NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
646123 |
6jhd   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6jhd
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 1139
_Distance_constraint_stats_list.Viol_count 1945
_Distance_constraint_stats_list.Viol_total 726.257
_Distance_constraint_stats_list.Viol_max 0.367
_Distance_constraint_stats_list.Viol_rms 0.0169
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0028
_Distance_constraint_stats_list.Viol_average_violations_only 0.0249
_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 ASP 0.000 0.000 . 0 "[ . 1 .]"
1 3 LEU 0.000 0.000 . 0 "[ . 1 .]"
1 7 HIS 0.000 0.000 . 0 "[ . 1 .]"
1 11 ASN 0.918 0.124 2 0 "[ . 1 .]"
1 12 ARG 0.865 0.124 2 0 "[ . 1 .]"
1 14 ALA 0.059 0.009 7 0 "[ . 1 .]"
1 15 LEU 0.129 0.025 2 0 "[ . 1 .]"
1 16 ILE 0.508 0.067 15 0 "[ . 1 .]"
1 17 LEU 0.408 0.067 15 0 "[ . 1 .]"
1 18 LEU 0.262 0.047 12 0 "[ . 1 .]"
1 19 ALA 0.189 0.047 12 0 "[ . 1 .]"
1 20 GLN 0.028 0.012 1 0 "[ . 1 .]"
1 22 ARG 0.039 0.011 8 0 "[ . 1 .]"
1 24 ILE 0.387 0.027 8 0 "[ . 1 .]"
1 25 SER 0.487 0.060 11 0 "[ . 1 .]"
1 26 PRO 0.000 0.000 . 0 "[ . 1 .]"
1 27 PHE 0.519 0.060 11 0 "[ . 1 .]"
1 28 SER 0.271 0.027 8 0 "[ . 1 .]"
1 29 CYS 0.279 0.076 15 0 "[ . 1 .]"
1 30 LEU 0.094 0.034 14 0 "[ . 1 .]"
1 31 LYS 0.246 0.036 9 0 "[ . 1 .]"
1 32 ASP 0.228 0.036 9 0 "[ . 1 .]"
1 33 ARG 0.118 0.038 3 0 "[ . 1 .]"
1 34 HIS 0.233 0.038 14 0 "[ . 1 .]"
1 35 ASP 0.294 0.046 9 0 "[ . 1 .]"
1 36 PHE 1.002 0.046 9 0 "[ . 1 .]"
1 37 GLU 0.947 0.227 4 0 "[ . 1 .]"
1 38 PHE 5.955 0.227 4 0 "[ . 1 .]"
1 39 PRO 0.351 0.085 14 0 "[ . 1 .]"
1 40 GLN 5.243 0.206 8 0 "[ . 1 .]"
1 41 GLU 0.003 0.003 14 0 "[ . 1 .]"
1 42 GLU 0.438 0.085 14 0 "[ . 1 .]"
1 43 PHE 4.004 0.206 8 0 "[ . 1 .]"
1 44 ASP 0.994 0.073 11 0 "[ . 1 .]"
1 45 ASP 0.038 0.027 12 0 "[ . 1 .]"
1 46 LYS 0.341 0.051 5 0 "[ . 1 .]"
1 47 GLN 1.102 0.162 6 0 "[ . 1 .]"
1 48 PHE 2.867 0.162 6 0 "[ . 1 .]"
1 49 GLN 0.329 0.070 8 0 "[ . 1 .]"
1 50 LYS 0.034 0.022 15 0 "[ . 1 .]"
1 51 ALA 0.541 0.035 12 0 "[ . 1 .]"
1 52 GLN 0.000 0.000 . 0 "[ . 1 .]"
1 53 ALA 0.271 0.027 6 0 "[ . 1 .]"
1 54 ILE 0.347 0.030 12 0 "[ . 1 .]"
1 55 SER 0.079 0.018 2 0 "[ . 1 .]"
1 56 VAL 0.680 0.043 14 0 "[ . 1 .]"
1 57 LEU 0.811 0.199 6 0 "[ . 1 .]"
1 58 HIS 0.267 0.028 2 0 "[ . 1 .]"
1 59 GLU 0.213 0.025 4 0 "[ . 1 .]"
1 60 MET 0.134 0.012 9 0 "[ . 1 .]"
1 61 ILE 0.150 0.021 6 0 "[ . 1 .]"
1 62 GLN 0.002 0.002 10 0 "[ . 1 .]"
1 63 GLN 0.084 0.018 6 0 "[ . 1 .]"
1 64 THR 0.474 0.030 3 0 "[ . 1 .]"
1 65 PHE 0.195 0.020 3 0 "[ . 1 .]"
1 66 ASN 0.011 0.005 2 0 "[ . 1 .]"
1 67 LEU 0.431 0.036 3 0 "[ . 1 .]"
1 68 PHE 0.079 0.028 14 0 "[ . 1 .]"
1 69 SER 0.811 0.065 4 0 "[ . 1 .]"
1 70 THR 1.383 0.346 8 0 "[ . 1 .]"
1 71 LYS 0.348 0.048 7 0 "[ . 1 .]"
1 72 ASP 0.171 0.016 12 0 "[ . 1 .]"
1 73 SER 0.050 0.010 7 0 "[ . 1 .]"
1 74 SER 0.097 0.019 4 0 "[ . 1 .]"
1 75 ALA 0.230 0.021 13 0 "[ . 1 .]"
1 76 ALA 0.054 0.020 10 0 "[ . 1 .]"
1 77 LEU 0.656 0.063 4 0 "[ . 1 .]"
1 78 ASP 0.101 0.015 14 0 "[ . 1 .]"
1 79 GLU 0.546 0.125 5 0 "[ . 1 .]"
1 80 THR 0.000 0.000 . 0 "[ . 1 .]"
1 81 LEU 0.125 0.015 14 0 "[ . 1 .]"
1 82 LEU 2.366 0.104 14 0 "[ . 1 .]"
1 83 ASP 0.370 0.031 7 0 "[ . 1 .]"
1 84 GLU 0.639 0.076 11 0 "[ . 1 .]"
1 85 PHE 1.464 0.105 6 0 "[ . 1 .]"
1 86 TYR 0.197 0.047 14 0 "[ . 1 .]"
1 87 ILE 0.244 0.031 7 0 "[ . 1 .]"
1 88 GLU 0.101 0.010 12 0 "[ . 1 .]"
1 89 LEU 0.356 0.040 14 0 "[ . 1 .]"
1 90 ASP 0.212 0.018 15 0 "[ . 1 .]"
1 91 GLN 0.062 0.014 7 0 "[ . 1 .]"
1 92 GLN 0.030 0.020 5 0 "[ . 1 .]"
1 93 LEU 0.312 0.021 5 0 "[ . 1 .]"
1 94 ASN 0.107 0.022 11 0 "[ . 1 .]"
1 96 LEU 0.000 0.000 . 0 "[ . 1 .]"
1 97 GLU 0.138 0.028 2 0 "[ . 1 .]"
1 98 SER 0.000 0.000 . 0 "[ . 1 .]"
1 99 CYS 0.121 0.017 8 0 "[ . 1 .]"
1 100 VAL 0.072 0.021 2 0 "[ . 1 .]"
1 101 MET 0.021 0.006 2 0 "[ . 1 .]"
1 102 GLN 0.026 0.006 15 0 "[ . 1 .]"
1 103 GLU 0.164 0.034 6 0 "[ . 1 .]"
1 104 VAL 2.588 0.331 5 0 "[ . 1 .]"
1 105 GLY 0.370 0.046 6 0 "[ . 1 .]"
1 106 VAL 0.197 0.021 6 0 "[ . 1 .]"
1 107 ILE 0.220 0.024 8 0 "[ . 1 .]"
1 108 GLU 0.218 0.024 8 0 "[ . 1 .]"
1 109 SER 0.307 0.113 1 0 "[ . 1 .]"
1 110 PRO 0.179 0.085 6 0 "[ . 1 .]"
1 111 LEU 0.289 0.085 6 0 "[ . 1 .]"
1 112 MET 0.128 0.079 1 0 "[ . 1 .]"
1 113 TYR 0.345 0.029 12 0 "[ . 1 .]"
1 114 GLU 0.191 0.029 12 0 "[ . 1 .]"
1 115 ASP 0.003 0.003 14 0 "[ . 1 .]"
1 116 SER 0.427 0.038 9 0 "[ . 1 .]"
1 117 ILE 0.659 0.038 9 0 "[ . 1 .]"
1 118 LEU 0.050 0.015 10 0 "[ . 1 .]"
1 119 ALA 0.189 0.021 14 0 "[ . 1 .]"
1 120 VAL 0.272 0.019 10 0 "[ . 1 .]"
1 121 ARG 0.106 0.017 1 0 "[ . 1 .]"
1 122 LYS 0.069 0.025 6 0 "[ . 1 .]"
1 123 TYR 0.206 0.033 6 0 "[ . 1 .]"
1 124 PHE 0.374 0.043 15 0 "[ . 1 .]"
1 125 GLN 0.032 0.025 6 0 "[ . 1 .]"
1 126 ARG 0.122 0.022 6 0 "[ . 1 .]"
1 127 ILE 0.806 0.036 5 0 "[ . 1 .]"
1 128 THR 0.026 0.009 4 0 "[ . 1 .]"
1 129 LEU 0.009 0.005 4 0 "[ . 1 .]"
1 130 TYR 0.244 0.025 4 0 "[ . 1 .]"
1 131 LEU 0.156 0.011 15 0 "[ . 1 .]"
1 132 THR 0.023 0.010 2 0 "[ . 1 .]"
1 133 GLU 0.024 0.019 9 0 "[ . 1 .]"
1 134 LYS 0.118 0.019 9 0 "[ . 1 .]"
1 135 LYS 0.186 0.095 3 0 "[ . 1 .]"
1 136 TYR 0.110 0.016 9 0 "[ . 1 .]"
1 137 SER 0.104 0.038 15 0 "[ . 1 .]"
1 138 SER 0.170 0.098 12 0 "[ . 1 .]"
1 139 CYS 0.110 0.098 12 0 "[ . 1 .]"
1 140 ALA 0.430 0.076 15 0 "[ . 1 .]"
1 141 TRP 0.419 0.038 2 0 "[ . 1 .]"
1 142 GLU 0.011 0.005 14 0 "[ . 1 .]"
1 143 VAL 0.188 0.038 14 0 "[ . 1 .]"
1 144 VAL 1.047 0.053 1 0 "[ . 1 .]"
1 145 ARG 0.029 0.022 10 0 "[ . 1 .]"
1 146 ALA 0.000 0.000 . 0 "[ . 1 .]"
1 147 GLU 0.138 0.055 14 0 "[ . 1 .]"
1 148 ILE 1.535 0.060 5 0 "[ . 1 .]"
1 149 MET 0.936 0.060 5 0 "[ . 1 .]"
1 150 ARG 1.817 0.209 3 0 "[ . 1 .]"
1 151 SER 1.716 0.150 3 0 "[ . 1 .]"
1 152 PHE 0.815 0.073 7 0 "[ . 1 .]"
1 153 SER 0.649 0.073 7 0 "[ . 1 .]"
1 154 LEU 3.308 0.175 15 0 "[ . 1 .]"
1 155 SER 1.166 0.083 9 0 "[ . 1 .]"
1 156 ILE 0.007 0.007 1 0 "[ . 1 .]"
1 158 LEU 1.215 0.221 9 0 "[ . 1 .]"
1 159 GLN 0.329 0.070 8 0 "[ . 1 .]"
1 161 ARG 0.280 0.221 9 0 "[ . 1 .]"
1 163 LYS 0.000 0.000 . 0 "[ . 1 .]"
1 164 SER 7.574 0.367 10 0 "[ . 1 .]"
1 165 LYS 7.821 0.367 10 0 "[ . 1 .]"
1 166 GLU 0.226 0.026 8 0 "[ . 1 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ASP H 1 3 LEU H 5.000 . 5.000 4.505 4.290 4.612 . 0 0 "[ . 1 .]" 1
2 1 2 ASP HA 1 3 LEU H 5.000 . 5.000 2.175 2.139 2.256 . 0 0 "[ . 1 .]" 1
3 1 2 ASP HB3 1 3 LEU H 5.000 . 5.000 3.665 2.935 4.366 . 0 0 "[ . 1 .]" 1
4 1 3 LEU H 1 3 LEU MD1 5.000 . 5.000 3.496 1.962 4.718 . 0 0 "[ . 1 .]" 1
5 1 7 HIS H 1 7 HIS HD2 5.000 . 5.000 4.340 2.831 4.979 . 0 0 "[ . 1 .]" 1
6 1 11 ASN H 1 11 ASN HB3 . . 2.800 2.725 2.493 2.814 0.014 13 0 "[ . 1 .]" 1
7 1 11 ASN H 1 12 ARG H 5.000 . 5.000 3.218 1.985 4.617 . 0 0 "[ . 1 .]" 1
8 1 11 ASN H 1 156 ILE MD 5.000 . 5.000 3.149 2.047 4.315 . 0 0 "[ . 1 .]" 1
9 1 11 ASN HA 1 12 ARG H 3.400 . 3.400 3.143 2.398 3.524 0.124 2 0 "[ . 1 .]" 1
10 1 11 ASN HB3 1 12 ARG H 3.400 . 3.400 2.723 1.877 3.406 0.006 6 0 "[ . 1 .]" 1
11 1 11 ASN HB3 1 15 LEU H 5.000 . 5.000 4.791 4.338 5.012 0.012 1 0 "[ . 1 .]" 1
12 1 11 ASN HB3 1 156 ILE MD 5.000 . 5.000 3.243 2.300 4.020 . 0 0 "[ . 1 .]" 1
13 1 12 ARG H 1 156 ILE MD 5.000 . 5.000 4.416 3.360 5.007 0.007 1 0 "[ . 1 .]" 1
14 1 12 ARG HA 1 15 LEU H 5.000 . 5.000 3.769 3.391 4.223 . 0 0 "[ . 1 .]" 1
15 1 12 ARG HA 1 15 LEU MD2 5.000 . 5.000 4.658 4.234 5.020 0.020 4 0 "[ . 1 .]" 1
16 1 12 ARG HA 1 16 ILE H 5.000 . 5.000 4.465 3.474 4.964 . 0 0 "[ . 1 .]" 1
17 1 14 ALA MB 1 15 LEU H 5.000 . 5.000 2.980 2.673 3.315 . 0 0 "[ . 1 .]" 1
18 1 14 ALA MB 1 61 ILE MD 5.000 . 5.000 4.618 4.203 5.004 0.004 6 0 "[ . 1 .]" 1
19 1 14 ALA MB 1 88 GLU HB3 3.400 . 3.400 3.279 2.414 3.409 0.009 7 0 "[ . 1 .]" 1
20 1 14 ALA MB 1 89 LEU MD2 5.000 . 5.000 3.970 3.299 4.611 . 0 0 "[ . 1 .]" 1
21 1 14 ALA MB 1 152 PHE HD1 5.000 . 5.000 4.143 3.369 4.665 . 0 0 "[ . 1 .]" 1
22 1 15 LEU H 1 15 LEU MD2 5.000 . 5.000 3.147 2.581 3.753 . 0 0 "[ . 1 .]" 1
23 1 15 LEU H 1 16 ILE H 3.400 . 3.400 2.689 2.460 2.798 . 0 0 "[ . 1 .]" 1
24 1 15 LEU HB2 1 15 LEU MD2 3.400 . 3.400 2.848 2.232 3.197 . 0 0 "[ . 1 .]" 1
25 1 15 LEU HB3 1 15 LEU MD2 3.400 . 3.400 2.735 2.365 3.199 . 0 0 "[ . 1 .]" 1
26 1 15 LEU MD2 1 18 LEU H 5.000 . 5.000 4.933 4.647 5.025 0.025 2 0 "[ . 1 .]" 1
27 1 15 LEU MD2 1 149 MET HG3 5.000 . 5.000 4.117 3.370 4.709 . 0 0 "[ . 1 .]" 1
28 1 15 LEU MD2 1 153 SER H 5.000 . 5.000 4.545 3.256 5.018 0.018 4 0 "[ . 1 .]" 1
29 1 16 ILE H 1 16 ILE HB . . 2.800 2.609 2.555 2.715 . 0 0 "[ . 1 .]" 1
30 1 16 ILE H 1 16 ILE MD 3.400 . 3.400 2.451 1.871 3.235 . 0 0 "[ . 1 .]" 1
31 1 16 ILE H 1 16 ILE HG12 5.000 . 5.000 2.904 1.850 3.822 . 0 0 "[ . 1 .]" 1
32 1 16 ILE H 1 16 ILE HG13 . . 3.400 3.134 2.785 3.439 0.039 4 0 "[ . 1 .]" 1
33 1 16 ILE H 1 17 LEU H 2.800 . 2.800 2.617 2.338 2.738 . 0 0 "[ . 1 .]" 1
34 1 16 ILE HA 1 16 ILE MD 3.400 . 3.400 2.810 1.998 3.421 0.021 6 0 "[ . 1 .]" 1
35 1 16 ILE HA 1 19 ALA MB 2.800 . 2.800 2.535 2.344 2.808 0.008 9 0 "[ . 1 .]" 1
36 1 16 ILE HB 1 17 LEU H . . 2.800 2.600 2.315 2.771 . 0 0 "[ . 1 .]" 1
37 1 16 ILE HG12 1 17 LEU H 5.000 . 5.000 4.560 3.969 5.067 0.067 15 0 "[ . 1 .]" 1
38 1 17 LEU H 1 17 LEU HA 2.800 . 2.800 2.797 2.785 2.817 0.017 11 0 "[ . 1 .]" 1
39 1 17 LEU H 1 17 LEU HB3 2.800 . 2.800 2.593 2.277 2.830 0.030 15 0 "[ . 1 .]" 1
40 1 17 LEU H 1 17 LEU MD2 5.000 . 5.000 4.070 2.985 4.328 . 0 0 "[ . 1 .]" 1
41 1 17 LEU HB3 1 17 LEU MD2 3.400 . 3.400 2.142 1.957 2.288 . 0 0 "[ . 1 .]" 1
42 1 17 LEU MD1 1 84 GLU HB2 5.000 . 5.000 3.335 2.403 5.005 0.005 1 0 "[ . 1 .]" 1
43 1 17 LEU MD1 1 85 PHE H 5.000 . 5.000 3.362 2.891 4.204 . 0 0 "[ . 1 .]" 1
44 1 17 LEU MD2 1 85 PHE H 5.000 . 5.000 3.720 2.844 4.440 . 0 0 "[ . 1 .]" 1
45 1 17 LEU MD2 1 85 PHE HA . . 2.800 2.052 1.849 2.319 . 0 0 "[ . 1 .]" 1
46 1 17 LEU MD2 1 85 PHE HB2 5.000 . 5.000 2.924 2.256 3.524 . 0 0 "[ . 1 .]" 1
47 1 17 LEU MD2 1 85 PHE HD1 . . 3.400 2.929 2.184 3.420 0.020 7 0 "[ . 1 .]" 1
48 1 17 LEU MD2 1 88 GLU H 5.000 . 5.000 4.407 4.047 4.801 . 0 0 "[ . 1 .]" 1
49 1 17 LEU MD2 1 88 GLU HB3 . . 3.400 3.114 2.428 3.408 0.008 6 0 "[ . 1 .]" 1
50 1 17 LEU MD2 1 89 LEU H 5.000 . 5.000 4.767 4.148 5.014 0.014 4 0 "[ . 1 .]" 1
51 1 18 LEU H 1 18 LEU MD1 5.000 . 5.000 3.228 2.497 3.967 . 0 0 "[ . 1 .]" 1
52 1 18 LEU HA 1 81 LEU MD1 5.000 . 5.000 4.560 3.689 5.003 0.003 14 0 "[ . 1 .]" 1
53 1 18 LEU HB3 1 19 ALA H 3.400 2.400 3.400 3.310 3.054 3.447 0.047 12 0 "[ . 1 .]" 1
54 1 18 LEU MD1 1 19 ALA H 5.000 . 5.000 4.636 4.338 4.958 . 0 0 "[ . 1 .]" 1
55 1 18 LEU MD1 1 64 THR MG 5.000 . 5.000 4.926 4.655 5.013 0.013 13 0 "[ . 1 .]" 1
56 1 18 LEU MD1 1 148 ILE H 5.000 . 5.000 4.279 3.046 5.006 0.006 4 0 "[ . 1 .]" 1
57 1 18 LEU MD1 1 148 ILE MG 5.000 . 5.000 2.747 2.295 3.459 . 0 0 "[ . 1 .]" 1
58 1 18 LEU MD1 1 149 MET H 5.000 . 5.000 3.140 1.984 4.262 . 0 0 "[ . 1 .]" 1
59 1 19 ALA H 1 19 ALA HA . . 2.800 2.783 2.769 2.812 0.012 4 0 "[ . 1 .]" 1
60 1 19 ALA H 1 19 ALA MB 2.800 . 2.800 2.188 2.073 2.230 . 0 0 "[ . 1 .]" 1
61 1 19 ALA H 1 20 GLN H 2.800 . 2.800 2.719 2.625 2.774 . 0 0 "[ . 1 .]" 1
62 1 19 ALA MB 1 20 GLN H 2.800 . 2.800 2.768 2.739 2.803 0.003 9 0 "[ . 1 .]" 1
63 1 20 GLN H 1 81 LEU MD2 5.000 . 5.000 4.323 3.593 4.969 . 0 0 "[ . 1 .]" 1
64 1 20 GLN HB3 1 81 LEU MD1 3.400 . 3.400 3.224 2.831 3.412 0.012 1 0 "[ . 1 .]" 1
65 1 20 GLN HB3 1 81 LEU MD2 5.000 . 5.000 3.143 2.459 3.807 . 0 0 "[ . 1 .]" 1
66 1 22 ARG H 1 22 ARG HD3 5.000 . 5.000 4.383 2.972 4.808 . 0 0 "[ . 1 .]" 1
67 1 22 ARG H 1 22 ARG HG3 5.000 . 5.000 3.746 1.789 4.769 0.011 8 0 "[ . 1 .]" 1
68 1 22 ARG HD3 1 24 ILE H 5.000 . 5.000 4.820 4.278 5.010 0.010 15 0 "[ . 1 .]" 1
69 1 24 ILE H 1 24 ILE HB . . 2.800 2.475 2.347 2.775 . 0 0 "[ . 1 .]" 1
70 1 24 ILE HA 1 24 ILE MD 3.400 . 3.400 3.386 3.301 3.416 0.016 1 0 "[ . 1 .]" 1
71 1 24 ILE HA 1 24 ILE MG 3.400 . 3.400 3.192 3.183 3.205 . 0 0 "[ . 1 .]" 1
72 1 24 ILE HA 1 25 SER H 2.800 . 2.800 2.426 2.263 2.466 . 0 0 "[ . 1 .]" 1
73 1 24 ILE HB 1 24 ILE MD 2.800 . 2.800 2.174 2.041 2.258 . 0 0 "[ . 1 .]" 1
74 1 24 ILE HB 1 24 ILE HG13 2.800 . 2.800 2.707 2.686 2.740 . 0 0 "[ . 1 .]" 1
75 1 24 ILE MD 1 25 SER H 5.000 . 5.000 3.626 3.581 3.935 . 0 0 "[ . 1 .]" 1
76 1 24 ILE MD 1 138 SER H 5.000 . 5.000 4.685 4.321 5.013 0.013 11 0 "[ . 1 .]" 1
77 1 24 ILE MD 1 138 SER HB3 3.400 . 3.400 2.909 1.996 3.406 0.006 15 0 "[ . 1 .]" 1
