NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405295 |
1x5e   |
11113 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x5e
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 2706
_Distance_constraint_stats_list.Viol_count 1337
_Distance_constraint_stats_list.Viol_total 425.367
_Distance_constraint_stats_list.Viol_max 0.182
_Distance_constraint_stats_list.Viol_rms 0.0039
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0159
_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 7 GLY 0.161 0.075 4 0 "[ . 1 . 2]"
1 8 ASN 0.029 0.009 20 0 "[ . 1 . 2]"
1 9 VAL 0.109 0.014 20 0 "[ . 1 . 2]"
1 10 ARG 0.458 0.130 12 0 "[ . 1 . 2]"
1 11 VAL 0.046 0.014 18 0 "[ . 1 . 2]"
1 12 ILE 0.438 0.044 17 0 "[ . 1 . 2]"
1 13 THR 0.220 0.034 11 0 "[ . 1 . 2]"
1 14 ASP 0.457 0.066 15 0 "[ . 1 . 2]"
1 15 GLU 0.303 0.087 13 0 "[ . 1 . 2]"
1 16 ASN 0.377 0.044 17 0 "[ . 1 . 2]"
1 17 TRP 0.618 0.066 15 0 "[ . 1 . 2]"
1 18 ARG 0.475 0.093 12 0 "[ . 1 . 2]"
1 19 GLU 0.479 0.096 17 0 "[ . 1 . 2]"
1 20 LEU 0.230 0.027 20 0 "[ . 1 . 2]"
1 21 LEU 0.168 0.016 3 0 "[ . 1 . 2]"
1 22 GLU 0.253 0.031 3 0 "[ . 1 . 2]"
1 23 GLY 0.086 0.026 4 0 "[ . 1 . 2]"
1 24 ASP 0.022 0.009 14 0 "[ . 1 . 2]"
1 25 TRP 0.369 0.019 8 0 "[ . 1 . 2]"
1 26 MET 0.342 0.021 9 0 "[ . 1 . 2]"
1 27 ILE 0.233 0.031 18 0 "[ . 1 . 2]"
1 28 GLU 0.274 0.062 3 0 "[ . 1 . 2]"
1 29 PHE 0.369 0.062 3 0 "[ . 1 . 2]"
1 30 TYR 0.811 0.037 6 0 "[ . 1 . 2]"
1 31 ALA 0.082 0.010 6 0 "[ . 1 . 2]"
1 32 PRO 0.298 0.036 12 0 "[ . 1 . 2]"
1 33 TRP 0.302 0.040 14 0 "[ . 1 . 2]"
1 34 CYS 0.388 0.097 12 0 "[ . 1 . 2]"
1 35 PRO 0.041 0.013 1 0 "[ . 1 . 2]"
1 36 ALA 0.048 0.015 20 0 "[ . 1 . 2]"
1 37 CYS 0.120 0.023 16 0 "[ . 1 . 2]"
1 38 GLN 0.343 0.058 14 0 "[ . 1 . 2]"
1 39 ASN 0.236 0.088 1 0 "[ . 1 . 2]"
1 40 LEU 1.011 0.042 18 0 "[ . 1 . 2]"
1 41 GLN 1.165 0.043 6 0 "[ . 1 . 2]"
1 42 PRO 0.221 0.032 16 0 "[ . 1 . 2]"
1 43 GLU 0.155 0.036 18 0 "[ . 1 . 2]"
1 44 TRP 0.891 0.043 6 0 "[ . 1 . 2]"
1 45 GLU 0.266 0.038 6 0 "[ . 1 . 2]"
1 46 SER 0.377 0.080 18 0 "[ . 1 . 2]"
1 47 PHE 2.079 0.108 18 0 "[ . 1 . 2]"
1 48 ALA 0.444 0.075 4 0 "[ . 1 . 2]"
1 49 GLU 0.117 0.027 8 0 "[ . 1 . 2]"
1 50 TRP 2.021 0.067 17 0 "[ . 1 . 2]"
1 51 GLY 0.017 0.009 6 0 "[ . 1 . 2]"
1 52 GLU 0.065 0.022 9 0 "[ . 1 . 2]"
1 53 ASP 0.949 0.067 17 0 "[ . 1 . 2]"
1 54 LEU 2.083 0.069 19 0 "[ . 1 . 2]"
1 55 GLU 0.523 0.044 14 0 "[ . 1 . 2]"
1 56 VAL 0.934 0.044 14 0 "[ . 1 . 2]"
1 57 ASN 0.053 0.011 20 0 "[ . 1 . 2]"
1 58 ILE 0.382 0.029 5 0 "[ . 1 . 2]"
1 59 ALA 0.025 0.012 20 0 "[ . 1 . 2]"
1 60 LYS 0.118 0.017 1 0 "[ . 1 . 2]"
1 61 VAL 1.049 0.107 8 0 "[ . 1 . 2]"
1 62 ASP 0.568 0.107 8 0 "[ . 1 . 2]"
1 63 VAL 0.717 0.083 10 0 "[ . 1 . 2]"
1 64 THR 0.447 0.060 10 0 "[ . 1 . 2]"
1 65 GLU 0.143 0.033 4 0 "[ . 1 . 2]"
1 66 GLN 0.205 0.033 4 0 "[ . 1 . 2]"
1 67 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 LEU 0.256 0.091 3 0 "[ . 1 . 2]"
1 70 SER 0.039 0.022 3 0 "[ . 1 . 2]"
1 71 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ARG 0.280 0.091 3 0 "[ . 1 . 2]"
1 73 PHE 0.338 0.041 12 0 "[ . 1 . 2]"
1 74 ILE 0.223 0.043 12 0 "[ . 1 . 2]"
1 75 ILE 0.065 0.031 13 0 "[ . 1 . 2]"
1 76 ASN 0.033 0.018 12 0 "[ . 1 . 2]"
1 77 ALA 0.070 0.030 20 0 "[ . 1 . 2]"
1 78 LEU 0.128 0.020 12 0 "[ . 1 . 2]"
1 79 PRO 0.140 0.023 16 0 "[ . 1 . 2]"
1 80 THR 0.148 0.030 20 0 "[ . 1 . 2]"
1 81 ILE 0.074 0.026 20 0 "[ . 1 . 2]"
1 82 TYR 0.060 0.010 12 0 "[ . 1 . 2]"
1 83 HIS 0.051 0.016 12 0 "[ . 1 . 2]"
1 84 CYS 0.055 0.017 8 0 "[ . 1 . 2]"
1 85 LYS 0.193 0.141 14 0 "[ . 1 . 2]"
1 86 ASP 0.059 0.020 18 0 "[ . 1 . 2]"
1 87 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 GLU 0.040 0.020 18 0 "[ . 1 . 2]"
1 89 PHE 0.021 0.009 12 0 "[ . 1 . 2]"
1 90 ARG 0.195 0.141 10 0 "[ . 1 . 2]"
1 91 ARG 0.022 0.007 19 0 "[ . 1 . 2]"
1 92 TYR 0.093 0.026 20 0 "[ . 1 . 2]"
1 93 GLN 0.016 0.011 20 0 "[ . 1 . 2]"
1 94 GLY 0.006 0.004 13 0 "[ . 1 . 2]"
1 95 PRO 0.202 0.134 19 0 "[ . 1 . 2]"
1 96 ARG 0.517 0.134 19 0 "[ . 1 . 2]"
1 97 THR 0.289 0.035 20 0 "[ . 1 . 2]"
1 98 LYS 1.336 0.106 16 0 "[ . 1 . 2]"
1 99 LYS 1.197 0.089 16 0 "[ . 1 . 2]"
1 100 ASP 0.713 0.182 14 0 "[ . 1 . 2]"
1 101 PHE 0.386 0.036 16 0 "[ . 1 . 2]"
1 102 ILE 2.000 0.108 18 0 "[ . 1 . 2]"
1 103 ASN 0.398 0.182 14 0 "[ . 1 . 2]"
1 104 PHE 0.081 0.018 16 0 "[ . 1 . 2]"
1 105 ILE 0.274 0.031 14 0 "[ . 1 . 2]"
1 106 SER 0.199 0.034 7 0 "[ . 1 . 2]"
1 107 ASP 0.090 0.034 7 0 "[ . 1 . 2]"
1 108 LYS 0.030 0.014 12 0 "[ . 1 . 2]"
1 109 GLU 0.221 0.072 5 0 "[ . 1 . 2]"
1 110 TRP 0.152 0.049 13 0 "[ . 1 . 2]"
1 111 LYS 0.089 0.049 13 0 "[ . 1 . 2]"
1 112 SER 0.001 0.001 8 0 "[ . 1 . 2]"
1 113 ILE 0.185 0.060 10 0 "[ . 1 . 2]"
1 114 GLU 0.083 0.060 10 0 "[ . 1 . 2]"
1 115 PRO 0.174 0.141 10 0 "[ . 1 . 2]"
1 116 VAL 0.059 0.021 10 0 "[ . 1 . 2]"
1 117 SER 0.041 0.021 10 0 "[ . 1 . 2]"
1 118 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 TRP 0.721 0.047 8 0 "[ . 1 . 2]"
1 120 PHE 0.071 0.037 14 0 "[ . 1 . 2]"
1 121 SER 0.053 0.042 11 0 "[ . 1 . 2]"
1 122 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 7 GLY QA 1 8 ASN H . . 3.110 2.184 2.111 2.374 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 8 ASN QB . . 5.330 4.205 3.988 4.407 . 0 0 "[ . 1 . 2]" 1
3 1 7 GLY QA 1 9 VAL H . . 4.550 3.312 3.065 3.709 . 0 0 "[ . 1 . 2]" 1
4 1 7 GLY QA 1 48 ALA MB . . 5.500 5.486 5.288 5.575 0.075 4 0 "[ . 1 . 2]" 1
5 1 8 ASN H 1 8 ASN HB2 . . 3.830 2.656 2.233 3.593 . 0 0 "[ . 1 . 2]" 1
6 1 8 ASN H 1 8 ASN QB . . 3.310 2.484 2.210 2.742 . 0 0 "[ . 1 . 2]" 1
7 1 8 ASN H 1 8 ASN HB3 . . 3.830 3.468 2.706 3.698 . 0 0 "[ . 1 . 2]" 1
8 1 8 ASN H 1 8 ASN QD . . 4.530 3.486 2.514 4.306 . 0 0 "[ . 1 . 2]" 1
9 1 8 ASN H 1 9 VAL H . . 3.310 2.590 2.107 2.910 . 0 0 "[ . 1 . 2]" 1
10 1 8 ASN H 1 9 VAL MG2 . . 4.520 4.073 3.589 4.488 . 0 0 "[ . 1 . 2]" 1
11 1 8 ASN H 1 48 ALA MB . . 4.800 4.313 4.034 4.628 . 0 0 "[ . 1 . 2]" 1
12 1 8 ASN HA 1 9 VAL MG2 . . 5.030 4.763 4.302 5.024 . 0 0 "[ . 1 . 2]" 1
13 1 8 ASN HA 1 48 ALA MB . . 4.770 4.056 2.738 4.737 . 0 0 "[ . 1 . 2]" 1
14 1 8 ASN QB 1 8 ASN QD . . 2.820 2.146 2.064 2.333 . 0 0 "[ . 1 . 2]" 1
15 1 8 ASN QB 1 9 VAL HA . . 5.340 3.981 3.869 4.177 . 0 0 "[ . 1 . 2]" 1
16 1 8 ASN QB 1 9 VAL MG2 . . 3.960 3.081 2.615 3.451 . 0 0 "[ . 1 . 2]" 1
17 1 8 ASN QB 1 49 GLU HA . . 4.260 3.814 3.113 4.268 0.008 10 0 "[ . 1 . 2]" 1
18 1 8 ASN HB2 1 9 VAL H . . 4.120 2.940 2.524 3.581 . 0 0 "[ . 1 . 2]" 1
19 1 8 ASN HB2 1 9 VAL MG2 . . 4.580 3.224 2.884 3.572 . 0 0 "[ . 1 . 2]" 1
20 1 8 ASN HB2 1 48 ALA MB . . 3.590 2.284 1.935 3.266 . 0 0 "[ . 1 . 2]" 1
21 1 8 ASN HB3 1 9 VAL H . . 4.120 3.827 3.400 4.129 0.009 20 0 "[ . 1 . 2]" 1
22 1 8 ASN HB3 1 9 VAL MG2 . . 4.580 4.052 2.934 4.585 0.005 7 0 "[ . 1 . 2]" 1
23 1 8 ASN HB3 1 48 ALA MB . . 3.590 2.442 1.764 3.391 . 0 0 "[ . 1 . 2]" 1
24 1 8 ASN QD 1 48 ALA MB . . 4.290 3.209 2.306 4.020 . 0 0 "[ . 1 . 2]" 1
25 1 8 ASN QD 1 49 GLU HA . . 3.720 2.683 1.850 3.723 0.003 11 0 "[ . 1 . 2]" 1
26 1 8 ASN QD 1 49 GLU QG . . 3.920 3.290 2.187 3.866 . 0 0 "[ . 1 . 2]" 1
27 1 8 ASN HD21 1 49 GLU HA . . 4.340 2.882 1.899 4.148 . 0 0 "[ . 1 . 2]" 1
28 1 8 ASN HD22 1 49 GLU HA . . 4.340 3.343 2.553 4.210 . 0 0 "[ . 1 . 2]" 1
29 1 9 VAL H 1 9 VAL HB . . 2.900 2.539 2.455 2.653 . 0 0 "[ . 1 . 2]" 1
30 1 9 VAL H 1 9 VAL MG1 . . 4.010 3.780 3.753 3.857 . 0 0 "[ . 1 . 2]" 1
31 1 9 VAL H 1 9 VAL MG2 . . 3.000 2.293 1.958 2.719 . 0 0 "[ . 1 . 2]" 1
32 1 9 VAL H 1 10 ARG H . . 4.880 4.542 4.402 4.602 . 0 0 "[ . 1 . 2]" 1
33 1 9 VAL H 1 48 ALA MB . . 4.070 3.573 3.255 3.823 . 0 0 "[ . 1 . 2]" 1
34 1 9 VAL HA 1 9 VAL MG1 . . 3.160 2.355 2.191 2.466 . 0 0 "[ . 1 . 2]" 1
35 1 9 VAL HA 1 9 VAL MG2 . . 3.110 2.402 2.280 2.516 . 0 0 "[ . 1 . 2]" 1
36 1 9 VAL HA 1 10 ARG H . . 2.870 2.175 2.142 2.215 . 0 0 "[ . 1 . 2]" 1
37 1 9 VAL HA 1 10 ARG HA . . 4.470 4.375 4.365 4.386 . 0 0 "[ . 1 . 2]" 1
38 1 9 VAL HA 1 10 ARG HB2 . . 4.780 4.364 4.294 4.424 . 0 0 "[ . 1 . 2]" 1
39 1 9 VAL HA 1 10 ARG QG . . 4.750 4.121 3.957 4.320 . 0 0 "[ . 1 . 2]" 1
40 1 9 VAL HA 1 48 ALA MB . . 3.570 3.225 2.989 3.403 . 0 0 "[ . 1 . 2]" 1
41 1 9 VAL HA 1 58 ILE H . . 4.860 4.517 4.190 4.701 . 0 0 "[ . 1 . 2]" 1
42 1 9 VAL HA 1 58 ILE HB . . 4.300 3.156 2.909 3.335 . 0 0 "[ . 1 . 2]" 1
43 1 9 VAL HA 1 58 ILE MD . . 5.190 4.711 4.465 4.867 . 0 0 "[ . 1 . 2]" 1
44 1 9 VAL HA 1 58 ILE MG . . 4.120 3.095 2.731 3.434 . 0 0 "[ . 1 . 2]" 1
45 1 9 VAL HA 1 59 ALA HA . . 4.200 3.498 3.257 3.734 . 0 0 "[ . 1 . 2]" 1
46 1 9 VAL HB 1 10 ARG H . . 4.560 4.088 3.930 4.248 . 0 0 "[ . 1 . 2]" 1
47 1 9 VAL HB 1 44 TRP HD1 . . 4.730 4.541 4.085 4.733 0.003 19 0 "[ . 1 . 2]" 1
48 1 9 VAL HB 1 48 ALA MB . . 5.140 4.518 4.295 4.709 . 0 0 "[ . 1 . 2]" 1
49 1 9 VAL HB 1 60 LYS HD3 . . 4.680 3.556 2.796 4.185 . 0 0 "[ . 1 . 2]" 1
50 1 9 VAL HB 1 60 LYS QE . . 3.980 3.703 3.218 3.969 . 0 0 "[ . 1 . 2]" 1
51 1 9 VAL MG1 1 10 ARG H . . 3.290 2.349 2.061 2.747 . 0 0 "[ . 1 . 2]" 1
52 1 9 VAL MG1 1 44 TRP HD1 . . 3.220 2.623 2.286 3.038 . 0 0 "[ . 1 . 2]" 1
53 1 9 VAL MG1 1 44 TRP HE1 . . 3.200 2.543 2.086 2.920 . 0 0 "[ . 1 . 2]" 1
54 1 9 VAL MG1 1 45 GLU HA . . 5.500 5.303 5.000 5.505 0.005 15 0 "[ . 1 . 2]" 1
55 1 9 VAL MG1 1 58 ILE MG . . 3.280 2.787 2.354 3.131 . 0 0 "[ . 1 . 2]" 1
56 1 9 VAL MG1 1 59 ALA H . . 4.450 3.996 3.689 4.350 . 0 0 "[ . 1 . 2]" 1
57 1 9 VAL MG1 1 59 ALA HA . . 3.260 2.312 1.980 2.692 . 0 0 "[ . 1 . 2]" 1
58 1 9 VAL MG1 1 60 LYS H . . 3.520 2.837 2.498 3.012 . 0 0 "[ . 1 . 2]" 1
59 1 9 VAL MG1 1 60 LYS HA . . 4.650 3.929 3.689 4.195 . 0 0 "[ . 1 . 2]" 1
60 1 9 VAL MG1 1 60 LYS HB2 . . 4.370 3.604 3.352 3.919 . 0 0 "[ . 1 . 2]" 1
61 1 9 VAL MG1 1 60 LYS HB3 . . 3.190 2.204 1.956 2.530 . 0 0 "[ . 1 . 2]" 1
62 1 9 VAL MG1 1 60 LYS HD3 . . 3.050 1.981 1.792 2.201 . 0 0 "[ . 1 . 2]" 1
63 1 9 VAL MG1 1 60 LYS HE2 . . 4.270 2.895 1.978 3.832 . 0 0 "[ . 1 . 2]" 1
64 1 9 VAL MG1 1 60 LYS QE . . 3.570 2.740 1.964 3.457 . 0 0 "[ . 1 . 2]" 1
65 1 9 VAL MG1 1 60 LYS HE3 . . 4.270 3.765 3.324 4.271 0.001 15 0 "[ . 1 . 2]" 1
66 1 9 VAL MG1 1 60 LYS HG3 . . 4.180 3.785 3.630 4.054 . 0 0 "[ . 1 . 2]" 1
67 1 9 VAL MG2 1 10 ARG H . . 4.110 4.002 3.886 4.118 0.008 18 0 "[ . 1 . 2]" 1
68 1 9 VAL MG2 1 44 TRP HB3 . . 4.630 3.792 3.416 4.119 . 0 0 "[ . 1 . 2]" 1
69 1 9 VAL MG2 1 44 TRP HD1 . . 3.240 2.249 1.945 2.629 . 0 0 "[ . 1 . 2]" 1
70 1 9 VAL MG2 1 44 TRP HE1 . . 3.860 3.105 2.910 3.327 . 0 0 "[ . 1 . 2]" 1
71 1 9 VAL MG2 1 44 TRP HZ2 . . 5.500 5.307 5.138 5.500 0.000 6 0 "[ . 1 . 2]" 1
72 1 9 VAL MG2 1 45 GLU H . . 4.800 4.365 4.068 4.608 . 0 0 "[ . 1 . 2]" 1
73 1 9 VAL MG2 1 45 GLU HA . . 3.120 3.023 2.775 3.131 0.011 2 0 "[ . 1 . 2]" 1
74 1 9 VAL MG2 1 45 GLU QB . . 4.650 4.414 4.163 4.539 . 0 0 "[ . 1 . 2]" 1
75 1 9 VAL MG2 1 45 GLU HG2 . . 3.430 3.098 2.725 3.332 . 0 0 "[ . 1 . 2]" 1
76 1 9 VAL MG2 1 45 GLU HG3 . . 4.090 4.006 3.787 4.100 0.010 20 0 "[ . 1 . 2]" 1
77 1 9 VAL MG2 1 48 ALA H . . 4.320 4.102 3.840 4.301 . 0 0 "[ . 1 . 2]" 1
78 1 9 VAL MG2 1 48 ALA HA . . 4.770 4.512 4.336 4.775 0.005 19 0 "[ . 1 . 2]" 1
79 1 9 VAL MG2 1 48 ALA MB . . 2.690 2.244 2.081 2.472 . 0 0 "[ . 1 . 2]" 1
80 1 9 VAL MG2 1 58 ILE HB . . 4.020 3.723 3.474 3.971 . 0 0 "[ . 1 . 2]" 1
81 1 9 VAL MG2 1 58 ILE MD . . 4.960 4.760 4.504 4.974 0.014 20 0 "[ . 1 . 2]" 1
82 1 9 VAL MG2 1 58 ILE MG . . 3.240 2.676 2.432 2.905 . 0 0 "[ . 1 . 2]" 1
83 1 9 VAL MG2 1 59 ALA HA . . 4.990 4.483 4.327 4.789 . 0 0 "[ . 1 . 2]" 1
84 1 9 VAL MG2 1 60 LYS HB2 . . 5.500 5.305 5.148 5.484 . 0 0 "[ . 1 . 2]" 1
85 1 9 VAL MG2 1 60 LYS HD3 . . 4.080 3.591 3.263 3.858 . 0 0 "[ . 1 . 2]" 1
86 1 9 VAL MG2 1 60 LYS QE . . 5.040 4.462 4.040 4.676 . 0 0 "[ . 1 . 2]" 1
87 1 10 ARG H 1 10 ARG HB2 . . 3.380 2.323 2.275 2.384 . 0 0 "[ . 1 . 2]" 1
88 1 10 ARG H 1 10 ARG HB3 . . 3.790 3.577 3.531 3.619 . 0 0 "[ . 1 . 2]" 1
89 1 10 ARG H 1 10 ARG QD . . 4.670 4.561 4.381 4.700 0.030 19 0 "[ . 1 . 2]" 1
90 1 10 ARG H 1 10 ARG QG . . 3.520 3.000 2.891 3.172 . 0 0 "[ . 1 . 2]" 1
91 1 10 ARG H 1 11 VAL H . . 4.600 4.560 4.536 4.582 . 0 0 "[ . 1 . 2]" 1
92 1 10 ARG H 1 44 TRP HE1 . . 5.460 4.865 4.604 5.341 . 0 0 "[ . 1 . 2]" 1
93 1 10 ARG H 1 58 ILE H . . 5.500 4.350 4.156 4.552 . 0 0 "[ . 1 . 2]" 1
94 1 10 ARG H 1 58 ILE MG . . 4.920 3.764 3.438 4.186 . 0 0 "[ . 1 . 2]" 1
95 1 10 ARG H 1 59 ALA H . . 4.710 4.192 4.086 4.363 . 0 0 "[ . 1 . 2]" 1
96 1 10 ARG H 1 59 ALA HA . . 2.990 1.936 1.886 2.150 . 0 0 "[ . 1 . 2]" 1
97 1 10 ARG H 1 59 ALA MB . . 4.170 3.164 3.003 3.403 . 0 0 "[ . 1 . 2]" 1
98 1 10 ARG HA 1 10 ARG QD . . 3.370 2.837 2.411 3.500 0.130 12 0 "[ . 1 . 2]" 1
99 1 10 ARG HA 1 10 ARG QG . . 3.480 2.441 2.139 2.530 . 0 0 "[ . 1 . 2]" 1
100 1 10 ARG HA 1 11 VAL H . . 2.660 2.269 2.209 2.289 . 0 0 "[ . 1 . 2]" 1
101 1 10 ARG HA 1 11 VAL MG2 . . 4.010 3.605 3.398 3.690 . 0 0 "[ . 1 . 2]" 1
102 1 10 ARG HA 1 59 ALA HA . . 4.930 4.109 4.023 4.213 . 0 0 "[ . 1 . 2]" 1
103 1 10 ARG HB2 1 10 ARG QD . . 3.480 3.189 2.761 3.284 . 0 0 "[ . 1 . 2]" 1
104 1 10 ARG HB2 1 10 ARG QG . . 2.730 2.147 2.140 2.176 . 0 0 "[ . 1 . 2]" 1
105 1 10 ARG HB2 1 11 VAL H . . 4.370 4.048 3.977 4.136 . 0 0 "[ . 1 . 2]" 1
106 1 10 ARG HB2 1 12 ILE MD . . 4.590 3.741 3.405 4.063 . 0 0 "[ . 1 . 2]" 1
107 1 10 ARG HB2 1 12 ILE HG12 . . 4.970 4.119 3.897 4.363 . 0 0 "[ . 1 . 2]" 1
108 1 10 ARG HB2 1 25 TRP HE3 . . 5.310 4.278 4.060 4.578 . 0 0 "[ . 1 . 2]" 1
109 1 10 ARG HB2 1 25 TRP HH2 . . 5.500 4.438 4.057 4.748 . 0 0 "[ . 1 . 2]" 1
110 1 10 ARG HB2 1 25 TRP HZ3 . . 4.290 2.783 2.490 3.251 . 0 0 "[ . 1 . 2]" 1
111 1 10 ARG HB2 1 59 ALA HA . . 3.780 2.747 2.616 2.911 . 0 0 "[ . 1 . 2]" 1
112 1 10 ARG HB2 1 59 ALA MB . . 3.410 2.207 1.969 2.393 . 0 0 "[ . 1 . 2]" 1
113 1 10 ARG HB3 1 11 VAL H . . 3.160 2.818 2.746 3.007 . 0 0 "[ . 1 . 2]" 1
114 1 10 ARG HB3 1 12 ILE MD . . 4.020 3.104 2.808 3.428 . 0 0 "[ . 1 . 2]" 1
115 1 10 ARG HB3 1 12 ILE HG12 . . 4.630 3.866 3.577 4.112 . 0 0 "[ . 1 . 2]" 1
116 1 10 ARG HB3 1 25 TRP HZ3 . . 4.340 2.871 2.602 3.065 . 0 0 "[ . 1 . 2]" 1
117 1 10 ARG HB3 1 59 ALA HA . . 4.050 3.937 3.766 4.055 0.005 13 0 "[ . 1 . 2]" 1
118 1 10 ARG HB3 1 59 ALA MB . . 3.640 2.766 2.603 2.908 . 0 0 "[ . 1 . 2]" 1
119 1 10 ARG QD 1 11 VAL H . . 3.880 3.308 2.702 3.888 0.008 15 0 "[ . 1 . 2]" 1
120 1 10 ARG QD 1 12 ILE MD . . 4.210 3.914 3.211 4.215 0.005 20 0 "[ . 1 . 2]" 1
121 1 10 ARG QD 1 25 TRP HH2 . . 3.600 3.104 2.024 3.573 . 0 0 "[ . 1 . 2]" 1
122 1 10 ARG QD 1 25 TRP HZ2 . . 5.500 5.167 4.202 5.500 0.000 2 0 "[ . 1 . 2]" 1
123 1 10 ARG QD 1 25 TRP HZ3 . . 3.920 3.566 2.630 3.928 0.008 19 0 "[ . 1 . 2]" 1
124 1 10 ARG QD 1 57 ASN HB3 . . 5.260 5.147 4.460 5.271 0.011 20 0 "[ . 1 . 2]" 1
125 1 10 ARG QD 1 59 ALA MB . . 4.500 4.304 3.964 4.478 . 0 0 "[ . 1 . 2]" 1
126 1 10 ARG QG 1 11 VAL H . . 4.370 4.116 3.694 4.290 . 0 0 "[ . 1 . 2]" 1
127 1 10 ARG QG 1 12 ILE MD . . 4.480 4.403 4.209 4.492 0.012 20 0 "[ . 1 . 2]" 1
128 1 10 ARG QG 1 25 TRP HH2 . . 4.050 3.561 3.165 4.068 0.018 15 0 "[ . 1 . 2]" 1
129 1 10 ARG QG 1 25 TRP HZ3 . . 3.950 3.257 2.863 3.959 0.009 15 0 "[ . 1 . 2]" 1
130 1 10 ARG QG 1 58 ILE H . . 5.030 4.011 3.623 4.492 . 0 0 "[ . 1 . 2]" 1
131 1 10 ARG QG 1 59 ALA HA . . 4.530 4.263 4.135 4.436 . 0 0 "[ . 1 . 2]" 1
132 1 11 VAL H 1 11 VAL HB . . 3.060 2.522 2.487 2.564 . 0 0 "[ . 1 . 2]" 1
133 1 11 VAL H 1 11 VAL MG1 . . 3.840 3.797 3.780 3.818 . 0 0 "[ . 1 . 2]" 1
134 1 11 VAL H 1 11 VAL MG2 . . 3.070 2.688 2.531 2.803 . 0 0 "[ . 1 . 2]" 1
135 1 11 VAL H 1 12 ILE H . . 4.590 4.129 4.063 4.293 . 0 0 "[ . 1 . 2]" 1
136 1 11 VAL H 1 59 ALA MB . . 4.910 4.131 3.959 4.324 . 0 0 "[ . 1 . 2]" 1
137 1 11 VAL HA 1 11 VAL MG1 . . 3.120 2.435 2.334 2.484 . 0 0 "[ . 1 . 2]" 1
138 1 11 VAL HA 1 11 VAL MG2 . . 3.050 2.285 2.228 2.404 . 0 0 "[ . 1 . 2]" 1
139 1 11 VAL HA 1 12 ILE H . . 2.890 2.191 2.148 2.211 . 0 0 "[ . 1 . 2]" 1
140 1 11 VAL HA 1 12 ILE HB . . 4.840 4.651 4.594 4.702 . 0 0 "[ . 1 . 2]" 1
141 1 11 VAL HA 1 12 ILE MD . . 5.080 4.708 4.508 5.012 . 0 0 "[ . 1 . 2]" 1
142 1 11 VAL HA 1 12 ILE HG12 . . 5.090 4.057 3.918 4.198 . 0 0 "[ . 1 . 2]" 1
143 1 11 VAL HA 1 59 ALA MB . . 4.250 3.671 3.389 3.868 . 0 0 "[ . 1 . 2]" 1
144 1 11 VAL HA 1 60 LYS H . . 3.710 2.974 2.834 3.115 . 0 0 "[ . 1 . 2]" 1
145 1 11 VAL HA 1 60 LYS HG3 . . 4.680 4.078 3.734 4.441 . 0 0 "[ . 1 . 2]" 1
146 1 11 VAL HA 1 61 VAL MG2 . . 5.350 4.888 4.681 5.256 . 0 0 "[ . 1 . 2]" 1
147 1 11 VAL HB 1 12 ILE H . . 4.560 4.444 4.384 4.474 . 0 0 "[ . 1 . 2]" 1
148 1 11 VAL MG1 1 12 ILE H . . 3.480 3.182 3.005 3.329 . 0 0 "[ . 1 . 2]" 1
149 1 11 VAL MG1 1 13 THR H . . 4.750 4.532 4.192 4.737 . 0 0 "[ . 1 . 2]" 1
150 1 11 VAL MG1 1 60 LYS HE2 . . 5.170 4.452 3.542 5.147 . 0 0 "[ . 1 . 2]" 1
151 1 11 VAL MG1 1 60 LYS QE . . 4.410 3.719 3.299 4.057 . 0 0 "[ . 1 . 2]" 1
152 1 11 VAL MG1 1 60 LYS HE3 . . 5.170 4.198 3.359 5.079 . 0 0 "[ . 1 . 2]" 1
153 1 11 VAL MG1 1 60 LYS HG2 . . 4.410 4.065 3.800 4.328 . 0 0 "[ . 1 . 2]" 1
154 1 11 VAL MG1 1 60 LYS HG3 . . 4.550 4.183 3.831 4.522 . 0 0 "[ . 1 . 2]" 1
155 1 11 VAL MG1 1 61 VAL MG2 . . 5.130 4.755 4.478 5.138 0.008 13 0 "[ . 1 . 2]" 1
156 1 11 VAL MG2 1 12 ILE H . . 4.390 4.167 4.065 4.242 . 0 0 "[ . 1 . 2]" 1
157 1 11 VAL MG2 1 30 TYR QE . . 5.500 5.405 5.157 5.504 0.004 3 0 "[ . 1 . 2]" 1
158 1 11 VAL MG2 1 60 LYS H . . 4.260 4.058 3.910 4.224 . 0 0 "[ . 1 . 2]" 1
159 1 11 VAL MG2 1 60 LYS HE2 . . 3.320 2.556 1.962 3.320 . 0 0 "[ . 1 . 2]" 1
160 1 11 VAL MG2 1 60 LYS HE3 . . 3.320 2.806 1.930 3.334 0.014 18 0 "[ . 1 . 2]" 1
161 1 11 VAL MG2 1 60 LYS HG2 . . 3.370 2.904 2.657 3.140 . 0 0 "[ . 1 . 2]" 1
162 1 11 VAL MG2 1 60 LYS HG3 . . 4.120 3.722 3.428 4.114 . 0 0 "[ . 1 . 2]" 1
163 1 12 ILE H 1 12 ILE HB . . 3.350 2.493 2.433 2.554 . 0 0 "[ . 1 . 2]" 1
164 1 12 ILE H 1 12 ILE MD . . 4.390 3.426 3.256 3.611 . 0 0 "[ . 1 . 2]" 1
165 1 12 ILE H 1 12 ILE HG12 . . 3.720 2.331 2.145 2.576 . 0 0 "[ . 1 . 2]" 1
166 1 12 ILE H 1 12 ILE HG13 . . 4.540 3.728 3.579 3.946 . 0 0 "[ . 1 . 2]" 1
167 1 12 ILE H 1 12 ILE MG . . 4.250 3.771 3.754 3.788 . 0 0 "[ . 1 . 2]" 1
168 1 12 ILE H 1 13 THR H . . 4.910 4.559 4.438 4.601 . 0 0 "[ . 1 . 2]" 1
169 1 12 ILE H 1 13 THR MG . . 4.820 4.721 4.292 4.854 0.034 11 0 "[ . 1 . 2]" 1
170 1 12 ILE H 1 59 ALA MB . . 4.540 2.922 2.704 3.150 . 0 0 "[ . 1 . 2]" 1
171 1 12 ILE H 1 60 LYS H . . 4.070 3.199 2.904 3.630 . 0 0 "[ . 1 . 2]" 1
172 1 12 ILE H 1 61 VAL MG2 . . 4.120 3.504 3.259 3.762 . 0 0 "[ . 1 . 2]" 1
173 1 12 ILE HB 1 12 ILE MD . . 3.530 3.221 3.216 3.230 . 0 0 "[ . 1 . 2]" 1
174 1 12 ILE HB 1 13 THR H . . 4.490 4.060 3.896 4.281 . 0 0 "[ . 1 . 2]" 1
175 1 12 ILE HB 1 13 THR HA . . 5.450 4.806 4.691 4.950 . 0 0 "[ . 1 . 2]" 1
176 1 12 ILE HB 1 13 THR MG . . 5.500 5.224 4.965 5.376 . 0 0 "[ . 1 . 2]" 1
177 1 12 ILE HB 1 17 TRP HA . . 5.110 4.879 4.429 5.124 0.014 14 0 "[ . 1 . 2]" 1
178 1 12 ILE HB 1 20 LEU MD2 . . 4.580 4.073 3.628 4.317 . 0 0 "[ . 1 . 2]" 1
179 1 12 ILE HB 1 61 VAL HA . . 5.380 4.232 3.868 4.589 . 0 0 "[ . 1 . 2]" 1
180 1 12 ILE HB 1 61 VAL HB . . 5.500 5.293 4.961 5.498 . 0 0 "[ . 1 . 2]" 1
181 1 12 ILE HB 1 61 VAL MG2 . . 2.970 2.390 2.069 2.624 . 0 0 "[ . 1 . 2]" 1
182 1 12 ILE MD 1 12 ILE MG . . 2.840 2.011 1.891 2.157 . 0 0 "[ . 1 . 2]" 1
183 1 12 ILE MD 1 13 THR H . . 4.020 3.423 3.243 3.617 . 0 0 "[ . 1 . 2]" 1
184 1 12 ILE MD 1 13 THR MG . . 5.470 4.969 4.626 5.321 . 0 0 "[ . 1 . 2]" 1
185 1 12 ILE MD 1 16 ASN HB2 . . 4.560 3.457 2.382 4.127 . 0 0 "[ . 1 . 2]" 1
186 1 12 ILE MD 1 16 ASN QB . . 3.810 2.273 2.025 2.660 . 0 0 "[ . 1 . 2]" 1
187 1 12 ILE MD 1 16 ASN HB3 . . 4.560 2.320 2.089 2.700 . 0 0 "[ . 1 . 2]" 1
188 1 12 ILE MD 1 16 ASN HD21 . . 4.170 2.887 2.157 3.850 . 0 0 "[ . 1 . 2]" 1
189 1 12 ILE MD 1 16 ASN QD . . 3.560 2.703 2.063 3.413 . 0 0 "[ . 1 . 2]" 1
190 1 12 ILE MD 1 16 ASN HD22 . . 4.170 3.539 2.417 4.214 0.044 17 0 "[ . 1 . 2]" 1
191 1 12 ILE MD 1 17 TRP H . . 5.220 4.287 4.005 4.549 . 0 0 "[ . 1 . 2]" 1
192 1 12 ILE MD 1 17 TRP HA . . 3.930 3.577 3.197 3.919 . 0 0 "[ . 1 . 2]" 1
193 1 12 ILE MD 1 19 GLU H . . 5.180 4.818 4.584 5.011 . 0 0 "[ . 1 . 2]" 1
194 1 12 ILE MD 1 19 GLU HB2 . . 3.840 3.372 2.974 3.617 . 0 0 "[ . 1 . 2]" 1
195 1 12 ILE MD 1 19 GLU HB3 . . 4.320 4.177 3.883 4.315 . 0 0 "[ . 1 . 2]" 1
196 1 12 ILE MD 1 19 GLU QG . . 4.910 4.256 3.730 4.662 . 0 0 "[ . 1 . 2]" 1
197 1 12 ILE MD 1 20 LEU QB . . 5.340 4.615 4.236 4.846 . 0 0 "[ . 1 . 2]" 1
198 1 12 ILE MD 1 20 LEU MD2 . . 3.430 2.189 1.922 2.528 . 0 0 "[ . 1 . 2]" 1
199 1 12 ILE MD 1 25 TRP HE3 . . 3.800 2.955 2.662 3.299 . 0 0 "[ . 1 . 2]" 1
200 1 12 ILE MD 1 25 TRP HH2 . . 3.860 3.306 2.911 3.648 . 0 0 "[ . 1 . 2]" 1
201 1 12 ILE MD 1 25 TRP HZ2 . . 5.500 4.624 4.271 4.932 . 0 0 "[ . 1 . 2]" 1
202 1 12 ILE MD 1 25 TRP HZ3 . . 3.690 2.119 1.957 2.510 . 0 0 "[ . 1 . 2]" 1
203 1 12 ILE MD 1 59 ALA HA . . 5.240 4.862 4.549 5.185 . 0 0 "[ . 1 . 2]" 1
204 1 12 ILE MD 1 59 ALA MB . . 3.420 2.661 2.391 2.912 . 0 0 "[ . 1 . 2]" 1
205 1 12 ILE MD 1 61 VAL MG2 . . 4.840 4.610 4.361 4.784 . 0 0 "[ . 1 . 2]" 1
206 1 12 ILE HG12 1 25 TRP HZ3 . . 4.900 3.555 3.122 4.015 . 0 0 "[ . 1 . 2]" 1
207 1 12 ILE HG12 1 59 ALA HA . . 4.720 4.183 3.966 4.383 . 0 0 "[ . 1 . 2]" 1
208 1 12 ILE HG12 1 59 ALA MB . . 3.020 1.846 1.773 1.913 . 0 0 "[ . 1 . 2]" 1
209 1 12 ILE HG12 1 60 LYS H . . 4.820 3.779 3.409 4.331 . 0 0 "[ . 1 . 2]" 1
210 1 12 ILE HG13 1 12 ILE MG . . 3.060 2.342 2.213 2.456 . 0 0 "[ . 1 . 2]" 1
211 1 12 ILE HG13 1 20 LEU MD1 . . 4.070 3.184 2.865 3.540 . 0 0 "[ . 1 . 2]" 1
212 1 12 ILE HG13 1 20 LEU MD2 . . 3.760 2.117 1.966 2.469 . 0 0 "[ . 1 . 2]" 1
213 1 12 ILE HG13 1 25 TRP HZ3 . . 4.860 3.972 3.408 4.378 . 0 0 "[ . 1 . 2]" 1
214 1 12 ILE HG13 1 59 ALA MB . . 3.220 2.538 2.274 2.775 . 0 0 "[ . 1 . 2]" 1
215 1 12 ILE HG13 1 61 VAL MG2 . . 4.090 3.854 3.520 4.116 0.026 15 0 "[ . 1 . 2]" 1
216 1 12 ILE MG 1 13 THR H . . 3.340 2.143 1.866 2.817 . 0 0 "[ . 1 . 2]" 1
217 1 12 ILE MG 1 13 THR HA . . 4.700 3.661 3.511 3.997 . 0 0 "[ . 1 . 2]" 1
218 1 12 ILE MG 1 15 GLU H . . 5.340 4.437 4.288 4.667 . 0 0 "[ . 1 . 2]" 1
219 1 12 ILE MG 1 16 ASN QB . . 3.370 2.210 1.900 2.719 . 0 0 "[ . 1 . 2]" 1
220 1 12 ILE MG 1 17 TRP H . . 3.820 2.688 2.367 2.908 . 0 0 "[ . 1 . 2]" 1
221 1 12 ILE MG 1 17 TRP HA . . 3.060 2.185 1.907 2.424 . 0 0 "[ . 1 . 2]" 1
222 1 12 ILE MG 1 17 TRP QB . . 3.580 2.949 2.605 3.209 . 0 0 "[ . 1 . 2]" 1
223 1 12 ILE MG 1 17 TRP HD1 . . 5.480 4.859 4.504 5.149 . 0 0 "[ . 1 . 2]" 1
224 1 12 ILE MG 1 20 LEU MD2 . . 3.650 2.774 2.322 3.033 . 0 0 "[ . 1 . 2]" 1
225 1 12 ILE MG 1 20 LEU HG . . 3.950 2.902 2.607 3.331 . 0 0 "[ . 1 . 2]" 1
226 1 12 ILE MG 1 59 ALA MB . . 4.300 3.984 3.883 4.091 . 0 0 "[ . 1 . 2]" 1
227 1 12 ILE MG 1 61 VAL MG2 . . 3.340 3.076 2.792 3.246 . 0 0 "[ . 1 . 2]" 1
228 1 13 THR H 1 13 THR HG1 . . 4.670 3.131 1.846 3.658 . 0 0 "[ . 1 . 2]" 1
229 1 13 THR H 1 13 THR MG . . 3.500 2.927 2.568 3.312 . 0 0 "[ . 1 . 2]" 1
230 1 13 THR H 1 15 GLU H . . 4.890 3.735 3.614 3.881 . 0 0 "[ . 1 . 2]" 1
231 1 13 THR H 1 16 ASN H . . 4.010 2.835 2.620 2.993 . 0 0 "[ . 1 . 2]" 1
232 1 13 THR H 1 16 ASN QB . . 4.390 1.813 1.687 1.892 . 0 0 "[ . 1 . 2]" 1
233 1 13 THR H 1 16 ASN QD . . 4.040 3.369 2.247 4.066 0.026 10 0 "[ . 1 . 2]" 1
234 1 13 THR H 1 17 TRP H . . 4.620 3.464 2.929 3.947 . 0 0 "[ . 1 . 2]" 1
235 1 13 THR H 1 69 LEU MD1 . . 4.830 3.888 3.316 4.238 . 0 0 "[ . 1 . 2]" 1
236 1 13 THR HA 1 13 THR MG . . 3.160 2.285 2.069 2.449 . 0 0 "[ . 1 . 2]" 1
237 1 13 THR HA 1 14 ASP H . . 3.350 2.653 2.634 2.679 . 0 0 "[ . 1 . 2]" 1
238 1 13 THR HA 1 61 VAL MG1 . . 5.110 4.975 4.703 5.126 0.016 12 0 "[ . 1 . 2]" 1
239 1 13 THR HA 1 66 GLN HB3 . . 5.060 4.536 3.973 4.962 . 0 0 "[ . 1 . 2]" 1
240 1 13 THR HA 1 66 GLN HE21 . . 4.520 3.712 3.240 4.109 . 0 0 "[ . 1 . 2]" 1
241 1 13 THR HA 1 66 GLN HE22 . . 4.520 3.947 3.393 4.419 . 0 0 "[ . 1 . 2]" 1
242 1 13 THR HA 1 66 GLN QG . . 3.420 2.935 2.626 3.252 . 0 0 "[ . 1 . 2]" 1
243 1 13 THR HA 1 69 LEU MD1 . . 3.870 2.578 2.139 2.798 . 0 0 "[ . 1 . 2]" 1
244 1 13 THR HA 1 69 LEU HG . . 5.500 4.468 3.866 4.923 . 0 0 "[ . 1 . 2]" 1
245 1 13 THR HB 1 14 ASP H . . 3.110 1.902 1.873 1.939 . 0 0 "[ . 1 . 2]" 1
246 1 13 THR HB 1 14 ASP QB . . 4.700 3.966 3.621 4.417 . 0 0 "[ . 1 . 2]" 1
247 1 13 THR HB 1 15 GLU H . . 3.420 2.861 2.608 3.112 . 0 0 "[ . 1 . 2]" 1
248 1 13 THR HB 1 16 ASN H . . 4.430 3.832 3.463 4.218 . 0 0 "[ . 1 . 2]" 1
249 1 13 THR HB 1 66 GLN QE . . 3.610 3.324 2.649 3.620 0.010 4 0 "[ . 1 . 2]" 1
250 1 13 THR HB 1 66 GLN QG . . 4.940 4.616 4.086 4.844 . 0 0 "[ . 1 . 2]" 1
251 1 13 THR HG1 1 15 GLU H . . 3.630 2.423 1.935 3.160 . 0 0 "[ . 1 . 2]" 1
252 1 13 THR HG1 1 15 GLU HB2 . . 4.750 3.401 2.240 4.689 . 0 0 "[ . 1 . 2]" 1
253 1 13 THR HG1 1 15 GLU QB . . 4.150 2.783 2.227 3.581 . 0 0 "[ . 1 . 2]" 1
254 1 13 THR HG1 1 15 GLU HB3 . . 4.750 3.519 2.288 4.653 . 0 0 "[ . 1 . 2]" 1
255 1 13 THR HG1 1 16 ASN H . . 4.210 2.321 1.857 3.044 . 0 0 "[ . 1 . 2]" 1
256 1 13 THR MG 1 14 ASP H . . 4.000 3.437 3.244 3.585 . 0 0 "[ . 1 . 2]" 1
257 1 13 THR MG 1 15 GLU H . . 4.190 4.104 4.065 4.124 . 0 0 "[ . 1 . 2]" 1
258 1 13 THR MG 1 16 ASN H . . 4.850 4.120 3.949 4.314 . 0 0 "[ . 1 . 2]" 1
259 1 13 THR MG 1 16 ASN QD . . 4.710 3.975 2.428 4.642 . 0 0 "[ . 1 . 2]" 1
260 1 13 THR MG 1 66 GLN HE21 . . 3.670 3.189 2.604 3.676 0.006 4 0 "[ . 1 . 2]" 1
261 1 13 THR MG 1 66 GLN HE22 . . 3.670 3.099 2.528 3.582 . 0 0 "[ . 1 . 2]" 1
262 1 13 THR MG 1 66 GLN QG . . 3.970 3.719 3.114 3.985 0.015 16 0 "[ . 1 . 2]" 1
263 1 13 THR MG 1 69 LEU MD1 . . 4.760 4.112 3.846 4.325 . 0 0 "[ . 1 . 2]" 1
264 1 14 ASP H 1 14 ASP HB2 . . 3.730 2.943 2.199 3.601 . 0 0 "[ . 1 . 2]" 1
265 1 14 ASP H 1 14 ASP QB . . 3.150 2.437 2.178 2.795 . 0 0 "[ . 1 . 2]" 1
266 1 14 ASP H 1 14 ASP HB3 . . 3.730 2.868 2.308 3.600 . 0 0 "[ . 1 . 2]" 1
267 1 14 ASP H 1 15 GLU H . . 3.520 2.653 2.596 2.682 . 0 0 "[ . 1 . 2]" 1
268 1 14 ASP H 1 66 GLN HB3 . . 5.130 4.696 4.223 5.126 . 0 0 "[ . 1 . 2]" 1
269 1 14 ASP H 1 66 GLN QE . . 4.520 3.375 2.772 3.937 . 0 0 "[ . 1 . 2]" 1
270 1 14 ASP H 1 66 GLN QG . . 4.340 4.205 3.795 4.343 0.003 8 0 "[ . 1 . 2]" 1
271 1 14 ASP H 1 69 LEU MD1 . . 4.320 3.502 3.085 3.892 . 0 0 "[ . 1 . 2]" 1
272 1 14 ASP H 1 69 LEU HG . . 4.400 4.178 3.395 4.404 0.004 18 0 "[ . 1 . 2]" 1
273 1 14 ASP HA 1 16 ASN H . . 5.000 4.756 4.493 5.005 0.005 10 0 "[ . 1 . 2]" 1
274 1 14 ASP HA 1 17 TRP H . . 4.230 4.175 4.057 4.270 0.040 18 0 "[ . 1 . 2]" 1
275 1 14 ASP HA 1 17 TRP QB . . 4.330 3.444 3.033 3.750 . 0 0 "[ . 1 . 2]" 1
276 1 14 ASP HA 1 17 TRP HD1 . . 3.550 3.334 2.444 3.616 0.066 15 0 "[ . 1 . 2]" 1
277 1 14 ASP HA 1 69 LEU MD1 . . 3.880 3.265 2.797 3.650 . 0 0 "[ . 1 . 2]" 1
278 1 14 ASP HA 1 69 LEU MD2 . . 4.090 3.008 2.070 3.518 . 0 0 "[ . 1 . 2]" 1
279 1 14 ASP HA 1 69 LEU HG . . 3.820 2.616 2.046 3.188 . 0 0 "[ . 1 . 2]" 1
280 1 14 ASP QB 1 15 GLU H . . 4.190 3.569 3.340 3.855 . 0 0 "[ . 1 . 2]" 1
281 1 14 ASP HB2 1 17 TRP HD1 . . 5.500 4.960 4.337 5.547 0.047 10 0 "[ . 1 . 2]" 1
282 1 14 ASP HB3 1 17 TRP HD1 . . 5.500 5.081 3.856 5.541 0.041 17 0 "[ . 1 . 2]" 1
283 1 15 GLU H 1 15 GLU HB2 . . 3.710 2.807 2.401 3.784 0.074 4 0 "[ . 1 . 2]" 1
284 1 15 GLU H 1 15 GLU QB . . 2.970 2.488 2.366 2.882 . 0 0 "[ . 1 . 2]" 1
285 1 15 GLU H 1 15 GLU HB3 . . 3.710 3.138 2.567 3.716 0.006 1 0 "[ . 1 . 2]" 1
286 1 15 GLU H 1 15 GLU QG . . 4.310 3.638 2.358 4.209 . 0 0 "[ . 1 . 2]" 1
287 1 15 GLU H 1 16 ASN H . . 3.100 1.991 1.837 2.186 . 0 0 "[ . 1 . 2]" 1
288 1 15 GLU H 1 16 ASN HA . . 4.960 4.685 4.565 4.826 . 0 0 "[ . 1 . 2]" 1
