NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
451546 |
2rov   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rov
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 2511
_Distance_constraint_stats_list.Viol_count 1583
_Distance_constraint_stats_list.Viol_total 901.421
_Distance_constraint_stats_list.Viol_max 0.235
_Distance_constraint_stats_list.Viol_rms 0.0088
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0009
_Distance_constraint_stats_list.Viol_average_violations_only 0.0285
_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 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ARG 0.382 0.055 14 0 "[ . 1 . 2]"
1 3 LEU 2.864 0.109 5 0 "[ . 1 . 2]"
1 4 GLU 1.798 0.055 14 0 "[ . 1 . 2]"
1 5 GLY 0.786 0.047 19 0 "[ . 1 . 2]"
1 6 TRP 2.151 0.091 9 0 "[ . 1 . 2]"
1 7 LEU 9.200 0.204 7 0 "[ . 1 . 2]"
1 8 SER 1.238 0.059 12 0 "[ . 1 . 2]"
1 9 LEU 0.701 0.096 5 0 "[ . 1 . 2]"
1 10 PRO 0.572 0.033 18 0 "[ . 1 . 2]"
1 11 VAL 1.639 0.207 13 0 "[ . 1 . 2]"
1 12 ARG 0.346 0.050 9 0 "[ . 1 . 2]"
1 13 ASN 0.307 0.051 19 0 "[ . 1 . 2]"
1 14 ASN 0.004 0.004 4 0 "[ . 1 . 2]"
1 15 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 LYS 0.017 0.017 12 0 "[ . 1 . 2]"
1 17 LYS 0.072 0.036 1 0 "[ . 1 . 2]"
1 18 PHE 0.621 0.059 11 0 "[ . 1 . 2]"
1 19 GLY 0.385 0.050 9 0 "[ . 1 . 2]"
1 20 TRP 1.467 0.089 1 0 "[ . 1 . 2]"
1 21 VAL 1.787 0.207 13 0 "[ . 1 . 2]"
1 22 LYS 1.393 0.089 1 0 "[ . 1 . 2]"
1 23 LYS 0.718 0.058 8 0 "[ . 1 . 2]"
1 24 TYR 1.062 0.058 8 0 "[ . 1 . 2]"
1 25 VAL 0.745 0.045 14 0 "[ . 1 . 2]"
1 26 ILE 0.940 0.052 2 0 "[ . 1 . 2]"
1 27 VAL 0.227 0.050 8 0 "[ . 1 . 2]"
1 28 SER 0.169 0.108 16 0 "[ . 1 . 2]"
1 29 SER 0.340 0.026 15 0 "[ . 1 . 2]"
1 30 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 LYS 0.091 0.013 5 0 "[ . 1 . 2]"
1 32 ILE 0.144 0.068 10 0 "[ . 1 . 2]"
1 33 LEU 0.432 0.114 8 0 "[ . 1 . 2]"
1 34 PHE 0.488 0.050 15 0 "[ . 1 . 2]"
1 35 TYR 0.630 0.050 15 0 "[ . 1 . 2]"
1 36 ASP 0.096 0.009 7 0 "[ . 1 . 2]"
1 37 SER 0.214 0.016 7 0 "[ . 1 . 2]"
1 38 GLU 0.005 0.003 11 0 "[ . 1 . 2]"
1 39 GLN 0.016 0.003 14 0 "[ . 1 . 2]"
1 40 ASP 0.027 0.009 3 0 "[ . 1 . 2]"
1 41 LYS 0.099 0.052 2 0 "[ . 1 . 2]"
1 42 GLU 0.002 0.001 19 0 "[ . 1 . 2]"
1 43 GLN 0.079 0.022 11 0 "[ . 1 . 2]"
1 44 SER 0.054 0.022 11 0 "[ . 1 . 2]"
1 45 ASN 0.089 0.018 16 0 "[ . 1 . 2]"
1 46 PRO 0.071 0.018 16 0 "[ . 1 . 2]"
1 47 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 MET 1.217 0.129 10 0 "[ . 1 . 2]"
1 49 VAL 0.482 0.114 8 0 "[ . 1 . 2]"
1 50 LEU 1.422 0.129 10 0 "[ . 1 . 2]"
1 51 ASP 0.072 0.013 5 0 "[ . 1 . 2]"
1 52 ILE 0.200 0.068 10 0 "[ . 1 . 2]"
1 53 ASP 0.061 0.014 9 0 "[ . 1 . 2]"
1 54 LYS 0.045 0.014 9 0 "[ . 1 . 2]"
1 55 LEU 0.054 0.014 1 0 "[ . 1 . 2]"
1 56 PHE 0.112 0.041 14 0 "[ . 1 . 2]"
1 57 HIS 0.124 0.013 3 0 "[ . 1 . 2]"
1 58 VAL 8.222 0.235 5 0 "[ . 1 . 2]"
1 59 ARG 0.023 0.010 8 0 "[ . 1 . 2]"
1 60 PRO 0.114 0.015 6 0 "[ . 1 . 2]"
1 61 VAL 0.114 0.015 6 0 "[ . 1 . 2]"
1 62 THR 0.002 0.002 8 0 "[ . 1 . 2]"
1 63 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ASP 0.002 0.002 8 0 "[ . 1 . 2]"
1 66 VAL 1.112 0.087 19 0 "[ . 1 . 2]"
1 67 TYR 0.501 0.036 7 0 "[ . 1 . 2]"
1 68 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ALA 0.035 0.016 3 0 "[ . 1 . 2]"
1 70 ASP 0.148 0.013 8 0 "[ . 1 . 2]"
1 71 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 LYS 0.006 0.006 10 0 "[ . 1 . 2]"
1 73 GLU 0.225 0.013 8 0 "[ . 1 . 2]"
1 74 ILE 0.723 0.087 19 0 "[ . 1 . 2]"
1 75 PRO 0.050 0.013 8 0 "[ . 1 . 2]"
1 76 ARG 0.024 0.006 15 0 "[ . 1 . 2]"
1 77 ILE 1.288 0.102 16 0 "[ . 1 . 2]"
1 78 PHE 1.360 0.088 13 0 "[ . 1 . 2]"
1 79 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ILE 2.746 0.157 9 0 "[ . 1 . 2]"
1 81 LEU 0.205 0.041 14 0 "[ . 1 . 2]"
1 82 TYR 0.330 0.020 4 0 "[ . 1 . 2]"
1 83 ALA 0.013 0.007 13 0 "[ . 1 . 2]"
1 84 ASN 0.054 0.024 4 0 "[ . 1 . 2]"
1 85 GLU 0.027 0.017 4 0 "[ . 1 . 2]"
1 86 GLY 0.529 0.042 16 0 "[ . 1 . 2]"
1 87 ILE 0.383 0.016 6 0 "[ . 1 . 2]"
1 88 SER 0.278 0.016 6 0 "[ . 1 . 2]"
1 89 SER 0.048 0.011 4 0 "[ . 1 . 2]"
1 90 ALA 0.022 0.020 4 0 "[ . 1 . 2]"
1 91 LYS 0.138 0.028 4 0 "[ . 1 . 2]"
1 92 ASN 0.295 0.028 4 0 "[ . 1 . 2]"
1 93 LEU 1.272 0.115 6 0 "[ . 1 . 2]"
1 94 LEU 0.223 0.014 4 0 "[ . 1 . 2]"
1 95 LEU 7.265 0.204 7 0 "[ . 1 . 2]"
1 96 LEU 1.290 0.102 16 0 "[ . 1 . 2]"
1 97 ALA 0.025 0.005 4 0 "[ . 1 . 2]"
1 98 ASN 0.073 0.010 20 0 "[ . 1 . 2]"
1 99 SER 0.242 0.013 7 0 "[ . 1 . 2]"
1 100 THR 0.213 0.018 1 0 "[ . 1 . 2]"
1 101 GLU 0.555 0.019 14 0 "[ . 1 . 2]"
1 102 GLU 0.167 0.016 1 0 "[ . 1 . 2]"
1 103 GLN 0.232 0.013 7 0 "[ . 1 . 2]"
1 104 GLN 0.431 0.019 14 0 "[ . 1 . 2]"
1 105 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 TRP 6.809 0.126 10 0 "[ . 1 . 2]"
1 107 VAL 0.996 0.096 13 0 "[ . 1 . 2]"
1 108 SER 0.116 0.012 5 0 "[ . 1 . 2]"
1 109 ARG 1.160 0.108 4 0 "[ . 1 . 2]"
1 110 LEU 5.009 0.235 5 0 "[ . 1 . 2]"
1 111 VAL 0.526 0.027 1 0 "[ . 1 . 2]"
1 112 LYS 0.133 0.012 14 0 "[ . 1 . 2]"
1 113 LYS 0.389 0.027 1 0 "[ . 1 . 2]"
1 114 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 PRO 0.117 0.045 20 0 "[ . 1 . 2]"
1 116 LYS 0.165 0.045 20 0 "[ . 1 . 2]"
1 117 LYS 0.048 0.015 15 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 SER HA 1 2 ARG H 2.850 . 2.850 2.689 2.559 2.769 . 0 0 "[ . 1 . 2]" 1
2 1 1 SER QB 1 2 ARG HD3 6.380 . 6.380 4.476 3.226 5.475 . 0 0 "[ . 1 . 2]" 1
3 1 1 SER QB 1 2 ARG HD2 6.380 . 6.380 3.537 3.022 4.947 . 0 0 "[ . 1 . 2]" 1
4 1 1 SER QB 1 2 ARG H 4.290 . 4.290 2.019 1.959 2.209 . 0 0 "[ . 1 . 2]" 1
5 1 1 SER QB 1 3 LEU H 6.380 . 6.380 5.621 5.461 5.734 . 0 0 "[ . 1 . 2]" 1
6 1 2 ARG HA 1 26 ILE MG 6.520 . 6.520 5.359 4.432 5.444 . 0 0 "[ . 1 . 2]" 1
7 1 2 ARG HA 1 2 ARG QD 4.950 . 4.950 3.651 3.438 3.844 . 0 0 "[ . 1 . 2]" 1
8 1 2 ARG HA 1 3 LEU H 2.740 . 2.740 2.634 2.314 2.696 . 0 0 "[ . 1 . 2]" 1
9 1 2 ARG HA 1 4 GLU H 5.500 . 5.500 5.294 4.598 5.503 0.003 11 0 "[ . 1 . 2]" 1
10 1 2 ARG QB 1 26 ILE MG 6.150 . 6.150 4.142 2.021 4.404 . 0 0 "[ . 1 . 2]" 1
11 1 2 ARG QB 1 29 SER H 6.380 . 6.380 4.464 3.961 5.581 . 0 0 "[ . 1 . 2]" 1
12 1 2 ARG QB 1 3 LEU H 4.220 . 4.220 2.003 1.908 2.725 . 0 0 "[ . 1 . 2]" 1
13 1 2 ARG QB 1 4 GLU H 6.380 . 6.380 5.334 3.585 5.635 . 0 0 "[ . 1 . 2]" 1
14 1 2 ARG HD3 1 26 ILE MG 5.030 . 5.030 3.170 2.577 3.560 . 0 0 "[ . 1 . 2]" 1
15 1 2 ARG HD3 1 28 SER HA 4.860 . 4.860 3.490 3.081 4.587 . 0 0 "[ . 1 . 2]" 1
16 1 2 ARG HD2 1 26 ILE MG 5.030 . 5.030 4.014 3.084 4.261 . 0 0 "[ . 1 . 2]" 1
17 1 2 ARG HD2 1 28 SER HA 4.860 . 4.860 4.458 4.172 4.653 . 0 0 "[ . 1 . 2]" 1
18 1 2 ARG QD 1 26 ILE MD 7.060 . 7.060 4.876 4.437 5.127 . 0 0 "[ . 1 . 2]" 1
19 1 2 ARG QD 1 26 ILE MG 5.190 . 5.190 3.043 2.465 3.358 . 0 0 "[ . 1 . 2]" 1
20 1 2 ARG QD 1 28 SER QB 6.290 . 6.290 4.128 3.663 4.784 . 0 0 "[ . 1 . 2]" 1
21 1 2 ARG QD 1 3 LEU H 6.210 . 6.210 4.717 4.187 5.023 . 0 0 "[ . 1 . 2]" 1
22 1 2 ARG HG3 1 26 ILE MG 5.130 . 5.130 3.516 3.029 4.200 . 0 0 "[ . 1 . 2]" 1
23 1 2 ARG HG3 1 27 VAL HB 5.500 . 5.500 4.570 4.474 5.335 . 0 0 "[ . 1 . 2]" 1
24 1 2 ARG HG3 1 29 SER H 5.420 . 5.420 3.778 3.691 4.147 . 0 0 "[ . 1 . 2]" 1
25 1 2 ARG HG3 1 3 LEU H 4.250 . 4.250 3.884 3.703 4.044 . 0 0 "[ . 1 . 2]" 1
26 1 2 ARG HG3 1 4 GLU HB3 5.500 . 5.500 5.088 4.625 5.555 0.055 14 0 "[ . 1 . 2]" 1
27 1 2 ARG HG2 1 26 ILE MG 5.130 . 5.130 2.659 2.491 3.179 . 0 0 "[ . 1 . 2]" 1
28 1 2 ARG HG2 1 27 VAL HB 5.500 . 5.500 4.805 3.972 5.283 . 0 0 "[ . 1 . 2]" 1
29 1 2 ARG HG2 1 29 SER H 5.420 . 5.420 5.364 3.977 5.446 0.026 15 0 "[ . 1 . 2]" 1
30 1 2 ARG HG2 1 3 LEU H 4.250 . 4.250 3.526 2.878 4.011 . 0 0 "[ . 1 . 2]" 1
31 1 2 ARG HG2 1 4 GLU HB3 5.500 . 5.500 3.577 3.277 4.931 . 0 0 "[ . 1 . 2]" 1
32 1 2 ARG QG 1 26 ILE MG 5.260 . 5.260 2.583 2.427 3.089 . 0 0 "[ . 1 . 2]" 1
33 1 2 ARG QG 1 27 VAL H 5.830 . 5.830 3.849 3.501 4.344 . 0 0 "[ . 1 . 2]" 1
34 1 2 ARG QG 1 28 SER HA 5.770 . 5.770 2.043 1.879 2.188 . 0 0 "[ . 1 . 2]" 1
35 1 2 ARG QG 1 28 SER QB 6.940 . 6.940 3.766 3.193 3.994 . 0 0 "[ . 1 . 2]" 1
36 1 2 ARG H 1 26 ILE MG 4.800 . 4.800 3.915 3.711 4.102 . 0 0 "[ . 1 . 2]" 1
37 1 2 ARG H 1 2 ARG QD 4.390 . 4.390 2.219 1.886 3.057 . 0 0 "[ . 1 . 2]" 1
38 1 2 ARG H 1 2 ARG QG 4.620 . 4.620 2.698 2.175 3.553 . 0 0 "[ . 1 . 2]" 1
39 1 2 ARG H 1 4 GLU QB 5.180 . 5.180 3.891 3.689 4.148 . 0 0 "[ . 1 . 2]" 1
40 1 2 ARG H 1 4 GLU H 5.500 . 5.500 5.048 4.383 5.377 . 0 0 "[ . 1 . 2]" 1
41 1 3 LEU HA 1 106 TRP HE1 5.500 . 5.500 5.513 5.500 5.528 0.028 9 0 "[ . 1 . 2]" 1
42 1 3 LEU HA 1 27 VAL MG2 6.020 . 6.020 4.752 4.265 4.889 . 0 0 "[ . 1 . 2]" 1
43 1 3 LEU HA 1 3 LEU HG 4.190 . 4.190 2.827 2.651 3.053 . 0 0 "[ . 1 . 2]" 1
44 1 3 LEU HA 1 4 GLU H 2.660 . 2.660 2.198 2.145 2.407 . 0 0 "[ . 1 . 2]" 1
45 1 3 LEU HB3 1 27 VAL HB 4.510 . 4.510 1.998 1.879 2.087 . 0 0 "[ . 1 . 2]" 1
46 1 3 LEU HB3 1 4 GLU H 4.740 . 4.740 4.222 4.082 4.433 . 0 0 "[ . 1 . 2]" 1
47 1 3 LEU HB2 1 27 VAL HB 4.510 . 4.510 3.156 2.874 3.571 . 0 0 "[ . 1 . 2]" 1
48 1 3 LEU HB2 1 4 GLU H 4.740 . 4.740 4.574 4.540 4.633 . 0 0 "[ . 1 . 2]" 1
49 1 3 LEU QB 1 27 VAL HB 4.610 . 4.610 1.975 1.870 2.070 . 0 0 "[ . 1 . 2]" 1
50 1 3 LEU QB 1 27 VAL MG2 6.290 . 6.290 2.414 2.091 2.783 . 0 0 "[ . 1 . 2]" 1
51 1 3 LEU QB 1 4 GLU H 5.040 . 5.040 3.894 3.808 4.019 . 0 0 "[ . 1 . 2]" 1
52 1 3 LEU MD1 1 105 LYS QD 7.400 . 7.400 3.489 3.281 3.754 . 0 0 "[ . 1 . 2]" 1
53 1 3 LEU MD1 1 105 LYS HE3 6.520 . 6.520 2.259 1.934 2.894 . 0 0 "[ . 1 . 2]" 1
54 1 3 LEU MD1 1 105 LYS HE2 6.520 . 6.520 2.760 2.019 3.574 . 0 0 "[ . 1 . 2]" 1
55 1 3 LEU MD1 1 105 LYS HG3 6.210 . 6.210 3.291 2.330 3.583 . 0 0 "[ . 1 . 2]" 1
56 1 3 LEU MD1 1 105 LYS HG2 6.210 . 6.210 2.239 2.044 3.777 . 0 0 "[ . 1 . 2]" 1
57 1 3 LEU MD1 1 106 TRP HA 4.790 . 4.790 2.057 1.937 2.207 . 0 0 "[ . 1 . 2]" 1
58 1 3 LEU MD1 1 106 TRP H 6.400 . 6.400 3.690 3.525 3.835 . 0 0 "[ . 1 . 2]" 1
59 1 3 LEU MD1 1 109 ARG HB3 4.670 . 4.670 2.550 2.108 3.076 . 0 0 "[ . 1 . 2]" 1
60 1 3 LEU MD1 1 109 ARG HB2 5.380 . 5.380 2.150 1.905 2.500 . 0 0 "[ . 1 . 2]" 1
61 1 3 LEU MD1 1 109 ARG QD 5.750 . 5.750 3.083 1.988 3.905 . 0 0 "[ . 1 . 2]" 1
62 1 3 LEU MD1 1 109 ARG HG3 5.530 . 5.530 2.224 1.878 2.719 . 0 0 "[ . 1 . 2]" 1
63 1 3 LEU MD1 1 109 ARG HG2 5.920 . 5.920 3.484 3.123 4.044 . 0 0 "[ . 1 . 2]" 1
64 1 3 LEU MD1 1 110 LEU HA 6.520 . 6.520 5.149 4.884 5.403 . 0 0 "[ . 1 . 2]" 1
65 1 3 LEU MD1 1 27 VAL HB 5.910 . 5.910 4.668 4.528 4.865 . 0 0 "[ . 1 . 2]" 1
66 1 3 LEU MD1 1 27 VAL MG2 6.220 . 6.220 4.159 3.792 4.255 . 0 0 "[ . 1 . 2]" 1
67 1 3 LEU MD1 1 27 VAL H 6.310 . 6.310 5.273 5.197 5.312 . 0 0 "[ . 1 . 2]" 1
68 1 3 LEU MD2 1 105 LYS QD 7.400 . 7.400 5.419 5.356 5.453 . 0 0 "[ . 1 . 2]" 1
69 1 3 LEU MD2 1 105 LYS HE3 6.520 . 6.520 4.719 4.324 5.388 . 0 0 "[ . 1 . 2]" 1
70 1 3 LEU MD2 1 105 LYS HE2 6.520 . 6.520 4.965 4.239 5.376 . 0 0 "[ . 1 . 2]" 1
71 1 3 LEU MD2 1 105 LYS HG3 6.210 . 6.210 4.927 3.982 5.008 . 0 0 "[ . 1 . 2]" 1
72 1 3 LEU MD2 1 105 LYS HG2 6.210 . 6.210 3.911 3.775 5.044 . 0 0 "[ . 1 . 2]" 1
73 1 3 LEU MD2 1 106 TRP HA 4.790 . 4.790 1.861 1.831 1.941 . 0 0 "[ . 1 . 2]" 1
74 1 3 LEU MD2 1 106 TRP H 6.400 . 6.400 4.213 4.169 4.270 . 0 0 "[ . 1 . 2]" 1
75 1 3 LEU MD2 1 109 ARG HB3 4.670 . 4.670 2.522 1.955 2.740 . 0 0 "[ . 1 . 2]" 1
76 1 3 LEU MD2 1 109 ARG HB2 5.380 . 5.380 1.884 1.816 1.954 . 0 0 "[ . 1 . 2]" 1
77 1 3 LEU MD2 1 109 ARG QD 5.750 . 5.750 4.033 3.832 4.200 . 0 0 "[ . 1 . 2]" 1
78 1 3 LEU MD2 1 109 ARG HG3 5.530 . 5.530 3.572 3.398 3.665 . 0 0 "[ . 1 . 2]" 1
79 1 3 LEU MD2 1 109 ARG HG2 5.920 . 5.920 4.217 3.963 4.418 . 0 0 "[ . 1 . 2]" 1
80 1 3 LEU MD2 1 110 LEU HA 6.520 . 6.520 2.940 2.756 3.333 . 0 0 "[ . 1 . 2]" 1
81 1 3 LEU MD2 1 27 VAL HB 5.910 . 5.910 2.955 2.723 3.268 . 0 0 "[ . 1 . 2]" 1
82 1 3 LEU MD2 1 27 VAL MG2 6.220 . 6.220 2.221 1.859 2.486 . 0 0 "[ . 1 . 2]" 1
83 1 3 LEU MD2 1 27 VAL H 6.310 . 6.310 4.269 3.784 4.561 . 0 0 "[ . 1 . 2]" 1
84 1 3 LEU QD 1 105 LYS QB 8.060 . 8.060 3.603 3.410 3.750 . 0 0 "[ . 1 . 2]" 1
85 1 3 LEU QD 1 105 LYS QD 7.390 . 7.390 3.448 3.253 3.691 . 0 0 "[ . 1 . 2]" 1
86 1 3 LEU QD 1 105 LYS QE 6.590 . 6.590 2.087 1.886 2.644 . 0 0 "[ . 1 . 2]" 1
87 1 3 LEU QD 1 105 LYS QG 6.580 . 6.580 2.129 2.014 2.292 . 0 0 "[ . 1 . 2]" 1
88 1 3 LEU QD 1 106 TRP HA 5.360 . 5.360 1.727 1.691 1.772 0.109 5 0 "[ . 1 . 2]" 1
89 1 3 LEU QD 1 106 TRP HE1 5.820 . 5.820 3.898 3.332 4.239 . 0 0 "[ . 1 . 2]" 1
90 1 3 LEU QD 1 106 TRP H 6.610 . 6.610 3.466 3.359 3.565 . 0 0 "[ . 1 . 2]" 1
91 1 3 LEU QD 1 109 ARG HA 7.540 . 7.540 3.823 3.675 4.035 . 0 0 "[ . 1 . 2]" 1
92 1 3 LEU QD 1 109 ARG HB2 5.760 . 5.760 1.758 1.692 1.888 0.108 4 0 "[ . 1 . 2]" 1
93 1 3 LEU QD 1 109 ARG QD 6.290 . 6.290 2.956 1.982 3.540 . 0 0 "[ . 1 . 2]" 1
94 1 3 LEU QD 1 109 ARG HG3 5.910 . 5.910 2.197 1.871 2.641 . 0 0 "[ . 1 . 2]" 1
95 1 3 LEU QD 1 109 ARG HG2 6.190 . 6.190 3.314 3.040 3.715 . 0 0 "[ . 1 . 2]" 1
96 1 3 LEU QD 1 109 ARG H 6.060 . 6.060 3.150 3.043 3.302 . 0 0 "[ . 1 . 2]" 1
97 1 3 LEU QD 1 110 LEU HA 6.060 . 6.060 2.923 2.746 3.293 . 0 0 "[ . 1 . 2]" 1
98 1 3 LEU QD 1 110 LEU MD1 8.240 . 8.240 4.228 4.105 4.391 . 0 0 "[ . 1 . 2]" 1
99 1 3 LEU QD 1 110 LEU MD2 7.140 . 7.140 2.838 2.659 3.086 . 0 0 "[ . 1 . 2]" 1
100 1 3 LEU QD 1 110 LEU HG 6.830 . 6.830 3.759 3.592 4.094 . 0 0 "[ . 1 . 2]" 1
101 1 3 LEU QD 1 110 LEU H 6.120 . 6.120 2.199 2.078 2.333 . 0 0 "[ . 1 . 2]" 1
102 1 3 LEU QD 1 27 VAL HB 6.300 . 6.300 2.924 2.704 3.215 . 0 0 "[ . 1 . 2]" 1
103 1 3 LEU QD 1 27 VAL MG1 6.690 . 6.690 3.181 2.931 3.379 . 0 0 "[ . 1 . 2]" 1
104 1 3 LEU QD 1 27 VAL MG2 6.350 . 6.350 2.212 1.856 2.468 . 0 0 "[ . 1 . 2]" 1
105 1 3 LEU QD 1 27 VAL H 6.530 . 6.530 4.091 3.708 4.304 . 0 0 "[ . 1 . 2]" 1
106 1 3 LEU QD 1 4 GLU H 5.640 . 5.640 3.403 3.146 3.919 . 0 0 "[ . 1 . 2]" 1
107 1 3 LEU HG 1 27 VAL HB 4.920 . 4.920 4.217 3.902 4.386 . 0 0 "[ . 1 . 2]" 1
108 1 3 LEU HG 1 27 VAL MG2 5.660 . 5.660 3.205 2.495 3.493 . 0 0 "[ . 1 . 2]" 1
109 1 3 LEU HG 1 4 GLU H 4.450 . 4.450 3.698 3.376 4.257 . 0 0 "[ . 1 . 2]" 1
110 1 3 LEU H 1 27 VAL HB 3.860 . 3.860 3.805 2.879 3.877 0.017 13 0 "[ . 1 . 2]" 1
111 1 3 LEU H 1 3 LEU HB3 3.650 . 3.650 2.904 2.444 3.063 . 0 0 "[ . 1 . 2]" 1
112 1 3 LEU H 1 3 LEU HB2 3.650 . 3.650 2.206 2.103 2.634 . 0 0 "[ . 1 . 2]" 1
113 1 3 LEU H 1 3 LEU HG 4.600 . 4.600 4.531 4.424 4.593 . 0 0 "[ . 1 . 2]" 1
114 1 3 LEU H 1 4 GLU H 4.530 . 4.530 4.299 3.746 4.410 . 0 0 "[ . 1 . 2]" 1
115 1 4 GLU HA 1 106 TRP HE1 5.500 . 5.500 5.022 4.866 5.117 . 0 0 "[ . 1 . 2]" 1
116 1 4 GLU HA 1 26 ILE HA 3.710 . 3.710 2.056 1.979 2.122 . 0 0 "[ . 1 . 2]" 1
117 1 4 GLU HA 1 26 ILE MD 5.760 . 5.760 4.506 4.360 4.788 . 0 0 "[ . 1 . 2]" 1
118 1 4 GLU HA 1 26 ILE HG13 5.250 . 5.250 4.421 4.240 4.844 . 0 0 "[ . 1 . 2]" 1
119 1 4 GLU HA 1 26 ILE MG 5.190 . 5.190 3.052 2.863 3.293 . 0 0 "[ . 1 . 2]" 1
120 1 4 GLU HA 1 26 ILE H 5.200 . 5.200 4.572 4.469 4.631 . 0 0 "[ . 1 . 2]" 1
121 1 4 GLU HA 1 27 VAL MG2 6.190 . 6.190 4.169 3.730 4.419 . 0 0 "[ . 1 . 2]" 1
122 1 4 GLU HA 1 27 VAL H 3.930 . 3.930 3.254 2.939 3.385 . 0 0 "[ . 1 . 2]" 1
123 1 4 GLU HA 1 5 GLY H 2.960 . 2.960 2.374 2.340 2.432 . 0 0 "[ . 1 . 2]" 1
124 1 4 GLU HB3 1 26 ILE HA 4.290 . 4.290 2.911 2.597 3.105 . 0 0 "[ . 1 . 2]" 1
125 1 4 GLU HB3 1 26 ILE MD 5.120 . 5.120 3.566 3.331 3.699 . 0 0 "[ . 1 . 2]" 1
126 1 4 GLU HB3 1 26 ILE HG13 5.020 . 5.020 4.644 4.386 4.804 . 0 0 "[ . 1 . 2]" 1
127 1 4 GLU HB3 1 26 ILE MG 4.710 . 4.710 1.788 1.758 1.840 0.042 10 0 "[ . 1 . 2]" 1
128 1 4 GLU HB2 1 26 ILE HA 4.490 . 4.490 3.050 2.201 3.303 . 0 0 "[ . 1 . 2]" 1
129 1 4 GLU HB2 1 26 ILE MD 5.580 . 5.580 2.887 2.676 3.196 . 0 0 "[ . 1 . 2]" 1
130 1 4 GLU HB2 1 26 ILE HG13 4.820 . 4.820 3.695 3.486 3.785 . 0 0 "[ . 1 . 2]" 1
131 1 4 GLU HB2 1 26 ILE MG 5.040 . 5.040 2.252 2.040 2.669 . 0 0 "[ . 1 . 2]" 1
132 1 4 GLU QB 1 25 VAL H 6.380 . 6.380 5.174 4.882 5.313 . 0 0 "[ . 1 . 2]" 1
133 1 4 GLU QB 1 5 GLY H 4.230 . 4.230 2.488 2.353 2.589 . 0 0 "[ . 1 . 2]" 1
134 1 4 GLU QG 1 26 ILE HA 6.260 . 6.260 4.551 4.047 4.646 . 0 0 "[ . 1 . 2]" 1
135 1 4 GLU QG 1 26 ILE MD 6.480 . 6.480 4.046 3.349 4.284 . 0 0 "[ . 1 . 2]" 1
136 1 4 GLU H 1 106 TRP HE1 5.480 . 5.480 4.778 4.533 5.488 0.008 14 0 "[ . 1 . 2]" 1
137 1 4 GLU H 1 26 ILE HA 4.910 . 4.910 4.546 4.160 4.635 . 0 0 "[ . 1 . 2]" 1
138 1 4 GLU H 1 26 ILE HG12 5.500 . 5.500 5.525 5.511 5.534 0.034 20 0 "[ . 1 . 2]" 1
139 1 4 GLU H 1 26 ILE MG 6.170 . 6.170 4.254 3.771 4.454 . 0 0 "[ . 1 . 2]" 1
140 1 4 GLU H 1 27 VAL H 5.400 . 5.400 4.726 4.164 4.836 . 0 0 "[ . 1 . 2]" 1
141 1 4 GLU H 1 4 GLU QG 4.730 . 4.730 2.472 2.106 2.670 . 0 0 "[ . 1 . 2]" 1
142 1 4 GLU H 1 5 GLY H 4.550 . 4.550 4.397 4.359 4.484 . 0 0 "[ . 1 . 2]" 1
143 1 5 GLY HA3 1 106 TRP HE1 4.680 . 4.680 3.507 3.418 3.538 . 0 0 "[ . 1 . 2]" 1
144 1 5 GLY HA3 1 6 TRP HE1 5.500 . 5.500 5.527 5.509 5.547 0.047 19 0 "[ . 1 . 2]" 1
145 1 5 GLY HA3 1 6 TRP H 2.960 . 2.960 2.288 2.243 2.332 . 0 0 "[ . 1 . 2]" 1
146 1 5 GLY HA2 1 106 TRP HE1 5.220 . 5.220 5.229 5.150 5.251 0.031 19 0 "[ . 1 . 2]" 1
147 1 5 GLY HA2 1 6 TRP HE1 4.880 . 4.880 4.127 4.092 4.175 . 0 0 "[ . 1 . 2]" 1
148 1 5 GLY HA2 1 6 TRP H 2.970 . 2.970 2.912 2.853 2.968 . 0 0 "[ . 1 . 2]" 1
149 1 5 GLY H 1 106 TRP HE1 5.440 . 5.440 5.099 5.031 5.166 . 0 0 "[ . 1 . 2]" 1
150 1 5 GLY H 1 25 VAL HA 5.310 . 5.310 4.967 4.895 5.010 . 0 0 "[ . 1 . 2]" 1
151 1 5 GLY H 1 25 VAL MG1 6.060 . 6.060 5.001 4.962 5.022 . 0 0 "[ . 1 . 2]" 1
152 1 5 GLY H 1 25 VAL MG2 6.060 . 6.060 4.968 4.807 5.021 . 0 0 "[ . 1 . 2]" 1
153 1 5 GLY H 1 25 VAL QG 6.490 . 6.490 4.440 4.348 4.470 . 0 0 "[ . 1 . 2]" 1
154 1 5 GLY H 1 25 VAL H 3.740 . 3.740 3.346 3.235 3.422 . 0 0 "[ . 1 . 2]" 1
155 1 5 GLY H 1 26 ILE HA 3.900 . 3.900 3.627 3.510 3.701 . 0 0 "[ . 1 . 2]" 1
156 1 5 GLY H 1 26 ILE HG12 4.070 . 4.070 2.869 2.725 3.149 . 0 0 "[ . 1 . 2]" 1
157 1 5 GLY H 1 7 LEU MD1 6.520 . 6.520 5.299 5.285 5.311 . 0 0 "[ . 1 . 2]" 1
158 1 6 TRP HA 1 23 LYS H 4.480 . 4.480 4.080 3.628 4.260 . 0 0 "[ . 1 . 2]" 1
159 1 6 TRP HA 1 24 TYR HA 3.760 . 3.760 2.497 2.428 2.556 . 0 0 "[ . 1 . 2]" 1
160 1 6 TRP HA 1 24 TYR HB3 5.500 . 5.500 5.454 5.389 5.510 0.010 14 0 "[ . 1 . 2]" 1
161 1 6 TRP HA 1 24 TYR H 5.300 . 5.300 4.417 4.295 4.506 . 0 0 "[ . 1 . 2]" 1
162 1 6 TRP HA 1 25 VAL QG 6.810 . 6.810 3.440 3.185 3.639 . 0 0 "[ . 1 . 2]" 1
163 1 6 TRP HA 1 25 VAL H 3.720 . 3.720 2.785 2.719 2.902 . 0 0 "[ . 1 . 2]" 1
164 1 6 TRP HA 1 6 TRP HE1 5.360 . 5.360 5.429 5.396 5.451 0.091 9 0 "[ . 1 . 2]" 1
165 1 6 TRP HA 1 7 LEU H 3.090 . 3.090 2.130 2.118 2.139 . 0 0 "[ . 1 . 2]" 1
166 1 6 TRP QB 1 22 LYS QB 6.860 . 6.860 1.941 1.727 2.071 0.073 17 0 "[ . 1 . 2]" 1
167 1 6 TRP QB 1 22 LYS QG 6.850 . 6.850 2.065 1.812 2.706 . 0 0 "[ . 1 . 2]" 1
168 1 6 TRP QB 1 7 LEU H 4.750 . 4.750 3.201 3.164 3.232 . 0 0 "[ . 1 . 2]" 1
169 1 6 TRP HE1 1 24 TYR HA 5.500 . 5.500 5.227 4.999 5.279 . 0 0 "[ . 1 . 2]" 1
170 1 6 TRP H 1 106 TRP HE1 5.500 . 5.500 4.541 4.400 4.616 . 0 0 "[ . 1 . 2]" 1
171 1 6 TRP H 1 24 TYR HA 5.500 . 5.500 4.701 4.632 4.799 . 0 0 "[ . 1 . 2]" 1
172 1 6 TRP H 1 25 VAL QG 7.480 . 7.480 5.182 5.037 5.264 . 0 0 "[ . 1 . 2]" 1
173 1 6 TRP H 1 6 TRP HE1 5.090 . 5.090 4.888 4.764 5.020 . 0 0 "[ . 1 . 2]" 1
174 1 6 TRP H 1 7 LEU MD1 6.520 . 6.520 5.392 5.339 5.411 . 0 0 "[ . 1 . 2]" 1
175 1 6 TRP H 1 7 LEU MD2 5.960 . 5.960 4.677 4.547 4.798 . 0 0 "[ . 1 . 2]" 1
176 1 6 TRP H 1 7 LEU HG 4.590 . 4.590 4.225 4.174 4.256 . 0 0 "[ . 1 . 2]" 1
177 1 6 TRP H 1 7 LEU H 4.380 . 4.380 4.308 4.286 4.324 . 0 0 "[ . 1 . 2]" 1
178 1 7 LEU HA 1 23 LYS H 4.790 . 4.790 4.580 4.268 4.679 . 0 0 "[ . 1 . 2]" 1
179 1 7 LEU HA 1 7 LEU MD2 4.190 . 4.190 2.264 2.078 2.410 . 0 0 "[ . 1 . 2]" 1
180 1 7 LEU HA 1 7 LEU HG 4.100 . 4.100 2.861 2.816 2.897 . 0 0 "[ . 1 . 2]" 1
181 1 7 LEU HA 1 8 SER H 3.160 . 3.160 2.265 2.243 2.302 . 0 0 "[ . 1 . 2]" 1
182 1 7 LEU HA 1 96 LEU H 5.180 . 5.180 4.632 4.355 4.867 . 0 0 "[ . 1 . 2]" 1
183 1 7 LEU HB3 1 8 SER H 3.840 . 3.840 2.749 2.698 2.791 . 0 0 "[ . 1 . 2]" 1
184 1 7 LEU HB2 1 8 SER H 3.840 . 3.840 3.884 3.863 3.899 0.059 12 0 "[ . 1 . 2]" 1
185 1 7 LEU QB 1 25 VAL QG 6.670 . 6.670 2.109 1.898 2.193 . 0 0 "[ . 1 . 2]" 1
186 1 7 LEU QB 1 8 SER H 4.200 . 4.200 2.695 2.649 2.733 . 0 0 "[ . 1 . 2]" 1
187 1 7 LEU QB 1 95 LEU QD 6.080 . 6.080 2.251 2.130 2.309 . 0 0 "[ . 1 . 2]" 1
188 1 7 LEU MD1 1 106 TRP HE1 4.830 . 4.830 3.775 3.756 3.802 . 0 0 "[ . 1 . 2]" 1
189 1 7 LEU MD1 1 25 VAL HB 5.370 . 5.370 2.368 2.292 2.503 . 0 0 "[ . 1 . 2]" 1
190 1 7 LEU MD1 1 25 VAL MG1 5.890 . 5.890 2.520 2.422 2.629 . 0 0 "[ . 1 . 2]" 1
191 1 7 LEU MD1 1 25 VAL MG2 5.890 . 5.890 2.200 2.078 2.356 . 0 0 "[ . 1 . 2]" 1
192 1 7 LEU MD1 1 25 VAL QG 6.310 . 6.310 2.067 1.985 2.169 . 0 0 "[ . 1 . 2]" 1
193 1 7 LEU MD1 1 25 VAL H 6.260 . 6.260 4.276 4.185 4.393 . 0 0 "[ . 1 . 2]" 1
194 1 7 LEU MD1 1 95 LEU HA 5.950 . 5.950 4.416 4.356 4.492 . 0 0 "[ . 1 . 2]" 1
195 1 7 LEU MD1 1 95 LEU QB 6.640 . 6.640 2.254 2.177 2.351 . 0 0 "[ . 1 . 2]" 1
196 1 7 LEU MD1 1 95 LEU MD1 6.010 . 6.010 1.626 1.602 1.672 0.198 4 0 "[ . 1 . 2]" 1
197 1 7 LEU MD1 1 95 LEU MD2 6.010 . 6.010 3.098 2.803 3.258 . 0 0 "[ . 1 . 2]" 1
198 1 7 LEU MD1 1 95 LEU QD 6.310 . 6.310 1.620 1.596 1.664 0.204 7 0 "[ . 1 . 2]" 1
199 1 7 LEU MD1 1 95 LEU HG 5.860 . 5.860 3.816 3.778 3.860 . 0 0 "[ . 1 . 2]" 1
200 1 7 LEU MD1 1 95 LEU H 6.520 . 6.520 5.254 5.225 5.281 . 0 0 "[ . 1 . 2]" 1
201 1 7 LEU MD1 1 97 ALA HA 6.520 . 6.520 5.265 5.160 5.390 . 0 0 "[ . 1 . 2]" 1
202 1 7 LEU MD1 1 97 ALA MB 7.110 . 7.110 4.582 4.431 4.703 . 0 0 "[ . 1 . 2]" 1
203 1 7 LEU MD2 1 102 GLU HG3 6.260 . 6.260 4.401 3.067 5.147 . 0 0 "[ . 1 . 2]" 1
204 1 7 LEU MD2 1 102 GLU HG2 6.260 . 6.260 3.610 3.091 5.097 . 0 0 "[ . 1 . 2]" 1
205 1 7 LEU MD2 1 106 TRP HE1 4.380 . 4.380 3.396 3.254 3.505 . 0 0 "[ . 1 . 2]" 1
206 1 7 LEU MD2 1 8 SER H 5.090 . 5.090 3.329 3.222 3.410 . 0 0 "[ . 1 . 2]" 1
207 1 7 LEU MD2 1 95 LEU QD 7.090 . 7.090 3.180 3.071 3.255 . 0 0 "[ . 1 . 2]" 1
208 1 7 LEU MD2 1 96 LEU H 6.070 . 6.070 4.169 3.780 4.402 . 0 0 "[ . 1 . 2]" 1
209 1 7 LEU MD2 1 97 ALA HA 4.380 . 4.380 2.640 2.477 2.776 . 0 0 "[ . 1 . 2]" 1
210 1 7 LEU MD2 1 97 ALA MB 5.640 . 5.640 2.604 2.398 2.803 . 0 0 "[ . 1 . 2]" 1
211 1 7 LEU MD2 1 98 ASN HD21 6.090 . 6.090 4.606 4.489 4.815 . 0 0 "[ . 1 . 2]" 1
212 1 7 LEU MD2 1 98 ASN HD22 6.040 . 6.040 4.723 4.412 4.889 . 0 0 "[ . 1 . 2]" 1
213 1 7 LEU MD2 1 98 ASN H 5.600 . 5.600 4.048 3.869 4.172 . 0 0 "[ . 1 . 2]" 1
214 1 7 LEU HG 1 106 TRP HE1 3.850 . 3.850 3.871 3.847 3.883 0.033 7 0 "[ . 1 . 2]" 1
215 1 7 LEU HG 1 25 VAL QG 5.880 . 5.880 3.152 2.984 3.262 . 0 0 "[ . 1 . 2]" 1
216 1 7 LEU HG 1 25 VAL H 4.760 . 4.760 4.390 4.288 4.495 . 0 0 "[ . 1 . 2]" 1
217 1 7 LEU H 1 22 LYS HA 4.810 . 4.810 3.593 3.543 3.655 . 0 0 "[ . 1 . 2]" 1
218 1 7 LEU H 1 22 LYS QB 6.340 . 6.340 3.791 3.285 4.536 . 0 0 "[ . 1 . 2]" 1
219 1 7 LEU H 1 23 LYS H 4.140 . 4.140 2.838 2.411 2.995 . 0 0 "[ . 1 . 2]" 1
220 1 7 LEU H 1 24 TYR HA 4.080 . 4.080 3.951 3.899 4.091 0.011 17 0 "[ . 1 . 2]" 1
221 1 7 LEU H 1 25 VAL HB 4.960 . 4.960 4.164 4.086 4.339 . 0 0 "[ . 1 . 2]" 1
222 1 7 LEU H 1 25 VAL QG 5.840 . 5.840 2.433 2.312 2.677 . 0 0 "[ . 1 . 2]" 1
223 1 7 LEU H 1 25 VAL H 4.320 . 4.320 3.435 3.350 3.582 . 0 0 "[ . 1 . 2]" 1
224 1 7 LEU H 1 7 LEU MD1 5.190 . 5.190 3.836 3.783 3.904 . 0 0 "[ . 1 . 2]" 1
225 1 7 LEU H 1 7 LEU MD2 5.120 . 5.120 4.103 4.067 4.138 . 0 0 "[ . 1 . 2]" 1
226 1 7 LEU H 1 7 LEU HG 4.030 . 4.030 3.094 3.031 3.129 . 0 0 "[ . 1 . 2]" 1
227 1 7 LEU H 1 8 SER H 4.710 . 4.710 4.432 4.421 4.447 . 0 0 "[ . 1 . 2]" 1
228 1 8 SER HA 1 21 VAL MG1 6.140 . 6.140 3.719 3.600 3.835 . 0 0 "[ . 1 . 2]" 1
229 1 8 SER HA 1 21 VAL H 4.410 . 4.410 2.930 2.655 3.130 . 0 0 "[ . 1 . 2]" 1
230 1 8 SER HA 1 22 LYS HA 3.310 . 3.310 2.235 2.017 2.601 . 0 0 "[ . 1 . 2]" 1
231 1 8 SER HA 1 22 LYS HB3 5.470 . 5.470 4.254 3.586 5.346 . 0 0 "[ . 1 . 2]" 1
232 1 8 SER HA 1 22 LYS HB2 5.470 . 5.470 4.430 4.146 4.950 . 0 0 "[ . 1 . 2]" 1
233 1 8 SER HA 1 22 LYS QB 5.630 . 5.630 3.830 3.408 4.563 . 0 0 "[ . 1 . 2]" 1
234 1 8 SER HA 1 22 LYS QD 6.210 . 6.210 5.533 5.272 5.572 . 0 0 "[ . 1 . 2]" 1
235 1 8 SER HA 1 22 LYS QG 6.110 . 6.110 4.446 3.623 4.896 . 0 0 "[ . 1 . 2]" 1
236 1 8 SER HA 1 22 LYS H 4.270 . 4.270 3.731 3.584 3.970 . 0 0 "[ . 1 . 2]" 1
237 1 8 SER HA 1 23 LYS QG 6.380 . 6.380 4.326 4.038 4.591 . 0 0 "[ . 1 . 2]" 1
238 1 8 SER HA 1 23 LYS H 3.600 . 3.600 3.397 3.294 3.580 . 0 0 "[ . 1 . 2]" 1
239 1 8 SER HA 1 9 LEU QD 6.800 . 6.800 2.943 2.702 3.569 . 0 0 "[ . 1 . 2]" 1
240 1 8 SER HA 1 9 LEU H 3.340 . 3.340 2.159 2.121 2.211 . 0 0 "[ . 1 . 2]" 1
241 1 8 SER HB3 1 20 TRP HB3 4.810 . 4.810 2.093 1.880 3.197 . 0 0 "[ . 1 . 2]" 1
242 1 8 SER HB3 1 20 TRP HB2 4.990 . 4.990 3.755 3.533 4.676 . 0 0 "[ . 1 . 2]" 1
243 1 8 SER HB3 1 21 VAL H 4.620 . 4.620 3.282 2.979 4.244 . 0 0 "[ . 1 . 2]" 1
244 1 8 SER HB3 1 22 LYS H 5.500 . 5.500 5.168 3.607 5.527 0.027 2 0 "[ . 1 . 2]" 1
245 1 8 SER HB3 1 96 LEU HB3 5.500 . 5.500 2.174 1.927 3.396 . 0 0 "[ . 1 . 2]" 1
246 1 8 SER HB3 1 96 LEU HB2 5.500 . 5.500 3.728 3.488 5.043 . 0 0 "[ . 1 . 2]" 1
247 1 8 SER HB3 1 96 LEU H 4.960 . 4.960 3.475 3.227 4.589 . 0 0 "[ . 1 . 2]" 1
248 1 8 SER HB3 1 9 LEU H 4.590 . 4.590 3.347 3.015 4.359 . 0 0 "[ . 1 . 2]" 1
249 1 8 SER HB2 1 20 TRP HB3 4.810 . 4.810 2.955 1.922 3.262 . 0 0 "[ . 1 . 2]" 1
250 1 8 SER HB2 1 20 TRP HB2 4.990 . 4.990 4.437 3.340 4.810 . 0 0 "[ . 1 . 2]" 1
251 1 8 SER HB2 1 21 VAL H 4.620 . 4.620 4.216 2.707 4.626 0.006 9 0 "[ . 1 . 2]" 1
252 1 8 SER HB2 1 22 LYS H 5.500 . 5.500 5.219 4.167 5.533 0.033 14 0 "[ . 1 . 2]" 1
253 1 8 SER HB2 1 96 LEU HB3 5.500 . 5.500 2.125 1.950 3.305 . 0 0 "[ . 1 . 2]" 1
254 1 8 SER HB2 1 96 LEU HB2 5.500 . 5.500 3.792 3.481 4.858 . 0 0 "[ . 1 . 2]" 1
255 1 8 SER HB2 1 96 LEU H 4.960 . 4.960 3.339 3.098 4.516 . 0 0 "[ . 1 . 2]" 1
256 1 8 SER HB2 1 9 LEU H 4.590 . 4.590 4.106 3.158 4.380 . 0 0 "[ . 1 . 2]" 1
257 1 8 SER QB 1 20 TRP HA 5.310 . 5.310 3.433 3.188 3.711 . 0 0 "[ . 1 . 2]" 1
258 1 8 SER QB 1 20 TRP HB3 5.090 . 5.090 1.932 1.856 2.055 . 0 0 "[ . 1 . 2]" 1
259 1 8 SER QB 1 20 TRP HB2 5.230 . 5.230 3.487 3.253 3.681 . 0 0 "[ . 1 . 2]" 1
260 1 8 SER QB 1 21 VAL H 4.870 . 4.870 3.055 2.678 3.219 . 0 0 "[ . 1 . 2]" 1
261 1 8 SER QB 1 22 LYS H 5.530 . 5.530 4.561 3.549 4.923 . 0 0 "[ . 1 . 2]" 1
262 1 8 SER QB 1 23 LYS H 6.160 . 6.160 5.284 4.990 5.427 . 0 0 "[ . 1 . 2]" 1
263 1 8 SER QB 1 96 LEU QB 5.780 . 5.780 1.820 1.762 1.933 0.038 17 0 "[ . 1 . 2]" 1
264 1 8 SER QB 1 96 LEU QD 6.900 . 6.900 1.993 1.883 2.224 . 0 0 "[ . 1 . 2]" 1
265 1 8 SER QB 1 96 LEU HG 5.730 . 5.730 3.014 2.741 3.686 . 0 0 "[ . 1 . 2]" 1
266 1 8 SER QB 1 96 LEU H 5.030 . 5.030 2.974 2.832 3.265 . 0 0 "[ . 1 . 2]" 1
267 1 8 SER QB 1 9 LEU H 4.830 . 4.830 3.130 2.889 3.320 . 0 0 "[ . 1 . 2]" 1
268 1 8 SER H 1 22 LYS HA 4.810 . 4.810 3.795 3.618 4.098 . 0 0 "[ . 1 . 2]" 1
269 1 8 SER H 1 23 LYS H 4.990 . 4.990 4.808 4.712 4.849 . 0 0 "[ . 1 . 2]" 1
270 1 8 SER H 1 25 VAL QG 7.540 . 7.540 5.168 5.121 5.207 . 0 0 "[ . 1 . 2]" 1
271 1 8 SER H 1 95 LEU HA 4.630 . 4.630 3.963 3.738 4.083 . 0 0 "[ . 1 . 2]" 1
272 1 8 SER H 1 95 LEU MD1 6.520 . 6.520 5.372 5.344 5.405 . 0 0 "[ . 1 . 2]" 1
273 1 8 SER H 1 95 LEU MD2 6.520 . 6.520 4.231 4.037 4.407 . 0 0 "[ . 1 . 2]" 1
274 1 8 SER H 1 95 LEU QD 6.560 . 6.560 4.082 3.927 4.212 . 0 0 "[ . 1 . 2]" 1
275 1 8 SER H 1 96 LEU HA 5.190 . 5.190 4.426 4.318 4.495 . 0 0 "[ . 1 . 2]" 1
