NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
454567 |
2z2d   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2z2d
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 1123
_Distance_constraint_stats_list.Viol_count 1257
_Distance_constraint_stats_list.Viol_total 2496.361
_Distance_constraint_stats_list.Viol_max 2.065
_Distance_constraint_stats_list.Viol_rms 0.0914
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0099
_Distance_constraint_stats_list.Viol_average_violations_only 0.1324
_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 10 TRP 0.000 0.000 . 0 "[ . 1 .]"
1 11 ARG 0.002 0.002 15 0 "[ . 1 .]"
1 12 LYS 0.000 0.000 . 0 "[ . 1 .]"
1 13 HIS 0.000 0.000 . 0 "[ . 1 .]"
1 14 TYR 0.116 0.096 2 0 "[ . 1 .]"
1 15 ILE 0.225 0.096 2 0 "[ . 1 .]"
1 16 THR 43.191 2.065 10 15 [*****-***+*****]
1 17 TYR 0.800 0.235 9 0 "[ . 1 .]"
1 18 ARG 0.527 0.235 9 0 "[ . 1 .]"
1 19 ILE 1.392 0.147 12 0 "[ . 1 .]"
1 20 ASN 0.388 0.084 9 0 "[ . 1 .]"
1 21 ASN 0.370 0.120 14 0 "[ . 1 .]"
1 22 TYR 1.785 0.134 2 0 "[ . 1 .]"
1 23 THR 1.281 0.614 13 1 "[ . 1 + .]"
1 24 PRO 1.047 0.099 2 0 "[ . 1 .]"
1 25 ASP 0.689 0.269 13 0 "[ . 1 .]"
1 26 MET 3.838 0.614 13 1 "[ . 1 + .]"
1 27 ASN 0.065 0.065 13 0 "[ . 1 .]"
1 28 ARG 6.858 0.230 6 0 "[ . 1 .]"
1 29 GLU 0.017 0.017 9 0 "[ . 1 .]"
1 30 ASP 2.397 0.230 6 0 "[ . 1 .]"
1 31 VAL 1.331 0.131 13 0 "[ . 1 .]"
1 32 ASP 0.085 0.053 1 0 "[ . 1 .]"
1 33 TYR 0.023 0.017 9 0 "[ . 1 .]"
1 34 ALA 0.192 0.071 13 0 "[ . 1 .]"
1 35 ILE 0.855 0.093 9 0 "[ . 1 .]"
1 36 ARG 0.923 0.079 9 0 "[ . 1 .]"
1 37 LYS 0.798 0.090 14 0 "[ . 1 .]"
1 38 ALA 0.000 0.000 . 0 "[ . 1 .]"
1 39 PHE 0.000 0.000 . 0 "[ . 1 .]"
1 40 GLN 3.804 0.229 14 0 "[ . 1 .]"
1 41 VAL 0.354 0.081 1 0 "[ . 1 .]"
1 42 TRP 3.209 0.419 13 0 "[ . 1 .]"
1 43 SER 2.446 0.346 13 0 "[ . 1 .]"
1 44 ASN 7.460 0.419 13 0 "[ . 1 .]"
1 45 VAL 1.685 0.200 14 0 "[ . 1 .]"
1 46 THR 0.089 0.029 2 0 "[ . 1 .]"
1 47 PRO 0.093 0.058 9 0 "[ . 1 .]"
1 48 LEU 0.551 0.396 7 0 "[ . 1 .]"
1 49 LYS 4.928 0.377 13 0 "[ . 1 .]"
1 50 PHE 0.499 0.052 8 0 "[ . 1 .]"
1 51 SER 0.091 0.035 2 0 "[ . 1 .]"
1 52 LYS 3.580 0.156 12 0 "[ . 1 .]"
1 53 ILE 1.292 0.098 6 0 "[ . 1 .]"
1 54 ASN 0.000 0.000 . 0 "[ . 1 .]"
1 55 THR 0.089 0.062 1 0 "[ . 1 .]"
1 56 GLY 0.089 0.062 1 0 "[ . 1 .]"
1 57 MET 0.164 0.102 10 0 "[ . 1 .]"
1 58 ALA 0.061 0.061 15 0 "[ . 1 .]"
1 59 ASP 43.184 2.065 10 15 [*****-***+*****]
1 60 ILE 0.494 0.165 6 0 "[ . 1 .]"
1 61 LEU 1.823 0.154 1 0 "[ . 1 .]"
1 62 VAL 0.889 0.126 10 0 "[ . 1 .]"
1 63 VAL 0.391 0.084 9 0 "[ . 1 .]"
1 64 PHE 0.314 0.052 12 0 "[ . 1 .]"
1 65 ALA 0.362 0.165 1 0 "[ . 1 .]"
1 66 ARG 0.531 0.145 12 0 "[ . 1 .]"
1 67 GLY 0.801 0.250 11 0 "[ . 1 .]"
1 68 ALA 0.214 0.084 9 0 "[ . 1 .]"
1 72 PHE 0.000 0.000 . 0 "[ . 1 .]"
1 73 HIS 1.345 0.262 8 0 "[ . 1 .]"
1 74 ALA 1.559 0.262 8 0 "[ . 1 .]"
1 75 PHE 1.773 0.281 15 0 "[ . 1 .]"
1 76 ASP 1.384 0.281 15 0 "[ . 1 .]"
1 77 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 78 LYS 3.278 0.276 12 0 "[ . 1 .]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 80 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 81 ILE 0.455 0.137 14 0 "[ . 1 .]"
1 82 LEU 0.640 0.105 14 0 "[ . 1 .]"
1 83 ALA 0.000 0.000 . 0 "[ . 1 .]"
1 84 HIS 0.876 0.108 6 0 "[ . 1 .]"
1 85 ALA 0.025 0.017 11 0 "[ . 1 .]"
1 86 PHE 0.760 0.701 2 1 "[ + . 1 .]"
1 87 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 88 PRO 0.677 0.369 1 0 "[ . 1 .]"
1 89 GLY 0.677 0.369 1 0 "[ . 1 .]"
1 90 SER 0.000 0.000 . 0 "[ . 1 .]"
1 91 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 92 ILE 1.350 0.701 2 1 "[ + . 1 .]"
1 93 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 94 GLY 0.035 0.035 7 0 "[ . 1 .]"
1 95 ASP 0.034 0.034 6 0 "[ . 1 .]"
1 96 ALA 0.001 0.001 3 0 "[ . 1 .]"
1 97 HIS 1.831 0.196 13 0 "[ . 1 .]"
1 98 PHE 0.019 0.014 10 0 "[ . 1 .]"
1 99 ASP 1.024 0.114 13 0 "[ . 1 .]"
1 100 GLU 2.049 0.230 6 0 "[ . 1 .]"
1 101 ASP 0.174 0.083 12 0 "[ . 1 .]"
1 102 GLU 1.060 0.114 13 0 "[ . 1 .]"
1 103 PHE 0.174 0.083 12 0 "[ . 1 .]"
1 104 TRP 2.122 0.230 6 0 "[ . 1 .]"
1 105 THR 0.000 0.000 . 0 "[ . 1 .]"
1 106 THR 0.025 0.016 10 0 "[ . 1 .]"
1 108 SER 0.000 0.000 . 0 "[ . 1 .]"
1 109 GLY 0.212 0.084 8 0 "[ . 1 .]"
1 110 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 111 THR 0.588 0.084 8 0 "[ . 1 .]"
1 112 ASN 0.000 0.000 . 0 "[ . 1 .]"
1 113 LEU 0.520 0.093 9 0 "[ . 1 .]"
1 114 PHE 0.000 0.000 . 0 "[ . 1 .]"
1 115 LEU 0.153 0.064 12 0 "[ . 1 .]"
1 116 THR 0.068 0.066 6 0 "[ . 1 .]"
1 117 ALA 0.000 0.000 . 0 "[ . 1 .]"
1 118 VAL 0.191 0.033 8 0 "[ . 1 .]"
1 119 HIS 0.759 0.157 1 0 "[ . 1 .]"
1 120 GLU 0.432 0.123 11 0 "[ . 1 .]"
1 121 ILE 0.328 0.273 6 0 "[ . 1 .]"
1 122 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 123 HIS 0.489 0.114 5 0 "[ . 1 .]"
1 124 SER 0.000 0.000 . 0 "[ . 1 .]"
1 125 LEU 1.171 0.254 1 0 "[ . 1 .]"
1 126 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 127 LEU 0.346 0.065 8 0 "[ . 1 .]"
1 128 GLY 0.183 0.065 1 0 "[ . 1 .]"
1 129 HIS 0.850 0.138 13 0 "[ . 1 .]"
1 130 SER 0.201 0.074 14 0 "[ . 1 .]"
1 131 SER 0.108 0.108 5 0 "[ . 1 .]"
1 132 ASP 0.721 0.125 13 0 "[ . 1 .]"
1 133 PRO 0.081 0.029 2 0 "[ . 1 .]"
1 134 LYS 0.936 0.121 10 0 "[ . 1 .]"
1 135 ALA 0.629 0.112 6 0 "[ . 1 .]"
1 136 VAL 0.920 0.157 1 0 "[ . 1 .]"
1 137 MET 0.889 0.123 11 0 "[ . 1 .]"
1 138 PHE 0.992 0.138 13 0 "[ . 1 .]"
1 139 PRO 0.000 0.000 . 0 "[ . 1 .]"
1 140 THR 0.063 0.030 12 0 "[ . 1 .]"
1 141 TYR 0.098 0.034 7 0 "[ . 1 .]"
1 142 LYS 2.932 0.158 13 0 "[ . 1 .]"
1 143 TYR 0.878 0.265 14 0 "[ . 1 .]"
1 144 VAL 1.711 0.158 13 0 "[ . 1 .]"
1 145 ASP 40.402 2.042 3 14 "[*-+** *********]"
1 146 ILE 1.411 0.134 13 0 "[ . 1 .]"
1 147 ASN 39.802 2.042 3 14 "[*-+** *********]"
1 148 THR 1.761 0.224 6 0 "[ . 1 .]"
1 149 PHE 2.136 0.224 6 0 "[ . 1 .]"
1 150 ARG 7.805 0.244 13 0 "[ . 1 .]"
1 151 LEU 4.521 0.244 13 0 "[ . 1 .]"
1 152 SER 1.666 0.228 14 0 "[ . 1 .]"
1 153 ALA 0.034 0.034 2 0 "[ . 1 .]"
1 154 ASP 0.132 0.034 13 0 "[ . 1 .]"
1 155 ASP 0.002 0.002 1 0 "[ . 1 .]"
1 156 ILE 2.892 0.207 1 0 "[ . 1 .]"
1 157 ARG 0.452 0.090 13 0 "[ . 1 .]"
1 158 GLY 0.000 0.000 . 0 "[ . 1 .]"
1 159 ILE 1.212 0.100 1 0 "[ . 1 .]"
1 160 GLN 0.248 0.182 11 0 "[ . 1 .]"
1 161 SER 0.000 0.000 11 0 "[ . 1 .]"
1 162 LEU 0.414 0.167 14 0 "[ . 1 .]"
1 163 TYR 2.131 0.396 7 0 "[ . 1 .]"
1 164 GLY 0.136 0.136 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 10 TRP H 1 11 ARG H . . 5.600 3.886 1.926 4.767 . 0 0 "[ . 1 .]" 1
2 1 10 TRP H 1 11 ARG HA . . 5.600 4.836 4.439 5.588 . 0 0 "[ . 1 .]" 1
3 1 11 ARG H 1 11 ARG QD . . 4.900 4.170 2.176 4.721 . 0 0 "[ . 1 .]" 1
4 1 11 ARG H 1 11 ARG HG2 . . 4.100 3.165 2.207 3.835 . 0 0 "[ . 1 .]" 1
5 1 11 ARG H 1 11 ARG HG3 . . 4.000 2.875 2.281 3.989 . 0 0 "[ . 1 .]" 1
6 1 11 ARG HA 1 12 LYS HB2 . . 5.600 4.271 3.924 5.124 . 0 0 "[ . 1 .]" 1
7 1 11 ARG HA 1 12 LYS HB3 . . 7.800 4.912 4.064 5.906 . 0 0 "[ . 1 .]" 1
8 1 11 ARG HB2 1 15 ILE MG . . 6.000 5.371 4.382 6.002 0.002 15 0 "[ . 1 .]" 1
9 1 12 LYS HE2 1 15 ILE MD . . 5.300 4.288 2.657 5.268 . 0 0 "[ . 1 .]" 1
10 1 12 LYS HE3 1 15 ILE MD . . 6.100 4.904 2.927 6.092 . 0 0 "[ . 1 .]" 1
11 1 13 HIS H 1 14 TYR H . . 4.200 2.730 2.041 4.126 . 0 0 "[ . 1 .]" 1
12 1 13 HIS HA 1 14 TYR H . . 5.600 3.513 3.289 3.655 . 0 0 "[ . 1 .]" 1
13 1 13 HIS HB3 1 14 TYR H . . 5.600 3.415 2.187 4.399 . 0 0 "[ . 1 .]" 1
14 1 13 HIS O 1 49 LYS H . . 2.200 1.861 1.716 1.990 . 0 0 "[ . 1 .]" 1
15 1 13 HIS O 1 49 LYS N . . 3.200 2.688 2.574 2.880 . 0 0 "[ . 1 .]" 1
16 1 14 TYR HA 1 15 ILE H . . 4.900 2.177 2.139 2.253 . 0 0 "[ . 1 .]" 1
17 1 14 TYR HB2 1 15 ILE H . . 5.600 4.357 3.993 4.564 . 0 0 "[ . 1 .]" 1
18 1 14 TYR HD1 1 15 ILE H . . 4.600 3.904 2.742 4.696 0.096 2 0 "[ . 1 .]" 1
19 1 14 TYR HD2 1 16 THR MG . . 6.600 5.012 2.820 6.418 . 0 0 "[ . 1 .]" 1
20 1 14 TYR QE 1 16 THR MG . . 8.800 2.555 2.011 3.905 . 0 0 "[ . 1 .]" 1
21 1 14 TYR HH 1 16 THR HA . . 5.600 4.895 4.234 5.477 . 0 0 "[ . 1 .]" 1
22 1 14 TYR HH 1 16 THR MG . . 4.500 2.951 1.837 4.227 . 0 0 "[ . 1 .]" 1
23 1 15 ILE H 1 15 ILE HG12 . . 3.100 2.617 2.052 3.116 0.016 15 0 "[ . 1 .]" 1
24 1 15 ILE H 1 15 ILE HG13 . . 3.900 3.053 2.156 3.885 . 0 0 "[ . 1 .]" 1
25 1 15 ILE H 1 16 THR H . . 5.600 4.539 4.361 4.691 . 0 0 "[ . 1 .]" 1
26 1 15 ILE H 1 49 LYS O . . 2.200 1.893 1.667 2.102 . 0 0 "[ . 1 .]" 1
27 1 15 ILE H 1 50 PHE HA . . 5.600 2.672 2.131 3.393 . 0 0 "[ . 1 .]" 1
28 1 15 ILE HA 1 15 ILE HG12 . . 4.200 2.990 2.404 3.685 . 0 0 "[ . 1 .]" 1
29 1 15 ILE HA 1 16 THR H . . 5.600 2.269 2.175 2.434 . 0 0 "[ . 1 .]" 1
30 1 15 ILE MD 1 16 THR H . . 6.700 4.417 3.820 5.074 . 0 0 "[ . 1 .]" 1
31 1 15 ILE MD 1 50 PHE QD . . 8.000 3.573 2.809 4.775 . 0 0 "[ . 1 .]" 1
32 1 15 ILE MD 1 50 PHE HZ . . 5.600 4.350 3.532 5.634 0.034 1 0 "[ . 1 .]" 1
33 1 15 ILE MD 1 125 LEU MD2 . . 4.900 3.661 1.738 4.864 . 0 0 "[ . 1 .]" 1
34 1 15 ILE MG 1 16 THR H . . 6.500 2.293 2.061 2.491 . 0 0 "[ . 1 .]" 1
35 1 15 ILE MG 1 50 PHE QD . . 8.200 3.194 1.990 4.071 . 0 0 "[ . 1 .]" 1
36 1 15 ILE MG 1 59 ASP HB2 . . 5.600 2.834 1.899 5.047 . 0 0 "[ . 1 .]" 1
37 1 15 ILE MG 1 60 ILE H . . 7.800 3.715 3.139 4.184 . 0 0 "[ . 1 .]" 1
38 1 15 ILE MG 1 60 ILE MD . . 6.100 2.709 1.707 4.820 . 0 0 "[ . 1 .]" 1
39 1 15 ILE MG 1 60 ILE MG . . 4.900 4.164 2.694 4.926 0.026 1 0 "[ . 1 .]" 1
40 1 15 ILE MG 1 125 LEU MD2 . . 4.900 4.188 2.513 4.932 0.032 7 0 "[ . 1 .]" 1
41 1 15 ILE N 1 49 LYS O . . 3.200 2.843 2.463 3.035 . 0 0 "[ . 1 .]" 1
42 1 15 ILE O 1 51 SER H . . 2.200 1.962 1.735 2.132 . 0 0 "[ . 1 .]" 1
43 1 15 ILE O 1 51 SER N . . 3.200 2.910 2.720 3.043 . 0 0 "[ . 1 .]" 1
44 1 16 THR H 1 17 TYR H . . 5.600 4.540 4.433 4.635 . 0 0 "[ . 1 .]" 1
45 1 16 THR H 1 59 ASP H . . 4.900 3.639 2.729 4.538 . 0 0 "[ . 1 .]" 1
46 1 16 THR H 1 59 ASP HB2 . . 5.600 2.782 1.943 5.045 . 0 0 "[ . 1 .]" 1
47 1 16 THR H 1 59 ASP HB3 . . 4.500 3.575 2.676 4.174 . 0 0 "[ . 1 .]" 1
48 1 16 THR H 1 59 ASP OD1 . . 2.200 3.704 2.700 4.265 2.065 10 15 [*****-***+*****] 1
49 1 16 THR HA 1 17 TYR H . . 5.600 2.288 2.173 2.369 . 0 0 "[ . 1 .]" 1
50 1 16 THR HA 1 51 SER H . . 5.300 2.749 2.071 3.281 . 0 0 "[ . 1 .]" 1
51 1 16 THR HA 1 53 ILE H . . 5.600 5.167 4.654 5.574 . 0 0 "[ . 1 .]" 1
52 1 16 THR HB 1 17 TYR H . . 5.600 3.039 2.473 3.722 . 0 0 "[ . 1 .]" 1
53 1 16 THR HB 1 53 ILE MD . . 4.500 3.732 2.475 4.482 . 0 0 "[ . 1 .]" 1
54 1 16 THR HB 1 53 ILE MG . . 5.800 4.441 3.288 5.760 . 0 0 "[ . 1 .]" 1
55 1 16 THR HB 1 58 ALA MB . . 6.100 2.262 1.903 3.013 . 0 0 "[ . 1 .]" 1
56 1 16 THR HG1 1 59 ASP H . . 5.600 3.143 2.030 4.818 . 0 0 "[ . 1 .]" 1
57 1 16 THR MG 1 17 TYR H . . 5.700 2.934 2.066 3.788 . 0 0 "[ . 1 .]" 1
58 1 16 THR MG 1 51 SER H . . 6.600 3.949 3.022 4.866 . 0 0 "[ . 1 .]" 1
59 1 16 THR MG 1 51 SER HB2 . . 5.000 3.164 2.212 4.422 . 0 0 "[ . 1 .]" 1
60 1 16 THR MG 1 51 SER HB3 . . 4.900 4.350 3.581 4.907 0.007 7 0 "[ . 1 .]" 1
61 1 16 THR MG 1 52 LYS HA . . 5.200 4.109 3.206 4.775 . 0 0 "[ . 1 .]" 1
62 1 16 THR MG 1 53 ILE HB . . 6.300 4.747 3.516 6.015 . 0 0 "[ . 1 .]" 1
63 1 16 THR MG 1 53 ILE MD . . 4.900 2.917 1.845 4.223 . 0 0 "[ . 1 .]" 1
64 1 16 THR MG 1 53 ILE MG . . 5.300 2.748 1.751 3.628 . 0 0 "[ . 1 .]" 1
65 1 16 THR N 1 59 ASP OD1 . . 3.200 4.575 3.292 5.197 1.997 10 14 "[***** ***+****-]" 1
66 1 16 THR O 1 60 ILE H . . 2.200 1.955 1.716 2.194 . 0 0 "[ . 1 .]" 1
67 1 16 THR O 1 60 ILE N . . 3.200 2.906 2.706 3.138 . 0 0 "[ . 1 .]" 1
68 1 17 TYR H 1 18 ARG H . . 5.600 4.442 4.406 4.518 . 0 0 "[ . 1 .]" 1
69 1 17 TYR H 1 51 SER H . . 4.200 3.915 3.624 4.144 . 0 0 "[ . 1 .]" 1
70 1 17 TYR H 1 51 SER O . . 2.200 2.066 1.876 2.176 . 0 0 "[ . 1 .]" 1
