NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
641845 |
5iq5   |
30043 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5iq5
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 1510
_Distance_constraint_stats_list.Viol_count 671
_Distance_constraint_stats_list.Viol_total 564.114
_Distance_constraint_stats_list.Viol_max 0.200
_Distance_constraint_stats_list.Viol_rms 0.0074
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0400
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 PRO 0.031 0.021 2 0 "[ . 1 . 2 ]"
1 4 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 5 TYR 0.461 0.135 21 0 "[ . 1 . 2 ]"
1 6 THR 1.766 0.111 13 0 "[ . 1 . 2 ]"
1 7 VAL 1.006 0.076 5 0 "[ . 1 . 2 ]"
1 8 LYS 0.334 0.089 12 0 "[ . 1 . 2 ]"
1 9 ARG 0.326 0.059 9 0 "[ . 1 . 2 ]"
1 10 ALA 1.261 0.120 19 0 "[ . 1 . 2 ]"
1 11 ASP 0.167 0.065 4 0 "[ . 1 . 2 ]"
1 12 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 13 ALA 0.611 0.103 21 0 "[ . 1 . 2 ]"
1 14 THR 0.409 0.103 21 0 "[ . 1 . 2 ]"
1 15 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 16 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 17 GLU 0.172 0.048 7 0 "[ . 1 . 2 ]"
1 18 ASP 0.138 0.048 7 0 "[ . 1 . 2 ]"
1 19 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 20 VAL 0.026 0.026 7 0 "[ . 1 . 2 ]"
1 21 VAL 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 22 ASN 0.710 0.111 7 0 "[ . 1 . 2 ]"
1 23 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 24 ALA 0.018 0.018 14 0 "[ . 1 . 2 ]"
1 25 ASN 0.194 0.051 4 0 "[ . 1 . 2 ]"
1 26 HIS 1.108 0.110 12 0 "[ . 1 . 2 ]"
1 27 ARG 1.346 0.122 4 0 "[ . 1 . 2 ]"
1 28 GLY 1.102 0.110 12 0 "[ . 1 . 2 ]"
1 29 GLN 0.868 0.122 4 0 "[ . 1 . 2 ]"
1 30 VAL 0.142 0.094 10 0 "[ . 1 . 2 ]"
1 34 VAL 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 38 VAL 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 40 ARG 0.006 0.006 10 0 "[ . 1 . 2 ]"
1 41 LYS 0.018 0.018 12 0 "[ . 1 . 2 ]"
1 42 TRP 0.128 0.064 18 0 "[ . 1 . 2 ]"
1 43 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 44 GLN 0.022 0.022 20 0 "[ . 1 . 2 ]"
1 45 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 46 PHE 0.163 0.094 10 0 "[ . 1 . 2 ]"
1 47 ARG 0.917 0.111 8 0 "[ . 1 . 2 ]"
1 48 ASN 0.957 0.111 8 0 "[ . 1 . 2 ]"
1 49 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 50 ALA 1.086 0.099 21 0 "[ . 1 . 2 ]"
1 51 THR 0.667 0.099 21 0 "[ . 1 . 2 ]"
1 52 PRO 0.086 0.048 8 0 "[ . 1 . 2 ]"
1 53 VAL 0.023 0.023 16 0 "[ . 1 . 2 ]"
1 54 GLY 0.179 0.179 16 0 "[ . 1 . 2 ]"
1 55 THR 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 56 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 57 LYS 0.385 0.111 13 0 "[ . 1 . 2 ]"
1 58 THR 0.199 0.067 13 0 "[ . 1 . 2 ]"
1 59 VAL 0.721 0.071 16 0 "[ . 1 . 2 ]"
1 60 LYS 0.168 0.054 16 0 "[ . 1 . 2 ]"
1 61 CYS 1.097 0.099 6 0 "[ . 1 . 2 ]"
1 62 ASP 0.264 0.091 16 0 "[ . 1 . 2 ]"
1 63 GLU 0.048 0.021 10 0 "[ . 1 . 2 ]"
1 64 THR 1.090 0.099 6 0 "[ . 1 . 2 ]"
1 65 TYR 0.394 0.100 21 0 "[ . 1 . 2 ]"
1 66 ILE 0.807 0.071 16 0 "[ . 1 . 2 ]"
1 67 ILE 0.065 0.057 7 0 "[ . 1 . 2 ]"
1 68 HIS 0.414 0.111 13 0 "[ . 1 . 2 ]"
1 69 ALA 0.710 0.111 7 0 "[ . 1 . 2 ]"
1 70 VAL 0.220 0.179 16 0 "[ . 1 . 2 ]"
1 71 GLY 0.883 0.096 16 0 "[ . 1 . 2 ]"
1 72 PRO 0.092 0.032 6 0 "[ . 1 . 2 ]"
1 73 ASN 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 74 PHE 0.243 0.064 19 0 "[ . 1 . 2 ]"
1 75 ASN 1.002 0.140 1 0 "[ . 1 . 2 ]"
1 76 ASN 0.073 0.029 11 0 "[ . 1 . 2 ]"
1 77 THR 0.780 0.140 1 0 "[ . 1 . 2 ]"
1 78 SER 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 79 GLU 0.003 0.003 19 0 "[ . 1 . 2 ]"
1 80 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 81 GLU 0.155 0.036 6 0 "[ . 1 . 2 ]"
1 82 GLY 0.803 0.067 17 0 "[ . 1 . 2 ]"
1 83 ASP 0.648 0.067 17 0 "[ . 1 . 2 ]"
1 84 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 85 ASP 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 86 LEU 0.391 0.065 17 0 "[ . 1 . 2 ]"
1 87 ALA 0.092 0.032 6 0 "[ . 1 . 2 ]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 89 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 90 TYR 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 91 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 92 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 93 VAL 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 94 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 95 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 96 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 97 ILE 0.460 0.095 10 0 "[ . 1 . 2 ]"
1 98 ASN 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 99 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 100 LEU 0.725 0.100 21 0 "[ . 1 . 2 ]"
1 101 SER 0.375 0.089 18 0 "[ . 1 . 2 ]"
1 102 ILE 0.460 0.095 10 0 "[ . 1 . 2 ]"
1 103 SER 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 104 SER 0.010 0.008 9 0 "[ . 1 . 2 ]"
1 105 VAL 0.009 0.008 9 0 "[ . 1 . 2 ]"
1 106 ALA 0.034 0.017 20 0 "[ . 1 . 2 ]"
1 107 ILE 0.074 0.036 6 0 "[ . 1 . 2 ]"
1 108 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 109 LEU 3.370 0.200 19 0 "[ . 1 . 2 ]"
1 110 LEU 0.905 0.084 12 0 "[ . 1 . 2 ]"
1 111 SER 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 112 THR 0.597 0.070 2 0 "[ . 1 . 2 ]"
1 115 PHE 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 116 SER 1.002 0.107 5 0 "[ . 1 . 2 ]"
1 117 ALA 0.446 0.067 9 0 "[ . 1 . 2 ]"
1 118 GLY 0.131 0.097 7 0 "[ . 1 . 2 ]"
1 119 LYS 0.456 0.107 5 0 "[ . 1 . 2 ]"
1 122 VAL 0.069 0.051 11 0 "[ . 1 . 2 ]"
1 123 HIS 0.517 0.085 13 0 "[ . 1 . 2 ]"
1 124 GLN 2.462 0.200 19 0 "[ . 1 . 2 ]"
1 125 SER 0.658 0.065 17 0 "[ . 1 . 2 ]"
1 126 LEU 0.722 0.094 19 0 "[ . 1 . 2 ]"
1 127 SER 0.318 0.097 17 0 "[ . 1 . 2 ]"
1 128 HIS 0.299 0.043 10 0 "[ . 1 . 2 ]"
1 129 LEU 0.505 0.084 12 0 "[ . 1 . 2 ]"
1 130 LEU 0.845 0.097 17 0 "[ . 1 . 2 ]"
1 131 ALA 0.287 0.087 2 0 "[ . 1 . 2 ]"
1 132 ALA 0.103 0.014 13 0 "[ . 1 . 2 ]"
1 133 MET 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 134 ASP 0.072 0.014 13 0 "[ . 1 . 2 ]"
1 135 THR 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 136 THR 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 137 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 138 ALA 0.034 0.021 2 0 "[ . 1 . 2 ]"
1 139 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 140 VAL 0.509 0.135 21 0 "[ . 1 . 2 ]"
1 141 THR 0.172 0.033 21 0 "[ . 1 . 2 ]"
1 142 ILE 0.923 0.076 5 0 "[ . 1 . 2 ]"
1 143 TYR 0.156 0.036 6 0 "[ . 1 . 2 ]"
1 146 ASP 0.039 0.039 16 0 "[ . 1 . 2 ]"
1 147 LYS 1.091 0.120 19 0 "[ . 1 . 2 ]"
1 148 THR 0.096 0.034 10 0 "[ . 1 . 2 ]"
1 149 TRP 0.096 0.034 10 0 "[ . 1 . 2 ]"
1 150 GLU 0.254 0.127 17 0 "[ . 1 . 2 ]"
1 151 GLN 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 152 LYS 0.208 0.071 16 0 "[ . 1 . 2 ]"
1 153 ILE 0.127 0.127 17 0 "[ . 1 . 2 ]"
1 154 LYS 0.384 0.084 16 0 "[ . 1 . 2 ]"
1 155 THR 0.410 0.082 2 0 "[ . 1 . 2 ]"
1 156 VAL 0.000 0.000 . 0 "[ . 1 . 2 ]"
1 157 LEU 2.248 0.111 13 0 "[ . 1 . 2 ]"
1 158 GLN 0.415 0.057 9 0 "[ . 1 . 2 ]"
1 159 ASN 0.570 0.082 2 0 "[ . 1 . 2 ]"
1 160 ARG 0.367 0.080 3 0 "[ . 1 . 2 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 PRO HA 1 138 ALA H . . 5.210 4.588 3.467 5.231 0.021 2 0 "[ . 1 . 2 ]" 1
2 1 3 PRO QB 1 4 ALA H . . 4.450 2.517 1.968 3.095 . 0 0 "[ . 1 . 2 ]" 1
3 1 3 PRO QB 1 136 THR H . . 6.450 4.512 3.744 5.211 . 0 0 "[ . 1 . 2 ]" 1
4 1 3 PRO QB 1 137 GLU H . . 6.160 4.488 4.016 5.064 . 0 0 "[ . 1 . 2 ]" 1
5 1 3 PRO QB 1 140 VAL H . . 5.980 4.353 3.389 4.780 . 0 0 "[ . 1 . 2 ]" 1
6 1 3 PRO QB 1 140 VAL QG . . 8.190 2.407 2.014 3.381 . 0 0 "[ . 1 . 2 ]" 1
7 1 3 PRO HB2 1 4 ALA H . . 4.650 2.573 1.979 3.246 . 0 0 "[ . 1 . 2 ]" 1
8 1 3 PRO HB2 1 138 ALA H . . 5.360 4.452 3.482 5.176 . 0 0 "[ . 1 . 2 ]" 1
9 1 3 PRO HB3 1 4 ALA H . . 4.650 3.656 3.414 3.905 . 0 0 "[ . 1 . 2 ]" 1
10 1 3 PRO HB3 1 138 ALA H . . 5.360 3.095 2.360 3.484 . 0 0 "[ . 1 . 2 ]" 1
11 1 3 PRO QD 1 136 THR H . . 6.240 4.751 3.099 5.561 . 0 0 "[ . 1 . 2 ]" 1
12 1 4 ALA H 1 5 TYR H . . 5.490 4.258 4.209 4.318 . 0 0 "[ . 1 . 2 ]" 1
13 1 4 ALA H 1 139 ARG H . . 6.000 5.255 4.738 5.833 . 0 0 "[ . 1 . 2 ]" 1
14 1 4 ALA H 1 139 ARG HA . . 4.160 2.630 2.284 3.146 . 0 0 "[ . 1 . 2 ]" 1
15 1 4 ALA H 1 139 ARG QB . . 5.370 4.588 4.171 4.846 . 0 0 "[ . 1 . 2 ]" 1
16 1 4 ALA H 1 140 VAL H . . 4.480 3.061 2.421 3.606 . 0 0 "[ . 1 . 2 ]" 1
17 1 4 ALA H 1 140 VAL MG1 . . 5.980 4.923 4.312 5.050 . 0 0 "[ . 1 . 2 ]" 1
18 1 4 ALA H 1 140 VAL QG . . 5.690 2.952 2.471 3.640 . 0 0 "[ . 1 . 2 ]" 1
19 1 4 ALA H 1 140 VAL MG2 . . 5.980 2.984 2.480 3.812 . 0 0 "[ . 1 . 2 ]" 1
20 1 4 ALA MB 1 5 TYR H . . 3.820 2.789 2.472 3.114 . 0 0 "[ . 1 . 2 ]" 1
21 1 4 ALA MB 1 140 VAL H . . 5.060 3.957 3.269 4.259 . 0 0 "[ . 1 . 2 ]" 1
22 1 5 TYR H 1 5 TYR QB . . 3.880 2.742 2.581 2.925 . 0 0 "[ . 1 . 2 ]" 1
23 1 5 TYR H 1 6 THR H . . 4.820 4.609 4.467 4.666 . 0 0 "[ . 1 . 2 ]" 1
24 1 5 TYR HA 1 140 VAL H . . 4.510 3.639 3.173 4.207 . 0 0 "[ . 1 . 2 ]" 1
25 1 5 TYR QB 1 6 THR H . . 4.100 2.752 2.408 3.156 . 0 0 "[ . 1 . 2 ]" 1
26 1 5 TYR HD1 1 140 VAL HB . . 4.940 3.709 2.157 5.075 0.135 21 0 "[ . 1 . 2 ]" 1
27 1 6 THR H 1 7 VAL H . . 4.850 4.351 4.269 4.390 . 0 0 "[ . 1 . 2 ]" 1
28 1 6 THR H 1 140 VAL HB . . 4.840 4.280 3.525 4.886 0.046 12 0 "[ . 1 . 2 ]" 1
29 1 6 THR H 1 141 THR HA . . 4.280 3.109 2.810 3.445 . 0 0 "[ . 1 . 2 ]" 1
30 1 6 THR H 1 141 THR MG . . 5.440 4.419 4.068 4.553 . 0 0 "[ . 1 . 2 ]" 1
31 1 6 THR H 1 142 ILE H . . 4.930 3.086 2.690 3.300 . 0 0 "[ . 1 . 2 ]" 1
32 1 6 THR H 1 142 ILE MG . . 5.100 4.153 3.901 4.281 . 0 0 "[ . 1 . 2 ]" 1
33 1 6 THR H 1 157 LEU QD . . 6.910 2.850 2.691 3.250 . 0 0 "[ . 1 . 2 ]" 1
34 1 6 THR H 1 157 LEU HG . . 5.560 5.619 5.125 5.671 0.111 13 0 "[ . 1 . 2 ]" 1
35 1 6 THR HA 1 7 VAL H . . 3.360 2.581 2.473 2.740 . 0 0 "[ . 1 . 2 ]" 1
36 1 6 THR HA 1 142 ILE H . . 5.670 4.878 4.770 5.011 . 0 0 "[ . 1 . 2 ]" 1
37 1 6 THR HB 1 7 VAL H . . 3.570 2.728 2.119 3.591 0.021 12 0 "[ . 1 . 2 ]" 1
38 1 6 THR HB 1 141 THR MG . . 4.750 2.567 2.038 3.382 . 0 0 "[ . 1 . 2 ]" 1
39 1 6 THR HB 1 142 ILE H . . 5.000 4.226 3.337 4.851 . 0 0 "[ . 1 . 2 ]" 1
40 1 7 VAL H 1 7 VAL HB . . 4.100 3.167 2.544 3.790 . 0 0 "[ . 1 . 2 ]" 1
41 1 7 VAL H 1 7 VAL QG . . 4.090 2.438 2.143 3.003 . 0 0 "[ . 1 . 2 ]" 1
42 1 7 VAL H 1 8 LYS H . . 5.190 4.328 4.292 4.422 . 0 0 "[ . 1 . 2 ]" 1
43 1 7 VAL H 1 141 THR MG . . 4.910 3.923 3.344 4.113 . 0 0 "[ . 1 . 2 ]" 1
44 1 7 VAL H 1 142 ILE H . . 6.000 4.623 4.474 4.923 . 0 0 "[ . 1 . 2 ]" 1
45 1 7 VAL H 1 142 ILE HB . . 6.000 6.036 5.890 6.076 0.076 5 0 "[ . 1 . 2 ]" 1
46 1 7 VAL HA 1 142 ILE H . . 4.410 3.034 2.660 3.499 . 0 0 "[ . 1 . 2 ]" 1
47 1 7 VAL HB 1 8 LYS H . . 4.340 4.103 3.163 4.367 0.027 10 0 "[ . 1 . 2 ]" 1
48 1 7 VAL QG 1 8 LYS H . . 5.970 2.644 2.305 3.615 . 0 0 "[ . 1 . 2 ]" 1
49 1 7 VAL QG 1 9 ARG H . . 6.830 4.159 3.828 5.078 . 0 0 "[ . 1 . 2 ]" 1
50 1 7 VAL QG 1 150 GLU HA . . 5.870 3.425 2.680 3.992 . 0 0 "[ . 1 . 2 ]" 1
51 1 7 VAL QG 1 153 ILE H . . 6.730 4.437 3.893 4.865 . 0 0 "[ . 1 . 2 ]" 1
52 1 7 VAL QG 1 154 LYS H . . 5.970 3.104 2.555 3.673 . 0 0 "[ . 1 . 2 ]" 1
53 1 8 LYS H 1 8 LYS QD . . 5.240 4.660 4.156 4.786 . 0 0 "[ . 1 . 2 ]" 1
54 1 8 LYS H 1 8 LYS QG . . 4.650 3.944 3.343 4.175 . 0 0 "[ . 1 . 2 ]" 1
55 1 8 LYS H 1 9 ARG H . . 5.130 4.267 4.019 4.440 . 0 0 "[ . 1 . 2 ]" 1
56 1 8 LYS H 1 9 ARG HA . . 5.940 4.619 4.381 5.017 . 0 0 "[ . 1 . 2 ]" 1
57 1 8 LYS H 1 10 ALA H . . 6.000 5.446 4.982 6.030 0.030 10 0 "[ . 1 . 2 ]" 1
58 1 8 LYS H 1 141 THR HA . . 5.430 5.387 5.223 5.463 0.033 21 0 "[ . 1 . 2 ]" 1
59 1 8 LYS H 1 141 THR MG . . 4.750 3.628 3.218 3.828 . 0 0 "[ . 1 . 2 ]" 1
60 1 8 LYS H 1 142 ILE H . . 4.880 4.420 4.065 4.706 . 0 0 "[ . 1 . 2 ]" 1
61 1 8 LYS H 1 143 TYR H . . 6.000 5.222 4.930 5.552 . 0 0 "[ . 1 . 2 ]" 1
62 1 8 LYS HA 1 10 ALA H . . 5.740 5.481 5.132 5.829 0.089 12 0 "[ . 1 . 2 ]" 1
63 1 8 LYS QB 1 9 ARG H . . 4.650 3.481 2.645 3.895 . 0 0 "[ . 1 . 2 ]" 1
64 1 8 LYS QB 1 10 ALA H . . 6.880 4.549 4.044 5.229 . 0 0 "[ . 1 . 2 ]" 1
65 1 8 LYS HB2 1 9 ARG H . . 5.030 4.393 4.013 4.588 . 0 0 "[ . 1 . 2 ]" 1
66 1 8 LYS HB3 1 9 ARG H . . 5.030 3.684 2.683 4.254 . 0 0 "[ . 1 . 2 ]" 1
67 1 8 LYS QD 1 141 THR MG . . 4.550 2.405 2.064 2.892 . 0 0 "[ . 1 . 2 ]" 1
68 1 8 LYS QD 1 143 TYR HE2 . . 4.770 3.709 2.849 4.258 . 0 0 "[ . 1 . 2 ]" 1
69 1 8 LYS QG 1 9 ARG H . . 4.960 3.075 2.203 3.893 . 0 0 "[ . 1 . 2 ]" 1
70 1 9 ARG H 1 9 ARG HD2 . . 5.930 5.292 3.836 5.989 0.059 9 0 "[ . 1 . 2 ]" 1
71 1 9 ARG H 1 9 ARG HD3 . . 5.930 4.640 3.037 5.947 0.017 17 0 "[ . 1 . 2 ]" 1
72 1 9 ARG H 1 9 ARG HG2 . . 5.220 3.939 1.992 4.666 . 0 0 "[ . 1 . 2 ]" 1
73 1 9 ARG H 1 9 ARG QG . . 5.030 3.491 1.955 4.075 . 0 0 "[ . 1 . 2 ]" 1
74 1 9 ARG H 1 9 ARG HG3 . . 5.220 4.029 2.452 4.796 . 0 0 "[ . 1 . 2 ]" 1
75 1 9 ARG H 1 10 ALA H . . 5.030 4.196 3.894 4.411 . 0 0 "[ . 1 . 2 ]" 1
76 1 9 ARG H 1 10 ALA MB . . 5.160 4.176 3.425 4.333 . 0 0 "[ . 1 . 2 ]" 1
77 1 9 ARG HB2 1 10 ALA H . . 5.040 4.475 3.395 4.744 . 0 0 "[ . 1 . 2 ]" 1
78 1 9 ARG HB3 1 10 ALA H . . 5.040 4.292 3.753 4.508 . 0 0 "[ . 1 . 2 ]" 1
79 1 9 ARG QD 1 10 ALA H . . 5.990 4.887 3.107 5.396 . 0 0 "[ . 1 . 2 ]" 1
80 1 9 ARG QD 1 147 LYS H . . 5.830 3.420 2.416 5.236 . 0 0 "[ . 1 . 2 ]" 1
81 1 9 ARG HD2 1 150 GLU H . . 5.470 4.907 3.952 5.492 0.022 12 0 "[ . 1 . 2 ]" 1
82 1 9 ARG HD3 1 150 GLU H . . 5.470 4.910 3.783 5.517 0.047 19 0 "[ . 1 . 2 ]" 1
83 1 9 ARG QG 1 10 ALA H . . 5.950 3.883 3.251 5.051 . 0 0 "[ . 1 . 2 ]" 1
84 1 10 ALA H 1 11 ASP H . . 5.240 4.309 4.171 4.414 . 0 0 "[ . 1 . 2 ]" 1
85 1 10 ALA H 1 143 TYR HA . . 5.140 4.592 3.887 5.128 . 0 0 "[ . 1 . 2 ]" 1
86 1 10 ALA H 1 146 ASP HA . . 4.970 3.824 2.818 5.009 0.039 16 0 "[ . 1 . 2 ]" 1
87 1 10 ALA H 1 146 ASP QB . . 6.390 4.310 2.902 5.762 . 0 0 "[ . 1 . 2 ]" 1
88 1 10 ALA H 1 147 LYS H . . 5.350 5.395 5.275 5.470 0.120 19 0 "[ . 1 . 2 ]" 1
89 1 10 ALA MB 1 11 ASP H . . 4.130 2.376 2.069 2.873 . 0 0 "[ . 1 . 2 ]" 1
90 1 10 ALA MB 1 143 TYR HD2 . . 4.350 3.024 2.574 3.410 . 0 0 "[ . 1 . 2 ]" 1
91 1 10 ALA MB 1 143 TYR HE2 . . 4.370 2.336 2.105 2.721 . 0 0 "[ . 1 . 2 ]" 1
92 1 11 ASP H 1 12 ILE H . . 5.310 4.595 4.484 4.660 . 0 0 "[ . 1 . 2 ]" 1
93 1 11 ASP H 1 14 THR H . . 5.900 4.982 4.500 5.571 . 0 0 "[ . 1 . 2 ]" 1
94 1 11 ASP H 1 14 THR MG . . 5.850 3.736 3.113 4.674 . 0 0 "[ . 1 . 2 ]" 1
95 1 11 ASP HA 1 13 ALA H . . 5.800 4.830 4.271 5.266 . 0 0 "[ . 1 . 2 ]" 1
96 1 11 ASP QB 1 13 ALA H . . 5.060 3.801 2.846 4.528 . 0 0 "[ . 1 . 2 ]" 1
97 1 11 ASP QB 1 14 THR H . . 5.840 4.011 2.796 4.970 . 0 0 "[ . 1 . 2 ]" 1
98 1 11 ASP HB2 1 13 ALA H . . 5.420 4.346 3.171 5.485 0.065 4 0 "[ . 1 . 2 ]" 1
99 1 11 ASP HB2 1 14 THR H . . 6.000 4.396 2.915 5.450 . 0 0 "[ . 1 . 2 ]" 1
100 1 11 ASP HB3 1 13 ALA H . . 5.420 4.398 3.220 5.484 0.064 6 0 "[ . 1 . 2 ]" 1
101 1 11 ASP HB3 1 14 THR H . . 6.000 4.746 3.599 6.038 0.038 18 0 "[ . 1 . 2 ]" 1
102 1 12 ILE H 1 12 ILE MD . . 5.540 4.241 4.070 4.328 . 0 0 "[ . 1 . 2 ]" 1
103 1 12 ILE H 1 13 ALA H . . 4.720 3.846 3.363 4.177 . 0 0 "[ . 1 . 2 ]" 1
104 1 12 ILE MD 1 17 GLU H . . 7.100 5.922 5.747 5.987 . 0 0 "[ . 1 . 2 ]" 1
105 1 12 ILE MD 1 38 VAL QG . . 5.800 3.328 3.015 3.607 . 0 0 "[ . 1 . 2 ]" 1
106 1 12 ILE MD 1 107 ILE H . . 5.400 4.102 3.822 4.394 . 0 0 "[ . 1 . 2 ]" 1
107 1 12 ILE MD 1 108 PRO QD . . 5.450 2.798 2.564 3.095 . 0 0 "[ . 1 . 2 ]" 1
108 1 12 ILE QG 1 107 ILE H . . 6.210 4.464 3.767 5.444 . 0 0 "[ . 1 . 2 ]" 1
109 1 13 ALA H 1 14 THR H . . 4.260 2.059 1.894 2.224 . 0 0 "[ . 1 . 2 ]" 1
110 1 13 ALA H 1 14 THR HB . . 4.870 4.796 4.348 4.973 0.103 21 0 "[ . 1 . 2 ]" 1
111 1 13 ALA H 1 14 THR MG . . 4.500 3.524 3.203 3.751 . 0 0 "[ . 1 . 2 ]" 1
112 1 13 ALA H 1 15 ALA H . . 4.990 3.313 2.362 3.754 . 0 0 "[ . 1 . 2 ]" 1
113 1 13 ALA H 1 20 VAL QG . . 5.520 4.072 3.852 4.163 . 0 0 "[ . 1 . 2 ]" 1
