NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
542949 |
2lft   |
17780 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lft
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 2247
_Distance_constraint_stats_list.Viol_count 5810
_Distance_constraint_stats_list.Viol_total 2134.661
_Distance_constraint_stats_list.Viol_max 0.200
_Distance_constraint_stats_list.Viol_rms 0.0103
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0184
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 THR 0.108 0.031 12 0 "[ . 1 . 2]"
1 7 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 SER 0.098 0.049 14 0 "[ . 1 . 2]"
1 9 GLN 0.505 0.049 14 0 "[ . 1 . 2]"
1 10 TRP 0.449 0.198 18 0 "[ . 1 . 2]"
1 11 ASN 0.580 0.033 14 0 "[ . 1 . 2]"
1 12 LYS 0.603 0.038 12 0 "[ . 1 . 2]"
1 13 PRO 0.836 0.038 12 0 "[ . 1 . 2]"
1 14 SER 0.337 0.078 11 0 "[ . 1 . 2]"
1 15 LYS 1.070 0.078 11 0 "[ . 1 . 2]"
1 16 PRO 1.179 0.070 17 0 "[ . 1 . 2]"
1 17 LYS 0.592 0.057 3 0 "[ . 1 . 2]"
1 18 THR 0.281 0.035 18 0 "[ . 1 . 2]"
1 19 ASN 0.255 0.035 18 0 "[ . 1 . 2]"
1 20 MET 0.012 0.010 8 0 "[ . 1 . 2]"
1 21 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 HIS 0.252 0.038 12 0 "[ . 1 . 2]"
1 23 MET 0.119 0.034 18 0 "[ . 1 . 2]"
1 24 ALA 0.160 0.034 18 0 "[ . 1 . 2]"
1 25 GLY 0.126 0.028 18 0 "[ . 1 . 2]"
1 26 ALA 0.087 0.027 19 0 "[ . 1 . 2]"
1 27 ALA 0.013 0.012 18 0 "[ . 1 . 2]"
1 28 ALA 0.034 0.018 18 0 "[ . 1 . 2]"
1 29 ALA 0.299 0.042 18 0 "[ . 1 . 2]"
1 30 GLY 0.961 0.153 18 0 "[ . 1 . 2]"
1 31 ALA 0.559 0.106 3 0 "[ . 1 . 2]"
1 32 VAL 0.915 0.153 18 0 "[ . 1 . 2]"
1 33 VAL 1.713 0.198 5 0 "[ . 1 . 2]"
1 34 GLY 0.992 0.168 20 0 "[ . 1 . 2]"
1 35 GLY 0.906 0.198 5 0 "[ . 1 . 2]"
1 36 LEU 2.551 0.089 6 0 "[ . 1 . 2]"
1 37 GLY 0.130 0.015 12 0 "[ . 1 . 2]"
1 38 GLY 0.807 0.037 8 0 "[ . 1 . 2]"
1 39 TYR 1.083 0.045 20 0 "[ . 1 . 2]"
1 40 MET 2.189 0.089 6 0 "[ . 1 . 2]"
1 41 LEU 4.575 0.122 12 0 "[ . 1 . 2]"
1 42 GLY 0.407 0.051 12 0 "[ . 1 . 2]"
1 43 SER 1.242 0.055 6 0 "[ . 1 . 2]"
1 44 ALA 1.266 0.057 18 0 "[ . 1 . 2]"
1 45 MET 2.944 0.187 18 0 "[ . 1 . 2]"
1 46 SER 0.487 0.057 18 0 "[ . 1 . 2]"
1 47 ARG 0.504 0.079 14 0 "[ . 1 . 2]"
1 48 PRO 1.633 0.090 10 0 "[ . 1 . 2]"
1 49 ILE 1.903 0.194 10 0 "[ . 1 . 2]"
1 50 ILE 8.758 0.195 6 0 "[ . 1 . 2]"
1 51 HIS 1.636 0.141 18 0 "[ . 1 . 2]"
1 52 PHE 1.850 0.061 12 0 "[ . 1 . 2]"
1 53 GLY 0.808 0.048 12 0 "[ . 1 . 2]"
1 54 SER 1.886 0.061 10 0 "[ . 1 . 2]"
1 55 ASP 0.581 0.061 10 0 "[ . 1 . 2]"
1 56 TYR 0.403 0.015 18 0 "[ . 1 . 2]"
1 57 GLU 0.549 0.039 12 0 "[ . 1 . 2]"
1 58 ASP 0.499 0.031 8 0 "[ . 1 . 2]"
1 59 ARG 1.138 0.082 18 0 "[ . 1 . 2]"
1 60 TYR 0.751 0.032 6 0 "[ . 1 . 2]"
1 61 TYR 1.589 0.083 10 0 "[ . 1 . 2]"
1 62 ARG 1.852 0.198 8 0 "[ . 1 . 2]"
1 63 GLU 1.249 0.057 12 0 "[ . 1 . 2]"
1 64 ASN 1.042 0.093 12 0 "[ . 1 . 2]"
1 65 MET 1.494 0.198 8 0 "[ . 1 . 2]"
1 66 HIS 0.170 0.024 8 0 "[ . 1 . 2]"
1 67 ARG 1.747 0.164 12 0 "[ . 1 . 2]"
1 68 TYR 1.098 0.027 15 0 "[ . 1 . 2]"
1 69 PRO 0.828 0.047 18 0 "[ . 1 . 2]"
1 70 ASN 2.023 0.099 8 0 "[ . 1 . 2]"
1 71 GLN 4.199 0.122 12 0 "[ . 1 . 2]"
1 72 VAL 2.966 0.125 10 0 "[ . 1 . 2]"
1 73 TYR 2.044 0.096 8 0 "[ . 1 . 2]"
1 74 TYR 0.926 0.046 12 0 "[ . 1 . 2]"
1 76 PRO 0.836 0.046 12 0 "[ . 1 . 2]"
1 77 MET 1.577 0.156 7 0 "[ . 1 . 2]"
1 79 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLN 1.817 0.069 14 0 "[ . 1 . 2]"
1 84 ASN 1.430 0.057 18 0 "[ . 1 . 2]"
1 85 ASN 1.202 0.055 19 0 "[ . 1 . 2]"
1 86 PHE 1.585 0.156 7 0 "[ . 1 . 2]"
1 87 VAL 2.442 0.094 18 0 "[ . 1 . 2]"
1 88 HIS 2.201 0.072 14 0 "[ . 1 . 2]"
1 89 ASP 0.384 0.033 12 0 "[ . 1 . 2]"
1 90 CYS 2.838 0.100 12 0 "[ . 1 . 2]"
1 91 VAL 3.793 0.200 9 0 "[ . 1 . 2]"
1 92 ASN 0.810 0.032 12 0 "[ . 1 . 2]"
1 93 ILE 3.382 0.103 18 0 "[ . 1 . 2]"
1 94 THR 2.546 0.125 10 0 "[ . 1 . 2]"
1 95 ILE 5.100 0.103 18 0 "[ . 1 . 2]"
1 96 LYS 5.352 0.113 12 0 "[ . 1 . 2]"
1 97 GLN 0.367 0.030 12 0 "[ . 1 . 2]"
1 98 HIS 0.935 0.034 18 0 "[ . 1 . 2]"
1 99 THR 2.725 0.090 18 0 "[ . 1 . 2]"
1 100 VAL 5.635 0.198 4 0 "[ . 1 . 2]"
1 101 THR 1.655 0.062 12 0 "[ . 1 . 2]"
1 102 THR 3.185 0.079 10 0 "[ . 1 . 2]"
1 103 THR 1.645 0.085 18 0 "[ . 1 . 2]"
1 104 THR 3.457 0.198 4 0 "[ . 1 . 2]"
1 105 LYS 0.223 0.016 18 0 "[ . 1 . 2]"
1 106 GLY 0.422 0.028 12 0 "[ . 1 . 2]"
1 107 GLU 1.759 0.051 19 0 "[ . 1 . 2]"
1 108 ASN 1.888 0.051 18 0 "[ . 1 . 2]"
1 109 PHE 2.474 0.044 19 0 "[ . 1 . 2]"
1 110 THR 2.854 0.136 18 0 "[ . 1 . 2]"
1 111 GLU 0.850 0.029 18 0 "[ . 1 . 2]"
1 112 THR 5.242 0.074 18 0 "[ . 1 . 2]"
1 113 ASP 0.978 0.046 8 0 "[ . 1 . 2]"
1 114 VAL 3.773 0.136 18 0 "[ . 1 . 2]"
1 115 LYS 1.171 0.074 18 0 "[ . 1 . 2]"
1 116 MET 4.944 0.195 6 0 "[ . 1 . 2]"
1 117 MET 1.939 0.053 10 0 "[ . 1 . 2]"
1 118 GLU 0.846 0.041 18 0 "[ . 1 . 2]"
1 119 ARG 3.491 0.095 2 0 "[ . 1 . 2]"
1 120 VAL 4.576 0.099 8 0 "[ . 1 . 2]"
1 121 VAL 0.772 0.200 9 0 "[ . 1 . 2]"
1 122 GLU 0.595 0.049 18 0 "[ . 1 . 2]"
1 123 GLN 0.781 0.032 15 0 "[ . 1 . 2]"
1 124 MET 2.141 0.090 13 0 "[ . 1 . 2]"
1 125 CYS 3.126 0.083 12 0 "[ . 1 . 2]"
1 126 ILE 5.805 0.195 14 0 "[ . 1 . 2]"
1 127 THR 4.445 0.187 18 0 "[ . 1 . 2]"
1 128 GLN 1.102 0.081 18 0 "[ . 1 . 2]"
1 129 TYR 1.199 0.064 15 0 "[ . 1 . 2]"
1 130 LYS 2.424 0.195 14 0 "[ . 1 . 2]"
1 131 ARG 0.365 0.081 18 0 "[ . 1 . 2]"
1 132 GLU 0.234 0.024 7 0 "[ . 1 . 2]"
1 133 SER 1.007 0.060 14 0 "[ . 1 . 2]"
1 134 GLN 0.276 0.026 12 0 "[ . 1 . 2]"
1 135 ALA 0.968 0.045 12 0 "[ . 1 . 2]"
1 136 TYR 0.963 0.032 12 0 "[ . 1 . 2]"
1 137 TYR 0.655 0.020 10 0 "[ . 1 . 2]"
1 138 GLN 0.712 0.045 12 0 "[ . 1 . 2]"
1 139 ARG 1.286 0.195 17 0 "[ . 1 . 2]"
1 140 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 SER 0.018 0.012 11 0 "[ . 1 . 2]"
1 142 SER 0.316 0.034 19 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 2 GLN HA 1 2 GLN QB 2.640 . 2.640 2.330 2.172 2.473 . 0 0 "[ . 1 . 2]" 1
2 1 2 GLN QB 1 2 GLN QG 2.370 . 2.370 2.074 2.009 2.119 . 0 0 "[ . 1 . 2]" 1
3 1 6 THR HA 1 6 THR MG 3.210 . 3.210 2.511 2.259 3.241 0.031 12 0 "[ . 1 . 2]" 1
4 1 6 THR MG 1 7 HIS H 5.390 . 5.390 3.361 2.143 4.335 . 0 0 "[ . 1 . 2]" 1
5 1 7 HIS QB 1 7 HIS HD2 3.130 . 3.130 2.735 2.643 3.004 . 0 0 "[ . 1 . 2]" 1
6 1 8 SER HA 1 9 GLN H 3.290 . 3.290 2.384 2.162 2.592 . 0 0 "[ . 1 . 2]" 1
7 1 8 SER HA 1 9 GLN QG 4.340 . 4.340 3.976 3.598 4.389 0.049 14 0 "[ . 1 . 2]" 1
8 1 8 SER QB 1 9 GLN H 4.390 . 4.390 2.641 2.238 3.455 . 0 0 "[ . 1 . 2]" 1
9 1 8 SER QB 1 10 TRP H 5.340 . 5.340 4.681 2.907 5.354 0.014 14 0 "[ . 1 . 2]" 1
10 1 9 GLN H 1 9 GLN QB 3.520 . 3.520 2.535 2.271 2.692 . 0 0 "[ . 1 . 2]" 1
11 1 9 GLN H 1 9 GLN QG 4.460 . 4.460 3.112 2.495 3.850 . 0 0 "[ . 1 . 2]" 1
12 1 9 GLN HA 1 9 GLN QE 4.030 . 4.030 3.803 2.549 4.066 0.036 18 0 "[ . 1 . 2]" 1
13 1 9 GLN HA 1 9 GLN QG 2.990 . 2.990 2.522 2.329 2.839 . 0 0 "[ . 1 . 2]" 1
14 1 9 GLN HA 1 10 TRP H 2.980 . 2.980 2.228 2.045 3.015 0.035 3 0 "[ . 1 . 2]" 1
15 1 9 GLN HA 1 10 TRP QB 5.020 . 5.020 4.573 4.441 4.788 . 0 0 "[ . 1 . 2]" 1
16 1 9 GLN HA 1 10 TRP HD1 5.500 . 5.500 4.882 4.176 5.541 0.041 18 0 "[ . 1 . 2]" 1
17 1 9 GLN HA 1 10 TRP HE3 5.500 . 5.500 5.246 3.754 5.510 0.010 3 0 "[ . 1 . 2]" 1
18 1 9 GLN HA 1 11 ASN H 4.390 . 4.390 3.684 3.242 4.319 . 0 0 "[ . 1 . 2]" 1
19 1 9 GLN QB 1 9 GLN QG 2.270 . 2.270 2.060 2.003 2.110 . 0 0 "[ . 1 . 2]" 1
20 1 9 GLN QB 1 10 TRP H 4.280 . 4.280 3.324 2.483 3.767 . 0 0 "[ . 1 . 2]" 1
21 1 9 GLN QB 1 10 TRP HA 4.820 . 4.820 4.394 4.116 4.865 0.045 3 0 "[ . 1 . 2]" 1
22 1 9 GLN QB 1 11 ASN H 4.470 . 4.470 3.074 2.627 3.908 . 0 0 "[ . 1 . 2]" 1
23 1 9 GLN HG2 1 10 TRP H 5.500 . 5.500 4.779 4.318 5.500 . 0 0 "[ . 1 . 2]" 1
24 1 9 GLN HG3 1 10 TRP H 5.500 . 5.500 5.086 4.499 5.519 0.019 8 0 "[ . 1 . 2]" 1
25 1 10 TRP H 1 10 TRP QB 3.630 . 3.630 2.713 2.543 3.424 . 0 0 "[ . 1 . 2]" 1
26 1 10 TRP HA 1 10 TRP QB 2.620 . 2.620 2.266 2.101 2.325 . 0 0 "[ . 1 . 2]" 1
27 1 10 TRP HA 1 10 TRP HE3 3.380 . 3.380 2.404 2.084 3.578 0.198 18 0 "[ . 1 . 2]" 1
28 1 10 TRP QB 1 10 TRP HD1 3.350 . 3.350 2.514 2.500 2.560 . 0 0 "[ . 1 . 2]" 1
29 1 10 TRP QB 1 10 TRP HE3 3.640 . 3.640 3.033 2.871 3.272 . 0 0 "[ . 1 . 2]" 1
30 1 10 TRP HB2 1 10 TRP HD1 3.850 . 3.850 2.647 2.550 3.491 . 0 0 "[ . 1 . 2]" 1
31 1 10 TRP HB3 1 10 TRP HD1 3.850 . 3.850 3.493 2.604 3.677 . 0 0 "[ . 1 . 2]" 1
32 1 11 ASN H 1 11 ASN QB 3.690 . 3.690 2.604 2.251 3.174 . 0 0 "[ . 1 . 2]" 1
33 1 11 ASN H 1 12 LYS HD2 5.500 . 5.500 5.026 3.815 5.512 0.012 14 0 "[ . 1 . 2]" 1
34 1 11 ASN H 1 12 LYS HD3 5.500 . 5.500 4.550 3.804 5.511 0.011 7 0 "[ . 1 . 2]" 1
35 1 11 ASN H 1 12 LYS QG 5.070 . 5.070 4.862 3.789 5.090 0.020 1 0 "[ . 1 . 2]" 1
36 1 11 ASN HA 1 11 ASN QB 2.560 . 2.560 2.326 2.195 2.427 . 0 0 "[ . 1 . 2]" 1
37 1 11 ASN HA 1 12 LYS H 2.760 . 2.760 2.304 2.135 2.788 0.028 20 0 "[ . 1 . 2]" 1
38 1 11 ASN QB 1 12 LYS H 4.310 . 4.310 3.468 2.605 4.086 . 0 0 "[ . 1 . 2]" 1
39 1 11 ASN HB2 1 12 LYS H 5.120 . 5.120 3.844 2.641 4.725 . 0 0 "[ . 1 . 2]" 1
40 1 11 ASN HB3 1 12 LYS H 5.120 . 5.120 4.132 3.737 4.472 . 0 0 "[ . 1 . 2]" 1
41 1 11 ASN QD 1 13 PRO HD2 5.340 . 5.340 5.354 5.319 5.373 0.033 14 0 "[ . 1 . 2]" 1
42 1 11 ASN QD 1 13 PRO HD3 4.410 . 4.410 4.252 4.104 4.419 0.009 3 0 "[ . 1 . 2]" 1
43 1 11 ASN HD21 1 13 PRO HD3 5.160 . 5.160 4.841 4.485 5.163 0.003 18 0 "[ . 1 . 2]" 1
44 1 11 ASN HD22 1 13 PRO HD3 5.160 . 5.160 4.768 4.353 5.168 0.008 19 0 "[ . 1 . 2]" 1
45 1 12 LYS H 1 12 LYS QB 3.500 . 3.500 2.931 2.493 3.411 . 0 0 "[ . 1 . 2]" 1
46 1 12 LYS H 1 12 LYS HG2 4.750 . 4.750 3.558 2.349 4.763 0.013 7 0 "[ . 1 . 2]" 1
47 1 12 LYS H 1 12 LYS QG 3.950 . 3.950 3.084 2.329 3.872 . 0 0 "[ . 1 . 2]" 1
48 1 12 LYS H 1 12 LYS HG3 4.750 . 4.750 3.980 3.264 4.565 . 0 0 "[ . 1 . 2]" 1
49 1 12 LYS H 1 13 PRO HD2 4.890 . 4.890 4.882 4.825 4.899 0.009 3 0 "[ . 1 . 2]" 1
50 1 12 LYS HA 1 12 LYS QB 2.600 . 2.600 2.308 2.181 2.430 . 0 0 "[ . 1 . 2]" 1
51 1 12 LYS HA 1 12 LYS QG 3.600 . 3.600 2.892 2.342 3.402 . 0 0 "[ . 1 . 2]" 1
52 1 12 LYS HA 1 13 PRO HD2 2.510 . 2.510 2.419 2.224 2.513 0.003 9 0 "[ . 1 . 2]" 1
53 1 12 LYS HA 1 13 PRO HD3 2.510 . 2.510 2.458 2.303 2.523 0.013 10 0 "[ . 1 . 2]" 1
54 1 12 LYS QB 1 13 PRO HD2 3.380 . 3.380 2.366 2.161 2.551 . 0 0 "[ . 1 . 2]" 1
55 1 12 LYS HB2 1 13 PRO HD2 3.950 . 3.950 3.221 2.219 3.988 0.038 12 0 "[ . 1 . 2]" 1
56 1 12 LYS HB3 1 13 PRO HD2 3.950 . 3.950 2.940 2.175 3.752 . 0 0 "[ . 1 . 2]" 1
57 1 12 LYS QG 1 13 PRO HD2 4.770 . 4.770 3.743 3.268 4.109 . 0 0 "[ . 1 . 2]" 1
58 1 12 LYS HG2 1 13 PRO HD2 5.500 . 5.500 4.391 3.363 4.906 . 0 0 "[ . 1 . 2]" 1
59 1 12 LYS HG2 1 13 PRO HD3 5.500 . 5.500 5.359 4.433 5.513 0.013 15 0 "[ . 1 . 2]" 1
60 1 12 LYS HG3 1 13 PRO HD2 5.500 . 5.500 4.096 3.630 4.444 . 0 0 "[ . 1 . 2]" 1
61 1 12 LYS HG3 1 13 PRO HD3 5.500 . 5.500 5.117 4.456 5.530 0.030 14 0 "[ . 1 . 2]" 1
62 1 13 PRO HA 1 14 SER H 2.660 . 2.660 2.315 2.173 2.446 . 0 0 "[ . 1 . 2]" 1
63 1 13 PRO QB 1 14 SER H 3.670 . 3.670 2.795 2.474 3.679 0.009 9 0 "[ . 1 . 2]" 1
64 1 13 PRO HB2 1 14 SER H 4.330 . 4.330 2.901 2.525 3.987 . 0 0 "[ . 1 . 2]" 1
65 1 13 PRO HB3 1 14 SER H 4.330 . 4.330 3.695 3.543 4.318 . 0 0 "[ . 1 . 2]" 1
66 1 13 PRO HD3 1 14 SER H 5.500 . 5.500 5.502 5.407 5.527 0.027 19 0 "[ . 1 . 2]" 1
67 1 14 SER H 1 14 SER QB 3.270 . 3.270 2.904 2.482 3.269 . 0 0 "[ . 1 . 2]" 1
68 1 14 SER HA 1 14 SER HB2 2.990 . 2.990 2.607 2.448 3.012 0.022 19 0 "[ . 1 . 2]" 1
69 1 14 SER HA 1 14 SER QB 2.530 . 2.530 2.246 2.168 2.441 . 0 0 "[ . 1 . 2]" 1
70 1 14 SER HA 1 14 SER HB3 2.990 . 2.990 2.480 2.307 2.985 . 0 0 "[ . 1 . 2]" 1
71 1 14 SER HA 1 15 LYS H 2.680 . 2.680 2.364 2.151 2.691 0.011 11 0 "[ . 1 . 2]" 1
72 1 14 SER QB 1 15 LYS H 3.530 . 3.530 2.783 2.336 3.608 0.078 11 0 "[ . 1 . 2]" 1
73 1 14 SER QB 1 15 LYS QB 5.180 . 5.180 4.547 3.889 4.993 . 0 0 "[ . 1 . 2]" 1
74 1 15 LYS H 1 15 LYS HB2 3.750 . 3.750 3.060 2.430 3.376 . 0 0 "[ . 1 . 2]" 1
75 1 15 LYS H 1 15 LYS QB 3.120 . 3.120 2.591 2.209 2.838 . 0 0 "[ . 1 . 2]" 1
76 1 15 LYS H 1 15 LYS HB3 3.750 . 3.750 2.806 2.474 3.052 . 0 0 "[ . 1 . 2]" 1
77 1 15 LYS H 1 15 LYS HG2 5.330 . 5.330 4.588 4.433 4.688 . 0 0 "[ . 1 . 2]" 1
78 1 15 LYS H 1 15 LYS QG 4.590 . 4.590 4.154 3.994 4.256 . 0 0 "[ . 1 . 2]" 1
79 1 15 LYS H 1 15 LYS HG3 5.330 . 5.330 4.750 4.507 4.882 . 0 0 "[ . 1 . 2]" 1
80 1 15 LYS H 1 16 PRO QD 5.010 . 5.010 4.321 4.162 4.496 . 0 0 "[ . 1 . 2]" 1
81 1 15 LYS HA 1 15 LYS HD2 5.500 . 5.500 4.531 4.282 4.778 . 0 0 "[ . 1 . 2]" 1
82 1 15 LYS HA 1 15 LYS QD 4.770 . 4.770 4.101 3.980 4.295 . 0 0 "[ . 1 . 2]" 1
83 1 15 LYS HA 1 15 LYS HD3 5.500 . 5.500 4.710 4.330 4.937 . 0 0 "[ . 1 . 2]" 1
84 1 15 LYS HA 1 15 LYS QG 3.740 . 3.740 2.442 2.380 2.521 . 0 0 "[ . 1 . 2]" 1
85 1 15 LYS HA 1 16 PRO HB3 4.980 . 4.980 4.848 4.802 4.939 . 0 0 "[ . 1 . 2]" 1
86 1 15 LYS HA 1 16 PRO HD2 2.460 . 2.460 2.324 2.183 2.424 . 0 0 "[ . 1 . 2]" 1
87 1 15 LYS HA 1 16 PRO HD3 2.460 . 2.460 2.458 2.391 2.485 0.025 12 0 "[ . 1 . 2]" 1
88 1 15 LYS HA 1 16 PRO HG2 5.340 . 5.340 4.480 4.369 4.558 . 0 0 "[ . 1 . 2]" 1
89 1 15 LYS HA 1 16 PRO QG 4.570 . 4.570 4.032 3.944 4.089 . 0 0 "[ . 1 . 2]" 1
90 1 15 LYS HA 1 16 PRO HG3 5.340 . 5.340 4.574 4.491 4.626 . 0 0 "[ . 1 . 2]" 1
91 1 15 LYS QB 1 16 PRO QD 3.460 . 3.460 3.504 3.468 3.530 0.070 17 0 "[ . 1 . 2]" 1
92 1 15 LYS QG 1 16 PRO HA 4.780 . 4.780 4.440 4.241 4.673 . 0 0 "[ . 1 . 2]" 1
93 1 15 LYS QG 1 16 PRO QD 3.580 . 3.580 2.167 2.079 2.348 . 0 0 "[ . 1 . 2]" 1
94 1 15 LYS HG2 1 16 PRO HD2 4.980 . 4.980 2.557 2.117 2.887 . 0 0 "[ . 1 . 2]" 1
95 1 15 LYS HG2 1 16 PRO HD3 4.980 . 4.980 4.052 3.658 4.348 . 0 0 "[ . 1 . 2]" 1
96 1 15 LYS HG3 1 16 PRO HD2 4.980 . 4.980 2.430 2.203 3.280 . 0 0 "[ . 1 . 2]" 1
97 1 15 LYS HG3 1 16 PRO HD3 4.980 . 4.980 3.928 3.678 4.815 . 0 0 "[ . 1 . 2]" 1
98 1 16 PRO HA 1 17 LYS H 2.650 . 2.650 2.359 2.155 2.560 . 0 0 "[ . 1 . 2]" 1
99 1 16 PRO HB3 1 17 LYS H 4.520 . 4.520 3.663 3.459 3.893 . 0 0 "[ . 1 . 2]" 1
100 1 16 PRO QD 1 17 LYS H 4.960 . 4.960 4.961 4.864 4.999 0.039 12 0 "[ . 1 . 2]" 1
101 1 17 LYS H 1 17 LYS QB 2.960 . 2.960 2.598 2.143 2.992 0.032 13 0 "[ . 1 . 2]" 1
102 1 17 LYS H 1 17 LYS HG2 5.230 . 5.230 3.694 2.066 4.817 . 0 0 "[ . 1 . 2]" 1
103 1 17 LYS H 1 17 LYS QG 4.450 . 4.450 3.056 2.040 4.271 . 0 0 "[ . 1 . 2]" 1
104 1 17 LYS H 1 17 LYS HG3 5.230 . 5.230 3.576 2.486 4.998 . 0 0 "[ . 1 . 2]" 1
105 1 17 LYS H 1 18 THR H 4.580 . 4.580 3.774 2.721 4.588 0.008 20 0 "[ . 1 . 2]" 1
106 1 17 LYS HA 1 17 LYS QB 2.520 . 2.520 2.360 2.142 2.485 . 0 0 "[ . 1 . 2]" 1
107 1 17 LYS HA 1 17 LYS QG 3.280 . 3.280 2.702 2.400 3.337 0.057 3 0 "[ . 1 . 2]" 1
108 1 17 LYS HA 1 18 THR H 2.890 . 2.890 2.462 2.169 2.906 0.016 7 0 "[ . 1 . 2]" 1
109 1 17 LYS QB 1 17 LYS QG 2.350 . 2.350 2.082 2.017 2.115 . 0 0 "[ . 1 . 2]" 1
110 1 17 LYS QB 1 18 THR H 4.000 . 4.000 3.598 2.609 4.019 0.019 8 0 "[ . 1 . 2]" 1
111 1 17 LYS QB 1 19 ASN QD 4.510 . 4.510 4.054 2.463 4.539 0.029 5 0 "[ . 1 . 2]" 1
112 1 17 LYS QD 1 17 LYS QG 2.330 . 2.330 2.105 2.029 2.121 . 0 0 "[ . 1 . 2]" 1
113 1 17 LYS QE 1 17 LYS QG 3.140 . 3.140 2.258 2.110 2.384 . 0 0 "[ . 1 . 2]" 1
114 1 18 THR H 1 19 ASN H 5.150 . 5.150 4.218 3.101 4.672 . 0 0 "[ . 1 . 2]" 1
115 1 18 THR HA 1 18 THR HB 2.540 . 2.540 2.536 2.490 2.561 0.021 18 0 "[ . 1 . 2]" 1
116 1 18 THR HA 1 18 THR MG 2.640 . 2.640 2.321 2.222 2.383 . 0 0 "[ . 1 . 2]" 1
117 1 18 THR HA 1 19 ASN H 3.520 . 3.520 2.391 2.157 3.019 . 0 0 "[ . 1 . 2]" 1
118 1 18 THR HB 1 19 ASN H 4.740 . 4.740 3.333 2.357 4.386 . 0 0 "[ . 1 . 2]" 1
119 1 18 THR HB 1 19 ASN HA 4.520 . 4.520 4.413 4.227 4.555 0.035 18 0 "[ . 1 . 2]" 1
120 1 18 THR MG 1 19 ASN H 5.500 . 5.500 3.996 3.735 4.465 . 0 0 "[ . 1 . 2]" 1
121 1 19 ASN HA 1 19 ASN QB 2.640 . 2.640 2.357 2.182 2.551 . 0 0 "[ . 1 . 2]" 1
122 1 20 MET H 1 20 MET QG 3.360 . 3.360 2.520 1.819 3.370 0.010 8 0 "[ . 1 . 2]" 1
123 1 20 MET HA 1 20 MET QB 2.610 . 2.610 2.262 2.161 2.416 . 0 0 "[ . 1 . 2]" 1
124 1 20 MET HA 1 20 MET HG2 4.210 . 4.210 3.348 2.472 3.867 . 0 0 "[ . 1 . 2]" 1
125 1 20 MET HA 1 20 MET HG3 4.210 . 4.210 3.592 2.988 3.869 . 0 0 "[ . 1 . 2]" 1
126 1 20 MET HA 1 21 LYS H 3.000 . 3.000 2.365 2.088 2.985 . 0 0 "[ . 1 . 2]" 1
127 1 21 LYS H 1 21 LYS QB 3.120 . 3.120 2.616 2.225 2.909 . 0 0 "[ . 1 . 2]" 1
128 1 21 LYS H 1 21 LYS QG 5.100 . 5.100 3.600 2.470 4.309 . 0 0 "[ . 1 . 2]" 1
129 1 21 LYS HA 1 21 LYS HG2 3.580 . 3.580 2.716 2.438 3.105 . 0 0 "[ . 1 . 2]" 1
130 1 21 LYS HA 1 21 LYS QG 3.010 . 3.010 2.419 2.281 2.485 . 0 0 "[ . 1 . 2]" 1
131 1 21 LYS HA 1 21 LYS HG3 3.580 . 3.580 2.916 2.382 3.284 . 0 0 "[ . 1 . 2]" 1
132 1 21 LYS HB2 1 22 HIS H 5.220 . 5.220 4.212 3.463 4.737 . 0 0 "[ . 1 . 2]" 1
133 1 21 LYS HB3 1 22 HIS H 5.220 . 5.220 3.641 2.193 4.481 . 0 0 "[ . 1 . 2]" 1
134 1 21 LYS QD 1 21 LYS QG 2.340 . 2.340 2.054 2.025 2.113 . 0 0 "[ . 1 . 2]" 1
135 1 22 HIS HA 1 22 HIS QB 2.520 . 2.520 2.360 2.251 2.442 . 0 0 "[ . 1 . 2]" 1
136 1 22 HIS HA 1 22 HIS HD2 3.070 . 3.070 2.986 2.771 3.108 0.038 12 0 "[ . 1 . 2]" 1
137 1 22 HIS HA 1 23 MET H 3.490 . 3.490 2.330 2.132 2.778 . 0 0 "[ . 1 . 2]" 1
138 1 22 HIS HA 1 23 MET QG 4.340 . 4.340 3.838 3.360 4.352 0.012 7 0 "[ . 1 . 2]" 1
139 1 22 HIS QB 1 22 HIS HD2 2.890 . 2.890 2.858 2.758 2.923 0.033 18 0 "[ . 1 . 2]" 1
140 1 22 HIS HB2 1 23 MET H 5.200 . 5.200 4.046 2.957 4.674 . 0 0 "[ . 1 . 2]" 1
141 1 22 HIS HB3 1 23 MET H 5.200 . 5.200 3.540 1.980 4.482 . 0 0 "[ . 1 . 2]" 1
142 1 23 MET HA 1 24 ALA H 2.810 . 2.810 2.362 2.201 2.510 . 0 0 "[ . 1 . 2]" 1
143 1 23 MET QB 1 24 ALA H 3.850 . 3.850 2.653 2.320 3.077 . 0 0 "[ . 1 . 2]" 1
144 1 23 MET QB 1 24 ALA HA 4.200 . 4.200 4.051 3.875 4.234 0.034 18 0 "[ . 1 . 2]" 1
145 1 24 ALA H 1 24 ALA MB 3.110 . 3.110 2.737 2.346 2.847 . 0 0 "[ . 1 . 2]" 1
146 1 24 ALA H 1 25 GLY HA2 5.500 . 5.500 5.066 4.446 5.507 0.007 7 0 "[ . 1 . 2]" 1
147 1 24 ALA H 1 25 GLY HA3 5.500 . 5.500 4.657 4.309 5.528 0.028 18 0 "[ . 1 . 2]" 1
148 1 24 ALA HA 1 25 GLY H 2.950 . 2.950 2.493 2.191 2.963 0.013 10 0 "[ . 1 . 2]" 1
149 1 24 ALA MB 1 25 GLY H 3.750 . 3.750 2.571 2.269 3.595 . 0 0 "[ . 1 . 2]" 1
150 1 25 GLY QA 1 26 ALA H 2.620 . 2.620 2.363 2.134 2.647 0.027 19 0 "[ . 1 . 2]" 1
