NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
392205 |
1psy   |
5374 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1psy
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 1452
_Distance_constraint_stats_list.Viol_count 1305
_Distance_constraint_stats_list.Viol_total 2217.169
_Distance_constraint_stats_list.Viol_max 1.522
_Distance_constraint_stats_list.Viol_rms 0.0298
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0038
_Distance_constraint_stats_list.Viol_average_violations_only 0.0849
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 SER 1.234 0.084 17 0 "[ . 1 . 2]"
1 7 LYS 0.412 0.052 1 0 "[ . 1 . 2]"
1 8 GLY 0.023 0.012 10 0 "[ . 1 . 2]"
1 9 GLU 0.162 0.062 14 0 "[ . 1 . 2]"
1 10 ARG 1.328 0.186 18 0 "[ . 1 . 2]"
1 11 GLU 1.658 0.097 17 0 "[ . 1 . 2]"
1 12 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 SER 0.106 0.106 5 0 "[ . 1 . 2]"
1 14 SER 1.648 0.109 13 0 "[ . 1 . 2]"
1 15 SER 0.150 0.150 20 0 "[ . 1 . 2]"
1 16 GLN 0.150 0.150 20 0 "[ . 1 . 2]"
1 17 GLN 0.176 0.092 16 0 "[ . 1 . 2]"
1 18 CYS 5.312 0.737 9 4 "[ *-. +1 * . 2]"
1 19 ARG 15.763 1.522 17 9 "[ *-. *1*** .*+ *2]"
1 20 GLN 3.049 0.250 16 0 "[ . 1 . 2]"
1 21 GLU 1.038 0.285 16 0 "[ . 1 . 2]"
1 22 VAL 8.811 1.522 17 6 "[ . 1**- .*+ *2]"
1 23 GLN 3.245 0.285 16 0 "[ . 1 . 2]"
1 24 ARG 0.058 0.048 17 0 "[ . 1 . 2]"
1 25 LYS 1.088 0.145 15 0 "[ . 1 . 2]"
1 26 ASP 7.222 0.544 4 2 "[ +. 1 - . 2]"
1 27 LEU 0.216 0.129 13 0 "[ . 1 . 2]"
1 28 SER 5.943 0.544 4 2 "[ +. 1 - . 2]"
1 29 SER 0.173 0.158 14 0 "[ . 1 . 2]"
1 30 CYS 3.570 0.174 7 0 "[ . 1 . 2]"
1 31 GLU 1.594 0.106 17 0 "[ . 1 . 2]"
1 32 ARG 3.718 0.158 14 0 "[ . 1 . 2]"
1 33 TYR 0.299 0.117 6 0 "[ . 1 . 2]"
1 34 LEU 1.541 0.175 4 0 "[ . 1 . 2]"
1 35 ARG 1.550 0.146 8 0 "[ . 1 . 2]"
1 36 GLN 2.762 0.175 4 0 "[ . 1 . 2]"
1 37 SER 0.817 0.090 4 0 "[ . 1 . 2]"
1 39 SER 0.421 0.062 19 0 "[ . 1 . 2]"
1 40 ARG 0.272 0.139 13 0 "[ . 1 . 2]"
1 41 ARG 1.141 0.105 16 0 "[ . 1 . 2]"
1 42 SER 0.340 0.156 8 0 "[ . 1 . 2]"
1 43 THR 0.467 0.156 8 0 "[ . 1 . 2]"
1 44 GLY 0.464 0.137 8 0 "[ . 1 . 2]"
1 45 GLU 0.943 0.137 8 0 "[ . 1 . 2]"
1 46 GLU 1.237 0.194 5 0 "[ . 1 . 2]"
1 47 VAL 1.109 0.168 6 0 "[ . 1 . 2]"
1 48 LEU 0.250 0.075 6 0 "[ . 1 . 2]"
1 49 ARG 0.244 0.075 11 0 "[ . 1 . 2]"
1 50 MET 0.096 0.047 6 0 "[ . 1 . 2]"
1 51 PRO 0.672 0.179 5 0 "[ . 1 . 2]"
1 52 GLY 0.747 0.179 5 0 "[ . 1 . 2]"
1 53 ASP 0.115 0.054 7 0 "[ . 1 . 2]"
1 54 GLU 1.130 0.128 12 0 "[ . 1 . 2]"
1 55 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLN 0.203 0.060 18 0 "[ . 1 . 2]"
1 57 GLN 0.217 0.101 5 0 "[ . 1 . 2]"
1 58 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 GLU 0.013 0.013 4 0 "[ . 1 . 2]"
1 60 SER 0.351 0.141 7 0 "[ . 1 . 2]"
1 61 GLN 0.423 0.141 7 0 "[ . 1 . 2]"
1 62 GLN 0.002 0.002 3 0 "[ . 1 . 2]"
1 63 LEU 0.577 0.096 12 0 "[ . 1 . 2]"
1 64 GLN 0.765 0.125 15 0 "[ . 1 . 2]"
1 65 GLN 3.790 0.211 8 0 "[ . 1 . 2]"
1 66 CYS 2.782 0.421 15 0 "[ . 1 . 2]"
1 67 CYS 2.850 0.148 18 0 "[ . 1 . 2]"
1 68 ASN 4.994 0.421 15 0 "[ . 1 . 2]"
1 69 GLN 0.604 0.222 8 0 "[ . 1 . 2]"
1 70 VAL 0.616 0.089 19 0 "[ . 1 . 2]"
1 71 LYS 0.586 0.127 5 0 "[ . 1 . 2]"
1 72 GLN 2.596 0.251 15 0 "[ . 1 . 2]"
1 73 VAL 4.179 0.251 15 0 "[ . 1 . 2]"
1 74 ARG 2.031 0.221 19 0 "[ . 1 . 2]"
1 75 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 CYS 2.892 0.221 19 0 "[ . 1 . 2]"
1 78 GLN 0.656 0.201 12 0 "[ . 1 . 2]"
1 79 CYS 11.342 0.535 5 4 "[ + 1 *. * -]"
1 80 GLU 2.681 0.313 10 0 "[ . 1 . 2]"
1 81 ALA 6.434 0.535 5 4 "[ + 1 *. * -]"
1 82 ILE 2.594 0.313 10 0 "[ . 1 . 2]"
1 83 LYS 0.491 0.131 15 0 "[ . 1 . 2]"
1 84 TYR 3.273 0.294 17 0 "[ . 1 . 2]"
1 85 ILE 0.520 0.151 9 0 "[ . 1 . 2]"
1 86 ALA 1.005 0.200 9 0 "[ . 1 . 2]"
1 87 GLU 1.686 0.145 16 0 "[ . 1 . 2]"
1 88 ASP 3.079 0.294 17 0 "[ . 1 . 2]"
1 89 GLN 2.219 0.200 9 0 "[ . 1 . 2]"
1 90 ILE 1.184 0.178 8 0 "[ . 1 . 2]"
1 91 GLN 3.961 0.375 8 0 "[ . 1 . 2]"
1 92 GLN 0.979 0.124 8 0 "[ . 1 . 2]"
1 93 GLY 4.296 0.375 8 0 "[ . 1 . 2]"
1 94 GLN 1.064 0.200 1 0 "[ . 1 . 2]"
1 95 LEU 1.490 0.200 1 0 "[ . 1 . 2]"
1 96 HIS 0.525 0.106 19 0 "[ . 1 . 2]"
1 97 GLY 0.315 0.061 19 0 "[ . 1 . 2]"
1 98 GLU 0.173 0.061 19 0 "[ . 1 . 2]"
1 99 GLU 0.302 0.074 5 0 "[ . 1 . 2]"
1 100 SER 1.276 0.125 8 0 "[ . 1 . 2]"
1 101 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ARG 0.026 0.026 1 0 "[ . 1 . 2]"
1 103 VAL 0.728 0.125 8 0 "[ . 1 . 2]"
1 104 ALA 0.225 0.162 8 0 "[ . 1 . 2]"
1 105 GLN 0.013 0.013 18 0 "[ . 1 . 2]"
1 106 ARG 0.311 0.162 8 0 "[ . 1 . 2]"
1 107 ALA 1.155 0.163 8 0 "[ . 1 . 2]"
1 108 GLY 0.230 0.037 19 0 "[ . 1 . 2]"
1 109 GLU 1.807 0.120 2 0 "[ . 1 . 2]"
1 110 ILE 1.581 0.174 7 0 "[ . 1 . 2]"
1 111 VAL 1.356 0.120 2 0 "[ . 1 . 2]"
1 112 SER 1.651 0.182 7 0 "[ . 1 . 2]"
1 113 SER 1.254 0.142 4 0 "[ . 1 . 2]"
1 114 CYS 3.167 0.142 4 0 "[ . 1 . 2]"
1 115 GLY 0.912 0.182 7 0 "[ . 1 . 2]"
1 116 VAL 1.658 0.127 13 0 "[ . 1 . 2]"
1 117 ARG 0.390 0.105 10 0 "[ . 1 . 2]"
1 118 CYS 5.599 0.387 8 0 "[ . 1 . 2]"
1 119 MET 0.176 0.062 6 0 "[ . 1 . 2]"
1 120 ARG 1.425 0.100 14 0 "[ . 1 . 2]"
1 121 GLN 0.072 0.033 11 0 "[ . 1 . 2]"
1 122 THR 0.146 0.058 12 0 "[ . 1 . 2]"
1 123 ARG 0.032 0.017 15 0 "[ . 1 . 2]"
1 124 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 PHE H 1 3 PHE QB . . 3.690 2.652 2.019 3.159 . 0 0 "[ . 1 . 2]" 1
2 1 3 PHE HA 1 4 MET H . . 3.290 2.342 2.145 2.757 . 0 0 "[ . 1 . 2]" 1
3 1 4 MET HA 1 5 GLU H . . 2.960 2.308 2.139 2.628 . 0 0 "[ . 1 . 2]" 1
4 1 5 GLU H 1 5 GLU HB2 . . 3.990 3.187 2.090 3.984 . 0 0 "[ . 1 . 2]" 1
5 1 5 GLU H 1 5 GLU QB . . 3.550 2.774 2.068 3.189 . 0 0 "[ . 1 . 2]" 1
6 1 5 GLU H 1 5 GLU HB3 . . 3.990 3.369 2.623 3.872 . 0 0 "[ . 1 . 2]" 1
7 1 5 GLU HA 1 6 SER H . . 3.130 2.421 2.209 2.554 . 0 0 "[ . 1 . 2]" 1
8 1 5 GLU QB 1 6 SER H . . 3.550 2.505 2.151 2.878 . 0 0 "[ . 1 . 2]" 1
9 1 5 GLU HB2 1 6 SER H . . 4.120 3.314 2.193 4.063 . 0 0 "[ . 1 . 2]" 1
10 1 5 GLU HB3 1 6 SER H . . 4.120 3.086 2.170 4.095 . 0 0 "[ . 1 . 2]" 1
11 1 6 SER H 1 6 SER HA . . 2.700 2.762 2.741 2.784 0.084 17 0 "[ . 1 . 2]" 1
12 1 6 SER HA 1 7 LYS H . . 3.230 2.274 2.139 2.882 . 0 0 "[ . 1 . 2]" 1
13 1 7 LYS H 1 7 LYS HA . . 2.890 2.884 2.736 2.942 0.052 1 0 "[ . 1 . 2]" 1
14 1 7 LYS H 1 7 LYS HB2 . . 3.890 3.153 2.088 3.907 0.017 10 0 "[ . 1 . 2]" 1
15 1 7 LYS H 1 7 LYS QB . . 3.510 2.801 2.070 3.146 . 0 0 "[ . 1 . 2]" 1
16 1 7 LYS H 1 7 LYS HB3 . . 3.890 3.403 3.121 3.787 . 0 0 "[ . 1 . 2]" 1
17 1 7 LYS HA 1 8 GLY H . . 3.490 2.373 2.116 2.830 . 0 0 "[ . 1 . 2]" 1
18 1 7 LYS QB 1 8 GLY H . . 5.190 3.099 2.049 4.058 . 0 0 "[ . 1 . 2]" 1
19 1 7 LYS HB2 1 8 GLY H . . 5.640 3.836 2.195 4.607 . 0 0 "[ . 1 . 2]" 1
20 1 7 LYS HB3 1 8 GLY H . . 5.640 3.566 2.061 4.635 . 0 0 "[ . 1 . 2]" 1
21 1 8 GLY H 1 9 GLU H . . 3.490 3.260 2.492 3.502 0.012 10 0 "[ . 1 . 2]" 1
22 1 8 GLY QA 1 9 GLU H . . 3.190 2.226 2.095 2.580 . 0 0 "[ . 1 . 2]" 1
23 1 9 GLU H 1 9 GLU HB2 . . 3.430 3.035 2.097 3.366 . 0 0 "[ . 1 . 2]" 1
24 1 9 GLU H 1 9 GLU HB3 . . 3.430 3.182 2.610 3.492 0.062 14 0 "[ . 1 . 2]" 1
25 1 9 GLU H 1 10 ARG H . . 4.650 3.638 1.893 4.678 0.028 18 0 "[ . 1 . 2]" 1
26 1 9 GLU QB 1 10 ARG H . . 3.980 2.945 1.930 3.580 . 0 0 "[ . 1 . 2]" 1
27 1 9 GLU QG 1 10 ARG H . . 5.660 2.861 1.905 4.259 . 0 0 "[ . 1 . 2]" 1
28 1 9 GLU QG 1 10 ARG QG . . 7.750 5.269 3.397 6.094 . 0 0 "[ . 1 . 2]" 1
29 1 10 ARG H 1 10 ARG HA . . 2.830 2.871 2.730 2.922 0.092 2 0 "[ . 1 . 2]" 1
30 1 10 ARG H 1 10 ARG HB2 . . 3.290 2.747 2.067 3.476 0.186 18 0 "[ . 1 . 2]" 1
31 1 10 ARG H 1 10 ARG QB . . 3.090 2.503 2.044 2.850 . 0 0 "[ . 1 . 2]" 1
32 1 10 ARG H 1 10 ARG HB3 . . 3.290 3.130 2.157 3.340 0.050 17 0 "[ . 1 . 2]" 1
33 1 10 ARG H 1 10 ARG QG . . 5.030 3.954 2.843 4.279 . 0 0 "[ . 1 . 2]" 1
34 1 10 ARG QB 1 11 GLU H . . 3.580 2.812 1.965 3.135 . 0 0 "[ . 1 . 2]" 1
35 1 10 ARG HB2 1 11 GLU H . . 4.090 3.828 2.760 4.078 . 0 0 "[ . 1 . 2]" 1
36 1 10 ARG HB3 1 11 GLU H . . 4.090 2.960 1.977 4.059 . 0 0 "[ . 1 . 2]" 1
37 1 10 ARG QG 1 11 GLU H . . 6.880 2.451 1.867 4.208 . 0 0 "[ . 1 . 2]" 1
38 1 11 GLU H 1 11 GLU HA . . 2.860 2.910 2.787 2.957 0.097 17 0 "[ . 1 . 2]" 1
39 1 11 GLU H 1 11 GLU HB2 . . 2.830 2.498 2.087 2.898 0.068 2 0 "[ . 1 . 2]" 1
40 1 11 GLU H 1 11 GLU HB3 . . 3.360 3.245 2.856 3.420 0.060 6 0 "[ . 1 . 2]" 1
41 1 11 GLU HA 1 12 GLY H . . 3.160 2.441 2.113 2.906 . 0 0 "[ . 1 . 2]" 1
42 1 11 GLU HB2 1 12 GLY H . . 4.680 4.098 3.475 4.619 . 0 0 "[ . 1 . 2]" 1
43 1 11 GLU HB3 1 12 GLY H . . 4.320 3.134 1.962 4.269 . 0 0 "[ . 1 . 2]" 1
44 1 11 GLU QG 1 12 GLY H . . 6.880 2.848 1.922 4.538 . 0 0 "[ . 1 . 2]" 1
45 1 12 GLY QA 1 13 SER H . . 3.140 2.308 2.115 2.726 . 0 0 "[ . 1 . 2]" 1
46 1 13 SER H 1 14 SER H . . 3.760 2.897 1.897 3.866 0.106 5 0 "[ . 1 . 2]" 1
47 1 14 SER H 1 14 SER HA . . 2.770 2.844 2.796 2.879 0.109 13 0 "[ . 1 . 2]" 1
48 1 14 SER H 1 14 SER HB2 . . 3.950 3.720 3.151 3.972 0.022 10 0 "[ . 1 . 2]" 1
49 1 14 SER H 1 14 SER QB . . 3.710 2.953 2.048 3.394 . 0 0 "[ . 1 . 2]" 1
50 1 14 SER H 1 14 SER HB3 . . 3.950 3.152 2.067 3.810 . 0 0 "[ . 1 . 2]" 1
51 1 14 SER HA 1 15 SER H . . 3.160 2.489 2.135 2.953 . 0 0 "[ . 1 . 2]" 1
52 1 14 SER HA 1 15 SER QB . . 6.480 4.360 4.068 5.209 . 0 0 "[ . 1 . 2]" 1
53 1 14 SER HA 1 19 ARG QD . . 5.560 4.603 4.173 4.968 . 0 0 "[ . 1 . 2]" 1
54 1 14 SER QB 1 15 SER H . . 4.210 2.414 1.817 3.419 . 0 0 "[ . 1 . 2]" 1
55 1 14 SER QB 1 19 ARG QB . . 7.750 2.916 1.882 4.674 . 0 0 "[ . 1 . 2]" 1
56 1 14 SER QB 1 22 VAL QG . . 7.120 4.469 3.320 4.702 . 0 0 "[ . 1 . 2]" 1
57 1 15 SER H 1 18 CYS QB . . 5.870 3.406 2.487 4.483 . 0 0 "[ . 1 . 2]" 1
58 1 15 SER HA 1 16 GLN H . . 3.400 2.770 2.283 3.550 0.150 20 0 "[ . 1 . 2]" 1
59 1 15 SER HA 1 18 CYS QB . . 6.090 4.747 4.233 5.545 . 0 0 "[ . 1 . 2]" 1
60 1 16 GLN H 1 16 GLN HB2 . . 2.700 2.367 2.163 2.645 . 0 0 "[ . 1 . 2]" 1
61 1 16 GLN H 1 16 GLN HB3 . . 3.110 2.724 2.377 2.963 . 0 0 "[ . 1 . 2]" 1
62 1 16 GLN HA 1 16 GLN HB2 . . 2.700 2.504 2.379 2.647 . 0 0 "[ . 1 . 2]" 1
63 1 17 GLN H 1 17 GLN QB . . 3.580 3.035 2.837 3.396 . 0 0 "[ . 1 . 2]" 1
64 1 17 GLN H 1 17 GLN QG . . 5.030 3.785 2.303 4.232 . 0 0 "[ . 1 . 2]" 1
65 1 17 GLN H 1 18 CYS H . . 3.100 2.162 1.804 3.102 0.002 5 0 "[ . 1 . 2]" 1
66 1 17 GLN HA 1 18 CYS H . . 3.360 2.766 2.311 3.037 . 0 0 "[ . 1 . 2]" 1
67 1 17 GLN HA 1 19 ARG H . . 4.280 3.707 3.205 4.233 . 0 0 "[ . 1 . 2]" 1
68 1 17 GLN HA 1 20 GLN H . . 4.150 3.885 3.481 4.242 0.092 16 0 "[ . 1 . 2]" 1
69 1 17 GLN QB 1 18 CYS H . . 4.470 3.931 3.722 4.042 . 0 0 "[ . 1 . 2]" 1
70 1 17 GLN QB 1 18 CYS HA . . 5.290 4.441 4.288 4.672 . 0 0 "[ . 1 . 2]" 1
71 1 17 GLN QG 1 18 CYS H . . 6.880 4.317 3.756 4.557 . 0 0 "[ . 1 . 2]" 1
72 1 18 CYS CB 1 77 CYS SG . . 3.100 2.998 2.923 3.132 0.032 12 0 "[ . 1 . 2]" 1
73 1 18 CYS H 1 18 CYS QB . . 3.330 2.177 2.047 2.792 . 0 0 "[ . 1 . 2]" 1
74 1 18 CYS H 1 19 ARG H . . 3.360 2.541 2.013 2.875 . 0 0 "[ . 1 . 2]" 1
75 1 18 CYS H 1 20 GLN H . . 5.310 4.290 2.984 4.761 . 0 0 "[ . 1 . 2]" 1
76 1 18 CYS HA 1 21 GLU H . . 4.420 3.486 3.216 3.767 . 0 0 "[ . 1 . 2]" 1
77 1 18 CYS HA 1 21 GLU QB . . 5.060 3.564 2.401 4.554 . 0 0 "[ . 1 . 2]" 1
78 1 18 CYS HA 1 21 GLU QG . . 6.280 3.413 2.135 4.645 . 0 0 "[ . 1 . 2]" 1
79 1 18 CYS HA 1 22 VAL H . . 3.920 3.734 3.513 4.081 0.161 2 0 "[ . 1 . 2]" 1
80 1 18 CYS QB 1 19 ARG H . . 4.100 2.648 2.245 3.058 . 0 0 "[ . 1 . 2]" 1
81 1 18 CYS QB 1 19 ARG QH2 . . 6.870 6.866 4.735 7.607 0.737 9 4 "[ *-. +1 * . 2]" 1
82 1 18 CYS QB 1 22 VAL QG . . 8.120 2.217 1.732 3.447 . 0 0 "[ . 1 . 2]" 1
83 1 18 CYS QB 1 73 VAL QG . . 8.940 5.647 5.389 5.838 . 0 0 "[ . 1 . 2]" 1
84 1 18 CYS QB 1 74 ARG QB . . 7.760 4.815 4.300 5.703 . 0 0 "[ . 1 . 2]" 1
85 1 18 CYS QB 1 77 CYS HA . . 6.000 4.135 3.084 4.980 . 0 0 "[ . 1 . 2]" 1
86 1 18 CYS QB 1 77 CYS QB . . 7.750 2.779 2.154 4.070 . 0 0 "[ . 1 . 2]" 1
87 1 18 CYS QB 1 80 GLU HB3 . . 6.680 4.464 3.185 5.692 . 0 0 "[ . 1 . 2]" 1
88 1 18 CYS QB 1 80 GLU QG . . 6.880 4.244 3.203 5.101 . 0 0 "[ . 1 . 2]" 1
89 1 18 CYS SG 1 77 CYS CB . . 3.100 3.062 2.924 3.163 0.063 12 0 "[ . 1 . 2]" 1
90 1 18 CYS SG 1 77 CYS SG . . 2.100 2.025 1.985 2.087 . 0 0 "[ . 1 . 2]" 1
91 1 19 ARG H 1 19 ARG HB2 . . 3.590 2.412 2.051 3.721 0.131 16 0 "[ . 1 . 2]" 1
92 1 19 ARG H 1 19 ARG QB . . 3.240 2.184 2.027 2.849 . 0 0 "[ . 1 . 2]" 1
93 1 19 ARG H 1 19 ARG HB3 . . 3.590 3.064 2.407 3.278 . 0 0 "[ . 1 . 2]" 1
94 1 19 ARG H 1 19 ARG HG2 . . 4.940 4.179 2.176 4.625 . 0 0 "[ . 1 . 2]" 1
95 1 19 ARG H 1 19 ARG QG . . 4.080 3.451 2.157 3.827 . 0 0 "[ . 1 . 2]" 1
96 1 19 ARG H 1 19 ARG HG3 . . 4.940 3.848 3.537 4.193 . 0 0 "[ . 1 . 2]" 1
97 1 19 ARG H 1 19 ARG QH2 . . 6.870 6.345 4.666 7.110 0.240 9 0 "[ . 1 . 2]" 1
98 1 19 ARG H 1 20 GLN H . . 3.390 3.074 2.831 3.640 0.250 16 0 "[ . 1 . 2]" 1
99 1 19 ARG H 1 21 GLU H . . 5.970 5.061 4.141 5.328 . 0 0 "[ . 1 . 2]" 1
100 1 19 ARG H 1 22 VAL QG . . 8.120 3.509 2.997 4.311 . 0 0 "[ . 1 . 2]" 1
101 1 19 ARG H 1 80 GLU QG . . 6.880 4.741 3.651 5.949 . 0 0 "[ . 1 . 2]" 1
102 1 19 ARG HA 1 19 ARG QH2 . . 6.270 5.801 4.988 7.203 0.933 17 2 "[ . 1 . + -2]" 1
103 1 19 ARG HA 1 22 VAL H . . 4.610 3.680 3.249 3.922 . 0 0 "[ . 1 . 2]" 1
104 1 19 ARG HA 1 22 VAL HB . . 3.530 2.180 2.014 2.424 . 0 0 "[ . 1 . 2]" 1
105 1 19 ARG HA 1 22 VAL QG . . 6.270 2.599 2.016 3.177 . 0 0 "[ . 1 . 2]" 1
106 1 19 ARG HA 1 84 TYR QD . . 8.140 4.474 3.038 5.461 . 0 0 "[ . 1 . 2]" 1
107 1 19 ARG QB 1 20 GLN H . . 3.630 2.681 2.062 3.423 . 0 0 "[ . 1 . 2]" 1
108 1 19 ARG HB2 1 19 ARG QH2 . . 6.870 5.395 3.972 6.155 . 0 0 "[ . 1 . 2]" 1
109 1 19 ARG HB2 1 20 GLN H . . 3.820 3.374 2.511 3.772 . 0 0 "[ . 1 . 2]" 1
110 1 19 ARG HB3 1 19 ARG QH2 . . 6.870 5.814 3.820 6.214 . 0 0 "[ . 1 . 2]" 1
111 1 19 ARG HB3 1 20 GLN H . . 3.820 2.938 2.090 3.923 0.103 17 0 "[ . 1 . 2]" 1
112 1 19 ARG QD 1 20 GLN H . . 6.880 4.631 1.956 5.168 . 0 0 "[ . 1 . 2]" 1
113 1 19 ARG QD 1 20 GLN HA . . 6.880 5.907 4.411 6.322 . 0 0 "[ . 1 . 2]" 1
114 1 19 ARG QD 1 84 TYR QD . . 9.020 4.112 2.498 7.226 . 0 0 "[ . 1 . 2]" 1
115 1 19 ARG QG 1 20 GLN HA . . 5.330 4.561 3.122 4.904 . 0 0 "[ . 1 . 2]" 1
116 1 19 ARG QG 1 22 VAL HB . . 6.350 3.961 3.256 4.931 . 0 0 "[ . 1 . 2]" 1
117 1 19 ARG QG 1 23 GLN H . . 6.880 4.787 3.956 5.679 . 0 0 "[ . 1 . 2]" 1
118 1 19 ARG QG 1 84 TYR QD . . 9.020 3.442 2.072 6.317 . 0 0 "[ . 1 . 2]" 1
119 1 19 ARG HG2 1 20 GLN H . . 6.000 4.095 1.904 4.837 . 0 0 "[ . 1 . 2]" 1
120 1 19 ARG HG3 1 20 GLN H . . 6.000 4.474 1.844 5.054 . 0 0 "[ . 1 . 2]" 1
121 1 19 ARG QH2 1 22 VAL HB . . 6.870 7.141 5.979 8.392 1.522 17 6 "[ . 1**- .*+ *2]" 1
122 1 20 GLN H 1 20 GLN HG2 . . 4.850 3.737 2.205 4.407 . 0 0 "[ . 1 . 2]" 1
123 1 20 GLN H 1 20 GLN QG . . 4.540 3.280 1.878 3.937 . 0 0 "[ . 1 . 2]" 1
124 1 20 GLN H 1 20 GLN HG3 . . 4.850 3.667 2.034 4.508 . 0 0 "[ . 1 . 2]" 1
125 1 20 GLN H 1 21 GLU H . . 3.390 3.132 2.865 3.498 0.108 16 0 "[ . 1 . 2]" 1
126 1 20 GLN H 1 21 GLU QG . . 6.020 4.793 3.990 5.636 . 0 0 "[ . 1 . 2]" 1