114 1 13 ALA H 1 37 ALA MB . . 5.100 4.217 3.515 4.411 . 0 0 "[ . 1 . 2 ]" 1
115 1 13 ALA HA 1 15 ALA H . . 4.980 3.941 3.533 4.632 . 0 0 "[ . 1 . 2 ]" 1
116 1 13 ALA HA 1 42 TRP HZ3 . . 4.550 3.180 2.114 4.614 0.064 18 0 "[ . 1 . 2 ]" 1
117 1 13 ALA MB 1 14 THR H . . 4.230 2.422 2.084 3.563 . 0 0 "[ . 1 . 2 ]" 1
118 1 13 ALA MB 1 15 ALA H . . 5.580 4.344 3.860 4.688 . 0 0 "[ . 1 . 2 ]" 1
119 1 13 ALA MB 1 37 ALA MB . . 3.840 2.025 1.870 2.227 . 0 0 "[ . 1 . 2 ]" 1
120 1 13 ALA MB 1 41 LYS H . . 5.690 4.484 4.125 4.776 . 0 0 "[ . 1 . 2 ]" 1
121 1 13 ALA MB 1 41 LYS QD . . 5.500 2.845 1.991 3.870 . 0 0 "[ . 1 . 2 ]" 1
122 1 14 THR H 1 14 THR MG . . 4.250 2.160 1.975 3.098 . 0 0 "[ . 1 . 2 ]" 1
123 1 14 THR H 1 15 ALA H . . 4.020 3.052 1.996 3.482 . 0 0 "[ . 1 . 2 ]" 1
124 1 14 THR H 1 15 ALA HA . . 5.170 4.701 4.035 5.021 . 0 0 "[ . 1 . 2 ]" 1
125 1 14 THR H 1 15 ALA MB . . 5.200 4.256 3.424 4.376 . 0 0 "[ . 1 . 2 ]" 1
126 1 14 THR H 1 20 VAL QG . . 6.900 4.814 4.010 5.161 . 0 0 "[ . 1 . 2 ]" 1
127 1 14 THR HB 1 15 ALA H . . 4.980 4.566 4.248 4.674 . 0 0 "[ . 1 . 2 ]" 1
128 1 14 THR MG 1 15 ALA H . . 5.960 4.006 2.803 4.379 . 0 0 "[ . 1 . 2 ]" 1
129 1 15 ALA H 1 16 ILE H . . 5.280 3.815 2.486 4.676 . 0 0 "[ . 1 . 2 ]" 1
130 1 15 ALA H 1 17 GLU H . . 6.000 4.792 3.975 5.778 . 0 0 "[ . 1 . 2 ]" 1
131 1 15 ALA H 1 20 VAL QG . . 4.600 3.310 2.995 3.468 . 0 0 "[ . 1 . 2 ]" 1
132 1 15 ALA HA 1 17 GLU H . . 4.890 4.278 4.007 4.680 . 0 0 "[ . 1 . 2 ]" 1
133 1 15 ALA MB 1 16 ILE H . . 4.270 2.598 2.041 3.336 . 0 0 "[ . 1 . 2 ]" 1
134 1 15 ALA MB 1 17 GLU H . . 4.140 2.598 2.263 2.839 . 0 0 "[ . 1 . 2 ]" 1
135 1 15 ALA MB 1 17 GLU QB . . 5.190 2.927 2.403 3.418 . 0 0 "[ . 1 . 2 ]" 1
136 1 15 ALA MB 1 106 ALA H . . 5.430 4.002 3.607 4.308 . 0 0 "[ . 1 . 2 ]" 1
137 1 15 ALA MB 1 143 TYR HE2 . . 4.810 3.608 2.883 4.008 . 0 0 "[ . 1 . 2 ]" 1
138 1 16 ILE H 1 16 ILE MD . . 5.250 3.328 1.861 4.274 . 0 0 "[ . 1 . 2 ]" 1
139 1 16 ILE H 1 16 ILE QG . . 4.060 2.855 1.980 3.693 . 0 0 "[ . 1 . 2 ]" 1
140 1 16 ILE H 1 16 ILE MG . . 4.330 2.825 2.358 3.179 . 0 0 "[ . 1 . 2 ]" 1
141 1 16 ILE H 1 17 GLU H . . 4.120 2.483 1.966 3.004 . 0 0 "[ . 1 . 2 ]" 1
142 1 16 ILE H 1 17 GLU HA . . 5.900 4.844 4.266 5.539 . 0 0 "[ . 1 . 2 ]" 1
143 1 16 ILE H 1 20 VAL QG . . 6.200 4.302 3.743 4.622 . 0 0 "[ . 1 . 2 ]" 1
144 1 16 ILE HB 1 17 GLU H . . 4.930 4.503 4.362 4.550 . 0 0 "[ . 1 . 2 ]" 1
145 1 16 ILE MD 1 17 GLU H . . 5.300 3.892 3.065 4.474 . 0 0 "[ . 1 . 2 ]" 1
146 1 16 ILE QG 1 17 GLU H . . 4.660 3.930 3.091 4.217 . 0 0 "[ . 1 . 2 ]" 1
147 1 16 ILE MG 1 17 GLU H . . 5.300 4.343 4.295 4.386 . 0 0 "[ . 1 . 2 ]" 1
148 1 17 GLU H 1 17 GLU HG2 . . 5.070 4.078 2.665 4.662 . 0 0 "[ . 1 . 2 ]" 1
149 1 17 GLU H 1 17 GLU QG . . 4.870 3.227 2.433 4.001 . 0 0 "[ . 1 . 2 ]" 1
150 1 17 GLU H 1 17 GLU HG3 . . 5.070 3.460 2.475 4.356 . 0 0 "[ . 1 . 2 ]" 1
151 1 17 GLU H 1 18 ASP H . . 5.500 4.553 4.399 4.646 . 0 0 "[ . 1 . 2 ]" 1
152 1 17 GLU H 1 19 ALA H . . 6.000 5.152 4.819 5.785 . 0 0 "[ . 1 . 2 ]" 1
153 1 17 GLU H 1 20 VAL QG . . 5.430 3.499 3.083 4.097 . 0 0 "[ . 1 . 2 ]" 1
154 1 17 GLU H 1 106 ALA H . . 5.850 5.065 4.703 5.336 . 0 0 "[ . 1 . 2 ]" 1
155 1 17 GLU HA 1 106 ALA H . . 5.940 5.772 5.427 5.957 0.017 20 0 "[ . 1 . 2 ]" 1
156 1 17 GLU QB 1 18 ASP H . . 4.370 2.493 2.051 2.815 . 0 0 "[ . 1 . 2 ]" 1
157 1 17 GLU QB 1 19 ALA H . . 5.110 2.856 2.387 3.299 . 0 0 "[ . 1 . 2 ]" 1
158 1 17 GLU QB 1 106 ALA H . . 4.860 2.812 2.509 3.002 . 0 0 "[ . 1 . 2 ]" 1
159 1 17 GLU QG 1 18 ASP H . . 4.550 3.630 2.772 4.109 . 0 0 "[ . 1 . 2 ]" 1
160 1 17 GLU QG 1 106 ALA H . . 5.630 3.983 3.353 4.798 . 0 0 "[ . 1 . 2 ]" 1
161 1 17 GLU QG 1 106 ALA MB . . 5.860 3.636 2.715 4.319 . 0 0 "[ . 1 . 2 ]" 1
162 1 17 GLU QG 1 141 THR H . . 6.790 4.811 3.831 5.999 . 0 0 "[ . 1 . 2 ]" 1
163 1 17 GLU HG2 1 18 ASP H . . 4.740 4.203 3.536 4.788 0.048 7 0 "[ . 1 . 2 ]" 1
164 1 17 GLU HG2 1 106 ALA H . . 5.760 4.282 3.447 5.308 . 0 0 "[ . 1 . 2 ]" 1
165 1 17 GLU HG3 1 18 ASP H . . 4.740 4.123 2.857 4.783 0.043 5 0 "[ . 1 . 2 ]" 1
166 1 17 GLU HG3 1 106 ALA H . . 5.760 5.108 3.446 5.565 . 0 0 "[ . 1 . 2 ]" 1
167 1 18 ASP H 1 19 ALA H . . 4.370 2.648 2.495 2.852 . 0 0 "[ . 1 . 2 ]" 1
168 1 18 ASP H 1 102 ILE QG . . 5.800 4.983 4.660 5.207 . 0 0 "[ . 1 . 2 ]" 1
169 1 18 ASP H 1 103 SER H . . 6.000 4.845 4.563 5.127 . 0 0 "[ . 1 . 2 ]" 1
170 1 18 ASP H 1 104 SER H . . 4.900 3.390 3.129 3.682 . 0 0 "[ . 1 . 2 ]" 1
171 1 18 ASP H 1 104 SER HA . . 5.350 4.769 4.320 5.234 . 0 0 "[ . 1 . 2 ]" 1
172 1 18 ASP H 1 105 VAL HA . . 5.590 3.977 3.505 4.294 . 0 0 "[ . 1 . 2 ]" 1
173 1 18 ASP H 1 106 ALA H . . 6.000 5.597 5.068 5.819 . 0 0 "[ . 1 . 2 ]" 1
174 1 18 ASP QB 1 19 ALA H . . 4.310 2.427 2.132 2.715 . 0 0 "[ . 1 . 2 ]" 1
175 1 18 ASP QB 1 104 SER H . . 4.760 2.649 2.061 3.116 . 0 0 "[ . 1 . 2 ]" 1
176 1 19 ALA H 1 20 VAL H . . 5.100 4.428 4.370 4.555 . 0 0 "[ . 1 . 2 ]" 1
177 1 19 ALA H 1 20 VAL HA . . 5.370 4.957 4.755 5.157 . 0 0 "[ . 1 . 2 ]" 1
178 1 19 ALA H 1 102 ILE QG . . 4.470 3.891 3.450 4.051 . 0 0 "[ . 1 . 2 ]" 1
179 1 19 ALA H 1 104 SER H . . 5.230 4.204 3.824 4.467 . 0 0 "[ . 1 . 2 ]" 1
180 1 19 ALA H 1 105 VAL HA . . 4.350 2.744 2.526 2.937 . 0 0 "[ . 1 . 2 ]" 1
181 1 19 ALA H 1 105 VAL HB . . 5.240 3.326 2.836 3.717 . 0 0 "[ . 1 . 2 ]" 1
182 1 19 ALA H 1 106 ALA H . . 4.940 4.241 3.994 4.483 . 0 0 "[ . 1 . 2 ]" 1
183 1 19 ALA HA 1 65 TYR H . . 4.380 2.865 2.547 3.441 . 0 0 "[ . 1 . 2 ]" 1
184 1 19 ALA MB 1 20 VAL H . . 3.860 2.508 2.316 2.709 . 0 0 "[ . 1 . 2 ]" 1
185 1 19 ALA MB 1 65 TYR H . . 4.710 3.580 3.330 3.821 . 0 0 "[ . 1 . 2 ]" 1
186 1 19 ALA MB 1 65 TYR QB . . 4.330 2.161 1.983 2.437 . 0 0 "[ . 1 . 2 ]" 1
187 1 19 ALA MB 1 65 TYR HD2 . . 4.590 3.474 3.153 3.838 . 0 0 "[ . 1 . 2 ]" 1
188 1 19 ALA MB 1 66 ILE H . . 6.000 4.965 4.837 5.028 . 0 0 "[ . 1 . 2 ]" 1
189 1 19 ALA MB 1 67 ILE H . . 5.450 4.309 3.919 4.567 . 0 0 "[ . 1 . 2 ]" 1
190 1 19 ALA MB 1 102 ILE MD . . 3.930 1.922 1.773 2.186 . 0 0 "[ . 1 . 2 ]" 1
191 1 19 ALA MB 1 104 SER H . . 5.750 4.717 4.409 4.878 . 0 0 "[ . 1 . 2 ]" 1
192 1 19 ALA MB 1 105 VAL HA . . 4.760 3.150 2.852 3.413 . 0 0 "[ . 1 . 2 ]" 1
193 1 19 ALA MB 1 105 VAL HB . . 4.280 2.140 2.014 2.262 . 0 0 "[ . 1 . 2 ]" 1
194 1 19 ALA MB 1 105 VAL QG . . 5.820 2.291 2.087 2.541 . 0 0 "[ . 1 . 2 ]" 1
195 1 19 ALA MB 1 106 ALA H . . 5.240 4.107 3.933 4.379 . 0 0 "[ . 1 . 2 ]" 1
196 1 20 VAL H 1 20 VAL QG . . 4.060 2.924 2.451 3.065 . 0 0 "[ . 1 . 2 ]" 1
197 1 20 VAL H 1 21 VAL H . . 5.210 4.237 4.145 4.360 . 0 0 "[ . 1 . 2 ]" 1
198 1 20 VAL H 1 65 TYR H . . 5.080 4.526 4.254 5.054 . 0 0 "[ . 1 . 2 ]" 1
199 1 20 VAL H 1 65 TYR HB2 . . 5.950 4.560 4.126 4.975 . 0 0 "[ . 1 . 2 ]" 1
200 1 20 VAL H 1 65 TYR QB . . 5.600 4.322 3.881 4.743 . 0 0 "[ . 1 . 2 ]" 1
201 1 20 VAL H 1 65 TYR HB3 . . 5.950 5.373 4.696 5.976 0.026 7 0 "[ . 1 . 2 ]" 1
202 1 20 VAL H 1 66 ILE HA . . 4.410 2.348 2.097 2.594 . 0 0 "[ . 1 . 2 ]" 1
203 1 20 VAL H 1 66 ILE MD . . 5.640 4.330 3.718 4.721 . 0 0 "[ . 1 . 2 ]" 1
204 1 20 VAL H 1 67 ILE H . . 4.650 3.511 3.130 3.701 . 0 0 "[ . 1 . 2 ]" 1
205 1 20 VAL H 1 67 ILE QG . . 4.920 3.802 3.374 4.281 . 0 0 "[ . 1 . 2 ]" 1
206 1 20 VAL H 1 105 VAL QG . . 6.290 3.631 3.384 3.818 . 0 0 "[ . 1 . 2 ]" 1
207 1 20 VAL H 1 106 ALA H . . 5.380 4.774 4.531 4.982 . 0 0 "[ . 1 . 2 ]" 1
208 1 20 VAL H 1 106 ALA MB . . 6.610 5.071 4.790 5.360 . 0 0 "[ . 1 . 2 ]" 1
209 1 20 VAL HA 1 106 ALA H . . 4.330 2.660 2.469 2.872 . 0 0 "[ . 1 . 2 ]" 1
210 1 20 VAL HA 1 106 ALA MB . . 4.370 2.438 2.122 2.952 . 0 0 "[ . 1 . 2 ]" 1
211 1 20 VAL QG 1 21 VAL H . . 4.130 2.830 2.427 3.070 . 0 0 "[ . 1 . 2 ]" 1
212 1 20 VAL QG 1 38 VAL QG . . 6.400 2.397 1.943 2.840 . 0 0 "[ . 1 . 2 ]" 1
213 1 20 VAL QG 1 66 ILE MD . . 4.880 2.498 2.214 2.793 . 0 0 "[ . 1 . 2 ]" 1
214 1 20 VAL QG 1 66 ILE MG . . 7.200 4.422 3.995 4.496 . 0 0 "[ . 1 . 2 ]" 1
215 1 20 VAL QG 1 67 ILE H . . 5.490 4.081 3.806 4.133 . 0 0 "[ . 1 . 2 ]" 1
216 1 20 VAL QG 1 106 ALA H . . 4.790 3.426 3.113 3.597 . 0 0 "[ . 1 . 2 ]" 1
217 1 21 VAL H 1 22 ASN H . . 4.850 4.514 4.414 4.578 . 0 0 "[ . 1 . 2 ]" 1
218 1 21 VAL H 1 67 ILE HB . . 5.340 4.746 4.454 5.146 . 0 0 "[ . 1 . 2 ]" 1
219 1 21 VAL H 1 105 VAL QG . . 6.890 3.250 2.933 3.622 . 0 0 "[ . 1 . 2 ]" 1
220 1 21 VAL H 1 106 ALA H . . 5.350 3.721 3.471 4.080 . 0 0 "[ . 1 . 2 ]" 1
221 1 21 VAL H 1 106 ALA MB . . 5.160 3.072 2.613 3.697 . 0 0 "[ . 1 . 2 ]" 1
222 1 21 VAL H 1 108 PRO HD2 . . 5.770 4.334 4.106 4.615 . 0 0 "[ . 1 . 2 ]" 1
223 1 21 VAL H 1 108 PRO QD . . 5.580 3.387 3.143 3.738 . 0 0 "[ . 1 . 2 ]" 1
224 1 21 VAL H 1 108 PRO HD3 . . 5.770 3.544 3.244 3.969 . 0 0 "[ . 1 . 2 ]" 1
225 1 21 VAL HA 1 67 ILE H . . 4.320 2.585 2.179 2.923 . 0 0 "[ . 1 . 2 ]" 1
226 1 21 VAL HA 1 69 ALA H . . 5.630 4.712 4.417 5.025 . 0 0 "[ . 1 . 2 ]" 1
227 1 21 VAL HB 1 22 ASN H . . 5.030 3.834 2.625 4.244 . 0 0 "[ . 1 . 2 ]" 1
228 1 22 ASN H 1 24 ALA MB . . 5.780 4.432 4.163 4.668 . 0 0 "[ . 1 . 2 ]" 1
229 1 22 ASN H 1 66 ILE MD . . 5.630 4.388 3.324 4.716 . 0 0 "[ . 1 . 2 ]" 1
230 1 22 ASN H 1 66 ILE QG . . 5.060 4.221 3.864 4.596 . 0 0 "[ . 1 . 2 ]" 1
231 1 22 ASN H 1 67 ILE H . . 4.510 4.024 3.657 4.328 . 0 0 "[ . 1 . 2 ]" 1
232 1 22 ASN H 1 67 ILE HA . . 5.970 5.230 5.085 5.544 . 0 0 "[ . 1 . 2 ]" 1
233 1 22 ASN H 1 67 ILE HB . . 5.630 3.953 3.489 4.364 . 0 0 "[ . 1 . 2 ]" 1
234 1 22 ASN H 1 68 HIS HA . . 5.070 2.727 2.304 3.015 . 0 0 "[ . 1 . 2 ]" 1
235 1 22 ASN H 1 69 ALA H . . 4.880 2.988 2.673 3.206 . 0 0 "[ . 1 . 2 ]" 1
236 1 22 ASN H 1 69 ALA MB . . 5.070 3.882 3.441 4.227 . 0 0 "[ . 1 . 2 ]" 1
237 1 22 ASN HA 1 38 VAL QG . . 6.310 3.724 3.150 4.416 . 0 0 "[ . 1 . 2 ]" 1
238 1 22 ASN QB 1 68 HIS H . . 6.780 5.202 4.712 6.052 . 0 0 "[ . 1 . 2 ]" 1
239 1 22 ASN HB2 1 69 ALA H . . 4.940 4.660 3.389 5.051 0.111 7 0 "[ . 1 . 2 ]" 1
240 1 22 ASN HB3 1 69 ALA H . . 4.940 4.085 3.524 4.934 . 0 0 "[ . 1 . 2 ]" 1
241 1 23 ALA HA 1 69 ALA H . . 4.900 4.033 3.787 4.273 . 0 0 "[ . 1 . 2 ]" 1
242 1 23 ALA HA 1 110 LEU QD . . 5.920 2.201 1.966 2.575 . 0 0 "[ . 1 . 2 ]" 1
243 1 23 ALA MB 1 108 PRO QB . . 5.000 3.129 2.673 3.636 . 0 0 "[ . 1 . 2 ]" 1
244 1 23 ALA MB 1 110 LEU HA . . 4.660 2.889 2.470 3.298 . 0 0 "[ . 1 . 2 ]" 1
245 1 23 ALA MB 1 110 LEU QD . . 5.540 2.401 2.015 2.906 . 0 0 "[ . 1 . 2 ]" 1
246 1 24 ALA H 1 25 ASN H . . 5.180 4.599 4.466 4.679 . 0 0 "[ . 1 . 2 ]" 1
247 1 24 ALA H 1 68 HIS HA . . 5.550 3.866 3.545 4.216 . 0 0 "[ . 1 . 2 ]" 1
248 1 24 ALA H 1 69 ALA H . . 4.700 2.884 2.603 3.637 . 0 0 "[ . 1 . 2 ]" 1
249 1 24 ALA H 1 69 ALA MB . . 5.150 3.461 3.115 4.328 . 0 0 "[ . 1 . 2 ]" 1
250 1 24 ALA H 1 70 VAL HA . . 5.170 3.817 3.471 5.188 0.018 14 0 "[ . 1 . 2 ]" 1
251 1 24 ALA H 1 70 VAL QG . . 7.250 4.046 3.723 5.087 . 0 0 "[ . 1 . 2 ]" 1
252 1 24 ALA H 1 110 LEU QD . . 6.440 3.478 3.144 4.202 . 0 0 "[ . 1 . 2 ]" 1
253 1 24 ALA MB 1 68 HIS H . . 5.530 4.632 4.475 4.703 . 0 0 "[ . 1 . 2 ]" 1
254 1 24 ALA MB 1 69 ALA H . . 4.440 2.971 2.516 3.325 . 0 0 "[ . 1 . 2 ]" 1
255 1 24 ALA MB 1 70 VAL H . . 5.640 4.166 3.573 4.700 . 0 0 "[ . 1 . 2 ]" 1
256 1 25 ASN H 1 28 GLY H . . 6.000 5.526 4.009 6.051 0.051 4 0 "[ . 1 . 2 ]" 1
257 1 25 ASN QB 1 70 VAL QG . . 6.200 4.074 3.743 4.190 . 0 0 "[ . 1 . 2 ]" 1
258 1 26 HIS H 1 27 ARG H . . 6.000 3.134 1.920 4.109 . 0 0 "[ . 1 . 2 ]" 1
259 1 26 HIS H 1 70 VAL QG . . 6.990 2.607 1.766 3.556 . 0 0 "[ . 1 . 2 ]" 1
260 1 26 HIS HA 1 28 GLY H . . 5.500 4.855 3.646 5.610 0.110 12 0 "[ . 1 . 2 ]" 1
261 1 26 HIS HA 1 51 THR H . . 4.560 3.566 3.102 4.352 . 0 0 "[ . 1 . 2 ]" 1
262 1 26 HIS HA 1 53 VAL H . . 5.780 5.151 4.335 5.548 . 0 0 "[ . 1 . 2 ]" 1
263 1 26 HIS HA 1 70 VAL MG1 . . 5.330 2.237 2.000 3.844 . 0 0 "[ . 1 . 2 ]" 1
264 1 26 HIS HA 1 70 VAL QG . . 4.720 2.010 1.875 2.215 . 0 0 "[ . 1 . 2 ]" 1
265 1 26 HIS HA 1 70 VAL MG2 . . 5.330 2.423 2.111 2.967 . 0 0 "[ . 1 . 2 ]" 1
266 1 26 HIS HA 1 71 GLY H . . 5.960 5.940 5.603 6.056 0.096 16 0 "[ . 1 . 2 ]" 1
267 1 26 HIS QB 1 27 ARG H . . 5.640 2.987 2.260 4.199 . 0 0 "[ . 1 . 2 ]" 1
268 1 26 HIS QB 1 53 VAL H . . 5.980 4.556 3.377 5.063 . 0 0 "[ . 1 . 2 ]" 1
269 1 26 HIS QB 1 53 VAL QG . . 7.590 2.760 2.245 3.233 . 0 0 "[ . 1 . 2 ]" 1
270 1 26 HIS QB 1 70 VAL QG . . 7.130 2.473 2.089 3.102 . 0 0 "[ . 1 . 2 ]" 1
271 1 26 HIS HD2 1 52 PRO HA . . 4.200 2.816 2.207 4.248 0.048 8 0 "[ . 1 . 2 ]" 1
272 1 27 ARG H 1 27 ARG QD . . 5.550 4.512 4.009 4.983 . 0 0 "[ . 1 . 2 ]" 1
273 1 27 ARG H 1 27 ARG HG2 . . 4.390 3.859 3.239 4.418 0.028 2 0 "[ . 1 . 2 ]" 1
274 1 27 ARG H 1 27 ARG HG3 . . 4.390 3.483 2.648 4.421 0.031 20 0 "[ . 1 . 2 ]" 1
275 1 27 ARG H 1 28 GLY H . . 4.210 3.778 2.188 4.279 0.069 1 0 "[ . 1 . 2 ]" 1
276 1 27 ARG H 1 28 GLY HA2 . . 5.850 5.048 4.236 5.505 . 0 0 "[ . 1 . 2 ]" 1
277 1 27 ARG H 1 29 GLN H . . 4.710 4.529 3.244 4.832 0.122 4 0 "[ . 1 . 2 ]" 1
278 1 27 ARG HA 1 50 ALA H . . 5.770 5.073 4.409 5.601 . 0 0 "[ . 1 . 2 ]" 1
279 1 27 ARG HA 1 50 ALA MB . . 4.160 2.521 2.138 3.037 . 0 0 "[ . 1 . 2 ]" 1
280 1 27 ARG HA 1 51 THR H . . 5.880 3.770 2.291 4.652 . 0 0 "[ . 1 . 2 ]" 1
281 1 27 ARG QB 1 29 GLN H . . 4.570 3.243 1.895 4.130 . 0 0 "[ . 1 . 2 ]" 1
282 1 27 ARG QB 1 29 GLN QG . . 6.410 3.297 2.183 4.871 . 0 0 "[ . 1 . 2 ]" 1
283 1 27 ARG QG 1 28 GLY H . . 6.660 4.328 3.799 4.908 . 0 0 "[ . 1 . 2 ]" 1
284 1 28 GLY H 1 29 GLN H . . 4.190 3.310 2.580 3.911 . 0 0 "[ . 1 . 2 ]" 1
285 1 28 GLY H 1 49 ALA MB . . 5.500 4.360 4.071 4.594 . 0 0 "[ . 1 . 2 ]" 1
286 1 28 GLY H 1 50 ALA HA . . 4.640 2.197 1.947 2.800 . 0 0 "[ . 1 . 2 ]" 1
287 1 28 GLY H 1 50 ALA MB . . 4.980 2.696 1.861 4.171 . 0 0 "[ . 1 . 2 ]" 1
288 1 28 GLY H 1 51 THR H . . 5.050 3.736 3.122 4.308 . 0 0 "[ . 1 . 2 ]" 1
289 1 28 GLY QA 1 49 ALA H . . 5.590 3.011 2.538 3.641 . 0 0 "[ . 1 . 2 ]" 1
290 1 28 GLY QA 1 49 ALA MB . . 6.000 2.488 2.076 3.424 . 0 0 "[ . 1 . 2 ]" 1
291 1 28 GLY QA 1 50 ALA H . . 4.530 3.135 1.986 3.958 . 0 0 "[ . 1 . 2 ]" 1
292 1 28 GLY QA 1 50 ALA MB . . 5.120 3.273 2.754 3.650 . 0 0 "[ . 1 . 2 ]" 1
293 1 28 GLY HA2 1 50 ALA H . . 4.800 4.531 2.711 4.875 0.075 19 0 "[ . 1 . 2 ]" 1
294 1 29 GLN H 1 29 GLN QB . . 3.890 2.422 1.961 3.017 . 0 0 "[ . 1 . 2 ]" 1
295 1 29 GLN H 1 29 GLN HG2 . . 4.680 3.812 2.262 4.629 . 0 0 "[ . 1 . 2 ]" 1
296 1 29 GLN H 1 29 GLN QG . . 4.330 3.109 2.070 3.918 . 0 0 "[ . 1 . 2 ]" 1
297 1 29 GLN H 1 29 GLN HG3 . . 4.680 3.482 2.087 4.329 . 0 0 "[ . 1 . 2 ]" 1
298 1 29 GLN H 1 30 VAL H . . 5.370 4.149 2.728 4.656 . 0 0 "[ . 1 . 2 ]" 1
299 1 29 GLN H 1 50 ALA MB . . 6.000 4.887 4.195 5.042 . 0 0 "[ . 1 . 2 ]" 1
300 1 29 GLN HA 1 30 VAL QG . . 6.490 3.513 3.035 4.532 . 0 0 "[ . 1 . 2 ]" 1
301 1 29 GLN QB 1 30 VAL H . . 4.340 2.980 2.136 3.895 . 0 0 "[ . 1 . 2 ]" 1
302 1 29 GLN HB2 1 30 VAL H . . 4.590 3.891 2.327 4.526 . 0 0 "[ . 1 . 2 ]" 1
303 1 29 GLN HB3 1 30 VAL H . . 4.590 3.217 2.220 4.329 . 0 0 "[ . 1 . 2 ]" 1
304 1 29 GLN QG 1 30 VAL H . . 5.430 3.837 2.234 4.477 . 0 0 "[ . 1 . 2 ]" 1
305 1 29 GLN HG2 1 30 VAL H . . 5.560 4.152 2.252 4.956 . 0 0 "[ . 1 . 2 ]" 1
306 1 29 GLN HG3 1 30 VAL H . . 5.560 4.659 3.332 5.262 . 0 0 "[ . 1 . 2 ]" 1
307 1 30 VAL H 1 30 VAL HB . . 4.100 2.965 2.361 3.904 . 0 0 "[ . 1 . 2 ]" 1
308 1 30 VAL HA 1 46 PHE HE2 . . 4.510 3.721 2.815 4.604 0.094 10 0 "[ . 1 . 2 ]" 1
309 1 30 VAL QG 1 39 ALA MB . . 5.420 2.578 1.889 3.313 . 0 0 "[ . 1 . 2 ]" 1
310 1 34 VAL QG 1 37 ALA MB . . 5.750 3.059 2.158 3.566 . 0 0 "[ . 1 . 2 ]" 1
311 1 37 ALA HA 1 40 ARG QB . . 5.250 3.435 2.490 4.714 . 0 0 "[ . 1 . 2 ]" 1
312 1 37 ALA MB 1 38 VAL H . . 4.270 2.437 2.278 2.586 . 0 0 "[ . 1 . 2 ]" 1
313 1 38 VAL H 1 38 VAL HB . . 4.100 2.465 2.300 2.676 . 0 0 "[ . 1 . 2 ]" 1
314 1 38 VAL H 1 38 VAL MG1 . . 4.740 3.760 3.701 3.813 . 0 0 "[ . 1 . 2 ]" 1
315 1 38 VAL H 1 38 VAL QG . . 4.070 2.210 2.034 2.490 . 0 0 "[ . 1 . 2 ]" 1
