NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
399891 |
1ugj   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ugj
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 2131
_Distance_constraint_stats_list.Viol_count 3278
_Distance_constraint_stats_list.Viol_total 3904.215
_Distance_constraint_stats_list.Viol_max 0.949
_Distance_constraint_stats_list.Viol_rms 0.0312
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0046
_Distance_constraint_stats_list.Viol_average_violations_only 0.0596
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 PRO 0.883 0.204 10 0 "[ . 1 . 2]"
1 9 ARG 2.667 0.234 7 0 "[ . 1 . 2]"
1 10 LEU 4.556 0.777 11 2 "[ - . 1+ . 2]"
1 11 TYR 3.353 0.326 15 0 "[ . 1 . 2]"
1 12 LYS 0.446 0.326 15 0 "[ . 1 . 2]"
1 13 GLU 2.511 0.536 8 3 "[ *- + 1 . 2]"
1 14 PRO 3.077 0.536 8 3 "[ *- + 1 . 2]"
1 15 SER 5.849 0.333 2 0 "[ . 1 . 2]"
1 16 ALA 3.978 0.333 2 0 "[ . 1 . 2]"
1 17 LYS 0.299 0.090 11 0 "[ . 1 . 2]"
1 18 SER 0.282 0.091 19 0 "[ . 1 . 2]"
1 19 ASN 2.463 0.354 5 0 "[ . 1 . 2]"
1 20 LYS 1.665 0.160 2 0 "[ . 1 . 2]"
1 21 PHE 2.676 0.131 1 0 "[ . 1 . 2]"
1 22 ILE 3.999 0.112 12 0 "[ . 1 . 2]"
1 23 ILE 1.858 0.336 1 0 "[ . 1 . 2]"
1 24 HIS 0.272 0.090 6 0 "[ . 1 . 2]"
1 25 ASN 0.026 0.006 20 0 "[ . 1 . 2]"
1 26 ALA 0.456 0.044 20 0 "[ . 1 . 2]"
1 27 LEU 1.099 0.079 8 0 "[ . 1 . 2]"
1 28 SER 1.331 0.244 19 0 "[ . 1 . 2]"
1 29 HIS 0.413 0.068 3 0 "[ . 1 . 2]"
1 30 CYS 1.245 0.372 18 0 "[ . 1 . 2]"
1 31 CYS 0.928 0.372 18 0 "[ . 1 . 2]"
1 32 LEU 0.165 0.039 20 0 "[ . 1 . 2]"
1 33 ALA 1.108 0.240 20 0 "[ . 1 . 2]"
1 34 GLY 0.921 0.240 20 0 "[ . 1 . 2]"
1 35 LYS 2.220 0.437 13 0 "[ . 1 . 2]"
1 36 VAL 2.040 0.437 13 0 "[ . 1 . 2]"
1 37 ASN 0.018 0.007 13 0 "[ . 1 . 2]"
1 38 GLU 2.676 0.541 16 1 "[ . 1 .+ 2]"
1 39 PRO 0.917 0.089 16 0 "[ . 1 . 2]"
1 40 GLN 12.683 0.371 14 0 "[ . 1 . 2]"
1 41 LYS 9.949 0.697 8 5 "[ . +** *.- 2]"
1 42 ASN 1.700 0.316 16 0 "[ . 1 . 2]"
1 43 ARG 6.160 0.519 11 1 "[ . 1+ . 2]"
1 44 ILE 3.192 0.099 5 0 "[ . 1 . 2]"
1 45 LEU 2.750 0.316 14 0 "[ . 1 . 2]"
1 46 GLU 3.104 0.739 8 2 "[ . + 1- . 2]"
1 47 GLU 2.689 0.368 5 0 "[ . 1 . 2]"
1 48 ILE 0.999 0.368 5 0 "[ . 1 . 2]"
1 49 GLU 0.534 0.036 2 0 "[ . 1 . 2]"
1 50 LYS 6.960 0.170 15 0 "[ . 1 . 2]"
1 51 SER 0.553 0.051 15 0 "[ . 1 . 2]"
1 52 LYS 1.391 0.089 20 0 "[ . 1 . 2]"
1 53 ALA 0.812 0.089 20 0 "[ . 1 . 2]"
1 54 ASN 0.041 0.026 9 0 "[ . 1 . 2]"
1 55 HIS 0.831 0.354 5 0 "[ . 1 . 2]"
1 56 PHE 1.103 0.227 15 0 "[ . 1 . 2]"
1 57 LEU 1.156 0.127 18 0 "[ . 1 . 2]"
1 58 ILE 0.017 0.004 15 0 "[ . 1 . 2]"
1 59 LEU 0.500 0.150 10 0 "[ . 1 . 2]"
1 60 PHE 0.083 0.016 6 0 "[ . 1 . 2]"
1 61 ARG 3.643 0.697 8 1 "[ . + 1 . 2]"
1 62 ASP 2.057 0.532 20 1 "[ . 1 . +]"
1 63 SER 1.346 0.532 20 1 "[ . 1 . +]"
1 64 SER 0.135 0.065 19 0 "[ . 1 . 2]"
1 65 CYS 0.183 0.113 11 0 "[ . 1 . 2]"
1 66 GLN 3.999 0.293 10 0 "[ . 1 . 2]"
1 67 PHE 1.556 0.163 15 0 "[ . 1 . 2]"
1 68 ARG 2.867 0.281 4 0 "[ . 1 . 2]"
1 69 ALA 3.702 0.421 1 0 "[ . 1 . 2]"
1 70 LEU 0.733 0.093 18 0 "[ . 1 . 2]"
1 71 TYR 0.508 0.065 8 0 "[ . 1 . 2]"
1 72 THR 0.650 0.039 9 0 "[ . 1 . 2]"
1 73 LEU 2.031 0.178 19 0 "[ . 1 . 2]"
1 74 SER 0.180 0.086 6 0 "[ . 1 . 2]"
1 75 GLY 0.055 0.022 15 0 "[ . 1 . 2]"
1 76 GLU 7.613 0.251 11 0 "[ . 1 . 2]"
1 77 THR 9.527 0.251 11 0 "[ . 1 . 2]"
1 78 GLU 3.199 0.182 19 0 "[ . 1 . 2]"
1 79 GLU 5.284 0.200 17 0 "[ . 1 . 2]"
1 80 LEU 2.956 0.335 8 0 "[ . 1 . 2]"
1 81 SER 3.344 0.335 8 0 "[ . 1 . 2]"
1 82 ARG 2.974 0.283 13 0 "[ . 1 . 2]"
1 83 LEU 3.283 0.319 5 0 "[ . 1 . 2]"
1 84 ALA 3.248 0.283 13 0 "[ . 1 . 2]"
1 85 GLY 4.690 0.421 1 0 "[ . 1 . 2]"
1 86 TYR 0.830 0.105 10 0 "[ . 1 . 2]"
1 87 GLY 0.849 0.105 10 0 "[ . 1 . 2]"
1 88 PRO 1.212 0.221 18 0 "[ . 1 . 2]"
1 89 ARG 0.798 0.428 18 0 "[ . 1 . 2]"
1 90 THR 2.634 0.149 18 0 "[ . 1 . 2]"
1 91 VAL 1.517 0.056 4 0 "[ . 1 . 2]"
1 92 THR 2.283 0.121 15 0 "[ . 1 . 2]"
1 93 PRO 4.748 0.121 15 0 "[ . 1 . 2]"
1 94 ALA 4.905 0.208 17 0 "[ . 1 . 2]"
1 95 MET 4.128 0.208 17 0 "[ . 1 . 2]"
1 96 VAL 0.965 0.094 10 0 "[ . 1 . 2]"
1 97 GLU 0.654 0.036 17 0 "[ . 1 . 2]"
1 98 GLY 0.191 0.025 19 0 "[ . 1 . 2]"
1 99 ILE 10.490 0.949 9 8 "[ * * *-+1* * . *2]"
1 100 TYR 2.915 0.313 13 0 "[ . 1 . 2]"
1 101 LYS 6.112 0.501 2 1 "[ + . 1 . 2]"
1 102 TYR 3.374 0.207 13 0 "[ . 1 . 2]"
1 103 ASN 0.616 0.200 9 0 "[ . 1 . 2]"
1 104 SER 1.294 0.149 4 0 "[ . 1 . 2]"
1 105 ASP 4.239 0.564 12 1 "[ . 1 + . 2]"
1 106 ARG 5.284 0.564 12 1 "[ . 1 + . 2]"
1 107 LYS 0.731 0.202 19 0 "[ . 1 . 2]"
1 108 ARG 4.669 0.475 7 0 "[ . 1 . 2]"
1 109 PHE 3.053 0.207 13 0 "[ . 1 . 2]"
1 110 THR 1.402 0.106 19 0 "[ . 1 . 2]"
1 111 GLN 8.572 0.653 7 3 "[ . + 1 .*- 2]"
1 112 ILE 9.487 0.508 11 1 "[ . 1+ . 2]"
1 113 PRO 6.574 0.508 11 1 "[ . 1+ . 2]"
1 114 ALA 1.695 0.129 14 0 "[ . 1 . 2]"
1 115 LYS 0.384 0.037 8 0 "[ . 1 . 2]"
1 116 THR 2.413 0.089 12 0 "[ . 1 . 2]"
1 117 MET 7.309 0.949 9 8 "[ * * *-+1* * . *2]"
1 118 SER 1.676 0.344 15 0 "[ . 1 . 2]"
1 119 MET 1.698 0.154 13 0 "[ . 1 . 2]"
1 120 SER 2.949 0.344 15 0 "[ . 1 . 2]"
1 121 VAL 0.582 0.059 4 0 "[ . 1 . 2]"
1 122 ASP 0.364 0.031 1 0 "[ . 1 . 2]"
1 123 ALA 0.083 0.019 1 0 "[ . 1 . 2]"
1 124 PHE 0.504 0.029 7 0 "[ . 1 . 2]"
1 125 THR 0.092 0.024 9 0 "[ . 1 . 2]"
1 126 ILE 1.304 0.083 17 0 "[ . 1 . 2]"
1 127 GLN 4.707 0.621 6 5 "[ .+-* 1 * . * 2]"
1 128 GLY 0.151 0.029 17 0 "[ . 1 . 2]"
1 129 HIS 3.889 0.621 6 5 "[ .+-* 1 * . * 2]"
1 130 LEU 0.199 0.051 12 0 "[ . 1 . 2]"
1 131 TRP 0.221 0.036 1 0 "[ . 1 . 2]"
1 132 GLN 0.055 0.018 5 0 "[ . 1 . 2]"
1 133 SER 1.452 0.310 6 0 "[ . 1 . 2]"
1 134 LYS 1.164 0.742 13 1 "[ . 1 + . 2]"
1 135 LYS 0.828 0.742 13 1 "[ . 1 + . 2]"
1 136 SER 0.156 0.052 7 0 "[ . 1 . 2]"
1 137 GLY 0.104 0.022 18 0 "[ . 1 . 2]"
1 139 SER 0.001 0.001 14 0 "[ . 1 . 2]"
1 140 SER 0.160 0.043 8 0 "[ . 1 . 2]"
1 141 GLY 0.159 0.043 8 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 83 LEU H 1 83 LEU QB . . 3.850 2.199 2.181 2.260 . 0 0 "[ . 1 . 2]" 1
2 1 69 ALA MB 1 83 LEU H . . 4.970 4.968 4.826 5.011 0.041 9 0 "[ . 1 . 2]" 1
3 1 72 THR MG 1 83 LEU H . . 5.110 4.364 4.101 4.530 . 0 0 "[ . 1 . 2]" 1
4 1 82 ARG HG2 1 83 LEU H . . 4.680 3.441 3.222 4.095 . 0 0 "[ . 1 . 2]" 1
5 1 82 ARG HG3 1 83 LEU H . . 4.830 4.056 3.044 4.426 . 0 0 "[ . 1 . 2]" 1
6 1 97 GLU H 1 97 GLU HB2 . . 4.130 2.699 2.508 2.874 . 0 0 "[ . 1 . 2]" 1
7 1 126 ILE H 1 131 TRP HE1 . . 4.850 3.964 2.962 4.621 . 0 0 "[ . 1 . 2]" 1
8 1 128 GLY HA2 1 131 TRP HE1 . . 5.090 4.214 3.693 4.632 . 0 0 "[ . 1 . 2]" 1
9 1 126 ILE HG12 1 131 TRP HE1 . . 4.270 3.145 2.718 3.382 . 0 0 "[ . 1 . 2]" 1
10 1 126 ILE HG13 1 131 TRP HE1 . . 4.000 2.744 2.162 3.179 . 0 0 "[ . 1 . 2]" 1
11 1 126 ILE MG 1 131 TRP HE1 . . 5.100 4.960 4.478 5.108 0.008 1 0 "[ . 1 . 2]" 1
12 1 59 LEU MD1 1 131 TRP HE1 . . 4.840 4.296 3.665 4.836 . 0 0 "[ . 1 . 2]" 1
13 1 111 GLN HG3 1 112 ILE H . . 4.070 2.870 1.913 4.086 0.016 11 0 "[ . 1 . 2]" 1
14 1 112 ILE H 1 112 ILE HB . . 3.660 2.750 2.674 2.879 . 0 0 "[ . 1 . 2]" 1
15 1 82 ARG H 1 83 LEU H . . 5.070 4.350 4.277 4.465 . 0 0 "[ . 1 . 2]" 1
16 1 71 TYR QE 1 82 ARG H . . 4.510 3.528 3.069 4.012 . 0 0 "[ . 1 . 2]" 1
17 1 81 SER HB2 1 82 ARG H . . 4.080 4.153 3.962 4.178 0.098 9 0 "[ . 1 . 2]" 1
18 1 81 SER HB3 1 82 ARG H . . 4.600 4.095 3.804 4.248 . 0 0 "[ . 1 . 2]" 1
19 1 82 ARG H 1 82 ARG QB . . 3.540 2.213 2.135 2.240 . 0 0 "[ . 1 . 2]" 1
20 1 82 ARG H 1 82 ARG HG3 . . 4.860 4.465 4.381 4.516 . 0 0 "[ . 1 . 2]" 1
21 1 102 TYR H 1 122 ASP H . . 5.230 4.336 3.641 4.660 . 0 0 "[ . 1 . 2]" 1
22 1 102 TYR H 1 102 TYR HB2 . . 4.120 3.037 2.660 3.266 . 0 0 "[ . 1 . 2]" 1
23 1 110 THR H 1 111 GLN H . . 4.960 4.461 4.407 4.495 . 0 0 "[ . 1 . 2]" 1
24 1 111 GLN H 1 112 ILE H . . 4.960 4.566 4.220 4.604 . 0 0 "[ . 1 . 2]" 1
25 1 100 TYR QD 1 111 GLN H . . 4.270 4.045 3.622 4.287 0.017 19 0 "[ . 1 . 2]" 1
26 1 110 THR HA 1 111 GLN H . . 2.950 2.396 2.333 2.461 . 0 0 "[ . 1 . 2]" 1
27 1 111 GLN H 1 111 GLN HG2 . . 4.620 4.265 4.016 4.528 . 0 0 "[ . 1 . 2]" 1
28 1 102 TYR QE 1 103 ASN H . . 5.210 5.095 4.904 5.215 0.005 18 0 "[ . 1 . 2]" 1
29 1 103 ASN H 1 107 LYS H . . 5.070 4.925 4.259 5.097 0.027 19 0 "[ . 1 . 2]" 1
30 1 103 ASN H 1 103 ASN HB2 . . 3.950 2.103 2.025 2.554 . 0 0 "[ . 1 . 2]" 1
31 1 19 ASN HD21 1 56 PHE H . . 4.630 4.019 3.126 4.857 0.227 15 0 "[ . 1 . 2]" 1
32 1 19 ASN HD22 1 56 PHE H . . 5.000 2.683 1.982 3.513 . 0 0 "[ . 1 . 2]" 1
33 1 56 PHE H 1 56 PHE QD . . 4.150 2.760 2.342 3.205 . 0 0 "[ . 1 . 2]" 1
34 1 59 LEU H 1 71 TYR H . . 5.190 4.599 4.067 5.087 . 0 0 "[ . 1 . 2]" 1
35 1 58 ILE H 1 59 LEU H . . 4.860 4.385 4.193 4.541 . 0 0 "[ . 1 . 2]" 1
36 1 59 LEU H 1 71 TYR QE . . 4.950 4.631 3.842 4.968 0.018 13 0 "[ . 1 . 2]" 1
37 1 59 LEU H 1 70 LEU HA . . 4.480 3.237 3.011 3.537 . 0 0 "[ . 1 . 2]" 1
38 1 58 ILE HG12 1 59 LEU H . . 5.230 4.583 4.385 4.964 . 0 0 "[ . 1 . 2]" 1
39 1 59 LEU H 1 59 LEU HB2 . . 4.010 2.673 2.503 2.811 . 0 0 "[ . 1 . 2]" 1
40 1 59 LEU H 1 59 LEU HG . . 5.070 4.397 4.312 4.479 . 0 0 "[ . 1 . 2]" 1
41 1 59 LEU H 1 70 LEU QD . . 4.600 4.105 3.708 4.509 . 0 0 "[ . 1 . 2]" 1
42 1 59 LEU H 1 59 LEU HB3 . . 4.130 2.438 2.347 2.557 . 0 0 "[ . 1 . 2]" 1
43 1 59 LEU H 1 59 LEU MD1 . . 4.920 4.173 3.998 4.249 . 0 0 "[ . 1 . 2]" 1
44 1 71 TYR H 1 124 PHE QE . . 4.990 4.171 3.960 4.516 . 0 0 "[ . 1 . 2]" 1
45 1 71 TYR H 1 71 TYR QD . . 4.750 3.046 2.798 3.303 . 0 0 "[ . 1 . 2]" 1
46 1 70 LEU HG 1 71 TYR H . . 4.280 2.893 1.941 4.345 0.065 8 0 "[ . 1 . 2]" 1
47 1 70 LEU HB2 1 71 TYR H . . 4.600 4.098 4.014 4.211 . 0 0 "[ . 1 . 2]" 1
48 1 70 LEU H 1 71 TYR H . . 4.970 4.572 4.504 4.618 . 0 0 "[ . 1 . 2]" 1
49 1 60 PHE H 1 60 PHE QD . . 4.700 2.892 1.988 3.543 . 0 0 "[ . 1 . 2]" 1
50 1 60 PHE H 1 125 THR HA . . 4.820 3.360 2.959 3.676 . 0 0 "[ . 1 . 2]" 1
51 1 59 LEU HG 1 60 PHE H . . 4.940 3.268 2.712 3.734 . 0 0 "[ . 1 . 2]" 1
52 1 59 LEU HB3 1 60 PHE H . . 4.810 4.349 4.133 4.516 . 0 0 "[ . 1 . 2]" 1
53 1 15 SER HB2 1 16 ALA H . . 4.410 4.494 3.280 4.743 0.333 2 0 "[ . 1 . 2]" 1
54 1 67 PHE H 1 67 PHE QD . . 4.750 4.058 3.875 4.106 . 0 0 "[ . 1 . 2]" 1
55 1 31 CYS QB 1 67 PHE H . . 4.750 4.021 3.433 4.604 . 0 0 "[ . 1 . 2]" 1
56 1 67 PHE H 1 67 PHE QB . . 3.510 2.104 2.031 2.141 . 0 0 "[ . 1 . 2]" 1
57 1 32 LEU MD2 1 67 PHE H . . 5.150 4.488 3.789 5.189 0.039 20 0 "[ . 1 . 2]" 1
58 1 14 PRO HB2 1 16 ALA H . . 5.120 4.646 2.972 5.235 0.115 7 0 "[ . 1 . 2]" 1
59 1 19 ASN H 1 56 PHE H . . 4.860 4.136 3.769 4.547 . 0 0 "[ . 1 . 2]" 1
60 1 19 ASN H 1 56 PHE QD . . 5.220 4.363 3.981 4.769 . 0 0 "[ . 1 . 2]" 1
61 1 19 ASN H 1 54 ASN QB . . 4.790 4.004 3.322 4.502 . 0 0 "[ . 1 . 2]" 1
62 1 58 ILE H 1 58 ILE HG12 . . 4.500 4.315 4.194 4.442 . 0 0 "[ . 1 . 2]" 1
63 1 58 ILE H 1 58 ILE HB . . 3.700 2.423 2.261 2.595 . 0 0 "[ . 1 . 2]" 1
64 1 23 ILE MD 1 58 ILE H . . 4.540 4.149 3.891 4.490 . 0 0 "[ . 1 . 2]" 1
65 1 57 LEU HB3 1 58 ILE H . . 4.570 2.664 2.363 3.144 . 0 0 "[ . 1 . 2]" 1
66 1 58 ILE H 1 58 ILE MG . . 4.730 3.707 3.593 3.805 . 0 0 "[ . 1 . 2]" 1
67 1 60 PHE QD 1 68 ARG H . . 5.100 4.506 3.335 5.094 . 0 0 "[ . 1 . 2]" 1
68 1 80 LEU H 1 92 THR HA . . 5.040 3.642 3.438 3.840 . 0 0 "[ . 1 . 2]" 1
69 1 80 LEU H 1 80 LEU HB2 . . 3.820 2.485 2.400 2.606 . 0 0 "[ . 1 . 2]" 1
70 1 80 LEU H 1 80 LEU MD2 . . 4.680 4.421 4.358 4.519 . 0 0 "[ . 1 . 2]" 1
71 1 91 VAL H 1 92 THR H . . 5.170 4.318 4.153 4.426 . 0 0 "[ . 1 . 2]" 1
72 1 91 VAL H 1 95 MET ME . . 5.080 4.912 4.768 5.098 0.018 10 0 "[ . 1 . 2]" 1
73 1 91 VAL H 1 91 VAL HB . . 3.760 2.697 2.573 2.816 . 0 0 "[ . 1 . 2]" 1
74 1 12 LYS QB 1 13 GLU H . . 4.070 3.243 2.688 3.691 . 0 0 "[ . 1 . 2]" 1
75 1 67 PHE QD 1 68 ARG H . . 4.780 3.481 3.170 3.735 . 0 0 "[ . 1 . 2]" 1
76 1 67 PHE QB 1 68 ARG H . . 4.830 3.800 3.620 3.894 . 0 0 "[ . 1 . 2]" 1
77 1 68 ARG H 1 68 ARG HB3 . . 3.980 3.445 2.679 3.717 . 0 0 "[ . 1 . 2]" 1
78 1 68 ARG H 1 68 ARG HG3 . . 4.550 4.288 3.999 4.576 0.026 4 0 "[ . 1 . 2]" 1
79 1 13 GLU H 1 13 GLU QG . . 3.740 3.046 2.427 3.744 0.004 2 0 "[ . 1 . 2]" 1
80 1 13 GLU H 1 13 GLU QB . . 3.320 2.340 2.059 2.662 . 0 0 "[ . 1 . 2]" 1
81 1 12 LYS QG 1 13 GLU H . . 4.480 3.218 2.149 4.245 . 0 0 "[ . 1 . 2]" 1
82 1 12 LYS H 1 13 GLU H . . 4.290 4.207 4.030 4.348 0.058 1 0 "[ . 1 . 2]" 1
83 1 9 ARG H 1 10 LEU H . . 4.370 4.305 3.841 4.568 0.198 7 0 "[ . 1 . 2]" 1
84 1 9 ARG QB 1 10 LEU H . . 4.140 2.697 1.877 3.981 . 0 0 "[ . 1 . 2]" 1
85 1 10 LEU H 1 10 LEU HB2 . . 3.220 2.703 2.085 3.476 0.256 11 0 "[ . 1 . 2]" 1
86 1 10 LEU H 1 10 LEU HB3 . . 3.930 3.479 2.277 3.895 . 0 0 "[ . 1 . 2]" 1
87 1 10 LEU H 1 10 LEU MD1 . . 5.210 3.907 2.352 4.647 . 0 0 "[ . 1 . 2]" 1
88 1 10 LEU H 1 10 LEU MD2 . . 5.160 4.092 1.954 4.812 . 0 0 "[ . 1 . 2]" 1
89 1 11 TYR QD 1 12 LYS H . . 5.050 3.296 2.216 4.555 . 0 0 "[ . 1 . 2]" 1
90 1 11 TYR HB3 1 12 LYS H . . 4.350 3.444 2.472 4.676 0.326 15 0 "[ . 1 . 2]" 1
91 1 12 LYS H 1 12 LYS QB . . 3.760 3.052 2.575 3.336 . 0 0 "[ . 1 . 2]" 1
92 1 117 MET H 1 118 SER H . . 4.830 4.633 4.472 4.663 . 0 0 "[ . 1 . 2]" 1
93 1 117 MET H 1 117 MET HG2 . . 4.250 3.568 2.653 4.227 . 0 0 "[ . 1 . 2]" 1
94 1 117 MET H 1 117 MET HG3 . . 4.470 4.006 3.785 4.186 . 0 0 "[ . 1 . 2]" 1
95 1 117 MET H 1 117 MET HB2 . . 3.560 2.065 1.996 2.157 . 0 0 "[ . 1 . 2]" 1
96 1 117 MET H 1 117 MET HB3 . . 3.570 3.368 3.289 3.449 . 0 0 "[ . 1 . 2]" 1
97 1 52 LYS H 1 53 ALA H . . 3.550 2.790 2.591 2.976 . 0 0 "[ . 1 . 2]" 1
98 1 51 SER H 1 53 ALA H . . 5.090 4.748 4.655 4.929 . 0 0 "[ . 1 . 2]" 1
99 1 53 ALA H 1 56 PHE HZ . . 4.620 3.039 2.521 3.711 . 0 0 "[ . 1 . 2]" 1
100 1 53 ALA H 1 56 PHE QE . . 4.870 3.897 3.594 4.278 . 0 0 "[ . 1 . 2]" 1
101 1 51 SER HG 1 53 ALA H . . 3.950 2.350 1.940 3.228 . 0 0 "[ . 1 . 2]" 1
102 1 51 SER HA 1 53 ALA H . . 3.920 3.793 3.616 3.912 . 0 0 "[ . 1 . 2]" 1
103 1 52 LYS HB3 1 53 ALA H . . 4.930 4.299 4.092 4.506 . 0 0 "[ . 1 . 2]" 1
104 1 52 LYS HB2 1 53 ALA H . . 4.580 4.350 4.125 4.669 0.089 20 0 "[ . 1 . 2]" 1
105 1 53 ALA H 1 72 THR MG . . 4.240 3.722 3.524 3.969 . 0 0 "[ . 1 . 2]" 1
106 1 113 PRO HD2 1 114 ALA H . . 4.670 2.588 2.370 2.701 . 0 0 "[ . 1 . 2]" 1
107 1 113 PRO HD3 1 114 ALA H . . 4.540 3.772 3.681 3.824 . 0 0 "[ . 1 . 2]" 1
108 1 113 PRO QG 1 114 ALA H . . 3.900 3.563 3.251 3.690 . 0 0 "[ . 1 . 2]" 1
109 1 112 ILE HB 1 114 ALA H . . 4.450 2.797 2.688 3.085 . 0 0 "[ . 1 . 2]" 1
110 1 114 ALA H 1 114 ALA MB . . 3.000 2.300 2.189 2.466 . 0 0 "[ . 1 . 2]" 1
111 1 99 ILE MD 1 114 ALA H . . 4.270 3.179 2.926 3.324 . 0 0 "[ . 1 . 2]" 1
112 1 112 ILE MD 1 114 ALA H . . 4.800 4.697 4.524 4.784 . 0 0 "[ . 1 . 2]" 1
113 1 101 LYS HB2 1 122 ASP H . . 5.200 4.254 4.057 4.657 . 0 0 "[ . 1 . 2]" 1
114 1 112 ILE MD 1 122 ASP H . . 5.000 3.739 3.365 3.972 . 0 0 "[ . 1 . 2]" 1
115 1 26 ALA H 1 28 SER H . . 4.850 4.412 4.262 4.562 . 0 0 "[ . 1 . 2]" 1
116 1 25 ASN HB3 1 26 ALA H . . 3.890 3.310 2.966 3.542 . 0 0 "[ . 1 . 2]" 1
117 1 22 ILE MG 1 26 ALA H . . 5.080 4.274 4.127 4.509 . 0 0 "[ . 1 . 2]" 1
118 1 23 ILE MG 1 26 ALA H . . 5.100 4.079 3.896 4.362 . 0 0 "[ . 1 . 2]" 1
119 1 23 ILE MD 1 26 ALA H . . 5.080 4.061 3.950 4.221 . 0 0 "[ . 1 . 2]" 1
120 1 26 ALA H 1 27 LEU MD2 . . 4.670 4.520 4.379 4.672 0.002 12 0 "[ . 1 . 2]" 1
121 1 30 CYS H 1 32 LEU H . . 4.710 2.794 2.666 2.953 . 0 0 "[ . 1 . 2]" 1
122 1 32 LEU H 1 32 LEU MD1 . . 5.070 4.323 4.002 4.460 . 0 0 "[ . 1 . 2]" 1
123 1 135 LYS H 1 135 LYS HB3 . . 4.170 3.492 2.709 4.075 . 0 0 "[ . 1 . 2]" 1
124 1 135 LYS H 1 135 LYS HB2 . . 3.820 2.981 2.121 3.530 . 0 0 "[ . 1 . 2]" 1
125 1 134 LYS QG 1 135 LYS H . . 4.520 2.830 1.919 3.794 . 0 0 "[ . 1 . 2]" 1
126 1 32 LEU H 1 32 LEU HG . . 4.390 3.632 3.298 3.822 . 0 0 "[ . 1 . 2]" 1
127 1 32 LEU H 1 32 LEU HB2 . . 4.120 2.748 2.635 2.890 . 0 0 "[ . 1 . 2]" 1
128 1 37 ASN H 1 38 GLU H . . 3.550 2.761 2.436 3.080 . 0 0 "[ . 1 . 2]" 1
129 1 36 VAL HA 1 38 GLU H . . 4.770 3.695 3.549 3.907 . 0 0 "[ . 1 . 2]" 1
130 1 38 GLU H 1 39 PRO HD2 . . 3.960 1.935 1.913 1.962 . 0 0 "[ . 1 . 2]" 1
131 1 38 GLU H 1 38 GLU HG2 . . 4.330 4.326 4.074 4.399 0.069 14 0 "[ . 1 . 2]" 1
132 1 38 GLU H 1 38 GLU QB . . 3.230 2.226 2.125 2.249 . 0 0 "[ . 1 . 2]" 1
133 1 38 GLU H 1 39 PRO HG3 . . 4.830 4.125 4.101 4.170 . 0 0 "[ . 1 . 2]" 1
134 1 19 ASN HB2 1 22 ILE H . . 4.890 3.891 3.646 4.164 . 0 0 "[ . 1 . 2]" 1
135 1 21 PHE HB3 1 22 ILE H . . 4.030 3.785 3.636 3.982 . 0 0 "[ . 1 . 2]" 1
136 1 22 ILE H 1 23 ILE MD . . 4.880 4.823 4.505 4.922 0.042 11 0 "[ . 1 . 2]" 1
137 1 22 ILE H 1 24 HIS H . . 4.790 4.044 3.737 4.279 . 0 0 "[ . 1 . 2]" 1
138 1 22 ILE H 1 23 ILE H . . 3.510 2.414 2.306 2.505 . 0 0 "[ . 1 . 2]" 1
139 1 22 ILE H 1 23 ILE HA . . 5.040 5.012 4.923 5.078 0.038 4 0 "[ . 1 . 2]" 1
140 1 20 LYS HA 1 22 ILE H . . 5.130 3.958 3.812 4.116 . 0 0 "[ . 1 . 2]" 1
141 1 21 PHE HB2 1 22 ILE H . . 4.100 2.975 2.828 3.122 . 0 0 "[ . 1 . 2]" 1
142 1 22 ILE H 1 22 ILE HB . . 3.330 2.404 2.373 2.448 . 0 0 "[ . 1 . 2]" 1
143 1 22 ILE H 1 23 ILE HG12 . . 5.060 4.143 3.941 4.257 . 0 0 "[ . 1 . 2]" 1
144 1 56 PHE HA 1 73 LEU H . . 4.490 3.262 2.760 3.772 . 0 0 "[ . 1 . 2]" 1
145 1 55 HIS HB3 1 73 LEU H . . 4.820 2.706 2.001 3.109 . 0 0 "[ . 1 . 2]" 1
146 1 55 HIS HB2 1 73 LEU H . . 4.760 4.408 3.732 4.787 0.027 1 0 "[ . 1 . 2]" 1
147 1 73 LEU H 1 73 LEU HG . . 4.710 4.279 4.174 4.372 . 0 0 "[ . 1 . 2]" 1
148 1 73 LEU H 1 73 LEU HB2 . . 3.950 2.778 2.656 2.912 . 0 0 "[ . 1 . 2]" 1
149 1 73 LEU H 1 80 LEU MD2 . . 5.050 2.903 2.598 3.252 . 0 0 "[ . 1 . 2]" 1
150 1 8 PRO QD 1 9 ARG H . . 5.190 4.827 4.460 5.029 . 0 0 "[ . 1 . 2]" 1
151 1 32 LEU H 1 33 ALA H . . 3.530 2.496 2.143 2.940 . 0 0 "[ . 1 . 2]" 1
152 1 33 ALA H 1 37 ASN HD21 . . 4.150 3.734 2.768 4.157 0.007 13 0 "[ . 1 . 2]" 1
153 1 32 LEU HA 1 33 ALA H . . 3.510 2.794 2.560 2.973 . 0 0 "[ . 1 . 2]" 1
154 1 33 ALA H 1 37 ASN QB . . 5.010 4.051 3.140 4.421 . 0 0 "[ . 1 . 2]" 1
155 1 32 LEU MD2 1 33 ALA H . . 4.620 4.522 4.274 4.625 0.005 2 0 "[ . 1 . 2]" 1
156 1 8 PRO HA 1 9 ARG H . . 2.910 2.342 2.152 2.596 . 0 0 "[ . 1 . 2]" 1
157 1 8 PRO HB2 1 9 ARG H . . 4.510 3.389 2.333 4.335 . 0 0 "[ . 1 . 2]" 1
158 1 8 PRO QG 1 9 ARG H . . 5.230 4.672 4.116 5.019 . 0 0 "[ . 1 . 2]" 1
159 1 8 PRO HB3 1 9 ARG H . . 4.340 3.863 3.228 4.544 0.204 10 0 "[ . 1 . 2]" 1
160 1 9 ARG H 1 9 ARG QB . . 3.400 2.634 2.058 3.297 . 0 0 "[ . 1 . 2]" 1
161 1 9 ARG H 1 9 ARG HG2 . . 4.070 3.522 2.554 4.092 0.022 3 0 "[ . 1 . 2]" 1
162 1 9 ARG H 1 9 ARG HG3 . . 4.080 3.611 3.003 4.075 . 0 0 "[ . 1 . 2]" 1
163 1 101 LYS H 1 112 ILE H . . 4.850 4.589 3.868 4.847 . 0 0 "[ . 1 . 2]" 1
164 1 101 LYS H 1 111 GLN HA . . 4.490 3.426 3.229 3.750 . 0 0 "[ . 1 . 2]" 1
165 1 100 TYR HB3 1 101 LYS H . . 4.080 2.714 2.409 2.972 . 0 0 "[ . 1 . 2]" 1
166 1 100 TYR HB2 1 101 LYS H . . 4.590 3.653 3.379 3.864 . 0 0 "[ . 1 . 2]" 1
167 1 101 LYS H 1 101 LYS HD3 . . 4.880 3.351 2.814 4.436 . 0 0 "[ . 1 . 2]" 1
168 1 18 SER HA 1 20 LYS H . . 4.770 4.054 3.551 4.725 . 0 0 "[ . 1 . 2]" 1
169 1 11 TYR H 1 11 TYR HB2 . . 3.450 2.625 1.958 3.768 0.318 15 0 "[ . 1 . 2]" 1
170 1 10 LEU MD1 1 11 TYR H . . 5.090 4.343 2.009 5.363 0.273 8 0 "[ . 1 . 2]" 1
171 1 9 ARG QB 1 11 TYR H . . 5.220 4.932 2.354 5.454 0.234 7 0 "[ . 1 . 2]" 1
172 1 10 LEU HB2 1 11 TYR H . . 4.320 4.044 2.141 4.518 0.198 20 0 "[ . 1 . 2]" 1
173 1 10 LEU HB3 1 11 TYR H . . 4.130 3.404 1.915 4.326 0.196 2 0 "[ . 1 . 2]" 1
174 1 73 LEU H 1 74 SER H . . 4.840 4.573 4.534 4.597 . 0 0 "[ . 1 . 2]" 1
175 1 73 LEU HB3 1 74 SER H . . 4.660 4.281 4.223 4.332 . 0 0 "[ . 1 . 2]" 1
176 1 73 LEU HB2 1 74 SER H . . 4.840 4.136 4.069 4.226 . 0 0 "[ . 1 . 2]" 1
177 1 74 SER H 1 80 LEU MD2 . . 4.920 4.112 3.931 4.444 . 0 0 "[ . 1 . 2]" 1
178 1 20 LYS H 1 56 PHE QD . . 4.940 4.028 3.672 4.470 . 0 0 "[ . 1 . 2]" 1
179 1 18 SER QB 1 20 LYS H . . 4.800 3.048 2.414 3.967 . 0 0 "[ . 1 . 2]" 1
180 1 20 LYS H 1 56 PHE QE . . 5.050 4.680 4.442 4.982 . 0 0 "[ . 1 . 2]" 1
181 1 20 LYS H 1 20 LYS HG3 . . 4.600 4.492 4.295 4.612 0.012 7 0 "[ . 1 . 2]" 1
182 1 104 SER H 1 105 ASP H . . 4.320 2.591 2.401 2.629 . 0 0 "[ . 1 . 2]" 1
183 1 105 ASP H 1 107 LYS H . . 4.300 2.911 2.756 3.325 . 0 0 "[ . 1 . 2]" 1
184 1 105 ASP H 1 106 ARG H . . 3.470 1.945 1.895 2.182 . 0 0 "[ . 1 . 2]" 1
185 1 105 ASP H 1 106 ARG HB2 . . 5.030 4.056 3.917 4.361 . 0 0 "[ . 1 . 2]" 1
186 1 130 LEU H 1 131 TRP H . . 3.720 2.870 2.540 3.168 . 0 0 "[ . 1 . 2]" 1
187 1 130 LEU H 1 130 LEU HB2 . . 3.690 2.256 2.082 2.677 . 0 0 "[ . 1 . 2]" 1
188 1 126 ILE MD 1 130 LEU H . . 4.960 4.630 4.348 4.946 . 0 0 "[ . 1 . 2]" 1
189 1 70 LEU H 1 84 ALA H . . 4.040 3.378 3.005 3.680 . 0 0 "[ . 1 . 2]" 1
190 1 67 PHE QE 1 70 LEU H . . 5.170 3.363 3.089 3.675 . 0 0 "[ . 1 . 2]" 1
191 1 67 PHE HZ 1 70 LEU H . . 4.670 2.257 1.942 2.746 . 0 0 "[ . 1 . 2]" 1
192 1 70 LEU H 1 85 GLY HA3 . . 5.190 3.533 3.159 3.764 . 0 0 "[ . 1 . 2]" 1
193 1 70 LEU H 1 70 LEU HB3 . . 3.830 2.476 2.435 2.518 . 0 0 "[ . 1 . 2]" 1
194 1 70 LEU H 1 70 LEU HB2 . . 3.270 2.731 2.583 2.931 . 0 0 "[ . 1 . 2]" 1
195 1 70 LEU H 1 70 LEU QD . . 4.130 3.689 3.573 3.813 . 0 0 "[ . 1 . 2]" 1
196 1 44 ILE MD 1 70 LEU H . . 4.840 3.917 3.297 4.418 . 0 0 "[ . 1 . 2]" 1
197 1 23 ILE H 1 24 HIS H . . 3.860 2.387 2.252 2.660 . 0 0 "[ . 1 . 2]" 1
198 1 24 HIS H 1 24 HIS HB3 . . 3.550 3.181 2.853 3.389 . 0 0 "[ . 1 . 2]" 1
199 1 24 HIS H 1 24 HIS HB2 . . 3.470 2.045 2.005 2.132 . 0 0 "[ . 1 . 2]" 1
200 1 24 HIS H 1 25 ASN HB2 . . 5.040 4.821 4.629 4.944 . 0 0 "[ . 1 . 2]" 1
201 1 23 ILE HB 1 24 HIS H . . 3.960 2.695 2.538 2.914 . 0 0 "[ . 1 . 2]" 1
202 1 24 HIS H 1 48 ILE MD . . 5.190 4.172 3.904 4.473 . 0 0 "[ . 1 . 2]" 1
203 1 40 GLN HG2 1 41 LYS H . . 4.630 2.844 2.500 3.232 . 0 0 "[ . 1 . 2]" 1
204 1 41 LYS H 1 41 LYS HB3 . . 3.670 2.424 2.175 2.472 . 0 0 "[ . 1 . 2]" 1
205 1 32 LEU HB3 1 41 LYS H . . 4.720 3.898 3.404 4.153 . 0 0 "[ . 1 . 2]" 1
206 1 41 LYS H 1 41 LYS HG2 . . 4.740 4.355 4.119 4.391 . 0 0 "[ . 1 . 2]" 1
207 1 41 LYS H 1 43 ARG H . . 5.020 4.338 4.157 4.440 . 0 0 "[ . 1 . 2]" 1
208 1 40 GLN HB3 1 41 LYS H . . 3.890 2.653 2.579 2.754 . 0 0 "[ . 1 . 2]" 1
209 1 41 LYS H 1 41 LYS HB2 . . 3.700 2.548 2.489 2.837 . 0 0 "[ . 1 . 2]" 1