71 1 17 TYR H 1 52 LYS HA . . 5.600 2.345 2.150 2.638 . 0 0 "[ . 1 .]" 1
72 1 17 TYR H 1 53 ILE H . . 5.600 3.356 2.954 3.759 . 0 0 "[ . 1 .]" 1
73 1 17 TYR H 1 58 ALA MB . . 6.100 2.911 2.359 3.499 . 0 0 "[ . 1 .]" 1
74 1 17 TYR HA 1 18 ARG H . . 5.600 2.306 2.189 2.351 . 0 0 "[ . 1 .]" 1
75 1 17 TYR HA 1 53 ILE HG12 . . 5.600 5.369 5.125 5.540 . 0 0 "[ . 1 .]" 1
76 1 17 TYR HA 1 60 ILE H . . 5.600 2.637 2.222 3.211 . 0 0 "[ . 1 .]" 1
77 1 17 TYR HA 1 60 ILE MD . . 5.900 3.865 3.020 4.922 . 0 0 "[ . 1 .]" 1
78 1 17 TYR HA 1 60 ILE MG . . 5.300 3.995 3.024 4.854 . 0 0 "[ . 1 .]" 1
79 1 17 TYR HB2 1 18 ARG H . . 3.900 3.534 2.528 4.135 0.235 9 0 "[ . 1 .]" 1
80 1 17 TYR HB2 1 60 ILE MG . . 5.800 4.236 3.357 5.838 0.038 2 0 "[ . 1 .]" 1
81 1 17 TYR HB3 1 18 ARG H . . 5.600 3.683 2.604 4.369 . 0 0 "[ . 1 .]" 1
82 1 17 TYR HB3 1 52 LYS HB2 . . 5.300 3.745 2.053 5.165 . 0 0 "[ . 1 .]" 1
83 1 17 TYR HB3 1 52 LYS HD2 . . 5.900 5.191 4.135 6.007 0.107 15 0 "[ . 1 .]" 1
84 1 17 TYR HB3 1 58 ALA MB . . 5.200 4.444 4.022 5.095 . 0 0 "[ . 1 .]" 1
85 1 17 TYR HB3 1 60 ILE MG . . 5.200 4.594 3.079 5.226 0.026 1 0 "[ . 1 .]" 1
86 1 17 TYR N 1 51 SER O . . 3.200 2.925 2.678 3.089 . 0 0 "[ . 1 .]" 1
87 1 17 TYR O 1 53 ILE H . . 2.300 1.991 1.740 2.272 . 0 0 "[ . 1 .]" 1
88 1 17 TYR O 1 53 ILE N . . 3.500 2.957 2.695 3.209 . 0 0 "[ . 1 .]" 1
89 1 18 ARG H 1 19 ILE MD . . 6.500 5.611 4.737 6.465 . 0 0 "[ . 1 .]" 1
90 1 18 ARG H 1 58 ALA MB . . 4.000 3.065 2.636 3.495 . 0 0 "[ . 1 .]" 1
91 1 18 ARG H 1 60 ILE MD . . 6.600 5.016 3.061 6.026 . 0 0 "[ . 1 .]" 1
92 1 18 ARG H 1 60 ILE O . . 2.300 1.976 1.628 2.269 . 0 0 "[ . 1 .]" 1
93 1 18 ARG H 1 61 LEU HA . . 5.600 2.690 2.149 3.152 . 0 0 "[ . 1 .]" 1
94 1 18 ARG H 1 62 VAL H . . 5.600 3.561 3.308 4.090 . 0 0 "[ . 1 .]" 1
95 1 18 ARG HA 1 19 ILE H . . 5.600 2.177 2.147 2.220 . 0 0 "[ . 1 .]" 1
96 1 18 ARG HB2 1 19 ILE H . . 5.600 4.182 3.537 4.581 . 0 0 "[ . 1 .]" 1
97 1 18 ARG HB2 1 58 ALA H . . 5.600 3.423 2.160 5.661 0.061 15 0 "[ . 1 .]" 1
98 1 18 ARG N 1 60 ILE O . . 3.300 2.872 2.466 3.165 . 0 0 "[ . 1 .]" 1
99 1 18 ARG O 1 62 VAL H . . 2.200 1.985 1.942 2.091 . 0 0 "[ . 1 .]" 1
100 1 18 ARG O 1 62 VAL N . . 3.200 2.958 2.880 3.046 . 0 0 "[ . 1 .]" 1
101 1 19 ILE H 1 52 LYS HG2 . . 5.100 4.869 3.969 5.156 0.056 6 0 "[ . 1 .]" 1
102 1 19 ILE H 1 52 LYS HG3 . . 5.600 3.961 3.388 5.710 0.110 13 0 "[ . 1 .]" 1
103 1 19 ILE HA 1 20 ASN H . . 5.600 2.201 2.166 2.227 . 0 0 "[ . 1 .]" 1
104 1 19 ILE HA 1 62 VAL H . . 4.900 3.285 2.848 3.614 . 0 0 "[ . 1 .]" 1
105 1 19 ILE HA 1 62 VAL HB . . 5.000 3.041 1.982 4.345 . 0 0 "[ . 1 .]" 1
106 1 19 ILE HA 1 62 VAL MG1 . . 4.700 3.973 2.273 4.729 0.029 10 0 "[ . 1 .]" 1
107 1 19 ILE HB 1 19 ILE HG12 . . 2.900 2.771 2.441 3.047 0.147 12 0 "[ . 1 .]" 1
108 1 19 ILE HB 1 20 ASN H . . 5.600 4.514 4.100 4.629 . 0 0 "[ . 1 .]" 1
109 1 19 ILE HB 1 22 TYR HH . . 5.100 4.893 2.788 5.147 0.047 14 0 "[ . 1 .]" 1
110 1 19 ILE MD 1 22 TYR QD . . 8.800 3.883 2.870 4.895 . 0 0 "[ . 1 .]" 1
111 1 19 ILE MD 1 31 VAL MG2 . . 4.700 4.280 2.799 4.710 0.010 13 0 "[ . 1 .]" 1
112 1 19 ILE MD 1 32 ASP HA . . 6.600 4.035 2.850 5.601 . 0 0 "[ . 1 .]" 1
113 1 19 ILE MD 1 35 ILE H . . 6.400 5.095 4.083 5.818 . 0 0 "[ . 1 .]" 1
114 1 19 ILE MD 1 35 ILE HB . . 5.200 4.102 2.775 5.201 0.001 15 0 "[ . 1 .]" 1
115 1 19 ILE MD 1 35 ILE MD . . 6.500 2.608 1.745 3.933 . 0 0 "[ . 1 .]" 1
116 1 19 ILE MD 1 35 ILE MG . . 5.800 2.862 1.995 3.572 . 0 0 "[ . 1 .]" 1
117 1 19 ILE MD 1 52 LYS QE . . 4.200 3.767 2.021 4.240 0.040 4 0 "[ . 1 .]" 1
118 1 19 ILE HG13 1 31 VAL HA . . 7.000 6.875 5.674 7.036 0.036 8 0 "[ . 1 .]" 1
119 1 19 ILE MG 1 20 ASN H . . 6.100 3.101 2.489 3.886 . 0 0 "[ . 1 .]" 1
120 1 19 ILE MG 1 21 ASN H . . 6.100 3.491 2.156 5.304 . 0 0 "[ . 1 .]" 1
121 1 19 ILE MG 1 22 TYR QD . . 5.600 2.422 1.805 3.679 . 0 0 "[ . 1 .]" 1
122 1 19 ILE MG 1 31 VAL MG1 . . 7.200 3.637 2.211 4.390 . 0 0 "[ . 1 .]" 1
123 1 19 ILE MG 1 31 VAL MG2 . . 5.200 4.705 3.536 5.182 . 0 0 "[ . 1 .]" 1
124 1 19 ILE MG 1 35 ILE MD . . 7.100 4.595 3.439 5.845 . 0 0 "[ . 1 .]" 1
125 1 19 ILE MG 1 62 VAL HB . . 5.800 4.736 2.649 5.508 . 0 0 "[ . 1 .]" 1
126 1 19 ILE MG 1 62 VAL MG1 . . 6.600 4.858 3.288 6.054 . 0 0 "[ . 1 .]" 1
127 1 19 ILE MG 1 62 VAL MG2 . . 6.600 4.746 2.744 6.276 . 0 0 "[ . 1 .]" 1
128 1 20 ASN H 1 21 ASN H . . 5.600 3.916 3.124 4.735 . 0 0 "[ . 1 .]" 1
129 1 20 ASN H 1 62 VAL H . . 4.000 3.666 3.157 3.961 . 0 0 "[ . 1 .]" 1
130 1 20 ASN H 1 62 VAL HB . . 5.600 3.434 2.454 4.551 . 0 0 "[ . 1 .]" 1
131 1 20 ASN H 1 63 VAL MG2 . . 6.600 4.574 3.275 5.725 . 0 0 "[ . 1 .]" 1
132 1 20 ASN HA 1 21 ASN H . . 4.200 3.222 2.190 3.688 . 0 0 "[ . 1 .]" 1
133 1 20 ASN HA 1 63 VAL MG2 . . 6.600 4.441 2.695 6.242 . 0 0 "[ . 1 .]" 1
134 1 20 ASN HB2 1 21 ASN H . . 5.600 3.581 2.062 4.120 . 0 0 "[ . 1 .]" 1
135 1 20 ASN HB2 1 63 VAL MG1 . . 3.900 3.156 1.908 3.940 0.040 13 0 "[ . 1 .]" 1
136 1 20 ASN HB2 1 63 VAL MG2 . . 3.900 3.507 1.998 3.984 0.084 9 0 "[ . 1 .]" 1
137 1 20 ASN HB3 1 21 ASN H . . 3.400 2.485 1.932 3.417 0.017 7 0 "[ . 1 .]" 1
138 1 20 ASN HB3 1 63 VAL MG1 . . 4.800 3.988 2.768 4.829 0.029 10 0 "[ . 1 .]" 1
139 1 20 ASN HB3 1 63 VAL MG2 . . 6.200 4.379 2.554 5.253 . 0 0 "[ . 1 .]" 1
140 1 20 ASN HD22 1 63 VAL MG1 . . 4.800 3.665 1.941 4.777 . 0 0 "[ . 1 .]" 1
141 1 20 ASN HD22 1 63 VAL MG2 . . 5.700 4.390 2.071 5.744 0.044 15 0 "[ . 1 .]" 1
142 1 21 ASN H 1 21 ASN HB2 . . 3.500 2.954 2.361 3.438 . 0 0 "[ . 1 .]" 1
143 1 21 ASN H 1 21 ASN HB3 . . 3.900 3.586 2.754 4.020 0.120 14 0 "[ . 1 .]" 1
144 1 21 ASN HA 1 22 TYR H . . 5.600 2.747 2.265 3.632 . 0 0 "[ . 1 .]" 1
145 1 21 ASN HB2 1 22 TYR H . . 5.100 4.374 3.434 4.714 . 0 0 "[ . 1 .]" 1
146 1 21 ASN HB3 1 22 TYR H . . 5.600 4.115 2.106 4.573 . 0 0 "[ . 1 .]" 1
147 1 22 TYR H 1 22 TYR QE . . 5.800 4.188 3.689 5.934 0.134 2 0 "[ . 1 .]" 1
148 1 22 TYR HB3 1 31 VAL MG1 . . 4.900 4.792 3.423 4.950 0.050 2 0 "[ . 1 .]" 1
149 1 22 TYR QD 1 28 ARG HA . . 7.800 3.631 3.128 3.999 . 0 0 "[ . 1 .]" 1
150 1 22 TYR QD 1 28 ARG HD2 . . 3.900 3.977 3.927 4.029 0.129 8 0 "[ . 1 .]" 1
151 1 22 TYR QD 1 28 ARG HG2 . . 5.600 2.168 2.025 2.953 . 0 0 "[ . 1 .]" 1
152 1 22 TYR QD 1 28 ARG HG3 . . 7.800 3.117 2.033 3.661 . 0 0 "[ . 1 .]" 1
153 1 22 TYR QD 1 31 VAL MG1 . . 5.600 3.688 2.732 4.272 . 0 0 "[ . 1 .]" 1
154 1 23 THR H 1 25 ASP H . . 6.100 5.337 3.339 6.223 0.123 8 0 "[ . 1 .]" 1
155 1 23 THR MG 1 25 ASP H . . 6.300 3.808 2.020 5.085 . 0 0 "[ . 1 .]" 1
156 1 23 THR MG 1 26 MET H . . 4.400 3.369 1.804 5.014 0.614 13 1 "[ . 1 + .]" 1
157 1 24 PRO HA 1 25 ASP H . . 5.600 3.622 3.564 3.681 . 0 0 "[ . 1 .]" 1
158 1 24 PRO HA 1 26 MET H . . 5.600 4.968 3.927 5.643 0.043 12 0 "[ . 1 .]" 1
159 1 24 PRO HB2 1 25 ASP H . . 5.600 2.950 2.085 3.400 . 0 0 "[ . 1 .]" 1
160 1 24 PRO HB3 1 24 PRO HD3 . . 3.000 3.004 2.891 3.051 0.051 10 0 "[ . 1 .]" 1
161 1 24 PRO HD2 1 24 PRO HG3 . . 2.700 2.706 2.621 2.799 0.099 2 0 "[ . 1 .]" 1
162 1 24 PRO HD2 1 25 ASP H . . 5.600 2.885 2.594 3.639 . 0 0 "[ . 1 .]" 1
163 1 24 PRO HD2 1 26 MET HB3 . . 5.800 5.659 4.976 5.884 0.084 9 0 "[ . 1 .]" 1
164 1 24 PRO HD3 1 25 ASP H . . 5.600 3.972 3.834 4.337 . 0 0 "[ . 1 .]" 1
165 1 24 PRO HG3 1 25 ASP H . . 5.600 3.693 3.485 3.981 . 0 0 "[ . 1 .]" 1
166 1 25 ASP H 1 25 ASP OD1 . . 2.200 1.951 1.689 2.203 0.003 14 0 "[ . 1 .]" 1
167 1 25 ASP H 1 26 MET H . . 5.800 2.451 1.860 3.023 . 0 0 "[ . 1 .]" 1
168 1 25 ASP H 1 26 MET ME . . 6.100 5.684 4.971 6.169 0.069 14 0 "[ . 1 .]" 1
169 1 25 ASP HA 1 26 MET H . . 4.000 3.534 3.312 3.620 . 0 0 "[ . 1 .]" 1
170 1 25 ASP HB3 1 26 MET H . . 4.200 3.964 3.467 4.469 0.269 13 0 "[ . 1 .]" 1
171 1 25 ASP N 1 25 ASP OD1 . . 3.200 2.679 2.507 2.865 . 0 0 "[ . 1 .]" 1
172 1 26 MET H 1 26 MET ME . . 5.700 4.268 3.401 5.376 . 0 0 "[ . 1 .]" 1
173 1 26 MET H 1 26 MET HG3 . . 4.000 3.917 3.527 4.098 0.098 3 0 "[ . 1 .]" 1
174 1 26 MET H 1 27 ASN H . . 5.600 4.493 4.159 4.696 . 0 0 "[ . 1 .]" 1
175 1 26 MET HA 1 27 ASN H . . 5.200 2.182 2.112 2.407 . 0 0 "[ . 1 .]" 1
176 1 26 MET HB2 1 26 MET HG3 . . 3.100 2.360 2.118 2.643 . 0 0 "[ . 1 .]" 1
177 1 26 MET HB2 1 27 ASN H . . 5.600 4.427 4.142 4.620 . 0 0 "[ . 1 .]" 1
178 1 26 MET HB2 1 28 ARG HG3 . . 7.200 6.955 6.140 7.320 0.120 1 0 "[ . 1 .]" 1
179 1 26 MET HB3 1 27 ASN H . . 5.600 3.634 3.314 4.066 . 0 0 "[ . 1 .]" 1
180 1 26 MET HB3 1 28 ARG HG3 . . 5.800 5.753 5.385 5.898 0.098 1 0 "[ . 1 .]" 1
181 1 26 MET HB3 1 31 VAL MG1 . . 4.100 4.133 4.029 4.231 0.131 13 0 "[ . 1 .]" 1
182 1 26 MET HB3 1 106 THR MG . . 4.800 4.435 3.698 4.805 0.005 5 0 "[ . 1 .]" 1
183 1 26 MET ME 1 31 VAL MG2 . . 4.400 3.347 1.940 4.272 . 0 0 "[ . 1 .]" 1
184 1 26 MET ME 1 104 TRP HE1 . . 6.000 4.228 2.734 6.083 0.083 7 0 "[ . 1 .]" 1
185 1 26 MET ME 1 106 THR MG . . 6.900 4.191 3.290 4.887 . 0 0 "[ . 1 .]" 1
186 1 26 MET HG3 1 27 ASN H . . 5.600 4.351 3.640 5.665 0.065 13 0 "[ . 1 .]" 1
187 1 27 ASN HA 1 28 ARG H . . 5.600 2.100 2.031 2.148 . 0 0 "[ . 1 .]" 1
188 1 27 ASN HA 1 29 GLU H . . 5.600 4.403 4.341 4.485 . 0 0 "[ . 1 .]" 1
189 1 27 ASN HA 1 30 ASP H . . 5.600 4.432 4.367 4.516 . 0 0 "[ . 1 .]" 1
190 1 27 ASN HB2 1 28 ARG H . . 5.600 4.315 3.731 4.458 . 0 0 "[ . 1 .]" 1
191 1 27 ASN HB3 1 28 ARG H . . 5.600 3.375 3.118 3.700 . 0 0 "[ . 1 .]" 1
192 1 27 ASN HB3 1 29 GLU H . . 5.600 3.450 3.283 3.740 . 0 0 "[ . 1 .]" 1
193 1 27 ASN O 1 31 VAL H . . 2.200 1.934 1.719 2.063 . 0 0 "[ . 1 .]" 1
194 1 27 ASN O 1 31 VAL N . . 3.200 2.866 2.655 2.987 . 0 0 "[ . 1 .]" 1
195 1 28 ARG H 1 28 ARG HG2 . . 4.600 3.474 3.414 3.544 . 0 0 "[ . 1 .]" 1
196 1 28 ARG H 1 28 ARG HG3 . . 4.100 2.052 1.986 2.116 . 0 0 "[ . 1 .]" 1
197 1 28 ARG H 1 29 GLU H . . 3.800 2.943 2.793 3.133 . 0 0 "[ . 1 .]" 1
198 1 28 ARG HA 1 28 ARG HG3 . . 3.600 2.810 2.723 2.929 . 0 0 "[ . 1 .]" 1
199 1 28 ARG HA 1 29 GLU H . . 5.600 3.618 3.540 3.657 . 0 0 "[ . 1 .]" 1
200 1 28 ARG HA 1 31 VAL HB . . 5.600 3.169 2.836 3.280 . 0 0 "[ . 1 .]" 1
201 1 28 ARG HA 1 31 VAL MG1 . . 6.400 4.347 4.022 4.490 . 0 0 "[ . 1 .]" 1
202 1 28 ARG HB2 1 28 ARG HD2 . . 3.700 3.006 2.028 3.657 . 0 0 "[ . 1 .]" 1
203 1 28 ARG HB2 1 28 ARG HD3 . . 3.900 3.052 2.276 3.513 . 0 0 "[ . 1 .]" 1
204 1 28 ARG HB2 1 29 GLU H . . 5.600 2.294 2.216 2.367 . 0 0 "[ . 1 .]" 1
205 1 28 ARG HB2 1 30 ASP H . . 5.600 4.707 4.669 4.752 . 0 0 "[ . 1 .]" 1
206 1 28 ARG HB2 1 31 VAL HB . . 5.700 5.653 5.560 5.757 0.057 13 0 "[ . 1 .]" 1
207 1 28 ARG HB3 1 28 ARG HD3 . . 3.900 3.901 3.573 4.006 0.106 14 0 "[ . 1 .]" 1
208 1 28 ARG HB3 1 28 ARG HG3 . . 2.700 2.851 2.792 2.924 0.224 9 0 "[ . 1 .]" 1
209 1 28 ARG HB3 1 29 GLU H . . 5.600 3.645 3.519 3.750 . 0 0 "[ . 1 .]" 1
210 1 28 ARG HB3 1 31 VAL HB . . 5.100 4.761 4.596 5.035 . 0 0 "[ . 1 .]" 1
211 1 28 ARG HG3 1 29 GLU H . . 5.600 4.247 4.127 4.306 . 0 0 "[ . 1 .]" 1
212 1 28 ARG HG3 1 30 ASP H . . 5.600 5.758 5.705 5.830 0.230 6 0 "[ . 1 .]" 1
213 1 28 ARG O 1 32 ASP H . . 2.200 1.884 1.707 1.962 . 0 0 "[ . 1 .]" 1
214 1 28 ARG O 1 32 ASP N . . 3.200 2.873 2.702 2.937 . 0 0 "[ . 1 .]" 1
215 1 29 GLU H 1 30 ASP H . . 5.600 2.750 2.603 2.797 . 0 0 "[ . 1 .]" 1
216 1 29 GLU H 1 31 VAL H . . 5.600 4.287 4.214 4.338 . 0 0 "[ . 1 .]" 1
217 1 29 GLU HA 1 30 ASP H . . 5.600 3.519 3.500 3.541 . 0 0 "[ . 1 .]" 1
218 1 29 GLU HA 1 32 ASP H . . 3.900 3.641 3.557 3.749 . 0 0 "[ . 1 .]" 1
219 1 29 GLU QB 1 30 ASP H . . 6.600 2.824 2.699 3.447 . 0 0 "[ . 1 .]" 1
220 1 29 GLU QG 1 30 ASP H . . 6.600 4.252 2.107 4.608 . 0 0 "[ . 1 .]" 1
221 1 29 GLU O 1 33 TYR H . . 2.200 2.146 1.920 2.217 0.017 9 0 "[ . 1 .]" 1
222 1 29 GLU O 1 33 TYR N . . 3.200 3.090 2.840 3.162 . 0 0 "[ . 1 .]" 1