127 1 20 GLN H 1 22 VAL QG . . 8.120 4.394 3.959 5.202 . 0 0 "[ . 1 . 2]" 1
128 1 20 GLN H 1 23 GLN H . . 4.570 4.684 4.575 4.788 0.218 3 0 "[ . 1 . 2]" 1
129 1 20 GLN HA 1 23 GLN QB . . 5.130 4.010 2.705 4.598 . 0 0 "[ . 1 . 2]" 1
130 1 20 GLN HA 1 23 GLN QE . . 6.870 3.553 1.946 5.530 . 0 0 "[ . 1 . 2]" 1
131 1 20 GLN HA 1 24 ARG QD . . 6.880 5.383 4.483 6.056 . 0 0 "[ . 1 . 2]" 1
132 1 20 GLN HA 1 24 ARG HE . . 6.000 5.273 3.378 5.991 . 0 0 "[ . 1 . 2]" 1
133 1 20 GLN QE 1 21 GLU H . . 3.570 2.425 1.679 3.043 . 0 0 "[ . 1 . 2]" 1
134 1 20 GLN QE 1 21 GLU HA . . 3.900 2.817 2.427 3.207 . 0 0 "[ . 1 . 2]" 1
135 1 20 GLN QE 1 24 ARG QG . . 7.750 4.409 3.146 6.013 . 0 0 "[ . 1 . 2]" 1
136 1 20 GLN QG 1 21 GLU H . . 5.460 3.074 1.818 4.034 . 0 0 "[ . 1 . 2]" 1
137 1 21 GLU H 1 21 GLU HA . . 2.870 2.822 2.764 2.893 0.023 9 0 "[ . 1 . 2]" 1
138 1 21 GLU H 1 21 GLU QG . . 4.340 2.409 1.920 3.123 . 0 0 "[ . 1 . 2]" 1
139 1 21 GLU H 1 22 VAL H . . 4.020 2.690 2.370 2.869 . 0 0 "[ . 1 . 2]" 1
140 1 21 GLU H 1 22 VAL QG . . 8.120 4.194 3.667 4.684 . 0 0 "[ . 1 . 2]" 1
141 1 21 GLU H 1 23 GLN H . . 4.480 4.379 3.799 4.765 0.285 16 0 "[ . 1 . 2]" 1
142 1 21 GLU H 1 74 ARG QG . . 6.880 6.108 5.095 6.350 . 0 0 "[ . 1 . 2]" 1
143 1 21 GLU HA 1 22 VAL HA . . 5.080 4.829 4.674 4.898 . 0 0 "[ . 1 . 2]" 1
144 1 21 GLU QG 1 22 VAL H . . 5.890 3.442 2.149 4.556 . 0 0 "[ . 1 . 2]" 1
145 1 21 GLU QG 1 25 LYS QG . . 7.760 4.625 3.274 6.016 . 0 0 "[ . 1 . 2]" 1
146 1 21 GLU QG 1 74 ARG HE . . 4.470 3.586 2.000 4.051 . 0 0 "[ . 1 . 2]" 1
147 1 21 GLU QG 1 74 ARG QG . . 7.750 4.337 2.580 5.607 . 0 0 "[ . 1 . 2]" 1
148 1 22 VAL H 1 22 VAL HB . . 2.960 2.238 2.075 2.489 . 0 0 "[ . 1 . 2]" 1
149 1 22 VAL H 1 23 GLN H . . 3.030 2.650 2.232 3.025 . 0 0 "[ . 1 . 2]" 1
150 1 22 VAL HA 1 24 ARG H . . 4.780 3.513 3.202 3.902 . 0 0 "[ . 1 . 2]" 1
151 1 22 VAL HA 1 25 LYS H . . 3.760 3.437 2.853 3.830 0.070 19 0 "[ . 1 . 2]" 1
152 1 22 VAL HA 1 25 LYS QD . . 5.420 4.615 2.751 5.048 . 0 0 "[ . 1 . 2]" 1
153 1 22 VAL HA 1 25 LYS HG2 . . 4.980 3.919 3.250 5.125 0.145 15 0 "[ . 1 . 2]" 1
154 1 22 VAL HA 1 25 LYS QG . . 4.580 3.485 3.107 4.109 . 0 0 "[ . 1 . 2]" 1
155 1 22 VAL HA 1 25 LYS HG3 . . 4.980 4.372 3.366 5.106 0.126 2 0 "[ . 1 . 2]" 1
156 1 22 VAL HA 1 81 ALA MB . . 5.180 4.039 3.601 4.239 . 0 0 "[ . 1 . 2]" 1
157 1 22 VAL HB 1 84 TYR QD . . 8.140 4.734 3.227 6.269 . 0 0 "[ . 1 . 2]" 1
158 1 22 VAL HB 1 84 TYR QE . . 7.570 5.055 2.592 6.908 . 0 0 "[ . 1 . 2]" 1
159 1 22 VAL QG 1 23 GLN H . . 6.470 2.958 2.011 3.381 . 0 0 "[ . 1 . 2]" 1
160 1 22 VAL QG 1 23 GLN QG . . 8.840 4.183 3.224 4.968 . 0 0 "[ . 1 . 2]" 1
161 1 22 VAL QG 1 24 ARG H . . 8.120 3.991 3.845 4.129 . 0 0 "[ . 1 . 2]" 1
162 1 22 VAL QG 1 25 LYS H . . 8.120 4.358 3.875 4.622 . 0 0 "[ . 1 . 2]" 1
163 1 22 VAL QG 1 25 LYS QG . . 8.380 4.111 3.886 4.457 . 0 0 "[ . 1 . 2]" 1
164 1 22 VAL QG 1 74 ARG H . . 7.790 4.159 3.481 4.905 . 0 0 "[ . 1 . 2]" 1
165 1 22 VAL QG 1 74 ARG QB . . 8.640 4.117 2.824 5.117 . 0 0 "[ . 1 . 2]" 1
166 1 22 VAL QG 1 77 CYS HB2 . . 7.830 2.823 2.051 3.399 . 0 0 "[ . 1 . 2]" 1
167 1 22 VAL QG 1 77 CYS QB . . 6.950 1.945 1.611 2.296 . 0 0 "[ . 1 . 2]" 1
168 1 22 VAL QG 1 77 CYS HB3 . . 7.830 1.987 1.640 2.340 . 0 0 "[ . 1 . 2]" 1
169 1 22 VAL QG 1 80 GLU QG . . 8.440 3.595 2.894 4.643 . 0 0 "[ . 1 . 2]" 1
170 1 22 VAL QG 1 81 ALA H . . 7.200 3.363 2.908 3.760 . 0 0 "[ . 1 . 2]" 1
171 1 22 VAL QG 1 81 ALA HA . . 5.520 1.987 1.587 2.483 . 0 0 "[ . 1 . 2]" 1
172 1 23 GLN H 1 23 GLN HG2 . . 4.220 2.819 1.977 3.609 . 0 0 "[ . 1 . 2]" 1
173 1 23 GLN H 1 23 GLN QG . . 3.700 2.453 1.931 2.843 . 0 0 "[ . 1 . 2]" 1
174 1 23 GLN H 1 23 GLN HG3 . . 4.220 2.909 2.346 4.050 . 0 0 "[ . 1 . 2]" 1
175 1 23 GLN H 1 24 ARG H . . 3.960 3.107 2.608 3.576 . 0 0 "[ . 1 . 2]" 1
176 1 23 GLN HA 1 25 LYS H . . 4.710 4.503 4.091 4.803 0.093 15 0 "[ . 1 . 2]" 1
177 1 23 GLN HA 1 84 TYR QE . . 8.130 2.670 2.098 3.853 . 0 0 "[ . 1 . 2]" 1
178 1 23 GLN QG 1 24 ARG H . . 6.880 3.731 2.856 4.505 . 0 0 "[ . 1 . 2]" 1
179 1 23 GLN QG 1 24 ARG HE . . 6.290 4.472 2.575 5.627 . 0 0 "[ . 1 . 2]" 1
180 1 23 GLN HG2 1 84 TYR QE . . 8.130 4.054 2.747 5.116 . 0 0 "[ . 1 . 2]" 1
181 1 23 GLN HG3 1 84 TYR QE . . 8.130 4.577 3.861 5.424 . 0 0 "[ . 1 . 2]" 1
182 1 24 ARG H 1 24 ARG HB2 . . 3.960 3.217 2.771 3.891 . 0 0 "[ . 1 . 2]" 1
183 1 24 ARG H 1 24 ARG QB . . 3.710 2.985 2.712 3.364 . 0 0 "[ . 1 . 2]" 1
184 1 24 ARG H 1 24 ARG HB3 . . 3.960 3.802 3.429 3.941 . 0 0 "[ . 1 . 2]" 1
185 1 24 ARG H 1 24 ARG HE . . 5.900 4.821 3.533 5.811 . 0 0 "[ . 1 . 2]" 1
186 1 24 ARG H 1 24 ARG QG . . 4.830 2.868 2.252 3.377 . 0 0 "[ . 1 . 2]" 1
187 1 24 ARG H 1 25 LYS QG . . 6.650 4.100 3.449 5.327 . 0 0 "[ . 1 . 2]" 1
188 1 24 ARG H 1 28 SER QB . . 4.540 3.362 2.638 4.114 . 0 0 "[ . 1 . 2]" 1
189 1 24 ARG HA 1 25 LYS H . . 3.620 3.360 2.700 3.547 . 0 0 "[ . 1 . 2]" 1
190 1 24 ARG QB 1 25 LYS H . . 4.450 2.974 2.249 4.056 . 0 0 "[ . 1 . 2]" 1
191 1 24 ARG HB2 1 25 LYS H . . 4.650 3.125 2.273 4.467 . 0 0 "[ . 1 . 2]" 1
192 1 24 ARG HB3 1 25 LYS H . . 4.650 3.947 3.295 4.698 0.048 17 0 "[ . 1 . 2]" 1
193 1 24 ARG HE 1 25 LYS QE . . 6.880 4.964 3.419 6.255 . 0 0 "[ . 1 . 2]" 1
194 1 24 ARG QG 1 25 LYS H . . 5.790 3.677 1.928 4.410 . 0 0 "[ . 1 . 2]" 1
195 1 24 ARG QG 1 84 TYR QD . . 9.020 7.159 6.941 7.365 . 0 0 "[ . 1 . 2]" 1
196 1 25 LYS H 1 25 LYS HB2 . . 3.770 3.541 2.421 3.777 0.007 12 0 "[ . 1 . 2]" 1
197 1 25 LYS H 1 25 LYS QB . . 3.290 2.904 2.387 3.205 . 0 0 "[ . 1 . 2]" 1
198 1 25 LYS H 1 25 LYS HB3 . . 3.590 3.159 2.752 3.626 0.036 15 0 "[ . 1 . 2]" 1
199 1 25 LYS H 1 25 LYS QD . . 6.020 4.048 2.308 5.417 . 0 0 "[ . 1 . 2]" 1
200 1 25 LYS H 1 25 LYS QG . . 4.830 2.680 1.915 4.090 . 0 0 "[ . 1 . 2]" 1
201 1 25 LYS H 1 26 ASP H . . 4.680 2.432 1.948 3.068 . 0 0 "[ . 1 . 2]" 1
202 1 25 LYS HA 1 25 LYS QD . . 4.860 4.011 3.209 4.335 . 0 0 "[ . 1 . 2]" 1
203 1 25 LYS HA 1 25 LYS QG . . 3.770 2.990 2.138 3.444 . 0 0 "[ . 1 . 2]" 1
204 1 25 LYS HA 1 26 ASP H . . 3.620 3.527 3.484 3.567 . 0 0 "[ . 1 . 2]" 1
205 1 25 LYS QB 1 26 ASP H . . 4.110 2.677 1.932 3.535 . 0 0 "[ . 1 . 2]" 1
206 1 25 LYS QB 1 73 VAL HA . . 6.880 3.771 2.530 4.875 . 0 0 "[ . 1 . 2]" 1
207 1 25 LYS QD 1 26 ASP H . . 5.190 3.789 2.003 4.479 . 0 0 "[ . 1 . 2]" 1
208 1 25 LYS QD 1 73 VAL HA . . 6.880 3.724 2.115 5.743 . 0 0 "[ . 1 . 2]" 1
209 1 25 LYS QE 1 74 ARG QD . . 7.750 4.732 2.509 6.076 . 0 0 "[ . 1 . 2]" 1
210 1 25 LYS QG 1 26 ASP H . . 4.650 2.223 1.778 3.850 . 0 0 "[ . 1 . 2]" 1
211 1 25 LYS QG 1 73 VAL HA . . 6.680 2.967 2.010 5.105 . 0 0 "[ . 1 . 2]" 1
212 1 25 LYS QG 1 73 VAL QG . . 8.540 3.705 2.781 5.567 . 0 0 "[ . 1 . 2]" 1
213 1 25 LYS HG2 1 26 ASP H . . 5.410 2.600 1.820 4.466 . 0 0 "[ . 1 . 2]" 1
214 1 25 LYS HG3 1 26 ASP H . . 5.410 2.905 1.912 4.204 . 0 0 "[ . 1 . 2]" 1
215 1 26 ASP H 1 26 ASP HB2 . . 3.460 2.808 2.165 3.507 0.047 8 0 "[ . 1 . 2]" 1
216 1 26 ASP H 1 26 ASP QB . . 3.120 2.482 2.083 2.840 . 0 0 "[ . 1 . 2]" 1
217 1 26 ASP H 1 26 ASP HB3 . . 3.460 3.258 2.101 3.617 0.157 20 0 "[ . 1 . 2]" 1
218 1 26 ASP H 1 27 LEU QD . . 8.600 5.028 4.655 5.312 . 0 0 "[ . 1 . 2]" 1
219 1 26 ASP H 1 70 VAL QG . . 8.590 5.783 5.287 6.231 . 0 0 "[ . 1 . 2]" 1
220 1 26 ASP H 1 73 VAL QG . . 8.190 3.441 2.664 3.753 . 0 0 "[ . 1 . 2]" 1
221 1 26 ASP HA 1 27 LEU H . . 2.980 2.567 2.279 2.979 . 0 0 "[ . 1 . 2]" 1
222 1 26 ASP HA 1 28 SER H . . 4.660 4.915 4.325 5.204 0.544 4 2 "[ +. 1 - . 2]" 1
223 1 26 ASP QB 1 27 LEU QD . . 7.230 2.634 1.916 3.089 . 0 0 "[ . 1 . 2]" 1
224 1 26 ASP QB 1 73 VAL QG . . 8.280 2.071 1.637 2.569 . 0 0 "[ . 1 . 2]" 1
225 1 26 ASP QB 1 77 CYS H . . 6.520 5.833 5.457 6.221 . 0 0 "[ . 1 . 2]" 1
226 1 26 ASP QB 1 77 CYS QB . . 5.310 3.772 3.487 4.461 . 0 0 "[ . 1 . 2]" 1
227 1 26 ASP QB 1 78 GLN HA . . 5.530 3.359 2.587 4.309 . 0 0 "[ . 1 . 2]" 1
228 1 26 ASP QB 1 78 GLN QG . . 7.760 5.278 4.237 6.019 . 0 0 "[ . 1 . 2]" 1
229 1 26 ASP HB2 1 27 LEU H . . 5.140 3.115 1.958 3.848 . 0 0 "[ . 1 . 2]" 1
230 1 26 ASP HB2 1 27 LEU MD1 . . 8.780 5.198 3.810 5.877 . 0 0 "[ . 1 . 2]" 1
231 1 26 ASP HB2 1 27 LEU MD2 . . 8.780 3.650 2.580 4.445 . 0 0 "[ . 1 . 2]" 1
232 1 26 ASP HB3 1 27 LEU H . . 5.140 2.634 1.910 3.589 . 0 0 "[ . 1 . 2]" 1
233 1 26 ASP HB3 1 27 LEU MD1 . . 8.780 4.732 3.790 6.094 . 0 0 "[ . 1 . 2]" 1
234 1 26 ASP HB3 1 27 LEU MD2 . . 8.780 3.018 1.955 4.571 . 0 0 "[ . 1 . 2]" 1
235 1 27 LEU H 1 27 LEU HG . . 4.780 3.759 3.493 3.920 . 0 0 "[ . 1 . 2]" 1
236 1 27 LEU HA 1 27 LEU HG . . 3.720 3.561 3.327 3.719 . 0 0 "[ . 1 . 2]" 1
237 1 27 LEU HA 1 28 SER H . . 3.460 2.254 2.143 2.571 . 0 0 "[ . 1 . 2]" 1
238 1 27 LEU HA 1 69 GLN HB2 . . 5.340 4.831 4.340 5.130 . 0 0 "[ . 1 . 2]" 1
239 1 27 LEU HA 1 69 GLN QB . . 4.630 3.809 3.383 4.076 . 0 0 "[ . 1 . 2]" 1
240 1 27 LEU HA 1 69 GLN HB3 . . 5.340 3.990 3.496 4.295 . 0 0 "[ . 1 . 2]" 1
241 1 27 LEU QB 1 28 SER H . . 6.880 3.765 3.626 3.902 . 0 0 "[ . 1 . 2]" 1
242 1 27 LEU QB 1 30 CYS H . . 5.590 4.201 3.828 4.404 . 0 0 "[ . 1 . 2]" 1
243 1 27 LEU QB 1 30 CYS QB . . 5.150 3.326 2.784 3.558 . 0 0 "[ . 1 . 2]" 1
244 1 27 LEU QB 1 31 GLU H . . 6.880 3.766 3.014 4.180 . 0 0 "[ . 1 . 2]" 1
245 1 27 LEU QB 1 69 GLN QB . . 7.760 5.473 5.135 5.698 . 0 0 "[ . 1 . 2]" 1
246 1 27 LEU QB 1 70 VAL QG . . 7.320 3.891 3.738 4.302 . 0 0 "[ . 1 . 2]" 1
247 1 27 LEU QB 1 84 TYR QE . . 9.010 5.958 4.234 6.798 . 0 0 "[ . 1 . 2]" 1
248 1 27 LEU QB 1 85 ILE QG . . 6.630 3.783 2.844 5.024 . 0 0 "[ . 1 . 2]" 1
249 1 27 LEU QD 1 30 CYS QB . . 7.140 2.667 1.928 3.517 . 0 0 "[ . 1 . 2]" 1
250 1 27 LEU QD 1 66 CYS HA . . 8.600 4.594 4.338 4.771 . 0 0 "[ . 1 . 2]" 1
251 1 27 LEU QD 1 69 GLN H . . 8.600 5.720 5.335 5.912 . 0 0 "[ . 1 . 2]" 1
252 1 27 LEU QD 1 69 GLN HA . . 8.330 5.858 5.480 6.033 . 0 0 "[ . 1 . 2]" 1
253 1 27 LEU QD 1 69 GLN QB . . 6.530 3.921 3.569 4.064 . 0 0 "[ . 1 . 2]" 1
254 1 27 LEU QD 1 70 VAL H . . 7.340 4.033 3.763 4.339 . 0 0 "[ . 1 . 2]" 1
255 1 27 LEU QD 1 70 VAL HA . . 5.760 3.148 2.814 3.577 . 0 0 "[ . 1 . 2]" 1
256 1 27 LEU QD 1 78 GLN H . . 8.040 4.774 4.399 5.293 . 0 0 "[ . 1 . 2]" 1
257 1 27 LEU QD 1 78 GLN HA . . 6.680 2.616 2.182 3.191 . 0 0 "[ . 1 . 2]" 1
258 1 27 LEU QD 1 78 GLN QG . . 7.630 3.706 2.843 4.361 . 0 0 "[ . 1 . 2]" 1
259 1 27 LEU QD 1 79 CYS H . . 6.820 4.582 4.300 4.910 . 0 0 "[ . 1 . 2]" 1
260 1 27 LEU QD 1 79 CYS HA . . 6.580 4.070 3.701 4.565 . 0 0 "[ . 1 . 2]" 1
261 1 27 LEU QD 1 81 ALA MB . . 6.210 1.691 1.378 2.011 . 0 0 "[ . 1 . 2]" 1
262 1 27 LEU QD 1 82 ILE H . . 8.600 2.708 1.962 3.587 . 0 0 "[ . 1 . 2]" 1
263 1 27 LEU QD 1 82 ILE HA . . 6.290 3.665 2.601 4.319 . 0 0 "[ . 1 . 2]" 1
264 1 27 LEU QD 1 82 ILE QG . . 6.930 2.446 1.868 3.746 . 0 0 "[ . 1 . 2]" 1
265 1 27 LEU QD 1 111 VAL HA . . 6.520 4.534 3.960 4.938 . 0 0 "[ . 1 . 2]" 1
266 1 27 LEU QD 1 115 GLY HA3 . . 5.590 3.133 2.753 3.519 . 0 0 "[ . 1 . 2]" 1
267 1 27 LEU QD 1 117 ARG H . . 5.990 4.326 4.013 4.679 . 0 0 "[ . 1 . 2]" 1
268 1 27 LEU QD 1 117 ARG HA . . 8.600 4.411 4.020 4.601 . 0 0 "[ . 1 . 2]" 1
269 1 27 LEU QD 1 117 ARG QB . . 6.700 2.643 2.377 3.045 . 0 0 "[ . 1 . 2]" 1
270 1 27 LEU QD 1 117 ARG QD . . 8.120 1.812 1.303 2.999 . 0 0 "[ . 1 . 2]" 1
271 1 27 LEU QD 1 118 CYS HA . . 8.600 6.297 5.886 6.541 . 0 0 "[ . 1 . 2]" 1
272 1 27 LEU MD1 1 28 SER H . . 7.030 3.783 3.516 4.291 . 0 0 "[ . 1 . 2]" 1
273 1 27 LEU MD1 1 30 CYS HB2 . . 8.880 2.793 1.953 3.912 . 0 0 "[ . 1 . 2]" 1
274 1 27 LEU MD1 1 30 CYS HB3 . . 8.880 3.518 3.013 4.230 . 0 0 "[ . 1 . 2]" 1
275 1 27 LEU MD1 1 69 GLN HB2 . . 8.780 4.733 4.350 5.166 . 0 0 "[ . 1 . 2]" 1
276 1 27 LEU MD1 1 69 GLN HB3 . . 8.780 4.408 3.907 5.189 . 0 0 "[ . 1 . 2]" 1
277 1 27 LEU MD1 1 81 ALA MB . . 7.430 3.808 3.210 4.218 . 0 0 "[ . 1 . 2]" 1
278 1 27 LEU MD2 1 28 SER H . . 7.030 4.823 4.143 5.290 . 0 0 "[ . 1 . 2]" 1
279 1 27 LEU MD2 1 30 CYS HB2 . . 8.880 5.195 4.760 5.519 . 0 0 "[ . 1 . 2]" 1
280 1 27 LEU MD2 1 30 CYS HB3 . . 8.880 6.039 5.635 6.323 . 0 0 "[ . 1 . 2]" 1
281 1 27 LEU MD2 1 69 GLN HB2 . . 8.780 6.482 5.377 6.932 . 0 0 "[ . 1 . 2]" 1
282 1 27 LEU MD2 1 69 GLN HB3 . . 8.780 5.737 4.828 6.251 . 0 0 "[ . 1 . 2]" 1
283 1 27 LEU MD2 1 81 ALA MB . . 7.430 1.694 1.378 2.019 . 0 0 "[ . 1 . 2]" 1
284 1 27 LEU HG 1 82 ILE H . . 4.280 3.875 3.092 4.347 0.067 19 0 "[ . 1 . 2]" 1
285 1 27 LEU HG 1 82 ILE HA . . 4.320 3.690 3.167 4.449 0.129 13 0 "[ . 1 . 2]" 1
286 1 27 LEU HG 1 111 VAL QG . . 6.340 4.442 4.124 4.692 . 0 0 "[ . 1 . 2]" 1
287 1 28 SER H 1 28 SER HB2 . . 3.760 3.404 2.579 3.930 0.170 13 0 "[ . 1 . 2]" 1
288 1 28 SER H 1 28 SER HB3 . . 3.760 3.093 2.674 3.657 . 0 0 "[ . 1 . 2]" 1
289 1 28 SER H 1 29 SER H . . 4.020 2.317 1.908 2.699 . 0 0 "[ . 1 . 2]" 1
290 1 29 SER H 1 29 SER HB2 . . 3.560 3.310 2.973 3.547 . 0 0 "[ . 1 . 2]" 1
291 1 29 SER H 1 29 SER QB . . 3.310 2.956 2.762 2.989 . 0 0 "[ . 1 . 2]" 1
292 1 29 SER H 1 29 SER HB3 . . 3.560 3.368 3.142 3.568 0.008 3 0 "[ . 1 . 2]" 1
293 1 29 SER H 1 30 CYS H . . 3.130 1.843 1.757 1.990 . 0 0 "[ . 1 . 2]" 1
294 1 29 SER H 1 31 GLU H . . 4.550 3.167 2.853 3.608 . 0 0 "[ . 1 . 2]" 1
295 1 29 SER H 1 32 ARG HE . . 6.000 5.400 4.715 6.158 0.158 14 0 "[ . 1 . 2]" 1
296 1 29 SER HA 1 32 ARG H . . 3.760 3.163 2.912 3.553 . 0 0 "[ . 1 . 2]" 1
297 1 29 SER HA 1 32 ARG HB2 . . 3.460 2.522 2.125 3.087 . 0 0 "[ . 1 . 2]" 1
298 1 29 SER HA 1 32 ARG QB . . 3.080 1.946 1.844 2.097 . 0 0 "[ . 1 . 2]" 1
299 1 29 SER HA 1 32 ARG HB3 . . 3.460 2.039 1.977 2.231 . 0 0 "[ . 1 . 2]" 1
300 1 29 SER HA 1 32 ARG QD . . 6.880 4.114 2.946 5.050 . 0 0 "[ . 1 . 2]" 1
301 1 29 SER HA 1 32 ARG HE . . 6.000 4.050 3.063 4.998 . 0 0 "[ . 1 . 2]" 1
302 1 29 SER QB 1 30 CYS H . . 4.160 2.757 2.644 2.835 . 0 0 "[ . 1 . 2]" 1
303 1 29 SER QB 1 66 CYS HA . . 5.130 2.812 2.102 3.330 . 0 0 "[ . 1 . 2]" 1
304 1 29 SER HB2 1 30 CYS H . . 4.320 3.681 3.373 4.055 . 0 0 "[ . 1 . 2]" 1
305 1 29 SER HB3 1 30 CYS H . . 4.320 2.858 2.688 3.008 . 0 0 "[ . 1 . 2]" 1
306 1 30 CYS CB 1 66 CYS SG . . 3.100 3.084 2.948 3.219 0.119 12 0 "[ . 1 . 2]" 1
307 1 30 CYS H 1 30 CYS HB2 . . 3.460 2.692 2.571 2.800 . 0 0 "[ . 1 . 2]" 1
308 1 30 CYS H 1 30 CYS HB3 . . 3.460 3.540 3.503 3.573 0.113 14 0 "[ . 1 . 2]" 1
309 1 30 CYS H 1 31 GLU H . . 3.130 2.900 2.737 3.117 . 0 0 "[ . 1 . 2]" 1
310 1 30 CYS H 1 32 ARG H . . 3.820 3.827 3.661 3.951 0.131 13 0 "[ . 1 . 2]" 1
311 1 30 CYS H 1 66 CYS QB . . 6.060 3.441 2.917 3.772 . 0 0 "[ . 1 . 2]" 1
312 1 30 CYS H 1 85 ILE MD . . 7.030 4.923 3.148 5.762 . 0 0 "[ . 1 . 2]" 1
313 1 30 CYS H 1 110 ILE QG . . 6.880 5.466 5.060 5.659 . 0 0 "[ . 1 . 2]" 1
314 1 30 CYS HA 1 33 TYR H . . 3.860 3.725 3.538 3.940 0.080 6 0 "[ . 1 . 2]" 1
315 1 30 CYS HA 1 33 TYR HB2 . . 3.890 3.471 2.830 4.007 0.117 6 0 "[ . 1 . 2]" 1
316 1 30 CYS HA 1 33 TYR QB . . 3.640 3.036 2.738 3.153 . 0 0 "[ . 1 . 2]" 1
317 1 30 CYS HA 1 33 TYR HB3 . . 3.890 3.407 3.083 3.646 . 0 0 "[ . 1 . 2]" 1