289 1 15 GLU H 1 17 TRP H . . 4.190 3.325 3.187 3.499 . 0 0 "[ . 1 . 2]" 1
290 1 15 GLU H 1 69 LEU MD1 . . 5.500 4.633 4.366 5.037 . 0 0 "[ . 1 . 2]" 1
291 1 15 GLU HA 1 15 GLU QG . . 3.250 2.551 2.167 3.337 0.087 13 0 "[ . 1 . 2]" 1
292 1 15 GLU HA 1 17 TRP H . . 4.520 3.968 3.790 4.265 . 0 0 "[ . 1 . 2]" 1
293 1 15 GLU HA 1 17 TRP HD1 . . 4.910 2.741 2.113 3.447 . 0 0 "[ . 1 . 2]" 1
294 1 15 GLU QB 1 16 ASN QB . . 4.750 4.133 3.836 4.748 . 0 0 "[ . 1 . 2]" 1
295 1 15 GLU HB2 1 16 ASN H . . 3.990 3.355 2.440 4.017 0.027 4 0 "[ . 1 . 2]" 1
296 1 15 GLU HB3 1 16 ASN H . . 3.990 3.137 2.497 3.997 0.007 13 0 "[ . 1 . 2]" 1
297 1 15 GLU QG 1 16 ASN H . . 4.730 3.957 1.882 4.546 . 0 0 "[ . 1 . 2]" 1
298 1 16 ASN H 1 16 ASN HB2 . . 3.860 2.270 2.130 2.696 . 0 0 "[ . 1 . 2]" 1
299 1 16 ASN H 1 16 ASN HB3 . . 3.860 3.103 2.820 3.591 . 0 0 "[ . 1 . 2]" 1
300 1 16 ASN H 1 17 TRP H . . 2.990 2.575 2.469 2.699 . 0 0 "[ . 1 . 2]" 1
301 1 16 ASN H 1 17 TRP HD1 . . 4.670 4.287 3.642 4.695 0.025 2 0 "[ . 1 . 2]" 1
302 1 16 ASN HA 1 16 ASN QD . . 4.400 3.834 3.562 4.090 . 0 0 "[ . 1 . 2]" 1
303 1 16 ASN HA 1 18 ARG H . . 5.310 4.004 3.868 4.148 . 0 0 "[ . 1 . 2]" 1
304 1 16 ASN HA 1 19 GLU QG . . 4.790 3.219 2.646 3.674 . 0 0 "[ . 1 . 2]" 1
305 1 16 ASN QB 1 19 GLU QG . . 4.500 4.051 3.021 4.505 0.005 8 0 "[ . 1 . 2]" 1
306 1 16 ASN QB 1 20 LEU MD2 . . 5.340 4.766 4.286 5.341 0.001 7 0 "[ . 1 . 2]" 1
307 1 17 TRP H 1 17 TRP QB . . 2.930 2.238 2.161 2.366 . 0 0 "[ . 1 . 2]" 1
308 1 17 TRP H 1 17 TRP HD1 . . 3.310 2.983 2.361 3.352 0.042 20 0 "[ . 1 . 2]" 1
309 1 17 TRP H 1 18 ARG H . . 3.630 3.043 2.982 3.097 . 0 0 "[ . 1 . 2]" 1
310 1 17 TRP H 1 19 GLU H . . 4.840 4.608 4.436 4.829 . 0 0 "[ . 1 . 2]" 1
311 1 17 TRP HA 1 17 TRP HE3 . . 4.610 3.891 3.603 4.362 . 0 0 "[ . 1 . 2]" 1
312 1 17 TRP HA 1 19 GLU H . . 4.600 4.397 4.195 4.596 . 0 0 "[ . 1 . 2]" 1
313 1 17 TRP HA 1 19 GLU HB2 . . 5.420 4.652 4.542 4.797 . 0 0 "[ . 1 . 2]" 1
314 1 17 TRP HA 1 20 LEU H . . 4.590 3.484 3.332 3.652 . 0 0 "[ . 1 . 2]" 1
315 1 17 TRP HA 1 20 LEU QB . . 4.510 3.713 3.440 3.970 . 0 0 "[ . 1 . 2]" 1
316 1 17 TRP HA 1 20 LEU MD1 . . 3.970 2.080 1.873 2.310 . 0 0 "[ . 1 . 2]" 1
317 1 17 TRP HA 1 20 LEU MD2 . . 4.940 3.611 3.407 3.830 . 0 0 "[ . 1 . 2]" 1
318 1 17 TRP HA 1 20 LEU HG . . 4.050 2.376 2.154 2.604 . 0 0 "[ . 1 . 2]" 1
319 1 17 TRP HA 1 69 LEU MD1 . . 4.760 4.582 4.154 4.766 0.006 8 0 "[ . 1 . 2]" 1
320 1 17 TRP QB 1 17 TRP HD1 . . 3.530 2.576 2.517 2.699 . 0 0 "[ . 1 . 2]" 1
321 1 17 TRP QB 1 17 TRP HE3 . . 3.870 2.641 2.453 2.785 . 0 0 "[ . 1 . 2]" 1
322 1 17 TRP QB 1 18 ARG H . . 4.730 3.281 3.211 3.346 . 0 0 "[ . 1 . 2]" 1
323 1 17 TRP QB 1 20 LEU MD1 . . 3.540 2.445 2.047 2.737 . 0 0 "[ . 1 . 2]" 1
324 1 17 TRP QB 1 20 LEU MD2 . . 5.500 4.690 4.433 4.904 . 0 0 "[ . 1 . 2]" 1
325 1 17 TRP QB 1 20 LEU HG . . 5.020 3.958 3.752 4.120 . 0 0 "[ . 1 . 2]" 1
326 1 17 TRP QB 1 69 LEU MD1 . . 3.940 3.591 3.166 3.944 0.004 14 0 "[ . 1 . 2]" 1
327 1 17 TRP QB 1 69 LEU MD2 . . 3.780 2.272 1.901 2.519 . 0 0 "[ . 1 . 2]" 1
328 1 17 TRP QB 1 69 LEU HG . . 4.710 4.119 3.470 4.552 . 0 0 "[ . 1 . 2]" 1
329 1 17 TRP HD1 1 69 LEU MD1 . . 5.500 5.251 4.822 5.500 . 17 0 "[ . 1 . 2]" 1
330 1 17 TRP HD1 1 69 LEU MD2 . . 4.490 4.029 2.959 4.444 . 0 0 "[ . 1 . 2]" 1
331 1 17 TRP HE1 1 18 ARG QG . . 4.790 2.821 2.455 3.078 . 0 0 "[ . 1 . 2]" 1
332 1 17 TRP HE3 1 18 ARG HA . . 4.510 3.075 2.642 3.511 . 0 0 "[ . 1 . 2]" 1
333 1 17 TRP HE3 1 20 LEU QB . . 4.880 3.332 2.764 4.285 . 0 0 "[ . 1 . 2]" 1
334 1 17 TRP HE3 1 20 LEU MD1 . . 3.970 3.084 2.528 3.990 0.020 14 0 "[ . 1 . 2]" 1
335 1 17 TRP HE3 1 21 LEU MD1 . . 4.450 3.702 2.974 4.102 . 0 0 "[ . 1 . 2]" 1
336 1 17 TRP HE3 1 21 LEU MD2 . . 4.540 3.410 2.701 3.773 . 0 0 "[ . 1 . 2]" 1
337 1 17 TRP HH2 1 21 LEU MD1 . . 4.100 2.383 1.945 3.547 . 0 0 "[ . 1 . 2]" 1
338 1 17 TRP HH2 1 21 LEU MD2 . . 5.500 3.631 2.706 5.364 . 0 0 "[ . 1 . 2]" 1
339 1 17 TRP HZ2 1 18 ARG H . . 5.500 4.935 4.752 5.169 . 0 0 "[ . 1 . 2]" 1
340 1 17 TRP HZ2 1 18 ARG QD . . 4.480 3.526 2.073 4.383 . 0 0 "[ . 1 . 2]" 1
341 1 17 TRP HZ2 1 21 LEU MD1 . . 4.940 3.970 3.365 4.907 . 0 0 "[ . 1 . 2]" 1
342 1 17 TRP HZ3 1 21 LEU MD1 . . 3.950 2.208 1.811 2.806 . 0 0 "[ . 1 . 2]" 1
343 1 17 TRP HZ3 1 21 LEU MD2 . . 4.000 2.219 1.896 3.483 . 0 0 "[ . 1 . 2]" 1
344 1 18 ARG H 1 18 ARG QB . . 3.590 2.396 2.233 2.611 . 0 0 "[ . 1 . 2]" 1
345 1 18 ARG H 1 18 ARG QD . . 4.260 4.068 3.825 4.238 . 0 0 "[ . 1 . 2]" 1
346 1 18 ARG H 1 18 ARG HG2 . . 4.550 3.131 2.335 3.888 . 0 0 "[ . 1 . 2]" 1
347 1 18 ARG H 1 18 ARG QG . . 3.760 2.403 2.068 2.720 . 0 0 "[ . 1 . 2]" 1
348 1 18 ARG H 1 18 ARG HG3 . . 4.550 2.712 2.123 3.685 . 0 0 "[ . 1 . 2]" 1
349 1 18 ARG H 1 19 GLU H . . 3.980 3.006 2.837 3.174 . 0 0 "[ . 1 . 2]" 1
350 1 18 ARG H 1 119 TRP HZ2 . . 5.500 5.516 5.503 5.545 0.045 4 0 "[ . 1 . 2]" 1
351 1 18 ARG HA 1 18 ARG QD . . 4.460 3.542 2.204 4.179 . 0 0 "[ . 1 . 2]" 1
352 1 18 ARG HA 1 18 ARG HG2 . . 4.170 2.413 2.237 2.648 . 0 0 "[ . 1 . 2]" 1
353 1 18 ARG HA 1 18 ARG QG . . 3.530 2.345 2.189 2.592 . 0 0 "[ . 1 . 2]" 1
354 1 18 ARG HA 1 18 ARG HG3 . . 4.170 3.245 2.700 3.712 . 0 0 "[ . 1 . 2]" 1
355 1 18 ARG HA 1 20 LEU H . . 4.410 4.011 3.847 4.288 . 0 0 "[ . 1 . 2]" 1
356 1 18 ARG HA 1 20 LEU MD1 . . 5.330 4.906 4.516 5.269 . 0 0 "[ . 1 . 2]" 1
357 1 18 ARG HA 1 21 LEU H . . 4.210 3.494 3.329 3.792 . 0 0 "[ . 1 . 2]" 1
358 1 18 ARG HA 1 21 LEU QB . . 4.640 3.851 3.494 4.160 . 0 0 "[ . 1 . 2]" 1
359 1 18 ARG HA 1 21 LEU MD1 . . 3.660 2.402 1.961 2.798 . 0 0 "[ . 1 . 2]" 1
360 1 18 ARG HA 1 21 LEU HG . . 3.850 2.659 2.420 2.946 . 0 0 "[ . 1 . 2]" 1
361 1 18 ARG HA 1 119 TRP HZ2 . . 5.030 4.695 3.976 5.077 0.047 8 0 "[ . 1 . 2]" 1
362 1 18 ARG HB2 1 18 ARG QD . . 3.290 2.777 2.270 3.383 0.093 12 0 "[ . 1 . 2]" 1
363 1 18 ARG HB2 1 19 GLU H . . 4.370 2.530 2.301 2.743 . 0 0 "[ . 1 . 2]" 1
364 1 18 ARG HB3 1 18 ARG QD . . 3.290 2.370 2.092 2.821 . 0 0 "[ . 1 . 2]" 1
365 1 18 ARG HB3 1 19 GLU H . . 4.370 3.267 3.020 3.552 . 0 0 "[ . 1 . 2]" 1
366 1 18 ARG QD 1 21 LEU MD1 . . 4.350 3.522 1.772 4.283 . 0 0 "[ . 1 . 2]" 1
367 1 18 ARG QG 1 21 LEU MD1 . . 3.790 3.051 2.480 3.796 0.006 12 0 "[ . 1 . 2]" 1
368 1 19 GLU H 1 19 GLU HB2 . . 3.250 2.427 2.299 2.601 . 0 0 "[ . 1 . 2]" 1
369 1 19 GLU H 1 19 GLU HB3 . . 3.860 3.586 3.553 3.613 . 0 0 "[ . 1 . 2]" 1
370 1 19 GLU H 1 19 GLU HG2 . . 3.620 2.695 2.100 3.564 . 0 0 "[ . 1 . 2]" 1
371 1 19 GLU H 1 19 GLU QG . . 3.110 2.511 2.087 3.206 0.096 17 0 "[ . 1 . 2]" 1
372 1 19 GLU H 1 19 GLU HG3 . . 3.620 3.425 2.448 3.690 0.070 9 0 "[ . 1 . 2]" 1
373 1 19 GLU H 1 20 LEU H . . 3.220 2.859 2.767 2.944 . 0 0 "[ . 1 . 2]" 1
374 1 19 GLU HA 1 19 GLU HG2 . . 3.750 2.792 2.237 3.728 . 0 0 "[ . 1 . 2]" 1
375 1 19 GLU HA 1 19 GLU QG . . 3.140 2.573 2.201 2.996 . 0 0 "[ . 1 . 2]" 1
376 1 19 GLU HA 1 19 GLU HG3 . . 3.750 3.475 2.630 3.720 . 0 0 "[ . 1 . 2]" 1
377 1 19 GLU HA 1 21 LEU H . . 4.350 4.037 3.520 4.351 0.001 7 0 "[ . 1 . 2]" 1
378 1 19 GLU HA 1 22 GLU H . . 4.320 3.666 3.387 4.298 . 0 0 "[ . 1 . 2]" 1
379 1 19 GLU HA 1 25 TRP HZ2 . . 5.330 5.038 4.681 5.245 . 0 0 "[ . 1 . 2]" 1
380 1 19 GLU HB2 1 20 LEU H . . 4.070 2.816 2.626 3.010 . 0 0 "[ . 1 . 2]" 1
381 1 19 GLU HB2 1 20 LEU MD2 . . 4.930 4.120 3.847 4.399 . 0 0 "[ . 1 . 2]" 1
382 1 19 GLU HB2 1 25 TRP HH2 . . 4.610 4.444 4.044 4.621 0.011 15 0 "[ . 1 . 2]" 1
383 1 19 GLU HB2 1 25 TRP HZ2 . . 4.390 4.231 3.937 4.395 0.005 7 0 "[ . 1 . 2]" 1
384 1 19 GLU HB3 1 20 LEU H . . 4.460 3.594 3.436 3.755 . 0 0 "[ . 1 . 2]" 1
385 1 19 GLU HB3 1 20 LEU MD2 . . 5.310 4.497 4.198 4.799 . 0 0 "[ . 1 . 2]" 1
386 1 19 GLU HB3 1 25 TRP HE1 . . 4.950 3.838 3.349 4.294 . 0 0 "[ . 1 . 2]" 1
387 1 19 GLU HB3 1 25 TRP HH2 . . 4.030 3.883 3.389 4.039 0.009 15 0 "[ . 1 . 2]" 1
388 1 19 GLU HB3 1 25 TRP HZ2 . . 3.360 2.822 2.539 3.057 . 0 0 "[ . 1 . 2]" 1
389 1 19 GLU QG 1 25 TRP HZ2 . . 4.680 4.222 3.844 4.599 . 0 0 "[ . 1 . 2]" 1
390 1 19 GLU HG2 1 25 TRP HZ2 . . 5.500 5.246 4.782 5.506 0.006 2 0 "[ . 1 . 2]" 1
391 1 19 GLU HG3 1 25 TRP HZ2 . . 5.500 4.530 3.972 5.509 0.009 19 0 "[ . 1 . 2]" 1
392 1 20 LEU H 1 20 LEU HB2 . . 3.720 2.619 2.505 2.697 . 0 0 "[ . 1 . 2]" 1
393 1 20 LEU H 1 20 LEU QB . . 3.100 2.557 2.459 2.622 . 0 0 "[ . 1 . 2]" 1
394 1 20 LEU H 1 20 LEU HB3 . . 3.720 3.582 3.575 3.586 . 0 0 "[ . 1 . 2]" 1
395 1 20 LEU H 1 20 LEU MD1 . . 4.030 3.425 3.280 3.569 . 0 0 "[ . 1 . 2]" 1
396 1 20 LEU H 1 20 LEU MD2 . . 3.980 3.234 3.057 3.419 . 0 0 "[ . 1 . 2]" 1
397 1 20 LEU H 1 20 LEU HG . . 3.180 2.008 1.891 2.198 . 0 0 "[ . 1 . 2]" 1
398 1 20 LEU H 1 21 LEU H . . 3.470 2.759 2.665 2.832 . 0 0 "[ . 1 . 2]" 1
399 1 20 LEU HA 1 20 LEU MD1 . . 4.410 3.929 3.887 3.971 . 0 0 "[ . 1 . 2]" 1
400 1 20 LEU HA 1 20 LEU MD2 . . 3.080 2.162 1.970 2.366 . 0 0 "[ . 1 . 2]" 1
401 1 20 LEU HA 1 20 LEU HG . . 4.180 3.102 2.985 3.200 . 0 0 "[ . 1 . 2]" 1
402 1 20 LEU HA 1 22 GLU H . . 4.210 3.670 3.320 3.997 . 0 0 "[ . 1 . 2]" 1
403 1 20 LEU HA 1 25 TRP HD1 . . 3.990 3.087 2.623 3.666 . 0 0 "[ . 1 . 2]" 1
404 1 20 LEU HA 1 25 TRP HE1 . . 4.130 3.811 3.452 4.129 . 0 0 "[ . 1 . 2]" 1
405 1 20 LEU HA 1 25 TRP HZ2 . . 5.270 5.124 4.693 5.275 0.005 12 0 "[ . 1 . 2]" 1
406 1 20 LEU QB 1 20 LEU MD2 . . 3.090 2.247 2.127 2.346 . 0 0 "[ . 1 . 2]" 1
407 1 20 LEU QB 1 27 ILE MD . . 3.870 2.984 2.705 3.306 . 0 0 "[ . 1 . 2]" 1
408 1 20 LEU QB 1 89 PHE QE . . 4.550 3.425 2.993 3.858 . 0 0 "[ . 1 . 2]" 1
409 1 20 LEU HB2 1 20 LEU MD1 . . 3.280 2.248 2.154 2.350 . 0 0 "[ . 1 . 2]" 1
410 1 20 LEU HB2 1 20 LEU MD2 . . 3.560 3.179 3.167 3.193 . 0 0 "[ . 1 . 2]" 1
411 1 20 LEU HB2 1 89 PHE HZ . . 4.780 3.476 2.904 4.121 . 0 0 "[ . 1 . 2]" 1
412 1 20 LEU HB3 1 20 LEU MD1 . . 3.280 2.464 2.354 2.548 . 0 0 "[ . 1 . 2]" 1
413 1 20 LEU HB3 1 20 LEU MD2 . . 3.560 2.298 2.161 2.414 . 0 0 "[ . 1 . 2]" 1
414 1 20 LEU HB3 1 89 PHE HZ . . 4.780 3.714 2.765 4.601 . 0 0 "[ . 1 . 2]" 1
415 1 20 LEU MD1 1 21 LEU H . . 5.500 4.432 4.204 4.846 . 0 0 "[ . 1 . 2]" 1
416 1 20 LEU MD1 1 25 TRP HB3 . . 5.500 4.370 4.172 4.841 . 0 0 "[ . 1 . 2]" 1
417 1 20 LEU MD1 1 73 PHE HZ . . 4.090 2.361 1.850 2.946 . 0 0 "[ . 1 . 2]" 1
418 1 20 LEU MD1 1 84 CYS HB2 . . 4.840 3.945 3.642 4.603 . 0 0 "[ . 1 . 2]" 1
419 1 20 LEU MD1 1 84 CYS HB3 . . 5.230 4.436 4.114 5.030 . 0 0 "[ . 1 . 2]" 1
420 1 20 LEU MD1 1 89 PHE QE . . 3.960 3.115 2.660 3.617 . 0 0 "[ . 1 . 2]" 1
421 1 20 LEU MD1 1 89 PHE HZ . . 4.280 3.317 2.561 4.275 . 0 0 "[ . 1 . 2]" 1
422 1 20 LEU MD1 1 119 TRP HH2 . . 4.450 3.640 2.713 4.125 . 0 0 "[ . 1 . 2]" 1
423 1 20 LEU MD1 1 119 TRP HZ2 . . 5.500 4.564 3.747 5.350 . 0 0 "[ . 1 . 2]" 1
424 1 20 LEU MD1 1 119 TRP HZ3 . . 5.260 4.729 4.324 5.254 . 0 0 "[ . 1 . 2]" 1
425 1 20 LEU MD2 1 22 GLU H . . 5.500 5.355 5.027 5.524 0.024 16 0 "[ . 1 . 2]" 1
426 1 20 LEU MD2 1 25 TRP HB2 . . 4.270 2.645 2.364 3.165 . 0 0 "[ . 1 . 2]" 1
427 1 20 LEU MD2 1 25 TRP HB3 . . 4.240 2.103 1.919 2.488 . 0 0 "[ . 1 . 2]" 1
428 1 20 LEU MD2 1 25 TRP HD1 . . 4.650 4.049 3.636 4.527 . 0 0 "[ . 1 . 2]" 1
429 1 20 LEU MD2 1 25 TRP HE1 . . 5.060 4.679 4.387 5.020 . 0 0 "[ . 1 . 2]" 1
430 1 20 LEU MD2 1 25 TRP HE3 . . 3.750 2.499 2.273 2.696 . 0 0 "[ . 1 . 2]" 1
431 1 20 LEU MD2 1 25 TRP HH2 . . 4.990 4.808 4.561 4.993 0.003 5 0 "[ . 1 . 2]" 1
432 1 20 LEU MD2 1 25 TRP HZ2 . . 5.210 4.962 4.809 5.207 . 0 0 "[ . 1 . 2]" 1
433 1 20 LEU MD2 1 25 TRP HZ3 . . 4.140 3.704 3.377 3.982 . 0 0 "[ . 1 . 2]" 1
434 1 20 LEU MD2 1 27 ILE HB . . 4.880 4.616 4.401 4.877 . 0 0 "[ . 1 . 2]" 1
435 1 20 LEU MD2 1 27 ILE MD . . 3.110 1.956 1.693 2.148 . 0 0 "[ . 1 . 2]" 1
436 1 20 LEU MD2 1 27 ILE HG12 . . 4.310 2.551 2.240 2.810 . 0 0 "[ . 1 . 2]" 1
437 1 20 LEU MD2 1 27 ILE HG13 . . 4.300 2.845 2.587 3.018 . 0 0 "[ . 1 . 2]" 1
438 1 20 LEU MD2 1 27 ILE MG . . 4.120 3.888 3.639 4.101 . 0 0 "[ . 1 . 2]" 1
439 1 20 LEU MD2 1 59 ALA MB . . 3.770 3.270 2.955 3.533 . 0 0 "[ . 1 . 2]" 1
440 1 20 LEU MD2 1 61 VAL MG2 . . 4.690 4.518 4.048 4.717 0.027 20 0 "[ . 1 . 2]" 1
441 1 20 LEU MD2 1 69 LEU MD1 . . 5.500 5.419 5.044 5.518 0.018 12 0 "[ . 1 . 2]" 1
442 1 20 LEU MD2 1 73 PHE QE . . 5.500 4.973 4.559 5.506 0.006 18 0 "[ . 1 . 2]" 1
443 1 20 LEU MD2 1 73 PHE HZ . . 5.500 4.509 4.037 5.328 . 0 0 "[ . 1 . 2]" 1
444 1 20 LEU MD2 1 84 CYS HB3 . . 5.500 3.493 3.104 3.911 . 0 0 "[ . 1 . 2]" 1
445 1 21 LEU H 1 21 LEU QB . . 3.290 2.539 2.452 2.627 . 0 0 "[ . 1 . 2]" 1
446 1 21 LEU H 1 21 LEU MD1 . . 3.890 3.490 3.359 3.717 . 0 0 "[ . 1 . 2]" 1
447 1 21 LEU H 1 21 LEU MD2 . . 4.350 3.284 3.019 3.510 . 0 0 "[ . 1 . 2]" 1
448 1 21 LEU H 1 21 LEU HG . . 3.200 2.085 1.897 2.409 . 0 0 "[ . 1 . 2]" 1
449 1 21 LEU H 1 22 GLU H . . 3.090 2.723 2.601 2.806 . 0 0 "[ . 1 . 2]" 1
450 1 21 LEU H 1 22 GLU QG . . 4.190 3.977 3.739 4.198 0.008 4 0 "[ . 1 . 2]" 1
451 1 21 LEU HA 1 21 LEU MD2 . . 3.150 2.168 1.973 2.358 . 0 0 "[ . 1 . 2]" 1
452 1 21 LEU HA 1 21 LEU HG . . 3.940 3.120 3.011 3.300 . 0 0 "[ . 1 . 2]" 1
453 1 21 LEU HA 1 87 GLY H . . 4.750 2.876 2.535 3.398 . 0 0 "[ . 1 . 2]" 1
454 1 21 LEU HA 1 87 GLY HA2 . . 3.990 2.130 1.994 2.621 . 0 0 "[ . 1 . 2]" 1
455 1 21 LEU HA 1 87 GLY QA . . 3.430 2.113 1.981 2.584 . 0 0 "[ . 1 . 2]" 1
456 1 21 LEU HA 1 87 GLY HA3 . . 3.990 3.517 3.125 3.915 . 0 0 "[ . 1 . 2]" 1
457 1 21 LEU QB 1 21 LEU MD1 . . 3.030 2.053 1.997 2.095 . 0 0 "[ . 1 . 2]" 1
458 1 21 LEU QB 1 22 GLU H . . 3.980 3.041 2.707 3.693 . 0 0 "[ . 1 . 2]" 1
459 1 21 LEU QB 1 22 GLU QG . . 4.080 3.172 2.728 3.613 . 0 0 "[ . 1 . 2]" 1
460 1 21 LEU MD1 1 22 GLU QG . . 4.740 4.541 4.187 4.756 0.016 3 0 "[ . 1 . 2]" 1
461 1 21 LEU MD1 1 119 TRP HZ2 . . 4.510 4.167 3.012 4.521 0.011 2 0 "[ . 1 . 2]" 1
462 1 21 LEU MD2 1 87 GLY HA2 . . 4.160 2.119 1.929 2.471 . 0 0 "[ . 1 . 2]" 1
463 1 21 LEU MD2 1 87 GLY QA . . 3.610 2.082 1.877 2.416 . 0 0 "[ . 1 . 2]" 1
464 1 21 LEU MD2 1 87 GLY HA3 . . 4.160 3.100 2.572 3.612 . 0 0 "[ . 1 . 2]" 1
465 1 21 LEU MD2 1 89 PHE QD . . 5.500 4.603 4.059 5.018 . 0 0 "[ . 1 . 2]" 1
466 1 21 LEU MD2 1 89 PHE QE . . 3.840 2.933 2.437 3.389 . 0 0 "[ . 1 . 2]" 1
467 1 21 LEU MD2 1 89 PHE HZ . . 4.210 3.224 2.317 4.132 . 0 0 "[ . 1 . 2]" 1
468 1 21 LEU MD2 1 119 TRP HB2 . . 5.250 4.882 4.019 5.256 0.006 4 0 "[ . 1 . 2]" 1
469 1 21 LEU MD2 1 119 TRP HB3 . . 5.250 4.887 4.086 5.259 0.009 12 0 "[ . 1 . 2]" 1
470 1 21 LEU MD2 1 119 TRP HZ2 . . 4.660 3.621 2.040 4.521 . 0 0 "[ . 1 . 2]" 1
471 1 21 LEU MD2 1 119 TRP HZ3 . . 5.500 5.433 4.949 5.515 0.015 16 0 "[ . 1 . 2]" 1
472 1 21 LEU HG 1 22 GLU H . . 4.860 4.415 4.199 4.814 . 0 0 "[ . 1 . 2]" 1
473 1 21 LEU HG 1 22 GLU QG . . 5.400 5.111 4.859 5.337 . 0 0 "[ . 1 . 2]" 1
474 1 21 LEU HG 1 89 PHE HZ . . 5.500 4.737 4.004 5.285 . 0 0 "[ . 1 . 2]" 1
475 1 21 LEU HG 1 119 TRP HZ2 . . 5.270 4.576 3.049 5.281 0.011 2 0 "[ . 1 . 2]" 1
476 1 22 GLU H 1 22 GLU HB2 . . 3.850 3.034 2.521 3.714 . 0 0 "[ . 1 . 2]" 1
477 1 22 GLU H 1 22 GLU QB . . 3.120 2.706 2.480 2.956 . 0 0 "[ . 1 . 2]" 1
478 1 22 GLU H 1 22 GLU HB3 . . 3.850 3.463 3.034 3.865 0.015 14 0 "[ . 1 . 2]" 1
479 1 22 GLU H 1 22 GLU QG . . 3.640 2.391 1.873 3.297 . 0 0 "[ . 1 . 2]" 1
480 1 22 GLU H 1 23 GLY H . . 4.530 4.447 4.215 4.536 0.006 2 0 "[ . 1 . 2]" 1
481 1 22 GLU H 1 25 TRP HD1 . . 4.740 4.298 3.685 4.615 . 0 0 "[ . 1 . 2]" 1
482 1 22 GLU H 1 25 TRP HE1 . . 4.490 4.239 3.650 4.493 0.003 6 0 "[ . 1 . 2]" 1
483 1 22 GLU HA 1 22 GLU QG . . 3.420 2.869 2.366 3.451 0.031 3 0 "[ . 1 . 2]" 1
484 1 22 GLU HA 1 23 GLY H . . 2.820 2.184 2.147 2.235 . 0 0 "[ . 1 . 2]" 1
485 1 22 GLU HA 1 23 GLY HA2 . . 4.560 4.403 4.381 4.440 . 0 0 "[ . 1 . 2]" 1
486 1 22 GLU HA 1 23 GLY HA3 . . 4.940 4.455 4.412 4.497 . 0 0 "[ . 1 . 2]" 1
487 1 22 GLU HA 1 86 ASP H . . 4.860 4.476 4.079 4.834 . 0 0 "[ . 1 . 2]" 1
488 1 22 GLU HA 1 86 ASP HA . . 3.650 3.298 2.797 3.658 0.008 14 0 "[ . 1 . 2]" 1
489 1 22 GLU QB 1 23 GLY H . . 3.570 3.039 2.833 3.243 . 0 0 "[ . 1 . 2]" 1
490 1 22 GLU QB 1 23 GLY HA2 . . 5.040 4.645 4.489 4.779 . 0 0 "[ . 1 . 2]" 1
491 1 22 GLU HB2 1 23 GLY H . . 4.260 3.688 2.907 4.265 0.005 19 0 "[ . 1 . 2]" 1
492 1 22 GLU HB3 1 23 GLY H . . 4.260 3.523 2.952 4.079 . 0 0 "[ . 1 . 2]" 1
493 1 22 GLU QG 1 23 GLY H . . 4.510 4.273 4.014 4.536 0.026 4 0 "[ . 1 . 2]" 1
494 1 23 GLY H 1 24 ASP H . . 4.700 4.578 4.491 4.639 . 0 0 "[ . 1 . 2]" 1
495 1 23 GLY H 1 86 ASP H . . 3.870 3.720 3.177 3.880 0.010 4 0 "[ . 1 . 2]" 1
496 1 23 GLY H 1 86 ASP HA . . 3.590 3.225 2.784 3.473 . 0 0 "[ . 1 . 2]" 1
497 1 23 GLY HA2 1 24 ASP H . . 3.280 2.575 2.447 2.809 . 0 0 "[ . 1 . 2]" 1
498 1 23 GLY HA2 1 25 TRP HE1 . . 5.500 5.309 5.108 5.495 . 0 0 "[ . 1 . 2]" 1
499 1 23 GLY HA3 1 24 ASP H . . 3.090 2.552 2.342 2.684 . 0 0 "[ . 1 . 2]" 1
500 1 23 GLY HA3 1 25 TRP HE1 . . 4.080 3.761 3.480 4.002 . 0 0 "[ . 1 . 2]" 1
501 1 23 GLY HA3 1 57 ASN QD . . 4.890 3.774 3.476 4.189 . 0 0 "[ . 1 . 2]" 1
502 1 24 ASP H 1 24 ASP HB2 . . 3.800 2.416 2.235 2.785 . 0 0 "[ . 1 . 2]" 1
503 1 24 ASP H 1 24 ASP QB . . 3.100 2.379 2.211 2.694 . 0 0 "[ . 1 . 2]" 1
504 1 24 ASP H 1 24 ASP HB3 . . 3.800 3.594 3.528 3.656 . 0 0 "[ . 1 . 2]" 1
505 1 24 ASP H 1 25 TRP H . . 4.830 4.589 4.489 4.616 . 0 0 "[ . 1 . 2]" 1
506 1 24 ASP H 1 25 TRP HD1 . . 4.740 4.063 3.797 4.209 . 0 0 "[ . 1 . 2]" 1
507 1 24 ASP H 1 25 TRP HE1 . . 5.490 5.086 4.714 5.374 . 0 0 "[ . 1 . 2]" 1
508 1 24 ASP H 1 57 ASN QD . . 4.390 3.661 3.222 4.072 . 0 0 "[ . 1 . 2]" 1
509 1 24 ASP HA 1 25 TRP H . . 2.760 2.222 2.153 2.261 . 0 0 "[ . 1 . 2]" 1
510 1 24 ASP HA 1 25 TRP HD1 . . 4.160 3.579 3.418 3.731 . 0 0 "[ . 1 . 2]" 1
511 1 24 ASP HA 1 84 CYS H . . 5.030 4.858 4.659 5.038 0.008 7 0 "[ . 1 . 2]" 1
512 1 24 ASP HA 1 84 CYS HB3 . . 5.080 4.510 4.157 5.085 0.005 14 0 "[ . 1 . 2]" 1
513 1 24 ASP HA 1 85 LYS HG2 . . 5.500 5.006 3.999 5.493 . 0 0 "[ . 1 . 2]" 1
514 1 24 ASP HA 1 85 LYS HG3 . . 4.860 3.874 3.098 4.860 . 0 0 "[ . 1 . 2]" 1
515 1 24 ASP HA 1 86 ASP H . . 4.580 3.613 3.283 3.955 . 0 0 "[ . 1 . 2]" 1
516 1 24 ASP QB 1 25 TRP H . . 3.530 2.888 2.754 3.163 . 0 0 "[ . 1 . 2]" 1
517 1 24 ASP QB 1 25 TRP HA . . 4.540 3.997 3.930 4.134 . 0 0 "[ . 1 . 2]" 1
518 1 24 ASP QB 1 56 VAL HA . . 3.380 2.707 2.482 3.018 . 0 0 "[ . 1 . 2]" 1
519 1 24 ASP QB 1 56 VAL HB . . 4.970 4.011 3.839 4.233 . 0 0 "[ . 1 . 2]" 1
520 1 24 ASP QB 1 57 ASN H . . 4.110 3.237 2.988 3.501 . 0 0 "[ . 1 . 2]" 1
521 1 24 ASP HB2 1 25 TRP H . . 4.220 4.038 3.746 4.164 . 0 0 "[ . 1 . 2]" 1
522 1 24 ASP HB2 1 25 TRP HA . . 5.180 4.736 4.335 4.951 . 0 0 "[ . 1 . 2]" 1
523 1 24 ASP HB2 1 56 VAL HA . . 4.020 2.788 2.523 3.144 . 0 0 "[ . 1 . 2]" 1
524 1 24 ASP HB2 1 56 VAL MG2 . . 3.430 2.305 2.014 2.599 . 0 0 "[ . 1 . 2]" 1
525 1 24 ASP HB2 1 57 ASN H . . 4.850 3.426 3.043 3.766 . 0 0 "[ . 1 . 2]" 1
526 1 24 ASP HB3 1 25 TRP H . . 4.220 2.961 2.809 3.279 . 0 0 "[ . 1 . 2]" 1
527 1 24 ASP HB3 1 25 TRP HA . . 5.180 4.326 4.124 4.684 . 0 0 "[ . 1 . 2]" 1
528 1 24 ASP HB3 1 56 VAL HA . . 4.020 3.725 3.397 4.029 0.009 14 0 "[ . 1 . 2]" 1
529 1 24 ASP HB3 1 56 VAL MG2 . . 3.430 2.108 1.958 2.364 . 0 0 "[ . 1 . 2]" 1
530 1 24 ASP HB3 1 57 ASN H . . 4.850 4.044 3.664 4.360 . 0 0 "[ . 1 . 2]" 1
531 1 25 TRP H 1 25 TRP HB2 . . 3.600 2.765 2.605 2.814 . 0 0 "[ . 1 . 2]" 1
532 1 25 TRP H 1 25 TRP HB3 . . 4.170 3.809 3.735 3.846 . 0 0 "[ . 1 . 2]" 1
533 1 25 TRP H 1 25 TRP HD1 . . 3.790 3.584 3.330 3.735 . 0 0 "[ . 1 . 2]" 1
534 1 25 TRP H 1 26 MET H . . 4.570 4.121 4.059 4.251 . 0 0 "[ . 1 . 2]" 1
535 1 25 TRP H 1 56 VAL MG2 . . 4.580 3.996 3.891 4.215 . 0 0 "[ . 1 . 2]" 1
536 1 25 TRP H 1 84 CYS H . . 3.380 3.109 2.956 3.339 . 0 0 "[ . 1 . 2]" 1
537 1 25 TRP H 1 84 CYS HB2 . . 5.010 4.576 4.293 4.869 . 0 0 "[ . 1 . 2]" 1
538 1 25 TRP H 1 84 CYS HB3 . . 4.090 3.234 2.980 3.890 . 0 0 "[ . 1 . 2]" 1
539 1 25 TRP HA 1 25 TRP HD1 . . 4.510 3.760 3.628 3.873 . 0 0 "[ . 1 . 2]" 1
540 1 25 TRP HA 1 25 TRP HE3 . . 4.510 3.593 3.458 3.784 . 0 0 "[ . 1 . 2]" 1
541 1 25 TRP HA 1 26 MET H . . 2.900 2.144 2.141 2.150 . 0 0 "[ . 1 . 2]" 1
542 1 25 TRP HA 1 56 VAL HA . . 5.210 5.163 5.061 5.226 0.016 9 0 "[ . 1 . 2]" 1
543 1 25 TRP HA 1 56 VAL MG2 . . 3.840 3.823 3.675 3.859 0.019 8 0 "[ . 1 . 2]" 1
544 1 25 TRP HA 1 57 ASN H . . 3.520 3.388 3.240 3.527 0.007 16 0 "[ . 1 . 2]" 1
545 1 25 TRP HA 1 57 ASN HA . . 5.290 4.848 4.717 5.022 . 0 0 "[ . 1 . 2]" 1
546 1 25 TRP HA 1 57 ASN HB2 . . 3.800 2.542 2.299 2.846 . 0 0 "[ . 1 . 2]" 1
547 1 25 TRP HA 1 57 ASN HB3 . . 4.560 4.088 3.824 4.400 . 0 0 "[ . 1 . 2]" 1
548 1 25 TRP HA 1 84 CYS HB3 . . 5.500 4.749 4.555 4.985 . 0 0 "[ . 1 . 2]" 1
549 1 25 TRP HB2 1 26 MET H . . 4.540 4.390 4.353 4.421 . 0 0 "[ . 1 . 2]" 1
550 1 25 TRP HB2 1 27 ILE MD . . 4.220 3.895 3.489 4.124 . 0 0 "[ . 1 . 2]" 1
551 1 25 TRP HB2 1 27 ILE HG12 . . 5.470 5.234 5.071 5.454 . 0 0 "[ . 1 . 2]" 1
552 1 25 TRP HB2 1 27 ILE HG13 . . 4.950 4.283 4.181 4.375 . 0 0 "[ . 1 . 2]" 1
553 1 25 TRP HB2 1 84 CYS H . . 3.910 3.720 3.279 3.915 0.005 9 0 "[ . 1 . 2]" 1
554 1 25 TRP HB2 1 84 CYS HB2 . . 3.640 3.508 3.294 3.645 0.005 7 0 "[ . 1 . 2]" 1
555 1 25 TRP HB2 1 84 CYS HB3 . . 3.660 2.099 1.994 2.312 . 0 0 "[ . 1 . 2]" 1
556 1 25 TRP HB3 1 25 TRP HE3 . . 3.870 2.478 2.436 2.506 . 0 0 "[ . 1 . 2]" 1
557 1 25 TRP HB3 1 26 MET H . . 3.660 3.437 3.364 3.490 . 0 0 "[ . 1 . 2]" 1
558 1 25 TRP HB3 1 27 ILE MD . . 3.900 3.495 3.161 3.773 . 0 0 "[ . 1 . 2]" 1
559 1 25 TRP HB3 1 27 ILE HG12 . . 4.570 3.919 3.780 4.088 . 0 0 "[ . 1 . 2]" 1
560 1 25 TRP HB3 1 27 ILE HG13 . . 4.580 3.236 3.091 3.346 . 0 0 "[ . 1 . 2]" 1
561 1 25 TRP HB3 1 59 ALA MB . . 4.530 4.074 3.723 4.369 . 0 0 "[ . 1 . 2]" 1
562 1 25 TRP HB3 1 84 CYS H . . 4.690 4.431 3.894 4.689 . 0 0 "[ . 1 . 2]" 1
563 1 25 TRP HB3 1 84 CYS HB2 . . 4.480 4.371 4.054 4.497 0.017 8 0 "[ . 1 . 2]" 1
564 1 25 TRP HB3 1 84 CYS HB3 . . 4.280 3.474 3.211 3.856 . 0 0 "[ . 1 . 2]" 1
565 1 25 TRP HD1 1 84 CYS HB3 . . 4.240 4.087 3.878 4.240 0.000 15 0 "[ . 1 . 2]" 1
566 1 25 TRP HE1 1 57 ASN HD21 . . 4.550 3.360 2.669 3.989 . 0 0 "[ . 1 . 2]" 1
567 1 25 TRP HE1 1 57 ASN HD22 . . 4.550 3.921 3.193 4.553 0.003 2 0 "[ . 1 . 2]" 1
568 1 25 TRP HE3 1 26 MET H . . 4.690 4.068 3.878 4.211 . 0 0 "[ . 1 . 2]" 1
569 1 25 TRP HE3 1 27 ILE MD . . 5.010 4.602 4.195 4.904 . 0 0 "[ . 1 . 2]" 1
570 1 25 TRP HE3 1 27 ILE HG13 . . 4.710 4.372 3.930 4.670 . 0 0 "[ . 1 . 2]" 1
571 1 25 TRP HE3 1 57 ASN HB2 . . 4.570 3.792 3.494 4.114 . 0 0 "[ . 1 . 2]" 1
572 1 25 TRP HE3 1 57 ASN HB3 . . 4.670 4.122 3.658 4.460 . 0 0 "[ . 1 . 2]" 1
573 1 25 TRP HE3 1 59 ALA MB . . 3.130 2.437 2.232 2.790 . 0 0 "[ . 1 . 2]" 1
574 1 25 TRP HH2 1 57 ASN HB3 . . 5.380 4.392 4.142 4.901 . 0 0 "[ . 1 . 2]" 1
575 1 25 TRP HH2 1 59 ALA MB . . 4.800 4.652 4.257 4.812 0.012 20 0 "[ . 1 . 2]" 1
576 1 25 TRP HZ2 1 57 ASN QD . . 4.700 4.030 3.441 4.598 . 0 0 "[ . 1 . 2]" 1
577 1 25 TRP HZ3 1 57 ASN HB3 . . 4.870 4.105 3.736 4.616 . 0 0 "[ . 1 . 2]" 1
578 1 25 TRP HZ3 1 59 ALA MB . . 3.190 2.615 2.240 2.784 . 0 0 "[ . 1 . 2]" 1
579 1 26 MET H 1 26 MET HB2 . . 3.590 2.308 2.278 2.351 . 0 0 "[ . 1 . 2]" 1
580 1 26 MET H 1 26 MET HB3 . . 4.110 3.557 3.526 3.599 . 0 0 "[ . 1 . 2]" 1
581 1 26 MET H 1 26 MET HG2 . . 3.850 3.186 3.025 3.323 . 0 0 "[ . 1 . 2]" 1
582 1 26 MET H 1 26 MET HG3 . . 4.620 4.170 4.047 4.283 . 0 0 "[ . 1 . 2]" 1
583 1 26 MET H 1 27 ILE H . . 4.700 4.289 4.244 4.333 . 0 0 "[ . 1 . 2]" 1
584 1 26 MET H 1 56 VAL MG1 . . 4.600 4.518 4.429 4.598 . 0 0 "[ . 1 . 2]" 1
585 1 26 MET H 1 56 VAL MG2 . . 3.720 3.669 3.587 3.723 0.003 3 0 "[ . 1 . 2]" 1
586 1 26 MET H 1 57 ASN H . . 4.380 4.237 4.052 4.387 0.007 4 0 "[ . 1 . 2]" 1
587 1 26 MET H 1 57 ASN HB2 . . 4.470 3.771 3.536 4.033 . 0 0 "[ . 1 . 2]" 1
588 1 26 MET H 1 57 ASN HB3 . . 5.210 4.765 4.439 5.123 . 0 0 "[ . 1 . 2]" 1
589 1 26 MET H 1 58 ILE HA . . 4.750 2.632 2.524 2.721 . 0 0 "[ . 1 . 2]" 1
590 1 26 MET H 1 58 ILE MD . . 4.860 4.546 4.454 4.688 . 0 0 "[ . 1 . 2]" 1
591 1 26 MET H 1 58 ILE HG12 . . 5.500 5.476 5.381 5.517 0.017 17 0 "[ . 1 . 2]" 1
592 1 26 MET H 1 59 ALA H . . 4.360 3.738 3.470 3.948 . 0 0 "[ . 1 . 2]" 1
593 1 26 MET H 1 59 ALA MB . . 4.750 4.408 4.202 4.632 . 0 0 "[ . 1 . 2]" 1
594 1 26 MET HA 1 26 MET ME . . 3.860 3.761 3.689 3.823 . 0 0 "[ . 1 . 2]" 1
595 1 26 MET HA 1 26 MET HG2 . . 3.740 2.743 2.679 2.820 . 0 0 "[ . 1 . 2]" 1
596 1 26 MET HA 1 26 MET HG3 . . 4.200 3.656 3.631 3.693 . 0 0 "[ . 1 . 2]" 1
597 1 26 MET HA 1 27 ILE H . . 2.810 2.149 2.142 2.152 . 0 0 "[ . 1 . 2]" 1
598 1 26 MET HA 1 27 ILE HB . . 5.000 4.781 4.686 4.843 . 0 0 "[ . 1 . 2]" 1
599 1 26 MET HA 1 27 ILE MD . . 5.390 4.783 4.613 4.951 . 0 0 "[ . 1 . 2]" 1
600 1 26 MET HA 1 27 ILE HG12 . . 5.360 5.242 5.125 5.355 . 0 0 "[ . 1 . 2]" 1
601 1 26 MET HA 1 27 ILE MG . . 5.500 5.487 5.465 5.496 . 0 0 "[ . 1 . 2]" 1
602 1 26 MET HA 1 44 TRP HH2 . . 4.850 4.308 4.031 4.612 . 0 0 "[ . 1 . 2]" 1
603 1 26 MET HA 1 81 ILE MG . . 4.490 3.917 3.718 4.388 . 0 0 "[ . 1 . 2]" 1
604 1 26 MET HA 1 82 TYR H . . 5.350 4.780 4.518 5.134 . 0 0 "[ . 1 . 2]" 1
605 1 26 MET HA 1 105 ILE MD . . 5.500 4.986 4.832 5.102 . 0 0 "[ . 1 . 2]" 1
606 1 26 MET HB2 1 26 MET ME . . 3.700 3.596 3.432 3.699 . 0 0 "[ . 1 . 2]" 1
607 1 26 MET HB2 1 27 ILE H . . 4.640 4.506 4.480 4.526 . 0 0 "[ . 1 . 2]" 1
608 1 26 MET HB2 1 44 TRP HH2 . . 4.490 3.952 3.659 4.234 . 0 0 "[ . 1 . 2]" 1
609 1 26 MET HB2 1 44 TRP HZ2 . . 4.520 3.591 3.289 3.887 . 0 0 "[ . 1 . 2]" 1
610 1 26 MET HB2 1 47 PHE QE . . 4.110 3.162 2.847 3.373 . 0 0 "[ . 1 . 2]" 1
611 1 26 MET HB2 1 47 PHE HZ . . 4.720 3.176 3.033 3.322 . 0 0 "[ . 1 . 2]" 1
612 1 26 MET HB2 1 56 VAL MG1 . . 4.030 3.723 3.582 3.855 . 0 0 "[ . 1 . 2]" 1
613 1 26 MET HB2 1 56 VAL MG2 . . 3.930 3.599 3.458 3.771 . 0 0 "[ . 1 . 2]" 1
614 1 26 MET HB2 1 58 ILE MD . . 3.870 3.767 3.588 3.847 . 0 0 "[ . 1 . 2]" 1
615 1 26 MET HB2 1 58 ILE HG12 . . 4.250 3.682 3.594 3.758 . 0 0 "[ . 1 . 2]" 1
616 1 26 MET HB2 1 58 ILE HG13 . . 4.630 2.212 2.123 2.271 . 0 0 "[ . 1 . 2]" 1
617 1 26 MET HB2 1 58 ILE MG . . 4.080 3.136 2.967 3.432 . 0 0 "[ . 1 . 2]" 1
618 1 26 MET HB2 1 59 ALA H . . 4.870 3.764 3.639 3.955 . 0 0 "[ . 1 . 2]" 1
619 1 26 MET HB2 1 105 ILE MD . . 4.590 4.456 4.318 4.594 0.004 5 0 "[ . 1 . 2]" 1
620 1 26 MET HB3 1 26 MET ME . . 3.060 2.533 2.377 2.734 . 0 0 "[ . 1 . 2]" 1
621 1 26 MET HB3 1 27 ILE H . . 4.130 3.691 3.614 3.721 . 0 0 "[ . 1 . 2]" 1
622 1 26 MET HB3 1 44 TRP HH2 . . 3.420 2.299 2.001 2.617 . 0 0 "[ . 1 . 2]" 1
623 1 26 MET HB3 1 44 TRP HZ2 . . 4.150 2.675 2.423 2.965 . 0 0 "[ . 1 . 2]" 1
624 1 26 MET HB3 1 47 PHE QE . . 4.130 2.518 2.268 2.716 . 0 0 "[ . 1 . 2]" 1
625 1 26 MET HB3 1 58 ILE HA . . 5.070 3.502 3.367 3.691 . 0 0 "[ . 1 . 2]" 1
626 1 26 MET HB3 1 58 ILE MD . . 4.920 4.896 4.688 4.932 0.012 18 0 "[ . 1 . 2]" 1
627 1 26 MET HB3 1 58 ILE HG12 . . 4.740 4.339 4.208 4.540 . 0 0 "[ . 1 . 2]" 1
628 1 26 MET HB3 1 58 ILE MG . . 4.670 3.195 2.951 3.444 . 0 0 "[ . 1 . 2]" 1
629 1 26 MET HB3 1 81 ILE MG . . 4.320 3.689 3.374 4.040 . 0 0 "[ . 1 . 2]" 1
630 1 26 MET ME 1 26 MET HG2 . . 3.410 3.312 3.272 3.341 . 0 0 "[ . 1 . 2]" 1
631 1 26 MET ME 1 26 MET HG3 . . 3.030 2.213 2.079 2.329 . 0 0 "[ . 1 . 2]" 1
632 1 26 MET ME 1 27 ILE H . . 4.580 4.581 4.553 4.594 0.014 9 0 "[ . 1 . 2]" 1
633 1 26 MET ME 1 44 TRP HH2 . . 3.170 2.297 2.002 2.506 . 0 0 "[ . 1 . 2]" 1
634 1 26 MET ME 1 44 TRP HZ3 . . 3.580 3.069 2.683 3.427 . 0 0 "[ . 1 . 2]" 1
635 1 26 MET ME 1 47 PHE QE . . 3.260 2.431 2.166 2.737 . 0 0 "[ . 1 . 2]" 1
636 1 26 MET ME 1 47 PHE HZ . . 3.420 3.050 2.772 3.274 . 0 0 "[ . 1 . 2]" 1
637 1 26 MET ME 1 58 ILE MD . . 5.450 5.208 5.027 5.351 . 0 0 "[ . 1 . 2]" 1
