NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
521026 |
2lja   |
17927 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lja
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 2080
_Distance_constraint_stats_list.Viol_count 3612
_Distance_constraint_stats_list.Viol_total 5468.399
_Distance_constraint_stats_list.Viol_max 0.662
_Distance_constraint_stats_list.Viol_rms 0.0297
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0066
_Distance_constraint_stats_list.Viol_average_violations_only 0.0757
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.130 0.073 18 0 "[ . 1 . 2]"
1 3 LEU 0.236 0.133 5 0 "[ . 1 . 2]"
1 4 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 ASN 2.250 0.272 14 0 "[ . 1 . 2]"
1 8 PRO 2.555 0.272 14 0 "[ . 1 . 2]"
1 9 SER 2.002 0.249 11 0 "[ . 1 . 2]"
1 10 ALA 2.058 0.249 11 0 "[ . 1 . 2]"
1 11 ALA 4.111 0.195 20 0 "[ . 1 . 2]"
1 12 SER 2.165 0.195 20 0 "[ . 1 . 2]"
1 13 PHE 0.707 0.122 16 0 "[ . 1 . 2]"
1 14 SER 0.476 0.059 19 0 "[ . 1 . 2]"
1 15 TYR 1.989 0.139 19 0 "[ . 1 . 2]"
1 16 PRO 0.940 0.182 12 0 "[ . 1 . 2]"
1 17 ASP 3.007 0.179 5 0 "[ . 1 . 2]"
1 18 ILE 9.310 0.259 1 0 "[ . 1 . 2]"
1 19 ASN 4.254 0.538 1 1 "[+ . 1 . 2]"
1 20 GLY 1.083 0.182 12 0 "[ . 1 . 2]"
1 21 LYS 1.494 0.210 19 0 "[ . 1 . 2]"
1 22 THR 1.341 0.210 19 0 "[ . 1 . 2]"
1 23 VAL 1.950 0.159 1 0 "[ . 1 . 2]"
1 24 SER 2.068 0.201 2 0 "[ . 1 . 2]"
1 25 LEU 1.145 0.217 13 0 "[ . 1 . 2]"
1 26 ALA 2.651 0.295 9 0 "[ . 1 . 2]"
1 27 ASP 1.960 0.336 9 0 "[ . 1 . 2]"
1 28 LEU 2.420 0.280 8 0 "[ . 1 . 2]"
1 29 LYS 9.073 0.283 18 0 "[ . 1 . 2]"
1 30 GLY 0.544 0.081 16 0 "[ . 1 . 2]"
1 31 LYS 5.715 0.208 18 0 "[ . 1 . 2]"
1 32 TYR 1.384 0.152 2 0 "[ . 1 . 2]"
1 33 ILE 0.354 0.146 17 0 "[ . 1 . 2]"
1 34 TYR 1.116 0.142 8 0 "[ . 1 . 2]"
1 35 ILE 0.873 0.115 6 0 "[ . 1 . 2]"
1 36 ASP 3.181 0.235 4 0 "[ . 1 . 2]"
1 37 VAL 0.629 0.096 14 0 "[ . 1 . 2]"
1 38 TRP 12.114 0.326 14 0 "[ . 1 . 2]"
1 39 ALA 1.179 0.141 15 0 "[ . 1 . 2]"
1 40 THR 2.156 0.163 17 0 "[ . 1 . 2]"
1 41 TRP 6.966 0.336 10 0 "[ . 1 . 2]"
1 42 CYS 1.202 0.264 11 0 "[ . 1 . 2]"
1 43 GLY 1.864 0.144 8 0 "[ . 1 . 2]"
1 44 PRO 1.762 0.128 15 0 "[ . 1 . 2]"
1 45 CYS 2.632 0.141 15 0 "[ . 1 . 2]"
1 46 ARG 6.388 0.277 12 0 "[ . 1 . 2]"
1 47 GLY 0.353 0.121 15 0 "[ . 1 . 2]"
1 48 GLU 3.009 0.259 8 0 "[ . 1 . 2]"
1 49 LEU 4.451 0.360 10 0 "[ . 1 . 2]"
1 50 PRO 1.089 0.158 10 0 "[ . 1 . 2]"
1 51 ALA 3.819 0.360 10 0 "[ . 1 . 2]"
1 52 LEU 2.739 0.292 13 0 "[ . 1 . 2]"
1 53 LYS 2.284 0.662 5 1 "[ + 1 . 2]"
1 54 GLU 5.323 0.292 13 0 "[ . 1 . 2]"
1 55 LEU 4.728 0.361 4 0 "[ . 1 . 2]"
1 56 GLU 6.149 0.303 10 0 "[ . 1 . 2]"
1 57 GLU 1.477 0.214 6 0 "[ . 1 . 2]"
1 58 LYS 3.186 0.214 6 0 "[ . 1 . 2]"
1 59 TYR 1.861 0.361 4 0 "[ . 1 . 2]"
1 60 ALA 0.169 0.046 12 0 "[ . 1 . 2]"
1 61 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LYS 5.741 0.392 1 0 "[ . 1 . 2]"
1 63 ASP 4.402 0.289 11 0 "[ . 1 . 2]"
1 64 ILE 3.179 0.165 6 0 "[ . 1 . 2]"
1 65 HIS 1.785 0.165 6 0 "[ . 1 . 2]"
1 66 PHE 1.641 0.133 1 0 "[ . 1 . 2]"
1 67 VAL 0.209 0.053 5 0 "[ . 1 . 2]"
1 68 SER 2.432 0.235 4 0 "[ . 1 . 2]"
1 69 LEU 4.675 0.227 5 0 "[ . 1 . 2]"
1 70 SER 2.951 0.185 11 0 "[ . 1 . 2]"
1 71 CYS 3.385 0.263 3 0 "[ . 1 . 2]"
1 72 ASP 7.592 0.336 10 0 "[ . 1 . 2]"
1 73 LYS 2.744 0.164 1 0 "[ . 1 . 2]"
1 74 ASN 7.069 0.516 8 1 "[ . + 1 . 2]"
1 75 LYS 9.027 0.251 10 0 "[ . 1 . 2]"
1 76 LYS 4.180 0.272 3 0 "[ . 1 . 2]"
1 77 ALA 4.226 0.516 8 1 "[ . + 1 . 2]"
1 78 TRP 12.876 0.318 8 0 "[ . 1 . 2]"
1 79 GLU 10.078 0.313 18 0 "[ . 1 . 2]"
1 80 ASN 8.290 0.318 8 0 "[ . 1 . 2]"
1 81 MET 10.504 0.299 1 0 "[ . 1 . 2]"
1 82 VAL 3.487 0.179 12 0 "[ . 1 . 2]"
1 83 THR 1.303 0.324 9 0 "[ . 1 . 2]"
1 84 LYS 3.826 0.212 20 0 "[ . 1 . 2]"
1 85 ASP 3.587 0.299 1 0 "[ . 1 . 2]"
1 86 GLN 0.376 0.102 1 0 "[ . 1 . 2]"
1 87 LEU 1.762 0.110 7 0 "[ . 1 . 2]"
1 88 LYS 6.664 0.481 19 0 "[ . 1 . 2]"
1 89 GLY 1.037 0.133 1 0 "[ . 1 . 2]"
1 90 ILE 0.922 0.125 20 0 "[ . 1 . 2]"
1 91 GLN 5.598 0.212 9 0 "[ . 1 . 2]"
1 92 LEU 2.267 0.159 1 0 "[ . 1 . 2]"
1 93 HIS 9.114 0.183 8 0 "[ . 1 . 2]"
1 94 MET 10.079 0.350 10 0 "[ . 1 . 2]"
1 95 GLY 1.990 0.230 1 0 "[ . 1 . 2]"
1 96 THR 0.639 0.164 1 0 "[ . 1 . 2]"
1 97 ASP 4.590 0.350 10 0 "[ . 1 . 2]"
1 98 ARG 6.261 0.364 12 0 "[ . 1 . 2]"
1 99 THR 0.521 0.364 12 0 "[ . 1 . 2]"
1 100 PHE 4.512 0.213 12 0 "[ . 1 . 2]"
1 101 MET 3.295 0.222 17 0 "[ . 1 . 2]"
1 102 ASP 1.553 0.167 5 0 "[ . 1 . 2]"
1 103 ALA 2.734 0.213 12 0 "[ . 1 . 2]"
1 104 TYR 1.658 0.201 6 0 "[ . 1 . 2]"
1 105 LEU 0.134 0.096 18 0 "[ . 1 . 2]"
1 106 ILE 3.655 0.211 4 0 "[ . 1 . 2]"
1 107 ASN 1.589 0.132 10 0 "[ . 1 . 2]"
1 108 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 ILE 4.950 0.218 9 0 "[ . 1 . 2]"
1 110 PRO 1.824 0.199 17 0 "[ . 1 . 2]"
1 111 ARG 5.281 0.212 6 0 "[ . 1 . 2]"
1 112 PHE 5.237 0.265 18 0 "[ . 1 . 2]"
1 113 ILE 4.269 0.151 12 0 "[ . 1 . 2]"
1 114 LEU 2.523 0.151 12 0 "[ . 1 . 2]"
1 115 LEU 4.660 0.166 14 0 "[ . 1 . 2]"
1 116 ASP 3.046 0.335 15 0 "[ . 1 . 2]"
1 117 ARG 1.817 0.182 19 0 "[ . 1 . 2]"
1 118 ASP 4.233 0.320 5 0 "[ . 1 . 2]"
1 119 GLY 1.678 0.161 2 0 "[ . 1 . 2]"
1 120 LYS 8.565 0.489 12 0 "[ . 1 . 2]"
1 121 ILE 7.212 0.489 12 0 "[ . 1 . 2]"
1 122 ILE 4.321 0.237 9 0 "[ . 1 . 2]"
1 123 SER 1.913 0.141 12 0 "[ . 1 . 2]"
1 124 ALA 0.385 0.105 12 0 "[ . 1 . 2]"
1 125 ASN 5.341 0.451 12 0 "[ . 1 . 2]"
1 126 MET 3.273 0.167 4 0 "[ . 1 . 2]"
1 127 THR 3.699 0.188 18 0 "[ . 1 . 2]"
1 128 ARG 8.394 0.508 2 1 "[ + . 1 . 2]"
1 129 PRO 1.052 0.196 12 0 "[ . 1 . 2]"
1 130 SER 1.176 0.454 12 0 "[ . 1 . 2]"
1 131 ASP 2.738 0.441 16 0 "[ . 1 . 2]"
1 132 PRO 1.344 0.096 2 0 "[ . 1 . 2]"
1 133 LYS 1.030 0.233 5 0 "[ . 1 . 2]"
1 134 THR 0.545 0.097 1 0 "[ . 1 . 2]"
1 135 ALA 4.637 0.170 8 0 "[ . 1 . 2]"
1 136 GLU 3.298 0.368 9 0 "[ . 1 . 2]"
1 137 LYS 4.539 0.368 9 0 "[ . 1 . 2]"
1 138 PHE 5.240 0.246 4 0 "[ . 1 . 2]"
1 139 ASN 1.793 0.198 5 0 "[ . 1 . 2]"
1 140 GLU 5.769 0.305 2 0 "[ . 1 . 2]"
1 141 LEU 0.591 0.318 5 0 "[ . 1 . 2]"
1 142 LEU 0.455 0.145 4 0 "[ . 1 . 2]"
1 143 GLY 3.335 0.196 12 0 "[ . 1 . 2]"
1 144 LEU 2.561 0.111 4 0 "[ . 1 . 2]"
1 145 GLU 10.114 0.429 16 0 "[ . 1 . 2]"
1 146 GLY 2.927 0.296 12 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 LEU HA 1 3 LEU QD 3.900 . 4.800 2.570 1.838 3.431 . 0 0 "[ . 1 . 2]" 1
2 1 4 ARG HA 1 4 ARG QD 4.100 . 4.900 3.672 1.916 4.561 . 0 0 "[ . 1 . 2]" 1
3 1 4 ARG HB2 1 4 ARG QD 3.500 . 4.200 2.699 2.259 3.326 . 0 0 "[ . 1 . 2]" 1
4 1 4 ARG HB3 1 4 ARG QD 3.600 . 4.300 2.758 2.319 3.480 . 0 0 "[ . 1 . 2]" 1
5 1 5 SER H 1 5 SER HB3 4.100 . 4.900 3.547 2.801 4.035 . 0 0 "[ . 1 . 2]" 1
6 1 7 ASN HB2 1 7 ASN HD21 3.500 . 4.200 2.642 2.189 3.468 . 0 0 "[ . 1 . 2]" 1
7 1 7 ASN HB2 1 7 ASN HD22 4.100 . 4.900 3.663 3.459 4.049 . 0 0 "[ . 1 . 2]" 1
8 1 7 ASN H 1 7 ASN HB2 3.400 . 4.100 3.199 2.377 4.020 . 0 0 "[ . 1 . 2]" 1
9 1 7 ASN H 1 7 ASN HB3 4.000 . 4.800 3.495 2.500 4.134 . 0 0 "[ . 1 . 2]" 1
10 1 8 PRO HA 1 8 PRO HD2 4.300 . 5.200 3.969 3.888 4.086 . 0 0 "[ . 1 . 2]" 1
11 1 8 PRO HA 1 8 PRO HD3 4.100 . 4.900 3.761 3.265 3.984 . 0 0 "[ . 1 . 2]" 1
12 1 8 PRO HA 1 8 PRO QG 3.000 . 3.600 3.223 2.865 3.524 . 0 0 "[ . 1 . 2]" 1
13 1 8 PRO HB2 1 8 PRO HD2 3.700 . 4.400 3.351 2.880 4.037 . 0 0 "[ . 1 . 2]" 1
14 1 8 PRO HB3 1 8 PRO HD2 4.000 . 4.800 3.900 3.837 3.976 . 0 0 "[ . 1 . 2]" 1
15 1 9 SER H 1 9 SER HB2 3.300 . 3.900 2.922 2.493 3.864 . 0 0 "[ . 1 . 2]" 1
16 1 11 ALA H 1 11 ALA MB 3.400 . 4.200 2.448 2.230 2.885 . 0 0 "[ . 1 . 2]" 1
17 1 12 SER H 1 12 SER QB 3.100 . 3.700 3.210 2.861 3.436 . 0 0 "[ . 1 . 2]" 1
18 1 13 PHE H 1 13 PHE HB2 3.700 . 4.400 3.691 3.598 3.980 . 0 0 "[ . 1 . 2]" 1
19 1 13 PHE H 1 13 PHE HB3 3.700 . 4.400 2.959 2.583 3.459 . 0 0 "[ . 1 . 2]" 1
20 1 13 PHE H 1 13 PHE QD 4.300 . 5.300 2.638 2.055 3.250 . 0 0 "[ . 1 . 2]" 1
21 1 14 SER H 1 14 SER QB 3.100 . 3.700 2.897 2.651 3.226 . 0 0 "[ . 1 . 2]" 1
22 1 15 TYR HA 1 15 TYR QE 5.900 . 6.700 4.453 4.273 4.595 . 0 0 "[ . 1 . 2]" 1
23 1 15 TYR H 1 15 TYR HB2 3.500 . 4.200 2.707 2.579 2.791 . 0 0 "[ . 1 . 2]" 1
24 1 15 TYR H 1 15 TYR HB3 3.200 . 3.800 3.792 3.708 3.844 0.044 19 0 "[ . 1 . 2]" 1
25 1 15 TYR H 1 15 TYR QD 4.900 . 6.000 3.607 3.212 3.955 . 0 0 "[ . 1 . 2]" 1
26 1 16 PRO HA 1 16 PRO HD3 3.300 . 4.000 3.876 3.687 3.996 . 0 0 "[ . 1 . 2]" 1
27 1 16 PRO HA 1 16 PRO HG2 3.900 . 4.700 3.988 3.859 4.096 . 0 0 "[ . 1 . 2]" 1
28 1 16 PRO QB 1 16 PRO HD3 3.700 . 4.400 3.321 2.955 3.552 . 0 0 "[ . 1 . 2]" 1
29 1 17 ASP H 1 17 ASP HB2 3.200 . 3.800 2.717 2.387 3.020 . 0 0 "[ . 1 . 2]" 1
30 1 17 ASP H 1 17 ASP HB3 3.500 . 4.200 2.350 2.101 3.604 . 0 0 "[ . 1 . 2]" 1
31 1 18 ILE HA 1 18 ILE MD 3.700 . 4.500 3.357 1.786 4.174 0.014 1 0 "[ . 1 . 2]" 1
32 1 18 ILE HA 1 18 ILE HG12 3.400 . 4.100 3.218 2.401 3.742 . 0 0 "[ . 1 . 2]" 1
33 1 18 ILE HA 1 18 ILE HG13 3.300 . 4.000 2.983 2.412 3.732 . 0 0 "[ . 1 . 2]" 1
34 1 18 ILE H 1 18 ILE HB 2.800 . 3.400 2.701 2.404 3.572 0.172 20 0 "[ . 1 . 2]" 1
35 1 18 ILE H 1 18 ILE MD 5.400 . 6.600 4.103 2.965 4.458 . 0 0 "[ . 1 . 2]" 1
36 1 18 ILE H 1 18 ILE HG12 3.900 . 4.700 3.987 2.051 4.663 . 0 0 "[ . 1 . 2]" 1
37 1 18 ILE H 1 18 ILE MG 3.900 . 4.800 2.142 1.785 3.750 0.015 2 0 "[ . 1 . 2]" 1
38 1 19 ASN HA 1 19 ASN HD21 4.700 . 5.600 3.728 2.228 4.155 . 0 0 "[ . 1 . 2]" 1
39 1 19 ASN HA 1 19 ASN HD22 4.500 . 5.400 4.334 3.445 5.108 . 0 0 "[ . 1 . 2]" 1
40 1 19 ASN HB2 1 19 ASN HD21 3.500 . 4.200 2.352 2.191 3.425 . 0 0 "[ . 1 . 2]" 1
41 1 19 ASN HB2 1 19 ASN HD22 2.800 . 3.400 3.511 3.454 3.938 0.538 1 1 "[+ . 1 . 2]" 1
42 1 19 ASN HB3 1 19 ASN HD21 3.300 . 4.000 3.402 2.231 3.483 . 0 0 "[ . 1 . 2]" 1
43 1 19 ASN HB3 1 19 ASN HD22 3.400 . 4.100 4.007 3.420 4.049 . 0 0 "[ . 1 . 2]" 1
44 1 19 ASN H 1 19 ASN HB2 3.400 . 4.100 2.526 2.233 3.612 . 0 0 "[ . 1 . 2]" 1
45 1 19 ASN H 1 19 ASN HB3 2.900 . 3.500 3.469 2.369 3.597 0.097 12 0 "[ . 1 . 2]" 1
46 1 19 ASN H 1 19 ASN HD21 3.700 . 4.400 2.278 1.980 4.250 . 0 0 "[ . 1 . 2]" 1
47 1 19 ASN H 1 19 ASN HD22 3.300 . 4.000 3.549 3.296 4.249 0.249 18 0 "[ . 1 . 2]" 1
48 1 21 LYS H 1 21 LYS HB2 2.600 . 3.100 2.921 2.540 3.202 0.102 20 0 "[ . 1 . 2]" 1
49 1 21 LYS H 1 21 LYS HB3 2.500 . 3.000 2.552 2.162 2.922 . 0 0 "[ . 1 . 2]" 1
50 1 22 THR H 1 22 THR HB 2.300 . 2.800 2.634 2.578 2.695 . 0 0 "[ . 1 . 2]" 1
51 1 22 THR H 1 22 THR MG 4.300 . 5.300 3.767 3.735 3.820 . 0 0 "[ . 1 . 2]" 1
52 1 24 SER H 1 24 SER HB2 3.500 . 4.200 3.518 2.589 3.812 . 0 0 "[ . 1 . 2]" 1
53 1 24 SER H 1 24 SER HB3 3.500 . 4.200 3.117 2.732 3.784 . 0 0 "[ . 1 . 2]" 1
54 1 25 LEU HA 1 25 LEU QD 3.900 . 4.700 1.975 1.863 2.137 . 0 0 "[ . 1 . 2]" 1
55 1 26 ALA H 1 26 ALA MB 3.300 . 4.100 2.293 2.240 2.452 . 0 0 "[ . 1 . 2]" 1
56 1 27 ASP H 1 27 ASP HB2 3.300 . 3.900 2.905 2.141 3.647 . 0 0 "[ . 1 . 2]" 1
57 1 27 ASP H 1 27 ASP HB3 2.600 . 3.100 2.646 2.316 3.436 0.336 9 0 "[ . 1 . 2]" 1
58 1 28 LEU H 1 28 LEU HB2 3.000 . 3.600 2.563 2.233 3.680 0.080 8 0 "[ . 1 . 2]" 1
59 1 28 LEU H 1 28 LEU HB3 3.100 . 3.600 3.572 2.697 3.690 0.090 18 0 "[ . 1 . 2]" 1
60 1 28 LEU H 1 28 LEU QD 4.800 . 5.900 3.105 2.178 3.849 . 0 0 "[ . 1 . 2]" 1
61 1 29 LYS HA 1 29 LYS QD 3.800 . 4.600 3.676 2.415 4.025 . 0 0 "[ . 1 . 2]" 1
62 1 29 LYS HA 1 29 LYS HG3 3.100 . 3.700 2.531 2.180 2.688 . 0 0 "[ . 1 . 2]" 1
63 1 29 LYS QB 1 29 LYS QE 3.800 . 4.600 3.457 2.010 3.865 . 0 0 "[ . 1 . 2]" 1
64 1 29 LYS H 1 29 LYS QB 2.100 . 2.500 2.162 2.065 2.243 . 0 0 "[ . 1 . 2]" 1
65 1 29 LYS H 1 29 LYS QD 3.500 . 4.300 3.873 2.299 4.331 0.031 14 0 "[ . 1 . 2]" 1
66 1 29 LYS H 1 29 LYS HG2 3.400 . 4.100 4.259 4.141 4.383 0.283 18 0 "[ . 1 . 2]" 1
67 1 29 LYS H 1 29 LYS HG3 3.700 . 4.400 4.223 2.897 4.478 0.078 14 0 "[ . 1 . 2]" 1
68 1 31 LYS H 1 31 LYS HB2 3.100 . 3.700 2.971 2.543 3.430 . 0 0 "[ . 1 . 2]" 1
69 1 31 LYS H 1 31 LYS HB3 3.100 . 3.700 3.278 2.712 3.793 0.093 19 0 "[ . 1 . 2]" 1
70 1 31 LYS H 1 31 LYS QE 4.100 . 4.900 4.902 4.346 5.108 0.208 18 0 "[ . 1 . 2]" 1
71 1 32 TYR HA 1 32 TYR QD 4.000 . 4.900 2.660 2.153 2.930 . 0 0 "[ . 1 . 2]" 1
72 1 32 TYR HA 1 32 TYR QE 3.900 . 4.700 4.478 4.343 4.687 . 0 0 "[ . 1 . 2]" 1
73 1 32 TYR H 1 32 TYR HB2 3.400 . 4.100 2.397 2.259 2.514 . 0 0 "[ . 1 . 2]" 1
74 1 32 TYR H 1 32 TYR HB3 3.300 . 4.000 3.592 3.546 3.635 . 0 0 "[ . 1 . 2]" 1
75 1 32 TYR H 1 32 TYR QD 4.100 . 5.000 2.664 2.242 3.247 . 0 0 "[ . 1 . 2]" 1
76 1 32 TYR H 1 32 TYR QE 5.400 . 6.600 4.502 4.231 4.725 . 0 0 "[ . 1 . 2]" 1
77 1 33 ILE H 1 33 ILE HB 2.800 . 3.400 2.679 2.560 2.830 . 0 0 "[ . 1 . 2]" 1
78 1 33 ILE H 1 33 ILE MD 4.800 . 5.900 3.447 2.029 4.139 . 0 0 "[ . 1 . 2]" 1
79 1 34 TYR HA 1 34 TYR QD 4.000 . 4.900 2.739 2.614 2.895 . 0 0 "[ . 1 . 2]" 1
80 1 34 TYR HB3 1 34 TYR QE 4.800 . 5.900 4.402 4.374 4.429 . 0 0 "[ . 1 . 2]" 1
81 1 34 TYR H 1 34 TYR HB2 3.200 . 3.800 3.090 2.790 3.265 . 0 0 "[ . 1 . 2]" 1
82 1 34 TYR H 1 34 TYR HB3 3.500 . 4.200 2.595 2.441 2.813 . 0 0 "[ . 1 . 2]" 1
83 1 34 TYR H 1 34 TYR QD 5.200 . 6.300 4.257 4.059 4.357 . 0 0 "[ . 1 . 2]" 1
84 1 35 ILE H 1 35 ILE MD 5.000 . 6.100 3.952 3.607 4.173 . 0 0 "[ . 1 . 2]" 1
85 1 35 ILE H 1 35 ILE HG12 3.700 . 4.400 3.696 2.541 4.116 . 0 0 "[ . 1 . 2]" 1
86 1 35 ILE H 1 35 ILE HG13 3.200 . 3.800 2.954 2.622 3.899 0.099 12 0 "[ . 1 . 2]" 1
87 1 36 ASP H 1 36 ASP HB2 3.400 . 4.100 3.273 2.374 3.818 . 0 0 "[ . 1 . 2]" 1
88 1 36 ASP H 1 36 ASP HB3 3.500 . 4.200 2.988 2.684 3.609 . 0 0 "[ . 1 . 2]" 1
89 1 37 VAL H 1 37 VAL HB 3.000 . 3.600 2.620 2.568 2.693 . 0 0 "[ . 1 . 2]" 1
90 1 37 VAL H 1 37 VAL MG2 4.400 . 5.400 2.442 2.123 2.636 . 0 0 "[ . 1 . 2]" 1
91 1 38 TRP HA 1 38 TRP HD1 3.800 . 4.600 4.010 3.934 4.065 . 0 0 "[ . 1 . 2]" 1
92 1 38 TRP H 1 38 TRP HB2 4.200 . 5.000 3.789 3.700 3.882 . 0 0 "[ . 1 . 2]" 1
93 1 38 TRP H 1 38 TRP HD1 3.200 . 3.800 1.628 1.474 1.717 0.326 14 0 "[ . 1 . 2]" 1
94 1 38 TRP H 1 38 TRP HE1 4.400 . 5.300 4.135 4.013 4.222 . 0 0 "[ . 1 . 2]" 1
95 1 40 THR H 1 40 THR HB 3.800 . 4.600 2.871 2.733 3.017 . 0 0 "[ . 1 . 2]" 1
96 1 40 THR H 1 40 THR MG 3.800 . 4.700 2.345 1.806 3.741 . 0 0 "[ . 1 . 2]" 1
97 1 41 TRP HA 1 41 TRP HD1 3.400 . 4.100 4.127 3.983 4.401 0.301 10 0 "[ . 1 . 2]" 1
98 1 41 TRP HB2 1 41 TRP HD1 3.400 . 4.100 3.843 3.721 3.866 . 0 0 "[ . 1 . 2]" 1
99 1 41 TRP HB2 1 41 TRP HE1 4.600 . 5.500 5.260 5.197 5.271 . 0 0 "[ . 1 . 2]" 1
100 1 41 TRP HB3 1 41 TRP HD1 3.500 . 4.200 2.740 2.558 2.803 . 0 0 "[ . 1 . 2]" 1
101 1 41 TRP H 1 41 TRP HB2 3.000 . 3.600 3.603 3.517 3.685 0.085 17 0 "[ . 1 . 2]" 1
102 1 41 TRP H 1 41 TRP HB3 3.100 . 3.700 2.991 2.740 3.356 . 0 0 "[ . 1 . 2]" 1
103 1 41 TRP H 1 41 TRP HD1 2.600 . 3.100 2.212 1.880 2.732 . 0 0 "[ . 1 . 2]" 1
104 1 41 TRP H 1 41 TRP HE1 4.000 . 4.800 3.913 3.761 4.438 . 0 0 "[ . 1 . 2]" 1
105 1 42 CYS H 1 42 CYS HB2 3.400 . 4.100 3.291 2.497 3.777 . 0 0 "[ . 1 . 2]" 1
106 1 42 CYS H 1 42 CYS HB3 3.000 . 3.600 2.742 2.369 3.662 0.062 11 0 "[ . 1 . 2]" 1
107 1 44 PRO HA 1 44 PRO HG3 3.700 . 4.400 3.241 2.888 3.956 . 0 0 "[ . 1 . 2]" 1
108 1 44 PRO HB2 1 44 PRO HD3 4.100 . 4.900 3.857 3.841 3.875 . 0 0 "[ . 1 . 2]" 1
109 1 45 CYS H 1 45 CYS HB2 3.700 . 4.400 2.813 2.431 3.600 . 0 0 "[ . 1 . 2]" 1
110 1 46 ARG HA 1 46 ARG HG2 3.500 . 4.200 2.766 2.381 3.565 . 0 0 "[ . 1 . 2]" 1
111 1 46 ARG HA 1 46 ARG HG3 2.900 . 3.400 3.081 2.369 3.677 0.277 12 0 "[ . 1 . 2]" 1
112 1 46 ARG H 1 46 ARG HB3 3.000 . 3.600 3.411 2.257 3.643 0.043 10 0 "[ . 1 . 2]" 1
113 1 46 ARG H 1 46 ARG HD2 4.000 . 4.800 4.397 2.814 4.833 0.033 15 0 "[ . 1 . 2]" 1
114 1 46 ARG H 1 46 ARG HG3 3.500 . 4.200 2.887 2.173 4.401 0.201 9 0 "[ . 1 . 2]" 1
115 1 48 GLU HA 1 48 GLU HG2 3.800 . 4.600 3.091 2.487 3.752 . 0 0 "[ . 1 . 2]" 1
116 1 48 GLU HA 1 48 GLU HG3 3.300 . 4.000 3.457 2.551 4.187 0.187 20 0 "[ . 1 . 2]" 1
117 1 48 GLU H 1 48 GLU HB3 3.200 . 3.800 3.477 2.909 3.762 . 0 0 "[ . 1 . 2]" 1
118 1 48 GLU H 1 48 GLU HG2 3.400 . 4.100 2.920 1.831 4.146 0.046 15 0 "[ . 1 . 2]" 1
119 1 48 GLU H 1 48 GLU HG3 3.100 . 3.700 2.859 2.078 3.646 . 0 0 "[ . 1 . 2]" 1
120 1 49 LEU HA 1 49 LEU QD 3.800 . 4.700 1.966 1.836 2.252 . 0 0 "[ . 1 . 2]" 1
121 1 49 LEU H 1 49 LEU HB2 3.300 . 4.000 2.423 2.149 2.704 . 0 0 "[ . 1 . 2]" 1
122 1 49 LEU H 1 49 LEU HB3 3.000 . 3.600 3.511 2.174 3.621 0.021 15 0 "[ . 1 . 2]" 1
123 1 49 LEU H 1 49 LEU QD 4.700 . 5.700 2.869 1.916 3.693 . 0 0 "[ . 1 . 2]" 1
124 1 49 LEU H 1 49 LEU HG 3.100 . 3.800 2.854 2.128 4.154 0.354 10 0 "[ . 1 . 2]" 1
125 1 50 PRO HA 1 50 PRO HG2 4.100 . 4.900 3.908 3.871 3.965 . 0 0 "[ . 1 . 2]" 1
126 1 50 PRO HA 1 50 PRO HG3 3.500 . 4.200 3.260 2.915 3.952 . 0 0 "[ . 1 . 2]" 1
127 1 50 PRO HB3 1 50 PRO HD3 4.200 . 5.000 3.724 2.943 4.057 . 0 0 "[ . 1 . 2]" 1
128 1 52 LEU H 1 52 LEU HB2 2.600 . 3.100 2.374 2.235 2.515 . 0 0 "[ . 1 . 2]" 1
129 1 52 LEU H 1 52 LEU HB3 2.800 . 3.400 2.718 2.543 3.548 0.148 14 0 "[ . 1 . 2]" 1
130 1 52 LEU H 1 52 LEU HG 3.900 . 4.700 4.219 2.400 4.501 . 0 0 "[ . 1 . 2]" 1
131 1 53 LYS H 1 53 LYS QB 2.200 . 2.600 2.426 1.979 2.637 0.037 3 0 "[ . 1 . 2]" 1
132 1 53 LYS H 1 53 LYS HG2 3.200 . 3.800 2.978 2.039 3.886 0.086 5 0 "[ . 1 . 2]" 1
133 1 53 LYS H 1 53 LYS HG3 3.100 . 3.700 2.952 1.844 4.362 0.662 5 1 "[ + 1 . 2]" 1
134 1 54 GLU HA 1 54 GLU HG2 3.000 . 3.600 2.792 2.118 3.628 0.028 3 0 "[ . 1 . 2]" 1
135 1 54 GLU H 1 54 GLU QB 2.300 . 2.800 2.237 1.937 2.591 . 0 0 "[ . 1 . 2]" 1
136 1 54 GLU H 1 54 GLU HG2 3.200 . 3.800 3.074 2.021 3.891 0.091 8 0 "[ . 1 . 2]" 1
137 1 54 GLU H 1 54 GLU HG3 3.100 . 3.700 3.589 2.508 3.991 0.291 15 0 "[ . 1 . 2]" 1
138 1 55 LEU HA 1 55 LEU QD . . 3.700 1.950 1.763 2.640 0.037 13 0 "[ . 1 . 2]" 1
139 1 55 LEU H 1 55 LEU HB2 2.900 . 3.500 2.289 2.103 2.465 . 0 0 "[ . 1 . 2]" 1
140 1 55 LEU H 1 55 LEU HB3 2.800 . 3.400 3.158 2.548 3.523 0.123 19 0 "[ . 1 . 2]" 1
141 1 55 LEU H 1 55 LEU QD 4.800 . 6.000 3.315 2.389 3.678 . 0 0 "[ . 1 . 2]" 1
142 1 56 GLU HA 1 56 GLU HG2 3.800 . 4.600 3.346 2.349 4.197 . 0 0 "[ . 1 . 2]" 1
143 1 56 GLU H 1 56 GLU HB2 3.200 . 3.800 2.536 2.093 3.625 . 0 0 "[ . 1 . 2]" 1
144 1 56 GLU H 1 56 GLU HG3 3.400 . 4.100 4.060 2.290 4.403 0.303 10 0 "[ . 1 . 2]" 1
145 1 57 GLU H 1 57 GLU QB 2.600 . 3.100 2.558 2.409 2.777 . 0 0 "[ . 1 . 2]" 1
146 1 57 GLU H 1 57 GLU HG2 2.900 . 3.500 2.813 1.783 3.518 0.018 15 0 "[ . 1 . 2]" 1
147 1 57 GLU H 1 57 GLU HG3 3.000 . 3.600 2.543 2.026 3.464 . 0 0 "[ . 1 . 2]" 1
148 1 58 LYS HA 1 58 LYS QD 3.600 . 4.300 3.953 2.680 4.207 . 0 0 "[ . 1 . 2]" 1
149 1 58 LYS HA 1 58 LYS HG2 3.400 . 4.100 3.019 2.506 3.485 . 0 0 "[ . 1 . 2]" 1
150 1 58 LYS H 1 58 LYS HB2 3.000 . 3.600 2.487 2.202 2.763 . 0 0 "[ . 1 . 2]" 1
151 1 58 LYS H 1 58 LYS HB3 3.200 . 3.800 2.777 2.395 3.612 . 0 0 "[ . 1 . 2]" 1
152 1 58 LYS H 1 58 LYS HG2 4.000 . 4.800 4.283 2.618 4.572 . 0 0 "[ . 1 . 2]" 1
153 1 58 LYS H 1 58 LYS HG3 4.000 . 4.800 4.102 2.037 4.553 . 0 0 "[ . 1 . 2]" 1
154 1 59 TYR HA 1 59 TYR QD 3.900 . 4.800 2.796 2.200 3.092 . 0 0 "[ . 1 . 2]" 1
155 1 59 TYR HB2 1 59 TYR QE 4.700 . 5.700 4.420 4.373 4.478 . 0 0 "[ . 1 . 2]" 1
156 1 59 TYR H 1 59 TYR HB2 3.300 . 4.000 2.477 2.332 2.627 . 0 0 "[ . 1 . 2]" 1
157 1 59 TYR H 1 59 TYR HB3 3.200 . 3.800 3.678 3.581 3.774 . 0 0 "[ . 1 . 2]" 1
158 1 59 TYR H 1 59 TYR QD 4.100 . 5.000 2.819 2.358 3.466 . 0 0 "[ . 1 . 2]" 1
159 1 59 TYR H 1 59 TYR QE 5.500 . 6.700 4.812 4.505 5.152 . 0 0 "[ . 1 . 2]" 1
160 1 60 ALA H 1 60 ALA MB 3.000 . 3.700 2.237 2.217 2.251 . 0 0 "[ . 1 . 2]" 1
161 1 62 LYS HA 1 62 LYS HD2 2.700 . 3.200 2.861 1.784 3.592 0.392 1 0 "[ . 1 . 2]" 1
162 1 62 LYS H 1 62 LYS HB2 3.300 . 4.000 2.625 2.315 3.584 . 0 0 "[ . 1 . 2]" 1
163 1 62 LYS H 1 62 LYS HB3 3.000 . 3.600 3.525 2.383 3.760 0.160 6 0 "[ . 1 . 2]" 1
164 1 62 LYS H 1 62 LYS HG2 3.100 . 3.800 2.905 2.349 3.943 0.143 17 0 "[ . 1 . 2]" 1
165 1 63 ASP H 1 63 ASP HB2 3.200 . 3.800 2.742 2.210 3.854 0.054 7 0 "[ . 1 . 2]" 1
166 1 63 ASP H 1 63 ASP HB3 3.400 . 4.100 3.078 2.637 3.660 . 0 0 "[ . 1 . 2]" 1
167 1 64 ILE HA 1 64 ILE HG12 4.100 . 4.900 3.360 2.567 3.781 . 0 0 "[ . 1 . 2]" 1
168 1 64 ILE HA 1 64 ILE HG13 3.700 . 4.400 2.784 2.298 3.765 . 0 0 "[ . 1 . 2]" 1
169 1 64 ILE H 1 64 ILE HB 3.700 . 4.500 3.383 2.745 4.005 . 0 0 "[ . 1 . 2]" 1
170 1 64 ILE H 1 64 ILE HG13 3.800 . 4.600 4.108 2.958 4.734 0.134 18 0 "[ . 1 . 2]" 1
171 1 65 HIS H 1 65 HIS HB2 3.400 . 4.100 2.717 2.480 3.864 . 0 0 "[ . 1 . 2]" 1
172 1 65 HIS H 1 65 HIS HB3 3.500 . 4.200 3.771 3.679 3.884 . 0 0 "[ . 1 . 2]" 1
173 1 65 HIS H 1 65 HIS HD2 4.600 . 5.500 3.509 2.376 4.660 . 0 0 "[ . 1 . 2]" 1
174 1 66 PHE H 1 66 PHE HB2 3.500 . 4.200 2.430 2.329 2.571 . 0 0 "[ . 1 . 2]" 1
175 1 66 PHE H 1 66 PHE HB3 3.300 . 4.000 3.635 3.580 3.722 . 0 0 "[ . 1 . 2]" 1
176 1 66 PHE H 1 66 PHE QD 4.000 . 4.900 2.607 2.078 3.464 . 0 0 "[ . 1 . 2]" 1
177 1 67 VAL H 1 67 VAL HB 3.000 . 3.600 2.688 2.593 2.783 . 0 0 "[ . 1 . 2]" 1
178 1 67 VAL H 1 67 VAL MG2 4.300 . 5.300 2.643 2.524 2.827 . 0 0 "[ . 1 . 2]" 1
179 1 68 SER H 1 68 SER QB 3.200 . 3.800 2.502 2.273 2.754 . 0 0 "[ . 1 . 2]" 1
180 1 69 LEU H 1 69 LEU HB3 3.600 . 4.300 3.122 2.448 3.802 . 0 0 "[ . 1 . 2]" 1
181 1 69 LEU H 1 69 LEU HG 3.700 . 4.500 3.998 2.756 4.504 0.004 6 0 "[ . 1 . 2]" 1
182 1 70 SER H 1 70 SER HB2 3.700 . 4.400 3.226 2.379 3.495 . 0 0 "[ . 1 . 2]" 1
183 1 70 SER H 1 70 SER HB3 3.300 . 4.000 2.459 2.313 3.621 . 0 0 "[ . 1 . 2]" 1
184 1 71 CYS H 1 71 CYS HB2 4.100 . 4.900 2.878 2.440 3.596 . 0 0 "[ . 1 . 2]" 1
185 1 71 CYS H 1 71 CYS HB3 3.700 . 4.400 3.243 2.489 3.622 . 0 0 "[ . 1 . 2]" 1
186 1 72 ASP H 1 72 ASP HB2 3.200 . 3.800 2.514 2.240 2.972 . 0 0 "[ . 1 . 2]" 1
187 1 74 ASN HB2 1 74 ASN HD21 3.500 . 4.200 2.280 2.094 3.398 . 0 0 "[ . 1 . 2]" 1
188 1 74 ASN HB2 1 74 ASN HD22 3.700 . 4.500 3.495 3.409 4.008 . 0 0 "[ . 1 . 2]" 1
189 1 74 ASN HB3 1 74 ASN HD21 3.500 . 4.200 3.301 2.115 3.504 . 0 0 "[ . 1 . 2]" 1
190 1 74 ASN HB3 1 74 ASN HD22 3.300 . 4.000 3.965 3.387 4.064 0.064 5 0 "[ . 1 . 2]" 1
191 1 74 ASN H 1 74 ASN HB2 2.900 . 3.500 3.285 2.770 3.592 0.092 5 0 "[ . 1 . 2]" 1
192 1 74 ASN H 1 74 ASN HB3 3.000 . 3.600 3.240 2.274 3.743 0.143 11 0 "[ . 1 . 2]" 1
193 1 75 LYS HA 1 75 LYS HG2 3.200 . 3.800 2.601 2.161 3.553 . 0 0 "[ . 1 . 2]" 1
194 1 75 LYS HA 1 75 LYS HG3 3.300 . 4.000 2.934 2.476 3.337 . 0 0 "[ . 1 . 2]" 1
195 1 75 LYS HE2 1 75 LYS HG3 4.200 . 5.000 2.818 1.940 3.233 . 0 0 "[ . 1 . 2]" 1
196 1 75 LYS HE3 1 75 LYS HG3 4.100 . 4.900 2.821 2.523 3.417 . 0 0 "[ . 1 . 2]" 1
197 1 75 LYS H 1 75 LYS HB2 2.900 . 3.500 2.542 2.336 2.871 . 0 0 "[ . 1 . 2]" 1
198 1 75 LYS H 1 75 LYS HB3 3.000 . 3.600 2.667 2.431 2.887 . 0 0 "[ . 1 . 2]" 1
199 1 75 LYS H 1 75 LYS QD 4.000 . 4.800 4.505 4.343 4.640 . 0 0 "[ . 1 . 2]" 1
200 1 76 LYS H 1 76 LYS HB3 2.200 . 2.600 2.653 2.526 2.872 0.272 3 0 "[ . 1 . 2]" 1
201 1 77 ALA H 1 77 ALA MB 3.200 . 3.900 2.236 2.216 2.285 . 0 0 "[ . 1 . 2]" 1
202 1 78 TRP HB2 1 78 TRP HD1 2.800 . 3.400 3.391 3.277 3.437 0.037 14 0 "[ . 1 . 2]" 1
203 1 78 TRP HB2 1 78 TRP HE1 5.300 . 6.000 5.043 4.983 5.065 . 0 0 "[ . 1 . 2]" 1
204 1 78 TRP H 1 78 TRP HB3 2.700 . 3.200 2.428 2.342 2.584 . 0 0 "[ . 1 . 2]" 1
205 1 79 GLU HA 1 79 GLU HG2 3.700 . 4.400 3.425 2.627 3.782 . 0 0 "[ . 1 . 2]" 1
206 1 79 GLU HA 1 79 GLU HG3 3.700 . 4.400 3.629 3.160 3.862 . 0 0 "[ . 1 . 2]" 1
207 1 79 GLU H 1 79 GLU HB2 3.300 . 4.000 3.078 2.700 3.511 . 0 0 "[ . 1 . 2]" 1
208 1 79 GLU H 1 79 GLU HB3 3.100 . 3.700 3.014 2.111 3.597 . 0 0 "[ . 1 . 2]" 1
209 1 79 GLU H 1 79 GLU HG2 2.900 . 3.500 2.495 1.807 3.141 . 0 0 "[ . 1 . 2]" 1
210 1 80 ASN HB2 1 80 ASN HD21 3.400 . 4.100 2.635 2.060 3.451 . 0 0 "[ . 1 . 2]" 1
211 1 80 ASN HB2 1 80 ASN HD22 3.900 . 4.700 3.648 3.374 4.026 . 0 0 "[ . 1 . 2]" 1
212 1 80 ASN HB3 1 80 ASN HD21 3.100 . 3.700 2.886 2.192 3.571 . 0 0 "[ . 1 . 2]" 1
213 1 80 ASN H 1 80 ASN HB2 3.200 . 3.900 3.239 2.816 3.699 . 0 0 "[ . 1 . 2]" 1
214 1 80 ASN H 1 80 ASN HB3 2.900 . 3.500 3.133 2.443 3.625 0.125 2 0 "[ . 1 . 2]" 1
215 1 80 ASN H 1 80 ASN HD22 4.300 . 5.200 3.455 2.712 3.901 . 0 0 "[ . 1 . 2]" 1
216 1 81 MET HA 1 81 MET HG2 3.500 . 4.200 3.450 2.517 3.839 . 0 0 "[ . 1 . 2]" 1
217 1 81 MET HA 1 81 MET HG3 3.500 . 4.200 2.845 2.537 3.701 . 0 0 "[ . 1 . 2]" 1
218 1 81 MET H 1 81 MET HB2 2.900 . 3.500 2.656 2.281 2.901 . 0 0 "[ . 1 . 2]" 1
219 1 81 MET H 1 81 MET HB3 2.900 . 3.500 2.456 2.312 2.766 . 0 0 "[ . 1 . 2]" 1
220 1 81 MET H 1 81 MET HG2 3.600 . 4.300 4.413 4.265 4.561 0.261 6 0 "[ . 1 . 2]" 1
221 1 82 VAL H 1 82 VAL HB 2.600 . 3.100 2.755 2.160 2.990 . 0 0 "[ . 1 . 2]" 1
222 1 82 VAL H 1 82 VAL MG1 3.600 . 4.400 1.971 1.776 3.462 0.024 6 0 "[ . 1 . 2]" 1
223 1 83 THR H 1 83 THR HB 2.700 . 3.200 2.619 2.523 3.524 0.324 9 0 "[ . 1 . 2]" 1
224 1 83 THR H 1 83 THR MG 4.100 . 5.000 3.641 2.200 3.790 . 0 0 "[ . 1 . 2]" 1
225 1 84 LYS H 1 84 LYS HB2 2.500 . 3.000 2.435 2.189 2.661 . 0 0 "[ . 1 . 2]" 1
