Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
583945 | 2mhc RC | 19625 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mhc
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 1882
_Distance_constraint_stats_list.Viol_count 3730
_Distance_constraint_stats_list.Viol_total 2746.926
_Distance_constraint_stats_list.Viol_max 0.296
_Distance_constraint_stats_list.Viol_rms 0.0382
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0146
_Distance_constraint_stats_list.Viol_average_violations_only 0.0736
_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 2 SER 0.050 0.050 3 0 "[ . 1]"
1 3 ARG 0.540 0.106 8 0 "[ . 1]"
1 4 THR 1.157 0.197 7 0 "[ . 1]"
1 5 SER 1.737 0.146 5 0 "[ . 1]"
1 6 ARG 4.029 0.200 4 0 "[ . 1]"
1 7 ILE 9.289 0.266 1 0 "[ . 1]"
1 8 THR 2.367 0.119 10 0 "[ . 1]"
1 9 ALA 5.158 0.276 8 0 "[ . 1]"
1 10 LEU 9.476 0.273 9 0 "[ . 1]"
1 11 TYR 5.759 0.261 6 0 "[ . 1]"
1 12 GLU 1.965 0.166 1 0 "[ . 1]"
1 13 ARG 7.185 0.262 8 0 "[ . 1]"
1 14 LEU 6.193 0.238 5 0 "[ . 1]"
1 15 SER 1.718 0.184 1 0 "[ . 1]"
1 16 ARG 0.721 0.090 10 0 "[ . 1]"
1 17 ASP 1.853 0.296 7 0 "[ . 1]"
1 18 ASP 4.638 0.241 5 0 "[ . 1]"
1 19 ASP 1.915 0.134 8 0 "[ . 1]"
1 20 LEU 3.762 0.296 7 0 "[ . 1]"
1 21 THR 1.297 0.227 7 0 "[ . 1]"
1 22 GLY 0.334 0.170 7 0 "[ . 1]"
1 23 GLU 1.718 0.160 8 0 "[ . 1]"
1 24 SER 0.105 0.026 1 0 "[ . 1]"
1 25 ASN 1.553 0.170 7 0 "[ . 1]"
1 26 SER 2.364 0.238 5 0 "[ . 1]"
1 27 ILE 4.720 0.262 8 0 "[ . 1]"
1 28 THR 3.352 0.209 3 0 "[ . 1]"
1 29 ASN 1.520 0.144 6 0 "[ . 1]"
1 30 GLN 4.679 0.216 1 0 "[ . 1]"
1 31 LYS 5.724 0.175 5 0 "[ . 1]"
1 32 LYS 2.000 0.136 3 0 "[ . 1]"
1 33 TYR 7.447 0.271 6 0 "[ . 1]"
1 34 LEU 9.754 0.273 9 0 "[ . 1]"
1 35 GLU 3.232 0.187 8 0 "[ . 1]"
1 36 ASP 1.334 0.112 8 0 "[ . 1]"
1 37 TYR 11.036 0.221 8 0 "[ . 1]"
1 38 ALA 7.992 0.206 7 0 "[ . 1]"
1 39 ARG 5.053 0.176 10 0 "[ . 1]"
1 40 ARG 2.250 0.221 8 0 "[ . 1]"
1 41 ASN 4.520 0.150 8 0 "[ . 1]"
1 42 GLY 1.221 0.120 6 0 "[ . 1]"
1 43 PHE 5.261 0.206 7 0 "[ . 1]"
1 44 GLU 9.834 0.217 4 0 "[ . 1]"
1 45 ASN 8.818 0.234 5 0 "[ . 1]"
1 46 ILE 11.777 0.234 5 0 "[ . 1]"
1 47 ARG 8.392 0.266 1 0 "[ . 1]"
1 48 HIS 8.206 0.219 2 0 "[ . 1]"
1 49 PHE 8.245 0.185 9 0 "[ . 1]"
1 50 THR 5.677 0.224 4 0 "[ . 1]"
1 51 ASP 2.343 0.216 2 0 "[ . 1]"
1 52 ASP 2.099 0.131 10 0 "[ . 1]"
1 53 GLY 0.979 0.136 5 0 "[ . 1]"
1 54 PHE 7.865 0.253 10 0 "[ . 1]"
1 55 SER 1.154 0.171 5 0 "[ . 1]"
1 56 GLY 0.163 0.071 3 0 "[ . 1]"
1 57 VAL 1.436 0.173 10 0 "[ . 1]"
1 58 ASN 4.372 0.267 7 0 "[ . 1]"
1 59 PHE 5.528 0.243 4 0 "[ . 1]"
1 60 ASN 1.221 0.130 7 0 "[ . 1]"
1 61 ARG 6.404 0.253 10 0 "[ . 1]"
1 62 PRO 3.309 0.165 1 0 "[ . 1]"
1 63 GLY 0.729 0.127 2 0 "[ . 1]"
1 64 PHE 8.874 0.181 9 0 "[ . 1]"
1 65 GLN 2.245 0.130 7 0 "[ . 1]"
1 66 SER 3.143 0.139 6 0 "[ . 1]"
1 67 LEU 10.918 0.261 6 0 "[ . 1]"
1 68 ILE 4.963 0.177 7 0 "[ . 1]"
1 69 LYS 1.705 0.126 5 0 "[ . 1]"
1 70 GLU 4.750 0.197 1 0 "[ . 1]"
1 71 VAL 5.861 0.253 8 0 "[ . 1]"
1 72 GLU 4.685 0.197 1 0 "[ . 1]"
1 73 ALA 1.463 0.156 1 0 "[ . 1]"
1 74 GLY 2.597 0.243 7 0 "[ . 1]"
1 75 ASN 7.978 0.200 4 0 "[ . 1]"
1 76 VAL 4.532 0.253 8 0 "[ . 1]"
1 77 GLU 1.970 0.154 7 0 "[ . 1]"
1 78 THR 6.344 0.198 4 0 "[ . 1]"
1 79 LEU 14.641 0.286 3 0 "[ . 1]"
1 80 ILE 3.673 0.140 1 0 "[ . 1]"
1 81 VAL 12.380 0.290 6 0 "[ . 1]"
1 82 LYS 3.756 0.271 6 0 "[ . 1]"
1 83 ASP 2.540 0.169 4 0 "[ . 1]"
1 84 MET 1.187 0.077 3 0 "[ . 1]"
1 85 SER 2.898 0.254 4 0 "[ . 1]"
1 86 ARG 2.393 0.236 5 0 "[ . 1]"
1 87 LEU 5.723 0.267 7 0 "[ . 1]"
1 88 GLY 1.500 0.169 6 0 "[ . 1]"
1 89 ARG 0.975 0.098 9 0 "[ . 1]"
1 90 ASN 0.528 0.098 9 0 "[ . 1]"
1 91 TYR 4.286 0.235 2 0 "[ . 1]"
1 92 LEU 2.569 0.123 10 0 "[ . 1]"
1 93 GLN 3.116 0.138 4 0 "[ . 1]"
1 94 VAL 6.666 0.243 4 0 "[ . 1]"
1 95 GLY 1.213 0.116 3 0 "[ . 1]"
1 96 PHE 2.697 0.156 6 0 "[ . 1]"
1 97 TYR 2.727 0.168 9 0 "[ . 1]"
1 98 THR 2.923 0.140 5 0 "[ . 1]"
1 99 GLU 3.839 0.200 8 0 "[ . 1]"
1 100 VAL 2.034 0.155 3 0 "[ . 1]"
1 101 LEU 5.243 0.177 7 0 "[ . 1]"
1 102 PHE 13.333 0.236 7 0 "[ . 1]"
1 103 PRO 7.039 0.200 8 0 "[ . 1]"
1 104 GLN 8.396 0.243 7 0 "[ . 1]"
1 105 LYS 4.840 0.223 6 0 "[ . 1]"
1 106 ASN 2.387 0.151 10 0 "[ . 1]"
1 107 VAL 7.011 0.236 7 0 "[ . 1]"
1 108 ARG 4.376 0.166 10 0 "[ . 1]"
1 109 PHE 11.896 0.196 10 0 "[ . 1]"
1 110 LEU 3.191 0.256 10 0 "[ . 1]"
1 111 ALA 6.062 0.256 10 0 "[ . 1]"
1 112 ILE 6.281 0.290 6 0 "[ . 1]"
1 113 ASN 0.060 0.022 8 0 "[ . 1]"
1 114 ASN 1.312 0.102 1 0 "[ . 1]"
1 115 SER 0.214 0.084 10 0 "[ . 1]"
1 116 ILE 3.679 0.173 9 0 "[ . 1]"
1 117 ASP 1.695 0.184 10 0 "[ . 1]"
1 118 SER 1.531 0.173 9 0 "[ . 1]"
1 119 ASN 2.193 0.213 2 0 "[ . 1]"
1 120 ASN 2.418 0.213 2 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER QB 1 3 ARG HB2 4.750 . 4.750 3.675 3.202 4.800 0.050 3 0 "[ . 1]" 1
2 1 3 ARG HA 1 3 ARG QD 4.120 . 4.120 3.010 1.998 3.963 . 0 0 "[ . 1]" 1
3 1 3 ARG HA 1 3 ARG QG 3.260 . 3.260 2.306 2.034 2.688 . 0 0 "[ . 1]" 1
4 1 3 ARG HB3 1 3 ARG QG 2.650 . 2.650 2.347 2.156 2.518 . 0 0 "[ . 1]" 1
5 1 3 ARG HB3 1 4 THR HA 4.420 . 4.420 4.331 3.983 4.526 0.106 8 0 "[ . 1]" 1
6 1 3 ARG QD 1 4 THR H 4.190 . 4.190 3.907 3.090 4.223 0.033 6 0 "[ . 1]" 1
7 1 3 ARG QD 1 4 THR MG 4.770 . 4.770 4.309 3.527 4.858 0.088 7 0 "[ . 1]" 1
8 1 4 THR H 1 4 THR MG 4.200 . 4.200 3.036 2.463 3.753 . 0 0 "[ . 1]" 1
9 1 4 THR HA 1 4 THR HB 2.720 . 2.720 2.533 2.295 2.805 0.085 3 0 "[ . 1]" 1
10 1 4 THR HA 1 4 THR MG 3.000 . 3.000 2.577 2.086 3.197 0.197 7 0 "[ . 1]" 1
11 1 4 THR MG 1 5 SER H 4.690 . 4.690 3.527 2.594 4.222 . 0 0 "[ . 1]" 1
12 1 5 SER H 1 5 SER QB 3.370 . 3.370 3.023 2.465 3.477 0.107 9 0 "[ . 1]" 1
13 1 5 SER HA 1 5 SER QB 2.510 . 2.510 2.324 2.170 2.529 0.019 4 0 "[ . 1]" 1
14 1 5 SER HA 1 6 ARG H 2.910 . 2.910 2.172 2.122 2.259 . 0 0 "[ . 1]" 1
15 1 5 SER HA 1 45 ASN HD22 4.110 . 4.110 4.220 4.189 4.256 0.146 5 0 "[ . 1]" 1
16 1 5 SER QB 1 6 ARG H 5.410 . 5.410 3.476 2.779 3.765 . 0 0 "[ . 1]" 1
17 1 5 SER QB 1 6 ARG HE 4.100 . 4.100 4.093 3.720 4.197 0.097 2 0 "[ . 1]" 1
18 1 5 SER QB 1 45 ASN HD21 4.170 . 4.170 4.020 3.737 4.219 0.049 8 0 "[ . 1]" 1
19 1 5 SER QB 1 45 ASN HD22 5.390 . 5.390 2.566 2.256 2.863 . 0 0 "[ . 1]" 1
20 1 6 ARG H 1 6 ARG QB 3.260 . 3.260 2.689 2.355 3.010 . 0 0 "[ . 1]" 1
21 1 6 ARG H 1 6 ARG QD 4.460 . 4.460 2.792 1.984 3.445 . 0 0 "[ . 1]" 1
22 1 6 ARG H 1 6 ARG HG2 3.730 . 3.730 3.497 3.381 3.774 0.044 2 0 "[ . 1]" 1
23 1 6 ARG H 1 6 ARG HG3 5.110 . 5.110 2.718 1.777 3.983 0.023 1 0 "[ . 1]" 1
24 1 6 ARG HA 1 7 ILE MG 3.820 . 3.820 3.012 2.861 3.084 . 0 0 "[ . 1]" 1
25 1 6 ARG HA 1 75 ASN HA 4.510 . 4.510 3.180 2.864 3.425 . 0 0 "[ . 1]" 1
26 1 6 ARG HA 1 75 ASN HB3 3.630 . 3.630 3.685 3.628 3.742 0.112 3 0 "[ . 1]" 1
27 1 6 ARG QB 1 6 ARG QD 3.490 . 3.490 2.225 2.142 2.393 . 0 0 "[ . 1]" 1
28 1 6 ARG QB 1 6 ARG HE 3.430 . 3.430 3.340 2.066 3.520 0.090 1 0 "[ . 1]" 1
29 1 6 ARG QB 1 6 ARG HG2 2.600 . 2.600 2.239 2.097 2.400 . 0 0 "[ . 1]" 1
30 1 6 ARG QB 1 7 ILE H 4.120 . 4.120 1.926 1.696 2.233 0.104 2 0 "[ . 1]" 1
31 1 6 ARG QB 1 75 ASN HA 4.030 . 4.030 2.002 1.816 2.376 . 0 0 "[ . 1]" 1
32 1 6 ARG QB 1 75 ASN HB3 3.520 . 3.520 3.470 3.227 3.586 0.066 2 0 "[ . 1]" 1
33 1 6 ARG QB 1 77 GLU H 4.020 . 4.020 3.852 3.474 4.091 0.071 7 0 "[ . 1]" 1
34 1 6 ARG QD 1 7 ILE H 4.480 . 4.480 3.142 2.016 4.118 . 0 0 "[ . 1]" 1
35 1 6 ARG QD 1 45 ASN HD21 5.500 . 5.500 4.558 4.066 5.175 . 0 0 "[ . 1]" 1
36 1 6 ARG QD 1 45 ASN HD22 5.500 . 5.500 5.176 4.842 5.570 0.070 2 0 "[ . 1]" 1
37 1 6 ARG QD 1 77 GLU H 5.500 . 5.500 3.841 2.797 4.738 . 0 0 "[ . 1]" 1
38 1 6 ARG QD 1 77 GLU HB3 3.930 . 3.930 2.370 1.836 2.988 . 0 0 "[ . 1]" 1
39 1 6 ARG QD 1 77 GLU QG 4.900 . 4.900 2.391 1.805 3.086 . 0 0 "[ . 1]" 1
40 1 6 ARG HE 1 7 ILE H 5.070 . 5.070 3.522 3.048 3.986 . 0 0 "[ . 1]" 1
41 1 6 ARG HE 1 7 ILE HA 4.340 . 4.340 3.369 2.959 3.970 . 0 0 "[ . 1]" 1
42 1 6 ARG HE 1 45 ASN QB 4.400 . 4.400 4.061 3.673 4.511 0.111 2 0 "[ . 1]" 1
43 1 6 ARG HE 1 45 ASN HD21 5.500 . 5.500 2.793 2.383 3.169 . 0 0 "[ . 1]" 1
44 1 6 ARG HG2 1 7 ILE H 4.060 . 4.060 3.142 1.881 4.188 0.128 2 0 "[ . 1]" 1
45 1 6 ARG HG2 1 75 ASN HA 3.980 . 3.980 4.052 3.863 4.180 0.200 4 0 "[ . 1]" 1
46 1 6 ARG HG3 1 7 ILE H 4.430 . 4.430 3.753 2.986 4.388 . 0 0 "[ . 1]" 1
47 1 6 ARG HG3 1 75 ASN HA 4.570 . 4.570 4.372 3.861 4.698 0.128 9 0 "[ . 1]" 1
48 1 7 ILE H 1 7 ILE HB 4.140 . 4.140 3.960 3.937 4.003 . 0 0 "[ . 1]" 1
49 1 7 ILE H 1 7 ILE QG 3.970 . 3.970 2.675 2.517 3.024 . 0 0 "[ . 1]" 1
50 1 7 ILE H 1 7 ILE MG 3.420 . 3.420 2.848 2.573 2.972 . 0 0 "[ . 1]" 1
51 1 7 ILE H 1 76 VAL HA 3.940 . 3.940 3.466 3.124 3.595 . 0 0 "[ . 1]" 1
52 1 7 ILE H 1 77 GLU H 4.290 . 4.290 3.098 2.889 3.324 . 0 0 "[ . 1]" 1
53 1 7 ILE HA 1 7 ILE MG 3.440 . 3.440 2.469 2.383 2.693 . 0 0 "[ . 1]" 1
54 1 7 ILE HA 1 8 THR H 3.050 . 3.050 2.406 2.335 2.490 . 0 0 "[ . 1]" 1
55 1 7 ILE HA 1 45 ASN QB 2.770 . 2.770 1.722 1.675 1.943 0.125 2 0 "[ . 1]" 1
56 1 7 ILE HA 1 45 ASN HD21 4.790 . 4.790 2.588 2.535 2.685 . 0 0 "[ . 1]" 1
57 1 7 ILE HA 1 45 ASN HD22 4.540 . 4.540 3.794 3.376 3.997 . 0 0 "[ . 1]" 1
58 1 7 ILE HA 1 77 GLU QG 4.170 . 4.170 4.000 3.700 4.226 0.056 3 0 "[ . 1]" 1
59 1 7 ILE HB 1 8 THR H 3.410 . 3.410 2.227 2.080 2.626 . 0 0 "[ . 1]" 1
60 1 7 ILE HB 1 45 ASN QB 3.540 . 3.540 2.144 1.903 2.362 . 0 0 "[ . 1]" 1
61 1 7 ILE HB 1 45 ASN HD21 4.390 . 4.390 4.563 4.532 4.583 0.193 1 0 "[ . 1]" 1
62 1 7 ILE HB 1 47 ARG HB2 4.810 . 4.810 3.386 3.162 3.629 . 0 0 "[ . 1]" 1
63 1 7 ILE HB 1 75 ASN HB3 4.330 . 4.330 4.462 4.413 4.517 0.187 8 0 "[ . 1]" 1
64 1 7 ILE HB 1 76 VAL HA 4.470 . 4.470 4.624 4.546 4.720 0.250 7 0 "[ . 1]" 1
65 1 7 ILE MD 1 8 THR H 3.620 . 3.620 2.845 2.626 3.067 . 0 0 "[ . 1]" 1
66 1 7 ILE MD 1 9 ALA H 4.510 . 4.510 3.948 3.740 4.238 . 0 0 "[ . 1]" 1
67 1 7 ILE MD 1 9 ALA HA 3.900 . 3.900 2.896 2.662 3.098 . 0 0 "[ . 1]" 1
68 1 7 ILE MD 1 9 ALA MB 3.500 . 3.500 2.939 2.674 3.322 . 0 0 "[ . 1]" 1
69 1 7 ILE MD 1 47 ARG H 4.310 . 4.310 3.042 2.863 3.211 . 0 0 "[ . 1]" 1
70 1 7 ILE MD 1 47 ARG HA 4.260 . 4.260 4.336 4.266 4.384 0.124 4 0 "[ . 1]" 1
71 1 7 ILE MD 1 47 ARG HB2 3.700 . 3.700 2.005 1.903 2.090 . 0 0 "[ . 1]" 1
72 1 7 ILE MD 1 47 ARG HB3 3.740 . 3.740 2.800 2.644 2.909 . 0 0 "[ . 1]" 1
73 1 7 ILE MD 1 47 ARG QD 3.040 . 3.040 3.140 3.058 3.306 0.266 1 0 "[ . 1]" 1
74 1 7 ILE MD 1 47 ARG HG3 3.540 . 3.540 3.212 2.933 3.429 . 0 0 "[ . 1]" 1
75 1 7 ILE MD 1 49 PHE QE 3.000 . 3.000 3.074 3.021 3.134 0.134 9 0 "[ . 1]" 1
76 1 7 ILE MD 1 49 PHE HZ 3.190 . 3.190 2.428 2.372 2.467 . 0 0 "[ . 1]" 1
77 1 7 ILE MD 1 75 ASN HD21 4.780 . 4.780 4.711 4.426 4.859 0.079 2 0 "[ . 1]" 1
78 1 7 ILE MD 1 76 VAL HA 4.300 . 4.300 2.959 2.680 3.296 . 0 0 "[ . 1]" 1
79 1 7 ILE MD 1 76 VAL MG2 3.690 . 3.690 3.036 2.751 3.500 . 0 0 "[ . 1]" 1
80 1 7 ILE MD 1 77 GLU H 4.440 . 4.440 4.481 4.358 4.594 0.154 7 0 "[ . 1]" 1
81 1 7 ILE QG 1 75 ASN HB3 4.100 . 4.100 2.082 1.916 2.591 . 0 0 "[ . 1]" 1
82 1 7 ILE QG 1 76 VAL MG2 3.780 . 3.780 3.490 2.703 3.788 0.008 7 0 "[ . 1]" 1
83 1 7 ILE MG 1 45 ASN QB 3.400 . 3.400 2.282 1.923 2.995 . 0 0 "[ . 1]" 1
84 1 7 ILE MG 1 45 ASN HD21 5.440 . 5.440 3.869 3.664 4.247 . 0 0 "[ . 1]" 1
85 1 7 ILE MG 1 45 ASN HD22 5.300 . 5.300 4.097 3.833 4.634 . 0 0 "[ . 1]" 1
86 1 7 ILE MG 1 75 ASN HB2 4.290 . 4.290 3.854 3.223 4.267 . 0 0 "[ . 1]" 1
87 1 7 ILE MG 1 75 ASN HB3 3.960 . 3.960 2.405 1.790 2.827 0.010 2 0 "[ . 1]" 1
88 1 7 ILE MG 1 75 ASN HD21 4.780 . 4.780 3.403 2.750 3.939 . 0 0 "[ . 1]" 1
89 1 8 THR H 1 8 THR HB 3.670 . 3.670 2.369 2.308 2.438 . 0 0 "[ . 1]" 1
90 1 8 THR H 1 8 THR MG 4.450 . 4.450 3.685 3.611 3.747 . 0 0 "[ . 1]" 1
91 1 8 THR H 1 9 ALA H 5.500 . 5.500 4.552 4.495 4.606 . 0 0 "[ . 1]" 1
92 1 8 THR H 1 45 ASN QB 3.510 . 3.510 2.225 2.098 2.433 . 0 0 "[ . 1]" 1
93 1 8 THR H 1 46 ILE HA 3.940 . 3.940 3.492 3.402 3.640 . 0 0 "[ . 1]" 1
94 1 8 THR H 1 47 ARG H 5.260 . 5.260 3.473 3.306 3.702 . 0 0 "[ . 1]" 1
95 1 8 THR HA 1 8 THR MG 3.230 . 3.230 2.634 2.571 2.686 . 0 0 "[ . 1]" 1
96 1 8 THR HA 1 9 ALA H 2.890 . 2.890 2.357 2.306 2.391 . 0 0 "[ . 1]" 1
97 1 8 THR HA 1 9 ALA MB 4.840 . 4.840 4.009 3.976 4.035 . 0 0 "[ . 1]" 1
98 1 8 THR HA 1 78 THR H 3.580 . 3.580 2.739 2.539 2.841 . 0 0 "[ . 1]" 1
99 1 8 THR HA 1 78 THR HB 3.520 . 3.520 3.227 3.021 3.410 . 0 0 "[ . 1]" 1
100 1 8 THR HB 1 44 GLU HA 4.860 . 4.860 4.828 4.762 4.877 0.017 6 0 "[ . 1]" 1
101 1 8 THR HB 1 45 ASN H 4.880 . 4.880 4.894 4.805 4.960 0.080 6 0 "[ . 1]" 1
102 1 8 THR HB 1 45 ASN HA 4.910 . 4.910 4.942 4.777 5.027 0.117 5 0 "[ . 1]" 1
103 1 8 THR HB 1 45 ASN QB 4.280 . 4.280 3.485 3.044 3.673 . 0 0 "[ . 1]" 1
104 1 8 THR HB 1 46 ILE H 5.150 . 5.150 3.145 1.902 3.371 . 0 0 "[ . 1]" 1
105 1 8 THR HB 1 46 ILE HA 3.240 . 3.240 2.139 1.990 2.315 . 0 0 "[ . 1]" 1
106 1 8 THR HB 1 46 ILE HB 4.540 . 4.540 4.590 4.490 4.659 0.119 10 0 "[ . 1]" 1
107 1 8 THR HB 1 46 ILE HG12 4.370 . 4.370 3.195 3.108 3.316 . 0 0 "[ . 1]" 1
108 1 8 THR HB 1 46 ILE HG13 4.070 . 4.070 2.976 2.895 3.088 . 0 0 "[ . 1]" 1
109 1 8 THR HB 1 47 ARG H 3.660 . 3.660 3.491 3.317 3.655 . 0 0 "[ . 1]" 1
110 1 8 THR HB 1 80 ILE MD 5.150 . 5.150 4.771 4.509 5.163 0.013 10 0 "[ . 1]" 1
111 1 8 THR MG 1 9 ALA H 3.610 . 3.610 2.348 2.202 2.533 . 0 0 "[ . 1]" 1
112 1 8 THR MG 1 38 ALA H 5.500 . 5.500 5.566 5.510 5.603 0.103 4 0 "[ . 1]" 1
113 1 8 THR MG 1 38 ALA MB 3.570 . 3.570 2.864 2.716 3.002 . 0 0 "[ . 1]" 1
114 1 8 THR MG 1 43 PHE H 4.990 . 4.990 4.973 4.839 5.053 0.063 1 0 "[ . 1]" 1
115 1 8 THR MG 1 43 PHE HB2 3.590 . 3.590 2.786 2.556 2.898 . 0 0 "[ . 1]" 1
116 1 8 THR MG 1 43 PHE HB3 3.760 . 3.760 2.210 2.089 2.338 . 0 0 "[ . 1]" 1
117 1 8 THR MG 1 44 GLU H 4.460 . 4.460 4.453 4.280 4.516 0.056 1 0 "[ . 1]" 1
118 1 8 THR MG 1 46 ILE HA 3.120 . 3.120 2.325 1.891 2.739 . 0 0 "[ . 1]" 1
119 1 8 THR MG 1 47 ARG H 4.710 . 4.710 3.427 2.982 3.746 . 0 0 "[ . 1]" 1
120 1 8 THR MG 1 77 GLU H 5.500 . 5.500 5.314 5.102 5.507 0.007 8 0 "[ . 1]" 1
121 1 9 ALA H 1 9 ALA MB 3.300 . 3.300 2.387 2.315 2.431 . 0 0 "[ . 1]" 1
122 1 9 ALA H 1 76 VAL QG 3.680 . 3.680 2.554 2.382 2.769 . 0 0 "[ . 1]" 1
123 1 9 ALA H 1 78 THR H 3.920 . 3.920 3.214 3.120 3.346 . 0 0 "[ . 1]" 1
124 1 9 ALA H 1 78 THR HB 4.120 . 4.120 3.155 3.006 3.263 . 0 0 "[ . 1]" 1
125 1 9 ALA H 1 78 THR MG 4.360 . 4.360 4.486 4.416 4.558 0.198 4 0 "[ . 1]" 1
126 1 9 ALA H 1 79 LEU HA 3.840 . 3.840 2.957 2.862 3.038 . 0 0 "[ . 1]" 1
127 1 9 ALA H 1 79 LEU HB3 5.500 . 5.500 5.737 5.661 5.776 0.276 8 0 "[ . 1]" 1
128 1 9 ALA H 1 79 LEU MD1 4.650 . 4.650 4.261 4.074 4.594 . 0 0 "[ . 1]" 1
129 1 9 ALA H 1 79 LEU MD2 4.700 . 4.700 4.069 3.907 4.210 . 0 0 "[ . 1]" 1
130 1 9 ALA HA 1 10 LEU H 2.890 . 2.890 2.059 2.049 2.077 . 0 0 "[ . 1]" 1
131 1 9 ALA HA 1 10 LEU HB2 4.200 . 4.200 4.238 4.140 4.283 0.083 1 0 "[ . 1]" 1
132 1 9 ALA HA 1 10 LEU HB3 4.740 . 4.740 4.731 4.653 4.774 0.034 8 0 "[ . 1]" 1
133 1 9 ALA HA 1 47 ARG H 3.790 . 3.790 3.405 3.147 3.538 . 0 0 "[ . 1]" 1
134 1 9 ALA HA 1 47 ARG HB2 4.660 . 4.660 4.022 3.869 4.227 . 0 0 "[ . 1]" 1
135 1 9 ALA HA 1 49 PHE QD 3.670 . 3.670 3.581 3.504 3.683 0.013 2 0 "[ . 1]" 1
136 1 9 ALA HA 1 49 PHE QE 3.450 . 3.450 1.767 1.719 1.880 0.081 3 0 "[ . 1]" 1
137 1 9 ALA HA 1 49 PHE HZ 4.290 . 4.290 3.736 3.525 3.898 . 0 0 "[ . 1]" 1
138 1 9 ALA HA 1 67 LEU MD1 4.690 . 4.690 4.194 4.065 4.330 . 0 0 "[ . 1]" 1
139 1 9 ALA MB 1 10 LEU H 3.720 . 3.720 3.136 3.014 3.238 . 0 0 "[ . 1]" 1
140 1 9 ALA MB 1 49 PHE QD 3.240 . 3.240 3.288 3.212 3.338 0.098 2 0 "[ . 1]" 1
141 1 9 ALA MB 1 49 PHE QE 3.190 . 3.190 2.383 2.228 2.533 . 0 0 "[ . 1]" 1
142 1 9 ALA MB 1 49 PHE HZ 4.180 . 4.180 3.643 3.417 3.845 . 0 0 "[ . 1]" 1
143 1 9 ALA MB 1 67 LEU HA 5.220 . 5.220 3.719 3.480 3.902 . 0 0 "[ . 1]" 1
144 1 9 ALA MB 1 67 LEU MD1 3.340 . 3.340 2.101 1.912 2.271 . 0 0 "[ . 1]" 1
145 1 9 ALA MB 1 67 LEU MD2 4.380 . 4.380 3.791 3.460 4.007 . 0 0 "[ . 1]" 1
146 1 9 ALA MB 1 79 LEU HA 3.660 . 3.660 2.192 1.987 2.328 . 0 0 "[ . 1]" 1
147 1 9 ALA MB 1 79 LEU MD1 3.700 . 3.700 2.575 2.325 2.966 . 0 0 "[ . 1]" 1
148 1 9 ALA MB 1 79 LEU MD2 3.480 . 3.480 1.831 1.768 1.980 0.032 2 0 "[ . 1]" 1
149 1 9 ALA MB 1 80 ILE H 3.640 . 3.640 3.427 3.298 3.532 . 0 0 "[ . 1]" 1
150 1 10 LEU H 1 10 LEU HB2 3.440 . 3.440 2.688 2.618 2.799 . 0 0 "[ . 1]" 1
151 1 10 LEU H 1 10 LEU HB3 3.580 . 3.580 2.747 2.709 2.818 . 0 0 "[ . 1]" 1
152 1 10 LEU H 1 10 LEU MD1 4.360 . 4.360 4.336 4.273 4.422 0.062 5 0 "[ . 1]" 1
153 1 10 LEU H 1 46 ILE HA 4.560 . 4.560 4.644 4.602 4.676 0.116 9 0 "[ . 1]" 1
154 1 10 LEU H 1 46 ILE MG 4.540 . 4.540 3.954 3.728 4.255 . 0 0 "[ . 1]" 1
155 1 10 LEU H 1 47 ARG H 5.260 . 5.260 3.561 3.457 3.658 . 0 0 "[ . 1]" 1
156 1 10 LEU H 1 48 HIS HA 3.900 . 3.900 3.671 3.530 3.783 . 0 0 "[ . 1]" 1
157 1 10 LEU H 1 49 PHE H 4.410 . 4.410 3.818 3.691 3.934 . 0 0 "[ . 1]" 1
158 1 10 LEU H 1 49 PHE QD 3.620 . 3.620 2.538 2.373 2.785 . 0 0 "[ . 1]" 1
159 1 10 LEU H 1 49 PHE QE 3.970 . 3.970 2.345 2.258 2.461 . 0 0 "[ . 1]" 1
160 1 10 LEU HA 1 10 LEU MD1 4.060 . 4.060 3.355 3.208 3.438 . 0 0 "[ . 1]" 1
161 1 10 LEU HA 1 10 LEU MD2 3.300 . 3.300 3.377 3.312 3.435 0.135 8 0 "[ . 1]" 1
162 1 10 LEU HA 1 10 LEU HG 3.290 . 3.290 2.294 2.244 2.336 . 0 0 "[ . 1]" 1
163 1 10 LEU HA 1 11 TYR H 2.970 . 2.970 2.222 2.197 2.251 . 0 0 "[ . 1]" 1
164 1 10 LEU HA 1 34 LEU MD2 4.250 . 4.250 3.639 3.374 4.044 . 0 0 "[ . 1]" 1
165 1 10 LEU HA 1 79 LEU MD1 4.190 . 4.190 3.392 3.313 3.470 . 0 0 "[ . 1]" 1
166 1 10 LEU HA 1 80 ILE H 3.920 . 3.920 2.922 2.807 3.037 . 0 0 "[ . 1]" 1
167 1 10 LEU HA 1 80 ILE HB 3.740 . 3.740 2.664 2.416 2.843 . 0 0 "[ . 1]" 1
168 1 10 LEU HA 1 81 VAL MG2 4.530 . 4.530 4.446 4.232 4.558 0.028 7 0 "[ . 1]" 1
169 1 10 LEU HB2 1 34 LEU MD2 4.360 . 4.360 4.534 4.445 4.633 0.273 9 0 "[ . 1]" 1
170 1 10 LEU HB2 1 47 ARG H 3.980 . 3.980 3.957 3.886 4.022 0.042 9 0 "[ . 1]" 1
171 1 10 LEU HB2 1 48 HIS HA 3.680 . 3.680 3.597 3.404 3.700 0.020 5 0 "[ . 1]" 1
172 1 10 LEU HB2 1 49 PHE H 4.850 . 4.850 4.771 4.550 4.876 0.026 1 0 "[ . 1]" 1
173 1 10 LEU HB3 1 48 HIS HA 3.840 . 3.840 1.986 1.893 2.099 . 0 0 "[ . 1]" 1
174 1 10 LEU HB3 1 49 PHE H 5.360 . 5.360 3.195 3.008 3.296 . 0 0 "[ . 1]" 1
175 1 10 LEU MD1 1 31 LYS HA 4.450 . 4.450 4.392 4.119 4.474 0.024 4 0 "[ . 1]" 1
176 1 10 LEU MD1 1 34 LEU HA 4.510 . 4.510 3.754 3.621 3.911 . 0 0 "[ . 1]" 1
177 1 10 LEU MD1 1 34 LEU HB3 4.380 . 4.380 1.994 1.875 2.368 . 0 0 "[ . 1]" 1
178 1 10 LEU MD1 1 34 LEU MD2 4.170 . 4.170 3.231 3.076 3.368 . 0 0 "[ . 1]" 1
179 1 10 LEU MD1 1 35 GLU H 4.070 . 4.070 2.821 2.478 2.986 . 0 0 "[ . 1]" 1
180 1 10 LEU MD1 1 35 GLU HA 3.330 . 3.330 2.644 2.438 2.767 . 0 0 "[ . 1]" 1
181 1 10 LEU MD1 1 35 GLU QB 3.840 . 3.840 3.566 3.253 3.794 . 0 0 "[ . 1]" 1
182 1 10 LEU MD1 1 35 GLU HG2 4.170 . 4.170 3.481 2.530 4.061 . 0 0 "[ . 1]" 1
183 1 10 LEU MD1 1 35 GLU HG3 4.370 . 4.370 3.372 2.440 4.050 . 0 0 "[ . 1]" 1
184 1 10 LEU MD1 1 38 ALA H 4.040 . 4.040 3.845 3.672 4.012 . 0 0 "[ . 1]" 1
185 1 10 LEU MD1 1 38 ALA MB 3.870 . 3.870 2.678 2.446 2.852 . 0 0 "[ . 1]" 1
186 1 10 LEU MD1 1 46 ILE H 5.500 . 5.500 5.658 5.573 5.733 0.233 2 0 "[ . 1]" 1
187 1 10 LEU MD1 1 46 ILE MD 4.280 . 4.280 3.484 3.420 3.661 . 0 0 "[ . 1]" 1
188 1 10 LEU MD1 1 46 ILE MG 3.110 . 3.110 1.731 1.715 1.774 0.085 4 0 "[ . 1]" 1
189 1 10 LEU MD1 1 47 ARG H 4.920 . 4.920 4.860 4.777 4.913 . 0 0 "[ . 1]" 1