223 1 30 ASP H 1 31 VAL H . . 5.600 2.538 2.466 2.621 . 0 0 "[ . 1 .]" 1
224 1 30 ASP HA 1 33 TYR H . . 5.600 3.587 3.462 3.785 . 0 0 "[ . 1 .]" 1
225 1 30 ASP HB2 1 31 VAL H . . 3.800 2.863 2.544 3.828 0.028 15 0 "[ . 1 .]" 1
226 1 30 ASP HB2 1 106 THR MG . . 5.600 3.005 2.137 4.437 . 0 0 "[ . 1 .]" 1
227 1 30 ASP HB3 1 106 THR MG . . 5.800 2.341 1.924 3.292 . 0 0 "[ . 1 .]" 1
228 1 30 ASP O 1 34 ALA H . . 2.200 1.994 1.838 2.172 . 0 0 "[ . 1 .]" 1
229 1 30 ASP O 1 34 ALA N . . 3.200 2.950 2.766 3.088 . 0 0 "[ . 1 .]" 1
230 1 31 VAL H 1 31 VAL MG2 . . 3.900 2.078 1.958 2.656 . 0 0 "[ . 1 .]" 1
231 1 31 VAL H 1 32 ASP H . . 4.000 2.665 2.568 2.761 . 0 0 "[ . 1 .]" 1
232 1 31 VAL HA 1 32 ASP H . . 5.600 3.548 3.510 3.591 . 0 0 "[ . 1 .]" 1
233 1 31 VAL HB 1 32 ASP H . . 5.100 2.537 2.359 2.735 . 0 0 "[ . 1 .]" 1
234 1 31 VAL MG1 1 32 ASP H . . 3.900 3.758 3.044 3.953 0.053 1 0 "[ . 1 .]" 1
235 1 31 VAL MG1 1 64 PHE QD . . 7.900 4.904 3.646 6.631 . 0 0 "[ . 1 .]" 1
236 1 31 VAL MG1 1 64 PHE HZ . . 5.600 2.624 1.864 4.128 . 0 0 "[ . 1 .]" 1
237 1 31 VAL MG1 1 106 THR MG . . 5.200 4.877 4.311 5.216 0.016 10 0 "[ . 1 .]" 1
238 1 31 VAL MG1 1 113 LEU HG . . 4.800 2.548 1.845 4.437 . 0 0 "[ . 1 .]" 1
239 1 31 VAL MG2 1 32 ASP H . . 6.200 3.557 3.456 4.014 . 0 0 "[ . 1 .]" 1
240 1 31 VAL MG2 1 35 ILE MD . . 5.100 4.981 4.555 5.159 0.059 14 0 "[ . 1 .]" 1
241 1 31 VAL MG2 1 64 PHE QD . . 7.800 5.210 3.739 6.057 . 0 0 "[ . 1 .]" 1
242 1 31 VAL MG2 1 64 PHE QE . . 8.800 3.826 2.611 4.631 . 0 0 "[ . 1 .]" 1
243 1 31 VAL MG2 1 113 LEU MD1 . . 5.000 3.734 2.890 4.547 . 0 0 "[ . 1 .]" 1
244 1 31 VAL MG2 1 113 LEU MD2 . . 4.900 3.949 3.094 4.444 . 0 0 "[ . 1 .]" 1
245 1 31 VAL O 1 35 ILE H . . 2.200 1.980 1.778 2.125 . 0 0 "[ . 1 .]" 1
246 1 31 VAL O 1 35 ILE N . . 3.200 2.961 2.766 3.097 . 0 0 "[ . 1 .]" 1
247 1 32 ASP H 1 33 TYR H . . 5.600 2.681 2.587 2.773 . 0 0 "[ . 1 .]" 1
248 1 32 ASP HB3 1 33 TYR H . . 5.600 3.174 2.536 3.892 . 0 0 "[ . 1 .]" 1
249 1 32 ASP O 1 36 ARG H . . 2.200 1.982 1.741 2.142 . 0 0 "[ . 1 .]" 1
250 1 32 ASP O 1 36 ARG N . . 3.200 2.892 2.695 3.072 . 0 0 "[ . 1 .]" 1
251 1 33 TYR H 1 34 ALA H . . 5.600 2.674 2.615 2.767 . 0 0 "[ . 1 .]" 1
252 1 33 TYR HA 1 34 ALA H . . 5.600 3.547 3.516 3.573 . 0 0 "[ . 1 .]" 1
253 1 33 TYR HB2 1 34 ALA H . . 5.600 3.590 3.176 4.129 . 0 0 "[ . 1 .]" 1
254 1 33 TYR HB3 1 34 ALA H . . 5.600 2.726 2.485 3.015 . 0 0 "[ . 1 .]" 1
255 1 33 TYR QD 1 34 ALA H . . 6.300 3.940 2.383 4.602 . 0 0 "[ . 1 .]" 1
256 1 33 TYR QD 1 37 LYS QE . . 4.400 3.102 2.500 4.300 . 0 0 "[ . 1 .]" 1
257 1 33 TYR QD 1 37 LYS HG3 . . 6.900 6.268 5.777 6.878 . 0 0 "[ . 1 .]" 1
258 1 33 TYR QE 1 34 ALA H . . 7.800 6.004 4.319 6.647 . 0 0 "[ . 1 .]" 1
259 1 33 TYR QE 1 37 LYS QE . . 8.800 2.803 2.052 4.256 . 0 0 "[ . 1 .]" 1
260 1 33 TYR QE 1 37 LYS HG3 . . 6.900 6.146 4.960 6.901 0.001 10 0 "[ . 1 .]" 1
261 1 33 TYR O 1 37 LYS H . . 2.200 2.102 2.008 2.205 0.005 9 0 "[ . 1 .]" 1
262 1 33 TYR O 1 37 LYS N . . 3.200 3.053 2.982 3.121 . 0 0 "[ . 1 .]" 1
263 1 34 ALA H 1 113 LEU MD2 . . 6.400 5.992 3.277 6.471 0.071 13 0 "[ . 1 .]" 1
264 1 34 ALA HA 1 37 LYS H . . 4.000 3.654 3.586 3.771 . 0 0 "[ . 1 .]" 1
265 1 34 ALA HA 1 114 PHE HB2 . . 3.900 2.876 2.117 3.872 . 0 0 "[ . 1 .]" 1
266 1 34 ALA HA 1 114 PHE QD . . 7.800 2.729 2.163 3.170 . 0 0 "[ . 1 .]" 1
267 1 34 ALA MB 1 35 ILE H . . 5.600 2.503 2.320 2.670 . 0 0 "[ . 1 .]" 1
268 1 34 ALA MB 1 35 ILE MD . . 6.500 4.251 2.226 5.063 . 0 0 "[ . 1 .]" 1
269 1 34 ALA MB 1 113 LEU MD1 . . 7.800 1.926 1.689 2.851 . 0 0 "[ . 1 .]" 1
270 1 34 ALA MB 1 113 LEU MD2 . . 5.200 3.627 1.747 4.167 . 0 0 "[ . 1 .]" 1
271 1 34 ALA MB 1 113 LEU HG . . 3.900 3.386 2.073 3.903 0.003 13 0 "[ . 1 .]" 1
272 1 34 ALA MB 1 114 PHE HA . . 6.600 2.188 1.907 2.860 . 0 0 "[ . 1 .]" 1
273 1 34 ALA MB 1 114 PHE HB2 . . 6.400 2.305 1.997 3.168 . 0 0 "[ . 1 .]" 1
274 1 34 ALA MB 1 114 PHE QD . . 6.000 3.383 2.826 3.942 . 0 0 "[ . 1 .]" 1
275 1 34 ALA O 1 38 ALA H . . 2.300 2.164 2.074 2.260 . 0 0 "[ . 1 .]" 1
276 1 34 ALA O 1 38 ALA N . . 3.300 3.116 3.023 3.181 . 0 0 "[ . 1 .]" 1
277 1 35 ILE H 1 35 ILE MD . . 4.900 3.573 2.233 3.862 . 0 0 "[ . 1 .]" 1
278 1 35 ILE H 1 35 ILE HG12 . . 2.700 2.112 1.977 2.377 . 0 0 "[ . 1 .]" 1
279 1 35 ILE H 1 35 ILE HG13 . . 3.700 3.131 2.406 3.731 0.031 3 0 "[ . 1 .]" 1
280 1 35 ILE H 1 36 ARG H . . 5.600 2.623 2.531 2.744 . 0 0 "[ . 1 .]" 1
281 1 35 ILE H 1 113 LEU MD1 . . 6.600 3.144 2.573 4.336 . 0 0 "[ . 1 .]" 1
282 1 35 ILE HA 1 38 ALA H . . 5.000 3.469 3.360 3.588 . 0 0 "[ . 1 .]" 1
283 1 35 ILE HA 1 113 LEU MD2 . . 6.500 5.738 5.231 6.503 0.003 4 0 "[ . 1 .]" 1
284 1 35 ILE HA 1 117 ALA MB . . 6.000 2.506 2.015 2.938 . 0 0 "[ . 1 .]" 1
285 1 35 ILE HB 1 36 ARG H . . 4.500 3.111 2.511 3.859 . 0 0 "[ . 1 .]" 1
286 1 35 ILE MD 1 38 ALA MB . . 7.400 4.748 3.489 5.766 . 0 0 "[ . 1 .]" 1
287 1 35 ILE MD 1 62 VAL MG1 . . 6.400 4.059 2.825 6.399 . 0 0 "[ . 1 .]" 1
288 1 35 ILE MD 1 62 VAL MG2 . . 6.100 3.647 2.594 5.547 . 0 0 "[ . 1 .]" 1
289 1 35 ILE MD 1 113 LEU MD1 . . 6.100 3.117 1.718 4.119 . 0 0 "[ . 1 .]" 1
290 1 35 ILE MD 1 113 LEU HG . . 5.900 4.828 3.373 5.922 0.022 15 0 "[ . 1 .]" 1
291 1 35 ILE MD 1 117 ALA MB . . 5.600 3.229 1.864 5.121 . 0 0 "[ . 1 .]" 1
292 1 35 ILE QG 1 64 PHE QE . . 10.000 6.475 5.288 8.873 . 0 0 "[ . 1 .]" 1
293 1 35 ILE HG12 1 113 LEU MD1 . . 4.200 3.061 1.951 3.929 . 0 0 "[ . 1 .]" 1
294 1 35 ILE HG13 1 113 LEU MD1 . . 4.900 4.174 2.974 4.993 0.093 9 0 "[ . 1 .]" 1
295 1 35 ILE MG 1 36 ARG H . . 6.200 3.803 3.319 4.012 . 0 0 "[ . 1 .]" 1
296 1 35 ILE MG 1 38 ALA MB . . 5.300 3.670 3.185 4.293 . 0 0 "[ . 1 .]" 1
297 1 35 ILE MG 1 64 PHE QE . . 10.000 6.233 4.275 6.863 . 0 0 "[ . 1 .]" 1
298 1 35 ILE MG 1 64 PHE HZ . . 6.600 6.238 3.898 6.652 0.052 12 0 "[ . 1 .]" 1
299 1 35 ILE MG 1 117 ALA MB . . 5.300 2.778 2.059 3.531 . 0 0 "[ . 1 .]" 1
300 1 35 ILE MG 1 121 ILE MD . . 7.300 3.304 2.504 4.226 . 0 0 "[ . 1 .]" 1
301 1 35 ILE O 1 39 PHE H . . 2.200 2.050 1.978 2.131 . 0 0 "[ . 1 .]" 1
302 1 35 ILE O 1 39 PHE N . . 3.200 3.009 2.946 3.070 . 0 0 "[ . 1 .]" 1
303 1 36 ARG H 1 37 LYS H . . 3.500 2.706 2.651 2.781 . 0 0 "[ . 1 .]" 1
304 1 36 ARG HA 1 36 ARG HG2 . . 2.800 2.608 2.276 2.867 0.067 13 0 "[ . 1 .]" 1
305 1 36 ARG HA 1 36 ARG HG3 . . 2.800 2.574 2.251 2.776 . 0 0 "[ . 1 .]" 1
306 1 36 ARG HA 1 37 LYS H . . 4.000 3.536 3.512 3.568 . 0 0 "[ . 1 .]" 1
307 1 36 ARG HA 1 39 PHE H . . 4.600 3.573 3.481 3.640 . 0 0 "[ . 1 .]" 1
308 1 36 ARG HB2 1 37 LYS H . . 5.600 3.135 2.609 3.829 . 0 0 "[ . 1 .]" 1
309 1 36 ARG HB3 1 36 ARG HG3 . . 3.000 3.051 3.023 3.079 0.079 9 0 "[ . 1 .]" 1
310 1 36 ARG HB3 1 37 LYS H . . 5.600 2.868 2.389 3.290 . 0 0 "[ . 1 .]" 1
311 1 36 ARG O 1 40 GLN H . . 2.200 2.192 2.145 2.228 0.028 12 0 "[ . 1 .]" 1
312 1 36 ARG O 1 40 GLN N . . 3.200 3.100 3.058 3.156 . 0 0 "[ . 1 .]" 1
313 1 37 LYS H 1 38 ALA H . . 4.600 2.644 2.509 2.724 . 0 0 "[ . 1 .]" 1
314 1 37 LYS HA 1 37 LYS QE . . 5.300 3.396 2.232 4.158 . 0 0 "[ . 1 .]" 1
315 1 37 LYS HA 1 37 LYS HG3 . . 2.700 2.692 2.588 2.756 0.056 8 0 "[ . 1 .]" 1
316 1 37 LYS HA 1 38 ALA H . . 5.600 3.564 3.539 3.584 . 0 0 "[ . 1 .]" 1
317 1 37 LYS HA 1 40 GLN H . . 5.600 3.460 3.368 3.559 . 0 0 "[ . 1 .]" 1
318 1 37 LYS HA 1 40 GLN QB . . 6.600 2.843 2.654 3.356 . 0 0 "[ . 1 .]" 1
319 1 37 LYS QB 1 38 ALA H . . 6.600 2.614 2.453 2.765 . 0 0 "[ . 1 .]" 1
320 1 37 LYS HD2 1 37 LYS HG3 . . 2.700 2.438 2.301 2.601 . 0 0 "[ . 1 .]" 1
321 1 37 LYS HD3 1 37 LYS HG3 . . 2.700 2.525 2.353 2.790 0.090 14 0 "[ . 1 .]" 1
322 1 37 LYS HD3 1 40 GLN HG3 . . 5.600 5.383 4.879 5.650 0.050 3 0 "[ . 1 .]" 1
323 1 37 LYS QE 1 37 LYS HG3 . . 3.900 3.389 3.268 3.500 . 0 0 "[ . 1 .]" 1
324 1 37 LYS O 1 41 VAL H . . 2.200 2.171 2.021 2.228 0.028 9 0 "[ . 1 .]" 1
325 1 37 LYS O 1 41 VAL N . . 3.200 3.085 2.961 3.145 . 0 0 "[ . 1 .]" 1
326 1 38 ALA H 1 39 PHE H . . 4.100 2.683 2.598 2.765 . 0 0 "[ . 1 .]" 1
327 1 38 ALA HA 1 41 VAL H . . 5.100 3.469 3.398 3.539 . 0 0 "[ . 1 .]" 1
328 1 38 ALA HA 1 118 VAL MG2 . . 4.900 2.424 2.047 2.983 . 0 0 "[ . 1 .]" 1
329 1 38 ALA MB 1 39 PHE H . . 5.800 2.530 2.426 2.637 . 0 0 "[ . 1 .]" 1
330 1 38 ALA MB 1 114 PHE HA . . 6.600 3.700 2.970 4.285 . 0 0 "[ . 1 .]" 1
331 1 38 ALA MB 1 118 VAL MG1 . . 5.600 3.287 2.211 3.976 . 0 0 "[ . 1 .]" 1
332 1 38 ALA MB 1 118 VAL MG2 . . 6.300 1.939 1.745 2.428 . 0 0 "[ . 1 .]" 1
333 1 38 ALA MB 1 121 ILE MD . . 6.400 2.522 1.693 4.283 . 0 0 "[ . 1 .]" 1
334 1 38 ALA O 1 42 TRP H . . 2.200 2.084 1.991 2.128 . 0 0 "[ . 1 .]" 1
335 1 38 ALA O 1 42 TRP N . . 3.200 3.009 2.943 3.042 . 0 0 "[ . 1 .]" 1
336 1 39 PHE H 1 39 PHE HD1 . . 4.600 4.233 3.785 4.589 . 0 0 "[ . 1 .]" 1
337 1 39 PHE H 1 39 PHE HD2 . . 3.900 3.546 3.270 3.748 . 0 0 "[ . 1 .]" 1
338 1 39 PHE H 1 40 GLN H . . 4.800 2.658 2.590 2.729 . 0 0 "[ . 1 .]" 1
339 1 39 PHE QB 1 40 GLN H . . 5.000 2.704 2.583 2.800 . 0 0 "[ . 1 .]" 1
340 1 39 PHE QB 1 41 VAL H . . 6.600 4.725 4.554 4.856 . 0 0 "[ . 1 .]" 1
341 1 39 PHE QE 1 60 ILE MD . . 5.700 3.440 2.620 4.787 . 0 0 "[ . 1 .]" 1
342 1 39 PHE QE 1 60 ILE MG . . 5.900 4.755 3.387 5.794 . 0 0 "[ . 1 .]" 1
343 1 39 PHE QE 1 121 ILE MD . . 4.600 2.918 2.029 3.719 . 0 0 "[ . 1 .]" 1
344 1 39 PHE QE 1 121 ILE MG . . 5.200 2.781 1.951 3.428 . 0 0 "[ . 1 .]" 1
345 1 39 PHE HZ 1 60 ILE MD . . 6.000 3.691 2.479 4.835 . 0 0 "[ . 1 .]" 1
346 1 39 PHE HZ 1 60 ILE MG . . 6.600 4.641 3.768 6.174 . 0 0 "[ . 1 .]" 1
347 1 39 PHE O 1 43 SER H . . 2.200 1.746 1.700 1.818 . 0 0 "[ . 1 .]" 1
348 1 39 PHE O 1 43 SER N . . 3.200 2.656 2.607 2.742 . 0 0 "[ . 1 .]" 1
349 1 40 GLN H 1 40 GLN HG3 . . 4.200 4.277 4.210 4.322 0.122 13 0 "[ . 1 .]" 1
350 1 40 GLN H 1 41 VAL H . . 4.000 2.599 2.568 2.624 . 0 0 "[ . 1 .]" 1
351 1 40 GLN H 1 41 VAL HB . . 5.600 4.871 4.474 5.198 . 0 0 "[ . 1 .]" 1
352 1 40 GLN H 1 41 VAL MG1 . . 6.300 4.750 3.626 5.953 . 0 0 "[ . 1 .]" 1
353 1 40 GLN HA 1 40 GLN HG2 . . 3.600 3.532 2.989 3.829 0.229 14 0 "[ . 1 .]" 1
354 1 40 GLN HA 1 43 SER H . . 5.600 3.435 3.360 3.486 . 0 0 "[ . 1 .]" 1
355 1 40 GLN QB 1 41 VAL H . . 6.600 3.034 2.554 3.451 . 0 0 "[ . 1 .]" 1
356 1 40 GLN HE21 1 41 VAL HA . . 5.600 4.923 3.969 5.681 0.081 1 0 "[ . 1 .]" 1
357 1 40 GLN HG2 1 44 ASN HD21 . . 5.600 5.142 4.782 5.702 0.102 7 0 "[ . 1 .]" 1
358 1 40 GLN HG3 1 44 ASN HD21 . . 5.600 4.940 4.252 5.643 0.043 12 0 "[ . 1 .]" 1
359 1 40 GLN O 1 44 ASN H . . 2.200 1.750 1.700 1.851 . 0 0 "[ . 1 .]" 1
360 1 40 GLN O 1 44 ASN N . . 3.200 2.705 2.662 2.836 . 0 0 "[ . 1 .]" 1
361 1 41 VAL H 1 41 VAL MG2 . . 4.600 3.287 2.081 3.817 . 0 0 "[ . 1 .]" 1
362 1 41 VAL H 1 42 TRP H . . 5.600 2.523 2.464 2.579 . 0 0 "[ . 1 .]" 1
363 1 41 VAL H 1 43 SER H . . 5.600 3.936 3.892 3.980 . 0 0 "[ . 1 .]" 1
364 1 41 VAL HA 1 42 TRP H . . 4.100 3.535 3.520 3.560 . 0 0 "[ . 1 .]" 1
365 1 41 VAL HB 1 42 TRP H . . 5.600 3.480 2.700 4.087 . 0 0 "[ . 1 .]" 1
366 1 41 VAL HB 1 118 VAL MG2 . . 6.600 4.252 3.426 5.053 . 0 0 "[ . 1 .]" 1
367 1 41 VAL MG1 1 42 TRP H . . 5.200 2.614 2.121 3.975 . 0 0 "[ . 1 .]" 1
368 1 41 VAL MG1 1 42 TRP HE3 . . 5.600 4.499 3.691 5.026 . 0 0 "[ . 1 .]" 1
369 1 41 VAL MG1 1 114 PHE QE . . 5.600 4.143 3.048 4.882 . 0 0 "[ . 1 .]" 1
370 1 41 VAL MG1 1 114 PHE HZ . . 5.900 3.751 2.476 4.453 . 0 0 "[ . 1 .]" 1
371 1 41 VAL MG1 1 118 VAL MG1 . . 6.100 2.980 2.101 4.125 . 0 0 "[ . 1 .]" 1
372 1 41 VAL MG1 1 118 VAL MG2 . . 5.800 3.171 2.182 4.375 . 0 0 "[ . 1 .]" 1
373 1 41 VAL MG1 1 149 PHE QD . . 8.000 4.495 3.679 5.472 . 0 0 "[ . 1 .]" 1
374 1 41 VAL MG1 1 149 PHE QE . . 7.900 2.990 1.992 3.631 . 0 0 "[ . 1 .]" 1
375 1 41 VAL MG1 1 149 PHE HZ . . 5.200 3.803 2.199 5.197 . 0 0 "[ . 1 .]" 1