316 1 38 VAL H 1 38 VAL MG2 . . 4.740 2.227 2.043 2.526 . 0 0 "[ . 1 . 2 ]" 1
317 1 38 VAL H 1 40 ARG H . . 5.570 4.434 3.869 5.342 . 0 0 "[ . 1 . 2 ]" 1
318 1 38 VAL HA 1 40 ARG H . . 5.180 4.066 3.564 4.606 . 0 0 "[ . 1 . 2 ]" 1
319 1 38 VAL HA 1 41 LYS H . . 5.040 3.711 3.219 4.507 . 0 0 "[ . 1 . 2 ]" 1
320 1 38 VAL HA 1 42 TRP HE3 . . 4.750 3.250 2.198 4.273 . 0 0 "[ . 1 . 2 ]" 1
321 1 38 VAL HA 1 42 TRP HZ3 . . 5.330 3.924 2.906 5.289 . 0 0 "[ . 1 . 2 ]" 1
322 1 38 VAL HB 1 40 ARG H . . 5.900 5.068 4.900 5.307 . 0 0 "[ . 1 . 2 ]" 1
323 1 38 VAL QG 1 39 ALA HA . . 5.910 3.487 2.978 3.872 . 0 0 "[ . 1 . 2 ]" 1
324 1 38 VAL QG 1 42 TRP H . . 6.720 3.623 3.096 4.191 . 0 0 "[ . 1 . 2 ]" 1
325 1 38 VAL QG 1 42 TRP QB . . 6.370 2.659 2.031 3.195 . 0 0 "[ . 1 . 2 ]" 1
326 1 38 VAL QG 1 42 TRP HE3 . . 4.140 2.173 1.913 2.425 . 0 0 "[ . 1 . 2 ]" 1
327 1 38 VAL QG 1 46 PHE HE1 . . 6.820 2.217 2.007 2.920 . 0 0 "[ . 1 . 2 ]" 1
328 1 38 VAL QG 1 66 ILE MD . . 5.690 1.883 1.761 2.352 . 0 0 "[ . 1 . 2 ]" 1
329 1 38 VAL MG1 1 42 TRP HE3 . . 4.620 2.192 1.917 2.451 . 0 0 "[ . 1 . 2 ]" 1
330 1 38 VAL MG1 1 42 TRP HZ3 . . 4.810 3.353 2.662 4.009 . 0 0 "[ . 1 . 2 ]" 1
331 1 38 VAL MG2 1 42 TRP HE3 . . 4.620 3.715 3.004 3.945 . 0 0 "[ . 1 . 2 ]" 1
332 1 38 VAL MG2 1 42 TRP HZ3 . . 4.810 3.576 2.709 4.038 . 0 0 "[ . 1 . 2 ]" 1
333 1 39 ALA MB 1 40 ARG H . . 4.440 3.069 2.458 3.708 . 0 0 "[ . 1 . 2 ]" 1
334 1 40 ARG H 1 40 ARG QD . . 4.770 3.977 3.352 4.318 . 0 0 "[ . 1 . 2 ]" 1
335 1 40 ARG H 1 40 ARG HG2 . . 4.570 3.649 2.666 4.576 0.006 10 0 "[ . 1 . 2 ]" 1
336 1 40 ARG H 1 40 ARG QG . . 4.220 2.887 2.177 3.798 . 0 0 "[ . 1 . 2 ]" 1
337 1 40 ARG H 1 40 ARG HG3 . . 4.570 3.361 2.200 4.510 . 0 0 "[ . 1 . 2 ]" 1
338 1 40 ARG H 1 41 LYS H . . 3.950 2.560 1.985 3.011 . 0 0 "[ . 1 . 2 ]" 1
339 1 40 ARG H 1 41 LYS QB . . 6.780 4.567 3.878 5.604 . 0 0 "[ . 1 . 2 ]" 1
340 1 40 ARG H 1 42 TRP H . . 5.310 3.689 2.411 4.587 . 0 0 "[ . 1 . 2 ]" 1
341 1 40 ARG HA 1 42 TRP H . . 5.540 4.653 3.895 5.167 . 0 0 "[ . 1 . 2 ]" 1
342 1 40 ARG QB 1 41 LYS H . . 4.150 2.867 2.004 3.721 . 0 0 "[ . 1 . 2 ]" 1
343 1 40 ARG QB 1 42 TRP H . . 6.000 4.770 3.943 5.425 . 0 0 "[ . 1 . 2 ]" 1
344 1 40 ARG QG 1 41 LYS H . . 6.370 4.228 1.999 4.658 . 0 0 "[ . 1 . 2 ]" 1
345 1 41 LYS H 1 41 LYS HB2 . . 4.200 2.615 2.179 3.792 . 0 0 "[ . 1 . 2 ]" 1
346 1 41 LYS H 1 41 LYS HB3 . . 4.200 3.508 2.677 3.837 . 0 0 "[ . 1 . 2 ]" 1
347 1 41 LYS H 1 41 LYS QD . . 5.260 3.149 2.006 4.116 . 0 0 "[ . 1 . 2 ]" 1
348 1 41 LYS H 1 41 LYS HG2 . . 5.420 4.080 2.192 4.993 . 0 0 "[ . 1 . 2 ]" 1
349 1 41 LYS H 1 41 LYS HG3 . . 5.420 3.635 2.679 4.718 . 0 0 "[ . 1 . 2 ]" 1
350 1 41 LYS H 1 42 TRP H . . 4.160 2.353 2.048 2.600 . 0 0 "[ . 1 . 2 ]" 1
351 1 41 LYS H 1 42 TRP QB . . 5.300 4.462 3.730 4.740 . 0 0 "[ . 1 . 2 ]" 1
352 1 41 LYS QB 1 42 TRP H . . 4.430 3.015 2.359 4.019 . 0 0 "[ . 1 . 2 ]" 1
353 1 41 LYS HB2 1 42 TRP H . . 4.720 3.253 2.430 4.442 . 0 0 "[ . 1 . 2 ]" 1
354 1 41 LYS HB3 1 42 TRP H . . 4.720 3.691 2.566 4.645 . 0 0 "[ . 1 . 2 ]" 1
355 1 41 LYS HG2 1 42 TRP H . . 5.910 5.009 3.036 5.928 0.018 12 0 "[ . 1 . 2 ]" 1
356 1 41 LYS HG3 1 42 TRP H . . 5.910 4.815 3.280 5.243 . 0 0 "[ . 1 . 2 ]" 1
357 1 42 TRP HE1 1 64 THR HB . . 5.650 4.305 2.987 5.508 . 0 0 "[ . 1 . 2 ]" 1
358 1 43 PRO HA 1 45 ALA H . . 4.680 4.169 3.915 4.597 . 0 0 "[ . 1 . 2 ]" 1
359 1 43 PRO QG 1 44 GLN H . . 4.430 2.336 1.983 2.902 . 0 0 "[ . 1 . 2 ]" 1
360 1 43 PRO HG2 1 44 GLN H . . 4.570 2.356 1.991 2.950 . 0 0 "[ . 1 . 2 ]" 1
361 1 43 PRO HG3 1 44 GLN H . . 4.670 3.906 3.629 4.311 . 0 0 "[ . 1 . 2 ]" 1
362 1 44 GLN H 1 44 GLN HG2 . . 4.710 4.263 2.851 4.659 . 0 0 "[ . 1 . 2 ]" 1
363 1 44 GLN H 1 44 GLN QG . . 4.530 3.520 2.211 4.048 . 0 0 "[ . 1 . 2 ]" 1
364 1 44 GLN H 1 44 GLN HG3 . . 4.710 3.824 2.236 4.484 . 0 0 "[ . 1 . 2 ]" 1
365 1 44 GLN H 1 45 ALA H . . 4.140 2.785 2.603 2.899 . 0 0 "[ . 1 . 2 ]" 1
366 1 44 GLN H 1 45 ALA HA . . 5.730 5.367 5.230 5.466 . 0 0 "[ . 1 . 2 ]" 1
367 1 44 GLN H 1 45 ALA MB . . 5.430 4.454 4.272 4.539 . 0 0 "[ . 1 . 2 ]" 1
368 1 44 GLN H 1 46 PHE H . . 5.690 4.333 4.028 4.740 . 0 0 "[ . 1 . 2 ]" 1
369 1 44 GLN HA 1 46 PHE H . . 4.560 4.113 3.514 4.582 0.022 20 0 "[ . 1 . 2 ]" 1
370 1 44 GLN HA 1 47 ARG QB . . 5.320 2.474 2.023 3.974 . 0 0 "[ . 1 . 2 ]" 1
371 1 44 GLN HB2 1 45 ALA H . . 5.100 3.689 2.820 4.225 . 0 0 "[ . 1 . 2 ]" 1
372 1 44 GLN HB3 1 45 ALA H . . 5.100 3.198 2.705 3.832 . 0 0 "[ . 1 . 2 ]" 1
373 1 44 GLN QG 1 45 ALA H . . 5.110 4.290 3.919 4.572 . 0 0 "[ . 1 . 2 ]" 1
374 1 44 GLN HG2 1 45 ALA H . . 5.410 4.726 4.117 5.309 . 0 0 "[ . 1 . 2 ]" 1
375 1 44 GLN HG3 1 45 ALA H . . 5.410 5.011 4.375 5.307 . 0 0 "[ . 1 . 2 ]" 1
376 1 45 ALA H 1 45 ALA MB . . 3.630 2.235 2.153 2.283 . 0 0 "[ . 1 . 2 ]" 1
377 1 45 ALA H 1 46 PHE H . . 4.100 2.723 2.568 3.052 . 0 0 "[ . 1 . 2 ]" 1
378 1 45 ALA H 1 47 ARG H . . 5.170 4.077 3.888 4.355 . 0 0 "[ . 1 . 2 ]" 1
379 1 45 ALA H 1 59 VAL QG . . 6.590 4.342 3.732 4.623 . 0 0 "[ . 1 . 2 ]" 1
380 1 45 ALA HA 1 47 ARG H . . 4.950 3.910 3.533 4.500 . 0 0 "[ . 1 . 2 ]" 1
381 1 45 ALA MB 1 46 PHE HE1 . . 4.500 3.675 3.273 3.785 . 0 0 "[ . 1 . 2 ]" 1
382 1 45 ALA MB 1 47 ARG H . . 5.910 4.341 4.180 4.588 . 0 0 "[ . 1 . 2 ]" 1
383 1 45 ALA MB 1 59 VAL H . . 5.960 4.142 3.625 4.819 . 0 0 "[ . 1 . 2 ]" 1
384 1 45 ALA MB 1 61 CYS H . . 4.750 3.824 3.432 4.005 . 0 0 "[ . 1 . 2 ]" 1
385 1 45 ALA MB 1 66 ILE H . . 5.250 4.356 4.243 4.490 . 0 0 "[ . 1 . 2 ]" 1
386 1 45 ALA MB 1 66 ILE HB . . 5.000 4.025 3.509 4.202 . 0 0 "[ . 1 . 2 ]" 1
387 1 45 ALA MB 1 66 ILE MD . . 5.000 2.986 2.463 3.552 . 0 0 "[ . 1 . 2 ]" 1
388 1 45 ALA MB 1 66 ILE MG . . 4.500 1.927 1.787 2.009 . 0 0 "[ . 1 . 2 ]" 1
389 1 46 PHE H 1 47 ARG H . . 4.340 2.602 2.336 2.902 . 0 0 "[ . 1 . 2 ]" 1
390 1 46 PHE H 1 47 ARG QB . . 5.290 4.195 3.808 4.644 . 0 0 "[ . 1 . 2 ]" 1
391 1 46 PHE H 1 49 ALA MB . . 5.570 4.390 4.205 4.596 . 0 0 "[ . 1 . 2 ]" 1
392 1 46 PHE H 1 59 VAL QG . . 6.690 4.437 3.642 4.590 . 0 0 "[ . 1 . 2 ]" 1
393 1 46 PHE HA 1 49 ALA H . . 5.060 3.612 3.092 4.090 . 0 0 "[ . 1 . 2 ]" 1
394 1 47 ARG H 1 47 ARG QD . . 5.320 4.169 3.242 4.682 . 0 0 "[ . 1 . 2 ]" 1
395 1 47 ARG H 1 48 ASN HA . . 5.970 5.828 5.144 6.081 0.111 8 0 "[ . 1 . 2 ]" 1
396 1 47 ARG H 1 49 ALA H . . 6.000 4.542 4.317 4.956 . 0 0 "[ . 1 . 2 ]" 1
397 1 47 ARG H 1 49 ALA MB . . 5.300 4.099 3.692 4.472 . 0 0 "[ . 1 . 2 ]" 1
398 1 47 ARG H 1 59 VAL QG . . 6.730 4.089 3.250 4.714 . 0 0 "[ . 1 . 2 ]" 1
399 1 47 ARG HA 1 49 ALA H . . 5.690 4.261 3.753 4.909 . 0 0 "[ . 1 . 2 ]" 1
400 1 48 ASN HA 1 50 ALA H . . 4.440 3.504 2.867 4.462 0.022 21 0 "[ . 1 . 2 ]" 1
401 1 48 ASN QB 1 50 ALA H . . 6.230 4.448 3.792 5.584 . 0 0 "[ . 1 . 2 ]" 1
402 1 48 ASN HB2 1 49 ALA H . . 5.040 4.463 4.249 4.705 . 0 0 "[ . 1 . 2 ]" 1
403 1 48 ASN HB3 1 49 ALA H . . 5.040 4.469 4.362 4.562 . 0 0 "[ . 1 . 2 ]" 1
404 1 49 ALA H 1 50 ALA H . . 4.020 2.937 2.559 3.483 . 0 0 "[ . 1 . 2 ]" 1
405 1 49 ALA H 1 50 ALA MB . . 4.990 4.183 4.080 4.225 . 0 0 "[ . 1 . 2 ]" 1
406 1 49 ALA H 1 59 VAL QG . . 7.280 4.474 3.219 5.451 . 0 0 "[ . 1 . 2 ]" 1
407 1 49 ALA HA 1 57 LYS QD . . 4.990 2.902 2.053 4.477 . 0 0 "[ . 1 . 2 ]" 1
408 1 49 ALA HA 1 57 LYS QG . . 5.880 3.595 2.151 5.294 . 0 0 "[ . 1 . 2 ]" 1
409 1 49 ALA HA 1 59 VAL QG . . 6.720 3.190 2.148 4.404 . 0 0 "[ . 1 . 2 ]" 1
410 1 49 ALA MB 1 50 ALA H . . 4.390 3.316 2.030 3.710 . 0 0 "[ . 1 . 2 ]" 1
411 1 49 ALA MB 1 59 VAL QG . . 5.830 2.664 2.123 3.375 . 0 0 "[ . 1 . 2 ]" 1
412 1 50 ALA H 1 51 THR H . . 4.850 4.538 3.906 4.704 . 0 0 "[ . 1 . 2 ]" 1
413 1 50 ALA H 1 51 THR HA . . 5.570 5.543 5.259 5.669 0.099 21 0 "[ . 1 . 2 ]" 1
414 1 50 ALA H 1 51 THR HB . . 5.560 4.878 4.389 5.564 0.004 9 0 "[ . 1 . 2 ]" 1
415 1 50 ALA H 1 57 LYS QD . . 6.880 3.800 2.941 5.151 . 0 0 "[ . 1 . 2 ]" 1
416 1 50 ALA MB 1 51 THR H . . 3.930 2.974 2.666 3.295 . 0 0 "[ . 1 . 2 ]" 1
417 1 51 THR H 1 51 THR MG . . 4.390 3.161 2.662 3.715 . 0 0 "[ . 1 . 2 ]" 1
418 1 51 THR H 1 70 VAL QG . . 6.240 3.309 3.009 3.911 . 0 0 "[ . 1 . 2 ]" 1
419 1 51 THR HB 1 57 LYS QB . . 4.930 2.421 2.053 3.328 . 0 0 "[ . 1 . 2 ]" 1
420 1 51 THR MG 1 55 THR H . . 4.450 3.741 3.690 3.778 . 0 0 "[ . 1 . 2 ]" 1
421 1 51 THR MG 1 57 LYS H . . 4.100 3.139 2.575 3.444 . 0 0 "[ . 1 . 2 ]" 1
422 1 51 THR MG 1 70 VAL H . . 4.890 3.766 3.448 4.119 . 0 0 "[ . 1 . 2 ]" 1
423 1 51 THR MG 1 70 VAL QG . . 5.570 1.954 1.832 2.084 . 0 0 "[ . 1 . 2 ]" 1
424 1 52 PRO HA 1 53 VAL QG . . 6.370 3.637 3.441 4.302 . 0 0 "[ . 1 . 2 ]" 1
425 1 52 PRO QB 1 53 VAL H . . 4.310 2.594 2.164 3.173 . 0 0 "[ . 1 . 2 ]" 1
426 1 52 PRO QB 1 55 THR MG . . 4.760 3.496 3.204 3.552 . 0 0 "[ . 1 . 2 ]" 1
427 1 52 PRO HB2 1 53 VAL H . . 4.470 2.672 2.189 3.343 . 0 0 "[ . 1 . 2 ]" 1
428 1 52 PRO HB3 1 53 VAL H . . 4.470 3.546 3.404 3.947 . 0 0 "[ . 1 . 2 ]" 1
429 1 52 PRO QG 1 53 VAL H . . 5.430 4.168 3.755 4.540 . 0 0 "[ . 1 . 2 ]" 1
430 1 53 VAL H 1 53 VAL HB . . 4.100 2.422 2.018 3.633 . 0 0 "[ . 1 . 2 ]" 1
431 1 53 VAL H 1 53 VAL MG1 . . 4.620 3.622 2.236 3.745 . 0 0 "[ . 1 . 2 ]" 1
432 1 53 VAL H 1 53 VAL QG . . 3.890 2.169 1.912 2.868 . 0 0 "[ . 1 . 2 ]" 1
433 1 53 VAL H 1 53 VAL MG2 . . 4.620 2.202 2.042 3.123 . 0 0 "[ . 1 . 2 ]" 1
434 1 53 VAL H 1 54 GLY H . . 5.570 4.664 4.621 4.701 . 0 0 "[ . 1 . 2 ]" 1
435 1 53 VAL H 1 55 THR H . . 5.550 5.274 5.169 5.542 . 0 0 "[ . 1 . 2 ]" 1
436 1 53 VAL H 1 70 VAL HB . . 5.970 4.763 4.554 5.993 0.023 16 0 "[ . 1 . 2 ]" 1
437 1 53 VAL H 1 70 VAL QG . . 6.090 3.465 3.224 3.778 . 0 0 "[ . 1 . 2 ]" 1
438 1 53 VAL HA 1 55 THR H . . 4.430 3.472 3.330 3.613 . 0 0 "[ . 1 . 2 ]" 1
439 1 53 VAL HA 1 70 VAL H . . 5.260 4.612 4.355 4.953 . 0 0 "[ . 1 . 2 ]" 1
440 1 53 VAL HA 1 70 VAL HB . . 4.610 2.515 2.252 4.000 . 0 0 "[ . 1 . 2 ]" 1
441 1 53 VAL HA 1 70 VAL MG1 . . 4.610 2.025 1.968 2.176 . 0 0 "[ . 1 . 2 ]" 1
442 1 53 VAL HA 1 70 VAL QG . . 4.180 2.000 1.816 2.147 . 0 0 "[ . 1 . 2 ]" 1
443 1 53 VAL HA 1 70 VAL MG2 . . 4.610 3.698 1.945 3.876 . 0 0 "[ . 1 . 2 ]" 1
444 1 53 VAL HB 1 54 GLY H . . 4.790 3.951 2.491 4.368 . 0 0 "[ . 1 . 2 ]" 1
445 1 53 VAL QG 1 54 GLY H . . 4.240 2.336 2.091 3.191 . 0 0 "[ . 1 . 2 ]" 1
446 1 53 VAL QG 1 54 GLY QA . . 8.440 2.913 2.813 3.327 . 0 0 "[ . 1 . 2 ]" 1
447 1 53 VAL QG 1 55 THR H . . 6.800 4.191 4.078 4.516 . 0 0 "[ . 1 . 2 ]" 1
448 1 53 VAL QG 1 72 PRO HA . . 5.840 2.013 1.925 2.176 . 0 0 "[ . 1 . 2 ]" 1
449 1 53 VAL QG 1 73 ASN H . . 4.880 3.290 3.113 3.519 . 0 0 "[ . 1 . 2 ]" 1
450 1 53 VAL QG 1 85 ASP H . . 7.030 4.889 4.809 5.069 . 0 0 "[ . 1 . 2 ]" 1
451 1 53 VAL QG 1 85 ASP QB . . 5.860 2.115 2.027 2.664 . 0 0 "[ . 1 . 2 ]" 1
452 1 53 VAL MG1 1 54 GLY H . . 4.710 2.388 2.099 3.769 . 0 0 "[ . 1 . 2 ]" 1
453 1 53 VAL MG1 1 73 ASN H . . 5.190 3.627 3.346 3.832 . 0 0 "[ . 1 . 2 ]" 1
454 1 53 VAL MG1 1 85 ASP HB2 . . 7.680 3.292 2.915 5.072 . 0 0 "[ . 1 . 2 ]" 1
455 1 53 VAL MG1 1 85 ASP HB3 . . 7.680 2.227 2.054 4.342 . 0 0 "[ . 1 . 2 ]" 1
456 1 53 VAL MG2 1 54 GLY H . . 4.710 3.820 2.989 3.956 . 0 0 "[ . 1 . 2 ]" 1
457 1 53 VAL MG2 1 73 ASN H . . 5.190 3.796 3.351 4.227 . 0 0 "[ . 1 . 2 ]" 1
458 1 53 VAL MG2 1 85 ASP HB2 . . 7.680 5.394 3.552 5.704 . 0 0 "[ . 1 . 2 ]" 1
459 1 53 VAL MG2 1 85 ASP HB3 . . 7.680 4.623 2.796 4.983 . 0 0 "[ . 1 . 2 ]" 1
460 1 54 GLY H 1 55 THR H . . 4.020 2.598 2.390 2.718 . 0 0 "[ . 1 . 2 ]" 1
461 1 54 GLY H 1 55 THR HA . . 5.900 5.177 5.013 5.276 . 0 0 "[ . 1 . 2 ]" 1
462 1 54 GLY H 1 55 THR MG . . 5.290 4.410 3.935 4.444 . 0 0 "[ . 1 . 2 ]" 1
463 1 54 GLY H 1 70 VAL H . . 5.490 4.150 3.975 4.275 . 0 0 "[ . 1 . 2 ]" 1
464 1 54 GLY H 1 70 VAL HA . . 5.510 5.019 4.828 5.140 . 0 0 "[ . 1 . 2 ]" 1
465 1 54 GLY H 1 70 VAL HB . . 4.470 3.303 2.971 4.649 0.179 16 0 "[ . 1 . 2 ]" 1
466 1 54 GLY H 1 70 VAL QG . . 6.020 3.233 1.906 3.466 . 0 0 "[ . 1 . 2 ]" 1
467 1 54 GLY H 1 85 ASP QB . . 6.010 3.621 3.134 4.137 . 0 0 "[ . 1 . 2 ]" 1
468 1 54 GLY H 1 88 ALA MB . . 5.170 4.320 4.289 4.377 . 0 0 "[ . 1 . 2 ]" 1
469 1 54 GLY H 1 89 ALA H . . 5.340 4.442 4.279 4.559 . 0 0 "[ . 1 . 2 ]" 1
470 1 54 GLY H 1 89 ALA MB . . 4.730 2.869 2.655 3.108 . 0 0 "[ . 1 . 2 ]" 1
471 1 54 GLY QA 1 88 ALA H . . 6.010 4.017 3.859 4.106 . 0 0 "[ . 1 . 2 ]" 1
472 1 54 GLY QA 1 89 ALA H . . 5.490 2.495 2.344 2.599 . 0 0 "[ . 1 . 2 ]" 1
473 1 54 GLY QA 1 90 TYR H . . 6.880 4.942 4.744 5.058 . 0 0 "[ . 1 . 2 ]" 1
474 1 54 GLY HA2 1 88 ALA MB . . 4.500 2.354 2.285 2.450 . 0 0 "[ . 1 . 2 ]" 1
475 1 54 GLY HA2 1 89 ALA MB . . 5.050 2.397 2.223 2.473 . 0 0 "[ . 1 . 2 ]" 1
476 1 55 THR H 1 55 THR MG . . 4.410 2.945 2.367 3.089 . 0 0 "[ . 1 . 2 ]" 1
477 1 55 THR H 1 56 ALA H . . 5.310 4.379 4.269 4.440 . 0 0 "[ . 1 . 2 ]" 1
478 1 55 THR H 1 69 ALA HA . . 5.980 4.903 4.705 5.109 . 0 0 "[ . 1 . 2 ]" 1
479 1 55 THR H 1 70 VAL H . . 4.770 3.252 3.068 3.410 . 0 0 "[ . 1 . 2 ]" 1
480 1 55 THR H 1 70 VAL HB . . 5.210 2.998 2.632 4.694 . 0 0 "[ . 1 . 2 ]" 1
481 1 55 THR H 1 70 VAL MG1 . . 5.080 4.134 1.879 4.281 . 0 0 "[ . 1 . 2 ]" 1
482 1 55 THR H 1 70 VAL MG2 . . 5.080 4.147 3.829 4.259 . 0 0 "[ . 1 . 2 ]" 1
483 1 55 THR H 1 88 ALA MB . . 5.510 4.616 4.533 4.644 . 0 0 "[ . 1 . 2 ]" 1
484 1 55 THR H 1 89 ALA HA . . 4.960 3.285 3.004 3.403 . 0 0 "[ . 1 . 2 ]" 1
485 1 55 THR H 1 89 ALA MB . . 4.940 3.506 3.318 3.630 . 0 0 "[ . 1 . 2 ]" 1
486 1 55 THR H 1 92 ALA MB . . 5.490 4.193 4.068 4.325 . 0 0 "[ . 1 . 2 ]" 1
487 1 55 THR HA 1 92 ALA H . . 5.530 4.312 3.963 4.711 . 0 0 "[ . 1 . 2 ]" 1
488 1 55 THR HA 1 92 ALA MB . . 3.900 2.126 1.964 2.338 . 0 0 "[ . 1 . 2 ]" 1
489 1 55 THR HB 1 56 ALA H . . 3.490 2.201 2.010 3.468 . 0 0 "[ . 1 . 2 ]" 1
490 1 55 THR MG 1 56 ALA H . . 4.800 3.747 3.612 3.825 . 0 0 "[ . 1 . 2 ]" 1
491 1 56 ALA H 1 57 LYS H . . 5.010 4.238 4.089 4.332 . 0 0 "[ . 1 . 2 ]" 1
492 1 56 ALA H 1 69 ALA HA . . 6.000 4.901 4.666 5.074 . 0 0 "[ . 1 . 2 ]" 1
493 1 56 ALA H 1 70 VAL H . . 6.000 5.195 5.068 5.429 . 0 0 "[ . 1 . 2 ]" 1
494 1 56 ALA H 1 89 ALA HA . . 5.470 4.924 4.678 5.072 . 0 0 "[ . 1 . 2 ]" 1
495 1 56 ALA H 1 92 ALA MB . . 3.900 2.318 2.168 2.438 . 0 0 "[ . 1 . 2 ]" 1
496 1 56 ALA HA 1 68 HIS H . . 5.960 4.190 3.838 4.848 . 0 0 "[ . 1 . 2 ]" 1
497 1 56 ALA HA 1 69 ALA H . . 5.960 4.631 4.507 4.840 . 0 0 "[ . 1 . 2 ]" 1
498 1 56 ALA HA 1 69 ALA HA . . 4.330 2.352 2.150 2.483 . 0 0 "[ . 1 . 2 ]" 1
499 1 56 ALA HA 1 69 ALA MB . . 5.150 3.834 3.693 4.001 . 0 0 "[ . 1 . 2 ]" 1
500 1 56 ALA HA 1 70 VAL H . . 4.560 3.483 3.195 3.889 . 0 0 "[ . 1 . 2 ]" 1
501 1 56 ALA HA 1 92 ALA MB . . 5.320 3.688 3.592 3.813 . 0 0 "[ . 1 . 2 ]" 1
502 1 56 ALA MB 1 67 ILE MG . . 3.830 2.023 1.970 2.097 . 0 0 "[ . 1 . 2 ]" 1
503 1 56 ALA MB 1 68 HIS H . . 5.350 3.842 3.516 4.233 . 0 0 "[ . 1 . 2 ]" 1
504 1 56 ALA MB 1 69 ALA H . . 5.700 4.673 4.320 4.770 . 0 0 "[ . 1 . 2 ]" 1
505 1 56 ALA MB 1 92 ALA H . . 5.360 4.149 3.975 4.388 . 0 0 "[ . 1 . 2 ]" 1
506 1 56 ALA MB 1 92 ALA MB . . 4.210 2.082 1.990 2.225 . 0 0 "[ . 1 . 2 ]" 1
507 1 56 ALA MB 1 93 VAL H . . 4.940 2.823 2.557 3.067 . 0 0 "[ . 1 . 2 ]" 1
508 1 56 ALA MB 1 96 GLU H . . 4.800 4.048 4.018 4.076 . 0 0 "[ . 1 . 2 ]" 1
509 1 57 LYS H 1 57 LYS HG2 . . 5.280 4.450 4.056 4.870 . 0 0 "[ . 1 . 2 ]" 1
510 1 57 LYS H 1 57 LYS HG3 . . 5.280 4.600 4.425 4.856 . 0 0 "[ . 1 . 2 ]" 1
511 1 57 LYS H 1 58 THR H . . 4.990 4.187 3.824 4.405 . 0 0 "[ . 1 . 2 ]" 1
512 1 57 LYS H 1 58 THR HA . . 5.330 4.718 4.482 5.030 . 0 0 "[ . 1 . 2 ]" 1
513 1 57 LYS H 1 67 ILE HA . . 5.050 4.256 3.936 4.584 . 0 0 "[ . 1 . 2 ]" 1
514 1 57 LYS H 1 67 ILE MG . . 4.870 3.347 3.089 3.821 . 0 0 "[ . 1 . 2 ]" 1
515 1 57 LYS H 1 68 HIS H . . 4.680 2.552 2.205 3.014 . 0 0 "[ . 1 . 2 ]" 1
516 1 57 LYS H 1 68 HIS HB2 . . 4.910 3.206 2.734 5.021 0.111 13 0 "[ . 1 . 2 ]" 1
517 1 57 LYS H 1 68 HIS QB . . 4.630 3.022 2.686 4.152 . 0 0 "[ . 1 . 2 ]" 1