276 1 8 SER H 1 96 LEU QB 5.000 . 5.000 3.152 2.856 3.300 . 0 0 "[ . 1 . 2]" 1
277 1 8 SER H 1 96 LEU QD 6.360 . 6.360 3.952 3.521 4.118 . 0 0 "[ . 1 . 2]" 1
278 1 8 SER H 1 96 LEU H 4.140 . 4.140 2.714 2.443 2.920 . 0 0 "[ . 1 . 2]" 1
279 1 8 SER H 1 9 LEU H 4.880 . 4.880 4.537 4.489 4.570 . 0 0 "[ . 1 . 2]" 1
280 1 9 LEU HA 1 10 PRO HG3 4.730 . 4.730 4.556 4.087 4.610 . 0 0 "[ . 1 . 2]" 1
281 1 9 LEU HA 1 10 PRO HG2 4.730 . 4.730 4.510 4.404 4.719 . 0 0 "[ . 1 . 2]" 1
282 1 9 LEU HA 1 93 LEU QD 7.540 . 7.540 4.635 4.283 4.903 . 0 0 "[ . 1 . 2]" 1
283 1 9 LEU HA 1 94 LEU H 5.500 . 5.500 5.198 4.942 5.319 . 0 0 "[ . 1 . 2]" 1
284 1 9 LEU HA 1 95 LEU QD 6.340 . 6.340 3.460 3.287 3.595 . 0 0 "[ . 1 . 2]" 1
285 1 9 LEU HA 1 96 LEU H 4.870 . 4.870 3.849 3.665 4.372 . 0 0 "[ . 1 . 2]" 1
286 1 9 LEU HB3 1 10 PRO HD3 4.950 . 4.950 3.512 2.449 3.775 . 0 0 "[ . 1 . 2]" 1
287 1 9 LEU HB3 1 10 PRO HD2 4.950 . 4.950 2.036 1.933 2.258 . 0 0 "[ . 1 . 2]" 1
288 1 9 LEU HB3 1 10 PRO QD 5.090 . 5.090 2.021 1.865 2.242 . 0 0 "[ . 1 . 2]" 1
289 1 9 LEU HB3 1 10 PRO HG3 4.790 . 4.790 4.613 4.506 4.794 0.004 1 0 "[ . 1 . 2]" 1
290 1 9 LEU HB3 1 21 VAL MG1 4.920 . 4.920 3.985 3.781 4.109 . 0 0 "[ . 1 . 2]" 1
291 1 9 LEU HB3 1 21 VAL H 5.310 . 5.310 5.330 5.320 5.345 0.035 17 0 "[ . 1 . 2]" 1
292 1 9 LEU HB2 1 10 PRO HD3 5.240 . 5.240 4.731 3.822 4.910 . 0 0 "[ . 1 . 2]" 1
293 1 9 LEU HB2 1 10 PRO HD2 5.240 . 5.240 3.571 3.279 3.759 . 0 0 "[ . 1 . 2]" 1
294 1 9 LEU HB2 1 10 PRO QD 5.330 . 5.330 3.470 3.101 3.646 . 0 0 "[ . 1 . 2]" 1
295 1 9 LEU HB2 1 10 PRO HG2 5.500 . 5.500 5.084 4.892 5.533 0.033 5 0 "[ . 1 . 2]" 1
296 1 9 LEU HB2 1 21 VAL MG1 4.710 . 4.710 2.664 2.471 2.783 . 0 0 "[ . 1 . 2]" 1
297 1 9 LEU HB2 1 21 VAL H 4.640 . 4.640 4.140 4.082 4.212 . 0 0 "[ . 1 . 2]" 1
298 1 9 LEU MD1 1 95 LEU HA 6.480 . 6.480 4.060 3.509 4.711 . 0 0 "[ . 1 . 2]" 1
299 1 9 LEU MD2 1 95 LEU HA 6.480 . 6.480 4.285 3.492 4.707 . 0 0 "[ . 1 . 2]" 1
300 1 9 LEU QD 1 10 PRO QD 6.860 . 6.860 3.032 2.763 3.301 . 0 0 "[ . 1 . 2]" 1
301 1 9 LEU QD 1 10 PRO HG2 6.680 . 6.680 4.458 4.226 4.692 . 0 0 "[ . 1 . 2]" 1
302 1 9 LEU QD 1 23 LYS HA 7.540 . 7.540 4.254 4.085 4.517 . 0 0 "[ . 1 . 2]" 1
303 1 9 LEU QD 1 23 LYS QB 7.770 . 7.770 2.213 2.021 2.352 . 0 0 "[ . 1 . 2]" 1
304 1 9 LEU QD 1 23 LYS H 6.300 . 6.300 2.684 2.492 3.004 . 0 0 "[ . 1 . 2]" 1
305 1 9 LEU QD 1 24 TYR H 7.540 . 7.540 5.262 5.127 5.403 . 0 0 "[ . 1 . 2]" 1
306 1 9 LEU QD 1 25 VAL QG 8.190 . 8.190 2.892 2.703 3.068 . 0 0 "[ . 1 . 2]" 1
307 1 9 LEU QD 1 34 PHE HA 7.540 . 7.540 5.521 5.281 5.630 . 0 0 "[ . 1 . 2]" 1
308 1 9 LEU QD 1 48 MET ME 7.200 . 7.200 3.818 3.486 4.067 . 0 0 "[ . 1 . 2]" 1
309 1 9 LEU QD 1 93 LEU HG 6.000 . 6.000 3.617 2.925 3.802 . 0 0 "[ . 1 . 2]" 1
310 1 9 LEU QD 1 95 LEU HA 6.500 . 6.500 3.672 3.390 3.968 . 0 0 "[ . 1 . 2]" 1
311 1 9 LEU QD 1 95 LEU QD 6.860 . 6.860 2.017 1.704 2.243 0.096 5 0 "[ . 1 . 2]" 1
312 1 9 LEU HG 1 21 VAL MG1 5.900 . 5.900 4.773 4.422 4.876 . 0 0 "[ . 1 . 2]" 1
313 1 9 LEU HG 1 25 VAL QG 7.540 . 7.540 4.467 4.280 4.668 . 0 0 "[ . 1 . 2]" 1
314 1 9 LEU HG 1 95 LEU MD1 5.770 . 5.770 4.423 4.243 4.631 . 0 0 "[ . 1 . 2]" 1
315 1 9 LEU HG 1 95 LEU MD2 5.770 . 5.770 1.988 1.871 2.268 . 0 0 "[ . 1 . 2]" 1
316 1 9 LEU HG 1 95 LEU QD 5.900 . 5.900 1.985 1.869 2.262 . 0 0 "[ . 1 . 2]" 1
317 1 9 LEU H 1 20 TRP HA 4.550 . 4.550 3.580 3.365 3.873 . 0 0 "[ . 1 . 2]" 1
318 1 9 LEU H 1 20 TRP HB3 4.770 . 4.770 3.983 3.907 4.097 . 0 0 "[ . 1 . 2]" 1
319 1 9 LEU H 1 20 TRP HB2 5.500 . 5.500 5.480 5.360 5.517 0.017 17 0 "[ . 1 . 2]" 1
320 1 9 LEU H 1 21 VAL HA 4.950 . 4.950 4.429 4.360 4.471 . 0 0 "[ . 1 . 2]" 1
321 1 9 LEU H 1 21 VAL HB 4.990 . 4.990 4.676 4.456 4.857 . 0 0 "[ . 1 . 2]" 1
322 1 9 LEU H 1 21 VAL MG1 4.960 . 4.960 2.449 2.331 2.608 . 0 0 "[ . 1 . 2]" 1
323 1 9 LEU H 1 21 VAL H 3.890 . 3.890 2.043 1.947 2.150 . 0 0 "[ . 1 . 2]" 1
324 1 9 LEU H 1 22 LYS HA 4.250 . 4.250 3.997 3.775 4.272 0.022 16 0 "[ . 1 . 2]" 1
325 1 9 LEU H 1 22 LYS H 5.160 . 5.160 4.836 4.710 4.981 . 0 0 "[ . 1 . 2]" 1
326 1 9 LEU H 1 23 LYS H 4.830 . 4.830 4.411 4.196 4.836 0.006 17 0 "[ . 1 . 2]" 1
327 1 9 LEU H 1 96 LEU QD 7.540 . 7.540 4.975 4.711 5.269 . 0 0 "[ . 1 . 2]" 1
328 1 9 LEU H 1 9 LEU HB3 3.970 . 3.970 3.771 3.720 3.829 . 0 0 "[ . 1 . 2]" 1
329 1 9 LEU H 1 9 LEU HB2 3.670 . 3.670 2.646 2.555 2.756 . 0 0 "[ . 1 . 2]" 1
330 1 9 LEU H 1 9 LEU HG 4.420 . 4.420 3.617 3.116 3.856 . 0 0 "[ . 1 . 2]" 1
331 1 10 PRO HA 1 11 VAL QG 7.330 . 7.330 3.797 3.368 4.072 . 0 0 "[ . 1 . 2]" 1
332 1 10 PRO HA 1 11 VAL H 2.970 . 2.970 2.201 2.161 2.334 . 0 0 "[ . 1 . 2]" 1
333 1 10 PRO HA 1 20 TRP HA 3.870 . 3.870 3.564 3.270 3.784 . 0 0 "[ . 1 . 2]" 1
334 1 10 PRO HA 1 21 VAL H 5.010 . 5.010 5.031 5.020 5.043 0.033 18 0 "[ . 1 . 2]" 1
335 1 10 PRO HB3 1 11 VAL H 4.320 . 4.320 4.257 4.153 4.337 0.017 6 0 "[ . 1 . 2]" 1
336 1 10 PRO HB2 1 11 VAL H 4.320 . 4.320 3.992 3.859 4.299 . 0 0 "[ . 1 . 2]" 1
337 1 10 PRO QB 1 11 VAL H 4.570 . 4.570 3.660 3.552 3.838 . 0 0 "[ . 1 . 2]" 1
338 1 10 PRO QB 1 19 GLY H 6.220 . 6.220 5.319 4.816 5.601 . 0 0 "[ . 1 . 2]" 1
339 1 10 PRO QD 1 11 VAL H 5.850 . 5.850 4.778 4.538 4.864 . 0 0 "[ . 1 . 2]" 1
340 1 10 PRO QD 1 94 LEU H 5.800 . 5.800 3.796 3.550 3.977 . 0 0 "[ . 1 . 2]" 1
341 1 10 PRO HG2 1 94 LEU H 5.220 . 5.220 5.153 4.822 5.229 0.009 17 0 "[ . 1 . 2]" 1
342 1 11 VAL HA 1 12 ARG H 3.020 . 3.020 2.371 2.137 2.637 . 0 0 "[ . 1 . 2]" 1
343 1 11 VAL HA 1 13 ASN H 5.500 . 5.500 5.247 3.977 5.529 0.029 9 0 "[ . 1 . 2]" 1
344 1 11 VAL HA 1 21 VAL MG1 5.310 . 5.310 3.775 2.826 4.298 . 0 0 "[ . 1 . 2]" 1
345 1 11 VAL HB 1 12 ARG H 4.400 . 4.400 3.712 2.088 4.409 0.009 7 0 "[ . 1 . 2]" 1
346 1 11 VAL HB 1 18 PHE HA 5.500 . 5.500 5.314 4.146 5.559 0.059 11 0 "[ . 1 . 2]" 1
347 1 11 VAL HB 1 18 PHE QB 6.380 . 6.380 5.300 4.773 5.729 . 0 0 "[ . 1 . 2]" 1
348 1 11 VAL HB 1 21 VAL MG2 5.730 . 5.730 4.246 3.743 4.733 . 0 0 "[ . 1 . 2]" 1
349 1 11 VAL MG1 1 13 ASN HD21 6.520 . 6.520 3.102 1.992 4.883 . 0 0 "[ . 1 . 2]" 1
350 1 11 VAL MG1 1 13 ASN HD22 6.150 . 6.150 3.005 1.965 5.128 . 0 0 "[ . 1 . 2]" 1
351 1 11 VAL MG1 1 13 ASN H 6.440 . 6.440 3.451 2.596 5.406 . 0 0 "[ . 1 . 2]" 1
352 1 11 VAL MG1 1 18 PHE HA 6.520 . 6.520 3.778 2.821 5.501 . 0 0 "[ . 1 . 2]" 1
353 1 11 VAL MG1 1 18 PHE QB 7.360 . 7.360 4.247 3.705 5.526 . 0 0 "[ . 1 . 2]" 1
354 1 11 VAL MG1 1 21 VAL MG1 5.660 . 5.660 2.930 1.698 3.821 0.102 13 0 "[ . 1 . 2]" 1
355 1 11 VAL MG2 1 13 ASN HD21 6.520 . 6.520 3.925 2.743 4.884 . 0 0 "[ . 1 . 2]" 1
356 1 11 VAL MG2 1 13 ASN HD22 6.150 . 6.150 3.958 2.018 4.986 . 0 0 "[ . 1 . 2]" 1
357 1 11 VAL MG2 1 13 ASN H 6.440 . 6.440 3.947 3.259 4.502 . 0 0 "[ . 1 . 2]" 1
358 1 11 VAL MG2 1 18 PHE HA 6.520 . 6.520 4.578 3.697 5.114 . 0 0 "[ . 1 . 2]" 1
359 1 11 VAL MG2 1 18 PHE QB 7.360 . 7.360 4.907 4.043 5.284 . 0 0 "[ . 1 . 2]" 1
360 1 11 VAL MG2 1 21 VAL MG1 5.660 . 5.660 2.566 1.929 3.229 . 0 0 "[ . 1 . 2]" 1
361 1 11 VAL QG 1 12 ARG QD 8.420 . 8.420 4.815 3.810 5.509 . 0 0 "[ . 1 . 2]" 1
362 1 11 VAL QG 1 12 ARG QG 6.540 . 6.540 3.935 3.269 4.281 . 0 0 "[ . 1 . 2]" 1
363 1 11 VAL QG 1 12 ARG H 5.480 . 5.480 2.369 1.804 3.118 . 0 0 "[ . 1 . 2]" 1
364 1 11 VAL QG 1 13 ASN HD22 6.590 . 6.590 2.589 1.959 3.434 . 0 0 "[ . 1 . 2]" 1
365 1 11 VAL QG 1 13 ASN H 6.700 . 6.700 3.164 2.563 3.962 . 0 0 "[ . 1 . 2]" 1
366 1 11 VAL QG 1 18 PHE QB 7.750 . 7.750 3.862 3.607 4.270 . 0 0 "[ . 1 . 2]" 1
367 1 11 VAL QG 1 19 GLY HA3 6.650 . 6.650 2.994 2.463 3.717 . 0 0 "[ . 1 . 2]" 1
368 1 11 VAL QG 1 19 GLY HA2 6.740 . 6.740 3.887 3.467 4.425 . 0 0 "[ . 1 . 2]" 1
369 1 11 VAL QG 1 19 GLY H 5.460 . 5.460 2.238 1.787 2.861 0.013 11 0 "[ . 1 . 2]" 1
370 1 11 VAL QG 1 20 TRP HA 6.020 . 6.020 3.072 2.277 3.504 . 0 0 "[ . 1 . 2]" 1
371 1 11 VAL QG 1 20 TRP H 5.490 . 5.490 2.780 2.413 3.201 . 0 0 "[ . 1 . 2]" 1
372 1 11 VAL QG 1 21 VAL HA 6.140 . 6.140 3.915 3.357 4.422 . 0 0 "[ . 1 . 2]" 1
373 1 11 VAL QG 1 21 VAL HB 5.320 . 5.320 2.258 1.807 2.862 . 0 0 "[ . 1 . 2]" 1
374 1 11 VAL QG 1 21 VAL MG1 5.920 . 5.920 2.285 1.593 2.705 0.207 13 0 "[ . 1 . 2]" 1
375 1 11 VAL QG 1 21 VAL H 5.900 . 5.900 3.592 2.597 4.135 . 0 0 "[ . 1 . 2]" 1
376 1 11 VAL H 1 11 VAL HB 3.680 . 3.680 2.896 2.400 3.612 . 0 0 "[ . 1 . 2]" 1
377 1 11 VAL H 1 12 ARG H 4.650 . 4.650 4.442 4.159 4.596 . 0 0 "[ . 1 . 2]" 1
378 1 11 VAL H 1 18 PHE HA 5.500 . 5.500 4.068 3.284 5.020 . 0 0 "[ . 1 . 2]" 1
379 1 11 VAL H 1 19 GLY H 3.830 . 3.830 3.104 2.681 3.508 . 0 0 "[ . 1 . 2]" 1
380 1 11 VAL H 1 20 TRP HA 3.880 . 3.880 3.165 2.797 3.596 . 0 0 "[ . 1 . 2]" 1
381 1 11 VAL H 1 21 VAL HB 5.500 . 5.500 4.987 4.512 5.329 . 0 0 "[ . 1 . 2]" 1
382 1 11 VAL H 1 21 VAL MG1 5.100 . 5.100 3.886 3.273 4.101 . 0 0 "[ . 1 . 2]" 1
383 1 11 VAL H 1 21 VAL H 4.800 . 4.800 4.421 3.696 4.809 0.009 10 0 "[ . 1 . 2]" 1
384 1 12 ARG HA 1 13 ASN HD21 4.980 . 4.980 3.755 3.456 3.948 . 0 0 "[ . 1 . 2]" 1
385 1 12 ARG HA 1 13 ASN H 3.150 . 3.150 2.367 2.162 3.164 0.014 19 0 "[ . 1 . 2]" 1
386 1 12 ARG HA 1 14 ASN H 4.890 . 4.890 4.181 3.350 4.874 . 0 0 "[ . 1 . 2]" 1
387 1 12 ARG HA 1 18 PHE HA 3.950 . 3.950 2.347 1.974 2.755 . 0 0 "[ . 1 . 2]" 1
388 1 12 ARG HA 1 19 GLY H 3.820 . 3.820 3.795 3.475 3.870 0.050 9 0 "[ . 1 . 2]" 1
389 1 12 ARG HB3 1 13 ASN H 4.550 . 4.550 4.070 3.758 4.564 0.014 14 0 "[ . 1 . 2]" 1
390 1 12 ARG HB3 1 18 PHE HA 5.500 . 5.500 4.677 4.025 5.227 . 0 0 "[ . 1 . 2]" 1
391 1 12 ARG HB2 1 13 ASN H 4.550 . 4.550 4.350 3.750 4.562 0.012 20 0 "[ . 1 . 2]" 1
392 1 12 ARG HB2 1 18 PHE HA 5.500 . 5.500 5.143 4.326 5.528 0.028 18 0 "[ . 1 . 2]" 1
393 1 12 ARG QB 1 15 THR H 6.220 . 6.220 3.811 2.637 4.847 . 0 0 "[ . 1 . 2]" 1
394 1 12 ARG QG 1 13 ASN HD21 6.380 . 6.380 5.608 5.068 5.733 . 0 0 "[ . 1 . 2]" 1
395 1 12 ARG QG 1 13 ASN H 5.410 . 5.410 4.351 3.376 4.563 . 0 0 "[ . 1 . 2]" 1
396 1 12 ARG QG 1 18 PHE HA 5.820 . 5.820 3.845 3.178 4.816 . 0 0 "[ . 1 . 2]" 1
397 1 12 ARG QG 1 19 GLY H 6.380 . 6.380 5.174 4.629 5.743 . 0 0 "[ . 1 . 2]" 1
398 1 12 ARG H 1 12 ARG HB3 3.930 . 3.930 3.649 2.753 3.889 . 0 0 "[ . 1 . 2]" 1
399 1 12 ARG H 1 12 ARG HB2 3.930 . 3.930 2.758 2.511 3.748 . 0 0 "[ . 1 . 2]" 1
400 1 12 ARG H 1 12 ARG QD 5.790 . 5.790 3.885 3.036 4.506 . 0 0 "[ . 1 . 2]" 1
401 1 12 ARG H 1 12 ARG QG 4.600 . 4.600 2.651 1.915 3.577 . 0 0 "[ . 1 . 2]" 1
402 1 12 ARG H 1 18 PHE HA 5.500 . 5.500 4.131 3.492 4.615 . 0 0 "[ . 1 . 2]" 1
403 1 12 ARG H 1 19 GLY H 5.210 . 5.210 4.725 4.458 5.014 . 0 0 "[ . 1 . 2]" 1
404 1 13 ASN HA 1 13 ASN HD21 4.080 . 4.080 3.250 2.489 3.718 . 0 0 "[ . 1 . 2]" 1
405 1 13 ASN HA 1 13 ASN HD22 4.690 . 4.690 3.923 3.500 4.217 . 0 0 "[ . 1 . 2]" 1
406 1 13 ASN HB3 1 14 ASN H 4.110 . 4.110 2.976 2.301 3.780 . 0 0 "[ . 1 . 2]" 1
407 1 13 ASN HB2 1 14 ASN H 4.110 . 4.110 2.417 1.999 2.936 . 0 0 "[ . 1 . 2]" 1
408 1 13 ASN QB 1 14 ASN H 4.390 . 4.390 2.307 1.953 2.840 . 0 0 "[ . 1 . 2]" 1
409 1 13 ASN HD21 1 14 ASN H 4.980 . 4.980 4.279 3.956 4.545 . 0 0 "[ . 1 . 2]" 1
410 1 13 ASN HD21 1 18 PHE HA 4.430 . 4.430 3.191 2.149 4.017 . 0 0 "[ . 1 . 2]" 1
411 1 13 ASN HD21 1 19 GLY HA3 5.500 . 5.500 3.674 2.802 4.648 . 0 0 "[ . 1 . 2]" 1
412 1 13 ASN HD21 1 19 GLY HA2 5.500 . 5.500 4.801 4.094 5.509 0.009 4 0 "[ . 1 . 2]" 1
413 1 13 ASN HD22 1 19 GLY HA3 5.500 . 5.500 3.054 1.994 3.829 . 0 0 "[ . 1 . 2]" 1
414 1 13 ASN HD22 1 19 GLY HA2 5.500 . 5.500 4.600 3.547 5.447 . 0 0 "[ . 1 . 2]" 1
415 1 13 ASN H 1 13 ASN HB3 4.000 . 4.000 3.629 3.481 4.051 0.051 19 0 "[ . 1 . 2]" 1
416 1 13 ASN H 1 13 ASN HB2 4.000 . 4.000 2.474 2.171 3.324 . 0 0 "[ . 1 . 2]" 1
417 1 13 ASN H 1 13 ASN HD21 4.480 . 4.480 2.061 1.961 2.347 . 0 0 "[ . 1 . 2]" 1
418 1 13 ASN H 1 13 ASN HD22 4.480 . 4.480 3.596 3.237 4.022 . 0 0 "[ . 1 . 2]" 1
419 1 13 ASN H 1 19 GLY H 5.390 . 5.390 3.563 2.914 4.718 . 0 0 "[ . 1 . 2]" 1
420 1 14 ASN QB 1 15 THR H 5.000 . 5.000 2.729 1.918 3.992 . 0 0 "[ . 1 . 2]" 1
421 1 14 ASN HD21 1 17 LYS QB 4.880 . 4.880 3.479 2.049 4.347 . 0 0 "[ . 1 . 2]" 1
422 1 14 ASN HD22 1 17 LYS QB 4.880 . 4.880 2.823 1.933 4.370 . 0 0 "[ . 1 . 2]" 1
423 1 14 ASN QD 1 15 THR MG 7.210 . 7.210 3.860 1.934 5.261 . 0 0 "[ . 1 . 2]" 1
424 1 14 ASN QD 1 16 LYS QB 7.080 . 7.080 3.967 1.857 5.377 . 0 0 "[ . 1 . 2]" 1
425 1 14 ASN QD 1 16 LYS H 5.930 . 5.930 3.440 2.222 4.870 . 0 0 "[ . 1 . 2]" 1
426 1 14 ASN QD 1 17 LYS QB 5.210 . 5.210 2.485 1.921 3.260 . 0 0 "[ . 1 . 2]" 1
427 1 14 ASN QD 1 17 LYS QG 7.090 . 7.090 3.617 1.874 4.747 . 0 0 "[ . 1 . 2]" 1
428 1 14 ASN H 1 14 ASN HD21 4.590 . 4.590 3.613 2.266 4.343 . 0 0 "[ . 1 . 2]" 1
429 1 14 ASN H 1 14 ASN HD22 4.590 . 4.590 3.818 2.876 4.594 0.004 4 0 "[ . 1 . 2]" 1
430 1 14 ASN H 1 14 ASN QD 4.890 . 4.890 3.266 2.186 3.900 . 0 0 "[ . 1 . 2]" 1
431 1 14 ASN H 1 15 THR H 4.110 . 4.110 2.567 2.232 3.066 . 0 0 "[ . 1 . 2]" 1
432 1 15 THR MG 1 16 LYS H 5.170 . 5.170 2.747 1.896 4.269 . 0 0 "[ . 1 . 2]" 1
433 1 15 THR H 1 15 THR HB 4.040 . 4.040 3.753 3.464 3.978 . 0 0 "[ . 1 . 2]" 1
434 1 15 THR H 1 15 THR MG 4.490 . 4.490 2.826 2.092 3.748 . 0 0 "[ . 1 . 2]" 1
435 1 15 THR H 1 16 LYS HA 5.500 . 5.500 4.555 4.322 5.386 . 0 0 "[ . 1 . 2]" 1
436 1 15 THR H 1 16 LYS QG 6.380 . 6.380 5.084 3.497 5.705 . 0 0 "[ . 1 . 2]" 1
437 1 16 LYS HA 1 16 LYS QD 4.660 . 4.660 3.732 2.217 4.166 . 0 0 "[ . 1 . 2]" 1
438 1 16 LYS HA 1 16 LYS QE 5.400 . 5.400 3.722 1.981 4.896 . 0 0 "[ . 1 . 2]" 1
439 1 16 LYS HA 1 16 LYS HG3 3.880 . 3.880 3.059 2.026 3.897 0.017 12 0 "[ . 1 . 2]" 1
440 1 16 LYS HA 1 16 LYS HG2 3.880 . 3.880 2.544 2.143 3.463 . 0 0 "[ . 1 . 2]" 1
441 1 16 LYS QB 1 17 LYS H 4.770 . 4.770 2.994 2.038 3.814 . 0 0 "[ . 1 . 2]" 1
442 1 16 LYS QE 1 17 LYS H 6.380 . 6.380 5.074 4.214 5.670 . 0 0 "[ . 1 . 2]" 1
443 1 16 LYS H 1 16 LYS QE 5.960 . 5.960 4.421 2.685 5.289 . 0 0 "[ . 1 . 2]" 1
444 1 16 LYS H 1 16 LYS QG 4.570 . 4.570 3.263 1.883 3.973 . 0 0 "[ . 1 . 2]" 1
445 1 16 LYS H 1 17 LYS H 3.660 . 3.660 2.352 2.001 2.870 . 0 0 "[ . 1 . 2]" 1
446 1 17 LYS HA 1 17 LYS QD 4.820 . 4.820 3.202 1.959 4.131 . 0 0 "[ . 1 . 2]" 1
447 1 17 LYS HA 1 17 LYS QE 5.540 . 5.540 3.538 1.991 4.954 . 0 0 "[ . 1 . 2]" 1
448 1 17 LYS HA 1 18 PHE H 3.350 . 3.350 2.350 2.135 2.752 . 0 0 "[ . 1 . 2]" 1
449 1 17 LYS QB 1 18 PHE H 5.270 . 5.270 3.105 2.238 3.888 . 0 0 "[ . 1 . 2]" 1
450 1 17 LYS QD 1 18 PHE HA 6.380 . 6.380 4.672 3.464 5.740 . 0 0 "[ . 1 . 2]" 1
451 1 17 LYS QD 1 18 PHE H 5.470 . 5.470 3.083 1.982 4.787 . 0 0 "[ . 1 . 2]" 1
452 1 17 LYS QE 1 18 PHE H 6.070 . 6.070 2.984 1.903 5.031 . 0 0 "[ . 1 . 2]" 1
453 1 17 LYS QE 1 19 GLY H 6.380 . 6.380 4.584 2.468 5.559 . 0 0 "[ . 1 . 2]" 1
454 1 17 LYS QG 1 18 PHE HA 6.380 . 6.380 4.971 3.576 5.622 . 0 0 "[ . 1 . 2]" 1
455 1 17 LYS QG 1 18 PHE H 5.320 . 5.320 3.018 1.945 4.282 . 0 0 "[ . 1 . 2]" 1
456 1 17 LYS H 1 17 LYS QE 6.380 . 6.380 5.152 4.160 5.713 . 0 0 "[ . 1 . 2]" 1
457 1 17 LYS H 1 18 PHE H 4.570 . 4.570 4.421 3.920 4.606 0.036 1 0 "[ . 1 . 2]" 1
458 1 18 PHE HA 1 19 GLY H 2.890 . 2.890 2.205 2.115 2.585 . 0 0 "[ . 1 . 2]" 1
459 1 18 PHE QB 1 19 GLY H 4.160 . 4.160 3.165 2.030 3.668 . 0 0 "[ . 1 . 2]" 1
460 1 18 PHE H 1 19 GLY H 4.790 . 4.790 4.159 3.463 4.413 . 0 0 "[ . 1 . 2]" 1
461 1 19 GLY HA3 1 20 TRP H 2.800 . 2.800 2.149 2.137 2.189 . 0 0 "[ . 1 . 2]" 1
462 1 19 GLY HA2 1 20 TRP HE1 5.350 . 5.350 4.785 4.633 5.004 . 0 0 "[ . 1 . 2]" 1
463 1 19 GLY HA2 1 20 TRP H 3.300 . 3.300 3.228 3.079 3.312 0.012 2 0 "[ . 1 . 2]" 1
464 1 19 GLY H 1 20 TRP HA 4.950 . 4.950 4.827 4.479 4.972 0.022 18 0 "[ . 1 . 2]" 1
465 1 20 TRP HA 1 21 VAL MG1 5.920 . 5.920 3.579 3.447 3.737 . 0 0 "[ . 1 . 2]" 1
466 1 20 TRP HA 1 21 VAL MG2 6.520 . 6.520 5.416 5.383 5.437 . 0 0 "[ . 1 . 2]" 1
467 1 20 TRP HA 1 21 VAL H 3.180 . 3.180 2.229 2.144 2.341 . 0 0 "[ . 1 . 2]" 1
468 1 20 TRP HB3 1 20 TRP HE1 5.150 . 5.150 5.161 5.153 5.168 0.018 4 0 "[ . 1 . 2]" 1
469 1 20 TRP HB3 1 21 VAL H 3.970 . 3.970 2.813 2.557 3.109 . 0 0 "[ . 1 . 2]" 1
470 1 20 TRP HB3 1 22 LYS H 5.450 . 5.450 5.009 4.858 5.193 . 0 0 "[ . 1 . 2]" 1
471 1 20 TRP HB3 1 96 LEU QD 7.180 . 7.180 2.426 2.059 2.983 . 0 0 "[ . 1 . 2]" 1
472 1 20 TRP HB2 1 21 VAL H 4.230 . 4.230 3.875 3.665 4.107 . 0 0 "[ . 1 . 2]" 1
473 1 20 TRP HB2 1 22 LYS H 5.500 . 5.500 5.552 5.533 5.589 0.089 1 0 "[ . 1 . 2]" 1
474 1 20 TRP HB2 1 96 LEU QD 7.090 . 7.090 3.076 2.737 3.556 . 0 0 "[ . 1 . 2]" 1
475 1 20 TRP HE1 1 69 ALA HA 4.870 . 4.870 3.295 2.445 3.923 . 0 0 "[ . 1 . 2]" 1
476 1 20 TRP HE1 1 69 ALA MB 5.520 . 5.520 3.191 2.649 3.737 . 0 0 "[ . 1 . 2]" 1
477 1 20 TRP HE1 1 70 ASP QB 6.080 . 6.080 5.125 4.177 5.451 . 0 0 "[ . 1 . 2]" 1
478 1 20 TRP HE1 1 73 GLU QB 6.220 . 6.220 3.910 3.603 4.154 . 0 0 "[ . 1 . 2]" 1
479 1 20 TRP HE1 1 73 GLU HG3 5.500 . 5.500 3.750 3.188 4.819 . 0 0 "[ . 1 . 2]" 1
480 1 20 TRP HE1 1 77 ILE MD 4.900 . 4.900 3.921 3.811 4.006 . 0 0 "[ . 1 . 2]" 1
481 1 20 TRP HE1 1 96 LEU MD1 5.380 . 5.380 3.994 3.745 4.188 . 0 0 "[ . 1 . 2]" 1
482 1 20 TRP HE1 1 96 LEU MD2 5.380 . 5.380 3.268 2.814 4.246 . 0 0 "[ . 1 . 2]" 1
483 1 20 TRP HE1 1 96 LEU QD 5.570 . 5.570 3.112 2.751 3.680 . 0 0 "[ . 1 . 2]" 1
484 1 20 TRP H 1 20 TRP HB3 3.960 . 3.960 3.899 3.790 3.943 . 0 0 "[ . 1 . 2]" 1
485 1 20 TRP H 1 20 TRP HB2 3.020 . 3.020 2.863 2.671 2.950 . 0 0 "[ . 1 . 2]" 1
486 1 20 TRP H 1 21 VAL H 4.490 . 4.490 4.338 4.198 4.462 . 0 0 "[ . 1 . 2]" 1
487 1 21 VAL HA 1 22 LYS H 2.540 . 2.540 2.180 2.160 2.207 . 0 0 "[ . 1 . 2]" 1
488 1 21 VAL MG1 1 22 LYS HA 5.950 . 5.950 4.305 4.136 4.369 . 0 0 "[ . 1 . 2]" 1
489 1 21 VAL MG1 1 23 LYS HA 6.520 . 6.520 4.812 4.578 5.205 . 0 0 "[ . 1 . 2]" 1
490 1 21 VAL MG2 1 22 LYS HA 5.530 . 5.530 4.259 4.144 4.304 . 0 0 "[ . 1 . 2]" 1
491 1 21 VAL MG2 1 22 LYS QB 6.980 . 6.980 4.396 3.954 4.643 . 0 0 "[ . 1 . 2]" 1
492 1 21 VAL MG2 1 22 LYS H 4.040 . 4.040 2.905 2.739 3.101 . 0 0 "[ . 1 . 2]" 1
493 1 21 VAL MG2 1 23 LYS HA 5.820 . 5.820 4.124 4.008 4.351 . 0 0 "[ . 1 . 2]" 1
494 1 21 VAL MG2 1 23 LYS QG 5.690 . 5.690 2.802 2.596 3.261 . 0 0 "[ . 1 . 2]" 1
495 1 21 VAL MG2 1 23 LYS H 5.760 . 5.760 4.369 4.233 4.648 . 0 0 "[ . 1 . 2]" 1
496 1 21 VAL H 1 21 VAL HB 3.700 . 3.700 3.323 3.225 3.411 . 0 0 "[ . 1 . 2]" 1
497 1 21 VAL H 1 21 VAL MG1 4.260 . 4.260 2.229 2.040 2.466 . 0 0 "[ . 1 . 2]" 1
498 1 21 VAL H 1 22 LYS H 4.240 . 4.240 4.026 3.964 4.092 . 0 0 "[ . 1 . 2]" 1
499 1 21 VAL H 1 96 LEU QD 7.060 . 7.060 4.599 4.540 4.796 . 0 0 "[ . 1 . 2]" 1
500 1 22 LYS HA 1 22 LYS QE 6.090 . 6.090 4.720 4.084 5.180 . 0 0 "[ . 1 . 2]" 1
501 1 22 LYS HA 1 23 LYS H 3.040 . 3.040 2.129 2.121 2.140 . 0 0 "[ . 1 . 2]" 1
502 1 22 LYS QB 1 23 LYS H 4.740 . 4.740 3.499 2.957 3.640 . 0 0 "[ . 1 . 2]" 1
503 1 22 LYS H 1 22 LYS QB 3.780 . 3.780 2.332 2.072 2.662 . 0 0 "[ . 1 . 2]" 1
504 1 22 LYS H 1 22 LYS QE 5.290 . 5.290 4.752 4.554 4.873 . 0 0 "[ . 1 . 2]" 1
505 1 22 LYS H 1 22 LYS QG 4.190 . 4.190 2.609 2.070 3.359 . 0 0 "[ . 1 . 2]" 1
506 1 22 LYS H 1 23 LYS H 4.700 . 4.700 4.388 4.365 4.544 . 0 0 "[ . 1 . 2]" 1
507 1 23 LYS HA 1 23 LYS QD 4.980 . 4.980 2.406 2.133 2.904 . 0 0 "[ . 1 . 2]" 1
508 1 23 LYS HA 1 24 TYR HB2 4.620 . 4.620 4.302 4.266 4.324 . 0 0 "[ . 1 . 2]" 1
509 1 23 LYS HA 1 24 TYR H 3.310 . 3.310 2.273 2.234 2.311 . 0 0 "[ . 1 . 2]" 1
510 1 23 LYS HA 1 36 ASP HA 4.280 . 4.280 3.508 3.054 3.803 . 0 0 "[ . 1 . 2]" 1
511 1 23 LYS HB3 1 24 TYR H 3.860 . 3.860 2.883 2.771 2.998 . 0 0 "[ . 1 . 2]" 1
512 1 23 LYS HB2 1 24 TYR H 3.860 . 3.860 3.896 3.880 3.918 0.058 8 0 "[ . 1 . 2]" 1
513 1 23 LYS QB 1 24 TYR HB2 5.670 . 5.670 4.819 4.731 4.907 . 0 0 "[ . 1 . 2]" 1
514 1 23 LYS QB 1 25 VAL QG 7.250 . 7.250 2.930 2.830 3.028 . 0 0 "[ . 1 . 2]" 1
515 1 23 LYS QB 1 35 TYR H 5.930 . 5.930 3.975 3.707 4.324 . 0 0 "[ . 1 . 2]" 1
516 1 23 LYS QD 1 24 TYR HB2 6.220 . 6.220 5.454 5.235 5.581 . 0 0 "[ . 1 . 2]" 1
517 1 23 LYS QD 1 24 TYR H 4.640 . 4.640 3.617 3.302 3.801 . 0 0 "[ . 1 . 2]" 1
518 1 23 LYS QD 1 36 ASP HA 5.140 . 5.140 2.370 1.981 2.933 . 0 0 "[ . 1 . 2]" 1
519 1 23 LYS H 1 23 LYS QG 4.510 . 4.510 2.656 2.455 2.924 . 0 0 "[ . 1 . 2]" 1
520 1 23 LYS H 1 24 TYR H 5.040 . 5.040 4.494 4.399 4.532 . 0 0 "[ . 1 . 2]" 1
521 1 23 LYS H 1 25 VAL QG 7.200 . 7.200 3.720 3.512 3.829 . 0 0 "[ . 1 . 2]" 1
522 1 24 TYR HA 1 25 VAL QG 6.710 . 6.710 3.662 3.566 3.733 . 0 0 "[ . 1 . 2]" 1
523 1 24 TYR HA 1 25 VAL H 3.090 . 3.090 2.128 2.102 2.140 . 0 0 "[ . 1 . 2]" 1
524 1 24 TYR HB3 1 25 VAL H 4.170 . 4.170 4.168 4.102 4.198 0.028 18 0 "[ . 1 . 2]" 1
525 1 24 TYR HB3 1 35 TYR H 4.810 . 4.810 3.449 3.129 3.639 . 0 0 "[ . 1 . 2]" 1
526 1 24 TYR HB3 1 37 SER H 5.500 . 5.500 4.275 3.942 4.504 . 0 0 "[ . 1 . 2]" 1
527 1 24 TYR HB2 1 25 VAL H 4.570 . 4.570 4.562 4.524 4.578 0.008 18 0 "[ . 1 . 2]" 1
528 1 24 TYR HB2 1 35 TYR H 4.940 . 4.940 4.762 4.498 4.936 . 0 0 "[ . 1 . 2]" 1
529 1 24 TYR HB2 1 36 ASP HA 4.640 . 4.640 4.482 4.048 4.648 0.008 2 0 "[ . 1 . 2]" 1
530 1 24 TYR HB2 1 37 SER H 4.900 . 4.900 4.148 3.604 4.444 . 0 0 "[ . 1 . 2]" 1
531 1 24 TYR H 1 24 TYR HB3 3.700 . 3.700 2.959 2.922 2.987 . 0 0 "[ . 1 . 2]" 1
532 1 24 TYR H 1 24 TYR HB2 3.510 . 3.510 2.257 2.220 2.304 . 0 0 "[ . 1 . 2]" 1
533 1 24 TYR H 1 25 VAL HA 5.500 . 5.500 5.381 5.312 5.466 . 0 0 "[ . 1 . 2]" 1
534 1 24 TYR H 1 25 VAL QG 7.350 . 7.350 4.308 4.213 4.357 . 0 0 "[ . 1 . 2]" 1
535 1 24 TYR H 1 25 VAL H 4.910 . 4.910 4.309 4.252 4.385 . 0 0 "[ . 1 . 2]" 1
536 1 24 TYR H 1 35 TYR HB3 5.500 . 5.500 5.068 4.602 5.502 0.002 5 0 "[ . 1 . 2]" 1
537 1 24 TYR H 1 35 TYR HB2 5.500 . 5.500 4.179 3.684 4.551 . 0 0 "[ . 1 . 2]" 1
538 1 24 TYR H 1 35 TYR H 4.320 . 4.320 4.146 3.910 4.319 . 0 0 "[ . 1 . 2]" 1
539 1 24 TYR H 1 36 ASP HA 4.820 . 4.820 3.163 2.901 3.432 . 0 0 "[ . 1 . 2]" 1
540 1 24 TYR H 1 36 ASP QB 6.220 . 6.220 5.048 4.842 5.381 . 0 0 "[ . 1 . 2]" 1
541 1 25 VAL HA 1 26 ILE H 2.990 . 2.990 2.175 2.151 2.204 . 0 0 "[ . 1 . 2]" 1
542 1 25 VAL HA 1 32 ILE MG 6.110 . 6.110 4.770 4.466 4.982 . 0 0 "[ . 1 . 2]" 1
543 1 25 VAL HA 1 33 LEU H 5.390 . 5.390 5.231 4.961 5.395 0.005 6 0 "[ . 1 . 2]" 1
544 1 25 VAL HA 1 34 PHE HA 3.830 . 3.830 2.562 2.423 2.718 . 0 0 "[ . 1 . 2]" 1
545 1 25 VAL HA 1 35 TYR H 4.460 . 4.460 3.243 3.006 3.479 . 0 0 "[ . 1 . 2]" 1
546 1 25 VAL HB 1 26 ILE H 4.570 . 4.570 4.002 3.901 4.093 . 0 0 "[ . 1 . 2]" 1
547 1 25 VAL MG1 1 34 PHE HA 6.010 . 6.010 3.290 2.973 3.601 . 0 0 "[ . 1 . 2]" 1
548 1 25 VAL MG2 1 34 PHE HA 6.010 . 6.010 3.572 3.260 3.870 . 0 0 "[ . 1 . 2]" 1
549 1 25 VAL QG 1 26 ILE H 5.210 . 5.210 2.469 2.238 2.725 . 0 0 "[ . 1 . 2]" 1
550 1 25 VAL QG 1 27 VAL HA 6.830 . 6.830 4.308 4.258 4.356 . 0 0 "[ . 1 . 2]" 1
551 1 25 VAL QG 1 27 VAL MG2 6.620 . 6.620 2.833 2.691 2.983 . 0 0 "[ . 1 . 2]" 1
552 1 25 VAL QG 1 27 VAL H 6.540 . 6.540 3.921 3.834 4.066 . 0 0 "[ . 1 . 2]" 1
553 1 25 VAL QG 1 32 ILE HA 7.330 . 7.330 4.745 4.538 4.827 . 0 0 "[ . 1 . 2]" 1
554 1 25 VAL QG 1 32 ILE MD 8.560 . 8.560 4.535 4.202 4.843 . 0 0 "[ . 1 . 2]" 1
555 1 25 VAL QG 1 32 ILE MG 6.370 . 6.370 2.759 2.520 2.895 . 0 0 "[ . 1 . 2]" 1
556 1 25 VAL QG 1 33 LEU H 6.370 . 6.370 3.967 3.724 4.147 . 0 0 "[ . 1 . 2]" 1
557 1 25 VAL QG 1 34 PHE HA 6.250 . 6.250 3.034 2.756 3.313 . 0 0 "[ . 1 . 2]" 1
558 1 25 VAL QG 1 35 TYR H 7.540 . 7.540 3.713 3.426 3.959 . 0 0 "[ . 1 . 2]" 1
559 1 25 VAL QG 1 95 LEU QD 8.000 . 8.000 2.130 2.006 2.222 . 0 0 "[ . 1 . 2]" 1
560 1 25 VAL H 1 25 VAL HB 3.550 . 3.550 2.708 2.670 2.760 . 0 0 "[ . 1 . 2]" 1
561 1 25 VAL H 1 26 ILE HG13 4.750 . 4.750 4.350 4.127 4.725 . 0 0 "[ . 1 . 2]" 1
562 1 25 VAL H 1 26 ILE H 4.530 . 4.530 4.439 4.358 4.483 . 0 0 "[ . 1 . 2]" 1
563 1 25 VAL H 1 34 PHE HA 5.430 . 5.430 5.195 5.062 5.355 . 0 0 "[ . 1 . 2]" 1
564 1 26 ILE HA 1 27 VAL MG2 5.890 . 5.890 3.552 3.457 3.673 . 0 0 "[ . 1 . 2]" 1
565 1 26 ILE HA 1 27 VAL H 3.120 . 3.120 2.136 2.130 2.160 . 0 0 "[ . 1 . 2]" 1
566 1 26 ILE HB 1 27 VAL H 4.360 . 4.360 4.174 4.150 4.204 . 0 0 "[ . 1 . 2]" 1
567 1 26 ILE HB 1 33 LEU QD 5.970 . 5.970 2.771 1.992 3.413 . 0 0 "[ . 1 . 2]" 1
568 1 26 ILE HB 1 33 LEU H 4.540 . 4.540 4.019 3.741 4.278 . 0 0 "[ . 1 . 2]" 1
569 1 26 ILE MD 1 41 LYS HE3 6.260 . 6.260 2.843 1.856 4.190 . 0 0 "[ . 1 . 2]" 1
570 1 26 ILE MD 1 41 LYS HE2 6.260 . 6.260 2.707 1.900 3.895 . 0 0 "[ . 1 . 2]" 1
571 1 26 ILE MD 1 41 LYS QE 6.260 . 6.260 2.204 1.748 3.585 0.052 2 0 "[ . 1 . 2]" 1
572 1 26 ILE HG12 1 27 VAL H 5.450 . 5.450 4.779 4.702 4.824 . 0 0 "[ . 1 . 2]" 1
573 1 26 ILE MG 1 27 VAL HA 5.590 . 5.590 4.368 4.230 4.443 . 0 0 "[ . 1 . 2]" 1
574 1 26 ILE MG 1 28 SER HA 5.400 . 5.400 4.074 3.902 4.368 . 0 0 "[ . 1 . 2]" 1
575 1 26 ILE MG 1 28 SER QB 6.080 . 6.080 4.017 3.744 4.397 . 0 0 "[ . 1 . 2]" 1
576 1 26 ILE MG 1 33 LEU QD 6.520 . 6.520 3.139 2.561 3.705 . 0 0 "[ . 1 . 2]" 1
577 1 26 ILE H 1 26 ILE HB 3.310 . 3.310 2.953 2.841 3.037 . 0 0 "[ . 1 . 2]" 1
578 1 26 ILE H 1 26 ILE HG13 4.250 . 4.250 2.670 2.497 2.751 . 0 0 "[ . 1 . 2]" 1
579 1 26 ILE H 1 26 ILE HG12 4.870 . 4.870 3.669 3.353 3.803 . 0 0 "[ . 1 . 2]" 1
580 1 26 ILE H 1 27 VAL H 4.590 . 4.590 4.096 4.039 4.211 . 0 0 "[ . 1 . 2]" 1
581 1 26 ILE H 1 33 LEU H 4.050 . 4.050 3.479 3.261 3.796 . 0 0 "[ . 1 . 2]" 1
582 1 26 ILE H 1 34 PHE HA 3.930 . 3.930 3.401 3.174 3.622 . 0 0 "[ . 1 . 2]" 1
583 1 26 ILE H 1 35 TYR H 4.880 . 4.880 4.519 4.123 4.833 . 0 0 "[ . 1 . 2]" 1
584 1 27 VAL HA 1 28 SER H 3.170 . 3.170 2.174 2.138 2.184 . 0 0 "[ . 1 . 2]" 1
585 1 27 VAL HA 1 32 ILE QG 6.220 . 6.220 3.371 3.054 3.643 . 0 0 "[ . 1 . 2]" 1
586 1 27 VAL HA 1 32 ILE MG 5.320 . 5.320 2.715 2.380 2.929 . 0 0 "[ . 1 . 2]" 1
587 1 27 VAL HA 1 52 ILE MD 5.800 . 5.800 3.874 3.478 4.201 . 0 0 "[ . 1 . 2]" 1
588 1 27 VAL HB 1 28 SER H 4.460 . 4.460 4.323 4.161 4.346 . 0 0 "[ . 1 . 2]" 1
589 1 27 VAL MG1 1 110 LEU HA 4.300 . 4.300 2.598 2.226 2.892 . 0 0 "[ . 1 . 2]" 1
590 1 27 VAL MG1 1 113 LYS QD 5.730 . 5.730 2.852 1.991 4.182 . 0 0 "[ . 1 . 2]" 1
591 1 27 VAL MG1 1 113 LYS QE 5.510 . 5.510 2.510 1.834 3.823 . 0 0 "[ . 1 . 2]" 1
592 1 27 VAL MG1 1 113 LYS QG 6.280 . 6.280 3.583 2.431 4.241 . 0 0 "[ . 1 . 2]" 1
593 1 27 VAL MG1 1 28 SER QB 7.240 . 7.240 4.440 4.260 4.765 . 0 0 "[ . 1 . 2]" 1
594 1 27 VAL MG1 1 28 SER H 4.230 . 4.230 3.077 2.762 3.195 . 0 0 "[ . 1 . 2]" 1
595 1 27 VAL MG1 1 31 LYS H 5.830 . 5.830 3.572 3.289 3.838 . 0 0 "[ . 1 . 2]" 1
596 1 27 VAL MG1 1 32 ILE MG 5.950 . 5.950 2.925 2.695 3.209 . 0 0 "[ . 1 . 2]" 1
597 1 27 VAL MG1 1 52 ILE MD 4.880 . 4.880 1.922 1.750 2.160 0.050 8 0 "[ . 1 . 2]" 1
598 1 27 VAL MG2 1 110 LEU HA 5.880 . 5.880 3.595 3.373 4.115 . 0 0 "[ . 1 . 2]" 1
599 1 27 VAL MG2 1 32 ILE MG 5.400 . 5.400 2.248 1.939 2.637 . 0 0 "[ . 1 . 2]" 1
600 1 27 VAL H 1 27 VAL HB 3.320 . 3.320 2.630 2.594 2.719 . 0 0 "[ . 1 . 2]" 1
601 1 27 VAL H 1 27 VAL MG2 3.970 . 3.970 2.179 2.036 2.325 . 0 0 "[ . 1 . 2]" 1
602 1 27 VAL H 1 28 SER H 4.500 . 4.500 4.273 4.242 4.414 . 0 0 "[ . 1 . 2]" 1
603 1 27 VAL H 1 32 ILE MG 5.680 . 5.680 4.356 4.147 4.577 . 0 0 "[ . 1 . 2]" 1
604 1 27 VAL H 1 33 LEU H 5.390 . 5.390 4.635 4.451 4.950 . 0 0 "[ . 1 . 2]" 1
605 1 28 SER HA 1 29 SER H 3.330 . 3.330 2.423 2.350 2.500 . 0 0 "[ . 1 . 2]" 1
606 1 28 SER HA 1 31 LYS H 5.380 . 5.380 4.866 4.524 5.051 . 0 0 "[ . 1 . 2]" 1
607 1 28 SER HA 1 33 LEU QD 6.410 . 6.410 3.704 3.356 4.119 . 0 0 "[ . 1 . 2]" 1
608 1 28 SER HB3 1 29 SER H 3.840 . 3.840 3.509 2.221 3.844 0.004 15 0 "[ . 1 . 2]" 1
609 1 28 SER HB3 1 33 LEU MD1 6.030 . 6.030 2.752 1.910 4.840 . 0 0 "[ . 1 . 2]" 1