376 1 41 VAL MG1 1 151 LEU MD1 . . 6.900 2.994 1.705 3.613 . 0 0 "[ . 1 .]" 1
377 1 41 VAL MG2 1 42 TRP H . . 5.200 3.908 3.549 4.267 . 0 0 "[ . 1 .]" 1
378 1 41 VAL MG2 1 118 VAL MG1 . . 4.400 4.011 3.514 4.421 0.021 7 0 "[ . 1 .]" 1
379 1 41 VAL MG2 1 118 VAL MG2 . . 4.900 3.997 3.036 4.826 . 0 0 "[ . 1 .]" 1
380 1 41 VAL MG2 1 149 PHE QD . . 6.700 4.218 3.015 5.365 . 0 0 "[ . 1 .]" 1
381 1 41 VAL MG2 1 149 PHE QE . . 7.900 3.191 2.195 3.782 . 0 0 "[ . 1 .]" 1
382 1 41 VAL MG2 1 149 PHE HZ . . 5.700 4.353 2.076 5.739 0.039 4 0 "[ . 1 .]" 1
383 1 41 VAL MG2 1 151 LEU MD1 . . 5.900 2.305 1.789 3.874 . 0 0 "[ . 1 .]" 1
384 1 41 VAL MG2 1 151 LEU MD2 . . 6.700 3.107 1.749 4.992 . 0 0 "[ . 1 .]" 1
385 1 42 TRP H 1 43 SER H . . 5.600 2.418 2.386 2.514 . 0 0 "[ . 1 .]" 1
386 1 42 TRP H 1 43 SER HB2 . . 5.600 4.576 4.405 4.689 . 0 0 "[ . 1 .]" 1
387 1 42 TRP H 1 44 ASN HB3 . . 5.600 5.806 5.712 6.019 0.419 13 0 "[ . 1 .]" 1
388 1 42 TRP H 1 118 VAL MG2 . . 6.300 5.307 4.336 5.897 . 0 0 "[ . 1 .]" 1
389 1 42 TRP HA 1 45 VAL H . . 5.600 3.825 3.721 3.880 . 0 0 "[ . 1 .]" 1
390 1 42 TRP HB2 1 43 SER H . . 5.600 2.889 2.759 3.065 . 0 0 "[ . 1 .]" 1
391 1 42 TRP HB3 1 43 SER H . . 5.200 3.533 3.346 3.684 . 0 0 "[ . 1 .]" 1
392 1 42 TRP HE1 1 118 VAL HA . . 5.600 2.589 1.984 3.617 . 0 0 "[ . 1 .]" 1
393 1 42 TRP HE1 1 118 VAL MG1 . . 5.300 2.237 1.940 2.749 . 0 0 "[ . 1 .]" 1
394 1 42 TRP HE1 1 118 VAL O . . 2.000 1.901 1.762 2.033 0.033 8 0 "[ . 1 .]" 1
395 1 42 TRP HE1 1 121 ILE HB . . 5.600 3.113 2.007 4.997 . 0 0 "[ . 1 .]" 1
396 1 42 TRP HE1 1 125 LEU MD2 . . 5.200 4.675 3.382 5.212 0.012 8 0 "[ . 1 .]" 1
397 1 42 TRP HE3 1 48 LEU HG . . 8.800 7.219 6.100 8.847 0.047 8 0 "[ . 1 .]" 1
398 1 42 TRP HE3 1 125 LEU MD1 . . 5.600 2.614 2.171 3.551 . 0 0 "[ . 1 .]" 1
399 1 42 TRP NE1 1 118 VAL O . . 3.200 2.819 2.554 3.061 . 0 0 "[ . 1 .]" 1
400 1 43 SER H 1 44 ASN H . . 5.600 2.604 2.549 2.705 . 0 0 "[ . 1 .]" 1
401 1 43 SER H 1 44 ASN HD22 . . 4.600 4.760 4.687 4.946 0.346 13 0 "[ . 1 .]" 1
402 1 43 SER HA 1 44 ASN H . . 3.900 3.628 3.602 3.655 . 0 0 "[ . 1 .]" 1
403 1 43 SER HA 1 45 VAL H . . 5.600 3.635 3.599 3.736 . 0 0 "[ . 1 .]" 1
404 1 43 SER HA 1 46 THR H . . 5.600 3.115 2.932 3.355 . 0 0 "[ . 1 .]" 1
405 1 43 SER HA 1 48 LEU H . . 5.300 4.364 3.014 5.287 . 0 0 "[ . 1 .]" 1
406 1 43 SER HB2 1 44 ASN H . . 3.400 2.639 2.438 3.450 0.050 1 0 "[ . 1 .]" 1
407 1 44 ASN H 1 44 ASN HB2 . . 3.700 3.608 3.586 3.637 . 0 0 "[ . 1 .]" 1
408 1 44 ASN H 1 44 ASN HB3 . . 3.900 2.338 2.244 2.425 . 0 0 "[ . 1 .]" 1
409 1 44 ASN H 1 45 VAL H . . 4.400 2.784 2.744 2.845 . 0 0 "[ . 1 .]" 1
410 1 44 ASN H 1 46 THR H . . 5.600 4.140 4.042 4.271 . 0 0 "[ . 1 .]" 1
411 1 44 ASN HB2 1 45 VAL H . . 5.600 4.439 4.406 4.476 . 0 0 "[ . 1 .]" 1
412 1 44 ASN HB2 1 45 VAL MG1 . . 3.900 4.003 3.945 4.100 0.200 14 0 "[ . 1 .]" 1
413 1 44 ASN HB3 1 45 VAL H . . 5.600 4.192 4.102 4.264 . 0 0 "[ . 1 .]" 1
414 1 45 VAL H 1 45 VAL HB . . 4.000 3.762 3.744 3.773 . 0 0 "[ . 1 .]" 1
415 1 45 VAL H 1 46 THR H . . 5.600 2.115 1.977 2.260 . 0 0 "[ . 1 .]" 1
416 1 45 VAL HA 1 46 THR H . . 5.600 3.315 3.206 3.417 . 0 0 "[ . 1 .]" 1
417 1 45 VAL MG1 1 46 THR H . . 4.900 4.244 4.168 4.361 . 0 0 "[ . 1 .]" 1
418 1 45 VAL MG1 1 151 LEU MD2 . . 5.200 3.213 2.267 3.761 . 0 0 "[ . 1 .]" 1
419 1 45 VAL MG1 1 156 ILE HG13 . . 4.000 3.971 3.868 4.042 0.042 4 0 "[ . 1 .]" 1
420 1 45 VAL MG2 1 46 THR H . . 6.000 3.055 2.776 3.335 . 0 0 "[ . 1 .]" 1
421 1 45 VAL MG2 1 46 THR MG . . 6.100 2.852 1.851 3.764 . 0 0 "[ . 1 .]" 1
422 1 45 VAL MG2 1 156 ILE MD . . 6.300 3.861 3.123 4.543 . 0 0 "[ . 1 .]" 1
423 1 45 VAL MG2 1 156 ILE MG . . 4.400 2.457 1.956 2.854 . 0 0 "[ . 1 .]" 1
424 1 45 VAL MG2 1 159 ILE MD . . 4.900 2.231 1.776 2.665 . 0 0 "[ . 1 .]" 1
425 1 45 VAL MG2 1 159 ILE MG . . 4.600 4.338 3.880 4.632 0.032 14 0 "[ . 1 .]" 1
426 1 46 THR H 1 125 LEU MD2 . . 7.100 6.582 5.275 7.118 0.018 12 0 "[ . 1 .]" 1
427 1 46 THR HA 1 48 LEU HG . . 5.600 4.577 4.225 5.265 . 0 0 "[ . 1 .]" 1
428 1 46 THR HB 1 48 LEU H . . 5.300 3.368 2.451 4.813 . 0 0 "[ . 1 .]" 1
429 1 46 THR MG 1 125 LEU MD2 . . 6.500 3.725 2.491 4.868 . 0 0 "[ . 1 .]" 1
430 1 46 THR MG 1 159 ILE MD . . 3.900 2.791 1.838 3.589 . 0 0 "[ . 1 .]" 1
431 1 46 THR MG 1 159 ILE HG13 . . 5.000 3.086 2.141 4.792 . 0 0 "[ . 1 .]" 1
432 1 46 THR MG 1 159 ILE MG . . 5.600 4.841 4.128 5.629 0.029 2 0 "[ . 1 .]" 1
433 1 46 THR MG 1 163 TYR QE . . 5.100 3.173 1.912 4.525 . 0 0 "[ . 1 .]" 1
434 1 47 PRO HA 1 48 LEU H . . 5.600 3.157 2.531 3.527 . 0 0 "[ . 1 .]" 1
435 1 47 PRO HG2 1 48 LEU H . . 4.900 3.499 2.178 4.958 0.058 9 0 "[ . 1 .]" 1
436 1 48 LEU H 1 48 LEU QD . . 4.900 2.689 2.069 3.324 . 0 0 "[ . 1 .]" 1
437 1 48 LEU H 1 48 LEU HG . . 3.700 2.205 1.947 2.635 . 0 0 "[ . 1 .]" 1
438 1 48 LEU H 1 49 LYS H . . 5.600 4.229 3.723 4.511 . 0 0 "[ . 1 .]" 1
439 1 48 LEU H 1 125 LEU MD2 . . 6.600 5.920 4.760 6.614 0.014 15 0 "[ . 1 .]" 1
440 1 48 LEU HA 1 49 LYS H . . 4.200 2.165 2.124 2.281 . 0 0 "[ . 1 .]" 1
441 1 48 LEU QD 1 49 LYS H . . 6.400 4.271 3.977 4.662 . 0 0 "[ . 1 .]" 1
442 1 48 LEU QD 1 50 PHE QE . . 6.500 3.476 1.979 4.534 . 0 0 "[ . 1 .]" 1
443 1 48 LEU QD 1 125 LEU MD2 . . 4.900 3.275 1.997 4.746 . 0 0 "[ . 1 .]" 1
444 1 48 LEU QD 1 159 ILE MG . . 7.500 5.951 5.387 6.582 . 0 0 "[ . 1 .]" 1
445 1 48 LEU QD 1 163 TYR HD1 . . 3.400 2.984 2.117 3.796 0.396 7 0 "[ . 1 .]" 1
446 1 48 LEU QD 1 163 TYR HD2 . . 5.600 4.226 3.108 5.122 . 0 0 "[ . 1 .]" 1
447 1 48 LEU QD 1 163 TYR QE . . 5.200 2.784 2.025 3.639 . 0 0 "[ . 1 .]" 1
448 1 49 LYS H 1 49 LYS HB2 . . 3.100 2.233 2.186 2.351 . 0 0 "[ . 1 .]" 1
449 1 49 LYS H 1 49 LYS HD3 . . 2.700 2.847 2.742 3.077 0.377 13 0 "[ . 1 .]" 1
450 1 49 LYS HA 1 49 LYS HD2 . . 2.700 2.148 2.082 2.255 . 0 0 "[ . 1 .]" 1
451 1 49 LYS HA 1 49 LYS HD3 . . 3.700 3.269 3.218 3.374 . 0 0 "[ . 1 .]" 1
452 1 49 LYS HA 1 49 LYS HG3 . . 3.000 2.687 2.666 2.707 . 0 0 "[ . 1 .]" 1
453 1 49 LYS HA 1 50 PHE H . . 5.000 2.295 2.250 2.321 . 0 0 "[ . 1 .]" 1
454 1 49 LYS HB3 1 49 LYS HD2 . . 3.600 3.751 3.701 3.786 0.186 6 0 "[ . 1 .]" 1
455 1 49 LYS HB3 1 50 PHE H . . 5.300 2.766 2.734 2.809 . 0 0 "[ . 1 .]" 1
456 1 49 LYS HD3 1 49 LYS HG2 . . 2.700 2.540 2.487 2.592 . 0 0 "[ . 1 .]" 1
457 1 49 LYS HD3 1 50 PHE H . . 5.600 5.243 5.212 5.305 . 0 0 "[ . 1 .]" 1
458 1 49 LYS HE2 1 49 LYS HG2 . . 3.400 2.751 2.395 3.274 . 0 0 "[ . 1 .]" 1
459 1 49 LYS HG2 1 50 PHE H . . 4.600 4.631 4.609 4.652 0.052 8 0 "[ . 1 .]" 1
460 1 50 PHE HA 1 51 SER H . . 5.600 2.242 2.145 2.331 . 0 0 "[ . 1 .]" 1
461 1 50 PHE HB2 1 51 SER H . . 5.600 3.846 3.526 4.467 . 0 0 "[ . 1 .]" 1
462 1 50 PHE QD 1 51 SER H . . 7.800 4.099 2.886 4.786 . 0 0 "[ . 1 .]" 1
463 1 51 SER HA 1 52 LYS H . . 5.600 2.160 2.136 2.216 . 0 0 "[ . 1 .]" 1
464 1 51 SER HB2 1 52 LYS H . . 4.200 4.077 3.838 4.235 0.035 2 0 "[ . 1 .]" 1
465 1 51 SER HB2 1 53 ILE MG . . 4.400 3.949 3.441 4.419 0.019 13 0 "[ . 1 .]" 1
466 1 51 SER HB3 1 52 LYS H . . 5.600 3.383 2.849 3.788 . 0 0 "[ . 1 .]" 1
467 1 51 SER HB3 1 53 ILE MG . . 4.800 4.140 3.665 4.632 . 0 0 "[ . 1 .]" 1
468 1 52 LYS H 1 52 LYS HG2 . . 5.300 3.873 3.510 4.294 . 0 0 "[ . 1 .]" 1
469 1 52 LYS H 1 52 LYS HG3 . . 4.400 4.192 2.036 4.556 0.156 12 0 "[ . 1 .]" 1
470 1 52 LYS HA 1 52 LYS HG2 . . 3.600 3.550 3.072 3.668 0.068 8 0 "[ . 1 .]" 1
471 1 52 LYS HA 1 53 ILE H . . 5.600 2.203 2.141 2.251 . 0 0 "[ . 1 .]" 1
472 1 52 LYS HA 1 53 ILE HG13 . . 5.600 4.342 4.085 4.768 . 0 0 "[ . 1 .]" 1
473 1 52 LYS HB2 1 53 ILE H . . 3.800 3.773 3.462 3.898 0.098 6 0 "[ . 1 .]" 1
474 1 52 LYS HB3 1 52 LYS QE . . 3.900 3.656 2.802 3.972 0.072 14 0 "[ . 1 .]" 1
475 1 52 LYS HB3 1 52 LYS HG2 . . 3.100 2.444 2.294 3.094 . 0 0 "[ . 1 .]" 1
476 1 52 LYS HB3 1 53 ILE HG13 . . 6.700 6.465 5.141 6.775 0.075 9 0 "[ . 1 .]" 1
477 1 52 LYS QE 1 52 LYS HG2 . . 3.900 2.561 2.140 3.335 . 0 0 "[ . 1 .]" 1
478 1 52 LYS QE 1 52 LYS HG3 . . 3.900 2.883 2.095 3.441 . 0 0 "[ . 1 .]" 1
479 1 52 LYS HG2 1 53 ILE H . . 4.700 3.763 2.904 4.727 0.027 13 0 "[ . 1 .]" 1
480 1 53 ILE H 1 53 ILE MD . . 5.000 3.849 3.637 4.000 . 0 0 "[ . 1 .]" 1
481 1 53 ILE H 1 53 ILE HG12 . . 2.700 2.472 2.206 2.640 . 0 0 "[ . 1 .]" 1
482 1 53 ILE H 1 53 ILE HG13 . . 3.400 2.369 2.095 2.708 . 0 0 "[ . 1 .]" 1
483 1 53 ILE H 1 53 ILE MG . . 4.000 3.149 2.871 3.710 . 0 0 "[ . 1 .]" 1
484 1 53 ILE HB 1 53 ILE HG12 . . 3.000 3.041 3.009 3.069 0.069 12 0 "[ . 1 .]" 1
485 1 53 ILE HB 1 55 THR H . . 5.600 3.123 2.205 5.086 . 0 0 "[ . 1 .]" 1
486 1 53 ILE MD 1 58 ALA HA . . 6.100 3.025 1.968 5.246 . 0 0 "[ . 1 .]" 1
487 1 53 ILE MD 1 58 ALA MB . . 6.400 2.480 2.004 3.293 . 0 0 "[ . 1 .]" 1
488 1 53 ILE HG13 1 58 ALA MB . . 4.700 2.567 1.980 3.014 . 0 0 "[ . 1 .]" 1
489 1 54 ASN HA 1 55 THR H . . 5.600 3.068 2.193 3.657 . 0 0 "[ . 1 .]" 1
490 1 54 ASN HB2 1 55 THR H . . 5.600 4.044 2.872 4.773 . 0 0 "[ . 1 .]" 1
491 1 54 ASN HB3 1 55 THR H . . 5.600 3.893 2.357 4.681 . 0 0 "[ . 1 .]" 1
492 1 54 ASN HB3 1 55 THR MG . . 6.600 4.772 2.319 6.582 . 0 0 "[ . 1 .]" 1
493 1 55 THR HA 1 56 GLY H . . 4.100 2.902 2.148 3.687 . 0 0 "[ . 1 .]" 1
494 1 55 THR MG 1 56 GLY H . . 3.900 3.314 2.066 3.962 0.062 1 0 "[ . 1 .]" 1
495 1 56 GLY HA2 1 57 MET H . . 5.000 2.866 2.241 3.669 . 0 0 "[ . 1 .]" 1
496 1 57 MET H 1 57 MET HB3 . . 4.000 3.296 2.693 4.051 0.051 15 0 "[ . 1 .]" 1
497 1 57 MET H 1 58 ALA MB . . 6.400 5.003 3.940 5.574 . 0 0 "[ . 1 .]" 1
498 1 57 MET HA 1 58 ALA H . . 5.600 2.239 2.168 2.391 . 0 0 "[ . 1 .]" 1
499 1 57 MET HB3 1 57 MET HG2 . . 2.700 2.440 2.241 2.802 0.102 10 0 "[ . 1 .]" 1
500 1 57 MET HB3 1 58 ALA H . . 5.600 3.861 2.857 4.340 . 0 0 "[ . 1 .]" 1
501 1 57 MET HG2 1 61 LEU MD1 . . 5.200 4.302 3.187 5.185 . 0 0 "[ . 1 .]" 1
502 1 57 MET HG3 1 61 LEU MD2 . . 4.200 3.757 2.801 4.178 . 0 0 "[ . 1 .]" 1
503 1 58 ALA MB 1 59 ASP H . . 4.900 2.562 2.365 3.101 . 0 0 "[ . 1 .]" 1
504 1 58 ALA MB 1 60 ILE H . . 6.600 3.125 2.777 3.888 . 0 0 "[ . 1 .]" 1
505 1 59 ASP H 1 60 ILE H . . 4.200 3.087 2.664 3.370 . 0 0 "[ . 1 .]" 1
506 1 59 ASP HA 1 60 ILE H . . 5.600 3.625 3.578 3.673 . 0 0 "[ . 1 .]" 1
507 1 59 ASP HB2 1 60 ILE H . . 5.600 2.529 2.016 3.951 . 0 0 "[ . 1 .]" 1
508 1 59 ASP HB3 1 60 ILE H . . 5.600 3.260 2.086 3.872 . 0 0 "[ . 1 .]" 1
509 1 60 ILE H 1 60 ILE HG13 . . 2.700 2.420 1.957 2.865 0.165 6 0 "[ . 1 .]" 1
510 1 60 ILE HA 1 61 LEU H . . 5.600 2.157 2.142 2.181 . 0 0 "[ . 1 .]" 1
511 1 60 ILE MD 1 61 LEU H . . 6.700 5.088 3.732 5.527 . 0 0 "[ . 1 .]" 1
512 1 60 ILE MD 1 62 VAL MG1 . . 6.900 5.906 4.023 6.960 0.060 1 0 "[ . 1 .]" 1
513 1 61 LEU H 1 61 LEU MD2 . . 3.900 3.956 3.894 4.054 0.154 1 0 "[ . 1 .]" 1
514 1 61 LEU H 1 62 VAL H . . 5.600 4.438 4.317 4.558 . 0 0 "[ . 1 .]" 1
515 1 61 LEU H 1 94 GLY HA2 . . 5.600 5.221 4.465 5.635 0.035 7 0 "[ . 1 .]" 1
516 1 61 LEU H 1 95 ASP HA . . 3.700 2.091 1.900 2.406 . 0 0 "[ . 1 .]" 1
517 1 61 LEU H 1 95 ASP HB3 . . 4.300 3.909 2.987 4.334 0.034 6 0 "[ . 1 .]" 1
518 1 61 LEU H 1 96 ALA H . . 4.300 3.659 3.164 4.132 . 0 0 "[ . 1 .]" 1
519 1 61 LEU HA 1 62 VAL H . . 5.600 2.168 2.119 2.210 . 0 0 "[ . 1 .]" 1
520 1 61 LEU HA 1 96 ALA H . . 5.800 4.941 4.673 5.220 . 0 0 "[ . 1 .]" 1
521 1 61 LEU HB3 1 61 LEU HG . . 2.800 2.654 2.332 2.902 0.102 14 0 "[ . 1 .]" 1
522 1 61 LEU MD2 1 92 ILE MG . . 8.300 6.353 5.320 7.492 . 0 0 "[ . 1 .]" 1
523 1 61 LEU HG 1 62 VAL H . . 3.700 3.271 2.656 3.826 0.126 10 0 "[ . 1 .]" 1
524 1 61 LEU O 1 96 ALA H . . 2.200 1.915 1.736 2.179 . 0 0 "[ . 1 .]" 1
525 1 61 LEU O 1 96 ALA N . . 3.200 2.790 2.528 2.951 . 0 0 "[ . 1 .]" 1
526 1 62 VAL H 1 62 VAL MG1 . . 4.400 3.625 3.085 3.868 . 0 0 "[ . 1 .]" 1