318 1 30 CYS HA 1 33 TYR QD . . 8.140 4.629 4.124 4.856 . 0 0 "[ . 1 . 2]" 1
319 1 30 CYS HA 1 33 TYR QE . . 8.130 6.426 6.150 6.581 . 0 0 "[ . 1 . 2]" 1
320 1 30 CYS HA 1 34 LEU H . . 5.110 5.053 4.942 5.096 . 0 0 "[ . 1 . 2]" 1
321 1 30 CYS HA 1 66 CYS QB . . 4.670 2.235 2.037 2.556 . 0 0 "[ . 1 . 2]" 1
322 1 30 CYS HA 1 110 ILE QG . . 5.490 2.961 2.489 3.142 . 0 0 "[ . 1 . 2]" 1
323 1 30 CYS QB 1 31 GLU H . . 3.820 2.184 1.857 2.390 . 0 0 "[ . 1 . 2]" 1
324 1 30 CYS QB 1 70 VAL QG . . 6.720 3.835 3.595 4.169 . 0 0 "[ . 1 . 2]" 1
325 1 30 CYS QB 1 82 ILE MD . . 5.300 3.493 2.987 4.010 . 0 0 "[ . 1 . 2]" 1
326 1 30 CYS QB 1 110 ILE QG . . 4.500 3.377 2.969 3.588 . 0 0 "[ . 1 . 2]" 1
327 1 30 CYS QB 1 111 VAL H . . 5.430 4.488 4.146 4.899 . 0 0 "[ . 1 . 2]" 1
328 1 30 CYS QB 1 111 VAL QG . . 8.210 3.754 3.400 4.190 . 0 0 "[ . 1 . 2]" 1
329 1 30 CYS HB2 1 31 GLU H . . 4.250 2.206 1.867 2.417 . 0 0 "[ . 1 . 2]" 1
330 1 30 CYS HB2 1 70 VAL MG1 . . 7.790 6.213 5.931 6.481 . 0 0 "[ . 1 . 2]" 1
331 1 30 CYS HB2 1 70 VAL MG2 . . 7.790 4.369 4.053 4.937 . 0 0 "[ . 1 . 2]" 1
332 1 30 CYS HB2 1 110 ILE HG12 . . 5.510 5.392 4.837 5.684 0.174 7 0 "[ . 1 . 2]" 1
333 1 30 CYS HB2 1 110 ILE HG13 . . 5.510 5.037 4.520 5.240 . 0 0 "[ . 1 . 2]" 1
334 1 30 CYS HB3 1 31 GLU H . . 4.250 3.520 3.283 3.768 . 0 0 "[ . 1 . 2]" 1
335 1 30 CYS HB3 1 70 VAL MG1 . . 7.790 6.368 6.125 6.548 . 0 0 "[ . 1 . 2]" 1
336 1 30 CYS HB3 1 70 VAL MG2 . . 7.790 4.407 4.151 4.720 . 0 0 "[ . 1 . 2]" 1
337 1 30 CYS HB3 1 110 ILE HG12 . . 5.510 4.167 3.713 4.506 . 0 0 "[ . 1 . 2]" 1
338 1 30 CYS HB3 1 110 ILE HG13 . . 5.510 3.722 3.223 3.930 . 0 0 "[ . 1 . 2]" 1
339 1 30 CYS SG 1 66 CYS CB . . 3.100 3.002 2.933 3.134 0.034 12 0 "[ . 1 . 2]" 1
340 1 30 CYS SG 1 66 CYS SG . . 2.100 2.019 1.964 2.078 . 0 0 "[ . 1 . 2]" 1
341 1 31 GLU H 1 31 GLU HB2 . . 3.230 2.079 1.995 2.156 . 0 0 "[ . 1 . 2]" 1
342 1 31 GLU H 1 31 GLU QB . . 3.020 2.055 1.976 2.118 . 0 0 "[ . 1 . 2]" 1
343 1 31 GLU H 1 31 GLU HB3 . . 3.230 3.245 3.022 3.336 0.106 17 0 "[ . 1 . 2]" 1
344 1 31 GLU H 1 31 GLU QG . . 4.900 3.713 3.356 3.926 . 0 0 "[ . 1 . 2]" 1
345 1 31 GLU H 1 32 ARG H . . 3.290 2.522 2.355 2.830 . 0 0 "[ . 1 . 2]" 1
346 1 31 GLU H 1 33 TYR H . . 4.450 4.135 3.991 4.322 . 0 0 "[ . 1 . 2]" 1
347 1 31 GLU H 1 82 ILE MD . . 7.030 4.368 3.578 5.424 . 0 0 "[ . 1 . 2]" 1
348 1 31 GLU H 1 85 ILE MD . . 5.340 3.732 1.943 4.521 . 0 0 "[ . 1 . 2]" 1
349 1 31 GLU H 1 85 ILE QG . . 6.880 3.531 2.752 5.078 . 0 0 "[ . 1 . 2]" 1
350 1 31 GLU H 1 110 ILE MG . . 7.030 4.684 4.379 5.104 . 0 0 "[ . 1 . 2]" 1
351 1 31 GLU HA 1 33 TYR H . . 4.580 4.117 3.895 4.422 . 0 0 "[ . 1 . 2]" 1
352 1 31 GLU HA 1 34 LEU QD . . 6.020 2.085 1.740 2.741 . 0 0 "[ . 1 . 2]" 1
353 1 31 GLU HA 1 34 LEU HG . . 3.820 3.267 2.558 3.620 . 0 0 "[ . 1 . 2]" 1
354 1 31 GLU HA 1 35 ARG H . . 4.610 4.434 4.165 4.574 . 0 0 "[ . 1 . 2]" 1
355 1 31 GLU HA 1 89 GLN QE . . 6.870 4.273 3.097 6.039 . 0 0 "[ . 1 . 2]" 1
356 1 31 GLU HA 1 107 ALA HA . . 3.260 3.264 3.122 3.364 0.104 13 0 "[ . 1 . 2]" 1
357 1 31 GLU HA 1 110 ILE QG . . 4.570 4.213 4.137 4.259 . 0 0 "[ . 1 . 2]" 1
358 1 31 GLU QB 1 32 ARG H . . 3.160 2.825 2.550 2.904 . 0 0 "[ . 1 . 2]" 1
359 1 31 GLU QB 1 86 ALA HA . . 5.330 3.590 2.892 4.907 . 0 0 "[ . 1 . 2]" 1
360 1 31 GLU HB2 1 32 ARG H . . 3.430 3.265 3.124 3.435 0.005 13 0 "[ . 1 . 2]" 1
361 1 31 GLU HB3 1 32 ARG H . . 3.430 3.117 2.629 3.283 . 0 0 "[ . 1 . 2]" 1
362 1 31 GLU QG 1 32 ARG H . . 6.780 4.560 4.345 4.630 . 0 0 "[ . 1 . 2]" 1
363 1 31 GLU QG 1 82 ILE MD . . 7.900 3.895 2.994 4.784 . 0 0 "[ . 1 . 2]" 1
364 1 31 GLU QG 1 87 GLU HA . . 6.880 6.139 5.982 6.288 . 0 0 "[ . 1 . 2]" 1
365 1 32 ARG H 1 32 ARG HB2 . . 2.730 2.277 2.222 2.330 . 0 0 "[ . 1 . 2]" 1
366 1 32 ARG H 1 32 ARG HB3 . . 2.730 2.793 2.712 2.863 0.133 13 0 "[ . 1 . 2]" 1
367 1 32 ARG H 1 32 ARG HD2 . . 6.000 5.231 4.524 5.932 . 0 0 "[ . 1 . 2]" 1
368 1 32 ARG H 1 32 ARG QD . . 5.650 4.242 3.732 4.725 . 0 0 "[ . 1 . 2]" 1
369 1 32 ARG H 1 32 ARG HD3 . . 6.000 4.795 3.812 5.916 . 0 0 "[ . 1 . 2]" 1
370 1 32 ARG H 1 32 ARG HE . . 6.000 4.439 3.416 4.777 . 0 0 "[ . 1 . 2]" 1
371 1 32 ARG H 1 33 TYR H . . 2.900 2.725 2.623 2.849 . 0 0 "[ . 1 . 2]" 1
372 1 32 ARG HA 1 32 ARG HD2 . . 5.640 3.842 3.164 4.655 . 0 0 "[ . 1 . 2]" 1
373 1 32 ARG HA 1 32 ARG QD . . 5.120 2.938 1.980 4.071 . 0 0 "[ . 1 . 2]" 1
374 1 32 ARG HA 1 32 ARG HD3 . . 5.640 3.219 1.994 4.675 . 0 0 "[ . 1 . 2]" 1
375 1 32 ARG HA 1 32 ARG HE . . 4.420 4.002 2.347 4.465 0.045 14 0 "[ . 1 . 2]" 1
376 1 32 ARG HA 1 34 LEU H . . 5.140 4.446 4.228 4.751 . 0 0 "[ . 1 . 2]" 1
377 1 32 ARG HA 1 34 LEU HG . . 6.000 4.636 4.427 4.915 . 0 0 "[ . 1 . 2]" 1
378 1 32 ARG HA 1 35 ARG H . . 4.020 3.103 3.021 3.206 . 0 0 "[ . 1 . 2]" 1
379 1 32 ARG HA 1 35 ARG HA . . 4.680 4.757 4.704 4.826 0.146 8 0 "[ . 1 . 2]" 1
380 1 32 ARG HA 1 35 ARG HB2 . . 3.560 2.475 2.037 2.988 . 0 0 "[ . 1 . 2]" 1
381 1 32 ARG HA 1 35 ARG QB . . 3.270 2.091 1.983 2.220 . 0 0 "[ . 1 . 2]" 1
382 1 32 ARG HA 1 35 ARG HB3 . . 3.560 2.406 2.023 3.122 . 0 0 "[ . 1 . 2]" 1
383 1 32 ARG HA 1 36 GLN H . . 4.380 3.912 3.572 4.457 0.077 15 0 "[ . 1 . 2]" 1
384 1 32 ARG HA 1 36 GLN QG . . 6.880 5.614 4.950 6.081 . 0 0 "[ . 1 . 2]" 1
385 1 32 ARG QB 1 33 TYR H . . 3.930 2.678 2.447 2.855 . 0 0 "[ . 1 . 2]" 1
386 1 32 ARG HB2 1 33 TYR H . . 4.150 3.763 3.640 3.865 . 0 0 "[ . 1 . 2]" 1
387 1 32 ARG HB3 1 33 TYR H . . 4.150 2.742 2.487 2.941 . 0 0 "[ . 1 . 2]" 1
388 1 32 ARG QD 1 33 TYR H . . 6.880 5.041 3.911 5.580 . 0 0 "[ . 1 . 2]" 1
389 1 32 ARG QD 1 35 ARG HE . . 6.250 4.664 2.496 5.431 . 0 0 "[ . 1 . 2]" 1
390 1 32 ARG QD 1 36 GLN QG . . 7.760 4.486 2.481 5.049 . 0 0 "[ . 1 . 2]" 1
391 1 32 ARG QG 1 33 TYR H . . 6.880 4.069 3.888 4.351 . 0 0 "[ . 1 . 2]" 1
392 1 33 TYR H 1 33 TYR HB2 . . 3.290 2.440 2.192 2.688 . 0 0 "[ . 1 . 2]" 1
393 1 33 TYR H 1 33 TYR HB3 . . 3.290 2.370 2.187 2.650 . 0 0 "[ . 1 . 2]" 1
394 1 33 TYR H 1 33 TYR QE . . 6.980 6.143 6.052 6.182 . 0 0 "[ . 1 . 2]" 1
395 1 33 TYR H 1 35 ARG H . . 4.150 3.785 3.590 4.002 . 0 0 "[ . 1 . 2]" 1
396 1 33 TYR HA 1 36 GLN QG . . 6.580 5.414 4.979 5.954 . 0 0 "[ . 1 . 2]" 1
397 1 33 TYR HA 1 62 GLN QB . . 6.880 5.342 3.673 5.943 . 0 0 "[ . 1 . 2]" 1
398 1 33 TYR QB 1 62 GLN QB . . 7.590 4.365 2.763 5.200 . 0 0 "[ . 1 . 2]" 1
399 1 33 TYR QB 1 62 GLN QE . . 7.740 5.465 3.344 6.141 . 0 0 "[ . 1 . 2]" 1
400 1 33 TYR QB 1 110 ILE QG . . 6.690 2.616 2.345 3.299 . 0 0 "[ . 1 . 2]" 1
401 1 33 TYR HB2 1 34 LEU H . . 3.950 3.742 3.427 3.938 . 0 0 "[ . 1 . 2]" 1
402 1 33 TYR HB2 1 110 ILE HG12 . . 7.750 5.081 4.451 5.850 . 0 0 "[ . 1 . 2]" 1
403 1 33 TYR HB2 1 110 ILE HG13 . . 7.750 3.726 3.262 4.705 . 0 0 "[ . 1 . 2]" 1
404 1 33 TYR HB3 1 34 LEU H . . 3.950 2.329 2.035 2.562 . 0 0 "[ . 1 . 2]" 1
405 1 33 TYR HB3 1 110 ILE HG12 . . 7.750 3.677 3.235 4.354 . 0 0 "[ . 1 . 2]" 1
406 1 33 TYR HB3 1 110 ILE HG13 . . 7.750 2.762 2.427 3.536 . 0 0 "[ . 1 . 2]" 1
407 1 33 TYR QD 1 34 LEU H . . 7.610 3.261 2.442 3.545 . 0 0 "[ . 1 . 2]" 1
408 1 33 TYR QD 1 34 LEU HA . . 8.140 3.799 2.858 4.094 . 0 0 "[ . 1 . 2]" 1
409 1 33 TYR QD 1 34 LEU QD . . 9.880 4.203 3.521 4.824 . 0 0 "[ . 1 . 2]" 1
410 1 33 TYR QD 1 62 GLN HA . . 8.140 4.795 4.050 5.985 . 0 0 "[ . 1 . 2]" 1
411 1 33 TYR QD 1 62 GLN QB . . 7.460 2.996 2.024 3.814 . 0 0 "[ . 1 . 2]" 1
412 1 33 TYR QD 1 62 GLN QG . . 9.020 3.742 1.983 4.956 . 0 0 "[ . 1 . 2]" 1
413 1 33 TYR QD 1 63 LEU HA . . 8.140 4.793 4.259 5.288 . 0 0 "[ . 1 . 2]" 1
414 1 33 TYR QD 1 63 LEU HB2 . . 7.780 6.107 4.277 6.845 . 0 0 "[ . 1 . 2]" 1
415 1 33 TYR QD 1 63 LEU MD1 . . 8.410 3.433 2.664 5.067 . 0 0 "[ . 1 . 2]" 1
416 1 33 TYR QD 1 63 LEU QD . . 8.130 3.266 2.645 4.532 . 0 0 "[ . 1 . 2]" 1
417 1 33 TYR QD 1 63 LEU MD2 . . 8.410 4.929 3.560 6.135 . 0 0 "[ . 1 . 2]" 1
418 1 33 TYR QD 1 110 ILE HA . . 8.140 5.322 4.914 5.910 . 0 0 "[ . 1 . 2]" 1
419 1 33 TYR QD 1 110 ILE MD . . 8.610 2.134 1.882 2.856 . 0 0 "[ . 1 . 2]" 1
420 1 33 TYR QD 1 110 ILE HG12 . . 6.850 2.937 2.617 3.397 . 0 0 "[ . 1 . 2]" 1
421 1 33 TYR QD 1 110 ILE QG . . 6.440 2.378 2.019 2.866 . 0 0 "[ . 1 . 2]" 1
422 1 33 TYR QD 1 110 ILE HG13 . . 6.850 2.521 2.096 3.087 . 0 0 "[ . 1 . 2]" 1
423 1 33 TYR QE 1 34 LEU H . . 7.770 5.324 4.636 5.617 . 0 0 "[ . 1 . 2]" 1
424 1 33 TYR QE 1 34 LEU HA . . 7.510 4.826 3.621 5.500 . 0 0 "[ . 1 . 2]" 1
425 1 33 TYR QE 1 34 LEU QD . . 9.510 5.540 4.721 6.112 . 0 0 "[ . 1 . 2]" 1
426 1 33 TYR QE 1 61 GLN QG . . 9.010 5.699 4.072 6.254 . 0 0 "[ . 1 . 2]" 1
427 1 33 TYR QE 1 62 GLN HA . . 8.130 4.441 3.756 5.181 . 0 0 "[ . 1 . 2]" 1
428 1 33 TYR QE 1 62 GLN QB . . 7.790 2.172 1.823 3.116 . 0 0 "[ . 1 . 2]" 1
429 1 33 TYR QE 1 62 GLN QG . . 9.010 2.644 2.012 3.413 . 0 0 "[ . 1 . 2]" 1
430 1 33 TYR QE 1 63 LEU H . . 8.000 4.495 3.420 5.423 . 0 0 "[ . 1 . 2]" 1
431 1 33 TYR QE 1 63 LEU HA . . 8.130 5.047 4.586 5.501 . 0 0 "[ . 1 . 2]" 1
432 1 33 TYR QE 1 63 LEU HB2 . . 6.850 5.377 3.723 6.218 . 0 0 "[ . 1 . 2]" 1
433 1 33 TYR QE 1 63 LEU HB3 . . 7.970 6.310 4.995 7.003 . 0 0 "[ . 1 . 2]" 1
434 1 33 TYR QE 1 63 LEU MD1 . . 8.100 2.995 2.114 4.521 . 0 0 "[ . 1 . 2]" 1
435 1 33 TYR QE 1 63 LEU QD . . 7.730 2.787 2.104 4.102 . 0 0 "[ . 1 . 2]" 1
436 1 33 TYR QE 1 63 LEU MD2 . . 8.100 4.313 2.797 5.710 . 0 0 "[ . 1 . 2]" 1
437 1 33 TYR QE 1 63 LEU HG . . 8.130 5.075 3.956 5.754 . 0 0 "[ . 1 . 2]" 1
438 1 33 TYR QE 1 109 GLU QB . . 9.010 4.503 3.973 5.293 . 0 0 "[ . 1 . 2]" 1
439 1 33 TYR QE 1 110 ILE H . . 8.130 5.837 5.338 6.518 . 0 0 "[ . 1 . 2]" 1
440 1 33 TYR QE 1 110 ILE HA . . 8.130 5.717 5.377 6.117 . 0 0 "[ . 1 . 2]" 1
441 1 33 TYR QE 1 110 ILE MD . . 8.040 2.319 2.041 2.697 . 0 0 "[ . 1 . 2]" 1
442 1 33 TYR QE 1 110 ILE HG12 . . 7.570 4.510 4.109 5.018 . 0 0 "[ . 1 . 2]" 1
443 1 33 TYR QE 1 110 ILE QG . . 6.690 3.868 3.559 4.293 . 0 0 "[ . 1 . 2]" 1
444 1 33 TYR QE 1 110 ILE HG13 . . 7.570 4.215 3.896 4.731 . 0 0 "[ . 1 . 2]" 1
445 1 33 TYR QE 1 110 ILE MG . . 9.160 5.037 4.742 5.376 . 0 0 "[ . 1 . 2]" 1
446 1 34 LEU H 1 34 LEU QB . . 3.870 2.295 2.116 2.584 . 0 0 "[ . 1 . 2]" 1
447 1 34 LEU H 1 34 LEU MD1 . . 5.150 3.970 3.552 4.180 . 0 0 "[ . 1 . 2]" 1
448 1 34 LEU H 1 34 LEU QD . . 4.820 2.898 2.358 3.118 . 0 0 "[ . 1 . 2]" 1
449 1 34 LEU H 1 34 LEU MD2 . . 5.150 2.987 2.379 3.218 . 0 0 "[ . 1 . 2]" 1
450 1 34 LEU H 1 34 LEU HG . . 3.920 2.609 1.943 2.978 . 0 0 "[ . 1 . 2]" 1
451 1 34 LEU H 1 35 ARG H . . 3.260 2.472 2.414 2.569 . 0 0 "[ . 1 . 2]" 1
452 1 34 LEU H 1 36 GLN H . . 4.120 4.179 3.983 4.295 0.175 4 0 "[ . 1 . 2]" 1
453 1 34 LEU H 1 110 ILE QG . . 6.250 3.829 3.564 4.295 . 0 0 "[ . 1 . 2]" 1
454 1 34 LEU HA 1 34 LEU HG . . 3.890 3.620 3.550 3.656 . 0 0 "[ . 1 . 2]" 1
455 1 34 LEU HA 1 36 GLN H . . 4.610 4.236 3.445 4.605 . 0 0 "[ . 1 . 2]" 1
456 1 34 LEU HA 1 106 ARG QG . . 6.880 4.368 3.567 6.102 . 0 0 "[ . 1 . 2]" 1
457 1 34 LEU QB 1 35 ARG H . . 4.200 3.572 3.479 3.739 . 0 0 "[ . 1 . 2]" 1
458 1 34 LEU QD 1 35 ARG H . . 6.260 3.098 2.713 3.286 . 0 0 "[ . 1 . 2]" 1
459 1 34 LEU QD 1 35 ARG HA . . 7.710 2.914 2.500 3.191 . 0 0 "[ . 1 . 2]" 1
460 1 34 LEU QD 1 36 GLN H . . 8.600 4.716 4.217 4.931 . 0 0 "[ . 1 . 2]" 1
461 1 34 LEU QD 1 103 VAL QG . . 9.800 2.120 1.637 2.641 . 0 0 "[ . 1 . 2]" 1
462 1 34 LEU QD 1 106 ARG HA . . 8.600 3.274 2.915 3.610 . 0 0 "[ . 1 . 2]" 1
463 1 34 LEU QD 1 106 ARG QB . . 6.180 1.543 1.428 1.771 . 0 0 "[ . 1 . 2]" 1
464 1 34 LEU QD 1 106 ARG HE . . 8.140 3.122 1.940 4.021 . 0 0 "[ . 1 . 2]" 1
465 1 34 LEU QD 1 106 ARG QG . . 8.780 1.948 1.500 2.492 . 0 0 "[ . 1 . 2]" 1
466 1 34 LEU QD 1 107 ALA H . . 6.490 2.371 1.907 2.645 . 0 0 "[ . 1 . 2]" 1
467 1 34 LEU QD 1 107 ALA HA . . 5.890 2.074 1.882 2.271 . 0 0 "[ . 1 . 2]" 1
468 1 34 LEU QD 1 110 ILE H . . 6.820 4.236 3.373 4.678 . 0 0 "[ . 1 . 2]" 1
469 1 34 LEU MD1 1 35 ARG H . . 7.030 3.304 2.746 3.590 . 0 0 "[ . 1 . 2]" 1
470 1 34 LEU MD1 1 107 ALA MB . . 6.140 3.922 3.595 4.085 . 0 0 "[ . 1 . 2]" 1
471 1 34 LEU MD2 1 35 ARG H . . 7.030 3.884 3.584 4.295 . 0 0 "[ . 1 . 2]" 1
472 1 34 LEU MD2 1 107 ALA MB . . 6.140 2.304 1.864 2.796 . 0 0 "[ . 1 . 2]" 1
473 1 34 LEU HG 1 35 ARG H . . 4.680 2.378 2.159 2.705 . 0 0 "[ . 1 . 2]" 1
474 1 34 LEU HG 1 35 ARG HA . . 6.000 3.782 3.433 4.537 . 0 0 "[ . 1 . 2]" 1
475 1 34 LEU HG 1 103 VAL HA . . 6.000 5.836 5.065 6.101 0.101 13 0 "[ . 1 . 2]" 1
476 1 34 LEU HG 1 103 VAL QG . . 8.120 4.081 3.511 4.763 . 0 0 "[ . 1 . 2]" 1
477 1 34 LEU HG 1 106 ARG QB . . 6.780 3.658 3.455 3.945 . 0 0 "[ . 1 . 2]" 1
478 1 35 ARG H 1 35 ARG HB2 . . 3.290 2.316 2.082 2.719 . 0 0 "[ . 1 . 2]" 1
479 1 35 ARG H 1 35 ARG HB3 . . 3.290 2.813 2.367 3.196 . 0 0 "[ . 1 . 2]" 1
480 1 35 ARG H 1 36 GLN H . . 3.920 2.581 2.376 2.676 . 0 0 "[ . 1 . 2]" 1
481 1 35 ARG QB 1 36 GLN QG . . 6.730 4.335 3.954 5.037 . 0 0 "[ . 1 . 2]" 1
482 1 35 ARG QD 1 36 GLN H . . 6.880 4.280 3.343 5.569 . 0 0 "[ . 1 . 2]" 1
483 1 35 ARG QD 1 36 GLN HB2 . . 6.880 4.804 3.774 5.898 . 0 0 "[ . 1 . 2]" 1
484 1 35 ARG HE 1 95 LEU QD . . 8.600 5.187 3.715 6.241 . 0 0 "[ . 1 . 2]" 1
485 1 35 ARG QG 1 36 GLN H . . 6.880 4.230 3.293 4.697 . 0 0 "[ . 1 . 2]" 1
486 1 35 ARG QG 1 93 GLY H . . 6.880 5.225 4.238 6.204 . 0 0 "[ . 1 . 2]" 1
487 1 36 GLN H 1 36 GLN HB2 . . 3.010 2.271 2.096 3.072 0.062 13 0 "[ . 1 . 2]" 1
488 1 36 GLN H 1 36 GLN HB3 . . 3.260 3.201 3.037 3.337 0.077 16 0 "[ . 1 . 2]" 1
489 1 36 GLN H 1 37 SER H . . 4.360 4.388 4.261 4.450 0.090 4 0 "[ . 1 . 2]" 1
490 1 36 GLN HA 1 36 GLN HE21 . . 6.000 4.041 2.210 4.898 . 0 0 "[ . 1 . 2]" 1
491 1 36 GLN HA 1 36 GLN QE . . 5.610 3.888 2.193 4.639 . 0 0 "[ . 1 . 2]" 1
492 1 36 GLN HA 1 36 GLN HE22 . . 6.000 5.183 3.374 5.759 . 0 0 "[ . 1 . 2]" 1
493 1 36 GLN HA 1 37 SER H . . 2.930 2.744 2.640 2.831 . 0 0 "[ . 1 . 2]" 1
494 1 36 GLN HB2 1 37 SER H . . 3.760 3.556 3.497 3.674 . 0 0 "[ . 1 . 2]" 1
495 1 36 GLN HB3 1 37 SER H . . 3.100 2.114 1.968 2.285 . 0 0 "[ . 1 . 2]" 1
496 1 36 GLN QG 1 37 SER H . . 5.090 2.465 1.838 3.192 . 0 0 "[ . 1 . 2]" 1
497 1 37 SER H 1 37 SER HB2 . . 3.530 2.576 2.112 3.338 . 0 0 "[ . 1 . 2]" 1
498 1 37 SER H 1 37 SER QB . . 3.220 2.345 2.085 2.844 . 0 0 "[ . 1 . 2]" 1
499 1 37 SER H 1 37 SER HB3 . . 3.530 2.971 2.195 3.495 . 0 0 "[ . 1 . 2]" 1
500 1 39 SER H 1 39 SER HA . . 2.870 2.832 2.661 2.932 0.062 19 0 "[ . 1 . 2]" 1
501 1 39 SER HA 1 40 ARG H . . 3.000 2.382 2.104 2.785 . 0 0 "[ . 1 . 2]" 1
502 1 40 ARG H 1 40 ARG HB2 . . 3.430 3.168 2.240 3.569 0.139 13 0 "[ . 1 . 2]" 1
503 1 40 ARG H 1 40 ARG QB . . 3.240 2.745 2.186 2.972 . 0 0 "[ . 1 . 2]" 1
504 1 40 ARG H 1 40 ARG HB3 . . 3.430 3.083 2.313 3.410 . 0 0 "[ . 1 . 2]" 1
505 1 40 ARG HA 1 47 VAL QG . . 8.120 5.783 5.320 5.980 . 0 0 "[ . 1 . 2]" 1
506 1 41 ARG H 1 41 ARG HA . . 2.730 2.786 2.704 2.835 0.105 16 0 "[ . 1 . 2]" 1
507 1 41 ARG H 1 41 ARG HB2 . . 3.630 2.811 2.058 3.602 . 0 0 "[ . 1 . 2]" 1
508 1 41 ARG H 1 41 ARG QB . . 3.260 2.505 2.037 3.015 . 0 0 "[ . 1 . 2]" 1