210 1 41 LYS H 1 41 LYS HG3 . . 5.030 4.476 4.443 4.584 . 0 0 "[ . 1 . 2]" 1
211 1 17 LYS H 1 17 LYS QG . . 4.260 3.944 2.178 4.262 0.002 20 0 "[ . 1 . 2]" 1
212 1 17 LYS H 1 18 SER QB . . 5.030 4.491 3.289 4.943 . 0 0 "[ . 1 . 2]" 1
213 1 17 LYS H 1 17 LYS QB . . 3.570 2.758 2.515 2.999 . 0 0 "[ . 1 . 2]" 1
214 1 16 ALA MB 1 17 LYS H . . 3.650 2.943 1.909 3.648 . 0 0 "[ . 1 . 2]" 1
215 1 86 TYR H 1 87 GLY H . . 4.850 3.901 1.893 4.522 . 0 0 "[ . 1 . 2]" 1
216 1 86 TYR H 1 86 TYR QD . . 4.480 4.073 1.945 4.441 . 0 0 "[ . 1 . 2]" 1
217 1 43 ARG H 1 44 ILE H . . 3.440 2.746 2.632 2.841 . 0 0 "[ . 1 . 2]" 1
218 1 40 GLN HA 1 43 ARG H . . 4.020 3.153 3.064 3.266 . 0 0 "[ . 1 . 2]" 1
219 1 42 ASN HB2 1 43 ARG H . . 3.830 2.577 2.477 2.668 . 0 0 "[ . 1 . 2]" 1
220 1 43 ARG H 1 43 ARG HB2 . . 3.290 2.367 2.264 2.481 . 0 0 "[ . 1 . 2]" 1
221 1 43 ARG H 1 43 ARG HB3 . . 3.380 3.535 3.508 3.550 0.170 9 0 "[ . 1 . 2]" 1
222 1 43 ARG H 1 43 ARG HG2 . . 3.660 2.584 2.513 2.682 . 0 0 "[ . 1 . 2]" 1
223 1 43 ARG H 1 44 ILE QG . . 4.760 3.994 3.883 4.257 . 0 0 "[ . 1 . 2]" 1
224 1 100 TYR H 1 123 ALA H . . 3.950 3.066 2.861 3.235 . 0 0 "[ . 1 . 2]" 1
225 1 123 ALA H 1 124 PHE QD . . 4.930 4.371 4.067 4.840 . 0 0 "[ . 1 . 2]" 1
226 1 44 ILE H 1 45 LEU H . . 3.560 2.589 2.330 2.748 . 0 0 "[ . 1 . 2]" 1
227 1 44 ILE H 1 44 ILE HB . . 3.330 2.565 2.457 2.651 . 0 0 "[ . 1 . 2]" 1
228 1 90 THR MG 1 92 THR H . . 4.910 4.237 3.869 4.654 . 0 0 "[ . 1 . 2]" 1
229 1 122 ASP H 1 123 ALA H . . 3.340 1.977 1.883 2.251 . 0 0 "[ . 1 . 2]" 1
230 1 101 LYS HA 1 123 ALA H . . 4.240 3.900 3.500 4.239 . 0 0 "[ . 1 . 2]" 1
231 1 122 ASP HB3 1 123 ALA H . . 4.650 4.293 4.194 4.481 . 0 0 "[ . 1 . 2]" 1
232 1 100 TYR HB2 1 123 ALA H . . 4.740 3.850 3.488 4.166 . 0 0 "[ . 1 . 2]" 1
233 1 122 ASP HB2 1 123 ALA H . . 4.390 3.933 3.660 4.154 . 0 0 "[ . 1 . 2]" 1
234 1 121 VAL HB 1 123 ALA H . . 5.190 4.337 4.175 4.543 . 0 0 "[ . 1 . 2]" 1
235 1 99 ILE MG 1 123 ALA H . . 5.080 4.424 4.249 4.579 . 0 0 "[ . 1 . 2]" 1
236 1 54 ASN H 1 55 HIS H . . 3.300 2.020 1.890 2.816 . 0 0 "[ . 1 . 2]" 1
237 1 55 HIS H 1 55 HIS HB3 . . 3.950 2.761 2.531 3.009 . 0 0 "[ . 1 . 2]" 1
238 1 55 HIS H 1 55 HIS HB2 . . 3.880 2.793 2.344 3.210 . 0 0 "[ . 1 . 2]" 1
239 1 109 PHE H 1 109 PHE QD . . 3.710 3.416 2.367 3.645 . 0 0 "[ . 1 . 2]" 1
240 1 109 PHE H 1 109 PHE HB2 . . 3.710 2.255 2.137 2.401 . 0 0 "[ . 1 . 2]" 1
241 1 109 PHE H 1 109 PHE HB3 . . 4.070 3.382 3.149 3.533 . 0 0 "[ . 1 . 2]" 1
242 1 108 ARG HB3 1 109 PHE H . . 3.820 2.153 1.929 3.698 . 0 0 "[ . 1 . 2]" 1
243 1 76 GLU H 1 77 THR H . . 3.360 2.451 2.251 2.615 . 0 0 "[ . 1 . 2]" 1
244 1 75 GLY QA 1 76 GLU H . . 3.370 2.931 2.860 2.987 . 0 0 "[ . 1 . 2]" 1
245 1 76 GLU H 1 76 GLU HB2 . . 3.810 3.568 3.523 3.611 . 0 0 "[ . 1 . 2]" 1
246 1 76 GLU H 1 76 GLU HB3 . . 3.460 2.651 2.537 2.821 . 0 0 "[ . 1 . 2]" 1
247 1 61 ARG H 1 62 ASP H . . 3.990 2.642 2.142 3.587 . 0 0 "[ . 1 . 2]" 1
248 1 60 PHE HB3 1 61 ARG H . . 4.240 2.370 1.986 3.248 . 0 0 "[ . 1 . 2]" 1
249 1 61 ARG H 1 61 ARG HD2 . . 5.050 4.861 4.287 5.747 0.697 8 1 "[ . + 1 . 2]" 1
250 1 61 ARG H 1 68 ARG HG2 . . 4.330 3.823 2.856 4.273 . 0 0 "[ . 1 . 2]" 1
251 1 61 ARG H 1 61 ARG HB3 . . 3.800 2.915 2.450 3.519 . 0 0 "[ . 1 . 2]" 1
252 1 61 ARG H 1 61 ARG HG3 . . 4.540 4.312 3.538 4.676 0.136 15 0 "[ . 1 . 2]" 1
253 1 25 ASN H 1 26 ALA H . . 3.590 2.375 2.217 2.585 . 0 0 "[ . 1 . 2]" 1
254 1 24 HIS H 1 25 ASN H . . 3.620 2.883 2.745 3.032 . 0 0 "[ . 1 . 2]" 1
255 1 24 HIS HB3 1 25 ASN H . . 3.710 3.067 2.701 3.467 . 0 0 "[ . 1 . 2]" 1
256 1 24 HIS HB2 1 25 ASN H . . 3.790 3.432 3.068 3.742 . 0 0 "[ . 1 . 2]" 1
257 1 25 ASN H 1 25 ASN HB3 . . 3.570 3.421 3.340 3.491 . 0 0 "[ . 1 . 2]" 1
258 1 25 ASN H 1 25 ASN HB2 . . 3.390 2.141 2.084 2.218 . 0 0 "[ . 1 . 2]" 1
259 1 131 TRP H 1 132 GLN H . . 3.600 2.925 2.471 3.244 . 0 0 "[ . 1 . 2]" 1
260 1 131 TRP HD1 1 132 GLN H . . 4.800 4.373 3.929 4.760 . 0 0 "[ . 1 . 2]" 1
261 1 128 GLY HA2 1 132 GLN H . . 4.640 4.461 4.059 4.658 0.018 5 0 "[ . 1 . 2]" 1
262 1 131 TRP HB2 1 132 GLN H . . 4.640 2.315 1.980 2.636 . 0 0 "[ . 1 . 2]" 1
263 1 132 GLN H 1 132 GLN HB3 . . 3.550 3.244 2.508 3.520 . 0 0 "[ . 1 . 2]" 1
264 1 45 LEU HA 1 49 GLU H . . 5.090 4.169 3.928 4.361 . 0 0 "[ . 1 . 2]" 1
265 1 49 GLU H 1 50 LYS HB3 . . 4.810 4.507 4.294 4.726 . 0 0 "[ . 1 . 2]" 1
266 1 44 ILE H 1 46 GLU H . . 4.220 3.958 3.627 4.137 . 0 0 "[ . 1 . 2]" 1
267 1 45 LEU HB3 1 46 GLU H . . 4.180 3.636 3.411 3.881 . 0 0 "[ . 1 . 2]" 1
268 1 45 LEU QD 1 46 GLU H . . 4.720 3.898 3.565 4.207 . 0 0 "[ . 1 . 2]" 1
269 1 63 SER H 1 64 SER H . . 4.500 3.454 1.896 4.506 0.006 20 0 "[ . 1 . 2]" 1
270 1 64 SER H 1 65 CYS H . . 3.690 2.687 1.898 3.629 . 0 0 "[ . 1 . 2]" 1
271 1 64 SER H 1 64 SER HB3 . . 4.110 3.386 2.453 3.978 . 0 0 "[ . 1 . 2]" 1
272 1 97 GLU H 1 127 GLN H . . 4.870 3.917 3.591 4.330 . 0 0 "[ . 1 . 2]" 1
273 1 127 GLN H 1 127 GLN HB3 . . 4.050 3.443 3.390 3.540 . 0 0 "[ . 1 . 2]" 1
274 1 25 ASN H 1 25 ASN HD21 . . 4.520 3.369 2.523 4.405 . 0 0 "[ . 1 . 2]" 1
275 1 48 ILE H 1 49 GLU H . . 3.590 2.750 2.676 2.885 . 0 0 "[ . 1 . 2]" 1
276 1 49 GLU H 1 50 LYS H . . 3.740 2.626 2.522 2.795 . 0 0 "[ . 1 . 2]" 1
277 1 45 LEU H 1 46 GLU H . . 3.730 2.851 2.547 2.967 . 0 0 "[ . 1 . 2]" 1
278 1 46 GLU H 1 47 GLU H . . 3.420 2.800 2.599 2.989 . 0 0 "[ . 1 . 2]" 1
279 1 46 GLU H 1 46 GLU QB . . 3.230 2.521 2.252 2.623 . 0 0 "[ . 1 . 2]" 1
280 1 45 LEU HB2 1 46 GLU H . . 3.910 2.690 2.545 2.904 . 0 0 "[ . 1 . 2]" 1
281 1 43 ARG H 1 45 LEU H . . 4.660 4.439 4.072 4.691 0.031 18 0 "[ . 1 . 2]" 1
282 1 45 LEU H 1 45 LEU HB2 . . 3.760 2.439 2.314 2.568 . 0 0 "[ . 1 . 2]" 1
283 1 44 ILE HB 1 45 LEU H . . 3.770 2.461 2.234 2.871 . 0 0 "[ . 1 . 2]" 1
284 1 45 LEU H 1 45 LEU HG . . 3.630 2.956 1.957 3.946 0.316 14 0 "[ . 1 . 2]" 1
285 1 45 LEU H 1 45 LEU HB3 . . 3.920 3.531 3.514 3.555 . 0 0 "[ . 1 . 2]" 1
286 1 45 LEU H 1 45 LEU QD . . 3.830 2.431 1.807 3.021 . 0 0 "[ . 1 . 2]" 1
287 1 77 THR H 1 78 GLU H . . 4.050 4.081 4.053 4.149 0.099 17 0 "[ . 1 . 2]" 1
288 1 78 GLU H 1 78 GLU HG3 . . 3.930 2.743 1.928 2.965 . 0 0 "[ . 1 . 2]" 1
289 1 47 GLU HG3 1 48 ILE H . . 5.050 4.949 4.410 5.076 0.026 15 0 "[ . 1 . 2]" 1
290 1 96 VAL H 1 97 GLU H . . 4.970 4.575 4.490 4.640 . 0 0 "[ . 1 . 2]" 1
291 1 95 MET H 1 96 VAL H . . 3.400 2.138 1.934 2.314 . 0 0 "[ . 1 . 2]" 1
292 1 96 VAL H 1 96 VAL HB . . 3.140 2.306 2.172 2.436 . 0 0 "[ . 1 . 2]" 1
293 1 93 PRO HB2 1 96 VAL H . . 5.190 5.212 5.153 5.284 0.094 10 0 "[ . 1 . 2]" 1
294 1 96 VAL H 1 117 MET ME . . 5.230 5.133 4.930 5.245 0.015 8 0 "[ . 1 . 2]" 1
295 1 94 ALA MB 1 96 VAL H . . 4.670 4.578 4.418 4.696 0.026 3 0 "[ . 1 . 2]" 1
296 1 121 VAL H 1 121 VAL QG . . 3.540 2.810 2.429 3.037 . 0 0 "[ . 1 . 2]" 1
297 1 131 TRP H 1 131 TRP HD1 . . 3.460 2.868 2.559 3.257 . 0 0 "[ . 1 . 2]" 1
298 1 129 HIS HA 1 131 TRP H . . 4.860 4.657 4.052 4.866 0.006 12 0 "[ . 1 . 2]" 1
299 1 131 TRP H 1 131 TRP HB2 . . 3.910 2.524 2.290 2.711 . 0 0 "[ . 1 . 2]" 1
300 1 131 TRP H 1 131 TRP HB3 . . 3.560 3.540 3.516 3.553 . 0 0 "[ . 1 . 2]" 1
301 1 130 LEU HB2 1 131 TRP H . . 4.470 2.561 2.234 2.900 . 0 0 "[ . 1 . 2]" 1
302 1 68 ARG H 1 69 ALA H . . 3.340 1.963 1.884 2.189 . 0 0 "[ . 1 . 2]" 1
303 1 67 PHE QE 1 69 ALA H . . 4.520 3.690 3.399 4.125 . 0 0 "[ . 1 . 2]" 1
304 1 69 ALA H 1 71 TYR QE . . 5.170 4.325 3.807 4.869 . 0 0 "[ . 1 . 2]" 1
305 1 67 PHE HA 1 69 ALA H . . 4.080 3.828 3.526 4.090 0.010 20 0 "[ . 1 . 2]" 1
306 1 68 ARG HB3 1 69 ALA H . . 3.760 3.424 2.492 3.977 0.217 16 0 "[ . 1 . 2]" 1
307 1 59 LEU HB3 1 69 ALA H . . 4.110 2.481 2.044 2.834 . 0 0 "[ . 1 . 2]" 1
308 1 58 ILE MG 1 69 ALA H . . 4.430 3.761 3.288 4.294 . 0 0 "[ . 1 . 2]" 1
309 1 59 LEU H 1 69 ALA H . . 3.830 2.929 2.590 3.257 . 0 0 "[ . 1 . 2]" 1
310 1 69 ALA H 1 70 LEU HA . . 5.080 4.400 4.332 4.481 . 0 0 "[ . 1 . 2]" 1
311 1 59 LEU HG 1 69 ALA H . . 4.620 4.329 3.951 4.603 . 0 0 "[ . 1 . 2]" 1
312 1 47 GLU H 1 48 ILE H . . 3.550 2.942 2.604 3.095 . 0 0 "[ . 1 . 2]" 1
313 1 46 GLU QB 1 47 GLU H . . 3.840 2.462 2.034 3.518 . 0 0 "[ . 1 . 2]" 1
314 1 47 GLU H 1 47 GLU HB2 . . 3.400 2.376 2.231 2.625 . 0 0 "[ . 1 . 2]" 1
315 1 47 GLU H 1 84 ALA MB . . 4.770 4.752 4.663 4.803 0.033 5 0 "[ . 1 . 2]" 1
316 1 56 PHE H 1 57 LEU H . . 5.170 4.360 4.097 4.533 . 0 0 "[ . 1 . 2]" 1
317 1 57 LEU H 1 70 LEU HA . . 5.070 4.704 4.321 5.070 . 0 0 "[ . 1 . 2]" 1
318 1 57 LEU H 1 57 LEU MD2 . . 4.750 4.588 4.351 4.877 0.127 18 0 "[ . 1 . 2]" 1
319 1 25 ASN H 1 27 LEU H . . 5.180 3.873 3.720 4.069 . 0 0 "[ . 1 . 2]" 1
320 1 27 LEU H 1 27 LEU HG . . 3.560 2.215 2.069 2.299 . 0 0 "[ . 1 . 2]" 1
321 1 27 LEU H 1 27 LEU HB3 . . 3.730 3.557 3.544 3.565 . 0 0 "[ . 1 . 2]" 1
322 1 26 ALA MB 1 27 LEU H . . 3.670 2.770 2.609 2.912 . 0 0 "[ . 1 . 2]" 1
323 1 27 LEU H 1 58 ILE MD . . 4.700 4.343 4.036 4.702 0.002 20 0 "[ . 1 . 2]" 1
324 1 27 LEU H 1 27 LEU HB2 . . 4.080 2.524 2.469 2.607 . 0 0 "[ . 1 . 2]" 1
325 1 57 LEU H 1 58 ILE H . . 5.190 4.452 4.224 4.560 . 0 0 "[ . 1 . 2]" 1
326 1 57 LEU H 1 71 TYR H . . 4.070 2.859 2.684 3.076 . 0 0 "[ . 1 . 2]" 1
327 1 56 PHE QD 1 57 LEU H . . 5.060 4.096 3.524 4.682 . 0 0 "[ . 1 . 2]" 1
328 1 56 PHE HB3 1 57 LEU H . . 4.020 3.078 2.312 3.659 . 0 0 "[ . 1 . 2]" 1
329 1 56 PHE HB2 1 57 LEU H . . 4.490 4.057 3.512 4.454 . 0 0 "[ . 1 . 2]" 1
330 1 57 LEU H 1 70 LEU HG . . 4.990 4.320 3.421 5.083 0.093 18 0 "[ . 1 . 2]" 1
331 1 57 LEU H 1 57 LEU HG . . 4.860 4.067 3.756 4.308 . 0 0 "[ . 1 . 2]" 1
332 1 57 LEU H 1 57 LEU HB2 . . 4.100 2.533 2.289 2.893 . 0 0 "[ . 1 . 2]" 1
333 1 57 LEU H 1 72 THR MG . . 5.040 4.352 3.935 4.566 . 0 0 "[ . 1 . 2]" 1
334 1 100 TYR H 1 100 TYR QD . . 3.780 2.413 2.250 2.548 . 0 0 "[ . 1 . 2]" 1
335 1 99 ILE HB 1 100 TYR H . . 4.090 2.912 2.715 3.319 . 0 0 "[ . 1 . 2]" 1
336 1 99 ILE MD 1 100 TYR H . . 5.060 4.752 4.596 5.070 0.010 11 0 "[ . 1 . 2]" 1
337 1 100 TYR H 1 123 ALA MB . . 4.750 3.386 3.204 3.534 . 0 0 "[ . 1 . 2]" 1
338 1 26 ALA MB 1 30 CYS H . . 5.040 4.900 4.823 4.990 . 0 0 "[ . 1 . 2]" 1
339 1 29 HIS HB2 1 30 CYS H . . 4.410 2.909 2.814 3.053 . 0 0 "[ . 1 . 2]" 1
340 1 79 GLU H 1 80 LEU H . . 4.570 4.626 4.605 4.646 0.076 8 0 "[ . 1 . 2]" 1
341 1 78 GLU H 1 79 GLU H . . 3.630 1.913 1.881 1.981 . 0 0 "[ . 1 . 2]" 1
342 1 77 THR HA 1 79 GLU H . . 4.510 4.477 4.442 4.497 . 0 0 "[ . 1 . 2]" 1
343 1 79 GLU H 1 79 GLU HG3 . . 3.610 3.635 3.617 3.648 0.038 5 0 "[ . 1 . 2]" 1
344 1 79 GLU H 1 79 GLU HG2 . . 3.950 3.949 3.887 3.974 0.024 8 0 "[ . 1 . 2]" 1
345 1 79 GLU H 1 79 GLU HB2 . . 3.420 2.305 2.265 2.336 . 0 0 "[ . 1 . 2]" 1
346 1 40 GLN H 1 41 LYS H . . 3.620 2.725 2.598 2.903 . 0 0 "[ . 1 . 2]" 1
347 1 39 PRO HD2 1 40 GLN H . . 4.150 2.295 2.256 2.430 . 0 0 "[ . 1 . 2]" 1
348 1 40 GLN H 1 40 GLN HG3 . . 4.080 4.326 4.313 4.355 0.275 18 0 "[ . 1 . 2]" 1
349 1 40 GLN H 1 40 GLN HG2 . . 4.140 4.089 3.878 4.171 0.031 5 0 "[ . 1 . 2]" 1
350 1 39 PRO HB2 1 40 GLN H . . 3.680 3.138 2.830 3.280 . 0 0 "[ . 1 . 2]" 1
351 1 35 LYS H 1 36 VAL H . . 4.740 2.384 2.115 2.967 . 0 0 "[ . 1 . 2]" 1
352 1 36 VAL H 1 38 GLU H . . 4.950 4.154 3.793 4.487 . 0 0 "[ . 1 . 2]" 1
353 1 36 VAL H 1 37 ASN H . . 3.720 2.689 2.494 2.954 . 0 0 "[ . 1 . 2]" 1
354 1 114 ALA H 1 115 LYS H . . 4.550 4.524 4.472 4.587 0.037 8 0 "[ . 1 . 2]" 1
355 1 115 LYS H 1 115 LYS HB2 . . 3.670 2.304 2.248 2.365 . 0 0 "[ . 1 . 2]" 1
356 1 114 ALA MB 1 115 LYS H . . 3.300 2.669 2.480 2.837 . 0 0 "[ . 1 . 2]" 1
357 1 99 ILE MD 1 115 LYS H . . 4.640 3.600 3.417 3.704 . 0 0 "[ . 1 . 2]" 1
358 1 103 ASN HB2 1 107 LYS H . . 4.830 3.887 3.274 4.257 . 0 0 "[ . 1 . 2]" 1
359 1 107 LYS H 1 107 LYS HG3 . . 3.920 2.901 2.303 4.122 0.202 19 0 "[ . 1 . 2]" 1
360 1 70 LEU HB3 1 84 ALA H . . 4.120 3.431 3.095 3.666 . 0 0 "[ . 1 . 2]" 1
361 1 83 LEU QB 1 84 ALA H . . 3.810 2.290 2.237 2.429 . 0 0 "[ . 1 . 2]" 1
362 1 82 ARG HG2 1 84 ALA H . . 4.280 3.553 3.285 4.563 0.283 13 0 "[ . 1 . 2]" 1
363 1 71 TYR HB3 1 81 SER H . . 4.810 3.176 2.715 3.840 . 0 0 "[ . 1 . 2]" 1
364 1 80 LEU HB2 1 81 SER H . . 4.720 3.616 3.085 4.377 . 0 0 "[ . 1 . 2]" 1
365 1 135 LYS HB3 1 136 SER H . . 4.820 3.435 2.027 4.563 . 0 0 "[ . 1 . 2]" 1
366 1 135 LYS HB2 1 136 SER H . . 5.160 4.265 3.377 4.738 . 0 0 "[ . 1 . 2]" 1
367 1 132 GLN H 1 133 SER H . . 4.750 3.900 2.961 4.674 . 0 0 "[ . 1 . 2]" 1
368 1 132 GLN HB3 1 133 SER H . . 4.870 3.409 2.447 4.703 . 0 0 "[ . 1 . 2]" 1
369 1 83 LEU H 1 84 ALA H . . 3.530 2.681 2.369 2.817 . 0 0 "[ . 1 . 2]" 1
370 1 83 LEU MD1 1 84 ALA H . . 4.640 4.320 4.256 4.447 . 0 0 "[ . 1 . 2]" 1
371 1 140 SER HA 1 141 GLY H . . 3.600 2.626 2.216 3.643 0.043 8 0 "[ . 1 . 2]" 1
372 1 140 SER QB 1 141 GLY H . . 4.920 3.144 2.362 4.101 . 0 0 "[ . 1 . 2]" 1
373 1 94 ALA H 1 96 VAL H . . 4.940 3.711 3.625 3.801 . 0 0 "[ . 1 . 2]" 1
374 1 92 THR HA 1 94 ALA H . . 4.950 3.918 3.887 3.951 . 0 0 "[ . 1 . 2]" 1
375 1 93 PRO HD2 1 94 ALA H . . 4.450 2.552 2.519 2.597 . 0 0 "[ . 1 . 2]" 1
376 1 93 PRO HG2 1 94 ALA H . . 3.600 3.654 3.606 3.716 0.116 17 0 "[ . 1 . 2]" 1
377 1 94 ALA H 1 96 VAL QG . . 4.940 4.106 3.816 4.363 . 0 0 "[ . 1 . 2]" 1
378 1 60 PHE QD 1 66 GLN H . . 5.180 2.827 2.164 4.723 . 0 0 "[ . 1 . 2]" 1
379 1 66 GLN H 1 66 GLN HB3 . . 3.610 3.614 2.715 3.903 0.293 10 0 "[ . 1 . 2]" 1
380 1 65 CYS HB3 1 66 GLN H . . 4.870 3.259 1.881 4.461 . 0 0 "[ . 1 . 2]" 1
381 1 66 GLN H 1 67 PHE H . . 5.050 4.184 3.369 4.611 . 0 0 "[ . 1 . 2]" 1
382 1 21 PHE H 1 22 ILE H . . 3.490 2.643 2.592 2.687 . 0 0 "[ . 1 . 2]" 1
383 1 21 PHE H 1 22 ILE HB . . 4.860 4.861 4.794 4.900 0.040 16 0 "[ . 1 . 2]" 1
384 1 20 LYS HB3 1 21 PHE H . . 3.940 2.672 2.534 2.837 . 0 0 "[ . 1 . 2]" 1
385 1 21 PHE H 1 22 ILE HG13 . . 5.190 3.937 3.784 4.116 . 0 0 "[ . 1 . 2]" 1
386 1 21 PHE H 1 22 ILE MD . . 5.010 4.787 4.655 5.017 0.007 6 0 "[ . 1 . 2]" 1
387 1 20 LYS HG2 1 21 PHE H . . 4.850 3.481 3.023 3.694 . 0 0 "[ . 1 . 2]" 1
388 1 20 LYS HG3 1 21 PHE H . . 4.740 4.513 3.668 4.871 0.131 1 0 "[ . 1 . 2]" 1
389 1 117 MET HG3 1 118 SER H . . 4.560 3.750 2.832 4.671 0.111 11 0 "[ . 1 . 2]" 1
390 1 117 MET HB2 1 118 SER H . . 4.910 4.083 3.733 4.624 . 0 0 "[ . 1 . 2]" 1
391 1 117 MET HB3 1 118 SER H . . 4.650 2.798 2.275 3.793 . 0 0 "[ . 1 . 2]" 1
392 1 109 PHE H 1 110 THR H . . 4.490 4.479 4.407 4.554 0.064 6 0 "[ . 1 . 2]" 1
393 1 103 ASN H 1 110 THR H . . 5.090 3.986 3.600 4.285 . 0 0 "[ . 1 . 2]" 1
394 1 100 TYR QD 1 110 THR H . . 4.700 4.670 4.374 4.733 0.033 5 0 "[ . 1 . 2]" 1
395 1 109 PHE HB2 1 110 THR H . . 4.450 4.320 3.756 4.471 0.021 11 0 "[ . 1 . 2]" 1
396 1 109 PHE HB3 1 110 THR H . . 4.180 3.212 2.434 3.489 . 0 0 "[ . 1 . 2]" 1
397 1 109 PHE QD 1 110 THR H . . 4.570 3.583 3.065 4.076 . 0 0 "[ . 1 . 2]" 1
398 1 58 ILE H 1 124 PHE H . . 4.450 3.509 3.140 3.918 . 0 0 "[ . 1 . 2]" 1
399 1 123 ALA H 1 124 PHE H . . 5.000 4.180 4.090 4.331 . 0 0 "[ . 1 . 2]" 1
400 1 60 PHE H 1 124 PHE H . . 4.530 4.210 3.766 4.531 0.001 9 0 "[ . 1 . 2]" 1
401 1 124 PHE H 1 124 PHE QD . . 3.570 2.008 1.939 2.230 . 0 0 "[ . 1 . 2]" 1
402 1 124 PHE H 1 124 PHE QE . . 5.080 4.057 3.915 4.262 . 0 0 "[ . 1 . 2]" 1
403 1 123 ALA HA 1 124 PHE H . . 3.360 2.301 2.241 2.439 . 0 0 "[ . 1 . 2]" 1
404 1 124 PHE H 1 125 THR MG . . 4.870 3.708 3.436 4.089 . 0 0 "[ . 1 . 2]" 1
405 1 59 LEU MD1 1 124 PHE H . . 4.640 4.587 4.279 4.654 0.014 1 0 "[ . 1 . 2]" 1
406 1 41 LYS HG2 1 42 ASN H . . 4.710 3.233 2.443 3.753 . 0 0 "[ . 1 . 2]" 1
407 1 41 LYS H 1 42 ASN H . . 3.710 3.102 3.015 3.206 . 0 0 "[ . 1 . 2]" 1
408 1 40 GLN H 1 42 ASN H . . 4.720 4.353 4.146 4.607 . 0 0 "[ . 1 . 2]" 1
409 1 42 ASN H 1 43 ARG H . . 3.620 2.828 2.729 2.887 . 0 0 "[ . 1 . 2]" 1
410 1 42 ASN H 1 42 ASN HD21 . . 4.620 2.420 2.238 2.607 . 0 0 "[ . 1 . 2]" 1
411 1 38 GLU HA 1 42 ASN H . . 4.430 4.250 4.143 4.524 0.094 16 0 "[ . 1 . 2]" 1
412 1 42 ASN H 1 42 ASN HB2 . . 3.450 2.249 2.199 2.385 . 0 0 "[ . 1 . 2]" 1
413 1 38 GLU HG2 1 42 ASN H . . 5.140 4.828 4.692 5.456 0.316 16 0 "[ . 1 . 2]" 1
414 1 41 LYS HB3 1 42 ASN H . . 3.740 2.568 2.454 2.730 . 0 0 "[ . 1 . 2]" 1
415 1 41 LYS QD 1 42 ASN H . . 5.160 4.538 2.919 4.844 . 0 0 "[ . 1 . 2]" 1
416 1 41 LYS HG3 1 42 ASN H . . 5.150 4.496 3.942 4.745 . 0 0 "[ . 1 . 2]" 1
417 1 42 ASN H 1 45 LEU QD . . 4.930 3.561 3.282 3.883 . 0 0 "[ . 1 . 2]" 1
418 1 58 ILE HB 1 124 PHE H . . 4.950 4.337 3.954 4.633 . 0 0 "[ . 1 . 2]" 1
419 1 31 CYS H 1 32 LEU H . . 3.790 2.941 2.871 3.027 . 0 0 "[ . 1 . 2]" 1
420 1 30 CYS H 1 31 CYS H . . 3.530 1.888 1.874 1.907 . 0 0 "[ . 1 . 2]" 1
421 1 26 ALA HA 1 31 CYS H . . 4.980 4.483 4.373 4.634 . 0 0 "[ . 1 . 2]" 1
422 1 30 CYS HB2 1 31 CYS H . . 3.540 3.388 3.009 3.912 0.372 18 0 "[ . 1 . 2]" 1
423 1 26 ALA MB 1 31 CYS H . . 4.770 4.424 4.305 4.611 . 0 0 "[ . 1 . 2]" 1
424 1 27 LEU MD2 1 31 CYS H . . 4.850 4.633 4.464 4.776 . 0 0 "[ . 1 . 2]" 1
425 1 139 SER H 1 140 SER QB . . 4.880 4.287 3.804 4.881 0.001 14 0 "[ . 1 . 2]" 1
426 1 15 SER H 1 16 ALA H . . 4.330 3.628 2.875 4.331 0.001 3 0 "[ . 1 . 2]" 1
427 1 14 PRO HA 1 15 SER H . . 2.990 2.635 2.464 3.239 0.249 3 0 "[ . 1 . 2]" 1
428 1 15 SER H 1 15 SER HB2 . . 3.640 2.967 2.051 3.729 0.089 1 0 "[ . 1 . 2]" 1
429 1 14 PRO HB2 1 15 SER H . . 4.240 2.413 1.928 4.035 . 0 0 "[ . 1 . 2]" 1
430 1 14 PRO HG2 1 15 SER H . . 4.670 4.354 3.876 4.667 . 0 0 "[ . 1 . 2]" 1
431 1 14 PRO HB3 1 15 SER H . . 4.350 3.304 3.095 4.615 0.265 3 0 "[ . 1 . 2]" 1
432 1 106 ARG H 1 107 LYS HA . . 4.420 4.323 4.148 4.427 0.007 4 0 "[ . 1 . 2]" 1
433 1 103 ASN HB3 1 106 ARG H . . 4.940 2.095 1.954 2.414 . 0 0 "[ . 1 . 2]" 1
434 1 106 ARG H 1 107 LYS H . . 3.240 2.174 2.028 2.300 . 0 0 "[ . 1 . 2]" 1
435 1 106 ARG H 1 108 ARG H . . 4.510 3.584 3.248 3.809 . 0 0 "[ . 1 . 2]" 1
436 1 106 ARG H 1 106 ARG QD . . 4.690 4.624 4.359 4.713 0.023 17 0 "[ . 1 . 2]" 1
437 1 106 ARG H 1 106 ARG HB3 . . 3.640 3.515 3.448 3.635 . 0 0 "[ . 1 . 2]" 1
438 1 50 LYS H 1 50 LYS HB3 . . 3.480 2.158 2.085 2.301 . 0 0 "[ . 1 . 2]" 1
439 1 50 LYS H 1 50 LYS HG2 . . 3.730 3.009 2.927 3.117 . 0 0 "[ . 1 . 2]" 1
440 1 36 VAL QG 1 37 ASN H . . 3.330 2.144 1.908 2.914 . 0 0 "[ . 1 . 2]" 1
441 1 17 LYS QB 1 18 SER H . . 4.490 3.766 1.972 4.128 . 0 0 "[ . 1 . 2]" 1
442 1 17 LYS QG 1 18 SER H . . 5.200 3.705 2.036 4.822 . 0 0 "[ . 1 . 2]" 1
443 1 16 ALA MB 1 18 SER H . . 5.080 4.317 3.407 5.171 0.091 19 0 "[ . 1 . 2]" 1
444 1 95 MET H 1 130 LEU QD . . 4.750 4.569 4.475 4.629 . 0 0 "[ . 1 . 2]" 1
445 1 95 MET H 1 96 VAL HB . . 4.280 4.158 3.910 4.310 0.030 1 0 "[ . 1 . 2]" 1
446 1 36 VAL QG 1 37 ASN HD22 . . 4.980 3.355 2.881 3.747 . 0 0 "[ . 1 . 2]" 1
447 1 125 THR H 1 126 ILE H . . 4.980 4.205 4.043 4.419 . 0 0 "[ . 1 . 2]" 1
448 1 126 ILE H 1 126 ILE HG12 . . 4.400 2.044 1.949 2.178 . 0 0 "[ . 1 . 2]" 1
449 1 126 ILE H 1 126 ILE HG13 . . 3.950 2.964 2.471 3.335 . 0 0 "[ . 1 . 2]" 1
450 1 116 THR H 1 117 MET H . . 4.640 4.537 4.510 4.575 . 0 0 "[ . 1 . 2]" 1
451 1 115 LYS H 1 116 THR H . . 3.460 2.218 2.138 2.317 . 0 0 "[ . 1 . 2]" 1
452 1 115 LYS HB3 1 116 THR H . . 4.080 4.074 4.042 4.104 0.024 3 0 "[ . 1 . 2]" 1
453 1 115 LYS HB2 1 116 THR H . . 4.040 3.985 3.892 4.056 0.016 5 0 "[ . 1 . 2]" 1
454 1 114 ALA MB 1 116 THR H . . 3.530 2.254 2.087 2.500 . 0 0 "[ . 1 . 2]" 1
455 1 116 THR H 1 116 THR MG . . 3.720 3.781 3.738 3.809 0.089 12 0 "[ . 1 . 2]" 1
456 1 99 ILE MD 1 116 THR H . . 3.760 2.528 2.398 2.623 . 0 0 "[ . 1 . 2]" 1
457 1 99 ILE H 1 100 TYR H . . 4.850 4.459 4.293 4.527 . 0 0 "[ . 1 . 2]" 1
458 1 98 GLY H 1 99 ILE H . . 4.820 4.397 4.312 4.467 . 0 0 "[ . 1 . 2]" 1
459 1 99 ILE H 1 111 GLN HE21 . . 4.600 3.215 2.067 4.618 0.018 11 0 "[ . 1 . 2]" 1
460 1 99 ILE H 1 111 GLN HG3 . . 4.640 4.194 3.241 5.293 0.653 7 1 "[ . + 1 . 2]" 1
461 1 99 ILE H 1 99 ILE HG12 . . 3.810 2.323 2.097 2.558 . 0 0 "[ . 1 . 2]" 1
462 1 99 ILE H 1 112 ILE HG12 . . 5.160 4.224 3.974 5.419 0.259 11 0 "[ . 1 . 2]" 1
463 1 99 ILE H 1 99 ILE HG13 . . 3.760 2.217 2.066 2.380 . 0 0 "[ . 1 . 2]" 1
464 1 51 SER H 1 52 LYS H . . 4.600 4.615 4.574 4.651 0.051 15 0 "[ . 1 . 2]" 1
465 1 51 SER H 1 51 SER HG . . 4.470 4.187 2.436 4.480 0.010 20 0 "[ . 1 . 2]" 1
466 1 51 SER H 1 51 SER QB . . 3.080 2.238 2.049 2.740 . 0 0 "[ . 1 . 2]" 1
467 1 49 GLU HA 1 51 SER H . . 4.620 4.055 3.827 4.355 . 0 0 "[ . 1 . 2]" 1
468 1 49 GLU QB 1 51 SER H . . 4.750 4.575 4.345 4.782 0.032 6 0 "[ . 1 . 2]" 1
469 1 50 LYS HB2 1 51 SER H . . 4.500 4.416 4.243 4.520 0.020 10 0 "[ . 1 . 2]" 1
470 1 50 LYS HB3 1 51 SER H . . 4.240 3.730 3.570 3.858 . 0 0 "[ . 1 . 2]" 1
471 1 50 LYS QD 1 51 SER H . . 4.640 4.435 4.032 4.648 0.008 10 0 "[ . 1 . 2]" 1
472 1 50 LYS HG3 1 51 SER H . . 4.730 3.707 3.333 3.950 . 0 0 "[ . 1 . 2]" 1
473 1 51 SER H 1 83 LEU MD2 . . 4.630 4.026 3.816 4.228 . 0 0 "[ . 1 . 2]" 1
474 1 48 ILE MG 1 51 SER H . . 4.940 4.374 4.190 4.660 . 0 0 "[ . 1 . 2]" 1
475 1 25 ASN HA 1 29 HIS H . . 4.930 4.307 4.220 4.373 . 0 0 "[ . 1 . 2]" 1
476 1 29 HIS H 1 31 CYS H . . 4.620 3.893 3.850 3.942 . 0 0 "[ . 1 . 2]" 1
477 1 29 HIS H 1 30 CYS H . . 3.140 2.427 2.383 2.479 . 0 0 "[ . 1 . 2]" 1
478 1 26 ALA HA 1 29 HIS H . . 4.490 3.434 3.400 3.455 . 0 0 "[ . 1 . 2]" 1
479 1 29 HIS H 1 29 HIS HB3 . . 3.660 3.349 3.242 3.414 . 0 0 "[ . 1 . 2]" 1
480 1 19 ASN HD21 1 122 ASP HA . . 4.980 3.215 2.462 4.148 . 0 0 "[ . 1 . 2]" 1
481 1 53 ALA H 1 54 ASN H . . 4.660 4.558 4.418 4.623 . 0 0 "[ . 1 . 2]" 1
482 1 54 ASN H 1 54 ASN HD21 . . 4.690 3.294 2.239 4.448 . 0 0 "[ . 1 . 2]" 1
483 1 119 MET H 1 120 SER H . . 4.490 2.867 2.653 3.603 . 0 0 "[ . 1 . 2]" 1
484 1 120 SER H 1 121 VAL H . . 3.430 2.674 1.881 3.202 . 0 0 "[ . 1 . 2]" 1
485 1 118 SER HB2 1 120 SER H . . 4.430 3.647 2.611 4.774 0.344 15 0 "[ . 1 . 2]" 1
486 1 119 MET HB2 1 120 SER H . . 4.670 3.952 3.205 4.681 0.011 11 0 "[ . 1 . 2]" 1
487 1 119 MET HB3 1 120 SER H . . 4.530 3.797 3.072 4.439 . 0 0 "[ . 1 . 2]" 1
488 1 120 SER H 1 121 VAL QG . . 4.140 3.277 2.744 3.616 . 0 0 "[ . 1 . 2]" 1
489 1 61 ARG HB3 1 62 ASP H . . 4.900 3.318 2.257 4.402 . 0 0 "[ . 1 . 2]" 1
490 1 106 ARG HB3 1 108 ARG H . . 4.330 3.682 3.256 4.161 . 0 0 "[ . 1 . 2]" 1
491 1 108 ARG H 1 109 PHE H . . 4.930 4.374 4.284 4.435 . 0 0 "[ . 1 . 2]" 1