527 1 62 VAL HA 1 63 VAL H . . 5.600 2.137 2.096 2.201 . 0 0 "[ . 1 .]" 1
528 1 62 VAL HA 1 96 ALA H . . 5.600 2.983 2.615 3.347 . 0 0 "[ . 1 .]" 1
529 1 62 VAL MG1 1 63 VAL H . . 5.300 3.025 2.634 3.781 . 0 0 "[ . 1 .]" 1
530 1 62 VAL MG1 1 97 HIS HA . . 4.600 4.271 3.452 4.679 0.079 1 0 "[ . 1 .]" 1
531 1 62 VAL MG1 1 98 PHE QD . . 8.300 3.284 2.380 4.200 . 0 0 "[ . 1 .]" 1
532 1 62 VAL MG1 1 98 PHE QE . . 8.600 2.307 1.880 5.251 . 0 0 "[ . 1 .]" 1
533 1 62 VAL MG2 1 63 VAL H . . 5.800 4.113 3.382 4.486 . 0 0 "[ . 1 .]" 1
534 1 62 VAL MG2 1 98 PHE QD . . 8.300 4.997 3.985 5.868 . 0 0 "[ . 1 .]" 1
535 1 62 VAL MG2 1 98 PHE QE . . 8.400 3.600 2.211 6.779 . 0 0 "[ . 1 .]" 1
536 1 63 VAL H 1 96 ALA O . . 2.300 2.086 1.991 2.205 . 0 0 "[ . 1 .]" 1
537 1 63 VAL H 1 97 HIS HA . . 5.600 2.783 2.278 3.389 . 0 0 "[ . 1 .]" 1
538 1 63 VAL H 1 98 PHE H . . 5.600 4.096 3.748 4.446 . 0 0 "[ . 1 .]" 1
539 1 63 VAL HA 1 64 PHE H . . 5.600 2.244 2.168 2.313 . 0 0 "[ . 1 .]" 1
540 1 63 VAL MG1 1 64 PHE H . . 6.100 3.030 2.020 4.450 . 0 0 "[ . 1 .]" 1
541 1 63 VAL MG2 1 64 PHE H . . 4.500 3.704 2.479 4.340 . 0 0 "[ . 1 .]" 1
542 1 63 VAL N 1 96 ALA O . . 3.200 3.063 2.991 3.201 0.001 3 0 "[ . 1 .]" 1
543 1 63 VAL O 1 98 PHE H . . 2.300 2.237 2.020 2.314 0.014 10 0 "[ . 1 .]" 1
544 1 63 VAL O 1 98 PHE N . . 3.300 3.138 2.972 3.193 . 0 0 "[ . 1 .]" 1
545 1 64 PHE H 1 64 PHE HB3 . . 3.700 3.661 3.607 3.719 0.019 12 0 "[ . 1 .]" 1
546 1 64 PHE H 1 64 PHE QD . . 4.900 2.523 1.963 3.138 . 0 0 "[ . 1 .]" 1
547 1 64 PHE HA 1 65 ALA H . . 5.600 2.203 2.174 2.233 . 0 0 "[ . 1 .]" 1
548 1 64 PHE HA 1 65 ALA MB . . 5.300 3.985 3.917 4.058 . 0 0 "[ . 1 .]" 1
549 1 64 PHE HA 1 98 PHE H . . 5.600 2.368 1.996 2.615 . 0 0 "[ . 1 .]" 1
550 1 64 PHE HB2 1 65 ALA H . . 5.100 4.212 4.029 4.432 . 0 0 "[ . 1 .]" 1
551 1 64 PHE HB3 1 65 ALA H . . 5.600 3.503 3.374 3.610 . 0 0 "[ . 1 .]" 1
552 1 64 PHE QE 1 98 PHE QB . . 5.600 3.830 2.989 5.031 . 0 0 "[ . 1 .]" 1
553 1 64 PHE QE 1 113 LEU MD1 . . 8.800 4.521 3.235 5.927 . 0 0 "[ . 1 .]" 1
554 1 64 PHE HZ 1 98 PHE QB . . 7.800 5.544 3.658 7.103 . 0 0 "[ . 1 .]" 1
555 1 65 ALA H 1 98 PHE H . . 3.600 3.086 2.524 3.566 . 0 0 "[ . 1 .]" 1
556 1 65 ALA H 1 98 PHE O . . 2.200 1.883 1.731 2.045 . 0 0 "[ . 1 .]" 1
557 1 65 ALA H 1 100 GLU H . . 5.600 2.742 2.354 3.127 . 0 0 "[ . 1 .]" 1
558 1 65 ALA HA 1 66 ARG H . . 5.600 2.503 2.471 2.540 . 0 0 "[ . 1 .]" 1
559 1 65 ALA MB 1 66 ARG H . . 4.900 2.339 2.216 2.463 . 0 0 "[ . 1 .]" 1
560 1 65 ALA N 1 98 PHE O . . 3.200 2.849 2.666 2.965 . 0 0 "[ . 1 .]" 1
561 1 65 ALA O 1 100 GLU H . . 2.200 2.016 1.727 2.365 0.165 1 0 "[ . 1 .]" 1
562 1 65 ALA O 1 100 GLU N . . 3.200 2.870 2.461 3.124 . 0 0 "[ . 1 .]" 1
563 1 66 ARG H 1 66 ARG HD3 . . 2.700 2.387 2.048 2.694 . 0 0 "[ . 1 .]" 1
564 1 66 ARG H 1 66 ARG HG3 . . 3.800 3.702 3.544 3.945 0.145 12 0 "[ . 1 .]" 1
565 1 66 ARG HA 1 66 ARG HG3 . . 4.400 4.248 4.130 4.295 . 0 0 "[ . 1 .]" 1
566 1 66 ARG HA 1 67 GLY H . . 5.600 2.352 2.215 2.426 . 0 0 "[ . 1 .]" 1
567 1 66 ARG HB2 1 66 ARG HG3 . . 2.700 2.285 2.207 2.352 . 0 0 "[ . 1 .]" 1
568 1 66 ARG HB2 1 67 GLY H . . 5.600 2.593 2.413 3.131 . 0 0 "[ . 1 .]" 1
569 1 66 ARG HB3 1 66 ARG HD2 . . 2.700 2.231 2.109 2.599 . 0 0 "[ . 1 .]" 1
570 1 66 ARG HB3 1 67 GLY H . . 5.600 3.671 3.468 4.116 . 0 0 "[ . 1 .]" 1
571 1 66 ARG HD2 1 66 ARG HG3 . . 3.000 2.812 2.378 3.017 0.017 10 0 "[ . 1 .]" 1
572 1 66 ARG HD3 1 66 ARG HG3 . . 3.000 2.956 2.746 3.064 0.064 6 0 "[ . 1 .]" 1
573 1 67 GLY HA2 1 68 ALA H . . 5.600 2.352 2.138 3.425 . 0 0 "[ . 1 .]" 1
574 1 67 GLY HA3 1 68 ALA H . . 5.600 3.121 2.167 3.505 . 0 0 "[ . 1 .]" 1
575 1 67 GLY HA3 1 75 PHE H . . 3.000 2.914 1.986 3.205 0.205 1 0 "[ . 1 .]" 1
576 1 67 GLY HA3 1 76 ASP H . . 5.000 4.794 4.234 5.250 0.250 11 0 "[ . 1 .]" 1
577 1 68 ALA HA 1 74 ALA HA . . 5.600 3.205 2.106 4.611 . 0 0 "[ . 1 .]" 1
578 1 68 ALA HA 1 74 ALA MB . . 4.500 3.699 2.121 4.584 0.084 9 0 "[ . 1 .]" 1
579 1 68 ALA MB 1 74 ALA HA . . 5.200 3.713 2.633 5.243 0.043 3 0 "[ . 1 .]" 1
580 1 68 ALA MB 1 74 ALA MB . . 6.000 3.712 2.421 4.789 . 0 0 "[ . 1 .]" 1
581 1 72 PHE HB2 1 73 HIS H . . 5.600 3.683 2.209 4.772 . 0 0 "[ . 1 .]" 1
582 1 72 PHE HB3 1 73 HIS H . . 5.600 3.092 1.946 4.576 . 0 0 "[ . 1 .]" 1
583 1 72 PHE QD 1 73 HIS H . . 7.800 3.559 1.970 4.745 . 0 0 "[ . 1 .]" 1
584 1 72 PHE QE 1 73 HIS H . . 7.800 5.419 3.795 6.780 . 0 0 "[ . 1 .]" 1
585 1 73 HIS H 1 74 ALA H . . 3.700 3.266 2.006 3.845 0.145 13 0 "[ . 1 .]" 1
586 1 73 HIS HA 1 74 ALA H . . 3.100 2.843 2.167 3.362 0.262 8 0 "[ . 1 .]" 1
587 1 74 ALA HA 1 75 PHE H . . 3.400 2.341 2.091 3.062 . 0 0 "[ . 1 .]" 1
588 1 74 ALA MB 1 75 PHE H . . 5.600 3.118 1.929 3.707 . 0 0 "[ . 1 .]" 1
589 1 75 PHE H 1 76 ASP H . . 5.600 4.305 3.817 4.696 . 0 0 "[ . 1 .]" 1
590 1 75 PHE HA 1 76 ASP H . . 5.600 2.917 2.476 3.654 . 0 0 "[ . 1 .]" 1
591 1 75 PHE HB3 1 76 ASP H . . 3.900 2.390 2.000 3.573 . 0 0 "[ . 1 .]" 1
592 1 75 PHE HD1 1 81 ILE MG . . 6.200 4.117 2.408 6.250 0.050 5 0 "[ . 1 .]" 1
593 1 75 PHE HD2 1 76 ASP H . . 5.600 3.544 2.595 4.570 . 0 0 "[ . 1 .]" 1
594 1 75 PHE HE1 1 81 ILE MG . . 6.600 3.612 1.842 6.089 . 0 0 "[ . 1 .]" 1
595 1 75 PHE HE2 1 76 ASP H . . 5.600 5.071 4.064 5.881 0.281 15 0 "[ . 1 .]" 1
596 1 75 PHE HZ 1 84 HIS H . . 5.600 4.199 2.115 5.173 . 0 0 "[ . 1 .]" 1
597 1 75 PHE HZ 1 97 HIS H . . 6.100 5.682 4.066 6.296 0.196 13 0 "[ . 1 .]" 1
598 1 76 ASP H 1 77 GLY H . . 5.100 4.128 2.441 4.730 . 0 0 "[ . 1 .]" 1
599 1 76 ASP H 1 81 ILE MG . . 4.200 3.701 2.507 4.275 0.075 12 0 "[ . 1 .]" 1
600 1 76 ASP HA 1 77 GLY H . . 5.600 2.801 2.207 3.690 . 0 0 "[ . 1 .]" 1
601 1 76 ASP HB2 1 77 GLY H . . 5.600 2.871 2.000 3.938 . 0 0 "[ . 1 .]" 1
602 1 77 GLY HA2 1 78 LYS H . . 5.600 2.527 2.091 3.194 . 0 0 "[ . 1 .]" 1
603 1 77 GLY HA3 1 78 LYS H . . 5.600 3.359 2.763 3.592 . 0 0 "[ . 1 .]" 1
604 1 78 LYS H 1 78 LYS HG3 . . 4.100 3.670 2.839 4.336 0.236 10 0 "[ . 1 .]" 1
605 1 78 LYS H 1 79 GLY H . . 5.300 2.468 1.846 3.390 . 0 0 "[ . 1 .]" 1
606 1 78 LYS H 1 102 GLU HA . . 4.200 3.538 2.033 4.313 0.113 1 0 "[ . 1 .]" 1
607 1 78 LYS H 1 102 GLU HB2 . . 5.000 3.853 2.104 5.064 0.064 13 0 "[ . 1 .]" 1
608 1 78 LYS H 1 102 GLU HG3 . . 5.600 4.555 2.652 5.657 0.057 11 0 "[ . 1 .]" 1
609 1 78 LYS HA 1 78 LYS HG3 . . 3.400 2.864 2.129 3.676 0.276 12 0 "[ . 1 .]" 1
610 1 78 LYS HA 1 79 GLY H . . 5.600 3.042 2.284 3.626 . 0 0 "[ . 1 .]" 1
611 1 78 LYS HB3 1 78 LYS HG3 . . 2.700 2.690 2.503 2.853 0.153 11 0 "[ . 1 .]" 1
612 1 78 LYS HB3 1 79 GLY H . . 5.600 4.127 2.867 4.718 . 0 0 "[ . 1 .]" 1
613 1 78 LYS HD2 1 78 LYS HG3 . . 3.000 2.409 2.166 2.866 . 0 0 "[ . 1 .]" 1
614 1 78 LYS HD3 1 78 LYS HG3 . . 3.000 2.961 2.750 3.057 0.057 15 0 "[ . 1 .]" 1
615 1 78 LYS QE 1 78 LYS HG3 . . 3.900 2.818 2.065 3.379 . 0 0 "[ . 1 .]" 1
616 1 78 LYS HG3 1 79 GLY H . . 5.600 4.119 2.273 5.094 . 0 0 "[ . 1 .]" 1
617 1 79 GLY H 1 80 GLY H . . 5.600 3.944 2.062 4.625 . 0 0 "[ . 1 .]" 1
618 1 79 GLY HA2 1 80 GLY H . . 5.600 3.194 2.466 3.634 . 0 0 "[ . 1 .]" 1
619 1 79 GLY HA3 1 80 GLY H . . 5.600 2.349 2.185 2.849 . 0 0 "[ . 1 .]" 1
620 1 80 GLY H 1 81 ILE H . . 5.600 4.308 3.039 4.734 . 0 0 "[ . 1 .]" 1
621 1 80 GLY HA2 1 81 ILE H . . 5.600 3.088 2.206 3.562 . 0 0 "[ . 1 .]" 1
622 1 80 GLY HA3 1 81 ILE H . . 5.600 2.561 2.128 3.414 . 0 0 "[ . 1 .]" 1
623 1 81 ILE H 1 81 ILE MD . . 5.300 3.700 2.026 4.496 . 0 0 "[ . 1 .]" 1
624 1 81 ILE H 1 81 ILE HG13 . . 4.000 3.185 2.002 4.137 0.137 14 0 "[ . 1 .]" 1
625 1 81 ILE HA 1 82 LEU H . . 5.600 2.620 2.426 2.827 . 0 0 "[ . 1 .]" 1
626 1 81 ILE HA 1 83 ALA H . . 5.600 4.355 3.318 5.541 . 0 0 "[ . 1 .]" 1
627 1 81 ILE MG 1 82 LEU H . . 6.600 2.909 1.793 4.153 . 0 0 "[ . 1 .]" 1
628 1 82 LEU H 1 83 ALA H . . 5.600 2.392 1.802 3.237 . 0 0 "[ . 1 .]" 1
629 1 82 LEU HB2 1 83 ALA H . . 4.100 3.315 2.125 3.843 . 0 0 "[ . 1 .]" 1
630 1 82 LEU HB2 1 111 THR HA . . 7.400 7.045 5.054 7.461 0.061 10 0 "[ . 1 .]" 1
631 1 82 LEU HB2 1 111 THR MG . . 5.200 4.873 3.919 5.274 0.074 3 0 "[ . 1 .]" 1
632 1 82 LEU HB2 1 116 THR MG . . 4.700 3.477 2.125 4.563 . 0 0 "[ . 1 .]" 1
633 1 82 LEU HB3 1 83 ALA H . . 5.600 2.656 2.024 3.495 . 0 0 "[ . 1 .]" 1
634 1 82 LEU QD 1 113 LEU MD2 . . 5.200 4.666 4.038 5.063 . 0 0 "[ . 1 .]" 1
635 1 82 LEU QD 1 116 THR MG . . 7.400 2.073 1.756 2.599 . 0 0 "[ . 1 .]" 1
636 1 82 LEU QD 1 141 TYR QD . . 4.700 3.140 2.465 3.643 . 0 0 "[ . 1 .]" 1
637 1 82 LEU O 1 99 ASP H . . 2.200 2.099 1.909 2.305 0.105 14 0 "[ . 1 .]" 1
638 1 82 LEU O 1 99 ASP N . . 3.200 3.075 2.892 3.259 0.059 10 0 "[ . 1 .]" 1
639 1 83 ALA HA 1 84 HIS H . . 5.600 2.608 2.547 2.801 . 0 0 "[ . 1 .]" 1
640 1 83 ALA MB 1 84 HIS H . . 5.100 2.138 1.994 2.281 . 0 0 "[ . 1 .]" 1
641 1 83 ALA MB 1 116 THR MG . . 6.100 1.928 1.736 2.604 . 0 0 "[ . 1 .]" 1
642 1 84 HIS H 1 84 HIS HD2 . . 5.600 4.051 2.387 4.807 . 0 0 "[ . 1 .]" 1
643 1 84 HIS H 1 97 HIS H . . 5.800 2.550 2.284 3.155 . 0 0 "[ . 1 .]" 1
644 1 84 HIS H 1 97 HIS HB2 . . 5.600 4.297 3.428 5.558 . 0 0 "[ . 1 .]" 1
645 1 84 HIS H 1 97 HIS O . . 2.200 2.080 1.897 2.247 0.047 12 0 "[ . 1 .]" 1
646 1 84 HIS HA 1 85 ALA H . . 3.000 2.336 2.218 2.595 . 0 0 "[ . 1 .]" 1
647 1 84 HIS HB3 1 97 HIS H . . 4.900 4.922 4.419 5.008 0.108 6 0 "[ . 1 .]" 1
648 1 84 HIS N 1 97 HIS O . . 3.200 2.911 2.713 3.067 . 0 0 "[ . 1 .]" 1
649 1 84 HIS O 1 97 HIS H . . 2.300 1.928 1.747 2.250 . 0 0 "[ . 1 .]" 1
650 1 84 HIS O 1 97 HIS N . . 3.200 2.837 2.737 2.982 . 0 0 "[ . 1 .]" 1
651 1 85 ALA HA 1 96 ALA MB . . 6.600 2.863 1.989 3.687 . 0 0 "[ . 1 .]" 1
652 1 85 ALA HA 1 97 HIS H . . 5.600 3.748 3.239 3.982 . 0 0 "[ . 1 .]" 1
653 1 85 ALA MB 1 96 ALA MB . . 4.100 1.886 1.781 1.998 . 0 0 "[ . 1 .]" 1
654 1 85 ALA MB 1 120 GLU HA . . 6.300 2.844 1.902 3.989 . 0 0 "[ . 1 .]" 1
655 1 85 ALA MB 1 120 GLU HB3 . . 3.900 3.269 2.261 3.917 0.017 11 0 "[ . 1 .]" 1
656 1 85 ALA MB 1 123 HIS HB2 . . 4.600 3.128 1.962 4.271 . 0 0 "[ . 1 .]" 1
657 1 85 ALA MB 1 123 HIS HB3 . . 6.600 3.158 2.008 4.552 . 0 0 "[ . 1 .]" 1
658 1 86 PHE HA 1 123 HIS HA . . 8.300 7.669 6.773 8.283 . 0 0 "[ . 1 .]" 1
659 1 86 PHE HA 1 123 HIS HE1 . . 8.300 7.631 6.743 8.213 . 0 0 "[ . 1 .]" 1
660 1 86 PHE QB 1 92 ILE MG . . 5.600 3.464 1.760 5.231 . 0 0 "[ . 1 .]" 1
661 1 86 PHE HB3 1 87 GLY H . . 4.600 2.520 2.053 3.768 . 0 0 "[ . 1 .]" 1
662 1 86 PHE HB3 1 94 GLY H . . 4.500 2.897 1.951 4.400 . 0 0 "[ . 1 .]" 1
663 1 86 PHE HB3 1 95 ASP H . . 6.600 4.720 3.262 6.111 . 0 0 "[ . 1 .]" 1
664 1 86 PHE HD2 1 92 ILE MD . . 6.300 5.089 2.203 7.001 0.701 2 1 "[ + . 1 .]" 1
665 1 86 PHE HD2 1 94 GLY H . . 8.300 5.065 3.685 6.615 . 0 0 "[ . 1 .]" 1
666 1 86 PHE HD2 1 95 ASP H . . 8.500 6.112 2.693 8.215 . 0 0 "[ . 1 .]" 1
667 1 86 PHE QE 1 92 ILE MD . . 6.100 4.356 2.490 5.878 . 0 0 "[ . 1 .]" 1
668 1 86 PHE QE 1 92 ILE MG . . 5.600 3.644 2.145 5.150 . 0 0 "[ . 1 .]" 1
669 1 87 GLY HA2 1 124 SER QB . . 8.300 4.670 3.284 6.793 . 0 0 "[ . 1 .]" 1
670 1 88 PRO HD2 1 89 GLY H . . 5.600 3.953 2.523 5.102 . 0 0 "[ . 1 .]" 1
671 1 88 PRO HD3 1 89 GLY H . . 5.200 4.675 3.777 5.569 0.369 1 0 "[ . 1 .]" 1
672 1 90 SER HA 1 91 GLY H . . 5.600 2.725 2.191 3.653 . 0 0 "[ . 1 .]" 1
673 1 91 GLY HA3 1 92 ILE H . . 5.600 2.294 2.136 2.604 . 0 0 "[ . 1 .]" 1
674 1 92 ILE H 1 93 GLY H . . 5.600 2.712 2.559 2.919 . 0 0 "[ . 1 .]" 1
675 1 92 ILE H 1 93 GLY HA3 . . 5.600 4.970 4.868 5.161 . 0 0 "[ . 1 .]" 1
676 1 92 ILE HA 1 92 ILE HG13 . . 3.400 2.925 2.212 3.623 0.223 15 0 "[ . 1 .]" 1
677 1 92 ILE HA 1 95 ASP H . . 5.900 4.275 3.754 4.605 . 0 0 "[ . 1 .]" 1
678 1 92 ILE HB 1 92 ILE HG12 . . 2.800 2.774 2.595 2.893 0.093 15 0 "[ . 1 .]" 1