226 1 84 LYS H 1 84 LYS HB3 3.100 . 3.700 2.834 2.351 3.646 . 0 0 "[ . 1 . 2]" 1
227 1 84 LYS H 1 84 LYS QD 3.800 . 4.600 4.000 2.427 4.690 0.090 5 0 "[ . 1 . 2]" 1
228 1 84 LYS H 1 84 LYS QG 3.600 . 4.400 3.708 2.348 4.016 . 0 0 "[ . 1 . 2]" 1
229 1 85 ASP H 1 85 ASP QB 2.400 . 2.900 2.178 2.051 2.288 . 0 0 "[ . 1 . 2]" 1
230 1 86 GLN HA 1 86 GLN QG 2.300 . 2.800 2.480 2.332 2.804 0.004 13 0 "[ . 1 . 2]" 1
231 1 86 GLN HE21 1 86 GLN QG 2.900 . 3.500 2.366 2.153 2.797 . 0 0 "[ . 1 . 2]" 1
232 1 86 GLN HE22 1 86 GLN QG 3.200 . 3.800 3.320 3.212 3.482 . 0 0 "[ . 1 . 2]" 1
233 1 86 GLN H 1 86 GLN HB2 3.300 . 4.000 3.535 3.291 3.608 . 0 0 "[ . 1 . 2]" 1
234 1 86 GLN H 1 86 GLN HB3 3.600 . 4.300 4.080 4.051 4.111 . 0 0 "[ . 1 . 2]" 1
235 1 86 GLN H 1 86 GLN QG 2.500 . 3.000 2.837 2.709 3.051 0.051 1 0 "[ . 1 . 2]" 1
236 1 87 LEU HA 1 87 LEU QD 3.700 . 4.500 2.179 1.974 2.975 . 0 0 "[ . 1 . 2]" 1
237 1 87 LEU H 1 87 LEU QB 2.600 . 3.100 2.467 2.197 2.641 . 0 0 "[ . 1 . 2]" 1
238 1 87 LEU H 1 87 LEU QD 4.500 . 5.600 2.950 2.132 3.376 . 0 0 "[ . 1 . 2]" 1
239 1 88 LYS HA 1 88 LYS QD 2.500 . 3.000 2.559 1.876 3.481 0.481 19 0 "[ . 1 . 2]" 1
240 1 88 LYS HA 1 88 LYS QE 4.200 . 5.000 3.824 1.759 5.289 0.289 1 0 "[ . 1 . 2]" 1
241 1 88 LYS H 1 88 LYS HB2 3.100 . 3.700 2.777 2.357 3.787 0.087 19 0 "[ . 1 . 2]" 1
242 1 88 LYS H 1 88 LYS HB3 3.000 . 3.600 3.584 3.027 3.712 0.112 16 0 "[ . 1 . 2]" 1
243 1 88 LYS H 1 88 LYS HG2 3.300 . 4.000 2.974 2.225 3.985 . 0 0 "[ . 1 . 2]" 1
244 1 88 LYS H 1 88 LYS HG3 3.100 . 3.700 3.466 1.997 3.924 0.224 15 0 "[ . 1 . 2]" 1
245 1 90 ILE HA 1 90 ILE MD 4.400 . 5.400 3.178 1.949 3.890 . 0 0 "[ . 1 . 2]" 1
246 1 90 ILE HA 1 90 ILE HG12 2.900 . 3.500 2.829 2.529 3.552 0.052 6 0 "[ . 1 . 2]" 1
247 1 90 ILE H 1 90 ILE HB 2.600 . 3.100 2.580 2.497 2.646 . 0 0 "[ . 1 . 2]" 1
248 1 90 ILE H 1 90 ILE MD 4.200 . 5.100 3.569 1.917 3.880 . 0 0 "[ . 1 . 2]" 1
249 1 90 ILE H 1 90 ILE HG12 3.300 . 4.000 3.301 2.475 4.049 0.049 6 0 "[ . 1 . 2]" 1
250 1 90 ILE H 1 90 ILE HG13 3.500 . 4.200 3.011 2.094 4.153 . 0 0 "[ . 1 . 2]" 1
251 1 91 GLN HA 1 91 GLN QG 3.100 . 3.700 3.165 2.407 3.341 . 0 0 "[ . 1 . 2]" 1
252 1 91 GLN HE22 1 91 GLN QG 3.500 . 4.200 3.418 3.214 3.496 . 0 0 "[ . 1 . 2]" 1
253 1 91 GLN H 1 91 GLN HB2 3.400 . 4.100 3.424 2.594 3.829 . 0 0 "[ . 1 . 2]" 1
254 1 91 GLN H 1 91 GLN HB3 3.000 . 3.600 3.526 3.210 3.812 0.212 9 0 "[ . 1 . 2]" 1
255 1 91 GLN H 1 91 GLN HG2 3.300 . 4.000 2.430 1.859 4.085 0.085 6 0 "[ . 1 . 2]" 1
256 1 92 LEU H 1 92 LEU HB2 3.600 . 4.300 2.699 2.345 3.789 . 0 0 "[ . 1 . 2]" 1
257 1 92 LEU H 1 92 LEU HB3 4.000 . 4.800 3.653 3.201 3.759 . 0 0 "[ . 1 . 2]" 1
258 1 93 HIS HA 1 93 HIS HD2 2.900 . 3.500 3.182 2.636 3.471 . 0 0 "[ . 1 . 2]" 1
259 1 93 HIS HB2 1 93 HIS HD2 3.800 . 4.600 2.935 2.832 3.323 . 0 0 "[ . 1 . 2]" 1
260 1 93 HIS HB3 1 93 HIS HD2 3.600 . 4.300 3.948 3.913 3.987 . 0 0 "[ . 1 . 2]" 1
261 1 93 HIS H 1 93 HIS HB2 3.200 . 3.800 3.206 3.078 3.383 . 0 0 "[ . 1 . 2]" 1
262 1 94 MET HA 1 94 MET HG3 4.300 . 5.200 2.745 2.500 2.934 . 0 0 "[ . 1 . 2]" 1
263 1 94 MET HB2 1 94 MET ME 4.300 . 5.300 2.234 1.895 2.657 . 0 0 "[ . 1 . 2]" 1
264 1 94 MET H 1 94 MET HB2 3.800 . 4.600 2.815 2.508 3.039 . 0 0 "[ . 1 . 2]" 1
265 1 94 MET H 1 94 MET HB3 3.500 . 4.200 2.250 2.128 2.380 . 0 0 "[ . 1 . 2]" 1
266 1 94 MET H 1 94 MET ME 5.600 . 6.700 4.023 3.608 4.375 . 0 0 "[ . 1 . 2]" 1
267 1 94 MET H 1 94 MET HG2 3.400 . 4.100 4.201 4.107 4.353 0.253 5 0 "[ . 1 . 2]" 1
268 1 94 MET H 1 94 MET HG3 4.000 . 4.800 4.513 4.332 4.654 . 0 0 "[ . 1 . 2]" 1
269 1 96 THR HA 1 96 THR MG 3.400 . 4.200 2.401 2.190 3.218 . 0 0 "[ . 1 . 2]" 1
270 1 96 THR H 1 96 THR HB 4.000 . 4.800 3.357 2.791 4.054 . 0 0 "[ . 1 . 2]" 1
271 1 96 THR H 1 96 THR MG 4.200 . 5.100 3.207 2.008 4.009 . 0 0 "[ . 1 . 2]" 1
272 1 97 ASP H 1 97 ASP QB 2.200 . 2.600 2.481 2.347 2.737 0.137 1 0 "[ . 1 . 2]" 1
273 1 98 ARG HA 1 98 ARG QD 3.100 . 3.700 3.611 2.552 3.969 0.269 2 0 "[ . 1 . 2]" 1
274 1 98 ARG HA 1 98 ARG HE 3.900 . 4.700 4.601 3.204 4.976 0.276 11 0 "[ . 1 . 2]" 1
275 1 98 ARG HA 1 98 ARG QG 3.100 . 3.700 3.254 2.261 3.473 . 0 0 "[ . 1 . 2]" 1
276 1 98 ARG HB2 1 98 ARG QD 2.800 . 3.400 2.527 1.912 3.473 0.073 9 0 "[ . 1 . 2]" 1
277 1 98 ARG HB2 1 98 ARG HE 3.700 . 4.400 2.952 2.025 4.388 . 0 0 "[ . 1 . 2]" 1
278 1 98 ARG HB3 1 98 ARG QD 3.700 . 4.400 3.311 2.455 3.520 . 0 0 "[ . 1 . 2]" 1
279 1 98 ARG HB3 1 98 ARG HE 4.100 . 4.900 3.657 1.726 4.637 0.074 12 0 "[ . 1 . 2]" 1
280 1 98 ARG H 1 98 ARG HB2 3.900 . 4.700 3.437 2.440 3.912 . 0 0 "[ . 1 . 2]" 1
281 1 98 ARG H 1 98 ARG HB3 3.400 . 4.100 2.944 2.489 3.654 . 0 0 "[ . 1 . 2]" 1
282 1 98 ARG H 1 98 ARG QG 3.900 . 4.700 2.273 1.768 3.938 0.032 14 0 "[ . 1 . 2]" 1
283 1 99 THR H 1 99 THR MG 4.400 . 5.400 3.434 1.980 3.762 . 0 0 "[ . 1 . 2]" 1
284 1 100 PHE H 1 100 PHE HB2 3.100 . 3.700 2.406 2.043 2.689 . 0 0 "[ . 1 . 2]" 1
285 1 100 PHE H 1 100 PHE HB3 3.100 . 3.700 2.696 2.365 3.400 . 0 0 "[ . 1 . 2]" 1
286 1 100 PHE H 1 100 PHE QD 4.800 . 5.900 4.022 2.687 4.204 . 0 0 "[ . 1 . 2]" 1
287 1 101 MET HA 1 101 MET ME 4.200 . 5.100 4.007 1.804 4.870 . 0 0 "[ . 1 . 2]" 1
288 1 101 MET HA 1 101 MET QG 3.700 . 4.400 2.870 2.243 3.472 . 0 0 "[ . 1 . 2]" 1
289 1 101 MET H 1 101 MET HB2 3.300 . 4.000 2.826 2.126 3.685 . 0 0 "[ . 1 . 2]" 1
290 1 101 MET H 1 101 MET QG 3.400 . 4.100 2.880 1.885 4.010 . 0 0 "[ . 1 . 2]" 1
291 1 102 ASP H 1 102 ASP HB2 2.700 . 3.200 2.397 2.050 2.640 . 0 0 "[ . 1 . 2]" 1
292 1 102 ASP H 1 102 ASP HB3 2.900 . 3.500 3.088 2.408 3.595 0.095 18 0 "[ . 1 . 2]" 1
293 1 104 TYR HA 1 104 TYR QD 3.900 . 4.800 2.662 2.093 3.090 . 0 0 "[ . 1 . 2]" 1
294 1 104 TYR HB2 1 104 TYR QE 4.500 . 5.500 4.411 4.369 4.503 . 0 0 "[ . 1 . 2]" 1
295 1 104 TYR H 1 104 TYR HB2 3.200 . 3.800 2.351 2.154 2.477 . 0 0 "[ . 1 . 2]" 1
296 1 104 TYR H 1 104 TYR HB3 3.100 . 3.700 3.577 3.362 3.658 . 0 0 "[ . 1 . 2]" 1
297 1 104 TYR H 1 104 TYR QD 4.300 . 5.300 3.070 2.394 3.855 . 0 0 "[ . 1 . 2]" 1
298 1 104 TYR H 1 104 TYR QE 5.400 . 6.600 5.087 4.662 5.750 . 0 0 "[ . 1 . 2]" 1
299 1 105 LEU HA 1 105 LEU QD 3.400 . 4.200 2.231 1.831 3.442 . 0 0 "[ . 1 . 2]" 1
300 1 105 LEU H 1 105 LEU HB2 3.400 . 4.100 3.506 3.016 4.002 . 0 0 "[ . 1 . 2]" 1
301 1 105 LEU H 1 105 LEU HB3 3.400 . 4.100 4.018 3.071 4.115 0.015 16 0 "[ . 1 . 2]" 1
302 1 105 LEU H 1 105 LEU QD 4.100 . 5.000 2.693 2.204 3.648 . 0 0 "[ . 1 . 2]" 1
303 1 106 ILE HA 1 106 ILE MD 4.300 . 5.300 3.671 1.900 4.194 . 0 0 "[ . 1 . 2]" 1
304 1 106 ILE H 1 106 ILE MD 4.300 . 5.300 3.433 1.781 4.015 0.019 4 0 "[ . 1 . 2]" 1
305 1 107 ASN QB 1 107 ASN HD21 3.100 . 3.700 2.180 2.143 2.241 . 0 0 "[ . 1 . 2]" 1
306 1 107 ASN QB 1 107 ASN HD22 2.700 . 3.200 3.240 3.208 3.292 0.092 11 0 "[ . 1 . 2]" 1
307 1 109 ILE H 1 109 ILE HG12 2.900 . 3.500 2.726 1.962 3.511 0.011 11 0 "[ . 1 . 2]" 1
308 1 109 ILE H 1 109 ILE HG13 2.900 . 3.500 2.534 1.774 3.141 0.026 14 0 "[ . 1 . 2]" 1
309 1 110 PRO HA 1 110 PRO QG 3.700 . 4.400 3.365 2.999 3.529 . 0 0 "[ . 1 . 2]" 1
310 1 111 ARG HA 1 111 ARG HD2 3.600 . 4.300 3.368 2.566 3.860 . 0 0 "[ . 1 . 2]" 1
311 1 111 ARG HA 1 111 ARG HD3 3.400 . 4.100 2.664 2.210 3.909 . 0 0 "[ . 1 . 2]" 1
312 1 111 ARG HB3 1 111 ARG HD3 4.200 . 5.000 3.124 2.441 3.710 . 0 0 "[ . 1 . 2]" 1
313 1 111 ARG H 1 111 ARG HB2 3.100 . 3.700 2.473 2.173 2.833 . 0 0 "[ . 1 . 2]" 1
314 1 111 ARG H 1 111 ARG HB3 4.000 . 4.800 3.105 2.651 3.359 . 0 0 "[ . 1 . 2]" 1
315 1 111 ARG H 1 111 ARG HD3 4.600 . 5.500 5.062 4.734 5.712 0.212 6 0 "[ . 1 . 2]" 1
316 1 112 PHE H 1 112 PHE HB2 3.800 . 4.600 3.164 2.666 3.539 . 0 0 "[ . 1 . 2]" 1
317 1 112 PHE H 1 112 PHE HB3 3.600 . 4.300 3.512 3.219 3.769 . 0 0 "[ . 1 . 2]" 1
318 1 112 PHE H 1 112 PHE QD 4.800 . 5.900 2.831 2.663 3.274 . 0 0 "[ . 1 . 2]" 1
319 1 113 ILE HA 1 113 ILE HG12 4.200 . 5.000 2.579 2.490 2.947 . 0 0 "[ . 1 . 2]" 1
320 1 113 ILE H 1 113 ILE HB 3.000 . 3.600 2.737 2.652 3.144 . 0 0 "[ . 1 . 2]" 1
321 1 113 ILE H 1 113 ILE MD 5.100 . 6.200 4.138 3.896 4.866 . 0 0 "[ . 1 . 2]" 1
322 1 113 ILE H 1 113 ILE HG12 4.300 . 5.200 4.079 2.930 4.698 . 0 0 "[ . 1 . 2]" 1
323 1 113 ILE H 1 113 ILE HG13 3.900 . 4.700 3.128 2.742 4.737 0.037 6 0 "[ . 1 . 2]" 1
324 1 114 LEU H 1 114 LEU HB3 3.300 . 4.000 2.752 2.558 3.277 . 0 0 "[ . 1 . 2]" 1
325 1 115 LEU H 1 115 LEU HB2 3.500 . 4.200 2.932 2.738 3.697 . 0 0 "[ . 1 . 2]" 1
326 1 115 LEU H 1 115 LEU HB3 3.600 . 4.300 3.877 3.646 3.933 . 0 0 "[ . 1 . 2]" 1
327 1 115 LEU H 1 115 LEU QD 4.800 . 5.600 2.314 2.104 2.913 . 0 0 "[ . 1 . 2]" 1
328 1 116 ASP H 1 116 ASP HB2 3.300 . 4.000 2.696 2.199 3.645 . 0 0 "[ . 1 . 2]" 1
329 1 116 ASP H 1 116 ASP HB3 3.200 . 3.800 2.478 2.265 2.844 . 0 0 "[ . 1 . 2]" 1
330 1 117 ARG HA 1 117 ARG QD 3.700 . 4.400 4.127 3.980 4.315 . 0 0 "[ . 1 . 2]" 1
331 1 117 ARG HA 1 117 ARG HG2 3.700 . 4.400 2.760 2.458 3.147 . 0 0 "[ . 1 . 2]" 1
332 1 117 ARG H 1 117 ARG HG2 4.300 . 5.200 3.320 2.893 3.647 . 0 0 "[ . 1 . 2]" 1
333 1 117 ARG H 1 117 ARG HG3 4.100 . 4.900 2.001 1.766 2.443 0.034 2 0 "[ . 1 . 2]" 1
334 1 118 ASP H 1 118 ASP HB2 3.300 . 4.000 2.435 2.249 2.631 . 0 0 "[ . 1 . 2]" 1
335 1 118 ASP H 1 118 ASP HB3 3.400 . 4.100 2.749 2.540 3.604 . 0 0 "[ . 1 . 2]" 1
336 1 120 LYS HA 1 120 LYS HG2 3.500 . 4.200 2.851 2.371 3.524 . 0 0 "[ . 1 . 2]" 1
337 1 120 LYS H 1 120 LYS HB2 2.800 . 3.400 2.554 2.381 3.244 . 0 0 "[ . 1 . 2]" 1
338 1 120 LYS H 1 120 LYS HB3 3.400 . 4.100 3.604 2.148 3.747 . 0 0 "[ . 1 . 2]" 1
339 1 120 LYS H 1 120 LYS HG2 3.200 . 3.800 3.136 1.940 3.870 0.070 16 0 "[ . 1 . 2]" 1
340 1 121 ILE HA 1 121 ILE HG12 3.100 . 3.700 3.509 2.642 3.620 . 0 0 "[ . 1 . 2]" 1
341 1 121 ILE HA 1 121 ILE HG13 3.500 . 4.200 2.368 2.326 2.509 . 0 0 "[ . 1 . 2]" 1
342 1 121 ILE HA 1 121 ILE MG 3.200 . 3.800 2.478 2.450 2.527 . 0 0 "[ . 1 . 2]" 1
343 1 121 ILE H 1 121 ILE MD 4.600 . 5.600 1.857 1.690 3.168 0.110 2 0 "[ . 1 . 2]" 1
344 1 121 ILE H 1 121 ILE HG12 3.300 . 4.000 3.806 3.609 3.951 . 0 0 "[ . 1 . 2]" 1
345 1 121 ILE H 1 121 ILE HG13 3.300 . 4.000 3.031 2.083 3.341 . 0 0 "[ . 1 . 2]" 1
346 1 122 ILE HA 1 122 ILE HG12 3.300 . 4.000 2.834 2.534 3.072 . 0 0 "[ . 1 . 2]" 1
347 1 122 ILE HA 1 122 ILE HG13 3.300 . 4.000 3.473 3.078 3.723 . 0 0 "[ . 1 . 2]" 1
348 1 122 ILE H 1 122 ILE HB 2.900 . 3.500 2.464 2.351 2.530 . 0 0 "[ . 1 . 2]" 1
349 1 122 ILE H 1 122 ILE HG12 3.900 . 4.700 3.013 2.482 3.687 . 0 0 "[ . 1 . 2]" 1
350 1 122 ILE H 1 122 ILE HG13 3.900 . 4.700 3.336 2.355 4.016 . 0 0 "[ . 1 . 2]" 1
351 1 122 ILE H 1 122 ILE MG 4.500 . 5.500 3.771 3.715 3.797 . 0 0 "[ . 1 . 2]" 1
352 1 123 SER H 1 123 SER HB2 3.800 . 4.600 2.860 2.707 3.281 . 0 0 "[ . 1 . 2]" 1
353 1 123 SER H 1 123 SER HB3 3.800 . 4.600 3.821 2.752 3.960 . 0 0 "[ . 1 . 2]" 1
354 1 125 ASN HB2 1 125 ASN HD22 3.200 . 3.800 3.753 3.406 4.012 0.212 11 0 "[ . 1 . 2]" 1
355 1 125 ASN HB3 1 125 ASN HD21 3.100 . 3.700 2.588 2.194 3.391 . 0 0 "[ . 1 . 2]" 1
356 1 125 ASN HB3 1 125 ASN HD22 2.900 . 3.500 3.612 3.445 3.951 0.451 12 0 "[ . 1 . 2]" 1
357 1 125 ASN H 1 125 ASN HB2 3.500 . 4.200 3.522 2.979 3.958 . 0 0 "[ . 1 . 2]" 1
358 1 125 ASN H 1 125 ASN HB3 3.100 . 3.700 3.087 2.570 3.515 . 0 0 "[ . 1 . 2]" 1
359 1 126 MET H 1 126 MET QB 2.700 . 3.200 2.348 2.110 2.440 . 0 0 "[ . 1 . 2]" 1
360 1 126 MET H 1 126 MET HG2 4.100 . 4.900 4.516 2.725 4.812 . 0 0 "[ . 1 . 2]" 1
361 1 127 THR HA 1 127 THR MG 3.500 . 4.300 2.228 2.145 2.298 . 0 0 "[ . 1 . 2]" 1
362 1 127 THR H 1 127 THR MG 4.000 . 4.900 3.564 3.114 4.051 . 0 0 "[ . 1 . 2]" 1
363 1 128 ARG HB2 1 128 ARG HD2 3.500 . 4.200 2.998 2.162 3.737 . 0 0 "[ . 1 . 2]" 1
364 1 128 ARG HB2 1 128 ARG HD3 3.600 . 4.300 3.155 2.323 4.135 . 0 0 "[ . 1 . 2]" 1
365 1 128 ARG HB2 1 128 ARG HE 5.000 . 6.000 3.753 2.030 4.725 . 0 0 "[ . 1 . 2]" 1
366 1 128 ARG HB3 1 128 ARG HE 5.100 . 6.000 3.795 1.861 4.722 . 0 0 "[ . 1 . 2]" 1
367 1 128 ARG H 1 128 ARG HB2 3.400 . 4.100 2.991 2.213 3.588 . 0 0 "[ . 1 . 2]" 1
368 1 128 ARG H 1 128 ARG HB3 3.500 . 4.200 2.879 2.343 3.939 . 0 0 "[ . 1 . 2]" 1
369 1 128 ARG H 1 128 ARG HD2 4.000 . 4.900 4.831 4.461 5.408 0.508 2 1 "[ + . 1 . 2]" 1
370 1 128 ARG H 1 128 ARG QG 3.500 . 4.200 3.614 2.034 4.414 0.214 17 0 "[ . 1 . 2]" 1
371 1 129 PRO HA 1 129 PRO HD2 4.500 . 5.400 3.938 3.806 4.082 . 0 0 "[ . 1 . 2]" 1
372 1 129 PRO HA 1 129 PRO HG2 3.900 . 4.700 3.887 3.810 3.991 . 0 0 "[ . 1 . 2]" 1
373 1 129 PRO HA 1 129 PRO HG3 3.800 . 4.600 3.193 2.785 3.992 . 0 0 "[ . 1 . 2]" 1
374 1 130 SER H 1 130 SER HB2 3.500 . 4.200 3.028 2.485 4.093 . 0 0 "[ . 1 . 2]" 1
375 1 131 ASP H 1 131 ASP HB2 2.600 . 3.100 2.782 2.540 3.541 0.441 16 0 "[ . 1 . 2]" 1
376 1 131 ASP H 1 131 ASP HB3 2.600 . 3.100 2.557 2.286 2.767 . 0 0 "[ . 1 . 2]" 1
377 1 132 PRO HA 1 132 PRO QD 3.500 . 4.200 3.340 3.197 3.434 . 0 0 "[ . 1 . 2]" 1
378 1 132 PRO HB3 1 132 PRO QD 3.200 . 3.800 3.231 2.809 3.542 . 0 0 "[ . 1 . 2]" 1
379 1 133 LYS H 1 133 LYS HB3 3.200 . 3.800 3.598 3.557 3.644 . 0 0 "[ . 1 . 2]" 1
380 1 133 LYS H 1 133 LYS HG2 2.800 . 3.400 2.912 1.935 3.633 0.233 5 0 "[ . 1 . 2]" 1
381 1 134 THR H 1 134 THR HB 3.000 . 3.600 2.813 2.434 3.588 . 0 0 "[ . 1 . 2]" 1
382 1 135 ALA H 1 135 ALA MB 3.400 . 4.200 2.226 2.198 2.241 . 0 0 "[ . 1 . 2]" 1
383 1 136 GLU HA 1 136 GLU HG2 3.300 . 4.000 3.136 2.346 3.917 . 0 0 "[ . 1 . 2]" 1
384 1 136 GLU HA 1 136 GLU HG3 3.300 . 4.000 3.564 2.789 3.840 . 0 0 "[ . 1 . 2]" 1
385 1 136 GLU H 1 136 GLU QB 2.300 . 2.800 2.510 2.319 2.641 . 0 0 "[ . 1 . 2]" 1
386 1 136 GLU H 1 136 GLU HG2 3.000 . 3.600 2.428 1.888 3.598 . 0 0 "[ . 1 . 2]" 1
387 1 136 GLU H 1 136 GLU HG3 2.800 . 3.400 2.993 2.048 3.491 0.091 12 0 "[ . 1 . 2]" 1
388 1 137 LYS H 1 137 LYS QB 2.400 . 2.900 2.260 2.028 2.522 . 0 0 "[ . 1 . 2]" 1
389 1 137 LYS H 1 137 LYS HD2 4.100 . 5.000 4.701 4.270 5.157 0.157 14 0 "[ . 1 . 2]" 1
390 1 137 LYS H 1 137 LYS HG2 4.100 . 5.000 4.058 2.265 4.650 . 0 0 "[ . 1 . 2]" 1
391 1 137 LYS H 1 137 LYS HG3 3.900 . 4.700 4.212 2.209 4.540 . 0 0 "[ . 1 . 2]" 1
392 1 138 PHE HA 1 138 PHE QD 3.400 . 4.200 2.160 1.978 2.283 . 0 0 "[ . 1 . 2]" 1
393 1 138 PHE H 1 138 PHE HB2 2.900 . 3.500 2.698 2.556 2.782 . 0 0 "[ . 1 . 2]" 1
394 1 138 PHE H 1 138 PHE HB3 3.100 . 3.700 3.633 3.601 3.649 . 0 0 "[ . 1 . 2]" 1
395 1 138 PHE H 1 138 PHE QD 4.100 . 5.000 2.970 2.739 3.149 . 0 0 "[ . 1 . 2]" 1
396 1 138 PHE H 1 138 PHE QE 5.400 . 6.600 4.284 4.109 4.511 . 0 0 "[ . 1 . 2]" 1
397 1 139 ASN HB2 1 139 ASN HD21 3.200 . 3.800 2.494 2.162 3.412 . 0 0 "[ . 1 . 2]" 1
398 1 139 ASN HB2 1 139 ASN HD22 3.500 . 4.200 3.589 3.431 4.016 . 0 0 "[ . 1 . 2]" 1
399 1 139 ASN HB3 1 139 ASN HD21 3.300 . 4.000 2.893 2.162 3.566 . 0 0 "[ . 1 . 2]" 1
400 1 139 ASN HB3 1 139 ASN HD22 3.600 . 4.300 3.773 3.458 4.089 . 0 0 "[ . 1 . 2]" 1
401 1 139 ASN H 1 139 ASN HB2 3.100 . 3.700 2.969 2.391 3.672 . 0 0 "[ . 1 . 2]" 1
402 1 139 ASN H 1 139 ASN HB3 3.000 . 3.600 3.297 2.587 3.671 0.071 13 0 "[ . 1 . 2]" 1
403 1 139 ASN H 1 139 ASN HD22 4.300 . 5.200 3.993 3.392 4.779 . 0 0 "[ . 1 . 2]" 1
404 1 140 GLU HA 1 140 GLU HG2 2.800 . 3.400 2.902 2.666 3.247 . 0 0 "[ . 1 . 2]" 1
405 1 140 GLU HA 1 140 GLU HG3 2.900 . 3.500 2.735 2.429 3.066 . 0 0 "[ . 1 . 2]" 1
406 1 140 GLU H 1 140 GLU QB 2.700 . 3.200 2.213 2.175 2.286 . 0 0 "[ . 1 . 2]" 1
407 1 140 GLU H 1 140 GLU HG2 3.800 . 4.600 4.420 4.332 4.507 . 0 0 "[ . 1 . 2]" 1
408 1 140 GLU H 1 140 GLU HG3 3.600 . 4.300 4.406 4.319 4.495 0.195 14 0 "[ . 1 . 2]" 1
409 1 141 LEU HA 1 141 LEU HG 3.400 . 4.100 3.242 2.402 3.706 . 0 0 "[ . 1 . 2]" 1
410 1 141 LEU H 1 141 LEU HB2 3.200 . 3.800 2.792 2.362 3.627 . 0 0 "[ . 1 . 2]" 1
411 1 141 LEU H 1 141 LEU QD 4.800 . 5.500 2.916 1.778 3.091 0.022 5 0 "[ . 1 . 2]" 1
412 1 141 LEU H 1 141 LEU HG 2.600 . 3.100 2.235 1.885 3.418 0.318 5 0 "[ . 1 . 2]" 1
413 1 142 LEU HA 1 142 LEU QD 3.800 . 4.700 2.119 1.821 2.684 . 0 0 "[ . 1 . 2]" 1
414 1 142 LEU H 1 142 LEU HB2 2.600 . 3.100 2.379 2.078 2.685 . 0 0 "[ . 1 . 2]" 1
415 1 142 LEU H 1 142 LEU HB3 3.000 . 3.600 3.362 2.402 3.618 0.018 1 0 "[ . 1 . 2]" 1
416 1 142 LEU H 1 142 LEU QD 4.800 . 5.900 3.021 2.070 3.778 . 0 0 "[ . 1 . 2]" 1
417 1 144 LEU HA 1 144 LEU QD 3.400 . 4.200 2.318 2.032 3.094 . 0 0 "[ . 1 . 2]" 1
418 1 144 LEU H 1 144 LEU HB3 2.200 . 2.600 2.459 2.335 2.613 0.013 17 0 "[ . 1 . 2]" 1
419 1 144 LEU H 1 144 LEU QD 4.700 . 5.500 3.772 3.690 3.889 . 0 0 "[ . 1 . 2]" 1
420 1 145 GLU HA 1 145 GLU HG2 3.100 . 3.700 2.815 2.136 4.066 0.366 13 0 "[ . 1 . 2]" 1
421 1 145 GLU HA 1 145 GLU HG3 2.500 . 3.000 3.095 2.654 3.429 0.429 16 0 "[ . 1 . 2]" 1
422 1 145 GLU H 1 145 GLU HB2 3.000 . 3.600 2.614 2.011 3.655 0.055 9 0 "[ . 1 . 2]" 1
423 1 145 GLU H 1 145 GLU HB3 3.300 . 3.900 3.547 3.247 3.976 0.076 9 0 "[ . 1 . 2]" 1
424 1 145 GLU H 1 145 GLU HG3 3.200 . 3.800 2.891 1.770 4.192 0.392 2 0 "[ . 1 . 2]" 1
425 1 3 LEU HA 1 4 ARG H 3.900 . 4.700 2.625 2.091 3.560 . 0 0 "[ . 1 . 2]" 1
426 1 3 LEU QB 1 4 ARG H 3.900 . 4.700 3.238 1.967 3.991 . 0 0 "[ . 1 . 2]" 1
427 1 4 ARG HA 1 5 SER H 3.400 . 4.100 3.186 2.155 3.543 . 0 0 "[ . 1 . 2]" 1
428 1 5 SER HA 1 6 GLY H 3.200 . 3.800 2.802 2.177 3.573 . 0 0 "[ . 1 . 2]" 1
429 1 6 GLY QA 1 7 ASN HB2 5.100 . 6.000 4.578 3.869 5.428 . 0 0 "[ . 1 . 2]" 1
430 1 7 ASN HA 1 8 PRO HA 4.500 . 5.400 4.431 4.352 4.485 . 0 0 "[ . 1 . 2]" 1
431 1 7 ASN HA 1 8 PRO HD2 2.400 . 2.900 2.729 2.320 2.928 0.028 13 0 "[ . 1 . 2]" 1
432 1 7 ASN HA 1 8 PRO HD3 2.600 . 3.100 2.038 1.772 2.688 0.028 15 0 "[ . 1 . 2]" 1
433 1 7 ASN HA 1 8 PRO QG 3.700 . 4.400 3.835 3.610 4.206 . 0 0 "[ . 1 . 2]" 1
434 1 7 ASN HB2 1 8 PRO HD2 4.000 . 4.800 3.509 1.976 4.828 0.028 14 0 "[ . 1 . 2]" 1
435 1 7 ASN HB2 1 8 PRO HD3 3.900 . 4.700 4.068 3.000 4.806 0.106 16 0 "[ . 1 . 2]" 1
436 1 7 ASN HB2 1 8 PRO QG 4.600 . 5.500 5.058 3.867 5.772 0.272 14 0 "[ . 1 . 2]" 1
437 1 7 ASN HB3 1 8 PRO HD2 3.300 . 4.000 3.020 1.759 4.072 0.072 15 0 "[ . 1 . 2]" 1
438 1 7 ASN HB3 1 8 PRO HD3 3.400 . 4.100 3.669 2.999 4.245 0.145 12 0 "[ . 1 . 2]" 1
439 1 7 ASN HB3 1 8 PRO QG 4.600 . 5.500 4.653 3.230 5.529 0.029 10 0 "[ . 1 . 2]" 1
440 1 8 PRO HB2 1 9 SER H 3.300 . 4.000 3.148 1.751 4.118 0.118 20 0 "[ . 1 . 2]" 1
441 1 8 PRO HB3 1 9 SER H 3.700 . 4.400 3.802 3.057 4.430 0.030 8 0 "[ . 1 . 2]" 1
442 1 9 SER HA 1 10 ALA H 2.500 . 3.000 2.443 2.110 3.249 0.249 11 0 "[ . 1 . 2]" 1
443 1 9 SER HB2 1 10 ALA H 3.700 . 4.400 3.649 1.858 4.452 0.052 17 0 "[ . 1 . 2]" 1
444 1 9 SER H 1 10 ALA H 3.700 . 4.400 4.106 2.591 4.571 0.171 12 0 "[ . 1 . 2]" 1
445 1 10 ALA H 1 11 ALA H 3.100 . 3.700 3.302 2.358 3.838 0.138 10 0 "[ . 1 . 2]" 1
446 1 11 ALA HA 1 12 SER H 2.800 . 3.300 2.797 2.100 3.495 0.195 20 0 "[ . 1 . 2]" 1
447 1 11 ALA MB 1 12 SER H 4.300 . 5.300 3.230 1.988 3.719 . 0 0 "[ . 1 . 2]" 1
448 1 11 ALA MB 1 12 SER QB 5.800 . 6.700 3.721 3.287 3.952 . 0 0 "[ . 1 . 2]" 1
449 1 11 ALA H 1 12 SER H 3.100 . 3.700 3.156 1.758 3.883 0.183 8 0 "[ . 1 . 2]" 1
450 1 12 SER HA 1 13 PHE H 2.500 . 3.000 2.403 2.144 3.038 0.038 11 0 "[ . 1 . 2]" 1
451 1 12 SER HA 1 13 PHE QD 6.500 . 6.700 4.305 3.387 4.916 . 0 0 "[ . 1 . 2]" 1
452 1 12 SER QB 1 13 PHE H 3.300 . 4.000 3.747 3.182 4.035 0.035 18 0 "[ . 1 . 2]" 1
453 1 12 SER QB 1 13 PHE HA 4.800 . 5.800 4.393 3.967 4.721 . 0 0 "[ . 1 . 2]" 1
454 1 12 SER H 1 13 PHE H 3.400 . 4.100 3.216 2.017 4.222 0.122 16 0 "[ . 1 . 2]" 1
455 1 13 PHE HA 1 14 SER H 2.400 . 2.900 2.400 2.158 2.596 . 0 0 "[ . 1 . 2]" 1
456 1 13 PHE HA 1 14 SER QB 4.600 . 5.500 4.309 3.911 4.481 . 0 0 "[ . 1 . 2]" 1
457 1 13 PHE HB2 1 14 SER H 3.200 . 3.800 2.487 2.064 3.212 . 0 0 "[ . 1 . 2]" 1
458 1 13 PHE HB3 1 14 SER H 3.400 . 4.100 3.761 3.492 4.113 0.013 14 0 "[ . 1 . 2]" 1
459 1 13 PHE QD 1 14 SER H 4.800 . 5.900 3.435 3.003 4.311 . 0 0 "[ . 1 . 2]" 1
460 1 13 PHE QD 1 14 SER HA 5.200 . 6.300 3.347 3.023 4.163 . 0 0 "[ . 1 . 2]" 1
461 1 13 PHE H 1 14 SER H 4.000 . 4.800 4.515 4.299 4.647 . 0 0 "[ . 1 . 2]" 1
462 1 14 SER HA 1 15 TYR H 2.300 . 2.800 2.163 2.131 2.195 . 0 0 "[ . 1 . 2]" 1
463 1 14 SER HA 1 15 TYR QD 4.900 . 6.000 4.235 3.786 4.823 . 0 0 "[ . 1 . 2]" 1
464 1 14 SER QB 1 15 TYR H 3.500 . 4.200 3.384 3.146 3.834 . 0 0 "[ . 1 . 2]" 1
465 1 14 SER H 1 15 TYR H 3.800 . 4.600 4.168 3.926 4.268 . 0 0 "[ . 1 . 2]" 1
466 1 15 TYR HA 1 16 PRO HD2 3.300 . 4.000 2.859 2.401 3.169 . 0 0 "[ . 1 . 2]" 1
467 1 15 TYR HA 1 16 PRO HD3 3.100 . 3.700 1.983 1.785 2.232 0.015 18 0 "[ . 1 . 2]" 1
468 1 15 TYR HA 1 16 PRO HG2 4.900 . 5.900 4.559 4.426 4.775 . 0 0 "[ . 1 . 2]" 1
469 1 15 TYR HB2 1 16 PRO HD2 4.600 . 5.500 4.074 3.718 4.403 . 0 0 "[ . 1 . 2]" 1
470 1 15 TYR HB2 1 16 PRO HD3 5.000 . 6.000 4.418 4.079 4.848 . 0 0 "[ . 1 . 2]" 1
471 1 15 TYR HB3 1 16 PRO HD2 4.100 . 4.900 2.464 2.072 2.819 . 0 0 "[ . 1 . 2]" 1
472 1 15 TYR QD 1 16 PRO HD2 5.300 . 6.500 2.755 2.072 3.160 . 0 0 "[ . 1 . 2]" 1
473 1 15 TYR QD 1 16 PRO HD3 6.500 . 6.700 2.909 2.364 3.506 . 0 0 "[ . 1 . 2]" 1
474 1 15 TYR QE 1 16 PRO HD2 4.400 . 5.300 4.990 4.321 5.335 0.035 5 0 "[ . 1 . 2]" 1
475 1 15 TYR H 1 16 PRO HD2 4.600 . 5.500 5.192 4.942 5.376 . 0 0 "[ . 1 . 2]" 1
476 1 15 TYR H 1 16 PRO HD3 4.200 . 5.000 4.663 4.487 4.854 . 0 0 "[ . 1 . 2]" 1
477 1 16 PRO HA 1 17 ASP H 2.400 . 2.900 2.115 2.098 2.159 . 0 0 "[ . 1 . 2]" 1
478 1 16 PRO QB 1 17 ASP H 3.000 . 3.600 3.390 3.233 3.441 . 0 0 "[ . 1 . 2]" 1
479 1 16 PRO HG2 1 17 ASP H 4.800 . 5.800 5.327 4.924 5.683 . 0 0 "[ . 1 . 2]" 1
480 1 17 ASP HA 1 18 ILE H 3.300 . 4.000 2.389 2.315 2.481 . 0 0 "[ . 1 . 2]" 1
481 1 17 ASP HB2 1 18 ILE H 3.400 . 4.100 3.685 3.308 3.988 . 0 0 "[ . 1 . 2]" 1
482 1 17 ASP HB3 1 18 ILE H 3.100 . 3.700 3.715 2.266 3.879 0.179 5 0 "[ . 1 . 2]" 1
483 1 17 ASP H 1 18 ILE H 4.100 . 4.900 4.602 4.578 4.635 . 0 0 "[ . 1 . 2]" 1
484 1 18 ILE HA 1 19 ASN H 3.400 . 4.100 3.526 3.479 3.573 . 0 0 "[ . 1 . 2]" 1
485 1 18 ILE HB 1 19 ASN H 3.700 . 4.400 3.895 2.541 4.167 . 0 0 "[ . 1 . 2]" 1
486 1 18 ILE HB 1 19 ASN HA 6.000 . 6.000 5.381 4.308 5.774 . 0 0 "[ . 1 . 2]" 1
487 1 18 ILE MD 1 19 ASN HA 6.500 . 6.700 4.577 2.848 5.594 . 0 0 "[ . 1 . 2]" 1
488 1 18 ILE MG 1 19 ASN H 4.100 . 5.000 2.477 1.995 4.006 . 0 0 "[ . 1 . 2]" 1
489 1 18 ILE MG 1 19 ASN HA 5.600 . 6.700 3.673 3.002 5.437 . 0 0 "[ . 1 . 2]" 1
490 1 18 ILE MG 1 19 ASN HD21 4.900 . 6.000 2.915 1.751 5.668 0.049 5 0 "[ . 1 . 2]" 1
491 1 18 ILE MG 1 19 ASN HD22 5.200 . 6.300 3.207 2.253 6.145 . 0 0 "[ . 1 . 2]" 1
492 1 19 ASN HA 1 20 GLY H 3.300 . 4.000 3.264 3.128 3.371 . 0 0 "[ . 1 . 2]" 1
493 1 19 ASN HB2 1 20 GLY H 3.900 . 4.700 3.626 3.302 4.282 . 0 0 "[ . 1 . 2]" 1
494 1 19 ASN HB3 1 20 GLY H 4.200 . 5.000 4.222 4.031 4.379 . 0 0 "[ . 1 . 2]" 1
495 1 19 ASN HD22 1 20 GLY H 4.900 . 6.000 5.731 3.989 6.051 0.051 14 0 "[ . 1 . 2]" 1
496 1 19 ASN H 1 20 GLY H 2.300 . 2.800 2.601 2.386 2.765 . 0 0 "[ . 1 . 2]" 1
497 1 19 ASN H 1 20 GLY HA2 4.300 . 5.100 4.908 4.778 5.009 . 0 0 "[ . 1 . 2]" 1
498 1 19 ASN H 1 20 GLY HA3 4.700 . 5.700 5.204 5.070 5.290 . 0 0 "[ . 1 . 2]" 1
499 1 20 GLY HA2 1 21 LYS H 3.300 . 4.000 2.853 2.642 2.984 . 0 0 "[ . 1 . 2]" 1
500 1 20 GLY HA3 1 21 LYS H 3.300 . 4.000 3.506 3.458 3.552 . 0 0 "[ . 1 . 2]" 1
501 1 20 GLY H 1 21 LYS H 2.800 . 3.400 2.288 2.052 2.515 . 0 0 "[ . 1 . 2]" 1
502 1 20 GLY H 1 21 LYS HA 4.000 . 5.000 4.924 4.732 5.075 0.075 14 0 "[ . 1 . 2]" 1
503 1 20 GLY H 1 21 LYS HB3 4.400 . 5.300 4.471 3.841 4.986 . 0 0 "[ . 1 . 2]" 1
504 1 21 LYS HA 1 22 THR H 2.000 . 2.400 2.162 2.138 2.252 . 0 0 "[ . 1 . 2]" 1
505 1 21 LYS HA 1 22 THR HA 4.800 . 5.800 4.391 4.315 4.430 . 0 0 "[ . 1 . 2]" 1
506 1 21 LYS HB2 1 22 THR H 3.700 . 4.400 4.298 3.721 4.452 0.052 9 0 "[ . 1 . 2]" 1
507 1 21 LYS HB3 1 22 THR H 3.700 . 4.400 4.268 3.661 4.421 0.021 16 0 "[ . 1 . 2]" 1
508 1 21 LYS HG2 1 22 THR H 3.500 . 4.200 3.591 2.708 4.410 0.210 19 0 "[ . 1 . 2]" 1
509 1 21 LYS HG3 1 22 THR H 3.600 . 4.300 3.510 2.630 4.326 0.026 11 0 "[ . 1 . 2]" 1
510 1 22 THR HA 1 23 VAL H 2.400 . 2.900 2.165 2.133 2.206 . 0 0 "[ . 1 . 2]" 1
511 1 22 THR HB 1 23 VAL H 3.800 . 4.600 4.341 4.240 4.413 . 0 0 "[ . 1 . 2]" 1
512 1 22 THR MG 1 23 VAL H 3.900 . 4.800 3.206 2.948 3.359 . 0 0 "[ . 1 . 2]" 1
513 1 22 THR H 1 23 VAL H 4.100 . 5.200 4.308 4.145 4.442 . 0 0 "[ . 1 . 2]" 1
514 1 23 VAL HA 1 24 SER H 2.200 . 2.600 2.196 2.115 2.357 . 0 0 "[ . 1 . 2]" 1
515 1 23 VAL HB 1 24 SER H 3.900 . 4.700 4.096 3.743 4.309 . 0 0 "[ . 1 . 2]" 1
516 1 23 VAL MG2 1 24 SER H 4.000 . 4.900 3.951 2.281 4.219 . 0 0 "[ . 1 . 2]" 1
517 1 25 LEU HA 1 26 ALA H 3.400 . 4.100 3.347 2.850 3.544 . 0 0 "[ . 1 . 2]" 1
518 1 25 LEU HB2 1 26 ALA H 3.500 . 4.200 4.116 3.765 4.417 0.217 13 0 "[ . 1 . 2]" 1
519 1 25 LEU HB3 1 26 ALA H 3.600 . 4.300 3.228 2.525 4.020 . 0 0 "[ . 1 . 2]" 1
520 1 25 LEU H 1 26 ALA H 3.200 . 3.800 2.581 2.291 2.871 . 0 0 "[ . 1 . 2]" 1