509 1 41 ARG H 1 41 ARG HB3 . . 3.630 3.205 2.390 3.619 . 0 0 "[ . 1 . 2]" 1
510 1 41 ARG H 1 41 ARG QG . . 5.130 3.542 2.345 4.370 . 0 0 "[ . 1 . 2]" 1
511 1 41 ARG HA 1 42 SER H . . 2.960 2.281 2.117 2.676 . 0 0 "[ . 1 . 2]" 1
512 1 41 ARG QB 1 42 SER H . . 4.120 3.126 2.202 3.716 . 0 0 "[ . 1 . 2]" 1
513 1 41 ARG HB2 1 42 SER H . . 4.480 3.945 2.244 4.430 . 0 0 "[ . 1 . 2]" 1
514 1 41 ARG HB3 1 42 SER H . . 4.480 3.461 2.220 4.092 . 0 0 "[ . 1 . 2]" 1
515 1 41 ARG QD 1 42 SER H . . 6.880 3.884 2.017 5.257 . 0 0 "[ . 1 . 2]" 1
516 1 41 ARG QG 1 42 SER H . . 6.880 2.937 1.879 4.191 . 0 0 "[ . 1 . 2]" 1
517 1 42 SER H 1 43 THR H . . 4.220 3.892 1.899 4.376 0.156 8 0 "[ . 1 . 2]" 1
518 1 42 SER HA 1 43 THR H . . 3.060 2.534 2.139 2.970 . 0 0 "[ . 1 . 2]" 1
519 1 43 THR H 1 43 THR HB . . 3.720 3.150 2.330 3.803 0.083 13 0 "[ . 1 . 2]" 1
520 1 43 THR HB 1 44 GLY H . . 4.020 3.642 1.905 4.035 0.015 19 0 "[ . 1 . 2]" 1
521 1 43 THR MG 1 44 GLY H . . 6.930 3.744 1.594 4.391 . 0 0 "[ . 1 . 2]" 1
522 1 44 GLY H 1 45 GLU H . . 3.690 3.546 1.907 3.827 0.137 8 0 "[ . 1 . 2]" 1
523 1 44 GLY QA 1 45 GLU H . . 3.060 2.181 2.083 2.923 . 0 0 "[ . 1 . 2]" 1
524 1 44 GLY HA2 1 45 GLU H . . 3.330 2.923 2.117 3.312 . 0 0 "[ . 1 . 2]" 1
525 1 44 GLY HA3 1 45 GLU H . . 3.330 2.589 2.108 3.410 0.080 4 0 "[ . 1 . 2]" 1
526 1 45 GLU H 1 45 GLU HB2 . . 3.560 2.980 2.084 3.650 0.090 9 0 "[ . 1 . 2]" 1
527 1 45 GLU H 1 45 GLU QB . . 3.360 2.505 2.057 2.864 . 0 0 "[ . 1 . 2]" 1
528 1 45 GLU H 1 45 GLU HB3 . . 3.560 3.027 2.451 3.557 . 0 0 "[ . 1 . 2]" 1
529 1 45 GLU H 1 46 GLU H . . 2.960 2.613 1.842 3.078 0.118 8 0 "[ . 1 . 2]" 1
530 1 45 GLU QG 1 47 VAL H . . 6.880 5.517 3.793 6.154 . 0 0 "[ . 1 . 2]" 1
531 1 46 GLU H 1 46 GLU HB2 . . 3.330 2.677 2.163 3.524 0.194 5 0 "[ . 1 . 2]" 1
532 1 46 GLU H 1 46 GLU QB . . 2.900 2.442 2.113 2.841 . 0 0 "[ . 1 . 2]" 1
533 1 46 GLU H 1 46 GLU HB3 . . 3.330 2.991 2.349 3.370 0.040 2 0 "[ . 1 . 2]" 1
534 1 46 GLU H 1 47 VAL H . . 4.120 3.755 2.153 4.288 0.168 6 0 "[ . 1 . 2]" 1
535 1 46 GLU HA 1 47 VAL H . . 2.960 2.525 2.100 2.982 0.022 14 0 "[ . 1 . 2]" 1
536 1 46 GLU HA 1 47 VAL QG . . 8.120 4.019 3.079 4.585 . 0 0 "[ . 1 . 2]" 1
537 1 46 GLU QG 1 47 VAL H . . 6.880 3.317 1.787 4.397 . 0 0 "[ . 1 . 2]" 1
538 1 46 GLU QG 1 48 LEU HG . . 6.880 4.458 2.768 6.189 . 0 0 "[ . 1 . 2]" 1
539 1 47 VAL H 1 47 VAL HB . . 3.030 2.664 2.324 3.062 0.032 9 0 "[ . 1 . 2]" 1
540 1 47 VAL H 1 48 LEU H . . 3.530 2.911 2.005 3.519 . 0 0 "[ . 1 . 2]" 1
541 1 47 VAL HA 1 48 LEU H . . 3.000 2.750 2.219 3.061 0.061 4 0 "[ . 1 . 2]" 1
542 1 47 VAL HA 1 49 ARG H . . 3.790 3.476 3.004 3.865 0.075 11 0 "[ . 1 . 2]" 1
543 1 47 VAL HB 1 48 LEU H . . 4.520 4.388 3.961 4.595 0.075 6 0 "[ . 1 . 2]" 1
544 1 47 VAL QG 1 68 ASN QB . . 8.540 4.581 1.733 5.484 . 0 0 "[ . 1 . 2]" 1
545 1 48 LEU H 1 48 LEU QB . . 3.580 2.796 2.121 3.130 . 0 0 "[ . 1 . 2]" 1
546 1 48 LEU H 1 48 LEU HG . . 3.820 2.919 2.117 3.834 0.014 11 0 "[ . 1 . 2]" 1
547 1 48 LEU H 1 49 ARG QB . . 5.160 3.844 3.181 4.598 . 0 0 "[ . 1 . 2]" 1
548 1 48 LEU HA 1 48 LEU HG . . 3.860 3.386 2.349 3.791 . 0 0 "[ . 1 . 2]" 1
549 1 48 LEU HA 1 49 ARG H . . 3.430 2.921 2.570 3.496 0.066 11 0 "[ . 1 . 2]" 1
550 1 48 LEU QD 1 49 ARG H . . 7.670 4.052 3.323 4.619 . 0 0 "[ . 1 . 2]" 1
551 1 49 ARG H 1 49 ARG HB2 . . 3.190 2.432 2.087 2.981 . 0 0 "[ . 1 . 2]" 1
552 1 49 ARG H 1 49 ARG QB . . 2.930 2.329 2.061 2.704 . 0 0 "[ . 1 . 2]" 1
553 1 49 ARG H 1 49 ARG HB3 . . 3.190 3.123 2.882 3.219 0.029 8 0 "[ . 1 . 2]" 1
554 1 49 ARG HA 1 50 MET H . . 3.230 2.631 2.129 3.223 . 0 0 "[ . 1 . 2]" 1
555 1 49 ARG QB 1 50 MET H . . 4.260 3.496 2.835 3.840 . 0 0 "[ . 1 . 2]" 1
556 1 49 ARG HB2 1 50 MET H . . 4.420 4.240 3.898 4.431 0.011 1 0 "[ . 1 . 2]" 1
557 1 49 ARG HB3 1 50 MET H . . 4.420 3.757 2.909 4.242 . 0 0 "[ . 1 . 2]" 1
558 1 49 ARG QD 1 50 MET H . . 6.880 4.574 3.001 5.683 . 0 0 "[ . 1 . 2]" 1
559 1 49 ARG QG 1 50 MET H . . 6.880 3.469 1.889 4.807 . 0 0 "[ . 1 . 2]" 1
560 1 50 MET H 1 50 MET HB2 . . 3.760 2.642 2.034 3.375 . 0 0 "[ . 1 . 2]" 1
561 1 50 MET H 1 50 MET QB . . 3.310 2.533 2.017 3.085 . 0 0 "[ . 1 . 2]" 1
562 1 50 MET H 1 50 MET HB3 . . 3.760 3.505 3.043 3.807 0.047 6 0 "[ . 1 . 2]" 1
563 1 50 MET H 1 51 PRO QD . . 6.880 3.199 2.018 4.375 . 0 0 "[ . 1 . 2]" 1
564 1 50 MET HA 1 51 PRO QD . . 3.780 2.593 1.969 3.550 . 0 0 "[ . 1 . 2]" 1
565 1 50 MET QB 1 51 PRO QD . . 4.960 2.564 1.890 3.867 . 0 0 "[ . 1 . 2]" 1
566 1 50 MET QB 1 52 GLY H . . 5.960 4.242 1.993 5.309 . 0 0 "[ . 1 . 2]" 1
567 1 50 MET HB2 1 51 PRO HD2 . . 5.510 3.932 3.122 5.049 . 0 0 "[ . 1 . 2]" 1
568 1 50 MET HB2 1 51 PRO HD3 . . 5.510 3.738 2.119 4.952 . 0 0 "[ . 1 . 2]" 1
569 1 50 MET HB3 1 51 PRO HD2 . . 5.510 3.414 2.012 5.033 . 0 0 "[ . 1 . 2]" 1
570 1 50 MET HB3 1 51 PRO HD3 . . 5.510 3.359 2.090 4.918 . 0 0 "[ . 1 . 2]" 1
571 1 51 PRO HA 1 52 GLY H . . 3.390 2.818 2.129 3.569 0.179 5 0 "[ . 1 . 2]" 1
572 1 52 GLY H 1 53 ASP H . . 3.690 3.140 1.949 3.744 0.054 7 0 "[ . 1 . 2]" 1
573 1 52 GLY H 1 53 ASP QB . . 6.480 4.512 3.332 5.503 . 0 0 "[ . 1 . 2]" 1
574 1 52 GLY H 1 55 ASN QB . . 6.880 5.608 3.820 6.186 . 0 0 "[ . 1 . 2]" 1
575 1 52 GLY QA 1 53 ASP HA . . 5.130 4.077 3.951 4.262 . 0 0 "[ . 1 . 2]" 1
576 1 52 GLY HA2 1 53 ASP H . . 3.560 2.914 2.138 3.580 0.020 7 0 "[ . 1 . 2]" 1
577 1 52 GLY HA3 1 53 ASP H . . 3.560 2.980 2.168 3.557 . 0 0 "[ . 1 . 2]" 1
578 1 53 ASP H 1 54 GLU H . . 3.590 2.743 2.091 3.630 0.040 19 0 "[ . 1 . 2]" 1
579 1 54 GLU H 1 54 GLU HB2 . . 3.430 2.663 2.066 3.558 0.128 12 0 "[ . 1 . 2]" 1
580 1 54 GLU H 1 54 GLU QB . . 3.020 2.304 2.047 2.752 . 0 0 "[ . 1 . 2]" 1
581 1 54 GLU H 1 54 GLU HB3 . . 3.430 3.131 2.243 3.484 0.054 10 0 "[ . 1 . 2]" 1
582 1 54 GLU H 1 54 GLU HG2 . . 4.250 3.395 2.026 4.282 0.032 7 0 "[ . 1 . 2]" 1
583 1 54 GLU H 1 54 GLU QG . . 3.850 3.105 2.012 3.610 . 0 0 "[ . 1 . 2]" 1
584 1 54 GLU H 1 54 GLU HG3 . . 4.250 3.880 3.286 4.354 0.104 13 0 "[ . 1 . 2]" 1
585 1 54 GLU HA 1 55 ASN H . . 3.290 2.396 2.085 2.867 . 0 0 "[ . 1 . 2]" 1
586 1 54 GLU QG 1 55 ASN H . . 5.490 3.910 2.664 4.568 . 0 0 "[ . 1 . 2]" 1
587 1 55 ASN HA 1 56 GLN H . . 3.030 2.470 2.138 2.943 . 0 0 "[ . 1 . 2]" 1
588 1 55 ASN QB 1 56 GLN H . . 4.530 3.084 1.981 4.058 . 0 0 "[ . 1 . 2]" 1
589 1 55 ASN QB 1 56 GLN HA . . 6.250 4.681 4.223 5.191 . 0 0 "[ . 1 . 2]" 1
590 1 55 ASN QB 1 65 GLN HA . . 6.880 6.097 5.591 6.283 . 0 0 "[ . 1 . 2]" 1
591 1 55 ASN QD 1 56 GLN QB . . 7.750 4.846 2.356 6.095 . 0 0 "[ . 1 . 2]" 1
592 1 56 GLN H 1 56 GLN HB2 . . 3.430 2.435 2.047 3.490 0.060 18 0 "[ . 1 . 2]" 1
593 1 56 GLN H 1 56 GLN HB3 . . 3.430 3.170 2.059 3.456 0.026 16 0 "[ . 1 . 2]" 1
594 1 56 GLN H 1 56 GLN HG2 . . 4.480 3.532 2.195 4.483 0.003 20 0 "[ . 1 . 2]" 1
595 1 56 GLN H 1 56 GLN QG . . 3.940 3.181 1.874 3.668 . 0 0 "[ . 1 . 2]" 1
596 1 56 GLN H 1 56 GLN HG3 . . 4.480 3.704 2.004 4.392 . 0 0 "[ . 1 . 2]" 1
597 1 56 GLN HA 1 56 GLN QG . . 3.470 2.311 1.924 3.254 . 0 0 "[ . 1 . 2]" 1
598 1 56 GLN QB 1 67 CYS QB . . 7.760 5.091 3.460 6.199 . 0 0 "[ . 1 . 2]" 1
599 1 57 GLN H 1 57 GLN HB2 . . 3.330 2.837 2.074 3.326 . 0 0 "[ . 1 . 2]" 1
600 1 57 GLN H 1 57 GLN HB3 . . 3.330 3.065 2.447 3.431 0.101 5 0 "[ . 1 . 2]" 1
601 1 57 GLN H 1 57 GLN QG . . 5.090 4.106 3.294 4.450 . 0 0 "[ . 1 . 2]" 1
602 1 58 GLN H 1 58 GLN QB . . 3.870 2.683 2.015 3.057 . 0 0 "[ . 1 . 2]" 1
603 1 58 GLN H 1 58 GLN QG . . 5.000 3.838 2.624 4.252 . 0 0 "[ . 1 . 2]" 1
604 1 58 GLN QB 1 59 GLU H . . 4.200 2.534 1.951 3.733 . 0 0 "[ . 1 . 2]" 1
605 1 59 GLU H 1 59 GLU HG2 . . 4.020 3.071 1.995 3.950 . 0 0 "[ . 1 . 2]" 1
606 1 59 GLU H 1 59 GLU HG3 . . 4.020 3.251 2.074 4.033 0.013 4 0 "[ . 1 . 2]" 1
607 1 59 GLU QG 1 60 SER H . . 6.060 4.273 3.704 4.655 . 0 0 "[ . 1 . 2]" 1
608 1 60 SER H 1 61 GLN H . . 4.320 2.780 2.027 3.458 . 0 0 "[ . 1 . 2]" 1
609 1 60 SER H 1 61 GLN HA . . 4.050 4.013 3.872 4.191 0.141 7 0 "[ . 1 . 2]" 1
610 1 60 SER H 1 63 LEU QD . . 8.600 5.516 4.423 6.290 . 0 0 "[ . 1 . 2]" 1
611 1 60 SER HA 1 61 GLN H . . 3.390 2.461 2.186 2.838 . 0 0 "[ . 1 . 2]" 1
612 1 60 SER HA 1 62 GLN H . . 4.420 3.134 2.909 3.393 . 0 0 "[ . 1 . 2]" 1
613 1 60 SER HA 1 63 LEU H . . 4.420 3.981 3.575 4.327 . 0 0 "[ . 1 . 2]" 1
614 1 60 SER HA 1 63 LEU QD . . 7.180 4.368 3.207 5.197 . 0 0 "[ . 1 . 2]" 1
615 1 61 GLN H 1 61 GLN QB . . 3.770 2.501 2.295 2.689 . 0 0 "[ . 1 . 2]" 1
616 1 61 GLN H 1 61 GLN HG2 . . 3.820 2.237 1.986 2.939 . 0 0 "[ . 1 . 2]" 1
617 1 61 GLN H 1 61 GLN QG . . 3.390 2.160 1.962 2.597 . 0 0 "[ . 1 . 2]" 1
618 1 61 GLN H 1 61 GLN HG3 . . 3.820 3.281 2.180 3.860 0.040 9 0 "[ . 1 . 2]" 1
619 1 61 GLN HA 1 61 GLN QG . . 3.870 3.313 3.273 3.364 . 0 0 "[ . 1 . 2]" 1
620 1 61 GLN HA 1 62 GLN H . . 3.530 3.462 3.365 3.532 0.002 3 0 "[ . 1 . 2]" 1
621 1 61 GLN HA 1 64 GLN H . . 3.860 3.492 3.168 3.763 . 0 0 "[ . 1 . 2]" 1
622 1 61 GLN QB 1 63 LEU H . . 6.510 5.517 4.934 5.837 . 0 0 "[ . 1 . 2]" 1
623 1 61 GLN QG 1 62 GLN HA . . 4.870 3.535 3.274 4.030 . 0 0 "[ . 1 . 2]" 1
624 1 61 GLN QG 1 62 GLN QG . . 7.760 2.989 2.180 4.018 . 0 0 "[ . 1 . 2]" 1
625 1 62 GLN H 1 62 GLN QB . . 3.910 2.191 1.963 2.603 . 0 0 "[ . 1 . 2]" 1
626 1 62 GLN H 1 62 GLN QG . . 5.090 2.849 2.167 3.699 . 0 0 "[ . 1 . 2]" 1
627 1 62 GLN HA 1 65 GLN H . . 4.260 3.571 3.039 3.968 . 0 0 "[ . 1 . 2]" 1
628 1 62 GLN QB 1 64 GLN H . . 6.350 4.347 4.097 4.673 . 0 0 "[ . 1 . 2]" 1
629 1 62 GLN QB 1 65 GLN H . . 5.820 4.696 4.291 4.913 . 0 0 "[ . 1 . 2]" 1
630 1 62 GLN QG 1 63 LEU H . . 6.880 4.203 3.883 4.638 . 0 0 "[ . 1 . 2]" 1
631 1 63 LEU H 1 63 LEU HB2 . . 3.430 2.108 2.009 2.326 . 0 0 "[ . 1 . 2]" 1
632 1 63 LEU H 1 63 LEU HB3 . . 3.530 3.352 2.552 3.506 . 0 0 "[ . 1 . 2]" 1
633 1 63 LEU H 1 63 LEU HG . . 4.250 4.131 3.648 4.335 0.085 19 0 "[ . 1 . 2]" 1
634 1 63 LEU H 1 64 GLN H . . 3.590 2.714 2.516 2.888 . 0 0 "[ . 1 . 2]" 1
635 1 63 LEU HA 1 63 LEU HG . . 3.990 2.647 2.370 3.571 . 0 0 "[ . 1 . 2]" 1
636 1 63 LEU HA 1 64 GLN HA . . 6.000 4.871 4.800 4.939 . 0 0 "[ . 1 . 2]" 1
637 1 63 LEU HA 1 65 GLN H . . 4.810 3.869 3.563 4.718 . 0 0 "[ . 1 . 2]" 1
638 1 63 LEU HA 1 66 CYS H . . 3.760 3.025 2.875 3.456 . 0 0 "[ . 1 . 2]" 1
639 1 63 LEU HA 1 66 CYS HB2 . . 3.720 3.669 3.407 3.816 0.096 12 0 "[ . 1 . 2]" 1
640 1 63 LEU HA 1 66 CYS HB3 . . 3.720 2.837 2.605 3.096 . 0 0 "[ . 1 . 2]" 1
641 1 63 LEU HA 1 67 CYS H . . 4.450 4.258 3.993 4.448 . 0 0 "[ . 1 . 2]" 1
642 1 63 LEU HA 1 110 ILE MD . . 7.030 3.707 2.637 3.964 . 0 0 "[ . 1 . 2]" 1
643 1 63 LEU QB 1 64 GLN H . . 4.830 2.881 2.629 2.981 . 0 0 "[ . 1 . 2]" 1
644 1 63 LEU HB2 1 64 GLN H . . 4.350 3.208 2.992 3.905 . 0 0 "[ . 1 . 2]" 1
645 1 63 LEU HB2 1 110 ILE MD . . 5.870 4.183 2.328 4.633 . 0 0 "[ . 1 . 2]" 1
646 1 63 LEU HB3 1 63 LEU HG . . 2.900 2.438 2.277 2.984 0.084 12 0 "[ . 1 . 2]" 1
647 1 63 LEU HB3 1 64 GLN H . . 3.590 3.360 2.672 3.572 . 0 0 "[ . 1 . 2]" 1
648 1 63 LEU QD 1 64 GLN QB . . 9.470 5.055 3.711 5.344 . 0 0 "[ . 1 . 2]" 1
649 1 63 LEU QD 1 66 CYS H . . 8.600 4.270 3.516 4.731 . 0 0 "[ . 1 . 2]" 1
650 1 63 LEU QD 1 66 CYS QB . . 7.610 3.355 2.137 3.961 . 0 0 "[ . 1 . 2]" 1
651 1 63 LEU QD 1 109 GLU QG . . 8.220 5.268 4.889 5.413 . 0 0 "[ . 1 . 2]" 1
652 1 63 LEU QD 1 110 ILE H . . 8.600 4.192 3.967 4.440 . 0 0 "[ . 1 . 2]" 1
653 1 63 LEU QD 1 110 ILE HA . . 4.650 2.512 1.959 2.853 . 0 0 "[ . 1 . 2]" 1
654 1 63 LEU QD 1 110 ILE MD . . 9.000 1.470 1.127 2.432 . 0 0 "[ . 1 . 2]" 1
655 1 63 LEU QD 1 110 ILE QG . . 6.620 2.927 2.662 3.557 . 0 0 "[ . 1 . 2]" 1
656 1 63 LEU QD 1 110 ILE MG . . 9.060 2.437 1.537 2.981 . 0 0 "[ . 1 . 2]" 1
657 1 63 LEU QD 1 113 SER H . . 8.600 3.873 3.437 4.213 . 0 0 "[ . 1 . 2]" 1
658 1 63 LEU QD 1 113 SER QB . . 5.000 1.783 1.420 2.141 . 0 0 "[ . 1 . 2]" 1
659 1 63 LEU QD 1 114 CYS QB . . 8.170 4.217 3.074 4.977 . 0 0 "[ . 1 . 2]" 1
660 1 63 LEU MD1 1 64 GLN H . . 7.030 4.439 4.242 4.959 . 0 0 "[ . 1 . 2]" 1
661 1 63 LEU MD1 1 66 CYS HB2 . . 9.740 4.537 3.136 6.074 . 0 0 "[ . 1 . 2]" 1
662 1 63 LEU MD1 1 66 CYS HB3 . . 9.740 4.063 2.249 5.118 . 0 0 "[ . 1 . 2]" 1
663 1 63 LEU MD1 1 67 CYS H . . 7.030 5.476 3.566 5.919 . 0 0 "[ . 1 . 2]" 1
664 1 63 LEU MD1 1 109 GLU QB . . 7.900 4.263 3.468 4.859 . 0 0 "[ . 1 . 2]" 1
665 1 63 LEU MD1 1 110 ILE HA . . 5.510 3.175 2.055 3.698 . 0 0 "[ . 1 . 2]" 1
666 1 63 LEU MD1 1 110 ILE HG12 . . 8.780 3.981 3.680 5.072 . 0 0 "[ . 1 . 2]" 1
667 1 63 LEU MD1 1 110 ILE HG13 . . 8.780 3.218 2.797 4.695 . 0 0 "[ . 1 . 2]" 1
668 1 63 LEU MD1 1 113 SER HB2 . . 6.000 3.836 2.261 4.662 . 0 0 "[ . 1 . 2]" 1
669 1 63 LEU MD1 1 113 SER HB3 . . 6.000 3.971 1.990 4.659 . 0 0 "[ . 1 . 2]" 1
670 1 63 LEU MD1 1 114 CYS H . . 7.030 5.250 2.876 5.907 . 0 0 "[ . 1 . 2]" 1
671 1 63 LEU MD1 1 114 CYS HB2 . . 10.170 6.183 3.497 7.228 . 0 0 "[ . 1 . 2]" 1
672 1 63 LEU MD1 1 114 CYS HB3 . . 10.170 6.154 3.425 6.740 . 0 0 "[ . 1 . 2]" 1
673 1 63 LEU MD2 1 64 GLN H . . 7.030 4.713 3.282 4.975 . 0 0 "[ . 1 . 2]" 1
674 1 63 LEU MD2 1 66 CYS HB2 . . 9.740 5.500 3.322 6.079 . 0 0 "[ . 1 . 2]" 1
675 1 63 LEU MD2 1 66 CYS HB3 . . 9.740 4.583 2.166 5.120 . 0 0 "[ . 1 . 2]" 1
676 1 63 LEU MD2 1 67 CYS H . . 7.030 5.481 3.330 5.891 . 0 0 "[ . 1 . 2]" 1
677 1 63 LEU MD2 1 109 GLU QB . . 7.900 4.243 3.601 5.831 . 0 0 "[ . 1 . 2]" 1
678 1 63 LEU MD2 1 110 ILE HA . . 5.510 2.791 2.006 3.848 . 0 0 "[ . 1 . 2]" 1
679 1 63 LEU MD2 1 110 ILE HG12 . . 8.780 4.817 4.174 6.116 . 0 0 "[ . 1 . 2]" 1
680 1 63 LEU MD2 1 110 ILE HG13 . . 8.780 4.388 3.563 5.577 . 0 0 "[ . 1 . 2]" 1
681 1 63 LEU MD2 1 113 SER HB2 . . 6.000 2.384 1.532 3.643 . 0 0 "[ . 1 . 2]" 1
682 1 63 LEU MD2 1 113 SER HB3 . . 6.000 2.352 1.440 3.830 . 0 0 "[ . 1 . 2]" 1
683 1 63 LEU MD2 1 114 CYS H . . 7.030 4.202 2.726 5.199 . 0 0 "[ . 1 . 2]" 1
684 1 63 LEU MD2 1 114 CYS HB2 . . 10.170 5.021 3.711 6.160 . 0 0 "[ . 1 . 2]" 1
685 1 63 LEU MD2 1 114 CYS HB3 . . 10.170 5.424 3.503 6.205 . 0 0 "[ . 1 . 2]" 1
686 1 63 LEU HG 1 64 GLN H . . 6.000 5.189 4.528 5.314 . 0 0 "[ . 1 . 2]" 1
687 1 63 LEU HG 1 67 CYS H . . 6.000 5.348 4.664 5.950 . 0 0 "[ . 1 . 2]" 1
688 1 63 LEU HG 1 110 ILE HA . . 6.000 3.002 2.449 4.114 . 0 0 "[ . 1 . 2]" 1
689 1 63 LEU HG 1 113 SER QB . . 6.880 2.850 2.442 3.800 . 0 0 "[ . 1 . 2]" 1
690 1 64 GLN H 1 65 GLN H . . 2.960 2.812 2.694 2.969 0.009 2 0 "[ . 1 . 2]" 1
691 1 64 GLN H 1 66 CYS H . . 4.320 4.251 4.013 4.445 0.125 15 0 "[ . 1 . 2]" 1
692 1 64 GLN H 1 67 CYS H . . 4.780 4.791 4.703 4.858 0.078 3 0 "[ . 1 . 2]" 1
693 1 64 GLN HA 1 67 CYS H . . 3.690 3.310 3.176 3.456 . 0 0 "[ . 1 . 2]" 1
694 1 64 GLN HA 1 67 CYS HB2 . . 3.860 3.242 2.935 3.560 . 0 0 "[ . 1 . 2]" 1
695 1 64 GLN HA 1 67 CYS QB . . 3.370 2.764 2.646 2.850 . 0 0 "[ . 1 . 2]" 1
696 1 64 GLN HA 1 67 CYS HB3 . . 3.860 3.014 2.815 3.238 . 0 0 "[ . 1 . 2]" 1
697 1 64 GLN QB 1 68 ASN QB . . 7.760 4.845 4.336 5.154 . 0 0 "[ . 1 . 2]" 1
698 1 64 GLN QE 1 68 ASN QD . . 5.620 3.455 1.873 4.202 . 0 0 "[ . 1 . 2]" 1
