3.394 2.012 4.776 3.939 3.558 4.074 . 0 0 "[ . 1 . 2]" 1
512 1 17 GLU H 1 18 GLY H 3.292 . 4.593 4.420 3.777 4.578 . 0 0 "[ . 1 . 2]" 1
513 1 17 GLU H 1 20 ASN HB3 3.048 . 4.163 3.817 3.317 4.152 . 0 0 "[ . 1 . 2]" 1
514 1 17 GLU H 1 22 CYS HB2 3.561 2.040 5.082 4.713 4.281 4.940 . 0 0 "[ . 1 . 2]" 1
515 1 17 GLU H 1 22 CYS HB3 4.291 2.082 6.500 6.412 5.935 6.616 0.116 3 0 "[ . 1 . 2]" 1
516 1 17 GLU HA 1 17 GLU QG 2.742 . 3.645 2.455 2.184 3.009 . 0 0 "[ . 1 . 2]" 1
517 1 17 GLU HA 1 18 GLY H 4.679 2.052 7.306 2.235 2.039 2.501 0.013 13 0 "[ . 1 . 2]" 1
518 1 17 GLU HA 1 19 SER H 4.008 2.080 5.936 5.310 4.982 5.560 . 0 0 "[ . 1 . 2]" 1
519 1 17 GLU HA 1 37 ASN QB 3.578 2.042 5.114 4.200 3.089 5.139 0.025 4 0 "[ . 1 . 2]" 1
520 1 17 GLU HA 1 37 ASN HD21 5.226 . 8.504 4.702 2.261 6.609 . 0 0 "[ . 1 . 2]" 1
521 1 17 GLU HB2 1 18 GLY H 3.069 . 4.199 4.204 3.819 4.472 0.273 8 0 "[ . 1 . 2]" 1
522 1 17 GLU HB2 1 18 GLY HA2 4.216 2.083 6.349 6.300 6.136 6.453 0.104 8 0 "[ . 1 . 2]" 1
523 1 17 GLU HB2 1 20 ASN H 3.351 2.003 4.699 4.641 4.205 4.775 0.076 20 0 "[ . 1 . 2]" 1
524 1 17 GLU HB2 1 38 GLN HA 3.374 2.008 4.740 4.479 3.618 4.942 0.202 13 0 "[ . 1 . 2]" 1
525 1 17 GLU HB2 1 39 CYS H 3.432 2.019 4.845 4.192 3.600 4.585 . 0 0 "[ . 1 . 2]" 1
526 1 17 GLU HB3 1 17 GLU QG 2.965 . 4.020 2.311 2.159 2.422 . 0 0 "[ . 1 . 2]" 1
527 1 17 GLU HB3 1 18 GLY H 2.653 . 3.497 3.661 3.174 4.230 0.733 8 1 "[ . + 1 . 2]" 1
528 1 17 GLU HB3 1 19 SER HB3 4.656 2.054 7.258 7.479 7.224 7.801 0.543 12 1 "[ . 1 + . 2]" 1
529 1 17 GLU HB3 1 20 ASN H 3.185 . 4.402 3.291 3.075 3.674 . 0 0 "[ . 1 . 2]" 1
530 1 17 GLU HB3 1 20 ASN HB2 2.864 . 3.848 2.107 1.799 2.850 0.081 8 0 "[ . 1 . 2]" 1
531 1 17 GLU HB3 1 20 ASN HD21 3.897 2.075 5.719 3.262 2.049 4.260 0.026 16 0 "[ . 1 . 2]" 1
532 1 17 GLU HB3 1 38 GLN HA 4.385 2.078 6.692 6.054 5.352 6.487 . 0 0 "[ . 1 . 2]" 1
533 1 17 GLU HB3 1 39 CYS H 3.878 2.073 5.683 5.707 5.258 5.854 0.171 14 0 "[ . 1 . 2]" 1
534 1 17 GLU HB3 1 39 CYS HB2 4.101 2.083 6.119 5.491 4.846 5.897 . 0 0 "[ . 1 . 2]" 1
535 1 17 GLU QG 1 18 GLY H 3.590 2.044 5.136 2.923 2.008 3.805 0.036 5 0 "[ . 1 . 2]" 1
536 1 17 GLU QG 1 38 GLN HA 4.086 2.083 6.089 4.424 3.127 5.901 . 0 0 "[ . 1 . 2]" 1
537 1 17 GLU QG 1 39 CYS H 4.148 2.083 6.213 4.699 3.205 6.125 . 0 0 "[ . 1 . 2]" 1
538 1 18 GLY H 1 18 GLY HA2 2.529 . 3.296 2.396 2.293 2.602 . 0 0 "[ . 1 . 2]" 1
539 1 18 GLY H 1 18 GLY HA3 2.222 . 2.814 2.591 2.350 2.835 0.021 8 0 "[ . 1 . 2]" 1
540 1 18 GLY H 1 19 SER H 3.306 . 4.617 4.025 3.603 4.242 . 0 0 "[ . 1 . 2]" 1
541 1 18 GLY H 1 19 SER HA 3.875 2.073 5.677 5.615 5.385 5.732 0.055 4 0 "[ . 1 . 2]" 1
542 1 18 GLY H 1 19 SER HB3 4.930 2.013 7.847 6.681 6.417 6.863 . 0 0 "[ . 1 . 2]" 1
543 1 18 GLY H 1 37 ASN QB 4.660 2.054 7.266 5.443 3.765 6.832 . 0 0 "[ . 1 . 2]" 1
544 1 18 GLY HA2 1 19 SER H 3.145 . 4.332 3.483 3.414 3.560 . 0 0 "[ . 1 . 2]" 1
545 1 18 GLY HA2 1 20 ASN H 3.436 2.019 4.853 4.608 4.386 4.753 . 0 0 "[ . 1 . 2]" 1
546 1 18 GLY HA3 1 19 SER H 2.796 . 3.734 2.284 2.184 2.451 . 0 0 "[ . 1 . 2]" 1
547 1 18 GLY HA3 1 20 ASN H 2.935 . 3.968 3.797 3.645 4.006 0.038 19 0 "[ . 1 . 2]" 1
548 1 18 GLY HA3 1 20 ASN HB2 3.990 2.079 5.901 5.368 5.108 5.706 . 0 0 "[ . 1 . 2]" 1
549 1 19 SER H 1 19 SER HA 2.434 . 3.145 2.947 2.936 2.955 . 0 0 "[ . 1 . 2]" 1
550 1 19 SER H 1 19 SER HB2 2.709 . 3.589 3.653 3.550 3.742 0.153 5 0 "[ . 1 . 2]" 1
551 1 19 SER H 1 19 SER HB3 2.790 . 3.724 3.275 3.122 3.527 . 0 0 "[ . 1 . 2]" 1
552 1 19 SER H 1 20 ASN H 2.257 . 2.868 2.152 1.895 2.433 . 0 0 "[ . 1 . 2]" 1
553 1 19 SER H 1 20 ASN HA 3.296 . 4.599 4.431 4.277 4.567 . 0 0 "[ . 1 . 2]" 1
554 1 19 SER HA 1 19 SER HB2 2.720 . 3.608 2.580 2.495 2.679 . 0 0 "[ . 1 . 2]" 1
555 1 19 SER HA 1 19 SER HB3 2.513 . 3.271 2.355 2.283 2.422 . 0 0 "[ . 1 . 2]" 1
556 1 19 SER HA 1 20 ASN H 2.888 . 3.889 3.157 2.892 3.307 . 0 0 "[ . 1 . 2]" 1
557 1 19 SER HA 1 21 VAL H 3.900 2.075 5.725 5.316 4.643 5.760 0.035 13 0 "[ . 1 . 2]" 1
558 1 19 SER HB2 1 20 ASN H 3.473 2.026 4.920 4.231 4.048 4.379 . 0 0 "[ . 1 . 2]" 1
559 1 19 SER HB3 1 20 ASN H 3.415 2.016 4.814 4.537 4.424 4.667 . 0 0 "[ . 1 . 2]" 1
560 1 20 ASN H 1 20 ASN HA 2.457 . 3.182 2.870 2.818 2.909 . 0 0 "[ . 1 . 2]" 1
561 1 20 ASN H 1 20 ASN HB2 2.491 . 3.236 2.379 2.300 2.445 . 0 0 "[ . 1 . 2]" 1
562 1 20 ASN H 1 20 ASN HB3 2.939 . 3.976 3.600 3.561 3.630 . 0 0 "[ . 1 . 2]" 1
563 1 20 ASN H 1 20 ASN HD21 1.850 . 2.261 2.107 2.017 2.226 . 0 0 "[ . 1 . 2]" 1
564 1 20 ASN H 1 20 ASN HD22 2.701 . 3.577 3.643 3.590 3.680 0.103 10 0 "[ . 1 . 2]" 1
565 1 20 ASN H 1 21 VAL H 3.214 . 4.454 4.330 4.069 4.490 0.036 13 0 "[ . 1 . 2]" 1
566 1 20 ASN H 1 22 CYS H 4.202 2.084 6.320 6.150 5.789 6.330 0.010 8 0 "[ . 1 . 2]" 1
567 1 20 ASN HA 1 20 ASN HB2 2.620 . 3.444 3.015 2.999 3.030 . 0 0 "[ . 1 . 2]" 1
568 1 20 ASN HA 1 20 ASN HB3 2.418 . 3.120 2.539 2.496 2.579 . 0 0 "[ . 1 . 2]" 1
569 1 20 ASN HA 1 21 VAL H 2.011 . 2.496 2.119 2.063 2.195 . 0 0 "[ . 1 . 2]" 1
570 1 20 ASN HA 1 21 VAL HA 3.243 . 4.505 4.388 4.334 4.426 . 0 0 "[ . 1 . 2]" 1
571 1 20 ASN HA 1 22 CYS H 4.198 2.083 6.313 5.325 5.116 5.527 . 0 0 "[ . 1 . 2]" 1
572 1 20 ASN HB2 1 20 ASN HD21 2.832 . 3.794 2.712 2.237 3.016 . 0 0 "[ . 1 . 2]" 1
573 1 20 ASN HB2 1 20 ASN HD22 3.584 2.043 5.125 3.683 3.471 3.823 . 0 0 "[ . 1 . 2]" 1
574 1 20 ASN HB2 1 21 VAL H 3.182 . 4.397 4.383 4.239 4.466 0.069 10 0 "[ . 1 . 2]" 1
575 1 20 ASN HB3 1 20 ASN HD21 3.316 . 4.635 3.489 3.464 3.512 . 0 0 "[ . 1 . 2]" 1
576 1 20 ASN HB3 1 20 ASN HD22 3.120 . 4.288 4.058 4.036 4.076 . 0 0 "[ . 1 . 2]" 1
577 1 20 ASN HB3 1 21 VAL H 2.855 . 3.833 3.597 3.258 3.922 0.089 14 0 "[ . 1 . 2]" 1
578 1 20 ASN HD22 1 21 VAL H 4.019 2.081 5.957 5.897 5.632 6.150 0.193 12 0 "[ . 1 . 2]" 1
579 1 21 VAL H 1 21 VAL HA 2.480 . 3.218 2.914 2.906 2.923 . 0 0 "[ . 1 . 2]" 1