610 1 28 SER HB3 1 33 LEU MD2 6.030 . 6.030 4.003 2.705 4.965 . 0 0 "[ . 1 . 2]" 1
611 1 28 SER HB3 1 33 LEU HG 5.500 . 5.500 3.916 2.987 5.355 . 0 0 "[ . 1 . 2]" 1
612 1 28 SER HB2 1 29 SER H 3.840 . 3.840 3.594 2.380 3.839 . 0 0 "[ . 1 . 2]" 1
613 1 28 SER HB2 1 33 LEU MD1 6.030 . 6.030 2.293 1.848 4.013 . 0 0 "[ . 1 . 2]" 1
614 1 28 SER HB2 1 33 LEU MD2 6.030 . 6.030 3.816 1.851 4.668 . 0 0 "[ . 1 . 2]" 1
615 1 28 SER HB2 1 33 LEU HG 5.500 . 5.500 4.001 2.774 5.228 . 0 0 "[ . 1 . 2]" 1
616 1 28 SER QB 1 29 SER H 4.190 . 4.190 3.105 2.202 3.367 . 0 0 "[ . 1 . 2]" 1
617 1 28 SER QB 1 31 LYS QD 7.040 . 7.040 4.598 3.351 5.473 . 0 0 "[ . 1 . 2]" 1
618 1 28 SER QB 1 31 LYS H 5.270 . 5.270 3.657 2.496 4.402 . 0 0 "[ . 1 . 2]" 1
619 1 28 SER QB 1 33 LEU QD 6.310 . 6.310 1.901 1.692 2.225 0.108 16 0 "[ . 1 . 2]" 1
620 1 28 SER H 1 28 SER HB3 4.030 . 4.030 2.568 2.301 3.574 . 0 0 "[ . 1 . 2]" 1
621 1 28 SER H 1 28 SER HB2 4.030 . 4.030 2.792 2.306 3.596 . 0 0 "[ . 1 . 2]" 1
622 1 28 SER H 1 29 SER H 4.730 . 4.730 4.584 4.543 4.607 . 0 0 "[ . 1 . 2]" 1
623 1 28 SER H 1 31 LYS H 4.150 . 4.150 3.959 3.436 4.154 0.004 3 0 "[ . 1 . 2]" 1
624 1 28 SER H 1 32 ILE HA 3.620 . 3.620 2.616 2.454 2.776 . 0 0 "[ . 1 . 2]" 1
625 1 28 SER H 1 32 ILE MG 5.510 . 5.510 4.181 3.870 4.367 . 0 0 "[ . 1 . 2]" 1
626 1 28 SER H 1 33 LEU H 4.400 . 4.400 3.240 2.960 3.612 . 0 0 "[ . 1 . 2]" 1
627 1 29 SER HA 1 31 LYS H 4.860 . 4.860 4.015 3.755 4.785 . 0 0 "[ . 1 . 2]" 1
628 1 29 SER HA 1 52 ILE MD 6.450 . 6.450 3.844 3.351 5.280 . 0 0 "[ . 1 . 2]" 1
629 1 29 SER QB 1 30 LYS HG3 5.370 . 5.370 3.876 3.038 4.545 . 0 0 "[ . 1 . 2]" 1
630 1 29 SER QB 1 30 LYS HG2 5.370 . 5.370 3.837 3.106 4.762 . 0 0 "[ . 1 . 2]" 1
631 1 29 SER QB 1 30 LYS QG 5.710 . 5.710 3.367 2.871 3.943 . 0 0 "[ . 1 . 2]" 1
632 1 29 SER QB 1 30 LYS H 5.270 . 5.270 3.455 2.575 3.914 . 0 0 "[ . 1 . 2]" 1
633 1 29 SER QB 1 31 LYS H 5.860 . 5.860 4.857 4.529 5.270 . 0 0 "[ . 1 . 2]" 1
634 1 29 SER H 1 30 LYS H 4.640 . 4.640 4.102 2.788 4.497 . 0 0 "[ . 1 . 2]" 1
635 1 29 SER H 1 31 LYS QB 6.380 . 6.380 4.649 4.398 5.192 . 0 0 "[ . 1 . 2]" 1
636 1 29 SER H 1 31 LYS H 4.710 . 4.710 4.536 4.323 4.718 0.008 15 0 "[ . 1 . 2]" 1
637 1 29 SER H 1 33 LEU QD 7.540 . 7.540 4.917 4.643 5.157 . 0 0 "[ . 1 . 2]" 1
638 1 30 LYS HA 1 30 LYS QD 4.770 . 4.770 2.977 2.214 3.925 . 0 0 "[ . 1 . 2]" 1
639 1 30 LYS HA 1 30 LYS QE 5.540 . 5.540 4.296 2.042 4.964 . 0 0 "[ . 1 . 2]" 1
640 1 30 LYS HA 1 52 ILE HB 4.040 . 4.040 2.501 2.300 2.662 . 0 0 "[ . 1 . 2]" 1
641 1 30 LYS HA 1 52 ILE MD 4.990 . 4.990 2.269 1.965 3.902 . 0 0 "[ . 1 . 2]" 1
642 1 30 LYS HA 1 52 ILE QG 5.430 . 5.430 3.282 2.068 3.724 . 0 0 "[ . 1 . 2]" 1
643 1 30 LYS HA 1 52 ILE MG 5.270 . 5.270 3.245 3.023 3.558 . 0 0 "[ . 1 . 2]" 1
644 1 30 LYS HA 1 52 ILE H 4.640 . 4.640 4.266 3.980 4.562 . 0 0 "[ . 1 . 2]" 1
645 1 30 LYS QB 1 31 LYS QB 5.960 . 5.960 3.777 3.630 4.484 . 0 0 "[ . 1 . 2]" 1
646 1 30 LYS QB 1 31 LYS H 5.170 . 5.170 3.844 3.775 4.068 . 0 0 "[ . 1 . 2]" 1
647 1 30 LYS QB 1 52 ILE HB 6.190 . 6.190 3.910 3.474 4.429 . 0 0 "[ . 1 . 2]" 1
648 1 30 LYS QD 1 52 ILE MD 7.240 . 7.240 4.526 3.720 5.219 . 0 0 "[ . 1 . 2]" 1
649 1 30 LYS H 1 30 LYS QD 5.750 . 5.750 4.280 3.467 5.100 . 0 0 "[ . 1 . 2]" 1
650 1 30 LYS H 1 31 LYS H 3.850 . 3.850 2.623 2.263 2.941 . 0 0 "[ . 1 . 2]" 1
651 1 30 LYS H 1 52 ILE HB 5.410 . 5.410 4.434 3.849 5.082 . 0 0 "[ . 1 . 2]" 1
652 1 30 LYS H 1 52 ILE QG 6.220 . 6.220 4.132 2.848 4.887 . 0 0 "[ . 1 . 2]" 1
653 1 30 LYS H 1 52 ILE MG 6.520 . 6.520 4.360 3.816 5.367 . 0 0 "[ . 1 . 2]" 1
654 1 31 LYS HA 1 31 LYS HE3 5.200 . 5.200 4.038 2.519 4.916 . 0 0 "[ . 1 . 2]" 1
655 1 31 LYS HA 1 31 LYS HE2 5.200 . 5.200 3.997 2.071 5.101 . 0 0 "[ . 1 . 2]" 1
656 1 31 LYS HA 1 31 LYS QE 5.270 . 5.270 3.378 2.062 4.150 . 0 0 "[ . 1 . 2]" 1
657 1 31 LYS HA 1 32 ILE MD 6.210 . 6.210 4.805 4.578 4.953 . 0 0 "[ . 1 . 2]" 1
658 1 31 LYS HA 1 32 ILE H 3.310 . 3.310 2.238 2.155 2.343 . 0 0 "[ . 1 . 2]" 1
659 1 31 LYS HA 1 49 VAL QG 6.820 . 6.820 4.461 4.099 5.062 . 0 0 "[ . 1 . 2]" 1
660 1 31 LYS HA 1 50 LEU H 5.500 . 5.500 5.301 4.974 5.504 0.004 1 0 "[ . 1 . 2]" 1
661 1 31 LYS HA 1 51 ASP HA 3.540 . 3.540 2.833 2.654 3.041 . 0 0 "[ . 1 . 2]" 1
662 1 31 LYS HA 1 51 ASP HB3 5.500 . 5.500 4.958 4.587 5.428 . 0 0 "[ . 1 . 2]" 1
663 1 31 LYS HA 1 51 ASP H 5.500 . 5.500 5.414 5.237 5.511 0.011 15 0 "[ . 1 . 2]" 1
664 1 31 LYS HA 1 52 ILE MD 5.580 . 5.580 3.549 3.359 3.770 . 0 0 "[ . 1 . 2]" 1
665 1 31 LYS HA 1 52 ILE QG 5.290 . 5.290 2.337 2.103 2.802 . 0 0 "[ . 1 . 2]" 1
666 1 31 LYS HA 1 52 ILE H 3.760 . 3.760 2.429 1.996 2.916 . 0 0 "[ . 1 . 2]" 1
667 1 31 LYS QB 1 32 ILE H 5.170 . 5.170 3.542 3.339 3.702 . 0 0 "[ . 1 . 2]" 1
668 1 31 LYS QB 1 33 LEU QD 7.070 . 7.070 3.396 2.598 3.750 . 0 0 "[ . 1 . 2]" 1
669 1 31 LYS QB 1 49 VAL QG 7.870 . 7.870 4.045 3.472 4.622 . 0 0 "[ . 1 . 2]" 1
670 1 31 LYS QD 1 49 VAL HA 6.380 . 6.380 5.078 4.386 5.470 . 0 0 "[ . 1 . 2]" 1
671 1 31 LYS QE 1 32 ILE H 5.900 . 5.900 4.274 2.935 5.135 . 0 0 "[ . 1 . 2]" 1
672 1 31 LYS QE 1 33 LEU QD 7.500 . 7.500 4.496 3.777 4.893 . 0 0 "[ . 1 . 2]" 1
673 1 31 LYS QE 1 49 VAL QG 6.450 . 6.450 3.264 2.134 4.162 . 0 0 "[ . 1 . 2]" 1
674 1 31 LYS QE 1 51 ASP HA 5.840 . 5.840 3.737 2.061 5.094 . 0 0 "[ . 1 . 2]" 1
675 1 31 LYS HG3 1 33 LEU MD1 6.220 . 6.220 4.252 2.613 5.167 . 0 0 "[ . 1 . 2]" 1
676 1 31 LYS HG3 1 33 LEU MD2 6.220 . 6.220 3.945 2.067 5.007 . 0 0 "[ . 1 . 2]" 1
677 1 31 LYS HG2 1 33 LEU MD1 6.220 . 6.220 3.700 1.969 4.960 . 0 0 "[ . 1 . 2]" 1
678 1 31 LYS HG2 1 33 LEU MD2 6.220 . 6.220 3.269 2.657 4.471 . 0 0 "[ . 1 . 2]" 1
679 1 31 LYS QG 1 32 ILE HA 6.220 . 6.220 3.937 3.740 4.359 . 0 0 "[ . 1 . 2]" 1
680 1 31 LYS QG 1 32 ILE H 4.680 . 4.680 2.261 1.948 2.852 . 0 0 "[ . 1 . 2]" 1
681 1 31 LYS QG 1 33 LEU QD 6.150 . 6.150 2.691 1.917 3.194 . 0 0 "[ . 1 . 2]" 1
682 1 31 LYS QG 1 49 VAL QG 6.340 . 6.340 2.420 1.860 2.994 . 0 0 "[ . 1 . 2]" 1
683 1 31 LYS H 1 31 LYS QE 6.380 . 6.380 5.216 4.513 5.670 . 0 0 "[ . 1 . 2]" 1
684 1 31 LYS H 1 32 ILE H 4.620 . 4.620 4.197 4.040 4.347 . 0 0 "[ . 1 . 2]" 1
685 1 31 LYS H 1 51 ASP HA 5.500 . 5.500 5.443 5.242 5.513 0.013 5 0 "[ . 1 . 2]" 1
686 1 31 LYS H 1 52 ILE MD 4.930 . 4.930 1.997 1.872 2.976 . 0 0 "[ . 1 . 2]" 1
687 1 31 LYS H 1 52 ILE QG 4.210 . 4.210 2.464 1.991 2.631 . 0 0 "[ . 1 . 2]" 1
688 1 31 LYS H 1 52 ILE H 4.660 . 4.660 4.088 3.902 4.181 . 0 0 "[ . 1 . 2]" 1
689 1 32 ILE HA 1 33 LEU QD 6.740 . 6.740 3.567 2.392 4.211 . 0 0 "[ . 1 . 2]" 1
690 1 32 ILE HA 1 33 LEU H 3.130 . 3.130 2.171 2.145 2.246 . 0 0 "[ . 1 . 2]" 1
691 1 32 ILE HA 1 52 ILE MD 6.220 . 6.220 3.804 3.324 4.154 . 0 0 "[ . 1 . 2]" 1
692 1 32 ILE HA 1 52 ILE QG 6.220 . 6.220 3.924 3.547 4.455 . 0 0 "[ . 1 . 2]" 1
693 1 32 ILE HB 1 33 LEU H 4.290 . 4.290 4.021 3.753 4.209 . 0 0 "[ . 1 . 2]" 1
694 1 32 ILE HB 1 48 MET ME 6.220 . 6.220 4.969 4.677 5.148 . 0 0 "[ . 1 . 2]" 1
695 1 32 ILE HB 1 50 LEU HA 4.890 . 4.890 4.237 4.000 4.456 . 0 0 "[ . 1 . 2]" 1
696 1 32 ILE HB 1 50 LEU HB3 4.820 . 4.820 3.717 3.092 3.992 . 0 0 "[ . 1 . 2]" 1
697 1 32 ILE HB 1 50 LEU HB2 4.820 . 4.820 2.073 1.967 2.311 . 0 0 "[ . 1 . 2]" 1
698 1 32 ILE HB 1 50 LEU QB 5.050 . 5.050 2.062 1.952 2.297 . 0 0 "[ . 1 . 2]" 1
699 1 32 ILE HB 1 50 LEU QD 6.160 . 6.160 2.322 1.865 3.487 . 0 0 "[ . 1 . 2]" 1
700 1 32 ILE HB 1 50 LEU HG 5.290 . 5.290 3.952 3.629 4.487 . 0 0 "[ . 1 . 2]" 1
701 1 32 ILE HB 1 50 LEU H 3.860 . 3.860 2.322 2.023 2.564 . 0 0 "[ . 1 . 2]" 1
702 1 32 ILE HB 1 52 ILE MD 6.520 . 6.520 5.092 4.007 5.365 . 0 0 "[ . 1 . 2]" 1
703 1 32 ILE MD 1 50 LEU QB 5.680 . 5.680 2.144 1.873 2.493 . 0 0 "[ . 1 . 2]" 1
704 1 32 ILE MD 1 50 LEU QD 6.180 . 6.180 2.436 2.059 2.937 . 0 0 "[ . 1 . 2]" 1
705 1 32 ILE MD 1 51 ASP H 6.150 . 6.150 4.402 3.839 4.756 . 0 0 "[ . 1 . 2]" 1
706 1 32 ILE MD 1 52 ILE HA 5.780 . 5.780 2.685 2.180 3.125 . 0 0 "[ . 1 . 2]" 1
707 1 32 ILE MD 1 52 ILE MD 5.720 . 5.720 3.631 2.218 3.916 . 0 0 "[ . 1 . 2]" 1
708 1 32 ILE QG 1 33 LEU H 6.080 . 6.080 4.316 4.247 4.365 . 0 0 "[ . 1 . 2]" 1
709 1 32 ILE QG 1 50 LEU HA 6.180 . 6.180 5.149 4.804 5.309 . 0 0 "[ . 1 . 2]" 1
710 1 32 ILE QG 1 50 LEU QD 7.700 . 7.700 3.702 3.338 4.290 . 0 0 "[ . 1 . 2]" 1
711 1 32 ILE QG 1 50 LEU H 5.010 . 5.010 4.092 3.713 4.302 . 0 0 "[ . 1 . 2]" 1
712 1 32 ILE QG 1 51 ASP H 6.070 . 6.070 4.764 4.512 4.918 . 0 0 "[ . 1 . 2]" 1
713 1 32 ILE QG 1 52 ILE MD 5.510 . 5.510 2.728 1.732 2.978 0.068 10 0 "[ . 1 . 2]" 1
714 1 32 ILE QG 1 52 ILE QG 5.200 . 5.200 1.970 1.786 2.613 0.014 20 0 "[ . 1 . 2]" 1
715 1 32 ILE MG 1 110 LEU MD1 7.420 . 7.420 4.874 4.599 4.948 . 0 0 "[ . 1 . 2]" 1
716 1 32 ILE MG 1 33 LEU HA 5.470 . 5.470 3.919 3.751 4.118 . 0 0 "[ . 1 . 2]" 1
717 1 32 ILE MG 1 33 LEU H 4.710 . 4.710 2.550 1.980 2.920 . 0 0 "[ . 1 . 2]" 1
718 1 32 ILE MG 1 34 PHE HA 6.520 . 6.520 4.706 4.523 4.851 . 0 0 "[ . 1 . 2]" 1
719 1 32 ILE MG 1 34 PHE H 6.080 . 6.080 4.792 4.447 4.897 . 0 0 "[ . 1 . 2]" 1
720 1 32 ILE MG 1 50 LEU QB 6.040 . 6.040 3.123 2.764 3.407 . 0 0 "[ . 1 . 2]" 1
721 1 32 ILE MG 1 50 LEU QD 6.980 . 6.980 2.164 1.833 3.113 . 0 0 "[ . 1 . 2]" 1
722 1 32 ILE MG 1 50 LEU H 5.070 . 5.070 3.484 3.168 3.706 . 0 0 "[ . 1 . 2]" 1
723 1 32 ILE MG 1 52 ILE MD 6.880 . 6.880 4.306 3.493 4.590 . 0 0 "[ . 1 . 2]" 1
724 1 32 ILE MG 1 80 ILE MG 7.540 . 7.540 4.672 4.486 4.917 . 0 0 "[ . 1 . 2]" 1
725 1 32 ILE MG 1 93 LEU QD 8.330 . 8.330 3.871 3.589 4.298 . 0 0 "[ . 1 . 2]" 1
726 1 32 ILE H 1 32 ILE QG 5.090 . 5.090 2.394 2.079 2.666 . 0 0 "[ . 1 . 2]" 1
727 1 32 ILE H 1 49 VAL QG 5.780 . 5.780 3.364 2.921 4.228 . 0 0 "[ . 1 . 2]" 1
728 1 32 ILE H 1 50 LEU H 4.020 . 4.020 3.250 3.000 3.585 . 0 0 "[ . 1 . 2]" 1
729 1 32 ILE H 1 51 ASP HA 4.050 . 4.050 3.364 3.218 3.535 . 0 0 "[ . 1 . 2]" 1
730 1 32 ILE H 1 52 ILE H 4.660 . 4.660 3.531 2.957 3.809 . 0 0 "[ . 1 . 2]" 1
731 1 33 LEU HA 1 33 LEU HG 4.120 . 4.120 2.851 2.440 3.717 . 0 0 "[ . 1 . 2]" 1
732 1 33 LEU HA 1 46 PRO QB 5.590 . 5.590 3.852 3.410 4.135 . 0 0 "[ . 1 . 2]" 1
733 1 33 LEU HA 1 49 VAL HA 3.970 . 3.970 2.455 1.956 2.693 . 0 0 "[ . 1 . 2]" 1
734 1 33 LEU HA 1 49 VAL HB 5.080 . 5.080 3.457 3.197 4.345 . 0 0 "[ . 1 . 2]" 1
735 1 33 LEU HA 1 49 VAL MG1 5.500 . 5.500 3.980 1.877 4.663 . 0 0 "[ . 1 . 2]" 1
736 1 33 LEU HA 1 49 VAL MG2 5.500 . 5.500 3.116 2.313 4.499 . 0 0 "[ . 1 . 2]" 1
737 1 33 LEU HA 1 49 VAL QG 5.620 . 5.620 2.583 1.875 3.045 . 0 0 "[ . 1 . 2]" 1
738 1 33 LEU HB3 1 34 PHE H 4.090 . 4.090 2.864 2.633 3.258 . 0 0 "[ . 1 . 2]" 1
739 1 33 LEU HB2 1 34 PHE H 4.090 . 4.090 3.820 3.592 4.055 . 0 0 "[ . 1 . 2]" 1
740 1 33 LEU QB 1 34 PHE H 4.430 . 4.430 2.785 2.577 3.104 . 0 0 "[ . 1 . 2]" 1
741 1 33 LEU QB 1 46 PRO QB 5.850 . 5.850 3.087 2.528 3.586 . 0 0 "[ . 1 . 2]" 1
742 1 33 LEU QD 1 34 PHE H 7.130 . 7.130 3.752 3.427 4.290 . 0 0 "[ . 1 . 2]" 1
743 1 33 LEU QD 1 46 PRO HA 7.470 . 7.470 4.576 4.313 5.082 . 0 0 "[ . 1 . 2]" 1
744 1 33 LEU QD 1 46 PRO QB 6.660 . 6.660 2.806 2.436 3.248 . 0 0 "[ . 1 . 2]" 1
745 1 33 LEU QD 1 46 PRO QD 8.260 . 8.260 4.345 3.804 4.925 . 0 0 "[ . 1 . 2]" 1
746 1 33 LEU QD 1 46 PRO QG 6.530 . 6.530 3.248 2.179 3.916 . 0 0 "[ . 1 . 2]" 1
747 1 33 LEU QD 1 49 VAL HA 6.040 . 6.040 3.962 2.797 4.544 . 0 0 "[ . 1 . 2]" 1
748 1 33 LEU QD 1 49 VAL HB 5.830 . 5.830 3.324 2.342 4.366 . 0 0 "[ . 1 . 2]" 1
749 1 33 LEU QD 1 49 VAL QG 7.020 . 7.020 2.265 1.686 2.898 0.114 8 0 "[ . 1 . 2]" 1
750 1 33 LEU HG 1 49 VAL HA 5.500 . 5.500 4.658 3.541 5.528 0.028 13 0 "[ . 1 . 2]" 1
751 1 33 LEU H 1 33 LEU MD1 5.170 . 5.170 3.021 2.235 3.672 . 0 0 "[ . 1 . 2]" 1
752 1 33 LEU H 1 33 LEU MD2 5.170 . 5.170 3.930 1.965 4.381 . 0 0 "[ . 1 . 2]" 1
753 1 33 LEU H 1 33 LEU HG 4.380 . 4.380 3.059 2.289 4.256 . 0 0 "[ . 1 . 2]" 1
754 1 33 LEU H 1 34 PHE H 4.730 . 4.730 4.476 4.311 4.537 . 0 0 "[ . 1 . 2]" 1
755 1 34 PHE HA 1 35 TYR H 3.550 . 3.550 2.149 2.126 2.166 . 0 0 "[ . 1 . 2]" 1
756 1 34 PHE HA 1 48 MET H 5.180 . 5.180 4.574 4.223 4.737 . 0 0 "[ . 1 . 2]" 1
757 1 34 PHE HB3 1 35 TYR H 4.410 . 4.410 3.683 3.432 4.151 . 0 0 "[ . 1 . 2]" 1
758 1 34 PHE HB3 1 48 MET H 4.700 . 4.700 2.749 2.357 3.256 . 0 0 "[ . 1 . 2]" 1
759 1 34 PHE HB2 1 35 TYR H 4.410 . 4.410 4.433 4.389 4.460 0.050 15 0 "[ . 1 . 2]" 1
760 1 34 PHE HB2 1 48 MET H 4.700 . 4.700 3.340 2.310 4.141 . 0 0 "[ . 1 . 2]" 1
761 1 34 PHE QB 1 35 TYR H 4.730 . 4.730 3.505 3.321 3.794 . 0 0 "[ . 1 . 2]" 1
762 1 34 PHE QB 1 48 MET QB 5.370 . 5.370 2.100 1.876 2.460 . 0 0 "[ . 1 . 2]" 1
763 1 34 PHE QB 1 48 MET H 4.840 . 4.840 2.570 2.239 2.831 . 0 0 "[ . 1 . 2]" 1
764 1 34 PHE H 1 34 PHE HB3 4.080 . 4.080 3.258 2.792 3.545 . 0 0 "[ . 1 . 2]" 1
765 1 34 PHE H 1 34 PHE HB2 4.080 . 4.080 2.675 2.408 3.061 . 0 0 "[ . 1 . 2]" 1
766 1 34 PHE H 1 35 TYR H 5.180 . 5.180 4.283 4.197 4.416 . 0 0 "[ . 1 . 2]" 1
767 1 34 PHE H 1 46 PRO HA 4.790 . 4.790 4.280 3.989 4.612 . 0 0 "[ . 1 . 2]" 1
768 1 34 PHE H 1 46 PRO QB 4.990 . 4.990 3.220 2.626 3.575 . 0 0 "[ . 1 . 2]" 1
769 1 34 PHE H 1 47 TYR H 5.160 . 5.160 4.262 3.466 4.510 . 0 0 "[ . 1 . 2]" 1
770 1 34 PHE H 1 48 MET QB 5.500 . 5.500 4.134 3.662 4.523 . 0 0 "[ . 1 . 2]" 1
771 1 34 PHE H 1 48 MET H 4.280 . 4.280 2.979 2.463 3.201 . 0 0 "[ . 1 . 2]" 1
772 1 34 PHE H 1 49 VAL HA 4.180 . 4.180 3.333 2.926 3.493 . 0 0 "[ . 1 . 2]" 1
773 1 35 TYR HA 1 37 SER H 4.730 . 4.730 4.213 4.110 4.345 . 0 0 "[ . 1 . 2]" 1
774 1 35 TYR HA 1 46 PRO HA 4.520 . 4.520 3.591 3.396 3.695 . 0 0 "[ . 1 . 2]" 1
775 1 35 TYR HA 1 47 TYR H 4.260 . 4.260 2.420 2.224 2.929 . 0 0 "[ . 1 . 2]" 1
776 1 35 TYR HA 1 48 MET H 4.600 . 4.600 4.178 4.050 4.422 . 0 0 "[ . 1 . 2]" 1
777 1 35 TYR HB3 1 36 ASP H 4.260 . 4.260 2.234 2.006 2.451 . 0 0 "[ . 1 . 2]" 1
778 1 35 TYR HB3 1 37 SER H 4.650 . 4.650 2.650 2.526 2.806 . 0 0 "[ . 1 . 2]" 1
779 1 35 TYR HB2 1 36 ASP H 4.260 . 4.260 3.394 3.127 3.661 . 0 0 "[ . 1 . 2]" 1
780 1 35 TYR HB2 1 37 SER H 4.650 . 4.650 3.635 3.177 3.851 . 0 0 "[ . 1 . 2]" 1
781 1 35 TYR QB 1 36 ASP H 4.360 . 4.360 2.204 1.984 2.398 . 0 0 "[ . 1 . 2]" 1
782 1 35 TYR QB 1 37 SER H 4.860 . 4.860 2.584 2.436 2.701 . 0 0 "[ . 1 . 2]" 1
783 1 35 TYR QB 1 40 ASP H 6.220 . 6.220 4.871 4.602 5.079 . 0 0 "[ . 1 . 2]" 1
784 1 35 TYR H 1 36 ASP H 5.160 . 5.160 4.432 4.393 4.478 . 0 0 "[ . 1 . 2]" 1
785 1 35 TYR H 1 37 SER H 5.500 . 5.500 5.491 5.174 5.510 0.010 13 0 "[ . 1 . 2]" 1
786 1 36 ASP QB 1 37 SER H 4.890 . 4.890 3.176 2.876 3.654 . 0 0 "[ . 1 . 2]" 1
787 1 36 ASP H 1 36 ASP HB3 4.200 . 4.200 2.996 2.560 3.712 . 0 0 "[ . 1 . 2]" 1
788 1 36 ASP H 1 36 ASP HB2 4.200 . 4.200 2.985 2.305 3.709 . 0 0 "[ . 1 . 2]" 1
789 1 36 ASP H 1 37 SER QB 6.220 . 6.220 4.495 3.926 4.985 . 0 0 "[ . 1 . 2]" 1
790 1 36 ASP H 1 37 SER H 3.570 . 3.570 2.005 1.941 2.104 . 0 0 "[ . 1 . 2]" 1
791 1 36 ASP H 1 40 ASP H 5.500 . 5.500 5.163 4.848 5.461 . 0 0 "[ . 1 . 2]" 1
792 1 36 ASP H 1 41 LYS HB2 5.500 . 5.500 5.457 5.178 5.505 0.005 9 0 "[ . 1 . 2]" 1
793 1 36 ASP H 1 41 LYS QG 6.380 . 6.380 5.554 5.256 5.690 . 0 0 "[ . 1 . 2]" 1
794 1 36 ASP H 1 46 PRO HA 5.500 . 5.500 5.470 5.213 5.509 0.009 7 0 "[ . 1 . 2]" 1
795 1 36 ASP H 1 47 TYR H 5.500 . 5.500 4.449 4.192 5.015 . 0 0 "[ . 1 . 2]" 1
796 1 37 SER HA 1 38 GLU H 3.320 . 3.320 2.490 2.344 2.619 . 0 0 "[ . 1 . 2]" 1
797 1 37 SER HA 1 39 GLN H 4.420 . 4.420 4.361 4.198 4.423 0.003 14 0 "[ . 1 . 2]" 1
798 1 37 SER HA 1 40 ASP H 5.170 . 5.170 4.887 4.695 5.145 . 0 0 "[ . 1 . 2]" 1
799 1 37 SER HB3 1 38 GLU H 3.840 . 3.840 2.358 1.997 2.962 . 0 0 "[ . 1 . 2]" 1
800 1 37 SER HB3 1 39 GLN HE22 4.680 . 4.680 3.468 2.676 4.250 . 0 0 "[ . 1 . 2]" 1
801 1 37 SER HB3 1 39 GLN H 3.700 . 3.700 2.813 2.291 3.702 0.002 4 0 "[ . 1 . 2]" 1
802 1 37 SER HB2 1 38 GLU H 3.840 . 3.840 3.440 2.710 3.843 0.003 11 0 "[ . 1 . 2]" 1
803 1 37 SER HB2 1 39 GLN HE22 4.680 . 4.680 4.232 3.242 4.646 . 0 0 "[ . 1 . 2]" 1
804 1 37 SER HB2 1 39 GLN H 3.700 . 3.700 3.263 2.311 3.686 . 0 0 "[ . 1 . 2]" 1
805 1 37 SER QB 1 38 GLU H 4.230 . 4.230 2.289 1.985 2.627 . 0 0 "[ . 1 . 2]" 1
806 1 37 SER QB 1 39 GLN HE21 5.860 . 5.860 2.793 1.883 4.058 . 0 0 "[ . 1 . 2]" 1
807 1 37 SER QB 1 39 GLN H 4.120 . 4.120 2.528 2.270 2.862 . 0 0 "[ . 1 . 2]" 1
808 1 37 SER QB 1 40 ASP H 5.380 . 5.380 2.851 2.393 3.079 . 0 0 "[ . 1 . 2]" 1
809 1 37 SER H 1 37 SER HB3 3.990 . 3.990 3.940 3.809 4.006 0.016 7 0 "[ . 1 . 2]" 1
810 1 37 SER H 1 37 SER HB2 3.990 . 3.990 3.064 2.909 3.605 . 0 0 "[ . 1 . 2]" 1
811 1 37 SER H 1 38 GLU H 4.630 . 4.630 4.366 4.322 4.391 . 0 0 "[ . 1 . 2]" 1
812 1 37 SER H 1 39 GLN H 5.340 . 5.340 5.044 4.804 5.265 . 0 0 "[ . 1 . 2]" 1
813 1 37 SER H 1 40 ASP QB 4.550 . 4.550 2.826 2.508 3.188 . 0 0 "[ . 1 . 2]" 1
814 1 37 SER H 1 40 ASP H 4.210 . 4.210 3.898 3.587 4.214 0.004 11 0 "[ . 1 . 2]" 1
815 1 38 GLU HA 1 38 GLU HG3 3.910 . 3.910 2.769 2.063 3.635 . 0 0 "[ . 1 . 2]" 1
816 1 38 GLU HA 1 38 GLU HG2 3.910 . 3.910 2.877 2.171 3.782 . 0 0 "[ . 1 . 2]" 1
817 1 38 GLU HA 1 41 LYS HB3 4.740 . 4.740 3.108 2.807 3.427 . 0 0 "[ . 1 . 2]" 1
818 1 38 GLU HA 1 41 LYS HB2 4.230 . 4.230 2.535 2.250 2.740 . 0 0 "[ . 1 . 2]" 1
819 1 38 GLU HA 1 41 LYS QD 6.310 . 6.310 5.077 4.659 5.362 . 0 0 "[ . 1 . 2]" 1
820 1 38 GLU HA 1 41 LYS QG 5.700 . 5.700 3.846 3.577 4.033 . 0 0 "[ . 1 . 2]" 1
821 1 38 GLU HA 1 41 LYS H 3.830 . 3.830 3.278 3.161 3.447 . 0 0 "[ . 1 . 2]" 1
822 1 38 GLU HA 1 42 GLU H 4.440 . 4.440 4.092 3.805 4.433 . 0 0 "[ . 1 . 2]" 1
823 1 38 GLU QB 1 39 GLN HE21 5.780 . 5.780 3.850 2.121 4.627 . 0 0 "[ . 1 . 2]" 1
824 1 38 GLU QB 1 39 GLN HE22 6.380 . 6.380 4.952 3.042 5.738 . 0 0 "[ . 1 . 2]" 1
825 1 38 GLU QB 1 39 GLN H 4.300 . 4.300 2.765 2.550 2.905 . 0 0 "[ . 1 . 2]" 1
826 1 38 GLU QB 1 40 ASP H 6.120 . 6.120 4.848 4.656 5.080 . 0 0 "[ . 1 . 2]" 1
827 1 38 GLU H 1 38 GLU QG 5.140 . 5.140 3.496 2.427 4.040 . 0 0 "[ . 1 . 2]" 1
828 1 38 GLU H 1 39 GLN H 3.530 . 3.530 2.541 2.435 2.694 . 0 0 "[ . 1 . 2]" 1
829 1 38 GLU H 1 40 ASP H 4.460 . 4.460 4.283 4.124 4.462 0.002 6 0 "[ . 1 . 2]" 1
830 1 39 GLN HA 1 39 GLN HE21 4.410 . 4.410 4.215 3.596 4.412 0.002 3 0 "[ . 1 . 2]" 1
831 1 39 GLN HA 1 39 GLN HG3 3.960 . 3.960 3.125 2.306 3.961 0.001 2 0 "[ . 1 . 2]" 1
832 1 39 GLN HA 1 39 GLN HG2 3.960 . 3.960 3.389 2.879 3.618 . 0 0 "[ . 1 . 2]" 1
833 1 39 GLN HA 1 41 LYS H 4.610 . 4.610 4.258 3.984 4.473 . 0 0 "[ . 1 . 2]" 1
834 1 39 GLN HA 1 42 GLU QB 5.070 . 5.070 3.681 3.018 4.370 . 0 0 "[ . 1 . 2]" 1
835 1 39 GLN HA 1 42 GLU QG 4.730 . 4.730 2.979 2.045 3.944 . 0 0 "[ . 1 . 2]" 1
836 1 39 GLN QB 1 40 ASP H 4.370 . 4.370 2.890 2.339 3.436 . 0 0 "[ . 1 . 2]" 1
837 1 39 GLN QG 1 40 ASP H 5.520 . 5.520 3.234 1.913 4.370 . 0 0 "[ . 1 . 2]" 1
838 1 39 GLN QG 1 41 LYS H 6.380 . 6.380 4.935 4.004 5.682 . 0 0 "[ . 1 . 2]" 1
839 1 39 GLN H 1 39 GLN QB 3.710 . 3.710 2.452 2.248 2.554 . 0 0 "[ . 1 . 2]" 1
840 1 39 GLN H 1 39 GLN HE21 4.710 . 4.710 2.516 2.168 2.978 . 0 0 "[ . 1 . 2]" 1
841 1 39 GLN H 1 39 GLN QG 4.520 . 4.520 2.397 1.985 3.310 . 0 0 "[ . 1 . 2]" 1
842 1 39 GLN H 1 40 ASP H 3.410 . 3.410 2.720 2.611 2.828 . 0 0 "[ . 1 . 2]" 1
843 1 39 GLN H 1 41 LYS H 4.740 . 4.740 3.953 3.833 4.065 . 0 0 "[ . 1 . 2]" 1
844 1 40 ASP HA 1 43 GLN HB3 4.840 . 4.840 3.775 2.568 4.373 . 0 0 "[ . 1 . 2]" 1
845 1 40 ASP HA 1 43 GLN HB2 4.840 . 4.840 2.579 2.232 3.264 . 0 0 "[ . 1 . 2]" 1
846 1 40 ASP HA 1 43 GLN QB 4.910 . 4.910 2.498 2.210 2.721 . 0 0 "[ . 1 . 2]" 1
847 1 40 ASP HA 1 43 GLN HG3 5.110 . 5.110 3.978 3.156 5.113 0.003 11 0 "[ . 1 . 2]" 1
848 1 40 ASP HA 1 43 GLN HG2 5.110 . 5.110 4.548 3.986 5.044 . 0 0 "[ . 1 . 2]" 1
849 1 40 ASP HA 1 43 GLN QG 5.170 . 5.170 3.645 3.075 4.172 . 0 0 "[ . 1 . 2]" 1
850 1 40 ASP HA 1 45 ASN HB3 5.500 . 5.500 4.101 3.215 4.909 . 0 0 "[ . 1 . 2]" 1
851 1 40 ASP HA 1 45 ASN HB2 5.500 . 5.500 3.995 3.068 4.766 . 0 0 "[ . 1 . 2]" 1
852 1 40 ASP HB3 1 41 LYS H 4.250 . 4.250 3.354 2.919 3.893 . 0 0 "[ . 1 . 2]" 1
853 1 40 ASP HB2 1 41 LYS H 4.250 . 4.250 3.223 2.907 3.730 . 0 0 "[ . 1 . 2]" 1
854 1 40 ASP QB 1 41 LYS H 4.560 . 4.560 2.871 2.788 2.964 . 0 0 "[ . 1 . 2]" 1
855 1 40 ASP H 1 40 ASP HB3 3.690 . 3.690 3.336 2.922 3.579 . 0 0 "[ . 1 . 2]" 1
856 1 40 ASP H 1 40 ASP HB2 3.690 . 3.690 2.183 2.089 2.400 . 0 0 "[ . 1 . 2]" 1
857 1 40 ASP H 1 41 LYS HB2 4.540 . 4.540 4.414 4.289 4.549 0.009 3 0 "[ . 1 . 2]" 1
858 1 40 ASP H 1 41 LYS H 3.390 . 3.390 2.515 2.408 2.634 . 0 0 "[ . 1 . 2]" 1
859 1 41 LYS HA 1 43 GLN H 4.360 . 4.360 4.022 3.931 4.155 . 0 0 "[ . 1 . 2]" 1
860 1 41 LYS HA 1 44 SER H 4.170 . 4.170 3.769 3.552 3.972 . 0 0 "[ . 1 . 2]" 1
861 1 41 LYS HB3 1 41 LYS HE3 4.680 . 4.680 3.428 2.290 4.404 . 0 0 "[ . 1 . 2]" 1
862 1 41 LYS HB3 1 41 LYS HE2 4.680 . 4.680 3.871 2.427 4.591 . 0 0 "[ . 1 . 2]" 1
863 1 41 LYS HB3 1 41 LYS QE 4.930 . 4.930 3.111 2.272 4.001 . 0 0 "[ . 1 . 2]" 1
864 1 41 LYS HB3 1 42 GLU H 3.600 . 3.600 2.476 2.363 2.616 . 0 0 "[ . 1 . 2]" 1
865 1 41 LYS HB3 1 43 GLN H 4.840 . 4.840 4.686 4.569 4.803 . 0 0 "[ . 1 . 2]" 1
866 1 41 LYS HB2 1 42 GLU H 3.690 . 3.690 3.378 3.268 3.483 . 0 0 "[ . 1 . 2]" 1
867 1 41 LYS HB2 1 43 GLN H 5.320 . 5.320 5.229 5.135 5.323 0.003 20 0 "[ . 1 . 2]" 1
868 1 41 LYS QD 1 43 GLN H 5.990 . 5.990 4.947 4.796 5.107 . 0 0 "[ . 1 . 2]" 1
869 1 41 LYS QD 1 44 SER H 5.140 . 5.140 4.220 3.873 4.534 . 0 0 "[ . 1 . 2]" 1
870 1 41 LYS QD 1 45 ASN H 6.320 . 6.320 5.150 4.545 5.540 . 0 0 "[ . 1 . 2]" 1
871 1 41 LYS QE 1 42 GLU H 6.380 . 6.380 5.025 4.193 5.691 . 0 0 "[ . 1 . 2]" 1
872 1 41 LYS H 1 41 LYS HB2 3.250 . 3.250 2.167 2.110 2.224 . 0 0 "[ . 1 . 2]" 1
873 1 41 LYS H 1 42 GLU QG 6.220 . 6.220 4.190 3.758 4.799 . 0 0 "[ . 1 . 2]" 1
874 1 41 LYS H 1 42 GLU H 3.530 . 3.530 2.705 2.625 2.814 . 0 0 "[ . 1 . 2]" 1
875 1 41 LYS H 1 43 GLN H 4.660 . 4.660 3.840 3.639 3.987 . 0 0 "[ . 1 . 2]" 1
876 1 42 GLU HA 1 44 SER H 3.890 . 3.890 3.537 3.462 3.610 . 0 0 "[ . 1 . 2]" 1
877 1 42 GLU QB 1 43 GLN H 4.580 . 4.580 3.189 2.832 3.682 . 0 0 "[ . 1 . 2]" 1
878 1 42 GLU QB 1 44 SER H 5.580 . 5.580 4.534 4.423 4.684 . 0 0 "[ . 1 . 2]" 1
879 1 42 GLU H 1 42 GLU QB 3.870 . 3.870 2.483 2.260 2.635 . 0 0 "[ . 1 . 2]" 1
880 1 42 GLU H 1 42 GLU HG3 3.370 . 3.370 2.707 2.115 3.371 0.001 19 0 "[ . 1 . 2]" 1
881 1 42 GLU H 1 42 GLU HG2 3.370 . 3.370 2.639 2.004 3.369 . 0 0 "[ . 1 . 2]" 1
882 1 42 GLU H 1 43 GLN HA 5.330 . 5.330 5.230 5.148 5.284 . 0 0 "[ . 1 . 2]" 1
883 1 42 GLU H 1 43 GLN H 3.540 . 3.540 2.627 2.538 2.681 . 0 0 "[ . 1 . 2]" 1
884 1 43 GLN HA 1 43 GLN HE21 4.350 . 4.350 2.733 1.998 4.177 . 0 0 "[ . 1 . 2]" 1
885 1 43 GLN HA 1 43 GLN HE22 4.530 . 4.530 3.949 3.242 4.460 . 0 0 "[ . 1 . 2]" 1
886 1 43 GLN HA 1 43 GLN HG3 3.730 . 3.730 3.318 2.065 3.734 0.004 10 0 "[ . 1 . 2]" 1
887 1 43 GLN HA 1 43 GLN HG2 3.730 . 3.730 2.607 2.096 3.695 . 0 0 "[ . 1 . 2]" 1
888 1 43 GLN HA 1 44 SER H 3.310 . 3.310 3.270 3.167 3.332 0.022 11 0 "[ . 1 . 2]" 1
889 1 43 GLN HB3 1 44 SER H 4.330 . 4.330 3.957 3.505 4.308 . 0 0 "[ . 1 . 2]" 1
890 1 43 GLN HB3 1 45 ASN H 4.720 . 4.720 3.699 2.915 4.524 . 0 0 "[ . 1 . 2]" 1
891 1 43 GLN HB2 1 44 SER H 4.330 . 4.330 3.782 3.592 4.293 . 0 0 "[ . 1 . 2]" 1
892 1 43 GLN HB2 1 45 ASN H 4.720 . 4.720 3.822 3.292 4.723 0.003 16 0 "[ . 1 . 2]" 1
893 1 43 GLN QB 1 43 GLN HE22 4.580 . 4.580 3.629 3.354 3.968 . 0 0 "[ . 1 . 2]" 1
894 1 43 GLN QB 1 44 SER H 4.420 . 4.420 3.419 3.301 3.568 . 0 0 "[ . 1 . 2]" 1
895 1 43 GLN QB 1 45 ASN H 4.990 . 4.990 3.276 2.860 3.624 . 0 0 "[ . 1 . 2]" 1
896 1 43 GLN QG 1 44 SER H 5.880 . 5.880 4.661 4.447 4.853 . 0 0 "[ . 1 . 2]" 1
897 1 43 GLN H 1 43 GLN HA 2.930 . 2.930 2.882 2.857 2.908 . 0 0 "[ . 1 . 2]" 1
898 1 43 GLN H 1 43 GLN HB3 3.680 . 3.680 3.360 2.712 3.604 . 0 0 "[ . 1 . 2]" 1
899 1 43 GLN H 1 43 GLN HB2 3.680 . 3.680 2.207 2.103 2.458 . 0 0 "[ . 1 . 2]" 1
900 1 43 GLN H 1 43 GLN QB 3.720 . 3.720 2.170 2.082 2.343 . 0 0 "[ . 1 . 2]" 1
901 1 43 GLN H 1 44 SER H 3.140 . 3.140 2.574 2.542 2.604 . 0 0 "[ . 1 . 2]" 1
902 1 43 GLN H 1 45 ASN QB 6.060 . 6.060 4.536 4.246 4.908 . 0 0 "[ . 1 . 2]" 1
903 1 43 GLN H 1 45 ASN H 3.980 . 3.980 3.804 3.581 3.985 0.005 16 0 "[ . 1 . 2]" 1
904 1 44 SER HA 1 45 ASN H 3.060 . 3.060 2.840 2.735 2.924 . 0 0 "[ . 1 . 2]" 1
905 1 44 SER HA 1 46 PRO QD 6.240 . 6.240 3.337 3.025 3.672 . 0 0 "[ . 1 . 2]" 1
906 1 44 SER HB3 1 45 ASN H 4.600 . 4.600 4.305 4.096 4.601 0.001 10 0 "[ . 1 . 2]" 1
907 1 44 SER HB2 1 45 ASN H 4.600 . 4.600 4.373 4.141 4.563 . 0 0 "[ . 1 . 2]" 1
908 1 44 SER QB 1 45 ASN H 4.830 . 4.830 3.853 3.794 4.068 . 0 0 "[ . 1 . 2]" 1
909 1 44 SER H 1 44 SER HA 2.730 . 2.730 2.272 2.269 2.274 . 0 0 "[ . 1 . 2]" 1
910 1 44 SER H 1 45 ASN HA 5.410 . 5.410 5.272 5.229 5.321 . 0 0 "[ . 1 . 2]" 1
911 1 44 SER H 1 45 ASN QB 5.400 . 5.400 4.360 4.288 4.434 . 0 0 "[ . 1 . 2]" 1
912 1 44 SER H 1 45 ASN H 3.200 . 3.200 2.663 2.581 2.775 . 0 0 "[ . 1 . 2]" 1
913 1 45 ASN HA 1 46 PRO HD3 3.960 . 3.960 2.745 2.528 2.831 . 0 0 "[ . 1 . 2]" 1
914 1 45 ASN HA 1 46 PRO HD2 3.960 . 3.960 2.162 2.012 2.481 . 0 0 "[ . 1 . 2]" 1
915 1 45 ASN HA 1 46 PRO QD 4.270 . 4.270 2.072 1.964 2.263 . 0 0 "[ . 1 . 2]" 1
916 1 45 ASN HA 1 46 PRO HG3 4.860 . 4.860 4.630 4.551 4.706 . 0 0 "[ . 1 . 2]" 1
917 1 45 ASN HA 1 46 PRO HG2 4.860 . 4.860 4.332 4.186 4.670 . 0 0 "[ . 1 . 2]" 1
918 1 45 ASN HB3 1 46 PRO HD3 5.160 . 5.160 4.977 4.761 5.056 . 0 0 "[ . 1 . 2]" 1
919 1 45 ASN HB3 1 46 PRO HD2 5.160 . 5.160 4.686 4.531 4.937 . 0 0 "[ . 1 . 2]" 1
920 1 45 ASN HB2 1 46 PRO HD3 5.160 . 5.160 4.954 4.646 5.088 . 0 0 "[ . 1 . 2]" 1
921 1 45 ASN HB2 1 46 PRO HD2 5.160 . 5.160 4.895 4.748 5.178 0.018 16 0 "[ . 1 . 2]" 1
922 1 45 ASN H 1 45 ASN HB3 3.250 . 3.250 3.179 3.042 3.253 0.003 17 0 "[ . 1 . 2]" 1
923 1 45 ASN H 1 45 ASN HB2 3.250 . 3.250 2.516 2.393 2.633 . 0 0 "[ . 1 . 2]" 1
924 1 45 ASN H 1 45 ASN HD21 4.390 . 4.390 3.995 3.837 4.062 . 0 0 "[ . 1 . 2]" 1
925 1 45 ASN H 1 45 ASN HD22 5.500 . 5.500 5.471 5.337 5.505 0.005 11 0 "[ . 1 . 2]" 1
926 1 45 ASN H 1 46 PRO HD3 4.390 . 4.390 3.483 2.977 3.804 . 0 0 "[ . 1 . 2]" 1
927 1 45 ASN H 1 46 PRO HD2 4.390 . 4.390 4.306 4.238 4.395 0.005 11 0 "[ . 1 . 2]" 1
928 1 46 PRO HA 1 47 TYR H 3.560 . 3.560 2.164 2.147 2.222 . 0 0 "[ . 1 . 2]" 1
929 1 46 PRO HA 1 49 VAL QG 7.490 . 7.490 5.301 3.974 5.616 . 0 0 "[ . 1 . 2]" 1
930 1 46 PRO HB3 1 47 TYR H 4.550 . 4.550 3.978 3.206 4.255 . 0 0 "[ . 1 . 2]" 1
931 1 46 PRO HB2 1 47 TYR H 4.550 . 4.550 3.685 3.155 4.022 . 0 0 "[ . 1 . 2]" 1
932 1 46 PRO QB 1 47 TYR H 4.840 . 4.840 3.374 2.998 3.584 . 0 0 "[ . 1 . 2]" 1
933 1 46 PRO QB 1 49 VAL HA 6.220 . 6.220 4.389 4.049 4.858 . 0 0 "[ . 1 . 2]" 1
934 1 46 PRO QB 1 49 VAL QG 6.860 . 6.860 3.175 1.846 3.541 . 0 0 "[ . 1 . 2]" 1
935 1 46 PRO QD 1 49 VAL QG 8.020 . 8.020 4.774 3.755 5.304 . 0 0 "[ . 1 . 2]" 1
936 1 46 PRO QG 1 47 TYR H 5.760 . 5.760 4.675 4.479 4.754 . 0 0 "[ . 1 . 2]" 1
937 1 46 PRO QG 1 48 MET H 6.390 . 6.390 4.800 4.501 5.289 . 0 0 "[ . 1 . 2]" 1
938 1 46 PRO QG 1 49 VAL QG 6.530 . 6.530 3.360 2.183 3.815 . 0 0 "[ . 1 . 2]" 1
939 1 47 TYR HB3 1 48 MET H 4.320 . 4.320 2.738 2.464 2.876 . 0 0 "[ . 1 . 2]" 1
940 1 47 TYR HB2 1 48 MET H 4.320 . 4.320 3.939 3.782 4.033 . 0 0 "[ . 1 . 2]" 1
941 1 47 TYR QB 1 48 MET H 4.640 . 4.640 2.689 2.434 2.816 . 0 0 "[ . 1 . 2]" 1
942 1 47 TYR H 1 47 TYR HB3 4.060 . 4.060 2.548 2.460 2.620 . 0 0 "[ . 1 . 2]" 1
943 1 47 TYR H 1 47 TYR HB2 4.060 . 4.060 2.533 2.439 2.748 . 0 0 "[ . 1 . 2]" 1
944 1 47 TYR H 1 48 MET H 3.660 . 3.660 2.611 2.316 2.707 . 0 0 "[ . 1 . 2]" 1
945 1 48 MET HA 1 48 MET ME 5.390 . 5.390 4.193 4.017 4.354 . 0 0 "[ . 1 . 2]" 1