699 1 64 GLN QG 1 69 GLN H . . 6.880 5.663 5.434 6.173 . 0 0 "[ . 1 . 2]" 1
700 1 64 GLN QG 1 69 GLN QG . . 7.750 6.234 6.057 6.355 . 0 0 "[ . 1 . 2]" 1
701 1 65 GLN H 1 65 GLN QB . . 3.910 2.110 2.022 2.415 . 0 0 "[ . 1 . 2]" 1
702 1 65 GLN H 1 65 GLN HG2 . . 4.890 4.102 2.947 4.645 . 0 0 "[ . 1 . 2]" 1
703 1 65 GLN H 1 65 GLN QG . . 4.490 3.485 2.309 3.944 . 0 0 "[ . 1 . 2]" 1
704 1 65 GLN H 1 65 GLN HG3 . . 4.890 3.873 2.412 4.463 . 0 0 "[ . 1 . 2]" 1
705 1 65 GLN H 1 66 CYS H . . 2.730 2.654 2.527 2.927 0.197 18 0 "[ . 1 . 2]" 1
706 1 65 GLN H 1 66 CYS HA . . 5.380 5.265 5.159 5.465 0.085 18 0 "[ . 1 . 2]" 1
707 1 65 GLN H 1 67 CYS H . . 4.650 4.291 4.109 4.562 . 0 0 "[ . 1 . 2]" 1
708 1 65 GLN HA 1 65 GLN HG2 . . 4.050 2.681 2.043 3.443 . 0 0 "[ . 1 . 2]" 1
709 1 65 GLN HA 1 65 GLN QG . . 3.440 2.139 1.932 2.575 . 0 0 "[ . 1 . 2]" 1
710 1 65 GLN HA 1 65 GLN HG3 . . 4.050 2.681 1.952 3.534 . 0 0 "[ . 1 . 2]" 1
711 1 65 GLN HA 1 67 CYS H . . 4.650 4.730 4.667 4.798 0.148 18 0 "[ . 1 . 2]" 1
712 1 65 GLN HA 1 68 ASN H . . 3.620 3.680 3.444 3.831 0.211 8 0 "[ . 1 . 2]" 1
713 1 65 GLN HA 1 68 ASN HB2 . . 4.050 3.177 2.464 3.959 . 0 0 "[ . 1 . 2]" 1
714 1 65 GLN HA 1 68 ASN QB . . 3.630 2.582 2.444 2.732 . 0 0 "[ . 1 . 2]" 1
715 1 65 GLN HA 1 68 ASN HB3 . . 4.050 3.347 2.541 4.071 0.021 18 0 "[ . 1 . 2]" 1
716 1 65 GLN HA 1 68 ASN QD . . 5.120 3.871 3.396 4.685 . 0 0 "[ . 1 . 2]" 1
717 1 65 GLN HA 1 69 GLN H . . 4.910 3.948 3.767 4.182 . 0 0 "[ . 1 . 2]" 1
718 1 65 GLN HA 1 69 GLN QB . . 5.590 4.693 4.570 4.785 . 0 0 "[ . 1 . 2]" 1
719 1 65 GLN QB 1 66 CYS H . . 4.300 2.799 2.611 2.901 . 0 0 "[ . 1 . 2]" 1
720 1 66 CYS H 1 66 CYS HB2 . . 3.590 2.781 2.609 2.917 . 0 0 "[ . 1 . 2]" 1
721 1 66 CYS H 1 66 CYS HB3 . . 3.590 2.280 2.184 2.490 . 0 0 "[ . 1 . 2]" 1
722 1 66 CYS H 1 67 CYS H . . 3.290 2.716 2.579 3.054 . 0 0 "[ . 1 . 2]" 1
723 1 66 CYS H 1 68 ASN H . . 4.220 4.223 3.893 4.641 0.421 15 0 "[ . 1 . 2]" 1
724 1 66 CYS H 1 110 ILE QG . . 6.880 5.896 5.821 5.966 . 0 0 "[ . 1 . 2]" 1
725 1 66 CYS HA 1 69 GLN H . . 4.380 3.263 3.129 3.381 . 0 0 "[ . 1 . 2]" 1
726 1 66 CYS HA 1 69 GLN HB2 . . 4.580 2.047 1.965 2.166 . 0 0 "[ . 1 . 2]" 1
727 1 66 CYS HA 1 69 GLN QB . . 4.030 2.033 1.954 2.152 . 0 0 "[ . 1 . 2]" 1
728 1 66 CYS HA 1 69 GLN HB3 . . 4.580 3.495 3.399 3.673 . 0 0 "[ . 1 . 2]" 1
729 1 66 CYS HA 1 70 VAL H . . 4.810 3.734 3.479 4.000 . 0 0 "[ . 1 . 2]" 1
730 1 66 CYS QB 1 67 CYS H . . 3.640 2.530 2.411 2.588 . 0 0 "[ . 1 . 2]" 1
731 1 66 CYS QB 1 70 VAL QG . . 9.430 3.782 3.642 4.091 . 0 0 "[ . 1 . 2]" 1
732 1 66 CYS QB 1 110 ILE MG . . 5.040 2.123 1.890 2.318 . 0 0 "[ . 1 . 2]" 1
733 1 66 CYS HB2 1 67 CYS H . . 3.990 3.959 3.890 4.006 0.016 2 0 "[ . 1 . 2]" 1
734 1 66 CYS HB3 1 67 CYS H . . 3.990 2.559 2.434 2.622 . 0 0 "[ . 1 . 2]" 1
735 1 67 CYS CB 1 114 CYS SG . . 3.100 3.054 2.949 3.123 0.023 18 0 "[ . 1 . 2]" 1
736 1 67 CYS H 1 67 CYS HB2 . . 3.620 2.232 2.119 2.325 . 0 0 "[ . 1 . 2]" 1
737 1 67 CYS H 1 67 CYS QB . . 3.350 2.148 2.076 2.201 . 0 0 "[ . 1 . 2]" 1
738 1 67 CYS H 1 67 CYS HB3 . . 3.620 2.822 2.635 2.973 . 0 0 "[ . 1 . 2]" 1
739 1 67 CYS H 1 68 ASN H . . 3.460 2.850 2.671 3.029 . 0 0 "[ . 1 . 2]" 1
740 1 67 CYS H 1 69 GLN H . . 5.310 3.867 3.715 4.067 . 0 0 "[ . 1 . 2]" 1
741 1 67 CYS H 1 70 VAL QG . . 8.590 4.165 3.738 4.650 . 0 0 "[ . 1 . 2]" 1
742 1 67 CYS HA 1 70 VAL H . . 3.720 3.414 3.233 3.777 0.057 7 0 "[ . 1 . 2]" 1
743 1 67 CYS HA 1 70 VAL HB . . 3.200 3.018 2.760 3.244 0.044 19 0 "[ . 1 . 2]" 1
744 1 67 CYS HA 1 70 VAL MG1 . . 5.340 4.421 4.144 4.491 . 0 0 "[ . 1 . 2]" 1
745 1 67 CYS HA 1 70 VAL QG . . 4.610 3.030 2.437 3.348 . 0 0 "[ . 1 . 2]" 1
746 1 67 CYS HA 1 70 VAL MG2 . . 5.340 3.097 2.448 3.501 . 0 0 "[ . 1 . 2]" 1
747 1 67 CYS HA 1 114 CYS HB2 . . 3.620 3.582 3.358 3.704 0.084 8 0 "[ . 1 . 2]" 1
748 1 67 CYS HA 1 114 CYS QB . . 3.070 2.169 2.032 2.393 . 0 0 "[ . 1 . 2]" 1
749 1 67 CYS HA 1 114 CYS HB3 . . 3.620 2.189 2.049 2.424 . 0 0 "[ . 1 . 2]" 1
750 1 67 CYS QB 1 68 ASN H . . 3.500 2.343 2.196 2.608 . 0 0 "[ . 1 . 2]" 1
751 1 67 CYS QB 1 69 GLN H . . 5.360 4.382 4.228 4.636 . 0 0 "[ . 1 . 2]" 1
752 1 67 CYS QB 1 70 VAL HB . . 6.880 5.045 4.806 5.167 . 0 0 "[ . 1 . 2]" 1
753 1 67 CYS QB 1 114 CYS QB . . 3.490 2.154 1.944 2.472 . 0 0 "[ . 1 . 2]" 1
754 1 67 CYS HB2 1 68 ASN H . . 3.690 3.538 3.345 3.680 . 0 0 "[ . 1 . 2]" 1
755 1 67 CYS HB2 1 114 CYS HB2 . . 4.450 2.630 2.372 2.984 . 0 0 "[ . 1 . 2]" 1
756 1 67 CYS HB2 1 114 CYS HB3 . . 4.450 2.326 2.052 2.785 . 0 0 "[ . 1 . 2]" 1
757 1 67 CYS HB3 1 68 ASN H . . 3.690 2.379 2.216 2.667 . 0 0 "[ . 1 . 2]" 1
758 1 67 CYS HB3 1 114 CYS HB2 . . 4.450 4.164 3.912 4.445 . 0 0 "[ . 1 . 2]" 1
759 1 67 CYS HB3 1 114 CYS HB3 . . 4.450 3.771 3.550 4.095 . 0 0 "[ . 1 . 2]" 1
760 1 67 CYS SG 1 114 CYS CB . . 3.100 2.998 2.924 3.112 0.012 18 0 "[ . 1 . 2]" 1
761 1 67 CYS SG 1 114 CYS SG . . 2.100 2.037 1.995 2.091 . 0 0 "[ . 1 . 2]" 1
762 1 68 ASN H 1 68 ASN HB2 . . 3.460 2.382 2.216 2.637 . 0 0 "[ . 1 . 2]" 1
763 1 68 ASN H 1 68 ASN HB3 . . 3.460 3.046 2.450 3.577 0.117 18 0 "[ . 1 . 2]" 1
764 1 68 ASN H 1 68 ASN HD21 . . 5.770 3.450 1.824 4.789 . 0 0 "[ . 1 . 2]" 1
765 1 68 ASN H 1 68 ASN HD22 . . 5.770 4.734 3.523 5.859 0.089 2 0 "[ . 1 . 2]" 1
766 1 68 ASN H 1 69 GLN H . . 2.700 2.672 2.468 2.922 0.222 8 0 "[ . 1 . 2]" 1
767 1 68 ASN H 1 70 VAL H . . 4.940 4.409 4.143 4.632 . 0 0 "[ . 1 . 2]" 1
768 1 68 ASN HA 1 71 LYS H . . 3.690 3.454 3.305 3.595 . 0 0 "[ . 1 . 2]" 1
769 1 68 ASN HA 1 71 LYS QB . . 4.080 2.419 2.326 2.491 . 0 0 "[ . 1 . 2]" 1
770 1 68 ASN QB 1 69 GLN H . . 3.810 2.814 2.610 2.998 . 0 0 "[ . 1 . 2]" 1
771 1 68 ASN QB 1 71 LYS H . . 6.810 4.805 4.689 4.883 . 0 0 "[ . 1 . 2]" 1
772 1 68 ASN QB 1 71 LYS QB . . 5.080 4.119 3.926 4.242 . 0 0 "[ . 1 . 2]" 1
773 1 68 ASN HB2 1 69 GLN H . . 4.050 3.481 2.839 4.011 . 0 0 "[ . 1 . 2]" 1
774 1 68 ASN HB3 1 69 GLN H . . 4.050 3.268 2.660 3.997 . 0 0 "[ . 1 . 2]" 1
775 1 68 ASN QD 1 69 GLN H . . 5.450 4.491 4.210 4.723 . 0 0 "[ . 1 . 2]" 1
776 1 68 ASN HD21 1 69 GLN H . . 6.000 4.678 4.311 4.991 . 0 0 "[ . 1 . 2]" 1
777 1 68 ASN HD22 1 69 GLN H . . 6.000 5.856 5.639 5.993 . 0 0 "[ . 1 . 2]" 1
778 1 69 GLN H 1 69 GLN HB2 . . 3.760 2.201 2.166 2.242 . 0 0 "[ . 1 . 2]" 1
779 1 69 GLN H 1 69 GLN QB . . 3.310 2.179 2.146 2.218 . 0 0 "[ . 1 . 2]" 1
780 1 69 GLN H 1 69 GLN HB3 . . 3.760 3.499 3.468 3.534 . 0 0 "[ . 1 . 2]" 1
781 1 69 GLN H 1 70 VAL H . . 3.100 2.578 2.451 2.829 . 0 0 "[ . 1 . 2]" 1
782 1 69 GLN H 1 70 VAL MG1 . . 7.030 5.792 5.657 5.946 . 0 0 "[ . 1 . 2]" 1
783 1 69 GLN H 1 70 VAL MG2 . . 7.030 3.759 3.516 4.380 . 0 0 "[ . 1 . 2]" 1
784 1 69 GLN H 1 71 LYS H . . 4.380 3.589 3.407 3.880 . 0 0 "[ . 1 . 2]" 1
785 1 69 GLN HA 1 72 GLN QG . . 6.150 3.443 1.980 4.691 . 0 0 "[ . 1 . 2]" 1
786 1 69 GLN QB 1 70 VAL H . . 3.540 2.553 2.346 2.694 . 0 0 "[ . 1 . 2]" 1
787 1 69 GLN QB 1 70 VAL QG . . 7.120 2.931 2.833 3.098 . 0 0 "[ . 1 . 2]" 1
788 1 69 GLN QB 1 72 GLN QB . . 7.750 4.789 4.356 5.600 . 0 0 "[ . 1 . 2]" 1
789 1 69 GLN HB2 1 70 VAL H . . 3.760 2.688 2.458 2.852 . 0 0 "[ . 1 . 2]" 1
790 1 69 GLN HB3 1 70 VAL H . . 3.760 3.191 2.957 3.359 . 0 0 "[ . 1 . 2]" 1
791 1 69 GLN QG 1 70 VAL H . . 6.880 4.261 4.112 4.352 . 0 0 "[ . 1 . 2]" 1
792 1 70 VAL H 1 70 VAL HB . . 2.770 2.616 2.366 2.859 0.089 19 0 "[ . 1 . 2]" 1
793 1 70 VAL H 1 71 LYS H . . 3.160 2.533 2.390 2.742 . 0 0 "[ . 1 . 2]" 1
794 1 70 VAL H 1 71 LYS QB . . 6.190 4.226 4.057 4.447 . 0 0 "[ . 1 . 2]" 1
795 1 70 VAL H 1 72 GLN H . . 4.910 4.088 3.883 4.263 . 0 0 "[ . 1 . 2]" 1
796 1 70 VAL HA 1 71 LYS HA . . 4.710 4.731 4.702 4.763 0.053 15 0 "[ . 1 . 2]" 1
797 1 70 VAL HA 1 72 GLN H . . 4.190 3.674 3.407 4.032 . 0 0 "[ . 1 . 2]" 1
798 1 70 VAL HA 1 73 VAL H . . 4.610 3.322 3.103 3.566 . 0 0 "[ . 1 . 2]" 1
799 1 70 VAL HA 1 73 VAL HB . . 3.620 2.721 2.128 3.624 0.004 1 0 "[ . 1 . 2]" 1
800 1 70 VAL HB 1 71 LYS H . . 3.720 3.159 2.836 3.401 . 0 0 "[ . 1 . 2]" 1
801 1 70 VAL HB 1 72 GLN H . . 5.410 5.042 4.867 5.205 . 0 0 "[ . 1 . 2]" 1
802 1 70 VAL QG 1 71 LYS H . . 5.890 3.477 3.295 3.583 . 0 0 "[ . 1 . 2]" 1
803 1 70 VAL QG 1 71 LYS HA . . 6.810 3.963 3.374 4.193 . 0 0 "[ . 1 . 2]" 1
804 1 70 VAL QG 1 78 GLN HA . . 5.880 4.008 3.426 4.237 . 0 0 "[ . 1 . 2]" 1
805 1 70 VAL QG 1 114 CYS HA . . 6.670 4.410 4.208 4.670 . 0 0 "[ . 1 . 2]" 1
806 1 70 VAL QG 1 114 CYS QB . . 7.820 3.611 3.300 3.843 . 0 0 "[ . 1 . 2]" 1
807 1 70 VAL QG 1 115 GLY H . . 8.060 4.174 3.947 4.493 . 0 0 "[ . 1 . 2]" 1
808 1 70 VAL QG 1 117 ARG QB . . 8.740 4.129 3.884 4.392 . 0 0 "[ . 1 . 2]" 1
809 1 70 VAL MG1 1 71 LYS H . . 6.930 4.012 3.512 4.178 . 0 0 "[ . 1 . 2]" 1
810 1 70 VAL MG2 1 71 LYS H . . 6.930 3.832 3.596 3.989 . 0 0 "[ . 1 . 2]" 1
811 1 71 LYS H 1 71 LYS HB2 . . 4.190 2.277 2.067 2.575 . 0 0 "[ . 1 . 2]" 1
812 1 71 LYS H 1 71 LYS QB . . 3.440 2.170 2.047 2.253 . 0 0 "[ . 1 . 2]" 1
813 1 71 LYS H 1 71 LYS HB3 . . 4.190 2.816 2.487 3.287 . 0 0 "[ . 1 . 2]" 1
814 1 71 LYS H 1 71 LYS QD . . 5.460 4.214 3.466 4.586 . 0 0 "[ . 1 . 2]" 1
815 1 71 LYS H 1 71 LYS HG2 . . 4.980 4.463 3.664 4.665 . 0 0 "[ . 1 . 2]" 1
816 1 71 LYS H 1 71 LYS QG . . 4.640 3.891 3.367 4.037 . 0 0 "[ . 1 . 2]" 1
817 1 71 LYS H 1 71 LYS HG3 . . 4.980 4.302 3.927 4.492 . 0 0 "[ . 1 . 2]" 1
818 1 71 LYS H 1 72 GLN H . . 3.260 2.494 2.357 2.690 . 0 0 "[ . 1 . 2]" 1
819 1 71 LYS H 1 73 VAL H . . 4.120 3.984 3.789 4.121 0.001 15 0 "[ . 1 . 2]" 1
820 1 71 LYS HA 1 71 LYS QD . . 4.800 3.301 2.254 4.030 . 0 0 "[ . 1 . 2]" 1
821 1 71 LYS HA 1 73 VAL H . . 3.690 3.585 3.450 3.817 0.127 5 0 "[ . 1 . 2]" 1
822 1 71 LYS QB 1 72 GLN H . . 5.230 3.061 2.881 3.254 . 0 0 "[ . 1 . 2]" 1
823 1 71 LYS QB 1 73 VAL H . . 5.160 4.593 4.499 4.684 . 0 0 "[ . 1 . 2]" 1
824 1 71 LYS QG 1 72 GLN H . . 6.580 4.377 3.991 4.760 . 0 0 "[ . 1 . 2]" 1
825 1 72 GLN H 1 72 GLN HB2 . . 3.590 2.518 2.209 3.654 0.064 16 0 "[ . 1 . 2]" 1
826 1 72 GLN H 1 72 GLN QB . . 3.190 2.346 2.184 2.730 . 0 0 "[ . 1 . 2]" 1
827 1 72 GLN H 1 72 GLN HB3 . . 3.590 3.438 2.630 3.634 0.044 11 0 "[ . 1 . 2]" 1
828 1 72 GLN H 1 72 GLN HG2 . . 4.220 3.098 2.203 4.248 0.028 19 0 "[ . 1 . 2]" 1
829 1 72 GLN H 1 72 GLN QG . . 4.030 2.829 2.123 3.703 . 0 0 "[ . 1 . 2]" 1
830 1 72 GLN H 1 72 GLN HG3 . . 4.220 3.374 2.699 4.078 . 0 0 "[ . 1 . 2]" 1
831 1 72 GLN H 1 73 VAL H . . 2.830 2.475 2.306 2.627 . 0 0 "[ . 1 . 2]" 1
832 1 72 GLN H 1 73 VAL HA . . 4.650 4.747 4.648 4.901 0.251 15 0 "[ . 1 . 2]" 1
833 1 72 GLN H 1 73 VAL HB . . 4.450 4.228 3.960 4.610 0.160 7 0 "[ . 1 . 2]" 1
834 1 72 GLN H 1 73 VAL QG . . 7.070 4.069 3.239 4.479 . 0 0 "[ . 1 . 2]" 1
835 1 72 GLN HA 1 72 GLN QE . . 4.920 3.344 2.233 4.427 . 0 0 "[ . 1 . 2]" 1
836 1 72 GLN HA 1 72 GLN QG . . 3.840 2.451 1.956 3.360 . 0 0 "[ . 1 . 2]" 1
837 1 73 VAL H 1 73 VAL HB . . 3.000 2.212 2.092 2.330 . 0 0 "[ . 1 . 2]" 1
838 1 73 VAL H 1 73 VAL QG . . 4.140 2.449 2.167 2.666 . 0 0 "[ . 1 . 2]" 1
839 1 73 VAL H 1 74 ARG H . . 4.520 4.610 4.566 4.643 0.123 8 0 "[ . 1 . 2]" 1
840 1 73 VAL HA 1 74 ARG H . . 2.770 2.396 2.155 2.627 . 0 0 "[ . 1 . 2]" 1
841 1 73 VAL HA 1 74 ARG QG . . 6.880 4.037 3.331 5.360 . 0 0 "[ . 1 . 2]" 1
842 1 73 VAL HB 1 74 ARG H . . 4.810 3.935 3.747 4.272 . 0 0 "[ . 1 . 2]" 1
843 1 73 VAL QG 1 74 ARG H . . 5.010 1.879 1.445 2.421 . 0 0 "[ . 1 . 2]" 1
844 1 73 VAL QG 1 74 ARG HA . . 7.860 3.669 3.472 4.005 . 0 0 "[ . 1 . 2]" 1
845 1 73 VAL QG 1 75 ASP H . . 7.860 2.555 2.121 3.118 . 0 0 "[ . 1 . 2]" 1
846 1 73 VAL QG 1 77 CYS H . . 6.940 3.483 2.930 3.833 . 0 0 "[ . 1 . 2]" 1
847 1 73 VAL QG 1 77 CYS HA . . 8.260 4.678 4.118 4.921 . 0 0 "[ . 1 . 2]" 1
848 1 73 VAL QG 1 77 CYS QB . . 5.590 2.990 2.282 3.402 . 0 0 "[ . 1 . 2]" 1
849 1 73 VAL QG 1 78 GLN H . . 7.000 3.093 2.695 3.734 . 0 0 "[ . 1 . 2]" 1
850 1 73 VAL QG 1 81 ALA MB . . 7.470 3.114 2.679 3.510 . 0 0 "[ . 1 . 2]" 1
851 1 73 VAL MG1 1 74 ARG H . . 5.910 2.640 1.925 3.318 . 0 0 "[ . 1 . 2]" 1
852 1 73 VAL MG1 1 77 CYS HB2 . . 7.440 4.310 2.949 5.281 . 0 0 "[ . 1 . 2]" 1
853 1 73 VAL MG1 1 77 CYS HB3 . . 7.440 5.464 3.942 6.174 . 0 0 "[ . 1 . 2]" 1
854 1 73 VAL MG2 1 74 ARG H . . 5.910 2.241 1.453 3.756 . 0 0 "[ . 1 . 2]" 1
855 1 73 VAL MG2 1 77 CYS HB2 . . 7.440 3.497 2.461 5.112 . 0 0 "[ . 1 . 2]" 1
856 1 73 VAL MG2 1 77 CYS HB3 . . 7.440 4.338 2.733 5.706 . 0 0 "[ . 1 . 2]" 1
857 1 74 ARG H 1 74 ARG QG . . 4.960 2.578 1.972 3.816 . 0 0 "[ . 1 . 2]" 1
858 1 74 ARG H 1 75 ASP H . . 4.650 2.890 2.462 3.244 . 0 0 "[ . 1 . 2]" 1
859 1 74 ARG H 1 77 CYS H . . 4.550 4.121 3.654 4.771 0.221 19 0 "[ . 1 . 2]" 1
860 1 74 ARG H 1 77 CYS QB . . 5.730 3.152 2.805 3.806 . 0 0 "[ . 1 . 2]" 1
861 1 74 ARG QB 1 75 ASP H . . 4.430 2.058 1.825 2.279 . 0 0 "[ . 1 . 2]" 1
862 1 74 ARG QB 1 76 GLU H . . 5.390 2.835 2.430 3.718 . 0 0 "[ . 1 . 2]" 1
863 1 74 ARG QB 1 77 CYS H . . 5.260 2.704 2.302 4.039 . 0 0 "[ . 1 . 2]" 1
864 1 74 ARG QB 1 77 CYS QB . . 5.780 2.381 1.963 3.306 . 0 0 "[ . 1 . 2]" 1
865 1 74 ARG QD 1 75 ASP H . . 6.880 4.396 3.611 4.777 . 0 0 "[ . 1 . 2]" 1
866 1 74 ARG QG 1 75 ASP H . . 6.250 3.833 3.395 4.226 . 0 0 "[ . 1 . 2]" 1
867 1 74 ARG QG 1 76 GLU H . . 6.280 4.754 4.293 5.645 . 0 0 "[ . 1 . 2]" 1
868 1 74 ARG QG 1 77 CYS H . . 6.510 4.308 3.825 4.813 . 0 0 "[ . 1 . 2]" 1
869 1 74 ARG QG 1 77 CYS QB . . 7.760 2.897 2.243 3.930 . 0 0 "[ . 1 . 2]" 1
870 1 75 ASP H 1 76 GLU H . . 3.760 2.297 1.713 3.121 . 0 0 "[ . 1 . 2]" 1
871 1 75 ASP H 1 77 CYS H . . 4.320 2.237 2.096 2.707 . 0 0 "[ . 1 . 2]" 1
872 1 75 ASP H 1 78 GLN QE . . 6.870 4.637 3.635 6.301 . 0 0 "[ . 1 . 2]" 1
873 1 75 ASP HA 1 77 CYS H . . 4.850 4.259 3.980 4.668 . 0 0 "[ . 1 . 2]" 1
874 1 75 ASP HA 1 78 GLN QE . . 6.670 3.290 1.769 5.405 . 0 0 "[ . 1 . 2]" 1
875 1 75 ASP HA 1 78 GLN QG . . 4.730 3.978 3.442 4.391 . 0 0 "[ . 1 . 2]" 1
876 1 75 ASP QB 1 76 GLU H . . 4.370 2.672 1.874 3.230 . 0 0 "[ . 1 . 2]" 1
877 1 75 ASP QB 1 77 CYS H . . 6.810 4.257 3.593 4.680 . 0 0 "[ . 1 . 2]" 1
878 1 76 GLU H 1 76 GLU QG . . 4.700 2.462 2.000 4.162 . 0 0 "[ . 1 . 2]" 1
879 1 76 GLU H 1 77 CYS H . . 3.390 2.086 1.699 2.928 . 0 0 "[ . 1 . 2]" 1
880 1 76 GLU H 1 78 GLN H . . 4.850 3.828 3.494 4.763 . 0 0 "[ . 1 . 2]" 1
881 1 76 GLU HA 1 78 GLN H . . 5.470 3.430 3.140 3.759 . 0 0 "[ . 1 . 2]" 1
882 1 76 GLU HA 1 124 THR MG . . 7.030 4.955 1.772 5.795 . 0 0 "[ . 1 . 2]" 1
883 1 76 GLU QB 1 123 ARG HA . . 6.710 5.561 4.318 6.120 . 0 0 "[ . 1 . 2]" 1
884 1 76 GLU QG 1 77 CYS H . . 5.690 3.106 2.617 4.636 . 0 0 "[ . 1 . 2]" 1
885 1 76 GLU QG 1 77 CYS HA . . 5.890 3.968 3.473 5.345 . 0 0 "[ . 1 . 2]" 1
886 1 77 CYS H 1 77 CYS HB2 . . 3.490 2.483 2.129 2.952 . 0 0 "[ . 1 . 2]" 1
887 1 77 CYS H 1 77 CYS QB . . 3.260 2.439 2.109 2.837 . 0 0 "[ . 1 . 2]" 1
888 1 77 CYS H 1 77 CYS HB3 . . 3.490 3.613 3.426 3.669 0.179 11 0 "[ . 1 . 2]" 1
889 1 77 CYS H 1 78 GLN H . . 2.870 2.283 2.016 2.624 . 0 0 "[ . 1 . 2]" 1
890 1 77 CYS HA 1 78 GLN HA . . 5.270 4.847 4.754 4.933 . 0 0 "[ . 1 . 2]" 1