78 1 24 ILE MD 1 139 CYS H 5.000 . 5.000 3.570 3.284 3.938 . 0 0 "[ . 1 .]" 1
79 1 24 ILE MD 1 139 CYS HA 5.000 . 5.000 2.526 2.154 2.824 . 0 0 "[ . 1 .]" 1
80 1 24 ILE MD 1 139 CYS HB3 5.000 . 5.000 4.699 3.854 5.005 0.005 4 0 "[ . 1 .]" 1
81 1 24 ILE MD 1 142 GLU H 5.000 . 5.000 3.784 3.424 4.143 . 0 0 "[ . 1 .]" 1
82 1 24 ILE MD 1 142 GLU HB3 5.000 . 5.000 3.326 1.871 3.968 . 0 0 "[ . 1 .]" 1
83 1 24 ILE HG13 1 25 SER H 3.400 . 3.400 2.039 1.938 2.299 . 0 0 "[ . 1 .]" 1
84 1 24 ILE MG 1 25 SER H . . 3.400 3.097 2.866 3.401 0.001 5 0 "[ . 1 .]" 1
85 1 24 ILE MG 1 28 SER H 5.000 . 5.000 5.018 5.008 5.027 0.027 8 0 "[ . 1 .]" 1
86 1 24 ILE MG 1 139 CYS HA 5.000 . 5.000 4.166 3.556 4.595 . 0 0 "[ . 1 .]" 1
87 1 25 SER H 1 25 SER HB2 2.800 . 2.800 2.721 2.555 2.800 . 0 0 "[ . 1 .]" 1
88 1 25 SER H 1 27 PHE H 5.000 . 5.000 5.032 5.006 5.060 0.060 11 0 "[ . 1 .]" 1
89 1 25 SER H 1 28 SER H 5.000 . 5.000 4.621 4.294 4.759 . 0 0 "[ . 1 .]" 1
90 1 25 SER HA 1 27 PHE H 5.000 . 5.000 3.659 3.556 3.814 . 0 0 "[ . 1 .]" 1
91 1 25 SER HB2 1 27 PHE H 3.400 . 3.400 3.263 3.006 3.403 0.003 12 0 "[ . 1 .]" 1
92 1 25 SER HB3 1 27 PHE H 3.400 . 3.400 2.933 2.644 3.085 . 0 0 "[ . 1 .]" 1
93 1 26 PRO HA 1 28 SER H 5.000 . 5.000 3.563 3.484 3.741 . 0 0 "[ . 1 .]" 1
94 1 27 PHE H 1 27 PHE HB3 . . 2.800 2.670 2.483 2.807 0.007 3 0 "[ . 1 .]" 1
95 1 27 PHE H 1 27 PHE HD1 5.000 . 5.000 4.459 4.268 4.692 . 0 0 "[ . 1 .]" 1
96 1 27 PHE H 1 28 SER H 2.800 . 2.800 2.549 2.458 2.616 . 0 0 "[ . 1 .]" 1
97 1 27 PHE H 1 29 CYS H 5.000 . 5.000 4.576 4.375 4.873 . 0 0 "[ . 1 .]" 1
98 1 27 PHE HB2 1 27 PHE HD1 3.400 . 3.400 2.839 2.626 2.923 . 0 0 "[ . 1 .]" 1
99 1 27 PHE HB3 1 28 SER H 5.000 . 5.000 3.510 3.267 3.601 . 0 0 "[ . 1 .]" 1
100 1 27 PHE HD1 1 30 LEU HG 5.000 . 5.000 4.731 4.057 5.004 0.004 9 0 "[ . 1 .]" 1
101 1 29 CYS HA 1 30 LEU H 3.400 . 3.400 2.318 2.214 2.443 . 0 0 "[ . 1 .]" 1
102 1 29 CYS HA 1 31 LYS H 5.000 . 5.000 4.506 3.956 4.803 . 0 0 "[ . 1 .]" 1
103 1 29 CYS HA 1 32 ASP H 5.000 . 5.000 4.494 4.235 4.798 . 0 0 "[ . 1 .]" 1
104 1 29 CYS HB2 1 30 LEU H 5.000 . 5.000 2.795 2.377 4.065 . 0 0 "[ . 1 .]" 1
105 1 29 CYS HB2 1 30 LEU MD1 5.000 . 5.000 4.667 4.370 5.034 0.034 14 0 "[ . 1 .]" 1
106 1 29 CYS HB2 1 32 ASP H 5.000 . 5.000 3.188 2.883 4.533 . 0 0 "[ . 1 .]" 1
107 1 29 CYS HB3 1 30 LEU H 5.000 . 5.000 3.765 2.995 4.035 . 0 0 "[ . 1 .]" 1
108 1 29 CYS HB3 1 32 ASP H 5.000 . 5.000 4.576 3.153 4.878 . 0 0 "[ . 1 .]" 1
109 1 29 CYS HB3 1 140 ALA H 5.000 . 5.000 5.012 4.945 5.076 0.076 15 0 "[ . 1 .]" 1
110 1 30 LEU H 1 30 LEU HB2 . . 3.400 2.668 2.477 2.874 . 0 0 "[ . 1 .]" 1
111 1 30 LEU H 1 30 LEU MD1 5.000 . 5.000 3.145 2.224 3.786 . 0 0 "[ . 1 .]" 1
112 1 30 LEU H 1 30 LEU HG 5.000 . 5.000 4.363 4.114 4.550 . 0 0 "[ . 1 .]" 1
113 1 30 LEU H 1 31 LYS H 3.400 . 3.400 2.300 1.988 2.664 . 0 0 "[ . 1 .]" 1
114 1 30 LEU HA 1 30 LEU MD1 2.800 . 2.800 2.465 1.908 2.812 0.012 9 0 "[ . 1 .]" 1
115 1 30 LEU HB3 1 31 LYS H 5.000 . 5.000 3.061 2.354 3.698 . 0 0 "[ . 1 .]" 1
116 1 30 LEU MD1 1 31 LYS H 5.000 . 5.000 4.175 3.759 4.485 . 0 0 "[ . 1 .]" 1
117 1 31 LYS H 1 31 LYS HB3 . . 2.800 2.646 2.487 2.740 . 0 0 "[ . 1 .]" 1
118 1 31 LYS H 1 31 LYS HG3 5.000 . 5.000 4.417 4.321 4.507 . 0 0 "[ . 1 .]" 1
119 1 31 LYS H 1 32 ASP H 2.800 . 2.800 2.599 2.563 2.703 . 0 0 "[ . 1 .]" 1
120 1 31 LYS H 1 32 ASP HB2 5.000 . 5.000 4.800 4.541 5.006 0.006 15 0 "[ . 1 .]" 1
121 1 31 LYS H 1 33 ARG H 5.000 . 5.000 4.614 4.397 4.765 . 0 0 "[ . 1 .]" 1
122 1 31 LYS HA 1 31 LYS HG3 . . 2.800 2.490 2.230 2.810 0.010 12 0 "[ . 1 .]" 1
123 1 31 LYS HB3 1 32 ASP H . 2.400 3.400 3.388 2.999 3.436 0.036 9 0 "[ . 1 .]" 1
124 1 32 ASP H 1 32 ASP HB2 2.800 . 2.800 2.461 2.287 2.589 . 0 0 "[ . 1 .]" 1
125 1 32 ASP H 1 143 VAL MG1 5.000 . 5.000 4.475 3.995 4.760 . 0 0 "[ . 1 .]" 1
126 1 32 ASP HA 1 33 ARG H 5.000 . 5.000 3.033 2.954 3.276 . 0 0 "[ . 1 .]" 1
127 1 32 ASP HA 1 143 VAL MG2 5.000 . 5.000 4.686 3.722 4.992 . 0 0 "[ . 1 .]" 1
128 1 32 ASP HB2 1 33 ARG H 5.000 . 5.000 3.984 3.584 4.110 . 0 0 "[ . 1 .]" 1
129 1 33 ARG H 1 33 ARG HB3 2.800 . 2.800 2.738 2.593 2.838 0.038 3 0 "[ . 1 .]" 1
130 1 33 ARG H 1 34 HIS H 4.000 2.400 4.000 3.938 3.714 4.018 0.018 4 0 "[ . 1 .]" 1
131 1 33 ARG H 1 143 VAL MG1 5.000 . 5.000 3.946 3.472 4.267 . 0 0 "[ . 1 .]" 1
132 1 33 ARG HA 1 34 HIS H 2.800 . 2.800 2.301 2.210 2.454 . 0 0 "[ . 1 .]" 1
133 1 34 HIS H 1 34 HIS HB2 2.800 . 2.800 2.560 2.370 2.758 . 0 0 "[ . 1 .]" 1
134 1 34 HIS H 1 36 PHE HE1 5.000 . 5.000 3.799 3.408 4.358 . 0 0 "[ . 1 .]" 1
135 1 34 HIS H 1 130 TYR HE1 5.000 . 5.000 4.699 4.211 5.004 0.004 12 0 "[ . 1 .]" 1
136 1 34 HIS H 1 143 VAL MG1 . . 3.400 3.383 3.164 3.438 0.038 14 0 "[ . 1 .]" 1
137 1 34 HIS HA 1 35 ASP H 2.800 . 2.800 2.517 2.324 2.677 . 0 0 "[ . 1 .]" 1
138 1 35 ASP H 1 36 PHE H 5.000 . 5.000 3.859 3.781 3.928 . 0 0 "[ . 1 .]" 1
139 1 35 ASP H 1 36 PHE HE1 5.600 2.400 5.600 5.593 5.422 5.616 0.016 4 0 "[ . 1 .]" 1
140 1 35 ASP HA 1 36 PHE H 2.800 . 2.800 2.254 2.229 2.276 . 0 0 "[ . 1 .]" 1
141 1 35 ASP HB2 1 36 PHE H 4.000 2.400 4.000 4.005 3.955 4.046 0.046 9 0 "[ . 1 .]" 1
142 1 35 ASP HB2 1 37 GLU H 5.000 . 5.000 3.923 3.821 4.022 . 0 0 "[ . 1 .]" 1
143 1 36 PHE H 1 36 PHE HD1 2.800 . 2.800 2.306 2.162 2.567 . 0 0 "[ . 1 .]" 1
144 1 36 PHE H 1 36 PHE HE1 5.000 . 5.000 3.874 3.772 4.104 . 0 0 "[ . 1 .]" 1
145 1 36 PHE H 1 37 GLU HB3 5.000 . 5.000 4.534 3.764 5.003 0.003 7 0 "[ . 1 .]" 1
146 1 36 PHE H 1 127 ILE MD 5.000 . 5.000 4.278 3.901 4.702 . 0 0 "[ . 1 .]" 1
147 1 36 PHE H 1 127 ILE HG13 5.000 . 5.000 4.927 4.729 5.017 0.017 9 0 "[ . 1 .]" 1
148 1 36 PHE H 1 147 GLU HB2 5.000 . 5.000 4.553 4.077 4.977 . 0 0 "[ . 1 .]" 1
149 1 36 PHE H 1 147 GLU HB3 5.000 . 5.000 4.543 4.175 4.923 . 0 0 "[ . 1 .]" 1
150 1 36 PHE HA 1 37 GLU H 3.400 . 3.400 3.276 3.265 3.283 . 0 0 "[ . 1 .]" 1
151 1 36 PHE HA 1 38 PHE H 5.000 . 5.000 4.986 4.599 5.036 0.036 14 0 "[ . 1 .]" 1
152 1 36 PHE HB2 1 37 GLU H 5.000 . 5.000 3.766 3.695 3.836 . 0 0 "[ . 1 .]" 1
153 1 36 PHE HB3 1 37 GLU H 5.000 . 5.000 4.588 4.556 4.622 . 0 0 "[ . 1 .]" 1
154 1 36 PHE HB3 1 127 ILE H 4.000 2.400 4.000 3.984 3.731 4.025 0.025 14 0 "[ . 1 .]" 1
155 1 36 PHE HD1 1 37 GLU H 5.000 . 5.000 3.581 3.335 3.957 . 0 0 "[ . 1 .]" 1
156 1 36 PHE HD1 1 127 ILE H 5.000 . 5.000 4.890 4.574 5.015 0.015 14 0 "[ . 1 .]" 1
157 1 36 PHE HD1 1 127 ILE HA 5.000 . 5.000 3.679 3.451 3.829 . 0 0 "[ . 1 .]" 1
158 1 36 PHE HD1 1 127 ILE MD 5.000 . 5.000 3.616 3.275 4.087 . 0 0 "[ . 1 .]" 1
159 1 36 PHE HD1 1 127 ILE MG 5.000 . 5.000 3.818 3.338 4.098 . 0 0 "[ . 1 .]" 1
160 1 36 PHE HD1 1 143 VAL MG2 5.000 . 5.000 4.521 4.180 4.793 . 0 0 "[ . 1 .]" 1
161 1 36 PHE HD1 1 144 VAL MG1 5.000 . 5.000 3.284 2.241 5.031 0.031 2 0 "[ . 1 .]" 1
162 1 36 PHE HE1 1 127 ILE HA 5.000 . 5.000 4.719 4.314 5.009 0.009 5 0 "[ . 1 .]" 1
163 1 36 PHE HE1 1 127 ILE MG 5.000 . 5.000 4.702 4.180 5.012 0.012 4 0 "[ . 1 .]" 1
164 1 36 PHE HE1 1 130 TYR HB2 5.000 . 5.000 4.959 4.462 5.025 0.025 4 0 "[ . 1 .]" 1
165 1 36 PHE HE1 1 130 TYR HD1 5.000 . 5.000 3.035 2.606 3.284 . 0 0 "[ . 1 .]" 1
166 1 36 PHE HE1 1 130 TYR HE1 . . 3.400 2.984 2.647 3.189 . 0 0 "[ . 1 .]" 1
167 1 36 PHE HE1 1 143 VAL HB 5.000 . 5.000 3.688 3.293 4.065 . 0 0 "[ . 1 .]" 1
168 1 36 PHE HE1 1 143 VAL MG1 5.000 . 5.000 4.756 4.389 5.004 0.004 12 0 "[ . 1 .]" 1
169 1 36 PHE HE1 1 143 VAL MG2 3.400 . 3.400 2.891 2.572 3.179 . 0 0 "[ . 1 .]" 1
170 1 36 PHE HE1 1 144 VAL HA 5.000 . 5.000 3.927 3.490 4.402 . 0 0 "[ . 1 .]" 1
171 1 36 PHE HE1 1 144 VAL MG1 5.000 . 5.000 3.289 2.043 4.981 . 0 0 "[ . 1 .]" 1
172 1 37 GLU H 1 38 PHE H 2.800 . 2.800 2.650 2.291 2.821 0.021 3 0 "[ . 1 .]" 1
173 1 37 GLU H 1 38 PHE HB3 5.600 2.400 5.600 5.215 5.018 5.474 . 0 0 "[ . 1 .]" 1
174 1 37 GLU H 1 38 PHE HD1 5.000 . 5.000 4.306 3.832 5.227 0.227 4 0 "[ . 1 .]" 1
175 1 37 GLU H 1 123 TYR HE1 5.000 . 5.000 4.572 4.132 4.986 . 0 0 "[ . 1 .]" 1
176 1 37 GLU HB3 1 38 PHE H 3.400 . 3.400 2.195 1.985 3.450 0.050 11 0 "[ . 1 .]" 1
177 1 38 PHE H 1 38 PHE HB3 2.800 . 2.800 2.642 2.413 2.855 0.055 9 0 "[ . 1 .]" 1
178 1 38 PHE H 1 38 PHE HE1 5.000 . 5.000 4.519 4.205 4.910 . 0 0 "[ . 1 .]" 1
179 1 38 PHE H 1 123 TYR HD1 5.000 . 5.000 3.651 3.245 3.935 . 0 0 "[ . 1 .]" 1
180 1 38 PHE H 1 123 TYR HE1 5.000 . 5.000 4.483 3.772 5.006 0.006 14 0 "[ . 1 .]" 1
181 1 38 PHE HA 1 38 PHE HD1 5.000 . 5.000 3.825 3.719 4.065 . 0 0 "[ . 1 .]" 1
182 1 38 PHE HB2 1 40 GLN H 5.600 2.400 5.600 5.386 5.000 5.568 . 0 0 "[ . 1 .]" 1
183 1 38 PHE HB2 1 154 LEU MD2 5.000 . 5.000 3.894 3.496 4.370 . 0 0 "[ . 1 .]" 1
184 1 38 PHE HB3 1 154 LEU MD2 5.000 . 5.000 4.944 4.523 5.175 0.175 15 0 "[ . 1 .]" 1
185 1 38 PHE HD1 1 40 GLN H 4.000 2.400 4.000 3.892 3.236 4.136 0.136 6 0 "[ . 1 .]" 1
186 1 38 PHE HD1 1 40 GLN HB2 5.000 . 5.000 4.644 4.148 5.028 0.028 14 0 "[ . 1 .]" 1
187 1 38 PHE HD1 1 147 GLU HB3 5.600 2.400 5.600 4.426 2.991 5.655 0.055 14 0 "[ . 1 .]" 1
188 1 38 PHE HD1 1 151 SER H 5.000 . 5.000 5.092 5.052 5.150 0.150 3 0 "[ . 1 .]" 1
189 1 38 PHE HD1 1 154 LEU MD2 5.000 . 5.000 4.694 3.636 5.084 0.084 11 0 "[ . 1 .]" 1
190 1 38 PHE HE1 1 40 GLN H 5.000 . 5.000 4.308 4.084 4.737 . 0 0 "[ . 1 .]" 1
191 1 38 PHE HE1 1 40 GLN HA 5.000 . 5.000 5.072 5.020 5.095 0.095 12 0 "[ . 1 .]" 1
192 1 38 PHE HE1 1 154 LEU MD2 5.000 . 5.000 4.658 4.305 5.006 0.006 7 0 "[ . 1 .]" 1
193 1 39 PRO HA 1 40 GLN H 2.800 . 2.800 2.212 2.197 2.229 . 0 0 "[ . 1 .]" 1
194 1 39 PRO HA 1 41 GLU H 5.000 . 5.000 3.485 3.357 3.648 . 0 0 "[ . 1 .]" 1
195 1 39 PRO HA 1 42 GLU H 5.000 . 5.000 4.465 4.252 4.599 . 0 0 "[ . 1 .]" 1
196 1 39 PRO HA 1 119 ALA MB 5.000 . 5.000 4.802 4.388 5.016 0.016 15 0 "[ . 1 .]" 1
197 1 39 PRO HB2 1 41 GLU H 5.000 . 5.000 3.893 3.476 4.188 . 0 0 "[ . 1 .]" 1
198 1 39 PRO HB2 1 119 ALA MB 2.800 . 2.800 2.629 2.404 2.810 0.010 13 0 "[ . 1 .]" 1
199 1 39 PRO HB2 1 123 TYR HD1 5.000 . 5.000 5.002 4.951 5.033 0.033 6 0 "[ . 1 .]" 1
200 1 39 PRO HB3 1 42 GLU H 4.000 2.400 4.000 3.970 3.728 4.085 0.085 14 0 "[ . 1 .]" 1
201 1 39 PRO HB3 1 119 ALA MB 3.400 . 3.400 2.902 2.448 3.198 . 0 0 "[ . 1 .]" 1
202 1 39 PRO HB3 1 120 VAL MG2 5.000 . 5.000 4.532 3.975 4.968 . 0 0 "[ . 1 .]" 1
203 1 40 GLN H 1 40 GLN HA . 2.400 3.400 2.816 2.805 2.829 . 0 0 "[ . 1 .]" 1
204 1 40 GLN H 1 41 GLU H 3.400 . 3.400 2.632 2.552 2.672 . 0 0 "[ . 1 .]" 1
205 1 40 GLN H 1 42 GLU H 5.000 . 5.000 4.405 4.118 4.518 . 0 0 "[ . 1 .]" 1
206 1 40 GLN H 1 43 PHE H 5.000 . 5.000 4.577 4.348 5.021 0.021 6 0 "[ . 1 .]" 1
207 1 40 GLN H 1 154 LEU MD2 5.000 . 5.000 4.955 4.623 5.067 0.067 7 0 "[ . 1 .]" 1
208 1 40 GLN HA 1 41 GLU H 5.000 . 5.000 3.497 3.464 3.529 . 0 0 "[ . 1 .]" 1
209 1 40 GLN HA 1 43 PHE H 5.000 . 5.000 2.852 2.725 3.249 . 0 0 "[ . 1 .]" 1
210 1 40 GLN HA 1 43 PHE HD1 5.000 . 5.000 5.167 5.018 5.206 0.206 8 0 "[ . 1 .]" 1
211 1 40 GLN HB2 1 44 ASP H 5.600 2.400 5.600 5.570 5.331 5.654 0.054 3 0 "[ . 1 .]" 1
212 1 40 GLN HG3 1 154 LEU MD2 5.000 . 5.000 3.690 2.838 5.027 0.027 14 0 "[ . 1 .]" 1
213 1 41 GLU H 1 41 GLU HB3 . . 2.800 2.637 2.469 2.803 0.003 14 0 "[ . 1 .]" 1
214 1 41 GLU H 1 42 GLU H . . 2.800 2.754 2.680 2.790 . 0 0 "[ . 1 .]" 1
215 1 41 GLU H 1 43 PHE H 5.000 . 5.000 3.785 3.656 4.452 . 0 0 "[ . 1 .]" 1
216 1 41 GLU HA 1 44 ASP H 5.000 . 5.000 3.905 3.756 4.193 . 0 0 "[ . 1 .]" 1
217 1 42 GLU H 1 42 GLU HG3 5.000 . 5.000 4.245 3.787 4.482 . 0 0 "[ . 1 .]" 1
218 1 42 GLU H 1 44 ASP H 5.000 . 5.000 3.910 3.679 4.095 . 0 0 "[ . 1 .]" 1
219 1 42 GLU HA 1 43 PHE H 4.000 2.400 4.000 3.453 3.420 3.566 . 0 0 "[ . 1 .]" 1
220 1 42 GLU HB2 1 43 PHE H 3.400 . 3.400 3.210 3.009 3.408 0.008 11 0 "[ . 1 .]" 1
221 1 42 GLU HB3 1 43 PHE H 5.000 . 5.000 3.579 3.029 4.130 . 0 0 "[ . 1 .]" 1
222 1 42 GLU HB3 1 43 PHE HD1 5.000 . 5.000 4.224 3.636 4.761 . 0 0 "[ . 1 .]" 1
223 1 42 GLU HG3 1 116 SER H 5.000 . 5.000 4.994 4.739 5.027 0.027 5 0 "[ . 1 .]" 1
224 1 42 GLU HG3 1 119 ALA HA 5.000 . 5.000 4.860 4.562 5.021 0.021 14 0 "[ . 1 .]" 1
225 1 43 PHE H 1 43 PHE HE1 5.600 2.400 5.600 5.526 5.089 5.683 0.083 6 0 "[ . 1 .]" 1
226 1 43 PHE H 1 44 ASP H . . 2.800 2.499 2.328 2.703 . 0 0 "[ . 1 .]" 1
227 1 43 PHE H 1 44 ASP HA 5.600 2.400 5.600 4.934 4.882 4.976 . 0 0 "[ . 1 .]" 1
228 1 43 PHE H 1 56 VAL MG2 5.000 . 5.000 4.952 4.616 5.043 0.043 14 0 "[ . 1 .]" 1
229 1 43 PHE HA 1 44 ASP H 5.000 . 5.000 3.318 3.083 3.477 . 0 0 "[ . 1 .]" 1