521 1 26 ALA HA 1 27 ASP H 3.300 . 4.000 3.434 3.119 3.554 . 0 0 "[ . 1 . 2]" 1
522 1 26 ALA MB 1 27 ASP H 4.100 . 5.000 2.866 2.488 3.516 . 0 0 "[ . 1 . 2]" 1
523 1 26 ALA MB 1 27 ASP HA 5.700 . 6.700 3.971 3.836 4.157 . 0 0 "[ . 1 . 2]" 1
524 1 26 ALA H 1 27 ASP H 2.600 . 3.100 2.367 1.857 2.802 . 0 0 "[ . 1 . 2]" 1
525 1 26 ALA H 1 27 ASP HB3 4.100 . 4.900 4.778 4.432 5.195 0.295 9 0 "[ . 1 . 2]" 1
526 1 27 ASP HA 1 28 LEU H 3.500 . 4.200 3.425 3.334 3.495 . 0 0 "[ . 1 . 2]" 1
527 1 27 ASP HB2 1 28 LEU H 3.900 . 4.700 3.921 3.004 4.175 . 0 0 "[ . 1 . 2]" 1
528 1 27 ASP HB3 1 28 LEU H 3.600 . 4.300 3.383 2.604 4.252 . 0 0 "[ . 1 . 2]" 1
529 1 27 ASP HB3 1 28 LEU QD 5.500 . 6.700 3.836 1.943 5.876 . 0 0 "[ . 1 . 2]" 1
530 1 27 ASP H 1 28 LEU H 2.500 . 3.000 2.384 1.862 2.588 . 0 0 "[ . 1 . 2]" 1
531 1 27 ASP H 1 28 LEU QD 6.200 . 6.700 4.314 2.741 5.314 . 0 0 "[ . 1 . 2]" 1
532 1 28 LEU HA 1 29 LYS H 3.200 . 3.800 3.245 2.965 3.420 . 0 0 "[ . 1 . 2]" 1
533 1 28 LEU HB3 1 29 LYS H 3.500 . 4.200 4.207 3.929 4.480 0.280 8 0 "[ . 1 . 2]" 1
534 1 28 LEU QD 1 29 LYS H 5.800 . 6.700 4.176 2.968 4.396 . 0 0 "[ . 1 . 2]" 1
535 1 28 LEU H 1 29 LYS H 2.400 . 2.900 2.271 1.874 2.754 . 0 0 "[ . 1 . 2]" 1
536 1 29 LYS HA 1 30 GLY H 2.400 . 2.900 2.287 2.138 2.667 . 0 0 "[ . 1 . 2]" 1
537 1 29 LYS QB 1 30 GLY H 3.100 . 3.700 3.233 1.997 3.705 0.005 15 0 "[ . 1 . 2]" 1
538 1 29 LYS QD 1 30 GLY H 4.600 . 5.600 4.522 4.164 5.198 . 0 0 "[ . 1 . 2]" 1
539 1 29 LYS HG2 1 30 GLY H 4.100 . 4.900 3.204 2.424 4.453 . 0 0 "[ . 1 . 2]" 1
540 1 29 LYS HG3 1 30 GLY H 3.500 . 4.200 2.874 2.290 4.281 0.081 16 0 "[ . 1 . 2]" 1
541 1 29 LYS H 1 30 GLY H 3.800 . 4.600 4.570 4.501 4.618 0.018 9 0 "[ . 1 . 2]" 1
542 1 30 GLY HA2 1 31 LYS H 3.700 . 4.400 3.371 3.140 3.537 . 0 0 "[ . 1 . 2]" 1
543 1 30 GLY HA3 1 31 LYS H 3.100 . 3.700 3.057 2.728 3.321 . 0 0 "[ . 1 . 2]" 1
544 1 30 GLY H 1 31 LYS H 2.700 . 3.200 2.444 2.038 3.253 0.053 7 0 "[ . 1 . 2]" 1
545 1 31 LYS HB2 1 32 TYR H 3.500 . 4.200 3.861 3.400 4.211 0.011 3 0 "[ . 1 . 2]" 1
546 1 31 LYS HB3 1 32 TYR H 3.700 . 4.400 3.209 2.222 4.031 . 0 0 "[ . 1 . 2]" 1
547 1 32 TYR HA 1 33 ILE H 2.600 . 3.100 2.258 2.127 2.376 . 0 0 "[ . 1 . 2]" 1
548 1 32 TYR HB2 1 33 ILE H 3.600 . 4.300 4.006 3.722 4.397 0.097 20 0 "[ . 1 . 2]" 1
549 1 32 TYR HB3 1 33 ILE H 3.600 . 4.300 2.833 2.561 3.436 . 0 0 "[ . 1 . 2]" 1
550 1 32 TYR QD 1 33 ILE H 5.100 . 6.200 3.473 3.038 3.985 . 0 0 "[ . 1 . 2]" 1
551 1 33 ILE HA 1 34 TYR H 2.800 . 3.400 2.173 2.146 2.231 . 0 0 "[ . 1 . 2]" 1
552 1 33 ILE MD 1 34 TYR H 5.100 . 6.200 4.693 3.723 5.342 . 0 0 "[ . 1 . 2]" 1
553 1 34 TYR HA 1 35 ILE H 2.600 . 3.100 2.151 2.124 2.193 . 0 0 "[ . 1 . 2]" 1
554 1 34 TYR HB2 1 35 ILE H 4.500 . 5.400 4.297 3.971 4.507 . 0 0 "[ . 1 . 2]" 1
555 1 34 TYR HB3 1 35 ILE H 4.300 . 5.200 4.307 4.123 4.431 . 0 0 "[ . 1 . 2]" 1
556 1 34 TYR QD 1 35 ILE H 4.800 . 5.900 3.618 2.990 3.956 . 0 0 "[ . 1 . 2]" 1
557 1 34 TYR QE 1 35 ILE H 6.400 . 6.700 4.697 4.079 5.106 . 0 0 "[ . 1 . 2]" 1
558 1 35 ILE HA 1 36 ASP H 2.500 . 3.000 2.122 2.078 2.172 . 0 0 "[ . 1 . 2]" 1
559 1 35 ILE MG 1 36 ASP HA 6.500 . 6.700 3.470 3.226 3.691 . 0 0 "[ . 1 . 2]" 1
560 1 36 ASP HA 1 37 VAL H 2.800 . 3.400 2.331 2.167 2.417 . 0 0 "[ . 1 . 2]" 1
561 1 36 ASP HB2 1 37 VAL H 4.500 . 5.400 3.395 2.391 4.413 . 0 0 "[ . 1 . 2]" 1
562 1 36 ASP HB3 1 37 VAL H 3.900 . 4.700 3.719 2.659 4.116 . 0 0 "[ . 1 . 2]" 1
563 1 36 ASP H 1 37 VAL H 4.100 . 4.900 4.449 4.257 4.552 . 0 0 "[ . 1 . 2]" 1
564 1 37 VAL HA 1 38 TRP HA 4.600 . 5.500 4.382 4.344 4.413 . 0 0 "[ . 1 . 2]" 1
565 1 37 VAL HA 1 38 TRP HD1 3.900 . 4.700 3.088 2.719 3.275 . 0 0 "[ . 1 . 2]" 1
566 1 37 VAL MG1 1 38 TRP H 4.400 . 5.400 2.735 2.420 2.976 . 0 0 "[ . 1 . 2]" 1
567 1 37 VAL MG1 1 38 TRP HA 6.500 . 6.700 3.753 3.465 3.964 . 0 0 "[ . 1 . 2]" 1
568 1 37 VAL MG2 1 38 TRP H 5.200 . 6.300 4.055 3.893 4.191 . 0 0 "[ . 1 . 2]" 1
569 1 38 TRP HA 1 39 ALA H 2.800 . 3.400 2.204 2.168 2.278 . 0 0 "[ . 1 . 2]" 1
570 1 38 TRP HB2 1 39 ALA H 3.500 . 4.200 3.159 2.972 3.264 . 0 0 "[ . 1 . 2]" 1
571 1 38 TRP HB3 1 39 ALA H 3.500 . 4.200 4.179 4.114 4.241 0.041 20 0 "[ . 1 . 2]" 1
572 1 38 TRP HD1 1 39 ALA H 4.600 . 5.600 5.316 5.051 5.405 . 0 0 "[ . 1 . 2]" 1
573 1 38 TRP HD1 1 39 ALA HA 4.600 . 5.500 5.446 4.973 5.640 0.140 4 0 "[ . 1 . 2]" 1
574 1 38 TRP H 1 39 ALA MB 6.100 . 6.700 4.515 4.303 4.678 . 0 0 "[ . 1 . 2]" 1
575 1 39 ALA HA 1 40 THR H 2.600 . 3.100 2.400 2.273 2.516 . 0 0 "[ . 1 . 2]" 1
576 1 39 ALA MB 1 40 THR H 4.200 . 5.100 2.457 2.218 2.662 . 0 0 "[ . 1 . 2]" 1
577 1 40 THR HA 1 41 TRP H 3.700 . 4.400 3.443 3.221 3.553 . 0 0 "[ . 1 . 2]" 1
578 1 40 THR HB 1 41 TRP H 4.200 . 5.000 3.852 2.467 4.426 . 0 0 "[ . 1 . 2]" 1
579 1 40 THR H 1 41 TRP H 3.200 . 3.800 2.244 2.073 2.446 . 0 0 "[ . 1 . 2]" 1
580 1 41 TRP HB2 1 42 CYS H 4.400 . 5.300 4.268 3.931 4.398 . 0 0 "[ . 1 . 2]" 1
581 1 41 TRP HB3 1 42 CYS H 4.000 . 4.800 4.529 4.327 4.643 . 0 0 "[ . 1 . 2]" 1
582 1 41 TRP HE3 1 42 CYS HA 3.600 . 4.300 4.063 3.062 4.335 0.035 4 0 "[ . 1 . 2]" 1
583 1 41 TRP H 1 42 CYS H 2.700 . 3.200 2.549 2.219 2.896 . 0 0 "[ . 1 . 2]" 1
584 1 41 TRP H 1 42 CYS HB3 4.000 . 5.000 4.601 4.206 5.264 0.264 11 0 "[ . 1 . 2]" 1
585 1 41 TRP HZ3 1 42 CYS HA 4.700 . 5.500 5.217 3.750 5.548 0.048 17 0 "[ . 1 . 2]" 1
586 1 42 CYS HA 1 43 GLY H 4.300 . 5.200 2.925 2.115 3.577 . 0 0 "[ . 1 . 2]" 1
587 1 43 GLY HA3 1 44 PRO HD2 4.500 . 5.400 2.854 1.993 3.634 . 0 0 "[ . 1 . 2]" 1
588 1 43 GLY HA3 1 44 PRO HD3 3.700 . 4.400 2.348 1.925 3.054 . 0 0 "[ . 1 . 2]" 1
589 1 44 PRO HA 1 45 CYS H 4.200 . 5.000 3.520 3.445 3.577 . 0 0 "[ . 1 . 2]" 1
590 1 44 PRO HB3 1 45 CYS H 3.400 . 4.100 4.074 3.782 4.213 0.113 12 0 "[ . 1 . 2]" 1
591 1 44 PRO HD3 1 45 CYS H 3.300 . 4.000 4.065 4.010 4.128 0.128 15 0 "[ . 1 . 2]" 1
592 1 44 PRO HG2 1 45 CYS H 3.900 . 4.700 3.704 2.505 4.342 . 0 0 "[ . 1 . 2]" 1
593 1 45 CYS HA 1 46 ARG H 3.600 . 4.300 3.490 3.393 3.533 . 0 0 "[ . 1 . 2]" 1
594 1 45 CYS HB2 1 46 ARG H 3.600 . 4.300 4.012 3.765 4.251 . 0 0 "[ . 1 . 2]" 1
595 1 45 CYS HB3 1 46 ARG H 3.700 . 4.400 3.168 2.614 4.224 . 0 0 "[ . 1 . 2]" 1
596 1 45 CYS H 1 46 ARG H 2.800 . 3.400 2.733 2.544 2.877 . 0 0 "[ . 1 . 2]" 1
597 1 46 ARG HB2 1 47 GLY H 3.800 . 4.500 3.394 2.931 4.266 . 0 0 "[ . 1 . 2]" 1
598 1 46 ARG HB3 1 47 GLY H 3.600 . 4.300 3.927 2.940 4.305 0.005 20 0 "[ . 1 . 2]" 1
599 1 46 ARG HB3 1 47 GLY QA 4.100 . 4.900 4.334 3.582 4.609 . 0 0 "[ . 1 . 2]" 1
600 1 46 ARG HG3 1 47 GLY H 4.500 . 5.400 4.682 4.264 5.501 0.101 12 0 "[ . 1 . 2]" 1
601 1 46 ARG H 1 47 GLY H 2.900 . 3.500 2.568 2.316 2.727 . 0 0 "[ . 1 . 2]" 1
602 1 47 GLY QA 1 48 GLU H 3.100 . 3.700 2.816 2.676 2.917 . 0 0 "[ . 1 . 2]" 1
603 1 47 GLY H 1 48 GLU H 3.100 . 3.700 2.473 2.299 2.737 . 0 0 "[ . 1 . 2]" 1
604 1 48 GLU HA 1 49 LEU H 3.600 . 4.300 3.306 3.061 3.437 . 0 0 "[ . 1 . 2]" 1
605 1 48 GLU HB2 1 49 LEU H 3.500 . 4.200 3.620 2.972 4.362 0.162 18 0 "[ . 1 . 2]" 1
606 1 48 GLU H 1 49 LEU H 2.700 . 3.200 2.269 2.031 2.604 . 0 0 "[ . 1 . 2]" 1
607 1 48 GLU H 1 49 LEU HA 3.900 . 4.700 4.667 4.415 4.797 0.097 12 0 "[ . 1 . 2]" 1
608 1 49 LEU HB2 1 50 PRO HD2 4.500 . 5.400 2.972 2.506 3.797 . 0 0 "[ . 1 . 2]" 1
609 1 49 LEU HB3 1 50 PRO HD2 5.000 . 6.000 4.024 2.435 4.373 . 0 0 "[ . 1 . 2]" 1
610 1 49 LEU H 1 50 PRO HD2 3.000 . 3.600 2.473 1.883 2.941 . 0 0 "[ . 1 . 2]" 1
611 1 49 LEU H 1 50 PRO HD3 2.900 . 3.500 3.088 2.844 3.539 0.039 9 0 "[ . 1 . 2]" 1
612 1 50 PRO HA 1 51 ALA H 3.300 . 4.000 3.553 3.473 3.577 . 0 0 "[ . 1 . 2]" 1
613 1 50 PRO HB2 1 51 ALA H 3.700 . 4.400 2.796 2.466 3.477 . 0 0 "[ . 1 . 2]" 1
614 1 50 PRO HB3 1 51 ALA H 3.900 . 4.700 4.037 3.864 4.306 . 0 0 "[ . 1 . 2]" 1
615 1 50 PRO HD2 1 51 ALA H 3.700 . 4.400 2.897 2.559 3.167 . 0 0 "[ . 1 . 2]" 1
616 1 50 PRO HD3 1 51 ALA H 3.400 . 4.100 4.067 3.888 4.139 0.039 13 0 "[ . 1 . 2]" 1
617 1 50 PRO HG3 1 51 ALA H 3.900 . 4.700 4.438 4.006 4.663 . 0 0 "[ . 1 . 2]" 1
618 1 51 ALA HA 1 52 LEU H 2.900 . 3.500 3.447 3.393 3.490 . 0 0 "[ . 1 . 2]" 1
619 1 51 ALA MB 1 52 LEU H 4.300 . 5.300 2.799 2.692 2.962 . 0 0 "[ . 1 . 2]" 1
620 1 51 ALA H 1 52 LEU H 2.800 . 3.400 2.409 2.130 2.544 . 0 0 "[ . 1 . 2]" 1
621 1 51 ALA H 1 52 LEU HA 4.300 . 5.200 5.055 4.850 5.168 . 0 0 "[ . 1 . 2]" 1
622 1 52 LEU HA 1 53 LYS H 3.200 . 3.800 3.545 3.508 3.577 . 0 0 "[ . 1 . 2]" 1
623 1 52 LEU QD 1 53 LYS H 5.500 . 6.700 3.386 3.027 4.161 . 0 0 "[ . 1 . 2]" 1
624 1 52 LEU H 1 53 LYS H 2.800 . 3.400 2.590 2.361 2.744 . 0 0 "[ . 1 . 2]" 1
625 1 53 LYS HA 1 54 GLU H 3.400 . 4.100 3.537 3.491 3.567 . 0 0 "[ . 1 . 2]" 1
626 1 53 LYS QB 1 54 GLU H 3.000 . 3.600 2.643 1.955 3.576 . 0 0 "[ . 1 . 2]" 1
627 1 53 LYS HG2 1 54 GLU H 3.900 . 4.700 4.116 2.646 4.923 0.223 18 0 "[ . 1 . 2]" 1
628 1 53 LYS HG3 1 54 GLU H 4.200 . 5.100 3.824 1.900 5.015 . 0 0 "[ . 1 . 2]" 1
629 1 53 LYS H 1 54 GLU H 2.600 . 3.100 2.683 2.503 2.959 . 0 0 "[ . 1 . 2]" 1
630 1 53 LYS H 1 54 GLU QB 4.000 . 5.000 4.389 4.025 4.724 . 0 0 "[ . 1 . 2]" 1
631 1 54 GLU HB2 1 55 LEU H 2.500 . 3.000 2.737 2.286 3.064 0.064 18 0 "[ . 1 . 2]" 1
632 1 54 GLU H 1 55 LEU H 2.700 . 3.200 2.847 2.586 3.082 . 0 0 "[ . 1 . 2]" 1
633 1 55 LEU HA 1 56 GLU H 3.700 . 4.400 3.534 3.503 3.570 . 0 0 "[ . 1 . 2]" 1
634 1 55 LEU HB3 1 56 GLU H 2.500 . 3.000 2.895 2.455 3.184 0.184 9 0 "[ . 1 . 2]" 1
635 1 55 LEU H 1 56 GLU H 2.700 . 3.200 2.698 2.495 2.832 . 0 0 "[ . 1 . 2]" 1
636 1 56 GLU HA 1 57 GLU H 3.500 . 4.200 3.567 3.524 3.604 . 0 0 "[ . 1 . 2]" 1
637 1 56 GLU HB2 1 57 GLU H 3.700 . 4.400 3.674 2.495 4.030 . 0 0 "[ . 1 . 2]" 1
638 1 56 GLU HB3 1 57 GLU H 3.500 . 4.200 2.633 2.127 3.885 . 0 0 "[ . 1 . 2]" 1
639 1 56 GLU H 1 57 GLU H 2.800 . 3.400 2.860 2.550 3.167 . 0 0 "[ . 1 . 2]" 1
640 1 57 GLU HA 1 58 LYS H 3.300 . 4.000 3.492 3.422 3.546 . 0 0 "[ . 1 . 2]" 1
641 1 57 GLU QB 1 58 LYS H 2.900 . 3.500 2.896 2.096 3.574 0.074 4 0 "[ . 1 . 2]" 1
642 1 57 GLU HG2 1 58 LYS H 4.300 . 5.200 4.330 2.620 5.171 . 0 0 "[ . 1 . 2]" 1
643 1 57 GLU HG3 1 58 LYS H 3.500 . 4.200 3.898 2.312 4.414 0.214 6 0 "[ . 1 . 2]" 1
644 1 57 GLU H 1 58 LYS H 2.600 . 3.100 2.591 2.392 2.892 . 0 0 "[ . 1 . 2]" 1
645 1 58 LYS HA 1 59 TYR H 3.400 . 4.100 3.516 3.454 3.574 . 0 0 "[ . 1 . 2]" 1
646 1 58 LYS HA 1 59 TYR QD 4.700 . 5.700 4.950 4.370 5.344 . 0 0 "[ . 1 . 2]" 1
647 1 58 LYS HB2 1 59 TYR H 3.400 . 4.100 3.663 2.431 4.134 0.034 6 0 "[ . 1 . 2]" 1
648 1 58 LYS HB2 1 59 TYR QD 3.800 . 4.700 3.959 2.367 4.769 0.069 8 0 "[ . 1 . 2]" 1
649 1 58 LYS HB2 1 59 TYR QE 4.100 . 5.000 4.446 3.018 5.033 0.033 4 0 "[ . 1 . 2]" 1
650 1 58 LYS HB3 1 59 TYR H 3.300 . 4.000 2.913 2.459 3.736 . 0 0 "[ . 1 . 2]" 1
651 1 58 LYS HB3 1 59 TYR QD 3.600 . 4.400 2.791 1.937 3.774 . 0 0 "[ . 1 . 2]" 1
652 1 58 LYS HB3 1 59 TYR QE 3.600 . 4.400 3.418 2.949 3.879 . 0 0 "[ . 1 . 2]" 1
653 1 58 LYS HD3 1 59 TYR QE 3.600 . 4.400 3.527 2.224 4.575 0.175 12 0 "[ . 1 . 2]" 1
654 1 58 LYS HE2 1 59 TYR QE 4.200 . 5.100 3.956 2.286 5.175 0.075 2 0 "[ . 1 . 2]" 1
655 1 58 LYS HG2 1 59 TYR H 4.300 . 5.200 4.240 3.722 5.208 0.008 15 0 "[ . 1 . 2]" 1
656 1 58 LYS HG3 1 59 TYR H 4.300 . 5.200 4.791 4.033 5.093 . 0 0 "[ . 1 . 2]" 1
657 1 58 LYS HG3 1 59 TYR QE 4.500 . 5.500 4.857 3.469 5.520 0.020 15 0 "[ . 1 . 2]" 1
658 1 58 LYS H 1 59 TYR H 2.800 . 3.400 2.585 2.330 2.957 . 0 0 "[ . 1 . 2]" 1
659 1 58 LYS H 1 59 TYR QD 5.400 . 6.600 4.180 3.556 4.715 . 0 0 "[ . 1 . 2]" 1
660 1 59 TYR HA 1 60 ALA H 2.900 . 3.500 3.168 3.009 3.323 . 0 0 "[ . 1 . 2]" 1
661 1 59 TYR HB2 1 60 ALA H 4.100 . 4.900 3.774 3.524 3.996 . 0 0 "[ . 1 . 2]" 1
662 1 59 TYR HB3 1 60 ALA H 4.200 . 5.000 4.320 4.167 4.437 . 0 0 "[ . 1 . 2]" 1
663 1 59 TYR H 1 60 ALA H 2.400 . 2.900 2.339 2.150 2.520 . 0 0 "[ . 1 . 2]" 1
664 1 59 TYR H 1 60 ALA MB 3.800 . 4.600 3.986 3.835 4.121 . 0 0 "[ . 1 . 2]" 1
665 1 60 ALA HA 1 61 GLY H 2.600 . 3.100 2.168 2.112 2.337 . 0 0 "[ . 1 . 2]" 1
666 1 60 ALA MB 1 61 GLY H 4.600 . 5.600 3.067 2.523 3.342 . 0 0 "[ . 1 . 2]" 1
667 1 60 ALA H 1 61 GLY H 3.900 . 4.700 4.517 4.400 4.628 . 0 0 "[ . 1 . 2]" 1
668 1 61 GLY HA2 1 62 LYS H 3.300 . 4.000 3.224 2.782 3.516 . 0 0 "[ . 1 . 2]" 1
669 1 61 GLY HA3 1 62 LYS H 3.100 . 3.700 3.291 2.842 3.548 . 0 0 "[ . 1 . 2]" 1
670 1 61 GLY H 1 62 LYS H 3.100 . 3.700 2.514 2.249 2.715 . 0 0 "[ . 1 . 2]" 1
671 1 62 LYS HA 1 63 ASP H 2.900 . 3.500 2.905 2.464 3.496 . 0 0 "[ . 1 . 2]" 1
672 1 62 LYS HB2 1 63 ASP H 3.100 . 3.700 2.539 1.888 3.246 . 0 0 "[ . 1 . 2]" 1
673 1 62 LYS HD3 1 63 ASP H 3.600 . 4.300 4.306 3.708 4.589 0.289 11 0 "[ . 1 . 2]" 1
674 1 62 LYS HG2 1 63 ASP H 3.600 . 4.300 4.240 2.951 4.525 0.225 12 0 "[ . 1 . 2]" 1
675 1 62 LYS H 1 63 ASP H 3.800 . 4.500 4.119 3.182 4.598 0.098 1 0 "[ . 1 . 2]" 1
676 1 63 ASP HA 1 64 ILE H 2.900 . 3.500 2.676 2.321 3.288 . 0 0 "[ . 1 . 2]" 1
677 1 63 ASP HB2 1 64 ILE H 3.900 . 4.700 4.494 4.158 4.662 . 0 0 "[ . 1 . 2]" 1
678 1 64 ILE HA 1 65 HIS H 2.800 . 3.400 2.263 2.145 2.420 . 0 0 "[ . 1 . 2]" 1
679 1 64 ILE HB 1 65 HIS H 3.700 . 4.400 3.673 2.294 4.225 . 0 0 "[ . 1 . 2]" 1
680 1 64 ILE MD 1 65 HIS H 6.100 . 6.700 4.080 2.445 5.011 . 0 0 "[ . 1 . 2]" 1
681 1 64 ILE HG12 1 65 HIS H 4.300 . 5.200 3.632 1.984 5.104 . 0 0 "[ . 1 . 2]" 1
682 1 64 ILE HG13 1 65 HIS H 3.600 . 4.300 3.203 2.177 4.465 0.165 6 0 "[ . 1 . 2]" 1
683 1 64 ILE MG 1 65 HIS H 4.900 . 6.000 3.424 2.299 4.026 . 0 0 "[ . 1 . 2]" 1
684 1 64 ILE H 1 65 HIS H 4.300 . 5.200 4.292 4.085 4.411 . 0 0 "[ . 1 . 2]" 1
685 1 65 HIS HA 1 66 PHE H 2.300 . 2.800 2.203 2.158 2.237 . 0 0 "[ . 1 . 2]" 1
686 1 65 HIS HA 1 66 PHE QD 5.800 . 6.700 3.986 3.340 4.982 . 0 0 "[ . 1 . 2]" 1
687 1 65 HIS HB3 1 66 PHE H 3.500 . 4.200 3.440 2.898 3.801 . 0 0 "[ . 1 . 2]" 1
688 1 65 HIS H 1 66 PHE QD 5.400 . 6.600 5.287 4.358 5.859 . 0 0 "[ . 1 . 2]" 1
689 1 66 PHE HA 1 67 VAL H 2.500 . 3.000 2.134 2.098 2.187 . 0 0 "[ . 1 . 2]" 1
690 1 66 PHE HA 1 67 VAL HB 4.900 . 5.900 4.660 4.495 4.808 . 0 0 "[ . 1 . 2]" 1
691 1 66 PHE HA 1 67 VAL MG2 5.400 . 6.600 3.579 3.433 3.705 . 0 0 "[ . 1 . 2]" 1
692 1 66 PHE HB2 1 67 VAL H 4.200 . 5.000 4.399 4.098 4.484 . 0 0 "[ . 1 . 2]" 1
693 1 66 PHE HB3 1 67 VAL H 4.200 . 5.000 3.635 3.158 3.782 . 0 0 "[ . 1 . 2]" 1
694 1 66 PHE QD 1 67 VAL H 5.200 . 6.300 4.289 3.597 4.657 . 0 0 "[ . 1 . 2]" 1
695 1 66 PHE H 1 67 VAL H 4.200 . 5.000 4.308 4.142 4.501 . 0 0 "[ . 1 . 2]" 1
696 1 67 VAL HA 1 68 SER HA 4.600 . 5.500 4.401 4.370 4.433 . 0 0 "[ . 1 . 2]" 1
697 1 67 VAL MG1 1 68 SER H 4.400 . 5.400 3.048 2.717 3.244 . 0 0 "[ . 1 . 2]" 1
698 1 67 VAL MG1 1 68 SER HA 6.400 . 6.700 3.988 3.707 4.132 . 0 0 "[ . 1 . 2]" 1
699 1 67 VAL MG2 1 68 SER H 4.200 . 5.000 4.179 4.092 4.259 . 0 0 "[ . 1 . 2]" 1
700 1 67 VAL MG2 1 68 SER HA 6.300 . 6.700 5.615 5.516 5.667 . 0 0 "[ . 1 . 2]" 1
701 1 67 VAL H 1 68 SER H 4.100 . 4.900 4.131 3.952 4.309 . 0 0 "[ . 1 . 2]" 1
702 1 68 SER HA 1 69 LEU H 2.700 . 3.200 2.220 2.149 2.288 . 0 0 "[ . 1 . 2]" 1
703 1 68 SER HA 1 69 LEU QD 6.000 . 6.000 4.599 2.939 5.255 . 0 0 "[ . 1 . 2]" 1
704 1 68 SER QB 1 69 LEU H 3.700 . 4.400 3.101 2.786 3.667 . 0 0 "[ . 1 . 2]" 1
705 1 68 SER QB 1 69 LEU QD 6.500 . 6.700 4.784 3.977 5.313 . 0 0 "[ . 1 . 2]" 1
706 1 69 LEU HA 1 70 SER H 2.800 . 3.400 2.176 2.135 2.241 . 0 0 "[ . 1 . 2]" 1
707 1 69 LEU HB2 1 70 SER H 4.100 . 4.900 4.154 3.967 4.387 . 0 0 "[ . 1 . 2]" 1
708 1 69 LEU QD 1 70 SER H 5.600 . 6.700 2.822 2.053 4.098 . 0 0 "[ . 1 . 2]" 1
709 1 69 LEU H 1 70 SER H 4.700 . 5.600 4.384 4.241 4.489 . 0 0 "[ . 1 . 2]" 1
710 1 70 SER HA 1 71 CYS H 2.600 . 3.100 2.111 2.065 2.144 . 0 0 "[ . 1 . 2]" 1
711 1 70 SER HB2 1 71 CYS H 4.300 . 5.200 4.088 3.872 4.364 . 0 0 "[ . 1 . 2]" 1
712 1 70 SER HB3 1 71 CYS H 4.000 . 5.000 4.399 3.478 4.502 . 0 0 "[ . 1 . 2]" 1
713 1 71 CYS HA 1 72 ASP H 3.300 . 4.000 3.089 2.929 3.178 . 0 0 "[ . 1 . 2]" 1
714 1 71 CYS HB3 1 72 ASP H 4.000 . 4.800 4.442 3.771 4.640 . 0 0 "[ . 1 . 2]" 1
715 1 73 LYS HA 1 74 ASN H 3.900 . 4.700 3.445 3.367 3.506 . 0 0 "[ . 1 . 2]" 1
716 1 73 LYS QB 1 74 ASN H 3.300 . 4.000 3.068 2.622 3.730 . 0 0 "[ . 1 . 2]" 1
717 1 73 LYS QG 1 74 ASN H 3.700 . 4.400 3.682 2.281 4.517 0.117 12 0 "[ . 1 . 2]" 1
718 1 74 ASN HA 1 75 LYS H 2.600 . 3.100 2.358 2.172 2.527 . 0 0 "[ . 1 . 2]" 1
719 1 75 LYS HA 1 76 LYS H 3.400 . 4.100 3.554 3.520 3.576 . 0 0 "[ . 1 . 2]" 1
720 1 75 LYS HB3 1 76 LYS H 3.000 . 3.600 2.289 2.033 2.408 . 0 0 "[ . 1 . 2]" 1
721 1 75 LYS HE2 1 76 LYS H 4.400 . 5.300 5.323 4.839 5.538 0.238 9 0 "[ . 1 . 2]" 1
722 1 75 LYS HG2 1 76 LYS H 3.200 . 3.900 3.719 2.766 4.115 0.215 2 0 "[ . 1 . 2]" 1
723 1 75 LYS H 1 76 LYS H 2.900 . 3.500 2.891 2.570 3.137 . 0 0 "[ . 1 . 2]" 1
724 1 76 LYS HA 1 77 ALA H 3.200 . 3.800 3.564 3.531 3.610 . 0 0 "[ . 1 . 2]" 1
725 1 76 LYS HB3 1 77 ALA H 2.700 . 3.200 2.469 2.227 2.664 . 0 0 "[ . 1 . 2]" 1
726 1 76 LYS H 1 77 ALA H 2.900 . 3.500 2.897 2.724 3.170 . 0 0 "[ . 1 . 2]" 1
727 1 77 ALA H 1 78 TRP H 2.500 . 3.000 2.625 2.492 2.760 . 0 0 "[ . 1 . 2]" 1
728 1 78 TRP HA 1 79 GLU H 3.800 . 4.600 3.565 3.522 3.609 . 0 0 "[ . 1 . 2]" 1
729 1 78 TRP HE3 1 79 GLU H 4.400 . 5.300 5.125 4.995 5.290 . 0 0 "[ . 1 . 2]" 1
730 1 78 TRP H 1 79 GLU H 2.900 . 3.500 2.613 2.447 2.946 . 0 0 "[ . 1 . 2]" 1
731 1 78 TRP H 1 79 GLU HG2 4.300 . 5.200 4.488 3.579 5.317 0.117 18 0 "[ . 1 . 2]" 1
732 1 79 GLU HA 1 80 ASN H 3.300 . 4.000 3.557 3.517 3.600 . 0 0 "[ . 1 . 2]" 1
733 1 79 GLU HB2 1 80 ASN H 3.500 . 4.200 3.130 2.229 4.222 0.022 3 0 "[ . 1 . 2]" 1
734 1 79 GLU HB3 1 80 ASN H 3.100 . 3.700 3.709 3.544 3.811 0.111 14 0 "[ . 1 . 2]" 1
735 1 79 GLU HG2 1 80 ASN H 3.900 . 4.700 3.337 2.089 4.757 0.057 18 0 "[ . 1 . 2]" 1
736 1 79 GLU HG2 1 80 ASN HD22 4.700 . 5.700 5.644 4.424 6.013 0.313 18 0 "[ . 1 . 2]" 1
737 1 79 GLU H 1 80 ASN H 2.800 . 3.400 2.853 2.691 3.079 . 0 0 "[ . 1 . 2]" 1
738 1 80 ASN HA 1 81 MET H 3.500 . 4.200 3.542 3.464 3.581 . 0 0 "[ . 1 . 2]" 1
739 1 80 ASN HB2 1 81 MET H 3.300 . 4.000 3.200 2.277 4.161 0.161 6 0 "[ . 1 . 2]" 1
740 1 80 ASN HB3 1 81 MET H 3.400 . 4.100 3.885 3.640 4.198 0.098 19 0 "[ . 1 . 2]" 1
741 1 80 ASN H 1 81 MET H 2.700 . 3.200 2.648 2.434 2.870 . 0 0 "[ . 1 . 2]" 1
742 1 81 MET HA 1 82 VAL H 3.400 . 4.100 3.583 3.556 3.600 . 0 0 "[ . 1 . 2]" 1
743 1 81 MET HB2 1 82 VAL H 3.700 . 4.400 3.922 3.585 4.077 . 0 0 "[ . 1 . 2]" 1
744 1 81 MET HB3 1 82 VAL H 3.400 . 4.100 2.587 2.309 2.771 . 0 0 "[ . 1 . 2]" 1
745 1 81 MET HG2 1 82 VAL H 4.300 . 5.200 3.766 3.038 4.841 . 0 0 "[ . 1 . 2]" 1
746 1 81 MET HG3 1 82 VAL H 4.000 . 4.800 4.127 3.263 4.485 . 0 0 "[ . 1 . 2]" 1
747 1 81 MET H 1 82 VAL H 2.700 . 3.200 2.807 2.739 2.886 . 0 0 "[ . 1 . 2]" 1
748 1 81 MET H 1 82 VAL MG1 5.100 . 6.200 3.879 3.637 5.650 . 0 0 "[ . 1 . 2]" 1
749 1 81 MET H 1 82 VAL MG2 6.100 . 6.700 5.955 5.358 6.092 . 0 0 "[ . 1 . 2]" 1
750 1 82 VAL HB 1 83 THR H 3.500 . 4.200 4.107 3.365 4.223 0.023 17 0 "[ . 1 . 2]" 1
751 1 82 VAL MG1 1 83 THR H 4.400 . 5.400 2.312 2.076 2.945 . 0 0 "[ . 1 . 2]" 1
752 1 82 VAL MG2 1 83 THR H 4.900 . 6.000 3.486 3.088 4.311 . 0 0 "[ . 1 . 2]" 1
753 1 82 VAL MG2 1 83 THR HA 5.800 . 6.700 3.545 3.148 5.275 . 0 0 "[ . 1 . 2]" 1
754 1 82 VAL H 1 83 THR H 2.900 . 3.500 2.674 2.567 2.739 . 0 0 "[ . 1 . 2]" 1
755 1 82 VAL H 1 83 THR MG 6.100 . 6.700 5.785 4.079 5.978 . 0 0 "[ . 1 . 2]" 1
756 1 83 THR HA 1 84 LYS H 3.300 . 4.000 3.525 3.444 3.560 . 0 0 "[ . 1 . 2]" 1
757 1 83 THR MG 1 84 LYS H 4.700 . 5.700 3.591 2.581 4.277 . 0 0 "[ . 1 . 2]" 1
758 1 83 THR MG 1 84 LYS HA 5.400 . 6.600 3.697 3.380 5.437 . 0 0 "[ . 1 . 2]" 1
759 1 83 THR H 1 84 LYS H 2.700 . 3.200 2.569 2.381 2.759 . 0 0 "[ . 1 . 2]" 1
760 1 84 LYS HA 1 85 ASP H 3.300 . 4.000 3.513 3.474 3.546 . 0 0 "[ . 1 . 2]" 1
761 1 84 LYS HB2 1 85 ASP H 3.100 . 3.700 3.417 2.394 3.781 0.081 7 0 "[ . 1 . 2]" 1
762 1 84 LYS HB3 1 85 ASP H 3.500 . 4.200 2.767 2.298 3.689 . 0 0 "[ . 1 . 2]" 1
763 1 84 LYS QD 1 85 ASP H 3.700 . 4.400 4.055 3.099 4.612 0.212 20 0 "[ . 1 . 2]" 1
764 1 84 LYS QG 1 85 ASP H 4.300 . 5.200 4.039 3.264 4.685 . 0 0 "[ . 1 . 2]" 1
765 1 84 LYS H 1 85 ASP H 2.700 . 3.200 2.467 2.307 2.595 . 0 0 "[ . 1 . 2]" 1
766 1 84 LYS H 1 85 ASP QB 4.000 . 4.800 4.246 4.020 4.555 . 0 0 "[ . 1 . 2]" 1
767 1 85 ASP HA 1 86 GLN H 3.400 . 4.100 3.338 3.207 3.443 . 0 0 "[ . 1 . 2]" 1
768 1 85 ASP HA 1 86 GLN QG 4.500 . 5.400 3.868 3.380 4.709 . 0 0 "[ . 1 . 2]" 1
769 1 85 ASP QB 1 86 GLN H 3.400 . 4.100 3.204 2.885 3.493 . 0 0 "[ . 1 . 2]" 1
770 1 85 ASP H 1 86 GLN H 2.500 . 3.000 2.504 2.331 2.584 . 0 0 "[ . 1 . 2]" 1
771 1 85 ASP H 1 86 GLN HA 4.100 . 5.100 4.740 4.554 4.844 . 0 0 "[ . 1 . 2]" 1
772 1 85 ASP H 1 86 GLN QG 4.100 . 4.900 4.500 4.249 4.918 0.018 1 0 "[ . 1 . 2]" 1
773 1 86 GLN HA 1 87 LEU H 2.700 . 3.200 2.781 2.277 3.171 . 0 0 "[ . 1 . 2]" 1
774 1 86 GLN QG 1 87 LEU H 3.900 . 4.700 4.549 4.357 4.802 0.102 1 0 "[ . 1 . 2]" 1
775 1 86 GLN H 1 87 LEU H 2.700 . 3.200 2.792 2.612 3.104 . 0 0 "[ . 1 . 2]" 1
776 1 86 GLN H 1 87 LEU QB 4.100 . 4.900 4.844 4.487 4.928 0.028 17 0 "[ . 1 . 2]" 1
777 1 86 GLN H 1 87 LEU QD 6.100 . 7.400 4.272 2.860 4.777 . 0 0 "[ . 1 . 2]" 1
778 1 87 LEU HA 1 88 LYS H 2.400 . 2.900 2.267 2.127 2.827 . 0 0 "[ . 1 . 2]" 1
779 1 87 LEU QD 1 88 LYS H 5.100 . 6.300 3.766 3.173 4.425 . 0 0 "[ . 1 . 2]" 1
780 1 87 LEU H 1 88 LYS H 3.800 . 4.600 4.340 3.204 4.638 0.038 16 0 "[ . 1 . 2]" 1
781 1 88 LYS HA 1 89 GLY H 3.100 . 3.700 2.626 2.270 2.954 . 0 0 "[ . 1 . 2]" 1
782 1 88 LYS HB2 1 89 GLY H 2.700 . 3.200 2.914 2.189 3.247 0.047 17 0 "[ . 1 . 2]" 1
783 1 88 LYS HB3 1 89 GLY H 2.900 . 3.500 2.297 1.669 3.510 0.131 2 0 "[ . 1 . 2]" 1
784 1 88 LYS QD 1 89 GLY H 3.200 . 3.800 3.546 2.950 3.889 0.089 1 0 "[ . 1 . 2]" 1
785 1 88 LYS HG3 1 89 GLY H 4.100 . 5.100 4.555 4.125 5.077 . 0 0 "[ . 1 . 2]" 1
786 1 89 GLY HA2 1 90 ILE H 2.800 . 3.400 2.771 2.336 3.135 . 0 0 "[ . 1 . 2]" 1
787 1 89 GLY HA3 1 90 ILE H 2.700 . 3.200 2.443 2.197 2.824 . 0 0 "[ . 1 . 2]" 1
788 1 89 GLY HA3 1 90 ILE MD 6.300 . 6.700 5.244 3.601 5.923 . 0 0 "[ . 1 . 2]" 1
789 1 89 GLY H 1 90 ILE H 4.100 . 5.100 4.468 4.168 4.603 . 0 0 "[ . 1 . 2]" 1
790 1 90 ILE HA 1 91 GLN H 2.300 . 2.800 2.167 2.122 2.213 . 0 0 "[ . 1 . 2]" 1
791 1 90 ILE HG12 1 91 GLN H 4.400 . 5.300 4.858 4.549 5.373 0.073 6 0 "[ . 1 . 2]" 1
792 1 90 ILE HG13 1 91 GLN H 4.500 . 5.400 5.231 4.438 5.525 0.125 20 0 "[ . 1 . 2]" 1
793 1 91 GLN HA 1 92 LEU H 2.800 . 3.400 2.120 2.073 2.199 . 0 0 "[ . 1 . 2]" 1
794 1 91 GLN HB2 1 92 LEU H 4.500 . 5.400 3.798 2.831 4.356 . 0 0 "[ . 1 . 2]" 1
795 1 91 GLN HB3 1 92 LEU H 4.500 . 5.400 3.999 3.583 4.323 . 0 0 "[ . 1 . 2]" 1
796 1 91 GLN HB3 1 92 LEU QD 6.500 . 6.700 5.145 4.572 5.552 . 0 0 "[ . 1 . 2]" 1
797 1 91 GLN QG 1 92 LEU H 4.300 . 5.200 4.477 4.090 4.880 . 0 0 "[ . 1 . 2]" 1
798 1 91 GLN H 1 92 LEU QD 5.100 . 6.200 3.485 2.938 4.911 . 0 0 "[ . 1 . 2]" 1
799 1 92 LEU HA 1 93 HIS H 2.800 . 3.400 2.291 2.200 2.487 . 0 0 "[ . 1 . 2]" 1
800 1 92 LEU HB2 1 93 HIS H 3.600 . 4.300 3.633 2.575 3.969 . 0 0 "[ . 1 . 2]" 1
801 1 92 LEU HB3 1 93 HIS H 3.600 . 4.300 2.800 2.240 3.764 . 0 0 "[ . 1 . 2]" 1
802 1 92 LEU QD 1 93 HIS H 4.800 . 5.900 3.511 2.609 4.068 . 0 0 "[ . 1 . 2]" 1
803 1 93 HIS HA 1 94 MET H 2.800 . 3.400 2.103 2.067 2.151 . 0 0 "[ . 1 . 2]" 1
804 1 93 HIS HD2 1 94 MET H 3.900 . 4.700 3.562 2.202 4.132 . 0 0 "[ . 1 . 2]" 1
805 1 93 HIS HD2 1 94 MET HB3 4.300 . 5.200 5.062 4.056 5.295 0.095 4 0 "[ . 1 . 2]" 1
806 1 94 MET H 1 95 GLY H 3.100 . 3.700 2.938 2.528 3.926 0.226 2 0 "[ . 1 . 2]" 1
807 1 95 GLY HA2 1 96 THR H 3.100 . 3.700 3.318 2.183 3.564 . 0 0 "[ . 1 . 2]" 1
808 1 95 GLY HA2 1 96 THR MG 6.500 . 6.700 4.814 3.268 5.724 . 0 0 "[ . 1 . 2]" 1
809 1 95 GLY HA3 1 96 THR H 2.900 . 3.500 2.491 2.110 3.525 0.025 18 0 "[ . 1 . 2]" 1
810 1 95 GLY HA3 1 96 THR MG 6.300 . 6.700 4.380 3.579 5.787 . 0 0 "[ . 1 . 2]" 1
811 1 95 GLY H 1 96 THR H 3.900 . 4.700 3.737 2.026 4.274 . 0 0 "[ . 1 . 2]" 1
812 1 96 THR HA 1 97 ASP H 3.000 . 3.600 3.239 2.927 3.489 . 0 0 "[ . 1 . 2]" 1
813 1 96 THR MG 1 97 ASP H 5.200 . 6.300 4.167 3.343 4.442 . 0 0 "[ . 1 . 2]" 1
814 1 96 THR H 1 97 ASP H 2.700 . 3.200 2.273 1.775 2.859 0.025 1 0 "[ . 1 . 2]" 1
815 1 97 ASP HA 1 98 ARG H 2.700 . 3.200 2.572 2.157 3.113 . 0 0 "[ . 1 . 2]" 1
816 1 97 ASP QB 1 98 ARG H 4.100 . 4.900 3.810 3.401 4.019 . 0 0 "[ . 1 . 2]" 1
817 1 97 ASP H 1 98 ARG H 4.100 . 4.900 3.541 2.668 4.545 . 0 0 "[ . 1 . 2]" 1
818 1 98 ARG HA 1 99 THR H 2.800 . 3.400 3.174 2.859 3.358 . 0 0 "[ . 1 . 2]" 1
819 1 98 ARG HB3 1 99 THR H 4.100 . 4.900 4.398 3.547 4.628 . 0 0 "[ . 1 . 2]" 1
820 1 98 ARG QD 1 99 THR H 4.400 . 5.300 4.006 3.043 5.664 0.364 12 0 "[ . 1 . 2]" 1
821 1 98 ARG QG 1 99 THR H 4.300 . 5.200 3.650 2.829 4.810 . 0 0 "[ . 1 . 2]" 1
822 1 98 ARG H 1 99 THR H 3.100 . 3.700 2.620 1.788 3.178 0.012 3 0 "[ . 1 . 2]" 1