580 1 21 VAL H 1 21 VAL HB 2.222 . 2.814 2.640 2.586 2.769 . 0 0 "[ . 1 . 2]" 1
581 1 21 VAL H 1 21 VAL QG 3.170 . 4.376 2.155 1.989 2.259 . 0 0 "[ . 1 . 2]" 1
582 1 21 VAL H 1 22 CYS H 3.073 . 4.206 4.201 4.078 4.278 0.072 2 0 "[ . 1 . 2]" 1
583 1 21 VAL HA 1 21 VAL HB 2.386 . 3.069 3.024 3.006 3.031 . 0 0 "[ . 1 . 2]" 1
584 1 21 VAL HA 1 21 VAL QG 2.455 . 3.178 2.134 2.114 2.158 . 0 0 "[ . 1 . 2]" 1
585 1 21 VAL HA 1 22 CYS H 2.126 . 2.668 2.173 2.130 2.244 . 0 0 "[ . 1 . 2]" 1
586 1 21 VAL HA 1 22 CYS HA 3.406 2.014 4.798 4.414 4.373 4.476 . 0 0 "[ . 1 . 2]" 1
587 1 21 VAL HA 1 22 CYS HB3 3.801 2.068 5.534 5.397 5.274 5.616 0.082 7 0 "[ . 1 . 2]" 1
588 1 21 VAL HA 1 23 GLY H 4.656 2.054 7.258 6.275 6.166 6.350 . 0 0 "[ . 1 . 2]" 1
589 1 21 VAL HB 1 21 VAL QG 2.140 . 2.689 1.894 1.888 1.897 . 0 0 "[ . 1 . 2]" 1
590 1 21 VAL QG 1 22 CYS H 3.432 2.019 4.845 3.155 3.034 3.336 . 0 0 "[ . 1 . 2]" 1
591 1 21 VAL QG 1 22 CYS HA 4.043 2.082 6.004 4.216 4.049 4.367 . 0 0 "[ . 1 . 2]" 1
592 1 21 VAL QG 1 22 CYS HB3 4.833 2.031 7.635 5.047 4.763 5.319 . 0 0 "[ . 1 . 2]" 1
593 1 21 VAL QG 1 23 GLY H 4.694 2.050 7.338 5.080 4.719 5.301 . 0 0 "[ . 1 . 2]" 1
594 1 21 VAL QG 1 23 GLY HA2 4.387 2.077 6.697 4.576 4.095 4.894 . 0 0 "[ . 1 . 2]" 1
595 1 21 VAL QG 1 23 GLY HA3 4.387 2.077 6.697 4.837 4.364 5.265 . 0 0 "[ . 1 . 2]" 1
596 1 22 CYS H 1 22 CYS HA 2.400 . 3.091 2.851 2.812 2.886 . 0 0 "[ . 1 . 2]" 1
597 1 22 CYS H 1 22 CYS HB2 2.694 . 3.565 2.127 2.074 2.209 . 0 0 "[ . 1 . 2]" 1
598 1 22 CYS H 1 22 CYS HB3 2.576 . 3.372 3.269 3.188 3.450 0.078 7 0 "[ . 1 . 2]" 1
599 1 22 CYS H 1 23 GLY H 3.502 2.030 4.974 4.602 4.547 4.644 . 0 0 "[ . 1 . 2]" 1
600 1 22 CYS HA 1 22 CYS HB2 2.463 . 3.191 2.866 2.824 2.961 . 0 0 "[ . 1 . 2]" 1
601 1 22 CYS HA 1 22 CYS HB3 2.675 . 3.534 2.832 2.692 2.881 . 0 0 "[ . 1 . 2]" 1
602 1 22 CYS HA 1 23 GLY H 2.459 . 3.184 2.347 2.237 2.470 . 0 0 "[ . 1 . 2]" 1
603 1 22 CYS HA 1 23 GLY HA3 3.330 . 4.660 4.289 4.257 4.316 . 0 0 "[ . 1 . 2]" 1
604 1 22 CYS HA 1 24 GLN H 4.387 2.077 6.697 6.141 5.750 6.366 . 0 0 "[ . 1 . 2]" 1
605 1 22 CYS HA 1 24 GLN HA 4.925 2.015 7.835 7.251 7.040 7.389 . 0 0 "[ . 1 . 2]" 1
606 1 22 CYS HB2 1 23 GLY H 3.363 2.006 4.720 4.086 3.827 4.294 . 0 0 "[ . 1 . 2]" 1
607 1 22 CYS HB2 1 39 CYS HA 3.681 2.055 5.307 5.120 4.715 5.379 0.072 7 0 "[ . 1 . 2]" 1
608 1 23 GLY H 1 23 GLY HA2 2.758 . 3.671 2.923 2.868 2.947 . 0 0 "[ . 1 . 2]" 1
609 1 23 GLY H 1 23 GLY HA3 2.632 . 3.463 2.605 2.537 2.715 . 0 0 "[ . 1 . 2]" 1
610 1 23 GLY H 1 24 GLN H 3.105 . 4.262 4.013 3.746 4.241 . 0 0 "[ . 1 . 2]" 1
611 1 23 GLY H 1 26 ASN H 3.033 . 4.137 4.161 3.952 4.237 0.100 20 0 "[ . 1 . 2]" 1
612 1 23 GLY H 1 26 ASN HB2 4.428 2.075 6.781 2.729 2.248 3.274 . 0 0 "[ . 1 . 2]" 1
613 1 23 GLY H 1 26 ASN HB3 3.681 2.055 5.307 4.208 3.413 4.873 . 0 0 "[ . 1 . 2]" 1
614 1 23 GLY H 1 26 ASN HD21 3.627 2.048 5.206 3.164 2.667 4.595 . 0 0 "[ . 1 . 2]" 1
615 1 23 GLY HA2 1 24 GLN H 2.492 . 3.237 3.055 2.872 3.251 0.014 17 0 "[ . 1 . 2]" 1
616 1 23 GLY HA2 1 26 ASN HD21 4.387 2.077 6.697 5.589 4.795 6.865 0.168 5 0 "[ . 1 . 2]" 1
617 1 23 GLY HA3 1 24 GLN H 2.011 . 2.496 2.224 2.126 2.319 . 0 0 "[ . 1 . 2]" 1
618 1 23 GLY HA3 1 25 GLY HA2 5.186 . 8.413 7.588 7.238 7.782 . 0 0 "[ . 1 . 2]" 1
619 1 24 GLN H 1 24 GLN QB 2.579 . 3.377 2.362 2.225 2.514 . 0 0 "[ . 1 . 2]" 1
620 1 24 GLN H 1 24 GLN QG 3.020 . 4.115 3.268 2.266 4.101 . 0 0 "[ . 1 . 2]" 1
621 1 24 GLN H 1 25 GLY H 3.323 . 4.648 4.525 4.438 4.603 . 0 0 "[ . 1 . 2]" 1
622 1 24 GLN H 1 26 ASN H 3.201 . 4.430 4.466 4.380 4.541 0.111 12 0 "[ . 1 . 2]" 1
623 1 24 GLN HA 1 24 GLN QB 2.449 . 3.168 2.392 2.333 2.476 . 0 0 "[ . 1 . 2]" 1
624 1 24 GLN HA 1 24 GLN QG 2.525 . 3.290 2.485 2.299 3.079 . 0 0 "[ . 1 . 2]" 1
625 1 24 GLN HA 1 25 GLY H 1.944 . 2.398 2.177 2.091 2.334 . 0 0 "[ . 1 . 2]" 1
626 1 24 GLN HA 1 26 ASN H 2.462 . 3.189 2.950 2.641 3.208 0.019 9 0 "[ . 1 . 2]" 1
627 1 24 GLN QB 1 24 GLN QG 3.667 2.053 5.281 2.057 1.961 2.089 0.092 13 0 "[ . 1 . 2]" 1
628 1 24 GLN QB 1 25 GLY H 2.708 . 3.588 3.218 2.808 3.632 0.044 3 0 "[ . 1 . 2]" 1
629 1 24 GLN QB 1 25 GLY HA2 3.590 2.044 5.136 4.637 4.287 5.076 . 0 0 "[ . 1 . 2]" 1
630 1 24 GLN QB 1 25 GLY HA3 3.584 2.043 5.125 4.368 4.081 4.629 . 0 0 "[ . 1 . 2]" 1
631 1 24 GLN HE21 1 24 GLN QG 2.774 . 3.697 2.453 2.133 2.815 . 0 0 "[ . 1 . 2]" 1
632 1 24 GLN HE22 1 24 GLN QG 3.120 . 4.288 3.355 3.203 3.487 . 0 0 "[ . 1 . 2]" 1
633 1 24 GLN QG 1 25 GLY H 3.190 . 4.411 3.390 2.216 4.454 0.043 13 0 "[ . 1 . 2]" 1
634 1 25 GLY H 1 25 GLY HA2 2.190 . 2.765 2.393 2.337 2.467 . 0 0 "[ . 1 . 2]" 1
635 1 25 GLY H 1 25 GLY HA3 2.442 . 3.157 2.943 2.921 2.958 . 0 0 "[ . 1 . 2]" 1
636 1 25 GLY H 1 26 ASN H 2.073 . 2.588 2.363 2.045 2.586 . 0 0 "[ . 1 . 2]" 1
637 1 25 GLY H 1 26 ASN HB2 3.891 2.075 5.707 4.944 4.693 5.135 . 0 0 "[ . 1 . 2]" 1
638 1 25 GLY H 1 43 GLU H 4.415 2.076 6.754 5.639 5.304 6.042 . 0 0 "[ . 1 . 2]" 1
639 1 25 GLY H 1 43 GLU HA 3.415 2.016 4.814 2.973 2.605 3.323 . 0 0 "[ . 1 . 2]" 1
640 1 25 GLY HA2 1 26 ASN H 2.757 . 3.669 3.347 3.250 3.452 . 0 0 "[ . 1 . 2]" 1
641 1 25 GLY HA2 1 27 LYS HA 4.638 2.057 7.219 7.303 7.242 7.381 0.162 2 0 "[ . 1 . 2]" 1
642 1 25 GLY HA2 1 42 GLY HA2 3.898 2.075 5.721 4.890 4.730 5.008 . 0 0 "[ . 1 . 2]" 1
643 1 25 GLY HA2 1 43 GLU H 4.347 2.079 6.615 5.633 5.415 5.798 . 0 0 "[ . 1 . 2]" 1
644 1 25 GLY HA3 1 26 ASN H 2.542 . 3.317 3.114 2.965 3.239 . 0 0 "[ . 1 . 2]" 1
645 1 25 GLY HA3 1 42 GLY H 3.566 2.040 5.092 4.772 4.530 4.939 . 0 0 "[ . 1 . 2]" 1
646 1 26 ASN H 1 26 ASN HA 2.647 . 3.488 2.940 2.929 2.948 . 0 0 "[ . 1 . 2]" 1
647 1 26 ASN H 1 26 ASN HB2 2.759 . 3.673 2.619 2.535 2.733 . 0 0 "[ . 1 . 2]" 1
648 1 26 ASN H 1 26 ASN HB3 3.150 . 4.341 3.756 3.706 3.821 . 0 0 "[ . 1 . 2]" 1
649 1 26 ASN H 1 26 ASN HD21 3.270 . 4.553 3.148 2.598 4.308 . 0 0 "[ . 1 . 2]" 1