230 1 43 PHE HA 1 56 VAL MG2 5.000 . 5.000 4.423 4.172 4.839 . 0 0 "[ . 1 .]" 1
231 1 43 PHE HB3 1 44 ASP H 5.000 . 5.000 4.082 3.504 4.401 . 0 0 "[ . 1 .]" 1
232 1 43 PHE HD1 1 44 ASP H 5.600 2.400 5.600 5.036 4.647 5.387 . 0 0 "[ . 1 .]" 1
233 1 43 PHE HD1 1 57 LEU MD1 3.400 . 3.400 3.249 2.864 3.599 0.199 6 0 "[ . 1 .]" 1
234 1 43 PHE HD1 1 154 LEU MD2 5.000 . 5.000 4.085 3.574 4.507 . 0 0 "[ . 1 .]" 1
235 1 43 PHE HD1 1 155 SER H 5.600 2.400 5.600 5.634 5.611 5.666 0.066 6 0 "[ . 1 .]" 1
236 1 43 PHE HE1 1 53 ALA HA 5.000 . 5.000 4.548 4.064 4.816 . 0 0 "[ . 1 .]" 1
237 1 43 PHE HE1 1 56 VAL H 5.000 . 5.000 4.924 4.764 5.036 0.036 8 0 "[ . 1 .]" 1
238 1 43 PHE HE1 1 56 VAL MG2 5.000 . 5.000 3.682 3.522 4.069 . 0 0 "[ . 1 .]" 1
239 1 43 PHE HE1 1 57 LEU H 5.000 . 5.000 3.590 3.243 3.843 . 0 0 "[ . 1 .]" 1
240 1 43 PHE HE1 1 57 LEU MD1 5.000 . 5.000 2.076 1.711 2.466 0.089 6 0 "[ . 1 .]" 1
241 1 43 PHE HE1 1 57 LEU MD2 5.000 . 5.000 4.703 3.835 5.008 0.008 5 0 "[ . 1 .]" 1
242 1 43 PHE HE1 1 120 VAL MG2 5.000 . 5.000 4.442 4.044 5.009 0.009 6 0 "[ . 1 .]" 1
243 1 44 ASP H 1 44 ASP HB2 3.400 . 3.400 2.603 2.350 2.868 . 0 0 "[ . 1 .]" 1
244 1 44 ASP H 1 44 ASP HB3 3.400 . 3.400 2.568 2.467 2.799 . 0 0 "[ . 1 .]" 1
245 1 44 ASP H 1 158 LEU MD1 5.000 . 5.000 4.466 3.484 5.034 0.034 13 0 "[ . 1 .]" 1
246 1 44 ASP HB2 1 154 LEU MD2 5.000 . 5.000 5.044 5.016 5.073 0.073 11 0 "[ . 1 .]" 1
247 1 45 ASP HB2 1 46 LYS H 5.000 . 5.000 4.253 4.017 4.397 . 0 0 "[ . 1 .]" 1
248 1 45 ASP HB2 1 48 PHE H 5.000 . 5.000 4.744 4.395 5.027 0.027 12 0 "[ . 1 .]" 1
249 1 46 LYS H 1 46 LYS HB3 . . 2.800 2.708 2.533 2.808 0.008 4 0 "[ . 1 .]" 1
250 1 46 LYS H 1 47 GLN H . . 2.800 2.718 2.584 2.800 . 0 0 "[ . 1 .]" 1
251 1 46 LYS H 1 48 PHE H 5.000 . 5.000 4.688 4.179 5.010 0.010 6 0 "[ . 1 .]" 1
252 1 46 LYS H 1 48 PHE HB3 5.000 . 5.000 5.021 5.003 5.051 0.051 5 0 "[ . 1 .]" 1
253 1 46 LYS HB3 1 47 GLN H 5.000 . 5.000 3.133 2.477 4.082 . 0 0 "[ . 1 .]" 1
254 1 47 GLN H 1 48 PHE HB3 5.000 . 5.000 3.945 3.814 4.178 . 0 0 "[ . 1 .]" 1
255 1 47 GLN H 1 48 PHE HD1 5.600 2.400 5.600 5.657 5.479 5.762 0.162 6 0 "[ . 1 .]" 1
256 1 48 PHE H 1 48 PHE HB3 3.400 . 3.400 2.898 2.575 3.117 . 0 0 "[ . 1 .]" 1
257 1 48 PHE H 1 49 GLN H 5.000 . 5.000 4.348 4.252 4.482 . 0 0 "[ . 1 .]" 1
258 1 48 PHE HA 1 49 GLN H 2.800 . 2.800 2.233 2.138 2.317 . 0 0 "[ . 1 .]" 1
259 1 48 PHE HB3 1 48 PHE HD1 3.400 . 3.400 2.831 2.240 3.455 0.055 1 0 "[ . 1 .]" 1
260 1 48 PHE HB3 1 49 GLN H 5.000 . 5.000 3.837 3.533 4.174 . 0 0 "[ . 1 .]" 1
261 1 48 PHE HD1 1 49 GLN H 5.000 . 5.000 4.636 4.354 4.833 . 0 0 "[ . 1 .]" 1
262 1 48 PHE HD1 1 53 ALA MB 5.000 . 5.000 4.184 3.547 4.775 . 0 0 "[ . 1 .]" 1
263 1 48 PHE HD1 1 158 LEU HB3 5.000 . 5.000 4.484 3.875 5.072 0.072 9 0 "[ . 1 .]" 1
264 1 48 PHE HD1 1 158 LEU MD1 3.400 . 3.400 2.322 1.812 3.193 . 0 0 "[ . 1 .]" 1
265 1 48 PHE HE1 1 53 ALA HA 5.000 . 5.000 2.915 2.241 3.306 . 0 0 "[ . 1 .]" 1
266 1 48 PHE HE1 1 53 ALA MB . . 3.400 3.068 2.520 3.420 0.020 3 0 "[ . 1 .]" 1
267 1 48 PHE HE1 1 56 VAL H 5.600 2.400 5.600 5.369 4.770 5.630 0.030 1 0 "[ . 1 .]" 1
268 1 48 PHE HE1 1 57 LEU H 5.000 . 5.000 5.020 4.989 5.041 0.041 6 0 "[ . 1 .]" 1
269 1 48 PHE HE1 1 158 LEU MD1 3.400 . 3.400 3.420 3.206 3.467 0.067 10 0 "[ . 1 .]" 1
270 1 49 GLN H 1 49 GLN HG3 5.000 . 5.000 3.378 2.168 3.988 . 0 0 "[ . 1 .]" 1
271 1 49 GLN H 1 50 LYS H 5.000 . 5.000 4.376 4.349 4.428 . 0 0 "[ . 1 .]" 1
272 1 49 GLN HA 1 50 LYS H 2.800 . 2.800 2.645 2.588 2.684 . 0 0 "[ . 1 .]" 1
273 1 49 GLN HB3 1 159 GLN HA 5.000 . 5.000 4.970 4.519 5.070 0.070 8 0 "[ . 1 .]" 1
274 1 50 LYS H 1 50 LYS HB3 2.800 . 2.800 2.682 2.532 2.822 0.022 15 0 "[ . 1 .]" 1
275 1 50 LYS H 1 50 LYS HD3 5.000 . 5.000 4.199 2.864 4.965 . 0 0 "[ . 1 .]" 1
276 1 51 ALA H 1 51 ALA HA . . 2.800 2.794 2.764 2.835 0.035 12 0 "[ . 1 .]" 1
277 1 51 ALA H 1 51 ALA MB 2.800 . 2.800 2.087 2.034 2.165 . 0 0 "[ . 1 .]" 1
278 1 51 ALA H 1 52 GLN H . . 3.400 2.734 2.579 2.832 . 0 0 "[ . 1 .]" 1
279 1 51 ALA H 1 53 ALA H 5.000 . 5.000 4.194 4.097 4.292 . 0 0 "[ . 1 .]" 1
280 1 51 ALA H 1 54 ILE H 5.000 . 5.000 4.976 4.907 5.024 0.024 10 0 "[ . 1 .]" 1
281 1 51 ALA H 1 104 VAL MG2 5.000 . 5.000 4.702 4.286 5.003 0.003 14 0 "[ . 1 .]" 1
282 1 51 ALA HA 1 54 ILE HB 3.400 . 3.400 3.416 3.406 3.430 0.030 12 0 "[ . 1 .]" 1
283 1 51 ALA HA 1 54 ILE MD 5.000 . 5.000 3.860 3.582 4.167 . 0 0 "[ . 1 .]" 1
284 1 51 ALA HA 1 54 ILE MG 5.000 . 5.000 4.390 4.261 4.481 . 0 0 "[ . 1 .]" 1
285 1 51 ALA MB 1 52 GLN H 5.000 . 5.000 2.616 2.437 2.778 . 0 0 "[ . 1 .]" 1
286 1 51 ALA MB 1 99 CYS HB3 5.000 . 5.000 4.995 4.933 5.017 0.017 8 0 "[ . 1 .]" 1
287 1 51 ALA MB 1 104 VAL HB 5.000 . 5.000 3.494 2.604 4.385 . 0 0 "[ . 1 .]" 1
288 1 51 ALA MB 1 106 VAL MG1 5.000 . 5.000 2.085 1.794 2.753 0.006 5 0 "[ . 1 .]" 1
289 1 52 GLN H 1 53 ALA H . . 3.400 2.695 2.535 2.748 . 0 0 "[ . 1 .]" 1
290 1 52 GLN H 1 53 ALA MB 5.000 . 5.000 4.311 4.157 4.390 . 0 0 "[ . 1 .]" 1
291 1 52 GLN H 1 54 ILE H 5.000 . 5.000 4.168 4.034 4.281 . 0 0 "[ . 1 .]" 1
292 1 53 ALA H 1 53 ALA MB . . 3.400 2.146 2.079 2.232 . 0 0 "[ . 1 .]" 1
293 1 53 ALA H 1 54 ILE H 3.400 . 3.400 2.708 2.647 2.757 . 0 0 "[ . 1 .]" 1
294 1 53 ALA H 1 55 SER H 5.000 . 5.000 4.224 4.143 4.288 . 0 0 "[ . 1 .]" 1
295 1 53 ALA HA 1 54 ILE H 5.000 . 5.000 3.518 3.491 3.537 . 0 0 "[ . 1 .]" 1
296 1 53 ALA HA 1 56 VAL H 3.400 . 3.400 3.404 3.282 3.424 0.024 9 0 "[ . 1 .]" 1
297 1 53 ALA HA 1 57 LEU MD2 5.000 . 5.000 3.858 3.210 4.590 . 0 0 "[ . 1 .]" 1
298 1 53 ALA MB 1 54 ILE H . . 3.400 2.641 2.516 2.769 . 0 0 "[ . 1 .]" 1
299 1 53 ALA MB 1 54 ILE HA 5.000 . 5.000 3.761 3.714 3.837 . 0 0 "[ . 1 .]" 1
300 1 53 ALA MB 1 55 SER H 5.000 . 5.000 4.429 4.359 4.499 . 0 0 "[ . 1 .]" 1
301 1 53 ALA MB 1 57 LEU MD1 3.400 . 3.400 2.307 1.968 3.427 0.027 6 0 "[ . 1 .]" 1
302 1 54 ILE H 1 54 ILE HB 2.800 . 2.800 2.624 2.551 2.664 . 0 0 "[ . 1 .]" 1
303 1 54 ILE H 1 54 ILE HG12 2.800 . 2.800 1.982 1.949 2.072 . 0 0 "[ . 1 .]" 1
304 1 54 ILE H 1 55 SER H 3.400 . 3.400 2.725 2.704 2.766 . 0 0 "[ . 1 .]" 1
305 1 54 ILE HA 1 54 ILE MG 3.400 . 3.400 2.380 2.248 2.428 . 0 0 "[ . 1 .]" 1
306 1 54 ILE HA 1 55 SER H 5.000 . 5.000 3.508 3.498 3.533 . 0 0 "[ . 1 .]" 1
307 1 54 ILE HA 1 57 LEU MD2 5.000 . 5.000 3.130 2.550 3.682 . 0 0 "[ . 1 .]" 1
308 1 54 ILE HB 1 54 ILE HG12 2.800 . 2.800 2.426 2.412 2.445 . 0 0 "[ . 1 .]" 1
309 1 54 ILE HB 1 55 SER H 3.400 . 3.400 2.774 2.642 2.808 . 0 0 "[ . 1 .]" 1
310 1 54 ILE HB 1 104 VAL MG1 5.000 . 5.000 4.617 4.000 5.004 0.004 3 0 "[ . 1 .]" 1
311 1 54 ILE HB 1 106 VAL MG1 3.400 . 3.400 3.127 2.585 3.418 0.018 5 0 "[ . 1 .]" 1
312 1 54 ILE MD 1 57 LEU HB2 5.000 . 5.000 3.721 3.583 3.853 . 0 0 "[ . 1 .]" 1
313 1 54 ILE MD 1 96 LEU HA 5.000 . 5.000 2.792 2.082 3.999 . 0 0 "[ . 1 .]" 1
314 1 54 ILE MD 1 99 CYS HB3 5.000 . 5.000 3.864 3.106 4.714 . 0 0 "[ . 1 .]" 1
315 1 54 ILE MG 1 55 SER H 5.000 . 5.000 3.666 3.524 3.733 . 0 0 "[ . 1 .]" 1
316 1 54 ILE MG 1 55 SER HA 5.000 . 5.000 3.677 3.449 3.793 . 0 0 "[ . 1 .]" 1
317 1 54 ILE MG 1 58 HIS H 5.000 . 5.000 3.998 3.816 4.192 . 0 0 "[ . 1 .]" 1
318 1 54 ILE MG 1 58 HIS HB2 5.000 . 5.000 3.147 2.749 3.615 . 0 0 "[ . 1 .]" 1
319 1 55 SER H 1 56 VAL H 3.400 . 3.400 2.734 2.646 2.766 . 0 0 "[ . 1 .]" 1
320 1 55 SER H 1 57 LEU H 5.000 . 5.000 4.123 3.984 4.226 . 0 0 "[ . 1 .]" 1
321 1 55 SER H 1 57 LEU HB2 5.000 . 5.000 4.789 4.597 5.000 . 0 0 "[ . 1 .]" 1
322 1 55 SER H 1 58 HIS H 5.000 . 5.000 4.723 4.575 4.872 . 0 0 "[ . 1 .]" 1
323 1 55 SER H 1 106 VAL MG1 5.000 . 5.000 3.574 3.099 4.276 . 0 0 "[ . 1 .]" 1
324 1 55 SER HA 1 100 VAL MG2 5.000 . 5.000 4.318 3.147 5.018 0.018 2 0 "[ . 1 .]" 1
325 1 55 SER HB3 1 106 VAL MG1 5.000 . 5.000 3.872 2.321 4.683 . 0 0 "[ . 1 .]" 1
326 1 55 SER HB3 1 107 ILE HA 5.000 . 5.000 4.702 3.716 5.018 0.018 2 0 "[ . 1 .]" 1
327 1 56 VAL HA 1 56 VAL MG2 2.800 . 2.800 2.457 2.398 2.517 . 0 0 "[ . 1 .]" 1
328 1 56 VAL HA 1 59 GLU H 5.000 . 5.000 3.651 3.562 3.778 . 0 0 "[ . 1 .]" 1
329 1 56 VAL HA 1 59 GLU HB2 5.000 . 5.000 3.244 2.937 4.405 . 0 0 "[ . 1 .]" 1
330 1 56 VAL HA 1 60 MET H 5.000 . 5.000 3.999 3.842 4.193 . 0 0 "[ . 1 .]" 1
331 1 56 VAL HA 1 117 ILE MD 5.000 . 5.000 4.824 4.303 5.017 0.017 5 0 "[ . 1 .]" 1
332 1 56 VAL HB 1 57 LEU MD2 5.000 . 5.000 4.904 4.549 5.016 0.016 6 0 "[ . 1 .]" 1
333 1 56 VAL MG1 1 60 MET H 5.000 . 5.000 3.727 3.429 4.082 . 0 0 "[ . 1 .]" 1
334 1 56 VAL MG1 1 60 MET HB3 5.000 . 5.000 3.884 3.552 4.611 . 0 0 "[ . 1 .]" 1
335 1 57 LEU H 1 57 LEU HB2 3.400 . 3.400 2.244 2.053 2.330 . 0 0 "[ . 1 .]" 1
336 1 57 LEU H 1 57 LEU MD2 5.000 . 5.000 3.607 3.190 3.771 . 0 0 "[ . 1 .]" 1
337 1 57 LEU H 1 58 HIS H 3.400 . 3.400 2.876 2.826 2.919 . 0 0 "[ . 1 .]" 1
338 1 57 LEU H 1 59 GLU H 5.000 . 5.000 4.501 4.453 4.605 . 0 0 "[ . 1 .]" 1
339 1 57 LEU H 1 60 MET H 5.000 . 5.000 4.639 4.530 4.702 . 0 0 "[ . 1 .]" 1
340 1 57 LEU HA 1 57 LEU MD1 3.400 . 3.400 2.164 1.823 2.379 . 0 0 "[ . 1 .]" 1
341 1 57 LEU HA 1 120 VAL MG2 5.000 . 5.000 4.943 4.762 5.019 0.019 10 0 "[ . 1 .]" 1
342 1 57 LEU HB2 1 58 HIS H 5.000 . 5.000 2.736 2.646 3.173 . 0 0 "[ . 1 .]" 1
343 1 57 LEU HB3 1 58 HIS H 3.400 . 3.400 3.203 2.920 3.322 . 0 0 "[ . 1 .]" 1
344 1 57 LEU HB3 1 61 ILE H 5.000 . 5.000 4.756 4.526 5.021 0.021 6 0 "[ . 1 .]" 1
345 1 58 HIS H 1 58 HIS HB2 2.800 . 2.800 2.428 2.301 2.580 . 0 0 "[ . 1 .]" 1
346 1 58 HIS H 1 58 HIS HB3 2.800 . 2.800 2.649 2.498 2.805 0.005 6 0 "[ . 1 .]" 1
347 1 58 HIS H 1 58 HIS HD2 5.000 . 5.000 4.873 4.750 5.016 0.016 2 0 "[ . 1 .]" 1
348 1 58 HIS H 1 59 GLU H 3.400 . 3.400 2.841 2.796 2.901 . 0 0 "[ . 1 .]" 1
349 1 58 HIS H 1 60 MET HB3 5.000 . 5.000 4.999 4.933 5.012 0.012 9 0 "[ . 1 .]" 1
350 1 58 HIS HA 1 61 ILE H 5.000 . 5.000 3.835 3.697 3.947 . 0 0 "[ . 1 .]" 1
351 1 58 HIS HB2 1 97 GLU H 5.000 . 5.000 4.997 4.869 5.028 0.028 2 0 "[ . 1 .]" 1
352 1 58 HIS HB3 1 59 GLU H 3.400 . 3.400 2.403 2.378 2.449 . 0 0 "[ . 1 .]" 1
353 1 58 HIS HB3 1 60 MET H 5.000 . 5.000 4.796 4.672 4.906 . 0 0 "[ . 1 .]" 1
354 1 58 HIS HD2 1 93 LEU HB2 5.000 . 5.000 4.956 4.566 5.013 0.013 4 0 "[ . 1 .]" 1
355 1 58 HIS HD2 1 93 LEU MD1 5.000 . 5.000 3.892 3.493 4.485 . 0 0 "[ . 1 .]" 1
356 1 59 GLU H 1 60 MET H 3.400 . 3.400 2.580 2.497 2.628 . 0 0 "[ . 1 .]" 1
357 1 59 GLU H 1 117 ILE MD 5.000 . 5.000 4.542 3.992 5.007 0.007 14 0 "[ . 1 .]" 1
358 1 59 GLU HA 1 61 ILE H 5.000 . 5.000 4.579 4.407 4.675 . 0 0 "[ . 1 .]" 1
359 1 59 GLU HA 1 62 GLN H 5.000 . 5.000 3.536 3.318 3.674 . 0 0 "[ . 1 .]" 1
360 1 59 GLU HA 1 63 GLN H 5.000 . 5.000 3.952 3.611 4.498 . 0 0 "[ . 1 .]" 1
361 1 59 GLU HB3 1 117 ILE MG 3.400 . 3.400 3.315 2.656 3.425 0.025 4 0 "[ . 1 .]" 1
362 1 60 MET H 1 60 MET HB3 2.800 . 2.800 2.533 2.453 2.771 . 0 0 "[ . 1 .]" 1
363 1 60 MET H 1 120 VAL HB 5.000 . 5.000 4.951 4.711 5.012 0.012 1 0 "[ . 1 .]" 1
364 1 60 MET H 1 120 VAL MG1 5.000 . 5.000 3.421 3.005 3.715 . 0 0 "[ . 1 .]" 1
365 1 60 MET H 1 120 VAL MG2 5.000 . 5.000 3.193 2.965 3.489 . 0 0 "[ . 1 .]" 1
366 1 60 MET HA 1 61 ILE H 5.000 . 5.000 3.560 3.556 3.565 . 0 0 "[ . 1 .]" 1
367 1 60 MET HA 1 63 GLN H 5.000 . 5.000 3.762 3.282 3.928 . 0 0 "[ . 1 .]" 1
368 1 60 MET HA 1 120 VAL MG1 5.000 . 5.000 1.956 1.833 2.109 . 0 0 "[ . 1 .]" 1
369 1 60 MET HB3 1 61 ILE H 5.000 . 5.000 2.446 2.426 2.471 . 0 0 "[ . 1 .]" 1
370 1 60 MET HB3 1 62 GLN H 5.000 . 5.000 4.885 4.803 4.978 . 0 0 "[ . 1 .]" 1
371 1 61 ILE H 1 61 ILE MD 5.000 . 5.000 3.308 2.904 3.381 . 0 0 "[ . 1 .]" 1
372 1 61 ILE H 1 61 ILE HG12 2.800 . 2.800 2.092 1.972 2.154 . 0 0 "[ . 1 .]" 1
373 1 61 ILE H 1 61 ILE HG13 5.000 . 5.000 3.545 3.498 3.586 . 0 0 "[ . 1 .]" 1
374 1 61 ILE H 1 62 GLN H . . 3.400 2.596 2.562 2.670 . 0 0 "[ . 1 .]" 1
375 1 61 ILE H 1 93 LEU MD1 5.000 . 5.000 4.780 4.438 5.005 0.005 8 0 "[ . 1 .]" 1
376 1 61 ILE HA 1 62 GLN H 5.000 . 5.000 3.540 3.509 3.557 . 0 0 "[ . 1 .]" 1
377 1 61 ILE HA 1 64 THR H 3.400 . 3.400 3.396 3.324 3.418 0.018 7 0 "[ . 1 .]" 1
378 1 61 ILE HB 1 93 LEU MD1 5.000 . 5.000 2.824 2.296 3.123 . 0 0 "[ . 1 .]" 1
379 1 61 ILE HG13 1 62 GLN H 5.000 . 5.000 4.863 4.746 4.975 . 0 0 "[ . 1 .]" 1
380 1 61 ILE MG 1 62 GLN H 5.000 . 5.000 3.505 3.379 3.642 . 0 0 "[ . 1 .]" 1
381 1 61 ILE MG 1 62 GLN HA 5.000 . 5.000 3.549 3.416 3.713 . 0 0 "[ . 1 .]" 1
382 1 61 ILE MG 1 65 PHE H 5.000 . 5.000 3.917 3.550 4.212 . 0 0 "[ . 1 .]" 1
383 1 61 ILE MG 1 89 LEU HA 5.000 . 5.000 2.433 2.125 2.680 . 0 0 "[ . 1 .]" 1