891 1 77 CYS HA 1 79 CYS H . . 5.210 4.145 3.257 5.143 . 0 0 "[ . 1 . 2]" 1
892 1 77 CYS HA 1 80 GLU H . . 4.120 3.514 3.261 3.915 . 0 0 "[ . 1 . 2]" 1
893 1 77 CYS HA 1 80 GLU HB2 . . 4.020 3.539 2.737 4.014 . 0 0 "[ . 1 . 2]" 1
894 1 77 CYS HA 1 80 GLU HB3 . . 3.990 2.728 2.006 3.873 . 0 0 "[ . 1 . 2]" 1
895 1 77 CYS HA 1 80 GLU QG . . 6.880 4.311 3.581 5.447 . 0 0 "[ . 1 . 2]" 1
896 1 77 CYS HA 1 81 ALA H . . 4.940 3.818 3.505 4.161 . 0 0 "[ . 1 . 2]" 1
897 1 77 CYS QB 1 78 GLN H . . 4.230 3.445 3.205 3.717 . 0 0 "[ . 1 . 2]" 1
898 1 77 CYS QB 1 81 ALA H . . 4.800 4.051 3.527 4.205 . 0 0 "[ . 1 . 2]" 1
899 1 77 CYS QB 1 81 ALA MB . . 7.910 3.438 2.982 3.939 . 0 0 "[ . 1 . 2]" 1
900 1 77 CYS HB2 1 78 GLN H . . 5.040 3.624 3.370 3.981 . 0 0 "[ . 1 . 2]" 1
901 1 77 CYS HB3 1 78 GLN H . . 5.040 4.324 3.981 4.526 . 0 0 "[ . 1 . 2]" 1
902 1 78 GLN H 1 78 GLN QG . . 4.960 2.504 1.984 3.366 . 0 0 "[ . 1 . 2]" 1
903 1 78 GLN H 1 79 CYS H . . 3.690 2.863 2.620 3.461 . 0 0 "[ . 1 . 2]" 1
904 1 78 GLN H 1 80 GLU H . . 5.210 4.554 4.089 5.144 . 0 0 "[ . 1 . 2]" 1
905 1 78 GLN HA 1 81 ALA H . . 3.790 3.802 3.724 3.991 0.201 12 0 "[ . 1 . 2]" 1
906 1 78 GLN HA 1 81 ALA MB . . 4.490 2.696 2.239 3.085 . 0 0 "[ . 1 . 2]" 1
907 1 78 GLN HA 1 117 ARG QB . . 5.850 3.748 2.946 4.456 . 0 0 "[ . 1 . 2]" 1
908 1 78 GLN QB 1 79 CYS HB3 . . 6.880 5.259 3.809 6.082 . 0 0 "[ . 1 . 2]" 1
909 1 78 GLN QG 1 79 CYS H . . 5.690 3.035 1.857 4.417 . 0 0 "[ . 1 . 2]" 1
910 1 78 GLN QG 1 117 ARG H . . 6.880 5.942 5.001 6.353 . 0 0 "[ . 1 . 2]" 1
911 1 78 GLN QG 1 117 ARG QB . . 5.340 3.212 2.147 4.178 . 0 0 "[ . 1 . 2]" 1
912 1 78 GLN QG 1 124 THR HB . . 6.880 5.867 4.764 6.279 . 0 0 "[ . 1 . 2]" 1
913 1 78 GLN QG 1 125 ASN H . . 5.290 4.473 3.764 4.875 . 0 0 "[ . 1 . 2]" 1
914 1 79 CYS CB 1 118 CYS SG . . 3.100 2.928 2.846 3.017 . 0 0 "[ . 1 . 2]" 1
915 1 79 CYS H 1 79 CYS HB2 . . 3.490 2.385 2.022 3.226 . 0 0 "[ . 1 . 2]" 1
916 1 79 CYS H 1 79 CYS HB3 . . 3.510 2.899 2.082 3.513 0.003 15 0 "[ . 1 . 2]" 1
917 1 79 CYS H 1 80 GLU H . . 3.160 2.788 2.550 3.010 . 0 0 "[ . 1 . 2]" 1
918 1 79 CYS H 1 117 ARG QB . . 5.990 3.424 2.948 3.806 . 0 0 "[ . 1 . 2]" 1
919 1 79 CYS HA 1 82 ILE H . . 4.450 3.358 3.108 3.664 . 0 0 "[ . 1 . 2]" 1
920 1 79 CYS HA 1 82 ILE HB . . 3.360 3.144 2.447 3.518 0.158 13 0 "[ . 1 . 2]" 1
921 1 79 CYS HA 1 117 ARG HA . . 4.520 4.203 3.888 4.495 . 0 0 "[ . 1 . 2]" 1
922 1 79 CYS HA 1 117 ARG QB . . 6.120 2.252 1.955 2.610 . 0 0 "[ . 1 . 2]" 1
923 1 79 CYS HA 1 118 CYS H . . 5.180 2.860 2.189 3.396 . 0 0 "[ . 1 . 2]" 1
924 1 79 CYS HA 1 118 CYS HA . . 4.550 3.863 3.450 4.174 . 0 0 "[ . 1 . 2]" 1
925 1 79 CYS HB2 1 80 GLU H . . 3.660 3.110 2.488 3.879 0.219 20 0 "[ . 1 . 2]" 1
926 1 79 CYS HB2 1 81 ALA H . . 4.860 5.089 4.770 5.395 0.535 5 4 "[ + 1 *. * -]" 1
927 1 79 CYS HB2 1 118 CYS HA . . 4.920 4.351 2.938 5.050 0.130 15 0 "[ . 1 . 2]" 1
928 1 79 CYS HB3 1 80 GLU H . . 3.950 2.437 1.984 3.024 . 0 0 "[ . 1 . 2]" 1
929 1 79 CYS HB3 1 81 ALA H . . 5.240 4.710 4.405 5.284 0.044 15 0 "[ . 1 . 2]" 1
930 1 79 CYS HB3 1 118 CYS H . . 6.000 5.253 4.560 5.668 . 0 0 "[ . 1 . 2]" 1
931 1 79 CYS HB3 1 118 CYS HA . . 4.510 4.717 4.588 4.897 0.387 8 0 "[ . 1 . 2]" 1
932 1 79 CYS HB3 1 122 THR HA . . 6.000 5.276 3.929 6.058 0.058 12 0 "[ . 1 . 2]" 1
933 1 79 CYS SG 1 118 CYS CB . . 3.100 2.946 2.798 3.130 0.030 14 0 "[ . 1 . 2]" 1
934 1 79 CYS SG 1 118 CYS SG . . 2.100 2.007 1.916 2.091 . 0 0 "[ . 1 . 2]" 1
935 1 80 GLU H 1 80 GLU HB2 . . 3.130 2.386 2.081 2.681 . 0 0 "[ . 1 . 2]" 1
936 1 80 GLU H 1 80 GLU HB3 . . 3.230 2.708 2.322 3.200 . 0 0 "[ . 1 . 2]" 1
937 1 80 GLU H 1 82 ILE H . . 5.010 4.639 4.424 4.935 . 0 0 "[ . 1 . 2]" 1
938 1 80 GLU HA 1 80 GLU HB2 . . 2.930 2.501 2.327 2.773 . 0 0 "[ . 1 . 2]" 1
939 1 80 GLU HA 1 82 ILE H . . 4.610 4.568 4.233 4.923 0.313 10 0 "[ . 1 . 2]" 1
940 1 80 GLU HA 1 83 LYS H . . 3.990 3.213 2.926 3.608 . 0 0 "[ . 1 . 2]" 1
941 1 80 GLU HA 1 83 LYS QB . . 3.810 2.348 1.966 2.886 . 0 0 "[ . 1 . 2]" 1
942 1 80 GLU HA 1 83 LYS QD . . 5.890 3.864 2.970 4.417 . 0 0 "[ . 1 . 2]" 1
943 1 80 GLU HB3 1 81 ALA H . . 3.560 2.875 2.503 3.242 . 0 0 "[ . 1 . 2]" 1
944 1 80 GLU QG 1 81 ALA H . . 6.120 3.946 3.477 4.592 . 0 0 "[ . 1 . 2]" 1
945 1 80 GLU QG 1 81 ALA MB . . 7.900 4.743 4.200 5.411 . 0 0 "[ . 1 . 2]" 1
946 1 80 GLU QG 1 84 TYR H . . 6.880 4.797 4.172 5.480 . 0 0 "[ . 1 . 2]" 1
947 1 80 GLU QG 1 84 TYR QD . . 9.020 5.192 4.114 5.683 . 0 0 "[ . 1 . 2]" 1
948 1 80 GLU QG 1 84 TYR QE . . 9.010 6.847 5.811 7.368 . 0 0 "[ . 1 . 2]" 1
949 1 81 ALA H 1 82 ILE H . . 3.200 2.858 2.647 3.137 . 0 0 "[ . 1 . 2]" 1
950 1 81 ALA H 1 82 ILE MD . . 7.030 5.723 5.206 6.108 . 0 0 "[ . 1 . 2]" 1
951 1 81 ALA H 1 83 LYS H . . 4.350 4.022 3.717 4.477 0.127 8 0 "[ . 1 . 2]" 1
952 1 81 ALA H 1 84 TYR H . . 4.910 4.879 4.678 5.048 0.138 16 0 "[ . 1 . 2]" 1
953 1 81 ALA HA 1 82 ILE H . . 3.620 3.588 3.543 3.643 0.023 4 0 "[ . 1 . 2]" 1
954 1 81 ALA HA 1 83 LYS H . . 4.610 4.373 4.099 4.741 0.131 15 0 "[ . 1 . 2]" 1
955 1 81 ALA HA 1 84 TYR H . . 3.760 3.531 3.321 3.814 0.054 12 0 "[ . 1 . 2]" 1
956 1 81 ALA HA 1 84 TYR QB . . 4.270 2.458 1.980 2.998 . 0 0 "[ . 1 . 2]" 1
957 1 81 ALA HA 1 84 TYR QD . . 7.740 3.349 2.206 4.742 . 0 0 "[ . 1 . 2]" 1
958 1 81 ALA MB 1 82 ILE H . . 4.290 2.335 2.105 2.544 . 0 0 "[ . 1 . 2]" 1
959 1 81 ALA MB 1 82 ILE HA . . 5.540 3.891 3.846 3.973 . 0 0 "[ . 1 . 2]" 1
960 1 82 ILE H 1 82 ILE HB . . 3.000 2.285 2.006 2.543 . 0 0 "[ . 1 . 2]" 1
961 1 82 ILE H 1 82 ILE MD . . 5.340 3.459 2.739 3.787 . 0 0 "[ . 1 . 2]" 1
962 1 82 ILE H 1 83 LYS H . . 3.160 2.769 2.509 2.956 . 0 0 "[ . 1 . 2]" 1
963 1 82 ILE H 1 83 LYS QB . . 5.990 4.592 4.181 5.026 . 0 0 "[ . 1 . 2]" 1
964 1 82 ILE H 1 84 TYR H . . 4.980 3.930 3.681 4.102 . 0 0 "[ . 1 . 2]" 1
965 1 82 ILE H 1 111 VAL QG . . 8.590 6.171 5.957 6.378 . 0 0 "[ . 1 . 2]" 1
966 1 82 ILE HA 1 82 ILE MD . . 3.990 2.076 1.663 3.545 . 0 0 "[ . 1 . 2]" 1
967 1 82 ILE HA 1 83 LYS QD . . 6.880 4.793 4.340 5.562 . 0 0 "[ . 1 . 2]" 1
968 1 82 ILE HA 1 84 TYR H . . 5.110 3.529 3.386 3.723 . 0 0 "[ . 1 . 2]" 1
969 1 82 ILE HA 1 85 ILE H . . 3.950 3.525 3.242 4.101 0.151 9 0 "[ . 1 . 2]" 1
970 1 82 ILE HA 1 85 ILE QG . . 5.730 4.714 2.081 5.119 . 0 0 "[ . 1 . 2]" 1
971 1 82 ILE HA 1 86 ALA H . . 5.640 2.791 2.157 3.448 . 0 0 "[ . 1 . 2]" 1
972 1 82 ILE HA 1 86 ALA MB . . 6.760 3.079 2.421 3.700 . 0 0 "[ . 1 . 2]" 1
973 1 82 ILE HA 1 107 ALA MB . . 7.030 5.449 5.079 5.683 . 0 0 "[ . 1 . 2]" 1
974 1 82 ILE HA 1 117 ARG QB . . 5.790 4.993 4.683 5.253 . 0 0 "[ . 1 . 2]" 1
975 1 82 ILE HB 1 83 LYS H . . 3.560 2.876 2.390 3.485 . 0 0 "[ . 1 . 2]" 1
976 1 82 ILE HB 1 84 TYR H . . 5.180 4.776 4.484 5.173 . 0 0 "[ . 1 . 2]" 1
977 1 82 ILE HB 1 118 CYS QB . . 6.390 2.358 1.939 3.578 . 0 0 "[ . 1 . 2]" 1
978 1 82 ILE MD 1 83 LYS H . . 7.030 4.746 4.454 5.082 . 0 0 "[ . 1 . 2]" 1
979 1 82 ILE MD 1 117 ARG QD . . 5.890 3.761 1.854 4.328 . 0 0 "[ . 1 . 2]" 1
980 1 82 ILE QG 1 83 LYS H . . 6.780 4.274 3.844 4.660 . 0 0 "[ . 1 . 2]" 1
981 1 82 ILE MG 1 83 LYS H . . 5.740 3.136 2.554 3.683 . 0 0 "[ . 1 . 2]" 1
982 1 82 ILE MG 1 86 ALA H . . 7.030 3.524 2.966 3.992 . 0 0 "[ . 1 . 2]" 1
983 1 82 ILE MG 1 107 ALA MB . . 5.710 3.866 3.781 3.943 . 0 0 "[ . 1 . 2]" 1
984 1 82 ILE MG 1 118 CYS QB . . 6.420 2.538 2.045 2.993 . 0 0 "[ . 1 . 2]" 1
985 1 82 ILE MG 1 119 MET H . . 6.900 3.158 2.609 3.844 . 0 0 "[ . 1 . 2]" 1
986 1 83 LYS H 1 83 LYS QD . . 5.490 2.585 1.912 3.462 . 0 0 "[ . 1 . 2]" 1
987 1 83 LYS H 1 83 LYS QE . . 6.880 4.380 3.316 5.095 . 0 0 "[ . 1 . 2]" 1
988 1 83 LYS H 1 84 TYR H . . 3.160 2.632 2.519 2.763 . 0 0 "[ . 1 . 2]" 1
989 1 83 LYS H 1 84 TYR QB . . 6.120 4.150 3.981 4.326 . 0 0 "[ . 1 . 2]" 1
990 1 83 LYS HA 1 83 LYS HD2 . . 4.680 2.417 2.053 4.228 . 0 0 "[ . 1 . 2]" 1
991 1 83 LYS HA 1 83 LYS QD . . 4.060 2.318 2.041 3.379 . 0 0 "[ . 1 . 2]" 1
992 1 83 LYS HA 1 83 LYS HD3 . . 4.680 3.477 2.699 3.708 . 0 0 "[ . 1 . 2]" 1
993 1 83 LYS HA 1 86 ALA MB . . 5.110 3.569 2.970 4.014 . 0 0 "[ . 1 . 2]" 1
994 1 83 LYS QB 1 84 TYR H . . 4.340 3.307 3.162 3.445 . 0 0 "[ . 1 . 2]" 1
995 1 83 LYS QB 1 84 TYR QD . . 9.020 5.616 5.371 5.743 . 0 0 "[ . 1 . 2]" 1
996 1 83 LYS QD 1 84 TYR H . . 6.880 4.468 4.137 4.972 . 0 0 "[ . 1 . 2]" 1
997 1 83 LYS QD 1 87 GLU QB . . 7.160 4.697 3.335 5.565 . 0 0 "[ . 1 . 2]" 1
998 1 83 LYS QD 1 119 MET H . . 6.480 5.679 5.331 5.923 . 0 0 "[ . 1 . 2]" 1
999 1 83 LYS QG 1 84 TYR H . . 6.880 4.695 4.198 4.894 . 0 0 "[ . 1 . 2]" 1
1000 1 84 TYR H 1 85 ILE H . . 3.330 2.445 2.297 2.903 . 0 0 "[ . 1 . 2]" 1
1001 1 84 TYR H 1 85 ILE MD . . 7.030 5.852 4.078 6.117 . 0 0 "[ . 1 . 2]" 1
1002 1 84 TYR H 1 85 ILE QG . . 6.880 5.778 2.805 6.170 . 0 0 "[ . 1 . 2]" 1
1003 1 84 TYR H 1 85 ILE MG . . 6.270 3.457 2.914 5.030 . 0 0 "[ . 1 . 2]" 1
1004 1 84 TYR H 1 86 ALA H . . 4.480 3.664 3.168 4.187 . 0 0 "[ . 1 . 2]" 1
1005 1 84 TYR HA 1 88 ASP H . . 3.690 3.812 3.439 3.984 0.294 17 0 "[ . 1 . 2]" 1
1006 1 84 TYR QB 1 85 ILE H . . 4.270 2.695 2.031 3.803 . 0 0 "[ . 1 . 2]" 1
1007 1 84 TYR QB 1 85 ILE QG . . 7.760 5.434 2.772 5.834 . 0 0 "[ . 1 . 2]" 1
1008 1 84 TYR QB 1 85 ILE MG . . 5.990 3.803 3.398 4.208 . 0 0 "[ . 1 . 2]" 1
1009 1 84 TYR QB 1 86 ALA H . . 6.580 4.760 4.315 5.367 . 0 0 "[ . 1 . 2]" 1
1010 1 84 TYR QD 1 85 ILE H . . 7.970 3.118 2.078 4.826 . 0 0 "[ . 1 . 2]" 1
1011 1 84 TYR QD 1 85 ILE HA . . 6.420 3.708 2.616 4.998 . 0 0 "[ . 1 . 2]" 1
1012 1 84 TYR QD 1 85 ILE MD . . 9.170 4.144 3.114 5.293 . 0 0 "[ . 1 . 2]" 1
1013 1 84 TYR QD 1 85 ILE HG12 . . 8.140 5.103 2.865 6.807 . 0 0 "[ . 1 . 2]" 1
1014 1 84 TYR QD 1 85 ILE QG . . 7.280 4.541 2.828 5.753 . 0 0 "[ . 1 . 2]" 1
1015 1 84 TYR QD 1 85 ILE HG13 . . 8.140 5.263 4.177 6.483 . 0 0 "[ . 1 . 2]" 1
1016 1 84 TYR QD 1 85 ILE MG . . 7.190 3.682 2.956 4.425 . 0 0 "[ . 1 . 2]" 1
1017 1 84 TYR QD 1 86 ALA MB . . 9.170 6.263 5.760 7.025 . 0 0 "[ . 1 . 2]" 1
1018 1 84 TYR QD 1 88 ASP QB . . 9.020 3.782 2.730 4.451 . 0 0 "[ . 1 . 2]" 1
1019 1 84 TYR QE 1 85 ILE HA . . 7.970 4.360 3.603 5.845 . 0 0 "[ . 1 . 2]" 1
1020 1 84 TYR QE 1 85 ILE MD . . 9.160 4.088 2.913 5.897 . 0 0 "[ . 1 . 2]" 1
1021 1 84 TYR QE 1 85 ILE QG . . 8.980 4.839 3.457 6.448 . 0 0 "[ . 1 . 2]" 1
1022 1 84 TYR QE 1 85 ILE MG . . 8.140 4.953 3.877 5.771 . 0 0 "[ . 1 . 2]" 1
1023 1 84 TYR QE 1 88 ASP QB . . 9.010 4.113 3.306 5.256 . 0 0 "[ . 1 . 2]" 1
1024 1 85 ILE H 1 85 ILE HB . . 3.790 2.733 2.201 3.691 . 0 0 "[ . 1 . 2]" 1
1025 1 85 ILE H 1 85 ILE MD . . 5.580 4.250 3.892 4.852 . 0 0 "[ . 1 . 2]" 1
1026 1 85 ILE H 1 85 ILE QG . . 4.440 3.964 2.519 4.176 . 0 0 "[ . 1 . 2]" 1
1027 1 85 ILE H 1 86 ALA H . . 3.290 2.547 1.865 2.859 . 0 0 "[ . 1 . 2]" 1
1028 1 85 ILE HA 1 85 ILE HG12 . . 3.640 3.322 2.669 3.711 0.071 8 0 "[ . 1 . 2]" 1
1029 1 85 ILE HA 1 85 ILE QG . . 3.240 2.671 2.200 3.114 . 0 0 "[ . 1 . 2]" 1
1030 1 85 ILE HA 1 85 ILE HG13 . . 3.640 2.907 2.274 3.656 0.016 12 0 "[ . 1 . 2]" 1
1031 1 85 ILE HA 1 88 ASP H . . 3.690 3.613 3.229 3.767 0.077 6 0 "[ . 1 . 2]" 1
1032 1 85 ILE HA 1 88 ASP QB . . 4.240 2.669 1.978 3.145 . 0 0 "[ . 1 . 2]" 1
1033 1 85 ILE HB 1 86 ALA H . . 4.220 3.731 3.137 4.005 . 0 0 "[ . 1 . 2]" 1
1034 1 85 ILE MD 1 86 ALA H . . 5.380 4.265 3.478 4.670 . 0 0 "[ . 1 . 2]" 1
1035 1 85 ILE MD 1 89 GLN H . . 7.030 4.377 3.096 5.932 . 0 0 "[ . 1 . 2]" 1
1036 1 85 ILE QG 1 86 ALA H . . 6.150 3.619 2.592 4.412 . 0 0 "[ . 1 . 2]" 1
1037 1 85 ILE QG 1 88 ASP QB . . 7.560 4.466 3.348 5.204 . 0 0 "[ . 1 . 2]" 1
1038 1 85 ILE MG 1 86 ALA H . . 5.210 1.950 1.538 4.268 . 0 0 "[ . 1 . 2]" 1
1039 1 85 ILE MG 1 107 ALA MB . . 6.870 4.383 3.744 4.749 . 0 0 "[ . 1 . 2]" 1
1040 1 86 ALA H 1 86 ALA HA . . 2.870 2.844 2.783 2.886 0.016 19 0 "[ . 1 . 2]" 1
1041 1 86 ALA H 1 87 GLU H . . 3.510 3.140 2.622 3.484 . 0 0 "[ . 1 . 2]" 1
1042 1 86 ALA H 1 89 GLN H . . 6.000 5.160 4.427 5.699 . 0 0 "[ . 1 . 2]" 1
1043 1 86 ALA HA 1 87 GLU H . . 3.560 3.085 2.557 3.604 0.044 6 0 "[ . 1 . 2]" 1
1044 1 86 ALA HA 1 89 GLN H . . 4.650 4.461 3.960 4.850 0.200 9 0 "[ . 1 . 2]" 1
1045 1 86 ALA MB 1 87 GLU H . . 4.320 3.004 1.902 3.750 . 0 0 "[ . 1 . 2]" 1
1046 1 86 ALA MB 1 89 GLN H . . 7.030 5.455 4.729 5.913 . 0 0 "[ . 1 . 2]" 1
1047 1 86 ALA MB 1 90 ILE MD . . 6.740 3.128 1.948 4.401 . 0 0 "[ . 1 . 2]" 1
1048 1 86 ALA MB 1 119 MET QB . . 7.210 4.600 3.585 5.272 . 0 0 "[ . 1 . 2]" 1
1049 1 87 GLU H 1 87 GLU HB2 . . 3.230 2.804 2.113 3.333 0.103 16 0 "[ . 1 . 2]" 1
1050 1 87 GLU H 1 87 GLU HB3 . . 3.230 3.119 2.652 3.375 0.145 16 0 "[ . 1 . 2]" 1
1051 1 87 GLU H 1 87 GLU QG . . 5.030 4.090 3.620 4.381 . 0 0 "[ . 1 . 2]" 1
1052 1 87 GLU H 1 88 ASP H . . 2.770 2.407 1.862 2.824 0.054 11 0 "[ . 1 . 2]" 1
1053 1 87 GLU HA 1 90 ILE H . . 3.990 3.322 2.918 3.747 . 0 0 "[ . 1 . 2]" 1
1054 1 87 GLU HA 1 90 ILE HB . . 3.200 2.347 1.992 3.147 . 0 0 "[ . 1 . 2]" 1
1055 1 87 GLU HA 1 90 ILE MD . . 5.940 2.068 1.402 3.722 . 0 0 "[ . 1 . 2]" 1
1056 1 87 GLU HB2 1 88 ASP H . . 4.020 3.608 3.435 3.930 . 0 0 "[ . 1 . 2]" 1
1057 1 87 GLU HB3 1 88 ASP H . . 4.020 2.633 2.249 3.131 . 0 0 "[ . 1 . 2]" 1
1058 1 87 GLU QG 1 88 ASP H . . 5.260 4.139 3.789 4.455 . 0 0 "[ . 1 . 2]" 1
1059 1 88 ASP H 1 88 ASP QB . . 3.910 2.163 2.066 2.243 . 0 0 "[ . 1 . 2]" 1
1060 1 88 ASP H 1 89 GLN H . . 3.290 2.813 2.531 3.143 . 0 0 "[ . 1 . 2]" 1
1061 1 88 ASP H 1 90 ILE MD . . 6.500 4.695 4.203 5.340 . 0 0 "[ . 1 . 2]" 1
1062 1 88 ASP HA 1 89 GLN QG . . 6.880 5.215 4.943 5.565 . 0 0 "[ . 1 . 2]" 1
1063 1 88 ASP HA 1 91 GLN H . . 4.250 3.603 3.377 3.867 . 0 0 "[ . 1 . 2]" 1
1064 1 88 ASP HA 1 91 GLN QB . . 4.470 3.288 2.884 4.045 . 0 0 "[ . 1 . 2]" 1
1065 1 88 ASP HA 1 92 GLN H . . 4.380 4.114 3.871 4.321 . 0 0 "[ . 1 . 2]" 1
1066 1 88 ASP QB 1 89 GLN H . . 4.430 2.279 2.014 2.784 . 0 0 "[ . 1 . 2]" 1
1067 1 89 GLN H 1 89 GLN HB2 . . 3.660 3.572 3.509 3.621 . 0 0 "[ . 1 . 2]" 1
1068 1 89 GLN H 1 89 GLN QB . . 3.230 2.418 2.233 2.585 . 0 0 "[ . 1 . 2]" 1
1069 1 89 GLN H 1 89 GLN HB3 . . 3.660 2.461 2.258 2.652 . 0 0 "[ . 1 . 2]" 1
1070 1 89 GLN H 1 89 GLN HE21 . . 6.000 4.355 3.171 5.304 . 0 0 "[ . 1 . 2]" 1
1071 1 89 GLN H 1 89 GLN QE . . 5.400 4.201 3.132 5.011 . 0 0 "[ . 1 . 2]" 1
1072 1 89 GLN H 1 89 GLN HE22 . . 6.000 5.644 4.861 6.163 0.163 13 0 "[ . 1 . 2]" 1
1073 1 89 GLN H 1 89 GLN QG . . 4.670 2.322 1.951 2.805 . 0 0 "[ . 1 . 2]" 1
1074 1 89 GLN H 1 90 ILE H . . 3.230 2.712 2.517 2.853 . 0 0 "[ . 1 . 2]" 1
1075 1 89 GLN HA 1 89 GLN HE21 . . 6.000 4.594 3.709 5.458 . 0 0 "[ . 1 . 2]" 1
1076 1 89 GLN HA 1 89 GLN HE22 . . 6.000 5.780 5.342 5.971 . 0 0 "[ . 1 . 2]" 1
1077 1 89 GLN HA 1 89 GLN QG . . 3.750 3.325 3.250 3.376 . 0 0 "[ . 1 . 2]" 1
1078 1 89 GLN HA 1 92 GLN H . . 3.890 3.128 2.737 3.300 . 0 0 "[ . 1 . 2]" 1
1079 1 89 GLN HA 1 92 GLN HB2 . . 2.770 2.746 2.291 2.894 0.124 8 0 "[ . 1 . 2]" 1
1080 1 89 GLN HA 1 92 GLN HB3 . . 2.770 2.604 2.058 2.821 0.051 18 0 "[ . 1 . 2]" 1