823 1 99 THR HA 1 100 PHE H 3.900 . 4.700 3.475 3.399 3.544 . 0 0 "[ . 1 . 2]" 1
824 1 99 THR MG 1 100 PHE H 4.200 . 5.000 3.696 2.437 4.213 . 0 0 "[ . 1 . 2]" 1
825 1 99 THR H 1 100 PHE H 3.300 . 4.000 2.539 2.356 3.015 . 0 0 "[ . 1 . 2]" 1
826 1 99 THR H 1 100 PHE HB2 4.800 . 5.900 4.690 4.330 5.432 . 0 0 "[ . 1 . 2]" 1
827 1 100 PHE HA 1 101 MET H 4.100 . 4.900 3.498 3.436 3.574 . 0 0 "[ . 1 . 2]" 1
828 1 100 PHE HB2 1 101 MET H 3.600 . 4.300 3.771 3.002 4.063 . 0 0 "[ . 1 . 2]" 1
829 1 100 PHE QD 1 101 MET H 5.100 . 6.200 4.231 3.738 4.605 . 0 0 "[ . 1 . 2]" 1
830 1 100 PHE H 1 101 MET H 3.000 . 3.600 2.436 2.269 2.564 . 0 0 "[ . 1 . 2]" 1
831 1 101 MET HB2 1 102 ASP H 3.300 . 4.000 3.344 2.258 4.034 0.034 3 0 "[ . 1 . 2]" 1
832 1 101 MET H 1 102 ASP H 3.200 . 3.800 2.603 2.325 2.778 . 0 0 "[ . 1 . 2]" 1
833 1 102 ASP HA 1 103 ALA H 3.500 . 4.200 3.508 3.447 3.560 . 0 0 "[ . 1 . 2]" 1
834 1 102 ASP HB2 1 103 ALA H 3.600 . 4.300 3.394 2.639 4.062 . 0 0 "[ . 1 . 2]" 1
835 1 102 ASP HB3 1 103 ALA H 3.300 . 4.000 3.225 2.378 4.003 0.003 18 0 "[ . 1 . 2]" 1
836 1 102 ASP H 1 103 ALA H 2.800 . 3.400 2.627 2.446 2.782 . 0 0 "[ . 1 . 2]" 1
837 1 102 ASP H 1 103 ALA MB 5.500 . 6.700 4.315 4.152 4.447 . 0 0 "[ . 1 . 2]" 1
838 1 103 ALA HA 1 104 TYR H 3.100 . 3.700 3.463 3.366 3.554 . 0 0 "[ . 1 . 2]" 1
839 1 103 ALA MB 1 104 TYR H 4.300 . 5.300 2.840 2.460 3.088 . 0 0 "[ . 1 . 2]" 1
840 1 103 ALA MB 1 104 TYR HA 5.600 . 6.700 4.010 3.831 4.091 . 0 0 "[ . 1 . 2]" 1
841 1 103 ALA MB 1 104 TYR QD 5.300 . 6.600 3.211 2.235 4.387 . 0 0 "[ . 1 . 2]" 1
842 1 103 ALA MB 1 104 TYR QE 5.000 . 6.200 3.996 3.064 5.460 . 0 0 "[ . 1 . 2]" 1
843 1 103 ALA H 1 104 TYR H 2.800 . 3.400 2.631 2.518 2.727 . 0 0 "[ . 1 . 2]" 1
844 1 104 TYR HA 1 105 LEU H 3.400 . 4.100 3.253 3.123 3.358 . 0 0 "[ . 1 . 2]" 1
845 1 104 TYR HA 1 105 LEU QD 4.300 . 5.300 3.854 3.041 4.948 . 0 0 "[ . 1 . 2]" 1
846 1 104 TYR HB3 1 105 LEU H 3.800 . 4.500 4.099 3.869 4.256 . 0 0 "[ . 1 . 2]" 1
847 1 104 TYR H 1 105 LEU H 2.800 . 3.400 2.255 2.032 2.458 . 0 0 "[ . 1 . 2]" 1
848 1 105 LEU HB2 1 106 ILE H 3.700 . 4.400 4.018 3.126 4.384 . 0 0 "[ . 1 . 2]" 1
849 1 105 LEU H 1 106 ILE H 3.000 . 3.600 2.698 2.547 3.057 . 0 0 "[ . 1 . 2]" 1
850 1 106 ILE HA 1 107 ASN H 3.700 . 4.400 2.385 2.140 3.549 . 0 0 "[ . 1 . 2]" 1
851 1 106 ILE HA 1 107 ASN HA 4.700 . 5.700 4.516 4.319 5.360 . 0 0 "[ . 1 . 2]" 1
852 1 106 ILE MG 1 107 ASN HA 6.100 . 6.700 4.502 3.208 5.672 . 0 0 "[ . 1 . 2]" 1
853 1 107 ASN QB 1 108 GLY H 4.300 . 5.200 2.772 1.871 3.738 . 0 0 "[ . 1 . 2]" 1
854 1 107 ASN H 1 108 GLY H 4.000 . 4.800 2.711 2.114 4.376 . 0 0 "[ . 1 . 2]" 1
855 1 108 GLY HA2 1 109 ILE H 3.100 . 3.700 2.278 2.111 3.556 . 0 0 "[ . 1 . 2]" 1
856 1 108 GLY HA3 1 109 ILE H 3.100 . 3.700 3.327 2.570 3.557 . 0 0 "[ . 1 . 2]" 1
857 1 109 ILE HB 1 110 PRO HA 4.500 . 5.400 2.403 1.734 4.008 0.066 12 0 "[ . 1 . 2]" 1
858 1 109 ILE MG 1 110 PRO HA 4.900 . 6.000 2.777 1.760 3.361 0.040 13 0 "[ . 1 . 2]" 1
859 1 109 ILE MG 1 110 PRO HB3 6.500 . 6.700 4.426 2.627 5.272 . 0 0 "[ . 1 . 2]" 1
860 1 110 PRO HB3 1 111 ARG H 4.000 . 4.800 3.565 3.062 3.924 . 0 0 "[ . 1 . 2]" 1
861 1 111 ARG HA 1 112 PHE H 2.600 . 3.100 2.204 2.085 2.368 . 0 0 "[ . 1 . 2]" 1
862 1 111 ARG HB2 1 112 PHE H 4.100 . 4.900 4.262 4.053 4.393 . 0 0 "[ . 1 . 2]" 1
863 1 111 ARG HB3 1 112 PHE H 4.100 . 4.900 3.418 2.984 3.887 . 0 0 "[ . 1 . 2]" 1
864 1 111 ARG HD2 1 112 PHE H 3.500 . 4.200 2.798 1.724 3.775 0.076 1 0 "[ . 1 . 2]" 1
865 1 111 ARG HD3 1 112 PHE H 3.600 . 4.300 2.138 1.697 2.951 0.103 16 0 "[ . 1 . 2]" 1
866 1 111 ARG HE 1 112 PHE H 4.000 . 4.800 3.856 2.312 4.909 0.109 6 0 "[ . 1 . 2]" 1
867 1 111 ARG HG2 1 112 PHE H 3.900 . 4.700 3.702 2.921 4.258 . 0 0 "[ . 1 . 2]" 1
868 1 111 ARG HG3 1 112 PHE H 4.400 . 5.300 4.394 4.036 4.653 . 0 0 "[ . 1 . 2]" 1
869 1 111 ARG H 1 112 PHE H 4.400 . 5.300 4.432 4.291 4.561 . 0 0 "[ . 1 . 2]" 1
870 1 112 PHE HA 1 113 ILE H 2.500 . 3.000 2.184 2.115 2.274 . 0 0 "[ . 1 . 2]" 1
871 1 112 PHE HA 1 113 ILE HA 4.800 . 5.800 4.429 4.401 4.469 . 0 0 "[ . 1 . 2]" 1
872 1 112 PHE HA 1 113 ILE MG 6.500 . 6.700 5.440 4.123 5.542 . 0 0 "[ . 1 . 2]" 1
873 1 112 PHE HB2 1 113 ILE H 3.500 . 4.200 3.862 3.560 4.144 . 0 0 "[ . 1 . 2]" 1
874 1 112 PHE HB3 1 113 ILE H 3.700 . 4.400 3.846 3.372 4.156 . 0 0 "[ . 1 . 2]" 1
875 1 112 PHE QD 1 113 ILE H 4.800 . 5.800 4.746 4.399 4.959 . 0 0 "[ . 1 . 2]" 1
876 1 113 ILE HA 1 114 LEU H 2.600 . 3.100 2.245 2.139 2.429 . 0 0 "[ . 1 . 2]" 1
877 1 113 ILE HA 1 114 LEU HB3 4.800 . 5.800 4.576 4.263 4.690 . 0 0 "[ . 1 . 2]" 1
878 1 113 ILE HB 1 114 LEU H 3.700 . 4.300 3.942 3.634 4.051 . 0 0 "[ . 1 . 2]" 1
879 1 113 ILE HG12 1 114 LEU H 3.900 . 4.700 4.109 1.981 4.839 0.139 12 0 "[ . 1 . 2]" 1
880 1 113 ILE HG13 1 114 LEU H 4.000 . 4.800 4.805 2.864 4.951 0.151 12 0 "[ . 1 . 2]" 1
881 1 114 LEU HA 1 115 LEU H 2.600 . 3.100 2.215 2.153 2.346 . 0 0 "[ . 1 . 2]" 1
882 1 114 LEU QD 1 115 LEU H 4.200 . 5.100 2.454 2.169 3.634 . 0 0 "[ . 1 . 2]" 1
883 1 114 LEU H 1 115 LEU H 4.100 . 4.900 4.379 4.280 4.423 . 0 0 "[ . 1 . 2]" 1
884 1 115 LEU HA 1 116 ASP H 2.700 . 3.200 2.262 2.134 2.355 . 0 0 "[ . 1 . 2]" 1
885 1 115 LEU HB2 1 116 ASP H 3.200 . 3.800 3.534 2.734 3.784 . 0 0 "[ . 1 . 2]" 1
886 1 115 LEU HB3 1 116 ASP H 3.700 . 4.400 2.647 2.453 3.346 . 0 0 "[ . 1 . 2]" 1
887 1 115 LEU QD 1 116 ASP H 5.200 . 5.500 4.035 3.946 4.139 . 0 0 "[ . 1 . 2]" 1
888 1 115 LEU H 1 116 ASP H 4.700 . 5.600 4.392 4.338 4.433 . 0 0 "[ . 1 . 2]" 1
889 1 116 ASP HB2 1 117 ARG H 3.700 . 4.400 3.530 1.893 3.926 . 0 0 "[ . 1 . 2]" 1
890 1 116 ASP HB3 1 117 ARG H 3.600 . 4.300 3.529 3.268 3.775 . 0 0 "[ . 1 . 2]" 1
891 1 116 ASP H 1 117 ARG H 4.500 . 5.400 4.547 4.456 4.589 . 0 0 "[ . 1 . 2]" 1
892 1 117 ARG HA 1 118 ASP H 4.000 . 4.800 3.499 3.426 3.559 . 0 0 "[ . 1 . 2]" 1
893 1 117 ARG QB 1 118 ASP H 3.700 . 4.400 2.742 2.513 3.026 . 0 0 "[ . 1 . 2]" 1
894 1 117 ARG QB 1 118 ASP HB2 4.400 . 5.300 4.027 3.749 4.397 . 0 0 "[ . 1 . 2]" 1
895 1 117 ARG H 1 118 ASP H 3.300 . 4.000 2.838 2.744 2.945 . 0 0 "[ . 1 . 2]" 1
896 1 118 ASP HA 1 119 GLY H 4.000 . 4.800 3.249 3.052 3.398 . 0 0 "[ . 1 . 2]" 1
897 1 118 ASP HB2 1 119 GLY H 3.800 . 4.600 4.154 3.748 4.377 . 0 0 "[ . 1 . 2]" 1
898 1 118 ASP HB3 1 119 GLY H 4.000 . 4.800 3.549 3.079 4.238 . 0 0 "[ . 1 . 2]" 1
899 1 118 ASP H 1 119 GLY H 2.400 . 2.900 2.570 2.327 2.769 . 0 0 "[ . 1 . 2]" 1
900 1 119 GLY HA2 1 120 LYS H 3.100 . 3.700 3.005 2.917 3.080 . 0 0 "[ . 1 . 2]" 1
901 1 119 GLY H 1 120 LYS H 2.600 . 3.100 2.265 1.991 2.461 . 0 0 "[ . 1 . 2]" 1
902 1 119 GLY H 1 120 LYS HB2 4.300 . 5.200 4.556 4.186 5.198 . 0 0 "[ . 1 . 2]" 1
903 1 120 LYS HA 1 121 ILE H 2.500 . 3.000 2.113 2.061 2.232 . 0 0 "[ . 1 . 2]" 1
904 1 120 LYS HB2 1 121 ILE H 3.900 . 4.700 4.323 3.495 4.448 . 0 0 "[ . 1 . 2]" 1
905 1 120 LYS HB3 1 121 ILE H 3.000 . 3.600 3.655 3.374 4.089 0.489 12 0 "[ . 1 . 2]" 1
906 1 120 LYS HG2 1 121 ILE H 4.200 . 5.000 4.772 3.127 5.161 0.161 4 0 "[ . 1 . 2]" 1
907 1 121 ILE HA 1 122 ILE H 2.700 . 3.200 2.104 2.026 2.155 . 0 0 "[ . 1 . 2]" 1
908 1 121 ILE HG13 1 122 ILE H 3.600 . 4.300 4.328 4.201 4.537 0.237 9 0 "[ . 1 . 2]" 1
909 1 121 ILE MG 1 122 ILE H 3.000 . 3.600 2.949 2.669 3.127 . 0 0 "[ . 1 . 2]" 1
910 1 121 ILE MG 1 122 ILE HA 5.400 . 6.600 3.770 3.535 3.976 . 0 0 "[ . 1 . 2]" 1
911 1 122 ILE HA 1 123 SER H 4.100 . 4.900 3.528 3.506 3.579 . 0 0 "[ . 1 . 2]" 1
912 1 122 ILE HB 1 123 SER H 3.000 . 3.600 2.476 2.262 2.652 . 0 0 "[ . 1 . 2]" 1
913 1 122 ILE MD 1 123 SER H 5.000 . 6.100 4.574 4.405 4.647 . 0 0 "[ . 1 . 2]" 1
914 1 122 ILE HG12 1 123 SER H 4.400 . 5.400 4.482 4.171 4.949 . 0 0 "[ . 1 . 2]" 1
915 1 122 ILE HG13 1 123 SER H 4.000 . 4.800 4.537 4.055 4.883 0.083 11 0 "[ . 1 . 2]" 1
916 1 122 ILE MG 1 123 SER H 4.600 . 5.600 3.298 2.983 3.536 . 0 0 "[ . 1 . 2]" 1
917 1 122 ILE MG 1 123 SER HA 5.700 . 6.700 3.895 3.650 4.211 . 0 0 "[ . 1 . 2]" 1
918 1 122 ILE MG 1 123 SER HB2 5.800 . 6.700 3.864 2.897 4.089 . 0 0 "[ . 1 . 2]" 1
919 1 122 ILE MG 1 123 SER HB3 5.500 . 6.700 4.362 3.546 4.578 . 0 0 "[ . 1 . 2]" 1
920 1 122 ILE H 1 123 SER H 2.600 . 3.100 2.241 2.109 2.380 . 0 0 "[ . 1 . 2]" 1
921 1 123 SER HA 1 124 ALA H 2.600 . 3.100 2.161 2.146 2.176 . 0 0 "[ . 1 . 2]" 1
922 1 123 SER HA 1 124 ALA MB 5.900 . 6.700 4.031 3.942 4.054 . 0 0 "[ . 1 . 2]" 1
923 1 123 SER HB2 1 124 ALA H 4.100 . 4.900 4.253 3.989 4.317 . 0 0 "[ . 1 . 2]" 1
924 1 123 SER HB3 1 124 ALA H 4.400 . 5.300 3.596 3.361 3.990 . 0 0 "[ . 1 . 2]" 1
925 1 123 SER H 1 124 ALA H 4.200 . 5.000 4.094 3.944 4.351 . 0 0 "[ . 1 . 2]" 1
926 1 124 ALA HA 1 125 ASN H 3.300 . 4.000 3.385 2.982 3.494 . 0 0 "[ . 1 . 2]" 1
927 1 124 ALA HA 1 125 ASN HA 4.400 . 5.300 4.472 4.389 4.538 . 0 0 "[ . 1 . 2]" 1
928 1 124 ALA MB 1 125 ASN H 4.100 . 5.000 2.944 2.641 3.547 . 0 0 "[ . 1 . 2]" 1
929 1 124 ALA MB 1 125 ASN HA 6.500 . 6.700 4.289 4.096 4.450 . 0 0 "[ . 1 . 2]" 1
930 1 124 ALA H 1 125 ASN H 2.800 . 3.400 2.452 2.361 2.669 . 0 0 "[ . 1 . 2]" 1
931 1 125 ASN HA 1 126 MET H 2.600 . 3.100 2.198 2.097 2.787 . 0 0 "[ . 1 . 2]" 1
932 1 125 ASN HA 1 126 MET HA 4.700 . 5.600 4.414 4.349 4.698 . 0 0 "[ . 1 . 2]" 1
933 1 125 ASN HB2 1 126 MET HA 5.200 . 6.000 5.384 4.644 6.000 . 0 0 "[ . 1 . 2]" 1
934 1 125 ASN HB3 1 126 MET H 4.000 . 4.800 4.380 4.188 4.629 . 0 0 "[ . 1 . 2]" 1
935 1 125 ASN H 1 126 MET H 3.700 . 4.400 3.801 2.201 4.117 . 0 0 "[ . 1 . 2]" 1
936 1 126 MET HA 1 127 THR H 3.100 . 3.700 3.203 2.748 3.544 . 0 0 "[ . 1 . 2]" 1
937 1 126 MET HA 1 127 THR MG 5.800 . 6.700 4.278 3.566 5.588 . 0 0 "[ . 1 . 2]" 1
938 1 126 MET QB 1 127 THR H 3.500 . 4.200 2.022 1.703 2.950 0.097 7 0 "[ . 1 . 2]" 1
939 1 126 MET ME 1 127 THR H 4.600 . 5.600 3.717 1.809 4.839 . 0 0 "[ . 1 . 2]" 1
940 1 126 MET HG2 1 127 THR H 3.600 . 4.300 3.161 1.753 4.292 0.047 11 0 "[ . 1 . 2]" 1
941 1 126 MET HG3 1 127 THR H 3.200 . 3.800 2.428 1.633 3.920 0.167 4 0 "[ . 1 . 2]" 1
942 1 126 MET H 1 127 THR H 4.200 . 5.000 3.736 2.912 4.458 . 0 0 "[ . 1 . 2]" 1
943 1 127 THR HA 1 128 ARG H 3.200 . 3.800 2.647 2.046 3.577 . 0 0 "[ . 1 . 2]" 1
944 1 127 THR MG 1 128 ARG H 4.500 . 5.500 3.430 2.524 3.910 . 0 0 "[ . 1 . 2]" 1
945 1 127 THR H 1 128 ARG H 4.100 . 4.900 3.639 2.084 4.396 . 0 0 "[ . 1 . 2]" 1
946 1 128 ARG HA 1 129 PRO HD2 3.200 . 3.800 2.502 2.001 3.770 . 0 0 "[ . 1 . 2]" 1
947 1 128 ARG HB2 1 129 PRO HD2 4.900 . 5.900 3.585 2.195 4.452 . 0 0 "[ . 1 . 2]" 1
948 1 128 ARG HB2 1 129 PRO HD3 4.800 . 5.800 4.313 3.100 5.002 . 0 0 "[ . 1 . 2]" 1
949 1 128 ARG HD2 1 129 PRO HD2 4.700 . 5.700 4.288 1.709 5.737 0.091 13 0 "[ . 1 . 2]" 1
950 1 128 ARG HD3 1 129 PRO HB2 4.800 . 5.800 5.662 4.482 5.996 0.196 12 0 "[ . 1 . 2]" 1
951 1 128 ARG HD3 1 129 PRO HD2 4.100 . 4.900 4.047 2.786 4.908 0.008 12 0 "[ . 1 . 2]" 1
952 1 129 PRO HB2 1 130 SER H 4.100 . 4.900 2.827 2.407 4.248 . 0 0 "[ . 1 . 2]" 1
953 1 129 PRO HB3 1 130 SER H 4.100 . 4.900 4.042 3.816 4.573 . 0 0 "[ . 1 . 2]" 1
954 1 129 PRO HD2 1 130 SER H 4.300 . 5.200 3.265 2.742 5.047 . 0 0 "[ . 1 . 2]" 1
955 1 130 SER HA 1 131 ASP H 3.100 . 3.700 3.273 2.914 3.504 . 0 0 "[ . 1 . 2]" 1
956 1 130 SER HB2 1 131 ASP H 4.200 . 5.000 3.882 2.821 4.616 . 0 0 "[ . 1 . 2]" 1
957 1 130 SER H 1 131 ASP H 2.900 . 3.500 2.617 1.930 2.825 . 0 0 "[ . 1 . 2]" 1
958 1 131 ASP HA 1 132 PRO QD 2.300 . 2.800 1.878 1.789 2.148 0.011 19 0 "[ . 1 . 2]" 1
959 1 131 ASP HA 1 132 PRO QG 3.500 . 4.200 3.787 3.698 4.057 . 0 0 "[ . 1 . 2]" 1
960 1 131 ASP HB2 1 132 PRO QD 4.100 . 4.900 3.688 1.985 3.994 . 0 0 "[ . 1 . 2]" 1
961 1 131 ASP HB3 1 132 PRO QD 4.400 . 5.300 3.997 3.437 4.219 . 0 0 "[ . 1 . 2]" 1
962 1 132 PRO HA 1 133 LYS H 3.600 . 4.300 3.533 3.485 3.606 . 0 0 "[ . 1 . 2]" 1
963 1 132 PRO HB2 1 133 LYS H 3.600 . 4.300 3.091 2.648 3.573 . 0 0 "[ . 1 . 2]" 1
964 1 132 PRO HB3 1 133 LYS H 3.600 . 4.300 4.176 3.988 4.367 0.067 13 0 "[ . 1 . 2]" 1
965 1 132 PRO QD 1 133 LYS H 3.000 . 3.600 2.830 2.526 3.131 . 0 0 "[ . 1 . 2]" 1
966 1 132 PRO QG 1 133 LYS H 3.500 . 4.200 3.344 2.386 4.025 . 0 0 "[ . 1 . 2]" 1
967 1 133 LYS HA 1 134 THR H 3.000 . 3.600 3.495 3.434 3.543 . 0 0 "[ . 1 . 2]" 1
968 1 133 LYS HB2 1 134 THR H 3.400 . 4.100 2.729 2.187 3.144 . 0 0 "[ . 1 . 2]" 1
969 1 133 LYS H 1 134 THR H 2.700 . 3.200 2.631 2.403 2.932 . 0 0 "[ . 1 . 2]" 1
970 1 134 THR HA 1 135 ALA H 3.700 . 4.400 3.542 3.514 3.564 . 0 0 "[ . 1 . 2]" 1
971 1 134 THR HB 1 135 ALA H 3.200 . 3.800 2.646 2.112 3.877 0.077 13 0 "[ . 1 . 2]" 1
972 1 134 THR HB 1 135 ALA HA 4.500 . 5.500 4.219 3.593 5.597 0.097 1 0 "[ . 1 . 2]" 1
973 1 134 THR HB 1 135 ALA MB 5.400 . 6.600 4.027 3.565 5.266 . 0 0 "[ . 1 . 2]" 1
974 1 134 THR MG 1 135 ALA H 4.600 . 5.600 3.453 2.081 4.099 . 0 0 "[ . 1 . 2]" 1
975 1 134 THR MG 1 135 ALA HA 5.800 . 6.700 4.002 3.020 5.326 . 0 0 "[ . 1 . 2]" 1
976 1 134 THR H 1 135 ALA H 2.700 . 3.200 2.675 2.452 2.876 . 0 0 "[ . 1 . 2]" 1
977 1 134 THR H 1 135 ALA MB 4.800 . 5.900 4.301 4.153 4.487 . 0 0 "[ . 1 . 2]" 1
978 1 135 ALA HA 1 136 GLU H 3.700 . 4.400 3.554 3.523 3.589 . 0 0 "[ . 1 . 2]" 1
979 1 135 ALA MB 1 136 GLU H 3.900 . 4.800 2.457 2.364 2.583 . 0 0 "[ . 1 . 2]" 1
980 1 135 ALA MB 1 136 GLU HA 5.500 . 6.700 3.815 3.727 3.893 . 0 0 "[ . 1 . 2]" 1
981 1 135 ALA H 1 136 GLU H 2.600 . 3.100 2.764 2.638 2.924 . 0 0 "[ . 1 . 2]" 1
982 1 135 ALA H 1 136 GLU HG3 4.700 . 5.600 5.219 4.247 5.770 0.170 8 0 "[ . 1 . 2]" 1
983 1 136 GLU HA 1 137 LYS H 3.200 . 3.800 3.496 3.443 3.549 . 0 0 "[ . 1 . 2]" 1
984 1 136 GLU QB 1 137 LYS H 3.100 . 3.700 2.873 2.125 3.643 . 0 0 "[ . 1 . 2]" 1
985 1 136 GLU HG2 1 137 LYS H 3.700 . 4.400 3.871 2.653 4.768 0.368 9 0 "[ . 1 . 2]" 1
986 1 136 GLU HG3 1 137 LYS H 4.100 . 4.900 3.826 1.778 5.052 0.152 5 0 "[ . 1 . 2]" 1
987 1 136 GLU H 1 137 LYS H 2.800 . 3.400 2.646 2.364 2.817 . 0 0 "[ . 1 . 2]" 1
988 1 137 LYS HA 1 138 PHE H 3.200 . 3.800 3.540 3.497 3.580 . 0 0 "[ . 1 . 2]" 1
989 1 137 LYS QB 1 138 PHE H 2.600 . 3.100 2.590 2.294 2.941 . 0 0 "[ . 1 . 2]" 1
990 1 137 LYS QB 1 138 PHE QD 4.900 . 6.000 3.581 3.057 3.892 . 0 0 "[ . 1 . 2]" 1
991 1 137 LYS HE2 1 138 PHE QD 5.600 . 6.700 6.535 5.547 6.801 0.101 4 0 "[ . 1 . 2]" 1
992 1 137 LYS HG2 1 138 PHE H 3.800 . 4.700 4.543 4.012 4.908 0.208 14 0 "[ . 1 . 2]" 1
993 1 137 LYS HG3 1 138 PHE H 4.100 . 4.900 4.503 3.696 4.948 0.048 12 0 "[ . 1 . 2]" 1
994 1 137 LYS H 1 138 PHE H 2.700 . 3.200 2.703 2.469 2.999 . 0 0 "[ . 1 . 2]" 1
995 1 138 PHE HA 1 139 ASN H 3.300 . 4.000 3.563 3.514 3.600 . 0 0 "[ . 1 . 2]" 1
996 1 138 PHE HB3 1 139 ASN H 3.200 . 3.800 3.590 3.404 3.845 0.045 5 0 "[ . 1 . 2]" 1
997 1 138 PHE QD 1 139 ASN H 5.200 . 6.300 4.146 3.934 4.388 . 0 0 "[ . 1 . 2]" 1
998 1 138 PHE H 1 139 ASN H 2.700 . 3.200 2.798 2.611 3.048 . 0 0 "[ . 1 . 2]" 1
999 1 139 ASN HA 1 140 GLU H 3.600 . 4.300 3.519 3.407 3.599 . 0 0 "[ . 1 . 2]" 1
1000 1 139 ASN HB2 1 140 GLU H 3.700 . 4.400 2.925 2.148 4.115 . 0 0 "[ . 1 . 2]" 1
1001 1 139 ASN HB3 1 140 GLU H 3.500 . 4.200 3.686 3.153 4.274 0.074 18 0 "[ . 1 . 2]" 1
1002 1 139 ASN H 1 140 GLU H 2.700 . 3.200 2.751 2.506 3.049 . 0 0 "[ . 1 . 2]" 1
1003 1 139 ASN H 1 140 GLU QB 4.100 . 4.900 4.381 4.177 4.807 . 0 0 "[ . 1 . 2]" 1
1004 1 140 GLU HA 1 141 LEU QD 6.500 . 6.700 5.139 4.382 5.562 . 0 0 "[ . 1 . 2]" 1
1005 1 140 GLU QB 1 141 LEU H 3.400 . 4.100 2.319 2.108 2.725 . 0 0 "[ . 1 . 2]" 1
1006 1 140 GLU HG2 1 141 LEU H 3.500 . 4.200 3.583 3.226 3.910 . 0 0 "[ . 1 . 2]" 1
1007 1 140 GLU HG2 1 141 LEU HA 4.400 . 5.300 3.579 3.188 3.843 . 0 0 "[ . 1 . 2]" 1
1008 1 140 GLU HG3 1 141 LEU H 3.900 . 4.700 4.650 4.454 4.735 0.035 10 0 "[ . 1 . 2]" 1
1009 1 140 GLU H 1 141 LEU H 2.800 . 3.400 2.883 2.602 3.173 . 0 0 "[ . 1 . 2]" 1
1010 1 140 GLU H 1 141 LEU QD 5.900 . 6.700 4.724 3.896 5.140 . 0 0 "[ . 1 . 2]" 1
1011 1 141 LEU HA 1 142 LEU H 3.000 . 3.600 3.494 3.413 3.557 . 0 0 "[ . 1 . 2]" 1
1012 1 141 LEU HB2 1 142 LEU H 3.600 . 4.300 3.050 2.502 4.177 . 0 0 "[ . 1 . 2]" 1
1013 1 141 LEU QD 1 142 LEU H 5.800 . 6.700 3.723 2.224 4.205 . 0 0 "[ . 1 . 2]" 1
1014 1 141 LEU H 1 142 LEU QD 6.100 . 6.700 4.635 3.687 5.730 . 0 0 "[ . 1 . 2]" 1
1015 1 142 LEU HA 1 143 GLY H 3.400 . 4.100 3.387 3.294 3.486 . 0 0 "[ . 1 . 2]" 1
1016 1 142 LEU HB3 1 143 GLY H 3.700 . 4.400 3.786 3.061 4.156 . 0 0 "[ . 1 . 2]" 1
1017 1 142 LEU QD 1 143 GLY H 6.400 . 6.700 4.164 3.831 4.382 . 0 0 "[ . 1 . 2]" 1
1018 1 142 LEU H 1 143 GLY H 2.700 . 3.200 2.390 2.220 2.566 . 0 0 "[ . 1 . 2]" 1
1019 1 143 GLY QA 1 144 LEU H 2.600 . 3.100 2.775 2.626 2.884 . 0 0 "[ . 1 . 2]" 1
1020 1 143 GLY H 1 144 LEU H 2.600 . 3.100 2.317 2.143 2.484 . 0 0 "[ . 1 . 2]" 1
1021 1 143 GLY H 1 144 LEU HA 4.200 . 5.000 4.976 4.807 5.055 0.055 14 0 "[ . 1 . 2]" 1
1022 1 143 GLY H 1 144 LEU HB3 3.700 . 4.400 4.459 4.404 4.486 0.086 12 0 "[ . 1 . 2]" 1
1023 1 143 GLY H 1 144 LEU QD 6.500 . 6.700 5.240 5.130 5.394 . 0 0 "[ . 1 . 2]" 1
1024 1 144 LEU HA 1 145 GLU H 2.900 . 3.500 3.278 2.781 3.552 0.052 10 0 "[ . 1 . 2]" 1
1025 1 144 LEU QB 1 145 GLU H 3.100 . 3.700 3.122 1.915 3.811 0.111 4 0 "[ . 1 . 2]" 1
1026 1 144 LEU QD 1 145 GLU H . . 5.600 3.950 3.234 4.370 . 0 0 "[ . 1 . 2]" 1
1027 1 144 LEU H 1 145 GLU H 2.800 . 3.400 2.459 2.246 2.893 . 0 0 "[ . 1 . 2]" 1
1028 1 144 LEU H 1 145 GLU HA 4.200 . 5.000 4.730 4.166 5.101 0.101 10 0 "[ . 1 . 2]" 1
1029 1 145 GLU HA 1 146 GLY H 2.700 . 3.200 2.702 2.058 3.496 0.296 12 0 "[ . 1 . 2]" 1
1030 1 145 GLU HB2 1 146 GLY H 3.500 . 4.200 3.467 1.776 4.430 0.230 6 0 "[ . 1 . 2]" 1
1031 1 145 GLU HB3 1 146 GLY H 3.400 . 4.100 3.172 1.778 4.200 0.100 13 0 "[ . 1 . 2]" 1
1032 1 145 GLU HG3 1 146 GLY H 4.200 . 5.000 4.463 3.322 5.234 0.234 10 0 "[ . 1 . 2]" 1
1033 1 3 LEU QD 1 8 PRO HA 5.600 . 6.700 3.769 2.055 6.278 . 0 0 "[ . 1 . 2]" 1
1034 1 3 LEU QD 1 7 ASN HA 6.600 . 7.400 5.210 2.236 7.096 . 0 0 "[ . 1 . 2]" 1
1035 1 3 LEU QD 1 7 ASN HB3 6.300 . 7.400 5.724 4.136 7.533 0.133 5 0 "[ . 1 . 2]" 1
1036 1 8 PRO HA 1 11 ALA MB 4.900 . 6.000 4.527 3.475 6.037 0.037 7 0 "[ . 1 . 2]" 1
1037 1 8 PRO HB3 1 11 ALA MB 6.200 . 6.700 4.878 2.305 6.407 . 0 0 "[ . 1 . 2]" 1
1038 1 9 SER HA 1 11 ALA H 4.100 . 4.900 4.129 3.121 4.938 0.038 12 0 "[ . 1 . 2]" 1
1039 1 9 SER HB2 1 11 ALA H 4.100 . 4.900 4.390 2.981 4.971 0.071 11 0 "[ . 1 . 2]" 1
1040 1 9 SER H 1 11 ALA MB 6.400 . 6.700 4.525 3.469 5.660 . 0 0 "[ . 1 . 2]" 1
1041 1 10 ALA HA 1 13 PHE QD 4.800 . 5.800 3.118 1.789 4.822 0.011 6 0 "[ . 1 . 2]" 1
1042 1 10 ALA HA 1 13 PHE QE 5.000 . 6.000 4.275 2.408 6.048 0.048 16 0 "[ . 1 . 2]" 1
1043 1 10 ALA MB 1 13 PHE QD 6.500 . 7.400 4.105 2.089 5.902 . 0 0 "[ . 1 . 2]" 1
1044 1 13 PHE HA 1 15 TYR QD 6.100 . 6.700 5.307 4.321 5.913 . 0 0 "[ . 1 . 2]" 1
1045 1 13 PHE HA 1 15 TYR QE 5.000 . 6.100 4.861 3.845 5.616 . 0 0 "[ . 1 . 2]" 1
1046 1 13 PHE HB2 1 15 TYR QD 5.600 . 6.700 3.245 2.481 3.965 . 0 0 "[ . 1 . 2]" 1
1047 1 13 PHE HB3 1 15 TYR QD 4.700 . 5.700 4.698 4.193 5.213 . 0 0 "[ . 1 . 2]" 1
1048 1 13 PHE HB3 1 15 TYR QE 4.100 . 5.000 3.596 3.028 4.270 . 0 0 "[ . 1 . 2]" 1
1049 1 13 PHE QD 1 15 TYR H 5.200 . 6.300 3.692 3.104 4.126 . 0 0 "[ . 1 . 2]" 1
1050 1 13 PHE QE 1 15 TYR H 4.900 . 5.900 4.785 4.157 5.478 . 0 0 "[ . 1 . 2]" 1
1051 1 15 TYR HB3 1 17 ASP HA 4.900 . 5.900 5.556 5.283 5.873 . 0 0 "[ . 1 . 2]" 1
1052 1 16 PRO HA 1 20 GLY H 4.600 . 5.500 5.300 5.019 5.463 . 0 0 "[ . 1 . 2]" 1
1053 1 16 PRO QB 1 20 GLY H 3.800 . 4.600 4.136 3.750 4.342 . 0 0 "[ . 1 . 2]" 1
1054 1 16 PRO QB 1 20 GLY HA2 3.700 . 4.400 3.053 2.604 3.272 . 0 0 "[ . 1 . 2]" 1
1055 1 16 PRO QB 1 20 GLY HA3 3.800 . 4.600 4.543 4.049 4.782 0.182 12 0 "[ . 1 . 2]" 1
1056 1 16 PRO QB 1 21 LYS H 4.100 . 4.900 3.843 3.183 4.175 . 0 0 "[ . 1 . 2]" 1
1057 1 17 ASP HB3 1 19 ASN H 4.000 . 4.800 3.540 2.687 3.928 . 0 0 "[ . 1 . 2]" 1
1058 1 17 ASP HB3 1 21 LYS H 3.800 . 4.600 2.545 1.931 4.214 . 0 0 "[ . 1 . 2]" 1
1059 1 17 ASP H 1 20 GLY HA2 4.600 . 5.500 4.645 4.299 4.859 . 0 0 "[ . 1 . 2]" 1
1060 1 17 ASP H 1 21 LYS HB3 4.100 . 4.900 3.215 2.825 3.603 . 0 0 "[ . 1 . 2]" 1
1061 1 17 ASP H 1 22 THR HA 3.700 . 4.300 3.638 3.235 4.004 . 0 0 "[ . 1 . 2]" 1
1062 1 18 ILE MG 1 20 GLY H 5.500 . 6.700 4.318 4.129 5.140 . 0 0 "[ . 1 . 2]" 1
1063 1 19 ASN HA 1 21 LYS HB3 5.800 . 6.800 6.245 5.739 6.851 0.051 5 0 "[ . 1 . 2]" 1
1064 1 19 ASN HB3 1 21 LYS H 4.200 . 5.000 4.788 4.554 5.066 0.066 18 0 "[ . 1 . 2]" 1
1065 1 19 ASN H 1 21 LYS H 3.400 . 4.000 3.572 3.241 3.849 . 0 0 "[ . 1 . 2]" 1
1066 1 22 THR MG 1 24 SER H 4.300 . 5.300 4.458 3.831 4.963 . 0 0 "[ . 1 . 2]" 1
1067 1 22 THR MG 1 24 SER HA 6.100 . 6.700 4.653 3.987 5.049 . 0 0 "[ . 1 . 2]" 1
1068 1 22 THR MG 1 24 SER HB2 5.600 . 6.700 5.165 4.274 5.777 . 0 0 "[ . 1 . 2]" 1
1069 1 22 THR MG 1 24 SER HB3 5.500 . 6.700 4.074 2.903 5.266 . 0 0 "[ . 1 . 2]" 1
1070 1 23 VAL MG2 1 27 ASP HB3 6.400 . 6.700 4.919 3.848 6.298 . 0 0 "[ . 1 . 2]" 1
1071 1 24 SER HB2 1 26 ALA H 3.700 . 4.400 2.730 2.373 3.063 . 0 0 "[ . 1 . 2]" 1
1072 1 24 SER HB2 1 26 ALA MB 5.400 . 6.600 3.431 2.987 4.067 . 0 0 "[ . 1 . 2]" 1
1073 1 24 SER HB2 1 27 ASP H 3.800 . 4.600 3.900 2.714 4.450 . 0 0 "[ . 1 . 2]" 1
1074 1 24 SER HB3 1 26 ALA H 3.800 . 4.600 3.812 2.866 4.223 . 0 0 "[ . 1 . 2]" 1
1075 1 24 SER HB3 1 26 ALA MB 5.500 . 6.700 4.201 3.735 4.832 . 0 0 "[ . 1 . 2]" 1
1076 1 24 SER HB3 1 27 ASP H 4.000 . 4.800 4.529 3.964 5.001 0.201 2 0 "[ . 1 . 2]" 1
1077 1 24 SER H 1 27 ASP H 3.800 . 4.600 3.576 3.075 4.143 . 0 0 "[ . 1 . 2]" 1
1078 1 24 SER H 1 27 ASP HB2 4.000 . 4.800 3.375 1.821 4.885 0.085 4 0 "[ . 1 . 2]" 1
1079 1 24 SER H 1 27 ASP HB3 3.800 . 4.600 3.310 1.816 4.576 . 0 0 "[ . 1 . 2]" 1
1080 1 25 LEU HA 1 28 LEU QD 4.800 . 5.900 3.049 1.772 4.794 0.028 2 0 "[ . 1 . 2]" 1
1081 1 25 LEU QD 1 27 ASP H 5.200 . 6.300 4.878 4.149 5.346 . 0 0 "[ . 1 . 2]" 1
1082 1 25 LEU QD 1 28 LEU H 4.800 . 5.900 4.094 3.568 4.686 . 0 0 "[ . 1 . 2]" 1
1083 1 25 LEU QD 1 29 LYS H 5.500 . 6.700 4.448 3.322 5.429 . 0 0 "[ . 1 . 2]" 1
1084 1 25 LEU QD 1 29 LYS HA 5.200 . 6.300 4.190 3.360 5.520 . 0 0 "[ . 1 . 2]" 1
1085 1 26 ALA HA 1 28 LEU H 3.800 . 4.600 3.882 3.382 4.408 . 0 0 "[ . 1 . 2]" 1
1086 1 26 ALA HA 1 29 LYS H 3.700 . 4.400 3.286 2.745 4.326 . 0 0 "[ . 1 . 2]" 1
1087 1 26 ALA HA 1 29 LYS QB 3.700 . 4.400 2.386 1.812 4.219 . 0 0 "[ . 1 . 2]" 1
1088 1 26 ALA HA 1 29 LYS HD2 3.800 . 4.600 3.140 2.458 3.791 . 0 0 "[ . 1 . 2]" 1
1089 1 26 ALA HA 1 29 LYS QE 4.300 . 5.200 4.088 1.769 5.119 0.031 7 0 "[ . 1 . 2]" 1
1090 1 26 ALA HA 1 29 LYS HG2 3.400 . 4.100 4.162 4.094 4.250 0.150 14 0 "[ . 1 . 2]" 1
1091 1 26 ALA MB 1 28 LEU H 5.200 . 6.300 4.401 4.153 4.826 . 0 0 "[ . 1 . 2]" 1
1092 1 26 ALA MB 1 29 LYS QD 5.100 . 6.200 3.246 2.843 3.723 . 0 0 "[ . 1 . 2]" 1
1093 1 27 ASP HA 1 29 LYS H 3.700 . 4.400 3.895 3.417 4.308 . 0 0 "[ . 1 . 2]" 1
1094 1 27 ASP HB3 1 29 LYS H 4.800 . 5.800 5.099 4.579 5.557 . 0 0 "[ . 1 . 2]" 1
1095 1 27 ASP H 1 29 LYS H 3.600 . 4.300 3.779 3.133 4.332 0.032 9 0 "[ . 1 . 2]" 1
1096 1 28 LEU HA 1 31 LYS H 4.500 . 5.500 5.342 4.774 5.668 0.168 14 0 "[ . 1 . 2]" 1
1097 1 28 LEU HA 1 33 ILE MD 5.100 . 6.200 4.464 3.524 5.369 . 0 0 "[ . 1 . 2]" 1
1098 1 28 LEU HB3 1 33 ILE MD 4.300 . 5.300 2.984 1.886 4.416 . 0 0 "[ . 1 . 2]" 1
1099 1 28 LEU QD 1 33 ILE MG 4.800 . 6.000 2.973 2.068 3.789 . 0 0 "[ . 1 . 2]" 1
1100 1 29 LYS HA 1 31 LYS H 3.200 . 3.800 3.224 2.931 3.712 . 0 0 "[ . 1 . 2]" 1
1101 1 29 LYS QB 1 31 LYS H 4.000 . 4.800 4.730 4.298 4.973 0.173 15 0 "[ . 1 . 2]" 1
1102 1 31 LYS H 1 33 ILE MD 5.800 . 6.700 4.091 3.334 4.954 . 0 0 "[ . 1 . 2]" 1
1103 1 35 ILE MG 1 37 VAL H 5.500 . 6.700 4.400 3.875 4.652 . 0 0 "[ . 1 . 2]" 1
1104 1 35 ILE MG 1 37 VAL HA 6.500 . 6.700 4.212 3.828 4.636 . 0 0 "[ . 1 . 2]" 1
1105 1 35 ILE MG 1 37 VAL HB 6.400 . 6.700 5.608 5.247 6.006 . 0 0 "[ . 1 . 2]" 1
1106 1 39 ALA HA 1 41 TRP H 3.900 . 4.700 4.076 3.878 4.370 . 0 0 "[ . 1 . 2]" 1
1107 1 39 ALA MB 1 41 TRP HD1 4.000 . 4.900 3.255 2.879 3.924 . 0 0 "[ . 1 . 2]" 1
1108 1 39 ALA MB 1 41 TRP HZ2 5.900 . 6.700 3.667 3.280 4.184 . 0 0 "[ . 1 . 2]" 1
1109 1 39 ALA H 1 42 CYS H 4.300 . 5.200 4.683 3.970 5.258 0.058 14 0 "[ . 1 . 2]" 1
1110 1 39 ALA H 1 42 CYS HB2 4.200 . 5.000 4.532 3.454 5.043 0.043 7 0 "[ . 1 . 2]" 1
1111 1 39 ALA H 1 42 CYS HB3 4.100 . 4.900 3.935 2.274 4.905 0.005 5 0 "[ . 1 . 2]" 1
1112 1 40 THR H 1 42 CYS H 4.100 . 4.900 3.899 3.441 4.312 . 0 0 "[ . 1 . 2]" 1
1113 1 42 CYS HA 1 45 CYS H 4.300 . 5.200 4.849 4.291 5.333 0.133 4 0 "[ . 1 . 2]" 1
1114 1 42 CYS HB2 1 45 CYS H 4.100 . 4.900 3.806 2.858 4.929 0.029 1 0 "[ . 1 . 2]" 1
1115 1 42 CYS HB2 1 45 CYS HB2 5.000 . 6.000 3.522 2.334 6.013 0.013 1 0 "[ . 1 . 2]" 1
1116 1 42 CYS HB2 1 45 CYS HB3 4.600 . 5.500 3.142 1.770 4.734 0.030 15 0 "[ . 1 . 2]" 1
1117 1 42 CYS H 1 46 ARG HD2 4.900 . 5.900 5.234 3.720 5.968 0.068 16 0 "[ . 1 . 2]" 1