518 1 57 LYS H 1 68 HIS HB3 . . 4.910 4.097 3.054 4.438 . 0 0 "[ . 1 . 2 ]" 1
519 1 57 LYS H 1 69 ALA H . . 6.000 4.882 4.707 5.124 . 0 0 "[ . 1 . 2 ]" 1
520 1 57 LYS H 1 69 ALA HA . . 4.630 3.893 3.792 4.006 . 0 0 "[ . 1 . 2 ]" 1
521 1 57 LYS H 1 69 ALA MB . . 6.000 4.951 4.808 5.022 . 0 0 "[ . 1 . 2 ]" 1
522 1 57 LYS H 1 70 VAL H . . 5.730 5.131 4.592 5.538 . 0 0 "[ . 1 . 2 ]" 1
523 1 57 LYS H 1 70 VAL QG . . 7.060 4.332 3.717 4.620 . 0 0 "[ . 1 . 2 ]" 1
524 1 57 LYS QB 1 68 HIS H . . 6.520 3.631 3.287 4.073 . 0 0 "[ . 1 . 2 ]" 1
525 1 57 LYS HB2 1 58 THR H . . 4.750 4.402 4.212 4.537 . 0 0 "[ . 1 . 2 ]" 1
526 1 57 LYS HB3 1 58 THR H . . 4.750 4.441 4.136 4.612 . 0 0 "[ . 1 . 2 ]" 1
527 1 57 LYS QE 1 58 THR H . . 6.390 4.774 2.768 5.705 . 0 0 "[ . 1 . 2 ]" 1
528 1 57 LYS QG 1 59 VAL H . . 6.050 4.597 4.254 4.997 . 0 0 "[ . 1 . 2 ]" 1
529 1 57 LYS HG2 1 58 THR H . . 4.420 3.985 3.012 4.487 0.067 13 0 "[ . 1 . 2 ]" 1
530 1 57 LYS HG3 1 58 THR H . . 4.420 3.282 2.768 3.846 . 0 0 "[ . 1 . 2 ]" 1
531 1 58 THR H 1 58 THR HB . . 4.090 2.435 2.293 2.570 . 0 0 "[ . 1 . 2 ]" 1
532 1 58 THR H 1 59 VAL H . . 5.140 4.567 4.400 4.648 . 0 0 "[ . 1 . 2 ]" 1
533 1 58 THR H 1 67 ILE HA . . 5.180 4.312 4.006 4.586 . 0 0 "[ . 1 . 2 ]" 1
534 1 58 THR H 1 67 ILE MG . . 5.370 4.044 3.617 4.485 . 0 0 "[ . 1 . 2 ]" 1
535 1 58 THR H 1 68 HIS H . . 5.930 4.597 4.207 4.882 . 0 0 "[ . 1 . 2 ]" 1
536 1 58 THR HA 1 66 ILE H . . 5.750 4.770 4.356 5.332 . 0 0 "[ . 1 . 2 ]" 1
537 1 58 THR HA 1 67 ILE H . . 5.380 4.608 4.424 4.760 . 0 0 "[ . 1 . 2 ]" 1
538 1 58 THR HA 1 67 ILE HA . . 4.440 2.147 1.999 2.318 . 0 0 "[ . 1 . 2 ]" 1
539 1 58 THR HA 1 67 ILE MG . . 5.110 3.473 3.269 3.900 . 0 0 "[ . 1 . 2 ]" 1
540 1 58 THR HA 1 68 HIS H . . 4.320 3.410 2.850 3.699 . 0 0 "[ . 1 . 2 ]" 1
541 1 58 THR HB 1 59 VAL H . . 5.160 4.149 3.904 4.382 . 0 0 "[ . 1 . 2 ]" 1
542 1 58 THR MG 1 59 VAL H . . 4.410 2.643 2.380 2.916 . 0 0 "[ . 1 . 2 ]" 1
543 1 58 THR MG 1 65 TYR HA . . 4.730 3.118 2.756 3.505 . 0 0 "[ . 1 . 2 ]" 1
544 1 58 THR MG 1 65 TYR HD1 . . 4.300 3.226 2.578 3.577 . 0 0 "[ . 1 . 2 ]" 1
545 1 58 THR MG 1 66 ILE H . . 4.490 3.331 2.880 3.765 . 0 0 "[ . 1 . 2 ]" 1
546 1 58 THR MG 1 67 ILE HA . . 4.440 3.332 2.870 3.764 . 0 0 "[ . 1 . 2 ]" 1
547 1 58 THR MG 1 100 LEU HG . . 3.930 2.814 2.147 3.329 . 0 0 "[ . 1 . 2 ]" 1
548 1 59 VAL H 1 59 VAL HB . . 4.170 2.976 2.701 3.825 . 0 0 "[ . 1 . 2 ]" 1
549 1 59 VAL H 1 60 LYS H . . 5.180 4.111 3.807 4.379 . 0 0 "[ . 1 . 2 ]" 1
550 1 59 VAL H 1 66 ILE H . . 4.750 3.511 2.939 4.013 . 0 0 "[ . 1 . 2 ]" 1
551 1 59 VAL H 1 66 ILE HB . . 5.570 5.477 5.221 5.626 0.056 7 0 "[ . 1 . 2 ]" 1
552 1 59 VAL H 1 66 ILE MD . . 6.500 5.413 5.285 5.506 . 0 0 "[ . 1 . 2 ]" 1
553 1 59 VAL H 1 66 ILE HG12 . . 5.420 4.439 4.099 5.387 . 0 0 "[ . 1 . 2 ]" 1
554 1 59 VAL H 1 66 ILE QG . . 4.890 4.091 3.961 4.225 . 0 0 "[ . 1 . 2 ]" 1
555 1 59 VAL H 1 66 ILE HG13 . . 5.420 5.127 4.285 5.491 0.071 16 0 "[ . 1 . 2 ]" 1
556 1 59 VAL H 1 67 ILE H . . 6.000 5.090 4.963 5.225 . 0 0 "[ . 1 . 2 ]" 1
557 1 59 VAL H 1 67 ILE HA . . 4.620 3.720 3.454 3.901 . 0 0 "[ . 1 . 2 ]" 1
558 1 59 VAL H 1 68 HIS H . . 5.010 4.856 4.185 5.078 0.068 11 0 "[ . 1 . 2 ]" 1
559 1 59 VAL HB 1 60 LYS H . . 4.780 4.094 2.635 4.528 . 0 0 "[ . 1 . 2 ]" 1
560 1 59 VAL HB 1 66 ILE H . . 5.690 5.242 4.352 5.750 0.060 6 0 "[ . 1 . 2 ]" 1
561 1 59 VAL QG 1 60 LYS H . . 4.520 2.862 1.981 3.346 . 0 0 "[ . 1 . 2 ]" 1
562 1 59 VAL MG1 1 60 LYS H . . 5.130 3.075 2.196 3.745 . 0 0 "[ . 1 . 2 ]" 1
563 1 59 VAL MG2 1 60 LYS H . . 5.130 3.997 1.997 4.316 . 0 0 "[ . 1 . 2 ]" 1
564 1 60 LYS H 1 60 LYS HD2 . . 5.300 4.528 3.630 5.308 0.008 8 0 "[ . 1 . 2 ]" 1
565 1 60 LYS H 1 60 LYS HD3 . . 5.300 3.767 2.177 5.354 0.054 16 0 "[ . 1 . 2 ]" 1
566 1 60 LYS H 1 60 LYS HE2 . . 6.000 4.879 3.959 6.054 0.054 16 0 "[ . 1 . 2 ]" 1
567 1 60 LYS H 1 60 LYS QE . . 5.820 4.525 3.799 5.254 . 0 0 "[ . 1 . 2 ]" 1
568 1 60 LYS H 1 60 LYS HE3 . . 6.000 5.492 4.894 5.965 . 0 0 "[ . 1 . 2 ]" 1
569 1 60 LYS H 1 60 LYS HG2 . . 4.930 4.018 3.147 4.513 . 0 0 "[ . 1 . 2 ]" 1
570 1 60 LYS H 1 60 LYS QG . . 4.530 2.903 2.178 4.037 . 0 0 "[ . 1 . 2 ]" 1
571 1 60 LYS H 1 60 LYS HG3 . . 4.930 3.034 2.210 4.633 . 0 0 "[ . 1 . 2 ]" 1
572 1 60 LYS H 1 61 CYS H . . 5.310 4.450 4.037 4.655 . 0 0 "[ . 1 . 2 ]" 1
573 1 60 LYS H 1 66 ILE H . . 5.500 5.084 4.681 5.388 . 0 0 "[ . 1 . 2 ]" 1
574 1 60 LYS HA 1 66 ILE H . . 4.510 3.166 2.700 3.608 . 0 0 "[ . 1 . 2 ]" 1
575 1 60 LYS QB 1 61 CYS H . . 4.390 3.387 3.051 3.836 . 0 0 "[ . 1 . 2 ]" 1
576 1 60 LYS QE 1 63 GLU HA . . 5.470 4.322 2.935 4.883 . 0 0 "[ . 1 . 2 ]" 1
577 1 60 LYS QG 1 64 THR H . . 6.440 4.424 3.745 5.775 . 0 0 "[ . 1 . 2 ]" 1
578 1 60 LYS QG 1 66 ILE H . . 5.660 4.082 3.445 4.672 . 0 0 "[ . 1 . 2 ]" 1
579 1 60 LYS HG2 1 66 ILE H . . 5.950 4.789 3.693 5.297 . 0 0 "[ . 1 . 2 ]" 1
580 1 60 LYS HG3 1 66 ILE H . . 5.950 4.673 3.541 5.958 0.008 21 0 "[ . 1 . 2 ]" 1
581 1 61 CYS H 1 62 ASP H . . 4.740 3.010 2.347 4.409 . 0 0 "[ . 1 . 2 ]" 1
582 1 61 CYS H 1 63 GLU HA . . 5.600 5.438 5.011 5.621 0.021 10 0 "[ . 1 . 2 ]" 1
583 1 61 CYS H 1 64 THR H . . 4.470 3.349 3.056 4.275 . 0 0 "[ . 1 . 2 ]" 1
584 1 61 CYS H 1 64 THR HA . . 5.340 5.349 5.197 5.439 0.099 6 0 "[ . 1 . 2 ]" 1
585 1 61 CYS H 1 64 THR HB . . 5.520 5.198 4.317 5.549 0.029 1 0 "[ . 1 . 2 ]" 1
586 1 61 CYS H 1 64 THR MG . . 5.700 2.854 2.419 3.393 . 0 0 "[ . 1 . 2 ]" 1
587 1 61 CYS H 1 66 ILE H . . 4.710 3.916 3.293 4.479 . 0 0 "[ . 1 . 2 ]" 1
588 1 61 CYS H 1 66 ILE HB . . 5.290 5.260 5.070 5.328 0.038 10 0 "[ . 1 . 2 ]" 1
589 1 61 CYS H 1 66 ILE MG . . 5.950 2.950 2.754 3.118 . 0 0 "[ . 1 . 2 ]" 1
590 1 61 CYS QB 1 62 ASP H . . 5.640 2.446 1.970 3.955 . 0 0 "[ . 1 . 2 ]" 1
591 1 61 CYS QB 1 64 THR H . . 5.270 3.985 3.208 4.639 . 0 0 "[ . 1 . 2 ]" 1
592 1 61 CYS HB2 1 62 ASP H . . 5.830 3.648 3.192 4.635 . 0 0 "[ . 1 . 2 ]" 1
593 1 61 CYS HB2 1 64 THR H . . 5.710 5.213 4.701 5.728 0.018 20 0 "[ . 1 . 2 ]" 1
594 1 61 CYS HB3 1 62 ASP H . . 5.830 2.544 1.981 4.290 . 0 0 "[ . 1 . 2 ]" 1
595 1 61 CYS HB3 1 64 THR H . . 5.710 4.151 3.266 5.075 . 0 0 "[ . 1 . 2 ]" 1
596 1 62 ASP H 1 63 GLU H . . 4.870 2.876 2.523 4.338 . 0 0 "[ . 1 . 2 ]" 1
597 1 62 ASP H 1 64 THR H . . 5.670 3.220 2.529 5.326 . 0 0 "[ . 1 . 2 ]" 1
598 1 62 ASP HA 1 64 THR H . . 5.330 4.937 4.720 5.421 0.091 16 0 "[ . 1 . 2 ]" 1
599 1 62 ASP QB 1 63 GLU H . . 3.680 2.023 1.903 2.188 . 0 0 "[ . 1 . 2 ]" 1
600 1 62 ASP QB 1 64 THR H . . 4.650 3.922 3.333 4.186 . 0 0 "[ . 1 . 2 ]" 1
601 1 62 ASP HB2 1 63 GLU H . . 3.930 2.272 1.973 3.378 . 0 0 "[ . 1 . 2 ]" 1
602 1 62 ASP HB2 1 64 THR H . . 5.190 4.234 3.606 4.857 . 0 0 "[ . 1 . 2 ]" 1
603 1 62 ASP HB3 1 63 GLU H . . 3.930 2.481 1.991 3.224 . 0 0 "[ . 1 . 2 ]" 1
604 1 62 ASP HB3 1 64 THR H . . 5.190 4.812 3.395 5.205 0.015 1 0 "[ . 1 . 2 ]" 1
605 1 63 GLU H 1 63 GLU HG2 . . 4.920 4.102 2.007 4.737 . 0 0 "[ . 1 . 2 ]" 1
606 1 63 GLU H 1 63 GLU QG . . 4.640 3.515 1.982 4.167 . 0 0 "[ . 1 . 2 ]" 1
607 1 63 GLU H 1 63 GLU HG3 . . 4.920 3.987 2.805 4.651 . 0 0 "[ . 1 . 2 ]" 1
608 1 63 GLU H 1 64 THR H . . 3.730 2.539 1.931 3.094 . 0 0 "[ . 1 . 2 ]" 1
609 1 63 GLU H 1 64 THR HA . . 6.000 4.732 4.415 5.054 . 0 0 "[ . 1 . 2 ]" 1
610 1 63 GLU H 1 64 THR HB . . 5.750 3.989 3.413 4.461 . 0 0 "[ . 1 . 2 ]" 1
611 1 64 THR H 1 64 THR MG . . 4.220 2.529 2.080 3.509 . 0 0 "[ . 1 . 2 ]" 1
612 1 64 THR H 1 65 TYR H . . 4.980 4.447 4.298 4.694 . 0 0 "[ . 1 . 2 ]" 1
613 1 64 THR H 1 65 TYR HA . . 5.560 4.866 4.526 5.572 0.012 7 0 "[ . 1 . 2 ]" 1
614 1 64 THR HB 1 65 TYR H . . 5.700 4.052 3.816 4.422 . 0 0 "[ . 1 . 2 ]" 1
615 1 64 THR MG 1 65 TYR H . . 5.270 3.409 2.675 3.858 . 0 0 "[ . 1 . 2 ]" 1
616 1 64 THR MG 1 66 ILE MG . . 4.200 2.589 2.345 2.945 . 0 0 "[ . 1 . 2 ]" 1
617 1 65 TYR H 1 66 ILE H . . 5.050 4.029 3.812 4.329 . 0 0 "[ . 1 . 2 ]" 1
618 1 65 TYR H 1 67 ILE MD . . 6.900 5.703 5.425 5.779 . 0 0 "[ . 1 . 2 ]" 1
619 1 65 TYR H 1 100 LEU QD . . 7.330 5.091 4.360 5.476 . 0 0 "[ . 1 . 2 ]" 1
620 1 65 TYR H 1 102 ILE MD . . 5.700 4.731 4.508 4.794 . 0 0 "[ . 1 . 2 ]" 1
621 1 65 TYR HB2 1 66 ILE H . . 5.640 4.526 4.431 4.629 . 0 0 "[ . 1 . 2 ]" 1
622 1 65 TYR HB3 1 66 ILE H . . 5.640 4.108 3.878 4.292 . 0 0 "[ . 1 . 2 ]" 1
623 1 65 TYR HD1 1 100 LEU QD . . 6.220 2.438 1.892 3.553 . 0 0 "[ . 1 . 2 ]" 1
624 1 65 TYR HD1 1 100 LEU HG . . 4.430 3.321 2.193 4.530 0.100 21 0 "[ . 1 . 2 ]" 1
625 1 65 TYR HD2 1 102 ILE MD . . 5.260 3.565 2.927 3.979 . 0 0 "[ . 1 . 2 ]" 1
626 1 66 ILE H 1 66 ILE MD . . 5.400 4.511 4.383 4.564 . 0 0 "[ . 1 . 2 ]" 1
627 1 66 ILE H 1 66 ILE MG . . 4.680 1.926 1.779 2.026 . 0 0 "[ . 1 . 2 ]" 1
628 1 66 ILE H 1 67 ILE H . . 4.920 4.489 4.330 4.599 . 0 0 "[ . 1 . 2 ]" 1
629 1 66 ILE H 1 67 ILE HA . . 5.370 5.133 4.776 5.427 0.057 7 0 "[ . 1 . 2 ]" 1
630 1 66 ILE H 1 100 LEU QD . . 7.240 5.093 4.507 5.422 . 0 0 "[ . 1 . 2 ]" 1
631 1 66 ILE HB 1 67 ILE H . . 5.080 3.877 3.766 4.048 . 0 0 "[ . 1 . 2 ]" 1
632 1 66 ILE MD 1 67 ILE H . . 4.530 3.517 2.267 3.809 . 0 0 "[ . 1 . 2 ]" 1
633 1 66 ILE QG 1 67 ILE H . . 5.580 2.279 2.016 3.125 . 0 0 "[ . 1 . 2 ]" 1
634 1 66 ILE QG 1 68 HIS H . . 5.540 4.435 3.924 4.676 . 0 0 "[ . 1 . 2 ]" 1
635 1 66 ILE MG 1 67 ILE H . . 5.140 4.124 3.986 4.314 . 0 0 "[ . 1 . 2 ]" 1
636 1 67 ILE H 1 67 ILE MD . . 5.120 3.583 3.260 3.968 . 0 0 "[ . 1 . 2 ]" 1
637 1 67 ILE H 1 67 ILE QG . . 4.240 2.669 2.196 3.013 . 0 0 "[ . 1 . 2 ]" 1
638 1 67 ILE H 1 67 ILE MG . . 4.660 3.821 3.745 3.902 . 0 0 "[ . 1 . 2 ]" 1
639 1 67 ILE H 1 68 HIS H . . 4.890 4.360 4.069 4.514 . 0 0 "[ . 1 . 2 ]" 1
640 1 67 ILE HB 1 68 HIS H . . 5.070 4.120 3.767 4.516 . 0 0 "[ . 1 . 2 ]" 1
641 1 67 ILE MD 1 93 VAL QG . . 5.350 2.772 2.204 3.339 . 0 0 "[ . 1 . 2 ]" 1
642 1 67 ILE MD 1 96 GLU H . . 5.510 4.598 4.513 4.645 . 0 0 "[ . 1 . 2 ]" 1
643 1 67 ILE MD 1 97 ILE H . . 5.270 3.924 3.603 4.352 . 0 0 "[ . 1 . 2 ]" 1
644 1 67 ILE MD 1 102 ILE MD . . 4.300 2.819 2.425 3.019 . 0 0 "[ . 1 . 2 ]" 1
645 1 67 ILE MG 1 68 HIS H . . 4.310 2.731 2.393 3.350 . 0 0 "[ . 1 . 2 ]" 1
646 1 67 ILE MG 1 93 VAL HA . . 4.530 2.402 2.170 2.614 . 0 0 "[ . 1 . 2 ]" 1
647 1 68 HIS H 1 69 ALA H . . 5.450 4.197 4.035 4.385 . 0 0 "[ . 1 . 2 ]" 1
648 1 68 HIS HB2 1 69 ALA H . . 5.230 4.441 3.297 4.729 . 0 0 "[ . 1 . 2 ]" 1
649 1 68 HIS HB3 1 69 ALA H . . 5.230 3.971 3.781 4.579 . 0 0 "[ . 1 . 2 ]" 1
650 1 69 ALA H 1 70 VAL H . . 5.250 4.530 4.438 4.618 . 0 0 "[ . 1 . 2 ]" 1
651 1 69 ALA H 1 70 VAL HA . . 6.000 4.978 4.749 5.096 . 0 0 "[ . 1 . 2 ]" 1
652 1 69 ALA H 1 70 VAL QG . . 7.170 4.427 4.284 5.184 . 0 0 "[ . 1 . 2 ]" 1
653 1 69 ALA H 1 110 LEU QD . . 6.760 3.898 3.691 4.069 . 0 0 "[ . 1 . 2 ]" 1
654 1 69 ALA MB 1 110 LEU MD1 . . 4.010 2.557 2.276 2.783 . 0 0 "[ . 1 . 2 ]" 1
655 1 69 ALA MB 1 110 LEU MD2 . . 4.010 2.389 2.141 2.610 . 0 0 "[ . 1 . 2 ]" 1
656 1 70 VAL H 1 70 VAL QG . . 4.210 2.556 2.079 2.775 . 0 0 "[ . 1 . 2 ]" 1
657 1 70 VAL H 1 71 GLY H . . 5.480 4.360 4.265 4.449 . 0 0 "[ . 1 . 2 ]" 1
658 1 70 VAL H 1 89 ALA MB . . 4.650 3.014 2.618 3.308 . 0 0 "[ . 1 . 2 ]" 1
659 1 70 VAL H 1 92 ALA MB . . 5.950 4.887 4.739 4.975 . 0 0 "[ . 1 . 2 ]" 1
660 1 70 VAL HB 1 71 GLY H . . 5.580 4.327 4.018 4.419 . 0 0 "[ . 1 . 2 ]" 1
661 1 70 VAL QG 1 71 GLY H . . 4.460 2.820 2.534 2.959 . 0 0 "[ . 1 . 2 ]" 1
662 1 70 VAL MG1 1 71 GLY H . . 4.960 2.961 2.569 4.147 . 0 0 "[ . 1 . 2 ]" 1
663 1 70 VAL MG2 1 71 GLY H . . 4.960 3.916 2.559 4.138 . 0 0 "[ . 1 . 2 ]" 1
664 1 71 GLY H 1 72 PRO HD2 . . 5.710 4.909 4.857 4.994 . 0 0 "[ . 1 . 2 ]" 1
665 1 71 GLY H 1 72 PRO QD . . 5.520 4.399 4.364 4.432 . 0 0 "[ . 1 . 2 ]" 1
666 1 71 GLY H 1 72 PRO HD3 . . 5.710 4.970 4.887 5.053 . 0 0 "[ . 1 . 2 ]" 1
667 1 71 GLY H 1 89 ALA MB . . 5.090 4.251 4.151 4.300 . 0 0 "[ . 1 . 2 ]" 1
668 1 71 GLY H 1 110 LEU HG . . 5.230 4.792 4.250 5.235 0.005 10 0 "[ . 1 . 2 ]" 1
669 1 71 GLY QA 1 86 LEU H . . 6.530 5.297 4.932 5.584 . 0 0 "[ . 1 . 2 ]" 1
670 1 71 GLY QA 1 89 ALA MB . . 5.460 2.807 2.617 2.995 . 0 0 "[ . 1 . 2 ]" 1
671 1 72 PRO QB 1 85 ASP H . . 6.120 4.250 4.137 4.422 . 0 0 "[ . 1 . 2 ]" 1
672 1 72 PRO QB 1 86 LEU H . . 5.140 4.105 3.979 4.206 . 0 0 "[ . 1 . 2 ]" 1
673 1 72 PRO HB2 1 86 LEU H . . 5.600 4.888 4.797 5.008 . 0 0 "[ . 1 . 2 ]" 1
674 1 72 PRO HB3 1 86 LEU H . . 5.600 4.413 4.223 4.520 . 0 0 "[ . 1 . 2 ]" 1
675 1 72 PRO QD 1 85 ASP H . . 6.120 4.952 4.728 5.207 . 0 0 "[ . 1 . 2 ]" 1
676 1 72 PRO QD 1 86 LEU H . . 5.030 3.378 3.113 3.600 . 0 0 "[ . 1 . 2 ]" 1
677 1 72 PRO QD 1 87 ALA H . . 5.840 5.041 4.894 5.156 . 0 0 "[ . 1 . 2 ]" 1
678 1 72 PRO HD2 1 86 LEU H . . 5.170 4.056 3.806 4.305 . 0 0 "[ . 1 . 2 ]" 1
679 1 72 PRO HD2 1 87 ALA H . . 6.000 5.892 5.710 6.032 0.032 6 0 "[ . 1 . 2 ]" 1
680 1 72 PRO HD3 1 86 LEU H . . 5.170 3.617 3.269 3.878 . 0 0 "[ . 1 . 2 ]" 1
681 1 72 PRO HD3 1 87 ALA H . . 6.000 5.478 5.239 5.698 . 0 0 "[ . 1 . 2 ]" 1
682 1 72 PRO QG 1 82 GLY H . . 6.880 5.058 4.793 5.310 . 0 0 "[ . 1 . 2 ]" 1
683 1 72 PRO QG 1 83 ASP H . . 6.160 4.770 4.606 4.990 . 0 0 "[ . 1 . 2 ]" 1
684 1 72 PRO QG 1 86 LEU H . . 5.560 2.310 2.225 2.410 . 0 0 "[ . 1 . 2 ]" 1
685 1 72 PRO QG 1 86 LEU HG . . 5.750 5.061 4.951 5.161 . 0 0 "[ . 1 . 2 ]" 1
686 1 72 PRO QG 1 87 ALA H . . 6.760 4.697 4.620 4.782 . 0 0 "[ . 1 . 2 ]" 1
687 1 73 ASN H 1 74 PHE H . . 6.000 3.974 3.736 4.226 . 0 0 "[ . 1 . 2 ]" 1
688 1 73 ASN H 1 77 THR MG . . 4.690 3.312 2.634 3.832 . 0 0 "[ . 1 . 2 ]" 1
689 1 73 ASN HA 1 75 ASN H . . 3.950 3.273 2.953 3.456 . 0 0 "[ . 1 . 2 ]" 1
690 1 73 ASN QB 1 75 ASN H . . 6.460 3.265 2.901 4.034 . 0 0 "[ . 1 . 2 ]" 1
691 1 73 ASN HB2 1 74 PHE H . . 5.140 4.350 3.930 4.663 . 0 0 "[ . 1 . 2 ]" 1
692 1 73 ASN HB3 1 74 PHE H . . 5.140 4.379 3.898 4.616 . 0 0 "[ . 1 . 2 ]" 1
693 1 74 PHE H 1 75 ASN H . . 4.360 2.820 2.668 2.933 . 0 0 "[ . 1 . 2 ]" 1
694 1 74 PHE H 1 75 ASN QB . . 6.380 4.698 4.412 5.029 . 0 0 "[ . 1 . 2 ]" 1
695 1 74 PHE H 1 76 ASN H . . 5.630 4.283 4.166 4.403 . 0 0 "[ . 1 . 2 ]" 1
696 1 74 PHE H 1 77 THR H . . 5.080 4.975 4.608 5.144 0.064 19 0 "[ . 1 . 2 ]" 1
697 1 74 PHE H 1 115 PHE HA . . 4.880 3.701 2.200 4.585 . 0 0 "[ . 1 . 2 ]" 1
698 1 74 PHE H 1 115 PHE QB . . 5.440 4.200 3.350 4.869 . 0 0 "[ . 1 . 2 ]" 1
699 1 74 PHE H 1 117 ALA MB . . 4.990 3.564 2.486 4.181 . 0 0 "[ . 1 . 2 ]" 1
700 1 74 PHE HA 1 76 ASN H . . 4.360 3.683 3.349 3.949 . 0 0 "[ . 1 . 2 ]" 1
701 1 74 PHE HA 1 77 THR H . . 4.980 3.069 2.508 3.440 . 0 0 "[ . 1 . 2 ]" 1
702 1 74 PHE HA 1 77 THR MG . . 4.010 2.135 1.964 2.387 . 0 0 "[ . 1 . 2 ]" 1
703 1 74 PHE QB 1 117 ALA H . . 6.800 3.857 1.932 5.152 . 0 0 "[ . 1 . 2 ]" 1
704 1 74 PHE QB 1 117 ALA MB . . 5.350 2.079 1.975 2.274 . 0 0 "[ . 1 . 2 ]" 1
705 1 74 PHE QB 1 119 LYS QB . . 5.970 4.229 3.409 4.776 . 0 0 "[ . 1 . 2 ]" 1
706 1 74 PHE HB2 1 75 ASN H . . 5.520 3.653 3.031 4.435 . 0 0 "[ . 1 . 2 ]" 1
707 1 74 PHE HB3 1 75 ASN H . . 5.520 3.521 2.903 4.116 . 0 0 "[ . 1 . 2 ]" 1
708 1 74 PHE HD1 1 79 GLU HA . . 3.960 2.984 2.215 3.963 0.003 19 0 "[ . 1 . 2 ]" 1
709 1 75 ASN H 1 76 ASN H . . 3.770 2.483 2.286 2.710 . 0 0 "[ . 1 . 2 ]" 1
710 1 75 ASN H 1 76 ASN HA . . 5.510 5.196 5.010 5.403 . 0 0 "[ . 1 . 2 ]" 1
711 1 75 ASN H 1 77 THR H . . 3.980 3.951 3.707 4.120 0.140 1 0 "[ . 1 . 2 ]" 1
712 1 75 ASN H 1 77 THR MG . . 5.250 4.407 4.336 4.443 . 0 0 "[ . 1 . 2 ]" 1
713 1 75 ASN H 1 117 ALA H . . 4.630 4.487 3.824 4.697 0.067 9 0 "[ . 1 . 2 ]" 1
714 1 75 ASN H 1 117 ALA HA . . 5.280 4.776 4.118 5.320 0.040 18 0 "[ . 1 . 2 ]" 1
715 1 75 ASN H 1 117 ALA MB . . 4.310 2.372 1.948 2.871 . 0 0 "[ . 1 . 2 ]" 1
716 1 75 ASN HA 1 77 THR H . . 4.900 4.199 4.037 4.667 . 0 0 "[ . 1 . 2 ]" 1
717 1 75 ASN HA 1 117 ALA MB . . 4.080 2.388 2.012 2.996 . 0 0 "[ . 1 . 2 ]" 1
718 1 75 ASN HB2 1 76 ASN H . . 4.280 4.023 3.667 4.292 0.012 17 0 "[ . 1 . 2 ]" 1