1081 1 89 GLN HA 1 93 GLY H . . 4.350 2.884 2.696 3.139 . 0 0 "[ . 1 . 2]" 1
1082 1 89 GLN QB 1 90 ILE H . . 4.170 3.545 3.368 3.727 . 0 0 "[ . 1 . 2]" 1
1083 1 89 GLN QB 1 93 GLY H . . 4.370 3.773 3.645 3.862 . 0 0 "[ . 1 . 2]" 1
1084 1 89 GLN QE 1 103 VAL QG . . 8.990 3.270 1.875 4.892 . 0 0 "[ . 1 . 2]" 1
1085 1 89 GLN QG 1 90 ILE H . . 6.880 2.172 1.893 2.496 . 0 0 "[ . 1 . 2]" 1
1086 1 89 GLN QG 1 90 ILE MG . . 7.580 4.580 4.240 4.997 . 0 0 "[ . 1 . 2]" 1
1087 1 90 ILE H 1 90 ILE HB . . 2.870 2.379 2.136 2.626 . 0 0 "[ . 1 . 2]" 1
1088 1 90 ILE H 1 90 ILE MD . . 4.290 3.327 2.783 3.672 . 0 0 "[ . 1 . 2]" 1
1089 1 90 ILE H 1 91 GLN H . . 3.820 2.684 2.499 2.865 . 0 0 "[ . 1 . 2]" 1
1090 1 90 ILE H 1 92 GLN H . . 5.700 3.920 3.684 4.393 . 0 0 "[ . 1 . 2]" 1
1091 1 90 ILE HA 1 93 GLY H . . 4.320 4.180 3.899 4.498 0.178 8 0 "[ . 1 . 2]" 1
1092 1 90 ILE HA 1 95 LEU H . . 3.720 3.738 3.625 3.811 0.091 9 0 "[ . 1 . 2]" 1
1093 1 90 ILE HA 1 95 LEU HA . . 4.780 4.763 4.662 4.852 0.072 7 0 "[ . 1 . 2]" 1
1094 1 90 ILE HA 1 95 LEU QB . . 5.160 1.949 1.890 1.994 . 0 0 "[ . 1 . 2]" 1
1095 1 90 ILE HA 1 95 LEU MD1 . . 6.470 3.877 3.639 4.150 . 0 0 "[ . 1 . 2]" 1
1096 1 90 ILE HA 1 95 LEU QD . . 5.080 1.916 1.643 3.259 . 0 0 "[ . 1 . 2]" 1
1097 1 90 ILE HA 1 95 LEU MD2 . . 6.470 1.938 1.645 3.427 . 0 0 "[ . 1 . 2]" 1
1098 1 90 ILE HA 1 95 LEU HG . . 3.100 2.440 2.016 2.995 . 0 0 "[ . 1 . 2]" 1
1099 1 90 ILE HB 1 91 GLN H . . 3.430 2.659 2.445 3.002 . 0 0 "[ . 1 . 2]" 1
1100 1 90 ILE HB 1 91 GLN QG . . 5.330 3.637 2.899 4.388 . 0 0 "[ . 1 . 2]" 1
1101 1 90 ILE HB 1 95 LEU QB . . 4.700 4.022 3.847 4.139 . 0 0 "[ . 1 . 2]" 1
1102 1 90 ILE HB 1 103 VAL QG . . 8.120 4.275 3.724 5.034 . 0 0 "[ . 1 . 2]" 1
1103 1 90 ILE MD 1 91 GLN H . . 5.540 4.532 4.427 4.637 . 0 0 "[ . 1 . 2]" 1
1104 1 90 ILE MD 1 103 VAL H . . 6.430 4.708 4.056 5.312 . 0 0 "[ . 1 . 2]" 1
1105 1 90 ILE MD 1 104 ALA H . . 7.030 4.153 3.043 4.747 . 0 0 "[ . 1 . 2]" 1
1106 1 90 ILE MD 1 104 ALA MB . . 6.410 3.814 2.858 4.225 . 0 0 "[ . 1 . 2]" 1
1107 1 90 ILE MG 1 91 GLN H . . 4.550 3.274 2.813 3.624 . 0 0 "[ . 1 . 2]" 1
1108 1 90 ILE MG 1 91 GLN HA . . 5.180 3.452 3.115 3.917 . 0 0 "[ . 1 . 2]" 1
1109 1 90 ILE MG 1 95 LEU H . . 6.700 4.231 3.963 4.410 . 0 0 "[ . 1 . 2]" 1
1110 1 90 ILE MG 1 95 LEU HA . . 7.030 4.287 4.008 4.675 . 0 0 "[ . 1 . 2]" 1
1111 1 90 ILE MG 1 95 LEU QB . . 4.810 2.029 1.718 2.344 . 0 0 "[ . 1 . 2]" 1
1112 1 90 ILE MG 1 96 HIS HA . . 7.030 4.084 3.349 4.532 . 0 0 "[ . 1 . 2]" 1
1113 1 90 ILE MG 1 96 HIS HD2 . . 7.030 4.288 2.497 5.757 . 0 0 "[ . 1 . 2]" 1
1114 1 90 ILE MG 1 103 VAL H . . 6.570 5.151 4.442 5.392 . 0 0 "[ . 1 . 2]" 1
1115 1 91 GLN H 1 91 GLN QG . . 4.270 2.629 1.977 3.401 . 0 0 "[ . 1 . 2]" 1
1116 1 91 GLN H 1 92 GLN H . . 2.960 2.490 2.219 2.699 . 0 0 "[ . 1 . 2]" 1
1117 1 91 GLN H 1 93 GLY H . . 4.220 4.417 4.202 4.595 0.375 8 0 "[ . 1 . 2]" 1
1118 1 91 GLN HA 1 91 GLN QG . . 3.470 2.324 1.982 3.306 . 0 0 "[ . 1 . 2]" 1
1119 1 91 GLN QB 1 96 HIS HE1 . . 6.880 4.440 3.289 6.122 . 0 0 "[ . 1 . 2]" 1
1120 1 91 GLN QG 1 92 GLN H . . 6.220 4.121 2.324 4.554 . 0 0 "[ . 1 . 2]" 1
1121 1 92 GLN H 1 92 GLN HB2 . . 3.100 2.192 2.074 2.341 . 0 0 "[ . 1 . 2]" 1
1122 1 92 GLN H 1 92 GLN QB . . 2.890 2.135 2.041 2.220 . 0 0 "[ . 1 . 2]" 1
1123 1 92 GLN H 1 92 GLN HB3 . . 3.100 2.972 2.755 3.094 . 0 0 "[ . 1 . 2]" 1
1124 1 92 GLN H 1 92 GLN HG2 . . 4.780 4.462 4.060 4.667 . 0 0 "[ . 1 . 2]" 1
1125 1 92 GLN H 1 92 GLN QG . . 4.410 3.868 3.691 4.003 . 0 0 "[ . 1 . 2]" 1
1126 1 92 GLN H 1 92 GLN HG3 . . 4.780 4.283 3.967 4.601 . 0 0 "[ . 1 . 2]" 1
1127 1 92 GLN H 1 93 GLY H . . 3.130 2.705 2.523 2.967 . 0 0 "[ . 1 . 2]" 1
1128 1 92 GLN QB 1 93 GLY H . . 4.270 2.226 2.133 2.397 . 0 0 "[ . 1 . 2]" 1
1129 1 93 GLY H 1 95 LEU QD . . 6.750 2.852 2.371 3.896 . 0 0 "[ . 1 . 2]" 1
1130 1 93 GLY QA 1 95 LEU QD . . 7.070 1.961 1.831 2.299 . 0 0 "[ . 1 . 2]" 1
1131 1 93 GLY QA 1 95 LEU HG . . 5.860 4.390 4.145 4.536 . 0 0 "[ . 1 . 2]" 1
1132 1 93 GLY QA 1 103 VAL QG . . 9.000 4.875 4.560 5.201 . 0 0 "[ . 1 . 2]" 1
1133 1 93 GLY HA2 1 95 LEU MD1 . . 9.050 5.031 4.633 6.324 . 0 0 "[ . 1 . 2]" 1
1134 1 93 GLY HA2 1 95 LEU MD2 . . 9.050 3.279 3.149 3.665 . 0 0 "[ . 1 . 2]" 1
1135 1 93 GLY HA3 1 95 LEU MD1 . . 9.050 3.855 3.349 5.112 . 0 0 "[ . 1 . 2]" 1
1136 1 93 GLY HA3 1 95 LEU MD2 . . 9.050 1.985 1.849 2.328 . 0 0 "[ . 1 . 2]" 1
1137 1 94 GLN H 1 94 GLN HA . . 2.870 2.908 2.874 2.924 0.054 20 0 "[ . 1 . 2]" 1
1138 1 94 GLN H 1 94 GLN QG . . 5.090 3.440 2.180 3.800 . 0 0 "[ . 1 . 2]" 1
1139 1 94 GLN H 1 95 LEU H . . 3.360 3.259 2.848 3.560 0.200 1 0 "[ . 1 . 2]" 1
1140 1 94 GLN H 1 95 LEU QD . . 8.430 2.558 2.339 2.742 . 0 0 "[ . 1 . 2]" 1
1141 1 94 GLN H 1 95 LEU HG . . 5.600 5.411 5.079 5.676 0.076 8 0 "[ . 1 . 2]" 1
1142 1 94 GLN HA 1 95 LEU H . . 3.160 2.816 2.707 2.988 . 0 0 "[ . 1 . 2]" 1
1143 1 94 GLN QB 1 102 ARG HE . . 6.880 6.039 5.285 6.221 . 0 0 "[ . 1 . 2]" 1
1144 1 94 GLN QG 1 95 LEU H . . 6.880 4.481 4.402 4.554 . 0 0 "[ . 1 . 2]" 1
1145 1 94 GLN QG 1 95 LEU QB . . 7.760 6.144 6.031 6.196 . 0 0 "[ . 1 . 2]" 1
1146 1 94 GLN QG 1 96 HIS H . . 6.080 4.413 3.881 5.357 . 0 0 "[ . 1 . 2]" 1
1147 1 95 LEU H 1 95 LEU QB . . 3.540 2.523 2.281 2.641 . 0 0 "[ . 1 . 2]" 1
1148 1 95 LEU H 1 95 LEU MD1 . . 5.640 3.059 2.638 4.048 . 0 0 "[ . 1 . 2]" 1
1149 1 95 LEU H 1 95 LEU QD . . 4.900 1.689 1.433 2.392 . 0 0 "[ . 1 . 2]" 1
1150 1 95 LEU H 1 95 LEU MD2 . . 5.640 1.697 1.440 2.409 . 0 0 "[ . 1 . 2]" 1
1151 1 95 LEU H 1 95 LEU HG . . 3.860 3.866 3.783 3.970 0.110 1 0 "[ . 1 . 2]" 1
1152 1 95 LEU H 1 96 HIS H . . 4.380 2.793 2.293 4.114 . 0 0 "[ . 1 . 2]" 1
1153 1 95 LEU HA 1 95 LEU QD . . 4.280 2.133 1.992 2.241 . 0 0 "[ . 1 . 2]" 1
1154 1 95 LEU HA 1 96 HIS HD2 . . 5.930 4.662 3.896 5.217 . 0 0 "[ . 1 . 2]" 1
1155 1 95 LEU HA 1 100 SER QB . . 5.790 4.440 3.723 4.849 . 0 0 "[ . 1 . 2]" 1
1156 1 95 LEU QB 1 96 HIS H . . 5.760 3.638 3.310 3.879 . 0 0 "[ . 1 . 2]" 1
1157 1 95 LEU QB 1 100 SER QB . . 4.680 3.007 2.140 3.839 . 0 0 "[ . 1 . 2]" 1
1158 1 95 LEU HB2 1 100 SER HB2 . . 5.700 3.908 3.337 5.301 . 0 0 "[ . 1 . 2]" 1
1159 1 95 LEU HB2 1 100 SER HB3 . . 5.700 4.854 3.514 5.700 . 0 0 "[ . 1 . 2]" 1
1160 1 95 LEU HB3 1 100 SER HB2 . . 5.700 3.536 2.980 4.934 . 0 0 "[ . 1 . 2]" 1
1161 1 95 LEU HB3 1 100 SER HB3 . . 5.700 4.235 2.204 4.846 . 0 0 "[ . 1 . 2]" 1
1162 1 95 LEU QD 1 96 HIS H . . 4.900 3.607 3.371 3.718 . 0 0 "[ . 1 . 2]" 1
1163 1 95 LEU QD 1 96 HIS HA . . 8.600 5.113 4.959 5.224 . 0 0 "[ . 1 . 2]" 1
1164 1 95 LEU QD 1 96 HIS HD2 . . 6.070 4.143 3.433 4.595 . 0 0 "[ . 1 . 2]" 1
1165 1 95 LEU QD 1 99 GLU QG . . 6.540 3.309 2.020 3.911 . 0 0 "[ . 1 . 2]" 1
1166 1 95 LEU QD 1 100 SER HA . . 6.050 3.550 1.713 4.314 . 0 0 "[ . 1 . 2]" 1
1167 1 95 LEU QD 1 100 SER QB . . 8.300 4.374 3.231 4.955 . 0 0 "[ . 1 . 2]" 1
1168 1 95 LEU MD1 1 96 HIS H . . 5.280 4.219 3.856 4.388 . 0 0 "[ . 1 . 2]" 1
1169 1 95 LEU MD1 1 96 HIS HD2 . . 6.730 5.418 4.623 5.645 . 0 0 "[ . 1 . 2]" 1
1170 1 95 LEU MD1 1 99 GLU QG . . 7.310 3.393 2.033 4.065 . 0 0 "[ . 1 . 2]" 1
1171 1 95 LEU MD1 1 100 SER HA . . 6.990 3.720 1.714 4.530 . 0 0 "[ . 1 . 2]" 1
1172 1 95 LEU MD1 1 100 SER HB2 . . 10.040 5.298 3.856 6.487 . 0 0 "[ . 1 . 2]" 1
1173 1 95 LEU MD1 1 100 SER HB3 . . 10.040 5.759 3.522 6.490 . 0 0 "[ . 1 . 2]" 1
1174 1 95 LEU MD2 1 96 HIS H . . 5.280 3.948 3.556 4.313 . 0 0 "[ . 1 . 2]" 1
1175 1 95 LEU MD2 1 96 HIS HD2 . . 6.730 4.326 3.540 5.052 . 0 0 "[ . 1 . 2]" 1
1176 1 95 LEU MD2 1 99 GLU QG . . 7.310 4.674 3.453 5.100 . 0 0 "[ . 1 . 2]" 1
1177 1 95 LEU MD2 1 100 SER HA . . 6.990 4.771 4.268 5.423 . 0 0 "[ . 1 . 2]" 1
1178 1 95 LEU MD2 1 100 SER HB2 . . 10.040 5.508 5.034 6.708 . 0 0 "[ . 1 . 2]" 1
1179 1 95 LEU MD2 1 100 SER HB3 . . 10.040 6.278 4.998 6.786 . 0 0 "[ . 1 . 2]" 1
1180 1 96 HIS H 1 96 HIS QB . . 3.790 2.424 2.087 3.253 . 0 0 "[ . 1 . 2]" 1
1181 1 96 HIS H 1 96 HIS HD2 . . 5.900 2.778 1.870 3.493 . 0 0 "[ . 1 . 2]" 1
1182 1 96 HIS H 1 97 GLY H . . 4.840 4.491 4.286 4.607 . 0 0 "[ . 1 . 2]" 1
1183 1 96 HIS H 1 99 GLU QG . . 5.160 3.159 1.973 3.869 . 0 0 "[ . 1 . 2]" 1
1184 1 96 HIS HA 1 97 GLY H . . 2.960 2.566 2.312 2.878 . 0 0 "[ . 1 . 2]" 1
1185 1 96 HIS HA 1 97 GLY HA3 . . 6.000 4.589 4.423 4.744 . 0 0 "[ . 1 . 2]" 1
1186 1 96 HIS HA 1 100 SER HB2 . . 4.940 4.106 3.334 4.979 0.039 7 0 "[ . 1 . 2]" 1
1187 1 96 HIS HA 1 100 SER QB . . 4.630 3.460 2.028 4.235 . 0 0 "[ . 1 . 2]" 1
1188 1 96 HIS HA 1 100 SER HB3 . . 4.940 3.961 2.037 5.046 0.106 19 0 "[ . 1 . 2]" 1
1189 1 96 HIS QB 1 97 GLY H . . 3.360 2.165 1.915 2.557 . 0 0 "[ . 1 . 2]" 1
1190 1 96 HIS HB2 1 97 GLY H . . 3.590 3.243 2.116 3.626 0.036 13 0 "[ . 1 . 2]" 1
1191 1 96 HIS HB3 1 97 GLY H . . 3.590 2.441 1.986 3.567 . 0 0 "[ . 1 . 2]" 1
1192 1 97 GLY H 1 98 GLU H . . 3.950 3.767 2.716 4.011 0.061 19 0 "[ . 1 . 2]" 1
1193 1 97 GLY HA3 1 99 GLU H . . 5.600 4.424 4.057 4.968 . 0 0 "[ . 1 . 2]" 1
1194 1 98 GLU H 1 98 GLU QB . . 3.910 2.970 2.846 3.067 . 0 0 "[ . 1 . 2]" 1
1195 1 98 GLU H 1 99 GLU H . . 3.260 2.165 1.877 2.885 . 0 0 "[ . 1 . 2]" 1
1196 1 98 GLU H 1 100 SER H . . 5.310 4.082 2.870 4.755 . 0 0 "[ . 1 . 2]" 1
1197 1 98 GLU QG 1 99 GLU H . . 5.330 4.211 3.481 4.392 . 0 0 "[ . 1 . 2]" 1
1198 1 98 GLU QG 1 101 GLU QB . . 6.100 4.647 3.747 4.998 . 0 0 "[ . 1 . 2]" 1
1199 1 99 GLU H 1 99 GLU QB . . 3.810 3.184 2.603 3.416 . 0 0 "[ . 1 . 2]" 1
1200 1 99 GLU H 1 99 GLU HG2 . . 3.290 2.454 2.019 2.846 . 0 0 "[ . 1 . 2]" 1
1201 1 99 GLU H 1 99 GLU HG3 . . 3.290 2.918 2.269 3.364 0.074 5 0 "[ . 1 . 2]" 1
1202 1 99 GLU H 1 100 SER H . . 3.060 2.099 1.804 2.857 . 0 0 "[ . 1 . 2]" 1
1203 1 99 GLU HA 1 99 GLU HG2 . . 4.090 3.552 3.168 3.859 . 0 0 "[ . 1 . 2]" 1
1204 1 99 GLU HA 1 99 GLU QG . . 3.730 3.246 3.016 3.312 . 0 0 "[ . 1 . 2]" 1
1205 1 99 GLU HA 1 99 GLU HG3 . . 4.090 3.780 3.607 3.848 . 0 0 "[ . 1 . 2]" 1
1206 1 99 GLU HA 1 100 SER H . . 3.290 3.027 2.889 3.329 0.039 7 0 "[ . 1 . 2]" 1
1207 1 99 GLU HA 1 102 ARG QB . . 4.100 3.303 2.888 3.467 . 0 0 "[ . 1 . 2]" 1
1208 1 99 GLU QG 1 100 SER H . . 4.230 3.667 3.050 3.849 . 0 0 "[ . 1 . 2]" 1
1209 1 99 GLU QG 1 102 ARG H . . 6.420 5.543 5.120 5.823 . 0 0 "[ . 1 . 2]" 1
1210 1 99 GLU HG2 1 100 SER H . . 4.450 4.203 3.320 4.478 0.028 18 0 "[ . 1 . 2]" 1
1211 1 99 GLU HG3 1 100 SER H . . 4.450 4.062 3.553 4.334 . 0 0 "[ . 1 . 2]" 1
1212 1 100 SER H 1 100 SER HB2 . . 3.490 3.292 2.949 3.567 0.077 12 0 "[ . 1 . 2]" 1
1213 1 100 SER H 1 100 SER QB . . 3.310 2.277 2.058 2.968 . 0 0 "[ . 1 . 2]" 1
1214 1 100 SER H 1 100 SER HB3 . . 3.490 2.336 2.088 3.184 . 0 0 "[ . 1 . 2]" 1
1215 1 100 SER H 1 101 GLU H . . 3.230 2.321 2.094 2.583 . 0 0 "[ . 1 . 2]" 1
1216 1 100 SER H 1 102 ARG QD . . 6.880 5.757 4.697 6.244 . 0 0 "[ . 1 . 2]" 1
1217 1 100 SER HA 1 101 GLU H . . 3.590 3.527 3.474 3.568 . 0 0 "[ . 1 . 2]" 1
1218 1 100 SER HA 1 102 ARG H . . 4.680 4.112 3.852 4.617 . 0 0 "[ . 1 . 2]" 1
1219 1 100 SER HA 1 103 VAL H . . 3.890 3.402 3.244 3.603 . 0 0 "[ . 1 . 2]" 1
1220 1 100 SER HA 1 103 VAL HB . . 2.870 2.899 2.854 2.995 0.125 8 0 "[ . 1 . 2]" 1
1221 1 100 SER HA 1 103 VAL QG . . 7.300 3.258 2.846 3.504 . 0 0 "[ . 1 . 2]" 1
1222 1 100 SER HB2 1 101 GLU H . . 4.280 4.034 3.587 4.248 . 0 0 "[ . 1 . 2]" 1
1223 1 100 SER HB3 1 101 GLU H . . 4.280 3.249 2.599 4.230 . 0 0 "[ . 1 . 2]" 1
1224 1 101 GLU H 1 101 GLU QG . . 5.090 3.781 2.570 4.052 . 0 0 "[ . 1 . 2]" 1
1225 1 101 GLU H 1 102 ARG H . . 2.960 2.550 2.407 2.676 . 0 0 "[ . 1 . 2]" 1
1226 1 101 GLU H 1 102 ARG QB . . 6.280 4.614 4.375 4.827 . 0 0 "[ . 1 . 2]" 1
1227 1 101 GLU HA 1 104 ALA H . . 3.430 3.111 3.041 3.211 . 0 0 "[ . 1 . 2]" 1
1228 1 101 GLU HA 1 104 ALA MB . . 4.220 2.587 2.312 2.717 . 0 0 "[ . 1 . 2]" 1
1229 1 101 GLU QB 1 102 ARG H . . 4.070 2.868 2.444 3.571 . 0 0 "[ . 1 . 2]" 1
1230 1 101 GLU QB 1 104 ALA MB . . 5.660 4.051 3.620 4.154 . 0 0 "[ . 1 . 2]" 1
1231 1 101 GLU QG 1 102 ARG H . . 6.610 4.111 2.197 4.650 . 0 0 "[ . 1 . 2]" 1
1232 1 101 GLU QG 1 104 ALA MB . . 7.900 3.116 2.743 4.790 . 0 0 "[ . 1 . 2]" 1
1233 1 102 ARG H 1 102 ARG HG2 . . 4.940 3.003 2.338 4.392 . 0 0 "[ . 1 . 2]" 1
1234 1 102 ARG H 1 102 ARG QG . . 4.300 2.488 2.237 4.012 . 0 0 "[ . 1 . 2]" 1
1235 1 102 ARG H 1 102 ARG HG3 . . 4.940 2.806 2.468 4.639 . 0 0 "[ . 1 . 2]" 1
1236 1 102 ARG H 1 103 VAL H . . 3.200 2.596 2.454 2.730 . 0 0 "[ . 1 . 2]" 1
1237 1 102 ARG H 1 103 VAL QG . . 8.120 4.277 3.917 4.564 . 0 0 "[ . 1 . 2]" 1
1238 1 102 ARG H 1 104 ALA H . . 4.480 4.039 3.889 4.191 . 0 0 "[ . 1 . 2]" 1
1239 1 102 ARG HA 1 102 ARG HE . . 6.000 5.812 5.291 6.026 0.026 1 0 "[ . 1 . 2]" 1
1240 1 102 ARG HA 1 105 GLN QE . . 6.340 3.104 1.771 4.348 . 0 0 "[ . 1 . 2]" 1
1241 1 102 ARG HA 1 105 GLN QG . . 5.400 2.677 1.970 4.694 . 0 0 "[ . 1 . 2]" 1
1242 1 102 ARG QB 1 103 VAL H . . 4.500 3.478 2.719 3.665 . 0 0 "[ . 1 . 2]" 1
1243 1 102 ARG QB 1 104 ALA H . . 6.780 4.978 4.726 5.207 . 0 0 "[ . 1 . 2]" 1
1244 1 102 ARG QB 1 104 ALA MB . . 7.670 5.589 5.449 5.680 . 0 0 "[ . 1 . 2]" 1
1245 1 102 ARG QD 1 105 GLN QE . . 7.750 4.797 3.575 5.987 . 0 0 "[ . 1 . 2]" 1
1246 1 102 ARG QG 1 103 VAL H . . 6.880 2.577 2.026 4.368 . 0 0 "[ . 1 . 2]" 1
1247 1 102 ARG QG 1 103 VAL HA . . 6.520 3.897 3.317 5.786 . 0 0 "[ . 1 . 2]" 1
1248 1 103 VAL H 1 103 VAL HB . . 2.960 2.176 2.067 2.270 . 0 0 "[ . 1 . 2]" 1
1249 1 103 VAL H 1 104 ALA H . . 3.100 2.358 2.297 2.461 . 0 0 "[ . 1 . 2]" 1
1250 1 103 VAL H 1 104 ALA MB . . 6.300 4.022 3.965 4.101 . 0 0 "[ . 1 . 2]" 1
1251 1 103 VAL H 1 105 GLN H . . 5.740 4.213 3.942 5.046 . 0 0 "[ . 1 . 2]" 1
1252 1 103 VAL HA 1 105 GLN H . . 5.240 4.324 3.867 5.168 . 0 0 "[ . 1 . 2]" 1
1253 1 103 VAL HA 1 106 ARG H . . 4.050 3.140 2.873 3.540 . 0 0 "[ . 1 . 2]" 1
1254 1 103 VAL HA 1 106 ARG HB2 . . 3.990 2.242 1.993 2.500 . 0 0 "[ . 1 . 2]" 1
1255 1 103 VAL HA 1 106 ARG QB . . 3.680 2.216 1.978 2.474 . 0 0 "[ . 1 . 2]" 1
1256 1 103 VAL HA 1 106 ARG HB3 . . 3.990 3.527 2.841 3.963 . 0 0 "[ . 1 . 2]" 1
1257 1 103 VAL HA 1 107 ALA H . . 4.710 4.026 3.668 4.387 . 0 0 "[ . 1 . 2]" 1
1258 1 103 VAL HB 1 104 ALA H . . 3.330 3.046 2.869 3.227 . 0 0 "[ . 1 . 2]" 1
1259 1 103 VAL QG 1 104 ALA H . . 6.600 3.165 2.902 3.402 . 0 0 "[ . 1 . 2]" 1
1260 1 104 ALA H 1 105 GLN H . . 3.260 2.741 2.575 3.140 . 0 0 "[ . 1 . 2]" 1
1261 1 104 ALA H 1 107 ALA MB . . 7.030 5.143 4.704 5.549 . 0 0 "[ . 1 . 2]" 1
1262 1 104 ALA HA 1 106 ARG H . . 4.520 4.299 3.936 4.682 0.162 8 0 "[ . 1 . 2]" 1
1263 1 104 ALA MB 1 105 GLN H . . 4.290 2.455 1.897 2.727 . 0 0 "[ . 1 . 2]" 1
1264 1 104 ALA MB 1 105 GLN HA . . 5.870 3.891 3.768 3.967 . 0 0 "[ . 1 . 2]" 1
1265 1 104 ALA MB 1 105 GLN QB . . 7.900 3.924 3.595 4.302 . 0 0 "[ . 1 . 2]" 1
1266 1 104 ALA MB 1 105 GLN QG . . 7.910 3.967 3.203 5.457 . 0 0 "[ . 1 . 2]" 1
1267 1 105 GLN H 1 105 GLN HG2 . . 5.540 2.496 1.985 4.421 . 0 0 "[ . 1 . 2]" 1
1268 1 105 GLN H 1 105 GLN QG . . 4.960 2.267 1.952 3.962 . 0 0 "[ . 1 . 2]" 1