1118 1 43 GLY HA2 1 46 ARG H 3.900 . 4.700 4.036 3.496 4.724 0.024 12 0 "[ . 1 . 2]" 1
1119 1 43 GLY HA2 1 46 ARG HD2 4.400 . 5.300 4.339 2.790 5.364 0.064 12 0 "[ . 1 . 2]" 1
1120 1 43 GLY HA2 1 46 ARG HD3 4.300 . 5.200 3.869 2.207 4.850 . 0 0 "[ . 1 . 2]" 1
1121 1 43 GLY HA2 1 46 ARG HG2 4.600 . 5.500 4.816 2.932 5.340 . 0 0 "[ . 1 . 2]" 1
1122 1 43 GLY HA3 1 46 ARG HG2 5.400 . 6.400 6.305 4.526 6.544 0.144 8 0 "[ . 1 . 2]" 1
1123 1 44 PRO HA 1 46 ARG H 3.800 . 4.600 3.936 3.451 4.599 . 0 0 "[ . 1 . 2]" 1
1124 1 44 PRO HA 1 47 GLY H 3.800 . 4.600 3.648 3.021 4.171 . 0 0 "[ . 1 . 2]" 1
1125 1 45 CYS HA 1 48 GLU H 4.200 . 5.000 3.698 3.343 4.299 . 0 0 "[ . 1 . 2]" 1
1126 1 45 CYS H 1 47 GLY H 4.100 . 4.900 4.223 3.938 4.700 . 0 0 "[ . 1 . 2]" 1
1127 1 46 ARG HA 1 49 LEU QD . . 4.700 1.978 1.669 2.791 0.131 14 0 "[ . 1 . 2]" 1
1128 1 46 ARG HA 1 49 LEU HG 4.100 . 4.900 2.595 1.739 4.814 0.061 15 0 "[ . 1 . 2]" 1
1129 1 46 ARG HB3 1 49 LEU QD 5.700 . 6.700 3.208 2.407 4.627 . 0 0 "[ . 1 . 2]" 1
1130 1 46 ARG HD2 1 49 LEU QD 6.500 . 6.700 4.023 2.464 5.903 . 0 0 "[ . 1 . 2]" 1
1131 1 46 ARG HD3 1 49 LEU QD 6.500 . 6.700 4.474 3.671 6.232 . 0 0 "[ . 1 . 2]" 1
1132 1 46 ARG HE 1 49 LEU QD 6.200 . 6.700 3.315 2.549 5.529 . 0 0 "[ . 1 . 2]" 1
1133 1 46 ARG H 1 48 GLU H 4.100 . 4.900 4.287 3.997 4.912 0.012 18 0 "[ . 1 . 2]" 1
1134 1 46 ARG H 1 49 LEU H 4.400 . 5.400 5.062 4.709 5.558 0.158 12 0 "[ . 1 . 2]" 1
1135 1 47 GLY QA 1 49 LEU HB2 4.400 . 5.400 4.750 3.945 5.229 . 0 0 "[ . 1 . 2]" 1
1136 1 47 GLY H 1 49 LEU H 4.500 . 5.400 3.846 3.485 4.162 . 0 0 "[ . 1 . 2]" 1
1137 1 47 GLY H 1 49 LEU QD 6.500 . 6.700 4.359 3.595 5.167 . 0 0 "[ . 1 . 2]" 1
1138 1 47 GLY H 1 50 PRO HD2 4.600 . 5.600 5.126 4.675 5.721 0.121 15 0 "[ . 1 . 2]" 1
1139 1 48 GLU HA 1 51 ALA H 4.000 . 4.800 3.115 2.809 3.494 . 0 0 "[ . 1 . 2]" 1
1140 1 48 GLU HA 1 51 ALA MB 5.300 . 6.500 2.752 2.407 3.285 . 0 0 "[ . 1 . 2]" 1
1141 1 48 GLU HB2 1 51 ALA H 4.100 . 4.900 4.837 3.874 5.159 0.259 8 0 "[ . 1 . 2]" 1
1142 1 48 GLU HB3 1 52 LEU H 5.000 . 6.000 4.823 3.841 6.044 0.044 6 0 "[ . 1 . 2]" 1
1143 1 48 GLU H 1 50 PRO HD2 4.100 . 4.900 3.831 3.398 4.328 . 0 0 "[ . 1 . 2]" 1
1144 1 49 LEU HA 1 52 LEU HB2 4.200 . 5.000 2.827 2.111 3.381 . 0 0 "[ . 1 . 2]" 1
1145 1 49 LEU HA 1 52 LEU HB3 4.400 . 5.300 2.987 2.430 4.156 . 0 0 "[ . 1 . 2]" 1
1146 1 49 LEU HA 1 52 LEU QD 6.500 . 6.700 3.065 1.813 3.461 . 0 0 "[ . 1 . 2]" 1
1147 1 49 LEU HB2 1 51 ALA H 4.100 . 4.900 4.973 4.826 5.260 0.360 10 0 "[ . 1 . 2]" 1
1148 1 49 LEU HB3 1 51 ALA H 4.600 . 5.600 5.298 4.635 5.474 . 0 0 "[ . 1 . 2]" 1
1149 1 49 LEU QD 1 52 LEU H 6.200 . 6.700 4.551 3.931 4.961 . 0 0 "[ . 1 . 2]" 1
1150 1 49 LEU HG 1 52 LEU HB3 5.000 . 6.000 5.699 4.514 6.167 0.167 2 0 "[ . 1 . 2]" 1
1151 1 49 LEU HG 1 52 LEU QD 4.600 . 5.600 4.608 2.835 5.223 . 0 0 "[ . 1 . 2]" 1
1152 1 50 PRO HA 1 53 LYS H 3.600 . 4.300 3.616 3.312 3.936 . 0 0 "[ . 1 . 2]" 1
1153 1 50 PRO HB3 1 52 LEU H 4.700 . 5.700 5.685 5.483 5.858 0.158 10 0 "[ . 1 . 2]" 1
1154 1 51 ALA HA 1 54 GLU H 3.100 . 3.700 3.285 2.931 3.706 0.006 13 0 "[ . 1 . 2]" 1
1155 1 51 ALA HA 1 54 GLU QB 2.600 . 3.100 2.328 1.810 2.936 . 0 0 "[ . 1 . 2]" 1
1156 1 51 ALA MB 1 54 GLU H 5.400 . 6.600 4.568 4.332 4.903 . 0 0 "[ . 1 . 2]" 1
1157 1 51 ALA H 1 53 LYS H 3.700 . 4.400 4.140 3.823 4.435 0.035 12 0 "[ . 1 . 2]" 1
1158 1 52 LEU HA 1 55 LEU H 3.400 . 4.100 3.482 3.207 3.976 . 0 0 "[ . 1 . 2]" 1
1159 1 52 LEU HA 1 56 GLU H 4.100 . 4.900 4.118 3.803 4.547 . 0 0 "[ . 1 . 2]" 1
1160 1 52 LEU QD 1 54 GLU H 6.100 . 6.700 4.949 4.667 5.459 . 0 0 "[ . 1 . 2]" 1
1161 1 52 LEU QD 1 56 GLU H 5.800 . 6.700 3.751 3.158 4.958 . 0 0 "[ . 1 . 2]" 1
1162 1 52 LEU H 1 54 GLU H 4.200 . 5.000 4.026 3.845 4.208 . 0 0 "[ . 1 . 2]" 1
1163 1 52 LEU H 1 54 GLU QB 3.900 . 4.600 4.608 4.228 4.892 0.292 13 0 "[ . 1 . 2]" 1
1164 1 53 LYS HA 1 56 GLU H 3.400 . 4.100 3.363 2.918 3.960 . 0 0 "[ . 1 . 2]" 1
1165 1 53 LYS HA 1 56 GLU HB3 2.900 . 3.500 2.777 2.004 3.635 0.135 18 0 "[ . 1 . 2]" 1
1166 1 54 GLU HA 1 56 GLU H 4.000 . 4.800 4.594 4.145 4.843 0.043 10 0 "[ . 1 . 2]" 1
1167 1 54 GLU QB 1 56 GLU H 3.900 . 4.700 4.669 4.365 4.850 0.150 8 0 "[ . 1 . 2]" 1
1168 1 54 GLU H 1 56 GLU H 4.200 . 5.000 4.259 4.032 4.499 . 0 0 "[ . 1 . 2]" 1
1169 1 55 LEU HA 1 58 LYS H 3.200 . 3.800 3.679 3.393 3.905 0.105 2 0 "[ . 1 . 2]" 1
1170 1 55 LEU HA 1 58 LYS HB3 4.100 . 4.900 3.162 2.507 4.700 . 0 0 "[ . 1 . 2]" 1
1171 1 55 LEU HA 1 58 LYS QD 4.000 . 4.800 3.809 2.422 4.865 0.065 12 0 "[ . 1 . 2]" 1
1172 1 55 LEU HA 1 59 TYR H 3.900 . 4.700 4.179 3.719 4.574 . 0 0 "[ . 1 . 2]" 1
1173 1 55 LEU HA 1 59 TYR QE 4.500 . 5.500 3.553 2.780 4.958 . 0 0 "[ . 1 . 2]" 1
1174 1 55 LEU QD 1 59 TYR HB3 5.500 . 6.000 5.162 4.020 5.768 . 0 0 "[ . 1 . 2]" 1
1175 1 55 LEU QD 1 59 TYR QD 4.700 . 5.800 2.800 1.439 3.702 0.361 4 0 "[ . 1 . 2]" 1
1176 1 55 LEU QD 1 59 TYR QE 4.400 . 5.500 2.341 1.830 3.501 . 0 0 "[ . 1 . 2]" 1
1177 1 55 LEU H 1 57 GLU H 4.000 . 4.800 4.343 3.918 4.624 . 0 0 "[ . 1 . 2]" 1
1178 1 56 GLU HA 1 58 LYS H 4.300 . 5.200 4.442 3.868 4.761 . 0 0 "[ . 1 . 2]" 1
1179 1 56 GLU HA 1 59 TYR H 4.200 . 5.000 3.648 3.084 4.221 . 0 0 "[ . 1 . 2]" 1
1180 1 56 GLU HA 1 60 ALA H 4.400 . 5.300 4.392 3.730 4.699 . 0 0 "[ . 1 . 2]" 1
1181 1 57 GLU HA 1 59 TYR H 4.000 . 4.800 4.246 3.677 4.745 . 0 0 "[ . 1 . 2]" 1
1182 1 57 GLU HA 1 60 ALA H 3.300 . 4.000 3.408 2.950 4.013 0.013 12 0 "[ . 1 . 2]" 1
1183 1 57 GLU HA 1 60 ALA MB 4.000 . 4.900 2.423 1.858 3.076 . 0 0 "[ . 1 . 2]" 1
1184 1 58 LYS HA 1 60 ALA H 3.600 . 4.300 4.119 3.857 4.346 0.046 12 0 "[ . 1 . 2]" 1
1185 1 58 LYS H 1 60 ALA H 3.800 . 4.600 3.872 3.654 4.260 . 0 0 "[ . 1 . 2]" 1
1186 1 59 TYR HA 1 62 LYS HB2 4.600 . 5.500 3.911 3.034 5.271 . 0 0 "[ . 1 . 2]" 1
1187 1 59 TYR QE 1 64 ILE MD 6.700 . 7.400 4.879 3.562 6.195 . 0 0 "[ . 1 . 2]" 1
1188 1 60 ALA HA 1 62 LYS H 3.200 . 3.800 3.514 3.169 3.834 0.034 14 0 "[ . 1 . 2]" 1
1189 1 64 ILE MD 1 66 PHE HZ 5.800 . 6.700 3.412 2.281 5.072 . 0 0 "[ . 1 . 2]" 1
1190 1 64 ILE MG 1 66 PHE QD 6.200 . 7.400 3.945 2.684 5.929 . 0 0 "[ . 1 . 2]" 1
1191 1 64 ILE MG 1 66 PHE HZ 5.300 . 6.500 3.933 2.783 5.809 . 0 0 "[ . 1 . 2]" 1
1192 1 67 VAL MG1 1 69 LEU H 6.200 . 6.700 4.467 3.729 4.870 . 0 0 "[ . 1 . 2]" 1
1193 1 67 VAL MG1 1 69 LEU HA 6.500 . 6.700 4.372 3.922 4.744 . 0 0 "[ . 1 . 2]" 1
1194 1 67 VAL MG1 1 69 LEU QD 5.700 . 7.000 3.204 2.102 4.126 . 0 0 "[ . 1 . 2]" 1
1195 1 69 LEU HB3 1 71 CYS H 4.700 . 5.700 5.488 4.825 5.743 0.043 8 0 "[ . 1 . 2]" 1
1196 1 70 SER HB3 1 72 ASP H 3.700 . 4.400 3.760 2.359 4.063 . 0 0 "[ . 1 . 2]" 1
1197 1 72 ASP HA 1 74 ASN H 3.700 . 4.400 3.692 3.389 3.970 . 0 0 "[ . 1 . 2]" 1
1198 1 72 ASP HB2 1 74 ASN H 3.500 . 4.200 4.251 4.055 4.429 0.229 11 0 "[ . 1 . 2]" 1
1199 1 72 ASP HB3 1 74 ASN H 4.400 . 5.400 3.093 2.683 4.543 . 0 0 "[ . 1 . 2]" 1
1200 1 72 ASP HB3 1 75 LYS HA 4.900 . 5.900 4.437 3.507 4.962 . 0 0 "[ . 1 . 2]" 1
1201 1 73 LYS QG 1 75 LYS H 4.000 . 5.000 4.812 4.369 5.106 0.106 12 0 "[ . 1 . 2]" 1
1202 1 74 ASN HA 1 77 ALA MB 5.700 . 6.700 4.075 3.832 4.944 . 0 0 "[ . 1 . 2]" 1
1203 1 74 ASN HB2 1 76 LYS H 4.800 . 5.800 4.944 4.479 5.457 . 0 0 "[ . 1 . 2]" 1
1204 1 74 ASN HB2 1 77 ALA H 3.800 . 4.600 3.331 2.961 4.404 . 0 0 "[ . 1 . 2]" 1
1205 1 74 ASN HB2 1 77 ALA MB 4.700 . 5.700 2.014 1.724 3.751 0.076 6 0 "[ . 1 . 2]" 1
1206 1 74 ASN HB3 1 77 ALA H 3.900 . 4.800 4.161 3.147 4.695 . 0 0 "[ . 1 . 2]" 1
1207 1 74 ASN HB3 1 77 ALA HA 5.300 . 6.000 5.854 4.835 6.516 0.516 8 1 "[ . + 1 . 2]" 1
1208 1 74 ASN HB3 1 77 ALA MB 4.400 . 5.400 2.985 2.116 3.616 . 0 0 "[ . 1 . 2]" 1
1209 1 74 ASN HD21 1 77 ALA H 4.200 . 5.200 4.628 3.824 5.409 0.209 10 0 "[ . 1 . 2]" 1
1210 1 75 LYS HA 1 78 TRP H 3.100 . 3.700 3.572 3.374 3.824 0.124 8 0 "[ . 1 . 2]" 1
1211 1 75 LYS HA 1 78 TRP HB3 3.600 . 4.300 2.665 2.346 3.200 . 0 0 "[ . 1 . 2]" 1
1212 1 75 LYS HA 1 79 GLU H 3.600 . 4.300 3.893 3.634 4.280 . 0 0 "[ . 1 . 2]" 1
1213 1 75 LYS HA 1 79 GLU HG2 5.000 . 6.000 4.924 3.795 6.026 0.026 15 0 "[ . 1 . 2]" 1
1214 1 75 LYS HB3 1 77 ALA H 4.600 . 5.600 4.988 4.732 5.176 . 0 0 "[ . 1 . 2]" 1
1215 1 75 LYS HE2 1 79 GLU H 3.700 . 4.400 4.527 4.434 4.651 0.251 10 0 "[ . 1 . 2]" 1
1216 1 75 LYS HG2 1 79 GLU H 3.600 . 4.300 3.960 3.386 4.439 0.139 12 0 "[ . 1 . 2]" 1
1217 1 75 LYS HG2 1 79 GLU HG2 4.100 . 4.900 3.781 2.158 4.966 0.066 16 0 "[ . 1 . 2]" 1
1218 1 75 LYS HG2 1 79 GLU HG3 4.700 . 5.600 4.259 2.790 5.709 0.109 15 0 "[ . 1 . 2]" 1
1219 1 75 LYS H 1 77 ALA H 4.100 . 4.900 4.360 4.093 4.555 . 0 0 "[ . 1 . 2]" 1
1220 1 76 LYS HA 1 78 TRP H 3.900 . 4.700 4.247 4.022 4.500 . 0 0 "[ . 1 . 2]" 1
1221 1 76 LYS HA 1 79 GLU H 3.300 . 4.000 3.546 3.357 3.852 . 0 0 "[ . 1 . 2]" 1
1222 1 76 LYS HA 1 80 ASN H 4.000 . 5.000 4.254 3.782 4.704 . 0 0 "[ . 1 . 2]" 1
1223 1 76 LYS HB3 1 78 TRP H 4.100 . 4.900 4.805 4.569 4.946 0.046 4 0 "[ . 1 . 2]" 1
1224 1 76 LYS H 1 78 TRP H 3.800 . 4.600 4.105 3.892 4.273 . 0 0 "[ . 1 . 2]" 1
1225 1 76 LYS H 1 79 GLU HG2 4.500 . 5.400 4.734 3.799 5.520 0.120 18 0 "[ . 1 . 2]" 1
1226 1 77 ALA HA 1 80 ASN H 3.600 . 4.300 3.854 3.515 4.108 . 0 0 "[ . 1 . 2]" 1
1227 1 77 ALA HA 1 80 ASN HB3 4.000 . 5.000 4.756 4.313 5.118 0.118 12 0 "[ . 1 . 2]" 1
1228 1 77 ALA HA 1 80 ASN HD21 4.100 . 4.900 2.235 1.778 3.928 0.022 5 0 "[ . 1 . 2]" 1
1229 1 77 ALA HA 1 80 ASN HD22 4.300 . 5.200 1.971 1.635 2.539 0.165 10 0 "[ . 1 . 2]" 1
1230 1 77 ALA MB 1 80 ASN HD21 4.800 . 5.800 3.710 3.066 4.821 . 0 0 "[ . 1 . 2]" 1
1231 1 77 ALA MB 1 80 ASN HD22 5.600 . 6.700 3.525 3.279 3.921 . 0 0 "[ . 1 . 2]" 1
1232 1 77 ALA H 1 79 GLU H 4.200 . 5.200 4.336 4.135 4.691 . 0 0 "[ . 1 . 2]" 1
1233 1 78 TRP HA 1 80 ASN HD21 4.700 . 5.600 5.054 4.501 5.633 0.033 10 0 "[ . 1 . 2]" 1
1234 1 78 TRP HA 1 80 ASN HD22 4.700 . 5.600 5.555 4.943 5.918 0.318 8 0 "[ . 1 . 2]" 1
1235 1 78 TRP HA 1 82 VAL H 4.200 . 5.000 4.033 3.744 4.219 . 0 0 "[ . 1 . 2]" 1
1236 1 78 TRP HA 1 82 VAL MG1 5.500 . 6.700 4.430 4.001 6.319 . 0 0 "[ . 1 . 2]" 1
1237 1 78 TRP HD1 1 82 VAL MG1 5.300 . 6.300 4.691 4.226 6.001 . 0 0 "[ . 1 . 2]" 1
1238 1 78 TRP HE1 1 82 VAL MG1 6.500 . 6.700 4.511 4.105 5.024 . 0 0 "[ . 1 . 2]" 1
1239 1 78 TRP HE3 1 81 MET H 4.400 . 5.300 4.165 3.661 4.739 . 0 0 "[ . 1 . 2]" 1
1240 1 78 TRP HH2 1 81 MET ME 5.800 . 6.700 4.697 2.648 6.171 . 0 0 "[ . 1 . 2]" 1
1241 1 78 TRP HH2 1 81 MET HG2 4.200 . 5.000 4.374 3.612 5.125 0.125 5 0 "[ . 1 . 2]" 1
1242 1 78 TRP HH2 1 82 VAL HB 3.600 . 4.400 4.209 3.886 4.579 0.179 12 0 "[ . 1 . 2]" 1
1243 1 78 TRP HH2 1 82 VAL MG1 5.000 . 6.100 5.245 4.803 5.557 . 0 0 "[ . 1 . 2]" 1
1244 1 78 TRP H 1 80 ASN H 4.100 . 4.900 4.105 3.803 4.520 . 0 0 "[ . 1 . 2]" 1
1245 1 78 TRP HZ2 1 82 VAL HA 4.700 . 5.600 5.580 5.161 5.723 0.123 16 0 "[ . 1 . 2]" 1
1246 1 78 TRP HZ2 1 82 VAL HB 3.700 . 4.600 4.022 3.623 4.465 . 0 0 "[ . 1 . 2]" 1
1247 1 78 TRP HZ2 1 82 VAL MG1 4.100 . 5.000 4.790 4.378 5.086 0.086 7 0 "[ . 1 . 2]" 1
1248 1 79 GLU HA 1 82 VAL H 3.700 . 4.400 3.730 3.517 4.038 . 0 0 "[ . 1 . 2]" 1
1249 1 79 GLU HA 1 82 VAL MG1 5.100 . 6.200 2.180 1.802 3.862 . 0 0 "[ . 1 . 2]" 1
1250 1 79 GLU H 1 82 VAL MG1 5.500 . 6.700 4.060 3.816 5.955 . 0 0 "[ . 1 . 2]" 1
1251 1 80 ASN HA 1 83 THR H 3.900 . 4.700 3.529 3.099 3.893 . 0 0 "[ . 1 . 2]" 1
1252 1 80 ASN HA 1 83 THR MG 5.700 . 6.700 3.899 2.114 4.502 . 0 0 "[ . 1 . 2]" 1
1253 1 80 ASN HA 1 84 LYS H 3.700 . 4.400 4.198 3.975 4.487 0.087 14 0 "[ . 1 . 2]" 1
1254 1 80 ASN HB2 1 83 THR H 4.600 . 5.500 5.356 5.053 5.531 0.031 5 0 "[ . 1 . 2]" 1
1255 1 80 ASN H 1 82 VAL H 3.800 . 4.600 4.384 4.164 4.602 0.002 5 0 "[ . 1 . 2]" 1
1256 1 80 ASN H 1 82 VAL MG1 5.900 . 6.700 4.224 3.987 6.080 . 0 0 "[ . 1 . 2]" 1
1257 1 81 MET HA 1 84 LYS H 2.600 . 3.100 3.202 3.119 3.300 0.200 5 0 "[ . 1 . 2]" 1
1258 1 81 MET HA 1 84 LYS HB3 3.500 . 4.200 3.058 2.256 4.279 0.079 11 0 "[ . 1 . 2]" 1
1259 1 81 MET HA 1 85 ASP H 3.300 . 4.000 3.675 3.423 3.869 . 0 0 "[ . 1 . 2]" 1
1260 1 81 MET HB2 1 85 ASP QB 4.300 . 5.300 5.355 4.835 5.599 0.299 1 0 "[ . 1 . 2]" 1
1261 1 81 MET ME 1 83 THR H 5.500 . 6.700 6.687 6.119 6.796 0.096 15 0 "[ . 1 . 2]" 1
1262 1 81 MET H 1 84 LYS HB2 4.300 . 5.300 5.209 4.911 5.373 0.073 16 0 "[ . 1 . 2]" 1
1263 1 82 VAL HA 1 87 LEU H 3.700 . 4.400 3.513 2.965 4.072 . 0 0 "[ . 1 . 2]" 1
1264 1 82 VAL HA 1 87 LEU QB 3.200 . 3.800 3.337 2.498 3.857 0.057 9 0 "[ . 1 . 2]" 1
1265 1 82 VAL HA 1 87 LEU QD 3.800 . 4.700 2.640 1.783 3.119 0.017 17 0 "[ . 1 . 2]" 1
1266 1 82 VAL MG1 1 84 LYS H 6.400 . 6.700 4.429 4.280 4.730 . 0 0 "[ . 1 . 2]" 1
1267 1 82 VAL MG1 1 87 LEU H 5.700 . 6.700 4.906 3.008 5.341 . 0 0 "[ . 1 . 2]" 1
1268 1 82 VAL MG1 1 87 LEU QD 5.800 . 7.200 4.067 3.402 4.580 . 0 0 "[ . 1 . 2]" 1
1269 1 82 VAL MG2 1 86 GLN H 6.100 . 6.700 4.347 3.760 5.061 . 0 0 "[ . 1 . 2]" 1
1270 1 82 VAL MG2 1 87 LEU QB 4.100 . 5.000 1.779 1.690 2.040 0.110 7 0 "[ . 1 . 2]" 1
1271 1 82 VAL H 1 84 LYS H 3.900 . 4.700 4.082 3.813 4.224 . 0 0 "[ . 1 . 2]" 1
1272 1 83 THR HA 1 85 ASP H 4.000 . 4.800 4.641 4.305 4.847 0.047 10 0 "[ . 1 . 2]" 1
1273 1 83 THR H 1 85 ASP H 4.200 . 5.000 4.089 3.799 4.298 . 0 0 "[ . 1 . 2]" 1
1274 1 83 THR H 1 85 ASP QB 4.500 . 5.500 5.001 4.645 5.516 0.016 10 0 "[ . 1 . 2]" 1
1275 1 84 LYS HA 1 86 GLN H 3.500 . 4.200 3.894 3.628 4.212 0.012 17 0 "[ . 1 . 2]" 1
1276 1 84 LYS H 1 86 GLN H 3.700 . 4.400 3.718 3.461 3.834 . 0 0 "[ . 1 . 2]" 1
1277 1 84 LYS H 1 87 LEU H 4.900 . 5.900 5.595 5.162 5.942 0.042 6 0 "[ . 1 . 2]" 1
1278 1 85 ASP HA 1 87 LEU QD 6.300 . 6.700 4.385 3.870 5.163 . 0 0 "[ . 1 . 2]" 1
1279 1 85 ASP HB2 1 87 LEU QD 4.200 . 5.100 3.220 2.187 4.365 . 0 0 "[ . 1 . 2]" 1
1280 1 85 ASP QB 1 87 LEU H 4.000 . 4.800 3.442 2.820 4.121 . 0 0 "[ . 1 . 2]" 1
1281 1 85 ASP QB 1 87 LEU QD 5.000 . 6.100 2.419 1.784 3.272 0.016 18 0 "[ . 1 . 2]" 1
1282 1 85 ASP H 1 87 LEU H 4.100 . 4.900 4.348 3.868 4.948 0.048 13 0 "[ . 1 . 2]" 1
1283 1 85 ASP H 1 87 LEU QD 5.800 . 7.200 4.440 3.436 4.981 . 0 0 "[ . 1 . 2]" 1
1284 1 87 LEU QB 1 91 GLN HE21 3.600 . 4.300 3.409 1.950 4.342 0.042 4 0 "[ . 1 . 2]" 1
1285 1 87 LEU QB 1 91 GLN HE22 3.400 . 4.100 2.768 1.867 4.120 0.020 5 0 "[ . 1 . 2]" 1
1286 1 87 LEU QD 1 91 GLN HE21 6.100 . 7.400 4.211 2.213 5.383 . 0 0 "[ . 1 . 2]" 1
1287 1 87 LEU QD 1 91 GLN HE22 5.700 . 7.000 3.805 2.808 4.729 . 0 0 "[ . 1 . 2]" 1
1288 1 90 ILE MG 1 92 LEU HB3 6.500 . 6.700 5.306 3.895 6.348 . 0 0 "[ . 1 . 2]" 1
1289 1 93 HIS HA 1 95 GLY H 4.300 . 5.200 4.610 3.908 5.277 0.077 20 0 "[ . 1 . 2]" 1
1290 1 93 HIS HE1 1 95 GLY HA2 3.200 . 3.800 3.040 2.356 3.850 0.050 8 0 "[ . 1 . 2]" 1
1291 1 93 HIS HE1 1 95 GLY HA3 2.900 . 3.500 3.082 2.234 3.538 0.038 5 0 "[ . 1 . 2]" 1
1292 1 94 MET HB2 1 97 ASP H 4.000 . 4.800 4.967 4.806 5.150 0.350 10 0 "[ . 1 . 2]" 1
1293 1 94 MET HB2 1 97 ASP QB 4.800 . 5.800 4.317 3.603 5.620 . 0 0 "[ . 1 . 2]" 1
1294 1 94 MET HB3 1 97 ASP H 4.400 . 5.300 4.591 3.866 5.004 . 0 0 "[ . 1 . 2]" 1
1295 1 94 MET HG2 1 97 ASP H 4.400 . 5.300 2.377 2.045 3.102 . 0 0 "[ . 1 . 2]" 1
1296 1 95 GLY HA2 1 97 ASP H 3.900 . 4.700 4.625 4.024 4.930 0.230 1 0 "[ . 1 . 2]" 1
1297 1 95 GLY HA3 1 97 ASP H 4.100 . 4.900 3.979 3.663 4.437 . 0 0 "[ . 1 . 2]" 1
1298 1 97 ASP HA 1 99 THR H 3.800 . 4.600 3.317 3.069 3.605 . 0 0 "[ . 1 . 2]" 1
1299 1 97 ASP QB 1 99 THR H 4.400 . 5.300 3.804 3.490 4.171 . 0 0 "[ . 1 . 2]" 1
1300 1 98 ARG HA 1 100 PHE H 3.200 . 3.800 3.404 2.683 3.906 0.106 5 0 "[ . 1 . 2]" 1
1301 1 98 ARG HA 1 101 MET H 3.900 . 4.700 2.840 2.337 3.379 . 0 0 "[ . 1 . 2]" 1
1302 1 98 ARG HA 1 101 MET QG 4.000 . 4.800 3.022 1.714 4.535 0.086 9 0 "[ . 1 . 2]" 1
1303 1 98 ARG HA 1 102 ASP H 4.200 . 5.000 4.382 3.437 5.029 0.029 4 0 "[ . 1 . 2]" 1
1304 1 98 ARG HB2 1 101 MET H 3.900 . 4.700 4.290 3.679 4.853 0.153 5 0 "[ . 1 . 2]" 1
1305 1 98 ARG HB2 1 101 MET QG 3.100 . 3.700 3.155 2.392 3.851 0.151 9 0 "[ . 1 . 2]" 1
1306 1 98 ARG HB2 1 102 ASP H 3.900 . 4.700 4.508 3.634 4.867 0.167 5 0 "[ . 1 . 2]" 1
1307 1 98 ARG QD 1 101 MET H 4.300 . 5.300 4.898 4.160 5.449 0.149 16 0 "[ . 1 . 2]" 1
1308 1 98 ARG QD 1 101 MET QG 3.600 . 4.300 4.034 2.621 4.522 0.222 17 0 "[ . 1 . 2]" 1
1309 1 99 THR HA 1 102 ASP HB2 4.200 . 5.000 3.100 2.381 4.118 . 0 0 "[ . 1 . 2]" 1
1310 1 99 THR HA 1 102 ASP HB3 4.100 . 4.900 3.737 2.172 4.953 0.053 17 0 "[ . 1 . 2]" 1
1311 1 100 PHE HA 1 103 ALA H 3.700 . 4.400 3.125 2.990 3.374 . 0 0 "[ . 1 . 2]" 1
1312 1 100 PHE HA 1 103 ALA MB 4.500 . 5.500 2.442 1.992 2.859 . 0 0 "[ . 1 . 2]" 1
1313 1 100 PHE HA 1 104 TYR QE 6.100 . 6.700 5.153 3.588 6.705 0.005 9 0 "[ . 1 . 2]" 1
1314 1 100 PHE HB2 1 103 ALA H 4.300 . 5.300 5.432 5.371 5.513 0.213 12 0 "[ . 1 . 2]" 1
1315 1 100 PHE HB3 1 104 TYR QE 5.700 . 6.700 5.450 4.156 6.667 . 0 0 "[ . 1 . 2]" 1
1316 1 101 MET ME 1 106 ILE MG 4.300 . 5.400 3.605 1.778 5.372 0.022 15 0 "[ . 1 . 2]" 1
1317 1 102 ASP HA 1 104 TYR H 4.500 . 5.400 3.980 3.519 4.763 . 0 0 "[ . 1 . 2]" 1
1318 1 102 ASP HA 1 105 LEU H 3.600 . 4.300 3.265 2.879 3.862 . 0 0 "[ . 1 . 2]" 1
1319 1 102 ASP HA 1 105 LEU HA 3.400 . 4.100 3.347 2.748 3.994 . 0 0 "[ . 1 . 2]" 1
1320 1 102 ASP HA 1 105 LEU QD 5.900 . 7.300 3.986 3.003 5.615 . 0 0 "[ . 1 . 2]" 1
1321 1 102 ASP HA 1 106 ILE H 4.200 . 5.000 4.140 3.244 5.045 0.045 17 0 "[ . 1 . 2]" 1
1322 1 103 ALA H 1 105 LEU QD 5.700 . 6.000 5.081 4.510 6.096 0.096 18 0 "[ . 1 . 2]" 1
1323 1 104 TYR HB2 1 106 ILE MD 5.000 . 6.100 2.986 1.746 5.436 0.054 4 0 "[ . 1 . 2]" 1
1324 1 104 TYR HB3 1 106 ILE H 2.900 . 3.500 3.461 3.090 3.602 0.102 14 0 "[ . 1 . 2]" 1
1325 1 104 TYR HB3 1 106 ILE MD 4.100 . 5.000 3.251 2.455 4.967 . 0 0 "[ . 1 . 2]" 1
1326 1 104 TYR QD 1 106 ILE MD 5.000 . 6.200 3.693 2.554 6.208 0.008 18 0 "[ . 1 . 2]" 1
1327 1 104 TYR H 1 106 ILE H 4.100 . 4.900 3.487 3.060 4.239 . 0 0 "[ . 1 . 2]" 1
1328 1 104 TYR H 1 106 ILE MD 5.200 . 6.300 4.524 3.212 6.501 0.201 6 0 "[ . 1 . 2]" 1
1329 1 106 ILE HA 1 111 ARG HG3 3.900 . 4.700 2.827 1.759 4.823 0.123 18 0 "[ . 1 . 2]" 1
1330 1 106 ILE MD 1 111 ARG HB2 6.100 . 6.700 3.621 2.491 6.285 . 0 0 "[ . 1 . 2]" 1
1331 1 106 ILE MD 1 111 ARG HG3 3.700 . 4.500 3.475 1.877 4.578 0.078 18 0 "[ . 1 . 2]" 1
1332 1 106 ILE MG 1 108 GLY H 4.900 . 6.000 4.360 2.125 5.976 . 0 0 "[ . 1 . 2]" 1
1333 1 106 ILE MG 1 109 ILE HA 5.800 . 6.700 4.594 3.312 6.186 . 0 0 "[ . 1 . 2]" 1
1334 1 106 ILE MG 1 111 ARG HE 6.000 . 6.000 4.211 2.027 5.593 . 0 0 "[ . 1 . 2]" 1
1335 1 106 ILE MG 1 111 ARG HG3 4.400 . 5.400 2.246 1.722 3.132 0.078 20 0 "[ . 1 . 2]" 1
1336 1 106 ILE H 1 111 ARG HG3 3.600 . 4.400 4.459 3.932 4.611 0.211 4 0 "[ . 1 . 2]" 1
1337 1 107 ASN QB 1 109 ILE H 4.600 . 5.600 5.426 4.678 5.732 0.132 10 0 "[ . 1 . 2]" 1
1338 1 109 ILE HA 1 111 ARG H 3.600 . 4.300 3.007 2.511 3.626 . 0 0 "[ . 1 . 2]" 1
1339 1 109 ILE MG 1 111 ARG H 5.500 . 6.700 3.096 2.473 3.612 . 0 0 "[ . 1 . 2]" 1
1340 1 111 ARG HD3 1 113 ILE MG 6.200 . 6.700 5.960 4.483 6.728 0.028 15 0 "[ . 1 . 2]" 1
1341 1 114 LEU QD 1 116 ASP H 6.500 . 6.700 5.176 4.944 5.381 . 0 0 "[ . 1 . 2]" 1
1342 1 115 LEU HA 1 120 LYS H 4.400 . 5.300 4.678 4.433 4.929 . 0 0 "[ . 1 . 2]" 1
1343 1 115 LEU HB2 1 119 GLY HA2 3.900 . 4.700 3.276 2.768 3.800 . 0 0 "[ . 1 . 2]" 1
1344 1 115 LEU HB2 1 120 LYS H 3.500 . 4.300 4.249 3.165 4.388 0.088 8 0 "[ . 1 . 2]" 1
1345 1 115 LEU HB3 1 119 GLY H 4.300 . 5.200 4.296 4.033 5.200 . 0 0 "[ . 1 . 2]" 1
1346 1 115 LEU HB3 1 119 GLY HA2 4.700 . 5.600 3.256 2.944 4.035 . 0 0 "[ . 1 . 2]" 1
1347 1 115 LEU QD 1 119 GLY HA2 6.500 . 6.700 3.001 1.945 3.345 . 0 0 "[ . 1 . 2]" 1
1348 1 115 LEU QD 1 119 GLY HA3 6.400 . 6.700 3.785 3.153 4.171 . 0 0 "[ . 1 . 2]" 1
1349 1 115 LEU QD 1 120 LYS H 5.500 . 6.700 4.067 3.786 4.367 . 0 0 "[ . 1 . 2]" 1
1350 1 115 LEU QD 1 119 GLY H 6.300 . 6.700 4.570 3.433 4.803 . 0 0 "[ . 1 . 2]" 1
1351 1 116 ASP HB2 1 118 ASP H 3.900 . 4.800 4.285 3.074 4.563 . 0 0 "[ . 1 . 2]" 1
1352 1 116 ASP HB2 1 120 LYS H 3.300 . 4.000 4.117 4.021 4.335 0.335 15 0 "[ . 1 . 2]" 1
1353 1 116 ASP H 1 118 ASP H 4.200 . 5.000 4.821 4.465 5.015 0.015 13 0 "[ . 1 . 2]" 1
1354 1 116 ASP H 1 119 GLY H 4.200 . 5.000 4.348 4.152 4.577 . 0 0 "[ . 1 . 2]" 1
1355 1 116 ASP H 1 120 LYS H 3.100 . 3.700 2.949 2.765 3.290 . 0 0 "[ . 1 . 2]" 1
1356 1 116 ASP H 1 120 LYS HB2 4.500 . 5.400 3.402 2.821 5.101 . 0 0 "[ . 1 . 2]" 1
1357 1 116 ASP H 1 121 ILE HA 3.900 . 4.700 3.811 3.604 4.060 . 0 0 "[ . 1 . 2]" 1
1358 1 117 ARG HA 1 119 GLY H 4.600 . 5.500 3.557 3.340 3.790 . 0 0 "[ . 1 . 2]" 1
1359 1 117 ARG QB 1 119 GLY H 4.100 . 4.900 4.329 4.253 4.492 . 0 0 "[ . 1 . 2]" 1
1360 1 117 ARG H 1 122 ILE HG12 4.700 . 5.700 5.731 5.439 5.882 0.182 19 0 "[ . 1 . 2]" 1
1361 1 118 ASP HB2 1 120 LYS H 3.500 . 4.200 4.321 3.478 4.520 0.320 5 0 "[ . 1 . 2]" 1
1362 1 118 ASP HB3 1 120 LYS H 3.700 . 4.400 3.170 2.849 4.439 0.039 10 0 "[ . 1 . 2]" 1
1363 1 118 ASP HB3 1 120 LYS HG2 4.500 . 5.400 2.573 1.775 4.979 0.025 4 0 "[ . 1 . 2]" 1
1364 1 118 ASP H 1 120 LYS HB2 4.300 . 5.200 4.205 3.724 5.020 . 0 0 "[ . 1 . 2]" 1
1365 1 121 ILE HA 1 123 SER H 3.500 . 4.200 3.762 3.466 4.214 0.014 12 0 "[ . 1 . 2]" 1
1366 1 121 ILE MG 1 123 SER H 4.400 . 5.400 2.938 2.598 3.326 . 0 0 "[ . 1 . 2]" 1
1367 1 121 ILE MG 1 123 SER HA 4.600 . 5.600 3.544 3.142 4.049 . 0 0 "[ . 1 . 2]" 1
1368 1 121 ILE MG 1 124 ALA H 4.700 . 5.700 3.199 2.902 3.603 . 0 0 "[ . 1 . 2]" 1
1369 1 121 ILE MG 1 124 ALA MB 5.200 . 6.400 2.690 2.406 3.081 . 0 0 "[ . 1 . 2]" 1
1370 1 123 SER HA 1 125 ASN H 3.500 . 4.200 3.443 3.264 3.940 . 0 0 "[ . 1 . 2]" 1
1371 1 123 SER HB2 1 125 ASN H 3.400 . 4.100 3.961 3.668 4.147 0.047 4 0 "[ . 1 . 2]" 1
1372 1 123 SER HB2 1 126 MET H 3.900 . 4.700 4.502 4.100 4.817 0.117 12 0 "[ . 1 . 2]" 1
1373 1 123 SER HB2 1 126 MET HA 4.700 . 5.600 3.627 2.892 4.370 . 0 0 "[ . 1 . 2]" 1
1374 1 123 SER HB3 1 125 ASN H 3.900 . 4.700 2.986 2.792 3.395 . 0 0 "[ . 1 . 2]" 1
1375 1 123 SER HB3 1 126 MET H 4.300 . 5.200 4.450 3.587 4.943 . 0 0 "[ . 1 . 2]" 1
1376 1 123 SER HB3 1 126 MET HA 4.200 . 5.000 3.334 2.557 3.788 . 0 0 "[ . 1 . 2]" 1
1377 1 123 SER HB3 1 126 MET HG2 4.900 . 5.900 5.127 2.874 5.916 0.016 2 0 "[ . 1 . 2]" 1
1378 1 127 THR HA 1 131 ASP HB2 4.900 . 5.900 5.115 4.425 5.748 . 0 0 "[ . 1 . 2]" 1
1379 1 127 THR HA 1 131 ASP HB3 4.100 . 4.900 4.726 4.116 5.044 0.144 8 0 "[ . 1 . 2]" 1
1380 1 127 THR HB 1 131 ASP H 4.000 . 5.000 4.547 3.836 5.058 0.058 20 0 "[ . 1 . 2]" 1
1381 1 127 THR HB 1 131 ASP HB2 3.600 . 4.300 3.366 2.578 4.378 0.078 13 0 "[ . 1 . 2]" 1
1382 1 127 THR HB 1 131 ASP HB3 3.600 . 4.300 2.485 1.894 3.098 . 0 0 "[ . 1 . 2]" 1
1383 1 127 THR MG 1 131 ASP H 5.800 . 6.700 5.250 4.113 6.010 . 0 0 "[ . 1 . 2]" 1
1384 1 127 THR MG 1 131 ASP HB2 6.500 . 6.700 3.632 2.287 4.773 . 0 0 "[ . 1 . 2]" 1
1385 1 127 THR MG 1 131 ASP HB3 5.400 . 6.600 3.329 2.304 3.915 . 0 0 "[ . 1 . 2]" 1
1386 1 128 ARG HB2 1 130 SER H 4.100 . 4.900 4.187 2.683 5.354 0.454 12 0 "[ . 1 . 2]" 1
1387 1 128 ARG HB2 1 131 ASP H 4.400 . 5.400 4.502 2.655 5.656 0.256 12 0 "[ . 1 . 2]" 1
1388 1 128 ARG HB3 1 130 SER H 3.700 . 4.400 3.571 2.282 4.450 0.050 7 0 "[ . 1 . 2]" 1
1389 1 128 ARG HB3 1 131 ASP H 4.000 . 5.000 3.654 2.193 5.112 0.112 12 0 "[ . 1 . 2]" 1
1390 1 128 ARG HD3 1 130 SER H 3.800 . 4.600 3.818 2.762 4.707 0.107 13 0 "[ . 1 . 2]" 1
1391 1 128 ARG QG 1 130 SER H 3.700 . 4.400 2.647 1.747 4.393 0.053 13 0 "[ . 1 . 2]" 1
1392 1 128 ARG QG 1 131 ASP H 3.800 . 4.600 3.598 2.293 4.819 0.219 19 0 "[ . 1 . 2]" 1
1393 1 128 ARG H 1 131 ASP HB2 3.900 . 4.700 4.117 3.173 4.747 0.047 13 0 "[ . 1 . 2]" 1
1394 1 128 ARG H 1 131 ASP HB3 4.000 . 5.000 3.756 2.864 4.632 . 0 0 "[ . 1 . 2]" 1
1395 1 131 ASP HA 1 133 LYS H 4.300 . 5.200 3.958 3.661 4.304 . 0 0 "[ . 1 . 2]" 1
1396 1 131 ASP HB2 1 134 THR H 4.200 . 5.200 4.798 4.144 5.234 0.034 10 0 "[ . 1 . 2]" 1
1397 1 131 ASP HB3 1 133 LYS H 4.300 . 5.200 3.910 3.344 4.655 . 0 0 "[ . 1 . 2]" 1
1398 1 131 ASP HB3 1 134 THR H 4.000 . 5.000 3.360 2.860 4.668 . 0 0 "[ . 1 . 2]" 1
1399 1 131 ASP H 1 134 THR H 4.500 . 5.500 4.861 4.421 5.297 . 0 0 "[ . 1 . 2]" 1
1400 1 132 PRO HA 1 134 THR H 3.700 . 4.400 4.210 3.639 4.475 0.075 12 0 "[ . 1 . 2]" 1
1401 1 132 PRO HA 1 135 ALA H 3.900 . 4.700 3.424 3.249 3.547 . 0 0 "[ . 1 . 2]" 1
1402 1 132 PRO HA 1 135 ALA MB 5.100 . 6.200 2.748 2.377 3.361 . 0 0 "[ . 1 . 2]" 1
1403 1 132 PRO HA 1 136 GLU H 4.200 . 5.000 4.047 3.643 4.550 . 0 0 "[ . 1 . 2]" 1
1404 1 132 PRO HB2 1 135 ALA MB 5.000 . 6.100 4.627 4.051 5.197 . 0 0 "[ . 1 . 2]" 1
1405 1 132 PRO HB3 1 135 ALA H 4.700 . 5.600 5.475 5.142 5.652 0.052 18 0 "[ . 1 . 2]" 1
1406 1 132 PRO HB3 1 135 ALA MB 6.500 . 6.700 4.214 3.881 4.531 . 0 0 "[ . 1 . 2]" 1
1407 1 132 PRO QG 1 135 ALA H 4.800 . 5.800 5.809 5.555 5.896 0.096 2 0 "[ . 1 . 2]" 1