190 1 10 LEU MD1 1 48 HIS HA 4.510 . 4.510 4.029 3.926 4.161 . 0 0 "[ . 1]" 1
191 1 10 LEU MD1 1 48 HIS HD2 4.160 . 4.160 3.720 3.124 4.125 . 0 0 "[ . 1]" 1
192 1 10 LEU MD1 1 48 HIS HE1 3.060 . 3.060 2.921 2.733 3.075 0.015 4 0 "[ . 1]" 1
193 1 10 LEU MD2 1 11 TYR H 4.010 . 4.010 3.882 3.750 4.037 0.027 8 0 "[ . 1]" 1
194 1 10 LEU MD2 1 31 LYS HA 4.530 . 4.530 2.599 2.343 2.806 . 0 0 "[ . 1]" 1
195 1 10 LEU MD2 1 34 LEU HB2 4.030 . 4.030 1.975 1.797 2.190 0.003 5 0 "[ . 1]" 1
196 1 10 LEU MD2 1 34 LEU MD2 3.230 . 3.230 1.720 1.673 1.752 0.127 4 0 "[ . 1]" 1
197 1 10 LEU MD2 1 35 GLU H 4.560 . 4.560 3.428 3.345 3.505 . 0 0 "[ . 1]" 1
198 1 10 LEU MD2 1 35 GLU HA 4.240 . 4.240 4.359 4.297 4.427 0.187 8 0 "[ . 1]" 1
199 1 10 LEU MD2 1 48 HIS HA 5.310 . 5.310 2.442 2.160 2.696 . 0 0 "[ . 1]" 1
200 1 10 LEU MD2 1 48 HIS HB3 5.040 . 5.040 3.170 2.997 3.426 . 0 0 "[ . 1]" 1
201 1 10 LEU MD2 1 48 HIS HE1 3.970 . 3.970 2.527 2.239 2.750 . 0 0 "[ . 1]" 1
202 1 10 LEU MD2 1 49 PHE QD 4.580 . 4.580 4.677 4.611 4.742 0.162 3 0 "[ . 1]" 1
203 1 11 TYR H 1 11 TYR HB2 3.480 . 3.480 3.270 3.085 3.462 . 0 0 "[ . 1]" 1
204 1 11 TYR H 1 11 TYR HB3 3.530 . 3.530 2.459 2.287 2.688 . 0 0 "[ . 1]" 1
205 1 11 TYR H 1 34 LEU MD2 4.180 . 4.180 3.586 3.274 4.189 0.009 9 0 "[ . 1]" 1
206 1 11 TYR H 1 67 LEU MD2 5.500 . 5.500 4.762 4.292 5.084 . 0 0 "[ . 1]" 1
207 1 11 TYR H 1 79 LEU MD1 4.080 . 4.080 2.800 2.721 2.846 . 0 0 "[ . 1]" 1
208 1 11 TYR H 1 79 LEU MD2 4.410 . 4.410 4.375 4.110 4.502 0.092 5 0 "[ . 1]" 1
209 1 11 TYR H 1 80 ILE H 4.090 . 4.090 3.600 3.330 3.787 . 0 0 "[ . 1]" 1
210 1 11 TYR H 1 80 ILE HB 4.350 . 4.350 4.258 3.977 4.399 0.049 10 0 "[ . 1]" 1
211 1 11 TYR H 1 81 VAL MG2 4.130 . 4.130 2.993 2.817 3.085 . 0 0 "[ . 1]" 1
212 1 11 TYR HA 1 12 GLU H 3.080 . 3.080 2.196 2.169 2.218 . 0 0 "[ . 1]" 1
213 1 11 TYR HA 1 49 PHE H 3.970 . 3.970 2.826 2.741 3.050 . 0 0 "[ . 1]" 1
214 1 11 TYR HA 1 49 PHE HB2 4.010 . 4.010 2.192 2.099 2.262 . 0 0 "[ . 1]" 1
215 1 11 TYR HA 1 49 PHE HB3 4.350 . 4.350 3.849 3.745 3.930 . 0 0 "[ . 1]" 1
216 1 11 TYR HA 1 49 PHE QD 4.060 . 4.060 3.081 2.831 3.211 . 0 0 "[ . 1]" 1
217 1 11 TYR HA 1 67 LEU MD2 4.560 . 4.560 4.346 3.988 4.614 0.054 6 0 "[ . 1]" 1
218 1 11 TYR HA 1 79 LEU MD1 4.570 . 4.570 4.691 4.613 4.737 0.167 5 0 "[ . 1]" 1
219 1 11 TYR HA 1 81 VAL MG2 4.700 . 4.700 4.818 4.734 4.895 0.195 4 0 "[ . 1]" 1
220 1 11 TYR HB2 1 12 GLU H 4.210 . 4.210 4.067 3.755 4.292 0.082 4 0 "[ . 1]" 1
221 1 11 TYR HB2 1 49 PHE QD 3.760 . 3.760 2.960 2.662 3.357 . 0 0 "[ . 1]" 1
222 1 11 TYR HB2 1 67 LEU HB2 3.730 . 3.730 3.055 2.833 3.319 . 0 0 "[ . 1]" 1
223 1 11 TYR HB2 1 67 LEU MD1 4.430 . 4.430 3.542 3.303 3.821 . 0 0 "[ . 1]" 1
224 1 11 TYR HB2 1 67 LEU MD2 3.850 . 3.850 2.327 2.027 2.574 . 0 0 "[ . 1]" 1
225 1 11 TYR HB2 1 79 LEU MD1 3.800 . 3.800 3.652 3.466 3.810 0.010 7 0 "[ . 1]" 1
226 1 11 TYR HB2 1 81 VAL MG2 4.100 . 4.100 4.199 4.126 4.274 0.174 6 0 "[ . 1]" 1
227 1 11 TYR HB3 1 49 PHE QD 5.440 . 5.440 4.034 3.848 4.259 . 0 0 "[ . 1]" 1
228 1 11 TYR HB3 1 67 LEU HB2 4.150 . 4.150 4.343 4.249 4.411 0.261 6 0 "[ . 1]" 1
229 1 11 TYR HB3 1 67 LEU MD2 4.090 . 4.090 2.831 2.406 3.104 . 0 0 "[ . 1]" 1
230 1 11 TYR HB3 1 79 LEU MD1 4.030 . 4.030 2.495 2.312 2.689 . 0 0 "[ . 1]" 1
231 1 11 TYR HB3 1 81 VAL MG2 3.360 . 3.360 2.736 2.631 2.836 . 0 0 "[ . 1]" 1
232 1 12 GLU H 1 34 LEU MD2 4.470 . 4.470 4.098 3.804 4.369 . 0 0 "[ . 1]" 1
233 1 12 GLU H 1 49 PHE H 4.100 . 4.100 4.085 3.900 4.149 0.049 7 0 "[ . 1]" 1
234 1 12 GLU H 1 50 THR HA 3.770 . 3.770 3.835 3.706 3.936 0.166 1 0 "[ . 1]" 1
235 1 12 GLU HA 1 13 ARG H 3.350 . 3.350 2.315 2.192 2.567 . 0 0 "[ . 1]" 1
236 1 12 GLU HA 1 34 LEU MD2 4.310 . 4.310 3.526 3.058 3.949 . 0 0 "[ . 1]" 1
237 1 12 GLU QB 1 13 ARG H 3.310 . 3.310 2.876 2.142 3.321 0.011 5 0 "[ . 1]" 1
238 1 12 GLU QB 1 34 LEU MD2 4.010 . 4.010 2.065 1.815 2.451 . 0 0 "[ . 1]" 1
239 1 12 GLU QB 1 50 THR HA 4.550 . 4.550 4.508 3.937 4.695 0.145 3 0 "[ . 1]" 1
240 1 12 GLU QG 1 34 LEU MD2 3.790 . 3.790 2.217 1.702 3.587 0.098 9 0 "[ . 1]" 1
241 1 13 ARG H 1 27 ILE MD 4.950 . 4.950 5.076 5.004 5.212 0.262 8 0 "[ . 1]" 1
242 1 13 ARG H 1 86 ARG QD 4.470 . 4.470 3.275 1.872 4.558 0.088 7 0 "[ . 1]" 1
243 1 13 ARG H 1 86 ARG HG3 3.930 . 3.930 3.905 3.514 4.072 0.142 1 0 "[ . 1]" 1
244 1 13 ARG HA 1 13 ARG QD 4.500 . 4.500 4.093 3.792 4.445 . 0 0 "[ . 1]" 1
245 1 13 ARG HA 1 14 LEU H 3.210 . 3.210 2.221 2.139 2.330 . 0 0 "[ . 1]" 1
246 1 13 ARG HA 1 27 ILE MD 4.050 . 4.050 3.281 2.934 3.626 . 0 0 "[ . 1]" 1
247 1 13 ARG HA 1 54 PHE QD 4.790 . 4.790 4.569 3.754 4.949 0.159 5 0 "[ . 1]" 1
248 1 13 ARG HB2 1 13 ARG QD 3.620 . 3.620 2.660 2.336 3.359 . 0 0 "[ . 1]" 1
249 1 13 ARG HB2 1 54 PHE QD 3.900 . 3.900 2.767 2.409 3.240 . 0 0 "[ . 1]" 1
250 1 13 ARG HB3 1 13 ARG QD 3.860 . 3.860 2.721 2.143 3.267 . 0 0 "[ . 1]" 1
251 1 13 ARG HB3 1 13 ARG HH12 3.770 . 3.770 3.836 3.470 3.978 0.208 3 0 "[ . 1]" 1
252 1 13 ARG HB3 1 54 PHE QD 3.540 . 3.540 3.678 3.649 3.717 0.177 10 0 "[ . 1]" 1
253 1 13 ARG HB3 1 86 ARG QD 4.540 . 4.540 3.012 1.734 4.647 0.107 5 0 "[ . 1]" 1
254 1 13 ARG QD 1 14 LEU H 5.120 . 5.120 4.242 3.581 5.028 . 0 0 "[ . 1]" 1
255 1 13 ARG QD 1 54 PHE QD 5.340 . 5.340 3.415 1.978 4.468 . 0 0 "[ . 1]" 1
256 1 13 ARG HE 1 54 PHE QB 4.130 . 4.130 3.233 2.421 4.180 0.050 10 0 "[ . 1]" 1
257 1 13 ARG HH11 1 86 ARG HG2 4.140 . 4.140 4.082 3.281 4.376 0.236 5 0 "[ . 1]" 1
258 1 13 ARG HH12 1 85 SER H 5.440 . 5.440 5.584 5.508 5.694 0.254 4 0 "[ . 1]" 1
259 1 13 ARG HH12 1 86 ARG H 4.600 . 4.600 3.798 3.608 4.162 . 0 0 "[ . 1]" 1
260 1 13 ARG HH12 1 86 ARG QD 4.800 . 4.800 2.347 1.998 3.773 . 0 0 "[ . 1]" 1
261 1 13 ARG HH12 1 86 ARG HG2 4.350 . 4.350 3.593 3.076 4.108 . 0 0 "[ . 1]" 1
262 1 14 LEU H 1 14 LEU QD 4.250 . 4.250 2.655 2.075 3.491 . 0 0 "[ . 1]" 1
263 1 14 LEU H 1 15 SER H 4.300 . 4.300 4.388 4.088 4.484 0.184 1 0 "[ . 1]" 1
264 1 14 LEU H 1 27 ILE MD 3.920 . 3.920 2.611 2.184 3.458 . 0 0 "[ . 1]" 1
265 1 14 LEU H 1 30 GLN HE22 5.150 . 5.150 3.908 3.521 4.315 . 0 0 "[ . 1]" 1
266 1 14 LEU HA 1 14 LEU QD 3.090 . 3.090 2.608 2.003 2.894 . 0 0 "[ . 1]" 1
267 1 14 LEU HA 1 15 SER H 3.130 . 3.130 2.184 2.137 2.246 . 0 0 "[ . 1]" 1
268 1 14 LEU HA 1 15 SER QB 4.230 . 4.230 4.091 3.980 4.256 0.026 9 0 "[ . 1]" 1
269 1 14 LEU HB2 1 14 LEU HG 2.710 . 2.710 2.392 2.291 2.470 . 0 0 "[ . 1]" 1
270 1 14 LEU HB2 1 15 SER H 4.520 . 4.520 3.563 3.166 4.109 . 0 0 "[ . 1]" 1
271 1 14 LEU HB2 1 25 ASN HA 4.280 . 4.280 3.724 2.823 4.328 0.048 1 0 "[ . 1]" 1
272 1 14 LEU HB2 1 30 GLN H 4.550 . 4.550 4.662 4.578 4.766 0.216 1 0 "[ . 1]" 1
273 1 14 LEU HB2 1 30 GLN HE21 5.120 . 5.120 3.506 2.414 4.444 . 0 0 "[ . 1]" 1
274 1 14 LEU HB2 1 30 GLN HE22 4.320 . 4.320 3.911 3.335 4.369 0.049 8 0 "[ . 1]" 1
275 1 14 LEU HB3 1 15 SER H 5.060 . 5.060 4.353 4.249 4.447 . 0 0 "[ . 1]" 1
276 1 14 LEU HB3 1 27 ILE MD 4.230 . 4.230 2.217 1.763 3.640 0.037 2 0 "[ . 1]" 1
277 1 14 LEU HB3 1 30 GLN H 4.920 . 4.920 4.974 4.791 5.053 0.133 2 0 "[ . 1]" 1
278 1 14 LEU HB3 1 30 GLN HE21 5.200 . 5.200 3.067 2.118 3.915 . 0 0 "[ . 1]" 1
279 1 14 LEU HB3 1 30 GLN HE22 3.690 . 3.690 2.874 2.371 3.378 . 0 0 "[ . 1]" 1
280 1 14 LEU QD 1 15 SER H 3.410 . 3.410 2.112 1.960 2.313 . 0 0 "[ . 1]" 1
281 1 14 LEU QD 1 18 ASP H 4.470 . 4.470 4.297 3.914 4.554 0.084 7 0 "[ . 1]" 1
282 1 14 LEU QD 1 18 ASP HB2 4.170 . 4.170 4.264 4.205 4.342 0.172 1 0 "[ . 1]" 1
283 1 14 LEU QD 1 25 ASN H 4.480 . 4.480 4.170 3.995 4.368 . 0 0 "[ . 1]" 1
284 1 14 LEU QD 1 25 ASN HA 4.680 . 4.680 1.957 1.717 2.289 0.083 7 0 "[ . 1]" 1
285 1 14 LEU QD 1 25 ASN HB2 4.090 . 4.090 3.286 1.753 4.115 0.047 6 0 "[ . 1]" 1
286 1 14 LEU QD 1 25 ASN HB3 4.570 . 4.570 3.272 1.739 4.382 0.061 2 0 "[ . 1]" 1
287 1 14 LEU QD 1 26 SER HA 4.500 . 4.500 2.909 2.157 3.457 . 0 0 "[ . 1]" 1
288 1 14 LEU QD 1 30 GLN HE21 4.510 . 4.510 4.341 3.843 4.639 0.129 5 0 "[ . 1]" 1
289 1 14 LEU QD 1 30 GLN HE22 4.960 . 4.960 4.133 3.849 4.413 . 0 0 "[ . 1]" 1
290 1 14 LEU HG 1 15 SER H 4.580 . 4.580 4.598 4.485 4.693 0.113 5 0 "[ . 1]" 1
291 1 14 LEU HG 1 26 SER H 5.370 . 5.370 2.300 1.820 3.243 . 0 0 "[ . 1]" 1
292 1 14 LEU HG 1 26 SER HA 3.100 . 3.100 3.039 2.485 3.338 0.238 5 0 "[ . 1]" 1
293 1 14 LEU HG 1 27 ILE H 3.950 . 3.950 2.889 1.939 4.004 0.054 1 0 "[ . 1]" 1
294 1 15 SER H 1 15 SER QB 3.640 . 3.640 2.318 2.244 2.389 . 0 0 "[ . 1]" 1
295 1 15 SER HA 1 16 ARG QB 4.530 . 4.530 4.083 3.978 4.468 . 0 0 "[ . 1]" 1
296 1 15 SER HA 1 18 ASP H 4.880 . 4.880 4.874 4.741 4.968 0.088 3 0 "[ . 1]" 1
297 1 15 SER QB 1 18 ASP H 4.050 . 4.050 3.333 2.735 3.909 . 0 0 "[ . 1]" 1
298 1 16 ARG H 1 16 ARG QB 3.880 . 3.880 2.199 2.071 2.504 . 0 0 "[ . 1]" 1
299 1 16 ARG H 1 16 ARG QG 4.900 . 4.900 3.513 2.410 4.004 . 0 0 "[ . 1]" 1
300 1 16 ARG H 1 17 ASP H 4.180 . 4.180 2.539 2.517 2.561 . 0 0 "[ . 1]" 1
301 1 16 ARG HA 1 16 ARG QB 2.440 . 2.440 2.460 2.325 2.530 0.090 10 0 "[ . 1]" 1
302 1 16 ARG HA 1 16 ARG QD 3.300 . 3.300 2.818 1.922 3.367 0.067 6 0 "[ . 1]" 1
303 1 16 ARG HA 1 16 ARG QG 2.900 . 2.900 2.353 2.026 2.984 0.084 4 0 "[ . 1]" 1
304 1 16 ARG HA 1 18 ASP H 5.030 . 5.030 3.753 3.515 4.183 . 0 0 "[ . 1]" 1
305 1 16 ARG QB 1 16 ARG QG 2.470 . 2.470 2.016 1.969 2.039 . 0 0 "[ . 1]" 1
306 1 16 ARG QG 1 17 ASP H 4.910 . 4.910 4.565 4.089 4.802 . 0 0 "[ . 1]" 1
307 1 17 ASP H 1 17 ASP HB2 3.490 . 3.490 2.738 2.183 3.524 0.034 2 0 "[ . 1]" 1
308 1 17 ASP H 1 18 ASP H 3.870 . 3.870 2.444 2.308 2.519 . 0 0 "[ . 1]" 1
309 1 17 ASP H 1 18 ASP HB2 5.250 . 5.250 4.811 4.470 5.138 . 0 0 "[ . 1]" 1
310 1 17 ASP H 1 20 LEU QD 4.590 . 4.590 4.722 4.264 4.886 0.296 7 0 "[ . 1]" 1
311 1 17 ASP HA 1 17 ASP HB2 3.050 . 3.050 2.941 2.630 3.027 . 0 0 "[ . 1]" 1
312 1 17 ASP HB2 1 18 ASP H 3.540 . 3.540 3.345 3.061 3.692 0.152 2 0 "[ . 1]" 1
313 1 18 ASP H 1 18 ASP HB2 3.680 . 3.680 2.676 2.229 3.169 . 0 0 "[ . 1]" 1
314 1 18 ASP H 1 20 LEU HG 5.490 . 5.490 5.152 4.647 5.731 0.241 5 0 "[ . 1]" 1
315 1 18 ASP HA 1 18 ASP HB2 2.960 . 2.960 2.774 2.394 3.012 0.052 6 0 "[ . 1]" 1
316 1 18 ASP HA 1 19 ASP H 3.240 . 3.240 2.505 2.337 2.788 . 0 0 "[ . 1]" 1
317 1 18 ASP HA 1 19 ASP HB3 5.500 . 5.500 5.190 4.613 5.518 0.018 8 0 "[ . 1]" 1
318 1 18 ASP HA 1 20 LEU QD 4.220 . 4.220 2.932 1.655 4.030 0.145 5 0 "[ . 1]" 1
319 1 18 ASP HB2 1 19 ASP H 4.470 . 4.470 4.108 3.468 4.604 0.134 8 0 "[ . 1]" 1
320 1 18 ASP HB2 1 20 LEU QD 4.010 . 4.010 2.803 1.661 4.127 0.139 1 0 "[ . 1]" 1
321 1 18 ASP HB2 1 21 THR MG 4.780 . 4.780 4.865 4.755 5.007 0.227 7 0 "[ . 1]" 1
322 1 18 ASP HB3 1 19 ASP H 4.320 . 4.320 3.396 2.180 4.401 0.081 9 0 "[ . 1]" 1
323 1 18 ASP HB3 1 20 LEU QD 4.460 . 4.460 3.262 2.253 4.507 0.047 4 0 "[ . 1]" 1
324 1 19 ASP H 1 19 ASP HA 2.800 . 2.800 2.889 2.826 2.919 0.119 1 0 "[ . 1]" 1
325 1 19 ASP H 1 19 ASP HB2 3.700 . 3.700 2.986 2.161 3.689 . 0 0 "[ . 1]" 1
326 1 19 ASP H 1 19 ASP HB3 3.300 . 3.300 2.895 2.611 3.147 . 0 0 "[ . 1]" 1
327 1 19 ASP HA 1 19 ASP HB3 2.930 . 2.930 2.687 2.356 3.012 0.082 5 0 "[ . 1]" 1
328 1 19 ASP HA 1 20 LEU H 3.290 . 3.290 3.155 3.063 3.402 0.112 7 0 "[ . 1]" 1
329 1 20 LEU H 1 20 LEU HB2 3.730 . 3.730 3.441 3.134 3.748 0.018 3 0 "[ . 1]" 1
330 1 20 LEU H 1 20 LEU HB3 3.790 . 3.790 3.350 2.890 3.710 . 0 0 "[ . 1]" 1
331 1 20 LEU H 1 20 LEU QD 3.590 . 3.590 2.040 1.675 2.555 0.125 5 0 "[ . 1]" 1
332 1 20 LEU H 1 20 LEU HG 4.760 . 4.760 2.428 1.784 3.812 0.016 2 0 "[ . 1]" 1
333 1 20 LEU HA 1 20 LEU QD 3.780 . 3.780 3.259 2.820 3.429 . 0 0 "[ . 1]" 1
334 1 20 LEU HA 1 21 THR H 3.540 . 3.540 3.157 2.200 3.560 0.020 3 0 "[ . 1]" 1
335 1 20 LEU HB2 1 20 LEU QD 3.270 . 3.270 2.122 2.024 2.255 . 0 0 "[ . 1]" 1
336 1 20 LEU HB3 1 20 LEU QD 3.130 . 3.130 2.196 2.091 2.305 . 0 0 "[ . 1]" 1
337 1 20 LEU HB3 1 21 THR H 4.320 . 4.320 3.912 3.470 4.196 . 0 0 "[ . 1]" 1
338 1 20 LEU QD 1 21 THR H 4.150 . 4.150 2.533 1.750 4.069 0.050 1 0 "[ . 1]" 1
339 1 20 LEU QD 1 24 SER QB 4.180 . 4.180 2.585 1.774 4.130 0.026 1 0 "[ . 1]" 1
340 1 20 LEU QD 1 25 ASN H 5.500 . 5.500 3.899 3.234 4.807 . 0 0 "[ . 1]" 1
341 1 20 LEU QD 1 25 ASN HA 4.480 . 4.480 3.371 2.876 3.920 . 0 0 "[ . 1]" 1
342 1 20 LEU QD 1 25 ASN HB2 3.970 . 3.970 3.283 2.157 4.134 0.164 3 0 "[ . 1]" 1
343 1 20 LEU QD 1 25 ASN HB3 4.080 . 4.080 2.605 1.825 3.847 . 0 0 "[ . 1]" 1
344 1 20 LEU QD 1 25 ASN HD21 4.320 . 4.320 3.784 2.934 4.344 0.024 9 0 "[ . 1]" 1
345 1 20 LEU QD 1 25 ASN HD22 5.480 . 5.480 4.071 1.795 5.491 0.011 9 0 "[ . 1]" 1
346 1 21 THR H 1 21 THR MG 4.240 . 4.240 3.041 2.362 3.791 . 0 0 "[ . 1]" 1
347 1 21 THR H 1 25 ASN HD21 5.500 . 5.500 4.221 3.180 4.973 . 0 0 "[ . 1]" 1
348 1 21 THR HA 1 21 THR HB 2.850 . 2.850 2.582 2.303 2.962 0.112 3 0 "[ . 1]" 1
349 1 21 THR HA 1 21 THR MG 2.820 . 2.820 2.328 2.124 2.625 . 0 0 "[ . 1]" 1
350 1 21 THR HA 1 22 GLY H 3.490 . 3.490 2.249 2.108 2.583 . 0 0 "[ . 1]" 1
351 1 21 THR HA 1 25 ASN HB3 3.410 . 3.410 3.184 2.487 3.501 0.091 3 0 "[ . 1]" 1
352 1 21 THR MG 1 22 GLY H 5.100 . 5.100 3.782 2.348 4.384 . 0 0 "[ . 1]" 1
353 1 22 GLY HA2 1 25 ASN HD21 3.940 . 3.940 3.954 3.820 4.110 0.170 7 0 "[ . 1]" 1
354 1 23 GLU HA 1 23 GLU QB 2.650 . 2.650 2.298 2.155 2.483 . 0 0 "[ . 1]" 1
355 1 23 GLU HA 1 23 GLU QG 2.840 . 2.840 2.645 2.158 3.000 0.160 8 0 "[ . 1]" 1
356 1 23 GLU HA 1 29 ASN HB2 3.810 . 3.810 3.874 3.730 3.954 0.144 6 0 "[ . 1]" 1
357 1 23 GLU HA 1 29 ASN HB3 3.510 . 3.510 3.127 2.572 3.553 0.043 3 0 "[ . 1]" 1
358 1 23 GLU HA 1 29 ASN HD21 4.600 . 4.600 2.549 1.896 3.680 . 0 0 "[ . 1]" 1
359 1 23 GLU HA 1 29 ASN HD22 3.800 . 3.800 3.187 2.156 3.798 . 0 0 "[ . 1]" 1
360 1 23 GLU QB 1 29 ASN HD21 5.030 . 5.030 3.618 2.025 4.735 . 0 0 "[ . 1]" 1
361 1 23 GLU QG 1 29 ASN HD21 5.460 . 5.460 3.039 2.003 4.711 . 0 0 "[ . 1]" 1
362 1 23 GLU QG 1 33 TYR HB2 4.030 . 4.030 3.992 3.662 4.133 0.103 7 0 "[ . 1]" 1
363 1 23 GLU QG 1 33 TYR QD 4.120 . 4.120 4.045 3.612 4.179 0.059 5 0 "[ . 1]" 1
364 1 24 SER HA 1 24 SER QB 2.530 . 2.530 2.343 2.148 2.532 0.002 4 0 "[ . 1]" 1
365 1 24 SER HA 1 25 ASN HA 4.580 . 4.580 4.523 4.439 4.605 0.025 4 0 "[ . 1]" 1
366 1 24 SER QB 1 25 ASN H 4.680 . 4.680 3.532 3.049 3.945 . 0 0 "[ . 1]" 1
367 1 24 SER QB 1 25 ASN HD21 5.500 . 5.500 4.346 3.385 5.191 . 0 0 "[ . 1]" 1
368 1 25 ASN H 1 25 ASN HB2 3.750 . 3.750 3.367 2.683 3.798 0.048 5 0 "[ . 1]" 1
369 1 25 ASN H 1 25 ASN HB3 4.020 . 4.020 3.090 2.441 3.955 . 0 0 "[ . 1]" 1
370 1 25 ASN H 1 25 ASN HD21 5.500 . 5.500 2.185 1.922 2.752 . 0 0 "[ . 1]" 1
371 1 25 ASN H 1 26 SER H 3.790 . 3.790 3.442 3.125 3.880 0.090 5 0 "[ . 1]" 1
372 1 25 ASN HA 1 25 ASN HD21 3.970 . 3.970 3.885 3.536 4.053 0.083 2 0 "[ . 1]" 1
373 1 25 ASN HA 1 26 SER H 3.390 . 3.390 2.516 2.206 2.862 . 0 0 "[ . 1]" 1
374 1 25 ASN HB2 1 25 ASN HD21 3.610 . 3.610 3.057 2.229 3.572 . 0 0 "[ . 1]" 1
375 1 25 ASN HB2 1 26 SER H 5.040 . 5.040 4.429 4.054 4.619 . 0 0 "[ . 1]" 1
376 1 26 SER H 1 26 SER HB2 3.750 . 3.750 3.310 2.900 3.755 0.005 8 0 "[ . 1]" 1
377 1 26 SER H 1 26 SER HB3 3.990 . 3.990 3.940 3.827 4.010 0.020 7 0 "[ . 1]" 1
378 1 26 SER H 1 30 GLN HE22 5.400 . 5.400 5.443 5.111 5.574 0.174 4 0 "[ . 1]" 1
379 1 26 SER HA 1 27 ILE H 3.400 . 3.400 2.718 2.125 3.499 0.099 5 0 "[ . 1]" 1
380 1 26 SER HA 1 27 ILE QG 4.190 . 4.190 4.124 4.005 4.242 0.052 5 0 "[ . 1]" 1
381 1 26 SER HB2 1 27 ILE H 4.600 . 4.600 3.477 2.333 4.150 . 0 0 "[ . 1]" 1
382 1 26 SER HB2 1 27 ILE HB 5.340 . 5.340 5.244 4.986 5.503 0.163 10 0 "[ . 1]" 1
383 1 26 SER HB3 1 27 ILE H 4.220 . 4.220 3.410 1.917 4.362 0.142 2 0 "[ . 1]" 1
384 1 26 SER HB3 1 28 THR H 4.670 . 4.670 4.088 2.879 4.702 0.032 4 0 "[ . 1]" 1
385 1 27 ILE H 1 27 ILE HB 3.690 . 3.690 2.825 2.211 3.528 . 0 0 "[ . 1]" 1
386 1 27 ILE H 1 27 ILE MD 5.450 . 5.450 3.652 3.034 4.451 . 0 0 "[ . 1]" 1
387 1 27 ILE H 1 27 ILE QG 4.750 . 4.750 2.989 2.391 3.966 . 0 0 "[ . 1]" 1
388 1 27 ILE H 1 27 ILE MG 4.320 . 4.320 3.845 3.609 4.111 . 0 0 "[ . 1]" 1
389 1 27 ILE H 1 28 THR H 4.530 . 4.530 3.224 2.613 4.117 . 0 0 "[ . 1]" 1
390 1 27 ILE HA 1 27 ILE MD 3.150 . 3.150 1.995 1.842 2.234 . 0 0 "[ . 1]" 1
391 1 27 ILE HA 1 27 ILE MG 3.390 . 3.390 2.608 2.541 2.749 . 0 0 "[ . 1]" 1
392 1 27 ILE HA 1 30 GLN H 4.170 . 4.170 3.957 3.793 4.127 . 0 0 "[ . 1]" 1
393 1 27 ILE HA 1 30 GLN HE21 4.120 . 4.120 2.598 1.953 3.524 . 0 0 "[ . 1]" 1
394 1 27 ILE HA 1 30 GLN HE22 3.900 . 3.900 1.952 1.766 2.195 0.034 9 0 "[ . 1]" 1
395 1 27 ILE HB 1 28 THR H 3.740 . 3.740 2.350 1.993 2.723 . 0 0 "[ . 1]" 1
396 1 27 ILE HB 1 30 GLN HE22 4.810 . 4.810 4.701 4.326 4.950 0.140 6 0 "[ . 1]" 1
397 1 27 ILE MD 1 27 ILE MG 3.280 . 3.280 2.102 1.849 2.333 . 0 0 "[ . 1]" 1
398 1 27 ILE MD 1 30 GLN HE21 4.860 . 4.860 3.268 2.886 3.590 . 0 0 "[ . 1]" 1
399 1 27 ILE MD 1 30 GLN HE22 4.560 . 4.560 2.196 1.972 2.321 . 0 0 "[ . 1]" 1
400 1 27 ILE MD 1 51 ASP H 3.970 . 3.970 2.546 2.294 3.006 . 0 0 "[ . 1]" 1
401 1 27 ILE MD 1 52 ASP HA 3.770 . 3.770 3.786 3.683 3.870 0.100 2 0 "[ . 1]" 1
402 1 27 ILE MD 1 53 GLY H 5.050 . 5.050 5.147 5.093 5.186 0.136 5 0 "[ . 1]" 1
403 1 27 ILE QG 1 51 ASP H 4.490 . 4.490 4.394 4.018 4.706 0.216 2 0 "[ . 1]" 1
404 1 27 ILE QG 1 52 ASP HB2 4.770 . 4.770 4.481 4.074 4.826 0.056 8 0 "[ . 1]" 1
405 1 27 ILE MG 1 28 THR H 3.630 . 3.630 2.355 2.076 2.565 . 0 0 "[ . 1]" 1
406 1 27 ILE MG 1 28 THR HA 3.700 . 3.700 2.948 2.800 3.018 . 0 0 "[ . 1]" 1
407 1 27 ILE MG 1 28 THR HB 3.410 . 3.410 3.350 3.093 3.499 0.089 4 0 "[ . 1]" 1
408 1 27 ILE MG 1 30 GLN H 5.500 . 5.500 5.022 4.874 5.138 . 0 0 "[ . 1]" 1
409 1 27 ILE MG 1 31 LYS HE3 3.880 . 3.880 3.537 2.713 3.964 0.084 2 0 "[ . 1]" 1
410 1 28 THR H 1 28 THR HB 3.220 . 3.220 2.084 2.042 2.153 . 0 0 "[ . 1]" 1
411 1 28 THR H 1 28 THR MG 3.570 . 3.570 3.060 2.688 3.327 . 0 0 "[ . 1]" 1
412 1 28 THR H 1 29 ASN H 4.140 . 4.140 2.769 2.621 2.840 . 0 0 "[ . 1]" 1
413 1 28 THR HA 1 28 THR HB 2.760 . 2.760 2.748 2.613 2.839 0.079 2 0 "[ . 1]" 1
414 1 28 THR HA 1 28 THR MG 2.950 . 2.950 3.077 2.978 3.159 0.209 3 0 "[ . 1]" 1
415 1 28 THR HA 1 31 LYS H 4.210 . 4.210 3.447 3.333 3.568 . 0 0 "[ . 1]" 1
416 1 28 THR HA 1 31 LYS HB2 3.720 . 3.720 2.570 2.139 2.756 . 0 0 "[ . 1]" 1
417 1 28 THR HA 1 31 LYS HB3 4.830 . 4.830 3.826 3.472 4.004 . 0 0 "[ . 1]" 1
418 1 28 THR HA 1 31 LYS HD2 3.760 . 3.760 3.851 3.790 3.887 0.127 4 0 "[ . 1]" 1
419 1 28 THR HA 1 31 LYS HE2 4.330 . 4.330 2.179 1.780 4.332 0.020 2 0 "[ . 1]" 1
420 1 28 THR HA 1 31 LYS HE3 4.430 . 4.430 3.320 3.147 3.480 . 0 0 "[ . 1]" 1
421 1 28 THR HA 1 31 LYS HG2 4.180 . 4.180 3.526 3.427 3.611 . 0 0 "[ . 1]" 1
422 1 28 THR HA 1 31 LYS HG3 3.580 . 3.580 1.795 1.728 1.863 0.072 2 0 "[ . 1]" 1
423 1 28 THR HA 1 32 LYS H 4.240 . 4.240 4.200 3.850 4.287 0.047 2 0 "[ . 1]" 1
424 1 28 THR HB 1 29 ASN H 3.620 . 3.620 3.578 3.276 3.733 0.113 3 0 "[ . 1]" 1
425 1 28 THR MG 1 29 ASN H 4.390 . 4.390 2.455 2.170 2.711 . 0 0 "[ . 1]" 1
426 1 28 THR MG 1 29 ASN HA 3.770 . 3.770 2.986 2.883 3.056 . 0 0 "[ . 1]" 1
427 1 28 THR MG 1 29 ASN HB2 4.670 . 4.670 3.983 3.293 4.533 . 0 0 "[ . 1]" 1
428 1 28 THR MG 1 29 ASN HB3 4.950 . 4.950 4.615 4.481 4.767 . 0 0 "[ . 1]" 1
429 1 28 THR MG 1 32 LYS H 5.500 . 5.500 4.315 3.944 4.640 . 0 0 "[ . 1]" 1
430 1 28 THR MG 1 32 LYS QB 5.300 . 5.300 4.140 3.639 4.517 . 0 0 "[ . 1]" 1
431 1 28 THR MG 1 32 LYS QD 3.970 . 3.970 3.155 2.063 3.987 0.017 4 0 "[ . 1]" 1
432 1 28 THR MG 1 32 LYS QE 3.910 . 3.910 2.733 1.825 3.929 0.019 10 0 "[ . 1]" 1