151 1 26 ALA H 1 26 ALA MB 2.870 . 2.870 2.636 2.237 2.810 . 0 0 "[ . 1 . 2]" 1
152 1 26 ALA HA 1 27 ALA H 2.580 . 2.580 2.373 2.183 2.592 0.012 18 0 "[ . 1 . 2]" 1
153 1 27 ALA H 1 27 ALA MB 2.890 . 2.890 2.706 2.276 2.783 . 0 0 "[ . 1 . 2]" 1
154 1 27 ALA HA 1 28 ALA H 2.710 . 2.710 2.338 2.229 2.531 . 0 0 "[ . 1 . 2]" 1
155 1 27 ALA MB 1 28 ALA H 3.360 . 3.360 2.711 2.375 2.936 . 0 0 "[ . 1 . 2]" 1
156 1 28 ALA H 1 28 ALA MB 3.090 . 3.090 2.634 2.260 2.758 . 0 0 "[ . 1 . 2]" 1
157 1 28 ALA HA 1 29 ALA H 2.870 . 2.870 2.440 2.161 2.888 0.018 18 0 "[ . 1 . 2]" 1
158 1 28 ALA MB 1 29 ALA H 4.310 . 4.310 3.141 2.533 3.776 . 0 0 "[ . 1 . 2]" 1
159 1 29 ALA H 1 29 ALA MB 3.430 . 3.430 2.734 2.567 2.859 . 0 0 "[ . 1 . 2]" 1
160 1 29 ALA H 1 30 GLY QA 4.300 . 4.300 4.288 4.146 4.342 0.042 18 0 "[ . 1 . 2]" 1
161 1 29 ALA HA 1 30 GLY H 2.680 . 2.680 2.435 2.163 2.689 0.009 1 0 "[ . 1 . 2]" 1
162 1 29 ALA MB 1 30 GLY H 3.670 . 3.670 2.677 2.301 3.690 0.020 1 0 "[ . 1 . 2]" 1
163 1 30 GLY QA 1 31 ALA H 2.460 . 2.460 2.312 2.116 2.566 0.106 3 0 "[ . 1 . 2]" 1
164 1 30 GLY QA 1 32 VAL HB 4.740 . 4.740 4.457 3.878 4.765 0.025 3 0 "[ . 1 . 2]" 1
165 1 30 GLY QA 1 32 VAL QG 3.480 . 3.480 3.197 2.685 3.633 0.153 18 0 "[ . 1 . 2]" 1
166 1 31 ALA H 1 31 ALA MB 2.880 . 2.880 2.598 2.221 2.870 . 0 0 "[ . 1 . 2]" 1
167 1 31 ALA HA 1 32 VAL H 2.850 . 2.850 2.778 2.431 2.874 0.024 12 0 "[ . 1 . 2]" 1
168 1 31 ALA HA 1 32 VAL QG 4.380 . 4.380 4.308 4.047 4.450 0.070 12 0 "[ . 1 . 2]" 1
169 1 31 ALA MB 1 32 VAL H 3.790 . 3.790 3.714 3.654 3.775 . 0 0 "[ . 1 . 2]" 1
170 1 32 VAL H 1 32 VAL HB 3.240 . 3.240 2.616 2.467 2.770 . 0 0 "[ . 1 . 2]" 1
171 1 32 VAL H 1 32 VAL MG1 4.370 . 4.370 3.864 3.780 3.945 . 0 0 "[ . 1 . 2]" 1
172 1 32 VAL H 1 32 VAL QG 2.940 . 2.940 2.511 2.068 2.858 . 0 0 "[ . 1 . 2]" 1
173 1 32 VAL H 1 32 VAL MG2 4.370 . 4.370 2.551 2.078 2.936 . 0 0 "[ . 1 . 2]" 1
174 1 32 VAL HA 1 32 VAL MG1 2.510 . 2.510 2.400 2.367 2.428 . 0 0 "[ . 1 . 2]" 1
175 1 32 VAL HA 1 32 VAL MG2 2.510 . 2.510 2.425 2.392 2.466 . 0 0 "[ . 1 . 2]" 1
176 1 32 VAL HA 1 33 VAL H 2.400 . 2.400 2.177 2.096 2.318 . 0 0 "[ . 1 . 2]" 1
177 1 32 VAL QG 1 33 VAL H 2.830 . 2.830 2.744 2.384 2.914 0.084 3 0 "[ . 1 . 2]" 1
178 1 33 VAL HA 1 33 VAL QG 2.740 . 2.740 2.263 2.130 2.354 . 0 0 "[ . 1 . 2]" 1
179 1 33 VAL HA 1 36 LEU MD1 4.670 . 4.670 3.840 2.463 4.673 0.003 18 0 "[ . 1 . 2]" 1
180 1 33 VAL HA 1 36 LEU MD2 3.840 . 3.840 2.696 2.148 3.540 . 0 0 "[ . 1 . 2]" 1
181 1 33 VAL HB 1 34 GLY H 4.340 . 4.340 3.004 2.108 4.355 0.015 5 0 "[ . 1 . 2]" 1
182 1 33 VAL HB 1 35 GLY H 4.820 . 4.820 3.035 2.470 4.532 . 0 0 "[ . 1 . 2]" 1
183 1 33 VAL HB 1 36 LEU MD2 4.190 . 4.190 3.214 2.109 4.260 0.070 19 0 "[ . 1 . 2]" 1
184 1 33 VAL QG 1 34 GLY H 3.250 . 3.250 3.159 2.249 3.418 0.168 20 0 "[ . 1 . 2]" 1
185 1 33 VAL QG 1 35 GLY H 3.700 . 3.700 2.789 1.775 3.898 0.198 5 0 "[ . 1 . 2]" 1
186 1 33 VAL QG 1 36 LEU H 4.520 . 4.520 3.613 2.386 4.308 . 0 0 "[ . 1 . 2]" 1
187 1 34 GLY H 1 35 GLY H 3.100 . 3.100 2.717 2.218 3.106 0.006 1 0 "[ . 1 . 2]" 1
188 1 34 GLY H 1 36 LEU MD2 4.690 . 4.690 2.586 1.830 4.754 0.064 20 0 "[ . 1 . 2]" 1
189 1 35 GLY H 1 35 GLY QA 2.500 . 2.500 2.285 2.246 2.381 . 0 0 "[ . 1 . 2]" 1
190 1 35 GLY H 1 36 LEU HB3 5.030 . 5.030 4.991 4.606 5.060 0.030 12 0 "[ . 1 . 2]" 1
191 1 35 GLY H 1 36 LEU MD1 4.990 . 4.990 4.949 4.774 5.056 0.066 3 0 "[ . 1 . 2]" 1
192 1 36 LEU H 1 36 LEU HB3 2.770 . 2.770 2.768 2.703 2.800 0.030 20 0 "[ . 1 . 2]" 1
193 1 36 LEU H 1 36 LEU MD2 4.210 . 4.210 2.324 1.924 2.719 . 0 0 "[ . 1 . 2]" 1
194 1 36 LEU H 1 37 GLY H 3.010 . 3.010 2.494 2.193 2.640 . 0 0 "[ . 1 . 2]" 1
195 1 36 LEU H 1 39 TYR HD1 5.390 . 5.390 5.187 5.052 5.249 . 0 0 "[ . 1 . 2]" 1
196 1 36 LEU HA 1 36 LEU HB3 2.640 . 2.640 2.361 2.318 2.389 . 0 0 "[ . 1 . 2]" 1
197 1 36 LEU HA 1 36 LEU HG 3.850 . 3.850 3.652 3.612 3.718 . 0 0 "[ . 1 . 2]" 1
198 1 36 LEU HA 1 38 GLY H 4.380 . 4.380 4.317 4.220 4.383 0.003 18 0 "[ . 1 . 2]" 1
199 1 36 LEU HA 1 39 TYR HD1 3.430 . 3.430 3.425 3.303 3.450 0.020 19 0 "[ . 1 . 2]" 1
200 1 36 LEU HA 1 39 TYR HE1 4.040 . 4.040 3.870 3.686 4.035 . 0 0 "[ . 1 . 2]" 1
201 1 36 LEU HA 1 93 ILE MD 3.950 . 3.950 3.099 2.679 3.581 . 0 0 "[ . 1 . 2]" 1
202 1 36 LEU HA 1 93 ILE MG 4.700 . 4.700 3.738 3.057 4.285 . 0 0 "[ . 1 . 2]" 1
203 1 36 LEU HB2 1 36 LEU MD1 2.740 . 2.740 2.181 2.152 2.203 . 0 0 "[ . 1 . 2]" 1
204 1 36 LEU HB2 1 36 LEU MD2 3.080 . 3.080 2.952 2.855 3.081 0.001 2 0 "[ . 1 . 2]" 1
205 1 36 LEU HB2 1 37 GLY HA2 5.390 . 5.390 5.324 5.264 5.392 0.002 20 0 "[ . 1 . 2]" 1
206 1 36 LEU HB2 1 37 GLY HA3 5.120 . 5.120 4.882 4.819 4.933 . 0 0 "[ . 1 . 2]" 1
207 1 36 LEU HB2 1 38 GLY H 4.810 . 4.810 3.479 3.277 3.528 . 0 0 "[ . 1 . 2]" 1
208 1 36 LEU HB2 1 38 GLY HA3 5.500 . 5.500 5.514 5.505 5.528 0.028 12 0 "[ . 1 . 2]" 1
209 1 36 LEU HB2 1 39 TYR H 4.290 . 4.290 3.309 3.047 3.465 . 0 0 "[ . 1 . 2]" 1
210 1 36 LEU HB2 1 39 TYR HA 5.170 . 5.170 4.907 4.809 5.053 . 0 0 "[ . 1 . 2]" 1
211 1 36 LEU HB2 1 39 TYR HD1 3.480 . 3.480 2.017 1.985 2.090 . 0 0 "[ . 1 . 2]" 1
212 1 36 LEU HB2 1 39 TYR HE1 4.060 . 4.060 4.024 3.912 4.066 0.006 11 0 "[ . 1 . 2]" 1
213 1 36 LEU HB3 1 36 LEU MD1 2.990 . 2.990 2.938 2.771 3.010 0.020 14 0 "[ . 1 . 2]" 1
214 1 36 LEU HB3 1 36 LEU MD2 2.750 . 2.750 2.121 2.083 2.180 . 0 0 "[ . 1 . 2]" 1
215 1 36 LEU HB3 1 37 GLY H 4.230 . 4.230 4.068 3.985 4.130 . 0 0 "[ . 1 . 2]" 1
216 1 36 LEU HB3 1 39 TYR HD1 3.690 . 3.690 3.690 3.672 3.708 0.018 10 0 "[ . 1 . 2]" 1
217 1 36 LEU MD1 1 37 GLY HA2 4.640 . 4.640 4.045 3.692 4.596 . 0 0 "[ . 1 . 2]" 1
218 1 36 LEU MD1 1 39 TYR HB2 3.910 . 3.910 2.268 2.080 2.541 . 0 0 "[ . 1 . 2]" 1
219 1 36 LEU MD1 1 39 TYR HD1 3.460 . 3.460 2.878 2.731 3.158 . 0 0 "[ . 1 . 2]" 1
220 1 36 LEU MD1 1 40 MET HA 4.720 . 4.720 4.360 4.180 4.538 . 0 0 "[ . 1 . 2]" 1
221 1 36 LEU MD1 1 40 MET ME 3.330 . 3.330 3.361 3.308 3.419 0.089 6 0 "[ . 1 . 2]" 1
222 1 36 LEU MD1 1 73 TYR HE2 3.590 . 3.590 2.919 2.480 3.251 . 0 0 "[ . 1 . 2]" 1
223 1 36 LEU MD2 1 39 TYR HB2 3.980 . 3.980 3.644 3.239 4.025 0.045 20 0 "[ . 1 . 2]" 1
224 1 36 LEU MD2 1 39 TYR HD1 4.980 . 4.980 4.564 4.409 4.798 . 0 0 "[ . 1 . 2]" 1
225 1 36 LEU HG 1 37 GLY HA2 4.120 . 4.120 4.108 3.958 4.135 0.015 12 0 "[ . 1 . 2]" 1
226 1 36 LEU HG 1 39 TYR HD1 4.350 . 4.350 4.352 4.119 4.380 0.030 8 0 "[ . 1 . 2]" 1
227 1 37 GLY H 1 37 GLY HA2 2.490 . 2.490 2.318 2.292 2.350 . 0 0 "[ . 1 . 2]" 1
228 1 37 GLY H 1 39 TYR H 5.070 . 5.070 5.001 4.662 5.075 0.005 11 0 "[ . 1 . 2]" 1
229 1 37 GLY HA3 1 38 GLY H 2.620 . 2.620 2.559 2.508 2.624 0.004 12 0 "[ . 1 . 2]" 1
230 1 37 GLY HA3 1 39 TYR HD1 4.410 . 4.410 4.365 4.302 4.414 0.004 2 0 "[ . 1 . 2]" 1
231 1 38 GLY H 1 39 TYR H 3.520 . 3.520 3.353 3.053 3.490 . 0 0 "[ . 1 . 2]" 1
232 1 38 GLY H 1 39 TYR HB2 4.420 . 4.420 4.387 4.177 4.427 0.007 14 0 "[ . 1 . 2]" 1
233 1 38 GLY H 1 39 TYR HD1 4.350 . 4.350 2.226 2.098 2.283 . 0 0 "[ . 1 . 2]" 1
234 1 38 GLY HA2 1 39 TYR HD1 4.150 . 4.150 4.161 4.151 4.187 0.037 8 0 "[ . 1 . 2]" 1
235 1 38 GLY HA3 1 39 TYR HB2 5.500 . 5.500 5.511 5.504 5.519 0.019 12 0 "[ . 1 . 2]" 1
236 1 38 GLY HA3 1 39 TYR HD1 4.310 . 4.310 4.102 3.879 4.255 . 0 0 "[ . 1 . 2]" 1
237 1 38 GLY HA3 1 39 TYR HE1 5.010 . 5.010 4.964 4.572 5.022 0.012 18 0 "[ . 1 . 2]" 1
238 1 39 TYR H 1 39 TYR HB2 3.030 . 3.030 2.655 2.478 2.742 . 0 0 "[ . 1 . 2]" 1
239 1 39 TYR H 1 39 TYR HD1 3.330 . 3.330 3.006 2.584 3.166 . 0 0 "[ . 1 . 2]" 1
240 1 39 TYR H 1 40 MET H 4.530 . 4.530 4.416 4.367 4.507 . 0 0 "[ . 1 . 2]" 1
241 1 39 TYR HA 1 39 TYR HD2 3.430 . 3.430 3.264 3.129 3.388 . 0 0 "[ . 1 . 2]" 1
242 1 39 TYR HA 1 40 MET H 3.200 . 3.200 2.298 2.208 2.420 . 0 0 "[ . 1 . 2]" 1
243 1 39 TYR HA 1 40 MET ME 5.040 . 5.040 4.900 4.809 4.970 . 0 0 "[ . 1 . 2]" 1
244 1 39 TYR HA 1 40 MET HG2 4.450 . 4.450 4.350 4.116 4.453 0.003 15 0 "[ . 1 . 2]" 1
245 1 39 TYR HA 1 74 TYR HE2 3.250 . 3.250 1.944 1.865 2.079 . 0 0 "[ . 1 . 2]" 1
246 1 39 TYR HB2 1 39 TYR HD1 3.470 . 3.470 2.535 2.475 2.589 . 0 0 "[ . 1 . 2]" 1
247 1 39 TYR HB2 1 93 ILE MD 5.370 . 5.370 4.478 4.286 4.745 . 0 0 "[ . 1 . 2]" 1
248 1 39 TYR HB2 1 93 ILE MG 3.830 . 3.830 2.615 2.423 2.798 . 0 0 "[ . 1 . 2]" 1
249 1 39 TYR HB3 1 39 TYR HD2 3.640 . 3.640 2.381 2.345 2.407 . 0 0 "[ . 1 . 2]" 1
250 1 39 TYR HB3 1 40 MET H 3.730 . 3.730 2.910 2.597 3.092 . 0 0 "[ . 1 . 2]" 1
251 1 39 TYR HB3 1 73 TYR HD2 3.940 . 3.940 2.043 1.984 2.085 . 0 0 "[ . 1 . 2]" 1
252 1 39 TYR HB3 1 73 TYR HE2 3.290 . 3.290 3.019 2.809 3.194 . 0 0 "[ . 1 . 2]" 1
253 1 39 TYR HB3 1 93 ILE MD 5.500 . 5.500 4.881 4.611 5.152 . 0 0 "[ . 1 . 2]" 1
254 1 39 TYR HB3 1 93 ILE MG 3.960 . 3.960 2.555 2.319 2.780 . 0 0 "[ . 1 . 2]" 1
255 1 39 TYR HD2 1 40 MET H 4.740 . 4.740 4.064 3.804 4.261 . 0 0 "[ . 1 . 2]" 1
256 1 39 TYR HD2 1 73 TYR HB3 3.670 . 3.670 3.508 3.129 3.675 0.005 7 0 "[ . 1 . 2]" 1
257 1 39 TYR HD2 1 74 TYR H 5.190 . 5.190 4.680 4.412 4.878 . 0 0 "[ . 1 . 2]" 1
258 1 39 TYR HD2 1 74 TYR HE1 4.450 . 4.450 3.686 3.431 3.919 . 0 0 "[ . 1 . 2]" 1
259 1 39 TYR HD2 1 74 TYR HE2 4.810 . 4.810 3.867 3.434 4.111 . 0 0 "[ . 1 . 2]" 1
260 1 39 TYR HD2 1 93 ILE HB 4.720 . 4.720 4.161 3.873 4.482 . 0 0 "[ . 1 . 2]" 1
261 1 39 TYR HD2 1 93 ILE HG13 4.240 . 4.240 3.204 2.790 3.529 . 0 0 "[ . 1 . 2]" 1
262 1 39 TYR HD2 1 93 ILE MG 3.600 . 3.600 3.254 2.982 3.589 . 0 0 "[ . 1 . 2]" 1
263 1 39 TYR HE2 1 74 TYR HE1 3.800 . 3.800 3.649 3.349 3.801 0.001 20 0 "[ . 1 . 2]" 1
264 1 39 TYR HE2 1 76 PRO HD3 5.500 . 5.500 4.745 4.103 5.267 . 0 0 "[ . 1 . 2]" 1
265 1 40 MET H 1 40 MET HB2 3.930 . 3.930 2.505 2.462 2.551 . 0 0 "[ . 1 . 2]" 1
266 1 40 MET H 1 40 MET HB3 3.920 . 3.920 3.651 3.619 3.719 . 0 0 "[ . 1 . 2]" 1
267 1 40 MET H 1 41 LEU H 4.620 . 4.620 4.478 4.442 4.505 . 0 0 "[ . 1 . 2]" 1
268 1 40 MET H 1 73 TYR HA 5.440 . 5.440 4.940 4.809 5.123 . 0 0 "[ . 1 . 2]" 1
269 1 40 MET H 1 73 TYR HB3 4.620 . 4.620 3.664 3.569 3.769 . 0 0 "[ . 1 . 2]" 1
270 1 40 MET H 1 73 TYR HE2 4.950 . 4.950 3.961 3.867 4.086 . 0 0 "[ . 1 . 2]" 1
271 1 40 MET H 1 74 TYR H 4.000 . 4.000 3.634 3.514 3.765 . 0 0 "[ . 1 . 2]" 1
272 1 40 MET HA 1 40 MET HB3 2.910 . 2.910 2.652 2.585 2.689 . 0 0 "[ . 1 . 2]" 1
273 1 40 MET HA 1 40 MET ME 2.790 . 2.790 2.018 1.954 2.083 . 0 0 "[ . 1 . 2]" 1
274 1 40 MET HA 1 40 MET HG2 2.770 . 2.770 2.723 2.682 2.773 0.003 12 0 "[ . 1 . 2]" 1
275 1 40 MET HA 1 41 LEU H 2.840 . 2.840 2.268 2.229 2.309 . 0 0 "[ . 1 . 2]" 1
276 1 40 MET HA 1 41 LEU QD 4.840 . 4.840 3.491 3.281 3.736 . 0 0 "[ . 1 . 2]" 1
277 1 40 MET HA 1 73 TYR HB3 5.500 . 5.500 5.304 5.185 5.415 . 0 0 "[ . 1 . 2]" 1
278 1 40 MET HA 1 73 TYR HE2 3.640 . 3.640 3.077 2.953 3.127 . 0 0 "[ . 1 . 2]" 1
279 1 40 MET HA 1 74 TYR HE2 4.990 . 4.990 4.737 4.563 4.858 . 0 0 "[ . 1 . 2]" 1
280 1 40 MET HB2 1 40 MET ME 3.920 . 3.920 3.958 3.937 3.973 0.053 14 0 "[ . 1 . 2]" 1
281 1 40 MET HB2 1 73 TYR HE2 5.500 . 5.500 5.509 5.501 5.522 0.022 12 0 "[ . 1 . 2]" 1
282 1 40 MET HB2 1 74 TYR H 5.200 . 5.200 4.810 4.602 5.064 . 0 0 "[ . 1 . 2]" 1
283 1 40 MET HB2 1 74 TYR HD2 4.670 . 4.670 2.682 2.480 2.918 . 0 0 "[ . 1 . 2]" 1
284 1 40 MET HB2 1 74 TYR HE2 4.240 . 4.240 3.249 3.058 3.417 . 0 0 "[ . 1 . 2]" 1
285 1 40 MET HB3 1 41 LEU H 3.000 . 3.000 2.791 2.694 2.889 . 0 0 "[ . 1 . 2]" 1
286 1 40 MET HB3 1 41 LEU QD 5.260 . 5.260 4.805 4.636 5.159 . 0 0 "[ . 1 . 2]" 1
287 1 40 MET HB3 1 74 TYR H 5.500 . 5.500 5.247 5.000 5.466 . 0 0 "[ . 1 . 2]" 1
288 1 40 MET HB3 1 74 TYR HD2 4.320 . 4.320 3.808 3.598 3.969 . 0 0 "[ . 1 . 2]" 1
289 1 40 MET HB3 1 74 TYR HE2 5.200 . 5.200 4.876 4.631 5.049 . 0 0 "[ . 1 . 2]" 1
290 1 40 MET ME 1 40 MET HG2 2.690 . 2.690 2.265 2.232 2.306 . 0 0 "[ . 1 . 2]" 1
291 1 40 MET ME 1 41 LEU H 4.670 . 4.670 3.367 3.244 3.474 . 0 0 "[ . 1 . 2]" 1
292 1 40 MET ME 1 41 LEU HB2 4.670 . 4.670 4.672 4.530 4.689 0.019 12 0 "[ . 1 . 2]" 1
293 1 40 MET ME 1 41 LEU QD 3.720 . 3.720 3.686 3.524 3.805 0.085 18 0 "[ . 1 . 2]" 1
294 1 40 MET ME 1 73 TYR HD2 5.010 . 5.010 4.702 4.507 4.846 . 0 0 "[ . 1 . 2]" 1
295 1 40 MET ME 1 73 TYR HE2 3.720 . 3.720 3.540 3.248 3.728 0.008 7 0 "[ . 1 . 2]" 1
296 1 40 MET HG2 1 41 LEU H 4.720 . 4.720 4.543 4.449 4.666 . 0 0 "[ . 1 . 2]" 1
297 1 40 MET HG2 1 74 TYR HD2 5.450 . 5.450 4.941 4.717 5.237 . 0 0 "[ . 1 . 2]" 1
298 1 40 MET HG2 1 74 TYR HE2 4.460 . 4.460 4.366 4.044 4.468 0.008 14 0 "[ . 1 . 2]" 1
299 1 41 LEU H 1 41 LEU HB2 3.140 . 3.140 2.136 2.093 2.233 . 0 0 "[ . 1 . 2]" 1
300 1 41 LEU H 1 41 LEU MD1 4.480 . 4.480 3.654 2.690 4.052 . 0 0 "[ . 1 . 2]" 1
301 1 41 LEU H 1 41 LEU QD 3.540 . 3.540 2.679 2.511 3.023 . 0 0 "[ . 1 . 2]" 1
302 1 41 LEU H 1 41 LEU MD2 4.480 . 4.480 3.176 2.542 4.446 . 0 0 "[ . 1 . 2]" 1
303 1 41 LEU H 1 41 LEU HG 4.430 . 4.430 4.010 3.448 4.283 . 0 0 "[ . 1 . 2]" 1
304 1 41 LEU H 1 42 GLY H 4.700 . 4.700 4.641 4.627 4.655 . 0 0 "[ . 1 . 2]" 1
305 1 41 LEU H 1 42 GLY HA2 5.500 . 5.500 5.500 5.433 5.520 0.020 12 0 "[ . 1 . 2]" 1
306 1 41 LEU H 1 73 TYR HA 5.140 . 5.140 4.496 4.447 4.581 . 0 0 "[ . 1 . 2]" 1
307 1 41 LEU H 1 74 TYR H 5.500 . 5.500 5.404 5.270 5.502 0.002 1 0 "[ . 1 . 2]" 1
308 1 41 LEU HA 1 41 LEU MD1 3.490 . 3.490 2.468 2.057 3.494 0.004 11 0 "[ . 1 . 2]" 1
309 1 41 LEU HA 1 41 LEU QD 2.950 . 2.950 2.237 1.979 2.849 . 0 0 "[ . 1 . 2]" 1
310 1 41 LEU HA 1 41 LEU MD2 3.490 . 3.490 2.754 2.557 3.090 . 0 0 "[ . 1 . 2]" 1
311 1 41 LEU HA 1 42 GLY H 3.480 . 3.480 2.288 2.210 2.360 . 0 0 "[ . 1 . 2]" 1
312 1 41 LEU HA 1 73 TYR HA 3.360 . 3.360 1.869 1.739 1.946 . 0 0 "[ . 1 . 2]" 1
313 1 41 LEU HA 1 73 TYR HD1 4.770 . 4.770 4.264 3.926 4.565 . 0 0 "[ . 1 . 2]" 1
314 1 41 LEU HA 1 73 TYR HD2 4.450 . 4.450 3.739 3.636 3.897 . 0 0 "[ . 1 . 2]" 1
315 1 41 LEU HA 1 74 TYR H 4.750 . 4.750 3.889 3.668 4.049 . 0 0 "[ . 1 . 2]" 1
316 1 41 LEU HB2 1 41 LEU MD1 3.220 . 3.220 2.915 2.141 3.253 0.033 18 0 "[ . 1 . 2]" 1
317 1 41 LEU HB2 1 41 LEU QD 2.640 . 2.640 2.202 2.098 2.265 . 0 0 "[ . 1 . 2]" 1
318 1 41 LEU HB2 1 41 LEU MD2 3.220 . 3.220 2.511 2.269 3.112 . 0 0 "[ . 1 . 2]" 1
319 1 41 LEU HB2 1 42 GLY H 4.850 . 4.850 4.006 3.890 4.068 . 0 0 "[ . 1 . 2]" 1
320 1 41 LEU HB2 1 73 TYR HA 5.120 . 5.120 4.803 4.625 4.898 . 0 0 "[ . 1 . 2]" 1
321 1 41 LEU HB3 1 41 LEU MD1 3.280 . 3.280 2.616 2.448 3.003 . 0 0 "[ . 1 . 2]" 1
322 1 41 LEU HB3 1 41 LEU QD 2.680 . 2.680 2.331 2.162 2.419 . 0 0 "[ . 1 . 2]" 1
323 1 41 LEU HB3 1 41 LEU MD2 3.280 . 3.280 2.891 2.218 3.182 . 0 0 "[ . 1 . 2]" 1
324 1 41 LEU HB3 1 42 GLY H 4.760 . 4.760 2.683 2.509 2.800 . 0 0 "[ . 1 . 2]" 1
325 1 41 LEU HB3 1 73 TYR HA 4.540 . 4.540 4.292 4.020 4.407 . 0 0 "[ . 1 . 2]" 1
326 1 41 LEU QD 1 42 GLY H 3.770 . 3.770 2.596 2.328 3.073 . 0 0 "[ . 1 . 2]" 1
327 1 41 LEU QD 1 42 GLY HA3 5.210 . 5.210 4.462 4.206 4.874 . 0 0 "[ . 1 . 2]" 1
328 1 41 LEU QD 1 71 GLN HB2 3.480 . 3.480 3.413 3.244 3.504 0.024 18 0 "[ . 1 . 2]" 1
329 1 41 LEU QD 1 71 GLN HB3 3.410 . 3.410 2.185 2.120 2.237 . 0 0 "[ . 1 . 2]" 1
330 1 41 LEU QD 1 71 GLN QE 3.590 . 3.590 2.409 2.131 2.799 . 0 0 "[ . 1 . 2]" 1
331 1 41 LEU QD 1 71 GLN HG2 3.840 . 3.840 3.512 3.065 3.942 0.102 10 0 "[ . 1 . 2]" 1
332 1 41 LEU QD 1 71 GLN HG3 3.890 . 3.890 3.751 3.205 4.012 0.122 12 0 "[ . 1 . 2]" 1
333 1 41 LEU QD 1 72 VAL H 4.150 . 4.150 3.113 2.990 3.224 . 0 0 "[ . 1 . 2]" 1
334 1 41 LEU QD 1 72 VAL HA 4.650 . 4.650 3.486 3.281 3.649 . 0 0 "[ . 1 . 2]" 1
335 1 41 LEU QD 1 73 TYR H 4.480 . 4.480 3.659 3.500 3.981 . 0 0 "[ . 1 . 2]" 1
336 1 41 LEU QD 1 73 TYR HA 3.540 . 3.540 2.826 2.558 3.395 . 0 0 "[ . 1 . 2]" 1
337 1 41 LEU QD 1 73 TYR HB2 5.440 . 5.440 4.301 4.116 4.724 . 0 0 "[ . 1 . 2]" 1
338 1 41 LEU QD 1 73 TYR HB3 5.440 . 5.440 4.308 4.103 4.721 . 0 0 "[ . 1 . 2]" 1
339 1 41 LEU QD 1 73 TYR HD1 3.380 . 3.380 2.871 2.624 3.180 . 0 0 "[ . 1 . 2]" 1
340 1 41 LEU QD 1 73 TYR HD2 5.440 . 5.440 3.661 3.410 4.014 . 0 0 "[ . 1 . 2]" 1
341 1 41 LEU QD 1 73 TYR HE1 3.040 . 3.040 2.674 2.578 2.771 . 0 0 "[ . 1 . 2]" 1
342 1 41 LEU QD 1 93 ILE MG 4.110 . 4.110 4.084 3.983 4.192 0.082 6 0 "[ . 1 . 2]" 1
343 1 41 LEU MD1 1 42 GLY H 4.900 . 4.900 3.141 2.340 4.691 . 0 0 "[ . 1 . 2]" 1
344 1 41 LEU MD1 1 71 GLN HB3 4.480 . 4.480 2.863 2.170 4.481 0.001 14 0 "[ . 1 . 2]" 1
345 1 41 LEU MD1 1 71 GLN HE21 4.710 . 4.710 3.269 2.488 4.570 . 0 0 "[ . 1 . 2]" 1
346 1 41 LEU MD1 1 71 GLN HE22 4.710 . 4.710 3.256 2.811 4.469 . 0 0 "[ . 1 . 2]" 1
347 1 41 LEU MD1 1 73 TYR H 5.310 . 5.310 4.175 3.549 5.406 0.096 8 0 "[ . 1 . 2]" 1
348 1 41 LEU MD1 1 73 TYR HA 4.460 . 4.460 3.165 2.597 4.375 . 0 0 "[ . 1 . 2]" 1
349 1 41 LEU MD1 1 73 TYR HE1 4.150 . 4.150 2.969 2.783 3.121 . 0 0 "[ . 1 . 2]" 1
350 1 41 LEU MD1 1 93 ILE MG 5.010 . 5.010 4.620 4.438 4.790 . 0 0 "[ . 1 . 2]" 1
351 1 41 LEU MD2 1 42 GLY H 4.900 . 4.900 3.884 2.663 4.425 . 0 0 "[ . 1 . 2]" 1
352 1 41 LEU MD2 1 71 GLN HB3 4.480 . 4.480 3.758 2.124 4.487 0.007 10 0 "[ . 1 . 2]" 1
353 1 41 LEU MD2 1 71 GLN HE21 4.710 . 4.710 4.039 2.286 4.796 0.086 18 0 "[ . 1 . 2]" 1
354 1 41 LEU MD2 1 71 GLN HE22 4.710 . 4.710 3.726 2.515 4.415 . 0 0 "[ . 1 . 2]" 1
355 1 41 LEU MD2 1 73 TYR H 5.310 . 5.310 4.905 3.679 5.366 0.056 12 0 "[ . 1 . 2]" 1
356 1 41 LEU MD2 1 73 TYR HA 4.460 . 4.460 3.751 3.230 3.971 . 0 0 "[ . 1 . 2]" 1
357 1 41 LEU MD2 1 73 TYR HE1 4.150 . 4.150 3.048 2.893 3.204 . 0 0 "[ . 1 . 2]" 1
358 1 41 LEU MD2 1 93 ILE MG 5.010 . 5.010 4.599 4.346 5.107 0.097 14 0 "[ . 1 . 2]" 1
359 1 41 LEU HG 1 42 GLY H 5.250 . 5.250 4.121 3.573 4.390 . 0 0 "[ . 1 . 2]" 1
360 1 41 LEU HG 1 71 GLN HE21 4.690 . 4.690 3.772 3.193 4.721 0.031 8 0 "[ . 1 . 2]" 1
361 1 41 LEU HG 1 71 GLN QE 4.050 . 4.050 3.003 2.345 4.126 0.076 2 0 "[ . 1 . 2]" 1
362 1 41 LEU HG 1 71 GLN HE22 4.690 . 4.690 3.216 2.383 4.607 . 0 0 "[ . 1 . 2]" 1
363 1 42 GLY H 1 43 SER H 3.930 . 3.930 3.346 3.149 3.829 . 0 0 "[ . 1 . 2]" 1
364 1 42 GLY H 1 71 GLN QE 4.760 . 4.760 3.071 2.352 3.365 . 0 0 "[ . 1 . 2]" 1
365 1 42 GLY H 1 72 VAL H 4.670 . 4.670 3.739 3.560 3.899 . 0 0 "[ . 1 . 2]" 1
366 1 42 GLY H 1 73 TYR HA 5.010 . 5.010 2.684 2.303 3.019 . 0 0 "[ . 1 . 2]" 1
367 1 42 GLY HA3 1 43 SER H 2.900 . 2.900 2.221 2.171 2.326 . 0 0 "[ . 1 . 2]" 1
368 1 42 GLY HA3 1 71 GLN QE 4.430 . 4.430 4.259 3.374 4.481 0.051 12 0 "[ . 1 . 2]" 1