650 1 26 ASN H 1 27 LYS H 3.289 . 4.587 4.436 4.388 4.470 . 0 0 "[ . 1 . 2]" 1
651 1 26 ASN H 1 41 THR HB 4.385 2.078 6.692 6.722 6.565 6.783 0.091 2 0 "[ . 1 . 2]" 1
652 1 26 ASN H 1 42 GLY H 3.555 2.038 5.072 4.236 4.011 4.388 . 0 0 "[ . 1 . 2]" 1
653 1 26 ASN H 1 43 GLU HA 3.550 2.038 5.062 4.089 3.696 4.369 . 0 0 "[ . 1 . 2]" 1
654 1 26 ASN HA 1 26 ASN HB2 2.570 . 3.362 3.022 3.007 3.034 . 0 0 "[ . 1 . 2]" 1
655 1 26 ASN HA 1 26 ASN HB3 2.533 . 3.303 2.507 2.414 2.584 . 0 0 "[ . 1 . 2]" 1
656 1 26 ASN HA 1 27 LYS H 2.143 . 2.694 2.347 2.258 2.418 . 0 0 "[ . 1 . 2]" 1
657 1 26 ASN HA 1 27 LYS HA 3.386 2.010 4.762 4.474 4.431 4.513 . 0 0 "[ . 1 . 2]" 1
658 1 26 ASN HA 1 28 CYS HA 4.387 2.077 6.697 6.672 6.498 6.798 0.101 16 0 "[ . 1 . 2]" 1
659 1 26 ASN HA 1 39 CYS HA 4.142 2.084 6.200 5.763 5.568 6.023 . 0 0 "[ . 1 . 2]" 1
660 1 26 ASN HA 1 40 VAL QG 4.690 2.050 7.330 4.314 4.151 4.479 . 0 0 "[ . 1 . 2]" 1
661 1 26 ASN HA 1 41 THR H 3.544 2.037 5.051 4.906 4.700 5.002 . 0 0 "[ . 1 . 2]" 1
662 1 26 ASN HA 1 41 THR HA 2.094 . 2.620 2.318 2.128 2.381 . 0 0 "[ . 1 . 2]" 1
663 1 26 ASN HA 1 41 THR MG 4.385 2.078 6.692 3.658 3.462 3.836 . 0 0 "[ . 1 . 2]" 1
664 1 26 ASN HA 1 42 GLY H 2.335 . 2.989 2.310 2.201 2.412 . 0 0 "[ . 1 . 2]" 1
665 1 26 ASN HA 1 42 GLY HA3 3.683 2.055 5.311 4.713 4.567 4.838 . 0 0 "[ . 1 . 2]" 1
666 1 26 ASN HA 1 43 GLU HA 3.590 2.044 5.136 4.952 4.656 5.200 0.064 16 0 "[ . 1 . 2]" 1
667 1 26 ASN HB2 1 27 LYS H 3.092 . 4.239 3.701 3.476 3.930 . 0 0 "[ . 1 . 2]" 1
668 1 26 ASN HB2 1 40 VAL HA 5.291 . 8.651 7.249 6.920 7.536 . 0 0 "[ . 1 . 2]" 1
669 1 26 ASN HB2 1 42 GLY H 3.914 2.075 5.753 5.241 5.104 5.319 . 0 0 "[ . 1 . 2]" 1
670 1 26 ASN HB2 1 44 GLY H 3.897 2.075 5.719 5.638 5.347 5.765 0.046 4 0 "[ . 1 . 2]" 1
671 1 26 ASN HB3 1 26 ASN HD21 3.129 . 4.304 3.357 2.848 3.520 . 0 0 "[ . 1 . 2]" 1
672 1 26 ASN HB3 1 27 LYS H 2.662 . 3.513 2.491 2.339 2.677 . 0 0 "[ . 1 . 2]" 1
673 1 26 ASN HB3 1 40 VAL H 3.463 2.024 4.902 4.537 4.232 4.778 . 0 0 "[ . 1 . 2]" 1
674 1 26 ASN HB3 1 42 GLY H 3.394 2.012 4.776 4.768 4.655 4.839 0.063 15 0 "[ . 1 . 2]" 1
675 1 26 ASN HD22 1 41 THR MG 5.083 . 8.184 4.152 3.267 4.788 . 0 0 "[ . 1 . 2]" 1
676 1 27 LYS H 1 27 LYS QB 2.310 . 2.950 2.645 2.479 2.726 . 0 0 "[ . 1 . 2]" 1
677 1 27 LYS H 1 27 LYS HG2 3.270 . 4.553 4.547 4.392 4.683 0.130 7 0 "[ . 1 . 2]" 1
678 1 27 LYS H 1 27 LYS HG3 3.544 2.037 5.051 4.610 4.372 4.702 . 0 0 "[ . 1 . 2]" 1
679 1 27 LYS H 1 28 CYS H 3.206 . 4.440 4.079 3.955 4.150 . 0 0 "[ . 1 . 2]" 1
680 1 27 LYS H 1 39 CYS HA 3.544 2.037 5.051 4.002 3.799 4.247 . 0 0 "[ . 1 . 2]" 1
681 1 27 LYS H 1 40 VAL QG 4.111 2.083 6.140 3.057 2.842 3.215 . 0 0 "[ . 1 . 2]" 1
682 1 27 LYS H 1 41 THR HA 2.897 . 3.904 3.437 3.220 3.634 . 0 0 "[ . 1 . 2]" 1
683 1 27 LYS H 1 42 GLY H 3.427 2.017 4.837 3.680 3.378 3.945 . 0 0 "[ . 1 . 2]" 1
684 1 27 LYS H 1 44 GLY HA2 4.057 2.082 6.032 6.006 5.883 6.059 0.027 18 0 "[ . 1 . 2]" 1
685 1 27 LYS H 1 44 GLY HA3 3.701 2.057 5.345 5.308 5.202 5.391 0.046 15 0 "[ . 1 . 2]" 1
686 1 27 LYS HA 1 27 LYS QB 2.239 . 2.840 2.341 2.300 2.360 . 0 0 "[ . 1 . 2]" 1
687 1 27 LYS HA 1 27 LYS HE3 3.602 2.045 5.159 4.638 4.143 4.772 . 0 0 "[ . 1 . 2]" 1
688 1 27 LYS HA 1 27 LYS HG2 3.544 2.037 5.051 3.509 3.330 3.811 . 0 0 "[ . 1 . 2]" 1
689 1 27 LYS HA 1 28 CYS H 2.376 . 3.053 2.170 2.141 2.206 . 0 0 "[ . 1 . 2]" 1
690 1 27 LYS HA 1 28 CYS HA 3.544 2.037 5.051 4.389 4.358 4.429 . 0 0 "[ . 1 . 2]" 1
691 1 27 LYS HA 1 40 VAL HA 4.773 2.039 7.507 7.214 7.118 7.292 . 0 0 "[ . 1 . 2]" 1
692 1 27 LYS HA 1 44 GLY HA2 2.735 . 3.633 3.661 3.514 3.738 0.105 14 0 "[ . 1 . 2]" 1
693 1 27 LYS HA 1 44 GLY HA3 3.555 2.038 5.072 2.699 2.640 2.805 . 0 0 "[ . 1 . 2]" 1
694 1 27 LYS QB 1 27 LYS HE3 3.312 . 4.629 2.104 2.006 2.213 . 0 0 "[ . 1 . 2]" 1
695 1 27 LYS QB 1 28 CYS H 3.337 2.001 4.673 3.854 3.786 3.943 . 0 0 "[ . 1 . 2]" 1
696 1 27 LYS QB 1 29 ILE MD 4.818 2.032 7.604 5.059 4.733 5.286 . 0 0 "[ . 1 . 2]" 1
697 1 27 LYS QB 1 40 VAL H 3.572 2.041 5.103 4.075 3.654 4.276 . 0 0 "[ . 1 . 2]" 1
698 1 27 LYS QB 1 44 GLY HA2 3.592 2.044 5.140 3.053 2.653 3.598 . 0 0 "[ . 1 . 2]" 1
699 1 27 LYS QB 1 44 GLY HA3 3.240 . 4.500 3.194 2.817 3.789 . 0 0 "[ . 1 . 2]" 1
700 1 27 LYS HD2 1 43 GLU H 3.544 2.037 5.051 5.011 4.808 5.145 0.094 7 0 "[ . 1 . 2]" 1
701 1 27 LYS HD3 1 27 LYS HG2 2.511 . 3.268 3.016 3.004 3.019 . 0 0 "[ . 1 . 2]" 1
702 1 27 LYS HD3 1 42 GLY H 4.256 2.082 6.430 6.390 6.213 6.475 0.045 12 0 "[ . 1 . 2]" 1
703 1 27 LYS HD3 1 43 GLU HA 3.769 2.065 5.473 4.669 4.557 4.841 . 0 0 "[ . 1 . 2]" 1
704 1 27 LYS HE2 1 40 VAL QG 5.090 . 8.199 4.575 4.176 5.273 . 0 0 "[ . 1 . 2]" 1
705 1 27 LYS HE3 1 27 LYS HG2 3.544 2.037 5.051 2.950 2.771 3.157 . 0 0 "[ . 1 . 2]" 1
706 1 27 LYS HE3 1 27 LYS HG3 2.806 . 3.751 3.699 3.638 3.757 0.006 17 0 "[ . 1 . 2]" 1
707 1 27 LYS HE3 1 40 VAL QG 5.037 . 8.082 3.393 3.006 4.045 . 0 0 "[ . 1 . 2]" 1
708 1 27 LYS HE3 1 42 GLY HA3 3.566 2.040 5.092 3.184 2.779 3.429 . 0 0 "[ . 1 . 2]" 1
709 1 27 LYS HG2 1 29 ILE MD 4.086 2.083 6.089 4.510 3.976 4.803 . 0 0 "[ . 1 . 2]" 1
710 1 27 LYS HG2 1 40 VAL H 3.544 2.037 5.051 4.937 4.700 5.081 0.030 7 0 "[ . 1 . 2]" 1
711 1 27 LYS HG2 1 44 GLY HA2 3.406 2.014 4.798 4.260 3.985 4.726 . 0 0 "[ . 1 . 2]" 1
712 1 27 LYS HG2 1 44 GLY HA3 7.366 . 13.876 4.723 4.373 5.283 . 0 0 "[ . 1 . 2]" 1
713 1 27 LYS HG3 1 29 ILE MD 5.097 . 8.215 5.807 4.625 6.224 . 0 0 "[ . 1 . 2]" 1
714 1 27 LYS HG3 1 44 GLY HA2 3.374 2.008 4.740 2.965 2.556 4.149 . 0 0 "[ . 1 . 2]" 1
715 1 27 LYS HG3 1 44 GLY HA3 3.113 . 4.276 3.167 2.695 4.243 . 0 0 "[ . 1 . 2]" 1
716 1 28 CYS H 1 28 CYS HA 2.266 . 2.882 2.905 2.900 2.911 0.029 11 0 "[ . 1 . 2]" 1
717 1 28 CYS H 1 28 CYS HB2 2.684 . 3.548 2.785 2.435 2.929 . 0 0 "[ . 1 . 2]" 1
718 1 28 CYS H 1 28 CYS HB3 2.683 . 3.547 2.645 2.348 3.616 0.069 17 0 "[ . 1 . 2]" 1