384 1 61 ILE MG 1 89 LEU MD1 5.000 . 5.000 3.242 2.813 3.726 . 0 0 "[ . 1 .]" 1
385 1 61 ILE MG 1 89 LEU MD2 5.000 . 5.000 2.064 1.877 2.343 . 0 0 "[ . 1 .]" 1
386 1 61 ILE MG 1 92 GLN H 5.000 . 5.000 3.941 3.374 4.357 . 0 0 "[ . 1 .]" 1
387 1 61 ILE MG 1 92 GLN HB2 5.000 . 5.000 3.664 3.034 4.290 . 0 0 "[ . 1 .]" 1
388 1 61 ILE MG 1 93 LEU H 5.000 . 5.000 3.205 2.905 3.596 . 0 0 "[ . 1 .]" 1
389 1 61 ILE MG 1 93 LEU MD1 5.000 . 5.000 1.920 1.792 2.132 0.008 6 0 "[ . 1 .]" 1
390 1 62 GLN H 1 62 GLN HB2 2.800 . 2.800 2.272 2.149 2.408 . 0 0 "[ . 1 .]" 1
391 1 62 GLN H 1 62 GLN HB3 3.400 . 3.400 2.817 2.649 2.991 . 0 0 "[ . 1 .]" 1
392 1 62 GLN H 1 63 GLN H 2.800 . 2.800 2.695 2.559 2.780 . 0 0 "[ . 1 .]" 1
393 1 62 GLN H 1 93 LEU MD1 5.000 . 5.000 3.324 3.082 3.715 . 0 0 "[ . 1 .]" 1
394 1 62 GLN HA 1 62 GLN HB2 2.800 . 2.800 2.599 2.514 2.694 . 0 0 "[ . 1 .]" 1
395 1 62 GLN HA 1 93 LEU MD1 5.000 . 5.000 2.304 1.924 3.520 . 0 0 "[ . 1 .]" 1
396 1 62 GLN HB3 1 63 GLN H 2.800 . 2.800 2.712 2.533 2.802 0.002 10 0 "[ . 1 .]" 1
397 1 62 GLN HB3 1 63 GLN HA 5.000 . 5.000 4.049 3.932 4.172 . 0 0 "[ . 1 .]" 1
398 1 63 GLN H 1 63 GLN HB2 2.800 . 2.800 2.120 2.071 2.170 . 0 0 "[ . 1 .]" 1
399 1 63 GLN H 1 64 THR H 2.800 . 2.800 2.629 2.581 2.705 . 0 0 "[ . 1 .]" 1
400 1 63 GLN H 1 64 THR HB 5.000 . 5.000 4.893 4.820 5.018 0.018 6 0 "[ . 1 .]" 1
401 1 63 GLN H 1 120 VAL MG1 5.000 . 5.000 4.165 3.369 4.564 . 0 0 "[ . 1 .]" 1
402 1 63 GLN H 1 124 PHE HE1 5.600 2.400 5.600 5.068 4.350 5.449 . 0 0 "[ . 1 .]" 1
403 1 63 GLN HA 1 65 PHE H 5.000 . 5.000 4.316 4.100 4.877 . 0 0 "[ . 1 .]" 1
404 1 63 GLN HA 1 66 ASN H 5.000 . 5.000 3.553 3.414 4.144 . 0 0 "[ . 1 .]" 1
405 1 63 GLN HA 1 66 ASN HB3 3.400 . 3.400 3.296 3.058 3.405 0.005 2 0 "[ . 1 .]" 1
406 1 63 GLN HA 1 67 LEU H 5.000 . 5.000 4.486 4.012 4.683 . 0 0 "[ . 1 .]" 1
407 1 63 GLN HB2 1 64 THR H 3.400 . 3.400 3.320 3.111 3.412 0.012 6 0 "[ . 1 .]" 1
408 1 63 GLN HB3 1 64 THR H 2.800 . 2.800 2.695 2.593 2.805 0.005 2 0 "[ . 1 .]" 1
409 1 63 GLN HB3 1 124 PHE HD1 5.000 . 5.000 2.936 2.022 4.624 . 0 0 "[ . 1 .]" 1
410 1 64 THR H 1 64 THR HB 2.800 . 2.800 2.596 2.509 2.724 . 0 0 "[ . 1 .]" 1
411 1 64 THR H 1 65 PHE H 2.800 . 2.800 2.653 2.439 2.722 . 0 0 "[ . 1 .]" 1
412 1 64 THR H 1 65 PHE HB3 5.000 . 5.000 4.837 4.642 4.951 . 0 0 "[ . 1 .]" 1
413 1 64 THR H 1 89 LEU MD1 5.000 . 5.000 4.303 3.886 5.006 0.006 11 0 "[ . 1 .]" 1
414 1 64 THR H 1 89 LEU MD2 5.000 . 5.000 4.534 3.812 5.002 0.002 5 0 "[ . 1 .]" 1
415 1 64 THR H 1 124 PHE HE1 5.000 . 5.000 3.445 2.560 4.978 . 0 0 "[ . 1 .]" 1
416 1 64 THR HA 1 67 LEU H 3.400 . 3.400 3.361 3.236 3.414 0.014 14 0 "[ . 1 .]" 1
417 1 64 THR HB 1 65 PHE H 2.800 . 2.800 2.684 2.507 2.809 0.009 3 0 "[ . 1 .]" 1
418 1 64 THR MG 1 68 PHE HD1 5.000 . 5.000 2.828 2.332 3.248 . 0 0 "[ . 1 .]" 1
419 1 64 THR MG 1 68 PHE HE1 5.000 . 5.000 2.108 1.835 2.523 . 0 0 "[ . 1 .]" 1
420 1 64 THR MG 1 85 PHE HD1 5.000 . 5.000 4.700 4.052 5.030 0.030 3 0 "[ . 1 .]" 1
421 1 64 THR MG 1 89 LEU MD1 5.000 . 5.000 2.310 1.962 2.707 . 0 0 "[ . 1 .]" 1
422 1 64 THR MG 1 148 ILE HB 5.000 . 5.000 4.739 4.444 5.030 0.030 3 0 "[ . 1 .]" 1
423 1 64 THR MG 1 148 ILE MG 5.000 . 5.000 2.782 2.515 3.132 . 0 0 "[ . 1 .]" 1
424 1 65 PHE H 1 65 PHE HA 2.800 . 2.800 2.807 2.798 2.820 0.020 3 0 "[ . 1 .]" 1
425 1 65 PHE H 1 65 PHE HB3 2.800 . 2.800 2.489 2.398 2.585 . 0 0 "[ . 1 .]" 1
426 1 65 PHE H 1 65 PHE HD1 5.000 . 5.000 4.618 4.514 4.735 . 0 0 "[ . 1 .]" 1
427 1 65 PHE H 1 66 ASN H 3.400 . 3.400 2.694 2.587 2.796 . 0 0 "[ . 1 .]" 1
428 1 65 PHE H 1 89 LEU HB3 5.000 . 5.000 4.159 3.747 4.453 . 0 0 "[ . 1 .]" 1
429 1 65 PHE H 1 89 LEU MD1 5.000 . 5.000 2.709 2.398 3.408 . 0 0 "[ . 1 .]" 1
430 1 65 PHE H 1 89 LEU MD2 5.000 . 5.000 3.886 3.074 4.233 . 0 0 "[ . 1 .]" 1
431 1 65 PHE HA 1 68 PHE H 5.000 . 5.000 4.029 3.909 4.256 . 0 0 "[ . 1 .]" 1
432 1 65 PHE HA 1 69 SER H 5.000 . 5.000 3.984 3.877 4.153 . 0 0 "[ . 1 .]" 1
433 1 65 PHE HA 1 89 LEU MD1 5.000 . 5.000 1.880 1.828 1.952 . 0 0 "[ . 1 .]" 1
434 1 65 PHE HB3 1 89 LEU MD1 5.000 . 5.000 3.481 3.213 4.044 . 0 0 "[ . 1 .]" 1
435 1 65 PHE HD1 1 69 SER H 5.000 . 5.000 4.719 4.181 5.004 0.004 4 0 "[ . 1 .]" 1
436 1 65 PHE HD1 1 86 TYR HB3 5.000 . 5.000 3.809 3.415 4.196 . 0 0 "[ . 1 .]" 1
437 1 65 PHE HD1 1 89 LEU H 5.000 . 5.000 4.797 4.147 5.006 0.006 14 0 "[ . 1 .]" 1
438 1 65 PHE HD1 1 89 LEU MD1 5.000 . 5.000 2.271 1.958 2.753 . 0 0 "[ . 1 .]" 1
439 1 65 PHE HD1 1 90 ASP H 5.000 . 5.000 4.698 3.982 5.001 0.001 10 0 "[ . 1 .]" 1
440 1 65 PHE HD1 1 93 LEU MD1 5.000 . 5.000 4.971 4.803 5.010 0.010 5 0 "[ . 1 .]" 1
441 1 66 ASN H 1 66 ASN HB3 2.800 . 2.800 2.665 2.565 2.800 0.000 13 0 "[ . 1 .]" 1
442 1 66 ASN H 1 67 LEU H 3.400 . 3.400 2.571 2.428 2.674 . 0 0 "[ . 1 .]" 1
443 1 66 ASN H 1 68 PHE H 5.000 . 5.000 4.734 4.450 4.847 . 0 0 "[ . 1 .]" 1
444 1 66 ASN H 1 69 SER H 5.000 . 5.000 4.793 4.624 4.883 . 0 0 "[ . 1 .]" 1
445 1 66 ASN H 1 89 LEU MD1 5.000 . 5.000 4.400 4.224 4.851 . 0 0 "[ . 1 .]" 1
446 1 66 ASN HB3 1 67 LEU H 3.400 . 3.400 2.900 2.749 2.934 . 0 0 "[ . 1 .]" 1
447 1 67 LEU H 1 67 LEU HA 2.800 . 2.800 2.786 2.781 2.795 . 0 0 "[ . 1 .]" 1
448 1 67 LEU H 1 67 LEU HB3 2.800 . 2.800 2.780 2.455 2.836 0.036 3 0 "[ . 1 .]" 1
449 1 67 LEU H 1 67 LEU MD1 5.000 . 5.000 3.771 3.616 4.220 . 0 0 "[ . 1 .]" 1
450 1 67 LEU H 1 67 LEU HG 5.000 . 5.000 4.447 4.297 4.522 . 0 0 "[ . 1 .]" 1
451 1 67 LEU H 1 68 PHE H 3.400 . 3.400 2.925 2.828 2.953 . 0 0 "[ . 1 .]" 1
452 1 67 LEU H 1 68 PHE HD1 5.000 . 5.000 4.652 4.388 4.934 . 0 0 "[ . 1 .]" 1
453 1 67 LEU H 1 69 SER H 5.000 . 5.000 4.008 3.870 4.179 . 0 0 "[ . 1 .]" 1
454 1 67 LEU H 1 70 THR MG 5.000 . 5.000 4.888 4.595 5.011 0.011 12 0 "[ . 1 .]" 1
455 1 67 LEU H 1 124 PHE HE1 5.000 . 5.000 4.720 3.646 5.024 0.024 14 0 "[ . 1 .]" 1
456 1 67 LEU HB3 1 68 PHE H 3.400 . 3.400 2.195 2.148 2.384 . 0 0 "[ . 1 .]" 1
457 1 67 LEU MD1 1 68 PHE H 5.000 . 5.000 4.635 4.436 4.695 . 0 0 "[ . 1 .]" 1
458 1 67 LEU MD1 1 124 PHE HA 5.000 . 5.000 4.913 4.664 5.010 0.010 14 0 "[ . 1 .]" 1
459 1 67 LEU MD1 1 124 PHE HD1 5.000 . 5.000 4.272 2.571 5.031 0.031 14 0 "[ . 1 .]" 1
460 1 67 LEU MD1 1 124 PHE HE1 5.000 . 5.000 3.393 2.388 4.096 . 0 0 "[ . 1 .]" 1
461 1 67 LEU MD1 1 127 ILE HB 5.000 . 5.000 3.753 3.595 3.941 . 0 0 "[ . 1 .]" 1
462 1 67 LEU MD1 1 127 ILE MD 5.000 . 5.000 3.446 3.049 3.805 . 0 0 "[ . 1 .]" 1
463 1 67 LEU MD1 1 127 ILE MG 3.400 . 3.400 3.154 2.363 3.408 0.008 15 0 "[ . 1 .]" 1
464 1 67 LEU MD1 1 128 THR HA 5.000 . 5.000 4.548 4.082 5.008 0.008 11 0 "[ . 1 .]" 1
465 1 67 LEU MD1 1 128 THR MG 5.000 . 5.000 4.147 3.590 4.799 . 0 0 "[ . 1 .]" 1
466 1 67 LEU MD1 1 131 LEU MD2 5.000 . 5.000 4.162 3.558 4.895 . 0 0 "[ . 1 .]" 1
467 1 67 LEU HG 1 68 PHE H 5.000 . 5.000 4.096 3.889 4.600 . 0 0 "[ . 1 .]" 1
468 1 68 PHE H 1 68 PHE HD1 3.400 . 3.400 2.587 2.356 2.950 . 0 0 "[ . 1 .]" 1
469 1 68 PHE H 1 68 PHE HE1 5.000 . 5.000 4.439 4.167 4.773 . 0 0 "[ . 1 .]" 1
470 1 68 PHE H 1 69 SER H 2.800 . 2.800 2.464 2.418 2.517 . 0 0 "[ . 1 .]" 1
471 1 68 PHE H 1 86 TYR HE1 5.000 . 5.000 4.016 3.734 4.308 . 0 0 "[ . 1 .]" 1
472 1 68 PHE HD1 1 82 LEU MD1 5.000 . 5.000 4.668 4.154 5.014 0.014 7 0 "[ . 1 .]" 1
473 1 68 PHE HD1 1 82 LEU MD2 5.000 . 5.000 3.959 3.577 4.105 . 0 0 "[ . 1 .]" 1
474 1 68 PHE HE1 1 82 LEU MD2 5.000 . 5.000 4.858 4.478 5.028 0.028 14 0 "[ . 1 .]" 1
475 1 68 PHE HE1 1 89 LEU MD2 5.000 . 5.000 4.497 3.582 4.969 . 0 0 "[ . 1 .]" 1
476 1 68 PHE HE1 1 148 ILE MD 5.000 . 5.000 3.078 2.560 3.674 . 0 0 "[ . 1 .]" 1
477 1 68 PHE HE1 1 148 ILE MG 5.000 . 5.000 4.641 4.198 5.008 0.008 14 0 "[ . 1 .]" 1
478 1 69 SER H 1 69 SER HA 2.800 . 2.800 2.788 2.774 2.824 0.024 14 0 "[ . 1 .]" 1
479 1 69 SER H 1 69 SER HB2 3.400 . 3.400 2.455 2.333 2.590 . 0 0 "[ . 1 .]" 1
480 1 69 SER H 1 69 SER HB3 3.400 . 3.400 2.613 2.491 2.740 . 0 0 "[ . 1 .]" 1
481 1 69 SER H 1 70 THR H 2.800 . 2.800 2.782 2.612 2.814 0.014 7 0 "[ . 1 .]" 1
482 1 69 SER H 1 70 THR MG 5.000 . 5.000 4.894 4.410 5.006 0.006 11 0 "[ . 1 .]" 1
483 1 69 SER H 1 82 LEU MD2 5.000 . 5.000 5.046 5.005 5.065 0.065 4 0 "[ . 1 .]" 1
484 1 69 SER H 1 86 TYR HD1 5.000 . 5.000 4.164 3.977 4.675 . 0 0 "[ . 1 .]" 1
485 1 69 SER H 1 86 TYR HE1 5.000 . 5.000 2.538 2.198 3.458 . 0 0 "[ . 1 .]" 1
486 1 69 SER HB2 1 70 THR H 5.000 . 5.000 4.221 4.102 4.297 . 0 0 "[ . 1 .]" 1
487 1 69 SER HB2 1 89 LEU MD1 5.000 . 5.000 4.934 4.770 5.016 0.016 3 0 "[ . 1 .]" 1
488 1 69 SER HB3 1 70 THR H 5.000 . 5.000 3.253 3.095 3.377 . 0 0 "[ . 1 .]" 1
489 1 70 THR H 1 70 THR HB 3.400 . 3.400 3.380 2.515 3.490 0.090 1 0 "[ . 1 .]" 1
490 1 70 THR H 1 70 THR MG . . 3.400 3.045 2.375 3.169 . 0 0 "[ . 1 .]" 1
491 1 70 THR H 1 71 LYS H 2.800 . 2.800 2.734 2.576 2.848 0.048 7 0 "[ . 1 .]" 1
492 1 70 THR H 1 72 ASP H 5.000 . 5.000 4.625 3.875 5.002 0.002 3 0 "[ . 1 .]" 1
493 1 70 THR H 1 73 SER H 5.000 . 5.000 4.879 4.606 5.010 0.010 7 0 "[ . 1 .]" 1
494 1 70 THR HA 1 70 THR MG 2.800 . 2.800 2.153 2.027 3.146 0.346 8 0 "[ . 1 .]" 1
495 1 70 THR HB 1 71 LYS H 5.000 . 5.000 3.155 2.362 4.320 . 0 0 "[ . 1 .]" 1
496 1 70 THR MG 1 71 LYS H 5.000 . 5.000 3.989 2.821 4.475 . 0 0 "[ . 1 .]" 1
497 1 70 THR MG 1 72 ASP H 5.000 . 5.000 4.326 1.905 4.598 . 0 0 "[ . 1 .]" 1
498 1 71 LYS H 1 71 LYS HA 2.800 . 2.800 2.543 2.289 2.780 . 0 0 "[ . 1 .]" 1
499 1 71 LYS H 1 72 ASP H 3.400 . 3.400 2.620 2.165 3.395 . 0 0 "[ . 1 .]" 1
500 1 71 LYS H 1 72 ASP HB2 5.000 . 5.000 4.372 3.699 5.008 0.008 9 0 "[ . 1 .]" 1
501 1 71 LYS HB3 1 72 ASP H 3.400 . 3.400 2.757 2.441 3.414 0.014 14 0 "[ . 1 .]" 1
502 1 72 ASP H 1 72 ASP HA 2.800 . 2.800 2.757 2.726 2.814 0.014 13 0 "[ . 1 .]" 1
503 1 72 ASP H 1 72 ASP HB3 3.400 2.400 3.400 3.194 2.730 3.409 0.009 8 0 "[ . 1 .]" 1
504 1 72 ASP H 1 73 SER H 3.400 . 3.400 3.130 2.902 3.275 . 0 0 "[ . 1 .]" 1
505 1 72 ASP H 1 75 ALA H 5.000 . 5.000 4.963 4.830 5.016 0.016 12 0 "[ . 1 .]" 1
506 1 72 ASP HA 1 75 ALA H 5.000 . 5.000 4.087 3.955 4.189 . 0 0 "[ . 1 .]" 1
507 1 72 ASP HB3 1 73 SER H 3.400 . 3.400 2.140 1.966 2.553 . 0 0 "[ . 1 .]" 1
508 1 72 ASP HB3 1 75 ALA H 5.600 2.400 5.600 5.554 5.430 5.611 0.011 5 0 "[ . 1 .]" 1
509 1 73 SER H 1 141 TRP HH2 5.000 . 5.000 4.376 3.532 5.004 0.004 11 0 "[ . 1 .]" 1
510 1 74 SER H 1 74 SER HA 2.800 . 2.800 2.781 2.771 2.788 . 0 0 "[ . 1 .]" 1
511 1 74 SER H 1 74 SER HB3 2.800 . 2.800 2.469 2.160 2.819 0.019 4 0 "[ . 1 .]" 1
512 1 74 SER H 1 75 ALA H 2.800 . 2.800 2.741 2.707 2.767 . 0 0 "[ . 1 .]" 1
513 1 74 SER H 1 75 ALA MB 5.000 . 5.000 4.404 4.293 4.486 . 0 0 "[ . 1 .]" 1
514 1 74 SER H 1 76 ALA H 5.000 . 5.000 3.946 3.819 4.234 . 0 0 "[ . 1 .]" 1
515 1 74 SER H 1 82 LEU MD2 5.000 . 5.000 4.202 3.824 4.369 . 0 0 "[ . 1 .]" 1
516 1 74 SER HA 1 82 LEU MD2 5.000 . 5.000 2.157 1.906 2.477 . 0 0 "[ . 1 .]" 1
517 1 74 SER HB3 1 75 ALA H 3.400 . 3.400 2.779 2.497 3.010 . 0 0 "[ . 1 .]" 1
518 1 75 ALA H 1 75 ALA HA 3.400 2.400 3.400 2.856 2.828 2.885 . 0 0 "[ . 1 .]" 1
519 1 75 ALA H 1 75 ALA MB 2.800 . 2.800 2.174 2.037 2.266 . 0 0 "[ . 1 .]" 1
520 1 75 ALA H 1 76 ALA H 2.800 . 2.800 2.565 2.491 2.625 . 0 0 "[ . 1 .]" 1
521 1 75 ALA H 1 76 ALA MB 5.000 . 5.000 4.144 3.984 4.246 . 0 0 "[ . 1 .]" 1
522 1 75 ALA H 1 82 LEU MD2 5.000 . 5.000 4.991 4.899 5.021 0.021 13 0 "[ . 1 .]" 1
523 1 76 ALA H 1 77 LEU H 2.800 . 2.800 2.471 2.439 2.523 . 0 0 "[ . 1 .]" 1
524 1 76 ALA H 1 77 LEU MD1 5.000 . 5.000 4.350 3.199 5.003 0.003 11 0 "[ . 1 .]" 1
525 1 76 ALA MB 1 77 LEU H 2.800 . 2.800 2.673 2.505 2.802 0.002 10 0 "[ . 1 .]" 1
526 1 76 ALA MB 1 141 TRP HB2 5.000 . 5.000 4.194 3.625 4.614 . 0 0 "[ . 1 .]" 1
527 1 76 ALA MB 1 141 TRP HD1 . . 3.400 3.151 2.629 3.420 0.020 10 0 "[ . 1 .]" 1
528 1 77 LEU H 1 78 ASP H 5.000 . 5.000 4.512 4.476 4.552 . 0 0 "[ . 1 .]" 1
529 1 77 LEU H 1 82 LEU MD1 5.000 . 5.000 5.007 4.452 5.063 0.063 4 0 "[ . 1 .]" 1
530 1 77 LEU H 1 82 LEU MD2 5.000 . 5.000 3.252 2.932 4.242 . 0 0 "[ . 1 .]" 1
531 1 78 ASP H 1 79 GLU H 5.000 . 5.000 4.624 4.482 4.649 . 0 0 "[ . 1 .]" 1
532 1 78 ASP H 1 81 LEU HB3 3.400 . 3.400 3.398 3.309 3.415 0.015 14 0 "[ . 1 .]" 1
533 1 78 ASP H 1 81 LEU MD1 5.000 . 5.000 4.766 4.514 5.011 0.011 12 0 "[ . 1 .]" 1
534 1 78 ASP HA 1 79 GLU H 2.800 . 2.800 2.246 2.155 2.307 . 0 0 "[ . 1 .]" 1
535 1 79 GLU H 1 79 GLU HB3 3.400 . 3.400 3.131 2.507 3.525 0.125 5 0 "[ . 1 .]" 1
536 1 79 GLU H 1 80 THR H 3.400 . 3.400 2.774 2.698 2.873 . 0 0 "[ . 1 .]" 1