433 1 29 ASN H 1 29 ASN HB2 3.690 . 3.690 2.352 2.149 2.664 . 0 0 "[ . 1]" 1
434 1 29 ASN H 1 29 ASN HB3 3.540 . 3.540 3.482 3.112 3.599 0.059 1 0 "[ . 1]" 1
435 1 29 ASN H 1 30 GLN H 3.760 . 3.760 2.888 2.792 3.011 . 0 0 "[ . 1]" 1
436 1 29 ASN HA 1 32 LYS H 3.550 . 3.550 3.550 3.469 3.617 0.067 3 0 "[ . 1]" 1
437 1 29 ASN HA 1 32 LYS QB 3.220 . 3.220 2.931 2.783 3.103 . 0 0 "[ . 1]" 1
438 1 29 ASN HA 1 33 TYR H 5.200 . 5.200 4.567 4.480 4.638 . 0 0 "[ . 1]" 1
439 1 29 ASN HB2 1 29 ASN HD22 4.000 . 4.000 3.835 3.435 4.075 0.075 4 0 "[ . 1]" 1
440 1 29 ASN HB3 1 30 GLN H 3.860 . 3.860 3.129 2.465 3.503 . 0 0 "[ . 1]" 1
441 1 30 GLN H 1 30 GLN QB 3.730 . 3.730 2.630 2.056 3.054 . 0 0 "[ . 1]" 1
442 1 30 GLN H 1 31 LYS H 3.750 . 3.750 2.647 2.578 2.728 . 0 0 "[ . 1]" 1
443 1 30 GLN HA 1 33 TYR HB2 3.300 . 3.300 2.405 2.164 2.593 . 0 0 "[ . 1]" 1
444 1 30 GLN HA 1 33 TYR HB3 3.730 . 3.730 2.780 2.653 2.978 . 0 0 "[ . 1]" 1
445 1 30 GLN HE22 1 30 GLN QG 3.650 . 3.650 3.372 3.284 3.456 . 0 0 "[ . 1]" 1
446 1 30 GLN HE22 1 31 LYS HA 5.200 . 5.200 5.311 5.242 5.371 0.171 1 0 "[ . 1]" 1
447 1 30 GLN HE22 1 31 LYS HG2 3.660 . 3.660 3.625 3.492 3.684 0.024 5 0 "[ . 1]" 1
448 1 31 LYS H 1 31 LYS HB2 3.590 . 3.590 2.618 2.426 2.713 . 0 0 "[ . 1]" 1
449 1 31 LYS H 1 31 LYS HB3 3.540 . 3.540 3.602 3.582 3.617 0.077 8 0 "[ . 1]" 1
450 1 31 LYS H 1 31 LYS HD3 4.680 . 4.680 4.677 4.587 4.719 0.039 1 0 "[ . 1]" 1
451 1 31 LYS H 1 31 LYS HG2 4.100 . 4.100 2.589 2.442 2.718 . 0 0 "[ . 1]" 1
452 1 31 LYS H 1 31 LYS HG3 3.420 . 3.420 2.578 2.377 3.037 . 0 0 "[ . 1]" 1
453 1 31 LYS H 1 32 LYS H 3.540 . 3.540 2.763 2.688 2.832 . 0 0 "[ . 1]" 1
454 1 31 LYS HA 1 31 LYS HG2 3.630 . 3.630 2.491 2.425 2.554 . 0 0 "[ . 1]" 1
455 1 31 LYS HA 1 48 HIS HE1 3.330 . 3.330 3.352 3.051 3.505 0.175 5 0 "[ . 1]" 1
456 1 31 LYS HB2 1 31 LYS HE3 4.020 . 4.020 3.915 3.543 4.059 0.039 3 0 "[ . 1]" 1
457 1 31 LYS HB2 1 32 LYS H 4.040 . 4.040 2.333 2.229 2.483 . 0 0 "[ . 1]" 1
458 1 31 LYS HB2 1 48 HIS HE1 4.210 . 4.210 4.007 3.819 4.241 0.031 2 0 "[ . 1]" 1
459 1 31 LYS HB3 1 32 LYS H 3.750 . 3.750 3.506 3.401 3.604 . 0 0 "[ . 1]" 1
460 1 31 LYS HB3 1 48 HIS HB3 3.560 . 3.560 3.673 3.622 3.732 0.172 7 0 "[ . 1]" 1
461 1 31 LYS HB3 1 48 HIS HE1 3.310 . 3.310 2.847 2.667 3.089 . 0 0 "[ . 1]" 1
462 1 31 LYS HD2 1 48 HIS HE1 4.810 . 4.810 4.354 4.140 4.636 . 0 0 "[ . 1]" 1
463 1 31 LYS HE2 1 31 LYS HG3 3.560 . 3.560 2.096 1.946 2.735 . 0 0 "[ . 1]" 1
464 1 31 LYS HE3 1 48 HIS HB2 4.580 . 4.580 4.626 4.591 4.690 0.110 2 0 "[ . 1]" 1
465 1 31 LYS HG2 1 32 LYS H 5.170 . 5.170 4.500 4.420 4.570 . 0 0 "[ . 1]" 1
466 1 32 LYS H 1 32 LYS QB 2.980 . 2.980 2.153 2.036 2.423 . 0 0 "[ . 1]" 1
467 1 32 LYS H 1 33 TYR H 3.320 . 3.320 2.700 2.602 2.771 . 0 0 "[ . 1]" 1
468 1 32 LYS H 1 48 HIS HE1 4.250 . 4.250 4.338 4.262 4.384 0.134 2 0 "[ . 1]" 1
469 1 32 LYS HA 1 32 LYS QB 2.630 . 2.630 2.495 2.386 2.542 . 0 0 "[ . 1]" 1
470 1 32 LYS HA 1 32 LYS QE 4.190 . 4.190 3.859 2.849 4.232 0.042 4 0 "[ . 1]" 1
471 1 32 LYS HA 1 32 LYS HG2 3.120 . 3.120 2.950 2.567 3.256 0.136 3 0 "[ . 1]" 1
472 1 32 LYS HA 1 32 LYS HG3 2.620 . 2.620 2.292 1.985 2.636 0.016 9 0 "[ . 1]" 1
473 1 32 LYS HA 1 33 TYR H 3.510 . 3.510 3.530 3.509 3.548 0.038 9 0 "[ . 1]" 1
474 1 32 LYS HA 1 35 GLU H 3.730 . 3.730 3.408 3.261 3.558 . 0 0 "[ . 1]" 1
475 1 32 LYS HA 1 36 ASP H 4.120 . 4.120 3.926 3.870 4.057 . 0 0 "[ . 1]" 1
476 1 32 LYS QB 1 32 LYS QD 3.450 . 3.450 2.233 1.918 2.595 . 0 0 "[ . 1]" 1
477 1 32 LYS QB 1 33 TYR H 3.360 . 3.360 2.787 2.612 2.950 . 0 0 "[ . 1]" 1
478 1 32 LYS QB 1 33 TYR HA 4.600 . 4.600 3.862 3.773 3.945 . 0 0 "[ . 1]" 1
479 1 32 LYS QE 1 32 LYS HG2 3.480 . 3.480 3.104 2.614 3.454 . 0 0 "[ . 1]" 1
480 1 32 LYS QE 1 32 LYS HG3 3.450 . 3.450 2.599 2.105 3.439 . 0 0 "[ . 1]" 1
481 1 32 LYS HG2 1 33 TYR H 5.500 . 5.500 5.189 4.892 5.422 . 0 0 "[ . 1]" 1
482 1 33 TYR H 1 33 TYR HB2 3.210 . 3.210 2.438 2.372 2.495 . 0 0 "[ . 1]" 1
483 1 33 TYR H 1 33 TYR HB3 3.080 . 3.080 2.667 2.619 2.726 . 0 0 "[ . 1]" 1
484 1 33 TYR HA 1 33 TYR HB2 2.680 . 2.680 2.514 2.483 2.548 . 0 0 "[ . 1]" 1
485 1 33 TYR HA 1 33 TYR QD 2.950 . 2.950 2.745 2.627 2.900 . 0 0 "[ . 1]" 1
486 1 33 TYR HA 1 36 ASP H 4.420 . 4.420 3.564 3.496 3.613 . 0 0 "[ . 1]" 1
487 1 33 TYR HA 1 36 ASP HB2 3.930 . 3.930 3.066 2.820 3.264 . 0 0 "[ . 1]" 1
488 1 33 TYR HA 1 36 ASP HB3 3.650 . 3.650 3.660 3.554 3.712 0.062 2 0 "[ . 1]" 1
489 1 33 TYR HA 1 37 TYR H 4.770 . 4.770 4.725 4.678 4.788 0.018 10 0 "[ . 1]" 1
490 1 33 TYR HB2 1 34 LEU H 3.560 . 3.560 3.527 3.472 3.602 0.042 9 0 "[ . 1]" 1
491 1 33 TYR HB2 1 34 LEU MD2 5.030 . 5.030 5.152 4.797 5.291 0.261 10 0 "[ . 1]" 1
492 1 33 TYR HB3 1 34 LEU H 3.720 . 3.720 2.039 1.978 2.104 . 0 0 "[ . 1]" 1
493 1 33 TYR HB3 1 34 LEU MD1 4.670 . 4.670 2.294 2.133 2.425 . 0 0 "[ . 1]" 1
494 1 33 TYR QD 1 34 LEU H 3.840 . 3.840 2.978 2.886 3.081 . 0 0 "[ . 1]" 1
495 1 33 TYR QD 1 34 LEU HA 3.590 . 3.590 3.209 3.021 3.412 . 0 0 "[ . 1]" 1
496 1 33 TYR QD 1 34 LEU HB3 5.110 . 5.110 4.998 4.905 5.080 . 0 0 "[ . 1]" 1
497 1 33 TYR QD 1 34 LEU MD1 3.220 . 3.220 1.731 1.690 1.779 0.110 10 0 "[ . 1]" 1
498 1 33 TYR QD 1 34 LEU HG 5.120 . 5.120 4.298 4.221 4.355 . 0 0 "[ . 1]" 1
499 1 33 TYR QD 1 82 LYS HA 3.880 . 3.880 4.025 3.896 4.151 0.271 6 0 "[ . 1]" 1
500 1 33 TYR QD 1 82 LYS HE2 4.130 . 4.130 3.814 3.385 4.142 0.012 1 0 "[ . 1]" 1
501 1 33 TYR QD 1 112 ILE MD 4.040 . 4.040 2.766 2.512 3.099 . 0 0 "[ . 1]" 1
502 1 33 TYR QE 1 34 LEU H 5.500 . 5.500 5.161 5.110 5.250 . 0 0 "[ . 1]" 1
503 1 33 TYR QE 1 34 LEU HA 4.320 . 4.320 4.509 4.437 4.555 0.235 8 0 "[ . 1]" 1
504 1 33 TYR QE 1 34 LEU MD1 3.880 . 3.880 3.096 2.999 3.248 . 0 0 "[ . 1]" 1
505 1 33 TYR QE 1 82 LYS HA 3.570 . 3.570 3.601 3.334 3.712 0.142 5 0 "[ . 1]" 1
506 1 33 TYR QE 1 82 LYS HD3 5.100 . 5.100 4.402 4.051 4.754 . 0 0 "[ . 1]" 1
507 1 33 TYR QE 1 82 LYS HE2 4.190 . 4.190 2.325 1.938 2.734 . 0 0 "[ . 1]" 1
508 1 33 TYR QE 1 82 LYS HE3 4.060 . 4.060 2.801 2.366 3.482 . 0 0 "[ . 1]" 1
509 1 33 TYR QE 1 82 LYS QG 3.850 . 3.850 3.386 2.554 3.784 . 0 0 "[ . 1]" 1
510 1 33 TYR QE 1 112 ILE HB 3.680 . 3.680 3.219 3.097 3.489 . 0 0 "[ . 1]" 1
511 1 33 TYR QE 1 112 ILE MD 3.530 . 3.530 1.769 1.746 1.790 0.054 8 0 "[ . 1]" 1
512 1 33 TYR QE 1 112 ILE HG12 4.770 . 4.770 3.244 2.841 3.626 . 0 0 "[ . 1]" 1
513 1 33 TYR QE 1 112 ILE MG 3.300 . 3.300 2.149 1.854 2.565 . 0 0 "[ . 1]" 1
514 1 34 LEU H 1 34 LEU HB2 4.000 . 4.000 2.423 2.315 2.718 . 0 0 "[ . 1]" 1
515 1 34 LEU H 1 34 LEU HB3 3.480 . 3.480 3.564 3.535 3.610 0.130 9 0 "[ . 1]" 1
516 1 34 LEU H 1 34 LEU MD1 3.810 . 3.810 1.985 1.837 2.123 . 0 0 "[ . 1]" 1
517 1 34 LEU H 1 34 LEU MD2 3.750 . 3.750 2.822 2.285 3.076 . 0 0 "[ . 1]" 1
518 1 34 LEU H 1 34 LEU HG 4.040 . 4.040 3.979 3.776 4.099 0.059 2 0 "[ . 1]" 1
519 1 34 LEU H 1 35 GLU H 3.770 . 3.770 2.705 2.657 2.789 . 0 0 "[ . 1]" 1
520 1 34 LEU HA 1 34 LEU MD1 3.030 . 3.030 1.901 1.822 1.992 . 0 0 "[ . 1]" 1
521 1 34 LEU HA 1 34 LEU MD2 3.910 . 3.910 3.809 3.783 3.845 . 0 0 "[ . 1]" 1
522 1 34 LEU HA 1 37 TYR H 4.040 . 4.040 3.287 3.184 3.386 . 0 0 "[ . 1]" 1
523 1 34 LEU HA 1 37 TYR HB2 3.850 . 3.850 3.436 3.220 3.686 . 0 0 "[ . 1]" 1
524 1 34 LEU HA 1 37 TYR HB3 4.080 . 4.080 2.529 2.471 2.634 . 0 0 "[ . 1]" 1
525 1 34 LEU HA 1 37 TYR QD 4.100 . 4.100 4.227 4.142 4.288 0.188 9 0 "[ . 1]" 1
526 1 34 LEU HA 1 38 ALA H 4.050 . 4.050 3.945 3.842 4.067 0.017 8 0 "[ . 1]" 1
527 1 34 LEU HA 1 80 ILE MG 4.050 . 4.050 2.833 2.659 2.972 . 0 0 "[ . 1]" 1
528 1 34 LEU HA 1 112 ILE MD 4.250 . 4.250 3.167 2.915 3.608 . 0 0 "[ . 1]" 1
529 1 34 LEU HB2 1 34 LEU MD2 3.110 . 3.110 2.068 1.885 2.154 . 0 0 "[ . 1]" 1
530 1 34 LEU HB2 1 35 GLU H 4.170 . 4.170 2.675 2.465 2.832 . 0 0 "[ . 1]" 1
531 1 34 LEU HB3 1 34 LEU MD1 3.050 . 3.050 3.036 2.874 3.088 0.038 2 0 "[ . 1]" 1
532 1 34 LEU HB3 1 34 LEU MD2 3.510 . 3.510 2.752 2.636 2.919 . 0 0 "[ . 1]" 1
533 1 34 LEU HB3 1 35 GLU H 4.350 . 4.350 3.564 3.401 3.785 . 0 0 "[ . 1]" 1
534 1 34 LEU HB3 1 37 TYR QD 5.460 . 5.460 4.597 4.471 4.757 . 0 0 "[ . 1]" 1
535 1 34 LEU HB3 1 80 ILE MG 3.700 . 3.700 1.890 1.758 2.188 0.042 3 0 "[ . 1]" 1
536 1 34 LEU MD1 1 35 GLU H 4.550 . 4.550 4.084 3.965 4.186 . 0 0 "[ . 1]" 1
537 1 34 LEU MD1 1 81 VAL HA 4.340 . 4.340 3.804 3.596 4.097 . 0 0 "[ . 1]" 1
538 1 34 LEU MD1 1 82 LYS H 4.000 . 4.000 3.174 2.979 3.544 . 0 0 "[ . 1]" 1
539 1 34 LEU MD1 1 82 LYS HA 3.590 . 3.590 2.709 2.294 3.211 . 0 0 "[ . 1]" 1
540 1 34 LEU MD1 1 112 ILE MD 3.930 . 3.930 2.257 1.881 2.789 . 0 0 "[ . 1]" 1
541 1 34 LEU MD2 1 35 GLU H 5.500 . 5.500 4.098 3.491 4.442 . 0 0 "[ . 1]" 1
542 1 34 LEU MD2 1 48 HIS HE1 4.730 . 4.730 4.487 3.971 4.846 0.116 2 0 "[ . 1]" 1
543 1 34 LEU MD2 1 81 VAL HA 4.530 . 4.530 3.242 2.408 4.278 . 0 0 "[ . 1]" 1
544 1 34 LEU MD2 1 82 LYS H 4.620 . 4.620 3.347 2.565 4.285 . 0 0 "[ . 1]" 1
545 1 34 LEU HG 1 82 LYS H 5.500 . 5.500 4.131 3.924 4.367 . 0 0 "[ . 1]" 1
546 1 35 GLU H 1 35 GLU QB 2.890 . 2.890 2.058 2.038 2.085 . 0 0 "[ . 1]" 1
547 1 35 GLU H 1 35 GLU HG3 3.870 . 3.870 3.737 3.341 3.994 0.124 8 0 "[ . 1]" 1
548 1 35 GLU H 1 48 HIS HE1 3.930 . 3.930 3.192 2.844 3.386 . 0 0 "[ . 1]" 1
549 1 35 GLU HA 1 35 GLU HG2 3.440 . 3.440 2.230 2.007 2.578 . 0 0 "[ . 1]" 1
550 1 35 GLU HA 1 35 GLU HG3 3.650 . 3.650 2.939 2.420 3.449 . 0 0 "[ . 1]" 1
551 1 35 GLU HA 1 36 ASP H 3.500 . 3.500 3.542 3.533 3.553 0.053 5 0 "[ . 1]" 1
552 1 35 GLU HA 1 38 ALA H 4.290 . 4.290 3.596 3.484 3.807 . 0 0 "[ . 1]" 1
553 1 35 GLU HA 1 38 ALA MB 3.400 . 3.400 2.839 2.523 3.146 . 0 0 "[ . 1]" 1
554 1 35 GLU HA 1 46 ILE MD 3.550 . 3.550 3.300 2.869 3.597 0.047 2 0 "[ . 1]" 1
555 1 35 GLU HA 1 46 ILE MG 3.380 . 3.380 3.145 2.613 3.323 . 0 0 "[ . 1]" 1
556 1 35 GLU HA 1 48 HIS HE1 4.060 . 4.060 3.938 3.517 4.114 0.054 8 0 "[ . 1]" 1
557 1 35 GLU QB 1 36 ASP H 3.410 . 3.410 2.482 2.385 2.577 . 0 0 "[ . 1]" 1
558 1 35 GLU QB 1 48 HIS HE1 2.840 . 2.840 2.638 2.109 2.874 0.034 9 0 "[ . 1]" 1
559 1 35 GLU HG2 1 46 ILE MD 3.860 . 3.860 3.242 2.961 3.788 . 0 0 "[ . 1]" 1
560 1 35 GLU HG2 1 48 HIS HE1 3.760 . 3.760 3.652 2.967 3.879 0.119 2 0 "[ . 1]" 1
561 1 35 GLU HG3 1 46 ILE MD 4.300 . 4.300 4.327 4.025 4.418 0.118 1 0 "[ . 1]" 1
562 1 35 GLU HG3 1 46 ILE MG 4.480 . 4.480 3.417 2.658 3.695 . 0 0 "[ . 1]" 1
563 1 35 GLU HG3 1 48 HIS HE1 3.290 . 3.290 2.404 2.097 2.740 . 0 0 "[ . 1]" 1
564 1 36 ASP H 1 36 ASP HA 2.850 . 2.850 2.771 2.755 2.792 . 0 0 "[ . 1]" 1
565 1 36 ASP H 1 36 ASP HB2 3.110 . 3.110 2.115 2.060 2.230 . 0 0 "[ . 1]" 1
566 1 36 ASP H 1 36 ASP HB3 2.960 . 2.960 2.998 2.879 3.072 0.112 8 0 "[ . 1]" 1
567 1 36 ASP H 1 37 TYR H 3.100 . 3.100 2.713 2.650 2.762 . 0 0 "[ . 1]" 1
568 1 36 ASP H 1 38 ALA MB 5.500 . 5.500 5.185 4.930 5.381 . 0 0 "[ . 1]" 1
569 1 36 ASP HA 1 36 ASP HB2 3.030 . 3.030 2.693 2.623 2.739 . 0 0 "[ . 1]" 1
570 1 36 ASP HA 1 36 ASP HB3 2.950 . 2.950 2.961 2.937 2.987 0.037 3 0 "[ . 1]" 1
571 1 36 ASP HA 1 40 ARG H 4.770 . 4.770 4.077 4.008 4.154 . 0 0 "[ . 1]" 1
572 1 36 ASP HB2 1 37 TYR H 3.660 . 3.660 3.610 3.507 3.695 0.035 3 0 "[ . 1]" 1
573 1 36 ASP HB3 1 37 TYR H 3.430 . 3.430 2.914 2.792 2.997 . 0 0 "[ . 1]" 1
574 1 37 TYR H 1 37 TYR HB2 3.090 . 3.090 2.834 2.771 2.918 . 0 0 "[ . 1]" 1
575 1 37 TYR H 1 37 TYR HB3 3.360 . 3.360 2.324 2.255 2.374 . 0 0 "[ . 1]" 1
576 1 37 TYR H 1 38 ALA H 3.310 . 3.310 2.719 2.630 2.818 . 0 0 "[ . 1]" 1
577 1 37 TYR H 1 38 ALA MB 4.890 . 4.890 4.245 4.155 4.346 . 0 0 "[ . 1]" 1
578 1 37 TYR H 1 39 ARG H 3.700 . 3.700 3.848 3.822 3.876 0.176 10 0 "[ . 1]" 1
579 1 37 TYR H 1 112 ILE MD 5.390 . 5.390 4.949 4.761 5.171 . 0 0 "[ . 1]" 1
580 1 37 TYR HA 1 37 TYR QD 3.060 . 3.060 3.128 3.077 3.235 0.175 8 0 "[ . 1]" 1
581 1 37 TYR HA 1 38 ALA H 3.570 . 3.570 3.569 3.552 3.583 0.013 10 0 "[ . 1]" 1
582 1 37 TYR HA 1 39 ARG HG2 4.070 . 4.070 4.210 4.167 4.243 0.173 8 0 "[ . 1]" 1
583 1 37 TYR HA 1 40 ARG H 4.190 . 4.190 3.425 3.352 3.476 . 0 0 "[ . 1]" 1
584 1 37 TYR HA 1 40 ARG HB2 4.350 . 4.350 4.467 4.399 4.571 0.221 8 0 "[ . 1]" 1
585 1 37 TYR HA 1 40 ARG HB3 4.610 . 4.610 3.319 2.943 3.886 . 0 0 "[ . 1]" 1
586 1 37 TYR HA 1 40 ARG QD 4.730 . 4.730 2.805 1.858 4.587 . 0 0 "[ . 1]" 1
587 1 37 TYR HA 1 40 ARG QG 3.610 . 3.610 1.970 1.717 2.526 0.083 6 0 "[ . 1]" 1
588 1 37 TYR HA 1 41 ASN QD 3.900 . 3.900 3.341 2.905 3.963 0.063 8 0 "[ . 1]" 1
589 1 37 TYR HA 1 112 ILE MD 5.140 . 5.140 5.244 5.181 5.310 0.170 7 0 "[ . 1]" 1
590 1 37 TYR HB2 1 38 ALA H 3.580 . 3.580 3.707 3.671 3.726 0.146 2 0 "[ . 1]" 1
591 1 37 TYR HB2 1 112 ILE MD 4.420 . 4.420 3.191 3.125 3.259 . 0 0 "[ . 1]" 1
592 1 37 TYR HB3 1 38 ALA H 3.700 . 3.700 2.244 2.183 2.298 . 0 0 "[ . 1]" 1
593 1 37 TYR HB3 1 112 ILE MD 4.730 . 4.730 3.583 3.332 3.756 . 0 0 "[ . 1]" 1
594 1 37 TYR QD 1 38 ALA H 3.440 . 3.440 2.211 1.962 2.309 . 0 0 "[ . 1]" 1
595 1 37 TYR QD 1 38 ALA HA 3.290 . 3.290 2.489 2.392 2.563 . 0 0 "[ . 1]" 1
596 1 37 TYR QD 1 38 ALA MB 3.790 . 3.790 2.812 2.522 2.912 . 0 0 "[ . 1]" 1
597 1 37 TYR QD 1 40 ARG QG 3.850 . 3.850 3.675 3.504 3.859 0.009 8 0 "[ . 1]" 1
598 1 37 TYR QD 1 41 ASN HB2 5.100 . 5.100 3.661 3.592 3.739 . 0 0 "[ . 1]" 1
599 1 37 TYR QD 1 41 ASN QD 3.980 . 3.980 3.126 2.839 3.752 . 0 0 "[ . 1]" 1
600 1 37 TYR QD 1 80 ILE MD 3.740 . 3.740 3.630 3.308 3.785 0.045 4 0 "[ . 1]" 1
601 1 37 TYR QD 1 80 ILE HG12 3.710 . 3.710 2.232 1.996 2.509 . 0 0 "[ . 1]" 1
602 1 37 TYR QD 1 80 ILE MG 3.560 . 3.560 2.664 2.292 2.977 . 0 0 "[ . 1]" 1
603 1 37 TYR QD 1 110 LEU QD 3.710 . 3.710 3.484 3.381 3.599 . 0 0 "[ . 1]" 1
604 1 37 TYR QD 1 110 LEU HG 3.700 . 3.700 3.772 3.698 3.836 0.136 4 0 "[ . 1]" 1
605 1 37 TYR QD 1 112 ILE MD 3.840 . 3.840 3.558 3.170 3.760 . 0 0 "[ . 1]" 1
606 1 37 TYR QE 1 38 ALA H 4.510 . 4.510 4.484 4.247 4.576 0.066 3 0 "[ . 1]" 1
607 1 37 TYR QE 1 38 ALA HA 3.710 . 3.710 3.341 3.067 3.523 . 0 0 "[ . 1]" 1
608 1 37 TYR QE 1 41 ASN HB3 3.780 . 3.780 3.905 3.871 3.930 0.150 8 0 "[ . 1]" 1
609 1 37 TYR QE 1 43 PHE QD 3.870 . 3.870 3.082 2.929 3.317 . 0 0 "[ . 1]" 1
610 1 37 TYR QE 1 43 PHE QE 3.240 . 3.240 1.868 1.750 2.295 0.050 5 0 "[ . 1]" 1
611 1 37 TYR QE 1 80 ILE MD 3.300 . 3.300 2.713 1.985 3.224 . 0 0 "[ . 1]" 1
612 1 37 TYR QE 1 80 ILE HG12 4.360 . 4.360 2.572 2.277 3.030 . 0 0 "[ . 1]" 1
613 1 37 TYR QE 1 80 ILE MG 4.560 . 4.560 3.727 3.452 3.972 . 0 0 "[ . 1]" 1
614 1 37 TYR QE 1 110 LEU QD 4.140 . 4.140 2.799 2.627 2.989 . 0 0 "[ . 1]" 1
615 1 37 TYR QE 1 110 LEU HG 3.160 . 3.160 2.778 2.574 2.986 . 0 0 "[ . 1]" 1
616 1 38 ALA H 1 38 ALA MB 3.040 . 3.040 2.185 2.139 2.232 . 0 0 "[ . 1]" 1
617 1 38 ALA H 1 39 ARG H 3.570 . 3.570 2.929 2.894 2.953 . 0 0 "[ . 1]" 1
618 1 38 ALA H 1 43 PHE HB2 5.200 . 5.200 5.186 5.105 5.262 0.062 2 0 "[ . 1]" 1
619 1 38 ALA H 1 43 PHE QD 4.150 . 4.150 4.193 4.131 4.234 0.084 8 0 "[ . 1]" 1
620 1 38 ALA H 1 43 PHE QE 5.470 . 5.470 5.313 5.251 5.410 . 0 0 "[ . 1]" 1
621 1 38 ALA H 1 46 ILE MD 4.210 . 4.210 4.249 4.173 4.291 0.081 7 0 "[ . 1]" 1
622 1 38 ALA H 1 80 ILE MD 5.500 . 5.500 4.883 4.704 5.055 . 0 0 "[ . 1]" 1
623 1 38 ALA H 1 80 ILE HG12 4.650 . 4.650 3.732 3.550 3.966 . 0 0 "[ . 1]" 1
624 1 38 ALA H 1 80 ILE MG 3.510 . 3.510 3.468 3.147 3.610 0.100 8 0 "[ . 1]" 1
625 1 38 ALA HA 1 41 ASN HB2 4.750 . 4.750 2.504 2.298 2.694 . 0 0 "[ . 1]" 1
626 1 38 ALA HA 1 41 ASN HB3 4.990 . 4.990 3.597 3.430 3.705 . 0 0 "[ . 1]" 1
627 1 38 ALA HA 1 42 GLY H 4.190 . 4.190 3.810 3.655 4.061 . 0 0 "[ . 1]" 1
628 1 38 ALA HA 1 43 PHE H 4.050 . 4.050 3.696 3.584 3.807 . 0 0 "[ . 1]" 1
629 1 38 ALA HA 1 43 PHE HB2 3.950 . 3.950 3.039 3.013 3.076 . 0 0 "[ . 1]" 1
630 1 38 ALA HA 1 43 PHE HB3 4.470 . 4.470 4.575 4.541 4.608 0.138 9 0 "[ . 1]" 1
631 1 38 ALA HA 1 43 PHE QD 2.810 . 2.810 1.649 1.594 1.737 0.206 7 0 "[ . 1]" 1
632 1 38 ALA HA 1 43 PHE QE 3.130 . 3.130 3.243 3.174 3.289 0.159 10 0 "[ . 1]" 1
633 1 38 ALA HA 1 46 ILE MD 4.310 . 4.310 3.795 3.575 3.899 . 0 0 "[ . 1]" 1
634 1 38 ALA HA 1 80 ILE MD 4.050 . 4.050 3.795 3.468 4.058 0.008 8 0 "[ . 1]" 1
635 1 38 ALA MB 1 39 ARG H 3.440 . 3.440 2.725 2.678 2.758 . 0 0 "[ . 1]" 1
636 1 38 ALA MB 1 43 PHE H 4.170 . 4.170 3.376 3.208 3.565 . 0 0 "[ . 1]" 1
637 1 38 ALA MB 1 43 PHE HB2 3.510 . 3.510 1.947 1.792 2.152 0.008 4 0 "[ . 1]" 1
638 1 38 ALA MB 1 43 PHE HB3 3.940 . 3.940 3.298 3.148 3.443 . 0 0 "[ . 1]" 1
639 1 38 ALA MB 1 43 PHE QD 3.550 . 3.550 2.490 2.322 2.663 . 0 0 "[ . 1]" 1
640 1 38 ALA MB 1 43 PHE QE 4.800 . 4.800 4.313 4.168 4.448 . 0 0 "[ . 1]" 1
641 1 38 ALA MB 1 46 ILE MD 3.180 . 3.180 1.739 1.696 1.786 0.104 6 0 "[ . 1]" 1
642 1 38 ALA MB 1 46 ILE MG 3.630 . 3.630 2.578 2.147 2.892 . 0 0 "[ . 1]" 1
643 1 38 ALA MB 1 80 ILE MD 3.420 . 3.420 3.247 2.920 3.499 0.079 7 0 "[ . 1]" 1
644 1 39 ARG H 1 39 ARG HB2 3.680 . 3.680 3.648 3.633 3.659 . 0 0 "[ . 1]" 1
645 1 39 ARG H 1 39 ARG HB3 3.060 . 3.060 2.828 2.701 2.948 . 0 0 "[ . 1]" 1
646 1 39 ARG H 1 39 ARG QD 3.980 . 3.980 3.120 3.006 3.283 . 0 0 "[ . 1]" 1
647 1 39 ARG H 1 39 ARG HG2 4.260 . 4.260 1.908 1.801 2.034 . 0 0 "[ . 1]" 1
648 1 39 ARG H 1 39 ARG HG3 3.990 . 3.990 3.484 3.416 3.545 . 0 0 "[ . 1]" 1
649 1 39 ARG H 1 40 ARG H 3.280 . 3.280 2.507 2.480 2.546 . 0 0 "[ . 1]" 1
650 1 39 ARG H 1 41 ASN H 4.070 . 4.070 3.598 3.568 3.626 . 0 0 "[ . 1]" 1
651 1 39 ARG H 1 46 ILE MD 4.590 . 4.590 3.623 3.337 3.797 . 0 0 "[ . 1]" 1
652 1 39 ARG HA 1 39 ARG HB2 2.680 . 2.680 2.490 2.442 2.542 . 0 0 "[ . 1]" 1
653 1 39 ARG HA 1 39 ARG HB3 2.870 . 2.870 2.388 2.343 2.440 . 0 0 "[ . 1]" 1
654 1 39 ARG HA 1 39 ARG QD 4.400 . 4.400 4.098 3.991 4.208 . 0 0 "[ . 1]" 1
655 1 39 ARG HA 1 39 ARG HG2 3.540 . 3.540 3.589 3.559 3.620 0.080 3 0 "[ . 1]" 1
656 1 39 ARG HA 1 42 GLY H 3.720 . 3.720 3.089 2.937 3.138 . 0 0 "[ . 1]" 1
657 1 39 ARG HA 1 43 PHE H 3.710 . 3.710 3.371 3.176 3.516 . 0 0 "[ . 1]" 1
658 1 39 ARG HA 1 46 ILE MD 4.540 . 4.540 3.568 3.272 3.752 . 0 0 "[ . 1]" 1
659 1 39 ARG HB2 1 39 ARG QD 3.090 . 3.090 2.840 2.589 3.180 0.090 2 0 "[ . 1]" 1
660 1 39 ARG HB2 1 40 ARG H 4.140 . 4.140 3.570 3.449 3.651 . 0 0 "[ . 1]" 1
661 1 39 ARG HB3 1 39 ARG QD 3.080 . 3.080 2.040 1.923 2.218 . 0 0 "[ . 1]" 1
662 1 39 ARG QD 1 46 ILE MD 4.280 . 4.280 4.291 3.831 4.442 0.162 7 0 "[ . 1]" 1
663 1 39 ARG HG2 1 40 ARG H 3.470 . 3.470 2.047 1.966 2.116 . 0 0 "[ . 1]" 1
664 1 39 ARG HG2 1 41 ASN H 4.220 . 4.220 4.310 4.269 4.349 0.129 2 0 "[ . 1]" 1
665 1 39 ARG HG3 1 40 ARG H 3.450 . 3.450 2.677 2.538 2.772 . 0 0 "[ . 1]" 1
666 1 40 ARG H 1 40 ARG HB2 3.660 . 3.660 3.510 3.366 3.611 . 0 0 "[ . 1]" 1
667 1 40 ARG H 1 40 ARG HB3 3.370 . 3.370 2.252 2.077 2.561 . 0 0 "[ . 1]" 1
668 1 40 ARG H 1 40 ARG QG 3.650 . 3.650 2.744 2.127 3.234 . 0 0 "[ . 1]" 1
669 1 40 ARG H 1 41 ASN H 3.350 . 3.350 2.574 2.535 2.598 . 0 0 "[ . 1]" 1
670 1 40 ARG H 1 42 GLY H 5.190 . 5.190 4.185 4.070 4.249 . 0 0 "[ . 1]" 1
671 1 40 ARG HA 1 40 ARG HB2 2.540 . 2.540 2.307 2.238 2.446 . 0 0 "[ . 1]" 1
672 1 40 ARG HA 1 40 ARG HB3 2.650 . 2.650 2.637 2.460 2.767 0.117 9 0 "[ . 1]" 1
673 1 40 ARG HA 1 40 ARG QD 4.390 . 4.390 4.197 3.374 4.443 0.053 7 0 "[ . 1]" 1
674 1 40 ARG HA 1 40 ARG QG 3.390 . 3.390 3.303 3.265 3.343 . 0 0 "[ . 1]" 1
675 1 40 ARG HA 1 41 ASN H 3.390 . 3.390 3.410 3.364 3.434 0.044 2 0 "[ . 1]" 1
676 1 40 ARG HB2 1 40 ARG HD2 3.620 . 3.620 2.513 2.338 2.664 . 0 0 "[ . 1]" 1
677 1 40 ARG HB2 1 40 ARG HD3 3.570 . 3.570 3.184 2.311 3.640 0.070 4 0 "[ . 1]" 1