719 1 28 CYS H 1 29 ILE H 3.370 2.007 4.733 4.499 4.428 4.547 . 0 0 "[ . 1 . 2]" 1
720 1 28 CYS H 1 29 ILE MD 4.828 2.031 7.625 6.405 6.266 6.504 . 0 0 "[ . 1 . 2]" 1
721 1 28 CYS H 1 39 CYS HA 3.473 2.026 4.920 4.381 4.207 4.634 . 0 0 "[ . 1 . 2]" 1
722 1 28 CYS H 1 40 VAL H 3.544 2.037 5.051 4.797 4.666 4.898 . 0 0 "[ . 1 . 2]" 1
723 1 28 CYS H 1 44 GLY HA2 3.668 2.054 5.282 4.994 4.851 5.170 . 0 0 "[ . 1 . 2]" 1
724 1 28 CYS H 1 44 GLY HA3 4.397 2.077 6.717 4.020 3.798 4.211 . 0 0 "[ . 1 . 2]" 1
725 1 28 CYS HA 1 28 CYS HB2 2.807 . 3.753 2.533 2.383 3.028 . 0 0 "[ . 1 . 2]" 1
726 1 28 CYS HA 1 29 ILE H 2.101 . 2.631 2.159 2.107 2.209 . 0 0 "[ . 1 . 2]" 1
727 1 28 CYS HA 1 29 ILE HA 3.423 2.017 4.829 4.388 4.364 4.418 . 0 0 "[ . 1 . 2]" 1
728 1 28 CYS HA 1 39 CYS HA 2.852 . 3.828 2.297 2.116 2.509 . 0 0 "[ . 1 . 2]" 1
729 1 28 CYS HA 1 39 CYS HB2 3.838 2.070 5.606 5.213 4.992 5.386 . 0 0 "[ . 1 . 2]" 1
730 1 28 CYS HA 1 40 VAL H 2.332 . 2.985 2.976 2.842 3.079 0.094 7 0 "[ . 1 . 2]" 1
731 1 28 CYS HA 1 40 VAL QG 4.726 2.084 6.338 3.906 3.680 4.072 . 0 0 "[ . 1 . 2]" 1
732 1 28 CYS HB2 1 29 ILE H 3.584 2.043 5.125 4.080 3.974 4.259 . 0 0 "[ . 1 . 2]" 1
733 1 28 CYS HB2 1 30 LEU QD 4.828 2.031 7.625 4.867 3.970 6.344 . 0 0 "[ . 1 . 2]" 1
734 1 28 CYS HB2 1 39 CYS HA 3.578 2.042 5.114 3.618 3.076 4.992 . 0 0 "[ . 1 . 2]" 1
735 1 28 CYS HB3 1 29 ILE H 3.175 . 4.384 3.963 2.942 4.269 . 0 0 "[ . 1 . 2]" 1
736 1 28 CYS HB3 1 30 LEU QD 4.586 2.062 7.110 4.175 3.507 5.596 . 0 0 "[ . 1 . 2]" 1
737 1 28 CYS HB3 1 37 ASN HA 4.160 2.084 6.236 6.027 4.551 6.425 0.189 4 0 "[ . 1 . 2]" 1
738 1 29 ILE H 1 29 ILE HA 2.978 . 4.042 2.933 2.923 2.946 . 0 0 "[ . 1 . 2]" 1
739 1 29 ILE H 1 29 ILE HB 3.053 . 4.172 3.739 3.659 3.796 . 0 0 "[ . 1 . 2]" 1
740 1 29 ILE H 1 29 ILE MD 3.596 2.044 5.148 3.824 3.720 3.896 . 0 0 "[ . 1 . 2]" 1
741 1 29 ILE H 1 29 ILE HG12 3.063 . 4.189 2.236 2.107 2.332 . 0 0 "[ . 1 . 2]" 1
742 1 29 ILE H 1 29 ILE HG13 2.900 . 3.909 2.627 2.483 2.755 . 0 0 "[ . 1 . 2]" 1
743 1 29 ILE H 1 29 ILE MG 3.330 . 4.660 3.215 3.089 3.308 . 0 0 "[ . 1 . 2]" 1
744 1 29 ILE H 1 30 LEU H 3.061 . 4.186 4.245 4.124 4.356 0.170 19 0 "[ . 1 . 2]" 1
745 1 29 ILE H 1 30 LEU QD 4.823 2.032 7.614 4.265 3.740 5.704 . 0 0 "[ . 1 . 2]" 1
746 1 29 ILE H 1 37 ASN QB 4.405 2.077 6.733 5.763 4.778 6.275 . 0 0 "[ . 1 . 2]" 1
747 1 29 ILE H 1 38 GLN H 2.264 . 2.879 2.799 2.537 2.941 0.062 14 0 "[ . 1 . 2]" 1
748 1 29 ILE H 1 38 GLN HB3 3.492 2.029 4.955 3.842 3.498 4.253 . 0 0 "[ . 1 . 2]" 1
749 1 29 ILE H 1 39 CYS H 3.873 2.073 5.673 5.026 4.803 5.231 . 0 0 "[ . 1 . 2]" 1
750 1 29 ILE H 1 39 CYS HA 3.351 2.003 4.699 3.837 3.638 4.083 . 0 0 "[ . 1 . 2]" 1
751 1 29 ILE H 1 40 VAL H 3.497 2.029 4.965 3.874 3.682 4.138 . 0 0 "[ . 1 . 2]" 1
752 1 29 ILE H 1 40 VAL QG 5.140 2.082 6.072 4.223 3.869 4.622 . 0 0 "[ . 1 . 2]" 1
753 1 29 ILE HA 1 29 ILE HB 2.312 . 2.954 2.567 2.519 2.612 . 0 0 "[ . 1 . 2]" 1
754 1 29 ILE HA 1 29 ILE MD 3.561 2.040 5.082 4.178 4.161 4.190 . 0 0 "[ . 1 . 2]" 1
755 1 29 ILE HA 1 29 ILE HG13 2.777 . 3.702 3.729 3.698 3.743 0.041 19 0 "[ . 1 . 2]" 1
756 1 29 ILE HA 1 29 ILE MG 2.332 . 2.985 2.228 2.182 2.274 . 0 0 "[ . 1 . 2]" 1
757 1 29 ILE HA 1 30 LEU H 1.849 . 2.259 2.114 2.083 2.177 . 0 0 "[ . 1 . 2]" 1
758 1 29 ILE HA 1 30 LEU QD 4.887 2.021 7.753 3.204 2.709 4.893 . 0 0 "[ . 1 . 2]" 1
759 1 29 ILE HA 1 31 GLY H 3.928 2.077 5.779 5.359 4.845 5.808 0.029 15 0 "[ . 1 . 2]" 1
760 1 29 ILE HA 1 38 GLN H 3.823 2.069 5.577 4.761 4.513 5.085 . 0 0 "[ . 1 . 2]" 1
761 1 29 ILE HB 1 29 ILE MD 2.885 . 3.884 2.423 2.385 2.455 . 0 0 "[ . 1 . 2]" 1
762 1 29 ILE HB 1 29 ILE HG12 2.438 . 3.151 3.022 3.019 3.027 . 0 0 "[ . 1 . 2]" 1
763 1 29 ILE HB 1 29 ILE HG13 2.418 . 3.120 2.478 2.457 2.499 . 0 0 "[ . 1 . 2]" 1
764 1 29 ILE HB 1 29 ILE MG 2.239 . 2.840 2.129 2.125 2.132 . 0 0 "[ . 1 . 2]" 1
765 1 29 ILE HB 1 30 LEU H 3.022 . 4.118 3.251 2.837 3.610 . 0 0 "[ . 1 . 2]" 1
766 1 29 ILE HB 1 30 LEU HG 4.947 2.010 7.884 6.270 5.390 6.628 . 0 0 "[ . 1 . 2]" 1
767 1 29 ILE HB 1 38 GLN H 4.021 2.080 5.962 4.958 4.404 5.511 . 0 0 "[ . 1 . 2]" 1
768 1 29 ILE MD 1 29 ILE HG12 2.976 . 4.039 2.119 2.115 2.123 . 0 0 "[ . 1 . 2]" 1
769 1 29 ILE MD 1 29 ILE HG13 3.124 . 4.295 2.122 2.118 2.125 . 0 0 "[ . 1 . 2]" 1
770 1 29 ILE MD 1 30 LEU H 4.412 2.076 6.748 5.081 4.680 5.339 . 0 0 "[ . 1 . 2]" 1
771 1 29 ILE MD 1 30 LEU HA 5.083 . 8.184 5.721 5.374 5.920 . 0 0 "[ . 1 . 2]" 1
772 1 29 ILE MD 1 30 LEU HG 5.424 . 8.955 7.236 6.666 7.551 . 0 0 "[ . 1 . 2]" 1
773 1 29 ILE MD 1 40 VAL H 4.743 2.044 7.442 4.313 4.031 4.723 . 0 0 "[ . 1 . 2]" 1
774 1 29 ILE HG12 1 29 ILE MG 3.092 . 4.239 2.371 2.323 2.396 . 0 0 "[ . 1 . 2]" 1
775 1 29 ILE HG12 1 30 LEU H 4.021 2.080 5.962 5.161 5.010 5.247 . 0 0 "[ . 1 . 2]" 1
776 1 29 ILE HG12 1 40 VAL H 5.070 . 8.155 3.516 3.228 3.865 . 0 0 "[ . 1 . 2]" 1
777 1 29 ILE HG13 1 29 ILE MG 2.913 . 3.931 3.204 3.197 3.209 . 0 0 "[ . 1 . 2]" 1
778 1 29 ILE HG13 1 30 LEU H 3.590 2.044 5.136 4.559 4.205 4.737 . 0 0 "[ . 1 . 2]" 1
779 1 29 ILE HG13 1 40 VAL H 4.021 2.080 5.962 4.832 4.472 5.248 . 0 0 "[ . 1 . 2]" 1
780 1 29 ILE MG 1 30 LEU H 3.468 2.025 4.911 3.666 3.376 3.818 . 0 0 "[ . 1 . 2]" 1
781 1 30 LEU H 1 30 LEU HA 2.842 . 3.811 2.889 2.775 2.928 . 0 0 "[ . 1 . 2]" 1
782 1 30 LEU H 1 30 LEU QB 2.495 . 3.242 2.382 2.297 2.473 . 0 0 "[ . 1 . 2]" 1
783 1 30 LEU H 1 30 LEU QD 3.129 . 4.304 2.312 1.918 3.839 0.036 5 0 "[ . 1 . 2]" 1
784 1 30 LEU H 1 30 LEU HG 3.180 . 4.393 3.481 2.377 4.252 . 0 0 "[ . 1 . 2]" 1
785 1 30 LEU H 1 31 GLY H 3.617 2.047 5.187 4.141 3.847 4.442 . 0 0 "[ . 1 . 2]" 1
786 1 30 LEU H 1 37 ASN H 4.375 2.078 6.672 6.838 6.729 6.932 0.260 19 0 "[ . 1 . 2]" 1
787 1 30 LEU HA 1 30 LEU QD 3.487 2.028 4.946 2.780 2.102 3.034 . 0 0 "[ . 1 . 2]" 1
788 1 30 LEU HA 1 30 LEU HG 2.332 . 2.985 2.535 2.389 2.991 0.006 3 0 "[ . 1 . 2]" 1