638 1 26 MET ME 1 58 ILE HG12 . . 4.920 4.851 4.674 4.930 0.010 10 0 "[ . 1 . 2]" 1
639 1 26 MET ME 1 58 ILE MG . . 4.960 4.337 4.009 4.600 . 0 0 "[ . 1 . 2]" 1
640 1 26 MET ME 1 81 ILE MD . . 3.750 3.307 2.680 3.700 . 0 0 "[ . 1 . 2]" 1
641 1 26 MET ME 1 81 ILE HG12 . . 4.560 4.183 3.931 4.513 . 0 0 "[ . 1 . 2]" 1
642 1 26 MET ME 1 81 ILE MG . . 2.780 2.007 1.914 2.301 . 0 0 "[ . 1 . 2]" 1
643 1 26 MET ME 1 82 TYR H . . 5.060 4.901 4.533 5.064 0.004 4 0 "[ . 1 . 2]" 1
644 1 26 MET ME 1 83 HIS HA . . 4.960 4.530 4.300 4.823 . 0 0 "[ . 1 . 2]" 1
645 1 26 MET ME 1 83 HIS HB2 . . 4.430 3.915 3.703 4.315 . 0 0 "[ . 1 . 2]" 1
646 1 26 MET ME 1 83 HIS HD2 . . 4.510 3.964 3.589 4.477 . 0 0 "[ . 1 . 2]" 1
647 1 26 MET ME 1 92 TYR HA . . 5.500 5.208 4.481 5.497 . 0 0 "[ . 1 . 2]" 1
648 1 26 MET ME 1 92 TYR QB . . 5.260 3.731 3.334 4.150 . 0 0 "[ . 1 . 2]" 1
649 1 26 MET ME 1 92 TYR QD . . 4.010 3.025 2.532 3.754 . 0 0 "[ . 1 . 2]" 1
650 1 26 MET ME 1 92 TYR QE . . 4.480 3.126 2.336 4.287 . 0 0 "[ . 1 . 2]" 1
651 1 26 MET ME 1 101 PHE HA . . 3.940 3.849 3.478 3.961 0.021 9 0 "[ . 1 . 2]" 1
652 1 26 MET ME 1 101 PHE HB3 . . 4.230 3.809 3.506 4.065 . 0 0 "[ . 1 . 2]" 1
653 1 26 MET ME 1 101 PHE QD . . 3.310 2.746 2.367 3.303 . 0 0 "[ . 1 . 2]" 1
654 1 26 MET ME 1 101 PHE QE . . 3.910 3.108 2.587 3.920 0.010 10 0 "[ . 1 . 2]" 1
655 1 26 MET ME 1 104 PHE HB3 . . 4.800 3.817 3.431 4.148 . 0 0 "[ . 1 . 2]" 1
656 1 26 MET ME 1 104 PHE QD . . 3.170 2.377 2.041 2.725 . 0 0 "[ . 1 . 2]" 1
657 1 26 MET ME 1 104 PHE QE . . 4.170 2.886 2.428 3.278 . 0 0 "[ . 1 . 2]" 1
658 1 26 MET ME 1 105 ILE HA . . 5.500 5.457 5.184 5.511 0.011 14 0 "[ . 1 . 2]" 1
659 1 26 MET ME 1 105 ILE MD . . 3.210 2.781 2.523 2.937 . 0 0 "[ . 1 . 2]" 1
660 1 26 MET HG2 1 27 ILE H . . 5.020 4.866 4.798 4.945 . 0 0 "[ . 1 . 2]" 1
661 1 26 MET HG2 1 47 PHE QE . . 4.500 4.334 3.989 4.502 0.002 1 0 "[ . 1 . 2]" 1
662 1 26 MET HG2 1 47 PHE HZ . . 4.130 3.595 3.405 3.864 . 0 0 "[ . 1 . 2]" 1
663 1 26 MET HG2 1 56 VAL MG1 . . 3.820 3.688 3.455 3.834 0.014 9 0 "[ . 1 . 2]" 1
664 1 26 MET HG2 1 56 VAL MG2 . . 3.530 2.566 2.414 2.740 . 0 0 "[ . 1 . 2]" 1
665 1 26 MET HG2 1 83 HIS HD2 . . 3.810 2.640 2.246 3.147 . 0 0 "[ . 1 . 2]" 1
666 1 26 MET HG2 1 105 ILE MD . . 3.480 2.870 2.676 3.043 . 0 0 "[ . 1 . 2]" 1
667 1 26 MET HG3 1 44 TRP HH2 . . 4.920 3.997 3.660 4.319 . 0 0 "[ . 1 . 2]" 1
668 1 26 MET HG3 1 47 PHE QE . . 4.100 2.924 2.546 3.149 . 0 0 "[ . 1 . 2]" 1
669 1 26 MET HG3 1 47 PHE HZ . . 3.690 2.090 1.989 2.338 . 0 0 "[ . 1 . 2]" 1
670 1 26 MET HG3 1 56 VAL MG1 . . 3.660 3.399 3.211 3.588 . 0 0 "[ . 1 . 2]" 1
671 1 26 MET HG3 1 56 VAL MG2 . . 4.070 3.214 3.071 3.360 . 0 0 "[ . 1 . 2]" 1
672 1 26 MET HG3 1 58 ILE MD . . 4.500 4.345 4.146 4.480 . 0 0 "[ . 1 . 2]" 1
673 1 26 MET HG3 1 83 HIS HD2 . . 4.350 3.877 3.598 4.357 0.007 18 0 "[ . 1 . 2]" 1
674 1 26 MET HG3 1 105 ILE MD . . 3.460 2.510 2.355 2.637 . 0 0 "[ . 1 . 2]" 1
675 1 27 ILE H 1 27 ILE HB . . 3.560 2.668 2.590 2.746 . 0 0 "[ . 1 . 2]" 1
676 1 27 ILE H 1 27 ILE MD . . 4.120 3.546 3.386 3.682 . 0 0 "[ . 1 . 2]" 1
677 1 27 ILE H 1 27 ILE HG12 . . 3.940 3.832 3.701 3.919 . 0 0 "[ . 1 . 2]" 1
678 1 27 ILE H 1 27 ILE HG13 . . 3.950 2.426 2.351 2.566 . 0 0 "[ . 1 . 2]" 1
679 1 27 ILE H 1 27 ILE MG . . 3.950 3.853 3.827 3.881 . 0 0 "[ . 1 . 2]" 1
680 1 27 ILE H 1 44 TRP HH2 . . 4.820 4.507 4.197 4.789 . 0 0 "[ . 1 . 2]" 1
681 1 27 ILE H 1 44 TRP HZ2 . . 4.720 4.455 4.200 4.621 . 0 0 "[ . 1 . 2]" 1
682 1 27 ILE H 1 81 ILE HA . . 4.940 4.851 4.724 4.948 0.008 7 0 "[ . 1 . 2]" 1
683 1 27 ILE H 1 81 ILE MG . . 4.270 3.382 3.203 4.019 . 0 0 "[ . 1 . 2]" 1
684 1 27 ILE H 1 82 TYR H . . 3.670 3.163 3.016 3.464 . 0 0 "[ . 1 . 2]" 1
685 1 27 ILE H 1 82 TYR HB2 . . 4.490 4.163 3.836 4.471 . 0 0 "[ . 1 . 2]" 1
686 1 27 ILE HA 1 27 ILE MD . . 4.510 3.930 3.894 3.960 . 0 0 "[ . 1 . 2]" 1
687 1 27 ILE HA 1 27 ILE HG12 . . 4.220 2.801 2.699 2.916 . 0 0 "[ . 1 . 2]" 1
688 1 27 ILE HA 1 27 ILE MG . . 3.630 2.323 2.229 2.407 . 0 0 "[ . 1 . 2]" 1
689 1 27 ILE HA 1 28 GLU H . . 3.180 2.280 2.224 2.323 . 0 0 "[ . 1 . 2]" 1
690 1 27 ILE HA 1 44 TRP HE1 . . 4.900 4.809 4.548 4.916 0.016 16 0 "[ . 1 . 2]" 1
691 1 27 ILE HA 1 44 TRP HZ2 . . 3.630 3.489 3.252 3.628 . 0 0 "[ . 1 . 2]" 1
692 1 27 ILE HA 1 59 ALA H . . 3.610 3.207 3.011 3.314 . 0 0 "[ . 1 . 2]" 1
693 1 27 ILE HA 1 59 ALA MB . . 3.870 3.371 3.116 3.521 . 0 0 "[ . 1 . 2]" 1
694 1 27 ILE HA 1 60 LYS HA . . 4.570 3.760 3.608 3.926 . 0 0 "[ . 1 . 2]" 1
695 1 27 ILE HB 1 27 ILE MD . . 3.080 2.205 2.099 2.320 . 0 0 "[ . 1 . 2]" 1
696 1 27 ILE HB 1 28 GLU H . . 4.290 3.717 3.631 3.900 . 0 0 "[ . 1 . 2]" 1
697 1 27 ILE HB 1 29 PHE QD . . 5.290 4.371 4.071 4.641 . 0 0 "[ . 1 . 2]" 1
698 1 27 ILE HB 1 29 PHE QE . . 3.950 3.578 3.248 3.938 . 0 0 "[ . 1 . 2]" 1
699 1 27 ILE HB 1 82 TYR H . . 4.270 3.045 2.820 3.274 . 0 0 "[ . 1 . 2]" 1
700 1 27 ILE HB 1 82 TYR HB2 . . 4.240 2.675 2.259 3.046 . 0 0 "[ . 1 . 2]" 1
701 1 27 ILE HB 1 82 TYR HB3 . . 4.690 3.737 3.442 4.028 . 0 0 "[ . 1 . 2]" 1
702 1 27 ILE HB 1 82 TYR QD . . 5.500 4.344 3.794 4.654 . 0 0 "[ . 1 . 2]" 1
703 1 27 ILE MD 1 27 ILE MG . . 3.050 2.290 2.088 2.479 . 0 0 "[ . 1 . 2]" 1
704 1 27 ILE MD 1 29 PHE QE . . 3.860 3.649 3.116 3.881 0.021 8 0 "[ . 1 . 2]" 1
705 1 27 ILE MD 1 29 PHE HZ . . 4.540 4.324 3.890 4.542 0.002 1 0 "[ . 1 . 2]" 1
706 1 27 ILE MD 1 59 ALA MB . . 4.370 4.181 3.949 4.355 . 0 0 "[ . 1 . 2]" 1
707 1 27 ILE MD 1 73 PHE QE . . 4.800 3.054 2.383 3.796 . 0 0 "[ . 1 . 2]" 1
708 1 27 ILE MD 1 73 PHE HZ . . 5.060 2.971 2.279 3.993 . 0 0 "[ . 1 . 2]" 1
709 1 27 ILE MD 1 82 TYR HA . . 5.500 5.363 5.153 5.506 0.006 11 0 "[ . 1 . 2]" 1
710 1 27 ILE MD 1 82 TYR HB2 . . 4.080 3.253 2.890 3.487 . 0 0 "[ . 1 . 2]" 1
711 1 27 ILE MD 1 82 TYR HB3 . . 4.320 3.409 3.053 3.611 . 0 0 "[ . 1 . 2]" 1
712 1 27 ILE MD 1 83 HIS HA . . 5.500 4.967 4.665 5.171 . 0 0 "[ . 1 . 2]" 1
713 1 27 ILE MD 1 84 CYS HB2 . . 4.330 2.869 2.540 3.122 . 0 0 "[ . 1 . 2]" 1
714 1 27 ILE MD 1 84 CYS HB3 . . 4.230 3.631 3.312 4.025 . 0 0 "[ . 1 . 2]" 1
715 1 27 ILE MD 1 89 PHE QD . . 4.690 3.926 3.500 4.415 . 0 0 "[ . 1 . 2]" 1
716 1 27 ILE MD 1 89 PHE QE . . 3.810 2.750 2.036 3.660 . 0 0 "[ . 1 . 2]" 1
717 1 27 ILE HG12 1 27 ILE MG . . 3.730 2.235 2.098 2.309 . 0 0 "[ . 1 . 2]" 1
718 1 27 ILE HG12 1 28 GLU H . . 4.480 4.404 4.259 4.511 0.031 18 0 "[ . 1 . 2]" 1
719 1 27 ILE HG12 1 59 ALA H . . 4.870 4.611 4.389 4.873 0.003 4 0 "[ . 1 . 2]" 1
720 1 27 ILE HG12 1 60 LYS HA . . 5.500 5.420 5.267 5.505 0.005 1 0 "[ . 1 . 2]" 1
721 1 27 ILE HG12 1 61 VAL MG2 . . 4.020 3.673 3.429 3.930 . 0 0 "[ . 1 . 2]" 1
722 1 27 ILE HG13 1 27 ILE MG . . 3.400 3.170 3.136 3.193 . 0 0 "[ . 1 . 2]" 1
723 1 27 ILE HG13 1 28 GLU H . . 5.010 4.860 4.808 4.948 . 0 0 "[ . 1 . 2]" 1
724 1 27 ILE HG13 1 59 ALA H . . 5.070 4.671 4.412 5.041 . 0 0 "[ . 1 . 2]" 1
725 1 27 ILE HG13 1 59 ALA MB . . 4.660 3.951 3.755 4.245 . 0 0 "[ . 1 . 2]" 1
726 1 27 ILE MG 1 28 GLU H . . 3.760 2.005 1.876 2.254 . 0 0 "[ . 1 . 2]" 1
727 1 27 ILE MG 1 29 PHE H . . 4.880 3.663 3.471 3.880 . 0 0 "[ . 1 . 2]" 1
728 1 27 ILE MG 1 29 PHE QD . . 4.070 3.282 2.856 3.584 . 0 0 "[ . 1 . 2]" 1
729 1 27 ILE MG 1 29 PHE QE . . 3.630 2.896 2.486 3.231 . 0 0 "[ . 1 . 2]" 1
730 1 27 ILE MG 1 29 PHE HZ . . 4.380 3.672 3.281 3.910 . 0 0 "[ . 1 . 2]" 1
731 1 27 ILE MG 1 59 ALA H . . 5.000 4.692 4.424 4.945 . 0 0 "[ . 1 . 2]" 1
732 1 27 ILE MG 1 59 ALA MB . . 3.520 3.297 3.028 3.496 . 0 0 "[ . 1 . 2]" 1
733 1 27 ILE MG 1 60 LYS HA . . 4.080 3.316 3.157 3.539 . 0 0 "[ . 1 . 2]" 1
734 1 27 ILE MG 1 61 VAL H . . 4.350 3.255 2.981 3.594 . 0 0 "[ . 1 . 2]" 1
735 1 27 ILE MG 1 61 VAL HB . . 4.140 2.979 2.608 3.251 . 0 0 "[ . 1 . 2]" 1
736 1 27 ILE MG 1 61 VAL MG2 . . 3.140 1.866 1.760 2.078 . 0 0 "[ . 1 . 2]" 1
737 1 27 ILE MG 1 82 TYR H . . 4.330 4.008 3.706 4.279 . 0 0 "[ . 1 . 2]" 1
738 1 27 ILE MG 1 82 TYR HB2 . . 4.100 3.758 3.379 4.058 . 0 0 "[ . 1 . 2]" 1
739 1 27 ILE MG 1 82 TYR HB3 . . 5.100 4.868 4.514 5.103 0.003 2 0 "[ . 1 . 2]" 1
740 1 28 GLU H 1 28 GLU HG2 . . 3.980 3.410 2.751 3.846 . 0 0 "[ . 1 . 2]" 1
741 1 28 GLU H 1 28 GLU HG3 . . 3.980 2.384 2.188 2.554 . 0 0 "[ . 1 . 2]" 1
742 1 28 GLU H 1 29 PHE H . . 4.990 3.947 3.869 4.116 . 0 0 "[ . 1 . 2]" 1
743 1 28 GLU H 1 59 ALA H . . 5.500 4.812 4.548 5.001 . 0 0 "[ . 1 . 2]" 1
744 1 28 GLU H 1 59 ALA MB . . 4.870 4.520 4.243 4.693 . 0 0 "[ . 1 . 2]" 1
745 1 28 GLU H 1 60 LYS HA . . 3.590 2.604 2.374 2.837 . 0 0 "[ . 1 . 2]" 1
746 1 28 GLU H 1 61 VAL H . . 4.240 3.252 2.960 3.424 . 0 0 "[ . 1 . 2]" 1
747 1 28 GLU QB 1 29 PHE H . . 3.800 3.507 3.382 3.553 . 0 0 "[ . 1 . 2]" 1
748 1 28 GLU QB 1 44 TRP HZ2 . . 4.530 3.422 3.082 3.599 . 0 0 "[ . 1 . 2]" 1
749 1 28 GLU QB 1 81 ILE MD . . 4.130 3.242 2.953 3.817 . 0 0 "[ . 1 . 2]" 1
750 1 28 GLU QB 1 81 ILE HG12 . . 4.030 2.093 1.936 2.628 . 0 0 "[ . 1 . 2]" 1
751 1 28 GLU QB 1 81 ILE HG13 . . 4.110 3.010 2.617 3.570 . 0 0 "[ . 1 . 2]" 1
752 1 28 GLU QB 1 81 ILE MG . . 4.420 3.114 2.655 3.488 . 0 0 "[ . 1 . 2]" 1
753 1 28 GLU HB2 1 29 PHE H . . 4.410 3.689 3.549 3.763 . 0 0 "[ . 1 . 2]" 1
754 1 28 GLU HB2 1 81 ILE HG13 . . 4.700 3.327 2.777 4.082 . 0 0 "[ . 1 . 2]" 1
755 1 28 GLU HB3 1 29 PHE H . . 4.410 4.386 4.257 4.472 0.062 3 0 "[ . 1 . 2]" 1
756 1 28 GLU HB3 1 81 ILE HG13 . . 4.700 3.485 2.999 4.363 . 0 0 "[ . 1 . 2]" 1
757 1 28 GLU QG 1 30 TYR HB3 . . 4.940 4.438 4.303 4.671 . 0 0 "[ . 1 . 2]" 1
758 1 28 GLU QG 1 30 TYR QD . . 4.540 3.762 3.447 4.146 . 0 0 "[ . 1 . 2]" 1
759 1 28 GLU QG 1 44 TRP HD1 . . 4.770 3.654 3.299 4.022 . 0 0 "[ . 1 . 2]" 1
760 1 28 GLU QG 1 44 TRP HE1 . . 3.780 2.757 2.427 2.992 . 0 0 "[ . 1 . 2]" 1
761 1 28 GLU QG 1 60 LYS HA . . 3.760 2.292 2.005 2.624 . 0 0 "[ . 1 . 2]" 1
762 1 28 GLU QG 1 61 VAL H . . 5.170 3.404 3.048 3.843 . 0 0 "[ . 1 . 2]" 1
763 1 28 GLU HG2 1 44 TRP HE1 . . 4.460 2.907 2.467 3.253 . 0 0 "[ . 1 . 2]" 1
764 1 28 GLU HG2 1 60 LYS HA . . 4.290 3.622 2.947 4.218 . 0 0 "[ . 1 . 2]" 1
765 1 28 GLU HG3 1 44 TRP HE1 . . 4.460 3.573 3.259 3.949 . 0 0 "[ . 1 . 2]" 1
766 1 28 GLU HG3 1 60 LYS HA . . 4.290 2.321 2.037 2.650 . 0 0 "[ . 1 . 2]" 1
767 1 29 PHE H 1 29 PHE HB2 . . 3.480 2.354 2.301 2.434 . 0 0 "[ . 1 . 2]" 1
768 1 29 PHE H 1 29 PHE HB3 . . 3.910 3.582 3.563 3.613 . 0 0 "[ . 1 . 2]" 1
769 1 29 PHE H 1 29 PHE QD . . 3.420 2.151 1.907 2.530 . 0 0 "[ . 1 . 2]" 1
770 1 29 PHE H 1 29 PHE QE . . 4.940 4.365 4.128 4.609 . 0 0 "[ . 1 . 2]" 1
771 1 29 PHE H 1 75 ILE MG . . 5.500 4.983 4.328 5.495 . 0 0 "[ . 1 . 2]" 1
772 1 29 PHE H 1 78 LEU MD2 . . 4.590 3.972 3.818 4.214 . 0 0 "[ . 1 . 2]" 1
773 1 29 PHE H 1 80 THR H . . 3.640 3.121 2.908 3.333 . 0 0 "[ . 1 . 2]" 1
774 1 29 PHE H 1 80 THR HB . . 4.450 3.724 2.418 4.125 . 0 0 "[ . 1 . 2]" 1
775 1 29 PHE H 1 80 THR MG . . 4.380 3.970 3.567 4.282 . 0 0 "[ . 1 . 2]" 1
776 1 29 PHE H 1 81 ILE HA . . 4.330 3.258 2.965 3.615 . 0 0 "[ . 1 . 2]" 1
777 1 29 PHE H 1 81 ILE HG12 . . 5.220 4.738 4.056 5.214 . 0 0 "[ . 1 . 2]" 1
778 1 29 PHE H 1 81 ILE MG . . 5.500 5.030 4.680 5.310 . 0 0 "[ . 1 . 2]" 1
779 1 29 PHE HA 1 29 PHE QD . . 3.910 3.065 2.840 3.145 . 0 0 "[ . 1 . 2]" 1
780 1 29 PHE HA 1 30 TYR H . . 2.890 2.144 2.139 2.155 . 0 0 "[ . 1 . 2]" 1
781 1 29 PHE HA 1 30 TYR QD . . 4.310 4.188 4.020 4.309 . 0 0 "[ . 1 . 2]" 1
782 1 29 PHE HA 1 61 VAL H . . 3.600 3.313 3.028 3.539 . 0 0 "[ . 1 . 2]" 1
783 1 29 PHE HA 1 61 VAL HB . . 3.530 2.849 2.479 3.060 . 0 0 "[ . 1 . 2]" 1
784 1 29 PHE HA 1 61 VAL MG1 . . 4.250 3.633 3.275 4.096 . 0 0 "[ . 1 . 2]" 1
785 1 29 PHE HA 1 61 VAL MG2 . . 4.610 4.329 3.982 4.556 . 0 0 "[ . 1 . 2]" 1
786 1 29 PHE HA 1 63 VAL H . . 5.200 4.994 4.416 5.193 . 0 0 "[ . 1 . 2]" 1
787 1 29 PHE HA 1 63 VAL MG1 . . 3.880 3.588 3.361 3.814 . 0 0 "[ . 1 . 2]" 1
788 1 29 PHE HA 1 80 THR H . . 5.500 4.810 4.584 5.167 . 0 0 "[ . 1 . 2]" 1
789 1 29 PHE HB2 1 30 TYR H . . 5.030 4.407 4.279 4.464 . 0 0 "[ . 1 . 2]" 1
790 1 29 PHE HB2 1 63 VAL MG1 . . 4.160 4.008 3.620 4.166 0.006 7 0 "[ . 1 . 2]" 1
791 1 29 PHE HB2 1 75 ILE MD . . 4.420 3.195 2.591 3.798 . 0 0 "[ . 1 . 2]" 1
792 1 29 PHE HB2 1 75 ILE MG . . 3.980 3.023 2.395 3.484 . 0 0 "[ . 1 . 2]" 1
793 1 29 PHE HB2 1 78 LEU MD2 . . 4.360 2.277 2.065 2.607 . 0 0 "[ . 1 . 2]" 1
794 1 29 PHE HB2 1 80 THR H . . 3.710 3.024 2.831 3.279 . 0 0 "[ . 1 . 2]" 1
795 1 29 PHE HB2 1 80 THR HB . . 3.490 2.410 2.000 2.655 . 0 0 "[ . 1 . 2]" 1
796 1 29 PHE HB2 1 80 THR MG . . 4.000 3.547 3.256 3.745 . 0 0 "[ . 1 . 2]" 1
797 1 29 PHE HB3 1 30 TYR H . . 4.160 3.576 3.280 3.706 . 0 0 "[ . 1 . 2]" 1
798 1 29 PHE HB3 1 63 VAL MG1 . . 3.290 2.594 2.281 2.734 . 0 0 "[ . 1 . 2]" 1
799 1 29 PHE HB3 1 75 ILE MD . . 4.420 3.807 3.180 4.377 . 0 0 "[ . 1 . 2]" 1
800 1 29 PHE HB3 1 75 ILE MG . . 3.760 3.023 2.718 3.422 . 0 0 "[ . 1 . 2]" 1
801 1 29 PHE HB3 1 78 LEU MD2 . . 3.970 1.914 1.838 2.588 . 0 0 "[ . 1 . 2]" 1
802 1 29 PHE HB3 1 80 THR H . . 4.490 4.287 4.024 4.519 0.029 18 0 "[ . 1 . 2]" 1
803 1 29 PHE HB3 1 80 THR HB . . 3.970 3.856 3.574 3.983 0.013 17 0 "[ . 1 . 2]" 1
804 1 29 PHE QD 1 61 VAL HB . . 3.880 3.480 3.191 3.742 . 0 0 "[ . 1 . 2]" 1
805 1 29 PHE QD 1 61 VAL MG1 . . 3.580 2.769 2.192 3.239 . 0 0 "[ . 1 . 2]" 1
806 1 29 PHE QD 1 61 VAL MG2 . . 4.350 4.182 3.789 4.359 0.009 10 0 "[ . 1 . 2]" 1
807 1 29 PHE QD 1 63 VAL MG1 . . 3.060 2.156 1.902 2.401 . 0 0 "[ . 1 . 2]" 1
808 1 29 PHE QD 1 70 SER HA . . 4.850 3.620 2.956 4.177 . 0 0 "[ . 1 . 2]" 1
809 1 29 PHE QD 1 73 PHE QD . . 5.500 5.086 4.737 5.496 . 0 0 "[ . 1 . 2]" 1
810 1 29 PHE QD 1 75 ILE MD . . 4.030 2.804 2.467 3.209 . 0 0 "[ . 1 . 2]" 1
811 1 29 PHE QD 1 75 ILE QG . . 4.090 2.724 2.267 3.030 . 0 0 "[ . 1 . 2]" 1
812 1 29 PHE QD 1 75 ILE MG . . 3.990 3.434 3.085 3.780 . 0 0 "[ . 1 . 2]" 1
813 1 29 PHE QD 1 80 THR H . . 4.630 4.425 4.142 4.631 0.001 13 0 "[ . 1 . 2]" 1
814 1 29 PHE QD 1 80 THR HB . . 4.090 3.476 2.155 3.919 . 0 0 "[ . 1 . 2]" 1
815 1 29 PHE QD 1 81 ILE HA . . 4.650 3.850 3.594 4.144 . 0 0 "[ . 1 . 2]" 1
816 1 29 PHE QE 1 61 VAL HB . . 4.480 3.775 3.541 4.081 . 0 0 "[ . 1 . 2]" 1
817 1 29 PHE QE 1 61 VAL MG1 . . 3.650 2.451 2.139 2.828 . 0 0 "[ . 1 . 2]" 1
818 1 29 PHE QE 1 61 VAL MG2 . . 3.840 3.541 3.202 3.759 . 0 0 "[ . 1 . 2]" 1
819 1 29 PHE QE 1 63 VAL MG1 . . 4.990 3.690 3.312 4.005 . 0 0 "[ . 1 . 2]" 1
820 1 29 PHE QE 1 69 LEU HB2 . . 4.650 3.912 3.622 4.426 . 0 0 "[ . 1 . 2]" 1
821 1 29 PHE QE 1 69 LEU QB . . 3.800 2.737 2.152 3.164 . 0 0 "[ . 1 . 2]" 1
822 1 29 PHE QE 1 69 LEU HB3 . . 4.650 2.801 2.168 3.286 . 0 0 "[ . 1 . 2]" 1
823 1 29 PHE QE 1 69 LEU MD1 . . 4.540 4.191 3.703 4.543 0.003 8 0 "[ . 1 . 2]" 1
824 1 29 PHE QE 1 69 LEU MD2 . . 5.200 4.120 3.463 4.667 . 0 0 "[ . 1 . 2]" 1
825 1 29 PHE QE 1 70 SER HA . . 4.600 2.708 2.024 3.447 . 0 0 "[ . 1 . 2]" 1
826 1 29 PHE QE 1 73 PHE QB . . 4.800 3.040 2.734 3.330 . 0 0 "[ . 1 . 2]" 1
827 1 29 PHE QE 1 73 PHE QD . . 3.690 3.286 2.902 3.700 0.010 18 0 "[ . 1 . 2]" 1
828 1 29 PHE QE 1 82 TYR H . . 4.890 4.659 4.047 4.892 0.002 17 0 "[ . 1 . 2]" 1
829 1 29 PHE QE 1 82 TYR HB2 . . 4.010 3.000 2.702 3.244 . 0 0 "[ . 1 . 2]" 1
830 1 29 PHE QE 1 82 TYR HB3 . . 4.700 4.341 4.092 4.551 . 0 0 "[ . 1 . 2]" 1
831 1 29 PHE QE 1 82 TYR QD . . 3.430 2.554 1.994 3.362 . 0 0 "[ . 1 . 2]" 1
832 1 29 PHE HZ 1 61 VAL MG1 . . 5.460 3.684 3.355 4.032 . 0 0 "[ . 1 . 2]" 1
833 1 29 PHE HZ 1 61 VAL MG2 . . 4.680 3.677 3.157 3.965 . 0 0 "[ . 1 . 2]" 1
834 1 29 PHE HZ 1 69 LEU MD2 . . 4.770 3.761 3.037 4.506 . 0 0 "[ . 1 . 2]" 1
835 1 29 PHE HZ 1 73 PHE QD . . 4.410 2.743 2.195 3.250 . 0 0 "[ . 1 . 2]" 1
836 1 29 PHE HZ 1 73 PHE QE . . 4.670 3.707 3.309 4.623 . 0 0 "[ . 1 . 2]" 1
837 1 30 TYR H 1 30 TYR HB3 . . 4.050 2.892 2.814 3.014 . 0 0 "[ . 1 . 2]" 1
838 1 30 TYR H 1 30 TYR QD . . 3.160 2.856 2.750 2.962 . 0 0 "[ . 1 . 2]" 1
839 1 30 TYR H 1 30 TYR QE . . 4.430 4.440 4.394 4.467 0.037 6 0 "[ . 1 . 2]" 1
840 1 30 TYR H 1 31 ALA H . . 4.960 4.463 4.443 4.490 . 0 0 "[ . 1 . 2]" 1
841 1 30 TYR H 1 61 VAL H . . 4.500 3.876 3.678 4.085 . 0 0 "[ . 1 . 2]" 1
842 1 30 TYR H 1 61 VAL HB . . 4.800 4.300 3.995 4.560 . 0 0 "[ . 1 . 2]" 1
843 1 30 TYR H 1 61 VAL MG1 . . 5.190 4.419 4.163 4.907 . 0 0 "[ . 1 . 2]" 1
844 1 30 TYR H 1 62 ASP HA . . 4.550 3.791 3.500 4.131 . 0 0 "[ . 1 . 2]" 1
845 1 30 TYR H 1 63 VAL H . . 4.190 4.077 3.797 4.214 0.024 12 0 "[ . 1 . 2]" 1
846 1 30 TYR H 1 63 VAL MG1 . . 3.720 3.517 3.299 3.724 0.004 19 0 "[ . 1 . 2]" 1
847 1 30 TYR H 1 63 VAL MG2 . . 4.390 4.298 4.097 4.403 0.013 18 0 "[ . 1 . 2]" 1
848 1 30 TYR H 1 78 LEU MD2 . . 4.570 3.768 3.418 3.954 . 0 0 "[ . 1 . 2]" 1
849 1 30 TYR HA 1 30 TYR QD . . 3.790 3.667 3.652 3.683 . 0 0 "[ . 1 . 2]" 1
850 1 30 TYR HA 1 31 ALA H . . 3.210 2.480 2.381 2.563 . 0 0 "[ . 1 . 2]" 1
851 1 30 TYR HA 1 63 VAL MG1 . . 4.670 4.497 4.070 4.651 . 0 0 "[ . 1 . 2]" 1
852 1 30 TYR HA 1 78 LEU MD1 . . 4.780 4.163 3.818 4.620 . 0 0 "[ . 1 . 2]" 1
853 1 30 TYR HA 1 78 LEU MD2 . . 3.460 3.142 2.827 3.246 . 0 0 "[ . 1 . 2]" 1
854 1 30 TYR HA 1 79 PRO HA . . 4.160 3.319 2.841 3.910 . 0 0 "[ . 1 . 2]" 1
855 1 30 TYR HA 1 80 THR H . . 5.500 4.426 4.124 4.737 . 0 0 "[ . 1 . 2]" 1
856 1 30 TYR HB2 1 31 ALA H . . 3.420 2.407 2.267 2.592 . 0 0 "[ . 1 . 2]" 1
857 1 30 TYR HB2 1 37 CYS QB . . 3.640 2.242 1.987 2.645 . 0 0 "[ . 1 . 2]" 1
858 1 30 TYR HB3 1 31 ALA H . . 4.160 3.829 3.732 3.951 . 0 0 "[ . 1 . 2]" 1
859 1 30 TYR HB3 1 37 CYS QB . . 4.020 3.688 3.357 4.028 0.008 18 0 "[ . 1 . 2]" 1
860 1 30 TYR HB3 1 78 LEU MD2 . . 5.060 5.009 4.700 5.076 0.016 12 0 "[ . 1 . 2]" 1
861 1 30 TYR QD 1 31 ALA H . . 3.870 2.423 2.222 2.735 . 0 0 "[ . 1 . 2]" 1
862 1 30 TYR QD 1 31 ALA HA . . 4.650 2.993 2.840 3.154 . 0 0 "[ . 1 . 2]" 1
863 1 30 TYR QD 1 32 PRO HA . . 4.010 3.931 3.810 4.017 0.007 7 0 "[ . 1 . 2]" 1
864 1 30 TYR QD 1 32 PRO QD . . 4.740 3.431 3.303 3.539 . 0 0 "[ . 1 . 2]" 1
865 1 30 TYR QD 1 37 CYS QB . . 3.820 3.448 3.173 3.780 . 0 0 "[ . 1 . 2]" 1
866 1 30 TYR QD 1 60 LYS HA . . 4.800 4.198 4.037 4.392 . 0 0 "[ . 1 . 2]" 1
867 1 30 TYR QD 1 60 LYS HB2 . . 3.840 2.656 2.371 2.846 . 0 0 "[ . 1 . 2]" 1
868 1 30 TYR QD 1 60 LYS HB3 . . 4.370 4.275 3.966 4.376 0.006 1 0 "[ . 1 . 2]" 1
869 1 30 TYR QD 1 60 LYS HG3 . . 4.790 4.074 3.665 4.441 . 0 0 "[ . 1 . 2]" 1
870 1 30 TYR QD 1 61 VAL H . . 3.670 3.535 3.273 3.678 0.008 10 0 "[ . 1 . 2]" 1
871 1 30 TYR QD 1 61 VAL HB . . 5.500 5.378 5.121 5.505 0.005 4 0 "[ . 1 . 2]" 1
872 1 30 TYR QD 1 62 ASP HA . . 4.550 4.287 4.157 4.502 . 0 0 "[ . 1 . 2]" 1
873 1 30 TYR QD 1 63 VAL MG1 . . 5.500 5.221 5.053 5.449 . 0 0 "[ . 1 . 2]" 1
874 1 30 TYR QE 1 32 PRO HA . . 4.310 3.899 3.496 4.253 . 0 0 "[ . 1 . 2]" 1
875 1 30 TYR QE 1 32 PRO HB3 . . 4.100 3.617 3.422 3.780 . 0 0 "[ . 1 . 2]" 1
876 1 30 TYR QE 1 32 PRO QD . . 4.340 2.952 2.895 3.000 . 0 0 "[ . 1 . 2]" 1
877 1 30 TYR QE 1 32 PRO QG . . 4.240 4.254 4.244 4.276 0.036 12 0 "[ . 1 . 2]" 1
878 1 30 TYR QE 1 60 LYS HA . . 4.780 4.652 4.484 4.788 0.008 8 0 "[ . 1 . 2]" 1
879 1 30 TYR QE 1 60 LYS HB2 . . 3.360 2.613 2.452 2.773 . 0 0 "[ . 1 . 2]" 1
880 1 30 TYR QE 1 60 LYS HB3 . . 4.240 4.043 3.853 4.223 . 0 0 "[ . 1 . 2]" 1
881 1 30 TYR QE 1 60 LYS HD2 . . 3.520 2.475 2.006 3.052 . 0 0 "[ . 1 . 2]" 1
882 1 30 TYR QE 1 60 LYS HE2 . . 5.000 4.716 4.235 4.942 . 0 0 "[ . 1 . 2]" 1
883 1 30 TYR QE 1 60 LYS QE . . 4.250 3.728 3.356 4.183 . 0 0 "[ . 1 . 2]" 1
884 1 30 TYR QE 1 60 LYS HE3 . . 5.000 3.967 3.440 4.814 . 0 0 "[ . 1 . 2]" 1
885 1 30 TYR QE 1 60 LYS HG2 . . 4.650 3.977 3.658 4.366 . 0 0 "[ . 1 . 2]" 1
886 1 30 TYR QE 1 60 LYS HG3 . . 4.220 2.356 2.006 2.787 . 0 0 "[ . 1 . 2]" 1
887 1 30 TYR QE 1 61 VAL H . . 4.340 4.114 3.872 4.345 0.005 10 0 "[ . 1 . 2]" 1
888 1 30 TYR QE 1 62 ASP H . . 5.270 4.989 4.692 5.276 0.006 19 0 "[ . 1 . 2]" 1
889 1 30 TYR QE 1 62 ASP HA . . 4.270 3.923 3.698 4.237 . 0 0 "[ . 1 . 2]" 1
890 1 30 TYR QE 1 62 ASP QB . . 4.320 3.996 3.519 4.327 0.007 14 0 "[ . 1 . 2]" 1
891 1 31 ALA H 1 34 CYS H . . 4.960 4.447 3.968 4.846 . 0 0 "[ . 1 . 2]" 1
892 1 31 ALA H 1 37 CYS HB2 . . 4.220 2.486 2.055 2.818 . 0 0 "[ . 1 . 2]" 1
893 1 31 ALA H 1 37 CYS QB . . 3.630 2.213 1.939 2.411 . 0 0 "[ . 1 . 2]" 1
894 1 31 ALA H 1 37 CYS HB3 . . 4.220 2.695 2.000 3.175 . 0 0 "[ . 1 . 2]" 1
895 1 31 ALA H 1 78 LEU QB . . 4.800 4.348 3.954 4.800 . 0 0 "[ . 1 . 2]" 1
896 1 31 ALA H 1 78 LEU MD1 . . 4.960 4.452 4.055 4.876 . 0 0 "[ . 1 . 2]" 1
897 1 31 ALA H 1 78 LEU MD2 . . 4.800 4.658 4.133 4.809 0.009 14 0 "[ . 1 . 2]" 1
898 1 31 ALA HA 1 32 PRO HA . . 4.770 4.413 4.409 4.417 . 0 0 "[ . 1 . 2]" 1
899 1 31 ALA HA 1 32 PRO HD2 . . 3.510 2.171 2.146 2.197 . 0 0 "[ . 1 . 2]" 1
900 1 31 ALA HA 1 32 PRO QD . . 2.970 1.969 1.956 1.981 . 0 0 "[ . 1 . 2]" 1
901 1 31 ALA HA 1 32 PRO HD3 . . 3.510 2.253 2.253 2.255 . 0 0 "[ . 1 . 2]" 1
902 1 31 ALA HA 1 32 PRO QG . . 4.850 3.869 3.856 3.883 . 0 0 "[ . 1 . 2]" 1
903 1 31 ALA HA 1 63 VAL MG2 . . 4.160 2.711 2.479 2.939 . 0 0 "[ . 1 . 2]" 1
904 1 31 ALA HA 1 64 THR H . . 5.500 5.157 4.268 5.510 0.010 6 0 "[ . 1 . 2]" 1
905 1 31 ALA HA 1 64 THR MG . . 3.570 3.321 3.005 3.474 . 0 0 "[ . 1 . 2]" 1
906 1 31 ALA MB 1 32 PRO HD2 . . 4.130 2.504 2.414 2.634 . 0 0 "[ . 1 . 2]" 1
907 1 31 ALA MB 1 32 PRO HD3 . . 4.130 3.573 3.537 3.613 . 0 0 "[ . 1 . 2]" 1
908 1 31 ALA MB 1 32 PRO QG . . 4.690 3.900 3.813 3.951 . 0 0 "[ . 1 . 2]" 1
909 1 31 ALA MB 1 33 TRP H . . 5.000 2.563 2.176 2.953 . 0 0 "[ . 1 . 2]" 1
910 1 31 ALA MB 1 33 TRP HE1 . . 4.400 3.794 3.341 4.055 . 0 0 "[ . 1 . 2]" 1
911 1 31 ALA MB 1 33 TRP HE3 . . 5.170 2.901 2.704 3.391 . 0 0 "[ . 1 . 2]" 1
912 1 31 ALA MB 1 33 TRP HZ2 . . 4.460 2.892 2.707 3.086 . 0 0 "[ . 1 . 2]" 1
913 1 31 ALA MB 1 34 CYS H . . 4.060 2.857 2.002 3.388 . 0 0 "[ . 1 . 2]" 1
914 1 31 ALA MB 1 34 CYS HB2 . . 4.870 2.162 1.914 2.677 . 0 0 "[ . 1 . 2]" 1
915 1 31 ALA MB 1 34 CYS HB3 . . 4.870 2.883 2.045 3.683 . 0 0 "[ . 1 . 2]" 1
916 1 31 ALA MB 1 63 VAL MG2 . . 3.450 2.164 2.000 2.351 . 0 0 "[ . 1 . 2]" 1
917 1 31 ALA MB 1 64 THR MG . . 3.390 3.334 3.122 3.399 0.009 8 0 "[ . 1 . 2]" 1
918 1 31 ALA MB 1 78 LEU MD1 . . 3.250 2.436 1.949 2.779 . 0 0 "[ . 1 . 2]" 1
919 1 31 ALA MB 1 78 LEU MD2 . . 4.060 3.772 3.171 3.926 . 0 0 "[ . 1 . 2]" 1
920 1 32 PRO HA 1 33 TRP HA . . 5.180 4.574 4.498 4.660 . 0 0 "[ . 1 . 2]" 1
921 1 32 PRO HA 1 34 CYS H . . 4.240 3.839 3.630 4.225 . 0 0 "[ . 1 . 2]" 1
922 1 32 PRO HA 1 38 GLN HE21 . . 5.010 4.302 3.569 4.817 . 0 0 "[ . 1 . 2]" 1
923 1 32 PRO HA 1 38 GLN QG . . 5.340 4.534 3.827 5.328 . 0 0 "[ . 1 . 2]" 1
924 1 32 PRO HB2 1 33 TRP H . . 4.310 3.670 3.310 3.985 . 0 0 "[ . 1 . 2]" 1
925 1 32 PRO HB2 1 33 TRP HA . . 4.730 4.334 4.138 4.509 . 0 0 "[ . 1 . 2]" 1
926 1 32 PRO HB2 1 33 TRP HD1 . . 4.670 4.260 3.642 4.571 . 0 0 "[ . 1 . 2]" 1
927 1 32 PRO QD 1 33 TRP H . . 4.480 2.724 2.602 2.973 . 0 0 "[ . 1 . 2]" 1
928 1 32 PRO QD 1 33 TRP HD1 . . 4.860 3.818 3.252 4.087 . 0 0 "[ . 1 . 2]" 1
929 1 32 PRO QD 1 33 TRP HE1 . . 4.840 3.201 2.662 3.486 . 0 0 "[ . 1 . 2]" 1
930 1 32 PRO QD 1 62 ASP HA . . 5.040 4.489 4.265 4.712 . 0 0 "[ . 1 . 2]" 1
931 1 32 PRO QD 1 64 THR HB . . 5.350 4.343 3.581 4.576 . 0 0 "[ . 1 . 2]" 1
932 1 32 PRO QD 1 64 THR MG . . 3.120 2.052 1.897 2.227 . 0 0 "[ . 1 . 2]" 1
933 1 32 PRO HD2 1 64 THR MG . . 3.660 2.152 1.999 2.312 . 0 0 "[ . 1 . 2]" 1
934 1 32 PRO HD3 1 64 THR MG . . 3.660 2.594 2.333 2.984 . 0 0 "[ . 1 . 2]" 1
935 1 32 PRO QG 1 33 TRP HD1 . . 3.960 2.592 2.007 2.859 . 0 0 "[ . 1 . 2]" 1
936 1 32 PRO QG 1 34 CYS H . . 5.120 4.918 4.454 5.136 0.016 9 0 "[ . 1 . 2]" 1
937 1 32 PRO QG 1 64 THR HB . . 4.160 3.949 3.644 4.163 0.003 6 0 "[ . 1 . 2]" 1
938 1 32 PRO QG 1 64 THR MG . . 3.980 2.153 1.882 2.530 . 0 0 "[ . 1 . 2]" 1
939 1 33 TRP H 1 33 TRP HD1 . . 4.150 3.476 3.297 3.702 . 0 0 "[ . 1 . 2]" 1
940 1 33 TRP H 1 34 CYS H . . 3.580 2.433 1.826 2.787 . 0 0 "[ . 1 . 2]" 1
941 1 33 TRP HA 1 33 TRP HD1 . . 4.630 4.292 4.060 4.423 . 0 0 "[ . 1 . 2]" 1
942 1 33 TRP HA 1 33 TRP HE3 . . 5.290 4.315 4.155 4.596 . 0 0 "[ . 1 . 2]" 1
943 1 33 TRP HA 1 38 GLN HE21 . . 4.180 4.082 3.613 4.198 0.018 16 0 "[ . 1 . 2]" 1
944 1 33 TRP HA 1 38 GLN HE22 . . 4.750 4.680 4.405 4.790 0.040 14 0 "[ . 1 . 2]" 1
945 1 33 TRP QB 1 33 TRP HD1 . . 3.250 2.531 2.505 2.611 . 0 0 "[ . 1 . 2]" 1
946 1 33 TRP QB 1 33 TRP HE3 . . 3.540 2.749 2.556 2.852 . 0 0 "[ . 1 . 2]" 1
947 1 33 TRP HB2 1 33 TRP HD1 . . 3.870 3.702 3.640 3.809 . 0 0 "[ . 1 . 2]" 1
948 1 33 TRP HB3 1 33 TRP HD1 . . 3.870 2.577 2.552 2.659 . 0 0 "[ . 1 . 2]" 1
949 1 33 TRP HD1 1 64 THR MG . . 4.220 3.436 3.062 4.142 . 0 0 "[ . 1 . 2]" 1
950 1 33 TRP HE1 1 64 THR HB . . 4.950 3.686 1.887 4.166 . 0 0 "[ . 1 . 2]" 1
951 1 33 TRP HE1 1 64 THR MG . . 3.510 1.957 1.739 2.854 . 0 0 "[ . 1 . 2]" 1
952 1 33 TRP HE3 1 34 CYS H . . 4.170 3.487 2.534 3.954 . 0 0 "[ . 1 . 2]" 1
953 1 33 TRP HE3 1 34 CYS QB . . 4.780 2.814 2.204 4.267 . 0 0 "[ . 1 . 2]" 1
954 1 33 TRP HE3 1 35 PRO QD . . 5.060 4.434 3.886 4.854 . 0 0 "[ . 1 . 2]" 1
955 1 33 TRP HH2 1 63 VAL MG2 . . 4.720 2.396 2.026 2.760 . 0 0 "[ . 1 . 2]" 1
956 1 33 TRP HH2 1 64 THR MG . . 4.890 4.843 4.653 4.910 0.020 6 0 "[ . 1 . 2]" 1
957 1 33 TRP HH2 1 78 LEU MD1 . . 3.940 2.407 2.131 2.777 . 0 0 "[ . 1 . 2]" 1
958 1 33 TRP HH2 1 78 LEU HG . . 5.500 4.994 4.608 5.401 . 0 0 "[ . 1 . 2]" 1
959 1 33 TRP HZ2 1 63 VAL HA . . 5.500 5.486 5.391 5.525 0.025 18 0 "[ . 1 . 2]" 1
960 1 33 TRP HZ2 1 63 VAL MG2 . . 4.640 1.985 1.869 2.184 . 0 0 "[ . 1 . 2]" 1
961 1 33 TRP HZ2 1 64 THR MG . . 3.700 2.997 2.802 3.245 . 0 0 "[ . 1 . 2]" 1
962 1 33 TRP HZ2 1 78 LEU MD1 . . 4.430 4.019 3.735 4.390 . 0 0 "[ . 1 . 2]" 1
963 1 34 CYS H 1 34 CYS HB2 . . 3.390 2.749 2.170 3.236 . 0 0 "[ . 1 . 2]" 1
964 1 34 CYS H 1 34 CYS QB . . 2.880 2.447 2.149 2.666 . 0 0 "[ . 1 . 2]" 1
965 1 34 CYS H 1 34 CYS HB3 . . 3.390 2.934 2.529 3.487 0.097 12 0 "[ . 1 . 2]" 1
966 1 34 CYS H 1 37 CYS QB . . 4.000 3.727 3.420 3.964 . 0 0 "[ . 1 . 2]" 1
967 1 34 CYS H 1 38 GLN HE21 . . 4.840 3.559 2.725 4.495 . 0 0 "[ . 1 . 2]" 1
968 1 34 CYS QB 1 35 PRO QD . . 4.310 3.270 2.743 3.447 . 0 0 "[ . 1 . 2]" 1
969 1 34 CYS QB 1 37 CYS QB . . 3.640 2.261 1.978 2.537 . 0 0 "[ . 1 . 2]" 1
970 1 34 CYS QB 1 78 LEU MD1 . . 4.160 3.889 3.385 4.180 0.020 12 0 "[ . 1 . 2]" 1
971 1 35 PRO HA 1 38 GLN H . . 3.990 3.564 3.279 3.896 . 0 0 "[ . 1 . 2]" 1
972 1 35 PRO HA 1 38 GLN QB . . 4.330 3.222 2.645 3.799 . 0 0 "[ . 1 . 2]" 1
973 1 35 PRO HA 1 38 GLN HE21 . . 5.340 3.539 3.114 4.219 . 0 0 "[ . 1 . 2]" 1
974 1 35 PRO HA 1 38 GLN HE22 . . 5.260 3.813 2.569 5.262 0.002 19 0 "[ . 1 . 2]" 1
975 1 35 PRO HA 1 38 GLN HG2 . . 4.380 3.898 2.099 4.393 0.013 1 0 "[ . 1 . 2]" 1
976 1 35 PRO HA 1 38 GLN QG . . 3.710 2.789 2.029 3.355 . 0 0 "[ . 1 . 2]" 1
977 1 35 PRO HA 1 38 GLN HG3 . . 4.380 2.951 2.085 3.483 . 0 0 "[ . 1 . 2]" 1
978 1 35 PRO HA 1 39 ASN H . . 5.300 5.009 4.433 5.310 0.010 18 0 "[ . 1 . 2]" 1
979 1 35 PRO HB2 1 36 ALA H . . 4.230 2.984 2.860 3.405 . 0 0 "[ . 1 . 2]" 1
980 1 35 PRO HB2 1 36 ALA MB . . 4.510 4.279 4.111 4.394 . 0 0 "[ . 1 . 2]" 1
981 1 35 PRO QD 1 36 ALA H . . 3.590 2.679 2.605 2.717 . 0 0 "[ . 1 . 2]" 1
982 1 35 PRO HD2 1 36 ALA H . . 4.160 2.732 2.650 2.774 . 0 0 "[ . 1 . 2]" 1
983 1 35 PRO HD3 1 36 ALA H . . 4.160 3.866 3.840 3.882 . 0 0 "[ . 1 . 2]" 1
984 1 35 PRO QG 1 36 ALA H . . 3.880 1.996 1.881 2.436 . 0 0 "[ . 1 . 2]" 1
985 1 35 PRO QG 1 36 ALA MB . . 4.280 3.253 3.032 3.407 . 0 0 "[ . 1 . 2]" 1
986 1 35 PRO HG2 1 36 ALA H . . 4.710 2.006 1.889 2.459 . 0 0 "[ . 1 . 2]" 1
987 1 35 PRO HG3 1 36 ALA H . . 4.710 3.609 3.520 3.948 . 0 0 "[ . 1 . 2]" 1
