NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
493790 |
2koy   |
16536 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2koy
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 1316
_Distance_constraint_stats_list.Viol_count 2164
_Distance_constraint_stats_list.Viol_total 2217.357
_Distance_constraint_stats_list.Viol_max 0.345
_Distance_constraint_stats_list.Viol_rms 0.0203
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.0512
_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 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 MET 0.035 0.019 12 0 "[ . 1 . 2]"
1 5 VAL 0.109 0.019 12 0 "[ . 1 . 2]"
1 6 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 ARG 0.167 0.056 5 0 "[ . 1 . 2]"
1 8 VAL 0.190 0.056 5 0 "[ . 1 . 2]"
1 9 MET 0.084 0.054 5 0 "[ . 1 . 2]"
1 10 ARG 0.485 0.131 10 0 "[ . 1 . 2]"
1 11 VAL 0.933 0.131 10 0 "[ . 1 . 2]"
1 12 LEU 0.518 0.081 18 0 "[ . 1 . 2]"
1 13 LEU 0.314 0.072 7 0 "[ . 1 . 2]"
1 14 LEU 2.427 0.094 1 0 "[ . 1 . 2]"
1 15 GLY 4.103 0.125 10 0 "[ . 1 . 2]"
1 16 ASP 2.261 0.125 10 0 "[ . 1 . 2]"
1 17 VAL 2.664 0.133 10 0 "[ . 1 . 2]"
1 18 ALA 2.251 0.133 10 0 "[ . 1 . 2]"
1 19 THR 0.008 0.008 15 0 "[ . 1 . 2]"
1 20 LEU 0.475 0.059 10 0 "[ . 1 . 2]"
1 21 PRO 0.441 0.064 8 0 "[ . 1 . 2]"
1 22 LEU 0.306 0.064 8 0 "[ . 1 . 2]"
1 23 ARG 0.223 0.031 15 0 "[ . 1 . 2]"
1 24 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 VAL 0.140 0.039 2 0 "[ . 1 . 2]"
1 26 LEU 0.628 0.062 10 0 "[ . 1 . 2]"
1 27 ALA 0.014 0.012 12 0 "[ . 1 . 2]"
1 28 VAL 0.004 0.004 20 0 "[ . 1 . 2]"
1 29 VAL 0.519 0.062 10 0 "[ . 1 . 2]"
1 30 GLY 0.016 0.010 15 0 "[ . 1 . 2]"
1 31 THR 3.209 0.200 11 0 "[ . 1 . 2]"
1 32 ALA 0.762 0.080 3 0 "[ . 1 . 2]"
1 33 ALA 0.259 0.036 20 0 "[ . 1 . 2]"
1 34 ALA 0.005 0.003 14 0 "[ . 1 . 2]"
1 35 SER 0.181 0.039 16 0 "[ . 1 . 2]"
1 36 SER 0.516 0.126 20 0 "[ . 1 . 2]"
1 37 GLU 0.484 0.126 20 0 "[ . 1 . 2]"
1 38 HIS 0.397 0.092 15 0 "[ . 1 . 2]"
1 39 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLY 0.043 0.031 20 0 "[ . 1 . 2]"
1 42 VAL 0.487 0.038 6 0 "[ . 1 . 2]"
1 43 ALA 0.038 0.038 6 0 "[ . 1 . 2]"
1 44 VAL 0.465 0.099 3 0 "[ . 1 . 2]"
1 45 THR 0.491 0.099 3 0 "[ . 1 . 2]"
1 46 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 TYR 0.190 0.033 1 0 "[ . 1 . 2]"
1 48 CYS 0.717 0.123 20 0 "[ . 1 . 2]"
1 49 LYS 0.093 0.018 14 0 "[ . 1 . 2]"
1 50 GLU 0.969 0.123 20 0 "[ . 1 . 2]"
1 51 GLU 1.363 0.127 20 0 "[ . 1 . 2]"
1 52 LEU 1.331 0.086 20 0 "[ . 1 . 2]"
1 53 GLY 0.817 0.127 20 0 "[ . 1 . 2]"
1 54 THR 1.440 0.158 20 0 "[ . 1 . 2]"
1 55 GLU 1.282 0.219 14 0 "[ . 1 . 2]"
1 56 THR 2.525 0.219 14 0 "[ . 1 . 2]"
1 57 LEU 0.791 0.175 2 0 "[ . 1 . 2]"
1 58 GLY 2.666 0.298 16 0 "[ . 1 . 2]"
1 59 TYR 5.875 0.344 9 0 "[ . 1 . 2]"
1 60 CYS 1.681 0.298 13 0 "[ . 1 . 2]"
1 61 THR 0.213 0.053 16 0 "[ . 1 . 2]"
1 62 ASP 0.876 0.075 6 0 "[ . 1 . 2]"
1 63 PHE 3.195 0.345 4 0 "[ . 1 . 2]"
1 64 GLN 1.713 0.133 17 0 "[ . 1 . 2]"
1 65 ALA 2.356 0.211 16 0 "[ . 1 . 2]"
1 66 VAL 0.595 0.162 9 0 "[ . 1 . 2]"
1 67 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 CYS 0.260 0.127 9 0 "[ . 1 . 2]"
1 70 GLY 1.007 0.162 9 0 "[ . 1 . 2]"
1 71 ILE 1.996 0.211 16 0 "[ . 1 . 2]"
1 72 GLY 1.400 0.155 17 0 "[ . 1 . 2]"
1 73 CYS 4.387 0.345 4 0 "[ . 1 . 2]"
1 74 LYS 2.323 0.151 16 0 "[ . 1 . 2]"
1 75 VAL 5.719 0.344 9 0 "[ . 1 . 2]"
1 76 SER 8.787 0.298 13 0 "[ . 1 . 2]"
1 77 ASN 1.636 0.300 5 0 "[ . 1 . 2]"
1 78 VAL 0.542 0.127 1 0 "[ . 1 . 2]"
1 79 GLU 2.217 0.290 14 0 "[ . 1 . 2]"
1 80 GLY 1.112 0.153 20 0 "[ . 1 . 2]"
1 81 ILE 1.827 0.112 2 0 "[ . 1 . 2]"
1 82 LEU 1.937 0.112 2 0 "[ . 1 . 2]"
1 83 ALA 0.547 0.153 20 0 "[ . 1 . 2]"
1 84 ALA 0.897 0.101 18 0 "[ . 1 . 2]"
1 85 VAL 3.106 0.290 14 0 "[ . 1 . 2]"
1 86 PRO 1.847 0.129 19 0 "[ . 1 . 2]"
1 87 GLN 5.557 0.207 9 0 "[ . 1 . 2]"
1 88 THR 5.099 0.267 19 0 "[ . 1 . 2]"
1 89 PHE 1.484 0.162 18 0 "[ . 1 . 2]"
1 90 SER 3.933 0.162 18 0 "[ . 1 . 2]"
1 91 VAL 2.877 0.166 12 0 "[ . 1 . 2]"
1 92 LEU 0.575 0.090 19 0 "[ . 1 . 2]"
1 93 ILE 0.370 0.094 20 0 "[ . 1 . 2]"
1 94 GLY 1.669 0.085 18 0 "[ . 1 . 2]"
1 95 ASN 0.043 0.022 20 0 "[ . 1 . 2]"
1 96 ARG 2.648 0.244 11 0 "[ . 1 . 2]"
1 97 GLU 1.911 0.177 18 0 "[ . 1 . 2]"
1 98 TRP 1.829 0.092 8 0 "[ . 1 . 2]"
1 99 LEU 1.536 0.099 1 0 "[ . 1 . 2]"
1 100 ARG 4.153 0.165 1 0 "[ . 1 . 2]"
1 101 ARG 1.385 0.088 1 0 "[ . 1 . 2]"
1 102 ASN 2.292 0.109 12 0 "[ . 1 . 2]"
1 103 GLY 1.673 0.103 5 0 "[ . 1 . 2]"
1 104 LEU 3.601 0.165 1 0 "[ . 1 . 2]"
1 105 THR 0.906 0.067 17 0 "[ . 1 . 2]"
1 106 ILE 6.459 0.204 6 0 "[ . 1 . 2]"
1 107 SER 4.053 0.177 18 0 "[ . 1 . 2]"
1 108 SER 1.654 0.155 8 0 "[ . 1 . 2]"
1 109 ASP 3.257 0.204 6 0 "[ . 1 . 2]"
1 110 VAL 3.482 0.109 5 0 "[ . 1 . 2]"
1 111 SER 0.986 0.061 4 0 "[ . 1 . 2]"
1 112 ASP 2.316 0.109 1 0 "[ . 1 . 2]"
1 113 ALA 4.989 0.190 6 0 "[ . 1 . 2]"
1 114 MET 3.092 0.322 7 0 "[ . 1 . 2]"
1 115 THR 8.714 0.322 7 0 "[ . 1 . 2]"
1 116 ASP 2.686 0.145 4 0 "[ . 1 . 2]"
1 117 HIS 0.083 0.027 13 0 "[ . 1 . 2]"
1 118 GLU 2.026 0.210 20 0 "[ . 1 . 2]"
1 119 MET 0.054 0.040 18 0 "[ . 1 . 2]"
1 120 LYS 3.710 0.139 19 0 "[ . 1 . 2]"
1 121 GLY 2.994 0.136 19 0 "[ . 1 . 2]"
1 122 GLN 1.229 0.139 19 0 "[ . 1 . 2]"
1 123 THR 0.051 0.017 11 0 "[ . 1 . 2]"
1 124 ALA 0.075 0.027 13 0 "[ . 1 . 2]"
1 125 ILE 0.402 0.056 12 0 "[ . 1 . 2]"
1 126 LEU 0.704 0.153 15 0 "[ . 1 . 2]"
1 127 VAL 1.054 0.091 8 0 "[ . 1 . 2]"
1 128 ALA 1.975 0.100 7 0 "[ . 1 . 2]"
1 129 ILE 2.262 0.102 16 0 "[ . 1 . 2]"
1 130 ASP 0.207 0.049 10 0 "[ . 1 . 2]"
1 131 GLY 0.504 0.066 6 0 "[ . 1 . 2]"
1 132 VAL 2.166 0.100 7 0 "[ . 1 . 2]"
1 133 LEU 2.522 0.093 1 0 "[ . 1 . 2]"
1 134 CYS 0.455 0.067 15 0 "[ . 1 . 2]"
1 135 GLY 0.715 0.065 15 0 "[ . 1 . 2]"
1 136 MET 1.826 0.153 15 0 "[ . 1 . 2]"
1 137 ILE 1.822 0.096 11 0 "[ . 1 . 2]"
1 138 ALA 1.252 0.096 11 0 "[ . 1 . 2]"
1 139 ILE 0.896 0.081 17 0 "[ . 1 . 2]"
1 140 ALA 0.050 0.016 10 0 "[ . 1 . 2]"
1 141 ASP 0.044 0.044 5 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 21 PRO HA 1 24 LYS H . . 5.500 4.825 4.748 4.899 . 0 0 "[ . 1 . 2]" 1
2 1 23 ARG H 1 24 LYS H . . 3.580 2.814 2.752 2.899 . 0 0 "[ . 1 . 2]" 1
3 1 24 LYS H 1 25 VAL H . . 3.450 2.807 2.679 2.945 . 0 0 "[ . 1 . 2]" 1
4 1 102 ASN H 1 103 GLY HA2 . . 4.630 4.662 4.598 4.733 0.103 5 0 "[ . 1 . 2]" 1
5 1 99 LEU HA 1 102 ASN H . . 3.980 3.920 3.786 4.044 0.064 14 0 "[ . 1 . 2]" 1
6 1 102 ASN H 1 102 ASN HB2 . . 3.790 2.586 2.332 3.616 . 0 0 "[ . 1 . 2]" 1
7 1 102 ASN H 1 102 ASN HB3 . . 3.790 3.609 3.173 3.788 . 0 0 "[ . 1 . 2]" 1
8 1 101 ARG H 1 102 ASN H . . 3.450 2.616 2.477 2.774 . 0 0 "[ . 1 . 2]" 1
9 1 102 ASN H 1 103 GLY H . . 3.300 1.938 1.863 2.048 . 0 0 "[ . 1 . 2]" 1
10 1 100 ARG HA 1 102 ASN H . . 4.420 3.930 3.759 4.195 . 0 0 "[ . 1 . 2]" 1
11 1 102 ASN H 1 103 GLY HA3 . . 4.630 4.285 4.197 4.335 . 0 0 "[ . 1 . 2]" 1
12 1 100 ARG H 1 102 ASN H . . 4.820 3.968 3.854 4.236 . 0 0 "[ . 1 . 2]" 1
13 1 69 CYS HB3 1 70 GLY H . . 3.890 3.708 3.194 4.017 0.127 9 0 "[ . 1 . 2]" 1
14 1 69 CYS HB2 1 70 GLY H . . 3.890 2.622 2.275 3.510 . 0 0 "[ . 1 . 2]" 1
15 1 70 GLY H 1 71 ILE H . . 4.940 4.227 3.965 4.347 . 0 0 "[ . 1 . 2]" 1
16 1 66 VAL H 1 70 GLY H . . 4.660 4.569 4.355 4.822 0.162 9 0 "[ . 1 . 2]" 1
17 1 69 CYS H 1 70 GLY H . . 3.450 1.957 1.884 2.149 . 0 0 "[ . 1 . 2]" 1
18 1 10 ARG H 1 138 ALA H . . 4.070 3.062 2.888 3.474 . 0 0 "[ . 1 . 2]" 1
19 1 10 ARG H 1 11 VAL H . . 4.760 4.356 4.298 4.409 . 0 0 "[ . 1 . 2]" 1
20 1 8 VAL HA 1 10 ARG H . . 4.880 4.115 3.876 4.250 . 0 0 "[ . 1 . 2]" 1
21 1 9 MET H 1 10 ARG H . . 3.520 2.278 1.995 2.475 . 0 0 "[ . 1 . 2]" 1
22 1 117 HIS H 1 117 HIS HB2 . . 3.790 2.624 2.132 3.660 . 0 0 "[ . 1 . 2]" 1
23 1 117 HIS H 1 117 HIS HB3 . . 3.790 3.192 2.416 3.641 . 0 0 "[ . 1 . 2]" 1
24 1 116 ASP HB3 1 117 HIS H . . 4.320 2.926 2.686 3.329 . 0 0 "[ . 1 . 2]" 1
25 1 116 ASP HB2 1 117 HIS H . . 4.320 3.615 2.880 4.198 . 0 0 "[ . 1 . 2]" 1
26 1 30 GLY H 1 31 THR H . . 3.300 3.088 2.995 3.143 . 0 0 "[ . 1 . 2]" 1
27 1 31 THR H 1 31 THR HB . . 3.210 2.928 2.486 3.304 0.094 17 0 "[ . 1 . 2]" 1
28 1 31 THR H 1 76 SER HA . . 4.200 4.311 4.239 4.400 0.200 11 0 "[ . 1 . 2]" 1
29 1 31 THR H 1 33 ALA H . . 4.720 4.521 4.148 4.742 0.022 14 0 "[ . 1 . 2]" 1
30 1 117 HIS H 1 118 GLU H . . 3.300 2.307 2.178 2.404 . 0 0 "[ . 1 . 2]" 1
31 1 33 ALA HA 1 35 SER H . . 3.830 3.796 3.650 3.866 0.036 20 0 "[ . 1 . 2]" 1
32 1 35 SER H 1 35 SER HB3 . . 3.520 2.897 2.249 3.559 0.039 16 0 "[ . 1 . 2]" 1
33 1 35 SER H 1 35 SER HB2 . . 3.520 2.761 2.197 3.535 0.015 7 0 "[ . 1 . 2]" 1
34 1 118 GLU HA 1 120 LYS H . . 3.760 3.455 3.343 3.578 . 0 0 "[ . 1 . 2]" 1
35 1 117 HIS HA 1 120 LYS H . . 4.420 3.806 3.585 3.982 . 0 0 "[ . 1 . 2]" 1
36 1 120 LYS H 1 121 GLY HA2 . . 4.940 4.775 4.578 4.955 0.015 19 0 "[ . 1 . 2]" 1
37 1 120 LYS H 1 120 LYS HB3 . . 3.520 3.257 2.741 3.428 . 0 0 "[ . 1 . 2]" 1
38 1 120 LYS H 1 120 LYS HB2 . . 3.520 2.216 2.148 2.520 . 0 0 "[ . 1 . 2]" 1
39 1 120 LYS H 1 121 GLY HA3 . . 4.940 4.993 4.942 5.060 0.120 18 0 "[ . 1 . 2]" 1
40 1 109 ASP HB2 1 110 VAL H . . 3.950 3.446 3.086 3.825 . 0 0 "[ . 1 . 2]" 1
41 1 110 VAL H 1 110 VAL HB . . 3.140 2.550 2.504 2.610 . 0 0 "[ . 1 . 2]" 1
42 1 110 VAL H 1 112 ASP H . . 4.140 4.172 4.143 4.203 0.063 4 0 "[ . 1 . 2]" 1
43 1 110 VAL H 1 111 SER H . . 3.080 2.695 2.633 2.737 . 0 0 "[ . 1 . 2]" 1
44 1 108 SER HA 1 110 VAL H . . 4.820 4.668 4.478 4.846 0.026 10 0 "[ . 1 . 2]" 1
45 1 109 ASP HB3 1 110 VAL H . . 3.950 2.506 2.193 2.861 . 0 0 "[ . 1 . 2]" 1
46 1 13 LEU H 1 14 LEU H . . 4.450 4.411 4.318 4.474 0.024 10 0 "[ . 1 . 2]" 1
47 1 14 LEU H 1 14 LEU HB3 . . 4.010 3.578 3.501 3.696 . 0 0 "[ . 1 . 2]" 1
48 1 14 LEU H 1 14 LEU HB2 . . 4.010 2.340 2.221 2.555 . 0 0 "[ . 1 . 2]" 1
49 1 14 LEU H 1 136 MET H . . 4.170 4.195 4.112 4.233 0.063 7 0 "[ . 1 . 2]" 1
50 1 14 LEU H 1 135 GLY HA3 . . 4.230 3.406 2.981 3.804 . 0 0 "[ . 1 . 2]" 1
51 1 14 LEU H 1 135 GLY HA2 . . 4.230 2.082 1.936 2.352 . 0 0 "[ . 1 . 2]" 1
52 1 110 VAL HA 1 113 ALA H . . 3.640 3.706 3.626 3.749 0.109 5 0 "[ . 1 . 2]" 1
53 1 112 ASP HB3 1 113 ALA H . . 3.890 2.525 2.397 2.632 . 0 0 "[ . 1 . 2]" 1
54 1 112 ASP HB2 1 113 ALA H . . 3.890 3.841 3.770 3.890 . 0 0 "[ . 1 . 2]" 1
55 1 113 ALA H 1 115 THR H . . 4.290 4.382 4.340 4.480 0.190 6 0 "[ . 1 . 2]" 1
56 1 113 ALA H 1 114 MET H . . 3.210 2.663 2.566 2.765 . 0 0 "[ . 1 . 2]" 1
57 1 78 VAL HA 1 81 ILE H . . 4.480 3.530 3.185 4.144 . 0 0 "[ . 1 . 2]" 1
58 1 79 GLU HA 1 81 ILE H . . 4.320 4.151 3.839 4.357 0.037 17 0 "[ . 1 . 2]" 1
59 1 81 ILE H 1 81 ILE HB . . 3.270 2.675 2.460 2.966 . 0 0 "[ . 1 . 2]" 1
60 1 80 GLY H 1 81 ILE H . . 3.520 2.561 2.415 2.804 . 0 0 "[ . 1 . 2]" 1
61 1 81 ILE H 1 83 ALA H . . 4.380 3.675 3.274 3.960 . 0 0 "[ . 1 . 2]" 1
62 1 36 SER H 1 37 GLU H . . 4.450 4.454 4.381 4.576 0.126 20 0 "[ . 1 . 2]" 1
63 1 35 SER HB2 1 36 SER H . . 5.000 4.275 3.730 4.568 . 0 0 "[ . 1 . 2]" 1
64 1 33 ALA HA 1 36 SER H . . 3.640 3.552 2.823 3.676 0.036 20 0 "[ . 1 . 2]" 1
65 1 35 SER H 1 36 SER H . . 3.050 2.526 2.084 2.632 . 0 0 "[ . 1 . 2]" 1
66 1 35 SER HB3 1 36 SER H . . 5.000 4.013 3.125 4.656 . 0 0 "[ . 1 . 2]" 1
67 1 84 ALA HA 1 85 VAL H . . 3.520 3.543 3.512 3.573 0.053 14 0 "[ . 1 . 2]" 1
68 1 85 VAL H 1 85 VAL HB . . 3.580 3.185 2.700 3.713 0.133 2 0 "[ . 1 . 2]" 1
69 1 79 GLU HA 1 85 VAL H . . 4.940 4.273 4.012 4.853 . 0 0 "[ . 1 . 2]" 1
70 1 83 ALA H 1 85 VAL H . . 5.500 4.172 3.830 4.821 . 0 0 "[ . 1 . 2]" 1
71 1 52 LEU HB2 1 54 THR H . . 4.010 3.648 3.319 3.866 . 0 0 "[ . 1 . 2]" 1
72 1 54 THR H 1 55 GLU H . . 4.450 4.368 4.303 4.434 . 0 0 "[ . 1 . 2]" 1
73 1 54 THR H 1 56 THR H . . 4.790 4.838 4.785 4.898 0.108 2 0 "[ . 1 . 2]" 1
74 1 54 THR H 1 55 GLU HA . . 4.940 4.781 4.667 5.021 0.081 20 0 "[ . 1 . 2]" 1
75 1 52 LEU HB3 1 54 THR H . . 4.010 2.482 2.268 2.707 . 0 0 "[ . 1 . 2]" 1
76 1 52 LEU HA 1 54 THR H . . 4.540 4.524 4.322 4.594 0.054 20 0 "[ . 1 . 2]" 1
77 1 28 VAL HA 1 32 ALA H . . 4.480 3.744 3.628 3.947 . 0 0 "[ . 1 . 2]" 1
78 1 29 VAL HA 1 32 ALA H . . 4.320 4.042 3.937 4.184 . 0 0 "[ . 1 . 2]" 1
79 1 31 THR H 1 32 ALA H . . 3.450 2.720 2.615 2.884 . 0 0 "[ . 1 . 2]" 1
80 1 32 ALA H 1 76 SER HA . . 4.630 4.656 4.538 4.710 0.080 3 0 "[ . 1 . 2]" 1
81 1 30 GLY H 1 32 ALA H . . 4.630 4.116 3.942 4.354 . 0 0 "[ . 1 . 2]" 1
82 1 17 VAL HA 1 19 THR H . . 4.570 3.693 3.311 4.243 . 0 0 "[ . 1 . 2]" 1
83 1 18 ALA H 1 19 THR H . . 3.580 2.787 2.623 2.999 . 0 0 "[ . 1 . 2]" 1
84 1 17 VAL H 1 19 THR H . . 5.500 4.341 3.972 4.821 . 0 0 "[ . 1 . 2]" 1
85 1 19 THR H 1 20 LEU H . . 3.170 2.514 2.319 2.695 . 0 0 "[ . 1 . 2]" 1
86 1 33 ALA H 1 34 ALA H . . 3.670 2.623 2.485 2.850 . 0 0 "[ . 1 . 2]" 1
87 1 34 ALA H 1 35 SER H . . 3.670 2.682 2.625 2.734 . 0 0 "[ . 1 . 2]" 1
88 1 132 VAL H 1 132 VAL HB . . 3.390 2.839 2.783 2.895 . 0 0 "[ . 1 . 2]" 1
89 1 129 ILE HB 1 132 VAL H . . 5.220 4.968 4.421 5.291 0.071 7 0 "[ . 1 . 2]" 1
90 1 131 GLY H 1 132 VAL H . . 3.360 2.514 2.457 2.639 . 0 0 "[ . 1 . 2]" 1
91 1 129 ILE H 1 132 VAL H . . 3.580 2.829 2.717 2.943 . 0 0 "[ . 1 . 2]" 1
92 1 128 ALA HA 1 132 VAL H . . 4.290 4.326 4.283 4.390 0.100 7 0 "[ . 1 . 2]" 1
93 1 130 ASP HA 1 132 VAL H . . 4.540 4.524 4.361 4.589 0.049 10 0 "[ . 1 . 2]" 1
94 1 130 ASP H 1 132 VAL H . . 4.690 4.095 3.965 4.174 . 0 0 "[ . 1 . 2]" 1
95 1 132 VAL H 1 133 LEU H . . 4.040 4.093 4.053 4.133 0.093 1 0 "[ . 1 . 2]" 1
96 1 44 VAL HA 1 47 TYR H . . 4.070 3.626 3.467 3.815 . 0 0 "[ . 1 . 2]" 1
97 1 47 TYR H 1 48 CYS H . . 3.790 2.961 2.890 3.025 . 0 0 "[ . 1 . 2]" 1
98 1 44 VAL H 1 47 TYR H . . 5.070 4.841 4.643 4.999 . 0 0 "[ . 1 . 2]" 1
99 1 100 ARG HA 1 103 GLY H . . 3.700 2.988 2.852 3.093 . 0 0 "[ . 1 . 2]" 1
100 1 101 ARG HA 1 103 GLY H . . 4.420 4.450 4.399 4.488 0.068 4 0 "[ . 1 . 2]" 1
101 1 101 ARG H 1 103 GLY H . . 4.720 3.705 3.618 3.813 . 0 0 "[ . 1 . 2]" 1
102 1 103 GLY H 1 104 LEU H . . 4.010 2.448 2.231 2.589 . 0 0 "[ . 1 . 2]" 1
103 1 25 VAL H 1 27 ALA H . . 5.070 4.532 4.122 4.824 . 0 0 "[ . 1 . 2]" 1
104 1 22 LEU HA 1 25 VAL H . . 4.200 3.722 3.499 3.979 . 0 0 "[ . 1 . 2]" 1
105 1 25 VAL H 1 25 VAL HB . . 3.140 2.600 2.508 2.669 . 0 0 "[ . 1 . 2]" 1
106 1 25 VAL H 1 26 LEU H . . 3.420 2.838 2.793 2.939 . 0 0 "[ . 1 . 2]" 1
107 1 121 GLY HA2 1 122 GLN H . . 3.450 3.364 3.136 3.481 0.031 13 0 "[ . 1 . 2]" 1
108 1 118 GLU HA 1 122 GLN H . . 3.640 3.275 2.804 3.648 0.008 3 0 "[ . 1 . 2]" 1
109 1 120 LYS HA 1 122 GLN H . . 4.600 4.559 4.327 4.739 0.139 19 0 "[ . 1 . 2]" 1
110 1 121 GLY HA3 1 122 GLN H . . 3.450 3.159 2.982 3.395 . 0 0 "[ . 1 . 2]" 1
111 1 121 GLY H 1 122 GLN H . . 3.140 2.427 2.251 2.580 . 0 0 "[ . 1 . 2]" 1
112 1 120 LYS H 1 122 GLN H . . 3.760 3.402 3.278 3.526 . 0 0 "[ . 1 . 2]" 1
113 1 81 ILE HA 1 82 LEU H . . 3.450 3.528 3.438 3.562 0.112 2 0 "[ . 1 . 2]" 1
114 1 23 ARG HA 1 25 VAL H . . 5.410 4.875 4.560 5.072 . 0 0 "[ . 1 . 2]" 1
115 1 81 ILE H 1 82 LEU H . . 2.990 2.461 2.031 2.983 . 0 0 "[ . 1 . 2]" 1
116 1 42 VAL HB 1 43 ALA H . . 3.670 3.258 2.147 3.708 0.038 6 0 "[ . 1 . 2]" 1
117 1 97 GLU HA 1 99 LEU H . . 5.070 4.771 4.576 4.925 . 0 0 "[ . 1 . 2]" 1
118 1 43 ALA H 1 44 VAL H . . 3.360 2.879 2.683 2.999 . 0 0 "[ . 1 . 2]" 1
119 1 99 LEU H 1 99 LEU HB2 . . 3.270 2.353 2.043 2.781 . 0 0 "[ . 1 . 2]" 1
120 1 99 LEU H 1 99 LEU HB3 . . 3.270 2.718 2.267 3.274 0.004 17 0 "[ . 1 . 2]" 1
121 1 99 LEU H 1 100 ARG H . . 3.360 2.808 2.749 2.868 . 0 0 "[ . 1 . 2]" 1
122 1 58 GLY H 1 76 SER HA . . 4.880 4.886 4.283 5.178 0.298 16 0 "[ . 1 . 2]" 1
123 1 31 THR HA 1 58 GLY H . . 4.040 2.580 2.230 3.220 . 0 0 "[ . 1 . 2]" 1
124 1 31 THR H 1 58 GLY H . . 4.720 4.724 4.422 4.863 0.143 17 0 "[ . 1 . 2]" 1