492 1 103 ASN H 1 108 ARG H . . 4.210 3.272 2.888 3.755 . 0 0 "[ . 1 . 2]" 1
493 1 107 LYS H 1 108 ARG H . . 3.470 2.653 2.336 2.911 . 0 0 "[ . 1 . 2]" 1
494 1 106 ARG HA 1 108 ARG H . . 4.910 4.780 4.457 4.916 0.006 19 0 "[ . 1 . 2]" 1
495 1 107 LYS HA 1 108 ARG H . . 3.500 2.852 2.719 3.044 . 0 0 "[ . 1 . 2]" 1
496 1 103 ASN HB2 1 108 ARG H . . 4.220 2.162 1.937 3.328 . 0 0 "[ . 1 . 2]" 1
497 1 65 CYS H 1 66 GLN H . . 3.740 2.896 1.948 3.853 0.113 11 0 "[ . 1 . 2]" 1
498 1 64 SER HB2 1 65 CYS H . . 5.160 4.160 3.006 4.722 . 0 0 "[ . 1 . 2]" 1
499 1 60 PHE HB3 1 65 CYS H . . 5.130 2.895 1.946 4.900 . 0 0 "[ . 1 . 2]" 1
500 1 22 ILE HA 1 25 ASN HD21 . . 4.990 3.678 3.062 4.428 . 0 0 "[ . 1 . 2]" 1
501 1 73 LEU HG 1 75 GLY H . . 4.780 4.677 4.463 4.802 0.022 15 0 "[ . 1 . 2]" 1
502 1 63 SER H 1 65 CYS H . . 5.140 3.922 2.811 5.130 . 0 0 "[ . 1 . 2]" 1
503 1 62 ASP QB 1 63 SER H . . 3.570 2.526 1.923 3.577 0.007 3 0 "[ . 1 . 2]" 1
504 1 63 SER H 1 125 THR MG . . 4.910 3.703 2.058 4.798 . 0 0 "[ . 1 . 2]" 1
505 1 26 ALA MB 1 28 SER H . . 4.970 4.800 4.684 4.912 . 0 0 "[ . 1 . 2]" 1
506 1 28 SER H 1 45 LEU QD . . 4.990 3.956 3.478 4.323 . 0 0 "[ . 1 . 2]" 1
507 1 27 LEU H 1 28 SER H . . 3.730 2.598 2.548 2.691 . 0 0 "[ . 1 . 2]" 1
508 1 28 SER H 1 29 HIS H . . 3.860 2.596 2.589 2.612 . 0 0 "[ . 1 . 2]" 1
509 1 25 ASN HB3 1 28 SER H . . 5.200 5.067 4.743 5.206 0.006 20 0 "[ . 1 . 2]" 1
510 1 27 LEU HB3 1 28 SER H . . 3.960 3.680 3.581 3.773 . 0 0 "[ . 1 . 2]" 1
511 1 27 LEU HB2 1 28 SER H . . 4.230 2.492 2.430 2.533 . 0 0 "[ . 1 . 2]" 1
512 1 42 ASN H 1 42 ASN HD22 . . 5.230 3.743 3.594 3.882 . 0 0 "[ . 1 . 2]" 1
513 1 6 SER QB 1 7 GLY H . . 4.910 2.853 2.272 3.913 . 0 0 "[ . 1 . 2]" 1
514 1 7 GLY H 1 8 PRO QD . . 4.820 3.682 2.521 4.317 . 0 0 "[ . 1 . 2]" 1
515 1 90 THR H 1 91 VAL H . . 4.510 4.446 4.417 4.480 . 0 0 "[ . 1 . 2]" 1
516 1 88 PRO HB2 1 90 THR H . . 3.910 2.964 2.751 3.128 . 0 0 "[ . 1 . 2]" 1
517 1 89 ARG H 1 90 THR H . . 4.430 3.050 3.005 3.106 . 0 0 "[ . 1 . 2]" 1
518 1 40 GLN HB2 1 40 GLN HE22 . . 5.200 4.204 3.771 4.500 . 0 0 "[ . 1 . 2]" 1
519 1 32 LEU MD2 1 40 GLN HE21 . . 4.800 2.384 1.759 4.035 . 0 0 "[ . 1 . 2]" 1
520 1 136 SER QB 1 137 GLY H . . 4.410 3.080 2.287 4.091 . 0 0 "[ . 1 . 2]" 1
521 1 99 ILE H 1 111 GLN HE22 . . 5.060 4.428 2.762 4.928 . 0 0 "[ . 1 . 2]" 1
522 1 98 GLY HA2 1 111 GLN HE21 . . 5.200 3.926 3.412 4.979 . 0 0 "[ . 1 . 2]" 1
523 1 98 GLY HA3 1 111 GLN HE21 . . 5.120 3.636 2.519 4.263 . 0 0 "[ . 1 . 2]" 1
524 1 77 THR H 1 79 GLU H . . 4.580 4.299 4.150 4.493 . 0 0 "[ . 1 . 2]" 1
525 1 76 GLU HB2 1 77 THR H . . 4.160 3.984 3.804 4.096 . 0 0 "[ . 1 . 2]" 1
526 1 76 GLU HB3 1 77 THR H . . 4.000 4.137 4.074 4.251 0.251 11 0 "[ . 1 . 2]" 1
527 1 127 GLN H 1 128 GLY H . . 4.950 4.617 4.536 4.674 . 0 0 "[ . 1 . 2]" 1
528 1 127 GLN HG2 1 128 GLY H . . 4.750 3.607 3.173 4.000 . 0 0 "[ . 1 . 2]" 1
529 1 127 GLN HB2 1 128 GLY H . . 4.230 3.758 3.311 4.105 . 0 0 "[ . 1 . 2]" 1
530 1 127 GLN HB3 1 128 GLY H . . 4.700 2.330 1.981 2.808 . 0 0 "[ . 1 . 2]" 1
531 1 72 THR H 1 81 SER H . . 3.990 2.629 2.267 3.062 . 0 0 "[ . 1 . 2]" 1
532 1 72 THR H 1 73 LEU H . . 5.010 4.423 4.316 4.523 . 0 0 "[ . 1 . 2]" 1
533 1 71 TYR HB3 1 72 THR H . . 3.960 2.692 2.339 3.027 . 0 0 "[ . 1 . 2]" 1
534 1 71 TYR H 1 72 THR H . . 5.060 4.413 4.361 4.467 . 0 0 "[ . 1 . 2]" 1
535 1 72 THR H 1 83 LEU H . . 4.740 3.596 3.408 4.000 . 0 0 "[ . 1 . 2]" 1
536 1 71 TYR HB2 1 72 THR H . . 4.310 3.960 3.676 4.221 . 0 0 "[ . 1 . 2]" 1
537 1 72 THR H 1 82 ARG HA . . 4.610 4.317 4.012 4.509 . 0 0 "[ . 1 . 2]" 1
538 1 72 THR H 1 83 LEU QB . . 4.890 3.215 2.973 3.522 . 0 0 "[ . 1 . 2]" 1
539 1 96 VAL QG 1 98 GLY H . . 3.740 2.691 2.339 3.062 . 0 0 "[ . 1 . 2]" 1
540 1 97 GLU H 1 98 GLY H . . 3.720 2.409 2.159 2.586 . 0 0 "[ . 1 . 2]" 1
541 1 98 GLY H 1 125 THR H . . 4.060 2.707 2.536 2.916 . 0 0 "[ . 1 . 2]" 1
542 1 98 GLY H 1 126 ILE HA . . 5.110 4.700 4.410 5.018 . 0 0 "[ . 1 . 2]" 1
543 1 96 VAL HA 1 98 GLY H . . 4.600 4.153 3.832 4.369 . 0 0 "[ . 1 . 2]" 1
544 1 97 GLU HB2 1 98 GLY H . . 4.090 3.839 3.621 4.011 . 0 0 "[ . 1 . 2]" 1
545 1 33 ALA H 1 34 GLY H . . 4.850 4.333 2.041 4.559 . 0 0 "[ . 1 . 2]" 1
546 1 86 TYR QD 1 87 GLY H . . 4.140 3.556 2.536 4.010 . 0 0 "[ . 1 . 2]" 1
547 1 86 TYR HB2 1 87 GLY H . . 4.450 4.420 4.105 4.555 0.105 10 0 "[ . 1 . 2]" 1
548 1 86 TYR HB3 1 87 GLY H . . 4.470 4.092 3.319 4.500 0.030 10 0 "[ . 1 . 2]" 1
549 1 82 ARG HD2 1 87 GLY H . . 4.870 2.827 2.096 4.766 . 0 0 "[ . 1 . 2]" 1
550 1 69 ALA MB 1 87 GLY H . . 4.740 4.486 2.477 4.761 0.021 2 0 "[ . 1 . 2]" 1
551 1 85 GLY H 1 86 TYR H . . 4.890 4.378 4.005 4.628 . 0 0 "[ . 1 . 2]" 1
552 1 100 TYR QE 1 125 THR H . . 3.900 3.300 2.889 3.794 . 0 0 "[ . 1 . 2]" 1
553 1 124 PHE HB2 1 125 THR H . . 3.920 2.863 2.573 3.067 . 0 0 "[ . 1 . 2]" 1
554 1 124 PHE HB3 1 125 THR H . . 4.190 4.120 3.952 4.205 0.015 17 0 "[ . 1 . 2]" 1
555 1 135 LYS HA 1 136 SER H . . 3.580 2.420 2.178 3.632 0.052 7 0 "[ . 1 . 2]" 1
556 1 34 GLY HA3 1 36 VAL H . . 5.120 3.626 3.172 4.009 . 0 0 "[ . 1 . 2]" 1
557 1 52 LYS QG 1 53 ALA H . . 5.150 4.658 4.265 4.874 . 0 0 "[ . 1 . 2]" 1
558 1 29 HIS H 1 29 HIS HB2 . . 3.860 2.107 2.063 2.135 . 0 0 "[ . 1 . 2]" 1
559 1 28 SER HA 1 30 CYS H . . 4.980 4.435 4.390 4.465 . 0 0 "[ . 1 . 2]" 1
560 1 27 LEU HA 1 30 CYS H . . 5.040 3.728 3.618 3.863 . 0 0 "[ . 1 . 2]" 1
561 1 29 HIS HB3 1 30 CYS H . . 3.800 3.114 2.961 3.235 . 0 0 "[ . 1 . 2]" 1
562 1 95 MET H 1 95 MET HB3 . . 3.620 3.526 3.474 3.599 . 0 0 "[ . 1 . 2]" 1
563 1 11 TYR H 1 12 LYS QB . . 4.930 4.253 3.425 4.830 . 0 0 "[ . 1 . 2]" 1
564 1 20 LYS H 1 20 LYS HG2 . . 4.550 4.242 4.004 4.332 . 0 0 "[ . 1 . 2]" 1
565 1 22 ILE H 1 23 ILE HB . . 4.640 4.483 4.329 4.644 0.004 4 0 "[ . 1 . 2]" 1
566 1 23 ILE H 1 26 ALA MB . . 5.140 4.319 4.136 4.465 . 0 0 "[ . 1 . 2]" 1
567 1 20 LYS HA 1 24 HIS H . . 5.160 4.140 3.945 4.460 . 0 0 "[ . 1 . 2]" 1
568 1 23 ILE H 1 25 ASN H . . 4.860 3.915 3.725 4.333 . 0 0 "[ . 1 . 2]" 1
569 1 40 GLN HB3 1 40 GLN HE22 . . 4.970 4.641 4.085 5.038 0.068 18 0 "[ . 1 . 2]" 1
570 1 41 LYS HB2 1 42 ASN H . . 3.990 3.950 3.880 3.995 0.005 15 0 "[ . 1 . 2]" 1
571 1 51 SER QB 1 53 ALA H . . 3.960 2.872 2.226 3.309 . 0 0 "[ . 1 . 2]" 1
572 1 57 LEU MD2 1 123 ALA H . . 4.450 2.896 2.207 3.321 . 0 0 "[ . 1 . 2]" 1
573 1 66 GLN H 1 66 GLN HB2 . . 3.750 2.945 2.145 3.782 0.032 9 0 "[ . 1 . 2]" 1
574 1 60 PHE HB3 1 66 GLN H . . 4.850 3.574 2.978 4.862 0.012 10 0 "[ . 1 . 2]" 1
575 1 54 ASN HD21 1 55 HIS H . . 4.720 4.390 3.609 4.746 0.026 9 0 "[ . 1 . 2]" 1
576 1 55 HIS H 1 73 LEU H . . 4.440 4.110 3.710 4.447 0.007 11 0 "[ . 1 . 2]" 1
577 1 80 LEU H 1 80 LEU HB3 . . 4.180 3.662 3.612 3.738 . 0 0 "[ . 1 . 2]" 1
578 1 81 SER HA 1 91 VAL H . . 4.410 3.863 3.622 4.124 . 0 0 "[ . 1 . 2]" 1
579 1 92 THR H 1 95 MET HG2 . . 5.100 4.998 4.868 5.103 0.003 6 0 "[ . 1 . 2]" 1
580 1 89 ARG H 1 89 ARG HG2 . . 5.020 4.471 2.190 4.656 . 0 0 "[ . 1 . 2]" 1
581 1 90 THR H 1 91 VAL MG2 . . 4.980 4.078 3.982 4.217 . 0 0 "[ . 1 . 2]" 1
582 1 94 ALA H 1 95 MET H . . 3.510 2.271 2.210 2.350 . 0 0 "[ . 1 . 2]" 1
583 1 95 MET HB3 1 96 VAL H . . 4.290 3.857 3.714 3.995 . 0 0 "[ . 1 . 2]" 1
584 1 99 ILE H 1 112 ILE H . . 5.050 3.821 3.552 4.509 . 0 0 "[ . 1 . 2]" 1
585 1 101 LYS H 1 101 LYS HG3 . . 4.050 3.537 1.874 4.028 . 0 0 "[ . 1 . 2]" 1
586 1 101 LYS H 1 110 THR H . . 3.930 2.794 2.382 3.044 . 0 0 "[ . 1 . 2]" 1
587 1 105 ASP H 1 105 ASP HB3 . . 3.480 3.350 3.082 3.490 0.010 9 0 "[ . 1 . 2]" 1
588 1 106 ARG H 1 106 ARG HG2 . . 3.770 3.501 2.845 3.810 0.040 13 0 "[ . 1 . 2]" 1
589 1 106 ARG H 1 106 ARG HB2 . . 3.850 2.296 2.197 2.527 . 0 0 "[ . 1 . 2]" 1
590 1 111 GLN H 1 111 GLN HB3 . . 3.460 2.582 2.246 2.999 . 0 0 "[ . 1 . 2]" 1
591 1 111 GLN H 1 111 GLN HB2 . . 3.360 2.731 2.309 3.136 . 0 0 "[ . 1 . 2]" 1
592 1 113 PRO HB2 1 114 ALA H . . 3.890 3.932 3.705 4.019 0.129 14 0 "[ . 1 . 2]" 1
593 1 113 PRO HB3 1 114 ALA H . . 4.560 4.564 4.444 4.607 0.047 14 0 "[ . 1 . 2]" 1
594 1 128 GLY HA2 1 131 TRP H . . 4.040 3.468 3.109 3.757 . 0 0 "[ . 1 . 2]" 1
595 1 130 LEU QD 1 131 TRP H . . 4.810 3.890 3.729 4.204 . 0 0 "[ . 1 . 2]" 1
596 1 130 LEU HB3 1 131 TRP H . . 4.540 3.163 2.709 3.903 . 0 0 "[ . 1 . 2]" 1
597 1 121 VAL QG 1 123 ALA H . . 3.380 1.934 1.851 2.060 . 0 0 "[ . 1 . 2]" 1
598 1 25 ASN H 1 26 ALA MB . . 4.970 3.965 3.825 4.124 . 0 0 "[ . 1 . 2]" 1
599 1 47 GLU HB2 1 48 ILE H . . 4.000 2.654 2.453 2.840 . 0 0 "[ . 1 . 2]" 1
600 1 118 SER HA 1 119 MET ME . . 4.670 4.688 4.670 4.715 0.045 19 0 "[ . 1 . 2]" 1
601 1 52 LYS HA 1 53 ALA MB . . 4.650 4.664 4.574 4.731 0.081 14 0 "[ . 1 . 2]" 1
602 1 26 ALA MB 1 29 HIS HB3 . . 4.620 4.593 4.464 4.652 0.032 10 0 "[ . 1 . 2]" 1
603 1 99 ILE HA 1 117 MET ME . . 4.610 4.266 3.930 4.591 . 0 0 "[ . 1 . 2]" 1
604 1 52 LYS H 1 53 ALA MB . . 4.590 3.902 3.654 4.043 . 0 0 "[ . 1 . 2]" 1
605 1 48 ILE MD 1 49 GLU H . . 4.580 4.358 3.964 4.594 0.014 18 0 "[ . 1 . 2]" 1
606 1 92 THR HB 1 94 ALA MB . . 4.550 3.525 3.287 3.776 . 0 0 "[ . 1 . 2]" 1
607 1 77 THR HB 1 79 GLU HB2 . . 4.550 4.254 3.982 4.442 . 0 0 "[ . 1 . 2]" 1
608 1 48 ILE MD 1 56 PHE QD . . 4.550 3.972 3.460 4.380 . 0 0 "[ . 1 . 2]" 1
609 1 90 THR HB 1 92 THR MG . . 4.530 4.523 4.383 4.573 0.043 9 0 "[ . 1 . 2]" 1
610 1 126 ILE MD 1 131 TRP HE1 . . 4.510 3.646 3.275 3.935 . 0 0 "[ . 1 . 2]" 1
611 1 101 LYS HB3 1 110 THR HB . . 4.500 4.525 4.482 4.606 0.106 19 0 "[ . 1 . 2]" 1
612 1 126 ILE MD 1 127 GLN H . . 4.490 4.115 3.841 4.441 . 0 0 "[ . 1 . 2]" 1
613 1 48 ILE MG 1 56 PHE QD . . 4.490 3.134 2.920 3.483 . 0 0 "[ . 1 . 2]" 1
614 1 126 ILE MD 1 131 TRP HZ2 . . 4.490 3.169 2.740 3.648 . 0 0 "[ . 1 . 2]" 1
615 1 58 ILE MD 1 60 PHE QE . . 4.480 3.889 3.476 4.258 . 0 0 "[ . 1 . 2]" 1
616 1 19 ASN HA 1 22 ILE MG . . 4.470 4.417 4.124 4.524 0.054 11 0 "[ . 1 . 2]" 1
617 1 21 PHE HB2 1 22 ILE MD . . 4.470 4.486 4.467 4.507 0.037 9 0 "[ . 1 . 2]" 1
618 1 41 LYS HA 1 44 ILE MG . . 4.450 4.131 3.923 4.282 . 0 0 "[ . 1 . 2]" 1
619 1 26 ALA MB 1 31 CYS QB . . 4.420 3.301 3.156 3.473 . 0 0 "[ . 1 . 2]" 1
620 1 89 ARG HG2 1 90 THR HB . . 4.410 3.981 3.590 4.211 . 0 0 "[ . 1 . 2]" 1
621 1 44 ILE HA 1 48 ILE MD . . 4.410 3.984 3.640 4.417 0.007 5 0 "[ . 1 . 2]" 1
622 1 101 LYS QE 1 112 ILE MD . . 4.380 3.211 1.770 4.321 . 0 0 "[ . 1 . 2]" 1
623 1 58 ILE MG 1 68 ARG H . . 4.370 3.329 2.998 3.711 . 0 0 "[ . 1 . 2]" 1
624 1 94 ALA MB 1 95 MET HB2 . . 4.360 4.469 4.397 4.568 0.208 17 0 "[ . 1 . 2]" 1
625 1 117 MET ME 1 118 SER H . . 4.360 4.029 3.794 4.262 . 0 0 "[ . 1 . 2]" 1
626 1 94 ALA MB 1 95 MET HG2 . . 4.350 3.906 3.665 4.125 . 0 0 "[ . 1 . 2]" 1
627 1 126 ILE H 1 126 ILE MD . . 4.350 3.640 3.535 3.718 . 0 0 "[ . 1 . 2]" 1
628 1 48 ILE MG 1 70 LEU QD . . 4.340 3.258 3.031 3.522 . 0 0 "[ . 1 . 2]" 1
629 1 119 MET H 1 119 MET ME . . 4.340 3.640 3.358 3.950 . 0 0 "[ . 1 . 2]" 1
630 1 58 ILE MD 1 123 ALA HA . . 4.330 3.973 3.561 4.332 0.002 6 0 "[ . 1 . 2]" 1
631 1 73 LEU HG 1 119 MET ME . . 4.320 4.243 4.045 4.349 0.029 6 0 "[ . 1 . 2]" 1
632 1 44 ILE MD 1 85 GLY H . . 4.320 4.221 4.080 4.336 0.016 13 0 "[ . 1 . 2]" 1
633 1 101 LYS HG3 1 110 THR HB . . 4.320 2.769 1.961 3.231 . 0 0 "[ . 1 . 2]" 1
634 1 117 MET H 1 117 MET ME . . 4.310 3.998 3.657 4.261 . 0 0 "[ . 1 . 2]" 1
635 1 101 LYS HG2 1 110 THR HB . . 4.310 2.150 1.979 2.898 . 0 0 "[ . 1 . 2]" 1
636 1 24 HIS HD2 1 48 ILE MG . . 4.280 2.552 1.903 3.849 . 0 0 "[ . 1 . 2]" 1
637 1 23 ILE MG 1 56 PHE QD . . 4.280 4.075 3.858 4.281 0.001 20 0 "[ . 1 . 2]" 1
638 1 26 ALA MB 1 102 TYR QE . . 4.270 2.616 1.916 3.759 . 0 0 "[ . 1 . 2]" 1
639 1 114 ALA MB 1 116 THR HB . . 4.260 3.213 3.006 3.348 . 0 0 "[ . 1 . 2]" 1
640 1 23 ILE MD 1 56 PHE HB2 . . 4.250 3.926 3.692 4.235 . 0 0 "[ . 1 . 2]" 1
641 1 22 ILE MG 1 23 ILE HG12 . . 4.250 4.068 3.925 4.192 . 0 0 "[ . 1 . 2]" 1
642 1 101 LYS H 1 112 ILE MD . . 4.240 2.540 2.047 3.894 . 0 0 "[ . 1 . 2]" 1
643 1 22 ILE MG 1 26 ALA MB . . 4.230 3.428 3.209 3.654 . 0 0 "[ . 1 . 2]" 1
644 1 58 ILE MG 1 67 PHE QB . . 4.220 2.638 2.097 3.366 . 0 0 "[ . 1 . 2]" 1
645 1 88 PRO HD3 1 126 ILE MD . . 4.200 3.253 2.963 3.522 . 0 0 "[ . 1 . 2]" 1
646 1 22 ILE MG 1 102 TYR H . . 4.180 3.984 3.806 4.181 0.001 10 0 "[ . 1 . 2]" 1
647 1 99 ILE MD 1 116 THR HB . . 4.170 4.194 4.148 4.229 0.059 6 0 "[ . 1 . 2]" 1
648 1 97 GLU H 1 126 ILE MG . . 4.170 4.158 3.966 4.201 0.031 12 0 "[ . 1 . 2]" 1
649 1 19 ASN HB2 1 22 ILE MG . . 4.170 3.201 2.940 3.473 . 0 0 "[ . 1 . 2]" 1
650 1 44 ILE MG 1 45 LEU HA . . 4.150 3.799 3.508 4.038 . 0 0 "[ . 1 . 2]" 1
651 1 23 ILE MG 1 27 LEU H . . 4.140 3.579 3.390 3.912 . 0 0 "[ . 1 . 2]" 1
652 1 26 ALA MB 1 27 LEU HG . . 4.450 3.437 3.336 3.574 . 0 0 "[ . 1 . 2]" 1
653 1 40 GLN HB2 1 44 ILE MD . . 4.130 4.186 4.142 4.224 0.094 18 0 "[ . 1 . 2]" 1
654 1 55 HIS HA 1 119 MET ME . . 4.130 3.375 2.838 3.786 . 0 0 "[ . 1 . 2]" 1
655 1 77 THR HB 1 79 GLU H . . 4.130 3.110 2.867 3.300 . 0 0 "[ . 1 . 2]" 1
656 1 77 THR HB 1 78 GLU HG3 . . 4.120 3.869 3.196 4.089 . 0 0 "[ . 1 . 2]" 1
657 1 92 THR HB 1 94 ALA H . . 4.120 2.870 2.580 3.138 . 0 0 "[ . 1 . 2]" 1
658 1 41 LYS HA 1 44 ILE MD . . 4.110 4.132 3.939 4.205 0.095 12 0 "[ . 1 . 2]" 1
659 1 44 ILE MD 1 70 LEU QD . . 4.110 3.922 3.762 4.002 . 0 0 "[ . 1 . 2]" 1
660 1 48 ILE MG 1 49 GLU QB . . 4.760 4.714 4.463 4.789 0.029 3 0 "[ . 1 . 2]" 1
661 1 23 ILE HB 1 48 ILE MD . . 4.100 3.767 3.299 4.102 0.002 7 0 "[ . 1 . 2]" 1
662 1 44 ILE MD 1 70 LEU HB3 . . 4.090 3.621 2.811 4.103 0.013 7 0 "[ . 1 . 2]" 1
663 1 101 LYS HA 1 112 ILE MD . . 4.090 3.077 2.766 3.448 . 0 0 "[ . 1 . 2]" 1
664 1 93 PRO HG2 1 94 ALA MB . . 4.080 4.075 4.035 4.127 0.047 4 0 "[ . 1 . 2]" 1
665 1 91 VAL MG1 1 126 ILE MD . . 4.070 3.758 3.542 3.996 . 0 0 "[ . 1 . 2]" 1
666 1 88 PRO HD2 1 126 ILE MD . . 4.070 3.758 3.538 4.017 . 0 0 "[ . 1 . 2]" 1
667 1 112 ILE MD 1 113 PRO HD3 . . 4.070 3.653 3.327 4.578 0.508 11 1 "[ . 1+ . 2]" 1
668 1 77 THR H 1 77 THR HB . . 4.070 3.843 3.805 3.876 . 0 0 "[ . 1 . 2]" 1
669 1 88 PRO HG3 1 126 ILE MG . . 4.060 3.954 3.717 4.069 0.009 5 0 "[ . 1 . 2]" 1
670 1 44 ILE MG 1 67 PHE HZ . . 4.050 2.845 2.312 3.347 . 0 0 "[ . 1 . 2]" 1
671 1 126 ILE H 1 126 ILE MG . . 4.050 2.407 2.161 2.781 . 0 0 "[ . 1 . 2]" 1
672 1 23 ILE MG 1 56 PHE HB3 . . 4.040 2.960 2.660 3.282 . 0 0 "[ . 1 . 2]" 1
673 1 58 ILE HA 1 58 ILE MD . . 4.030 3.766 3.577 3.869 . 0 0 "[ . 1 . 2]" 1
674 1 44 ILE MG 1 45 LEU H . . 4.030 3.567 3.244 3.812 . 0 0 "[ . 1 . 2]" 1
675 1 94 ALA MB 1 95 MET HG3 . . 4.030 3.475 3.238 3.653 . 0 0 "[ . 1 . 2]" 1
676 1 112 ILE H 1 112 ILE MG . . 4.030 3.784 3.615 3.822 . 0 0 "[ . 1 . 2]" 1
677 1 48 ILE MG 1 56 PHE HZ . . 4.020 2.505 2.072 3.046 . 0 0 "[ . 1 . 2]" 1
678 1 23 ILE MD 1 122 ASP HB2 . . 4.020 3.853 3.671 4.034 0.014 8 0 "[ . 1 . 2]" 1
679 1 117 MET ME 1 124 PHE HB2 . . 4.020 2.923 2.680 3.297 . 0 0 "[ . 1 . 2]" 1
680 1 23 ILE MG 1 24 HIS H . . 4.010 3.332 3.118 3.610 . 0 0 "[ . 1 . 2]" 1
681 1 88 PRO HG2 1 126 ILE MG . . 4.000 3.701 3.469 3.887 . 0 0 "[ . 1 . 2]" 1
682 1 53 ALA MB 1 72 THR HA . . 4.000 3.626 3.272 3.996 . 0 0 "[ . 1 . 2]" 1
683 1 23 ILE MG 1 56 PHE HB2 . . 3.990 3.074 2.639 3.428 . 0 0 "[ . 1 . 2]" 1
684 1 44 ILE MG 1 67 PHE QE . . 3.980 3.060 2.688 3.603 . 0 0 "[ . 1 . 2]" 1
685 1 23 ILE H 1 23 ILE MD . . 3.960 3.344 3.128 3.496 . 0 0 "[ . 1 . 2]" 1
686 1 91 VAL MG2 1 126 ILE MD . . 3.950 3.227 3.006 3.523 . 0 0 "[ . 1 . 2]" 1
687 1 48 ILE MG 1 56 PHE QE . . 3.940 2.640 2.288 3.060 . 0 0 "[ . 1 . 2]" 1
688 1 19 ASN H 1 119 MET ME . . 3.940 3.953 3.899 3.982 0.042 1 0 "[ . 1 . 2]" 1
689 1 58 ILE H 1 58 ILE MD . . 3.930 3.325 2.613 3.774 . 0 0 "[ . 1 . 2]" 1
690 1 99 ILE H 1 99 ILE MD . . 3.920 3.747 3.628 3.907 . 0 0 "[ . 1 . 2]" 1
691 1 48 ILE HA 1 48 ILE MD . . 3.910 3.855 3.788 3.893 . 0 0 "[ . 1 . 2]" 1
692 1 51 SER HG 1 53 ALA MB . . 3.880 2.378 1.910 3.265 . 0 0 "[ . 1 . 2]" 1
693 1 23 ILE H 1 23 ILE MG . . 3.870 3.680 3.640 3.706 . 0 0 "[ . 1 . 2]" 1
694 1 22 ILE MG 1 23 ILE H . . 3.860 3.797 3.569 3.883 0.023 11 0 "[ . 1 . 2]" 1
695 1 125 THR HB 1 126 ILE H . . 3.850 3.629 3.183 3.845 . 0 0 "[ . 1 . 2]" 1
696 1 101 LYS H 1 110 THR HB . . 3.850 3.517 3.421 3.684 . 0 0 "[ . 1 . 2]" 1
697 1 99 ILE MD 1 117 MET HA . . 3.840 3.165 2.955 3.437 . 0 0 "[ . 1 . 2]" 1
698 1 117 MET ME 1 124 PHE QD . . 3.840 3.181 2.971 3.538 . 0 0 "[ . 1 . 2]" 1
699 1 110 THR HB 1 111 GLN H . . 3.830 3.827 3.723 3.904 0.074 4 0 "[ . 1 . 2]" 1
700 1 19 ASN HD22 1 23 ILE MD . . 3.830 3.385 2.701 3.772 . 0 0 "[ . 1 . 2]" 1
701 1 58 ILE MG 1 67 PHE HA . . 3.810 2.494 2.213 2.881 . 0 0 "[ . 1 . 2]" 1
702 1 55 HIS HB3 1 119 MET ME . . 3.810 3.411 2.972 3.786 . 0 0 "[ . 1 . 2]" 1
703 1 90 THR HB 1 91 VAL H . . 3.800 3.815 3.774 3.856 0.056 4 0 "[ . 1 . 2]" 1
704 1 112 ILE H 1 112 ILE MD . . 3.800 3.095 1.907 3.766 . 0 0 "[ . 1 . 2]" 1
705 1 112 ILE HA 1 112 ILE MD . . 3.780 2.405 1.898 3.382 . 0 0 "[ . 1 . 2]" 1
706 1 20 LYS HB2 1 48 ILE MG . . 3.780 3.667 3.351 3.940 0.160 2 0 "[ . 1 . 2]" 1
707 1 19 ASN HB3 1 22 ILE MD . . 3.770 2.647 2.139 2.981 . 0 0 "[ . 1 . 2]" 1
708 1 119 MET HA 1 119 MET ME . . 3.770 1.991 1.827 2.381 . 0 0 "[ . 1 . 2]" 1
709 1 48 ILE H 1 48 ILE MD . . 3.760 3.237 2.890 3.498 . 0 0 "[ . 1 . 2]" 1
710 1 18 SER HA 1 119 MET ME . . 3.760 3.514 2.851 3.787 0.027 19 0 "[ . 1 . 2]" 1
711 1 20 LYS HD3 1 48 ILE MG . . 3.750 2.788 1.876 3.498 . 0 0 "[ . 1 . 2]" 1
712 1 22 ILE H 1 22 ILE MD . . 3.750 3.407 3.317 3.572 . 0 0 "[ . 1 . 2]" 1
713 1 23 ILE MD 1 57 LEU HA . . 3.750 3.410 3.015 3.703 . 0 0 "[ . 1 . 2]" 1
714 1 19 ASN HB2 1 22 ILE MD . . 3.740 2.172 1.944 2.403 . 0 0 "[ . 1 . 2]" 1
715 1 58 ILE MD 1 109 PHE QE . . 3.730 3.443 2.956 3.727 . 0 0 "[ . 1 . 2]" 1
716 1 117 MET ME 1 124 PHE HB3 . . 3.730 2.896 2.587 3.497 . 0 0 "[ . 1 . 2]" 1
717 1 126 ILE HG12 1 126 ILE MG . . 3.730 2.302 2.152 2.433 . 0 0 "[ . 1 . 2]" 1
718 1 58 ILE MG 1 60 PHE QE . . 3.730 2.595 1.848 3.167 . 0 0 "[ . 1 . 2]" 1
719 1 20 LYS HE2 1 48 ILE MG . . 3.730 2.396 1.782 3.738 0.008 8 0 "[ . 1 . 2]" 1
720 1 116 THR HB 1 117 MET H . . 3.720 3.654 3.489 3.737 0.017 6 0 "[ . 1 . 2]" 1
721 1 26 ALA MB 1 109 PHE QE . . 3.720 3.329 2.785 3.728 0.008 20 0 "[ . 1 . 2]" 1
722 1 126 ILE MG 1 127 GLN H . . 3.720 3.724 3.665 3.803 0.083 17 0 "[ . 1 . 2]" 1
723 1 48 ILE H 1 48 ILE MG . . 3.720 3.705 3.688 3.712 . 0 0 "[ . 1 . 2]" 1
724 1 44 ILE MG 1 70 LEU QD . . 3.080 2.309 1.857 2.839 . 0 0 "[ . 1 . 2]" 1
725 1 40 GLN HG2 1 44 ILE MD . . 3.710 3.458 3.228 3.732 0.022 8 0 "[ . 1 . 2]" 1
726 1 22 ILE MG 1 102 TYR HB3 . . 3.700 2.217 1.935 2.395 . 0 0 "[ . 1 . 2]" 1
727 1 44 ILE H 1 44 ILE MD . . 3.690 2.470 2.180 2.714 . 0 0 "[ . 1 . 2]" 1
728 1 58 ILE MG 1 60 PHE QD . . 3.690 3.159 2.658 3.539 . 0 0 "[ . 1 . 2]" 1
729 1 99 ILE MD 1 121 VAL QG . . 2.870 2.303 2.026 2.486 . 0 0 "[ . 1 . 2]" 1
730 1 48 ILE MG 1 49 GLU H . . 3.680 3.450 3.042 3.635 . 0 0 "[ . 1 . 2]" 1
731 1 44 ILE MG 1 70 LEU HB3 . . 3.670 2.742 2.348 3.146 . 0 0 "[ . 1 . 2]" 1
732 1 44 ILE H 1 44 ILE MG . . 3.670 3.726 3.705 3.759 0.089 8 0 "[ . 1 . 2]" 1
733 1 96 VAL HA 1 126 ILE MG . . 3.640 2.870 2.628 3.127 . 0 0 "[ . 1 . 2]" 1
734 1 95 MET H 1 95 MET ME . . 4.060 4.000 3.822 4.109 0.049 15 0 "[ . 1 . 2]" 1
735 1 53 ALA MB 1 56 PHE HZ . . 3.640 3.016 2.377 3.667 0.027 18 0 "[ . 1 . 2]" 1
736 1 77 THR HB 1 78 GLU H . . 3.630 2.025 1.919 2.194 . 0 0 "[ . 1 . 2]" 1
737 1 48 ILE HG13 1 48 ILE MG . . 3.630 3.206 3.157 3.230 . 0 0 "[ . 1 . 2]" 1
738 1 19 ASN HA 1 22 ILE MD . . 3.630 2.147 1.991 2.430 . 0 0 "[ . 1 . 2]" 1
739 1 22 ILE H 1 22 ILE MG . . 3.620 3.718 3.704 3.732 0.112 12 0 "[ . 1 . 2]" 1
740 1 126 ILE HB 1 126 ILE MD . . 3.620 2.313 2.236 2.411 . 0 0 "[ . 1 . 2]" 1
741 1 53 ALA MB 1 56 PHE QE . . 3.600 3.023 2.495 3.559 . 0 0 "[ . 1 . 2]" 1
742 1 57 LEU MD1 1 117 MET ME . . 3.590 3.489 3.204 3.599 0.009 16 0 "[ . 1 . 2]" 1
743 1 72 THR HB 1 73 LEU H . . 3.590 3.376 3.133 3.523 . 0 0 "[ . 1 . 2]" 1
744 1 95 MET ME 1 126 ILE MG . . 3.580 2.610 2.030 3.257 . 0 0 "[ . 1 . 2]" 1
745 1 19 ASN HD21 1 23 ILE MD . . 3.570 3.020 2.512 3.823 0.253 1 0 "[ . 1 . 2]" 1
746 1 58 ILE MG 1 59 LEU H . . 3.570 2.729 2.313 3.222 . 0 0 "[ . 1 . 2]" 1
747 1 112 ILE MG 1 113 PRO QG . . 3.570 3.362 3.345 3.443 . 0 0 "[ . 1 . 2]" 1
748 1 117 MET HA 1 117 MET ME . . 3.560 2.617 2.308 2.956 . 0 0 "[ . 1 . 2]" 1
749 1 20 LYS HG2 1 48 ILE MG . . 3.550 2.888 2.393 3.574 0.024 2 0 "[ . 1 . 2]" 1
750 1 73 LEU MD2 1 119 MET ME . . 3.540 3.241 2.943 3.485 . 0 0 "[ . 1 . 2]" 1
751 1 117 MET ME 1 121 VAL QG . . 3.180 2.533 2.227 2.897 . 0 0 "[ . 1 . 2]" 1
752 1 126 ILE HG13 1 126 ILE MG . . 3.530 3.222 3.187 3.240 . 0 0 "[ . 1 . 2]" 1
753 1 55 HIS HB2 1 119 MET ME . . 3.510 2.220 1.804 2.632 . 0 0 "[ . 1 . 2]" 1
754 1 110 THR H 1 110 THR HB . . 3.500 2.645 2.549 2.819 . 0 0 "[ . 1 . 2]" 1
755 1 58 ILE HA 1 58 ILE MG . . 3.490 2.482 2.380 2.608 . 0 0 "[ . 1 . 2]" 1
756 1 22 ILE HG12 1 22 ILE MG . . 3.470 2.302 2.237 2.408 . 0 0 "[ . 1 . 2]" 1
757 1 53 ALA MB 1 55 HIS H . . 3.470 2.664 2.307 3.320 . 0 0 "[ . 1 . 2]" 1
758 1 95 MET ME 1 126 ILE MD . . 3.470 2.948 2.574 3.444 . 0 0 "[ . 1 . 2]" 1
759 1 112 ILE MD 1 121 VAL QG . . 2.940 2.404 1.959 2.776 . 0 0 "[ . 1 . 2]" 1
760 1 20 LYS HG3 1 48 ILE MG . . 3.450 2.099 1.884 2.572 . 0 0 "[ . 1 . 2]" 1
761 1 124 PHE QD 1 126 ILE MG . . 3.440 2.948 2.631 3.312 . 0 0 "[ . 1 . 2]" 1
762 1 112 ILE MG 1 114 ALA H . . 3.430 1.963 1.880 2.082 . 0 0 "[ . 1 . 2]" 1
763 1 23 ILE MD 1 122 ASP HB3 . . 3.430 2.516 2.217 2.770 . 0 0 "[ . 1 . 2]" 1
764 1 22 ILE MG 1 102 TYR HB2 . . 3.420 3.230 2.836 3.517 0.097 17 0 "[ . 1 . 2]" 1
765 1 112 ILE MD 1 121 VAL HA . . 3.410 2.426 2.067 2.784 . 0 0 "[ . 1 . 2]" 1
766 1 92 THR MG 1 95 MET ME . . 3.410 3.149 2.842 3.415 0.005 10 0 "[ . 1 . 2]" 1
767 1 112 ILE MG 1 113 PRO HD2 . . 3.410 1.769 1.759 1.841 . 0 0 "[ . 1 . 2]" 1
768 1 48 ILE MD 1 70 LEU QD . . 3.060 2.134 1.724 2.719 . 0 0 "[ . 1 . 2]" 1
769 1 92 THR H 1 95 MET ME . . 3.410 2.397 2.135 2.703 . 0 0 "[ . 1 . 2]" 1
770 1 22 ILE HB 1 22 ILE MD . . 3.400 2.182 2.130 2.225 . 0 0 "[ . 1 . 2]" 1