1408 1 133 LYS H 1 135 ALA H 4.400 . 5.300 4.281 3.817 4.663 . 0 0 "[ . 1 . 2]" 1
1409 1 134 THR HA 1 136 GLU H 4.200 . 5.000 4.581 4.341 4.736 . 0 0 "[ . 1 . 2]" 1
1410 1 134 THR HA 1 137 LYS H 3.600 . 4.300 3.603 3.187 3.931 . 0 0 "[ . 1 . 2]" 1
1411 1 134 THR MG 1 136 GLU H 6.300 . 6.700 5.222 4.287 5.671 . 0 0 "[ . 1 . 2]" 1
1412 1 134 THR MG 1 138 PHE HZ 4.900 . 6.000 2.133 1.779 3.174 0.021 14 0 "[ . 1 . 2]" 1
1413 1 134 THR H 1 136 GLU H 3.800 . 4.600 4.120 3.774 4.427 . 0 0 "[ . 1 . 2]" 1
1414 1 135 ALA HA 1 138 PHE H 3.300 . 4.000 3.426 3.187 3.651 . 0 0 "[ . 1 . 2]" 1
1415 1 135 ALA HA 1 138 PHE HB2 3.600 . 4.300 3.229 2.888 3.595 . 0 0 "[ . 1 . 2]" 1
1416 1 135 ALA HA 1 138 PHE HB3 4.000 . 5.000 4.586 4.274 4.881 . 0 0 "[ . 1 . 2]" 1
1417 1 135 ALA HA 1 138 PHE QD 4.400 . 5.400 2.074 1.871 2.407 . 0 0 "[ . 1 . 2]" 1
1418 1 135 ALA HA 1 139 ASN H 4.000 . 4.800 4.434 4.008 4.772 . 0 0 "[ . 1 . 2]" 1
1419 1 135 ALA MB 1 138 PHE HB2 5.700 . 6.700 4.233 3.861 4.497 . 0 0 "[ . 1 . 2]" 1
1420 1 135 ALA MB 1 138 PHE QD 4.500 . 5.400 3.331 3.147 3.569 . 0 0 "[ . 1 . 2]" 1
1421 1 135 ALA MB 1 139 ASN H 6.100 . 6.700 4.712 4.264 4.928 . 0 0 "[ . 1 . 2]" 1
1422 1 135 ALA H 1 137 LYS H 4.400 . 5.300 4.120 3.809 4.429 . 0 0 "[ . 1 . 2]" 1
1423 1 135 ALA H 1 138 PHE QD 5.900 . 6.700 4.627 4.365 4.979 . 0 0 "[ . 1 . 2]" 1
1424 1 135 ALA H 1 138 PHE HZ 4.000 . 5.000 5.131 5.092 5.170 0.170 14 0 "[ . 1 . 2]" 1
1425 1 136 GLU HA 1 139 ASN H 3.400 . 4.100 3.405 2.747 3.800 . 0 0 "[ . 1 . 2]" 1
1426 1 136 GLU HA 1 139 ASN HD21 3.400 . 4.100 2.736 1.963 4.182 0.082 4 0 "[ . 1 . 2]" 1
1427 1 136 GLU HA 1 139 ASN HD22 3.500 . 4.200 2.778 1.721 4.199 0.079 12 0 "[ . 1 . 2]" 1
1428 1 136 GLU H 1 138 PHE H 4.000 . 4.800 4.159 3.930 4.356 . 0 0 "[ . 1 . 2]" 1
1429 1 137 LYS HA 1 139 ASN H 4.400 . 5.300 4.559 4.068 4.997 . 0 0 "[ . 1 . 2]" 1
1430 1 137 LYS HA 1 140 GLU H 3.400 . 4.100 3.433 2.920 3.845 . 0 0 "[ . 1 . 2]" 1
1431 1 137 LYS HA 1 140 GLU QB 3.400 . 4.100 2.480 1.937 3.124 . 0 0 "[ . 1 . 2]" 1
1432 1 137 LYS HA 1 141 LEU H 4.100 . 4.900 4.031 3.462 4.505 . 0 0 "[ . 1 . 2]" 1
1433 1 137 LYS QB 1 139 ASN H 4.200 . 5.000 4.868 4.512 5.029 0.029 4 0 "[ . 1 . 2]" 1
1434 1 137 LYS H 1 141 LEU QD 6.200 . 6.700 5.514 5.056 5.815 . 0 0 "[ . 1 . 2]" 1
1435 1 138 PHE HA 1 141 LEU QD 4.900 . 6.000 2.545 1.980 3.830 . 0 0 "[ . 1 . 2]" 1
1436 1 138 PHE HB3 1 142 LEU QD 6.500 . 6.700 3.531 2.717 5.130 . 0 0 "[ . 1 . 2]" 1
1437 1 138 PHE QD 1 141 LEU QD 6.200 . 7.400 2.905 1.865 4.093 . 0 0 "[ . 1 . 2]" 1
1438 1 139 ASN HA 1 144 LEU H 3.100 . 3.700 3.480 3.092 3.740 0.040 10 0 "[ . 1 . 2]" 1
1439 1 139 ASN HA 1 144 LEU QB 2.400 . 2.900 2.390 1.902 2.852 . 0 0 "[ . 1 . 2]" 1
1440 1 139 ASN HA 1 144 LEU QD 4.700 . 5.700 3.099 2.493 3.602 . 0 0 "[ . 1 . 2]" 1
1441 1 139 ASN HB2 1 144 LEU H 4.300 . 5.300 4.394 3.098 5.216 . 0 0 "[ . 1 . 2]" 1
1442 1 139 ASN HB2 1 144 LEU QB 4.200 . 5.000 3.195 1.757 4.026 0.043 14 0 "[ . 1 . 2]" 1
1443 1 139 ASN HB2 1 144 LEU QD 4.800 . 5.500 3.619 2.736 4.437 . 0 0 "[ . 1 . 2]" 1
1444 1 139 ASN HB3 1 144 LEU QB 4.600 . 5.500 2.573 1.784 3.545 0.016 5 0 "[ . 1 . 2]" 1
1445 1 139 ASN HB3 1 144 LEU QD 6.100 . 6.700 2.807 1.960 3.790 . 0 0 "[ . 1 . 2]" 1
1446 1 139 ASN H 1 144 LEU QB 4.100 . 4.900 4.740 4.383 4.970 0.070 17 0 "[ . 1 . 2]" 1
1447 1 140 GLU QB 1 143 GLY H 4.200 . 5.000 4.778 4.590 4.886 . 0 0 "[ . 1 . 2]" 1
1448 1 140 GLU HG2 1 143 GLY QA 4.100 . 4.900 4.978 4.777 5.096 0.196 12 0 "[ . 1 . 2]" 1
1449 1 140 GLU HG3 1 143 GLY H 4.900 . 5.900 5.600 4.579 5.929 0.029 3 0 "[ . 1 . 2]" 1
1450 1 140 GLU HG3 1 143 GLY QA 4.900 . 5.900 5.393 4.122 5.933 0.033 14 0 "[ . 1 . 2]" 1
1451 1 140 GLU H 1 142 LEU H 3.700 . 4.400 4.146 3.814 4.417 0.017 19 0 "[ . 1 . 2]" 1
1452 1 140 GLU H 1 144 LEU H 4.000 . 4.800 4.756 4.381 4.850 0.050 4 0 "[ . 1 . 2]" 1
1453 1 140 GLU H 1 145 GLU QG 3.200 . 3.800 3.632 2.290 4.105 0.305 2 0 "[ . 1 . 2]" 1
1454 1 141 LEU HB3 1 143 GLY H 4.600 . 5.500 5.335 5.073 5.538 0.038 12 0 "[ . 1 . 2]" 1
1455 1 141 LEU H 1 143 GLY H 4.000 . 4.800 3.893 3.796 4.172 . 0 0 "[ . 1 . 2]" 1
1456 1 142 LEU H 1 144 LEU QD 5.700 . 6.700 5.303 4.957 5.689 . 0 0 "[ . 1 . 2]" 1
1457 1 143 GLY H 1 145 GLU H 3.800 . 4.600 4.041 3.345 4.469 . 0 0 "[ . 1 . 2]" 1
1458 1 2 SER QB 1 11 ALA MB 5.800 . 6.800 4.963 2.691 6.873 0.073 18 0 "[ . 1 . 2]" 1
1459 1 10 ALA MB 1 115 LEU QD 6.200 . 7.400 3.760 1.893 4.582 . 0 0 "[ . 1 . 2]" 1
1460 1 10 ALA MB 1 121 ILE MD 6.300 . 7.400 2.232 1.819 4.344 . 0 0 "[ . 1 . 2]" 1
1461 1 10 ALA MB 1 121 ILE HG12 5.000 . 6.100 3.766 2.794 6.110 0.010 12 0 "[ . 1 . 2]" 1
1462 1 10 ALA MB 1 25 LEU QD 6.700 . 7.400 4.345 2.014 5.545 . 0 0 "[ . 1 . 2]" 1
1463 1 11 ALA HA 1 121 ILE MD 5.700 . 6.700 4.391 2.518 6.629 . 0 0 "[ . 1 . 2]" 1
1464 1 11 ALA H 1 100 PHE HZ 4.100 . 4.900 4.919 4.203 5.061 0.161 5 0 "[ . 1 . 2]" 1
1465 1 11 ALA H 1 115 LEU QD 6.100 . 6.700 5.867 4.389 6.559 . 0 0 "[ . 1 . 2]" 1
1466 1 12 SER HA 1 25 LEU HB2 3.400 . 4.100 2.874 2.125 3.643 . 0 0 "[ . 1 . 2]" 1
1467 1 12 SER HA 1 25 LEU QD 3.900 . 4.800 2.566 1.850 3.830 . 0 0 "[ . 1 . 2]" 1
1468 1 12 SER QB 1 25 LEU HB2 4.400 . 5.300 4.597 3.618 5.352 0.052 4 0 "[ . 1 . 2]" 1
1469 1 12 SER QB 1 25 LEU QD 5.100 . 6.200 3.880 3.136 4.865 . 0 0 "[ . 1 . 2]" 1
1470 1 12 SER H 1 115 LEU QD 6.400 . 6.700 5.692 4.378 6.516 . 0 0 "[ . 1 . 2]" 1
1471 1 13 PHE HB2 1 69 LEU QD 6.500 . 6.700 4.741 3.730 5.507 . 0 0 "[ . 1 . 2]" 1
1472 1 13 PHE QD 1 104 TYR QD 6.900 . 7.400 6.912 5.160 7.504 0.104 6 0 "[ . 1 . 2]" 1
1473 1 13 PHE QD 1 23 VAL HB 5.700 . 6.700 6.302 5.446 6.776 0.076 15 0 "[ . 1 . 2]" 1
1474 1 13 PHE QD 1 24 SER HA 5.900 . 6.700 4.092 3.290 4.734 . 0 0 "[ . 1 . 2]" 1
1475 1 13 PHE QD 1 24 SER QB 5.400 . 6.600 5.267 4.777 5.794 . 0 0 "[ . 1 . 2]" 1
1476 1 13 PHE QD 1 25 LEU HB3 4.800 . 5.900 4.656 3.954 5.450 . 0 0 "[ . 1 . 2]" 1
1477 1 13 PHE QD 1 25 LEU QD 5.900 . 7.300 3.085 2.654 4.007 . 0 0 "[ . 1 . 2]" 1
1478 1 13 PHE QD 1 92 LEU QD 6.200 . 7.400 3.623 2.577 4.988 . 0 0 "[ . 1 . 2]" 1
1479 1 13 PHE QE 1 104 TYR QE 5.100 . 6.000 4.961 2.702 6.011 0.011 14 0 "[ . 1 . 2]" 1
1480 1 13 PHE H 1 25 LEU H 3.900 . 4.700 3.466 2.868 4.437 . 0 0 "[ . 1 . 2]" 1
1481 1 13 PHE H 1 25 LEU HB2 3.700 . 4.400 2.472 1.753 3.286 0.047 20 0 "[ . 1 . 2]" 1
1482 1 13 PHE H 1 25 LEU HB3 3.800 . 4.600 2.987 2.036 4.553 . 0 0 "[ . 1 . 2]" 1
1483 1 13 PHE H 1 25 LEU QD 5.700 . 6.500 3.091 2.378 3.962 . 0 0 "[ . 1 . 2]" 1
1484 1 13 PHE HZ 1 25 LEU HB2 4.300 . 5.300 4.304 3.691 5.077 . 0 0 "[ . 1 . 2]" 1
1485 1 13 PHE HZ 1 25 LEU QD 6.300 . 6.400 2.779 2.221 3.486 . 0 0 "[ . 1 . 2]" 1
1486 1 13 PHE HZ 1 67 VAL MG1 6.300 . 6.700 3.547 2.658 4.714 . 0 0 "[ . 1 . 2]" 1
1487 1 14 SER HA 1 22 THR MG 5.400 . 6.600 4.345 3.640 4.918 . 0 0 "[ . 1 . 2]" 1
1488 1 14 SER HA 1 24 SER HA 2.400 . 2.900 1.921 1.772 2.178 0.028 20 0 "[ . 1 . 2]" 1
1489 1 14 SER HA 1 24 SER HB2 3.500 . 4.200 3.752 3.337 4.247 0.047 8 0 "[ . 1 . 2]" 1
1490 1 14 SER HA 1 24 SER HB3 3.500 . 4.200 3.435 3.036 3.933 . 0 0 "[ . 1 . 2]" 1
1491 1 14 SER QB 1 22 THR MG 3.600 . 4.400 2.976 2.272 4.059 . 0 0 "[ . 1 . 2]" 1
1492 1 14 SER QB 1 24 SER HA 3.500 . 4.200 3.152 2.917 3.666 . 0 0 "[ . 1 . 2]" 1
1493 1 14 SER QB 1 24 SER HB2 3.200 . 3.800 3.493 2.787 3.859 0.059 19 0 "[ . 1 . 2]" 1
1494 1 14 SER QB 1 24 SER HB3 3.200 . 3.800 2.820 2.345 3.254 . 0 0 "[ . 1 . 2]" 1
1495 1 15 TYR HA 1 22 THR MG 6.500 . 6.700 4.462 3.527 5.043 . 0 0 "[ . 1 . 2]" 1
1496 1 15 TYR HB2 1 69 LEU QD 6.500 . 6.700 3.259 2.595 3.600 . 0 0 "[ . 1 . 2]" 1
1497 1 15 TYR HB3 1 69 LEU QD 6.400 . 6.700 3.533 3.009 4.190 . 0 0 "[ . 1 . 2]" 1
1498 1 15 TYR HB3 1 92 LEU HA 4.700 . 5.600 4.329 3.920 4.945 . 0 0 "[ . 1 . 2]" 1
1499 1 15 TYR HB3 1 92 LEU QD 4.300 . 5.300 3.137 2.467 3.678 . 0 0 "[ . 1 . 2]" 1
1500 1 15 TYR HB3 1 93 HIS H 4.000 . 4.800 3.234 2.582 3.904 . 0 0 "[ . 1 . 2]" 1
1501 1 15 TYR QD 1 69 LEU QD 6.400 . 7.400 2.797 2.160 3.104 . 0 0 "[ . 1 . 2]" 1
1502 1 15 TYR QD 1 92 LEU QD 6.600 . 7.400 3.298 1.966 4.357 . 0 0 "[ . 1 . 2]" 1
1503 1 15 TYR QD 1 94 MET HA 4.800 . 5.900 2.611 2.066 3.473 . 0 0 "[ . 1 . 2]" 1
1504 1 15 TYR QD 1 94 MET HB3 5.700 . 6.700 5.167 4.865 5.608 . 0 0 "[ . 1 . 2]" 1
1505 1 15 TYR QE 1 100 PHE HB3 4.100 . 5.000 4.449 3.755 5.064 0.064 16 0 "[ . 1 . 2]" 1
1506 1 15 TYR QE 1 92 LEU HB2 5.200 . 6.200 6.060 5.644 6.263 0.063 9 0 "[ . 1 . 2]" 1
1507 1 15 TYR QE 1 94 MET HA 4.300 . 5.300 2.931 1.957 4.157 . 0 0 "[ . 1 . 2]" 1
1508 1 15 TYR QE 1 94 MET HG2 4.200 . 5.100 4.261 3.353 4.995 . 0 0 "[ . 1 . 2]" 1
1509 1 15 TYR QE 1 94 MET HG3 5.200 . 6.300 2.790 1.852 3.573 . 0 0 "[ . 1 . 2]" 1
1510 1 15 TYR QE 1 97 ASP H 5.000 . 6.100 4.773 3.660 5.986 . 0 0 "[ . 1 . 2]" 1
1511 1 15 TYR QE 1 97 ASP QB 6.200 . 6.700 2.932 1.781 4.182 0.019 14 0 "[ . 1 . 2]" 1
1512 1 15 TYR H 1 22 THR HA 3.900 . 4.700 4.643 4.332 4.768 0.068 5 0 "[ . 1 . 2]" 1
1513 1 15 TYR H 1 22 THR MG 4.600 . 5.600 4.084 3.535 4.470 . 0 0 "[ . 1 . 2]" 1
1514 1 15 TYR H 1 23 VAL H 3.000 . 3.600 3.392 3.116 3.599 . 0 0 "[ . 1 . 2]" 1
1515 1 15 TYR H 1 24 SER HB2 4.500 . 5.500 5.511 5.212 5.639 0.139 19 0 "[ . 1 . 2]" 1
1516 1 15 TYR H 1 24 SER HB3 4.500 . 5.500 4.939 4.466 5.152 . 0 0 "[ . 1 . 2]" 1
1517 1 15 TYR H 1 92 LEU QD 4.900 . 6.000 2.863 2.237 3.709 . 0 0 "[ . 1 . 2]" 1
1518 1 16 PRO HA 1 22 THR HA 2.400 . 2.900 2.445 2.074 2.847 . 0 0 "[ . 1 . 2]" 1
1519 1 16 PRO HA 1 22 THR MG 4.600 . 5.600 4.052 3.732 4.447 . 0 0 "[ . 1 . 2]" 1
1520 1 16 PRO QB 1 22 THR H 4.500 . 5.400 4.796 4.151 5.396 . 0 0 "[ . 1 . 2]" 1
1521 1 16 PRO QB 1 22 THR HA 3.400 . 4.100 3.686 2.998 4.145 0.045 5 0 "[ . 1 . 2]" 1
1522 1 16 PRO HG2 1 22 THR HA 5.700 . 6.700 5.942 5.192 6.320 . 0 0 "[ . 1 . 2]" 1
1523 1 17 ASP HA 1 23 VAL MG1 5.500 . 6.700 5.775 4.047 6.365 . 0 0 "[ . 1 . 2]" 1
1524 1 17 ASP HA 1 38 TRP HH2 4.400 . 5.400 5.365 4.755 5.540 0.140 9 0 "[ . 1 . 2]" 1
1525 1 17 ASP HA 1 38 TRP HZ2 4.400 . 5.300 4.338 3.823 4.636 . 0 0 "[ . 1 . 2]" 1
1526 1 17 ASP HA 1 92 LEU HA 2.900 . 3.500 2.040 1.738 2.514 0.062 18 0 "[ . 1 . 2]" 1
1527 1 17 ASP HA 1 92 LEU HB2 5.000 . 6.000 4.866 3.803 5.456 . 0 0 "[ . 1 . 2]" 1
1528 1 17 ASP HA 1 92 LEU HB3 4.800 . 5.800 4.040 2.909 4.962 . 0 0 "[ . 1 . 2]" 1
1529 1 17 ASP HA 1 92 LEU QD 4.000 . 4.900 2.562 1.966 4.345 . 0 0 "[ . 1 . 2]" 1
1530 1 17 ASP HB2 1 23 VAL MG1 5.000 . 6.100 4.514 3.235 5.845 . 0 0 "[ . 1 . 2]" 1
1531 1 17 ASP HB2 1 92 LEU HA 4.500 . 5.400 3.775 3.238 4.896 . 0 0 "[ . 1 . 2]" 1
1532 1 17 ASP HB2 1 92 LEU QD 4.600 . 5.600 2.552 1.985 4.430 . 0 0 "[ . 1 . 2]" 1
1533 1 17 ASP HB3 1 23 VAL MG1 5.300 . 6.500 5.459 4.011 6.502 0.002 15 0 "[ . 1 . 2]" 1
1534 1 17 ASP HB3 1 92 LEU HA 4.300 . 5.200 4.783 4.416 5.249 0.049 1 0 "[ . 1 . 2]" 1
1535 1 17 ASP HB3 1 92 LEU QD 4.700 . 5.700 3.680 3.161 5.531 . 0 0 "[ . 1 . 2]" 1
1536 1 17 ASP H 1 23 VAL H 4.100 . 5.100 3.432 2.973 3.745 . 0 0 "[ . 1 . 2]" 1
1537 1 17 ASP H 1 23 VAL MG1 5.300 . 6.500 5.253 3.422 5.722 . 0 0 "[ . 1 . 2]" 1
1538 1 17 ASP H 1 23 VAL MG2 5.600 . 6.700 3.157 2.450 5.787 . 0 0 "[ . 1 . 2]" 1
1539 1 17 ASP H 1 92 LEU HA 4.600 . 5.500 4.094 3.848 4.498 . 0 0 "[ . 1 . 2]" 1
1540 1 17 ASP H 1 92 LEU QD 4.900 . 6.000 3.052 2.570 4.872 . 0 0 "[ . 1 . 2]" 1
1541 1 18 ILE HA 1 38 TRP HH2 3.700 . 4.500 4.304 3.601 4.613 0.113 3 0 "[ . 1 . 2]" 1
1542 1 18 ILE HA 1 38 TRP HZ2 3.800 . 4.600 4.732 4.630 4.859 0.259 1 0 "[ . 1 . 2]" 1
1543 1 18 ILE HA 1 79 GLU HA 5.100 . 6.000 4.618 3.927 5.358 . 0 0 "[ . 1 . 2]" 1
1544 1 18 ILE HA 1 79 GLU HG3 4.200 . 5.000 5.116 4.835 5.210 0.210 6 0 "[ . 1 . 2]" 1
1545 1 18 ILE HB 1 38 TRP HH2 3.600 . 4.300 2.613 1.822 4.348 0.048 6 0 "[ . 1 . 2]" 1
1546 1 18 ILE HB 1 79 GLU HG3 5.000 . 6.000 5.705 3.599 6.106 0.106 18 0 "[ . 1 . 2]" 1
1547 1 18 ILE HB 1 82 VAL MG2 5.100 . 6.200 3.955 3.229 5.066 . 0 0 "[ . 1 . 2]" 1
1548 1 18 ILE MD 1 38 TRP HZ2 4.800 . 5.900 4.917 2.527 5.886 . 0 0 "[ . 1 . 2]" 1
1549 1 18 ILE MD 1 79 GLU HA 3.500 . 4.300 2.872 1.801 4.092 . 0 0 "[ . 1 . 2]" 1
1550 1 18 ILE MD 1 79 GLU HB2 5.300 . 6.000 3.901 2.611 4.664 . 0 0 "[ . 1 . 2]" 1
1551 1 18 ILE MD 1 79 GLU HB3 5.200 . 6.000 3.735 2.604 5.521 . 0 0 "[ . 1 . 2]" 1
1552 1 18 ILE MD 1 79 GLU HG2 5.200 . 6.200 4.747 2.165 5.961 . 0 0 "[ . 1 . 2]" 1
1553 1 18 ILE MD 1 79 GLU HG3 3.800 . 4.700 4.187 2.544 4.801 0.101 13 0 "[ . 1 . 2]" 1
1554 1 18 ILE MD 1 82 VAL MG2 4.800 . 6.000 3.078 1.827 4.811 . 0 0 "[ . 1 . 2]" 1
1555 1 18 ILE MD 1 91 GLN HB3 6.500 . 6.700 6.096 4.952 6.811 0.111 7 0 "[ . 1 . 2]" 1
1556 1 18 ILE HG12 1 79 GLU HA 5.300 . 6.000 4.051 2.025 5.719 . 0 0 "[ . 1 . 2]" 1
1557 1 18 ILE HG12 1 79 GLU HB2 5.100 . 6.000 4.822 3.046 6.007 0.007 17 0 "[ . 1 . 2]" 1
1558 1 18 ILE HG12 1 82 VAL MG1 5.800 . 6.700 3.516 1.759 4.382 0.041 7 0 "[ . 1 . 2]" 1
1559 1 18 ILE HG12 1 82 VAL MG2 4.600 . 5.600 4.700 3.484 5.716 0.116 12 0 "[ . 1 . 2]" 1
1560 1 18 ILE HG13 1 79 GLU HA 5.000 . 6.000 3.034 1.927 5.639 . 0 0 "[ . 1 . 2]" 1
1561 1 18 ILE HG13 1 82 VAL MG2 5.800 . 6.700 4.473 2.440 5.985 . 0 0 "[ . 1 . 2]" 1
1562 1 18 ILE MG 1 82 VAL MG1 6.900 . 7.400 2.806 1.757 3.665 0.043 20 0 "[ . 1 . 2]" 1
1563 1 18 ILE H 1 38 TRP HH2 3.800 . 4.600 3.786 3.241 4.079 . 0 0 "[ . 1 . 2]" 1
1564 1 23 VAL HB 1 92 LEU QD 4.800 . 5.000 1.851 1.641 3.859 0.159 1 0 "[ . 1 . 2]" 1
1565 1 23 VAL MG1 1 90 ILE HA 5.700 . 6.700 5.314 4.762 5.692 . 0 0 "[ . 1 . 2]" 1
1566 1 23 VAL MG1 1 91 GLN H 4.500 . 5.500 5.439 4.619 5.608 0.108 13 0 "[ . 1 . 2]" 1
1567 1 23 VAL MG1 1 92 LEU H 5.900 . 6.700 5.897 4.151 6.502 . 0 0 "[ . 1 . 2]" 1
1568 1 23 VAL MG1 1 92 LEU HA 5.800 . 6.700 5.613 3.693 6.178 . 0 0 "[ . 1 . 2]" 1
1569 1 23 VAL H 1 92 LEU QD 4.800 . 5.900 3.070 2.530 3.889 . 0 0 "[ . 1 . 2]" 1
1570 1 25 LEU QD 1 119 GLY HA2 4.700 . 5.700 2.622 2.135 3.441 . 0 0 "[ . 1 . 2]" 1
1571 1 25 LEU QD 1 119 GLY HA3 4.700 . 5.700 2.236 1.666 3.371 0.134 20 0 "[ . 1 . 2]" 1
1572 1 25 LEU QD 1 120 LYS H 5.500 . 6.700 4.616 4.009 5.515 . 0 0 "[ . 1 . 2]" 1
1573 1 28 LEU HA 1 65 HIS HE1 4.200 . 5.000 3.862 2.925 5.105 0.105 8 0 "[ . 1 . 2]" 1
1574 1 28 LEU QD 1 65 HIS HE1 4.800 . 5.900 3.663 2.813 5.130 . 0 0 "[ . 1 . 2]" 1
1575 1 28 LEU QD 1 65 HIS HB2 6.100 . 6.700 3.221 2.196 4.149 . 0 0 "[ . 1 . 2]" 1
1576 1 28 LEU QD 1 65 HIS HB3 6.500 . 6.700 2.703 2.118 5.173 . 0 0 "[ . 1 . 2]" 1
1577 1 29 LYS HA 1 117 ARG HA 4.400 . 5.300 4.456 3.769 5.063 . 0 0 "[ . 1 . 2]" 1
1578 1 29 LYS HA 1 118 ASP HA 4.300 . 5.200 4.352 3.192 5.216 0.016 8 0 "[ . 1 . 2]" 1
1579 1 29 LYS QB 1 118 ASP HA 4.500 . 5.400 4.415 2.921 5.091 . 0 0 "[ . 1 . 2]" 1
1580 1 29 LYS QD 1 118 ASP HA 3.700 . 4.400 3.895 2.534 4.421 0.021 6 0 "[ . 1 . 2]" 1
1581 1 29 LYS QD 1 119 GLY HA2 4.500 . 5.400 5.276 4.404 5.509 0.109 13 0 "[ . 1 . 2]" 1
1582 1 29 LYS QD 1 119 GLY HA3 5.200 . 6.000 4.113 3.346 4.489 . 0 0 "[ . 1 . 2]" 1
1583 1 29 LYS QE 1 118 ASP HA 3.500 . 4.200 3.135 1.786 4.243 0.043 2 0 "[ . 1 . 2]" 1
1584 1 29 LYS HG2 1 118 ASP HA 3.700 . 4.400 3.507 1.879 4.353 . 0 0 "[ . 1 . 2]" 1
1585 1 29 LYS HG2 1 119 GLY HA3 5.000 . 6.000 5.716 3.925 6.161 0.161 2 0 "[ . 1 . 2]" 1
1586 1 29 LYS HG3 1 118 ASP H 4.400 . 5.400 5.000 4.439 5.603 0.203 16 0 "[ . 1 . 2]" 1
1587 1 29 LYS HG3 1 118 ASP HA 3.500 . 4.200 2.673 1.743 3.498 0.057 5 0 "[ . 1 . 2]" 1
1588 1 29 LYS HG3 1 119 GLY H 3.900 . 4.700 4.146 3.768 4.465 . 0 0 "[ . 1 . 2]" 1
1589 1 30 GLY HA2 1 117 ARG QB 4.600 . 5.500 3.020 2.671 3.419 . 0 0 "[ . 1 . 2]" 1
1590 1 30 GLY HA3 1 117 ARG QB 3.900 . 4.700 4.190 3.945 4.607 . 0 0 "[ . 1 . 2]" 1
1591 1 30 GLY HA3 1 117 ARG QD 5.000 . 6.000 5.529 4.344 6.074 0.074 17 0 "[ . 1 . 2]" 1
1592 1 30 GLY H 1 117 ARG QB 4.000 . 4.800 3.118 2.427 3.647 . 0 0 "[ . 1 . 2]" 1
1593 1 31 LYS HA 1 117 ARG HG2 5.400 . 6.000 2.289 1.792 2.767 0.008 18 0 "[ . 1 . 2]" 1
1594 1 31 LYS HA 1 117 ARG HG3 5.400 . 6.000 3.904 3.204 4.522 . 0 0 "[ . 1 . 2]" 1
1595 1 31 LYS HB3 1 65 HIS HE1 4.000 . 4.800 4.322 3.271 4.922 0.122 15 0 "[ . 1 . 2]" 1
1596 1 31 LYS HD2 1 64 ILE H 3.000 . 3.600 3.633 3.240 3.737 0.137 11 0 "[ . 1 . 2]" 1
1597 1 31 LYS HD3 1 64 ILE H 3.800 . 4.600 2.885 2.067 4.686 0.086 3 0 "[ . 1 . 2]" 1
1598 1 31 LYS QE 1 65 HIS HE1 3.500 . 4.200 4.007 2.604 4.288 0.088 5 0 "[ . 1 . 2]" 1
1599 1 31 LYS H 1 117 ARG HA 3.000 . 3.600 3.258 2.608 3.660 0.060 14 0 "[ . 1 . 2]" 1
1600 1 31 LYS H 1 117 ARG HG2 4.800 . 5.800 4.167 3.483 4.762 . 0 0 "[ . 1 . 2]" 1
1601 1 31 LYS H 1 65 HIS HD2 4.000 . 4.800 3.907 3.208 4.905 0.105 17 0 "[ . 1 . 2]" 1
1602 1 32 TYR HA 1 114 LEU QD 5.600 . 6.700 4.780 4.312 5.789 . 0 0 "[ . 1 . 2]" 1
1603 1 32 TYR HA 1 115 LEU H 4.700 . 5.600 5.162 4.751 5.515 . 0 0 "[ . 1 . 2]" 1
1604 1 32 TYR HA 1 116 ASP HA 4.200 . 5.000 3.417 3.005 3.647 . 0 0 "[ . 1 . 2]" 1
1605 1 32 TYR HA 1 122 ILE MD 6.500 . 6.700 5.775 4.464 6.723 0.023 13 0 "[ . 1 . 2]" 1
1606 1 32 TYR HB2 1 64 ILE H 4.100 . 5.100 4.837 4.390 5.190 0.090 2 0 "[ . 1 . 2]" 1
1607 1 32 TYR HB2 1 64 ILE HA 5.000 . 6.000 2.582 2.157 2.871 . 0 0 "[ . 1 . 2]" 1
1608 1 32 TYR HB2 1 64 ILE MD 4.900 . 6.000 4.044 2.420 5.112 . 0 0 "[ . 1 . 2]" 1
1609 1 32 TYR HB2 1 64 ILE HG12 4.700 . 5.600 4.654 2.954 5.538 . 0 0 "[ . 1 . 2]" 1
1610 1 32 TYR HB2 1 65 HIS H 4.300 . 5.200 4.169 3.746 4.462 . 0 0 "[ . 1 . 2]" 1
1611 1 32 TYR HB3 1 116 ASP HA 5.200 . 6.000 4.322 3.707 4.592 . 0 0 "[ . 1 . 2]" 1
1612 1 32 TYR HB3 1 64 ILE HA 4.900 . 5.900 3.705 3.245 4.105 . 0 0 "[ . 1 . 2]" 1
1613 1 32 TYR HB3 1 64 ILE MD 5.600 . 6.700 4.370 2.443 5.488 . 0 0 "[ . 1 . 2]" 1
1614 1 32 TYR HB3 1 64 ILE HG12 5.400 . 6.400 5.230 3.068 6.431 0.031 15 0 "[ . 1 . 2]" 1
1615 1 32 TYR HB3 1 64 ILE MG 6.400 . 6.700 4.493 2.426 5.955 . 0 0 "[ . 1 . 2]" 1
1616 1 32 TYR HB3 1 65 HIS H 4.700 . 5.600 4.558 4.032 4.962 . 0 0 "[ . 1 . 2]" 1
1617 1 32 TYR QD 1 115 LEU H 6.100 . 6.700 4.758 4.160 5.480 . 0 0 "[ . 1 . 2]" 1
1618 1 32 TYR QD 1 116 ASP H 6.200 . 6.700 4.488 4.210 5.098 . 0 0 "[ . 1 . 2]" 1
1619 1 32 TYR QD 1 116 ASP HA 4.200 . 5.100 2.072 1.770 2.429 0.030 7 0 "[ . 1 . 2]" 1
1620 1 32 TYR QD 1 116 ASP HB3 6.500 . 6.700 4.926 3.699 5.253 . 0 0 "[ . 1 . 2]" 1
1621 1 32 TYR QE 1 116 ASP H 6.200 . 6.700 5.189 4.454 6.399 . 0 0 "[ . 1 . 2]" 1
1622 1 32 TYR QE 1 116 ASP HA 4.000 . 4.900 2.705 2.181 3.738 . 0 0 "[ . 1 . 2]" 1
1623 1 32 TYR QE 1 116 ASP HB2 4.300 . 5.300 3.657 3.202 4.328 . 0 0 "[ . 1 . 2]" 1
1624 1 32 TYR QE 1 116 ASP HB3 4.000 . 4.900 4.770 3.783 4.966 0.066 7 0 "[ . 1 . 2]" 1
1625 1 32 TYR QE 1 122 ILE MD 5.300 . 6.600 3.427 1.988 5.374 . 0 0 "[ . 1 . 2]" 1
1626 1 32 TYR QE 1 141 LEU QD 5.500 . 6.500 3.344 2.652 4.331 . 0 0 "[ . 1 . 2]" 1
1627 1 32 TYR H 1 117 ARG HG2 4.600 . 5.500 2.778 2.287 3.337 . 0 0 "[ . 1 . 2]" 1
1628 1 32 TYR H 1 117 ARG HG3 3.900 . 4.700 3.708 2.725 4.707 0.007 15 0 "[ . 1 . 2]" 1
1629 1 32 TYR H 1 63 ASP HB2 4.300 . 5.200 4.913 3.764 5.352 0.152 2 0 "[ . 1 . 2]" 1
1630 1 32 TYR H 1 64 ILE H 4.300 . 5.200 4.807 4.249 5.188 . 0 0 "[ . 1 . 2]" 1
1631 1 32 TYR H 1 64 ILE HA 3.700 . 4.400 3.222 2.499 3.906 . 0 0 "[ . 1 . 2]" 1
1632 1 32 TYR H 1 65 HIS H 4.400 . 5.300 4.749 4.164 5.297 . 0 0 "[ . 1 . 2]" 1
1633 1 33 ILE HA 1 64 ILE MG 6.500 . 6.700 5.175 3.840 5.820 . 0 0 "[ . 1 . 2]" 1
1634 1 33 ILE HA 1 65 HIS H 3.800 . 4.600 2.636 2.237 3.047 . 0 0 "[ . 1 . 2]" 1
1635 1 33 ILE HA 1 65 HIS HB2 4.400 . 5.300 2.596 2.200 4.888 . 0 0 "[ . 1 . 2]" 1
1636 1 33 ILE HA 1 65 HIS HB3 4.600 . 5.500 4.202 3.788 5.646 0.146 17 0 "[ . 1 . 2]" 1
1637 1 33 ILE HB 1 115 LEU H 3.600 . 4.300 3.437 3.079 3.851 . 0 0 "[ . 1 . 2]" 1
1638 1 33 ILE HB 1 115 LEU HB3 4.700 . 5.600 3.720 3.339 4.624 . 0 0 "[ . 1 . 2]" 1
1639 1 33 ILE MD 1 65 HIS H 5.500 . 6.700 4.748 3.227 5.938 . 0 0 "[ . 1 . 2]" 1
1640 1 33 ILE MD 1 65 HIS HB2 6.500 . 6.700 3.691 1.814 6.453 . 0 0 "[ . 1 . 2]" 1
1641 1 33 ILE MG 1 115 LEU HB3 5.600 . 6.700 4.739 4.362 5.466 . 0 0 "[ . 1 . 2]" 1
1642 1 33 ILE MG 1 65 HIS HB2 5.800 . 6.700 2.934 1.967 4.927 . 0 0 "[ . 1 . 2]" 1
1643 1 33 ILE MG 1 65 HIS HB3 5.500 . 6.700 3.925 2.971 6.077 . 0 0 "[ . 1 . 2]" 1
1644 1 33 ILE H 1 114 LEU QD 5.100 . 6.200 3.751 3.410 4.761 . 0 0 "[ . 1 . 2]" 1
1645 1 33 ILE H 1 115 LEU H 3.500 . 4.200 3.242 2.951 3.527 . 0 0 "[ . 1 . 2]" 1
1646 1 33 ILE H 1 115 LEU HB3 4.500 . 5.500 4.721 4.256 5.609 0.109 12 0 "[ . 1 . 2]" 1
1647 1 34 TYR HA 1 114 LEU HA 4.200 . 5.000 2.392 2.141 2.547 . 0 0 "[ . 1 . 2]" 1
1648 1 34 TYR HA 1 114 LEU QD 5.000 . 6.100 2.650 2.319 3.546 . 0 0 "[ . 1 . 2]" 1
1649 1 34 TYR HA 1 115 LEU H 4.100 . 4.900 3.378 3.109 3.550 . 0 0 "[ . 1 . 2]" 1
1650 1 34 TYR HA 1 66 PHE QD 5.500 . 6.700 5.855 4.841 6.496 . 0 0 "[ . 1 . 2]" 1
1651 1 34 TYR HB2 1 138 PHE HZ 4.700 . 5.700 4.307 3.352 5.219 . 0 0 "[ . 1 . 2]" 1
1652 1 34 TYR HB2 1 64 ILE MG 4.800 . 5.900 4.662 2.378 5.980 0.080 20 0 "[ . 1 . 2]" 1
1653 1 34 TYR HB2 1 66 PHE HA 4.200 . 5.000 4.311 3.599 4.565 . 0 0 "[ . 1 . 2]" 1
1654 1 34 TYR HB2 1 66 PHE QD 4.400 . 5.400 4.489 3.296 5.069 . 0 0 "[ . 1 . 2]" 1
1655 1 34 TYR HB2 1 67 VAL H 5.100 . 6.100 5.207 4.865 5.487 . 0 0 "[ . 1 . 2]" 1
1656 1 34 TYR HB3 1 114 LEU QD 5.200 . 6.300 3.993 3.443 4.520 . 0 0 "[ . 1 . 2]" 1
1657 1 34 TYR HB3 1 138 PHE HZ 4.700 . 5.700 4.971 3.927 5.712 0.012 1 0 "[ . 1 . 2]" 1
1658 1 34 TYR HB3 1 64 ILE MD 5.900 . 6.700 4.017 2.449 6.842 0.142 8 0 "[ . 1 . 2]" 1
1659 1 34 TYR HB3 1 66 PHE HA 4.800 . 5.800 2.634 2.425 2.858 . 0 0 "[ . 1 . 2]" 1
1660 1 34 TYR HB3 1 66 PHE QD 4.800 . 5.900 3.197 1.960 4.005 . 0 0 "[ . 1 . 2]" 1
1661 1 34 TYR QD 1 112 PHE HB2 4.800 . 5.800 5.600 4.981 5.897 0.097 20 0 "[ . 1 . 2]" 1
1662 1 34 TYR QD 1 114 LEU HA 6.500 . 6.700 3.136 2.871 3.437 . 0 0 "[ . 1 . 2]" 1
1663 1 34 TYR QD 1 114 LEU HB2 3.900 . 4.800 2.901 2.295 3.394 . 0 0 "[ . 1 . 2]" 1
1664 1 34 TYR QD 1 126 MET ME 5.500 . 6.800 4.460 3.100 5.844 . 0 0 "[ . 1 . 2]" 1
1665 1 34 TYR QD 1 126 MET HG3 6.300 . 6.700 4.764 3.035 5.753 . 0 0 "[ . 1 . 2]" 1
1666 1 34 TYR QD 1 138 PHE HZ 4.800 . 5.900 3.811 2.868 4.507 . 0 0 "[ . 1 . 2]" 1
1667 1 34 TYR QD 1 64 ILE MG 5.700 . 7.000 5.601 3.786 6.714 . 0 0 "[ . 1 . 2]" 1
1668 1 34 TYR QD 1 66 PHE HA 5.800 . 6.700 3.040 1.905 4.216 . 0 0 "[ . 1 . 2]" 1
1669 1 34 TYR QD 1 66 PHE HB3 4.000 . 4.900 3.713 3.148 4.642 . 0 0 "[ . 1 . 2]" 1
1670 1 34 TYR QD 1 66 PHE QD 4.400 . 5.500 2.248 1.827 2.948 . 0 0 "[ . 1 . 2]" 1
1671 1 34 TYR QD 1 66 PHE QE 5.200 . 6.400 3.615 2.981 4.001 . 0 0 "[ . 1 . 2]" 1
1672 1 34 TYR QD 1 66 PHE HZ 4.900 . 6.000 5.505 4.787 6.005 0.005 5 0 "[ . 1 . 2]" 1
1673 1 34 TYR QE 1 112 PHE HB2 6.500 . 6.700 3.626 3.029 4.029 . 0 0 "[ . 1 . 2]" 1
1674 1 34 TYR QE 1 112 PHE HB3 6.400 . 6.700 3.226 2.428 3.994 . 0 0 "[ . 1 . 2]" 1
1675 1 34 TYR QE 1 113 ILE HA 4.400 . 5.300 4.918 4.515 5.308 0.008 19 0 "[ . 1 . 2]" 1
1676 1 34 TYR QE 1 114 LEU QD 5.000 . 6.200 3.829 2.859 4.561 . 0 0 "[ . 1 . 2]" 1
1677 1 34 TYR QE 1 126 MET QB 3.700 . 4.500 2.725 2.198 3.297 . 0 0 "[ . 1 . 2]" 1
1678 1 34 TYR QE 1 126 MET ME 4.900 . 6.100 4.191 1.785 5.836 0.015 10 0 "[ . 1 . 2]" 1
1679 1 34 TYR QE 1 126 MET HG2 3.400 . 4.200 3.195 1.792 4.256 0.056 10 0 "[ . 1 . 2]" 1
1680 1 34 TYR QE 1 126 MET HG3 3.800 . 4.700 3.582 1.855 4.769 0.069 10 0 "[ . 1 . 2]" 1
1681 1 34 TYR QE 1 127 THR H 4.900 . 5.900 3.683 2.627 4.660 . 0 0 "[ . 1 . 2]" 1
1682 1 34 TYR QE 1 134 THR MG 5.600 . 6.900 3.072 2.136 4.606 . 0 0 "[ . 1 . 2]" 1
1683 1 34 TYR QE 1 138 PHE HZ 4.900 . 6.000 3.942 3.222 4.629 . 0 0 "[ . 1 . 2]" 1
1684 1 34 TYR QE 1 52 LEU QD 5.200 . 6.400 3.775 2.254 5.643 . 0 0 "[ . 1 . 2]" 1
1685 1 34 TYR QE 1 52 LEU HG 4.900 . 5.900 4.520 2.966 5.933 0.033 12 0 "[ . 1 . 2]" 1
1686 1 34 TYR QE 1 66 PHE QD 5.800 . 7.200 3.575 2.728 4.312 . 0 0 "[ . 1 . 2]" 1
1687 1 34 TYR QE 1 66 PHE QE 5.400 . 6.700 4.255 3.348 4.857 . 0 0 "[ . 1 . 2]" 1
1688 1 34 TYR H 1 114 LEU QD 6.100 . 6.700 4.113 3.682 5.182 . 0 0 "[ . 1 . 2]" 1
1689 1 34 TYR H 1 65 HIS H 4.300 . 5.200 3.307 2.873 3.703 . 0 0 "[ . 1 . 2]" 1
1690 1 34 TYR H 1 65 HIS HB2 4.300 . 5.200 3.532 2.927 5.254 0.054 17 0 "[ . 1 . 2]" 1
1691 1 34 TYR H 1 66 PHE HA 3.700 . 4.400 3.340 2.534 3.878 . 0 0 "[ . 1 . 2]" 1
1692 1 34 TYR H 1 67 VAL HB 4.800 . 5.700 4.466 4.094 4.973 . 0 0 "[ . 1 . 2]" 1
1693 1 34 TYR H 1 67 VAL MG2 4.200 . 5.100 3.476 3.218 3.926 . 0 0 "[ . 1 . 2]" 1
1694 1 35 ILE HA 1 67 VAL HB 4.400 . 5.300 2.851 2.496 3.264 . 0 0 "[ . 1 . 2]" 1
1695 1 35 ILE HA 1 67 VAL MG1 6.500 . 6.700 3.835 3.463 4.025 . 0 0 "[ . 1 . 2]" 1
1696 1 35 ILE HA 1 67 VAL MG2 5.000 . 6.100 4.237 3.871 4.589 . 0 0 "[ . 1 . 2]" 1
1697 1 35 ILE HB 1 112 PHE HA 4.700 . 5.600 5.547 5.294 5.671 0.071 20 0 "[ . 1 . 2]" 1
1698 1 35 ILE MD 1 100 PHE HZ 4.800 . 5.900 4.786 3.811 5.947 0.047 5 0 "[ . 1 . 2]" 1
1699 1 35 ILE HG12 1 67 VAL H 4.400 . 5.200 4.467 3.803 5.215 0.015 9 0 "[ . 1 . 2]" 1