789 1 30 LEU HA 1 31 GLY H 2.184 . 2.757 2.203 2.064 2.347 . 0 0 "[ . 1 . 2]" 1
790 1 30 LEU HA 1 37 ASN HA 2.442 . 3.157 2.296 1.736 2.844 . 0 0 "[ . 1 . 2]" 1
791 1 30 LEU HA 1 37 ASN QB 3.572 2.041 5.103 3.722 2.759 4.403 . 0 0 "[ . 1 . 2]" 1
792 1 30 LEU HA 1 37 ASN HD21 3.885 2.073 5.697 4.728 3.550 5.763 0.066 20 0 "[ . 1 . 2]" 1
793 1 30 LEU HA 1 37 ASN HD22 4.270 2.082 6.458 5.532 4.005 6.674 0.216 5 0 "[ . 1 . 2]" 1
794 1 30 LEU HA 1 38 GLN H 2.849 . 3.823 3.653 3.058 3.916 0.093 3 0 "[ . 1 . 2]" 1
795 1 30 LEU HA 1 38 GLN HB3 4.182 2.083 6.281 5.895 5.308 6.310 0.029 15 0 "[ . 1 . 2]" 1
796 1 30 LEU QB 1 30 LEU QD 2.407 . 3.102 1.913 1.893 1.930 . 0 0 "[ . 1 . 2]" 1
797 1 30 LEU QB 1 31 GLY H 3.153 . 4.346 3.616 3.258 3.868 . 0 0 "[ . 1 . 2]" 1
798 1 30 LEU QD 1 30 LEU HG 2.209 . 2.795 1.892 1.887 1.897 . 0 0 "[ . 1 . 2]" 1
799 1 30 LEU QD 1 31 GLY H 3.976 2.079 5.873 4.267 3.018 4.523 . 0 0 "[ . 1 . 2]" 1
800 1 30 LEU QD 1 37 ASN H 4.573 2.064 7.082 5.162 4.238 5.548 . 0 0 "[ . 1 . 2]" 1
801 1 30 LEU QD 1 37 ASN HA 4.718 2.047 7.389 3.351 2.025 3.966 0.022 3 0 "[ . 1 . 2]" 1
802 1 30 LEU QD 1 37 ASN HD21 4.982 2.004 7.960 3.592 1.953 5.264 0.051 12 0 "[ . 1 . 2]" 1
803 1 30 LEU QD 1 37 ASN HD22 4.739 2.044 7.434 3.696 2.397 5.839 . 0 0 "[ . 1 . 2]" 1
804 1 30 LEU HG 1 31 GLY H 3.482 2.027 4.937 4.633 4.063 5.048 0.111 3 0 "[ . 1 . 2]" 1
805 1 30 LEU HG 1 36 LYS HA 4.405 2.077 6.733 5.715 4.604 6.730 . 0 0 "[ . 1 . 2]" 1
806 1 30 LEU HG 1 36 LYS HB3 4.795 2.036 7.554 6.889 5.528 8.405 0.851 3 3 "[ + . 1 * . -]" 1
807 1 30 LEU HG 1 37 ASN H 4.329 2.080 6.578 5.493 5.004 6.636 0.058 12 0 "[ . 1 . 2]" 1
808 1 30 LEU HG 1 37 ASN HD22 4.107 2.083 6.131 4.342 3.041 6.140 0.009 2 0 "[ . 1 . 2]" 1
809 1 31 GLY H 1 31 GLY HA3 2.104 . 2.635 2.489 2.271 2.906 0.271 2 0 "[ . 1 . 2]" 1
810 1 31 GLY H 1 32 ARG H 2.631 . 3.462 3.436 2.710 3.622 0.160 19 0 "[ . 1 . 2]" 1
811 1 31 GLY H 1 35 SER HB2 4.405 2.077 6.733 5.735 5.079 6.261 . 0 0 "[ . 1 . 2]" 1
812 1 31 GLY H 1 36 LYS HA 3.355 2.004 4.706 2.702 1.978 3.886 0.026 14 0 "[ . 1 . 2]" 1
813 1 31 GLY H 1 36 LYS HB2 4.051 2.081 6.021 4.732 4.193 5.614 . 0 0 "[ . 1 . 2]" 1
814 1 31 GLY H 1 37 ASN HA 3.842 2.070 5.614 3.479 2.186 4.211 . 0 0 "[ . 1 . 2]" 1
815 1 31 GLY H 1 38 GLN H 4.256 2.082 6.430 4.130 3.184 4.898 . 0 0 "[ . 1 . 2]" 1
816 1 31 GLY HA2 1 32 ARG H 2.686 . 3.552 3.095 2.078 3.523 . 0 0 "[ . 1 . 2]" 1
817 1 31 GLY HA2 1 32 ARG HB2 4.318 2.080 6.556 5.176 4.043 5.925 . 0 0 "[ . 1 . 2]" 1
818 1 31 GLY HA2 1 32 ARG HD3 4.065 2.082 6.048 5.431 2.964 6.121 0.073 2 0 "[ . 1 . 2]" 1
819 1 31 GLY HA2 1 35 SER HB2 4.809 2.034 7.584 6.496 4.540 7.374 . 0 0 "[ . 1 . 2]" 1
820 1 31 GLY HA2 1 36 LYS HB2 4.593 2.062 7.124 6.195 4.259 7.144 0.020 17 0 "[ . 1 . 2]" 1
821 1 31 GLY HA2 1 36 LYS HB3 4.544 2.066 7.022 6.000 3.783 7.195 0.173 17 0 "[ . 1 . 2]" 1
822 1 31 GLY HA3 1 32 ARG H 2.798 . 3.737 2.403 2.095 3.487 . 0 0 "[ . 1 . 2]" 1
823 1 31 GLY HA3 1 32 ARG HB2 3.995 2.079 5.911 5.084 4.188 6.147 0.236 8 0 "[ . 1 . 2]" 1
824 1 31 GLY HA3 1 32 ARG HB3 4.080 2.083 6.077 5.186 4.349 6.024 . 0 0 "[ . 1 . 2]" 1
825 1 31 GLY HA3 1 35 SER HB2 5.097 . 8.215 5.444 3.375 6.908 . 0 0 "[ . 1 . 2]" 1
826 1 31 GLY HA3 1 35 SER HB3 3.528 2.035 5.021 4.019 1.961 5.195 0.174 8 0 "[ . 1 . 2]" 1
827 1 31 GLY HA3 1 36 LYS HA 3.561 2.040 5.082 3.679 2.890 4.553 . 0 0 "[ . 1 . 2]" 1
828 1 32 ARG H 1 32 ARG HA 2.386 . 3.069 2.852 2.268 2.926 . 0 0 "[ . 1 . 2]" 1
829 1 32 ARG H 1 32 ARG HB2 3.195 . 4.420 3.462 2.860 4.024 . 0 0 "[ . 1 . 2]" 1
830 1 32 ARG H 1 32 ARG HB3 3.017 . 4.109 3.566 3.000 4.075 . 0 0 "[ . 1 . 2]" 1
831 1 32 ARG H 1 32 ARG HD3 4.134 2.084 6.184 4.647 2.037 5.918 0.047 3 0 "[ . 1 . 2]" 1
832 1 32 ARG H 1 32 ARG QG 3.427 2.017 4.837 3.231 2.094 4.423 . 0 0 "[ . 1 . 2]" 1
833 1 32 ARG H 1 35 SER H 3.502 2.030 4.974 3.804 2.631 4.545 . 0 0 "[ . 1 . 2]" 1
834 1 32 ARG H 1 35 SER HB2 3.319 . 4.641 4.182 2.999 4.751 0.110 17 0 "[ . 1 . 2]" 1
835 1 32 ARG H 1 35 SER HB3 3.355 2.004 4.706 2.907 2.004 3.673 0.000 10 0 "[ . 1 . 2]" 1
836 1 32 ARG H 1 36 LYS H 3.566 2.040 5.092 4.441 3.763 4.778 . 0 0 "[ . 1 . 2]" 1
837 1 32 ARG H 1 36 LYS HB2 4.893 2.020 7.766 5.636 4.643 6.714 . 0 0 "[ . 1 . 2]" 1
838 1 32 ARG H 1 36 LYS HB3 4.420 2.076 6.764 4.889 3.862 6.813 0.049 2 0 "[ . 1 . 2]" 1
839 1 32 ARG H 1 36 LYS HD3 4.941 2.011 7.871 7.306 6.353 8.385 0.514 4 1 "[ +. 1 . 2]" 1
840 1 32 ARG HA 1 32 ARG HB2 2.522 . 3.285 2.698 2.348 3.029 . 0 0 "[ . 1 . 2]" 1
841 1 32 ARG HA 1 32 ARG HB3 2.393 . 3.080 2.566 2.278 3.019 . 0 0 "[ . 1 . 2]" 1
842 1 32 ARG HA 1 33 GLY H 2.532 . 3.301 2.402 2.132 2.754 . 0 0 "[ . 1 . 2]" 1
843 1 32 ARG HA 1 33 GLY HA3 3.701 2.057 5.345 4.517 4.327 4.673 . 0 0 "[ . 1 . 2]" 1
844 1 32 ARG HA 1 35 SER H 3.528 2.035 5.021 4.817 4.105 5.054 0.033 13 0 "[ . 1 . 2]" 1
845 1 32 ARG HB2 1 33 GLY HA3 4.375 2.078 6.672 4.668 3.885 5.934 . 0 0 "[ . 1 . 2]" 1
846 1 32 ARG HD2 1 33 GLY HA3 4.526 2.068 6.984 6.222 5.271 6.868 . 0 0 "[ . 1 . 2]" 1
847 1 32 ARG HD3 1 32 ARG HE 2.446 . 3.164 2.794 2.491 2.957 . 0 0 "[ . 1 . 2]" 1
848 1 32 ARG HD3 1 32 ARG QG 2.422 . 3.126 2.286 2.151 2.485 . 0 0 "[ . 1 . 2]" 1
849 1 32 ARG QG 1 33 GLY H 3.512 2.032 4.992 3.785 2.184 4.649 . 0 0 "[ . 1 . 2]" 1
850 1 33 GLY H 1 33 GLY HA2 2.422 . 3.126 2.313 2.291 2.375 . 0 0 "[ . 1 . 2]" 1
851 1 33 GLY H 1 33 GLY HA3 2.422 . 3.126 2.863 2.810 2.933 . 0 0 "[ . 1 . 2]" 1
852 1 33 GLY HA2 1 34 ASP H 2.801 . 3.743 3.221 2.960 3.472 . 0 0 "[ . 1 . 2]" 1
853 1 33 GLY HA2 1 35 SER HB3 4.264 2.082 6.446 6.419 6.071 6.775 0.329 18 0 "[ . 1 . 2]" 1
854 1 33 GLY HA3 1 34 ASP H 2.422 . 3.126 2.154 2.086 2.242 . 0 0 "[ . 1 . 2]" 1
855 1 33 GLY HA3 1 35 SER HB2 3.860 2.072 5.648 5.023 3.443 5.706 0.058 13 0 "[ . 1 . 2]" 1
856 1 33 GLY HA3 1 35 SER HB3 4.175 2.083 6.267 5.093 4.656 5.338 . 0 0 "[ . 1 . 2]" 1