771 1 88 PRO HB2 1 95 MET ME . . 3.390 3.409 3.352 3.444 0.054 10 0 "[ . 1 . 2]" 1
772 1 44 ILE HB 1 44 ILE MD . . 3.380 3.181 3.154 3.197 . 0 0 "[ . 1 . 2]" 1
773 1 44 ILE MG 1 48 ILE HG13 . . 3.360 2.751 2.246 3.206 . 0 0 "[ . 1 . 2]" 1
774 1 126 ILE MD 1 130 LEU QD . . 3.350 2.183 1.856 2.682 . 0 0 "[ . 1 . 2]" 1
775 1 80 LEU MD2 1 117 MET ME . . 3.350 3.326 3.216 3.369 0.019 9 0 "[ . 1 . 2]" 1
776 1 116 THR H 1 116 THR HB . . 3.350 2.469 2.364 2.599 . 0 0 "[ . 1 . 2]" 1
777 1 23 ILE HG13 1 23 ILE MG . . 3.320 2.303 2.222 2.392 . 0 0 "[ . 1 . 2]" 1
778 1 92 THR HB 1 93 PRO HD2 . . 3.320 1.954 1.911 1.989 . 0 0 "[ . 1 . 2]" 1
779 1 112 ILE HG12 1 112 ILE MG . . 3.320 3.210 2.885 3.237 . 0 0 "[ . 1 . 2]" 1
780 1 23 ILE HA 1 26 ALA MB . . 3.310 2.017 1.901 2.134 . 0 0 "[ . 1 . 2]" 1
781 1 90 THR H 1 90 THR HB . . 3.300 2.597 2.449 2.696 . 0 0 "[ . 1 . 2]" 1
782 1 26 ALA MB 1 109 PHE HZ . . 3.290 2.877 2.147 3.302 0.012 1 0 "[ . 1 . 2]" 1
783 1 23 ILE HA 1 23 ILE MG . . 3.290 2.516 2.454 2.581 . 0 0 "[ . 1 . 2]" 1
784 1 94 ALA MB 1 95 MET H . . 3.270 3.035 2.796 3.236 . 0 0 "[ . 1 . 2]" 1
785 1 48 ILE HA 1 48 ILE MG . . 3.260 2.400 2.324 2.508 . 0 0 "[ . 1 . 2]" 1
786 1 117 MET ME 1 117 MET HG3 . . 3.260 2.508 1.978 3.078 . 0 0 "[ . 1 . 2]" 1
787 1 126 ILE MD 1 130 LEU HB2 . . 3.250 2.607 2.191 3.002 . 0 0 "[ . 1 . 2]" 1
788 1 126 ILE HA 1 126 ILE MG . . 3.250 2.221 2.114 2.351 . 0 0 "[ . 1 . 2]" 1
789 1 53 ALA MB 1 72 THR HB . . 3.250 2.165 1.899 2.576 . 0 0 "[ . 1 . 2]" 1
790 1 22 ILE HG13 1 22 ILE MG . . 3.240 3.226 3.216 3.239 . 0 0 "[ . 1 . 2]" 1
791 1 45 LEU HA 1 48 ILE MD . . 3.230 2.436 1.952 2.823 . 0 0 "[ . 1 . 2]" 1
792 1 58 ILE HB 1 58 ILE MD . . 3.230 2.139 2.018 2.243 . 0 0 "[ . 1 . 2]" 1
793 1 22 ILE HA 1 22 ILE MG . . 3.220 2.457 2.378 2.498 . 0 0 "[ . 1 . 2]" 1
794 1 101 LYS HB2 1 112 ILE MD . . 3.210 3.280 3.198 3.369 0.159 17 0 "[ . 1 . 2]" 1
795 1 58 ILE MD 1 109 PHE HZ . . 3.210 2.907 2.342 3.213 0.003 5 0 "[ . 1 . 2]" 1
796 1 44 ILE HA 1 44 ILE MG . . 3.200 2.260 2.161 2.364 . 0 0 "[ . 1 . 2]" 1
797 1 112 ILE MG 1 113 PRO HD3 . . 3.200 2.641 2.589 2.836 . 0 0 "[ . 1 . 2]" 1
798 1 58 ILE MG 1 67 PHE QD . . 3.180 1.957 1.778 2.292 . 0 0 "[ . 1 . 2]" 1
799 1 48 ILE HB 1 48 ILE MD . . 3.170 2.273 2.083 2.431 . 0 0 "[ . 1 . 2]" 1
800 1 53 ALA MB 1 54 ASN H . . 3.170 2.763 2.498 3.126 . 0 0 "[ . 1 . 2]" 1
801 1 99 ILE HB 1 99 ILE MD . . 3.150 2.284 2.178 2.381 . 0 0 "[ . 1 . 2]" 1
802 1 23 ILE MG 1 27 LEU HG . . 3.140 2.300 1.959 2.558 . 0 0 "[ . 1 . 2]" 1
803 1 44 ILE MG 1 48 ILE MD . . 3.110 1.978 1.733 2.341 . 0 0 "[ . 1 . 2]" 1
804 1 91 VAL HA 1 95 MET ME . . 3.100 2.483 2.361 2.624 . 0 0 "[ . 1 . 2]" 1
805 1 117 MET ME 1 117 MET HG2 . . 3.100 2.603 1.951 3.070 . 0 0 "[ . 1 . 2]" 1
806 1 23 ILE MG 1 48 ILE MD . . 3.090 2.466 2.010 2.728 . 0 0 "[ . 1 . 2]" 1
807 1 44 ILE QG 1 44 ILE MG . . 3.090 2.163 2.069 2.287 . 0 0 "[ . 1 . 2]" 1
808 1 96 VAL QG 1 117 MET ME . . 2.880 2.050 1.753 2.383 . 0 0 "[ . 1 . 2]" 1
809 1 124 PHE QE 1 126 ILE MG . . 3.080 2.567 2.174 2.908 . 0 0 "[ . 1 . 2]" 1
810 1 23 ILE HA 1 23 ILE MD . . 3.060 1.913 1.884 1.943 . 0 0 "[ . 1 . 2]" 1
811 1 112 ILE HA 1 112 ILE MG . . 3.060 2.145 2.109 2.218 . 0 0 "[ . 1 . 2]" 1
812 1 116 THR HA 1 116 THR HB . . 3.050 3.063 3.055 3.065 0.015 8 0 "[ . 1 . 2]" 1
813 1 26 ALA H 1 26 ALA MB . . 3.050 2.110 1.976 2.175 . 0 0 "[ . 1 . 2]" 1
814 1 16 ALA H 1 16 ALA MB . . 3.040 2.369 1.936 2.912 . 0 0 "[ . 1 . 2]" 1
815 1 112 ILE HB 1 112 ILE MD . . 3.300 3.172 2.802 3.213 . 0 0 "[ . 1 . 2]" 1
816 1 126 ILE MD 1 126 ILE MG . . 2.980 2.097 1.904 2.294 . 0 0 "[ . 1 . 2]" 1
817 1 95 MET ME 1 130 LEU QD . . 2.970 1.942 1.815 2.080 . 0 0 "[ . 1 . 2]" 1
818 1 23 ILE MG 1 27 LEU MD2 . . 2.960 2.406 2.256 2.635 . 0 0 "[ . 1 . 2]" 1
819 1 26 ALA MB 1 58 ILE MD . . 2.950 2.186 1.823 2.468 . 0 0 "[ . 1 . 2]" 1
820 1 53 ALA H 1 53 ALA MB . . 2.930 2.220 2.035 2.445 . 0 0 "[ . 1 . 2]" 1
821 1 44 ILE MD 1 84 ALA MB . . 2.920 2.415 1.995 2.762 . 0 0 "[ . 1 . 2]" 1
822 1 91 VAL MG2 1 95 MET ME . . 2.920 2.810 2.405 2.961 0.041 17 0 "[ . 1 . 2]" 1
823 1 99 ILE MG 1 117 MET ME . . 2.920 1.907 1.739 2.178 . 0 0 "[ . 1 . 2]" 1
824 1 23 ILE MG 1 58 ILE MD . . 2.910 2.467 2.153 2.873 . 0 0 "[ . 1 . 2]" 1
825 1 23 ILE MD 1 23 ILE MG . . 2.910 2.099 1.944 2.235 . 0 0 "[ . 1 . 2]" 1
826 1 77 THR HA 1 77 THR HB . . 2.890 2.438 2.380 2.482 . 0 0 "[ . 1 . 2]" 1
827 1 58 ILE MD 1 58 ILE MG . . 2.890 2.453 2.124 2.832 . 0 0 "[ . 1 . 2]" 1
828 1 53 ALA MB 1 72 THR MG . . 2.790 1.967 1.680 2.416 . 0 0 "[ . 1 . 2]" 1
829 1 94 ALA H 1 94 ALA MB . . 2.730 2.232 2.189 2.254 . 0 0 "[ . 1 . 2]" 1
830 1 99 ILE MD 1 99 ILE MG . . 2.680 2.031 1.916 2.169 . 0 0 "[ . 1 . 2]" 1
831 1 19 ASN HD22 1 22 ILE HB . . 5.500 5.059 4.707 5.359 . 0 0 "[ . 1 . 2]" 1
832 1 71 TYR HH 1 87 GLY HA3 . . 4.780 2.726 2.282 3.455 . 0 0 "[ . 1 . 2]" 1
833 1 107 LYS HB2 1 107 LYS HE3 . . 4.780 4.057 2.437 4.708 . 0 0 "[ . 1 . 2]" 1
834 1 17 LYS H 1 17 LYS QD . . 4.770 4.504 3.951 4.815 0.045 18 0 "[ . 1 . 2]" 1
835 1 99 ILE HA 1 124 PHE HB2 . . 4.770 3.449 3.167 3.602 . 0 0 "[ . 1 . 2]" 1
836 1 93 PRO HA 1 94 ALA MB . . 4.770 4.815 4.803 4.824 0.054 13 0 "[ . 1 . 2]" 1
837 1 20 LYS HA 1 23 ILE HG13 . . 4.770 4.004 3.686 4.297 . 0 0 "[ . 1 . 2]" 1
838 1 127 GLN HB2 1 129 HIS HD2 . . 4.770 4.731 3.808 5.391 0.621 6 5 "[ .+-* 1 * . * 2]" 1
839 1 122 ASP HB3 1 123 ALA MB . . 4.770 3.796 3.617 4.060 . 0 0 "[ . 1 . 2]" 1
840 1 100 TYR HB3 1 111 GLN HA . . 4.770 3.084 2.824 3.387 . 0 0 "[ . 1 . 2]" 1
841 1 46 GLU HA 1 48 ILE H . . 4.770 4.440 4.141 4.723 . 0 0 "[ . 1 . 2]" 1
842 1 13 GLU H 1 14 PRO HD3 . . 4.930 4.677 4.618 4.783 . 0 0 "[ . 1 . 2]" 1
843 1 41 LYS H 1 41 LYS HE2 . . 4.770 4.488 4.191 5.429 0.659 14 4 "[ . *-* +. 2]" 1
844 1 87 GLY HA3 1 131 TRP HZ3 . . 4.760 4.568 4.068 4.765 0.005 8 0 "[ . 1 . 2]" 1
845 1 72 THR HA 1 73 LEU HB3 . . 4.760 4.419 4.333 4.537 . 0 0 "[ . 1 . 2]" 1
846 1 75 GLY QA 1 76 GLU QG . . 4.760 4.527 4.111 4.689 . 0 0 "[ . 1 . 2]" 1
847 1 55 HIS HD2 1 73 LEU HB3 . . 4.760 3.975 3.644 4.427 . 0 0 "[ . 1 . 2]" 1
848 1 53 ALA HA 1 54 ASN QB . . 4.760 4.406 4.068 4.564 . 0 0 "[ . 1 . 2]" 1
849 1 35 LYS HB3 1 35 LYS QE . . 4.760 3.804 2.492 4.300 . 0 0 "[ . 1 . 2]" 1
850 1 24 HIS HB3 1 45 LEU QD . . 4.750 4.097 3.451 4.696 . 0 0 "[ . 1 . 2]" 1
851 1 42 ASN HA 1 42 ASN HD21 . . 4.750 3.743 3.598 4.032 . 0 0 "[ . 1 . 2]" 1
852 1 115 LYS HB2 1 115 LYS QE . . 4.750 3.534 2.194 4.004 . 0 0 "[ . 1 . 2]" 1
853 1 38 GLU HG2 1 41 LYS HB3 . . 4.750 4.804 4.748 5.291 0.541 16 1 "[ . 1 .+ 2]" 1
854 1 51 SER HG 1 83 LEU MD2 . . 4.740 3.731 2.988 4.246 . 0 0 "[ . 1 . 2]" 1
855 1 60 PHE QE 1 109 PHE QD . . 4.740 4.381 3.653 4.756 0.016 6 0 "[ . 1 . 2]" 1
856 1 127 GLN HB2 1 130 LEU HG . . 4.740 3.772 2.132 4.759 0.019 16 0 "[ . 1 . 2]" 1
857 1 87 GLY HA2 1 131 TRP HZ3 . . 4.740 3.851 3.386 4.243 . 0 0 "[ . 1 . 2]" 1
858 1 50 LYS H 1 50 LYS QE . . 4.740 4.473 4.211 4.757 0.017 4 0 "[ . 1 . 2]" 1
859 1 101 LYS HB2 1 121 VAL HA . . 4.730 3.761 3.408 4.020 . 0 0 "[ . 1 . 2]" 1
860 1 28 SER HB3 1 41 LYS QD . . 4.730 4.517 4.218 4.974 0.244 19 0 "[ . 1 . 2]" 1
861 1 99 ILE HA 1 100 TYR QE . . 4.730 3.664 3.348 4.249 . 0 0 "[ . 1 . 2]" 1
862 1 47 GLU HG2 1 48 ILE H . . 4.730 4.635 4.508 5.098 0.368 5 0 "[ . 1 . 2]" 1
863 1 33 ALA MB 1 34 GLY HA3 . . 4.720 4.335 4.151 4.631 . 0 0 "[ . 1 . 2]" 1
864 1 107 LYS HB2 1 107 LYS HE2 . . 4.720 4.235 3.419 4.788 0.068 10 0 "[ . 1 . 2]" 1
865 1 36 VAL QG 1 38 GLU H . . 4.720 4.046 3.891 4.199 . 0 0 "[ . 1 . 2]" 1
866 1 57 LEU HA 1 58 ILE HB . . 4.720 4.437 4.322 4.540 . 0 0 "[ . 1 . 2]" 1
867 1 95 MET HB2 1 126 ILE HA . . 4.720 4.752 4.721 4.789 0.069 12 0 "[ . 1 . 2]" 1
868 1 99 ILE MG 1 121 VAL HB . . 4.720 4.052 3.747 4.313 . 0 0 "[ . 1 . 2]" 1
869 1 99 ILE HB 1 124 PHE HA . . 4.720 4.719 4.618 4.749 0.029 7 0 "[ . 1 . 2]" 1
870 1 100 TYR QE 1 123 ALA MB . . 4.720 4.509 4.120 4.732 0.012 8 0 "[ . 1 . 2]" 1
871 1 60 PHE QE 1 109 PHE QE . . 4.720 3.491 1.995 4.429 . 0 0 "[ . 1 . 2]" 1
872 1 91 VAL HB 1 124 PHE HZ . . 4.720 4.174 3.728 4.519 . 0 0 "[ . 1 . 2]" 1
873 1 19 ASN HA 1 22 ILE HG13 . . 4.720 2.978 2.653 3.115 . 0 0 "[ . 1 . 2]" 1
874 1 100 TYR HA 1 101 LYS HA . . 4.720 4.393 4.338 4.463 . 0 0 "[ . 1 . 2]" 1
875 1 51 SER HA 1 83 LEU MD2 . . 4.710 4.695 4.555 4.731 0.021 8 0 "[ . 1 . 2]" 1
876 1 37 ASN HA 1 39 PRO HD2 . . 4.710 2.635 2.499 2.779 . 0 0 "[ . 1 . 2]" 1
877 1 80 LEU HB3 1 91 VAL MG2 . . 4.710 4.328 4.094 4.478 . 0 0 "[ . 1 . 2]" 1
878 1 22 ILE MG 1 102 TYR HA . . 4.710 4.539 4.260 4.720 0.010 17 0 "[ . 1 . 2]" 1
879 1 72 THR H 1 81 SER HB2 . . 4.710 4.707 4.630 4.749 0.039 9 0 "[ . 1 . 2]" 1
880 1 56 PHE QD 1 70 LEU HG . . 4.710 3.339 2.845 4.058 . 0 0 "[ . 1 . 2]" 1
881 1 72 THR HB 1 83 LEU MD1 . . 4.710 4.681 4.448 4.742 0.032 15 0 "[ . 1 . 2]" 1
882 1 56 PHE HZ 1 83 LEU MD2 . . 4.710 3.929 3.541 4.458 . 0 0 "[ . 1 . 2]" 1
883 1 127 GLN HB3 1 130 LEU H . . 4.700 3.024 2.641 3.486 . 0 0 "[ . 1 . 2]" 1
884 1 81 SER HB2 1 90 THR MG . . 4.700 4.245 3.523 4.528 . 0 0 "[ . 1 . 2]" 1
885 1 66 GLN HB3 1 67 PHE H . . 4.700 3.546 2.242 4.402 . 0 0 "[ . 1 . 2]" 1
886 1 31 CYS QB 1 67 PHE QD . . 4.700 2.826 2.302 4.049 . 0 0 "[ . 1 . 2]" 1
887 1 97 GLU HB2 1 126 ILE HA . . 4.700 4.021 3.751 4.245 . 0 0 "[ . 1 . 2]" 1
888 1 58 ILE HA 1 71 TYR H . . 4.700 3.898 3.553 4.184 . 0 0 "[ . 1 . 2]" 1
889 1 88 PRO HA 1 90 THR H . . 4.700 3.993 3.823 4.138 . 0 0 "[ . 1 . 2]" 1
890 1 83 LEU H 1 83 LEU MD2 . . 4.690 4.186 4.146 4.272 . 0 0 "[ . 1 . 2]" 1
891 1 23 ILE HA 1 26 ALA HA . . 4.690 4.568 4.455 4.690 0.000 8 0 "[ . 1 . 2]" 1
892 1 62 ASP QB 1 63 SER HB3 . . 4.690 4.292 3.097 5.222 0.532 20 1 "[ . 1 . +]" 1
893 1 32 LEU HA 1 37 ASN QB . . 4.150 2.877 2.271 3.182 . 0 0 "[ . 1 . 2]" 1
894 1 19 ASN HD22 1 55 HIS HD2 . . 4.690 2.434 1.946 2.917 . 0 0 "[ . 1 . 2]" 1
895 1 102 TYR HB2 1 109 PHE QE . . 4.690 2.975 2.151 3.478 . 0 0 "[ . 1 . 2]" 1
896 1 71 TYR HH 1 88 PRO HB2 . . 4.690 4.621 4.382 4.735 0.045 13 0 "[ . 1 . 2]" 1
897 1 71 TYR HB3 1 80 LEU HB2 . . 4.690 3.747 3.426 3.938 . 0 0 "[ . 1 . 2]" 1
898 1 112 ILE MD 1 113 PRO HD2 . . 4.690 3.694 3.574 4.099 . 0 0 "[ . 1 . 2]" 1
899 1 98 GLY HA2 1 111 GLN HE22 . . 4.690 4.449 3.702 4.715 0.025 19 0 "[ . 1 . 2]" 1
900 1 99 ILE HA 1 100 TYR HA . . 4.690 4.446 4.382 4.481 . 0 0 "[ . 1 . 2]" 1
901 1 71 TYR HH 1 82 ARG QB . . 4.690 2.894 2.114 3.938 . 0 0 "[ . 1 . 2]" 1
902 1 129 HIS HE1 1 130 LEU QD . . 3.840 3.081 2.084 3.517 . 0 0 "[ . 1 . 2]" 1
903 1 131 TRP HB3 1 132 GLN H . . 4.680 3.383 2.494 3.823 . 0 0 "[ . 1 . 2]" 1
904 1 100 TYR H 1 121 VAL QG . . 3.650 2.286 2.082 2.597 . 0 0 "[ . 1 . 2]" 1
905 1 99 ILE HA 1 99 ILE MD . . 4.680 4.116 4.099 4.135 . 0 0 "[ . 1 . 2]" 1
906 1 82 ARG HD3 1 87 GLY H . . 4.680 4.357 3.578 4.688 0.008 12 0 "[ . 1 . 2]" 1
907 1 22 ILE HG13 1 23 ILE H . . 4.680 4.327 4.254 4.404 . 0 0 "[ . 1 . 2]" 1
908 1 20 LYS HE2 1 56 PHE QE . . 4.670 3.302 2.010 4.079 . 0 0 "[ . 1 . 2]" 1
909 1 57 LEU HB3 1 71 TYR HB2 . . 4.670 4.115 3.660 4.455 . 0 0 "[ . 1 . 2]" 1
910 1 40 GLN HG3 1 41 LYS H . . 4.670 3.551 3.431 3.774 . 0 0 "[ . 1 . 2]" 1
911 1 100 TYR QD 1 101 LYS H . . 4.670 4.277 3.986 4.467 . 0 0 "[ . 1 . 2]" 1
912 1 27 LEU HB3 1 45 LEU QD . . 4.670 3.307 2.864 3.779 . 0 0 "[ . 1 . 2]" 1
913 1 21 PHE H 1 21 PHE QE . . 4.670 4.329 4.067 4.458 . 0 0 "[ . 1 . 2]" 1
914 1 37 ASN HA 1 40 GLN H . . 4.670 3.190 3.096 3.425 . 0 0 "[ . 1 . 2]" 1
915 1 95 MET HG2 1 129 HIS HE1 . . 4.670 4.323 3.364 4.657 . 0 0 "[ . 1 . 2]" 1
916 1 32 LEU MD1 1 41 LYS H . . 4.670 4.307 4.098 4.580 . 0 0 "[ . 1 . 2]" 1
917 1 18 SER QB 1 54 ASN QB . . 4.250 1.959 1.758 2.224 . 0 0 "[ . 1 . 2]" 1
918 1 105 ASP HB3 1 106 ARG HG2 . . 4.660 3.654 2.991 4.116 . 0 0 "[ . 1 . 2]" 1
919 1 111 GLN H 1 111 GLN HG3 . . 4.660 4.429 4.256 4.571 . 0 0 "[ . 1 . 2]" 1
920 1 60 PHE QD 1 65 CYS HA . . 4.660 3.927 3.109 4.651 . 0 0 "[ . 1 . 2]" 1
921 1 44 ILE MD 1 69 ALA HA . . 4.660 4.449 4.016 4.678 0.018 20 0 "[ . 1 . 2]" 1
922 1 118 SER HB2 1 121 VAL QG . . 4.660 3.283 2.402 4.139 . 0 0 "[ . 1 . 2]" 1
923 1 127 GLN HG3 1 129 HIS HE1 . . 4.660 3.575 2.172 4.489 . 0 0 "[ . 1 . 2]" 1
924 1 96 VAL HA 1 97 GLU HA . . 4.660 4.319 4.307 4.339 . 0 0 "[ . 1 . 2]" 1
925 1 71 TYR HH 1 88 PRO HG2 . . 4.650 3.773 3.500 4.120 . 0 0 "[ . 1 . 2]" 1
926 1 23 ILE HG12 1 56 PHE HB3 . . 4.650 4.607 4.389 4.681 0.031 8 0 "[ . 1 . 2]" 1
927 1 40 GLN HA 1 43 ARG HG2 . . 4.650 3.896 3.766 4.045 . 0 0 "[ . 1 . 2]" 1
928 1 105 ASP HB2 1 106 ARG HG2 . . 4.650 4.721 3.919 5.214 0.564 12 1 "[ . 1 + . 2]" 1
929 1 47 GLU HG3 1 83 LEU MD2 . . 4.650 4.568 4.372 4.969 0.319 5 0 "[ . 1 . 2]" 1
930 1 55 HIS HE1 1 119 MET HA . . 4.650 2.572 1.997 3.057 . 0 0 "[ . 1 . 2]" 1
931 1 23 ILE HG13 1 56 PHE QD . . 4.650 4.109 3.827 4.507 . 0 0 "[ . 1 . 2]" 1
932 1 41 LYS HA 1 41 LYS HE2 . . 5.040 5.030 4.552 5.737 0.697 8 4 "[ . +** -. 2]" 1
933 1 103 ASN HB3 1 108 ARG QG . . 4.640 4.101 2.440 4.652 0.012 16 0 "[ . 1 . 2]" 1
934 1 32 LEU MD1 1 44 ILE HB . . 4.640 2.877 2.456 3.231 . 0 0 "[ . 1 . 2]" 1
935 1 27 LEU MD1 1 67 PHE QE . . 4.640 3.792 3.043 4.352 . 0 0 "[ . 1 . 2]" 1
936 1 50 LYS HG3 1 51 SER HA . . 4.640 3.473 3.301 3.611 . 0 0 "[ . 1 . 2]" 1
937 1 95 MET ME 1 130 LEU HG . . 4.640 3.557 2.579 4.652 0.012 7 0 "[ . 1 . 2]" 1
938 1 72 THR H 1 81 SER HB3 . . 4.640 3.279 3.118 3.518 . 0 0 "[ . 1 . 2]" 1
939 1 59 LEU HB2 1 69 ALA H . . 4.640 4.062 3.453 4.501 . 0 0 "[ . 1 . 2]" 1
940 1 47 GLU HB2 1 83 LEU MD1 . . 4.640 4.140 3.782 4.413 . 0 0 "[ . 1 . 2]" 1
941 1 119 MET H 1 119 MET HG2 . . 4.630 3.647 2.079 4.616 . 0 0 "[ . 1 . 2]" 1
942 1 44 ILE MD 1 85 GLY HA2 . . 4.630 4.132 3.881 4.452 . 0 0 "[ . 1 . 2]" 1
943 1 40 GLN HA 1 43 ARG HG3 . . 4.630 2.575 2.227 2.755 . 0 0 "[ . 1 . 2]" 1
944 1 31 CYS QB 1 32 LEU HB2 . . 4.630 3.653 3.457 4.161 . 0 0 "[ . 1 . 2]" 1
945 1 35 LYS H 1 35 LYS QG . . 4.630 3.600 1.922 4.073 . 0 0 "[ . 1 . 2]" 1
946 1 47 GLU HA 1 50 LYS HG2 . . 4.630 2.471 2.071 2.684 . 0 0 "[ . 1 . 2]" 1
947 1 13 GLU QB 1 14 PRO HD2 . . 4.000 2.411 2.047 2.619 . 0 0 "[ . 1 . 2]" 1
948 1 47 GLU HG3 1 83 LEU MD1 . . 4.620 4.504 4.161 4.936 0.316 5 0 "[ . 1 . 2]" 1
949 1 48 ILE HB 1 49 GLU QB . . 4.620 4.569 4.382 4.646 0.026 7 0 "[ . 1 . 2]" 1
950 1 37 ASN QB 1 38 GLU H . . 4.620 3.816 3.677 4.027 . 0 0 "[ . 1 . 2]" 1
951 1 90 THR HA 1 91 VAL HB . . 4.620 4.287 4.205 4.360 . 0 0 "[ . 1 . 2]" 1
952 1 66 GLN HA 1 67 PHE HA . . 4.620 4.387 4.289 4.625 0.005 8 0 "[ . 1 . 2]" 1
953 1 23 ILE MD 1 56 PHE HB3 . . 4.620 4.461 4.359 4.618 . 0 0 "[ . 1 . 2]" 1
954 1 24 HIS H 1 24 HIS HD2 . . 4.620 3.770 3.088 4.620 0.000 11 0 "[ . 1 . 2]" 1
955 1 20 LYS HA 1 56 PHE QE . . 4.610 3.728 3.275 4.096 . 0 0 "[ . 1 . 2]" 1
956 1 32 LEU HB2 1 37 ASN QB . . 4.610 4.326 3.864 4.438 . 0 0 "[ . 1 . 2]" 1
957 1 60 PHE HZ 1 109 PHE QE . . 4.610 2.958 1.996 3.884 . 0 0 "[ . 1 . 2]" 1
958 1 22 ILE HB 1 23 ILE MD . . 4.610 3.604 3.356 3.806 . 0 0 "[ . 1 . 2]" 1
959 1 39 PRO HG2 1 40 GLN H . . 4.610 2.674 2.410 2.812 . 0 0 "[ . 1 . 2]" 1
960 1 67 PHE QE 1 70 LEU QD . . 4.070 2.217 1.973 2.446 . 0 0 "[ . 1 . 2]" 1
961 1 93 PRO HA 1 96 VAL QG . . 3.210 2.069 1.863 2.473 . 0 0 "[ . 1 . 2]" 1
962 1 48 ILE HB 1 83 LEU MD2 . . 4.600 4.288 4.014 4.564 . 0 0 "[ . 1 . 2]" 1
963 1 45 LEU HB2 1 46 GLU HA . . 4.600 4.387 4.230 4.635 0.035 5 0 "[ . 1 . 2]" 1
964 1 50 LYS HA 1 50 LYS QE . . 4.600 3.931 3.852 4.146 . 0 0 "[ . 1 . 2]" 1
965 1 34 GLY HA3 1 36 VAL QG . . 4.600 3.464 2.751 4.463 . 0 0 "[ . 1 . 2]" 1
966 1 67 PHE HZ 1 70 LEU QD . . 4.600 3.517 3.289 3.762 . 0 0 "[ . 1 . 2]" 1
967 1 98 GLY HA2 1 100 TYR QE . . 4.600 4.407 4.012 4.618 0.018 11 0 "[ . 1 . 2]" 1
968 1 79 GLU HG3 1 80 LEU H . . 4.600 3.850 3.786 3.899 . 0 0 "[ . 1 . 2]" 1
969 1 93 PRO HG3 1 94 ALA H . . 4.600 4.616 4.583 4.658 0.058 17 0 "[ . 1 . 2]" 1
970 1 93 PRO HD3 1 94 ALA H . . 4.600 3.755 3.740 3.775 . 0 0 "[ . 1 . 2]" 1
971 1 31 CYS QB 1 32 LEU HG . . 4.370 3.220 2.821 3.604 . 0 0 "[ . 1 . 2]" 1
972 1 48 ILE HG13 1 49 GLU H . . 4.590 4.289 4.189 4.417 . 0 0 "[ . 1 . 2]" 1
973 1 79 GLU HG2 1 80 LEU H . . 4.590 4.598 4.563 4.614 0.024 4 0 "[ . 1 . 2]" 1
974 1 19 ASN HD21 1 23 ILE HG13 . . 4.590 3.641 2.865 4.926 0.336 1 0 "[ . 1 . 2]" 1
975 1 127 GLN HG3 1 128 GLY H . . 4.590 4.557 4.447 4.619 0.029 17 0 "[ . 1 . 2]" 1
976 1 55 HIS HB2 1 73 LEU HB3 . . 4.590 3.479 3.116 3.969 . 0 0 "[ . 1 . 2]" 1
977 1 47 GLU HG3 1 83 LEU HG . . 4.590 3.832 3.689 4.755 0.165 5 0 "[ . 1 . 2]" 1
978 1 59 LEU MD2 1 68 ARG HB2 . . 4.590 3.352 2.839 4.501 . 0 0 "[ . 1 . 2]" 1
979 1 58 ILE HG12 1 67 PHE QD . . 4.590 2.337 1.990 2.995 . 0 0 "[ . 1 . 2]" 1
980 1 20 LYS HE3 1 56 PHE HZ . . 4.590 3.273 2.225 4.624 0.034 2 0 "[ . 1 . 2]" 1
981 1 73 LEU H 1 73 LEU MD2 . . 4.590 4.239 4.196 4.303 . 0 0 "[ . 1 . 2]" 1
982 1 28 SER HA 1 41 LYS HG3 . . 4.580 4.345 3.184 4.594 0.014 12 0 "[ . 1 . 2]" 1
983 1 84 ALA HA 1 85 GLY HA2 . . 4.580 4.686 4.542 4.782 0.202 5 0 "[ . 1 . 2]" 1
984 1 51 SER HA 1 52 LYS HB2 . . 4.580 4.283 4.116 4.526 . 0 0 "[ . 1 . 2]" 1
985 1 100 TYR HA 1 112 ILE HB . . 4.580 4.461 4.373 4.574 . 0 0 "[ . 1 . 2]" 1
986 1 33 ALA HA 1 34 GLY HA2 . . 4.580 4.457 4.424 4.685 0.105 20 0 "[ . 1 . 2]" 1
987 1 57 LEU MD1 1 73 LEU HG . . 4.580 4.363 4.123 4.498 . 0 0 "[ . 1 . 2]" 1
988 1 55 HIS HB3 1 73 LEU HB2 . . 4.580 3.723 3.480 4.353 . 0 0 "[ . 1 . 2]" 1
989 1 105 ASP HB3 1 106 ARG HA . . 4.570 3.992 3.869 4.138 . 0 0 "[ . 1 . 2]" 1
990 1 48 ILE HG13 1 70 LEU QD . . 3.080 2.492 1.845 2.969 . 0 0 "[ . 1 . 2]" 1
991 1 100 TYR H 1 100 TYR QE . . 4.570 4.629 4.574 4.694 0.124 15 0 "[ . 1 . 2]" 1
992 1 80 LEU HB3 1 91 VAL MG1 . . 4.570 4.449 4.055 4.592 0.022 3 0 "[ . 1 . 2]" 1
993 1 101 LYS HB3 1 102 TYR H . . 4.570 3.716 3.526 4.041 . 0 0 "[ . 1 . 2]" 1
994 1 59 LEU MD2 1 68 ARG HB3 . . 4.560 3.047 2.010 3.731 . 0 0 "[ . 1 . 2]" 1
995 1 20 LYS HA 1 23 ILE HG12 . . 4.560 3.424 2.962 3.710 . 0 0 "[ . 1 . 2]" 1
996 1 71 TYR HB3 1 80 LEU HB3 . . 4.560 2.359 2.001 2.605 . 0 0 "[ . 1 . 2]" 1
997 1 41 LYS HA 1 44 ILE H . . 4.560 3.337 3.172 3.422 . 0 0 "[ . 1 . 2]" 1
998 1 22 ILE MD 1 104 SER HB3 . . 4.560 4.469 3.506 4.584 0.024 1 0 "[ . 1 . 2]" 1
999 1 21 PHE HA 1 24 HIS HD2 . . 4.560 4.496 4.224 4.588 0.028 10 0 "[ . 1 . 2]" 1
1000 1 29 HIS H 1 29 HIS HD2 . . 4.550 3.517 3.299 3.779 . 0 0 "[ . 1 . 2]" 1
1001 1 67 PHE QD 1 70 LEU HB2 . . 4.550 4.425 4.320 4.567 0.017 11 0 "[ . 1 . 2]" 1
1002 1 51 SER H 1 83 LEU MD1 . . 4.550 3.814 3.550 4.150 . 0 0 "[ . 1 . 2]" 1
1003 1 71 TYR HA 1 84 ALA H . . 4.550 3.942 3.787 4.222 . 0 0 "[ . 1 . 2]" 1
1004 1 73 LEU MD2 1 78 GLU HA . . 4.540 3.726 3.498 3.923 . 0 0 "[ . 1 . 2]" 1
1005 1 120 SER HB3 1 121 VAL H . . 4.540 4.354 4.122 4.460 . 0 0 "[ . 1 . 2]" 1
1006 1 106 ARG HB3 1 107 LYS H . . 4.540 4.033 3.793 4.262 . 0 0 "[ . 1 . 2]" 1
1007 1 71 TYR HB2 1 80 LEU HB3 . . 4.540 3.686 3.310 4.008 . 0 0 "[ . 1 . 2]" 1
1008 1 59 LEU MD2 1 71 TYR HH . . 4.540 3.573 2.855 4.169 . 0 0 "[ . 1 . 2]" 1
1009 1 74 SER QB 1 78 GLU H . . 4.540 4.352 3.895 4.547 0.007 5 0 "[ . 1 . 2]" 1
1010 1 72 THR MG 1 83 LEU HA . . 4.540 4.225 3.986 4.405 . 0 0 "[ . 1 . 2]" 1
1011 1 22 ILE HA 1 26 ALA H . . 4.540 4.443 4.302 4.547 0.007 14 0 "[ . 1 . 2]" 1
1012 1 37 ASN HA 1 37 ASN HD21 . . 4.540 4.365 4.168 4.530 . 0 0 "[ . 1 . 2]" 1
1013 1 79 GLU HG3 1 92 THR HA . . 4.540 2.132 1.992 2.595 . 0 0 "[ . 1 . 2]" 1
1014 1 76 GLU QG 1 77 THR HA . . 4.530 4.012 3.843 4.333 . 0 0 "[ . 1 . 2]" 1
1015 1 102 TYR HB3 1 109 PHE QE . . 4.530 4.597 3.839 4.737 0.207 13 0 "[ . 1 . 2]" 1
1016 1 28 SER HB3 1 29 HIS HD2 . . 4.530 4.067 3.567 4.507 . 0 0 "[ . 1 . 2]" 1
1017 1 21 PHE HB2 1 22 ILE HA . . 4.530 4.473 4.324 4.548 0.018 1 0 "[ . 1 . 2]" 1
1018 1 44 ILE HA 1 46 GLU H . . 4.530 4.351 4.046 4.533 0.003 2 0 "[ . 1 . 2]" 1
1019 1 27 LEU MD1 1 28 SER H . . 4.530 4.534 4.492 4.557 0.027 16 0 "[ . 1 . 2]" 1
1020 1 76 GLU HA 1 77 THR MG . . 4.530 3.876 3.819 3.927 . 0 0 "[ . 1 . 2]" 1
1021 1 57 LEU HG 1 58 ILE H . . 4.530 3.815 3.665 4.129 . 0 0 "[ . 1 . 2]" 1
1022 1 32 LEU HB3 1 37 ASN QB . . 3.910 2.849 2.485 3.041 . 0 0 "[ . 1 . 2]" 1
1023 1 21 PHE HA 1 25 ASN H . . 4.530 4.406 4.129 4.534 0.004 14 0 "[ . 1 . 2]" 1
1024 1 71 TYR QE 1 82 ARG HA . . 4.530 2.785 2.547 3.221 . 0 0 "[ . 1 . 2]" 1
1025 1 41 LYS HE2 1 42 ASN H . . 4.520 4.075 3.677 4.781 0.261 14 0 "[ . 1 . 2]" 1
1026 1 96 VAL HA 1 124 PHE QD . . 4.520 3.744 3.521 4.134 . 0 0 "[ . 1 . 2]" 1
1027 1 80 LEU HB2 1 91 VAL MG2 . . 4.520 3.514 3.370 3.716 . 0 0 "[ . 1 . 2]" 1
1028 1 32 LEU MD2 1 41 LYS H . . 4.520 3.669 3.292 3.901 . 0 0 "[ . 1 . 2]" 1
1029 1 79 GLU HA 1 93 PRO HD2 . . 4.520 4.339 4.098 4.527 0.007 20 0 "[ . 1 . 2]" 1
1030 1 60 PHE HZ 1 109 PHE QD . . 4.520 4.336 3.987 4.526 0.006 16 0 "[ . 1 . 2]" 1
1031 1 82 ARG HD2 1 89 ARG HA . . 4.520 3.489 2.142 4.100 . 0 0 "[ . 1 . 2]" 1
1032 1 38 GLU HG2 1 42 ASN HD21 . . 4.520 3.003 2.872 3.906 . 0 0 "[ . 1 . 2]" 1
1033 1 48 ILE H 1 83 LEU MD2 . . 4.510 3.323 3.070 3.643 . 0 0 "[ . 1 . 2]" 1
1034 1 57 LEU HG 1 122 ASP HA . . 4.510 3.144 2.904 3.435 . 0 0 "[ . 1 . 2]" 1
1035 1 71 TYR HB2 1 124 PHE QE . . 4.510 2.981 2.704 3.294 . 0 0 "[ . 1 . 2]" 1
1036 1 41 LYS HG2 1 45 LEU HG . . 4.510 3.407 2.441 4.415 . 0 0 "[ . 1 . 2]" 1
1037 1 24 HIS HA 1 27 LEU HB2 . . 4.510 3.519 3.157 3.928 . 0 0 "[ . 1 . 2]" 1
1038 1 96 VAL HA 1 126 ILE HB . . 4.510 4.058 3.844 4.478 . 0 0 "[ . 1 . 2]" 1
1039 1 56 PHE QD 1 83 LEU MD1 . . 4.510 4.533 4.474 4.574 0.064 13 0 "[ . 1 . 2]" 1
1040 1 27 LEU MD2 1 58 ILE HG13 . . 4.510 3.466 2.773 3.977 . 0 0 "[ . 1 . 2]" 1
1041 1 24 HIS HE1 1 45 LEU QD . . 3.990 2.828 2.093 3.367 . 0 0 "[ . 1 . 2]" 1
1042 1 27 LEU MD2 1 58 ILE HG12 . . 4.510 2.620 2.027 3.018 . 0 0 "[ . 1 . 2]" 1
1043 1 39 PRO HA 1 42 ASN HD22 . . 4.510 4.487 3.998 4.531 0.021 2 0 "[ . 1 . 2]" 1
1044 1 20 LYS HB3 1 56 PHE QE . . 4.510 3.583 3.426 3.755 . 0 0 "[ . 1 . 2]" 1
1045 1 27 LEU MD2 1 67 PHE QB . . 4.510 3.774 3.439 4.158 . 0 0 "[ . 1 . 2]" 1
1046 1 38 GLU HA 1 41 LYS QD . . 4.500 4.045 3.739 4.285 . 0 0 "[ . 1 . 2]" 1