537 1 79 GLU H 1 81 LEU H 5.000 . 5.000 4.503 4.419 4.567 . 0 0 "[ . 1 .]" 1
538 1 79 GLU H 1 82 LEU HB3 5.000 . 5.000 4.935 4.669 5.014 0.014 12 0 "[ . 1 .]" 1
539 1 79 GLU HA 1 80 THR H 5.000 . 5.000 3.516 3.494 3.541 . 0 0 "[ . 1 .]" 1
540 1 79 GLU HA 1 82 LEU H 5.000 . 5.000 3.569 3.498 3.632 . 0 0 "[ . 1 .]" 1
541 1 79 GLU HA 1 82 LEU HB2 3.400 . 3.400 3.196 3.057 3.413 0.013 14 0 "[ . 1 .]" 1
542 1 79 GLU HA 1 82 LEU HB3 3.400 . 3.400 2.591 2.400 2.696 . 0 0 "[ . 1 .]" 1
543 1 79 GLU HA 1 82 LEU MD2 5.000 . 5.000 4.937 3.716 5.041 0.041 11 0 "[ . 1 .]" 1
544 1 80 THR H 1 80 THR HB . . 2.800 2.660 2.548 2.772 . 0 0 "[ . 1 .]" 1
545 1 80 THR H 1 81 LEU H 2.800 . 2.800 2.686 2.614 2.765 . 0 0 "[ . 1 .]" 1
546 1 80 THR HA 1 80 THR MG . . 2.800 2.292 2.200 2.399 . 0 0 "[ . 1 .]" 1
547 1 80 THR HA 1 83 ASP HB3 5.000 . 5.000 3.197 3.019 3.391 . 0 0 "[ . 1 .]" 1
548 1 80 THR HB 1 81 LEU H 3.400 . 3.400 2.365 2.349 2.414 . 0 0 "[ . 1 .]" 1
549 1 80 THR MG 1 81 LEU H 5.000 . 5.000 3.551 3.404 3.687 . 0 0 "[ . 1 .]" 1
550 1 81 LEU H 1 81 LEU HB2 2.800 . 2.800 2.269 2.137 2.397 . 0 0 "[ . 1 .]" 1
551 1 81 LEU H 1 81 LEU MD1 5.000 . 5.000 4.242 4.165 4.307 . 0 0 "[ . 1 .]" 1
552 1 81 LEU H 1 81 LEU MD2 5.000 . 5.000 3.699 3.413 3.904 . 0 0 "[ . 1 .]" 1
553 1 81 LEU H 1 81 LEU HG 5.000 . 5.000 4.550 4.444 4.598 . 0 0 "[ . 1 .]" 1
554 1 81 LEU H 1 82 LEU H . . 2.800 2.526 2.493 2.570 . 0 0 "[ . 1 .]" 1
555 1 81 LEU HA 1 81 LEU MD1 3.400 . 3.400 2.726 2.443 2.958 . 0 0 "[ . 1 .]" 1
556 1 81 LEU HA 1 81 LEU MD2 2.800 . 2.800 2.007 1.920 2.182 . 0 0 "[ . 1 .]" 1
557 1 81 LEU HA 1 82 LEU H 5.000 . 5.000 3.511 3.499 3.532 . 0 0 "[ . 1 .]" 1
558 1 81 LEU HA 1 84 GLU H 5.000 . 5.000 3.584 3.478 3.981 . 0 0 "[ . 1 .]" 1
559 1 81 LEU HB2 1 81 LEU MD2 3.400 . 3.400 2.352 2.238 2.404 . 0 0 "[ . 1 .]" 1
560 1 81 LEU HB3 1 82 LEU H 3.400 . 3.400 2.701 2.548 2.817 . 0 0 "[ . 1 .]" 1
561 1 81 LEU MD1 1 84 GLU H 5.000 . 5.000 4.460 4.293 4.656 . 0 0 "[ . 1 .]" 1
562 1 81 LEU MD2 1 84 GLU H 5.000 . 5.000 4.749 4.474 4.964 . 0 0 "[ . 1 .]" 1
563 1 82 LEU H 1 82 LEU MD1 5.000 . 5.000 4.248 3.790 4.336 . 0 0 "[ . 1 .]" 1
564 1 82 LEU H 1 82 LEU MD2 5.000 . 5.000 3.726 3.485 4.378 . 0 0 "[ . 1 .]" 1
565 1 82 LEU H 1 82 LEU HG 5.000 . 5.000 4.497 4.404 4.559 . 0 0 "[ . 1 .]" 1
566 1 82 LEU H 1 83 ASP HB3 5.000 . 5.000 4.932 4.837 5.001 0.001 7 0 "[ . 1 .]" 1
567 1 82 LEU HA 1 82 LEU MD1 3.400 . 3.400 2.859 2.111 3.121 . 0 0 "[ . 1 .]" 1
568 1 82 LEU HA 1 83 ASP H 5.000 . 5.000 3.544 3.519 3.559 . 0 0 "[ . 1 .]" 1
569 1 82 LEU HA 1 84 GLU H 5.000 . 5.000 4.248 3.679 4.575 . 0 0 "[ . 1 .]" 1
570 1 82 LEU HA 1 85 PHE HB3 5.000 . 5.000 3.214 2.663 3.682 . 0 0 "[ . 1 .]" 1
571 1 82 LEU HB2 1 82 LEU MD2 2.800 . 2.800 2.468 2.402 2.550 . 0 0 "[ . 1 .]" 1
572 1 82 LEU HB3 1 82 LEU MD1 3.400 . 3.400 2.248 2.049 3.170 . 0 0 "[ . 1 .]" 1
573 1 82 LEU HB3 1 82 LEU MD2 3.400 . 3.400 3.123 2.279 3.185 . 0 0 "[ . 1 .]" 1
574 1 82 LEU HB3 1 83 ASP H 3.400 . 3.400 2.561 2.368 2.913 . 0 0 "[ . 1 .]" 1
575 1 82 LEU MD1 1 85 PHE HB2 5.000 . 5.000 3.924 2.543 4.424 . 0 0 "[ . 1 .]" 1
576 1 82 LEU MD1 1 85 PHE HB3 5.000 . 5.000 3.300 3.050 3.762 . 0 0 "[ . 1 .]" 1
577 1 82 LEU MD1 1 85 PHE HD1 5.000 . 5.000 4.742 1.899 5.010 0.010 4 0 "[ . 1 .]" 1
578 1 82 LEU MD1 1 86 TYR H 5.000 . 5.000 4.061 3.779 5.047 0.047 14 0 "[ . 1 .]" 1
579 1 82 LEU MD1 1 86 TYR HE1 5.000 . 5.000 2.820 2.308 4.738 . 0 0 "[ . 1 .]" 1
580 1 82 LEU MD2 1 83 ASP H 5.000 . 5.000 4.533 4.383 4.624 . 0 0 "[ . 1 .]" 1
581 1 82 LEU MD2 1 85 PHE H 5.000 . 5.000 4.478 4.272 5.104 0.104 14 0 "[ . 1 .]" 1
582 1 82 LEU MD2 1 85 PHE HB3 5.000 . 5.000 3.102 2.500 3.701 . 0 0 "[ . 1 .]" 1
583 1 82 LEU MD2 1 85 PHE HD1 5.000 . 5.000 3.663 3.140 4.078 . 0 0 "[ . 1 .]" 1
584 1 82 LEU MD2 1 85 PHE HE1 5.000 . 5.000 4.929 4.685 5.058 0.058 14 0 "[ . 1 .]" 1
585 1 82 LEU MD2 1 86 TYR H 5.000 . 5.000 4.816 4.466 5.014 0.014 4 0 "[ . 1 .]" 1
586 1 82 LEU MD2 1 86 TYR HE1 5.000 . 5.000 3.779 2.801 4.139 . 0 0 "[ . 1 .]" 1
587 1 83 ASP H 1 83 ASP HA 2.800 . 2.800 2.805 2.760 2.824 0.024 6 0 "[ . 1 .]" 1
588 1 83 ASP H 1 83 ASP HB3 2.800 . 2.800 2.614 2.542 2.688 . 0 0 "[ . 1 .]" 1
589 1 83 ASP H 1 84 GLU H . . 3.400 2.664 2.571 2.744 . 0 0 "[ . 1 .]" 1
590 1 83 ASP H 1 85 PHE H 5.000 . 5.000 3.940 3.734 4.092 . 0 0 "[ . 1 .]" 1
591 1 83 ASP HA 1 84 GLU H 5.000 . 5.000 3.509 3.476 3.548 . 0 0 "[ . 1 .]" 1
592 1 83 ASP HA 1 87 ILE H 5.000 . 5.000 5.008 4.888 5.031 0.031 7 0 "[ . 1 .]" 1
593 1 83 ASP HB3 1 84 GLU H 5.000 . 5.000 2.705 2.450 2.898 . 0 0 "[ . 1 .]" 1
594 1 84 GLU H 1 84 GLU HB2 3.400 . 3.400 2.112 2.105 2.118 . 0 0 "[ . 1 .]" 1
595 1 84 GLU H 1 84 GLU HB3 3.400 . 3.400 3.403 3.390 3.409 0.009 1 0 "[ . 1 .]" 1
596 1 84 GLU H 1 84 GLU HG3 3.400 . 3.400 3.286 3.215 3.354 . 0 0 "[ . 1 .]" 1
597 1 84 GLU H 1 85 PHE H 5.000 . 5.000 2.452 2.410 2.481 . 0 0 "[ . 1 .]" 1
598 1 84 GLU H 1 85 PHE HB3 5.000 . 5.000 5.032 4.898 5.076 0.076 11 0 "[ . 1 .]" 1
599 1 84 GLU H 1 87 ILE MD 5.000 . 5.000 4.416 4.041 5.001 0.001 10 0 "[ . 1 .]" 1
600 1 84 GLU HA 1 84 GLU HB3 2.800 . 2.800 2.751 2.743 2.764 . 0 0 "[ . 1 .]" 1
601 1 84 GLU HA 1 87 ILE H 5.000 . 5.000 3.469 3.372 3.562 . 0 0 "[ . 1 .]" 1
602 1 84 GLU HA 1 87 ILE MD 3.400 . 3.400 2.257 1.950 2.912 . 0 0 "[ . 1 .]" 1
603 1 84 GLU HA 1 87 ILE MG 5.000 . 5.000 4.589 4.317 4.792 . 0 0 "[ . 1 .]" 1
604 1 84 GLU HB3 1 87 ILE MD 5.000 . 5.000 4.417 4.111 4.998 . 0 0 "[ . 1 .]" 1
605 1 85 PHE HA 1 85 PHE HD1 4.000 2.400 4.000 3.731 3.289 4.105 0.105 6 0 "[ . 1 .]" 1
606 1 85 PHE HE1 1 89 LEU MD2 5.000 . 5.000 4.305 2.562 5.040 0.040 14 0 "[ . 1 .]" 1
607 1 86 TYR H 1 86 TYR HA 2.800 . 2.800 2.789 2.765 2.822 0.022 12 0 "[ . 1 .]" 1
608 1 86 TYR H 1 86 TYR HD1 3.400 . 3.400 3.251 3.109 3.402 0.002 11 0 "[ . 1 .]" 1
609 1 86 TYR H 1 86 TYR HE1 5.000 . 5.000 4.815 4.560 5.012 0.012 8 0 "[ . 1 .]" 1
610 1 86 TYR H 1 87 ILE H . . 3.400 2.802 2.711 2.882 . 0 0 "[ . 1 .]" 1
611 1 86 TYR HA 1 87 ILE H 5.000 . 5.000 3.552 3.509 3.561 . 0 0 "[ . 1 .]" 1
612 1 86 TYR HA 1 89 LEU H 4.000 2.400 4.000 3.755 3.548 3.990 . 0 0 "[ . 1 .]" 1
613 1 86 TYR HA 1 89 LEU MD1 5.000 . 5.000 3.063 2.220 3.362 . 0 0 "[ . 1 .]" 1
614 1 86 TYR HB3 1 87 ILE H 5.000 . 5.000 3.496 3.348 3.889 . 0 0 "[ . 1 .]" 1
615 1 86 TYR HD1 1 89 LEU MD1 5.000 . 5.000 3.374 2.582 3.699 . 0 0 "[ . 1 .]" 1
616 1 86 TYR HE1 1 89 LEU MD1 5.000 . 5.000 4.631 3.898 4.976 . 0 0 "[ . 1 .]" 1
617 1 87 ILE H 1 87 ILE HB . . 3.400 2.635 2.610 2.658 . 0 0 "[ . 1 .]" 1
618 1 87 ILE H 1 87 ILE MD 5.000 . 5.000 3.123 2.667 3.583 . 0 0 "[ . 1 .]" 1
619 1 87 ILE H 1 87 ILE HG12 5.000 . 5.000 3.436 3.123 3.567 . 0 0 "[ . 1 .]" 1
620 1 87 ILE H 1 87 ILE HG13 5.000 . 5.000 1.980 1.947 2.016 . 0 0 "[ . 1 .]" 1
621 1 87 ILE H 1 88 GLU H 3.400 . 3.400 2.637 2.495 2.711 . 0 0 "[ . 1 .]" 1
622 1 87 ILE H 1 89 LEU H 5.000 . 5.000 4.422 4.152 4.524 . 0 0 "[ . 1 .]" 1
623 1 87 ILE HA 1 87 ILE HG12 3.400 . 3.400 2.845 2.556 3.074 . 0 0 "[ . 1 .]" 1
624 1 87 ILE HA 1 87 ILE HG13 3.400 . 3.400 2.844 2.649 3.174 . 0 0 "[ . 1 .]" 1
625 1 87 ILE HA 1 87 ILE MG 2.800 . 2.800 2.325 2.221 2.388 . 0 0 "[ . 1 .]" 1
626 1 87 ILE HA 1 88 GLU H 5.000 . 5.000 3.514 3.507 3.528 . 0 0 "[ . 1 .]" 1
627 1 87 ILE HA 1 90 ASP H 5.000 . 5.000 3.488 3.278 3.814 . 0 0 "[ . 1 .]" 1
628 1 87 ILE HA 1 90 ASP HB2 5.000 . 5.000 3.134 2.706 3.665 . 0 0 "[ . 1 .]" 1
629 1 87 ILE HA 1 90 ASP HB3 5.000 . 5.000 2.673 2.393 2.966 . 0 0 "[ . 1 .]" 1
630 1 87 ILE HB 1 87 ILE MD 2.800 . 2.800 2.224 2.054 2.504 . 0 0 "[ . 1 .]" 1
631 1 87 ILE HG12 1 87 ILE MG 3.400 . 3.400 2.196 1.979 2.430 . 0 0 "[ . 1 .]" 1
632 1 87 ILE MG 1 88 GLU H 5.000 . 5.000 3.698 3.635 3.739 . 0 0 "[ . 1 .]" 1
633 1 87 ILE MG 1 88 GLU HA 5.000 . 5.000 3.730 3.636 3.842 . 0 0 "[ . 1 .]" 1
634 1 87 ILE MG 1 90 ASP H 5.000 . 5.000 4.705 4.356 5.006 0.006 6 0 "[ . 1 .]" 1
635 1 87 ILE MG 1 91 GLN H 5.000 . 5.000 3.946 3.465 4.340 . 0 0 "[ . 1 .]" 1
636 1 88 GLU H 1 89 LEU H 3.400 . 3.400 2.760 2.640 2.842 . 0 0 "[ . 1 .]" 1
637 1 88 GLU HB3 1 89 LEU H 2.800 . 2.800 2.725 2.480 2.810 0.010 12 0 "[ . 1 .]" 1
638 1 88 GLU HB3 1 89 LEU MD2 5.000 . 5.000 3.387 2.817 4.039 . 0 0 "[ . 1 .]" 1
639 1 89 LEU H 1 89 LEU MD1 5.000 . 5.000 3.422 3.011 3.616 . 0 0 "[ . 1 .]" 1
640 1 89 LEU H 1 89 LEU MD2 5.000 . 5.000 3.299 2.893 3.798 . 0 0 "[ . 1 .]" 1
641 1 89 LEU H 1 89 LEU HG . . 2.800 2.080 1.966 2.315 . 0 0 "[ . 1 .]" 1
642 1 89 LEU HA 1 89 LEU MD2 . . 3.400 2.178 1.934 2.697 . 0 0 "[ . 1 .]" 1
643 1 89 LEU HA 1 92 GLN H 5.000 . 5.000 3.424 3.310 3.515 . 0 0 "[ . 1 .]" 1
644 1 89 LEU HB3 1 89 LEU MD1 3.400 . 3.400 2.497 2.330 2.728 . 0 0 "[ . 1 .]" 1
645 1 89 LEU HB3 1 90 ASP H 4.000 2.400 4.000 3.780 3.617 3.993 . 0 0 "[ . 1 .]" 1
646 1 89 LEU MD1 1 90 ASP H 5.000 . 5.000 4.283 3.973 4.546 . 0 0 "[ . 1 .]" 1
647 1 89 LEU MD2 1 90 ASP H 5.000 . 5.000 4.664 4.423 4.906 . 0 0 "[ . 1 .]" 1
648 1 89 LEU MD2 1 92 GLN HB3 5.000 . 5.000 4.270 3.666 4.955 . 0 0 "[ . 1 .]" 1
649 1 90 ASP H 1 90 ASP HA 2.800 . 2.800 2.783 2.763 2.808 0.008 7 0 "[ . 1 .]" 1
650 1 90 ASP H 1 90 ASP HB3 2.800 . 2.800 2.745 2.647 2.803 0.003 4 0 "[ . 1 .]" 1
651 1 90 ASP H 1 91 GLN H 2.800 . 2.800 2.753 2.678 2.813 0.013 15 0 "[ . 1 .]" 1
652 1 90 ASP H 1 91 GLN HB3 5.000 . 5.000 4.995 4.953 5.014 0.014 7 0 "[ . 1 .]" 1
653 1 90 ASP HA 1 93 LEU H 3.400 . 3.400 3.403 3.345 3.418 0.018 15 0 "[ . 1 .]" 1
654 1 90 ASP HB3 1 91 GLN H 3.400 . 3.400 2.674 2.310 2.966 . 0 0 "[ . 1 .]" 1
655 1 91 GLN HA 1 94 ASN H 4.000 2.400 4.000 3.805 3.727 3.987 . 0 0 "[ . 1 .]" 1
656 1 92 GLN H 1 92 GLN HB2 3.400 . 3.400 2.438 2.285 2.594 . 0 0 "[ . 1 .]" 1
657 1 92 GLN H 1 92 GLN HB3 . . 2.800 2.643 2.482 2.820 0.020 5 0 "[ . 1 .]" 1
658 1 92 GLN H 1 93 LEU H 3.400 . 3.400 2.537 2.519 2.573 . 0 0 "[ . 1 .]" 1
659 1 93 LEU H 1 93 LEU MD1 5.000 . 5.000 3.142 2.608 3.767 . 0 0 "[ . 1 .]" 1
660 1 93 LEU H 1 93 LEU HG 5.000 . 5.000 3.850 3.458 4.146 . 0 0 "[ . 1 .]" 1
661 1 93 LEU H 1 94 ASN H . . 2.800 2.741 2.675 2.821 0.021 5 0 "[ . 1 .]" 1
662 1 93 LEU HA 1 93 LEU MD1 3.400 . 3.400 3.257 2.996 3.408 0.008 6 0 "[ . 1 .]" 1
663 1 93 LEU HB2 1 93 LEU MD1 3.400 . 3.400 2.015 1.949 2.136 . 0 0 "[ . 1 .]" 1
664 1 93 LEU HB2 1 94 ASN H 3.400 . 3.400 3.132 2.897 3.373 . 0 0 "[ . 1 .]" 1
665 1 93 LEU HB3 1 94 ASN H 3.400 . 3.400 2.927 2.549 3.226 . 0 0 "[ . 1 .]" 1
666 1 93 LEU MD1 1 94 ASN H 5.000 . 5.000 4.655 4.468 4.854 . 0 0 "[ . 1 .]" 1
667 1 93 LEU HG 1 94 ASN H 5.000 . 5.000 4.907 4.807 4.980 . 0 0 "[ . 1 .]" 1
668 1 94 ASN H 1 94 ASN HA 2.800 . 2.800 2.803 2.782 2.822 0.022 11 0 "[ . 1 .]" 1
669 1 94 ASN H 1 94 ASN HB3 . . 2.800 2.703 2.558 2.801 0.001 3 0 "[ . 1 .]" 1
670 1 94 ASN HA 1 97 GLU H 5.000 . 5.000 3.651 3.140 4.651 . 0 0 "[ . 1 .]" 1
671 1 97 GLU H 1 97 GLU HB3 . . 3.400 2.921 2.576 3.408 0.008 15 0 "[ . 1 .]" 1
672 1 97 GLU H 1 100 VAL MG2 5.000 . 5.000 4.003 3.685 4.341 . 0 0 "[ . 1 .]" 1
673 1 97 GLU HA 1 100 VAL H 3.400 . 3.400 3.291 3.164 3.421 0.021 2 0 "[ . 1 .]" 1
674 1 97 GLU HA 1 100 VAL HB 3.400 . 3.400 3.089 2.827 3.403 0.003 12 0 "[ . 1 .]" 1
675 1 97 GLU HA 1 100 VAL MG1 5.000 . 5.000 4.194 4.001 4.462 . 0 0 "[ . 1 .]" 1
676 1 97 GLU HB3 1 98 SER H 3.400 . 3.400 2.850 2.736 3.231 . 0 0 "[ . 1 .]" 1
677 1 97 GLU QG 1 98 SER H 5.000 . 5.000 4.273 3.763 4.565 . 0 0 "[ . 1 .]" 1
678 1 98 SER H 1 100 VAL MG2 5.000 . 5.000 4.456 4.257 4.628 . 0 0 "[ . 1 .]" 1
679 1 99 CYS H 1 100 VAL MG2 5.000 . 5.000 3.633 3.398 3.842 . 0 0 "[ . 1 .]" 1
680 1 99 CYS HA 1 102 GLN H 3.400 . 3.400 3.323 3.190 3.404 0.004 11 0 "[ . 1 .]" 1
681 1 99 CYS HB3 1 106 VAL MG1 5.000 . 5.000 4.578 3.876 5.006 0.006 13 0 "[ . 1 .]" 1
682 1 100 VAL H 1 100 VAL HB 2.800 . 2.800 2.633 2.580 2.686 . 0 0 "[ . 1 .]" 1
683 1 100 VAL H 1 100 VAL MG2 3.400 . 3.400 2.032 1.950 2.159 . 0 0 "[ . 1 .]" 1
684 1 100 VAL HA 1 100 VAL MG1 3.400 . 3.400 2.301 2.216 2.398 . 0 0 "[ . 1 .]" 1
685 1 100 VAL HA 1 100 VAL MG2 3.400 . 3.400 2.430 2.352 2.501 . 0 0 "[ . 1 .]" 1
686 1 100 VAL HA 1 104 VAL H 5.000 . 5.000 4.531 4.044 4.921 . 0 0 "[ . 1 .]" 1
687 1 100 VAL HB 1 101 MET H 2.800 . 2.800 2.507 2.347 2.806 0.006 2 0 "[ . 1 .]" 1
688 1 100 VAL MG1 1 101 MET H 5.000 . 5.000 3.540 3.343 3.722 . 0 0 "[ . 1 .]" 1
689 1 100 VAL MG1 1 101 MET HA 5.000 . 5.000 3.674 3.528 3.753 . 0 0 "[ . 1 .]" 1
690 1 101 MET H 1 101 MET HB3 2.800 . 2.800 2.685 2.494 2.805 0.005 9 0 "[ . 1 .]" 1