988 1 36 ALA H 1 36 ALA MB . . 3.150 2.153 2.024 2.243 . 0 0 "[ . 1 . 2]" 1
989 1 36 ALA HA 1 39 ASN H . . 4.240 3.637 3.397 3.854 . 0 0 "[ . 1 . 2]" 1
990 1 36 ALA HA 1 39 ASN QB . . 3.460 3.030 2.809 3.304 . 0 0 "[ . 1 . 2]" 1
991 1 36 ALA HA 1 39 ASN QD . . 3.990 3.275 2.121 3.997 0.007 20 0 "[ . 1 . 2]" 1
992 1 36 ALA HA 1 40 LEU H . . 5.080 4.910 4.705 5.095 0.015 20 0 "[ . 1 . 2]" 1
993 1 36 ALA MB 1 37 CYS H . . 3.920 2.615 2.443 2.953 . 0 0 "[ . 1 . 2]" 1
994 1 36 ALA MB 1 37 CYS HA . . 4.340 3.775 3.658 3.897 . 0 0 "[ . 1 . 2]" 1
995 1 36 ALA MB 1 39 ASN QB . . 4.240 4.017 3.844 4.193 . 0 0 "[ . 1 . 2]" 1
996 1 36 ALA MB 1 40 LEU H . . 5.130 4.936 4.600 5.138 0.008 8 0 "[ . 1 . 2]" 1
997 1 36 ALA MB 1 79 PRO HD2 . . 3.420 2.562 1.982 3.252 . 0 0 "[ . 1 . 2]" 1
998 1 36 ALA MB 1 79 PRO QD . . 2.970 1.878 1.725 2.037 . 0 0 "[ . 1 . 2]" 1
999 1 36 ALA MB 1 79 PRO HD3 . . 3.420 1.946 1.770 2.138 . 0 0 "[ . 1 . 2]" 1
1000 1 36 ALA MB 1 79 PRO QG . . 3.760 2.900 2.127 3.459 . 0 0 "[ . 1 . 2]" 1
1001 1 37 CYS H 1 38 GLN H . . 4.560 2.740 2.600 2.942 . 0 0 "[ . 1 . 2]" 1
1002 1 37 CYS HA 1 40 LEU H . . 3.990 3.132 2.926 3.343 . 0 0 "[ . 1 . 2]" 1
1003 1 37 CYS HA 1 40 LEU HB2 . . 4.500 3.546 3.192 3.837 . 0 0 "[ . 1 . 2]" 1
1004 1 37 CYS HA 1 40 LEU HB3 . . 3.690 2.817 2.520 3.212 . 0 0 "[ . 1 . 2]" 1
1005 1 37 CYS HA 1 40 LEU MD1 . . 5.500 5.158 4.909 5.388 . 0 0 "[ . 1 . 2]" 1
1006 1 37 CYS HA 1 40 LEU MD2 . . 4.140 3.603 3.302 3.988 . 0 0 "[ . 1 . 2]" 1
1007 1 37 CYS HA 1 41 GLN HE21 . . 4.840 4.487 4.060 4.845 0.005 11 0 "[ . 1 . 2]" 1
1008 1 37 CYS HA 1 79 PRO HB2 . . 4.830 4.583 3.765 4.853 0.023 16 0 "[ . 1 . 2]" 1
1009 1 37 CYS HA 1 79 PRO QB . . 4.250 3.043 2.248 3.443 . 0 0 "[ . 1 . 2]" 1
1010 1 37 CYS HA 1 79 PRO HB3 . . 4.830 3.092 2.266 3.522 . 0 0 "[ . 1 . 2]" 1
1011 1 37 CYS HA 1 79 PRO QD . . 4.280 3.585 2.700 4.202 . 0 0 "[ . 1 . 2]" 1
1012 1 37 CYS HA 1 79 PRO QG . . 3.880 3.228 2.351 3.845 . 0 0 "[ . 1 . 2]" 1
1013 1 37 CYS QB 1 38 GLN H . . 3.930 2.633 2.457 2.825 . 0 0 "[ . 1 . 2]" 1
1014 1 37 CYS HB2 1 38 GLN H . . 4.790 3.408 2.514 4.129 . 0 0 "[ . 1 . 2]" 1
1015 1 37 CYS HB3 1 38 GLN H . . 4.790 3.103 2.494 3.764 . 0 0 "[ . 1 . 2]" 1
1016 1 38 GLN H 1 38 GLN HB2 . . 4.150 2.653 2.438 2.957 . 0 0 "[ . 1 . 2]" 1
1017 1 38 GLN H 1 38 GLN QB . . 3.460 2.580 2.400 2.809 . 0 0 "[ . 1 . 2]" 1
1018 1 38 GLN H 1 38 GLN HB3 . . 4.150 3.576 3.504 3.606 . 0 0 "[ . 1 . 2]" 1
1019 1 38 GLN H 1 38 GLN HG2 . . 4.000 2.924 1.879 3.757 . 0 0 "[ . 1 . 2]" 1
1020 1 38 GLN H 1 38 GLN QG . . 3.350 2.040 1.853 2.293 . 0 0 "[ . 1 . 2]" 1
1021 1 38 GLN H 1 38 GLN HG3 . . 4.000 2.395 1.982 3.517 . 0 0 "[ . 1 . 2]" 1
1022 1 38 GLN H 1 39 ASN H . . 3.720 2.740 2.593 2.879 . 0 0 "[ . 1 . 2]" 1
1023 1 38 GLN HA 1 38 GLN HG2 . . 3.800 2.841 2.535 3.344 . 0 0 "[ . 1 . 2]" 1
1024 1 38 GLN HA 1 38 GLN QG . . 3.120 2.616 2.416 3.134 0.014 20 0 "[ . 1 . 2]" 1
1025 1 38 GLN HA 1 38 GLN HG3 . . 3.800 3.197 2.643 3.858 0.058 14 0 "[ . 1 . 2]" 1
1026 1 38 GLN HA 1 41 GLN H . . 4.010 3.480 3.235 3.774 . 0 0 "[ . 1 . 2]" 1
1027 1 38 GLN HA 1 41 GLN HG2 . . 3.240 2.459 2.153 2.894 . 0 0 "[ . 1 . 2]" 1
1028 1 38 GLN QB 1 39 ASN H . . 3.360 2.882 2.655 3.121 . 0 0 "[ . 1 . 2]" 1
1029 1 38 GLN HB2 1 39 ASN H . . 4.160 2.959 2.703 3.248 . 0 0 "[ . 1 . 2]" 1
1030 1 38 GLN HB3 1 39 ASN H . . 4.160 3.985 3.722 4.193 0.033 12 0 "[ . 1 . 2]" 1
1031 1 38 GLN HE22 1 38 GLN HG2 . . 4.010 3.642 3.523 3.774 . 0 0 "[ . 1 . 2]" 1
1032 1 38 GLN HE22 1 38 GLN HG3 . . 4.010 3.595 3.488 3.716 . 0 0 "[ . 1 . 2]" 1
1033 1 39 ASN H 1 39 ASN HB2 . . 3.520 2.333 2.178 2.838 . 0 0 "[ . 1 . 2]" 1
1034 1 39 ASN H 1 39 ASN QB . . 2.950 2.223 2.157 2.579 . 0 0 "[ . 1 . 2]" 1
1035 1 39 ASN H 1 39 ASN HB3 . . 3.520 3.245 2.383 3.608 0.088 1 0 "[ . 1 . 2]" 1
1036 1 39 ASN H 1 40 LEU H . . 3.340 2.397 2.167 2.573 . 0 0 "[ . 1 . 2]" 1
1037 1 39 ASN HA 1 39 ASN HD21 . . 4.870 4.158 3.063 4.531 . 0 0 "[ . 1 . 2]" 1
1038 1 39 ASN HA 1 39 ASN QD . . 4.220 3.802 2.936 4.152 . 0 0 "[ . 1 . 2]" 1
1039 1 39 ASN HA 1 39 ASN HD22 . . 4.870 4.414 3.764 4.823 . 0 0 "[ . 1 . 2]" 1
1040 1 39 ASN HA 1 42 PRO HD2 . . 4.230 3.394 3.337 3.451 . 0 0 "[ . 1 . 2]" 1
1041 1 39 ASN HA 1 42 PRO HD3 . . 5.110 4.059 3.973 4.168 . 0 0 "[ . 1 . 2]" 1
1042 1 39 ASN QB 1 40 LEU HB3 . . 5.340 4.794 4.589 4.925 . 0 0 "[ . 1 . 2]" 1
1043 1 39 ASN QB 1 41 GLN H . . 5.340 4.672 4.553 4.837 . 0 0 "[ . 1 . 2]" 1
1044 1 39 ASN HB2 1 40 LEU H . . 3.980 3.259 2.750 4.017 0.037 18 0 "[ . 1 . 2]" 1
1045 1 39 ASN HB3 1 40 LEU H . . 3.980 3.336 2.700 3.927 . 0 0 "[ . 1 . 2]" 1
1046 1 40 LEU H 1 40 LEU HB2 . . 3.210 2.622 2.531 2.768 . 0 0 "[ . 1 . 2]" 1
1047 1 40 LEU H 1 40 LEU HB3 . . 3.110 2.482 2.399 2.560 . 0 0 "[ . 1 . 2]" 1
1048 1 40 LEU H 1 40 LEU MD1 . . 4.340 4.127 4.014 4.235 . 0 0 "[ . 1 . 2]" 1
1049 1 40 LEU H 1 40 LEU MD2 . . 4.270 4.228 4.197 4.295 0.025 20 0 "[ . 1 . 2]" 1
1050 1 40 LEU H 1 40 LEU HG . . 5.380 4.460 4.401 4.510 . 0 0 "[ . 1 . 2]" 1
1051 1 40 LEU H 1 41 GLN HG2 . . 4.580 4.562 4.327 4.622 0.042 18 0 "[ . 1 . 2]" 1
1052 1 40 LEU H 1 42 PRO HD2 . . 4.370 3.496 3.306 3.615 . 0 0 "[ . 1 . 2]" 1
1053 1 40 LEU HA 1 40 LEU MD1 . . 3.030 2.168 1.980 2.332 . 0 0 "[ . 1 . 2]" 1
1054 1 40 LEU HA 1 40 LEU MD2 . . 4.130 3.909 3.880 3.945 . 0 0 "[ . 1 . 2]" 1
1055 1 40 LEU HA 1 42 PRO HD2 . . 5.110 3.414 3.332 3.468 . 0 0 "[ . 1 . 2]" 1
1056 1 40 LEU HA 1 43 GLU HB2 . . 4.470 2.003 1.982 2.100 . 0 0 "[ . 1 . 2]" 1
1057 1 40 LEU HB2 1 40 LEU MD1 . . 3.320 2.268 2.154 2.381 . 0 0 "[ . 1 . 2]" 1
1058 1 40 LEU HB2 1 41 GLN H . . 4.240 4.001 3.883 4.124 . 0 0 "[ . 1 . 2]" 1
1059 1 40 LEU HB2 1 41 GLN HE21 . . 5.500 5.519 5.507 5.530 0.030 13 0 "[ . 1 . 2]" 1
1060 1 40 LEU HB2 1 96 ARG QD . . 4.570 3.583 2.227 4.387 . 0 0 "[ . 1 . 2]" 1
1061 1 40 LEU HB3 1 40 LEU MD2 . . 3.230 2.228 2.088 2.333 . 0 0 "[ . 1 . 2]" 1
1062 1 40 LEU HB3 1 41 GLN H . . 3.710 2.862 2.712 3.075 . 0 0 "[ . 1 . 2]" 1
1063 1 40 LEU HB3 1 41 GLN HE21 . . 4.210 3.776 3.758 3.800 . 0 0 "[ . 1 . 2]" 1
1064 1 40 LEU HB3 1 44 TRP HB2 . . 4.960 4.738 4.549 4.947 . 0 0 "[ . 1 . 2]" 1
1065 1 40 LEU MD1 1 42 PRO HD2 . . 5.500 4.997 4.800 5.166 . 0 0 "[ . 1 . 2]" 1
1066 1 40 LEU MD1 1 43 GLU H . . 4.400 4.121 3.886 4.406 0.006 5 0 "[ . 1 . 2]" 1
1067 1 40 LEU MD1 1 43 GLU HA . . 4.980 4.596 4.415 4.912 . 0 0 "[ . 1 . 2]" 1
1068 1 40 LEU MD1 1 43 GLU HB2 . . 3.420 2.330 1.995 2.756 . 0 0 "[ . 1 . 2]" 1
1069 1 40 LEU MD1 1 43 GLU HB3 . . 3.690 2.512 2.293 2.889 . 0 0 "[ . 1 . 2]" 1
1070 1 40 LEU MD1 1 43 GLU QG . . 3.920 3.293 3.029 3.913 . 0 0 "[ . 1 . 2]" 1
1071 1 40 LEU MD1 1 44 TRP H . . 3.980 3.467 2.953 3.755 . 0 0 "[ . 1 . 2]" 1
1072 1 40 LEU MD1 1 44 TRP HA . . 4.280 3.860 3.475 4.146 . 0 0 "[ . 1 . 2]" 1
1073 1 40 LEU MD1 1 44 TRP HB2 . . 3.870 3.511 3.155 3.696 . 0 0 "[ . 1 . 2]" 1
1074 1 40 LEU MD1 1 44 TRP HB3 . . 5.130 4.947 4.588 5.126 . 0 0 "[ . 1 . 2]" 1
1075 1 40 LEU MD1 1 44 TRP HE3 . . 3.200 2.818 2.396 3.170 . 0 0 "[ . 1 . 2]" 1
1076 1 40 LEU MD1 1 44 TRP HZ3 . . 4.540 3.941 3.547 4.236 . 0 0 "[ . 1 . 2]" 1
1077 1 40 LEU MD1 1 79 PRO QG . . 5.020 3.993 3.495 4.448 . 0 0 "[ . 1 . 2]" 1
1078 1 40 LEU MD1 1 96 ARG HA . . 4.530 3.870 3.591 4.198 . 0 0 "[ . 1 . 2]" 1
1079 1 40 LEU MD1 1 96 ARG QB . . 3.080 2.120 1.871 3.103 0.023 16 0 "[ . 1 . 2]" 1
1080 1 40 LEU MD1 1 96 ARG HD2 . . 4.120 2.825 1.947 3.638 . 0 0 "[ . 1 . 2]" 1
1081 1 40 LEU MD1 1 96 ARG QD . . 3.610 2.532 1.935 3.077 . 0 0 "[ . 1 . 2]" 1
1082 1 40 LEU MD1 1 96 ARG HD3 . . 4.120 3.196 2.317 4.083 . 0 0 "[ . 1 . 2]" 1
1083 1 40 LEU MD1 1 97 THR H . . 5.280 5.164 4.925 5.293 0.013 2 0 "[ . 1 . 2]" 1
1084 1 40 LEU MD1 1 97 THR MG . . 4.980 4.894 4.568 4.992 0.012 12 0 "[ . 1 . 2]" 1
1085 1 40 LEU MD1 1 101 PHE QE . . 3.470 2.891 2.656 3.069 . 0 0 "[ . 1 . 2]" 1
1086 1 40 LEU MD1 1 101 PHE HZ . . 3.450 2.432 1.947 2.777 . 0 0 "[ . 1 . 2]" 1
1087 1 40 LEU MD2 1 41 GLN H . . 4.870 4.512 4.312 4.640 . 0 0 "[ . 1 . 2]" 1
1088 1 40 LEU MD2 1 41 GLN HA . . 4.860 4.758 4.478 4.863 0.003 20 0 "[ . 1 . 2]" 1
1089 1 40 LEU MD2 1 41 GLN HE21 . . 4.480 4.267 3.870 4.485 0.005 1 0 "[ . 1 . 2]" 1
1090 1 40 LEU MD2 1 41 GLN HE22 . . 5.350 4.884 4.436 5.066 . 0 0 "[ . 1 . 2]" 1
1091 1 40 LEU MD2 1 44 TRP H . . 4.820 4.796 4.643 4.836 0.016 10 0 "[ . 1 . 2]" 1
1092 1 40 LEU MD2 1 44 TRP HA . . 5.500 5.021 4.842 5.177 . 0 0 "[ . 1 . 2]" 1
1093 1 40 LEU MD2 1 44 TRP HB2 . . 4.070 3.651 3.414 3.795 . 0 0 "[ . 1 . 2]" 1
1094 1 40 LEU MD2 1 44 TRP HE3 . . 4.080 3.659 3.296 3.849 . 0 0 "[ . 1 . 2]" 1
1095 1 40 LEU MD2 1 79 PRO HB2 . . 3.700 2.549 1.967 3.058 . 0 0 "[ . 1 . 2]" 1
1096 1 40 LEU MD2 1 79 PRO HB3 . . 3.700 2.816 2.503 3.328 . 0 0 "[ . 1 . 2]" 1
1097 1 40 LEU MD2 1 79 PRO QD . . 5.350 4.486 4.151 4.790 . 0 0 "[ . 1 . 2]" 1
1098 1 40 LEU MD2 1 79 PRO HG2 . . 4.050 3.615 2.874 4.064 0.014 18 0 "[ . 1 . 2]" 1
1099 1 40 LEU MD2 1 79 PRO QG . . 3.380 2.949 2.541 3.391 0.011 18 0 "[ . 1 . 2]" 1
1100 1 40 LEU MD2 1 79 PRO HG3 . . 4.050 3.134 2.641 3.631 . 0 0 "[ . 1 . 2]" 1
1101 1 40 LEU MD2 1 96 ARG HA . . 5.500 5.271 4.919 5.507 0.007 3 0 "[ . 1 . 2]" 1
1102 1 40 LEU MD2 1 96 ARG HD2 . . 4.690 3.096 1.890 3.615 . 0 0 "[ . 1 . 2]" 1
1103 1 40 LEU MD2 1 96 ARG QD . . 3.850 2.580 1.878 3.282 . 0 0 "[ . 1 . 2]" 1
1104 1 40 LEU MD2 1 96 ARG HD3 . . 4.690 3.000 2.122 3.940 . 0 0 "[ . 1 . 2]" 1
1105 1 40 LEU HG 1 41 GLN H . . 4.400 4.113 3.915 4.273 . 0 0 "[ . 1 . 2]" 1
1106 1 40 LEU HG 1 41 GLN HA . . 4.960 4.154 3.939 4.318 . 0 0 "[ . 1 . 2]" 1
1107 1 40 LEU HG 1 41 GLN HE21 . . 4.810 4.606 4.314 4.818 0.008 1 0 "[ . 1 . 2]" 1
1108 1 40 LEU HG 1 44 TRP H . . 4.500 3.345 3.182 3.437 . 0 0 "[ . 1 . 2]" 1
1109 1 40 LEU HG 1 44 TRP HB2 . . 4.140 2.587 2.441 2.699 . 0 0 "[ . 1 . 2]" 1
1110 1 40 LEU HG 1 44 TRP HB3 . . 4.490 4.267 4.093 4.394 . 0 0 "[ . 1 . 2]" 1
1111 1 40 LEU HG 1 101 PHE QE . . 5.500 4.907 4.775 5.138 . 0 0 "[ . 1 . 2]" 1
1112 1 41 GLN H 1 41 GLN QB . . 3.100 2.295 2.255 2.329 . 0 0 "[ . 1 . 2]" 1
1113 1 41 GLN H 1 41 GLN HG2 . . 3.180 2.721 2.634 2.773 . 0 0 "[ . 1 . 2]" 1
1114 1 41 GLN H 1 41 GLN HG3 . . 4.290 4.031 3.941 4.063 . 0 0 "[ . 1 . 2]" 1
1115 1 41 GLN H 1 42 PRO HD2 . . 3.380 2.361 2.246 2.409 . 0 0 "[ . 1 . 2]" 1
1116 1 41 GLN H 1 42 PRO HD3 . . 3.550 3.343 3.209 3.386 . 0 0 "[ . 1 . 2]" 1
1117 1 41 GLN H 1 44 TRP HB2 . . 5.500 5.188 5.140 5.403 . 0 0 "[ . 1 . 2]" 1
1118 1 41 GLN HA 1 41 GLN HE21 . . 4.500 2.219 2.141 2.259 . 0 0 "[ . 1 . 2]" 1
1119 1 41 GLN HA 1 41 GLN HE22 . . 3.830 2.813 2.792 2.872 . 0 0 "[ . 1 . 2]" 1
1120 1 41 GLN HA 1 41 GLN HG2 . . 4.020 2.960 2.920 2.993 . 0 0 "[ . 1 . 2]" 1
1121 1 41 GLN HA 1 41 GLN HG3 . . 3.790 3.563 3.547 3.602 . 0 0 "[ . 1 . 2]" 1
1122 1 41 GLN HA 1 43 GLU H . . 4.990 4.882 4.841 4.905 . 0 0 "[ . 1 . 2]" 1
1123 1 41 GLN HA 1 44 TRP H . . 4.050 4.075 4.050 4.093 0.043 6 0 "[ . 1 . 2]" 1
1124 1 41 GLN HA 1 44 TRP HB2 . . 3.970 3.812 3.712 3.972 0.002 10 0 "[ . 1 . 2]" 1
1125 1 41 GLN HA 1 44 TRP HB3 . . 4.000 3.893 3.798 3.998 . 0 0 "[ . 1 . 2]" 1
1126 1 41 GLN HA 1 45 GLU H . . 4.880 4.690 4.514 4.874 . 0 0 "[ . 1 . 2]" 1
1127 1 41 GLN QB 1 42 PRO HD2 . . 3.300 2.472 2.449 2.523 . 0 0 "[ . 1 . 2]" 1
1128 1 41 GLN QB 1 42 PRO HD3 . . 3.010 1.894 1.881 1.908 . 0 0 "[ . 1 . 2]" 1
1129 1 41 GLN HE21 1 41 GLN HG2 . . 3.420 2.256 2.251 2.268 . 0 0 "[ . 1 . 2]" 1
1130 1 41 GLN HE21 1 42 PRO HD2 . . 5.500 5.109 5.078 5.149 . 0 0 "[ . 1 . 2]" 1
1131 1 41 GLN HE22 1 44 TRP HB2 . . 5.500 5.044 4.941 5.169 . 0 0 "[ . 1 . 2]" 1
1132 1 41 GLN HG2 1 42 PRO HD2 . . 4.870 4.399 4.344 4.424 . 0 0 "[ . 1 . 2]" 1
1133 1 41 GLN HG2 1 42 PRO HD3 . . 4.560 4.280 4.265 4.293 . 0 0 "[ . 1 . 2]" 1
1134 1 41 GLN HG3 1 42 PRO HD3 . . 4.600 4.245 4.223 4.273 . 0 0 "[ . 1 . 2]" 1
1135 1 42 PRO HA 1 45 GLU H . . 4.030 3.512 3.367 3.670 . 0 0 "[ . 1 . 2]" 1
1136 1 42 PRO HA 1 45 GLU QB . . 3.120 2.737 2.539 2.885 . 0 0 "[ . 1 . 2]" 1
1137 1 42 PRO HA 1 45 GLU HG3 . . 4.240 3.600 3.141 4.012 . 0 0 "[ . 1 . 2]" 1
1138 1 42 PRO HA 1 46 SER H . . 4.700 4.165 3.847 4.405 . 0 0 "[ . 1 . 2]" 1
1139 1 42 PRO QB 1 43 GLU H . . 3.620 2.915 2.883 2.944 . 0 0 "[ . 1 . 2]" 1
1140 1 42 PRO QB 1 43 GLU QG . . 5.040 4.525 4.007 4.937 . 0 0 "[ . 1 . 2]" 1
1141 1 42 PRO HB2 1 43 GLU H . . 4.440 3.002 2.966 3.035 . 0 0 "[ . 1 . 2]" 1
1142 1 42 PRO HB3 1 43 GLU H . . 4.440 3.949 3.928 3.969 . 0 0 "[ . 1 . 2]" 1
1143 1 42 PRO HD2 1 43 GLU H . . 3.810 2.711 2.698 2.727 . 0 0 "[ . 1 . 2]" 1
1144 1 42 PRO HD2 1 43 GLU HB2 . . 4.680 4.060 4.047 4.088 . 0 0 "[ . 1 . 2]" 1
1145 1 42 PRO HD3 1 43 GLU H . . 4.450 3.857 3.852 3.863 . 0 0 "[ . 1 . 2]" 1
1146 1 42 PRO HG2 1 43 GLU H . . 4.580 2.008 1.976 2.040 . 0 0 "[ . 1 . 2]" 1
1147 1 42 PRO HG2 1 44 TRP H . . 4.700 4.709 4.674 4.732 0.032 16 0 "[ . 1 . 2]" 1
1148 1 42 PRO HG3 1 43 GLU H . . 4.130 3.612 3.587 3.636 . 0 0 "[ . 1 . 2]" 1
1149 1 43 GLU H 1 43 GLU HB2 . . 3.280 2.228 2.214 2.258 . 0 0 "[ . 1 . 2]" 1
1150 1 43 GLU H 1 43 GLU HB3 . . 3.590 3.519 3.512 3.535 . 0 0 "[ . 1 . 2]" 1
1151 1 43 GLU H 1 43 GLU HG2 . . 4.350 3.726 2.777 4.140 . 0 0 "[ . 1 . 2]" 1
1152 1 43 GLU H 1 43 GLU QG . . 3.670 3.207 2.717 3.495 . 0 0 "[ . 1 . 2]" 1
1153 1 43 GLU H 1 43 GLU HG3 . . 4.350 3.704 2.838 4.047 . 0 0 "[ . 1 . 2]" 1
1154 1 43 GLU H 1 44 TRP H . . 3.220 2.790 2.759 2.823 . 0 0 "[ . 1 . 2]" 1
1155 1 43 GLU H 1 44 TRP HB2 . . 4.930 4.885 4.852 4.930 0.000 13 0 "[ . 1 . 2]" 1
1156 1 43 GLU H 1 45 GLU H . . 4.800 4.557 4.364 4.731 . 0 0 "[ . 1 . 2]" 1
1157 1 43 GLU HA 1 47 PHE H . . 4.690 4.566 4.437 4.713 0.023 10 0 "[ . 1 . 2]" 1
1158 1 43 GLU HA 1 98 LYS H . . 4.480 4.348 3.955 4.492 0.012 13 0 "[ . 1 . 2]" 1
1159 1 43 GLU HA 1 98 LYS HG3 . . 5.360 4.413 4.090 5.130 . 0 0 "[ . 1 . 2]" 1
1160 1 43 GLU HB2 1 44 TRP H . . 3.730 2.897 2.805 2.977 . 0 0 "[ . 1 . 2]" 1
1161 1 43 GLU HB2 1 98 LYS H . . 5.460 5.349 5.143 5.462 0.002 13 0 "[ . 1 . 2]" 1
1162 1 43 GLU HB3 1 44 TRP H . . 4.000 3.374 3.252 3.452 . 0 0 "[ . 1 . 2]" 1
1163 1 43 GLU HB3 1 97 THR HA . . 4.060 3.677 3.293 3.946 . 0 0 "[ . 1 . 2]" 1
1164 1 43 GLU HB3 1 98 LYS H . . 4.030 3.901 3.673 4.030 0.000 3 0 "[ . 1 . 2]" 1
1165 1 43 GLU HB3 1 101 PHE QE . . 4.350 2.732 2.281 3.104 . 0 0 "[ . 1 . 2]" 1
1166 1 43 GLU QG 1 97 THR HA . . 3.590 2.875 2.547 3.104 . 0 0 "[ . 1 . 2]" 1
1167 1 43 GLU QG 1 97 THR HB . . 5.340 4.478 3.862 4.784 . 0 0 "[ . 1 . 2]" 1
1168 1 43 GLU QG 1 97 THR MG . . 4.040 3.492 3.266 3.700 . 0 0 "[ . 1 . 2]" 1
1169 1 43 GLU HG2 1 97 THR HA . . 4.320 3.359 2.603 4.329 0.009 3 0 "[ . 1 . 2]" 1
1170 1 43 GLU HG2 1 97 THR MG . . 4.700 3.936 3.367 4.663 . 0 0 "[ . 1 . 2]" 1
1171 1 43 GLU HG2 1 98 LYS H . . 4.420 3.912 2.743 4.456 0.036 18 0 "[ . 1 . 2]" 1
1172 1 43 GLU HG3 1 97 THR HA . . 4.320 3.476 2.643 4.324 0.004 9 0 "[ . 1 . 2]" 1
1173 1 43 GLU HG3 1 97 THR MG . . 4.700 4.173 3.430 4.658 . 0 0 "[ . 1 . 2]" 1
1174 1 43 GLU HG3 1 98 LYS H . . 4.420 3.517 2.995 4.434 0.014 11 0 "[ . 1 . 2]" 1
1175 1 44 TRP H 1 44 TRP HB2 . . 3.230 2.293 2.238 2.362 . 0 0 "[ . 1 . 2]" 1
1176 1 44 TRP H 1 44 TRP HB3 . . 3.370 2.815 2.745 2.868 . 0 0 "[ . 1 . 2]" 1
1177 1 44 TRP H 1 44 TRP HE3 . . 4.240 4.038 3.910 4.181 . 0 0 "[ . 1 . 2]" 1
1178 1 44 TRP HA 1 44 TRP HE3 . . 3.320 2.230 2.134 2.398 . 0 0 "[ . 1 . 2]" 1
1179 1 44 TRP HA 1 47 PHE H . . 3.820 3.365 3.279 3.510 . 0 0 "[ . 1 . 2]" 1
1180 1 44 TRP HA 1 47 PHE HB2 . . 4.050 3.643 3.505 3.768 . 0 0 "[ . 1 . 2]" 1
1181 1 44 TRP HA 1 47 PHE HB3 . . 4.110 2.392 2.227 2.614 . 0 0 "[ . 1 . 2]" 1
1182 1 44 TRP HA 1 47 PHE QD . . 4.150 2.986 2.751 3.333 . 0 0 "[ . 1 . 2]" 1
1183 1 44 TRP HA 1 48 ALA H . . 4.200 3.957 3.823 4.115 . 0 0 "[ . 1 . 2]" 1
1184 1 44 TRP HA 1 58 ILE MG . . 5.060 4.592 4.342 4.761 . 0 0 "[ . 1 . 2]" 1
1185 1 44 TRP HB2 1 44 TRP HE3 . . 4.080 3.012 2.913 3.063 . 0 0 "[ . 1 . 2]" 1
1186 1 44 TRP HB2 1 45 GLU H . . 3.950 3.494 3.367 3.626 . 0 0 "[ . 1 . 2]" 1
1187 1 44 TRP HB2 1 45 GLU HG3 . . 5.500 5.306 5.213 5.438 . 0 0 "[ . 1 . 2]" 1
1188 1 44 TRP HB3 1 44 TRP HD1 . . 3.660 2.548 2.547 2.550 . 0 0 "[ . 1 . 2]" 1
1189 1 44 TRP HB3 1 45 GLU H . . 3.470 2.312 2.128 2.527 . 0 0 "[ . 1 . 2]" 1
1190 1 44 TRP HB3 1 45 GLU HA . . 4.960 3.896 3.828 3.956 . 0 0 "[ . 1 . 2]" 1
1191 1 44 TRP HB3 1 45 GLU QB . . 4.910 4.355 4.230 4.482 . 0 0 "[ . 1 . 2]" 1
1192 1 44 TRP HB3 1 45 GLU HG3 . . 4.930 3.771 3.628 3.946 . 0 0 "[ . 1 . 2]" 1
1193 1 44 TRP HB3 1 46 SER H . . 5.220 4.971 4.812 5.230 0.010 20 0 "[ . 1 . 2]" 1
1194 1 44 TRP HD1 1 45 GLU H . . 4.720 4.369 4.201 4.628 . 0 0 "[ . 1 . 2]" 1
1195 1 44 TRP HD1 1 45 GLU HA . . 4.900 4.455 4.167 4.614 . 0 0 "[ . 1 . 2]" 1
1196 1 44 TRP HD1 1 45 GLU HG2 . . 5.270 4.953 4.685 5.224 . 0 0 "[ . 1 . 2]" 1
1197 1 44 TRP HD1 1 45 GLU HG3 . . 5.410 4.941 4.702 5.285 . 0 0 "[ . 1 . 2]" 1
1198 1 44 TRP HD1 1 48 ALA MB . . 4.340 4.198 4.004 4.322 . 0 0 "[ . 1 . 2]" 1
1199 1 44 TRP HD1 1 58 ILE MG . . 4.110 3.452 3.220 3.687 . 0 0 "[ . 1 . 2]" 1
1200 1 44 TRP HD1 1 60 LYS HB3 . . 4.300 3.473 3.050 3.644 . 0 0 "[ . 1 . 2]" 1
1201 1 44 TRP HD1 1 60 LYS HD3 . . 4.570 3.904 3.316 4.388 . 0 0 "[ . 1 . 2]" 1
1202 1 44 TRP HE1 1 58 ILE HA . . 5.040 4.657 4.357 5.022 . 0 0 "[ . 1 . 2]" 1
1203 1 44 TRP HE1 1 58 ILE MG . . 3.220 2.011 1.818 2.199 . 0 0 "[ . 1 . 2]" 1
1204 1 44 TRP HE1 1 59 ALA H . . 4.150 3.531 3.059 3.985 . 0 0 "[ . 1 . 2]" 1
1205 1 44 TRP HE1 1 59 ALA HA . . 4.890 3.979 3.678 4.248 . 0 0 "[ . 1 . 2]" 1
1206 1 44 TRP HE1 1 60 LYS H . . 5.500 4.594 4.015 4.829 . 0 0 "[ . 1 . 2]" 1
1207 1 44 TRP HE1 1 60 LYS HA . . 4.640 3.988 3.565 4.235 . 0 0 "[ . 1 . 2]" 1
1208 1 44 TRP HE1 1 60 LYS HB3 . . 3.800 3.201 2.871 3.400 . 0 0 "[ . 1 . 2]" 1
1209 1 44 TRP HE1 1 60 LYS HD3 . . 5.500 4.757 4.302 5.053 . 0 0 "[ . 1 . 2]" 1
1210 1 44 TRP HE1 1 60 LYS HG2 . . 5.500 5.321 4.927 5.510 0.010 13 0 "[ . 1 . 2]" 1
1211 1 44 TRP HE3 1 47 PHE QD . . 4.700 2.825 2.582 3.126 . 0 0 "[ . 1 . 2]" 1
1212 1 44 TRP HE3 1 81 ILE MD . . 4.490 3.504 2.667 4.080 . 0 0 "[ . 1 . 2]" 1
1213 1 44 TRP HH2 1 47 PHE QE . . 4.360 2.514 2.327 2.784 . 0 0 "[ . 1 . 2]" 1
1214 1 44 TRP HH2 1 58 ILE MG . . 4.860 3.615 3.407 4.014 . 0 0 "[ . 1 . 2]" 1
1215 1 44 TRP HH2 1 81 ILE MD . . 4.200 3.538 2.790 4.184 . 0 0 "[ . 1 . 2]" 1
1216 1 44 TRP HH2 1 81 ILE MG . . 3.190 2.540 2.121 3.059 . 0 0 "[ . 1 . 2]" 1
1217 1 44 TRP HZ2 1 58 ILE MG . . 3.520 2.035 1.947 2.340 . 0 0 "[ . 1 . 2]" 1
1218 1 44 TRP HZ2 1 59 ALA H . . 3.820 3.024 2.708 3.416 . 0 0 "[ . 1 . 2]" 1
1219 1 44 TRP HZ2 1 81 ILE MG . . 4.410 4.114 3.668 4.423 0.013 17 0 "[ . 1 . 2]" 1
1220 1 44 TRP HZ3 1 47 PHE QD . . 4.710 2.996 2.793 3.311 . 0 0 "[ . 1 . 2]" 1
1221 1 44 TRP HZ3 1 81 ILE MD . . 3.340 2.250 1.963 2.891 . 0 0 "[ . 1 . 2]" 1
1222 1 44 TRP HZ3 1 101 PHE QE . . 4.420 2.708 2.182 3.155 . 0 0 "[ . 1 . 2]" 1
1223 1 44 TRP HZ3 1 101 PHE HZ . . 5.040 2.691 2.184 3.166 . 0 0 "[ . 1 . 2]" 1
1224 1 45 GLU H 1 45 GLU QB . . 3.030 2.310 2.262 2.354 . 0 0 "[ . 1 . 2]" 1
1225 1 45 GLU H 1 45 GLU HG2 . . 3.630 3.471 3.272 3.627 . 0 0 "[ . 1 . 2]" 1
1226 1 45 GLU H 1 45 GLU HG3 . . 3.330 2.603 2.510 2.708 . 0 0 "[ . 1 . 2]" 1
1227 1 45 GLU H 1 46 SER H . . 3.200 2.907 2.827 2.984 . 0 0 "[ . 1 . 2]" 1
1228 1 45 GLU H 1 46 SER QB . . 5.180 4.801 4.551 4.994 . 0 0 "[ . 1 . 2]" 1
1229 1 45 GLU H 1 47 PHE H . . 4.510 4.021 3.882 4.175 . 0 0 "[ . 1 . 2]" 1
1230 1 45 GLU H 1 48 ALA H . . 4.970 4.886 4.843 4.945 . 0 0 "[ . 1 . 2]" 1
1231 1 45 GLU H 1 48 ALA MB . . 5.090 4.842 4.702 5.014 . 0 0 "[ . 1 . 2]" 1
1232 1 45 GLU HA 1 45 GLU HG2 . . 3.270 2.282 2.222 2.382 . 0 0 "[ . 1 . 2]" 1
1233 1 45 GLU HA 1 45 GLU HG3 . . 3.670 3.078 2.941 3.246 . 0 0 "[ . 1 . 2]" 1
1234 1 45 GLU HA 1 47 PHE H . . 4.750 4.067 3.885 4.227 . 0 0 "[ . 1 . 2]" 1
1235 1 45 GLU HA 1 48 ALA H . . 3.870 3.698 3.641 3.762 . 0 0 "[ . 1 . 2]" 1
1236 1 45 GLU HA 1 48 ALA MB . . 3.140 2.939 2.792 3.133 . 0 0 "[ . 1 . 2]" 1
1237 1 45 GLU QB 1 46 SER H . . 3.190 2.485 2.307 2.591 . 0 0 "[ . 1 . 2]" 1
1238 1 45 GLU QB 1 47 PHE H . . 4.630 4.402 4.240 4.489 . 0 0 "[ . 1 . 2]" 1
1239 1 45 GLU QB 1 48 ALA H . . 5.190 5.185 5.110 5.228 0.038 6 0 "[ . 1 . 2]" 1
1240 1 45 GLU QB 1 48 ALA MB . . 4.670 4.564 4.435 4.666 . 0 0 "[ . 1 . 2]" 1
1241 1 45 GLU HG2 1 48 ALA MB . . 4.670 4.498 4.403 4.582 . 0 0 "[ . 1 . 2]" 1
1242 1 45 GLU HG3 1 46 SER H . . 5.130 4.576 4.437 4.654 . 0 0 "[ . 1 . 2]" 1
1243 1 46 SER H 1 46 SER HB2 . . 3.620 2.434 2.200 3.572 . 0 0 "[ . 1 . 2]" 1
1244 1 46 SER H 1 46 SER QB . . 2.880 2.339 2.141 2.430 . 0 0 "[ . 1 . 2]" 1
1245 1 46 SER H 1 46 SER HB3 . . 3.620 3.484 2.363 3.592 . 0 0 "[ . 1 . 2]" 1
1246 1 46 SER H 1 47 PHE H . . 3.190 2.628 2.540 2.749 . 0 0 "[ . 1 . 2]" 1
1247 1 46 SER H 1 49 GLU QG . . 5.270 4.326 4.045 4.635 . 0 0 "[ . 1 . 2]" 1
1248 1 46 SER H 1 98 LYS HG3 . . 4.930 4.694 4.465 4.852 . 0 0 "[ . 1 . 2]" 1
1249 1 46 SER HA 1 49 GLU H . . 3.970 3.855 3.773 3.933 . 0 0 "[ . 1 . 2]" 1
1250 1 46 SER HA 1 49 GLU QG . . 3.630 2.261 1.982 2.557 . 0 0 "[ . 1 . 2]" 1
1251 1 46 SER QB 1 47 PHE H . . 3.380 2.917 2.749 3.460 0.080 18 0 "[ . 1 . 2]" 1
1252 1 46 SER QB 1 47 PHE HB2 . . 5.340 4.553 4.387 5.265 . 0 0 "[ . 1 . 2]" 1
1253 1 46 SER QB 1 98 LYS HB3 . . 4.450 4.362 3.718 4.471 0.021 10 0 "[ . 1 . 2]" 1
1254 1 46 SER QB 1 98 LYS QD . . 3.180 2.086 1.845 2.385 . 0 0 "[ . 1 . 2]" 1
1255 1 46 SER QB 1 98 LYS QE . . 4.530 4.023 3.837 4.212 . 0 0 "[ . 1 . 2]" 1
1256 1 46 SER HB2 1 47 PHE H . . 3.880 3.075 2.831 3.919 0.039 18 0 "[ . 1 . 2]" 1
1257 1 46 SER HB2 1 98 LYS HB2 . . 4.170 3.793 3.274 3.998 . 0 0 "[ . 1 . 2]" 1
1258 1 46 SER HB2 1 98 LYS HB3 . . 5.150 5.079 4.208 5.187 0.037 9 0 "[ . 1 . 2]" 1
1259 1 46 SER HB2 1 98 LYS HG3 . . 4.620 2.760 2.439 3.759 . 0 0 "[ . 1 . 2]" 1
1260 1 46 SER HB3 1 47 PHE H . . 3.880 3.780 3.017 3.895 0.015 7 0 "[ . 1 . 2]" 1
1261 1 46 SER HB3 1 98 LYS HB2 . . 4.170 3.973 2.673 4.193 0.023 14 0 "[ . 1 . 2]" 1
1262 1 46 SER HB3 1 98 LYS HB3 . . 5.150 4.792 3.809 5.186 0.036 18 0 "[ . 1 . 2]" 1
1263 1 46 SER HB3 1 98 LYS HG3 . . 4.620 2.634 1.999 3.883 . 0 0 "[ . 1 . 2]" 1
1264 1 47 PHE H 1 47 PHE HB2 . . 3.590 2.995 2.899 3.067 . 0 0 "[ . 1 . 2]" 1
1265 1 47 PHE H 1 47 PHE HB3 . . 2.980 2.204 2.188 2.256 . 0 0 "[ . 1 . 2]" 1
1266 1 47 PHE H 1 47 PHE QD . . 4.200 4.095 4.071 4.134 . 0 0 "[ . 1 . 2]" 1
1267 1 47 PHE H 1 48 ALA H . . 3.360 2.677 2.586 2.780 . 0 0 "[ . 1 . 2]" 1
1268 1 47 PHE H 1 48 ALA MB . . 4.730 4.169 4.063 4.277 . 0 0 "[ . 1 . 2]" 1
1269 1 47 PHE H 1 98 LYS HA . . 5.360 4.857 4.263 5.040 . 0 0 "[ . 1 . 2]" 1
1270 1 47 PHE H 1 98 LYS QD . . 4.820 4.684 4.321 4.838 0.018 8 0 "[ . 1 . 2]" 1
1271 1 47 PHE H 1 98 LYS HG2 . . 5.190 4.766 4.534 4.975 . 0 0 "[ . 1 . 2]" 1
1272 1 47 PHE H 1 98 LYS HG3 . . 4.320 3.563 3.178 3.740 . 0 0 "[ . 1 . 2]" 1
1273 1 47 PHE HA 1 47 PHE QD . . 3.800 2.389 2.278 2.438 . 0 0 "[ . 1 . 2]" 1
1274 1 47 PHE HA 1 49 GLU H . . 4.700 3.720 3.616 3.953 . 0 0 "[ . 1 . 2]" 1
1275 1 47 PHE HA 1 50 TRP HD1 . . 4.020 4.005 3.849 4.053 0.033 14 0 "[ . 1 . 2]" 1
1276 1 47 PHE HA 1 50 TRP HZ2 . . 5.010 3.255 3.010 3.414 . 0 0 "[ . 1 . 2]" 1
1277 1 47 PHE HA 1 98 LYS HA . . 4.650 3.933 3.671 4.215 . 0 0 "[ . 1 . 2]" 1
1278 1 47 PHE HA 1 98 LYS QD . . 4.470 4.036 3.695 4.248 . 0 0 "[ . 1 . 2]" 1
1279 1 47 PHE HA 1 98 LYS QE . . 5.340 4.443 4.057 4.900 . 0 0 "[ . 1 . 2]" 1
1280 1 47 PHE HA 1 98 LYS HG2 . . 4.270 3.109 2.805 3.513 . 0 0 "[ . 1 . 2]" 1
1281 1 47 PHE HA 1 98 LYS HG3 . . 4.040 3.095 2.696 3.267 . 0 0 "[ . 1 . 2]" 1
1282 1 47 PHE HA 1 101 PHE HB2 . . 5.500 4.621 4.335 4.738 . 0 0 "[ . 1 . 2]" 1
1283 1 47 PHE HA 1 102 ILE MD . . 4.460 3.973 3.753 4.042 . 0 0 "[ . 1 . 2]" 1
1284 1 47 PHE HB2 1 48 ALA H . . 4.230 3.852 3.797 3.913 . 0 0 "[ . 1 . 2]" 1
1285 1 47 PHE HB2 1 98 LYS HA . . 3.830 2.999 2.910 3.069 . 0 0 "[ . 1 . 2]" 1
1286 1 47 PHE HB2 1 98 LYS QD . . 5.340 5.148 4.878 5.346 0.006 17 0 "[ . 1 . 2]" 1
1287 1 47 PHE HB2 1 98 LYS HG2 . . 4.570 3.842 3.457 4.492 . 0 0 "[ . 1 . 2]" 1
1288 1 47 PHE HB2 1 98 LYS HG3 . . 4.050 3.572 3.292 3.811 . 0 0 "[ . 1 . 2]" 1
1289 1 47 PHE HB2 1 101 PHE QD . . 3.910 2.351 1.985 3.096 . 0 0 "[ . 1 . 2]" 1
1290 1 47 PHE HB2 1 102 ILE MD . . 4.750 4.531 4.377 4.662 . 0 0 "[ . 1 . 2]" 1
1291 1 47 PHE HB3 1 48 ALA H . . 3.460 2.495 2.393 2.564 . 0 0 "[ . 1 . 2]" 1
1292 1 47 PHE HB3 1 48 ALA MB . . 4.420 4.122 3.964 4.189 . 0 0 "[ . 1 . 2]" 1
1293 1 47 PHE HB3 1 49 GLU H . . 4.830 4.681 4.582 4.760 . 0 0 "[ . 1 . 2]" 1
1294 1 47 PHE HB3 1 58 ILE MG . . 4.760 4.359 4.096 4.634 . 0 0 "[ . 1 . 2]" 1
1295 1 47 PHE HB3 1 98 LYS HA . . 4.560 4.547 4.385 4.584 0.024 4 0 "[ . 1 . 2]" 1
1296 1 47 PHE QD 1 48 ALA H . . 4.640 3.449 3.361 3.549 . 0 0 "[ . 1 . 2]" 1
1297 1 47 PHE QD 1 58 ILE MD . . 4.320 4.153 4.015 4.269 . 0 0 "[ . 1 . 2]" 1
1298 1 47 PHE QD 1 58 ILE MG . . 4.270 3.163 2.862 3.449 . 0 0 "[ . 1 . 2]" 1
1299 1 47 PHE QD 1 102 ILE MD . . 4.680 4.131 4.051 4.188 . 0 0 "[ . 1 . 2]" 1
1300 1 47 PHE QD 1 102 ILE HG13 . . 4.540 4.485 4.425 4.556 0.016 4 0 "[ . 1 . 2]" 1
1301 1 47 PHE QE 1 50 TRP HZ3 . . 4.460 2.292 2.236 2.411 . 0 0 "[ . 1 . 2]" 1
1302 1 47 PHE QE 1 51 GLY HA2 . . 4.150 2.284 2.000 2.423 . 0 0 "[ . 1 . 2]" 1
1303 1 47 PHE QE 1 54 LEU MD1 . . 4.010 3.867 3.730 3.954 . 0 0 "[ . 1 . 2]" 1
1304 1 47 PHE QE 1 56 VAL MG1 . . 4.400 2.784 2.575 2.906 . 0 0 "[ . 1 . 2]" 1
1305 1 47 PHE QE 1 56 VAL MG2 . . 4.780 4.448 4.264 4.586 . 0 0 "[ . 1 . 2]" 1
1306 1 47 PHE QE 1 58 ILE MD . . 3.710 3.193 3.038 3.360 . 0 0 "[ . 1 . 2]" 1
1307 1 47 PHE QE 1 58 ILE HG12 . . 4.730 2.843 2.619 3.078 . 0 0 "[ . 1 . 2]" 1
1308 1 47 PHE QE 1 58 ILE MG . . 4.120 2.692 2.328 3.092 . 0 0 "[ . 1 . 2]" 1
1309 1 47 PHE QE 1 101 PHE HB3 . . 4.780 3.811 3.614 3.954 . 0 0 "[ . 1 . 2]" 1
1310 1 47 PHE QE 1 102 ILE H . . 5.500 5.538 5.515 5.608 0.108 18 0 "[ . 1 . 2]" 1
1311 1 47 PHE QE 1 102 ILE MD . . 5.420 5.290 5.180 5.370 . 0 0 "[ . 1 . 2]" 1
1312 1 47 PHE QE 1 102 ILE HG13 . . 5.090 5.080 5.012 5.115 0.025 10 0 "[ . 1 . 2]" 1
1313 1 47 PHE QE 1 105 ILE MD . . 5.300 3.922 3.593 4.168 . 0 0 "[ . 1 . 2]" 1
1314 1 47 PHE QE 1 105 ILE HG12 . . 5.060 4.330 4.052 4.453 . 0 0 "[ . 1 . 2]" 1
1315 1 47 PHE QE 1 105 ILE QG . . 4.370 3.101 2.768 3.242 . 0 0 "[ . 1 . 2]" 1
1316 1 47 PHE QE 1 105 ILE HG13 . . 5.060 3.178 2.818 3.342 . 0 0 "[ . 1 . 2]" 1
1317 1 47 PHE QE 1 105 ILE MG . . 4.790 4.382 4.112 4.572 . 0 0 "[ . 1 . 2]" 1
1318 1 47 PHE HZ 1 54 LEU MD1 . . 5.500 5.506 5.342 5.569 0.069 19 0 "[ . 1 . 2]" 1
1319 1 47 PHE HZ 1 56 VAL MG1 . . 4.010 2.711 2.465 2.887 . 0 0 "[ . 1 . 2]" 1
1320 1 47 PHE HZ 1 56 VAL MG2 . . 4.430 3.719 3.447 3.911 . 0 0 "[ . 1 . 2]" 1
1321 1 47 PHE HZ 1 58 ILE MD . . 4.020 3.140 2.904 3.349 . 0 0 "[ . 1 . 2]" 1
1322 1 47 PHE HZ 1 101 PHE HB3 . . 4.920 4.501 4.176 4.710 . 0 0 "[ . 1 . 2]" 1
1323 1 47 PHE HZ 1 105 ILE MD . . 3.970 3.229 2.831 3.526 . 0 0 "[ . 1 . 2]" 1
1324 1 47 PHE HZ 1 105 ILE HG12 . . 4.570 4.494 4.273 4.583 0.013 16 0 "[ . 1 . 2]" 1
1325 1 47 PHE HZ 1 105 ILE QG . . 3.850 3.383 3.203 3.513 . 0 0 "[ . 1 . 2]" 1
1326 1 47 PHE HZ 1 105 ILE HG13 . . 4.570 3.498 3.309 3.649 . 0 0 "[ . 1 . 2]" 1
1327 1 47 PHE HZ 1 105 ILE MG . . 5.090 4.741 4.481 4.920 . 0 0 "[ . 1 . 2]" 1
1328 1 48 ALA H 1 48 ALA MB . . 2.850 2.134 2.037 2.239 . 0 0 "[ . 1 . 2]" 1
1329 1 48 ALA H 1 49 GLU H . . 3.480 2.810 2.760 2.861 . 0 0 "[ . 1 . 2]" 1
1330 1 48 ALA H 1 58 ILE MD . . 4.420 4.396 4.338 4.427 0.007 12 0 "[ . 1 . 2]" 1
1331 1 48 ALA H 1 58 ILE MG . . 4.150 3.703 3.511 4.038 . 0 0 "[ . 1 . 2]" 1