1047 1 53 ALA HA 1 54 ASN HA . . 4.500 4.332 4.309 4.362 . 0 0 "[ . 1 . 2]" 1
1048 1 59 LEU HG 1 131 TRP HH2 . . 4.500 3.378 2.671 3.947 . 0 0 "[ . 1 . 2]" 1
1049 1 20 LYS HE3 1 56 PHE QE . . 4.500 2.480 1.996 4.529 0.029 2 0 "[ . 1 . 2]" 1
1050 1 119 MET HA 1 121 VAL H . . 4.500 3.399 3.260 3.709 . 0 0 "[ . 1 . 2]" 1
1051 1 52 LYS H 1 52 LYS QG . . 4.380 3.606 2.849 3.958 . 0 0 "[ . 1 . 2]" 1
1052 1 103 ASN HB2 1 106 ARG HB2 . . 4.490 3.116 2.353 3.490 . 0 0 "[ . 1 . 2]" 1
1053 1 111 GLN HB2 1 112 ILE H . . 4.490 4.004 3.723 4.463 . 0 0 "[ . 1 . 2]" 1
1054 1 83 LEU H 1 83 LEU MD1 . . 4.490 4.091 3.941 4.195 . 0 0 "[ . 1 . 2]" 1
1055 1 41 LYS HA 1 44 ILE QG . . 4.490 2.383 2.163 2.462 . 0 0 "[ . 1 . 2]" 1
1056 1 20 LYS HA 1 23 ILE H . . 4.490 3.314 3.209 3.393 . 0 0 "[ . 1 . 2]" 1
1057 1 127 GLN HG2 1 130 LEU QD . . 4.490 4.173 4.007 4.377 . 0 0 "[ . 1 . 2]" 1
1058 1 121 VAL QG 1 122 ASP HA . . 4.490 3.405 3.135 3.736 . 0 0 "[ . 1 . 2]" 1
1059 1 48 ILE MD 1 70 LEU HG . . 4.490 3.595 1.977 4.506 0.016 7 0 "[ . 1 . 2]" 1
1060 1 59 LEU HA 1 124 PHE QD . . 4.490 3.673 3.128 4.006 . 0 0 "[ . 1 . 2]" 1
1061 1 32 LEU HA 1 37 ASN HD21 . . 4.490 2.638 2.007 3.360 . 0 0 "[ . 1 . 2]" 1
1062 1 112 ILE MG 1 113 PRO HA . . 4.490 4.411 4.323 4.458 . 0 0 "[ . 1 . 2]" 1
1063 1 100 TYR HA 1 101 LYS HB3 . . 4.490 4.288 4.177 4.448 . 0 0 "[ . 1 . 2]" 1
1064 1 111 GLN HB3 1 112 ILE H . . 4.480 3.743 3.152 4.550 0.070 17 0 "[ . 1 . 2]" 1
1065 1 27 LEU MD2 1 28 SER H . . 4.480 4.512 4.486 4.559 0.079 8 0 "[ . 1 . 2]" 1
1066 1 99 ILE MG 1 117 MET HG3 . . 4.480 4.449 3.784 5.429 0.949 9 8 "[ * * *-+1* * . *2]" 1
1067 1 27 LEU MD2 1 67 PHE HZ . . 4.480 4.408 3.989 4.509 0.029 20 0 "[ . 1 . 2]" 1
1068 1 75 GLY QA 1 77 THR H . . 4.480 3.834 3.750 3.929 . 0 0 "[ . 1 . 2]" 1
1069 1 83 LEU H 1 83 LEU HG . . 4.480 4.403 4.341 4.482 0.002 16 0 "[ . 1 . 2]" 1
1070 1 60 PHE HB2 1 62 ASP H . . 4.480 3.355 2.745 3.916 . 0 0 "[ . 1 . 2]" 1
1071 1 32 LEU HA 1 37 ASN HD22 . . 4.480 3.545 3.145 4.238 . 0 0 "[ . 1 . 2]" 1
1072 1 51 SER HG 1 72 THR MG . . 4.480 2.664 1.846 3.821 . 0 0 "[ . 1 . 2]" 1
1073 1 38 GLU HG3 1 41 LYS HE3 . . 4.480 4.331 3.279 4.516 0.036 4 0 "[ . 1 . 2]" 1
1074 1 66 GLN HB2 1 67 PHE H . . 4.470 4.011 2.606 4.633 0.163 15 0 "[ . 1 . 2]" 1
1075 1 32 LEU MD2 1 37 ASN HD21 . . 4.470 3.009 2.293 3.722 . 0 0 "[ . 1 . 2]" 1
1076 1 103 ASN HB3 1 106 ARG HB3 . . 4.470 3.537 3.254 4.221 . 0 0 "[ . 1 . 2]" 1
1077 1 100 TYR QD 1 109 PHE HB3 . . 4.470 4.234 3.771 4.485 0.015 8 0 "[ . 1 . 2]" 1
1078 1 104 SER HA 1 105 ASP HA . . 4.470 4.510 4.474 4.605 0.135 4 0 "[ . 1 . 2]" 1
1079 1 18 SER HA 1 19 ASN HA . . 4.460 4.381 4.336 4.437 . 0 0 "[ . 1 . 2]" 1
1080 1 129 HIS HA 1 132 GLN H . . 4.460 3.577 3.156 4.415 . 0 0 "[ . 1 . 2]" 1
1081 1 98 GLY HA2 1 99 ILE HG13 . . 4.460 4.113 3.942 4.283 . 0 0 "[ . 1 . 2]" 1
1082 1 99 ILE MG 1 125 THR H . . 4.460 3.941 3.717 4.130 . 0 0 "[ . 1 . 2]" 1
1083 1 58 ILE MG 1 123 ALA HA . . 4.460 4.214 3.848 4.425 . 0 0 "[ . 1 . 2]" 1
1084 1 103 ASN HB3 1 108 ARG H . . 4.460 2.281 1.946 3.529 . 0 0 "[ . 1 . 2]" 1
1085 1 57 LEU MD2 1 58 ILE H . . 4.460 3.799 3.488 4.112 . 0 0 "[ . 1 . 2]" 1
1086 1 27 LEU MD2 1 32 LEU H . . 4.460 3.635 3.344 4.142 . 0 0 "[ . 1 . 2]" 1
1087 1 23 ILE MG 1 24 HIS HA . . 4.460 3.416 3.192 3.652 . 0 0 "[ . 1 . 2]" 1
1088 1 46 GLU QB 1 50 LYS QE . . 4.460 4.133 3.965 4.341 . 0 0 "[ . 1 . 2]" 1
1089 1 80 LEU HA 1 81 SER HB3 . . 4.730 4.525 4.403 4.742 0.012 10 0 "[ . 1 . 2]" 1
1090 1 60 PHE HB2 1 61 ARG H . . 4.460 3.576 3.193 4.254 . 0 0 "[ . 1 . 2]" 1
1091 1 108 ARG QG 1 109 PHE H . . 4.450 3.978 3.188 4.218 . 0 0 "[ . 1 . 2]" 1
1092 1 60 PHE QD 1 61 ARG H . . 4.450 3.674 3.080 4.425 . 0 0 "[ . 1 . 2]" 1
1093 1 88 PRO HB3 1 90 THR H . . 4.450 4.361 4.180 4.515 0.065 18 0 "[ . 1 . 2]" 1
1094 1 97 GLU HA 1 127 GLN HA . . 4.450 4.271 3.992 4.457 0.007 20 0 "[ . 1 . 2]" 1
1095 1 102 TYR HA 1 109 PHE QD . . 4.440 2.987 2.358 3.605 . 0 0 "[ . 1 . 2]" 1
1096 1 32 LEU HB2 1 41 LYS HB2 . . 4.440 3.740 3.111 4.063 . 0 0 "[ . 1 . 2]" 1
1097 1 93 PRO HB2 1 94 ALA HA . . 4.440 4.334 4.310 4.356 . 0 0 "[ . 1 . 2]" 1
1098 1 51 SER HA 1 52 LYS HA . . 4.440 4.370 4.361 4.378 . 0 0 "[ . 1 . 2]" 1
1099 1 67 PHE QE 1 70 LEU HB3 . . 4.440 3.708 3.557 3.906 . 0 0 "[ . 1 . 2]" 1
1100 1 60 PHE HA 1 68 ARG H . . 4.440 3.200 2.574 3.572 . 0 0 "[ . 1 . 2]" 1
1101 1 32 LEU MD2 1 37 ASN HA . . 4.440 3.908 3.596 4.403 . 0 0 "[ . 1 . 2]" 1
1102 1 13 GLU QG 1 14 PRO HD2 . . 4.430 2.653 2.126 3.512 . 0 0 "[ . 1 . 2]" 1
1103 1 67 PHE HZ 1 70 LEU HB3 . . 4.430 2.977 2.799 3.268 . 0 0 "[ . 1 . 2]" 1
1104 1 61 ARG HB2 1 62 ASP H . . 4.430 3.830 2.877 4.727 0.297 19 0 "[ . 1 . 2]" 1
1105 1 73 LEU HG 1 80 LEU MD2 . . 4.430 4.304 4.162 4.476 0.046 6 0 "[ . 1 . 2]" 1
1106 1 99 ILE HB 1 112 ILE HB . . 4.430 3.227 2.969 3.483 . 0 0 "[ . 1 . 2]" 1
1107 1 79 GLU HA 1 80 LEU MD1 . . 4.430 3.720 3.371 4.062 . 0 0 "[ . 1 . 2]" 1
1108 1 83 LEU MD2 1 84 ALA H . . 4.430 4.063 3.882 4.234 . 0 0 "[ . 1 . 2]" 1
1109 1 88 PRO HD3 1 91 VAL MG2 . . 4.430 4.242 4.083 4.430 . 16 0 "[ . 1 . 2]" 1
1110 1 101 LYS HG3 1 102 TYR H . . 4.430 3.393 2.865 4.199 . 0 0 "[ . 1 . 2]" 1
1111 1 112 ILE MG 1 114 ALA HA . . 4.430 4.385 4.304 4.463 0.033 4 0 "[ . 1 . 2]" 1
1112 1 16 ALA HA 1 17 LYS QB . . 4.430 4.083 3.804 4.427 . 0 0 "[ . 1 . 2]" 1
1113 1 38 GLU HG2 1 41 LYS HE3 . . 4.420 4.315 3.587 4.617 0.197 16 0 "[ . 1 . 2]" 1
1114 1 112 ILE MD 1 120 SER HB3 . . 4.420 3.151 2.782 3.439 . 0 0 "[ . 1 . 2]" 1
1115 1 73 LEU MD2 1 74 SER H . . 4.420 4.409 4.327 4.506 0.086 6 0 "[ . 1 . 2]" 1
1116 1 42 ASN HA 1 45 LEU QD . . 3.450 2.100 1.887 2.859 . 0 0 "[ . 1 . 2]" 1
1117 1 22 ILE MD 1 104 SER HB2 . . 4.420 3.664 3.278 4.499 0.079 4 0 "[ . 1 . 2]" 1
1118 1 19 ASN HA 1 22 ILE HG12 . . 4.420 4.360 4.100 4.447 0.027 2 0 "[ . 1 . 2]" 1
1119 1 59 LEU MD2 1 124 PHE HZ . . 4.420 3.731 3.051 4.219 . 0 0 "[ . 1 . 2]" 1
1120 1 100 TYR HA 1 111 GLN HG3 . . 4.410 4.099 3.572 4.723 0.313 13 0 "[ . 1 . 2]" 1
1121 1 69 ALA MB 1 87 GLY HA3 . . 4.410 3.845 3.045 4.046 . 0 0 "[ . 1 . 2]" 1
1122 1 102 TYR HA 1 110 THR H . . 4.410 3.617 3.401 3.830 . 0 0 "[ . 1 . 2]" 1
1123 1 120 SER H 1 121 VAL HB . . 4.410 4.279 3.620 4.469 0.059 4 0 "[ . 1 . 2]" 1
1124 1 32 LEU MD2 1 40 GLN HG3 . . 4.410 3.428 3.094 3.826 . 0 0 "[ . 1 . 2]" 1
1125 1 68 ARG HB3 1 131 TRP HH2 . . 4.410 3.283 2.670 4.193 . 0 0 "[ . 1 . 2]" 1
1126 1 93 PRO HA 1 96 VAL HB . . 4.400 2.767 2.376 3.140 . 0 0 "[ . 1 . 2]" 1
1127 1 55 HIS HD2 1 57 LEU HG . . 4.400 4.024 3.600 4.369 . 0 0 "[ . 1 . 2]" 1
1128 1 103 ASN HD21 1 110 THR MG . . 4.400 4.026 3.613 4.419 0.019 19 0 "[ . 1 . 2]" 1
1129 1 21 PHE H 1 21 PHE QD . . 4.400 2.152 1.942 2.788 . 0 0 "[ . 1 . 2]" 1
1130 1 60 PHE HB3 1 62 ASP H . . 4.400 2.800 2.135 3.959 . 0 0 "[ . 1 . 2]" 1
1131 1 47 GLU HB3 1 84 ALA MB . . 4.400 2.941 2.752 3.199 . 0 0 "[ . 1 . 2]" 1
1132 1 100 TYR HA 1 112 ILE HG13 . . 4.400 3.393 2.737 3.909 . 0 0 "[ . 1 . 2]" 1
1133 1 103 ASN HD22 1 110 THR MG . . 4.400 3.563 2.954 4.289 . 0 0 "[ . 1 . 2]" 1
1134 1 54 ASN QB 1 55 HIS H . . 4.390 3.467 2.557 3.832 . 0 0 "[ . 1 . 2]" 1
1135 1 120 SER HB2 1 121 VAL H . . 4.400 4.222 3.952 4.386 . 0 0 "[ . 1 . 2]" 1
1136 1 47 GLU HB3 1 83 LEU HG . . 4.390 2.108 1.988 2.420 . 0 0 "[ . 1 . 2]" 1
1137 1 94 ALA MB 1 95 MET HA . . 4.390 3.987 3.883 4.086 . 0 0 "[ . 1 . 2]" 1
1138 1 46 GLU HG2 1 47 GLU H . . 4.390 3.889 2.018 4.318 . 0 0 "[ . 1 . 2]" 1
1139 1 115 LYS H 1 115 LYS QG . . 4.390 3.929 3.697 4.046 . 0 0 "[ . 1 . 2]" 1
1140 1 121 VAL HB 1 122 ASP H . . 4.390 4.140 3.968 4.393 0.003 11 0 "[ . 1 . 2]" 1
1141 1 117 MET HA 1 121 VAL QG . . 3.270 2.977 2.773 3.151 . 0 0 "[ . 1 . 2]" 1
1142 1 108 ARG HA 1 109 PHE QD . . 4.390 3.896 3.091 4.361 . 0 0 "[ . 1 . 2]" 1
1143 1 28 SER HB2 1 29 HIS HD2 . . 4.380 4.093 3.665 4.448 0.068 3 0 "[ . 1 . 2]" 1
1144 1 67 PHE QE 1 69 ALA HA . . 4.380 2.318 1.990 2.683 . 0 0 "[ . 1 . 2]" 1
1145 1 120 SER HA 1 121 VAL QG . . 4.380 4.281 4.157 4.346 . 0 0 "[ . 1 . 2]" 1
1146 1 100 TYR HB2 1 109 PHE QD . . 4.380 3.838 3.227 4.390 0.010 11 0 "[ . 1 . 2]" 1
1147 1 47 GLU HB2 1 83 LEU HG . . 4.380 3.400 3.020 3.765 . 0 0 "[ . 1 . 2]" 1
1148 1 57 LEU HA 1 58 ILE MD . . 4.380 3.938 3.344 4.345 . 0 0 "[ . 1 . 2]" 1
1149 1 33 ALA MB 1 34 GLY HA2 . . 4.380 4.145 4.073 4.209 . 0 0 "[ . 1 . 2]" 1
1150 1 83 LEU HG 1 84 ALA H . . 4.380 3.462 3.293 3.655 . 0 0 "[ . 1 . 2]" 1
1151 1 71 TYR HB2 1 80 LEU MD1 . . 4.380 4.337 4.031 4.406 0.026 16 0 "[ . 1 . 2]" 1
1152 1 68 ARG HB2 1 131 TRP HH2 . . 4.380 3.935 3.319 4.416 0.036 1 0 "[ . 1 . 2]" 1
1153 1 95 MET HG3 1 130 LEU QD . . 4.380 3.471 3.302 3.719 . 0 0 "[ . 1 . 2]" 1
1154 1 71 TYR HB3 1 80 LEU MD1 . . 4.370 4.111 3.897 4.316 . 0 0 "[ . 1 . 2]" 1
1155 1 40 GLN HA 1 43 ARG QD . . 4.370 4.248 3.739 4.386 0.016 12 0 "[ . 1 . 2]" 1
1156 1 25 ASN HB2 1 102 TYR QE . . 4.370 4.136 3.772 4.369 . 0 0 "[ . 1 . 2]" 1
1157 1 44 ILE MG 1 70 LEU HG . . 4.370 3.543 2.009 4.399 0.029 9 0 "[ . 1 . 2]" 1
1158 1 91 VAL H 1 92 THR MG . . 4.370 3.967 3.779 4.224 . 0 0 "[ . 1 . 2]" 1
1159 1 68 ARG HG3 1 131 TRP HH2 . . 4.370 3.797 3.229 4.375 0.005 16 0 "[ . 1 . 2]" 1
1160 1 80 LEU HB2 1 91 VAL MG1 . . 4.370 3.124 2.728 3.314 . 0 0 "[ . 1 . 2]" 1
1161 1 23 ILE HG12 1 56 PHE HB2 . . 4.370 3.244 3.115 3.417 . 0 0 "[ . 1 . 2]" 1
1162 1 96 VAL QG 1 97 GLU HB3 . . 4.710 4.222 4.055 4.333 . 0 0 "[ . 1 . 2]" 1
1163 1 59 LEU MD1 1 124 PHE HZ . . 4.370 2.657 2.073 3.223 . 0 0 "[ . 1 . 2]" 1
1164 1 68 ARG HB2 1 69 ALA H . . 4.370 3.044 2.625 3.646 . 0 0 "[ . 1 . 2]" 1
1165 1 67 PHE QD 1 68 ARG HA . . 4.370 3.368 3.052 3.787 . 0 0 "[ . 1 . 2]" 1
1166 1 95 MET HB3 1 130 LEU QD . . 4.370 1.914 1.773 2.123 . 0 0 "[ . 1 . 2]" 1
1167 1 101 LYS HD3 1 112 ILE MD . . 4.370 3.232 2.482 4.409 0.039 2 0 "[ . 1 . 2]" 1
1168 1 100 TYR QD 1 125 THR MG . . 4.370 3.753 3.294 4.046 . 0 0 "[ . 1 . 2]" 1
1169 1 39 PRO HD3 1 40 GLN H . . 4.360 3.703 3.670 3.799 . 0 0 "[ . 1 . 2]" 1
1170 1 47 GLU HA 1 50 LYS HB2 . . 4.360 4.287 4.143 4.365 0.005 12 0 "[ . 1 . 2]" 1
1171 1 48 ILE HB 1 49 GLU QG . . 4.360 3.371 3.130 3.613 . 0 0 "[ . 1 . 2]" 1
1172 1 31 CYS HA 1 67 PHE QB . . 4.360 3.014 2.609 3.342 . 0 0 "[ . 1 . 2]" 1
1173 1 73 LEU MD1 1 79 GLU H . . 4.360 3.545 3.389 3.685 . 0 0 "[ . 1 . 2]" 1
1174 1 101 LYS H 1 101 LYS HG2 . . 4.360 2.512 2.020 3.469 . 0 0 "[ . 1 . 2]" 1
1175 1 112 ILE HB 1 113 PRO HD2 . . 4.360 3.719 3.655 3.840 . 0 0 "[ . 1 . 2]" 1
1176 1 82 ARG HD3 1 89 ARG HA . . 4.360 2.772 2.285 3.855 . 0 0 "[ . 1 . 2]" 1
1177 1 24 HIS HD2 1 49 GLU QG . . 4.360 3.890 3.131 4.369 0.009 5 0 "[ . 1 . 2]" 1
1178 1 59 LEU H 1 59 LEU MD2 . . 4.350 4.244 4.117 4.330 . 0 0 "[ . 1 . 2]" 1
1179 1 103 ASN HB2 1 106 ARG HB3 . . 4.350 4.186 3.677 4.468 0.118 9 0 "[ . 1 . 2]" 1
1180 1 95 MET HG2 1 130 LEU QD . . 3.720 2.628 2.349 2.956 . 0 0 "[ . 1 . 2]" 1
1181 1 38 GLU HG3 1 42 ASN HD22 . . 4.350 3.920 3.562 4.064 . 0 0 "[ . 1 . 2]" 1
1182 1 59 LEU MD2 1 88 PRO HD3 . . 4.340 3.295 2.903 3.505 . 0 0 "[ . 1 . 2]" 1
1183 1 100 TYR QD 1 125 THR H . . 4.340 4.167 3.890 4.364 0.024 9 0 "[ . 1 . 2]" 1
1184 1 31 CYS QB 1 32 LEU H . . 4.080 2.667 2.535 2.876 . 0 0 "[ . 1 . 2]" 1
1185 1 48 ILE HA 1 83 LEU MD1 . . 4.340 3.743 3.443 3.966 . 0 0 "[ . 1 . 2]" 1
1186 1 57 LEU HB3 1 123 ALA HA . . 4.340 3.553 2.979 3.796 . 0 0 "[ . 1 . 2]" 1
1187 1 35 LYS QG 1 36 VAL HA . . 4.340 4.225 3.707 4.399 0.059 5 0 "[ . 1 . 2]" 1
1188 1 120 SER HB2 1 121 VAL QG . . 4.340 3.738 3.435 3.973 . 0 0 "[ . 1 . 2]" 1
1189 1 49 GLU QB 1 50 LYS HA . . 4.340 3.957 3.844 4.095 . 0 0 "[ . 1 . 2]" 1
1190 1 20 LYS HB2 1 20 LYS HE2 . . 4.340 4.002 3.422 4.447 0.107 2 0 "[ . 1 . 2]" 1
1191 1 81 SER HA 1 90 THR MG . . 4.340 3.197 2.538 3.516 . 0 0 "[ . 1 . 2]" 1
1192 1 90 THR HA 1 91 VAL MG2 . . 4.330 3.445 3.283 3.656 . 0 0 "[ . 1 . 2]" 1
1193 1 57 LEU HB2 1 71 TYR HB2 . . 4.330 3.206 2.857 3.388 . 0 0 "[ . 1 . 2]" 1
1194 1 101 LYS HG2 1 102 TYR H . . 4.330 3.598 3.220 4.446 0.116 2 0 "[ . 1 . 2]" 1
1195 1 18 SER HA 1 54 ASN QB . . 4.040 2.812 2.387 3.802 . 0 0 "[ . 1 . 2]" 1
1196 1 51 SER HA 1 83 LEU MD1 . . 4.330 3.541 3.204 3.761 . 0 0 "[ . 1 . 2]" 1
1197 1 32 LEU HB3 1 41 LYS HB2 . . 4.330 2.377 1.996 2.634 . 0 0 "[ . 1 . 2]" 1
1198 1 73 LEU MD2 1 117 MET HB2 . . 4.330 3.363 3.136 3.773 . 0 0 "[ . 1 . 2]" 1
1199 1 100 TYR HB3 1 109 PHE QD . . 4.330 3.620 3.006 3.973 . 0 0 "[ . 1 . 2]" 1
1200 1 92 THR MG 1 94 ALA H . . 4.330 4.086 3.979 4.139 . 0 0 "[ . 1 . 2]" 1
1201 1 73 LEU MD1 1 79 GLU HA . . 4.330 3.775 3.583 4.143 . 0 0 "[ . 1 . 2]" 1
1202 1 12 LYS HA 1 13 GLU QB . . 4.330 4.144 3.940 4.220 . 0 0 "[ . 1 . 2]" 1
1203 1 91 VAL MG1 1 95 MET HG3 . . 4.550 4.572 4.432 4.595 0.045 17 0 "[ . 1 . 2]" 1
1204 1 76 GLU QG 1 77 THR H . . 4.320 1.967 1.932 2.089 . 0 0 "[ . 1 . 2]" 1
1205 1 90 THR MG 1 91 VAL HA . . 4.320 3.369 3.214 3.657 . 0 0 "[ . 1 . 2]" 1
1206 1 57 LEU HA 1 57 LEU MD1 . . 4.320 3.177 3.040 3.335 . 0 0 "[ . 1 . 2]" 1
1207 1 63 SER HA 1 65 CYS H . . 4.320 3.987 3.528 4.362 0.042 20 0 "[ . 1 . 2]" 1
1208 1 26 ALA HA 1 30 CYS H . . 4.320 4.334 4.281 4.364 0.044 20 0 "[ . 1 . 2]" 1
1209 1 77 THR HA 1 78 GLU HA . . 4.320 4.420 4.391 4.449 0.129 15 0 "[ . 1 . 2]" 1
1210 1 61 ARG HA 1 68 ARG HG3 . . 4.320 2.929 2.177 4.329 0.009 4 0 "[ . 1 . 2]" 1
1211 1 32 LEU H 1 32 LEU MD2 . . 4.310 4.267 4.127 4.328 0.018 1 0 "[ . 1 . 2]" 1
1212 1 101 LYS HD2 1 112 ILE MD . . 4.310 2.259 1.778 4.422 0.112 19 0 "[ . 1 . 2]" 1
1213 1 56 PHE HB3 1 70 LEU QD . . 3.480 2.219 2.002 2.386 . 0 0 "[ . 1 . 2]" 1
1214 1 11 TYR H 1 11 TYR QD . . 4.310 3.842 1.910 4.360 0.050 12 0 "[ . 1 . 2]" 1
1215 1 81 SER HA 1 82 ARG QB . . 4.310 4.116 4.103 4.129 . 0 0 "[ . 1 . 2]" 1
1216 1 27 LEU HG 1 58 ILE MD . . 4.310 4.062 3.654 4.314 0.004 15 0 "[ . 1 . 2]" 1
1217 1 38 GLU HG3 1 42 ASN HD21 . . 4.300 4.304 4.046 4.341 0.041 20 0 "[ . 1 . 2]" 1
1218 1 35 LYS QG 1 36 VAL H . . 4.300 3.653 1.866 4.233 . 0 0 "[ . 1 . 2]" 1
1219 1 73 LEU HB3 1 80 LEU MD2 . . 4.300 3.234 3.049 3.448 . 0 0 "[ . 1 . 2]" 1
1220 1 32 LEU HA 1 32 LEU MD1 . . 4.300 3.847 3.815 3.921 . 0 0 "[ . 1 . 2]" 1
1221 1 73 LEU HG 1 74 SER H . . 4.300 3.407 3.292 3.561 . 0 0 "[ . 1 . 2]" 1
1222 1 115 LYS HB3 1 115 LYS QE . . 4.300 3.994 3.178 4.301 0.001 4 0 "[ . 1 . 2]" 1
1223 1 42 ASN HA 1 45 LEU HB3 . . 4.300 4.207 4.023 4.406 0.106 20 0 "[ . 1 . 2]" 1
1224 1 32 LEU MD1 1 44 ILE QG . . 4.300 1.871 1.737 2.118 . 0 0 "[ . 1 . 2]" 1
1225 1 73 LEU MD1 1 78 GLU H . . 4.300 4.228 4.020 4.329 0.029 5 0 "[ . 1 . 2]" 1
1226 1 80 LEU HA 1 81 SER HB2 . . 4.300 4.343 4.273 4.635 0.335 8 0 "[ . 1 . 2]" 1
1227 1 9 ARG HA 1 9 ARG HG3 . . 4.290 3.228 2.270 4.219 . 0 0 "[ . 1 . 2]" 1
1228 1 57 LEU MD2 1 124 PHE QE . . 4.290 3.678 3.334 4.258 . 0 0 "[ . 1 . 2]" 1
1229 1 119 MET H 1 119 MET HG3 . . 4.290 3.825 2.769 4.396 0.106 11 0 "[ . 1 . 2]" 1
1230 1 71 TYR QE 1 82 ARG QB . . 4.290 2.345 2.149 2.601 . 0 0 "[ . 1 . 2]" 1
1231 1 100 TYR HA 1 112 ILE MD . . 4.290 2.576 2.181 3.768 . 0 0 "[ . 1 . 2]" 1
1232 1 91 VAL HA 1 92 THR MG . . 4.290 3.126 2.917 3.363 . 0 0 "[ . 1 . 2]" 1
1233 1 129 HIS HA 1 132 GLN QG . . 4.290 3.394 2.023 4.237 . 0 0 "[ . 1 . 2]" 1
1234 1 104 SER HB3 1 105 ASP H . . 4.290 3.996 3.727 4.218 . 0 0 "[ . 1 . 2]" 1
1235 1 82 ARG HA 1 82 ARG HG2 . . 4.290 2.882 2.534 3.638 . 0 0 "[ . 1 . 2]" 1
1236 1 73 LEU MD2 1 119 MET HA . . 4.290 4.082 3.679 4.275 . 0 0 "[ . 1 . 2]" 1
1237 1 20 LYS HB2 1 20 LYS HE3 . . 4.280 2.975 2.265 4.015 . 0 0 "[ . 1 . 2]" 1
1238 1 41 LYS HA 1 41 LYS QD . . 4.280 4.182 4.034 4.286 0.006 16 0 "[ . 1 . 2]" 1
1239 1 32 LEU MD2 1 37 ASN HD22 . . 4.280 3.049 2.392 4.286 0.006 16 0 "[ . 1 . 2]" 1
1240 1 70 LEU HB3 1 83 LEU QB . . 4.280 3.139 2.598 3.415 . 0 0 "[ . 1 . 2]" 1
1241 1 79 GLU HG2 1 92 THR HA . . 4.280 3.765 3.603 4.282 0.002 6 0 "[ . 1 . 2]" 1
1242 1 118 SER HB3 1 119 MET H . . 4.280 3.452 2.421 4.251 . 0 0 "[ . 1 . 2]" 1
1243 1 12 LYS H 1 12 LYS QG . . 4.280 3.435 2.494 4.255 . 0 0 "[ . 1 . 2]" 1
1244 1 101 LYS HB2 1 102 TYR H . . 4.270 2.226 1.954 2.725 . 0 0 "[ . 1 . 2]" 1
1245 1 92 THR H 1 95 MET HG3 . . 4.270 3.499 3.362 3.766 . 0 0 "[ . 1 . 2]" 1
1246 1 80 LEU MD2 1 124 PHE QE . . 4.270 3.708 3.492 4.015 . 0 0 "[ . 1 . 2]" 1
1247 1 94 ALA HA 1 96 VAL H . . 4.270 4.229 3.879 4.307 0.037 15 0 "[ . 1 . 2]" 1
1248 1 84 ALA MB 1 85 GLY HA3 . . 4.270 4.016 3.866 4.277 0.007 10 0 "[ . 1 . 2]" 1
1249 1 111 GLN HA 1 112 ILE HG12 . . 4.270 3.197 3.053 3.652 . 0 0 "[ . 1 . 2]" 1
1250 1 51 SER QB 1 52 LYS H . . 4.270 3.576 2.871 3.765 . 0 0 "[ . 1 . 2]" 1
1251 1 80 LEU MD2 1 124 PHE QD . . 4.270 4.214 3.987 4.289 0.019 11 0 "[ . 1 . 2]" 1
1252 1 38 GLU HG3 1 41 LYS HE2 . . 4.270 3.804 3.092 4.286 0.016 15 0 "[ . 1 . 2]" 1
1253 1 32 LEU MD2 1 40 GLN HB2 . . 5.500 4.374 4.112 4.890 . 0 0 "[ . 1 . 2]" 1
1254 1 82 ARG HA 1 83 LEU QB . . 4.260 4.121 4.095 4.135 . 0 0 "[ . 1 . 2]" 1
1255 1 101 LYS HA 1 121 VAL HA . . 4.260 2.613 2.376 3.059 . 0 0 "[ . 1 . 2]" 1
1256 1 103 ASN HB2 1 108 ARG QG . . 4.260 3.975 2.139 4.460 0.200 9 0 "[ . 1 . 2]" 1
1257 1 28 SER HB3 1 29 HIS H . . 4.260 4.062 3.853 4.224 . 0 0 "[ . 1 . 2]" 1
1258 1 57 LEU MD1 1 122 ASP HA . . 4.260 4.153 3.831 4.285 0.025 1 0 "[ . 1 . 2]" 1
1259 1 59 LEU HG 1 68 ARG HB3 . . 4.260 3.654 2.967 4.410 0.150 10 0 "[ . 1 . 2]" 1
1260 1 7 GLY QA 1 8 PRO QG . . 4.260 3.760 3.698 3.947 . 0 0 "[ . 1 . 2]" 1
1261 1 97 GLU HB2 1 127 GLN HG3 . . 4.250 4.142 3.548 4.276 0.026 16 0 "[ . 1 . 2]" 1
1262 1 44 ILE MG 1 70 LEU HB2 . . 4.250 2.487 2.085 2.789 . 0 0 "[ . 1 . 2]" 1
1263 1 59 LEU HB2 1 71 TYR QE . . 4.250 3.157 2.505 3.691 . 0 0 "[ . 1 . 2]" 1
1264 1 59 LEU MD1 1 71 TYR QE . . 4.250 3.990 3.660 4.252 0.002 13 0 "[ . 1 . 2]" 1
1265 1 61 ARG HA 1 68 ARG HG2 . . 4.250 3.802 2.607 4.269 0.019 11 0 "[ . 1 . 2]" 1
1266 1 23 ILE HG13 1 56 PHE HB3 . . 4.250 3.114 2.978 3.191 . 0 0 "[ . 1 . 2]" 1
1267 1 99 ILE HA 1 99 ILE HG12 . . 4.250 3.589 3.531 3.703 . 0 0 "[ . 1 . 2]" 1
1268 1 63 SER HA 1 125 THR MG . . 4.250 2.933 1.801 4.223 . 0 0 "[ . 1 . 2]" 1
1269 1 53 ALA HA 1 55 HIS H . . 4.250 3.783 3.456 4.207 . 0 0 "[ . 1 . 2]" 1
1270 1 95 MET ME 1 126 ILE HB . . 4.250 3.033 2.659 3.485 . 0 0 "[ . 1 . 2]" 1
1271 1 40 GLN HG3 1 44 ILE QG . . 4.250 2.093 1.936 2.277 . 0 0 "[ . 1 . 2]" 1
1272 1 15 SER HA 1 16 ALA MB . . 4.240 4.000 3.738 4.241 0.001 6 0 "[ . 1 . 2]" 1
1273 1 32 LEU MD1 1 40 GLN HG3 . . 4.240 3.463 3.072 3.813 . 0 0 "[ . 1 . 2]" 1
1274 1 108 ARG HA 1 108 ARG HD3 . . 4.240 3.419 2.359 4.478 0.238 6 0 "[ . 1 . 2]" 1
1275 1 100 TYR H 1 121 VAL HA . . 4.240 4.141 3.993 4.273 0.033 16 0 "[ . 1 . 2]" 1
1276 1 82 ARG HA 1 84 ALA H . . 4.240 4.234 4.119 4.264 0.024 14 0 "[ . 1 . 2]" 1
1277 1 38 GLU HG2 1 42 ASN HD22 . . 4.240 3.060 2.854 3.982 . 0 0 "[ . 1 . 2]" 1
1278 1 22 ILE MG 1 23 ILE HA . . 4.240 3.701 3.564 3.798 . 0 0 "[ . 1 . 2]" 1
1279 1 100 TYR QE 1 124 PHE HA . . 4.240 3.301 2.741 3.999 . 0 0 "[ . 1 . 2]" 1
1280 1 25 ASN HA 1 28 SER HB3 . . 4.240 4.032 3.645 4.234 . 0 0 "[ . 1 . 2]" 1
1281 1 55 HIS HB3 1 73 LEU HB3 . . 4.240 2.072 1.992 2.623 . 0 0 "[ . 1 . 2]" 1
1282 1 19 ASN HD21 1 55 HIS HD2 . . 4.230 3.973 3.555 4.584 0.354 5 0 "[ . 1 . 2]" 1
1283 1 92 THR HA 1 93 PRO HG3 . . 4.230 4.316 4.296 4.351 0.121 15 0 "[ . 1 . 2]" 1
1284 1 92 THR MG 1 93 PRO HD3 . . 4.230 3.856 3.553 4.021 . 0 0 "[ . 1 . 2]" 1
1285 1 38 GLU HA 1 41 LYS H . . 4.230 3.965 3.731 4.131 . 0 0 "[ . 1 . 2]" 1
1286 1 24 HIS HA 1 48 ILE MD . . 4.230 3.388 3.017 3.684 . 0 0 "[ . 1 . 2]" 1
1287 1 71 TYR HB2 1 80 LEU MD2 . . 4.230 3.017 2.758 3.205 . 0 0 "[ . 1 . 2]" 1
1288 1 44 ILE HA 1 47 GLU HG3 . . 4.230 3.527 3.105 3.944 . 0 0 "[ . 1 . 2]" 1
1289 1 24 HIS HD2 1 48 ILE MD . . 4.220 2.975 2.081 3.985 . 0 0 "[ . 1 . 2]" 1
1290 1 73 LEU MD1 1 74 SER QB . . 4.220 3.147 3.004 3.351 . 0 0 "[ . 1 . 2]" 1
1291 1 88 PRO HA 1 89 ARG QB . . 4.220 4.089 4.056 4.441 0.221 18 0 "[ . 1 . 2]" 1
1292 1 74 SER QB 1 79 GLU HB2 . . 4.220 3.527 3.198 3.884 . 0 0 "[ . 1 . 2]" 1
1293 1 109 PHE QE 1 122 ASP HB2 . . 4.220 3.969 3.185 4.247 0.027 9 0 "[ . 1 . 2]" 1
1294 1 55 HIS HD2 1 73 LEU MD2 . . 4.220 4.166 3.674 4.262 0.042 1 0 "[ . 1 . 2]" 1
1295 1 101 LYS HA 1 101 LYS HG2 . . 4.220 3.636 3.520 4.222 0.002 2 0 "[ . 1 . 2]" 1
1296 1 114 ALA HA 1 115 LYS HB2 . . 4.220 4.096 4.063 4.161 . 0 0 "[ . 1 . 2]" 1
1297 1 76 GLU H 1 77 THR MG . . 4.220 3.873 3.700 4.009 . 0 0 "[ . 1 . 2]" 1
1298 1 20 LYS HA 1 23 ILE MG . . 4.220 4.230 4.133 4.290 0.070 2 0 "[ . 1 . 2]" 1
1299 1 49 GLU QG 1 50 LYS H . . 4.220 4.221 4.127 4.256 0.036 2 0 "[ . 1 . 2]" 1
1300 1 108 ARG HA 1 108 ARG HD2 . . 4.210 3.463 1.990 4.294 0.084 6 0 "[ . 1 . 2]" 1
1301 1 57 LEU MD1 1 73 LEU HB3 . . 4.210 2.943 2.604 3.293 . 0 0 "[ . 1 . 2]" 1
1302 1 55 HIS HA 1 56 PHE QD . . 4.210 3.522 2.844 4.008 . 0 0 "[ . 1 . 2]" 1
1303 1 104 SER HA 1 107 LYS H . . 4.200 3.511 3.281 3.750 . 0 0 "[ . 1 . 2]" 1
1304 1 43 ARG H 1 43 ARG QD . . 4.200 4.231 4.172 4.259 0.059 5 0 "[ . 1 . 2]" 1
1305 1 51 SER QB 1 72 THR MG . . 4.200 2.938 2.662 3.194 . 0 0 "[ . 1 . 2]" 1
1306 1 41 LYS HE2 1 45 LEU QD . . 4.200 4.093 3.827 4.251 0.051 11 0 "[ . 1 . 2]" 1
1307 1 47 GLU HB2 1 83 LEU MD2 . . 4.200 3.208 2.833 3.438 . 0 0 "[ . 1 . 2]" 1
1308 1 99 ILE HA 1 121 VAL QG . . 3.900 3.184 2.863 3.438 . 0 0 "[ . 1 . 2]" 1
1309 1 24 HIS HA 1 24 HIS HD2 . . 4.200 3.351 2.904 3.990 . 0 0 "[ . 1 . 2]" 1
1310 1 99 ILE MG 1 117 MET HA . . 4.200 3.124 2.926 3.468 . 0 0 "[ . 1 . 2]" 1
1311 1 60 PHE QE 1 125 THR MG . . 4.200 4.037 3.638 4.194 . 0 0 "[ . 1 . 2]" 1
1312 1 41 LYS HE3 1 41 LYS HG3 . . 4.200 3.654 3.579 3.777 . 0 0 "[ . 1 . 2]" 1
1313 1 40 GLN HG2 1 44 ILE QG . . 4.200 2.730 2.376 2.833 . 0 0 "[ . 1 . 2]" 1
1314 1 127 GLN HG3 1 130 LEU QD . . 4.200 3.536 3.245 3.747 . 0 0 "[ . 1 . 2]" 1
1315 1 99 ILE MD 1 114 ALA HA . . 4.190 4.185 3.983 4.244 0.054 3 0 "[ . 1 . 2]" 1
1316 1 60 PHE HA 1 67 PHE HA . . 4.190 3.168 2.539 3.658 . 0 0 "[ . 1 . 2]" 1
1317 1 121 VAL QG 1 122 ASP H . . 3.660 2.445 2.108 2.949 . 0 0 "[ . 1 . 2]" 1
1318 1 10 LEU HA 1 10 LEU HG . . 4.190 2.715 2.062 3.637 . 0 0 "[ . 1 . 2]" 1
1319 1 52 LYS H 1 52 LYS HB3 . . 4.190 3.103 2.394 3.538 . 0 0 "[ . 1 . 2]" 1