946 1 48 MET HA 1 48 MET HG3 3.710 . 3.710 2.845 2.493 3.590 . 0 0 "[ . 1 . 2]" 1
947 1 48 MET HA 1 48 MET HG2 3.710 . 3.710 2.577 2.085 2.858 . 0 0 "[ . 1 . 2]" 1
948 1 48 MET HB3 1 48 MET ME 4.690 . 4.690 2.040 1.921 2.539 . 0 0 "[ . 1 . 2]" 1
949 1 48 MET HB2 1 48 MET ME 4.690 . 4.690 3.186 2.870 3.638 . 0 0 "[ . 1 . 2]" 1
950 1 48 MET QB 1 49 VAL H 4.560 . 4.560 3.548 3.080 3.843 . 0 0 "[ . 1 . 2]" 1
951 1 48 MET ME 1 50 LEU MD1 5.800 . 5.800 1.999 1.803 2.397 . 0 0 "[ . 1 . 2]" 1
952 1 48 MET ME 1 50 LEU MD2 5.800 . 5.800 2.342 1.842 3.826 . 0 0 "[ . 1 . 2]" 1
953 1 48 MET ME 1 50 LEU QD 6.380 . 6.380 1.811 1.671 2.108 0.129 10 0 "[ . 1 . 2]" 1
954 1 48 MET ME 1 50 LEU HG 4.900 . 4.900 2.624 2.137 3.171 . 0 0 "[ . 1 . 2]" 1
955 1 48 MET ME 1 93 LEU MD1 5.180 . 5.180 1.854 1.709 2.204 0.091 7 0 "[ . 1 . 2]" 1
956 1 48 MET ME 1 93 LEU MD2 5.180 . 5.180 3.096 2.669 3.486 . 0 0 "[ . 1 . 2]" 1
957 1 48 MET ME 1 93 LEU QD 5.800 . 5.800 1.839 1.701 2.166 0.099 7 0 "[ . 1 . 2]" 1
958 1 48 MET ME 1 93 LEU HG 5.660 . 5.660 3.643 2.895 4.511 . 0 0 "[ . 1 . 2]" 1
959 1 48 MET ME 1 95 LEU QD 8.320 . 8.320 4.433 4.062 4.803 . 0 0 "[ . 1 . 2]" 1
960 1 48 MET QG 1 49 VAL H 4.120 . 4.120 2.563 2.106 3.298 . 0 0 "[ . 1 . 2]" 1
961 1 48 MET QG 1 50 LEU QD 7.490 . 7.490 3.509 3.047 4.224 . 0 0 "[ . 1 . 2]" 1
962 1 48 MET H 1 48 MET HB3 3.840 . 3.840 3.185 3.013 3.415 . 0 0 "[ . 1 . 2]" 1
963 1 48 MET H 1 48 MET HB2 3.840 . 3.840 3.240 2.848 3.450 . 0 0 "[ . 1 . 2]" 1
964 1 48 MET H 1 49 VAL QG 6.450 . 6.450 4.451 3.511 4.830 . 0 0 "[ . 1 . 2]" 1
965 1 48 MET H 1 49 VAL H 4.550 . 4.550 4.184 3.946 4.344 . 0 0 "[ . 1 . 2]" 1
966 1 49 VAL HA 1 50 LEU H 3.040 . 3.040 2.163 2.124 2.219 . 0 0 "[ . 1 . 2]" 1
967 1 49 VAL HB 1 50 LEU H 4.220 . 4.220 3.946 2.891 4.239 0.019 5 0 "[ . 1 . 2]" 1
968 1 49 VAL QG 1 50 LEU HA 6.710 . 6.710 3.589 3.341 4.185 . 0 0 "[ . 1 . 2]" 1
969 1 49 VAL QG 1 50 LEU H 5.200 . 5.200 2.621 2.118 3.386 . 0 0 "[ . 1 . 2]" 1
970 1 49 VAL QG 1 51 ASP H 7.540 . 7.540 4.655 4.318 5.478 . 0 0 "[ . 1 . 2]" 1
971 1 49 VAL H 1 49 VAL HB 3.700 . 3.700 3.275 2.684 3.749 0.049 11 0 "[ . 1 . 2]" 1
972 1 49 VAL H 1 50 LEU HG 5.000 . 5.000 4.199 3.672 4.741 . 0 0 "[ . 1 . 2]" 1
973 1 49 VAL H 1 50 LEU H 4.400 . 4.400 4.315 4.162 4.418 0.018 9 0 "[ . 1 . 2]" 1
974 1 50 LEU HA 1 50 LEU HG 4.140 . 4.140 2.723 2.416 2.847 . 0 0 "[ . 1 . 2]" 1
975 1 50 LEU HA 1 51 ASP H 2.910 . 2.910 2.310 2.192 2.339 . 0 0 "[ . 1 . 2]" 1
976 1 50 LEU QB 1 51 ASP H 4.430 . 4.430 2.661 2.558 3.037 . 0 0 "[ . 1 . 2]" 1
977 1 50 LEU MD1 1 51 ASP H 5.970 . 5.970 4.904 4.715 5.016 . 0 0 "[ . 1 . 2]" 1
978 1 50 LEU MD1 1 80 ILE MG 6.880 . 6.880 4.364 3.988 4.525 . 0 0 "[ . 1 . 2]" 1
979 1 50 LEU MD2 1 51 ASP H 5.970 . 5.970 3.971 2.867 4.495 . 0 0 "[ . 1 . 2]" 1
980 1 50 LEU MD2 1 80 ILE MG 6.880 . 6.880 4.387 4.157 4.466 . 0 0 "[ . 1 . 2]" 1
981 1 50 LEU QD 1 51 ASP H 6.040 . 6.040 3.788 2.843 4.163 . 0 0 "[ . 1 . 2]" 1
982 1 50 LEU QD 1 80 ILE HB 7.540 . 7.540 4.397 4.180 4.601 . 0 0 "[ . 1 . 2]" 1
983 1 50 LEU QD 1 80 ILE MD 7.710 . 7.710 4.233 3.776 4.529 . 0 0 "[ . 1 . 2]" 1
984 1 50 LEU QD 1 80 ILE MG 6.860 . 6.860 3.894 3.664 3.975 . 0 0 "[ . 1 . 2]" 1
985 1 50 LEU QD 1 93 LEU QD 6.880 . 6.880 1.808 1.685 1.950 0.115 6 0 "[ . 1 . 2]" 1
986 1 50 LEU HG 1 51 ASP H 5.080 . 5.080 4.681 4.213 4.825 . 0 0 "[ . 1 . 2]" 1
987 1 50 LEU HG 1 93 LEU QD 6.230 . 6.230 3.736 3.509 3.945 . 0 0 "[ . 1 . 2]" 1
988 1 50 LEU H 1 50 LEU MD1 5.410 . 5.410 2.738 2.170 3.738 . 0 0 "[ . 1 . 2]" 1
989 1 50 LEU H 1 50 LEU MD2 5.410 . 5.410 4.217 4.036 4.507 . 0 0 "[ . 1 . 2]" 1
990 1 50 LEU H 1 51 ASP H 4.670 . 4.670 4.492 4.419 4.559 . 0 0 "[ . 1 . 2]" 1
991 1 51 ASP HA 1 52 ILE H 3.280 . 3.280 2.144 2.138 2.164 . 0 0 "[ . 1 . 2]" 1
992 1 51 ASP HA 1 53 ASP H 4.060 . 4.060 3.810 3.630 3.980 . 0 0 "[ . 1 . 2]" 1
993 1 51 ASP HB3 1 52 ILE H 4.050 . 4.050 3.508 3.234 3.683 . 0 0 "[ . 1 . 2]" 1
994 1 51 ASP HB3 1 53 ASP H 3.580 . 3.580 3.035 2.855 3.214 . 0 0 "[ . 1 . 2]" 1
995 1 51 ASP HB3 1 54 LYS QD 5.870 . 5.870 4.134 3.570 4.849 . 0 0 "[ . 1 . 2]" 1
996 1 51 ASP HB3 1 54 LYS QG 5.510 . 5.510 2.659 2.089 3.150 . 0 0 "[ . 1 . 2]" 1
997 1 51 ASP HB2 1 52 ILE H 4.630 . 4.630 4.368 4.184 4.534 . 0 0 "[ . 1 . 2]" 1
998 1 51 ASP HB2 1 53 ASP H 4.570 . 4.570 4.324 3.994 4.573 0.003 2 0 "[ . 1 . 2]" 1
999 1 51 ASP HB2 1 54 LYS QD 5.400 . 5.400 2.850 2.307 3.397 . 0 0 "[ . 1 . 2]" 1
1000 1 51 ASP HB2 1 54 LYS HG3 5.230 . 5.230 2.074 1.980 2.232 . 0 0 "[ . 1 . 2]" 1
1001 1 51 ASP HB2 1 54 LYS HG2 5.230 . 5.230 3.677 3.581 3.833 . 0 0 "[ . 1 . 2]" 1
1002 1 51 ASP HB2 1 54 LYS QG 5.410 . 5.410 2.063 1.971 2.218 . 0 0 "[ . 1 . 2]" 1
1003 1 51 ASP HB2 1 54 LYS H 4.350 . 4.350 2.960 2.651 3.309 . 0 0 "[ . 1 . 2]" 1
1004 1 51 ASP H 1 51 ASP HB3 3.710 . 3.710 3.605 3.473 3.683 . 0 0 "[ . 1 . 2]" 1
1005 1 51 ASP H 1 51 ASP HB2 3.300 . 3.300 2.392 2.220 2.629 . 0 0 "[ . 1 . 2]" 1
1006 1 51 ASP H 1 52 ILE H 4.690 . 4.690 4.404 4.350 4.508 . 0 0 "[ . 1 . 2]" 1
1007 1 51 ASP H 1 54 LYS QD 5.070 . 5.070 3.854 2.931 4.461 . 0 0 "[ . 1 . 2]" 1
1008 1 51 ASP H 1 54 LYS QG 6.220 . 6.220 4.141 3.924 4.350 . 0 0 "[ . 1 . 2]" 1
1009 1 52 ILE HA 1 114 ILE MG 6.520 . 6.520 4.489 4.326 4.703 . 0 0 "[ . 1 . 2]" 1
1010 1 52 ILE HA 1 52 ILE HG13 4.040 . 4.040 3.194 3.019 3.766 . 0 0 "[ . 1 . 2]" 1
1011 1 52 ILE HA 1 52 ILE HG12 4.040 . 4.040 2.512 2.385 2.986 . 0 0 "[ . 1 . 2]" 1
1012 1 52 ILE HA 1 54 LYS H 4.680 . 4.680 4.064 3.915 4.179 . 0 0 "[ . 1 . 2]" 1
1013 1 52 ILE HA 1 55 LEU MD1 4.680 . 4.680 2.482 2.020 2.843 . 0 0 "[ . 1 . 2]" 1
1014 1 52 ILE HA 1 55 LEU MD2 5.330 . 5.330 3.219 2.943 3.561 . 0 0 "[ . 1 . 2]" 1
1015 1 52 ILE HA 1 55 LEU HG 3.830 . 3.830 1.962 1.918 2.137 . 0 0 "[ . 1 . 2]" 1
1016 1 52 ILE HA 1 55 LEU H 4.170 . 4.170 3.496 3.408 3.581 . 0 0 "[ . 1 . 2]" 1
1017 1 52 ILE HA 1 80 ILE MG 6.520 . 6.520 5.043 4.907 5.291 . 0 0 "[ . 1 . 2]" 1
1018 1 52 ILE HB 1 53 ASP H 3.220 . 3.220 2.730 2.602 2.943 . 0 0 "[ . 1 . 2]" 1
1019 1 52 ILE HB 1 55 LEU MD1 6.400 . 6.400 4.509 4.202 4.988 . 0 0 "[ . 1 . 2]" 1
1020 1 52 ILE MD 1 113 LYS HB3 5.330 . 5.330 2.547 2.085 3.256 . 0 0 "[ . 1 . 2]" 1
1021 1 52 ILE MD 1 113 LYS HB2 5.330 . 5.330 2.661 2.131 2.962 . 0 0 "[ . 1 . 2]" 1
1022 1 52 ILE MD 1 113 LYS QD 5.980 . 5.980 2.908 2.285 3.891 . 0 0 "[ . 1 . 2]" 1
1023 1 52 ILE MD 1 113 LYS QE 6.090 . 6.090 2.747 2.157 3.724 . 0 0 "[ . 1 . 2]" 1
1024 1 52 ILE MD 1 113 LYS QG 6.010 . 6.010 3.669 2.915 4.305 . 0 0 "[ . 1 . 2]" 1
1025 1 52 ILE MD 1 113 LYS H 6.130 . 6.130 4.732 4.421 4.933 . 0 0 "[ . 1 . 2]" 1
1026 1 52 ILE MD 1 114 ILE HA 6.520 . 6.520 4.379 4.095 4.726 . 0 0 "[ . 1 . 2]" 1
1027 1 52 ILE MD 1 53 ASP H 5.960 . 5.960 4.750 4.621 4.941 . 0 0 "[ . 1 . 2]" 1
1028 1 52 ILE QG 1 53 ASP H 5.290 . 5.290 3.994 3.911 4.168 . 0 0 "[ . 1 . 2]" 1
1029 1 52 ILE MG 1 110 LEU HA 6.480 . 6.480 4.238 4.051 4.580 . 0 0 "[ . 1 . 2]" 1
1030 1 52 ILE MG 1 113 LYS HA 5.860 . 5.860 4.164 3.899 4.519 . 0 0 "[ . 1 . 2]" 1
1031 1 52 ILE MG 1 113 LYS HB3 5.170 . 5.170 2.750 2.272 3.094 . 0 0 "[ . 1 . 2]" 1
1032 1 52 ILE MG 1 113 LYS HB2 5.170 . 5.170 2.690 2.277 3.123 . 0 0 "[ . 1 . 2]" 1
1033 1 52 ILE MG 1 113 LYS QB 5.330 . 5.330 2.399 2.167 2.735 . 0 0 "[ . 1 . 2]" 1
1034 1 52 ILE MG 1 113 LYS HE3 6.520 . 6.520 4.689 4.134 5.281 . 0 0 "[ . 1 . 2]" 1
1035 1 52 ILE MG 1 113 LYS HE2 6.520 . 6.520 4.827 4.242 5.298 . 0 0 "[ . 1 . 2]" 1
1036 1 52 ILE MG 1 113 LYS QG 6.210 . 6.210 4.175 3.827 4.527 . 0 0 "[ . 1 . 2]" 1
1037 1 52 ILE MG 1 113 LYS H 5.560 . 5.560 4.182 4.042 4.402 . 0 0 "[ . 1 . 2]" 1
1038 1 52 ILE MG 1 114 ILE HA 4.900 . 4.900 1.906 1.824 2.194 . 0 0 "[ . 1 . 2]" 1
1039 1 52 ILE MG 1 114 ILE H 4.790 . 4.790 3.116 2.935 3.502 . 0 0 "[ . 1 . 2]" 1
1040 1 52 ILE MG 1 115 PRO HD3 5.700 . 5.700 2.721 2.209 3.193 . 0 0 "[ . 1 . 2]" 1
1041 1 52 ILE MG 1 115 PRO HD2 5.300 . 5.300 3.194 2.857 3.674 . 0 0 "[ . 1 . 2]" 1
1042 1 52 ILE MG 1 53 ASP HA 5.560 . 5.560 3.622 3.431 3.698 . 0 0 "[ . 1 . 2]" 1
1043 1 52 ILE MG 1 53 ASP HB3 6.520 . 6.520 5.349 5.249 5.374 . 0 0 "[ . 1 . 2]" 1
1044 1 52 ILE MG 1 53 ASP HB2 6.520 . 6.520 4.600 4.391 4.707 . 0 0 "[ . 1 . 2]" 1
1045 1 52 ILE MG 1 53 ASP QB 6.550 . 6.550 4.347 4.180 4.419 . 0 0 "[ . 1 . 2]" 1
1046 1 52 ILE MG 1 53 ASP H 4.940 . 4.940 3.594 3.545 3.681 . 0 0 "[ . 1 . 2]" 1
1047 1 52 ILE MG 1 55 LEU HB2 5.180 . 5.180 3.629 3.418 4.004 . 0 0 "[ . 1 . 2]" 1
1048 1 52 ILE MG 1 55 LEU HG 5.210 . 5.210 3.215 3.031 3.379 . 0 0 "[ . 1 . 2]" 1
1049 1 52 ILE H 1 52 ILE HB 3.290 . 3.290 2.581 2.484 2.634 . 0 0 "[ . 1 . 2]" 1
1050 1 52 ILE H 1 52 ILE MD 5.120 . 5.120 3.615 3.251 3.736 . 0 0 "[ . 1 . 2]" 1
1051 1 52 ILE H 1 52 ILE HG13 3.660 . 3.660 2.200 1.996 3.452 . 0 0 "[ . 1 . 2]" 1
1052 1 52 ILE H 1 52 ILE HG12 3.660 . 3.660 3.032 1.976 3.350 . 0 0 "[ . 1 . 2]" 1
1053 1 52 ILE H 1 52 ILE QG 3.990 . 3.990 2.028 1.965 2.190 . 0 0 "[ . 1 . 2]" 1
1054 1 52 ILE H 1 53 ASP H 3.420 . 3.420 2.728 2.689 2.770 . 0 0 "[ . 1 . 2]" 1
1055 1 52 ILE H 1 54 LYS H 4.380 . 4.380 4.071 4.018 4.144 . 0 0 "[ . 1 . 2]" 1
1056 1 53 ASP HA 1 114 ILE MG 5.780 . 5.780 3.012 2.726 3.247 . 0 0 "[ . 1 . 2]" 1
1057 1 53 ASP HA 1 115 PRO HD3 4.950 . 4.950 2.703 2.456 3.061 . 0 0 "[ . 1 . 2]" 1
1058 1 53 ASP HA 1 115 PRO HD2 5.000 . 5.000 2.061 1.970 2.237 . 0 0 "[ . 1 . 2]" 1
1059 1 53 ASP HA 1 115 PRO HG3 4.050 . 4.050 2.706 2.308 3.379 . 0 0 "[ . 1 . 2]" 1
1060 1 53 ASP HA 1 115 PRO HG2 4.050 . 4.050 2.607 2.196 3.000 . 0 0 "[ . 1 . 2]" 1
1061 1 53 ASP HA 1 115 PRO QG 4.410 . 4.410 2.309 2.109 2.669 . 0 0 "[ . 1 . 2]" 1
1062 1 53 ASP HB3 1 54 LYS H 4.320 . 4.320 2.938 2.848 3.023 . 0 0 "[ . 1 . 2]" 1
1063 1 53 ASP HB2 1 54 LYS H 4.320 . 4.320 4.067 3.997 4.131 . 0 0 "[ . 1 . 2]" 1
1064 1 53 ASP QB 1 115 PRO HB3 6.220 . 6.220 4.411 4.105 4.853 . 0 0 "[ . 1 . 2]" 1
1065 1 53 ASP QB 1 54 LYS H 4.580 . 4.580 2.873 2.790 2.952 . 0 0 "[ . 1 . 2]" 1
1066 1 53 ASP H 1 53 ASP HB3 3.100 . 3.100 2.495 2.442 2.541 . 0 0 "[ . 1 . 2]" 1
1067 1 53 ASP H 1 53 ASP HB2 3.100 . 3.100 2.583 2.534 2.665 . 0 0 "[ . 1 . 2]" 1
1068 1 53 ASP H 1 54 LYS HB2 4.530 . 4.530 4.505 4.424 4.544 0.014 9 0 "[ . 1 . 2]" 1
1069 1 53 ASP H 1 54 LYS H 3.200 . 3.200 2.539 2.437 2.621 . 0 0 "[ . 1 . 2]" 1
1070 1 53 ASP H 1 55 LEU HG 4.680 . 4.680 4.459 4.152 4.691 0.011 10 0 "[ . 1 . 2]" 1
1071 1 53 ASP H 1 55 LEU H 4.370 . 4.370 4.040 3.958 4.128 . 0 0 "[ . 1 . 2]" 1
1072 1 54 LYS HA 1 54 LYS QD 4.980 . 4.980 3.754 3.533 3.959 . 0 0 "[ . 1 . 2]" 1
1073 1 54 LYS HA 1 54 LYS QE 5.320 . 5.320 4.013 3.084 4.648 . 0 0 "[ . 1 . 2]" 1
1074 1 54 LYS HA 1 54 LYS HG3 4.240 . 4.240 3.189 2.900 3.429 . 0 0 "[ . 1 . 2]" 1
1075 1 54 LYS HA 1 54 LYS HG2 4.240 . 4.240 2.198 2.125 2.306 . 0 0 "[ . 1 . 2]" 1
1076 1 54 LYS HA 1 55 LEU MD2 6.520 . 6.520 5.225 5.048 5.291 . 0 0 "[ . 1 . 2]" 1
1077 1 54 LYS HA 1 55 LEU H 3.510 . 3.510 3.438 3.405 3.462 . 0 0 "[ . 1 . 2]" 1
1078 1 54 LYS HB3 1 55 LEU H 4.530 . 4.530 3.780 3.609 3.955 . 0 0 "[ . 1 . 2]" 1
1079 1 54 LYS HB3 1 83 ALA MB 5.300 . 5.300 3.072 2.944 3.213 . 0 0 "[ . 1 . 2]" 1
1080 1 54 LYS HB3 1 83 ALA H 4.110 . 4.110 2.728 2.550 2.908 . 0 0 "[ . 1 . 2]" 1
1081 1 54 LYS HB2 1 55 LEU H 3.310 . 3.310 3.221 3.138 3.311 0.001 18 0 "[ . 1 . 2]" 1
1082 1 54 LYS HB2 1 83 ALA MB 5.740 . 5.740 4.562 4.487 4.652 . 0 0 "[ . 1 . 2]" 1
1083 1 54 LYS HB2 1 83 ALA H 4.700 . 4.700 4.305 4.160 4.432 . 0 0 "[ . 1 . 2]" 1
1084 1 54 LYS QD 1 55 LEU H 6.210 . 6.210 5.353 5.199 5.476 . 0 0 "[ . 1 . 2]" 1
1085 1 54 LYS QD 1 83 ALA MB 5.940 . 5.940 2.915 2.300 3.537 . 0 0 "[ . 1 . 2]" 1
1086 1 54 LYS QD 1 84 ASN HA 5.940 . 5.940 4.132 3.744 4.517 . 0 0 "[ . 1 . 2]" 1
1087 1 54 LYS QD 1 84 ASN H 6.380 . 6.380 5.212 4.681 5.488 . 0 0 "[ . 1 . 2]" 1
1088 1 54 LYS QE 1 83 ALA H 6.200 . 6.200 4.856 3.826 5.571 . 0 0 "[ . 1 . 2]" 1
1089 1 54 LYS QG 1 55 LEU H 5.870 . 5.870 4.467 4.408 4.529 . 0 0 "[ . 1 . 2]" 1
1090 1 54 LYS QG 1 83 ALA MB 6.380 . 6.380 3.554 2.933 3.940 . 0 0 "[ . 1 . 2]" 1
1091 1 54 LYS H 1 54 LYS HB3 3.710 . 3.710 3.515 3.478 3.561 . 0 0 "[ . 1 . 2]" 1
1092 1 54 LYS H 1 54 LYS HB2 3.540 . 3.540 2.222 2.169 2.298 . 0 0 "[ . 1 . 2]" 1
1093 1 54 LYS H 1 54 LYS QD 5.260 . 5.260 4.379 4.164 4.543 . 0 0 "[ . 1 . 2]" 1
1094 1 54 LYS H 1 54 LYS QE 6.310 . 6.310 5.122 4.322 5.584 . 0 0 "[ . 1 . 2]" 1
1095 1 54 LYS H 1 54 LYS HG3 4.310 . 4.310 3.015 2.813 3.207 . 0 0 "[ . 1 . 2]" 1
1096 1 54 LYS H 1 54 LYS HG2 4.310 . 4.310 3.621 3.331 3.894 . 0 0 "[ . 1 . 2]" 1
1097 1 54 LYS H 1 54 LYS QG 4.390 . 4.390 2.868 2.711 3.014 . 0 0 "[ . 1 . 2]" 1
1098 1 54 LYS H 1 55 LEU HG 4.210 . 4.210 3.929 3.683 4.207 . 0 0 "[ . 1 . 2]" 1
1099 1 55 LEU HA 1 55 LEU MD2 4.530 . 4.530 2.021 1.913 2.183 . 0 0 "[ . 1 . 2]" 1
1100 1 55 LEU HA 1 57 HIS H 4.250 . 4.250 4.028 3.834 4.188 . 0 0 "[ . 1 . 2]" 1
1101 1 55 LEU HA 1 80 ILE MG 5.820 . 5.820 3.932 3.758 4.086 . 0 0 "[ . 1 . 2]" 1
1102 1 55 LEU HA 1 82 TYR HA 3.890 . 3.890 2.210 2.022 2.324 . 0 0 "[ . 1 . 2]" 1
1103 1 55 LEU HA 1 82 TYR QB 5.260 . 5.260 2.491 2.064 2.716 . 0 0 "[ . 1 . 2]" 1
1104 1 55 LEU HB3 1 114 ILE MD 4.710 . 4.710 2.429 2.237 2.693 . 0 0 "[ . 1 . 2]" 1
1105 1 55 LEU HB3 1 114 ILE MG 5.590 . 5.590 3.732 3.445 4.088 . 0 0 "[ . 1 . 2]" 1
1106 1 55 LEU HB3 1 56 PHE H 4.210 . 4.210 2.841 2.603 3.205 . 0 0 "[ . 1 . 2]" 1
1107 1 55 LEU HB3 1 57 HIS H 4.280 . 4.280 3.387 3.253 3.618 . 0 0 "[ . 1 . 2]" 1
1108 1 55 LEU HB3 1 80 ILE MG 4.940 . 4.940 3.181 2.928 3.435 . 0 0 "[ . 1 . 2]" 1
1109 1 55 LEU HB2 1 114 ILE MD 5.420 . 5.420 2.193 1.955 2.663 . 0 0 "[ . 1 . 2]" 1
1110 1 55 LEU HB2 1 114 ILE MG 5.210 . 5.210 2.554 2.298 2.746 . 0 0 "[ . 1 . 2]" 1
1111 1 55 LEU HB2 1 56 PHE H 4.320 . 4.320 3.904 3.732 4.103 . 0 0 "[ . 1 . 2]" 1
1112 1 55 LEU MD1 1 114 ILE HG13 5.260 . 5.260 3.031 2.866 3.274 . 0 0 "[ . 1 . 2]" 1
1113 1 55 LEU MD1 1 114 ILE HG12 5.260 . 5.260 2.032 1.936 2.282 . 0 0 "[ . 1 . 2]" 1
1114 1 55 LEU MD1 1 114 ILE QG 5.480 . 5.480 2.002 1.913 2.228 . 0 0 "[ . 1 . 2]" 1
1115 1 55 LEU MD1 1 115 PRO HD2 6.410 . 6.410 5.055 4.818 5.195 . 0 0 "[ . 1 . 2]" 1
1116 1 55 LEU MD1 1 58 VAL HA 6.520 . 6.520 5.235 5.200 5.277 . 0 0 "[ . 1 . 2]" 1
1117 1 55 LEU MD1 1 58 VAL QG 6.500 . 6.500 2.485 2.248 2.885 . 0 0 "[ . 1 . 2]" 1
1118 1 55 LEU MD1 1 80 ILE MG 5.230 . 5.230 2.226 1.979 2.413 . 0 0 "[ . 1 . 2]" 1
1119 1 55 LEU MD1 1 82 TYR QB 6.260 . 6.260 4.216 4.118 4.264 . 0 0 "[ . 1 . 2]" 1
1120 1 55 LEU MD2 1 56 PHE H 5.010 . 5.010 3.370 3.196 3.721 . 0 0 "[ . 1 . 2]" 1
1121 1 55 LEU MD2 1 58 VAL QG 7.150 . 7.150 3.713 3.349 4.243 . 0 0 "[ . 1 . 2]" 1
1122 1 55 LEU MD2 1 80 ILE MG 5.040 . 5.040 2.003 1.860 2.186 . 0 0 "[ . 1 . 2]" 1
1123 1 55 LEU MD2 1 82 TYR HA 5.170 . 5.170 3.124 2.873 3.368 . 0 0 "[ . 1 . 2]" 1
1124 1 55 LEU MD2 1 82 TYR QB 5.840 . 5.840 1.806 1.786 1.826 0.014 1 0 "[ . 1 . 2]" 1
1125 1 55 LEU HG 1 80 ILE MG 5.430 . 5.430 4.076 3.908 4.305 . 0 0 "[ . 1 . 2]" 1
1126 1 55 LEU H 1 55 LEU HB2 3.480 . 3.480 2.578 2.505 2.732 . 0 0 "[ . 1 . 2]" 1
1127 1 55 LEU H 1 55 LEU MD1 4.760 . 4.760 3.753 3.634 3.857 . 0 0 "[ . 1 . 2]" 1
1128 1 55 LEU H 1 55 LEU MD2 4.510 . 4.510 2.849 2.589 2.970 . 0 0 "[ . 1 . 2]" 1
1129 1 55 LEU H 1 55 LEU HG 3.600 . 3.600 2.215 1.989 2.369 . 0 0 "[ . 1 . 2]" 1
1130 1 55 LEU H 1 56 PHE H 4.810 . 4.810 4.626 4.564 4.645 . 0 0 "[ . 1 . 2]" 1
1131 1 55 LEU H 1 82 TYR HA 4.720 . 4.720 4.447 4.266 4.647 . 0 0 "[ . 1 . 2]" 1
1132 1 55 LEU H 1 82 TYR QB 5.150 . 5.150 3.936 3.633 4.140 . 0 0 "[ . 1 . 2]" 1
1133 1 55 LEU H 1 83 ALA H 5.000 . 5.000 4.895 4.739 5.003 0.003 20 0 "[ . 1 . 2]" 1
1134 1 56 PHE HA 1 114 ILE MG 5.920 . 5.920 4.792 4.568 4.882 . 0 0 "[ . 1 . 2]" 1
1135 1 56 PHE HB3 1 81 LEU QB 5.750 . 5.750 3.666 3.343 3.876 . 0 0 "[ . 1 . 2]" 1
1136 1 56 PHE HB2 1 81 LEU QB 5.750 . 5.750 2.666 2.459 2.908 . 0 0 "[ . 1 . 2]" 1
1137 1 56 PHE QB 1 57 HIS H 4.370 . 4.370 2.740 2.614 2.867 . 0 0 "[ . 1 . 2]" 1
1138 1 56 PHE QB 1 81 LEU QB 6.010 . 6.010 2.603 2.419 2.830 . 0 0 "[ . 1 . 2]" 1
1139 1 56 PHE QB 1 81 LEU QD 6.430 . 6.430 1.830 1.759 1.919 0.041 14 0 "[ . 1 . 2]" 1
1140 1 56 PHE QB 1 81 LEU HG 5.530 . 5.530 2.425 1.948 2.786 . 0 0 "[ . 1 . 2]" 1
1141 1 56 PHE H 1 57 HIS H 3.470 . 3.470 2.055 1.991 2.208 . 0 0 "[ . 1 . 2]" 1
1142 1 56 PHE H 1 80 ILE MG 5.650 . 5.650 4.182 3.964 4.363 . 0 0 "[ . 1 . 2]" 1
1143 1 56 PHE H 1 81 LEU QB 5.380 . 5.380 3.288 3.113 3.566 . 0 0 "[ . 1 . 2]" 1
1144 1 56 PHE H 1 81 LEU QD 6.560 . 6.560 3.672 3.536 3.939 . 0 0 "[ . 1 . 2]" 1
1145 1 56 PHE H 1 81 LEU HG 5.040 . 5.040 3.702 3.185 4.127 . 0 0 "[ . 1 . 2]" 1
1146 1 56 PHE H 1 82 TYR HA 4.050 . 4.050 2.844 2.492 2.981 . 0 0 "[ . 1 . 2]" 1
1147 1 56 PHE H 1 83 ALA H 4.780 . 4.780 4.593 4.341 4.787 0.007 13 0 "[ . 1 . 2]" 1
1148 1 57 HIS HA 1 114 ILE MD 4.750 . 4.750 3.745 3.492 3.937 . 0 0 "[ . 1 . 2]" 1
1149 1 57 HIS HA 1 114 ILE MG 6.390 . 6.390 4.959 4.722 5.098 . 0 0 "[ . 1 . 2]" 1
1150 1 57 HIS HA 1 58 VAL QG 6.660 . 6.660 3.465 3.349 3.625 . 0 0 "[ . 1 . 2]" 1
1151 1 57 HIS HA 1 58 VAL H 3.290 . 3.290 2.179 2.138 2.266 . 0 0 "[ . 1 . 2]" 1
1152 1 57 HIS HA 1 80 ILE MG 6.520 . 6.520 5.194 5.103 5.238 . 0 0 "[ . 1 . 2]" 1
1153 1 57 HIS HB3 1 81 LEU QB 5.240 . 5.240 3.742 3.358 4.136 . 0 0 "[ . 1 . 2]" 1
1154 1 57 HIS HB2 1 81 LEU QB 5.240 . 5.240 3.858 3.488 4.402 . 0 0 "[ . 1 . 2]" 1
1155 1 57 HIS QB 1 58 VAL H 4.640 . 4.640 3.407 2.747 3.720 . 0 0 "[ . 1 . 2]" 1
1156 1 57 HIS QB 1 59 ARG H 6.380 . 6.380 4.972 4.704 5.428 . 0 0 "[ . 1 . 2]" 1
1157 1 57 HIS QB 1 81 LEU QD 6.560 . 6.560 3.209 2.949 3.517 . 0 0 "[ . 1 . 2]" 1
1158 1 57 HIS QB 1 81 LEU HG 6.220 . 6.220 5.344 4.908 5.583 . 0 0 "[ . 1 . 2]" 1
1159 1 57 HIS H 1 58 VAL QG 6.480 . 6.480 3.779 3.354 4.489 . 0 0 "[ . 1 . 2]" 1
1160 1 57 HIS H 1 80 ILE MG 5.570 . 5.570 4.023 3.780 4.166 . 0 0 "[ . 1 . 2]" 1
1161 1 57 HIS H 1 81 LEU HA 5.220 . 5.220 4.930 4.715 5.118 . 0 0 "[ . 1 . 2]" 1
1162 1 57 HIS H 1 81 LEU QB 4.250 . 4.250 2.577 2.298 2.845 . 0 0 "[ . 1 . 2]" 1
1163 1 57 HIS H 1 81 LEU QD 5.730 . 5.730 3.414 3.197 3.719 . 0 0 "[ . 1 . 2]" 1
1164 1 57 HIS H 1 81 LEU H 4.140 . 4.140 3.217 3.022 3.384 . 0 0 "[ . 1 . 2]" 1
1165 1 57 HIS H 1 82 TYR HA 4.710 . 4.710 4.701 4.508 4.723 0.013 3 0 "[ . 1 . 2]" 1
1166 1 58 VAL HA 1 110 LEU MD2 6.520 . 6.520 5.199 5.072 5.274 . 0 0 "[ . 1 . 2]" 1
1167 1 58 VAL HA 1 114 ILE MD 6.520 . 6.520 5.021 4.876 5.242 . 0 0 "[ . 1 . 2]" 1
1168 1 58 VAL HA 1 59 ARG H 3.200 . 3.200 2.158 2.143 2.178 . 0 0 "[ . 1 . 2]" 1
1169 1 58 VAL HA 1 80 ILE HA 3.790 . 3.790 2.385 2.163 2.501 . 0 0 "[ . 1 . 2]" 1
1170 1 58 VAL HA 1 80 ILE QG 5.320 . 5.320 3.437 3.014 3.811 . 0 0 "[ . 1 . 2]" 1
1171 1 58 VAL HA 1 80 ILE MG 5.380 . 5.380 3.505 3.292 3.669 . 0 0 "[ . 1 . 2]" 1
1172 1 58 VAL HA 1 81 LEU H 4.170 . 4.170 3.269 2.911 3.599 . 0 0 "[ . 1 . 2]" 1
1173 1 58 VAL HB 1 110 LEU MD1 5.480 . 5.480 2.601 2.393 2.804 . 0 0 "[ . 1 . 2]" 1
1174 1 58 VAL HB 1 110 LEU MD2 6.520 . 6.520 4.147 3.714 4.579 . 0 0 "[ . 1 . 2]" 1
1175 1 58 VAL HB 1 111 VAL HA 5.310 . 5.310 4.172 3.580 5.010 . 0 0 "[ . 1 . 2]" 1
1176 1 58 VAL HB 1 111 VAL QG 6.220 . 6.220 3.050 2.073 4.383 . 0 0 "[ . 1 . 2]" 1
1177 1 58 VAL HB 1 114 ILE MD 5.770 . 5.770 3.570 3.282 3.763 . 0 0 "[ . 1 . 2]" 1
1178 1 58 VAL HB 1 59 ARG H 4.450 . 4.450 4.198 4.071 4.340 . 0 0 "[ . 1 . 2]" 1
1179 1 58 VAL HB 1 80 ILE HA 5.060 . 5.060 3.952 2.406 4.895 . 0 0 "[ . 1 . 2]" 1
1180 1 58 VAL HB 1 80 ILE MD 6.520 . 6.520 5.080 4.263 5.451 . 0 0 "[ . 1 . 2]" 1
1181 1 58 VAL HB 1 80 ILE QG 4.520 . 4.520 3.581 2.679 4.016 . 0 0 "[ . 1 . 2]" 1
1182 1 58 VAL MG1 1 110 LEU HB2 6.520 . 6.520 4.536 4.362 4.728 . 0 0 "[ . 1 . 2]" 1
1183 1 58 VAL MG1 1 110 LEU MD1 5.600 . 5.600 1.862 1.726 2.054 0.074 18 0 "[ . 1 . 2]" 1
1184 1 58 VAL MG1 1 110 LEU HG 6.150 . 6.150 2.928 2.529 3.080 . 0 0 "[ . 1 . 2]" 1
1185 1 58 VAL MG1 1 80 ILE HB 6.520 . 6.520 4.545 3.908 5.446 . 0 0 "[ . 1 . 2]" 1
1186 1 58 VAL MG2 1 110 LEU HB2 6.520 . 6.520 4.471 4.262 4.673 . 0 0 "[ . 1 . 2]" 1
1187 1 58 VAL MG2 1 110 LEU MD1 5.600 . 5.600 1.793 1.684 1.941 0.116 1 0 "[ . 1 . 2]" 1
1188 1 58 VAL MG2 1 110 LEU HG 6.150 . 6.150 3.580 2.943 3.938 . 0 0 "[ . 1 . 2]" 1
1189 1 58 VAL MG2 1 80 ILE HB 6.520 . 6.520 3.914 3.801 3.973 . 0 0 "[ . 1 . 2]" 1
1190 1 58 VAL QG 1 107 VAL HA 5.730 . 5.730 2.555 2.323 2.831 . 0 0 "[ . 1 . 2]" 1
1191 1 58 VAL QG 1 107 VAL QG 7.040 . 7.040 1.779 1.704 1.907 0.096 13 0 "[ . 1 . 2]" 1
1192 1 58 VAL QG 1 108 SER HA 7.060 . 7.060 4.979 4.655 5.193 . 0 0 "[ . 1 . 2]" 1
1193 1 58 VAL QG 1 110 LEU HB2 6.860 . 6.860 4.007 3.874 4.163 . 0 0 "[ . 1 . 2]" 1
1194 1 58 VAL QG 1 110 LEU MD1 6.210 . 6.210 1.615 1.565 1.671 0.235 5 0 "[ . 1 . 2]" 1
1195 1 58 VAL QG 1 110 LEU MD2 6.910 . 6.910 2.050 1.879 2.300 . 0 0 "[ . 1 . 2]" 1
1196 1 58 VAL QG 1 110 LEU HG 6.340 . 6.340 2.791 2.426 2.930 . 0 0 "[ . 1 . 2]" 1
1197 1 58 VAL QG 1 111 VAL HA 6.060 . 6.060 2.687 2.475 3.011 . 0 0 "[ . 1 . 2]" 1
1198 1 58 VAL QG 1 111 VAL HB 5.840 . 5.840 2.429 1.830 2.785 . 0 0 "[ . 1 . 2]" 1
1199 1 58 VAL QG 1 111 VAL QG 7.290 . 7.290 2.355 1.855 2.661 . 0 0 "[ . 1 . 2]" 1
1200 1 58 VAL QG 1 114 ILE MD 6.360 . 6.360 1.962 1.850 2.139 . 0 0 "[ . 1 . 2]" 1
1201 1 58 VAL QG 1 59 ARG HA 6.970 . 6.970 3.410 3.081 3.661 . 0 0 "[ . 1 . 2]" 1
1202 1 58 VAL QG 1 59 ARG H 5.750 . 5.750 2.696 2.481 2.859 . 0 0 "[ . 1 . 2]" 1
1203 1 58 VAL QG 1 79 GLN H 7.200 . 7.200 3.915 3.538 4.196 . 0 0 "[ . 1 . 2]" 1
1204 1 58 VAL QG 1 80 ILE HA 5.780 . 5.780 2.508 2.300 2.719 . 0 0 "[ . 1 . 2]" 1
1205 1 58 VAL QG 1 80 ILE QG 7.340 . 7.340 1.672 1.643 1.765 0.157 9 0 "[ . 1 . 2]" 1
1206 1 58 VAL QG 1 80 ILE MG 6.400 . 6.400 2.026 1.728 2.548 0.072 3 0 "[ . 1 . 2]" 1
1207 1 58 VAL QG 1 81 LEU QB 7.920 . 7.920 4.632 4.254 5.133 . 0 0 "[ . 1 . 2]" 1
1208 1 58 VAL QG 1 81 LEU H 6.010 . 6.010 3.553 3.036 4.125 . 0 0 "[ . 1 . 2]" 1
1209 1 58 VAL H 1 114 ILE MD 5.420 . 5.420 3.743 3.458 4.116 . 0 0 "[ . 1 . 2]" 1
1210 1 58 VAL H 1 59 ARG QG 5.800 . 5.800 3.869 3.126 4.957 . 0 0 "[ . 1 . 2]" 1
1211 1 58 VAL H 1 59 ARG H 4.790 . 4.790 4.257 3.976 4.366 . 0 0 "[ . 1 . 2]" 1
1212 1 58 VAL H 1 80 ILE HA 5.500 . 5.500 4.894 4.615 5.107 . 0 0 "[ . 1 . 2]" 1
1213 1 59 ARG HA 1 107 VAL MG1 5.880 . 5.880 2.480 2.082 2.919 . 0 0 "[ . 1 . 2]" 1
1214 1 59 ARG HA 1 107 VAL MG2 5.880 . 5.880 3.936 3.559 4.370 . 0 0 "[ . 1 . 2]" 1
1215 1 59 ARG HA 1 107 VAL QG 5.760 . 5.760 2.454 2.071 2.878 . 0 0 "[ . 1 . 2]" 1
1216 1 59 ARG HA 1 59 ARG HD3 5.190 . 5.190 4.010 2.431 4.982 . 0 0 "[ . 1 . 2]" 1
1217 1 59 ARG HA 1 59 ARG HD2 5.190 . 5.190 4.096 2.091 5.191 0.001 3 0 "[ . 1 . 2]" 1
1218 1 59 ARG HA 1 60 PRO HD3 3.840 . 3.840 2.491 2.403 2.607 . 0 0 "[ . 1 . 2]" 1
1219 1 59 ARG HA 1 60 PRO QG 5.130 . 5.130 4.064 4.039 4.120 . 0 0 "[ . 1 . 2]" 1
1220 1 59 ARG HB3 1 60 PRO HD2 4.990 . 4.990 2.444 1.944 3.351 . 0 0 "[ . 1 . 2]" 1
1221 1 59 ARG HB2 1 60 PRO HD2 4.990 . 4.990 2.927 1.949 3.694 . 0 0 "[ . 1 . 2]" 1
1222 1 59 ARG QB 1 60 PRO HD3 5.470 . 5.470 3.401 3.328 3.484 . 0 0 "[ . 1 . 2]" 1
1223 1 59 ARG H 1 107 VAL MG1 6.000 . 6.000 3.684 3.401 3.900 . 0 0 "[ . 1 . 2]" 1
1224 1 59 ARG H 1 107 VAL MG2 6.000 . 6.000 4.596 4.324 4.817 . 0 0 "[ . 1 . 2]" 1
1225 1 59 ARG H 1 107 VAL QG 6.300 . 6.300 3.541 3.285 3.742 . 0 0 "[ . 1 . 2]" 1
1226 1 59 ARG H 1 59 ARG HD3 5.500 . 5.500 5.063 3.912 5.506 0.006 12 0 "[ . 1 . 2]" 1
1227 1 59 ARG H 1 59 ARG HD2 5.500 . 5.500 4.999 3.373 5.510 0.010 8 0 "[ . 1 . 2]" 1
1228 1 59 ARG H 1 59 ARG HG3 4.670 . 4.670 3.531 2.366 4.551 . 0 0 "[ . 1 . 2]" 1
1229 1 59 ARG H 1 59 ARG HG2 4.670 . 4.670 3.589 2.359 4.603 . 0 0 "[ . 1 . 2]" 1
1230 1 59 ARG H 1 59 ARG QG 4.880 . 4.880 3.007 2.340 3.670 . 0 0 "[ . 1 . 2]" 1
1231 1 59 ARG H 1 60 PRO HD3 5.340 . 5.340 4.988 4.896 5.110 . 0 0 "[ . 1 . 2]" 1
1232 1 59 ARG H 1 60 PRO HD2 5.500 . 5.500 4.769 4.717 4.819 . 0 0 "[ . 1 . 2]" 1
1233 1 59 ARG H 1 78 PHE QB 6.110 . 6.110 4.152 3.885 4.485 . 0 0 "[ . 1 . 2]" 1
1234 1 59 ARG H 1 79 GLN QB 5.730 . 5.730 3.818 3.551 4.036 . 0 0 "[ . 1 . 2]" 1
1235 1 59 ARG H 1 79 GLN H 3.920 . 3.920 3.407 3.160 3.632 . 0 0 "[ . 1 . 2]" 1
1236 1 59 ARG H 1 80 ILE HA 4.040 . 4.040 3.776 3.606 3.946 . 0 0 "[ . 1 . 2]" 1
1237 1 60 PRO HA 1 107 VAL QG 6.310 . 6.310 3.540 3.229 3.786 . 0 0 "[ . 1 . 2]" 1
1238 1 60 PRO HA 1 61 VAL MG1 5.370 . 5.370 3.587 3.328 3.741 . 0 0 "[ . 1 . 2]" 1
1239 1 60 PRO HA 1 61 VAL MG2 5.930 . 5.930 3.949 3.852 4.066 . 0 0 "[ . 1 . 2]" 1
1240 1 60 PRO HA 1 78 PHE HA 3.810 . 3.810 1.933 1.897 1.972 . 0 0 "[ . 1 . 2]" 1
1241 1 60 PRO HA 1 78 PHE HB3 4.510 . 4.510 2.648 2.352 2.942 . 0 0 "[ . 1 . 2]" 1
1242 1 60 PRO HA 1 78 PHE HB2 4.510 . 4.510 3.166 2.862 3.493 . 0 0 "[ . 1 . 2]" 1
1243 1 60 PRO HA 1 78 PHE QB 4.800 . 4.800 2.518 2.249 2.746 . 0 0 "[ . 1 . 2]" 1
1244 1 60 PRO HB3 1 61 VAL H 3.920 . 3.920 3.557 3.415 3.740 . 0 0 "[ . 1 . 2]" 1
1245 1 60 PRO HB3 1 78 PHE HA 5.070 . 5.070 3.963 3.830 4.066 . 0 0 "[ . 1 . 2]" 1
1246 1 60 PRO HB2 1 61 VAL H 3.920 . 3.920 2.959 2.596 3.282 . 0 0 "[ . 1 . 2]" 1
1247 1 60 PRO HB2 1 78 PHE HA 5.070 . 5.070 4.430 4.275 4.613 . 0 0 "[ . 1 . 2]" 1
1248 1 60 PRO QB 1 103 GLN QE 5.460 . 5.460 2.273 1.842 2.656 . 0 0 "[ . 1 . 2]" 1
1249 1 60 PRO QB 1 107 VAL QG 7.830 . 7.830 3.626 3.146 3.916 . 0 0 "[ . 1 . 2]" 1
1250 1 60 PRO QB 1 61 VAL H 4.100 . 4.100 2.816 2.523 3.059 . 0 0 "[ . 1 . 2]" 1
1251 1 60 PRO QB 1 78 PHE HA 5.240 . 5.240 3.698 3.573 3.809 . 0 0 "[ . 1 . 2]" 1
1252 1 60 PRO HD3 1 107 VAL MG1 5.510 . 5.510 2.868 2.029 3.217 . 0 0 "[ . 1 . 2]" 1
1253 1 60 PRO HD3 1 107 VAL MG2 5.510 . 5.510 3.483 2.922 3.901 . 0 0 "[ . 1 . 2]" 1
1254 1 60 PRO HD3 1 107 VAL QG 5.710 . 5.710 2.735 1.994 3.073 . 0 0 "[ . 1 . 2]" 1
1255 1 60 PRO HD3 1 61 VAL H 5.500 . 5.500 5.491 5.425 5.515 0.015 6 0 "[ . 1 . 2]" 1
1256 1 60 PRO HD2 1 107 VAL MG1 6.520 . 6.520 3.851 3.171 4.363 . 0 0 "[ . 1 . 2]" 1
1257 1 60 PRO HD2 1 107 VAL MG2 6.520 . 6.520 4.849 4.389 5.271 . 0 0 "[ . 1 . 2]" 1
1258 1 60 PRO HD2 1 107 VAL QG 6.610 . 6.610 3.708 3.102 4.165 . 0 0 "[ . 1 . 2]" 1
1259 1 60 PRO QG 1 103 GLN QE 5.970 . 5.970 2.708 2.084 3.214 . 0 0 "[ . 1 . 2]" 1
1260 1 60 PRO QG 1 107 VAL QG 7.580 . 7.580 4.010 3.491 4.244 . 0 0 "[ . 1 . 2]" 1
1261 1 61 VAL HA 1 62 THR MG 4.530 . 4.530 3.400 3.186 3.553 . 0 0 "[ . 1 . 2]" 1
1262 1 61 VAL HA 1 62 THR H 3.330 . 3.330 2.494 2.393 2.551 . 0 0 "[ . 1 . 2]" 1
1263 1 61 VAL HA 1 65 ASP QB 5.480 . 5.480 3.672 3.461 3.844 . 0 0 "[ . 1 . 2]" 1
1264 1 61 VAL HA 1 77 ILE MG 6.520 . 6.520 5.249 5.196 5.300 . 0 0 "[ . 1 . 2]" 1
1265 1 61 VAL HB 1 62 THR H 3.510 . 3.510 2.209 2.087 2.419 . 0 0 "[ . 1 . 2]" 1
1266 1 61 VAL HB 1 65 ASP HB3 4.430 . 4.430 2.520 2.221 2.794 . 0 0 "[ . 1 . 2]" 1
1267 1 61 VAL HB 1 65 ASP HB2 4.430 . 4.430 2.011 1.968 2.079 . 0 0 "[ . 1 . 2]" 1
1268 1 61 VAL HB 1 65 ASP H 4.450 . 4.450 3.925 3.868 3.995 . 0 0 "[ . 1 . 2]" 1
1269 1 61 VAL HB 1 77 ILE MG 5.740 . 5.740 4.065 3.916 4.165 . 0 0 "[ . 1 . 2]" 1
1270 1 61 VAL MG1 1 65 ASP HA 6.480 . 6.480 4.814 4.681 4.995 . 0 0 "[ . 1 . 2]" 1
1271 1 61 VAL MG1 1 65 ASP HB3 5.030 . 5.030 3.385 3.063 3.699 . 0 0 "[ . 1 . 2]" 1
1272 1 61 VAL MG1 1 65 ASP HB2 5.030 . 5.030 3.275 3.059 3.465 . 0 0 "[ . 1 . 2]" 1
1273 1 61 VAL MG1 1 77 ILE HB 5.760 . 5.760 3.856 3.611 4.195 . 0 0 "[ . 1 . 2]" 1
1274 1 61 VAL MG1 1 77 ILE MG 5.100 . 5.100 2.530 2.258 2.755 . 0 0 "[ . 1 . 2]" 1
1275 1 61 VAL MG1 1 78 PHE HA 4.940 . 4.940 2.743 2.357 2.952 . 0 0 "[ . 1 . 2]" 1