679 1 92 ILE MG 1 93 GLY H . . 4.400 2.649 1.903 4.308 . 0 0 "[ . 1 .]" 1
680 1 92 ILE MG 1 95 ASP H . . 6.200 4.645 3.920 5.192 . 0 0 "[ . 1 .]" 1
681 1 92 ILE O 1 95 ASP H . . 2.200 2.066 1.912 2.182 . 0 0 "[ . 1 .]" 1
682 1 92 ILE O 1 95 ASP N . . 3.200 2.966 2.839 3.110 . 0 0 "[ . 1 .]" 1
683 1 93 GLY HA3 1 94 GLY H . . 5.600 3.164 2.908 3.434 . 0 0 "[ . 1 .]" 1
684 1 94 GLY HA3 1 95 ASP H . . 5.600 3.034 2.728 3.341 . 0 0 "[ . 1 .]" 1
685 1 95 ASP H 1 96 ALA H . . 5.600 4.548 4.298 4.695 . 0 0 "[ . 1 .]" 1
686 1 95 ASP HA 1 96 ALA H . . 5.600 2.244 2.168 2.435 . 0 0 "[ . 1 .]" 1
687 1 95 ASP HB3 1 96 ALA H . . 5.600 3.258 2.545 3.935 . 0 0 "[ . 1 .]" 1
688 1 96 ALA HA 1 97 HIS H . . 5.600 2.265 2.189 2.355 . 0 0 "[ . 1 .]" 1
689 1 96 ALA MB 1 97 HIS H . . 6.400 2.742 2.468 3.012 . 0 0 "[ . 1 .]" 1
690 1 97 HIS HA 1 97 HIS HD2 . . 4.300 2.759 2.265 3.295 . 0 0 "[ . 1 .]" 1
691 1 97 HIS HA 1 98 PHE H . . 5.600 2.206 2.143 2.325 . 0 0 "[ . 1 .]" 1
692 1 97 HIS HB2 1 98 PHE H . . 5.600 3.911 3.480 4.249 . 0 0 "[ . 1 .]" 1
693 1 98 PHE QD 1 113 LEU MD1 . . 8.800 5.115 3.935 5.956 . 0 0 "[ . 1 .]" 1
694 1 98 PHE QD 1 116 THR MG . . 8.500 2.530 2.005 3.546 . 0 0 "[ . 1 .]" 1
695 1 98 PHE QE 1 116 THR MG . . 8.500 2.978 2.057 4.103 . 0 0 "[ . 1 .]" 1
696 1 99 ASP O 1 102 GLU H . . 2.600 2.530 2.290 2.706 0.106 5 0 "[ . 1 .]" 1
697 1 99 ASP O 1 102 GLU N . . 3.300 3.304 3.231 3.414 0.114 13 0 "[ . 1 .]" 1
698 1 99 ASP O 1 104 TRP HE1 . . 2.000 1.966 1.807 2.020 0.020 11 0 "[ . 1 .]" 1
699 1 99 ASP O 1 104 TRP NE1 . . 3.200 2.823 2.576 3.014 . 0 0 "[ . 1 .]" 1
700 1 100 GLU HA 1 104 TRP HE1 . . 4.600 2.092 1.926 2.442 . 0 0 "[ . 1 .]" 1
701 1 100 GLU HG2 1 104 TRP HE1 . . 6.100 5.362 3.871 6.216 0.116 6 0 "[ . 1 .]" 1
702 1 100 GLU HG3 1 104 TRP HE1 . . 5.200 5.245 4.990 5.430 0.230 6 0 "[ . 1 .]" 1
703 1 101 ASP HA 1 102 GLU H . . 5.600 3.579 3.433 3.652 . 0 0 "[ . 1 .]" 1
704 1 101 ASP HA 1 104 TRP HE1 . . 6.600 5.938 5.483 6.560 . 0 0 "[ . 1 .]" 1
705 1 101 ASP HB2 1 103 PHE H . . 7.800 7.505 6.790 7.883 0.083 12 0 "[ . 1 .]" 1
706 1 101 ASP HB3 1 103 PHE H . . 7.800 6.621 6.295 7.246 . 0 0 "[ . 1 .]" 1
707 1 102 GLU H 1 102 GLU HG2 . . 4.000 3.297 2.115 4.035 0.035 9 0 "[ . 1 .]" 1
708 1 102 GLU H 1 102 GLU HG3 . . 5.100 3.835 2.533 4.539 . 0 0 "[ . 1 .]" 1
709 1 102 GLU H 1 103 PHE H . . 5.600 4.622 4.566 4.687 . 0 0 "[ . 1 .]" 1
710 1 102 GLU HA 1 103 PHE H . . 5.000 2.637 2.558 2.813 . 0 0 "[ . 1 .]" 1
711 1 102 GLU HB2 1 103 PHE H . . 5.000 2.809 2.061 3.638 . 0 0 "[ . 1 .]" 1
712 1 102 GLU HB3 1 103 PHE H . . 5.600 3.176 2.037 3.883 . 0 0 "[ . 1 .]" 1
713 1 102 GLU HG2 1 103 PHE H . . 5.600 3.561 2.886 4.188 . 0 0 "[ . 1 .]" 1
714 1 103 PHE H 1 104 TRP H . . 5.600 4.000 3.634 4.364 . 0 0 "[ . 1 .]" 1
715 1 103 PHE HA 1 104 TRP H . . 4.600 2.224 2.106 2.366 . 0 0 "[ . 1 .]" 1
716 1 103 PHE HB3 1 104 TRP H . . 5.600 4.269 3.798 4.575 . 0 0 "[ . 1 .]" 1
717 1 103 PHE QD 1 105 THR MG . . 5.600 4.094 2.664 5.550 . 0 0 "[ . 1 .]" 1
718 1 104 TRP H 1 104 TRP HE1 . . 4.700 4.491 4.138 4.793 0.093 10 0 "[ . 1 .]" 1
719 1 104 TRP HA 1 105 THR H . . 4.700 2.256 2.179 2.327 . 0 0 "[ . 1 .]" 1
720 1 104 TRP HB2 1 105 THR H . . 4.900 3.979 2.966 4.445 . 0 0 "[ . 1 .]" 1
721 1 104 TRP HB3 1 105 THR H . . 5.300 3.239 2.768 3.838 . 0 0 "[ . 1 .]" 1
722 1 105 THR H 1 110 GLY HA3 . . 5.600 4.994 4.139 5.561 . 0 0 "[ . 1 .]" 1
723 1 105 THR H 1 111 THR O . . 2.200 1.979 1.834 2.117 . 0 0 "[ . 1 .]" 1
724 1 105 THR H 1 112 ASN HA . . 5.100 3.763 2.796 4.088 . 0 0 "[ . 1 .]" 1
725 1 105 THR MG 1 109 GLY H . . 5.200 3.952 2.032 5.131 . 0 0 "[ . 1 .]" 1
726 1 105 THR MG 1 111 THR H . . 5.900 3.857 2.782 5.393 . 0 0 "[ . 1 .]" 1
727 1 105 THR N 1 111 THR O . . 3.200 2.857 2.731 3.046 . 0 0 "[ . 1 .]" 1
728 1 106 THR MG 1 113 LEU HB3 . . 5.200 3.467 2.391 4.408 . 0 0 "[ . 1 .]" 1
729 1 106 THR MG 1 113 LEU MD1 . . 6.900 4.467 3.166 5.568 . 0 0 "[ . 1 .]" 1
730 1 106 THR MG 1 113 LEU MD2 . . 5.300 4.247 2.247 5.200 . 0 0 "[ . 1 .]" 1
731 1 108 SER HA 1 109 GLY H . . 5.600 2.822 2.156 3.673 . 0 0 "[ . 1 .]" 1
732 1 108 SER HB2 1 109 GLY H . . 5.600 3.907 2.690 4.682 . 0 0 "[ . 1 .]" 1
733 1 108 SER HB3 1 109 GLY H . . 4.900 3.321 2.004 4.594 . 0 0 "[ . 1 .]" 1
734 1 109 GLY H 1 111 THR H . . 5.800 5.719 5.336 5.884 0.084 8 0 "[ . 1 .]" 1
735 1 109 GLY HA2 1 110 GLY H . . 4.400 3.100 2.190 3.610 . 0 0 "[ . 1 .]" 1
736 1 109 GLY HA3 1 110 GLY H . . 4.400 2.976 2.212 3.653 . 0 0 "[ . 1 .]" 1
737 1 110 GLY H 1 111 THR H . . 5.600 4.038 2.995 4.600 . 0 0 "[ . 1 .]" 1
738 1 110 GLY QA 1 111 THR H . . 5.000 2.194 2.125 2.359 . 0 0 "[ . 1 .]" 1
739 1 110 GLY HA2 1 111 THR H . . 5.000 3.298 2.883 3.608 . 0 0 "[ . 1 .]" 1
740 1 111 THR H 1 112 ASN H . . 5.600 4.531 4.369 4.641 . 0 0 "[ . 1 .]" 1
741 1 111 THR HA 1 112 ASN H . . 5.600 2.150 2.061 2.238 . 0 0 "[ . 1 .]" 1
742 1 111 THR HA 1 141 TYR HH . . 5.600 4.029 2.233 5.594 . 0 0 "[ . 1 .]" 1
743 1 111 THR HB 1 112 ASN H . . 5.600 3.555 2.946 4.564 . 0 0 "[ . 1 .]" 1
744 1 111 THR HB 1 141 TYR QE . . 5.700 4.616 2.862 5.486 . 0 0 "[ . 1 .]" 1
745 1 111 THR MG 1 112 ASN H . . 5.200 3.799 2.668 4.447 . 0 0 "[ . 1 .]" 1
746 1 111 THR MG 1 116 THR MG . . 7.100 5.212 3.755 6.047 . 0 0 "[ . 1 .]" 1
747 1 111 THR MG 1 141 TYR QE . . 4.300 3.108 2.308 4.057 . 0 0 "[ . 1 .]" 1
748 1 111 THR MG 1 141 TYR HH . . 6.300 2.464 2.033 3.561 . 0 0 "[ . 1 .]" 1
749 1 112 ASN HA 1 113 LEU H . . 5.600 2.244 2.153 2.688 . 0 0 "[ . 1 .]" 1
750 1 112 ASN OD1 1 115 LEU H . . 2.200 1.913 1.687 2.153 . 0 0 "[ . 1 .]" 1
751 1 112 ASN OD1 1 115 LEU N . . 3.200 2.804 2.646 3.075 . 0 0 "[ . 1 .]" 1
752 1 113 LEU H 1 114 PHE H . . 5.600 2.643 2.583 2.768 . 0 0 "[ . 1 .]" 1
753 1 113 LEU H 1 114 PHE HB2 . . 5.600 5.099 4.861 5.351 . 0 0 "[ . 1 .]" 1
754 1 113 LEU HB3 1 114 PHE H . . 5.600 3.064 2.779 4.074 . 0 0 "[ . 1 .]" 1
755 1 113 LEU MD1 1 116 THR MG . . 7.800 5.260 3.115 6.309 . 0 0 "[ . 1 .]" 1
756 1 113 LEU MD2 1 117 ALA MB . . 4.900 3.221 2.151 4.663 . 0 0 "[ . 1 .]" 1
757 1 113 LEU HG 1 114 PHE H . . 5.600 4.826 2.554 5.395 . 0 0 "[ . 1 .]" 1
758 1 113 LEU O 1 117 ALA H . . 2.200 1.708 1.574 1.925 . 0 0 "[ . 1 .]" 1
759 1 113 LEU O 1 117 ALA N . . 3.200 2.662 2.522 2.894 . 0 0 "[ . 1 .]" 1
760 1 114 PHE HB2 1 115 LEU H . . 5.600 3.871 3.774 3.984 . 0 0 "[ . 1 .]" 1
761 1 114 PHE HB3 1 115 LEU H . . 5.600 2.518 2.385 2.675 . 0 0 "[ . 1 .]" 1
762 1 114 PHE QD 1 115 LEU H . . 7.800 2.841 2.314 3.708 . 0 0 "[ . 1 .]" 1
763 1 114 PHE QD 1 118 VAL MG2 . . 8.700 2.913 2.226 3.471 . 0 0 "[ . 1 .]" 1
764 1 114 PHE QD 1 146 ILE MD . . 8.800 3.420 2.745 4.383 . 0 0 "[ . 1 .]" 1
765 1 114 PHE QD 1 146 ILE MG . . 8.500 2.930 2.481 3.653 . 0 0 "[ . 1 .]" 1
766 1 114 PHE QE 1 115 LEU QD . . 5.700 4.716 3.461 5.332 . 0 0 "[ . 1 .]" 1
767 1 114 PHE QE 1 118 VAL MG2 . . 5.200 2.458 2.020 2.927 . 0 0 "[ . 1 .]" 1
768 1 114 PHE QE 1 146 ILE HA . . 5.600 3.851 2.506 4.666 . 0 0 "[ . 1 .]" 1
769 1 114 PHE QE 1 146 ILE MD . . 8.400 4.602 3.451 5.587 . 0 0 "[ . 1 .]" 1
770 1 114 PHE QE 1 146 ILE MG . . 7.400 2.678 2.267 3.388 . 0 0 "[ . 1 .]" 1
771 1 114 PHE O 1 118 VAL H . . 2.200 1.898 1.763 2.108 . 0 0 "[ . 1 .]" 1
772 1 114 PHE O 1 118 VAL N . . 3.200 2.845 2.695 3.016 . 0 0 "[ . 1 .]" 1
773 1 115 LEU H 1 115 LEU HG . . 4.800 3.950 3.726 4.311 . 0 0 "[ . 1 .]" 1
774 1 115 LEU H 1 116 THR H . . 5.600 2.845 2.685 2.927 . 0 0 "[ . 1 .]" 1
775 1 115 LEU H 1 117 ALA H . . 5.600 4.153 3.942 4.357 . 0 0 "[ . 1 .]" 1
776 1 115 LEU HA 1 116 THR H . . 4.000 3.585 3.530 3.634 . 0 0 "[ . 1 .]" 1
777 1 115 LEU HA 1 118 VAL H . . 5.600 3.680 3.460 3.770 . 0 0 "[ . 1 .]" 1
778 1 115 LEU HB2 1 116 THR H . . 4.500 3.819 2.859 4.173 . 0 0 "[ . 1 .]" 1
779 1 115 LEU HB3 1 116 THR H . . 4.200 2.925 2.559 3.229 . 0 0 "[ . 1 .]" 1
780 1 115 LEU QD 1 116 THR H . . 4.300 3.422 3.210 3.998 . 0 0 "[ . 1 .]" 1
781 1 115 LEU QD 1 136 VAL MG1 . . 6.100 4.661 3.170 5.522 . 0 0 "[ . 1 .]" 1
782 1 115 LEU QD 1 143 TYR HA . . 5.300 2.686 1.867 2.940 . 0 0 "[ . 1 .]" 1
783 1 115 LEU QD 1 143 TYR HB3 . . 4.300 4.034 3.207 4.227 . 0 0 "[ . 1 .]" 1
784 1 115 LEU QD 1 144 VAL H . . 5.600 2.736 2.171 3.239 . 0 0 "[ . 1 .]" 1
785 1 115 LEU QD 1 144 VAL HB . . 5.200 4.671 3.763 4.928 . 0 0 "[ . 1 .]" 1
786 1 115 LEU QD 1 144 VAL MG1 . . 4.400 3.106 2.205 4.181 . 0 0 "[ . 1 .]" 1
787 1 115 LEU QD 1 146 ILE HA . . 6.200 5.131 3.740 5.652 . 0 0 "[ . 1 .]" 1
788 1 115 LEU QD 1 146 ILE MD . . 6.900 5.024 3.960 6.001 . 0 0 "[ . 1 .]" 1
789 1 115 LEU QD 1 146 ILE MG . . 6.500 5.310 3.983 6.081 . 0 0 "[ . 1 .]" 1
790 1 115 LEU O 1 119 HIS H . . 2.200 2.185 2.049 2.264 0.064 12 0 "[ . 1 .]" 1
791 1 115 LEU O 1 119 HIS N . . 3.200 3.121 3.047 3.165 . 0 0 "[ . 1 .]" 1
792 1 116 THR H 1 116 THR HA . . 3.100 2.846 2.785 2.927 . 0 0 "[ . 1 .]" 1
793 1 116 THR H 1 117 ALA H . . 3.800 2.616 2.398 2.732 . 0 0 "[ . 1 .]" 1
794 1 116 THR MG 1 117 ALA H . . 5.700 4.014 3.476 4.223 . 0 0 "[ . 1 .]" 1
795 1 116 THR MG 1 119 HIS HE1 . . 6.600 6.279 5.017 6.666 0.066 6 0 "[ . 1 .]" 1
796 1 116 THR O 1 120 GLU H . . 2.200 1.837 1.729 2.056 . 0 0 "[ . 1 .]" 1
797 1 116 THR O 1 120 GLU N . . 3.200 2.825 2.691 2.999 . 0 0 "[ . 1 .]" 1
798 1 117 ALA H 1 118 VAL H . . 5.600 2.697 2.576 2.773 . 0 0 "[ . 1 .]" 1
799 1 117 ALA H 1 119 HIS H . . 5.600 4.175 4.039 4.410 . 0 0 "[ . 1 .]" 1
800 1 117 ALA HA 1 118 VAL H . . 4.000 3.537 3.516 3.551 . 0 0 "[ . 1 .]" 1
801 1 117 ALA HA 1 119 HIS H . . 5.600 4.438 4.348 4.646 . 0 0 "[ . 1 .]" 1
802 1 117 ALA MB 1 118 VAL H . . 3.900 2.615 2.492 2.721 . 0 0 "[ . 1 .]" 1
803 1 117 ALA MB 1 118 VAL HA . . 5.200 3.796 3.727 3.861 . 0 0 "[ . 1 .]" 1
804 1 117 ALA MB 1 121 ILE MD . . 6.400 3.048 2.001 4.145 . 0 0 "[ . 1 .]" 1
805 1 117 ALA O 1 121 ILE H . . 2.200 2.003 1.807 2.195 . 0 0 "[ . 1 .]" 1
806 1 117 ALA O 1 121 ILE N . . 3.200 2.937 2.749 3.117 . 0 0 "[ . 1 .]" 1
807 1 118 VAL H 1 118 VAL HB . . 3.000 2.517 2.147 2.847 . 0 0 "[ . 1 .]" 1
808 1 118 VAL H 1 119 HIS H . . 4.900 2.609 2.515 2.679 . 0 0 "[ . 1 .]" 1
809 1 118 VAL HA 1 119 HIS H . . 4.900 3.525 3.486 3.549 . 0 0 "[ . 1 .]" 1
810 1 118 VAL HA 1 121 ILE H . . 5.600 3.733 3.483 3.903 . 0 0 "[ . 1 .]" 1
811 1 118 VAL HB 1 119 HIS H . . 5.600 2.666 2.475 3.061 . 0 0 "[ . 1 .]" 1
812 1 118 VAL HB 1 136 VAL MG1 . . 4.600 3.974 2.944 4.598 . 0 0 "[ . 1 .]" 1
813 1 118 VAL MG1 1 119 HIS H . . 6.600 3.409 2.478 3.869 . 0 0 "[ . 1 .]" 1
814 1 118 VAL MG1 1 149 PHE QD . . 6.900 4.061 2.805 5.379 . 0 0 "[ . 1 .]" 1
815 1 118 VAL MG1 1 149 PHE QE . . 6.100 2.339 1.915 4.247 . 0 0 "[ . 1 .]" 1
816 1 118 VAL MG1 1 151 LEU MD1 . . 5.700 4.298 3.427 5.492 . 0 0 "[ . 1 .]" 1
817 1 118 VAL MG2 1 119 HIS H . . 6.200 3.861 3.609 4.231 . 0 0 "[ . 1 .]" 1
818 1 118 VAL MG2 1 136 VAL MG1 . . 5.100 3.970 3.068 4.968 . 0 0 "[ . 1 .]" 1
819 1 118 VAL MG2 1 136 VAL MG2 . . 4.900 4.534 3.542 4.925 0.025 8 0 "[ . 1 .]" 1
820 1 118 VAL MG2 1 149 PHE HZ . . 5.900 2.961 2.074 5.477 . 0 0 "[ . 1 .]" 1
821 1 118 VAL O 1 122 GLY H . . 2.200 2.002 1.855 2.174 . 0 0 "[ . 1 .]" 1
822 1 118 VAL O 1 122 GLY N . . 3.200 2.928 2.745 3.103 . 0 0 "[ . 1 .]" 1
823 1 119 HIS H 1 120 GLU H . . 3.800 2.654 2.547 2.767 . 0 0 "[ . 1 .]" 1
824 1 119 HIS HB2 1 120 GLU H . . 5.100 3.783 3.630 4.052 . 0 0 "[ . 1 .]" 1
825 1 119 HIS HB2 1 136 VAL MG1 . . 5.200 5.035 4.335 5.357 0.157 1 0 "[ . 1 .]" 1
826 1 119 HIS HB3 1 120 GLU H . . 5.600 2.537 2.389 2.744 . 0 0 "[ . 1 .]" 1
827 1 119 HIS HD1 1 137 MET ME . . 5.700 5.035 3.755 5.715 0.015 8 0 "[ . 1 .]" 1
828 1 119 HIS HE1 1 137 MET ME . . 5.700 4.657 3.412 5.206 . 0 0 "[ . 1 .]" 1
829 1 119 HIS O 1 123 HIS H . . 2.200 2.185 2.115 2.229 0.029 12 0 "[ . 1 .]" 1