719 1 75 ASN HB3 1 76 ASN H . . 4.280 3.592 2.861 4.309 0.029 11 0 "[ . 1 . 2 ]" 1
720 1 76 ASN H 1 77 THR H . . 3.640 2.153 1.970 2.450 . 0 0 "[ . 1 . 2 ]" 1
721 1 76 ASN H 1 77 THR HA . . 5.110 4.706 4.560 4.949 . 0 0 "[ . 1 . 2 ]" 1
722 1 76 ASN H 1 77 THR HB . . 5.490 4.307 3.583 4.619 . 0 0 "[ . 1 . 2 ]" 1
723 1 76 ASN H 1 77 THR MG . . 4.530 3.623 3.465 3.785 . 0 0 "[ . 1 . 2 ]" 1
724 1 76 ASN H 1 117 ALA MB . . 5.420 4.210 4.011 4.369 . 0 0 "[ . 1 . 2 ]" 1
725 1 76 ASN QB 1 77 THR H . . 4.360 3.651 3.239 3.794 . 0 0 "[ . 1 . 2 ]" 1
726 1 76 ASN HB2 1 77 THR H . . 4.700 4.285 3.846 4.576 . 0 0 "[ . 1 . 2 ]" 1
727 1 76 ASN HB3 1 77 THR H . . 4.700 3.973 3.486 4.286 . 0 0 "[ . 1 . 2 ]" 1
728 1 77 THR H 1 77 THR HB . . 4.130 3.278 2.890 3.448 . 0 0 "[ . 1 . 2 ]" 1
729 1 77 THR H 1 77 THR MG . . 4.180 2.628 2.357 2.815 . 0 0 "[ . 1 . 2 ]" 1
730 1 77 THR H 1 78 SER H . . 4.590 4.368 4.223 4.500 . 0 0 "[ . 1 . 2 ]" 1
731 1 77 THR H 1 117 ALA MB . . 5.830 4.939 4.865 5.006 . 0 0 "[ . 1 . 2 ]" 1
732 1 77 THR HB 1 78 SER H . . 4.410 3.809 3.570 4.263 . 0 0 "[ . 1 . 2 ]" 1
733 1 77 THR HB 1 82 GLY H . . 5.950 5.727 5.456 5.943 . 0 0 "[ . 1 . 2 ]" 1
734 1 77 THR MG 1 78 SER H . . 4.230 2.862 2.297 3.379 . 0 0 "[ . 1 . 2 ]" 1
735 1 77 THR MG 1 81 GLU H . . 5.140 4.167 3.736 4.309 . 0 0 "[ . 1 . 2 ]" 1
736 1 77 THR MG 1 82 GLY H . . 4.170 2.819 2.566 3.083 . 0 0 "[ . 1 . 2 ]" 1
737 1 77 THR MG 1 82 GLY QA . . 5.610 2.315 2.150 2.531 . 0 0 "[ . 1 . 2 ]" 1
738 1 77 THR MG 1 83 ASP H . . 5.550 4.658 4.577 4.711 . 0 0 "[ . 1 . 2 ]" 1
739 1 78 SER H 1 79 GLU H . . 5.570 4.634 4.474 4.704 . 0 0 "[ . 1 . 2 ]" 1
740 1 78 SER H 1 81 GLU H . . 5.120 3.891 3.512 4.229 . 0 0 "[ . 1 . 2 ]" 1
741 1 78 SER H 1 81 GLU HB2 . . 5.290 2.896 2.203 5.230 . 0 0 "[ . 1 . 2 ]" 1
742 1 78 SER H 1 81 GLU QB . . 4.790 2.821 2.186 4.316 . 0 0 "[ . 1 . 2 ]" 1
743 1 78 SER H 1 81 GLU HB3 . . 5.290 4.306 3.644 4.820 . 0 0 "[ . 1 . 2 ]" 1
744 1 78 SER H 1 81 GLU QG . . 6.880 4.014 2.471 4.768 . 0 0 "[ . 1 . 2 ]" 1
745 1 78 SER H 1 82 GLY H . . 5.600 4.212 3.446 4.780 . 0 0 "[ . 1 . 2 ]" 1
746 1 78 SER HA 1 80 ALA H . . 5.310 4.282 4.063 4.561 . 0 0 "[ . 1 . 2 ]" 1
747 1 78 SER HA 1 81 GLU H . . 5.530 4.972 4.630 5.240 . 0 0 "[ . 1 . 2 ]" 1
748 1 78 SER HA 1 82 GLY H . . 5.820 5.118 4.922 5.272 . 0 0 "[ . 1 . 2 ]" 1
749 1 78 SER QB 1 80 ALA H . . 5.390 2.710 2.211 3.113 . 0 0 "[ . 1 . 2 ]" 1
750 1 78 SER QB 1 81 GLU H . . 5.310 2.660 2.091 3.297 . 0 0 "[ . 1 . 2 ]" 1
751 1 79 GLU H 1 79 GLU HG2 . . 4.730 3.176 2.191 4.506 . 0 0 "[ . 1 . 2 ]" 1
752 1 79 GLU H 1 79 GLU QG . . 4.250 2.595 2.049 3.884 . 0 0 "[ . 1 . 2 ]" 1
753 1 79 GLU H 1 79 GLU HG3 . . 4.730 3.178 2.067 4.401 . 0 0 "[ . 1 . 2 ]" 1
754 1 79 GLU H 1 80 ALA H . . 4.960 2.754 2.537 3.013 . 0 0 "[ . 1 . 2 ]" 1
755 1 79 GLU H 1 80 ALA MB . . 5.380 4.355 4.162 4.512 . 0 0 "[ . 1 . 2 ]" 1
756 1 79 GLU H 1 81 GLU H . . 6.000 4.747 4.359 5.063 . 0 0 "[ . 1 . 2 ]" 1
757 1 79 GLU H 1 82 GLY H . . 6.000 4.720 4.553 4.843 . 0 0 "[ . 1 . 2 ]" 1
758 1 79 GLU HA 1 81 GLU H . . 5.590 4.866 4.430 5.023 . 0 0 "[ . 1 . 2 ]" 1
759 1 79 GLU HA 1 82 GLY H . . 5.470 3.450 3.108 3.718 . 0 0 "[ . 1 . 2 ]" 1
760 1 79 GLU HA 1 83 ASP H . . 4.870 3.660 3.248 4.007 . 0 0 "[ . 1 . 2 ]" 1
761 1 79 GLU QB 1 80 ALA H . . 4.550 3.250 2.636 3.675 . 0 0 "[ . 1 . 2 ]" 1
762 1 79 GLU QB 1 83 ASP H . . 5.390 4.517 4.111 4.861 . 0 0 "[ . 1 . 2 ]" 1
763 1 79 GLU QG 1 80 ALA H . . 6.590 3.065 2.057 4.569 . 0 0 "[ . 1 . 2 ]" 1
764 1 80 ALA H 1 81 GLU H . . 4.310 2.965 2.750 3.247 . 0 0 "[ . 1 . 2 ]" 1
765 1 80 ALA H 1 81 GLU QB . . 5.850 4.790 4.541 5.203 . 0 0 "[ . 1 . 2 ]" 1
766 1 80 ALA H 1 82 GLY H . . 4.950 3.840 3.721 4.093 . 0 0 "[ . 1 . 2 ]" 1
767 1 80 ALA H 1 83 ASP H . . 5.220 4.749 4.579 4.966 . 0 0 "[ . 1 . 2 ]" 1
768 1 80 ALA HA 1 82 GLY H . . 5.130 4.259 4.099 4.478 . 0 0 "[ . 1 . 2 ]" 1
769 1 80 ALA HA 1 83 ASP H . . 4.620 3.891 3.582 4.223 . 0 0 "[ . 1 . 2 ]" 1
770 1 80 ALA HA 1 84 ARG H . . 4.640 4.125 3.817 4.327 . 0 0 "[ . 1 . 2 ]" 1
771 1 80 ALA MB 1 81 GLU H . . 3.760 2.147 2.065 2.236 . 0 0 "[ . 1 . 2 ]" 1
772 1 80 ALA MB 1 82 GLY H . . 4.820 4.077 4.041 4.116 . 0 0 "[ . 1 . 2 ]" 1
773 1 81 GLU H 1 81 GLU HG2 . . 4.210 3.459 2.191 3.896 . 0 0 "[ . 1 . 2 ]" 1
774 1 81 GLU H 1 81 GLU QG . . 3.940 2.386 2.152 2.687 . 0 0 "[ . 1 . 2 ]" 1
775 1 81 GLU H 1 81 GLU HG3 . . 4.210 2.552 2.173 3.612 . 0 0 "[ . 1 . 2 ]" 1
776 1 81 GLU H 1 82 GLY H . . 4.120 2.572 2.455 2.690 . 0 0 "[ . 1 . 2 ]" 1
777 1 81 GLU H 1 82 GLY QA . . 6.390 4.468 4.381 4.572 . 0 0 "[ . 1 . 2 ]" 1
778 1 81 GLU H 1 83 ASP H . . 5.510 4.476 4.208 4.878 . 0 0 "[ . 1 . 2 ]" 1
779 1 81 GLU H 1 84 ARG H . . 5.700 4.871 4.738 4.965 . 0 0 "[ . 1 . 2 ]" 1
780 1 81 GLU HA 1 83 ASP H . . 5.500 4.691 4.302 5.153 . 0 0 "[ . 1 . 2 ]" 1
781 1 81 GLU HA 1 84 ARG H . . 4.640 3.702 3.443 4.015 . 0 0 "[ . 1 . 2 ]" 1
782 1 81 GLU HA 1 85 ASP H . . 5.910 3.747 3.451 3.920 . 0 0 "[ . 1 . 2 ]" 1
783 1 81 GLU QB 1 82 GLY H . . 4.300 2.830 2.574 3.547 . 0 0 "[ . 1 . 2 ]" 1
784 1 81 GLU HB2 1 82 GLY H . . 4.570 2.939 2.641 4.023 . 0 0 "[ . 1 . 2 ]" 1
785 1 81 GLU HB3 1 82 GLY H . . 4.570 3.762 3.540 3.992 . 0 0 "[ . 1 . 2 ]" 1
786 1 81 GLU HG2 1 82 GLY H . . 5.140 4.936 2.316 5.176 0.036 6 0 "[ . 1 . 2 ]" 1
787 1 81 GLU HG3 1 82 GLY H . . 5.140 4.494 2.907 5.070 . 0 0 "[ . 1 . 2 ]" 1
788 1 82 GLY H 1 83 ASP H . . 4.310 2.629 2.499 2.747 . 0 0 "[ . 1 . 2 ]" 1
789 1 82 GLY H 1 83 ASP HA . . 6.000 5.285 5.187 5.373 . 0 0 "[ . 1 . 2 ]" 1
790 1 82 GLY H 1 83 ASP HB2 . . 5.970 4.706 4.508 5.169 . 0 0 "[ . 1 . 2 ]" 1
791 1 82 GLY H 1 83 ASP QB . . 5.790 4.461 4.386 4.563 . 0 0 "[ . 1 . 2 ]" 1
792 1 82 GLY H 1 83 ASP HB3 . . 5.970 5.734 4.988 6.037 0.067 17 0 "[ . 1 . 2 ]" 1
793 1 82 GLY H 1 84 ARG H . . 5.230 3.943 3.699 4.250 . 0 0 "[ . 1 . 2 ]" 1
794 1 82 GLY H 1 85 ASP H . . 6.000 4.691 4.483 4.940 . 0 0 "[ . 1 . 2 ]" 1
795 1 82 GLY QA 1 85 ASP H . . 5.990 3.666 3.418 3.906 . 0 0 "[ . 1 . 2 ]" 1
796 1 82 GLY HA2 1 84 ARG H . . 5.940 4.580 4.360 4.769 . 0 0 "[ . 1 . 2 ]" 1
797 1 83 ASP H 1 83 ASP HB2 . . 4.050 2.324 2.152 2.549 . 0 0 "[ . 1 . 2 ]" 1
798 1 83 ASP H 1 83 ASP QB . . 3.850 2.247 2.131 2.370 . 0 0 "[ . 1 . 2 ]" 1
799 1 83 ASP H 1 83 ASP HB3 . . 4.050 3.262 2.581 3.611 . 0 0 "[ . 1 . 2 ]" 1
800 1 83 ASP H 1 84 ARG H . . 4.120 2.559 2.325 2.785 . 0 0 "[ . 1 . 2 ]" 1
801 1 83 ASP H 1 84 ARG HA . . 5.640 5.217 4.995 5.391 . 0 0 "[ . 1 . 2 ]" 1
802 1 83 ASP H 1 84 ARG QB . . 5.170 4.299 4.019 4.618 . 0 0 "[ . 1 . 2 ]" 1
803 1 83 ASP H 1 85 ASP H . . 5.170 4.313 3.967 4.563 . 0 0 "[ . 1 . 2 ]" 1
804 1 83 ASP HA 1 85 ASP H . . 5.310 4.685 4.515 4.847 . 0 0 "[ . 1 . 2 ]" 1
805 1 83 ASP HA 1 86 LEU H . . 4.880 3.417 3.014 3.710 . 0 0 "[ . 1 . 2 ]" 1
806 1 83 ASP HA 1 86 LEU QB . . 6.310 2.435 2.131 2.713 . 0 0 "[ . 1 . 2 ]" 1
807 1 83 ASP HA 1 87 ALA H . . 5.120 4.076 3.756 4.416 . 0 0 "[ . 1 . 2 ]" 1
808 1 83 ASP QB 1 84 ARG H . . 4.360 2.701 2.390 3.087 . 0 0 "[ . 1 . 2 ]" 1
809 1 83 ASP HB2 1 84 ARG H . . 4.610 3.200 2.528 3.801 . 0 0 "[ . 1 . 2 ]" 1
810 1 83 ASP HB3 1 84 ARG H . . 4.610 3.174 2.421 3.738 . 0 0 "[ . 1 . 2 ]" 1
811 1 84 ARG H 1 84 ARG QD . . 4.970 4.094 2.743 4.473 . 0 0 "[ . 1 . 2 ]" 1
812 1 84 ARG H 1 84 ARG QG . . 4.720 3.629 2.530 4.012 . 0 0 "[ . 1 . 2 ]" 1
813 1 84 ARG H 1 85 ASP H . . 4.070 2.863 2.734 2.964 . 0 0 "[ . 1 . 2 ]" 1
814 1 84 ARG H 1 86 LEU H . . 5.490 4.090 3.908 4.226 . 0 0 "[ . 1 . 2 ]" 1
815 1 84 ARG H 1 87 ALA H . . 5.170 4.783 4.603 4.915 . 0 0 "[ . 1 . 2 ]" 1
816 1 84 ARG HA 1 86 LEU H . . 5.080 4.460 4.323 4.581 . 0 0 "[ . 1 . 2 ]" 1
817 1 84 ARG HA 1 87 ALA H . . 4.730 3.598 3.418 3.757 . 0 0 "[ . 1 . 2 ]" 1
818 1 84 ARG HA 1 87 ALA MB . . 4.300 2.889 2.648 3.064 . 0 0 "[ . 1 . 2 ]" 1
819 1 84 ARG HA 1 88 ALA H . . 5.060 4.255 4.134 4.348 . 0 0 "[ . 1 . 2 ]" 1
820 1 84 ARG QB 1 85 ASP H . . 4.490 2.430 2.275 2.586 . 0 0 "[ . 1 . 2 ]" 1
821 1 84 ARG QD 1 85 ASP H . . 6.000 4.394 3.066 5.194 . 0 0 "[ . 1 . 2 ]" 1
822 1 84 ARG QG 1 85 ASP H . . 4.820 3.996 3.422 4.315 . 0 0 "[ . 1 . 2 ]" 1
823 1 85 ASP H 1 86 LEU H . . 4.290 2.723 2.634 2.833 . 0 0 "[ . 1 . 2 ]" 1
824 1 85 ASP H 1 87 ALA H . . 4.990 4.200 4.070 4.338 . 0 0 "[ . 1 . 2 ]" 1
825 1 85 ASP H 1 88 ALA MB . . 5.510 4.334 4.220 4.452 . 0 0 "[ . 1 . 2 ]" 1
826 1 85 ASP HA 1 87 ALA H . . 5.300 4.229 4.032 4.426 . 0 0 "[ . 1 . 2 ]" 1
827 1 85 ASP HA 1 88 ALA H . . 4.430 3.005 2.784 3.193 . 0 0 "[ . 1 . 2 ]" 1
828 1 85 ASP HA 1 88 ALA MB . . 4.040 2.112 2.005 2.255 . 0 0 "[ . 1 . 2 ]" 1
829 1 85 ASP HA 1 89 ALA H . . 4.860 3.863 3.706 4.021 . 0 0 "[ . 1 . 2 ]" 1
830 1 85 ASP QB 1 87 ALA H . . 6.750 4.782 4.690 4.919 . 0 0 "[ . 1 . 2 ]" 1
831 1 85 ASP QB 1 88 ALA H . . 6.720 4.584 4.391 4.702 . 0 0 "[ . 1 . 2 ]" 1
832 1 85 ASP HB2 1 86 LEU H . . 5.230 3.097 2.847 3.364 . 0 0 "[ . 1 . 2 ]" 1
833 1 85 ASP HB3 1 86 LEU H . . 5.230 3.558 3.299 3.877 . 0 0 "[ . 1 . 2 ]" 1
834 1 86 LEU H 1 86 LEU QD . . 4.800 3.615 3.595 3.632 . 0 0 "[ . 1 . 2 ]" 1
835 1 86 LEU H 1 86 LEU HG . . 5.000 4.405 4.306 4.480 . 0 0 "[ . 1 . 2 ]" 1
836 1 86 LEU H 1 87 ALA H . . 4.100 2.635 2.575 2.722 . 0 0 "[ . 1 . 2 ]" 1
837 1 86 LEU H 1 87 ALA HA . . 5.950 5.296 5.252 5.362 . 0 0 "[ . 1 . 2 ]" 1
838 1 86 LEU H 1 88 ALA H . . 5.670 3.913 3.810 3.993 . 0 0 "[ . 1 . 2 ]" 1
839 1 86 LEU H 1 88 ALA MB . . 5.900 4.544 4.471 4.621 . 0 0 "[ . 1 . 2 ]" 1
840 1 86 LEU HA 1 88 ALA H . . 5.000 4.317 4.141 4.461 . 0 0 "[ . 1 . 2 ]" 1
841 1 86 LEU HA 1 89 ALA H . . 4.580 3.486 3.368 3.654 . 0 0 "[ . 1 . 2 ]" 1
842 1 86 LEU HA 1 89 ALA MB . . 4.300 2.836 2.666 2.962 . 0 0 "[ . 1 . 2 ]" 1
843 1 86 LEU HA 1 90 TYR H . . 5.000 4.277 4.108 4.573 . 0 0 "[ . 1 . 2 ]" 1
844 1 86 LEU QB 1 87 ALA H . . 4.410 2.574 2.445 2.639 . 0 0 "[ . 1 . 2 ]" 1
845 1 86 LEU HB2 1 87 ALA H . . 4.630 3.895 3.800 3.963 . 0 0 "[ . 1 . 2 ]" 1
846 1 86 LEU HB3 1 87 ALA H . . 4.630 2.612 2.475 2.680 . 0 0 "[ . 1 . 2 ]" 1
847 1 86 LEU QD 1 110 LEU QD . . 6.440 2.968 2.682 3.284 . 0 0 "[ . 1 . 2 ]" 1
848 1 86 LEU HG 1 87 ALA H . . 4.620 3.825 3.609 3.959 . 0 0 "[ . 1 . 2 ]" 1
849 1 86 LEU HG 1 125 SER HA . . 4.040 3.866 3.323 4.105 0.065 17 0 "[ . 1 . 2 ]" 1
850 1 86 LEU HG 1 128 HIS H . . 5.350 5.289 5.087 5.389 0.039 4 0 "[ . 1 . 2 ]" 1
851 1 86 LEU HG 1 128 HIS HD2 . . 4.700 3.533 2.981 4.717 0.017 19 0 "[ . 1 . 2 ]" 1
852 1 87 ALA H 1 88 ALA H . . 4.050 2.497 2.462 2.528 . 0 0 "[ . 1 . 2 ]" 1
853 1 87 ALA H 1 88 ALA MB . . 4.900 4.133 4.123 4.143 . 0 0 "[ . 1 . 2 ]" 1
854 1 87 ALA H 1 89 ALA H . . 4.900 4.156 4.022 4.249 . 0 0 "[ . 1 . 2 ]" 1
855 1 87 ALA HA 1 90 TYR H . . 4.650 3.579 3.401 3.783 . 0 0 "[ . 1 . 2 ]" 1
856 1 87 ALA HA 1 90 TYR QB . . 6.250 2.917 2.725 3.297 . 0 0 "[ . 1 . 2 ]" 1
857 1 87 ALA HA 1 91 ARG H . . 5.450 4.043 3.832 4.198 . 0 0 "[ . 1 . 2 ]" 1
858 1 87 ALA HA 1 128 HIS QB . . 4.080 2.272 2.108 2.513 . 0 0 "[ . 1 . 2 ]" 1
859 1 87 ALA MB 1 88 ALA H . . 3.660 2.669 2.563 2.850 . 0 0 "[ . 1 . 2 ]" 1
860 1 87 ALA MB 1 91 ARG H . . 5.720 4.504 4.339 4.580 . 0 0 "[ . 1 . 2 ]" 1
861 1 87 ALA MB 1 128 HIS QB . . 4.460 2.703 2.375 3.025 . 0 0 "[ . 1 . 2 ]" 1
862 1 88 ALA H 1 89 ALA H . . 4.100 2.680 2.549 2.770 . 0 0 "[ . 1 . 2 ]" 1
863 1 88 ALA H 1 90 TYR H . . 4.910 4.361 4.179 4.497 . 0 0 "[ . 1 . 2 ]" 1
864 1 88 ALA HA 1 90 TYR H . . 5.370 4.757 4.614 4.847 . 0 0 "[ . 1 . 2 ]" 1
865 1 88 ALA HA 1 91 ARG H . . 4.570 3.441 3.334 3.567 . 0 0 "[ . 1 . 2 ]" 1
866 1 88 ALA HA 1 91 ARG QB . . 5.160 2.540 2.371 2.743 . 0 0 "[ . 1 . 2 ]" 1
867 1 88 ALA HA 1 92 ALA H . . 4.850 4.047 3.862 4.191 . 0 0 "[ . 1 . 2 ]" 1
868 1 88 ALA MB 1 89 ALA H . . 4.090 2.478 2.372 2.574 . 0 0 "[ . 1 . 2 ]" 1
869 1 89 ALA H 1 90 TYR H . . 4.200 2.823 2.750 2.894 . 0 0 "[ . 1 . 2 ]" 1
870 1 89 ALA H 1 91 ARG H . . 4.870 4.078 3.942 4.233 . 0 0 "[ . 1 . 2 ]" 1
871 1 89 ALA HA 1 91 ARG H . . 5.740 4.528 4.381 4.683 . 0 0 "[ . 1 . 2 ]" 1
872 1 89 ALA HA 1 92 ALA H . . 4.650 3.601 3.501 3.764 . 0 0 "[ . 1 . 2 ]" 1
873 1 89 ALA HA 1 92 ALA MB . . 4.240 2.848 2.658 3.020 . 0 0 "[ . 1 . 2 ]" 1
874 1 89 ALA MB 1 90 TYR H . . 3.980 2.308 2.217 2.397 . 0 0 "[ . 1 . 2 ]" 1
875 1 89 ALA MB 1 92 ALA H . . 5.710 4.662 4.574 4.754 . 0 0 "[ . 1 . 2 ]" 1
876 1 89 ALA MB 1 110 LEU QD . . 5.480 2.876 2.545 3.290 . 0 0 "[ . 1 . 2 ]" 1
877 1 90 TYR H 1 91 ARG H . . 4.170 2.815 2.701 2.944 . 0 0 "[ . 1 . 2 ]" 1
878 1 90 TYR H 1 92 ALA H . . 4.970 4.266 4.182 4.403 . 0 0 "[ . 1 . 2 ]" 1
879 1 90 TYR H 1 93 VAL H . . 6.000 4.837 4.734 4.992 . 0 0 "[ . 1 . 2 ]" 1
880 1 90 TYR H 1 110 LEU QD . . 6.680 4.548 4.047 4.990 . 0 0 "[ . 1 . 2 ]" 1
881 1 90 TYR H 1 128 HIS QB . . 5.400 4.852 4.762 4.924 . 0 0 "[ . 1 . 2 ]" 1
882 1 90 TYR HA 1 92 ALA H . . 5.390 4.291 4.195 4.398 . 0 0 "[ . 1 . 2 ]" 1
883 1 90 TYR HA 1 93 VAL H . . 4.590 3.307 3.105 3.583 . 0 0 "[ . 1 . 2 ]" 1
884 1 90 TYR HA 1 93 VAL HB . . 4.760 2.815 2.465 4.299 . 0 0 "[ . 1 . 2 ]" 1
885 1 90 TYR HA 1 93 VAL QG . . 5.590 2.780 1.949 2.965 . 0 0 "[ . 1 . 2 ]" 1
886 1 90 TYR HA 1 94 ALA H . . 4.960 4.012 3.853 4.231 . 0 0 "[ . 1 . 2 ]" 1
887 1 90 TYR HA 1 129 LEU HA . . 4.610 4.325 4.036 4.517 . 0 0 "[ . 1 . 2 ]" 1
888 1 90 TYR QB 1 132 ALA H . . 5.130 3.971 3.704 4.370 . 0 0 "[ . 1 . 2 ]" 1
889 1 90 TYR QB 1 132 ALA MB . . 5.430 2.236 1.961 3.053 . 0 0 "[ . 1 . 2 ]" 1
890 1 90 TYR QB 1 133 MET H . . 6.120 4.180 3.685 4.771 . 0 0 "[ . 1 . 2 ]" 1
891 1 90 TYR HB2 1 91 ARG H . . 5.050 2.701 2.519 2.893 . 0 0 "[ . 1 . 2 ]" 1
892 1 90 TYR HB2 1 132 ALA H . . 5.500 4.795 4.249 5.477 . 0 0 "[ . 1 . 2 ]" 1
893 1 90 TYR HB3 1 91 ARG H . . 5.050 3.643 3.371 3.899 . 0 0 "[ . 1 . 2 ]" 1
894 1 90 TYR HB3 1 132 ALA H . . 5.500 4.251 4.005 4.592 . 0 0 "[ . 1 . 2 ]" 1
895 1 90 TYR HD1 1 107 ILE MD . . 4.290 2.740 2.161 3.363 . 0 0 "[ . 1 . 2 ]" 1
896 1 91 ARG H 1 91 ARG HB2 . . 4.190 2.445 2.327 2.571 . 0 0 "[ . 1 . 2 ]" 1
897 1 91 ARG H 1 91 ARG HB3 . . 4.190 2.581 2.457 2.718 . 0 0 "[ . 1 . 2 ]" 1
898 1 91 ARG H 1 91 ARG QD . . 5.360 4.289 3.980 4.514 . 0 0 "[ . 1 . 2 ]" 1
899 1 91 ARG H 1 91 ARG QG . . 5.130 3.985 3.919 4.072 . 0 0 "[ . 1 . 2 ]" 1
900 1 91 ARG H 1 92 ALA H . . 4.090 2.663 2.576 2.757 . 0 0 "[ . 1 . 2 ]" 1
901 1 91 ARG H 1 92 ALA MB . . 5.510 4.327 4.244 4.412 . 0 0 "[ . 1 . 2 ]" 1
902 1 91 ARG H 1 93 VAL H . . 5.090 4.162 4.015 4.268 . 0 0 "[ . 1 . 2 ]" 1
903 1 91 ARG H 1 93 VAL QG . . 7.180 4.887 4.078 5.037 . 0 0 "[ . 1 . 2 ]" 1
904 1 91 ARG H 1 94 ALA H . . 5.840 4.858 4.705 4.957 . 0 0 "[ . 1 . 2 ]" 1
905 1 91 ARG H 1 94 ALA MB . . 5.850 4.664 4.502 4.835 . 0 0 "[ . 1 . 2 ]" 1
906 1 91 ARG H 1 132 ALA MB . . 4.660 3.192 2.727 3.715 . 0 0 "[ . 1 . 2 ]" 1
907 1 91 ARG HA 1 93 VAL H . . 4.870 4.417 4.265 4.674 . 0 0 "[ . 1 . 2 ]" 1
908 1 91 ARG HA 1 94 ALA H . . 4.540 3.502 3.192 3.717 . 0 0 "[ . 1 . 2 ]" 1
909 1 91 ARG HA 1 94 ALA MB . . 4.200 2.469 2.260 2.752 . 0 0 "[ . 1 . 2 ]" 1
910 1 91 ARG HA 1 95 ALA H . . 5.260 4.078 3.861 4.239 . 0 0 "[ . 1 . 2 ]" 1
911 1 91 ARG HA 1 132 ALA MB . . 4.350 2.051 1.936 2.196 . 0 0 "[ . 1 . 2 ]" 1
912 1 91 ARG QB 1 92 ALA H . . 4.490 2.750 2.570 2.973 . 0 0 "[ . 1 . 2 ]" 1
913 1 91 ARG HB2 1 92 ALA H . . 4.880 3.955 3.768 4.110 . 0 0 "[ . 1 . 2 ]" 1
914 1 91 ARG HB3 1 92 ALA H . . 4.880 2.806 2.608 3.051 . 0 0 "[ . 1 . 2 ]" 1
915 1 91 ARG QG 1 92 ALA H . . 4.600 3.904 3.614 4.106 . 0 0 "[ . 1 . 2 ]" 1
916 1 91 ARG QG 1 95 ALA H . . 5.350 4.234 4.043 4.353 . 0 0 "[ . 1 . 2 ]" 1
917 1 92 ALA H 1 93 VAL H . . 4.110 2.628 2.541 2.696 . 0 0 "[ . 1 . 2 ]" 1
918 1 92 ALA H 1 93 VAL HA . . 5.510 5.258 5.191 5.312 . 0 0 "[ . 1 . 2 ]" 1
919 1 92 ALA H 1 93 VAL HB . . 5.390 4.822 4.657 5.315 . 0 0 "[ . 1 . 2 ]" 1
920 1 92 ALA H 1 93 VAL QG . . 6.580 4.118 3.718 4.234 . 0 0 "[ . 1 . 2 ]" 1
921 1 92 ALA H 1 94 ALA H . . 5.140 4.342 4.029 4.588 . 0 0 "[ . 1 . 2 ]" 1