691 1 102 GLN H 1 102 GLN HB2 2.800 . 2.800 2.246 2.058 2.525 . 0 0 "[ . 1 .]" 1
692 1 102 GLN H 1 102 GLN HB3 3.400 . 3.400 2.884 2.521 3.266 . 0 0 "[ . 1 .]" 1
693 1 102 GLN H 1 104 VAL MG1 5.000 . 5.000 4.565 4.047 5.006 0.006 15 0 "[ . 1 .]" 1
694 1 103 GLU H 1 104 VAL H 2.800 . 2.800 2.734 2.576 2.834 0.034 6 0 "[ . 1 .]" 1
695 1 103 GLU HA 1 104 VAL H 2.800 . 2.800 2.637 2.502 2.808 0.008 5 0 "[ . 1 .]" 1
696 1 103 GLU HA 1 104 VAL HA 5.000 . 5.000 4.656 4.590 4.767 . 0 0 "[ . 1 .]" 1
697 1 103 GLU HA 1 105 GLY H 5.000 . 5.000 3.459 3.192 3.648 . 0 0 "[ . 1 .]" 1
698 1 103 GLU HG3 1 105 GLY H 5.000 . 5.000 4.455 3.989 5.018 0.018 6 0 "[ . 1 .]" 1
699 1 104 VAL H 1 104 VAL MG1 2.800 . 2.800 1.929 1.848 2.135 . 0 0 "[ . 1 .]" 1
700 1 104 VAL H 1 105 GLY H . . 2.800 2.635 2.526 2.817 0.017 6 0 "[ . 1 .]" 1
701 1 104 VAL HA 1 104 VAL HB 2.800 . 2.800 2.345 2.304 2.406 . 0 0 "[ . 1 .]" 1
702 1 104 VAL HA 1 104 VAL MG1 2.800 . 2.800 2.775 2.527 3.131 0.331 5 0 "[ . 1 .]" 1
703 1 104 VAL HA 1 106 VAL H 5.000 . 5.000 4.900 4.342 5.021 0.021 6 0 "[ . 1 .]" 1
704 1 104 VAL MG1 1 105 GLY H . . 3.400 2.859 1.925 3.446 0.046 6 0 "[ . 1 .]" 1
705 1 104 VAL MG1 1 106 VAL H 5.000 . 5.000 3.373 1.991 4.451 . 0 0 "[ . 1 .]" 1
706 1 105 GLY H 1 105 GLY HA2 2.800 . 2.800 2.554 2.366 2.674 . 0 0 "[ . 1 .]" 1
707 1 105 GLY H 1 106 VAL H 3.400 . 3.400 2.417 1.924 2.943 . 0 0 "[ . 1 .]" 1
708 1 105 GLY HA2 1 107 ILE H 5.000 . 5.000 4.065 3.789 4.398 . 0 0 "[ . 1 .]" 1
709 1 106 VAL H 1 106 VAL HB 2.800 . 2.800 2.626 2.461 2.820 0.020 3 0 "[ . 1 .]" 1
710 1 106 VAL H 1 106 VAL MG1 2.800 . 2.800 2.154 1.948 2.405 . 0 0 "[ . 1 .]" 1
711 1 106 VAL H 1 107 ILE H 3.400 . 3.400 2.475 2.099 2.756 . 0 0 "[ . 1 .]" 1
712 1 106 VAL H 1 108 GLU H 5.000 . 5.000 4.630 4.369 4.899 . 0 0 "[ . 1 .]" 1
713 1 106 VAL HA 1 106 VAL HB 2.800 . 2.800 2.463 2.449 2.479 . 0 0 "[ . 1 .]" 1
714 1 106 VAL HB 1 107 ILE H 5.000 . 5.000 4.051 3.981 4.145 . 0 0 "[ . 1 .]" 1
715 1 106 VAL MG1 1 107 ILE H 3.400 . 3.400 2.052 1.960 2.188 . 0 0 "[ . 1 .]" 1
716 1 107 ILE H 1 107 ILE HB 2.800 . 2.800 2.668 2.629 2.735 . 0 0 "[ . 1 .]" 1
717 1 107 ILE H 1 107 ILE MD 5.000 . 5.000 2.789 1.967 3.917 . 0 0 "[ . 1 .]" 1
718 1 107 ILE H 1 107 ILE HG12 5.000 . 5.000 3.885 3.338 4.089 . 0 0 "[ . 1 .]" 1
719 1 107 ILE H 1 107 ILE HG13 2.800 . 2.800 2.571 2.211 2.803 0.003 8 0 "[ . 1 .]" 1
720 1 107 ILE H 1 108 GLU H 3.400 . 3.400 3.095 2.960 3.410 0.010 3 0 "[ . 1 .]" 1
721 1 107 ILE H 1 108 GLU HA 5.000 . 5.000 4.992 4.926 5.024 0.024 8 0 "[ . 1 .]" 1
722 1 107 ILE HA 1 107 ILE HG13 . . 3.400 2.696 2.489 3.270 . 0 0 "[ . 1 .]" 1
723 1 107 ILE HA 1 107 ILE MG . . 2.800 2.246 2.172 2.343 . 0 0 "[ . 1 .]" 1
724 1 107 ILE HA 1 108 GLU H 2.800 . 2.800 2.749 2.505 2.819 0.019 8 0 "[ . 1 .]" 1
725 1 107 ILE HB 1 107 ILE MD 2.800 . 2.800 2.164 2.007 2.473 . 0 0 "[ . 1 .]" 1
726 1 107 ILE HG13 1 108 GLU H 5.000 . 5.000 4.689 4.599 4.904 . 0 0 "[ . 1 .]" 1
727 1 107 ILE MG 1 113 TYR HE1 5.000 . 5.000 2.532 1.861 3.568 . 0 0 "[ . 1 .]" 1
728 1 108 GLU H 1 108 GLU HB3 . . 2.800 2.772 2.692 2.804 0.004 3 0 "[ . 1 .]" 1
729 1 108 GLU H 1 109 SER H 2.800 . 2.800 1.965 1.847 2.147 . 0 0 "[ . 1 .]" 1
730 1 108 GLU H 1 109 SER HB2 5.000 . 5.000 4.498 4.157 5.012 0.012 1 0 "[ . 1 .]" 1
731 1 108 GLU H 1 113 TYR HE1 5.000 . 5.000 3.872 3.338 4.608 . 0 0 "[ . 1 .]" 1
732 1 108 GLU HB3 1 109 SER H 2.800 . 2.800 2.619 2.466 2.817 0.017 10 0 "[ . 1 .]" 1
733 1 109 SER H 1 109 SER HB3 2.800 . 2.800 2.580 2.305 2.913 0.113 1 0 "[ . 1 .]" 1
734 1 109 SER H 1 113 TYR HD1 5.000 . 5.000 4.638 4.263 4.827 . 0 0 "[ . 1 .]" 1
735 1 109 SER H 1 113 TYR HE1 5.000 . 5.000 4.898 4.342 5.021 0.021 10 0 "[ . 1 .]" 1
736 1 109 SER HB3 1 112 MET H 3.400 . 3.400 3.008 2.507 3.479 0.079 1 0 "[ . 1 .]" 1
737 1 110 PRO HA 1 110 PRO HB3 2.800 . 2.800 2.288 2.272 2.302 . 0 0 "[ . 1 .]" 1
738 1 110 PRO HA 1 113 TYR H 5.000 . 5.000 3.570 3.396 3.918 . 0 0 "[ . 1 .]" 1
739 1 110 PRO HB2 1 111 LEU H 2.800 . 2.800 2.763 2.550 2.885 0.085 6 0 "[ . 1 .]" 1
740 1 111 LEU H 1 111 LEU HB3 . . 2.800 2.527 2.370 2.667 . 0 0 "[ . 1 .]" 1
741 1 111 LEU H 1 111 LEU MD1 5.000 . 5.000 3.976 3.782 4.081 . 0 0 "[ . 1 .]" 1
742 1 111 LEU H 1 111 LEU MD2 5.000 . 5.000 4.017 3.218 4.230 . 0 0 "[ . 1 .]" 1
743 1 111 LEU H 1 112 MET H 2.800 . 2.800 2.720 2.456 2.808 0.008 11 0 "[ . 1 .]" 1
744 1 111 LEU HA 1 111 LEU MD1 3.400 . 3.400 2.307 1.932 3.422 0.022 3 0 "[ . 1 .]" 1
745 1 111 LEU HB3 1 111 LEU MD2 2.800 . 2.800 2.312 2.014 2.468 . 0 0 "[ . 1 .]" 1
746 1 111 LEU MD1 1 112 MET H 5.000 . 5.000 3.994 2.564 4.476 . 0 0 "[ . 1 .]" 1
747 1 111 LEU MD1 1 113 TYR H 5.000 . 5.000 4.882 4.340 5.008 0.008 15 0 "[ . 1 .]" 1
748 1 111 LEU MD1 1 114 GLU H 5.000 . 5.000 4.410 3.989 5.014 0.014 13 0 "[ . 1 .]" 1
749 1 111 LEU MD1 1 115 ASP H 5.000 . 5.000 4.187 3.193 4.666 . 0 0 "[ . 1 .]" 1
750 1 111 LEU MD2 1 112 MET H 5.000 . 5.000 4.173 3.680 4.732 . 0 0 "[ . 1 .]" 1
751 1 112 MET H 1 112 MET HB2 2.800 . 2.800 2.457 2.212 2.672 . 0 0 "[ . 1 .]" 1
752 1 112 MET H 1 112 MET HG3 2.800 . 2.800 2.424 1.993 2.803 0.003 13 0 "[ . 1 .]" 1
753 1 112 MET H 1 113 TYR H 2.800 . 2.800 2.644 2.523 2.724 . 0 0 "[ . 1 .]" 1
754 1 112 MET H 1 113 TYR HB2 5.000 . 5.000 4.462 4.315 4.553 . 0 0 "[ . 1 .]" 1
755 1 112 MET H 1 113 TYR HD1 5.000 . 5.000 4.786 4.383 5.008 0.008 6 0 "[ . 1 .]" 1
756 1 112 MET HA 1 115 ASP H 4.000 2.400 4.000 3.725 3.485 4.003 0.003 14 0 "[ . 1 .]" 1
757 1 112 MET HB2 1 113 TYR H 3.400 . 3.400 3.030 2.871 3.126 . 0 0 "[ . 1 .]" 1
758 1 113 TYR H 1 113 TYR HB2 3.400 . 3.400 2.091 2.070 2.128 . 0 0 "[ . 1 .]" 1
759 1 113 TYR H 1 113 TYR HD1 3.400 . 3.400 2.980 2.598 3.136 . 0 0 "[ . 1 .]" 1
760 1 113 TYR H 1 114 GLU HB2 5.000 . 5.000 4.670 4.388 4.987 . 0 0 "[ . 1 .]" 1
761 1 113 TYR HA 1 115 ASP H 5.000 . 5.000 4.673 4.172 4.943 . 0 0 "[ . 1 .]" 1
762 1 113 TYR HA 1 116 SER H 5.000 . 5.000 3.650 3.310 3.976 . 0 0 "[ . 1 .]" 1
763 1 113 TYR HA 1 117 ILE H 5.000 . 5.000 3.400 3.026 3.662 . 0 0 "[ . 1 .]" 1
764 1 113 TYR HB2 1 113 TYR HD1 3.400 . 3.400 2.796 2.509 2.967 . 0 0 "[ . 1 .]" 1
765 1 113 TYR HB3 1 114 GLU H 5.000 . 5.000 2.946 2.801 3.243 . 0 0 "[ . 1 .]" 1
766 1 113 TYR HB3 1 117 ILE H 5.000 . 5.000 4.586 4.229 4.939 . 0 0 "[ . 1 .]" 1
767 1 113 TYR HD1 1 114 GLU H 5.000 . 5.000 4.997 4.872 5.029 0.029 12 0 "[ . 1 .]" 1
768 1 113 TYR HD1 1 117 ILE MD 5.000 . 5.000 4.696 4.169 4.921 . 0 0 "[ . 1 .]" 1
769 1 113 TYR HE1 1 117 ILE MD 5.000 . 5.000 4.938 4.703 5.018 0.018 6 0 "[ . 1 .]" 1
770 1 114 GLU H 1 114 GLU HB2 2.800 . 2.800 2.401 2.153 2.652 . 0 0 "[ . 1 .]" 1
771 1 114 GLU H 1 115 ASP H 3.400 . 3.400 2.862 2.717 2.957 . 0 0 "[ . 1 .]" 1
772 1 114 GLU H 1 117 ILE HG13 5.000 . 5.000 4.639 4.309 5.017 0.017 5 0 "[ . 1 .]" 1
773 1 114 GLU HB2 1 115 ASP H 2.800 . 2.800 2.518 2.320 2.715 . 0 0 "[ . 1 .]" 1
774 1 115 ASP H 1 116 SER H 2.800 . 2.800 2.729 2.620 2.795 . 0 0 "[ . 1 .]" 1
775 1 115 ASP H 1 117 ILE H 5.000 . 5.000 4.360 4.114 4.483 . 0 0 "[ . 1 .]" 1
776 1 115 ASP HA 1 118 LEU H 5.000 . 5.000 4.203 4.051 4.384 . 0 0 "[ . 1 .]" 1
777 1 115 ASP HA 1 119 ALA H 5.000 . 5.000 4.169 3.883 4.566 . 0 0 "[ . 1 .]" 1
778 1 115 ASP HB3 1 116 SER H 2.800 . 2.800 2.642 2.603 2.782 . 0 0 "[ . 1 .]" 1
779 1 116 SER H 1 116 SER HB3 2.800 . 2.800 2.420 2.200 2.770 . 0 0 "[ . 1 .]" 1
780 1 116 SER H 1 117 ILE H 2.800 . 2.800 2.598 2.513 2.648 . 0 0 "[ . 1 .]" 1
781 1 116 SER H 1 117 ILE HG13 5.000 . 5.000 4.856 4.337 5.038 0.038 9 0 "[ . 1 .]" 1
782 1 116 SER H 1 118 LEU H 5.000 . 5.000 4.124 3.989 4.210 . 0 0 "[ . 1 .]" 1
783 1 116 SER HA 1 119 ALA MB 5.000 . 5.000 2.867 2.468 3.153 . 0 0 "[ . 1 .]" 1
784 1 116 SER HB2 1 119 ALA MB 5.000 . 5.000 4.675 4.497 4.975 . 0 0 "[ . 1 .]" 1
785 1 117 ILE H 1 117 ILE HB . . 2.800 2.618 2.459 2.685 . 0 0 "[ . 1 .]" 1
786 1 117 ILE H 1 117 ILE MD 5.000 . 5.000 3.622 3.516 3.752 . 0 0 "[ . 1 .]" 1
787 1 117 ILE H 1 118 LEU H 2.800 . 2.800 2.725 2.681 2.760 . 0 0 "[ . 1 .]" 1
788 1 117 ILE HA 1 118 LEU H 5.000 . 5.000 3.565 3.550 3.574 . 0 0 "[ . 1 .]" 1
789 1 117 ILE HA 1 119 ALA H 5.000 . 5.000 4.202 3.965 4.451 . 0 0 "[ . 1 .]" 1
790 1 117 ILE HA 1 120 VAL HB 5.000 . 5.000 3.717 3.423 3.943 . 0 0 "[ . 1 .]" 1
791 1 117 ILE HA 1 121 ARG H 5.000 . 5.000 4.472 4.218 4.805 . 0 0 "[ . 1 .]" 1
792 1 117 ILE HG13 1 118 LEU H 5.000 . 5.000 4.337 4.286 4.419 . 0 0 "[ . 1 .]" 1
793 1 117 ILE MG 1 118 LEU H 5.000 . 5.000 3.472 3.353 3.523 . 0 0 "[ . 1 .]" 1
794 1 117 ILE MG 1 120 VAL H 5.000 . 5.000 4.437 3.964 4.721 . 0 0 "[ . 1 .]" 1
795 1 117 ILE MG 1 120 VAL MG1 5.000 . 5.000 4.727 4.364 5.012 0.012 6 0 "[ . 1 .]" 1
796 1 118 LEU H 1 118 LEU HB3 2.800 . 2.800 2.739 2.567 2.802 0.002 3 0 "[ . 1 .]" 1
797 1 118 LEU H 1 118 LEU MD1 5.000 . 5.000 4.183 4.111 4.249 . 0 0 "[ . 1 .]" 1
798 1 118 LEU H 1 119 ALA H 2.800 . 2.800 2.695 2.587 2.759 . 0 0 "[ . 1 .]" 1
799 1 118 LEU H 1 119 ALA MB 5.000 . 5.000 4.313 4.195 4.376 . 0 0 "[ . 1 .]" 1
800 1 118 LEU HA 1 118 LEU MD2 2.800 . 2.800 2.382 1.878 2.815 0.015 10 0 "[ . 1 .]" 1
801 1 118 LEU MD1 1 119 ALA H 5.000 . 5.000 4.056 3.253 4.853 . 0 0 "[ . 1 .]" 1
802 1 118 LEU MD2 1 121 ARG H 5.000 . 5.000 4.234 3.929 4.587 . 0 0 "[ . 1 .]" 1
803 1 118 LEU MD2 1 122 LYS H 5.000 . 5.000 3.041 2.333 4.155 . 0 0 "[ . 1 .]" 1
804 1 119 ALA H 1 119 ALA HA 2.800 . 2.800 2.784 2.769 2.807 0.007 2 0 "[ . 1 .]" 1
805 1 119 ALA H 1 119 ALA MB 2.800 . 2.800 2.162 2.043 2.236 . 0 0 "[ . 1 .]" 1
806 1 119 ALA H 1 120 VAL H 2.800 . 2.800 2.735 2.658 2.817 0.017 15 0 "[ . 1 .]" 1
807 1 119 ALA H 1 120 VAL MG2 5.000 . 5.000 4.068 3.826 4.267 . 0 0 "[ . 1 .]" 1
808 1 119 ALA H 1 121 ARG H 5.000 . 5.000 4.255 4.013 4.435 . 0 0 "[ . 1 .]" 1
809 1 119 ALA HA 1 122 LYS HB2 3.400 . 3.400 3.353 3.136 3.409 0.009 11 0 "[ . 1 .]" 1
810 1 119 ALA MB 1 120 VAL MG1 5.000 . 5.000 4.849 4.767 4.913 . 0 0 "[ . 1 .]" 1
811 1 120 VAL H 1 120 VAL HB . . 2.800 2.613 2.536 2.677 . 0 0 "[ . 1 .]" 1
812 1 120 VAL H 1 120 VAL MG2 . . 2.800 2.177 2.018 2.302 . 0 0 "[ . 1 .]" 1
813 1 120 VAL H 1 121 ARG H 2.800 . 2.800 2.478 2.370 2.652 . 0 0 "[ . 1 .]" 1
814 1 120 VAL H 1 122 LYS H 5.000 . 5.000 4.029 3.873 4.135 . 0 0 "[ . 1 .]" 1
815 1 120 VAL HA 1 120 VAL MG1 . . 3.400 2.321 2.158 2.383 . 0 0 "[ . 1 .]" 1
816 1 120 VAL HA 1 120 VAL MG2 3.400 . 3.400 2.433 2.358 2.499 . 0 0 "[ . 1 .]" 1
817 1 120 VAL HA 1 121 ARG H 5.000 . 5.000 3.545 3.502 3.567 . 0 0 "[ . 1 .]" 1
818 1 120 VAL HA 1 122 LYS H 5.000 . 5.000 4.501 4.179 4.637 . 0 0 "[ . 1 .]" 1
819 1 120 VAL HA 1 123 TYR H 5.000 . 5.000 3.665 3.446 3.800 . 0 0 "[ . 1 .]" 1
820 1 120 VAL HB 1 121 ARG HB3 5.000 . 5.000 4.823 4.072 5.017 0.017 1 0 "[ . 1 .]" 1
821 1 120 VAL MG1 1 121 ARG H 5.000 . 5.000 3.596 3.515 3.692 . 0 0 "[ . 1 .]" 1
822 1 120 VAL MG1 1 123 TYR H 5.000 . 5.000 4.775 4.556 4.997 . 0 0 "[ . 1 .]" 1
823 1 120 VAL MG1 1 124 PHE H 5.000 . 5.000 3.757 3.428 4.240 . 0 0 "[ . 1 .]" 1
824 1 120 VAL MG1 1 124 PHE HE1 5.000 . 5.000 4.826 4.181 5.004 0.004 10 0 "[ . 1 .]" 1
825 1 121 ARG H 1 122 LYS H 3.400 . 3.400 2.715 2.549 2.794 . 0 0 "[ . 1 .]" 1
826 1 121 ARG H 1 123 TYR H 5.000 . 5.000 4.295 4.043 4.423 . 0 0 "[ . 1 .]" 1
827 1 121 ARG H 1 124 PHE H 5.000 . 5.000 4.682 4.585 4.815 . 0 0 "[ . 1 .]" 1
828 1 121 ARG H 1 124 PHE HB2 5.000 . 5.000 4.834 4.600 5.015 0.015 5 0 "[ . 1 .]" 1
829 1 122 LYS H 1 123 TYR H 3.400 . 3.400 2.724 2.513 2.813 . 0 0 "[ . 1 .]" 1
830 1 122 LYS H 1 124 PHE H 5.000 . 5.000 4.152 4.048 4.285 . 0 0 "[ . 1 .]" 1
831 1 122 LYS H 1 125 GLN H 5.000 . 5.000 4.807 4.599 5.025 0.025 6 0 "[ . 1 .]" 1
832 1 123 TYR H 1 123 TYR HB2 2.800 . 2.800 2.081 2.060 2.098 . 0 0 "[ . 1 .]" 1
833 1 123 TYR H 1 124 PHE H 2.800 . 2.800 2.633 2.515 2.769 . 0 0 "[ . 1 .]" 1
834 1 123 TYR H 1 124 PHE HB2 5.000 . 5.000 4.611 4.422 4.861 . 0 0 "[ . 1 .]" 1
835 1 123 TYR H 1 125 GLN H 5.000 . 5.000 4.027 3.817 4.240 . 0 0 "[ . 1 .]" 1
836 1 123 TYR H 1 126 ARG H 5.000 . 5.000 4.968 4.839 5.022 0.022 6 0 "[ . 1 .]" 1
837 1 123 TYR HA 1 126 ARG H 3.400 . 3.400 3.355 3.243 3.421 0.021 13 0 "[ . 1 .]" 1
838 1 123 TYR HD1 1 124 PHE H 5.600 2.400 5.600 5.296 5.141 5.444 . 0 0 "[ . 1 .]" 1
839 1 124 PHE H 1 124 PHE HA . . 2.800 2.782 2.751 2.812 0.012 13 0 "[ . 1 .]" 1
840 1 124 PHE H 1 124 PHE HB2 2.800 . 2.800 2.209 2.103 2.394 . 0 0 "[ . 1 .]" 1
841 1 124 PHE H 1 125 GLN H . . 2.800 2.715 2.603 2.800 . 14 0 "[ . 1 .]" 1