369 1 42 GLY HA3 1 72 VAL QG 4.810 . 4.810 3.525 3.298 3.712 . 0 0 "[ . 1 . 2]" 1
370 1 43 SER H 1 43 SER HB2 3.330 . 3.330 2.869 2.757 2.975 . 0 0 "[ . 1 . 2]" 1
371 1 43 SER H 1 44 ALA H 4.510 . 4.510 4.434 4.407 4.465 . 0 0 "[ . 1 . 2]" 1
372 1 43 SER H 1 44 ALA MB 5.500 . 5.500 5.465 5.380 5.555 0.055 6 0 "[ . 1 . 2]" 1
373 1 43 SER H 1 45 MET ME 5.110 . 5.110 3.623 3.358 4.085 . 0 0 "[ . 1 . 2]" 1
374 1 43 SER H 1 71 GLN QE 4.560 . 4.560 3.633 3.276 3.980 . 0 0 "[ . 1 . 2]" 1
375 1 43 SER H 1 71 GLN HG2 5.500 . 5.500 4.247 3.923 4.875 . 0 0 "[ . 1 . 2]" 1
376 1 43 SER H 1 71 GLN HG3 5.500 . 5.500 5.513 5.500 5.533 0.033 18 0 "[ . 1 . 2]" 1
377 1 43 SER H 1 72 VAL QG 4.940 . 4.940 3.327 2.765 4.069 . 0 0 "[ . 1 . 2]" 1
378 1 43 SER H 1 128 GLN QE 4.220 . 4.220 3.722 2.425 4.227 0.007 20 0 "[ . 1 . 2]" 1
379 1 43 SER H 1 128 GLN QG 5.340 . 5.340 4.186 3.815 4.587 . 0 0 "[ . 1 . 2]" 1
380 1 43 SER HA 1 43 SER HB3 2.410 . 2.410 2.364 2.305 2.412 0.002 17 0 "[ . 1 . 2]" 1
381 1 43 SER HA 1 44 ALA H 2.700 . 2.700 2.255 2.197 2.301 . 0 0 "[ . 1 . 2]" 1
382 1 43 SER HA 1 44 ALA MB 3.970 . 3.970 3.994 3.974 4.020 0.050 12 0 "[ . 1 . 2]" 1
383 1 43 SER HA 1 71 GLN HE21 4.420 . 4.420 3.827 3.269 4.416 . 0 0 "[ . 1 . 2]" 1
384 1 43 SER HA 1 71 GLN QE 3.850 . 3.850 3.359 3.187 3.595 . 0 0 "[ . 1 . 2]" 1
385 1 43 SER HA 1 71 GLN HE22 4.420 . 4.420 4.018 3.441 4.429 0.009 18 0 "[ . 1 . 2]" 1
386 1 43 SER HB2 1 44 ALA H 3.620 . 3.620 3.586 3.442 3.626 0.006 17 0 "[ . 1 . 2]" 1
387 1 43 SER HB2 1 45 MET H 5.500 . 5.500 5.511 5.503 5.523 0.023 14 0 "[ . 1 . 2]" 1
388 1 43 SER HB2 1 45 MET ME 4.320 . 4.320 3.266 2.543 4.107 . 0 0 "[ . 1 . 2]" 1
389 1 43 SER HB2 1 128 GLN QE 5.110 . 5.110 3.287 2.340 5.126 0.016 17 0 "[ . 1 . 2]" 1
390 1 43 SER HB3 1 44 ALA H 4.650 . 4.650 2.779 2.618 3.094 . 0 0 "[ . 1 . 2]" 1
391 1 43 SER HB3 1 44 ALA MB 4.850 . 4.850 4.412 4.293 4.593 . 0 0 "[ . 1 . 2]" 1
392 1 44 ALA H 1 44 ALA MB 2.790 . 2.790 2.247 2.199 2.315 . 0 0 "[ . 1 . 2]" 1
393 1 44 ALA H 1 71 GLN HE21 4.920 . 4.920 4.201 3.909 4.744 . 0 0 "[ . 1 . 2]" 1
394 1 44 ALA H 1 71 GLN HE22 4.920 . 4.920 4.767 4.425 4.927 0.007 2 0 "[ . 1 . 2]" 1
395 1 44 ALA H 1 71 GLN HG2 4.590 . 4.590 4.089 3.928 4.229 . 0 0 "[ . 1 . 2]" 1
396 1 44 ALA H 1 71 GLN HG3 5.120 . 5.120 4.299 4.104 4.446 . 0 0 "[ . 1 . 2]" 1
397 1 44 ALA HA 1 45 MET H 2.960 . 2.960 2.181 2.103 2.269 . 0 0 "[ . 1 . 2]" 1
398 1 44 ALA HA 1 45 MET HG2 4.890 . 4.890 4.812 4.650 4.892 0.002 6 0 "[ . 1 . 2]" 1
399 1 44 ALA HA 1 70 ASN QD 4.110 . 4.110 3.619 3.183 4.110 . 0 0 "[ . 1 . 2]" 1
400 1 44 ALA HA 1 71 GLN QE 4.470 . 4.470 3.935 3.693 4.316 . 0 0 "[ . 1 . 2]" 1
401 1 44 ALA HA 1 71 GLN HG2 3.030 . 3.030 2.210 1.929 2.492 . 0 0 "[ . 1 . 2]" 1
402 1 44 ALA HA 1 71 GLN HG3 2.930 . 2.930 2.509 2.112 2.928 . 0 0 "[ . 1 . 2]" 1
403 1 44 ALA MB 1 45 MET H 3.230 . 3.230 2.912 2.761 3.023 . 0 0 "[ . 1 . 2]" 1
404 1 44 ALA MB 1 45 MET HA 4.180 . 4.180 3.937 3.880 3.988 . 0 0 "[ . 1 . 2]" 1
405 1 44 ALA MB 1 46 SER H 5.500 . 5.500 5.524 5.505 5.557 0.057 18 0 "[ . 1 . 2]" 1
406 1 44 ALA MB 1 70 ASN HB2 5.370 . 5.370 4.707 4.337 5.061 . 0 0 "[ . 1 . 2]" 1
407 1 44 ALA MB 1 70 ASN HD21 3.990 . 3.990 2.979 2.501 3.399 . 0 0 "[ . 1 . 2]" 1
408 1 44 ALA MB 1 70 ASN HD22 3.990 . 3.990 3.199 2.719 3.547 . 0 0 "[ . 1 . 2]" 1
409 1 44 ALA MB 1 71 GLN HG2 3.370 . 3.370 3.341 3.246 3.387 0.017 2 0 "[ . 1 . 2]" 1
410 1 44 ALA MB 1 71 GLN HG3 3.130 . 3.130 2.751 2.407 3.057 . 0 0 "[ . 1 . 2]" 1
411 1 45 MET H 1 45 MET HB3 3.500 . 3.500 3.354 3.200 3.499 . 0 0 "[ . 1 . 2]" 1
412 1 45 MET H 1 45 MET HG2 3.430 . 3.430 2.902 2.748 3.002 . 0 0 "[ . 1 . 2]" 1
413 1 45 MET H 1 46 SER H 4.700 . 4.700 4.397 4.351 4.452 . 0 0 "[ . 1 . 2]" 1
414 1 45 MET H 1 70 ASN HD21 5.050 . 5.050 3.338 2.759 4.011 . 0 0 "[ . 1 . 2]" 1
415 1 45 MET H 1 70 ASN QD 4.310 . 4.310 3.262 2.724 3.864 . 0 0 "[ . 1 . 2]" 1
416 1 45 MET H 1 70 ASN HD22 5.050 . 5.050 4.652 4.217 5.052 0.002 14 0 "[ . 1 . 2]" 1
417 1 45 MET HA 1 45 MET HB2 3.020 . 3.020 2.445 2.414 2.475 . 0 0 "[ . 1 . 2]" 1
418 1 45 MET HA 1 45 MET HB3 2.990 . 2.990 2.465 2.440 2.494 . 0 0 "[ . 1 . 2]" 1
419 1 45 MET HA 1 45 MET HG2 3.810 . 3.810 3.705 3.680 3.735 . 0 0 "[ . 1 . 2]" 1
420 1 45 MET HA 1 46 SER H 3.020 . 3.020 2.406 2.372 2.463 . 0 0 "[ . 1 . 2]" 1
421 1 45 MET HB2 1 45 MET HG2 2.680 . 2.680 2.602 2.557 2.639 . 0 0 "[ . 1 . 2]" 1
422 1 45 MET HB2 1 45 MET HG3 2.870 . 2.870 2.313 2.291 2.344 . 0 0 "[ . 1 . 2]" 1
423 1 45 MET HB2 1 46 SER H 3.120 . 3.120 2.508 2.434 2.566 . 0 0 "[ . 1 . 2]" 1
424 1 45 MET HB3 1 45 MET ME 2.850 . 2.850 2.379 2.295 2.486 . 0 0 "[ . 1 . 2]" 1
425 1 45 MET ME 1 45 MET HG2 3.720 . 3.720 3.432 3.404 3.464 . 0 0 "[ . 1 . 2]" 1
426 1 45 MET ME 1 45 MET HG3 2.490 . 2.490 2.430 2.344 2.483 . 0 0 "[ . 1 . 2]" 1
427 1 45 MET ME 1 72 VAL H 4.210 . 4.210 3.798 3.511 3.914 . 0 0 "[ . 1 . 2]" 1
428 1 45 MET ME 1 72 VAL HA 5.500 . 5.500 5.519 5.500 5.569 0.069 18 0 "[ . 1 . 2]" 1
429 1 45 MET ME 1 72 VAL QG 2.760 . 2.760 2.152 2.087 2.246 . 0 0 "[ . 1 . 2]" 1
430 1 45 MET ME 1 124 MET HA 3.400 . 3.400 3.011 2.783 3.166 . 0 0 "[ . 1 . 2]" 1
431 1 45 MET ME 1 125 CYS H 4.690 . 4.690 4.723 4.700 4.751 0.061 14 0 "[ . 1 . 2]" 1
432 1 45 MET ME 1 127 THR H 4.710 . 4.710 4.672 4.570 4.717 0.007 11 0 "[ . 1 . 2]" 1
433 1 45 MET ME 1 127 THR HB 4.020 . 4.020 3.346 3.090 3.552 . 0 0 "[ . 1 . 2]" 1
434 1 45 MET ME 1 127 THR MG 2.400 . 2.400 2.482 2.420 2.587 0.187 18 0 "[ . 1 . 2]" 1
435 1 45 MET ME 1 128 GLN QE 4.640 . 4.640 2.441 1.702 3.974 . 0 0 "[ . 1 . 2]" 1
436 1 45 MET HG2 1 46 SER H 4.140 . 4.140 3.787 3.594 3.887 . 0 0 "[ . 1 . 2]" 1
437 1 45 MET HG2 1 124 MET HB3 3.980 . 3.980 3.495 3.258 3.853 . 0 0 "[ . 1 . 2]" 1
438 1 45 MET HG2 1 124 MET HG2 4.210 . 4.210 3.235 3.007 3.629 . 0 0 "[ . 1 . 2]" 1
439 1 45 MET HG3 1 124 MET HB3 3.210 . 3.210 2.766 2.511 3.103 . 0 0 "[ . 1 . 2]" 1
440 1 46 SER H 1 46 SER QB 2.960 . 2.960 2.529 2.279 2.746 . 0 0 "[ . 1 . 2]" 1
441 1 46 SER H 1 47 ARG H 4.670 . 4.670 4.639 4.575 4.672 0.002 17 0 "[ . 1 . 2]" 1
442 1 46 SER HA 1 46 SER QB 2.420 . 2.420 2.307 2.196 2.394 . 0 0 "[ . 1 . 2]" 1
443 1 46 SER HA 1 47 ARG H 2.980 . 2.980 2.270 2.208 2.330 . 0 0 "[ . 1 . 2]" 1
444 1 46 SER HA 1 70 ASN HB2 4.510 . 4.510 4.128 3.676 4.455 . 0 0 "[ . 1 . 2]" 1
445 1 46 SER QB 1 47 ARG H 3.830 . 3.830 3.046 2.758 3.655 . 0 0 "[ . 1 . 2]" 1
446 1 47 ARG H 1 47 ARG QD 3.980 . 3.980 3.453 1.730 4.059 0.079 14 0 "[ . 1 . 2]" 1
447 1 47 ARG HA 1 47 ARG QD 4.030 . 4.030 3.879 2.941 4.086 0.056 6 0 "[ . 1 . 2]" 1
448 1 47 ARG HA 1 48 PRO HD2 3.650 . 3.650 2.349 2.229 2.472 . 0 0 "[ . 1 . 2]" 1
449 1 47 ARG HA 1 70 ASN HB2 4.550 . 4.550 4.452 4.117 4.554 0.004 5 0 "[ . 1 . 2]" 1
450 1 47 ARG HA 1 70 ASN HB3 5.500 . 5.500 4.986 4.782 5.287 . 0 0 "[ . 1 . 2]" 1
451 1 47 ARG HA 1 124 MET HG2 4.730 . 4.730 3.899 3.425 4.266 . 0 0 "[ . 1 . 2]" 1
452 1 47 ARG QD 1 47 ARG QG 2.320 . 2.320 2.063 2.007 2.107 . 0 0 "[ . 1 . 2]" 1
453 1 47 ARG QD 1 70 ASN HB2 4.730 . 4.730 3.894 2.708 4.739 0.009 12 0 "[ . 1 . 2]" 1
454 1 47 ARG QD 1 70 ASN HB3 5.000 . 5.000 3.006 2.188 3.894 . 0 0 "[ . 1 . 2]" 1
455 1 47 ARG QG 1 70 ASN HA 5.340 . 5.340 3.251 2.272 4.957 . 0 0 "[ . 1 . 2]" 1
456 1 48 PRO HA 1 49 ILE H 2.810 . 2.810 2.550 2.490 2.597 . 0 0 "[ . 1 . 2]" 1
457 1 48 PRO HA 1 49 ILE MD 4.880 . 4.880 4.599 4.063 4.685 . 0 0 "[ . 1 . 2]" 1
458 1 48 PRO HA 1 49 ILE QG 4.300 . 4.300 3.452 3.355 3.782 . 0 0 "[ . 1 . 2]" 1
459 1 48 PRO HA 1 49 ILE MG 5.500 . 5.500 5.549 5.521 5.578 0.078 10 0 "[ . 1 . 2]" 1
460 1 48 PRO HB2 1 49 ILE H 4.080 . 4.080 2.321 2.162 2.434 . 0 0 "[ . 1 . 2]" 1
461 1 48 PRO HB3 1 50 ILE MD 4.310 . 4.310 4.317 4.198 4.400 0.090 10 0 "[ . 1 . 2]" 1
462 1 48 PRO HB3 1 123 GLN HB3 3.990 . 3.990 3.133 2.888 3.421 . 0 0 "[ . 1 . 2]" 1
463 1 48 PRO HB3 1 123 GLN HG2 3.750 . 3.750 3.263 3.114 3.513 . 0 0 "[ . 1 . 2]" 1
464 1 48 PRO HD2 1 49 ILE H 5.500 . 5.500 5.437 5.396 5.498 . 0 0 "[ . 1 . 2]" 1
465 1 48 PRO HD2 1 120 VAL MG1 4.630 . 4.630 3.794 3.669 3.951 . 0 0 "[ . 1 . 2]" 1
466 1 48 PRO HD2 1 120 VAL MG2 4.490 . 4.490 3.906 3.748 4.068 . 0 0 "[ . 1 . 2]" 1
467 1 48 PRO HD2 1 123 GLN HB3 4.660 . 4.660 4.634 4.470 4.677 0.017 12 0 "[ . 1 . 2]" 1
468 1 48 PRO HD2 1 124 MET HG2 5.370 . 5.370 3.875 3.570 4.158 . 0 0 "[ . 1 . 2]" 1
469 1 48 PRO HD3 1 123 GLN HB3 4.950 . 4.950 3.762 3.634 3.859 . 0 0 "[ . 1 . 2]" 1
470 1 48 PRO HD3 1 124 MET HG2 5.500 . 5.500 2.491 2.323 2.743 . 0 0 "[ . 1 . 2]" 1
471 1 48 PRO HG2 1 50 ILE H 5.370 . 5.370 5.043 4.888 5.223 . 0 0 "[ . 1 . 2]" 1
472 1 48 PRO HG2 1 50 ILE HB 5.500 . 5.500 5.306 5.231 5.399 . 0 0 "[ . 1 . 2]" 1
473 1 48 PRO HG2 1 50 ILE MD 3.620 . 3.620 2.390 2.319 2.484 . 0 0 "[ . 1 . 2]" 1
474 1 48 PRO HG2 1 120 VAL MG1 3.930 . 3.930 3.269 3.091 3.472 . 0 0 "[ . 1 . 2]" 1
475 1 48 PRO HG2 1 124 MET H 5.080 . 5.080 5.091 5.083 5.101 0.021 14 0 "[ . 1 . 2]" 1
476 1 48 PRO HG3 1 124 MET H 4.960 . 4.960 3.628 3.526 3.772 . 0 0 "[ . 1 . 2]" 1
477 1 49 ILE H 1 49 ILE HB 3.070 . 3.070 2.666 2.620 2.707 . 0 0 "[ . 1 . 2]" 1
478 1 49 ILE H 1 49 ILE MD 3.890 . 3.890 3.896 3.565 3.938 0.048 12 0 "[ . 1 . 2]" 1
479 1 49 ILE H 1 49 ILE QG 3.470 . 3.470 2.897 2.849 2.965 . 0 0 "[ . 1 . 2]" 1
480 1 49 ILE H 1 49 ILE MG 3.900 . 3.900 3.877 3.850 3.900 0.000 5 0 "[ . 1 . 2]" 1
481 1 49 ILE H 1 50 ILE H 4.480 . 4.480 4.292 4.258 4.360 . 0 0 "[ . 1 . 2]" 1
482 1 49 ILE H 1 50 ILE HA 5.500 . 5.500 4.803 4.701 4.872 . 0 0 "[ . 1 . 2]" 1
483 1 49 ILE H 1 61 TYR HE1 5.170 . 5.170 4.934 4.848 5.007 . 0 0 "[ . 1 . 2]" 1
484 1 49 ILE HA 1 49 ILE HG12 3.440 . 3.440 2.708 2.651 3.115 . 0 0 "[ . 1 . 2]" 1
485 1 49 ILE HA 1 49 ILE QG 3.000 . 3.000 2.497 2.443 2.917 . 0 0 "[ . 1 . 2]" 1
486 1 49 ILE HA 1 49 ILE HG13 3.440 . 3.440 2.929 2.853 3.519 0.079 10 0 "[ . 1 . 2]" 1
487 1 49 ILE HA 1 49 ILE MG 2.690 . 2.690 2.407 2.361 2.434 . 0 0 "[ . 1 . 2]" 1
488 1 49 ILE HA 1 50 ILE H 3.110 . 3.110 2.183 2.157 2.228 . 0 0 "[ . 1 . 2]" 1
489 1 49 ILE HA 1 50 ILE HB 4.590 . 4.590 4.571 4.499 4.592 0.002 11 0 "[ . 1 . 2]" 1
490 1 49 ILE HA 1 50 ILE MD 3.980 . 3.980 3.634 3.571 3.755 . 0 0 "[ . 1 . 2]" 1
491 1 49 ILE HA 1 61 TYR HD1 4.250 . 4.250 4.170 4.104 4.235 . 0 0 "[ . 1 . 2]" 1
492 1 49 ILE HA 1 61 TYR HE1 3.030 . 3.030 2.024 1.962 2.106 . 0 0 "[ . 1 . 2]" 1
493 1 49 ILE HA 1 65 MET ME 3.980 . 3.980 3.471 3.104 3.852 . 0 0 "[ . 1 . 2]" 1
494 1 49 ILE HB 1 49 ILE MD 3.030 . 3.030 2.383 2.335 3.175 0.145 10 0 "[ . 1 . 2]" 1
495 1 49 ILE HB 1 50 ILE H 4.490 . 4.490 4.284 4.227 4.328 . 0 0 "[ . 1 . 2]" 1
496 1 49 ILE HB 1 61 TYR HE1 5.300 . 5.300 4.563 4.385 4.636 . 0 0 "[ . 1 . 2]" 1
497 1 49 ILE MD 1 49 ILE MG 2.550 . 2.550 2.145 2.135 2.202 . 0 0 "[ . 1 . 2]" 1
498 1 49 ILE MD 1 62 ARG QD 4.400 . 4.400 2.495 1.933 3.192 . 0 0 "[ . 1 . 2]" 1
499 1 49 ILE MD 1 62 ARG QG 4.410 . 4.410 3.710 2.041 3.948 . 0 0 "[ . 1 . 2]" 1
500 1 49 ILE QG 1 49 ILE MG 2.540 . 2.540 2.248 2.143 2.268 . 0 0 "[ . 1 . 2]" 1
501 1 49 ILE QG 1 50 ILE H 4.720 . 4.720 4.253 4.171 4.650 . 0 0 "[ . 1 . 2]" 1
502 1 49 ILE QG 1 61 TYR HD1 5.340 . 5.340 4.346 4.176 4.818 . 0 0 "[ . 1 . 2]" 1
503 1 49 ILE QG 1 62 ARG QD 3.500 . 3.500 2.672 2.544 2.870 . 0 0 "[ . 1 . 2]" 1
504 1 49 ILE QG 1 62 ARG QG 3.190 . 3.190 3.071 2.930 3.384 0.194 10 0 "[ . 1 . 2]" 1
505 1 49 ILE HG12 1 49 ILE MG 3.220 . 3.220 2.345 2.281 3.172 . 0 0 "[ . 1 . 2]" 1
506 1 49 ILE HG12 1 61 TYR HE1 3.970 . 3.970 2.893 2.687 4.031 0.061 10 0 "[ . 1 . 2]" 1
507 1 49 ILE HG13 1 49 ILE MG 3.220 . 3.220 3.163 2.178 3.220 . 18 0 "[ . 1 . 2]" 1
508 1 49 ILE HG13 1 61 TYR HE1 3.970 . 3.970 3.923 3.784 3.972 0.002 14 0 "[ . 1 . 2]" 1
509 1 49 ILE MG 1 50 ILE H 3.200 . 3.200 2.794 2.664 2.846 . 0 0 "[ . 1 . 2]" 1
510 1 49 ILE MG 1 50 ILE HA 4.100 . 4.100 3.708 3.628 3.790 . 0 0 "[ . 1 . 2]" 1
511 1 49 ILE MG 1 51 HIS HA 4.830 . 4.830 4.461 4.226 4.603 . 0 0 "[ . 1 . 2]" 1
512 1 49 ILE MG 1 61 TYR HD1 3.800 . 3.800 3.066 2.958 3.191 . 0 0 "[ . 1 . 2]" 1
513 1 49 ILE MG 1 61 TYR HE1 3.130 . 3.130 2.494 2.406 2.661 . 0 0 "[ . 1 . 2]" 1
514 1 49 ILE MG 1 62 ARG QG 3.980 . 3.980 2.715 2.568 3.170 . 0 0 "[ . 1 . 2]" 1
515 1 50 ILE H 1 50 ILE HB 3.300 . 3.300 2.607 2.530 2.645 . 0 0 "[ . 1 . 2]" 1
516 1 50 ILE H 1 50 ILE MD 4.370 . 4.370 2.964 2.881 3.043 . 0 0 "[ . 1 . 2]" 1
517 1 50 ILE H 1 50 ILE MG 4.240 . 4.240 3.852 3.814 3.870 . 0 0 "[ . 1 . 2]" 1
518 1 50 ILE H 1 51 HIS H 4.570 . 4.570 4.368 4.324 4.421 . 0 0 "[ . 1 . 2]" 1
519 1 50 ILE H 1 61 TYR HB3 5.500 . 5.500 5.108 4.975 5.328 . 0 0 "[ . 1 . 2]" 1
520 1 50 ILE H 1 61 TYR HD1 5.380 . 5.380 3.999 3.885 4.200 . 0 0 "[ . 1 . 2]" 1
521 1 50 ILE H 1 61 TYR HD2 5.050 . 5.050 4.428 4.324 4.558 . 0 0 "[ . 1 . 2]" 1
522 1 50 ILE H 1 61 TYR HE1 4.240 . 4.240 2.873 2.756 3.009 . 0 0 "[ . 1 . 2]" 1
523 1 50 ILE H 1 61 TYR HE2 4.000 . 4.000 3.386 3.320 3.478 . 0 0 "[ . 1 . 2]" 1
524 1 50 ILE H 1 120 VAL MG1 3.940 . 3.940 3.989 3.957 4.024 0.084 8 0 "[ . 1 . 2]" 1
525 1 50 ILE HA 1 50 ILE MD 3.600 . 3.600 3.627 3.613 3.646 0.046 14 0 "[ . 1 . 2]" 1
526 1 50 ILE HA 1 50 ILE HG12 3.480 . 3.480 3.201 3.134 3.249 . 0 0 "[ . 1 . 2]" 1
527 1 50 ILE HA 1 50 ILE HG13 2.900 . 2.900 2.299 2.259 2.338 . 0 0 "[ . 1 . 2]" 1
528 1 50 ILE HA 1 50 ILE MG 2.770 . 2.770 2.452 2.423 2.499 . 0 0 "[ . 1 . 2]" 1
529 1 50 ILE HA 1 51 HIS H 2.530 . 2.530 2.181 2.100 2.222 . 0 0 "[ . 1 . 2]" 1
530 1 50 ILE HA 1 51 HIS QB 4.630 . 4.630 4.502 3.978 4.655 0.025 5 0 "[ . 1 . 2]" 1
531 1 50 ILE HA 1 123 GLN HE22 4.420 . 4.420 4.431 4.422 4.444 0.024 12 0 "[ . 1 . 2]" 1
532 1 50 ILE HB 1 50 ILE MD 2.740 . 2.740 2.213 2.194 2.236 . 0 0 "[ . 1 . 2]" 1
533 1 50 ILE HB 1 51 HIS H 4.440 . 4.440 4.221 4.169 4.281 . 0 0 "[ . 1 . 2]" 1
534 1 50 ILE HB 1 51 HIS HA 5.210 . 5.210 4.946 4.812 5.191 . 0 0 "[ . 1 . 2]" 1
535 1 50 ILE HB 1 52 PHE HD1 5.440 . 5.440 5.342 5.184 5.441 0.001 4 0 "[ . 1 . 2]" 1
536 1 50 ILE HB 1 52 PHE HE1 3.680 . 3.680 3.619 3.410 3.683 0.003 19 0 "[ . 1 . 2]" 1
537 1 50 ILE HB 1 52 PHE HZ 4.100 . 4.100 3.316 3.175 3.476 . 0 0 "[ . 1 . 2]" 1
538 1 50 ILE HB 1 61 TYR HD2 4.840 . 4.840 3.899 3.788 4.067 . 0 0 "[ . 1 . 2]" 1
539 1 50 ILE HB 1 61 TYR HE2 4.100 . 4.100 2.651 2.555 2.728 . 0 0 "[ . 1 . 2]" 1
540 1 50 ILE HB 1 119 ARG HG3 4.710 . 4.710 4.248 4.195 4.309 . 0 0 "[ . 1 . 2]" 1
541 1 50 ILE MD 1 50 ILE MG 3.000 . 3.000 2.846 2.772 2.897 . 0 0 "[ . 1 . 2]" 1
542 1 50 ILE MD 1 61 TYR HD2 4.800 . 4.800 4.626 4.509 4.799 . 0 0 "[ . 1 . 2]" 1
543 1 50 ILE MD 1 119 ARG H 4.400 . 4.400 4.467 4.429 4.495 0.095 2 0 "[ . 1 . 2]" 1
544 1 50 ILE MD 1 119 ARG HA 4.220 . 4.220 3.909 3.861 3.978 . 0 0 "[ . 1 . 2]" 1
545 1 50 ILE MD 1 119 ARG HB2 4.120 . 4.120 3.609 3.563 3.640 . 0 0 "[ . 1 . 2]" 1
546 1 50 ILE MD 1 119 ARG HB3 2.910 . 2.910 2.001 1.957 2.027 . 0 0 "[ . 1 . 2]" 1
547 1 50 ILE MD 1 119 ARG HD2 4.100 . 4.100 2.469 2.403 2.584 . 0 0 "[ . 1 . 2]" 1
548 1 50 ILE MD 1 119 ARG HD3 4.130 . 4.130 3.436 3.324 3.537 . 0 0 "[ . 1 . 2]" 1
549 1 50 ILE MD 1 119 ARG HG2 4.460 . 4.460 4.370 4.347 4.409 . 0 0 "[ . 1 . 2]" 1
550 1 50 ILE MD 1 119 ARG HG3 3.550 . 3.550 3.560 3.525 3.590 0.040 12 0 "[ . 1 . 2]" 1
551 1 50 ILE MD 1 120 VAL H 3.630 . 3.630 3.105 2.974 3.167 . 0 0 "[ . 1 . 2]" 1
552 1 50 ILE MD 1 120 VAL HA 3.340 . 3.340 2.143 2.072 2.218 . 0 0 "[ . 1 . 2]" 1
553 1 50 ILE MD 1 120 VAL MG1 2.780 . 2.780 2.137 2.071 2.228 . 0 0 "[ . 1 . 2]" 1
554 1 50 ILE MD 1 123 GLN HB2 3.160 . 3.160 2.871 2.752 2.960 . 0 0 "[ . 1 . 2]" 1
555 1 50 ILE MD 1 123 GLN HB3 4.060 . 4.060 4.056 3.943 4.092 0.032 15 0 "[ . 1 . 2]" 1
556 1 50 ILE MD 1 123 GLN HE21 4.850 . 4.850 2.689 2.194 2.824 . 0 0 "[ . 1 . 2]" 1
557 1 50 ILE MD 1 123 GLN HE22 3.150 . 3.150 3.054 2.856 3.159 0.009 3 0 "[ . 1 . 2]" 1
558 1 50 ILE MD 1 123 GLN HG2 4.170 . 4.170 3.827 3.733 4.028 . 0 0 "[ . 1 . 2]" 1
559 1 50 ILE HG12 1 50 ILE MG 2.840 . 2.840 2.092 2.073 2.104 . 0 0 "[ . 1 . 2]" 1
560 1 50 ILE HG12 1 51 HIS H 4.850 . 4.850 4.753 4.586 4.852 0.002 14 0 "[ . 1 . 2]" 1
561 1 50 ILE HG12 1 61 TYR HE2 5.480 . 5.480 4.956 4.875 5.083 . 0 0 "[ . 1 . 2]" 1
562 1 50 ILE HG12 1 119 ARG HA 5.120 . 5.120 5.094 5.023 5.128 0.008 14 0 "[ . 1 . 2]" 1
563 1 50 ILE HG12 1 119 ARG HB3 4.150 . 4.150 3.358 3.204 3.495 . 0 0 "[ . 1 . 2]" 1
564 1 50 ILE HG12 1 119 ARG HG3 4.310 . 4.310 3.385 3.219 3.606 . 0 0 "[ . 1 . 2]" 1
565 1 50 ILE HG12 1 120 VAL MG1 4.690 . 4.690 4.630 4.544 4.698 0.008 19 0 "[ . 1 . 2]" 1
566 1 50 ILE HG12 1 123 GLN HE22 3.990 . 3.990 2.187 2.104 2.279 . 0 0 "[ . 1 . 2]" 1
567 1 50 ILE HG13 1 50 ILE MG 3.170 . 3.170 2.896 2.872 2.932 . 0 0 "[ . 1 . 2]" 1
568 1 50 ILE HG13 1 51 HIS H 4.790 . 4.790 4.373 4.293 4.466 . 0 0 "[ . 1 . 2]" 1
569 1 50 ILE HG13 1 123 GLN HE21 3.880 . 3.880 2.391 2.279 2.504 . 0 0 "[ . 1 . 2]" 1
570 1 50 ILE HG13 1 123 GLN HE22 3.680 . 3.680 2.849 2.677 2.991 . 0 0 "[ . 1 . 2]" 1
571 1 50 ILE MG 1 51 HIS H 3.290 . 3.290 2.634 2.541 2.741 . 0 0 "[ . 1 . 2]" 1
572 1 50 ILE MG 1 51 HIS HA 3.920 . 3.920 3.689 3.573 3.883 . 0 0 "[ . 1 . 2]" 1
573 1 50 ILE MG 1 51 HIS HB2 5.200 . 5.200 4.916 4.330 5.151 . 0 0 "[ . 1 . 2]" 1
574 1 50 ILE MG 1 51 HIS QB 4.330 . 4.330 4.343 3.960 4.471 0.141 18 0 "[ . 1 . 2]" 1
575 1 50 ILE MG 1 51 HIS HB3 5.200 . 5.200 4.896 4.188 5.209 0.009 5 0 "[ . 1 . 2]" 1
576 1 50 ILE MG 1 52 PHE HA 4.180 . 4.180 3.913 3.814 4.106 . 0 0 "[ . 1 . 2]" 1
577 1 50 ILE MG 1 52 PHE HD1 3.400 . 3.400 3.023 2.909 3.113 . 0 0 "[ . 1 . 2]" 1
578 1 50 ILE MG 1 52 PHE HE1 3.060 . 3.060 2.095 2.035 2.132 . 0 0 "[ . 1 . 2]" 1
579 1 50 ILE MG 1 52 PHE HZ 3.480 . 3.480 3.234 3.123 3.372 . 0 0 "[ . 1 . 2]" 1
580 1 50 ILE MG 1 61 TYR HD2 4.860 . 4.860 4.603 4.528 4.705 . 0 0 "[ . 1 . 2]" 1
581 1 50 ILE MG 1 116 MET HA 4.780 . 4.780 4.458 4.316 4.595 . 0 0 "[ . 1 . 2]" 1
582 1 50 ILE MG 1 116 MET HB2 4.910 . 4.910 4.712 4.598 4.797 . 0 0 "[ . 1 . 2]" 1
583 1 50 ILE MG 1 116 MET ME 5.500 . 5.500 5.617 5.532 5.695 0.195 6 0 "[ . 1 . 2]" 1
584 1 50 ILE MG 1 119 ARG HA 5.290 . 5.290 4.994 4.900 5.075 . 0 0 "[ . 1 . 2]" 1
585 1 50 ILE MG 1 119 ARG HB2 3.930 . 3.930 3.761 3.635 3.858 . 0 0 "[ . 1 . 2]" 1