125 1 102 ASN H 1 104 LEU H . . 4.290 3.827 3.477 4.017 . 0 0 "[ . 1 . 2]" 1
126 1 102 ASN HA 1 104 LEU H . . 4.350 4.351 4.232 4.419 0.069 8 0 "[ . 1 . 2]" 1
127 1 100 ARG HA 1 104 LEU H . . 3.790 3.044 2.910 3.137 . 0 0 "[ . 1 . 2]" 1
128 1 104 LEU H 1 105 THR H . . 4.290 4.335 4.316 4.357 0.067 17 0 "[ . 1 . 2]" 1
129 1 100 ARG H 1 104 LEU H . . 5.380 5.442 5.358 5.526 0.146 19 0 "[ . 1 . 2]" 1
130 1 52 LEU HB2 1 53 GLY H . . 4.260 3.339 3.035 3.531 . 0 0 "[ . 1 . 2]" 1
131 1 52 LEU HB3 1 53 GLY H . . 4.260 3.073 2.878 3.181 . 0 0 "[ . 1 . 2]" 1
132 1 52 LEU H 1 53 GLY H . . 3.300 2.302 2.150 2.512 . 0 0 "[ . 1 . 2]" 1
133 1 53 GLY H 1 54 THR H . . 3.270 2.391 2.225 2.515 . 0 0 "[ . 1 . 2]" 1
134 1 116 ASP H 1 116 ASP HA . . 2.860 2.811 2.782 2.843 . 0 0 "[ . 1 . 2]" 1
135 1 116 ASP H 1 116 ASP HB3 . . 3.300 2.765 2.238 3.412 0.112 15 0 "[ . 1 . 2]" 1
136 1 116 ASP H 1 116 ASP HB2 . . 3.300 2.500 2.073 2.883 . 0 0 "[ . 1 . 2]" 1
137 1 116 ASP H 1 118 GLU H . . 4.570 3.886 3.758 3.994 . 0 0 "[ . 1 . 2]" 1
138 1 114 MET H 1 116 ASP H . . 4.940 3.912 3.835 3.997 . 0 0 "[ . 1 . 2]" 1
139 1 113 ALA H 1 116 ASP H . . 5.130 4.530 4.473 4.577 . 0 0 "[ . 1 . 2]" 1
140 1 116 ASP H 1 117 HIS H . . 3.730 2.675 2.526 2.802 . 0 0 "[ . 1 . 2]" 1
141 1 114 MET HA 1 116 ASP H . . 4.720 4.360 4.221 4.553 . 0 0 "[ . 1 . 2]" 1
142 1 53 GLY H 1 54 THR HA . . 5.280 5.019 4.848 5.137 . 0 0 "[ . 1 . 2]" 1
143 1 20 LEU H 1 20 LEU HB2 . . 3.700 2.504 2.102 3.694 . 0 0 "[ . 1 . 2]" 1
144 1 20 LEU H 1 20 LEU HB3 . . 3.700 3.422 2.889 3.668 . 0 0 "[ . 1 . 2]" 1
145 1 17 VAL HA 1 20 LEU H . . 4.660 3.178 2.966 3.352 . 0 0 "[ . 1 . 2]" 1
146 1 18 ALA H 1 20 LEU H . . 4.760 4.055 3.757 4.193 . 0 0 "[ . 1 . 2]" 1
147 1 81 ILE HA 1 83 ALA H . . 5.070 4.773 4.421 5.109 0.039 10 0 "[ . 1 . 2]" 1
148 1 83 ALA H 1 84 ALA H . . 4.420 2.738 2.606 2.978 . 0 0 "[ . 1 . 2]" 1
149 1 82 LEU H 1 83 ALA H . . 3.640 2.497 2.213 2.843 . 0 0 "[ . 1 . 2]" 1
150 1 80 GLY H 1 83 ALA H . . 5.380 4.516 4.072 4.706 . 0 0 "[ . 1 . 2]" 1
151 1 86 PRO HA 1 87 GLN H . . 3.080 2.184 2.161 2.479 . 0 0 "[ . 1 . 2]" 1
152 1 67 PRO HA 1 69 CYS H . . 4.420 3.599 3.345 3.990 . 0 0 "[ . 1 . 2]" 1
153 1 126 LEU HA 1 135 GLY H . . 5.470 5.124 4.912 5.447 . 0 0 "[ . 1 . 2]" 1
154 1 134 CYS HB2 1 135 GLY H . . 4.790 3.908 3.599 4.058 . 0 0 "[ . 1 . 2]" 1
155 1 134 CYS HB3 1 135 GLY H . . 4.790 2.878 2.601 4.028 . 0 0 "[ . 1 . 2]" 1
156 1 128 ALA HA 1 135 GLY H . . 4.230 3.830 3.704 3.948 . 0 0 "[ . 1 . 2]" 1
157 1 134 CYS H 1 135 GLY H . . 3.050 2.207 1.968 2.600 . 0 0 "[ . 1 . 2]" 1
158 1 127 VAL H 1 135 GLY H . . 3.830 3.284 3.086 3.453 . 0 0 "[ . 1 . 2]" 1
159 1 14 LEU H 1 135 GLY H . . 5.070 3.910 3.682 4.133 . 0 0 "[ . 1 . 2]" 1
160 1 133 LEU HA 1 135 GLY H . . 3.760 3.768 3.677 3.825 0.065 15 0 "[ . 1 . 2]" 1
161 1 24 LYS HA 1 27 ALA H . . 5.220 3.783 3.676 3.888 . 0 0 "[ . 1 . 2]" 1
162 1 23 ARG HA 1 27 ALA H . . 5.220 3.985 3.810 4.092 . 0 0 "[ . 1 . 2]" 1
163 1 27 ALA H 1 28 VAL H . . 3.420 2.887 2.763 2.936 . 0 0 "[ . 1 . 2]" 1
164 1 82 LEU H 1 84 ALA H . . 4.880 4.625 4.308 4.981 0.101 18 0 "[ . 1 . 2]" 1
165 1 83 ALA HA 1 84 ALA H . . 3.360 2.882 2.604 3.109 . 0 0 "[ . 1 . 2]" 1
166 1 79 GLU HA 1 84 ALA H . . 4.230 3.739 2.617 4.275 0.045 3 0 "[ . 1 . 2]" 1
167 1 84 ALA H 1 85 VAL H . . 3.830 1.983 1.830 2.455 . 0 0 "[ . 1 . 2]" 1
168 1 47 TYR HA 1 50 GLU H . . 4.320 3.550 3.439 3.635 . 0 0 "[ . 1 . 2]" 1
169 1 48 CYS HA 1 50 GLU H . . 4.260 4.295 4.260 4.383 0.123 20 0 "[ . 1 . 2]" 1
170 1 48 CYS H 1 50 GLU H . . 4.660 4.274 4.173 4.393 . 0 0 "[ . 1 . 2]" 1
171 1 49 LYS HA 1 52 LEU H . . 4.140 3.598 3.479 3.724 . 0 0 "[ . 1 . 2]" 1
172 1 52 LEU H 1 52 LEU HB2 . . 3.270 2.176 2.075 2.311 . 0 0 "[ . 1 . 2]" 1
173 1 52 LEU H 1 52 LEU HB3 . . 3.270 3.163 2.989 3.356 0.086 20 0 "[ . 1 . 2]" 1
174 1 52 LEU H 1 54 THR H . . 4.230 3.967 3.810 4.184 . 0 0 "[ . 1 . 2]" 1
175 1 54 THR HA 1 56 THR H . . 4.140 3.736 3.525 4.298 0.158 20 0 "[ . 1 . 2]" 1
176 1 56 THR H 1 56 THR HB . . 3.790 3.224 2.760 3.670 . 0 0 "[ . 1 . 2]" 1
177 1 55 GLU H 1 56 THR H . . 3.950 2.518 2.141 2.604 . 0 0 "[ . 1 . 2]" 1
178 1 44 VAL H 1 44 VAL HB . . 3.640 2.909 2.558 3.617 . 0 0 "[ . 1 . 2]" 1
179 1 44 VAL H 1 45 THR H . . 3.270 2.788 2.740 2.830 . 0 0 "[ . 1 . 2]" 1
180 1 120 LYS HB2 1 121 GLY H . . 4.320 3.787 3.575 4.175 . 0 0 "[ . 1 . 2]" 1
181 1 118 GLU HA 1 121 GLY H . . 4.010 3.575 3.240 3.869 . 0 0 "[ . 1 . 2]" 1
182 1 120 LYS HA 1 121 GLY H . . 3.270 3.287 3.220 3.332 0.062 14 0 "[ . 1 . 2]" 1
183 1 120 LYS HB3 1 121 GLY H . . 4.320 3.797 3.520 3.977 . 0 0 "[ . 1 . 2]" 1
184 1 119 MET H 1 121 GLY H . . 4.510 4.169 4.069 4.262 . 0 0 "[ . 1 . 2]" 1
185 1 120 LYS H 1 121 GLY H . . 3.360 2.367 2.258 2.473 . 0 0 "[ . 1 . 2]" 1
186 1 25 VAL HA 1 28 VAL H . . 4.320 3.964 3.749 4.055 . 0 0 "[ . 1 . 2]" 1
187 1 28 VAL H 1 28 VAL HB . . 3.110 2.586 2.519 2.615 . 0 0 "[ . 1 . 2]" 1
188 1 28 VAL H 1 29 VAL H . . 3.360 3.132 3.055 3.182 . 0 0 "[ . 1 . 2]" 1
189 1 97 GLU H 1 97 GLU HB3 . . 3.050 2.859 2.529 3.055 0.005 6 0 "[ . 1 . 2]" 1
190 1 97 GLU H 1 97 GLU HB2 . . 3.050 2.247 2.118 2.518 . 0 0 "[ . 1 . 2]" 1
191 1 97 GLU H 1 98 TRP H . . 3.420 2.935 2.777 3.119 . 0 0 "[ . 1 . 2]" 1
192 1 96 ARG H 1 97 GLU H . . 3.420 2.833 2.768 2.910 . 0 0 "[ . 1 . 2]" 1
193 1 97 GLU H 1 99 LEU H . . 4.230 4.223 4.081 4.287 0.057 17 0 "[ . 1 . 2]" 1
194 1 95 ASN HA 1 97 GLU H . . 5.310 4.514 4.356 4.697 . 0 0 "[ . 1 . 2]" 1
195 1 69 CYS HA 1 97 GLU H . . 5.440 5.106 4.398 5.455 0.015 9 0 "[ . 1 . 2]" 1
196 1 4 MET HA 1 5 VAL H . . 2.990 2.868 2.261 3.009 0.019 12 0 "[ . 1 . 2]" 1
197 1 5 VAL H 1 5 VAL HB . . 3.300 2.998 2.714 3.318 0.018 19 0 "[ . 1 . 2]" 1
198 1 4 MET H 1 5 VAL H . . 5.250 2.818 2.306 3.894 . 0 0 "[ . 1 . 2]" 1
199 1 3 HIS HA 1 5 VAL H . . 4.690 3.812 3.090 4.683 . 0 0 "[ . 1 . 2]" 1
200 1 15 GLY H 1 16 ASP H . . 4.320 4.433 4.379 4.445 0.125 10 0 "[ . 1 . 2]" 1
201 1 104 LEU HA 1 105 THR H . . 2.800 2.492 2.159 2.757 . 0 0 "[ . 1 . 2]" 1
202 1 105 THR H 1 105 THR HB . . 3.020 2.629 2.451 2.948 . 0 0 "[ . 1 . 2]" 1
203 1 104 LEU QB 1 105 THR H . . 4.460 2.719 1.875 3.919 . 0 0 "[ . 1 . 2]" 1
204 1 15 GLY H 1 134 CYS HA . . 4.350 2.189 1.939 2.530 . 0 0 "[ . 1 . 2]" 1
205 1 14 LEU HA 1 15 GLY H . . 3.480 3.560 3.549 3.574 0.094 1 0 "[ . 1 . 2]" 1
206 1 14 LEU HB3 1 15 GLY H . . 4.010 2.637 2.385 3.157 . 0 0 "[ . 1 . 2]" 1
207 1 14 LEU HB2 1 15 GLY H . . 4.010 2.165 1.948 2.373 . 0 0 "[ . 1 . 2]" 1
208 1 14 LEU H 1 15 GLY H . . 3.700 2.693 2.485 2.764 . 0 0 "[ . 1 . 2]" 1
209 1 111 SER H 1 111 SER HB3 . . 3.110 2.542 2.111 3.112 0.002 11 0 "[ . 1 . 2]" 1
210 1 111 SER H 1 111 SER HB2 . . 3.110 2.641 2.117 3.106 . 0 0 "[ . 1 . 2]" 1
211 1 110 VAL HB 1 111 SER H . . 3.360 2.537 2.488 2.592 . 0 0 "[ . 1 . 2]" 1
212 1 109 ASP H 1 111 SER H . . 4.380 4.039 3.958 4.121 . 0 0 "[ . 1 . 2]" 1
213 1 109 ASP HA 1 111 SER H . . 4.570 4.608 4.582 4.631 0.061 4 0 "[ . 1 . 2]" 1
214 1 111 SER HA 1 114 MET H . . 4.820 3.535 3.428 3.646 . 0 0 "[ . 1 . 2]" 1
215 1 110 VAL HA 1 114 MET H . . 5.410 4.033 3.891 4.136 . 0 0 "[ . 1 . 2]" 1
216 1 114 MET H 1 114 MET HB3 . . 3.580 3.102 2.449 3.580 . 0 0 "[ . 1 . 2]" 1
217 1 114 MET H 1 114 MET HB2 . . 3.580 2.320 2.093 2.598 . 0 0 "[ . 1 . 2]" 1
218 1 112 ASP HA 1 114 MET H . . 4.540 4.600 4.575 4.649 0.109 1 0 "[ . 1 . 2]" 1
219 1 41 GLY H 1 42 VAL H . . 4.570 2.945 2.792 3.028 . 0 0 "[ . 1 . 2]" 1
220 1 42 VAL H 1 43 ALA H . . 4.570 2.803 2.749 2.975 . 0 0 "[ . 1 . 2]" 1
221 1 42 VAL H 1 42 VAL HB . . 3.580 3.310 2.571 3.613 0.033 18 0 "[ . 1 . 2]" 1
222 1 141 ASP H 1 141 ASP HB2 . . 3.790 2.660 2.102 3.578 . 0 0 "[ . 1 . 2]" 1
223 1 141 ASP H 1 141 ASP HB3 . . 3.790 3.111 2.349 3.763 . 0 0 "[ . 1 . 2]" 1
224 1 140 ALA H 1 141 ASP H . . 4.320 3.819 2.548 4.308 . 0 0 "[ . 1 . 2]" 1
225 1 7 ARG H 1 141 ASP H . . 5.500 5.115 3.702 5.544 0.044 5 0 "[ . 1 . 2]" 1
226 1 140 ALA HA 1 141 ASP H . . 3.360 2.336 2.140 3.331 . 0 0 "[ . 1 . 2]" 1
227 1 47 TYR H 1 49 LYS H . . 4.820 3.918 3.748 4.112 . 0 0 "[ . 1 . 2]" 1
228 1 54 THR HB 1 55 GLU H . . 3.950 3.784 2.185 3.986 0.036 8 0 "[ . 1 . 2]" 1
229 1 54 THR HA 1 55 GLU H . . 2.800 2.238 2.161 2.686 . 0 0 "[ . 1 . 2]" 1
230 1 55 GLU H 1 55 GLU HB3 . . 3.520 2.835 2.655 3.520 . 0 0 "[ . 1 . 2]" 1
231 1 55 GLU H 1 55 GLU HB2 . . 3.520 2.749 2.266 3.612 0.092 12 0 "[ . 1 . 2]" 1
232 1 45 THR HA 1 49 LYS H . . 4.940 4.010 3.846 4.178 . 0 0 "[ . 1 . 2]" 1
233 1 48 CYS HB3 1 49 LYS H . . 4.350 3.670 2.712 4.029 . 0 0 "[ . 1 . 2]" 1
234 1 48 CYS HB2 1 49 LYS H . . 4.350 3.533 2.662 3.955 . 0 0 "[ . 1 . 2]" 1
235 1 49 LYS H 1 49 LYS HB2 . . 3.110 2.608 2.360 2.712 . 0 0 "[ . 1 . 2]" 1
236 1 49 LYS H 1 49 LYS HB3 . . 3.110 2.450 2.361 2.703 . 0 0 "[ . 1 . 2]" 1
237 1 49 LYS H 1 50 GLU H . . 3.050 2.621 2.550 2.687 . 0 0 "[ . 1 . 2]" 1
238 1 47 TYR HA 1 49 LYS H . . 4.350 4.297 4.192 4.368 0.018 14 0 "[ . 1 . 2]" 1
239 1 127 VAL H 1 133 LEU HA . . 5.500 5.190 5.052 5.359 . 0 0 "[ . 1 . 2]" 1
240 1 126 LEU HB3 1 127 VAL H . . 4.230 3.227 2.953 3.830 . 0 0 "[ . 1 . 2]" 1
241 1 127 VAL H 1 127 VAL HB . . 3.270 2.858 2.651 3.154 . 0 0 "[ . 1 . 2]" 1
242 1 127 VAL H 1 128 ALA H . . 4.510 4.407 4.321 4.481 . 0 0 "[ . 1 . 2]" 1
243 1 127 VAL H 1 137 ILE H . . 5.130 4.449 4.018 4.765 . 0 0 "[ . 1 . 2]" 1
244 1 126 LEU HB2 1 127 VAL H . . 4.230 3.437 2.343 4.131 . 0 0 "[ . 1 . 2]" 1
245 1 126 LEU H 1 127 VAL H . . 5.100 4.438 4.337 4.525 . 0 0 "[ . 1 . 2]" 1
246 1 127 VAL H 1 136 MET H . . 5.100 4.688 4.600 4.860 . 0 0 "[ . 1 . 2]" 1
247 1 127 VAL H 1 136 MET HA . . 3.950 2.951 2.663 3.322 . 0 0 "[ . 1 . 2]" 1
248 1 126 LEU HA 1 127 VAL H . . 3.110 2.250 2.149 2.436 . 0 0 "[ . 1 . 2]" 1
249 1 127 VAL H 1 128 ALA HA . . 5.130 4.999 4.786 5.144 0.014 16 0 "[ . 1 . 2]" 1
250 1 76 SER HA 1 78 VAL H . . 4.510 3.520 3.464 3.733 . 0 0 "[ . 1 . 2]" 1
251 1 76 SER HB3 1 78 VAL H . . 5.440 4.203 2.762 4.781 . 0 0 "[ . 1 . 2]" 1
252 1 76 SER HB2 1 78 VAL H . . 5.440 3.305 2.656 5.082 . 0 0 "[ . 1 . 2]" 1
253 1 77 ASN HB2 1 78 VAL H . . 5.070 4.126 3.593 4.333 . 0 0 "[ . 1 . 2]" 1
254 1 77 ASN HB3 1 78 VAL H . . 5.070 3.485 2.910 3.880 . 0 0 "[ . 1 . 2]" 1
255 1 78 VAL H 1 78 VAL HB . . 4.010 3.091 2.415 3.619 . 0 0 "[ . 1 . 2]" 1
256 1 77 ASN H 1 78 VAL H . . 3.730 2.290 2.153 2.375 . 0 0 "[ . 1 . 2]" 1
257 1 78 VAL H 1 79 GLU H . . 3.580 2.873 2.759 3.301 . 0 0 "[ . 1 . 2]" 1
258 1 97 GLU HA 1 100 ARG H . . 3.830 3.865 3.789 3.968 0.138 12 0 "[ . 1 . 2]" 1
259 1 100 ARG H 1 101 ARG H . . 3.640 2.355 2.298 2.427 . 0 0 "[ . 1 . 2]" 1
260 1 96 ARG HA 1 100 ARG H . . 5.070 3.881 3.565 4.202 . 0 0 "[ . 1 . 2]" 1
261 1 16 ASP H 1 17 VAL H . . 4.720 4.518 4.431 4.628 . 0 0 "[ . 1 . 2]" 1
262 1 16 ASP HA 1 17 VAL H . . 3.270 2.535 2.245 2.638 . 0 0 "[ . 1 . 2]" 1
263 1 16 ASP HB3 1 17 VAL H . . 4.230 2.750 2.312 3.853 . 0 0 "[ . 1 . 2]" 1
264 1 16 ASP HB2 1 17 VAL H . . 4.230 3.843 3.706 4.208 . 0 0 "[ . 1 . 2]" 1
265 1 17 VAL H 1 17 VAL HB . . 3.860 3.534 2.677 3.734 . 0 0 "[ . 1 . 2]" 1
266 1 51 GLU H 1 51 GLU HB3 . . 3.330 3.061 2.701 3.330 . 0 0 "[ . 1 . 2]" 1
267 1 51 GLU H 1 51 GLU HB2 . . 3.330 2.204 2.107 2.437 . 0 0 "[ . 1 . 2]" 1
268 1 51 GLU H 1 52 LEU H . . 2.990 2.420 2.327 2.490 . 0 0 "[ . 1 . 2]" 1
269 1 50 GLU H 1 51 GLU H . . 2.990 2.414 2.320 2.543 . 0 0 "[ . 1 . 2]" 1
270 1 51 GLU H 1 53 GLY H . . 4.230 3.778 3.610 3.997 . 0 0 "[ . 1 . 2]" 1
271 1 51 GLU H 1 52 LEU HA . . 5.070 5.096 5.028 5.138 0.068 14 0 "[ . 1 . 2]" 1
272 1 17 VAL H 1 20 LEU H . . 5.130 5.127 4.884 5.189 0.059 10 0 "[ . 1 . 2]" 1
273 1 129 ILE H 1 133 LEU HA . . 3.700 3.521 3.396 3.631 . 0 0 "[ . 1 . 2]" 1
274 1 129 ILE H 1 129 ILE HB . . 3.700 3.373 2.700 3.802 0.102 16 0 "[ . 1 . 2]" 1
275 1 129 ILE H 1 130 ASP H . . 4.660 4.353 4.124 4.435 . 0 0 "[ . 1 . 2]" 1
276 1 129 ILE H 1 132 VAL HB . . 4.480 3.739 3.598 4.006 . 0 0 "[ . 1 . 2]" 1
277 1 129 ILE H 1 134 CYS H . . 3.830 3.301 2.618 3.598 . 0 0 "[ . 1 . 2]" 1
278 1 129 ILE H 1 133 LEU H . . 4.510 4.542 4.512 4.579 0.069 12 0 "[ . 1 . 2]" 1
279 1 129 ILE H 1 135 GLY H . . 5.500 5.417 4.866 5.542 0.042 15 0 "[ . 1 . 2]" 1
280 1 128 ALA HA 1 129 ILE H . . 3.020 2.238 2.182 2.264 . 0 0 "[ . 1 . 2]" 1
281 1 63 PHE H 1 63 PHE HB3 . . 3.420 2.685 2.467 3.063 . 0 0 "[ . 1 . 2]" 1
282 1 63 PHE H 1 63 PHE HB2 . . 3.420 3.102 2.553 3.441 0.021 4 0 "[ . 1 . 2]" 1
283 1 63 PHE H 1 73 CYS HA . . 4.690 4.518 3.905 4.839 0.149 19 0 "[ . 1 . 2]" 1
284 1 88 THR H 1 89 PHE H . . 4.660 4.328 4.023 4.569 . 0 0 "[ . 1 . 2]" 1
285 1 87 GLN HA 1 88 THR H . . 3.050 2.188 2.163 2.326 . 0 0 "[ . 1 . 2]" 1
286 1 88 THR H 1 88 THR HB . . 3.420 3.234 2.576 3.410 . 0 0 "[ . 1 . 2]" 1
287 1 87 GLN H 1 88 THR H . . 4.230 3.881 3.725 4.409 0.179 17 0 "[ . 1 . 2]" 1
288 1 65 ALA HA 1 66 VAL H . . 3.420 2.247 2.142 2.331 . 0 0 "[ . 1 . 2]" 1
289 1 66 VAL H 1 71 ILE HA . . 5.070 2.992 2.379 3.477 . 0 0 "[ . 1 . 2]" 1
290 1 56 THR HA 1 57 LEU H . . 3.080 2.229 2.143 3.212 0.132 2 0 "[ . 1 . 2]" 1
291 1 56 THR HB 1 57 LEU H . . 4.010 3.916 3.055 4.100 0.090 6 0 "[ . 1 . 2]" 1
292 1 56 THR H 1 57 LEU H . . 4.320 4.182 2.588 4.409 0.089 14 0 "[ . 1 . 2]" 1
293 1 57 LEU H 1 58 GLY H . . 4.450 4.319 4.183 4.625 0.175 2 0 "[ . 1 . 2]" 1
294 1 10 ARG HA 1 11 VAL H . . 3.360 2.323 2.238 2.389 . 0 0 "[ . 1 . 2]" 1
295 1 11 VAL H 1 11 VAL HB . . 3.640 3.317 2.913 3.767 0.127 1 0 "[ . 1 . 2]" 1
296 1 10 ARG HB3 1 11 VAL H . . 3.790 2.908 2.488 3.790 0.000 7 0 "[ . 1 . 2]" 1
297 1 10 ARG HB2 1 11 VAL H . . 3.790 3.688 2.560 3.921 0.131 10 0 "[ . 1 . 2]" 1
298 1 37 GLU HB3 1 38 HIS H . . 5.070 4.025 3.513 4.618 . 0 0 "[ . 1 . 2]" 1
299 1 37 GLU HA 1 38 HIS H . . 3.360 3.196 2.921 3.378 0.018 11 0 "[ . 1 . 2]" 1
300 1 38 HIS H 1 38 HIS HB2 . . 3.520 2.591 2.112 3.612 0.092 15 0 "[ . 1 . 2]" 1
301 1 38 HIS H 1 38 HIS HB3 . . 3.520 3.286 2.722 3.518 . 0 0 "[ . 1 . 2]" 1
302 1 37 GLU HB2 1 38 HIS H . . 5.070 4.062 3.719 4.423 . 0 0 "[ . 1 . 2]" 1
303 1 78 VAL HA 1 80 GLY H . . 4.450 4.406 4.089 4.577 0.127 1 0 "[ . 1 . 2]" 1
304 1 79 GLU H 1 80 GLY H . . 4.100 2.607 2.424 2.850 . 0 0 "[ . 1 . 2]" 1
305 1 80 GLY H 1 82 LEU H . . 5.500 4.388 3.698 4.989 . 0 0 "[ . 1 . 2]" 1
306 1 109 ASP H 1 109 ASP HB2 . . 3.240 2.292 2.098 2.781 . 0 0 "[ . 1 . 2]" 1
307 1 109 ASP H 1 109 ASP HB3 . . 3.240 2.878 2.322 3.216 . 0 0 "[ . 1 . 2]" 1
308 1 108 SER H 1 109 ASP H . . 3.610 2.650 2.576 2.723 . 0 0 "[ . 1 . 2]" 1
309 1 107 SER H 1 109 ASP H . . 5.220 5.186 4.969 5.302 0.082 12 0 "[ . 1 . 2]" 1
310 1 109 ASP H 1 110 VAL H . . 3.240 2.635 2.506 2.776 . 0 0 "[ . 1 . 2]" 1
311 1 109 ASP H 1 110 VAL HA . . 5.500 5.243 5.150 5.340 . 0 0 "[ . 1 . 2]" 1
312 1 109 ASP H 1 110 VAL HB . . 4.880 4.822 4.740 4.917 0.037 10 0 "[ . 1 . 2]" 1
313 1 79 GLU HB2 1 80 GLY H . . 4.200 3.769 2.873 4.066 . 0 0 "[ . 1 . 2]" 1
314 1 79 GLU HB3 1 80 GLY H . . 4.200 3.636 2.601 4.272 0.072 20 0 "[ . 1 . 2]" 1
315 1 16 ASP H 1 16 ASP HB3 . . 3.210 3.037 2.598 3.203 . 0 0 "[ . 1 . 2]" 1
316 1 16 ASP H 1 16 ASP HB2 . . 3.210 2.322 2.073 2.802 . 0 0 "[ . 1 . 2]" 1
317 1 45 THR HA 1 48 CYS H . . 4.070 3.982 3.795 4.073 0.003 7 0 "[ . 1 . 2]" 1
318 1 48 CYS H 1 49 LYS H . . 4.010 2.725 2.620 2.784 . 0 0 "[ . 1 . 2]" 1
319 1 105 THR HB 1 106 ILE H . . 3.580 2.214 1.926 2.667 . 0 0 "[ . 1 . 2]" 1
320 1 106 ILE H 1 106 ILE HB . . 3.170 3.040 2.552 3.355 0.185 12 0 "[ . 1 . 2]" 1
321 1 105 THR H 1 106 ILE H . . 3.860 2.500 1.841 2.981 . 0 0 "[ . 1 . 2]" 1
322 1 16 ASP HA 1 18 ALA H . . 4.230 4.077 3.715 4.205 . 0 0 "[ . 1 . 2]" 1
323 1 17 VAL HA 1 18 ALA H . . 3.240 3.288 3.216 3.317 0.077 16 0 "[ . 1 . 2]" 1
324 1 17 VAL HB 1 18 ALA H . . 4.070 4.083 3.513 4.203 0.133 10 0 "[ . 1 . 2]" 1