1269 1 105 GLN H 1 105 GLN HG3 . . 5.540 3.044 2.306 4.475 . 0 0 "[ . 1 . 2]" 1
1270 1 105 GLN H 1 106 ARG H . . 4.750 2.608 2.498 2.871 . 0 0 "[ . 1 . 2]" 1
1271 1 105 GLN H 1 107 ALA H . . 4.650 4.496 4.077 4.663 0.013 18 0 "[ . 1 . 2]" 1
1272 1 105 GLN HA 1 108 GLY H . . 4.090 3.540 3.079 4.055 . 0 0 "[ . 1 . 2]" 1
1273 1 105 GLN QB 1 106 ARG H . . 4.530 3.380 2.514 3.651 . 0 0 "[ . 1 . 2]" 1
1274 1 105 GLN QB 1 107 ALA H . . 6.680 5.344 4.759 5.702 . 0 0 "[ . 1 . 2]" 1
1275 1 105 GLN QB 1 108 GLY H . . 5.890 4.977 4.624 5.439 . 0 0 "[ . 1 . 2]" 1
1276 1 105 GLN QG 1 106 ARG HE . . 6.880 4.699 2.962 6.072 . 0 0 "[ . 1 . 2]" 1
1277 1 105 GLN QG 1 108 GLY H . . 6.320 5.191 4.954 5.657 . 0 0 "[ . 1 . 2]" 1
1278 1 106 ARG H 1 106 ARG HE . . 6.000 4.404 2.368 5.838 . 0 0 "[ . 1 . 2]" 1
1279 1 106 ARG H 1 107 ALA H . . 2.960 2.800 2.521 2.956 . 0 0 "[ . 1 . 2]" 1
1280 1 106 ARG H 1 107 ALA MB . . 7.030 4.366 4.100 4.525 . 0 0 "[ . 1 . 2]" 1
1281 1 106 ARG HA 1 106 ARG HE . . 6.000 4.302 2.010 5.365 . 0 0 "[ . 1 . 2]" 1
1282 1 106 ARG HA 1 109 GLU QG . . 6.880 2.808 2.157 3.771 . 0 0 "[ . 1 . 2]" 1
1283 1 106 ARG QB 1 106 ARG HE . . 3.940 3.019 2.219 3.575 . 0 0 "[ . 1 . 2]" 1
1284 1 106 ARG QB 1 107 ALA H . . 4.270 2.402 2.135 2.852 . 0 0 "[ . 1 . 2]" 1
1285 1 106 ARG HB2 1 106 ARG HE . . 4.120 3.266 2.278 4.181 0.061 4 0 "[ . 1 . 2]" 1
1286 1 106 ARG HB3 1 106 ARG HE . . 4.120 3.888 3.059 4.131 0.011 18 0 "[ . 1 . 2]" 1
1287 1 107 ALA H 1 108 GLY H . . 3.390 2.698 2.466 2.915 . 0 0 "[ . 1 . 2]" 1
1288 1 107 ALA H 1 109 GLU H . . 5.040 4.202 3.767 4.592 . 0 0 "[ . 1 . 2]" 1
1289 1 107 ALA HA 1 110 ILE H . . 3.530 3.493 3.323 3.693 0.163 8 0 "[ . 1 . 2]" 1
1290 1 107 ALA HA 1 110 ILE QG . . 4.670 3.373 2.823 3.874 . 0 0 "[ . 1 . 2]" 1
1291 1 107 ALA HA 1 110 ILE MG . . 6.000 5.100 5.020 5.234 . 0 0 "[ . 1 . 2]" 1
1292 1 107 ALA MB 1 109 GLU H . . 7.030 4.386 4.173 4.547 . 0 0 "[ . 1 . 2]" 1
1293 1 107 ALA MB 1 111 VAL HB . . 7.030 4.745 4.345 5.101 . 0 0 "[ . 1 . 2]" 1
1294 1 107 ALA MB 1 111 VAL QG . . 8.300 2.749 2.250 3.099 . 0 0 "[ . 1 . 2]" 1
1295 1 108 GLY H 1 109 GLU H . . 3.530 2.960 2.784 3.162 . 0 0 "[ . 1 . 2]" 1
1296 1 108 GLY H 1 111 VAL MG1 . . 7.030 5.214 4.792 5.514 . 0 0 "[ . 1 . 2]" 1
1297 1 108 GLY H 1 111 VAL MG2 . . 7.030 3.485 3.083 3.680 . 0 0 "[ . 1 . 2]" 1
1298 1 108 GLY QA 1 111 VAL H . . 4.120 3.177 2.988 3.345 . 0 0 "[ . 1 . 2]" 1
1299 1 108 GLY QA 1 111 VAL HA . . 5.300 4.566 4.468 4.674 . 0 0 "[ . 1 . 2]" 1
1300 1 108 GLY QA 1 111 VAL HB . . 4.140 1.927 1.888 1.982 . 0 0 "[ . 1 . 2]" 1
1301 1 108 GLY QA 1 111 VAL QG . . 5.440 2.251 2.079 2.438 . 0 0 "[ . 1 . 2]" 1
1302 1 108 GLY QA 1 112 SER H . . 5.660 3.526 3.350 3.804 . 0 0 "[ . 1 . 2]" 1
1303 1 108 GLY QA 1 120 ARG QB . . 6.000 4.590 4.495 4.704 . 0 0 "[ . 1 . 2]" 1
1304 1 108 GLY HA2 1 109 GLU H . . 3.530 3.538 3.503 3.567 0.037 19 0 "[ . 1 . 2]" 1
1305 1 108 GLY HA2 1 111 VAL H . . 4.750 3.256 3.049 3.448 . 0 0 "[ . 1 . 2]" 1
1306 1 108 GLY HA2 1 111 VAL MG1 . . 6.300 3.111 2.950 3.255 . 0 0 "[ . 1 . 2]" 1
1307 1 108 GLY HA2 1 111 VAL MG2 . . 6.300 2.347 2.128 2.625 . 0 0 "[ . 1 . 2]" 1
1308 1 108 GLY HA3 1 109 GLU H . . 3.530 2.888 2.807 2.955 . 0 0 "[ . 1 . 2]" 1
1309 1 108 GLY HA3 1 111 VAL H . . 4.750 4.424 4.284 4.520 . 0 0 "[ . 1 . 2]" 1
1310 1 108 GLY HA3 1 111 VAL MG1 . . 6.300 4.424 4.337 4.566 . 0 0 "[ . 1 . 2]" 1
1311 1 108 GLY HA3 1 111 VAL MG2 . . 6.300 3.715 3.534 3.976 . 0 0 "[ . 1 . 2]" 1
1312 1 109 GLU H 1 109 GLU HG2 . . 3.530 3.245 2.636 3.614 0.084 9 0 "[ . 1 . 2]" 1
1313 1 109 GLU H 1 109 GLU QG . . 3.050 2.347 1.969 2.843 . 0 0 "[ . 1 . 2]" 1
1314 1 109 GLU H 1 109 GLU HG3 . . 3.530 2.441 1.997 3.384 . 0 0 "[ . 1 . 2]" 1
1315 1 109 GLU H 1 110 ILE H . . 3.590 2.927 2.728 3.103 . 0 0 "[ . 1 . 2]" 1
1316 1 109 GLU H 1 111 VAL QG . . 7.890 4.171 3.968 4.343 . 0 0 "[ . 1 . 2]" 1
1317 1 109 GLU HA 1 109 GLU HG2 . . 3.460 2.328 2.100 2.631 . 0 0 "[ . 1 . 2]" 1
1318 1 109 GLU HA 1 109 GLU QG . . 3.200 2.254 2.061 2.403 . 0 0 "[ . 1 . 2]" 1
1319 1 109 GLU HA 1 109 GLU HG3 . . 3.460 3.125 2.779 3.483 0.023 17 0 "[ . 1 . 2]" 1
1320 1 109 GLU HA 1 110 ILE HA . . 5.570 4.680 4.656 4.705 . 0 0 "[ . 1 . 2]" 1
1321 1 109 GLU HA 1 111 VAL H . . 4.250 4.318 4.279 4.370 0.120 2 0 "[ . 1 . 2]" 1
1322 1 109 GLU QG 1 110 ILE H . . 4.740 4.041 3.729 4.271 . 0 0 "[ . 1 . 2]" 1
1323 1 109 GLU QG 1 110 ILE MD . . 7.910 4.172 3.973 4.350 . 0 0 "[ . 1 . 2]" 1
1324 1 110 ILE H 1 110 ILE HB . . 3.230 2.573 2.410 2.715 . 0 0 "[ . 1 . 2]" 1
1325 1 110 ILE H 1 110 ILE MD . . 5.250 2.346 2.127 2.537 . 0 0 "[ . 1 . 2]" 1
1326 1 110 ILE H 1 110 ILE HG12 . . 3.790 2.310 2.073 2.582 . 0 0 "[ . 1 . 2]" 1
1327 1 110 ILE H 1 110 ILE QG . . 3.520 2.287 2.060 2.548 . 0 0 "[ . 1 . 2]" 1
1328 1 110 ILE H 1 110 ILE HG13 . . 3.790 3.712 3.540 3.906 0.116 2 0 "[ . 1 . 2]" 1
1329 1 110 ILE H 1 110 ILE MG . . 4.160 3.749 3.727 3.786 . 0 0 "[ . 1 . 2]" 1
1330 1 110 ILE H 1 111 VAL H . . 2.700 2.438 2.339 2.570 . 0 0 "[ . 1 . 2]" 1
1331 1 110 ILE H 1 111 VAL QG . . 8.090 3.682 3.552 3.800 . 0 0 "[ . 1 . 2]" 1
1332 1 110 ILE HA 1 110 ILE MD . . 4.450 2.073 1.918 2.241 . 0 0 "[ . 1 . 2]" 1
1333 1 110 ILE HA 1 110 ILE HG12 . . 4.220 3.516 3.435 3.611 . 0 0 "[ . 1 . 2]" 1
1334 1 110 ILE HA 1 110 ILE HG13 . . 4.220 3.605 3.479 3.723 . 0 0 "[ . 1 . 2]" 1
1335 1 110 ILE HA 1 113 SER H . . 4.710 3.165 2.998 3.236 . 0 0 "[ . 1 . 2]" 1
1336 1 110 ILE HA 1 113 SER HB2 . . 4.910 2.595 2.001 3.570 . 0 0 "[ . 1 . 2]" 1
1337 1 110 ILE HA 1 113 SER QB . . 4.190 2.307 1.985 2.822 . 0 0 "[ . 1 . 2]" 1
1338 1 110 ILE HA 1 113 SER HB3 . . 4.910 3.184 2.007 3.951 . 0 0 "[ . 1 . 2]" 1
1339 1 110 ILE HA 1 114 CYS H . . 4.350 3.803 3.455 4.300 . 0 0 "[ . 1 . 2]" 1
1340 1 110 ILE HB 1 111 VAL H . . 3.260 2.916 2.846 3.003 . 0 0 "[ . 1 . 2]" 1
1341 1 110 ILE QG 1 111 VAL H . . 5.070 4.042 3.781 4.251 . 0 0 "[ . 1 . 2]" 1
1342 1 110 ILE QG 1 113 SER H . . 6.880 5.778 5.697 5.862 . 0 0 "[ . 1 . 2]" 1
1343 1 110 ILE MG 1 111 VAL H . . 4.880 3.810 3.598 3.998 . 0 0 "[ . 1 . 2]" 1
1344 1 110 ILE MG 1 111 VAL HA . . 5.160 3.910 3.589 4.204 . 0 0 "[ . 1 . 2]" 1
1345 1 110 ILE MG 1 112 SER H . . 7.030 5.411 5.116 5.667 . 0 0 "[ . 1 . 2]" 1
1346 1 110 ILE MG 1 114 CYS H . . 6.040 3.163 2.964 3.539 . 0 0 "[ . 1 . 2]" 1
1347 1 111 VAL H 1 111 VAL HB . . 2.930 2.407 2.304 2.486 . 0 0 "[ . 1 . 2]" 1
1348 1 111 VAL H 1 111 VAL MG1 . . 4.720 3.740 3.709 3.798 . 0 0 "[ . 1 . 2]" 1
1349 1 111 VAL H 1 111 VAL QG . . 4.070 2.041 1.936 2.159 . 0 0 "[ . 1 . 2]" 1
1350 1 111 VAL H 1 111 VAL MG2 . . 4.720 2.050 1.942 2.173 . 0 0 "[ . 1 . 2]" 1
1351 1 111 VAL H 1 112 SER H . . 3.430 2.882 2.777 3.040 . 0 0 "[ . 1 . 2]" 1
1352 1 111 VAL H 1 113 SER H . . 4.280 3.821 3.656 3.925 . 0 0 "[ . 1 . 2]" 1
1353 1 111 VAL HA 1 114 CYS H . . 4.940 3.934 3.586 4.101 . 0 0 "[ . 1 . 2]" 1
1354 1 111 VAL HA 1 116 VAL H . . 3.920 3.501 3.291 3.754 . 0 0 "[ . 1 . 2]" 1
1355 1 111 VAL HA 1 116 VAL QG . . 5.850 4.085 3.603 4.471 . 0 0 "[ . 1 . 2]" 1
1356 1 111 VAL HB 1 112 SER H . . 3.130 2.342 2.156 2.584 . 0 0 "[ . 1 . 2]" 1
1357 1 111 VAL HB 1 113 SER H . . 4.850 4.615 4.365 4.775 . 0 0 "[ . 1 . 2]" 1
1358 1 111 VAL QG 1 112 SER H . . 5.040 2.898 2.656 3.132 . 0 0 "[ . 1 . 2]" 1
1359 1 111 VAL QG 1 115 GLY HA3 . . 7.990 2.925 2.664 3.152 . 0 0 "[ . 1 . 2]" 1
1360 1 111 VAL QG 1 116 VAL HA . . 6.110 1.660 1.542 1.946 . 0 0 "[ . 1 . 2]" 1
1361 1 111 VAL QG 1 117 ARG QG . . 7.260 4.074 3.106 4.837 . 0 0 "[ . 1 . 2]" 1
1362 1 111 VAL QG 1 118 CYS H . . 8.590 4.050 3.631 4.670 . 0 0 "[ . 1 . 2]" 1
1363 1 111 VAL MG1 1 112 SER H . . 5.340 3.011 2.709 3.333 . 0 0 "[ . 1 . 2]" 1
1364 1 111 VAL MG2 1 112 SER H . . 5.340 3.797 3.686 3.934 . 0 0 "[ . 1 . 2]" 1
1365 1 112 SER H 1 113 SER H . . 3.230 2.751 2.648 2.925 . 0 0 "[ . 1 . 2]" 1
1366 1 112 SER H 1 114 CYS H . . 5.180 5.116 4.943 5.291 0.111 4 0 "[ . 1 . 2]" 1
1367 1 112 SER HA 1 115 GLY H . . 4.650 4.647 4.334 4.832 0.182 7 0 "[ . 1 . 2]" 1
1368 1 112 SER HA 1 116 VAL H . . 5.270 5.116 4.668 5.397 0.127 13 0 "[ . 1 . 2]" 1
1369 1 112 SER HA 1 116 VAL QG . . 7.170 3.358 2.014 4.472 . 0 0 "[ . 1 . 2]" 1
1370 1 113 SER H 1 113 SER HB2 . . 3.950 2.481 2.053 3.117 . 0 0 "[ . 1 . 2]" 1
1371 1 113 SER H 1 113 SER QB . . 3.340 2.272 2.035 2.651 . 0 0 "[ . 1 . 2]" 1
1372 1 113 SER H 1 113 SER HB3 . . 3.950 3.054 2.066 3.587 . 0 0 "[ . 1 . 2]" 1
1373 1 113 SER H 1 114 CYS H . . 2.900 2.951 2.765 3.042 0.142 4 0 "[ . 1 . 2]" 1
1374 1 113 SER H 1 115 GLY H . . 4.550 3.671 3.386 4.096 . 0 0 "[ . 1 . 2]" 1
1375 1 113 SER QB 1 114 CYS H . . 3.420 1.998 1.828 2.517 . 0 0 "[ . 1 . 2]" 1
1376 1 113 SER HB2 1 114 CYS H . . 3.690 2.719 1.867 3.674 . 0 0 "[ . 1 . 2]" 1
1377 1 113 SER HB3 1 114 CYS H . . 3.690 2.472 1.849 3.346 . 0 0 "[ . 1 . 2]" 1
1378 1 114 CYS H 1 114 CYS HB2 . . 3.620 3.108 2.744 3.299 . 0 0 "[ . 1 . 2]" 1
1379 1 114 CYS H 1 114 CYS QB . . 3.320 2.765 2.665 2.822 . 0 0 "[ . 1 . 2]" 1
1380 1 114 CYS H 1 114 CYS HB3 . . 3.620 3.139 2.959 3.620 0.000 8 0 "[ . 1 . 2]" 1
1381 1 114 CYS H 1 115 GLY H . . 3.290 2.306 2.030 2.582 . 0 0 "[ . 1 . 2]" 1
1382 1 114 CYS H 1 116 VAL H . . 4.420 4.452 4.316 4.540 0.120 6 0 "[ . 1 . 2]" 1
1383 1 114 CYS HA 1 116 VAL QG . . 7.960 3.670 3.112 4.455 . 0 0 "[ . 1 . 2]" 1
1384 1 114 CYS QB 1 115 GLY H . . 4.920 3.877 3.798 3.948 . 0 0 "[ . 1 . 2]" 1
1385 1 114 CYS HB2 1 115 GLY H . . 5.740 4.513 4.268 4.584 . 0 0 "[ . 1 . 2]" 1
1386 1 114 CYS HB3 1 115 GLY H . . 5.740 4.226 4.096 4.308 . 0 0 "[ . 1 . 2]" 1
1387 1 115 GLY H 1 115 GLY HA3 . . 2.970 2.559 2.484 2.654 . 0 0 "[ . 1 . 2]" 1
1388 1 115 GLY H 1 116 VAL H . . 3.360 2.260 1.857 2.615 . 0 0 "[ . 1 . 2]" 1
1389 1 115 GLY H 1 117 ARG HE . . 4.550 3.974 3.454 4.540 . 0 0 "[ . 1 . 2]" 1
1390 1 115 GLY HA2 1 116 VAL H . . 3.160 3.010 2.882 3.113 . 0 0 "[ . 1 . 2]" 1
1391 1 115 GLY HA3 1 116 VAL H . . 3.560 3.489 3.437 3.558 . 0 0 "[ . 1 . 2]" 1
1392 1 116 VAL H 1 116 VAL HB . . 2.770 2.501 2.109 2.815 0.045 6 0 "[ . 1 . 2]" 1
1393 1 116 VAL H 1 117 ARG H . . 4.350 4.091 3.696 4.455 0.105 10 0 "[ . 1 . 2]" 1
1394 1 116 VAL HA 1 117 ARG H . . 2.700 2.293 2.125 2.513 . 0 0 "[ . 1 . 2]" 1
1395 1 116 VAL HB 1 117 ARG H . . 5.470 4.504 4.249 4.624 . 0 0 "[ . 1 . 2]" 1
1396 1 116 VAL QG 1 117 ARG H . . 6.710 3.352 2.949 3.653 . 0 0 "[ . 1 . 2]" 1
1397 1 116 VAL QG 1 117 ARG QD . . 8.080 4.147 3.575 4.976 . 0 0 "[ . 1 . 2]" 1
1398 1 116 VAL QG 1 120 ARG QD . . 7.090 2.555 1.571 3.615 . 0 0 "[ . 1 . 2]" 1
1399 1 117 ARG H 1 117 ARG HG2 . . 5.740 3.545 2.136 4.764 . 0 0 "[ . 1 . 2]" 1
1400 1 117 ARG H 1 117 ARG QG . . 5.050 3.065 2.122 3.804 . 0 0 "[ . 1 . 2]" 1
1401 1 117 ARG H 1 117 ARG HG3 . . 5.740 3.862 2.423 4.122 . 0 0 "[ . 1 . 2]" 1
1402 1 117 ARG H 1 118 CYS H . . 4.250 2.880 2.567 3.438 . 0 0 "[ . 1 . 2]" 1
1403 1 117 ARG H 1 119 MET H . . 4.710 2.546 2.296 2.802 . 0 0 "[ . 1 . 2]" 1
1404 1 117 ARG H 1 120 ARG H . . 4.710 3.542 2.936 4.088 . 0 0 "[ . 1 . 2]" 1
1405 1 117 ARG QB 1 118 CYS HA . . 6.050 4.035 3.938 4.146 . 0 0 "[ . 1 . 2]" 1
1406 1 117 ARG QB 1 119 MET H . . 6.650 3.277 2.949 3.512 . 0 0 "[ . 1 . 2]" 1
1407 1 117 ARG QD 1 118 CYS H . . 6.380 4.162 2.624 4.713 . 0 0 "[ . 1 . 2]" 1
1408 1 117 ARG QG 1 118 CYS H . . 5.820 3.540 3.100 3.930 . 0 0 "[ . 1 . 2]" 1
1409 1 117 ARG QG 1 119 MET H . . 6.880 4.604 3.895 5.321 . 0 0 "[ . 1 . 2]" 1
1410 1 117 ARG HG2 1 118 CYS H . . 6.000 3.860 3.339 4.342 . 0 0 "[ . 1 . 2]" 1
1411 1 117 ARG HG3 1 118 CYS H . . 6.000 4.136 3.675 4.490 . 0 0 "[ . 1 . 2]" 1
1412 1 118 CYS H 1 118 CYS HB2 . . 3.230 2.387 2.146 2.625 . 0 0 "[ . 1 . 2]" 1
1413 1 118 CYS H 1 118 CYS QB . . 2.990 2.326 2.120 2.507 . 0 0 "[ . 1 . 2]" 1
1414 1 118 CYS H 1 118 CYS HB3 . . 3.230 3.248 3.108 3.373 0.143 17 0 "[ . 1 . 2]" 1
1415 1 118 CYS HA 1 119 MET H . . 3.330 3.273 3.218 3.311 . 0 0 "[ . 1 . 2]" 1
1416 1 118 CYS HB2 1 119 MET H . . 4.050 3.847 3.744 3.967 . 0 0 "[ . 1 . 2]" 1
1417 1 118 CYS HB3 1 119 MET H . . 4.050 3.798 3.698 3.897 . 0 0 "[ . 1 . 2]" 1
1418 1 119 MET H 1 119 MET HB2 . . 3.560 2.209 2.083 2.428 . 0 0 "[ . 1 . 2]" 1
1419 1 119 MET H 1 119 MET QB . . 3.330 2.157 2.052 2.289 . 0 0 "[ . 1 . 2]" 1
1420 1 119 MET H 1 119 MET HB3 . . 3.560 3.124 2.799 3.510 . 0 0 "[ . 1 . 2]" 1
1421 1 119 MET H 1 119 MET HG2 . . 5.540 4.353 3.398 4.729 . 0 0 "[ . 1 . 2]" 1
1422 1 119 MET H 1 119 MET HG3 . . 5.540 4.047 3.490 4.548 . 0 0 "[ . 1 . 2]" 1
1423 1 119 MET H 1 120 ARG H . . 3.560 2.413 2.265 2.559 . 0 0 "[ . 1 . 2]" 1
1424 1 119 MET HA 1 120 ARG H . . 3.260 3.227 3.140 3.322 0.062 6 0 "[ . 1 . 2]" 1
1425 1 119 MET QB 1 120 ARG H . . 4.370 3.433 3.270 3.569 . 0 0 "[ . 1 . 2]" 1
1426 1 119 MET QG 1 120 ARG H . . 5.160 4.606 4.540 4.672 . 0 0 "[ . 1 . 2]" 1
1427 1 120 ARG H 1 120 ARG HA . . 2.830 2.892 2.878 2.930 0.100 14 0 "[ . 1 . 2]" 1
1428 1 120 ARG H 1 120 ARG HB2 . . 3.600 3.516 3.355 3.579 . 0 0 "[ . 1 . 2]" 1
1429 1 120 ARG H 1 120 ARG QB . . 3.380 2.767 2.620 2.818 . 0 0 "[ . 1 . 2]" 1
1430 1 120 ARG H 1 120 ARG HB3 . . 3.600 2.898 2.706 3.007 . 0 0 "[ . 1 . 2]" 1
1431 1 120 ARG HA 1 120 ARG HE . . 6.000 4.310 2.899 5.756 . 0 0 "[ . 1 . 2]" 1
1432 1 120 ARG QG 1 121 GLN QG . . 7.750 3.802 2.561 5.867 . 0 0 "[ . 1 . 2]" 1
1433 1 121 GLN H 1 121 GLN HB2 . . 3.890 2.660 2.145 3.837 . 0 0 "[ . 1 . 2]" 1
1434 1 121 GLN H 1 121 GLN QB . . 3.530 2.461 2.122 2.948 . 0 0 "[ . 1 . 2]" 1
1435 1 121 GLN H 1 121 GLN HB3 . . 3.890 3.206 2.540 3.803 . 0 0 "[ . 1 . 2]" 1
1436 1 121 GLN H 1 122 THR H . . 4.350 4.224 4.031 4.383 0.033 11 0 "[ . 1 . 2]" 1
1437 1 121 GLN HA 1 122 THR H . . 3.160 2.718 2.006 3.059 . 0 0 "[ . 1 . 2]" 1
1438 1 121 GLN HB2 1 122 THR H . . 5.310 3.404 1.849 4.424 . 0 0 "[ . 1 . 2]" 1
1439 1 121 GLN HB3 1 122 THR H . . 5.310 2.324 1.834 3.556 . 0 0 "[ . 1 . 2]" 1
1440 1 121 GLN QG 1 122 THR H . . 6.880 2.629 1.893 4.315 . 0 0 "[ . 1 . 2]" 1
1441 1 122 THR H 1 122 THR HB . . 4.050 3.323 2.685 3.833 . 0 0 "[ . 1 . 2]" 1
1442 1 122 THR HA 1 123 ARG H . . 3.000 2.684 2.141 2.999 . 0 0 "[ . 1 . 2]" 1
1443 1 122 THR HB 1 123 ARG H . . 3.330 2.490 1.901 3.303 . 0 0 "[ . 1 . 2]" 1
1444 1 122 THR HB 1 124 THR MG . . 5.810 4.450 2.596 4.888 . 0 0 "[ . 1 . 2]" 1
1445 1 122 THR MG 1 123 ARG H . . 7.030 2.738 1.433 4.155 . 0 0 "[ . 1 . 2]" 1
1446 1 123 ARG H 1 123 ARG HB2 . . 3.590 2.554 2.063 3.593 0.003 12 0 "[ . 1 . 2]" 1
1447 1 123 ARG H 1 123 ARG QB . . 3.240 2.362 2.040 3.015 . 0 0 "[ . 1 . 2]" 1
1448 1 123 ARG H 1 123 ARG HB3 . . 3.590 3.300 2.333 3.607 0.017 15 0 "[ . 1 . 2]" 1
1449 1 123 ARG HA 1 124 THR H . . 3.560 2.763 2.107 3.521 . 0 0 "[ . 1 . 2]" 1
1450 1 123 ARG HB2 1 124 THR H . . 6.000 3.552 1.930 4.680 . 0 0 "[ . 1 . 2]" 1
1451 1 123 ARG HB3 1 124 THR H . . 6.000 3.217 2.101 4.358 . 0 0 "[ . 1 . 2]" 1
1452 1 124 THR MG 1 125 ASN H . . 5.640 3.975 3.511 4.415 . 0 0 "[ . 1 . 2]" 1
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