586 1 50 ILE MG 1 119 ARG HB3 3.220 . 3.220 2.951 2.833 3.027 . 0 0 "[ . 1 . 2]" 1
587 1 50 ILE MG 1 119 ARG HD2 3.770 . 3.770 2.861 2.649 2.997 . 0 0 "[ . 1 . 2]" 1
588 1 50 ILE MG 1 119 ARG HD3 4.480 . 4.480 4.178 4.016 4.285 . 0 0 "[ . 1 . 2]" 1
589 1 50 ILE MG 1 119 ARG HG2 3.770 . 3.770 3.802 3.777 3.842 0.072 18 0 "[ . 1 . 2]" 1
590 1 50 ILE MG 1 119 ARG HG3 3.420 . 3.420 2.196 2.168 2.228 . 0 0 "[ . 1 . 2]" 1
591 1 50 ILE MG 1 120 VAL H 5.430 . 5.430 5.366 5.167 5.439 0.009 13 0 "[ . 1 . 2]" 1
592 1 50 ILE MG 1 120 VAL HA 5.460 . 5.460 5.378 5.242 5.468 0.008 13 0 "[ . 1 . 2]" 1
593 1 50 ILE MG 1 120 VAL MG1 4.520 . 4.520 4.525 4.437 4.570 0.050 12 0 "[ . 1 . 2]" 1
594 1 51 HIS H 1 51 HIS HB2 3.810 . 3.810 3.417 2.448 3.776 . 0 0 "[ . 1 . 2]" 1
595 1 51 HIS H 1 51 HIS QB 3.100 . 3.100 2.803 2.154 3.071 . 0 0 "[ . 1 . 2]" 1
596 1 51 HIS H 1 51 HIS HB3 3.810 . 3.810 3.127 2.211 3.699 . 0 0 "[ . 1 . 2]" 1
597 1 51 HIS H 1 52 PHE H 4.800 . 4.800 4.512 4.459 4.594 . 0 0 "[ . 1 . 2]" 1
598 1 51 HIS H 1 52 PHE HE1 5.500 . 5.500 5.451 5.241 5.507 0.007 14 0 "[ . 1 . 2]" 1
599 1 51 HIS HA 1 51 HIS QB 2.630 . 2.630 2.212 2.152 2.401 . 0 0 "[ . 1 . 2]" 1
600 1 51 HIS HA 1 52 PHE H 3.350 . 3.350 2.242 2.178 2.342 . 0 0 "[ . 1 . 2]" 1
601 1 51 HIS QB 1 52 PHE H 3.570 . 3.570 2.861 2.644 3.622 0.052 3 0 "[ . 1 . 2]" 1
602 1 51 HIS HB2 1 52 PHE H 4.080 . 4.080 3.109 2.697 4.082 0.002 10 0 "[ . 1 . 2]" 1
603 1 51 HIS HB3 1 52 PHE H 4.080 . 4.080 3.731 2.833 4.103 0.023 7 0 "[ . 1 . 2]" 1
604 1 52 PHE H 1 52 PHE HB2 4.120 . 4.120 2.466 2.403 2.601 . 0 0 "[ . 1 . 2]" 1
605 1 52 PHE H 1 52 PHE HB3 3.840 . 3.840 3.653 3.607 3.740 . 0 0 "[ . 1 . 2]" 1
606 1 52 PHE H 1 52 PHE HD1 5.100 . 5.100 4.106 4.036 4.170 . 0 0 "[ . 1 . 2]" 1
607 1 52 PHE H 1 52 PHE HD2 4.610 . 4.610 3.497 3.356 3.770 . 0 0 "[ . 1 . 2]" 1
608 1 52 PHE H 1 52 PHE HE1 5.500 . 5.500 5.519 5.508 5.542 0.042 12 0 "[ . 1 . 2]" 1
609 1 52 PHE H 1 53 GLY H 3.750 . 3.750 2.571 2.511 2.706 . 0 0 "[ . 1 . 2]" 1
610 1 52 PHE H 1 53 GLY HA2 5.020 . 5.020 4.964 4.887 5.014 . 0 0 "[ . 1 . 2]" 1
611 1 52 PHE H 1 53 GLY HA3 4.890 . 4.890 4.898 4.892 4.915 0.025 3 0 "[ . 1 . 2]" 1
612 1 52 PHE H 1 54 SER H 4.290 . 4.290 3.766 3.489 4.144 . 0 0 "[ . 1 . 2]" 1
613 1 52 PHE H 1 57 GLU H 5.500 . 5.500 5.021 4.796 5.386 . 0 0 "[ . 1 . 2]" 1
614 1 52 PHE H 1 57 GLU HB3 4.970 . 4.970 3.376 3.130 3.859 . 0 0 "[ . 1 . 2]" 1
615 1 52 PHE HA 1 52 PHE HD1 3.020 . 3.020 2.136 2.073 2.172 . 0 0 "[ . 1 . 2]" 1
616 1 52 PHE HA 1 53 GLY HA2 4.540 . 4.540 4.535 4.523 4.542 0.002 10 0 "[ . 1 . 2]" 1
617 1 52 PHE HB2 1 52 PHE HD2 3.220 . 3.220 2.327 2.311 2.337 . 0 0 "[ . 1 . 2]" 1
618 1 52 PHE HB2 1 52 PHE HE2 4.750 . 4.750 4.622 4.593 4.641 . 0 0 "[ . 1 . 2]" 1
619 1 52 PHE HB2 1 53 GLY H 3.720 . 3.720 2.041 1.871 2.130 . 0 0 "[ . 1 . 2]" 1
620 1 52 PHE HB2 1 53 GLY HA2 4.510 . 4.510 4.505 4.452 4.518 0.008 17 0 "[ . 1 . 2]" 1
621 1 52 PHE HB2 1 53 GLY HA3 4.090 . 4.090 3.984 3.876 4.035 . 0 0 "[ . 1 . 2]" 1
622 1 52 PHE HB2 1 54 SER H 4.270 . 4.270 4.006 3.906 4.161 . 0 0 "[ . 1 . 2]" 1
623 1 52 PHE HB2 1 57 GLU HB3 3.860 . 3.860 2.334 2.278 2.434 . 0 0 "[ . 1 . 2]" 1
624 1 52 PHE HB2 1 57 GLU HG2 4.770 . 4.770 4.172 4.110 4.278 . 0 0 "[ . 1 . 2]" 1
625 1 52 PHE HB2 1 57 GLU HG3 4.040 . 4.040 3.796 3.768 3.837 . 0 0 "[ . 1 . 2]" 1
626 1 52 PHE HB3 1 53 GLY H 3.860 . 3.860 3.120 2.894 3.236 . 0 0 "[ . 1 . 2]" 1
627 1 52 PHE HB3 1 53 GLY HA3 4.680 . 4.680 4.404 4.214 4.513 . 0 0 "[ . 1 . 2]" 1
628 1 52 PHE HB3 1 57 GLU HB3 3.910 . 3.910 3.929 3.913 3.949 0.039 12 0 "[ . 1 . 2]" 1
629 1 52 PHE HD2 1 57 GLU HA 4.740 . 4.740 4.148 4.067 4.211 . 0 0 "[ . 1 . 2]" 1
630 1 52 PHE HD2 1 57 GLU HB3 3.680 . 3.680 2.022 1.959 2.054 . 0 0 "[ . 1 . 2]" 1
631 1 52 PHE HD2 1 57 GLU HG2 4.980 . 4.980 4.287 4.217 4.350 . 0 0 "[ . 1 . 2]" 1
632 1 52 PHE HD2 1 57 GLU HG3 4.950 . 4.950 4.787 4.757 4.814 . 0 0 "[ . 1 . 2]" 1
633 1 52 PHE HD2 1 60 TYR HB3 5.500 . 5.500 5.457 5.227 5.503 0.003 6 0 "[ . 1 . 2]" 1
634 1 52 PHE HD2 1 60 TYR HD2 5.500 . 5.500 5.257 5.088 5.502 0.002 1 0 "[ . 1 . 2]" 1
635 1 52 PHE HD2 1 61 TYR HB2 4.410 . 4.410 3.797 3.683 3.869 . 0 0 "[ . 1 . 2]" 1
636 1 52 PHE HD2 1 61 TYR HD2 5.160 . 5.160 4.651 4.513 4.796 . 0 0 "[ . 1 . 2]" 1
637 1 52 PHE HD2 1 112 THR MG 4.180 . 4.180 3.034 2.896 3.221 . 0 0 "[ . 1 . 2]" 1
638 1 52 PHE HD2 1 116 MET HB3 5.500 . 5.500 4.639 4.450 4.922 . 0 0 "[ . 1 . 2]" 1
639 1 52 PHE HD2 1 116 MET ME 3.790 . 3.790 3.634 3.551 3.711 . 0 0 "[ . 1 . 2]" 1
640 1 52 PHE HE1 1 116 MET HA 4.780 . 4.780 3.680 3.553 3.805 . 0 0 "[ . 1 . 2]" 1
641 1 52 PHE HE1 1 119 ARG HB2 3.990 . 3.990 3.693 3.464 3.992 0.002 16 0 "[ . 1 . 2]" 1
642 1 52 PHE HE1 1 119 ARG HB3 4.020 . 4.020 3.726 3.509 3.988 . 0 0 "[ . 1 . 2]" 1
643 1 52 PHE HE1 1 119 ARG HG3 3.750 . 3.750 2.861 2.621 3.375 . 0 0 "[ . 1 . 2]" 1
644 1 52 PHE HE2 1 57 GLU HB3 4.930 . 4.930 4.228 4.133 4.274 . 0 0 "[ . 1 . 2]" 1
645 1 52 PHE HE2 1 61 TYR HA 4.190 . 4.190 4.156 3.792 4.195 0.005 10 0 "[ . 1 . 2]" 1
646 1 52 PHE HE2 1 61 TYR HB2 3.880 . 3.880 2.566 2.292 2.754 . 0 0 "[ . 1 . 2]" 1
647 1 52 PHE HE2 1 61 TYR HB3 4.830 . 4.830 4.195 3.978 4.416 . 0 0 "[ . 1 . 2]" 1
648 1 52 PHE HE2 1 61 TYR HD2 3.470 . 3.470 2.410 2.313 2.539 . 0 0 "[ . 1 . 2]" 1
649 1 52 PHE HE2 1 112 THR HA 5.500 . 5.500 5.354 5.272 5.489 . 0 0 "[ . 1 . 2]" 1
650 1 52 PHE HE2 1 112 THR MG 2.910 . 2.910 2.945 2.921 2.971 0.061 12 0 "[ . 1 . 2]" 1
651 1 52 PHE HE2 1 116 MET H 5.430 . 5.430 4.902 4.761 5.355 . 0 0 "[ . 1 . 2]" 1
652 1 52 PHE HE2 1 116 MET HB3 3.720 . 3.720 2.512 2.351 2.966 . 0 0 "[ . 1 . 2]" 1
653 1 52 PHE HE2 1 116 MET ME 2.550 . 2.550 1.928 1.896 1.973 . 0 0 "[ . 1 . 2]" 1
654 1 52 PHE HZ 1 61 TYR HD2 4.670 . 4.670 2.663 2.272 2.855 . 0 0 "[ . 1 . 2]" 1
655 1 52 PHE HZ 1 116 MET HA 3.670 . 3.670 2.535 2.404 2.975 . 0 0 "[ . 1 . 2]" 1
656 1 52 PHE HZ 1 116 MET HB2 4.640 . 4.640 2.120 2.037 2.182 . 0 0 "[ . 1 . 2]" 1
657 1 52 PHE HZ 1 120 VAL MG1 4.600 . 4.600 4.301 4.150 4.447 . 0 0 "[ . 1 . 2]" 1
658 1 53 GLY H 1 54 SER H 3.040 . 3.040 2.173 2.074 2.313 . 0 0 "[ . 1 . 2]" 1
659 1 53 GLY H 1 54 SER HA 4.550 . 4.550 4.572 4.555 4.598 0.048 12 0 "[ . 1 . 2]" 1
660 1 53 GLY H 1 57 GLU H 5.460 . 5.460 4.083 3.966 4.232 . 0 0 "[ . 1 . 2]" 1
661 1 53 GLY H 1 57 GLU HB3 5.080 . 5.080 3.114 3.020 3.257 . 0 0 "[ . 1 . 2]" 1
662 1 53 GLY H 1 58 ASP H 5.030 . 5.030 4.473 4.387 4.608 . 0 0 "[ . 1 . 2]" 1
663 1 53 GLY HA2 1 57 GLU HG3 4.800 . 4.800 4.804 4.800 4.809 0.009 3 0 "[ . 1 . 2]" 1
664 1 53 GLY HA3 1 54 SER H 3.270 . 3.270 2.704 2.525 2.845 . 0 0 "[ . 1 . 2]" 1
665 1 53 GLY HA3 1 54 SER HA 4.710 . 4.710 4.597 4.499 4.658 . 0 0 "[ . 1 . 2]" 1
666 1 53 GLY HA3 1 56 TYR HD2 4.940 . 4.940 4.722 4.563 4.947 0.007 7 0 "[ . 1 . 2]" 1
667 1 53 GLY HA3 1 57 GLU HB2 3.820 . 3.820 3.819 3.725 3.833 0.013 12 0 "[ . 1 . 2]" 1
668 1 54 SER H 1 54 SER HB3 3.900 . 3.900 3.361 3.123 3.902 0.002 2 0 "[ . 1 . 2]" 1
669 1 54 SER H 1 55 ASP H 4.510 . 4.510 4.298 4.238 4.352 . 0 0 "[ . 1 . 2]" 1
670 1 54 SER H 1 55 ASP HA 5.350 . 5.350 5.007 4.888 5.152 . 0 0 "[ . 1 . 2]" 1
671 1 54 SER H 1 56 TYR H 5.050 . 5.050 4.103 3.977 4.264 . 0 0 "[ . 1 . 2]" 1
672 1 54 SER H 1 56 TYR HB3 4.420 . 4.420 4.160 4.056 4.329 . 0 0 "[ . 1 . 2]" 1
673 1 54 SER H 1 56 TYR HD2 4.260 . 4.260 4.263 4.220 4.275 0.015 18 0 "[ . 1 . 2]" 1
674 1 54 SER H 1 57 GLU H 4.160 . 4.160 2.746 2.690 2.799 . 0 0 "[ . 1 . 2]" 1
675 1 54 SER H 1 57 GLU HA 5.160 . 5.160 4.916 4.859 4.971 . 0 0 "[ . 1 . 2]" 1
676 1 54 SER H 1 57 GLU HB3 4.110 . 4.110 3.984 3.853 4.068 . 0 0 "[ . 1 . 2]" 1
677 1 54 SER H 1 57 GLU HG2 4.980 . 4.980 4.419 4.230 4.522 . 0 0 "[ . 1 . 2]" 1
678 1 54 SER H 1 58 ASP H 4.030 . 4.030 3.594 3.524 3.687 . 0 0 "[ . 1 . 2]" 1
679 1 54 SER H 1 58 ASP HB2 4.590 . 4.590 4.606 4.588 4.621 0.031 8 0 "[ . 1 . 2]" 1
680 1 54 SER HA 1 54 SER HB2 2.930 . 2.930 2.727 2.641 2.978 0.048 12 0 "[ . 1 . 2]" 1
681 1 54 SER HA 1 54 SER HB3 2.940 . 2.940 2.873 2.517 2.970 0.030 18 0 "[ . 1 . 2]" 1
682 1 54 SER HA 1 55 ASP H 3.050 . 3.050 2.666 2.615 2.767 . 0 0 "[ . 1 . 2]" 1
683 1 54 SER HA 1 56 TYR H 4.480 . 4.480 4.270 4.163 4.481 0.001 9 0 "[ . 1 . 2]" 1
684 1 54 SER HB2 1 55 ASP H 3.610 . 3.610 3.510 3.199 3.618 0.008 3 0 "[ . 1 . 2]" 1
685 1 54 SER HB2 1 56 TYR HB3 4.270 . 4.270 3.667 2.551 4.076 . 0 0 "[ . 1 . 2]" 1
686 1 54 SER HB2 1 56 TYR HD2 4.910 . 4.910 4.631 3.655 4.915 0.005 10 0 "[ . 1 . 2]" 1
687 1 54 SER HB3 1 55 ASP H 3.440 . 3.440 2.384 1.846 2.640 . 0 0 "[ . 1 . 2]" 1
688 1 54 SER HB3 1 55 ASP HA 4.580 . 4.580 4.538 4.387 4.601 0.021 18 0 "[ . 1 . 2]" 1
689 1 54 SER HB3 1 55 ASP QB 3.920 . 3.920 3.938 3.921 3.981 0.061 10 0 "[ . 1 . 2]" 1
690 1 54 SER HB3 1 56 TYR HD2 5.330 . 5.330 4.509 4.022 5.333 0.003 2 0 "[ . 1 . 2]" 1
691 1 54 SER HB3 1 57 GLU H 4.290 . 4.290 3.603 3.168 4.294 0.004 12 0 "[ . 1 . 2]" 1
692 1 54 SER HB3 1 58 ASP H 5.350 . 5.350 4.941 4.740 5.362 0.012 12 0 "[ . 1 . 2]" 1
693 1 55 ASP H 1 55 ASP QB 2.890 . 2.890 2.302 2.191 2.395 . 0 0 "[ . 1 . 2]" 1
694 1 55 ASP H 1 56 TYR H 3.620 . 3.620 2.679 2.609 2.763 . 0 0 "[ . 1 . 2]" 1
695 1 55 ASP H 1 56 TYR HA 5.500 . 5.500 5.306 5.248 5.373 . 0 0 "[ . 1 . 2]" 1
696 1 55 ASP H 1 56 TYR HB3 4.900 . 4.900 4.563 4.466 4.630 . 0 0 "[ . 1 . 2]" 1
697 1 55 ASP H 1 57 GLU H 4.900 . 4.900 4.480 4.400 4.546 . 0 0 "[ . 1 . 2]" 1
698 1 55 ASP H 1 58 ASP H 4.980 . 4.980 4.657 4.607 4.721 . 0 0 "[ . 1 . 2]" 1
699 1 55 ASP HA 1 58 ASP H 4.380 . 4.380 3.150 2.990 3.417 . 0 0 "[ . 1 . 2]" 1
700 1 55 ASP HA 1 58 ASP HB2 3.740 . 3.740 3.005 2.802 3.319 . 0 0 "[ . 1 . 2]" 1
701 1 55 ASP HA 1 58 ASP HB3 3.230 . 3.230 2.124 1.995 2.361 . 0 0 "[ . 1 . 2]" 1
702 1 55 ASP HA 1 59 ARG H 5.500 . 5.500 3.526 3.384 3.670 . 0 0 "[ . 1 . 2]" 1
703 1 55 ASP HA 1 59 ARG HB3 4.480 . 4.480 4.475 4.388 4.496 0.016 12 0 "[ . 1 . 2]" 1
704 1 55 ASP HA 1 59 ARG HG2 5.500 . 5.500 5.324 4.957 5.504 0.004 19 0 "[ . 1 . 2]" 1
705 1 55 ASP QB 1 58 ASP H 5.340 . 5.340 4.733 4.617 4.913 . 0 0 "[ . 1 . 2]" 1
706 1 55 ASP QB 1 59 ARG H 5.340 . 5.340 4.267 4.126 4.486 . 0 0 "[ . 1 . 2]" 1
707 1 55 ASP QB 1 59 ARG HB3 4.090 . 4.090 3.877 3.743 4.097 0.007 10 0 "[ . 1 . 2]" 1
708 1 55 ASP QB 1 59 ARG HG2 5.190 . 5.190 4.493 4.221 4.794 . 0 0 "[ . 1 . 2]" 1
709 1 55 ASP HB2 1 56 TYR H 5.500 . 5.500 3.313 2.872 3.981 . 0 0 "[ . 1 . 2]" 1
710 1 55 ASP HB3 1 56 TYR H 5.500 . 5.500 3.847 3.718 3.943 . 0 0 "[ . 1 . 2]" 1
711 1 56 TYR H 1 56 TYR HB3 3.100 . 3.100 2.179 2.153 2.200 . 0 0 "[ . 1 . 2]" 1
712 1 56 TYR H 1 56 TYR HD2 4.310 . 4.310 4.306 4.272 4.315 0.005 12 0 "[ . 1 . 2]" 1
713 1 56 TYR H 1 57 GLU H 3.480 . 3.480 2.774 2.705 2.862 . 0 0 "[ . 1 . 2]" 1
714 1 56 TYR H 1 58 ASP H 4.020 . 4.020 3.920 3.850 3.996 . 0 0 "[ . 1 . 2]" 1
715 1 56 TYR H 1 59 ARG H 4.640 . 4.640 4.632 4.584 4.649 0.009 12 0 "[ . 1 . 2]" 1
716 1 56 TYR HA 1 56 TYR HB2 2.810 . 2.810 2.349 2.331 2.365 . 0 0 "[ . 1 . 2]" 1
717 1 56 TYR HA 1 56 TYR HD1 2.890 . 2.890 2.790 2.705 2.852 . 0 0 "[ . 1 . 2]" 1
718 1 56 TYR HA 1 59 ARG HG2 4.110 . 4.110 2.621 2.324 2.821 . 0 0 "[ . 1 . 2]" 1
719 1 56 TYR HA 1 59 ARG HG3 3.390 . 3.390 3.294 3.093 3.397 0.007 5 0 "[ . 1 . 2]" 1
720 1 56 TYR HA 1 60 TYR H 4.960 . 4.960 4.472 4.297 4.627 . 0 0 "[ . 1 . 2]" 1
721 1 56 TYR HB2 1 56 TYR HD1 2.750 . 2.750 2.689 2.648 2.730 . 0 0 "[ . 1 . 2]" 1
722 1 56 TYR HB2 1 57 GLU H 4.190 . 4.190 3.964 3.927 3.987 . 0 0 "[ . 1 . 2]" 1
723 1 56 TYR HB3 1 56 TYR HD2 2.850 . 2.850 2.324 2.304 2.335 . 0 0 "[ . 1 . 2]" 1
724 1 56 TYR HB3 1 57 GLU H 3.740 . 3.740 2.577 2.539 2.610 . 0 0 "[ . 1 . 2]" 1
725 1 56 TYR HB3 1 57 GLU HG2 4.670 . 4.670 4.501 4.344 4.569 . 0 0 "[ . 1 . 2]" 1
726 1 56 TYR HB3 1 57 GLU HG3 4.030 . 4.030 3.739 3.622 3.870 . 0 0 "[ . 1 . 2]" 1
727 1 56 TYR HB3 1 58 ASP H 4.720 . 4.720 4.727 4.723 4.733 0.013 18 0 "[ . 1 . 2]" 1
728 1 56 TYR HD1 1 59 ARG HG2 4.430 . 4.430 4.382 4.216 4.435 0.005 12 0 "[ . 1 . 2]" 1
729 1 56 TYR HD2 1 57 GLU H 4.190 . 4.190 3.030 2.837 3.211 . 0 0 "[ . 1 . 2]" 1
730 1 56 TYR HD2 1 57 GLU HA 4.110 . 4.110 3.898 3.733 4.110 . 0 0 "[ . 1 . 2]" 1
731 1 56 TYR HD2 1 57 GLU HG2 3.400 . 3.400 2.735 2.640 2.921 . 0 0 "[ . 1 . 2]" 1
732 1 56 TYR HD2 1 57 GLU HG3 3.210 . 3.210 2.299 2.171 2.468 . 0 0 "[ . 1 . 2]" 1
733 1 56 TYR HE2 1 57 GLU HA 4.750 . 4.750 4.411 4.245 4.584 . 0 0 "[ . 1 . 2]" 1
734 1 56 TYR HE2 1 57 GLU HG2 3.900 . 3.900 2.816 2.696 2.983 . 0 0 "[ . 1 . 2]" 1
735 1 56 TYR HE2 1 57 GLU HG3 4.220 . 4.220 3.562 3.411 3.837 . 0 0 "[ . 1 . 2]" 1
736 1 57 GLU H 1 57 GLU HG2 3.680 . 3.680 3.357 3.219 3.431 . 0 0 "[ . 1 . 2]" 1
737 1 57 GLU H 1 58 ASP H 3.480 . 3.480 2.379 2.299 2.475 . 0 0 "[ . 1 . 2]" 1
738 1 57 GLU H 1 59 ARG H 4.460 . 4.460 4.077 3.997 4.140 . 0 0 "[ . 1 . 2]" 1
739 1 57 GLU HA 1 57 GLU HB3 3.000 . 3.000 2.550 2.509 2.581 . 0 0 "[ . 1 . 2]" 1
740 1 57 GLU HA 1 57 GLU HG2 3.310 . 3.310 2.293 2.240 2.371 . 0 0 "[ . 1 . 2]" 1
741 1 57 GLU HA 1 57 GLU HG3 3.440 . 3.440 3.327 3.281 3.406 . 0 0 "[ . 1 . 2]" 1
742 1 57 GLU HA 1 59 ARG H 5.170 . 5.170 4.397 4.287 4.484 . 0 0 "[ . 1 . 2]" 1
743 1 57 GLU HA 1 60 TYR HB2 4.030 . 4.030 3.850 3.666 3.959 . 0 0 "[ . 1 . 2]" 1
744 1 57 GLU HB3 1 58 ASP H 4.020 . 4.020 3.668 3.631 3.723 . 0 0 "[ . 1 . 2]" 1
745 1 57 GLU HB3 1 58 ASP HA 5.500 . 5.500 4.350 4.290 4.402 . 0 0 "[ . 1 . 2]" 1
746 1 58 ASP H 1 58 ASP HB2 3.280 . 3.280 2.384 2.306 2.435 . 0 0 "[ . 1 . 2]" 1
747 1 58 ASP H 1 58 ASP HB3 3.090 . 3.090 2.610 2.541 2.697 . 0 0 "[ . 1 . 2]" 1
748 1 58 ASP H 1 61 TYR H 5.500 . 5.500 4.730 4.661 4.830 . 0 0 "[ . 1 . 2]" 1
749 1 58 ASP HB3 1 59 ARG H 3.300 . 3.300 2.700 2.631 2.759 . 0 0 "[ . 1 . 2]" 1
750 1 59 ARG H 1 59 ARG HB3 2.860 . 2.860 2.524 2.443 2.598 . 0 0 "[ . 1 . 2]" 1
751 1 59 ARG H 1 59 ARG HD2 5.360 . 5.360 4.840 4.551 5.037 . 0 0 "[ . 1 . 2]" 1
752 1 59 ARG H 1 59 ARG QD 4.530 . 4.530 4.328 4.182 4.436 . 0 0 "[ . 1 . 2]" 1
753 1 59 ARG H 1 59 ARG HD3 5.360 . 5.360 4.903 4.634 5.181 . 0 0 "[ . 1 . 2]" 1
754 1 59 ARG H 1 59 ARG HG2 3.560 . 3.560 3.174 2.823 3.364 . 0 0 "[ . 1 . 2]" 1
755 1 59 ARG H 1 59 ARG HG3 3.330 . 3.330 2.740 2.411 2.985 . 0 0 "[ . 1 . 2]" 1
756 1 59 ARG H 1 61 TYR H 4.490 . 4.490 3.973 3.847 4.075 . 0 0 "[ . 1 . 2]" 1
757 1 59 ARG H 1 61 TYR HB3 4.900 . 4.900 4.663 4.542 4.763 . 0 0 "[ . 1 . 2]" 1
758 1 59 ARG HA 1 59 ARG HB2 2.400 . 2.400 2.342 2.311 2.402 0.002 11 0 "[ . 1 . 2]" 1
759 1 59 ARG HA 1 59 ARG HB3 2.910 . 2.910 2.518 2.459 2.549 . 0 0 "[ . 1 . 2]" 1
760 1 59 ARG HA 1 59 ARG QD 3.880 . 3.880 3.833 3.717 3.962 0.082 18 0 "[ . 1 . 2]" 1
761 1 59 ARG HA 1 60 TYR HA 4.940 . 4.940 4.750 4.698 4.798 . 0 0 "[ . 1 . 2]" 1
762 1 59 ARG HA 1 62 ARG H 4.860 . 4.860 3.213 3.127 3.394 . 0 0 "[ . 1 . 2]" 1
763 1 59 ARG HB2 1 59 ARG QD 2.650 . 2.650 2.138 1.996 2.358 . 0 0 "[ . 1 . 2]" 1
764 1 59 ARG HB2 1 59 ARG HG2 2.950 . 2.950 2.809 2.749 2.918 . 0 0 "[ . 1 . 2]" 1
765 1 59 ARG HB2 1 60 TYR H 4.270 . 4.270 4.009 3.845 4.085 . 0 0 "[ . 1 . 2]" 1
766 1 59 ARG HB3 1 60 TYR H 4.550 . 4.550 3.944 3.914 3.974 . 0 0 "[ . 1 . 2]" 1
767 1 59 ARG QD 1 59 ARG HG3 2.600 . 2.600 2.303 2.122 2.523 . 0 0 "[ . 1 . 2]" 1
768 1 59 ARG QD 1 60 TYR H 4.190 . 4.190 3.589 3.042 4.032 . 0 0 "[ . 1 . 2]" 1
769 1 59 ARG QD 1 60 TYR HB2 4.400 . 4.400 3.919 3.186 4.432 0.032 6 0 "[ . 1 . 2]" 1
770 1 59 ARG QD 1 63 GLU HG2 4.250 . 4.250 3.977 3.655 4.279 0.029 18 0 "[ . 1 . 2]" 1
771 1 59 ARG QD 1 63 GLU HG3 3.920 . 3.920 2.769 2.305 3.383 . 0 0 "[ . 1 . 2]" 1
772 1 59 ARG HD2 1 59 ARG HG3 2.990 . 2.990 2.453 2.196 2.788 . 0 0 "[ . 1 . 2]" 1
773 1 59 ARG HD2 1 60 TYR H 4.860 . 4.860 3.854 3.109 4.307 . 0 0 "[ . 1 . 2]" 1
774 1 59 ARG HD3 1 59 ARG HG3 2.990 . 2.990 2.819 2.540 2.991 0.001 16 0 "[ . 1 . 2]" 1
775 1 59 ARG HD3 1 60 TYR H 4.860 . 4.860 4.389 3.532 4.873 0.013 8 0 "[ . 1 . 2]" 1
776 1 59 ARG HG2 1 60 TYR H 3.710 . 3.710 3.610 3.354 3.712 0.002 15 0 "[ . 1 . 2]" 1
777 1 59 ARG HG2 1 60 TYR HA 5.210 . 5.210 5.223 5.212 5.235 0.025 12 0 "[ . 1 . 2]" 1
778 1 59 ARG HG3 1 60 TYR HB2 4.250 . 4.250 3.272 3.181 3.407 . 0 0 "[ . 1 . 2]" 1
779 1 59 ARG HG3 1 63 GLU HG3 4.470 . 4.470 4.471 4.354 4.499 0.029 12 0 "[ . 1 . 2]" 1
780 1 60 TYR H 1 60 TYR HB2 3.350 . 3.350 2.570 2.455 2.663 . 0 0 "[ . 1 . 2]" 1
781 1 60 TYR H 1 61 TYR H 3.610 . 3.610 2.477 2.406 2.542 . 0 0 "[ . 1 . 2]" 1
782 1 60 TYR H 1 62 ARG H 4.390 . 4.390 4.084 3.948 4.207 . 0 0 "[ . 1 . 2]" 1
783 1 60 TYR H 1 116 MET ME 5.390 . 5.390 5.374 5.314 5.409 0.019 7 0 "[ . 1 . 2]" 1
784 1 60 TYR HA 1 60 TYR HD1 3.060 . 3.060 2.527 2.378 2.679 . 0 0 "[ . 1 . 2]" 1
785 1 60 TYR HA 1 60 TYR HE1 4.850 . 4.850 4.745 4.630 4.843 . 0 0 "[ . 1 . 2]" 1
786 1 60 TYR HA 1 63 GLU HB2 2.960 . 2.960 2.187 2.019 2.319 . 0 0 "[ . 1 . 2]" 1
787 1 60 TYR HA 1 63 GLU HG2 4.280 . 4.280 4.206 4.128 4.282 0.002 6 0 "[ . 1 . 2]" 1
788 1 60 TYR HA 1 63 GLU HG3 4.100 . 4.100 2.882 2.682 3.096 . 0 0 "[ . 1 . 2]" 1
789 1 60 TYR HA 1 64 ASN H 5.500 . 5.500 4.426 4.321 4.632 . 0 0 "[ . 1 . 2]" 1
790 1 60 TYR HA 1 64 ASN QD 4.540 . 4.540 3.590 3.370 4.012 . 0 0 "[ . 1 . 2]" 1
791 1 60 TYR HB2 1 60 TYR HD1 3.570 . 3.570 2.684 2.622 2.750 . 0 0 "[ . 1 . 2]" 1
792 1 60 TYR HB2 1 61 TYR H 4.290 . 4.290 3.883 3.800 3.950 . 0 0 "[ . 1 . 2]" 1
793 1 60 TYR HD1 1 63 GLU HB2 4.210 . 4.210 3.524 3.131 3.746 . 0 0 "[ . 1 . 2]" 1
794 1 60 TYR HD1 1 63 GLU HB3 4.700 . 4.700 4.119 3.687 4.422 . 0 0 "[ . 1 . 2]" 1
795 1 60 TYR HD1 1 63 GLU HG3 4.550 . 4.550 4.544 4.418 4.576 0.026 18 0 "[ . 1 . 2]" 1
796 1 60 TYR HD2 1 61 TYR H 4.460 . 4.460 3.905 3.742 4.080 . 0 0 "[ . 1 . 2]" 1
797 1 60 TYR HD2 1 61 TYR HA 4.130 . 4.130 3.978 3.760 4.141 0.011 18 0 "[ . 1 . 2]" 1
798 1 60 TYR HD2 1 112 THR MG 4.030 . 4.030 2.378 2.287 2.490 . 0 0 "[ . 1 . 2]" 1
799 1 60 TYR HD2 1 113 ASP H 5.500 . 5.500 5.460 5.290 5.508 0.008 8 0 "[ . 1 . 2]" 1
800 1 60 TYR HD2 1 113 ASP HA 5.460 . 5.460 5.358 5.223 5.462 0.002 6 0 "[ . 1 . 2]" 1
801 1 60 TYR HD2 1 116 MET ME 3.650 . 3.650 2.620 2.405 2.771 . 0 0 "[ . 1 . 2]" 1
802 1 60 TYR HE2 1 61 TYR HA 5.500 . 5.500 5.251 4.992 5.504 0.004 10 0 "[ . 1 . 2]" 1
803 1 60 TYR HE2 1 116 MET ME 3.690 . 3.690 3.108 2.851 3.407 . 0 0 "[ . 1 . 2]" 1