678 1 40 ARG HB2 1 41 ASN H 4.340 . 4.340 4.316 4.121 4.412 0.072 8 0 "[ . 1]" 1
679 1 40 ARG HB2 1 41 ASN QD 4.910 . 4.910 4.349 4.021 4.543 . 0 0 "[ . 1]" 1
680 1 40 ARG HB3 1 40 ARG HD2 3.700 . 3.700 2.919 2.428 3.722 0.022 9 0 "[ . 1]" 1
681 1 40 ARG HB3 1 41 ASN H 4.160 . 4.160 3.912 3.580 4.170 0.010 6 0 "[ . 1]" 1
682 1 40 ARG HB3 1 41 ASN QD 4.540 . 4.540 4.327 3.698 4.609 0.069 8 0 "[ . 1]" 1
683 1 40 ARG HD3 1 41 ASN QD 4.660 . 4.660 3.762 3.034 4.560 . 0 0 "[ . 1]" 1
684 1 40 ARG QG 1 41 ASN H 4.450 . 4.450 2.751 2.655 3.003 . 0 0 "[ . 1]" 1
685 1 40 ARG QG 1 41 ASN HA 3.650 . 3.650 3.322 3.085 3.590 . 0 0 "[ . 1]" 1
686 1 40 ARG QG 1 41 ASN QD 4.230 . 4.230 1.911 1.813 2.033 . 0 0 "[ . 1]" 1
687 1 40 ARG QG 1 42 GLY H 5.270 . 5.270 4.691 4.591 4.838 . 0 0 "[ . 1]" 1
688 1 41 ASN H 1 41 ASN HB2 3.310 . 3.310 2.197 2.151 2.253 . 0 0 "[ . 1]" 1
689 1 41 ASN H 1 41 ASN HB3 3.350 . 3.350 3.411 3.338 3.475 0.125 1 0 "[ . 1]" 1
690 1 41 ASN H 1 41 ASN QD 3.870 . 3.870 2.867 2.479 3.188 . 0 0 "[ . 1]" 1
691 1 41 ASN H 1 42 GLY H 3.490 . 3.490 2.235 2.147 2.306 . 0 0 "[ . 1]" 1
692 1 41 ASN H 1 42 GLY QA 4.140 . 4.140 4.142 4.078 4.190 0.050 3 0 "[ . 1]" 1
693 1 41 ASN HA 1 41 ASN QD 4.380 . 4.380 2.840 2.308 3.062 . 0 0 "[ . 1]" 1
694 1 41 ASN HA 1 42 GLY H 3.420 . 3.420 3.527 3.500 3.540 0.120 6 0 "[ . 1]" 1
695 1 41 ASN HA 1 42 GLY QA 4.330 . 4.330 4.270 4.260 4.281 . 0 0 "[ . 1]" 1
696 1 41 ASN HB2 1 42 GLY H 5.330 . 5.330 2.984 2.742 3.219 . 0 0 "[ . 1]" 1
697 1 41 ASN HB2 1 43 PHE QD 3.430 . 3.430 2.922 2.632 3.261 . 0 0 "[ . 1]" 1
698 1 41 ASN HB2 1 43 PHE QE 3.170 . 3.170 2.769 2.457 3.013 . 0 0 "[ . 1]" 1
699 1 41 ASN HB3 1 43 PHE QD 3.470 . 3.470 3.128 2.782 3.324 . 0 0 "[ . 1]" 1
700 1 41 ASN HB3 1 43 PHE QE 3.580 . 3.580 2.367 1.988 2.648 . 0 0 "[ . 1]" 1
701 1 41 ASN QD 1 42 GLY H 5.370 . 5.370 4.568 4.329 4.750 . 0 0 "[ . 1]" 1
702 1 42 GLY H 1 43 PHE H 3.160 . 3.160 2.371 2.281 2.491 . 0 0 "[ . 1]" 1
703 1 42 GLY QA 1 43 PHE HA 4.380 . 4.380 4.033 4.021 4.046 . 0 0 "[ . 1]" 1
704 1 42 GLY QA 1 43 PHE QD 4.790 . 4.790 4.607 4.406 4.725 . 0 0 "[ . 1]" 1
705 1 43 PHE H 1 43 PHE HB2 3.390 . 3.390 2.501 2.434 2.573 . 0 0 "[ . 1]" 1
706 1 43 PHE H 1 43 PHE HB3 3.760 . 3.760 3.690 3.653 3.727 . 0 0 "[ . 1]" 1
707 1 43 PHE H 1 43 PHE QD 3.320 . 3.320 3.307 3.066 3.455 0.135 3 0 "[ . 1]" 1
708 1 43 PHE H 1 44 GLU H 4.580 . 4.580 4.486 4.430 4.527 . 0 0 "[ . 1]" 1
709 1 43 PHE H 1 46 ILE MD 4.580 . 4.580 3.326 3.057 3.484 . 0 0 "[ . 1]" 1
710 1 43 PHE HA 1 43 PHE QD 2.960 . 2.960 2.312 2.048 2.545 . 0 0 "[ . 1]" 1
711 1 43 PHE HA 1 44 GLU H 2.830 . 2.830 2.197 2.159 2.216 . 0 0 "[ . 1]" 1
712 1 43 PHE HB2 1 44 GLU H 4.340 . 4.340 4.125 4.065 4.173 . 0 0 "[ . 1]" 1
713 1 43 PHE HB2 1 46 ILE MD 4.570 . 4.570 2.754 2.463 2.894 . 0 0 "[ . 1]" 1
714 1 43 PHE HB3 1 44 GLU H 3.940 . 3.940 3.106 2.998 3.265 . 0 0 "[ . 1]" 1
715 1 43 PHE HB3 1 46 ILE MD 4.730 . 4.730 3.823 3.572 3.976 . 0 0 "[ . 1]" 1
716 1 43 PHE QD 1 44 GLU H 3.880 . 3.880 3.718 3.557 3.892 0.012 5 0 "[ . 1]" 1
717 1 43 PHE QD 1 78 THR HB 4.080 . 4.080 4.097 4.004 4.139 0.059 2 0 "[ . 1]" 1
718 1 43 PHE QD 1 78 THR MG 3.200 . 3.200 2.942 2.493 3.223 0.023 9 0 "[ . 1]" 1
719 1 43 PHE QD 1 80 ILE MD 3.690 . 3.690 2.880 2.171 3.486 . 0 0 "[ . 1]" 1
720 1 43 PHE QD 1 80 ILE HG12 4.100 . 4.100 3.456 2.808 4.109 0.009 8 0 "[ . 1]" 1
721 1 43 PHE QE 1 78 THR MG 3.500 . 3.500 2.376 2.220 2.668 . 0 0 "[ . 1]" 1
722 1 43 PHE QE 1 80 ILE MD 3.900 . 3.900 3.150 2.670 3.922 0.022 8 0 "[ . 1]" 1
723 1 44 GLU H 1 44 GLU HB2 3.650 . 3.650 2.251 2.223 2.270 . 0 0 "[ . 1]" 1
724 1 44 GLU H 1 44 GLU HB3 3.920 . 3.920 3.522 3.495 3.537 . 0 0 "[ . 1]" 1
725 1 44 GLU H 1 44 GLU HG2 3.740 . 3.740 3.901 3.865 3.957 0.217 4 0 "[ . 1]" 1
726 1 44 GLU H 1 44 GLU HG3 4.120 . 4.120 4.232 4.194 4.304 0.184 6 0 "[ . 1]" 1
727 1 44 GLU H 1 46 ILE H 4.900 . 4.900 4.933 4.484 5.008 0.108 8 0 "[ . 1]" 1
728 1 44 GLU HA 1 44 GLU HG2 3.540 . 3.540 3.646 3.634 3.656 0.116 7 0 "[ . 1]" 1
729 1 44 GLU HA 1 45 ASN H 3.150 . 3.150 2.393 2.359 2.432 . 0 0 "[ . 1]" 1
730 1 44 GLU HA 1 45 ASN QB 4.480 . 4.480 4.584 4.525 4.609 0.129 3 0 "[ . 1]" 1
731 1 44 GLU HA 1 46 ILE MD 3.580 . 3.580 3.623 3.585 3.652 0.072 2 0 "[ . 1]" 1
732 1 44 GLU HA 1 46 ILE HG13 3.210 . 3.210 3.300 3.275 3.356 0.146 5 0 "[ . 1]" 1
733 1 44 GLU HB2 1 45 ASN H 4.060 . 4.060 3.652 3.610 3.723 . 0 0 "[ . 1]" 1
734 1 44 GLU HB2 1 45 ASN QB 4.880 . 4.880 4.145 4.065 4.275 . 0 0 "[ . 1]" 1
735 1 44 GLU HB3 1 44 GLU HG3 2.800 . 2.800 2.293 2.261 2.316 . 0 0 "[ . 1]" 1
736 1 44 GLU HB3 1 45 ASN H 3.690 . 3.690 2.236 2.185 2.329 . 0 0 "[ . 1]" 1
737 1 44 GLU HB3 1 45 ASN HA 4.050 . 4.050 4.080 4.005 4.123 0.073 2 0 "[ . 1]" 1
738 1 44 GLU HB3 1 45 ASN QB 4.890 . 4.890 3.644 3.461 3.830 . 0 0 "[ . 1]" 1
739 1 44 GLU HB3 1 45 ASN HD22 5.500 . 5.500 3.225 3.006 3.418 . 0 0 "[ . 1]" 1
740 1 44 GLU HG2 1 45 ASN H 4.440 . 4.440 4.457 4.416 4.499 0.059 5 0 "[ . 1]" 1
741 1 44 GLU HG2 1 45 ASN HD21 4.640 . 4.640 4.770 4.748 4.800 0.160 2 0 "[ . 1]" 1
742 1 44 GLU HG3 1 45 ASN HA 5.500 . 5.500 5.589 5.533 5.628 0.128 4 0 "[ . 1]" 1
743 1 45 ASN H 1 45 ASN QB 3.850 . 3.850 3.244 3.148 3.332 . 0 0 "[ . 1]" 1
744 1 45 ASN H 1 46 ILE H 3.880 . 3.880 2.896 2.800 3.316 . 0 0 "[ . 1]" 1
745 1 45 ASN HA 1 45 ASN QB 2.680 . 2.680 2.379 2.354 2.407 . 0 0 "[ . 1]" 1
746 1 45 ASN HA 1 46 ILE H 3.250 . 3.250 3.012 2.900 3.484 0.234 5 0 "[ . 1]" 1
747 1 45 ASN QB 1 45 ASN HD21 3.240 . 3.240 2.090 2.059 2.153 . 0 0 "[ . 1]" 1
748 1 45 ASN QB 1 45 ASN HD22 3.630 . 3.630 3.240 3.222 3.272 . 0 0 "[ . 1]" 1
749 1 45 ASN QB 1 46 ILE H 3.750 . 3.750 3.646 2.702 3.773 0.023 2 0 "[ . 1]" 1
750 1 45 ASN QB 1 47 ARG H 5.090 . 5.090 4.364 4.023 4.483 . 0 0 "[ . 1]" 1
751 1 46 ILE H 1 46 ILE HB 2.960 . 2.960 2.612 2.506 3.144 0.184 5 0 "[ . 1]" 1
752 1 46 ILE H 1 46 ILE MD 3.460 . 3.460 3.209 3.133 3.602 0.142 5 0 "[ . 1]" 1
753 1 46 ILE H 1 46 ILE HG12 3.560 . 3.560 3.417 3.138 3.488 . 0 0 "[ . 1]" 1
754 1 46 ILE H 1 46 ILE HG13 3.340 . 3.340 1.958 1.877 2.019 . 0 0 "[ . 1]" 1
755 1 46 ILE H 1 46 ILE MG 3.810 . 3.810 3.745 3.730 3.843 0.033 5 0 "[ . 1]" 1
756 1 46 ILE H 1 47 ARG H 4.040 . 4.040 4.143 3.732 4.228 0.188 4 0 "[ . 1]" 1
757 1 46 ILE HA 1 46 ILE HG12 4.030 . 4.030 2.702 2.581 2.783 . 0 0 "[ . 1]" 1
758 1 46 ILE HA 1 46 ILE HG13 3.730 . 3.730 2.770 2.728 2.821 . 0 0 "[ . 1]" 1
759 1 46 ILE HA 1 46 ILE MG 3.330 . 3.330 2.378 2.221 2.482 . 0 0 "[ . 1]" 1
760 1 46 ILE HA 1 47 ARG H 2.930 . 2.930 2.134 2.087 2.194 . 0 0 "[ . 1]" 1
761 1 46 ILE HB 1 47 ARG H 4.590 . 4.590 4.396 4.329 4.447 . 0 0 "[ . 1]" 1
762 1 46 ILE MD 1 46 ILE MG 3.170 . 3.170 2.236 1.974 2.416 . 0 0 "[ . 1]" 1
763 1 46 ILE HG12 1 47 ARG H 4.660 . 4.660 4.769 4.734 4.804 0.144 7 0 "[ . 1]" 1
764 1 46 ILE HG13 1 47 ARG H 4.760 . 4.760 4.819 4.790 4.847 0.087 5 0 "[ . 1]" 1
765 1 46 ILE MG 1 47 ARG H 3.590 . 3.590 3.173 2.955 3.428 . 0 0 "[ . 1]" 1
766 1 46 ILE MG 1 47 ARG HA 4.390 . 4.390 3.986 3.837 4.140 . 0 0 "[ . 1]" 1
767 1 46 ILE MG 1 48 HIS H 5.500 . 5.500 4.382 4.122 4.639 . 0 0 "[ . 1]" 1
768 1 46 ILE MG 1 48 HIS HD2 3.570 . 3.570 2.861 2.422 3.099 . 0 0 "[ . 1]" 1
769 1 47 ARG H 1 47 ARG HB2 3.300 . 3.300 2.361 2.333 2.384 . 0 0 "[ . 1]" 1
770 1 47 ARG H 1 47 ARG HB3 3.640 . 3.640 2.990 2.876 3.040 . 0 0 "[ . 1]" 1
771 1 47 ARG H 1 47 ARG HG2 4.340 . 4.340 4.334 4.261 4.373 0.033 4 0 "[ . 1]" 1
772 1 47 ARG H 1 49 PHE QE 5.280 . 5.280 4.112 3.919 4.259 . 0 0 "[ . 1]" 1
773 1 47 ARG HA 1 47 ARG QD 3.520 . 3.520 3.602 3.531 3.653 0.133 4 0 "[ . 1]" 1
774 1 47 ARG HA 1 47 ARG HG3 3.780 . 3.780 3.110 2.944 3.292 . 0 0 "[ . 1]" 1
775 1 47 ARG HA 1 48 HIS H 2.740 . 2.740 2.132 2.109 2.178 . 0 0 "[ . 1]" 1
776 1 47 ARG HA 1 48 HIS HA 4.190 . 4.190 4.313 4.300 4.322 0.132 10 0 "[ . 1]" 1
777 1 47 ARG HA 1 48 HIS HD2 3.760 . 3.760 3.414 3.258 3.566 . 0 0 "[ . 1]" 1
778 1 47 ARG HB2 1 47 ARG QD 3.650 . 3.650 2.968 2.846 3.107 . 0 0 "[ . 1]" 1
779 1 47 ARG HB2 1 49 PHE QE 3.860 . 3.860 3.822 3.677 3.895 0.035 3 0 "[ . 1]" 1
780 1 47 ARG HB3 1 47 ARG QD 3.600 . 3.600 2.057 1.921 2.135 . 0 0 "[ . 1]" 1
781 1 47 ARG HB3 1 48 HIS H 4.410 . 4.410 3.767 3.665 3.867 . 0 0 "[ . 1]" 1
782 1 47 ARG HB3 1 49 PHE QD 4.390 . 4.390 3.939 3.802 4.006 . 0 0 "[ . 1]" 1
783 1 47 ARG HB3 1 49 PHE QE 3.820 . 3.820 2.632 2.509 2.762 . 0 0 "[ . 1]" 1
784 1 47 ARG HB3 1 49 PHE HZ 4.390 . 4.390 2.644 2.491 2.755 . 0 0 "[ . 1]" 1
785 1 47 ARG QD 1 49 PHE HA 4.190 . 4.190 4.173 4.026 4.310 0.120 4 0 "[ . 1]" 1
786 1 47 ARG QD 1 49 PHE QD 4.540 . 4.540 3.329 3.186 3.488 . 0 0 "[ . 1]" 1
787 1 47 ARG QD 1 49 PHE QE 2.810 . 2.810 2.367 2.135 2.541 . 0 0 "[ . 1]" 1
788 1 47 ARG QD 1 49 PHE HZ 3.420 . 3.420 2.389 2.114 2.659 . 0 0 "[ . 1]" 1
789 1 47 ARG HG2 1 48 HIS H 3.240 . 3.240 2.790 2.700 2.880 . 0 0 "[ . 1]" 1
790 1 47 ARG HG3 1 48 HIS H 4.300 . 4.300 4.414 4.355 4.468 0.168 7 0 "[ . 1]" 1
791 1 48 HIS H 1 48 HIS HB2 3.320 . 3.320 2.389 2.358 2.433 . 0 0 "[ . 1]" 1
792 1 48 HIS H 1 48 HIS HB3 3.620 . 3.620 3.628 3.616 3.649 0.029 5 0 "[ . 1]" 1
793 1 48 HIS H 1 48 HIS HD2 3.120 . 3.120 2.773 2.651 3.071 . 0 0 "[ . 1]" 1
794 1 48 HIS H 1 49 PHE H 4.900 . 4.900 4.348 4.310 4.381 . 0 0 "[ . 1]" 1
795 1 48 HIS HA 1 48 HIS HD2 3.650 . 3.650 3.614 3.191 3.740 0.090 5 0 "[ . 1]" 1
796 1 48 HIS HA 1 49 PHE H 3.030 . 3.030 2.114 2.086 2.128 . 0 0 "[ . 1]" 1
797 1 48 HIS HA 1 49 PHE HA 4.460 . 4.460 4.383 4.365 4.396 . 0 0 "[ . 1]" 1
798 1 48 HIS HA 1 49 PHE QD 3.780 . 3.780 3.824 3.730 3.877 0.097 2 0 "[ . 1]" 1
799 1 48 HIS HB2 1 48 HIS HD2 2.900 . 2.900 2.982 2.927 3.119 0.219 2 0 "[ . 1]" 1
800 1 48 HIS HB2 1 49 PHE H 4.580 . 4.580 4.430 4.374 4.469 . 0 0 "[ . 1]" 1
801 1 48 HIS HB3 1 48 HIS HD2 3.990 . 3.990 3.947 3.928 3.954 . 0 0 "[ . 1]" 1
802 1 48 HIS HB3 1 49 PHE H 3.840 . 3.840 3.588 3.502 3.657 . 0 0 "[ . 1]" 1
803 1 49 PHE H 1 49 PHE HB2 3.910 . 3.910 2.615 2.591 2.634 . 0 0 "[ . 1]" 1
804 1 49 PHE H 1 49 PHE HB3 3.800 . 3.800 3.709 3.691 3.725 . 0 0 "[ . 1]" 1
805 1 49 PHE H 1 49 PHE QD 3.280 . 3.280 2.576 2.434 2.673 . 0 0 "[ . 1]" 1
806 1 49 PHE H 1 50 THR H 4.010 . 4.010 4.042 4.010 4.095 0.085 10 0 "[ . 1]" 1
807 1 49 PHE HA 1 49 PHE QD 3.430 . 3.430 2.860 2.783 2.960 . 0 0 "[ . 1]" 1
808 1 49 PHE HA 1 50 THR H 2.840 . 2.840 2.065 2.034 2.080 . 0 0 "[ . 1]" 1
809 1 49 PHE HA 1 50 THR HB 4.150 . 4.150 4.305 4.203 4.335 0.185 9 0 "[ . 1]" 1
810 1 49 PHE HB2 1 67 LEU H 4.660 . 4.660 4.778 4.742 4.822 0.162 6 0 "[ . 1]" 1
811 1 49 PHE HB2 1 67 LEU MD1 4.730 . 4.730 4.705 4.604 4.781 0.051 2 0 "[ . 1]" 1
812 1 49 PHE HB2 1 67 LEU MD2 4.100 . 4.100 3.820 3.598 3.926 . 0 0 "[ . 1]" 1
813 1 49 PHE HB3 1 50 THR H 5.010 . 5.010 3.827 3.770 3.865 . 0 0 "[ . 1]" 1
814 1 49 PHE HB3 1 67 LEU HB3 3.400 . 3.400 3.434 3.409 3.499 0.099 8 0 "[ . 1]" 1
815 1 49 PHE QD 1 66 SER HB2 3.650 . 3.650 3.127 2.848 3.438 . 0 0 "[ . 1]" 1
816 1 49 PHE QD 1 66 SER HB3 3.320 . 3.320 1.797 1.743 1.875 0.057 1 0 "[ . 1]" 1
817 1 49 PHE QD 1 67 LEU H 3.660 . 3.660 2.793 2.666 2.884 . 0 0 "[ . 1]" 1
818 1 49 PHE QD 1 67 LEU HA 3.890 . 3.890 3.470 3.354 3.731 . 0 0 "[ . 1]" 1
819 1 49 PHE QD 1 67 LEU HB2 3.490 . 3.490 3.012 2.845 3.094 . 0 0 "[ . 1]" 1
820 1 49 PHE QD 1 67 LEU HB3 5.020 . 5.020 3.612 3.546 3.678 . 0 0 "[ . 1]" 1
821 1 49 PHE QD 1 67 LEU MD1 3.720 . 3.720 3.786 3.708 3.848 0.128 7 0 "[ . 1]" 1
822 1 49 PHE QD 1 67 LEU MD2 4.160 . 4.160 4.055 3.809 4.177 0.017 4 0 "[ . 1]" 1
823 1 49 PHE QE 1 66 SER H 4.790 . 4.790 4.794 4.601 4.872 0.082 4 0 "[ . 1]" 1
824 1 49 PHE QE 1 66 SER HA 4.390 . 4.390 3.943 3.896 3.988 . 0 0 "[ . 1]" 1
825 1 49 PHE QE 1 66 SER HB2 4.470 . 4.470 3.904 3.689 3.985 . 0 0 "[ . 1]" 1
826 1 49 PHE QE 1 66 SER HB3 2.830 . 2.830 2.349 2.084 2.790 . 0 0 "[ . 1]" 1
827 1 49 PHE QE 1 67 LEU H 4.350 . 4.350 3.413 3.273 3.524 . 0 0 "[ . 1]" 1
828 1 49 PHE QE 1 67 LEU HA 3.530 . 3.530 2.701 2.553 2.839 . 0 0 "[ . 1]" 1
829 1 49 PHE QE 1 67 LEU HB2 3.960 . 3.960 3.497 3.154 3.656 . 0 0 "[ . 1]" 1
830 1 49 PHE QE 1 67 LEU MD1 3.850 . 3.850 3.557 3.437 3.702 . 0 0 "[ . 1]" 1
831 1 49 PHE HZ 1 67 LEU MD1 4.570 . 4.570 4.295 3.987 4.445 . 0 0 "[ . 1]" 1
832 1 50 THR H 1 50 THR HB 3.020 . 3.020 2.359 2.215 2.435 . 0 0 "[ . 1]" 1
833 1 50 THR H 1 50 THR MG 4.480 . 4.480 2.371 2.248 2.613 . 0 0 "[ . 1]" 1
834 1 50 THR H 1 63 GLY HA2 4.870 . 4.870 4.415 4.295 4.545 . 0 0 "[ . 1]" 1
835 1 50 THR H 1 63 GLY HA3 4.510 . 4.510 3.741 3.450 4.110 . 0 0 "[ . 1]" 1
836 1 50 THR HA 1 50 THR MG 3.370 . 3.370 3.205 3.169 3.213 . 0 0 "[ . 1]" 1
837 1 50 THR HA 1 51 ASP H 2.980 . 2.980 2.227 2.206 2.294 . 0 0 "[ . 1]" 1
838 1 50 THR HA 1 51 ASP HA 4.270 . 4.270 4.356 4.346 4.368 0.098 3 0 "[ . 1]" 1
839 1 50 THR HA 1 54 PHE HZ 5.480 . 5.480 5.561 5.492 5.704 0.224 4 0 "[ . 1]" 1
840 1 50 THR HB 1 51 ASP H 4.850 . 4.850 3.913 3.857 4.003 . 0 0 "[ . 1]" 1
841 1 50 THR MG 1 51 ASP H 4.330 . 4.330 3.451 3.044 3.590 . 0 0 "[ . 1]" 1
842 1 50 THR MG 1 51 ASP HA 4.330 . 4.330 3.848 3.385 4.090 . 0 0 "[ . 1]" 1
843 1 50 THR MG 1 52 ASP H 5.200 . 5.200 4.808 3.924 5.035 . 0 0 "[ . 1]" 1
844 1 50 THR MG 1 63 GLY HA2 3.930 . 3.930 3.999 3.952 4.057 0.127 2 0 "[ . 1]" 1
845 1 51 ASP H 1 52 ASP H 5.070 . 5.070 4.459 4.316 4.507 . 0 0 "[ . 1]" 1
846 1 51 ASP HA 1 52 ASP H 2.880 . 2.880 2.224 2.162 2.257 . 0 0 "[ . 1]" 1
847 1 51 ASP HA 1 52 ASP HA 4.400 . 4.400 4.450 4.403 4.465 0.065 9 0 "[ . 1]" 1
848 1 51 ASP HA 1 52 ASP HB2 4.490 . 4.490 4.471 4.376 4.523 0.033 2 0 "[ . 1]" 1
849 1 51 ASP HA 1 52 ASP HB3 4.360 . 4.360 4.420 4.364 4.465 0.105 4 0 "[ . 1]" 1
850 1 51 ASP HA 1 54 PHE QD 4.160 . 4.160 3.907 3.478 4.165 0.005 8 0 "[ . 1]" 1
851 1 51 ASP QB 1 52 ASP H 4.890 . 4.890 3.054 2.763 3.377 . 0 0 "[ . 1]" 1
852 1 51 ASP QB 1 54 PHE QD 3.680 . 3.680 2.572 2.200 2.813 . 0 0 "[ . 1]" 1
853 1 51 ASP QB 1 54 PHE HZ 4.460 . 4.460 3.517 3.098 4.232 . 0 0 "[ . 1]" 1
854 1 52 ASP H 1 52 ASP HB2 3.550 . 3.550 3.462 3.346 3.509 . 0 0 "[ . 1]" 1
855 1 52 ASP H 1 52 ASP HB3 3.440 . 3.440 2.996 2.825 3.057 . 0 0 "[ . 1]" 1
856 1 52 ASP H 1 54 PHE HA 4.670 . 4.670 4.698 4.547 4.801 0.131 10 0 "[ . 1]" 1
857 1 52 ASP H 1 54 PHE QD 3.740 . 3.740 3.525 3.263 3.747 0.007 8 0 "[ . 1]" 1
858 1 52 ASP H 1 54 PHE QE 3.910 . 3.910 3.204 2.829 3.579 . 0 0 "[ . 1]" 1
859 1 52 ASP HA 1 53 GLY H 3.090 . 3.090 2.147 2.132 2.167 . 0 0 "[ . 1]" 1
860 1 52 ASP HA 1 53 GLY HA2 4.490 . 4.490 4.391 4.374 4.407 . 0 0 "[ . 1]" 1
861 1 52 ASP HB2 1 53 GLY H 5.270 . 5.270 4.397 4.375 4.425 . 0 0 "[ . 1]" 1
862 1 52 ASP HB3 1 53 GLY H 4.430 . 4.430 4.401 4.339 4.438 0.008 2 0 "[ . 1]" 1
863 1 53 GLY H 1 54 PHE H 4.110 . 4.110 3.054 2.925 3.181 . 0 0 "[ . 1]" 1
864 1 54 PHE H 1 54 PHE QD 4.840 . 4.840 3.545 3.436 3.667 . 0 0 "[ . 1]" 1
865 1 54 PHE H 1 55 SER H 4.390 . 4.390 4.499 4.423 4.561 0.171 5 0 "[ . 1]" 1
866 1 54 PHE HA 1 54 PHE QD 3.310 . 3.310 1.798 1.752 1.838 0.048 1 0 "[ . 1]" 1
867 1 54 PHE HA 1 54 PHE QE 4.120 . 4.120 4.131 4.083 4.168 0.048 10 0 "[ . 1]" 1
868 1 54 PHE QD 1 61 ARG HA 4.120 . 4.120 4.282 4.167 4.373 0.253 10 0 "[ . 1]" 1
869 1 54 PHE QD 1 61 ARG HB2 4.830 . 4.830 4.090 3.851 4.339 . 0 0 "[ . 1]" 1
870 1 54 PHE QE 1 61 ARG HB3 4.380 . 4.380 2.674 2.373 3.108 . 0 0 "[ . 1]" 1
871 1 54 PHE QE 1 62 PRO HD2 5.010 . 5.010 1.739 1.715 1.762 0.085 5 0 "[ . 1]" 1
872 1 54 PHE QE 1 62 PRO HD3 3.710 . 3.710 3.199 3.150 3.282 . 0 0 "[ . 1]" 1
873 1 54 PHE QE 1 62 PRO HG2 3.970 . 3.970 1.802 1.689 2.067 0.111 5 0 "[ . 1]" 1
874 1 54 PHE QE 1 62 PRO HG3 4.450 . 4.450 2.733 2.634 2.850 . 0 0 "[ . 1]" 1
875 1 54 PHE HZ 1 62 PRO HG3 4.640 . 4.640 4.704 4.520 4.805 0.165 1 0 "[ . 1]" 1
876 1 55 SER HA 1 56 GLY H 3.530 . 3.530 2.495 2.457 2.520 . 0 0 "[ . 1]" 1
877 1 55 SER HA 1 57 VAL H 5.090 . 5.090 4.502 4.365 4.589 . 0 0 "[ . 1]" 1
878 1 55 SER HB2 1 56 GLY H 4.870 . 4.870 3.859 3.663 3.967 . 0 0 "[ . 1]" 1
879 1 55 SER HB2 1 57 VAL H 4.380 . 4.380 3.913 3.410 4.411 0.031 9 0 "[ . 1]" 1
880 1 55 SER HB2 1 57 VAL MG1 4.180 . 4.180 3.548 3.038 4.198 0.018 2 0 "[ . 1]" 1
881 1 56 GLY H 1 57 VAL H 4.530 . 4.530 3.072 2.723 3.498 . 0 0 "[ . 1]" 1
882 1 56 GLY H 1 57 VAL MG2 5.500 . 5.500 4.737 4.011 5.571 0.071 3 0 "[ . 1]" 1
883 1 56 GLY HA2 1 57 VAL HA 5.300 . 5.300 4.531 4.520 4.552 . 0 0 "[ . 1]" 1
884 1 56 GLY HA2 1 57 VAL MG1 5.380 . 5.380 4.564 4.448 4.798 . 0 0 "[ . 1]" 1
885 1 56 GLY HA3 1 57 VAL MG1 5.090 . 5.090 4.614 4.267 5.107 0.017 6 0 "[ . 1]" 1
886 1 57 VAL H 1 57 VAL MG1 3.140 . 3.140 2.418 2.012 2.928 . 0 0 "[ . 1]" 1
887 1 57 VAL H 1 58 ASN H 3.790 . 3.790 2.374 2.346 2.410 . 0 0 "[ . 1]" 1
888 1 57 VAL HA 1 57 VAL HB 2.740 . 2.740 2.429 2.369 2.525 . 0 0 "[ . 1]" 1
889 1 57 VAL HA 1 57 VAL MG1 3.320 . 3.320 2.582 2.124 3.216 . 0 0 "[ . 1]" 1
890 1 57 VAL HA 1 57 VAL QG 2.870 . 2.870 2.266 2.096 2.366 . 0 0 "[ . 1]" 1
891 1 57 VAL HA 1 57 VAL MG2 3.660 . 3.660 2.941 2.273 3.218 . 0 0 "[ . 1]" 1
892 1 57 VAL HA 1 58 ASN H 3.580 . 3.580 3.513 3.312 3.597 0.017 5 0 "[ . 1]" 1
893 1 57 VAL HB 1 58 ASN H 4.290 . 4.290 3.911 3.439 4.332 0.042 10 0 "[ . 1]" 1
894 1 57 VAL HB 1 58 ASN HD22 4.700 . 4.700 4.330 2.575 4.865 0.165 8 0 "[ . 1]" 1
895 1 57 VAL QG 1 58 ASN H 4.250 . 4.250 2.187 1.770 2.901 0.030 5 0 "[ . 1]" 1
896 1 57 VAL QG 1 58 ASN HD21 4.360 . 4.360 3.334 1.813 4.359 . 0 0 "[ . 1]" 1
897 1 57 VAL QG 1 58 ASN HD22 4.410 . 4.410 3.449 1.866 4.583 0.173 10 0 "[ . 1]" 1
898 1 57 VAL MG2 1 58 ASN H 4.550 . 4.550 2.696 1.897 3.639 . 0 0 "[ . 1]" 1
899 1 57 VAL MG2 1 58 ASN HA 4.760 . 4.760 4.231 3.869 4.763 0.003 3 0 "[ . 1]" 1
900 1 57 VAL MG2 1 58 ASN HB2 4.890 . 4.890 4.319 2.428 4.856 . 0 0 "[ . 1]" 1
901 1 57 VAL MG2 1 58 ASN HD21 4.920 . 4.920 3.548 1.870 4.544 . 0 0 "[ . 1]" 1
902 1 57 VAL MG2 1 58 ASN HD22 5.130 . 5.130 3.729 2.031 5.179 0.049 10 0 "[ . 1]" 1
903 1 58 ASN HA 1 58 ASN HD22 5.040 . 5.040 4.931 4.442 5.126 0.086 3 0 "[ . 1]" 1
904 1 58 ASN HA 1 59 PHE QD 4.020 . 4.020 3.966 3.323 4.226 0.206 6 0 "[ . 1]" 1
905 1 58 ASN HA 1 87 LEU HA 4.740 . 4.740 4.942 4.834 5.007 0.267 7 0 "[ . 1]" 1
906 1 58 ASN HB2 1 58 ASN HD22 4.110 . 4.110 3.715 3.418 4.044 . 0 0 "[ . 1]" 1
907 1 58 ASN HB2 1 59 PHE QD 5.350 . 5.350 2.144 1.756 3.024 0.044 5 0 "[ . 1]" 1
908 1 58 ASN HB3 1 59 PHE QE 4.060 . 4.060 3.406 2.548 4.119 0.059 6 0 "[ . 1]" 1
909 1 59 PHE HA 1 59 PHE QD 3.310 . 3.310 3.233 2.901 3.363 0.053 10 0 "[ . 1]" 1
910 1 59 PHE HA 1 61 ARG H 5.500 . 5.500 4.687 3.658 5.092 . 0 0 "[ . 1]" 1
911 1 59 PHE HA 1 64 PHE QE 3.630 . 3.630 3.341 2.865 3.635 0.005 1 0 "[ . 1]" 1
912 1 59 PHE HB2 1 60 ASN H 3.220 . 3.220 2.685 2.368 2.958 . 0 0 "[ . 1]" 1
913 1 59 PHE HB2 1 60 ASN HD22 4.460 . 4.460 3.743 3.317 4.049 . 0 0 "[ . 1]" 1
914 1 59 PHE HB2 1 64 PHE QE 4.050 . 4.050 4.007 3.793 4.109 0.059 10 0 "[ . 1]" 1
915 1 59 PHE HB3 1 60 ASN H 5.500 . 5.500 2.134 2.036 2.205 . 0 0 "[ . 1]" 1
916 1 59 PHE HB3 1 60 ASN HD21 4.480 . 4.480 4.282 3.854 4.493 0.013 2 0 "[ . 1]" 1
917 1 59 PHE HB3 1 60 ASN HD22 5.020 . 5.020 4.514 4.217 4.765 . 0 0 "[ . 1]" 1
918 1 59 PHE HB3 1 64 PHE QD 3.950 . 3.950 4.026 3.978 4.104 0.154 10 0 "[ . 1]" 1
919 1 59 PHE HB3 1 64 PHE QE 3.520 . 3.520 2.743 2.246 2.899 . 0 0 "[ . 1]" 1
920 1 59 PHE HB3 1 97 TYR QE 4.930 . 4.930 4.248 3.983 4.470 . 0 0 "[ . 1]" 1
921 1 59 PHE QD 1 64 PHE HZ 3.450 . 3.450 1.871 1.756 2.351 0.044 3 0 "[ . 1]" 1