857 1 34 ASP H 1 34 ASP HA 2.713 . 3.596 2.924 2.908 2.950 . 0 0 "[ . 1 . 2]" 1
858 1 34 ASP H 1 34 ASP HB3 2.989 . 4.061 3.149 2.308 3.694 . 0 0 "[ . 1 . 2]" 1
859 1 34 ASP H 1 35 SER H 2.446 . 3.164 2.254 2.018 3.186 0.022 8 0 "[ . 1 . 2]" 1
860 1 34 ASP HA 1 35 SER H 3.118 . 4.284 3.224 2.664 3.414 . 0 0 "[ . 1 . 2]" 1
861 1 34 ASP HA 1 35 SER HB2 4.505 2.070 6.940 5.420 4.946 5.664 . 0 0 "[ . 1 . 2]" 1
862 1 34 ASP HB2 1 35 SER HB2 4.642 2.057 7.227 5.102 3.971 6.208 . 0 0 "[ . 1 . 2]" 1
863 1 34 ASP HB3 1 35 SER H 3.639 2.050 5.228 4.054 3.025 4.430 . 0 0 "[ . 1 . 2]" 1
864 1 34 ASP HB3 1 35 SER HB2 4.730 2.045 7.415 5.392 4.122 6.249 . 0 0 "[ . 1 . 2]" 1
865 1 35 SER H 1 35 SER HA 2.585 . 3.387 2.922 2.894 2.947 . 0 0 "[ . 1 . 2]" 1
866 1 35 SER H 1 35 SER HB2 3.006 . 4.090 2.666 2.196 3.169 . 0 0 "[ . 1 . 2]" 1
867 1 35 SER H 1 35 SER HB3 2.956 . 4.004 2.831 2.479 3.523 . 0 0 "[ . 1 . 2]" 1
868 1 35 SER H 1 36 LYS H 3.188 . 4.407 3.258 2.542 4.524 0.117 2 0 "[ . 1 . 2]" 1
869 1 35 SER HA 1 35 SER HB3 2.438 . 3.151 2.930 2.479 3.035 . 0 0 "[ . 1 . 2]" 1
870 1 35 SER HA 1 36 LYS H 2.273 . 2.893 2.713 2.204 2.978 0.085 4 0 "[ . 1 . 2]" 1
871 1 35 SER HA 1 37 ASN H 3.167 . 4.371 3.596 3.159 4.296 . 0 0 "[ . 1 . 2]" 1
872 1 35 SER HB2 1 36 LYS H 3.419 2.016 4.822 4.322 3.883 4.664 . 0 0 "[ . 1 . 2]" 1
873 1 35 SER HB2 1 36 LYS HG3 4.312 2.081 6.543 6.244 5.847 6.707 0.164 4 0 "[ . 1 . 2]" 1
874 1 35 SER HB3 1 36 LYS H 3.512 2.032 4.992 4.068 3.356 4.396 . 0 0 "[ . 1 . 2]" 1
875 1 36 LYS H 1 36 LYS HA 2.442 . 3.157 2.857 2.751 2.934 . 0 0 "[ . 1 . 2]" 1
876 1 36 LYS H 1 36 LYS HB2 2.956 . 4.004 3.473 2.565 3.842 . 0 0 "[ . 1 . 2]" 1
877 1 36 LYS H 1 36 LYS HB3 2.983 . 4.050 3.060 2.609 3.785 . 0 0 "[ . 1 . 2]" 1
878 1 36 LYS H 1 36 LYS HD2 3.129 . 4.304 3.454 1.944 4.495 0.191 16 0 "[ . 1 . 2]" 1
879 1 36 LYS H 1 36 LYS HD3 3.468 2.025 4.911 3.992 2.832 4.470 . 0 0 "[ . 1 . 2]" 1
880 1 36 LYS H 1 36 LYS HG3 2.951 . 3.996 2.247 1.802 4.014 0.104 13 0 "[ . 1 . 2]" 1
881 1 36 LYS H 1 37 ASN H 2.446 . 3.164 2.387 1.792 2.993 . 0 0 "[ . 1 . 2]" 1
882 1 36 LYS HA 1 36 LYS HB2 2.968 . 4.025 2.628 2.504 3.028 . 0 0 "[ . 1 . 2]" 1
883 1 36 LYS HA 1 36 LYS HB3 2.962 . 4.015 2.356 2.279 2.553 . 0 0 "[ . 1 . 2]" 1
884 1 36 LYS HA 1 36 LYS HG3 3.096 . 4.246 3.503 2.282 3.769 . 0 0 "[ . 1 . 2]" 1
885 1 36 LYS HA 1 37 ASN H 2.769 . 3.689 3.441 3.311 3.536 . 0 0 "[ . 1 . 2]" 1
886 1 36 LYS HB2 1 36 LYS HG3 2.446 . 3.164 2.875 2.449 3.016 . 0 0 "[ . 1 . 2]" 1
887 1 36 LYS HB2 1 37 ASN H 3.240 . 4.500 3.599 2.315 4.133 . 0 0 "[ . 1 . 2]" 1
888 1 36 LYS HB3 1 36 LYS HD3 3.063 . 4.189 3.463 2.538 3.763 . 0 0 "[ . 1 . 2]" 1
889 1 36 LYS HB3 1 36 LYS HG3 2.776 . 3.700 2.682 2.493 3.007 . 0 0 "[ . 1 . 2]" 1
890 1 36 LYS HB3 1 37 ASN H 3.022 . 4.118 4.128 3.571 4.440 0.322 1 0 "[ . 1 . 2]" 1
891 1 36 LYS HD3 1 37 ASN HA 4.517 2.069 6.965 5.497 3.779 7.503 0.538 10 1 "[ . + . 2]" 1
892 1 36 LYS HG3 1 37 ASN H 3.821 2.069 5.573 3.085 1.868 4.903 0.201 15 0 "[ . 1 . 2]" 1
893 1 37 ASN H 1 37 ASN HA 2.602 . 3.415 2.877 2.862 2.899 . 0 0 "[ . 1 . 2]" 1
894 1 37 ASN H 1 37 ASN QB 2.353 . 3.018 2.828 2.710 3.224 0.206 2 0 "[ . 1 . 2]" 1
895 1 37 ASN H 1 37 ASN HD21 3.861 2.072 5.650 4.811 3.904 5.186 . 0 0 "[ . 1 . 2]" 1
896 1 37 ASN H 1 37 ASN HD22 4.033 2.081 5.985 5.771 4.063 6.114 0.129 12 0 "[ . 1 . 2]" 1
897 1 37 ASN H 1 38 GLN H 3.252 . 4.521 3.654 3.269 4.226 . 0 0 "[ . 1 . 2]" 1
898 1 37 ASN H 1 38 GLN HB2 3.502 2.030 4.974 3.822 3.248 4.593 . 0 0 "[ . 1 . 2]" 1
899 1 37 ASN HA 1 38 GLN H 2.145 . 2.697 2.266 2.171 2.387 . 0 0 "[ . 1 . 2]" 1
900 1 37 ASN QB 1 38 GLN H 3.243 . 4.505 3.860 3.218 4.060 . 0 0 "[ . 1 . 2]" 1
901 1 37 ASN HD22 1 38 GLN HA 4.057 2.082 6.032 5.773 4.433 6.121 0.089 1 0 "[ . 1 . 2]" 1
902 1 38 GLN H 1 38 GLN HB2 2.825 . 3.783 2.998 2.538 3.381 . 0 0 "[ . 1 . 2]" 1
903 1 38 GLN H 1 38 GLN HB3 2.335 . 2.989 2.826 2.583 3.067 0.078 12 0 "[ . 1 . 2]" 1
904 1 38 GLN H 1 38 GLN HG3 3.572 2.041 5.103 4.621 4.351 5.082 . 0 0 "[ . 1 . 2]" 1
905 1 38 GLN H 1 39 CYS H 3.359 2.005 4.713 4.379 4.068 4.498 . 0 0 "[ . 1 . 2]" 1
906 1 38 GLN HA 1 38 GLN HB2 2.449 . 3.169 2.529 2.408 2.718 . 0 0 "[ . 1 . 2]" 1
907 1 38 GLN HA 1 38 GLN HB3 2.593 . 3.400 3.007 2.941 3.036 . 0 0 "[ . 1 . 2]" 1
908 1 38 GLN HA 1 38 GLN HE22 3.386 2.010 4.762 3.750 2.999 4.814 0.052 11 0 "[ . 1 . 2]" 1
909 1 38 GLN HA 1 38 GLN HG2 2.923 . 3.948 3.399 2.293 3.836 . 0 0 "[ . 1 . 2]" 1
910 1 38 GLN HA 1 38 GLN HG3 2.971 . 4.030 3.159 2.692 3.667 . 0 0 "[ . 1 . 2]" 1
911 1 38 GLN HA 1 39 CYS H 1.992 . 2.468 2.176 2.078 2.277 . 0 0 "[ . 1 . 2]" 1
912 1 38 GLN HA 1 39 CYS HA 3.249 . 4.516 4.365 4.349 4.388 . 0 0 "[ . 1 . 2]" 1
913 1 38 GLN HA 1 40 VAL QG 5.140 . 8.311 6.006 5.725 6.336 . 0 0 "[ . 1 . 2]" 1
914 1 38 GLN HB2 1 39 CYS H 3.024 . 4.121 4.142 3.990 4.368 0.247 12 0 "[ . 1 . 2]" 1
915 1 38 GLN HB2 1 40 VAL QG 5.178 . 8.396 5.785 5.373 6.221 . 0 0 "[ . 1 . 2]" 1
916 1 38 GLN HB3 1 38 GLN HG2 2.415 . 3.115 2.545 2.290 3.012 . 0 0 "[ . 1 . 2]" 1
917 1 38 GLN HB3 1 39 CYS H 3.011 . 4.099 3.890 3.382 4.118 0.019 16 0 "[ . 1 . 2]" 1
918 1 38 GLN HB3 1 40 VAL QG 4.385 2.078 6.692 4.621 4.297 4.996 . 0 0 "[ . 1 . 2]" 1
919 1 38 GLN HE21 1 38 GLN HG2 2.773 . 3.696 3.114 2.177 3.511 . 0 0 "[ . 1 . 2]" 1
920 1 38 GLN HE21 1 38 GLN HG3 2.840 . 3.808 2.746 2.171 3.503 . 0 0 "[ . 1 . 2]" 1
921 1 38 GLN HE22 1 38 GLN HG3 2.976 . 4.039 3.714 3.465 4.068 0.029 20 0 "[ . 1 . 2]" 1
922 1 38 GLN HG2 1 40 VAL QG 3.779 2.066 5.492 4.912 3.749 6.188 0.696 9 1 "[ . +1 . 2]" 1
923 1 38 GLN HG3 1 39 CYS H 3.010 . 4.097 3.084 2.239 4.752 0.655 12 1 "[ . 1 + . 2]" 1
924 1 39 CYS H 1 39 CYS HA 2.252 . 2.861 2.902 2.894 2.919 0.058 6 0 "[ . 1 . 2]" 1
925 1 39 CYS H 1 39 CYS HB2 2.695 . 3.566 2.385 2.309 2.459 . 0 0 "[ . 1 . 2]" 1