1276 1 61 VAL MG1 1 79 GLN HA 5.450 . 5.450 3.617 3.368 3.915 . 0 0 "[ . 1 . 2]" 1
1277 1 61 VAL MG1 1 79 GLN HB3 4.900 . 4.900 2.669 2.499 2.921 . 0 0 "[ . 1 . 2]" 1
1278 1 61 VAL MG1 1 79 GLN HB2 4.900 . 4.900 2.144 1.940 2.422 . 0 0 "[ . 1 . 2]" 1
1279 1 61 VAL MG1 1 79 GLN HE21 6.090 . 6.090 3.284 2.774 4.257 . 0 0 "[ . 1 . 2]" 1
1280 1 61 VAL MG1 1 79 GLN HE22 6.090 . 6.090 4.009 3.628 4.610 . 0 0 "[ . 1 . 2]" 1
1281 1 61 VAL MG1 1 79 GLN QE 6.300 . 6.300 3.137 2.713 3.928 . 0 0 "[ . 1 . 2]" 1
1282 1 61 VAL MG1 1 79 GLN HG3 5.460 . 5.460 3.950 3.701 4.301 . 0 0 "[ . 1 . 2]" 1
1283 1 61 VAL MG1 1 79 GLN H 4.760 . 4.760 2.711 2.386 3.063 . 0 0 "[ . 1 . 2]" 1
1284 1 61 VAL MG2 1 62 THR HA 5.350 . 5.350 3.786 3.646 3.986 . 0 0 "[ . 1 . 2]" 1
1285 1 61 VAL MG2 1 62 THR H 4.140 . 4.140 3.239 3.096 3.434 . 0 0 "[ . 1 . 2]" 1
1286 1 61 VAL MG2 1 65 ASP HA 6.520 . 6.520 5.279 5.158 5.362 . 0 0 "[ . 1 . 2]" 1
1287 1 61 VAL MG2 1 65 ASP HB3 5.450 . 5.450 2.834 2.648 3.019 . 0 0 "[ . 1 . 2]" 1
1288 1 61 VAL MG2 1 65 ASP HB2 5.450 . 5.450 3.322 3.089 3.510 . 0 0 "[ . 1 . 2]" 1
1289 1 61 VAL MG2 1 65 ASP QB 5.780 . 5.780 2.680 2.547 2.786 . 0 0 "[ . 1 . 2]" 1
1290 1 61 VAL MG2 1 65 ASP H 5.600 . 5.600 4.515 4.463 4.574 . 0 0 "[ . 1 . 2]" 1
1291 1 61 VAL MG2 1 74 ILE HA 5.130 . 5.130 3.119 2.869 3.412 . 0 0 "[ . 1 . 2]" 1
1292 1 61 VAL MG2 1 77 ILE HA 5.440 . 5.440 3.856 3.643 4.022 . 0 0 "[ . 1 . 2]" 1
1293 1 61 VAL MG2 1 77 ILE HB 4.380 . 4.380 1.985 1.866 2.178 . 0 0 "[ . 1 . 2]" 1
1294 1 61 VAL MG2 1 77 ILE MG 5.010 . 5.010 1.907 1.847 2.025 . 0 0 "[ . 1 . 2]" 1
1295 1 61 VAL MG2 1 78 PHE HA 5.370 . 5.370 3.338 3.045 3.713 . 0 0 "[ . 1 . 2]" 1
1296 1 61 VAL MG2 1 78 PHE H 5.780 . 5.780 3.942 3.547 4.284 . 0 0 "[ . 1 . 2]" 1
1297 1 61 VAL H 1 103 GLN QE 6.200 . 6.200 5.107 3.735 5.578 . 0 0 "[ . 1 . 2]" 1
1298 1 61 VAL H 1 61 VAL HB 3.920 . 3.920 3.702 3.674 3.766 . 0 0 "[ . 1 . 2]" 1
1299 1 61 VAL H 1 61 VAL MG2 4.230 . 4.230 2.118 1.953 2.242 . 0 0 "[ . 1 . 2]" 1
1300 1 61 VAL H 1 62 THR H 4.570 . 4.570 4.524 4.483 4.568 . 0 0 "[ . 1 . 2]" 1
1301 1 61 VAL H 1 77 ILE HB 4.550 . 4.550 4.010 3.771 4.197 . 0 0 "[ . 1 . 2]" 1
1302 1 61 VAL H 1 78 PHE HA 4.060 . 4.060 2.559 2.045 2.916 . 0 0 "[ . 1 . 2]" 1
1303 1 61 VAL H 1 78 PHE QB 5.190 . 5.190 4.034 3.616 4.328 . 0 0 "[ . 1 . 2]" 1
1304 1 61 VAL H 1 78 PHE H 5.110 . 5.110 4.690 4.351 5.039 . 0 0 "[ . 1 . 2]" 1
1305 1 61 VAL H 1 79 GLN H 4.680 . 4.680 4.003 3.824 4.341 . 0 0 "[ . 1 . 2]" 1
1306 1 62 THR HA 1 62 THR HB 3.010 . 3.010 2.445 2.391 2.505 . 0 0 "[ . 1 . 2]" 1
1307 1 62 THR HA 1 63 GLN H 3.120 . 3.120 2.649 2.576 2.677 . 0 0 "[ . 1 . 2]" 1
1308 1 62 THR HA 1 64 THR H 4.270 . 4.270 4.180 4.160 4.208 . 0 0 "[ . 1 . 2]" 1
1309 1 62 THR HA 1 74 ILE MD 6.120 . 6.120 4.487 4.273 4.804 . 0 0 "[ . 1 . 2]" 1
1310 1 62 THR HA 1 74 ILE MG 4.470 . 4.470 2.078 1.902 2.352 . 0 0 "[ . 1 . 2]" 1
1311 1 62 THR HB 1 63 GLN QB 5.650 . 5.650 3.759 3.686 3.838 . 0 0 "[ . 1 . 2]" 1
1312 1 62 THR HB 1 63 GLN H 3.110 . 3.110 2.011 1.976 2.126 . 0 0 "[ . 1 . 2]" 1
1313 1 62 THR HB 1 64 THR H 3.750 . 3.750 3.036 2.847 3.238 . 0 0 "[ . 1 . 2]" 1
1314 1 62 THR HB 1 74 ILE MG 5.590 . 5.590 3.599 3.326 3.778 . 0 0 "[ . 1 . 2]" 1
1315 1 62 THR MG 1 63 GLN H 5.040 . 5.040 3.608 3.507 3.689 . 0 0 "[ . 1 . 2]" 1
1316 1 62 THR MG 1 74 ILE MG 6.070 . 6.070 3.671 3.501 3.955 . 0 0 "[ . 1 . 2]" 1
1317 1 62 THR H 1 62 THR MG 4.570 . 4.570 2.852 2.637 3.064 . 0 0 "[ . 1 . 2]" 1
1318 1 62 THR H 1 65 ASP HB3 3.980 . 3.980 3.635 3.390 3.982 0.002 8 0 "[ . 1 . 2]" 1
1319 1 62 THR H 1 65 ASP HB2 3.980 . 3.980 2.326 2.119 2.637 . 0 0 "[ . 1 . 2]" 1
1320 1 62 THR H 1 65 ASP QB 4.370 . 4.370 2.299 2.104 2.585 . 0 0 "[ . 1 . 2]" 1
1321 1 62 THR H 1 65 ASP H 4.010 . 4.010 3.122 3.028 3.300 . 0 0 "[ . 1 . 2]" 1
1322 1 62 THR H 1 66 VAL H 5.490 . 5.490 5.128 4.812 5.490 . 0 0 "[ . 1 . 2]" 1
1323 1 63 GLN HA 1 63 GLN QE 4.420 . 4.420 2.874 2.177 3.455 . 0 0 "[ . 1 . 2]" 1
1324 1 63 GLN HA 1 66 VAL H 4.100 . 4.100 3.600 3.499 3.728 . 0 0 "[ . 1 . 2]" 1
1325 1 63 GLN HA 1 69 ALA MB 6.520 . 6.520 4.868 4.686 5.085 . 0 0 "[ . 1 . 2]" 1
1326 1 63 GLN HA 1 74 ILE MD 4.350 . 4.350 2.455 2.155 2.678 . 0 0 "[ . 1 . 2]" 1
1327 1 63 GLN HA 1 74 ILE HG13 4.460 . 4.460 2.657 2.481 2.877 . 0 0 "[ . 1 . 2]" 1
1328 1 63 GLN HA 1 74 ILE HG12 4.490 . 4.490 4.241 4.080 4.405 . 0 0 "[ . 1 . 2]" 1
1329 1 63 GLN HA 1 74 ILE MG 4.760 . 4.760 2.666 2.081 3.187 . 0 0 "[ . 1 . 2]" 1
1330 1 63 GLN QB 1 64 THR HA 5.920 . 5.920 4.138 4.065 4.174 . 0 0 "[ . 1 . 2]" 1
1331 1 63 GLN QB 1 64 THR MG 5.880 . 5.880 3.353 3.115 3.578 . 0 0 "[ . 1 . 2]" 1
1332 1 63 GLN QB 1 64 THR H 4.110 . 4.110 3.091 2.977 3.174 . 0 0 "[ . 1 . 2]" 1
1333 1 63 GLN QB 1 71 ALA MB 7.320 . 7.320 4.617 4.440 4.921 . 0 0 "[ . 1 . 2]" 1
1334 1 63 GLN QB 1 74 ILE MD 6.240 . 6.240 3.952 3.593 4.243 . 0 0 "[ . 1 . 2]" 1
1335 1 63 GLN QB 1 74 ILE HG13 5.640 . 5.640 3.162 2.810 3.408 . 0 0 "[ . 1 . 2]" 1
1336 1 63 GLN QB 1 74 ILE HG12 5.830 . 5.830 4.741 4.409 4.961 . 0 0 "[ . 1 . 2]" 1
1337 1 63 GLN QB 1 74 ILE MG 5.570 . 5.570 3.137 2.788 3.624 . 0 0 "[ . 1 . 2]" 1
1338 1 63 GLN HE21 1 69 ALA MB 5.480 . 5.480 3.988 3.554 4.261 . 0 0 "[ . 1 . 2]" 1
1339 1 63 GLN HE22 1 69 ALA MB 5.480 . 5.480 3.973 3.460 4.399 . 0 0 "[ . 1 . 2]" 1
1340 1 63 GLN QE 1 67 TYR HA 4.340 . 4.340 3.488 3.261 3.712 . 0 0 "[ . 1 . 2]" 1
1341 1 63 GLN QE 1 67 TYR QB 7.060 . 7.060 5.020 4.810 5.195 . 0 0 "[ . 1 . 2]" 1
1342 1 63 GLN QE 1 69 ALA MB 5.790 . 5.790 3.543 3.123 3.836 . 0 0 "[ . 1 . 2]" 1
1343 1 63 GLN QE 1 70 ASP HA 6.200 . 6.200 3.740 3.288 4.054 . 0 0 "[ . 1 . 2]" 1
1344 1 63 GLN QE 1 71 ALA HA 4.240 . 4.240 2.908 2.514 3.201 . 0 0 "[ . 1 . 2]" 1
1345 1 63 GLN QE 1 74 ILE HG13 5.110 . 5.110 2.829 2.301 3.314 . 0 0 "[ . 1 . 2]" 1
1346 1 63 GLN QE 1 74 ILE HG12 5.840 . 5.840 3.209 2.923 3.602 . 0 0 "[ . 1 . 2]" 1
1347 1 63 GLN QG 1 64 THR HA 5.400 . 5.400 4.197 3.996 4.341 . 0 0 "[ . 1 . 2]" 1
1348 1 63 GLN QG 1 64 THR H 5.280 . 5.280 4.222 4.047 4.330 . 0 0 "[ . 1 . 2]" 1
1349 1 63 GLN QG 1 66 VAL MG2 6.980 . 6.980 4.175 3.738 4.783 . 0 0 "[ . 1 . 2]" 1
1350 1 63 GLN QG 1 66 VAL H 5.700 . 5.700 4.583 4.358 4.713 . 0 0 "[ . 1 . 2]" 1
1351 1 63 GLN QG 1 67 TYR HA 4.730 . 4.730 3.927 3.772 3.988 . 0 0 "[ . 1 . 2]" 1
1352 1 63 GLN QG 1 71 ALA MB 6.930 . 6.930 4.724 4.456 4.900 . 0 0 "[ . 1 . 2]" 1
1353 1 63 GLN QG 1 74 ILE MD 6.160 . 6.160 3.799 3.443 4.173 . 0 0 "[ . 1 . 2]" 1
1354 1 63 GLN QG 1 74 ILE HG13 6.070 . 6.070 3.965 3.715 4.313 . 0 0 "[ . 1 . 2]" 1
1355 1 63 GLN QG 1 74 ILE MG 6.760 . 6.760 4.448 4.161 4.888 . 0 0 "[ . 1 . 2]" 1
1356 1 63 GLN H 1 63 GLN QB 3.780 . 3.780 2.225 2.192 2.241 . 0 0 "[ . 1 . 2]" 1
1357 1 63 GLN H 1 63 GLN QG 5.050 . 5.050 4.039 4.028 4.051 . 0 0 "[ . 1 . 2]" 1
1358 1 63 GLN H 1 64 THR MG 5.440 . 5.440 3.831 3.589 4.157 . 0 0 "[ . 1 . 2]" 1
1359 1 63 GLN H 1 64 THR H 3.610 . 3.610 2.653 2.626 2.698 . 0 0 "[ . 1 . 2]" 1
1360 1 63 GLN H 1 74 ILE MD 5.870 . 5.870 4.400 4.167 4.582 . 0 0 "[ . 1 . 2]" 1
1361 1 63 GLN H 1 74 ILE HG13 5.500 . 5.500 4.082 3.836 4.379 . 0 0 "[ . 1 . 2]" 1
1362 1 63 GLN H 1 74 ILE MG 4.430 . 4.430 2.583 2.286 2.905 . 0 0 "[ . 1 . 2]" 1
1363 1 64 THR HB 1 65 ASP H 4.350 . 4.350 4.019 3.867 4.179 . 0 0 "[ . 1 . 2]" 1
1364 1 64 THR MG 1 65 ASP H 5.180 . 5.180 3.912 3.668 4.097 . 0 0 "[ . 1 . 2]" 1
1365 1 64 THR MG 1 66 VAL H 6.520 . 6.520 5.297 5.156 5.413 . 0 0 "[ . 1 . 2]" 1
1366 1 64 THR H 1 64 THR HB 3.680 . 3.680 3.610 3.584 3.627 . 0 0 "[ . 1 . 2]" 1
1367 1 64 THR H 1 64 THR MG 4.040 . 4.040 2.243 1.948 2.509 . 0 0 "[ . 1 . 2]" 1
1368 1 64 THR H 1 65 ASP HB3 5.500 . 5.500 5.210 4.887 5.498 . 0 0 "[ . 1 . 2]" 1
1369 1 64 THR H 1 65 ASP HB2 5.500 . 5.500 4.342 4.173 4.648 . 0 0 "[ . 1 . 2]" 1
1370 1 64 THR H 1 65 ASP QB 5.540 . 5.540 4.129 4.051 4.290 . 0 0 "[ . 1 . 2]" 1
1371 1 64 THR H 1 66 VAL H 4.410 . 4.410 4.123 3.988 4.297 . 0 0 "[ . 1 . 2]" 1
1372 1 64 THR H 1 74 ILE MG 5.510 . 5.510 4.218 4.104 4.447 . 0 0 "[ . 1 . 2]" 1
1373 1 65 ASP HA 1 66 VAL MG2 5.800 . 5.800 4.569 4.280 4.720 . 0 0 "[ . 1 . 2]" 1
1374 1 65 ASP HB3 1 66 VAL MG2 5.380 . 5.380 2.750 2.297 3.070 . 0 0 "[ . 1 . 2]" 1
1375 1 65 ASP HB3 1 66 VAL H 4.040 . 4.040 2.994 2.734 3.248 . 0 0 "[ . 1 . 2]" 1
1376 1 65 ASP HB2 1 66 VAL MG2 5.380 . 5.380 3.962 3.708 4.200 . 0 0 "[ . 1 . 2]" 1
1377 1 65 ASP HB2 1 66 VAL H 4.040 . 4.040 3.693 3.473 3.923 . 0 0 "[ . 1 . 2]" 1
1378 1 65 ASP QB 1 66 VAL MG1 5.950 . 5.950 3.137 2.806 3.726 . 0 0 "[ . 1 . 2]" 1
1379 1 65 ASP QB 1 66 VAL MG2 5.530 . 5.530 2.693 2.279 2.988 . 0 0 "[ . 1 . 2]" 1
1380 1 65 ASP H 1 65 ASP HB3 3.320 . 3.320 2.943 2.661 3.207 . 0 0 "[ . 1 . 2]" 1
1381 1 65 ASP H 1 65 ASP HB2 3.320 . 3.320 2.211 2.086 2.410 . 0 0 "[ . 1 . 2]" 1
1382 1 65 ASP H 1 66 VAL MG2 5.140 . 5.140 3.780 3.633 3.996 . 0 0 "[ . 1 . 2]" 1
1383 1 65 ASP H 1 66 VAL H 3.140 . 3.140 2.577 2.492 2.669 . 0 0 "[ . 1 . 2]" 1
1384 1 66 VAL HA 1 67 TYR H 3.110 . 3.110 2.525 2.267 2.632 . 0 0 "[ . 1 . 2]" 1
1385 1 66 VAL HA 1 69 ALA MB 5.530 . 5.530 4.384 4.179 4.487 . 0 0 "[ . 1 . 2]" 1
1386 1 66 VAL HB 1 67 TYR H 3.470 . 3.470 2.125 1.896 2.775 . 0 0 "[ . 1 . 2]" 1
1387 1 66 VAL HB 1 69 ALA HA 5.160 . 5.160 4.517 4.205 4.636 . 0 0 "[ . 1 . 2]" 1
1388 1 66 VAL HB 1 69 ALA MB 4.550 . 4.550 2.134 1.955 2.345 . 0 0 "[ . 1 . 2]" 1
1389 1 66 VAL HB 1 69 ALA H 3.990 . 3.990 2.555 2.352 2.713 . 0 0 "[ . 1 . 2]" 1
1390 1 66 VAL HB 1 74 ILE MD 5.270 . 5.270 3.743 3.544 4.050 . 0 0 "[ . 1 . 2]" 1
1391 1 66 VAL MG1 1 67 TYR QB 7.240 . 7.240 5.312 5.260 5.376 . 0 0 "[ . 1 . 2]" 1
1392 1 66 VAL MG1 1 68 ARG QD 6.510 . 6.510 3.919 2.902 4.649 . 0 0 "[ . 1 . 2]" 1
1393 1 66 VAL MG1 1 68 ARG H 5.840 . 5.840 4.438 4.166 4.796 . 0 0 "[ . 1 . 2]" 1
1394 1 66 VAL MG1 1 69 ALA HA 6.330 . 6.330 4.807 4.619 4.965 . 0 0 "[ . 1 . 2]" 1
1395 1 66 VAL MG1 1 69 ALA MB 5.300 . 5.300 2.669 2.424 2.967 . 0 0 "[ . 1 . 2]" 1
1396 1 66 VAL MG1 1 69 ALA H 5.350 . 5.350 3.794 3.608 3.917 . 0 0 "[ . 1 . 2]" 1
1397 1 66 VAL MG2 1 67 TYR HA 5.680 . 5.680 4.135 3.927 4.572 . 0 0 "[ . 1 . 2]" 1
1398 1 66 VAL MG2 1 69 ALA HA 5.880 . 5.880 4.378 4.113 4.650 . 0 0 "[ . 1 . 2]" 1
1399 1 66 VAL MG2 1 69 ALA MB 5.200 . 5.200 1.896 1.784 2.090 0.016 3 0 "[ . 1 . 2]" 1
1400 1 66 VAL MG2 1 70 ASP H 5.710 . 5.710 4.211 4.048 4.360 . 0 0 "[ . 1 . 2]" 1
1401 1 66 VAL MG2 1 74 ILE MD 4.680 . 4.680 1.833 1.713 2.074 0.087 19 0 "[ . 1 . 2]" 1
1402 1 66 VAL H 1 66 VAL HB 3.940 . 3.940 3.754 3.707 3.794 . 0 0 "[ . 1 . 2]" 1
1403 1 66 VAL H 1 67 TYR H 4.360 . 4.360 4.385 4.368 4.396 0.036 7 0 "[ . 1 . 2]" 1
1404 1 67 TYR HA 1 74 ILE MD 6.100 . 6.100 4.888 4.737 4.951 . 0 0 "[ . 1 . 2]" 1
1405 1 67 TYR QB 1 68 ARG H 4.940 . 4.940 3.108 2.077 3.297 . 0 0 "[ . 1 . 2]" 1
1406 1 67 TYR H 1 68 ARG HA 5.030 . 5.030 4.650 4.551 4.862 . 0 0 "[ . 1 . 2]" 1
1407 1 67 TYR H 1 68 ARG QB 6.010 . 6.010 4.421 4.282 4.707 . 0 0 "[ . 1 . 2]" 1
1408 1 67 TYR H 1 68 ARG QG 6.320 . 6.320 3.403 2.944 4.343 . 0 0 "[ . 1 . 2]" 1
1409 1 67 TYR H 1 69 ALA MB 5.850 . 5.850 3.584 3.237 4.092 . 0 0 "[ . 1 . 2]" 1
1410 1 67 TYR H 1 69 ALA H 4.660 . 4.660 2.785 2.493 3.302 . 0 0 "[ . 1 . 2]" 1
1411 1 68 ARG HA 1 68 ARG QD 4.820 . 4.820 3.857 3.567 4.156 . 0 0 "[ . 1 . 2]" 1
1412 1 68 ARG HA 1 69 ALA MB 6.520 . 6.520 4.937 4.904 4.964 . 0 0 "[ . 1 . 2]" 1
1413 1 68 ARG HA 1 69 ALA H 3.520 . 3.520 3.450 3.361 3.475 . 0 0 "[ . 1 . 2]" 1
1414 1 68 ARG QB 1 69 ALA HA 5.830 . 5.830 4.443 4.291 4.600 . 0 0 "[ . 1 . 2]" 1
1415 1 68 ARG QB 1 69 ALA H 5.190 . 5.190 3.614 3.553 3.728 . 0 0 "[ . 1 . 2]" 1
1416 1 68 ARG QD 1 69 ALA HA 6.380 . 6.380 4.067 2.409 5.608 . 0 0 "[ . 1 . 2]" 1
1417 1 68 ARG QD 1 69 ALA H 4.720 . 4.720 3.117 2.015 4.134 . 0 0 "[ . 1 . 2]" 1
1418 1 68 ARG QG 1 69 ALA H 4.150 . 4.150 2.392 2.026 3.561 . 0 0 "[ . 1 . 2]" 1
1419 1 68 ARG H 1 68 ARG HB3 4.070 . 4.070 2.627 2.372 2.930 . 0 0 "[ . 1 . 2]" 1
1420 1 68 ARG H 1 68 ARG HB2 4.070 . 4.070 3.594 3.564 3.616 . 0 0 "[ . 1 . 2]" 1
1421 1 68 ARG H 1 68 ARG QD 5.230 . 5.230 2.792 1.870 4.254 . 0 0 "[ . 1 . 2]" 1
1422 1 68 ARG H 1 69 ALA H 3.330 . 3.330 2.531 2.436 2.675 . 0 0 "[ . 1 . 2]" 1
1423 1 69 ALA HA 1 70 ASP QB 5.560 . 5.560 3.973 3.919 4.116 . 0 0 "[ . 1 . 2]" 1
1424 1 69 ALA HA 1 70 ASP H 3.030 . 3.030 2.718 2.622 2.788 . 0 0 "[ . 1 . 2]" 1
1425 1 69 ALA HA 1 73 GLU HG2 5.500 . 5.500 5.348 4.351 5.506 0.006 17 0 "[ . 1 . 2]" 1
1426 1 69 ALA HA 1 74 ILE MD 5.730 . 5.730 4.533 4.345 4.679 . 0 0 "[ . 1 . 2]" 1
1427 1 69 ALA HA 1 77 ILE MD 6.360 . 6.360 4.845 4.422 5.196 . 0 0 "[ . 1 . 2]" 1
1428 1 69 ALA MB 1 70 ASP HA 5.490 . 5.490 3.951 3.894 4.010 . 0 0 "[ . 1 . 2]" 1
1429 1 69 ALA MB 1 70 ASP QB 6.520 . 6.520 3.920 3.853 3.962 . 0 0 "[ . 1 . 2]" 1
1430 1 69 ALA MB 1 70 ASP H 4.240 . 4.240 2.006 1.933 2.124 . 0 0 "[ . 1 . 2]" 1
1431 1 69 ALA MB 1 71 ALA HA 6.520 . 6.520 5.063 4.983 5.164 . 0 0 "[ . 1 . 2]" 1
1432 1 69 ALA MB 1 73 GLU HB3 6.250 . 6.250 3.889 3.394 4.674 . 0 0 "[ . 1 . 2]" 1
1433 1 69 ALA MB 1 73 GLU HB2 6.250 . 6.250 2.950 2.587 4.317 . 0 0 "[ . 1 . 2]" 1
1434 1 69 ALA MB 1 73 GLU QB 6.400 . 6.400 2.860 2.511 3.983 . 0 0 "[ . 1 . 2]" 1
1435 1 69 ALA MB 1 73 GLU HG3 5.520 . 5.520 3.795 2.572 4.309 . 0 0 "[ . 1 . 2]" 1
1436 1 69 ALA MB 1 74 ILE HA 6.010 . 6.010 4.214 3.976 4.427 . 0 0 "[ . 1 . 2]" 1
1437 1 69 ALA MB 1 74 ILE MD 5.210 . 5.210 2.093 1.941 2.284 . 0 0 "[ . 1 . 2]" 1
1438 1 69 ALA MB 1 77 ILE MD 5.460 . 5.460 2.866 2.518 3.107 . 0 0 "[ . 1 . 2]" 1
1439 1 69 ALA MB 1 77 ILE QG 6.920 . 6.920 4.637 4.268 4.955 . 0 0 "[ . 1 . 2]" 1
1440 1 69 ALA MB 1 96 LEU QD 8.540 . 8.540 3.975 3.494 4.455 . 0 0 "[ . 1 . 2]" 1
1441 1 69 ALA H 1 70 ASP H 4.670 . 4.670 4.508 4.430 4.567 . 0 0 "[ . 1 . 2]" 1
1442 1 70 ASP HA 1 71 ALA MB 5.330 . 5.330 4.024 3.967 4.071 . 0 0 "[ . 1 . 2]" 1
1443 1 70 ASP HA 1 72 LYS H 3.990 . 3.990 3.923 3.870 3.996 0.006 10 0 "[ . 1 . 2]" 1
1444 1 70 ASP HA 1 73 GLU H 4.640 . 4.640 4.380 4.277 4.649 0.009 8 0 "[ . 1 . 2]" 1
1445 1 70 ASP HA 1 74 ILE MD 6.350 . 6.350 4.368 4.256 4.495 . 0 0 "[ . 1 . 2]" 1
1446 1 70 ASP HA 1 74 ILE H 5.330 . 5.330 5.230 5.161 5.343 0.013 8 0 "[ . 1 . 2]" 1
1447 1 70 ASP QB 1 71 ALA H 4.700 . 4.700 3.407 3.018 3.610 . 0 0 "[ . 1 . 2]" 1
1448 1 70 ASP QB 1 72 LYS H 4.260 . 4.260 2.651 2.348 3.022 . 0 0 "[ . 1 . 2]" 1
1449 1 70 ASP QB 1 73 GLU QB 6.480 . 6.480 3.196 2.862 3.520 . 0 0 "[ . 1 . 2]" 1
1450 1 70 ASP QB 1 73 GLU HG3 5.580 . 5.580 2.797 2.299 3.763 . 0 0 "[ . 1 . 2]" 1
1451 1 70 ASP QB 1 73 GLU HG2 5.480 . 5.480 1.969 1.835 2.220 . 0 0 "[ . 1 . 2]" 1
1452 1 70 ASP QB 1 73 GLU H 4.610 . 4.610 2.412 2.303 2.694 . 0 0 "[ . 1 . 2]" 1
1453 1 70 ASP QB 1 74 ILE H 5.760 . 5.760 4.292 4.190 4.472 . 0 0 "[ . 1 . 2]" 1
1454 1 70 ASP H 1 70 ASP QB 3.870 . 3.870 2.518 2.418 2.584 . 0 0 "[ . 1 . 2]" 1
1455 1 70 ASP H 1 71 ALA HA 5.500 . 5.500 5.145 5.097 5.221 . 0 0 "[ . 1 . 2]" 1
1456 1 70 ASP H 1 73 GLU HB3 4.780 . 4.780 3.894 3.512 4.146 . 0 0 "[ . 1 . 2]" 1
1457 1 70 ASP H 1 73 GLU HB2 4.780 . 4.780 2.458 1.981 4.533 . 0 0 "[ . 1 . 2]" 1
1458 1 70 ASP H 1 73 GLU QB 4.950 . 4.950 2.405 1.971 3.839 . 0 0 "[ . 1 . 2]" 1
1459 1 70 ASP H 1 73 GLU HG3 4.080 . 4.080 3.020 2.685 3.466 . 0 0 "[ . 1 . 2]" 1
1460 1 70 ASP H 1 73 GLU HG2 4.340 . 4.340 3.204 1.962 3.433 . 0 0 "[ . 1 . 2]" 1
1461 1 70 ASP H 1 73 GLU H 4.090 . 4.090 3.565 3.426 3.753 . 0 0 "[ . 1 . 2]" 1
1462 1 70 ASP H 1 74 ILE HG13 5.500 . 5.500 5.506 5.500 5.513 0.013 18 0 "[ . 1 . 2]" 1
1463 1 70 ASP H 1 77 ILE MD 5.880 . 5.880 4.051 3.758 4.446 . 0 0 "[ . 1 . 2]" 1
1464 1 71 ALA HA 1 72 LYS QG 6.310 . 6.310 5.096 4.880 5.400 . 0 0 "[ . 1 . 2]" 1
1465 1 71 ALA HA 1 74 ILE HA 5.500 . 5.500 5.239 5.010 5.420 . 0 0 "[ . 1 . 2]" 1
1466 1 71 ALA HA 1 74 ILE HB 3.930 . 3.930 3.371 3.084 3.670 . 0 0 "[ . 1 . 2]" 1
1467 1 71 ALA HA 1 74 ILE MD 4.530 . 4.530 3.503 3.373 3.659 . 0 0 "[ . 1 . 2]" 1
1468 1 71 ALA HA 1 74 ILE HG13 4.770 . 4.770 2.595 2.274 2.856 . 0 0 "[ . 1 . 2]" 1
1469 1 71 ALA HA 1 74 ILE HG12 3.660 . 3.660 2.046 1.907 2.197 . 0 0 "[ . 1 . 2]" 1
1470 1 71 ALA HA 1 74 ILE MG 5.630 . 5.630 4.183 3.899 4.373 . 0 0 "[ . 1 . 2]" 1
1471 1 71 ALA HA 1 74 ILE H 3.790 . 3.790 3.466 3.392 3.593 . 0 0 "[ . 1 . 2]" 1
1472 1 71 ALA MB 1 72 LYS HA 5.200 . 5.200 3.855 3.768 3.910 . 0 0 "[ . 1 . 2]" 1
1473 1 71 ALA MB 1 72 LYS QB 6.550 . 6.550 4.379 3.934 4.540 . 0 0 "[ . 1 . 2]" 1
1474 1 71 ALA MB 1 74 ILE HB 6.520 . 6.520 4.420 4.116 4.709 . 0 0 "[ . 1 . 2]" 1
1475 1 71 ALA H 1 72 LYS H 3.300 . 3.300 2.806 2.768 2.829 . 0 0 "[ . 1 . 2]" 1
1476 1 71 ALA H 1 73 GLU H 4.560 . 4.560 4.234 4.101 4.530 . 0 0 "[ . 1 . 2]" 1
1477 1 72 LYS HA 1 72 LYS QD 4.930 . 4.930 3.589 2.019 4.335 . 0 0 "[ . 1 . 2]" 1
1478 1 72 LYS HA 1 72 LYS QE 5.710 . 5.710 4.458 3.191 4.920 . 0 0 "[ . 1 . 2]" 1
1479 1 72 LYS HA 1 74 ILE H 5.470 . 5.470 4.340 4.262 4.504 . 0 0 "[ . 1 . 2]" 1
1480 1 72 LYS HA 1 75 PRO HD3 5.030 . 5.030 3.866 3.807 3.979 . 0 0 "[ . 1 . 2]" 1
1481 1 72 LYS QG 1 73 GLU H 5.180 . 5.180 3.942 2.134 4.454 . 0 0 "[ . 1 . 2]" 1
1482 1 72 LYS H 1 72 LYS QB 3.580 . 3.580 2.450 2.202 2.733 . 0 0 "[ . 1 . 2]" 1
1483 1 72 LYS H 1 72 LYS QD 4.910 . 4.910 3.723 2.273 4.254 . 0 0 "[ . 1 . 2]" 1
1484 1 72 LYS H 1 72 LYS QE 5.430 . 5.430 4.039 2.948 4.635 . 0 0 "[ . 1 . 2]" 1
1485 1 72 LYS H 1 73 GLU HG2 4.410 . 4.410 3.846 3.678 4.077 . 0 0 "[ . 1 . 2]" 1
1486 1 72 LYS H 1 73 GLU H 3.060 . 3.060 2.435 2.351 2.600 . 0 0 "[ . 1 . 2]" 1
1487 1 72 LYS H 1 74 ILE H 4.130 . 4.130 3.953 3.890 4.104 . 0 0 "[ . 1 . 2]" 1
1488 1 72 LYS H 1 75 PRO HD3 5.500 . 5.500 5.200 5.128 5.308 . 0 0 "[ . 1 . 2]" 1
1489 1 72 LYS H 1 75 PRO HD2 4.790 . 4.790 4.454 4.379 4.546 . 0 0 "[ . 1 . 2]" 1
1490 1 73 GLU HA 1 73 GLU HG3 3.900 . 3.900 3.801 3.673 3.880 . 0 0 "[ . 1 . 2]" 1
1491 1 73 GLU HA 1 73 GLU HG2 3.960 . 3.960 3.172 2.967 3.821 . 0 0 "[ . 1 . 2]" 1
1492 1 73 GLU HA 1 74 ILE HA 5.500 . 5.500 4.921 4.898 4.936 . 0 0 "[ . 1 . 2]" 1
1493 1 73 GLU HA 1 75 PRO QG 4.910 . 4.910 4.085 3.978 4.158 . 0 0 "[ . 1 . 2]" 1
1494 1 73 GLU HA 1 76 ARG HD3 4.930 . 4.930 4.719 4.359 4.936 0.006 15 0 "[ . 1 . 2]" 1
1495 1 73 GLU HA 1 76 ARG HD2 4.930 . 4.930 4.185 3.516 4.791 . 0 0 "[ . 1 . 2]" 1
1496 1 73 GLU HA 1 76 ARG QD 5.120 . 5.120 3.889 3.426 4.199 . 0 0 "[ . 1 . 2]" 1
1497 1 73 GLU HA 1 76 ARG H 3.890 . 3.890 3.351 3.291 3.408 . 0 0 "[ . 1 . 2]" 1
1498 1 73 GLU HA 1 77 ILE MD 5.500 . 5.500 3.806 3.519 4.102 . 0 0 "[ . 1 . 2]" 1
1499 1 73 GLU HA 1 77 ILE H 5.060 . 5.060 5.065 5.019 5.071 0.011 10 0 "[ . 1 . 2]" 1
1500 1 73 GLU HA 1 96 LEU QD 6.540 . 6.540 2.899 2.656 3.083 . 0 0 "[ . 1 . 2]" 1
1501 1 73 GLU HB3 1 74 ILE H 4.250 . 4.250 3.925 3.744 4.136 . 0 0 "[ . 1 . 2]" 1
1502 1 73 GLU HB2 1 74 ILE H 4.250 . 4.250 2.865 2.627 3.899 . 0 0 "[ . 1 . 2]" 1
1503 1 73 GLU QB 1 77 ILE MD 6.140 . 6.140 2.209 1.883 2.583 . 0 0 "[ . 1 . 2]" 1
1504 1 73 GLU QB 1 96 LEU QD 6.900 . 6.900 1.901 1.793 2.151 0.007 17 0 "[ . 1 . 2]" 1
1505 1 73 GLU HG3 1 74 ILE H 5.210 . 5.210 4.828 2.302 5.158 . 0 0 "[ . 1 . 2]" 1
1506 1 73 GLU HG3 1 77 ILE MD 5.870 . 5.870 4.014 2.602 4.420 . 0 0 "[ . 1 . 2]" 1
1507 1 73 GLU HG3 1 96 LEU QD 6.680 . 6.680 3.241 2.732 3.654 . 0 0 "[ . 1 . 2]" 1
1508 1 73 GLU HG2 1 77 ILE MD 6.050 . 6.050 4.622 3.930 4.904 . 0 0 "[ . 1 . 2]" 1
1509 1 73 GLU HG2 1 96 LEU QD 6.430 . 6.430 3.951 3.589 4.104 . 0 0 "[ . 1 . 2]" 1
1510 1 73 GLU H 1 74 ILE MD 5.200 . 5.200 4.132 4.009 4.216 . 0 0 "[ . 1 . 2]" 1
1511 1 73 GLU H 1 74 ILE HG12 4.530 . 4.530 3.651 3.637 3.669 . 0 0 "[ . 1 . 2]" 1
1512 1 73 GLU H 1 74 ILE H 3.420 . 3.420 2.422 2.407 2.449 . 0 0 "[ . 1 . 2]" 1
1513 1 73 GLU H 1 75 PRO HD3 4.790 . 4.790 4.773 4.671 4.803 0.013 8 0 "[ . 1 . 2]" 1
1514 1 73 GLU H 1 75 PRO HD2 3.930 . 3.930 3.393 3.276 3.482 . 0 0 "[ . 1 . 2]" 1
1515 1 73 GLU H 1 77 ILE MD 5.850 . 5.850 4.544 4.374 4.691 . 0 0 "[ . 1 . 2]" 1
1516 1 73 GLU H 1 96 LEU QD 7.360 . 7.360 4.620 4.418 4.819 . 0 0 "[ . 1 . 2]" 1
1517 1 74 ILE HA 1 74 ILE MD 4.310 . 4.310 2.004 1.954 2.139 . 0 0 "[ . 1 . 2]" 1
1518 1 74 ILE HA 1 77 ILE HB 4.500 . 4.500 3.092 2.962 3.225 . 0 0 "[ . 1 . 2]" 1
1519 1 74 ILE HA 1 77 ILE MD 4.650 . 4.650 2.262 1.984 2.434 . 0 0 "[ . 1 . 2]" 1
1520 1 74 ILE HA 1 77 ILE MG 5.690 . 5.690 4.384 4.274 4.501 . 0 0 "[ . 1 . 2]" 1
1521 1 74 ILE HA 1 77 ILE H 3.950 . 3.950 3.781 3.674 3.949 . 0 0 "[ . 1 . 2]" 1
1522 1 74 ILE HB 1 75 PRO HD3 4.190 . 4.190 1.884 1.844 1.909 . 0 0 "[ . 1 . 2]" 1
1523 1 74 ILE HB 1 75 PRO HD2 4.060 . 4.060 2.723 2.674 2.815 . 0 0 "[ . 1 . 2]" 1
1524 1 74 ILE HB 1 75 PRO QG 5.590 . 5.590 3.893 3.869 3.920 . 0 0 "[ . 1 . 2]" 1
1525 1 74 ILE MD 1 75 PRO HD3 6.150 . 6.150 4.585 4.525 4.617 . 0 0 "[ . 1 . 2]" 1
1526 1 74 ILE MD 1 77 ILE HB 5.560 . 5.560 4.146 4.004 4.267 . 0 0 "[ . 1 . 2]" 1
1527 1 74 ILE HG12 1 75 PRO HD2 5.250 . 5.250 3.597 3.553 3.697 . 0 0 "[ . 1 . 2]" 1
1528 1 74 ILE MG 1 75 PRO HA 4.950 . 4.950 3.595 3.551 3.701 . 0 0 "[ . 1 . 2]" 1
1529 1 74 ILE MG 1 75 PRO HB3 6.290 . 6.290 4.555 4.416 4.647 . 0 0 "[ . 1 . 2]" 1
1530 1 74 ILE MG 1 75 PRO HD3 5.190 . 5.190 3.317 3.256 3.353 . 0 0 "[ . 1 . 2]" 1
1531 1 74 ILE MG 1 75 PRO HD2 5.510 . 5.510 4.045 4.010 4.100 . 0 0 "[ . 1 . 2]" 1
1532 1 74 ILE MG 1 75 PRO QG 6.790 . 6.790 4.674 4.644 4.697 . 0 0 "[ . 1 . 2]" 1
1533 1 74 ILE H 1 74 ILE HB 3.140 . 3.140 2.748 2.723 2.788 . 0 0 "[ . 1 . 2]" 1
1534 1 74 ILE H 1 74 ILE MD 4.530 . 4.530 2.604 2.488 2.682 . 0 0 "[ . 1 . 2]" 1
1535 1 74 ILE H 1 74 ILE HG13 3.820 . 3.820 3.520 3.505 3.533 . 0 0 "[ . 1 . 2]" 1
1536 1 74 ILE H 1 74 ILE HG12 3.340 . 3.340 1.949 1.938 1.965 . 0 0 "[ . 1 . 2]" 1
1537 1 74 ILE H 1 75 PRO HD3 3.490 . 3.490 3.299 3.234 3.358 . 0 0 "[ . 1 . 2]" 1
1538 1 74 ILE H 1 75 PRO HD2 3.420 . 3.420 2.307 2.251 2.378 . 0 0 "[ . 1 . 2]" 1
1539 1 74 ILE H 1 75 PRO QG 5.590 . 5.590 4.183 4.132 4.252 . 0 0 "[ . 1 . 2]" 1
1540 1 74 ILE H 1 76 ARG H 4.700 . 4.700 4.029 3.998 4.070 . 0 0 "[ . 1 . 2]" 1
1541 1 74 ILE H 1 77 ILE MD 5.350 . 5.350 3.454 3.273 3.693 . 0 0 "[ . 1 . 2]" 1
1542 1 75 PRO HA 1 100 THR MG 5.220 . 5.220 3.928 3.784 4.059 . 0 0 "[ . 1 . 2]" 1
1543 1 75 PRO HA 1 77 ILE H 4.600 . 4.600 3.765 3.691 3.817 . 0 0 "[ . 1 . 2]" 1
1544 1 75 PRO HB3 1 100 THR MG 4.640 . 4.640 3.459 3.312 3.606 . 0 0 "[ . 1 . 2]" 1
1545 1 75 PRO HB2 1 100 THR HB 5.040 . 5.040 4.858 4.663 5.043 0.003 16 0 "[ . 1 . 2]" 1
1546 1 75 PRO HB2 1 100 THR MG 4.420 . 4.420 2.028 1.912 2.130 . 0 0 "[ . 1 . 2]" 1
1547 1 75 PRO HD3 1 76 ARG H 4.160 . 4.160 3.996 3.960 4.022 . 0 0 "[ . 1 . 2]" 1
1548 1 75 PRO HD2 1 76 ARG H 4.360 . 4.360 2.910 2.852 2.961 . 0 0 "[ . 1 . 2]" 1
1549 1 75 PRO HD2 1 77 ILE MD 6.060 . 6.060 4.679 4.505 4.906 . 0 0 "[ . 1 . 2]" 1
1550 1 75 PRO QG 1 100 THR HB 6.390 . 6.390 5.472 5.257 5.649 . 0 0 "[ . 1 . 2]" 1
1551 1 75 PRO QG 1 100 THR MG 5.540 . 5.540 3.086 2.937 3.277 . 0 0 "[ . 1 . 2]" 1
1552 1 75 PRO QG 1 76 ARG H 4.730 . 4.730 2.908 2.819 3.065 . 0 0 "[ . 1 . 2]" 1
1553 1 76 ARG HA 1 100 THR MG 5.030 . 5.030 3.068 2.884 3.275 . 0 0 "[ . 1 . 2]" 1
1554 1 76 ARG HA 1 103 GLN HB3 4.460 . 4.460 2.886 2.731 3.053 . 0 0 "[ . 1 . 2]" 1
1555 1 76 ARG HA 1 103 GLN HB2 4.270 . 4.270 2.677 2.444 2.890 . 0 0 "[ . 1 . 2]" 1
1556 1 76 ARG HA 1 76 ARG QD 5.080 . 5.080 3.793 3.512 4.001 . 0 0 "[ . 1 . 2]" 1
1557 1 76 ARG HA 1 96 LEU QD 7.500 . 7.500 4.504 4.223 4.750 . 0 0 "[ . 1 . 2]" 1
1558 1 76 ARG HA 1 97 ALA MB 5.220 . 5.220 3.416 3.277 3.606 . 0 0 "[ . 1 . 2]" 1
1559 1 76 ARG HA 1 97 ALA H 4.550 . 4.550 4.112 3.949 4.247 . 0 0 "[ . 1 . 2]" 1
1560 1 76 ARG QB 1 96 LEU QD 6.580 . 6.580 2.377 2.193 2.565 . 0 0 "[ . 1 . 2]" 1
1561 1 76 ARG QB 1 97 ALA H 4.980 . 4.980 2.901 2.688 3.176 . 0 0 "[ . 1 . 2]" 1
1562 1 76 ARG QB 1 99 SER H 5.690 . 5.690 3.912 3.682 4.071 . 0 0 "[ . 1 . 2]" 1
1563 1 76 ARG HD3 1 100 THR HA 5.120 . 5.120 3.507 2.993 4.098 . 0 0 "[ . 1 . 2]" 1
1564 1 76 ARG HD3 1 99 SER HA 3.950 . 3.950 2.471 1.994 3.271 . 0 0 "[ . 1 . 2]" 1
1565 1 76 ARG HD3 1 99 SER HB3 5.500 . 5.500 4.567 4.132 5.337 . 0 0 "[ . 1 . 2]" 1
1566 1 76 ARG HD2 1 100 THR HA 5.120 . 5.120 3.887 3.238 4.318 . 0 0 "[ . 1 . 2]" 1
1567 1 76 ARG HD2 1 99 SER HA 3.950 . 3.950 2.684 2.149 3.213 . 0 0 "[ . 1 . 2]" 1
1568 1 76 ARG HD2 1 99 SER HB3 5.500 . 5.500 5.016 4.296 5.498 . 0 0 "[ . 1 . 2]" 1
1569 1 76 ARG QD 1 100 THR HA 5.390 . 5.390 3.223 2.873 3.588 . 0 0 "[ . 1 . 2]" 1
1570 1 76 ARG QD 1 100 THR MG 6.410 . 6.410 3.916 3.462 4.233 . 0 0 "[ . 1 . 2]" 1
1571 1 76 ARG QD 1 100 THR H 5.500 . 5.500 2.227 1.968 2.741 . 0 0 "[ . 1 . 2]" 1
1572 1 76 ARG QD 1 101 GLU H 6.140 . 6.140 4.706 4.467 5.186 . 0 0 "[ . 1 . 2]" 1
1573 1 76 ARG QD 1 96 LEU QD 7.510 . 7.510 3.907 3.435 4.442 . 0 0 "[ . 1 . 2]" 1
1574 1 76 ARG QD 1 98 ASN HA 5.400 . 5.400 3.934 3.701 4.450 . 0 0 "[ . 1 . 2]" 1
1575 1 76 ARG QD 1 99 SER HB3 5.650 . 5.650 4.190 3.861 4.605 . 0 0 "[ . 1 . 2]" 1
1576 1 76 ARG QD 1 99 SER H 4.590 . 4.590 3.513 3.067 3.690 . 0 0 "[ . 1 . 2]" 1
1577 1 76 ARG HG3 1 100 THR HA 4.790 . 4.790 3.984 3.647 4.557 . 0 0 "[ . 1 . 2]" 1
1578 1 76 ARG HG3 1 100 THR H 5.170 . 5.170 4.484 4.122 5.045 . 0 0 "[ . 1 . 2]" 1
1579 1 76 ARG HG3 1 99 SER HA 5.480 . 5.480 5.010 4.602 5.390 . 0 0 "[ . 1 . 2]" 1
1580 1 76 ARG HG2 1 100 THR HA 4.790 . 4.790 2.295 1.995 3.016 . 0 0 "[ . 1 . 2]" 1
1581 1 76 ARG HG2 1 100 THR H 5.170 . 5.170 3.157 2.747 3.997 . 0 0 "[ . 1 . 2]" 1
1582 1 76 ARG HG2 1 99 SER HA 5.480 . 5.480 4.209 3.798 5.008 . 0 0 "[ . 1 . 2]" 1
1583 1 76 ARG QG 1 100 THR HA 5.090 . 5.090 2.280 1.987 2.975 . 0 0 "[ . 1 . 2]" 1
1584 1 76 ARG QG 1 100 THR H 5.310 . 5.310 3.094 2.709 3.853 . 0 0 "[ . 1 . 2]" 1
1585 1 76 ARG QG 1 96 LEU QD 7.420 . 7.420 3.909 3.573 4.199 . 0 0 "[ . 1 . 2]" 1
1586 1 76 ARG QG 1 99 SER HA 5.490 . 5.490 3.996 3.674 4.610 . 0 0 "[ . 1 . 2]" 1
1587 1 76 ARG H 1 76 ARG HB3 3.840 . 3.840 3.708 3.680 3.753 . 0 0 "[ . 1 . 2]" 1
1588 1 76 ARG H 1 76 ARG HB2 3.840 . 3.840 2.668 2.561 2.868 . 0 0 "[ . 1 . 2]" 1
1589 1 76 ARG H 1 76 ARG QD 5.570 . 5.570 4.383 4.258 4.496 . 0 0 "[ . 1 . 2]" 1
1590 1 76 ARG H 1 76 ARG HG3 4.010 . 4.010 2.563 2.401 2.698 . 0 0 "[ . 1 . 2]" 1
1591 1 76 ARG H 1 76 ARG HG2 4.010 . 4.010 3.218 2.706 3.565 . 0 0 "[ . 1 . 2]" 1
1592 1 76 ARG H 1 76 ARG QG 4.360 . 4.360 2.453 2.350 2.563 . 0 0 "[ . 1 . 2]" 1
1593 1 76 ARG H 1 77 ILE HA 4.890 . 4.890 4.853 4.777 4.896 0.006 15 0 "[ . 1 . 2]" 1
1594 1 76 ARG H 1 77 ILE MD 5.070 . 5.070 4.038 3.873 4.146 . 0 0 "[ . 1 . 2]" 1
1595 1 76 ARG H 1 96 LEU QD 6.890 . 6.890 3.930 3.786 4.062 . 0 0 "[ . 1 . 2]" 1
1596 1 77 ILE HA 1 78 PHE H 3.130 . 3.130 2.164 2.144 2.197 . 0 0 "[ . 1 . 2]" 1
1597 1 77 ILE HA 1 95 LEU H 4.850 . 4.850 4.460 4.289 4.555 . 0 0 "[ . 1 . 2]" 1
1598 1 77 ILE HA 1 96 LEU HA 3.860 . 3.860 2.227 2.098 2.327 . 0 0 "[ . 1 . 2]" 1
1599 1 77 ILE HA 1 96 LEU QD 6.240 . 6.240 3.419 3.173 3.630 . 0 0 "[ . 1 . 2]" 1
1600 1 77 ILE HA 1 96 LEU H 5.080 . 5.080 4.647 4.561 4.734 . 0 0 "[ . 1 . 2]" 1
1601 1 77 ILE HA 1 97 ALA H 3.930 . 3.930 3.040 2.831 3.254 . 0 0 "[ . 1 . 2]" 1
1602 1 77 ILE HB 1 78 PHE H 4.270 . 4.270 4.149 4.019 4.276 0.006 5 0 "[ . 1 . 2]" 1
1603 1 77 ILE HB 1 96 LEU HA 5.060 . 5.060 4.443 4.233 4.676 . 0 0 "[ . 1 . 2]" 1
1604 1 77 ILE HB 1 96 LEU QD 7.500 . 7.500 3.963 3.906 4.082 . 0 0 "[ . 1 . 2]" 1
1605 1 77 ILE MD 1 96 LEU HA 5.500 . 5.500 3.921 3.689 4.250 . 0 0 "[ . 1 . 2]" 1
1606 1 77 ILE MD 1 96 LEU MD1 6.710 . 6.710 1.967 1.896 2.118 . 0 0 "[ . 1 . 2]" 1