1700 1 35 ILE MG 1 100 PHE HZ 5.400 . 6.600 5.906 3.715 6.632 0.032 17 0 "[ . 1 . 2]" 1
1701 1 35 ILE MG 1 113 ILE MG 5.400 . 6.700 3.743 2.870 4.420 . 0 0 "[ . 1 . 2]" 1
1702 1 35 ILE MG 1 67 VAL H 6.100 . 6.700 4.867 4.481 5.314 . 0 0 "[ . 1 . 2]" 1
1703 1 35 ILE MG 1 68 SER HA 6.200 . 6.700 3.670 3.388 3.975 . 0 0 "[ . 1 . 2]" 1
1704 1 35 ILE MG 1 69 LEU HB3 5.200 . 6.300 3.625 2.437 4.855 . 0 0 "[ . 1 . 2]" 1
1705 1 35 ILE MG 1 69 LEU QD 5.700 . 7.000 2.701 1.784 3.284 0.016 5 0 "[ . 1 . 2]" 1
1706 1 35 ILE MG 1 69 LEU HG 4.100 . 5.000 3.936 2.020 5.068 0.068 8 0 "[ . 1 . 2]" 1
1707 1 35 ILE H 1 112 PHE HA 5.000 . 6.000 5.269 4.936 5.515 . 0 0 "[ . 1 . 2]" 1
1708 1 35 ILE H 1 113 ILE H 3.100 . 3.700 3.367 3.165 3.615 . 0 0 "[ . 1 . 2]" 1
1709 1 35 ILE H 1 113 ILE HB 3.600 . 4.300 3.218 2.849 4.415 0.115 6 0 "[ . 1 . 2]" 1
1710 1 35 ILE H 1 114 LEU HA 3.900 . 4.700 3.212 2.266 3.572 . 0 0 "[ . 1 . 2]" 1
1711 1 35 ILE H 1 114 LEU QD 5.400 . 6.600 4.195 3.946 4.583 . 0 0 "[ . 1 . 2]" 1
1712 1 35 ILE H 1 115 LEU H 4.700 . 5.600 4.512 4.258 4.718 . 0 0 "[ . 1 . 2]" 1
1713 1 35 ILE H 1 67 VAL MG2 4.900 . 6.000 5.538 5.178 5.910 . 0 0 "[ . 1 . 2]" 1
1714 1 36 ASP HA 1 112 PHE HA 3.900 . 4.700 2.955 2.585 3.248 . 0 0 "[ . 1 . 2]" 1
1715 1 36 ASP HB2 1 68 SER HA 3.600 . 4.300 4.198 3.102 4.535 0.235 4 0 "[ . 1 . 2]" 1
1716 1 36 ASP HB2 1 69 LEU H 4.400 . 5.300 5.353 4.784 5.527 0.227 5 0 "[ . 1 . 2]" 1
1717 1 36 ASP HB3 1 52 LEU QD 6.500 . 6.700 3.374 2.154 5.264 . 0 0 "[ . 1 . 2]" 1
1718 1 36 ASP HB3 1 68 SER HA 4.000 . 4.800 3.841 2.698 4.893 0.093 4 0 "[ . 1 . 2]" 1
1719 1 36 ASP H 1 67 VAL MG2 4.600 . 5.600 5.365 4.985 5.653 0.053 5 0 "[ . 1 . 2]" 1
1720 1 36 ASP H 1 68 SER HA 3.100 . 3.700 2.474 2.029 2.963 . 0 0 "[ . 1 . 2]" 1
1721 1 36 ASP H 1 69 LEU H 3.800 . 4.600 3.712 3.222 4.157 . 0 0 "[ . 1 . 2]" 1
1722 1 37 VAL HA 1 69 LEU H 3.900 . 4.700 2.487 2.231 2.721 . 0 0 "[ . 1 . 2]" 1
1723 1 37 VAL HA 1 69 LEU HB3 4.500 . 5.400 3.995 3.110 5.082 . 0 0 "[ . 1 . 2]" 1
1724 1 37 VAL HA 1 69 LEU QD 6.500 . 6.700 4.599 4.284 4.830 . 0 0 "[ . 1 . 2]" 1
1725 1 37 VAL HA 1 94 MET ME 6.400 . 6.700 6.011 5.540 6.497 . 0 0 "[ . 1 . 2]" 1
1726 1 37 VAL HB 1 111 ARG H 3.100 . 3.700 1.876 1.704 2.178 0.096 14 0 "[ . 1 . 2]" 1
1727 1 37 VAL MG1 1 101 MET QG 5.400 . 6.600 4.815 3.838 6.007 . 0 0 "[ . 1 . 2]" 1
1728 1 37 VAL MG1 1 109 ILE HA 4.400 . 5.400 3.904 3.389 4.331 . 0 0 "[ . 1 . 2]" 1
1729 1 37 VAL MG1 1 109 ILE MG 5.100 . 6.300 1.839 1.749 2.048 0.051 9 0 "[ . 1 . 2]" 1
1730 1 37 VAL MG1 1 110 PRO HA 6.500 . 6.700 3.242 2.928 3.487 . 0 0 "[ . 1 . 2]" 1
1731 1 37 VAL MG1 1 111 ARG H 6.500 . 6.700 3.541 3.283 3.852 . 0 0 "[ . 1 . 2]" 1
1732 1 37 VAL MG1 1 69 LEU H 5.000 . 6.000 4.132 3.970 4.380 . 0 0 "[ . 1 . 2]" 1
1733 1 37 VAL MG1 1 70 SER HA 6.500 . 6.700 2.950 2.613 3.447 . 0 0 "[ . 1 . 2]" 1
1734 1 37 VAL MG1 1 71 CYS H 5.600 . 6.700 2.895 2.402 3.180 . 0 0 "[ . 1 . 2]" 1
1735 1 37 VAL MG1 1 71 CYS HA 6.500 . 6.700 4.930 4.446 5.454 . 0 0 "[ . 1 . 2]" 1
1736 1 37 VAL MG1 1 94 MET ME 4.700 . 5.800 4.361 3.881 4.834 . 0 0 "[ . 1 . 2]" 1
1737 1 37 VAL MG2 1 111 ARG H 5.700 . 6.700 2.366 2.012 2.836 . 0 0 "[ . 1 . 2]" 1
1738 1 37 VAL MG2 1 69 LEU H 5.800 . 6.700 3.804 3.585 3.990 . 0 0 "[ . 1 . 2]" 1
1739 1 37 VAL H 1 111 ARG H 3.600 . 4.300 2.541 2.132 2.966 . 0 0 "[ . 1 . 2]" 1
1740 1 37 VAL H 1 111 ARG HB2 4.200 . 5.200 4.459 4.092 4.950 . 0 0 "[ . 1 . 2]" 1
1741 1 37 VAL H 1 112 PHE HA 4.300 . 5.200 4.371 3.946 4.656 . 0 0 "[ . 1 . 2]" 1
1742 1 38 TRP HA 1 109 ILE HB 4.400 . 5.400 5.486 5.351 5.618 0.218 9 0 "[ . 1 . 2]" 1
1743 1 38 TRP HA 1 109 ILE MG 5.700 . 6.700 5.289 2.775 6.202 . 0 0 "[ . 1 . 2]" 1
1744 1 38 TRP HA 1 110 PRO HA 4.400 . 5.300 4.878 4.470 5.334 0.034 7 0 "[ . 1 . 2]" 1
1745 1 38 TRP HA 1 110 PRO QG 5.100 . 6.000 4.879 3.937 5.669 . 0 0 "[ . 1 . 2]" 1
1746 1 38 TRP HD1 1 68 SER HA 4.200 . 5.000 3.924 3.699 4.133 . 0 0 "[ . 1 . 2]" 1
1747 1 38 TRP HD1 1 68 SER QB 3.500 . 4.200 2.699 2.397 3.169 . 0 0 "[ . 1 . 2]" 1
1748 1 38 TRP HD1 1 69 LEU H 3.200 . 3.800 2.780 2.307 3.174 . 0 0 "[ . 1 . 2]" 1
1749 1 38 TRP HD1 1 70 SER HA 3.600 . 4.300 2.973 2.699 3.259 . 0 0 "[ . 1 . 2]" 1
1750 1 38 TRP HE1 1 68 SER QB 3.400 . 4.100 3.433 2.817 3.913 . 0 0 "[ . 1 . 2]" 1
1751 1 38 TRP HE1 1 69 LEU H 4.600 . 5.500 4.071 3.371 4.450 . 0 0 "[ . 1 . 2]" 1
1752 1 38 TRP HE1 1 70 SER H 5.100 . 6.000 2.351 2.210 2.642 . 0 0 "[ . 1 . 2]" 1
1753 1 38 TRP HE1 1 70 SER HB2 4.800 . 5.800 2.984 2.604 3.480 . 0 0 "[ . 1 . 2]" 1
1754 1 38 TRP HE1 1 70 SER HB3 4.800 . 5.800 2.759 2.285 4.653 . 0 0 "[ . 1 . 2]" 1
1755 1 38 TRP HE1 1 78 TRP HD1 5.300 . 6.300 5.552 4.996 6.290 . 0 0 "[ . 1 . 2]" 1
1756 1 38 TRP HE1 1 78 TRP HZ2 4.400 . 5.400 4.977 4.583 5.431 0.031 8 0 "[ . 1 . 2]" 1
1757 1 38 TRP HH2 1 82 VAL HB 4.300 . 5.200 3.799 3.342 4.610 . 0 0 "[ . 1 . 2]" 1
1758 1 38 TRP HH2 1 82 VAL MG1 5.300 . 6.500 2.615 2.167 2.985 . 0 0 "[ . 1 . 2]" 1
1759 1 38 TRP HH2 1 91 GLN HB3 4.100 . 4.900 3.899 2.744 4.786 . 0 0 "[ . 1 . 2]" 1
1760 1 38 TRP HH2 1 91 GLN QG 4.300 . 5.200 3.268 2.584 5.069 . 0 0 "[ . 1 . 2]" 1
1761 1 38 TRP HH2 1 92 LEU HA 4.700 . 5.600 5.545 4.907 5.732 0.132 1 0 "[ . 1 . 2]" 1
1762 1 38 TRP HH2 1 93 HIS HB3 5.100 . 6.100 5.812 5.149 6.144 0.044 11 0 "[ . 1 . 2]" 1
1763 1 38 TRP H 1 109 ILE MG 6.500 . 6.700 5.084 3.645 5.688 . 0 0 "[ . 1 . 2]" 1
1764 1 38 TRP H 1 69 LEU H 4.000 . 4.800 3.164 2.871 3.488 . 0 0 "[ . 1 . 2]" 1
1765 1 38 TRP H 1 69 LEU HB2 4.700 . 5.600 5.209 4.526 5.646 0.046 8 0 "[ . 1 . 2]" 1
1766 1 38 TRP H 1 70 SER HA 2.600 . 3.100 3.023 2.814 3.200 0.100 16 0 "[ . 1 . 2]" 1
1767 1 38 TRP H 1 94 MET ME 5.700 . 6.700 6.565 5.694 6.787 0.087 1 0 "[ . 1 . 2]" 1
1768 1 38 TRP HZ2 1 78 TRP HE1 5.200 . 6.000 3.459 3.011 3.973 . 0 0 "[ . 1 . 2]" 1
1769 1 38 TRP HZ2 1 82 VAL MG1 6.100 . 6.700 4.613 4.187 5.074 . 0 0 "[ . 1 . 2]" 1
1770 1 38 TRP HZ2 1 82 VAL MG2 6.500 . 6.700 4.779 4.494 5.092 . 0 0 "[ . 1 . 2]" 1
1771 1 38 TRP HZ2 1 91 GLN HA 4.300 . 5.200 4.181 3.730 4.429 . 0 0 "[ . 1 . 2]" 1
1772 1 38 TRP HZ2 1 91 GLN HB2 4.000 . 4.800 2.861 2.353 3.789 . 0 0 "[ . 1 . 2]" 1
1773 1 38 TRP HZ2 1 91 GLN QG 4.500 . 5.400 3.904 3.219 4.995 . 0 0 "[ . 1 . 2]" 1
1774 1 38 TRP HZ2 1 92 LEU HA 4.200 . 5.000 3.723 3.175 3.975 . 0 0 "[ . 1 . 2]" 1
1775 1 38 TRP HZ2 1 93 HIS HB3 5.000 . 6.000 4.362 3.851 4.712 . 0 0 "[ . 1 . 2]" 1
1776 1 38 TRP HZ2 1 93 HIS HD2 5.100 . 6.000 5.227 4.853 5.586 . 0 0 "[ . 1 . 2]" 1
1777 1 39 ALA HA 1 70 SER HA 4.200 . 5.000 4.149 3.843 4.419 . 0 0 "[ . 1 . 2]" 1
1778 1 39 ALA HA 1 72 ASP H 4.100 . 4.900 4.366 4.190 4.793 . 0 0 "[ . 1 . 2]" 1
1779 1 39 ALA HA 1 72 ASP HA 4.600 . 5.500 5.120 4.471 5.452 . 0 0 "[ . 1 . 2]" 1
1780 1 39 ALA MB 1 70 SER HA 6.500 . 6.700 3.869 3.646 4.009 . 0 0 "[ . 1 . 2]" 1
1781 1 39 ALA MB 1 71 CYS HA 6.500 . 6.700 5.741 5.337 6.096 . 0 0 "[ . 1 . 2]" 1
1782 1 39 ALA MB 1 72 ASP HA 4.700 . 5.700 4.126 3.317 4.486 . 0 0 "[ . 1 . 2]" 1
1783 1 39 ALA MB 1 93 HIS HD2 6.500 . 6.700 6.057 5.607 6.303 . 0 0 "[ . 1 . 2]" 1
1784 1 39 ALA H 1 109 ILE MD 4.000 . 4.900 4.341 3.713 4.824 . 0 0 "[ . 1 . 2]" 1
1785 1 39 ALA H 1 45 CYS HB2 4.200 . 5.200 4.597 3.540 5.341 0.141 15 0 "[ . 1 . 2]" 1
1786 1 40 THR HA 1 78 TRP HH2 4.100 . 4.900 3.981 3.503 4.480 . 0 0 "[ . 1 . 2]" 1
1787 1 40 THR HA 1 78 TRP HZ3 3.200 . 3.800 2.706 2.207 3.069 . 0 0 "[ . 1 . 2]" 1
1788 1 40 THR HA 1 81 MET ME 4.400 . 5.400 3.589 2.394 4.513 . 0 0 "[ . 1 . 2]" 1
1789 1 40 THR HB 1 81 MET ME 5.000 . 6.100 4.133 3.205 5.898 . 0 0 "[ . 1 . 2]" 1
1790 1 40 THR MG 1 72 ASP HB2 6.500 . 6.700 4.360 2.602 6.004 . 0 0 "[ . 1 . 2]" 1
1791 1 40 THR MG 1 72 ASP HB3 6.500 . 6.700 3.817 3.041 5.196 . 0 0 "[ . 1 . 2]" 1
1792 1 40 THR MG 1 74 ASN H 5.700 . 6.700 4.959 4.109 6.391 . 0 0 "[ . 1 . 2]" 1
1793 1 40 THR MG 1 74 ASN HD22 4.900 . 6.000 2.862 1.801 4.650 . 0 0 "[ . 1 . 2]" 1
1794 1 40 THR MG 1 78 TRP H 3.800 . 4.700 4.327 3.858 4.632 . 0 0 "[ . 1 . 2]" 1
1795 1 40 THR MG 1 78 TRP HA 4.100 . 5.000 3.140 2.681 3.479 . 0 0 "[ . 1 . 2]" 1
1796 1 40 THR MG 1 78 TRP HB2 5.500 . 6.700 3.243 2.646 3.716 . 0 0 "[ . 1 . 2]" 1
1797 1 40 THR MG 1 78 TRP HB3 4.900 . 6.000 4.646 4.100 5.021 . 0 0 "[ . 1 . 2]" 1
1798 1 40 THR MG 1 78 TRP HD1 5.000 . 6.000 5.607 4.876 6.096 0.096 16 0 "[ . 1 . 2]" 1
1799 1 40 THR MG 1 78 TRP HH2 4.300 . 5.300 5.283 4.959 5.463 0.163 17 0 "[ . 1 . 2]" 1
1800 1 40 THR MG 1 78 TRP HZ2 6.500 . 6.700 5.911 5.550 6.262 . 0 0 "[ . 1 . 2]" 1
1801 1 40 THR MG 1 78 TRP HZ3 4.200 . 5.100 3.807 2.976 4.450 . 0 0 "[ . 1 . 2]" 1
1802 1 40 THR MG 1 81 MET H 4.700 . 5.700 5.365 4.511 5.757 0.057 19 0 "[ . 1 . 2]" 1
1803 1 40 THR MG 1 81 MET HB2 6.200 . 6.700 4.260 2.819 5.061 . 0 0 "[ . 1 . 2]" 1
1804 1 40 THR MG 1 81 MET HB3 4.600 . 5.600 4.117 2.979 4.703 . 0 0 "[ . 1 . 2]" 1
1805 1 40 THR H 1 74 ASN HD21 4.200 . 5.200 5.208 4.903 5.346 0.146 8 0 "[ . 1 . 2]" 1
1806 1 41 TRP HD1 1 72 ASP HA 3.700 . 4.400 3.696 2.542 4.437 0.037 17 0 "[ . 1 . 2]" 1
1807 1 41 TRP HE1 1 109 ILE MD 4.500 . 5.500 4.336 3.546 5.448 . 0 0 "[ . 1 . 2]" 1
1808 1 41 TRP HE1 1 72 ASP HA 3.400 . 4.100 1.942 1.469 2.263 0.331 10 0 "[ . 1 . 2]" 1
1809 1 41 TRP HH2 1 109 ILE MD 4.700 . 5.600 2.970 2.337 3.907 . 0 0 "[ . 1 . 2]" 1
1810 1 41 TRP HH2 1 109 ILE HG12 4.700 . 5.600 3.720 2.779 5.200 . 0 0 "[ . 1 . 2]" 1
1811 1 41 TRP HH2 1 109 ILE HG13 4.100 . 4.900 4.254 3.503 4.946 0.046 19 0 "[ . 1 . 2]" 1
1812 1 41 TRP HH2 1 109 ILE MG 6.500 . 6.700 4.443 3.444 5.972 . 0 0 "[ . 1 . 2]" 1
1813 1 41 TRP HH2 1 71 CYS HB2 4.800 . 5.800 4.425 3.682 5.806 0.006 11 0 "[ . 1 . 2]" 1
1814 1 41 TRP HH2 1 71 CYS HB3 4.600 . 5.500 4.993 3.928 5.577 0.077 3 0 "[ . 1 . 2]" 1
1815 1 41 TRP HH2 1 72 ASP HA 4.900 . 5.900 6.023 5.955 6.236 0.336 10 0 "[ . 1 . 2]" 1
1816 1 41 TRP H 1 109 ILE MD 4.100 . 5.000 4.837 4.429 5.023 0.023 19 0 "[ . 1 . 2]" 1
1817 1 41 TRP HZ2 1 101 MET ME 6.300 . 6.700 4.653 3.508 6.019 . 0 0 "[ . 1 . 2]" 1
1818 1 41 TRP HZ2 1 101 MET QG 4.900 . 5.900 5.884 5.675 6.031 0.131 10 0 "[ . 1 . 2]" 1
1819 1 41 TRP HZ2 1 109 ILE MD 5.300 . 6.500 3.172 2.525 4.659 . 0 0 "[ . 1 . 2]" 1
1820 1 41 TRP HZ2 1 109 ILE HG12 4.600 . 5.600 4.727 3.599 5.673 0.073 1 0 "[ . 1 . 2]" 1
1821 1 41 TRP HZ2 1 109 ILE HG13 4.300 . 5.300 5.323 4.668 5.496 0.196 3 0 "[ . 1 . 2]" 1
1822 1 41 TRP HZ2 1 71 CYS HB3 4.200 . 5.000 3.738 2.425 4.773 . 0 0 "[ . 1 . 2]" 1
1823 1 42 CYS HA 1 109 ILE MD 6.400 . 6.700 3.876 2.115 5.270 . 0 0 "[ . 1 . 2]" 1
1824 1 42 CYS HB2 1 109 ILE MD 5.200 . 6.300 3.295 1.778 4.566 0.022 14 0 "[ . 1 . 2]" 1
1825 1 42 CYS H 1 109 ILE MD 4.700 . 5.700 4.429 3.857 5.138 . 0 0 "[ . 1 . 2]" 1
1826 1 43 GLY HA2 1 81 MET ME 6.500 . 6.700 6.272 4.939 6.792 0.092 15 0 "[ . 1 . 2]" 1
1827 1 45 CYS HA 1 110 PRO QG 3.600 . 4.300 2.456 1.869 3.674 . 0 0 "[ . 1 . 2]" 1
1828 1 45 CYS H 1 110 PRO QG 3.600 . 4.300 3.910 1.991 4.373 0.073 1 0 "[ . 1 . 2]" 1
1829 1 46 ARG HA 1 110 PRO QG 5.100 . 6.100 6.112 5.496 6.299 0.199 17 0 "[ . 1 . 2]" 1
1830 1 46 ARG HD2 1 81 MET ME 4.100 . 5.000 3.672 2.271 5.069 0.069 12 0 "[ . 1 . 2]" 1
1831 1 46 ARG HD3 1 81 MET ME 4.200 . 5.100 4.213 3.511 5.148 0.048 4 0 "[ . 1 . 2]" 1
1832 1 46 ARG HE 1 81 MET ME 4.400 . 5.400 3.245 1.822 4.983 . 0 0 "[ . 1 . 2]" 1
1833 1 46 ARG HE 1 81 MET HG3 3.600 . 4.400 4.358 3.859 4.578 0.178 19 0 "[ . 1 . 2]" 1
1834 1 49 LEU HB2 1 87 LEU QD 5.500 . 6.000 3.194 1.784 4.911 0.016 4 0 "[ . 1 . 2]" 1
1835 1 51 ALA MB 1 130 SER H 5.200 . 6.300 4.137 2.148 5.466 . 0 0 "[ . 1 . 2]" 1
1836 1 52 LEU HA 1 66 PHE QD 5.300 . 6.500 5.295 4.133 6.552 0.052 9 0 "[ . 1 . 2]" 1
1837 1 52 LEU QD 1 66 PHE QD 6.100 . 7.400 3.479 2.093 4.910 . 0 0 "[ . 1 . 2]" 1
1838 1 55 LEU HB2 1 66 PHE HZ 3.900 . 4.700 4.590 3.628 4.796 0.096 15 0 "[ . 1 . 2]" 1
1839 1 55 LEU HB3 1 66 PHE HZ 3.900 . 4.700 3.162 2.213 4.087 . 0 0 "[ . 1 . 2]" 1
1840 1 55 LEU QD 1 129 PRO HA 4.600 . 5.600 2.943 1.792 5.054 0.008 19 0 "[ . 1 . 2]" 1
1841 1 55 LEU QD 1 129 PRO HB3 6.400 . 6.700 3.141 1.789 6.081 0.011 11 0 "[ . 1 . 2]" 1
1842 1 55 LEU QD 1 129 PRO HG2 6.500 . 6.700 4.844 3.669 6.455 . 0 0 "[ . 1 . 2]" 1
1843 1 55 LEU QD 1 134 THR HB 6.500 . 6.700 3.812 2.196 6.112 . 0 0 "[ . 1 . 2]" 1
1844 1 55 LEU QD 1 134 THR MG 5.300 . 6.600 3.474 2.514 4.932 . 0 0 "[ . 1 . 2]" 1
1845 1 55 LEU QD 1 135 ALA H 5.400 . 6.600 3.796 2.942 4.664 . 0 0 "[ . 1 . 2]" 1
1846 1 55 LEU QD 1 135 ALA MB 6.100 . 7.000 2.329 1.770 3.310 0.030 13 0 "[ . 1 . 2]" 1
1847 1 55 LEU QD 1 138 PHE QD 5.500 . 6.800 2.809 1.554 3.920 0.246 4 0 "[ . 1 . 2]" 1
1848 1 55 LEU QD 1 135 ALA HA 5.600 . 6.900 3.007 2.498 3.777 . 0 0 "[ . 1 . 2]" 1
1849 1 55 LEU QD 1 138 PHE HZ 5.700 . 7.000 3.269 2.453 4.676 . 0 0 "[ . 1 . 2]" 1
1850 1 55 LEU QD 1 66 PHE HZ 5.000 . 6.000 2.752 1.706 4.088 0.094 13 0 "[ . 1 . 2]" 1
1851 1 56 GLU HA 1 66 PHE QD 6.300 . 6.700 2.942 2.087 3.965 . 0 0 "[ . 1 . 2]" 1
1852 1 56 GLU HA 1 66 PHE QE 5.500 . 6.700 2.700 1.766 3.936 0.034 1 0 "[ . 1 . 2]" 1
1853 1 56 GLU HA 1 66 PHE HZ 4.400 . 5.300 4.108 3.304 5.321 0.021 2 0 "[ . 1 . 2]" 1
1854 1 58 LYS HB3 1 138 PHE QD 5.600 . 6.600 6.122 5.480 6.685 0.085 15 0 "[ . 1 . 2]" 1
1855 1 59 TYR HB2 1 66 PHE HZ 4.600 . 5.600 3.079 2.142 3.848 . 0 0 "[ . 1 . 2]" 1
1856 1 59 TYR HB3 1 66 PHE HZ 3.800 . 4.600 4.092 2.997 4.700 0.100 4 0 "[ . 1 . 2]" 1
1857 1 59 TYR QD 1 138 PHE HB2 4.200 . 5.000 3.856 2.612 4.642 . 0 0 "[ . 1 . 2]" 1
1858 1 59 TYR QD 1 138 PHE QD 6.100 . 7.400 3.567 2.620 4.118 . 0 0 "[ . 1 . 2]" 1
1859 1 59 TYR QE 1 135 ALA HA 4.400 . 5.400 3.632 2.812 4.233 . 0 0 "[ . 1 . 2]" 1
1860 1 59 TYR QE 1 135 ALA MB 5.100 . 6.300 3.034 1.754 3.926 0.046 5 0 "[ . 1 . 2]" 1
1861 1 59 TYR QE 1 138 PHE H 5.200 . 6.300 4.989 4.573 5.389 . 0 0 "[ . 1 . 2]" 1
1862 1 59 TYR QE 1 138 PHE HB3 4.700 . 5.700 3.373 2.615 4.676 . 0 0 "[ . 1 . 2]" 1
1863 1 59 TYR QE 1 138 PHE QD 5.300 . 6.600 2.912 2.208 3.296 . 0 0 "[ . 1 . 2]" 1
1864 1 59 TYR QE 1 139 ASN H 5.500 . 6.700 3.483 2.785 4.217 . 0 0 "[ . 1 . 2]" 1
1865 1 59 TYR QE 1 139 ASN HA 4.500 . 5.500 3.362 2.419 4.125 . 0 0 "[ . 1 . 2]" 1
1866 1 59 TYR QE 1 139 ASN HB2 4.400 . 5.400 4.556 3.189 5.525 0.125 13 0 "[ . 1 . 2]" 1
1867 1 59 TYR QE 1 142 LEU QD 6.900 . 7.400 3.679 2.543 5.339 . 0 0 "[ . 1 . 2]" 1
1868 1 59 TYR QE 1 144 LEU QD 5.600 . 6.900 3.349 2.293 4.549 . 0 0 "[ . 1 . 2]" 1
1869 1 62 LYS HA 1 142 LEU QD 6.300 . 6.700 3.514 2.545 4.102 . 0 0 "[ . 1 . 2]" 1
1870 1 62 LYS HB3 1 142 LEU QD 5.900 . 6.700 2.286 1.751 3.058 0.049 12 0 "[ . 1 . 2]" 1
1871 1 62 LYS H 1 142 LEU QD 5.400 . 6.600 4.764 3.553 5.751 . 0 0 "[ . 1 . 2]" 1
1872 1 63 ASP HB2 1 142 LEU QD 5.300 . 6.500 2.632 1.792 3.496 0.008 10 0 "[ . 1 . 2]" 1
1873 1 63 ASP H 1 142 LEU QD 4.300 . 5.300 2.307 1.655 3.332 0.145 4 0 "[ . 1 . 2]" 1
1874 1 64 ILE MD 1 114 LEU QD 6.300 . 7.400 3.756 2.667 5.234 . 0 0 "[ . 1 . 2]" 1
1875 1 64 ILE MD 1 138 PHE HA 6.500 . 6.700 3.860 2.878 4.911 . 0 0 "[ . 1 . 2]" 1
1876 1 64 ILE MD 1 138 PHE QD 6.200 . 7.400 3.132 2.682 3.925 . 0 0 "[ . 1 . 2]" 1
1877 1 64 ILE MD 1 138 PHE HZ 5.900 . 6.700 4.466 2.936 6.561 . 0 0 "[ . 1 . 2]" 1
1878 1 64 ILE MD 1 139 ASN H 6.400 . 6.700 5.907 4.837 6.746 0.046 2 0 "[ . 1 . 2]" 1
1879 1 64 ILE H 1 142 LEU QD 4.700 . 5.700 4.286 3.333 5.091 . 0 0 "[ . 1 . 2]" 1
1880 1 66 PHE HA 1 114 LEU QD 6.500 . 6.700 5.969 5.669 6.539 . 0 0 "[ . 1 . 2]" 1
1881 1 66 PHE QD 1 89 GLY HA2 5.100 . 6.200 5.657 4.222 6.333 0.133 1 0 "[ . 1 . 2]" 1
1882 1 66 PHE QD 1 89 GLY HA3 5.100 . 6.200 5.535 4.594 6.205 0.005 4 0 "[ . 1 . 2]" 1
1883 1 66 PHE QE 1 138 PHE HZ 5.300 . 6.500 3.431 2.416 5.201 . 0 0 "[ . 1 . 2]" 1
1884 1 66 PHE H 1 90 ILE MD 5.200 . 6.300 4.321 2.679 6.305 0.005 14 0 "[ . 1 . 2]" 1
1885 1 66 PHE HZ 1 114 LEU QD 6.200 . 6.700 6.406 5.981 6.507 . 0 0 "[ . 1 . 2]" 1
1886 1 67 VAL HA 1 90 ILE HB 2.800 . 3.400 2.570 2.241 2.937 . 0 0 "[ . 1 . 2]" 1
1887 1 67 VAL HA 1 90 ILE MD 5.700 . 6.700 4.533 3.800 5.505 . 0 0 "[ . 1 . 2]" 1
1888 1 67 VAL HA 1 90 ILE HG12 4.600 . 5.500 5.288 4.515 5.547 0.047 16 0 "[ . 1 . 2]" 1
1889 1 67 VAL HA 1 90 ILE MG 4.900 . 6.000 3.124 2.666 3.605 . 0 0 "[ . 1 . 2]" 1
1890 1 67 VAL MG1 1 90 ILE H 5.900 . 6.700 5.232 4.616 5.653 . 0 0 "[ . 1 . 2]" 1
1891 1 67 VAL MG1 1 90 ILE HB 5.300 . 6.500 3.424 2.702 4.093 . 0 0 "[ . 1 . 2]" 1
1892 1 67 VAL MG1 1 90 ILE MG 5.900 . 7.300 2.419 1.898 3.184 . 0 0 "[ . 1 . 2]" 1
1893 1 67 VAL MG1 1 91 GLN H 6.200 . 6.700 4.788 4.200 5.489 . 0 0 "[ . 1 . 2]" 1
1894 1 67 VAL MG1 1 92 LEU H 6.200 . 6.700 3.453 3.087 3.818 . 0 0 "[ . 1 . 2]" 1
1895 1 68 SER QB 1 78 TRP HZ2 4.500 . 5.500 4.900 4.540 5.493 . 0 0 "[ . 1 . 2]" 1
1896 1 68 SER QB 1 91 GLN HA 3.200 . 3.800 2.552 2.042 3.556 . 0 0 "[ . 1 . 2]" 1
1897 1 68 SER QB 1 91 GLN HE21 4.300 . 5.200 3.840 3.374 5.210 0.010 9 0 "[ . 1 . 2]" 1
1898 1 68 SER QB 1 91 GLN HE22 4.000 . 4.800 4.547 3.005 4.964 0.164 6 0 "[ . 1 . 2]" 1
1899 1 68 SER QB 1 92 LEU H 4.300 . 5.200 3.587 2.995 4.232 . 0 0 "[ . 1 . 2]" 1
1900 1 68 SER H 1 90 ILE H 4.200 . 5.200 4.504 3.919 4.913 . 0 0 "[ . 1 . 2]" 1
1901 1 68 SER H 1 90 ILE HB 3.700 . 4.400 4.096 3.763 4.410 0.010 1 0 "[ . 1 . 2]" 1
1902 1 68 SER H 1 90 ILE MG 5.700 . 6.700 4.022 3.671 4.393 . 0 0 "[ . 1 . 2]" 1
1903 1 68 SER H 1 92 LEU H 4.000 . 4.800 3.544 3.126 3.872 . 0 0 "[ . 1 . 2]" 1
1904 1 69 LEU HA 1 92 LEU H 4.200 . 5.000 3.281 3.017 3.572 . 0 0 "[ . 1 . 2]" 1
1905 1 69 LEU HB2 1 93 HIS HA 4.900 . 5.900 6.013 5.964 6.083 0.183 8 0 "[ . 1 . 2]" 1
1906 1 69 LEU HB3 1 94 MET ME 6.100 . 6.700 3.833 2.825 4.550 . 0 0 "[ . 1 . 2]" 1
1907 1 69 LEU QD 1 92 LEU HB2 4.600 . 5.600 2.338 1.741 3.920 0.059 12 0 "[ . 1 . 2]" 1
1908 1 69 LEU QD 1 92 LEU HB3 5.000 . 6.100 3.201 2.454 5.052 . 0 0 "[ . 1 . 2]" 1
1909 1 69 LEU QD 1 92 LEU QD 5.100 . 6.300 2.731 1.950 3.532 . 0 0 "[ . 1 . 2]" 1
1910 1 69 LEU QD 1 93 HIS H 5.300 . 6.300 4.126 3.602 5.226 . 0 0 "[ . 1 . 2]" 1
1911 1 69 LEU QD 1 94 MET HG3 5.800 . 6.700 4.407 3.498 5.806 . 0 0 "[ . 1 . 2]" 1
1912 1 69 LEU QD 1 100 PHE QE 6.200 . 7.400 3.109 2.441 4.046 . 0 0 "[ . 1 . 2]" 1
1913 1 69 LEU QD 1 100 PHE HZ 6.200 . 6.700 4.736 3.959 5.535 . 0 0 "[ . 1 . 2]" 1
1914 1 70 SER HA 1 109 ILE MG 6.500 . 6.700 5.337 4.778 5.826 . 0 0 "[ . 1 . 2]" 1
1915 1 70 SER HA 1 93 HIS HA 4.700 . 5.600 4.463 4.249 4.631 . 0 0 "[ . 1 . 2]" 1
1916 1 70 SER HA 1 93 HIS HD2 4.100 . 4.900 4.631 4.107 4.905 0.005 1 0 "[ . 1 . 2]" 1
1917 1 70 SER HA 1 94 MET ME 6.500 . 6.700 5.009 4.133 5.590 . 0 0 "[ . 1 . 2]" 1
1918 1 70 SER HB2 1 78 TRP HD1 3.700 . 4.400 3.879 3.554 4.230 . 0 0 "[ . 1 . 2]" 1
1919 1 70 SER HB2 1 78 TRP HZ2 3.900 . 4.700 3.522 3.170 4.792 0.092 9 0 "[ . 1 . 2]" 1
1920 1 70 SER HB2 1 93 HIS HA 3.700 . 4.400 3.801 2.070 4.279 . 0 0 "[ . 1 . 2]" 1
1921 1 70 SER HB2 1 93 HIS HD2 3.500 . 4.300 3.572 2.240 3.802 . 0 0 "[ . 1 . 2]" 1
1922 1 70 SER HB3 1 78 TRP HD1 3.300 . 4.000 3.453 3.088 3.703 . 0 0 "[ . 1 . 2]" 1
1923 1 70 SER HB3 1 78 TRP HE1 5.500 . 6.000 2.578 2.456 2.904 . 0 0 "[ . 1 . 2]" 1
1924 1 70 SER HB3 1 78 TRP HZ2 3.900 . 4.700 4.811 4.488 4.885 0.185 11 0 "[ . 1 . 2]" 1
1925 1 70 SER HB3 1 93 HIS HA 4.200 . 5.000 2.303 1.845 3.750 . 0 0 "[ . 1 . 2]" 1
1926 1 70 SER HB3 1 93 HIS HB3 4.700 . 5.600 4.486 4.042 5.610 0.010 9 0 "[ . 1 . 2]" 1
1927 1 70 SER HB3 1 93 HIS HD2 2.700 . 3.200 2.530 1.912 2.774 . 0 0 "[ . 1 . 2]" 1
1928 1 70 SER H 1 93 HIS HA 3.400 . 4.100 2.228 1.939 2.408 . 0 0 "[ . 1 . 2]" 1
1929 1 71 CYS HA 1 101 MET ME 6.500 . 6.700 5.683 4.456 6.745 0.045 3 0 "[ . 1 . 2]" 1
1930 1 71 CYS HA 1 94 MET HB2 4.500 . 5.400 3.977 3.339 4.422 . 0 0 "[ . 1 . 2]" 1
1931 1 71 CYS HA 1 94 MET ME 4.100 . 5.000 3.063 1.859 4.094 . 0 0 "[ . 1 . 2]" 1
1932 1 71 CYS HB2 1 101 MET ME 4.700 . 5.700 3.927 2.843 5.417 . 0 0 "[ . 1 . 2]" 1
1933 1 71 CYS HB2 1 109 ILE MD 6.500 . 6.700 4.110 2.379 6.726 0.026 15 0 "[ . 1 . 2]" 1
1934 1 71 CYS HB2 1 94 MET ME 4.400 . 5.400 4.007 1.972 5.136 . 0 0 "[ . 1 . 2]" 1
1935 1 71 CYS HB3 1 94 MET ME 4.000 . 4.900 3.400 1.797 4.957 0.057 11 0 "[ . 1 . 2]" 1
1936 1 71 CYS H 1 109 ILE MD 5.000 . 6.100 4.164 3.223 5.806 . 0 0 "[ . 1 . 2]" 1
1937 1 71 CYS H 1 94 MET HB3 3.400 . 4.100 4.244 4.141 4.363 0.263 3 0 "[ . 1 . 2]" 1
1938 1 71 CYS H 1 94 MET ME 5.500 . 6.700 4.226 3.253 4.893 . 0 0 "[ . 1 . 2]" 1
1939 1 72 ASP HA 1 78 TRP HB3 5.500 . 6.500 6.503 6.259 6.598 0.098 5 0 "[ . 1 . 2]" 1
1940 1 72 ASP HA 1 93 HIS HD2 4.800 . 5.800 5.208 4.928 5.562 . 0 0 "[ . 1 . 2]" 1
1941 1 72 ASP HB2 1 78 TRP H 4.800 . 5.800 5.577 5.111 6.030 0.230 17 0 "[ . 1 . 2]" 1
1942 1 72 ASP HB2 1 78 TRP HB2 4.400 . 5.300 3.351 3.013 3.655 . 0 0 "[ . 1 . 2]" 1
1943 1 72 ASP HB2 1 93 HIS HD2 3.600 . 4.300 2.973 2.437 4.310 0.010 17 0 "[ . 1 . 2]" 1
1944 1 72 ASP HB3 1 78 TRP HA 4.700 . 5.600 5.283 4.952 5.687 0.087 18 0 "[ . 1 . 2]" 1
1945 1 72 ASP HB3 1 78 TRP HB2 4.700 . 5.600 3.028 2.724 3.516 . 0 0 "[ . 1 . 2]" 1
1946 1 72 ASP HB3 1 93 HIS HD2 3.900 . 4.800 4.089 2.226 4.707 . 0 0 "[ . 1 . 2]" 1
1947 1 72 ASP H 1 78 TRP HB3 5.100 . 6.200 6.139 5.907 6.300 0.100 8 0 "[ . 1 . 2]" 1
1948 1 72 ASP H 1 78 TRP HD1 4.000 . 4.800 4.744 4.384 4.901 0.101 13 0 "[ . 1 . 2]" 1
1949 1 72 ASP H 1 93 HIS HA 4.200 . 5.000 5.030 4.736 5.139 0.139 4 0 "[ . 1 . 2]" 1
1950 1 72 ASP H 1 93 HIS HD2 3.600 . 4.300 3.163 2.631 3.599 . 0 0 "[ . 1 . 2]" 1
1951 1 72 ASP H 1 94 MET HB3 4.000 . 4.800 4.473 4.087 4.822 0.022 5 0 "[ . 1 . 2]" 1
1952 1 73 LYS HA 1 93 HIS HD2 4.900 . 5.900 5.963 5.575 6.041 0.141 10 0 "[ . 1 . 2]" 1
1953 1 73 LYS HA 1 95 GLY HA2 3.600 . 4.300 2.974 2.279 4.216 . 0 0 "[ . 1 . 2]" 1
1954 1 73 LYS HA 1 95 GLY HA3 4.500 . 5.400 4.028 2.917 5.427 0.027 20 0 "[ . 1 . 2]" 1
1955 1 73 LYS HA 1 96 THR H 4.200 . 5.000 4.535 3.166 5.059 0.059 2 0 "[ . 1 . 2]" 1
1956 1 73 LYS HA 1 96 THR MG 4.100 . 5.000 4.092 2.659 5.164 0.164 1 0 "[ . 1 . 2]" 1
1957 1 73 LYS QB 1 96 THR MG 4.200 . 5.100 3.906 2.467 5.142 0.042 11 0 "[ . 1 . 2]" 1
1958 1 73 LYS QG 1 96 THR MG 3.900 . 4.800 3.472 1.915 4.869 0.069 9 0 "[ . 1 . 2]" 1
1959 1 75 LYS HA 1 93 HIS HE1 4.600 . 5.500 3.367 1.706 4.173 0.094 17 0 "[ . 1 . 2]" 1
1960 1 75 LYS HB2 1 93 HIS HE1 3.300 . 4.000 2.157 1.834 2.507 . 0 0 "[ . 1 . 2]" 1
1961 1 75 LYS QD 1 93 HIS HE1 3.300 . 4.000 3.761 2.627 4.136 0.136 20 0 "[ . 1 . 2]" 1
1962 1 75 LYS HE2 1 93 HIS HE1 4.600 . 5.500 5.293 4.300 5.659 0.159 15 0 "[ . 1 . 2]" 1
1963 1 75 LYS HE3 1 93 HIS HE1 4.600 . 5.500 4.973 4.203 5.558 0.058 1 0 "[ . 1 . 2]" 1
1964 1 75 LYS HG2 1 93 HIS HE1 4.200 . 5.200 3.966 2.204 5.062 . 0 0 "[ . 1 . 2]" 1
1965 1 75 LYS HG3 1 93 HIS HE1 3.700 . 4.400 2.871 2.310 4.428 0.028 9 0 "[ . 1 . 2]" 1
1966 1 78 TRP HD1 1 93 HIS HA 4.000 . 4.800 4.627 4.280 4.851 0.051 9 0 "[ . 1 . 2]" 1
1967 1 78 TRP HD1 1 93 HIS HB3 5.600 . 6.000 4.582 4.019 5.019 . 0 0 "[ . 1 . 2]" 1
1968 1 78 TRP HD1 1 93 HIS HD2 4.000 . 4.800 2.413 2.010 3.276 . 0 0 "[ . 1 . 2]" 1
1969 1 78 TRP HH2 1 87 LEU QD 5.000 . 5.500 2.842 2.229 3.405 . 0 0 "[ . 1 . 2]" 1
1970 1 78 TRP HZ2 1 87 LEU QD 5.400 . 6.600 3.613 3.008 4.298 . 0 0 "[ . 1 . 2]" 1
1971 1 78 TRP HZ2 1 91 GLN HB2 5.100 . 6.100 5.863 5.262 6.304 0.204 20 0 "[ . 1 . 2]" 1
1972 1 78 TRP HZ2 1 93 HIS HD2 5.200 . 6.200 6.177 5.903 6.313 0.113 16 0 "[ . 1 . 2]" 1
1973 1 81 MET HA 1 87 LEU QD 6.500 . 6.700 5.900 4.839 6.426 . 0 0 "[ . 1 . 2]" 1
1974 1 81 MET HB3 1 87 LEU QD 5.700 . 6.700 5.222 4.098 5.806 . 0 0 "[ . 1 . 2]" 1
1975 1 81 MET ME 1 87 LEU QD 5.300 . 6.600 4.461 1.860 6.226 . 0 0 "[ . 1 . 2]" 1
1976 1 81 MET HG2 1 87 LEU QD 5.400 . 6.600 4.325 2.560 5.729 . 0 0 "[ . 1 . 2]" 1
1977 1 81 MET HG3 1 87 LEU QD 5.700 . 6.700 4.581 3.467 5.494 . 0 0 "[ . 1 . 2]" 1
1978 1 82 VAL MG1 1 91 GLN HB2 5.500 . 6.700 4.953 4.545 5.484 . 0 0 "[ . 1 . 2]" 1
1979 1 82 VAL MG1 1 91 GLN HG2 5.300 . 6.300 5.996 5.193 6.477 0.177 9 0 "[ . 1 . 2]" 1
1980 1 82 VAL MG2 1 91 GLN HB2 5.500 . 6.700 4.016 3.401 4.681 . 0 0 "[ . 1 . 2]" 1
1981 1 82 VAL MG2 1 91 GLN HB3 5.400 . 6.400 4.366 3.728 5.239 . 0 0 "[ . 1 . 2]" 1
1982 1 82 VAL MG2 1 91 GLN HE21 5.800 . 6.700 3.525 2.419 5.206 . 0 0 "[ . 1 . 2]" 1
1983 1 82 VAL MG2 1 91 GLN HE22 5.100 . 6.200 3.242 1.770 5.704 0.030 16 0 "[ . 1 . 2]" 1
1984 1 82 VAL MG2 1 91 GLN QG 5.000 . 6.000 3.674 2.922 5.030 . 0 0 "[ . 1 . 2]" 1
1985 1 94 MET ME 1 100 PHE HB2 5.400 . 6.600 3.937 2.790 5.584 . 0 0 "[ . 1 . 2]" 1
1986 1 94 MET ME 1 100 PHE HB3 6.200 . 6.700 2.807 2.019 4.113 . 0 0 "[ . 1 . 2]" 1
1987 1 94 MET ME 1 101 MET ME 5.900 . 7.300 4.455 1.866 5.759 . 0 0 "[ . 1 . 2]" 1
1988 1 94 MET ME 1 101 MET QG 4.400 . 5.400 3.076 1.933 4.733 . 0 0 "[ . 1 . 2]" 1
1989 1 100 PHE HZ 1 113 ILE MD 5.200 . 6.300 6.108 5.498 6.370 0.070 5 0 "[ . 1 . 2]" 1
1990 1 100 PHE HZ 1 115 LEU QD 5.100 . 6.200 4.945 3.629 5.790 . 0 0 "[ . 1 . 2]" 1