922 1 59 PHE QD 1 68 ILE MD 4.220 . 4.220 4.310 4.248 4.357 0.137 10 0 "[ . 1]" 1
923 1 59 PHE QD 1 87 LEU HA 4.180 . 4.180 3.957 3.524 4.262 0.082 10 0 "[ . 1]" 1
924 1 59 PHE QD 1 87 LEU MD2 3.610 . 3.610 1.950 1.773 2.333 0.027 7 0 "[ . 1]" 1
925 1 59 PHE QD 1 87 LEU HG 3.950 . 3.950 3.403 2.923 3.808 . 0 0 "[ . 1]" 1
926 1 59 PHE QD 1 93 GLN QB 4.220 . 4.220 4.146 3.948 4.277 0.057 8 0 "[ . 1]" 1
927 1 59 PHE QD 1 93 GLN QG 4.630 . 4.630 4.652 4.527 4.728 0.098 2 0 "[ . 1]" 1
928 1 59 PHE QD 1 94 VAL QG 4.050 . 4.050 4.235 4.141 4.293 0.243 4 0 "[ . 1]" 1
929 1 59 PHE QD 1 97 TYR QE 3.910 . 3.910 3.200 3.072 3.433 . 0 0 "[ . 1]" 1
930 1 59 PHE QE 1 64 PHE HZ 4.150 . 4.150 3.926 3.748 4.007 . 0 0 "[ . 1]" 1
931 1 59 PHE QE 1 87 LEU MD2 3.950 . 3.950 1.852 1.785 1.968 0.015 4 0 "[ . 1]" 1
932 1 59 PHE QE 1 90 ASN HD22 3.080 . 3.080 2.205 2.010 2.732 . 0 0 "[ . 1]" 1
933 1 59 PHE QE 1 93 GLN QB 3.210 . 3.210 2.542 2.186 3.050 . 0 0 "[ . 1]" 1
934 1 59 PHE QE 1 93 GLN QG 3.580 . 3.580 3.387 2.991 3.614 0.034 10 0 "[ . 1]" 1
935 1 59 PHE QE 1 94 VAL HA 3.880 . 3.880 2.810 2.481 3.153 . 0 0 "[ . 1]" 1
936 1 59 PHE QE 1 94 VAL QG 3.540 . 3.540 2.569 2.417 2.715 . 0 0 "[ . 1]" 1
937 1 59 PHE QE 1 97 TYR QE 3.460 . 3.460 2.900 2.776 2.989 . 0 0 "[ . 1]" 1
938 1 60 ASN H 1 60 ASN HB2 3.790 . 3.790 3.647 3.563 3.739 . 0 0 "[ . 1]" 1
939 1 60 ASN H 1 60 ASN HB3 4.180 . 4.180 4.071 3.997 4.140 . 0 0 "[ . 1]" 1
940 1 60 ASN H 1 60 ASN HD22 4.500 . 4.500 3.824 3.496 4.139 . 0 0 "[ . 1]" 1
941 1 60 ASN H 1 61 ARG H 4.000 . 4.000 3.049 2.737 3.350 . 0 0 "[ . 1]" 1
942 1 60 ASN H 1 61 ARG HG2 4.540 . 4.540 3.111 2.837 3.295 . 0 0 "[ . 1]" 1
943 1 60 ASN H 1 61 ARG HG3 5.500 . 5.500 4.542 4.349 4.791 . 0 0 "[ . 1]" 1
944 1 60 ASN HA 1 60 ASN HB3 3.050 . 3.050 2.442 2.399 2.518 . 0 0 "[ . 1]" 1
945 1 60 ASN HA 1 60 ASN HD21 3.800 . 3.800 1.945 1.833 2.107 . 0 0 "[ . 1]" 1
946 1 60 ASN HA 1 61 ARG H 2.810 . 2.810 2.305 2.158 2.637 . 0 0 "[ . 1]" 1
947 1 60 ASN HA 1 65 GLN QG 2.880 . 2.880 2.905 2.737 3.010 0.130 7 0 "[ . 1]" 1
948 1 60 ASN HB2 1 61 ARG H 4.680 . 4.680 4.427 4.298 4.509 . 0 0 "[ . 1]" 1
949 1 60 ASN HD21 1 65 GLN HA 5.500 . 5.500 5.019 4.821 5.343 . 0 0 "[ . 1]" 1
950 1 60 ASN HD21 1 65 GLN QG 3.770 . 3.770 3.710 3.562 3.794 0.024 8 0 "[ . 1]" 1
951 1 60 ASN HD22 1 64 PHE QE 4.550 . 4.550 4.612 4.583 4.657 0.107 3 0 "[ . 1]" 1
952 1 61 ARG H 1 61 ARG HB3 3.960 . 3.960 3.797 3.594 3.905 . 0 0 "[ . 1]" 1
953 1 61 ARG H 1 61 ARG HG2 4.020 . 4.020 2.130 1.802 2.314 . 0 0 "[ . 1]" 1
954 1 61 ARG H 1 64 PHE HB2 3.960 . 3.960 3.649 3.451 3.977 0.017 8 0 "[ . 1]" 1
955 1 61 ARG H 1 64 PHE HB3 4.910 . 4.910 2.061 1.856 2.431 . 0 0 "[ . 1]" 1
956 1 61 ARG H 1 64 PHE QD 5.190 . 5.190 2.673 1.873 3.001 . 0 0 "[ . 1]" 1
957 1 61 ARG H 1 65 GLN H 4.810 . 4.810 3.196 2.974 3.546 . 0 0 "[ . 1]" 1
958 1 61 ARG H 1 65 GLN QG 3.810 . 3.810 2.795 2.537 3.243 . 0 0 "[ . 1]" 1
959 1 61 ARG HA 1 62 PRO HD2 3.570 . 3.570 2.426 2.382 2.544 . 0 0 "[ . 1]" 1
960 1 61 ARG HA 1 62 PRO HD3 3.180 . 3.180 2.659 2.581 2.770 . 0 0 "[ . 1]" 1
961 1 61 ARG HA 1 62 PRO HG3 4.630 . 4.630 4.713 4.669 4.777 0.147 6 0 "[ . 1]" 1
962 1 61 ARG HB3 1 64 PHE H 3.880 . 3.880 3.924 3.888 3.982 0.102 9 0 "[ . 1]" 1
963 1 61 ARG HB3 1 64 PHE HB3 3.830 . 3.830 3.545 3.449 3.649 . 0 0 "[ . 1]" 1
964 1 61 ARG HB3 1 65 GLN QG 5.460 . 5.460 5.505 5.470 5.538 0.078 4 0 "[ . 1]" 1
965 1 61 ARG QD 1 64 PHE QE 4.710 . 4.710 4.702 4.436 4.876 0.166 8 0 "[ . 1]" 1
966 1 61 ARG HG2 1 64 PHE HB3 3.440 . 3.440 2.257 1.906 2.715 . 0 0 "[ . 1]" 1
967 1 61 ARG HG2 1 64 PHE QD 3.920 . 3.920 3.016 2.805 3.202 . 0 0 "[ . 1]" 1
968 1 61 ARG HG2 1 64 PHE QE 4.200 . 4.200 4.281 4.227 4.372 0.172 1 0 "[ . 1]" 1
969 1 61 ARG HG3 1 62 PRO HD2 4.400 . 4.400 4.464 4.304 4.538 0.138 5 0 "[ . 1]" 1
970 1 61 ARG HG3 1 64 PHE HB3 2.750 . 2.750 2.452 1.841 2.771 0.021 6 0 "[ . 1]" 1
971 1 61 ARG HG3 1 64 PHE QD 3.810 . 3.810 2.555 2.342 2.890 . 0 0 "[ . 1]" 1
972 1 61 ARG HG3 1 64 PHE QE 4.310 . 4.310 4.403 4.297 4.484 0.174 5 0 "[ . 1]" 1
973 1 62 PRO HA 1 65 GLN H 3.960 . 3.960 3.686 3.543 3.800 . 0 0 "[ . 1]" 1
974 1 62 PRO HA 1 65 GLN QG 4.460 . 4.460 3.707 3.200 4.046 . 0 0 "[ . 1]" 1
975 1 62 PRO HB2 1 63 GLY H 3.960 . 3.960 2.255 2.112 2.483 . 0 0 "[ . 1]" 1
976 1 62 PRO HB2 1 63 GLY HA3 4.680 . 4.680 4.155 4.057 4.320 . 0 0 "[ . 1]" 1
977 1 62 PRO HB3 1 63 GLY H 4.320 . 4.320 3.607 3.523 3.726 . 0 0 "[ . 1]" 1
978 1 62 PRO HG2 1 63 GLY H 4.110 . 4.110 1.912 1.816 2.042 . 0 0 "[ . 1]" 1
979 1 62 PRO HG3 1 63 GLY H 3.890 . 3.890 3.481 3.389 3.596 . 0 0 "[ . 1]" 1
980 1 63 GLY H 1 64 PHE H 3.580 . 3.580 2.660 2.624 2.727 . 0 0 "[ . 1]" 1
981 1 63 GLY HA3 1 65 GLN H 4.860 . 4.860 4.780 4.714 4.884 0.024 7 0 "[ . 1]" 1
982 1 63 GLY HA3 1 66 SER H 4.590 . 4.590 4.535 4.453 4.605 0.015 2 0 "[ . 1]" 1
983 1 64 PHE H 1 64 PHE HB2 3.750 . 3.750 2.481 2.429 2.565 . 0 0 "[ . 1]" 1
984 1 64 PHE H 1 64 PHE HB3 3.780 . 3.780 2.456 2.384 2.528 . 0 0 "[ . 1]" 1
985 1 64 PHE H 1 64 PHE QD 4.060 . 4.060 4.135 4.115 4.147 0.087 10 0 "[ . 1]" 1
986 1 64 PHE H 1 65 GLN H 3.870 . 3.870 2.613 2.533 2.674 . 0 0 "[ . 1]" 1
987 1 64 PHE HA 1 64 PHE QD 3.270 . 3.270 3.115 2.729 3.216 . 0 0 "[ . 1]" 1
988 1 64 PHE HA 1 67 LEU H 3.930 . 3.930 3.052 2.860 3.150 . 0 0 "[ . 1]" 1
989 1 64 PHE HA 1 67 LEU HB2 3.950 . 3.950 3.579 3.451 3.673 . 0 0 "[ . 1]" 1
990 1 64 PHE HA 1 67 LEU HB3 3.350 . 3.350 2.095 2.028 2.198 . 0 0 "[ . 1]" 1
991 1 64 PHE HA 1 67 LEU MD1 4.520 . 4.520 4.590 4.505 4.636 0.116 4 0 "[ . 1]" 1
992 1 64 PHE HA 1 67 LEU MD2 3.850 . 3.850 2.408 2.211 2.711 . 0 0 "[ . 1]" 1
993 1 64 PHE HA 1 68 ILE H 4.100 . 4.100 3.944 3.814 4.124 0.024 6 0 "[ . 1]" 1
994 1 64 PHE HB2 1 65 GLN H 3.830 . 3.830 3.823 3.731 3.897 0.067 8 0 "[ . 1]" 1
995 1 64 PHE HB3 1 65 GLN H 4.250 . 4.250 2.523 2.406 2.584 . 0 0 "[ . 1]" 1
996 1 64 PHE QD 1 65 GLN H 3.910 . 3.910 3.277 3.189 3.421 . 0 0 "[ . 1]" 1
997 1 64 PHE QD 1 65 GLN HA 3.880 . 3.880 2.845 2.653 3.411 . 0 0 "[ . 1]" 1
998 1 64 PHE QD 1 65 GLN QG 4.190 . 4.190 3.399 3.258 3.570 . 0 0 "[ . 1]" 1
999 1 64 PHE QD 1 67 LEU H 4.770 . 4.770 4.764 4.662 4.951 0.181 9 0 "[ . 1]" 1
1000 1 64 PHE QD 1 67 LEU MD2 3.610 . 3.610 2.710 1.842 2.976 . 0 0 "[ . 1]" 1
1001 1 64 PHE QD 1 68 ILE H 4.280 . 4.280 3.690 3.377 4.356 0.076 8 0 "[ . 1]" 1
1002 1 64 PHE QD 1 87 LEU HG 3.760 . 3.760 3.734 3.554 3.854 0.094 8 0 "[ . 1]" 1
1003 1 64 PHE QE 1 65 GLN HA 4.540 . 4.540 4.444 4.289 4.621 0.081 8 0 "[ . 1]" 1
1004 1 64 PHE QE 1 65 GLN QG 4.880 . 4.880 4.813 4.633 4.954 0.074 6 0 "[ . 1]" 1
1005 1 64 PHE QE 1 67 LEU MD2 3.760 . 3.760 2.968 2.209 3.235 . 0 0 "[ . 1]" 1
1006 1 64 PHE QE 1 67 LEU HG 4.000 . 4.000 4.049 3.824 4.175 0.175 10 0 "[ . 1]" 1
1007 1 64 PHE QE 1 68 ILE HA 5.090 . 5.090 4.755 4.363 5.189 0.099 8 0 "[ . 1]" 1
1008 1 64 PHE QE 1 68 ILE MD 3.340 . 3.340 2.365 1.861 2.986 . 0 0 "[ . 1]" 1
1009 1 64 PHE QE 1 87 LEU MD1 3.430 . 3.430 3.399 3.144 3.512 0.082 10 0 "[ . 1]" 1
1010 1 64 PHE QE 1 87 LEU MD2 3.510 . 3.510 2.312 1.961 2.957 . 0 0 "[ . 1]" 1
1011 1 64 PHE QE 1 87 LEU HG 4.040 . 4.040 2.116 1.875 3.042 . 0 0 "[ . 1]" 1
1012 1 64 PHE HZ 1 67 LEU MD2 4.750 . 4.750 3.703 3.427 3.983 . 0 0 "[ . 1]" 1
1013 1 64 PHE HZ 1 68 ILE MD 3.750 . 3.750 2.901 2.382 3.314 . 0 0 "[ . 1]" 1
1014 1 64 PHE HZ 1 68 ILE QG 4.170 . 4.170 4.087 3.693 4.285 0.115 7 0 "[ . 1]" 1
1015 1 64 PHE HZ 1 87 LEU MD1 4.760 . 4.760 4.758 4.526 4.861 0.101 7 0 "[ . 1]" 1
1016 1 64 PHE HZ 1 87 LEU MD2 4.020 . 4.020 2.473 2.059 2.884 . 0 0 "[ . 1]" 1
1017 1 64 PHE HZ 1 87 LEU HG 5.130 . 5.130 3.949 3.557 4.491 . 0 0 "[ . 1]" 1
1018 1 65 GLN H 1 65 GLN QB 3.370 . 3.370 2.223 2.180 2.260 . 0 0 "[ . 1]" 1
1019 1 65 GLN H 1 65 GLN QG 3.340 . 3.340 2.794 2.608 3.033 . 0 0 "[ . 1]" 1
1020 1 65 GLN H 1 66 SER H 3.390 . 3.390 2.607 2.540 2.653 . 0 0 "[ . 1]" 1
1021 1 65 GLN H 1 67 LEU H 4.180 . 4.180 4.105 4.026 4.191 0.011 4 0 "[ . 1]" 1
1022 1 65 GLN H 1 67 LEU HB3 5.360 . 5.360 4.762 4.675 4.859 . 0 0 "[ . 1]" 1
1023 1 65 GLN HA 1 65 GLN QG 3.060 . 3.060 2.186 2.088 2.283 . 0 0 "[ . 1]" 1
1024 1 65 GLN HA 1 66 SER H 3.400 . 3.400 3.476 3.460 3.492 0.092 1 0 "[ . 1]" 1
1025 1 65 GLN HA 1 68 ILE H 3.530 . 3.530 3.278 3.188 3.376 . 0 0 "[ . 1]" 1
1026 1 65 GLN HA 1 68 ILE HB 3.340 . 3.340 2.745 2.396 3.019 . 0 0 "[ . 1]" 1
1027 1 65 GLN HA 1 68 ILE MG 3.740 . 3.740 2.675 2.017 3.778 0.038 3 0 "[ . 1]" 1
1028 1 65 GLN HA 1 69 LYS H 3.970 . 3.970 3.772 3.680 3.913 . 0 0 "[ . 1]" 1
1029 1 65 GLN QB 1 66 SER H 3.630 . 3.630 2.911 2.843 2.998 . 0 0 "[ . 1]" 1
1030 1 65 GLN QG 1 66 SER H 4.510 . 4.510 4.417 4.371 4.476 . 0 0 "[ . 1]" 1
1031 1 66 SER H 1 66 SER HB2 2.970 . 2.970 2.298 2.112 2.571 . 0 0 "[ . 1]" 1
1032 1 66 SER H 1 66 SER HB3 3.140 . 3.140 2.928 2.544 3.204 0.064 4 0 "[ . 1]" 1
1033 1 66 SER H 1 67 LEU H 3.380 . 3.380 2.432 2.390 2.465 . 0 0 "[ . 1]" 1
1034 1 66 SER H 1 67 LEU HB2 5.320 . 5.320 5.429 5.379 5.459 0.139 6 0 "[ . 1]" 1
1035 1 66 SER H 1 67 LEU HB3 4.040 . 4.040 4.068 4.044 4.110 0.070 8 0 "[ . 1]" 1
1036 1 66 SER HA 1 69 LYS H 3.640 . 3.640 3.238 3.099 3.366 . 0 0 "[ . 1]" 1
1037 1 66 SER HA 1 69 LYS QB 2.920 . 2.920 2.217 1.788 2.513 0.012 10 0 "[ . 1]" 1
1038 1 66 SER HA 1 69 LYS QD 4.280 . 4.280 3.812 3.468 4.388 0.108 10 0 "[ . 1]" 1
1039 1 66 SER HA 1 69 LYS HG3 4.540 . 4.540 4.090 3.698 4.513 . 0 0 "[ . 1]" 1
1040 1 66 SER HB2 1 67 LEU H 3.630 . 3.630 3.402 3.039 3.691 0.061 7 0 "[ . 1]" 1
1041 1 66 SER HB2 1 69 LYS QB 4.810 . 4.810 4.643 4.380 4.840 0.030 8 0 "[ . 1]" 1
1042 1 66 SER HB3 1 67 LEU H 3.370 . 3.370 2.652 2.379 2.877 . 0 0 "[ . 1]" 1
1043 1 66 SER HB3 1 67 LEU HB3 4.620 . 4.620 4.378 4.090 4.601 . 0 0 "[ . 1]" 1
1044 1 67 LEU H 1 67 LEU HB2 3.600 . 3.600 3.072 3.035 3.113 . 0 0 "[ . 1]" 1
1045 1 67 LEU H 1 67 LEU HB3 3.530 . 3.530 2.006 1.982 2.025 . 0 0 "[ . 1]" 1
1046 1 67 LEU H 1 67 LEU MD1 4.150 . 4.150 4.264 4.234 4.295 0.145 2 0 "[ . 1]" 1
1047 1 67 LEU H 1 67 LEU MD2 3.920 . 3.920 3.908 3.844 3.939 0.019 9 0 "[ . 1]" 1
1048 1 67 LEU H 1 67 LEU HG 3.930 . 3.930 3.839 3.792 3.886 . 0 0 "[ . 1]" 1
1049 1 67 LEU HA 1 67 LEU MD1 3.190 . 3.190 2.761 2.582 2.839 . 0 0 "[ . 1]" 1
1050 1 67 LEU HA 1 67 LEU MD2 3.990 . 3.990 4.062 4.032 4.084 0.094 6 0 "[ . 1]" 1
1051 1 67 LEU HA 1 67 LEU HG 3.980 . 3.980 3.596 3.555 3.637 . 0 0 "[ . 1]" 1
1052 1 67 LEU HA 1 68 ILE H 3.620 . 3.620 3.563 3.548 3.569 . 0 0 "[ . 1]" 1
1053 1 67 LEU HA 1 69 LYS H 4.900 . 4.900 4.409 4.257 4.539 . 0 0 "[ . 1]" 1
1054 1 67 LEU HA 1 70 GLU H 4.700 . 4.700 3.718 3.577 3.871 . 0 0 "[ . 1]" 1
1055 1 67 LEU HA 1 70 GLU QB 3.720 . 3.720 3.442 3.044 3.761 0.041 4 0 "[ . 1]" 1
1056 1 67 LEU HA 1 71 VAL H 5.500 . 5.500 4.661 4.607 4.716 . 0 0 "[ . 1]" 1
1057 1 67 LEU HB2 1 68 ILE H 4.050 . 4.050 4.013 3.943 4.073 0.023 9 0 "[ . 1]" 1
1058 1 67 LEU HB2 1 79 LEU MD2 3.820 . 3.820 3.915 3.867 3.976 0.156 9 0 "[ . 1]" 1
1059 1 67 LEU MD1 1 68 ILE H 5.370 . 5.370 3.624 3.471 3.714 . 0 0 "[ . 1]" 1
1060 1 67 LEU MD1 1 68 ILE HA 4.680 . 4.680 3.306 3.181 3.478 . 0 0 "[ . 1]" 1
1061 1 67 LEU MD1 1 70 GLU H 5.500 . 5.500 4.559 4.323 4.817 . 0 0 "[ . 1]" 1
1062 1 67 LEU MD1 1 70 GLU QB 4.200 . 4.200 3.849 3.549 4.189 . 0 0 "[ . 1]" 1
1063 1 67 LEU MD1 1 71 VAL H 4.610 . 4.610 3.921 3.804 4.107 . 0 0 "[ . 1]" 1
1064 1 67 LEU MD1 1 71 VAL MG2 3.750 . 3.750 2.276 2.154 2.398 . 0 0 "[ . 1]" 1
1065 1 67 LEU MD1 1 76 VAL HB 5.500 . 5.500 3.783 3.310 4.077 . 0 0 "[ . 1]" 1
1066 1 67 LEU MD1 1 76 VAL MG1 3.990 . 3.990 3.404 3.159 3.556 . 0 0 "[ . 1]" 1
1067 1 67 LEU MD1 1 76 VAL MG2 3.020 . 3.020 2.821 2.336 3.079 0.059 10 0 "[ . 1]" 1
1068 1 67 LEU MD1 1 79 LEU HA 5.200 . 5.200 4.490 4.147 4.654 . 0 0 "[ . 1]" 1
1069 1 67 LEU MD1 1 79 LEU MD1 3.850 . 3.850 3.293 3.157 3.400 . 0 0 "[ . 1]" 1
1070 1 67 LEU MD1 1 79 LEU MD2 3.600 . 3.600 1.786 1.728 1.847 0.072 1 0 "[ . 1]" 1
1071 1 67 LEU MD1 1 79 LEU HG 4.660 . 4.660 3.861 3.817 3.926 . 0 0 "[ . 1]" 1
1072 1 67 LEU MD1 1 102 PHE QE 4.670 . 4.670 3.862 3.751 3.990 . 0 0 "[ . 1]" 1
1073 1 67 LEU MD2 1 68 ILE H 4.030 . 4.030 3.637 3.486 3.823 . 0 0 "[ . 1]" 1
1074 1 67 LEU MD2 1 68 ILE HA 4.540 . 4.540 4.523 4.423 4.595 0.055 9 0 "[ . 1]" 1
1075 1 67 LEU MD2 1 79 LEU MD2 3.400 . 3.400 2.731 2.139 2.976 . 0 0 "[ . 1]" 1
1076 1 67 LEU HG 1 68 ILE HA 4.420 . 4.420 3.066 2.965 3.150 . 0 0 "[ . 1]" 1
1077 1 68 ILE H 1 68 ILE HB 3.280 . 3.280 2.222 2.125 2.371 . 0 0 "[ . 1]" 1
1078 1 68 ILE H 1 68 ILE MD 3.860 . 3.860 3.534 3.347 3.689 . 0 0 "[ . 1]" 1
1079 1 68 ILE H 1 68 ILE MG 3.640 . 3.640 3.163 2.796 3.726 0.086 6 0 "[ . 1]" 1
1080 1 68 ILE H 1 69 LYS H 3.460 . 3.460 2.614 2.553 2.653 . 0 0 "[ . 1]" 1
1081 1 68 ILE HA 1 68 ILE MD 3.100 . 3.100 1.866 1.734 2.025 0.066 7 0 "[ . 1]" 1
1082 1 68 ILE HA 1 68 ILE QG 4.020 . 4.020 2.639 2.458 2.784 . 0 0 "[ . 1]" 1
1083 1 68 ILE HA 1 68 ILE MG 3.180 . 3.180 2.940 2.569 3.129 . 0 0 "[ . 1]" 1
1084 1 68 ILE HA 1 70 GLU H 4.210 . 4.210 4.078 4.033 4.205 . 0 0 "[ . 1]" 1
1085 1 68 ILE HA 1 71 VAL H 3.580 . 3.580 3.027 2.967 3.136 . 0 0 "[ . 1]" 1
1086 1 68 ILE HA 1 71 VAL HB 3.110 . 3.110 2.565 2.323 2.814 . 0 0 "[ . 1]" 1
1087 1 68 ILE HA 1 71 VAL MG2 3.480 . 3.480 1.848 1.760 2.012 0.040 10 0 "[ . 1]" 1
1088 1 68 ILE HA 1 72 GLU H 3.940 . 3.940 3.935 3.896 3.979 0.039 7 0 "[ . 1]" 1
1089 1 68 ILE HB 1 68 ILE MD 3.650 . 3.650 2.717 2.364 3.248 . 0 0 "[ . 1]" 1
1090 1 68 ILE HB 1 69 LYS H 3.810 . 3.810 3.309 2.746 3.603 . 0 0 "[ . 1]" 1
1091 1 68 ILE MD 1 68 ILE MG 3.630 . 3.630 2.854 1.861 3.271 . 0 0 "[ . 1]" 1
1092 1 68 ILE MD 1 69 LYS H 4.760 . 4.760 4.733 4.681 4.807 0.047 6 0 "[ . 1]" 1
1093 1 68 ILE MD 1 71 VAL H 4.520 . 4.520 4.323 4.147 4.528 0.008 6 0 "[ . 1]" 1
1094 1 68 ILE MD 1 71 VAL HB 3.770 . 3.770 2.921 2.565 3.080 . 0 0 "[ . 1]" 1
1095 1 68 ILE MD 1 71 VAL MG1 3.210 . 3.210 3.189 2.946 3.285 0.075 8 0 "[ . 1]" 1
1096 1 68 ILE MD 1 72 GLU H 4.810 . 4.810 4.670 4.490 4.766 . 0 0 "[ . 1]" 1
1097 1 68 ILE MD 1 97 TYR QD 3.390 . 3.390 3.155 2.649 3.402 0.012 7 0 "[ . 1]" 1
1098 1 68 ILE MD 1 97 TYR QE 3.360 . 3.360 3.035 2.719 3.371 0.011 8 0 "[ . 1]" 1
1099 1 68 ILE MD 1 101 LEU HG 3.460 . 3.460 3.584 3.527 3.637 0.177 7 0 "[ . 1]" 1
1100 1 68 ILE MD 1 102 PHE QE 3.270 . 3.270 2.948 2.580 3.170 . 0 0 "[ . 1]" 1
1101 1 68 ILE QG 1 97 TYR QE 4.630 . 4.630 3.932 3.121 4.635 0.005 6 0 "[ . 1]" 1
1102 1 68 ILE MG 1 69 LYS H 4.030 . 4.030 2.607 2.231 3.294 . 0 0 "[ . 1]" 1
1103 1 68 ILE MG 1 69 LYS HA 3.220 . 3.220 2.968 2.801 3.251 0.031 10 0 "[ . 1]" 1
1104 1 68 ILE MG 1 72 GLU HG3 3.910 . 3.910 3.985 3.914 4.021 0.111 8 0 "[ . 1]" 1
1105 1 69 LYS H 1 69 LYS QB 2.790 . 2.790 2.174 2.050 2.266 . 0 0 "[ . 1]" 1
1106 1 69 LYS H 1 69 LYS HG2 4.870 . 4.870 4.145 3.497 4.438 . 0 0 "[ . 1]" 1
1107 1 69 LYS H 1 69 LYS HG3 4.740 . 4.740 4.165 3.555 4.539 . 0 0 "[ . 1]" 1
1108 1 69 LYS H 1 70 GLU H 3.700 . 3.700 2.722 2.631 2.813 . 0 0 "[ . 1]" 1
1109 1 69 LYS H 1 71 VAL H 4.080 . 4.080 4.014 3.900 4.086 0.006 9 0 "[ . 1]" 1
1110 1 69 LYS H 1 72 GLU HG3 5.450 . 5.450 4.690 4.579 4.887 . 0 0 "[ . 1]" 1
1111 1 69 LYS HA 1 69 LYS QB 2.630 . 2.630 2.276 2.143 2.401 . 0 0 "[ . 1]" 1
1112 1 69 LYS HA 1 69 LYS QD 4.280 . 4.280 3.905 2.445 4.262 . 0 0 "[ . 1]" 1
1113 1 69 LYS HA 1 69 LYS QE 4.310 . 4.310 3.346 1.971 3.881 . 0 0 "[ . 1]" 1
1114 1 69 LYS HA 1 69 LYS HG2 4.050 . 4.050 3.241 2.345 4.157 0.107 8 0 "[ . 1]" 1
1115 1 69 LYS HA 1 69 LYS HG3 3.460 . 3.460 3.324 3.191 3.462 0.002 8 0 "[ . 1]" 1
1116 1 69 LYS HA 1 70 GLU H 3.590 . 3.590 3.508 3.491 3.541 . 0 0 "[ . 1]" 1
1117 1 69 LYS HA 1 72 GLU H 3.590 . 3.590 3.538 3.440 3.600 0.010 8 0 "[ . 1]" 1
1118 1 69 LYS HA 1 72 GLU HG2 2.970 . 2.970 2.153 2.033 2.309 . 0 0 "[ . 1]" 1
1119 1 69 LYS QB 1 69 LYS QD 3.120 . 3.120 2.181 1.910 2.508 . 0 0 "[ . 1]" 1
1120 1 69 LYS QD 1 70 GLU HA 4.410 . 4.410 4.386 4.006 4.536 0.126 5 0 "[ . 1]" 1
1121 1 69 LYS QE 1 69 LYS HG3 3.410 . 3.410 2.772 2.052 3.330 . 0 0 "[ . 1]" 1
1122 1 69 LYS QE 1 70 GLU HA 4.400 . 4.400 3.053 2.324 4.000 . 0 0 "[ . 1]" 1
1123 1 69 LYS QE 1 72 GLU HG2 4.960 . 4.960 4.739 3.516 5.024 0.064 5 0 "[ . 1]" 1
1124 1 69 LYS QE 1 72 GLU HG3 5.100 . 5.100 3.662 2.667 4.208 . 0 0 "[ . 1]" 1
1125 1 69 LYS HG2 1 70 GLU H 4.290 . 4.290 4.014 3.350 4.388 0.098 7 0 "[ . 1]" 1
1126 1 70 GLU H 1 70 GLU QB 2.950 . 2.950 2.421 2.101 2.738 . 0 0 "[ . 1]" 1
1127 1 70 GLU H 1 71 VAL H 3.320 . 3.320 2.422 2.367 2.470 . 0 0 "[ . 1]" 1
1128 1 70 GLU H 1 71 VAL MG2 4.400 . 4.400 3.757 3.664 3.905 . 0 0 "[ . 1]" 1
1129 1 70 GLU H 1 72 GLU HG2 4.500 . 4.500 4.564 4.526 4.593 0.093 9 0 "[ . 1]" 1
1130 1 70 GLU HA 1 72 GLU HG3 4.160 . 4.160 4.288 4.246 4.357 0.197 1 0 "[ . 1]" 1
1131 1 70 GLU HA 1 73 ALA MB 3.260 . 3.260 2.838 2.621 2.959 . 0 0 "[ . 1]" 1
1132 1 70 GLU HA 1 75 ASN H 4.600 . 4.600 3.852 3.631 4.342 . 0 0 "[ . 1]" 1
1133 1 70 GLU HA 1 75 ASN HB2 3.760 . 3.760 2.699 2.621 2.894 . 0 0 "[ . 1]" 1
1134 1 70 GLU HA 1 75 ASN HB3 3.960 . 3.960 4.104 4.048 4.137 0.177 1 0 "[ . 1]" 1
1135 1 70 GLU HA 1 75 ASN HD21 3.800 . 3.800 3.310 2.935 3.547 . 0 0 "[ . 1]" 1
1136 1 70 GLU HA 1 75 ASN HD22 4.710 . 4.710 4.683 4.351 4.839 0.129 1 0 "[ . 1]" 1
1137 1 70 GLU HA 1 76 VAL QG 5.160 . 5.160 4.544 4.391 4.722 . 0 0 "[ . 1]" 1
1138 1 70 GLU QB 1 71 VAL H 3.990 . 3.990 2.694 2.584 2.803 . 0 0 "[ . 1]" 1
1139 1 70 GLU QB 1 75 ASN HB3 4.090 . 4.090 3.139 2.864 3.542 . 0 0 "[ . 1]" 1
1140 1 70 GLU QB 1 75 ASN HD22 5.500 . 5.500 5.337 5.055 5.566 0.066 6 0 "[ . 1]" 1
1141 1 70 GLU QB 1 76 VAL MG1 3.710 . 3.710 3.045 2.847 3.250 . 0 0 "[ . 1]" 1
1142 1 70 GLU QB 1 76 VAL QG 3.330 . 3.330 2.881 2.732 3.014 . 0 0 "[ . 1]" 1
1143 1 71 VAL H 1 71 VAL HB 3.430 . 3.430 2.701 2.551 2.805 . 0 0 "[ . 1]" 1
1144 1 71 VAL H 1 71 VAL MG1 3.750 . 3.750 3.768 3.750 3.777 0.027 8 0 "[ . 1]" 1
1145 1 71 VAL H 1 71 VAL MG2 3.290 . 3.290 2.019 1.953 2.154 . 0 0 "[ . 1]" 1
1146 1 71 VAL H 1 72 GLU H 3.540 . 3.540 2.735 2.690 2.833 . 0 0 "[ . 1]" 1
1147 1 71 VAL H 1 73 ALA MB 5.500 . 5.500 4.893 4.740 4.964 . 0 0 "[ . 1]" 1
1148 1 71 VAL H 1 76 VAL QG 3.970 . 3.970 2.784 2.531 3.035 . 0 0 "[ . 1]" 1
1149 1 71 VAL HA 1 71 VAL MG1 3.370 . 3.370 2.248 2.196 2.347 . 0 0 "[ . 1]" 1
1150 1 71 VAL HA 1 71 VAL MG2 3.310 . 3.310 2.524 2.457 2.566 . 0 0 "[ . 1]" 1
1151 1 71 VAL HA 1 75 ASN H 5.030 . 5.030 3.385 3.155 3.619 . 0 0 "[ . 1]" 1
1152 1 71 VAL HA 1 76 VAL H 3.870 . 3.870 3.118 2.964 3.280 . 0 0 "[ . 1]" 1
1153 1 71 VAL HA 1 76 VAL HB 3.460 . 3.460 3.621 3.484 3.713 0.253 8 0 "[ . 1]" 1
1154 1 71 VAL HA 1 76 VAL QG 3.370 . 3.370 1.715 1.682 1.773 0.118 1 0 "[ . 1]" 1
1155 1 71 VAL HA 1 105 LYS HG2 3.950 . 3.950 4.023 3.895 4.084 0.134 5 0 "[ . 1]" 1
1156 1 71 VAL HB 1 72 GLU H 3.500 . 3.500 2.498 2.328 2.651 . 0 0 "[ . 1]" 1
1157 1 71 VAL MG1 1 72 GLU H 3.720 . 3.720 3.547 3.192 3.707 . 0 0 "[ . 1]" 1
1158 1 71 VAL MG1 1 72 GLU HA 4.230 . 4.230 3.661 3.381 3.811 . 0 0 "[ . 1]" 1
1159 1 71 VAL MG1 1 72 GLU QB 4.940 . 4.940 4.546 4.095 4.739 . 0 0 "[ . 1]" 1
1160 1 71 VAL MG1 1 102 PHE QD 3.160 . 3.160 2.345 2.237 2.728 . 0 0 "[ . 1]" 1
1161 1 71 VAL MG1 1 102 PHE QE 3.100 . 3.100 2.541 2.152 3.137 0.037 6 0 "[ . 1]" 1
1162 1 71 VAL MG1 1 105 LYS QE 3.690 . 3.690 2.725 1.766 3.448 0.034 1 0 "[ . 1]" 1
1163 1 71 VAL MG1 1 105 LYS HG2 4.420 . 4.420 4.539 4.482 4.643 0.223 6 0 "[ . 1]" 1
1164 1 71 VAL MG2 1 72 GLU H 4.170 . 4.170 3.700 3.616 3.784 . 0 0 "[ . 1]" 1