325 1 17 VAL H 1 18 ALA H . . 4.140 1.981 1.884 2.375 . 0 0 "[ . 1 . 2]" 1
326 1 6 PRO HB2 1 7 ARG H . . 4.070 2.851 2.069 3.416 . 0 0 "[ . 1 . 2]" 1
327 1 7 ARG H 1 8 VAL H . . 3.860 3.864 3.849 3.916 0.056 5 0 "[ . 1 . 2]" 1
328 1 6 PRO HA 1 7 ARG H . . 3.050 2.338 2.167 2.640 . 0 0 "[ . 1 . 2]" 1
329 1 7 ARG H 1 139 ILE HA . . 5.500 4.663 3.825 5.279 . 0 0 "[ . 1 . 2]" 1
330 1 7 ARG H 1 140 ALA H . . 4.100 3.733 2.988 4.066 . 0 0 "[ . 1 . 2]" 1
331 1 6 PRO HB3 1 7 ARG H . . 4.070 3.600 3.208 3.922 . 0 0 "[ . 1 . 2]" 1
332 1 115 THR H 1 115 THR HB . . 2.930 2.952 2.647 3.102 0.172 11 0 "[ . 1 . 2]" 1
333 1 114 MET HB3 1 115 THR H . . 3.450 2.729 2.287 3.374 . 0 0 "[ . 1 . 2]" 1
334 1 114 MET HB2 1 115 THR H . . 3.450 3.123 2.446 3.772 0.322 7 0 "[ . 1 . 2]" 1
335 1 114 MET H 1 115 THR H . . 3.450 2.861 2.820 2.926 . 0 0 "[ . 1 . 2]" 1
336 1 115 THR H 1 116 ASP H . . 3.640 2.518 2.464 2.575 . 0 0 "[ . 1 . 2]" 1
337 1 115 THR H 1 117 HIS H . . 4.790 4.262 4.013 4.472 . 0 0 "[ . 1 . 2]" 1
338 1 112 ASP H 1 115 THR H . . 5.000 4.943 4.865 5.025 0.025 17 0 "[ . 1 . 2]" 1
339 1 93 ILE H 1 93 ILE HB . . 3.110 2.947 2.605 3.204 0.094 20 0 "[ . 1 . 2]" 1
340 1 93 ILE H 1 94 GLY H . . 4.450 4.207 3.879 4.399 . 0 0 "[ . 1 . 2]" 1
341 1 71 ILE H 1 93 ILE H . . 3.790 3.133 2.710 3.508 . 0 0 "[ . 1 . 2]" 1
342 1 92 LEU HA 1 93 ILE H . . 3.110 2.245 2.140 2.422 . 0 0 "[ . 1 . 2]" 1
343 1 65 ALA H 1 71 ILE HA . . 5.500 5.585 5.519 5.711 0.211 16 0 "[ . 1 . 2]" 1
344 1 64 GLN HA 1 65 ALA H . . 3.110 2.151 2.139 2.169 . 0 0 "[ . 1 . 2]" 1
345 1 64 GLN HB3 1 65 ALA H . . 4.200 3.644 3.176 4.292 0.092 14 0 "[ . 1 . 2]" 1
346 1 64 GLN HB2 1 65 ALA H . . 4.200 4.166 3.714 4.278 0.078 11 0 "[ . 1 . 2]" 1
347 1 45 THR H 1 45 THR HB . . 3.300 2.553 2.478 2.686 . 0 0 "[ . 1 . 2]" 1
348 1 42 VAL HA 1 45 THR H . . 3.950 3.813 3.627 3.958 0.008 15 0 "[ . 1 . 2]" 1
349 1 44 VAL HB 1 45 THR H . . 3.830 3.216 2.356 3.929 0.099 3 0 "[ . 1 . 2]" 1
350 1 45 THR H 1 47 TYR H . . 4.450 4.167 3.885 4.454 0.004 2 0 "[ . 1 . 2]" 1
351 1 95 ASN HA 1 96 ARG H . . 3.520 2.740 2.660 2.777 . 0 0 "[ . 1 . 2]" 1
352 1 95 ASN HB3 1 96 ARG H . . 3.580 3.489 3.218 3.543 . 0 0 "[ . 1 . 2]" 1
353 1 95 ASN HB2 1 96 ARG H . . 3.580 1.960 1.881 2.077 . 0 0 "[ . 1 . 2]" 1
354 1 137 ILE HA 1 138 ALA H . . 3.050 2.235 2.215 2.271 . 0 0 "[ . 1 . 2]" 1
355 1 11 VAL HA 1 138 ALA H . . 3.830 3.379 3.102 3.593 . 0 0 "[ . 1 . 2]" 1
356 1 137 ILE HB 1 138 ALA H . . 3.860 3.893 3.731 3.956 0.096 11 0 "[ . 1 . 2]" 1
357 1 138 ALA H 1 139 ILE H . . 4.260 4.216 4.056 4.327 0.067 10 0 "[ . 1 . 2]" 1
358 1 9 MET H 1 138 ALA H . . 5.130 4.256 3.962 4.476 . 0 0 "[ . 1 . 2]" 1
359 1 32 ALA H 1 33 ALA H . . 3.360 2.974 2.806 3.078 . 0 0 "[ . 1 . 2]" 1
360 1 59 TYR H 1 59 TYR HB3 . . 4.100 2.831 2.454 3.529 . 0 0 "[ . 1 . 2]" 1
361 1 59 TYR H 1 59 TYR HB2 . . 4.100 2.585 2.230 2.823 . 0 0 "[ . 1 . 2]" 1
362 1 59 TYR H 1 76 SER H . . 3.830 3.801 3.645 3.905 0.075 5 0 "[ . 1 . 2]" 1
363 1 58 GLY H 1 59 TYR H . . 4.200 2.251 2.140 2.596 . 0 0 "[ . 1 . 2]" 1
364 1 59 TYR H 1 76 SER HA . . 5.220 4.448 4.069 4.638 . 0 0 "[ . 1 . 2]" 1
365 1 59 TYR H 1 75 VAL HA . . 4.690 4.939 4.810 5.034 0.344 9 0 "[ . 1 . 2]" 1
366 1 59 TYR H 1 77 ASN HA . . 5.130 3.710 3.113 4.058 . 0 0 "[ . 1 . 2]" 1
367 1 107 SER H 1 107 SER HB2 . . 3.580 2.607 2.080 3.291 . 0 0 "[ . 1 . 2]" 1
368 1 107 SER H 1 111 SER H . . 5.220 4.418 4.045 4.865 . 0 0 "[ . 1 . 2]" 1
369 1 107 SER H 1 107 SER HB3 . . 3.580 3.352 2.852 3.574 . 0 0 "[ . 1 . 2]" 1
370 1 106 ILE HA 1 107 SER H . . 2.800 2.203 2.167 2.239 . 0 0 "[ . 1 . 2]" 1
371 1 107 SER H 1 110 VAL HB . . 3.980 3.725 2.682 4.004 0.024 1 0 "[ . 1 . 2]" 1
372 1 106 ILE HB 1 107 SER H . . 3.980 4.084 4.021 4.157 0.177 18 0 "[ . 1 . 2]" 1
373 1 107 SER H 1 110 VAL H . . 4.790 4.622 3.914 4.863 0.073 1 0 "[ . 1 . 2]" 1
374 1 63 PHE HA 1 73 CYS H . . 5.500 5.216 4.766 5.529 0.029 15 0 "[ . 1 . 2]" 1
375 1 72 GLY HA2 1 73 CYS H . . 3.360 2.288 2.139 2.431 . 0 0 "[ . 1 . 2]" 1
376 1 73 CYS H 1 91 VAL H . . 3.700 2.942 2.657 3.209 . 0 0 "[ . 1 . 2]" 1
377 1 72 GLY HA3 1 73 CYS H . . 3.360 2.905 2.703 3.283 . 0 0 "[ . 1 . 2]" 1
378 1 59 TYR HB3 1 60 CYS H . . 4.290 3.594 2.383 4.209 . 0 0 "[ . 1 . 2]" 1
379 1 59 TYR HB2 1 60 CYS H . . 4.290 4.137 3.788 4.286 . 0 0 "[ . 1 . 2]" 1
380 1 59 TYR HA 1 60 CYS H . . 2.930 2.256 2.149 2.551 . 0 0 "[ . 1 . 2]" 1
381 1 97 GLU HB3 1 98 TRP H . . 3.730 2.282 1.950 2.635 . 0 0 "[ . 1 . 2]" 1
382 1 97 GLU HB2 1 98 TRP H . . 3.730 3.470 3.224 3.656 . 0 0 "[ . 1 . 2]" 1
383 1 98 TRP H 1 99 LEU H . . 3.610 2.687 2.550 2.780 . 0 0 "[ . 1 . 2]" 1
384 1 94 GLY HA2 1 98 TRP H . . 5.130 5.148 5.063 5.215 0.085 18 0 "[ . 1 . 2]" 1
385 1 96 ARG HA 1 98 TRP H . . 5.130 4.661 4.224 5.131 0.001 14 0 "[ . 1 . 2]" 1
386 1 98 TRP H 1 100 ARG H . . 4.230 4.158 4.013 4.276 0.046 11 0 "[ . 1 . 2]" 1
387 1 94 GLY HA3 1 98 TRP H . . 5.130 4.009 3.818 4.155 . 0 0 "[ . 1 . 2]" 1
388 1 12 LEU HA 1 13 LEU H . . 2.960 2.332 2.187 2.414 . 0 0 "[ . 1 . 2]" 1
389 1 12 LEU HB2 1 13 LEU H . . 4.320 4.074 3.897 4.293 . 0 0 "[ . 1 . 2]" 1
390 1 12 LEU HB3 1 13 LEU H . . 4.320 3.087 2.553 3.812 . 0 0 "[ . 1 . 2]" 1
391 1 12 LEU H 1 13 LEU H . . 4.820 4.377 4.260 4.440 . 0 0 "[ . 1 . 2]" 1
392 1 115 THR HA 1 118 GLU H . . 4.010 3.187 3.064 3.248 . 0 0 "[ . 1 . 2]" 1
393 1 117 HIS HB2 1 118 GLU H . . 4.480 3.346 2.807 4.134 . 0 0 "[ . 1 . 2]" 1
394 1 117 HIS HB3 1 118 GLU H . . 4.480 3.584 2.967 3.933 . 0 0 "[ . 1 . 2]" 1
395 1 115 THR HB 1 118 GLU H . . 5.220 5.312 5.267 5.430 0.210 20 0 "[ . 1 . 2]" 1
396 1 71 ILE H 1 71 ILE HB . . 3.980 3.371 2.655 3.895 . 0 0 "[ . 1 . 2]" 1
397 1 21 PRO HA 1 22 LEU H . . 3.020 2.457 2.379 2.643 . 0 0 "[ . 1 . 2]" 1
398 1 22 LEU H 1 22 LEU HB2 . . 3.240 2.464 2.300 2.587 . 0 0 "[ . 1 . 2]" 1
399 1 22 LEU H 1 22 LEU HB3 . . 3.240 2.550 2.426 2.730 . 0 0 "[ . 1 . 2]" 1
400 1 22 LEU H 1 25 VAL H . . 5.500 4.863 4.758 5.014 . 0 0 "[ . 1 . 2]" 1
401 1 22 LEU H 1 24 LYS H . . 5.220 4.403 4.290 4.477 . 0 0 "[ . 1 . 2]" 1
402 1 21 PRO HB3 1 22 LEU H . . 3.420 3.393 3.205 3.484 0.064 8 0 "[ . 1 . 2]" 1
403 1 21 PRO HB2 1 22 LEU H . . 3.420 2.484 2.063 2.671 . 0 0 "[ . 1 . 2]" 1
404 1 115 THR H 1 118 GLU H . . 4.660 4.606 4.499 4.671 0.011 7 0 "[ . 1 . 2]" 1
405 1 98 TRP HA 1 101 ARG H . . 4.720 3.150 3.068 3.243 . 0 0 "[ . 1 . 2]" 1
406 1 99 LEU HA 1 101 ARG H . . 5.500 4.471 4.254 4.636 . 0 0 "[ . 1 . 2]" 1
407 1 99 LEU H 1 101 ARG H . . 4.040 4.012 3.879 4.110 0.070 18 0 "[ . 1 . 2]" 1
408 1 115 THR HA 1 119 MET H . . 4.570 4.252 3.754 4.610 0.040 18 0 "[ . 1 . 2]" 1
409 1 119 MET H 1 120 LYS H . . 3.640 2.599 2.590 2.631 . 0 0 "[ . 1 . 2]" 1
410 1 117 HIS HA 1 119 MET H . . 5.500 3.718 3.520 3.990 . 0 0 "[ . 1 . 2]" 1
411 1 23 ARG HA 1 26 LEU H . . 4.100 3.840 3.752 4.088 . 0 0 "[ . 1 . 2]" 1
412 1 25 VAL HB 1 26 LEU H . . 3.450 2.472 2.149 2.680 . 0 0 "[ . 1 . 2]" 1
413 1 26 LEU H 1 28 VAL H . . 4.720 4.476 4.302 4.724 0.004 20 0 "[ . 1 . 2]" 1
414 1 26 LEU H 1 27 ALA H . . 3.760 2.883 2.776 2.971 . 0 0 "[ . 1 . 2]" 1
415 1 24 LYS H 1 26 LEU H . . 4.660 4.226 4.017 4.575 . 0 0 "[ . 1 . 2]" 1
416 1 22 LEU HA 1 26 LEU H . . 5.500 3.718 3.433 3.857 . 0 0 "[ . 1 . 2]" 1
417 1 24 LYS HA 1 26 LEU H . . 5.500 4.586 4.338 5.059 . 0 0 "[ . 1 . 2]" 1
418 1 7 ARG HA 1 8 VAL H . . 3.110 2.148 2.141 2.149 . 0 0 "[ . 1 . 2]" 1
419 1 8 VAL H 1 8 VAL HB . . 3.240 2.616 2.494 2.681 . 0 0 "[ . 1 . 2]" 1
420 1 73 CYS HB3 1 74 LYS H . . 3.580 3.559 2.169 3.731 0.151 16 0 "[ . 1 . 2]" 1
421 1 73 CYS HB2 1 74 LYS H . . 3.580 2.566 2.099 2.832 . 0 0 "[ . 1 . 2]" 1
422 1 74 LYS H 1 74 LYS HB2 . . 3.950 2.946 2.519 3.808 . 0 0 "[ . 1 . 2]" 1
423 1 74 LYS H 1 74 LYS HB3 . . 3.950 3.620 3.089 3.904 . 0 0 "[ . 1 . 2]" 1
424 1 74 LYS H 1 75 VAL H . . 5.040 4.370 4.157 4.490 . 0 0 "[ . 1 . 2]" 1
425 1 73 CYS H 1 74 LYS H . . 4.970 4.312 4.217 4.376 . 0 0 "[ . 1 . 2]" 1
426 1 63 PHE H 1 74 LYS H . . 4.720 4.560 4.349 4.848 0.128 13 0 "[ . 1 . 2]" 1
427 1 63 PHE HA 1 74 LYS H . . 4.200 3.757 3.456 4.056 . 0 0 "[ . 1 . 2]" 1
428 1 26 LEU HA 1 30 GLY H . . 4.350 3.873 3.563 4.070 . 0 0 "[ . 1 . 2]" 1
429 1 27 ALA HA 1 30 GLY H . . 3.920 3.738 3.638 3.847 . 0 0 "[ . 1 . 2]" 1
430 1 29 VAL HB 1 30 GLY H . . 3.580 2.808 2.674 2.926 . 0 0 "[ . 1 . 2]" 1
431 1 28 VAL HB 1 30 GLY H . . 4.720 4.457 4.320 4.615 . 0 0 "[ . 1 . 2]" 1
432 1 109 ASP HA 1 112 ASP H . . 4.450 3.689 3.628 3.774 . 0 0 "[ . 1 . 2]" 1
433 1 108 SER HA 1 112 ASP H . . 4.660 3.698 3.626 3.811 . 0 0 "[ . 1 . 2]" 1
434 1 112 ASP H 1 112 ASP HB3 . . 3.110 2.542 2.433 2.631 . 0 0 "[ . 1 . 2]" 1
435 1 112 ASP H 1 112 ASP HB2 . . 3.110 2.520 2.435 2.631 . 0 0 "[ . 1 . 2]" 1
436 1 109 ASP H 1 112 ASP H . . 4.880 4.552 4.479 4.615 . 0 0 "[ . 1 . 2]" 1
437 1 111 SER H 1 112 ASP H . . 3.330 2.652 2.626 2.684 . 0 0 "[ . 1 . 2]" 1
438 1 112 ASP H 1 114 MET H . . 4.880 4.197 4.116 4.272 . 0 0 "[ . 1 . 2]" 1
439 1 112 ASP H 1 113 ALA H . . 3.270 2.738 2.688 2.788 . 0 0 "[ . 1 . 2]" 1
440 1 110 VAL HA 1 112 ASP H . . 4.820 4.592 4.445 4.742 . 0 0 "[ . 1 . 2]" 1
441 1 110 VAL HB 1 112 ASP H . . 5.000 5.022 4.993 5.055 0.055 12 0 "[ . 1 . 2]" 1
442 1 30 GLY H 1 33 ALA H . . 5.310 4.612 4.569 4.693 . 0 0 "[ . 1 . 2]" 1
443 1 28 VAL H 1 30 GLY H . . 5.220 3.954 3.841 4.087 . 0 0 "[ . 1 . 2]" 1
444 1 21 PRO HA 1 23 ARG H . . 4.570 4.500 4.327 4.601 0.031 15 0 "[ . 1 . 2]" 1
445 1 23 ARG H 1 25 VAL H . . 4.540 4.395 4.149 4.564 0.024 10 0 "[ . 1 . 2]" 1
446 1 92 LEU H 1 130 ASP H . . 5.380 4.804 4.492 5.179 . 0 0 "[ . 1 . 2]" 1
447 1 91 VAL HB 1 92 LEU H . . 4.450 4.302 4.114 4.380 . 0 0 "[ . 1 . 2]" 1
448 1 92 LEU H 1 131 GLY H . . 5.310 5.060 4.687 5.347 0.037 16 0 "[ . 1 . 2]" 1
449 1 73 CYS H 1 92 LEU H . . 5.500 4.812 4.603 5.062 . 0 0 "[ . 1 . 2]" 1
450 1 92 LEU H 1 93 ILE H . . 5.070 4.437 4.304 4.539 . 0 0 "[ . 1 . 2]" 1
451 1 91 VAL HA 1 92 LEU H . . 3.020 2.155 2.142 2.183 . 0 0 "[ . 1 . 2]" 1
452 1 92 LEU H 1 129 ILE HA . . 4.100 3.536 3.390 3.707 . 0 0 "[ . 1 . 2]" 1
453 1 63 PHE HA 1 64 GLN H . . 3.240 2.203 2.150 2.352 . 0 0 "[ . 1 . 2]" 1
454 1 63 PHE HB3 1 64 GLN H . . 4.170 4.053 3.475 4.208 0.038 9 0 "[ . 1 . 2]" 1
455 1 63 PHE HB2 1 64 GLN H . . 4.170 4.108 3.918 4.260 0.090 4 0 "[ . 1 . 2]" 1
456 1 64 GLN H 1 64 GLN HB3 . . 4.040 3.743 2.805 3.948 . 0 0 "[ . 1 . 2]" 1
457 1 64 GLN H 1 64 GLN HB2 . . 4.040 3.041 2.857 3.811 . 0 0 "[ . 1 . 2]" 1
458 1 64 GLN H 1 73 CYS H . . 4.880 4.818 4.526 4.911 0.031 9 0 "[ . 1 . 2]" 1
459 1 64 GLN H 1 65 ALA H . . 4.290 4.091 3.889 4.249 . 0 0 "[ . 1 . 2]" 1
460 1 63 PHE H 1 64 GLN H . . 4.480 4.369 4.051 4.613 0.133 17 0 "[ . 1 . 2]" 1
461 1 64 GLN H 1 73 CYS HA . . 3.860 3.189 2.876 3.377 . 0 0 "[ . 1 . 2]" 1
462 1 37 GLU H 1 37 GLU HB2 . . 3.610 2.671 2.104 3.647 0.037 16 0 "[ . 1 . 2]" 1
463 1 37 GLU H 1 37 GLU HB3 . . 3.610 3.108 2.493 3.616 0.006 1 0 "[ . 1 . 2]" 1
464 1 37 GLU H 1 38 HIS H . . 3.450 2.493 1.864 2.855 . 0 0 "[ . 1 . 2]" 1
465 1 123 THR H 1 123 THR HB . . 3.420 3.177 2.791 3.429 0.009 5 0 "[ . 1 . 2]" 1
466 1 122 GLN H 1 123 THR H . . 4.660 4.618 4.564 4.640 . 0 0 "[ . 1 . 2]" 1
467 1 123 THR H 1 141 ASP H . . 5.070 4.411 3.506 5.014 . 0 0 "[ . 1 . 2]" 1
468 1 123 THR H 1 139 ILE HA . . 5.500 4.729 4.404 4.920 . 0 0 "[ . 1 . 2]" 1
469 1 62 ASP H 1 63 PHE H . . 4.480 4.484 4.278 4.555 0.075 6 0 "[ . 1 . 2]" 1
470 1 125 ILE H 1 137 ILE H . . 3.670 3.634 3.304 3.723 0.053 10 0 "[ . 1 . 2]" 1
471 1 124 ALA HA 1 125 ILE H . . 2.930 2.155 2.141 2.194 . 0 0 "[ . 1 . 2]" 1
472 1 125 ILE H 1 138 ALA HA . . 4.290 3.181 2.902 3.504 . 0 0 "[ . 1 . 2]" 1
473 1 65 ALA HA 1 72 GLY H . . 4.320 3.524 3.304 3.835 . 0 0 "[ . 1 . 2]" 1
474 1 64 GLN HA 1 72 GLY H . . 5.310 5.000 4.784 5.140 . 0 0 "[ . 1 . 2]" 1
475 1 71 ILE HA 1 72 GLY H . . 3.270 2.342 2.254 2.554 . 0 0 "[ . 1 . 2]" 1
476 1 71 ILE HB 1 72 GLY H . . 3.790 3.073 2.061 3.845 0.055 17 0 "[ . 1 . 2]" 1
477 1 72 GLY H 1 73 CYS H . . 4.320 4.365 4.120 4.475 0.155 17 0 "[ . 1 . 2]" 1
478 1 26 LEU HA 1 29 VAL H . . 4.420 4.439 4.340 4.482 0.062 10 0 "[ . 1 . 2]" 1
479 1 25 VAL HA 1 29 VAL H . . 4.380 3.278 3.149 3.471 . 0 0 "[ . 1 . 2]" 1
480 1 29 VAL H 1 29 VAL HB . . 3.210 2.606 2.566 2.653 . 0 0 "[ . 1 . 2]" 1
481 1 28 VAL HB 1 29 VAL H . . 3.580 2.026 1.972 2.123 . 0 0 "[ . 1 . 2]" 1
482 1 29 VAL H 1 31 THR H . . 5.500 5.129 4.899 5.252 . 0 0 "[ . 1 . 2]" 1
483 1 27 ALA H 1 29 VAL H . . 4.940 4.760 4.469 4.903 . 0 0 "[ . 1 . 2]" 1
484 1 132 VAL HA 1 133 LEU H . . 2.900 2.143 2.140 2.152 . 0 0 "[ . 1 . 2]" 1
485 1 132 VAL HB 1 133 LEU H . . 4.600 4.282 4.213 4.330 . 0 0 "[ . 1 . 2]" 1
486 1 133 LEU H 1 133 LEU HB2 . . 4.010 2.670 2.048 3.549 . 0 0 "[ . 1 . 2]" 1
487 1 133 LEU H 1 133 LEU HB3 . . 4.010 2.806 2.259 3.325 . 0 0 "[ . 1 . 2]" 1
488 1 128 ALA HA 1 133 LEU H . . 5.220 4.244 4.202 4.355 . 0 0 "[ . 1 . 2]" 1
489 1 139 ILE HA 1 140 ALA H . . 3.140 2.267 2.166 2.368 . 0 0 "[ . 1 . 2]" 1
490 1 8 VAL HA 1 140 ALA H . . 4.230 3.595 2.700 4.177 . 0 0 "[ . 1 . 2]" 1
491 1 7 ARG HA 1 140 ALA H . . 5.220 5.094 4.776 5.236 0.016 10 0 "[ . 1 . 2]" 1
492 1 139 ILE H 1 140 ALA H . . 4.720 4.527 4.443 4.602 . 0 0 "[ . 1 . 2]" 1
493 1 123 THR HA 1 124 ALA H . . 2.800 2.188 2.142 2.251 . 0 0 "[ . 1 . 2]" 1
494 1 123 THR HB 1 124 ALA H . . 4.690 4.055 3.486 4.447 . 0 0 "[ . 1 . 2]" 1
495 1 94 GLY H 1 127 VAL HA . . 3.890 3.683 3.435 3.842 . 0 0 "[ . 1 . 2]" 1
496 1 71 ILE H 1 94 GLY H . . 5.220 5.044 4.689 5.184 . 0 0 "[ . 1 . 2]" 1
497 1 93 ILE HA 1 94 GLY H . . 3.050 2.162 2.143 2.208 . 0 0 "[ . 1 . 2]" 1
498 1 75 VAL HB 1 76 SER H . . 4.450 3.530 3.033 4.263 . 0 0 "[ . 1 . 2]" 1
499 1 75 VAL HA 1 76 SER H . . 3.270 2.162 2.140 2.190 . 0 0 "[ . 1 . 2]" 1
500 1 76 SER H 1 77 ASN H . . 4.690 4.059 4.018 4.145 . 0 0 "[ . 1 . 2]" 1
501 1 60 CYS HA 1 76 SER H . . 4.630 4.218 3.659 4.928 0.298 13 0 "[ . 1 . 2]" 1
502 1 76 SER H 1 88 THR HA . . 4.660 4.597 4.034 4.794 0.134 5 0 "[ . 1 . 2]" 1
503 1 94 GLY H 1 125 ILE HA . . 4.880 4.532 4.254 4.903 0.023 18 0 "[ . 1 . 2]" 1
504 1 94 GLY H 1 95 ASN H . . 5.340 4.379 4.326 4.407 . 0 0 "[ . 1 . 2]" 1
505 1 125 ILE H 1 126 LEU H . . 4.880 4.377 3.859 4.549 . 0 0 "[ . 1 . 2]" 1
506 1 95 ASN HA 1 126 LEU H . . 4.880 3.031 2.757 3.243 . 0 0 "[ . 1 . 2]" 1
507 1 13 LEU HA 1 136 MET H . . 5.500 3.229 3.034 3.580 . 0 0 "[ . 1 . 2]" 1
508 1 135 GLY H 1 136 MET H . . 4.420 4.361 4.204 4.390 . 0 0 "[ . 1 . 2]" 1
509 1 12 LEU HA 1 136 MET H . . 5.410 4.846 4.691 4.963 . 0 0 "[ . 1 . 2]" 1
510 1 11 VAL HA 1 136 MET H . . 5.310 4.881 4.704 5.188 . 0 0 "[ . 1 . 2]" 1
511 1 12 LEU H 1 136 MET H . . 4.290 3.127 2.927 3.319 . 0 0 "[ . 1 . 2]" 1
512 1 13 LEU H 1 136 MET H . . 5.500 4.811 4.578 4.909 . 0 0 "[ . 1 . 2]" 1
513 1 125 ILE HA 1 126 LEU H . . 3.300 2.210 2.141 2.351 . 0 0 "[ . 1 . 2]" 1
514 1 125 ILE HB 1 126 LEU H . . 4.230 3.427 2.503 4.154 . 0 0 "[ . 1 . 2]" 1
515 1 93 ILE HA 1 126 LEU H . . 5.470 4.623 4.307 4.921 . 0 0 "[ . 1 . 2]" 1
516 1 9 MET H 1 139 ILE HA . . 3.950 2.064 1.937 2.525 . 0 0 "[ . 1 . 2]" 1
517 1 8 VAL HA 1 9 MET H . . 3.420 2.165 2.145 2.239 . 0 0 "[ . 1 . 2]" 1
518 1 9 MET H 1 9 MET HB2 . . 4.140 2.538 2.217 2.952 . 0 0 "[ . 1 . 2]" 1
519 1 9 MET H 1 9 MET HB3 . . 4.140 2.819 2.377 3.050 . 0 0 "[ . 1 . 2]" 1
520 1 8 VAL HB 1 9 MET H . . 4.140 4.112 3.887 4.194 0.054 5 0 "[ . 1 . 2]" 1
521 1 8 VAL H 1 9 MET H . . 5.220 4.561 4.514 4.630 . 0 0 "[ . 1 . 2]" 1
522 1 9 MET H 1 10 ARG HA . . 5.220 4.740 4.590 4.937 . 0 0 "[ . 1 . 2]" 1
523 1 107 SER H 1 108 SER H . . 4.480 4.254 4.002 4.635 0.155 8 0 "[ . 1 . 2]" 1
524 1 107 SER HA 1 108 SER H . . 3.020 2.204 2.141 2.459 . 0 0 "[ . 1 . 2]" 1