804 1 61 TYR H 1 61 TYR HB2 3.510 . 3.510 2.684 2.625 2.732 . 0 0 "[ . 1 . 2]" 1
805 1 61 TYR H 1 61 TYR HB3 3.550 . 3.550 2.197 2.128 2.246 . 0 0 "[ . 1 . 2]" 1
806 1 61 TYR H 1 61 TYR HD1 4.350 . 4.350 4.249 4.193 4.350 . 0 0 "[ . 1 . 2]" 1
807 1 61 TYR H 1 62 ARG H 3.780 . 3.780 2.704 2.625 2.810 . 0 0 "[ . 1 . 2]" 1
808 1 61 TYR H 1 63 GLU H 5.010 . 5.010 3.846 3.805 3.880 . 0 0 "[ . 1 . 2]" 1
809 1 61 TYR H 1 63 GLU HB2 4.570 . 4.570 4.597 4.580 4.627 0.057 12 0 "[ . 1 . 2]" 1
810 1 61 TYR H 1 116 MET ME 3.910 . 3.910 3.615 3.569 3.676 . 0 0 "[ . 1 . 2]" 1
811 1 61 TYR HA 1 61 TYR HD2 3.400 . 3.400 3.384 3.266 3.407 0.007 8 0 "[ . 1 . 2]" 1
812 1 61 TYR HA 1 64 ASN QD 5.340 . 5.340 3.864 3.553 4.002 . 0 0 "[ . 1 . 2]" 1
813 1 61 TYR HA 1 112 THR MG 4.440 . 4.440 4.458 4.419 4.495 0.055 18 0 "[ . 1 . 2]" 1
814 1 61 TYR HB2 1 62 ARG H 4.200 . 4.200 3.995 3.864 4.044 . 0 0 "[ . 1 . 2]" 1
815 1 61 TYR HB2 1 112 THR MG 4.390 . 4.390 4.120 4.048 4.211 . 0 0 "[ . 1 . 2]" 1
816 1 61 TYR HB2 1 116 MET ME 2.830 . 2.830 2.593 2.497 2.675 . 0 0 "[ . 1 . 2]" 1
817 1 61 TYR HB3 1 62 ARG H 3.570 . 3.570 2.624 2.456 2.694 . 0 0 "[ . 1 . 2]" 1
818 1 61 TYR HB3 1 63 GLU H 4.980 . 4.980 4.797 4.692 4.853 . 0 0 "[ . 1 . 2]" 1
819 1 61 TYR HB3 1 112 THR MG 5.500 . 5.500 5.403 5.305 5.504 0.004 16 0 "[ . 1 . 2]" 1
820 1 61 TYR HB3 1 116 MET ME 4.000 . 4.000 3.918 3.831 3.984 . 0 0 "[ . 1 . 2]" 1
821 1 61 TYR HD1 1 62 ARG H 3.760 . 3.760 2.677 2.606 2.873 . 0 0 "[ . 1 . 2]" 1
822 1 61 TYR HD1 1 62 ARG HA 4.230 . 4.230 3.028 2.939 3.285 . 0 0 "[ . 1 . 2]" 1
823 1 61 TYR HD1 1 62 ARG HB2 4.480 . 4.480 3.766 3.329 3.931 . 0 0 "[ . 1 . 2]" 1
824 1 61 TYR HD1 1 62 ARG QD 4.960 . 4.960 3.794 2.852 4.137 . 0 0 "[ . 1 . 2]" 1
825 1 61 TYR HD1 1 62 ARG HG2 4.460 . 4.460 2.530 2.119 3.951 . 0 0 "[ . 1 . 2]" 1
826 1 61 TYR HD1 1 62 ARG QG 3.870 . 3.870 1.951 1.851 2.207 . 0 0 "[ . 1 . 2]" 1
827 1 61 TYR HD1 1 62 ARG HG3 4.460 . 4.460 2.096 1.896 2.800 . 0 0 "[ . 1 . 2]" 1
828 1 61 TYR HD1 1 65 MET HB3 5.500 . 5.500 4.308 4.173 4.539 . 0 0 "[ . 1 . 2]" 1
829 1 61 TYR HD1 1 65 MET ME 3.780 . 3.780 3.513 3.292 3.780 . 0 0 "[ . 1 . 2]" 1
830 1 61 TYR HD2 1 116 MET HB3 4.030 . 4.030 3.030 2.944 3.129 . 0 0 "[ . 1 . 2]" 1
831 1 61 TYR HD2 1 116 MET ME 3.780 . 3.780 2.738 2.666 2.806 . 0 0 "[ . 1 . 2]" 1
832 1 61 TYR HD2 1 116 MET HG2 4.840 . 4.840 4.320 4.254 4.389 . 0 0 "[ . 1 . 2]" 1
833 1 61 TYR HD2 1 120 VAL MG1 4.080 . 4.080 3.874 3.794 3.950 . 0 0 "[ . 1 . 2]" 1
834 1 61 TYR HE1 1 62 ARG QD 3.900 . 3.900 3.903 3.440 3.983 0.083 10 0 "[ . 1 . 2]" 1
835 1 61 TYR HE1 1 65 MET HB2 5.300 . 5.300 4.954 4.767 5.302 0.002 10 0 "[ . 1 . 2]" 1
836 1 61 TYR HE1 1 65 MET HB3 4.670 . 4.670 4.205 3.981 4.571 . 0 0 "[ . 1 . 2]" 1
837 1 61 TYR HE1 1 65 MET ME 2.860 . 2.860 2.480 2.241 2.858 . 0 0 "[ . 1 . 2]" 1
838 1 61 TYR HE2 1 116 MET HB3 4.820 . 4.820 4.284 4.184 4.382 . 0 0 "[ . 1 . 2]" 1
839 1 61 TYR HE2 1 119 ARG HB2 5.380 . 5.380 5.008 4.889 5.137 . 0 0 "[ . 1 . 2]" 1
840 1 61 TYR HE2 1 119 ARG HB3 5.070 . 5.070 3.914 3.803 4.080 . 0 0 "[ . 1 . 2]" 1
841 1 61 TYR HE2 1 120 VAL MG1 3.180 . 3.180 2.069 2.006 2.150 . 0 0 "[ . 1 . 2]" 1
842 1 62 ARG H 1 62 ARG HB3 3.530 . 3.530 3.531 3.378 3.559 0.029 18 0 "[ . 1 . 2]" 1
843 1 62 ARG H 1 62 ARG QG 3.960 . 3.960 2.613 2.443 3.251 . 0 0 "[ . 1 . 2]" 1
844 1 62 ARG H 1 116 MET ME 5.130 . 5.130 5.097 5.041 5.131 0.001 16 0 "[ . 1 . 2]" 1
845 1 62 ARG HA 1 62 ARG HB3 2.940 . 2.940 2.549 2.509 2.757 . 0 0 "[ . 1 . 2]" 1
846 1 62 ARG HA 1 62 ARG QD 4.070 . 4.070 3.856 3.684 4.054 . 0 0 "[ . 1 . 2]" 1
847 1 62 ARG HA 1 62 ARG QG 3.120 . 3.120 2.233 2.089 2.296 . 0 0 "[ . 1 . 2]" 1
848 1 62 ARG HA 1 64 ASN H 4.720 . 4.720 4.152 4.004 4.455 . 0 0 "[ . 1 . 2]" 1
849 1 62 ARG HA 1 65 MET H 4.740 . 4.740 3.137 3.017 3.336 . 0 0 "[ . 1 . 2]" 1
850 1 62 ARG HA 1 65 MET ME 2.860 . 2.860 2.657 2.327 2.792 . 0 0 "[ . 1 . 2]" 1
851 1 62 ARG HA 1 65 MET HG2 4.170 . 4.170 2.259 2.095 2.482 . 0 0 "[ . 1 . 2]" 1
852 1 62 ARG HB2 1 62 ARG QD 3.580 . 3.580 2.814 1.910 3.210 . 0 0 "[ . 1 . 2]" 1
853 1 62 ARG HB2 1 63 GLU H 3.950 . 3.950 3.175 3.037 3.436 . 0 0 "[ . 1 . 2]" 1
854 1 62 ARG HB3 1 62 ARG QD 2.740 . 2.740 2.383 2.178 2.819 0.079 8 0 "[ . 1 . 2]" 1
855 1 62 ARG HB3 1 63 GLU H 4.730 . 4.730 3.886 3.555 4.018 . 0 0 "[ . 1 . 2]" 1
856 1 62 ARG HB3 1 65 MET H 5.220 . 5.220 5.000 4.845 5.227 0.007 10 0 "[ . 1 . 2]" 1
857 1 62 ARG QD 1 65 MET ME 3.150 . 3.150 3.147 2.914 3.348 0.198 8 0 "[ . 1 . 2]" 1
858 1 62 ARG QG 1 65 MET ME 2.390 . 2.390 2.108 1.910 2.410 0.020 10 0 "[ . 1 . 2]" 1
859 1 63 GLU H 1 63 GLU HB2 2.890 . 2.890 2.086 2.047 2.155 . 0 0 "[ . 1 . 2]" 1
860 1 63 GLU H 1 63 GLU HG2 4.650 . 4.650 3.945 3.745 4.062 . 0 0 "[ . 1 . 2]" 1
861 1 63 GLU H 1 63 GLU HG3 3.860 . 3.860 2.945 2.781 3.127 . 0 0 "[ . 1 . 2]" 1
862 1 63 GLU H 1 64 ASN H 3.450 . 3.450 2.655 2.541 2.787 . 0 0 "[ . 1 . 2]" 1
863 1 63 GLU H 1 64 ASN HD21 4.900 . 4.900 4.056 3.844 4.563 . 0 0 "[ . 1 . 2]" 1
864 1 63 GLU H 1 64 ASN HD22 4.900 . 4.900 4.913 4.902 4.934 0.034 12 0 "[ . 1 . 2]" 1
865 1 63 GLU HA 1 63 GLU HG2 2.510 . 2.510 2.427 2.283 2.524 0.014 18 0 "[ . 1 . 2]" 1
866 1 63 GLU HA 1 63 GLU HG3 3.310 . 3.310 2.888 2.689 3.056 . 0 0 "[ . 1 . 2]" 1
867 1 63 GLU HB2 1 63 GLU HG3 2.640 . 2.640 2.408 2.374 2.469 . 0 0 "[ . 1 . 2]" 1
868 1 63 GLU HB2 1 64 ASN H 4.030 . 4.030 2.696 2.509 2.898 . 0 0 "[ . 1 . 2]" 1
869 1 63 GLU HB2 1 64 ASN QD 4.520 . 4.520 2.745 2.508 3.036 . 0 0 "[ . 1 . 2]" 1
870 1 63 GLU HB3 1 64 ASN H 4.340 . 4.340 3.122 2.876 3.419 . 0 0 "[ . 1 . 2]" 1
871 1 63 GLU HB3 1 64 ASN HD21 4.790 . 4.790 3.224 2.661 3.737 . 0 0 "[ . 1 . 2]" 1
872 1 63 GLU HB3 1 64 ASN QD 4.140 . 4.140 2.860 2.630 3.141 . 0 0 "[ . 1 . 2]" 1
873 1 63 GLU HB3 1 64 ASN HD22 4.790 . 4.790 3.558 2.881 4.795 0.005 7 0 "[ . 1 . 2]" 1
874 1 64 ASN H 1 64 ASN HD21 4.040 . 4.040 2.450 2.062 2.873 . 0 0 "[ . 1 . 2]" 1
875 1 64 ASN H 1 64 ASN QD 3.510 . 3.510 2.397 2.039 2.720 . 0 0 "[ . 1 . 2]" 1
876 1 64 ASN H 1 64 ASN HD22 4.040 . 4.040 3.531 3.206 3.738 . 0 0 "[ . 1 . 2]" 1
877 1 64 ASN H 1 65 MET H 3.130 . 3.130 2.426 2.353 2.546 . 0 0 "[ . 1 . 2]" 1
878 1 64 ASN H 1 65 MET HA 4.970 . 4.970 4.604 4.465 4.752 . 0 0 "[ . 1 . 2]" 1
879 1 64 ASN H 1 65 MET HB3 5.500 . 5.500 4.526 4.420 4.717 . 0 0 "[ . 1 . 2]" 1
880 1 64 ASN H 1 65 MET HG2 4.670 . 4.670 4.664 4.572 4.680 0.010 12 0 "[ . 1 . 2]" 1
881 1 64 ASN H 1 65 MET HG3 5.390 . 5.390 5.339 5.253 5.393 0.003 2 0 "[ . 1 . 2]" 1
882 1 64 ASN HA 1 67 ARG H 5.140 . 5.140 4.321 4.138 4.507 . 0 0 "[ . 1 . 2]" 1
883 1 64 ASN HA 1 67 ARG QD 4.560 . 4.560 4.059 3.066 4.574 0.014 13 0 "[ . 1 . 2]" 1
884 1 64 ASN QB 1 67 ARG HB3 4.400 . 4.400 4.429 4.396 4.493 0.093 12 0 "[ . 1 . 2]" 1
885 1 64 ASN QB 1 67 ARG QD 3.210 . 3.210 2.615 2.056 2.810 . 0 0 "[ . 1 . 2]" 1
886 1 64 ASN QB 1 67 ARG HG3 4.660 . 4.660 4.436 4.264 4.681 0.021 13 0 "[ . 1 . 2]" 1
887 1 64 ASN QD 1 65 MET H 5.340 . 5.340 4.438 4.114 4.661 . 0 0 "[ . 1 . 2]" 1
888 1 65 MET H 1 65 MET HB2 3.840 . 3.840 3.639 3.625 3.661 . 0 0 "[ . 1 . 2]" 1
889 1 65 MET H 1 65 MET HB3 3.790 . 3.790 2.551 2.489 2.596 . 0 0 "[ . 1 . 2]" 1
890 1 65 MET H 1 65 MET HG2 3.750 . 3.750 2.645 2.506 2.740 . 0 0 "[ . 1 . 2]" 1
891 1 65 MET H 1 65 MET HG3 3.400 . 3.400 3.023 2.874 3.104 . 0 0 "[ . 1 . 2]" 1
892 1 65 MET H 1 68 TYR HD1 4.670 . 4.670 4.440 4.279 4.626 . 0 0 "[ . 1 . 2]" 1
893 1 65 MET H 1 68 TYR HE1 5.500 . 5.500 4.141 3.955 4.346 . 0 0 "[ . 1 . 2]" 1
894 1 65 MET HA 1 65 MET ME 4.420 . 4.420 4.247 4.063 4.290 . 0 0 "[ . 1 . 2]" 1
895 1 65 MET HA 1 65 MET HG2 4.070 . 4.070 3.963 3.892 3.999 . 0 0 "[ . 1 . 2]" 1
896 1 65 MET HA 1 65 MET HG3 3.770 . 3.770 3.636 3.619 3.655 . 0 0 "[ . 1 . 2]" 1
897 1 65 MET HA 1 67 ARG H 4.420 . 4.420 3.641 3.542 3.709 . 0 0 "[ . 1 . 2]" 1
898 1 65 MET HA 1 68 TYR HB2 3.540 . 3.540 3.271 3.080 3.540 0.000 13 0 "[ . 1 . 2]" 1
899 1 65 MET HA 1 68 TYR HD1 3.420 . 3.420 2.137 2.019 2.237 . 0 0 "[ . 1 . 2]" 1
900 1 65 MET HA 1 68 TYR HE1 3.770 . 3.770 3.019 2.740 3.163 . 0 0 "[ . 1 . 2]" 1
901 1 65 MET HB2 1 65 MET ME 2.520 . 2.520 2.474 2.166 2.551 0.031 17 0 "[ . 1 . 2]" 1
902 1 65 MET HB2 1 66 HIS H 4.170 . 4.170 4.099 4.039 4.145 . 0 0 "[ . 1 . 2]" 1
903 1 65 MET HB2 1 67 ARG H 5.140 . 5.140 5.158 5.146 5.176 0.036 12 0 "[ . 1 . 2]" 1
904 1 65 MET HB2 1 68 TYR HB2 3.780 . 3.780 3.710 3.571 3.783 0.003 7 0 "[ . 1 . 2]" 1
905 1 65 MET HB2 1 68 TYR HD1 4.180 . 4.180 4.066 3.871 4.172 . 0 0 "[ . 1 . 2]" 1
906 1 65 MET HB2 1 68 TYR HE1 5.500 . 5.500 5.385 5.120 5.506 0.006 6 0 "[ . 1 . 2]" 1
907 1 65 MET HB3 1 65 MET ME 2.400 . 2.400 2.404 2.322 2.429 0.029 18 0 "[ . 1 . 2]" 1
908 1 65 MET ME 1 65 MET HG2 3.010 . 3.010 2.580 2.539 2.657 . 0 0 "[ . 1 . 2]" 1
909 1 65 MET HG2 1 66 HIS H 4.370 . 4.370 3.875 3.796 3.983 . 0 0 "[ . 1 . 2]" 1
910 1 65 MET HG3 1 66 HIS H 3.770 . 3.770 2.624 2.519 2.687 . 0 0 "[ . 1 . 2]" 1
911 1 65 MET HG3 1 67 ARG H 5.060 . 5.060 4.961 4.890 5.064 0.004 2 0 "[ . 1 . 2]" 1
912 1 66 HIS H 1 67 ARG H 3.600 . 3.600 2.781 2.681 2.852 . 0 0 "[ . 1 . 2]" 1
913 1 66 HIS H 1 68 TYR H 4.380 . 4.380 4.385 4.336 4.404 0.024 8 0 "[ . 1 . 2]" 1
914 1 66 HIS H 1 68 TYR HD1 5.070 . 5.070 4.002 3.894 4.056 . 0 0 "[ . 1 . 2]" 1
915 1 66 HIS QB 1 67 ARG H 4.150 . 4.150 2.940 2.724 3.635 . 0 0 "[ . 1 . 2]" 1
916 1 66 HIS QB 1 67 ARG HA 4.430 . 4.430 4.050 3.809 4.418 . 0 0 "[ . 1 . 2]" 1
917 1 67 ARG H 1 67 ARG HB2 3.780 . 3.780 3.639 3.600 3.723 . 0 0 "[ . 1 . 2]" 1
918 1 67 ARG H 1 67 ARG HB3 3.920 . 3.920 2.595 2.507 2.769 . 0 0 "[ . 1 . 2]" 1
919 1 67 ARG H 1 67 ARG HD2 4.510 . 4.510 4.287 2.854 4.539 0.029 18 0 "[ . 1 . 2]" 1
920 1 67 ARG H 1 67 ARG QD 3.630 . 3.630 3.423 2.753 3.794 0.164 12 0 "[ . 1 . 2]" 1
921 1 67 ARG H 1 67 ARG HD3 4.510 . 4.510 3.745 3.487 4.547 0.037 2 0 "[ . 1 . 2]" 1
922 1 67 ARG H 1 67 ARG HG2 4.040 . 4.040 2.091 1.760 2.472 . 0 0 "[ . 1 . 2]" 1
923 1 67 ARG H 1 67 ARG HG3 3.890 . 3.890 3.518 3.114 3.905 0.015 19 0 "[ . 1 . 2]" 1
924 1 67 ARG H 1 68 TYR HB2 5.500 . 5.500 4.476 4.343 4.565 . 0 0 "[ . 1 . 2]" 1
925 1 67 ARG H 1 68 TYR HD1 4.450 . 4.450 2.539 2.388 2.611 . 0 0 "[ . 1 . 2]" 1
926 1 67 ARG H 1 68 TYR HE1 4.160 . 4.160 3.771 3.660 3.864 . 0 0 "[ . 1 . 2]" 1
927 1 67 ARG HA 1 67 ARG QD 4.740 . 4.740 4.260 4.121 4.721 . 0 0 "[ . 1 . 2]" 1
928 1 67 ARG HA 1 67 ARG HG3 4.050 . 4.050 3.822 3.728 4.017 . 0 0 "[ . 1 . 2]" 1
929 1 67 ARG HA 1 68 TYR HD1 4.650 . 4.650 4.572 4.430 4.650 . 0 0 "[ . 1 . 2]" 1
930 1 67 ARG HB2 1 67 ARG QD 3.500 . 3.500 2.610 2.439 3.327 . 0 0 "[ . 1 . 2]" 1
931 1 67 ARG HB2 1 68 TYR H 4.620 . 4.620 4.389 4.315 4.553 . 0 0 "[ . 1 . 2]" 1
932 1 67 ARG HB2 1 68 TYR HD1 4.830 . 4.830 4.747 4.647 4.829 . 0 0 "[ . 1 . 2]" 1
933 1 67 ARG HB2 1 68 TYR HE1 5.390 . 5.390 5.355 5.268 5.393 0.003 7 0 "[ . 1 . 2]" 1
934 1 67 ARG HB3 1 67 ARG HD2 3.750 . 3.750 2.849 2.179 3.585 . 0 0 "[ . 1 . 2]" 1
935 1 67 ARG HB3 1 67 ARG QD 3.180 . 3.180 2.297 2.080 3.116 . 0 0 "[ . 1 . 2]" 1
936 1 67 ARG HB3 1 67 ARG HD3 3.750 . 3.750 2.523 2.158 3.556 . 0 0 "[ . 1 . 2]" 1
937 1 67 ARG HB3 1 68 TYR H 4.760 . 4.760 4.337 4.261 4.465 . 0 0 "[ . 1 . 2]" 1
938 1 67 ARG HB3 1 68 TYR HD1 4.720 . 4.720 4.426 4.328 4.646 . 0 0 "[ . 1 . 2]" 1
939 1 67 ARG HB3 1 68 TYR HE1 5.040 . 5.040 4.855 4.712 5.018 . 0 0 "[ . 1 . 2]" 1
940 1 67 ARG HB3 1 109 PHE HZ 4.940 . 4.940 4.786 4.466 4.970 0.030 19 0 "[ . 1 . 2]" 1
941 1 67 ARG QD 1 68 TYR HD1 4.390 . 4.390 4.130 3.553 4.359 . 0 0 "[ . 1 . 2]" 1
942 1 67 ARG HD2 1 68 TYR HD1 5.090 . 5.090 4.829 3.853 5.103 0.013 6 0 "[ . 1 . 2]" 1
943 1 67 ARG HD2 1 68 TYR HE1 4.540 . 4.540 4.047 2.471 4.516 . 0 0 "[ . 1 . 2]" 1
944 1 67 ARG HD3 1 68 TYR HD1 5.090 . 5.090 4.573 3.840 5.000 . 0 0 "[ . 1 . 2]" 1
945 1 67 ARG HD3 1 68 TYR HE1 4.540 . 4.540 3.720 2.401 4.227 . 0 0 "[ . 1 . 2]" 1
946 1 67 ARG HG2 1 68 TYR H 3.750 . 3.750 3.171 2.978 3.433 . 0 0 "[ . 1 . 2]" 1
947 1 67 ARG HG2 1 68 TYR HA 4.980 . 4.980 4.263 3.941 4.628 . 0 0 "[ . 1 . 2]" 1
948 1 67 ARG HG2 1 68 TYR HD1 3.660 . 3.660 2.239 2.163 2.429 . 0 0 "[ . 1 . 2]" 1
949 1 67 ARG HG2 1 68 TYR HE1 4.860 . 4.860 2.488 2.416 2.586 . 0 0 "[ . 1 . 2]" 1
950 1 67 ARG HG3 1 68 TYR H 4.560 . 4.560 3.801 3.412 4.570 0.010 7 0 "[ . 1 . 2]" 1
951 1 67 ARG HG3 1 68 TYR HD1 5.090 . 5.090 3.289 2.953 3.945 . 0 0 "[ . 1 . 2]" 1
952 1 67 ARG HG3 1 68 TYR HE1 5.140 . 5.140 3.484 3.157 3.843 . 0 0 "[ . 1 . 2]" 1
953 1 67 ARG HG3 1 109 PHE HZ 4.480 . 4.480 2.650 2.425 2.944 . 0 0 "[ . 1 . 2]" 1
954 1 68 TYR H 1 68 TYR HB2 3.180 . 3.180 2.324 2.301 2.360 . 0 0 "[ . 1 . 2]" 1
955 1 68 TYR H 1 68 TYR HD1 4.000 . 4.000 2.104 2.021 2.285 . 0 0 "[ . 1 . 2]" 1
956 1 68 TYR HA 1 68 TYR HD1 4.300 . 4.300 3.588 3.505 3.691 . 0 0 "[ . 1 . 2]" 1
957 1 68 TYR HA 1 68 TYR HD2 4.010 . 4.010 3.378 3.304 3.434 . 0 0 "[ . 1 . 2]" 1
958 1 68 TYR HA 1 68 TYR HE1 5.500 . 5.500 5.255 5.165 5.351 . 0 0 "[ . 1 . 2]" 1
959 1 68 TYR HA 1 68 TYR HE2 5.500 . 5.500 5.146 5.106 5.192 . 0 0 "[ . 1 . 2]" 1
960 1 68 TYR HA 1 69 PRO HA 4.640 . 4.640 4.447 4.365 4.492 . 0 0 "[ . 1 . 2]" 1
961 1 68 TYR HA 1 69 PRO HD2 3.510 . 3.510 2.370 2.283 2.521 . 0 0 "[ . 1 . 2]" 1
962 1 68 TYR HA 1 102 THR MG 5.470 . 5.470 4.636 4.471 4.781 . 0 0 "[ . 1 . 2]" 1
963 1 68 TYR HA 1 109 PHE HZ 4.660 . 4.660 4.325 4.087 4.496 . 0 0 "[ . 1 . 2]" 1
964 1 68 TYR HA 1 117 MET HB2 4.480 . 4.480 4.480 4.383 4.499 0.019 12 0 "[ . 1 . 2]" 1
965 1 68 TYR HA 1 117 MET ME 4.960 . 4.960 4.521 4.445 4.611 . 0 0 "[ . 1 . 2]" 1
966 1 68 TYR HA 1 120 VAL MG2 5.500 . 5.500 4.384 4.249 4.486 . 0 0 "[ . 1 . 2]" 1
967 1 68 TYR HB2 1 120 VAL MG1 5.120 . 5.120 4.181 4.022 4.414 . 0 0 "[ . 1 . 2]" 1
968 1 68 TYR HB3 1 68 TYR HE2 5.080 . 5.080 4.712 4.689 4.727 . 0 0 "[ . 1 . 2]" 1
969 1 68 TYR HB3 1 69 PRO HA 5.090 . 5.090 4.878 4.817 4.921 . 0 0 "[ . 1 . 2]" 1
970 1 68 TYR HB3 1 69 PRO HD2 3.200 . 3.200 2.188 2.157 2.211 . 0 0 "[ . 1 . 2]" 1
971 1 68 TYR HB3 1 117 MET HA 4.290 . 4.290 3.842 3.678 3.993 . 0 0 "[ . 1 . 2]" 1
972 1 68 TYR HB3 1 117 MET HB2 4.380 . 4.380 4.272 4.173 4.372 . 0 0 "[ . 1 . 2]" 1
973 1 68 TYR HB3 1 120 VAL MG1 4.240 . 4.240 3.871 3.698 4.062 . 0 0 "[ . 1 . 2]" 1
974 1 68 TYR HB3 1 120 VAL MG2 4.460 . 4.460 2.256 2.126 2.388 . 0 0 "[ . 1 . 2]" 1
975 1 68 TYR HD1 1 109 PHE HE2 4.120 . 4.120 4.130 4.122 4.140 0.020 10 0 "[ . 1 . 2]" 1
976 1 68 TYR HD2 1 69 PRO HD2 4.110 . 4.110 2.754 2.680 2.819 . 0 0 "[ . 1 . 2]" 1
977 1 68 TYR HD2 1 69 PRO HD3 4.350 . 4.350 4.314 4.195 4.365 0.015 18 0 "[ . 1 . 2]" 1
978 1 68 TYR HD2 1 95 ILE MD 4.310 . 4.310 4.269 4.158 4.332 0.022 8 0 "[ . 1 . 2]" 1
979 1 68 TYR HD2 1 117 MET H 4.780 . 4.780 4.125 4.033 4.213 . 0 0 "[ . 1 . 2]" 1
980 1 68 TYR HD2 1 117 MET HA 3.380 . 3.380 2.049 1.948 2.180 . 0 0 "[ . 1 . 2]" 1
981 1 68 TYR HD2 1 117 MET HB2 4.180 . 4.180 2.544 2.502 2.593 . 0 0 "[ . 1 . 2]" 1
982 1 68 TYR HD2 1 117 MET ME 3.750 . 3.750 3.756 3.676 3.777 0.027 15 0 "[ . 1 . 2]" 1
983 1 68 TYR HD2 1 120 VAL MG1 3.940 . 3.940 3.669 3.518 3.796 . 0 0 "[ . 1 . 2]" 1
984 1 68 TYR HD2 1 120 VAL MG2 4.640 . 4.640 2.783 2.636 2.950 . 0 0 "[ . 1 . 2]" 1
985 1 68 TYR HE2 1 69 PRO HD2 5.320 . 5.320 5.075 4.957 5.177 . 0 0 "[ . 1 . 2]" 1
986 1 68 TYR HE2 1 95 ILE MD 5.300 . 5.300 5.249 5.151 5.325 0.025 10 0 "[ . 1 . 2]" 1
987 1 68 TYR HE2 1 109 PHE HD2 3.810 . 3.810 3.367 3.168 3.696 . 0 0 "[ . 1 . 2]" 1
988 1 68 TYR HE2 1 113 ASP HA 3.670 . 3.670 3.310 3.237 3.435 . 0 0 "[ . 1 . 2]" 1
989 1 68 TYR HE2 1 113 ASP HB3 4.780 . 4.780 3.537 3.382 3.769 . 0 0 "[ . 1 . 2]" 1
990 1 68 TYR HE2 1 114 VAL HA 4.980 . 4.980 4.483 4.426 4.543 . 0 0 "[ . 1 . 2]" 1
991 1 68 TYR HE2 1 116 MET H 5.150 . 5.150 4.528 4.425 4.643 . 0 0 "[ . 1 . 2]" 1
992 1 68 TYR HE2 1 116 MET ME 4.520 . 4.520 4.333 4.302 4.376 . 0 0 "[ . 1 . 2]" 1
993 1 68 TYR HE2 1 116 MET HG2 4.230 . 4.230 2.902 2.824 2.935 . 0 0 "[ . 1 . 2]" 1
994 1 68 TYR HE2 1 117 MET HA 4.260 . 4.260 3.022 2.891 3.279 . 0 0 "[ . 1 . 2]" 1
995 1 68 TYR HE2 1 117 MET ME 3.410 . 3.410 3.255 3.188 3.310 . 0 0 "[ . 1 . 2]" 1
996 1 68 TYR HE2 1 117 MET HG2 4.150 . 4.150 3.910 3.883 3.946 . 0 0 "[ . 1 . 2]" 1
997 1 68 TYR HE2 1 117 MET HG3 5.080 . 5.080 4.882 4.825 4.939 . 0 0 "[ . 1 . 2]" 1
998 1 69 PRO HA 1 70 ASN H 3.200 . 3.200 2.307 2.194 2.403 . 0 0 "[ . 1 . 2]" 1
999 1 69 PRO HA 1 70 ASN HA 4.580 . 4.580 4.538 4.482 4.581 0.001 12 0 "[ . 1 . 2]" 1
1000 1 69 PRO HA 1 71 GLN H 3.920 . 3.920 3.821 3.715 3.921 0.001 3 0 "[ . 1 . 2]" 1
1001 1 69 PRO HA 1 98 HIS HB3 4.920 . 4.920 4.147 3.925 4.337 . 0 0 "[ . 1 . 2]" 1
1002 1 69 PRO HA 1 124 MET ME 5.100 . 5.100 4.755 4.438 4.926 . 0 0 "[ . 1 . 2]" 1
1003 1 69 PRO HB2 1 70 ASN H 3.910 . 3.910 3.054 2.949 3.157 . 0 0 "[ . 1 . 2]" 1
1004 1 69 PRO HB2 1 71 GLN H 3.610 . 3.610 2.945 2.793 3.138 . 0 0 "[ . 1 . 2]" 1
1005 1 69 PRO HB2 1 95 ILE H 5.470 . 5.470 5.453 5.409 5.473 0.003 1 0 "[ . 1 . 2]" 1
1006 1 69 PRO HB2 1 124 MET ME 3.600 . 3.600 3.178 2.915 3.408 . 0 0 "[ . 1 . 2]" 1
1007 1 69 PRO HB3 1 70 ASN H 4.180 . 4.180 3.708 3.648 3.762 . 0 0 "[ . 1 . 2]" 1
1008 1 69 PRO HB3 1 71 GLN H 4.200 . 4.200 4.173 4.077 4.210 0.010 3 0 "[ . 1 . 2]" 1
1009 1 69 PRO HB3 1 95 ILE H 5.060 . 5.060 5.082 5.066 5.107 0.047 18 0 "[ . 1 . 2]" 1
1010 1 69 PRO HB3 1 95 ILE HG13 4.000 . 4.000 3.758 3.704 3.822 . 0 0 "[ . 1 . 2]" 1
1011 1 69 PRO HD2 1 95 ILE HG12 5.500 . 5.500 5.154 5.038 5.281 . 0 0 "[ . 1 . 2]" 1
1012 1 69 PRO HD2 1 95 ILE HG13 4.280 . 4.280 3.758 3.630 3.912 . 0 0 "[ . 1 . 2]" 1
1013 1 69 PRO HD2 1 120 VAL MG2 4.290 . 4.290 3.113 2.830 3.225 . 0 0 "[ . 1 . 2]" 1
1014 1 69 PRO HD3 1 95 ILE HG12 4.990 . 4.990 4.514 4.349 4.731 . 0 0 "[ . 1 . 2]" 1
1015 1 69 PRO HD3 1 95 ILE HG13 4.140 . 4.140 3.124 2.955 3.336 . 0 0 "[ . 1 . 2]" 1
1016 1 69 PRO HD3 1 120 VAL MG2 4.550 . 4.550 4.472 4.219 4.575 0.025 4 0 "[ . 1 . 2]" 1
1017 1 69 PRO HG2 1 95 ILE HB 4.820 . 4.820 4.824 4.820 4.828 0.008 18 0 "[ . 1 . 2]" 1
1018 1 69 PRO HG2 1 124 MET ME 4.310 . 4.310 3.700 3.328 3.984 . 0 0 "[ . 1 . 2]" 1
1019 1 69 PRO HG3 1 95 ILE HA 4.630 . 4.630 2.745 2.646 2.868 . 0 0 "[ . 1 . 2]" 1
1020 1 69 PRO HG3 1 95 ILE HB 4.040 . 4.040 3.455 3.361 3.565 . 0 0 "[ . 1 . 2]" 1