1165 1 71 VAL MG2 1 76 VAL H 4.710 . 4.710 4.059 3.931 4.167 . 0 0 "[ . 1]" 1
1166 1 71 VAL MG2 1 76 VAL HB 4.220 . 4.220 2.906 2.768 3.031 . 0 0 "[ . 1]" 1
1167 1 71 VAL MG2 1 102 PHE QD 3.630 . 3.630 3.707 3.666 3.740 0.110 2 0 "[ . 1]" 1
1168 1 71 VAL MG2 1 102 PHE QE 3.990 . 3.990 2.944 2.791 3.106 . 0 0 "[ . 1]" 1
1169 1 72 GLU H 1 72 GLU QB 3.480 . 3.480 2.822 2.764 2.883 . 0 0 "[ . 1]" 1
1170 1 72 GLU H 1 72 GLU HG2 3.290 . 3.290 2.183 2.076 2.329 . 0 0 "[ . 1]" 1
1171 1 72 GLU H 1 72 GLU HG3 3.430 . 3.430 2.192 2.049 2.327 . 0 0 "[ . 1]" 1
1172 1 72 GLU H 1 73 ALA H 3.180 . 3.180 2.697 2.593 2.755 . 0 0 "[ . 1]" 1
1173 1 72 GLU H 1 73 ALA MB 4.180 . 4.180 4.277 4.250 4.289 0.109 1 0 "[ . 1]" 1
1174 1 72 GLU HA 1 72 GLU HG2 3.650 . 3.650 3.724 3.684 3.787 0.137 9 0 "[ . 1]" 1
1175 1 72 GLU HA 1 72 GLU HG3 3.710 . 3.710 3.635 3.582 3.684 . 0 0 "[ . 1]" 1
1176 1 72 GLU HG3 1 73 ALA H 3.450 . 3.450 2.009 1.906 2.155 . 0 0 "[ . 1]" 1
1177 1 73 ALA H 1 73 ALA MB 2.760 . 2.760 2.040 2.000 2.141 . 0 0 "[ . 1]" 1
1178 1 73 ALA H 1 74 GLY H 3.550 . 3.550 2.605 2.533 2.693 . 0 0 "[ . 1]" 1
1179 1 73 ALA H 1 75 ASN H 5.160 . 5.160 4.208 3.937 4.434 . 0 0 "[ . 1]" 1
1180 1 73 ALA MB 1 74 GLY H 3.730 . 3.730 3.112 2.892 3.416 . 0 0 "[ . 1]" 1
1181 1 73 ALA MB 1 75 ASN HB2 4.010 . 4.010 3.221 3.074 3.359 . 0 0 "[ . 1]" 1
1182 1 73 ALA MB 1 75 ASN HB3 4.490 . 4.490 4.511 4.368 4.646 0.156 1 0 "[ . 1]" 1
1183 1 73 ALA MB 1 75 ASN HD21 3.460 . 3.460 3.310 2.916 3.519 0.059 1 0 "[ . 1]" 1
1184 1 73 ALA MB 1 75 ASN HD22 3.770 . 3.770 3.306 2.979 3.563 . 0 0 "[ . 1]" 1
1185 1 74 GLY H 1 74 GLY HA2 2.910 . 2.910 2.287 2.262 2.317 . 0 0 "[ . 1]" 1
1186 1 74 GLY H 1 76 VAL H 5.500 . 5.500 4.336 4.067 4.870 . 0 0 "[ . 1]" 1
1187 1 74 GLY HA3 1 75 ASN H 3.680 . 3.680 3.540 3.513 3.558 . 0 0 "[ . 1]" 1
1188 1 74 GLY HA3 1 75 ASN HA 4.930 . 4.930 4.617 4.604 4.633 . 0 0 "[ . 1]" 1
1189 1 74 GLY HA3 1 104 GLN HB2 3.670 . 3.670 3.869 3.822 3.913 0.243 7 0 "[ . 1]" 1
1190 1 74 GLY HA3 1 105 LYS HG2 2.780 . 2.780 2.815 2.642 2.905 0.125 9 0 "[ . 1]" 1
1191 1 75 ASN H 1 75 ASN HB2 3.270 . 3.270 2.321 2.237 2.421 . 0 0 "[ . 1]" 1
1192 1 75 ASN H 1 75 ASN HB3 3.440 . 3.440 3.536 3.507 3.594 0.154 5 0 "[ . 1]" 1
1193 1 75 ASN H 1 75 ASN HD21 5.070 . 5.070 4.535 4.227 4.738 . 0 0 "[ . 1]" 1
1194 1 75 ASN H 1 76 VAL H 3.420 . 3.420 2.188 2.079 2.426 . 0 0 "[ . 1]" 1
1195 1 75 ASN H 1 76 VAL MG1 4.100 . 4.100 3.395 3.201 3.728 . 0 0 "[ . 1]" 1
1196 1 75 ASN H 1 76 VAL QG 4.360 . 4.360 3.363 3.178 3.678 . 0 0 "[ . 1]" 1
1197 1 75 ASN H 1 105 LYS QE 5.500 . 5.500 4.769 3.921 4.973 . 0 0 "[ . 1]" 1
1198 1 75 ASN H 1 105 LYS HG2 3.140 . 3.140 2.988 2.361 3.204 0.064 7 0 "[ . 1]" 1
1199 1 75 ASN HB2 1 75 ASN HD22 3.570 . 3.570 3.540 3.478 3.613 0.043 5 0 "[ . 1]" 1
1200 1 75 ASN HB2 1 76 VAL H 5.070 . 5.070 2.578 2.353 2.765 . 0 0 "[ . 1]" 1
1201 1 75 ASN HB2 1 76 VAL QG 4.320 . 4.320 4.246 4.109 4.371 0.051 9 0 "[ . 1]" 1
1202 1 75 ASN HB3 1 75 ASN HD22 3.590 . 3.590 3.645 3.582 3.726 0.136 9 0 "[ . 1]" 1
1203 1 75 ASN HB3 1 76 VAL H 4.190 . 4.190 3.131 2.645 3.359 . 0 0 "[ . 1]" 1
1204 1 75 ASN HB3 1 76 VAL MG1 5.500 . 5.500 4.968 4.613 5.066 . 0 0 "[ . 1]" 1
1205 1 76 VAL H 1 76 VAL HB 3.370 . 3.370 2.498 2.405 2.531 . 0 0 "[ . 1]" 1
1206 1 76 VAL H 1 76 VAL MG1 3.510 . 3.510 2.319 2.222 2.572 . 0 0 "[ . 1]" 1
1207 1 76 VAL H 1 76 VAL QG 3.490 . 3.490 2.298 2.206 2.529 . 0 0 "[ . 1]" 1
1208 1 76 VAL HA 1 76 VAL MG1 3.670 . 3.670 3.197 3.188 3.210 . 0 0 "[ . 1]" 1
1209 1 76 VAL HA 1 76 VAL QG 3.270 . 3.270 2.232 2.199 2.274 . 0 0 "[ . 1]" 1
1210 1 76 VAL HA 1 76 VAL MG2 3.270 . 3.270 2.279 2.239 2.328 . 0 0 "[ . 1]" 1
1211 1 76 VAL HA 1 77 GLU H 3.090 . 3.090 2.225 2.097 2.360 . 0 0 "[ . 1]" 1
1212 1 76 VAL HA 1 78 THR H 4.080 . 4.080 3.197 3.084 3.341 . 0 0 "[ . 1]" 1
1213 1 76 VAL QG 1 77 GLU H 3.700 . 3.700 3.191 2.838 3.397 . 0 0 "[ . 1]" 1
1214 1 76 VAL QG 1 78 THR H 3.700 . 3.700 2.363 2.107 2.487 . 0 0 "[ . 1]" 1
1215 1 76 VAL MG1 1 77 GLU H 4.160 . 4.160 4.114 3.996 4.155 . 0 0 "[ . 1]" 1
1216 1 76 VAL MG1 1 78 THR H 4.310 . 4.310 4.066 3.859 4.178 . 0 0 "[ . 1]" 1
1217 1 76 VAL MG2 1 77 GLU H 3.930 . 3.930 3.333 2.904 3.623 . 0 0 "[ . 1]" 1
1218 1 76 VAL MG2 1 107 VAL HA 4.680 . 4.680 4.717 4.695 4.747 0.067 10 0 "[ . 1]" 1
1219 1 76 VAL MG2 1 107 VAL MG2 2.880 . 2.880 2.725 2.634 2.835 . 0 0 "[ . 1]" 1
1220 1 77 GLU H 1 77 GLU HB2 3.840 . 3.840 3.653 3.608 3.721 . 0 0 "[ . 1]" 1
1221 1 77 GLU H 1 77 GLU HB3 3.580 . 3.580 2.651 2.508 2.830 . 0 0 "[ . 1]" 1
1222 1 77 GLU H 1 77 GLU QG 4.120 . 4.120 2.341 2.246 2.605 . 0 0 "[ . 1]" 1
1223 1 77 GLU H 1 78 THR H 3.410 . 3.410 2.427 2.190 2.620 . 0 0 "[ . 1]" 1
1224 1 77 GLU HA 1 77 GLU QG 3.240 . 3.240 3.331 3.309 3.343 0.103 6 0 "[ . 1]" 1
1225 1 77 GLU HA 1 107 VAL MG2 4.150 . 4.150 3.598 3.363 3.984 . 0 0 "[ . 1]" 1
1226 1 77 GLU HB2 1 78 THR HA 5.400 . 5.400 5.193 5.067 5.384 . 0 0 "[ . 1]" 1
1227 1 77 GLU HB3 1 78 THR H 4.280 . 4.280 4.297 4.215 4.329 0.049 4 0 "[ . 1]" 1
1228 1 77 GLU QG 1 78 THR H 3.990 . 3.990 2.821 2.616 3.056 . 0 0 "[ . 1]" 1
1229 1 77 GLU QG 1 78 THR HB 4.360 . 4.360 3.868 3.579 4.285 . 0 0 "[ . 1]" 1
1230 1 78 THR H 1 78 THR HB 3.580 . 3.580 3.354 3.162 3.652 0.072 4 0 "[ . 1]" 1
1231 1 78 THR HA 1 78 THR MG 3.160 . 3.160 2.086 1.983 2.184 . 0 0 "[ . 1]" 1
1232 1 78 THR HA 1 79 LEU H 2.930 . 2.930 2.298 2.287 2.317 . 0 0 "[ . 1]" 1
1233 1 78 THR HA 1 79 LEU HA 4.330 . 4.330 4.422 4.410 4.432 0.102 4 0 "[ . 1]" 1
1234 1 78 THR HA 1 107 VAL HA 3.750 . 3.750 2.999 2.870 3.111 . 0 0 "[ . 1]" 1
1235 1 78 THR HA 1 107 VAL HB 4.690 . 4.690 4.703 4.523 4.777 0.087 8 0 "[ . 1]" 1
1236 1 78 THR HA 1 107 VAL MG2 3.820 . 3.820 2.221 1.964 2.302 . 0 0 "[ . 1]" 1
1237 1 78 THR HA 1 108 ARG H 3.430 . 3.430 1.773 1.757 1.819 0.043 6 0 "[ . 1]" 1
1238 1 78 THR HA 1 108 ARG HA 4.370 . 4.370 4.462 4.415 4.514 0.144 1 0 "[ . 1]" 1
1239 1 78 THR HA 1 108 ARG HB2 4.010 . 4.010 3.529 3.312 3.809 . 0 0 "[ . 1]" 1
1240 1 78 THR HA 1 108 ARG HB3 3.620 . 3.620 3.626 3.469 3.697 0.077 9 0 "[ . 1]" 1
1241 1 78 THR HB 1 79 LEU H 5.260 . 5.260 3.221 2.833 3.438 . 0 0 "[ . 1]" 1
1242 1 78 THR HB 1 80 ILE H 4.850 . 4.850 4.912 4.883 4.947 0.097 3 0 "[ . 1]" 1
1243 1 78 THR HB 1 80 ILE MD 4.510 . 4.510 2.679 2.514 2.904 . 0 0 "[ . 1]" 1
1244 1 78 THR MG 1 79 LEU H 3.230 . 3.230 2.503 2.298 3.020 . 0 0 "[ . 1]" 1
1245 1 78 THR MG 1 80 ILE MD 3.570 . 3.570 2.373 1.987 3.228 . 0 0 "[ . 1]" 1
1246 1 78 THR MG 1 107 VAL HA 3.980 . 3.980 4.035 3.844 4.106 0.126 9 0 "[ . 1]" 1
1247 1 78 THR MG 1 108 ARG H 4.480 . 4.480 2.481 2.409 2.701 . 0 0 "[ . 1]" 1
1248 1 78 THR MG 1 108 ARG HB2 4.360 . 4.360 2.196 2.017 2.603 . 0 0 "[ . 1]" 1
1249 1 78 THR MG 1 108 ARG HB3 3.980 . 3.980 1.801 1.720 1.942 0.080 1 0 "[ . 1]" 1
1250 1 79 LEU H 1 79 LEU HB2 3.790 . 3.790 2.951 2.908 3.005 . 0 0 "[ . 1]" 1
1251 1 79 LEU H 1 79 LEU HB3 3.790 . 3.790 2.938 2.889 2.989 . 0 0 "[ . 1]" 1
1252 1 79 LEU H 1 79 LEU MD1 4.450 . 4.450 4.144 4.128 4.158 . 0 0 "[ . 1]" 1
1253 1 79 LEU H 1 79 LEU MD2 4.780 . 4.780 4.343 4.292 4.397 . 0 0 "[ . 1]" 1
1254 1 79 LEU H 1 107 VAL MG2 3.780 . 3.780 2.816 2.677 2.878 . 0 0 "[ . 1]" 1
1255 1 79 LEU H 1 108 ARG H 4.150 . 4.150 3.132 2.970 3.264 . 0 0 "[ . 1]" 1
1256 1 79 LEU H 1 108 ARG HB3 4.720 . 4.720 3.842 3.700 3.972 . 0 0 "[ . 1]" 1
1257 1 79 LEU H 1 109 PHE HA 3.440 . 3.440 2.762 2.650 2.859 . 0 0 "[ . 1]" 1
1258 1 79 LEU H 1 110 LEU H 4.260 . 4.260 4.167 4.061 4.283 0.023 5 0 "[ . 1]" 1
1259 1 79 LEU HA 1 79 LEU MD1 3.260 . 3.260 2.095 1.964 2.252 . 0 0 "[ . 1]" 1
1260 1 79 LEU HA 1 79 LEU MD2 3.490 . 3.490 2.572 2.377 2.740 . 0 0 "[ . 1]" 1
1261 1 79 LEU HA 1 79 LEU HG 3.740 . 3.740 3.717 3.704 3.736 . 0 0 "[ . 1]" 1
1262 1 79 LEU HA 1 80 ILE H 2.850 . 2.850 2.103 2.077 2.125 . 0 0 "[ . 1]" 1
1263 1 79 LEU HA 1 80 ILE MD 4.620 . 4.620 3.206 3.014 3.490 . 0 0 "[ . 1]" 1
1264 1 79 LEU HB2 1 80 ILE H 4.240 . 4.240 4.367 4.351 4.380 0.140 1 0 "[ . 1]" 1
1265 1 79 LEU HB2 1 107 VAL MG2 4.740 . 4.740 2.580 2.474 2.712 . 0 0 "[ . 1]" 1
1266 1 79 LEU HB2 1 109 PHE HA 3.200 . 3.200 3.338 3.309 3.357 0.157 7 0 "[ . 1]" 1
1267 1 79 LEU HB2 1 109 PHE QD 3.970 . 3.970 3.301 3.239 3.387 . 0 0 "[ . 1]" 1
1268 1 79 LEU HB2 1 109 PHE QE 3.760 . 3.760 3.848 3.796 3.894 0.134 8 0 "[ . 1]" 1
1269 1 79 LEU HB2 1 110 LEU H 4.750 . 4.750 4.737 4.706 4.771 0.021 10 0 "[ . 1]" 1
1270 1 79 LEU HB3 1 107 VAL MG2 3.770 . 3.770 3.453 3.207 3.618 . 0 0 "[ . 1]" 1
1271 1 79 LEU HB3 1 108 ARG H 5.430 . 5.430 5.212 5.021 5.360 . 0 0 "[ . 1]" 1
1272 1 79 LEU HB3 1 109 PHE HA 3.610 . 3.610 2.115 1.981 2.211 . 0 0 "[ . 1]" 1
1273 1 79 LEU HB3 1 109 PHE HB2 4.850 . 4.850 3.758 3.688 3.825 . 0 0 "[ . 1]" 1
1274 1 79 LEU HB3 1 109 PHE QD 3.430 . 3.430 2.956 2.887 3.018 . 0 0 "[ . 1]" 1
1275 1 79 LEU HB3 1 109 PHE QE 3.750 . 3.750 3.574 3.518 3.663 . 0 0 "[ . 1]" 1
1276 1 79 LEU MD1 1 80 ILE H 3.260 . 3.260 1.918 1.828 2.007 . 0 0 "[ . 1]" 1
1277 1 79 LEU MD1 1 81 VAL MG2 3.370 . 3.370 1.701 1.661 1.736 0.139 8 0 "[ . 1]" 1
1278 1 79 LEU MD1 1 102 PHE QE 4.060 . 4.060 4.232 4.176 4.277 0.217 9 0 "[ . 1]" 1
1279 1 79 LEU MD1 1 109 PHE QD 4.170 . 4.170 4.081 3.902 4.146 . 0 0 "[ . 1]" 1
1280 1 79 LEU MD2 1 81 VAL MG2 3.270 . 3.270 3.505 3.441 3.556 0.286 3 0 "[ . 1]" 1
1281 1 79 LEU MD2 1 102 PHE QE 3.250 . 3.250 2.452 2.268 2.612 . 0 0 "[ . 1]" 1
1282 1 79 LEU MD2 1 109 PHE QE 3.080 . 3.080 2.945 2.580 3.092 0.012 7 0 "[ . 1]" 1
1283 1 79 LEU HG 1 109 PHE QD 3.670 . 3.670 3.405 3.305 3.543 . 0 0 "[ . 1]" 1
1284 1 80 ILE H 1 80 ILE HB 3.560 . 3.560 2.492 2.397 2.586 . 0 0 "[ . 1]" 1
1285 1 80 ILE H 1 80 ILE MD 4.020 . 4.020 2.621 2.419 2.943 . 0 0 "[ . 1]" 1
1286 1 80 ILE H 1 80 ILE HG13 4.120 . 4.120 4.100 4.028 4.199 0.079 10 0 "[ . 1]" 1
1287 1 80 ILE H 1 81 VAL MG2 4.690 . 4.690 3.686 3.624 3.767 . 0 0 "[ . 1]" 1
1288 1 80 ILE HA 1 80 ILE MD 4.170 . 4.170 2.810 2.668 2.964 . 0 0 "[ . 1]" 1
1289 1 80 ILE HA 1 80 ILE HG13 4.190 . 4.190 2.284 2.162 2.374 . 0 0 "[ . 1]" 1
1290 1 80 ILE HA 1 80 ILE MG 3.190 . 3.190 2.525 2.430 2.654 . 0 0 "[ . 1]" 1
1291 1 80 ILE HA 1 81 VAL H 2.770 . 2.770 2.125 2.103 2.146 . 0 0 "[ . 1]" 1
1292 1 80 ILE HA 1 110 LEU H 3.670 . 3.670 3.169 3.088 3.302 . 0 0 "[ . 1]" 1
1293 1 80 ILE HA 1 110 LEU HB2 4.060 . 4.060 3.725 3.484 4.056 . 0 0 "[ . 1]" 1
1294 1 80 ILE HA 1 110 LEU HB3 3.400 . 3.400 2.045 1.850 2.328 . 0 0 "[ . 1]" 1
1295 1 80 ILE HA 1 110 LEU QD 4.320 . 4.320 2.377 2.040 3.577 . 0 0 "[ . 1]" 1
1296 1 80 ILE HA 1 110 LEU HG 4.260 . 4.260 4.015 3.732 4.262 0.002 10 0 "[ . 1]" 1
1297 1 80 ILE HB 1 81 VAL H 4.410 . 4.410 4.441 4.375 4.481 0.071 2 0 "[ . 1]" 1
1298 1 80 ILE MD 1 80 ILE MG 3.740 . 3.740 3.223 3.200 3.247 . 0 0 "[ . 1]" 1
1299 1 80 ILE MD 1 81 VAL H 5.020 . 5.020 4.609 4.506 4.724 . 0 0 "[ . 1]" 1
1300 1 80 ILE MD 1 110 LEU HB3 3.330 . 3.330 3.330 3.142 3.422 0.092 8 0 "[ . 1]" 1
1301 1 80 ILE MG 1 81 VAL H 3.330 . 3.330 2.884 2.746 3.002 . 0 0 "[ . 1]" 1
1302 1 80 ILE MG 1 110 LEU H 5.330 . 5.330 5.123 4.987 5.232 . 0 0 "[ . 1]" 1
1303 1 80 ILE MG 1 110 LEU HB3 3.740 . 3.740 3.499 3.295 3.759 0.019 8 0 "[ . 1]" 1
1304 1 80 ILE MG 1 110 LEU QD 3.580 . 3.580 2.270 1.823 3.614 0.034 10 0 "[ . 1]" 1
1305 1 81 VAL H 1 81 VAL MG1 3.910 . 3.910 3.915 3.885 3.936 0.026 1 0 "[ . 1]" 1
1306 1 81 VAL H 1 81 VAL MG2 3.420 . 3.420 2.811 2.681 2.986 . 0 0 "[ . 1]" 1
1307 1 81 VAL H 1 109 PHE QE 4.390 . 4.390 4.340 4.173 4.439 0.049 8 0 "[ . 1]" 1
1308 1 81 VAL H 1 110 LEU H 5.500 . 5.500 3.453 3.317 3.552 . 0 0 "[ . 1]" 1
1309 1 81 VAL H 1 110 LEU HB2 4.980 . 4.980 4.632 4.522 4.773 . 0 0 "[ . 1]" 1
1310 1 81 VAL H 1 110 LEU QD 4.290 . 4.290 2.042 1.816 3.025 . 0 0 "[ . 1]" 1
1311 1 81 VAL H 1 111 ALA HA 3.730 . 3.730 3.763 3.698 3.799 0.069 2 0 "[ . 1]" 1
1312 1 81 VAL HA 1 81 VAL MG1 3.600 . 3.600 2.321 2.193 2.389 . 0 0 "[ . 1]" 1
1313 1 81 VAL HA 1 81 VAL MG2 3.250 . 3.250 2.448 2.345 2.483 . 0 0 "[ . 1]" 1
1314 1 81 VAL HA 1 82 LYS H 3.230 . 3.230 2.276 2.242 2.305 . 0 0 "[ . 1]" 1
1315 1 81 VAL HA 1 83 ASP H 4.150 . 4.150 4.082 3.961 4.189 0.039 10 0 "[ . 1]" 1
1316 1 81 VAL HA 1 112 ILE MD 5.100 . 5.100 4.505 4.310 4.685 . 0 0 "[ . 1]" 1
1317 1 81 VAL HB 1 82 LYS H 3.840 . 3.840 3.789 3.693 3.913 0.073 4 0 "[ . 1]" 1
1318 1 81 VAL HB 1 83 ASP H 3.560 . 3.560 3.249 3.084 3.525 . 0 0 "[ . 1]" 1
1319 1 81 VAL HB 1 110 LEU QD 4.670 . 4.670 3.870 3.736 4.430 . 0 0 "[ . 1]" 1
1320 1 81 VAL HB 1 111 ALA MB 4.430 . 4.430 3.785 3.654 3.903 . 0 0 "[ . 1]" 1
1321 1 81 VAL HB 1 112 ILE H 4.170 . 4.170 4.415 4.370 4.460 0.290 6 0 "[ . 1]" 1
1322 1 81 VAL MG1 1 82 LYS H 4.600 . 4.600 2.001 1.901 2.139 . 0 0 "[ . 1]" 1
1323 1 81 VAL MG1 1 82 LYS QB 4.310 . 4.310 3.120 2.981 3.246 . 0 0 "[ . 1]" 1
1324 1 81 VAL MG1 1 83 ASP H 3.880 . 3.880 1.800 1.766 1.827 0.034 4 0 "[ . 1]" 1
1325 1 81 VAL MG1 1 84 MET HA 3.920 . 3.920 3.725 3.372 3.933 0.013 1 0 "[ . 1]" 1
1326 1 81 VAL MG1 1 87 LEU H 4.010 . 4.010 3.665 3.450 3.829 . 0 0 "[ . 1]" 1
1327 1 81 VAL MG1 1 109 PHE QE 3.630 . 3.630 3.623 3.448 3.679 0.049 3 0 "[ . 1]" 1
1328 1 81 VAL MG1 1 111 ALA HA 4.110 . 4.110 4.016 3.734 4.153 0.043 2 0 "[ . 1]" 1
1329 1 81 VAL MG2 1 82 LYS H 4.280 . 4.280 4.030 3.934 4.087 . 0 0 "[ . 1]" 1
1330 1 81 VAL MG2 1 87 LEU H 4.460 . 4.460 4.566 4.522 4.610 0.150 1 0 "[ . 1]" 1
1331 1 81 VAL MG2 1 87 LEU HG 4.560 . 4.560 4.630 4.564 4.682 0.122 10 0 "[ . 1]" 1
1332 1 81 VAL MG2 1 109 PHE QD 3.540 . 3.540 3.655 3.602 3.694 0.154 10 0 "[ . 1]" 1
1333 1 81 VAL MG2 1 109 PHE QE 3.440 . 3.440 2.348 2.278 2.404 . 0 0 "[ . 1]" 1
1334 1 81 VAL MG2 1 111 ALA HA 4.650 . 4.650 4.488 4.390 4.575 . 0 0 "[ . 1]" 1
1335 1 82 LYS H 1 82 LYS QB 3.790 . 3.790 2.048 2.013 2.091 . 0 0 "[ . 1]" 1
1336 1 82 LYS H 1 82 LYS HD2 5.500 . 5.500 5.606 5.550 5.666 0.166 8 0 "[ . 1]" 1
1337 1 82 LYS H 1 83 ASP H 3.960 . 3.960 2.711 2.663 2.805 . 0 0 "[ . 1]" 1
1338 1 82 LYS H 1 86 ARG HG3 4.960 . 4.960 4.119 3.271 5.030 0.070 5 0 "[ . 1]" 1
1339 1 82 LYS HA 1 82 LYS HD2 4.190 . 4.190 4.026 3.793 4.210 0.020 4 0 "[ . 1]" 1
1340 1 82 LYS HA 1 82 LYS HE2 4.440 . 4.440 2.954 2.501 3.587 . 0 0 "[ . 1]" 1
1341 1 82 LYS HA 1 82 LYS QG 3.550 . 3.550 2.261 2.163 2.427 . 0 0 "[ . 1]" 1
1342 1 82 LYS HA 1 112 ILE H 4.010 . 4.010 3.400 3.196 3.550 . 0 0 "[ . 1]" 1
1343 1 82 LYS HA 1 112 ILE HB 4.140 . 4.140 2.405 2.221 2.586 . 0 0 "[ . 1]" 1
1344 1 82 LYS HA 1 112 ILE MD 4.090 . 4.090 2.264 1.916 2.540 . 0 0 "[ . 1]" 1
1345 1 82 LYS HA 1 112 ILE HG12 4.860 . 4.860 4.697 4.461 4.915 0.055 8 0 "[ . 1]" 1
1346 1 82 LYS HA 1 112 ILE MG 4.380 . 4.380 3.706 3.599 3.840 . 0 0 "[ . 1]" 1
1347 1 82 LYS HA 1 113 ASN H 5.500 . 5.500 4.142 4.033 4.336 . 0 0 "[ . 1]" 1
1348 1 82 LYS QB 1 82 LYS HE3 4.480 . 4.480 4.054 3.887 4.265 . 0 0 "[ . 1]" 1
1349 1 82 LYS QB 1 83 ASP H 3.910 . 3.910 2.716 2.570 2.859 . 0 0 "[ . 1]" 1
1350 1 82 LYS HD2 1 113 ASN QB 4.350 . 4.350 3.805 3.456 4.240 . 0 0 "[ . 1]" 1
1351 1 82 LYS HD3 1 83 ASP H 4.320 . 4.320 4.277 4.071 4.424 0.104 1 0 "[ . 1]" 1
1352 1 82 LYS HE2 1 113 ASN H 4.330 . 4.330 4.293 4.085 4.352 0.022 8 0 "[ . 1]" 1
1353 1 83 ASP H 1 84 MET H 5.490 . 5.490 4.327 4.295 4.365 . 0 0 "[ . 1]" 1
1354 1 83 ASP H 1 86 ARG H 4.250 . 4.250 4.073 3.832 4.340 0.090 4 0 "[ . 1]" 1
1355 1 83 ASP H 1 86 ARG QD 5.270 . 5.270 3.755 1.882 5.165 . 0 0 "[ . 1]" 1
1356 1 83 ASP H 1 86 ARG HG2 4.650 . 4.650 3.546 2.791 4.139 . 0 0 "[ . 1]" 1
1357 1 83 ASP H 1 86 ARG HG3 4.740 . 4.740 3.981 3.124 4.879 0.139 10 0 "[ . 1]" 1
1358 1 83 ASP HA 1 84 MET H 3.220 . 3.220 2.386 2.348 2.438 . 0 0 "[ . 1]" 1
1359 1 83 ASP HA 1 84 MET HA 4.330 . 4.330 4.291 4.264 4.306 . 0 0 "[ . 1]" 1
1360 1 83 ASP HA 1 85 SER H 3.960 . 3.960 4.050 4.017 4.086 0.126 8 0 "[ . 1]" 1
1361 1 83 ASP HA 1 111 ALA HA 2.440 . 2.440 2.512 2.446 2.609 0.169 4 0 "[ . 1]" 1
1362 1 83 ASP HA 1 111 ALA MB 2.760 . 2.760 2.234 2.052 2.435 . 0 0 "[ . 1]" 1
1363 1 83 ASP HA 1 113 ASN H 4.560 . 4.560 2.807 2.504 3.163 . 0 0 "[ . 1]" 1
1364 1 83 ASP HB2 1 84 MET H 3.740 . 3.740 2.473 2.351 2.632 . 0 0 "[ . 1]" 1
1365 1 83 ASP HB2 1 85 SER H 4.160 . 4.160 2.651 2.351 3.465 . 0 0 "[ . 1]" 1
1366 1 83 ASP HB2 1 112 ILE H 5.500 . 5.500 5.368 5.088 5.505 0.005 5 0 "[ . 1]" 1
1367 1 83 ASP HB3 1 84 MET H 3.970 . 3.970 3.623 3.389 3.973 0.003 8 0 "[ . 1]" 1
1368 1 83 ASP HB3 1 111 ALA MB 4.180 . 4.180 3.940 3.786 4.239 0.059 8 0 "[ . 1]" 1
1369 1 83 ASP HB3 1 112 ILE MG 4.740 . 4.740 4.634 4.456 4.763 0.023 2 0 "[ . 1]" 1
1370 1 83 ASP HB3 1 113 ASN H 3.630 . 3.630 2.091 1.964 2.283 . 0 0 "[ . 1]" 1
1371 1 84 MET H 1 84 MET QB 3.520 . 3.520 2.227 2.126 2.376 . 0 0 "[ . 1]" 1
1372 1 84 MET H 1 84 MET ME 4.210 . 4.210 4.238 4.193 4.268 0.058 4 0 "[ . 1]" 1
1373 1 84 MET H 1 84 MET HG2 3.990 . 3.990 2.826 2.576 3.087 . 0 0 "[ . 1]" 1
1374 1 84 MET H 1 84 MET HG3 4.120 . 4.120 3.544 3.069 4.108 . 0 0 "[ . 1]" 1
1375 1 84 MET H 1 85 SER H 4.260 . 4.260 2.835 2.721 2.950 . 0 0 "[ . 1]" 1
1376 1 84 MET H 1 111 ALA MB 3.870 . 3.870 2.208 1.929 2.598 . 0 0 "[ . 1]" 1
1377 1 84 MET H 1 116 ILE MD 5.500 . 5.500 5.470 5.311 5.538 0.038 9 0 "[ . 1]" 1
1378 1 84 MET HA 1 84 MET ME 3.320 . 3.320 2.708 2.268 3.196 . 0 0 "[ . 1]" 1
1379 1 84 MET HA 1 84 MET HG2 3.000 . 3.000 2.474 2.338 2.829 . 0 0 "[ . 1]" 1
1380 1 84 MET HA 1 84 MET HG3 4.050 . 4.050 3.627 3.561 3.672 . 0 0 "[ . 1]" 1
1381 1 84 MET HA 1 86 ARG H 4.590 . 4.590 3.629 3.521 3.857 . 0 0 "[ . 1]" 1
1382 1 84 MET HA 1 87 LEU H 4.280 . 4.280 3.686 3.493 3.795 . 0 0 "[ . 1]" 1
1383 1 84 MET HA 1 109 PHE QE 4.030 . 4.030 3.924 3.598 4.075 0.045 8 0 "[ . 1]" 1
1384 1 84 MET HA 1 111 ALA MB 4.190 . 4.190 3.438 3.056 3.864 . 0 0 "[ . 1]" 1
1385 1 84 MET QB 1 85 SER H 3.830 . 3.830 3.342 3.215 3.479 . 0 0 "[ . 1]" 1
1386 1 84 MET QB 1 111 ALA MB 4.510 . 4.510 3.277 2.867 3.640 . 0 0 "[ . 1]" 1
1387 1 84 MET ME 1 84 MET HG2 3.690 . 3.690 2.071 1.986 2.230 . 0 0 "[ . 1]" 1
1388 1 84 MET ME 1 84 MET HG3 3.470 . 3.470 3.098 2.864 3.219 . 0 0 "[ . 1]" 1
1389 1 84 MET ME 1 87 LEU H 5.400 . 5.400 4.564 3.920 5.377 . 0 0 "[ . 1]" 1
1390 1 84 MET ME 1 94 VAL QG 2.840 . 2.840 2.344 2.031 2.688 . 0 0 "[ . 1]" 1
1391 1 84 MET ME 1 98 THR HB 4.990 . 4.990 4.997 4.815 5.043 0.053 6 0 "[ . 1]" 1
1392 1 84 MET ME 1 98 THR MG 3.220 . 3.220 2.797 2.745 2.903 . 0 0 "[ . 1]" 1
1393 1 84 MET ME 1 109 PHE HB3 4.620 . 4.620 3.753 3.575 4.000 . 0 0 "[ . 1]" 1
1394 1 84 MET ME 1 109 PHE QE 3.030 . 3.030 2.209 2.097 2.362 . 0 0 "[ . 1]" 1
1395 1 84 MET ME 1 111 ALA HA 4.660 . 4.660 4.457 4.289 4.647 . 0 0 "[ . 1]" 1
1396 1 84 MET ME 1 111 ALA MB 3.880 . 3.880 2.669 2.401 2.964 . 0 0 "[ . 1]" 1
1397 1 84 MET ME 1 116 ILE MD 3.300 . 3.300 1.920 1.772 2.087 0.028 9 0 "[ . 1]" 1
1398 1 84 MET HG2 1 94 VAL QG 4.450 . 4.450 4.166 4.013 4.378 . 0 0 "[ . 1]" 1
1399 1 84 MET HG2 1 109 PHE QE 5.030 . 5.030 3.930 3.649 4.454 . 0 0 "[ . 1]" 1
1400 1 84 MET HG2 1 111 ALA HA 5.170 . 5.170 4.326 4.150 4.945 . 0 0 "[ . 1]" 1
1401 1 84 MET HG2 1 111 ALA MB 4.470 . 4.470 2.079 1.853 2.563 . 0 0 "[ . 1]" 1
1402 1 84 MET HG3 1 94 VAL QG 4.160 . 4.160 4.111 3.407 4.237 0.077 3 0 "[ . 1]" 1
1403 1 84 MET HG3 1 111 ALA MB 4.870 . 4.870 3.052 2.733 3.993 . 0 0 "[ . 1]" 1
1404 1 84 MET HG3 1 116 ILE HA 4.580 . 4.580 2.773 2.210 3.742 . 0 0 "[ . 1]" 1
1405 1 85 SER H 1 85 SER HB2 3.580 . 3.580 2.806 2.120 3.596 0.016 5 0 "[ . 1]" 1