830 1 119 HIS O 1 123 HIS N . . 3.200 3.066 2.983 3.093 . 0 0 "[ . 1 .]" 1
831 1 120 GLU H 1 120 GLU HG2 . . 3.000 2.757 2.364 3.036 0.036 5 0 "[ . 1 .]" 1
832 1 120 GLU H 1 120 GLU HG3 . . 5.600 3.508 1.904 4.168 . 0 0 "[ . 1 .]" 1
833 1 120 GLU H 1 121 ILE H . . 4.000 2.698 2.629 2.797 . 0 0 "[ . 1 .]" 1
834 1 120 GLU H 1 137 MET HB3 . . 9.100 8.287 5.588 9.223 0.123 11 0 "[ . 1 .]" 1
835 1 120 GLU HA 1 121 ILE H . . 4.000 3.537 3.469 3.587 . 0 0 "[ . 1 .]" 1
836 1 120 GLU HA 1 123 HIS H . . 5.600 3.669 3.497 3.828 . 0 0 "[ . 1 .]" 1
837 1 120 GLU HB3 1 121 ILE H . . 5.600 3.642 3.472 4.031 . 0 0 "[ . 1 .]" 1
838 1 121 ILE H 1 121 ILE HB . . 4.200 2.710 2.357 3.715 . 0 0 "[ . 1 .]" 1
839 1 121 ILE H 1 121 ILE HG13 . . 3.400 2.907 2.325 3.673 0.273 6 0 "[ . 1 .]" 1
840 1 121 ILE H 1 122 GLY H . . 4.100 2.628 2.536 2.707 . 0 0 "[ . 1 .]" 1
841 1 121 ILE HA 1 122 GLY H . . 5.600 3.568 3.534 3.610 . 0 0 "[ . 1 .]" 1
842 1 121 ILE HA 1 124 SER H . . 5.600 3.500 3.399 3.671 . 0 0 "[ . 1 .]" 1
843 1 121 ILE HB 1 122 GLY H . . 5.100 2.838 2.478 3.902 . 0 0 "[ . 1 .]" 1
844 1 121 ILE MG 1 122 GLY H . . 5.600 3.499 3.042 4.000 . 0 0 "[ . 1 .]" 1
845 1 121 ILE O 1 125 LEU H . . 2.200 1.974 1.880 2.019 . 0 0 "[ . 1 .]" 1
846 1 121 ILE O 1 125 LEU N . . 3.200 2.975 2.910 3.033 . 0 0 "[ . 1 .]" 1
847 1 122 GLY H 1 123 HIS H . . 4.400 2.690 2.578 2.765 . 0 0 "[ . 1 .]" 1
848 1 122 GLY HA2 1 123 HIS H . . 5.600 3.501 3.485 3.517 . 0 0 "[ . 1 .]" 1
849 1 122 GLY HA2 1 125 LEU H . . 4.600 3.444 3.339 3.510 . 0 0 "[ . 1 .]" 1
850 1 122 GLY HA3 1 123 HIS H . . 5.600 2.875 2.836 2.919 . 0 0 "[ . 1 .]" 1
851 1 123 HIS H 1 124 SER H . . 5.600 2.629 2.550 2.690 . 0 0 "[ . 1 .]" 1
852 1 123 HIS H 1 125 LEU H . . 4.700 4.106 4.008 4.182 . 0 0 "[ . 1 .]" 1
853 1 123 HIS H 1 137 MET ME . . 5.100 2.756 2.175 3.344 . 0 0 "[ . 1 .]" 1
854 1 123 HIS HB2 1 124 SER H . . 5.600 2.960 2.822 3.052 . 0 0 "[ . 1 .]" 1
855 1 123 HIS HB2 1 125 LEU H . . 5.900 5.280 5.124 5.396 . 0 0 "[ . 1 .]" 1
856 1 123 HIS HB3 1 124 SER H . . 5.600 3.162 2.984 3.289 . 0 0 "[ . 1 .]" 1
857 1 123 HIS HD1 1 137 MET ME . . 4.400 3.047 2.167 3.808 . 0 0 "[ . 1 .]" 1
858 1 123 HIS HD2 1 137 MET ME . . 6.600 3.646 2.569 4.537 . 0 0 "[ . 1 .]" 1
859 1 123 HIS HE1 1 137 MET ME . . 3.900 3.485 2.565 4.014 0.114 5 0 "[ . 1 .]" 1
860 1 124 SER H 1 125 LEU H . . 5.600 2.564 2.499 2.655 . 0 0 "[ . 1 .]" 1
861 1 125 LEU H 1 125 LEU HA . . 3.100 2.878 2.702 3.034 . 0 0 "[ . 1 .]" 1
862 1 125 LEU H 1 125 LEU HB2 . . 3.600 3.218 2.547 3.854 0.254 1 0 "[ . 1 .]" 1
863 1 125 LEU H 1 125 LEU HB3 . . 4.100 3.230 2.545 3.690 . 0 0 "[ . 1 .]" 1
864 1 125 LEU H 1 125 LEU MD2 . . 3.900 2.839 2.077 3.484 . 0 0 "[ . 1 .]" 1
865 1 125 LEU H 1 125 LEU HG . . 2.700 2.276 1.882 2.673 . 0 0 "[ . 1 .]" 1
866 1 125 LEU H 1 126 GLY H . . 4.500 2.992 2.324 4.399 . 0 0 "[ . 1 .]" 1
867 1 126 GLY H 1 127 LEU H . . 5.600 3.773 1.946 4.588 . 0 0 "[ . 1 .]" 1
868 1 127 LEU H 1 127 LEU MD1 . . 5.000 3.066 1.913 4.620 . 0 0 "[ . 1 .]" 1
869 1 127 LEU H 1 127 LEU HG . . 4.000 2.970 2.007 4.005 0.005 8 0 "[ . 1 .]" 1
870 1 127 LEU HA 1 128 GLY H . . 4.000 2.984 2.273 3.645 . 0 0 "[ . 1 .]" 1
871 1 127 LEU MD1 1 128 GLY H . . 4.000 3.540 2.405 4.051 0.051 10 0 "[ . 1 .]" 1
872 1 127 LEU MD1 1 159 ILE H . . 3.900 3.902 3.804 3.965 0.065 8 0 "[ . 1 .]" 1
873 1 127 LEU MD1 1 161 SER H . . 6.600 5.829 5.274 6.544 . 0 0 "[ . 1 .]" 1
874 1 128 GLY H 1 129 HIS HA . . 5.600 5.205 4.381 5.665 0.065 1 0 "[ . 1 .]" 1
875 1 128 GLY HA3 1 129 HIS H . . 5.300 2.431 2.141 3.519 . 0 0 "[ . 1 .]" 1
876 1 129 HIS HA 1 130 SER H . . 3.900 2.920 2.399 3.639 . 0 0 "[ . 1 .]" 1
877 1 129 HIS HA 1 130 SER HA . . 5.600 4.498 4.234 4.888 . 0 0 "[ . 1 .]" 1
878 1 129 HIS HA 1 137 MET QB . . 5.600 2.762 1.933 4.766 . 0 0 "[ . 1 .]" 1
879 1 129 HIS QB 1 130 SER QB . . 6.400 3.982 3.389 4.427 . 0 0 "[ . 1 .]" 1
880 1 129 HIS HB2 1 130 SER H . . 5.600 2.694 2.052 3.474 . 0 0 "[ . 1 .]" 1
881 1 129 HIS HB2 1 138 PHE H . . 5.900 5.575 3.810 6.038 0.138 13 0 "[ . 1 .]" 1
882 1 129 HIS HD1 1 137 MET ME . . 5.900 4.506 2.989 5.947 0.047 11 0 "[ . 1 .]" 1
883 1 129 HIS HD2 1 130 SER H . . 5.600 5.078 4.394 5.612 0.012 10 0 "[ . 1 .]" 1
884 1 129 HIS HD2 1 137 MET ME . . 4.400 3.084 1.972 4.455 0.055 1 0 "[ . 1 .]" 1
885 1 130 SER H 1 131 SER H . . 2.900 2.181 1.872 2.867 . 0 0 "[ . 1 .]" 1
886 1 130 SER H 1 131 SER HA . . 5.600 4.257 3.760 4.917 . 0 0 "[ . 1 .]" 1
887 1 130 SER H 1 138 PHE HA . . 4.200 3.714 2.813 4.178 . 0 0 "[ . 1 .]" 1
888 1 130 SER HA 1 132 ASP H . . 4.700 4.449 4.132 4.774 0.074 14 0 "[ . 1 .]" 1
889 1 130 SER OG 1 132 ASP H . . 2.200 2.145 2.017 2.256 0.056 14 0 "[ . 1 .]" 1
890 1 130 SER OG 1 132 ASP N . . 3.200 3.063 2.868 3.240 0.040 14 0 "[ . 1 .]" 1
891 1 131 SER H 1 132 ASP H . . 2.700 2.446 1.901 2.808 0.108 5 0 "[ . 1 .]" 1
892 1 131 SER H 1 138 PHE HA . . 4.900 3.549 2.557 4.681 . 0 0 "[ . 1 .]" 1
893 1 131 SER HA 1 132 ASP H . . 5.200 3.192 2.961 3.561 . 0 0 "[ . 1 .]" 1
894 1 132 ASP H 1 133 PRO HD3 . . 5.600 4.638 4.349 4.875 . 0 0 "[ . 1 .]" 1
895 1 132 ASP H 1 135 ALA MB . . 5.900 2.843 2.095 3.405 . 0 0 "[ . 1 .]" 1
896 1 132 ASP H 1 138 PHE HA . . 5.600 4.660 3.730 5.725 0.125 13 0 "[ . 1 .]" 1
897 1 132 ASP H 1 138 PHE QD . . 4.400 3.965 3.072 4.459 0.059 1 0 "[ . 1 .]" 1
898 1 132 ASP HA 1 134 LYS H . . 4.800 4.363 3.836 4.865 0.065 1 0 "[ . 1 .]" 1
899 1 132 ASP HB2 1 135 ALA MB . . 4.600 3.486 2.335 4.517 . 0 0 "[ . 1 .]" 1
900 1 132 ASP HB3 1 135 ALA MB . . 4.900 4.223 2.481 4.879 . 0 0 "[ . 1 .]" 1
901 1 132 ASP O 1 135 ALA H . . 2.400 2.064 1.791 2.410 0.010 7 0 "[ . 1 .]" 1
902 1 132 ASP O 1 135 ALA N . . 3.300 3.003 2.761 3.337 0.037 8 0 "[ . 1 .]" 1
903 1 133 PRO HA 1 138 PHE HB2 . . 4.400 3.740 2.795 4.417 0.017 1 0 "[ . 1 .]" 1
904 1 133 PRO HA 1 138 PHE HB3 . . 4.400 3.844 2.000 4.428 0.028 13 0 "[ . 1 .]" 1
905 1 133 PRO HB3 1 134 LYS HB3 . . 6.100 5.897 5.523 6.129 0.029 2 0 "[ . 1 .]" 1
906 1 134 LYS H 1 134 LYS HB3 . . 3.600 3.080 2.601 3.721 0.121 10 0 "[ . 1 .]" 1
907 1 134 LYS H 1 134 LYS HG3 . . 3.700 2.640 2.046 3.754 0.054 4 0 "[ . 1 .]" 1
908 1 134 LYS H 1 135 ALA H . . 3.400 2.473 1.837 3.093 . 0 0 "[ . 1 .]" 1
909 1 134 LYS HA 1 135 ALA H . . 4.000 3.492 3.227 3.600 . 0 0 "[ . 1 .]" 1
910 1 134 LYS HE3 1 135 ALA H . . 3.800 3.546 2.801 3.912 0.112 6 0 "[ . 1 .]" 1
911 1 134 LYS HG3 1 135 ALA H . . 5.600 2.626 2.077 3.480 . 0 0 "[ . 1 .]" 1
912 1 135 ALA H 1 138 PHE H . . 4.900 4.541 4.177 4.820 . 0 0 "[ . 1 .]" 1
913 1 135 ALA HA 1 136 VAL H . . 3.400 2.143 2.093 2.267 . 0 0 "[ . 1 .]" 1
914 1 135 ALA HA 1 137 MET H . . 5.600 4.132 3.400 5.079 . 0 0 "[ . 1 .]" 1
915 1 135 ALA HA 1 151 LEU HA . . 5.600 4.832 2.550 5.522 . 0 0 "[ . 1 .]" 1
916 1 135 ALA HA 1 155 ASP QB . . 4.900 3.845 2.559 4.631 . 0 0 "[ . 1 .]" 1
917 1 135 ALA MB 1 136 VAL H . . 4.400 3.149 2.918 3.343 . 0 0 "[ . 1 .]" 1
918 1 135 ALA MB 1 137 MET H . . 4.800 3.009 2.271 4.135 . 0 0 "[ . 1 .]" 1
919 1 135 ALA MB 1 138 PHE H . . 3.900 2.786 2.038 3.480 . 0 0 "[ . 1 .]" 1
920 1 135 ALA MB 1 154 ASP QB . . 7.100 6.726 5.424 7.134 0.034 13 0 "[ . 1 .]" 1
921 1 135 ALA MB 1 155 ASP QB . . 6.100 3.926 3.052 4.524 . 0 0 "[ . 1 .]" 1
922 1 135 ALA O 1 138 PHE H . . 2.300 2.130 1.834 2.274 . 0 0 "[ . 1 .]" 1
923 1 135 ALA O 1 138 PHE N . . 3.200 3.107 2.854 3.258 0.058 11 0 "[ . 1 .]" 1
924 1 136 VAL H 1 137 MET H . . 4.200 3.223 2.528 4.145 . 0 0 "[ . 1 .]" 1
925 1 136 VAL H 1 138 PHE H . . 4.900 4.545 4.135 4.928 0.028 1 0 "[ . 1 .]" 1
926 1 136 VAL H 1 151 LEU HA . . 4.900 3.823 2.600 4.732 . 0 0 "[ . 1 .]" 1
927 1 136 VAL HA 1 137 MET H . . 4.400 2.831 2.202 3.401 . 0 0 "[ . 1 .]" 1
928 1 136 VAL HB 1 151 LEU HA . . 4.400 3.301 2.097 4.374 . 0 0 "[ . 1 .]" 1
929 1 136 VAL HB 1 151 LEU MD1 . . 4.200 4.058 3.714 4.271 0.071 15 0 "[ . 1 .]" 1
930 1 136 VAL MG1 1 137 MET H . . 6.200 3.331 2.790 4.132 . 0 0 "[ . 1 .]" 1
931 1 136 VAL MG1 1 149 PHE HA . . 6.400 5.792 4.913 6.515 0.115 13 0 "[ . 1 .]" 1
932 1 136 VAL MG1 1 149 PHE QD . . 5.600 4.010 2.376 5.014 . 0 0 "[ . 1 .]" 1
933 1 136 VAL MG1 1 149 PHE QE . . 5.600 2.690 1.992 3.630 . 0 0 "[ . 1 .]" 1
934 1 136 VAL MG1 1 151 LEU MD1 . . 6.200 3.604 2.928 4.376 . 0 0 "[ . 1 .]" 1
935 1 136 VAL MG2 1 137 MET H . . 5.700 4.300 3.698 4.454 . 0 0 "[ . 1 .]" 1
936 1 136 VAL MG2 1 151 LEU MD1 . . 6.100 2.714 1.928 4.147 . 0 0 "[ . 1 .]" 1
937 1 137 MET H 1 138 PHE H . . 3.400 2.061 1.766 2.569 . 0 0 "[ . 1 .]" 1
938 1 137 MET HA 1 138 PHE H . . 4.000 3.328 2.896 3.600 . 0 0 "[ . 1 .]" 1
939 1 138 PHE H 1 138 PHE QD . . 4.900 2.992 2.130 3.996 . 0 0 "[ . 1 .]" 1
940 1 138 PHE QE 1 140 THR H . . 7.800 4.295 3.355 5.230 . 0 0 "[ . 1 .]" 1
941 1 138 PHE QE 1 140 THR HB . . 7.800 2.952 2.065 3.978 . 0 0 "[ . 1 .]" 1
942 1 139 PRO HA 1 140 THR H . . 4.400 3.640 3.533 3.718 . 0 0 "[ . 1 .]" 1
943 1 139 PRO HB2 1 140 THR H . . 5.600 2.622 2.258 3.477 . 0 0 "[ . 1 .]" 1
944 1 140 THR HA 1 141 TYR H . . 2.700 2.199 2.146 2.279 . 0 0 "[ . 1 .]" 1
945 1 140 THR HB 1 141 TYR H . . 4.600 4.159 3.478 4.630 0.030 12 0 "[ . 1 .]" 1
946 1 140 THR MG 1 141 TYR H . . 4.200 2.782 2.258 3.311 . 0 0 "[ . 1 .]" 1
947 1 141 TYR H 1 141 TYR HB3 . . 3.800 2.433 2.238 2.661 . 0 0 "[ . 1 .]" 1
948 1 141 TYR HA 1 142 LYS H . . 2.700 2.228 2.095 2.423 . 0 0 "[ . 1 .]" 1
949 1 141 TYR HB2 1 142 LYS H . . 4.900 4.127 3.720 4.601 . 0 0 "[ . 1 .]" 1
950 1 141 TYR QD 1 143 TYR H . . 3.700 3.516 3.012 3.734 0.034 7 0 "[ . 1 .]" 1
951 1 141 TYR QD 1 143 TYR HA . . 5.600 4.930 3.788 5.553 . 0 0 "[ . 1 .]" 1
952 1 142 LYS HA 1 142 LYS HG2 . . 4.400 2.820 2.526 3.523 . 0 0 "[ . 1 .]" 1
953 1 142 LYS HA 1 143 TYR H . . 3.400 2.142 2.053 2.225 . 0 0 "[ . 1 .]" 1
954 1 142 LYS HB2 1 143 TYR H . . 4.400 4.336 3.979 4.487 0.087 14 0 "[ . 1 .]" 1
955 1 142 LYS HB3 1 143 TYR H . . 5.800 4.525 4.404 4.652 . 0 0 "[ . 1 .]" 1
956 1 142 LYS HD2 1 142 LYS HG3 . . 2.700 2.720 2.554 2.835 0.135 6 0 "[ . 1 .]" 1
957 1 142 LYS HE2 1 142 LYS HG2 . . 3.700 2.747 2.384 2.955 . 0 0 "[ . 1 .]" 1
958 1 142 LYS HE2 1 142 LYS HG3 . . 2.700 2.579 2.407 2.786 0.086 11 0 "[ . 1 .]" 1
959 1 142 LYS HE2 1 144 VAL MG2 . . 5.600 4.745 3.161 5.636 0.036 11 0 "[ . 1 .]" 1
960 1 142 LYS HE3 1 142 LYS HG2 . . 3.700 3.590 3.337 3.752 0.052 10 0 "[ . 1 .]" 1
961 1 142 LYS HE3 1 142 LYS HG3 . . 2.700 2.669 2.405 2.820 0.120 13 0 "[ . 1 .]" 1
962 1 142 LYS HE3 1 144 VAL MG1 . . 5.000 4.677 3.753 5.158 0.158 13 0 "[ . 1 .]" 1
963 1 142 LYS HG2 1 143 TYR H . . 3.700 3.469 3.105 3.777 0.077 11 0 "[ . 1 .]" 1
964 1 143 TYR H 1 143 TYR HB3 . . 4.100 2.829 2.318 3.025 . 0 0 "[ . 1 .]" 1
965 1 143 TYR H 1 144 VAL H . . 5.600 4.524 4.438 4.600 . 0 0 "[ . 1 .]" 1
966 1 143 TYR HA 1 144 VAL H . . 2.700 2.136 2.086 2.203 . 0 0 "[ . 1 .]" 1
967 1 143 TYR HA 1 144 VAL MG1 . . 5.800 3.916 3.473 4.667 . 0 0 "[ . 1 .]" 1
968 1 143 TYR HA 1 145 ASP H . . 5.600 4.202 3.395 5.865 0.265 14 0 "[ . 1 .]" 1
969 1 143 TYR HB2 1 144 VAL H . . 4.900 3.529 3.194 3.659 . 0 0 "[ . 1 .]" 1
970 1 143 TYR HB3 1 144 VAL H . . 4.900 4.139 3.928 4.404 . 0 0 "[ . 1 .]" 1
971 1 143 TYR QD 1 146 ILE MD . . 8.700 7.832 6.115 8.747 0.047 14 0 "[ . 1 .]" 1
972 1 144 VAL HA 1 145 ASP H . . 4.100 2.938 2.159 3.461 . 0 0 "[ . 1 .]" 1
973 1 144 VAL HB 1 145 ASP H . . 4.400 4.378 3.936 4.542 0.142 9 0 "[ . 1 .]" 1
974 1 144 VAL MG1 1 145 ASP H . . 5.700 3.792 2.593 4.517 . 0 0 "[ . 1 .]" 1
975 1 144 VAL MG1 1 149 PHE H . . 6.600 4.189 2.900 5.657 . 0 0 "[ . 1 .]" 1
976 1 144 VAL MG1 1 149 PHE HA . . 4.200 3.520 2.825 4.207 0.007 11 0 "[ . 1 .]" 1
977 1 144 VAL MG1 1 149 PHE HB3 . . 6.600 4.639 1.964 6.495 . 0 0 "[ . 1 .]" 1