1332 1 48 ALA HA 1 50 TRP H . . 4.670 4.624 4.506 4.684 0.014 18 0 "[ . 1 . 2]" 1
1333 1 48 ALA HA 1 51 GLY H . . 4.010 3.158 3.054 3.270 . 0 0 "[ . 1 . 2]" 1
1334 1 48 ALA HA 1 58 ILE HB . . 3.840 3.336 3.140 3.616 . 0 0 "[ . 1 . 2]" 1
1335 1 48 ALA HA 1 58 ILE MD . . 2.860 1.992 1.971 2.054 . 0 0 "[ . 1 . 2]" 1
1336 1 48 ALA HA 1 58 ILE HG12 . . 4.330 2.535 2.324 2.821 . 0 0 "[ . 1 . 2]" 1
1337 1 48 ALA HA 1 58 ILE HG13 . . 4.360 4.068 3.889 4.292 . 0 0 "[ . 1 . 2]" 1
1338 1 48 ALA HA 1 58 ILE MG . . 3.750 3.412 3.237 3.716 . 0 0 "[ . 1 . 2]" 1
1339 1 48 ALA MB 1 49 GLU H . . 3.500 2.979 2.789 3.080 . 0 0 "[ . 1 . 2]" 1
1340 1 48 ALA MB 1 49 GLU HA . . 4.490 3.867 3.751 3.955 . 0 0 "[ . 1 . 2]" 1
1341 1 48 ALA MB 1 50 TRP H . . 5.200 5.023 4.949 5.081 . 0 0 "[ . 1 . 2]" 1
1342 1 48 ALA MB 1 51 GLY H . . 4.930 4.349 4.220 4.499 . 0 0 "[ . 1 . 2]" 1
1343 1 48 ALA MB 1 58 ILE H . . 5.350 4.588 4.501 4.830 . 0 0 "[ . 1 . 2]" 1
1344 1 48 ALA MB 1 58 ILE HB . . 3.390 2.487 2.238 2.764 . 0 0 "[ . 1 . 2]" 1
1345 1 48 ALA MB 1 58 ILE MD . . 3.450 2.892 2.730 2.985 . 0 0 "[ . 1 . 2]" 1
1346 1 48 ALA MB 1 58 ILE HG12 . . 4.320 3.164 2.906 3.497 . 0 0 "[ . 1 . 2]" 1
1347 1 48 ALA MB 1 58 ILE MG . . 3.010 2.443 2.051 2.748 . 0 0 "[ . 1 . 2]" 1
1348 1 49 GLU H 1 49 GLU HB2 . . 3.080 2.431 2.280 2.559 . 0 0 "[ . 1 . 2]" 1
1349 1 49 GLU H 1 49 GLU HB3 . . 3.680 3.578 3.543 3.596 . 0 0 "[ . 1 . 2]" 1
1350 1 49 GLU H 1 49 GLU HG2 . . 3.510 3.107 2.628 3.521 0.011 10 0 "[ . 1 . 2]" 1
1351 1 49 GLU H 1 49 GLU QG . . 2.980 2.354 2.107 2.638 . 0 0 "[ . 1 . 2]" 1
1352 1 49 GLU H 1 49 GLU HG3 . . 3.510 2.618 2.136 3.513 0.003 12 0 "[ . 1 . 2]" 1
1353 1 49 GLU H 1 50 TRP H . . 3.320 2.957 2.865 3.069 . 0 0 "[ . 1 . 2]" 1
1354 1 49 GLU H 1 58 ILE MD . . 5.070 4.949 4.876 5.023 . 0 0 "[ . 1 . 2]" 1
1355 1 49 GLU HA 1 49 GLU HG2 . . 3.640 2.428 2.260 2.542 . 0 0 "[ . 1 . 2]" 1
1356 1 49 GLU HA 1 49 GLU QG . . 2.880 2.363 2.210 2.457 . 0 0 "[ . 1 . 2]" 1
1357 1 49 GLU HA 1 49 GLU HG3 . . 3.640 3.297 2.929 3.667 0.027 8 0 "[ . 1 . 2]" 1
1358 1 49 GLU HA 1 50 TRP HA . . 4.730 4.606 4.596 4.615 . 0 0 "[ . 1 . 2]" 1
1359 1 49 GLU HA 1 51 GLY H . . 4.540 4.254 4.029 4.461 . 0 0 "[ . 1 . 2]" 1
1360 1 49 GLU HB2 1 50 TRP H . . 4.340 2.290 2.182 2.403 . 0 0 "[ . 1 . 2]" 1
1361 1 49 GLU HB2 1 50 TRP HD1 . . 3.730 3.393 3.152 3.638 . 0 0 "[ . 1 . 2]" 1
1362 1 49 GLU HB2 1 50 TRP HE1 . . 4.910 4.764 4.508 4.911 0.001 6 0 "[ . 1 . 2]" 1
1363 1 49 GLU HB3 1 50 TRP H . . 4.090 3.141 2.941 3.311 . 0 0 "[ . 1 . 2]" 1
1364 1 49 GLU HB3 1 50 TRP HB3 . . 5.020 4.357 4.148 4.553 . 0 0 "[ . 1 . 2]" 1
1365 1 49 GLU HB3 1 50 TRP HD1 . . 4.710 4.326 4.052 4.488 . 0 0 "[ . 1 . 2]" 1
1366 1 50 TRP H 1 50 TRP HB2 . . 3.710 3.614 3.601 3.627 . 0 0 "[ . 1 . 2]" 1
1367 1 50 TRP H 1 50 TRP HB3 . . 3.290 2.906 2.869 2.994 . 0 0 "[ . 1 . 2]" 1
1368 1 50 TRP H 1 50 TRP HD1 . . 3.550 2.937 2.827 3.013 . 0 0 "[ . 1 . 2]" 1
1369 1 50 TRP H 1 51 GLY H . . 3.330 2.321 2.233 2.417 . 0 0 "[ . 1 . 2]" 1
1370 1 50 TRP H 1 51 GLY HA2 . . 5.390 4.721 4.647 4.777 . 0 0 "[ . 1 . 2]" 1
1371 1 50 TRP H 1 54 LEU MD1 . . 5.500 5.533 5.517 5.567 0.067 18 0 "[ . 1 . 2]" 1
1372 1 50 TRP H 1 58 ILE MD . . 5.350 5.301 5.201 5.361 0.011 13 0 "[ . 1 . 2]" 1
1373 1 50 TRP HA 1 50 TRP HD1 . . 4.630 4.501 4.389 4.547 . 0 0 "[ . 1 . 2]" 1
1374 1 50 TRP HA 1 50 TRP HE3 . . 4.560 4.139 4.072 4.289 . 0 0 "[ . 1 . 2]" 1
1375 1 50 TRP HA 1 54 LEU MD1 . . 5.500 5.241 5.197 5.302 . 0 0 "[ . 1 . 2]" 1
1376 1 50 TRP HB2 1 50 TRP HE3 . . 3.520 2.773 2.688 2.816 . 0 0 "[ . 1 . 2]" 1
1377 1 50 TRP HB2 1 53 ASP QB . . 4.870 2.933 2.714 3.098 . 0 0 "[ . 1 . 2]" 1
1378 1 50 TRP HB2 1 54 LEU H . . 4.500 4.383 4.190 4.489 . 0 0 "[ . 1 . 2]" 1
1379 1 50 TRP HB2 1 54 LEU MD1 . . 3.730 3.400 3.322 3.482 . 0 0 "[ . 1 . 2]" 1
1380 1 50 TRP HB2 1 54 LEU MD2 . . 4.460 3.842 3.688 4.003 . 0 0 "[ . 1 . 2]" 1
1381 1 50 TRP HB2 1 54 LEU HG . . 4.120 3.119 2.881 3.319 . 0 0 "[ . 1 . 2]" 1
1382 1 50 TRP HB2 1 102 ILE MD . . 5.500 5.085 4.774 5.212 . 0 0 "[ . 1 . 2]" 1
1383 1 50 TRP HB3 1 50 TRP HD1 . . 3.640 2.576 2.564 2.603 . 0 0 "[ . 1 . 2]" 1
1384 1 50 TRP HB3 1 54 LEU MD1 . . 4.860 4.779 4.667 4.875 0.015 3 0 "[ . 1 . 2]" 1
1385 1 50 TRP HB3 1 54 LEU MD2 . . 5.500 5.203 5.032 5.389 . 0 0 "[ . 1 . 2]" 1
1386 1 50 TRP HB3 1 54 LEU HG . . 5.490 4.875 4.641 5.073 . 0 0 "[ . 1 . 2]" 1
1387 1 50 TRP HB3 1 98 LYS QE . . 5.340 5.319 5.206 5.393 0.053 9 0 "[ . 1 . 2]" 1
1388 1 50 TRP HB3 1 102 ILE MD . . 5.290 5.127 4.720 5.299 0.009 3 0 "[ . 1 . 2]" 1
1389 1 50 TRP HB3 1 102 ILE HG13 . . 5.440 5.279 5.039 5.444 0.004 20 0 "[ . 1 . 2]" 1
1390 1 50 TRP HD1 1 98 LYS QD . . 4.390 3.797 3.425 4.131 . 0 0 "[ . 1 . 2]" 1
1391 1 50 TRP HD1 1 98 LYS QE . . 4.480 3.103 2.983 3.376 . 0 0 "[ . 1 . 2]" 1
1392 1 50 TRP HD1 1 102 ILE MD . . 3.940 3.725 3.249 3.913 . 0 0 "[ . 1 . 2]" 1
1393 1 50 TRP HE1 1 98 LYS QD . . 4.240 3.221 2.801 3.538 . 0 0 "[ . 1 . 2]" 1
1394 1 50 TRP HE1 1 98 LYS QE . . 4.400 2.425 1.891 3.067 . 0 0 "[ . 1 . 2]" 1
1395 1 50 TRP HE1 1 102 ILE MD . . 4.000 2.155 2.011 2.297 . 0 0 "[ . 1 . 2]" 1
1396 1 50 TRP HE1 1 102 ILE HG13 . . 4.880 3.593 3.548 3.665 . 0 0 "[ . 1 . 2]" 1
1397 1 50 TRP HE1 1 102 ILE MG . . 5.500 5.506 5.448 5.533 0.033 10 0 "[ . 1 . 2]" 1
1398 1 50 TRP HE3 1 51 GLY HA2 . . 4.820 2.419 2.180 2.736 . 0 0 "[ . 1 . 2]" 1
1399 1 50 TRP HE3 1 53 ASP HB2 . . 4.900 4.465 4.143 4.905 0.005 16 0 "[ . 1 . 2]" 1
1400 1 50 TRP HE3 1 53 ASP QB . . 4.030 3.903 3.789 3.975 . 0 0 "[ . 1 . 2]" 1
1401 1 50 TRP HE3 1 53 ASP HB3 . . 4.900 4.536 3.978 4.967 0.067 17 0 "[ . 1 . 2]" 1
1402 1 50 TRP HE3 1 54 LEU QB . . 5.080 3.177 2.837 3.485 . 0 0 "[ . 1 . 2]" 1
1403 1 50 TRP HE3 1 54 LEU MD1 . . 4.140 2.107 2.005 2.175 . 0 0 "[ . 1 . 2]" 1
1404 1 50 TRP HE3 1 54 LEU MD2 . . 4.030 3.805 3.719 3.894 . 0 0 "[ . 1 . 2]" 1
1405 1 50 TRP HE3 1 54 LEU HG . . 4.130 2.301 2.139 2.443 . 0 0 "[ . 1 . 2]" 1
1406 1 50 TRP HE3 1 56 VAL MG1 . . 4.580 3.956 3.863 4.044 . 0 0 "[ . 1 . 2]" 1
1407 1 50 TRP HE3 1 102 ILE MD . . 5.050 4.941 4.787 5.023 . 0 0 "[ . 1 . 2]" 1
1408 1 50 TRP HE3 1 102 ILE HG13 . . 5.190 3.849 3.701 3.960 . 0 0 "[ . 1 . 2]" 1
1409 1 50 TRP HE3 1 102 ILE MG . . 5.150 4.812 4.639 4.941 . 0 0 "[ . 1 . 2]" 1
1410 1 50 TRP HH2 1 102 ILE MG . . 4.830 4.706 4.644 4.797 . 0 0 "[ . 1 . 2]" 1
1411 1 50 TRP HH2 1 105 ILE HB . . 4.840 3.998 3.753 4.198 . 0 0 "[ . 1 . 2]" 1
1412 1 50 TRP HH2 1 105 ILE MD . . 4.380 4.253 3.994 4.406 0.026 10 0 "[ . 1 . 2]" 1
1413 1 50 TRP HH2 1 105 ILE MG . . 4.860 4.681 4.538 4.863 0.003 10 0 "[ . 1 . 2]" 1
1414 1 50 TRP HZ2 1 98 LYS QE . . 5.340 4.526 3.951 5.178 . 0 0 "[ . 1 . 2]" 1
1415 1 50 TRP HZ2 1 102 ILE MD . . 4.000 2.004 1.947 2.067 . 0 0 "[ . 1 . 2]" 1
1416 1 50 TRP HZ2 1 102 ILE MG . . 5.100 4.955 4.905 4.992 . 0 0 "[ . 1 . 2]" 1
1417 1 50 TRP HZ3 1 54 LEU MD2 . . 4.780 4.643 4.614 4.672 . 0 0 "[ . 1 . 2]" 1
1418 1 50 TRP HZ3 1 56 VAL MG1 . . 4.680 3.037 2.929 3.207 . 0 0 "[ . 1 . 2]" 1
1419 1 50 TRP HZ3 1 102 ILE MG . . 5.500 4.625 4.538 4.739 . 0 0 "[ . 1 . 2]" 1
1420 1 50 TRP HZ3 1 105 ILE MG . . 4.530 3.262 3.042 3.438 . 0 0 "[ . 1 . 2]" 1
1421 1 51 GLY H 1 52 GLU H . . 3.750 3.277 3.150 3.381 . 0 0 "[ . 1 . 2]" 1
1422 1 51 GLY H 1 52 GLU QB . . 5.500 5.307 5.178 5.493 . 0 0 "[ . 1 . 2]" 1
1423 1 51 GLY H 1 54 LEU HG . . 5.500 5.213 5.070 5.443 . 0 0 "[ . 1 . 2]" 1
1424 1 51 GLY H 1 56 VAL MG1 . . 5.150 4.460 4.329 4.525 . 0 0 "[ . 1 . 2]" 1
1425 1 51 GLY H 1 58 ILE MD . . 3.520 3.459 3.398 3.525 0.005 18 0 "[ . 1 . 2]" 1
1426 1 51 GLY HA2 1 53 ASP H . . 5.500 4.163 3.989 4.289 . 0 0 "[ . 1 . 2]" 1
1427 1 51 GLY HA2 1 54 LEU H . . 4.500 3.637 3.546 3.722 . 0 0 "[ . 1 . 2]" 1
1428 1 51 GLY HA2 1 54 LEU QB . . 4.160 3.533 3.258 3.794 . 0 0 "[ . 1 . 2]" 1
1429 1 51 GLY HA2 1 54 LEU MD1 . . 4.430 3.544 3.224 3.969 . 0 0 "[ . 1 . 2]" 1
1430 1 51 GLY HA2 1 54 LEU HG . . 4.850 4.038 3.850 4.412 . 0 0 "[ . 1 . 2]" 1
1431 1 51 GLY HA2 1 56 VAL H . . 5.080 4.778 4.478 4.981 . 0 0 "[ . 1 . 2]" 1
1432 1 51 GLY HA2 1 56 VAL HB . . 4.890 4.668 4.480 4.766 . 0 0 "[ . 1 . 2]" 1
1433 1 51 GLY HA2 1 56 VAL MG1 . . 3.470 2.406 2.277 2.509 . 0 0 "[ . 1 . 2]" 1
1434 1 51 GLY HA2 1 56 VAL MG2 . . 4.960 4.912 4.744 4.969 0.009 6 0 "[ . 1 . 2]" 1
1435 1 51 GLY HA2 1 58 ILE MD . . 3.300 2.917 2.581 3.143 . 0 0 "[ . 1 . 2]" 1
1436 1 51 GLY HA2 1 105 ILE MG . . 5.140 4.422 4.204 4.726 . 0 0 "[ . 1 . 2]" 1
1437 1 51 GLY HA3 1 56 VAL MG1 . . 3.940 2.781 2.684 2.907 . 0 0 "[ . 1 . 2]" 1
1438 1 51 GLY HA3 1 56 VAL MG2 . . 5.500 5.226 5.129 5.365 . 0 0 "[ . 1 . 2]" 1
1439 1 51 GLY HA3 1 58 ILE MD . . 3.310 1.824 1.767 1.900 . 0 0 "[ . 1 . 2]" 1
1440 1 52 GLU H 1 52 GLU QB . . 2.980 2.340 2.266 2.441 . 0 0 "[ . 1 . 2]" 1
1441 1 52 GLU H 1 52 GLU QG . . 3.280 2.550 2.250 3.282 0.002 1 0 "[ . 1 . 2]" 1
1442 1 52 GLU H 1 53 ASP H . . 3.770 2.773 2.682 2.845 . 0 0 "[ . 1 . 2]" 1
1443 1 52 GLU HA 1 52 GLU QB . . 2.750 2.177 2.171 2.180 . 0 0 "[ . 1 . 2]" 1
1444 1 52 GLU HA 1 58 ILE MD . . 5.440 3.721 3.476 4.018 . 0 0 "[ . 1 . 2]" 1
1445 1 52 GLU QB 1 53 ASP H . . 3.600 3.539 3.463 3.622 0.022 9 0 "[ . 1 . 2]" 1
1446 1 52 GLU QB 1 53 ASP HA . . 4.800 4.497 4.414 4.595 . 0 0 "[ . 1 . 2]" 1
1447 1 52 GLU QG 1 53 ASP H . . 3.980 2.266 2.057 2.685 . 0 0 "[ . 1 . 2]" 1
1448 1 52 GLU QG 1 53 ASP HA . . 3.770 3.270 2.982 3.747 . 0 0 "[ . 1 . 2]" 1
1449 1 52 GLU HG2 1 53 ASP H . . 4.560 2.933 2.220 3.925 . 0 0 "[ . 1 . 2]" 1
1450 1 52 GLU HG3 1 53 ASP H . . 4.560 2.700 2.065 4.214 . 0 0 "[ . 1 . 2]" 1
1451 1 53 ASP H 1 53 ASP HB2 . . 3.530 2.174 2.140 2.239 . 0 0 "[ . 1 . 2]" 1
1452 1 53 ASP H 1 53 ASP QB . . 2.930 2.135 2.120 2.167 . 0 0 "[ . 1 . 2]" 1
1453 1 53 ASP H 1 53 ASP HB3 . . 3.530 3.216 2.885 3.470 . 0 0 "[ . 1 . 2]" 1
1454 1 53 ASP H 1 54 LEU H . . 3.140 2.674 2.587 2.781 . 0 0 "[ . 1 . 2]" 1
1455 1 53 ASP H 1 54 LEU QB . . 5.090 4.816 4.642 4.985 . 0 0 "[ . 1 . 2]" 1
1456 1 53 ASP H 1 54 LEU MD1 . . 5.500 5.407 5.128 5.539 0.039 7 0 "[ . 1 . 2]" 1
1457 1 53 ASP H 1 58 ILE MD . . 5.500 4.811 4.625 5.093 . 0 0 "[ . 1 . 2]" 1
1458 1 53 ASP QB 1 54 LEU MD2 . . 4.020 3.202 3.075 3.377 . 0 0 "[ . 1 . 2]" 1
1459 1 53 ASP QB 1 54 LEU HG . . 3.910 3.044 2.746 3.275 . 0 0 "[ . 1 . 2]" 1
1460 1 53 ASP HB2 1 54 LEU H . . 3.890 3.255 2.898 3.623 . 0 0 "[ . 1 . 2]" 1
1461 1 53 ASP HB2 1 54 LEU MD2 . . 4.760 4.476 4.079 4.774 0.014 3 0 "[ . 1 . 2]" 1
1462 1 53 ASP HB2 1 54 LEU HG . . 4.470 3.964 3.551 4.427 . 0 0 "[ . 1 . 2]" 1
1463 1 53 ASP HB3 1 54 LEU H . . 3.890 3.032 2.671 3.407 . 0 0 "[ . 1 . 2]" 1
1464 1 53 ASP HB3 1 54 LEU MD2 . . 4.760 3.291 3.132 3.512 . 0 0 "[ . 1 . 2]" 1
1465 1 53 ASP HB3 1 54 LEU HG . . 4.470 3.266 2.779 3.649 . 0 0 "[ . 1 . 2]" 1
1466 1 54 LEU H 1 54 LEU QB . . 3.220 2.469 2.377 2.558 . 0 0 "[ . 1 . 2]" 1
1467 1 54 LEU H 1 54 LEU MD1 . . 3.960 3.696 3.500 3.853 . 0 0 "[ . 1 . 2]" 1
1468 1 54 LEU H 1 54 LEU MD2 . . 3.950 3.458 3.339 3.578 . 0 0 "[ . 1 . 2]" 1
1469 1 54 LEU H 1 54 LEU HG . . 3.480 2.421 2.218 2.678 . 0 0 "[ . 1 . 2]" 1
1470 1 54 LEU H 1 105 ILE MG . . 5.200 4.662 4.403 4.922 . 0 0 "[ . 1 . 2]" 1
1471 1 54 LEU HA 1 54 LEU MD1 . . 4.050 3.900 3.849 3.964 . 0 0 "[ . 1 . 2]" 1
1472 1 54 LEU HA 1 54 LEU MD2 . . 2.830 2.261 2.073 2.433 . 0 0 "[ . 1 . 2]" 1
1473 1 54 LEU HA 1 54 LEU HG . . 3.800 3.160 3.111 3.217 . 0 0 "[ . 1 . 2]" 1
1474 1 54 LEU HA 1 55 GLU HA . . 5.290 4.969 4.933 5.022 . 0 0 "[ . 1 . 2]" 1
1475 1 54 LEU HA 1 105 ILE MG . . 4.690 4.414 4.263 4.575 . 0 0 "[ . 1 . 2]" 1
1476 1 54 LEU QB 1 54 LEU MD1 . . 3.130 2.049 2.023 2.069 . 0 0 "[ . 1 . 2]" 1
1477 1 54 LEU QB 1 54 LEU MD2 . . 3.030 2.208 2.107 2.301 . 0 0 "[ . 1 . 2]" 1
1478 1 54 LEU QB 1 55 GLU H . . 3.720 3.646 3.506 3.722 0.002 18 0 "[ . 1 . 2]" 1
1479 1 54 LEU QB 1 56 VAL MG1 . . 3.650 3.049 2.882 3.162 . 0 0 "[ . 1 . 2]" 1
1480 1 54 LEU QB 1 105 ILE MG . . 2.960 2.159 1.934 2.365 . 0 0 "[ . 1 . 2]" 1
1481 1 54 LEU MD1 1 102 ILE HA . . 3.760 2.581 2.447 2.726 . 0 0 "[ . 1 . 2]" 1
1482 1 54 LEU MD1 1 102 ILE MD . . 4.290 4.088 3.982 4.195 . 0 0 "[ . 1 . 2]" 1
1483 1 54 LEU MD1 1 102 ILE HG12 . . 4.070 3.483 3.274 3.704 . 0 0 "[ . 1 . 2]" 1
1484 1 54 LEU MD1 1 102 ILE MG . . 3.340 2.475 2.310 2.725 . 0 0 "[ . 1 . 2]" 1
1485 1 54 LEU MD1 1 105 ILE HB . . 3.690 2.489 2.243 2.697 . 0 0 "[ . 1 . 2]" 1
1486 1 54 LEU MD1 1 105 ILE QG . . 4.860 3.142 2.911 3.298 . 0 0 "[ . 1 . 2]" 1
1487 1 54 LEU MD1 1 105 ILE MG . . 3.370 2.515 2.197 2.795 . 0 0 "[ . 1 . 2]" 1
1488 1 54 LEU MD2 1 55 GLU H . . 4.980 4.670 4.557 4.783 . 0 0 "[ . 1 . 2]" 1
1489 1 54 LEU MD2 1 102 ILE HA . . 4.800 4.684 4.563 4.792 . 0 0 "[ . 1 . 2]" 1
1490 1 54 LEU MD2 1 102 ILE MD . . 5.500 5.520 5.467 5.541 0.041 18 0 "[ . 1 . 2]" 1
1491 1 54 LEU MD2 1 102 ILE MG . . 3.390 3.296 3.001 3.408 0.018 4 0 "[ . 1 . 2]" 1
1492 1 54 LEU MD2 1 105 ILE HB . . 4.660 4.603 4.350 4.684 0.024 14 0 "[ . 1 . 2]" 1
1493 1 54 LEU MD2 1 105 ILE MG . . 3.880 3.811 3.675 3.884 0.004 20 0 "[ . 1 . 2]" 1
1494 1 54 LEU MD2 1 106 SER H . . 4.790 4.537 4.307 4.795 0.005 7 0 "[ . 1 . 2]" 1
1495 1 54 LEU MD2 1 106 SER HB2 . . 4.650 3.588 2.974 4.627 . 0 0 "[ . 1 . 2]" 1
1496 1 54 LEU MD2 1 106 SER QB . . 3.850 3.266 2.827 3.857 0.007 8 0 "[ . 1 . 2]" 1
1497 1 54 LEU MD2 1 106 SER HB3 . . 4.650 4.286 2.884 4.665 0.015 3 0 "[ . 1 . 2]" 1
1498 1 55 GLU H 1 55 GLU HA . . 2.920 2.276 2.274 2.280 . 0 0 "[ . 1 . 2]" 1
1499 1 55 GLU H 1 55 GLU QB . . 3.370 3.108 2.916 3.368 . 0 0 "[ . 1 . 2]" 1
1500 1 55 GLU HA 1 56 VAL H . . 3.490 2.615 2.614 2.622 . 0 0 "[ . 1 . 2]" 1
1501 1 55 GLU HA 1 56 VAL MG1 . . 5.090 4.870 4.838 4.915 . 0 0 "[ . 1 . 2]" 1
1502 1 55 GLU HA 1 56 VAL MG2 . . 5.500 5.526 5.508 5.544 0.044 14 0 "[ . 1 . 2]" 1
1503 1 56 VAL H 1 56 VAL HB . . 3.610 3.089 3.032 3.132 . 0 0 "[ . 1 . 2]" 1
1504 1 56 VAL H 1 56 VAL MG1 . . 3.270 2.629 2.590 2.667 . 0 0 "[ . 1 . 2]" 1
1505 1 56 VAL H 1 56 VAL MG2 . . 4.040 4.016 4.001 4.028 . 0 0 "[ . 1 . 2]" 1
1506 1 56 VAL H 1 57 ASN H . . 4.700 4.213 4.136 4.314 . 0 0 "[ . 1 . 2]" 1
1507 1 56 VAL H 1 105 ILE MG . . 5.500 4.708 4.572 4.851 . 0 0 "[ . 1 . 2]" 1
1508 1 56 VAL HA 1 56 VAL MG1 . . 3.640 3.155 3.143 3.162 . 0 0 "[ . 1 . 2]" 1
1509 1 56 VAL HA 1 56 VAL MG2 . . 3.290 2.071 2.026 2.117 . 0 0 "[ . 1 . 2]" 1
1510 1 56 VAL HA 1 57 ASN H . . 2.880 2.171 2.145 2.228 . 0 0 "[ . 1 . 2]" 1
1511 1 56 VAL HA 1 57 ASN QD . . 5.240 4.012 3.464 4.539 . 0 0 "[ . 1 . 2]" 1
1512 1 56 VAL HB 1 57 ASN H . . 4.500 4.338 4.211 4.421 . 0 0 "[ . 1 . 2]" 1
1513 1 56 VAL HB 1 58 ILE MD . . 4.500 4.497 4.429 4.529 0.029 5 0 "[ . 1 . 2]" 1
1514 1 56 VAL HB 1 105 ILE MG . . 3.640 2.327 2.197 2.514 . 0 0 "[ . 1 . 2]" 1
1515 1 56 VAL MG1 1 57 ASN H . . 3.820 3.507 3.346 3.616 . 0 0 "[ . 1 . 2]" 1
1516 1 56 VAL MG1 1 57 ASN HA . . 4.330 3.824 3.745 3.900 . 0 0 "[ . 1 . 2]" 1
1517 1 56 VAL MG1 1 58 ILE H . . 4.910 4.493 4.233 4.638 . 0 0 "[ . 1 . 2]" 1
1518 1 56 VAL MG1 1 58 ILE MD . . 3.090 1.926 1.870 1.980 . 0 0 "[ . 1 . 2]" 1
1519 1 56 VAL MG1 1 58 ILE HG12 . . 4.110 3.697 3.569 3.847 . 0 0 "[ . 1 . 2]" 1
1520 1 56 VAL MG1 1 105 ILE MD . . 3.470 2.884 2.570 3.035 . 0 0 "[ . 1 . 2]" 1
1521 1 56 VAL MG1 1 105 ILE HG12 . . 4.490 4.195 4.007 4.410 . 0 0 "[ . 1 . 2]" 1
1522 1 56 VAL MG1 1 105 ILE QG . . 3.840 2.607 2.386 2.836 . 0 0 "[ . 1 . 2]" 1
1523 1 56 VAL MG1 1 105 ILE HG13 . . 4.490 2.633 2.404 2.871 . 0 0 "[ . 1 . 2]" 1
1524 1 56 VAL MG1 1 105 ILE MG . . 3.110 2.497 2.272 2.767 . 0 0 "[ . 1 . 2]" 1
1525 1 56 VAL MG2 1 57 ASN H . . 3.340 2.694 2.454 2.863 . 0 0 "[ . 1 . 2]" 1
1526 1 56 VAL MG2 1 57 ASN HA . . 4.850 4.485 4.355 4.584 . 0 0 "[ . 1 . 2]" 1
1527 1 56 VAL MG2 1 58 ILE H . . 5.410 5.329 5.127 5.426 0.016 18 0 "[ . 1 . 2]" 1
1528 1 56 VAL MG2 1 58 ILE HA . . 4.860 4.770 4.644 4.836 . 0 0 "[ . 1 . 2]" 1
1529 1 56 VAL MG2 1 58 ILE MD . . 3.850 3.638 3.542 3.684 . 0 0 "[ . 1 . 2]" 1
1530 1 56 VAL MG2 1 58 ILE HG12 . . 5.500 5.192 5.047 5.389 . 0 0 "[ . 1 . 2]" 1
1531 1 56 VAL MG2 1 83 HIS HD2 . . 4.530 3.610 3.280 4.040 . 0 0 "[ . 1 . 2]" 1
1532 1 56 VAL MG2 1 105 ILE HA . . 5.190 4.282 4.145 4.521 . 0 0 "[ . 1 . 2]" 1
1533 1 56 VAL MG2 1 105 ILE MD . . 2.980 2.001 1.910 2.178 . 0 0 "[ . 1 . 2]" 1
1534 1 56 VAL MG2 1 105 ILE QG . . 4.130 3.363 3.146 3.541 . 0 0 "[ . 1 . 2]" 1
1535 1 56 VAL MG2 1 105 ILE MG . . 3.670 2.467 2.329 2.668 . 0 0 "[ . 1 . 2]" 1
1536 1 57 ASN H 1 57 ASN HB2 . . 3.330 2.590 2.425 2.741 . 0 0 "[ . 1 . 2]" 1
1537 1 57 ASN H 1 57 ASN HB3 . . 3.750 3.647 3.626 3.690 . 0 0 "[ . 1 . 2]" 1
1538 1 57 ASN H 1 57 ASN HD21 . . 4.220 2.834 2.213 3.457 . 0 0 "[ . 1 . 2]" 1
1539 1 57 ASN H 1 57 ASN QD . . 3.600 2.731 2.183 3.197 . 0 0 "[ . 1 . 2]" 1
1540 1 57 ASN H 1 57 ASN HD22 . . 4.220 3.662 3.219 4.056 . 0 0 "[ . 1 . 2]" 1
1541 1 57 ASN H 1 58 ILE H . . 4.900 4.569 4.512 4.602 . 0 0 "[ . 1 . 2]" 1
1542 1 57 ASN HA 1 58 ILE H . . 2.750 2.234 2.169 2.280 . 0 0 "[ . 1 . 2]" 1
1543 1 57 ASN HA 1 58 ILE HB . . 4.680 4.574 4.532 4.648 . 0 0 "[ . 1 . 2]" 1
1544 1 57 ASN HA 1 58 ILE MD . . 4.400 2.638 2.551 2.749 . 0 0 "[ . 1 . 2]" 1
1545 1 57 ASN HA 1 58 ILE HG13 . . 4.820 4.485 4.370 4.686 . 0 0 "[ . 1 . 2]" 1
1546 1 57 ASN HB2 1 57 ASN HD22 . . 4.090 3.447 3.433 3.478 . 0 0 "[ . 1 . 2]" 1
1547 1 57 ASN HB2 1 58 ILE H . . 4.290 3.867 3.711 4.067 . 0 0 "[ . 1 . 2]" 1
1548 1 57 ASN HB3 1 58 ILE H . . 3.780 2.932 2.762 3.184 . 0 0 "[ . 1 . 2]" 1
1549 1 58 ILE H 1 58 ILE HB . . 3.100 2.681 2.556 2.745 . 0 0 "[ . 1 . 2]" 1
1550 1 58 ILE H 1 58 ILE MD . . 3.980 2.151 1.915 2.287 . 0 0 "[ . 1 . 2]" 1
1551 1 58 ILE H 1 58 ILE HG12 . . 4.490 4.376 4.204 4.462 . 0 0 "[ . 1 . 2]" 1
1552 1 58 ILE H 1 58 ILE HG13 . . 3.710 3.623 3.434 3.707 . 0 0 "[ . 1 . 2]" 1
1553 1 58 ILE H 1 58 ILE MG . . 4.010 3.864 3.809 3.895 . 0 0 "[ . 1 . 2]" 1
1554 1 58 ILE H 1 59 ALA H . . 4.800 4.386 4.222 4.490 . 0 0 "[ . 1 . 2]" 1
1555 1 58 ILE H 1 59 ALA MB . . 5.500 4.613 4.482 4.721 . 0 0 "[ . 1 . 2]" 1
1556 1 58 ILE HA 1 58 ILE MD . . 3.860 3.275 3.204 3.314 . 0 0 "[ . 1 . 2]" 1
1557 1 58 ILE HA 1 58 ILE HG12 . . 3.980 3.562 3.541 3.586 . 0 0 "[ . 1 . 2]" 1
1558 1 58 ILE HA 1 58 ILE MG . . 3.340 2.359 2.287 2.442 . 0 0 "[ . 1 . 2]" 1
1559 1 58 ILE HB 1 58 ILE MD . . 3.240 2.293 2.247 2.315 . 0 0 "[ . 1 . 2]" 1
1560 1 58 ILE HB 1 59 ALA H . . 4.910 4.059 3.947 4.240 . 0 0 "[ . 1 . 2]" 1
1561 1 58 ILE MD 1 58 ILE MG . . 3.190 3.177 3.162 3.194 0.004 5 0 "[ . 1 . 2]" 1
1562 1 58 ILE MD 1 59 ALA H . . 5.210 4.909 4.840 4.967 . 0 0 "[ . 1 . 2]" 1
1563 1 58 ILE HG12 1 58 ILE MG . . 3.470 2.124 2.029 2.230 . 0 0 "[ . 1 . 2]" 1
1564 1 58 ILE HG12 1 59 ALA H . . 5.480 5.047 4.877 5.333 . 0 0 "[ . 1 . 2]" 1
1565 1 58 ILE HG13 1 58 ILE MG . . 3.530 2.631 2.556 2.674 . 0 0 "[ . 1 . 2]" 1
1566 1 58 ILE MG 1 59 ALA H . . 3.520 2.270 1.965 2.666 . 0 0 "[ . 1 . 2]" 1
1567 1 58 ILE MG 1 59 ALA HA . . 4.740 3.438 3.212 3.711 . 0 0 "[ . 1 . 2]" 1
1568 1 59 ALA H 1 59 ALA MB . . 3.240 2.603 2.438 2.715 . 0 0 "[ . 1 . 2]" 1
1569 1 59 ALA H 1 60 LYS H . . 5.140 4.411 4.375 4.455 . 0 0 "[ . 1 . 2]" 1
1570 1 59 ALA HA 1 60 LYS H . . 3.020 2.440 2.278 2.593 . 0 0 "[ . 1 . 2]" 1
1571 1 59 ALA HA 1 60 LYS HG2 . . 5.170 4.219 3.996 4.436 . 0 0 "[ . 1 . 2]" 1
1572 1 59 ALA MB 1 60 LYS H . . 3.090 2.465 2.208 2.783 . 0 0 "[ . 1 . 2]" 1
1573 1 59 ALA MB 1 60 LYS HA . . 4.950 3.891 3.756 4.029 . 0 0 "[ . 1 . 2]" 1
1574 1 59 ALA MB 1 61 VAL HA . . 5.500 5.305 5.134 5.416 . 0 0 "[ . 1 . 2]" 1
1575 1 59 ALA MB 1 61 VAL MG2 . . 4.260 3.735 3.622 3.880 . 0 0 "[ . 1 . 2]" 1
1576 1 60 LYS H 1 60 LYS HG2 . . 3.300 2.391 2.186 2.550 . 0 0 "[ . 1 . 2]" 1
1577 1 60 LYS H 1 60 LYS HG3 . . 4.550 3.635 3.439 3.769 . 0 0 "[ . 1 . 2]" 1
1578 1 60 LYS H 1 61 VAL H . . 4.530 4.378 4.280 4.469 . 0 0 "[ . 1 . 2]" 1
1579 1 60 LYS HA 1 60 LYS HG2 . . 4.200 3.714 3.659 3.781 . 0 0 "[ . 1 . 2]" 1
1580 1 60 LYS HA 1 61 VAL H . . 2.930 2.220 2.161 2.276 . 0 0 "[ . 1 . 2]" 1
1581 1 60 LYS HA 1 61 VAL MG2 . . 4.490 3.777 3.608 4.046 . 0 0 "[ . 1 . 2]" 1
1582 1 60 LYS HB2 1 61 VAL H . . 3.640 3.002 2.777 3.248 . 0 0 "[ . 1 . 2]" 1
1583 1 60 LYS HB3 1 60 LYS HD2 . . 4.060 3.052 2.625 3.356 . 0 0 "[ . 1 . 2]" 1
1584 1 60 LYS HB3 1 60 LYS HD3 . . 3.700 2.292 2.169 2.460 . 0 0 "[ . 1 . 2]" 1
1585 1 60 LYS HB3 1 61 VAL H . . 4.580 4.162 3.998 4.284 . 0 0 "[ . 1 . 2]" 1
1586 1 60 LYS QE 1 60 LYS HG2 . . 3.520 2.322 2.100 2.545 . 0 0 "[ . 1 . 2]" 1
1587 1 60 LYS HE2 1 60 LYS HG3 . . 3.740 3.254 2.583 3.754 0.014 11 0 "[ . 1 . 2]" 1
1588 1 60 LYS HE3 1 60 LYS HG3 . . 3.740 2.835 2.449 3.757 0.017 1 0 "[ . 1 . 2]" 1
1589 1 60 LYS HG2 1 61 VAL H . . 4.660 4.639 4.562 4.671 0.011 11 0 "[ . 1 . 2]" 1
1590 1 60 LYS HG3 1 61 VAL H . . 4.910 3.879 3.668 4.211 . 0 0 "[ . 1 . 2]" 1
1591 1 60 LYS HG3 1 61 VAL HA . . 5.500 4.014 3.783 4.310 . 0 0 "[ . 1 . 2]" 1
1592 1 61 VAL H 1 61 VAL HB . . 3.240 2.544 2.411 2.631 . 0 0 "[ . 1 . 2]" 1
1593 1 61 VAL H 1 61 VAL MG1 . . 4.070 3.776 3.680 3.836 . 0 0 "[ . 1 . 2]" 1
1594 1 61 VAL H 1 61 VAL MG2 . . 3.650 2.961 2.699 3.094 . 0 0 "[ . 1 . 2]" 1
1595 1 61 VAL HA 1 61 VAL MG1 . . 3.280 2.465 2.400 2.544 . 0 0 "[ . 1 . 2]" 1
1596 1 61 VAL HA 1 61 VAL MG2 . . 3.280 2.234 2.138 2.348 . 0 0 "[ . 1 . 2]" 1
1597 1 61 VAL HA 1 62 ASP H . . 2.970 2.229 2.165 2.303 . 0 0 "[ . 1 . 2]" 1
1598 1 61 VAL HA 1 62 ASP HA . . 4.900 4.383 4.372 4.398 . 0 0 "[ . 1 . 2]" 1
1599 1 61 VAL HA 1 62 ASP QB . . 5.340 4.320 3.930 4.626 . 0 0 "[ . 1 . 2]" 1
1600 1 61 VAL HA 1 66 GLN QG . . 4.740 4.104 3.720 4.366 . 0 0 "[ . 1 . 2]" 1
1601 1 61 VAL HB 1 62 ASP H . . 4.830 4.037 3.920 4.200 . 0 0 "[ . 1 . 2]" 1
1602 1 61 VAL HB 1 69 LEU MD1 . . 4.580 4.215 3.862 4.582 0.002 18 0 "[ . 1 . 2]" 1
1603 1 61 VAL MG1 1 62 ASP H . . 3.590 2.128 1.883 2.559 . 0 0 "[ . 1 . 2]" 1
1604 1 61 VAL MG1 1 62 ASP HA . . 4.100 3.572 3.399 3.724 . 0 0 "[ . 1 . 2]" 1
1605 1 61 VAL MG1 1 63 VAL H . . 4.750 3.818 2.855 4.154 . 0 0 "[ . 1 . 2]" 1
1606 1 61 VAL MG1 1 63 VAL HA . . 3.700 3.635 3.147 3.783 0.083 10 0 "[ . 1 . 2]" 1
1607 1 61 VAL MG1 1 63 VAL MG1 . . 3.470 3.085 2.868 3.278 . 0 0 "[ . 1 . 2]" 1
1608 1 61 VAL MG1 1 66 GLN H . . 4.840 4.366 3.836 4.620 . 0 0 "[ . 1 . 2]" 1
1609 1 61 VAL MG1 1 66 GLN HA . . 5.500 5.270 4.938 5.501 0.001 10 0 "[ . 1 . 2]" 1
1610 1 61 VAL MG1 1 66 GLN HB2 . . 3.340 2.777 2.405 2.993 . 0 0 "[ . 1 . 2]" 1
1611 1 61 VAL MG1 1 66 GLN HB3 . . 3.900 3.636 3.279 3.857 . 0 0 "[ . 1 . 2]" 1
1612 1 61 VAL MG1 1 66 GLN QG . . 3.470 3.003 2.646 3.334 . 0 0 "[ . 1 . 2]" 1
1613 1 61 VAL MG1 1 69 LEU H . . 5.500 4.793 4.532 5.006 . 0 0 "[ . 1 . 2]" 1
1614 1 61 VAL MG1 1 69 LEU HB2 . . 3.740 2.870 2.558 2.983 . 0 0 "[ . 1 . 2]" 1
1615 1 61 VAL MG1 1 69 LEU QB . . 3.260 2.351 2.163 2.542 . 0 0 "[ . 1 . 2]" 1
1616 1 61 VAL MG1 1 69 LEU HB3 . . 3.740 2.511 2.258 2.766 . 0 0 "[ . 1 . 2]" 1
1617 1 61 VAL MG1 1 69 LEU MD1 . . 3.180 2.135 1.843 2.495 . 0 0 "[ . 1 . 2]" 1
1618 1 61 VAL MG2 1 62 ASP H . . 4.430 3.748 3.525 3.962 . 0 0 "[ . 1 . 2]" 1
1619 1 61 VAL MG2 1 62 ASP HA . . 5.500 5.519 5.437 5.607 0.107 8 0 "[ . 1 . 2]" 1
1620 1 61 VAL MG2 1 66 GLN QG . . 4.490 4.111 3.773 4.489 . 0 0 "[ . 1 . 2]" 1
1621 1 61 VAL MG2 1 69 LEU HA . . 5.500 5.425 5.111 5.521 0.021 8 0 "[ . 1 . 2]" 1
1622 1 61 VAL MG2 1 69 LEU QB . . 4.130 3.226 3.091 3.366 . 0 0 "[ . 1 . 2]" 1
1623 1 61 VAL MG2 1 69 LEU MD1 . . 2.950 2.158 1.924 2.485 . 0 0 "[ . 1 . 2]" 1
1624 1 61 VAL MG2 1 69 LEU MD2 . . 3.530 3.187 2.428 3.536 0.006 20 0 "[ . 1 . 2]" 1
1625 1 62 ASP H 1 62 ASP HB2 . . 3.810 2.814 2.493 3.634 . 0 0 "[ . 1 . 2]" 1
1626 1 62 ASP H 1 62 ASP QB . . 3.320 2.628 2.344 3.080 . 0 0 "[ . 1 . 2]" 1
1627 1 62 ASP H 1 62 ASP HB3 . . 3.810 3.315 2.842 3.772 . 0 0 "[ . 1 . 2]" 1
1628 1 62 ASP H 1 66 GLN QG . . 5.050 3.068 2.243 3.470 . 0 0 "[ . 1 . 2]" 1
1629 1 62 ASP HA 1 63 VAL H . . 2.860 2.162 2.139 2.334 . 0 0 "[ . 1 . 2]" 1
1630 1 62 ASP HA 1 63 VAL MG1 . . 4.210 3.781 3.604 4.027 . 0 0 "[ . 1 . 2]" 1
1631 1 62 ASP HA 1 63 VAL MG2 . . 4.250 3.841 3.592 3.955 . 0 0 "[ . 1 . 2]" 1
1632 1 62 ASP HA 1 64 THR H . . 4.330 3.615 3.284 3.806 . 0 0 "[ . 1 . 2]" 1
1633 1 62 ASP HA 1 64 THR MG . . 4.650 4.462 3.733 4.668 0.018 6 0 "[ . 1 . 2]" 1
1634 1 62 ASP HA 1 65 GLU H . . 4.760 4.496 4.193 4.762 0.002 20 0 "[ . 1 . 2]" 1
1635 1 62 ASP QB 1 65 GLU H . . 4.200 2.396 2.048 2.818 . 0 0 "[ . 1 . 2]" 1
1636 1 62 ASP QB 1 65 GLU HB2 . . 3.810 2.404 1.942 3.547 . 0 0 "[ . 1 . 2]" 1
1637 1 63 VAL H 1 63 VAL HB . . 4.110 3.645 3.610 3.678 . 0 0 "[ . 1 . 2]" 1
1638 1 63 VAL H 1 63 VAL MG1 . . 3.200 2.388 1.937 2.675 . 0 0 "[ . 1 . 2]" 1
1639 1 63 VAL H 1 63 VAL MG2 . . 3.170 2.190 1.913 2.354 . 0 0 "[ . 1 . 2]" 1
1640 1 63 VAL H 1 64 THR H . . 3.590 2.807 2.166 2.955 . 0 0 "[ . 1 . 2]" 1
1641 1 63 VAL H 1 64 THR MG . . 4.490 3.526 3.024 4.282 . 0 0 "[ . 1 . 2]" 1
1642 1 63 VAL H 1 65 GLU H . . 4.710 4.431 3.685 4.667 . 0 0 "[ . 1 . 2]" 1
1643 1 63 VAL HA 1 63 VAL MG1 . . 2.940 2.308 2.213 2.460 . 0 0 "[ . 1 . 2]" 1
1644 1 63 VAL HA 1 63 VAL MG2 . . 3.450 3.191 3.185 3.202 . 0 0 "[ . 1 . 2]" 1
1645 1 63 VAL HA 1 64 THR MG . . 5.070 4.447 4.276 4.869 . 0 0 "[ . 1 . 2]" 1
1646 1 63 VAL HA 1 65 GLU H . . 4.640 4.398 4.151 4.646 0.006 10 0 "[ . 1 . 2]" 1
1647 1 63 VAL HA 1 66 GLN H . . 3.960 3.858 3.645 3.970 0.010 14 0 "[ . 1 . 2]" 1
1648 1 63 VAL HA 1 66 GLN HB2 . . 4.110 4.003 3.639 4.118 0.008 20 0 "[ . 1 . 2]" 1
1649 1 63 VAL HB 1 64 THR H . . 5.010 4.320 3.785 4.468 . 0 0 "[ . 1 . 2]" 1
1650 1 63 VAL HB 1 64 THR MG . . 4.630 4.249 4.061 4.683 0.053 19 0 "[ . 1 . 2]" 1
1651 1 63 VAL HB 1 70 SER QB . . 4.080 3.556 2.906 3.901 . 0 0 "[ . 1 . 2]" 1
1652 1 63 VAL HB 1 78 LEU MD2 . . 4.820 4.430 3.998 4.824 0.004 5 0 "[ . 1 . 2]" 1
1653 1 63 VAL MG1 1 64 THR H . . 4.790 4.224 3.961 4.332 . 0 0 "[ . 1 . 2]" 1
1654 1 63 VAL MG1 1 64 THR MG . . 4.470 4.446 4.391 4.524 0.054 19 0 "[ . 1 . 2]" 1
1655 1 63 VAL MG1 1 70 SER QB . . 4.100 3.235 2.449 3.739 . 0 0 "[ . 1 . 2]" 1
1656 1 63 VAL MG1 1 75 ILE MG . . 3.730 3.098 2.580 3.610 . 0 0 "[ . 1 . 2]" 1
1657 1 63 VAL MG1 1 78 LEU MD2 . . 3.280 2.274 1.922 2.625 . 0 0 "[ . 1 . 2]" 1
1658 1 63 VAL MG2 1 64 THR H . . 3.820 3.065 2.142 3.390 . 0 0 "[ . 1 . 2]" 1
1659 1 63 VAL MG2 1 64 THR HA . . 4.150 3.757 3.154 4.010 . 0 0 "[ . 1 . 2]" 1
1660 1 63 VAL MG2 1 64 THR HB . . 5.010 4.529 3.192 4.846 . 0 0 "[ . 1 . 2]" 1
1661 1 63 VAL MG2 1 64 THR MG . . 3.250 2.211 2.086 2.533 . 0 0 "[ . 1 . 2]" 1
1662 1 63 VAL MG2 1 65 GLU H . . 4.940 4.774 4.206 4.948 0.008 16 0 "[ . 1 . 2]" 1
1663 1 63 VAL MG2 1 70 SER QB . . 5.060 4.786 4.211 5.065 0.005 1 0 "[ . 1 . 2]" 1
1664 1 64 THR H 1 64 THR MG . . 3.210 2.608 1.763 2.957 . 0 0 "[ . 1 . 2]" 1
1665 1 64 THR H 1 65 GLU H . . 3.180 1.980 1.801 2.647 . 0 0 "[ . 1 . 2]" 1
1666 1 64 THR H 1 65 GLU HB2 . . 4.860 4.218 3.931 4.826 . 0 0 "[ . 1 . 2]" 1
1667 1 64 THR H 1 65 GLU QG . . 5.180 4.144 3.641 4.580 . 0 0 "[ . 1 . 2]" 1
1668 1 64 THR H 1 66 GLN H . . 4.390 3.161 2.791 3.919 . 0 0 "[ . 1 . 2]" 1
1669 1 64 THR HA 1 64 THR MG . . 3.090 2.514 2.348 3.150 0.060 10 0 "[ . 1 . 2]" 1
1670 1 64 THR HB 1 65 GLU H . . 4.880 3.910 3.596 4.193 . 0 0 "[ . 1 . 2]" 1
1671 1 64 THR MG 1 65 GLU H . . 4.350 3.624 2.018 3.943 . 0 0 "[ . 1 . 2]" 1
1672 1 64 THR MG 1 65 GLU QG . . 4.980 4.201 2.386 4.811 . 0 0 "[ . 1 . 2]" 1
1673 1 65 GLU H 1 65 GLU HB2 . . 3.390 2.448 2.248 2.626 . 0 0 "[ . 1 . 2]" 1
1674 1 65 GLU H 1 65 GLU HB3 . . 3.990 3.635 3.534 3.707 . 0 0 "[ . 1 . 2]" 1
1675 1 65 GLU H 1 65 GLU QG . . 3.570 2.699 2.098 3.158 . 0 0 "[ . 1 . 2]" 1
1676 1 65 GLU H 1 66 GLN H . . 3.030 2.175 2.003 2.507 . 0 0 "[ . 1 . 2]" 1