525 1 108 SER H 1 111 SER H . . 5.500 4.917 4.801 4.984 . 0 0 "[ . 1 . 2]" 1
526 1 108 SER H 1 110 VAL H . . 5.500 4.497 4.264 4.802 . 0 0 "[ . 1 . 2]" 1
527 1 61 THR H 1 62 ASP H . . 5.040 3.066 2.109 4.148 . 0 0 "[ . 1 . 2]" 1
528 1 60 CYS H 1 61 THR H . . 4.450 3.716 2.617 4.478 0.028 3 0 "[ . 1 . 2]" 1
529 1 60 CYS HA 1 61 THR H . . 2.860 2.437 2.139 2.913 0.053 16 0 "[ . 1 . 2]" 1
530 1 61 THR H 1 75 VAL HA . . 4.880 3.231 2.423 4.328 . 0 0 "[ . 1 . 2]" 1
531 1 133 LEU HA 1 134 CYS H . . 3.300 2.147 2.139 2.173 . 0 0 "[ . 1 . 2]" 1
532 1 133 LEU H 1 134 CYS H . . 4.570 4.485 4.323 4.550 . 0 0 "[ . 1 . 2]" 1
533 1 128 ALA HA 1 134 CYS H . . 3.640 1.934 1.892 2.095 . 0 0 "[ . 1 . 2]" 1
534 1 129 ILE HA 1 131 GLY H . . 5.070 3.632 3.493 3.985 . 0 0 "[ . 1 . 2]" 1
535 1 130 ASP HA 1 131 GLY H . . 3.450 2.865 2.720 2.912 . 0 0 "[ . 1 . 2]" 1
536 1 130 ASP HB3 1 131 GLY H . . 4.660 4.290 4.117 4.676 0.016 6 0 "[ . 1 . 2]" 1
537 1 130 ASP HB2 1 131 GLY H . . 4.660 4.404 4.114 4.603 . 0 0 "[ . 1 . 2]" 1
538 1 130 ASP H 1 131 GLY H . . 3.670 2.747 2.649 2.867 . 0 0 "[ . 1 . 2]" 1
539 1 90 SER H 1 131 GLY H . . 5.280 5.280 4.994 5.346 0.066 6 0 "[ . 1 . 2]" 1
540 1 129 ILE H 1 131 GLY H . . 4.820 4.252 4.119 4.492 . 0 0 "[ . 1 . 2]" 1
541 1 12 LEU H 1 137 ILE HA . . 3.760 3.442 3.167 3.595 . 0 0 "[ . 1 . 2]" 1
542 1 11 VAL HA 1 12 LEU H . . 3.110 2.195 2.161 2.238 . 0 0 "[ . 1 . 2]" 1
543 1 11 VAL HB 1 12 LEU H . . 4.010 3.923 3.075 4.084 0.074 18 0 "[ . 1 . 2]" 1
544 1 12 LEU H 1 12 LEU HB2 . . 3.830 2.866 2.589 3.109 . 0 0 "[ . 1 . 2]" 1
545 1 12 LEU H 1 12 LEU HB3 . . 3.830 3.366 3.078 3.818 . 0 0 "[ . 1 . 2]" 1
546 1 12 LEU H 1 138 ALA H . . 5.250 5.206 4.698 5.275 0.025 13 0 "[ . 1 . 2]" 1
547 1 11 VAL H 1 12 LEU H . . 5.070 4.260 4.160 4.371 . 0 0 "[ . 1 . 2]" 1
548 1 122 GLN HA 1 139 ILE H . . 5.220 5.107 4.716 5.271 0.051 5 0 "[ . 1 . 2]" 1
549 1 139 ILE H 1 139 ILE HB . . 3.610 3.060 2.547 3.691 0.081 17 0 "[ . 1 . 2]" 1
550 1 9 MET H 1 139 ILE H . . 5.410 4.391 4.291 4.647 . 0 0 "[ . 1 . 2]" 1
551 1 123 THR H 1 139 ILE H . . 3.640 3.184 2.780 3.415 . 0 0 "[ . 1 . 2]" 1
552 1 138 ALA HA 1 139 ILE H . . 3.050 2.147 2.142 2.166 . 0 0 "[ . 1 . 2]" 1
553 1 124 ALA HA 1 139 ILE H . . 4.450 3.257 2.449 3.905 . 0 0 "[ . 1 . 2]" 1
554 1 91 VAL H 1 91 VAL HB . . 3.420 3.061 2.611 3.464 0.044 13 0 "[ . 1 . 2]" 1
555 1 91 VAL H 1 92 LEU H . . 4.200 4.034 3.836 4.290 0.090 19 0 "[ . 1 . 2]" 1
556 1 74 LYS HA 1 91 VAL H . . 3.700 3.085 2.750 3.257 . 0 0 "[ . 1 . 2]" 1
557 1 76 SER HB3 1 77 ASN H . . 4.230 4.143 3.336 4.323 0.093 15 0 "[ . 1 . 2]" 1
558 1 76 SER HB2 1 77 ASN H . . 4.230 3.605 3.284 4.321 0.091 19 0 "[ . 1 . 2]" 1
559 1 75 VAL H 1 75 VAL HB . . 4.140 3.602 2.702 3.979 . 0 0 "[ . 1 . 2]" 1
560 1 74 LYS HB3 1 75 VAL H . . 4.140 3.486 2.886 4.094 . 0 0 "[ . 1 . 2]" 1
561 1 75 VAL H 1 76 SER H . . 4.570 4.225 3.937 4.369 . 0 0 "[ . 1 . 2]" 1
562 1 74 LYS HA 1 75 VAL H . . 3.110 2.172 2.141 2.240 . 0 0 "[ . 1 . 2]" 1
563 1 74 LYS HB2 1 75 VAL H . . 4.140 3.852 2.930 4.248 0.108 6 0 "[ . 1 . 2]" 1
564 1 75 VAL H 1 90 SER HA . . 4.600 4.041 3.681 4.352 . 0 0 "[ . 1 . 2]" 1
565 1 137 ILE H 1 137 ILE HB . . 3.420 3.001 2.633 3.317 . 0 0 "[ . 1 . 2]" 1
566 1 136 MET H 1 137 ILE H . . 4.260 4.286 4.230 4.354 0.094 1 0 "[ . 1 . 2]" 1
567 1 137 ILE H 1 138 ALA H . . 4.880 4.446 4.392 4.566 . 0 0 "[ . 1 . 2]" 1
568 1 136 MET HA 1 137 ILE H . . 3.170 2.175 2.141 2.199 . 0 0 "[ . 1 . 2]" 1
569 1 126 LEU HA 1 137 ILE H . . 3.270 2.887 2.242 3.186 . 0 0 "[ . 1 . 2]" 1
570 1 128 ALA H 1 133 LEU HA . . 5.130 4.367 4.230 4.636 . 0 0 "[ . 1 . 2]" 1
571 1 127 VAL HB 1 128 ALA H . . 4.040 4.084 3.997 4.131 0.091 8 0 "[ . 1 . 2]" 1
572 1 92 LEU H 1 128 ALA H . . 3.890 3.209 2.986 3.467 . 0 0 "[ . 1 . 2]" 1
573 1 128 ALA H 1 129 ILE H . . 4.660 4.455 4.414 4.522 . 0 0 "[ . 1 . 2]" 1
574 1 127 VAL HA 1 128 ALA H . . 3.170 2.159 2.145 2.195 . 0 0 "[ . 1 . 2]" 1
575 1 94 GLY H 1 128 ALA H . . 4.880 4.855 4.624 4.948 0.068 12 0 "[ . 1 . 2]" 1
576 1 91 VAL HA 1 128 ALA H . . 5.070 4.695 4.495 4.898 . 0 0 "[ . 1 . 2]" 1
577 1 90 SER H 1 130 ASP HA . . 3.980 3.036 2.671 3.272 . 0 0 "[ . 1 . 2]" 1
578 1 90 SER H 1 130 ASP H . . 3.920 3.266 3.109 3.417 . 0 0 "[ . 1 . 2]" 1
579 1 89 PHE HB2 1 90 SER H . . 4.420 4.445 4.311 4.582 0.162 18 0 "[ . 1 . 2]" 1
580 1 89 PHE HB3 1 90 SER H . . 4.420 3.742 3.579 3.932 . 0 0 "[ . 1 . 2]" 1
581 1 89 PHE H 1 90 SER H . . 4.480 4.370 4.138 4.488 0.008 10 0 "[ . 1 . 2]" 1
582 1 90 SER H 1 91 VAL H . . 4.480 4.569 4.486 4.598 0.118 7 0 "[ . 1 . 2]" 1
583 1 89 PHE HA 1 90 SER H . . 3.520 2.151 2.139 2.199 . 0 0 "[ . 1 . 2]" 1
584 1 90 SER H 1 129 ILE HA . . 5.070 5.062 4.803 5.115 0.045 12 0 "[ . 1 . 2]" 1
585 1 74 LYS HA 1 90 SER H . . 5.070 4.581 4.131 4.967 . 0 0 "[ . 1 . 2]" 1
586 1 89 PHE H 1 89 PHE HB2 . . 4.140 2.366 2.094 2.583 . 0 0 "[ . 1 . 2]" 1
587 1 89 PHE H 1 89 PHE HB3 . . 4.140 3.470 2.986 3.686 . 0 0 "[ . 1 . 2]" 1
588 1 75 VAL H 1 89 PHE H . . 3.920 3.699 3.170 3.893 . 0 0 "[ . 1 . 2]" 1
589 1 74 LYS HA 1 89 PHE H . . 5.500 4.756 4.385 5.273 . 0 0 "[ . 1 . 2]" 1
590 1 76 SER HA 1 89 PHE H . . 4.420 4.352 4.229 4.493 0.073 18 0 "[ . 1 . 2]" 1
591 1 88 THR HA 1 89 PHE H . . 3.390 2.174 2.141 2.250 . 0 0 "[ . 1 . 2]" 1
592 1 88 THR HB 1 89 PHE H . . 4.260 3.962 3.737 4.260 0.000 13 0 "[ . 1 . 2]" 1
593 1 129 ILE HB 1 130 ASP H . . 5.130 3.584 2.939 4.312 . 0 0 "[ . 1 . 2]" 1
594 1 89 PHE HA 1 130 ASP H . . 5.500 4.770 4.401 5.011 . 0 0 "[ . 1 . 2]" 1
595 1 91 VAL HA 1 130 ASP H . . 4.320 3.661 3.395 3.849 . 0 0 "[ . 1 . 2]" 1
596 1 87 GLN HA 1 87 GLN HE21 . . 5.500 3.669 1.957 4.423 . 0 0 "[ . 1 . 2]" 1
597 1 87 GLN HE21 1 88 THR H . . 5.500 3.993 2.477 4.983 . 0 0 "[ . 1 . 2]" 1
598 1 87 GLN HE21 1 89 PHE HD1 . . 5.500 2.837 2.045 5.473 . 0 0 "[ . 1 . 2]" 1
599 1 87 GLN HE21 1 89 PHE HE1 . . 5.410 3.289 1.958 5.432 0.022 2 0 "[ . 1 . 2]" 1
600 1 59 TYR HD1 1 77 ASN QD . . 5.500 4.156 1.892 5.800 0.300 5 0 "[ . 1 . 2]" 1
601 1 59 TYR HB3 1 77 ASN QD . . 5.500 3.413 2.691 3.902 . 0 0 "[ . 1 . 2]" 1
602 1 59 TYR HB2 1 77 ASN QD . . 5.500 2.269 1.921 2.734 . 0 0 "[ . 1 . 2]" 1
603 1 21 PRO HD3 1 24 LYS H . . 5.500 4.905 4.563 5.158 . 0 0 "[ . 1 . 2]" 1
604 1 21 PRO HD2 1 24 LYS H . . 5.500 3.733 3.104 4.127 . 0 0 "[ . 1 . 2]" 1
605 1 14 LEU H 1 14 LEU HG . . 4.350 3.526 2.759 4.372 0.022 5 0 "[ . 1 . 2]" 1
606 1 81 ILE H 1 81 ILE HG13 . . 4.600 3.782 2.247 4.592 . 0 0 "[ . 1 . 2]" 1
607 1 81 ILE H 1 81 ILE HG12 . . 4.600 3.791 2.163 4.635 0.035 20 0 "[ . 1 . 2]" 1
608 1 95 ASN HA 1 95 ASN HD22 . . 5.500 5.203 4.891 5.391 . 0 0 "[ . 1 . 2]" 1
609 1 85 VAL H 1 86 PRO HD3 . . 5.500 3.412 2.821 3.689 . 0 0 "[ . 1 . 2]" 1
610 1 85 VAL H 1 86 PRO HD2 . . 5.500 4.120 3.701 4.299 . 0 0 "[ . 1 . 2]" 1
611 1 52 LEU HG 1 54 THR H . . 5.500 5.386 4.745 5.497 . 0 0 "[ . 1 . 2]" 1
612 1 46 LYS HG3 1 47 TYR H . . 5.500 4.845 4.341 5.197 . 0 0 "[ . 1 . 2]" 1
613 1 46 LYS HG2 1 47 TYR H . . 5.500 4.613 3.460 5.061 . 0 0 "[ . 1 . 2]" 1
614 1 47 TYR H 1 47 TYR HD1 . . 4.690 4.671 4.559 4.723 0.033 1 0 "[ . 1 . 2]" 1
615 1 20 LEU HG 1 25 VAL H . . 5.500 5.004 2.973 5.539 0.039 2 0 "[ . 1 . 2]" 1
616 1 31 THR HB 1 58 GLY H . . 5.500 4.316 3.945 4.608 . 0 0 "[ . 1 . 2]" 1
617 1 57 LEU HG 1 58 GLY H . . 5.380 4.399 3.677 5.195 . 0 0 "[ . 1 . 2]" 1
618 1 104 LEU H 1 104 LEU HG . . 4.690 3.814 2.280 4.674 . 0 0 "[ . 1 . 2]" 1
619 1 52 LEU HG 1 53 GLY H . . 5.190 5.145 4.983 5.227 0.037 2 0 "[ . 1 . 2]" 1
620 1 87 GLN HA 1 87 GLN HE22 . . 5.500 4.515 3.330 5.255 . 0 0 "[ . 1 . 2]" 1
621 1 87 GLN HE22 1 88 THR H . . 5.500 4.595 2.856 5.525 0.025 7 0 "[ . 1 . 2]" 1
622 1 87 GLN HE22 1 89 PHE HD1 . . 5.500 2.850 2.046 4.448 . 0 0 "[ . 1 . 2]" 1
623 1 87 GLN HE22 1 89 PHE HE1 . . 5.410 3.390 2.069 5.387 . 0 0 "[ . 1 . 2]" 1
624 1 20 LEU H 1 21 PRO HD3 . . 5.500 4.536 3.426 5.097 . 0 0 "[ . 1 . 2]" 1
625 1 20 LEU H 1 21 PRO HD2 . . 5.500 4.559 4.134 4.803 . 0 0 "[ . 1 . 2]" 1
626 1 86 PRO HG2 1 87 GLN H . . 5.500 4.879 4.272 4.937 . 0 0 "[ . 1 . 2]" 1
627 1 86 PRO HG3 1 87 GLN H . . 5.500 5.565 4.946 5.629 0.129 19 0 "[ . 1 . 2]" 1
628 1 127 VAL HB 1 135 GLY H . . 5.040 3.997 3.046 5.100 0.060 15 0 "[ . 1 . 2]" 1
629 1 133 LEU HG 1 135 GLY H . . 5.500 3.971 2.929 4.674 . 0 0 "[ . 1 . 2]" 1
630 1 14 LEU HG 1 135 GLY H . . 5.500 5.440 4.951 5.539 0.039 10 0 "[ . 1 . 2]" 1
631 1 27 ALA H 1 52 LEU HG . . 5.500 5.071 3.958 5.512 0.012 12 0 "[ . 1 . 2]" 1
632 1 50 GLU H 1 50 GLU HG2 . . 4.540 3.988 2.432 4.530 . 0 0 "[ . 1 . 2]" 1
633 1 50 GLU H 1 50 GLU HG3 . . 4.540 4.097 2.727 4.510 . 0 0 "[ . 1 . 2]" 1
634 1 52 LEU H 1 52 LEU HG . . 4.910 3.964 3.589 4.239 . 0 0 "[ . 1 . 2]" 1
635 1 96 ARG HD3 1 97 GLU H . . 5.500 4.996 3.262 5.539 0.039 10 0 "[ . 1 . 2]" 1
636 1 95 ASN HD22 1 97 GLU H . . 5.500 3.098 2.387 4.178 . 0 0 "[ . 1 . 2]" 1
637 1 95 ASN HD21 1 97 GLU H . . 5.500 3.589 1.979 4.784 . 0 0 "[ . 1 . 2]" 1
638 1 96 ARG HD2 1 97 GLU H . . 5.500 5.158 3.354 5.677 0.177 18 0 "[ . 1 . 2]" 1
639 1 5 VAL H 1 6 PRO HD3 . . 5.500 3.128 2.862 3.327 . 0 0 "[ . 1 . 2]" 1
640 1 5 VAL H 1 6 PRO HD2 . . 5.500 3.925 3.733 4.055 . 0 0 "[ . 1 . 2]" 1
641 1 104 LEU HG 1 105 THR H . . 5.470 3.665 2.358 4.840 . 0 0 "[ . 1 . 2]" 1
642 1 14 LEU HG 1 15 GLY H . . 5.500 4.368 4.009 4.586 . 0 0 "[ . 1 . 2]" 1
643 1 100 ARG H 1 100 ARG HD2 . . 5.500 4.529 3.229 5.596 0.096 12 0 "[ . 1 . 2]" 1
644 1 100 ARG H 1 100 ARG HD3 . . 5.500 4.609 3.270 5.515 0.015 2 0 "[ . 1 . 2]" 1
645 1 47 TYR HD1 1 51 GLU H . . 5.500 4.685 3.875 5.362 . 0 0 "[ . 1 . 2]" 1
646 1 63 PHE H 1 73 CYS HB3 . . 5.500 4.846 4.183 5.403 . 0 0 "[ . 1 . 2]" 1
647 1 63 PHE H 1 73 CYS HB2 . . 5.500 5.132 4.857 5.845 0.345 4 0 "[ . 1 . 2]" 1
648 1 63 PHE H 1 63 PHE QD . . 5.500 4.301 4.154 4.403 . 0 0 "[ . 1 . 2]" 1
649 1 87 GLN HG3 1 88 THR H . . 5.040 4.993 3.974 5.133 0.093 14 0 "[ . 1 . 2]" 1
650 1 87 GLN HG2 1 88 THR H . . 5.040 4.165 3.577 5.112 0.072 9 0 "[ . 1 . 2]" 1
651 1 57 LEU H 1 57 LEU HG . . 4.720 3.529 1.983 4.353 . 0 0 "[ . 1 . 2]" 1
652 1 38 HIS H 1 39 PRO HD2 . . 5.500 4.721 4.708 4.778 . 0 0 "[ . 1 . 2]" 1
653 1 38 HIS H 1 39 PRO HD3 . . 5.500 5.049 5.025 5.091 . 0 0 "[ . 1 . 2]" 1
654 1 47 TYR HD1 1 48 CYS H . . 4.970 4.607 3.880 4.963 . 0 0 "[ . 1 . 2]" 1
655 1 106 ILE H 1 106 ILE HG12 . . 5.160 4.644 4.482 5.175 0.015 1 0 "[ . 1 . 2]" 1
656 1 106 ILE H 1 106 ILE HG13 . . 5.160 4.640 4.387 4.889 . 0 0 "[ . 1 . 2]" 1
657 1 93 ILE H 1 98 TRP HE1 . . 4.690 4.347 3.472 4.713 0.023 18 0 "[ . 1 . 2]" 1
658 1 71 ILE HB 1 93 ILE H . . 5.040 4.531 3.145 5.068 0.028 2 0 "[ . 1 . 2]" 1
659 1 93 ILE H 1 98 TRP HD1 . . 5.500 4.522 3.593 5.533 0.033 20 0 "[ . 1 . 2]" 1
660 1 63 PHE QE 1 65 ALA H . . 5.500 4.140 3.003 4.866 . 0 0 "[ . 1 . 2]" 1
661 1 63 PHE QD 1 65 ALA H . . 5.500 4.292 3.442 5.069 . 0 0 "[ . 1 . 2]" 1
662 1 95 ASN HD22 1 96 ARG H . . 5.500 4.475 3.704 5.225 . 0 0 "[ . 1 . 2]" 1
663 1 95 ASN HD21 1 96 ARG H . . 5.500 3.795 2.521 4.923 . 0 0 "[ . 1 . 2]" 1
664 1 59 TYR H 1 77 ASN HB2 . . 4.970 2.975 2.458 3.555 . 0 0 "[ . 1 . 2]" 1
665 1 59 TYR H 1 77 ASN HB3 . . 4.970 4.649 4.178 4.969 . 0 0 "[ . 1 . 2]" 1
666 1 59 TYR H 1 59 TYR HD1 . . 5.500 4.458 3.253 5.217 . 0 0 "[ . 1 . 2]" 1
667 1 59 TYR H 1 77 ASN QD . . 5.500 2.975 1.903 4.226 . 0 0 "[ . 1 . 2]" 1
668 1 106 ILE HG12 1 107 SER H . . 5.500 3.064 2.184 3.963 . 0 0 "[ . 1 . 2]" 1
669 1 106 ILE HG13 1 107 SER H . . 5.500 2.592 2.081 3.092 . 0 0 "[ . 1 . 2]" 1
670 1 73 CYS H 1 91 VAL HB . . 5.100 4.291 3.286 5.266 0.166 12 0 "[ . 1 . 2]" 1
671 1 59 TYR HD1 1 60 CYS H . . 5.220 3.538 1.948 5.150 . 0 0 "[ . 1 . 2]" 1
672 1 98 TRP H 1 98 TRP HD1 . . 5.500 5.169 4.649 5.374 . 0 0 "[ . 1 . 2]" 1
673 1 95 ASN HD21 1 98 TRP H . . 5.500 4.758 2.154 5.522 0.022 20 0 "[ . 1 . 2]" 1
674 1 95 ASN HD22 1 98 TRP H . . 5.500 4.192 2.974 4.770 . 0 0 "[ . 1 . 2]" 1
675 1 12 LEU HG 1 13 LEU H . . 5.380 2.991 1.950 4.167 . 0 0 "[ . 1 . 2]" 1
676 1 71 ILE H 1 93 ILE HB . . 5.500 4.204 3.401 5.477 . 0 0 "[ . 1 . 2]" 1
677 1 71 ILE H 1 98 TRP HD1 . . 5.500 4.709 3.762 5.250 . 0 0 "[ . 1 . 2]" 1
678 1 22 LEU H 1 22 LEU HG . . 5.380 4.481 4.429 4.561 . 0 0 "[ . 1 . 2]" 1
679 1 100 ARG HG2 1 101 ARG H . . 5.500 4.599 4.048 5.415 . 0 0 "[ . 1 . 2]" 1
680 1 118 GLU HG2 1 119 MET H . . 5.500 5.031 4.499 5.463 . 0 0 "[ . 1 . 2]" 1
681 1 118 GLU HG3 1 119 MET H . . 5.500 5.110 4.756 5.433 . 0 0 "[ . 1 . 2]" 1
682 1 62 ASP HB2 1 74 LYS H . . 5.500 3.524 1.920 5.011 . 0 0 "[ . 1 . 2]" 1
683 1 62 ASP HB3 1 74 LYS H . . 5.500 2.624 1.930 4.418 . 0 0 "[ . 1 . 2]" 1
684 1 30 GLY H 1 48 CYS HB3 . . 5.500 4.721 4.202 5.464 . 0 0 "[ . 1 . 2]" 1
685 1 30 GLY H 1 48 CYS HB2 . . 5.500 4.836 4.048 5.510 0.010 15 0 "[ . 1 . 2]" 1
686 1 23 ARG H 1 23 ARG HD2 . . 5.500 4.493 3.264 5.290 . 0 0 "[ . 1 . 2]" 1
687 1 23 ARG H 1 23 ARG HD3 . . 5.500 4.645 3.852 5.232 . 0 0 "[ . 1 . 2]" 1
688 1 22 LEU HG 1 23 ARG H . . 4.040 3.897 3.635 4.035 . 0 0 "[ . 1 . 2]" 1
689 1 64 GLN H 1 73 CYS HB3 . . 5.250 2.724 2.296 3.518 . 0 0 "[ . 1 . 2]" 1
690 1 64 GLN H 1 73 CYS HB2 . . 5.250 4.265 3.936 4.738 . 0 0 "[ . 1 . 2]" 1
691 1 63 PHE QD 1 64 GLN H . . 5.070 3.155 2.832 3.506 . 0 0 "[ . 1 . 2]" 1
692 1 123 THR H 1 139 ILE HB . . 5.040 3.859 2.749 4.731 . 0 0 "[ . 1 . 2]" 1
693 1 64 GLN HB2 1 72 GLY H . . 5.500 3.525 2.826 4.890 . 0 0 "[ . 1 . 2]" 1
694 1 64 GLN HB3 1 72 GLY H . . 5.500 4.360 2.828 5.507 0.007 14 0 "[ . 1 . 2]" 1
695 1 133 LEU H 1 133 LEU HG . . 4.970 4.080 3.749 4.584 . 0 0 "[ . 1 . 2]" 1
696 1 94 GLY H 1 125 ILE HB . . 5.500 4.772 3.732 5.556 0.056 12 0 "[ . 1 . 2]" 1
697 1 94 GLY H 1 126 LEU HG . . 5.500 5.349 3.884 5.560 0.060 10 0 "[ . 1 . 2]" 1
698 1 94 GLY H 1 98 TRP HD1 . . 5.500 4.403 3.228 5.577 0.077 20 0 "[ . 1 . 2]" 1
699 1 14 LEU HG 1 136 MET H . . 5.500 4.864 3.829 5.521 0.021 9 0 "[ . 1 . 2]" 1
700 1 133 LEU HG 1 134 CYS H . . 4.660 3.760 3.215 4.164 . 0 0 "[ . 1 . 2]" 1
701 1 92 LEU HA 1 98 TRP HE1 . . 5.190 4.344 3.086 5.227 0.037 17 0 "[ . 1 . 2]" 1
702 1 92 LEU HB2 1 98 TRP HE1 . . 5.500 2.953 1.941 4.051 . 0 0 "[ . 1 . 2]" 1
703 1 92 LEU HB3 1 98 TRP HE1 . . 5.500 2.698 1.941 5.467 . 0 0 "[ . 1 . 2]" 1
704 1 71 ILE H 1 98 TRP HE1 . . 5.500 5.163 4.283 5.560 0.060 8 0 "[ . 1 . 2]" 1
705 1 12 LEU H 1 12 LEU HG . . 5.070 4.460 3.812 4.797 . 0 0 "[ . 1 . 2]" 1
706 1 123 THR HB 1 139 ILE H . . 5.500 3.616 3.200 5.500 . 0 0 "[ . 1 . 2]" 1
707 1 75 VAL H 1 89 PHE HB2 . . 5.500 3.537 3.098 4.422 . 0 0 "[ . 1 . 2]" 1
708 1 75 VAL H 1 89 PHE HB3 . . 5.500 4.128 3.039 4.660 . 0 0 "[ . 1 . 2]" 1
709 1 89 PHE HD1 1 90 SER H . . 4.940 4.267 3.674 4.951 0.011 18 0 "[ . 1 . 2]" 1
710 1 89 PHE H 1 89 PHE HD1 . . 5.160 3.783 3.032 4.592 . 0 0 "[ . 1 . 2]" 1
711 1 122 GLN HE22 1 140 ALA MB . . 6.300 5.016 2.587 6.301 0.001 9 0 "[ . 1 . 2]" 1
712 1 66 VAL MG1 1 70 GLY H . . 6.120 2.923 2.187 4.878 . 0 0 "[ . 1 . 2]" 1
713 1 66 VAL MG2 1 70 GLY H . . 6.120 3.620 2.433 4.830 . 0 0 "[ . 1 . 2]" 1
714 1 10 ARG H 1 137 ILE MG . . 6.520 5.047 3.541 6.135 . 0 0 "[ . 1 . 2]" 1
715 1 10 ARG H 1 138 ALA MB . . 5.150 3.081 2.745 3.381 . 0 0 "[ . 1 . 2]" 1
716 1 31 THR H 1 32 ALA MB . . 6.520 4.338 4.237 4.474 . 0 0 "[ . 1 . 2]" 1
717 1 34 ALA MB 1 35 SER H . . 5.710 2.902 2.824 2.959 . 0 0 "[ . 1 . 2]" 1
718 1 110 VAL H 1 110 VAL MG1 . . 4.260 3.764 3.761 3.766 . 0 0 "[ . 1 . 2]" 1
719 1 110 VAL H 1 110 VAL MG2 . . 4.260 2.152 1.978 2.333 . 0 0 "[ . 1 . 2]" 1
720 1 81 ILE H 1 83 ALA MB . . 6.520 4.904 4.698 5.112 . 0 0 "[ . 1 . 2]" 1
721 1 34 ALA MB 1 36 SER H . . 6.520 4.342 4.245 4.426 . 0 0 "[ . 1 . 2]" 1
722 1 84 ALA MB 1 85 VAL H . . 4.320 2.515 2.023 2.772 . 0 0 "[ . 1 . 2]" 1