1991 1 101 MET ME 1 107 ASN HA 6.400 . 6.700 2.821 1.727 5.741 0.073 3 0 "[ . 1 . 2]" 1
1992 1 101 MET ME 1 108 GLY H 5.900 . 6.700 4.931 3.216 6.197 . 0 0 "[ . 1 . 2]" 1
1993 1 101 MET ME 1 109 ILE HA 5.400 . 6.600 5.382 3.377 6.668 0.068 8 0 "[ . 1 . 2]" 1
1994 1 101 MET ME 1 109 ILE MG 5.200 . 6.400 3.373 2.002 6.286 . 0 0 "[ . 1 . 2]" 1
1995 1 104 TYR HB2 1 124 ALA MB 5.700 . 6.700 5.510 4.176 6.388 . 0 0 "[ . 1 . 2]" 1
1996 1 104 TYR QD 1 113 ILE MD 6.600 . 7.400 2.653 1.917 2.971 . 0 0 "[ . 1 . 2]" 1
1997 1 104 TYR QD 1 121 ILE HG12 5.000 . 6.100 4.297 2.753 5.347 . 0 0 "[ . 1 . 2]" 1
1998 1 104 TYR QD 1 121 ILE HG13 4.800 . 5.900 5.301 3.651 5.931 0.031 12 0 "[ . 1 . 2]" 1
1999 1 104 TYR QD 1 124 ALA MB 5.800 . 7.200 3.168 1.996 5.018 . 0 0 "[ . 1 . 2]" 1
2000 1 104 TYR QE 1 113 ILE HB 5.100 . 6.200 5.326 4.765 6.075 . 0 0 "[ . 1 . 2]" 1
2001 1 104 TYR QE 1 113 ILE MD 5.700 . 7.000 3.061 2.269 3.429 . 0 0 "[ . 1 . 2]" 1
2002 1 104 TYR QE 1 113 ILE MG 3.400 . 4.100 3.180 2.737 3.844 . 0 0 "[ . 1 . 2]" 1
2003 1 104 TYR QE 1 121 ILE HG12 4.000 . 4.900 2.467 1.885 3.994 . 0 0 "[ . 1 . 2]" 1
2004 1 104 TYR QE 1 121 ILE HG13 4.100 . 5.000 3.309 2.123 4.305 . 0 0 "[ . 1 . 2]" 1
2005 1 104 TYR QE 1 124 ALA HA 5.700 . 6.700 4.258 3.268 6.313 . 0 0 "[ . 1 . 2]" 1
2006 1 104 TYR QE 1 124 ALA MB 5.800 . 7.200 4.121 3.066 5.926 . 0 0 "[ . 1 . 2]" 1
2007 1 111 ARG HD2 1 125 ASN HA 3.400 . 4.100 3.698 3.170 4.167 0.067 12 0 "[ . 1 . 2]" 1
2008 1 111 ARG HD2 1 126 MET H 4.200 . 5.000 4.708 4.099 5.079 0.079 17 0 "[ . 1 . 2]" 1
2009 1 111 ARG HD3 1 125 ASN HA 3.600 . 4.300 3.615 2.780 4.248 . 0 0 "[ . 1 . 2]" 1
2010 1 111 ARG HD3 1 126 MET H 4.100 . 4.900 4.494 3.697 5.014 0.114 1 0 "[ . 1 . 2]" 1
2011 1 111 ARG HE 1 125 ASN HA 3.900 . 4.700 3.724 2.934 4.830 0.130 4 0 "[ . 1 . 2]" 1
2012 1 111 ARG HE 1 126 MET H 4.300 . 5.200 5.141 4.494 5.346 0.146 18 0 "[ . 1 . 2]" 1
2013 1 112 PHE HA 1 126 MET QB 4.600 . 5.500 4.088 3.521 4.541 . 0 0 "[ . 1 . 2]" 1
2014 1 112 PHE HA 1 127 THR H 4.500 . 5.500 5.277 4.540 5.688 0.188 18 0 "[ . 1 . 2]" 1
2015 1 112 PHE HA 1 128 ARG H 4.600 . 5.600 5.716 4.993 5.865 0.265 18 0 "[ . 1 . 2]" 1
2016 1 112 PHE HB2 1 126 MET H 3.700 . 4.400 2.824 2.256 3.586 . 0 0 "[ . 1 . 2]" 1
2017 1 112 PHE HB2 1 126 MET QB 4.600 . 5.500 2.366 1.759 2.845 0.041 16 0 "[ . 1 . 2]" 1
2018 1 112 PHE HB3 1 126 MET QB 4.400 . 5.300 3.333 2.502 4.093 . 0 0 "[ . 1 . 2]" 1
2019 1 112 PHE QE 1 129 PRO HD2 5.900 . 6.700 4.517 2.840 6.669 . 0 0 "[ . 1 . 2]" 1
2020 1 112 PHE H 1 125 ASN HA 4.500 . 5.400 4.189 3.760 4.885 . 0 0 "[ . 1 . 2]" 1
2021 1 112 PHE H 1 126 MET H 4.600 . 5.500 4.039 3.682 4.727 . 0 0 "[ . 1 . 2]" 1
2022 1 112 PHE H 1 126 MET QB 4.500 . 5.400 4.868 4.334 5.371 . 0 0 "[ . 1 . 2]" 1
2023 1 113 ILE HA 1 126 MET H 3.100 . 3.700 3.103 2.146 3.576 . 0 0 "[ . 1 . 2]" 1
2024 1 113 ILE HA 1 126 MET QB 4.700 . 5.600 2.982 2.099 4.242 . 0 0 "[ . 1 . 2]" 1
2025 1 113 ILE MD 1 121 ILE HB 6.500 . 6.700 6.475 4.802 6.766 0.066 10 0 "[ . 1 . 2]" 1
2026 1 113 ILE MD 1 121 ILE MG 4.300 . 5.400 4.169 2.699 4.577 . 0 0 "[ . 1 . 2]" 1
2027 1 113 ILE MD 1 123 SER HB2 6.100 . 6.700 6.642 5.592 6.806 0.106 18 0 "[ . 1 . 2]" 1
2028 1 113 ILE MD 1 124 ALA HA 6.200 . 6.700 3.325 1.765 3.741 0.035 12 0 "[ . 1 . 2]" 1
2029 1 113 ILE HG12 1 124 ALA HA 3.600 . 4.300 2.917 2.113 4.405 0.105 12 0 "[ . 1 . 2]" 1
2030 1 113 ILE HG12 1 124 ALA MB 5.000 . 6.100 3.942 3.286 5.354 . 0 0 "[ . 1 . 2]" 1
2031 1 113 ILE HG13 1 124 ALA HA 3.900 . 4.700 4.439 3.011 4.740 0.040 1 0 "[ . 1 . 2]" 1
2032 1 113 ILE MG 1 124 ALA HA 4.200 . 5.100 2.473 1.919 5.157 0.057 6 0 "[ . 1 . 2]" 1
2033 1 113 ILE MG 1 124 ALA MB 4.800 . 6.000 3.821 3.334 5.855 . 0 0 "[ . 1 . 2]" 1
2034 1 113 ILE MG 1 125 ASN HA 6.500 . 6.700 4.977 4.518 5.863 . 0 0 "[ . 1 . 2]" 1
2035 1 113 ILE MG 1 126 MET H 6.200 . 6.700 4.928 4.537 5.296 . 0 0 "[ . 1 . 2]" 1
2036 1 113 ILE H 1 126 MET QB 4.300 . 5.200 3.815 3.072 4.517 . 0 0 "[ . 1 . 2]" 1
2037 1 114 LEU HB2 1 123 SER H 4.200 . 5.000 4.644 4.409 5.141 0.141 12 0 "[ . 1 . 2]" 1
2038 1 114 LEU HB2 1 126 MET HG3 5.000 . 6.000 3.971 1.798 6.097 0.097 12 0 "[ . 1 . 2]" 1
2039 1 114 LEU HB3 1 123 SER H 3.900 . 4.700 3.122 2.770 4.731 0.031 12 0 "[ . 1 . 2]" 1
2040 1 114 LEU HB3 1 123 SER HB3 4.400 . 5.300 4.238 3.776 4.930 . 0 0 "[ . 1 . 2]" 1
2041 1 114 LEU QD 1 126 MET ME 6.300 . 7.400 2.306 1.799 3.837 0.001 1 0 "[ . 1 . 2]" 1
2042 1 114 LEU QD 1 126 MET HG3 6.500 . 6.700 3.815 2.989 4.842 . 0 0 "[ . 1 . 2]" 1
2043 1 114 LEU QD 1 138 PHE QD 6.600 . 7.400 3.463 2.641 4.249 . 0 0 "[ . 1 . 2]" 1
2044 1 114 LEU QD 1 138 PHE HZ 5.600 . 6.700 4.148 3.341 4.891 . 0 0 "[ . 1 . 2]" 1
2045 1 114 LEU H 1 123 SER HB3 4.000 . 4.800 4.356 3.790 4.831 0.031 6 0 "[ . 1 . 2]" 1
2046 1 114 LEU H 1 126 MET H 4.100 . 4.900 4.624 4.080 4.919 0.019 12 0 "[ . 1 . 2]" 1
2047 1 115 LEU HA 1 121 ILE HA 3.700 . 4.400 2.432 2.176 2.871 . 0 0 "[ . 1 . 2]" 1
2048 1 115 LEU HA 1 122 ILE H 3.300 . 4.000 1.819 1.723 2.279 0.077 19 0 "[ . 1 . 2]" 1
2049 1 115 LEU HA 1 122 ILE HB 3.900 . 4.700 3.146 2.897 3.406 . 0 0 "[ . 1 . 2]" 1
2050 1 115 LEU HA 1 122 ILE MD 6.500 . 6.700 3.768 3.318 4.223 . 0 0 "[ . 1 . 2]" 1
2051 1 115 LEU HA 1 122 ILE HG13 4.300 . 5.200 3.108 1.947 4.053 . 0 0 "[ . 1 . 2]" 1
2052 1 115 LEU HA 1 123 SER H 4.400 . 5.300 3.692 3.519 4.168 . 0 0 "[ . 1 . 2]" 1
2053 1 115 LEU HB2 1 121 ILE H 4.200 . 5.000 5.127 5.064 5.166 0.166 14 0 "[ . 1 . 2]" 1
2054 1 115 LEU QD 1 121 ILE H 4.300 . 5.300 2.885 2.563 4.922 . 0 0 "[ . 1 . 2]" 1
2055 1 115 LEU QD 1 121 ILE HA 4.600 . 5.600 2.750 2.412 3.588 . 0 0 "[ . 1 . 2]" 1
2056 1 115 LEU QD 1 121 ILE HG12 4.300 . 5.300 3.368 2.573 5.153 . 0 0 "[ . 1 . 2]" 1
2057 1 115 LEU H 1 122 ILE H 4.300 . 5.200 4.196 4.049 4.530 . 0 0 "[ . 1 . 2]" 1
2058 1 115 LEU H 1 122 ILE HB 3.500 . 4.300 4.351 4.244 4.408 0.108 17 0 "[ . 1 . 2]" 1
2059 1 116 ASP HA 1 122 ILE MD 4.700 . 5.700 3.052 2.055 3.924 . 0 0 "[ . 1 . 2]" 1
2060 1 116 ASP HA 1 122 ILE HG12 4.900 . 5.900 3.638 3.251 4.088 . 0 0 "[ . 1 . 2]" 1
2061 1 116 ASP HA 1 122 ILE HG13 4.700 . 5.600 3.336 3.091 3.578 . 0 0 "[ . 1 . 2]" 1
2062 1 116 ASP HB2 1 122 ILE MD 4.700 . 5.700 2.273 1.794 3.413 0.006 7 0 "[ . 1 . 2]" 1
2063 1 116 ASP HB2 1 122 ILE HG12 4.700 . 5.600 2.862 2.384 4.361 . 0 0 "[ . 1 . 2]" 1
2064 1 116 ASP HB2 1 122 ILE HG13 4.200 . 5.000 3.151 2.624 4.295 . 0 0 "[ . 1 . 2]" 1
2065 1 116 ASP HB3 1 122 ILE MD 4.400 . 5.400 3.299 1.899 4.093 . 0 0 "[ . 1 . 2]" 1
2066 1 116 ASP HB3 1 122 ILE HG12 4.900 . 5.900 3.678 2.470 4.223 . 0 0 "[ . 1 . 2]" 1
2067 1 116 ASP HB3 1 122 ILE HG13 4.400 . 5.300 4.104 2.614 5.206 . 0 0 "[ . 1 . 2]" 1
2068 1 116 ASP H 1 122 ILE H 3.800 . 4.600 3.461 3.261 3.723 . 0 0 "[ . 1 . 2]" 1
2069 1 116 ASP H 1 122 ILE HB 3.700 . 4.400 4.312 4.024 4.461 0.061 18 0 "[ . 1 . 2]" 1
2070 1 116 ASP H 1 122 ILE MD 5.000 . 6.100 3.191 3.017 3.342 . 0 0 "[ . 1 . 2]" 1
2071 1 116 ASP H 1 122 ILE HG12 4.000 . 4.800 2.560 1.954 3.421 . 0 0 "[ . 1 . 2]" 1
2072 1 116 ASP H 1 122 ILE HG13 3.400 . 4.100 2.909 2.082 3.680 . 0 0 "[ . 1 . 2]" 1
2073 1 126 MET ME 1 138 PHE H 5.200 . 6.300 5.128 3.687 6.369 0.069 4 0 "[ . 1 . 2]" 1
2074 1 126 MET ME 1 138 PHE HZ 6.100 . 6.700 4.668 2.673 5.991 . 0 0 "[ . 1 . 2]" 1
2075 1 127 THR HB 1 133 LYS H 4.500 . 5.400 5.049 4.443 5.430 0.030 3 0 "[ . 1 . 2]" 1
2076 1 127 THR HB 1 133 LYS HB2 4.600 . 5.500 4.027 2.902 4.797 . 0 0 "[ . 1 . 2]" 1
2077 1 127 THR HB 1 133 LYS HB3 4.800 . 5.800 5.477 4.116 5.899 0.099 3 0 "[ . 1 . 2]" 1
2078 1 127 THR HB 1 134 THR H 4.100 . 4.900 3.897 3.188 4.450 . 0 0 "[ . 1 . 2]" 1
2079 1 127 THR MG 1 133 LYS H 5.700 . 6.700 4.650 3.438 5.699 . 0 0 "[ . 1 . 2]" 1
2080 1 139 ASN HB2 1 145 GLU HA 4.300 . 5.200 4.140 2.532 5.398 0.198 5 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 64
_Distance_constraint_stats_list.Viol_count 40
_Distance_constraint_stats_list.Viol_total 51.801
_Distance_constraint_stats_list.Viol_max 0.270
_Distance_constraint_stats_list.Viol_rms 0.0160
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0020
_Distance_constraint_stats_list.Viol_average_violations_only 0.0648
_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 2 SER 0.079 0.046 11 0 "[ . 1 . 2]"
1 4 ARG 0.079 0.046 11 0 "[ . 1 . 2]"
1 6 GLY 0.079 0.046 11 0 "[ . 1 . 2]"
1 9 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 PHE 0.033 0.033 4 0 "[ . 1 . 2]"
1 15 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 ILE 0.143 0.084 1 0 "[ . 1 . 2]"
1 22 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 LEU 0.033 0.033 4 0 "[ . 1 . 2]"
1 26 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 ASP 0.602 0.270 10 0 "[ . 1 . 2]"
1 28 LEU 0.602 0.270 10 0 "[ . 1 . 2]"
1 29 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 TYR 0.065 0.027 17 0 "[ . 1 . 2]"
1 33 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 TYR 0.065 0.027 17 0 "[ . 1 . 2]"
1 35 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ALA 0.184 0.092 3 0 "[ . 1 . 2]"
1 40 THR 0.752 0.134 5 0 "[ . 1 . 2]"
1 41 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 CYS 0.184 0.092 3 0 "[ . 1 . 2]"
1 46 ARG 0.062 0.048 1 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 LEU 0.062 0.048 1 0 "[ . 1 . 2]"
1 51 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 LEU 0.011 0.011 9 0 "[ . 1 . 2]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 LEU 0.011 0.011 9 0 "[ . 1 . 2]"
1 56 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 PHE 0.011 0.011 9 0 "[ . 1 . 2]"
1 67 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LYS 0.567 0.134 5 0 "[ . 1 . 2]"
1 77 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 GLU 0.143 0.084 1 0 "[ . 1 . 2]"
1 80 ASN 0.567 0.134 5 0 "[ . 1 . 2]"
1 81 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 VAL 0.143 0.084 1 0 "[ . 1 . 2]"
1 83 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 ILE 0.184 0.092 3 0 "[ . 1 . 2]"
1 113 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 LEU 0.065 0.027 17 0 "[ . 1 . 2]"
1 115 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 130 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 LYS 0.844 0.173 13 0 "[ . 1 . 2]"
1 136 GLU 0.844 0.173 13 0 "[ . 1 . 2]"
1 142 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 143 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 40 THR MG 1 80 ASN H 5.100 . 5.900 5.736 5.241 6.034 0.134 5 0 "[ . 1 . 2]" 2
2 1 38 TRP HE1 1 68 SER HA 5.200 . 6.000 4.214 4.092 4.393 . 0 0 "[ . 1 . 2]" 2
3 1 133 LYS HB2 1 136 GLU H 4.400 . 5.300 5.296 4.985 5.473 0.173 13 0 "[ . 1 . 2]" 2
4 1 39 ALA MB 1 41 TRP HA 6.000 . 6.000 3.721 2.975 4.190 . 0 0 "[ . 1 . 2]" 2
5 1 87 LEU HA 1 88 LYS HA 4.300 . 5.200 4.071 3.997 4.118 . 0 0 "[ . 1 . 2]" 2
6 1 40 THR MG 1 72 ASP HB2 4.800 . 5.800 3.587 1.994 4.236 . 0 0 "[ . 1 . 2]" 2
7 1 99 THR HA 1 102 ASP H 3.300 . 4.000 3.074 2.849 3.308 . 0 0 "[ . 1 . 2]" 2
8 1 118 ASP H 1 119 GLY H 2.200 . 2.600 2.118 1.931 2.302 . 0 0 "[ . 1 . 2]" 2
9 1 103 ALA H 1 104 TYR H 2.400 . 2.900 2.129 1.954 2.275 . 0 0 "[ . 1 . 2]" 2
10 1 25 LEU QD 1 119 GLY H 5.000 . 6.000 3.202 2.347 4.254 . 0 0 "[ . 1 . 2]" 2
11 1 35 ILE MG 1 37 VAL HA 6.000 . 6.000 3.858 3.600 4.129 . 0 0 "[ . 1 . 2]" 2
12 1 55 LEU H 1 57 GLU H 4.100 . 4.900 3.734 3.512 3.876 . 0 0 "[ . 1 . 2]" 2
13 1 34 TYR HA 1 35 ILE HB 4.000 . 4.800 3.797 3.491 4.399 . 0 0 "[ . 1 . 2]" 2
14 1 40 THR MG 1 74 ASN HD21 4.400 . 5.300 2.376 2.016 2.906 . 0 0 "[ . 1 . 2]" 2
15 1 101 MET HA 1 104 TYR QD 5.000 . 6.000 3.659 1.929 4.479 . 0 0 "[ . 1 . 2]" 2
16 1 66 PHE H 1 67 VAL H 4.000 . 4.800 3.749 3.697 3.826 . 0 0 "[ . 1 . 2]" 2
17 1 52 LEU HG 1 66 PHE QD 3.700 . 4.400 3.476 2.482 4.369 . 0 0 "[ . 1 . 2]" 2
18 1 39 ALA MB 1 101 MET ME 6.000 . 6.000 3.898 2.857 5.236 . 0 0 "[ . 1 . 2]" 2
19 1 101 MET HA 1 104 TYR QE 5.700 2.800 6.700 5.246 3.361 6.208 . 0 0 "[ . 1 . 2]" 2
20 1 33 ILE MG 1 34 TYR HA 5.800 . 6.000 3.397 3.047 3.648 . 0 0 "[ . 1 . 2]" 2
21 1 25 LEU HA 1 33 ILE MD 5.900 . 6.000 3.484 2.738 4.156 . 0 0 "[ . 1 . 2]" 2
22 1 22 THR MG 1 24 SER HA 5.000 . 6.000 4.378 3.578 4.668 . 0 0 "[ . 1 . 2]" 2
23 1 77 ALA MB 1 78 TRP HB3 4.600 . 5.500 4.368 4.253 4.550 . 0 0 "[ . 1 . 2]" 2
24 1 133 LYS H 1 133 LYS HB2 2.800 . 3.300 2.255 1.840 2.814 . 0 0 "[ . 1 . 2]" 2
25 1 46 ARG HB2 1 49 LEU QD 4.400 . 5.200 2.751 1.752 4.056 0.048 1 0 "[ . 1 . 2]" 2
26 1 130 SER H 1 130 SER HA 2.800 . 3.400 2.559 2.221 2.756 . 0 0 "[ . 1 . 2]" 2
27 1 101 MET HA 1 106 ILE H 3.000 . 3.500 2.908 2.511 3.436 . 0 0 "[ . 1 . 2]" 2
28 1 38 TRP HZ2 1 91 GLN HB3 4.000 . 4.800 2.882 2.565 3.301 . 0 0 "[ . 1 . 2]" 2
29 1 32 TYR HB2 1 33 ILE HA 4.900 . 5.900 4.301 4.135 4.462 . 0 0 "[ . 1 . 2]" 2
30 1 32 TYR QD 1 114 LEU QD 4.300 . 5.200 2.264 1.773 2.752 0.027 17 0 "[ . 1 . 2]" 2
31 1 31 LYS HA 1 32 TYR H 2.800 . 3.400 2.266 2.182 2.378 . 0 0 "[ . 1 . 2]" 2
32 1 10 ALA HA 1 11 ALA H 2.700 . 3.200 2.553 2.184 2.759 . 0 0 "[ . 1 . 2]" 2
33 1 52 LEU HB2 1 66 PHE QD 4.400 . 5.300 4.242 3.298 5.311 0.011 9 0 "[ . 1 . 2]" 2
34 1 13 PHE QD 1 15 TYR QE 4.400 . 5.300 2.964 2.640 3.536 . 0 0 "[ . 1 . 2]" 2
35 1 101 MET HB2 1 106 ILE H 3.900 . 4.700 4.111 3.489 4.552 . 0 0 "[ . 1 . 2]" 2
36 1 39 ALA MB 1 41 TRP HZ2 3.500 . 4.200 2.890 2.485 3.553 . 0 0 "[ . 1 . 2]" 2
37 1 73 LYS HA 1 75 LYS HA 4.700 . 5.600 4.889 4.573 5.206 . 0 0 "[ . 1 . 2]" 2
38 1 32 TYR HA 1 118 ASP H 4.200 . 5.000 4.474 4.233 4.586 . 0 0 "[ . 1 . 2]" 2
39 1 28 LEU HA 1 28 LEU HB3 2.900 . 3.500 2.387 2.257 2.671 . 0 0 "[ . 1 . 2]" 2
40 1 121 ILE HB 1 122 ILE H 3.900 . 4.700 4.146 3.841 4.245 . 0 0 "[ . 1 . 2]" 2
41 1 40 THR MG 1 72 ASP HB3 4.600 . 5.500 3.278 2.579 3.995 . 0 0 "[ . 1 . 2]" 2
42 1 52 LEU QD 1 66 PHE QD 4.000 . 4.800 3.411 2.093 4.603 . 0 0 "[ . 1 . 2]" 2
43 1 12 SER HB3 1 13 PHE QD 5.000 . 6.000 4.776 4.293 5.221 . 0 0 "[ . 1 . 2]" 2
44 1 142 LEU H 1 143 GLY H 2.200 . 2.600 2.089 1.942 2.182 . 0 0 "[ . 1 . 2]" 2
45 1 55 LEU QD 1 57 GLU H 5.300 . 6.000 5.213 4.712 5.456 . 0 0 "[ . 1 . 2]" 2
46 1 49 LEU HA 1 53 LYS H 4.000 . 4.800 3.835 3.624 4.076 . 0 0 "[ . 1 . 2]" 2
47 1 18 ILE MD 1 79 GLU HA 3.900 . 4.700 1.988 1.716 2.156 0.084 1 0 "[ . 1 . 2]" 2
48 1 9 SER HA 1 10 ALA MB 4.700 . 5.600 3.968 3.729 4.360 . 0 0 "[ . 1 . 2]" 2
49 1 35 ILE HG13 1 115 LEU HB3 4.700 . 5.600 5.044 4.769 5.244 . 0 0 "[ . 1 . 2]" 2
50 1 32 TYR HB2 1 114 LEU QD 4.500 . 5.400 2.607 2.074 3.115 . 0 0 "[ . 1 . 2]" 2
51 1 31 LYS HA 1 117 ARG HA 3.800 . 4.600 2.541 2.237 2.856 . 0 0 "[ . 1 . 2]" 2
52 1 13 PHE H 1 25 LEU QD 6.000 . 6.000 2.231 1.767 2.961 0.033 4 0 "[ . 1 . 2]" 2
53 1 81 MET H 1 82 VAL H 2.400 . 2.900 2.436 2.387 2.493 . 0 0 "[ . 1 . 2]" 2
54 1 121 ILE HB 1 123 SER H 4.800 . 5.800 4.978 4.305 5.379 . 0 0 "[ . 1 . 2]" 2
55 1 25 LEU QD 1 120 LYS H 5.100 . 6.000 3.793 3.542 4.094 . 0 0 "[ . 1 . 2]" 2
56 1 16 PRO HD3 1 17 ASP H 4.800 . 5.800 5.243 5.106 5.344 . 0 0 "[ . 1 . 2]" 2
57 1 9 SER QB 1 10 ALA MB 5.300 . 6.000 3.343 2.823 4.264 . 0 0 "[ . 1 . 2]" 2
58 1 26 ALA MB 1 27 ASP HB3 5.100 . 6.000 3.941 2.750 4.470 . 0 0 "[ . 1 . 2]" 2
59 1 2 SER HB3 1 4 ARG H 4.700 . 5.700 4.782 3.294 5.746 0.046 11 0 "[ . 1 . 2]" 2
60 1 46 ARG HA 1 49 LEU H 3.200 . 3.800 3.092 2.883 3.422 . 0 0 "[ . 1 . 2]" 2
61 1 37 VAL MG2 1 101 MET QG 5.400 . 6.000 4.042 2.248 5.144 . 0 0 "[ . 1 . 2]" 2
62 1 35 ILE HB 1 36 ASP H 3.400 . 4.000 3.510 3.339 3.708 . 0 0 "[ . 1 . 2]" 2
63 1 39 ALA MB 1 40 THR MG 4.700 . 5.600 2.326 1.708 3.260 0.092 3 0 "[ . 1 . 2]" 2
64 1 27 ASP H 1 28 LEU HB3 3.900 . 4.600 4.108 3.455 4.870 0.270 10 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 76
_Distance_constraint_stats_list.Viol_count 621
_Distance_constraint_stats_list.Viol_total 825.266
_Distance_constraint_stats_list.Viol_max 0.255
_Distance_constraint_stats_list.Viol_rms 0.0481
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0271
_Distance_constraint_stats_list.Viol_average_violations_only 0.0664
_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 15 TYR 0.109 0.031 1 0 "[ . 1 . 2]"
1 17 ASP 3.967 0.237 20 0 "[ . 1 . 2]"
1 21 LYS 3.967 0.237 20 0 "[ . 1 . 2]"
1 23 VAL 0.109 0.031 1 0 "[ . 1 . 2]"
1 32 TYR 1.147 0.126 5 0 "[ . 1 . 2]"
1 33 ILE 1.226 0.090 8 0 "[ . 1 . 2]"
1 34 TYR 1.247 0.073 11 0 "[ . 1 . 2]"
1 35 ILE 0.950 0.107 12 0 "[ . 1 . 2]"
1 36 ASP 1.912 0.129 5 0 "[ . 1 . 2]"
1 37 VAL 2.260 0.248 11 0 "[ . 1 . 2]"
1 38 TRP 0.179 0.072 14 0 "[ . 1 . 2]"
1 50 PRO 0.379 0.081 8 0 "[ . 1 . 2]"
1 51 ALA 0.304 0.089 12 0 "[ . 1 . 2]"
1 52 LEU 0.196 0.085 11 0 "[ . 1 . 2]"
1 53 LYS 0.043 0.027 13 0 "[ . 1 . 2]"
1 54 GLU 0.965 0.092 4 0 "[ . 1 . 2]"
1 55 LEU 0.569 0.091 13 0 "[ . 1 . 2]"
1 56 GLU 1.611 0.167 4 0 "[ . 1 . 2]"
1 57 GLU 0.043 0.027 13 0 "[ . 1 . 2]"
1 58 LYS 0.585 0.092 4 0 "[ . 1 . 2]"
1 59 TYR 0.266 0.091 13 0 "[ . 1 . 2]"
1 60 ALA 1.415 0.167 4 0 "[ . 1 . 2]"
1 65 HIS 1.559 0.126 5 0 "[ . 1 . 2]"
1 67 VAL 0.981 0.066 19 0 "[ . 1 . 2]"
1 68 SER 2.016 0.139 18 0 "[ . 1 . 2]"
1 69 LEU 1.944 0.129 5 0 "[ . 1 . 2]"
1 70 SER 2.331 0.145 17 0 "[ . 1 . 2]"
1 75 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 LYS 2.653 0.221 5 0 "[ . 1 . 2]"
1 77 ALA 3.461 0.186 9 0 "[ . 1 . 2]"
1 78 TRP 0.003 0.003 5 0 "[ . 1 . 2]"
1 79 GLU 1.372 0.130 6 0 "[ . 1 . 2]"
1 80 ASN 2.653 0.221 5 0 "[ . 1 . 2]"
1 81 MET 3.461 0.186 9 0 "[ . 1 . 2]"
1 82 VAL 0.003 0.003 5 0 "[ . 1 . 2]"
1 83 THR 1.372 0.130 6 0 "[ . 1 . 2]"
1 90 ILE 0.236 0.077 2 0 "[ . 1 . 2]"
1 92 LEU 1.780 0.139 18 0 "[ . 1 . 2]"
1 94 MET 2.331 0.145 17 0 "[ . 1 . 2]"
1 111 ARG 2.260 0.248 11 0 "[ . 1 . 2]"
1 113 ILE 0.950 0.107 12 0 "[ . 1 . 2]"
1 114 LEU 0.697 0.098 17 0 "[ . 1 . 2]"
1 115 LEU 1.226 0.090 8 0 "[ . 1 . 2]"
1 116 ASP 8.654 0.255 9 0 "[ . 1 . 2]"
1 120 LYS 8.654 0.255 9 0 "[ . 1 . 2]"
1 122 ILE 0.697 0.098 17 0 "[ . 1 . 2]"
1 132 PRO 0.021 0.020 10 0 "[ . 1 . 2]"
1 133 LYS 0.472 0.122 15 0 "[ . 1 . 2]"
1 134 THR 0.678 0.120 5 0 "[ . 1 . 2]"
1 135 ALA 1.595 0.171 5 0 "[ . 1 . 2]"
1 136 GLU 0.496 0.176 8 0 "[ . 1 . 2]"
1 137 LYS 0.714 0.122 15 0 "[ . 1 . 2]"
1 138 PHE 1.085 0.120 5 0 "[ . 1 . 2]"
1 139 ASN 1.595 0.171 5 0 "[ . 1 . 2]"
1 140 GLU 0.475 0.176 8 0 "[ . 1 . 2]"
1 141 LEU 0.242 0.070 9 0 "[ . 1 . 2]"
1 142 LEU 0.407 0.090 11 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 50 PRO O 1 54 GLU N 3.200 2.200 3.200 3.081 2.921 3.244 0.044 8 0 "[ . 1 . 2]" 3
2 1 50 PRO O 1 54 GLU H 2.200 . 2.200 2.131 1.946 2.281 0.081 8 0 "[ . 1 . 2]" 3
3 1 51 ALA O 1 55 LEU N 3.200 2.200 3.200 2.977 2.746 3.221 0.021 10 0 "[ . 1 . 2]" 3
4 1 51 ALA O 1 55 LEU H 2.200 . 2.200 2.066 1.839 2.289 0.089 12 0 "[ . 1 . 2]" 3
5 1 52 LEU O 1 56 GLU N 3.200 2.200 3.200 2.919 2.657 3.218 0.018 11 0 "[ . 1 . 2]" 3
6 1 52 LEU O 1 56 GLU H 2.200 . 2.200 1.986 1.696 2.285 0.085 11 0 "[ . 1 . 2]" 3
7 1 53 LYS O 1 57 GLU N 3.200 2.200 3.200 2.870 2.649 3.167 . 0 0 "[ . 1 . 2]" 3
8 1 53 LYS O 1 57 GLU H 2.200 . 2.200 1.907 1.679 2.227 0.027 13 0 "[ . 1 . 2]" 3
9 1 54 GLU O 1 58 LYS N 3.200 2.200 3.200 3.056 2.785 3.225 0.025 12 0 "[ . 1 . 2]" 3
10 1 54 GLU O 1 58 LYS H 2.200 . 2.200 2.191 1.963 2.292 0.092 4 0 "[ . 1 . 2]" 3
11 1 55 LEU O 1 59 TYR N 3.200 2.200 3.200 2.914 2.744 3.100 . 0 0 "[ . 1 . 2]" 3
12 1 55 LEU O 1 59 TYR H 2.200 . 2.200 2.060 1.832 2.291 0.091 13 0 "[ . 1 . 2]" 3
13 1 56 GLU O 1 60 ALA N 3.200 2.200 3.200 2.697 2.571 2.888 . 0 0 "[ . 1 . 2]" 3
14 1 56 GLU O 1 60 ALA H 2.200 . 2.200 2.252 1.815 2.367 0.167 4 0 "[ . 1 . 2]" 3
15 1 75 LYS O 1 79 GLU N 3.200 2.200 3.200 2.755 2.572 3.065 . 0 0 "[ . 1 . 2]" 3
16 1 75 LYS O 1 79 GLU H 2.200 . 2.200 1.794 1.610 2.094 . 0 0 "[ . 1 . 2]" 3
17 1 76 LYS O 1 80 ASN N 3.200 2.200 3.200 3.205 2.871 3.396 0.196 10 0 "[ . 1 . 2]" 3
18 1 76 LYS O 1 80 ASN H 2.200 . 2.200 2.262 1.918 2.421 0.221 5 0 "[ . 1 . 2]" 3
19 1 77 ALA O 1 81 MET N 3.200 2.200 3.200 3.220 3.062 3.327 0.127 9 0 "[ . 1 . 2]" 3
20 1 77 ALA O 1 81 MET H 2.200 . 2.200 2.326 2.250 2.386 0.186 9 0 "[ . 1 . 2]" 3
21 1 78 TRP O 1 82 VAL N 3.200 2.200 3.200 2.944 2.763 3.184 . 0 0 "[ . 1 . 2]" 3
22 1 78 TRP O 1 82 VAL H 2.200 . 2.200 1.969 1.781 2.203 0.003 5 0 "[ . 1 . 2]" 3
23 1 79 GLU O 1 83 THR N 3.200 2.200 3.200 3.154 3.059 3.232 0.032 6 0 "[ . 1 . 2]" 3
24 1 79 GLU O 1 83 THR H 2.200 . 2.200 2.264 2.183 2.330 0.130 6 0 "[ . 1 . 2]" 3
25 1 132 PRO O 1 136 GLU N 3.200 2.200 3.200 2.871 2.612 3.201 0.001 10 0 "[ . 1 . 2]" 3
26 1 132 PRO O 1 136 GLU H 2.200 . 2.200 1.904 1.647 2.220 0.020 10 0 "[ . 1 . 2]" 3
27 1 133 LYS O 1 137 LYS N 3.200 2.200 3.200 3.001 2.790 3.195 . 0 0 "[ . 1 . 2]" 3
28 1 133 LYS O 1 137 LYS H 2.200 . 2.200 2.130 1.827 2.322 0.122 15 0 "[ . 1 . 2]" 3
29 1 134 THR O 1 138 PHE N 3.200 2.200 3.200 3.065 2.726 3.234 0.034 5 0 "[ . 1 . 2]" 3
30 1 134 THR O 1 138 PHE H 2.200 . 2.200 2.163 1.925 2.320 0.120 5 0 "[ . 1 . 2]" 3
31 1 135 ALA O 1 139 ASN N 3.200 2.200 3.200 3.155 2.788 3.286 0.086 11 0 "[ . 1 . 2]" 3
32 1 135 ALA O 1 139 ASN H 2.200 . 2.200 2.204 1.804 2.371 0.171 5 0 "[ . 1 . 2]" 3
33 1 136 GLU O 1 140 GLU N 3.200 2.200 3.200 2.944 2.682 3.300 0.100 8 0 "[ . 1 . 2]" 3
34 1 136 GLU O 1 140 GLU H 2.200 . 2.200 2.019 1.737 2.376 0.176 8 0 "[ . 1 . 2]" 3
35 1 137 LYS O 1 141 LEU N 3.200 2.200 3.200 2.946 2.693 3.218 0.018 9 0 "[ . 1 . 2]" 3
36 1 137 LYS O 1 141 LEU H 2.200 . 2.200 1.995 1.720 2.270 0.070 9 0 "[ . 1 . 2]" 3
37 1 138 PHE O 1 142 LEU N 3.200 2.200 3.200 3.041 2.764 3.176 . 0 0 "[ . 1 . 2]" 3
38 1 138 PHE O 1 142 LEU H 2.200 . 2.200 2.162 1.839 2.290 0.090 11 0 "[ . 1 . 2]" 3
39 1 17 ASP O 1 21 LYS N 2.800 2.800 3.300 3.335 3.263 3.384 0.084 15 0 "[ . 1 . 2]" 3
40 1 17 ASP O 1 21 LYS H 1.800 . 2.300 2.461 2.384 2.537 0.237 20 0 "[ . 1 . 2]" 3
41 1 15 TYR O 1 23 VAL N 2.800 2.800 3.300 2.915 2.769 3.258 0.031 1 0 "[ . 1 . 2]" 3
42 1 15 TYR O 1 23 VAL H 1.800 . 2.300 1.980 1.816 2.294 . 0 0 "[ . 1 . 2]" 3
43 1 34 TYR N 1 65 HIS O 2.800 2.800 3.300 2.812 2.727 3.022 0.073 11 0 "[ . 1 . 2]" 3
44 1 34 TYR H 1 65 HIS O 1.800 . 2.300 1.853 1.763 2.076 0.037 11 0 "[ . 1 . 2]" 3
45 1 32 TYR O 1 65 HIS N 2.800 2.800 3.300 2.746 2.674 2.815 0.126 5 0 "[ . 1 . 2]" 3
46 1 32 TYR O 1 65 HIS H 1.800 . 2.300 1.946 1.781 2.308 0.019 5 0 "[ . 1 . 2]" 3
47 1 36 ASP N 1 67 VAL O 2.800 2.800 3.300 2.929 2.753 3.155 0.047 6 0 "[ . 1 . 2]" 3
48 1 36 ASP H 1 67 VAL O 1.800 . 2.300 2.042 1.814 2.342 0.042 10 0 "[ . 1 . 2]" 3
49 1 34 TYR O 1 67 VAL N 2.800 2.800 3.300 2.766 2.734 2.809 0.066 19 0 "[ . 1 . 2]" 3
50 1 34 TYR O 1 67 VAL H 1.800 . 2.300 1.806 1.777 1.863 0.023 12 0 "[ . 1 . 2]" 3
51 1 38 TRP N 1 69 LEU O 2.800 2.800 3.300 3.100 2.898 3.252 . 0 0 "[ . 1 . 2]" 3
52 1 38 TRP H 1 69 LEU O 1.800 . 2.300 2.241 2.075 2.372 0.072 14 0 "[ . 1 . 2]" 3
53 1 36 ASP O 1 69 LEU N 2.800 2.800 3.300 2.734 2.671 2.874 0.129 5 0 "[ . 1 . 2]" 3
54 1 36 ASP O 1 69 LEU H 1.800 . 2.300 1.810 1.722 2.006 0.078 2 0 "[ . 1 . 2]" 3
55 1 33 ILE N 1 115 LEU O 2.800 2.800 3.300 2.996 2.792 3.159 0.008 12 0 "[ . 1 . 2]" 3
56 1 33 ILE H 1 115 LEU O 1.800 . 2.300 2.052 1.812 2.303 0.003 8 0 "[ . 1 . 2]" 3
57 1 33 ILE O 1 115 LEU N 2.800 2.800 3.300 2.747 2.710 2.830 0.090 8 0 "[ . 1 . 2]" 3
58 1 33 ILE O 1 115 LEU H 1.800 . 2.300 1.819 1.766 1.960 0.034 18 0 "[ . 1 . 2]" 3
59 1 35 ILE N 1 113 ILE O 2.800 2.800 3.300 2.790 2.693 3.135 0.107 12 0 "[ . 1 . 2]" 3
60 1 35 ILE H 1 113 ILE O 1.800 . 2.300 1.907 1.802 2.310 0.010 6 0 "[ . 1 . 2]" 3
61 1 35 ILE O 1 113 ILE N 2.800 2.800 3.300 2.810 2.735 2.970 0.065 5 0 "[ . 1 . 2]" 3
62 1 35 ILE O 1 113 ILE H 1.800 . 2.300 1.939 1.817 2.278 . 0 0 "[ . 1 . 2]" 3
63 1 37 VAL N 1 111 ARG O 2.800 2.800 3.300 3.168 3.033 3.258 . 0 0 "[ . 1 . 2]" 3
64 1 37 VAL H 1 111 ARG O 1.800 . 2.300 2.404 2.122 2.548 0.248 11 0 "[ . 1 . 2]" 3
65 1 114 LEU O 1 122 ILE N 2.800 2.800 3.300 2.774 2.702 2.881 0.098 17 0 "[ . 1 . 2]" 3
66 1 114 LEU O 1 122 ILE H 1.800 . 2.300 1.914 1.830 1.999 . 0 0 "[ . 1 . 2]" 3
67 1 116 ASP N 1 120 LYS O 2.800 2.800 3.300 2.688 2.596 2.710 0.204 12 0 "[ . 1 . 2]" 3
68 1 116 ASP H 1 120 LYS O 1.800 . 2.300 1.718 1.695 1.746 0.105 16 0 "[ . 1 . 2]" 3
69 1 116 ASP O 1 120 LYS N 2.800 2.800 3.300 3.319 3.272 3.354 0.054 11 0 "[ . 1 . 2]" 3
70 1 116 ASP O 1 120 LYS H 1.800 . 2.300 2.517 2.474 2.555 0.255 9 0 "[ . 1 . 2]" 3
71 1 68 SER N 1 90 ILE O 2.800 2.800 3.300 2.880 2.723 3.206 0.077 2 0 "[ . 1 . 2]" 3
72 1 68 SER H 1 90 ILE O 1.800 . 2.300 1.949 1.789 2.248 0.011 2 0 "[ . 1 . 2]" 3
73 1 68 SER O 1 92 LEU N 2.800 2.800 3.300 2.721 2.661 2.769 0.139 18 0 "[ . 1 . 2]" 3
74 1 68 SER O 1 92 LEU H 1.800 . 2.300 1.822 1.743 1.998 0.057 1 0 "[ . 1 . 2]" 3
75 1 70 SER O 1 94 MET N 2.800 2.800 3.300 2.693 2.655 2.755 0.145 17 0 "[ . 1 . 2]" 3
76 1 70 SER O 1 94 MET H 1.800 . 2.300 1.849 1.762 2.150 0.038 20 0 "[ . 1 . 2]" 3
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