1607 1 77 ILE MD 1 96 LEU MD2 6.710 . 6.710 3.544 3.346 3.947 . 0 0 "[ . 1 . 2]" 1
1608 1 77 ILE MD 1 96 LEU QD 6.590 . 6.590 1.957 1.889 2.100 . 0 0 "[ . 1 . 2]" 1
1609 1 77 ILE HG13 1 78 PHE H 5.000 . 5.000 4.842 4.767 4.900 . 0 0 "[ . 1 . 2]" 1
1610 1 77 ILE HG13 1 97 ALA H 4.910 . 4.910 3.752 3.461 4.096 . 0 0 "[ . 1 . 2]" 1
1611 1 77 ILE HG12 1 78 PHE H 5.000 . 5.000 4.497 4.369 4.627 . 0 0 "[ . 1 . 2]" 1
1612 1 77 ILE HG12 1 97 ALA H 4.910 . 4.910 3.930 3.569 4.458 . 0 0 "[ . 1 . 2]" 1
1613 1 77 ILE QG 1 96 LEU QD 6.720 . 6.720 1.745 1.698 1.817 0.102 16 0 "[ . 1 . 2]" 1
1614 1 77 ILE QG 1 96 LEU H 6.220 . 6.220 4.062 3.917 4.246 . 0 0 "[ . 1 . 2]" 1
1615 1 77 ILE QG 1 97 ALA H 5.190 . 5.190 3.412 3.157 3.787 . 0 0 "[ . 1 . 2]" 1
1616 1 77 ILE MG 1 78 PHE HA 5.650 . 5.650 3.559 3.432 3.667 . 0 0 "[ . 1 . 2]" 1
1617 1 77 ILE MG 1 78 PHE H 4.190 . 4.190 2.543 2.122 2.843 . 0 0 "[ . 1 . 2]" 1
1618 1 77 ILE MG 1 94 LEU HB3 5.040 . 5.040 2.955 2.707 3.150 . 0 0 "[ . 1 . 2]" 1
1619 1 77 ILE MG 1 94 LEU MD1 4.780 . 4.780 2.309 2.116 2.455 . 0 0 "[ . 1 . 2]" 1
1620 1 77 ILE MG 1 96 LEU HA 5.380 . 5.380 2.929 2.551 3.227 . 0 0 "[ . 1 . 2]" 1
1621 1 77 ILE MG 1 96 LEU MD1 7.540 . 7.540 3.601 3.464 3.813 . 0 0 "[ . 1 . 2]" 1
1622 1 77 ILE MG 1 96 LEU MD2 7.540 . 7.540 4.830 4.684 5.039 . 0 0 "[ . 1 . 2]" 1
1623 1 77 ILE MG 1 96 LEU QD 7.580 . 7.580 3.507 3.378 3.702 . 0 0 "[ . 1 . 2]" 1
1624 1 77 ILE H 1 103 GLN HG3 4.480 . 4.480 3.660 3.347 3.837 . 0 0 "[ . 1 . 2]" 1
1625 1 77 ILE H 1 77 ILE HB 3.280 . 3.280 2.624 2.592 2.638 . 0 0 "[ . 1 . 2]" 1
1626 1 77 ILE H 1 77 ILE MD 4.600 . 4.600 3.635 3.536 3.714 . 0 0 "[ . 1 . 2]" 1
1627 1 77 ILE H 1 77 ILE HG13 4.310 . 4.310 2.745 2.625 2.931 . 0 0 "[ . 1 . 2]" 1
1628 1 77 ILE H 1 77 ILE HG12 4.310 . 4.310 4.096 3.992 4.248 . 0 0 "[ . 1 . 2]" 1
1629 1 77 ILE H 1 77 ILE QG 4.490 . 4.490 2.706 2.592 2.880 . 0 0 "[ . 1 . 2]" 1
1630 1 77 ILE H 1 78 PHE H 4.600 . 4.600 4.393 4.295 4.460 . 0 0 "[ . 1 . 2]" 1
1631 1 77 ILE H 1 96 LEU HA 5.060 . 5.060 4.601 4.526 4.717 . 0 0 "[ . 1 . 2]" 1
1632 1 77 ILE H 1 97 ALA H 5.060 . 5.060 4.600 4.462 4.779 . 0 0 "[ . 1 . 2]" 1
1633 1 78 PHE HA 1 103 GLN HG3 4.880 . 4.880 3.941 3.732 4.183 . 0 0 "[ . 1 . 2]" 1
1634 1 78 PHE HA 1 107 VAL QG 6.450 . 6.450 3.730 3.660 3.830 . 0 0 "[ . 1 . 2]" 1
1635 1 78 PHE HA 1 79 GLN H 3.550 . 3.550 2.275 2.212 2.408 . 0 0 "[ . 1 . 2]" 1
1636 1 78 PHE QB 1 103 GLN QE 6.290 . 6.290 2.814 1.984 3.272 . 0 0 "[ . 1 . 2]" 1
1637 1 78 PHE QB 1 107 VAL QG 6.270 . 6.270 1.787 1.740 1.848 0.060 14 0 "[ . 1 . 2]" 1
1638 1 78 PHE QB 1 79 GLN H 4.520 . 4.520 2.705 2.384 2.864 . 0 0 "[ . 1 . 2]" 1
1639 1 78 PHE H 1 103 GLN HG3 5.060 . 5.060 3.667 3.418 3.943 . 0 0 "[ . 1 . 2]" 1
1640 1 78 PHE H 1 94 LEU HA 4.830 . 4.830 4.661 4.546 4.769 . 0 0 "[ . 1 . 2]" 1
1641 1 78 PHE H 1 94 LEU MD1 6.070 . 6.070 4.381 4.214 4.564 . 0 0 "[ . 1 . 2]" 1
1642 1 78 PHE H 1 95 LEU QB 5.150 . 5.150 3.614 3.502 3.717 . 0 0 "[ . 1 . 2]" 1
1643 1 78 PHE H 1 95 LEU QD 7.490 . 7.490 4.967 4.858 5.065 . 0 0 "[ . 1 . 2]" 1
1644 1 78 PHE H 1 95 LEU H 4.010 . 4.010 3.112 2.994 3.219 . 0 0 "[ . 1 . 2]" 1
1645 1 78 PHE H 1 96 LEU HA 4.120 . 4.120 3.730 3.539 3.867 . 0 0 "[ . 1 . 2]" 1
1646 1 78 PHE H 1 97 ALA H 4.860 . 4.860 4.557 4.224 4.833 . 0 0 "[ . 1 . 2]" 1
1647 1 79 GLN HA 1 80 ILE H 3.270 . 3.270 2.207 2.184 2.239 . 0 0 "[ . 1 . 2]" 1
1648 1 79 GLN HA 1 94 LEU HA 3.870 . 3.870 2.594 2.453 2.749 . 0 0 "[ . 1 . 2]" 1
1649 1 79 GLN HA 1 94 LEU MD1 4.640 . 4.640 2.836 2.691 3.051 . 0 0 "[ . 1 . 2]" 1
1650 1 79 GLN HA 1 94 LEU H 5.120 . 5.120 4.736 4.632 4.884 . 0 0 "[ . 1 . 2]" 1
1651 1 79 GLN HA 1 95 LEU QD 6.710 . 6.710 4.982 4.890 5.055 . 0 0 "[ . 1 . 2]" 1
1652 1 79 GLN HA 1 95 LEU H 3.900 . 3.900 3.560 3.419 3.652 . 0 0 "[ . 1 . 2]" 1
1653 1 79 GLN QB 1 94 LEU HA 5.650 . 5.650 3.603 3.445 3.796 . 0 0 "[ . 1 . 2]" 1
1654 1 79 GLN QB 1 94 LEU MD1 5.360 . 5.360 2.022 1.886 2.248 . 0 0 "[ . 1 . 2]" 1
1655 1 79 GLN HE21 1 92 ASN HD21 5.280 . 5.280 4.289 3.121 4.795 . 0 0 "[ . 1 . 2]" 1
1656 1 79 GLN HE21 1 92 ASN HD22 4.870 . 4.870 4.269 3.015 4.819 . 0 0 "[ . 1 . 2]" 1
1657 1 79 GLN HE21 1 94 LEU MD1 6.520 . 6.520 2.425 1.975 3.549 . 0 0 "[ . 1 . 2]" 1
1658 1 79 GLN HE22 1 92 ASN HD21 5.280 . 5.280 4.911 4.389 5.204 . 0 0 "[ . 1 . 2]" 1
1659 1 79 GLN HE22 1 92 ASN HD22 4.870 . 4.870 4.392 3.732 4.688 . 0 0 "[ . 1 . 2]" 1
1660 1 79 GLN HE22 1 94 LEU MD1 6.520 . 6.520 3.792 3.355 4.461 . 0 0 "[ . 1 . 2]" 1
1661 1 79 GLN QE 1 92 ASN HB2 5.430 . 5.430 3.381 2.655 3.831 . 0 0 "[ . 1 . 2]" 1
1662 1 79 GLN QE 1 92 ASN HD21 5.440 . 5.440 4.024 3.058 4.428 . 0 0 "[ . 1 . 2]" 1
1663 1 79 GLN QE 1 94 LEU MD1 6.560 . 6.560 2.395 1.962 3.418 . 0 0 "[ . 1 . 2]" 1
1664 1 79 GLN QE 1 94 LEU HG 6.120 . 6.120 3.845 3.535 4.232 . 0 0 "[ . 1 . 2]" 1
1665 1 79 GLN HG3 1 80 ILE H 4.270 . 4.270 2.965 2.802 3.278 . 0 0 "[ . 1 . 2]" 1
1666 1 79 GLN HG3 1 93 LEU H 5.050 . 5.050 3.309 3.095 3.452 . 0 0 "[ . 1 . 2]" 1
1667 1 79 GLN HG3 1 94 LEU HA 4.980 . 4.980 3.728 3.631 3.901 . 0 0 "[ . 1 . 2]" 1
1668 1 79 GLN HG3 1 94 LEU MD1 4.920 . 4.920 2.919 2.714 3.070 . 0 0 "[ . 1 . 2]" 1
1669 1 79 GLN HG2 1 80 ILE HA 5.500 . 5.500 3.692 3.579 3.787 . 0 0 "[ . 1 . 2]" 1
1670 1 79 GLN HG2 1 80 ILE H 4.210 . 4.210 2.517 2.320 2.716 . 0 0 "[ . 1 . 2]" 1
1671 1 79 GLN HG2 1 81 LEU H 4.670 . 4.670 3.939 3.829 4.033 . 0 0 "[ . 1 . 2]" 1
1672 1 79 GLN HG2 1 93 LEU H 4.620 . 4.620 3.307 3.038 3.506 . 0 0 "[ . 1 . 2]" 1
1673 1 79 GLN HG2 1 94 LEU MD2 5.410 . 5.410 3.384 3.135 3.534 . 0 0 "[ . 1 . 2]" 1
1674 1 79 GLN H 1 107 VAL QG 6.850 . 6.850 3.965 3.651 4.139 . 0 0 "[ . 1 . 2]" 1
1675 1 79 GLN H 1 79 GLN HB3 4.010 . 4.010 2.556 2.518 2.646 . 0 0 "[ . 1 . 2]" 1
1676 1 79 GLN H 1 79 GLN HB2 4.010 . 4.010 3.020 2.953 3.120 . 0 0 "[ . 1 . 2]" 1
1677 1 79 GLN H 1 79 GLN HG3 4.970 . 4.970 4.724 4.674 4.767 . 0 0 "[ . 1 . 2]" 1
1678 1 79 GLN H 1 80 ILE H 4.980 . 4.980 4.474 4.408 4.498 . 0 0 "[ . 1 . 2]" 1
1679 1 80 ILE HA 1 81 LEU H 3.310 . 3.310 2.155 2.147 2.169 . 0 0 "[ . 1 . 2]" 1
1680 1 80 ILE HB 1 81 LEU H 4.600 . 4.600 4.268 4.171 4.330 . 0 0 "[ . 1 . 2]" 1
1681 1 80 ILE HB 1 93 LEU HB3 4.350 . 4.350 3.178 2.836 3.292 . 0 0 "[ . 1 . 2]" 1
1682 1 80 ILE HB 1 93 LEU HB2 4.410 . 4.410 3.117 2.754 3.347 . 0 0 "[ . 1 . 2]" 1
1683 1 80 ILE HB 1 93 LEU QD 6.630 . 6.630 3.876 3.517 4.040 . 0 0 "[ . 1 . 2]" 1
1684 1 80 ILE HB 1 93 LEU H 4.190 . 4.190 3.258 3.146 3.357 . 0 0 "[ . 1 . 2]" 1
1685 1 80 ILE HB 1 95 LEU QD 7.020 . 7.020 4.440 4.310 4.639 . 0 0 "[ . 1 . 2]" 1
1686 1 80 ILE MD 1 93 LEU HB3 5.190 . 5.190 2.685 1.944 3.020 . 0 0 "[ . 1 . 2]" 1
1687 1 80 ILE MD 1 93 LEU QD 7.120 . 7.120 3.296 2.695 3.576 . 0 0 "[ . 1 . 2]" 1
1688 1 80 ILE MD 1 95 LEU MD1 6.620 . 6.620 2.428 2.093 2.696 . 0 0 "[ . 1 . 2]" 1
1689 1 80 ILE MD 1 95 LEU MD2 6.620 . 6.620 3.887 3.640 4.099 . 0 0 "[ . 1 . 2]" 1
1690 1 80 ILE MD 1 95 LEU QD 6.350 . 6.350 2.404 2.084 2.661 . 0 0 "[ . 1 . 2]" 1
1691 1 80 ILE QG 1 93 LEU HB3 5.400 . 5.400 4.517 4.080 4.839 . 0 0 "[ . 1 . 2]" 1
1692 1 80 ILE QG 1 93 LEU HB2 6.220 . 6.220 5.046 4.646 5.359 . 0 0 "[ . 1 . 2]" 1
1693 1 80 ILE QG 1 95 LEU QD 7.050 . 7.050 4.065 3.716 4.345 . 0 0 "[ . 1 . 2]" 1
1694 1 80 ILE MG 1 111 VAL HA 6.520 . 6.520 5.115 5.009 5.278 . 0 0 "[ . 1 . 2]" 1
1695 1 80 ILE MG 1 81 LEU HA 5.970 . 5.970 4.153 4.086 4.337 . 0 0 "[ . 1 . 2]" 1
1696 1 80 ILE MG 1 81 LEU H 4.710 . 4.710 2.802 2.710 2.903 . 0 0 "[ . 1 . 2]" 1
1697 1 80 ILE MG 1 82 TYR HA 5.880 . 5.880 4.722 4.642 4.808 . 0 0 "[ . 1 . 2]" 1
1698 1 80 ILE MG 1 82 TYR QB 6.180 . 6.180 3.485 3.322 3.741 . 0 0 "[ . 1 . 2]" 1
1699 1 80 ILE MG 1 93 LEU HB3 5.620 . 5.620 4.561 4.298 4.669 . 0 0 "[ . 1 . 2]" 1
1700 1 80 ILE MG 1 93 LEU HB2 5.220 . 5.220 4.173 4.015 4.280 . 0 0 "[ . 1 . 2]" 1
1701 1 80 ILE MG 1 93 LEU QD 7.470 . 7.470 4.274 3.984 4.399 . 0 0 "[ . 1 . 2]" 1
1702 1 80 ILE MG 1 93 LEU H 5.550 . 5.550 4.309 4.186 4.446 . 0 0 "[ . 1 . 2]" 1
1703 1 80 ILE MG 1 95 LEU QD 8.550 . 8.550 4.774 4.660 4.949 . 0 0 "[ . 1 . 2]" 1
1704 1 80 ILE H 1 80 ILE HB 3.850 . 3.850 2.753 2.677 2.863 . 0 0 "[ . 1 . 2]" 1
1705 1 80 ILE H 1 80 ILE MD 5.280 . 5.280 3.000 2.473 3.435 . 0 0 "[ . 1 . 2]" 1
1706 1 80 ILE H 1 81 LEU H 4.220 . 4.220 4.181 4.144 4.222 0.002 15 0 "[ . 1 . 2]" 1
1707 1 80 ILE H 1 93 LEU HB3 4.130 . 4.130 3.671 3.440 3.823 . 0 0 "[ . 1 . 2]" 1
1708 1 80 ILE H 1 93 LEU HB2 4.420 . 4.420 3.948 3.791 4.135 . 0 0 "[ . 1 . 2]" 1
1709 1 80 ILE H 1 95 LEU QD 6.670 . 6.670 4.973 4.905 5.004 . 0 0 "[ . 1 . 2]" 1
1710 1 80 ILE H 1 95 LEU H 5.470 . 5.470 5.037 4.938 5.108 . 0 0 "[ . 1 . 2]" 1
1711 1 81 LEU HA 1 81 LEU HG 4.200 . 4.200 2.974 2.830 3.297 . 0 0 "[ . 1 . 2]" 1
1712 1 81 LEU HA 1 82 TYR HA 4.900 . 4.900 4.437 4.412 4.465 . 0 0 "[ . 1 . 2]" 1
1713 1 81 LEU HA 1 82 TYR H 3.200 . 3.200 2.198 2.167 2.235 . 0 0 "[ . 1 . 2]" 1
1714 1 81 LEU HA 1 90 ALA MB 5.720 . 5.720 4.570 4.490 4.623 . 0 0 "[ . 1 . 2]" 1
1715 1 81 LEU HA 1 91 LYS H 5.500 . 5.500 5.484 5.150 5.510 0.010 8 0 "[ . 1 . 2]" 1
1716 1 81 LEU HA 1 92 ASN HA 3.850 . 3.850 2.098 1.933 2.240 . 0 0 "[ . 1 . 2]" 1
1717 1 81 LEU HA 1 92 ASN HB3 4.690 . 4.690 2.546 2.334 2.670 . 0 0 "[ . 1 . 2]" 1
1718 1 81 LEU HA 1 92 ASN HB2 5.310 . 5.310 3.712 3.598 3.804 . 0 0 "[ . 1 . 2]" 1
1719 1 81 LEU HA 1 92 ASN H 4.880 . 4.880 4.542 4.318 4.640 . 0 0 "[ . 1 . 2]" 1
1720 1 81 LEU HA 1 93 LEU H 4.090 . 4.090 3.787 3.673 3.913 . 0 0 "[ . 1 . 2]" 1
1721 1 81 LEU QB 1 82 TYR H 5.060 . 5.060 3.613 3.528 3.688 . 0 0 "[ . 1 . 2]" 1
1722 1 81 LEU QB 1 92 ASN HA 5.540 . 5.540 3.945 3.693 4.121 . 0 0 "[ . 1 . 2]" 1
1723 1 81 LEU QB 1 92 ASN HB3 6.270 . 6.270 2.898 2.649 3.087 . 0 0 "[ . 1 . 2]" 1
1724 1 81 LEU QB 1 92 ASN HB2 5.990 . 5.990 4.285 4.111 4.439 . 0 0 "[ . 1 . 2]" 1
1725 1 81 LEU MD1 1 82 TYR HA 6.520 . 6.520 4.558 3.777 4.913 . 0 0 "[ . 1 . 2]" 1
1726 1 81 LEU MD1 1 83 ALA HA 6.520 . 6.520 4.788 3.976 5.257 . 0 0 "[ . 1 . 2]" 1
1727 1 81 LEU MD2 1 82 TYR HA 6.520 . 6.520 4.549 4.358 4.844 . 0 0 "[ . 1 . 2]" 1
1728 1 81 LEU MD2 1 83 ALA HA 6.520 . 6.520 5.273 5.225 5.350 . 0 0 "[ . 1 . 2]" 1
1729 1 81 LEU QD 1 82 TYR HA 6.420 . 6.420 4.033 3.651 4.226 . 0 0 "[ . 1 . 2]" 1
1730 1 81 LEU QD 1 82 TYR H 6.030 . 6.030 2.596 2.001 2.897 . 0 0 "[ . 1 . 2]" 1
1731 1 81 LEU QD 1 83 ALA HA 6.520 . 6.520 4.427 3.874 4.676 . 0 0 "[ . 1 . 2]" 1
1732 1 81 LEU QD 1 84 ASN HD21 7.540 . 7.540 5.059 4.746 5.281 . 0 0 "[ . 1 . 2]" 1
1733 1 81 LEU QD 1 84 ASN H 7.540 . 7.540 5.301 4.724 5.541 . 0 0 "[ . 1 . 2]" 1
1734 1 81 LEU QD 1 90 ALA HA 6.910 . 6.910 3.875 3.234 4.172 . 0 0 "[ . 1 . 2]" 1
1735 1 81 LEU QD 1 90 ALA MB 6.220 . 6.220 2.175 1.780 2.406 0.020 4 0 "[ . 1 . 2]" 1
1736 1 81 LEU QD 1 90 ALA H 7.030 . 7.030 4.324 4.055 4.488 . 0 0 "[ . 1 . 2]" 1
1737 1 81 LEU QD 1 91 LYS H 6.190 . 6.190 3.726 3.018 3.991 . 0 0 "[ . 1 . 2]" 1
1738 1 81 LEU QD 1 92 ASN HA 5.670 . 5.670 3.145 2.986 3.361 . 0 0 "[ . 1 . 2]" 1
1739 1 81 LEU QD 1 92 ASN HB3 5.690 . 5.690 2.504 2.274 2.778 . 0 0 "[ . 1 . 2]" 1
1740 1 81 LEU QD 1 92 ASN HB2 6.410 . 6.410 3.995 3.842 4.200 . 0 0 "[ . 1 . 2]" 1
1741 1 81 LEU HG 1 82 TYR H 4.510 . 4.510 2.535 2.343 2.965 . 0 0 "[ . 1 . 2]" 1
1742 1 81 LEU HG 1 90 ALA MB 5.260 . 5.260 2.670 2.576 2.758 . 0 0 "[ . 1 . 2]" 1
1743 1 81 LEU HG 1 92 ASN HA 5.500 . 5.500 4.758 4.522 5.078 . 0 0 "[ . 1 . 2]" 1
1744 1 81 LEU H 1 92 ASN HA 4.860 . 4.860 4.437 4.246 4.531 . 0 0 "[ . 1 . 2]" 1
1745 1 82 TYR HA 1 83 ALA HA 4.860 . 4.860 4.325 4.318 4.332 . 0 0 "[ . 1 . 2]" 1
1746 1 82 TYR HA 1 83 ALA MB 5.690 . 5.690 3.968 3.916 4.030 . 0 0 "[ . 1 . 2]" 1
1747 1 82 TYR HA 1 83 ALA H 3.380 . 3.380 2.244 2.211 2.309 . 0 0 "[ . 1 . 2]" 1
1748 1 82 TYR QB 1 83 ALA H 4.270 . 4.270 2.805 2.635 2.911 . 0 0 "[ . 1 . 2]" 1
1749 1 82 TYR H 1 83 ALA H 4.470 . 4.470 4.328 4.263 4.366 . 0 0 "[ . 1 . 2]" 1
1750 1 82 TYR H 1 90 ALA HA 5.080 . 5.080 4.579 4.414 4.695 . 0 0 "[ . 1 . 2]" 1
1751 1 82 TYR H 1 90 ALA MB 4.930 . 4.930 3.193 3.008 3.371 . 0 0 "[ . 1 . 2]" 1
1752 1 82 TYR H 1 91 LYS HA 5.290 . 5.290 4.775 4.540 4.852 . 0 0 "[ . 1 . 2]" 1
1753 1 82 TYR H 1 91 LYS H 4.200 . 4.200 3.927 3.538 4.003 . 0 0 "[ . 1 . 2]" 1
1754 1 82 TYR H 1 92 ASN HA 4.210 . 4.210 3.147 3.038 3.261 . 0 0 "[ . 1 . 2]" 1
1755 1 82 TYR H 1 92 ASN HB3 5.040 . 5.040 4.338 4.189 4.430 . 0 0 "[ . 1 . 2]" 1
1756 1 82 TYR H 1 92 ASN HB2 5.500 . 5.500 5.507 5.469 5.520 0.020 4 0 "[ . 1 . 2]" 1
1757 1 83 ALA HA 1 84 ASN HD22 5.500 . 5.500 5.102 4.123 5.195 . 0 0 "[ . 1 . 2]" 1
1758 1 83 ALA HA 1 84 ASN H 2.700 . 2.700 2.147 2.141 2.161 . 0 0 "[ . 1 . 2]" 1
1759 1 83 ALA HA 1 90 ALA MB 4.800 . 4.800 1.929 1.888 2.029 . 0 0 "[ . 1 . 2]" 1
1760 1 83 ALA MB 1 84 ASN HA 5.650 . 5.650 4.206 4.153 4.262 . 0 0 "[ . 1 . 2]" 1
1761 1 83 ALA MB 1 84 ASN HD21 6.040 . 6.040 5.029 5.007 5.039 . 0 0 "[ . 1 . 2]" 1
1762 1 83 ALA MB 1 84 ASN H 4.360 . 4.360 3.219 3.058 3.277 . 0 0 "[ . 1 . 2]" 1
1763 1 83 ALA MB 1 85 GLU H 5.160 . 5.160 3.964 3.844 4.103 . 0 0 "[ . 1 . 2]" 1
1764 1 83 ALA MB 1 86 GLY H 5.350 . 5.350 3.800 3.450 3.900 . 0 0 "[ . 1 . 2]" 1
1765 1 83 ALA MB 1 87 ILE HA 5.210 . 5.210 2.982 2.862 3.176 . 0 0 "[ . 1 . 2]" 1
1766 1 83 ALA MB 1 87 ILE MG 6.130 . 6.130 3.938 3.829 4.018 . 0 0 "[ . 1 . 2]" 1
1767 1 83 ALA MB 1 90 ALA HA 5.170 . 5.170 3.942 3.802 4.009 . 0 0 "[ . 1 . 2]" 1
1768 1 84 ASN HA 1 84 ASN HD21 4.440 . 4.440 4.149 4.074 4.174 . 0 0 "[ . 1 . 2]" 1
1769 1 84 ASN HA 1 84 ASN HD22 5.290 . 5.290 5.137 4.918 5.161 . 0 0 "[ . 1 . 2]" 1
1770 1 84 ASN HB3 1 85 GLU H 4.040 . 4.040 3.730 3.681 4.057 0.017 4 0 "[ . 1 . 2]" 1
1771 1 84 ASN HB3 1 91 LYS HB2 5.110 . 5.110 3.588 3.375 4.366 . 0 0 "[ . 1 . 2]" 1
1772 1 84 ASN HB3 1 91 LYS QD 6.380 . 6.380 4.744 4.531 5.659 . 0 0 "[ . 1 . 2]" 1
1773 1 84 ASN HB3 1 91 LYS QG 6.280 . 6.280 2.905 2.653 3.795 . 0 0 "[ . 1 . 2]" 1
1774 1 84 ASN HB2 1 85 GLU H 4.040 . 4.040 3.788 2.825 3.887 . 0 0 "[ . 1 . 2]" 1
1775 1 84 ASN HB2 1 91 LYS HB2 5.110 . 5.110 4.810 4.598 5.112 0.002 7 0 "[ . 1 . 2]" 1
1776 1 84 ASN HB2 1 91 LYS QD 6.380 . 6.380 5.541 5.230 5.636 . 0 0 "[ . 1 . 2]" 1
1777 1 84 ASN HB2 1 91 LYS QG 6.280 . 6.280 3.748 3.532 3.876 . 0 0 "[ . 1 . 2]" 1
1778 1 84 ASN QB 1 85 GLU HB2 6.090 . 6.090 4.688 4.479 4.840 . 0 0 "[ . 1 . 2]" 1
1779 1 84 ASN QB 1 85 GLU QG 6.790 . 6.790 3.584 2.383 3.907 . 0 0 "[ . 1 . 2]" 1
1780 1 84 ASN QB 1 85 GLU H 4.310 . 4.310 3.331 2.775 3.405 . 0 0 "[ . 1 . 2]" 1
1781 1 84 ASN QB 1 86 GLY H 5.870 . 5.870 5.032 4.625 5.135 . 0 0 "[ . 1 . 2]" 1
1782 1 84 ASN QB 1 90 ALA H 6.220 . 6.220 5.415 5.402 5.522 . 0 0 "[ . 1 . 2]" 1
1783 1 84 ASN QB 1 91 LYS HB3 6.070 . 6.070 4.899 4.689 5.468 . 0 0 "[ . 1 . 2]" 1
1784 1 84 ASN QB 1 91 LYS HB2 5.380 . 5.380 3.492 3.294 4.128 . 0 0 "[ . 1 . 2]" 1
1785 1 84 ASN QB 1 91 LYS QD 6.580 . 6.580 4.477 4.317 4.825 . 0 0 "[ . 1 . 2]" 1
1786 1 84 ASN QB 1 91 LYS QG 6.500 . 6.500 2.802 2.581 3.329 . 0 0 "[ . 1 . 2]" 1
1787 1 84 ASN QB 1 91 LYS H 5.070 . 5.070 2.732 2.547 3.880 . 0 0 "[ . 1 . 2]" 1
1788 1 84 ASN HD21 1 85 GLU QG 5.890 . 5.890 4.644 2.511 4.968 . 0 0 "[ . 1 . 2]" 1
1789 1 84 ASN HD21 1 85 GLU H 4.340 . 4.340 3.069 2.104 3.219 . 0 0 "[ . 1 . 2]" 1
1790 1 84 ASN HD21 1 86 GLY H 5.120 . 5.120 4.389 3.686 4.546 . 0 0 "[ . 1 . 2]" 1
1791 1 84 ASN HD21 1 89 SER QB 5.590 . 5.590 3.284 2.500 3.508 . 0 0 "[ . 1 . 2]" 1
1792 1 84 ASN HD21 1 91 LYS HA 5.260 . 5.260 4.421 4.211 5.284 0.024 4 0 "[ . 1 . 2]" 1
1793 1 84 ASN HD21 1 91 LYS QD 5.930 . 5.930 3.629 3.403 4.269 . 0 0 "[ . 1 . 2]" 1
1794 1 84 ASN HD22 1 85 GLU QG 5.740 . 5.740 3.910 3.472 4.230 . 0 0 "[ . 1 . 2]" 1
1795 1 84 ASN HD22 1 85 GLU H 4.750 . 4.750 3.136 3.043 3.670 . 0 0 "[ . 1 . 2]" 1
1796 1 84 ASN HD22 1 86 GLY H 5.500 . 5.500 4.167 3.995 4.939 . 0 0 "[ . 1 . 2]" 1
1797 1 84 ASN HD22 1 89 SER QB 5.650 . 5.650 2.068 1.909 3.299 . 0 0 "[ . 1 . 2]" 1
1798 1 84 ASN HD22 1 89 SER H 5.120 . 5.120 4.631 4.473 5.131 0.011 4 0 "[ . 1 . 2]" 1
1799 1 84 ASN HD22 1 91 LYS QD 6.140 . 6.140 3.413 3.195 3.604 . 0 0 "[ . 1 . 2]" 1
1800 1 84 ASN HD22 1 91 LYS QG 5.740 . 5.740 2.910 1.939 3.273 . 0 0 "[ . 1 . 2]" 1
1801 1 84 ASN H 1 84 ASN HB3 3.810 . 3.810 2.708 2.599 3.597 . 0 0 "[ . 1 . 2]" 1
1802 1 84 ASN H 1 84 ASN HB2 3.810 . 3.810 3.676 3.253 3.747 . 0 0 "[ . 1 . 2]" 1
1803 1 84 ASN H 1 84 ASN HD21 4.590 . 4.590 2.302 2.246 2.455 . 0 0 "[ . 1 . 2]" 1
1804 1 84 ASN H 1 84 ASN HD22 4.460 . 4.460 3.430 2.885 3.504 . 0 0 "[ . 1 . 2]" 1
1805 1 84 ASN H 1 85 GLU QG 5.800 . 5.800 4.869 4.018 5.110 . 0 0 "[ . 1 . 2]" 1
1806 1 84 ASN H 1 89 SER QB 5.280 . 5.280 4.103 3.820 4.258 . 0 0 "[ . 1 . 2]" 1
1807 1 84 ASN H 1 90 ALA MB 4.260 . 4.260 3.160 3.103 3.269 . 0 0 "[ . 1 . 2]" 1
1808 1 84 ASN H 1 90 ALA H 4.710 . 4.710 3.837 3.588 3.930 . 0 0 "[ . 1 . 2]" 1
1809 1 84 ASN H 1 91 LYS QD 6.380 . 6.380 5.638 5.472 5.741 . 0 0 "[ . 1 . 2]" 1
1810 1 84 ASN H 1 91 LYS H 4.780 . 4.780 3.306 3.204 3.413 . 0 0 "[ . 1 . 2]" 1
1811 1 85 GLU HB3 1 86 GLY H 4.110 . 4.110 3.445 3.302 3.978 . 0 0 "[ . 1 . 2]" 1
1812 1 85 GLU HB3 1 89 SER HB2 4.390 . 4.390 4.052 3.794 4.359 . 0 0 "[ . 1 . 2]" 1
1813 1 85 GLU HB2 1 86 GLY H 3.560 . 3.560 2.694 2.564 2.839 . 0 0 "[ . 1 . 2]" 1
1814 1 85 GLU HB2 1 89 SER HB3 4.380 . 4.380 3.178 2.821 3.478 . 0 0 "[ . 1 . 2]" 1
1815 1 85 GLU HB2 1 89 SER HB2 4.490 . 4.490 2.621 2.042 2.808 . 0 0 "[ . 1 . 2]" 1
1816 1 85 GLU HB2 1 89 SER H 5.080 . 5.080 4.918 4.130 5.085 0.005 13 0 "[ . 1 . 2]" 1
1817 1 85 GLU HB2 1 90 ALA H 5.500 . 5.500 5.304 4.809 5.502 0.002 7 0 "[ . 1 . 2]" 1
1818 1 85 GLU QG 1 89 SER HB3 5.720 . 5.720 4.050 2.427 4.780 . 0 0 "[ . 1 . 2]" 1
1819 1 85 GLU QG 1 89 SER HB2 5.640 . 5.640 4.234 2.920 4.740 . 0 0 "[ . 1 . 2]" 1
1820 1 85 GLU H 1 85 GLU HB3 3.840 . 3.840 3.676 3.592 3.746 . 0 0 "[ . 1 . 2]" 1
1821 1 85 GLU H 1 85 GLU HB2 2.960 . 2.960 2.514 2.428 2.706 . 0 0 "[ . 1 . 2]" 1
1822 1 85 GLU H 1 85 GLU QG 4.390 . 4.390 3.216 2.391 3.436 . 0 0 "[ . 1 . 2]" 1
1823 1 85 GLU H 1 89 SER QB 4.700 . 4.700 3.118 2.672 3.299 . 0 0 "[ . 1 . 2]" 1
1824 1 85 GLU H 1 90 ALA HA 3.960 . 3.960 3.687 3.619 3.779 . 0 0 "[ . 1 . 2]" 1
1825 1 85 GLU H 1 90 ALA MB 5.500 . 5.500 4.498 4.455 4.558 . 0 0 "[ . 1 . 2]" 1
1826 1 86 GLY HA3 1 87 ILE MG 6.520 . 6.520 5.343 5.304 5.352 . 0 0 "[ . 1 . 2]" 1
1827 1 86 GLY HA3 1 87 ILE H 2.770 . 2.770 2.220 2.199 2.277 . 0 0 "[ . 1 . 2]" 1
1828 1 86 GLY H 1 86 GLY HA2 2.890 . 2.890 2.914 2.839 2.932 0.042 16 0 "[ . 1 . 2]" 1
1829 1 86 GLY H 1 87 ILE MD 6.020 . 6.020 4.656 4.572 4.746 . 0 0 "[ . 1 . 2]" 1
1830 1 86 GLY H 1 87 ILE HG13 5.240 . 5.240 5.124 5.051 5.161 . 0 0 "[ . 1 . 2]" 1
1831 1 86 GLY H 1 87 ILE H 3.670 . 3.670 3.218 3.103 3.277 . 0 0 "[ . 1 . 2]" 1
1832 1 86 GLY H 1 90 ALA H 5.290 . 5.290 3.893 3.580 3.990 . 0 0 "[ . 1 . 2]" 1
1833 1 87 ILE HA 1 87 ILE MD 4.720 . 4.720 3.608 3.566 3.628 . 0 0 "[ . 1 . 2]" 1
1834 1 87 ILE HA 1 87 ILE HG13 4.010 . 4.010 2.661 2.624 2.696 . 0 0 "[ . 1 . 2]" 1
1835 1 87 ILE HA 1 87 ILE HG12 4.090 . 4.090 3.659 3.605 3.702 . 0 0 "[ . 1 . 2]" 1
1836 1 87 ILE HA 1 89 SER H 4.330 . 4.330 4.315 4.153 4.336 0.006 19 0 "[ . 1 . 2]" 1
1837 1 87 ILE HA 1 90 ALA MB 5.250 . 5.250 2.749 2.623 2.882 . 0 0 "[ . 1 . 2]" 1
1838 1 87 ILE HA 1 90 ALA H 4.570 . 4.570 3.552 3.502 3.607 . 0 0 "[ . 1 . 2]" 1
1839 1 87 ILE HB 1 88 SER H 3.280 . 3.280 1.974 1.908 2.044 . 0 0 "[ . 1 . 2]" 1
1840 1 87 ILE HB 1 89 SER H 5.380 . 5.380 4.418 4.366 4.466 . 0 0 "[ . 1 . 2]" 1
1841 1 87 ILE HB 1 90 ALA H 5.500 . 5.500 5.093 5.048 5.174 . 0 0 "[ . 1 . 2]" 1
1842 1 87 ILE MD 1 88 SER QB 6.740 . 6.740 4.010 3.900 4.673 . 0 0 "[ . 1 . 2]" 1
1843 1 87 ILE MD 1 88 SER H 4.300 . 4.300 2.798 2.672 3.014 . 0 0 "[ . 1 . 2]" 1
1844 1 87 ILE HG13 1 88 SER H 4.430 . 4.430 4.251 4.242 4.258 . 0 0 "[ . 1 . 2]" 1
1845 1 87 ILE HG12 1 88 SER H 4.470 . 4.470 4.481 4.475 4.486 0.016 6 0 "[ . 1 . 2]" 1
1846 1 87 ILE MG 1 88 SER HA 5.160 . 5.160 3.870 3.735 3.941 . 0 0 "[ . 1 . 2]" 1
1847 1 87 ILE MG 1 88 SER HB3 6.520 . 6.520 5.251 4.486 5.399 . 0 0 "[ . 1 . 2]" 1
1848 1 87 ILE MG 1 88 SER HB2 6.520 . 6.520 4.667 4.384 5.354 . 0 0 "[ . 1 . 2]" 1
1849 1 87 ILE MG 1 88 SER H 4.620 . 4.620 3.391 3.259 3.474 . 0 0 "[ . 1 . 2]" 1
1850 1 87 ILE MG 1 90 ALA MB 5.740 . 5.740 3.553 3.467 3.645 . 0 0 "[ . 1 . 2]" 1
1851 1 87 ILE MG 1 90 ALA H 5.910 . 5.910 4.612 4.526 4.721 . 0 0 "[ . 1 . 2]" 1
1852 1 87 ILE H 1 87 ILE HB 3.460 . 3.460 3.017 2.988 3.053 . 0 0 "[ . 1 . 2]" 1
1853 1 87 ILE H 1 87 ILE MD 4.850 . 4.850 2.304 2.058 2.465 . 0 0 "[ . 1 . 2]" 1
1854 1 87 ILE H 1 87 ILE HG13 3.150 . 3.150 3.157 3.150 3.166 0.016 6 0 "[ . 1 . 2]" 1
1855 1 87 ILE H 1 88 SER HA 4.870 . 4.870 4.801 4.760 4.824 . 0 0 "[ . 1 . 2]" 1
1856 1 87 ILE H 1 88 SER H 3.210 . 3.210 2.427 2.358 2.481 . 0 0 "[ . 1 . 2]" 1
1857 1 88 SER HA 1 88 SER HB3 3.020 . 3.020 2.969 2.351 3.027 0.007 12 0 "[ . 1 . 2]" 1
1858 1 88 SER HA 1 88 SER HB2 3.020 . 3.020 2.459 2.322 3.010 . 0 0 "[ . 1 . 2]" 1
1859 1 88 SER HA 1 90 ALA MB 5.960 . 5.960 4.228 4.122 4.383 . 0 0 "[ . 1 . 2]" 1
1860 1 88 SER H 1 88 SER HA 2.910 . 2.910 2.794 2.783 2.807 . 0 0 "[ . 1 . 2]" 1
1861 1 88 SER H 1 88 SER QB 3.700 . 3.700 2.265 2.216 2.699 . 0 0 "[ . 1 . 2]" 1
1862 1 88 SER H 1 89 SER H 3.010 . 3.010 2.686 2.653 2.718 . 0 0 "[ . 1 . 2]" 1
1863 1 88 SER H 1 90 ALA H 5.260 . 5.260 4.039 3.999 4.123 . 0 0 "[ . 1 . 2]" 1
1864 1 89 SER HA 1 89 SER HB3 2.530 . 2.530 2.473 2.421 2.513 . 0 0 "[ . 1 . 2]" 1
1865 1 89 SER HA 1 90 ALA MB 5.880 . 5.880 4.847 4.817 4.862 . 0 0 "[ . 1 . 2]" 1
1866 1 89 SER HA 1 91 LYS QD 6.380 . 6.380 4.068 3.910 4.364 . 0 0 "[ . 1 . 2]" 1
1867 1 89 SER HB3 1 90 ALA MB 6.520 . 6.520 5.352 5.267 5.431 . 0 0 "[ . 1 . 2]" 1
1868 1 89 SER HB3 1 91 LYS QD 5.030 . 5.030 4.163 4.074 4.431 . 0 0 "[ . 1 . 2]" 1
1869 1 89 SER HB3 1 91 LYS QG 5.900 . 5.900 4.533 4.359 4.668 . 0 0 "[ . 1 . 2]" 1
1870 1 89 SER HB2 1 91 LYS QD 6.330 . 6.330 5.333 5.222 5.651 . 0 0 "[ . 1 . 2]" 1
1871 1 89 SER HB2 1 91 LYS QG 6.380 . 6.380 5.368 5.234 5.441 . 0 0 "[ . 1 . 2]" 1
1872 1 89 SER QB 1 90 ALA H 4.170 . 4.170 3.013 2.875 3.076 . 0 0 "[ . 1 . 2]" 1
1873 1 89 SER H 1 89 SER QB 3.570 . 3.570 2.434 2.369 2.520 . 0 0 "[ . 1 . 2]" 1
1874 1 89 SER H 1 90 ALA MB 5.130 . 5.130 4.129 3.964 4.170 . 0 0 "[ . 1 . 2]" 1
1875 1 89 SER H 1 90 ALA H 3.050 . 3.050 2.459 2.341 2.482 . 0 0 "[ . 1 . 2]" 1
1876 1 90 ALA HA 1 91 LYS QG 5.470 . 5.470 3.712 3.643 3.779 . 0 0 "[ . 1 . 2]" 1
1877 1 90 ALA HA 1 91 LYS H 2.920 . 2.920 2.137 2.128 2.141 . 0 0 "[ . 1 . 2]" 1
1878 1 90 ALA MB 1 91 LYS H 4.410 . 4.410 3.235 3.136 3.287 . 0 0 "[ . 1 . 2]" 1
1879 1 90 ALA H 1 90 ALA HA 2.930 . 2.930 2.683 2.633 2.706 . 0 0 "[ . 1 . 2]" 1
1880 1 90 ALA H 1 90 ALA MB 3.480 . 3.480 2.185 2.119 2.250 . 0 0 "[ . 1 . 2]" 1
1881 1 90 ALA H 1 91 LYS H 4.600 . 4.600 4.460 4.424 4.505 . 0 0 "[ . 1 . 2]" 1
1882 1 91 LYS HA 1 91 LYS QD 4.560 . 4.560 2.003 1.944 2.168 . 0 0 "[ . 1 . 2]" 1
1883 1 91 LYS HA 1 91 LYS QE 5.690 . 5.690 3.954 3.447 4.158 . 0 0 "[ . 1 . 2]" 1
1884 1 91 LYS HA 1 92 ASN HD21 5.230 . 5.230 4.881 4.737 5.045 . 0 0 "[ . 1 . 2]" 1
1885 1 91 LYS HA 1 92 ASN HD22 5.210 . 5.210 4.710 4.606 4.835 . 0 0 "[ . 1 . 2]" 1
1886 1 91 LYS HA 1 92 ASN H 2.740 . 2.740 2.603 2.537 2.621 . 0 0 "[ . 1 . 2]" 1
1887 1 91 LYS HB3 1 92 ASN HD21 4.460 . 4.460 4.253 4.019 4.391 . 0 0 "[ . 1 . 2]" 1
1888 1 91 LYS HB3 1 92 ASN HD22 4.660 . 4.660 4.582 4.385 4.666 0.006 5 0 "[ . 1 . 2]" 1
1889 1 91 LYS HB3 1 92 ASN H 3.360 . 3.360 2.083 2.045 2.200 . 0 0 "[ . 1 . 2]" 1
1890 1 91 LYS HB2 1 92 ASN H 3.320 . 3.320 3.142 3.088 3.348 0.028 4 0 "[ . 1 . 2]" 1
1891 1 91 LYS QD 1 92 ASN HD21 6.380 . 6.380 5.382 5.361 5.485 . 0 0 "[ . 1 . 2]" 1
1892 1 91 LYS QD 1 92 ASN HD22 6.180 . 6.180 4.934 4.886 5.065 . 0 0 "[ . 1 . 2]" 1
1893 1 91 LYS QD 1 92 ASN H 4.650 . 4.650 3.537 3.478 3.714 . 0 0 "[ . 1 . 2]" 1
1894 1 91 LYS QE 1 92 ASN H 5.790 . 5.790 4.588 3.525 5.082 . 0 0 "[ . 1 . 2]" 1
1895 1 91 LYS QG 1 92 ASN H 5.250 . 5.250 4.113 4.088 4.194 . 0 0 "[ . 1 . 2]" 1
1896 1 91 LYS H 1 91 LYS QD 4.800 . 4.800 3.500 3.393 3.716 . 0 0 "[ . 1 . 2]" 1
1897 1 91 LYS H 1 91 LYS QE 6.050 . 6.050 4.997 4.875 5.115 . 0 0 "[ . 1 . 2]" 1
1898 1 91 LYS H 1 92 ASN H 4.550 . 4.550 4.498 4.485 4.520 . 0 0 "[ . 1 . 2]" 1
1899 1 92 ASN HA 1 92 ASN HD21 4.700 . 4.700 3.766 3.720 3.807 . 0 0 "[ . 1 . 2]" 1
1900 1 92 ASN HA 1 92 ASN HD22 5.150 . 5.150 4.930 4.901 4.952 . 0 0 "[ . 1 . 2]" 1
1901 1 92 ASN HA 1 93 LEU H 3.100 . 3.100 2.427 2.370 2.454 . 0 0 "[ . 1 . 2]" 1
1902 1 92 ASN HB3 1 93 LEU H 3.860 . 3.860 3.432 3.389 3.480 . 0 0 "[ . 1 . 2]" 1
1903 1 92 ASN HB2 1 93 LEU H 3.670 . 3.670 2.407 2.346 2.497 . 0 0 "[ . 1 . 2]" 1
1904 1 92 ASN HD21 1 93 LEU H 4.910 . 4.910 3.880 3.792 3.954 . 0 0 "[ . 1 . 2]" 1
1905 1 92 ASN HD21 1 94 LEU HB2 5.500 . 5.500 5.494 5.428 5.508 0.008 1 0 "[ . 1 . 2]" 1
1906 1 92 ASN HD21 1 94 LEU HG 5.500 . 5.500 5.120 5.009 5.182 . 0 0 "[ . 1 . 2]" 1
1907 1 92 ASN HD22 1 93 LEU H 5.500 . 5.500 5.433 5.353 5.503 0.003 6 0 "[ . 1 . 2]" 1
1908 1 92 ASN HD22 1 94 LEU HG 5.500 . 5.500 5.478 5.377 5.507 0.007 16 0 "[ . 1 . 2]" 1
1909 1 92 ASN H 1 92 ASN HB3 3.630 . 3.630 3.511 3.457 3.551 . 0 0 "[ . 1 . 2]" 1
1910 1 92 ASN H 1 92 ASN HB2 3.880 . 3.880 3.686 3.653 3.714 . 0 0 "[ . 1 . 2]" 1
1911 1 92 ASN H 1 92 ASN HD21 4.120 . 4.120 2.529 2.341 2.683 . 0 0 "[ . 1 . 2]" 1
1912 1 92 ASN H 1 92 ASN HD22 3.940 . 3.940 3.100 2.972 3.177 . 0 0 "[ . 1 . 2]" 1
1913 1 92 ASN H 1 93 LEU H 4.520 . 4.520 4.449 4.433 4.471 . 0 0 "[ . 1 . 2]" 1
1914 1 93 LEU HA 1 93 LEU HG 4.060 . 4.060 2.210 2.102 2.426 . 0 0 "[ . 1 . 2]" 1
1915 1 93 LEU HA 1 94 LEU H 3.470 . 3.470 2.145 2.139 2.158 . 0 0 "[ . 1 . 2]" 1
1916 1 93 LEU HB3 1 94 LEU H 4.070 . 4.070 3.848 3.748 3.924 . 0 0 "[ . 1 . 2]" 1
1917 1 93 LEU HB3 1 95 LEU QD 6.620 . 6.620 3.097 2.995 3.224 . 0 0 "[ . 1 . 2]" 1
1918 1 93 LEU HB2 1 94 LEU H 5.280 . 5.280 4.533 4.441 4.573 . 0 0 "[ . 1 . 2]" 1
1919 1 93 LEU HB2 1 95 LEU QD 6.750 . 6.750 4.275 4.186 4.394 . 0 0 "[ . 1 . 2]" 1
1920 1 93 LEU HG 1 94 LEU H 5.500 . 5.500 3.723 3.228 4.164 . 0 0 "[ . 1 . 2]" 1
1921 1 93 LEU HG 1 95 LEU QD 6.970 . 6.970 4.005 3.504 4.247 . 0 0 "[ . 1 . 2]" 1
1922 1 93 LEU H 1 93 LEU HB3 3.600 . 3.600 3.208 3.098 3.282 . 0 0 "[ . 1 . 2]" 1
1923 1 93 LEU H 1 93 LEU HB2 3.620 . 3.620 2.605 2.538 2.674 . 0 0 "[ . 1 . 2]" 1
1924 1 93 LEU H 1 93 LEU MD1 5.630 . 5.630 4.291 4.113 4.546 . 0 0 "[ . 1 . 2]" 1
1925 1 93 LEU H 1 93 LEU MD2 5.630 . 5.630 4.523 4.295 4.625 . 0 0 "[ . 1 . 2]" 1
1926 1 93 LEU H 1 94 LEU H 4.570 . 4.570 4.222 4.167 4.347 . 0 0 "[ . 1 . 2]" 1
1927 1 94 LEU HA 1 94 LEU MD1 4.240 . 4.240 2.160 2.077 2.377 . 0 0 "[ . 1 . 2]" 1
1928 1 94 LEU HA 1 94 LEU HG 4.170 . 4.170 3.740 3.731 3.746 . 0 0 "[ . 1 . 2]" 1
1929 1 94 LEU HA 1 95 LEU MD1 6.520 . 6.520 5.233 5.115 5.336 . 0 0 "[ . 1 . 2]" 1
1930 1 94 LEU HA 1 95 LEU MD2 6.520 . 6.520 4.210 4.034 4.443 . 0 0 "[ . 1 . 2]" 1
1931 1 94 LEU HA 1 95 LEU QD 6.360 . 6.360 4.042 3.921 4.186 . 0 0 "[ . 1 . 2]" 1
1932 1 94 LEU HA 1 95 LEU H 3.180 . 3.180 2.146 2.140 2.150 . 0 0 "[ . 1 . 2]" 1
1933 1 94 LEU HB2 1 95 LEU H 4.550 . 4.550 4.363 4.358 4.376 . 0 0 "[ . 1 . 2]" 1
1934 1 94 LEU MD1 1 95 LEU H 4.490 . 4.490 3.401 3.272 3.499 . 0 0 "[ . 1 . 2]" 1
1935 1 94 LEU MD2 1 95 LEU QD 8.070 . 8.070 4.756 4.666 4.854 . 0 0 "[ . 1 . 2]" 1
1936 1 94 LEU MD2 1 95 LEU H 5.330 . 5.330 4.262 4.180 4.308 . 0 0 "[ . 1 . 2]" 1
1937 1 94 LEU H 1 94 LEU HB3 3.770 . 3.770 3.584 3.570 3.600 . 0 0 "[ . 1 . 2]" 1