723 1 54 THR H 1 54 THR MG . . 4.570 2.156 2.049 2.314 . 0 0 "[ . 1 . 2]" 1
724 1 32 ALA H 1 33 ALA MB . . 6.520 4.613 4.486 4.666 . 0 0 "[ . 1 . 2]" 1
725 1 18 ALA MB 1 19 THR H . . 6.300 2.670 2.187 3.039 . 0 0 "[ . 1 . 2]" 1
726 1 122 GLN HE21 1 140 ALA MB . . 6.300 4.686 3.096 5.971 . 0 0 "[ . 1 . 2]" 1
727 1 33 ALA MB 1 34 ALA H . . 5.930 2.621 2.326 2.791 . 0 0 "[ . 1 . 2]" 1
728 1 32 ALA MB 1 34 ALA H . . 6.520 4.304 4.160 4.548 . 0 0 "[ . 1 . 2]" 1
729 1 34 ALA H 1 45 THR MG . . 6.460 5.180 4.003 6.163 . 0 0 "[ . 1 . 2]" 1
730 1 128 ALA MB 1 132 VAL H . . 6.460 3.080 2.760 3.426 . 0 0 "[ . 1 . 2]" 1
731 1 43 ALA MB 1 47 TYR H . . 6.520 4.682 4.517 4.746 . 0 0 "[ . 1 . 2]" 1
732 1 122 GLN H 1 140 ALA MB . . 5.460 5.231 4.024 5.475 0.015 7 0 "[ . 1 . 2]" 1
733 1 81 ILE MD 1 82 LEU H . . 6.520 4.518 3.846 5.161 . 0 0 "[ . 1 . 2]" 1
734 1 31 THR MG 1 58 GLY H . . 5.150 1.915 1.732 2.156 . 0 0 "[ . 1 . 2]" 1
735 1 53 GLY H 1 54 THR MG . . 6.460 3.767 3.626 4.102 . 0 0 "[ . 1 . 2]" 1
736 1 113 ALA MB 1 116 ASP H . . 6.520 4.469 4.408 4.540 . 0 0 "[ . 1 . 2]" 1
737 1 115 THR MG 1 116 ASP H . . 5.870 3.732 1.914 4.233 . 0 0 "[ . 1 . 2]" 1
738 1 19 THR MG 1 20 LEU H . . 6.210 3.913 2.093 4.429 . 0 0 "[ . 1 . 2]" 1
739 1 20 LEU H 1 20 LEU MD1 . . 5.840 3.446 2.273 4.299 . 0 0 "[ . 1 . 2]" 1
740 1 20 LEU H 1 20 LEU MD2 . . 5.840 3.138 1.939 4.546 . 0 0 "[ . 1 . 2]" 1
741 1 82 LEU MD2 1 83 ALA H . . 6.400 4.450 3.647 4.753 . 0 0 "[ . 1 . 2]" 1
742 1 82 LEU MD1 1 83 ALA H . . 6.400 4.360 3.674 4.756 . 0 0 "[ . 1 . 2]" 1
743 1 52 LEU H 1 52 LEU MD1 . . 5.740 4.097 3.124 4.320 . 0 0 "[ . 1 . 2]" 1
744 1 52 LEU H 1 52 LEU MD2 . . 5.740 4.202 2.780 4.434 . 0 0 "[ . 1 . 2]" 1
745 1 54 THR MG 1 56 THR H . . 4.810 3.323 3.035 4.013 . 0 0 "[ . 1 . 2]" 1
746 1 43 ALA MB 1 44 VAL H . . 4.630 2.236 2.032 2.588 . 0 0 "[ . 1 . 2]" 1
747 1 27 ALA MB 1 28 VAL H . . 4.660 2.307 2.086 2.511 . 0 0 "[ . 1 . 2]" 1
748 1 28 VAL H 1 28 VAL MG1 . . 4.750 3.766 3.763 3.768 . 0 0 "[ . 1 . 2]" 1
749 1 28 VAL H 1 28 VAL MG2 . . 4.750 2.055 1.927 2.335 . 0 0 "[ . 1 . 2]" 1
750 1 104 LEU MD1 1 105 THR H . . 6.520 4.057 2.312 4.885 . 0 0 "[ . 1 . 2]" 1
751 1 14 LEU MD2 1 15 GLY H . . 6.520 4.250 4.074 4.458 . 0 0 "[ . 1 . 2]" 1
752 1 14 LEU MD1 1 15 GLY H . . 6.520 4.089 3.877 4.260 . 0 0 "[ . 1 . 2]" 1
753 1 110 VAL MG1 1 111 SER H . . 5.560 3.445 3.389 3.497 . 0 0 "[ . 1 . 2]" 1
754 1 110 VAL MG2 1 111 SER H . . 5.560 3.794 3.736 3.840 . 0 0 "[ . 1 . 2]" 1
755 1 113 ALA MB 1 114 MET H . . 5.250 2.531 2.416 2.650 . 0 0 "[ . 1 . 2]" 1
756 1 140 ALA MB 1 141 ASP H . . 4.880 3.363 3.071 3.661 . 0 0 "[ . 1 . 2]" 1
757 1 139 ILE MG 1 141 ASP H . . 6.520 4.459 1.957 6.137 . 0 0 "[ . 1 . 2]" 1
758 1 55 GLU H 1 56 THR MG . . 6.520 4.769 3.465 5.422 . 0 0 "[ . 1 . 2]" 1
759 1 126 LEU MD1 1 127 VAL H . . 5.740 4.782 3.725 5.267 . 0 0 "[ . 1 . 2]" 1
760 1 126 LEU MD2 1 127 VAL H . . 5.740 4.410 3.357 4.937 . 0 0 "[ . 1 . 2]" 1
761 1 27 ALA MB 1 78 VAL H . . 6.520 3.807 3.314 4.193 . 0 0 "[ . 1 . 2]" 1
762 1 31 THR MG 1 78 VAL H . . 6.520 4.321 3.953 4.637 . 0 0 "[ . 1 . 2]" 1
763 1 26 LEU MD2 1 51 GLU H . . 6.520 4.657 3.688 6.534 0.014 8 0 "[ . 1 . 2]" 1
764 1 26 LEU MD1 1 51 GLU H . . 6.520 4.966 3.382 6.278 . 0 0 "[ . 1 . 2]" 1
765 1 128 ALA MB 1 129 ILE H . . 4.010 2.834 2.694 3.028 . 0 0 "[ . 1 . 2]" 1
766 1 129 ILE H 1 129 ILE MD . . 4.660 3.963 3.585 4.677 0.017 7 0 "[ . 1 . 2]" 1
767 1 65 ALA MB 1 66 VAL H . . 4.880 2.844 2.565 3.292 . 0 0 "[ . 1 . 2]" 1
768 1 56 THR MG 1 57 LEU H . . 5.840 3.463 2.897 4.239 . 0 0 "[ . 1 . 2]" 1
769 1 80 GLY H 1 81 ILE MG . . 6.520 4.808 3.612 5.984 . 0 0 "[ . 1 . 2]" 1
770 1 106 ILE MD 1 109 ASP H . . 6.210 6.290 6.066 6.414 0.204 6 0 "[ . 1 . 2]" 1
771 1 106 ILE MG 1 109 ASP H . . 6.520 6.315 5.764 6.549 0.029 13 0 "[ . 1 . 2]" 1
772 1 105 THR MG 1 106 ILE H . . 6.180 2.982 2.494 3.601 . 0 0 "[ . 1 . 2]" 1
773 1 18 ALA H 1 19 THR MG . . 6.520 5.391 3.947 6.147 . 0 0 "[ . 1 . 2]" 1
774 1 7 ARG H 1 140 ALA MB . . 6.300 5.032 3.031 5.677 . 0 0 "[ . 1 . 2]" 1
775 1 7 ARG H 1 139 ILE MG . . 5.530 2.763 1.982 4.687 . 0 0 "[ . 1 . 2]" 1
776 1 7 ARG H 1 139 ILE MD . . 6.520 4.138 1.931 5.931 . 0 0 "[ . 1 . 2]" 1
777 1 44 VAL MG2 1 45 THR H . . 6.180 3.167 2.046 3.826 . 0 0 "[ . 1 . 2]" 1
778 1 65 ALA H 1 71 ILE MG . . 6.390 4.871 4.305 5.724 . 0 0 "[ . 1 . 2]" 1
779 1 33 ALA MB 1 45 THR H . . 6.180 4.125 3.030 5.311 . 0 0 "[ . 1 . 2]" 1
780 1 44 VAL MG1 1 45 THR H . . 6.180 3.252 1.992 3.983 . 0 0 "[ . 1 . 2]" 1
781 1 137 ILE MG 1 138 ALA H . . 4.750 3.053 1.941 3.936 . 0 0 "[ . 1 . 2]" 1
782 1 32 ALA MB 1 33 ALA H . . 4.940 2.232 2.040 2.585 . 0 0 "[ . 1 . 2]" 1
783 1 31 THR MG 1 59 TYR H . . 5.590 1.971 1.841 2.230 . 0 0 "[ . 1 . 2]" 1
784 1 106 ILE MD 1 107 SER H . . 5.000 3.515 2.068 3.931 . 0 0 "[ . 1 . 2]" 1
785 1 106 ILE MG 1 107 SER H . . 4.720 3.801 3.630 4.033 . 0 0 "[ . 1 . 2]" 1
786 1 31 THR MG 1 60 CYS H . . 5.810 5.045 4.778 5.527 . 0 0 "[ . 1 . 2]" 1
787 1 115 THR MG 1 118 GLU H . . 6.520 4.635 4.456 4.919 . 0 0 "[ . 1 . 2]" 1
788 1 71 ILE H 1 93 ILE MG . . 6.180 3.951 2.602 4.912 . 0 0 "[ . 1 . 2]" 1
789 1 115 THR MG 1 119 MET H . . 6.520 4.734 4.192 5.455 . 0 0 "[ . 1 . 2]" 1
790 1 26 LEU H 1 27 ALA MB . . 6.520 4.445 4.386 4.520 . 0 0 "[ . 1 . 2]" 1
791 1 26 LEU H 1 26 LEU MD2 . . 4.750 3.365 2.265 4.220 . 0 0 "[ . 1 . 2]" 1
792 1 26 LEU H 1 26 LEU MD1 . . 4.750 3.854 3.513 4.251 . 0 0 "[ . 1 . 2]" 1
793 1 8 VAL H 1 139 ILE MG . . 6.520 3.661 3.206 6.273 . 0 0 "[ . 1 . 2]" 1
794 1 27 ALA MB 1 30 GLY H . . 6.520 4.573 4.518 4.636 . 0 0 "[ . 1 . 2]" 1
795 1 29 VAL MG2 1 30 GLY H . . 6.520 3.883 3.788 3.920 . 0 0 "[ . 1 . 2]" 1
796 1 112 ASP H 1 113 ALA MB . . 6.520 4.379 4.310 4.429 . 0 0 "[ . 1 . 2]" 1
797 1 92 LEU H 1 128 ALA MB . . 5.060 3.468 2.966 3.871 . 0 0 "[ . 1 . 2]" 1
798 1 64 GLN H 1 71 ILE MG . . 6.520 4.629 3.384 6.104 . 0 0 "[ . 1 . 2]" 1
799 1 125 ILE H 1 138 ALA MB . . 6.520 4.270 3.680 4.651 . 0 0 "[ . 1 . 2]" 1
800 1 61 THR MG 1 62 ASP H . . 4.470 3.811 1.896 4.302 . 0 0 "[ . 1 . 2]" 1
801 1 124 ALA MB 1 125 ILE H . . 5.060 3.326 2.984 3.442 . 0 0 "[ . 1 . 2]" 1
802 1 71 ILE MG 1 72 GLY H . . 5.930 2.782 1.987 3.778 . 0 0 "[ . 1 . 2]" 1
803 1 29 VAL H 1 29 VAL MG2 . . 4.500 1.984 1.921 2.211 . 0 0 "[ . 1 . 2]" 1
804 1 29 VAL H 1 29 VAL MG1 . . 4.500 3.765 3.762 3.768 . 0 0 "[ . 1 . 2]" 1
805 1 139 ILE MG 1 140 ALA H . . 4.530 2.886 1.934 3.708 . 0 0 "[ . 1 . 2]" 1
806 1 123 THR MG 1 124 ALA H . . 4.720 3.273 2.254 4.228 . 0 0 "[ . 1 . 2]" 1
807 1 31 THR MG 1 76 SER H . . 5.250 2.542 2.342 2.800 . 0 0 "[ . 1 . 2]" 1
808 1 93 ILE MG 1 94 GLY H . . 6.520 3.024 2.077 4.139 . 0 0 "[ . 1 . 2]" 1
809 1 126 LEU H 1 126 LEU MD1 . . 5.340 2.416 1.927 2.785 . 0 0 "[ . 1 . 2]" 1
810 1 126 LEU H 1 126 LEU MD2 . . 5.340 3.879 1.858 4.354 . 0 0 "[ . 1 . 2]" 1
811 1 8 VAL MG1 1 9 MET H . . 6.330 3.149 2.110 4.094 . 0 0 "[ . 1 . 2]" 1
812 1 9 MET H 1 139 ILE MG . . 6.180 3.492 2.750 4.967 . 0 0 "[ . 1 . 2]" 1
813 1 8 VAL MG2 1 9 MET H . . 6.330 3.361 2.214 4.142 . 0 0 "[ . 1 . 2]" 1
814 1 106 ILE MG 1 108 SER H . . 6.520 4.711 4.220 5.625 . 0 0 "[ . 1 . 2]" 1
815 1 128 ALA MB 1 131 GLY H . . 6.520 3.730 3.552 3.860 . 0 0 "[ . 1 . 2]" 1
816 1 129 ILE MG 1 131 GLY H . . 6.080 4.975 4.391 5.538 . 0 0 "[ . 1 . 2]" 1
817 1 11 VAL MG2 1 12 LEU H . . 5.060 3.046 2.050 4.142 . 0 0 "[ . 1 . 2]" 1
818 1 11 VAL MG1 1 12 LEU H . . 5.060 3.329 2.226 4.035 . 0 0 "[ . 1 . 2]" 1
819 1 123 THR MG 1 139 ILE H . . 6.520 4.692 2.972 5.092 . 0 0 "[ . 1 . 2]" 1
820 1 138 ALA MB 1 139 ILE H . . 5.150 3.229 3.108 3.432 . 0 0 "[ . 1 . 2]" 1
821 1 126 LEU MD1 1 137 ILE H . . 5.930 5.269 3.944 5.820 . 0 0 "[ . 1 . 2]" 1
822 1 137 ILE H 1 138 ALA MB . . 6.390 4.919 4.696 5.183 . 0 0 "[ . 1 . 2]" 1
823 1 126 LEU MD2 1 137 ILE H . . 5.930 4.688 4.002 5.190 . 0 0 "[ . 1 . 2]" 1
824 1 127 VAL MG2 1 128 ALA H . . 4.720 3.447 2.230 4.179 . 0 0 "[ . 1 . 2]" 1
825 1 127 VAL MG1 1 128 ALA H . . 4.720 3.068 2.209 4.099 . 0 0 "[ . 1 . 2]" 1
826 1 90 SER H 1 129 ILE MG . . 5.710 5.240 3.716 5.756 0.046 14 0 "[ . 1 . 2]" 1
827 1 88 THR MG 1 89 PHE H . . 5.000 3.463 2.942 3.826 . 0 0 "[ . 1 . 2]" 1
828 1 129 ILE MG 1 130 ASP H . . 5.430 3.472 2.119 3.900 . 0 0 "[ . 1 . 2]" 1
829 1 129 ILE MD 1 130 ASP H . . 6.520 4.351 3.490 5.224 . 0 0 "[ . 1 . 2]" 1
830 1 81 ILE HB 1 82 LEU H . . 5.440 3.038 1.919 4.115 . 0 0 "[ . 1 . 2]" 1
831 1 115 THR HA 1 118 GLU HB2 . . 4.350 2.129 1.943 2.893 . 0 0 "[ . 1 . 2]" 1
832 1 45 THR HA 1 48 CYS HB2 . . 5.280 4.350 2.920 5.280 . 16 0 "[ . 1 . 2]" 1
833 1 45 THR HA 1 48 CYS HB3 . . 5.280 4.432 3.380 4.904 . 0 0 "[ . 1 . 2]" 1
834 1 25 VAL HA 1 28 VAL HB . . 5.220 2.802 2.534 3.085 . 0 0 "[ . 1 . 2]" 1
835 1 28 VAL HA 1 31 THR HB . . 5.500 4.368 3.817 4.845 . 0 0 "[ . 1 . 2]" 1
836 1 45 THR HA 1 46 LYS HA . . 5.500 4.796 4.774 4.832 . 0 0 "[ . 1 . 2]" 1
837 1 34 ALA HA 1 45 THR HA . . 5.500 4.493 3.377 5.503 0.003 14 0 "[ . 1 . 2]" 1
838 1 8 VAL HA 1 139 ILE HA . . 5.000 2.385 2.040 2.736 . 0 0 "[ . 1 . 2]" 1
839 1 42 VAL HA 1 45 THR HB . . 4.540 2.708 2.571 3.163 . 0 0 "[ . 1 . 2]" 1
840 1 31 THR HA 1 76 SER HA . . 5.500 4.632 4.569 4.761 . 0 0 "[ . 1 . 2]" 1
841 1 87 GLN HA 1 88 THR HB . . 5.500 5.346 4.576 5.531 0.031 4 0 "[ . 1 . 2]" 1
842 1 122 GLN HA 1 123 THR HB . . 5.500 5.073 4.557 5.423 . 0 0 "[ . 1 . 2]" 1
843 1 50 GLU HA 1 52 LEU H . . 4.320 4.332 4.308 4.362 0.042 2 0 "[ . 1 . 2]" 1
844 1 56 THR HB 1 57 LEU HA . . 4.940 4.308 3.874 4.541 . 0 0 "[ . 1 . 2]" 1
845 1 97 GLU HA 1 101 ARG H . . 5.500 4.155 3.977 4.264 . 0 0 "[ . 1 . 2]" 1
846 1 115 THR HA 1 118 GLU HB3 . . 4.350 3.261 2.152 3.814 . 0 0 "[ . 1 . 2]" 1
847 1 45 THR HB 1 46 LYS H . . 5.500 2.349 2.211 2.524 . 0 0 "[ . 1 . 2]" 1
848 1 115 THR HB 1 116 ASP H . . 5.500 3.208 2.845 4.174 . 0 0 "[ . 1 . 2]" 1
849 1 112 ASP HA 1 116 ASP H . . 5.500 4.050 3.935 4.156 . 0 0 "[ . 1 . 2]" 1
850 1 100 ARG HA 1 104 LEU HA . . 5.410 4.090 1.955 5.575 0.165 1 0 "[ . 1 . 2]" 1
851 1 76 SER HA 1 88 THR HA . . 5.280 5.280 4.575 5.451 0.171 17 0 "[ . 1 . 2]" 1
852 1 128 ALA HA 1 133 LEU HA . . 4.880 2.012 1.966 2.165 . 0 0 "[ . 1 . 2]" 1
853 1 60 CYS HA 1 75 VAL HA . . 5.130 3.379 2.150 5.036 . 0 0 "[ . 1 . 2]" 1
854 1 93 ILE HA 1 127 VAL HA . . 5.280 2.335 2.101 2.543 . 0 0 "[ . 1 . 2]" 1
855 1 74 LYS HA 1 90 SER HA . . 4.880 2.432 1.971 2.900 . 0 0 "[ . 1 . 2]" 1
856 1 106 ILE HG13 1 108 SER HA . . 5.500 5.343 4.315 5.549 0.049 13 0 "[ . 1 . 2]" 1
857 1 106 ILE HG12 1 108 SER HA . . 5.500 4.803 4.275 5.541 0.041 12 0 "[ . 1 . 2]" 1
858 1 22 LEU HG 1 26 LEU HG . . 5.500 3.047 2.176 4.397 . 0 0 "[ . 1 . 2]" 1
859 1 100 ARG HG3 1 101 ARG H . . 5.500 4.995 4.514 5.436 . 0 0 "[ . 1 . 2]" 1
860 1 26 LEU HA 1 52 LEU HG . . 5.500 4.956 3.908 5.545 0.045 2 0 "[ . 1 . 2]" 1
861 1 26 LEU H 1 26 LEU HG . . 5.500 3.387 2.246 4.534 . 0 0 "[ . 1 . 2]" 1
862 1 63 PHE HA 1 73 CYS HB2 . . 5.500 2.994 2.730 3.543 . 0 0 "[ . 1 . 2]" 1
863 1 63 PHE HA 1 73 CYS HB3 . . 5.500 2.130 1.923 2.687 . 0 0 "[ . 1 . 2]" 1
864 1 22 LEU HG 1 23 ARG HA . . 5.500 3.903 3.587 4.133 . 0 0 "[ . 1 . 2]" 1
865 1 123 THR HB 1 139 ILE HB . . 5.500 3.597 2.132 4.756 . 0 0 "[ . 1 . 2]" 1
866 1 47 TYR HD1 1 48 CYS HA . . 5.500 4.941 3.772 5.489 . 0 0 "[ . 1 . 2]" 1
867 1 31 THR HB 1 76 SER HA . . 5.500 2.331 2.170 2.548 . 0 0 "[ . 1 . 2]" 1
868 1 122 GLN HA 1 139 ILE HB . . 5.500 5.140 4.477 5.545 0.045 13 0 "[ . 1 . 2]" 1
869 1 128 ALA HA 1 133 LEU HG . . 5.500 4.518 3.481 5.396 . 0 0 "[ . 1 . 2]" 1
870 1 29 VAL MG1 1 30 GLY H . . 6.520 3.623 3.453 3.725 . 0 0 "[ . 1 . 2]" 1
871 1 104 LEU MD2 1 105 THR H . . 6.520 3.354 1.893 5.414 . 0 0 "[ . 1 . 2]" 1
872 1 9 MET H 1 138 ALA MB . . 6.520 4.090 3.845 4.438 . 0 0 "[ . 1 . 2]" 1
873 1 123 THR MG 1 139 ILE MD . . 7.540 3.419 2.350 5.551 . 0 0 "[ . 1 . 2]" 1
874 1 128 ALA MB 1 133 LEU HA . . 6.210 2.102 1.965 2.424 . 0 0 "[ . 1 . 2]" 1
875 1 31 THR MG 1 34 ALA MB . . 6.950 3.138 2.908 3.406 . 0 0 "[ . 1 . 2]" 1
876 1 76 SER HA 1 88 THR MG . . 6.520 5.802 5.541 6.787 0.267 19 0 "[ . 1 . 2]" 1
877 1 34 ALA MB 1 45 THR MG . . 6.420 3.327 1.913 4.323 . 0 0 "[ . 1 . 2]" 1
878 1 45 THR MG 1 49 LYS HA . . 6.520 4.939 4.646 5.208 . 0 0 "[ . 1 . 2]" 1
879 1 45 THR MG 1 46 LYS HA . . 6.520 3.386 3.179 3.587 . 0 0 "[ . 1 . 2]" 1
880 1 63 PHE QD 1 65 ALA MB . . 6.520 4.063 3.456 4.706 . 0 0 "[ . 1 . 2]" 1
881 1 63 PHE QE 1 65 ALA MB . . 6.520 2.802 1.977 3.601 . 0 0 "[ . 1 . 2]" 1
882 1 83 ALA HA 1 84 ALA MB . . 6.520 4.532 4.336 4.680 . 0 0 "[ . 1 . 2]" 1
883 1 115 THR MG 1 119 MET HB3 . . 6.520 5.885 5.179 6.473 . 0 0 "[ . 1 . 2]" 1
884 1 115 THR MG 1 119 MET HB2 . . 6.520 4.572 3.754 5.360 . 0 0 "[ . 1 . 2]" 1
885 1 129 ILE MG 1 130 ASP HB2 . . 6.520 4.225 2.327 6.354 . 0 0 "[ . 1 . 2]" 1
886 1 129 ILE MG 1 130 ASP HB3 . . 6.520 4.878 3.239 6.401 . 0 0 "[ . 1 . 2]" 1
887 1 29 VAL HA 1 32 ALA MB . . 6.520 2.444 2.323 2.683 . 0 0 "[ . 1 . 2]" 1
888 1 43 ALA MB 1 44 VAL HA . . 6.520 3.684 3.591 3.806 . 0 0 "[ . 1 . 2]" 1
889 1 28 VAL HA 1 31 THR MG . . 6.430 5.558 5.065 5.914 . 0 0 "[ . 1 . 2]" 1
890 1 8 VAL HA 1 139 ILE MD . . 6.520 4.267 1.899 5.297 . 0 0 "[ . 1 . 2]" 1
891 1 8 VAL HA 1 139 ILE MG . . 6.520 2.467 1.910 4.795 . 0 0 "[ . 1 . 2]" 1
892 1 110 VAL HA 1 113 ALA MB . . 6.520 2.910 2.766 3.125 . 0 0 "[ . 1 . 2]" 1
893 1 42 VAL HA 1 45 THR MG . . 6.300 3.927 3.732 4.411 . 0 0 "[ . 1 . 2]" 1
894 1 31 THR HA 1 34 ALA MB . . 6.520 2.182 1.961 2.495 . 0 0 "[ . 1 . 2]" 1
895 1 123 THR HB 1 139 ILE MG . . 6.520 3.878 1.999 5.573 . 0 0 "[ . 1 . 2]" 1
896 1 27 ALA HA 1 52 LEU MD1 . . 6.520 3.055 2.410 3.615 . 0 0 "[ . 1 . 2]" 1
897 1 27 ALA HA 1 52 LEU MD2 . . 6.520 4.802 2.035 5.882 . 0 0 "[ . 1 . 2]" 1
898 1 49 LYS HA 1 54 THR MG . . 6.520 3.977 3.584 4.867 . 0 0 "[ . 1 . 2]" 1
899 1 24 LYS HA 1 27 ALA MB . . 6.520 2.965 2.648 3.331 . 0 0 "[ . 1 . 2]" 1
900 1 114 MET HA 1 124 ALA MB . . 6.460 5.161 4.451 5.699 . 0 0 "[ . 1 . 2]" 1
901 1 34 ALA HA 1 45 THR MG . . 6.520 3.707 2.711 5.019 . 0 0 "[ . 1 . 2]" 1
902 1 124 ALA MB 1 138 ALA HA . . 6.520 3.259 1.974 4.453 . 0 0 "[ . 1 . 2]" 1
903 1 4 MET H 1 4 MET QB . . 3.700 2.610 2.220 3.343 . 0 0 "[ . 1 . 2]" 1
904 1 4 MET HA 1 6 PRO QG . . 5.350 4.980 4.657 5.254 . 0 0 "[ . 1 . 2]" 1
905 1 4 MET QB 1 5 VAL QG . . 5.560 3.715 2.868 4.605 . 0 0 "[ . 1 . 2]" 1
906 1 4 MET QG 1 5 VAL H . . 5.340 4.291 3.502 4.711 . 0 0 "[ . 1 . 2]" 1
907 1 5 VAL QG 1 6 PRO QD . . 6.190 3.230 3.194 3.272 . 0 0 "[ . 1 . 2]" 1
908 1 5 VAL QG 1 7 ARG H . . 6.330 5.064 4.435 5.545 . 0 0 "[ . 1 . 2]" 1
909 1 6 PRO QB 1 7 ARG H . . 3.250 2.735 2.045 3.216 . 0 0 "[ . 1 . 2]" 1
910 1 6 PRO QB 1 139 ILE MG . . 6.290 3.250 2.105 5.079 . 0 0 "[ . 1 . 2]" 1
911 1 6 PRO QG 1 7 ARG H . . 5.030 4.288 3.751 4.614 . 0 0 "[ . 1 . 2]" 1
912 1 7 ARG H 1 7 ARG QB . . 3.550 2.809 2.771 2.838 . 0 0 "[ . 1 . 2]" 1
913 1 7 ARG H 1 7 ARG QG . . 4.470 4.183 3.766 4.315 . 0 0 "[ . 1 . 2]" 1
914 1 7 ARG H 1 7 ARG QD . . 5.340 4.875 4.457 5.108 . 0 0 "[ . 1 . 2]" 1
915 1 7 ARG QB 1 8 VAL H . . 4.020 3.790 3.568 3.897 . 0 0 "[ . 1 . 2]" 1
916 1 7 ARG QB 1 140 ALA H . . 5.340 3.618 3.090 4.208 . 0 0 "[ . 1 . 2]" 1
917 1 7 ARG QD 1 8 VAL H . . 5.340 4.315 2.795 5.185 . 0 0 "[ . 1 . 2]" 1
918 1 7 ARG QD 1 8 VAL QG . . 6.190 4.588 2.669 5.655 . 0 0 "[ . 1 . 2]" 1
919 1 8 VAL QG 1 9 MET H . . 5.440 2.453 2.103 2.668 . 0 0 "[ . 1 . 2]" 1
920 1 8 VAL QG 1 10 ARG H . . 5.470 2.786 2.388 3.021 . 0 0 "[ . 1 . 2]" 1
921 1 8 VAL QG 1 138 ALA H . . 6.420 3.608 3.109 3.990 . 0 0 "[ . 1 . 2]" 1
922 1 8 VAL QG 1 140 ALA H . . 6.420 4.601 3.904 4.989 . 0 0 "[ . 1 . 2]" 1
923 1 9 MET H 1 9 MET QB . . 3.440 2.336 2.165 2.458 . 0 0 "[ . 1 . 2]" 1