1320 1 112 ILE HB 1 113 PRO HD3 . . 4.190 4.386 4.346 4.459 0.269 11 0 "[ . 1 . 2]" 1
1321 1 39 PRO HA 1 42 ASN H . . 4.190 3.924 3.807 4.094 . 0 0 "[ . 1 . 2]" 1
1322 1 130 LEU H 1 130 LEU HG . . 4.190 3.382 2.012 4.241 0.051 12 0 "[ . 1 . 2]" 1
1323 1 96 VAL QG 1 125 THR H . . 4.190 2.846 2.308 3.333 . 0 0 "[ . 1 . 2]" 1
1324 1 119 MET HA 1 119 MET HG2 . . 4.190 3.146 2.479 3.709 . 0 0 "[ . 1 . 2]" 1
1325 1 47 GLU HA 1 50 LYS HG3 . . 4.190 3.956 3.576 4.145 . 0 0 "[ . 1 . 2]" 1
1326 1 43 ARG HA 1 46 GLU HG2 . . 4.190 3.702 1.971 4.207 0.017 2 0 "[ . 1 . 2]" 1
1327 1 32 LEU MD2 1 40 GLN HB3 . . 4.190 3.532 3.290 3.969 . 0 0 "[ . 1 . 2]" 1
1328 1 96 VAL QG 1 97 GLU HA . . 4.180 3.736 3.463 4.058 . 0 0 "[ . 1 . 2]" 1
1329 1 20 LYS HA 1 48 ILE MG . . 4.180 3.706 3.426 3.971 . 0 0 "[ . 1 . 2]" 1
1330 1 48 ILE H 1 48 ILE HG12 . . 4.180 3.418 3.223 3.576 . 0 0 "[ . 1 . 2]" 1
1331 1 59 LEU HA 1 124 PHE H . . 4.180 3.788 3.553 3.998 . 0 0 "[ . 1 . 2]" 1
1332 1 127 GLN HB3 1 130 LEU QD . . 3.590 2.954 2.578 3.179 . 0 0 "[ . 1 . 2]" 1
1333 1 59 LEU HG 1 131 TRP HZ2 . . 4.180 2.876 2.275 3.745 . 0 0 "[ . 1 . 2]" 1
1334 1 79 GLU HA 1 93 PRO HD3 . . 4.180 2.734 2.433 2.903 . 0 0 "[ . 1 . 2]" 1
1335 1 104 SER HB2 1 105 ASP H . . 4.180 4.010 3.839 4.329 0.149 4 0 "[ . 1 . 2]" 1
1336 1 59 LEU MD2 1 87 GLY HA2 . . 4.180 4.177 3.984 4.213 0.033 12 0 "[ . 1 . 2]" 1
1337 1 80 LEU HA 1 80 LEU MD1 . . 4.180 3.747 3.693 3.802 . 0 0 "[ . 1 . 2]" 1
1338 1 79 GLU HA 1 90 THR MG . . 4.170 4.152 4.016 4.193 0.023 9 0 "[ . 1 . 2]" 1
1339 1 114 ALA HA 1 116 THR H . . 4.170 3.812 3.736 3.869 . 0 0 "[ . 1 . 2]" 1
1340 1 102 TYR H 1 122 ASP HB3 . . 4.170 4.047 3.732 4.201 0.031 1 0 "[ . 1 . 2]" 1
1341 1 107 LYS H 1 107 LYS HG2 . . 4.170 3.701 3.288 4.211 0.041 6 0 "[ . 1 . 2]" 1
1342 1 55 HIS HE1 1 73 LEU MD2 . . 4.170 2.186 1.853 2.557 . 0 0 "[ . 1 . 2]" 1
1343 1 71 TYR HA 1 83 LEU QB . . 4.170 2.495 2.369 2.701 . 0 0 "[ . 1 . 2]" 1
1344 1 22 ILE HA 1 25 ASN H . . 4.170 3.812 3.602 4.021 . 0 0 "[ . 1 . 2]" 1
1345 1 26 ALA HA 1 102 TYR QE . . 4.170 2.411 1.991 3.313 . 0 0 "[ . 1 . 2]" 1
1346 1 71 TYR HH 1 88 PRO HD2 . . 4.170 2.240 1.966 2.835 . 0 0 "[ . 1 . 2]" 1
1347 1 44 ILE HA 1 47 GLU HG2 . . 4.170 3.985 3.605 4.269 0.099 5 0 "[ . 1 . 2]" 1
1348 1 71 TYR HB3 1 80 LEU MD2 . . 4.170 2.684 2.082 2.948 . 0 0 "[ . 1 . 2]" 1
1349 1 20 LYS HB2 1 21 PHE H . . 4.170 4.013 3.925 4.118 . 0 0 "[ . 1 . 2]" 1
1350 1 108 ARG HB3 1 108 ARG HD3 . . 4.170 3.146 2.448 3.738 . 0 0 "[ . 1 . 2]" 1
1351 1 10 LEU H 1 10 LEU HG . . 4.170 3.714 1.987 4.241 0.071 14 0 "[ . 1 . 2]" 1
1352 1 46 GLU HG3 1 47 GLU H . . 4.170 3.713 1.886 4.196 0.026 10 0 "[ . 1 . 2]" 1
1353 1 63 SER H 1 63 SER HB2 . . 4.170 3.287 2.181 4.064 . 0 0 "[ . 1 . 2]" 1
1354 1 122 ASP H 1 122 ASP HB3 . . 4.160 3.657 3.473 3.895 . 0 0 "[ . 1 . 2]" 1
1355 1 19 ASN HA 1 22 ILE H . . 4.160 3.205 3.073 3.362 . 0 0 "[ . 1 . 2]" 1
1356 1 36 VAL QG 1 37 ASN HD21 . . 4.160 3.403 2.975 3.844 . 0 0 "[ . 1 . 2]" 1
1357 1 42 ASN HB3 1 43 ARG H . . 4.160 3.207 3.122 3.406 . 0 0 "[ . 1 . 2]" 1
1358 1 126 ILE MD 1 130 LEU HB3 . . 4.160 2.365 2.047 2.801 . 0 0 "[ . 1 . 2]" 1
1359 1 25 ASN HB3 1 102 TYR QE . . 4.160 3.977 3.613 4.159 . 0 0 "[ . 1 . 2]" 1
1360 1 97 GLU HB2 1 127 GLN HG2 . . 4.160 2.908 2.525 3.974 . 0 0 "[ . 1 . 2]" 1
1361 1 48 ILE HG12 1 83 LEU MD2 . . 4.160 2.575 2.144 3.014 . 0 0 "[ . 1 . 2]" 1
1362 1 55 HIS HD2 1 56 PHE H . . 4.160 2.231 1.934 3.000 . 0 0 "[ . 1 . 2]" 1
1363 1 95 MET HB2 1 130 LEU QD . . 4.160 3.214 2.977 3.392 . 0 0 "[ . 1 . 2]" 1
1364 1 109 PHE QE 1 122 ASP HB3 . . 4.160 3.417 2.582 4.085 . 0 0 "[ . 1 . 2]" 1
1365 1 59 LEU MD2 1 87 GLY HA3 . . 4.160 3.136 2.878 3.275 . 0 0 "[ . 1 . 2]" 1
1366 1 73 LEU MD1 1 117 MET HG3 . . 4.160 2.870 2.107 3.731 . 0 0 "[ . 1 . 2]" 1
1367 1 126 ILE HA 1 130 LEU QD . . 4.160 3.496 3.349 3.640 . 0 0 "[ . 1 . 2]" 1
1368 1 73 LEU MD1 1 117 MET ME . . 4.150 4.157 4.098 4.187 0.037 5 0 "[ . 1 . 2]" 1
1369 1 102 TYR QE 1 104 SER HB3 . . 4.150 3.962 3.003 4.157 0.007 2 0 "[ . 1 . 2]" 1
1370 1 112 ILE H 1 112 ILE HG13 . . 4.150 3.370 2.399 3.512 . 0 0 "[ . 1 . 2]" 1
1371 1 24 HIS HA 1 27 LEU H . . 4.150 3.744 3.578 4.018 . 0 0 "[ . 1 . 2]" 1
1372 1 57 LEU MD2 1 123 ALA HA . . 4.150 3.459 3.145 3.892 . 0 0 "[ . 1 . 2]" 1
1373 1 97 GLU H 1 97 GLU QG . . 4.150 3.984 3.931 4.098 . 0 0 "[ . 1 . 2]" 1
1374 1 67 PHE QE 1 70 LEU HB2 . . 4.150 2.071 1.979 2.291 . 0 0 "[ . 1 . 2]" 1
1375 1 69 ALA MB 1 71 TYR HH . . 4.150 4.090 3.638 4.184 0.034 17 0 "[ . 1 . 2]" 1
1376 1 99 ILE HB 1 112 ILE HG13 . . 4.150 2.172 1.975 2.736 . 0 0 "[ . 1 . 2]" 1
1377 1 131 TRP HB2 1 131 TRP HE3 . . 4.150 4.145 4.113 4.167 0.017 8 0 "[ . 1 . 2]" 1
1378 1 44 ILE HA 1 47 GLU HB3 . . 4.150 4.056 3.735 4.179 0.029 15 0 "[ . 1 . 2]" 1
1379 1 48 ILE HA 1 56 PHE QE . . 4.140 2.361 2.079 2.968 . 0 0 "[ . 1 . 2]" 1
1380 1 20 LYS HB2 1 56 PHE QE . . 4.140 2.090 1.983 2.403 . 0 0 "[ . 1 . 2]" 1
1381 1 99 ILE HA 1 124 PHE HB3 . . 4.140 3.441 3.267 3.615 . 0 0 "[ . 1 . 2]" 1
1382 1 73 LEU HA 1 73 LEU HG . . 4.140 3.426 3.359 3.515 . 0 0 "[ . 1 . 2]" 1
1383 1 19 ASN HB3 1 22 ILE HB . . 4.140 3.819 3.375 4.130 . 0 0 "[ . 1 . 2]" 1
1384 1 30 CYS H 1 33 ALA MB . . 4.140 2.659 2.396 2.935 . 0 0 "[ . 1 . 2]" 1
1385 1 122 ASP H 1 122 ASP HB2 . . 4.130 2.601 2.313 2.894 . 0 0 "[ . 1 . 2]" 1
1386 1 98 GLY HA3 1 100 TYR QE . . 4.130 3.089 2.750 3.392 . 0 0 "[ . 1 . 2]" 1
1387 1 101 LYS H 1 101 LYS HB2 . . 4.130 3.746 3.627 3.851 . 0 0 "[ . 1 . 2]" 1
1388 1 91 VAL MG1 1 124 PHE HZ . . 4.130 3.810 3.585 4.039 . 0 0 "[ . 1 . 2]" 1
1389 1 79 GLU HA 1 92 THR MG . . 4.130 4.046 3.735 4.161 0.031 1 0 "[ . 1 . 2]" 1
1390 1 47 GLU HB3 1 48 ILE H . . 4.130 3.410 3.210 3.675 . 0 0 "[ . 1 . 2]" 1
1391 1 31 CYS QB 1 67 PHE QB . . 3.930 2.373 1.982 3.176 . 0 0 "[ . 1 . 2]" 1
1392 1 23 ILE HA 1 58 ILE MD . . 4.130 3.336 3.049 3.531 . 0 0 "[ . 1 . 2]" 1
1393 1 42 ASN HA 1 45 LEU H . . 4.120 3.358 3.109 3.622 . 0 0 "[ . 1 . 2]" 1
1394 1 20 LYS HA 1 20 LYS HG2 . . 4.120 3.115 2.731 3.740 . 0 0 "[ . 1 . 2]" 1
1395 1 112 ILE MD 1 120 SER HB2 . . 4.120 4.090 3.506 4.408 0.288 19 0 "[ . 1 . 2]" 1
1396 1 50 LYS HB2 1 50 LYS QE . . 4.120 1.957 1.918 2.113 . 0 0 "[ . 1 . 2]" 1
1397 1 54 ASN HA 1 56 PHE QE . . 4.120 2.697 2.041 3.515 . 0 0 "[ . 1 . 2]" 1
1398 1 118 SER HA 1 121 VAL QG . . 4.120 4.103 4.077 4.146 0.026 15 0 "[ . 1 . 2]" 1
1399 1 48 ILE HA 1 51 SER H . . 4.120 3.236 3.042 3.556 . 0 0 "[ . 1 . 2]" 1
1400 1 39 PRO HB3 1 40 GLN H . . 4.120 4.128 3.953 4.209 0.089 16 0 "[ . 1 . 2]" 1
1401 1 77 THR HA 1 78 GLU HG3 . . 4.120 3.410 3.182 4.267 0.147 19 0 "[ . 1 . 2]" 1
1402 1 35 LYS H 1 35 LYS HB3 . . 4.120 2.666 2.402 3.069 . 0 0 "[ . 1 . 2]" 1
1403 1 31 CYS H 1 31 CYS QB . . 3.920 2.434 2.228 2.636 . 0 0 "[ . 1 . 2]" 1
1404 1 36 VAL QG 1 37 ASN HA . . 4.120 3.480 2.980 3.840 . 0 0 "[ . 1 . 2]" 1
1405 1 73 LEU MD1 1 117 MET HB2 . . 4.110 3.542 3.259 3.938 . 0 0 "[ . 1 . 2]" 1
1406 1 37 ASN HA 1 40 GLN HB3 . . 4.110 2.708 2.526 2.967 . 0 0 "[ . 1 . 2]" 1
1407 1 57 LEU MD1 1 73 LEU H . . 4.110 3.162 2.827 3.414 . 0 0 "[ . 1 . 2]" 1
1408 1 45 LEU HA 1 48 ILE H . . 4.110 3.742 3.439 4.049 . 0 0 "[ . 1 . 2]" 1
1409 1 80 LEU MD1 1 124 PHE QD . . 4.110 3.163 2.815 3.518 . 0 0 "[ . 1 . 2]" 1
1410 1 79 GLU HB2 1 80 LEU H . . 4.110 3.811 3.714 3.942 . 0 0 "[ . 1 . 2]" 1
1411 1 59 LEU HB3 1 71 TYR QE . . 4.110 3.015 2.124 3.409 . 0 0 "[ . 1 . 2]" 1
1412 1 73 LEU H 1 73 LEU MD1 . . 4.110 4.129 4.095 4.164 0.054 19 0 "[ . 1 . 2]" 1
1413 1 101 LYS QE 1 110 THR MG . . 4.110 2.957 2.048 3.934 . 0 0 "[ . 1 . 2]" 1
1414 1 41 LYS HE2 1 41 LYS HG2 . . 4.100 3.414 3.066 3.716 . 0 0 "[ . 1 . 2]" 1
1415 1 19 ASN HA 1 22 ILE HB . . 4.100 3.177 2.846 3.334 . 0 0 "[ . 1 . 2]" 1
1416 1 97 GLU QG 1 127 GLN HG2 . . 4.100 3.721 3.377 4.105 0.005 7 0 "[ . 1 . 2]" 1
1417 1 101 LYS HA 1 101 LYS HD2 . . 4.100 4.282 4.120 4.601 0.501 2 1 "[ + . 1 . 2]" 1
1418 1 52 LYS QE 1 52 LYS QG . . 3.400 2.134 1.975 2.335 . 0 0 "[ . 1 . 2]" 1
1419 1 74 SER H 1 80 LEU HA . . 4.100 2.861 2.364 3.488 . 0 0 "[ . 1 . 2]" 1
1420 1 32 LEU MD1 1 40 GLN HE21 . . 5.480 3.044 1.932 4.303 . 0 0 "[ . 1 . 2]" 1
1421 1 61 ARG HA 1 61 ARG HG3 . . 4.100 3.099 2.057 3.685 . 0 0 "[ . 1 . 2]" 1
1422 1 59 LEU MD2 1 88 PRO HD2 . . 4.100 2.776 2.357 3.091 . 0 0 "[ . 1 . 2]" 1
1423 1 80 LEU MD1 1 91 VAL HB . . 4.100 2.690 2.361 3.165 . 0 0 "[ . 1 . 2]" 1
1424 1 39 PRO HA 1 42 ASN HD21 . . 4.090 3.030 2.601 3.131 . 0 0 "[ . 1 . 2]" 1
1425 1 28 SER HB2 1 29 HIS H . . 4.090 3.732 3.605 3.930 . 0 0 "[ . 1 . 2]" 1
1426 1 29 HIS HA 1 29 HIS HD2 . . 4.090 2.676 2.363 3.080 . 0 0 "[ . 1 . 2]" 1
1427 1 57 LEU H 1 72 THR HA . . 4.090 3.515 3.062 3.809 . 0 0 "[ . 1 . 2]" 1
1428 1 68 ARG HB2 1 68 ARG HD3 . . 4.090 3.992 3.265 4.287 0.197 1 0 "[ . 1 . 2]" 1
1429 1 67 PHE HZ 1 70 LEU HB2 . . 4.090 2.045 1.993 2.352 . 0 0 "[ . 1 . 2]" 1
1430 1 66 GLN HA 1 67 PHE QB . . 4.090 4.027 3.949 4.173 0.083 10 0 "[ . 1 . 2]" 1
1431 1 42 ASN HA 1 45 LEU HB2 . . 4.080 2.602 2.416 2.739 . 0 0 "[ . 1 . 2]" 1
1432 1 117 MET HA 1 117 MET HG2 . . 4.080 3.249 2.692 3.622 . 0 0 "[ . 1 . 2]" 1
1433 1 35 LYS H 1 35 LYS HB2 . . 4.080 2.706 2.242 3.646 . 0 0 "[ . 1 . 2]" 1
1434 1 78 GLU H 1 78 GLU HG2 . . 4.080 3.762 2.572 3.944 . 0 0 "[ . 1 . 2]" 1
1435 1 19 ASN HB3 1 19 ASN HD22 . . 4.080 3.937 3.717 4.130 0.050 4 0 "[ . 1 . 2]" 1
1436 1 35 LYS HA 1 38 GLU H . . 4.080 3.532 3.118 3.724 . 0 0 "[ . 1 . 2]" 1
1437 1 101 LYS HA 1 122 ASP HB3 . . 4.080 4.001 3.654 4.100 0.020 9 0 "[ . 1 . 2]" 1
1438 1 57 LEU HB2 1 124 PHE QD . . 4.080 3.640 3.271 3.855 . 0 0 "[ . 1 . 2]" 1
1439 1 93 PRO HB2 1 96 VAL QG . . 5.070 3.629 3.262 4.411 . 0 0 "[ . 1 . 2]" 1
1440 1 118 SER HB2 1 119 MET H . . 4.070 3.769 2.479 4.224 0.154 13 0 "[ . 1 . 2]" 1
1441 1 57 LEU MD2 1 121 VAL HB . . 4.070 3.017 2.444 3.333 . 0 0 "[ . 1 . 2]" 1
1442 1 102 TYR H 1 102 TYR HB3 . . 4.070 2.419 2.252 2.651 . 0 0 "[ . 1 . 2]" 1
1443 1 47 GLU HA 1 47 GLU HG3 . . 4.070 3.599 2.552 3.701 . 0 0 "[ . 1 . 2]" 1
1444 1 51 SER QB 1 56 PHE QE . . 4.070 2.344 2.062 3.033 . 0 0 "[ . 1 . 2]" 1
1445 1 19 ASN H 1 55 HIS HA . . 4.070 3.138 2.763 3.548 . 0 0 "[ . 1 . 2]" 1
1446 1 127 GLN HB3 1 129 HIS HE1 . . 4.060 3.511 2.658 4.100 0.040 10 0 "[ . 1 . 2]" 1
1447 1 96 VAL QG 1 97 GLU H . . 3.410 2.596 2.287 2.851 . 0 0 "[ . 1 . 2]" 1
1448 1 99 ILE HB 1 112 ILE MD . . 4.060 3.724 3.017 4.010 . 0 0 "[ . 1 . 2]" 1
1449 1 96 VAL QG 1 126 ILE HA . . 4.060 3.410 3.104 3.563 . 0 0 "[ . 1 . 2]" 1
1450 1 79 GLU HA 1 80 LEU HG . . 4.060 3.985 3.841 4.126 0.066 6 0 "[ . 1 . 2]" 1
1451 1 67 PHE HZ 1 69 ALA HA . . 4.060 2.780 2.369 3.292 . 0 0 "[ . 1 . 2]" 1
1452 1 18 SER QB 1 19 ASN H . . 3.910 3.085 1.916 3.555 . 0 0 "[ . 1 . 2]" 1
1453 1 23 ILE HA 1 26 ALA H . . 4.060 2.803 2.692 2.964 . 0 0 "[ . 1 . 2]" 1
1454 1 68 ARG HA 1 68 ARG HG3 . . 4.060 3.534 2.451 3.727 . 0 0 "[ . 1 . 2]" 1
1455 1 99 ILE HA 1 125 THR H . . 4.060 3.789 3.637 3.921 . 0 0 "[ . 1 . 2]" 1
1456 1 73 LEU MD1 1 78 GLU HB3 . . 4.060 3.776 3.354 4.238 0.178 19 0 "[ . 1 . 2]" 1
1457 1 38 GLU HA 1 41 LYS HE3 . . 4.050 3.383 2.560 3.701 . 0 0 "[ . 1 . 2]" 1
1458 1 100 TYR H 1 124 PHE HA . . 4.050 3.420 3.157 3.640 . 0 0 "[ . 1 . 2]" 1
1459 1 99 ILE HG13 1 115 LYS HA . . 4.050 3.460 3.213 3.629 . 0 0 "[ . 1 . 2]" 1
1460 1 96 VAL QG 1 124 PHE HB3 . . 4.050 3.365 3.080 3.641 . 0 0 "[ . 1 . 2]" 1
1461 1 58 ILE HA 1 58 ILE HG12 . . 4.050 2.890 2.689 3.195 . 0 0 "[ . 1 . 2]" 1
1462 1 96 VAL HA 1 127 GLN H . . 4.050 3.762 3.566 4.058 0.008 4 0 "[ . 1 . 2]" 1
1463 1 68 ARG HB2 1 68 ARG HD2 . . 4.040 3.539 2.320 4.068 0.028 6 0 "[ . 1 . 2]" 1
1464 1 38 GLU HG2 1 39 PRO HD3 . . 4.040 3.920 3.066 4.060 0.020 14 0 "[ . 1 . 2]" 1
1465 1 77 THR MG 1 78 GLU H . . 4.040 3.642 3.631 3.653 . 0 0 "[ . 1 . 2]" 1
1466 1 32 LEU HA 1 32 LEU HG . . 4.040 2.781 2.688 2.954 . 0 0 "[ . 1 . 2]" 1
1467 1 95 MET H 1 95 MET HG2 . . 4.040 3.602 3.312 3.894 . 0 0 "[ . 1 . 2]" 1
1468 1 26 ALA HA 1 29 HIS HB3 . . 4.040 3.269 3.158 3.331 . 0 0 "[ . 1 . 2]" 1
1469 1 111 GLN HE22 1 111 GLN HG2 . . 4.040 3.791 3.445 4.141 0.101 2 0 "[ . 1 . 2]" 1
1470 1 79 GLU HB3 1 92 THR MG . . 4.030 3.584 3.280 3.879 . 0 0 "[ . 1 . 2]" 1
1471 1 20 LYS HD2 1 48 ILE MG . . 4.030 3.230 1.782 3.953 . 0 0 "[ . 1 . 2]" 1
1472 1 125 THR H 1 125 THR MG . . 4.030 3.022 2.677 3.336 . 0 0 "[ . 1 . 2]" 1
1473 1 23 ILE H 1 23 ILE HG13 . . 4.030 3.902 3.720 3.986 . 0 0 "[ . 1 . 2]" 1
1474 1 62 ASP H 1 125 THR MG . . 4.030 3.438 2.777 3.878 . 0 0 "[ . 1 . 2]" 1
1475 1 27 LEU HA 1 31 CYS H . . 4.030 3.758 3.624 3.910 . 0 0 "[ . 1 . 2]" 1
1476 1 57 LEU H 1 70 LEU QD . . 4.030 2.871 2.124 3.576 . 0 0 "[ . 1 . 2]" 1
1477 1 130 LEU HA 1 130 LEU QD . . 2.760 2.003 1.883 2.184 . 0 0 "[ . 1 . 2]" 1
1478 1 32 LEU MD2 1 40 GLN HE22 . . 4.030 3.143 2.691 3.865 . 0 0 "[ . 1 . 2]" 1
1479 1 25 ASN HA 1 28 SER H . . 4.030 3.109 2.939 3.218 . 0 0 "[ . 1 . 2]" 1
1480 1 102 TYR QE 1 104 SER HB2 . . 4.030 3.672 2.886 4.153 0.123 11 0 "[ . 1 . 2]" 1
1481 1 59 LEU MD2 1 126 ILE MD . . 4.030 3.045 2.656 3.305 . 0 0 "[ . 1 . 2]" 1
1482 1 111 GLN HG2 1 112 ILE H . . 4.030 2.654 1.957 3.897 . 0 0 "[ . 1 . 2]" 1
1483 1 41 LYS HB2 1 41 LYS HE3 . . 4.020 3.759 3.442 4.070 0.050 11 0 "[ . 1 . 2]" 1
1484 1 73 LEU HB2 1 80 LEU MD1 . . 4.020 3.914 3.720 4.049 0.029 1 0 "[ . 1 . 2]" 1
1485 1 23 ILE HA 1 23 ILE HG12 . . 4.020 3.106 3.030 3.203 . 0 0 "[ . 1 . 2]" 1
1486 1 50 LYS H 1 50 LYS QD . . 4.020 3.963 3.749 4.053 0.033 7 0 "[ . 1 . 2]" 1
1487 1 73 LEU MD2 1 117 MET HG2 . . 4.020 2.790 1.984 3.802 . 0 0 "[ . 1 . 2]" 1
1488 1 108 ARG H 1 108 ARG QG . . 4.020 2.927 2.090 3.299 . 0 0 "[ . 1 . 2]" 1
1489 1 130 LEU H 1 130 LEU HB3 . . 4.010 3.473 3.398 3.546 . 0 0 "[ . 1 . 2]" 1
1490 1 50 LYS H 1 50 LYS HG3 . . 4.010 4.087 4.059 4.145 0.135 1 0 "[ . 1 . 2]" 1
1491 1 91 VAL MG1 1 95 MET HB3 . . 4.010 3.687 3.180 4.013 0.003 17 0 "[ . 1 . 2]" 1
1492 1 19 ASN HA 1 21 PHE H . . 4.010 3.917 3.782 4.018 0.008 7 0 "[ . 1 . 2]" 1
1493 1 120 SER HB3 1 121 VAL QG . . 4.010 3.766 3.578 3.938 . 0 0 "[ . 1 . 2]" 1
1494 1 78 GLU H 1 78 GLU HB2 . . 4.010 2.734 2.566 3.494 . 0 0 "[ . 1 . 2]" 1
1495 1 69 ALA MB 1 85 GLY HA3 . . 4.010 2.068 1.908 2.364 . 0 0 "[ . 1 . 2]" 1
1496 1 41 LYS HG3 1 45 LEU QD . . 4.010 2.503 1.917 3.199 . 0 0 "[ . 1 . 2]" 1
1497 1 27 LEU HB2 1 45 LEU QD . . 4.010 2.629 2.139 3.077 . 0 0 "[ . 1 . 2]" 1
1498 1 36 VAL HB 1 37 ASN H . . 4.010 3.731 3.194 4.016 0.006 1 0 "[ . 1 . 2]" 1
1499 1 82 ARG HA 1 82 ARG HG3 . . 4.010 2.754 2.547 2.955 . 0 0 "[ . 1 . 2]" 1
1500 1 88 PRO HD2 1 91 VAL MG2 . . 4.010 3.335 3.157 3.574 . 0 0 "[ . 1 . 2]" 1
1501 1 79 GLU HB3 1 80 LEU H . . 4.010 2.512 2.420 2.651 . 0 0 "[ . 1 . 2]" 1
1502 1 111 GLN HE22 1 111 GLN HG3 . . 4.010 3.627 3.446 3.991 . 0 0 "[ . 1 . 2]" 1
1503 1 27 LEU HA 1 27 LEU HG . . 4.010 3.360 3.313 3.399 . 0 0 "[ . 1 . 2]" 1
1504 1 117 MET HB2 1 117 MET ME . . 4.010 4.016 3.904 4.134 0.124 11 0 "[ . 1 . 2]" 1
1505 1 56 PHE HA 1 70 LEU QD . . 4.000 3.524 3.360 3.812 . 0 0 "[ . 1 . 2]" 1
1506 1 17 LYS HA 1 17 LYS QD . . 4.000 3.124 2.175 3.960 . 0 0 "[ . 1 . 2]" 1
1507 1 87 GLY HA3 1 88 PRO HD3 . . 4.000 2.375 2.299 2.502 . 0 0 "[ . 1 . 2]" 1
1508 1 20 LYS HE3 1 48 ILE MG . . 4.000 3.020 1.969 3.990 . 0 0 "[ . 1 . 2]" 1
1509 1 23 ILE HG13 1 56 PHE HB2 . . 4.000 2.210 1.998 2.571 . 0 0 "[ . 1 . 2]" 1
1510 1 38 GLU HA 1 41 LYS HB2 . . 4.000 3.920 3.832 4.012 0.012 12 0 "[ . 1 . 2]" 1
1511 1 13 GLU QB 1 14 PRO HD3 . . 3.950 3.322 2.942 3.495 . 0 0 "[ . 1 . 2]" 1
1512 1 80 LEU HB3 1 91 VAL HB . . 4.000 3.454 3.188 3.621 . 0 0 "[ . 1 . 2]" 1
1513 1 32 LEU MD1 1 40 GLN HG2 . . 4.000 2.936 2.538 3.244 . 0 0 "[ . 1 . 2]" 1
1514 1 70 LEU QD 1 71 TYR H . . 3.520 2.329 1.824 3.015 . 0 0 "[ . 1 . 2]" 1
1515 1 57 LEU HB2 1 124 PHE QE . . 3.990 3.159 2.794 3.665 . 0 0 "[ . 1 . 2]" 1
1516 1 97 GLU HB3 1 127 GLN HA . . 3.990 3.760 3.464 4.006 0.016 9 0 "[ . 1 . 2]" 1
1517 1 57 LEU MD1 1 72 THR HA . . 3.990 3.808 3.539 3.997 0.007 15 0 "[ . 1 . 2]" 1
1518 1 93 PRO HA 1 96 VAL H . . 3.990 3.022 2.949 3.175 . 0 0 "[ . 1 . 2]" 1
1519 1 42 ASN HB2 1 42 ASN HD22 . . 3.990 3.476 3.453 3.492 . 0 0 "[ . 1 . 2]" 1
1520 1 88 PRO HB3 1 91 VAL MG2 . . 3.990 3.999 3.917 4.036 0.046 10 0 "[ . 1 . 2]" 1
1521 1 61 ARG HA 1 61 ARG HD3 . . 3.990 3.382 2.366 3.877 . 0 0 "[ . 1 . 2]" 1
1522 1 60 PHE H 1 125 THR MG . . 3.990 2.840 2.386 3.297 . 0 0 "[ . 1 . 2]" 1
1523 1 19 ASN HB2 1 22 ILE HB . . 3.980 2.270 1.998 2.621 . 0 0 "[ . 1 . 2]" 1
1524 1 128 GLY HA3 1 131 TRP HD1 . . 3.980 3.894 3.660 3.984 0.004 13 0 "[ . 1 . 2]" 1
1525 1 111 GLN HB3 1 111 GLN HE21 . . 3.980 4.146 3.812 4.526 0.546 16 2 "[ . 1 .+- 2]" 1
1526 1 99 ILE MG 1 124 PHE HA . . 3.980 3.018 2.771 3.207 . 0 0 "[ . 1 . 2]" 1
1527 1 57 LEU HB3 1 124 PHE QE . . 3.980 2.549 2.160 3.341 . 0 0 "[ . 1 . 2]" 1
1528 1 100 TYR HA 1 100 TYR QD . . 3.980 3.266 3.163 3.316 . 0 0 "[ . 1 . 2]" 1
1529 1 127 GLN H 1 127 GLN HB2 . . 3.980 2.157 2.087 2.399 . 0 0 "[ . 1 . 2]" 1
1530 1 69 ALA HA 1 86 TYR H . . 3.980 3.940 3.695 4.043 0.063 20 0 "[ . 1 . 2]" 1
1531 1 51 SER QB 1 56 PHE HZ . . 3.980 2.531 2.008 3.810 . 0 0 "[ . 1 . 2]" 1
1532 1 56 PHE QE 1 83 LEU MD1 . . 3.970 3.358 3.066 3.666 . 0 0 "[ . 1 . 2]" 1
1533 1 40 GLN HA 1 43 ARG HB2 . . 3.970 2.361 2.008 2.501 . 0 0 "[ . 1 . 2]" 1
1534 1 89 ARG HA 1 89 ARG HG2 . . 3.970 3.444 2.832 3.704 . 0 0 "[ . 1 . 2]" 1
1535 1 69 ALA HA 1 85 GLY HA3 . . 3.970 2.690 2.500 2.807 . 0 0 "[ . 1 . 2]" 1
1536 1 61 ARG H 1 61 ARG HB2 . . 3.970 2.326 2.102 2.602 . 0 0 "[ . 1 . 2]" 1
1537 1 47 GLU HG2 1 84 ALA MB . . 3.970 3.438 2.499 3.744 . 0 0 "[ . 1 . 2]" 1
1538 1 20 LYS HE2 1 20 LYS HG2 . . 3.970 3.466 3.017 3.813 . 0 0 "[ . 1 . 2]" 1
1539 1 118 SER HB3 1 121 VAL QG . . 3.970 3.054 2.251 3.730 . 0 0 "[ . 1 . 2]" 1
1540 1 104 SER H 1 104 SER HB2 . . 3.970 2.185 2.056 3.586 . 0 0 "[ . 1 . 2]" 1
1541 1 40 GLN HB2 1 41 LYS H . . 3.970 3.984 3.949 4.075 0.105 16 0 "[ . 1 . 2]" 1
1542 1 95 MET H 1 95 MET HB2 . . 3.970 2.275 2.191 2.390 . 0 0 "[ . 1 . 2]" 1
1543 1 100 TYR HA 1 112 ILE HG12 . . 3.970 2.078 1.979 2.678 . 0 0 "[ . 1 . 2]" 1
1544 1 88 PRO HG2 1 126 ILE MD . . 3.970 3.161 2.947 3.360 . 0 0 "[ . 1 . 2]" 1
1545 1 104 SER H 1 104 SER HB3 . . 3.970 3.162 2.539 3.421 . 0 0 "[ . 1 . 2]" 1
1546 1 73 LEU HA 1 73 LEU MD2 . . 3.970 3.812 3.755 3.862 . 0 0 "[ . 1 . 2]" 1
1547 1 93 PRO HB2 1 94 ALA H . . 3.970 3.905 3.875 3.943 . 0 0 "[ . 1 . 2]" 1
1548 1 51 SER HG 1 83 LEU MD1 . . 3.970 3.234 2.428 3.864 . 0 0 "[ . 1 . 2]" 1
1549 1 100 TYR QE 1 111 GLN HB2 . . 3.970 3.239 2.385 3.995 0.025 13 0 "[ . 1 . 2]" 1
1550 1 54 ASN H 1 54 ASN QB . . 3.810 2.691 2.116 3.033 . 0 0 "[ . 1 . 2]" 1
1551 1 103 ASN H 1 109 PHE HA . . 3.960 2.781 2.385 3.039 . 0 0 "[ . 1 . 2]" 1
1552 1 67 PHE QD 1 70 LEU QD . . 3.960 3.833 3.587 3.962 0.002 13 0 "[ . 1 . 2]" 1
1553 1 107 LYS HE2 1 107 LYS HG3 . . 3.960 2.913 2.063 3.801 . 0 0 "[ . 1 . 2]" 1
1554 1 48 ILE MG 1 49 GLU QG . . 3.960 3.447 3.056 3.649 . 0 0 "[ . 1 . 2]" 1
1555 1 41 LYS QD 1 45 LEU QD . . 3.960 2.455 1.804 2.778 . 0 0 "[ . 1 . 2]" 1
1556 1 10 LEU HA 1 10 LEU MD1 . . 3.960 3.361 2.014 3.974 0.014 1 0 "[ . 1 . 2]" 1
1557 1 127 GLN HB2 1 129 HIS HE1 . . 3.960 3.469 2.760 3.958 . 0 0 "[ . 1 . 2]" 1
1558 1 99 ILE MG 1 100 TYR H . . 3.960 3.306 3.139 3.612 . 0 0 "[ . 1 . 2]" 1
1559 1 66 GLN H 1 66 GLN HG2 . . 3.950 3.401 1.975 3.959 0.009 2 0 "[ . 1 . 2]" 1
1560 1 40 GLN HA 1 43 ARG HB3 . . 3.950 3.928 3.568 4.030 0.080 4 0 "[ . 1 . 2]" 1
1561 1 91 VAL MG2 1 92 THR H . . 3.950 3.864 3.743 3.983 0.033 5 0 "[ . 1 . 2]" 1
1562 1 87 GLY HA3 1 88 PRO HD2 . . 3.950 2.230 2.208 2.282 . 0 0 "[ . 1 . 2]" 1
1563 1 102 TYR H 1 122 ASP HB2 . . 3.950 2.665 2.262 2.966 . 0 0 "[ . 1 . 2]" 1
1564 1 74 SER QB 1 77 THR H . . 3.940 2.397 2.212 2.543 . 0 0 "[ . 1 . 2]" 1
1565 1 63 SER H 1 63 SER HB3 . . 3.940 3.619 2.942 3.986 0.046 3 0 "[ . 1 . 2]" 1
1566 1 52 LYS HA 1 52 LYS HD2 . . 3.940 3.354 2.499 3.903 . 0 0 "[ . 1 . 2]" 1
1567 1 112 ILE H 1 112 ILE HG12 . . 3.940 1.939 1.819 2.277 . 0 0 "[ . 1 . 2]" 1
1568 1 99 ILE MG 1 124 PHE QD . . 3.940 3.918 3.740 3.958 0.018 19 0 "[ . 1 . 2]" 1
1569 1 91 VAL H 1 91 VAL MG1 . . 3.940 3.819 3.727 3.872 . 0 0 "[ . 1 . 2]" 1
1570 1 73 LEU MD2 1 80 LEU MD1 . . 3.940 3.899 3.737 3.980 0.040 6 0 "[ . 1 . 2]" 1
1571 1 43 ARG HB3 1 44 ILE H . . 3.930 3.710 3.548 3.939 0.009 8 0 "[ . 1 . 2]" 1
1572 1 30 CYS HB3 1 31 CYS H . . 3.930 3.049 2.778 3.358 . 0 0 "[ . 1 . 2]" 1
1573 1 50 LYS HB3 1 50 LYS QE . . 3.930 2.606 2.238 2.958 . 0 0 "[ . 1 . 2]" 1
1574 1 59 LEU MD1 1 124 PHE QD . . 3.930 3.632 3.103 3.874 . 0 0 "[ . 1 . 2]" 1
1575 1 25 ASN HB3 1 29 HIS HD2 . . 3.930 2.791 2.146 3.143 . 0 0 "[ . 1 . 2]" 1
1576 1 30 CYS H 1 30 CYS HB3 . . 3.930 3.616 3.287 3.855 . 0 0 "[ . 1 . 2]" 1
1577 1 71 TYR HH 1 91 VAL MG2 . . 3.930 3.801 3.510 3.934 0.004 12 0 "[ . 1 . 2]" 1
1578 1 27 LEU MD2 1 31 CYS QB . . 3.520 2.377 2.155 2.627 . 0 0 "[ . 1 . 2]" 1
1579 1 64 SER H 1 64 SER HB2 . . 3.930 3.196 2.100 3.995 0.065 19 0 "[ . 1 . 2]" 1
1580 1 107 LYS HE3 1 107 LYS HG2 . . 3.920 3.221 2.323 3.948 0.028 6 0 "[ . 1 . 2]" 1
1581 1 50 LYS QE 1 50 LYS HG2 . . 3.920 3.347 3.304 3.475 . 0 0 "[ . 1 . 2]" 1
1582 1 99 ILE MD 1 112 ILE HB . . 3.920 2.100 1.971 2.371 . 0 0 "[ . 1 . 2]" 1
1583 1 20 LYS HE3 1 20 LYS HG2 . . 3.920 3.449 2.340 3.958 0.038 9 0 "[ . 1 . 2]" 1
1584 1 121 VAL HA 1 123 ALA H . . 3.920 3.631 3.331 3.897 . 0 0 "[ . 1 . 2]" 1
1585 1 56 PHE HA 1 56 PHE QD . . 3.910 2.982 2.811 3.228 . 0 0 "[ . 1 . 2]" 1
1586 1 112 ILE HA 1 112 ILE HG13 . . 3.910 3.907 3.759 3.939 0.029 18 0 "[ . 1 . 2]" 1
1587 1 103 ASN H 1 103 ASN HB3 . . 3.910 3.307 3.137 3.559 . 0 0 "[ . 1 . 2]" 1
1588 1 73 LEU HA 1 80 LEU HA . . 3.910 2.188 1.983 2.720 . 0 0 "[ . 1 . 2]" 1
1589 1 48 ILE MG 1 49 GLU HA . . 3.900 3.591 3.367 3.699 . 0 0 "[ . 1 . 2]" 1
1590 1 97 GLU H 1 97 GLU HB3 . . 3.900 2.452 2.363 2.567 . 0 0 "[ . 1 . 2]" 1
1591 1 101 LYS HB3 1 112 ILE MD . . 3.900 1.864 1.830 1.939 . 0 0 "[ . 1 . 2]" 1
1592 1 80 LEU MD1 1 124 PHE HZ . . 3.900 3.463 2.982 3.898 . 0 0 "[ . 1 . 2]" 1