1021 1 69 PRO HG3 1 95 ILE MD 2.920 . 2.920 2.895 2.810 2.933 0.013 2 0 "[ . 1 . 2]" 1
1022 1 69 PRO HG3 1 95 ILE HG12 4.000 . 4.000 3.874 3.807 3.964 . 0 0 "[ . 1 . 2]" 1
1023 1 69 PRO HG3 1 117 MET HA 5.150 . 5.150 5.120 4.996 5.157 0.007 6 0 "[ . 1 . 2]" 1
1024 1 70 ASN H 1 70 ASN HD21 5.290 . 5.290 4.527 4.118 4.811 . 0 0 "[ . 1 . 2]" 1
1025 1 70 ASN H 1 70 ASN QD 4.510 . 4.510 4.013 3.696 4.242 . 0 0 "[ . 1 . 2]" 1
1026 1 70 ASN H 1 70 ASN HD22 5.290 . 5.290 4.484 4.182 4.718 . 0 0 "[ . 1 . 2]" 1
1027 1 70 ASN H 1 71 GLN H 3.040 . 3.040 1.957 1.799 2.144 . 0 0 "[ . 1 . 2]" 1
1028 1 70 ASN H 1 71 GLN HA 4.910 . 4.910 4.476 4.303 4.663 . 0 0 "[ . 1 . 2]" 1
1029 1 70 ASN H 1 71 GLN HB2 4.390 . 4.390 3.325 3.043 3.653 . 0 0 "[ . 1 . 2]" 1
1030 1 70 ASN H 1 71 GLN HG2 5.500 . 5.500 5.521 5.499 5.566 0.066 18 0 "[ . 1 . 2]" 1
1031 1 70 ASN H 1 72 VAL QG 5.440 . 5.440 5.386 5.257 5.476 0.036 8 0 "[ . 1 . 2]" 1
1032 1 70 ASN H 1 120 VAL MG2 5.500 . 5.500 5.560 5.522 5.599 0.099 8 0 "[ . 1 . 2]" 1
1033 1 70 ASN H 1 124 MET ME 4.840 . 4.840 3.618 3.400 3.837 . 0 0 "[ . 1 . 2]" 1
1034 1 70 ASN HA 1 124 MET ME 3.140 . 3.140 2.530 2.349 2.822 . 0 0 "[ . 1 . 2]" 1
1035 1 70 ASN QD 1 71 GLN HG2 4.340 . 4.340 4.350 4.319 4.372 0.032 18 0 "[ . 1 . 2]" 1
1036 1 71 GLN H 1 71 GLN HB2 3.680 . 3.680 2.785 2.680 2.960 . 0 0 "[ . 1 . 2]" 1
1037 1 71 GLN H 1 72 VAL H 4.460 . 4.460 4.368 4.327 4.410 . 0 0 "[ . 1 . 2]" 1
1038 1 71 GLN H 1 72 VAL QG 5.440 . 5.440 3.902 3.794 3.992 . 0 0 "[ . 1 . 2]" 1
1039 1 71 GLN H 1 121 VAL HA 5.500 . 5.500 5.474 5.354 5.515 0.015 14 0 "[ . 1 . 2]" 1
1040 1 71 GLN H 1 121 VAL QG 4.610 . 4.610 3.783 3.248 4.013 . 0 0 "[ . 1 . 2]" 1
1041 1 71 GLN H 1 124 MET ME 4.940 . 4.940 2.475 2.171 2.674 . 0 0 "[ . 1 . 2]" 1
1042 1 71 GLN HA 1 72 VAL H 3.260 . 3.260 2.355 2.306 2.417 . 0 0 "[ . 1 . 2]" 1
1043 1 71 GLN HB2 1 71 GLN HG2 3.000 . 3.000 2.803 2.602 2.949 . 0 0 "[ . 1 . 2]" 1
1044 1 71 GLN HB2 1 72 VAL H 4.080 . 4.080 4.066 3.983 4.091 0.011 2 0 "[ . 1 . 2]" 1
1045 1 71 GLN HB3 1 72 VAL H 4.100 . 4.100 2.869 2.824 2.925 . 0 0 "[ . 1 . 2]" 1
1046 1 71 GLN HB3 1 73 TYR HD1 5.230 . 5.230 5.143 4.915 5.250 0.020 6 0 "[ . 1 . 2]" 1
1047 1 71 GLN HG2 1 72 VAL H 4.250 . 4.250 2.826 2.469 3.114 . 0 0 "[ . 1 . 2]" 1
1048 1 71 GLN HG2 1 72 VAL HA 5.500 . 5.500 5.377 5.110 5.563 0.063 6 0 "[ . 1 . 2]" 1
1049 1 72 VAL H 1 72 VAL MG1 4.080 . 4.080 3.259 3.139 3.481 . 0 0 "[ . 1 . 2]" 1
1050 1 72 VAL H 1 72 VAL QG 3.280 . 3.280 2.250 2.195 2.300 . 0 0 "[ . 1 . 2]" 1
1051 1 72 VAL H 1 72 VAL MG2 4.080 . 4.080 2.295 2.219 2.350 . 0 0 "[ . 1 . 2]" 1
1052 1 72 VAL H 1 124 MET ME 4.050 . 4.050 4.019 3.820 4.116 0.066 8 0 "[ . 1 . 2]" 1
1053 1 72 VAL HA 1 72 VAL MG1 3.340 . 3.340 2.277 2.243 2.315 . 0 0 "[ . 1 . 2]" 1
1054 1 72 VAL HA 1 72 VAL QG 2.900 . 2.900 2.233 2.202 2.266 . 0 0 "[ . 1 . 2]" 1
1055 1 72 VAL HA 1 72 VAL MG2 3.340 . 3.340 3.231 3.195 3.255 . 0 0 "[ . 1 . 2]" 1
1056 1 72 VAL HA 1 73 TYR HA 5.090 . 5.090 4.373 4.328 4.404 . 0 0 "[ . 1 . 2]" 1
1057 1 72 VAL HA 1 73 TYR HD1 4.020 . 4.020 3.240 3.189 3.288 . 0 0 "[ . 1 . 2]" 1
1058 1 72 VAL HA 1 73 TYR HE1 5.040 . 5.040 5.043 4.991 5.055 0.015 18 0 "[ . 1 . 2]" 1
1059 1 72 VAL HA 1 94 THR H 4.980 . 4.980 4.619 4.483 4.740 . 0 0 "[ . 1 . 2]" 1
1060 1 72 VAL HA 1 94 THR MG 3.420 . 3.420 2.297 2.111 2.430 . 0 0 "[ . 1 . 2]" 1
1061 1 72 VAL HA 1 121 VAL QG 4.180 . 4.180 3.600 3.491 3.758 . 0 0 "[ . 1 . 2]" 1
1062 1 72 VAL HA 1 124 MET ME 4.120 . 4.120 4.105 4.003 4.139 0.019 13 0 "[ . 1 . 2]" 1
1063 1 72 VAL HB 1 73 TYR H 4.770 . 4.770 2.553 2.440 2.706 . 0 0 "[ . 1 . 2]" 1
1064 1 72 VAL HB 1 91 VAL HA 5.500 . 5.500 4.781 4.105 5.076 . 0 0 "[ . 1 . 2]" 1
1065 1 72 VAL HB 1 94 THR HB 4.950 . 4.950 4.337 4.146 4.521 . 0 0 "[ . 1 . 2]" 1
1066 1 72 VAL HB 1 94 THR MG 3.790 . 3.790 3.743 3.444 3.854 0.064 18 0 "[ . 1 . 2]" 1
1067 1 72 VAL QG 1 73 TYR H 3.630 . 3.630 3.197 3.157 3.219 . 0 0 "[ . 1 . 2]" 1
1068 1 72 VAL QG 1 73 TYR HA 4.570 . 4.570 4.242 4.143 4.470 . 0 0 "[ . 1 . 2]" 1
1069 1 72 VAL QG 1 91 VAL HA 3.320 . 3.320 3.199 2.836 3.384 0.064 14 0 "[ . 1 . 2]" 1
1070 1 72 VAL QG 1 94 THR H 4.980 . 4.980 4.705 4.588 4.769 . 0 0 "[ . 1 . 2]" 1
1071 1 72 VAL QG 1 94 THR HB 3.540 . 3.540 3.576 3.507 3.665 0.125 10 0 "[ . 1 . 2]" 1
1072 1 72 VAL QG 1 94 THR MG 4.330 . 4.330 2.138 2.008 2.220 . 0 0 "[ . 1 . 2]" 1
1073 1 72 VAL QG 1 121 VAL QG 2.510 . 2.510 2.013 1.937 2.225 . 0 0 "[ . 1 . 2]" 1
1074 1 72 VAL QG 1 124 MET H 4.720 . 4.720 4.041 3.826 4.254 . 0 0 "[ . 1 . 2]" 1
1075 1 72 VAL QG 1 124 MET ME 2.500 . 2.500 2.111 1.971 2.185 . 0 0 "[ . 1 . 2]" 1
1076 1 72 VAL QG 1 124 MET HG3 4.180 . 4.180 4.068 3.945 4.185 0.005 4 0 "[ . 1 . 2]" 1
1077 1 72 VAL QG 1 125 CYS H 3.510 . 3.510 2.739 2.469 2.904 . 0 0 "[ . 1 . 2]" 1
1078 1 72 VAL QG 1 125 CYS HA 2.820 . 2.820 2.306 2.016 2.582 . 0 0 "[ . 1 . 2]" 1
1079 1 72 VAL QG 1 125 CYS QB 3.730 . 3.730 2.274 2.088 3.447 . 0 0 "[ . 1 . 2]" 1
1080 1 72 VAL QG 1 128 GLN H 4.460 . 4.460 3.946 3.821 4.065 . 0 0 "[ . 1 . 2]" 1
1081 1 72 VAL QG 1 128 GLN HB2 3.810 . 3.810 3.340 2.926 3.693 . 0 0 "[ . 1 . 2]" 1
1082 1 72 VAL QG 1 128 GLN QG 3.460 . 3.460 2.254 1.985 3.284 . 0 0 "[ . 1 . 2]" 1
1083 1 72 VAL MG1 1 73 TYR H 4.290 . 4.290 3.462 3.306 3.517 . 0 0 "[ . 1 . 2]" 1
1084 1 72 VAL MG1 1 73 TYR HA 5.500 . 5.500 5.514 5.459 5.534 0.034 19 0 "[ . 1 . 2]" 1
1085 1 72 VAL MG1 1 124 MET ME 3.580 . 3.580 2.132 1.991 2.230 . 0 0 "[ . 1 . 2]" 1
1086 1 72 VAL MG1 1 125 CYS H 4.410 . 4.410 2.790 2.514 2.966 . 0 0 "[ . 1 . 2]" 1
1087 1 72 VAL MG1 1 125 CYS HA 3.610 . 3.610 2.774 2.633 2.973 . 0 0 "[ . 1 . 2]" 1
1088 1 72 VAL MG2 1 73 TYR H 4.290 . 4.290 3.766 3.645 4.000 . 0 0 "[ . 1 . 2]" 1
1089 1 72 VAL MG2 1 73 TYR HA 5.500 . 5.500 4.412 4.282 4.745 . 0 0 "[ . 1 . 2]" 1
1090 1 72 VAL MG2 1 124 MET ME 3.580 . 3.580 3.446 3.010 3.631 0.051 14 0 "[ . 1 . 2]" 1
1091 1 72 VAL MG2 1 125 CYS H 4.410 . 4.410 3.988 3.606 4.207 . 0 0 "[ . 1 . 2]" 1
1092 1 72 VAL MG2 1 125 CYS HA 3.610 . 3.610 2.484 2.054 2.835 . 0 0 "[ . 1 . 2]" 1
1093 1 73 TYR H 1 73 TYR HB2 3.530 . 3.530 2.221 2.188 2.255 . 0 0 "[ . 1 . 2]" 1
1094 1 73 TYR H 1 73 TYR HD1 4.160 . 4.160 2.341 2.226 2.420 . 0 0 "[ . 1 . 2]" 1
1095 1 73 TYR H 1 93 ILE HB 4.670 . 4.670 4.627 4.543 4.680 0.010 2 0 "[ . 1 . 2]" 1
1096 1 73 TYR H 1 93 ILE MG 4.790 . 4.790 4.802 4.788 4.840 0.050 18 0 "[ . 1 . 2]" 1
1097 1 73 TYR H 1 94 THR H 4.200 . 4.200 4.179 4.040 4.204 0.004 12 0 "[ . 1 . 2]" 1
1098 1 73 TYR H 1 94 THR HB 4.220 . 4.220 2.710 2.621 2.883 . 0 0 "[ . 1 . 2]" 1
1099 1 73 TYR H 1 94 THR MG 3.950 . 3.950 3.448 3.083 3.622 . 0 0 "[ . 1 . 2]" 1
1100 1 73 TYR HA 1 73 TYR HD1 4.260 . 4.260 3.412 3.203 3.520 . 0 0 "[ . 1 . 2]" 1
1101 1 73 TYR HA 1 73 TYR HD2 4.120 . 4.120 3.483 3.331 3.674 . 0 0 "[ . 1 . 2]" 1
1102 1 73 TYR HA 1 74 TYR H 3.470 . 3.470 2.719 2.653 2.812 . 0 0 "[ . 1 . 2]" 1
1103 1 73 TYR HA 1 74 TYR HB3 4.990 . 4.990 4.971 4.915 4.997 0.007 17 0 "[ . 1 . 2]" 1
1104 1 73 TYR HA 1 93 ILE MG 5.500 . 5.500 5.173 5.116 5.234 . 0 0 "[ . 1 . 2]" 1
1105 1 73 TYR HB2 1 93 ILE HB 4.430 . 4.430 3.263 3.131 3.383 . 0 0 "[ . 1 . 2]" 1
1106 1 73 TYR HB2 1 93 ILE MG 3.880 . 3.880 3.631 3.565 3.720 . 0 0 "[ . 1 . 2]" 1
1107 1 73 TYR HB2 1 94 THR H 4.690 . 4.690 4.298 4.205 4.372 . 0 0 "[ . 1 . 2]" 1
1108 1 73 TYR HB2 1 94 THR HA 5.500 . 5.500 5.307 5.221 5.392 . 0 0 "[ . 1 . 2]" 1
1109 1 73 TYR HB2 1 94 THR MG 5.210 . 5.210 4.641 4.169 4.881 . 0 0 "[ . 1 . 2]" 1
1110 1 73 TYR HB3 1 74 TYR H 3.680 . 3.680 1.989 1.850 2.104 . 0 0 "[ . 1 . 2]" 1
1111 1 73 TYR HB3 1 74 TYR HD2 4.080 . 4.080 4.014 3.925 4.087 0.007 14 0 "[ . 1 . 2]" 1
1112 1 73 TYR HB3 1 74 TYR HE2 4.650 . 4.650 4.657 4.650 4.670 0.020 12 0 "[ . 1 . 2]" 1
1113 1 73 TYR HD1 1 93 ILE HB 4.240 . 4.240 3.792 3.610 4.038 . 0 0 "[ . 1 . 2]" 1
1114 1 73 TYR HD1 1 94 THR HA 3.460 . 3.460 2.925 2.842 3.012 . 0 0 "[ . 1 . 2]" 1
1115 1 73 TYR HD1 1 94 THR HB 3.990 . 3.990 1.863 1.797 1.939 . 0 0 "[ . 1 . 2]" 1
1116 1 73 TYR HD2 1 74 TYR H 3.850 . 3.850 3.428 3.317 3.514 . 0 0 "[ . 1 . 2]" 1
1117 1 73 TYR HE1 1 93 ILE HB 5.260 . 5.260 4.834 4.696 5.010 . 0 0 "[ . 1 . 2]" 1
1118 1 73 TYR HE1 1 93 ILE MG 3.990 . 3.990 3.028 2.879 3.187 . 0 0 "[ . 1 . 2]" 1
1119 1 73 TYR HE1 1 94 THR HA 3.560 . 3.560 2.001 1.947 2.059 . 0 0 "[ . 1 . 2]" 1
1120 1 73 TYR HE1 1 94 THR HB 4.140 . 4.140 3.242 2.999 3.459 . 0 0 "[ . 1 . 2]" 1
1121 1 73 TYR HE1 1 97 GLN HB2 3.560 . 3.560 3.324 3.203 3.450 . 0 0 "[ . 1 . 2]" 1
1122 1 73 TYR HE1 1 97 GLN HG2 3.880 . 3.880 3.489 3.107 3.742 . 0 0 "[ . 1 . 2]" 1
1123 1 74 TYR HA 1 74 TYR HD1 4.670 . 4.670 4.129 4.094 4.164 . 0 0 "[ . 1 . 2]" 1
1124 1 74 TYR HA 1 74 TYR HD2 5.130 . 5.130 4.347 4.310 4.377 . 0 0 "[ . 1 . 2]" 1
1125 1 74 TYR HB2 1 76 PRO HD2 5.340 . 5.340 5.363 5.347 5.386 0.046 12 0 "[ . 1 . 2]" 1
1126 1 74 TYR HB2 1 76 PRO HD3 4.540 . 4.540 4.311 4.212 4.401 . 0 0 "[ . 1 . 2]" 1
1127 1 74 TYR HD1 1 76 PRO HA 3.770 . 3.770 3.457 3.363 3.633 . 0 0 "[ . 1 . 2]" 1
1128 1 74 TYR HD1 1 76 PRO HB3 4.020 . 4.020 3.237 3.024 3.377 . 0 0 "[ . 1 . 2]" 1
1129 1 74 TYR HD1 1 76 PRO HD3 4.090 . 4.090 2.023 1.972 2.118 . 0 0 "[ . 1 . 2]" 1
1130 1 74 TYR HD1 1 76 PRO HG3 4.480 . 4.480 4.033 3.888 4.184 . 0 0 "[ . 1 . 2]" 1
1131 1 74 TYR HE1 1 76 PRO HA 3.870 . 3.870 3.690 3.389 3.874 0.004 6 0 "[ . 1 . 2]" 1
1132 1 74 TYR HE1 1 76 PRO HB3 3.800 . 3.800 2.088 2.010 2.183 . 0 0 "[ . 1 . 2]" 1
1133 1 74 TYR HE1 1 76 PRO HD3 4.730 . 4.730 2.849 2.712 2.983 . 0 0 "[ . 1 . 2]" 1
1134 1 74 TYR HE1 1 76 PRO HG2 4.580 . 4.580 4.591 4.583 4.608 0.028 14 0 "[ . 1 . 2]" 1
1135 1 74 TYR HE1 1 76 PRO HG3 4.190 . 4.190 3.324 3.243 3.449 . 0 0 "[ . 1 . 2]" 1
1136 1 76 PRO HA 1 77 MET H 3.150 . 3.150 2.699 2.506 2.914 . 0 0 "[ . 1 . 2]" 1
1137 1 76 PRO HA 1 86 PHE HD1 4.730 . 4.730 4.404 4.283 4.515 . 0 0 "[ . 1 . 2]" 1
1138 1 76 PRO HB2 1 86 PHE HE1 5.290 . 5.290 5.180 4.939 5.299 0.009 7 0 "[ . 1 . 2]" 1
1139 1 76 PRO HD3 1 77 MET H 5.210 . 5.210 4.891 4.669 5.026 . 0 0 "[ . 1 . 2]" 1
1140 1 76 PRO HD3 1 86 PHE HD1 5.120 . 5.120 4.480 4.297 4.702 . 0 0 "[ . 1 . 2]" 1
1141 1 76 PRO HD3 1 90 CYS HB2 4.230 . 4.230 3.461 3.241 3.726 . 0 0 "[ . 1 . 2]" 1
1142 1 76 PRO HG2 1 86 PHE HE1 4.040 . 4.040 3.594 3.372 3.885 . 0 0 "[ . 1 . 2]" 1
1143 1 76 PRO HG3 1 90 CYS HB3 4.940 . 4.940 4.936 4.828 4.957 0.017 14 0 "[ . 1 . 2]" 1
1144 1 77 MET H 1 77 MET HB2 3.870 . 3.870 3.562 2.575 3.695 . 0 0 "[ . 1 . 2]" 1
1145 1 77 MET HA 1 86 PHE HD1 4.360 . 4.360 2.945 2.631 3.371 . 0 0 "[ . 1 . 2]" 1
1146 1 77 MET HA 1 86 PHE HE1 5.090 . 5.090 4.105 3.757 4.630 . 0 0 "[ . 1 . 2]" 1
1147 1 77 MET HB2 1 77 MET ME 2.740 . 2.740 2.413 2.149 2.887 0.147 7 0 "[ . 1 . 2]" 1
1148 1 77 MET HB2 1 86 PHE HB2 5.420 . 5.420 4.900 4.174 5.264 . 0 0 "[ . 1 . 2]" 1
1149 1 77 MET HB2 1 86 PHE HB3 5.500 . 5.500 5.230 4.454 5.510 0.010 6 0 "[ . 1 . 2]" 1
1150 1 77 MET HB2 1 86 PHE HD1 5.050 . 5.050 4.846 3.041 5.056 0.006 15 0 "[ . 1 . 2]" 1
1151 1 77 MET HB2 1 129 TYR HD1 5.180 . 5.180 4.326 3.610 5.138 . 0 0 "[ . 1 . 2]" 1
1152 1 77 MET HB2 1 129 TYR HE1 4.270 . 4.270 3.278 2.554 4.162 . 0 0 "[ . 1 . 2]" 1
1153 1 77 MET HB3 1 77 MET ME 3.450 . 3.450 3.118 2.107 3.455 0.005 18 0 "[ . 1 . 2]" 1
1154 1 77 MET HB3 1 86 PHE HB2 4.980 . 4.980 4.336 3.736 5.079 0.099 7 0 "[ . 1 . 2]" 1
1155 1 77 MET HB3 1 86 PHE HB3 5.500 . 5.500 4.695 4.199 5.354 . 0 0 "[ . 1 . 2]" 1
1156 1 77 MET HB3 1 86 PHE HD1 4.600 . 4.600 3.685 3.193 4.349 . 0 0 "[ . 1 . 2]" 1
1157 1 77 MET HB3 1 86 PHE HE1 3.870 . 3.870 3.364 2.992 4.026 0.156 7 0 "[ . 1 . 2]" 1
1158 1 77 MET HB3 1 86 PHE HZ 5.040 . 5.040 3.457 3.142 4.661 . 0 0 "[ . 1 . 2]" 1
1159 1 77 MET ME 1 77 MET QG 2.700 . 2.700 2.402 2.239 2.558 . 0 0 "[ . 1 . 2]" 1
1160 1 77 MET ME 1 129 TYR HD1 3.370 . 3.370 3.020 2.392 3.406 0.036 12 0 "[ . 1 . 2]" 1
1161 1 77 MET ME 1 129 TYR HE1 2.550 . 2.550 2.154 1.923 2.383 . 0 0 "[ . 1 . 2]" 1
1162 1 77 MET ME 1 133 SER HA 2.530 . 2.530 2.199 1.966 2.567 0.037 15 0 "[ . 1 . 2]" 1
1163 1 77 MET ME 1 133 SER HB2 3.160 . 3.160 3.176 2.823 3.220 0.060 14 0 "[ . 1 . 2]" 1
1164 1 77 MET ME 1 133 SER HB3 3.840 . 3.840 3.254 2.941 3.842 0.002 6 0 "[ . 1 . 2]" 1
1165 1 77 MET ME 1 136 TYR HB2 4.800 . 4.800 4.624 4.387 4.810 0.010 6 0 "[ . 1 . 2]" 1
1166 1 77 MET ME 1 136 TYR HB3 3.500 . 3.500 3.417 3.167 3.532 0.032 12 0 "[ . 1 . 2]" 1
1167 1 77 MET ME 1 136 TYR HD2 3.840 . 3.840 2.066 2.004 2.139 . 0 0 "[ . 1 . 2]" 1
1168 1 77 MET ME 1 136 TYR HE2 3.120 . 3.120 2.640 2.393 3.080 . 0 0 "[ . 1 . 2]" 1
1169 1 77 MET ME 1 137 TYR H 5.500 . 5.500 5.435 5.228 5.518 0.018 15 0 "[ . 1 . 2]" 1
1170 1 77 MET QG 1 86 PHE HD1 4.820 . 4.820 4.410 3.719 4.836 0.016 6 0 "[ . 1 . 2]" 1
1171 1 77 MET QG 1 86 PHE HE1 4.260 . 4.260 3.496 3.037 4.025 . 0 0 "[ . 1 . 2]" 1
1172 1 77 MET QG 1 86 PHE HZ 5.340 . 5.340 3.861 3.450 4.287 . 0 0 "[ . 1 . 2]" 1
1173 1 77 MET HG2 1 86 PHE HD1 5.500 . 5.500 4.804 4.072 5.510 0.010 15 0 "[ . 1 . 2]" 1
1174 1 77 MET HG2 1 86 PHE HE1 4.890 . 4.890 3.717 3.074 4.924 0.034 7 0 "[ . 1 . 2]" 1
1175 1 77 MET HG3 1 86 PHE HD1 5.500 . 5.500 5.336 4.298 5.515 0.015 19 0 "[ . 1 . 2]" 1
1176 1 77 MET HG3 1 86 PHE HE1 4.890 . 4.890 4.689 3.740 4.901 0.011 12 0 "[ . 1 . 2]" 1
1177 1 79 GLU H 1 79 GLU QB 3.430 . 3.430 2.379 2.172 2.684 . 0 0 "[ . 1 . 2]" 1
1178 1 83 GLN H 1 83 GLN QB 3.480 . 3.480 2.430 2.065 2.766 . 0 0 "[ . 1 . 2]" 1
1179 1 83 GLN H 1 83 GLN QG 4.450 . 4.450 3.058 2.036 4.034 . 0 0 "[ . 1 . 2]" 1
1180 1 83 GLN H 1 84 ASN H 3.310 . 3.310 2.585 2.397 2.723 . 0 0 "[ . 1 . 2]" 1
1181 1 83 GLN H 1 84 ASN HA 5.120 . 5.120 5.141 5.104 5.177 0.057 18 0 "[ . 1 . 2]" 1
1182 1 83 GLN H 1 84 ASN HB3 4.510 . 4.510 4.374 4.233 4.509 . 0 0 "[ . 1 . 2]" 1
1183 1 83 GLN H 1 84 ASN HD21 5.500 . 5.500 5.517 5.499 5.538 0.038 3 0 "[ . 1 . 2]" 1
1184 1 83 GLN HA 1 83 GLN QE 4.620 . 4.620 4.610 4.467 4.689 0.069 14 0 "[ . 1 . 2]" 1
1185 1 83 GLN HA 1 85 ASN HD21 5.500 . 5.500 5.413 4.788 5.546 0.046 18 0 "[ . 1 . 2]" 1
1186 1 83 GLN HA 1 86 PHE HB3 2.900 . 2.900 2.499 2.117 2.917 0.017 12 0 "[ . 1 . 2]" 1
1187 1 83 GLN HA 1 86 PHE HD2 5.060 . 5.060 3.221 2.096 4.075 . 0 0 "[ . 1 . 2]" 1
1188 1 83 GLN QB 1 84 ASN H 4.120 . 4.120 3.358 2.296 3.738 . 0 0 "[ . 1 . 2]" 1
1189 1 83 GLN QB 1 84 ASN HB2 5.340 . 5.340 5.097 4.241 5.396 0.056 8 0 "[ . 1 . 2]" 1
1190 1 83 GLN HB2 1 84 ASN H 4.750 . 4.750 4.023 3.754 4.198 . 0 0 "[ . 1 . 2]" 1
1191 1 83 GLN HB3 1 84 ASN H 4.750 . 4.750 3.718 2.316 4.265 . 0 0 "[ . 1 . 2]" 1
1192 1 83 GLN QE 1 84 ASN HA 4.690 . 4.690 4.049 3.221 4.699 0.009 1 0 "[ . 1 . 2]" 1
1193 1 83 GLN QE 1 84 ASN HB2 4.770 . 4.770 3.806 2.397 4.786 0.016 19 0 "[ . 1 . 2]" 1
1194 1 83 GLN QG 1 84 ASN H 4.010 . 4.010 2.947 2.269 3.531 . 0 0 "[ . 1 . 2]" 1
1195 1 83 GLN QG 1 84 ASN HB2 4.390 . 4.390 3.799 3.188 4.385 . 0 0 "[ . 1 . 2]" 1
1196 1 83 GLN QG 1 84 ASN HB3 4.530 . 4.530 3.877 3.131 4.546 0.016 15 0 "[ . 1 . 2]" 1
1197 1 84 ASN H 1 84 ASN HB3 2.840 . 2.840 2.075 2.000 2.139 . 0 0 "[ . 1 . 2]" 1
1198 1 84 ASN H 1 84 ASN HD21 4.260 . 4.260 3.429 3.209 3.793 . 0 0 "[ . 1 . 2]" 1
1199 1 84 ASN H 1 84 ASN HD22 5.500 . 5.500 4.938 4.714 5.225 . 0 0 "[ . 1 . 2]" 1
1200 1 84 ASN H 1 85 ASN H 3.320 . 3.320 2.468 2.286 2.955 . 0 0 "[ . 1 . 2]" 1
1201 1 84 ASN H 1 85 ASN HD21 5.060 . 5.060 4.359 3.009 5.075 0.015 4 0 "[ . 1 . 2]" 1
1202 1 84 ASN H 1 86 PHE HB3 4.700 . 4.700 4.635 4.343 4.754 0.054 7 0 "[ . 1 . 2]" 1
1203 1 84 ASN HA 1 84 ASN HB2 2.580 . 2.580 2.242 2.197 2.318 . 0 0 "[ . 1 . 2]" 1
1204 1 84 ASN HA 1 84 ASN HD21 4.420 . 4.420 4.289 4.166 4.416 . 0 0 "[ . 1 . 2]" 1
1205 1 84 ASN HA 1 84 ASN HD22 5.010 . 5.010 4.946 4.783 5.034 0.024 12 0 "[ . 1 . 2]" 1
1206 1 84 ASN HA 1 86 PHE HD2 5.340 . 5.340 4.467 4.163 4.988 . 0 0 "[ . 1 . 2]" 1
1207 1 84 ASN HA 1 87 VAL H 5.330 . 5.330 4.167 3.851 4.435 . 0 0 "[ . 1 . 2]" 1
1208 1 84 ASN HB2 1 85 ASN H 4.580 . 4.580 4.220 4.086 4.327 . 0 0 "[ . 1 . 2]" 1
1209 1 84 ASN HB3 1 84 ASN HD21 3.130 . 3.130 2.171 2.112 2.236 . 0 0 "[ . 1 . 2]" 1
1210 1 84 ASN HB3 1 84 ASN HD22 3.690 . 3.690 3.451 3.419 3.478 . 0 0 "[ . 1 . 2]" 1
1211 1 84 ASN HB3 1 85 ASN H 3.250 . 3.250 3.119 2.938 3.251 0.001 19 0 "[ . 1 . 2]" 1
1212 1 84 ASN HD21 1 85 ASN H 4.580 . 4.580 2.832 2.540 3.086 . 0 0 "[ . 1 . 2]" 1
1213 1 84 ASN HD21 1 85 ASN HA 4.980 . 4.980 4.160 3.516 4.665 . 0 0 "[ . 1 . 2]" 1
1214 1 85 ASN H 1 85 ASN QB 3.010 . 3.010 2.505 2.138 2.978 . 0 0 "[ . 1 . 2]" 1
1215 1 85 ASN H 1 85 ASN HD21 4.670 . 4.670 2.667 1.622 3.332 . 0 0 "[ . 1 . 2]" 1
1216 1 85 ASN H 1 85 ASN HD22 5.090 . 5.090 3.830 2.918 4.862 . 0 0 "[ . 1 . 2]" 1
1217 1 85 ASN H 1 87 VAL H 4.820 . 4.820 4.360 4.204 4.578 . 0 0 "[ . 1 . 2]" 1
1218 1 85 ASN H 1 88 HIS HB2 5.500 . 5.500 5.346 4.950 5.505 0.005 8 0 "[ . 1 . 2]" 1
1219 1 85 ASN HA 1 85 ASN HD21 4.220 . 4.220 4.024 3.693 4.238 0.018 2 0 "[ . 1 . 2]" 1
1220 1 85 ASN HA 1 85 ASN HD22 4.910 . 4.910 4.804 4.480 4.940 0.030 12 0 "[ . 1 . 2]" 1
1221 1 85 ASN HA 1 87 VAL MG2 5.280 . 5.280 5.042 4.748 5.312 0.032 15 0 "[ . 1 . 2]" 1
1222 1 85 ASN HA 1 88 HIS H 3.840 . 3.840 2.807 2.643 2.927 . 0 0 "[ . 1 . 2]" 1
1223 1 85 ASN HA 1 88 HIS HA 5.270 . 5.270 4.859 4.545 5.036 . 0 0 "[ . 1 . 2]" 1
1224 1 85 ASN HA 1 88 HIS HB2 2.930 . 2.930 2.458 2.194 2.613 . 0 0 "[ . 1 . 2]" 1
1225 1 85 ASN HA 1 88 HIS HB3 3.620 . 3.620 3.210 2.681 3.622 0.002 8 0 "[ . 1 . 2]" 1
1226 1 85 ASN HA 1 88 HIS HD2 4.500 . 4.500 4.407 4.181 4.526 0.026 1 0 "[ . 1 . 2]" 1
1227 1 85 ASN QB 1 85 ASN HD22 3.530 . 3.530 3.345 3.277 3.410 . 0 0 "[ . 1 . 2]" 1
1228 1 85 ASN QB 1 87 VAL H 5.340 . 5.340 4.982 4.741 5.239 . 0 0 "[ . 1 . 2]" 1
1229 1 85 ASN QB 1 88 HIS HB2 3.880 . 3.880 3.618 3.271 3.891 0.011 14 0 "[ . 1 . 2]" 1
1230 1 85 ASN QB 1 88 HIS HB3 3.950 . 3.950 3.428 2.892 3.961 0.011 14 0 "[ . 1 . 2]" 1
1231 1 85 ASN QB 1 88 HIS HD2 4.920 . 4.920 4.941 4.735 4.975 0.055 19 0 "[ . 1 . 2]" 1
1232 1 86 PHE HD1 1 87 VAL HA 5.140 . 5.140 4.345 3.999 4.516 . 0 0 "[ . 1 . 2]" 1
1233 1 86 PHE HD2 1 87 VAL HA 5.200 . 5.200 4.237 3.883 4.504 . 0 0 "[ . 1 . 2]" 1
1234 1 86 PHE HD2 1 87 VAL MG2 4.000 . 4.000 2.393 2.207 2.533 . 0 0 "[ . 1 . 2]" 1