924 1 9 MET H 1 9 MET QG . . 4.650 3.987 3.771 4.130 . 0 0 "[ . 1 . 2]" 1
925 1 9 MET QB 1 10 ARG H . . 3.940 2.439 2.367 2.658 . 0 0 "[ . 1 . 2]" 1
926 1 9 MET QB 1 138 ALA H . . 5.340 4.515 4.083 5.117 . 0 0 "[ . 1 . 2]" 1
927 1 9 MET QB 1 140 ALA H . . 5.340 2.739 2.428 3.295 . 0 0 "[ . 1 . 2]" 1
928 1 9 MET QB 1 140 ALA MB . . 6.290 2.352 1.877 4.651 . 0 0 "[ . 1 . 2]" 1
929 1 9 MET QG 1 10 ARG H . . 5.340 4.128 3.301 4.519 . 0 0 "[ . 1 . 2]" 1
930 1 9 MET QG 1 140 ALA H . . 5.260 4.149 3.651 5.190 . 0 0 "[ . 1 . 2]" 1
931 1 9 MET QG 1 140 ALA MB . . 6.290 2.409 1.883 5.071 . 0 0 "[ . 1 . 2]" 1
932 1 10 ARG H 1 10 ARG QB . . 3.530 2.888 2.706 3.360 . 0 0 "[ . 1 . 2]" 1
933 1 10 ARG QB 1 138 ALA H . . 5.340 3.814 3.314 4.902 . 0 0 "[ . 1 . 2]" 1
934 1 10 ARG QB 1 138 ALA MB . . 6.290 2.800 2.028 4.216 . 0 0 "[ . 1 . 2]" 1
935 1 10 ARG QD 1 138 ALA MB . . 6.290 4.203 2.761 5.409 . 0 0 "[ . 1 . 2]" 1
936 1 11 VAL QG 1 12 LEU H . . 4.290 2.374 2.043 3.456 . 0 0 "[ . 1 . 2]" 1
937 1 11 VAL QG 1 12 LEU HG . . 5.710 4.864 3.997 5.538 . 0 0 "[ . 1 . 2]" 1
938 1 11 VAL QG 1 13 LEU H . . 6.420 4.654 4.081 5.671 . 0 0 "[ . 1 . 2]" 1
939 1 11 VAL QG 1 137 ILE HB . . 6.420 3.134 1.955 4.340 . 0 0 "[ . 1 . 2]" 1
940 1 12 LEU H 1 12 LEU QB . . 3.210 2.691 2.507 2.784 . 0 0 "[ . 1 . 2]" 1
941 1 12 LEU QB 1 13 LEU H . . 3.740 2.987 2.521 3.567 . 0 0 "[ . 1 . 2]" 1
942 1 12 LEU QB 1 136 MET H . . 3.910 3.749 3.272 3.991 0.081 18 0 "[ . 1 . 2]" 1
943 1 12 LEU QD 1 13 LEU H . . 6.420 2.808 1.875 3.598 . 0 0 "[ . 1 . 2]" 1
944 1 13 LEU H 1 13 LEU QD . . 4.580 2.656 2.008 3.435 . 0 0 "[ . 1 . 2]" 1
945 1 13 LEU QB 1 14 LEU H . . 4.210 3.073 2.820 3.310 . 0 0 "[ . 1 . 2]" 1
946 1 13 LEU QB 1 15 GLY H . . 4.760 4.682 4.460 4.832 0.072 7 0 "[ . 1 . 2]" 1
947 1 14 LEU H 1 14 LEU QD . . 4.560 3.119 2.554 3.584 . 0 0 "[ . 1 . 2]" 1
948 1 14 LEU H 1 134 CYS QB . . 5.340 4.917 4.585 5.093 . 0 0 "[ . 1 . 2]" 1
949 1 14 LEU H 1 135 GLY QA . . 3.400 2.064 1.912 2.329 . 0 0 "[ . 1 . 2]" 1
950 1 14 LEU QB 1 15 GLY H . . 3.420 2.056 1.920 2.236 . 0 0 "[ . 1 . 2]" 1
951 1 14 LEU QB 1 135 GLY H . . 5.340 3.978 3.604 4.645 . 0 0 "[ . 1 . 2]" 1
952 1 14 LEU QB 1 136 MET H . . 5.340 5.018 4.641 5.327 . 0 0 "[ . 1 . 2]" 1
953 1 14 LEU QD 1 15 GLY H . . 5.500 3.699 3.620 3.800 . 0 0 "[ . 1 . 2]" 1
954 1 14 LEU QD 1 136 MET H . . 5.200 4.036 3.009 4.818 . 0 0 "[ . 1 . 2]" 1
955 1 15 GLY QA 1 16 ASP H . . 2.890 2.119 2.118 2.120 . 0 0 "[ . 1 . 2]" 1
956 1 16 ASP H 1 132 VAL QG . . 6.420 4.656 4.125 5.164 . 0 0 "[ . 1 . 2]" 1
957 1 16 ASP QB 1 17 VAL H . . 3.660 2.681 2.290 3.520 . 0 0 "[ . 1 . 2]" 1
958 1 17 VAL QG 1 18 ALA H . . 5.410 2.863 2.648 3.648 . 0 0 "[ . 1 . 2]" 1
959 1 19 THR H 1 20 LEU QB . . 4.940 4.337 3.689 4.948 0.008 15 0 "[ . 1 . 2]" 1
960 1 19 THR H 1 20 LEU QD . . 5.770 3.571 2.685 4.947 . 0 0 "[ . 1 . 2]" 1
961 1 20 LEU H 1 20 LEU QB . . 3.140 2.383 2.082 3.135 . 0 0 "[ . 1 . 2]" 1
962 1 20 LEU H 1 20 LEU QD . . 4.690 2.522 1.932 3.877 . 0 0 "[ . 1 . 2]" 1
963 1 20 LEU QB 1 25 VAL QG . . 4.880 2.303 1.951 2.957 . 0 0 "[ . 1 . 2]" 1
964 1 20 LEU QD 1 25 VAL HA . . 6.420 3.921 2.512 5.273 . 0 0 "[ . 1 . 2]" 1
965 1 21 PRO HA 1 22 LEU QD . . 6.420 5.236 5.087 5.538 . 0 0 "[ . 1 . 2]" 1
966 1 21 PRO QB 1 22 LEU H . . 2.960 2.423 2.039 2.590 . 0 0 "[ . 1 . 2]" 1
967 1 21 PRO QB 1 22 LEU QD . . 6.190 4.866 4.472 4.998 . 0 0 "[ . 1 . 2]" 1
968 1 21 PRO QB 1 23 ARG H . . 4.470 2.651 2.484 2.770 . 0 0 "[ . 1 . 2]" 1
969 1 21 PRO QB 1 24 LYS H . . 4.880 3.209 2.971 3.736 . 0 0 "[ . 1 . 2]" 1
970 1 21 PRO QD 1 24 LYS QB . . 4.760 2.079 1.925 2.307 . 0 0 "[ . 1 . 2]" 1
971 1 22 LEU H 1 22 LEU QD . . 4.620 3.659 3.575 3.724 . 0 0 "[ . 1 . 2]" 1
972 1 22 LEU QB 1 23 ARG H . . 2.900 2.493 2.350 2.658 . 0 0 "[ . 1 . 2]" 1
973 1 22 LEU HG 1 25 VAL QG . . 6.420 4.817 4.352 5.231 . 0 0 "[ . 1 . 2]" 1
974 1 22 LEU QD 1 23 ARG H . . 4.770 3.733 3.252 3.956 . 0 0 "[ . 1 . 2]" 1
975 1 22 LEU QD 1 23 ARG QB . . 5.740 4.777 4.153 5.108 . 0 0 "[ . 1 . 2]" 1
976 1 23 ARG H 1 23 ARG QB . . 2.910 2.342 2.083 2.587 . 0 0 "[ . 1 . 2]" 1
977 1 23 ARG HA 1 26 LEU QD . . 6.420 3.327 2.274 4.725 . 0 0 "[ . 1 . 2]" 1
978 1 23 ARG QB 1 24 LYS H . . 3.560 2.513 2.335 3.251 . 0 0 "[ . 1 . 2]" 1
979 1 23 ARG QB 1 24 LYS QE . . 5.180 4.196 3.487 5.029 . 0 0 "[ . 1 . 2]" 1
980 1 23 ARG QB 1 27 ALA H . . 4.880 4.804 4.743 4.861 . 0 0 "[ . 1 . 2]" 1
981 1 23 ARG QD 1 24 LYS H . . 5.340 4.710 3.894 5.117 . 0 0 "[ . 1 . 2]" 1
982 1 24 LYS H 1 24 LYS QB . . 3.010 2.188 2.068 2.305 . 0 0 "[ . 1 . 2]" 1
983 1 24 LYS H 1 24 LYS QG . . 4.730 3.410 2.478 4.043 . 0 0 "[ . 1 . 2]" 1
984 1 24 LYS H 1 25 VAL QG . . 6.420 4.184 4.087 4.326 . 0 0 "[ . 1 . 2]" 1
985 1 24 LYS HA 1 25 VAL QG . . 6.420 4.762 4.722 4.809 . 0 0 "[ . 1 . 2]" 1
986 1 24 LYS QB 1 24 LYS QE . . 4.180 3.243 2.091 3.734 . 0 0 "[ . 1 . 2]" 1
987 1 24 LYS QB 1 25 VAL H . . 2.930 2.387 2.109 2.612 . 0 0 "[ . 1 . 2]" 1
988 1 24 LYS QB 1 25 VAL QG . . 6.190 3.067 2.818 3.195 . 0 0 "[ . 1 . 2]" 1
989 1 25 VAL H 1 25 VAL QG . . 4.110 2.118 1.920 2.286 . 0 0 "[ . 1 . 2]" 1
990 1 25 VAL QG 1 26 LEU H . . 5.200 3.132 2.882 3.258 . 0 0 "[ . 1 . 2]" 1
991 1 25 VAL QG 1 26 LEU HA . . 6.420 3.391 3.243 3.561 . 0 0 "[ . 1 . 2]" 1
992 1 25 VAL QG 1 28 VAL HB . . 4.840 3.887 3.542 4.066 . 0 0 "[ . 1 . 2]" 1
993 1 26 LEU H 1 26 LEU QB . . 2.940 2.147 2.025 2.450 . 0 0 "[ . 1 . 2]" 1
994 1 26 LEU HA 1 29 VAL QG . . 6.420 3.889 3.714 4.198 . 0 0 "[ . 1 . 2]" 1
995 1 26 LEU QB 1 27 ALA H . . 3.410 2.386 2.233 2.643 . 0 0 "[ . 1 . 2]" 1
996 1 26 LEU QD 1 27 ALA H . . 6.420 3.839 3.447 4.046 . 0 0 "[ . 1 . 2]" 1
997 1 26 LEU QD 1 51 GLU QG . . 6.190 2.531 1.942 3.939 . 0 0 "[ . 1 . 2]" 1
998 1 26 LEU QD 1 52 LEU H . . 6.420 3.161 2.449 3.798 . 0 0 "[ . 1 . 2]" 1
999 1 27 ALA H 1 28 VAL QG . . 6.420 4.257 4.144 4.347 . 0 0 "[ . 1 . 2]" 1
1000 1 27 ALA H 1 52 LEU QD . . 6.240 3.871 3.283 4.515 . 0 0 "[ . 1 . 2]" 1
1001 1 27 ALA HA 1 52 LEU QD . . 5.560 2.987 1.940 3.584 . 0 0 "[ . 1 . 2]" 1
1002 1 27 ALA MB 1 28 VAL QG . . 7.390 2.996 2.781 3.258 . 0 0 "[ . 1 . 2]" 1
1003 1 27 ALA MB 1 78 VAL QG . . 7.390 2.183 1.711 2.916 . 0 0 "[ . 1 . 2]" 1
1004 1 28 VAL H 1 28 VAL QG . . 4.150 2.046 1.922 2.313 . 0 0 "[ . 1 . 2]" 1
1005 1 28 VAL H 1 78 VAL QG . . 5.530 4.545 3.820 5.334 . 0 0 "[ . 1 . 2]" 1
1006 1 28 VAL QG 1 29 VAL H . . 4.140 2.709 2.599 2.856 . 0 0 "[ . 1 . 2]" 1
1007 1 28 VAL QG 1 29 VAL HA . . 6.360 3.168 3.044 3.311 . 0 0 "[ . 1 . 2]" 1
1008 1 28 VAL QG 1 30 GLY QA . . 6.190 5.243 5.208 5.324 . 0 0 "[ . 1 . 2]" 1
1009 1 28 VAL QG 1 31 THR MG . . 7.390 5.565 5.131 5.847 . 0 0 "[ . 1 . 2]" 1
1010 1 28 VAL QG 1 90 SER H . . 6.420 5.468 4.661 6.251 . 0 0 "[ . 1 . 2]" 1
1011 1 29 VAL QG 1 30 GLY H . . 5.400 3.329 3.225 3.380 . 0 0 "[ . 1 . 2]" 1
1012 1 29 VAL QG 1 32 ALA H . . 6.150 4.802 4.721 4.899 . 0 0 "[ . 1 . 2]" 1
1013 1 29 VAL QG 1 32 ALA MB . . 7.390 3.473 3.395 3.591 . 0 0 "[ . 1 . 2]" 1
1014 1 29 VAL QG 1 33 ALA H . . 6.420 3.556 3.376 3.890 . 0 0 "[ . 1 . 2]" 1
1015 1 29 VAL QG 1 33 ALA HA . . 6.420 4.559 4.394 4.732 . 0 0 "[ . 1 . 2]" 1
1016 1 30 GLY QA 1 31 THR MG . . 6.290 4.979 4.631 5.187 . 0 0 "[ . 1 . 2]" 1
1017 1 30 GLY QA 1 34 ALA H . . 4.940 4.013 3.831 4.118 . 0 0 "[ . 1 . 2]" 1
1018 1 30 GLY QA 1 57 LEU QD . . 6.190 2.466 1.871 4.087 . 0 0 "[ . 1 . 2]" 1
1019 1 31 THR H 1 57 LEU QD . . 5.610 3.316 2.247 5.321 . 0 0 "[ . 1 . 2]" 1
1020 1 31 THR HA 1 57 LEU QD . . 6.420 3.039 2.202 4.136 . 0 0 "[ . 1 . 2]" 1
1021 1 31 THR MG 1 58 GLY QA . . 6.290 2.049 1.913 2.604 . 0 0 "[ . 1 . 2]" 1
1022 1 32 ALA H 1 75 VAL QG . . 6.210 3.526 2.821 4.859 . 0 0 "[ . 1 . 2]" 1
1023 1 32 ALA HA 1 75 VAL QG . . 6.420 2.502 1.878 3.972 . 0 0 "[ . 1 . 2]" 1
1024 1 33 ALA H 1 44 VAL QG . . 6.420 4.310 3.736 5.332 . 0 0 "[ . 1 . 2]" 1
1025 1 33 ALA H 1 75 VAL QG . . 6.420 4.951 4.513 6.187 . 0 0 "[ . 1 . 2]" 1
1026 1 34 ALA H 1 57 LEU QD . . 6.420 4.020 3.324 4.620 . 0 0 "[ . 1 . 2]" 1
1027 1 35 SER QB 1 36 SER H . . 4.320 3.641 2.984 3.891 . 0 0 "[ . 1 . 2]" 1
1028 1 36 SER H 1 36 SER QB . . 3.590 2.408 2.241 2.763 . 0 0 "[ . 1 . 2]" 1
1029 1 36 SER H 1 41 GLY QA . . 5.340 4.702 4.046 5.371 0.031 20 0 "[ . 1 . 2]" 1
1030 1 37 GLU QB 1 38 HIS H . . 4.340 3.591 3.243 4.021 . 0 0 "[ . 1 . 2]" 1
1031 1 38 HIS QB 1 41 GLY H . . 4.940 3.471 3.201 3.992 . 0 0 "[ . 1 . 2]" 1
1032 1 41 GLY H 1 42 VAL QG . . 6.420 3.806 3.604 4.275 . 0 0 "[ . 1 . 2]" 1
1033 1 42 VAL QG 1 43 ALA H . . 5.200 2.351 1.911 3.278 . 0 0 "[ . 1 . 2]" 1
1034 1 43 ALA HA 1 46 LYS QB . . 3.800 3.045 2.572 3.328 . 0 0 "[ . 1 . 2]" 1
1035 1 43 ALA MB 1 44 VAL QG . . 6.270 3.081 2.866 3.519 . 0 0 "[ . 1 . 2]" 1
1036 1 43 ALA MB 1 46 LYS QB . . 6.290 4.354 4.005 4.533 . 0 0 "[ . 1 . 2]" 1
1037 1 44 VAL H 1 44 VAL QG . . 4.170 2.009 1.836 2.229 . 0 0 "[ . 1 . 2]" 1
1038 1 44 VAL HA 1 47 TYR QB . . 5.190 2.610 2.346 3.025 . 0 0 "[ . 1 . 2]" 1
1039 1 44 VAL QG 1 45 THR HA . . 6.420 3.290 2.972 3.677 . 0 0 "[ . 1 . 2]" 1
1040 1 44 VAL QG 1 48 CYS H . . 6.390 3.940 3.529 4.655 . 0 0 "[ . 1 . 2]" 1
1041 1 44 VAL QG 1 48 CYS QB . . 6.190 3.737 2.977 4.751 . 0 0 "[ . 1 . 2]" 1
1042 1 45 THR HA 1 48 CYS QB . . 4.540 3.790 2.889 4.423 . 0 0 "[ . 1 . 2]" 1
1043 1 46 LYS QB 1 47 TYR H . . 3.430 2.572 2.288 2.803 . 0 0 "[ . 1 . 2]" 1
1044 1 47 TYR H 1 47 TYR QB . . 2.760 2.127 2.048 2.254 . 0 0 "[ . 1 . 2]" 1
1045 1 47 TYR QB 1 48 CYS H . . 2.960 2.219 1.990 2.418 . 0 0 "[ . 1 . 2]" 1
1046 1 48 CYS H 1 48 CYS QB . . 3.610 2.374 2.044 2.545 . 0 0 "[ . 1 . 2]" 1
1047 1 48 CYS QB 1 49 LYS H . . 3.570 3.137 2.611 3.549 . 0 0 "[ . 1 . 2]" 1
1048 1 48 CYS QB 1 52 LEU QD . . 6.190 3.800 2.543 4.232 . 0 0 "[ . 1 . 2]" 1
1049 1 49 LYS H 1 49 LYS QB . . 2.680 2.236 2.220 2.256 . 0 0 "[ . 1 . 2]" 1
1050 1 49 LYS H 1 49 LYS QG . . 4.440 3.989 3.927 4.032 . 0 0 "[ . 1 . 2]" 1
1051 1 49 LYS H 1 49 LYS QE . . 5.050 4.688 4.194 5.056 0.006 16 0 "[ . 1 . 2]" 1
1052 1 49 LYS H 1 57 LEU QD . . 6.390 4.141 3.375 5.051 . 0 0 "[ . 1 . 2]" 1
1053 1 49 LYS HA 1 49 LYS QD . . 4.470 3.658 3.306 4.080 . 0 0 "[ . 1 . 2]" 1
1054 1 49 LYS HA 1 57 LEU QD . . 6.420 3.303 2.013 4.643 . 0 0 "[ . 1 . 2]" 1
1055 1 49 LYS QB 1 50 GLU H . . 3.560 2.653 2.545 2.727 . 0 0 "[ . 1 . 2]" 1
1056 1 49 LYS QG 1 50 GLU H . . 5.340 3.900 3.498 4.300 . 0 0 "[ . 1 . 2]" 1
1057 1 49 LYS QD 1 50 GLU H . . 5.230 3.820 2.858 5.245 0.015 17 0 "[ . 1 . 2]" 1
1058 1 49 LYS QD 1 52 LEU QD . . 6.190 6.094 5.554 6.194 0.004 16 0 "[ . 1 . 2]" 1
1059 1 49 LYS QD 1 54 THR MG . . 5.980 5.401 4.950 5.781 . 0 0 "[ . 1 . 2]" 1
1060 1 49 LYS QD 1 55 GLU HA . . 5.340 3.258 1.930 5.121 . 0 0 "[ . 1 . 2]" 1
1061 1 50 GLU H 1 50 GLU QB . . 3.210 2.323 2.254 2.528 . 0 0 "[ . 1 . 2]" 1
1062 1 50 GLU HA 1 50 GLU QG . . 3.690 2.427 2.309 2.631 . 0 0 "[ . 1 . 2]" 1
1063 1 50 GLU QB 1 51 GLU H . . 3.080 2.866 2.709 2.981 . 0 0 "[ . 1 . 2]" 1
1064 1 50 GLU QG 1 51 GLU H . . 4.100 3.995 3.805 4.114 0.014 19 0 "[ . 1 . 2]" 1
1065 1 51 GLU H 1 51 GLU QB . . 2.640 2.144 2.078 2.268 . 0 0 "[ . 1 . 2]" 1
1066 1 51 GLU H 1 52 LEU QB . . 4.580 4.172 4.138 4.211 . 0 0 "[ . 1 . 2]" 1
1067 1 51 GLU QB 1 52 LEU H . . 3.260 2.782 2.687 2.851 . 0 0 "[ . 1 . 2]" 1
1068 1 51 GLU QB 1 53 GLY H . . 4.610 4.649 4.612 4.737 0.127 20 0 "[ . 1 . 2]" 1
1069 1 52 LEU H 1 52 LEU QB . . 2.800 2.137 2.052 2.242 . 0 0 "[ . 1 . 2]" 1
1070 1 52 LEU H 1 52 LEU QD . . 4.400 3.656 2.748 3.805 . 0 0 "[ . 1 . 2]" 1
1071 1 52 LEU QB 1 53 GLY H . . 3.510 2.829 2.750 2.892 . 0 0 "[ . 1 . 2]" 1
1072 1 52 LEU QB 1 54 THR H . . 3.380 2.439 2.247 2.593 . 0 0 "[ . 1 . 2]" 1
1073 1 52 LEU QD 1 53 GLY H . . 6.420 4.024 3.814 4.139 . 0 0 "[ . 1 . 2]" 1
1074 1 52 LEU QD 1 54 THR H . . 6.420 3.596 3.283 3.901 . 0 0 "[ . 1 . 2]" 1
1075 1 53 GLY QA 1 54 THR H . . 3.010 2.888 2.862 2.919 . 0 0 "[ . 1 . 2]" 1
1076 1 55 GLU H 1 55 GLU QB . . 2.770 2.425 2.240 2.755 . 0 0 "[ . 1 . 2]" 1
1077 1 55 GLU QB 1 56 THR H . . 3.670 3.661 3.556 3.889 0.219 14 0 "[ . 1 . 2]" 1
1078 1 55 GLU QG 1 56 THR H . . 5.340 4.224 2.918 4.609 . 0 0 "[ . 1 . 2]" 1
1079 1 57 LEU H 1 57 LEU QD . . 5.110 3.162 1.833 4.025 . 0 0 "[ . 1 . 2]" 1
1080 1 57 LEU QB 1 58 GLY H . . 3.830 2.616 2.032 3.164 . 0 0 "[ . 1 . 2]" 1
1081 1 57 LEU QD 1 58 GLY H . . 6.420 3.330 2.298 4.088 . 0 0 "[ . 1 . 2]" 1
1082 1 58 GLY QA 1 77 ASN QD . . 5.180 4.274 3.235 5.303 0.123 2 0 "[ . 1 . 2]" 1
1083 1 59 TYR H 1 59 TYR QB . . 3.600 2.318 2.196 2.393 . 0 0 "[ . 1 . 2]" 1
1084 1 59 TYR HA 1 60 CYS QB . . 5.340 4.409 4.021 4.665 . 0 0 "[ . 1 . 2]" 1
1085 1 59 TYR QB 1 60 CYS H . . 3.730 3.325 2.359 3.752 0.022 3 0 "[ . 1 . 2]" 1
1086 1 59 TYR QB 1 76 SER H . . 5.340 3.374 2.820 3.982 . 0 0 "[ . 1 . 2]" 1
1087 1 60 CYS H 1 60 CYS QB . . 3.620 2.900 2.380 3.369 . 0 0 "[ . 1 . 2]" 1
1088 1 60 CYS H 1 75 VAL QG . . 6.420 4.290 3.683 5.966 . 0 0 "[ . 1 . 2]" 1
1089 1 60 CYS HA 1 75 VAL QG . . 6.420 3.252 1.909 5.674 . 0 0 "[ . 1 . 2]" 1
1090 1 60 CYS QB 1 61 THR H . . 3.940 3.564 3.153 3.840 . 0 0 "[ . 1 . 2]" 1
1091 1 60 CYS QB 1 75 VAL QG . . 6.190 2.953 1.876 4.461 . 0 0 "[ . 1 . 2]" 1
1092 1 62 ASP H 1 62 ASP QB . . 3.700 2.335 2.233 2.497 . 0 0 "[ . 1 . 2]" 1
1093 1 62 ASP QB 1 63 PHE H . . 4.210 3.387 2.702 3.754 . 0 0 "[ . 1 . 2]" 1
1094 1 64 GLN H 1 73 CYS QB . . 4.400 2.691 2.282 3.407 . 0 0 "[ . 1 . 2]" 1
1095 1 64 GLN QB 1 65 ALA H . . 3.670 3.403 3.070 3.759 0.089 10 0 "[ . 1 . 2]" 1
1096 1 64 GLN QG 1 65 ALA H . . 5.340 4.140 2.365 4.620 . 0 0 "[ . 1 . 2]" 1
1097 1 64 GLN QG 1 72 GLY H . . 5.340 4.594 2.877 5.150 . 0 0 "[ . 1 . 2]" 1
1098 1 64 GLN QE 1 92 LEU QD . . 5.720 4.317 2.147 5.734 0.014 13 0 "[ . 1 . 2]" 1
1099 1 66 VAL QG 1 69 CYS H . . 6.420 2.923 2.325 3.921 . 0 0 "[ . 1 . 2]" 1
1100 1 66 VAL QG 1 70 GLY H . . 5.260 2.541 2.111 3.605 . 0 0 "[ . 1 . 2]" 1
1101 1 69 CYS H 1 69 CYS QB . . 3.680 2.832 2.677 3.289 . 0 0 "[ . 1 . 2]" 1
1102 1 69 CYS QB 1 70 GLY H . . 3.390 2.562 2.251 3.301 . 0 0 "[ . 1 . 2]" 1
1103 1 69 CYS QB 1 70 GLY QA . . 5.180 3.700 3.605 3.933 . 0 0 "[ . 1 . 2]" 1
1104 1 69 CYS QB 1 98 TRP H . . 5.340 3.313 2.767 3.787 . 0 0 "[ . 1 . 2]" 1
1105 1 70 GLY QA 1 94 GLY H . . 4.940 4.490 3.943 4.845 . 0 0 "[ . 1 . 2]" 1
1106 1 70 GLY QA 1 95 ASN H . . 4.530 3.906 3.539 4.209 . 0 0 "[ . 1 . 2]" 1
1107 1 70 GLY QA 1 98 TRP H . . 5.340 5.172 4.210 5.374 0.034 6 0 "[ . 1 . 2]" 1
1108 1 72 GLY H 1 92 LEU QD . . 5.850 4.876 3.796 5.924 0.074 17 0 "[ . 1 . 2]" 1
1109 1 72 GLY QA 1 91 VAL H . . 5.320 4.371 4.106 4.719 . 0 0 "[ . 1 . 2]" 1
1110 1 72 GLY QA 1 92 LEU QD . . 5.720 2.823 1.892 4.136 . 0 0 "[ . 1 . 2]" 1
1111 1 72 GLY QA 1 98 TRP HE1 . . 5.340 4.194 2.993 4.854 . 0 0 "[ . 1 . 2]" 1
1112 1 73 CYS H 1 91 VAL QG . . 5.530 3.479 2.386 4.249 . 0 0 "[ . 1 . 2]" 1
1113 1 73 CYS QB 1 74 LYS H . . 3.050 2.489 2.070 2.751 . 0 0 "[ . 1 . 2]" 1
1114 1 74 LYS H 1 74 LYS QB . . 3.360 2.715 2.479 3.106 . 0 0 "[ . 1 . 2]" 1
1115 1 74 LYS H 1 74 LYS QG . . 4.530 2.550 1.965 2.943 . 0 0 "[ . 1 . 2]" 1
1116 1 74 LYS H 1 74 LYS QD . . 5.230 4.106 3.018 4.739 . 0 0 "[ . 1 . 2]" 1
1117 1 74 LYS HA 1 75 VAL QG . . 6.420 3.391 3.137 3.661 . 0 0 "[ . 1 . 2]" 1
1118 1 74 LYS QB 1 74 LYS QE . . 4.170 3.187 2.664 3.618 . 0 0 "[ . 1 . 2]" 1
1119 1 74 LYS QB 1 75 VAL H . . 3.380 3.111 2.813 3.333 . 0 0 "[ . 1 . 2]" 1
1120 1 74 LYS QB 1 75 VAL QG . . 5.720 4.065 3.847 4.443 . 0 0 "[ . 1 . 2]" 1
1121 1 74 LYS QB 1 91 VAL H . . 5.140 4.407 3.191 4.908 . 0 0 "[ . 1 . 2]" 1
1122 1 74 LYS QG 1 75 VAL H . . 5.340 4.212 3.887 4.409 . 0 0 "[ . 1 . 2]" 1
1123 1 74 LYS QG 1 91 VAL H . . 5.340 3.858 2.979 5.365 0.025 19 0 "[ . 1 . 2]" 1
1124 1 75 VAL QG 1 76 SER HA . . 6.420 3.633 3.179 4.218 . 0 0 "[ . 1 . 2]" 1