1938 1 94 LEU H 1 94 LEU HB2 3.790 . 3.790 2.330 2.310 2.354 . 0 0 "[ . 1 . 2]" 1
1939 1 94 LEU H 1 94 LEU MD2 4.550 . 4.550 2.245 2.141 2.331 . 0 0 "[ . 1 . 2]" 1
1940 1 94 LEU H 1 95 LEU H 4.430 . 4.430 4.432 4.411 4.444 0.014 4 0 "[ . 1 . 2]" 1
1941 1 95 LEU HA 1 95 LEU HG 4.020 . 4.020 3.248 3.171 3.336 . 0 0 "[ . 1 . 2]" 1
1942 1 95 LEU HA 1 96 LEU H 3.280 . 3.280 2.127 2.121 2.134 . 0 0 "[ . 1 . 2]" 1
1943 1 95 LEU HB3 1 96 LEU H 4.570 . 4.570 3.499 3.335 3.593 . 0 0 "[ . 1 . 2]" 1
1944 1 95 LEU HB2 1 96 LEU H 4.570 . 4.570 4.277 4.189 4.324 . 0 0 "[ . 1 . 2]" 1
1945 1 95 LEU QB 1 96 LEU H 4.900 . 4.900 3.350 3.211 3.425 . 0 0 "[ . 1 . 2]" 1
1946 1 95 LEU MD1 1 96 LEU H 6.520 . 6.520 5.146 5.048 5.229 . 0 0 "[ . 1 . 2]" 1
1947 1 95 LEU MD2 1 96 LEU H 6.520 . 6.520 3.578 3.458 3.686 . 0 0 "[ . 1 . 2]" 1
1948 1 95 LEU QD 1 96 LEU H 6.410 . 6.410 3.514 3.403 3.615 . 0 0 "[ . 1 . 2]" 1
1949 1 95 LEU H 1 95 LEU HB3 3.950 . 3.950 3.781 3.759 3.802 . 0 0 "[ . 1 . 2]" 1
1950 1 95 LEU H 1 95 LEU HB2 3.950 . 3.950 2.668 2.635 2.699 . 0 0 "[ . 1 . 2]" 1
1951 1 95 LEU H 1 95 LEU MD1 5.640 . 5.640 4.180 4.097 4.255 . 0 0 "[ . 1 . 2]" 1
1952 1 95 LEU H 1 95 LEU MD2 5.640 . 5.640 3.579 3.468 3.724 . 0 0 "[ . 1 . 2]" 1
1953 1 95 LEU H 1 95 LEU HG 4.210 . 4.210 2.973 2.894 3.049 . 0 0 "[ . 1 . 2]" 1
1954 1 96 LEU HA 1 97 ALA H 3.270 . 3.270 2.159 2.141 2.226 . 0 0 "[ . 1 . 2]" 1
1955 1 96 LEU MD1 1 97 ALA H 5.770 . 5.770 2.748 2.471 3.074 . 0 0 "[ . 1 . 2]" 1
1956 1 96 LEU MD1 1 98 ASN H 6.520 . 6.520 5.342 5.132 5.417 . 0 0 "[ . 1 . 2]" 1
1957 1 96 LEU MD2 1 97 ALA H 5.770 . 5.770 4.546 4.028 4.839 . 0 0 "[ . 1 . 2]" 1
1958 1 96 LEU MD2 1 98 ASN H 6.520 . 6.520 5.263 4.489 5.380 . 0 0 "[ . 1 . 2]" 1
1959 1 96 LEU QD 1 97 ALA H 5.670 . 5.670 2.725 2.459 3.042 . 0 0 "[ . 1 . 2]" 1
1960 1 96 LEU QD 1 98 ASN H 6.900 . 6.900 4.712 4.284 4.774 . 0 0 "[ . 1 . 2]" 1
1961 1 96 LEU HG 1 97 ALA HA 5.500 . 5.500 3.894 3.642 4.110 . 0 0 "[ . 1 . 2]" 1
1962 1 96 LEU HG 1 97 ALA H 3.690 . 3.690 3.067 2.362 3.448 . 0 0 "[ . 1 . 2]" 1
1963 1 96 LEU HG 1 98 ASN H 5.500 . 5.500 4.517 4.283 4.576 . 0 0 "[ . 1 . 2]" 1
1964 1 96 LEU H 1 96 LEU HG 4.670 . 4.670 4.254 4.222 4.305 . 0 0 "[ . 1 . 2]" 1
1965 1 96 LEU H 1 97 ALA H 5.020 . 5.020 4.468 4.356 4.554 . 0 0 "[ . 1 . 2]" 1
1966 1 97 ALA HA 1 98 ASN H 3.510 . 3.510 2.185 2.151 2.214 . 0 0 "[ . 1 . 2]" 1
1967 1 97 ALA MB 1 100 THR HA 5.810 . 5.810 3.909 3.778 3.982 . 0 0 "[ . 1 . 2]" 1
1968 1 97 ALA MB 1 101 GLU H 6.520 . 6.520 5.279 5.085 5.352 . 0 0 "[ . 1 . 2]" 1
1969 1 97 ALA MB 1 102 GLU HA 6.080 . 6.080 4.180 4.012 4.356 . 0 0 "[ . 1 . 2]" 1
1970 1 97 ALA MB 1 102 GLU HB3 4.610 . 4.610 1.852 1.799 1.965 0.001 16 0 "[ . 1 . 2]" 1
1971 1 97 ALA MB 1 102 GLU HB2 4.610 . 4.610 2.759 2.041 3.244 . 0 0 "[ . 1 . 2]" 1
1972 1 97 ALA MB 1 102 GLU HG3 5.370 . 5.370 3.838 2.616 4.193 . 0 0 "[ . 1 . 2]" 1
1973 1 97 ALA MB 1 102 GLU HG2 5.370 . 5.370 3.113 2.460 4.130 . 0 0 "[ . 1 . 2]" 1
1974 1 97 ALA MB 1 102 GLU H 5.500 . 5.500 3.663 3.459 3.801 . 0 0 "[ . 1 . 2]" 1
1975 1 97 ALA MB 1 103 GLN HA 4.670 . 4.670 2.997 2.884 3.073 . 0 0 "[ . 1 . 2]" 1
1976 1 97 ALA MB 1 103 GLN HB3 5.060 . 5.060 3.554 3.414 3.685 . 0 0 "[ . 1 . 2]" 1
1977 1 97 ALA MB 1 103 GLN HB2 4.850 . 4.850 2.305 2.181 2.408 . 0 0 "[ . 1 . 2]" 1
1978 1 97 ALA MB 1 103 GLN HG2 5.510 . 5.510 4.377 4.189 4.486 . 0 0 "[ . 1 . 2]" 1
1979 1 97 ALA MB 1 104 GLN H 5.920 . 5.920 4.752 4.594 4.821 . 0 0 "[ . 1 . 2]" 1
1980 1 97 ALA MB 1 98 ASN H 4.490 . 4.490 3.003 2.913 3.121 . 0 0 "[ . 1 . 2]" 1
1981 1 97 ALA MB 1 99 SER H 3.950 . 3.950 2.415 2.346 2.579 . 0 0 "[ . 1 . 2]" 1
1982 1 97 ALA H 1 103 GLN HB3 5.500 . 5.500 5.437 5.264 5.505 0.005 4 0 "[ . 1 . 2]" 1
1983 1 97 ALA H 1 103 GLN HB2 4.740 . 4.740 3.833 3.668 3.942 . 0 0 "[ . 1 . 2]" 1
1984 1 97 ALA H 1 103 GLN HG3 5.230 . 5.230 4.917 4.559 5.092 . 0 0 "[ . 1 . 2]" 1
1985 1 97 ALA H 1 98 ASN H 4.660 . 4.660 4.507 4.385 4.536 . 0 0 "[ . 1 . 2]" 1
1986 1 97 ALA H 1 99 SER H 5.500 . 5.500 5.032 4.928 5.143 . 0 0 "[ . 1 . 2]" 1
1987 1 98 ASN HA 1 98 ASN HD21 4.550 . 4.550 4.012 3.900 4.085 . 0 0 "[ . 1 . 2]" 1
1988 1 98 ASN HA 1 98 ASN HD22 5.280 . 5.280 4.816 4.579 5.072 . 0 0 "[ . 1 . 2]" 1
1989 1 98 ASN HA 1 99 SER H 3.490 . 3.490 3.473 3.457 3.486 . 0 0 "[ . 1 . 2]" 1
1990 1 98 ASN HB3 1 99 SER H 4.410 . 4.410 4.115 4.022 4.207 . 0 0 "[ . 1 . 2]" 1
1991 1 98 ASN HB2 1 99 SER H 4.410 . 4.410 3.378 2.875 3.929 . 0 0 "[ . 1 . 2]" 1
1992 1 98 ASN HD21 1 99 SER H 4.390 . 4.390 3.950 3.708 4.314 . 0 0 "[ . 1 . 2]" 1
1993 1 98 ASN HD22 1 99 SER H 5.200 . 5.200 4.649 3.984 5.210 0.010 20 0 "[ . 1 . 2]" 1
1994 1 98 ASN H 1 102 GLU HB3 5.110 . 5.110 4.213 4.036 4.387 . 0 0 "[ . 1 . 2]" 1
1995 1 98 ASN H 1 102 GLU HB2 5.110 . 5.110 4.473 4.218 4.659 . 0 0 "[ . 1 . 2]" 1
1996 1 98 ASN H 1 102 GLU QB 5.320 . 5.320 3.852 3.709 4.015 . 0 0 "[ . 1 . 2]" 1
1997 1 98 ASN H 1 102 GLU QG 5.810 . 5.810 4.161 3.646 4.992 . 0 0 "[ . 1 . 2]" 1
1998 1 98 ASN H 1 98 ASN HB3 3.600 . 3.600 3.117 2.587 3.578 . 0 0 "[ . 1 . 2]" 1
1999 1 98 ASN H 1 98 ASN HB2 3.600 . 3.600 3.167 2.736 3.592 . 0 0 "[ . 1 . 2]" 1
2000 1 98 ASN H 1 98 ASN QB 3.760 . 3.760 2.628 2.531 2.687 . 0 0 "[ . 1 . 2]" 1
2001 1 98 ASN H 1 98 ASN HD21 3.960 . 3.960 2.180 2.108 2.303 . 0 0 "[ . 1 . 2]" 1
2002 1 98 ASN H 1 98 ASN HD22 3.920 . 3.920 3.037 2.964 3.171 . 0 0 "[ . 1 . 2]" 1
2003 1 98 ASN H 1 99 SER H 3.110 . 3.110 2.720 2.659 2.792 . 0 0 "[ . 1 . 2]" 1
2004 1 99 SER HA 1 100 THR MG 6.470 . 6.470 5.332 5.308 5.361 . 0 0 "[ . 1 . 2]" 1
2005 1 99 SER HA 1 100 THR H 3.410 . 3.410 2.257 2.231 2.288 . 0 0 "[ . 1 . 2]" 1
2006 1 99 SER HA 1 101 GLU H 4.390 . 4.390 4.301 4.206 4.357 . 0 0 "[ . 1 . 2]" 1
2007 1 99 SER HB3 1 100 THR H 3.690 . 3.690 2.930 2.806 3.241 . 0 0 "[ . 1 . 2]" 1
2008 1 99 SER HB3 1 101 GLU H 3.850 . 3.850 2.990 2.710 3.468 . 0 0 "[ . 1 . 2]" 1
2009 1 99 SER HB2 1 101 GLU HB2 4.660 . 4.660 3.845 3.275 4.628 . 0 0 "[ . 1 . 2]" 1
2010 1 99 SER H 1 100 THR H 4.600 . 4.600 4.397 4.363 4.423 . 0 0 "[ . 1 . 2]" 1
2011 1 99 SER H 1 102 GLU HB3 3.830 . 3.830 3.338 2.898 3.786 . 0 0 "[ . 1 . 2]" 1
2012 1 99 SER H 1 102 GLU HB2 3.830 . 3.830 2.834 2.568 3.203 . 0 0 "[ . 1 . 2]" 1
2013 1 99 SER H 1 102 GLU QB 3.980 . 3.980 2.664 2.528 2.798 . 0 0 "[ . 1 . 2]" 1
2014 1 99 SER H 1 102 GLU QG 5.260 . 5.260 4.083 3.678 4.466 . 0 0 "[ . 1 . 2]" 1
2015 1 99 SER H 1 102 GLU H 4.410 . 4.410 3.952 3.815 4.060 . 0 0 "[ . 1 . 2]" 1
2016 1 99 SER H 1 103 GLN H 4.620 . 4.620 4.628 4.624 4.633 0.013 7 0 "[ . 1 . 2]" 1
2017 1 99 SER H 1 99 SER HB3 4.130 . 4.130 3.751 3.374 3.898 . 0 0 "[ . 1 . 2]" 1
2018 1 99 SER H 1 99 SER HB2 3.420 . 3.420 2.752 2.588 3.054 . 0 0 "[ . 1 . 2]" 1
2019 1 100 THR HA 1 103 GLN HB3 4.200 . 4.200 3.093 3.020 3.177 . 0 0 "[ . 1 . 2]" 1
2020 1 100 THR HA 1 103 GLN HB2 5.000 . 5.000 3.779 3.691 3.838 . 0 0 "[ . 1 . 2]" 1
2021 1 100 THR HA 1 103 GLN HG3 5.150 . 5.150 5.142 5.083 5.158 0.008 6 0 "[ . 1 . 2]" 1
2022 1 100 THR HB 1 101 GLU HB3 5.500 . 5.500 5.506 5.500 5.518 0.018 1 0 "[ . 1 . 2]" 1
2023 1 100 THR HB 1 101 GLU HB2 5.130 . 5.130 5.113 5.035 5.136 0.006 3 0 "[ . 1 . 2]" 1
2024 1 100 THR HB 1 101 GLU QG 5.460 . 5.460 3.335 3.303 3.357 . 0 0 "[ . 1 . 2]" 1
2025 1 100 THR HB 1 101 GLU H 3.160 . 3.160 2.533 2.489 2.567 . 0 0 "[ . 1 . 2]" 1
2026 1 100 THR HB 1 104 GLN HE21 4.710 . 4.710 2.905 2.833 2.984 . 0 0 "[ . 1 . 2]" 1
2027 1 100 THR HB 1 104 GLN HE22 4.710 . 4.710 4.170 4.111 4.249 . 0 0 "[ . 1 . 2]" 1
2028 1 100 THR HB 1 104 GLN QE 4.980 . 4.980 2.853 2.786 2.928 . 0 0 "[ . 1 . 2]" 1
2029 1 100 THR MG 1 101 GLU HA 5.340 . 5.340 4.317 4.229 4.364 . 0 0 "[ . 1 . 2]" 1
2030 1 100 THR MG 1 101 GLU HG3 6.230 . 6.230 5.134 5.002 5.199 . 0 0 "[ . 1 . 2]" 1
2031 1 100 THR MG 1 101 GLU HG2 6.230 . 6.230 4.810 4.689 4.988 . 0 0 "[ . 1 . 2]" 1
2032 1 100 THR MG 1 101 GLU QG 6.450 . 6.450 4.411 4.357 4.457 . 0 0 "[ . 1 . 2]" 1
2033 1 100 THR MG 1 101 GLU H 4.880 . 4.880 3.884 3.840 3.913 . 0 0 "[ . 1 . 2]" 1
2034 1 100 THR MG 1 103 GLN HB2 5.870 . 5.870 4.482 4.400 4.572 . 0 0 "[ . 1 . 2]" 1
2035 1 100 THR MG 1 104 GLN HE21 4.540 . 4.540 1.952 1.887 2.035 . 0 0 "[ . 1 . 2]" 1
2036 1 100 THR MG 1 104 GLN HE22 4.540 . 4.540 2.083 1.985 2.156 . 0 0 "[ . 1 . 2]" 1
2037 1 100 THR MG 1 104 GLN HG3 5.430 . 5.430 4.080 3.984 4.180 . 0 0 "[ . 1 . 2]" 1
2038 1 100 THR MG 1 104 GLN HG2 5.430 . 5.430 3.918 3.831 3.982 . 0 0 "[ . 1 . 2]" 1
2039 1 100 THR MG 1 104 GLN QG 5.730 . 5.730 3.557 3.482 3.628 . 0 0 "[ . 1 . 2]" 1
2040 1 100 THR MG 1 104 GLN H 5.670 . 5.670 4.532 4.472 4.591 . 0 0 "[ . 1 . 2]" 1
2041 1 100 THR H 1 100 THR HB 3.540 . 3.540 2.923 2.874 2.963 . 0 0 "[ . 1 . 2]" 1
2042 1 100 THR H 1 101 GLU HB2 5.140 . 5.140 5.104 5.043 5.150 0.010 1 0 "[ . 1 . 2]" 1
2043 1 100 THR H 1 101 GLU H 3.550 . 3.550 2.788 2.747 2.836 . 0 0 "[ . 1 . 2]" 1
2044 1 100 THR H 1 102 GLU H 4.840 . 4.840 4.245 4.158 4.339 . 0 0 "[ . 1 . 2]" 1
2045 1 101 GLU HA 1 101 GLU HG3 3.770 . 3.770 3.421 3.291 3.485 . 0 0 "[ . 1 . 2]" 1
2046 1 101 GLU HA 1 101 GLU HG2 3.770 . 3.770 2.547 2.485 2.576 . 0 0 "[ . 1 . 2]" 1
2047 1 101 GLU HA 1 104 GLN HB3 4.620 . 4.620 4.493 4.348 4.583 . 0 0 "[ . 1 . 2]" 1
2048 1 101 GLU HA 1 104 GLN HB2 3.740 . 3.740 3.369 3.232 3.446 . 0 0 "[ . 1 . 2]" 1
2049 1 101 GLU HA 1 104 GLN HE21 4.880 . 4.880 3.292 3.265 3.324 . 0 0 "[ . 1 . 2]" 1
2050 1 101 GLU HA 1 104 GLN HE22 4.880 . 4.880 4.892 4.885 4.899 0.019 14 0 "[ . 1 . 2]" 1
2051 1 101 GLU HA 1 104 GLN QE 5.090 . 5.090 3.243 3.219 3.273 . 0 0 "[ . 1 . 2]" 1
2052 1 101 GLU HA 1 104 GLN HG3 4.570 . 4.570 2.848 2.658 2.975 . 0 0 "[ . 1 . 2]" 1
2053 1 101 GLU HA 1 104 GLN HG2 4.570 . 4.570 1.937 1.902 1.959 . 0 0 "[ . 1 . 2]" 1
2054 1 101 GLU HA 1 104 GLN H 3.550 . 3.550 3.378 3.318 3.438 . 0 0 "[ . 1 . 2]" 1
2055 1 101 GLU HA 1 105 LYS H 4.610 . 4.610 4.324 4.252 4.398 . 0 0 "[ . 1 . 2]" 1
2056 1 101 GLU HB3 1 102 GLU HA 4.930 . 4.930 4.622 4.559 4.655 . 0 0 "[ . 1 . 2]" 1
2057 1 101 GLU HB3 1 102 GLU H 4.100 . 4.100 3.830 3.751 3.890 . 0 0 "[ . 1 . 2]" 1
2058 1 101 GLU H 1 101 GLU HA 2.810 . 2.810 2.765 2.757 2.777 . 0 0 "[ . 1 . 2]" 1
2059 1 101 GLU H 1 101 GLU HB3 3.610 . 3.610 3.575 3.569 3.582 . 0 0 "[ . 1 . 2]" 1
2060 1 101 GLU H 1 101 GLU HB2 2.830 . 2.830 2.698 2.659 2.718 . 0 0 "[ . 1 . 2]" 1
2061 1 101 GLU H 1 101 GLU HG3 3.590 . 3.590 2.065 1.990 2.200 . 0 0 "[ . 1 . 2]" 1
2062 1 101 GLU H 1 101 GLU HG2 3.590 . 3.590 2.731 2.617 2.942 . 0 0 "[ . 1 . 2]" 1
2063 1 101 GLU H 1 101 GLU QG 3.940 . 3.940 2.003 1.952 2.106 . 0 0 "[ . 1 . 2]" 1
2064 1 101 GLU H 1 102 GLU H 3.210 . 3.210 2.793 2.747 2.832 . 0 0 "[ . 1 . 2]" 1
2065 1 101 GLU H 1 103 GLN HB3 5.500 . 5.500 5.356 5.295 5.421 . 0 0 "[ . 1 . 2]" 1
2066 1 101 GLU H 1 103 GLN H 4.490 . 4.490 4.337 4.258 4.384 . 0 0 "[ . 1 . 2]" 1
2067 1 101 GLU H 1 104 GLN HE21 5.500 . 5.500 3.967 3.876 4.030 . 0 0 "[ . 1 . 2]" 1
2068 1 101 GLU H 1 104 GLN HE22 5.500 . 5.500 5.507 5.501 5.518 0.018 15 0 "[ . 1 . 2]" 1
2069 1 101 GLU H 1 104 GLN H 5.140 . 5.140 4.933 4.859 4.963 . 0 0 "[ . 1 . 2]" 1
2070 1 102 GLU HA 1 102 GLU HG3 3.920 . 3.920 2.313 2.062 3.277 . 0 0 "[ . 1 . 2]" 1
2071 1 102 GLU HA 1 102 GLU HG2 3.920 . 3.920 3.352 2.020 3.695 . 0 0 "[ . 1 . 2]" 1
2072 1 102 GLU HA 1 104 GLN H 4.390 . 4.390 4.293 4.210 4.394 0.004 15 0 "[ . 1 . 2]" 1
2073 1 102 GLU HA 1 105 LYS QB 4.720 . 4.720 2.812 2.504 3.551 . 0 0 "[ . 1 . 2]" 1
2074 1 102 GLU HA 1 105 LYS QD 5.240 . 5.240 3.841 2.516 4.414 . 0 0 "[ . 1 . 2]" 1
2075 1 102 GLU HA 1 105 LYS QE 5.970 . 5.970 4.116 3.254 4.946 . 0 0 "[ . 1 . 2]" 1
2076 1 102 GLU QG 1 103 GLN H 5.640 . 5.640 4.260 3.865 4.471 . 0 0 "[ . 1 . 2]" 1
2077 1 102 GLU H 1 102 GLU QG 4.880 . 4.880 3.850 3.375 4.060 . 0 0 "[ . 1 . 2]" 1
2078 1 102 GLU H 1 103 GLN HB3 5.050 . 5.050 4.809 4.719 4.903 . 0 0 "[ . 1 . 2]" 1
2079 1 103 GLN HA 1 103 GLN HG3 4.120 . 4.120 3.470 3.416 3.543 . 0 0 "[ . 1 . 2]" 1
2080 1 103 GLN HA 1 105 LYS H 5.030 . 5.030 4.395 4.299 4.608 . 0 0 "[ . 1 . 2]" 1
2081 1 103 GLN HA 1 106 TRP QB 5.230 . 5.230 2.682 2.446 2.887 . 0 0 "[ . 1 . 2]" 1
2082 1 103 GLN HA 1 107 VAL QG 6.760 . 6.760 3.152 3.068 3.256 . 0 0 "[ . 1 . 2]" 1
2083 1 103 GLN HA 1 107 VAL H 4.110 . 4.110 3.634 3.586 3.675 . 0 0 "[ . 1 . 2]" 1
2084 1 103 GLN HB2 1 107 VAL QG 6.620 . 6.620 4.246 4.218 4.273 . 0 0 "[ . 1 . 2]" 1
2085 1 103 GLN HE21 1 107 VAL MG1 6.520 . 6.520 3.636 3.457 5.286 . 0 0 "[ . 1 . 2]" 1
2086 1 103 GLN HE21 1 107 VAL MG2 6.520 . 6.520 2.043 1.934 3.676 . 0 0 "[ . 1 . 2]" 1
2087 1 103 GLN HE22 1 107 VAL MG1 6.520 . 6.520 4.404 4.054 5.086 . 0 0 "[ . 1 . 2]" 1
2088 1 103 GLN HE22 1 107 VAL MG2 6.520 . 6.520 3.421 3.057 3.831 . 0 0 "[ . 1 . 2]" 1
2089 1 103 GLN QE 1 107 VAL QG 6.900 . 6.900 2.000 1.903 3.265 . 0 0 "[ . 1 . 2]" 1
2090 1 103 GLN HG3 1 107 VAL QG 5.880 . 5.880 3.386 3.324 3.458 . 0 0 "[ . 1 . 2]" 1
2091 1 103 GLN HG2 1 104 GLN H 4.380 . 4.380 4.196 4.039 4.306 . 0 0 "[ . 1 . 2]" 1
2092 1 103 GLN H 1 103 GLN HB3 3.290 . 3.290 2.401 2.355 2.465 . 0 0 "[ . 1 . 2]" 1
2093 1 103 GLN H 1 103 GLN HB2 3.450 . 3.450 2.654 2.585 2.710 . 0 0 "[ . 1 . 2]" 1
2094 1 103 GLN H 1 104 GLN QG 5.760 . 5.760 3.803 3.710 3.867 . 0 0 "[ . 1 . 2]" 1
2095 1 103 GLN H 1 104 GLN H 3.320 . 3.320 2.641 2.559 2.693 . 0 0 "[ . 1 . 2]" 1
2096 1 104 GLN HA 1 104 GLN HE21 5.500 . 5.500 4.813 4.616 4.891 . 0 0 "[ . 1 . 2]" 1
2097 1 104 GLN HA 1 104 GLN HE22 5.500 . 5.500 4.599 4.447 4.670 . 0 0 "[ . 1 . 2]" 1
2098 1 104 GLN HA 1 104 GLN QE 5.690 . 5.690 4.185 4.032 4.251 . 0 0 "[ . 1 . 2]" 1
2099 1 104 GLN HA 1 104 GLN HG3 3.880 . 3.880 3.872 3.853 3.887 0.007 16 0 "[ . 1 . 2]" 1
2100 1 104 GLN HA 1 104 GLN HG2 3.880 . 3.880 3.591 3.498 3.633 . 0 0 "[ . 1 . 2]" 1
2101 1 104 GLN HA 1 107 VAL HB 3.960 . 3.960 3.318 3.185 3.358 . 0 0 "[ . 1 . 2]" 1
2102 1 104 GLN HA 1 107 VAL MG1 5.600 . 5.600 4.572 4.404 4.630 . 0 0 "[ . 1 . 2]" 1
2103 1 104 GLN HA 1 107 VAL MG2 5.600 . 5.600 3.696 3.465 3.837 . 0 0 "[ . 1 . 2]" 1
2104 1 104 GLN HA 1 107 VAL QG 5.960 . 5.960 3.545 3.368 3.646 . 0 0 "[ . 1 . 2]" 1
2105 1 104 GLN HA 1 107 VAL H 4.210 . 4.210 4.067 4.004 4.106 . 0 0 "[ . 1 . 2]" 1
2106 1 104 GLN HA 1 108 SER H 4.200 . 4.200 3.790 3.663 3.931 . 0 0 "[ . 1 . 2]" 1
2107 1 104 GLN HB3 1 108 SER H 5.500 . 5.500 5.222 5.088 5.310 . 0 0 "[ . 1 . 2]" 1
2108 1 104 GLN HB2 1 105 LYS H 3.390 . 3.390 2.693 2.382 2.844 . 0 0 "[ . 1 . 2]" 1
2109 1 104 GLN HB2 1 108 SER H 5.500 . 5.500 5.452 5.356 5.509 0.009 9 0 "[ . 1 . 2]" 1
2110 1 104 GLN QG 1 105 LYS H 4.550 . 4.550 3.489 3.462 3.517 . 0 0 "[ . 1 . 2]" 1
2111 1 104 GLN H 1 104 GLN HB3 3.670 . 3.670 3.563 3.551 3.570 . 0 0 "[ . 1 . 2]" 1
2112 1 104 GLN H 1 104 GLN HB2 3.160 . 3.160 2.918 2.871 2.949 . 0 0 "[ . 1 . 2]" 1
2113 1 104 GLN H 1 104 GLN QE 5.280 . 5.280 3.225 3.085 3.313 . 0 0 "[ . 1 . 2]" 1
2114 1 104 GLN H 1 104 GLN HG3 3.500 . 3.500 3.464 3.444 3.474 . 0 0 "[ . 1 . 2]" 1
2115 1 104 GLN H 1 104 GLN HG2 3.500 . 3.500 1.961 1.920 1.983 . 0 0 "[ . 1 . 2]" 1
2116 1 104 GLN H 1 104 GLN QG 3.870 . 3.870 1.951 1.911 1.972 . 0 0 "[ . 1 . 2]" 1
2117 1 104 GLN H 1 105 LYS QB 5.560 . 5.560 4.369 4.256 4.576 . 0 0 "[ . 1 . 2]" 1
2118 1 104 GLN H 1 105 LYS H 3.440 . 3.440 2.590 2.498 2.775 . 0 0 "[ . 1 . 2]" 1
2119 1 104 GLN H 1 107 VAL QG 7.220 . 7.220 4.521 4.399 4.595 . 0 0 "[ . 1 . 2]" 1
2120 1 105 LYS HA 1 105 LYS HG3 4.060 . 4.060 2.714 2.578 3.611 . 0 0 "[ . 1 . 2]" 1
2121 1 105 LYS HA 1 105 LYS HG2 4.060 . 4.060 3.248 3.165 3.820 . 0 0 "[ . 1 . 2]" 1
2122 1 105 LYS HA 1 107 VAL H 4.960 . 4.960 4.715 4.676 4.770 . 0 0 "[ . 1 . 2]" 1
2123 1 105 LYS HA 1 109 ARG HG2 4.690 . 4.690 3.649 3.348 3.844 . 0 0 "[ . 1 . 2]" 1
2124 1 105 LYS QB 1 106 TRP H 3.980 . 3.980 2.479 2.351 3.317 . 0 0 "[ . 1 . 2]" 1
2125 1 105 LYS QE 1 106 TRP H 5.480 . 5.480 4.102 3.563 4.737 . 0 0 "[ . 1 . 2]" 1
2126 1 105 LYS QG 1 106 TRP H 4.750 . 4.750 3.197 1.951 3.407 . 0 0 "[ . 1 . 2]" 1
2127 1 105 LYS QG 1 109 ARG QD 7.060 . 7.060 3.900 2.907 4.651 . 0 0 "[ . 1 . 2]" 1
2128 1 105 LYS H 1 105 LYS QB 3.620 . 3.620 2.241 2.217 2.312 . 0 0 "[ . 1 . 2]" 1
2129 1 105 LYS H 1 105 LYS QG 4.900 . 4.900 3.887 2.598 3.970 . 0 0 "[ . 1 . 2]" 1
2130 1 105 LYS H 1 106 TRP H 3.300 . 3.300 2.626 2.574 2.685 . 0 0 "[ . 1 . 2]" 1
2131 1 106 TRP HA 1 106 TRP HE1 5.280 . 5.280 4.957 4.942 4.975 . 0 0 "[ . 1 . 2]" 1
2132 1 106 TRP HA 1 109 ARG HB3 4.740 . 4.740 4.411 4.258 4.515 . 0 0 "[ . 1 . 2]" 1
2133 1 106 TRP HA 1 109 ARG HB2 4.880 . 4.880 2.957 2.848 3.062 . 0 0 "[ . 1 . 2]" 1
2134 1 106 TRP HA 1 109 ARG HG2 5.280 . 5.280 5.059 4.858 5.283 0.003 11 0 "[ . 1 . 2]" 1
2135 1 106 TRP HA 1 109 ARG H 4.190 . 4.190 3.829 3.753 3.900 . 0 0 "[ . 1 . 2]" 1
2136 1 106 TRP HA 1 110 LEU H 4.530 . 4.530 3.624 3.485 3.768 . 0 0 "[ . 1 . 2]" 1
2137 1 106 TRP QB 1 107 VAL QG 8.110 . 8.110 2.921 2.860 2.974 . 0 0 "[ . 1 . 2]" 1
2138 1 106 TRP QB 1 107 VAL H 4.450 . 4.450 2.525 2.513 2.540 . 0 0 "[ . 1 . 2]" 1
2139 1 106 TRP QB 1 108 SER H 5.880 . 5.880 4.748 4.688 4.836 . 0 0 "[ . 1 . 2]" 1
2140 1 106 TRP H 1 107 VAL QG 6.900 . 6.900 4.145 4.080 4.238 . 0 0 "[ . 1 . 2]" 1
2141 1 106 TRP H 1 107 VAL H 3.440 . 3.440 2.859 2.821 2.878 . 0 0 "[ . 1 . 2]" 1
2142 1 106 TRP H 1 108 SER H 4.760 . 4.760 4.372 4.282 4.498 . 0 0 "[ . 1 . 2]" 1
2143 1 107 VAL HA 1 110 LEU HB3 4.590 . 4.590 4.175 3.972 4.332 . 0 0 "[ . 1 . 2]" 1
2144 1 107 VAL HA 1 110 LEU HB2 5.170 . 5.170 4.961 4.818 5.046 . 0 0 "[ . 1 . 2]" 1
2145 1 107 VAL HA 1 110 LEU MD1 5.400 . 5.400 3.322 3.185 3.592 . 0 0 "[ . 1 . 2]" 1
2146 1 107 VAL HA 1 110 LEU H 4.730 . 4.730 3.889 3.739 3.998 . 0 0 "[ . 1 . 2]" 1
2147 1 107 VAL HA 1 111 VAL QG 6.810 . 6.810 4.070 4.021 4.099 . 0 0 "[ . 1 . 2]" 1
2148 1 107 VAL HA 1 111 VAL H 4.360 . 4.360 3.684 3.545 3.774 . 0 0 "[ . 1 . 2]" 1
2149 1 107 VAL HB 1 108 SER H 3.110 . 3.110 2.394 2.291 2.463 . 0 0 "[ . 1 . 2]" 1
2150 1 107 VAL MG1 1 108 SER H 5.170 . 5.170 3.407 3.328 3.489 . 0 0 "[ . 1 . 2]" 1
2151 1 107 VAL MG2 1 108 SER H 5.170 . 5.170 3.712 3.663 3.753 . 0 0 "[ . 1 . 2]" 1
2152 1 107 VAL QG 1 108 SER QB 7.420 . 7.420 4.185 3.906 4.472 . 0 0 "[ . 1 . 2]" 1
2153 1 107 VAL QG 1 108 SER H 5.220 . 5.220 3.150 3.097 3.191 . 0 0 "[ . 1 . 2]" 1
2154 1 107 VAL QG 1 111 VAL HA 7.450 . 7.450 4.851 4.664 5.043 . 0 0 "[ . 1 . 2]" 1
2155 1 107 VAL QG 1 111 VAL QG 7.400 . 7.400 2.879 2.764 2.955 . 0 0 "[ . 1 . 2]" 1
2156 1 107 VAL H 1 107 VAL HB 3.110 . 3.110 2.584 2.551 2.616 . 0 0 "[ . 1 . 2]" 1
2157 1 107 VAL H 1 108 SER HA 5.480 . 5.480 5.340 5.293 5.393 . 0 0 "[ . 1 . 2]" 1
2158 1 107 VAL H 1 108 SER QB 6.240 . 6.240 4.594 4.458 4.862 . 0 0 "[ . 1 . 2]" 1
2159 1 107 VAL H 1 108 SER H 3.190 . 3.190 2.762 2.698 2.837 . 0 0 "[ . 1 . 2]" 1
2160 1 108 SER HA 1 111 VAL HB 3.990 . 3.990 3.967 3.840 3.998 0.008 15 0 "[ . 1 . 2]" 1
2161 1 108 SER HA 1 111 VAL MG1 5.330 . 5.330 1.990 1.927 2.008 . 0 0 "[ . 1 . 2]" 1
2162 1 108 SER HA 1 111 VAL MG2 5.330 . 5.330 4.402 4.352 4.434 . 0 0 "[ . 1 . 2]" 1
2163 1 108 SER HA 1 111 VAL QG 5.500 . 5.500 1.987 1.925 2.005 . 0 0 "[ . 1 . 2]" 1
2164 1 108 SER HA 1 111 VAL H 4.050 . 4.050 3.892 3.853 3.909 . 0 0 "[ . 1 . 2]" 1
2165 1 108 SER HA 1 112 LYS HG3 4.770 . 4.770 3.748 3.552 3.934 . 0 0 "[ . 1 . 2]" 1
2166 1 108 SER HA 1 112 LYS H 4.560 . 4.560 3.840 3.760 3.893 . 0 0 "[ . 1 . 2]" 1
2167 1 108 SER HB3 1 109 ARG HG2 5.500 . 5.500 3.962 3.259 4.592 . 0 0 "[ . 1 . 2]" 1
2168 1 108 SER HB3 1 112 LYS HG3 5.500 . 5.500 4.392 3.646 5.212 . 0 0 "[ . 1 . 2]" 1
2169 1 108 SER HB2 1 109 ARG HG2 5.500 . 5.500 4.614 3.625 5.388 . 0 0 "[ . 1 . 2]" 1
2170 1 108 SER HB2 1 112 LYS HG3 5.500 . 5.500 5.200 4.907 5.460 . 0 0 "[ . 1 . 2]" 1
2171 1 108 SER QB 1 109 ARG HG2 5.570 . 5.570 3.547 3.215 3.660 . 0 0 "[ . 1 . 2]" 1
2172 1 108 SER QB 1 109 ARG H 4.510 . 4.510 2.696 2.655 2.730 . 0 0 "[ . 1 . 2]" 1
2173 1 108 SER QB 1 111 VAL QG 7.030 . 7.030 3.611 3.476 3.709 . 0 0 "[ . 1 . 2]" 1
2174 1 108 SER QB 1 112 LYS QD 7.110 . 7.110 4.471 3.258 5.458 . 0 0 "[ . 1 . 2]" 1
2175 1 108 SER H 1 108 SER QB 3.720 . 3.720 2.310 2.180 2.544 . 0 0 "[ . 1 . 2]" 1
2176 1 108 SER H 1 109 ARG HB2 4.800 . 4.800 4.720 4.627 4.803 0.003 8 0 "[ . 1 . 2]" 1
2177 1 108 SER H 1 109 ARG HG2 5.170 . 5.170 5.112 4.837 5.182 0.012 5 0 "[ . 1 . 2]" 1
2178 1 108 SER H 1 110 LEU H 4.730 . 4.730 4.496 4.472 4.538 . 0 0 "[ . 1 . 2]" 1
2179 1 108 SER H 1 111 VAL HB 5.500 . 5.500 5.266 5.109 5.367 . 0 0 "[ . 1 . 2]" 1
2180 1 109 ARG HA 1 109 ARG QD 4.260 . 4.260 2.504 1.949 3.654 . 0 0 "[ . 1 . 2]" 1
2181 1 109 ARG HA 1 109 ARG HG3 4.010 . 4.010 3.653 3.604 3.703 . 0 0 "[ . 1 . 2]" 1
2182 1 109 ARG HA 1 109 ARG HG2 3.820 . 3.820 2.553 2.339 2.743 . 0 0 "[ . 1 . 2]" 1
2183 1 109 ARG HA 1 112 LYS HB3 4.310 . 4.310 4.063 3.901 4.187 . 0 0 "[ . 1 . 2]" 1
2184 1 109 ARG HA 1 112 LYS HB2 3.880 . 3.880 2.614 2.507 2.681 . 0 0 "[ . 1 . 2]" 1
2185 1 109 ARG HA 1 112 LYS QD 5.240 . 5.240 3.791 3.205 4.699 . 0 0 "[ . 1 . 2]" 1
2186 1 109 ARG HA 1 112 LYS HG3 5.320 . 5.320 4.079 3.997 4.197 . 0 0 "[ . 1 . 2]" 1
2187 1 109 ARG HA 1 112 LYS HG2 5.500 . 5.500 5.327 5.214 5.403 . 0 0 "[ . 1 . 2]" 1
2188 1 109 ARG HA 1 112 LYS H 3.580 . 3.580 3.567 3.522 3.592 0.012 7 0 "[ . 1 . 2]" 1
2189 1 109 ARG HB3 1 110 LEU H 3.570 . 3.570 3.117 3.015 3.269 . 0 0 "[ . 1 . 2]" 1
2190 1 109 ARG HB2 1 110 LEU H 3.550 . 3.550 2.503 2.406 2.581 . 0 0 "[ . 1 . 2]" 1
2191 1 109 ARG QD 1 110 LEU H 5.980 . 5.980 4.776 4.637 5.063 . 0 0 "[ . 1 . 2]" 1
2192 1 109 ARG H 1 109 ARG HB2 3.130 . 3.130 2.255 2.189 2.357 . 0 0 "[ . 1 . 2]" 1
2193 1 109 ARG H 1 109 ARG QD 5.420 . 5.420 4.296 4.080 4.548 . 0 0 "[ . 1 . 2]" 1
2194 1 109 ARG H 1 109 ARG HG2 3.090 . 3.090 2.894 2.680 2.982 . 0 0 "[ . 1 . 2]" 1
2195 1 109 ARG H 1 110 LEU HB3 4.890 . 4.890 4.859 4.757 4.899 0.009 5 0 "[ . 1 . 2]" 1
2196 1 109 ARG H 1 110 LEU MD2 5.770 . 5.770 4.670 4.602 4.714 . 0 0 "[ . 1 . 2]" 1
2197 1 109 ARG H 1 110 LEU HG 4.490 . 4.490 4.305 4.183 4.527 0.037 6 0 "[ . 1 . 2]" 1
2198 1 109 ARG H 1 110 LEU H 3.410 . 3.410 2.651 2.633 2.661 . 0 0 "[ . 1 . 2]" 1
2199 1 109 ARG H 1 111 VAL H 4.180 . 4.180 3.885 3.815 3.919 . 0 0 "[ . 1 . 2]" 1
2200 1 109 ARG H 1 112 LYS H 5.110 . 5.110 4.508 4.478 4.541 . 0 0 "[ . 1 . 2]" 1
2201 1 110 LEU HA 1 110 LEU HG 4.220 . 4.220 3.699 3.683 3.706 . 0 0 "[ . 1 . 2]" 1
2202 1 110 LEU HA 1 113 LYS QB 4.940 . 4.940 2.888 2.725 3.058 . 0 0 "[ . 1 . 2]" 1
2203 1 110 LEU HA 1 113 LYS QD 5.720 . 5.720 3.602 1.966 4.739 . 0 0 "[ . 1 . 2]" 1
2204 1 110 LEU HA 1 113 LYS QG 4.800 . 4.800 3.120 2.266 4.163 . 0 0 "[ . 1 . 2]" 1
2205 1 110 LEU HA 1 113 LYS H 3.800 . 3.800 3.587 3.529 3.667 . 0 0 "[ . 1 . 2]" 1
2206 1 110 LEU HB2 1 111 VAL H 4.130 . 4.130 3.954 3.909 4.047 . 0 0 "[ . 1 . 2]" 1
2207 1 110 LEU MD1 1 111 VAL HA 4.660 . 4.660 2.496 2.259 2.730 . 0 0 "[ . 1 . 2]" 1
2208 1 110 LEU MD1 1 111 VAL H 4.100 . 4.100 2.719 2.604 3.087 . 0 0 "[ . 1 . 2]" 1
2209 1 110 LEU MD2 1 111 VAL H 4.910 . 4.910 3.752 3.685 3.790 . 0 0 "[ . 1 . 2]" 1
2210 1 110 LEU HG 1 111 VAL QG 6.680 . 6.680 3.580 3.516 3.641 . 0 0 "[ . 1 . 2]" 1
2211 1 110 LEU HG 1 111 VAL H 3.820 . 3.820 2.022 1.970 2.068 . 0 0 "[ . 1 . 2]" 1
2212 1 110 LEU H 1 110 LEU HB3 3.460 . 3.460 2.343 2.269 2.379 . 0 0 "[ . 1 . 2]" 1
2213 1 110 LEU H 1 110 LEU HB2 3.640 . 3.640 3.561 3.537 3.572 . 0 0 "[ . 1 . 2]" 1
2214 1 110 LEU H 1 110 LEU MD1 5.140 . 5.140 3.930 3.865 4.067 . 0 0 "[ . 1 . 2]" 1
2215 1 110 LEU H 1 110 LEU MD2 4.520 . 4.520 3.235 3.193 3.286 . 0 0 "[ . 1 . 2]" 1
2216 1 110 LEU H 1 110 LEU HG 3.450 . 3.450 2.606 2.510 2.821 . 0 0 "[ . 1 . 2]" 1
2217 1 110 LEU H 1 111 VAL HB 5.300 . 5.300 5.013 4.922 5.069 . 0 0 "[ . 1 . 2]" 1
2218 1 110 LEU H 1 111 VAL QG 6.410 . 6.410 4.036 3.997 4.071 . 0 0 "[ . 1 . 2]" 1
2219 1 110 LEU H 1 111 VAL H 3.240 . 3.240 2.712 2.663 2.741 . 0 0 "[ . 1 . 2]" 1
2220 1 110 LEU H 1 112 LYS H 4.260 . 4.260 4.223 4.196 4.260 . 0 0 "[ . 1 . 2]" 1
2221 1 110 LEU H 1 113 LYS H 5.110 . 5.110 4.853 4.818 4.881 . 0 0 "[ . 1 . 2]" 1
2222 1 111 VAL HA 1 113 LYS H 4.210 . 4.210 4.004 3.971 4.041 . 0 0 "[ . 1 . 2]" 1
2223 1 111 VAL HA 1 114 ILE HB 4.180 . 4.180 3.645 3.454 3.845 . 0 0 "[ . 1 . 2]" 1
2224 1 111 VAL HA 1 114 ILE MD 4.440 . 4.440 1.992 1.923 2.093 . 0 0 "[ . 1 . 2]" 1
2225 1 111 VAL HA 1 114 ILE QG 4.810 . 4.810 2.041 1.969 2.475 . 0 0 "[ . 1 . 2]" 1
2226 1 111 VAL HA 1 114 ILE MG 6.520 . 6.520 4.368 4.275 4.478 . 0 0 "[ . 1 . 2]" 1
2227 1 111 VAL HA 1 114 ILE H 3.650 . 3.650 3.360 3.281 3.551 . 0 0 "[ . 1 . 2]" 1
2228 1 111 VAL HB 1 112 LYS H 4.030 . 4.030 3.775 3.738 3.809 . 0 0 "[ . 1 . 2]" 1
2229 1 111 VAL HB 1 113 LYS H 5.500 . 5.500 5.519 5.510 5.527 0.027 1 0 "[ . 1 . 2]" 1
2230 1 111 VAL HB 1 114 ILE MD 5.340 . 5.340 3.525 3.443 3.694 . 0 0 "[ . 1 . 2]" 1
2231 1 111 VAL MG1 1 112 LYS HA 5.180 . 5.180 3.041 2.981 3.116 . 0 0 "[ . 1 . 2]" 1
2232 1 111 VAL MG1 1 112 LYS HG3 6.120 . 6.120 2.844 2.641 2.970 . 0 0 "[ . 1 . 2]" 1
2233 1 111 VAL MG1 1 112 LYS H 5.110 . 5.110 1.907 1.888 1.924 . 0 0 "[ . 1 . 2]" 1
2234 1 111 VAL MG1 1 114 ILE MD 6.330 . 6.330 4.055 3.916 4.163 . 0 0 "[ . 1 . 2]" 1
2235 1 111 VAL MG2 1 112 LYS HA 5.180 . 5.180 3.951 3.848 4.071 . 0 0 "[ . 1 . 2]" 1
2236 1 111 VAL MG2 1 112 LYS HG3 6.120 . 6.120 4.883 4.639 5.027 . 0 0 "[ . 1 . 2]" 1
2237 1 111 VAL MG2 1 112 LYS H 5.110 . 5.110 3.753 3.706 3.804 . 0 0 "[ . 1 . 2]" 1
2238 1 111 VAL MG2 1 114 ILE MD 6.330 . 6.330 2.029 1.911 2.280 . 0 0 "[ . 1 . 2]" 1
2239 1 111 VAL QG 1 112 LYS HA 5.730 . 5.730 2.946 2.905 3.004 . 0 0 "[ . 1 . 2]" 1
2240 1 111 VAL QG 1 112 LYS HG3 6.430 . 6.430 2.826 2.628 2.948 . 0 0 "[ . 1 . 2]" 1
2241 1 111 VAL QG 1 112 LYS HG2 6.900 . 6.900 3.513 3.347 3.782 . 0 0 "[ . 1 . 2]" 1
2242 1 111 VAL QG 1 112 LYS H 5.330 . 5.330 1.901 1.883 1.918 . 0 0 "[ . 1 . 2]" 1
2243 1 111 VAL QG 1 113 LYS H 6.330 . 6.330 3.883 3.861 3.899 . 0 0 "[ . 1 . 2]" 1
2244 1 111 VAL QG 1 114 ILE MD 6.190 . 6.190 2.023 1.908 2.270 . 0 0 "[ . 1 . 2]" 1
2245 1 111 VAL QG 1 114 ILE QG 7.030 . 7.030 3.192 3.076 3.542 . 0 0 "[ . 1 . 2]" 1
2246 1 111 VAL QG 1 117 LYS QD 6.920 . 6.920 2.954 1.878 4.289 . 0 0 "[ . 1 . 2]" 1
2247 1 111 VAL QG 1 117 LYS QE 7.700 . 7.700 3.129 1.895 4.651 . 0 0 "[ . 1 . 2]" 1
2248 1 111 VAL H 1 111 VAL HB 2.880 . 2.880 2.483 2.457 2.502 . 0 0 "[ . 1 . 2]" 1
2249 1 111 VAL H 1 112 LYS HA 5.180 . 5.180 5.184 5.174 5.192 0.012 14 0 "[ . 1 . 2]" 1
2250 1 111 VAL H 1 112 LYS HB2 4.480 . 4.480 4.408 4.370 4.453 . 0 0 "[ . 1 . 2]" 1
2251 1 111 VAL H 1 112 LYS H 3.390 . 3.390 2.561 2.548 2.574 . 0 0 "[ . 1 . 2]" 1
2252 1 111 VAL H 1 113 LYS H 4.360 . 4.360 3.905 3.885 3.925 . 0 0 "[ . 1 . 2]" 1
2253 1 111 VAL H 1 114 ILE H 5.250 . 5.250 4.956 4.891 5.134 . 0 0 "[ . 1 . 2]" 1
2254 1 112 LYS HA 1 112 LYS QE 5.670 . 5.670 4.205 3.434 4.958 . 0 0 "[ . 1 . 2]" 1
2255 1 112 LYS HA 1 112 LYS HG3 3.920 . 3.920 2.980 2.814 3.098 . 0 0 "[ . 1 . 2]" 1
2256 1 112 LYS HA 1 112 LYS HG2 3.460 . 3.460 2.233 2.171 2.385 . 0 0 "[ . 1 . 2]" 1
2257 1 112 LYS HA 1 117 LYS QD 5.650 . 5.650 3.021 1.968 4.486 . 0 0 "[ . 1 . 2]" 1
2258 1 112 LYS HB3 1 112 LYS QD 3.810 . 3.810 2.321 2.103 2.632 . 0 0 "[ . 1 . 2]" 1
2259 1 112 LYS HB3 1 113 LYS H 3.880 . 3.880 3.504 3.433 3.599 . 0 0 "[ . 1 . 2]" 1
2260 1 112 LYS HB2 1 113 LYS H 3.600 . 3.600 3.058 2.983 3.101 . 0 0 "[ . 1 . 2]" 1
2261 1 112 LYS QD 1 113 LYS H 6.380 . 6.380 5.212 5.048 5.487 . 0 0 "[ . 1 . 2]" 1
2262 1 112 LYS HG3 1 113 LYS H 5.490 . 5.490 4.917 4.796 4.974 . 0 0 "[ . 1 . 2]" 1