1406 1 85 SER H 1 85 SER HB3 3.640 . 3.640 3.096 2.324 3.610 . 0 0 "[ . 1]" 1
1407 1 85 SER H 1 86 ARG H 4.020 . 4.020 2.514 2.433 2.650 . 0 0 "[ . 1]" 1
1408 1 85 SER H 1 87 LEU H 4.880 . 4.880 4.789 4.633 4.891 0.011 3 0 "[ . 1]" 1
1409 1 85 SER H 1 88 GLY H 5.450 . 5.450 4.840 4.655 5.007 . 0 0 "[ . 1]" 1
1410 1 85 SER HA 1 85 SER HB3 3.020 . 3.020 2.604 2.363 3.028 0.008 7 0 "[ . 1]" 1
1411 1 85 SER HA 1 88 GLY H 3.490 . 3.490 3.404 3.071 3.557 0.067 6 0 "[ . 1]" 1
1412 1 85 SER HA 1 89 ARG HA 4.310 . 4.310 4.282 4.068 4.354 0.044 3 0 "[ . 1]" 1
1413 1 85 SER HA 1 89 ARG QD 4.590 . 4.590 4.036 2.588 4.641 0.051 4 0 "[ . 1]" 1
1414 1 85 SER HA 1 89 ARG QG 4.460 . 4.460 3.600 3.030 4.515 0.055 5 0 "[ . 1]" 1
1415 1 85 SER HB2 1 86 ARG H 4.220 . 4.220 3.576 2.901 4.250 0.030 5 0 "[ . 1]" 1
1416 1 86 ARG H 1 86 ARG QD 5.090 . 5.090 3.200 2.161 4.100 . 0 0 "[ . 1]" 1
1417 1 86 ARG H 1 86 ARG HG2 4.450 . 4.450 2.991 1.948 4.228 . 0 0 "[ . 1]" 1
1418 1 86 ARG H 1 86 ARG HG3 4.360 . 4.360 3.676 3.315 4.091 . 0 0 "[ . 1]" 1
1419 1 86 ARG H 1 87 LEU H 3.630 . 3.630 2.909 2.800 3.068 . 0 0 "[ . 1]" 1
1420 1 86 ARG H 1 87 LEU MD1 4.840 . 4.840 4.208 3.971 4.578 . 0 0 "[ . 1]" 1
1421 1 86 ARG HB3 1 87 LEU H 4.160 . 4.160 3.088 2.460 3.528 . 0 0 "[ . 1]" 1
1422 1 87 LEU H 1 87 LEU QB 2.930 . 2.930 2.281 2.217 2.364 . 0 0 "[ . 1]" 1
1423 1 87 LEU H 1 87 LEU MD1 3.560 . 3.560 2.240 1.945 2.481 . 0 0 "[ . 1]" 1
1424 1 87 LEU H 1 87 LEU HG 3.800 . 3.800 3.441 3.195 3.619 . 0 0 "[ . 1]" 1
1425 1 87 LEU H 1 88 GLY H 2.560 . 2.560 2.550 2.408 2.628 0.068 3 0 "[ . 1]" 1
1426 1 87 LEU HA 1 87 LEU MD1 3.310 . 3.310 3.274 3.076 3.379 0.069 8 0 "[ . 1]" 1
1427 1 87 LEU QB 1 87 LEU MD1 3.210 . 3.210 2.110 2.012 2.181 . 0 0 "[ . 1]" 1
1428 1 87 LEU QB 1 88 GLY H 3.600 . 3.600 2.898 2.684 3.083 . 0 0 "[ . 1]" 1
1429 1 87 LEU QB 1 90 ASN HD22 4.590 . 4.590 4.611 4.565 4.640 0.050 5 0 "[ . 1]" 1
1430 1 87 LEU QB 1 94 VAL QG 3.040 . 3.040 2.261 2.056 2.373 . 0 0 "[ . 1]" 1
1431 1 87 LEU QB 1 98 THR MG 5.500 . 5.500 5.320 4.940 5.556 0.056 9 0 "[ . 1]" 1
1432 1 87 LEU MD1 1 109 PHE QE 3.220 . 3.220 3.010 2.742 3.215 . 0 0 "[ . 1]" 1
1433 1 87 LEU MD2 1 109 PHE QE 3.600 . 3.600 3.217 2.606 3.672 0.072 9 0 "[ . 1]" 1
1434 1 88 GLY H 1 94 VAL QG 3.640 . 3.640 3.365 3.260 3.538 . 0 0 "[ . 1]" 1
1435 1 88 GLY HA2 1 89 ARG H 3.530 . 3.530 2.288 2.237 2.348 . 0 0 "[ . 1]" 1
1436 1 88 GLY HA2 1 94 VAL QG 4.010 . 4.010 4.120 4.042 4.179 0.169 6 0 "[ . 1]" 1
1437 1 88 GLY HA3 1 90 ASN H 5.210 . 5.210 3.251 3.086 3.464 . 0 0 "[ . 1]" 1
1438 1 88 GLY HA3 1 94 VAL QG 3.810 . 3.810 3.134 3.066 3.200 . 0 0 "[ . 1]" 1
1439 1 89 ARG H 1 89 ARG HB2 3.640 . 3.640 2.350 2.203 2.504 . 0 0 "[ . 1]" 1
1440 1 89 ARG H 1 89 ARG HB3 3.570 . 3.570 3.565 3.496 3.603 0.033 4 0 "[ . 1]" 1
1441 1 89 ARG H 1 89 ARG QD 4.590 . 4.590 3.109 1.898 4.465 . 0 0 "[ . 1]" 1
1442 1 89 ARG H 1 89 ARG QG 4.070 . 4.070 2.987 2.408 3.640 . 0 0 "[ . 1]" 1
1443 1 89 ARG H 1 90 ASN H 3.550 . 3.550 2.416 2.366 2.486 . 0 0 "[ . 1]" 1
1444 1 89 ARG H 1 94 VAL QG 5.000 . 5.000 4.285 4.161 4.403 . 0 0 "[ . 1]" 1
1445 1 89 ARG HA 1 89 ARG QD 3.580 . 3.580 3.265 2.334 3.640 0.060 9 0 "[ . 1]" 1
1446 1 89 ARG HA 1 89 ARG QG 2.960 . 2.960 2.374 2.151 2.695 . 0 0 "[ . 1]" 1
1447 1 89 ARG HA 1 94 VAL QG 4.760 . 4.760 3.974 3.821 4.225 . 0 0 "[ . 1]" 1
1448 1 89 ARG HB2 1 90 ASN H 4.400 . 4.400 3.085 2.779 3.324 . 0 0 "[ . 1]" 1
1449 1 89 ARG HB2 1 90 ASN HA 4.550 . 4.550 4.486 4.272 4.648 0.098 9 0 "[ . 1]" 1
1450 1 89 ARG HB3 1 89 ARG QD 3.280 . 3.280 2.724 1.937 3.372 0.092 5 0 "[ . 1]" 1
1451 1 89 ARG HB3 1 90 ASN H 4.220 . 4.220 3.860 3.493 4.101 . 0 0 "[ . 1]" 1
1452 1 89 ARG HB3 1 90 ASN HA 4.900 . 4.900 4.452 4.147 4.702 . 0 0 "[ . 1]" 1
1453 1 89 ARG QG 1 90 ASN H 4.860 . 4.860 4.450 4.158 4.667 . 0 0 "[ . 1]" 1
1454 1 90 ASN H 1 90 ASN HB2 3.620 . 3.620 3.546 3.526 3.569 . 0 0 "[ . 1]" 1
1455 1 90 ASN H 1 90 ASN HB3 3.560 . 3.560 2.921 2.863 2.987 . 0 0 "[ . 1]" 1
1456 1 90 ASN H 1 94 VAL QG 4.470 . 4.470 3.445 3.278 3.758 . 0 0 "[ . 1]" 1
1457 1 90 ASN HA 1 90 ASN HB2 2.970 . 2.970 2.638 2.590 2.691 . 0 0 "[ . 1]" 1
1458 1 90 ASN HA 1 90 ASN HB3 3.030 . 3.030 2.310 2.281 2.339 . 0 0 "[ . 1]" 1
1459 1 90 ASN HA 1 92 LEU H 4.160 . 4.160 3.273 3.225 3.337 . 0 0 "[ . 1]" 1
1460 1 90 ASN HA 1 92 LEU MD1 3.720 . 3.720 3.076 2.948 3.285 . 0 0 "[ . 1]" 1
1461 1 90 ASN HB2 1 90 ASN HD22 3.570 . 3.570 3.538 3.498 3.573 0.003 10 0 "[ . 1]" 1
1462 1 90 ASN HB2 1 92 LEU MD1 3.910 . 3.910 3.251 3.111 3.523 . 0 0 "[ . 1]" 1
1463 1 90 ASN HB2 1 93 GLN H 5.070 . 5.070 2.704 2.582 2.888 . 0 0 "[ . 1]" 1
1464 1 90 ASN HB2 1 94 VAL QG 3.870 . 3.870 3.815 3.696 3.889 0.019 8 0 "[ . 1]" 1
1465 1 90 ASN HB3 1 92 LEU MD1 4.090 . 4.090 3.778 3.579 3.981 . 0 0 "[ . 1]" 1
1466 1 90 ASN HD21 1 94 VAL H 4.160 . 4.160 2.317 2.186 2.662 . 0 0 "[ . 1]" 1
1467 1 90 ASN HD21 1 94 VAL QG 3.190 . 3.190 2.011 1.878 2.212 . 0 0 "[ . 1]" 1
1468 1 91 TYR H 1 91 TYR HB2 4.040 . 4.040 2.539 2.439 2.635 . 0 0 "[ . 1]" 1
1469 1 91 TYR HA 1 91 TYR QD 3.090 . 3.090 3.039 2.905 3.108 0.018 7 0 "[ . 1]" 1
1470 1 91 TYR HA 1 93 GLN H 4.960 . 4.960 4.655 4.548 4.825 . 0 0 "[ . 1]" 1
1471 1 91 TYR HA 1 94 VAL H 3.650 . 3.650 3.524 3.417 3.647 . 0 0 "[ . 1]" 1
1472 1 91 TYR HA 1 94 VAL HB 2.980 . 2.980 2.139 1.932 2.609 . 0 0 "[ . 1]" 1
1473 1 91 TYR HA 1 94 VAL QG 3.180 . 3.180 2.703 2.246 2.893 . 0 0 "[ . 1]" 1
1474 1 91 TYR HA 1 95 GLY H 3.950 . 3.950 3.067 2.882 3.335 . 0 0 "[ . 1]" 1
1475 1 91 TYR HB2 1 92 LEU H 4.450 . 4.450 4.316 4.266 4.342 . 0 0 "[ . 1]" 1
1476 1 91 TYR HB2 1 94 VAL HB 4.840 . 4.840 4.359 4.158 4.842 0.002 6 0 "[ . 1]" 1
1477 1 91 TYR HB2 1 94 VAL QG 3.940 . 3.940 4.123 4.023 4.175 0.235 2 0 "[ . 1]" 1
1478 1 91 TYR HB3 1 92 LEU H 4.330 . 4.330 3.332 3.240 3.361 . 0 0 "[ . 1]" 1
1479 1 91 TYR QD 1 92 LEU HA 3.660 . 3.660 3.529 3.376 3.672 0.012 6 0 "[ . 1]" 1
1480 1 91 TYR QD 1 92 LEU MD1 3.710 . 3.710 3.639 3.395 3.726 0.016 1 0 "[ . 1]" 1
1481 1 91 TYR QD 1 92 LEU HG 4.260 . 4.260 4.158 4.098 4.266 0.006 1 0 "[ . 1]" 1
1482 1 91 TYR QD 1 94 VAL HB 4.070 . 4.070 4.181 4.117 4.251 0.181 10 0 "[ . 1]" 1
1483 1 91 TYR QE 1 92 LEU HA 5.060 . 5.060 4.955 4.862 5.055 . 0 0 "[ . 1]" 1
1484 1 91 TYR QE 1 116 ILE MD 4.820 . 4.820 4.356 4.113 4.709 . 0 0 "[ . 1]" 1
1485 1 91 TYR QE 1 117 ASP HA 3.420 . 3.420 3.546 3.477 3.604 0.184 10 0 "[ . 1]" 1
1486 1 92 LEU H 1 92 LEU HB2 3.320 . 3.320 2.475 2.418 2.494 . 0 0 "[ . 1]" 1
1487 1 92 LEU H 1 92 LEU HB3 3.790 . 3.790 3.604 3.594 3.612 . 0 0 "[ . 1]" 1
1488 1 92 LEU H 1 92 LEU MD1 4.620 . 4.620 1.844 1.811 1.889 . 0 0 "[ . 1]" 1
1489 1 92 LEU H 1 92 LEU MD2 4.730 . 4.730 3.934 3.895 4.004 . 0 0 "[ . 1]" 1
1490 1 92 LEU H 1 92 LEU HG 3.400 . 3.400 3.323 3.262 3.392 . 0 0 "[ . 1]" 1
1491 1 92 LEU H 1 93 GLN H 3.660 . 3.660 2.679 2.577 2.729 . 0 0 "[ . 1]" 1
1492 1 92 LEU H 1 93 GLN QG 5.020 . 5.020 5.041 4.887 5.118 0.098 2 0 "[ . 1]" 1
1493 1 92 LEU HA 1 92 LEU HB3 2.880 . 2.880 2.484 2.473 2.509 . 0 0 "[ . 1]" 1
1494 1 92 LEU HA 1 92 LEU MD1 3.040 . 3.040 3.125 3.089 3.163 0.123 10 0 "[ . 1]" 1
1495 1 92 LEU HA 1 92 LEU MD2 3.790 . 3.790 3.701 3.667 3.746 . 0 0 "[ . 1]" 1
1496 1 92 LEU HB2 1 92 LEU MD1 3.450 . 3.450 2.142 2.114 2.191 . 0 0 "[ . 1]" 1
1497 1 92 LEU HB2 1 92 LEU MD2 3.470 . 3.470 2.488 2.451 2.580 . 0 0 "[ . 1]" 1
1498 1 92 LEU HB2 1 93 GLN H 3.850 . 3.850 2.219 2.146 2.279 . 0 0 "[ . 1]" 1
1499 1 92 LEU HB2 1 93 GLN QG 4.260 . 4.260 3.535 3.447 3.650 . 0 0 "[ . 1]" 1
1500 1 92 LEU HB2 1 94 VAL H 4.660 . 4.660 4.688 4.662 4.715 0.055 3 0 "[ . 1]" 1
1501 1 92 LEU HB3 1 92 LEU MD1 3.330 . 3.330 3.154 3.142 3.175 . 0 0 "[ . 1]" 1
1502 1 92 LEU HB3 1 93 GLN H 3.990 . 3.990 3.288 3.190 3.371 . 0 0 "[ . 1]" 1
1503 1 92 LEU HB3 1 93 GLN QB 5.380 . 5.380 4.983 4.887 5.044 . 0 0 "[ . 1]" 1
1504 1 92 LEU HB3 1 93 GLN QG 4.700 . 4.700 4.185 4.017 4.321 . 0 0 "[ . 1]" 1
1505 1 92 LEU MD1 1 93 GLN QB 4.750 . 4.750 4.831 4.810 4.865 0.115 2 0 "[ . 1]" 1
1506 1 92 LEU MD2 1 93 GLN H 5.480 . 5.480 4.368 4.269 4.419 . 0 0 "[ . 1]" 1
1507 1 92 LEU MD2 1 93 GLN QG 4.660 . 4.660 4.679 4.650 4.728 0.068 2 0 "[ . 1]" 1
1508 1 93 GLN H 1 93 GLN QB 3.070 . 3.070 2.193 2.153 2.249 . 0 0 "[ . 1]" 1
1509 1 93 GLN H 1 93 GLN QG 3.170 . 3.170 2.770 2.667 2.864 . 0 0 "[ . 1]" 1
1510 1 93 GLN H 1 94 VAL H 3.510 . 3.510 2.592 2.514 2.695 . 0 0 "[ . 1]" 1
1511 1 93 GLN H 1 94 VAL QG 5.190 . 5.190 3.923 3.694 4.122 . 0 0 "[ . 1]" 1
1512 1 93 GLN H 1 95 GLY H 5.230 . 5.230 4.009 3.929 4.098 . 0 0 "[ . 1]" 1
1513 1 93 GLN HA 1 93 GLN QB 2.770 . 2.770 2.473 2.441 2.489 . 0 0 "[ . 1]" 1
1514 1 93 GLN HA 1 93 GLN QG 2.920 . 2.920 2.741 2.271 2.994 0.074 3 0 "[ . 1]" 1
1515 1 93 GLN HA 1 96 PHE HB3 3.670 . 3.670 2.470 2.356 2.584 . 0 0 "[ . 1]" 1
1516 1 93 GLN HA 1 96 PHE QD 3.960 . 3.960 4.049 4.014 4.098 0.138 4 0 "[ . 1]" 1
1517 1 93 GLN QB 1 94 VAL HA 4.410 . 4.410 3.807 3.764 3.841 . 0 0 "[ . 1]" 1
1518 1 93 GLN QB 1 97 TYR QE 4.380 . 4.380 2.832 2.576 2.927 . 0 0 "[ . 1]" 1
1519 1 93 GLN QG 1 94 VAL H 4.330 . 4.330 4.216 4.126 4.288 . 0 0 "[ . 1]" 1
1520 1 93 GLN QG 1 97 TYR QE 4.480 . 4.480 4.435 4.136 4.529 0.049 8 0 "[ . 1]" 1
1521 1 94 VAL H 1 94 VAL HB 3.250 . 3.250 2.657 2.448 3.013 . 0 0 "[ . 1]" 1
1522 1 94 VAL H 1 94 VAL QG 3.020 . 3.020 2.025 1.825 2.201 . 0 0 "[ . 1]" 1
1523 1 94 VAL H 1 95 GLY H 3.670 . 3.670 2.762 2.715 2.828 . 0 0 "[ . 1]" 1
1524 1 94 VAL H 1 96 PHE HB3 5.500 . 5.500 4.911 4.795 4.979 . 0 0 "[ . 1]" 1
1525 1 94 VAL HA 1 94 VAL QG 2.810 . 2.810 2.146 2.081 2.184 . 0 0 "[ . 1]" 1
1526 1 94 VAL HA 1 97 TYR H 4.210 . 4.210 3.687 3.606 3.778 . 0 0 "[ . 1]" 1
1527 1 94 VAL HA 1 97 TYR QD 3.050 . 3.050 2.076 1.897 2.157 . 0 0 "[ . 1]" 1
1528 1 94 VAL HA 1 97 TYR QE 3.900 . 3.900 3.882 3.743 3.953 0.053 6 0 "[ . 1]" 1
1529 1 94 VAL HB 1 95 GLY H 3.810 . 3.810 2.586 2.443 2.659 . 0 0 "[ . 1]" 1
1530 1 94 VAL QG 1 95 GLY H 3.630 . 3.630 3.203 3.125 3.269 . 0 0 "[ . 1]" 1
1531 1 94 VAL QG 1 97 TYR QE 4.400 . 4.400 4.244 4.063 4.385 . 0 0 "[ . 1]" 1
1532 1 94 VAL QG 1 98 THR H 4.360 . 4.360 4.076 3.875 4.283 . 0 0 "[ . 1]" 1
1533 1 94 VAL QG 1 98 THR MG 3.210 . 3.210 2.855 2.485 3.190 . 0 0 "[ . 1]" 1
1534 1 95 GLY H 1 96 PHE H 3.750 . 3.750 2.752 2.723 2.795 . 0 0 "[ . 1]" 1
1535 1 95 GLY H 1 96 PHE HB3 5.060 . 5.060 4.529 4.488 4.574 . 0 0 "[ . 1]" 1
1536 1 95 GLY HA2 1 99 GLU HG3 4.670 . 4.670 4.259 3.124 4.613 . 0 0 "[ . 1]" 1
1537 1 95 GLY HA3 1 98 THR H 4.420 . 4.420 4.468 4.436 4.489 0.069 10 0 "[ . 1]" 1
1538 1 95 GLY HA3 1 98 THR MG 5.500 . 5.500 5.022 4.734 5.231 . 0 0 "[ . 1]" 1
1539 1 95 GLY HA3 1 99 GLU H 4.420 . 4.420 4.493 4.455 4.536 0.116 3 0 "[ . 1]" 1
1540 1 95 GLY HA3 1 99 GLU HG2 4.660 . 4.660 3.254 3.051 3.518 . 0 0 "[ . 1]" 1
1541 1 95 GLY HA3 1 99 GLU HG3 4.790 . 4.790 4.082 2.712 4.487 . 0 0 "[ . 1]" 1
1542 1 96 PHE H 1 96 PHE HB2 3.150 . 3.150 2.821 2.750 2.886 . 0 0 "[ . 1]" 1
1543 1 96 PHE H 1 96 PHE HB3 3.330 . 3.330 2.294 2.247 2.337 . 0 0 "[ . 1]" 1
1544 1 96 PHE H 1 99 GLU HG3 3.940 . 3.940 3.984 3.953 4.010 0.070 6 0 "[ . 1]" 1
1545 1 96 PHE H 1 100 VAL MG1 5.500 . 5.500 4.541 4.300 4.644 . 0 0 "[ . 1]" 1
1546 1 96 PHE HA 1 96 PHE QD 3.400 . 3.400 3.253 3.214 3.320 . 0 0 "[ . 1]" 1
1547 1 96 PHE HA 1 99 GLU H 3.890 . 3.890 3.525 3.488 3.576 . 0 0 "[ . 1]" 1
1548 1 96 PHE HA 1 99 GLU HG3 3.730 . 3.730 2.382 2.010 3.723 . 0 0 "[ . 1]" 1
1549 1 96 PHE HA 1 100 VAL H 4.430 . 4.430 3.034 2.954 3.089 . 0 0 "[ . 1]" 1
1550 1 96 PHE HA 1 100 VAL HB 4.100 . 4.100 4.084 4.014 4.149 0.049 3 0 "[ . 1]" 1
1551 1 96 PHE HA 1 100 VAL MG1 2.770 . 2.770 2.200 1.902 2.336 . 0 0 "[ . 1]" 1
1552 1 96 PHE HB2 1 100 VAL MG1 4.840 . 4.840 3.241 3.076 3.377 . 0 0 "[ . 1]" 1
1553 1 96 PHE HB3 1 100 VAL MG1 4.500 . 4.500 3.971 3.871 4.036 . 0 0 "[ . 1]" 1
1554 1 96 PHE QD 1 97 TYR H 3.240 . 3.240 2.452 2.350 2.555 . 0 0 "[ . 1]" 1
1555 1 96 PHE QD 1 97 TYR HA 3.900 . 3.900 2.778 2.729 2.860 . 0 0 "[ . 1]" 1
1556 1 96 PHE QD 1 97 TYR HB2 3.950 . 3.950 3.875 3.747 3.961 0.011 10 0 "[ . 1]" 1
1557 1 96 PHE QD 1 97 TYR QD 3.710 . 3.710 3.123 3.023 3.215 . 0 0 "[ . 1]" 1
1558 1 96 PHE QD 1 97 TYR QE 3.760 . 3.760 3.691 3.537 3.784 0.024 4 0 "[ . 1]" 1
1559 1 96 PHE QD 1 100 VAL MG1 3.460 . 3.460 2.222 2.030 2.379 . 0 0 "[ . 1]" 1
1560 1 96 PHE QD 1 100 VAL MG2 4.130 . 4.130 4.055 3.812 4.177 0.047 2 0 "[ . 1]" 1
1561 1 96 PHE QD 1 101 LEU HB2 3.910 . 3.910 3.388 3.285 3.460 . 0 0 "[ . 1]" 1
1562 1 96 PHE QD 1 101 LEU HG 4.240 . 4.240 4.352 4.320 4.396 0.156 6 0 "[ . 1]" 1
1563 1 96 PHE QE 1 100 VAL MG1 3.760 . 3.760 2.601 2.476 2.891 . 0 0 "[ . 1]" 1
1564 1 96 PHE QE 1 100 VAL MG2 3.750 . 3.750 3.651 3.549 3.751 0.001 6 0 "[ . 1]" 1
1565 1 96 PHE QE 1 101 LEU HB2 3.700 . 3.700 3.009 2.901 3.105 . 0 0 "[ . 1]" 1
1566 1 96 PHE QE 1 101 LEU QD 3.280 . 3.280 2.122 1.798 2.334 0.002 2 0 "[ . 1]" 1
1567 1 96 PHE QE 1 101 LEU HG 4.430 . 4.430 3.014 2.874 3.179 . 0 0 "[ . 1]" 1
1568 1 97 TYR H 1 97 TYR HB2 3.530 . 3.530 2.340 2.296 2.395 . 0 0 "[ . 1]" 1
1569 1 97 TYR H 1 97 TYR HB3 3.770 . 3.770 3.568 3.552 3.589 . 0 0 "[ . 1]" 1
1570 1 97 TYR H 1 97 TYR QD 3.960 . 3.960 2.972 2.772 3.163 . 0 0 "[ . 1]" 1
1571 1 97 TYR H 1 98 THR H 3.520 . 3.520 2.764 2.702 2.801 . 0 0 "[ . 1]" 1
1572 1 97 TYR H 1 98 THR MG 5.500 . 5.500 4.445 4.210 4.667 . 0 0 "[ . 1]" 1
1573 1 97 TYR HA 1 97 TYR QD 3.210 . 3.210 2.330 2.156 2.544 . 0 0 "[ . 1]" 1
1574 1 97 TYR HA 1 97 TYR QE 4.270 . 4.270 4.322 4.279 4.362 0.092 4 0 "[ . 1]" 1
1575 1 97 TYR HA 1 101 LEU HA 4.430 . 4.430 4.376 4.296 4.439 0.009 4 0 "[ . 1]" 1
1576 1 97 TYR HA 1 101 LEU HB2 3.690 . 3.690 1.865 1.778 1.988 0.022 6 0 "[ . 1]" 1
1577 1 97 TYR HA 1 101 LEU HB3 3.300 . 3.300 2.114 1.931 2.221 . 0 0 "[ . 1]" 1
1578 1 97 TYR HA 1 101 LEU QD 3.790 . 3.790 3.352 3.315 3.384 . 0 0 "[ . 1]" 1
1579 1 97 TYR HA 1 101 LEU HG 3.880 . 3.880 3.039 2.968 3.128 . 0 0 "[ . 1]" 1
1580 1 97 TYR HA 1 102 PHE H 3.880 . 3.880 3.453 3.335 3.524 . 0 0 "[ . 1]" 1
1581 1 97 TYR HA 1 102 PHE QE 5.130 . 5.130 3.964 3.830 4.055 . 0 0 "[ . 1]" 1
1582 1 97 TYR HB2 1 98 THR H 3.860 . 3.860 2.566 2.499 2.638 . 0 0 "[ . 1]" 1
1583 1 97 TYR HB2 1 101 LEU QD 5.320 . 5.320 5.292 5.228 5.344 0.024 4 0 "[ . 1]" 1
1584 1 97 TYR HB2 1 102 PHE QE 4.240 . 4.240 4.279 4.248 4.303 0.063 10 0 "[ . 1]" 1
1585 1 97 TYR HB3 1 98 THR H 4.110 . 4.110 3.370 3.256 3.444 . 0 0 "[ . 1]" 1
1586 1 97 TYR HB3 1 98 THR MG 4.380 . 4.380 3.615 3.391 3.724 . 0 0 "[ . 1]" 1
1587 1 97 TYR HB3 1 109 PHE QE 4.210 . 4.210 4.335 4.268 4.378 0.168 9 0 "[ . 1]" 1
1588 1 97 TYR QD 1 101 LEU HB2 4.190 . 4.190 3.009 2.755 3.288 . 0 0 "[ . 1]" 1
1589 1 97 TYR QD 1 101 LEU HG 2.910 . 2.910 1.915 1.795 2.101 0.005 6 0 "[ . 1]" 1
1590 1 97 TYR QE 1 101 LEU QD 4.110 . 4.110 3.299 3.046 3.545 . 0 0 "[ . 1]" 1
1591 1 97 TYR QE 1 101 LEU HG 3.290 . 3.290 3.119 2.946 3.284 . 0 0 "[ . 1]" 1
1592 1 98 THR H 1 98 THR MG 3.230 . 3.230 2.418 2.232 2.599 . 0 0 "[ . 1]" 1
1593 1 98 THR HA 1 98 THR HB 2.610 . 2.610 2.476 2.398 2.517 . 0 0 "[ . 1]" 1
1594 1 98 THR HA 1 98 THR MG 3.000 . 3.000 2.299 2.209 2.415 . 0 0 "[ . 1]" 1
1595 1 98 THR HA 1 102 PHE H 4.540 . 4.540 3.451 3.364 3.551 . 0 0 "[ . 1]" 1
1596 1 98 THR HA 1 102 PHE QD 2.960 . 2.960 3.049 3.011 3.089 0.129 5 0 "[ . 1]" 1
1597 1 98 THR HA 1 102 PHE QE 4.040 . 4.040 4.120 4.101 4.180 0.140 5 0 "[ . 1]" 1
1598 1 98 THR HA 1 109 PHE QD 4.160 . 4.160 3.779 3.678 3.898 . 0 0 "[ . 1]" 1
1599 1 98 THR HB 1 102 PHE QD 4.310 . 4.310 4.345 4.314 4.386 0.076 9 0 "[ . 1]" 1
1600 1 98 THR MG 1 99 GLU H 4.460 . 4.460 4.152 4.056 4.214 . 0 0 "[ . 1]" 1
1601 1 98 THR MG 1 102 PHE QD 3.940 . 3.940 3.199 2.899 3.605 . 0 0 "[ . 1]" 1
1602 1 98 THR MG 1 102 PHE QE 3.890 . 3.890 3.086 2.942 3.402 . 0 0 "[ . 1]" 1
1603 1 98 THR MG 1 109 PHE HB2 4.780 . 4.780 2.706 2.325 2.993 . 0 0 "[ . 1]" 1
1604 1 98 THR MG 1 109 PHE QD 3.040 . 3.040 2.024 1.790 2.428 0.010 1 0 "[ . 1]" 1
1605 1 98 THR MG 1 109 PHE QE 3.540 . 3.540 2.846 2.713 3.039 . 0 0 "[ . 1]" 1
1606 1 99 GLU H 1 99 GLU HG2 3.680 . 3.680 2.672 2.160 2.954 . 0 0 "[ . 1]" 1
1607 1 99 GLU H 1 99 GLU HG3 3.700 . 3.700 2.278 1.983 3.266 . 0 0 "[ . 1]" 1
1608 1 99 GLU H 1 100 VAL H 3.210 . 3.210 2.455 2.301 2.540 . 0 0 "[ . 1]" 1
1609 1 99 GLU H 1 100 VAL MG1 4.120 . 4.120 3.914 3.576 4.048 . 0 0 "[ . 1]" 1
1610 1 99 GLU H 1 101 LEU H 5.370 . 5.370 3.811 3.584 3.941 . 0 0 "[ . 1]" 1
1611 1 99 GLU HA 1 99 GLU HG2 3.900 . 3.900 3.755 2.790 4.061 0.161 6 0 "[ . 1]" 1
1612 1 99 GLU HA 1 99 GLU HG3 3.800 . 3.800 3.646 3.558 3.929 0.129 5 0 "[ . 1]" 1
1613 1 99 GLU HA 1 103 PRO QG 3.110 . 3.110 3.263 3.223 3.310 0.200 8 0 "[ . 1]" 1
1614 1 99 GLU HG2 1 100 VAL H 4.930 . 4.930 3.775 3.674 4.161 . 0 0 "[ . 1]" 1
1615 1 99 GLU HG2 1 100 VAL MG1 4.850 . 4.850 4.392 4.158 5.005 0.155 3 0 "[ . 1]" 1
1616 1 100 VAL H 1 100 VAL HB 3.690 . 3.690 3.003 2.970 3.086 . 0 0 "[ . 1]" 1
1617 1 100 VAL H 1 100 VAL MG1 3.410 . 3.410 2.154 1.932 2.224 . 0 0 "[ . 1]" 1
1618 1 100 VAL H 1 101 LEU HB3 5.270 . 5.270 4.740 4.626 4.812 . 0 0 "[ . 1]" 1
1619 1 100 VAL H 1 103 PRO HD3 4.540 . 4.540 3.937 3.869 3.995 . 0 0 "[ . 1]" 1
1620 1 100 VAL H 1 103 PRO QG 4.210 . 4.210 3.660 3.626 3.708 . 0 0 "[ . 1]" 1
1621 1 100 VAL HA 1 100 VAL MG2 2.900 . 2.900 2.372 2.308 2.426 . 0 0 "[ . 1]" 1
1622 1 100 VAL HA 1 103 PRO HB3 4.630 . 4.630 4.428 4.363 4.514 . 0 0 "[ . 1]" 1
1623 1 100 VAL HA 1 103 PRO HD3 4.010 . 4.010 4.076 4.044 4.110 0.100 10 0 "[ . 1]" 1
1624 1 100 VAL HA 1 103 PRO QG 3.460 . 3.460 1.964 1.923 2.009 . 0 0 "[ . 1]" 1
1625 1 100 VAL HB 1 101 LEU H 3.930 . 3.930 3.980 3.950 4.031 0.101 3 0 "[ . 1]" 1
1626 1 100 VAL MG1 1 101 LEU H 3.770 . 3.770 1.980 1.923 2.066 . 0 0 "[ . 1]" 1
1627 1 100 VAL MG1 1 101 LEU HA 3.910 . 3.910 3.288 3.183 3.528 . 0 0 "[ . 1]" 1
1628 1 100 VAL MG2 1 101 LEU H 3.520 . 3.520 3.547 3.377 3.592 0.072 8 0 "[ . 1]" 1
1629 1 100 VAL MG2 1 101 LEU HA 3.830 . 3.830 3.528 3.374 3.584 . 0 0 "[ . 1]" 1
1630 1 101 LEU H 1 101 LEU HB2 3.640 . 3.640 2.183 2.144 2.253 . 0 0 "[ . 1]" 1
1631 1 101 LEU H 1 101 LEU HB3 3.800 . 3.800 2.867 2.776 2.924 . 0 0 "[ . 1]" 1
1632 1 101 LEU H 1 101 LEU QD 4.020 . 4.020 3.412 3.349 3.466 . 0 0 "[ . 1]" 1
1633 1 101 LEU H 1 102 PHE H 3.870 . 3.870 2.916 2.847 2.953 . 0 0 "[ . 1]" 1
1634 1 101 LEU H 1 103 PRO HD2 5.500 . 5.500 3.022 2.962 3.067 . 0 0 "[ . 1]" 1
1635 1 101 LEU HA 1 101 LEU QD 2.790 . 2.790 1.974 1.848 2.071 . 0 0 "[ . 1]" 1
1636 1 101 LEU HA 1 101 LEU HG 3.720 . 3.720 3.689 3.670 3.727 0.007 5 0 "[ . 1]" 1
1637 1 101 LEU HA 1 102 PHE QD 4.460 . 4.460 4.408 4.324 4.455 . 0 0 "[ . 1]" 1
1638 1 101 LEU HA 1 104 GLN H 4.850 . 4.850 4.777 4.712 4.854 0.004 1 0 "[ . 1]" 1
1639 1 101 LEU HA 1 104 GLN HG3 5.180 . 5.180 4.179 4.028 4.404 . 0 0 "[ . 1]" 1
1640 1 101 LEU HB2 1 102 PHE H 3.840 . 3.840 3.286 3.256 3.339 . 0 0 "[ . 1]" 1
1641 1 101 LEU HB3 1 102 PHE H 3.850 . 3.850 2.036 1.980 2.145 . 0 0 "[ . 1]" 1
1642 1 101 LEU HB3 1 102 PHE HB3 5.140 . 5.140 5.207 5.198 5.224 0.084 6 0 "[ . 1]" 1
1643 1 101 LEU HB3 1 102 PHE QD 4.210 . 4.210 2.144 2.015 2.188 . 0 0 "[ . 1]" 1
1644 1 101 LEU QD 1 102 PHE H 4.140 . 4.140 3.172 3.020 3.333 . 0 0 "[ . 1]" 1
1645 1 101 LEU QD 1 102 PHE QD 3.510 . 3.510 2.289 2.150 2.489 . 0 0 "[ . 1]" 1
1646 1 101 LEU QD 1 102 PHE QE 3.720 . 3.720 3.263 3.135 3.381 . 0 0 "[ . 1]" 1