842 1 124 PHE H 1 127 ILE MD 5.000 . 5.000 4.641 4.525 4.789 . 0 0 "[ . 1 .]" 1
843 1 124 PHE H 1 127 ILE HG13 5.000 . 5.000 4.975 4.898 5.026 0.026 9 0 "[ . 1 .]" 1
844 1 124 PHE HA 1 124 PHE HD1 5.000 . 5.000 3.265 2.569 4.163 . 0 0 "[ . 1 .]" 1
845 1 124 PHE HA 1 125 GLN H 5.000 . 5.000 3.504 3.465 3.538 . 0 0 "[ . 1 .]" 1
846 1 124 PHE HA 1 126 ARG H 5.000 . 5.000 4.145 4.019 4.270 . 0 0 "[ . 1 .]" 1
847 1 124 PHE HA 1 127 ILE HB 5.000 . 5.000 3.538 3.105 3.721 . 0 0 "[ . 1 .]" 1
848 1 124 PHE HA 1 127 ILE MD 5.000 . 5.000 2.453 2.210 2.850 . 0 0 "[ . 1 .]" 1
849 1 124 PHE HA 1 127 ILE MG 5.000 . 5.000 4.648 4.454 4.808 . 0 0 "[ . 1 .]" 1
850 1 124 PHE HB2 1 124 PHE HD1 . . 3.400 2.629 2.276 3.443 0.043 15 0 "[ . 1 .]" 1
851 1 124 PHE HD1 1 127 ILE MD 5.000 . 5.000 3.749 3.182 5.019 0.019 6 0 "[ . 1 .]" 1
852 1 125 GLN H 1 125 GLN HB2 2.800 . 2.800 2.391 2.272 2.572 . 0 0 "[ . 1 .]" 1
853 1 125 GLN H 1 125 GLN HB3 2.800 . 2.800 2.676 2.486 2.804 0.004 3 0 "[ . 1 .]" 1
854 1 125 GLN H 1 126 ARG H 2.800 . 2.800 2.598 2.543 2.661 . 0 0 "[ . 1 .]" 1
855 1 125 GLN HA 1 125 GLN HG3 2.800 . 2.800 2.410 2.196 2.691 . 0 0 "[ . 1 .]" 1
856 1 125 GLN HA 1 128 THR MG 5.000 . 5.000 4.389 4.255 4.509 . 0 0 "[ . 1 .]" 1
857 1 126 ARG H 1 127 ILE H 2.800 . 2.800 2.699 2.653 2.760 . 0 0 "[ . 1 .]" 1
858 1 126 ARG H 1 127 ILE HG13 5.000 . 5.000 4.095 4.031 4.167 . 0 0 "[ . 1 .]" 1
859 1 126 ARG HA 1 128 THR H 5.000 . 5.000 4.471 4.329 4.649 . 0 0 "[ . 1 .]" 1
860 1 127 ILE H 1 127 ILE HB . . 2.800 2.634 2.610 2.670 . 0 0 "[ . 1 .]" 1
861 1 127 ILE H 1 127 ILE MD 5.000 . 5.000 3.554 3.475 3.593 . 0 0 "[ . 1 .]" 1
862 1 127 ILE H 1 127 ILE HG13 2.800 . 2.800 1.961 1.912 1.996 . 0 0 "[ . 1 .]" 1
863 1 127 ILE H 1 128 THR H 2.800 . 2.800 2.762 2.614 2.809 0.009 4 0 "[ . 1 .]" 1
864 1 127 ILE HA 1 127 ILE HG13 3.400 . 3.400 3.119 3.041 3.158 . 0 0 "[ . 1 .]" 1
865 1 127 ILE HA 1 128 THR HA 5.000 . 5.000 4.799 4.773 4.809 . 0 0 "[ . 1 .]" 1
866 1 127 ILE HA 1 130 TYR HB2 5.000 . 5.000 3.236 2.900 3.633 . 0 0 "[ . 1 .]" 1
867 1 127 ILE HB 1 127 ILE MD . . 3.400 2.425 2.276 2.489 . 0 0 "[ . 1 .]" 1
868 1 127 ILE HB 1 128 THR H . . 2.800 2.509 2.422 2.608 . 0 0 "[ . 1 .]" 1
869 1 127 ILE MD 1 128 THR H 5.000 . 5.000 4.508 4.406 4.612 . 0 0 "[ . 1 .]" 1
870 1 127 ILE MD 1 131 LEU MD2 5.000 . 5.000 4.635 4.142 4.849 . 0 0 "[ . 1 .]" 1
871 1 127 ILE MD 1 144 VAL HA 5.000 . 5.000 3.841 3.582 4.195 . 0 0 "[ . 1 .]" 1
872 1 127 ILE MD 1 144 VAL MG2 5.000 . 5.000 3.176 1.813 4.014 . 0 0 "[ . 1 .]" 1
873 1 127 ILE MD 1 148 ILE H 5.600 2.400 5.600 5.584 5.450 5.636 0.036 14 0 "[ . 1 .]" 1
874 1 127 ILE MD 1 148 ILE MD 5.000 . 5.000 4.378 4.187 4.555 . 0 0 "[ . 1 .]" 1
875 1 127 ILE MD 1 148 ILE HG13 5.000 . 5.000 4.716 4.635 4.838 . 0 0 "[ . 1 .]" 1
876 1 127 ILE HG12 1 128 THR H 5.000 . 5.000 4.878 4.822 4.936 . 0 0 "[ . 1 .]" 1
877 1 127 ILE MG 1 128 THR H 5.000 . 5.000 3.492 3.407 3.583 . 0 0 "[ . 1 .]" 1
878 1 127 ILE MG 1 130 TYR H 5.000 . 5.000 4.701 4.551 4.838 . 0 0 "[ . 1 .]" 1
879 1 127 ILE MG 1 130 TYR HB2 5.000 . 5.000 4.823 4.481 5.004 0.004 15 0 "[ . 1 .]" 1
880 1 127 ILE MG 1 130 TYR HD1 5.000 . 5.000 3.839 3.190 4.245 . 0 0 "[ . 1 .]" 1
881 1 127 ILE MG 1 131 LEU H 5.000 . 5.000 3.758 3.382 3.913 . 0 0 "[ . 1 .]" 1
882 1 127 ILE MG 1 131 LEU MD1 5.000 . 5.000 2.108 1.887 2.391 . 0 0 "[ . 1 .]" 1
883 1 127 ILE MG 1 131 LEU MD2 5.000 . 5.000 2.394 2.090 2.672 . 0 0 "[ . 1 .]" 1
884 1 127 ILE MG 1 131 LEU HG 5.000 . 5.000 4.352 3.991 4.550 . 0 0 "[ . 1 .]" 1
885 1 127 ILE MG 1 140 ALA MB 5.000 . 5.000 4.958 4.770 5.030 0.030 14 0 "[ . 1 .]" 1
886 1 127 ILE MG 1 144 VAL HA 5.000 . 5.000 4.096 3.871 4.219 . 0 0 "[ . 1 .]" 1
887 1 127 ILE MG 1 144 VAL HB 5.000 . 5.000 2.317 1.962 2.615 . 0 0 "[ . 1 .]" 1
888 1 127 ILE MG 1 144 VAL MG1 5.000 . 5.000 2.157 1.810 2.900 . 0 0 "[ . 1 .]" 1
889 1 127 ILE MG 1 148 ILE MD 5.000 . 5.000 5.014 4.977 5.036 0.036 5 0 "[ . 1 .]" 1
890 1 128 THR H 1 131 LEU H 5.000 . 5.000 4.814 4.711 4.885 . 0 0 "[ . 1 .]" 1
891 1 128 THR H 1 131 LEU MD1 5.600 2.400 5.600 4.933 4.798 5.009 . 0 0 "[ . 1 .]" 1
892 1 128 THR HA 1 128 THR MG 3.400 . 3.400 2.235 2.075 2.397 . 0 0 "[ . 1 .]" 1
893 1 128 THR HA 1 131 LEU H . 2.400 4.000 3.911 3.766 4.002 0.002 3 0 "[ . 1 .]" 1
894 1 128 THR HA 1 131 LEU MD2 5.000 . 5.000 3.753 3.480 3.999 . 0 0 "[ . 1 .]" 1
895 1 128 THR HB 1 130 TYR H 5.000 . 5.000 4.802 4.752 4.877 . 0 0 "[ . 1 .]" 1
896 1 128 THR MG 1 129 LEU HA 5.000 . 5.000 4.137 3.787 4.444 . 0 0 "[ . 1 .]" 1
897 1 128 THR MG 1 131 LEU HB2 5.000 . 5.000 4.630 4.362 4.796 . 0 0 "[ . 1 .]" 1
898 1 128 THR MG 1 131 LEU MD2 5.000 . 5.000 4.770 4.444 4.988 . 0 0 "[ . 1 .]" 1
899 1 128 THR MG 1 132 THR H 5.000 . 5.000 4.676 4.264 4.971 . 0 0 "[ . 1 .]" 1
900 1 128 THR MG 1 136 TYR HE1 5.000 . 5.000 4.374 3.926 4.796 . 0 0 "[ . 1 .]" 1
901 1 129 LEU H 1 129 LEU HB3 2.800 . 2.800 2.605 2.428 2.805 0.005 4 0 "[ . 1 .]" 1
902 1 129 LEU H 1 130 TYR H 2.800 . 2.800 2.527 2.486 2.584 . 0 0 "[ . 1 .]" 1
903 1 129 LEU HA 1 129 LEU MD1 2.800 . 2.800 2.130 1.960 2.563 . 0 0 "[ . 1 .]" 1
904 1 129 LEU HA 1 132 THR MG 5.000 . 5.000 3.726 3.636 3.794 . 0 0 "[ . 1 .]" 1
905 1 129 LEU MD1 1 130 TYR H 5.000 . 5.000 4.488 3.586 4.750 . 0 0 "[ . 1 .]" 1
906 1 129 LEU MD1 1 132 THR H 5.000 . 5.000 4.687 4.281 5.000 . 0 0 "[ . 1 .]" 1
907 1 129 LEU MD1 1 133 GLU H 5.000 . 5.000 4.585 3.767 5.000 0.000 12 0 "[ . 1 .]" 1
908 1 130 TYR H 1 130 TYR HB3 2.800 . 2.800 2.591 2.330 2.759 . 0 0 "[ . 1 .]" 1
909 1 130 TYR H 1 131 LEU H 2.800 . 2.800 2.775 2.708 2.809 0.009 4 0 "[ . 1 .]" 1
910 1 130 TYR H 1 131 LEU HB2 5.000 . 5.000 4.639 4.549 4.702 . 0 0 "[ . 1 .]" 1
911 1 130 TYR HA 1 130 TYR HB2 2.800 . 2.800 2.494 2.376 2.576 . 0 0 "[ . 1 .]" 1
912 1 130 TYR HB3 1 131 LEU MD1 5.000 . 5.000 2.572 2.412 2.779 . 0 0 "[ . 1 .]" 1
913 1 130 TYR HD1 1 131 LEU MD1 5.000 . 5.000 2.258 1.995 2.462 . 0 0 "[ . 1 .]" 1
914 1 130 TYR HD1 1 131 LEU MD2 5.000 . 5.000 4.712 4.452 4.933 . 0 0 "[ . 1 .]" 1
915 1 130 TYR HD1 1 131 LEU HG 5.000 . 5.000 4.791 4.455 5.002 0.002 12 0 "[ . 1 .]" 1
916 1 130 TYR HD1 1 140 ALA MB 5.000 . 5.000 3.701 3.255 4.096 . 0 0 "[ . 1 .]" 1
917 1 130 TYR HD1 1 144 VAL H 5.600 2.400 5.600 5.155 4.877 5.439 . 0 0 "[ . 1 .]" 1
918 1 130 TYR HD1 1 144 VAL MG1 5.000 . 5.000 3.287 2.296 4.672 . 0 0 "[ . 1 .]" 1
919 1 130 TYR HE1 1 143 VAL MG2 5.000 . 5.000 2.071 1.836 2.389 . 0 0 "[ . 1 .]" 1
920 1 130 TYR HE1 1 144 VAL H 5.000 . 5.000 4.798 3.683 5.010 0.010 9 0 "[ . 1 .]" 1
921 1 130 TYR HE1 1 144 VAL MG1 5.000 . 5.000 3.957 2.325 5.015 0.015 10 0 "[ . 1 .]" 1
922 1 131 LEU H 1 131 LEU HB2 2.800 . 2.800 2.189 2.136 2.207 . 0 0 "[ . 1 .]" 1
923 1 131 LEU H 1 131 LEU MD1 5.000 . 5.000 2.242 2.030 2.439 . 0 0 "[ . 1 .]" 1
924 1 131 LEU H 1 131 LEU MD2 5.000 . 5.000 3.683 3.573 3.892 . 0 0 "[ . 1 .]" 1
925 1 131 LEU H 1 131 LEU HG 5.000 . 5.000 4.073 4.048 4.111 . 0 0 "[ . 1 .]" 1
926 1 131 LEU HA 1 133 GLU H 5.000 . 5.000 4.035 3.919 4.210 . 0 0 "[ . 1 .]" 1
927 1 131 LEU HA 1 134 LYS H . . 3.400 3.239 3.164 3.300 . 0 0 "[ . 1 .]" 1
928 1 131 LEU HA 1 136 TYR H 5.000 . 5.000 3.628 3.435 3.768 . 0 0 "[ . 1 .]" 1
929 1 131 LEU HA 1 140 ALA MB 5.000 . 5.000 2.658 2.180 3.008 . 0 0 "[ . 1 .]" 1
930 1 131 LEU HB2 1 132 THR H 5.000 . 5.000 2.931 2.778 3.001 . 0 0 "[ . 1 .]" 1
931 1 131 LEU HB2 1 136 TYR H 5.000 . 5.000 4.994 4.903 5.008 0.008 13 0 "[ . 1 .]" 1
932 1 131 LEU HB2 1 136 TYR HD1 5.000 . 5.000 3.888 3.721 4.062 . 0 0 "[ . 1 .]" 1
933 1 131 LEU HB2 1 136 TYR HE1 5.000 . 5.000 2.984 2.738 3.170 . 0 0 "[ . 1 .]" 1
934 1 131 LEU HB3 1 136 TYR HE1 3.400 . 3.400 2.666 2.304 2.886 . 0 0 "[ . 1 .]" 1
935 1 131 LEU MD1 1 132 THR H 5.000 . 5.000 4.189 4.127 4.295 . 0 0 "[ . 1 .]" 1
936 1 131 LEU MD1 1 136 TYR H 5.000 . 5.000 4.992 4.917 5.005 0.005 1 0 "[ . 1 .]" 1
937 1 131 LEU MD1 1 136 TYR HA 5.000 . 5.000 4.629 4.472 4.745 . 0 0 "[ . 1 .]" 1
938 1 131 LEU MD1 1 136 TYR HD1 5.000 . 5.000 4.400 4.247 4.592 . 0 0 "[ . 1 .]" 1
939 1 131 LEU MD1 1 136 TYR HE1 5.000 . 5.000 4.525 4.356 4.753 . 0 0 "[ . 1 .]" 1
940 1 131 LEU MD1 1 140 ALA MB 5.000 . 5.000 2.253 1.898 2.500 . 0 0 "[ . 1 .]" 1
941 1 131 LEU MD1 1 141 TRP H 5.000 . 5.000 4.254 3.787 4.506 . 0 0 "[ . 1 .]" 1
942 1 131 LEU MD1 1 144 VAL H 5.000 . 5.000 3.976 3.737 4.127 . 0 0 "[ . 1 .]" 1
943 1 131 LEU MD1 1 144 VAL HB 5.000 . 5.000 3.486 2.605 3.955 . 0 0 "[ . 1 .]" 1
944 1 131 LEU MD1 1 144 VAL MG1 . . 3.400 2.040 1.796 2.583 0.004 8 0 "[ . 1 .]" 1
945 1 131 LEU MD2 1 132 THR H 5.000 . 5.000 4.736 4.635 4.800 . 0 0 "[ . 1 .]" 1
946 1 131 LEU MD2 1 136 TYR H 5.000 . 5.000 4.805 4.604 4.924 . 0 0 "[ . 1 .]" 1
947 1 131 LEU MD2 1 136 TYR HD1 5.000 . 5.000 1.969 1.923 2.034 . 0 0 "[ . 1 .]" 1
948 1 131 LEU MD2 1 136 TYR HE1 . . 3.400 2.369 2.169 2.599 . 0 0 "[ . 1 .]" 1
949 1 131 LEU MD2 1 141 TRP H 5.000 . 5.000 4.432 4.108 4.956 . 0 0 "[ . 1 .]" 1
950 1 131 LEU MD2 1 141 TRP HD1 5.000 . 5.000 4.150 3.456 4.437 . 0 0 "[ . 1 .]" 1
951 1 131 LEU MD2 1 141 TRP HE3 5.000 . 5.000 2.937 2.752 3.434 . 0 0 "[ . 1 .]" 1
952 1 131 LEU MD2 1 141 TRP HH2 5.000 . 5.000 3.110 2.830 3.540 . 0 0 "[ . 1 .]" 1
953 1 131 LEU MD2 1 141 TRP HZ3 5.000 . 5.000 3.090 2.724 3.481 . 0 0 "[ . 1 .]" 1
954 1 131 LEU MD2 1 144 VAL H 5.000 . 5.000 5.001 4.939 5.011 0.011 15 0 "[ . 1 .]" 1
955 1 131 LEU MD2 1 144 VAL MG1 5.000 . 5.000 2.746 2.153 3.140 . 0 0 "[ . 1 .]" 1
956 1 131 LEU MD2 1 144 VAL MG2 5.000 . 5.000 2.629 2.027 3.503 . 0 0 "[ . 1 .]" 1
957 1 131 LEU HG 1 144 VAL MG1 5.000 . 5.000 3.960 3.725 4.149 . 0 0 "[ . 1 .]" 1
958 1 132 THR H 1 132 THR HB 2.800 . 2.800 2.519 2.429 2.565 . 0 0 "[ . 1 .]" 1
959 1 132 THR H 1 133 GLU H 2.800 . 2.800 2.721 2.695 2.745 . 0 0 "[ . 1 .]" 1
960 1 132 THR H 1 133 GLU HB3 5.000 . 5.000 4.992 4.973 5.002 0.002 6 0 "[ . 1 .]" 1
961 1 132 THR H 1 134 LYS H 5.000 . 5.000 4.145 4.049 4.241 . 0 0 "[ . 1 .]" 1
962 1 132 THR H 1 136 TYR HE1 5.000 . 5.000 4.881 4.615 5.010 0.010 2 0 "[ . 1 .]" 1
963 1 132 THR HA 1 132 THR MG 2.800 . 2.800 2.441 2.360 2.499 . 0 0 "[ . 1 .]" 1
964 1 132 THR HA 1 136 TYR HE1 5.600 2.400 5.600 5.182 4.816 5.491 . 0 0 "[ . 1 .]" 1
965 1 132 THR MG 1 133 GLU H 5.000 . 5.000 3.601 3.502 3.692 . 0 0 "[ . 1 .]" 1
966 1 132 THR MG 1 133 GLU HA 5.000 . 5.000 3.627 3.511 3.752 . 0 0 "[ . 1 .]" 1
967 1 133 GLU H 1 133 GLU HB2 2.800 . 2.800 2.539 2.502 2.568 . 0 0 "[ . 1 .]" 1
968 1 133 GLU H 1 133 GLU HB3 2.800 . 2.800 2.524 2.495 2.556 . 0 0 "[ . 1 .]" 1
969 1 133 GLU H 1 134 LYS H 2.800 . 2.800 2.558 2.534 2.605 . 0 0 "[ . 1 .]" 1
970 1 133 GLU H 1 134 LYS HB2 5.000 . 5.000 4.922 4.817 5.019 0.019 9 0 "[ . 1 .]" 1
971 1 133 GLU H 1 135 LYS H 5.000 . 5.000 3.762 3.713 3.795 . 0 0 "[ . 1 .]" 1
972 1 133 GLU HA 1 133 GLU HB2 2.800 . 2.800 2.468 2.453 2.483 . 0 0 "[ . 1 .]" 1
973 1 133 GLU HA 1 135 LYS H 5.000 . 5.000 3.978 3.782 4.075 . 0 0 "[ . 1 .]" 1
974 1 133 GLU HB3 1 134 LYS H . . 3.400 2.807 2.652 2.885 . 0 0 "[ . 1 .]" 1
975 1 134 LYS H 1 134 LYS HB2 2.800 . 2.800 2.654 2.533 2.738 . 0 0 "[ . 1 .]" 1
976 1 134 LYS H 1 135 LYS H 2.800 . 2.800 2.300 2.204 2.483 . 0 0 "[ . 1 .]" 1
977 1 134 LYS H 1 136 TYR H 5.000 . 5.000 3.617 3.514 3.754 . 0 0 "[ . 1 .]" 1
978 1 134 LYS H 1 140 ALA MB 5.000 . 5.000 4.275 3.789 4.559 . 0 0 "[ . 1 .]" 1
979 1 134 LYS HA 1 134 LYS HD2 5.000 . 5.000 3.958 3.099 4.653 . 0 0 "[ . 1 .]" 1
980 1 134 LYS HA 1 135 LYS H 5.000 . 5.000 3.312 3.277 3.326 . 0 0 "[ . 1 .]" 1
981 1 134 LYS HA 1 136 TYR H 5.000 . 5.000 4.541 4.483 4.589 . 0 0 "[ . 1 .]" 1
982 1 134 LYS HA 1 140 ALA MB 5.000 . 5.000 4.863 4.605 5.013 0.013 12 0 "[ . 1 .]" 1
983 1 134 LYS HB3 1 136 TYR H 5.000 . 5.000 2.930 2.787 3.987 . 0 0 "[ . 1 .]" 1
984 1 134 LYS HD2 1 137 SER H 5.000 . 5.000 4.508 3.071 5.006 0.006 1 0 "[ . 1 .]" 1
985 1 134 LYS HD2 1 140 ALA H 5.000 . 5.000 3.972 2.576 5.007 0.007 7 0 "[ . 1 .]" 1
986 1 134 LYS HE2 1 134 LYS HG3 3.400 . 3.400 2.500 2.008 3.407 0.007 7 0 "[ . 1 .]" 1
987 1 134 LYS HE2 1 140 ALA MB 5.000 . 5.000 4.347 2.684 4.984 . 0 0 "[ . 1 .]" 1
988 1 134 LYS HG2 1 136 TYR H 5.000 . 5.000 4.098 3.700 4.866 . 0 0 "[ . 1 .]" 1
989 1 134 LYS HG2 1 137 SER H 5.000 . 5.000 2.441 1.992 5.011 0.011 9 0 "[ . 1 .]" 1
990 1 134 LYS HG2 1 140 ALA H 5.000 . 5.000 3.970 3.000 5.006 0.006 9 0 "[ . 1 .]" 1
991 1 134 LYS HG2 1 140 ALA MB 5.000 . 5.000 2.873 2.081 3.319 . 0 0 "[ . 1 .]" 1