2263 1 112 LYS H 1 112 LYS HB3 3.510 . 3.510 3.484 3.456 3.512 0.002 7 0 "[ . 1 . 2]" 1
2264 1 112 LYS H 1 112 LYS HB2 2.920 . 2.920 2.176 2.142 2.216 . 0 0 "[ . 1 . 2]" 1
2265 1 112 LYS H 1 112 LYS QE 6.170 . 6.170 4.818 3.794 5.420 . 0 0 "[ . 1 . 2]" 1
2266 1 112 LYS H 1 112 LYS HG3 3.290 . 3.290 2.973 2.806 3.074 . 0 0 "[ . 1 . 2]" 1
2267 1 112 LYS H 1 113 LYS H 3.340 . 3.340 2.631 2.595 2.654 . 0 0 "[ . 1 . 2]" 1
2268 1 112 LYS H 1 114 ILE H 4.390 . 4.390 4.064 4.036 4.103 . 0 0 "[ . 1 . 2]" 1
2269 1 113 LYS HA 1 113 LYS QE 5.700 . 5.700 4.129 2.782 4.959 . 0 0 "[ . 1 . 2]" 1
2270 1 113 LYS QB 1 114 ILE H 4.280 . 4.280 2.993 2.891 3.299 . 0 0 "[ . 1 . 2]" 1
2271 1 113 LYS QB 1 115 PRO HD3 6.220 . 6.220 5.048 4.794 5.185 . 0 0 "[ . 1 . 2]" 1
2272 1 113 LYS QG 1 114 ILE H 5.390 . 5.390 4.295 4.058 4.539 . 0 0 "[ . 1 . 2]" 1
2273 1 113 LYS H 1 113 LYS HB3 3.620 . 3.620 3.572 3.439 3.604 . 0 0 "[ . 1 . 2]" 1
2274 1 113 LYS H 1 113 LYS HB2 3.620 . 3.620 2.376 2.134 2.560 . 0 0 "[ . 1 . 2]" 1
2275 1 113 LYS H 1 113 LYS QB 3.870 . 3.870 2.343 2.115 2.508 . 0 0 "[ . 1 . 2]" 1
2276 1 113 LYS H 1 113 LYS QD 5.750 . 5.750 4.046 3.395 4.521 . 0 0 "[ . 1 . 2]" 1
2277 1 113 LYS H 1 113 LYS QE 5.950 . 5.950 4.791 3.166 5.136 . 0 0 "[ . 1 . 2]" 1
2278 1 113 LYS H 1 113 LYS QG 3.970 . 3.970 2.521 2.226 3.075 . 0 0 "[ . 1 . 2]" 1
2279 1 113 LYS H 1 114 ILE H 3.190 . 3.190 2.514 2.449 2.570 . 0 0 "[ . 1 . 2]" 1
2280 1 114 ILE HA 1 115 PRO HD3 3.720 . 3.720 2.199 1.852 2.379 . 0 0 "[ . 1 . 2]" 1
2281 1 114 ILE HA 1 115 PRO HD2 3.640 . 3.640 2.359 2.184 2.863 . 0 0 "[ . 1 . 2]" 1
2282 1 114 ILE HA 1 115 PRO HG3 4.870 . 4.870 4.337 3.964 4.443 . 0 0 "[ . 1 . 2]" 1
2283 1 114 ILE HA 1 115 PRO HG2 4.870 . 4.870 4.421 4.355 4.474 . 0 0 "[ . 1 . 2]" 1
2284 1 114 ILE HA 1 115 PRO QG 5.140 . 5.140 3.895 3.711 3.935 . 0 0 "[ . 1 . 2]" 1
2285 1 114 ILE HB 1 115 PRO HD3 5.090 . 5.090 4.788 4.336 4.940 . 0 0 "[ . 1 . 2]" 1
2286 1 114 ILE HB 1 115 PRO HD2 5.210 . 5.210 4.042 3.952 4.190 . 0 0 "[ . 1 . 2]" 1
2287 1 114 ILE MD 1 115 PRO HD3 6.520 . 6.520 5.345 4.838 5.470 . 0 0 "[ . 1 . 2]" 1
2288 1 114 ILE MD 1 115 PRO HD2 5.970 . 5.970 4.456 4.310 4.630 . 0 0 "[ . 1 . 2]" 1
2289 1 114 ILE HG13 1 115 PRO HD2 5.500 . 5.500 4.978 4.780 5.343 . 0 0 "[ . 1 . 2]" 1
2290 1 114 ILE HG12 1 115 PRO HD2 5.500 . 5.500 3.937 3.722 4.335 . 0 0 "[ . 1 . 2]" 1
2291 1 114 ILE QG 1 115 PRO HD2 5.640 . 5.640 3.795 3.603 4.158 . 0 0 "[ . 1 . 2]" 1
2292 1 114 ILE MG 1 115 PRO HA 5.830 . 5.830 4.108 4.066 4.156 . 0 0 "[ . 1 . 2]" 1
2293 1 114 ILE MG 1 115 PRO HD3 4.750 . 4.750 3.097 2.513 3.241 . 0 0 "[ . 1 . 2]" 1
2294 1 114 ILE MG 1 115 PRO HD2 5.010 . 5.010 1.877 1.809 1.952 . 0 0 "[ . 1 . 2]" 1
2295 1 114 ILE MG 1 115 PRO QG 6.380 . 6.380 3.171 2.881 3.567 . 0 0 "[ . 1 . 2]" 1
2296 1 114 ILE MG 1 116 LYS HA 6.420 . 6.420 4.110 3.980 4.253 . 0 0 "[ . 1 . 2]" 1
2297 1 114 ILE MG 1 116 LYS QG 6.490 . 6.490 3.886 2.236 4.594 . 0 0 "[ . 1 . 2]" 1
2298 1 114 ILE MG 1 116 LYS H 5.140 . 5.140 2.040 1.957 2.230 . 0 0 "[ . 1 . 2]" 1
2299 1 114 ILE MG 1 117 LYS QB 6.700 . 6.700 3.561 2.912 4.337 . 0 0 "[ . 1 . 2]" 1
2300 1 114 ILE MG 1 117 LYS QG 6.930 . 6.930 4.255 3.533 4.892 . 0 0 "[ . 1 . 2]" 1
2301 1 114 ILE MG 1 117 LYS H 5.660 . 5.660 3.215 2.699 3.766 . 0 0 "[ . 1 . 2]" 1
2302 1 114 ILE H 1 114 ILE MD 5.160 . 5.160 3.564 3.408 3.661 . 0 0 "[ . 1 . 2]" 1
2303 1 114 ILE H 1 114 ILE QG 3.770 . 3.770 1.949 1.923 2.074 . 0 0 "[ . 1 . 2]" 1
2304 1 115 PRO HB2 1 116 LYS H 3.210 . 3.210 3.006 2.192 3.223 0.013 15 0 "[ . 1 . 2]" 1
2305 1 115 PRO HD3 1 116 LYS H 4.160 . 4.160 3.768 3.655 3.936 . 0 0 "[ . 1 . 2]" 1
2306 1 115 PRO HD2 1 116 LYS H 4.510 . 4.510 2.505 2.289 2.814 . 0 0 "[ . 1 . 2]" 1
2307 1 115 PRO HG3 1 116 LYS H 4.240 . 4.240 3.723 3.548 4.285 0.045 20 0 "[ . 1 . 2]" 1
2308 1 115 PRO HG2 1 116 LYS H 4.240 . 4.240 2.280 1.993 3.579 . 0 0 "[ . 1 . 2]" 1
2309 1 115 PRO QG 1 116 LYS QG 6.180 . 6.180 3.021 2.308 4.460 . 0 0 "[ . 1 . 2]" 1
2310 1 115 PRO QG 1 116 LYS H 4.600 . 4.600 2.247 1.983 3.409 . 0 0 "[ . 1 . 2]" 1
2311 1 116 LYS HA 1 116 LYS QD 5.090 . 5.090 3.595 2.226 4.309 . 0 0 "[ . 1 . 2]" 1
2312 1 116 LYS HA 1 117 LYS H 2.850 . 2.850 2.705 2.483 2.851 0.001 3 0 "[ . 1 . 2]" 1
2313 1 116 LYS H 1 116 LYS QB 3.740 . 3.740 2.437 2.131 2.900 . 0 0 "[ . 1 . 2]" 1
2314 1 116 LYS H 1 116 LYS QE 6.230 . 6.230 4.693 3.721 5.474 . 0 0 "[ . 1 . 2]" 1
2315 1 116 LYS H 1 116 LYS QG 3.920 . 3.920 2.691 1.948 3.384 . 0 0 "[ . 1 . 2]" 1
2316 1 116 LYS H 1 117 LYS H 3.380 . 3.380 3.222 2.947 3.395 0.015 15 0 "[ . 1 . 2]" 1
2317 1 117 LYS HA 1 117 LYS QD 4.640 . 4.640 3.838 2.656 4.128 . 0 0 "[ . 1 . 2]" 1
2318 1 117 LYS H 1 117 LYS HB3 2.800 . 2.800 2.638 2.515 2.799 . 0 0 "[ . 1 . 2]" 1
2319 1 117 LYS H 1 117 LYS HB2 2.800 . 2.800 2.419 2.274 2.543 . 0 0 "[ . 1 . 2]" 1
2320 1 117 LYS H 1 117 LYS QB 3.310 . 3.310 2.230 2.180 2.253 . 0 0 "[ . 1 . 2]" 1
2321 1 117 LYS H 1 117 LYS QE 6.290 . 6.290 5.255 4.236 5.656 . 0 0 "[ . 1 . 2]" 1
2322 1 3 LEU QB 1 106 TRP HH2 5.000 . 6.000 4.707 4.526 4.987 . 0 0 "[ . 1 . 2]" 1
2323 1 3 LEU QB 1 106 TRP HZ2 5.000 . 6.000 5.218 5.105 5.327 . 0 0 "[ . 1 . 2]" 1
2324 1 3 LEU QB 1 106 TRP HZ3 5.000 . 6.000 4.421 4.246 4.774 . 0 0 "[ . 1 . 2]" 1
2325 1 3 LEU QD 1 106 TRP HD1 5.000 . 7.400 3.626 3.188 3.901 . 0 0 "[ . 1 . 2]" 1
2326 1 3 LEU QD 1 106 TRP HE3 3.500 . 5.900 2.310 2.216 2.705 . 0 0 "[ . 1 . 2]" 1
2327 1 3 LEU QD 1 106 TRP HH2 5.000 . 7.400 4.352 4.172 4.498 . 0 0 "[ . 1 . 2]" 1
2328 1 3 LEU QD 1 106 TRP HZ2 5.000 . 7.400 4.351 4.047 4.538 . 0 0 "[ . 1 . 2]" 1
2329 1 3 LEU QD 1 106 TRP HZ3 5.000 . 7.400 3.367 3.252 3.535 . 0 0 "[ . 1 . 2]" 1
2330 1 3 LEU HG 1 106 TRP HH2 5.000 . 5.000 4.334 3.961 4.625 . 0 0 "[ . 1 . 2]" 1
2331 1 3 LEU HG 1 106 TRP HZ2 5.000 . 5.000 4.035 3.773 4.240 . 0 0 "[ . 1 . 2]" 1
2332 1 3 LEU HG 1 106 TRP HZ3 5.000 . 5.000 4.211 3.805 4.533 . 0 0 "[ . 1 . 2]" 1
2333 1 4 GLU HA 1 106 TRP HH2 3.500 . 3.500 3.054 2.967 3.101 . 0 0 "[ . 1 . 2]" 1
2334 1 4 GLU HA 1 106 TRP HZ2 3.500 . 3.500 2.799 2.587 2.863 . 0 0 "[ . 1 . 2]" 1
2335 1 4 GLU HA 1 106 TRP HZ3 5.000 . 5.000 5.042 5.032 5.052 0.052 15 0 "[ . 1 . 2]" 1
2336 1 4 GLU QB 1 24 TYR QE 3.500 . 6.500 2.771 1.988 4.097 . 0 0 "[ . 1 . 2]" 1
2337 1 4 GLU QG 1 24 TYR QD 5.000 . 8.000 5.186 4.556 5.979 . 0 0 "[ . 1 . 2]" 1
2338 1 4 GLU QG 1 24 TYR QE 3.500 . 6.500 3.379 2.611 4.619 . 0 0 "[ . 1 . 2]" 1
2339 1 5 GLY HA3 1 24 TYR QE 5.000 . 8.000 4.112 3.805 4.425 . 0 0 "[ . 1 . 2]" 1
2340 1 6 TRP HA 1 24 TYR QD 3.500 . 5.500 3.867 3.053 4.427 . 0 0 "[ . 1 . 2]" 1
2341 1 6 TRP HA 1 6 TRP HD1 5.000 . 5.000 4.017 3.973 4.054 . 0 0 "[ . 1 . 2]" 1
2342 1 6 TRP HA 1 6 TRP HE3 3.500 . 3.500 3.488 3.434 3.513 0.013 14 0 "[ . 1 . 2]" 1
2343 1 6 TRP QB 1 24 TYR QD 5.000 . 8.000 4.754 3.775 5.319 . 0 0 "[ . 1 . 2]" 1
2344 1 6 TRP QB 1 6 TRP HD1 2.900 . 3.900 2.672 2.657 2.682 . 0 0 "[ . 1 . 2]" 1
2345 1 6 TRP QB 1 6 TRP HE3 3.500 . 4.500 2.450 2.427 2.473 . 0 0 "[ . 1 . 2]" 1
2346 1 6 TRP HD1 1 22 LYS QB 5.000 . 6.000 5.176 5.033 5.231 . 0 0 "[ . 1 . 2]" 1
2347 1 6 TRP HD1 1 22 LYS QD 5.000 . 6.000 5.012 4.814 5.212 . 0 0 "[ . 1 . 2]" 1
2348 1 6 TRP HD1 1 22 LYS QG 5.000 . 6.000 5.046 4.879 5.184 . 0 0 "[ . 1 . 2]" 1
2349 1 6 TRP HD1 1 24 TYR HA 5.000 . 5.000 4.987 4.832 5.024 0.024 14 0 "[ . 1 . 2]" 1
2350 1 6 TRP HD1 1 24 TYR QD 3.500 . 5.500 4.637 3.516 5.258 . 0 0 "[ . 1 . 2]" 1
2351 1 6 TRP HD1 1 24 TYR QE 3.500 . 5.500 4.321 2.879 5.063 . 0 0 "[ . 1 . 2]" 1
2352 1 6 TRP HE3 1 22 LYS QB 3.500 . 4.500 3.260 2.300 3.753 . 0 0 "[ . 1 . 2]" 1
2353 1 6 TRP HE3 1 22 LYS QD 5.000 . 6.000 4.635 1.847 5.048 . 0 0 "[ . 1 . 2]" 1
2354 1 6 TRP HE3 1 22 LYS QG 3.500 . 4.500 3.083 2.446 4.113 . 0 0 "[ . 1 . 2]" 1
2355 1 6 TRP HE3 1 23 LYS HA 5.000 . 5.000 2.670 2.292 2.965 . 0 0 "[ . 1 . 2]" 1
2356 1 6 TRP HE3 1 24 TYR HA 5.000 . 5.000 3.578 3.419 3.820 . 0 0 "[ . 1 . 2]" 1
2357 1 6 TRP HE3 1 24 TYR QD 5.000 . 7.000 4.456 3.729 4.921 . 0 0 "[ . 1 . 2]" 1
2358 1 6 TRP HZ2 1 24 TYR QD 5.000 . 7.000 2.937 2.427 3.807 . 0 0 "[ . 1 . 2]" 1
2359 1 6 TRP HZ2 1 24 TYR QE 5.000 . 7.000 3.333 2.829 4.203 . 0 0 "[ . 1 . 2]" 1
2360 1 7 LEU QD 1 106 TRP HD1 5.000 . 7.400 3.289 3.204 3.397 . 0 0 "[ . 1 . 2]" 1
2361 1 7 LEU QD 1 106 TRP HE3 5.000 . 7.400 2.940 2.916 2.974 . 0 0 "[ . 1 . 2]" 1
2362 1 7 LEU QD 1 106 TRP HH2 5.000 . 7.400 3.038 2.977 3.136 . 0 0 "[ . 1 . 2]" 1
2363 1 7 LEU QD 1 106 TRP HZ2 3.500 . 5.900 3.064 3.015 3.131 . 0 0 "[ . 1 . 2]" 1
2364 1 7 LEU QD 1 106 TRP HZ3 5.000 . 7.400 2.997 2.955 3.056 . 0 0 "[ . 1 . 2]" 1
2365 1 7 LEU QD 1 78 PHE QD 5.000 . 9.400 3.927 3.861 4.025 . 0 0 "[ . 1 . 2]" 1
2366 1 7 LEU QD 1 78 PHE QE 3.500 . 7.900 2.280 2.174 2.398 . 0 0 "[ . 1 . 2]" 1
2367 1 7 LEU QD 1 78 PHE HZ 2.900 . 5.300 1.760 1.712 1.816 0.088 13 0 "[ . 1 . 2]" 1
2368 1 8 SER HA 1 20 TRP HE3 5.000 . 5.000 4.325 4.137 4.491 . 0 0 "[ . 1 . 2]" 1
2369 1 8 SER QB 1 20 TRP HD1 5.000 . 6.000 4.808 4.659 4.976 . 0 0 "[ . 1 . 2]" 1
2370 1 8 SER QB 1 20 TRP HE3 3.500 . 4.500 2.608 2.195 3.614 . 0 0 "[ . 1 . 2]" 1
2371 1 9 LEU HA 1 20 TRP HE3 5.000 . 5.000 3.143 3.035 3.334 . 0 0 "[ . 1 . 2]" 1
2372 1 9 LEU HA 1 20 TRP HZ3 3.500 . 3.500 2.992 2.641 3.351 . 0 0 "[ . 1 . 2]" 1
2373 1 9 LEU QB 1 34 PHE QE 3.500 . 6.500 4.432 4.159 4.753 . 0 0 "[ . 1 . 2]" 1
2374 1 17 LYS HA 1 18 PHE QD 5.000 . 7.000 3.572 2.519 4.345 . 0 0 "[ . 1 . 2]" 1
2375 1 17 LYS QB 1 18 PHE QD 3.500 . 6.500 4.859 4.186 5.451 . 0 0 "[ . 1 . 2]" 1
2376 1 18 PHE HA 1 18 PHE QD 3.500 . 5.500 3.344 2.226 3.711 . 0 0 "[ . 1 . 2]" 1
2377 1 18 PHE QB 1 18 PHE QD 2.900 . 5.900 2.130 2.124 2.179 . 0 0 "[ . 1 . 2]" 1
2378 1 19 GLY QA 1 20 TRP HD1 3.500 . 4.500 4.044 3.987 4.089 . 0 0 "[ . 1 . 2]" 1
2379 1 20 TRP HA 1 20 TRP HE3 3.500 . 3.500 2.342 2.259 2.447 . 0 0 "[ . 1 . 2]" 1
2380 1 20 TRP QB 1 20 TRP HD1 2.900 . 3.900 2.512 2.506 2.517 . 0 0 "[ . 1 . 2]" 1
2381 1 20 TRP QB 1 20 TRP HE3 3.500 . 4.500 2.856 2.809 2.895 . 0 0 "[ . 1 . 2]" 1
2382 1 20 TRP HD1 1 96 LEU QD 2.900 . 5.300 2.947 2.700 3.522 . 0 0 "[ . 1 . 2]" 1
2383 1 20 TRP HE3 1 96 LEU QB 5.000 . 6.000 3.329 2.969 3.774 . 0 0 "[ . 1 . 2]" 1
2384 1 20 TRP HE3 1 96 LEU QD 3.500 . 5.900 3.527 3.171 4.126 . 0 0 "[ . 1 . 2]" 1
2385 1 20 TRP HZ2 1 69 ALA MB 3.500 . 5.000 2.487 2.040 2.890 . 0 0 "[ . 1 . 2]" 1
2386 1 20 TRP HZ2 1 73 GLU QB 5.000 . 6.000 4.323 3.955 4.795 . 0 0 "[ . 1 . 2]" 1
2387 1 20 TRP HZ2 1 96 LEU QD 3.500 . 5.900 3.661 3.297 4.004 . 0 0 "[ . 1 . 2]" 1
2388 1 20 TRP HZ3 1 95 LEU HA 5.000 . 5.000 4.782 4.531 5.003 0.003 18 0 "[ . 1 . 2]" 1
2389 1 22 LYS QE 1 24 TYR QD 5.000 . 8.000 5.615 4.716 6.162 . 0 0 "[ . 1 . 2]" 1
2390 1 22 LYS QE 1 24 TYR QE 5.000 . 8.000 6.230 5.487 6.607 . 0 0 "[ . 1 . 2]" 1
2391 1 24 TYR HA 1 24 TYR QD 3.500 . 5.500 2.308 1.929 2.624 . 0 0 "[ . 1 . 2]" 1
2392 1 24 TYR HA 1 24 TYR QE 5.000 . 7.000 4.218 4.081 4.311 . 0 0 "[ . 1 . 2]" 1
2393 1 24 TYR QB 1 24 TYR QD 2.900 . 5.900 2.203 2.184 2.225 . 0 0 "[ . 1 . 2]" 1
2394 1 24 TYR QB 1 35 TYR QD 3.500 . 6.500 3.505 3.024 4.072 . 0 0 "[ . 1 . 2]" 1
2395 1 24 TYR QD 1 26 ILE HB 5.000 . 7.000 5.223 4.915 5.633 . 0 0 "[ . 1 . 2]" 1
2396 1 24 TYR QD 1 26 ILE MD 3.500 . 7.000 2.897 2.150 3.429 . 0 0 "[ . 1 . 2]" 1
2397 1 24 TYR QD 1 26 ILE HG13 5.000 . 8.000 3.035 2.513 3.674 . 0 0 "[ . 1 . 2]" 1
2398 1 24 TYR QD 1 35 TYR QB 5.000 . 8.000 3.649 2.639 4.179 . 0 0 "[ . 1 . 2]" 1
2399 1 24 TYR QD 1 35 TYR QD 3.500 . 7.500 4.166 3.521 5.087 . 0 0 "[ . 1 . 2]" 1
2400 1 24 TYR QD 1 35 TYR QE 5.000 . 9.000 5.646 4.918 6.663 . 0 0 "[ . 1 . 2]" 1
2401 1 24 TYR QD 1 38 GLU HA 5.000 . 7.000 3.807 2.805 4.793 . 0 0 "[ . 1 . 2]" 1
2402 1 24 TYR QE 1 26 ILE HB 5.000 . 7.000 5.490 5.127 5.906 . 0 0 "[ . 1 . 2]" 1
2403 1 24 TYR QE 1 26 ILE MD 2.900 . 6.400 2.630 2.071 3.096 . 0 0 "[ . 1 . 2]" 1
2404 1 24 TYR QE 1 26 ILE HG13 3.500 . 6.500 3.945 3.459 4.470 . 0 0 "[ . 1 . 2]" 1
2405 1 24 TYR QE 1 26 ILE MG 2.900 . 6.400 3.962 3.599 4.541 . 0 0 "[ . 1 . 2]" 1
2406 1 24 TYR QE 1 35 TYR QD 5.000 . 9.000 5.681 5.127 6.423 . 0 0 "[ . 1 . 2]" 1
2407 1 24 TYR QE 1 38 GLU HA 5.000 . 7.000 4.337 3.390 5.356 . 0 0 "[ . 1 . 2]" 1
2408 1 25 VAL HB 1 106 TRP HH2 3.500 . 3.500 2.016 1.980 2.052 . 0 0 "[ . 1 . 2]" 1
2409 1 25 VAL HB 1 106 TRP HZ2 3.500 . 3.500 3.083 3.022 3.139 . 0 0 "[ . 1 . 2]" 1
2410 1 25 VAL HB 1 106 TRP HZ3 3.500 . 3.500 3.527 3.511 3.545 0.045 14 0 "[ . 1 . 2]" 1
2411 1 25 VAL HB 1 34 PHE QE 5.000 . 7.000 4.589 4.198 4.950 . 0 0 "[ . 1 . 2]" 1
2412 1 25 VAL QG 1 106 TRP HE3 5.000 . 7.400 4.020 3.898 4.136 . 0 0 "[ . 1 . 2]" 1
2413 1 25 VAL QG 1 106 TRP HH2 2.900 . 5.300 2.105 1.958 2.290 . 0 0 "[ . 1 . 2]" 1
2414 1 25 VAL QG 1 106 TRP HZ2 3.500 . 5.900 3.764 3.733 3.819 . 0 0 "[ . 1 . 2]" 1
2415 1 25 VAL QG 1 106 TRP HZ3 3.500 . 5.900 2.218 1.978 2.416 . 0 0 "[ . 1 . 2]" 1
2416 1 25 VAL QG 1 34 PHE QD 5.000 . 9.400 2.467 1.967 2.874 . 0 0 "[ . 1 . 2]" 1
2417 1 25 VAL QG 1 34 PHE QE 5.000 . 9.400 2.083 1.872 2.454 . 0 0 "[ . 1 . 2]" 1
2418 1 25 VAL QG 1 34 PHE HZ 5.000 . 7.400 2.535 2.139 3.709 . 0 0 "[ . 1 . 2]" 1
2419 1 26 ILE MD 1 35 TYR QD 3.500 . 7.000 3.118 2.593 3.566 . 0 0 "[ . 1 . 2]" 1
2420 1 26 ILE MD 1 35 TYR QE 2.900 . 6.400 3.130 2.559 4.109 . 0 0 "[ . 1 . 2]" 1
2421 1 26 ILE HG13 1 35 TYR QE 5.000 . 8.000 3.750 3.029 5.018 . 0 0 "[ . 1 . 2]" 1
2422 1 33 LEU QB 1 35 TYR QE 3.500 . 6.500 1.925 1.832 2.185 . 0 0 "[ . 1 . 2]" 1
2423 1 33 LEU QD 1 35 TYR QE 3.500 . 7.900 2.644 1.993 3.406 . 0 0 "[ . 1 . 2]" 1
2424 1 34 PHE HA 1 34 PHE QD 3.500 . 5.500 2.858 1.983 3.014 . 0 0 "[ . 1 . 2]" 1
2425 1 34 PHE HA 1 35 TYR QD 3.500 . 5.500 3.418 3.061 3.625 . 0 0 "[ . 1 . 2]" 1
2426 1 34 PHE HA 1 47 TYR QD 5.000 . 7.000 5.799 5.539 6.068 . 0 0 "[ . 1 . 2]" 1
2427 1 34 PHE QB 1 34 PHE QD 2.900 . 5.900 2.135 2.122 2.262 . 0 0 "[ . 1 . 2]" 1
2428 1 34 PHE QD 1 48 MET ME 3.500 . 7.000 2.864 1.825 3.450 . 0 0 "[ . 1 . 2]" 1
2429 1 34 PHE QD 1 49 VAL HA 5.000 . 7.000 4.912 3.846 5.916 . 0 0 "[ . 1 . 2]" 1
2430 1 34 PHE QE 1 48 MET ME 3.500 . 7.000 3.623 2.652 4.288 . 0 0 "[ . 1 . 2]" 1
2431 1 35 TYR HA 1 35 TYR QD 3.500 . 5.500 3.043 2.926 3.161 . 0 0 "[ . 1 . 2]" 1
2432 1 35 TYR HA 1 35 TYR QE 5.000 . 7.000 4.716 4.622 4.850 . 0 0 "[ . 1 . 2]" 1
2433 1 35 TYR HA 1 47 TYR QD 3.500 . 5.500 4.600 4.417 4.844 . 0 0 "[ . 1 . 2]" 1
2434 1 35 TYR QD 1 41 LYS HA 3.500 . 5.500 2.599 2.334 2.786 . 0 0 "[ . 1 . 2]" 1
2435 1 35 TYR QE 1 41 LYS HA 3.500 . 5.500 2.578 2.199 3.090 . 0 0 "[ . 1 . 2]" 1
2436 1 35 TYR QE 1 45 ASN HA 5.000 . 7.000 4.447 3.871 4.857 . 0 0 "[ . 1 . 2]" 1
2437 1 35 TYR QE 1 46 PRO QD 5.000 . 8.000 3.089 2.853 3.416 . 0 0 "[ . 1 . 2]" 1
2438 1 47 TYR QB 1 47 TYR QD 2.900 . 5.900 2.140 2.135 2.168 . 0 0 "[ . 1 . 2]" 1
2439 1 47 TYR QD 1 48 MET QB 3.500 . 6.500 2.439 1.971 3.332 . 0 0 "[ . 1 . 2]" 1
2440 1 47 TYR QD 1 48 MET QG 3.500 . 6.500 4.267 3.577 5.135 . 0 0 "[ . 1 . 2]" 1
2441 1 47 TYR QE 1 48 MET QG 5.000 . 8.000 4.778 4.058 5.594 . 0 0 "[ . 1 . 2]" 1
2442 1 50 LEU QD 1 82 TYR QD 3.500 . 7.900 2.618 2.238 3.018 . 0 0 "[ . 1 . 2]" 1
2443 1 50 LEU QD 1 82 TYR QE 3.500 . 7.900 2.330 2.019 2.592 . 0 0 "[ . 1 . 2]" 1
2444 1 55 LEU HA 1 56 PHE QD 5.000 . 7.000 4.560 2.984 4.912 . 0 0 "[ . 1 . 2]" 1
2445 1 55 LEU HA 1 82 TYR QD 5.000 . 7.000 4.266 3.858 4.438 . 0 0 "[ . 1 . 2]" 1
2446 1 56 PHE HA 1 56 PHE QD 3.500 . 5.500 2.194 1.964 2.973 . 0 0 "[ . 1 . 2]" 1
2447 1 56 PHE QB 1 56 PHE QD 2.900 . 5.900 2.153 2.129 2.178 . 0 0 "[ . 1 . 2]" 1
2448 1 56 PHE QD 1 81 LEU QB 3.500 . 6.500 4.023 3.797 4.339 . 0 0 "[ . 1 . 2]" 1
2449 1 56 PHE QD 1 82 TYR HA 5.000 . 7.000 3.256 2.126 3.811 . 0 0 "[ . 1 . 2]" 1
2450 1 56 PHE QD 1 83 ALA HA 5.000 . 7.000 3.762 3.430 4.576 . 0 0 "[ . 1 . 2]" 1
2451 1 56 PHE QD 1 83 ALA MB 3.500 . 7.000 3.602 3.297 3.774 . 0 0 "[ . 1 . 2]" 1
2452 1 56 PHE QD 1 90 ALA MB 3.500 . 7.000 2.275 2.022 3.547 . 0 0 "[ . 1 . 2]" 1
2453 1 56 PHE QE 1 81 LEU HG 3.500 . 5.500 4.490 4.315 5.142 . 0 0 "[ . 1 . 2]" 1
2454 1 56 PHE QE 1 83 ALA HA 3.500 . 5.500 2.527 2.067 3.428 . 0 0 "[ . 1 . 2]" 1
2455 1 56 PHE QE 1 83 ALA MB 2.900 . 6.400 1.991 1.882 2.241 . 0 0 "[ . 1 . 2]" 1
2456 1 56 PHE QE 1 90 ALA HA 5.000 . 7.000 4.121 3.743 5.381 . 0 0 "[ . 1 . 2]" 1
2457 1 56 PHE QE 1 90 ALA MB 2.900 . 6.400 1.968 1.817 3.349 . 0 0 "[ . 1 . 2]" 1
2458 1 66 VAL HA 1 67 TYR QD 5.000 . 7.000 3.049 2.499 3.867 . 0 0 "[ . 1 . 2]" 1
2459 1 66 VAL MG1 1 67 TYR QD 3.500 . 7.900 4.263 3.963 4.610 . 0 0 "[ . 1 . 2]" 1
2460 1 67 TYR HA 1 67 TYR QD 2.900 . 4.900 3.669 3.361 3.743 . 0 0 "[ . 1 . 2]" 1
2461 1 67 TYR HA 1 67 TYR QE 5.000 . 7.000 5.597 5.196 5.660 . 0 0 "[ . 1 . 2]" 1
2462 1 67 TYR QB 1 67 TYR QD 2.900 . 5.900 2.137 2.135 2.141 . 0 0 "[ . 1 . 2]" 1
2463 1 67 TYR QD 1 68 ARG HA 5.000 . 7.000 3.550 3.083 5.069 . 0 0 "[ . 1 . 2]" 1
2464 1 67 TYR QD 1 68 ARG HB3 5.000 . 8.000 3.219 2.608 4.454 . 0 0 "[ . 1 . 2]" 1
2465 1 67 TYR QD 1 68 ARG QG 5.000 . 8.000 4.053 2.830 4.616 . 0 0 "[ . 1 . 2]" 1
2466 1 67 TYR QD 1 69 ALA MB 5.000 . 8.500 5.400 4.933 5.562 . 0 0 "[ . 1 . 2]" 1
2467 1 67 TYR QE 1 69 ALA MB 5.000 . 8.500 6.235 6.043 6.418 . 0 0 "[ . 1 . 2]" 1
2468 1 77 ILE HA 1 78 PHE QD 5.000 . 7.000 3.095 2.812 3.352 . 0 0 "[ . 1 . 2]" 1
2469 1 78 PHE HA 1 78 PHE QD 3.500 . 5.500 3.663 3.625 3.707 . 0 0 "[ . 1 . 2]" 1
2470 1 78 PHE QB 1 78 PHE QD 2.900 . 5.900 2.126 2.124 2.130 . 0 0 "[ . 1 . 2]" 1
2471 1 78 PHE QD 1 103 GLN HA 3.500 . 5.500 3.008 2.748 3.366 . 0 0 "[ . 1 . 2]" 1
2472 1 78 PHE QD 1 103 GLN HG2 3.500 . 6.500 2.410 2.209 2.719 . 0 0 "[ . 1 . 2]" 1
2473 1 78 PHE QD 1 106 TRP HD1 5.000 . 7.000 6.391 6.298 6.467 . 0 0 "[ . 1 . 2]" 1
2474 1 78 PHE QD 1 107 VAL MG2 2.900 . 7.300 2.361 2.158 2.615 . 0 0 "[ . 1 . 2]" 1
2475 1 78 PHE QD 1 95 LEU QB 5.000 . 8.000 3.556 3.456 3.615 . 0 0 "[ . 1 . 2]" 1
2476 1 78 PHE QE 1 103 GLN HB3 5.000 . 8.000 4.957 4.771 5.214 . 0 0 "[ . 1 . 2]" 1
2477 1 78 PHE QE 1 103 GLN HG2 5.000 . 8.000 3.999 3.692 4.227 . 0 0 "[ . 1 . 2]" 1
2478 1 78 PHE QE 1 106 TRP HD1 5.000 . 7.000 4.716 4.541 4.890 . 0 0 "[ . 1 . 2]" 1
2479 1 78 PHE QE 1 106 TRP HE3 3.500 . 5.500 3.055 2.839 3.287 . 0 0 "[ . 1 . 2]" 1
2480 1 78 PHE QE 1 107 VAL MG2 5.000 . 9.400 3.409 3.314 3.503 . 0 0 "[ . 1 . 2]" 1
2481 1 78 PHE QE 1 110 LEU MD2 3.500 . 7.900 2.549 2.337 2.881 . 0 0 "[ . 1 . 2]" 1
2482 1 78 PHE QE 1 95 LEU HB3 5.000 . 8.000 3.636 3.533 3.717 . 0 0 "[ . 1 . 2]" 1
2483 1 78 PHE QE 1 95 LEU QD 2.900 . 7.300 2.375 2.172 2.700 . 0 0 "[ . 1 . 2]" 1
2484 1 78 PHE QE 1 97 ALA MB 3.500 . 7.000 2.465 2.308 2.660 . 0 0 "[ . 1 . 2]" 1
2485 1 78 PHE HZ 1 106 TRP HE3 3.500 . 3.500 3.508 3.504 3.513 0.013 5 0 "[ . 1 . 2]" 1
2486 1 78 PHE HZ 1 110 LEU MD2 3.500 . 5.900 4.114 3.921 4.276 . 0 0 "[ . 1 . 2]" 1
2487 1 78 PHE HZ 1 95 LEU HB3 5.000 . 6.000 3.232 3.113 3.354 . 0 0 "[ . 1 . 2]" 1
2488 1 78 PHE HZ 1 95 LEU QD 3.500 . 5.900 2.742 2.527 2.861 . 0 0 "[ . 1 . 2]" 1
2489 1 80 ILE HB 1 82 TYR QD 5.000 . 7.000 3.659 3.429 3.825 . 0 0 "[ . 1 . 2]" 1
2490 1 80 ILE HB 1 82 TYR QE 3.500 . 5.500 3.723 3.586 3.825 . 0 0 "[ . 1 . 2]" 1
2491 1 80 ILE MG 1 82 TYR QD 2.900 . 6.400 2.809 2.295 3.306 . 0 0 "[ . 1 . 2]" 1
2492 1 80 ILE MG 1 82 TYR QE 3.500 . 7.000 4.045 3.449 4.561 . 0 0 "[ . 1 . 2]" 1
2493 1 81 LEU HA 1 82 TYR QD 5.000 . 7.000 3.184 2.734 4.258 . 0 0 "[ . 1 . 2]" 1
2494 1 82 TYR HA 1 82 TYR QD 3.500 . 5.500 3.636 3.581 3.716 . 0 0 "[ . 1 . 2]" 1
2495 1 82 TYR HA 1 82 TYR QE 5.000 . 7.000 5.601 5.573 5.627 . 0 0 "[ . 1 . 2]" 1
2496 1 82 TYR QB 1 82 TYR QD 2.900 . 5.900 2.139 2.136 2.148 . 0 0 "[ . 1 . 2]" 1
2497 1 82 TYR QD 1 92 ASN HA 5.000 . 7.000 3.282 2.913 4.251 . 0 0 "[ . 1 . 2]" 1
2498 1 82 TYR QD 1 93 LEU QB 3.500 . 6.500 3.692 3.452 3.953 . 0 0 "[ . 1 . 2]" 1
2499 1 82 TYR QE 1 93 LEU QB 2.900 . 5.900 1.927 1.877 1.974 . 0 0 "[ . 1 . 2]" 1
2500 1 82 TYR QE 1 93 LEU QD 2.900 . 7.300 2.617 1.910 3.229 . 0 0 "[ . 1 . 2]" 1
2501 1 82 TYR QE 1 93 LEU HG 2.900 . 4.900 3.676 3.256 4.211 . 0 0 "[ . 1 . 2]" 1
2502 1 95 LEU QD 1 106 TRP HZ2 5.000 . 7.400 5.219 5.166 5.270 . 0 0 "[ . 1 . 2]" 1
2503 1 97 ALA MB 1 106 TRP HD1 5.000 . 6.500 4.090 3.966 4.217 . 0 0 "[ . 1 . 2]" 1
2504 1 102 GLU HA 1 106 TRP HD1 3.500 . 3.500 3.505 3.449 3.516 0.016 1 0 "[ . 1 . 2]" 1
2505 1 102 GLU QB 1 106 TRP HD1 5.000 . 6.000 3.594 3.183 3.982 . 0 0 "[ . 1 . 2]" 1
2506 1 106 TRP HA 1 106 TRP HD1 3.500 . 3.500 3.606 3.591 3.626 0.126 10 0 "[ . 1 . 2]" 1
2507 1 106 TRP HA 1 106 TRP HE3 3.500 . 3.500 3.526 3.505 3.545 0.045 14 0 "[ . 1 . 2]" 1
2508 1 106 TRP QB 1 106 TRP HD1 2.900 . 3.900 2.605 2.586 2.622 . 0 0 "[ . 1 . 2]" 1
2509 1 106 TRP QB 1 106 TRP HE3 3.500 . 4.500 2.541 2.517 2.573 . 0 0 "[ . 1 . 2]" 1
2510 1 106 TRP HE3 1 110 LEU MD2 2.900 . 5.300 2.381 2.150 2.634 . 0 0 "[ . 1 . 2]" 1
2511 1 106 TRP HE3 1 110 LEU HG 5.000 . 5.000 4.861 4.660 5.018 0.018 6 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 56
_Distance_constraint_stats_list.Viol_count 197
_Distance_constraint_stats_list.Viol_total 50.659
_Distance_constraint_stats_list.Viol_max 0.060
_Distance_constraint_stats_list.Viol_rms 0.0068
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0023
_Distance_constraint_stats_list.Viol_average_violations_only 0.0129
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 LEU 0.455 0.047 15 0 "[ . 1 . 2]"
1 5 GLY 0.012 0.007 14 0 "[ . 1 . 2]"
1 7 LEU 0.635 0.060 17 0 "[ . 1 . 2]"
1 23 LYS 0.635 0.060 17 0 "[ . 1 . 2]"
1 25 VAL 0.012 0.007 14 0 "[ . 1 . 2]"
1 26 ILE 0.026 0.007 15 0 "[ . 1 . 2]"
1 27 VAL 0.455 0.047 15 0 "[ . 1 . 2]"
1 32 ILE 0.186 0.019 5 0 "[ . 1 . 2]"
1 33 LEU 0.026 0.007 15 0 "[ . 1 . 2]"
1 34 PHE 0.188 0.033 18 0 "[ . 1 . 2]"
1 38 GLU 0.020 0.007 16 0 "[ . 1 . 2]"
1 42 GLU 0.020 0.007 16 0 "[ . 1 . 2]"
1 48 MET 0.188 0.033 18 0 "[ . 1 . 2]"
1 50 LEU 0.186 0.019 5 0 "[ . 1 . 2]"
1 57 HIS 0.026 0.007 15 0 "[ . 1 . 2]"
1 59 ARG 0.266 0.026 2 0 "[ . 1 . 2]"
1 78 PHE 0.056 0.011 9 0 "[ . 1 . 2]"
1 79 GLN 0.266 0.026 2 0 "[ . 1 . 2]"
1 80 ILE 0.031 0.013 4 0 "[ . 1 . 2]"
1 81 LEU 0.026 0.007 15 0 "[ . 1 . 2]"
1 93 LEU 0.031 0.013 4 0 "[ . 1 . 2]"
1 95 LEU 0.056 0.011 9 0 "[ . 1 . 2]"
1 101 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 GLU 0.056 0.012 16 0 "[ . 1 . 2]"
1 103 GLN 0.009 0.007 14 0 "[ . 1 . 2]"
1 104 GLN 0.029 0.008 17 0 "[ . 1 . 2]"
1 105 LYS 0.105 0.018 14 0 "[ . 1 . 2]"
1 106 TRP 0.061 0.012 16 0 "[ . 1 . 2]"
1 107 VAL 0.014 0.007 14 0 "[ . 1 . 2]"
1 108 SER 0.039 0.009 8 0 "[ . 1 . 2]"
1 109 ARG 0.519 0.031 11 0 "[ . 1 . 2]"
1 110 LEU 0.005 0.003 17 0 "[ . 1 . 2]"
1 111 VAL 0.005 0.005 18 0 "[ . 1 . 2]"
1 112 LYS 0.011 0.009 8 0 "[ . 1 . 2]"
1 113 LYS 0.414 0.031 11 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 1 101 GLU O 1 105 LYS N 3.300 2.200 3.300 3.031 2.935 3.114 . 0 0 "[ . 1 . 2]" 2
2 1 101 GLU O 1 105 LYS H 2.200 . 2.200 2.119 2.056 2.190 . 0 0 "[ . 1 . 2]" 2
3 1 102 GLU O 1 106 TRP N 3.300 2.200 3.300 2.792 2.755 2.939 . 0 0 "[ . 1 . 2]" 2
4 1 102 GLU O 1 106 TRP H 2.200 . 2.200 1.825 1.788 1.994 0.012 16 0 "[ . 1 . 2]" 2
5 1 103 GLN O 1 107 VAL N 3.300 2.200 3.300 3.054 2.906 3.130 . 0 0 "[ . 1 . 2]" 2
6 1 103 GLN O 1 107 VAL H 2.200 . 2.200 2.120 1.946 2.207 0.007 14 0 "[ . 1 . 2]" 2
7 1 104 GLN O 1 108 SER N 3.300 2.200 3.300 3.044 2.875 3.111 . 0 0 "[ . 1 . 2]" 2
8 1 104 GLN O 1 108 SER H 2.200 . 2.200 2.157 1.992 2.208 0.008 17 0 "[ . 1 . 2]" 2
9 1 105 LYS O 1 109 ARG N 3.300 2.200 3.300 2.691 2.668 2.735 . 0 0 "[ . 1 . 2]" 2
10 1 105 LYS O 1 109 ARG H 2.200 . 2.200 1.799 1.782 1.848 0.018 14 0 "[ . 1 . 2]" 2
11 1 106 TRP O 1 110 LEU N 3.300 2.200 3.300 2.798 2.719 2.884 . 0 0 "[ . 1 . 2]" 2
12 1 106 TRP O 1 110 LEU H 2.200 . 2.200 1.861 1.797 1.958 0.003 17 0 "[ . 1 . 2]" 2
13 1 107 VAL O 1 111 VAL N 3.300 2.200 3.300 2.820 2.698 2.922 . 0 0 "[ . 1 . 2]" 2
14 1 107 VAL O 1 111 VAL H 2.200 . 2.200 1.936 1.795 2.044 0.005 18 0 "[ . 1 . 2]" 2
15 1 108 SER O 1 112 LYS N 3.300 2.200 3.300 3.018 2.983 3.066 . 0 0 "[ . 1 . 2]" 2
16 1 108 SER O 1 112 LYS H 2.200 . 2.200 2.161 2.119 2.209 0.009 8 0 "[ . 1 . 2]" 2
17 1 109 ARG O 1 113 LYS N 3.300 2.200 3.300 3.039 3.008 3.065 . 0 0 "[ . 1 . 2]" 2
18 1 109 ARG O 1 113 LYS H 2.200 . 2.200 2.221 2.209 2.231 0.031 11 0 "[ . 1 . 2]" 2
19 1 38 GLU O 1 42 GLU N 3.300 2.200 3.300 3.043 2.819 3.179 . 0 0 "[ . 1 . 2]" 2
20 1 38 GLU O 1 42 GLU H 2.200 . 2.200 2.082 1.845 2.207 0.007 16 0 "[ . 1 . 2]" 2
21 1 3 LEU O 1 27 VAL H 2.200 . 2.200 1.800 1.753 2.224 0.047 15 0 "[ . 1 . 2]" 2
22 1 3 LEU O 1 27 VAL N 3.300 2.200 3.300 2.708 2.621 3.155 . 0 0 "[ . 1 . 2]" 2
23 1 5 GLY O 1 25 VAL H 2.200 . 2.200 1.932 1.800 2.050 . 0 0 "[ . 1 . 2]" 2
24 1 5 GLY O 1 25 VAL N 3.300 2.200 3.300 2.757 2.653 2.871 . 0 0 "[ . 1 . 2]" 2
25 1 5 GLY H 1 25 VAL O 2.200 . 2.200 2.151 2.076 2.207 0.007 14 0 "[ . 1 . 2]" 2
26 1 5 GLY N 1 25 VAL O 3.300 2.200 3.300 2.910 2.843 2.963 . 0 0 "[ . 1 . 2]" 2
27 1 7 LEU O 1 23 LYS H 2.200 . 2.200 1.768 1.740 1.795 0.060 17 0 "[ . 1 . 2]" 2
28 1 7 LEU O 1 23 LYS N 3.300 2.200 3.300 2.678 2.635 2.754 . 0 0 "[ . 1 . 2]" 2
29 1 7 LEU H 1 23 LYS O 2.200 . 2.200 2.071 2.007 2.125 . 0 0 "[ . 1 . 2]" 2
30 1 7 LEU N 1 23 LYS O 3.300 2.200 3.300 3.020 2.947 3.087 . 0 0 "[ . 1 . 2]" 2
31 1 26 ILE O 1 33 LEU H 2.200 . 2.200 1.912 1.793 2.171 0.007 15 0 "[ . 1 . 2]" 2
32 1 26 ILE O 1 33 LEU N 3.300 2.200 3.300 2.807 2.668 3.095 . 0 0 "[ . 1 . 2]" 2
33 1 26 ILE H 1 33 LEU O 2.200 . 2.200 2.029 1.890 2.201 0.001 7 0 "[ . 1 . 2]" 2
34 1 26 ILE N 1 33 LEU O 3.300 2.200 3.300 2.985 2.867 3.146 . 0 0 "[ . 1 . 2]" 2
35 1 32 ILE O 1 50 LEU H 2.200 . 2.200 1.896 1.781 2.158 0.019 5 0 "[ . 1 . 2]" 2
36 1 32 ILE O 1 50 LEU N 3.300 2.200 3.300 2.751 2.582 2.943 . 0 0 "[ . 1 . 2]" 2
37 1 32 ILE H 1 50 LEU O 2.200 . 2.200 1.795 1.782 1.834 0.018 8 0 "[ . 1 . 2]" 2
38 1 32 ILE N 1 50 LEU O 3.300 2.200 3.300 2.673 2.594 2.770 . 0 0 "[ . 1 . 2]" 2
39 1 34 PHE O 1 48 MET H 2.200 . 2.200 2.208 2.185 2.233 0.033 18 0 "[ . 1 . 2]" 2
40 1 34 PHE O 1 48 MET N 3.300 2.200 3.300 3.121 3.052 3.147 . 0 0 "[ . 1 . 2]" 2
41 1 34 PHE H 1 48 MET O 2.200 . 2.200 1.992 1.797 2.200 0.003 7 0 "[ . 1 . 2]" 2
42 1 34 PHE N 1 48 MET O 3.300 2.200 3.300 2.593 2.528 2.772 . 0 0 "[ . 1 . 2]" 2
43 1 57 HIS O 1 81 LEU H 2.200 . 2.200 2.086 1.800 2.207 0.007 15 0 "[ . 1 . 2]" 2
44 1 57 HIS O 1 81 LEU N 3.300 2.200 3.300 3.049 2.758 3.173 . 0 0 "[ . 1 . 2]" 2
45 1 59 ARG O 1 79 GLN H 2.200 . 2.200 2.002 1.899 2.118 . 0 0 "[ . 1 . 2]" 2
46 1 59 ARG O 1 79 GLN N 3.300 2.200 3.300 2.956 2.845 3.076 . 0 0 "[ . 1 . 2]" 2
47 1 59 ARG H 1 79 GLN O 2.200 . 2.200 2.213 2.190 2.226 0.026 2 0 "[ . 1 . 2]" 2
48 1 59 ARG N 1 79 GLN O 3.300 2.200 3.300 3.092 2.940 3.176 . 0 0 "[ . 1 . 2]" 2
49 1 80 ILE O 1 93 LEU H 2.200 . 2.200 2.020 1.911 2.135 . 0 0 "[ . 1 . 2]" 2
50 1 80 ILE O 1 93 LEU N 3.300 2.200 3.300 2.812 2.672 2.907 . 0 0 "[ . 1 . 2]" 2
51 1 80 ILE H 1 93 LEU O 2.200 . 2.200 2.161 2.013 2.213 0.013 4 0 "[ . 1 . 2]" 2
52 1 80 ILE N 1 93 LEU O 3.300 2.200 3.300 3.031 2.887 3.095 . 0 0 "[ . 1 . 2]" 2
53 1 78 PHE O 1 95 LEU H 2.200 . 2.200 2.061 1.909 2.169 . 0 0 "[ . 1 . 2]" 2
54 1 78 PHE O 1 95 LEU N 3.300 2.200 3.300 3.031 2.886 3.122 . 0 0 "[ . 1 . 2]" 2
55 1 78 PHE H 1 95 LEU O 2.200 . 2.200 2.172 2.014 2.211 0.011 9 0 "[ . 1 . 2]" 2
56 1 78 PHE N 1 95 LEU O 3.300 2.200 3.300 3.130 2.985 3.171 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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