922 1 92 ALA H 1 94 ALA MB . . 5.990 4.706 4.530 4.949 . 0 0 "[ . 1 . 2 ]" 1
923 1 92 ALA H 1 95 ALA H . . 5.360 4.677 4.532 4.770 . 0 0 "[ . 1 . 2 ]" 1
924 1 92 ALA HA 1 94 ALA H . . 5.330 4.779 4.544 4.996 . 0 0 "[ . 1 . 2 ]" 1
925 1 92 ALA HA 1 95 ALA H . . 4.520 3.372 3.266 3.515 . 0 0 "[ . 1 . 2 ]" 1
926 1 92 ALA HA 1 95 ALA MB . . 4.300 2.611 2.425 2.796 . 0 0 "[ . 1 . 2 ]" 1
927 1 92 ALA HA 1 96 GLU H . . 4.890 4.175 4.031 4.304 . 0 0 "[ . 1 . 2 ]" 1
928 1 92 ALA MB 1 93 VAL H . . 4.160 2.595 2.477 2.699 . 0 0 "[ . 1 . 2 ]" 1
929 1 93 VAL H 1 93 VAL HB . . 4.120 2.517 2.416 2.734 . 0 0 "[ . 1 . 2 ]" 1
930 1 93 VAL H 1 93 VAL QG . . 4.090 2.181 1.974 2.305 . 0 0 "[ . 1 . 2 ]" 1
931 1 93 VAL H 1 94 ALA H . . 4.130 2.854 2.747 2.967 . 0 0 "[ . 1 . 2 ]" 1
932 1 93 VAL H 1 94 ALA HA . . 6.000 5.396 5.326 5.451 . 0 0 "[ . 1 . 2 ]" 1
933 1 93 VAL H 1 94 ALA MB . . 5.160 4.306 4.255 4.321 . 0 0 "[ . 1 . 2 ]" 1
934 1 93 VAL H 1 95 ALA H . . 4.890 4.114 4.002 4.295 . 0 0 "[ . 1 . 2 ]" 1
935 1 93 VAL HA 1 95 ALA H . . 5.540 4.337 4.161 4.549 . 0 0 "[ . 1 . 2 ]" 1
936 1 93 VAL HA 1 96 GLU H . . 4.810 3.400 3.175 3.571 . 0 0 "[ . 1 . 2 ]" 1
937 1 93 VAL HA 1 97 ILE H . . 5.080 4.437 4.297 4.646 . 0 0 "[ . 1 . 2 ]" 1
938 1 93 VAL HB 1 94 ALA H . . 4.090 2.440 2.177 4.045 . 0 0 "[ . 1 . 2 ]" 1
939 1 93 VAL QG 1 94 ALA H . . 4.730 2.928 2.117 3.130 . 0 0 "[ . 1 . 2 ]" 1
940 1 93 VAL QG 1 95 ALA H . . 7.290 4.505 4.250 4.693 . 0 0 "[ . 1 . 2 ]" 1
941 1 93 VAL QG 1 107 ILE MD . . 5.710 2.082 1.881 2.668 . 0 0 "[ . 1 . 2 ]" 1
942 1 93 VAL MG1 1 94 ALA H . . 5.360 3.053 2.140 3.348 . 0 0 "[ . 1 . 2 ]" 1
943 1 93 VAL MG2 1 94 ALA H . . 5.360 3.802 3.350 3.925 . 0 0 "[ . 1 . 2 ]" 1
944 1 94 ALA H 1 95 ALA H . . 4.140 2.921 2.754 3.133 . 0 0 "[ . 1 . 2 ]" 1
945 1 94 ALA H 1 96 GLU H . . 4.800 4.504 4.314 4.691 . 0 0 "[ . 1 . 2 ]" 1
946 1 94 ALA H 1 97 ILE MD . . 5.430 4.233 3.830 4.561 . 0 0 "[ . 1 . 2 ]" 1
947 1 94 ALA H 1 97 ILE QG . . 5.130 3.976 3.772 4.140 . 0 0 "[ . 1 . 2 ]" 1
948 1 94 ALA H 1 132 ALA MB . . 4.570 3.477 3.179 3.808 . 0 0 "[ . 1 . 2 ]" 1
949 1 94 ALA H 1 133 MET QB . . 5.850 5.164 4.892 5.292 . 0 0 "[ . 1 . 2 ]" 1
950 1 94 ALA H 1 136 THR MG . . 5.190 4.320 4.228 4.389 . 0 0 "[ . 1 . 2 ]" 1
951 1 94 ALA HA 1 96 GLU H . . 4.870 4.674 4.572 4.792 . 0 0 "[ . 1 . 2 ]" 1
952 1 94 ALA HA 1 97 ILE H . . 4.510 3.353 3.174 3.490 . 0 0 "[ . 1 . 2 ]" 1
953 1 94 ALA HA 1 97 ILE HB . . 4.380 3.095 2.586 3.503 . 0 0 "[ . 1 . 2 ]" 1
954 1 94 ALA HA 1 97 ILE MD . . 4.040 2.660 2.029 3.445 . 0 0 "[ . 1 . 2 ]" 1
955 1 94 ALA HA 1 98 ASN H . . 5.250 4.585 4.297 4.856 . 0 0 "[ . 1 . 2 ]" 1
956 1 94 ALA HA 1 136 THR MG . . 4.230 2.178 2.073 2.305 . 0 0 "[ . 1 . 2 ]" 1
957 1 94 ALA MB 1 95 ALA H . . 4.200 2.559 2.394 2.728 . 0 0 "[ . 1 . 2 ]" 1
958 1 94 ALA MB 1 98 ASN H . . 6.100 4.965 4.727 5.102 . 0 0 "[ . 1 . 2 ]" 1
959 1 94 ALA MB 1 133 MET H . . 5.390 3.423 3.191 3.594 . 0 0 "[ . 1 . 2 ]" 1
960 1 94 ALA MB 1 135 THR H . . 5.000 3.762 3.525 4.170 . 0 0 "[ . 1 . 2 ]" 1
961 1 94 ALA MB 1 136 THR H . . 5.360 4.185 3.830 4.468 . 0 0 "[ . 1 . 2 ]" 1
962 1 95 ALA H 1 96 GLU H . . 4.140 2.814 2.696 2.959 . 0 0 "[ . 1 . 2 ]" 1
963 1 95 ALA H 1 96 GLU QB . . 6.270 4.683 4.370 4.897 . 0 0 "[ . 1 . 2 ]" 1
964 1 95 ALA H 1 97 ILE H . . 4.890 4.095 3.888 4.215 . 0 0 "[ . 1 . 2 ]" 1
965 1 95 ALA H 1 97 ILE QG . . 5.000 4.471 4.319 4.546 . 0 0 "[ . 1 . 2 ]" 1
966 1 95 ALA H 1 136 THR MG . . 5.600 4.393 4.209 4.570 . 0 0 "[ . 1 . 2 ]" 1
967 1 95 ALA HA 1 98 ASN H . . 4.730 3.591 3.516 3.681 . 0 0 "[ . 1 . 2 ]" 1
968 1 95 ALA HA 1 98 ASN QB . . 5.250 3.615 3.119 4.513 . 0 0 "[ . 1 . 2 ]" 1
969 1 95 ALA HA 1 99 ARG H . . 5.060 4.325 4.174 4.478 . 0 0 "[ . 1 . 2 ]" 1
970 1 95 ALA MB 1 96 GLU H . . 4.110 2.417 2.299 2.507 . 0 0 "[ . 1 . 2 ]" 1
971 1 95 ALA MB 1 98 ASN H . . 5.600 4.700 4.674 4.720 . 0 0 "[ . 1 . 2 ]" 1
972 1 96 GLU H 1 96 GLU QG . . 4.130 2.472 2.062 3.765 . 0 0 "[ . 1 . 2 ]" 1
973 1 96 GLU H 1 97 ILE H . . 4.150 2.920 2.841 2.972 . 0 0 "[ . 1 . 2 ]" 1
974 1 96 GLU H 1 97 ILE QG . . 4.760 4.167 4.108 4.256 . 0 0 "[ . 1 . 2 ]" 1
975 1 96 GLU H 1 98 ASN H . . 5.020 4.583 4.488 4.720 . 0 0 "[ . 1 . 2 ]" 1
976 1 96 GLU H 1 99 ARG H . . 5.860 4.592 4.508 4.654 . 0 0 "[ . 1 . 2 ]" 1
977 1 96 GLU H 1 99 ARG QB . . 4.430 3.990 3.867 4.041 . 0 0 "[ . 1 . 2 ]" 1
978 1 96 GLU HA 1 98 ASN H . . 5.190 4.385 4.196 4.488 . 0 0 "[ . 1 . 2 ]" 1
979 1 96 GLU HA 1 99 ARG H . . 4.560 3.004 2.798 3.169 . 0 0 "[ . 1 . 2 ]" 1
980 1 96 GLU HA 1 99 ARG QB . . 4.250 1.931 1.853 2.004 . 0 0 "[ . 1 . 2 ]" 1
981 1 96 GLU HA 1 100 LEU H . . 4.960 3.541 3.299 3.771 . 0 0 "[ . 1 . 2 ]" 1
982 1 96 GLU QB 1 97 ILE H . . 4.350 3.028 2.896 3.189 . 0 0 "[ . 1 . 2 ]" 1
983 1 96 GLU HB2 1 97 ILE H . . 4.600 3.216 3.028 3.826 . 0 0 "[ . 1 . 2 ]" 1
984 1 96 GLU HB3 1 97 ILE H . . 4.600 3.837 3.183 4.041 . 0 0 "[ . 1 . 2 ]" 1
985 1 96 GLU QG 1 97 ILE H . . 5.030 4.449 4.337 4.550 . 0 0 "[ . 1 . 2 ]" 1
986 1 97 ILE H 1 97 ILE MD . . 4.760 3.185 2.376 3.705 . 0 0 "[ . 1 . 2 ]" 1
987 1 97 ILE H 1 97 ILE QG . . 4.080 1.960 1.902 2.081 . 0 0 "[ . 1 . 2 ]" 1
988 1 97 ILE H 1 97 ILE MG . . 4.350 3.722 3.706 3.748 . 0 0 "[ . 1 . 2 ]" 1
989 1 97 ILE H 1 98 ASN H . . 4.110 2.762 2.703 2.890 . 0 0 "[ . 1 . 2 ]" 1
990 1 97 ILE H 1 99 ARG H . . 5.140 3.753 3.637 3.882 . 0 0 "[ . 1 . 2 ]" 1
991 1 97 ILE H 1 99 ARG QB . . 5.030 4.454 4.369 4.514 . 0 0 "[ . 1 . 2 ]" 1
992 1 97 ILE H 1 102 ILE MD . . 5.770 4.465 4.164 4.751 . 0 0 "[ . 1 . 2 ]" 1
993 1 97 ILE H 1 136 THR MG . . 5.240 3.847 3.667 4.014 . 0 0 "[ . 1 . 2 ]" 1
994 1 97 ILE HA 1 99 ARG H . . 5.250 4.221 3.969 4.359 . 0 0 "[ . 1 . 2 ]" 1
995 1 97 ILE HA 1 100 LEU H . . 4.810 4.073 3.829 4.288 . 0 0 "[ . 1 . 2 ]" 1
996 1 97 ILE HA 1 101 SER H . . 5.490 4.303 3.957 4.543 . 0 0 "[ . 1 . 2 ]" 1
997 1 97 ILE HA 1 102 ILE H . . 4.760 3.873 3.523 4.468 . 0 0 "[ . 1 . 2 ]" 1
998 1 97 ILE HA 1 102 ILE HB . . 5.600 4.366 2.545 5.695 0.095 10 0 "[ . 1 . 2 ]" 1
999 1 97 ILE HA 1 102 ILE MD . . 4.400 2.245 1.945 2.549 . 0 0 "[ . 1 . 2 ]" 1
1000 1 97 ILE HB 1 98 ASN H . . 4.400 2.376 2.270 2.458 . 0 0 "[ . 1 . 2 ]" 1
1001 1 97 ILE MD 1 98 ASN H . . 5.620 4.531 4.368 4.716 . 0 0 "[ . 1 . 2 ]" 1
1002 1 97 ILE QG 1 98 ASN H . . 5.110 3.773 3.600 3.915 . 0 0 "[ . 1 . 2 ]" 1
1003 1 97 ILE QG 1 99 ARG H . . 5.750 5.185 5.136 5.214 . 0 0 "[ . 1 . 2 ]" 1
1004 1 97 ILE MG 1 98 ASN H . . 4.210 3.384 3.135 3.526 . 0 0 "[ . 1 . 2 ]" 1
1005 1 97 ILE MG 1 136 THR H . . 6.050 5.092 5.061 5.127 . 0 0 "[ . 1 . 2 ]" 1
1006 1 97 ILE MG 1 137 GLU H . . 5.600 3.251 2.804 3.787 . 0 0 "[ . 1 . 2 ]" 1
1007 1 97 ILE MG 1 138 ALA H . . 4.580 3.009 2.447 3.498 . 0 0 "[ . 1 . 2 ]" 1
1008 1 98 ASN H 1 98 ASN HB2 . . 4.150 2.793 2.205 3.703 . 0 0 "[ . 1 . 2 ]" 1
1009 1 98 ASN H 1 98 ASN HB3 . . 4.150 2.643 2.435 2.927 . 0 0 "[ . 1 . 2 ]" 1
1010 1 98 ASN H 1 99 ARG H . . 4.180 2.428 2.353 2.493 . 0 0 "[ . 1 . 2 ]" 1
1011 1 98 ASN H 1 99 ARG QB . . 5.420 4.066 3.931 4.150 . 0 0 "[ . 1 . 2 ]" 1
1012 1 98 ASN H 1 136 THR MG . . 4.950 3.521 3.215 3.696 . 0 0 "[ . 1 . 2 ]" 1
1013 1 98 ASN HA 1 101 SER H . . 4.560 3.273 3.132 3.568 . 0 0 "[ . 1 . 2 ]" 1
1014 1 98 ASN HA 1 102 ILE H . . 5.470 3.951 3.703 4.627 . 0 0 "[ . 1 . 2 ]" 1
1015 1 98 ASN QB 1 99 ARG H . . 4.310 3.159 2.787 3.875 . 0 0 "[ . 1 . 2 ]" 1
1016 1 98 ASN HB2 1 99 ARG H . . 4.570 4.067 3.608 4.375 . 0 0 "[ . 1 . 2 ]" 1
1017 1 98 ASN HB3 1 99 ARG H . . 4.570 3.343 2.840 4.326 . 0 0 "[ . 1 . 2 ]" 1
1018 1 99 ARG H 1 99 ARG QD . . 5.480 4.237 3.886 4.471 . 0 0 "[ . 1 . 2 ]" 1
1019 1 99 ARG H 1 99 ARG HG2 . . 4.920 4.528 4.301 4.739 . 0 0 "[ . 1 . 2 ]" 1
1020 1 99 ARG H 1 99 ARG QG . . 4.760 3.947 3.636 4.047 . 0 0 "[ . 1 . 2 ]" 1
1021 1 99 ARG H 1 99 ARG HG3 . . 4.920 4.366 3.807 4.564 . 0 0 "[ . 1 . 2 ]" 1
1022 1 99 ARG H 1 100 LEU H . . 4.160 2.569 2.368 2.706 . 0 0 "[ . 1 . 2 ]" 1
1023 1 99 ARG H 1 100 LEU QB . . 6.380 4.472 4.191 4.672 . 0 0 "[ . 1 . 2 ]" 1
1024 1 99 ARG H 1 101 SER H . . 5.000 3.500 3.234 3.766 . 0 0 "[ . 1 . 2 ]" 1
1025 1 99 ARG HA 1 101 SER H . . 4.950 4.217 4.010 4.651 . 0 0 "[ . 1 . 2 ]" 1
1026 1 99 ARG QB 1 100 LEU H . . 4.300 2.476 2.172 2.973 . 0 0 "[ . 1 . 2 ]" 1
1027 1 99 ARG QB 1 101 SER H . . 5.560 4.341 4.177 4.621 . 0 0 "[ . 1 . 2 ]" 1
1028 1 99 ARG QG 1 100 LEU H . . 6.260 4.000 3.579 4.480 . 0 0 "[ . 1 . 2 ]" 1
1029 1 100 LEU H 1 100 LEU MD1 . . 4.660 3.411 2.252 3.909 . 0 0 "[ . 1 . 2 ]" 1
1030 1 100 LEU H 1 100 LEU QD . . 4.240 2.532 2.149 3.177 . 0 0 "[ . 1 . 2 ]" 1
1031 1 100 LEU H 1 100 LEU MD2 . . 4.660 2.852 2.162 3.799 . 0 0 "[ . 1 . 2 ]" 1
1032 1 100 LEU H 1 100 LEU HG . . 4.700 3.678 2.351 4.273 . 0 0 "[ . 1 . 2 ]" 1
1033 1 100 LEU H 1 101 SER H . . 4.140 2.332 2.005 2.537 . 0 0 "[ . 1 . 2 ]" 1
1034 1 100 LEU QB 1 101 SER H . . 4.610 2.959 2.566 3.115 . 0 0 "[ . 1 . 2 ]" 1
1035 1 100 LEU QB 1 102 ILE H . . 5.290 3.799 3.302 4.460 . 0 0 "[ . 1 . 2 ]" 1
1036 1 100 LEU HB2 1 101 SER H . . 4.920 3.072 2.625 3.253 . 0 0 "[ . 1 . 2 ]" 1
1037 1 100 LEU HB3 1 101 SER H . . 4.920 3.882 3.610 4.136 . 0 0 "[ . 1 . 2 ]" 1
1038 1 100 LEU QD 1 101 SER H . . 6.440 3.997 3.737 4.340 . 0 0 "[ . 1 . 2 ]" 1
1039 1 100 LEU HG 1 101 SER H . . 5.390 5.191 4.427 5.479 0.089 18 0 "[ . 1 . 2 ]" 1
1040 1 101 SER H 1 102 ILE H . . 4.130 2.831 2.400 3.258 . 0 0 "[ . 1 . 2 ]" 1
1041 1 101 SER H 1 102 ILE MD . . 5.940 3.831 2.783 4.575 . 0 0 "[ . 1 . 2 ]" 1
1042 1 101 SER H 1 102 ILE QG . . 5.340 4.229 3.637 4.720 . 0 0 "[ . 1 . 2 ]" 1
1043 1 101 SER HB2 1 102 ILE H . . 4.900 4.514 4.394 4.687 . 0 0 "[ . 1 . 2 ]" 1
1044 1 101 SER HB3 1 102 ILE H . . 4.900 4.338 4.019 4.510 . 0 0 "[ . 1 . 2 ]" 1
1045 1 102 ILE H 1 102 ILE HB . . 4.070 2.995 2.001 3.848 . 0 0 "[ . 1 . 2 ]" 1
1046 1 102 ILE H 1 102 ILE MD . . 4.460 3.055 1.960 3.737 . 0 0 "[ . 1 . 2 ]" 1
1047 1 102 ILE H 1 102 ILE QG . . 4.160 2.502 1.911 3.161 . 0 0 "[ . 1 . 2 ]" 1
1048 1 102 ILE H 1 102 ILE MG . . 4.180 3.187 2.558 3.557 . 0 0 "[ . 1 . 2 ]" 1
1049 1 102 ILE H 1 103 SER H . . 4.850 4.545 4.411 4.637 . 0 0 "[ . 1 . 2 ]" 1
1050 1 102 ILE HA 1 104 SER H . . 4.740 4.203 3.918 4.445 . 0 0 "[ . 1 . 2 ]" 1
1051 1 102 ILE HB 1 103 SER H . . 4.980 3.074 2.055 4.198 . 0 0 "[ . 1 . 2 ]" 1
1052 1 102 ILE HB 1 104 SER H . . 5.490 3.537 2.496 4.912 . 0 0 "[ . 1 . 2 ]" 1
1053 1 102 ILE MD 1 103 SER H . . 5.780 4.689 4.111 4.902 . 0 0 "[ . 1 . 2 ]" 1
1054 1 102 ILE QG 1 103 SER H . . 4.620 3.544 3.036 3.821 . 0 0 "[ . 1 . 2 ]" 1
1055 1 102 ILE QG 1 104 SER H . . 4.550 3.492 2.641 4.148 . 0 0 "[ . 1 . 2 ]" 1
1056 1 102 ILE MG 1 103 SER H . . 4.200 2.944 2.114 3.554 . 0 0 "[ . 1 . 2 ]" 1
1057 1 102 ILE MG 1 104 SER H . . 5.170 3.261 1.893 4.346 . 0 0 "[ . 1 . 2 ]" 1
1058 1 103 SER H 1 104 SER H . . 4.000 2.273 2.024 2.679 . 0 0 "[ . 1 . 2 ]" 1
1059 1 103 SER H 1 138 ALA MB . . 5.660 4.124 3.733 4.460 . 0 0 "[ . 1 . 2 ]" 1
1060 1 103 SER HA 1 139 ARG H . . 4.920 4.001 3.350 4.580 . 0 0 "[ . 1 . 2 ]" 1
1061 1 103 SER QB 1 104 SER H . . 4.540 3.129 2.677 3.627 . 0 0 "[ . 1 . 2 ]" 1
1062 1 103 SER HB2 1 104 SER H . . 4.800 3.278 2.762 4.301 . 0 0 "[ . 1 . 2 ]" 1
1063 1 103 SER HB3 1 104 SER H . . 4.800 4.042 3.595 4.448 . 0 0 "[ . 1 . 2 ]" 1
1064 1 104 SER H 1 105 VAL H . . 5.140 4.344 4.192 4.442 . 0 0 "[ . 1 . 2 ]" 1
1065 1 104 SER H 1 105 VAL HA . . 5.850 4.748 4.649 4.813 . 0 0 "[ . 1 . 2 ]" 1
1066 1 104 SER H 1 138 ALA HA . . 5.350 5.012 4.546 5.352 0.002 10 0 "[ . 1 . 2 ]" 1
1067 1 104 SER H 1 138 ALA MB . . 4.950 3.343 2.778 3.664 . 0 0 "[ . 1 . 2 ]" 1
1068 1 104 SER H 1 139 ARG H . . 5.700 4.420 3.933 5.008 . 0 0 "[ . 1 . 2 ]" 1
1069 1 104 SER HA 1 138 ALA MB . . 5.060 2.663 2.292 2.980 . 0 0 "[ . 1 . 2 ]" 1
1070 1 104 SER HA 1 139 ARG H . . 4.310 2.310 2.099 2.627 . 0 0 "[ . 1 . 2 ]" 1
1071 1 104 SER HB2 1 105 VAL H . . 4.400 3.501 2.766 4.408 0.008 9 0 "[ . 1 . 2 ]" 1
1072 1 104 SER HB3 1 105 VAL H . . 4.400 3.699 2.621 4.231 . 0 0 "[ . 1 . 2 ]" 1
1073 1 105 VAL H 1 105 VAL QG . . 4.220 2.378 2.306 2.598 . 0 0 "[ . 1 . 2 ]" 1
1074 1 105 VAL H 1 106 ALA H . . 5.000 4.249 3.978 4.358 . 0 0 "[ . 1 . 2 ]" 1
1075 1 105 VAL H 1 138 ALA MB . . 4.790 3.569 3.289 3.841 . 0 0 "[ . 1 . 2 ]" 1
1076 1 105 VAL H 1 139 ARG H . . 5.000 4.024 3.717 4.377 . 0 0 "[ . 1 . 2 ]" 1
1077 1 105 VAL H 1 140 VAL HA . . 4.570 3.871 3.253 4.572 0.002 19 0 "[ . 1 . 2 ]" 1
1078 1 105 VAL H 1 140 VAL QG . . 6.630 4.515 3.896 4.936 . 0 0 "[ . 1 . 2 ]" 1
1079 1 105 VAL H 1 141 THR H . . 4.630 3.897 3.673 4.457 . 0 0 "[ . 1 . 2 ]" 1
1080 1 105 VAL HB 1 106 ALA H . . 4.750 3.905 3.603 4.147 . 0 0 "[ . 1 . 2 ]" 1
1081 1 105 VAL QG 1 106 ALA H . . 4.210 2.359 2.130 2.577 . 0 0 "[ . 1 . 2 ]" 1
1082 1 105 VAL QG 1 107 ILE H . . 6.300 4.227 4.037 4.346 . 0 0 "[ . 1 . 2 ]" 1
1083 1 105 VAL QG 1 139 ARG H . . 6.980 4.162 3.712 4.395 . 0 0 "[ . 1 . 2 ]" 1
1084 1 105 VAL QG 1 141 THR H . . 6.110 3.801 3.214 4.010 . 0 0 "[ . 1 . 2 ]" 1
1085 1 105 VAL MG1 1 106 ALA H . . 4.900 4.075 3.968 4.114 . 0 0 "[ . 1 . 2 ]" 1
1086 1 105 VAL MG2 1 106 ALA H . . 4.600 2.375 2.138 2.604 . 0 0 "[ . 1 . 2 ]" 1
1087 1 106 ALA H 1 107 ILE H . . 5.430 4.580 4.506 4.619 . 0 0 "[ . 1 . 2 ]" 1
1088 1 106 ALA H 1 107 ILE HB . . 5.590 5.294 4.969 5.529 . 0 0 "[ . 1 . 2 ]" 1
1089 1 106 ALA H 1 141 THR H . . 5.700 5.107 4.898 5.526 . 0 0 "[ . 1 . 2 ]" 1
1090 1 106 ALA HA 1 141 THR H . . 4.380 3.050 2.749 3.200 . 0 0 "[ . 1 . 2 ]" 1
1091 1 106 ALA MB 1 107 ILE H . . 4.270 2.982 2.878 3.105 . 0 0 "[ . 1 . 2 ]" 1
1092 1 106 ALA MB 1 141 THR H . . 5.540 4.582 4.351 4.691 . 0 0 "[ . 1 . 2 ]" 1
1093 1 106 ALA MB 1 143 TYR HD1 . . 4.490 2.628 2.345 2.855 . 0 0 "[ . 1 . 2 ]" 1
1094 1 106 ALA MB 1 143 TYR HE1 . . 3.990 2.383 2.220 2.670 . 0 0 "[ . 1 . 2 ]" 1
1095 1 107 ILE H 1 107 ILE MD . . 5.520 4.516 4.401 4.664 . 0 0 "[ . 1 . 2 ]" 1
1096 1 107 ILE H 1 107 ILE MG . . 4.050 2.201 2.110 2.350 . 0 0 "[ . 1 . 2 ]" 1
1097 1 107 ILE H 1 141 THR H . . 4.740 3.765 3.461 4.117 . 0 0 "[ . 1 . 2 ]" 1
1098 1 107 ILE H 1 141 THR HB . . 4.980 3.880 3.547 4.324 . 0 0 "[ . 1 . 2 ]" 1
1099 1 107 ILE H 1 142 ILE HA . . 4.570 3.050 2.795 3.351 . 0 0 "[ . 1 . 2 ]" 1
1100 1 107 ILE H 1 143 TYR H . . 4.600 3.753 3.450 4.018 . 0 0 "[ . 1 . 2 ]" 1
1101 1 107 ILE H 1 143 TYR HD1 . . 4.100 2.803 2.417 3.187 . 0 0 "[ . 1 . 2 ]" 1
1102 1 107 ILE H 1 143 TYR HE1 . . 4.580 4.161 3.504 4.616 0.036 6 0 "[ . 1 . 2 ]" 1
1103 1 107 ILE MG 1 141 THR H . . 5.040 2.911 2.481 3.353 . 0 0 "[ . 1 . 2 ]" 1
1104 1 107 ILE MG 1 142 ILE H . . 4.900 3.963 3.766 4.124 . 0 0 "[ . 1 . 2 ]" 1
1105 1 107 ILE MG 1 142 ILE MD . . 4.280 2.105 1.871 2.550 . 0 0 "[ . 1 . 2 ]" 1
1106 1 107 ILE MG 1 143 TYR H . . 4.880 3.854 3.582 4.082 . 0 0 "[ . 1 . 2 ]" 1
1107 1 108 PRO HA 1 143 TYR H . . 4.350 2.515 2.217 2.663 . 0 0 "[ . 1 . 2 ]" 1
1108 1 108 PRO QB 1 109 LEU H . . 4.490 2.991 2.799 3.160 . 0 0 "[ . 1 . 2 ]" 1
1109 1 108 PRO QG 1 109 LEU H . . 5.520 4.463 4.301 4.570 . 0 0 "[ . 1 . 2 ]" 1
1110 1 109 LEU H 1 109 LEU QD . . 4.710 3.532 3.036 3.594 . 0 0 "[ . 1 . 2 ]" 1
1111 1 109 LEU H 1 109 LEU HG . . 4.890 4.586 4.519 4.674 . 0 0 "[ . 1 . 2 ]" 1
1112 1 109 LEU H 1 110 LEU H . . 4.690 4.325 4.096 4.499 . 0 0 "[ . 1 . 2 ]" 1
1113 1 109 LEU H 1 142 ILE QG . . 4.290 3.541 2.977 3.856 . 0 0 "[ . 1 . 2 ]" 1
1114 1 109 LEU H 1 143 TYR H . . 5.130 3.686 3.203 4.190 . 0 0 "[ . 1 . 2 ]" 1
1115 1 109 LEU QB 1 110 LEU H . . 5.480 4.025 3.841 4.087 . 0 0 "[ . 1 . 2 ]" 1
1116 1 109 LEU QD 1 110 LEU H . . 4.230 2.728 2.350 3.035 . 0 0 "[ . 1 . 2 ]" 1
1117 1 109 LEU QD 1 123 HIS H . . 6.000 4.456 4.382 4.516 . 0 0 "[ . 1 . 2 ]" 1
1118 1 109 LEU QD 1 125 SER H . . 5.010 3.021 2.789 3.200 . 0 0 "[ . 1 . 2 ]" 1
1119 1 109 LEU QD 1 126 LEU H . . 4.510 2.100 1.883 2.684 . 0 0 "[ . 1 . 2 ]" 1
1120 1 109 LEU QD 1 127 SER H . . 5.850 4.352 4.206 4.415 . 0 0 "[ . 1 . 2 ]" 1
1121 1 109 LEU QD 1 128 HIS H . . 7.000 5.230 5.199 5.276 . 0 0 "[ . 1 . 2 ]" 1