1593 1 38 GLU H 1 39 PRO HD3 . . 3.900 2.032 2.009 2.085 . 0 0 "[ . 1 . 2]" 1
1594 1 88 PRO HG2 1 95 MET ME . . 3.900 3.501 3.200 3.752 . 0 0 "[ . 1 . 2]" 1
1595 1 58 ILE HB 1 123 ALA HA . . 3.900 3.026 2.682 3.352 . 0 0 "[ . 1 . 2]" 1
1596 1 80 LEU MD1 1 124 PHE QE . . 3.900 2.725 2.317 3.317 . 0 0 "[ . 1 . 2]" 1
1597 1 110 THR H 1 110 THR MG . . 3.900 3.860 3.802 3.939 0.039 19 0 "[ . 1 . 2]" 1
1598 1 112 ILE HA 1 112 ILE HG12 . . 3.900 3.250 2.704 3.536 . 0 0 "[ . 1 . 2]" 1
1599 1 74 SER QB 1 79 GLU H . . 3.890 3.364 2.903 3.818 . 0 0 "[ . 1 . 2]" 1
1600 1 66 GLN HA 1 66 GLN HG3 . . 3.890 3.396 2.635 3.880 . 0 0 "[ . 1 . 2]" 1
1601 1 109 PHE HA 1 109 PHE QD . . 3.890 2.505 1.988 3.146 . 0 0 "[ . 1 . 2]" 1
1602 1 55 HIS HA 1 55 HIS HD2 . . 3.890 2.484 2.349 2.710 . 0 0 "[ . 1 . 2]" 1
1603 1 108 ARG HB2 1 109 PHE H . . 3.890 3.051 2.112 3.411 . 0 0 "[ . 1 . 2]" 1
1604 1 107 LYS HE3 1 107 LYS HG3 . . 3.890 2.837 2.264 3.613 . 0 0 "[ . 1 . 2]" 1
1605 1 70 LEU HB3 1 83 LEU MD2 . . 3.890 3.274 3.021 3.475 . 0 0 "[ . 1 . 2]" 1
1606 1 47 GLU HB3 1 83 LEU MD1 . . 3.890 2.668 2.364 2.961 . 0 0 "[ . 1 . 2]" 1
1607 1 45 LEU HA 1 45 LEU QD . . 2.740 2.024 1.859 2.293 . 0 0 "[ . 1 . 2]" 1
1608 1 40 GLN HE22 1 40 GLN HG2 . . 3.890 3.625 3.457 4.087 0.197 2 0 "[ . 1 . 2]" 1
1609 1 119 MET HA 1 119 MET HG3 . . 3.890 2.990 2.314 3.771 . 0 0 "[ . 1 . 2]" 1
1610 1 87 GLY HA2 1 88 PRO HD2 . . 3.890 3.474 3.356 3.544 . 0 0 "[ . 1 . 2]" 1
1611 1 115 LYS H 1 115 LYS HB3 . . 3.890 3.291 3.206 3.376 . 0 0 "[ . 1 . 2]" 1
1612 1 41 LYS HE3 1 45 LEU QD . . 3.890 3.108 2.873 3.890 0.000 15 0 "[ . 1 . 2]" 1
1613 1 115 LYS HA 1 115 LYS QD . . 3.880 3.089 2.470 3.785 . 0 0 "[ . 1 . 2]" 1
1614 1 57 LEU HB2 1 80 LEU MD2 . . 3.880 2.239 1.939 2.475 . 0 0 "[ . 1 . 2]" 1
1615 1 47 GLU HB3 1 83 LEU MD2 . . 3.880 2.655 2.213 2.856 . 0 0 "[ . 1 . 2]" 1
1616 1 101 LYS H 1 101 LYS HB3 . . 3.880 2.949 2.767 3.297 . 0 0 "[ . 1 . 2]" 1
1617 1 132 GLN H 1 132 GLN HB2 . . 3.880 2.609 2.042 3.753 . 0 0 "[ . 1 . 2]" 1
1618 1 100 TYR QD 1 111 GLN HB2 . . 3.880 2.935 2.199 3.586 . 0 0 "[ . 1 . 2]" 1
1619 1 18 SER H 1 18 SER QB . . 3.830 2.831 2.228 3.494 . 0 0 "[ . 1 . 2]" 1
1620 1 43 ARG HB2 1 44 ILE H . . 3.880 2.864 2.662 3.214 . 0 0 "[ . 1 . 2]" 1
1621 1 88 PRO HG3 1 126 ILE MD . . 3.880 2.539 2.215 2.852 . 0 0 "[ . 1 . 2]" 1
1622 1 107 LYS HE2 1 107 LYS HG2 . . 3.880 2.819 2.123 3.675 . 0 0 "[ . 1 . 2]" 1
1623 1 60 PHE QD 1 67 PHE HA . . 3.880 3.247 2.412 3.886 0.006 9 0 "[ . 1 . 2]" 1
1624 1 123 ALA HA 1 124 PHE QD . . 3.870 2.852 2.639 3.066 . 0 0 "[ . 1 . 2]" 1
1625 1 41 LYS HB2 1 41 LYS HE2 . . 3.870 3.246 2.589 4.077 0.207 9 0 "[ . 1 . 2]" 1
1626 1 59 LEU MD2 1 131 TRP HZ2 . . 3.870 2.978 2.045 3.571 . 0 0 "[ . 1 . 2]" 1
1627 1 24 HIS HD2 1 45 LEU QD . . 3.870 3.648 2.584 3.844 . 0 0 "[ . 1 . 2]" 1
1628 1 44 ILE HA 1 84 ALA MB . . 3.870 3.454 3.089 3.692 . 0 0 "[ . 1 . 2]" 1
1629 1 90 THR H 1 90 THR MG . . 3.870 3.779 3.693 3.884 0.014 8 0 "[ . 1 . 2]" 1
1630 1 43 ARG H 1 43 ARG HG3 . . 3.870 2.991 2.641 3.310 . 0 0 "[ . 1 . 2]" 1
1631 1 41 LYS HE3 1 41 LYS HG2 . . 3.870 2.566 2.343 4.081 0.211 15 0 "[ . 1 . 2]" 1
1632 1 56 PHE HB2 1 70 LEU QD . . 3.870 3.353 3.157 3.561 . 0 0 "[ . 1 . 2]" 1
1633 1 106 ARG HB2 1 108 ARG QG . . 3.870 3.377 2.140 3.802 . 0 0 "[ . 1 . 2]" 1
1634 1 73 LEU MD2 1 117 MET ME . . 3.870 3.688 3.442 3.891 0.021 6 0 "[ . 1 . 2]" 1
1635 1 74 SER QB 1 77 THR MG . . 3.870 3.253 2.921 3.434 . 0 0 "[ . 1 . 2]" 1
1636 1 52 LYS HA 1 52 LYS HD3 . . 3.860 3.125 2.036 3.935 0.075 4 0 "[ . 1 . 2]" 1
1637 1 25 ASN HB2 1 26 ALA H . . 3.860 2.818 2.635 3.121 . 0 0 "[ . 1 . 2]" 1
1638 1 57 LEU HA 1 57 LEU MD2 . . 3.860 3.500 3.391 3.613 . 0 0 "[ . 1 . 2]" 1
1639 1 57 LEU HA 1 123 ALA HA . . 3.860 3.768 3.279 3.879 0.019 1 0 "[ . 1 . 2]" 1
1640 1 59 LEU MD2 1 131 TRP HH2 . . 3.860 2.256 1.866 2.885 . 0 0 "[ . 1 . 2]" 1
1641 1 73 LEU HA 1 80 LEU MD2 . . 3.860 2.175 1.968 2.617 . 0 0 "[ . 1 . 2]" 1
1642 1 58 ILE MD 1 123 ALA MB . . 3.860 3.374 2.918 3.802 . 0 0 "[ . 1 . 2]" 1
1643 1 73 LEU HA 1 81 SER H . . 3.860 3.834 3.455 3.894 0.034 1 0 "[ . 1 . 2]" 1
1644 1 77 THR MG 1 79 GLU H . . 3.860 3.983 3.884 4.060 0.200 17 0 "[ . 1 . 2]" 1
1645 1 107 LYS HA 1 107 LYS HG3 . . 3.860 2.837 2.392 3.687 . 0 0 "[ . 1 . 2]" 1
1646 1 88 PRO HG2 1 91 VAL MG2 . . 3.850 1.945 1.877 2.067 . 0 0 "[ . 1 . 2]" 1
1647 1 11 TYR H 1 11 TYR HB3 . . 3.850 3.224 2.731 3.626 . 0 0 "[ . 1 . 2]" 1
1648 1 107 LYS HB2 1 107 LYS HD3 . . 3.850 2.976 2.100 3.833 . 0 0 "[ . 1 . 2]" 1
1649 1 80 LEU HB3 1 81 SER H . . 3.850 2.442 1.931 3.360 . 0 0 "[ . 1 . 2]" 1
1650 1 95 MET H 1 95 MET HG3 . . 3.850 3.033 2.731 3.346 . 0 0 "[ . 1 . 2]" 1
1651 1 44 ILE HA 1 47 GLU H . . 3.850 3.422 3.173 3.654 . 0 0 "[ . 1 . 2]" 1
1652 1 106 ARG H 1 106 ARG HG3 . . 3.850 3.443 2.829 3.684 . 0 0 "[ . 1 . 2]" 1
1653 1 19 ASN HD22 1 122 ASP HA . . 3.850 3.061 2.259 3.744 . 0 0 "[ . 1 . 2]" 1
1654 1 25 ASN HA 1 28 SER HB2 . . 3.850 2.735 2.566 2.926 . 0 0 "[ . 1 . 2]" 1
1655 1 96 VAL H 1 96 VAL QG . . 2.960 2.216 1.931 2.397 . 0 0 "[ . 1 . 2]" 1
1656 1 30 CYS H 1 30 CYS HB2 . . 3.850 3.241 3.063 3.521 . 0 0 "[ . 1 . 2]" 1
1657 1 76 GLU HB2 1 77 THR MG . . 3.840 2.823 2.622 3.003 . 0 0 "[ . 1 . 2]" 1
1658 1 60 PHE HB3 1 125 THR MG . . 3.840 3.097 2.623 3.405 . 0 0 "[ . 1 . 2]" 1
1659 1 129 HIS HD2 1 130 LEU QD . . 3.840 2.730 1.978 3.779 . 0 0 "[ . 1 . 2]" 1
1660 1 25 ASN HA 1 29 HIS HD2 . . 3.840 3.494 3.145 3.759 . 0 0 "[ . 1 . 2]" 1
1661 1 91 VAL MG1 1 95 MET HB2 . . 3.840 2.860 2.679 2.964 . 0 0 "[ . 1 . 2]" 1
1662 1 111 GLN HA 1 111 GLN HG2 . . 3.840 2.912 2.009 3.667 . 0 0 "[ . 1 . 2]" 1
1663 1 117 MET HA 1 117 MET HG3 . . 3.840 2.913 2.227 3.656 . 0 0 "[ . 1 . 2]" 1
1664 1 35 LYS HB2 1 36 VAL H . . 3.840 3.813 3.325 3.959 0.119 5 0 "[ . 1 . 2]" 1
1665 1 86 TYR H 1 86 TYR HB2 . . 3.840 3.192 2.385 3.867 0.027 10 0 "[ . 1 . 2]" 1
1666 1 106 ARG HB3 1 108 ARG QG . . 3.830 2.368 1.992 3.005 . 0 0 "[ . 1 . 2]" 1
1667 1 87 GLY HA2 1 88 PRO HD3 . . 3.830 2.665 2.531 2.748 . 0 0 "[ . 1 . 2]" 1
1668 1 72 THR MG 1 73 LEU H . . 3.830 3.838 3.779 3.858 0.028 12 0 "[ . 1 . 2]" 1
1669 1 100 TYR HA 1 112 ILE H . . 3.830 2.679 1.944 2.906 . 0 0 "[ . 1 . 2]" 1
1670 1 58 ILE MG 1 67 PHE QE . . 3.830 3.360 3.073 3.663 . 0 0 "[ . 1 . 2]" 1
1671 1 59 LEU MD1 1 126 ILE H . . 3.830 2.630 2.318 2.828 . 0 0 "[ . 1 . 2]" 1
1672 1 86 TYR H 1 86 TYR HB3 . . 3.820 3.171 2.401 3.801 . 0 0 "[ . 1 . 2]" 1
1673 1 47 GLU HB2 1 84 ALA MB . . 3.820 3.189 3.044 3.388 . 0 0 "[ . 1 . 2]" 1
1674 1 23 ILE H 1 23 ILE HG12 . . 3.810 2.569 2.315 2.718 . 0 0 "[ . 1 . 2]" 1
1675 1 99 ILE H 1 99 ILE MG . . 3.810 3.417 3.238 3.546 . 0 0 "[ . 1 . 2]" 1
1676 1 105 ASP HB3 1 106 ARG H . . 3.810 3.190 2.863 3.435 . 0 0 "[ . 1 . 2]" 1
1677 1 83 LEU HA 1 83 LEU MD2 . . 3.810 3.861 3.788 3.911 0.101 3 0 "[ . 1 . 2]" 1
1678 1 99 ILE MG 1 124 PHE HB2 . . 3.810 2.484 2.285 2.610 . 0 0 "[ . 1 . 2]" 1
1679 1 28 SER H 1 28 SER HB3 . . 3.810 3.393 3.157 3.507 . 0 0 "[ . 1 . 2]" 1
1680 1 70 LEU HA 1 70 LEU QD . . 3.210 2.189 1.903 2.755 . 0 0 "[ . 1 . 2]" 1
1681 1 41 LYS HB3 1 41 LYS HE3 . . 3.810 2.428 1.989 2.957 . 0 0 "[ . 1 . 2]" 1
1682 1 139 SER QB 1 140 SER H . . 3.810 2.879 2.045 3.804 . 0 0 "[ . 1 . 2]" 1
1683 1 27 LEU HA 1 32 LEU H . . 3.810 2.366 2.077 2.737 . 0 0 "[ . 1 . 2]" 1
1684 1 112 ILE HA 1 113 PRO QG . . 3.810 3.856 3.838 3.861 0.051 4 0 "[ . 1 . 2]" 1
1685 1 41 LYS HA 1 41 LYS HG2 . . 3.800 3.075 2.623 3.338 . 0 0 "[ . 1 . 2]" 1
1686 1 9 ARG HA 1 9 ARG QD . . 3.800 3.217 2.333 3.812 0.012 13 0 "[ . 1 . 2]" 1
1687 1 38 GLU HA 1 41 LYS HE2 . . 3.800 2.387 1.950 3.180 . 0 0 "[ . 1 . 2]" 1
1688 1 88 PRO HG3 1 95 MET ME . . 3.800 3.334 3.138 3.585 . 0 0 "[ . 1 . 2]" 1
1689 1 97 GLU HB2 1 127 GLN H . . 3.800 3.759 3.570 3.836 0.036 17 0 "[ . 1 . 2]" 1
1690 1 48 ILE HA 1 51 SER QB . . 3.800 2.487 2.144 3.510 . 0 0 "[ . 1 . 2]" 1
1691 1 21 PHE HA 1 24 HIS HB2 . . 3.800 2.399 2.190 2.647 . 0 0 "[ . 1 . 2]" 1
1692 1 135 LYS HA 1 135 LYS QD . . 3.800 3.345 2.765 3.792 . 0 0 "[ . 1 . 2]" 1
1693 1 107 LYS HA 1 107 LYS HG2 . . 3.800 2.721 2.145 3.840 0.040 17 0 "[ . 1 . 2]" 1
1694 1 101 LYS HA 1 122 ASP HB2 . . 3.800 2.327 2.001 2.429 . 0 0 "[ . 1 . 2]" 1
1695 1 52 LYS HA 1 52 LYS QG . . 3.360 2.260 2.012 2.641 . 0 0 "[ . 1 . 2]" 1
1696 1 27 LEU HA 1 31 CYS QB . . 3.580 2.065 1.973 2.249 . 0 0 "[ . 1 . 2]" 1
1697 1 51 SER HA 1 51 SER HG . . 3.800 3.032 2.187 3.798 . 0 0 "[ . 1 . 2]" 1
1698 1 108 ARG HB2 1 108 ARG HD3 . . 3.800 3.909 2.172 4.275 0.475 7 0 "[ . 1 . 2]" 1
1699 1 41 LYS HA 1 44 ILE HB . . 3.790 2.867 2.553 3.041 . 0 0 "[ . 1 . 2]" 1
1700 1 89 ARG H 1 89 ARG QB . . 3.790 2.219 2.168 2.452 . 0 0 "[ . 1 . 2]" 1
1701 1 15 SER H 1 15 SER HB3 . . 3.790 3.371 2.461 3.808 0.018 6 0 "[ . 1 . 2]" 1
1702 1 43 ARG HB2 1 43 ARG QD . . 3.790 3.097 2.968 3.201 . 0 0 "[ . 1 . 2]" 1
1703 1 97 GLU QG 1 127 GLN HA . . 3.790 3.692 3.403 3.802 0.012 8 0 "[ . 1 . 2]" 1
1704 1 47 GLU HA 1 50 LYS H . . 3.790 3.323 3.164 3.616 . 0 0 "[ . 1 . 2]" 1
1705 1 22 ILE HB 1 23 ILE H . . 3.780 3.058 2.738 3.175 . 0 0 "[ . 1 . 2]" 1
1706 1 108 ARG HA 1 108 ARG QG . . 3.780 2.597 2.127 3.420 . 0 0 "[ . 1 . 2]" 1
1707 1 133 SER H 1 133 SER HB3 . . 3.780 3.464 2.266 4.090 0.310 6 0 "[ . 1 . 2]" 1
1708 1 73 LEU MD2 1 117 MET HG3 . . 3.780 2.333 1.978 2.707 . 0 0 "[ . 1 . 2]" 1
1709 1 60 PHE HZ 1 123 ALA MB . . 3.780 2.634 1.929 3.384 . 0 0 "[ . 1 . 2]" 1
1710 1 67 PHE HA 1 67 PHE QD . . 3.780 3.221 3.111 3.311 . 0 0 "[ . 1 . 2]" 1
1711 1 100 TYR QD 1 111 GLN HA . . 3.780 2.617 2.265 2.982 . 0 0 "[ . 1 . 2]" 1
1712 1 66 GLN H 1 66 GLN HG3 . . 3.770 3.464 2.279 3.903 0.133 16 0 "[ . 1 . 2]" 1
1713 1 13 GLU QG 1 14 PRO HD3 . . 3.770 3.068 2.494 4.306 0.536 8 3 "[ *- + 1 . 2]" 1
1714 1 20 LYS HA 1 23 ILE HB . . 3.770 2.886 2.772 2.959 . 0 0 "[ . 1 . 2]" 1
1715 1 127 GLN HB2 1 130 LEU QD . . 3.770 2.063 1.967 2.217 . 0 0 "[ . 1 . 2]" 1
1716 1 99 ILE HB 1 112 ILE HG12 . . 3.770 3.014 2.486 4.175 0.405 11 0 "[ . 1 . 2]" 1
1717 1 27 LEU H 1 27 LEU MD2 . . 3.770 2.876 2.772 3.020 . 0 0 "[ . 1 . 2]" 1
1718 1 62 ASP HA 1 125 THR MG . . 3.770 3.452 2.784 3.768 . 0 0 "[ . 1 . 2]" 1
1719 1 132 GLN H 1 132 GLN QG . . 3.770 2.606 1.902 3.527 . 0 0 "[ . 1 . 2]" 1
1720 1 76 GLU HB3 1 77 THR MG . . 3.770 3.848 3.802 3.927 0.157 17 0 "[ . 1 . 2]" 1
1721 1 42 ASN H 1 42 ASN HB3 . . 3.770 3.502 3.478 3.548 . 0 0 "[ . 1 . 2]" 1
1722 1 107 LYS HB2 1 107 LYS HD2 . . 3.770 2.581 2.036 3.462 . 0 0 "[ . 1 . 2]" 1
1723 1 32 LEU MD2 1 67 PHE QE . . 3.760 3.268 2.546 3.765 0.005 20 0 "[ . 1 . 2]" 1
1724 1 57 LEU MD1 1 121 VAL QG . . 3.760 3.299 3.033 3.626 . 0 0 "[ . 1 . 2]" 1
1725 1 83 LEU MD1 1 84 ALA MB . . 3.760 3.770 3.697 3.807 0.047 5 0 "[ . 1 . 2]" 1
1726 1 27 LEU H 1 27 LEU MD1 . . 3.760 3.743 3.665 3.785 0.025 16 0 "[ . 1 . 2]" 1
1727 1 73 LEU MD2 1 117 MET HB3 . . 3.760 2.109 1.904 2.667 . 0 0 "[ . 1 . 2]" 1
1728 1 88 PRO HG3 1 91 VAL MG2 . . 3.760 3.175 3.071 3.268 . 0 0 "[ . 1 . 2]" 1
1729 1 40 GLN HE22 1 40 GLN HG3 . . 3.760 3.807 3.460 4.131 0.371 14 0 "[ . 1 . 2]" 1
1730 1 57 LEU MD2 1 121 VAL QG . . 3.170 1.803 1.689 2.067 . 0 0 "[ . 1 . 2]" 1
1731 1 22 ILE HA 1 22 ILE HG12 . . 3.750 2.640 2.559 2.696 . 0 0 "[ . 1 . 2]" 1
1732 1 40 GLN HG3 1 44 ILE MD . . 3.750 2.161 2.020 2.349 . 0 0 "[ . 1 . 2]" 1
1733 1 73 LEU MD1 1 80 LEU HA . . 3.750 2.856 2.542 3.359 . 0 0 "[ . 1 . 2]" 1
1734 1 57 LEU H 1 57 LEU MD1 . . 3.750 2.882 2.461 3.417 . 0 0 "[ . 1 . 2]" 1
1735 1 57 LEU HB3 1 124 PHE QD . . 3.750 2.078 1.997 2.550 . 0 0 "[ . 1 . 2]" 1
1736 1 22 ILE HA 1 25 ASN HB2 . . 3.750 3.305 3.115 3.554 . 0 0 "[ . 1 . 2]" 1
1737 1 126 ILE HB 1 127 GLN H . . 3.740 2.431 2.217 2.743 . 0 0 "[ . 1 . 2]" 1
1738 1 58 ILE HA 1 70 LEU HA . . 3.740 2.860 2.529 3.335 . 0 0 "[ . 1 . 2]" 1
1739 1 100 TYR HB3 1 123 ALA MB . . 3.740 3.265 3.029 3.532 . 0 0 "[ . 1 . 2]" 1
1740 1 97 GLU HB2 1 127 GLN HA . . 3.730 2.270 2.057 2.400 . 0 0 "[ . 1 . 2]" 1
1741 1 68 ARG HA 1 68 ARG HD2 . . 3.730 2.695 1.991 3.716 . 0 0 "[ . 1 . 2]" 1
1742 1 80 LEU HA 1 80 LEU HG . . 3.730 2.462 2.419 2.533 . 0 0 "[ . 1 . 2]" 1
1743 1 56 PHE HA 1 72 THR MG . . 3.730 3.088 2.468 3.316 . 0 0 "[ . 1 . 2]" 1
1744 1 128 GLY HA2 1 131 TRP HD1 . . 3.730 2.227 2.032 2.381 . 0 0 "[ . 1 . 2]" 1
1745 1 79 GLU HG3 1 90 THR MG . . 3.730 3.756 3.742 3.768 0.038 7 0 "[ . 1 . 2]" 1
1746 1 35 LYS HB3 1 36 VAL H . . 3.720 3.045 2.498 4.157 0.437 13 0 "[ . 1 . 2]" 1
1747 1 72 THR H 1 72 THR MG . . 3.720 3.015 2.829 3.215 . 0 0 "[ . 1 . 2]" 1
1748 1 41 LYS HG2 1 45 LEU QD . . 3.720 1.901 1.744 2.149 . 0 0 "[ . 1 . 2]" 1
1749 1 32 LEU MD2 1 67 PHE QB . . 3.720 2.596 2.114 3.691 . 0 0 "[ . 1 . 2]" 1
1750 1 43 ARG HA 1 46 GLU H . . 3.720 3.691 3.468 3.815 0.095 12 0 "[ . 1 . 2]" 1
1751 1 48 ILE HA 1 48 ILE HG13 . . 3.720 2.838 2.664 3.045 . 0 0 "[ . 1 . 2]" 1
1752 1 48 ILE H 1 48 ILE HG13 . . 3.710 2.019 1.944 2.161 . 0 0 "[ . 1 . 2]" 1
1753 1 109 PHE QD 1 123 ALA MB . . 3.710 3.200 2.324 3.719 0.009 11 0 "[ . 1 . 2]" 1
1754 1 47 GLU HA 1 50 LYS QE . . 3.710 3.758 3.694 3.863 0.153 19 0 "[ . 1 . 2]" 1
1755 1 58 ILE H 1 123 ALA MB . . 3.710 3.538 3.181 3.682 . 0 0 "[ . 1 . 2]" 1
1756 1 79 GLU HA 1 79 GLU HG3 . . 3.710 2.334 2.286 2.356 . 0 0 "[ . 1 . 2]" 1
1757 1 96 VAL QG 1 124 PHE HB2 . . 3.710 2.136 1.824 2.618 . 0 0 "[ . 1 . 2]" 1
1758 1 59 LEU MD1 1 125 THR MG . . 4.670 4.033 3.367 4.308 . 0 0 "[ . 1 . 2]" 1
1759 1 56 PHE QD 1 83 LEU MD2 . . 3.700 2.341 2.184 2.486 . 0 0 "[ . 1 . 2]" 1
1760 1 22 ILE H 1 22 ILE HG13 . . 3.700 2.166 2.053 2.245 . 0 0 "[ . 1 . 2]" 1
1761 1 83 LEU HA 1 83 LEU HG . . 3.700 3.174 3.132 3.216 . 0 0 "[ . 1 . 2]" 1
1762 1 66 GLN HA 1 66 GLN HG2 . . 3.700 2.544 2.123 3.695 . 0 0 "[ . 1 . 2]" 1
1763 1 120 SER H 1 120 SER HB2 . . 3.700 2.358 2.162 3.007 . 0 0 "[ . 1 . 2]" 1
1764 1 71 TYR HA 1 83 LEU H . . 3.700 2.016 1.919 2.222 . 0 0 "[ . 1 . 2]" 1
1765 1 73 LEU HB2 1 80 LEU MD2 . . 3.700 1.915 1.791 2.045 . 0 0 "[ . 1 . 2]" 1
1766 1 38 GLU HA 1 41 LYS HB3 . . 3.690 2.816 2.679 2.910 . 0 0 "[ . 1 . 2]" 1
1767 1 21 PHE HA 1 24 HIS HB3 . . 3.690 3.423 2.857 3.780 0.090 6 0 "[ . 1 . 2]" 1
1768 1 79 GLU HG2 1 90 THR MG . . 3.690 3.334 3.253 3.401 . 0 0 "[ . 1 . 2]" 1
1769 1 40 GLN HA 1 40 GLN HG2 . . 3.690 3.763 3.750 3.778 0.088 5 0 "[ . 1 . 2]" 1
1770 1 92 THR HB 1 93 PRO HD3 . . 3.690 2.830 2.717 2.916 . 0 0 "[ . 1 . 2]" 1
1771 1 86 TYR HA 1 86 TYR QD . . 3.690 2.716 2.104 3.716 0.026 10 0 "[ . 1 . 2]" 1
1772 1 47 GLU H 1 47 GLU HB3 . . 3.690 3.541 3.494 3.571 . 0 0 "[ . 1 . 2]" 1
1773 1 57 LEU MD2 1 124 PHE QD . . 3.680 2.481 2.077 3.082 . 0 0 "[ . 1 . 2]" 1
1774 1 127 GLN HA 1 127 GLN HG3 . . 3.680 3.230 2.625 3.492 . 0 0 "[ . 1 . 2]" 1
1775 1 127 GLN H 1 130 LEU QD . . 3.680 2.071 1.875 2.194 . 0 0 "[ . 1 . 2]" 1
1776 1 101 LYS QE 1 101 LYS HG3 . . 3.680 2.323 1.982 3.080 . 0 0 "[ . 1 . 2]" 1
1777 1 56 PHE QE 1 72 THR MG . . 3.680 2.221 2.005 2.509 . 0 0 "[ . 1 . 2]" 1
1778 1 80 LEU H 1 80 LEU HG . . 3.680 3.312 3.199 3.529 . 0 0 "[ . 1 . 2]" 1
1779 1 79 GLU HA 1 92 THR HA . . 3.680 2.507 2.346 2.691 . 0 0 "[ . 1 . 2]" 1
1780 1 48 ILE HA 1 48 ILE HG12 . . 3.680 2.659 2.455 2.882 . 0 0 "[ . 1 . 2]" 1
1781 1 28 SER H 1 28 SER HB2 . . 3.680 2.131 2.049 2.243 . 0 0 "[ . 1 . 2]" 1
1782 1 20 LYS HA 1 56 PHE QD . . 3.680 2.351 2.035 2.679 . 0 0 "[ . 1 . 2]" 1
1783 1 97 GLU HB3 1 98 GLY H . . 3.670 2.487 2.237 2.719 . 0 0 "[ . 1 . 2]" 1
1784 1 32 LEU MD2 1 41 LYS HA . . 3.670 3.564 3.293 3.688 0.018 1 0 "[ . 1 . 2]" 1
1785 1 59 LEU HB2 1 59 LEU MD2 . . 3.670 2.507 2.438 2.567 . 0 0 "[ . 1 . 2]" 1
1786 1 59 LEU MD1 1 131 TRP HZ2 . . 3.660 2.833 2.117 3.408 . 0 0 "[ . 1 . 2]" 1
1787 1 126 ILE HB 1 130 LEU QD . . 3.660 1.863 1.784 2.004 . 0 0 "[ . 1 . 2]" 1
1788 1 73 LEU MD1 1 80 LEU HG . . 3.660 2.057 1.959 2.519 . 0 0 "[ . 1 . 2]" 1
1789 1 32 LEU MD2 1 37 ASN QB . . 3.580 2.361 1.999 2.634 . 0 0 "[ . 1 . 2]" 1
1790 1 73 LEU HB3 1 73 LEU MD1 . . 3.650 3.200 3.193 3.210 . 0 0 "[ . 1 . 2]" 1
1791 1 99 ILE MG 1 124 PHE HB3 . . 3.650 2.433 2.231 2.755 . 0 0 "[ . 1 . 2]" 1
1792 1 23 ILE MD 1 122 ASP HA . . 3.650 2.875 2.260 3.191 . 0 0 "[ . 1 . 2]" 1
1793 1 42 ASN HB2 1 42 ASN HD21 . . 3.650 2.178 2.121 2.219 . 0 0 "[ . 1 . 2]" 1
1794 1 48 ILE HG12 1 70 LEU QD . . 3.650 1.876 1.760 1.994 . 0 0 "[ . 1 . 2]" 1
1795 1 48 ILE HB 1 49 GLU H . . 3.650 2.586 2.193 2.844 . 0 0 "[ . 1 . 2]" 1
1796 1 47 GLU HA 1 50 LYS QD . . 3.650 1.957 1.857 2.008 . 0 0 "[ . 1 . 2]" 1
1797 1 106 ARG HA 1 106 ARG HG2 . . 3.650 2.150 2.041 2.440 . 0 0 "[ . 1 . 2]" 1
1798 1 73 LEU H 1 73 LEU HB3 . . 3.650 2.292 2.236 2.371 . 0 0 "[ . 1 . 2]" 1
1799 1 43 ARG HA 1 46 GLU QB . . 3.640 3.152 2.834 3.559 . 0 0 "[ . 1 . 2]" 1
1800 1 47 GLU H 1 47 GLU HG3 . . 3.640 3.445 1.972 3.645 0.005 20 0 "[ . 1 . 2]" 1
1801 1 41 LYS HB3 1 41 LYS HE2 . . 3.640 2.236 1.986 3.057 . 0 0 "[ . 1 . 2]" 1
1802 1 29 HIS HA 1 33 ALA MB . . 3.640 3.617 3.434 3.672 0.032 12 0 "[ . 1 . 2]" 1
1803 1 100 TYR QD 1 123 ALA MB . . 3.640 2.894 2.517 3.088 . 0 0 "[ . 1 . 2]" 1
1804 1 106 ARG HB3 1 106 ARG QD . . 3.640 2.075 1.971 2.185 . 0 0 "[ . 1 . 2]" 1
1805 1 41 LYS HA 1 41 LYS HG3 . . 3.630 2.785 2.692 3.332 . 0 0 "[ . 1 . 2]" 1
1806 1 37 ASN H 1 37 ASN QB . . 3.620 2.328 2.208 3.061 . 0 0 "[ . 1 . 2]" 1
1807 1 105 ASP HB2 1 106 ARG H . . 3.630 2.973 2.762 3.497 . 0 0 "[ . 1 . 2]" 1
1808 1 61 ARG HA 1 61 ARG HD2 . . 3.630 3.200 2.299 3.942 0.312 2 0 "[ . 1 . 2]" 1
1809 1 44 ILE HA 1 47 GLU HB2 . . 3.630 2.454 2.161 2.593 . 0 0 "[ . 1 . 2]" 1
1810 1 127 GLN H 1 127 GLN HG2 . . 3.630 3.353 2.940 3.660 0.030 9 0 "[ . 1 . 2]" 1
1811 1 47 GLU HA 1 47 GLU HG2 . . 3.630 2.658 2.493 2.914 . 0 0 "[ . 1 . 2]" 1
1812 1 130 LEU H 1 130 LEU QD . . 3.590 2.486 1.964 3.077 . 0 0 "[ . 1 . 2]" 1
1813 1 79 GLU HA 1 79 GLU HG2 . . 3.620 3.603 3.572 3.617 . 0 0 "[ . 1 . 2]" 1
1814 1 20 LYS H 1 20 LYS HB3 . . 3.620 2.291 2.144 2.391 . 0 0 "[ . 1 . 2]" 1
1815 1 99 ILE HG12 1 99 ILE MG . . 3.620 2.351 2.279 2.422 . 0 0 "[ . 1 . 2]" 1
1816 1 79 GLU HB2 1 90 THR MG . . 3.620 3.610 3.466 3.644 0.024 5 0 "[ . 1 . 2]" 1
1817 1 123 ALA H 1 123 ALA MB . . 3.620 2.840 2.724 2.912 . 0 0 "[ . 1 . 2]" 1
1818 1 136 SER HA 1 137 GLY H . . 3.620 2.743 2.215 3.642 0.022 18 0 "[ . 1 . 2]" 1
1819 1 91 VAL H 1 91 VAL MG2 . . 3.610 3.154 2.995 3.214 . 0 0 "[ . 1 . 2]" 1
1820 1 32 LEU MD2 1 40 GLN HG2 . . 3.610 2.082 1.922 2.505 . 0 0 "[ . 1 . 2]" 1
1821 1 47 GLU HG3 1 84 ALA MB . . 3.610 2.125 1.886 3.602 . 0 0 "[ . 1 . 2]" 1
1822 1 70 LEU HB2 1 70 LEU QD . . 3.180 2.167 1.960 2.406 . 0 0 "[ . 1 . 2]" 1
1823 1 50 LYS QE 1 50 LYS HG3 . . 3.600 2.575 2.413 3.209 . 0 0 "[ . 1 . 2]" 1
1824 1 56 PHE QD 1 70 LEU QD . . 3.530 2.095 1.832 2.610 . 0 0 "[ . 1 . 2]" 1
1825 1 59 LEU MD1 1 126 ILE MD . . 3.600 2.837 2.454 3.263 . 0 0 "[ . 1 . 2]" 1
1826 1 101 LYS QE 1 101 LYS HG2 . . 3.600 3.055 2.044 3.516 . 0 0 "[ . 1 . 2]" 1
1827 1 97 GLU QG 1 98 GLY H . . 3.600 3.586 3.448 3.620 0.020 16 0 "[ . 1 . 2]" 1
1828 1 99 ILE HA 1 124 PHE HA . . 3.600 2.283 2.175 2.401 . 0 0 "[ . 1 . 2]" 1
1829 1 120 SER HA 1 121 VAL H . . 3.600 2.987 2.821 3.197 . 0 0 "[ . 1 . 2]" 1
1830 1 79 GLU H 1 79 GLU HB3 . . 3.600 3.538 3.517 3.557 . 0 0 "[ . 1 . 2]" 1
1831 1 99 ILE HG13 1 99 ILE MG . . 3.590 3.231 3.215 3.240 . 0 0 "[ . 1 . 2]" 1
1832 1 39 PRO HA 1 42 ASN HB2 . . 3.590 3.227 3.082 3.582 . 0 0 "[ . 1 . 2]" 1
1833 1 91 VAL MG2 1 124 PHE HZ . . 3.590 3.345 3.162 3.569 . 0 0 "[ . 1 . 2]" 1
1834 1 51 SER QB 1 83 LEU MD2 . . 3.590 2.346 2.228 2.567 . 0 0 "[ . 1 . 2]" 1
1835 1 22 ILE HA 1 22 ILE HG13 . . 3.590 2.889 2.833 2.983 . 0 0 "[ . 1 . 2]" 1
1836 1 96 VAL QG 1 124 PHE QD . . 3.590 2.066 1.867 2.262 . 0 0 "[ . 1 . 2]" 1
1837 1 95 MET HA 1 95 MET HG3 . . 3.590 3.258 3.164 3.358 . 0 0 "[ . 1 . 2]" 1
1838 1 127 GLN H 1 127 GLN HG3 . . 3.590 3.166 2.252 3.497 . 0 0 "[ . 1 . 2]" 1
1839 1 38 GLU HA 1 38 GLU HG3 . . 3.590 2.823 2.652 2.929 . 0 0 "[ . 1 . 2]" 1
1840 1 32 LEU HB2 1 32 LEU MD1 . . 3.590 2.303 2.227 2.350 . 0 0 "[ . 1 . 2]" 1
1841 1 28 SER HA 1 41 LYS QD . . 3.590 3.100 2.717 3.594 0.004 15 0 "[ . 1 . 2]" 1
1842 1 32 LEU MD2 1 67 PHE QD . . 3.580 2.444 1.971 3.232 . 0 0 "[ . 1 . 2]" 1
1843 1 80 LEU HA 1 80 LEU MD2 . . 3.580 2.842 2.613 3.021 . 0 0 "[ . 1 . 2]" 1
1844 1 50 LYS HA 1 50 LYS HG2 . . 3.570 3.694 3.670 3.714 0.144 14 0 "[ . 1 . 2]" 1
1845 1 43 ARG HA 1 43 ARG HG2 . . 3.570 2.318 2.290 2.360 . 0 0 "[ . 1 . 2]" 1
1846 1 20 LYS HA 1 20 LYS HG3 . . 3.570 2.803 2.526 2.965 . 0 0 "[ . 1 . 2]" 1
1847 1 85 GLY HA2 1 86 TYR H . . 3.570 3.249 2.805 3.553 . 0 0 "[ . 1 . 2]" 1
1848 1 73 LEU MD1 1 80 LEU MD1 . . 3.570 3.303 3.057 3.575 0.005 14 0 "[ . 1 . 2]" 1
1849 1 97 GLU H 1 126 ILE HA . . 3.570 2.573 2.284 2.736 . 0 0 "[ . 1 . 2]" 1
1850 1 35 LYS HA 1 35 LYS QD . . 3.560 3.244 2.397 3.613 0.053 5 0 "[ . 1 . 2]" 1
1851 1 56 PHE HA 1 57 LEU MD1 . . 3.560 3.301 2.914 3.571 0.011 5 0 "[ . 1 . 2]" 1
1852 1 43 ARG HA 1 43 ARG HG3 . . 3.560 3.593 3.546 3.617 0.057 12 0 "[ . 1 . 2]" 1
1853 1 76 GLU QG 1 77 THR MG . . 3.560 1.808 1.768 1.971 . 0 0 "[ . 1 . 2]" 1
1854 1 50 LYS H 1 50 LYS HB2 . . 3.560 3.445 3.389 3.546 . 0 0 "[ . 1 . 2]" 1
1855 1 116 THR MG 1 117 MET H . . 3.560 1.934 1.793 2.251 . 0 0 "[ . 1 . 2]" 1
1856 1 106 ARG HB2 1 106 ARG QD . . 3.550 2.994 2.816 3.114 . 0 0 "[ . 1 . 2]" 1
1857 1 95 MET ME 1 95 MET HG3 . . 3.550 2.642 2.515 2.716 . 0 0 "[ . 1 . 2]" 1
1858 1 110 THR MG 1 111 GLN H . . 3.550 2.050 1.914 2.226 . 0 0 "[ . 1 . 2]" 1
1859 1 102 TYR QE 1 104 SER HA . . 3.550 2.068 1.990 2.342 . 0 0 "[ . 1 . 2]" 1
1860 1 95 MET HA 1 130 LEU QD . . 3.550 3.063 2.765 3.307 . 0 0 "[ . 1 . 2]" 1
1861 1 48 ILE HG13 1 83 LEU MD2 . . 3.550 2.591 2.193 3.025 . 0 0 "[ . 1 . 2]" 1
1862 1 58 ILE HA 1 70 LEU QD . . 3.540 2.768 2.371 3.165 . 0 0 "[ . 1 . 2]" 1
1863 1 60 PHE HB2 1 125 THR MG . . 3.540 1.942 1.777 2.190 . 0 0 "[ . 1 . 2]" 1
1864 1 92 THR MG 1 93 PRO HD2 . . 3.760 3.664 3.413 3.766 0.006 15 0 "[ . 1 . 2]" 1
1865 1 22 ILE H 1 22 ILE HG12 . . 3.530 3.538 3.468 3.566 0.036 16 0 "[ . 1 . 2]" 1
1866 1 96 VAL HA 1 126 ILE HA . . 3.530 2.016 1.969 2.290 . 0 0 "[ . 1 . 2]" 1