1125 1 75 VAL QG 1 76 SER QB . . 6.190 4.114 3.807 4.770 . 0 0 "[ . 1 . 2]" 1
1126 1 75 VAL QG 1 89 PHE QB . . 5.720 3.565 3.142 4.661 . 0 0 "[ . 1 . 2]" 1
1127 1 76 SER H 1 76 SER QB . . 3.660 3.158 2.788 3.415 . 0 0 "[ . 1 . 2]" 1
1128 1 76 SER QB 1 77 ASN H . . 3.660 3.338 3.179 3.769 0.109 3 0 "[ . 1 . 2]" 1
1129 1 76 SER QB 1 89 PHE H . . 5.340 2.075 1.894 2.926 . 0 0 "[ . 1 . 2]" 1
1130 1 78 VAL QG 1 81 ILE QG . . 6.190 4.865 3.621 6.193 0.003 20 0 "[ . 1 . 2]" 1
1131 1 79 GLU HA 1 82 LEU QD . . 6.420 4.681 4.077 5.123 . 0 0 "[ . 1 . 2]" 1
1132 1 79 GLU QB 1 84 ALA H . . 5.340 4.921 3.188 5.365 0.025 8 0 "[ . 1 . 2]" 1
1133 1 79 GLU QB 1 85 VAL H . . 5.340 5.384 4.298 5.630 0.290 14 0 "[ . 1 . 2]" 1
1134 1 79 GLU QG 1 80 GLY H . . 4.150 2.523 1.913 4.103 . 0 0 "[ . 1 . 2]" 1
1135 1 80 GLY QA 1 81 ILE H . . 2.970 2.817 2.650 2.900 . 0 0 "[ . 1 . 2]" 1
1136 1 80 GLY QA 1 83 ALA H . . 4.120 4.089 3.520 4.273 0.153 20 0 "[ . 1 . 2]" 1
1137 1 81 ILE H 1 81 ILE QG . . 4.030 3.172 2.146 4.038 0.008 20 0 "[ . 1 . 2]" 1
1138 1 82 LEU H 1 82 LEU QB . . 3.140 2.150 2.023 2.318 . 0 0 "[ . 1 . 2]" 1
1139 1 82 LEU QB 1 83 ALA H . . 3.290 2.605 2.387 2.789 . 0 0 "[ . 1 . 2]" 1
1140 1 82 LEU QB 1 84 ALA H . . 4.120 2.436 2.092 3.037 . 0 0 "[ . 1 . 2]" 1
1141 1 82 LEU QD 1 83 ALA H . . 5.020 3.870 3.479 4.105 . 0 0 "[ . 1 . 2]" 1
1142 1 84 ALA MB 1 85 VAL QG . . 7.390 2.642 2.332 3.155 . 0 0 "[ . 1 . 2]" 1
1143 1 85 VAL HA 1 86 PRO QG . . 5.110 3.878 3.835 3.955 . 0 0 "[ . 1 . 2]" 1
1144 1 85 VAL QG 1 86 PRO QD . . 6.190 3.227 3.073 3.383 . 0 0 "[ . 1 . 2]" 1
1145 1 86 PRO QG 1 87 GLN H . . 4.660 4.583 4.032 4.638 . 0 0 "[ . 1 . 2]" 1
1146 1 87 GLN H 1 87 GLN QB . . 3.300 2.675 2.626 3.056 . 0 0 "[ . 1 . 2]" 1
1147 1 87 GLN QB 1 88 THR H . . 3.770 3.810 2.613 3.977 0.207 9 0 "[ . 1 . 2]" 1
1148 1 87 GLN QG 1 88 THR H . . 4.210 3.890 3.508 4.293 0.083 18 0 "[ . 1 . 2]" 1
1149 1 87 GLN QE 1 89 PHE HE1 . . 4.650 2.637 1.949 4.631 . 0 0 "[ . 1 . 2]" 1
1150 1 89 PHE H 1 89 PHE QB . . 3.600 2.327 2.064 2.531 . 0 0 "[ . 1 . 2]" 1
1151 1 89 PHE QB 1 90 SER H . . 3.630 3.555 3.417 3.705 0.075 6 0 "[ . 1 . 2]" 1
1152 1 90 SER H 1 90 SER QB . . 3.300 2.381 2.064 2.879 . 0 0 "[ . 1 . 2]" 1
1153 1 90 SER QB 1 91 VAL H . . 3.590 3.232 2.971 3.555 . 0 0 "[ . 1 . 2]" 1
1154 1 90 SER QB 1 130 ASP H . . 5.000 2.804 1.929 4.363 . 0 0 "[ . 1 . 2]" 1
1155 1 90 SER QB 1 131 GLY H . . 5.340 3.479 2.395 5.179 . 0 0 "[ . 1 . 2]" 1
1156 1 91 VAL QG 1 92 LEU H . . 5.610 2.841 2.453 3.099 . 0 0 "[ . 1 . 2]" 1
1157 1 91 VAL QG 1 93 ILE HB . . 5.580 4.573 3.226 5.541 . 0 0 "[ . 1 . 2]" 1
1158 1 92 LEU H 1 92 LEU QB . . 3.410 2.764 2.432 3.233 . 0 0 "[ . 1 . 2]" 1
1159 1 92 LEU QB 1 128 ALA MB . . 5.190 3.289 2.002 4.503 . 0 0 "[ . 1 . 2]" 1
1160 1 92 LEU QD 1 93 ILE H . . 4.290 3.737 2.826 4.238 . 0 0 "[ . 1 . 2]" 1
1161 1 92 LEU QD 1 98 TRP HE1 . . 5.100 2.091 1.843 3.682 . 0 0 "[ . 1 . 2]" 1
1162 1 92 LEU QD 1 102 ASN H . . 6.040 5.595 4.325 6.076 0.036 19 0 "[ . 1 . 2]" 1
1163 1 92 LEU QD 1 102 ASN QD . . 6.180 3.656 2.236 5.055 . 0 0 "[ . 1 . 2]" 1
1164 1 92 LEU QD 1 131 GLY H . . 6.420 3.271 2.673 4.033 . 0 0 "[ . 1 . 2]" 1
1165 1 93 ILE HA 1 127 VAL QG . . 6.420 3.217 2.742 3.757 . 0 0 "[ . 1 . 2]" 1
1166 1 94 GLY H 1 126 LEU QD . . 6.420 3.505 2.323 4.172 . 0 0 "[ . 1 . 2]" 1
1167 1 94 GLY QA 1 98 TRP H . . 4.480 3.875 3.722 4.000 . 0 0 "[ . 1 . 2]" 1
1168 1 95 ASN H 1 98 TRP QB . . 4.530 3.190 2.525 3.670 . 0 0 "[ . 1 . 2]" 1
1169 1 95 ASN QD 1 97 GLU QB . . 5.180 2.293 1.895 3.115 . 0 0 "[ . 1 . 2]" 1
1170 1 96 ARG H 1 96 ARG QB . . 3.070 2.240 2.045 2.665 . 0 0 "[ . 1 . 2]" 1
1171 1 96 ARG H 1 96 ARG QG . . 4.330 3.429 1.958 4.051 . 0 0 "[ . 1 . 2]" 1
1172 1 96 ARG H 1 96 ARG QD . . 4.500 3.479 1.839 4.491 . 0 0 "[ . 1 . 2]" 1
1173 1 96 ARG H 1 114 MET QB . . 5.340 4.887 4.196 5.403 0.063 1 0 "[ . 1 . 2]" 1
1174 1 96 ARG HA 1 126 LEU QD . . 5.410 2.767 2.206 3.691 . 0 0 "[ . 1 . 2]" 1
1175 1 96 ARG QB 1 96 ARG QD . . 3.270 2.179 1.930 2.543 . 0 0 "[ . 1 . 2]" 1
1176 1 96 ARG QB 1 97 GLU H . . 3.090 2.696 2.475 2.871 . 0 0 "[ . 1 . 2]" 1
1177 1 96 ARG QB 1 115 THR MG . . 6.290 5.712 3.679 6.534 0.244 11 0 "[ . 1 . 2]" 1
1178 1 96 ARG QB 1 126 LEU QD . . 4.880 3.949 3.278 4.927 0.047 15 0 "[ . 1 . 2]" 1
1179 1 96 ARG QG 1 97 GLU H . . 4.360 4.211 3.724 4.470 0.110 17 0 "[ . 1 . 2]" 1
1180 1 97 GLU QG 1 98 TRP H . . 5.340 3.766 2.918 4.446 . 0 0 "[ . 1 . 2]" 1
1181 1 98 TRP H 1 98 TRP QB . . 2.900 2.218 2.117 2.253 . 0 0 "[ . 1 . 2]" 1
1182 1 98 TRP H 1 99 LEU QD . . 6.300 5.408 4.660 5.631 . 0 0 "[ . 1 . 2]" 1
1183 1 98 TRP HA 1 102 ASN QD . . 5.340 3.647 3.037 4.046 . 0 0 "[ . 1 . 2]" 1
1184 1 98 TRP QB 1 99 LEU H . . 3.400 2.465 2.363 2.628 . 0 0 "[ . 1 . 2]" 1
1185 1 98 TRP QB 1 99 LEU QD . . 6.190 4.540 3.279 4.934 . 0 0 "[ . 1 . 2]" 1
1186 1 98 TRP QB 1 100 ARG H . . 4.940 4.679 4.493 4.903 . 0 0 "[ . 1 . 2]" 1
1187 1 98 TRP HD1 1 99 LEU QD . . 6.420 5.559 3.955 6.512 0.092 8 0 "[ . 1 . 2]" 1
1188 1 98 TRP HZ2 1 102 ASN QD . . 5.340 3.656 3.107 5.337 . 0 0 "[ . 1 . 2]" 1
1189 1 99 LEU H 1 99 LEU QB . . 2.840 2.146 2.023 2.229 . 0 0 "[ . 1 . 2]" 1
1190 1 99 LEU H 1 99 LEU QD . . 4.710 3.506 2.716 3.736 . 0 0 "[ . 1 . 2]" 1
1191 1 99 LEU HA 1 102 ASN QB . . 5.170 3.928 3.517 5.143 . 0 0 "[ . 1 . 2]" 1
1192 1 99 LEU HA 1 102 ASN QD . . 5.340 5.037 3.358 5.361 0.021 20 0 "[ . 1 . 2]" 1
1193 1 99 LEU HA 1 126 LEU QD . . 6.420 3.691 2.814 4.716 . 0 0 "[ . 1 . 2]" 1
1194 1 99 LEU QB 1 126 LEU QD . . 6.070 2.042 1.786 2.926 . 0 0 "[ . 1 . 2]" 1
1195 1 99 LEU QD 1 100 ARG H . . 4.620 3.608 3.051 4.160 . 0 0 "[ . 1 . 2]" 1
1196 1 99 LEU QD 1 102 ASN H . . 6.420 4.597 4.196 5.262 . 0 0 "[ . 1 . 2]" 1
1197 1 99 LEU QD 1 102 ASN QD . . 5.930 5.568 4.012 6.029 0.099 1 0 "[ . 1 . 2]" 1
1198 1 100 ARG H 1 100 ARG QG . . 4.730 3.971 3.190 4.094 . 0 0 "[ . 1 . 2]" 1
1199 1 100 ARG QB 1 101 ARG H . . 3.020 2.816 2.698 2.994 . 0 0 "[ . 1 . 2]" 1
1200 1 100 ARG QG 1 103 GLY QA . . 5.180 5.036 4.582 5.279 0.099 9 0 "[ . 1 . 2]" 1
1201 1 100 ARG QD 1 101 ARG H . . 5.340 3.877 2.800 5.047 . 0 0 "[ . 1 . 2]" 1
1202 1 100 ARG QD 1 102 ASN H . . 5.340 5.221 4.697 5.449 0.109 12 0 "[ . 1 . 2]" 1
1203 1 101 ARG H 1 101 ARG QG . . 4.230 3.764 3.180 4.033 . 0 0 "[ . 1 . 2]" 1
1204 1 101 ARG H 1 102 ASN QD . . 5.340 4.362 3.931 5.284 . 0 0 "[ . 1 . 2]" 1
1205 1 101 ARG QB 1 102 ASN H . . 3.730 2.883 2.571 3.050 . 0 0 "[ . 1 . 2]" 1
1206 1 101 ARG QG 1 102 ASN H . . 5.340 4.224 3.626 4.607 . 0 0 "[ . 1 . 2]" 1
1207 1 101 ARG QG 1 102 ASN QD . . 5.180 3.577 1.888 4.731 . 0 0 "[ . 1 . 2]" 1
1208 1 101 ARG QD 1 102 ASN H . . 5.110 4.300 3.409 5.106 . 0 0 "[ . 1 . 2]" 1
1209 1 101 ARG QD 1 102 ASN QD . . 3.330 2.924 1.951 3.418 0.088 1 0 "[ . 1 . 2]" 1
1210 1 102 ASN H 1 102 ASN QB . . 3.180 2.506 2.298 2.980 . 0 0 "[ . 1 . 2]" 1
1211 1 102 ASN H 1 102 ASN QD . . 4.500 2.941 2.440 3.801 . 0 0 "[ . 1 . 2]" 1
1212 1 102 ASN H 1 103 GLY QA . . 4.020 3.960 3.889 4.003 . 0 0 "[ . 1 . 2]" 1
1213 1 102 ASN QB 1 103 GLY H . . 3.600 3.159 3.035 3.638 0.038 11 0 "[ . 1 . 2]" 1
1214 1 102 ASN QB 1 104 LEU H . . 5.230 5.016 4.798 5.233 0.003 11 0 "[ . 1 . 2]" 1
1215 1 102 ASN QD 1 103 GLY H . . 5.340 4.465 4.024 5.137 . 0 0 "[ . 1 . 2]" 1
1216 1 103 GLY H 1 104 LEU QD . . 6.420 4.959 4.134 5.641 . 0 0 "[ . 1 . 2]" 1
1217 1 103 GLY QA 1 104 LEU QD . . 6.190 4.059 2.781 5.077 . 0 0 "[ . 1 . 2]" 1
1218 1 104 LEU H 1 104 LEU QD . . 4.970 3.490 2.403 4.093 . 0 0 "[ . 1 . 2]" 1
1219 1 104 LEU QD 1 105 THR H . . 5.250 2.844 1.890 4.332 . 0 0 "[ . 1 . 2]" 1
1220 1 106 ILE MG 1 111 SER QB . . 6.290 4.470 1.929 6.150 . 0 0 "[ . 1 . 2]" 1
1221 1 106 ILE QG 1 107 SER H . . 4.730 2.189 2.064 2.373 . 0 0 "[ . 1 . 2]" 1
1222 1 107 SER QB 1 108 SER H . . 3.940 3.390 2.461 3.893 . 0 0 "[ . 1 . 2]" 1
1223 1 108 SER H 1 108 SER QB . . 2.860 2.417 2.140 2.767 . 0 0 "[ . 1 . 2]" 1
1224 1 108 SER QB 1 109 ASP H . . 2.990 2.881 2.693 3.008 0.018 2 0 "[ . 1 . 2]" 1
1225 1 109 ASP QB 1 110 VAL H . . 3.460 2.435 2.174 2.665 . 0 0 "[ . 1 . 2]" 1
1226 1 109 ASP QB 1 111 SER H . . 5.110 4.661 4.500 4.801 . 0 0 "[ . 1 . 2]" 1
1227 1 109 ASP QB 1 112 ASP H . . 5.230 5.049 4.960 5.202 . 0 0 "[ . 1 . 2]" 1
1228 1 110 VAL H 1 111 SER QB . . 4.390 4.400 4.370 4.422 0.032 8 0 "[ . 1 . 2]" 1
1229 1 110 VAL QG 1 111 SER H . . 4.480 3.198 3.168 3.217 . 0 0 "[ . 1 . 2]" 1
1230 1 110 VAL QG 1 113 ALA H . . 5.560 4.491 4.430 4.554 . 0 0 "[ . 1 . 2]" 1
1231 1 110 VAL QG 1 114 MET H . . 6.420 3.881 3.796 3.980 . 0 0 "[ . 1 . 2]" 1
1232 1 111 SER H 1 111 SER QB . . 2.700 2.120 2.079 2.228 . 0 0 "[ . 1 . 2]" 1
1233 1 111 SER H 1 112 ASP QB . . 5.190 4.393 4.366 4.423 . 0 0 "[ . 1 . 2]" 1
1234 1 111 SER QB 1 112 ASP H . . 2.970 2.678 2.450 2.878 . 0 0 "[ . 1 . 2]" 1
1235 1 112 ASP QB 1 113 ALA H . . 3.370 2.492 2.372 2.592 . 0 0 "[ . 1 . 2]" 1
1236 1 113 ALA H 1 116 ASP QB . . 4.120 4.210 4.166 4.265 0.145 4 0 "[ . 1 . 2]" 1
1237 1 113 ALA HA 1 116 ASP QB . . 3.400 2.075 1.946 2.230 . 0 0 "[ . 1 . 2]" 1
1238 1 114 MET H 1 114 MET QB . . 2.990 2.220 2.075 2.383 . 0 0 "[ . 1 . 2]" 1
1239 1 114 MET H 1 114 MET QG . . 4.060 3.423 2.345 4.051 . 0 0 "[ . 1 . 2]" 1
1240 1 114 MET QB 1 115 THR H . . 3.000 2.385 2.265 2.562 . 0 0 "[ . 1 . 2]" 1
1241 1 114 MET QB 1 116 ASP H . . 4.680 4.404 4.330 4.477 . 0 0 "[ . 1 . 2]" 1
1242 1 114 MET QG 1 115 THR H . . 5.340 4.043 3.101 4.416 . 0 0 "[ . 1 . 2]" 1
1243 1 114 MET QG 1 124 ALA MB . . 6.290 4.348 2.856 5.691 . 0 0 "[ . 1 . 2]" 1
1244 1 115 THR H 1 116 ASP QB . . 4.220 4.227 4.182 4.288 0.068 7 0 "[ . 1 . 2]" 1
1245 1 115 THR HA 1 118 GLU QB . . 3.700 2.049 1.929 2.343 . 0 0 "[ . 1 . 2]" 1
1246 1 115 THR MG 1 119 MET QG . . 6.290 5.679 4.841 6.272 . 0 0 "[ . 1 . 2]" 1
1247 1 116 ASP H 1 116 ASP QB . . 2.850 2.132 2.053 2.196 . 0 0 "[ . 1 . 2]" 1
1248 1 116 ASP H 1 118 GLU QB . . 5.000 4.546 4.363 4.683 . 0 0 "[ . 1 . 2]" 1
1249 1 116 ASP QB 1 117 HIS H . . 3.560 2.742 2.586 2.940 . 0 0 "[ . 1 . 2]" 1
1250 1 116 ASP QB 1 118 GLU H . . 5.340 4.615 4.454 4.793 . 0 0 "[ . 1 . 2]" 1
1251 1 117 HIS HA 1 120 LYS QB . . 4.880 3.452 2.912 3.984 . 0 0 "[ . 1 . 2]" 1
1252 1 117 HIS HA 1 120 LYS QG . . 5.340 5.013 4.706 5.340 0.000 14 0 "[ . 1 . 2]" 1
1253 1 117 HIS QB 1 120 LYS QE . . 5.180 4.853 3.219 5.189 0.009 8 0 "[ . 1 . 2]" 1
1254 1 117 HIS QB 1 124 ALA MB . . 6.290 5.359 3.970 6.317 0.027 13 0 "[ . 1 . 2]" 1
1255 1 118 GLU H 1 118 GLU QB . . 3.350 2.153 2.062 2.248 . 0 0 "[ . 1 . 2]" 1
1256 1 118 GLU H 1 118 GLU QG . . 4.420 3.119 2.716 3.983 . 0 0 "[ . 1 . 2]" 1
1257 1 118 GLU HA 1 121 GLY QA . . 5.340 4.716 4.157 5.204 . 0 0 "[ . 1 . 2]" 1
1258 1 118 GLU QG 1 122 GLN H . . 5.340 4.652 3.898 5.266 . 0 0 "[ . 1 . 2]" 1
1259 1 118 GLU QG 1 122 GLN QE . . 5.180 5.024 4.165 5.228 0.048 18 0 "[ . 1 . 2]" 1
1260 1 118 GLU QG 1 124 ALA H . . 4.820 3.551 2.534 4.828 0.008 17 0 "[ . 1 . 2]" 1
1261 1 119 MET H 1 119 MET QB . . 2.810 2.235 2.166 2.254 . 0 0 "[ . 1 . 2]" 1
1262 1 119 MET QB 1 120 LYS H . . 3.560 3.166 3.086 3.212 . 0 0 "[ . 1 . 2]" 1
1263 1 119 MET QB 1 121 GLY H . . 5.080 4.657 4.613 4.690 . 0 0 "[ . 1 . 2]" 1
1264 1 119 MET QG 1 120 LYS QG . . 5.180 5.012 4.529 5.184 0.004 2 0 "[ . 1 . 2]" 1
1265 1 120 LYS H 1 120 LYS QG . . 4.060 3.782 3.509 4.050 . 0 0 "[ . 1 . 2]" 1
1266 1 120 LYS H 1 120 LYS QD . . 4.530 3.571 2.981 4.545 0.015 9 0 "[ . 1 . 2]" 1
1267 1 120 LYS H 1 120 LYS QE . . 5.340 4.282 3.176 5.318 . 0 0 "[ . 1 . 2]" 1
1268 1 120 LYS H 1 121 GLY QA . . 4.300 4.341 4.222 4.436 0.136 19 0 "[ . 1 . 2]" 1
1269 1 120 LYS QB 1 120 LYS QD . . 3.320 2.016 1.938 2.199 . 0 0 "[ . 1 . 2]" 1
1270 1 120 LYS QB 1 121 GLY H . . 3.710 3.366 3.293 3.474 . 0 0 "[ . 1 . 2]" 1
1271 1 120 LYS QG 1 121 GLY H . . 5.340 4.692 4.536 4.790 . 0 0 "[ . 1 . 2]" 1
1272 1 120 LYS QG 1 121 GLY QA . . 5.180 5.081 4.483 5.223 0.043 17 0 "[ . 1 . 2]" 1
1273 1 120 LYS QD 1 121 GLY H . . 5.340 5.189 4.400 5.373 0.033 14 0 "[ . 1 . 2]" 1
1274 1 121 GLY H 1 122 GLN QB . . 5.080 4.165 3.813 4.571 . 0 0 "[ . 1 . 2]" 1
1275 1 121 GLY QA 1 122 GLN H . . 2.970 2.885 2.821 2.918 . 0 0 "[ . 1 . 2]" 1
1276 1 122 GLN H 1 122 GLN QB . . 2.930 2.246 2.045 2.644 . 0 0 "[ . 1 . 2]" 1
1277 1 122 GLN H 1 122 GLN QG . . 3.730 2.940 1.937 3.616 . 0 0 "[ . 1 . 2]" 1
1278 1 122 GLN HA 1 122 GLN QE . . 5.340 4.089 2.508 4.854 . 0 0 "[ . 1 . 2]" 1
1279 1 122 GLN QB 1 123 THR H . . 3.210 2.890 2.121 3.227 0.017 11 0 "[ . 1 . 2]" 1
1280 1 122 GLN QB 1 139 ILE H . . 5.340 4.965 4.197 5.361 0.021 19 0 "[ . 1 . 2]" 1
1281 1 122 GLN QB 1 140 ALA MB . . 6.290 4.141 3.392 4.723 . 0 0 "[ . 1 . 2]" 1
1282 1 122 GLN QB 1 141 ASP H . . 5.340 4.959 4.398 5.335 . 0 0 "[ . 1 . 2]" 1
1283 1 122 GLN QG 1 123 THR H . . 5.340 3.504 2.565 4.546 . 0 0 "[ . 1 . 2]" 1
1284 1 122 GLN QG 1 140 ALA MB . . 6.290 2.608 1.950 4.398 . 0 0 "[ . 1 . 2]" 1
1285 1 126 LEU H 1 126 LEU QD . . 4.670 2.369 1.706 2.743 . 0 0 "[ . 1 . 2]" 1
1286 1 126 LEU H 1 136 MET QB . . 5.340 4.996 4.646 5.405 0.065 9 0 "[ . 1 . 2]" 1
1287 1 126 LEU QB 1 127 VAL H . . 3.540 2.830 2.312 3.175 . 0 0 "[ . 1 . 2]" 1
1288 1 126 LEU QB 1 135 GLY H . . 5.340 4.564 3.857 5.260 . 0 0 "[ . 1 . 2]" 1
1289 1 126 LEU HG 1 136 MET QG . . 5.340 4.318 2.439 5.493 0.153 15 0 "[ . 1 . 2]" 1
1290 1 126 LEU QD 1 127 VAL H . . 4.470 3.999 3.286 4.388 . 0 0 "[ . 1 . 2]" 1
1291 1 126 LEU QD 1 136 MET HA . . 6.420 3.570 3.236 3.798 . 0 0 "[ . 1 . 2]" 1
1292 1 127 VAL H 1 135 GLY QA . . 5.340 4.036 3.868 4.210 . 0 0 "[ . 1 . 2]" 1
1293 1 127 VAL H 1 136 MET QB . . 5.340 4.143 3.775 4.910 . 0 0 "[ . 1 . 2]" 1
1294 1 127 VAL QG 1 134 CYS H . . 5.850 3.711 3.014 4.415 . 0 0 "[ . 1 . 2]" 1
1295 1 127 VAL QG 1 135 GLY H . . 4.600 3.234 1.990 4.155 . 0 0 "[ . 1 . 2]" 1
1296 1 127 VAL QG 1 135 GLY QA . . 6.190 3.590 2.517 4.392 . 0 0 "[ . 1 . 2]" 1
1297 1 128 ALA HA 1 133 LEU QD . . 6.420 3.960 2.897 4.698 . 0 0 "[ . 1 . 2]" 1
1298 1 128 ALA MB 1 133 LEU QB . . 6.290 3.378 3.007 4.040 . 0 0 "[ . 1 . 2]" 1
1299 1 129 ILE QG 1 134 CYS QB . . 5.180 2.520 1.868 4.740 . 0 0 "[ . 1 . 2]" 1
1300 1 130 ASP H 1 131 GLY QA . . 5.290 4.618 4.537 4.696 . 0 0 "[ . 1 . 2]" 1
1301 1 130 ASP QB 1 132 VAL H . . 5.340 3.890 3.794 4.623 . 0 0 "[ . 1 . 2]" 1
1302 1 132 VAL HA 1 133 LEU QB . . 5.340 4.104 3.995 4.255 . 0 0 "[ . 1 . 2]" 1
1303 1 132 VAL QG 1 133 LEU H . . 6.420 2.792 2.665 2.988 . 0 0 "[ . 1 . 2]" 1
1304 1 132 VAL QG 1 133 LEU QB . . 4.610 3.828 3.515 4.142 . 0 0 "[ . 1 . 2]" 1
1305 1 132 VAL QG 1 134 CYS QB . . 5.720 4.553 4.241 4.703 . 0 0 "[ . 1 . 2]" 1
1306 1 133 LEU H 1 133 LEU QB . . 3.130 2.134 2.029 2.266 . 0 0 "[ . 1 . 2]" 1
1307 1 133 LEU QB 1 134 CYS H . . 3.740 3.507 3.191 3.773 0.033 1 0 "[ . 1 . 2]" 1
1308 1 133 LEU HG 1 134 CYS QB . . 5.340 5.300 4.940 5.407 0.067 15 0 "[ . 1 . 2]" 1
1309 1 133 LEU QD 1 134 CYS H . . 5.850 3.752 2.891 4.181 . 0 0 "[ . 1 . 2]" 1
1310 1 134 CYS H 1 135 GLY QA . . 5.340 4.287 4.104 4.561 . 0 0 "[ . 1 . 2]" 1
1311 1 134 CYS QB 1 135 GLY H . . 4.210 2.784 2.544 3.585 . 0 0 "[ . 1 . 2]" 1
1312 1 135 GLY QA 1 136 MET H . . 3.060 2.244 2.153 2.283 . 0 0 "[ . 1 . 2]" 1
1313 1 136 MET H 1 136 MET QB . . 3.390 2.946 2.580 3.215 . 0 0 "[ . 1 . 2]" 1
1314 1 136 MET QB 1 137 ILE H . . 3.640 3.201 2.948 3.674 0.034 20 0 "[ . 1 . 2]" 1
1315 1 136 MET QG 1 137 ILE H . . 5.340 3.821 2.347 4.487 . 0 0 "[ . 1 . 2]" 1
1316 1 139 ILE MG 1 141 ASP QB . . 6.290 4.885 2.311 6.284 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 146
_Distance_constraint_stats_list.Viol_count 1137
_Distance_constraint_stats_list.Viol_total 1107.014
_Distance_constraint_stats_list.Viol_max 0.349
_Distance_constraint_stats_list.Viol_rms 0.0380