926 1 39 CYS H 1 39 CYS HB3 2.678 . 3.539 3.600 3.569 3.620 0.081 15 0 "[ . 1 . 2]" 1
927 1 39 CYS H 1 40 VAL H 3.165 . 4.367 4.137 3.985 4.292 . 0 0 "[ . 1 . 2]" 1
928 1 39 CYS H 1 40 VAL HB 3.754 2.063 5.445 5.473 5.296 5.557 0.112 13 0 "[ . 1 . 2]" 1
929 1 39 CYS H 1 40 VAL QG 4.925 2.015 7.835 5.286 5.177 5.371 . 0 0 "[ . 1 . 2]" 1
930 1 39 CYS HA 1 39 CYS HB2 2.296 . 2.929 3.010 3.005 3.014 0.085 7 0 "[ . 1 . 2]" 1
931 1 39 CYS HA 1 39 CYS HB3 2.366 . 3.038 2.511 2.448 2.572 . 0 0 "[ . 1 . 2]" 1
932 1 39 CYS HA 1 40 VAL H 2.205 . 2.789 2.227 2.172 2.283 . 0 0 "[ . 1 . 2]" 1
933 1 39 CYS HA 1 40 VAL QG 4.436 2.083 6.161 4.022 3.914 4.171 . 0 0 "[ . 1 . 2]" 1
934 1 39 CYS HB3 1 40 VAL H 3.578 2.042 5.114 3.900 3.641 4.063 . 0 0 "[ . 1 . 2]" 1
935 1 40 VAL H 1 40 VAL HA 2.669 . 3.524 2.914 2.903 2.935 . 0 0 "[ . 1 . 2]" 1
936 1 40 VAL H 1 40 VAL HB 1.944 . 2.397 2.511 2.462 2.583 0.186 8 0 "[ . 1 . 2]" 1
937 1 40 VAL H 1 40 VAL QG 3.463 2.024 4.755 2.274 2.170 2.427 . 0 0 "[ . 1 . 2]" 1
938 1 40 VAL H 1 41 THR H 3.427 2.017 4.837 4.569 4.537 4.605 . 0 0 "[ . 1 . 2]" 1
939 1 40 VAL HA 1 40 VAL HB 2.281 . 2.905 2.584 2.553 2.632 . 0 0 "[ . 1 . 2]" 1
940 1 40 VAL HA 1 40 VAL QG . 2.083 3.979 2.203 2.166 2.236 . 0 0 "[ . 1 . 2]" 1
941 1 40 VAL HA 1 41 THR H 2.198 . 2.778 2.418 2.322 2.484 . 0 0 "[ . 1 . 2]" 1
942 1 40 VAL HA 1 41 THR MG 4.161 2.083 6.239 3.734 3.590 3.922 . 0 0 "[ . 1 . 2]" 1
943 1 40 VAL HA 1 42 GLY H 4.019 2.081 5.957 6.010 5.894 6.056 0.099 10 0 "[ . 1 . 2]" 1
944 1 40 VAL HB 1 40 VAL QG 2.213 . 2.757 1.892 1.890 1.894 . 0 0 "[ . 1 . 2]" 1
945 1 40 VAL HB 1 41 THR H 2.984 . 4.053 4.023 3.940 4.094 0.041 6 0 "[ . 1 . 2]" 1
946 1 40 VAL QG 1 41 THR H 2.692 . 3.562 1.911 1.784 2.057 0.067 11 0 "[ . 1 . 2]" 1
947 1 40 VAL QG 1 41 THR HB 4.286 2.081 6.491 4.503 4.408 4.610 . 0 0 "[ . 1 . 2]" 1
948 1 41 THR H 1 41 THR HA 2.291 . 2.921 2.902 2.896 2.919 . 0 0 "[ . 1 . 2]" 1
949 1 41 THR H 1 41 THR HB 3.107 . 4.265 3.607 3.543 3.657 . 0 0 "[ . 1 . 2]" 1
950 1 41 THR H 1 41 THR MG 3.148 . 4.337 2.719 2.561 2.918 . 0 0 "[ . 1 . 2]" 1
951 1 41 THR HA 1 41 THR HB 2.925 . 3.951 2.551 2.511 2.622 . 0 0 "[ . 1 . 2]" 1
952 1 41 THR HA 1 41 THR MG 2.207 . 2.792 2.255 2.204 2.297 . 0 0 "[ . 1 . 2]" 1
953 1 41 THR HA 1 42 GLY H 2.126 . 2.668 2.106 2.075 2.135 . 0 0 "[ . 1 . 2]" 1
954 1 41 THR HA 1 43 GLU H 3.990 2.079 5.901 5.917 5.759 6.060 0.159 16 0 "[ . 1 . 2]" 1
955 1 41 THR HB 1 41 THR MG 2.475 . 3.210 2.134 2.130 2.137 . 0 0 "[ . 1 . 2]" 1
956 1 41 THR HB 1 42 GLY H 3.138 . 4.320 3.254 3.135 3.518 . 0 0 "[ . 1 . 2]" 1
957 1 41 THR MG 1 42 GLY H 3.590 2.044 5.136 3.716 3.524 3.860 . 0 0 "[ . 1 . 2]" 1
958 1 42 GLY H 1 42 GLY HA2 2.589 . 3.393 2.765 2.729 2.826 . 0 0 "[ . 1 . 2]" 1
959 1 42 GLY H 1 42 GLY HA3 2.718 . 3.604 2.840 2.780 2.866 . 0 0 "[ . 1 . 2]" 1
960 1 42 GLY HA2 1 43 GLU H 2.710 . 3.591 3.133 2.970 3.255 . 0 0 "[ . 1 . 2]" 1
961 1 42 GLY HA2 1 43 GLU HA 3.299 . 4.605 4.584 4.420 4.668 0.063 6 0 "[ . 1 . 2]" 1
962 1 42 GLY HA3 1 43 GLU H 2.740 . 3.641 2.179 2.141 2.232 . 0 0 "[ . 1 . 2]" 1
963 1 42 GLY HA3 1 43 GLU HG2 4.065 2.082 6.048 4.540 3.936 5.457 . 0 0 "[ . 1 . 2]" 1
964 1 43 GLU H 1 43 GLU HA 2.470 . 3.202 2.917 2.880 2.948 . 0 0 "[ . 1 . 2]" 1
965 1 43 GLU H 1 43 GLU QB 2.976 . 4.039 2.997 2.475 3.300 . 0 0 "[ . 1 . 2]" 1
966 1 43 GLU H 1 43 GLU HG2 3.088 . 4.232 3.128 2.460 4.250 0.018 5 0 "[ . 1 . 2]" 1
967 1 43 GLU H 1 43 GLU HG3 3.085 . 4.227 3.333 2.581 4.362 0.135 8 0 "[ . 1 . 2]" 1
968 1 43 GLU H 1 44 GLY H 3.040 . 4.149 4.045 3.860 4.159 0.010 20 0 "[ . 1 . 2]" 1
969 1 43 GLU HA 1 43 GLU QB 2.115 . 2.652 2.259 2.147 2.458 . 0 0 "[ . 1 . 2]" 1
970 1 43 GLU HA 1 43 GLU HG2 3.273 . 4.559 3.319 2.316 4.184 . 0 0 "[ . 1 . 2]" 1
971 1 43 GLU HA 1 43 GLU HG3 3.306 . 4.617 3.621 2.977 4.260 . 0 0 "[ . 1 . 2]" 1
972 1 43 GLU HA 1 44 GLY H 1.975 . 2.443 2.120 2.091 2.155 . 0 0 "[ . 1 . 2]" 1
973 1 43 GLU QB 1 44 GLY H 3.487 2.028 4.946 3.387 3.152 3.576 . 0 0 "[ . 1 . 2]" 1
974 1 44 GLY H 1 44 GLY HA2 2.369 . 3.043 2.920 2.887 2.942 . 0 0 "[ . 1 . 2]" 1
975 1 44 GLY H 1 44 GLY HA3 2.468 . 3.199 2.363 2.312 2.423 . 0 0 "[ . 1 . 2]" 1
976 1 44 GLY H 1 45 THR H 2.986 . 4.056 4.112 4.016 4.186 0.130 2 0 "[ . 1 . 2]" 1
977 1 44 GLY HA2 1 45 THR H 2.509 . 3.264 2.936 2.840 3.059 . 0 0 "[ . 1 . 2]" 1
978 1 44 GLY HA3 1 45 THR H 2.234 . 2.833 2.203 2.161 2.246 . 0 0 "[ . 1 . 2]" 1
979 1 45 THR H 1 45 THR HA 2.389 . 3.074 2.917 2.894 2.933 . 0 0 "[ . 1 . 2]" 1
980 1 45 THR H 1 45 THR HB 2.785 . 3.715 3.364 2.805 3.595 . 0 0 "[ . 1 . 2]" 1
981 1 45 THR H 1 45 THR MG 3.454 2.022 4.886 3.766 3.256 3.905 . 0 0 "[ . 1 . 2]" 1
982 1 45 THR H 1 46 PRO HA 3.507 2.031 4.983 5.002 4.890 5.081 0.098 2 0 "[ . 1 . 2]" 1
983 1 45 THR HA 1 45 THR MG 3.243 . 4.505 2.244 2.148 2.986 . 0 0 "[ . 1 . 2]" 1
984 1 45 THR HA 1 46 PRO HD2 2.415 . 3.115 2.630 2.379 2.726 . 0 0 "[ . 1 . 2]" 1
985 1 45 THR HA 1 46 PRO HD3 2.159 . 2.719 1.990 1.929 2.089 . 0 0 "[ . 1 . 2]" 1
986 1 45 THR HA 1 46 PRO HG2 4.101 2.083 6.119 4.481 4.405 4.530 . 0 0 "[ . 1 . 2]" 1
987 1 45 THR HB 1 45 THR MG 2.752 . 3.661 2.134 2.127 2.138 . 0 0 "[ . 1 . 2]" 1
988 1 45 THR HB 1 47 LYS H 4.134 2.084 6.184 5.698 5.482 6.402 0.218 16 0 "[ . 1 . 2]" 1
989 1 45 THR MG 1 46 PRO HD2 2.711 . 3.593 2.184 1.866 2.678 . 0 0 "[ . 1 . 2]" 1
990 1 45 THR MG 1 46 PRO HD3 2.827 . 3.786 3.027 2.775 3.514 . 0 0 "[ . 1 . 2]" 1
991 1 45 THR MG 1 47 LYS H 5.111 . 8.246 5.982 3.978 6.477 . 0 0 "[ . 1 . 2]" 1
992 1 46 PRO HA 1 46 PRO HB2 2.502 . 3.253 2.973 2.959 2.988 . 0 0 "[ . 1 . 2]" 1
993 1 46 PRO HA 1 46 PRO HB3 2.083 . 2.604 2.301 2.286 2.311 . 0 0 "[ . 1 . 2]" 1
994 1 46 PRO HA 1 46 PRO HD2 3.650 2.051 5.249 3.932 3.925 3.941 . 0 0 "[ . 1 . 2]" 1
995 1 46 PRO HA 1 46 PRO HD3 3.129 . 4.304 3.716 3.605 3.792 . 0 0 "[ . 1 . 2]" 1