992 1 134 LYS HG3 1 136 TYR H 5.000 . 5.000 4.823 3.808 5.016 0.016 9 0 "[ . 1 .]" 1
993 1 134 LYS HG3 1 137 SER H 5.000 . 5.000 3.646 2.059 4.413 . 0 0 "[ . 1 .]" 1
994 1 135 LYS H 1 135 LYS HA 2.800 . 2.800 2.271 2.268 2.274 . 0 0 "[ . 1 .]" 1
995 1 135 LYS H 1 135 LYS HG3 5.000 . 5.000 3.366 2.792 4.141 . 0 0 "[ . 1 .]" 1
996 1 135 LYS H 1 136 TYR H 2.800 . 2.800 2.669 2.627 2.742 . 0 0 "[ . 1 .]" 1
997 1 135 LYS H 1 136 TYR HA 5.000 . 5.000 4.934 4.894 5.003 0.003 7 0 "[ . 1 .]" 1
998 1 135 LYS H 1 137 SER H 5.000 . 5.000 4.881 4.412 5.019 0.019 15 0 "[ . 1 .]" 1
999 1 135 LYS HA 1 135 LYS HB3 2.800 . 2.800 2.621 2.444 2.824 0.024 3 0 "[ . 1 .]" 1
1000 1 135 LYS HA 1 135 LYS HG3 2.800 . 2.800 2.269 2.060 2.445 . 0 0 "[ . 1 .]" 1
1001 1 135 LYS HA 1 136 TYR H 3.400 2.400 3.400 2.939 2.906 2.974 . 0 0 "[ . 1 .]" 1
1002 1 135 LYS HB3 1 135 LYS HG3 2.800 . 2.800 2.689 2.438 2.895 0.095 3 0 "[ . 1 .]" 1
1003 1 136 TYR H 1 140 ALA MB 5.000 . 5.000 3.860 3.551 4.411 . 0 0 "[ . 1 .]" 1
1004 1 136 TYR HB2 1 141 TRP HD1 5.000 . 5.000 4.344 3.836 4.727 . 0 0 "[ . 1 .]" 1
1005 1 136 TYR HD1 1 141 TRP HZ2 3.400 2.400 3.400 2.983 2.564 3.406 0.006 9 0 "[ . 1 .]" 1
1006 1 137 SER H 1 137 SER HB3 2.800 . 2.800 2.400 2.310 2.509 . 0 0 "[ . 1 .]" 1
1007 1 137 SER H 1 138 SER H 3.400 . 3.400 3.027 2.871 3.184 . 0 0 "[ . 1 .]" 1
1008 1 137 SER H 1 139 CYS H 5.600 2.400 5.600 4.919 4.778 5.068 . 0 0 "[ . 1 .]" 1
1009 1 137 SER H 1 140 ALA H 5.000 . 5.000 4.202 4.018 4.493 . 0 0 "[ . 1 .]" 1
1010 1 137 SER H 1 140 ALA MB . . 3.400 3.063 2.804 3.438 0.038 15 0 "[ . 1 .]" 1
1011 1 137 SER H 1 141 TRP H 5.000 . 5.000 4.920 4.654 5.005 0.005 8 0 "[ . 1 .]" 1
1012 1 137 SER HB3 1 140 ALA H 4.000 2.400 4.000 3.442 3.306 3.654 . 0 0 "[ . 1 .]" 1
1013 1 138 SER H 1 139 CYS H 2.800 . 2.800 2.071 1.862 2.202 . 0 0 "[ . 1 .]" 1
1014 1 138 SER H 1 139 CYS HA 5.000 . 5.000 4.502 4.387 4.561 . 0 0 "[ . 1 .]" 1
1015 1 138 SER H 1 139 CYS HB2 5.000 . 5.000 4.297 4.049 5.098 0.098 12 0 "[ . 1 .]" 1
1016 1 138 SER H 1 139 CYS HB3 5.000 . 5.000 4.560 3.667 4.711 . 0 0 "[ . 1 .]" 1
1017 1 138 SER H 1 140 ALA H 5.000 . 5.000 2.653 2.506 3.117 . 0 0 "[ . 1 .]" 1
1018 1 138 SER H 1 140 ALA MB 5.000 . 5.000 3.373 3.147 3.753 . 0 0 "[ . 1 .]" 1
1019 1 138 SER H 1 141 TRP H 5.000 . 5.000 3.709 3.391 3.922 . 0 0 "[ . 1 .]" 1
1020 1 138 SER H 1 141 TRP HD1 5.000 . 5.000 4.902 4.234 5.007 0.007 10 0 "[ . 1 .]" 1
1021 1 139 CYS H 1 140 ALA H 2.800 . 2.800 2.509 2.360 2.803 0.003 15 0 "[ . 1 .]" 1
1022 1 139 CYS H 1 140 ALA MB 5.000 . 5.000 4.112 3.965 4.313 . 0 0 "[ . 1 .]" 1
1023 1 139 CYS H 1 141 TRP H 5.000 . 5.000 4.141 3.769 4.286 . 0 0 "[ . 1 .]" 1
1024 1 139 CYS HA 1 140 ALA H 5.000 . 5.000 3.516 3.483 3.567 . 0 0 "[ . 1 .]" 1
1025 1 139 CYS HA 1 141 TRP H 5.000 . 5.000 4.119 3.967 4.275 . 0 0 "[ . 1 .]" 1
1026 1 139 CYS HA 1 142 GLU H 3.400 . 3.400 3.132 3.010 3.402 0.002 15 0 "[ . 1 .]" 1
1027 1 140 ALA H 1 140 ALA HA 2.800 . 2.800 2.777 2.767 2.788 . 0 0 "[ . 1 .]" 1
1028 1 140 ALA H 1 140 ALA MB . . 2.800 2.129 2.064 2.223 . 0 0 "[ . 1 .]" 1
1029 1 140 ALA H 1 141 TRP H 2.800 . 2.800 2.752 2.723 2.779 . 0 0 "[ . 1 .]" 1
1030 1 140 ALA HA 1 143 VAL HB 5.600 2.400 5.600 4.913 4.602 5.169 . 0 0 "[ . 1 .]" 1
1031 1 140 ALA MB 1 141 TRP H . . 3.400 2.677 2.563 2.876 . 0 0 "[ . 1 .]" 1
1032 1 140 ALA MB 1 142 GLU H 5.000 . 5.000 4.470 4.423 4.637 . 0 0 "[ . 1 .]" 1
1033 1 140 ALA MB 1 144 VAL MG1 5.000 . 5.000 3.828 3.570 4.101 . 0 0 "[ . 1 .]" 1
1034 1 141 TRP H 1 142 GLU H 2.800 . 2.800 2.479 2.457 2.523 . 0 0 "[ . 1 .]" 1
1035 1 141 TRP H 1 144 VAL MG1 5.000 . 5.000 4.633 3.896 5.015 0.015 12 0 "[ . 1 .]" 1
1036 1 141 TRP HA 1 144 VAL HB 5.000 . 5.000 4.464 4.037 4.848 . 0 0 "[ . 1 .]" 1
1037 1 141 TRP HA 1 144 VAL MG1 5.000 . 5.000 2.970 1.823 3.582 . 0 0 "[ . 1 .]" 1
1038 1 141 TRP HE3 1 144 VAL H 5.000 . 5.000 4.684 4.412 5.010 0.010 13 0 "[ . 1 .]" 1
1039 1 141 TRP HE3 1 144 VAL HB 5.000 . 5.000 4.314 4.128 4.539 . 0 0 "[ . 1 .]" 1
1040 1 141 TRP HE3 1 144 VAL MG2 . . 3.400 2.439 1.862 3.438 0.038 2 0 "[ . 1 .]" 1
1041 1 141 TRP HE3 1 145 ARG H 5.000 . 5.000 3.676 3.280 4.315 . 0 0 "[ . 1 .]" 1
1042 1 141 TRP HE3 1 148 ILE MD 5.000 . 5.000 4.961 4.505 5.021 0.021 9 0 "[ . 1 .]" 1
1043 1 141 TRP HH2 1 144 VAL MG2 5.000 . 5.000 4.559 4.147 4.782 . 0 0 "[ . 1 .]" 1
1044 1 141 TRP HZ3 1 144 VAL MG1 5.000 . 5.000 4.013 2.708 4.875 . 0 0 "[ . 1 .]" 1
1045 1 141 TRP HZ3 1 144 VAL MG2 5.000 . 5.000 2.807 2.558 3.059 . 0 0 "[ . 1 .]" 1
1046 1 142 GLU H 1 142 GLU HB3 2.800 . 2.800 2.541 2.174 2.803 0.003 11 0 "[ . 1 .]" 1
1047 1 142 GLU H 1 143 VAL H 2.800 . 2.800 2.715 2.603 2.805 0.005 14 0 "[ . 1 .]" 1
1048 1 142 GLU H 1 143 VAL MG2 5.000 . 5.000 3.624 3.501 3.712 . 0 0 "[ . 1 .]" 1
1049 1 142 GLU H 1 145 ARG H 5.000 . 5.000 4.597 4.394 4.716 . 0 0 "[ . 1 .]" 1
1050 1 142 GLU HA 1 145 ARG H 5.000 . 5.000 3.575 3.325 3.773 . 0 0 "[ . 1 .]" 1
1051 1 143 VAL H 1 143 VAL MG1 3.400 . 3.400 2.502 2.310 2.698 . 0 0 "[ . 1 .]" 1
1052 1 143 VAL HA 1 146 ALA H 5.000 . 5.000 3.800 3.521 4.026 . 0 0 "[ . 1 .]" 1
1053 1 143 VAL HA 1 146 ALA MB 5.000 . 5.000 2.825 2.596 3.216 . 0 0 "[ . 1 .]" 1
1054 1 143 VAL HA 1 147 GLU H 5.000 . 5.000 4.288 3.785 4.660 . 0 0 "[ . 1 .]" 1
1055 1 143 VAL HB 1 144 VAL MG1 5.000 . 5.000 4.216 3.702 5.009 0.009 2 0 "[ . 1 .]" 1
1056 1 144 VAL H 1 144 VAL HA . . 2.800 2.837 2.817 2.853 0.053 1 0 "[ . 1 .]" 1
1057 1 144 VAL H 1 144 VAL MG1 . . 2.800 2.166 1.844 2.447 . 0 0 "[ . 1 .]" 1
1058 1 144 VAL HA 1 144 VAL MG1 3.400 . 3.400 2.623 2.225 3.202 . 0 0 "[ . 1 .]" 1
1059 1 144 VAL HA 1 147 GLU H 5.000 . 5.000 3.652 3.422 3.869 . 0 0 "[ . 1 .]" 1
1060 1 144 VAL HA 1 147 GLU HB2 5.000 . 5.000 2.953 2.404 3.432 . 0 0 "[ . 1 .]" 1
1061 1 144 VAL HA 1 148 ILE H 5.000 . 5.000 4.800 4.493 5.015 0.015 3 0 "[ . 1 .]" 1
1062 1 144 VAL MG2 1 145 ARG H 5.000 . 5.000 2.484 1.883 3.586 . 0 0 "[ . 1 .]" 1
1063 1 145 ARG H 1 145 ARG HG3 3.400 . 3.400 2.855 2.250 3.422 0.022 10 0 "[ . 1 .]" 1
1064 1 145 ARG H 1 146 ALA H . 2.400 2.800 2.624 2.507 2.729 . 0 0 "[ . 1 .]" 1
1065 1 145 ARG H 1 146 ALA MB 5.000 . 5.000 4.260 4.102 4.345 . 0 0 "[ . 1 .]" 1
1066 1 145 ARG H 1 147 GLU H 5.000 . 5.000 3.972 3.828 4.122 . 0 0 "[ . 1 .]" 1
1067 1 145 ARG H 1 148 ILE HG13 5.000 . 5.000 4.681 4.392 4.964 . 0 0 "[ . 1 .]" 1
1068 1 146 ALA H 1 147 GLU H 2.800 . 2.800 2.669 2.504 2.751 . 0 0 "[ . 1 .]" 1
1069 1 146 ALA H 1 148 ILE H 5.000 . 5.000 4.232 4.154 4.325 . 0 0 "[ . 1 .]" 1
1070 1 146 ALA MB 1 147 GLU H 3.400 . 3.400 2.746 2.613 2.820 . 0 0 "[ . 1 .]" 1
1071 1 147 GLU H 1 148 ILE H . . 2.800 2.595 2.540 2.701 . 0 0 "[ . 1 .]" 1
1072 1 147 GLU H 1 149 MET H 5.000 . 5.000 4.176 4.006 4.314 . 0 0 "[ . 1 .]" 1
1073 1 147 GLU HA 1 148 ILE H 5.000 . 5.000 3.514 3.506 3.527 . 0 0 "[ . 1 .]" 1
1074 1 147 GLU HA 1 150 ARG H 4.000 2.400 4.000 3.408 3.217 3.594 . 0 0 "[ . 1 .]" 1
1075 1 148 ILE H 1 148 ILE HB . . 2.800 2.644 2.609 2.705 . 0 0 "[ . 1 .]" 1
1076 1 148 ILE H 1 148 ILE MD 5.000 . 5.000 3.446 3.340 3.522 . 0 0 "[ . 1 .]" 1
1077 1 148 ILE H 1 148 ILE HG13 2.800 . 2.800 1.899 1.798 1.945 0.002 3 0 "[ . 1 .]" 1
1078 1 148 ILE H 1 149 MET H 3.400 . 3.400 2.763 2.648 2.839 . 0 0 "[ . 1 .]" 1
1079 1 148 ILE HA 1 151 SER H 3.400 . 3.400 3.361 3.210 3.413 0.013 14 0 "[ . 1 .]" 1
1080 1 148 ILE HB 1 149 MET H 2.800 . 2.800 2.801 2.660 2.860 0.060 5 0 "[ . 1 .]" 1
1081 1 148 ILE MD 1 149 MET H 5.000 . 5.000 4.619 4.440 4.750 . 0 0 "[ . 1 .]" 1
1082 1 148 ILE HG12 1 148 ILE MG 3.400 . 3.400 2.308 2.173 2.393 . 0 0 "[ . 1 .]" 1
1083 1 148 ILE HG12 1 149 MET H 5.000 . 5.000 5.024 5.006 5.050 0.050 15 0 "[ . 1 .]" 1
1084 1 148 ILE MG 1 151 SER H 5.000 . 5.000 4.369 4.181 4.498 . 0 0 "[ . 1 .]" 1
1085 1 148 ILE MG 1 152 PHE HB3 5.000 . 5.000 4.748 3.335 5.037 0.037 10 0 "[ . 1 .]" 1
1086 1 148 ILE MG 1 152 PHE HD1 3.400 . 3.400 2.470 1.941 3.426 0.026 12 0 "[ . 1 .]" 1
1087 1 149 MET H 1 149 MET HA 2.800 . 2.800 2.789 2.773 2.818 0.018 7 0 "[ . 1 .]" 1
1088 1 149 MET H 1 149 MET HG3 5.000 . 5.000 4.093 3.758 4.398 . 0 0 "[ . 1 .]" 1
1089 1 149 MET H 1 150 ARG H 3.400 . 3.400 2.747 2.616 2.899 . 0 0 "[ . 1 .]" 1
1090 1 149 MET H 1 151 SER H 5.000 . 5.000 4.302 4.053 4.518 . 0 0 "[ . 1 .]" 1
1091 1 149 MET HG3 1 150 ARG H 3.400 . 3.400 3.102 2.548 3.430 0.030 3 0 "[ . 1 .]" 1
1092 1 149 MET HG3 1 153 SER H 5.000 . 5.000 4.865 4.558 5.032 0.032 9 0 "[ . 1 .]" 1
1093 1 150 ARG H 1 150 ARG HA 3.400 2.400 3.400 2.814 2.794 2.835 . 0 0 "[ . 1 .]" 1
1094 1 150 ARG H 1 150 ARG HB3 . . 2.800 2.883 2.761 3.009 0.209 3 0 "[ . 1 .]" 1
1095 1 150 ARG H 1 150 ARG HD3 5.000 . 5.000 4.259 3.373 5.014 0.014 11 0 "[ . 1 .]" 1
1096 1 150 ARG H 1 151 SER H 3.400 . 3.400 2.683 2.568 2.805 . 0 0 "[ . 1 .]" 1
1097 1 150 ARG H 1 152 PHE H 5.000 . 5.000 4.095 3.891 4.265 . 0 0 "[ . 1 .]" 1
1098 1 150 ARG HA 1 150 ARG HG3 3.400 . 3.400 2.473 2.148 3.024 . 0 0 "[ . 1 .]" 1
1099 1 150 ARG HB3 1 151 SER H . . 3.400 2.592 2.396 2.776 . 0 0 "[ . 1 .]" 1
1100 1 150 ARG HB3 1 154 LEU HG 5.000 . 5.000 4.686 4.153 5.112 0.112 3 0 "[ . 1 .]" 1
1101 1 150 ARG HG3 1 151 SER H 5.000 . 5.000 4.550 3.990 4.974 . 0 0 "[ . 1 .]" 1
1102 1 150 ARG HG3 1 154 LEU H 5.000 . 5.000 4.280 3.686 4.999 . 0 0 "[ . 1 .]" 1
1103 1 151 SER H 1 152 PHE H 5.000 . 5.000 2.704 2.634 2.765 . 0 0 "[ . 1 .]" 1
1104 1 151 SER H 1 152 PHE HD1 5.000 . 5.000 4.935 4.635 5.014 0.014 5 0 "[ . 1 .]" 1
1105 1 151 SER H 1 153 SER H 5.000 . 5.000 4.005 3.862 4.334 . 0 0 "[ . 1 .]" 1
1106 1 151 SER H 1 154 LEU MD2 5.000 . 5.000 4.707 4.183 5.069 0.069 12 0 "[ . 1 .]" 1
1107 1 151 SER HA 1 154 LEU H 5.000 . 5.000 3.867 3.094 4.840 . 0 0 "[ . 1 .]" 1
1108 1 152 PHE H 1 153 SER H 5.000 . 5.000 2.468 2.274 2.719 . 0 0 "[ . 1 .]" 1
1109 1 152 PHE HB3 1 153 SER H 3.400 . 3.400 3.425 3.321 3.473 0.073 7 0 "[ . 1 .]" 1
1110 1 153 SER H 1 154 LEU H 5.000 . 5.000 2.728 2.203 3.160 . 0 0 "[ . 1 .]" 1
1111 1 153 SER H 1 155 SER H 5.000 . 5.000 3.955 3.671 4.519 . 0 0 "[ . 1 .]" 1
1112 1 154 LEU H 1 154 LEU MD2 5.000 . 5.000 3.650 3.198 4.288 . 0 0 "[ . 1 .]" 1
1113 1 154 LEU H 1 154 LEU HG 5.000 . 5.000 2.456 1.894 4.354 . 0 0 "[ . 1 .]" 1
1114 1 154 LEU H 1 155 SER H . . 2.800 2.660 2.573 2.804 0.004 4 0 "[ . 1 .]" 1
1115 1 154 LEU H 1 155 SER HB3 5.000 . 5.000 4.987 4.777 5.047 0.047 14 0 "[ . 1 .]" 1
1116 1 154 LEU HA 1 158 LEU H 3.400 . 3.400 3.244 2.751 3.474 0.074 9 0 "[ . 1 .]" 1
1117 1 154 LEU MD2 1 155 SER HA 5.000 . 5.000 5.015 4.802 5.083 0.083 9 0 "[ . 1 .]" 1
1118 1 154 LEU HG 1 155 SER H 5.000 . 5.000 3.358 2.160 4.812 . 0 0 "[ . 1 .]" 1
1119 1 158 LEU H 1 158 LEU MD1 5.000 . 5.000 4.062 1.854 4.396 . 0 0 "[ . 1 .]" 1
1120 1 158 LEU HA 1 159 GLN H 5.000 . 5.000 3.533 3.507 3.577 . 0 0 "[ . 1 .]" 1
1121 1 158 LEU MD1 1 159 GLN H 5.000 . 5.000 3.618 2.406 4.581 . 0 0 "[ . 1 .]" 1
1122 1 158 LEU MD1 1 161 ARG H 5.000 . 5.000 4.776 4.208 5.221 0.221 9 0 "[ . 1 .]" 1
1123 1 163 LYS HB3 1 164 SER H 5.000 . 5.000 2.907 1.902 4.336 . 0 0 "[ . 1 .]" 1
1124 1 164 SER H 1 164 SER HB3 3.400 . 3.400 2.759 2.555 3.615 0.215 8 0 "[ . 1 .]" 1
1125 1 164 SER H 1 165 LYS H 3.400 . 3.400 2.543 1.872 3.630 0.230 8 0 "[ . 1 .]" 1
1126 1 164 SER H 1 165 LYS HD3 5.000 . 5.000 4.909 3.936 5.072 0.072 7 0 "[ . 1 .]" 1
1127 1 164 SER HA 1 165 LYS H 2.800 . 2.800 3.038 2.047 3.167 0.367 10 0 "[ . 1 .]" 1
1128 1 164 SER HB3 1 165 LYS H 3.400 . 3.400 3.116 1.781 3.631 0.231 8 0 "[ . 1 .]" 1
1129 1 164 SER HB3 1 166 GLU H 3.400 . 3.400 3.263 2.823 3.404 0.004 6 0 "[ . 1 .]" 1
1130 1 165 LYS H 1 165 LYS HA 2.800 . 2.800 2.437 2.280 2.914 0.114 7 0 "[ . 1 .]" 1
1131 1 165 LYS H 1 165 LYS HD3 5.000 . 5.000 3.069 1.894 3.640 . 0 0 "[ . 1 .]" 1
1132 1 165 LYS H 1 165 LYS HE3 5.000 . 5.000 2.919 2.252 3.603 . 0 0 "[ . 1 .]" 1
1133 1 165 LYS H 1 165 LYS HG2 . . 3.400 2.909 2.219 3.107 . 0 0 "[ . 1 .]" 1
1134 1 165 LYS H 1 166 GLU H 2.800 . 2.800 2.649 2.120 2.826 0.026 8 0 "[ . 1 .]" 1
1135 1 165 LYS HA 1 166 GLU H 2.800 . 2.800 2.773 2.691 2.819 0.019 8 0 "[ . 1 .]" 1
1136 1 165 LYS HD3 1 165 LYS HE3 2.800 . 2.800 2.580 2.358 2.848 0.048 14 0 "[ . 1 .]" 1
1137 1 165 LYS HD3 1 165 LYS HG2 2.800 . 2.800 2.641 2.443 2.794 . 0 0 "[ . 1 .]" 1
1138 1 165 LYS HE3 1 166 GLU H 5.000 . 5.000 4.967 4.689 5.022 0.022 14 0 "[ . 1 .]" 1
1139 1 165 LYS HG2 1 166 GLU H 5.000 . 5.000 4.674 3.860 5.008 0.008 15 0 "[ . 1 .]" 1
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