1122 1 109 LEU HG 1 122 VAL H . . 4.930 4.486 4.100 4.981 0.051 11 0 "[ . 1 . 2 ]" 1
1123 1 109 LEU HG 1 122 VAL HA . . 4.440 2.334 2.143 2.801 . 0 0 "[ . 1 . 2 ]" 1
1124 1 109 LEU HG 1 122 VAL MG1 . . 4.430 2.288 2.028 2.734 . 0 0 "[ . 1 . 2 ]" 1
1125 1 109 LEU HG 1 122 VAL QG . . 3.860 2.267 2.020 2.670 . 0 0 "[ . 1 . 2 ]" 1
1126 1 109 LEU HG 1 122 VAL MG2 . . 4.430 3.766 3.739 3.802 . 0 0 "[ . 1 . 2 ]" 1
1127 1 109 LEU HG 1 123 HIS H . . 5.300 5.312 5.203 5.385 0.085 13 0 "[ . 1 . 2 ]" 1
1128 1 109 LEU HG 1 124 GLN H . . 5.800 5.911 5.853 6.000 0.200 19 0 "[ . 1 . 2 ]" 1
1129 1 109 LEU HG 1 125 SER H . . 4.900 4.911 4.811 4.958 0.058 13 0 "[ . 1 . 2 ]" 1
1130 1 109 LEU HG 1 125 SER QB . . 5.270 3.509 3.147 3.874 . 0 0 "[ . 1 . 2 ]" 1
1131 1 109 LEU HG 1 126 LEU H . . 4.640 4.286 4.085 4.630 . 0 0 "[ . 1 . 2 ]" 1
1132 1 110 LEU H 1 110 LEU MD1 . . 5.010 2.780 2.156 4.100 . 0 0 "[ . 1 . 2 ]" 1
1133 1 110 LEU H 1 110 LEU QD . . 4.570 2.358 2.150 2.611 . 0 0 "[ . 1 . 2 ]" 1
1134 1 110 LEU H 1 110 LEU MD2 . . 5.010 3.627 2.169 4.195 . 0 0 "[ . 1 . 2 ]" 1
1135 1 110 LEU H 1 110 LEU HG . . 3.980 3.920 3.489 4.063 0.083 12 0 "[ . 1 . 2 ]" 1
1136 1 110 LEU H 1 129 LEU HG . . 5.350 5.277 4.854 5.434 0.084 12 0 "[ . 1 . 2 ]" 1
1137 1 110 LEU HA 1 112 THR H . . 4.290 4.146 3.711 4.331 0.041 14 0 "[ . 1 . 2 ]" 1
1138 1 110 LEU HB2 1 111 SER H . . 5.530 4.070 3.463 4.619 . 0 0 "[ . 1 . 2 ]" 1
1139 1 110 LEU HB3 1 111 SER H . . 5.530 2.970 1.984 4.176 . 0 0 "[ . 1 . 2 ]" 1
1140 1 110 LEU QD 1 111 SER H . . 5.460 3.615 2.572 4.114 . 0 0 "[ . 1 . 2 ]" 1
1141 1 110 LEU MD1 1 111 SER H . . 6.000 4.135 2.598 4.769 . 0 0 "[ . 1 . 2 ]" 1
1142 1 110 LEU MD2 1 111 SER H . . 6.000 4.287 3.346 5.076 . 0 0 "[ . 1 . 2 ]" 1
1143 1 111 SER H 1 112 THR H . . 4.930 2.840 2.209 3.394 . 0 0 "[ . 1 . 2 ]" 1
1144 1 112 THR H 1 116 SER H . . 5.030 4.928 4.361 5.100 0.070 2 0 "[ . 1 . 2 ]" 1
1145 1 112 THR H 1 116 SER QB . . 6.020 4.166 2.623 5.368 . 0 0 "[ . 1 . 2 ]" 1
1146 1 115 PHE HA 1 117 ALA H . . 5.550 4.230 3.331 4.927 . 0 0 "[ . 1 . 2 ]" 1
1147 1 116 SER H 1 117 ALA H . . 4.190 2.537 1.998 3.578 . 0 0 "[ . 1 . 2 ]" 1
1148 1 116 SER H 1 117 ALA MB . . 4.960 3.968 3.232 4.230 . 0 0 "[ . 1 . 2 ]" 1
1149 1 116 SER H 1 119 LYS H . . 5.690 5.505 4.993 5.749 0.059 11 0 "[ . 1 . 2 ]" 1
1150 1 116 SER HA 1 119 LYS H . . 4.780 3.639 2.832 4.092 . 0 0 "[ . 1 . 2 ]" 1
1151 1 116 SER QB 1 118 GLY H . . 4.660 3.290 2.292 4.167 . 0 0 "[ . 1 . 2 ]" 1
1152 1 116 SER QB 1 119 LYS H . . 4.460 3.393 2.238 4.023 . 0 0 "[ . 1 . 2 ]" 1
1153 1 116 SER HB2 1 117 ALA H . . 5.370 3.345 2.102 4.546 . 0 0 "[ . 1 . 2 ]" 1
1154 1 116 SER HB2 1 118 GLY H . . 4.840 4.018 2.960 4.761 . 0 0 "[ . 1 . 2 ]" 1
1155 1 116 SER HB2 1 119 LYS H . . 4.890 4.396 2.678 4.997 0.107 5 0 "[ . 1 . 2 ]" 1
1156 1 116 SER HB3 1 117 ALA H . . 5.370 3.560 2.245 4.602 . 0 0 "[ . 1 . 2 ]" 1
1157 1 116 SER HB3 1 118 GLY H . . 4.840 3.707 2.307 4.937 0.097 7 0 "[ . 1 . 2 ]" 1
1158 1 116 SER HB3 1 119 LYS H . . 4.890 3.641 2.278 4.592 . 0 0 "[ . 1 . 2 ]" 1
1159 1 117 ALA H 1 118 GLY H . . 4.230 3.316 2.665 4.079 . 0 0 "[ . 1 . 2 ]" 1
1160 1 117 ALA H 1 118 GLY QA . . 6.790 4.859 4.525 5.238 . 0 0 "[ . 1 . 2 ]" 1
1161 1 117 ALA H 1 119 LYS H . . 4.630 4.311 3.556 4.672 0.042 2 0 "[ . 1 . 2 ]" 1
1162 1 117 ALA HA 1 119 LYS H . . 5.130 4.649 4.169 5.109 . 0 0 "[ . 1 . 2 ]" 1
1163 1 118 GLY H 1 119 LYS H . . 4.170 2.656 1.962 3.118 . 0 0 "[ . 1 . 2 ]" 1
1164 1 119 LYS H 1 119 LYS QD . . 4.300 3.526 2.682 3.948 . 0 0 "[ . 1 . 2 ]" 1
1165 1 119 LYS H 1 119 LYS QE . . 5.350 4.349 3.136 4.859 . 0 0 "[ . 1 . 2 ]" 1
1166 1 119 LYS H 1 119 LYS HG2 . . 4.840 3.526 2.063 4.837 . 0 0 "[ . 1 . 2 ]" 1
1167 1 119 LYS H 1 119 LYS QG . . 4.510 3.076 2.050 4.071 . 0 0 "[ . 1 . 2 ]" 1
1168 1 119 LYS H 1 119 LYS HG3 . . 4.840 3.844 2.086 4.525 . 0 0 "[ . 1 . 2 ]" 1
1169 1 122 VAL H 1 122 VAL HB . . 4.030 3.610 3.563 3.664 . 0 0 "[ . 1 . 2 ]" 1
1170 1 122 VAL H 1 122 VAL MG1 . . 4.570 1.980 1.894 2.067 . 0 0 "[ . 1 . 2 ]" 1
1171 1 122 VAL H 1 122 VAL QG . . 3.910 1.855 1.798 1.898 . 0 0 "[ . 1 . 2 ]" 1
1172 1 122 VAL H 1 122 VAL MG2 . . 4.570 2.260 2.009 2.514 . 0 0 "[ . 1 . 2 ]" 1
1173 1 122 VAL H 1 123 HIS H . . 4.250 2.813 2.634 2.960 . 0 0 "[ . 1 . 2 ]" 1
1174 1 122 VAL H 1 123 HIS HA . . 5.590 5.393 5.248 5.513 . 0 0 "[ . 1 . 2 ]" 1
1175 1 122 VAL H 1 123 HIS QB . . 6.050 4.644 4.260 5.110 . 0 0 "[ . 1 . 2 ]" 1
1176 1 122 VAL H 1 124 GLN H . . 5.740 4.190 4.041 4.383 . 0 0 "[ . 1 . 2 ]" 1
1177 1 122 VAL H 1 125 SER H . . 5.610 5.004 4.828 5.342 . 0 0 "[ . 1 . 2 ]" 1
1178 1 122 VAL HA 1 125 SER H . . 4.970 3.226 3.055 3.364 . 0 0 "[ . 1 . 2 ]" 1
1179 1 122 VAL HA 1 126 LEU H . . 5.480 3.618 3.063 4.242 . 0 0 "[ . 1 . 2 ]" 1
1180 1 122 VAL HB 1 123 HIS H . . 4.300 3.800 3.628 4.005 . 0 0 "[ . 1 . 2 ]" 1
1181 1 122 VAL HB 1 126 LEU QB . . 4.650 3.676 2.975 4.198 . 0 0 "[ . 1 . 2 ]" 1
1182 1 122 VAL HB 1 126 LEU QD . . 4.360 2.831 2.158 3.280 . 0 0 "[ . 1 . 2 ]" 1
1183 1 122 VAL QG 1 123 HIS H . . 4.060 2.041 1.948 2.186 . 0 0 "[ . 1 . 2 ]" 1
1184 1 122 VAL QG 1 126 LEU H . . 6.920 4.391 4.162 4.582 . 0 0 "[ . 1 . 2 ]" 1
1185 1 122 VAL QG 1 152 LYS H . . 7.270 4.952 4.232 5.382 . 0 0 "[ . 1 . 2 ]" 1
1186 1 122 VAL QG 1 152 LYS QD . . 7.020 4.077 2.115 4.649 . 0 0 "[ . 1 . 2 ]" 1
1187 1 122 VAL QG 1 153 ILE H . . 6.850 3.554 2.777 4.089 . 0 0 "[ . 1 . 2 ]" 1
1188 1 122 VAL QG 1 153 ILE QG . . 6.610 2.111 1.873 3.433 . 0 0 "[ . 1 . 2 ]" 1
1189 1 122 VAL MG1 1 123 HIS H . . 4.530 3.795 3.734 3.826 . 0 0 "[ . 1 . 2 ]" 1
1190 1 122 VAL MG1 1 125 SER H . . 5.990 5.039 4.940 5.090 . 0 0 "[ . 1 . 2 ]" 1
1191 1 122 VAL MG2 1 123 HIS H . . 4.530 2.049 1.955 2.200 . 0 0 "[ . 1 . 2 ]" 1
1192 1 122 VAL MG2 1 125 SER H . . 5.990 5.071 5.002 5.101 . 0 0 "[ . 1 . 2 ]" 1
1193 1 123 HIS H 1 123 HIS HB2 . . 4.140 2.904 2.408 3.666 . 0 0 "[ . 1 . 2 ]" 1
1194 1 123 HIS H 1 123 HIS HB3 . . 4.140 2.520 2.236 3.614 . 0 0 "[ . 1 . 2 ]" 1
1195 1 123 HIS H 1 124 GLN H . . 4.270 2.892 2.755 3.029 . 0 0 "[ . 1 . 2 ]" 1
1196 1 123 HIS H 1 124 GLN QB . . 5.620 4.710 4.384 4.946 . 0 0 "[ . 1 . 2 ]" 1
1197 1 123 HIS H 1 125 SER H . . 5.490 4.515 4.311 4.680 . 0 0 "[ . 1 . 2 ]" 1
1198 1 123 HIS HA 1 125 SER H . . 5.910 4.661 4.356 4.902 . 0 0 "[ . 1 . 2 ]" 1
1199 1 123 HIS HA 1 126 LEU H . . 4.640 3.904 3.404 4.279 . 0 0 "[ . 1 . 2 ]" 1
1200 1 123 HIS HA 1 126 LEU QB . . 4.230 3.233 2.251 3.945 . 0 0 "[ . 1 . 2 ]" 1
1201 1 123 HIS HA 1 127 SER H . . 4.800 4.023 3.652 4.457 . 0 0 "[ . 1 . 2 ]" 1
1202 1 123 HIS QB 1 124 GLN H . . 4.280 3.246 2.859 3.814 . 0 0 "[ . 1 . 2 ]" 1
1203 1 123 HIS HB2 1 124 GLN H . . 4.570 4.207 3.076 4.424 . 0 0 "[ . 1 . 2 ]" 1
1204 1 123 HIS HB3 1 124 GLN H . . 4.570 3.462 2.912 4.171 . 0 0 "[ . 1 . 2 ]" 1
1205 1 124 GLN H 1 124 GLN HG2 . . 5.240 4.344 3.119 4.799 . 0 0 "[ . 1 . 2 ]" 1
1206 1 124 GLN H 1 124 GLN HG3 . . 5.240 4.354 2.976 4.749 . 0 0 "[ . 1 . 2 ]" 1
1207 1 124 GLN H 1 125 SER H . . 4.310 2.388 2.161 2.558 . 0 0 "[ . 1 . 2 ]" 1
1208 1 124 GLN H 1 126 LEU H . . 5.120 3.896 3.509 4.122 . 0 0 "[ . 1 . 2 ]" 1
1209 1 124 GLN H 1 127 SER H . . 5.340 4.468 4.245 4.668 . 0 0 "[ . 1 . 2 ]" 1
1210 1 124 GLN HA 1 126 LEU H . . 5.350 4.754 4.122 5.214 . 0 0 "[ . 1 . 2 ]" 1
1211 1 124 GLN HA 1 127 SER H . . 4.620 3.548 3.137 3.955 . 0 0 "[ . 1 . 2 ]" 1
1212 1 124 GLN HA 1 128 HIS H . . 4.890 4.786 4.536 4.933 0.043 10 0 "[ . 1 . 2 ]" 1
1213 1 124 GLN QB 1 125 SER H . . 4.110 2.563 2.334 2.862 . 0 0 "[ . 1 . 2 ]" 1
1214 1 124 GLN QB 1 127 SER H . . 5.980 4.863 4.615 5.016 . 0 0 "[ . 1 . 2 ]" 1
1215 1 124 GLN HG2 1 125 SER H . . 5.510 4.546 3.666 5.203 . 0 0 "[ . 1 . 2 ]" 1
1216 1 124 GLN HG3 1 125 SER H . . 5.510 4.794 3.938 5.181 . 0 0 "[ . 1 . 2 ]" 1
1217 1 125 SER H 1 126 LEU H . . 4.200 2.569 2.337 2.800 . 0 0 "[ . 1 . 2 ]" 1
1218 1 125 SER H 1 127 SER H . . 4.990 3.926 3.692 4.037 . 0 0 "[ . 1 . 2 ]" 1
1219 1 125 SER H 1 128 HIS H . . 5.640 5.165 4.971 5.458 . 0 0 "[ . 1 . 2 ]" 1
1220 1 125 SER HA 1 127 SER H . . 5.250 4.068 3.824 4.270 . 0 0 "[ . 1 . 2 ]" 1
1221 1 125 SER HA 1 128 HIS H . . 4.680 3.555 3.106 3.946 . 0 0 "[ . 1 . 2 ]" 1
1222 1 125 SER HA 1 129 LEU H . . 5.560 4.289 3.695 4.750 . 0 0 "[ . 1 . 2 ]" 1
1223 1 125 SER QB 1 126 LEU H . . 4.230 2.528 2.209 3.230 . 0 0 "[ . 1 . 2 ]" 1
1224 1 125 SER QB 1 127 SER H . . 6.000 4.592 4.290 4.852 . 0 0 "[ . 1 . 2 ]" 1
1225 1 126 LEU H 1 126 LEU QD . . 4.940 3.242 2.878 3.559 . 0 0 "[ . 1 . 2 ]" 1
1226 1 126 LEU H 1 126 LEU HG . . 5.120 3.526 2.346 4.527 . 0 0 "[ . 1 . 2 ]" 1
1227 1 126 LEU H 1 127 SER H . . 4.160 2.780 2.377 2.936 . 0 0 "[ . 1 . 2 ]" 1
1228 1 126 LEU H 1 128 HIS H . . 5.010 4.418 4.178 4.680 . 0 0 "[ . 1 . 2 ]" 1
1229 1 126 LEU H 1 129 LEU H . . 5.550 4.631 4.494 4.849 . 0 0 "[ . 1 . 2 ]" 1
1230 1 126 LEU HA 1 128 HIS H . . 5.200 4.246 3.727 4.667 . 0 0 "[ . 1 . 2 ]" 1
1231 1 126 LEU HA 1 129 LEU H . . 5.860 3.087 2.486 3.844 . 0 0 "[ . 1 . 2 ]" 1
1232 1 126 LEU HA 1 129 LEU HG . . 4.760 4.072 2.031 4.840 0.080 19 0 "[ . 1 . 2 ]" 1
1233 1 126 LEU QB 1 127 SER H . . 4.720 3.356 2.678 3.904 . 0 0 "[ . 1 . 2 ]" 1
1234 1 126 LEU QD 1 130 LEU QD . . 5.950 2.183 1.943 2.803 . 0 0 "[ . 1 . 2 ]" 1
1235 1 126 LEU QD 1 157 LEU QD . . 5.520 2.242 1.943 2.602 . 0 0 "[ . 1 . 2 ]" 1
1236 1 126 LEU HG 1 127 SER H . . 4.900 3.922 2.643 4.986 0.086 11 0 "[ . 1 . 2 ]" 1
1237 1 126 LEU HG 1 130 LEU H . . 5.190 4.728 3.637 5.284 0.094 19 0 "[ . 1 . 2 ]" 1
1238 1 126 LEU HG 1 156 VAL QG . . 5.960 3.930 3.431 4.368 . 0 0 "[ . 1 . 2 ]" 1
1239 1 127 SER H 1 128 HIS H . . 4.210 2.693 2.543 2.865 . 0 0 "[ . 1 . 2 ]" 1
1240 1 127 SER H 1 128 HIS HA . . 5.720 5.324 5.182 5.455 . 0 0 "[ . 1 . 2 ]" 1
1241 1 127 SER H 1 128 HIS QB . . 5.710 4.793 4.558 4.997 . 0 0 "[ . 1 . 2 ]" 1
1242 1 127 SER H 1 129 LEU H . . 5.110 4.017 3.737 4.335 . 0 0 "[ . 1 . 2 ]" 1
1243 1 127 SER HA 1 129 LEU H . . 5.160 4.586 4.056 5.151 . 0 0 "[ . 1 . 2 ]" 1
1244 1 127 SER HA 1 130 LEU H . . 5.000 3.840 3.180 4.347 . 0 0 "[ . 1 . 2 ]" 1
1245 1 127 SER HA 1 130 LEU HG . . 5.080 4.572 3.773 5.177 0.097 17 0 "[ . 1 . 2 ]" 1
1246 1 127 SER QB 1 129 LEU H . . 5.360 4.660 4.414 4.812 . 0 0 "[ . 1 . 2 ]" 1
1247 1 128 HIS H 1 129 LEU H . . 4.160 2.505 2.253 2.743 . 0 0 "[ . 1 . 2 ]" 1
1248 1 128 HIS H 1 129 LEU HA . . 5.990 5.154 4.926 5.379 . 0 0 "[ . 1 . 2 ]" 1
1249 1 128 HIS H 1 129 LEU QB . . 5.430 4.202 3.807 4.485 . 0 0 "[ . 1 . 2 ]" 1
1250 1 128 HIS H 1 130 LEU H . . 5.110 4.310 3.878 4.678 . 0 0 "[ . 1 . 2 ]" 1
1251 1 128 HIS H 1 131 ALA H . . 5.180 4.833 4.600 5.085 . 0 0 "[ . 1 . 2 ]" 1
1252 1 128 HIS HA 1 131 ALA H . . 5.590 3.562 3.259 3.903 . 0 0 "[ . 1 . 2 ]" 1
1253 1 128 HIS HA 1 131 ALA MB . . 4.250 2.641 2.303 3.027 . 0 0 "[ . 1 . 2 ]" 1
1254 1 128 HIS HA 1 132 ALA H . . 6.000 4.456 3.869 4.879 . 0 0 "[ . 1 . 2 ]" 1
1255 1 128 HIS QB 1 129 LEU H . . 4.640 2.688 2.402 2.943 . 0 0 "[ . 1 . 2 ]" 1
1256 1 129 LEU H 1 129 LEU HG . . 4.740 4.392 3.147 4.658 . 0 0 "[ . 1 . 2 ]" 1
1257 1 129 LEU H 1 130 LEU H . . 4.250 2.863 2.595 3.166 . 0 0 "[ . 1 . 2 ]" 1
1258 1 129 LEU H 1 130 LEU QB . . 5.990 4.744 4.473 5.295 . 0 0 "[ . 1 . 2 ]" 1
1259 1 129 LEU H 1 130 LEU QD . . 7.310 4.902 4.115 5.332 . 0 0 "[ . 1 . 2 ]" 1
1260 1 129 LEU H 1 131 ALA H . . 4.990 4.267 3.820 4.752 . 0 0 "[ . 1 . 2 ]" 1
1261 1 129 LEU HA 1 131 ALA H . . 5.510 4.670 4.462 4.893 . 0 0 "[ . 1 . 2 ]" 1
1262 1 129 LEU HA 1 132 ALA H . . 4.710 3.626 3.348 3.892 . 0 0 "[ . 1 . 2 ]" 1
1263 1 129 LEU HA 1 132 ALA MB . . 4.290 2.853 2.321 3.563 . 0 0 "[ . 1 . 2 ]" 1
1264 1 129 LEU HA 1 133 MET H . . 4.890 3.933 3.577 4.168 . 0 0 "[ . 1 . 2 ]" 1
1265 1 129 LEU QB 1 130 LEU H . . 4.890 2.488 2.106 3.505 . 0 0 "[ . 1 . 2 ]" 1
1266 1 129 LEU QD 1 130 LEU H . . 6.260 2.896 2.631 3.352 . 0 0 "[ . 1 . 2 ]" 1
1267 1 129 LEU QD 1 130 LEU QD . . 7.220 2.401 2.003 3.068 . 0 0 "[ . 1 . 2 ]" 1
1268 1 129 LEU QD 1 131 ALA H . . 6.910 4.619 4.409 4.914 . 0 0 "[ . 1 . 2 ]" 1
1269 1 129 LEU QD 1 133 MET H . . 6.690 3.139 2.538 3.944 . 0 0 "[ . 1 . 2 ]" 1
1270 1 129 LEU HG 1 130 LEU H . . 5.330 4.489 2.382 5.339 0.009 21 0 "[ . 1 . 2 ]" 1
1271 1 130 LEU H 1 130 LEU QB . . 3.910 2.365 2.106 2.530 . 0 0 "[ . 1 . 2 ]" 1
1272 1 130 LEU H 1 130 LEU HG . . 4.580 2.799 2.209 4.385 . 0 0 "[ . 1 . 2 ]" 1
1273 1 130 LEU H 1 131 ALA H . . 4.170 2.850 2.640 3.127 . 0 0 "[ . 1 . 2 ]" 1
1274 1 130 LEU H 1 132 ALA H . . 5.380 4.211 3.870 4.583 . 0 0 "[ . 1 . 2 ]" 1
1275 1 130 LEU H 1 133 MET H . . 6.000 4.781 4.535 4.951 . 0 0 "[ . 1 . 2 ]" 1
1276 1 130 LEU HA 1 132 ALA H . . 5.190 4.052 3.792 4.331 . 0 0 "[ . 1 . 2 ]" 1
1277 1 130 LEU HA 1 133 MET H . . 4.840 3.402 3.171 3.802 . 0 0 "[ . 1 . 2 ]" 1
1278 1 130 LEU HA 1 134 ASP H . . 5.540 3.632 3.354 3.896 . 0 0 "[ . 1 . 2 ]" 1
1279 1 130 LEU QB 1 131 ALA H . . 4.250 2.625 2.378 2.800 . 0 0 "[ . 1 . 2 ]" 1
1280 1 130 LEU HB2 1 131 ALA H . . 4.470 2.749 2.587 3.033 . 0 0 "[ . 1 . 2 ]" 1
1281 1 130 LEU HB2 1 132 ALA H . . 5.950 5.100 4.964 5.379 . 0 0 "[ . 1 . 2 ]" 1
1282 1 130 LEU HB3 1 131 ALA H . . 4.470 3.444 2.622 3.739 . 0 0 "[ . 1 . 2 ]" 1
1283 1 130 LEU HB3 1 132 ALA H . . 5.950 5.292 5.017 5.533 . 0 0 "[ . 1 . 2 ]" 1
1284 1 130 LEU QD 1 131 ALA H . . 6.700 4.138 3.855 4.284 . 0 0 "[ . 1 . 2 ]" 1
1285 1 130 LEU QD 1 133 MET H . . 7.500 4.599 4.163 5.066 . 0 0 "[ . 1 . 2 ]" 1
1286 1 130 LEU QD 1 142 ILE MD . . 6.380 3.253 2.183 3.986 . 0 0 "[ . 1 . 2 ]" 1
1287 1 130 LEU HG 1 131 ALA H . . 4.780 4.678 4.497 4.867 0.087 2 0 "[ . 1 . 2 ]" 1
1288 1 131 ALA H 1 132 ALA H . . 4.130 2.881 2.771 2.983 . 0 0 "[ . 1 . 2 ]" 1
1289 1 131 ALA H 1 132 ALA HA . . 5.580 5.518 5.413 5.593 0.013 13 0 "[ . 1 . 2 ]" 1
1290 1 131 ALA H 1 133 MET H . . 5.030 4.574 4.130 4.955 . 0 0 "[ . 1 . 2 ]" 1
1291 1 131 ALA HA 1 134 ASP H . . 5.130 4.035 3.710 4.371 . 0 0 "[ . 1 . 2 ]" 1
1292 1 131 ALA MB 1 132 ALA H . . 4.230 2.799 2.482 3.000 . 0 0 "[ . 1 . 2 ]" 1
1293 1 132 ALA H 1 133 MET H . . 4.040 2.503 2.213 2.760 . 0 0 "[ . 1 . 2 ]" 1
1294 1 132 ALA H 1 133 MET QB . . 4.960 4.185 3.759 4.444 . 0 0 "[ . 1 . 2 ]" 1
1295 1 132 ALA H 1 134 ASP H . . 4.990 3.704 3.399 3.857 . 0 0 "[ . 1 . 2 ]" 1
1296 1 132 ALA H 1 134 ASP HB2 . . 5.320 5.191 4.771 5.333 0.013 8 0 "[ . 1 . 2 ]" 1
1297 1 132 ALA H 1 134 ASP HB3 . . 5.320 4.940 4.323 5.334 0.014 13 0 "[ . 1 . 2 ]" 1
1298 1 132 ALA H 1 135 THR MG . . 5.300 4.501 4.471 4.534 . 0 0 "[ . 1 . 2 ]" 1
1299 1 132 ALA HA 1 135 THR H . . 5.220 3.791 3.652 3.936 . 0 0 "[ . 1 . 2 ]" 1
1300 1 132 ALA HA 1 135 THR MG . . 4.350 2.564 2.285 2.759 . 0 0 "[ . 1 . 2 ]" 1
1301 1 132 ALA MB 1 133 MET H . . 4.180 2.322 2.165 2.528 . 0 0 "[ . 1 . 2 ]" 1
1302 1 132 ALA MB 1 134 ASP H . . 5.030 4.207 4.102 4.273 . 0 0 "[ . 1 . 2 ]" 1
1303 1 132 ALA MB 1 135 THR H . . 5.480 4.552 4.426 4.615 . 0 0 "[ . 1 . 2 ]" 1
1304 1 133 MET H 1 134 ASP H . . 4.240 2.622 2.522 2.815 . 0 0 "[ . 1 . 2 ]" 1
1305 1 133 MET H 1 134 ASP QB . . 5.800 4.331 4.183 4.568 . 0 0 "[ . 1 . 2 ]" 1
1306 1 133 MET H 1 135 THR H . . 5.420 4.150 4.055 4.299 . 0 0 "[ . 1 . 2 ]" 1
1307 1 133 MET H 1 136 THR MG . . 5.400 4.496 4.270 4.579 . 0 0 "[ . 1 . 2 ]" 1
1308 1 133 MET H 1 140 VAL QG . . 7.360 4.685 4.119 5.385 . 0 0 "[ . 1 . 2 ]" 1
1309 1 133 MET QB 1 135 THR H . . 5.220 4.666 4.604 4.711 . 0 0 "[ . 1 . 2 ]" 1
1310 1 133 MET QB 1 136 THR H . . 5.500 4.915 4.676 5.033 . 0 0 "[ . 1 . 2 ]" 1
1311 1 134 ASP H 1 134 ASP HB2 . . 4.130 2.470 2.191 2.637 . 0 0 "[ . 1 . 2 ]" 1
1312 1 134 ASP H 1 134 ASP HB3 . . 4.130 2.527 2.336 2.817 . 0 0 "[ . 1 . 2 ]" 1
1313 1 134 ASP H 1 135 THR H . . 4.370 2.611 2.438 2.708 . 0 0 "[ . 1 . 2 ]" 1
1314 1 134 ASP H 1 135 THR MG . . 4.960 3.661 3.434 3.798 . 0 0 "[ . 1 . 2 ]" 1
1315 1 134 ASP H 1 136 THR H . . 5.890 4.284 4.030 4.487 . 0 0 "[ . 1 . 2 ]" 1