996 1 46 PRO HA 1 47 LYS H 2.115 . 2.652 2.225 2.140 2.325 . 0 0 "[ . 1 . 2]" 1
997 1 46 PRO HB2 1 46 PRO HD2 3.578 2.042 5.114 2.954 2.917 2.985 . 0 0 "[ . 1 . 2]" 1
998 1 46 PRO HB2 1 47 LYS H 3.165 . 4.367 3.730 3.445 4.069 . 0 0 "[ . 1 . 2]" 1
999 1 46 PRO HB3 1 46 PRO HD2 3.398 2.012 4.784 3.896 3.878 3.922 . 0 0 "[ . 1 . 2]" 1
1000 1 46 PRO HB3 1 47 LYS H 3.363 2.006 4.720 3.395 3.111 3.832 . 0 0 "[ . 1 . 2]" 1
1001 1 46 PRO HD2 1 47 LYS H 4.108 2.083 6.133 5.475 5.338 5.567 . 0 0 "[ . 1 . 2]" 1
1002 1 47 LYS H 1 47 LYS HA 2.597 . 3.406 2.890 2.871 2.907 . 0 0 "[ . 1 . 2]" 1
1003 1 47 LYS H 1 47 LYS HB2 2.470 . 3.202 2.497 2.150 2.655 . 0 0 "[ . 1 . 2]" 1
1004 1 47 LYS H 1 47 LYS HB3 3.578 2.042 5.114 2.645 2.428 3.389 . 0 0 "[ . 1 . 2]" 1
1005 1 47 LYS H 1 47 LYS HE2 4.182 2.083 6.281 6.275 5.735 6.505 0.224 5 0 "[ . 1 . 2]" 1
1006 1 47 LYS H 1 47 LYS HG2 3.170 . 4.376 4.375 3.722 4.475 0.099 18 0 "[ . 1 . 2]" 1
1007 1 47 LYS H 1 47 LYS HG3 3.209 . 4.445 4.424 3.629 4.557 0.112 16 0 "[ . 1 . 2]" 1
1008 1 47 LYS H 1 48 PRO HA 3.845 2.071 5.619 5.390 5.223 5.650 0.031 6 0 "[ . 1 . 2]" 1
1009 1 47 LYS HA 1 47 LYS HB2 2.506 . 3.260 2.568 2.474 2.940 . 0 0 "[ . 1 . 2]" 1
1010 1 47 LYS HA 1 47 LYS HB3 2.758 . 3.671 2.999 2.716 3.031 . 0 0 "[ . 1 . 2]" 1
1011 1 47 LYS HA 1 47 LYS HD3 3.333 . 4.666 4.401 3.774 4.537 . 0 0 "[ . 1 . 2]" 1
1012 1 47 LYS HA 1 47 LYS HG2 3.042 . 4.153 2.526 2.077 2.767 . 0 0 "[ . 1 . 2]" 1
1013 1 47 LYS HA 1 47 LYS HG3 2.411 . 3.108 2.863 2.676 3.479 0.371 16 0 "[ . 1 . 2]" 1
1014 1 47 LYS HA 1 48 PRO HD2 2.074 . 2.590 2.397 1.795 2.597 0.007 13 0 "[ . 1 . 2]" 1
1015 1 47 LYS HA 1 48 PRO HD3 2.593 . 3.400 2.034 1.790 2.570 . 0 0 "[ . 1 . 2]" 1
1016 1 47 LYS HA 1 49 GLN H 4.347 2.079 6.615 6.243 6.096 6.412 . 0 0 "[ . 1 . 2]" 1
1017 1 47 LYS HB2 1 47 LYS HE3 3.333 . 4.666 4.754 2.687 5.048 0.382 17 0 "[ . 1 . 2]" 1
1018 1 47 LYS HB3 1 47 LYS HE3 3.544 2.037 5.051 4.168 1.926 4.629 0.111 14 0 "[ . 1 . 2]" 1
1019 1 47 LYS HD3 1 47 LYS HE3 2.716 . 3.601 2.699 2.445 3.014 . 0 0 "[ . 1 . 2]" 1
1020 1 47 LYS HE2 1 47 LYS HG2 2.953 . 3.999 2.398 2.168 3.853 . 0 0 "[ . 1 . 2]" 1
1021 1 47 LYS HE2 1 47 LYS HG3 3.578 2.042 5.114 3.107 2.514 3.524 . 0 0 "[ . 1 . 2]" 1
1022 1 47 LYS HE3 1 47 LYS HG3 2.777 . 3.702 3.555 2.669 4.191 0.489 9 0 "[ . 1 . 2]" 1
1023 1 47 LYS HG2 1 48 PRO HD2 3.348 2.003 4.693 2.691 1.890 3.416 0.113 11 0 "[ . 1 . 2]" 1
1024 1 47 LYS HG2 1 48 PRO HD3 3.645 2.050 5.240 3.693 3.151 4.319 . 0 0 "[ . 1 . 2]" 1
1025 1 47 LYS HG3 1 48 PRO HD2 2.901 . 3.911 3.677 2.755 4.830 0.919 14 1 "[ . 1 +. 2]" 1
1026 1 47 LYS HG3 1 48 PRO HD3 3.243 . 4.505 4.462 3.905 5.264 0.759 16 1 "[ . 1 .+ 2]" 1
1027 1 48 PRO HA 1 48 PRO HB2 2.301 . 2.937 2.924 2.751 2.993 0.056 6 0 "[ . 1 . 2]" 1
1028 1 48 PRO HA 1 48 PRO HB3 2.582 . 3.382 2.277 2.241 2.319 . 0 0 "[ . 1 . 2]" 1
1029 1 48 PRO HA 1 48 PRO HD3 3.539 2.036 5.042 3.720 3.151 3.912 . 0 0 "[ . 1 . 2]" 1
1030 1 48 PRO HA 1 49 GLN H 2.350 . 3.013 2.231 2.089 2.741 . 0 0 "[ . 1 . 2]" 1
1031 1 48 PRO HA 1 49 GLN HG3 3.067 . 4.196 4.257 3.875 4.356 0.160 4 0 "[ . 1 . 2]" 1
1032 1 48 PRO HB2 1 48 PRO HD2 3.035 . 4.140 3.135 2.907 4.011 . 0 0 "[ . 1 . 2]" 1
1033 1 48 PRO HB2 1 48 PRO HD3 3.348 2.003 4.693 3.900 3.863 3.968 . 0 0 "[ . 1 . 2]" 1
1034 1 48 PRO HB2 1 49 GLN H 2.469 . 3.201 3.314 2.322 3.778 0.577 5 3 "[ +- 1* . 2]" 1
1035 1 48 PRO HB3 1 48 PRO HD2 2.944 . 3.984 3.899 3.852 3.973 . 0 0 "[ . 1 . 2]" 1
1036 1 48 PRO HB3 1 48 PRO HD3 3.172 . 4.380 3.893 3.042 4.063 . 0 0 "[ . 1 . 2]" 1
1037 1 48 PRO HB3 1 49 GLN H 3.160 . 4.358 3.169 2.708 3.353 . 0 0 "[ . 1 . 2]" 1
1038 1 48 PRO HD3 1 48 PRO HG3 2.654 . 3.499 2.313 2.294 2.330 . 0 0 "[ . 1 . 2]" 1
1039 1 49 GLN H 1 49 GLN HA 2.291 . 2.921 2.905 2.811 2.942 0.021 6 0 "[ . 1 . 2]" 1
1040 1 49 GLN H 1 49 GLN HB2 3.595 2.044 5.146 3.737 3.516 3.984 . 0 0 "[ . 1 . 2]" 1
1041 1 49 GLN H 1 49 GLN HB3 2.906 . 3.920 3.524 3.112 3.750 . 0 0 "[ . 1 . 2]" 1
1042 1 49 GLN H 1 49 GLN HG2 3.201 . 4.430 2.413 1.900 2.857 0.072 4 0 "[ . 1 . 2]" 1
1043 1 49 GLN H 1 49 GLN HG3 3.073 . 4.206 2.722 2.096 3.430 . 0 0 "[ . 1 . 2]" 1
1044 1 49 GLN H 1 50 SER H 2.048 . 2.551 1.930 1.519 2.572 0.026 11 0 "[ . 1 . 2]" 1
1045 1 49 GLN H 1 50 SER HA 3.312 . 4.629 4.408 3.947 4.730 0.101 18 0 "[ . 1 . 2]" 1
1046 1 49 GLN HA 1 49 GLN HB3 2.592 . 3.398 2.297 2.260 2.341 . 0 0 "[ . 1 . 2]" 1
1047 1 49 GLN HA 1 49 GLN HG2 2.661 . 3.511 3.568 3.476 3.685 0.174 11 0 "[ . 1 . 2]" 1
1048 1 49 GLN HA 1 50 SER H 3.100 . 4.253 3.476 3.223 3.573 . 0 0 "[ . 1 . 2]" 1
1049 1 49 GLN HB2 1 50 SER H 2.987 . 4.058 3.446 2.495 4.045 . 0 0 "[ . 1 . 2]" 1
1050 1 49 GLN HB3 1 49 GLN HG3 2.503 . 3.255 3.001 2.976 3.013 . 0 0 "[ . 1 . 2]" 1
1051 1 49 GLN HB3 1 50 SER H 3.022 . 4.118 4.090 3.651 4.340 0.222 4 0 "[ . 1 . 2]" 1
1052 1 49 GLN HE21 1 49 GLN HG3 2.989 . 4.061 2.807 2.169 3.490 . 0 0 "[ . 1 . 2]" 1
1053 1 49 GLN HE22 1 49 GLN HG3 3.071 . 4.203 3.745 3.454 4.063 . 0 0 "[ . 1 . 2]" 1
1054 1 49 GLN HE22 1 50 SER H 5.104 . 8.230 5.905 4.605 6.708 . 0 0 "[ . 1 . 2]" 1
1055 1 49 GLN HG3 1 50 SER HA 3.344 2.002 4.686 4.371 3.889 4.806 0.120 19 0 "[ . 1 . 2]" 1
1056 1 50 SER H 1 50 SER QB 2.498 . 3.247 2.609 2.298 3.110 . 0 0 "[ . 1 . 2]" 1
1057 1 50 SER H 1 51 HIS H 4.430 2.075 6.785 3.391 2.168 4.602 . 0 0 "[ . 1 . 2]" 1
1058 1 50 SER HA 1 50 SER QB 2.442 . 3.157 2.334 2.174 2.448 . 0 0 "[ . 1 . 2]" 1
1059 1 50 SER HA 1 51 HIS H 4.862 2.025 7.699 2.872 2.122 3.593 . 0 0 "[ . 1 . 2]" 1
1060 1 50 SER QB 1 51 HIS H 4.115 2.083 6.147 3.038 1.963 4.024 0.120 7 0 "[ . 1 . 2]" 1
1061 1 51 HIS H 1 51 HIS HB2 2.479 . 3.216 2.548 2.226 3.527 0.311 2 0 "[ . 1 . 2]" 1
1062 1 51 HIS HA 1 51 HIS HB3 2.526 . 3.292 2.497 2.373 2.662 . 0 0 "[ . 1 . 2]" 1
1063 1 51 HIS HB2 1 51 HIS HD2 3.255 . 4.526 3.617 2.678 3.975 . 0 0 "[ . 1 . 2]" 1
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