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0190
_Distance_constraint_stats_list.Viol_average_violations_only 0.0487
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 ARG 0.094 0.017 1 0 "[ . 1 . 2]"
1 10 ARG 0.406 0.095 5 0 "[ . 1 . 2]"
1 12 LEU 0.403 0.056 7 0 "[ . 1 . 2]"
1 14 LEU 0.190 0.032 7 0 "[ . 1 . 2]"
1 15 GLY 1.536 0.196 15 0 "[ . 1 . 2]"
1 17 VAL 0.076 0.044 8 0 "[ . 1 . 2]"
1 20 LEU 0.076 0.044 8 0 "[ . 1 . 2]"
1 21 PRO 0.163 0.063 8 0 "[ . 1 . 2]"
1 22 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ARG 0.725 0.052 15 0 "[ . 1 . 2]"
1 24 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 VAL 0.416 0.063 8 0 "[ . 1 . 2]"
1 26 LEU 0.185 0.040 4 0 "[ . 1 . 2]"
1 27 ALA 2.185 0.121 3 0 "[ . 1 . 2]"
1 28 VAL 0.019 0.019 9 0 "[ . 1 . 2]"
1 29 VAL 0.571 0.036 13 0 "[ . 1 . 2]"
1 30 GLY 0.468 0.049 7 0 "[ . 1 . 2]"
1 31 THR 2.135 0.121 3 0 "[ . 1 . 2]"
1 32 ALA 0.019 0.019 9 0 "[ . 1 . 2]"
1 33 ALA 0.356 0.035 8 0 "[ . 1 . 2]"
1 34 ALA 0.283 0.049 7 0 "[ . 1 . 2]"
1 36 SER 0.038 0.014 2 0 "[ . 1 . 2]"
1 38 HIS 5.474 0.349 8 0 "[ . 1 . 2]"
1 40 LEU 0.448 0.045 14 0 "[ . 1 . 2]"
1 41 GLY 5.474 0.349 8 0 "[ . 1 . 2]"
1 42 VAL 0.516 0.058 20 0 "[ . 1 . 2]"
1 43 ALA 0.217 0.030 2 0 "[ . 1 . 2]"
1 44 VAL 0.615 0.045 14 0 "[ . 1 . 2]"
1 45 THR 0.149 0.051 14 0 "[ . 1 . 2]"
1 46 LYS 0.942 0.064 20 0 "[ . 1 . 2]"
1 47 TYR 0.736 0.101 20 0 "[ . 1 . 2]"
1 48 CYS 0.215 0.022 8 0 "[ . 1 . 2]"
1 49 LYS 0.698 0.113 20 0 "[ . 1 . 2]"
1 50 GLU 0.426 0.064 20 0 "[ . 1 . 2]"
1 51 GLU 0.519 0.101 20 0 "[ . 1 . 2]"
1 52 LEU 0.048 0.010 12 0 "[ . 1 . 2]"
1 53 GLY 0.549 0.113 20 0 "[ . 1 . 2]"
1 54 THR 1.778 0.200 20 0 "[ . 1 . 2]"
1 56 THR 1.778 0.200 20 0 "[ . 1 . 2]"
1 59 TYR 1.578 0.203 3 0 "[ . 1 . 2]"
1 62 ASP 4.066 0.254 7 0 "[ . 1 . 2]"
1 64 GLN 1.310 0.079 6 0 "[ . 1 . 2]"
1 66 VAL 1.699 0.223 8 0 "[ . 1 . 2]"
1 70 GLY 1.699 0.223 8 0 "[ . 1 . 2]"
1 71 ILE 1.010 0.119 10 0 "[ . 1 . 2]"
1 72 GLY 1.310 0.079 6 0 "[ . 1 . 2]"
1 73 CYS 1.224 0.130 19 0 "[ . 1 . 2]"
1 74 LYS 4.066 0.254 7 0 "[ . 1 . 2]"
1 75 VAL 3.360 0.212 17 0 "[ . 1 . 2]"
1 76 SER 1.578 0.203 3 0 "[ . 1 . 2]"
1 77 ASN 2.003 0.217 14 0 "[ . 1 . 2]"
1 78 VAL 0.599 0.106 7 0 "[ . 1 . 2]"
1 79 GLU 1.301 0.129 14 0 "[ . 1 . 2]"
1 81 ILE 1.327 0.217 14 0 "[ . 1 . 2]"
1 82 LEU 0.599 0.106 7 0 "[ . 1 . 2]"
1 83 ALA 1.301 0.129 14 0 "[ . 1 . 2]"
1 89 PHE 3.360 0.212 17 0 "[ . 1 . 2]"
1 91 VAL 1.224 0.130 19 0 "[ . 1 . 2]"
1 92 LEU 0.298 0.049 16 0 "[ . 1 . 2]"
1 93 ILE 1.010 0.119 10 0 "[ . 1 . 2]"
1 94 GLY 1.091 0.090 5 0 "[ . 1 . 2]"
1 95 ASN 0.754 0.103 20 0 "[ . 1 . 2]"
1 96 ARG 0.285 0.093 6 0 "[ . 1 . 2]"
1 97 GLU 0.038 0.036 7 0 "[ . 1 . 2]"
1 98 TRP 1.924 0.154 1 0 "[ . 1 . 2]"
1 99 LEU 2.649 0.153 8 0 "[ . 1 . 2]"
1 100 ARG 2.132 0.227 9 0 "[ . 1 . 2]"
1 101 ARG 0.038 0.036 7 0 "[ . 1 . 2]"
1 102 ASN 1.924 0.154 1 0 "[ . 1 . 2]"
1 103 GLY 1.894 0.153 8 0 "[ . 1 . 2]"
1 104 LEU 1.847 0.227 9 0 "[ . 1 . 2]"
1 107 SER 0.839 0.069 17 0 "[ . 1 . 2]"
1 108 SER 0.874 0.093 12 0 "[ . 1 . 2]"
1 109 ASP 0.850 0.066 2 0 "[ . 1 . 2]"
1 110 VAL 0.367 0.047 7 0 "[ . 1 . 2]"
1 111 SER 2.895 0.100 17 0 "[ . 1 . 2]"
1 112 ASP 1.290 0.095 20 0 "[ . 1 . 2]"
1 113 ALA 2.296 0.148 20 0 "[ . 1 . 2]"
1 114 MET 1.551 0.121 13 0 "[ . 1 . 2]"
1 115 THR 2.055 0.100 17 0 "[ . 1 . 2]"
1 116 ASP 0.415 0.095 20 0 "[ . 1 . 2]"
1 117 HIS 1.914 0.148 20 0 "[ . 1 . 2]"
1 118 GLU 1.776 0.121 13 0 "[ . 1 . 2]"
1 120 LYS 0.469 0.060 17 0 "[ . 1 . 2]"
1 121 GLY 0.592 0.083 4 0 "[ . 1 . 2]"
1 123 THR 0.112 0.026 13 0 "[ . 1 . 2]"
1 125 ILE 0.290 0.084 5 0 "[ . 1 . 2]"
1 126 LEU 1.091 0.090 5 0 "[ . 1 . 2]"
1 127 VAL 3.138 0.172 15 0 "[ . 1 . 2]"
1 128 ALA 0.298 0.049 16 0 "[ . 1 . 2]"
1 129 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 LEU 1.536 0.196 15 0 "[ . 1 . 2]"
1 134 CYS 0.190 0.032 7 0 "[ . 1 . 2]"
1 135 GLY 3.138 0.172 15 0 "[ . 1 . 2]"
1 136 MET 0.403 0.056 7 0 "[ . 1 . 2]"
1 137 ILE 0.290 0.084 5 0 "[ . 1 . 2]"
1 138 ALA 0.406 0.095 5 0 "[ . 1 . 2]"
1 139 ILE 0.112 0.026 13 0 "[ . 1 . 2]"
1 140 ALA 0.094 0.017 1 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 7 ARG O 1 140 ALA H . . 2.000 1.987 1.836 2.017 0.017 1 0 "[ . 1 . 2]" 2
2 1 7 ARG O 1 140 ALA N . . 3.000 2.925 2.753 2.993 . 0 0 "[ . 1 . 2]" 2
3 1 10 ARG O 1 138 ALA H . . 2.000 1.844 1.789 1.957 . 0 0 "[ . 1 . 2]" 2
4 1 10 ARG O 1 138 ALA N . . 3.000 2.800 2.738 2.933 . 0 0 "[ . 1 . 2]" 2
5 1 10 ARG H 1 138 ALA O . . 2.000 2.010 1.923 2.095 0.095 5 0 "[ . 1 . 2]" 2
6 1 10 ARG N 1 138 ALA O . . 3.000 2.947 2.834 3.045 0.045 5 0 "[ . 1 . 2]" 2
7 1 12 LEU O 1 136 MET H . . 2.000 1.830 1.787 1.914 . 0 0 "[ . 1 . 2]" 2
8 1 12 LEU O 1 136 MET N . . 3.000 2.783 2.734 2.881 . 0 0 "[ . 1 . 2]" 2
9 1 38 HIS O 1 41 GLY H . . 2.000 2.169 2.138 2.349 0.349 8 0 "[ . 1 . 2]" 2
10 1 38 HIS O 1 41 GLY N . . 3.000 3.104 3.081 3.250 0.250 14 0 "[ . 1 . 2]" 2
11 1 12 LEU H 1 136 MET O . . 2.000 2.015 1.919 2.056 0.056 7 0 "[ . 1 . 2]" 2
12 1 12 LEU N 1 136 MET O . . 3.000 2.955 2.877 3.009 0.009 14 0 "[ . 1 . 2]" 2
13 1 17 VAL O 1 20 LEU H . . 2.000 1.967 1.844 2.044 0.044 8 0 "[ . 1 . 2]" 2
14 1 17 VAL O 1 20 LEU N . . 3.000 2.781 2.732 2.923 . 0 0 "[ . 1 . 2]" 2
15 1 14 LEU H 1 134 CYS O . . 2.000 1.978 1.826 2.032 0.032 7 0 "[ . 1 . 2]" 2
16 1 14 LEU N 1 134 CYS O . . 3.000 2.760 2.731 2.833 . 0 0 "[ . 1 . 2]" 2
17 1 15 GLY H 1 133 LEU O . . 2.000 2.077 2.002 2.196 0.196 15 0 "[ . 1 . 2]" 2
18 1 15 GLY N 1 133 LEU O . . 3.000 2.752 2.727 2.836 . 0 0 "[ . 1 . 2]" 2
19 1 123 THR O 1 139 ILE H . . 2.000 1.914 1.794 2.016 0.016 5 0 "[ . 1 . 2]" 2
20 1 123 THR O 1 139 ILE N . . 3.000 2.861 2.731 2.982 . 0 0 "[ . 1 . 2]" 2
21 1 123 THR H 1 139 ILE O . . 2.000 1.944 1.791 2.026 0.026 13 0 "[ . 1 . 2]" 2
22 1 123 THR N 1 139 ILE O . . 3.000 2.884 2.736 2.981 . 0 0 "[ . 1 . 2]" 2
23 1 125 ILE O 1 137 ILE H . . 2.000 1.896 1.800 2.013 0.013 7 0 "[ . 1 . 2]" 2
24 1 125 ILE O 1 137 ILE N . . 3.000 2.827 2.719 2.972 . 0 0 "[ . 1 . 2]" 2
25 1 125 ILE H 1 137 ILE O . . 2.000 1.995 1.792 2.084 0.084 5 0 "[ . 1 . 2]" 2
26 1 125 ILE N 1 137 ILE O . . 3.000 2.847 2.738 3.016 0.016 5 0 "[ . 1 . 2]" 2
27 1 127 VAL O 1 135 GLY H . . 2.000 2.099 2.054 2.172 0.172 15 0 "[ . 1 . 2]" 2
28 1 127 VAL O 1 135 GLY N . . 3.000 3.058 3.024 3.133 0.133 15 0 "[ . 1 . 2]" 2
29 1 127 VAL H 1 135 GLY O . . 2.000 1.819 1.786 1.868 . 0 0 "[ . 1 . 2]" 2
30 1 127 VAL N 1 135 GLY O . . 3.000 2.746 2.724 2.782 . 0 0 "[ . 1 . 2]" 2
31 1 92 LEU O 1 128 ALA H . . 2.000 1.872 1.792 2.025 0.025 17 0 "[ . 1 . 2]" 2
32 1 92 LEU O 1 128 ALA N . . 3.000 2.823 2.720 2.980 . 0 0 "[ . 1 . 2]" 2
33 1 92 LEU H 1 128 ALA O . . 2.000 1.974 1.799 2.049 0.049 16 0 "[ . 1 . 2]" 2
34 1 92 LEU N 1 128 ALA O . . 3.000 2.903 2.736 3.018 0.018 10 0 "[ . 1 . 2]" 2
35 1 94 GLY O 1 126 LEU H . . 2.000 1.882 1.789 2.019 0.019 16 0 "[ . 1 . 2]" 2
36 1 94 GLY O 1 126 LEU N . . 3.000 2.801 2.724 2.965 . 0 0 "[ . 1 . 2]" 2
37 1 94 GLY H 1 126 LEU O . . 2.000 2.038 1.857 2.090 0.090 5 0 "[ . 1 . 2]" 2
38 1 94 GLY N 1 126 LEU O . . 3.000 2.978 2.795 3.054 0.054 5 0 "[ . 1 . 2]" 2
39 1 71 ILE O 1 93 ILE H . . 2.000 1.901 1.776 2.037 0.037 16 0 "[ . 1 . 2]" 2
40 1 71 ILE O 1 93 ILE N . . 3.000 2.830 2.721 2.965 . 0 0 "[ . 1 . 2]" 2
41 1 71 ILE H 1 93 ILE O . . 2.000 2.043 1.997 2.119 0.119 10 0 "[ . 1 . 2]" 2
42 1 71 ILE N 1 93 ILE O . . 3.000 2.948 2.713 3.030 0.030 13 0 "[ . 1 . 2]" 2
43 1 73 CYS O 1 91 VAL H . . 2.000 1.887 1.767 2.027 0.027 17 0 "[ . 1 . 2]" 2
44 1 73 CYS O 1 91 VAL N . . 3.000 2.722 2.687 2.742 . 0 0 "[ . 1 . 2]" 2
45 1 73 CYS H 1 91 VAL O . . 2.000 2.047 1.857 2.130 0.130 19 0 "[ . 1 . 2]" 2
46 1 73 CYS N 1 91 VAL O . . 3.000 2.914 2.742 3.025 0.025 4 0 "[ . 1 . 2]" 2
47 1 75 VAL H 1 89 PHE O . . 2.000 2.143 2.095 2.212 0.212 17 0 "[ . 1 . 2]" 2
48 1 75 VAL N 1 89 PHE O . . 3.000 3.018 2.953 3.095 0.095 19 0 "[ . 1 . 2]" 2
49 1 66 VAL O 1 70 GLY H . . 2.000 2.064 1.915 2.223 0.223 8 0 "[ . 1 . 2]" 2
50 1 66 VAL O 1 70 GLY N . . 3.000 2.984 2.747 3.126 0.126 8 0 "[ . 1 . 2]" 2
51 1 64 GLN O 1 72 GLY H . . 2.000 2.015 1.856 2.063 0.063 20 0 "[ . 1 . 2]" 2
52 1 64 GLN O 1 72 GLY N . . 3.000 2.933 2.725 3.017 0.017 10 0 "[ . 1 . 2]" 2
53 1 64 GLN H 1 72 GLY O . . 2.000 2.023 1.885 2.079 0.079 6 0 "[ . 1 . 2]" 2
54 1 64 GLN N 1 72 GLY O . . 3.000 2.722 2.694 2.909 . 0 0 "[ . 1 . 2]" 2
55 1 62 ASP O 1 74 LYS H . . 2.000 1.987 1.782 2.153 0.153 4 0 "[ . 1 . 2]" 2
56 1 62 ASP O 1 74 LYS N . . 3.000 2.892 2.734 3.118 0.118 4 0 "[ . 1 . 2]" 2
57 1 62 ASP H 1 74 LYS O . . 2.000 2.056 1.782 2.254 0.254 7 0 "[ . 1 . 2]" 2
58 1 62 ASP N 1 74 LYS O . . 3.000 2.940 2.679 3.144 0.144 7 0 "[ . 1 . 2]" 2
59 1 59 TYR O 1 76 SER H . . 2.000 2.057 1.866 2.203 0.203 3 0 "[ . 1 . 2]" 2
60 1 59 TYR O 1 76 SER N . . 3.000 2.857 2.719 3.010 0.010 3 0 "[ . 1 . 2]" 2
61 1 54 THR OG1 1 56 THR H . . 2.000 2.074 2.035 2.200 0.200 20 0 "[ . 1 . 2]" 2
62 1 54 THR OG1 1 56 THR N . . 3.000 3.008 2.970 3.163 0.163 20 0 "[ . 1 . 2]" 2
63 1 31 THR OG1 1 77 ASN H . . 2.000 1.975 1.795 2.119 0.119 16 0 "[ . 1 . 2]" 2
64 1 31 THR OG1 1 77 ASN N . . 3.000 2.867 2.730 3.032 0.032 16 0 "[ . 1 . 2]" 2
65 1 21 PRO O 1 25 VAL H . . 2.000 1.932 1.792 2.063 0.063 8 0 "[ . 1 . 2]" 2
66 1 21 PRO O 1 25 VAL N . . 3.000 2.893 2.748 3.029 0.029 8 0 "[ . 1 . 2]" 2
67 1 22 LEU O 1 26 LEU H . . 2.000 1.855 1.793 1.985 . 0 0 "[ . 1 . 2]" 2
68 1 22 LEU O 1 26 LEU N . . 3.000 2.782 2.735 2.908 . 0 0 "[ . 1 . 2]" 2
69 1 23 ARG O 1 27 ALA H . . 2.000 2.029 2.003 2.052 0.052 15 0 "[ . 1 . 2]" 2
70 1 23 ARG O 1 27 ALA N . . 3.000 2.991 2.911 3.029 0.029 19 0 "[ . 1 . 2]" 2
71 1 24 LYS O 1 28 VAL H . . 2.000 1.810 1.793 1.847 . 0 0 "[ . 1 . 2]" 2
72 1 24 LYS O 1 28 VAL N . . 3.000 2.742 2.725 2.792 . 0 0 "[ . 1 . 2]" 2
73 1 25 VAL O 1 29 VAL H . . 2.000 2.005 1.923 2.036 0.036 13 0 "[ . 1 . 2]" 2
74 1 25 VAL O 1 29 VAL N . . 3.000 2.812 2.753 2.867 . 0 0 "[ . 1 . 2]" 2
75 1 26 LEU O 1 30 GLY H . . 2.000 1.987 1.936 2.040 0.040 4 0 "[ . 1 . 2]" 2
76 1 26 LEU O 1 30 GLY N . . 3.000 2.735 2.707 2.838 . 0 0 "[ . 1 . 2]" 2
77 1 27 ALA O 1 31 THR H . . 2.000 2.062 1.978 2.121 0.121 3 0 "[ . 1 . 2]" 2
78 1 27 ALA O 1 31 THR N . . 3.000 2.995 2.944 3.055 0.055 3 0 "[ . 1 . 2]" 2
79 1 28 VAL O 1 32 ALA H . . 2.000 1.888 1.832 2.019 0.019 9 0 "[ . 1 . 2]" 2
80 1 28 VAL O 1 32 ALA N . . 3.000 2.779 2.727 2.908 . 0 0 "[ . 1 . 2]" 2
81 1 29 VAL O 1 33 ALA H . . 2.000 2.009 1.871 2.035 0.035 8 0 "[ . 1 . 2]" 2
82 1 29 VAL O 1 33 ALA N . . 3.000 2.896 2.780 2.933 . 0 0 "[ . 1 . 2]" 2
83 1 30 GLY O 1 34 ALA H . . 2.000 1.996 1.906 2.049 0.049 7 0 "[ . 1 . 2]" 2
84 1 30 GLY O 1 34 ALA N . . 3.000 2.871 2.746 3.005 0.005 20 0 "[ . 1 . 2]" 2
85 1 33 ALA O 1 36 SER H . . 2.000 1.924 1.857 2.014 0.014 2 0 "[ . 1 . 2]" 2
86 1 33 ALA O 1 36 SER N . . 3.000 2.796 2.742 2.889 . 0 0 "[ . 1 . 2]" 2
87 1 40 LEU O 1 44 VAL H . . 2.000 2.020 1.998 2.045 0.045 14 0 "[ . 1 . 2]" 2
88 1 40 LEU O 1 44 VAL N . . 3.000 2.972 2.938 3.019 0.019 8 0 "[ . 1 . 2]" 2
89 1 41 GLY O 1 45 THR H . . 2.000 1.820 1.798 1.941 . 0 0 "[ . 1 . 2]" 2
90 1 41 GLY O 1 45 THR N . . 3.000 2.754 2.714 2.898 . 0 0 "[ . 1 . 2]" 2
91 1 42 VAL O 1 46 LYS H . . 2.000 2.022 2.001 2.058 0.058 20 0 "[ . 1 . 2]" 2
92 1 42 VAL O 1 46 LYS N . . 3.000 2.975 2.925 3.028 0.028 8 0 "[ . 1 . 2]" 2
93 1 43 ALA O 1 47 TYR H . . 2.000 1.991 1.808 2.030 0.030 2 0 "[ . 1 . 2]" 2
94 1 43 ALA O 1 47 TYR N . . 3.000 2.938 2.762 3.002 0.002 2 0 "[ . 1 . 2]" 2
95 1 44 VAL O 1 48 CYS H . . 2.000 1.991 1.865 2.022 0.022 8 0 "[ . 1 . 2]" 2
96 1 44 VAL O 1 48 CYS N . . 3.000 2.948 2.842 2.995 . 0 0 "[ . 1 . 2]" 2
97 1 45 THR O 1 49 LYS H . . 2.000 1.950 1.852 2.051 0.051 14 0 "[ . 1 . 2]" 2
98 1 45 THR O 1 49 LYS N . . 3.000 2.811 2.731 2.932 . 0 0 "[ . 1 . 2]" 2
99 1 46 LYS O 1 50 GLU H . . 2.000 2.021 2.007 2.064 0.064 20 0 "[ . 1 . 2]" 2
100 1 46 LYS O 1 50 GLU N . . 3.000 2.874 2.841 2.942 . 0 0 "[ . 1 . 2]" 2
101 1 47 TYR O 1 51 GLU H . . 2.000 2.023 1.952 2.101 0.101 20 0 "[ . 1 . 2]" 2
102 1 47 TYR O 1 51 GLU N . . 3.000 2.869 2.750 3.007 0.007 20 0 "[ . 1 . 2]" 2
103 1 48 CYS O 1 52 LEU H . . 2.000 1.953 1.840 2.010 0.010 12 0 "[ . 1 . 2]" 2
104 1 48 CYS O 1 52 LEU N . . 3.000 2.830 2.736 2.893 . 0 0 "[ . 1 . 2]" 2
105 1 49 LYS O 1 53 GLY H . . 2.000 2.026 1.992 2.113 0.113 20 0 "[ . 1 . 2]" 2
106 1 49 LYS O 1 53 GLY N . . 3.000 2.847 2.744 3.016 0.016 20 0 "[ . 1 . 2]" 2
107 1 77 ASN O 1 81 ILE H . . 2.000 2.058 1.955 2.217 0.217 14 0 "[ . 1 . 2]" 2
108 1 77 ASN O 1 81 ILE N . . 3.000 2.889 2.731 3.050 0.050 14 0 "[ . 1 . 2]" 2
109 1 78 VAL O 1 82 LEU H . . 2.000 1.988 1.813 2.106 0.106 7 0 "[ . 1 . 2]" 2
110 1 78 VAL O 1 82 LEU N . . 3.000 2.828 2.715 2.969 . 0 0 "[ . 1 . 2]" 2
111 1 79 GLU O 1 83 ALA H . . 2.000 2.065 1.999 2.129 0.129 14 0 "[ . 1 . 2]" 2
112 1 79 GLU O 1 83 ALA N . . 3.000 2.753 2.688 2.842 . 0 0 "[ . 1 . 2]" 2
113 1 95 ASN O 1 99 LEU H . . 2.000 2.006 1.821 2.103 0.103 20 0 "[ . 1 . 2]" 2
114 1 95 ASN O 1 99 LEU N . . 3.000 2.969 2.798 3.067 0.067 17 0 "[ . 1 . 2]" 2
115 1 96 ARG O 1 100 ARG H . . 2.000 1.961 1.843 2.093 0.093 6 0 "[ . 1 . 2]" 2
116 1 96 ARG O 1 100 ARG N . . 3.000 2.850 2.730 3.040 0.040 6 0 "[ . 1 . 2]" 2
117 1 97 GLU O 1 101 ARG H . . 2.000 1.923 1.797 2.036 0.036 7 0 "[ . 1 . 2]" 2
118 1 97 GLU O 1 101 ARG N . . 3.000 2.747 2.716 2.826 . 0 0 "[ . 1 . 2]" 2
119 1 98 TRP O 1 102 ASN H . . 2.000 2.093 2.013 2.154 0.154 1 0 "[ . 1 . 2]" 2
120 1 98 TRP O 1 102 ASN N . . 3.000 2.919 2.758 3.028 0.028 14 0 "[ . 1 . 2]" 2
121 1 99 LEU O 1 103 GLY H . . 2.000 2.095 2.020 2.153 0.153 8 0 "[ . 1 . 2]" 2
122 1 99 LEU O 1 103 GLY N . . 3.000 2.704 2.669 2.754 . 0 0 "[ . 1 . 2]" 2
123 1 100 ARG O 1 104 LEU H . . 2.000 2.067 1.877 2.227 0.227 9 0 "[ . 1 . 2]" 2
124 1 100 ARG O 1 104 LEU N . . 3.000 2.780 2.645 2.950 . 0 0 "[ . 1 . 2]" 2
125 1 107 SER O 1 111 SER H . . 2.000 2.015 1.839 2.069 0.069 17 0 "[ . 1 . 2]" 2
126 1 107 SER O 1 111 SER N . . 3.000 2.985 2.804 3.045 0.045 17 0 "[ . 1 . 2]" 2
127 1 108 SER O 1 112 ASP H . . 2.000 2.043 1.995 2.093 0.093 12 0 "[ . 1 . 2]" 2
128 1 108 SER O 1 112 ASP N . . 3.000 2.918 2.842 2.981 . 0 0 "[ . 1 . 2]" 2
129 1 109 ASP O 1 113 ALA H . . 2.000 2.037 2.015 2.066 0.066 2 0 "[ . 1 . 2]" 2
130 1 109 ASP O 1 113 ALA N . . 3.000 2.972 2.904 3.024 0.024 10 0 "[ . 1 . 2]" 2
131 1 110 VAL O 1 114 MET H . . 2.000 2.002 1.889 2.047 0.047 7 0 "[ . 1 . 2]" 2
132 1 110 VAL O 1 114 MET N . . 3.000 2.936 2.802 2.986 . 0 0 "[ . 1 . 2]" 2
133 1 111 SER O 1 115 THR H . . 2.000 2.065 2.041 2.100 0.100 17 0 "[ . 1 . 2]" 2
134 1 111 SER O 1 115 THR N . . 3.000 3.038 3.011 3.077 0.077 17 0 "[ . 1 . 2]" 2
135 1 112 ASP O 1 116 ASP H . . 2.000 1.983 1.881 2.095 0.095 20 0 "[ . 1 . 2]" 2
136 1 112 ASP O 1 116 ASP N . . 3.000 2.782 2.725 2.861 . 0 0 "[ . 1 . 2]" 2
137 1 113 ALA O 1 117 HIS H . . 2.000 2.065 2.018 2.148 0.148 20 0 "[ . 1 . 2]" 2
138 1 113 ALA O 1 117 HIS N . . 3.000 2.955 2.840 3.060 0.060 20 0 "[ . 1 . 2]" 2
139 1 114 MET O 1 118 GLU H . . 2.000 2.059 2.030 2.121 0.121 13 0 "[ . 1 . 2]" 2
140 1 114 MET O 1 118 GLU N . . 3.000 2.912 2.835 2.974 . 0 0 "[ . 1 . 2]" 2
141 1 117 HIS O 1 120 LYS H . . 2.000 2.002 1.833 2.060 0.060 17 0 "[ . 1 . 2]" 2
142 1 117 HIS O 1 120 LYS N . . 3.000 2.935 2.748 2.992 . 0 0 "[ . 1 . 2]" 2
143 1 118 GLU O 1 121 GLY H . . 2.000 2.025 1.914 2.083 0.083 4 0 "[ . 1 . 2]" 2
144 1 118 GLU O 1 121 GLY N . . 3.000 2.953 2.826 2.998 . 0 0 "[ . 1 . 2]" 2
145 1 129 ILE H 1 132 VAL O . . 2.000 1.801 1.779 1.845 . 0 0 "[ . 1 . 2]" 2
146 1 129 ILE N 1 132 VAL O . . 3.000 2.761 2.721 2.823 . 0 0 "[ . 1 . 2]" 2
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