1677 1 65 GLU H 1 66 GLN QG . . 4.460 4.122 3.741 4.473 0.013 19 0 "[ . 1 . 2]" 1
1678 1 65 GLU HB2 1 66 GLN H . . 4.050 2.908 2.492 3.130 . 0 0 "[ . 1 . 2]" 1
1679 1 65 GLU HB2 1 66 GLN QE . . 4.120 3.884 3.453 4.153 0.033 4 0 "[ . 1 . 2]" 1
1680 1 65 GLU HB2 1 66 GLN QG . . 4.030 3.095 2.662 3.442 . 0 0 "[ . 1 . 2]" 1
1681 1 65 GLU HB3 1 66 GLN H . . 4.110 3.803 3.577 4.079 . 0 0 "[ . 1 . 2]" 1
1682 1 65 GLU HB3 1 66 GLN QE . . 3.900 3.505 3.021 3.901 0.001 14 0 "[ . 1 . 2]" 1
1683 1 65 GLU QG 1 66 GLN H . . 4.460 4.191 3.774 4.418 . 0 0 "[ . 1 . 2]" 1
1684 1 66 GLN H 1 66 GLN HB2 . . 3.620 2.566 2.421 2.719 . 0 0 "[ . 1 . 2]" 1
1685 1 66 GLN H 1 66 GLN QG . . 3.780 2.753 2.514 3.003 . 0 0 "[ . 1 . 2]" 1
1686 1 66 GLN H 1 67 PRO HD2 . . 5.030 4.368 4.237 4.517 . 0 0 "[ . 1 . 2]" 1
1687 1 66 GLN H 1 67 PRO QD . . 4.210 3.576 3.405 3.775 . 0 0 "[ . 1 . 2]" 1
1688 1 66 GLN H 1 67 PRO HD3 . . 5.030 3.798 3.588 4.046 . 0 0 "[ . 1 . 2]" 1
1689 1 66 GLN H 1 69 LEU MD1 . . 5.500 5.196 4.830 5.408 . 0 0 "[ . 1 . 2]" 1
1690 1 66 GLN HA 1 67 PRO HD2 . . 3.500 1.958 1.921 1.998 . 0 0 "[ . 1 . 2]" 1
1691 1 66 GLN HA 1 67 PRO QD . . 2.980 1.913 1.871 1.955 . 0 0 "[ . 1 . 2]" 1
1692 1 66 GLN HA 1 67 PRO HD3 . . 3.500 2.690 2.579 2.781 . 0 0 "[ . 1 . 2]" 1
1693 1 66 GLN HA 1 67 PRO HG2 . . 4.900 4.136 4.116 4.158 . 0 0 "[ . 1 . 2]" 1
1694 1 66 GLN HB3 1 69 LEU HB2 . . 4.490 2.350 2.106 2.661 . 0 0 "[ . 1 . 2]" 1
1695 1 66 GLN HB3 1 69 LEU QB . . 3.900 2.334 2.096 2.638 . 0 0 "[ . 1 . 2]" 1
1696 1 66 GLN HB3 1 69 LEU HB3 . . 4.490 4.035 3.769 4.339 . 0 0 "[ . 1 . 2]" 1
1697 1 66 GLN HB3 1 69 LEU MD1 . . 3.840 2.615 2.393 2.831 . 0 0 "[ . 1 . 2]" 1
1698 1 66 GLN HB3 1 69 LEU MD2 . . 4.620 4.570 4.379 4.626 0.006 5 0 "[ . 1 . 2]" 1
1699 1 66 GLN QE 1 67 PRO QD . . 5.080 4.205 3.148 4.755 . 0 0 "[ . 1 . 2]" 1
1700 1 66 GLN QE 1 69 LEU MD1 . . 5.340 4.055 3.209 4.511 . 0 0 "[ . 1 . 2]" 1
1701 1 66 GLN HE22 1 66 GLN QG . . 3.700 3.256 3.216 3.421 . 0 0 "[ . 1 . 2]" 1
1702 1 66 GLN QG 1 69 LEU MD1 . . 4.080 2.301 2.100 2.581 . 0 0 "[ . 1 . 2]" 1
1703 1 67 PRO HA 1 70 SER H . . 4.250 4.037 3.663 4.241 . 0 0 "[ . 1 . 2]" 1
1704 1 67 PRO HA 1 70 SER QB . . 3.420 3.177 2.936 3.390 . 0 0 "[ . 1 . 2]" 1
1705 1 67 PRO QD 1 68 GLY H . . 4.230 2.657 2.603 2.892 . 0 0 "[ . 1 . 2]" 1
1706 1 67 PRO HD2 1 68 GLY H . . 4.910 2.707 2.647 2.965 . 0 0 "[ . 1 . 2]" 1
1707 1 67 PRO HD3 1 68 GLY H . . 4.910 3.873 3.838 4.012 . 0 0 "[ . 1 . 2]" 1
1708 1 67 PRO HG2 1 68 GLY H . . 4.070 2.594 2.070 3.254 . 0 0 "[ . 1 . 2]" 1
1709 1 67 PRO HG2 1 68 GLY QA . . 4.580 3.771 3.623 3.988 . 0 0 "[ . 1 . 2]" 1
1710 1 68 GLY H 1 69 LEU H . . 3.960 2.682 2.280 2.997 . 0 0 "[ . 1 . 2]" 1
1711 1 68 GLY QA 1 69 LEU QB . . 5.210 4.408 4.337 4.494 . 0 0 "[ . 1 . 2]" 1
1712 1 68 GLY QA 1 69 LEU HG . . 5.500 4.446 4.129 4.715 . 0 0 "[ . 1 . 2]" 1
1713 1 69 LEU H 1 69 LEU HB2 . . 4.020 2.322 2.192 2.466 . 0 0 "[ . 1 . 2]" 1
1714 1 69 LEU H 1 69 LEU QB . . 3.330 2.293 2.171 2.426 . 0 0 "[ . 1 . 2]" 1
1715 1 69 LEU H 1 69 LEU HB3 . . 4.020 3.558 3.501 3.594 . 0 0 "[ . 1 . 2]" 1
1716 1 69 LEU H 1 69 LEU MD1 . . 4.480 3.643 3.488 3.895 . 0 0 "[ . 1 . 2]" 1
1717 1 69 LEU H 1 69 LEU MD2 . . 4.470 3.702 3.374 3.975 . 0 0 "[ . 1 . 2]" 1
1718 1 69 LEU H 1 69 LEU HG . . 3.550 2.619 2.318 2.911 . 0 0 "[ . 1 . 2]" 1
1719 1 69 LEU H 1 70 SER H . . 3.850 2.849 2.475 3.031 . 0 0 "[ . 1 . 2]" 1
1720 1 69 LEU HA 1 69 LEU MD1 . . 3.920 3.834 3.769 3.879 . 0 0 "[ . 1 . 2]" 1
1721 1 69 LEU HA 1 69 LEU MD2 . . 3.160 2.030 1.970 2.160 . 0 0 "[ . 1 . 2]" 1
1722 1 69 LEU HA 1 69 LEU HG . . 3.810 2.815 2.697 2.988 . 0 0 "[ . 1 . 2]" 1
1723 1 69 LEU HA 1 72 ARG H . . 4.090 3.381 2.967 3.774 . 0 0 "[ . 1 . 2]" 1
1724 1 69 LEU HA 1 72 ARG QB . . 3.770 2.397 1.923 3.861 0.091 3 0 "[ . 1 . 2]" 1
1725 1 69 LEU HA 1 72 ARG QG . . 5.290 3.399 1.910 4.629 . 0 0 "[ . 1 . 2]" 1
1726 1 69 LEU HA 1 73 PHE QD . . 4.310 3.182 2.612 3.602 . 0 0 "[ . 1 . 2]" 1
1727 1 69 LEU QB 1 69 LEU MD1 . . 2.920 2.068 2.032 2.099 . 0 0 "[ . 1 . 2]" 1
1728 1 69 LEU QB 1 69 LEU MD2 . . 3.270 2.269 2.183 2.319 . 0 0 "[ . 1 . 2]" 1
1729 1 69 LEU QB 1 70 SER H . . 3.570 2.651 2.247 2.954 . 0 0 "[ . 1 . 2]" 1
1730 1 69 LEU QB 1 73 PHE QD . . 4.080 3.451 2.897 3.909 . 0 0 "[ . 1 . 2]" 1
1731 1 69 LEU QB 1 73 PHE QE . . 4.880 4.036 3.532 4.484 . 0 0 "[ . 1 . 2]" 1
1732 1 69 LEU HB2 1 69 LEU MD1 . . 3.400 2.259 2.145 2.357 . 0 0 "[ . 1 . 2]" 1
1733 1 69 LEU HB2 1 70 SER H . . 4.180 2.767 2.330 3.097 . 0 0 "[ . 1 . 2]" 1
1734 1 69 LEU HB3 1 69 LEU MD1 . . 3.400 2.407 2.321 2.516 . 0 0 "[ . 1 . 2]" 1
1735 1 69 LEU HB3 1 70 SER H . . 4.180 3.410 2.955 3.787 . 0 0 "[ . 1 . 2]" 1
1736 1 69 LEU MD1 1 73 PHE QD . . 5.150 4.814 4.234 5.146 . 0 0 "[ . 1 . 2]" 1
1737 1 69 LEU MD1 1 73 PHE QE . . 4.560 4.261 3.769 4.572 0.012 3 0 "[ . 1 . 2]" 1
1738 1 69 LEU MD2 1 70 SER H . . 4.980 4.676 4.518 4.788 . 0 0 "[ . 1 . 2]" 1
1739 1 69 LEU MD2 1 72 ARG QD . . 4.560 3.067 1.880 4.489 . 0 0 "[ . 1 . 2]" 1
1740 1 69 LEU MD2 1 73 PHE QD . . 3.990 2.761 1.982 3.254 . 0 0 "[ . 1 . 2]" 1
1741 1 69 LEU MD2 1 73 PHE QE . . 3.460 2.136 1.944 2.356 . 0 0 "[ . 1 . 2]" 1
1742 1 69 LEU HG 1 73 PHE QD . . 5.500 5.212 4.586 5.504 0.004 1 0 "[ . 1 . 2]" 1
1743 1 69 LEU HG 1 73 PHE QE . . 5.450 4.874 4.547 5.146 . 0 0 "[ . 1 . 2]" 1
1744 1 70 SER H 1 70 SER QB . . 3.400 2.340 2.155 2.692 . 0 0 "[ . 1 . 2]" 1
1745 1 70 SER HA 1 75 ILE HB . . 4.330 3.725 2.745 4.352 0.022 3 0 "[ . 1 . 2]" 1
1746 1 70 SER HA 1 75 ILE MD . . 5.310 4.468 3.618 5.001 . 0 0 "[ . 1 . 2]" 1
1747 1 70 SER HA 1 75 ILE HG12 . . 4.250 3.331 2.294 4.100 . 0 0 "[ . 1 . 2]" 1
1748 1 70 SER HA 1 75 ILE QG . . 3.730 2.923 2.182 3.362 . 0 0 "[ . 1 . 2]" 1
1749 1 70 SER HA 1 75 ILE HG13 . . 4.250 3.338 2.533 3.981 . 0 0 "[ . 1 . 2]" 1
1750 1 70 SER QB 1 71 GLY H . . 4.630 2.574 2.115 3.373 . 0 0 "[ . 1 . 2]" 1
1751 1 72 ARG H 1 72 ARG HB2 . . 4.030 2.560 2.168 3.588 . 0 0 "[ . 1 . 2]" 1
1752 1 72 ARG H 1 72 ARG QB . . 3.260 2.364 2.119 2.590 . 0 0 "[ . 1 . 2]" 1
1753 1 72 ARG H 1 72 ARG HB3 . . 4.030 3.126 2.413 3.622 . 0 0 "[ . 1 . 2]" 1
1754 1 72 ARG H 1 72 ARG QD . . 4.690 4.165 3.148 4.703 0.013 17 0 "[ . 1 . 2]" 1
1755 1 72 ARG H 1 72 ARG HG2 . . 4.650 3.702 1.942 4.643 . 0 0 "[ . 1 . 2]" 1
1756 1 72 ARG H 1 72 ARG QG . . 3.960 2.989 1.926 3.997 0.037 16 0 "[ . 1 . 2]" 1
1757 1 72 ARG H 1 72 ARG HG3 . . 4.650 3.396 2.016 4.652 0.002 17 0 "[ . 1 . 2]" 1
1758 1 72 ARG H 1 73 PHE H . . 3.620 2.734 2.156 3.094 . 0 0 "[ . 1 . 2]" 1
1759 1 72 ARG H 1 73 PHE QD . . 4.740 4.229 3.626 4.768 0.028 3 0 "[ . 1 . 2]" 1
1760 1 72 ARG QB 1 73 PHE H . . 3.980 2.816 2.058 3.640 . 0 0 "[ . 1 . 2]" 1
1761 1 72 ARG QB 1 73 PHE QD . . 4.160 2.646 2.147 3.982 . 0 0 "[ . 1 . 2]" 1
1762 1 72 ARG QB 1 73 PHE QE . . 4.820 3.617 2.708 4.473 . 0 0 "[ . 1 . 2]" 1
1763 1 72 ARG HB2 1 73 PHE H . . 4.560 3.379 2.082 4.203 . 0 0 "[ . 1 . 2]" 1
1764 1 72 ARG HB2 1 73 PHE QD . . 4.770 3.438 2.192 4.429 . 0 0 "[ . 1 . 2]" 1
1765 1 72 ARG HB2 1 73 PHE QE . . 5.500 4.438 2.799 5.498 . 0 0 "[ . 1 . 2]" 1
1766 1 72 ARG HB3 1 73 PHE H . . 4.560 3.363 2.430 4.391 . 0 0 "[ . 1 . 2]" 1
1767 1 72 ARG HB3 1 73 PHE QD . . 4.770 3.232 2.358 4.783 0.013 3 0 "[ . 1 . 2]" 1
1768 1 72 ARG HB3 1 73 PHE QE . . 5.500 4.061 3.120 5.500 . 0 0 "[ . 1 . 2]" 1
1769 1 72 ARG QD 1 73 PHE QD . . 5.340 4.290 2.508 5.296 . 0 0 "[ . 1 . 2]" 1
1770 1 72 ARG QD 1 73 PHE QE . . 5.340 4.124 2.487 5.337 . 0 0 "[ . 1 . 2]" 1
1771 1 72 ARG QG 1 73 PHE QD . . 5.230 3.937 1.974 5.271 0.041 12 0 "[ . 1 . 2]" 1
1772 1 72 ARG HG2 1 73 PHE H . . 5.120 4.451 2.082 5.070 . 0 0 "[ . 1 . 2]" 1
1773 1 72 ARG HG3 1 73 PHE H . . 5.120 4.488 1.932 5.083 . 0 0 "[ . 1 . 2]" 1
1774 1 73 PHE H 1 73 PHE HB2 . . 4.120 2.402 2.221 2.612 . 0 0 "[ . 1 . 2]" 1
1775 1 73 PHE H 1 73 PHE QB . . 3.360 2.368 2.198 2.566 . 0 0 "[ . 1 . 2]" 1
1776 1 73 PHE H 1 73 PHE HB3 . . 4.120 3.616 3.516 3.763 . 0 0 "[ . 1 . 2]" 1
1777 1 73 PHE H 1 73 PHE QD . . 3.680 2.740 2.142 3.424 . 0 0 "[ . 1 . 2]" 1
1778 1 73 PHE H 1 74 ILE MG . . 5.490 5.302 4.853 5.514 0.024 5 0 "[ . 1 . 2]" 1
1779 1 73 PHE HA 1 73 PHE QD . . 3.780 3.019 2.727 3.131 . 0 0 "[ . 1 . 2]" 1
1780 1 73 PHE HA 1 74 ILE QG . . 4.440 4.145 3.015 4.472 0.032 7 0 "[ . 1 . 2]" 1
1781 1 73 PHE QB 1 75 ILE QG . . 3.640 2.403 1.903 3.450 . 0 0 "[ . 1 . 2]" 1
1782 1 73 PHE QB 1 82 TYR QE . . 3.980 3.479 3.005 3.990 0.010 12 0 "[ . 1 . 2]" 1
1783 1 73 PHE HB2 1 75 ILE MD . . 4.070 2.843 2.111 3.672 . 0 0 "[ . 1 . 2]" 1
1784 1 73 PHE HB2 1 75 ILE HG12 . . 4.940 2.623 2.069 4.000 . 0 0 "[ . 1 . 2]" 1
1785 1 73 PHE HB2 1 75 ILE HG13 . . 4.940 3.655 3.019 4.971 0.031 13 0 "[ . 1 . 2]" 1
1786 1 73 PHE HB3 1 75 ILE MD . . 4.070 2.288 1.966 2.860 . 0 0 "[ . 1 . 2]" 1
1787 1 73 PHE HB3 1 75 ILE HG12 . . 4.940 3.138 1.993 4.127 . 0 0 "[ . 1 . 2]" 1
1788 1 73 PHE HB3 1 75 ILE HG13 . . 4.940 4.183 3.221 4.951 0.011 3 0 "[ . 1 . 2]" 1
1789 1 73 PHE QD 1 75 ILE MD . . 4.680 3.623 2.907 4.352 . 0 0 "[ . 1 . 2]" 1
1790 1 73 PHE QD 1 82 TYR QE . . 4.070 3.877 3.413 4.072 0.002 1 0 "[ . 1 . 2]" 1
1791 1 73 PHE QD 1 89 PHE HB3 . . 5.500 4.912 4.396 5.509 0.009 12 0 "[ . 1 . 2]" 1
1792 1 73 PHE QD 1 89 PHE QD . . 5.500 4.244 3.721 4.851 . 0 0 "[ . 1 . 2]" 1
1793 1 73 PHE QE 1 82 TYR HB3 . . 4.650 3.565 2.673 4.488 . 0 0 "[ . 1 . 2]" 1
1794 1 73 PHE QE 1 82 TYR QD . . 4.670 4.262 3.624 4.677 0.007 13 0 "[ . 1 . 2]" 1
1795 1 73 PHE QE 1 89 PHE HB3 . . 4.990 4.518 3.937 4.914 . 0 0 "[ . 1 . 2]" 1
1796 1 73 PHE QE 1 89 PHE QD . . 4.640 2.918 2.166 3.508 . 0 0 "[ . 1 . 2]" 1
1797 1 73 PHE QE 1 89 PHE QE . . 4.330 2.308 1.992 2.886 . 0 0 "[ . 1 . 2]" 1
1798 1 73 PHE QE 1 89 PHE HZ . . 5.500 3.556 2.746 4.342 . 0 0 "[ . 1 . 2]" 1
1799 1 73 PHE QE 1 119 TRP HE3 . . 4.860 4.528 3.747 4.874 0.014 12 0 "[ . 1 . 2]" 1
1800 1 73 PHE QE 1 119 TRP HH2 . . 4.690 2.706 2.040 3.475 . 0 0 "[ . 1 . 2]" 1
1801 1 73 PHE QE 1 119 TRP HZ2 . . 5.500 4.800 4.173 5.474 . 0 0 "[ . 1 . 2]" 1
1802 1 73 PHE QE 1 119 TRP HZ3 . . 4.550 2.873 2.594 3.266 . 0 0 "[ . 1 . 2]" 1
1803 1 73 PHE HZ 1 89 PHE QE . . 4.640 2.888 2.114 3.650 . 0 0 "[ . 1 . 2]" 1
1804 1 73 PHE HZ 1 89 PHE HZ . . 5.130 3.187 2.157 4.121 . 0 0 "[ . 1 . 2]" 1
1805 1 73 PHE HZ 1 119 TRP HZ2 . . 5.500 4.925 4.066 5.489 . 0 0 "[ . 1 . 2]" 1
1806 1 74 ILE H 1 74 ILE MD . . 4.400 2.796 1.736 4.383 . 0 0 "[ . 1 . 2]" 1
1807 1 74 ILE H 1 74 ILE HG12 . . 4.650 3.922 3.039 4.377 . 0 0 "[ . 1 . 2]" 1
1808 1 74 ILE H 1 74 ILE QG . . 4.050 2.928 1.822 3.708 . 0 0 "[ . 1 . 2]" 1
1809 1 74 ILE H 1 74 ILE HG13 . . 4.650 3.290 1.835 4.653 0.003 15 0 "[ . 1 . 2]" 1
1810 1 74 ILE H 1 74 ILE MG . . 4.800 3.189 2.004 3.971 . 0 0 "[ . 1 . 2]" 1
1811 1 74 ILE HA 1 74 ILE MD . . 4.220 3.568 3.408 4.160 . 0 0 "[ . 1 . 2]" 1
1812 1 74 ILE HA 1 74 ILE QG . . 3.720 2.892 2.427 3.501 . 0 0 "[ . 1 . 2]" 1
1813 1 74 ILE HA 1 74 ILE MG . . 3.690 2.239 2.141 2.381 . 0 0 "[ . 1 . 2]" 1
1814 1 74 ILE HB 1 74 ILE MD . . 3.230 2.474 2.061 3.225 . 0 0 "[ . 1 . 2]" 1
1815 1 74 ILE MD 1 119 TRP HE3 . . 5.500 5.058 4.370 5.473 . 0 0 "[ . 1 . 2]" 1
1816 1 74 ILE MD 1 119 TRP HZ3 . . 5.500 5.312 4.926 5.543 0.043 12 0 "[ . 1 . 2]" 1
1817 1 74 ILE MG 1 76 ASN QD . . 4.750 3.835 1.994 4.768 0.018 12 0 "[ . 1 . 2]" 1
1818 1 75 ILE H 1 75 ILE HB . . 4.010 2.561 2.494 2.644 . 0 0 "[ . 1 . 2]" 1
1819 1 75 ILE H 1 75 ILE MD . . 4.980 3.224 2.978 3.494 . 0 0 "[ . 1 . 2]" 1
1820 1 75 ILE H 1 75 ILE HG12 . . 4.850 2.230 1.924 3.110 . 0 0 "[ . 1 . 2]" 1
1821 1 75 ILE H 1 75 ILE QG . . 4.130 2.211 1.914 3.049 . 0 0 "[ . 1 . 2]" 1
1822 1 75 ILE H 1 75 ILE HG13 . . 4.850 3.692 3.435 4.399 . 0 0 "[ . 1 . 2]" 1
1823 1 75 ILE H 1 75 ILE MG . . 4.540 3.776 3.760 3.842 . 0 0 "[ . 1 . 2]" 1
1824 1 75 ILE HA 1 75 ILE MD . . 3.480 2.014 1.906 2.286 . 0 0 "[ . 1 . 2]" 1
1825 1 75 ILE HA 1 75 ILE QG . . 3.700 2.960 2.874 3.045 . 0 0 "[ . 1 . 2]" 1
1826 1 75 ILE HA 1 75 ILE MG . . 3.560 2.355 2.215 2.459 . 0 0 "[ . 1 . 2]" 1
1827 1 75 ILE HA 1 77 ALA H . . 4.250 3.871 3.321 4.170 . 0 0 "[ . 1 . 2]" 1
1828 1 75 ILE HA 1 80 THR MG . . 4.450 3.754 3.026 4.403 . 0 0 "[ . 1 . 2]" 1
1829 1 75 ILE MD 1 75 ILE MG . . 3.030 2.014 1.887 2.328 . 0 0 "[ . 1 . 2]" 1
1830 1 75 ILE MD 1 78 LEU MD2 . . 4.450 3.486 3.007 3.936 . 0 0 "[ . 1 . 2]" 1
1831 1 75 ILE MD 1 80 THR HB . . 3.610 2.860 2.339 3.410 . 0 0 "[ . 1 . 2]" 1
1832 1 75 ILE MD 1 80 THR MG . . 3.350 2.276 1.859 2.666 . 0 0 "[ . 1 . 2]" 1
1833 1 75 ILE MD 1 82 TYR QD . . 4.690 2.877 2.575 3.503 . 0 0 "[ . 1 . 2]" 1
1834 1 75 ILE MD 1 82 TYR QE . . 3.560 2.029 1.863 2.363 . 0 0 "[ . 1 . 2]" 1
1835 1 75 ILE QG 1 80 THR HB . . 5.110 4.405 4.003 4.932 . 0 0 "[ . 1 . 2]" 1
1836 1 75 ILE MG 1 77 ALA H . . 3.480 2.815 1.763 3.432 . 0 0 "[ . 1 . 2]" 1
1837 1 75 ILE MG 1 77 ALA MB . . 4.510 4.145 3.217 4.483 . 0 0 "[ . 1 . 2]" 1
1838 1 75 ILE MG 1 80 THR HA . . 5.500 5.165 4.644 5.501 0.001 3 0 "[ . 1 . 2]" 1
1839 1 75 ILE MG 1 80 THR HB . . 3.490 2.761 2.116 3.345 . 0 0 "[ . 1 . 2]" 1
1840 1 75 ILE MG 1 80 THR HG1 . . 5.040 3.381 2.413 4.509 . 0 0 "[ . 1 . 2]" 1
1841 1 75 ILE MG 1 80 THR MG . . 4.050 3.157 2.306 3.675 . 0 0 "[ . 1 . 2]" 1
1842 1 76 ASN H 1 77 ALA H . . 4.110 2.398 1.969 2.951 . 0 0 "[ . 1 . 2]" 1
1843 1 76 ASN QB 1 77 ALA H . . 4.070 2.972 2.272 4.051 . 0 0 "[ . 1 . 2]" 1
1844 1 76 ASN QB 1 77 ALA MB . . 4.660 3.424 3.114 4.151 . 0 0 "[ . 1 . 2]" 1
1845 1 76 ASN QD 1 77 ALA MB . . 5.340 4.856 3.969 5.348 0.008 18 0 "[ . 1 . 2]" 1
1846 1 77 ALA H 1 77 ALA MB . . 3.350 2.581 2.215 2.903 . 0 0 "[ . 1 . 2]" 1
1847 1 77 ALA H 1 78 LEU H . . 4.730 4.369 3.675 4.576 . 0 0 "[ . 1 . 2]" 1
1848 1 77 ALA H 1 80 THR HG1 . . 4.320 3.895 3.160 4.333 0.013 18 0 "[ . 1 . 2]" 1
1849 1 77 ALA HA 1 78 LEU H . . 3.200 2.378 2.158 2.598 . 0 0 "[ . 1 . 2]" 1
1850 1 77 ALA HA 1 78 LEU MD1 . . 4.780 4.334 4.100 4.788 0.008 20 0 "[ . 1 . 2]" 1
1851 1 77 ALA MB 1 78 LEU H . . 3.410 2.578 2.058 3.391 . 0 0 "[ . 1 . 2]" 1
1852 1 77 ALA MB 1 78 LEU HA . . 4.610 3.907 3.795 4.180 . 0 0 "[ . 1 . 2]" 1
1853 1 77 ALA MB 1 80 THR HB . . 5.500 5.284 4.558 5.530 0.030 20 0 "[ . 1 . 2]" 1
1854 1 77 ALA MB 1 80 THR HG1 . . 4.500 3.560 2.939 3.952 . 0 0 "[ . 1 . 2]" 1
1855 1 78 LEU H 1 78 LEU QB . . 3.570 2.751 2.493 2.850 . 0 0 "[ . 1 . 2]" 1
1856 1 78 LEU H 1 78 LEU MD1 . . 4.440 3.884 3.531 4.057 . 0 0 "[ . 1 . 2]" 1
1857 1 78 LEU H 1 78 LEU MD2 . . 4.550 4.240 4.051 4.374 . 0 0 "[ . 1 . 2]" 1
1858 1 78 LEU H 1 78 LEU HG . . 3.910 3.182 2.843 3.375 . 0 0 "[ . 1 . 2]" 1
1859 1 78 LEU HA 1 78 LEU MD1 . . 4.440 3.935 3.901 3.997 . 0 0 "[ . 1 . 2]" 1
1860 1 78 LEU HA 1 78 LEU MD2 . . 3.180 2.468 2.270 2.689 . 0 0 "[ . 1 . 2]" 1
1861 1 78 LEU HA 1 80 THR H . . 3.730 3.336 2.751 3.393 . 0 0 "[ . 1 . 2]" 1
1862 1 78 LEU QB 1 78 LEU MD1 . . 3.210 2.001 1.933 2.091 . 0 0 "[ . 1 . 2]" 1
1863 1 78 LEU QB 1 78 LEU MD2 . . 3.150 2.106 2.005 2.195 . 0 0 "[ . 1 . 2]" 1
1864 1 78 LEU QB 1 79 PRO HA . . 4.000 1.998 1.966 2.360 . 0 0 "[ . 1 . 2]" 1
1865 1 78 LEU HB2 1 79 PRO HA . . 4.640 3.553 3.413 3.865 . 0 0 "[ . 1 . 2]" 1
1866 1 78 LEU HB3 1 79 PRO HA . . 4.640 2.009 1.975 2.381 . 0 0 "[ . 1 . 2]" 1
1867 1 78 LEU MD2 1 79 PRO HA . . 3.690 2.677 2.362 3.023 . 0 0 "[ . 1 . 2]" 1
1868 1 78 LEU MD2 1 79 PRO QD . . 5.350 5.044 4.879 5.289 . 0 0 "[ . 1 . 2]" 1
1869 1 78 LEU MD2 1 80 THR H . . 3.790 3.020 2.429 3.448 . 0 0 "[ . 1 . 2]" 1
1870 1 78 LEU MD2 1 80 THR HB . . 4.520 2.575 2.410 3.542 . 0 0 "[ . 1 . 2]" 1
1871 1 79 PRO HA 1 80 THR H . . 2.990 2.404 2.228 2.423 . 0 0 "[ . 1 . 2]" 1
1872 1 79 PRO QB 1 80 THR H . . 3.360 2.532 2.488 2.971 . 0 0 "[ . 1 . 2]" 1
1873 1 79 PRO HB2 1 80 THR H . . 3.900 2.605 2.555 3.119 . 0 0 "[ . 1 . 2]" 1
1874 1 79 PRO HB3 1 80 THR H . . 3.900 3.450 3.423 3.735 . 0 0 "[ . 1 . 2]" 1
1875 1 80 THR H 1 80 THR HB . . 3.380 2.910 2.838 2.978 . 0 0 "[ . 1 . 2]" 1
1876 1 80 THR H 1 80 THR HG1 . . 4.380 3.842 2.493 4.384 0.004 13 0 "[ . 1 . 2]" 1
1877 1 80 THR H 1 80 THR MG . . 4.090 3.882 3.794 3.929 . 0 0 "[ . 1 . 2]" 1
1878 1 80 THR H 1 81 ILE H . . 4.740 3.988 3.824 4.537 . 0 0 "[ . 1 . 2]" 1
1879 1 80 THR H 1 81 ILE HA . . 5.500 4.522 4.421 5.137 . 0 0 "[ . 1 . 2]" 1
1880 1 80 THR HA 1 80 THR MG . . 3.260 2.463 2.049 2.565 . 0 0 "[ . 1 . 2]" 1
1881 1 80 THR HA 1 81 ILE H . . 2.810 2.156 2.142 2.290 . 0 0 "[ . 1 . 2]" 1
1882 1 80 THR HA 1 81 ILE HB . . 4.660 4.572 4.493 4.661 0.001 4 0 "[ . 1 . 2]" 1
1883 1 80 THR HA 1 81 ILE MD . . 5.230 4.810 4.540 5.174 . 0 0 "[ . 1 . 2]" 1
1884 1 80 THR HA 1 81 ILE HG13 . . 4.580 3.956 3.496 4.260 . 0 0 "[ . 1 . 2]" 1
1885 1 80 THR HB 1 81 ILE H . . 4.650 4.344 3.460 4.504 . 0 0 "[ . 1 . 2]" 1
1886 1 80 THR MG 1 81 ILE H . . 3.280 2.748 2.094 3.103 . 0 0 "[ . 1 . 2]" 1
1887 1 80 THR MG 1 81 ILE HA . . 4.650 3.755 3.519 4.090 . 0 0 "[ . 1 . 2]" 1
1888 1 80 THR MG 1 81 ILE HB . . 4.790 4.612 4.414 4.797 0.007 3 0 "[ . 1 . 2]" 1
1889 1 80 THR MG 1 82 TYR H . . 4.900 4.424 4.225 4.589 . 0 0 "[ . 1 . 2]" 1
1890 1 80 THR MG 1 82 TYR QD . . 3.880 2.516 2.055 3.106 . 0 0 "[ . 1 . 2]" 1
1891 1 80 THR MG 1 82 TYR QE . . 3.080 2.034 1.790 2.570 . 0 0 "[ . 1 . 2]" 1
1892 1 80 THR MG 1 91 ARG HD2 . . 4.440 3.436 2.510 4.444 0.004 9 0 "[ . 1 . 2]" 1
1893 1 80 THR MG 1 91 ARG QD . . 3.670 3.188 2.444 3.673 0.003 10 0 "[ . 1 . 2]" 1
1894 1 80 THR MG 1 91 ARG HD3 . . 4.440 3.944 3.033 4.420 . 0 0 "[ . 1 . 2]" 1
1895 1 81 ILE H 1 81 ILE HB . . 3.290 2.499 2.370 2.862 . 0 0 "[ . 1 . 2]" 1
1896 1 81 ILE H 1 81 ILE MD . . 4.070 3.588 3.282 4.070 . 0 0 "[ . 1 . 2]" 1
1897 1 81 ILE H 1 81 ILE HG12 . . 4.290 4.039 3.827 4.300 0.010 20 0 "[ . 1 . 2]" 1
1898 1 81 ILE H 1 81 ILE HG13 . . 3.780 2.715 2.505 3.083 . 0 0 "[ . 1 . 2]" 1
1899 1 81 ILE H 1 81 ILE MG . . 4.140 3.780 3.710 3.930 . 0 0 "[ . 1 . 2]" 1
1900 1 81 ILE H 1 92 TYR H . . 4.710 4.123 3.753 4.508 . 0 0 "[ . 1 . 2]" 1
1901 1 81 ILE H 1 92 TYR QB . . 4.440 3.242 2.811 4.181 . 0 0 "[ . 1 . 2]" 1
1902 1 81 ILE HA 1 81 ILE HG12 . . 3.890 2.704 2.465 2.809 . 0 0 "[ . 1 . 2]" 1
1903 1 81 ILE HA 1 81 ILE HG13 . . 3.860 2.721 2.571 2.931 . 0 0 "[ . 1 . 2]" 1
1904 1 81 ILE HA 1 81 ILE MG . . 3.090 2.438 2.313 2.510 . 0 0 "[ . 1 . 2]" 1
1905 1 81 ILE HA 1 82 TYR H . . 2.880 2.213 2.146 2.275 . 0 0 "[ . 1 . 2]" 1
1906 1 81 ILE HA 1 82 TYR QD . . 5.290 4.196 3.736 4.751 . 0 0 "[ . 1 . 2]" 1
1907 1 81 ILE HB 1 81 ILE MD . . 3.150 2.216 2.093 2.373 . 0 0 "[ . 1 . 2]" 1
1908 1 81 ILE HB 1 82 TYR H . . 4.780 4.037 3.914 4.340 . 0 0 "[ . 1 . 2]" 1
1909 1 81 ILE HB 1 92 TYR H . . 4.220 3.656 3.181 4.014 . 0 0 "[ . 1 . 2]" 1
1910 1 81 ILE HB 1 92 TYR HA . . 5.500 4.652 4.427 5.185 . 0 0 "[ . 1 . 2]" 1
1911 1 81 ILE HB 1 92 TYR HB2 . . 3.860 2.384 1.993 3.625 . 0 0 "[ . 1 . 2]" 1
1912 1 81 ILE HB 1 92 TYR QB . . 3.290 1.932 1.804 2.162 . 0 0 "[ . 1 . 2]" 1
1913 1 81 ILE HB 1 92 TYR HB3 . . 3.860 2.177 1.986 2.809 . 0 0 "[ . 1 . 2]" 1
1914 1 81 ILE HB 1 92 TYR QD . . 4.090 3.252 2.458 3.712 . 0 0 "[ . 1 . 2]" 1
1915 1 81 ILE MD 1 92 TYR HB2 . . 4.360 3.619 3.018 4.386 0.026 20 0 "[ . 1 . 2]" 1
1916 1 81 ILE MD 1 92 TYR QB . . 3.750 3.021 2.616 3.446 . 0 0 "[ . 1 . 2]" 1
1917 1 81 ILE MD 1 92 TYR HB3 . . 4.360 3.265 2.868 3.644 . 0 0 "[ . 1 . 2]" 1
1918 1 81 ILE MD 1 92 TYR QD . . 3.900 2.851 1.976 3.450 . 0 0 "[ . 1 . 2]" 1
1919 1 81 ILE MD 1 92 TYR QE . . 4.030 3.529 2.829 3.919 . 0 0 "[ . 1 . 2]" 1
1920 1 81 ILE MD 1 96 ARG H . . 5.440 4.615 3.996 5.024 . 0 0 "[ . 1 . 2]" 1
1921 1 81 ILE MD 1 96 ARG HA . . 4.350 3.197 2.878 3.499 . 0 0 "[ . 1 . 2]" 1
1922 1 81 ILE MD 1 96 ARG HB2 . . 4.280 3.786 2.330 4.264 . 0 0 "[ . 1 . 2]" 1
1923 1 81 ILE MD 1 96 ARG HB3 . . 4.280 2.935 2.258 4.280 0.000 2 0 "[ . 1 . 2]" 1
1924 1 81 ILE MD 1 96 ARG HD2 . . 3.850 3.421 2.298 3.852 0.002 8 0 "[ . 1 . 2]" 1
1925 1 81 ILE MD 1 96 ARG HD3 . . 3.850 2.515 1.918 3.588 . 0 0 "[ . 1 . 2]" 1
1926 1 81 ILE MD 1 101 PHE QE . . 3.230 2.011 1.865 2.322 . 0 0 "[ . 1 . 2]" 1
1927 1 81 ILE MD 1 101 PHE HZ . . 3.760 2.171 1.786 2.748 . 0 0 "[ . 1 . 2]" 1
1928 1 81 ILE HG12 1 82 TYR H . . 5.210 4.219 3.908 4.654 . 0 0 "[ . 1 . 2]" 1
1929 1 81 ILE HG13 1 101 PHE QE . . 5.500 4.744 4.414 5.097 . 0 0 "[ . 1 . 2]" 1
1930 1 81 ILE MG 1 82 TYR H . . 3.380 2.167 1.886 2.942 . 0 0 "[ . 1 . 2]" 1
1931 1 81 ILE MG 1 82 TYR HA . . 4.900 3.405 3.150 3.806 . 0 0 "[ . 1 . 2]" 1
1932 1 81 ILE MG 1 83 HIS H . . 4.900 4.012 3.579 4.364 . 0 0 "[ . 1 . 2]" 1
1933 1 81 ILE MG 1 92 TYR H . . 4.160 3.674 3.044 4.156 . 0 0 "[ . 1 . 2]" 1
1934 1 81 ILE MG 1 92 TYR HA . . 4.750 4.312 3.942 4.704 . 0 0 "[ . 1 . 2]" 1
1935 1 81 ILE MG 1 92 TYR HB2 . . 3.960 2.281 1.940 2.641 . 0 0 "[ . 1 . 2]" 1
1936 1 81 ILE MG 1 92 TYR QB . . 3.170 2.205 1.874 2.603 . 0 0 "[ . 1 . 2]" 1
1937 1 81 ILE MG 1 92 TYR HB3 . . 3.960 3.196 1.961 3.937 . 0 0 "[ . 1 . 2]" 1
1938 1 81 ILE MG 1 92 TYR QD . . 4.100 3.038 2.522 3.448 . 0 0 "[ . 1 . 2]" 1
1939 1 81 ILE MG 1 92 TYR QE . . 4.770 4.241 3.983 4.486 . 0 0 "[ . 1 . 2]" 1
1940 1 81 ILE MG 1 101 PHE QD . . 4.600 4.332 4.128 4.564 . 0 0 "[ . 1 . 2]" 1
1941 1 81 ILE MG 1 101 PHE QE . . 3.950 3.169 2.743 3.869 . 0 0 "[ . 1 . 2]" 1
1942 1 82 TYR H 1 82 TYR HB2 . . 3.500 2.539 2.394 2.647 . 0 0 "[ . 1 . 2]" 1
1943 1 82 TYR H 1 82 TYR HB3 . . 3.960 3.625 3.581 3.682 . 0 0 "[ . 1 . 2]" 1
1944 1 82 TYR H 1 82 TYR QD . . 3.980 3.661 3.250 3.974 . 0 0 "[ . 1 . 2]" 1
1945 1 82 TYR H 1 83 HIS HA . . 5.500 4.770 4.626 4.953 . 0 0 "[ . 1 . 2]" 1
1946 1 82 TYR HA 1 82 TYR QD . . 4.020 2.717 2.229 3.016 . 0 0 "[ . 1 . 2]" 1
1947 1 82 TYR HA 1 83 HIS H . . 2.970 2.157 2.138 2.181 . 0 0 "[ . 1 . 2]" 1
1948 1 82 TYR HA 1 83 HIS HB3 . . 4.860 4.586 4.443 4.792 . 0 0 "[ . 1 . 2]" 1
1949 1 82 TYR HA 1 91 ARG HA . . 3.510 2.717 2.252 3.243 . 0 0 "[ . 1 . 2]" 1
1950 1 82 TYR HA 1 92 TYR H . . 3.540 3.078 2.663 3.429 . 0 0 "[ . 1 . 2]" 1
1951 1 82 TYR HB2 1 83 HIS H . . 4.610 4.382 4.310 4.477 . 0 0 "[ . 1 . 2]" 1
1952 1 82 TYR HB3 1 83 HIS H . . 3.870 3.351 3.205 3.561 . 0 0 "[ . 1 . 2]" 1
1953 1 82 TYR HB3 1 89 PHE QD . . 3.830 2.727 2.182 3.297 . 0 0 "[ . 1 . 2]" 1
1954 1 82 TYR HB3 1 90 ARG H . . 4.870 4.267 3.667 4.740 . 0 0 "[ . 1 . 2]" 1
1955 1 82 TYR QD 1 83 HIS H . . 4.160 3.409 2.997 4.059 . 0 0 "[ . 1 . 2]" 1
1956 1 82 TYR QD 1 89 PHE HB3 . . 4.030 2.902 2.337 3.349 . 0 0 "[ . 1 . 2]" 1
1957 1 82 TYR QD 1 90 ARG H . . 4.010 3.308 2.607 3.835 . 0 0 "[ . 1 . 2]" 1
1958 1 82 TYR QD 1 91 ARG H . . 4.770 3.951 3.108 4.674 . 0 0 "[ . 1 . 2]" 1
1959 1 82 TYR QD 1 91 ARG HA . . 4.260 3.118 2.353 3.673 . 0 0 "[ . 1 . 2]" 1
1960 1 82 TYR QD 1 92 TYR H . . 4.860 4.567 4.073 4.870 0.010 20 0 "[ . 1 . 2]" 1
1961 1 82 TYR QE 1 89 PHE HB2 . . 5.400 5.005 4.335 5.401 0.001 9 0 "[ . 1 . 2]" 1
1962 1 82 TYR QE 1 89 PHE HB3 . . 4.080 3.898 3.373 4.085 0.005 11 0 "[ . 1 . 2]" 1
1963 1 82 TYR QE 1 91 ARG H . . 4.400 3.723 2.836 4.357 . 0 0 "[ . 1 . 2]" 1
1964 1 82 TYR QE 1 91 ARG HA . . 4.160 3.566 2.983 3.979 . 0 0 "[ . 1 . 2]" 1
1965 1 82 TYR QE 1 91 ARG QB . . 3.620 2.801 2.086 3.458 . 0 0 "[ . 1 . 2]" 1
1966 1 82 TYR QE 1 91 ARG QD . . 4.360 3.591 2.938 4.208 . 0 0 "[ . 1 . 2]" 1
1967 1 82 TYR QE 1 91 ARG QG . . 4.570 3.976 3.225 4.532 . 0 0 "[ . 1 . 2]" 1
1968 1 82 TYR QE 1 116 VAL MG1 . . 4.120 2.888 1.842 4.122 0.002 2 0 "[ . 1 . 2]" 1
1969 1 82 TYR QE 1 116 VAL QG . . 3.400 2.587 1.837 3.377 . 0 0 "[ . 1 . 2]" 1
1970 1 82 TYR QE 1 116 VAL MG2 . . 4.120 3.302 1.998 4.057 . 0 0 "[ . 1 . 2]" 1
1971 1 83 HIS H 1 83 HIS HB2 . . 3.750 2.856 2.663 3.054 . 0 0 "[ . 1 . 2]" 1
1972 1 83 HIS H 1 83 HIS HB3 . . 3.470 2.507 2.429 2.681 . 0 0 "[ . 1 . 2]" 1
1973 1 83 HIS H 1 84 CYS H . . 4.460 4.315 4.174 4.412 . 0 0 "[ . 1 . 2]" 1
1974 1 83 HIS H 1 90 ARG HB2 . . 4.810 3.849 3.189 4.225 . 0 0 "[ . 1 . 2]" 1
1975 1 83 HIS H 1 91 ARG HA . . 4.310 3.664 3.154 4.277 . 0 0 "[ . 1 . 2]" 1
1976 1 83 HIS H 1 92 TYR H . . 4.460 4.052 3.416 4.468 0.008 9 0 "[ . 1 . 2]" 1
1977 1 83 HIS H 1 104 PHE QE . . 4.990 4.689 4.492 4.991 0.001 20 0 "[ . 1 . 2]" 1
1978 1 83 HIS HA 1 83 HIS HD2 . . 3.880 2.906 2.591 3.079 . 0 0 "[ . 1 . 2]" 1
1979 1 83 HIS HA 1 84 CYS H . . 2.790 2.148 2.139 2.174 . 0 0 "[ . 1 . 2]" 1
1980 1 83 HIS HA 1 84 CYS HB2 . . 5.080 4.442 4.285 4.651 . 0 0 "[ . 1 . 2]" 1
1981 1 83 HIS HA 1 84 CYS HB3 . . 5.500 4.846 4.688 4.997 . 0 0 "[ . 1 . 2]" 1
1982 1 83 HIS HA 1 104 PHE QE . . 4.900 4.063 3.542 4.526 . 0 0 "[ . 1 . 2]" 1
1983 1 83 HIS HB2 1 84 CYS H . . 4.510 4.373 4.251 4.489 . 0 0 "[ . 1 . 2]" 1
1984 1 83 HIS HB2 1 90 ARG HB2 . . 4.800 4.132 3.635 4.776 . 0 0 "[ . 1 . 2]" 1
1985 1 83 HIS HB2 1 104 PHE QE . . 3.430 2.118 1.995 2.398 . 0 0 "[ . 1 . 2]" 1
1986 1 83 HIS HB2 1 104 PHE HZ . . 4.370 2.507 2.000 3.213 . 0 0 "[ . 1 . 2]" 1
1987 1 83 HIS HB2 1 113 ILE MD . . 5.500 5.355 4.985 5.516 0.016 12 0 "[ . 1 . 2]" 1
1988 1 83 HIS HB3 1 90 ARG H . . 4.410 3.279 2.765 3.660 . 0 0 "[ . 1 . 2]" 1
1989 1 83 HIS HB3 1 90 ARG HB2 . . 4.160 2.489 2.118 3.075 . 0 0 "[ . 1 . 2]" 1
1990 1 83 HIS HB3 1 90 ARG HB3 . . 4.700 3.658 3.225 4.181 . 0 0 "[ . 1 . 2]" 1
1991 1 83 HIS HB3 1 104 PHE QE . . 3.980 3.452 3.298 3.688 . 0 0 "[ . 1 . 2]" 1
1992 1 83 HIS HB3 1 104 PHE HZ . . 4.750 2.722 2.294 3.237 . 0 0 "[ . 1 . 2]" 1
1993 1 83 HIS HD2 1 84 CYS H . . 4.260 3.866 3.493 4.208 . 0 0 "[ . 1 . 2]" 1
1994 1 83 HIS HD2 1 104 PHE QE . . 3.870 3.083 2.241 3.720 . 0 0 "[ . 1 . 2]" 1
1995 1 83 HIS HD2 1 105 ILE MD . . 3.340 3.156 2.866 3.348 0.008 14 0 "[ . 1 . 2]" 1
1996 1 83 HIS HE1 1 85 LYS HB2 . . 4.150 2.439 2.091 3.806 . 0 0 "[ . 1 . 2]" 1
1997 1 83 HIS HE1 1 85 LYS QB . . 3.630 2.354 2.035 2.808 . 0 0 "[ . 1 . 2]" 1
1998 1 83 HIS HE1 1 85 LYS HB3 . . 4.150 3.479 2.795 3.974 . 0 0 "[ . 1 . 2]" 1
1999 1 83 HIS HE1 1 85 LYS HD2 . . 4.510 2.492 1.997 3.018 . 0 0 "[ . 1 . 2]" 1
2000 1 83 HIS HE1 1 85 LYS HD3 . . 4.510 3.777 2.810 4.502 . 0 0 "[ . 1 . 2]" 1
2001 1 83 HIS HE1 1 85 LYS HG2 . . 5.500 4.732 4.319 5.063 . 0 0 "[ . 1 . 2]" 1
2002 1 83 HIS HE1 1 85 LYS HG3 . . 5.500 3.970 3.320 4.810 . 0 0 "[ . 1 . 2]" 1
2003 1 83 HIS HE1 1 105 ILE MD . . 5.500 4.861 4.175 5.401 . 0 0 "[ . 1 . 2]" 1
2004 1 84 CYS H 1 84 CYS HB2 . . 3.880 2.669 2.548 2.780 . 0 0 "[ . 1 . 2]" 1
2005 1 84 CYS H 1 84 CYS HB3 . . 3.830 2.723 2.527 2.890 . 0 0 "[ . 1 . 2]" 1
2006 1 84 CYS H 1 85 LYS H . . 4.820 4.319 4.124 4.446 . 0 0 "[ . 1 . 2]" 1
2007 1 84 CYS HA 1 85 LYS H . . 2.950 2.145 2.138 2.174 . 0 0 "[ . 1 . 2]" 1
2008 1 84 CYS HA 1 88 GLU H . . 5.400 4.990 3.576 5.307 . 0 0 "[ . 1 . 2]" 1
2009 1 84 CYS HA 1 89 PHE HA . . 3.640 2.527 2.031 2.795 . 0 0 "[ . 1 . 2]" 1
2010 1 84 CYS HA 1 89 PHE QD . . 4.350 3.456 2.933 4.142 . 0 0 "[ . 1 . 2]" 1
2011 1 84 CYS HA 1 90 ARG H . . 4.260 3.986 3.452 4.266 0.006 8 0 "[ . 1 . 2]" 1
2012 1 84 CYS HB2 1 85 LYS H . . 4.680 4.456 4.310 4.596 . 0 0 "[ . 1 . 2]" 1
2013 1 84 CYS HB2 1 89 PHE HA . . 5.310 4.297 3.806 4.546 . 0 0 "[ . 1 . 2]" 1
2014 1 84 CYS HB2 1 89 PHE QD . . 4.140 3.212 2.944 3.603 . 0 0 "[ . 1 . 2]" 1
2015 1 84 CYS HB2 1 89 PHE QE . . 4.620 2.556 1.999 3.467 . 0 0 "[ . 1 . 2]" 1
2016 1 84 CYS HB3 1 85 LYS H . . 4.730 4.189 4.009 4.324 . 0 0 "[ . 1 . 2]" 1
2017 1 84 CYS HB3 1 89 PHE QD . . 5.290 4.793 4.540 5.201 . 0 0 "[ . 1 . 2]" 1
2018 1 84 CYS HB3 1 89 PHE QE . . 4.980 4.020 3.631 4.798 . 0 0 "[ . 1 . 2]" 1
2019 1 84 CYS HG 1 85 LYS H . . 5.000 3.733 2.857 4.987 . 0 0 "[ . 1 . 2]" 1
2020 1 85 LYS H 1 85 LYS HB2 . . 3.990 3.165 2.975 3.847 . 0 0 "[ . 1 . 2]" 1
2021 1 85 LYS H 1 85 LYS QB . . 3.410 2.529 2.446 2.793 . 0 0 "[ . 1 . 2]" 1
2022 1 85 LYS H 1 85 LYS HB3 . . 3.990 2.664 2.553 2.868 . 0 0 "[ . 1 . 2]" 1
2023 1 85 LYS H 1 85 LYS HG2 . . 5.480 4.330 2.571 4.581 . 0 0 "[ . 1 . 2]" 1