978 1 144 VAL MG1 1 149 PHE QE . . 5.600 5.081 4.038 5.649 0.049 11 0 "[ . 1 .]" 1
979 1 144 VAL MG1 1 150 ARG H . . 5.100 4.993 4.679 5.175 0.075 14 0 "[ . 1 .]" 1
980 1 144 VAL MG2 1 146 ILE HA . . 4.700 3.643 2.877 4.741 0.041 6 0 "[ . 1 .]" 1
981 1 144 VAL MG2 1 150 ARG H . . 4.800 4.517 3.562 4.828 0.028 4 0 "[ . 1 .]" 1
982 1 145 ASP HA 1 146 ILE H . . 4.100 2.815 2.091 3.406 . 0 0 "[ . 1 .]" 1
983 1 145 ASP HA 1 147 ASN H . . 4.900 4.060 3.582 4.399 . 0 0 "[ . 1 .]" 1
984 1 145 ASP HB3 1 146 ILE H . . 5.600 4.036 3.573 4.709 . 0 0 "[ . 1 .]" 1
985 1 145 ASP OD2 1 147 ASN H . . 2.200 3.544 1.837 4.242 2.042 3 14 "[**+*- *********]" 1
986 1 145 ASP OD2 1 147 ASN N . . 3.200 4.429 2.835 5.140 1.940 3 14 "[*-+** *********]" 1
987 1 146 ILE H 1 146 ILE HB . . 4.100 3.427 2.645 3.885 . 0 0 "[ . 1 .]" 1
988 1 146 ILE H 1 146 ILE HG12 . . 3.900 3.774 3.501 3.952 0.052 6 0 "[ . 1 .]" 1
989 1 146 ILE H 1 146 ILE HG13 . . 3.700 2.676 2.052 3.222 . 0 0 "[ . 1 .]" 1
990 1 146 ILE H 1 147 ASN H . . 3.400 2.673 2.021 3.283 . 0 0 "[ . 1 .]" 1
991 1 146 ILE H 1 147 ASN HB3 . . 5.600 5.555 5.226 5.667 0.067 9 0 "[ . 1 .]" 1
992 1 146 ILE H 1 148 THR H . . 5.600 3.844 3.308 4.395 . 0 0 "[ . 1 .]" 1
993 1 146 ILE HA 1 146 ILE HG13 . . 2.900 2.825 2.491 2.988 0.088 10 0 "[ . 1 .]" 1
994 1 146 ILE HA 1 147 ASN H . . 3.900 3.412 3.197 3.586 . 0 0 "[ . 1 .]" 1
995 1 146 ILE HA 1 149 PHE H . . 3.900 2.947 2.654 3.414 . 0 0 "[ . 1 .]" 1
996 1 146 ILE HA 1 149 PHE HB2 . . 4.100 2.353 2.001 4.058 . 0 0 "[ . 1 .]" 1
997 1 146 ILE HA 1 149 PHE HB3 . . 4.900 2.517 2.043 3.592 . 0 0 "[ . 1 .]" 1
998 1 146 ILE HB 1 147 ASN H . . 5.600 3.244 2.614 3.724 . 0 0 "[ . 1 .]" 1
999 1 146 ILE HG12 1 147 ASN H . . 5.600 5.261 5.009 5.453 . 0 0 "[ . 1 .]" 1
1000 1 146 ILE HG13 1 147 ASN H . . 5.600 4.400 4.046 4.731 . 0 0 "[ . 1 .]" 1
1001 1 146 ILE HG13 1 148 THR H . . 6.000 5.882 5.548 6.134 0.134 13 0 "[ . 1 .]" 1
1002 1 146 ILE MG 1 147 ASN H . . 6.000 4.085 3.734 4.285 . 0 0 "[ . 1 .]" 1
1003 1 147 ASN H 1 147 ASN HB2 . . 3.500 2.219 2.096 2.763 . 0 0 "[ . 1 .]" 1
1004 1 147 ASN H 1 148 THR H . . 3.600 2.640 2.334 2.909 . 0 0 "[ . 1 .]" 1
1005 1 147 ASN HA 1 148 THR H . . 4.400 3.491 3.341 3.588 . 0 0 "[ . 1 .]" 1
1006 1 147 ASN HB2 1 148 THR H . . 3.700 3.448 3.072 3.759 0.059 12 0 "[ . 1 .]" 1
1007 1 147 ASN HB2 1 148 THR MG . . 4.500 3.897 3.165 4.508 0.008 15 0 "[ . 1 .]" 1
1008 1 147 ASN HB3 1 148 THR H . . 4.800 3.177 2.611 4.248 . 0 0 "[ . 1 .]" 1
1009 1 147 ASN HB3 1 148 THR MG . . 6.600 2.870 2.294 5.339 . 0 0 "[ . 1 .]" 1
1010 1 148 THR H 1 149 PHE H . . 3.700 2.101 1.936 2.468 . 0 0 "[ . 1 .]" 1
1011 1 148 THR H 1 149 PHE HA . . 4.500 4.547 4.388 4.724 0.224 6 0 "[ . 1 .]" 1
1012 1 148 THR HA 1 149 PHE H . . 3.900 3.316 3.167 3.491 . 0 0 "[ . 1 .]" 1
1013 1 148 THR HB 1 149 PHE H . . 5.600 4.265 3.277 4.670 . 0 0 "[ . 1 .]" 1
1014 1 148 THR MG 1 149 PHE H . . 6.100 4.039 3.520 4.399 . 0 0 "[ . 1 .]" 1
1015 1 149 PHE H 1 150 ARG H . . 4.100 4.045 2.701 4.321 0.221 12 0 "[ . 1 .]" 1
1016 1 149 PHE HA 1 149 PHE QE . . 5.600 4.798 4.465 5.593 . 0 0 "[ . 1 .]" 1
1017 1 149 PHE HA 1 150 ARG H . . 3.000 2.367 2.196 3.114 0.114 14 0 "[ . 1 .]" 1
1018 1 149 PHE HB2 1 150 ARG H . . 5.600 4.434 2.156 4.675 . 0 0 "[ . 1 .]" 1
1019 1 149 PHE QD 1 151 LEU MD1 . . 5.600 3.272 2.607 4.390 . 0 0 "[ . 1 .]" 1
1020 1 149 PHE QE 1 150 ARG HA . . 7.800 5.011 3.662 6.191 . 0 0 "[ . 1 .]" 1
1021 1 150 ARG H 1 150 ARG HD3 . . 4.300 4.279 4.214 4.430 0.130 14 0 "[ . 1 .]" 1
1022 1 150 ARG H 1 150 ARG HG2 . . 5.600 4.585 4.488 4.651 . 0 0 "[ . 1 .]" 1
1023 1 150 ARG H 1 151 LEU H . . 5.600 4.457 4.097 4.585 . 0 0 "[ . 1 .]" 1
1024 1 150 ARG H 1 151 LEU MD1 . . 5.600 4.223 3.700 5.209 . 0 0 "[ . 1 .]" 1
1025 1 150 ARG HA 1 150 ARG HD3 . . 3.900 3.981 3.929 4.051 0.151 14 0 "[ . 1 .]" 1
1026 1 150 ARG HA 1 150 ARG HG2 . . 4.300 2.503 2.454 2.791 . 0 0 "[ . 1 .]" 1
1027 1 150 ARG HA 1 150 ARG HG3 . . 3.800 3.449 3.398 3.668 . 0 0 "[ . 1 .]" 1
1028 1 150 ARG HA 1 151 LEU H . . 5.600 2.237 2.148 2.344 . 0 0 "[ . 1 .]" 1
1029 1 150 ARG HB2 1 150 ARG HD3 . . 4.400 3.640 3.599 3.699 . 0 0 "[ . 1 .]" 1
1030 1 150 ARG HB2 1 151 LEU H . . 3.900 3.961 3.751 4.043 0.143 3 0 "[ . 1 .]" 1
1031 1 150 ARG HB3 1 150 ARG HD2 . . 2.900 2.662 2.488 2.716 . 0 0 "[ . 1 .]" 1
1032 1 150 ARG HB3 1 150 ARG HD3 . . 3.500 2.390 2.326 2.557 . 0 0 "[ . 1 .]" 1
1033 1 150 ARG HD2 1 152 SER H . . 5.600 5.708 5.647 5.828 0.228 14 0 "[ . 1 .]" 1
1034 1 150 ARG HD3 1 150 ARG HG2 . . 2.700 2.741 2.696 2.779 0.079 14 0 "[ . 1 .]" 1
1035 1 150 ARG HG2 1 151 LEU HA . . 4.300 4.430 4.203 4.544 0.244 13 0 "[ . 1 .]" 1
1036 1 150 ARG HG2 1 152 SER H . . 5.600 5.492 5.285 5.613 0.013 1 0 "[ . 1 .]" 1
1037 1 151 LEU H 1 151 LEU MD2 . . 4.100 2.511 1.886 4.053 . 0 0 "[ . 1 .]" 1
1038 1 151 LEU H 1 151 LEU HG . . 3.600 3.560 2.473 3.762 0.162 13 0 "[ . 1 .]" 1
1039 1 151 LEU HA 1 152 SER H . . 5.600 2.177 2.117 2.217 . 0 0 "[ . 1 .]" 1
1040 1 151 LEU MD2 1 156 ILE HA . . 5.800 5.433 4.034 5.810 0.010 9 0 "[ . 1 .]" 1
1041 1 151 LEU MD2 1 156 ILE MD . . 6.400 3.164 2.522 4.925 . 0 0 "[ . 1 .]" 1
1042 1 151 LEU MD2 1 156 ILE HG12 . . 6.800 3.992 3.371 4.723 . 0 0 "[ . 1 .]" 1
1043 1 151 LEU MD2 1 156 ILE HG13 . . 5.600 5.131 4.628 5.635 0.035 3 0 "[ . 1 .]" 1
1044 1 151 LEU MD2 1 156 ILE MG . . 7.800 2.465 1.909 2.697 . 0 0 "[ . 1 .]" 1
1045 1 152 SER HA 1 153 ALA H . . 5.600 2.211 2.158 2.327 . 0 0 "[ . 1 .]" 1
1046 1 152 SER HB2 1 153 ALA H . . 4.300 3.809 3.155 4.334 0.034 2 0 "[ . 1 .]" 1
1047 1 152 SER O 1 156 ILE H . . 2.200 1.967 1.923 2.039 . 0 0 "[ . 1 .]" 1
1048 1 152 SER O 1 156 ILE N . . 3.300 2.968 2.930 3.033 . 0 0 "[ . 1 .]" 1
1049 1 153 ALA HA 1 156 ILE MD . . 6.600 2.194 1.936 2.415 . 0 0 "[ . 1 .]" 1
1050 1 153 ALA HA 1 156 ILE HG12 . . 5.100 2.229 2.068 2.760 . 0 0 "[ . 1 .]" 1
1051 1 153 ALA HA 1 156 ILE MG . . 5.700 4.003 3.769 4.407 . 0 0 "[ . 1 .]" 1
1052 1 153 ALA MB 1 154 ASP H . . 6.600 2.623 2.498 2.730 . 0 0 "[ . 1 .]" 1
1053 1 153 ALA MB 1 156 ILE HG12 . . 4.600 3.951 3.809 4.384 . 0 0 "[ . 1 .]" 1
1054 1 153 ALA MB 1 156 ILE HG13 . . 5.800 3.977 3.782 4.282 . 0 0 "[ . 1 .]" 1
1055 1 153 ALA O 1 157 ARG H . . 2.200 1.851 1.739 2.060 . 0 0 "[ . 1 .]" 1
1056 1 153 ALA O 1 157 ARG N . . 3.200 2.724 2.607 2.922 . 0 0 "[ . 1 .]" 1
1057 1 154 ASP H 1 154 ASP HB2 . . 4.400 2.245 2.090 2.647 . 0 0 "[ . 1 .]" 1
1058 1 154 ASP H 1 154 ASP HB3 . . 3.600 3.351 2.892 3.596 . 0 0 "[ . 1 .]" 1
1059 1 154 ASP H 1 155 ASP H . . 4.500 2.668 2.513 2.745 . 0 0 "[ . 1 .]" 1
1060 1 154 ASP HB2 1 155 ASP H . . 4.400 3.115 2.672 3.661 . 0 0 "[ . 1 .]" 1
1061 1 154 ASP O 1 157 ARG H . . 3.500 3.003 2.937 3.076 . 0 0 "[ . 1 .]" 1
1062 1 154 ASP O 1 157 ARG N . . 3.500 3.504 3.502 3.508 0.008 12 0 "[ . 1 .]" 1
1063 1 154 ASP O 1 158 GLY H . . 2.200 1.938 1.835 2.120 . 0 0 "[ . 1 .]" 1
1064 1 154 ASP O 1 158 GLY N . . 3.200 2.789 2.708 2.980 . 0 0 "[ . 1 .]" 1
1065 1 155 ASP H 1 156 ILE H . . 3.600 2.723 2.609 2.775 . 0 0 "[ . 1 .]" 1
1066 1 155 ASP HB3 1 156 ILE H . . 3.500 2.446 2.261 2.991 . 0 0 "[ . 1 .]" 1
1067 1 155 ASP O 1 159 ILE H . . 2.300 2.280 2.244 2.302 0.002 1 0 "[ . 1 .]" 1
1068 1 155 ASP O 1 159 ILE N . . 3.300 3.260 3.233 3.281 . 0 0 "[ . 1 .]" 1
1069 1 156 ILE H 1 156 ILE MD . . 4.800 3.777 3.597 3.872 . 0 0 "[ . 1 .]" 1
1070 1 156 ILE H 1 156 ILE HG12 . . 2.700 2.181 2.109 2.332 . 0 0 "[ . 1 .]" 1
1071 1 156 ILE H 1 156 ILE HG13 . . 2.900 2.845 2.042 3.107 0.207 1 0 "[ . 1 .]" 1
1072 1 156 ILE H 1 156 ILE MG . . 3.900 2.380 2.198 2.786 . 0 0 "[ . 1 .]" 1
1073 1 156 ILE H 1 157 ARG H . . 5.600 2.629 2.581 2.708 . 0 0 "[ . 1 .]" 1
1074 1 156 ILE HA 1 156 ILE HG13 . . 3.600 3.707 3.572 3.759 0.159 14 0 "[ . 1 .]" 1
1075 1 156 ILE HA 1 157 ARG H . . 5.600 3.526 3.510 3.540 . 0 0 "[ . 1 .]" 1
1076 1 156 ILE HA 1 159 ILE H . . 5.600 3.636 3.513 3.759 . 0 0 "[ . 1 .]" 1
1077 1 156 ILE HA 1 159 ILE MG . . 5.100 2.616 2.355 3.432 . 0 0 "[ . 1 .]" 1
1078 1 156 ILE MD 1 160 GLN HE21 . . 3.900 3.853 3.504 3.896 . 0 0 "[ . 1 .]" 1
1079 1 156 ILE HG13 1 158 GLY H . . 5.600 4.558 4.427 4.689 . 0 0 "[ . 1 .]" 1
1080 1 156 ILE O 1 160 GLN H . . 2.300 2.229 2.198 2.289 . 0 0 "[ . 1 .]" 1
1081 1 156 ILE O 1 160 GLN N . . 3.200 3.189 3.166 3.210 0.010 14 0 "[ . 1 .]" 1
1082 1 157 ARG H 1 157 ARG HB2 . . 3.000 2.364 2.304 2.426 . 0 0 "[ . 1 .]" 1
1083 1 157 ARG H 1 157 ARG HB3 . . 3.900 3.604 3.573 3.648 . 0 0 "[ . 1 .]" 1
1084 1 157 ARG H 1 157 ARG HG3 . . 2.700 2.704 2.580 2.790 0.090 13 0 "[ . 1 .]" 1
1085 1 157 ARG H 1 158 GLY H . . 5.600 2.525 2.467 2.678 . 0 0 "[ . 1 .]" 1
1086 1 157 ARG HA 1 159 ILE H . . 5.600 4.599 4.398 5.006 . 0 0 "[ . 1 .]" 1
1087 1 157 ARG HB3 1 158 GLY H . . 4.000 3.693 3.398 3.794 . 0 0 "[ . 1 .]" 1
1088 1 157 ARG O 1 161 SER H . . 2.200 2.021 1.775 2.200 0.000 11 0 "[ . 1 .]" 1
1089 1 157 ARG O 1 161 SER N . . 3.200 2.812 2.595 3.105 . 0 0 "[ . 1 .]" 1
1090 1 158 GLY H 1 159 ILE H . . 5.600 2.666 2.541 2.828 . 0 0 "[ . 1 .]" 1
1091 1 158 GLY H 1 159 ILE HG12 . . 5.600 4.623 3.854 4.768 . 0 0 "[ . 1 .]" 1
1092 1 158 GLY HA2 1 160 GLN H . . 5.600 4.548 4.279 4.621 . 0 0 "[ . 1 .]" 1
1093 1 158 GLY HA2 1 161 SER H . . 4.900 3.418 3.196 3.495 . 0 0 "[ . 1 .]" 1
1094 1 159 ILE H 1 159 ILE MD . . 5.100 3.848 3.643 3.917 . 0 0 "[ . 1 .]" 1
1095 1 159 ILE H 1 159 ILE HG12 . . 2.700 2.712 2.100 2.800 0.100 1 0 "[ . 1 .]" 1
1096 1 159 ILE H 1 159 ILE MG . . 3.900 2.026 1.969 2.135 . 0 0 "[ . 1 .]" 1
1097 1 159 ILE H 1 161 SER H . . 4.700 3.857 3.754 4.222 . 0 0 "[ . 1 .]" 1
1098 1 159 ILE HA 1 160 GLN H . . 5.600 3.550 3.490 3.581 . 0 0 "[ . 1 .]" 1
1099 1 159 ILE HB 1 160 GLN H . . 4.600 3.900 3.611 3.996 . 0 0 "[ . 1 .]" 1
1100 1 159 ILE MD 1 160 GLN H . . 3.900 3.630 3.564 3.767 . 0 0 "[ . 1 .]" 1
1101 1 159 ILE MD 1 163 TYR QE . . 4.400 4.107 3.174 4.373 . 0 0 "[ . 1 .]" 1
1102 1 159 ILE HG12 1 160 GLN H . . 3.000 2.041 1.930 2.533 . 0 0 "[ . 1 .]" 1
1103 1 159 ILE MG 1 163 TYR QE . . 5.700 5.090 4.450 5.691 . 0 0 "[ . 1 .]" 1
1104 1 160 GLN H 1 160 GLN HG2 . . 3.700 2.823 2.054 3.057 . 0 0 "[ . 1 .]" 1
1105 1 160 GLN H 1 160 GLN HG3 . . 3.000 2.261 1.942 3.182 0.182 11 0 "[ . 1 .]" 1
1106 1 160 GLN H 1 161 SER H . . 5.600 2.501 2.423 2.629 . 0 0 "[ . 1 .]" 1
1107 1 160 GLN H 1 161 SER HB3 . . 5.600 4.642 4.327 4.900 . 0 0 "[ . 1 .]" 1
1108 1 160 GLN HB2 1 161 SER H . . 4.600 4.012 3.792 4.205 . 0 0 "[ . 1 .]" 1
1109 1 160 GLN HB3 1 161 SER H . . 5.600 4.131 3.979 4.250 . 0 0 "[ . 1 .]" 1
1110 1 161 SER H 1 161 SER HB3 . . 3.400 2.366 2.135 2.612 . 0 0 "[ . 1 .]" 1
1111 1 161 SER H 1 162 LEU H . . 5.600 2.580 2.460 2.750 . 0 0 "[ . 1 .]" 1
1112 1 161 SER HB3 1 162 LEU H . . 5.600 3.011 2.617 3.643 . 0 0 "[ . 1 .]" 1
1113 1 162 LEU H 1 162 LEU HG . . 3.700 3.468 2.476 3.778 0.078 11 0 "[ . 1 .]" 1
1114 1 162 LEU H 1 163 TYR H . . 5.600 3.089 2.236 4.235 . 0 0 "[ . 1 .]" 1
1115 1 162 LEU HA 1 162 LEU QD . . 4.200 2.651 2.089 3.436 . 0 0 "[ . 1 .]" 1
1116 1 162 LEU HA 1 162 LEU HG . . 3.400 2.569 2.144 3.567 0.167 14 0 "[ . 1 .]" 1
1117 1 162 LEU QD 1 163 TYR QE . . 6.300 3.424 2.090 5.863 . 0 0 "[ . 1 .]" 1
1118 1 163 TYR H 1 163 TYR HB2 . . 4.000 3.510 2.588 3.707 . 0 0 "[ . 1 .]" 1
1119 1 163 TYR H 1 163 TYR HB3 . . 3.400 3.460 2.965 3.709 0.309 11 0 "[ . 1 .]" 1
1120 1 163 TYR H 1 163 TYR QE . . 5.000 3.798 3.575 4.631 . 0 0 "[ . 1 .]" 1
1121 1 163 TYR H 1 164 GLY H . . 4.500 3.438 2.422 4.636 0.136 8 0 "[ . 1 .]" 1
1122 1 163 TYR HA 1 164 GLY H . . 5.600 2.740 2.167 3.650 . 0 0 "[ . 1 .]" 1
1123 1 163 TYR HB2 1 164 GLY H . . 4.700 3.910 2.056 4.485 . 0 0 "[ . 1 .]" 1
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