1235 1 86 PHE HD2 1 126 ILE MD 5.500 . 5.500 5.523 5.466 5.543 0.043 6 0 "[ . 1 . 2]" 1
1236 1 86 PHE HD2 1 129 TYR HB2 5.500 . 5.500 5.319 4.849 5.507 0.007 8 0 "[ . 1 . 2]" 1
1237 1 86 PHE HD2 1 129 TYR HD1 5.500 . 5.500 5.137 4.734 5.307 . 0 0 "[ . 1 . 2]" 1
1238 1 86 PHE HD2 1 129 TYR HD2 5.500 . 5.500 5.489 5.382 5.515 0.015 7 0 "[ . 1 . 2]" 1
1239 1 86 PHE HD2 1 129 TYR HE1 5.500 . 5.500 4.689 4.441 4.846 . 0 0 "[ . 1 . 2]" 1
1240 1 86 PHE HD2 1 129 TYR HE2 5.500 . 5.500 5.087 4.737 5.419 . 0 0 "[ . 1 . 2]" 1
1241 1 86 PHE HE1 1 129 TYR HA 5.500 . 5.500 5.052 4.546 5.475 . 0 0 "[ . 1 . 2]" 1
1242 1 86 PHE HE2 1 129 TYR HA 5.500 . 5.500 4.483 4.011 4.703 . 0 0 "[ . 1 . 2]" 1
1243 1 86 PHE HE2 1 129 TYR HE1 5.500 . 5.500 3.614 3.401 3.787 . 0 0 "[ . 1 . 2]" 1
1244 1 86 PHE HE2 1 129 TYR HE2 5.500 . 5.500 4.005 3.700 4.377 . 0 0 "[ . 1 . 2]" 1
1245 1 86 PHE HZ 1 87 VAL HA 4.600 . 4.600 4.238 4.019 4.356 . 0 0 "[ . 1 . 2]" 1
1246 1 86 PHE HZ 1 87 VAL MG2 3.480 . 3.480 3.473 3.260 3.532 0.052 12 0 "[ . 1 . 2]" 1
1247 1 86 PHE HZ 1 126 ILE HA 5.500 . 5.500 5.268 5.075 5.491 . 0 0 "[ . 1 . 2]" 1
1248 1 86 PHE HZ 1 126 ILE MD 5.500 . 5.500 5.369 5.136 5.507 0.007 9 0 "[ . 1 . 2]" 1
1249 1 86 PHE HZ 1 129 TYR HA 4.590 . 4.590 3.088 2.518 3.398 . 0 0 "[ . 1 . 2]" 1
1250 1 86 PHE HZ 1 129 TYR HB2 4.310 . 4.310 2.283 2.133 2.595 . 0 0 "[ . 1 . 2]" 1
1251 1 86 PHE HZ 1 129 TYR HB3 4.470 . 4.470 3.976 3.806 4.244 . 0 0 "[ . 1 . 2]" 1
1252 1 86 PHE HZ 1 129 TYR HD1 4.900 . 4.900 2.623 2.442 2.737 . 0 0 "[ . 1 . 2]" 1
1253 1 86 PHE HZ 1 129 TYR HE1 4.610 . 4.610 4.388 4.057 4.617 0.007 14 0 "[ . 1 . 2]" 1
1254 1 87 VAL H 1 87 VAL MG2 3.570 . 3.570 2.123 2.059 2.189 . 0 0 "[ . 1 . 2]" 1
1255 1 87 VAL H 1 88 HIS H 3.770 . 3.770 2.657 2.597 2.727 . 0 0 "[ . 1 . 2]" 1
1256 1 87 VAL H 1 88 HIS HA 5.500 . 5.500 5.246 5.208 5.295 . 0 0 "[ . 1 . 2]" 1
1257 1 87 VAL H 1 90 CYS HB3 5.500 . 5.500 5.091 4.968 5.338 . 0 0 "[ . 1 . 2]" 1
1258 1 87 VAL HA 1 87 VAL MG1 2.890 . 2.890 2.384 2.349 2.432 . 0 0 "[ . 1 . 2]" 1
1259 1 87 VAL HA 1 90 CYS H 3.980 . 3.980 3.480 3.403 3.624 . 0 0 "[ . 1 . 2]" 1
1260 1 87 VAL HA 1 90 CYS HB2 4.190 . 4.190 3.919 3.711 4.110 . 0 0 "[ . 1 . 2]" 1
1261 1 87 VAL HA 1 91 VAL H 4.790 . 4.790 4.272 4.189 4.435 . 0 0 "[ . 1 . 2]" 1
1262 1 87 VAL HB 1 88 HIS HB2 4.390 . 4.390 4.106 3.896 4.221 . 0 0 "[ . 1 . 2]" 1
1263 1 87 VAL HB 1 88 HIS HB3 5.500 . 5.500 5.382 5.219 5.506 0.006 15 0 "[ . 1 . 2]" 1
1264 1 87 VAL HB 1 126 ILE MD 3.710 . 3.710 3.633 3.567 3.715 0.005 12 0 "[ . 1 . 2]" 1
1265 1 87 VAL MG1 1 88 HIS H 3.580 . 3.580 3.453 3.385 3.554 . 0 0 "[ . 1 . 2]" 1
1266 1 87 VAL MG1 1 88 HIS HA 3.840 . 3.840 3.445 3.330 3.527 . 0 0 "[ . 1 . 2]" 1
1267 1 87 VAL MG1 1 88 HIS HB2 5.070 . 5.070 4.661 4.547 4.796 . 0 0 "[ . 1 . 2]" 1
1268 1 87 VAL MG1 1 89 ASP H 5.460 . 5.460 5.001 4.903 5.138 . 0 0 "[ . 1 . 2]" 1
1269 1 87 VAL MG1 1 90 CYS H 4.460 . 4.460 4.435 4.380 4.476 0.016 14 0 "[ . 1 . 2]" 1
1270 1 87 VAL MG1 1 90 CYS HB2 4.760 . 4.760 4.801 4.769 4.854 0.094 18 0 "[ . 1 . 2]" 1
1271 1 87 VAL MG1 1 90 CYS HB3 4.400 . 4.400 3.528 3.458 3.588 . 0 0 "[ . 1 . 2]" 1
1272 1 87 VAL MG1 1 91 VAL H 3.890 . 3.890 3.670 3.626 3.744 . 0 0 "[ . 1 . 2]" 1
1273 1 87 VAL MG1 1 122 GLU HG2 2.790 . 2.790 2.645 2.499 2.794 0.004 5 0 "[ . 1 . 2]" 1
1274 1 87 VAL MG1 1 123 GLN H 5.500 . 5.500 5.238 5.171 5.364 . 0 0 "[ . 1 . 2]" 1
1275 1 87 VAL MG1 1 125 CYS H 4.650 . 4.650 4.198 4.128 4.280 . 0 0 "[ . 1 . 2]" 1
1276 1 87 VAL MG1 1 125 CYS HA 4.310 . 4.310 4.349 4.327 4.393 0.083 12 0 "[ . 1 . 2]" 1
1277 1 87 VAL MG1 1 125 CYS HB2 3.500 . 3.500 3.217 2.197 3.333 . 0 0 "[ . 1 . 2]" 1
1278 1 87 VAL MG1 1 125 CYS QB 2.820 . 2.820 2.009 1.978 2.058 . 0 0 "[ . 1 . 2]" 1
1279 1 87 VAL MG1 1 125 CYS HB3 3.500 . 3.500 2.041 1.995 2.263 . 0 0 "[ . 1 . 2]" 1
1280 1 87 VAL MG1 1 126 ILE H 4.000 . 4.000 3.730 3.625 3.834 . 0 0 "[ . 1 . 2]" 1
1281 1 87 VAL MG1 1 126 ILE HB 4.950 . 4.950 4.405 4.317 4.473 . 0 0 "[ . 1 . 2]" 1
1282 1 87 VAL MG1 1 126 ILE MD 2.800 . 2.800 2.032 1.991 2.070 . 0 0 "[ . 1 . 2]" 1
1283 1 87 VAL MG2 1 125 CYS QB 3.870 . 3.870 3.840 3.355 3.895 0.025 6 0 "[ . 1 . 2]" 1
1284 1 87 VAL MG2 1 126 ILE MD 3.010 . 3.010 2.144 2.075 2.222 . 0 0 "[ . 1 . 2]" 1
1285 1 87 VAL MG2 1 129 TYR H 5.310 . 5.310 5.197 4.885 5.314 0.004 17 0 "[ . 1 . 2]" 1
1286 1 87 VAL MG2 1 129 TYR HA 5.330 . 5.330 5.313 4.958 5.394 0.064 15 0 "[ . 1 . 2]" 1
1287 1 87 VAL MG2 1 129 TYR HB2 4.340 . 4.340 3.321 2.981 3.396 . 0 0 "[ . 1 . 2]" 1
1288 1 87 VAL MG2 1 129 TYR HB3 4.720 . 4.720 3.956 3.783 4.071 . 0 0 "[ . 1 . 2]" 1
1289 1 87 VAL MG2 1 129 TYR HD2 3.870 . 3.870 3.561 3.376 3.692 . 0 0 "[ . 1 . 2]" 1
1290 1 87 VAL MG2 1 129 TYR HE2 4.660 . 4.660 4.227 3.925 4.349 . 0 0 "[ . 1 . 2]" 1
1291 1 88 HIS H 1 88 HIS HB2 2.990 . 2.990 2.125 2.073 2.167 . 0 0 "[ . 1 . 2]" 1
1292 1 88 HIS H 1 88 HIS HD2 5.040 . 5.040 4.657 4.488 4.876 . 0 0 "[ . 1 . 2]" 1
1293 1 88 HIS H 1 89 ASP H 3.600 . 3.600 2.933 2.840 3.110 . 0 0 "[ . 1 . 2]" 1
1294 1 88 HIS H 1 90 CYS H 4.490 . 4.490 4.289 4.194 4.369 . 0 0 "[ . 1 . 2]" 1
1295 1 88 HIS H 1 91 VAL MG2 4.620 . 4.620 4.648 4.631 4.692 0.072 14 0 "[ . 1 . 2]" 1
1296 1 88 HIS H 1 122 GLU HG2 5.110 . 5.110 5.063 4.816 5.132 0.022 12 0 "[ . 1 . 2]" 1
1297 1 88 HIS HA 1 88 HIS HB2 2.930 . 2.930 2.644 2.631 2.663 . 0 0 "[ . 1 . 2]" 1
1298 1 88 HIS HA 1 88 HIS HD2 4.450 . 4.450 3.991 3.835 4.288 . 0 0 "[ . 1 . 2]" 1
1299 1 88 HIS HA 1 88 HIS HE1 5.160 . 5.160 4.691 4.588 4.783 . 0 0 "[ . 1 . 2]" 1
1300 1 88 HIS HA 1 89 ASP HA 5.500 . 5.500 4.731 4.648 4.783 . 0 0 "[ . 1 . 2]" 1
1301 1 88 HIS HA 1 91 VAL H 4.330 . 4.330 3.170 3.135 3.201 . 0 0 "[ . 1 . 2]" 1
1302 1 88 HIS HA 1 91 VAL MG1 3.200 . 3.200 2.175 2.067 2.304 . 0 0 "[ . 1 . 2]" 1
1303 1 88 HIS HA 1 91 VAL MG2 3.170 . 3.170 2.204 2.169 2.241 . 0 0 "[ . 1 . 2]" 1
1304 1 88 HIS HB2 1 88 HIS HD2 3.390 . 3.390 2.729 2.678 2.767 . 0 0 "[ . 1 . 2]" 1
1305 1 88 HIS HB2 1 89 ASP H 3.640 . 3.640 3.653 3.643 3.673 0.033 12 0 "[ . 1 . 2]" 1
1306 1 88 HIS HB2 1 91 VAL H 5.500 . 5.500 5.510 5.503 5.519 0.019 8 0 "[ . 1 . 2]" 1
1307 1 88 HIS HB2 1 91 VAL MG1 5.350 . 5.350 4.419 4.325 4.558 . 0 0 "[ . 1 . 2]" 1
1308 1 88 HIS HB2 1 91 VAL MG2 4.600 . 4.600 4.325 4.271 4.379 . 0 0 "[ . 1 . 2]" 1
1309 1 88 HIS HB3 1 88 HIS HD2 3.800 . 3.800 3.661 3.485 3.732 . 0 0 "[ . 1 . 2]" 1
1310 1 88 HIS HB3 1 91 VAL H 5.420 . 5.420 5.263 5.223 5.294 . 0 0 "[ . 1 . 2]" 1
1311 1 88 HIS HB3 1 91 VAL MG1 4.880 . 4.880 4.807 4.716 4.902 0.022 8 0 "[ . 1 . 2]" 1
1312 1 88 HIS HE1 1 91 VAL MG2 5.020 . 5.020 3.317 3.218 3.503 . 0 0 "[ . 1 . 2]" 1
1313 1 88 HIS HE1 1 92 ASN HA 5.500 . 5.500 4.610 4.420 4.733 . 0 0 "[ . 1 . 2]" 1
1314 1 88 HIS HE1 1 92 ASN HB2 4.530 . 4.530 3.783 3.751 3.825 . 0 0 "[ . 1 . 2]" 1
1315 1 88 HIS HE1 1 92 ASN HB3 5.500 . 5.500 5.509 5.502 5.515 0.015 10 0 "[ . 1 . 2]" 1
1316 1 88 HIS HE1 1 95 ILE MD 5.500 . 5.500 5.247 4.977 5.421 . 0 0 "[ . 1 . 2]" 1
1317 1 88 HIS HE1 1 118 GLU HG2 4.680 . 4.680 3.762 3.337 3.937 . 0 0 "[ . 1 . 2]" 1
1318 1 88 HIS HE1 1 118 GLU HG3 4.680 . 4.680 4.688 4.683 4.699 0.019 18 0 "[ . 1 . 2]" 1
1319 1 89 ASP H 1 89 ASP QB 3.210 . 3.210 2.376 2.255 2.458 . 0 0 "[ . 1 . 2]" 1
1320 1 89 ASP H 1 90 CYS H 3.540 . 3.540 2.596 2.544 2.634 . 0 0 "[ . 1 . 2]" 1
1321 1 89 ASP H 1 91 VAL MG1 5.500 . 5.500 4.521 4.427 4.585 . 0 0 "[ . 1 . 2]" 1
1322 1 89 ASP HA 1 89 ASP QB 2.500 . 2.500 2.388 2.360 2.436 . 0 0 "[ . 1 . 2]" 1
1323 1 89 ASP HA 1 91 VAL H 5.090 . 5.090 4.375 4.228 4.494 . 0 0 "[ . 1 . 2]" 1
1324 1 89 ASP HA 1 91 VAL MG2 4.710 . 4.710 4.655 4.513 4.735 0.025 18 0 "[ . 1 . 2]" 1
1325 1 89 ASP HA 1 92 ASN H 4.100 . 4.100 3.254 3.034 3.459 . 0 0 "[ . 1 . 2]" 1
1326 1 89 ASP HA 1 92 ASN HB3 3.070 . 3.070 2.467 2.195 2.693 . 0 0 "[ . 1 . 2]" 1
1327 1 89 ASP HA 1 92 ASN HD21 4.820 . 4.820 3.864 3.529 4.110 . 0 0 "[ . 1 . 2]" 1
1328 1 89 ASP HA 1 93 ILE HG12 4.640 . 4.640 4.137 3.897 4.398 . 0 0 "[ . 1 . 2]" 1
1329 1 89 ASP QB 1 90 CYS H 3.200 . 3.200 2.617 2.527 2.746 . 0 0 "[ . 1 . 2]" 1
1330 1 89 ASP QB 1 90 CYS HB2 4.540 . 4.540 4.509 4.384 4.552 0.012 6 0 "[ . 1 . 2]" 1
1331 1 90 CYS H 1 90 CYS HB2 3.540 . 3.540 2.932 2.718 2.985 . 0 0 "[ . 1 . 2]" 1
1332 1 90 CYS H 1 91 VAL H 3.740 . 3.740 2.640 2.611 2.669 . 0 0 "[ . 1 . 2]" 1
1333 1 90 CYS H 1 91 VAL MG1 3.780 . 3.780 3.835 3.804 3.880 0.100 12 0 "[ . 1 . 2]" 1
1334 1 90 CYS H 1 92 ASN H 4.240 . 4.240 3.936 3.890 3.985 . 0 0 "[ . 1 . 2]" 1
1335 1 90 CYS HA 1 91 VAL MG1 4.740 . 4.740 4.757 4.696 4.797 0.057 19 0 "[ . 1 . 2]" 1
1336 1 90 CYS HA 1 93 ILE HB 4.230 . 4.230 3.647 3.464 3.817 . 0 0 "[ . 1 . 2]" 1
1337 1 90 CYS HA 1 93 ILE HG12 5.250 . 5.250 4.120 3.867 4.364 . 0 0 "[ . 1 . 2]" 1
1338 1 90 CYS HA 1 93 ILE HG13 5.500 . 5.500 4.729 4.535 4.922 . 0 0 "[ . 1 . 2]" 1
1339 1 90 CYS HB2 1 91 VAL H 4.400 . 4.400 4.094 4.043 4.128 . 0 0 "[ . 1 . 2]" 1
1340 1 90 CYS HB2 1 91 VAL MG1 5.480 . 5.480 4.639 4.509 4.700 . 0 0 "[ . 1 . 2]" 1
1341 1 90 CYS HB3 1 91 VAL H 4.380 . 4.380 2.816 2.754 2.856 . 0 0 "[ . 1 . 2]" 1
1342 1 90 CYS HB3 1 91 VAL MG1 4.690 . 4.690 3.399 3.266 3.454 . 0 0 "[ . 1 . 2]" 1
1343 1 90 CYS HB3 1 92 ASN H 4.970 . 4.970 4.982 4.974 4.993 0.023 12 0 "[ . 1 . 2]" 1
1344 1 90 CYS SG 1 125 CYS SG 2.020 . 2.120 2.033 2.030 2.038 . 0 0 "[ . 1 . 2]" 1
1345 1 91 VAL H 1 91 VAL MG1 3.050 . 3.050 1.999 1.925 2.035 . 0 0 "[ . 1 . 2]" 1
1346 1 91 VAL H 1 92 ASN H 3.650 . 3.650 2.526 2.482 2.562 . 0 0 "[ . 1 . 2]" 1
1347 1 91 VAL H 1 92 ASN HB3 4.770 . 4.770 4.732 4.655 4.776 0.006 18 0 "[ . 1 . 2]" 1
1348 1 91 VAL H 1 122 GLU HG2 5.500 . 5.500 5.480 5.391 5.511 0.011 6 0 "[ . 1 . 2]" 1
1349 1 91 VAL HA 1 91 VAL MG1 2.950 . 2.950 2.621 2.584 2.669 . 0 0 "[ . 1 . 2]" 1
1350 1 91 VAL HA 1 94 THR H 4.070 . 4.070 3.586 3.372 3.773 . 0 0 "[ . 1 . 2]" 1
1351 1 91 VAL HA 1 94 THR HB 4.370 . 4.370 4.376 4.370 4.388 0.018 18 0 "[ . 1 . 2]" 1
1352 1 91 VAL HA 1 94 THR MG 4.030 . 4.030 2.244 2.029 2.473 . 0 0 "[ . 1 . 2]" 1
1353 1 91 VAL HA 1 121 VAL QG 2.810 . 2.810 2.181 1.881 2.928 0.118 13 0 "[ . 1 . 2]" 1
1354 1 91 VAL HB 1 121 VAL QG 3.150 . 3.150 2.035 1.765 2.223 . 0 0 "[ . 1 . 2]" 1
1355 1 91 VAL HB 1 122 GLU HA 3.750 . 3.750 3.772 3.756 3.799 0.049 18 0 "[ . 1 . 2]" 1
1356 1 91 VAL MG1 1 118 GLU HB3 5.500 . 5.500 4.636 4.415 5.114 . 0 0 "[ . 1 . 2]" 1
1357 1 91 VAL MG1 1 121 VAL QG 2.830 . 2.830 2.600 2.468 3.030 0.200 9 0 "[ . 1 . 2]" 1
1358 1 91 VAL MG1 1 122 GLU H 4.120 . 4.120 3.287 3.167 3.516 . 0 0 "[ . 1 . 2]" 1
1359 1 91 VAL MG1 1 122 GLU HA 2.590 . 2.590 1.999 1.894 2.072 . 0 0 "[ . 1 . 2]" 1
1360 1 91 VAL MG1 1 122 GLU HG2 3.090 . 3.090 2.440 2.354 2.546 . 0 0 "[ . 1 . 2]" 1
1361 1 91 VAL MG1 1 122 GLU HG3 2.630 . 2.630 2.500 2.346 2.642 0.012 8 0 "[ . 1 . 2]" 1
1362 1 91 VAL MG1 1 125 CYS H 4.920 . 4.920 4.056 3.852 4.174 . 0 0 "[ . 1 . 2]" 1
1363 1 91 VAL MG2 1 92 ASN HB3 4.310 . 4.310 4.186 4.118 4.260 . 0 0 "[ . 1 . 2]" 1
1364 1 91 VAL MG2 1 118 GLU HA 4.290 . 4.290 3.157 3.014 3.435 . 0 0 "[ . 1 . 2]" 1
1365 1 91 VAL MG2 1 118 GLU HB3 4.070 . 4.070 3.040 2.671 3.497 . 0 0 "[ . 1 . 2]" 1
1366 1 91 VAL MG2 1 118 GLU QG 3.260 . 3.260 3.026 2.710 3.275 0.015 6 0 "[ . 1 . 2]" 1
1367 1 92 ASN H 1 92 ASN HB3 3.030 . 3.030 2.441 2.389 2.498 . 0 0 "[ . 1 . 2]" 1
1368 1 92 ASN H 1 92 ASN HD21 4.770 . 4.770 4.448 4.354 4.539 . 0 0 "[ . 1 . 2]" 1
1369 1 92 ASN H 1 93 ILE H 3.730 . 3.730 2.765 2.673 2.824 . 0 0 "[ . 1 . 2]" 1
1370 1 92 ASN HA 1 92 ASN HB2 2.610 . 2.610 2.403 2.380 2.442 . 0 0 "[ . 1 . 2]" 1
1371 1 92 ASN HA 1 92 ASN HD21 4.570 . 4.570 4.163 4.139 4.204 . 0 0 "[ . 1 . 2]" 1
1372 1 92 ASN HA 1 92 ASN HD22 4.790 . 4.790 4.577 4.536 4.620 . 0 0 "[ . 1 . 2]" 1
1373 1 92 ASN HA 1 95 ILE MD 4.620 . 4.620 4.303 4.218 4.444 . 0 0 "[ . 1 . 2]" 1
1374 1 92 ASN HA 1 95 ILE MG 3.600 . 3.600 1.987 1.950 2.036 . 0 0 "[ . 1 . 2]" 1
1375 1 92 ASN HA 1 96 LYS H 4.190 . 4.190 3.754 3.676 3.814 . 0 0 "[ . 1 . 2]" 1
1376 1 92 ASN HA 1 121 VAL QG 5.350 . 5.350 4.768 4.414 4.936 . 0 0 "[ . 1 . 2]" 1
1377 1 92 ASN HB2 1 93 ILE MD 5.340 . 5.340 4.942 4.849 5.011 . 0 0 "[ . 1 . 2]" 1
1378 1 92 ASN HB2 1 95 ILE MG 4.050 . 4.050 3.888 3.762 4.015 . 0 0 "[ . 1 . 2]" 1
1379 1 92 ASN HB3 1 92 ASN HD22 3.580 . 3.580 3.454 3.435 3.467 . 0 0 "[ . 1 . 2]" 1
1380 1 92 ASN HB3 1 93 ILE HB 5.390 . 5.390 4.991 4.880 5.125 . 0 0 "[ . 1 . 2]" 1
1381 1 92 ASN HB3 1 93 ILE MD 4.840 . 4.840 3.676 3.526 3.806 . 0 0 "[ . 1 . 2]" 1
1382 1 92 ASN HB3 1 93 ILE HG12 4.010 . 4.010 3.455 3.262 3.599 . 0 0 "[ . 1 . 2]" 1
1383 1 92 ASN HD21 1 93 ILE H 4.770 . 4.770 3.454 3.267 3.595 . 0 0 "[ . 1 . 2]" 1
1384 1 92 ASN HD21 1 93 ILE MD 3.370 . 3.370 2.201 2.153 2.294 . 0 0 "[ . 1 . 2]" 1
1385 1 92 ASN HD21 1 95 ILE MG 4.980 . 4.980 4.959 4.891 5.012 0.032 12 0 "[ . 1 . 2]" 1
1386 1 92 ASN HD21 1 96 LYS H 5.500 . 5.500 5.515 5.506 5.525 0.025 12 0 "[ . 1 . 2]" 1
1387 1 92 ASN HD21 1 96 LYS HD2 5.090 . 5.090 3.389 3.182 3.529 . 0 0 "[ . 1 . 2]" 1
1388 1 92 ASN HD22 1 93 ILE H 5.460 . 5.460 4.875 4.692 5.009 . 0 0 "[ . 1 . 2]" 1
1389 1 92 ASN HD22 1 93 ILE MD 4.620 . 4.620 2.873 2.689 3.011 . 0 0 "[ . 1 . 2]" 1
1390 1 92 ASN HD22 1 93 ILE HG12 5.420 . 5.420 4.626 4.319 4.828 . 0 0 "[ . 1 . 2]" 1
1391 1 92 ASN HD22 1 95 ILE MG 5.500 . 5.500 4.907 4.820 5.022 . 0 0 "[ . 1 . 2]" 1
1392 1 92 ASN HD22 1 96 LYS HD2 5.040 . 5.040 2.502 2.347 2.681 . 0 0 "[ . 1 . 2]" 1
1393 1 92 ASN HD22 1 96 LYS HE3 4.650 . 4.650 3.735 3.202 4.194 . 0 0 "[ . 1 . 2]" 1
1394 1 93 ILE H 1 93 ILE HB 3.770 . 3.770 2.464 2.425 2.497 . 0 0 "[ . 1 . 2]" 1
1395 1 93 ILE H 1 93 ILE HG12 3.790 . 3.790 2.335 2.240 2.392 . 0 0 "[ . 1 . 2]" 1
1396 1 93 ILE H 1 93 ILE MG 4.050 . 4.050 3.800 3.774 3.824 . 0 0 "[ . 1 . 2]" 1
1397 1 93 ILE H 1 94 THR H 3.590 . 3.590 2.696 2.652 2.742 . 0 0 "[ . 1 . 2]" 1
1398 1 93 ILE HA 1 93 ILE MD 2.780 . 2.780 1.970 1.949 1.987 . 0 0 "[ . 1 . 2]" 1
1399 1 93 ILE HA 1 93 ILE HG12 3.350 . 3.350 3.105 3.067 3.153 . 0 0 "[ . 1 . 2]" 1
1400 1 93 ILE HA 1 93 ILE MG 3.080 . 3.080 2.463 2.452 2.477 . 0 0 "[ . 1 . 2]" 1
1401 1 93 ILE HA 1 94 THR HA 4.740 . 4.740 4.604 4.587 4.618 . 0 0 "[ . 1 . 2]" 1
1402 1 93 ILE HA 1 96 LYS HD2 3.660 . 3.660 3.107 2.981 3.224 . 0 0 "[ . 1 . 2]" 1
1403 1 93 ILE HA 1 96 LYS HE2 5.280 . 5.280 5.285 5.280 5.290 0.010 2 0 "[ . 1 . 2]" 1
1404 1 93 ILE HA 1 96 LYS HE3 5.500 . 5.500 4.982 4.961 5.007 . 0 0 "[ . 1 . 2]" 1
1405 1 93 ILE HA 1 97 GLN H 4.730 . 4.730 4.269 4.160 4.357 . 0 0 "[ . 1 . 2]" 1
1406 1 93 ILE HA 1 97 GLN HE22 4.150 . 4.150 3.620 3.323 3.907 . 0 0 "[ . 1 . 2]" 1
1407 1 93 ILE HB 1 94 THR H 3.820 . 3.820 2.873 2.818 2.929 . 0 0 "[ . 1 . 2]" 1
1408 1 93 ILE HB 1 94 THR HA 4.730 . 4.730 4.536 4.466 4.604 . 0 0 "[ . 1 . 2]" 1
1409 1 93 ILE MD 1 93 ILE MG 2.560 . 2.560 2.154 2.129 2.170 . 0 0 "[ . 1 . 2]" 1
1410 1 93 ILE MD 1 94 THR H 4.790 . 4.790 4.736 4.716 4.755 . 0 0 "[ . 1 . 2]" 1
1411 1 93 ILE MD 1 95 ILE H 5.500 . 5.500 5.558 5.522 5.603 0.103 18 0 "[ . 1 . 2]" 1
1412 1 93 ILE MD 1 96 LYS H 5.150 . 5.150 4.806 4.730 4.850 . 0 0 "[ . 1 . 2]" 1
1413 1 93 ILE MD 1 96 LYS HB2 5.310 . 5.310 5.322 5.308 5.344 0.034 12 0 "[ . 1 . 2]" 1
1414 1 93 ILE MD 1 96 LYS HB3 4.590 . 4.590 4.614 4.594 4.643 0.053 12 0 "[ . 1 . 2]" 1
1415 1 93 ILE MD 1 96 LYS HD2 2.910 . 2.910 2.784 2.653 2.889 . 0 0 "[ . 1 . 2]" 1
1416 1 93 ILE MD 1 96 LYS HE3 3.790 . 3.790 3.772 3.674 3.806 0.016 19 0 "[ . 1 . 2]" 1
1417 1 93 ILE MD 1 96 LYS HG2 3.730 . 3.730 3.519 3.470 3.552 . 0 0 "[ . 1 . 2]" 1
1418 1 93 ILE MD 1 97 GLN HE22 3.750 . 3.750 3.546 3.286 3.757 0.007 11 0 "[ . 1 . 2]" 1
1419 1 93 ILE HG12 1 94 THR H 4.740 . 4.740 4.497 4.425 4.534 . 0 0 "[ . 1 . 2]" 1
1420 1 93 ILE HG13 1 93 ILE MG 2.710 . 2.710 2.297 2.277 2.329 . 0 0 "[ . 1 . 2]" 1
1421 1 93 ILE MG 1 94 THR H 3.590 . 3.590 3.496 3.421 3.532 . 0 0 "[ . 1 . 2]" 1
1422 1 93 ILE MG 1 94 THR HA 3.550 . 3.550 3.386 3.351 3.446 . 0 0 "[ . 1 . 2]" 1
1423 1 93 ILE MG 1 94 THR HB 4.210 . 4.210 4.227 4.186 4.259 0.049 10 0 "[ . 1 . 2]" 1
1424 1 93 ILE MG 1 95 ILE H 5.500 . 5.500 4.998 4.962 5.048 . 0 0 "[ . 1 . 2]" 1
1425 1 93 ILE MG 1 96 LYS HG2 4.710 . 4.710 3.808 3.736 3.877 . 0 0 "[ . 1 . 2]" 1
1426 1 93 ILE MG 1 97 GLN H 4.820 . 4.820 4.578 4.478 4.675 . 0 0 "[ . 1 . 2]" 1
1427 1 93 ILE MG 1 97 GLN HB2 4.130 . 4.130 3.971 3.868 4.086 . 0 0 "[ . 1 . 2]" 1
1428 1 93 ILE MG 1 97 GLN HE21 3.180 . 3.180 2.498 2.368 2.570 . 0 0 "[ . 1 . 2]" 1
1429 1 93 ILE MG 1 97 GLN HG2 4.160 . 4.160 4.135 3.967 4.181 0.021 19 0 "[ . 1 . 2]" 1
1430 1 94 THR H 1 94 THR HB 3.550 . 3.550 2.628 2.477 2.840 . 0 0 "[ . 1 . 2]" 1
1431 1 94 THR H 1 95 ILE H 3.460 . 3.460 2.493 2.456 2.561 . 0 0 "[ . 1 . 2]" 1
1432 1 94 THR H 1 95 ILE MG 4.250 . 4.250 4.281 4.266 4.301 0.051 6 0 "[ . 1 . 2]" 1
1433 1 94 THR H 1 97 GLN HE21 5.070 . 5.070 4.911 4.785 5.025 . 0 0 "[ . 1 . 2]" 1
1434 1 94 THR H 1 121 VAL QG 4.380 . 4.380 4.126 3.984 4.390 0.010 13 0 "[ . 1 . 2]" 1
1435 1 94 THR HA 1 94 THR HB 2.960 . 2.960 2.507 2.417 2.570 . 0 0 "[ . 1 . 2]" 1
1436 1 94 THR HA 1 95 ILE HA 5.230 . 5.230 4.660 4.639 4.674 . 0 0 "[ . 1 . 2]" 1
1437 1 94 THR HA 1 97 GLN H 5.040 . 5.040 3.695 3.552 3.807 . 0 0 "[ . 1 . 2]" 1
1438 1 94 THR HA 1 97 GLN HB2 3.660 . 3.660 2.767 2.540 2.906 . 0 0 "[ . 1 . 2]" 1
1439 1 94 THR HA 1 97 GLN HE21 4.900 . 4.900 3.511 3.348 3.687 . 0 0 "[ . 1 . 2]" 1
1440 1 94 THR HA 1 97 GLN HG2 4.400 . 4.400 4.268 3.942 4.407 0.007 18 0 "[ . 1 . 2]" 1
1441 1 94 THR HA 1 121 VAL QG 5.270 . 5.270 5.009 4.913 5.123 . 0 0 "[ . 1 . 2]" 1
1442 1 94 THR HB 1 95 ILE H 4.180 . 4.180 4.042 3.936 4.184 0.004 10 0 "[ . 1 . 2]" 1
1443 1 94 THR HB 1 121 VAL QG 4.010 . 4.010 3.917 3.801 4.049 0.039 6 0 "[ . 1 . 2]" 1
1444 1 94 THR MG 1 95 ILE H 4.190 . 4.190 2.346 2.226 2.430 . 0 0 "[ . 1 . 2]" 1
1445 1 94 THR MG 1 95 ILE MG 4.170 . 4.170 3.942 3.880 3.996 . 0 0 "[ . 1 . 2]" 1
1446 1 94 THR MG 1 121 VAL QG 2.710 . 2.710 1.869 1.833 1.891 . 0 0 "[ . 1 . 2]" 1
1447 1 94 THR MG 1 124 MET ME 3.520 . 3.520 3.458 3.274 3.610 0.090 13 0 "[ . 1 . 2]" 1
1448 1 95 ILE H 1 95 ILE HB 3.430 . 3.430 2.365 2.322 2.437 . 0 0 "[ . 1 . 2]" 1