2024 1 85 LYS H 1 87 GLY H . . 4.850 3.781 3.452 4.636 . 0 0 "[ . 1 . 2]" 1
2025 1 85 LYS H 1 88 GLU H . . 3.770 3.566 2.470 3.773 0.003 13 0 "[ . 1 . 2]" 1
2026 1 85 LYS H 1 88 GLU QB . . 4.250 3.335 2.810 4.177 . 0 0 "[ . 1 . 2]" 1
2027 1 85 LYS H 1 89 PHE HA . . 4.110 3.585 3.308 4.006 . 0 0 "[ . 1 . 2]" 1
2028 1 85 LYS QD 1 110 TRP HH2 . . 4.510 3.001 2.318 3.613 . 0 0 "[ . 1 . 2]" 1
2029 1 85 LYS QD 1 110 TRP HZ2 . . 4.350 3.305 2.871 3.913 . 0 0 "[ . 1 . 2]" 1
2030 1 85 LYS HD2 1 110 TRP HH2 . . 5.360 3.716 2.668 4.694 . 0 0 "[ . 1 . 2]" 1
2031 1 85 LYS HD3 1 110 TRP HH2 . . 5.360 3.255 2.545 3.757 . 0 0 "[ . 1 . 2]" 1
2032 1 85 LYS QE 1 85 LYS HG2 . . 3.470 2.704 2.432 3.451 . 0 0 "[ . 1 . 2]" 1
2033 1 85 LYS QE 1 85 LYS HG3 . . 3.250 2.504 2.147 2.934 . 0 0 "[ . 1 . 2]" 1
2034 1 85 LYS QE 1 110 TRP HH2 . . 3.520 2.484 1.990 3.359 . 0 0 "[ . 1 . 2]" 1
2035 1 85 LYS HE2 1 85 LYS HG2 . . 4.070 3.241 2.479 3.758 . 0 0 "[ . 1 . 2]" 1
2036 1 85 LYS HE2 1 85 LYS HG3 . . 3.710 2.918 2.167 3.716 0.006 1 0 "[ . 1 . 2]" 1
2037 1 85 LYS HE2 1 110 TRP HH2 . . 4.130 3.433 2.170 4.136 0.006 18 0 "[ . 1 . 2]" 1
2038 1 85 LYS HE2 1 110 TRP HZ2 . . 4.330 3.330 1.999 4.315 . 0 0 "[ . 1 . 2]" 1
2039 1 85 LYS HE3 1 85 LYS HG2 . . 4.070 3.294 2.503 4.211 0.141 14 0 "[ . 1 . 2]" 1
2040 1 85 LYS HE3 1 85 LYS HG3 . . 3.710 3.203 2.445 3.694 . 0 0 "[ . 1 . 2]" 1
2041 1 85 LYS HE3 1 110 TRP HH2 . . 4.130 2.957 2.000 4.141 0.011 12 0 "[ . 1 . 2]" 1
2042 1 85 LYS HE3 1 110 TRP HZ2 . . 4.330 3.189 2.109 4.347 0.017 16 0 "[ . 1 . 2]" 1
2043 1 85 LYS HG2 1 86 ASP H . . 4.710 3.592 2.860 4.550 . 0 0 "[ . 1 . 2]" 1
2044 1 85 LYS HG2 1 86 ASP HB2 . . 4.620 2.974 2.526 4.430 . 0 0 "[ . 1 . 2]" 1
2045 1 85 LYS HG2 1 86 ASP QB . . 4.060 2.868 2.508 3.890 . 0 0 "[ . 1 . 2]" 1
2046 1 85 LYS HG2 1 86 ASP HB3 . . 4.620 4.076 3.252 4.620 . 0 0 "[ . 1 . 2]" 1
2047 1 85 LYS HG3 1 86 ASP H . . 4.430 3.665 3.298 4.188 . 0 0 "[ . 1 . 2]" 1
2048 1 86 ASP H 1 87 GLY H . . 4.180 2.800 2.621 2.942 . 0 0 "[ . 1 . 2]" 1
2049 1 86 ASP HA 1 88 GLU H . . 4.640 4.565 4.054 4.660 0.020 18 0 "[ . 1 . 2]" 1
2050 1 86 ASP HB2 1 88 GLU H . . 4.900 4.338 3.567 4.896 . 0 0 "[ . 1 . 2]" 1
2051 1 86 ASP HB3 1 88 GLU H . . 4.900 4.002 3.417 4.830 . 0 0 "[ . 1 . 2]" 1
2052 1 87 GLY H 1 88 GLU H . . 3.530 3.013 2.418 3.204 . 0 0 "[ . 1 . 2]" 1
2053 1 87 GLY H 1 88 GLU QG . . 5.340 4.847 4.249 5.214 . 0 0 "[ . 1 . 2]" 1
2054 1 88 GLU H 1 88 GLU HB2 . . 3.730 2.680 2.341 3.544 . 0 0 "[ . 1 . 2]" 1
2055 1 88 GLU H 1 88 GLU QB . . 2.980 2.385 2.160 2.531 . 0 0 "[ . 1 . 2]" 1
2056 1 88 GLU H 1 88 GLU HB3 . . 3.730 3.330 2.181 3.738 0.008 12 0 "[ . 1 . 2]" 1
2057 1 88 GLU H 1 88 GLU HG2 . . 4.090 2.863 2.129 3.951 . 0 0 "[ . 1 . 2]" 1
2058 1 88 GLU H 1 88 GLU QG . . 3.310 2.470 2.108 3.072 . 0 0 "[ . 1 . 2]" 1
2059 1 88 GLU H 1 88 GLU HG3 . . 4.090 3.340 2.230 4.070 . 0 0 "[ . 1 . 2]" 1
2060 1 88 GLU HA 1 88 GLU HG2 . . 4.020 2.931 2.341 3.798 . 0 0 "[ . 1 . 2]" 1
2061 1 88 GLU HA 1 88 GLU QG . . 3.480 2.756 2.283 3.304 . 0 0 "[ . 1 . 2]" 1
2062 1 88 GLU HA 1 88 GLU HG3 . . 4.020 3.492 2.837 3.796 . 0 0 "[ . 1 . 2]" 1
2063 1 88 GLU HA 1 89 PHE H . . 3.160 2.294 2.139 2.482 . 0 0 "[ . 1 . 2]" 1
2064 1 88 GLU QB 1 89 PHE H . . 3.890 2.789 2.220 3.536 . 0 0 "[ . 1 . 2]" 1
2065 1 88 GLU HB2 1 89 PHE H . . 4.630 3.734 2.634 4.445 . 0 0 "[ . 1 . 2]" 1
2066 1 88 GLU HB3 1 89 PHE H . . 4.630 3.101 2.242 4.285 . 0 0 "[ . 1 . 2]" 1
2067 1 88 GLU QG 1 89 PHE H . . 4.610 4.000 2.832 4.549 . 0 0 "[ . 1 . 2]" 1
2068 1 89 PHE H 1 89 PHE HB2 . . 3.630 2.577 2.252 2.806 . 0 0 "[ . 1 . 2]" 1
2069 1 89 PHE H 1 89 PHE HB3 . . 4.160 3.718 3.519 3.838 . 0 0 "[ . 1 . 2]" 1
2070 1 89 PHE H 1 89 PHE QD . . 3.970 3.161 2.261 3.964 . 0 0 "[ . 1 . 2]" 1
2071 1 89 PHE H 1 90 ARG H . . 5.040 4.392 4.054 4.609 . 0 0 "[ . 1 . 2]" 1
2072 1 89 PHE H 1 115 PRO HB2 . . 4.700 3.736 3.135 4.324 . 0 0 "[ . 1 . 2]" 1
2073 1 89 PHE H 1 115 PRO HB3 . . 4.600 3.950 3.355 4.579 . 0 0 "[ . 1 . 2]" 1
2074 1 89 PHE H 1 116 VAL H . . 4.140 3.484 2.904 4.115 . 0 0 "[ . 1 . 2]" 1
2075 1 89 PHE H 1 116 VAL QG . . 4.370 3.290 2.767 3.989 . 0 0 "[ . 1 . 2]" 1
2076 1 89 PHE HA 1 89 PHE QD . . 3.940 2.811 2.419 3.033 . 0 0 "[ . 1 . 2]" 1
2077 1 89 PHE HA 1 90 ARG H . . 3.020 2.251 2.139 2.446 . 0 0 "[ . 1 . 2]" 1
2078 1 89 PHE HB2 1 90 ARG H . . 5.210 4.076 3.682 4.447 . 0 0 "[ . 1 . 2]" 1
2079 1 89 PHE HB2 1 116 VAL HB . . 4.940 4.395 2.058 4.941 0.001 9 0 "[ . 1 . 2]" 1
2080 1 89 PHE HB2 1 116 VAL QG . . 3.580 1.995 1.814 2.777 . 0 0 "[ . 1 . 2]" 1
2081 1 89 PHE HB3 1 90 ARG H . . 4.230 2.951 2.358 3.564 . 0 0 "[ . 1 . 2]" 1
2082 1 89 PHE HB3 1 116 VAL H . . 5.340 4.200 3.525 4.923 . 0 0 "[ . 1 . 2]" 1
2083 1 89 PHE HB3 1 116 VAL QG . . 3.810 2.409 1.923 2.954 . 0 0 "[ . 1 . 2]" 1
2084 1 89 PHE QD 1 90 ARG H . . 5.030 3.595 3.077 4.183 . 0 0 "[ . 1 . 2]" 1
2085 1 89 PHE QD 1 116 VAL QG . . 4.090 3.241 2.867 3.679 . 0 0 "[ . 1 . 2]" 1
2086 1 90 ARG H 1 90 ARG HB2 . . 3.670 2.752 2.538 2.935 . 0 0 "[ . 1 . 2]" 1
2087 1 90 ARG H 1 90 ARG HB3 . . 4.100 3.797 3.699 3.898 . 0 0 "[ . 1 . 2]" 1
2088 1 90 ARG H 1 90 ARG HG2 . . 4.780 4.254 3.128 4.564 . 0 0 "[ . 1 . 2]" 1
2089 1 90 ARG H 1 90 ARG QG . . 4.070 3.438 3.021 3.743 . 0 0 "[ . 1 . 2]" 1
2090 1 90 ARG H 1 90 ARG HG3 . . 4.780 3.665 3.338 4.037 . 0 0 "[ . 1 . 2]" 1
2091 1 90 ARG H 1 91 ARG H . . 4.850 4.044 3.775 4.209 . 0 0 "[ . 1 . 2]" 1
2092 1 90 ARG HA 1 91 ARG H . . 2.920 2.150 2.140 2.177 . 0 0 "[ . 1 . 2]" 1
2093 1 90 ARG HA 1 91 ARG QB . . 4.860 4.079 4.068 4.087 . 0 0 "[ . 1 . 2]" 1
2094 1 90 ARG HA 1 113 ILE MG . . 3.930 3.397 3.018 3.700 . 0 0 "[ . 1 . 2]" 1
2095 1 90 ARG HA 1 116 VAL QG . . 4.040 3.134 2.186 3.472 . 0 0 "[ . 1 . 2]" 1
2096 1 90 ARG HB2 1 91 ARG H . . 4.710 4.424 4.241 4.541 . 0 0 "[ . 1 . 2]" 1
2097 1 90 ARG HB3 1 90 ARG QD . . 3.720 2.276 2.013 2.402 . 0 0 "[ . 1 . 2]" 1
2098 1 90 ARG HB3 1 90 ARG HE . . 5.310 4.388 3.940 4.582 . 0 0 "[ . 1 . 2]" 1
2099 1 90 ARG HB3 1 91 ARG H . . 4.730 3.557 3.278 3.824 . 0 0 "[ . 1 . 2]" 1
2100 1 90 ARG HB3 1 92 TYR HA . . 5.500 5.101 4.817 5.471 . 0 0 "[ . 1 . 2]" 1
2101 1 90 ARG HB3 1 104 PHE QE . . 5.500 4.401 4.094 4.727 . 0 0 "[ . 1 . 2]" 1
2102 1 90 ARG HB3 1 113 ILE MG . . 3.200 2.641 2.095 3.112 . 0 0 "[ . 1 . 2]" 1
2103 1 90 ARG QD 1 110 TRP QB . . 3.990 2.104 1.875 3.593 . 0 0 "[ . 1 . 2]" 1
2104 1 90 ARG QD 1 110 TRP HE3 . . 4.140 2.392 1.995 4.009 . 0 0 "[ . 1 . 2]" 1
2105 1 90 ARG QD 1 113 ILE H . . 4.080 3.477 2.935 3.675 . 0 0 "[ . 1 . 2]" 1
2106 1 90 ARG QD 1 113 ILE HB . . 3.420 2.209 1.979 2.442 . 0 0 "[ . 1 . 2]" 1
2107 1 90 ARG QD 1 113 ILE MG . . 3.930 2.987 2.482 3.385 . 0 0 "[ . 1 . 2]" 1
2108 1 90 ARG HD2 1 113 ILE HB . . 4.050 3.695 2.207 4.056 0.006 19 0 "[ . 1 . 2]" 1
2109 1 90 ARG HD3 1 113 ILE HB . . 4.050 2.313 1.992 3.963 . 0 0 "[ . 1 . 2]" 1
2110 1 90 ARG HE 1 110 TRP QB . . 5.060 4.332 3.799 4.950 . 0 0 "[ . 1 . 2]" 1
2111 1 90 ARG HE 1 110 TRP HE3 . . 4.370 3.479 2.586 4.366 . 0 0 "[ . 1 . 2]" 1
2112 1 90 ARG HE 1 111 LYS HA . . 4.680 3.568 3.120 4.458 . 0 0 "[ . 1 . 2]" 1
2113 1 90 ARG HE 1 113 ILE H . . 4.650 3.999 2.655 4.504 . 0 0 "[ . 1 . 2]" 1
2114 1 90 ARG HE 1 113 ILE HB . . 4.680 3.815 3.060 4.303 . 0 0 "[ . 1 . 2]" 1
2115 1 90 ARG HE 1 113 ILE MG . . 4.500 4.163 3.828 4.459 . 0 0 "[ . 1 . 2]" 1
2116 1 90 ARG HE 1 115 PRO HB3 . . 4.600 3.721 2.683 4.279 . 0 0 "[ . 1 . 2]" 1
2117 1 90 ARG HE 1 115 PRO HD2 . . 4.940 4.173 3.664 4.973 0.033 10 0 "[ . 1 . 2]" 1
2118 1 90 ARG HE 1 115 PRO QD . . 4.090 2.493 1.963 3.226 . 0 0 "[ . 1 . 2]" 1
2119 1 90 ARG HE 1 115 PRO HD3 . . 4.940 2.515 1.970 3.268 . 0 0 "[ . 1 . 2]" 1
2120 1 90 ARG HE 1 115 PRO QG . . 4.840 3.943 3.143 4.689 . 0 0 "[ . 1 . 2]" 1
2121 1 90 ARG QG 1 115 PRO HA . . 3.670 2.091 1.941 2.892 . 0 0 "[ . 1 . 2]" 1
2122 1 90 ARG QG 1 115 PRO HB3 . . 4.410 2.598 2.083 3.723 . 0 0 "[ . 1 . 2]" 1
2123 1 90 ARG QG 1 116 VAL H . . 5.080 3.778 3.057 4.250 . 0 0 "[ . 1 . 2]" 1
2124 1 90 ARG QG 1 116 VAL QG . . 5.280 4.011 3.187 4.409 . 0 0 "[ . 1 . 2]" 1
2125 1 90 ARG HG2 1 115 PRO HA . . 4.180 2.144 1.993 2.938 . 0 0 "[ . 1 . 2]" 1
2126 1 90 ARG HG3 1 115 PRO HA . . 4.180 3.025 2.497 4.321 0.141 10 0 "[ . 1 . 2]" 1
2127 1 90 ARG QH2 1 115 PRO QD . . 4.610 2.514 1.943 3.733 . 0 0 "[ . 1 . 2]" 1
2128 1 90 ARG QH2 1 115 PRO QG . . 4.540 2.782 1.964 4.011 . 0 0 "[ . 1 . 2]" 1
2129 1 91 ARG H 1 91 ARG HB2 . . 3.290 2.566 2.269 2.720 . 0 0 "[ . 1 . 2]" 1
2130 1 91 ARG H 1 91 ARG HB3 . . 3.290 2.503 2.353 2.830 . 0 0 "[ . 1 . 2]" 1
2131 1 91 ARG H 1 91 ARG QG . . 4.670 3.957 3.918 3.984 . 0 0 "[ . 1 . 2]" 1
2132 1 91 ARG H 1 92 TYR H . . 4.680 4.545 4.450 4.645 . 0 0 "[ . 1 . 2]" 1
2133 1 91 ARG H 1 113 ILE MG . . 3.520 3.276 2.806 3.496 . 0 0 "[ . 1 . 2]" 1
2134 1 91 ARG H 1 116 VAL H . . 5.400 4.893 4.147 5.407 0.007 19 0 "[ . 1 . 2]" 1
2135 1 91 ARG H 1 116 VAL MG1 . . 4.720 3.519 2.673 4.680 . 0 0 "[ . 1 . 2]" 1
2136 1 91 ARG H 1 116 VAL QG . . 4.140 3.182 2.494 3.829 . 0 0 "[ . 1 . 2]" 1
2137 1 91 ARG H 1 116 VAL MG2 . . 4.720 4.239 2.504 4.722 0.002 5 0 "[ . 1 . 2]" 1
2138 1 91 ARG HA 1 91 ARG QD . . 4.620 3.826 3.671 4.132 . 0 0 "[ . 1 . 2]" 1
2139 1 91 ARG HA 1 91 ARG HG2 . . 3.940 3.373 3.179 3.549 . 0 0 "[ . 1 . 2]" 1
2140 1 91 ARG HA 1 91 ARG QG . . 3.390 2.423 2.236 2.571 . 0 0 "[ . 1 . 2]" 1
2141 1 91 ARG HA 1 91 ARG HG3 . . 3.940 2.485 2.282 2.652 . 0 0 "[ . 1 . 2]" 1
2142 1 91 ARG HA 1 92 TYR H . . 2.860 2.172 2.140 2.324 . 0 0 "[ . 1 . 2]" 1
2143 1 91 ARG HA 1 92 TYR HA . . 4.490 4.357 4.321 4.391 . 0 0 "[ . 1 . 2]" 1
2144 1 91 ARG HA 1 92 TYR HB2 . . 4.980 4.424 4.258 4.785 . 0 0 "[ . 1 . 2]" 1
2145 1 91 ARG HA 1 92 TYR QB . . 4.360 4.075 4.030 4.118 . 0 0 "[ . 1 . 2]" 1
2146 1 91 ARG HA 1 92 TYR HB3 . . 4.980 4.799 4.417 4.977 . 0 0 "[ . 1 . 2]" 1
2147 1 91 ARG QB 1 91 ARG QD . . 2.990 2.168 2.065 2.264 . 0 0 "[ . 1 . 2]" 1
2148 1 91 ARG QB 1 92 TYR H . . 4.010 3.713 3.408 3.856 . 0 0 "[ . 1 . 2]" 1
2149 1 91 ARG QB 1 116 VAL QG . . 4.460 3.405 2.688 4.144 . 0 0 "[ . 1 . 2]" 1
2150 1 91 ARG HB2 1 91 ARG HD2 . . 3.940 3.233 2.277 3.606 . 0 0 "[ . 1 . 2]" 1
2151 1 91 ARG HB2 1 91 ARG HD3 . . 3.940 2.426 2.130 3.592 . 0 0 "[ . 1 . 2]" 1
2152 1 91 ARG HB2 1 92 TYR H . . 4.740 4.182 3.870 4.338 . 0 0 "[ . 1 . 2]" 1
2153 1 91 ARG HB3 1 91 ARG HD2 . . 3.940 3.686 2.692 3.924 . 0 0 "[ . 1 . 2]" 1
2154 1 91 ARG HB3 1 91 ARG HD3 . . 3.940 3.044 2.537 3.755 . 0 0 "[ . 1 . 2]" 1
2155 1 91 ARG HB3 1 92 TYR H . . 4.740 4.163 3.783 4.397 . 0 0 "[ . 1 . 2]" 1
2156 1 91 ARG QD 1 92 TYR H . . 5.130 4.595 4.022 4.892 . 0 0 "[ . 1 . 2]" 1
2157 1 91 ARG QD 1 93 GLN HG2 . . 5.340 4.287 3.227 5.062 . 0 0 "[ . 1 . 2]" 1
2158 1 91 ARG QG 1 93 GLN H . . 5.330 3.975 2.466 4.865 . 0 0 "[ . 1 . 2]" 1
2159 1 91 ARG QG 1 93 GLN HA . . 5.340 3.896 3.209 4.352 . 0 0 "[ . 1 . 2]" 1
2160 1 91 ARG QG 1 93 GLN QE . . 4.600 3.754 2.925 4.534 . 0 0 "[ . 1 . 2]" 1
2161 1 91 ARG QG 1 93 GLN HG2 . . 3.920 2.979 2.143 3.582 . 0 0 "[ . 1 . 2]" 1
2162 1 91 ARG QG 1 93 GLN HG3 . . 3.730 3.112 2.005 3.721 . 0 0 "[ . 1 . 2]" 1
2163 1 91 ARG HG2 1 92 TYR H . . 3.870 3.394 2.300 3.784 . 0 0 "[ . 1 . 2]" 1
2164 1 91 ARG HG3 1 92 TYR H . . 3.870 2.792 2.127 3.172 . 0 0 "[ . 1 . 2]" 1
2165 1 92 TYR H 1 92 TYR HB2 . . 3.380 2.434 2.263 2.820 . 0 0 "[ . 1 . 2]" 1
2166 1 92 TYR H 1 92 TYR QB . . 2.940 2.236 2.177 2.330 . 0 0 "[ . 1 . 2]" 1
2167 1 92 TYR H 1 92 TYR HB3 . . 3.380 2.676 2.315 2.831 . 0 0 "[ . 1 . 2]" 1
2168 1 92 TYR HA 1 92 TYR QD . . 3.900 2.670 1.976 3.035 . 0 0 "[ . 1 . 2]" 1
2169 1 92 TYR HA 1 93 GLN HB2 . . 4.860 4.492 4.363 4.721 . 0 0 "[ . 1 . 2]" 1
2170 1 92 TYR HA 1 94 GLY H . . 4.820 4.638 3.610 4.824 0.004 13 0 "[ . 1 . 2]" 1
2171 1 92 TYR HA 1 104 PHE QE . . 4.750 3.600 3.064 4.074 . 0 0 "[ . 1 . 2]" 1
2172 1 92 TYR HA 1 113 ILE MD . . 3.870 3.074 2.470 3.454 . 0 0 "[ . 1 . 2]" 1
2173 1 92 TYR QD 1 101 PHE QE . . 4.900 3.621 2.688 3.943 . 0 0 "[ . 1 . 2]" 1
2174 1 92 TYR QD 1 104 PHE QE . . 4.590 2.943 2.586 3.564 . 0 0 "[ . 1 . 2]" 1
2175 1 92 TYR QE 1 92 TYR HH . . 3.040 2.378 2.210 2.637 . 0 0 "[ . 1 . 2]" 1
2176 1 92 TYR QE 1 94 GLY H . . 4.180 3.469 2.842 4.099 . 0 0 "[ . 1 . 2]" 1
2177 1 92 TYR QE 1 94 GLY HA2 . . 4.830 4.313 3.836 4.756 . 0 0 "[ . 1 . 2]" 1
2178 1 92 TYR QE 1 94 GLY QA . . 4.230 2.757 2.251 3.209 . 0 0 "[ . 1 . 2]" 1
2179 1 92 TYR QE 1 94 GLY HA3 . . 4.830 2.792 2.266 3.263 . 0 0 "[ . 1 . 2]" 1
2180 1 92 TYR QE 1 95 PRO QD . . 5.110 3.490 2.812 4.074 . 0 0 "[ . 1 . 2]" 1
2181 1 92 TYR QE 1 95 PRO HG2 . . 5.060 4.442 3.858 5.061 0.001 1 0 "[ . 1 . 2]" 1
2182 1 92 TYR QE 1 96 ARG HA . . 3.270 2.358 1.997 2.858 . 0 0 "[ . 1 . 2]" 1
2183 1 92 TYR QE 1 96 ARG HB2 . . 4.930 4.472 3.498 4.940 0.010 19 0 "[ . 1 . 2]" 1
2184 1 92 TYR QE 1 96 ARG QB . . 4.300 3.891 3.306 4.277 . 0 0 "[ . 1 . 2]" 1
2185 1 92 TYR QE 1 96 ARG HB3 . . 4.930 4.357 3.426 4.783 . 0 0 "[ . 1 . 2]" 1
2186 1 92 TYR QE 1 100 ASP HB2 . . 5.250 4.831 3.836 5.255 0.005 5 0 "[ . 1 . 2]" 1
2187 1 92 TYR QE 1 100 ASP QB . . 4.390 3.739 3.023 3.974 . 0 0 "[ . 1 . 2]" 1
2188 1 92 TYR QE 1 100 ASP HB3 . . 5.250 3.904 3.165 4.204 . 0 0 "[ . 1 . 2]" 1
2189 1 92 TYR QE 1 101 PHE HA . . 4.530 3.016 2.387 3.661 . 0 0 "[ . 1 . 2]" 1
2190 1 92 TYR QE 1 101 PHE QD . . 3.640 2.642 2.140 3.642 0.002 1 0 "[ . 1 . 2]" 1
2191 1 92 TYR QE 1 101 PHE QE . . 3.370 3.194 2.541 3.376 0.006 1 0 "[ . 1 . 2]" 1
2192 1 92 TYR QE 1 101 PHE HZ . . 5.050 4.524 3.843 5.043 . 0 0 "[ . 1 . 2]" 1
2193 1 92 TYR QE 1 104 PHE H . . 5.030 4.632 4.257 5.006 . 0 0 "[ . 1 . 2]" 1
2194 1 92 TYR QE 1 104 PHE HB2 . . 3.400 2.613 2.036 3.193 . 0 0 "[ . 1 . 2]" 1
2195 1 92 TYR QE 1 104 PHE HB3 . . 4.980 2.672 2.084 3.378 . 0 0 "[ . 1 . 2]" 1
2196 1 92 TYR QE 1 104 PHE QD . . 3.640 2.641 2.243 3.232 . 0 0 "[ . 1 . 2]" 1
2197 1 92 TYR QE 1 104 PHE QE . . 4.650 3.804 3.402 4.293 . 0 0 "[ . 1 . 2]" 1
2198 1 92 TYR QE 1 104 PHE HZ . . 5.470 4.898 4.576 5.322 . 0 0 "[ . 1 . 2]" 1
2199 1 92 TYR QE 1 105 ILE MD . . 5.500 4.670 4.123 5.500 0.000 20 0 "[ . 1 . 2]" 1
2200 1 92 TYR QE 1 113 ILE MD . . 5.500 5.080 4.118 5.420 . 0 0 "[ . 1 . 2]" 1
2201 1 92 TYR HH 1 94 GLY QA . . 4.680 3.558 2.077 4.400 . 0 0 "[ . 1 . 2]" 1
2202 1 92 TYR HH 1 95 PRO QD . . 4.120 3.435 2.011 4.124 0.004 7 0 "[ . 1 . 2]" 1
2203 1 92 TYR HH 1 96 ARG HA . . 4.820 3.485 2.218 4.424 . 0 0 "[ . 1 . 2]" 1
2204 1 92 TYR HH 1 97 THR H . . 4.410 3.482 2.557 4.403 . 0 0 "[ . 1 . 2]" 1
2205 1 92 TYR HH 1 100 ASP HB2 . . 4.180 3.533 2.574 4.186 0.006 9 0 "[ . 1 . 2]" 1
2206 1 92 TYR HH 1 100 ASP QB . . 3.600 2.288 1.959 2.735 . 0 0 "[ . 1 . 2]" 1
2207 1 92 TYR HH 1 100 ASP HB3 . . 4.180 2.324 1.997 2.772 . 0 0 "[ . 1 . 2]" 1
2208 1 93 GLN H 1 93 GLN HB2 . . 4.050 2.747 2.262 3.579 . 0 0 "[ . 1 . 2]" 1
2209 1 93 GLN H 1 93 GLN HG2 . . 4.690 3.644 3.066 4.320 . 0 0 "[ . 1 . 2]" 1
2210 1 93 GLN H 1 93 GLN HG3 . . 4.190 3.146 2.433 3.889 . 0 0 "[ . 1 . 2]" 1
2211 1 93 GLN H 1 94 GLY H . . 3.900 3.318 2.716 3.902 0.002 9 0 "[ . 1 . 2]" 1
2212 1 93 GLN H 1 113 ILE MD . . 4.790 2.949 1.878 4.758 . 0 0 "[ . 1 . 2]" 1
2213 1 93 GLN HA 1 93 GLN HG2 . . 3.380 2.459 2.195 2.783 . 0 0 "[ . 1 . 2]" 1
2214 1 93 GLN HA 1 93 GLN HG3 . . 3.660 3.224 2.882 3.671 0.011 20 0 "[ . 1 . 2]" 1
2215 1 93 GLN HB2 1 93 GLN QE . . 4.510 3.888 3.027 4.340 . 0 0 "[ . 1 . 2]" 1
2216 1 93 GLN HB2 1 93 GLN HG3 . . 2.940 2.365 2.261 2.561 . 0 0 "[ . 1 . 2]" 1
2217 1 93 GLN QE 1 93 GLN HG3 . . 3.440 2.536 2.105 3.277 . 0 0 "[ . 1 . 2]" 1
2218 1 93 GLN QE 1 113 ILE MG . . 5.340 3.416 1.826 5.298 . 0 0 "[ . 1 . 2]" 1
2219 1 93 GLN HG3 1 113 ILE MD . . 4.020 3.398 2.089 3.966 . 0 0 "[ . 1 . 2]" 1
2220 1 94 GLY H 1 95 PRO QD . . 5.210 4.294 4.245 4.331 . 0 0 "[ . 1 . 2]" 1
2221 1 94 GLY QA 1 95 PRO QD . . 2.990 2.012 1.964 2.032 . 0 0 "[ . 1 . 2]" 1
2222 1 94 GLY QA 1 95 PRO HG3 . . 4.780 4.275 4.270 4.278 . 0 0 "[ . 1 . 2]" 1
2223 1 95 PRO HA 1 96 ARG H . . 3.500 3.351 2.765 3.475 . 0 0 "[ . 1 . 2]" 1
2224 1 95 PRO HA 1 97 THR MG . . 4.700 4.190 3.782 4.654 . 0 0 "[ . 1 . 2]" 1
2225 1 95 PRO QB 1 96 ARG H . . 4.070 3.496 1.813 3.739 . 0 0 "[ . 1 . 2]" 1
2226 1 95 PRO QB 1 97 THR H . . 5.060 3.563 2.789 3.973 . 0 0 "[ . 1 . 2]" 1
2227 1 95 PRO HB2 1 97 THR MG . . 3.690 2.108 1.962 2.322 . 0 0 "[ . 1 . 2]" 1
2228 1 95 PRO HB3 1 97 THR MG . . 3.690 3.608 3.450 3.705 0.015 17 0 "[ . 1 . 2]" 1
2229 1 95 PRO QD 1 97 THR H . . 5.350 3.973 3.732 4.785 . 0 0 "[ . 1 . 2]" 1
2230 1 95 PRO QD 1 100 ASP QB . . 3.920 3.051 2.792 3.437 . 0 0 "[ . 1 . 2]" 1
2231 1 95 PRO HG2 1 96 ARG H . . 3.560 3.081 2.661 3.694 0.134 19 0 "[ . 1 . 2]" 1
2232 1 95 PRO HG2 1 97 THR H . . 3.940 2.747 2.480 3.084 . 0 0 "[ . 1 . 2]" 1
2233 1 95 PRO HG2 1 97 THR MG . . 4.300 3.117 2.667 3.541 . 0 0 "[ . 1 . 2]" 1
2234 1 95 PRO HG2 1 100 ASP QB . . 4.350 2.472 1.961 2.843 . 0 0 "[ . 1 . 2]" 1
2235 1 95 PRO HG3 1 100 ASP H . . 5.500 5.377 5.034 5.517 0.017 7 0 "[ . 1 . 2]" 1
2236 1 95 PRO HG3 1 100 ASP QB . . 4.720 3.508 2.793 4.054 . 0 0 "[ . 1 . 2]" 1
2237 1 96 ARG H 1 97 THR H . . 4.510 2.748 2.594 2.978 . 0 0 "[ . 1 . 2]" 1
2238 1 96 ARG H 1 97 THR MG . . 4.510 4.147 2.733 4.491 . 0 0 "[ . 1 . 2]" 1
2239 1 96 ARG HA 1 96 ARG HD2 . . 4.930 4.599 4.416 4.841 . 0 0 "[ . 1 . 2]" 1
2240 1 96 ARG HA 1 96 ARG QD . . 4.340 3.998 3.764 4.265 . 0 0 "[ . 1 . 2]" 1
2241 1 96 ARG HA 1 96 ARG HD3 . . 4.930 4.416 4.035 4.743 . 0 0 "[ . 1 . 2]" 1
2242 1 96 ARG HA 1 97 THR H . . 2.910 2.723 2.616 2.851 . 0 0 "[ . 1 . 2]" 1
2243 1 96 ARG HA 1 101 PHE QE . . 3.700 2.946 2.500 3.372 . 0 0 "[ . 1 . 2]" 1
2244 1 96 ARG HA 1 101 PHE HZ . . 3.760 2.908 2.625 3.194 . 0 0 "[ . 1 . 2]" 1
2245 1 96 ARG QB 1 96 ARG QD . . 2.740 2.177 2.106 2.513 . 0 0 "[ . 1 . 2]" 1
2246 1 96 ARG QB 1 97 THR MG . . 5.340 4.059 3.819 4.705 . 0 0 "[ . 1 . 2]" 1
2247 1 96 ARG QB 1 101 PHE HZ . . 3.700 2.842 2.261 3.736 0.036 16 0 "[ . 1 . 2]" 1
2248 1 96 ARG HB2 1 96 ARG HD2 . . 3.680 2.641 2.345 3.735 0.055 16 0 "[ . 1 . 2]" 1
2249 1 96 ARG HB2 1 96 ARG HD3 . . 3.680 3.269 2.689 3.688 0.008 5 0 "[ . 1 . 2]" 1
2250 1 96 ARG HB2 1 97 THR H . . 5.290 4.341 4.174 4.595 . 0 0 "[ . 1 . 2]" 1
2251 1 96 ARG HB2 1 101 PHE QE . . 4.970 4.650 3.406 4.991 0.021 5 0 "[ . 1 . 2]" 1
2252 1 96 ARG HB2 1 101 PHE HZ . . 4.540 4.151 2.285 4.554 0.014 18 0 "[ . 1 . 2]" 1
2253 1 96 ARG HB3 1 96 ARG HD2 . . 3.680 2.842 2.438 3.587 . 0 0 "[ . 1 . 2]" 1
2254 1 96 ARG HB3 1 96 ARG HD3 . . 3.680 2.845 2.395 3.576 . 0 0 "[ . 1 . 2]" 1
2255 1 96 ARG HB3 1 97 THR H . . 5.290 4.442 4.271 4.647 . 0 0 "[ . 1 . 2]" 1
2256 1 96 ARG HB3 1 101 PHE QE . . 4.970 3.881 3.535 4.741 . 0 0 "[ . 1 . 2]" 1
2257 1 96 ARG HB3 1 101 PHE HZ . . 4.540 3.099 2.635 4.105 . 0 0 "[ . 1 . 2]" 1
2258 1 96 ARG QD 1 101 PHE HZ . . 4.500 4.071 3.472 4.503 0.003 14 0 "[ . 1 . 2]" 1
2259 1 96 ARG HD2 1 101 PHE HZ . . 5.270 4.862 3.672 5.283 0.013 4 0 "[ . 1 . 2]" 1
2260 1 96 ARG HD3 1 101 PHE HZ . . 5.270 4.531 3.874 5.276 0.006 14 0 "[ . 1 . 2]" 1
2261 1 97 THR H 1 97 THR HG1 . . 3.960 2.915 1.913 3.616 . 0 0 "[ . 1 . 2]" 1
2262 1 97 THR H 1 97 THR MG . . 3.460 2.895 2.448 3.142 . 0 0 "[ . 1 . 2]" 1
2263 1 97 THR H 1 98 LYS H . . 4.660 4.505 4.442 4.552 . 0 0 "[ . 1 . 2]" 1
2264 1 97 THR H 1 100 ASP H . . 4.390 4.184 3.977 4.400 0.010 19 0 "[ . 1 . 2]" 1
2265 1 97 THR H 1 100 ASP HB2 . . 3.840 2.775 2.155 3.488 . 0 0 "[ . 1 . 2]" 1
2266 1 97 THR H 1 100 ASP QB . . 3.150 2.372 2.133 2.672 . 0 0 "[ . 1 . 2]" 1
2267 1 97 THR H 1 100 ASP HB3 . . 3.840 2.954 2.245 3.729 . 0 0 "[ . 1 . 2]" 1
2268 1 97 THR H 1 101 PHE H . . 4.170 3.665 3.373 3.986 . 0 0 "[ . 1 . 2]" 1
2269 1 97 THR H 1 101 PHE QE . . 4.470 4.281 3.878 4.486 0.016 9 0 "[ . 1 . 2]" 1
2270 1 97 THR H 1 101 PHE HZ . . 5.500 4.804 4.218 5.128 . 0 0 "[ . 1 . 2]" 1
2271 1 97 THR HA 1 97 THR HB . . 3.020 2.515 2.415 2.576 . 0 0 "[ . 1 . 2]" 1
2272 1 97 THR HA 1 97 THR MG . . 3.140 2.264 2.110 2.410 . 0 0 "[ . 1 . 2]" 1
2273 1 97 THR HA 1 98 LYS H . . 3.060 2.271 2.185 2.404 . 0 0 "[ . 1 . 2]" 1
2274 1 97 THR HA 1 98 LYS HA . . 5.140 4.304 4.295 4.323 . 0 0 "[ . 1 . 2]" 1
2275 1 97 THR HA 1 98 LYS HB2 . . 4.520 4.409 4.329 4.503 . 0 0 "[ . 1 . 2]" 1
2276 1 97 THR HA 1 98 LYS HB3 . . 5.500 5.173 4.925 5.332 . 0 0 "[ . 1 . 2]" 1
2277 1 97 THR HB 1 98 LYS H . . 3.340 2.755 2.378 3.063 . 0 0 "[ . 1 . 2]" 1
2278 1 97 THR HB 1 98 LYS HB3 . . 4.660 4.489 4.331 4.656 . 0 0 "[ . 1 . 2]" 1
2279 1 97 THR HB 1 99 LYS H . . 3.660 3.340 3.017 3.562 . 0 0 "[ . 1 . 2]" 1
2280 1 97 THR HB 1 100 ASP H . . 4.610 3.576 3.344 3.913 . 0 0 "[ . 1 . 2]" 1
2281 1 97 THR HG1 1 97 THR MG . . 3.470 2.733 2.129 3.041 . 0 0 "[ . 1 . 2]" 1
2282 1 97 THR HG1 1 99 LYS H . . 4.850 4.049 3.452 4.863 0.013 10 0 "[ . 1 . 2]" 1
2283 1 97 THR HG1 1 100 ASP H . . 3.600 2.284 1.887 2.998 . 0 0 "[ . 1 . 2]" 1
2284 1 97 THR MG 1 98 LYS H . . 4.070 3.677 3.527 3.872 . 0 0 "[ . 1 . 2]" 1
2285 1 97 THR MG 1 99 LYS H . . 5.040 4.841 4.563 5.027 . 0 0 "[ . 1 . 2]" 1
2286 1 97 THR MG 1 99 LYS HB3 . . 5.170 4.841 4.726 4.988 . 0 0 "[ . 1 . 2]" 1
2287 1 97 THR MG 1 99 LYS QD . . 5.500 5.328 4.959 5.535 0.035 20 0 "[ . 1 . 2]" 1
2288 1 97 THR MG 1 100 ASP H . . 4.690 4.470 4.282 4.628 . 0 0 "[ . 1 . 2]" 1
2289 1 98 LYS H 1 98 LYS HB2 . . 3.390 2.192 2.159 2.319 . 0 0 "[ . 1 . 2]" 1
2290 1 98 LYS H 1 98 LYS HB3 . . 3.380 2.987 2.761 3.104 . 0 0 "[ . 1 . 2]" 1
2291 1 98 LYS H 1 98 LYS HG2 . . 4.790 4.431 4.374 4.523 . 0 0 "[ . 1 . 2]" 1
2292 1 98 LYS H 1 98 LYS HG3 . . 4.550 4.082 3.978 4.300 . 0 0 "[ . 1 . 2]" 1
2293 1 98 LYS H 1 99 LYS H . . 3.590 3.164 3.020 3.268 . 0 0 "[ . 1 . 2]" 1
2294 1 98 LYS H 1 101 PHE QD . . 4.900 3.863 3.476 4.301 . 0 0 "[ . 1 . 2]" 1
2295 1 98 LYS HA 1 98 LYS HD2 . . 4.730 4.707 4.681 4.772 0.042 9 0 "[ . 1 . 2]" 1
2296 1 98 LYS HA 1 98 LYS HD3 . . 4.730 4.485 4.452 4.525 . 0 0 "[ . 1 . 2]" 1
2297 1 98 LYS HA 1 98 LYS HG2 . . 3.810 2.528 2.400 2.834 . 0 0 "[ . 1 . 2]" 1
2298 1 98 LYS HA 1 98 LYS HG3 . . 3.520 2.715 2.621 2.810 . 0 0 "[ . 1 . 2]" 1
2299 1 98 LYS HA 1 101 PHE H . . 4.270 4.013 3.750 4.124 . 0 0 "[ . 1 . 2]" 1
2300 1 98 LYS HA 1 101 PHE HB2 . . 3.960 3.058 2.688 3.289 . 0 0 "[ . 1 . 2]" 1
2301 1 98 LYS HA 1 101 PHE HB3 . . 4.780 4.539 4.210 4.722 . 0 0 "[ . 1 . 2]" 1
2302 1 98 LYS HA 1 101 PHE QD . . 3.170 1.982 1.971 2.000 . 0 0 "[ . 1 . 2]" 1
2303 1 98 LYS HA 1 101 PHE QE . . 4.510 3.666 3.223 3.971 . 0 0 "[ . 1 . 2]" 1
2304 1 98 LYS HB2 1 98 LYS QD . . 3.550 2.581 2.447 2.697 . 0 0 "[ . 1 . 2]" 1
2305 1 98 LYS HB2 1 98 LYS HE2 . . 4.800 3.778 3.555 4.261 . 0 0 "[ . 1 . 2]" 1
2306 1 98 LYS HB2 1 98 LYS QE . . 3.930 3.608 3.433 4.014 0.084 9 0 "[ . 1 . 2]" 1
2307 1 98 LYS HB2 1 98 LYS HE3 . . 4.800 4.598 4.417 4.904 0.104 9 0 "[ . 1 . 2]" 1
2308 1 98 LYS HB2 1 99 LYS H . . 3.810 3.338 3.245 3.555 . 0 0 "[ . 1 . 2]" 1
2309 1 98 LYS HB2 1 102 ILE MD . . 4.970 4.716 4.568 4.840 . 0 0 "[ . 1 . 2]" 1
2310 1 98 LYS HB3 1 98 LYS QD . . 3.340 2.421 2.271 2.542 . 0 0 "[ . 1 . 2]" 1
2311 1 98 LYS HB3 1 98 LYS HE2 . . 4.030 2.370 2.021 3.137 . 0 0 "[ . 1 . 2]" 1
2312 1 98 LYS HB3 1 98 LYS QE . . 3.340 2.333 2.005 3.022 . 0 0 "[ . 1 . 2]" 1
2313 1 98 LYS HB3 1 98 LYS HE3 . . 4.030 3.581 3.334 3.950 . 0 0 "[ . 1 . 2]" 1
2314 1 98 LYS HB3 1 99 LYS H . . 3.190 2.068 1.934 2.240 . 0 0 "[ . 1 . 2]" 1
2315 1 98 LYS HB3 1 99 LYS HA . . 4.400 3.854 3.779 4.036 . 0 0 "[ . 1 . 2]" 1
2316 1 98 LYS HB3 1 100 ASP H . . 5.500 5.054 4.834 5.220 . 0 0 "[ . 1 . 2]" 1
2317 1 98 LYS QE 1 98 LYS HG3 . . 3.480 3.250 3.210 3.293 . 0 0 "[ . 1 . 2]" 1
2318 1 98 LYS QE 1 99 LYS H . . 4.390 3.420 2.949 3.774 . 0 0 "[ . 1 . 2]" 1
2319 1 98 LYS QE 1 99 LYS HA . . 4.200 3.425 3.116 3.634 . 0 0 "[ . 1 . 2]" 1
2320 1 98 LYS QE 1 99 LYS HB2 . . 4.720 4.085 3.777 4.527 . 0 0 "[ . 1 . 2]" 1
2321 1 98 LYS HE2 1 98 LYS HG2 . . 3.690 2.631 2.097 2.940 . 0 0 "[ . 1 . 2]" 1
2322 1 98 LYS HE2 1 98 LYS HG3 . . 4.000 3.697 3.429 3.885 . 0 0 "[ . 1 . 2]" 1
2323 1 98 LYS HE2 1 99 LYS HA . . 4.830 3.558 3.250 3.822 . 0 0 "[ . 1 . 2]" 1
2324 1 98 LYS HE2 1 102 ILE MD . . 3.610 2.900 1.999 3.330 . 0 0 "[ . 1 . 2]" 1
2325 1 98 LYS HE3 1 98 LYS HG2 . . 3.690 2.541 2.170 3.405 . 0 0 "[ . 1 . 2]" 1
2326 1 98 LYS HE3 1 98 LYS HG3 . . 4.000 3.643 3.440 4.106 0.106 16 0 "[ . 1 . 2]" 1
2327 1 98 LYS HE3 1 99 LYS HA . . 4.830 4.523 4.001 4.855 0.025 9 0 "[ . 1 . 2]" 1
2328 1 98 LYS HE3 1 102 ILE MD . . 3.610 2.816 2.018 3.416 . 0 0 "[ . 1 . 2]" 1
2329 1 98 LYS HG2 1 99 LYS H . . 4.170 3.974 3.653 4.171 0.001 19 0 "[ . 1 . 2]" 1
2330 1 98 LYS HG2 1 102 ILE MD . . 3.270 2.690 2.424 2.868 . 0 0 "[ . 1 . 2]" 1
2331 1 98 LYS HG3 1 99 LYS H . . 5.020 4.760 4.603 4.892 . 0 0 "[ . 1 . 2]" 1
2332 1 98 LYS HG3 1 101 PHE QD . . 4.360 4.204 3.851 4.381 0.021 12 0 "[ . 1 . 2]" 1
2333 1 98 LYS HG3 1 102 ILE MD . . 4.420 4.145 3.692 4.361 . 0 0 "[ . 1 . 2]" 1
2334 1 99 LYS H 1 99 LYS HB2 . . 3.010 2.597 2.481 2.679 . 0 0 "[ . 1 . 2]" 1
2335 1 99 LYS H 1 99 LYS HB3 . . 2.980 2.472 2.374 2.602 . 0 0 "[ . 1 . 2]" 1
2336 1 99 LYS H 1 99 LYS QD . . 4.570 4.342 4.089 4.506 . 0 0 "[ . 1 . 2]" 1
2337 1 99 LYS H 1 99 LYS QE . . 5.500 5.095 4.492 5.589 0.089 16 0 "[ . 1 . 2]" 1
2338 1 99 LYS H 1 100 ASP H . . 3.260 3.107 3.013 3.262 0.002 10 0 "[ . 1 . 2]" 1
2339 1 99 LYS H 1 102 ILE MD . . 4.700 3.616 3.466 3.716 . 0 0 "[ . 1 . 2]" 1
2340 1 99 LYS HA 1 99 LYS HB2 . . 2.970 2.390 2.363 2.438 . 0 0 "[ . 1 . 2]" 1
2341 1 99 LYS HA 1 99 LYS QD . . 4.490 4.089 3.687 4.235 . 0 0 "[ . 1 . 2]" 1
2342 1 99 LYS HA 1 99 LYS HG2 . . 4.170 2.842 2.506 3.050 . 0 0 "[ . 1 . 2]" 1
2343 1 99 LYS HA 1 99 LYS QG . . 3.540 2.589 2.459 2.661 . 0 0 "[ . 1 . 2]" 1
2344 1 99 LYS HA 1 99 LYS HG3 . . 4.170 3.102 2.920 3.570 . 0 0 "[ . 1 . 2]" 1
2345 1 99 LYS HA 1 102 ILE H . . 3.930 3.905 3.751 3.993 0.063 9 0 "[ . 1 . 2]" 1
2346 1 99 LYS HA 1 102 ILE HB . . 3.610 3.367 3.147 3.462 . 0 0 "[ . 1 . 2]" 1
2347 1 99 LYS HA 1 102 ILE MD . . 3.370 1.946 1.877 2.013 . 0 0 "[ . 1 . 2]" 1
2348 1 99 LYS HA 1 102 ILE MG . . 4.620 4.531 4.347 4.639 0.019 17 0 "[ . 1 . 2]" 1
2349 1 99 LYS HB2 1 99 LYS QE . . 5.110 3.992 3.651 4.345 . 0 0 "[ . 1 . 2]" 1
2350 1 99 LYS HB2 1 100 ASP H . . 3.720 3.690 3.621 3.780 0.060 11 0 "[ . 1 . 2]" 1
2351 1 99 LYS HB3 1 99 LYS QE . . 4.770 3.104 2.333 3.859 . 0 0 "[ . 1 . 2]" 1
2352 1 99 LYS HB3 1 100 ASP H . . 4.070 2.208 2.108 2.335 . 0 0 "[ . 1 . 2]" 1
2353 1 99 LYS QD 1 100 ASP H . . 4.350 3.285 2.154 3.873 . 0 0 "[ . 1 . 2]" 1
2354 1 99 LYS QD 1 100 ASP HA . . 5.310 4.041 2.501 4.680 . 0 0 "[ . 1 . 2]" 1
2355 1 99 LYS QD 1 103 ASN HD21 . . 5.200 4.563 3.603 5.143 . 0 0 "[ . 1 . 2]" 1
2356 1 99 LYS QD 1 103 ASN QD . . 4.380 3.665 3.352 4.099 . 0 0 "[ . 1 . 2]" 1
2357 1 99 LYS QD 1 103 ASN HD22 . . 5.200 3.936 3.491 4.368 . 0 0 "[ . 1 . 2]" 1
2358 1 99 LYS QE 1 99 LYS HG2 . . 3.660 2.170 2.067 2.314 . 0 0 "[ . 1 . 2]" 1
2359 1 99 LYS QE 1 99 LYS HG3 . . 3.660 3.057 2.689 3.388 . 0 0 "[ . 1 . 2]" 1
2360 1 99 LYS QE 1 100 ASP HA . . 4.150 2.790 2.331 3.422 . 0 0 "[ . 1 . 2]" 1
2361 1 99 LYS QE 1 103 ASN H . . 5.500 4.918 3.864 5.510 0.010 10 0 "[ . 1 . 2]" 1
2362 1 99 LYS QE 1 103 ASN HD21 . . 3.890 3.062 1.864 3.896 0.006 20 0 "[ . 1 . 2]" 1
2363 1 99 LYS QE 1 103 ASN QD . . 3.320 2.418 1.714 3.283 . 0 0 "[ . 1 . 2]" 1
2364 1 99 LYS QE 1 103 ASN HD22 . . 3.890 2.573 1.873 3.838 . 0 0 "[ . 1 . 2]" 1
2365 1 99 LYS QG 1 100 ASP H . . 4.080 3.123 2.760 3.745 . 0 0 "[ . 1 . 2]" 1
2366 1 99 LYS QG 1 100 ASP HA . . 4.440 3.395 3.022 4.134 . 0 0 "[ . 1 . 2]" 1
2367 1 99 LYS QG 1 102 ILE MD . . 4.850 3.644 3.500 3.864 . 0 0 "[ . 1 . 2]" 1