1647 1 101 LEU QD 1 104 GLN HB2 5.190 . 5.190 4.936 4.671 5.138 . 0 0 "[ . 1]" 1
1648 1 101 LEU QD 1 104 GLN HG2 4.070 . 4.070 4.057 3.677 4.209 0.139 4 0 "[ . 1]" 1
1649 1 101 LEU QD 1 104 GLN HG3 5.070 . 5.070 3.385 3.162 3.598 . 0 0 "[ . 1]" 1
1650 1 101 LEU QD 1 105 LYS QE 3.620 . 3.620 3.654 3.388 3.713 0.093 6 0 "[ . 1]" 1
1651 1 101 LEU HG 1 102 PHE H 4.660 . 4.660 4.382 4.232 4.523 . 0 0 "[ . 1]" 1
1652 1 101 LEU HG 1 102 PHE QE 3.700 . 3.700 3.675 3.498 3.726 0.026 9 0 "[ . 1]" 1
1653 1 102 PHE H 1 102 PHE HB2 3.890 . 3.890 2.371 2.344 2.390 . 0 0 "[ . 1]" 1
1654 1 102 PHE H 1 102 PHE HB3 4.010 . 4.010 3.545 3.536 3.552 . 0 0 "[ . 1]" 1
1655 1 102 PHE H 1 102 PHE QD 3.410 . 3.410 2.113 2.085 2.168 . 0 0 "[ . 1]" 1
1656 1 102 PHE H 1 102 PHE QE 4.130 . 4.130 4.201 4.180 4.249 0.119 6 0 "[ . 1]" 1
1657 1 102 PHE H 1 103 PRO HD2 3.620 . 3.620 2.465 2.426 2.492 . 0 0 "[ . 1]" 1
1658 1 102 PHE H 1 103 PRO HD3 3.510 . 3.510 2.692 2.656 2.743 . 0 0 "[ . 1]" 1
1659 1 102 PHE HA 1 102 PHE QD 2.810 . 2.810 2.295 2.214 2.337 . 0 0 "[ . 1]" 1
1660 1 102 PHE HA 1 107 VAL HB 3.850 . 3.850 3.770 3.702 3.855 0.005 3 0 "[ . 1]" 1
1661 1 102 PHE HA 1 107 VAL MG1 4.340 . 4.340 4.000 3.963 4.038 . 0 0 "[ . 1]" 1
1662 1 102 PHE HB2 1 103 PRO HD2 3.440 . 3.440 3.453 3.398 3.482 0.042 1 0 "[ . 1]" 1
1663 1 102 PHE HB2 1 103 PRO HD3 3.260 . 3.260 2.371 2.285 2.435 . 0 0 "[ . 1]" 1
1664 1 102 PHE HB2 1 107 VAL HB 3.560 . 3.560 3.344 3.287 3.375 . 0 0 "[ . 1]" 1
1665 1 102 PHE HB2 1 107 VAL MG1 4.260 . 4.260 2.007 1.945 2.065 . 0 0 "[ . 1]" 1
1666 1 102 PHE HB2 1 107 VAL MG2 3.940 . 3.940 3.941 3.863 3.978 0.038 4 0 "[ . 1]" 1
1667 1 102 PHE HB3 1 107 VAL H 5.180 . 5.180 3.417 3.171 3.597 . 0 0 "[ . 1]" 1
1668 1 102 PHE HB3 1 107 VAL HB 3.160 . 3.160 1.723 1.703 1.744 0.097 4 0 "[ . 1]" 1
1669 1 102 PHE HB3 1 107 VAL MG1 4.550 . 4.550 1.781 1.740 1.904 0.060 8 0 "[ . 1]" 1
1670 1 102 PHE HB3 1 107 VAL MG2 4.940 . 4.940 2.861 2.775 2.897 . 0 0 "[ . 1]" 1
1671 1 102 PHE QD 1 103 PRO HD2 4.150 . 4.150 4.278 4.253 4.299 0.149 7 0 "[ . 1]" 1
1672 1 102 PHE QD 1 107 VAL H 5.220 . 5.220 4.787 4.647 4.886 . 0 0 "[ . 1]" 1
1673 1 102 PHE QD 1 107 VAL HA 4.370 . 4.370 4.555 4.472 4.606 0.236 7 0 "[ . 1]" 1
1674 1 102 PHE QD 1 107 VAL HB 3.510 . 3.510 2.841 2.729 2.941 . 0 0 "[ . 1]" 1
1675 1 102 PHE QD 1 107 VAL MG1 3.520 . 3.520 1.726 1.700 1.757 0.100 8 0 "[ . 1]" 1
1676 1 102 PHE QD 1 107 VAL MG2 3.880 . 3.880 1.764 1.739 1.857 0.061 9 0 "[ . 1]" 1
1677 1 102 PHE QD 1 109 PHE HA 4.690 . 4.690 4.809 4.774 4.854 0.164 3 0 "[ . 1]" 1
1678 1 102 PHE QD 1 109 PHE HB2 4.390 . 4.390 3.785 3.682 3.906 . 0 0 "[ . 1]" 1
1679 1 102 PHE QE 1 107 VAL MG2 4.610 . 4.610 2.858 2.812 2.898 . 0 0 "[ . 1]" 1
1680 1 102 PHE QE 1 109 PHE HB2 4.270 . 4.270 4.108 4.003 4.205 . 0 0 "[ . 1]" 1
1681 1 102 PHE QE 1 109 PHE QD 3.930 . 3.930 1.994 1.930 2.097 . 0 0 "[ . 1]" 1
1682 1 103 PRO HA 1 106 ASN H 3.610 . 3.610 2.954 2.891 3.061 . 0 0 "[ . 1]" 1
1683 1 103 PRO HA 1 106 ASN HB2 4.750 . 4.750 4.863 4.822 4.901 0.151 10 0 "[ . 1]" 1
1684 1 103 PRO HA 1 107 VAL H 4.200 . 4.200 3.511 3.392 3.736 . 0 0 "[ . 1]" 1
1685 1 103 PRO HA 1 107 VAL MG1 4.430 . 4.430 4.303 4.100 4.441 0.011 6 0 "[ . 1]" 1
1686 1 103 PRO HB3 1 104 GLN H 3.830 . 3.830 3.944 3.907 3.987 0.157 8 0 "[ . 1]" 1
1687 1 103 PRO HD2 1 104 GLN H 4.420 . 4.420 3.374 3.339 3.400 . 0 0 "[ . 1]" 1
1688 1 103 PRO HD3 1 104 GLN H 4.270 . 4.270 4.380 4.355 4.404 0.134 4 0 "[ . 1]" 1
1689 1 103 PRO QG 1 104 GLN H 4.010 . 4.010 3.976 3.930 4.019 0.009 8 0 "[ . 1]" 1
1690 1 104 GLN H 1 104 GLN HB2 3.110 . 3.110 3.211 3.048 3.305 0.195 3 0 "[ . 1]" 1
1691 1 104 GLN H 1 104 GLN HB3 3.510 . 3.510 3.484 3.397 3.555 0.045 5 0 "[ . 1]" 1
1692 1 104 GLN H 1 104 GLN HG2 3.630 . 3.630 2.190 2.057 2.278 . 0 0 "[ . 1]" 1
1693 1 104 GLN H 1 104 GLN HG3 3.310 . 3.310 1.981 1.822 2.118 . 0 0 "[ . 1]" 1
1694 1 104 GLN H 1 105 LYS H 3.450 . 3.450 2.903 2.812 2.977 . 0 0 "[ . 1]" 1
1695 1 104 GLN H 1 105 LYS QE 4.610 . 4.610 2.815 2.257 3.531 . 0 0 "[ . 1]" 1
1696 1 104 GLN H 1 106 ASN H 5.090 . 5.090 4.072 3.993 4.113 . 0 0 "[ . 1]" 1
1697 1 104 GLN HA 1 104 GLN HB2 2.860 . 2.860 2.925 2.883 2.976 0.116 5 0 "[ . 1]" 1
1698 1 104 GLN HA 1 104 GLN HB3 2.620 . 2.620 2.244 2.225 2.289 . 0 0 "[ . 1]" 1
1699 1 104 GLN HA 1 104 GLN HG2 3.070 . 3.070 2.985 2.739 3.175 0.105 3 0 "[ . 1]" 1
1700 1 104 GLN HA 1 104 GLN HG3 3.490 . 3.490 3.606 3.542 3.680 0.190 10 0 "[ . 1]" 1
1701 1 104 GLN HA 1 105 LYS H 3.630 . 3.630 3.501 3.456 3.547 . 0 0 "[ . 1]" 1
1702 1 104 GLN HA 1 105 LYS HA 4.690 . 4.690 4.520 4.500 4.555 . 0 0 "[ . 1]" 1
1703 1 104 GLN HB2 1 105 LYS H 3.950 . 3.950 3.050 2.771 3.265 . 0 0 "[ . 1]" 1
1704 1 104 GLN HB2 1 105 LYS QE 3.900 . 3.900 2.355 1.722 3.236 0.078 10 0 "[ . 1]" 1
1705 1 104 GLN HB3 1 105 LYS QE 4.470 . 4.470 3.768 3.156 4.590 0.120 5 0 "[ . 1]" 1
1706 1 104 GLN HG3 1 105 LYS H 4.520 . 4.520 3.538 3.166 3.776 . 0 0 "[ . 1]" 1
1707 1 105 LYS H 1 105 LYS HB2 4.010 . 4.010 3.092 2.731 3.214 . 0 0 "[ . 1]" 1
1708 1 105 LYS H 1 105 LYS HB3 4.020 . 4.020 3.784 3.747 3.827 . 0 0 "[ . 1]" 1
1709 1 105 LYS H 1 105 LYS QD 3.870 . 3.870 2.605 1.874 3.632 . 0 0 "[ . 1]" 1
1710 1 105 LYS H 1 105 LYS HG2 4.050 . 4.050 3.903 3.728 4.066 0.016 3 0 "[ . 1]" 1
1711 1 105 LYS H 1 105 LYS HG3 4.190 . 4.190 2.696 2.140 3.656 . 0 0 "[ . 1]" 1
1712 1 105 LYS H 1 106 ASN HA 4.480 . 4.480 4.351 4.252 4.456 . 0 0 "[ . 1]" 1
1713 1 105 LYS H 1 107 VAL H 5.220 . 5.220 4.661 4.169 5.109 . 0 0 "[ . 1]" 1
1714 1 105 LYS HA 1 105 LYS QE 4.000 . 4.000 4.055 3.933 4.202 0.202 6 0 "[ . 1]" 1
1715 1 105 LYS HB2 1 106 ASN H 4.740 . 4.740 3.820 3.494 4.012 . 0 0 "[ . 1]" 1
1716 1 105 LYS HB3 1 105 LYS QD 3.330 . 3.330 3.205 3.009 3.519 0.189 3 0 "[ . 1]" 1
1717 1 105 LYS HB3 1 105 LYS QE 5.140 . 5.140 3.940 3.391 4.159 . 0 0 "[ . 1]" 1
1718 1 105 LYS HB3 1 106 ASN H 5.160 . 5.160 4.594 4.357 4.669 . 0 0 "[ . 1]" 1
1719 1 106 ASN H 1 106 ASN HA 2.630 . 2.630 2.275 2.266 2.281 . 0 0 "[ . 1]" 1
1720 1 106 ASN H 1 106 ASN HB2 3.830 . 3.830 3.168 3.069 3.273 . 0 0 "[ . 1]" 1
1721 1 106 ASN H 1 106 ASN HB3 3.740 . 3.740 3.554 3.476 3.634 . 0 0 "[ . 1]" 1
1722 1 106 ASN H 1 107 VAL H 3.570 . 3.570 3.356 3.102 3.583 0.013 6 0 "[ . 1]" 1
1723 1 106 ASN H 1 107 VAL MG1 5.010 . 5.010 4.994 4.686 5.086 0.076 6 0 "[ . 1]" 1
1724 1 106 ASN HA 1 106 ASN HB2 2.770 . 2.770 2.432 2.395 2.482 . 0 0 "[ . 1]" 1
1725 1 106 ASN HA 1 106 ASN HB3 3.010 . 3.010 3.026 3.024 3.029 0.019 4 0 "[ . 1]" 1
1726 1 106 ASN HA 1 106 ASN HD22 4.850 . 4.850 4.039 3.583 4.717 . 0 0 "[ . 1]" 1
1727 1 106 ASN HA 1 107 VAL H 3.200 . 3.200 2.197 2.138 2.327 . 0 0 "[ . 1]" 1
1728 1 106 ASN HA 1 107 VAL MG1 4.480 . 4.480 4.181 3.911 4.303 . 0 0 "[ . 1]" 1
1729 1 106 ASN HB2 1 106 ASN HD22 3.410 . 3.410 3.493 3.461 3.548 0.138 10 0 "[ . 1]" 1
1730 1 106 ASN HB2 1 107 VAL H 4.660 . 4.660 4.475 4.383 4.567 . 0 0 "[ . 1]" 1
1731 1 106 ASN HB3 1 106 ASN HD22 4.080 . 4.080 3.956 3.604 4.081 0.001 9 0 "[ . 1]" 1
1732 1 106 ASN HB3 1 107 VAL H 4.510 . 4.510 4.459 4.383 4.492 . 0 0 "[ . 1]" 1
1733 1 107 VAL H 1 107 VAL HB 3.340 . 3.340 2.563 2.374 2.813 . 0 0 "[ . 1]" 1
1734 1 107 VAL H 1 107 VAL MG1 3.190 . 3.190 2.358 2.085 2.481 . 0 0 "[ . 1]" 1
1735 1 107 VAL H 1 107 VAL MG2 3.850 . 3.850 3.795 3.717 3.868 0.018 3 0 "[ . 1]" 1
1736 1 107 VAL H 1 108 ARG H 5.400 . 5.400 4.516 4.466 4.559 . 0 0 "[ . 1]" 1
1737 1 107 VAL HA 1 107 VAL MG1 3.190 . 3.190 3.149 3.136 3.177 . 0 0 "[ . 1]" 1
1738 1 107 VAL HA 1 107 VAL MG2 3.220 . 3.220 2.124 2.044 2.159 . 0 0 "[ . 1]" 1
1739 1 107 VAL HA 1 108 ARG H 2.900 . 2.900 2.163 2.149 2.189 . 0 0 "[ . 1]" 1
1740 1 107 VAL HA 1 108 ARG HB2 4.200 . 4.200 4.042 3.981 4.107 . 0 0 "[ . 1]" 1
1741 1 107 VAL HA 1 109 PHE H 5.380 . 5.380 5.275 5.251 5.325 . 0 0 "[ . 1]" 1
1742 1 107 VAL HB 1 108 ARG H 4.220 . 4.220 3.984 3.931 4.018 . 0 0 "[ . 1]" 1
1743 1 107 VAL MG1 1 108 ARG H 4.140 . 4.140 3.284 3.218 3.437 . 0 0 "[ . 1]" 1
1744 1 107 VAL MG1 1 109 PHE HA 5.110 . 5.110 4.085 3.988 4.387 . 0 0 "[ . 1]" 1
1745 1 107 VAL MG2 1 108 ARG H 3.610 . 3.610 1.992 1.915 2.080 . 0 0 "[ . 1]" 1
1746 1 107 VAL MG2 1 108 ARG HA 4.420 . 4.420 3.847 3.781 3.923 . 0 0 "[ . 1]" 1
1747 1 107 VAL MG2 1 108 ARG HB2 4.350 . 4.350 4.304 4.216 4.415 0.065 1 0 "[ . 1]" 1
1748 1 107 VAL MG2 1 109 PHE H 5.500 . 5.500 3.543 3.281 3.612 . 0 0 "[ . 1]" 1
1749 1 107 VAL MG2 1 109 PHE HA 3.810 . 3.810 3.470 3.259 3.556 . 0 0 "[ . 1]" 1
1750 1 107 VAL MG2 1 109 PHE HB2 4.380 . 4.380 3.660 3.233 3.787 . 0 0 "[ . 1]" 1
1751 1 107 VAL MG2 1 109 PHE HB3 4.970 . 4.970 5.008 4.663 5.097 0.127 2 0 "[ . 1]" 1
1752 1 107 VAL MG2 1 109 PHE QD 4.170 . 4.170 3.309 3.026 3.426 . 0 0 "[ . 1]" 1
1753 1 108 ARG H 1 108 ARG HB2 3.770 . 3.770 2.648 2.551 2.779 . 0 0 "[ . 1]" 1
1754 1 108 ARG H 1 108 ARG HB3 3.690 . 3.690 3.158 3.039 3.245 . 0 0 "[ . 1]" 1
1755 1 108 ARG H 1 108 ARG QD 4.430 . 4.430 4.160 3.666 4.442 0.012 10 0 "[ . 1]" 1
1756 1 108 ARG H 1 109 PHE H 5.420 . 5.420 3.769 3.745 3.816 . 0 0 "[ . 1]" 1
1757 1 108 ARG H 1 109 PHE QD 5.500 . 5.500 5.637 5.591 5.666 0.166 10 0 "[ . 1]" 1
1758 1 108 ARG HA 1 108 ARG QD 4.220 . 4.220 2.558 1.999 3.064 . 0 0 "[ . 1]" 1
1759 1 108 ARG HA 1 108 ARG QG 3.980 . 3.980 2.306 2.064 2.584 . 0 0 "[ . 1]" 1
1760 1 108 ARG HA 1 109 PHE H 2.920 . 2.920 2.203 2.185 2.220 . 0 0 "[ . 1]" 1
1761 1 108 ARG HA 1 109 PHE HA 4.320 . 4.320 4.429 4.416 4.434 0.114 4 0 "[ . 1]" 1
1762 1 108 ARG QD 1 109 PHE H 5.020 . 5.020 4.097 3.104 5.030 0.010 9 0 "[ . 1]" 1
1763 1 109 PHE H 1 109 PHE HB2 3.580 . 3.580 2.262 2.239 2.283 . 0 0 "[ . 1]" 1
1764 1 109 PHE H 1 109 PHE HB3 3.630 . 3.630 2.891 2.866 2.914 . 0 0 "[ . 1]" 1
1765 1 109 PHE H 1 109 PHE QD 4.280 . 4.280 4.034 4.021 4.045 . 0 0 "[ . 1]" 1
1766 1 109 PHE HA 1 109 PHE QD 2.980 . 2.980 3.020 3.003 3.031 0.051 9 0 "[ . 1]" 1
1767 1 109 PHE HA 1 110 LEU H 2.980 . 2.980 2.252 2.221 2.283 . 0 0 "[ . 1]" 1
1768 1 109 PHE HB2 1 110 LEU H 4.910 . 4.910 4.230 4.164 4.270 . 0 0 "[ . 1]" 1
1769 1 109 PHE HB2 1 116 ILE MG 4.500 . 4.500 4.487 4.409 4.546 0.046 4 0 "[ . 1]" 1
1770 1 109 PHE HB3 1 116 ILE HG13 3.330 . 3.330 2.787 2.606 2.936 . 0 0 "[ . 1]" 1
1771 1 109 PHE QD 1 110 LEU H 3.420 . 3.420 2.350 2.215 2.490 . 0 0 "[ . 1]" 1
1772 1 109 PHE QD 1 110 LEU HA 4.420 . 4.420 3.565 3.487 3.617 . 0 0 "[ . 1]" 1
1773 1 109 PHE QD 1 111 ALA H 5.020 . 5.020 4.029 3.988 4.080 . 0 0 "[ . 1]" 1
1774 1 109 PHE QD 1 111 ALA MB 3.540 . 3.540 3.406 3.336 3.540 . 0 0 "[ . 1]" 1
1775 1 109 PHE QD 1 116 ILE MD 3.200 . 3.200 2.403 2.220 2.765 . 0 0 "[ . 1]" 1
1776 1 109 PHE QD 1 116 ILE MG 3.920 . 3.920 3.973 3.912 4.022 0.102 9 0 "[ . 1]" 1
1777 1 109 PHE QE 1 110 LEU H 3.940 . 3.940 3.837 3.737 3.944 0.004 1 0 "[ . 1]" 1
1778 1 109 PHE QE 1 111 ALA MB 3.370 . 3.370 3.493 3.442 3.566 0.196 10 0 "[ . 1]" 1
1779 1 110 LEU H 1 110 LEU HB2 3.860 . 3.860 3.339 3.104 3.414 . 0 0 "[ . 1]" 1
1780 1 110 LEU H 1 110 LEU HB3 3.410 . 3.410 2.647 2.572 2.857 . 0 0 "[ . 1]" 1
1781 1 110 LEU H 1 110 LEU QD 4.140 . 4.140 3.496 3.388 3.725 . 0 0 "[ . 1]" 1
1782 1 110 LEU H 1 111 ALA H 4.330 . 4.330 4.238 4.210 4.276 . 0 0 "[ . 1]" 1
1783 1 110 LEU HA 1 110 LEU HB2 2.450 . 2.450 2.342 2.314 2.478 0.028 10 0 "[ . 1]" 1
1784 1 110 LEU HA 1 110 LEU QD 3.210 . 3.210 1.968 1.915 2.031 . 0 0 "[ . 1]" 1
1785 1 110 LEU HA 1 110 LEU HG 4.150 . 4.150 3.794 3.762 3.820 . 0 0 "[ . 1]" 1
1786 1 110 LEU HA 1 111 ALA H 2.800 . 2.800 2.075 2.066 2.086 . 0 0 "[ . 1]" 1
1787 1 110 LEU HA 1 111 ALA HA 4.420 . 4.420 4.393 4.377 4.413 . 0 0 "[ . 1]" 1
1788 1 110 LEU HB2 1 111 ALA H 3.860 . 3.860 4.007 3.978 4.116 0.256 10 0 "[ . 1]" 1
1789 1 110 LEU HB3 1 110 LEU QD 3.250 . 3.250 2.104 2.067 2.281 . 0 0 "[ . 1]" 1
1790 1 110 LEU HB3 1 110 LEU HG 2.830 . 2.830 2.539 2.426 2.565 . 0 0 "[ . 1]" 1
1791 1 110 LEU HB3 1 111 ALA H 4.300 . 4.300 4.257 3.985 4.313 0.013 6 0 "[ . 1]" 1
1792 1 110 LEU QD 1 111 ALA H 3.560 . 3.560 1.986 1.921 2.018 . 0 0 "[ . 1]" 1
1793 1 110 LEU QD 1 111 ALA HA 3.630 . 3.630 2.728 2.650 2.835 . 0 0 "[ . 1]" 1
1794 1 110 LEU QD 1 116 ILE HB 3.620 . 3.620 3.621 3.495 3.670 0.050 5 0 "[ . 1]" 1
1795 1 110 LEU HG 1 111 ALA H 4.450 . 4.450 4.469 4.348 4.503 0.053 4 0 "[ . 1]" 1
1796 1 110 LEU HG 1 112 ILE HG13 3.570 . 3.570 3.461 3.219 3.601 0.031 10 0 "[ . 1]" 1
1797 1 111 ALA H 1 111 ALA MB 3.090 . 3.090 2.488 2.455 2.535 . 0 0 "[ . 1]" 1
1798 1 111 ALA H 1 112 ILE HA 4.340 . 4.340 4.421 4.375 4.449 0.109 1 0 "[ . 1]" 1
1799 1 111 ALA H 1 116 ILE HB 3.760 . 3.760 2.475 2.279 2.650 . 0 0 "[ . 1]" 1
1800 1 111 ALA H 1 116 ILE MG 4.350 . 4.350 3.667 3.473 3.846 . 0 0 "[ . 1]" 1
1801 1 111 ALA HA 1 112 ILE H 3.320 . 3.320 2.179 2.157 2.212 . 0 0 "[ . 1]" 1
1802 1 111 ALA HA 1 112 ILE HA 4.460 . 4.460 4.418 4.388 4.460 0.000 6 0 "[ . 1]" 1
1803 1 111 ALA HA 1 112 ILE MD 4.590 . 4.590 4.572 4.358 4.655 0.065 4 0 "[ . 1]" 1
1804 1 111 ALA HA 1 116 ILE HB 4.840 . 4.840 4.698 4.534 4.849 0.009 8 0 "[ . 1]" 1
1805 1 111 ALA HA 1 116 ILE HG13 4.370 . 4.370 4.395 4.378 4.422 0.052 10 0 "[ . 1]" 1
1806 1 111 ALA MB 1 113 ASN H 4.480 . 4.480 3.910 3.669 4.172 . 0 0 "[ . 1]" 1
1807 1 111 ALA MB 1 114 ASN HB2 3.850 . 3.850 3.785 3.421 3.921 0.071 10 0 "[ . 1]" 1
1808 1 111 ALA MB 1 114 ASN HB3 3.650 . 3.650 3.626 3.139 3.717 0.067 9 0 "[ . 1]" 1
1809 1 111 ALA MB 1 116 ILE HA 4.560 . 4.560 2.472 2.155 2.778 . 0 0 "[ . 1]" 1
1810 1 111 ALA MB 1 116 ILE HB 3.720 . 3.720 2.395 2.224 2.645 . 0 0 "[ . 1]" 1
1811 1 111 ALA MB 1 116 ILE MD 3.540 . 3.540 3.175 3.068 3.375 . 0 0 "[ . 1]" 1
1812 1 112 ILE H 1 112 ILE HB 3.580 . 3.580 2.362 2.302 2.408 . 0 0 "[ . 1]" 1
1813 1 112 ILE H 1 112 ILE MD 3.920 . 3.920 3.058 2.736 3.178 . 0 0 "[ . 1]" 1
1814 1 112 ILE H 1 112 ILE HG12 3.850 . 3.850 3.921 3.851 4.004 0.154 6 0 "[ . 1]" 1
1815 1 112 ILE H 1 112 ILE HG13 3.160 . 3.160 2.535 2.419 2.714 . 0 0 "[ . 1]" 1
1816 1 112 ILE H 1 112 ILE MG 3.700 . 3.700 3.731 3.707 3.748 0.048 10 0 "[ . 1]" 1
1817 1 112 ILE H 1 113 ASN H 3.930 . 3.930 2.978 2.833 3.144 . 0 0 "[ . 1]" 1
1818 1 112 ILE HA 1 112 ILE MD 3.720 . 3.720 3.718 3.582 3.769 0.049 10 0 "[ . 1]" 1
1819 1 112 ILE HA 1 112 ILE HG12 3.440 . 3.440 2.779 2.715 2.895 . 0 0 "[ . 1]" 1
1820 1 112 ILE HA 1 112 ILE HG13 3.380 . 3.380 2.335 2.113 2.448 . 0 0 "[ . 1]" 1
1821 1 112 ILE HA 1 112 ILE MG 3.010 . 3.010 2.536 2.477 2.608 . 0 0 "[ . 1]" 1
1822 1 112 ILE HB 1 112 ILE MD 3.560 . 3.560 2.143 2.101 2.221 . 0 0 "[ . 1]" 1
1823 1 112 ILE HB 1 113 ASN H 3.810 . 3.810 2.813 2.621 3.089 . 0 0 "[ . 1]" 1
1824 1 112 ILE MD 1 112 ILE MG 3.480 . 3.480 2.491 2.408 2.629 . 0 0 "[ . 1]" 1
1825 1 112 ILE HG12 1 112 ILE MG 3.620 . 3.620 2.181 2.097 2.220 . 0 0 "[ . 1]" 1
1826 1 112 ILE MG 1 113 ASN H 4.200 . 4.200 3.073 2.800 3.321 . 0 0 "[ . 1]" 1
1827 1 112 ILE MG 1 113 ASN HA 4.220 . 4.220 3.177 3.052 3.355 . 0 0 "[ . 1]" 1
1828 1 113 ASN H 1 113 ASN QB 3.310 . 3.310 2.215 2.093 2.348 . 0 0 "[ . 1]" 1
1829 1 114 ASN HA 1 114 ASN HB3 2.760 . 2.760 2.843 2.804 2.862 0.102 1 0 "[ . 1]" 1
1830 1 114 ASN HA 1 115 SER H 3.430 . 3.430 2.421 2.260 2.650 . 0 0 "[ . 1]" 1
1831 1 114 ASN HB2 1 115 SER H 5.500 . 5.500 3.978 3.661 4.274 . 0 0 "[ . 1]" 1
1832 1 115 SER H 1 116 ILE H 4.360 . 4.360 4.342 4.240 4.379 0.019 7 0 "[ . 1]" 1
1833 1 115 SER HA 1 115 SER QB 2.650 . 2.650 2.376 2.187 2.514 . 0 0 "[ . 1]" 1
1834 1 115 SER HA 1 116 ILE H 3.060 . 3.060 2.152 2.124 2.177 . 0 0 "[ . 1]" 1
1835 1 115 SER HA 1 117 ASP H 4.960 . 4.960 3.972 3.837 4.137 . 0 0 "[ . 1]" 1
1836 1 115 SER QB 1 116 ILE H 4.620 . 4.620 3.606 3.453 3.820 . 0 0 "[ . 1]" 1
1837 1 115 SER QB 1 116 ILE MG 4.850 . 4.850 4.754 4.577 4.934 0.084 10 0 "[ . 1]" 1
1838 1 115 SER QB 1 117 ASP H 5.200 . 5.200 3.646 3.304 3.967 . 0 0 "[ . 1]" 1
1839 1 115 SER QB 1 117 ASP HA 4.650 . 4.650 4.492 4.367 4.689 0.039 8 0 "[ . 1]" 1
1840 1 116 ILE H 1 116 ILE HB 3.580 . 3.580 2.163 2.118 2.207 . 0 0 "[ . 1]" 1
1841 1 116 ILE H 1 116 ILE MD 5.120 . 5.120 4.361 4.332 4.395 . 0 0 "[ . 1]" 1
1842 1 116 ILE H 1 116 ILE HG12 4.430 . 4.430 3.965 3.892 4.042 . 0 0 "[ . 1]" 1
1843 1 116 ILE H 1 116 ILE HG13 5.070 . 5.070 4.459 4.384 4.534 . 0 0 "[ . 1]" 1
1844 1 116 ILE H 1 116 ILE MG 4.430 . 4.430 2.850 2.728 2.926 . 0 0 "[ . 1]" 1
1845 1 116 ILE HA 1 116 ILE HB 2.940 . 2.940 2.679 2.643 2.706 . 0 0 "[ . 1]" 1
1846 1 116 ILE HA 1 116 ILE MD 3.640 . 3.640 2.568 2.491 2.786 . 0 0 "[ . 1]" 1
1847 1 116 ILE HA 1 116 ILE HG12 3.400 . 3.400 2.211 2.146 2.267 . 0 0 "[ . 1]" 1
1848 1 116 ILE HA 1 116 ILE HG13 3.540 . 3.540 3.506 3.477 3.531 . 0 0 "[ . 1]" 1
1849 1 116 ILE HA 1 116 ILE MG 3.030 . 3.030 3.132 3.116 3.148 0.118 10 0 "[ . 1]" 1
1850 1 116 ILE HB 1 116 ILE MD 3.740 . 3.740 3.222 3.210 3.226 . 0 0 "[ . 1]" 1
1851 1 116 ILE HB 1 117 ASP H 4.360 . 4.360 3.542 3.421 3.615 . 0 0 "[ . 1]" 1
1852 1 116 ILE MD 1 117 ASP H 4.170 . 4.170 3.906 3.753 4.036 . 0 0 "[ . 1]" 1
1853 1 116 ILE MD 1 117 ASP HA 4.970 . 4.970 4.372 4.180 4.513 . 0 0 "[ . 1]" 1
1854 1 116 ILE MD 1 117 ASP HB2 4.930 . 4.930 2.817 2.440 3.295 . 0 0 "[ . 1]" 1
1855 1 116 ILE HG12 1 116 ILE MG 3.290 . 3.290 3.202 3.196 3.208 . 0 0 "[ . 1]" 1
1856 1 116 ILE HG12 1 117 ASP H 5.500 . 5.500 4.987 4.917 5.051 . 0 0 "[ . 1]" 1
1857 1 116 ILE HG13 1 116 ILE MG 3.400 . 3.400 2.448 2.384 2.545 . 0 0 "[ . 1]" 1
1858 1 116 ILE HG13 1 117 ASP H 5.370 . 5.370 5.135 5.020 5.257 . 0 0 "[ . 1]" 1
1859 1 116 ILE MG 1 117 ASP H 3.100 . 3.100 1.951 1.834 2.152 . 0 0 "[ . 1]" 1
1860 1 116 ILE MG 1 117 ASP HA 3.970 . 3.970 3.720 3.631 3.783 . 0 0 "[ . 1]" 1
1861 1 116 ILE MG 1 117 ASP HB2 3.900 . 3.900 2.177 1.962 2.875 . 0 0 "[ . 1]" 1
1862 1 116 ILE MG 1 117 ASP HB3 4.090 . 4.090 3.065 2.316 3.592 . 0 0 "[ . 1]" 1
1863 1 116 ILE MG 1 118 SER HA 4.570 . 4.570 4.672 4.565 4.743 0.173 9 0 "[ . 1]" 1
1864 1 116 ILE MG 1 118 SER HB2 4.810 . 4.810 4.042 3.235 4.941 0.131 3 0 "[ . 1]" 1
1865 1 117 ASP H 1 117 ASP HB2 3.830 . 3.830 3.138 2.794 3.601 . 0 0 "[ . 1]" 1
1866 1 117 ASP H 1 117 ASP HB3 3.630 . 3.630 3.472 3.101 3.717 0.087 8 0 "[ . 1]" 1
1867 1 117 ASP H 1 118 SER HA 4.370 . 4.370 4.263 3.949 4.455 0.085 5 0 "[ . 1]" 1
1868 1 117 ASP HB3 1 118 SER HA 4.680 . 4.680 4.221 3.811 4.588 . 0 0 "[ . 1]" 1
1869 1 118 SER H 1 118 SER HB2 3.580 . 3.580 2.481 2.086 3.208 . 0 0 "[ . 1]" 1
1870 1 118 SER HA 1 118 SER HB2 3.050 . 3.050 2.775 2.556 2.925 . 0 0 "[ . 1]" 1
1871 1 119 ASN H 1 119 ASN HB2 4.010 . 4.010 2.527 2.123 3.035 . 0 0 "[ . 1]" 1
1872 1 119 ASN H 1 120 ASN H 4.380 . 4.380 3.611 2.314 4.550 0.170 10 0 "[ . 1]" 1
1873 1 119 ASN HA 1 119 ASN HB3 2.960 . 2.960 2.861 2.727 2.925 . 0 0 "[ . 1]" 1
1874 1 119 ASN HA 1 119 ASN HD21 3.490 . 3.490 2.667 2.480 2.853 . 0 0 "[ . 1]" 1
1875 1 119 ASN HA 1 119 ASN HD22 3.440 . 3.440 3.496 3.440 3.581 0.141 4 0 "[ . 1]" 1
1876 1 119 ASN HA 1 120 ASN H 3.440 . 3.440 3.022 2.250 3.551 0.111 1 0 "[ . 1]" 1
1877 1 119 ASN HB2 1 120 ASN H 4.280 . 4.280 3.351 2.814 4.139 . 0 0 "[ . 1]" 1
1878 1 119 ASN HB3 1 119 ASN HD22 4.120 . 4.120 4.074 4.068 4.080 . 0 0 "[ . 1]" 1
1879 1 119 ASN HB3 1 120 ASN HA 3.740 . 3.740 3.831 3.793 3.953 0.213 2 0 "[ . 1]" 1
1880 1 120 ASN H 1 120 ASN HB2 3.230 . 3.230 2.849 2.163 3.280 0.050 10 0 "[ . 1]" 1
1881 1 120 ASN H 1 120 ASN HB3 3.540 . 3.540 3.323 2.432 3.626 0.086 6 0 "[ . 1]" 1
1882 1 120 ASN HA 1 120 ASN HB3 2.930 . 2.930 2.901 2.496 3.012 0.082 1 0 "[ . 1]" 1
stop_
save_