1867 1 56 PHE HA 1 72 THR HA . . 3.530 2.273 1.990 2.582 . 0 0 "[ . 1 . 2]" 1
1868 1 79 GLU HG2 1 92 THR MG . . 3.530 2.696 2.205 3.269 . 0 0 "[ . 1 . 2]" 1
1869 1 71 TYR HA 1 82 ARG HA . . 3.530 3.206 2.944 3.358 . 0 0 "[ . 1 . 2]" 1
1870 1 109 PHE QE 1 123 ALA MB . . 3.530 2.521 1.823 3.373 . 0 0 "[ . 1 . 2]" 1
1871 1 70 LEU HB3 1 84 ALA MB . . 3.530 3.457 2.971 3.554 0.024 5 0 "[ . 1 . 2]" 1
1872 1 69 ALA H 1 69 ALA MB . . 3.530 2.848 2.750 2.956 . 0 0 "[ . 1 . 2]" 1
1873 1 121 VAL H 1 121 VAL HB . . 3.520 2.551 2.482 2.686 . 0 0 "[ . 1 . 2]" 1
1874 1 27 LEU HB3 1 27 LEU MD2 . . 3.520 2.480 2.443 2.516 . 0 0 "[ . 1 . 2]" 1
1875 1 99 ILE HA 1 100 TYR QD . . 3.520 2.558 2.337 2.970 . 0 0 "[ . 1 . 2]" 1
1876 1 120 SER H 1 120 SER HB3 . . 3.520 3.500 3.397 3.703 0.183 16 0 "[ . 1 . 2]" 1
1877 1 46 GLU HA 1 46 GLU HG2 . . 3.520 2.878 2.548 4.259 0.739 8 1 "[ . + 1 . 2]" 1
1878 1 106 ARG HA 1 106 ARG QD . . 3.520 3.335 2.859 3.494 . 0 0 "[ . 1 . 2]" 1
1879 1 125 THR HA 1 126 ILE H . . 3.510 2.161 2.150 2.216 . 0 0 "[ . 1 . 2]" 1
1880 1 92 THR HA 1 93 PRO HD2 . . 3.510 2.856 2.821 2.914 . 0 0 "[ . 1 . 2]" 1
1881 1 59 LEU MD2 1 71 TYR QE . . 3.510 2.091 1.893 2.482 . 0 0 "[ . 1 . 2]" 1
1882 1 46 GLU H 1 46 GLU HG2 . . 3.510 2.141 1.947 3.355 . 0 0 "[ . 1 . 2]" 1
1883 1 32 LEU MD1 1 41 LYS HA . . 3.510 2.581 2.168 3.008 . 0 0 "[ . 1 . 2]" 1
1884 1 60 PHE QE 1 123 ALA MB . . 3.510 1.876 1.773 2.108 . 0 0 "[ . 1 . 2]" 1
1885 1 102 TYR HA 1 109 PHE HA . . 3.510 2.601 2.100 2.889 . 0 0 "[ . 1 . 2]" 1
1886 1 78 GLU HA 1 78 GLU HG2 . . 3.510 2.588 2.439 3.489 . 0 0 "[ . 1 . 2]" 1
1887 1 47 GLU HA 1 50 LYS HB3 . . 3.510 2.910 2.711 3.214 . 0 0 "[ . 1 . 2]" 1
1888 1 48 ILE HA 1 83 LEU MD2 . . 3.510 2.277 1.961 2.524 . 0 0 "[ . 1 . 2]" 1
1889 1 84 ALA H 1 84 ALA MB . . 3.510 2.725 2.645 2.822 . 0 0 "[ . 1 . 2]" 1
1890 1 21 PHE HA 1 21 PHE QD . . 3.500 2.919 2.394 3.130 . 0 0 "[ . 1 . 2]" 1
1891 1 57 LEU MD1 1 80 LEU MD1 . . 3.500 3.371 2.978 3.520 0.020 9 0 "[ . 1 . 2]" 1
1892 1 40 GLN H 1 40 GLN HB2 . . 3.500 2.909 2.831 3.051 . 0 0 "[ . 1 . 2]" 1
1893 1 49 GLU QB 1 50 LYS H . . 3.500 2.814 2.505 3.183 . 0 0 "[ . 1 . 2]" 1
1894 1 127 GLN HA 1 127 GLN HG2 . . 3.500 2.096 1.975 2.679 . 0 0 "[ . 1 . 2]" 1
1895 1 56 PHE QD 1 72 THR MG . . 3.500 2.200 1.929 2.647 . 0 0 "[ . 1 . 2]" 1
1896 1 89 ARG HA 1 89 ARG HG3 . . 3.500 2.491 2.274 3.928 0.428 18 0 "[ . 1 . 2]" 1
1897 1 98 GLY HA3 1 99 ILE H . . 3.490 2.955 2.807 3.089 . 0 0 "[ . 1 . 2]" 1
1898 1 59 LEU MD1 1 124 PHE QE . . 3.490 2.772 2.345 3.109 . 0 0 "[ . 1 . 2]" 1
1899 1 20 LYS H 1 20 LYS HB2 . . 3.490 2.744 2.530 3.045 . 0 0 "[ . 1 . 2]" 1
1900 1 99 ILE MD 1 115 LYS HA . . 3.490 2.507 2.294 2.696 . 0 0 "[ . 1 . 2]" 1
1901 1 21 PHE HA 1 24 HIS H . . 3.480 3.236 3.088 3.444 . 0 0 "[ . 1 . 2]" 1
1902 1 57 LEU HA 1 122 ASP HA . . 3.480 3.422 3.271 3.491 0.011 13 0 "[ . 1 . 2]" 1
1903 1 55 HIS HD2 1 57 LEU MD1 . . 3.480 2.450 2.176 2.663 . 0 0 "[ . 1 . 2]" 1
1904 1 24 HIS HA 1 27 LEU MD1 . . 3.480 2.928 2.586 3.292 . 0 0 "[ . 1 . 2]" 1
1905 1 23 ILE H 1 23 ILE HB . . 3.480 2.297 2.243 2.346 . 0 0 "[ . 1 . 2]" 1
1906 1 133 SER HA 1 134 LYS H . . 3.470 2.462 2.217 3.547 0.077 5 0 "[ . 1 . 2]" 1
1907 1 38 GLU HA 1 38 GLU HG2 . . 3.470 2.843 2.763 3.452 . 0 0 "[ . 1 . 2]" 1
1908 1 100 TYR HA 1 111 GLN HA . . 3.470 2.058 1.958 2.419 . 0 0 "[ . 1 . 2]" 1
1909 1 12 LYS HA 1 12 LYS QG . . 3.470 2.606 1.981 3.352 . 0 0 "[ . 1 . 2]" 1
1910 1 69 ALA HA 1 70 LEU H . . 3.460 2.341 2.243 2.474 . 0 0 "[ . 1 . 2]" 1
1911 1 68 ARG HA 1 68 ARG HD3 . . 3.460 2.919 2.006 3.741 0.281 4 0 "[ . 1 . 2]" 1
1912 1 57 LEU MD1 1 73 LEU HB2 . . 3.460 2.172 1.904 2.327 . 0 0 "[ . 1 . 2]" 1
1913 1 82 ARG HA 1 83 LEU H . . 3.450 2.250 2.227 2.267 . 0 0 "[ . 1 . 2]" 1
1914 1 126 ILE HA 1 127 GLN H . . 3.450 2.505 2.358 2.624 . 0 0 "[ . 1 . 2]" 1
1915 1 13 GLU HA 1 13 GLU QG . . 3.450 2.361 1.983 3.366 . 0 0 "[ . 1 . 2]" 1
1916 1 60 PHE HA 1 61 ARG H . . 3.450 2.567 2.236 2.738 . 0 0 "[ . 1 . 2]" 1
1917 1 91 VAL MG2 1 124 PHE QE . . 3.450 2.642 2.314 2.894 . 0 0 "[ . 1 . 2]" 1
1918 1 78 GLU HA 1 78 GLU HG3 . . 3.450 3.153 3.056 3.632 0.182 19 0 "[ . 1 . 2]" 1
1919 1 88 PRO HB2 1 91 VAL MG2 . . 3.450 2.895 2.799 2.992 . 0 0 "[ . 1 . 2]" 1
1920 1 44 ILE HA 1 44 ILE QG . . 3.450 3.169 3.121 3.214 . 0 0 "[ . 1 . 2]" 1
1921 1 95 MET HA 1 95 MET HG2 . . 3.450 2.220 2.163 2.326 . 0 0 "[ . 1 . 2]" 1
1922 1 43 ARG HA 1 46 GLU HG3 . . 3.450 2.814 2.421 3.969 0.519 11 1 "[ . 1+ . 2]" 1
1923 1 73 LEU HB2 1 73 LEU MD2 . . 3.450 2.237 2.163 2.356 . 0 0 "[ . 1 . 2]" 1
1924 1 95 MET H 1 96 VAL QG . . 3.820 3.575 3.230 3.765 . 0 0 "[ . 1 . 2]" 1
1925 1 99 ILE MD 1 114 ALA MB . . 3.440 2.663 2.424 2.861 . 0 0 "[ . 1 . 2]" 1
1926 1 46 GLU H 1 46 GLU HG3 . . 3.440 2.804 2.417 3.582 0.142 11 0 "[ . 1 . 2]" 1
1927 1 32 LEU HB3 1 32 LEU MD2 . . 3.430 2.313 2.200 2.382 . 0 0 "[ . 1 . 2]" 1
1928 1 73 LEU MD1 1 78 GLU HA . . 3.430 2.418 2.077 2.689 . 0 0 "[ . 1 . 2]" 1
1929 1 56 PHE QE 1 83 LEU MD2 . . 3.430 1.965 1.815 2.432 . 0 0 "[ . 1 . 2]" 1
1930 1 131 TRP HA 1 131 TRP HE3 . . 3.430 2.491 2.194 2.753 . 0 0 "[ . 1 . 2]" 1
1931 1 47 GLU H 1 47 GLU HG2 . . 3.420 2.429 2.109 3.504 0.084 5 0 "[ . 1 . 2]" 1
1932 1 80 LEU H 1 80 LEU MD1 . . 3.420 3.069 2.749 3.420 . 0 0 "[ . 1 . 2]" 1
1933 1 51 SER QB 1 83 LEU MD1 . . 3.420 1.948 1.712 2.224 . 0 0 "[ . 1 . 2]" 1
1934 1 35 LYS HA 1 35 LYS QG . . 3.420 2.478 2.107 3.450 0.030 18 0 "[ . 1 . 2]" 1
1935 1 24 HIS HA 1 45 LEU QD . . 3.420 2.845 2.487 3.159 . 0 0 "[ . 1 . 2]" 1
1936 1 60 PHE QD 1 125 THR MG . . 3.420 2.247 1.843 2.629 . 0 0 "[ . 1 . 2]" 1
1937 1 111 GLN HA 1 111 GLN HG3 . . 3.410 2.767 2.462 3.195 . 0 0 "[ . 1 . 2]" 1
1938 1 105 ASP H 1 105 ASP HB2 . . 3.400 2.298 2.138 2.413 . 0 0 "[ . 1 . 2]" 1
1939 1 58 ILE H 1 123 ALA HA . . 3.400 2.161 1.945 2.406 . 0 0 "[ . 1 . 2]" 1
1940 1 78 GLU HA 1 79 GLU H . . 3.400 3.310 3.249 3.376 . 0 0 "[ . 1 . 2]" 1
1941 1 132 GLN HA 1 132 GLN QG . . 3.400 2.536 1.991 3.354 . 0 0 "[ . 1 . 2]" 1
1942 1 99 ILE HB 1 121 VAL QG . . 3.280 1.965 1.816 2.115 . 0 0 "[ . 1 . 2]" 1
1943 1 21 PHE H 1 21 PHE HB3 . . 3.390 3.429 3.405 3.460 0.070 6 0 "[ . 1 . 2]" 1
1944 1 40 GLN H 1 40 GLN HB3 . . 3.390 2.144 2.082 2.171 . 0 0 "[ . 1 . 2]" 1
1945 1 98 GLY HA2 1 99 ILE H . . 3.380 2.343 2.259 2.449 . 0 0 "[ . 1 . 2]" 1
1946 1 81 SER H 1 81 SER HB2 . . 3.380 3.151 2.591 3.439 0.059 17 0 "[ . 1 . 2]" 1
1947 1 124 PHE HA 1 125 THR H . . 3.380 2.371 2.285 2.493 . 0 0 "[ . 1 . 2]" 1
1948 1 71 TYR QE 1 91 VAL MG2 . . 3.380 2.637 2.296 2.954 . 0 0 "[ . 1 . 2]" 1
1949 1 57 LEU HB2 1 57 LEU MD1 . . 3.380 2.069 2.022 2.170 . 0 0 "[ . 1 . 2]" 1
1950 1 21 PHE H 1 21 PHE HB2 . . 3.380 2.182 2.102 2.336 . 0 0 "[ . 1 . 2]" 1
1951 1 100 TYR HB2 1 123 ALA MB . . 3.380 2.002 1.798 2.220 . 0 0 "[ . 1 . 2]" 1
1952 1 59 LEU MD1 1 125 THR HA . . 3.370 2.967 2.287 3.332 . 0 0 "[ . 1 . 2]" 1
1953 1 81 SER H 1 81 SER HB3 . . 3.370 2.729 2.330 2.899 . 0 0 "[ . 1 . 2]" 1
1954 1 57 LEU HA 1 57 LEU HG . . 3.370 2.236 2.182 2.331 . 0 0 "[ . 1 . 2]" 1
1955 1 72 THR MG 1 83 LEU QB . . 3.370 2.366 2.164 2.585 . 0 0 "[ . 1 . 2]" 1
1956 1 71 TYR HA 1 72 THR H . . 3.360 2.422 2.311 2.560 . 0 0 "[ . 1 . 2]" 1
1957 1 44 ILE H 1 44 ILE QG . . 3.360 2.085 1.910 2.408 . 0 0 "[ . 1 . 2]" 1
1958 1 73 LEU HB2 1 73 LEU MD1 . . 3.350 2.498 2.465 2.551 . 0 0 "[ . 1 . 2]" 1
1959 1 45 LEU HA 1 48 ILE HB . . 3.350 2.971 2.565 3.278 . 0 0 "[ . 1 . 2]" 1
1960 1 130 LEU HB3 1 130 LEU QD . . 3.150 2.357 2.052 2.567 . 0 0 "[ . 1 . 2]" 1
1961 1 79 GLU HG3 1 92 THR MG . . 3.350 2.426 2.048 2.662 . 0 0 "[ . 1 . 2]" 1
1962 1 48 ILE H 1 48 ILE HB . . 3.350 2.425 2.334 2.485 . 0 0 "[ . 1 . 2]" 1
1963 1 96 VAL HA 1 96 VAL QG . . 3.160 2.218 2.031 2.324 . 0 0 "[ . 1 . 2]" 1
1964 1 69 ALA MB 1 86 TYR H . . 3.350 1.893 1.832 2.004 . 0 0 "[ . 1 . 2]" 1
1965 1 69 ALA MB 1 85 GLY HA2 . . 3.340 3.452 3.213 3.761 0.421 1 0 "[ . 1 . 2]" 1
1966 1 27 LEU HB3 1 27 LEU MD1 . . 3.340 2.259 2.168 2.359 . 0 0 "[ . 1 . 2]" 1
1967 1 80 LEU HB3 1 80 LEU MD1 . . 3.340 2.899 2.826 2.977 . 0 0 "[ . 1 . 2]" 1
1968 1 50 LYS HA 1 50 LYS HG3 . . 3.340 3.419 3.372 3.510 0.170 15 0 "[ . 1 . 2]" 1
1969 1 92 THR HA 1 93 PRO HD3 . . 3.340 2.070 2.045 2.112 . 0 0 "[ . 1 . 2]" 1
1970 1 76 GLU H 1 76 GLU QG . . 3.340 2.192 1.902 2.380 . 0 0 "[ . 1 . 2]" 1
1971 1 115 LYS HA 1 115 LYS QG . . 3.340 2.038 1.955 2.162 . 0 0 "[ . 1 . 2]" 1
1972 1 91 VAL MG1 1 124 PHE QD . . 3.340 3.105 2.855 3.322 . 0 0 "[ . 1 . 2]" 1
1973 1 30 CYS HA 1 33 ALA MB . . 3.330 1.963 1.810 2.223 . 0 0 "[ . 1 . 2]" 1
1974 1 106 ARG HA 1 106 ARG HG3 . . 3.330 3.402 3.285 3.661 0.331 4 0 "[ . 1 . 2]" 1
1975 1 73 LEU MD1 1 74 SER H . . 3.320 1.923 1.862 2.063 . 0 0 "[ . 1 . 2]" 1
1976 1 35 LYS HA 1 38 GLU QB . . 3.320 1.969 1.814 2.157 . 0 0 "[ . 1 . 2]" 1
1977 1 9 ARG QB 1 9 ARG QD . . 3.320 2.139 1.953 2.424 . 0 0 "[ . 1 . 2]" 1
1978 1 123 ALA MB 1 124 PHE H . . 3.320 2.920 2.652 3.070 . 0 0 "[ . 1 . 2]" 1
1979 1 125 THR HA 1 125 THR MG . . 3.310 2.333 2.192 2.503 . 0 0 "[ . 1 . 2]" 1
1980 1 100 TYR HA 1 101 LYS H . . 3.310 2.419 2.315 2.558 . 0 0 "[ . 1 . 2]" 1
1981 1 27 LEU HB2 1 27 LEU MD1 . . 3.300 2.455 2.354 2.523 . 0 0 "[ . 1 . 2]" 1
1982 1 102 TYR HA 1 103 ASN H . . 3.300 2.193 2.188 2.209 . 0 0 "[ . 1 . 2]" 1
1983 1 99 ILE HA 1 99 ILE MG . . 3.300 2.073 1.953 2.190 . 0 0 "[ . 1 . 2]" 1
1984 1 27 LEU HB2 1 27 LEU MD2 . . 3.300 3.205 3.200 3.215 . 0 0 "[ . 1 . 2]" 1
1985 1 99 ILE HA 1 100 TYR H . . 3.290 2.334 2.215 2.400 . 0 0 "[ . 1 . 2]" 1
1986 1 70 LEU HA 1 71 TYR H . . 3.290 2.319 2.236 2.382 . 0 0 "[ . 1 . 2]" 1
1987 1 73 LEU HB3 1 73 LEU MD2 . . 3.280 2.418 2.317 2.483 . 0 0 "[ . 1 . 2]" 1
1988 1 121 VAL HA 1 121 VAL QG . . 3.270 2.111 2.072 2.152 . 0 0 "[ . 1 . 2]" 1
1989 1 11 TYR HA 1 11 TYR QD . . 3.280 2.741 1.998 3.533 0.253 15 0 "[ . 1 . 2]" 1
1990 1 59 LEU MD1 1 60 PHE H . . 3.280 2.925 2.335 3.211 . 0 0 "[ . 1 . 2]" 1
1991 1 51 SER HA 1 52 LYS H . . 3.280 2.292 2.244 2.345 . 0 0 "[ . 1 . 2]" 1
1992 1 100 TYR QD 1 124 PHE HA . . 3.280 2.503 2.203 2.891 . 0 0 "[ . 1 . 2]" 1
1993 1 72 THR HA 1 72 THR MG . . 3.280 2.333 2.204 2.379 . 0 0 "[ . 1 . 2]" 1
1994 1 59 LEU HA 1 60 PHE H . . 3.270 2.190 2.178 2.225 . 0 0 "[ . 1 . 2]" 1
1995 1 40 GLN HA 1 40 GLN HG3 . . 3.270 2.793 2.740 2.914 . 0 0 "[ . 1 . 2]" 1
1996 1 91 VAL HA 1 91 VAL MG2 . . 3.270 2.227 2.158 2.333 . 0 0 "[ . 1 . 2]" 1
1997 1 101 LYS HA 1 102 TYR H . . 3.270 2.686 2.401 2.874 . 0 0 "[ . 1 . 2]" 1
1998 1 82 ARG QB 1 89 ARG HA . . 3.270 2.381 2.008 2.624 . 0 0 "[ . 1 . 2]" 1
1999 1 89 ARG QB 1 89 ARG QD . . 3.260 2.097 1.945 2.393 . 0 0 "[ . 1 . 2]" 1
2000 1 58 ILE HA 1 59 LEU H . . 3.260 2.194 2.176 2.232 . 0 0 "[ . 1 . 2]" 1
2001 1 9 ARG QB 1 9 ARG HG3 . . 2.460 2.290 2.180 2.498 0.038 11 0 "[ . 1 . 2]" 1
2002 1 9 ARG QB 1 9 ARG HG2 . . 2.450 2.435 2.192 2.569 0.119 18 0 "[ . 1 . 2]" 1
2003 1 76 GLU HB2 1 76 GLU QG . . 2.400 2.237 2.182 2.543 0.143 9 0 "[ . 1 . 2]" 1
2004 1 35 LYS QD 1 35 LYS QG . . 2.400 2.101 2.048 2.134 . 0 0 "[ . 1 . 2]" 1
2005 1 35 LYS QD 1 35 LYS QE . . 2.400 2.097 2.058 2.136 . 0 0 "[ . 1 . 2]" 1
2006 1 43 ARG HA 1 43 ARG QD . . 3.260 2.916 2.612 3.263 0.003 14 0 "[ . 1 . 2]" 1
2007 1 60 PHE HA 1 60 PHE QD . . 3.260 2.518 1.982 3.202 . 0 0 "[ . 1 . 2]" 1
2008 1 27 LEU MD2 1 67 PHE QE . . 3.250 2.802 2.258 3.278 0.028 15 0 "[ . 1 . 2]" 1
2009 1 56 PHE HA 1 57 LEU H . . 3.250 2.323 2.192 2.569 . 0 0 "[ . 1 . 2]" 1
2010 1 115 LYS HA 1 116 THR H . . 3.250 3.258 3.232 3.283 0.033 8 0 "[ . 1 . 2]" 1
2011 1 91 VAL MG1 1 92 THR H . . 3.250 2.191 1.919 2.608 . 0 0 "[ . 1 . 2]" 1
2012 1 91 VAL HA 1 91 VAL MG1 . . 3.250 2.431 2.384 2.514 . 0 0 "[ . 1 . 2]" 1
2013 1 109 PHE HA 1 110 THR H . . 3.250 2.285 2.240 2.517 . 0 0 "[ . 1 . 2]" 1
2014 1 67 PHE HA 1 68 ARG H . . 3.240 2.228 2.197 2.319 . 0 0 "[ . 1 . 2]" 1
2015 1 135 LYS HA 1 135 LYS QG . . 3.240 2.068 1.967 2.398 . 0 0 "[ . 1 . 2]" 1
2016 1 101 LYS HA 1 122 ASP H . . 3.240 2.032 1.933 2.368 . 0 0 "[ . 1 . 2]" 1
2017 1 57 LEU MD2 1 80 LEU MD1 . . 3.240 2.795 2.328 3.222 . 0 0 "[ . 1 . 2]" 1
2018 1 84 ALA MB 1 85 GLY H . . 3.240 2.479 2.210 2.900 . 0 0 "[ . 1 . 2]" 1
2019 1 96 VAL HA 1 97 GLU H . . 3.230 2.207 2.182 2.253 . 0 0 "[ . 1 . 2]" 1
2020 1 58 ILE HB 1 123 ALA MB . . 3.230 2.888 2.612 3.232 0.002 2 0 "[ . 1 . 2]" 1
2021 1 81 SER HA 1 82 ARG H . . 3.230 2.295 2.257 2.362 . 0 0 "[ . 1 . 2]" 1
2022 1 73 LEU HA 1 74 SER H . . 3.220 2.220 2.206 2.238 . 0 0 "[ . 1 . 2]" 1
2023 1 111 GLN HA 1 112 ILE H . . 3.220 2.394 2.221 2.477 . 0 0 "[ . 1 . 2]" 1
2024 1 80 LEU MD1 1 117 MET ME . . 3.220 2.033 1.868 2.240 . 0 0 "[ . 1 . 2]" 1
2025 1 10 LEU HA 1 10 LEU MD2 . . 3.210 2.864 2.049 3.987 0.777 11 2 "[ - . 1+ . 2]" 1
2026 1 23 ILE MG 1 27 LEU MD1 . . 3.210 2.693 2.412 2.953 . 0 0 "[ . 1 . 2]" 1
2027 1 76 GLU HA 1 76 GLU QG . . 3.200 3.346 3.296 3.362 0.162 18 0 "[ . 1 . 2]" 1
2028 1 108 ARG HA 1 109 PHE H . . 3.190 2.758 2.605 2.926 . 0 0 "[ . 1 . 2]" 1
2029 1 100 TYR QE 1 125 THR MG . . 3.190 2.543 2.039 2.954 . 0 0 "[ . 1 . 2]" 1
2030 1 77 THR H 1 77 THR MG . . 3.190 2.597 2.418 2.752 . 0 0 "[ . 1 . 2]" 1
2031 1 77 THR HA 1 78 GLU H . . 3.190 3.047 2.984 3.075 . 0 0 "[ . 1 . 2]" 1
2032 1 33 ALA MB 1 34 GLY H . . 3.190 3.200 2.887 3.406 0.216 20 0 "[ . 1 . 2]" 1
2033 1 121 VAL HA 1 122 ASP H . . 3.180 2.260 2.182 2.354 . 0 0 "[ . 1 . 2]" 1
2034 1 80 LEU HA 1 81 SER H . . 3.180 2.555 2.195 2.797 . 0 0 "[ . 1 . 2]" 1
2035 1 92 THR H 1 92 THR MG . . 3.180 2.306 1.958 2.712 . 0 0 "[ . 1 . 2]" 1
2036 1 57 LEU HA 1 58 ILE H . . 3.180 2.413 2.252 2.541 . 0 0 "[ . 1 . 2]" 1
2037 1 90 THR MG 1 91 VAL H . . 3.180 1.842 1.800 1.972 . 0 0 "[ . 1 . 2]" 1
2038 1 49 GLU HA 1 49 GLU QG . . 3.180 2.343 2.148 2.577 . 0 0 "[ . 1 . 2]" 1
2039 1 59 LEU HA 1 59 LEU MD1 . . 3.180 2.094 1.985 2.275 . 0 0 "[ . 1 . 2]" 1
2040 1 36 VAL H 1 36 VAL QG . . 3.160 2.157 1.792 2.848 . 0 0 "[ . 1 . 2]" 1
2041 1 134 LYS QG 1 135 LYS HB2 . . 3.170 2.919 2.437 3.912 0.742 13 1 "[ . 1 + . 2]" 1
2042 1 55 HIS HA 1 56 PHE H . . 3.170 2.201 2.186 2.260 . 0 0 "[ . 1 . 2]" 1
2043 1 36 VAL HA 1 36 VAL QG . . 2.930 2.216 2.095 2.362 . 0 0 "[ . 1 . 2]" 1
2044 1 72 THR HA 1 73 LEU H . . 3.160 2.186 2.160 2.240 . 0 0 "[ . 1 . 2]" 1
2045 1 80 LEU HB2 1 80 LEU MD1 . . 3.160 2.120 2.037 2.155 . 0 0 "[ . 1 . 2]" 1
2046 1 66 GLN HA 1 67 PHE H . . 3.160 2.346 2.202 2.692 . 0 0 "[ . 1 . 2]" 1
2047 1 57 LEU MD2 1 80 LEU MD2 . . 3.150 2.512 2.167 2.865 . 0 0 "[ . 1 . 2]" 1
2048 1 79 GLU HB3 1 90 THR MG . . 3.150 2.428 2.328 2.462 . 0 0 "[ . 1 . 2]" 1
2049 1 74 SER HA 1 75 GLY H . . 3.150 2.219 2.215 2.228 . 0 0 "[ . 1 . 2]" 1
2050 1 49 GLU H 1 49 GLU QG . . 3.150 2.379 2.120 2.566 . 0 0 "[ . 1 . 2]" 1
2051 1 91 VAL MG1 1 124 PHE QE . . 3.140 1.938 1.825 2.078 . 0 0 "[ . 1 . 2]" 1
2052 1 15 SER HA 1 16 ALA H . . 3.140 2.405 2.215 3.243 0.103 7 0 "[ . 1 . 2]" 1
2053 1 44 ILE HA 1 44 ILE MD . . 3.120 1.972 1.893 2.068 . 0 0 "[ . 1 . 2]" 1
2054 1 115 LYS QE 1 115 LYS QG . . 3.110 2.108 1.952 2.274 . 0 0 "[ . 1 . 2]" 1
2055 1 86 TYR HA 1 87 GLY H . . 3.110 2.251 2.187 3.099 . 0 0 "[ . 1 . 2]" 1
2056 1 69 ALA MB 1 70 LEU H . . 3.100 2.759 2.455 3.014 . 0 0 "[ . 1 . 2]" 1
2057 1 10 LEU HA 1 11 TYR H . . 3.100 2.423 2.184 3.124 0.024 10 0 "[ . 1 . 2]" 1
2058 1 89 ARG QB 1 90 THR H . . 3.090 2.526 2.373 3.239 0.149 18 0 "[ . 1 . 2]" 1
2059 1 53 ALA HA 1 54 ASN H . . 3.090 2.346 2.214 2.452 . 0 0 "[ . 1 . 2]" 1
2060 1 27 LEU HA 1 27 LEU MD2 . . 3.080 2.011 1.948 2.153 . 0 0 "[ . 1 . 2]" 1
2061 1 46 GLU HA 1 49 GLU QB . . 3.080 2.491 2.289 2.851 . 0 0 "[ . 1 . 2]" 1
2062 1 74 SER H 1 74 SER QB . . 3.080 2.252 2.062 2.506 . 0 0 "[ . 1 . 2]" 1
2063 1 97 GLU HA 1 97 GLU QG . . 3.080 2.621 2.376 3.062 . 0 0 "[ . 1 . 2]" 1
2064 1 91 VAL HA 1 92 THR H . . 3.070 2.266 2.191 2.408 . 0 0 "[ . 1 . 2]" 1
2065 1 73 LEU MD1 1 80 LEU MD2 . . 3.070 2.784 2.556 2.964 . 0 0 "[ . 1 . 2]" 1
2066 1 38 GLU QB 1 39 PRO HD3 . . 3.070 1.917 1.891 1.939 . 0 0 "[ . 1 . 2]" 1
2067 1 112 ILE MG 1 114 ALA MB . . 3.060 2.499 2.252 2.673 . 0 0 "[ . 1 . 2]" 1
2068 1 73 LEU HA 1 73 LEU MD1 . . 3.050 1.964 1.909 2.035 . 0 0 "[ . 1 . 2]" 1
2069 1 21 PHE HA 1 21 PHE HB2 . . 3.050 3.064 3.053 3.078 0.028 14 0 "[ . 1 . 2]" 1
2070 1 32 LEU HA 1 32 LEU MD2 . . 3.050 2.087 1.964 2.284 . 0 0 "[ . 1 . 2]" 1
2071 1 82 ARG H 1 90 THR HA . . 3.050 3.095 3.067 3.126 0.076 9 0 "[ . 1 . 2]" 1
2072 1 112 ILE HA 1 113 PRO HD2 . . 3.050 2.525 2.469 2.538 . 0 0 "[ . 1 . 2]" 1
2073 1 117 MET HA 1 118 SER H . . 3.050 2.437 2.203 2.614 . 0 0 "[ . 1 . 2]" 1
2074 1 90 THR HA 1 90 THR MG . . 3.040 2.531 2.445 2.602 . 0 0 "[ . 1 . 2]" 1
2075 1 33 ALA HA 1 34 GLY H . . 3.040 2.262 2.194 3.280 0.240 20 0 "[ . 1 . 2]" 1
2076 1 18 SER HA 1 19 ASN H . . 3.040 2.337 2.217 2.962 . 0 0 "[ . 1 . 2]" 1
2077 1 118 SER H 1 121 VAL QG . . 3.040 2.380 1.946 2.778 . 0 0 "[ . 1 . 2]" 1
2078 1 84 ALA HA 1 85 GLY H . . 3.020 2.524 2.297 2.710 . 0 0 "[ . 1 . 2]" 1
2079 1 77 THR HA 1 77 THR MG . . 3.020 2.615 2.554 2.690 . 0 0 "[ . 1 . 2]" 1
2080 1 59 LEU MD1 1 126 ILE MG . . 3.020 2.177 1.844 2.757 . 0 0 "[ . 1 . 2]" 1
2081 1 101 LYS HD3 1 101 LYS HG2 . . 3.020 2.388 2.264 2.899 . 0 0 "[ . 1 . 2]" 1
2082 1 17 LYS HA 1 18 SER H . . 3.010 2.578 2.177 3.100 0.090 11 0 "[ . 1 . 2]" 1
2083 1 105 ASP HA 1 105 ASP HB2 . . 3.010 2.947 2.832 3.004 . 0 0 "[ . 1 . 2]" 1
2084 1 49 GLU H 1 49 GLU QB . . 3.010 2.339 2.266 2.430 . 0 0 "[ . 1 . 2]" 1
2085 1 79 GLU HB3 1 79 GLU HG2 . . 3.000 2.405 2.390 2.420 . 0 0 "[ . 1 . 2]" 1
2086 1 40 GLN HB2 1 40 GLN HG2 . . 3.000 2.999 2.980 3.029 0.029 8 0 "[ . 1 . 2]" 1
2087 1 127 GLN HA 1 128 GLY H . . 2.990 2.618 2.447 2.755 . 0 0 "[ . 1 . 2]" 1
2088 1 90 THR HA 1 91 VAL H . . 2.990 2.479 2.388 2.507 . 0 0 "[ . 1 . 2]" 1
2089 1 134 LYS HA 1 134 LYS HB3 . . 2.990 2.805 2.338 3.031 0.041 14 0 "[ . 1 . 2]" 1
2090 1 11 TYR HA 1 11 TYR HB2 . . 2.980 2.864 2.674 3.070 0.090 7 0 "[ . 1 . 2]" 1
2091 1 69 ALA MB 1 71 TYR QE . . 2.970 1.878 1.772 1.979 . 0 0 "[ . 1 . 2]" 1
2092 1 35 LYS QE 1 35 LYS QG . . 2.960 2.127 1.963 2.351 . 0 0 "[ . 1 . 2]" 1
2093 1 36 VAL HA 1 36 VAL HB . . 2.960 2.570 2.394 2.863 . 0 0 "[ . 1 . 2]" 1
2094 1 91 VAL MG1 1 95 MET ME . . 2.960 2.647 2.164 2.934 . 0 0 "[ . 1 . 2]" 1
2095 1 92 THR HA 1 92 THR MG . . 2.960 2.602 2.463 2.733 . 0 0 "[ . 1 . 2]" 1
2096 1 21 PHE HA 1 21 PHE HB3 . . 2.950 2.655 2.578 2.699 . 0 0 "[ . 1 . 2]" 1
2097 1 79 GLU HB2 1 79 GLU HG2 . . 2.950 2.557 2.539 2.577 . 0 0 "[ . 1 . 2]" 1
2098 1 27 LEU MD2 1 58 ILE MD . . 2.930 2.359 1.955 2.689 . 0 0 "[ . 1 . 2]" 1
2099 1 116 THR HA 1 116 THR MG . . 2.930 2.326 2.239 2.440 . 0 0 "[ . 1 . 2]" 1
2100 1 114 ALA HA 1 115 LYS H . . 2.930 2.414 2.354 2.460 . 0 0 "[ . 1 . 2]" 1
2101 1 9 ARG HA 1 10 LEU H . . 2.920 2.534 2.228 2.927 0.007 5 0 "[ . 1 . 2]" 1
2102 1 134 LYS HA 1 134 LYS HB2 . . 2.900 2.494 2.380 2.680 . 0 0 "[ . 1 . 2]" 1
2103 1 43 ARG HB3 1 43 ARG QD . . 2.890 2.178 2.134 2.198 . 0 0 "[ . 1 . 2]" 1
2104 1 79 GLU HA 1 80 LEU H . . 2.880 2.478 2.426 2.515 . 0 0 "[ . 1 . 2]" 1
2105 1 11 TYR HA 1 12 LYS H . . 2.880 2.399 2.194 2.700 . 0 0 "[ . 1 . 2]" 1
2106 1 15 SER HA 1 15 SER HB3 . . 2.870 2.864 2.335 3.051 0.181 7 0 "[ . 1 . 2]" 1
2107 1 78 GLU HA 1 78 GLU HB3 . . 2.870 2.461 2.268 2.521 . 0 0 "[ . 1 . 2]" 1
2108 1 112 ILE HA 1 113 PRO HD3 . . 2.860 1.921 1.911 1.924 . 0 0 "[ . 1 . 2]" 1
2109 1 33 ALA H 1 33 ALA MB . . 2.850 2.321 2.198 2.458 . 0 0 "[ . 1 . 2]" 1
2110 1 83 LEU QB 1 83 LEU MD2 . . 2.850 2.078 2.065 2.093 . 0 0 "[ . 1 . 2]" 1
2111 1 16 ALA HA 1 17 LYS H . . 2.830 2.409 2.190 2.876 0.046 19 0 "[ . 1 . 2]" 1
2112 1 116 THR HA 1 117 MET H . . 2.820 2.465 2.342 2.536 . 0 0 "[ . 1 . 2]" 1
2113 1 81 SER HA 1 90 THR HA . . 2.820 2.566 2.314 2.734 . 0 0 "[ . 1 . 2]" 1
2114 1 132 GLN HB3 1 132 GLN QG . . 2.790 2.466 2.182 2.571 . 0 0 "[ . 1 . 2]" 1
2115 1 80 LEU MD1 1 91 VAL MG1 . . 2.780 2.151 1.907 2.691 . 0 0 "[ . 1 . 2]" 1
2116 1 47 GLU HA 1 47 GLU HB3 . . 2.780 2.629 2.524 2.694 . 0 0 "[ . 1 . 2]" 1
2117 1 78 GLU HB2 1 78 GLU HG3 . . 2.780 2.502 2.451 2.610 . 0 0 "[ . 1 . 2]" 1
2118 1 13 GLU HA 1 14 PRO HD3 . . 2.730 2.016 2.007 2.026 . 0 0 "[ . 1 . 2]" 1
2119 1 12 LYS HA 1 13 GLU H . . 2.720 2.274 2.204 2.387 . 0 0 "[ . 1 . 2]" 1
2120 1 13 GLU HA 1 14 PRO HD2 . . 2.710 2.735 2.720 2.755 0.045 5 0 "[ . 1 . 2]" 1
2121 1 132 GLN HB2 1 132 GLN QG . . 2.710 2.270 2.179 2.570 . 0 0 "[ . 1 . 2]" 1
2122 1 89 ARG QB 1 89 ARG HG3 . . 2.700 2.506 2.287 2.570 . 0 0 "[ . 1 . 2]" 1
2123 1 76 GLU HB3 1 76 GLU QG . . 2.700 2.523 2.238 2.572 . 0 0 "[ . 1 . 2]" 1
2124 1 83 LEU HA 1 83 LEU MD1 . . 2.680 1.967 1.948 2.110 . 0 0 "[ . 1 . 2]" 1
2125 1 43 ARG QD 1 43 ARG HG2 . . 2.580 2.396 2.346 2.463 . 0 0 "[ . 1 . 2]" 1
2126 1 7 GLY QA 1 8 PRO QD . . 2.570 1.925 1.842 2.103 . 0 0 "[ . 1 . 2]" 1
2127 1 89 ARG QB 1 89 ARG HG2 . . 2.550 2.274 2.193 2.500 . 0 0 "[ . 1 . 2]" 1
2128 1 27 LEU MD1 1 45 LEU QD . . 3.280 2.098 1.742 2.919 . 0 0 "[ . 1 . 2]" 1
2129 1 23 ILE MD 1 26 ALA MB . . 3.950 2.417 2.240 2.550 . 0 0 "[ . 1 . 2]" 1
2130 1 59 LEU MD2 1 69 ALA MB . . 3.130 2.233 1.960 2.521 . 0 0 "[ . 1 . 2]" 1
2131 1 59 LEU HB3 1 69 ALA MB . . 4.070 2.734 2.500 3.121 . 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 3
_Distance_constraint_stats_list.Viol_count 59
_Distance_constraint_stats_list.Viol_total 748.556
_Distance_constraint_stats_list.Viol_max 1.075
_Distance_constraint_stats_list.Viol_rms 0.3221
_Distance_constraint_stats_list.Viol_average_all_restraints 0.6238
_Distance_constraint_stats_list.Viol_average_violations_only 0.6344
_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 99 ILE 33.354 1.075 9 20 [*****-**+***********]
1 117 MET 37.428 1.075 9 20 [*****-**+***********]
1 121 VAL 4.073 0.443 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 117 MET QB 1 121 VAL QG . . 4.000 4.199 3.901 4.443 0.443 15 0 "[ . 1 . 2]" 2
2 1 99 ILE MG 1 117 MET QB . . 4.000 4.783 4.599 5.019 1.019 14 20 [*****-*******+******] 2
3 1 99 ILE MD 1 117 MET QB . . 4.000 4.884 4.728 5.075 1.075 9 20 [*****-**+***********] 2
stop_
save_
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