2368 1 99 LYS QG 1 103 ASN QD . . 3.690 2.471 2.034 3.255 . 0 0 "[ . 1 . 2]" 1
2369 1 99 LYS HG2 1 100 ASP H . . 4.640 3.224 2.803 4.008 . 0 0 "[ . 1 . 2]" 1
2370 1 99 LYS HG2 1 103 ASN HD21 . . 5.380 3.335 2.816 3.865 . 0 0 "[ . 1 . 2]" 1
2371 1 99 LYS HG2 1 103 ASN HD22 . . 5.380 2.646 2.070 3.633 . 0 0 "[ . 1 . 2]" 1
2372 1 99 LYS HG3 1 100 ASP H . . 4.640 4.319 4.138 4.504 . 0 0 "[ . 1 . 2]" 1
2373 1 99 LYS HG3 1 103 ASN HD21 . . 5.380 4.817 3.970 5.381 0.001 9 0 "[ . 1 . 2]" 1
2374 1 99 LYS HG3 1 103 ASN HD22 . . 5.380 3.850 3.114 4.987 . 0 0 "[ . 1 . 2]" 1
2375 1 100 ASP H 1 100 ASP HB2 . . 3.750 2.310 2.182 2.465 . 0 0 "[ . 1 . 2]" 1
2376 1 100 ASP H 1 100 ASP QB . . 3.100 2.252 2.137 2.426 . 0 0 "[ . 1 . 2]" 1
2377 1 100 ASP H 1 100 ASP HB3 . . 3.750 3.213 2.742 3.611 . 0 0 "[ . 1 . 2]" 1
2378 1 100 ASP H 1 101 PHE H . . 3.310 3.137 2.978 3.206 . 0 0 "[ . 1 . 2]" 1
2379 1 100 ASP H 1 101 PHE HB2 . . 5.500 5.007 4.780 5.213 . 0 0 "[ . 1 . 2]" 1
2380 1 100 ASP HA 1 102 ILE HB . . 5.500 4.918 4.742 5.014 . 0 0 "[ . 1 . 2]" 1
2381 1 100 ASP HA 1 102 ILE MD . . 5.240 4.931 4.700 5.258 0.018 16 0 "[ . 1 . 2]" 1
2382 1 100 ASP HA 1 103 ASN QB . . 3.960 3.485 3.119 4.142 0.182 14 0 "[ . 1 . 2]" 1
2383 1 100 ASP HA 1 103 ASN HD21 . . 4.270 2.519 1.994 3.494 . 0 0 "[ . 1 . 2]" 1
2384 1 100 ASP HA 1 103 ASN QD . . 3.510 2.318 1.865 3.064 . 0 0 "[ . 1 . 2]" 1
2385 1 100 ASP HA 1 103 ASN HD22 . . 4.270 3.340 1.872 4.281 0.011 2 0 "[ . 1 . 2]" 1
2386 1 100 ASP QB 1 101 PHE H . . 3.350 2.218 2.073 2.368 . 0 0 "[ . 1 . 2]" 1
2387 1 100 ASP HB2 1 101 PHE H . . 4.010 3.005 2.394 3.600 . 0 0 "[ . 1 . 2]" 1
2388 1 100 ASP HB3 1 101 PHE H . . 4.010 2.511 2.092 3.120 . 0 0 "[ . 1 . 2]" 1
2389 1 101 PHE H 1 101 PHE HB2 . . 3.380 2.511 2.417 2.672 . 0 0 "[ . 1 . 2]" 1
2390 1 101 PHE H 1 101 PHE HB3 . . 3.730 3.613 3.602 3.621 . 0 0 "[ . 1 . 2]" 1
2391 1 101 PHE H 1 101 PHE QD . . 3.750 3.163 2.900 3.283 . 0 0 "[ . 1 . 2]" 1
2392 1 101 PHE H 1 102 ILE H . . 3.260 3.211 3.151 3.247 . 0 0 "[ . 1 . 2]" 1
2393 1 101 PHE H 1 102 ILE HB . . 5.240 5.079 4.979 5.149 . 0 0 "[ . 1 . 2]" 1
2394 1 101 PHE HA 1 101 PHE QD . . 3.070 2.030 1.930 2.405 . 0 0 "[ . 1 . 2]" 1
2395 1 101 PHE HA 1 101 PHE QE . . 4.600 4.236 4.174 4.360 . 0 0 "[ . 1 . 2]" 1
2396 1 101 PHE HA 1 104 PHE H . . 4.060 3.633 3.274 3.846 . 0 0 "[ . 1 . 2]" 1
2397 1 101 PHE HA 1 104 PHE HB3 . . 3.660 2.564 2.383 2.765 . 0 0 "[ . 1 . 2]" 1
2398 1 101 PHE HA 1 104 PHE QD . . 5.010 3.848 3.513 4.255 . 0 0 "[ . 1 . 2]" 1
2399 1 101 PHE HA 1 105 ILE H . . 4.890 4.543 4.325 4.707 . 0 0 "[ . 1 . 2]" 1
2400 1 101 PHE HB2 1 102 ILE H . . 3.560 2.263 2.123 2.396 . 0 0 "[ . 1 . 2]" 1
2401 1 101 PHE HB2 1 102 ILE MD . . 4.470 3.018 2.806 3.134 . 0 0 "[ . 1 . 2]" 1
2402 1 101 PHE HB3 1 102 ILE H . . 3.880 3.024 2.890 3.273 . 0 0 "[ . 1 . 2]" 1
2403 1 101 PHE HB3 1 102 ILE MD . . 5.250 4.011 3.814 4.247 . 0 0 "[ . 1 . 2]" 1
2404 1 101 PHE QD 1 102 ILE H . . 4.370 4.198 4.088 4.306 . 0 0 "[ . 1 . 2]" 1
2405 1 101 PHE QD 1 102 ILE MD . . 5.060 4.188 4.005 4.443 . 0 0 "[ . 1 . 2]" 1
2406 1 102 ILE H 1 102 ILE HB . . 3.080 2.558 2.476 2.632 . 0 0 "[ . 1 . 2]" 1
2407 1 102 ILE H 1 102 ILE MD . . 3.920 2.028 1.845 2.102 . 0 0 "[ . 1 . 2]" 1
2408 1 102 ILE H 1 102 ILE HG12 . . 3.960 3.890 3.810 4.001 0.041 9 0 "[ . 1 . 2]" 1
2409 1 102 ILE H 1 102 ILE HG13 . . 3.280 2.910 2.772 3.103 . 0 0 "[ . 1 . 2]" 1
2410 1 102 ILE H 1 102 ILE MG . . 3.950 3.784 3.767 3.793 . 0 0 "[ . 1 . 2]" 1
2411 1 102 ILE HA 1 102 ILE MD . . 4.120 3.299 3.173 3.375 . 0 0 "[ . 1 . 2]" 1
2412 1 102 ILE HA 1 102 ILE HG12 . . 3.720 3.411 3.384 3.443 . 0 0 "[ . 1 . 2]" 1
2413 1 102 ILE HA 1 102 ILE HG13 . . 3.630 2.186 2.117 2.236 . 0 0 "[ . 1 . 2]" 1
2414 1 102 ILE HA 1 102 ILE MG . . 3.220 2.511 2.454 2.583 . 0 0 "[ . 1 . 2]" 1
2415 1 102 ILE HA 1 105 ILE H . . 4.570 3.730 3.619 3.931 . 0 0 "[ . 1 . 2]" 1
2416 1 102 ILE HA 1 105 ILE HB . . 4.270 3.177 3.083 3.272 . 0 0 "[ . 1 . 2]" 1
2417 1 102 ILE HA 1 105 ILE MG . . 4.740 4.477 4.399 4.584 . 0 0 "[ . 1 . 2]" 1
2418 1 102 ILE HB 1 102 ILE MD . . 3.180 2.097 2.058 2.243 . 0 0 "[ . 1 . 2]" 1
2419 1 102 ILE HB 1 103 ASN H . . 3.150 2.209 2.074 2.511 . 0 0 "[ . 1 . 2]" 1
2420 1 102 ILE HB 1 103 ASN HD21 . . 5.500 3.892 2.752 5.227 . 0 0 "[ . 1 . 2]" 1
2421 1 102 ILE HB 1 103 ASN QD . . 4.790 3.469 2.643 4.380 . 0 0 "[ . 1 . 2]" 1
2422 1 102 ILE HB 1 103 ASN HD22 . . 5.500 4.028 3.411 4.702 . 0 0 "[ . 1 . 2]" 1
2423 1 102 ILE MD 1 102 ILE MG . . 3.180 3.108 3.083 3.129 . 0 0 "[ . 1 . 2]" 1
2424 1 102 ILE MD 1 103 ASN H . . 4.580 3.757 3.622 3.994 . 0 0 "[ . 1 . 2]" 1
2425 1 102 ILE HG12 1 102 ILE MG . . 3.200 2.078 1.958 2.193 . 0 0 "[ . 1 . 2]" 1
2426 1 102 ILE HG13 1 103 ASN H . . 4.750 4.645 4.579 4.748 . 0 0 "[ . 1 . 2]" 1
2427 1 102 ILE MG 1 103 ASN H . . 3.650 2.622 2.309 3.163 . 0 0 "[ . 1 . 2]" 1
2428 1 102 ILE MG 1 103 ASN HA . . 4.010 2.961 2.702 3.163 . 0 0 "[ . 1 . 2]" 1
2429 1 102 ILE MG 1 105 ILE H . . 4.430 4.303 4.157 4.461 0.031 14 0 "[ . 1 . 2]" 1
2430 1 102 ILE MG 1 106 SER H . . 5.080 3.443 3.150 3.767 . 0 0 "[ . 1 . 2]" 1
2431 1 102 ILE MG 1 106 SER HB2 . . 4.200 3.156 2.491 4.216 0.016 7 0 "[ . 1 . 2]" 1
2432 1 102 ILE MG 1 106 SER HB3 . . 4.200 3.362 3.012 4.203 0.003 9 0 "[ . 1 . 2]" 1
2433 1 103 ASN H 1 103 ASN HB2 . . 3.980 2.750 2.313 3.510 . 0 0 "[ . 1 . 2]" 1
2434 1 103 ASN H 1 103 ASN QB . . 3.390 2.612 2.285 2.829 . 0 0 "[ . 1 . 2]" 1
2435 1 103 ASN H 1 103 ASN HB3 . . 3.980 3.511 2.936 3.599 . 0 0 "[ . 1 . 2]" 1
2436 1 103 ASN H 1 103 ASN HD21 . . 4.590 2.571 1.784 3.608 . 0 0 "[ . 1 . 2]" 1
2437 1 103 ASN H 1 103 ASN QD . . 3.880 2.441 1.751 3.268 . 0 0 "[ . 1 . 2]" 1
2438 1 103 ASN H 1 103 ASN HD22 . . 4.590 3.281 2.545 3.736 . 0 0 "[ . 1 . 2]" 1
2439 1 103 ASN HA 1 105 ILE H . . 4.670 3.804 3.567 4.080 . 0 0 "[ . 1 . 2]" 1
2440 1 103 ASN HA 1 106 SER H . . 4.160 3.493 3.218 3.761 . 0 0 "[ . 1 . 2]" 1
2441 1 103 ASN HA 1 106 SER HB2 . . 5.050 3.890 2.744 4.418 . 0 0 "[ . 1 . 2]" 1
2442 1 103 ASN HA 1 106 SER QB . . 4.260 2.965 2.690 3.951 . 0 0 "[ . 1 . 2]" 1
2443 1 103 ASN HA 1 106 SER HB3 . . 5.050 3.385 2.718 4.453 . 0 0 "[ . 1 . 2]" 1
2444 1 103 ASN HA 1 107 ASP H . . 3.960 2.461 2.178 2.669 . 0 0 "[ . 1 . 2]" 1
2445 1 103 ASN QB 1 104 PHE H . . 3.600 2.380 2.101 2.972 . 0 0 "[ . 1 . 2]" 1
2446 1 103 ASN HB2 1 104 PHE H . . 4.270 2.423 2.118 3.070 . 0 0 "[ . 1 . 2]" 1
2447 1 103 ASN HB3 1 104 PHE H . . 4.270 3.546 3.290 3.970 . 0 0 "[ . 1 . 2]" 1
2448 1 104 PHE H 1 104 PHE HB2 . . 3.020 2.485 2.369 2.554 . 0 0 "[ . 1 . 2]" 1
2449 1 104 PHE H 1 104 PHE HB3 . . 3.280 2.600 2.505 2.727 . 0 0 "[ . 1 . 2]" 1
2450 1 104 PHE H 1 104 PHE QD . . 4.320 4.171 4.121 4.192 . 0 0 "[ . 1 . 2]" 1
2451 1 104 PHE H 1 105 ILE H . . 3.320 2.812 2.703 2.899 . 0 0 "[ . 1 . 2]" 1
2452 1 104 PHE HA 1 104 PHE QD . . 3.560 2.588 2.289 2.849 . 0 0 "[ . 1 . 2]" 1
2453 1 104 PHE HA 1 109 GLU H . . 3.780 2.519 2.094 2.953 . 0 0 "[ . 1 . 2]" 1
2454 1 104 PHE HA 1 109 GLU QB . . 3.280 2.089 1.984 2.472 . 0 0 "[ . 1 . 2]" 1
2455 1 104 PHE HA 1 109 GLU HG2 . . 4.830 3.889 3.250 4.363 . 0 0 "[ . 1 . 2]" 1
2456 1 104 PHE HA 1 109 GLU HG3 . . 3.360 2.429 2.014 2.913 . 0 0 "[ . 1 . 2]" 1
2457 1 104 PHE HB2 1 113 ILE MD . . 5.500 5.329 4.926 5.514 0.014 16 0 "[ . 1 . 2]" 1
2458 1 104 PHE HB3 1 105 ILE H . . 3.390 2.955 2.779 3.178 . 0 0 "[ . 1 . 2]" 1
2459 1 104 PHE HB3 1 105 ILE QG . . 4.950 3.078 2.922 3.205 . 0 0 "[ . 1 . 2]" 1
2460 1 104 PHE QD 1 105 ILE HA . . 4.840 4.031 3.601 4.424 . 0 0 "[ . 1 . 2]" 1
2461 1 104 PHE QD 1 105 ILE MD . . 3.220 2.310 1.978 2.640 . 0 0 "[ . 1 . 2]" 1
2462 1 104 PHE QD 1 105 ILE QG . . 4.050 3.025 2.792 3.406 . 0 0 "[ . 1 . 2]" 1
2463 1 104 PHE QD 1 109 GLU H . . 4.360 4.040 3.534 4.268 . 0 0 "[ . 1 . 2]" 1
2464 1 104 PHE QD 1 109 GLU HA . . 4.980 4.917 4.811 4.997 0.017 5 0 "[ . 1 . 2]" 1
2465 1 104 PHE QD 1 109 GLU HB2 . . 3.790 2.147 1.991 2.365 . 0 0 "[ . 1 . 2]" 1
2466 1 104 PHE QD 1 109 GLU QB . . 3.310 2.123 1.972 2.336 . 0 0 "[ . 1 . 2]" 1
2467 1 104 PHE QD 1 109 GLU HB3 . . 3.790 3.356 3.030 3.637 . 0 0 "[ . 1 . 2]" 1
2468 1 104 PHE QD 1 109 GLU HG2 . . 5.130 4.979 4.768 5.138 0.008 17 0 "[ . 1 . 2]" 1
2469 1 104 PHE QD 1 109 GLU HG3 . . 4.490 4.118 3.883 4.302 . 0 0 "[ . 1 . 2]" 1
2470 1 104 PHE QD 1 110 TRP HA . . 5.410 3.864 3.411 4.188 . 0 0 "[ . 1 . 2]" 1
2471 1 104 PHE QE 1 109 GLU QB . . 4.350 3.688 3.398 4.073 . 0 0 "[ . 1 . 2]" 1
2472 1 104 PHE QE 1 110 TRP H . . 4.470 3.431 3.126 3.647 . 0 0 "[ . 1 . 2]" 1
2473 1 104 PHE QE 1 110 TRP HA . . 4.150 2.234 1.993 2.580 . 0 0 "[ . 1 . 2]" 1
2474 1 104 PHE QE 1 110 TRP HB2 . . 4.640 3.745 3.279 4.042 . 0 0 "[ . 1 . 2]" 1
2475 1 104 PHE QE 1 110 TRP QB . . 3.810 2.627 2.313 2.926 . 0 0 "[ . 1 . 2]" 1
2476 1 104 PHE QE 1 110 TRP HB3 . . 4.640 2.684 2.352 3.002 . 0 0 "[ . 1 . 2]" 1
2477 1 104 PHE QE 1 110 TRP HD1 . . 4.820 4.052 3.689 4.501 . 0 0 "[ . 1 . 2]" 1
2478 1 104 PHE QE 1 113 ILE HB . . 5.010 4.075 3.761 4.406 . 0 0 "[ . 1 . 2]" 1
2479 1 104 PHE QE 1 113 ILE MD . . 3.030 1.944 1.789 2.128 . 0 0 "[ . 1 . 2]" 1
2480 1 104 PHE QE 1 113 ILE MG . . 4.980 4.431 3.855 4.779 . 0 0 "[ . 1 . 2]" 1
2481 1 104 PHE HZ 1 110 TRP HA . . 4.030 3.611 2.985 3.972 . 0 0 "[ . 1 . 2]" 1
2482 1 104 PHE HZ 1 110 TRP HB2 . . 4.300 3.548 3.280 3.865 . 0 0 "[ . 1 . 2]" 1
2483 1 104 PHE HZ 1 110 TRP QB . . 3.600 2.459 2.198 2.915 . 0 0 "[ . 1 . 2]" 1
2484 1 104 PHE HZ 1 110 TRP HB3 . . 4.300 2.511 2.233 3.023 . 0 0 "[ . 1 . 2]" 1
2485 1 104 PHE HZ 1 110 TRP HD1 . . 5.500 4.576 4.123 5.178 . 0 0 "[ . 1 . 2]" 1
2486 1 104 PHE HZ 1 113 ILE MD . . 3.540 3.365 2.938 3.558 0.018 16 0 "[ . 1 . 2]" 1
2487 1 105 ILE H 1 105 ILE HB . . 3.040 2.519 2.463 2.580 . 0 0 "[ . 1 . 2]" 1
2488 1 105 ILE H 1 105 ILE MD . . 3.570 3.481 3.341 3.575 0.005 7 0 "[ . 1 . 2]" 1
2489 1 105 ILE H 1 105 ILE HG12 . . 4.070 2.498 2.333 2.656 . 0 0 "[ . 1 . 2]" 1
2490 1 105 ILE H 1 105 ILE QG . . 3.450 2.470 2.312 2.622 . 0 0 "[ . 1 . 2]" 1
2491 1 105 ILE H 1 105 ILE HG13 . . 4.070 3.877 3.754 4.043 . 0 0 "[ . 1 . 2]" 1
2492 1 105 ILE H 1 105 ILE MG . . 3.870 3.794 3.771 3.819 . 0 0 "[ . 1 . 2]" 1
2493 1 105 ILE H 1 106 SER H . . 3.320 2.504 2.246 2.647 . 0 0 "[ . 1 . 2]" 1
2494 1 105 ILE H 1 106 SER QB . . 5.310 4.295 4.141 4.854 . 0 0 "[ . 1 . 2]" 1
2495 1 105 ILE H 1 107 ASP H . . 4.760 3.798 3.586 3.948 . 0 0 "[ . 1 . 2]" 1
2496 1 105 ILE HA 1 105 ILE MD . . 2.980 2.084 1.954 2.218 . 0 0 "[ . 1 . 2]" 1
2497 1 105 ILE HA 1 105 ILE MG . . 3.110 2.339 2.278 2.430 . 0 0 "[ . 1 . 2]" 1
2498 1 105 ILE HA 1 108 LYS H . . 4.210 3.767 3.525 3.966 . 0 0 "[ . 1 . 2]" 1
2499 1 105 ILE HA 1 108 LYS HA . . 4.670 3.511 3.303 3.889 . 0 0 "[ . 1 . 2]" 1
2500 1 105 ILE HA 1 110 TRP HD1 . . 4.140 3.411 3.102 3.875 . 0 0 "[ . 1 . 2]" 1
2501 1 105 ILE HA 1 110 TRP HE1 . . 4.470 3.882 3.449 4.191 . 0 0 "[ . 1 . 2]" 1
2502 1 105 ILE HB 1 106 SER H . . 3.680 2.183 2.084 2.439 . 0 0 "[ . 1 . 2]" 1
2503 1 105 ILE MD 1 110 TRP HD1 . . 4.060 3.783 3.529 4.066 0.006 3 0 "[ . 1 . 2]" 1
2504 1 105 ILE MD 1 110 TRP HE1 . . 5.080 4.632 4.146 4.900 . 0 0 "[ . 1 . 2]" 1
2505 1 105 ILE QG 1 105 ILE MG . . 3.260 2.251 2.172 2.323 . 0 0 "[ . 1 . 2]" 1
2506 1 105 ILE MG 1 106 SER H . . 4.030 3.094 2.925 3.294 . 0 0 "[ . 1 . 2]" 1
2507 1 105 ILE MG 1 106 SER QB . . 4.610 3.976 3.692 4.403 . 0 0 "[ . 1 . 2]" 1
2508 1 105 ILE MG 1 110 TRP HE1 . . 5.480 4.596 4.161 4.915 . 0 0 "[ . 1 . 2]" 1
2509 1 106 SER H 1 106 SER HB2 . . 3.560 2.586 2.198 3.591 0.031 7 0 "[ . 1 . 2]" 1
2510 1 106 SER H 1 106 SER HB3 . . 3.560 2.850 2.427 3.539 . 0 0 "[ . 1 . 2]" 1
2511 1 106 SER H 1 107 ASP H . . 3.670 2.792 2.598 2.937 . 0 0 "[ . 1 . 2]" 1
2512 1 106 SER H 1 108 LYS H . . 4.920 3.745 3.611 3.863 . 0 0 "[ . 1 . 2]" 1
2513 1 106 SER HA 1 108 LYS H . . 4.610 3.763 3.555 4.143 . 0 0 "[ . 1 . 2]" 1
2514 1 106 SER HA 1 108 LYS QE . . 4.970 3.991 3.172 4.927 . 0 0 "[ . 1 . 2]" 1
2515 1 106 SER HB2 1 107 ASP H . . 3.830 3.353 2.529 3.786 . 0 0 "[ . 1 . 2]" 1
2516 1 106 SER HB3 1 107 ASP H . . 3.830 2.733 2.269 3.864 0.034 7 0 "[ . 1 . 2]" 1
2517 1 107 ASP H 1 107 ASP HB2 . . 3.690 2.278 2.179 2.452 . 0 0 "[ . 1 . 2]" 1
2518 1 107 ASP H 1 107 ASP QB . . 3.060 2.248 2.158 2.414 . 0 0 "[ . 1 . 2]" 1
2519 1 107 ASP H 1 107 ASP HB3 . . 3.690 3.507 2.856 3.602 . 0 0 "[ . 1 . 2]" 1
2520 1 107 ASP H 1 108 LYS H . . 3.200 2.615 2.494 2.707 . 0 0 "[ . 1 . 2]" 1
2521 1 107 ASP H 1 108 LYS HA . . 4.860 4.769 4.731 4.818 . 0 0 "[ . 1 . 2]" 1
2522 1 107 ASP H 1 109 GLU H . . 4.740 4.200 3.875 4.642 . 0 0 "[ . 1 . 2]" 1
2523 1 107 ASP H 1 109 GLU HG3 . . 4.770 4.337 3.955 4.794 0.024 5 0 "[ . 1 . 2]" 1
2524 1 107 ASP QB 1 108 LYS H . . 4.010 3.350 3.003 3.571 . 0 0 "[ . 1 . 2]" 1
2525 1 107 ASP QB 1 109 GLU H . . 4.140 3.181 2.876 3.434 . 0 0 "[ . 1 . 2]" 1
2526 1 107 ASP QB 1 109 GLU HG3 . . 3.130 2.500 2.108 2.953 . 0 0 "[ . 1 . 2]" 1
2527 1 107 ASP HB2 1 108 LYS H . . 4.710 3.589 3.109 4.223 . 0 0 "[ . 1 . 2]" 1
2528 1 107 ASP HB2 1 109 GLU H . . 4.870 3.539 3.124 4.442 . 0 0 "[ . 1 . 2]" 1
2529 1 107 ASP HB2 1 109 GLU HG2 . . 3.960 3.363 2.411 3.901 . 0 0 "[ . 1 . 2]" 1
2530 1 107 ASP HB2 1 109 GLU HG3 . . 3.620 2.719 2.288 3.625 0.005 6 0 "[ . 1 . 2]" 1
2531 1 107 ASP HB3 1 108 LYS H . . 4.710 4.060 3.699 4.347 . 0 0 "[ . 1 . 2]" 1
2532 1 107 ASP HB3 1 109 GLU H . . 4.870 3.708 2.913 4.314 . 0 0 "[ . 1 . 2]" 1
2533 1 107 ASP HB3 1 109 GLU HG2 . . 3.960 2.909 2.022 3.477 . 0 0 "[ . 1 . 2]" 1
2534 1 107 ASP HB3 1 109 GLU HG3 . . 3.620 3.116 2.122 3.499 . 0 0 "[ . 1 . 2]" 1
2535 1 108 LYS H 1 108 LYS QB . . 3.600 3.276 3.122 3.428 . 0 0 "[ . 1 . 2]" 1
2536 1 108 LYS H 1 108 LYS QD . . 5.250 4.236 3.067 4.784 . 0 0 "[ . 1 . 2]" 1
2537 1 108 LYS H 1 108 LYS QE . . 4.710 4.136 3.451 4.454 . 0 0 "[ . 1 . 2]" 1
2538 1 108 LYS H 1 108 LYS HG2 . . 3.940 3.434 2.190 3.839 . 0 0 "[ . 1 . 2]" 1
2539 1 108 LYS H 1 108 LYS QG . . 3.320 2.407 2.177 2.719 . 0 0 "[ . 1 . 2]" 1
2540 1 108 LYS H 1 108 LYS HG3 . . 3.940 2.650 2.225 3.872 . 0 0 "[ . 1 . 2]" 1
2541 1 108 LYS H 1 109 GLU H . . 3.460 2.940 2.675 3.123 . 0 0 "[ . 1 . 2]" 1
2542 1 108 LYS H 1 110 TRP H . . 4.940 4.847 4.683 4.949 0.009 7 0 "[ . 1 . 2]" 1
2543 1 108 LYS H 1 110 TRP HD1 . . 4.790 4.343 4.095 4.682 . 0 0 "[ . 1 . 2]" 1
2544 1 108 LYS H 1 110 TRP HE1 . . 4.680 3.995 3.730 4.342 . 0 0 "[ . 1 . 2]" 1
2545 1 108 LYS HA 1 109 GLU H . . 3.480 2.744 2.618 2.895 . 0 0 "[ . 1 . 2]" 1
2546 1 108 LYS HA 1 110 TRP H . . 4.120 3.173 3.031 3.362 . 0 0 "[ . 1 . 2]" 1
2547 1 108 LYS HA 1 110 TRP HD1 . . 4.370 2.362 2.069 2.807 . 0 0 "[ . 1 . 2]" 1
2548 1 108 LYS HA 1 110 TRP HE1 . . 3.870 2.128 1.896 2.461 . 0 0 "[ . 1 . 2]" 1
2549 1 108 LYS QB 1 108 LYS QD . . 3.010 2.109 2.036 2.201 . 0 0 "[ . 1 . 2]" 1
2550 1 108 LYS QB 1 110 TRP HZ2 . . 4.660 2.747 2.499 3.130 . 0 0 "[ . 1 . 2]" 1
2551 1 108 LYS QB 1 111 LYS QE . . 3.670 2.659 1.873 3.673 0.003 5 0 "[ . 1 . 2]" 1
2552 1 108 LYS QB 1 111 LYS QG . . 4.660 2.854 2.018 3.988 . 0 0 "[ . 1 . 2]" 1
2553 1 108 LYS HB2 1 110 TRP HE1 . . 4.760 3.767 3.504 4.513 . 0 0 "[ . 1 . 2]" 1
2554 1 108 LYS HB3 1 110 TRP HE1 . . 4.760 2.339 2.048 3.066 . 0 0 "[ . 1 . 2]" 1
2555 1 108 LYS QD 1 110 TRP HE1 . . 4.890 3.492 1.887 3.923 . 0 0 "[ . 1 . 2]" 1
2556 1 108 LYS QD 1 110 TRP HZ2 . . 3.830 2.710 1.984 3.282 . 0 0 "[ . 1 . 2]" 1
2557 1 108 LYS QD 1 111 LYS QE . . 3.780 2.653 1.901 3.624 . 0 0 "[ . 1 . 2]" 1
2558 1 108 LYS QE 1 108 LYS QG . . 3.190 2.152 2.059 2.316 . 0 0 "[ . 1 . 2]" 1
2559 1 108 LYS QE 1 110 TRP HE1 . . 5.020 4.240 1.988 4.951 . 0 0 "[ . 1 . 2]" 1
2560 1 108 LYS QG 1 110 TRP HE1 . . 3.880 2.188 1.868 3.795 . 0 0 "[ . 1 . 2]" 1
2561 1 108 LYS QG 1 110 TRP HZ2 . . 4.110 3.001 2.288 3.947 . 0 0 "[ . 1 . 2]" 1
2562 1 108 LYS HG2 1 110 TRP HZ2 . . 4.680 3.132 2.300 4.694 0.014 12 0 "[ . 1 . 2]" 1
2563 1 108 LYS HG3 1 110 TRP HZ2 . . 4.680 4.442 3.810 4.685 0.005 3 0 "[ . 1 . 2]" 1
2564 1 109 GLU H 1 109 GLU HB2 . . 3.880 2.523 2.425 2.655 . 0 0 "[ . 1 . 2]" 1
2565 1 109 GLU H 1 109 GLU QB . . 3.130 2.475 2.388 2.588 . 0 0 "[ . 1 . 2]" 1
2566 1 109 GLU H 1 109 GLU HB3 . . 3.880 3.591 3.582 3.597 . 0 0 "[ . 1 . 2]" 1
2567 1 109 GLU H 1 109 GLU HG2 . . 3.330 3.045 2.004 3.330 . 0 0 "[ . 1 . 2]" 1
2568 1 109 GLU H 1 109 GLU HG3 . . 3.180 2.371 2.091 3.191 0.011 1 0 "[ . 1 . 2]" 1
2569 1 109 GLU H 1 110 TRP H . . 3.280 2.718 2.532 2.833 . 0 0 "[ . 1 . 2]" 1
2570 1 109 GLU H 1 110 TRP HD1 . . 4.190 3.682 3.175 4.078 . 0 0 "[ . 1 . 2]" 1
2571 1 109 GLU HA 1 109 GLU HG2 . . 3.000 2.457 2.283 2.767 . 0 0 "[ . 1 . 2]" 1
2572 1 109 GLU HA 1 109 GLU HG3 . . 3.740 3.294 3.100 3.812 0.072 5 0 "[ . 1 . 2]" 1
2573 1 109 GLU HA 1 111 LYS H . . 4.050 3.744 3.620 3.920 . 0 0 "[ . 1 . 2]" 1
2574 1 109 GLU HA 1 112 SER H . . 4.250 3.511 3.284 3.750 . 0 0 "[ . 1 . 2]" 1
2575 1 109 GLU QB 1 110 TRP H . . 3.990 2.855 2.681 3.019 . 0 0 "[ . 1 . 2]" 1
2576 1 109 GLU QB 1 113 ILE MD . . 4.860 3.640 3.061 4.141 . 0 0 "[ . 1 . 2]" 1
2577 1 109 GLU HB2 1 110 TRP H . . 4.800 2.939 2.756 3.125 . 0 0 "[ . 1 . 2]" 1
2578 1 109 GLU HB3 1 110 TRP H . . 4.800 3.881 3.664 4.055 . 0 0 "[ . 1 . 2]" 1
2579 1 110 TRP H 1 110 TRP HB2 . . 4.020 3.595 3.577 3.617 . 0 0 "[ . 1 . 2]" 1
2580 1 110 TRP H 1 110 TRP QB . . 3.390 2.571 2.516 2.637 . 0 0 "[ . 1 . 2]" 1
2581 1 110 TRP H 1 110 TRP HB3 . . 4.020 2.633 2.569 2.713 . 0 0 "[ . 1 . 2]" 1
2582 1 110 TRP H 1 110 TRP HD1 . . 3.220 2.358 1.930 2.614 . 0 0 "[ . 1 . 2]" 1
2583 1 110 TRP H 1 110 TRP HE1 . . 4.820 4.261 4.028 4.429 . 0 0 "[ . 1 . 2]" 1
2584 1 110 TRP H 1 110 TRP HE3 . . 5.190 4.957 4.759 5.194 0.004 13 0 "[ . 1 . 2]" 1
2585 1 110 TRP H 1 111 LYS H . . 3.460 2.835 2.679 2.969 . 0 0 "[ . 1 . 2]" 1
2586 1 110 TRP H 1 113 ILE MD . . 4.460 4.170 3.597 4.465 0.005 12 0 "[ . 1 . 2]" 1
2587 1 110 TRP HA 1 113 ILE H . . 4.010 3.394 3.156 3.980 . 0 0 "[ . 1 . 2]" 1
2588 1 110 TRP HA 1 113 ILE MD . . 3.260 2.243 1.944 2.526 . 0 0 "[ . 1 . 2]" 1
2589 1 110 TRP HA 1 113 ILE HG13 . . 4.070 3.189 2.456 3.735 . 0 0 "[ . 1 . 2]" 1
2590 1 110 TRP QB 1 113 ILE MD . . 4.020 3.407 3.025 3.795 . 0 0 "[ . 1 . 2]" 1
2591 1 110 TRP QB 1 113 ILE MG . . 5.180 4.563 4.135 5.087 . 0 0 "[ . 1 . 2]" 1
2592 1 110 TRP HB2 1 113 ILE MD . . 4.640 3.963 3.546 4.425 . 0 0 "[ . 1 . 2]" 1
2593 1 110 TRP HB3 1 113 ILE MD . . 4.640 3.717 3.249 4.131 . 0 0 "[ . 1 . 2]" 1
2594 1 110 TRP HE3 1 111 LYS H . . 4.560 3.400 2.840 4.151 . 0 0 "[ . 1 . 2]" 1
2595 1 110 TRP HE3 1 111 LYS HA . . 3.640 2.624 2.224 3.472 . 0 0 "[ . 1 . 2]" 1
2596 1 110 TRP HH2 1 111 LYS HE2 . . 4.510 3.029 2.415 4.499 . 0 0 "[ . 1 . 2]" 1
2597 1 110 TRP HH2 1 111 LYS QE . . 3.910 2.715 1.966 3.652 . 0 0 "[ . 1 . 2]" 1
2598 1 110 TRP HH2 1 111 LYS HE3 . . 4.510 3.409 2.068 4.559 0.049 13 0 "[ . 1 . 2]" 1
2599 1 110 TRP HZ2 1 111 LYS HE2 . . 4.500 3.630 2.239 4.512 0.012 13 0 "[ . 1 . 2]" 1
2600 1 110 TRP HZ2 1 111 LYS HE3 . . 4.500 3.318 2.159 4.379 . 0 0 "[ . 1 . 2]" 1
2601 1 110 TRP HZ3 1 111 LYS HA . . 4.440 3.292 2.810 4.336 . 0 0 "[ . 1 . 2]" 1
2602 1 111 LYS H 1 111 LYS HB2 . . 3.720 2.409 2.203 3.553 . 0 0 "[ . 1 . 2]" 1
2603 1 111 LYS H 1 111 LYS QB . . 3.080 2.315 2.181 2.572 . 0 0 "[ . 1 . 2]" 1
2604 1 111 LYS H 1 111 LYS HB3 . . 3.720 3.494 2.309 3.593 . 0 0 "[ . 1 . 2]" 1
2605 1 111 LYS H 1 111 LYS HG2 . . 4.230 3.312 1.927 4.199 . 0 0 "[ . 1 . 2]" 1
2606 1 111 LYS H 1 111 LYS QG . . 3.370 2.603 1.913 3.385 0.015 12 0 "[ . 1 . 2]" 1
2607 1 111 LYS H 1 111 LYS HG3 . . 4.230 3.044 2.198 3.710 . 0 0 "[ . 1 . 2]" 1
2608 1 111 LYS H 1 112 SER H . . 3.330 2.823 2.666 3.020 . 0 0 "[ . 1 . 2]" 1
2609 1 111 LYS H 1 113 ILE H . . 4.620 4.118 3.962 4.299 . 0 0 "[ . 1 . 2]" 1
2610 1 111 LYS H 1 113 ILE MD . . 5.500 5.126 4.763 5.356 . 0 0 "[ . 1 . 2]" 1
2611 1 111 LYS HA 1 111 LYS QD . . 4.670 3.366 2.386 4.504 . 0 0 "[ . 1 . 2]" 1
2612 1 111 LYS HA 1 111 LYS HG2 . . 4.200 2.780 2.281 3.806 . 0 0 "[ . 1 . 2]" 1
2613 1 111 LYS HA 1 111 LYS QG . . 3.460 2.413 2.121 3.319 . 0 0 "[ . 1 . 2]" 1
2614 1 111 LYS HA 1 111 LYS HG3 . . 4.200 3.036 2.140 3.856 . 0 0 "[ . 1 . 2]" 1
2615 1 111 LYS HA 1 113 ILE H . . 4.210 3.913 3.443 4.163 . 0 0 "[ . 1 . 2]" 1
2616 1 111 LYS QB 1 111 LYS QE . . 4.500 3.344 1.997 3.746 . 0 0 "[ . 1 . 2]" 1
2617 1 111 LYS QB 1 112 SER H . . 3.490 2.661 2.409 3.433 . 0 0 "[ . 1 . 2]" 1
2618 1 111 LYS QB 1 112 SER HA . . 4.590 3.897 3.723 4.512 . 0 0 "[ . 1 . 2]" 1
2619 1 111 LYS QB 1 112 SER QB . . 4.990 4.142 3.673 4.784 . 0 0 "[ . 1 . 2]" 1
2620 1 111 LYS QE 1 111 LYS QG . . 3.260 2.233 2.078 2.403 . 0 0 "[ . 1 . 2]" 1
2621 1 111 LYS HE2 1 111 LYS HG2 . . 4.220 3.316 2.302 4.145 . 0 0 "[ . 1 . 2]" 1
2622 1 111 LYS HE2 1 111 LYS HG3 . . 4.220 3.258 2.605 3.868 . 0 0 "[ . 1 . 2]" 1
2623 1 111 LYS HE3 1 111 LYS HG2 . . 4.220 3.071 2.424 3.640 . 0 0 "[ . 1 . 2]" 1
2624 1 111 LYS HE3 1 111 LYS HG3 . . 4.220 2.868 2.120 3.788 . 0 0 "[ . 1 . 2]" 1
2625 1 112 SER H 1 112 SER HB2 . . 3.600 2.506 2.235 3.585 . 0 0 "[ . 1 . 2]" 1
2626 1 112 SER H 1 112 SER HB3 . . 3.600 3.107 2.433 3.594 . 0 0 "[ . 1 . 2]" 1
2627 1 112 SER H 1 113 ILE H . . 3.080 2.662 2.505 2.876 . 0 0 "[ . 1 . 2]" 1
2628 1 112 SER H 1 113 ILE HB . . 5.050 4.841 4.113 5.051 0.001 8 0 "[ . 1 . 2]" 1
2629 1 112 SER H 1 113 ILE HG13 . . 4.310 4.052 3.425 4.310 . 0 0 "[ . 1 . 2]" 1
2630 1 112 SER QB 1 113 ILE MD . . 5.340 4.344 3.994 5.203 . 0 0 "[ . 1 . 2]" 1
2631 1 112 SER QB 1 113 ILE HG13 . . 4.780 3.228 2.896 4.209 . 0 0 "[ . 1 . 2]" 1
2632 1 113 ILE H 1 113 ILE HB . . 3.050 2.540 2.487 2.648 . 0 0 "[ . 1 . 2]" 1
2633 1 113 ILE H 1 113 ILE MD . . 4.210 3.623 3.337 4.223 0.013 7 0 "[ . 1 . 2]" 1
2634 1 113 ILE H 1 113 ILE HG12 . . 4.210 3.791 3.610 4.201 . 0 0 "[ . 1 . 2]" 1
2635 1 113 ILE H 1 113 ILE HG13 . . 3.320 2.477 2.233 3.161 . 0 0 "[ . 1 . 2]" 1
2636 1 113 ILE H 1 113 ILE MG . . 4.070 3.788 3.739 3.839 . 0 0 "[ . 1 . 2]" 1
2637 1 113 ILE H 1 114 GLU H . . 4.770 4.525 4.347 4.592 . 0 0 "[ . 1 . 2]" 1
2638 1 113 ILE HA 1 113 ILE MD . . 4.030 3.863 3.747 3.910 . 0 0 "[ . 1 . 2]" 1
2639 1 113 ILE HA 1 113 ILE HG12 . . 3.360 2.637 2.368 2.772 . 0 0 "[ . 1 . 2]" 1
2640 1 113 ILE HA 1 113 ILE HG13 . . 3.790 2.884 2.791 3.032 . 0 0 "[ . 1 . 2]" 1
2641 1 113 ILE HA 1 113 ILE MG . . 3.030 2.388 2.259 2.485 . 0 0 "[ . 1 . 2]" 1
2642 1 113 ILE HA 1 114 GLU H . . 2.770 2.189 2.164 2.232 . 0 0 "[ . 1 . 2]" 1
2643 1 113 ILE HA 1 114 GLU QB . . 4.580 4.318 4.160 4.514 . 0 0 "[ . 1 . 2]" 1
2644 1 113 ILE HA 1 114 GLU QG . . 4.780 4.075 3.632 4.442 . 0 0 "[ . 1 . 2]" 1
2645 1 113 ILE HB 1 113 ILE MD . . 3.130 2.282 2.168 2.387 . 0 0 "[ . 1 . 2]" 1
2646 1 113 ILE MD 1 114 GLU H . . 5.130 5.018 4.710 5.147 0.017 12 0 "[ . 1 . 2]" 1
2647 1 113 ILE HG12 1 114 GLU H . . 5.040 4.314 3.965 4.479 . 0 0 "[ . 1 . 2]" 1
2648 1 113 ILE HG13 1 114 GLU H . . 4.940 4.894 4.807 5.000 0.060 10 0 "[ . 1 . 2]" 1
2649 1 113 ILE MG 1 114 GLU H . . 3.230 2.213 1.883 2.541 . 0 0 "[ . 1 . 2]" 1
2650 1 113 ILE MG 1 114 GLU QB . . 4.500 3.591 3.362 4.032 . 0 0 "[ . 1 . 2]" 1
2651 1 113 ILE MG 1 114 GLU QG . . 4.870 4.217 2.874 4.652 . 0 0 "[ . 1 . 2]" 1
2652 1 114 GLU H 1 114 GLU HB2 . . 3.670 2.460 2.208 3.605 . 0 0 "[ . 1 . 2]" 1
2653 1 114 GLU H 1 114 GLU QB . . 2.880 2.311 2.186 2.459 . 0 0 "[ . 1 . 2]" 1
2654 1 114 GLU H 1 114 GLU HB3 . . 3.670 3.447 2.400 3.624 . 0 0 "[ . 1 . 2]" 1
2655 1 114 GLU H 1 114 GLU QG . . 3.460 2.634 2.251 3.034 . 0 0 "[ . 1 . 2]" 1
2656 1 114 GLU H 1 115 PRO QD . . 4.910 4.254 4.115 4.364 . 0 0 "[ . 1 . 2]" 1
2657 1 114 GLU QB 1 115 PRO QD . . 4.220 2.778 2.223 3.286 . 0 0 "[ . 1 . 2]" 1
2658 1 114 GLU QG 1 115 PRO QD . . 3.510 3.267 2.855 3.503 . 0 0 "[ . 1 . 2]" 1
2659 1 115 PRO HA 1 116 VAL H . . 3.110 2.351 2.175 2.648 . 0 0 "[ . 1 . 2]" 1
2660 1 115 PRO HB2 1 116 VAL H . . 3.860 2.774 2.052 3.369 . 0 0 "[ . 1 . 2]" 1
2661 1 115 PRO HB2 1 116 VAL QG . . 4.460 3.915 3.525 4.461 0.001 3 0 "[ . 1 . 2]" 1
2662 1 115 PRO HB3 1 116 VAL H . . 3.920 3.548 3.201 3.892 . 0 0 "[ . 1 . 2]" 1
2663 1 115 PRO QG 1 116 VAL H . . 5.020 4.257 3.736 4.593 . 0 0 "[ . 1 . 2]" 1
2664 1 116 VAL H 1 116 VAL HB . . 4.180 3.584 2.596 3.811 . 0 0 "[ . 1 . 2]" 1
2665 1 116 VAL H 1 116 VAL MG1 . . 3.860 2.753 2.319 3.800 . 0 0 "[ . 1 . 2]" 1
2666 1 116 VAL H 1 116 VAL QG . . 3.000 2.019 1.885 2.171 . 0 0 "[ . 1 . 2]" 1
2667 1 116 VAL H 1 116 VAL MG2 . . 3.860 2.104 1.942 2.262 . 0 0 "[ . 1 . 2]" 1
2668 1 116 VAL H 1 117 SER H . . 4.750 4.536 4.333 4.618 . 0 0 "[ . 1 . 2]" 1
2669 1 116 VAL HA 1 116 VAL MG1 . . 3.440 2.287 2.081 2.401 . 0 0 "[ . 1 . 2]" 1
2670 1 116 VAL HA 1 116 VAL MG2 . . 3.440 3.122 2.470 3.202 . 0 0 "[ . 1 . 2]" 1
2671 1 116 VAL HA 1 117 SER H . . 3.490 2.311 2.149 2.495 . 0 0 "[ . 1 . 2]" 1
2672 1 116 VAL HB 1 117 SER H . . 4.390 2.758 2.190 3.843 . 0 0 "[ . 1 . 2]" 1
2673 1 116 VAL QG 1 117 SER H . . 3.570 3.121 1.887 3.481 . 0 0 "[ . 1 . 2]" 1
2674 1 116 VAL QG 1 117 SER QB . . 4.620 4.278 2.886 4.641 0.021 10 0 "[ . 1 . 2]" 1
2675 1 116 VAL MG1 1 117 SER H . . 4.470 3.534 1.891 3.866 . 0 0 "[ . 1 . 2]" 1
2676 1 116 VAL MG2 1 117 SER H . . 4.470 3.661 3.148 4.157 . 0 0 "[ . 1 . 2]" 1
2677 1 117 SER H 1 117 SER QB . . 3.540 2.559 2.267 3.096 . 0 0 "[ . 1 . 2]" 1
2678 1 117 SER H 1 118 SER H . . 4.710 3.136 1.877 4.643 . 0 0 "[ . 1 . 2]" 1
2679 1 117 SER QB 1 118 SER H . . 4.160 2.871 2.059 4.061 . 0 0 "[ . 1 . 2]" 1
2680 1 118 SER H 1 118 SER QB . . 3.620 2.710 2.232 3.375 . 0 0 "[ . 1 . 2]" 1
2681 1 119 TRP H 1 119 TRP HD1 . . 4.970 4.763 4.459 4.987 0.017 14 0 "[ . 1 . 2]" 1
2682 1 119 TRP H 1 120 PHE H . . 4.840 3.809 2.294 4.569 . 0 0 "[ . 1 . 2]" 1
2683 1 119 TRP HA 1 119 TRP HD1 . . 4.780 4.507 4.013 4.751 . 0 0 "[ . 1 . 2]" 1
2684 1 119 TRP HA 1 119 TRP HE3 . . 4.490 2.683 1.973 3.413 . 0 0 "[ . 1 . 2]" 1
2685 1 119 TRP HA 1 119 TRP HZ3 . . 5.500 4.901 4.319 5.486 . 0 0 "[ . 1 . 2]" 1
2686 1 119 TRP HA 1 120 PHE H . . 3.440 2.379 2.140 3.477 0.037 14 0 "[ . 1 . 2]" 1
2687 1 119 TRP QB 1 119 TRP HE3 . . 3.680 2.733 2.475 3.052 . 0 0 "[ . 1 . 2]" 1
2688 1 119 TRP QB 1 120 PHE H . . 4.410 3.860 2.868 4.059 . 0 0 "[ . 1 . 2]" 1
2689 1 119 TRP HB2 1 120 PHE H . . 5.010 4.418 3.990 4.650 . 0 0 "[ . 1 . 2]" 1
2690 1 119 TRP HB3 1 120 PHE H . . 5.010 4.309 2.929 4.593 . 0 0 "[ . 1 . 2]" 1
2691 1 119 TRP HE3 1 120 PHE H . . 5.370 4.514 3.428 5.357 . 0 0 "[ . 1 . 2]" 1
2692 1 119 TRP HH2 1 121 SER HB2 . . 5.200 4.597 3.369 5.242 0.042 11 0 "[ . 1 . 2]" 1
2693 1 119 TRP HH2 1 121 SER QB . . 4.490 4.124 3.325 4.490 0.000 8 0 "[ . 1 . 2]" 1
2694 1 119 TRP HH2 1 121 SER HB3 . . 5.200 4.791 4.223 5.199 . 0 0 "[ . 1 . 2]" 1
2695 1 119 TRP HZ2 1 121 SER QB . . 4.650 2.973 2.231 3.956 . 0 0 "[ . 1 . 2]" 1
2696 1 120 PHE H 1 120 PHE QB . . 3.440 2.469 2.147 3.170 . 0 0 "[ . 1 . 2]" 1
2697 1 120 PHE H 1 120 PHE QD . . 4.370 4.033 2.961 4.353 . 0 0 "[ . 1 . 2]" 1
2698 1 120 PHE H 1 121 SER H . . 5.080 3.875 2.605 4.537 . 0 0 "[ . 1 . 2]" 1
2699 1 120 PHE HA 1 120 PHE QD . . 3.950 2.840 2.301 3.693 . 0 0 "[ . 1 . 2]" 1
2700 1 120 PHE QB 1 121 SER H . . 4.390 3.879 3.172 4.048 . 0 0 "[ . 1 . 2]" 1
2701 1 120 PHE QD 1 121 SER HA . . 5.110 4.083 3.044 5.120 0.010 16 0 "[ . 1 . 2]" 1
2702 1 121 SER H 1 121 SER QB . . 3.520 2.769 2.244 3.121 . 0 0 "[ . 1 . 2]" 1
2703 1 121 SER H 1 122 GLY H . . 4.570 4.054 2.643 4.563 . 0 0 "[ . 1 . 2]" 1
2704 1 121 SER HB2 1 122 GLY H . . 4.610 4.037 2.491 4.460 . 0 0 "[ . 1 . 2]" 1
2705 1 121 SER HB3 1 122 GLY H . . 4.610 3.822 2.474 4.488 . 0 0 "[ . 1 . 2]" 1
2706 1 122 GLY QA 1 123 PRO QD . . 2.810 1.941 1.839 2.169 . 0 0 "[ . 1 . 2]" 1
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