1316 1 134 ASP HB2 1 135 THR H . . 5.160 4.077 3.750 4.205 . 0 0 "[ . 1 . 2 ]" 1
1317 1 134 ASP HB3 1 135 THR H . . 5.160 3.010 2.697 3.223 . 0 0 "[ . 1 . 2 ]" 1
1318 1 135 THR H 1 135 THR MG . . 4.110 2.039 1.995 2.117 . 0 0 "[ . 1 . 2 ]" 1
1319 1 135 THR H 1 136 THR H . . 4.090 2.840 2.491 3.032 . 0 0 "[ . 1 . 2 ]" 1
1320 1 135 THR H 1 136 THR MG . . 4.680 3.368 3.020 3.575 . 0 0 "[ . 1 . 2 ]" 1
1321 1 135 THR HB 1 136 THR H . . 5.270 4.615 4.363 4.737 . 0 0 "[ . 1 . 2 ]" 1
1322 1 135 THR MG 1 136 THR H . . 5.170 4.240 3.977 4.333 . 0 0 "[ . 1 . 2 ]" 1
1323 1 136 THR H 1 136 THR MG . . 4.150 2.336 2.052 2.570 . 0 0 "[ . 1 . 2 ]" 1
1324 1 136 THR H 1 137 GLU H . . 5.610 4.438 4.307 4.617 . 0 0 "[ . 1 . 2 ]" 1
1325 1 136 THR H 1 138 ALA H . . 5.860 4.824 4.326 5.206 . 0 0 "[ . 1 . 2 ]" 1
1326 1 136 THR HA 1 138 ALA H . . 4.860 4.385 4.206 4.598 . 0 0 "[ . 1 . 2 ]" 1
1327 1 136 THR HB 1 137 GLU H . . 4.250 2.317 2.030 2.619 . 0 0 "[ . 1 . 2 ]" 1
1328 1 136 THR HB 1 138 ALA H . . 4.290 3.103 2.776 3.337 . 0 0 "[ . 1 . 2 ]" 1
1329 1 136 THR MG 1 137 GLU H . . 4.960 3.878 3.694 4.063 . 0 0 "[ . 1 . 2 ]" 1
1330 1 136 THR MG 1 138 ALA H . . 4.990 4.189 4.153 4.260 . 0 0 "[ . 1 . 2 ]" 1
1331 1 137 GLU H 1 137 GLU HG2 . . 5.130 4.151 2.491 4.704 . 0 0 "[ . 1 . 2 ]" 1
1332 1 137 GLU H 1 137 GLU QG . . 4.880 3.378 2.342 4.180 . 0 0 "[ . 1 . 2 ]" 1
1333 1 137 GLU H 1 137 GLU HG3 . . 5.130 3.630 2.847 4.858 . 0 0 "[ . 1 . 2 ]" 1
1334 1 137 GLU H 1 138 ALA H . . 4.100 2.377 2.076 2.917 . 0 0 "[ . 1 . 2 ]" 1
1335 1 137 GLU QG 1 138 ALA H . . 5.800 4.522 3.464 4.685 . 0 0 "[ . 1 . 2 ]" 1
1336 1 137 GLU HG2 1 138 ALA H . . 6.000 5.069 4.265 5.447 . 0 0 "[ . 1 . 2 ]" 1
1337 1 137 GLU HG3 1 138 ALA H . . 6.000 5.138 3.665 5.757 . 0 0 "[ . 1 . 2 ]" 1
1338 1 138 ALA H 1 139 ARG H . . 5.580 4.561 4.417 4.653 . 0 0 "[ . 1 . 2 ]" 1
1339 1 138 ALA H 1 140 VAL QG . . 7.290 4.125 3.823 4.367 . 0 0 "[ . 1 . 2 ]" 1
1340 1 138 ALA MB 1 139 ARG H . . 4.380 2.517 2.318 2.838 . 0 0 "[ . 1 . 2 ]" 1
1341 1 139 ARG H 1 140 VAL H . . 5.210 4.707 4.642 4.788 . 0 0 "[ . 1 . 2 ]" 1
1342 1 140 VAL H 1 140 VAL HB . . 4.150 2.636 2.390 3.710 . 0 0 "[ . 1 . 2 ]" 1
1343 1 140 VAL H 1 141 THR H . . 4.940 3.947 3.733 4.222 . 0 0 "[ . 1 . 2 ]" 1
1344 1 140 VAL H 1 141 THR MG . . 6.300 5.291 5.255 5.327 . 0 0 "[ . 1 . 2 ]" 1
1345 1 140 VAL HB 1 141 THR H . . 5.000 4.476 3.413 4.618 . 0 0 "[ . 1 . 2 ]" 1
1346 1 140 VAL QG 1 141 THR H . . 4.520 3.270 2.776 3.419 . 0 0 "[ . 1 . 2 ]" 1
1347 1 140 VAL MG1 1 141 THR H . . 5.080 3.415 2.815 3.600 . 0 0 "[ . 1 . 2 ]" 1
1348 1 140 VAL MG2 1 141 THR H . . 5.080 4.215 3.887 4.284 . 0 0 "[ . 1 . 2 ]" 1
1349 1 141 THR H 1 141 THR MG . . 4.450 3.755 3.731 3.797 . 0 0 "[ . 1 . 2 ]" 1
1350 1 141 THR H 1 142 ILE H . . 4.900 4.253 4.100 4.366 . 0 0 "[ . 1 . 2 ]" 1
1351 1 141 THR H 1 142 ILE HA . . 5.400 4.716 4.492 4.921 . 0 0 "[ . 1 . 2 ]" 1
1352 1 141 THR MG 1 142 ILE H . . 5.170 3.231 2.957 3.421 . 0 0 "[ . 1 . 2 ]" 1
1353 1 141 THR MG 1 143 TYR HD1 . . 4.660 3.412 3.043 3.603 . 0 0 "[ . 1 . 2 ]" 1
1354 1 141 THR MG 1 143 TYR HE1 . . 4.310 2.410 2.226 3.005 . 0 0 "[ . 1 . 2 ]" 1
1355 1 142 ILE H 1 142 ILE HB . . 2.810 2.275 2.201 2.335 . 0 0 "[ . 1 . 2 ]" 1
1356 1 142 ILE H 1 142 ILE MD . . 4.630 3.778 3.502 3.890 . 0 0 "[ . 1 . 2 ]" 1
1357 1 142 ILE H 1 142 ILE QG . . 4.730 4.070 4.019 4.111 . 0 0 "[ . 1 . 2 ]" 1
1358 1 142 ILE H 1 142 ILE MG . . 4.110 2.561 2.367 2.873 . 0 0 "[ . 1 . 2 ]" 1
1359 1 142 ILE H 1 143 TYR H . . 5.150 4.593 4.448 4.654 . 0 0 "[ . 1 . 2 ]" 1
1360 1 142 ILE HB 1 143 TYR H . . 4.790 4.351 4.246 4.607 . 0 0 "[ . 1 . 2 ]" 1
1361 1 142 ILE MD 1 157 LEU QD . . 5.680 3.246 2.740 3.540 . 0 0 "[ . 1 . 2 ]" 1
1362 1 142 ILE MG 1 143 TYR H . . 4.400 3.393 3.150 3.676 . 0 0 "[ . 1 . 2 ]" 1
1363 1 143 TYR H 1 143 TYR HD1 . . 4.190 3.143 2.857 3.359 . 0 0 "[ . 1 . 2 ]" 1
1364 1 143 TYR H 1 143 TYR HE1 . . 5.700 5.561 5.344 5.723 0.023 18 0 "[ . 1 . 2 ]" 1
1365 1 146 ASP HB2 1 147 LYS H . . 4.880 3.910 1.994 4.662 . 0 0 "[ . 1 . 2 ]" 1
1366 1 146 ASP HB3 1 147 LYS H . . 4.880 4.172 2.035 4.780 . 0 0 "[ . 1 . 2 ]" 1
1367 1 147 LYS H 1 147 LYS QD . . 5.130 4.149 2.695 4.603 . 0 0 "[ . 1 . 2 ]" 1
1368 1 147 LYS H 1 147 LYS QG . . 4.840 3.760 2.409 4.387 . 0 0 "[ . 1 . 2 ]" 1
1369 1 148 THR HA 1 151 GLN H . . 4.890 3.081 2.556 3.782 . 0 0 "[ . 1 . 2 ]" 1
1370 1 148 THR HA 1 151 GLN QB . . 4.340 2.957 2.133 3.883 . 0 0 "[ . 1 . 2 ]" 1
1371 1 148 THR HB 1 149 TRP H . . 4.260 3.287 2.124 4.294 0.034 10 0 "[ . 1 . 2 ]" 1
1372 1 148 THR MG 1 149 TRP H . . 4.810 3.597 2.662 4.087 . 0 0 "[ . 1 . 2 ]" 1
1373 1 148 THR MG 1 152 LYS QE . . 5.060 3.089 2.347 3.791 . 0 0 "[ . 1 . 2 ]" 1
1374 1 149 TRP H 1 150 GLU H . . 4.180 2.760 2.459 2.859 . 0 0 "[ . 1 . 2 ]" 1
1375 1 149 TRP H 1 150 GLU QB . . 5.690 4.495 4.027 4.875 . 0 0 "[ . 1 . 2 ]" 1
1376 1 149 TRP H 1 151 GLN H . . 5.290 4.205 3.912 4.419 . 0 0 "[ . 1 . 2 ]" 1
1377 1 149 TRP H 1 152 LYS H . . 5.810 5.045 4.732 5.324 . 0 0 "[ . 1 . 2 ]" 1
1378 1 149 TRP HA 1 152 LYS QB . . 5.610 2.965 2.336 4.069 . 0 0 "[ . 1 . 2 ]" 1
1379 1 149 TRP QB 1 150 GLU H . . 4.380 2.754 2.535 3.140 . 0 0 "[ . 1 . 2 ]" 1
1380 1 149 TRP QB 1 152 LYS H . . 6.880 4.804 4.565 5.303 . 0 0 "[ . 1 . 2 ]" 1
1381 1 149 TRP QB 1 153 ILE H . . 6.220 4.800 4.302 5.419 . 0 0 "[ . 1 . 2 ]" 1
1382 1 149 TRP QB 1 153 ILE MD . . 5.460 3.131 2.263 3.914 . 0 0 "[ . 1 . 2 ]" 1
1383 1 149 TRP HB2 1 150 GLU H . . 4.670 3.127 2.627 3.756 . 0 0 "[ . 1 . 2 ]" 1
1384 1 149 TRP HB3 1 150 GLU H . . 4.670 3.258 2.594 3.818 . 0 0 "[ . 1 . 2 ]" 1
1385 1 150 GLU H 1 151 GLN H . . 4.260 2.832 2.612 3.043 . 0 0 "[ . 1 . 2 ]" 1
1386 1 150 GLU H 1 152 LYS H . . 5.190 4.369 4.172 4.607 . 0 0 "[ . 1 . 2 ]" 1
1387 1 150 GLU H 1 153 ILE H . . 6.000 4.827 4.655 5.056 . 0 0 "[ . 1 . 2 ]" 1
1388 1 150 GLU H 1 153 ILE MD . . 5.040 3.956 3.603 4.236 . 0 0 "[ . 1 . 2 ]" 1
1389 1 150 GLU H 1 153 ILE QG . . 6.370 5.011 3.911 5.736 . 0 0 "[ . 1 . 2 ]" 1
1390 1 150 GLU HA 1 152 LYS H . . 5.530 4.377 4.125 4.683 . 0 0 "[ . 1 . 2 ]" 1
1391 1 150 GLU HA 1 153 ILE H . . 4.650 3.308 2.845 3.566 . 0 0 "[ . 1 . 2 ]" 1
1392 1 150 GLU HA 1 153 ILE HB . . 4.270 2.736 2.198 4.397 0.127 17 0 "[ . 1 . 2 ]" 1
1393 1 150 GLU HA 1 154 LYS H . . 4.840 4.090 3.506 4.680 . 0 0 "[ . 1 . 2 ]" 1
1394 1 150 GLU QB 1 151 GLN H . . 4.370 2.914 2.517 3.599 . 0 0 "[ . 1 . 2 ]" 1
1395 1 151 GLN H 1 151 GLN QG . . 5.090 3.425 2.061 4.040 . 0 0 "[ . 1 . 2 ]" 1
1396 1 151 GLN H 1 152 LYS H . . 4.160 2.728 2.606 3.152 . 0 0 "[ . 1 . 2 ]" 1
1397 1 151 GLN H 1 153 ILE H . . 6.000 4.142 3.963 4.420 . 0 0 "[ . 1 . 2 ]" 1
1398 1 151 GLN H 1 154 LYS H . . 5.810 4.667 4.502 4.966 . 0 0 "[ . 1 . 2 ]" 1
1399 1 151 GLN HA 1 153 ILE H . . 5.720 4.406 4.114 4.919 . 0 0 "[ . 1 . 2 ]" 1
1400 1 151 GLN HA 1 154 LYS H . . 4.610 3.286 3.019 3.788 . 0 0 "[ . 1 . 2 ]" 1
1401 1 151 GLN HA 1 154 LYS QB . . 4.270 2.573 2.327 3.410 . 0 0 "[ . 1 . 2 ]" 1
1402 1 151 GLN HA 1 155 THR H . . 4.920 4.166 3.822 4.683 . 0 0 "[ . 1 . 2 ]" 1
1403 1 151 GLN QB 1 152 LYS H . . 4.440 2.658 2.376 2.865 . 0 0 "[ . 1 . 2 ]" 1
1404 1 151 GLN QB 1 153 ILE H . . 6.000 4.750 4.526 5.063 . 0 0 "[ . 1 . 2 ]" 1
1405 1 151 GLN QB 1 155 THR H . . 5.820 5.038 4.564 5.249 . 0 0 "[ . 1 . 2 ]" 1
1406 1 151 GLN QG 1 152 LYS H . . 4.960 4.145 3.709 4.498 . 0 0 "[ . 1 . 2 ]" 1
1407 1 151 GLN QG 1 154 LYS H . . 6.000 4.922 4.412 5.358 . 0 0 "[ . 1 . 2 ]" 1
1408 1 152 LYS H 1 152 LYS HD2 . . 5.000 3.759 2.116 5.071 0.071 16 0 "[ . 1 . 2 ]" 1
1409 1 152 LYS H 1 152 LYS HD3 . . 5.000 4.436 2.251 5.039 0.039 7 0 "[ . 1 . 2 ]" 1
1410 1 152 LYS H 1 152 LYS QE . . 6.240 3.793 2.461 5.168 . 0 0 "[ . 1 . 2 ]" 1
1411 1 152 LYS H 1 152 LYS QG . . 4.750 2.862 2.215 3.629 . 0 0 "[ . 1 . 2 ]" 1
1412 1 152 LYS H 1 153 ILE H . . 4.200 2.654 2.458 2.854 . 0 0 "[ . 1 . 2 ]" 1
1413 1 152 LYS H 1 153 ILE QG . . 6.010 4.379 3.748 5.406 . 0 0 "[ . 1 . 2 ]" 1
1414 1 152 LYS H 1 154 LYS H . . 5.130 4.075 3.769 4.733 . 0 0 "[ . 1 . 2 ]" 1
1415 1 152 LYS H 1 155 THR H . . 5.340 4.881 4.657 5.089 . 0 0 "[ . 1 . 2 ]" 1
1416 1 152 LYS HA 1 154 LYS H . . 5.320 4.320 4.083 5.108 . 0 0 "[ . 1 . 2 ]" 1
1417 1 152 LYS HA 1 155 THR H . . 4.570 3.408 3.097 3.658 . 0 0 "[ . 1 . 2 ]" 1
1418 1 152 LYS HA 1 156 VAL H . . 5.050 4.141 3.809 4.418 . 0 0 "[ . 1 . 2 ]" 1
1419 1 152 LYS QB 1 153 ILE H . . 4.330 2.799 2.464 3.572 . 0 0 "[ . 1 . 2 ]" 1
1420 1 152 LYS HB2 1 153 ILE H . . 4.590 2.982 2.511 4.230 . 0 0 "[ . 1 . 2 ]" 1
1421 1 152 LYS HB3 1 153 ILE H . . 4.590 3.541 2.990 3.873 . 0 0 "[ . 1 . 2 ]" 1
1422 1 152 LYS QG 1 153 ILE H . . 6.830 4.172 2.278 4.617 . 0 0 "[ . 1 . 2 ]" 1
1423 1 152 LYS QG 1 156 VAL H . . 6.280 5.535 4.844 5.690 . 0 0 "[ . 1 . 2 ]" 1
1424 1 153 ILE H 1 153 ILE HB . . 4.120 2.573 2.262 3.651 . 0 0 "[ . 1 . 2 ]" 1
1425 1 153 ILE H 1 153 ILE MD . . 4.650 3.162 2.065 3.800 . 0 0 "[ . 1 . 2 ]" 1
1426 1 153 ILE H 1 153 ILE HG12 . . 4.650 3.462 2.002 3.952 . 0 0 "[ . 1 . 2 ]" 1
1427 1 153 ILE H 1 153 ILE QG . . 4.250 2.289 1.961 3.380 . 0 0 "[ . 1 . 2 ]" 1
1428 1 153 ILE H 1 153 ILE HG13 . . 4.650 2.448 1.998 3.699 . 0 0 "[ . 1 . 2 ]" 1
1429 1 153 ILE H 1 154 LYS H . . 4.210 2.706 2.493 3.072 . 0 0 "[ . 1 . 2 ]" 1
1430 1 153 ILE H 1 154 LYS QB . . 5.480 4.442 4.249 4.846 . 0 0 "[ . 1 . 2 ]" 1
1431 1 153 ILE H 1 155 THR H . . 5.580 4.409 4.174 4.640 . 0 0 "[ . 1 . 2 ]" 1
1432 1 153 ILE H 1 156 VAL H . . 6.000 4.836 4.701 5.025 . 0 0 "[ . 1 . 2 ]" 1
1433 1 153 ILE HA 1 155 THR H . . 5.360 4.608 4.343 4.846 . 0 0 "[ . 1 . 2 ]" 1
1434 1 153 ILE HA 1 156 VAL H . . 4.520 3.415 3.049 3.857 . 0 0 "[ . 1 . 2 ]" 1
1435 1 153 ILE HA 1 156 VAL QG . . 6.220 2.777 1.960 3.373 . 0 0 "[ . 1 . 2 ]" 1
1436 1 153 ILE HA 1 157 LEU H . . 5.340 3.947 3.604 4.199 . 0 0 "[ . 1 . 2 ]" 1
1437 1 153 ILE HB 1 154 LYS H . . 4.270 2.883 2.198 3.664 . 0 0 "[ . 1 . 2 ]" 1
1438 1 153 ILE MD 1 154 LYS H . . 5.540 4.515 3.980 4.648 . 0 0 "[ . 1 . 2 ]" 1
1439 1 153 ILE QG 1 154 LYS H . . 5.800 4.123 2.429 4.618 . 0 0 "[ . 1 . 2 ]" 1
1440 1 153 ILE MG 1 157 LEU QD . . 5.690 2.758 2.209 3.514 . 0 0 "[ . 1 . 2 ]" 1
1441 1 154 LYS H 1 154 LYS QD . . 5.380 4.360 3.983 4.619 . 0 0 "[ . 1 . 2 ]" 1
1442 1 154 LYS H 1 154 LYS HG2 . . 5.270 4.432 3.258 4.584 . 0 0 "[ . 1 . 2 ]" 1
1443 1 154 LYS H 1 154 LYS HG3 . . 5.270 4.459 4.226 4.658 . 0 0 "[ . 1 . 2 ]" 1
1444 1 154 LYS H 1 155 THR H . . 4.260 2.848 2.724 3.176 . 0 0 "[ . 1 . 2 ]" 1
1445 1 154 LYS H 1 156 VAL H . . 5.210 4.176 3.911 4.845 . 0 0 "[ . 1 . 2 ]" 1
1446 1 154 LYS H 1 157 LEU H . . 5.260 4.771 4.632 4.951 . 0 0 "[ . 1 . 2 ]" 1
1447 1 154 LYS H 1 157 LEU HG . . 5.530 5.509 5.398 5.614 0.084 16 0 "[ . 1 . 2 ]" 1
1448 1 154 LYS HA 1 156 VAL H . . 4.870 4.468 4.152 4.846 . 0 0 "[ . 1 . 2 ]" 1
1449 1 154 LYS HA 1 157 LEU H . . 4.630 3.568 3.311 3.889 . 0 0 "[ . 1 . 2 ]" 1
1450 1 154 LYS HA 1 157 LEU HG . . 4.570 4.009 3.055 4.539 . 0 0 "[ . 1 . 2 ]" 1
1451 1 154 LYS HA 1 158 GLN H . . 5.000 4.260 4.041 4.455 . 0 0 "[ . 1 . 2 ]" 1
1452 1 154 LYS QB 1 155 THR H . . 4.200 2.530 2.321 3.536 . 0 0 "[ . 1 . 2 ]" 1
1453 1 154 LYS QG 1 155 THR H . . 4.810 3.624 2.274 4.141 . 0 0 "[ . 1 . 2 ]" 1
1454 1 154 LYS HG2 1 155 THR H . . 4.970 3.776 2.357 4.425 . 0 0 "[ . 1 . 2 ]" 1
1455 1 154 LYS HG3 1 155 THR H . . 4.970 4.699 2.992 4.986 0.016 6 0 "[ . 1 . 2 ]" 1
1456 1 155 THR H 1 155 THR MG . . 4.410 2.472 2.048 3.727 . 0 0 "[ . 1 . 2 ]" 1
1457 1 155 THR H 1 156 VAL H . . 4.170 2.784 2.640 2.951 . 0 0 "[ . 1 . 2 ]" 1
1458 1 155 THR H 1 156 VAL HA . . 5.890 5.364 5.268 5.493 . 0 0 "[ . 1 . 2 ]" 1
1459 1 155 THR H 1 157 LEU H . . 5.000 4.370 4.094 4.689 . 0 0 "[ . 1 . 2 ]" 1
1460 1 155 THR H 1 158 GLN H . . 5.270 4.837 4.542 5.042 . 0 0 "[ . 1 . 2 ]" 1
1461 1 155 THR HA 1 157 LEU H . . 5.910 4.554 4.143 4.958 . 0 0 "[ . 1 . 2 ]" 1
1462 1 155 THR HB 1 156 VAL H . . 4.740 3.723 2.598 4.262 . 0 0 "[ . 1 . 2 ]" 1
1463 1 155 THR HB 1 158 GLN QB . . 5.380 4.534 4.143 4.871 . 0 0 "[ . 1 . 2 ]" 1
1464 1 155 THR HB 1 159 ASN H . . 6.000 5.495 5.007 6.082 0.082 2 0 "[ . 1 . 2 ]" 1
1465 1 156 VAL H 1 156 VAL HB . . 4.120 2.363 2.250 2.544 . 0 0 "[ . 1 . 2 ]" 1
1466 1 156 VAL H 1 156 VAL MG1 . . 4.450 3.361 2.096 3.739 . 0 0 "[ . 1 . 2 ]" 1
1467 1 156 VAL H 1 156 VAL QG . . 4.040 2.271 2.086 2.515 . 0 0 "[ . 1 . 2 ]" 1
1468 1 156 VAL H 1 156 VAL MG2 . . 4.450 2.656 2.166 3.763 . 0 0 "[ . 1 . 2 ]" 1
1469 1 156 VAL H 1 157 LEU H . . 4.190 2.724 2.586 2.839 . 0 0 "[ . 1 . 2 ]" 1
1470 1 156 VAL H 1 157 LEU QB . . 5.120 4.548 4.097 4.617 . 0 0 "[ . 1 . 2 ]" 1
1471 1 156 VAL H 1 158 GLN H . . 4.800 4.071 3.847 4.409 . 0 0 "[ . 1 . 2 ]" 1
1472 1 156 VAL H 1 159 ASN H . . 5.740 4.662 4.485 4.902 . 0 0 "[ . 1 . 2 ]" 1
1473 1 156 VAL HA 1 158 GLN H . . 4.970 4.199 3.827 4.556 . 0 0 "[ . 1 . 2 ]" 1
1474 1 156 VAL HA 1 159 ASN H . . 4.740 3.137 3.053 3.231 . 0 0 "[ . 1 . 2 ]" 1
1475 1 156 VAL HB 1 157 LEU H . . 4.740 2.939 2.493 4.058 . 0 0 "[ . 1 . 2 ]" 1
1476 1 156 VAL QG 1 157 LEU H . . 4.110 2.833 2.129 3.107 . 0 0 "[ . 1 . 2 ]" 1
1477 1 156 VAL QG 1 158 GLN H . . 6.570 4.405 4.081 4.735 . 0 0 "[ . 1 . 2 ]" 1
1478 1 156 VAL QG 1 159 ASN H . . 5.500 4.083 3.961 4.133 . 0 0 "[ . 1 . 2 ]" 1
1479 1 156 VAL QG 1 160 ARG H . . 7.490 3.984 3.402 4.614 . 0 0 "[ . 1 . 2 ]" 1
1480 1 156 VAL MG1 1 157 LEU H . . 4.710 2.923 2.142 3.254 . 0 0 "[ . 1 . 2 ]" 1
1481 1 156 VAL MG1 1 159 ASN H . . 5.950 4.510 4.303 4.965 . 0 0 "[ . 1 . 2 ]" 1
1482 1 156 VAL MG2 1 157 LEU H . . 4.710 3.929 3.694 3.999 . 0 0 "[ . 1 . 2 ]" 1
1483 1 156 VAL MG2 1 159 ASN H . . 5.950 4.753 4.240 4.963 . 0 0 "[ . 1 . 2 ]" 1
1484 1 157 LEU H 1 157 LEU HG . . 3.820 2.906 2.550 3.902 0.082 16 0 "[ . 1 . 2 ]" 1
1485 1 157 LEU H 1 158 GLN H . . 4.180 2.756 2.329 3.033 . 0 0 "[ . 1 . 2 ]" 1
1486 1 157 LEU H 1 158 GLN QB . . 6.190 4.579 3.946 4.935 . 0 0 "[ . 1 . 2 ]" 1
1487 1 157 LEU H 1 158 GLN QG . . 6.380 5.265 4.578 5.807 . 0 0 "[ . 1 . 2 ]" 1
1488 1 157 LEU H 1 159 ASN H . . 4.880 4.098 3.811 4.359 . 0 0 "[ . 1 . 2 ]" 1
1489 1 157 LEU H 1 160 ARG QB . . 5.950 5.083 4.637 5.356 . 0 0 "[ . 1 . 2 ]" 1
1490 1 157 LEU HA 1 159 ASN H . . 5.250 4.257 4.034 4.495 . 0 0 "[ . 1 . 2 ]" 1
1491 1 157 LEU HA 1 160 ARG H . . 4.800 3.531 3.105 3.921 . 0 0 "[ . 1 . 2 ]" 1
1492 1 157 LEU QB 1 158 GLN H . . 4.170 2.847 2.536 3.241 . 0 0 "[ . 1 . 2 ]" 1
1493 1 157 LEU HG 1 158 GLN H . . 4.920 4.810 3.597 4.977 0.057 9 0 "[ . 1 . 2 ]" 1
1494 1 158 GLN H 1 158 GLN HG2 . . 4.800 3.655 2.737 4.423 . 0 0 "[ . 1 . 2 ]" 1
1495 1 158 GLN H 1 158 GLN QG . . 4.500 3.082 2.480 3.869 . 0 0 "[ . 1 . 2 ]" 1
1496 1 158 GLN H 1 158 GLN HG3 . . 4.800 3.481 2.541 4.271 . 0 0 "[ . 1 . 2 ]" 1
1497 1 158 GLN H 1 159 ASN H . . 4.150 2.566 2.385 2.740 . 0 0 "[ . 1 . 2 ]" 1
1498 1 158 GLN H 1 160 ARG H . . 5.000 4.121 3.934 4.440 . 0 0 "[ . 1 . 2 ]" 1
1499 1 158 GLN HA 1 160 ARG H . . 5.000 4.242 3.621 5.043 0.043 5 0 "[ . 1 . 2 ]" 1
1500 1 158 GLN HB2 1 159 ASN H . . 4.400 3.213 2.777 4.155 . 0 0 "[ . 1 . 2 ]" 1
1501 1 158 GLN HB3 1 159 ASN H . . 4.400 3.386 2.727 3.973 . 0 0 "[ . 1 . 2 ]" 1
1502 1 158 GLN HG2 1 159 ASN H . . 5.130 4.932 4.561 5.148 0.018 21 0 "[ . 1 . 2 ]" 1
1503 1 158 GLN HG3 1 159 ASN H . . 5.130 4.788 3.432 5.171 0.041 16 0 "[ . 1 . 2 ]" 1
1504 1 159 ASN H 1 160 ARG H . . 4.260 2.568 2.453 2.863 . 0 0 "[ . 1 . 2 ]" 1
1505 1 159 ASN H 1 160 ARG QB . . 5.650 4.413 4.079 4.634 . 0 0 "[ . 1 . 2 ]" 1
1506 1 159 ASN H 1 160 ARG QG . . 5.220 4.079 3.760 4.460 . 0 0 "[ . 1 . 2 ]" 1
1507 1 160 ARG H 1 160 ARG HD2 . . 5.360 4.943 4.323 5.440 0.080 3 0 "[ . 1 . 2 ]" 1
1508 1 160 ARG H 1 160 ARG QD . . 5.160 4.320 3.576 4.634 . 0 0 "[ . 1 . 2 ]" 1
1509 1 160 ARG H 1 160 ARG HD3 . . 5.360 4.816 3.810 5.385 0.025 4 0 "[ . 1 . 2 ]" 1
1510 1 160 ARG H 1 160 ARG QG . . 3.950 2.551 1.969 3.182 . 0 0 "[ . 1 . 2 ]" 1
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