1449 1 95 ILE H 1 95 ILE MG 3.230 . 3.230 2.498 2.444 2.535 . 0 0 "[ . 1 . 2]" 1
1450 1 95 ILE H 1 96 LYS H 3.260 . 3.260 2.698 2.647 2.771 . 0 0 "[ . 1 . 2]" 1
1451 1 95 ILE H 1 121 VAL QG 3.870 . 3.870 3.569 3.448 3.651 . 0 0 "[ . 1 . 2]" 1
1452 1 95 ILE HA 1 95 ILE MD 3.470 . 3.470 3.488 3.474 3.523 0.053 6 0 "[ . 1 . 2]" 1
1453 1 95 ILE HA 1 95 ILE MG 3.360 . 3.360 3.235 3.227 3.245 . 0 0 "[ . 1 . 2]" 1
1454 1 95 ILE HA 1 96 LYS HA 5.500 . 5.500 4.672 4.646 4.701 . 0 0 "[ . 1 . 2]" 1
1455 1 95 ILE HA 1 98 HIS H 4.450 . 4.450 3.374 3.304 3.442 . 0 0 "[ . 1 . 2]" 1
1456 1 95 ILE HA 1 98 HIS HB2 4.820 . 4.820 3.638 3.355 3.890 . 0 0 "[ . 1 . 2]" 1
1457 1 95 ILE HA 1 98 HIS HB3 3.980 . 3.980 3.048 2.873 3.218 . 0 0 "[ . 1 . 2]" 1
1458 1 95 ILE HA 1 99 THR H 4.990 . 4.990 3.561 3.507 3.652 . 0 0 "[ . 1 . 2]" 1
1459 1 95 ILE HA 1 99 THR HB 4.690 . 4.690 4.188 4.091 4.289 . 0 0 "[ . 1 . 2]" 1
1460 1 95 ILE HB 1 95 ILE MD 2.700 . 2.700 2.099 2.065 2.167 . 0 0 "[ . 1 . 2]" 1
1461 1 95 ILE HB 1 96 LYS H 4.310 . 4.310 3.856 3.822 3.905 . 0 0 "[ . 1 . 2]" 1
1462 1 95 ILE HB 1 121 VAL QG 3.830 . 3.830 2.680 2.449 2.840 . 0 0 "[ . 1 . 2]" 1
1463 1 95 ILE MD 1 96 LYS H 5.500 . 5.500 4.931 4.900 4.970 . 0 0 "[ . 1 . 2]" 1
1464 1 95 ILE MD 1 98 HIS HB3 5.500 . 5.500 5.159 5.046 5.302 . 0 0 "[ . 1 . 2]" 1
1465 1 95 ILE MD 1 99 THR HB 4.280 . 4.280 3.905 3.823 4.093 . 0 0 "[ . 1 . 2]" 1
1466 1 95 ILE MD 1 117 MET H 4.690 . 4.690 4.472 4.392 4.544 . 0 0 "[ . 1 . 2]" 1
1467 1 95 ILE MD 1 117 MET HA 4.020 . 4.020 3.579 3.500 3.660 . 0 0 "[ . 1 . 2]" 1
1468 1 95 ILE MD 1 117 MET HB2 3.800 . 3.800 2.198 2.109 2.253 . 0 0 "[ . 1 . 2]" 1
1469 1 95 ILE MD 1 117 MET HG3 3.690 . 3.690 2.098 2.034 2.168 . 0 0 "[ . 1 . 2]" 1
1470 1 95 ILE MD 1 118 GLU HA 2.800 . 2.800 2.435 2.268 2.533 . 0 0 "[ . 1 . 2]" 1
1471 1 95 ILE MD 1 118 GLU HB3 4.690 . 4.690 4.230 4.042 4.468 . 0 0 "[ . 1 . 2]" 1
1472 1 95 ILE MD 1 118 GLU QG 3.170 . 3.170 2.433 2.249 2.765 . 0 0 "[ . 1 . 2]" 1
1473 1 95 ILE MD 1 119 ARG H 4.940 . 4.940 4.904 4.784 4.977 0.037 6 0 "[ . 1 . 2]" 1
1474 1 95 ILE MD 1 121 VAL H 4.360 . 4.360 4.203 4.094 4.293 . 0 0 "[ . 1 . 2]" 1
1475 1 95 ILE MD 1 121 VAL QG 3.560 . 3.560 2.268 2.040 2.457 . 0 0 "[ . 1 . 2]" 1
1476 1 95 ILE MD 1 122 GLU H 5.500 . 5.500 5.230 5.130 5.302 . 0 0 "[ . 1 . 2]" 1
1477 1 95 ILE HG12 1 99 THR H 4.850 . 4.850 3.871 3.799 4.028 . 0 0 "[ . 1 . 2]" 1
1478 1 95 ILE HG12 1 99 THR HB 4.020 . 4.020 2.591 2.481 2.735 . 0 0 "[ . 1 . 2]" 1
1479 1 95 ILE HG12 1 99 THR MG 3.270 . 3.270 2.951 2.797 3.117 . 0 0 "[ . 1 . 2]" 1
1480 1 95 ILE HG13 1 98 HIS HB3 4.660 . 4.660 3.776 3.633 3.940 . 0 0 "[ . 1 . 2]" 1
1481 1 95 ILE HG13 1 117 MET HA 5.500 . 5.500 5.441 5.384 5.502 0.002 16 0 "[ . 1 . 2]" 1
1482 1 95 ILE MG 1 96 LYS H 3.270 . 3.270 2.060 2.033 2.098 . 0 0 "[ . 1 . 2]" 1
1483 1 95 ILE MG 1 96 LYS HA 3.140 . 3.140 3.095 3.067 3.135 . 0 0 "[ . 1 . 2]" 1
1484 1 95 ILE MG 1 96 LYS HB3 2.950 . 2.950 2.996 2.964 3.022 0.072 19 0 "[ . 1 . 2]" 1
1485 1 95 ILE MG 1 96 LYS HG2 3.760 . 3.760 3.818 3.785 3.863 0.103 12 0 "[ . 1 . 2]" 1
1486 1 95 ILE MG 1 97 GLN H 4.370 . 4.370 4.176 4.133 4.212 . 0 0 "[ . 1 . 2]" 1
1487 1 95 ILE MG 1 99 THR HB 4.060 . 4.060 3.912 3.802 4.067 0.007 8 0 "[ . 1 . 2]" 1
1488 1 95 ILE MG 1 99 THR MG 3.110 . 3.110 2.956 2.835 3.123 0.013 8 0 "[ . 1 . 2]" 1
1489 1 96 LYS H 1 96 LYS HB3 2.990 . 2.990 2.425 2.402 2.442 . 0 0 "[ . 1 . 2]" 1
1490 1 96 LYS H 1 96 LYS HD2 4.760 . 4.760 3.850 3.661 3.972 . 0 0 "[ . 1 . 2]" 1
1491 1 96 LYS H 1 97 GLN H 3.550 . 3.550 2.546 2.512 2.585 . 0 0 "[ . 1 . 2]" 1
1492 1 96 LYS H 1 97 GLN HE21 5.090 . 5.090 4.639 4.464 4.757 . 0 0 "[ . 1 . 2]" 1
1493 1 96 LYS HA 1 96 LYS HB2 2.860 . 2.860 2.391 2.373 2.407 . 0 0 "[ . 1 . 2]" 1
1494 1 96 LYS HA 1 98 HIS H 4.180 . 4.180 3.621 3.523 3.705 . 0 0 "[ . 1 . 2]" 1
1495 1 96 LYS HA 1 99 THR HB 4.140 . 4.140 4.153 4.143 4.169 0.029 18 0 "[ . 1 . 2]" 1
1496 1 96 LYS HA 1 99 THR MG 3.390 . 3.390 2.027 1.996 2.066 . 0 0 "[ . 1 . 2]" 1
1497 1 96 LYS HA 1 100 VAL H 3.610 . 3.610 3.286 3.096 3.383 . 0 0 "[ . 1 . 2]" 1
1498 1 96 LYS HA 1 100 VAL QG 3.290 . 3.290 2.760 2.603 2.847 . 0 0 "[ . 1 . 2]" 1
1499 1 96 LYS HB2 1 96 LYS HE2 2.790 . 2.790 2.252 2.203 2.300 . 0 0 "[ . 1 . 2]" 1
1500 1 96 LYS HB2 1 100 VAL QG 3.140 . 3.140 3.140 2.965 3.203 0.063 8 0 "[ . 1 . 2]" 1
1501 1 96 LYS HB3 1 96 LYS HD2 3.030 . 3.030 2.438 2.390 2.498 . 0 0 "[ . 1 . 2]" 1
1502 1 96 LYS HB3 1 96 LYS HE2 3.300 . 3.300 3.061 2.776 3.301 0.001 7 0 "[ . 1 . 2]" 1
1503 1 96 LYS HB3 1 96 LYS HG2 2.840 . 2.840 2.481 2.465 2.509 . 0 0 "[ . 1 . 2]" 1
1504 1 96 LYS HD2 1 96 LYS HE3 2.680 . 2.680 2.421 2.375 2.453 . 0 0 "[ . 1 . 2]" 1
1505 1 96 LYS HD2 1 96 LYS HG2 2.950 . 2.950 2.505 2.445 2.560 . 0 0 "[ . 1 . 2]" 1
1506 1 96 LYS HD2 1 97 GLN H 5.440 . 5.440 4.960 4.901 5.019 . 0 0 "[ . 1 . 2]" 1
1507 1 96 LYS HG3 1 97 GLN HE21 4.790 . 4.790 3.451 3.320 3.636 . 0 0 "[ . 1 . 2]" 1
1508 1 96 LYS HG3 1 97 GLN HE22 4.820 . 4.820 2.884 2.617 3.269 . 0 0 "[ . 1 . 2]" 1
1509 1 96 LYS HG3 1 100 VAL QG 4.420 . 4.420 4.495 4.467 4.533 0.113 12 0 "[ . 1 . 2]" 1
1510 1 97 GLN H 1 97 GLN HB2 3.010 . 3.010 2.045 2.012 2.101 . 0 0 "[ . 1 . 2]" 1
1511 1 97 GLN H 1 97 GLN HE21 4.290 . 4.290 3.058 2.913 3.153 . 0 0 "[ . 1 . 2]" 1
1512 1 97 GLN H 1 97 GLN HE22 4.530 . 4.530 3.979 3.844 4.155 . 0 0 "[ . 1 . 2]" 1
1513 1 97 GLN H 1 97 GLN HG3 4.700 . 4.700 4.373 4.325 4.427 . 0 0 "[ . 1 . 2]" 1
1514 1 97 GLN H 1 98 HIS HB3 5.190 . 5.190 4.982 4.873 5.192 0.002 10 0 "[ . 1 . 2]" 1
1515 1 97 GLN H 1 100 VAL QG 5.080 . 5.080 5.068 4.987 5.110 0.030 12 0 "[ . 1 . 2]" 1
1516 1 97 GLN HA 1 97 GLN HE21 3.840 . 3.840 3.811 3.609 3.866 0.026 18 0 "[ . 1 . 2]" 1
1517 1 97 GLN HA 1 97 GLN HE22 4.420 . 4.420 4.155 3.929 4.257 . 0 0 "[ . 1 . 2]" 1
1518 1 97 GLN HA 1 97 GLN HG2 3.650 . 3.650 3.591 3.543 3.624 . 0 0 "[ . 1 . 2]" 1
1519 1 97 GLN HA 1 98 HIS HA 4.770 . 4.770 4.608 4.586 4.634 . 0 0 "[ . 1 . 2]" 1
1520 1 97 GLN HB2 1 97 GLN HE21 3.710 . 3.710 2.178 2.100 2.260 . 0 0 "[ . 1 . 2]" 1
1521 1 97 GLN HE21 1 98 HIS H 5.500 . 5.500 5.372 5.232 5.488 . 0 0 "[ . 1 . 2]" 1
1522 1 97 GLN HE22 1 97 GLN HG2 3.960 . 3.960 3.653 3.599 3.695 . 0 0 "[ . 1 . 2]" 1
1523 1 98 HIS H 1 98 HIS HB2 3.550 . 3.550 2.713 2.540 2.797 . 0 0 "[ . 1 . 2]" 1
1524 1 98 HIS H 1 98 HIS HB3 3.520 . 3.520 2.670 2.571 2.824 . 0 0 "[ . 1 . 2]" 1
1525 1 98 HIS H 1 99 THR MG 4.310 . 4.310 3.657 3.581 3.741 . 0 0 "[ . 1 . 2]" 1
1526 1 98 HIS H 1 100 VAL H 4.060 . 4.060 3.852 3.799 3.915 . 0 0 "[ . 1 . 2]" 1
1527 1 98 HIS H 1 101 THR H 4.470 . 4.470 4.314 4.246 4.381 . 0 0 "[ . 1 . 2]" 1
1528 1 98 HIS HA 1 101 THR H 4.180 . 4.180 3.682 3.508 3.778 . 0 0 "[ . 1 . 2]" 1
1529 1 98 HIS HA 1 101 THR MG 3.590 . 3.590 3.604 3.589 3.621 0.031 8 0 "[ . 1 . 2]" 1
1530 1 98 HIS HA 1 102 THR H 4.690 . 4.690 4.206 4.107 4.287 . 0 0 "[ . 1 . 2]" 1
1531 1 98 HIS HA 1 102 THR MG 5.000 . 5.000 4.670 4.565 4.717 . 0 0 "[ . 1 . 2]" 1
1532 1 98 HIS HB2 1 99 THR H 4.310 . 4.310 3.637 3.496 3.734 . 0 0 "[ . 1 . 2]" 1
1533 1 98 HIS HB3 1 99 THR H 4.160 . 4.160 2.372 2.289 2.501 . 0 0 "[ . 1 . 2]" 1
1534 1 98 HIS HB3 1 99 THR MG 4.770 . 4.770 4.441 4.380 4.549 . 0 0 "[ . 1 . 2]" 1
1535 1 98 HIS HB3 1 101 THR H 5.350 . 5.350 5.367 5.352 5.377 0.027 12 0 "[ . 1 . 2]" 1
1536 1 98 HIS HB3 1 102 THR MG 4.750 . 4.750 4.755 4.639 4.784 0.034 18 0 "[ . 1 . 2]" 1
1537 1 99 THR H 1 99 THR MG 3.700 . 3.700 2.416 2.376 2.473 . 0 0 "[ . 1 . 2]" 1
1538 1 99 THR H 1 100 VAL H 3.660 . 3.660 2.822 2.771 2.861 . 0 0 "[ . 1 . 2]" 1
1539 1 99 THR H 1 100 VAL QG 4.530 . 4.530 4.176 4.133 4.211 . 0 0 "[ . 1 . 2]" 1
1540 1 99 THR H 1 101 THR H 4.820 . 4.820 3.984 3.877 4.061 . 0 0 "[ . 1 . 2]" 1
1541 1 99 THR H 1 102 THR H 5.140 . 5.140 4.812 4.762 4.882 . 0 0 "[ . 1 . 2]" 1
1542 1 99 THR H 1 102 THR MG 4.430 . 4.430 4.470 4.412 4.509 0.079 10 0 "[ . 1 . 2]" 1
1543 1 99 THR H 1 117 MET ME 5.220 . 5.220 5.175 5.098 5.222 0.002 8 0 "[ . 1 . 2]" 1
1544 1 99 THR HA 1 109 PHE HE1 4.450 . 4.450 3.543 3.436 3.610 . 0 0 "[ . 1 . 2]" 1
1545 1 99 THR HA 1 109 PHE HZ 3.590 . 3.590 3.589 3.527 3.618 0.028 19 0 "[ . 1 . 2]" 1
1546 1 99 THR HA 1 117 MET ME 3.810 . 3.810 3.820 3.760 3.848 0.038 6 0 "[ . 1 . 2]" 1
1547 1 99 THR HB 1 100 VAL H 4.020 . 4.020 3.828 3.803 3.845 . 0 0 "[ . 1 . 2]" 1
1548 1 99 THR MG 1 100 VAL H 3.660 . 3.660 1.912 1.854 1.952 . 0 0 "[ . 1 . 2]" 1
1549 1 99 THR MG 1 100 VAL HB 3.640 . 3.640 3.703 3.667 3.730 0.090 18 0 "[ . 1 . 2]" 1
1550 1 99 THR MG 1 101 THR H 4.380 . 4.380 4.042 4.002 4.071 . 0 0 "[ . 1 . 2]" 1
1551 1 100 VAL H 1 100 VAL HB 3.180 . 3.180 2.466 2.442 2.487 . 0 0 "[ . 1 . 2]" 1
1552 1 100 VAL H 1 100 VAL QG 2.910 . 2.910 2.120 2.101 2.144 . 0 0 "[ . 1 . 2]" 1
1553 1 100 VAL HA 1 104 THR H 4.460 . 4.460 3.334 3.253 3.402 . 0 0 "[ . 1 . 2]" 1
1554 1 100 VAL HB 1 101 THR H 4.030 . 4.030 2.617 2.508 2.689 . 0 0 "[ . 1 . 2]" 1
1555 1 100 VAL HB 1 102 THR H 5.500 . 5.500 5.073 4.958 5.139 . 0 0 "[ . 1 . 2]" 1
1556 1 100 VAL QG 1 101 THR H 4.070 . 4.070 3.270 3.227 3.303 . 0 0 "[ . 1 . 2]" 1
1557 1 100 VAL QG 1 104 THR H 4.100 . 4.100 3.544 3.392 3.603 . 0 0 "[ . 1 . 2]" 1
1558 1 100 VAL QG 1 104 THR HA 4.740 . 4.740 4.771 4.666 4.815 0.075 18 0 "[ . 1 . 2]" 1
1559 1 100 VAL QG 1 104 THR HB 3.510 . 3.510 3.539 2.843 3.708 0.198 4 0 "[ . 1 . 2]" 1
1560 1 100 VAL MG1 1 104 THR H 5.090 . 5.090 3.616 3.449 3.683 . 0 0 "[ . 1 . 2]" 1
1561 1 100 VAL MG2 1 104 THR H 5.090 . 5.090 5.105 5.020 5.153 0.063 12 0 "[ . 1 . 2]" 1
1562 1 101 THR H 1 101 THR HB 3.080 . 3.080 2.429 2.395 2.481 . 0 0 "[ . 1 . 2]" 1
1563 1 101 THR H 1 101 THR MG 4.180 . 4.180 3.707 3.685 3.718 . 0 0 "[ . 1 . 2]" 1
1564 1 101 THR H 1 102 THR HA 5.310 . 5.310 5.318 5.314 5.324 0.014 12 0 "[ . 1 . 2]" 1
1565 1 101 THR H 1 102 THR HB 5.310 . 5.310 5.058 4.933 5.148 . 0 0 "[ . 1 . 2]" 1
1566 1 101 THR HA 1 101 THR MG 2.500 . 2.500 2.423 2.382 2.453 . 0 0 "[ . 1 . 2]" 1
1567 1 101 THR HA 1 104 THR H 4.870 . 4.870 4.423 4.348 4.491 . 0 0 "[ . 1 . 2]" 1
1568 1 101 THR HA 1 105 LYS HE3 5.020 . 5.020 4.533 4.305 4.852 . 0 0 "[ . 1 . 2]" 1
1569 1 101 THR HB 1 102 THR H 3.780 . 3.780 2.747 2.641 2.800 . 0 0 "[ . 1 . 2]" 1
1570 1 101 THR HB 1 105 LYS HE3 5.500 . 5.500 5.425 5.282 5.502 0.002 8 0 "[ . 1 . 2]" 1
1571 1 101 THR MG 1 102 THR H 3.490 . 3.490 3.518 3.506 3.552 0.062 12 0 "[ . 1 . 2]" 1
1572 1 101 THR MG 1 102 THR HA 3.450 . 3.450 3.465 3.448 3.491 0.041 18 0 "[ . 1 . 2]" 1
1573 1 101 THR MG 1 105 LYS HE3 3.270 . 3.270 2.984 2.898 3.045 . 0 0 "[ . 1 . 2]" 1
1574 1 102 THR H 1 102 THR HA 2.940 . 2.940 2.918 2.903 2.929 . 0 0 "[ . 1 . 2]" 1
1575 1 102 THR H 1 102 THR HB 3.950 . 3.950 2.601 2.508 2.670 . 0 0 "[ . 1 . 2]" 1
1576 1 102 THR H 1 102 THR MG 3.220 . 3.220 2.284 2.146 2.342 . 0 0 "[ . 1 . 2]" 1
1577 1 102 THR H 1 103 THR H 3.180 . 3.180 2.348 2.317 2.387 . 0 0 "[ . 1 . 2]" 1
1578 1 102 THR H 1 104 THR H 4.360 . 4.360 4.251 4.186 4.334 . 0 0 "[ . 1 . 2]" 1
1579 1 102 THR H 1 105 LYS H 4.670 . 4.670 4.671 4.641 4.686 0.016 18 0 "[ . 1 . 2]" 1
1580 1 102 THR H 1 107 GLU HB3 5.500 . 5.500 5.516 5.505 5.536 0.036 12 0 "[ . 1 . 2]" 1
1581 1 102 THR HA 1 102 THR MG 3.230 . 3.230 3.235 3.229 3.242 0.012 8 0 "[ . 1 . 2]" 1
1582 1 102 THR HA 1 104 THR H 5.110 . 5.110 4.766 4.687 4.872 . 0 0 "[ . 1 . 2]" 1
1583 1 102 THR HA 1 105 LYS HB3 3.830 . 3.830 2.540 2.454 2.632 . 0 0 "[ . 1 . 2]" 1
1584 1 102 THR HA 1 105 LYS HD2 3.470 . 3.470 3.456 3.387 3.472 0.002 20 0 "[ . 1 . 2]" 1
1585 1 102 THR HA 1 105 LYS HE3 4.260 . 4.260 3.602 3.323 3.957 . 0 0 "[ . 1 . 2]" 1
1586 1 102 THR HB 1 109 PHE HE1 5.380 . 5.380 5.129 5.061 5.186 . 0 0 "[ . 1 . 2]" 1
1587 1 102 THR HB 1 109 PHE HZ 4.670 . 4.670 4.655 4.602 4.677 0.007 7 0 "[ . 1 . 2]" 1
1588 1 102 THR MG 1 103 THR H 3.630 . 3.630 2.413 2.342 2.458 . 0 0 "[ . 1 . 2]" 1
1589 1 102 THR MG 1 103 THR HA 3.530 . 3.530 3.337 3.306 3.364 . 0 0 "[ . 1 . 2]" 1
1590 1 102 THR MG 1 107 GLU HB3 2.790 . 2.790 2.562 2.517 2.611 . 0 0 "[ . 1 . 2]" 1
1591 1 102 THR MG 1 108 ASN H 4.580 . 4.580 4.604 4.586 4.631 0.051 18 0 "[ . 1 . 2]" 1
1592 1 102 THR MG 1 109 PHE HE1 4.590 . 4.590 2.230 2.107 2.289 . 0 0 "[ . 1 . 2]" 1
1593 1 102 THR MG 1 109 PHE HZ 3.180 . 3.180 2.113 2.075 2.152 . 0 0 "[ . 1 . 2]" 1
1594 1 103 THR H 1 103 THR HB 3.380 . 3.380 2.552 2.514 2.591 . 0 0 "[ . 1 . 2]" 1
1595 1 103 THR H 1 103 THR MG 3.920 . 3.920 3.764 3.752 3.771 . 0 0 "[ . 1 . 2]" 1
1596 1 103 THR H 1 104 THR H 3.450 . 3.450 2.814 2.766 2.855 . 0 0 "[ . 1 . 2]" 1
1597 1 103 THR H 1 105 LYS H 4.010 . 4.010 3.860 3.810 3.895 . 0 0 "[ . 1 . 2]" 1
1598 1 103 THR H 1 106 GLY H 4.690 . 4.690 4.699 4.692 4.708 0.018 12 0 "[ . 1 . 2]" 1
1599 1 103 THR HA 1 103 THR MG 2.440 . 2.440 2.386 2.354 2.410 . 0 0 "[ . 1 . 2]" 1
1600 1 103 THR HA 1 106 GLY H 3.600 . 3.600 3.379 3.345 3.408 . 0 0 "[ . 1 . 2]" 1
1601 1 103 THR HA 1 107 GLU H 3.140 . 3.140 2.420 2.377 2.504 . 0 0 "[ . 1 . 2]" 1
1602 1 103 THR HA 1 108 ASN HA 3.990 . 3.990 3.977 3.910 3.994 0.004 14 0 "[ . 1 . 2]" 1
1603 1 103 THR HA 1 108 ASN HB2 5.270 . 5.270 5.253 5.187 5.274 0.004 18 0 "[ . 1 . 2]" 1
1604 1 103 THR HA 1 109 PHE HD1 4.970 . 4.970 4.437 4.323 4.544 . 0 0 "[ . 1 . 2]" 1
1605 1 103 THR HB 1 104 THR H 3.070 . 3.070 2.282 2.231 2.362 . 0 0 "[ . 1 . 2]" 1
1606 1 103 THR HB 1 107 GLU HB3 4.890 . 4.890 4.699 4.598 4.780 . 0 0 "[ . 1 . 2]" 1
1607 1 103 THR HB 1 109 PHE HD1 4.920 . 4.920 4.839 4.751 4.920 0.000 6 0 "[ . 1 . 2]" 1
1608 1 103 THR MG 1 104 THR H 3.140 . 3.140 3.188 3.159 3.225 0.085 18 0 "[ . 1 . 2]" 1
1609 1 103 THR MG 1 106 GLY H 4.640 . 4.640 4.565 4.526 4.597 . 0 0 "[ . 1 . 2]" 1
1610 1 103 THR MG 1 107 GLU H 3.630 . 3.630 3.531 3.494 3.570 . 0 0 "[ . 1 . 2]" 1
1611 1 103 THR MG 1 107 GLU HB3 3.820 . 3.820 3.566 3.446 3.625 . 0 0 "[ . 1 . 2]" 1
1612 1 103 THR MG 1 108 ASN H 4.190 . 4.190 4.212 4.198 4.236 0.046 14 0 "[ . 1 . 2]" 1
1613 1 103 THR MG 1 108 ASN HA 3.140 . 3.140 2.503 2.450 2.537 . 0 0 "[ . 1 . 2]" 1
1614 1 103 THR MG 1 108 ASN HB2 3.960 . 3.960 3.633 3.538 3.670 . 0 0 "[ . 1 . 2]" 1
1615 1 103 THR MG 1 108 ASN HB3 4.640 . 4.640 4.626 4.554 4.651 0.011 19 0 "[ . 1 . 2]" 1
1616 1 103 THR MG 1 109 PHE H 4.240 . 4.240 4.069 3.988 4.159 . 0 0 "[ . 1 . 2]" 1
1617 1 103 THR MG 1 109 PHE HD1 3.780 . 3.780 3.454 3.330 3.566 . 0 0 "[ . 1 . 2]" 1
1618 1 104 THR H 1 104 THR HB 3.500 . 3.500 2.823 2.383 3.516 0.016 11 0 "[ . 1 . 2]" 1
1619 1 104 THR H 1 105 LYS H 3.280 . 3.280 2.716 2.637 2.771 . 0 0 "[ . 1 . 2]" 1
1620 1 104 THR H 1 107 GLU HB3 5.500 . 5.500 5.465 5.378 5.505 0.005 2 0 "[ . 1 . 2]" 1
1621 1 105 LYS H 1 105 LYS HB2 3.460 . 3.460 2.566 2.499 2.705 . 0 0 "[ . 1 . 2]" 1
1622 1 105 LYS H 1 105 LYS HE2 5.500 . 5.500 5.413 5.335 5.503 0.003 11 0 "[ . 1 . 2]" 1
1623 1 105 LYS H 1 106 GLY H 2.990 . 2.990 2.389 2.226 2.472 . 0 0 "[ . 1 . 2]" 1
1624 1 105 LYS HA 1 105 LYS HB2 2.790 . 2.790 2.482 2.474 2.492 . 0 0 "[ . 1 . 2]" 1
1625 1 105 LYS HA 1 105 LYS HE2 4.300 . 4.300 4.302 4.252 4.313 0.013 18 0 "[ . 1 . 2]" 1
1626 1 105 LYS HA 1 105 LYS HG2 3.750 . 3.750 3.070 3.039 3.112 . 0 0 "[ . 1 . 2]" 1
1627 1 105 LYS HA 1 105 LYS HG3 2.810 . 2.810 2.532 2.518 2.552 . 0 0 "[ . 1 . 2]" 1
1628 1 105 LYS HB2 1 105 LYS HG3 2.790 . 2.790 2.467 2.451 2.477 . 0 0 "[ . 1 . 2]" 1
1629 1 105 LYS HB2 1 106 GLY H 4.290 . 4.290 3.990 3.975 4.016 . 0 0 "[ . 1 . 2]" 1
1630 1 105 LYS HB3 1 106 GLY HA3 4.650 . 4.650 4.259 4.222 4.293 . 0 0 "[ . 1 . 2]" 1
1631 1 105 LYS HD3 1 105 LYS HE2 2.960 . 2.960 2.535 2.523 2.569 . 0 0 "[ . 1 . 2]" 1
1632 1 105 LYS HE2 1 105 LYS HG3 2.710 . 2.710 2.380 2.331 2.416 . 0 0 "[ . 1 . 2]" 1
1633 1 105 LYS HG2 1 106 GLY H 4.180 . 4.180 4.172 4.144 4.182 0.002 11 0 "[ . 1 . 2]" 1
1634 1 105 LYS HG2 1 106 GLY HA3 4.160 . 4.160 3.892 3.837 3.932 . 0 0 "[ . 1 . 2]" 1
1635 1 106 GLY H 1 106 GLY HA2 2.920 . 2.920 2.735 2.700 2.764 . 0 0 "[ . 1 . 2]" 1
1636 1 106 GLY H 1 107 GLU H 3.280 . 3.280 2.216 2.167 2.274 . 0 0 "[ . 1 . 2]" 1
1637 1 106 GLY HA2 1 107 GLU H 3.270 . 3.270 2.756 2.701 2.812 . 0 0 "[ . 1 . 2]" 1
1638 1 106 GLY HA2 1 107 GLU HB2 4.950 . 4.950 4.906 4.869 4.950 . 0 0 "[ . 1 . 2]" 1
1639 1 106 GLY HA3 1 107 GLU HB2 4.630 . 4.630 4.642 4.632 4.658 0.028 12 0 "[ . 1 . 2]" 1
1640 1 107 GLU H 1 107 GLU HB2 3.400 . 3.400 3.010 2.943 3.049 . 0 0 "[ . 1 . 2]" 1
1641 1 107 GLU H 1 107 GLU HB3 3.780 . 3.780 3.190 3.141 3.223 . 0 0 "[ . 1 . 2]" 1
1642 1 107 GLU H 1 108 ASN H 4.500 . 4.500 4.350 4.332 4.358 . 0 0 "[ . 1 . 2]" 1
1643 1 107 GLU HA 1 107 GLU HG2 3.790 . 3.790 3.476 3.294 3.650 . 0 0 "[ . 1 . 2]" 1
1644 1 107 GLU HA 1 107 GLU HG3 2.700 . 2.700 2.177 2.060 2.455 . 0 0 "[ . 1 . 2]" 1
1645 1 107 GLU HA 1 108 ASN H 2.770 . 2.770 2.547 2.524 2.570 . 0 0 "[ . 1 . 2]" 1
1646 1 107 GLU HA 1 108 ASN HB2 5.050 . 5.050 4.753 4.707 4.828 . 0 0 "[ . 1 . 2]" 1
1647 1 107 GLU HA 1 108 ASN HB3 4.410 . 4.410 3.863 3.840 3.909 . 0 0 "[ . 1 . 2]" 1
1648 1 107 GLU HA 1 108 ASN HD21 5.500 . 5.500 5.503 5.501 5.506 0.006 12 0 "[ . 1 . 2]" 1
1649 1 107 GLU HB3 1 107 GLU HG2 2.970 . 2.970 2.183 2.147 2.257 . 0 0 "[ . 1 . 2]" 1
1650 1 107 GLU HB3 1 107 GLU HG3 2.750 . 2.750 2.750 2.591 2.801 0.051 19 0 "[ . 1 . 2]" 1
1651 1 107 GLU HB3 1 108 ASN H 2.910 . 2.910 2.607 2.561 2.682 . 0 0 "[ . 1 . 2]" 1
1652 1 107 GLU HB3 1 108 ASN HB2 5.500 . 5.500 5.257 5.223 5.288 . 0 0 "[ . 1 . 2]" 1
1653 1 107 GLU HB3 1 108 ASN HB3 4.990 . 4.990 5.015 4.999 5.031 0.041 18 0 "[ . 1 . 2]" 1
1654 1 107 GLU HB3 1 109 PHE H 5.500 . 5.500 5.518 5.505 5.537 0.037 12 0 "[ . 1 . 2]" 1
1655 1 107 GLU HG2 1 108 ASN H 3.380 . 3.380 2.498 2.182 3.008 . 0 0 "[ . 1 . 2]" 1
1656 1 107 GLU HG2 1 109 PHE HD1 5.500 . 5.500 4.171 4.012 4.323 . 0 0 "[ . 1 . 2]" 1
1657 1 107 GLU HG2 1 109 PHE HZ 4.060 . 4.060 3.126 2.694 3.479 . 0 0 "[ . 1 . 2]" 1
1658 1 107 GLU HG3 1 108 ASN H 3.530 . 3.530 1.964 1.723 2.256 . 0 0 "[ . 1 . 2]" 1
1659 1 107 GLU HG3 1 108 ASN HB3 4.730 . 4.730 4.418 4.336 4.580 . 0 0 "[ . 1 . 2]" 1
1660 1 107 GLU HG3 1 109 PHE HZ 5.500 . 5.500 4.845 4.297 5.093 . 0 0 "[ . 1 . 2]" 1
1661 1 108 ASN H 1 108 ASN HB3 3.130 . 3.130 2.865 2.831 2.915 . 0 0 "[ . 1 . 2]" 1
1662 1 108 ASN H 1 109 PHE H 4.270 . 4.270 4.165 4.130 4.190 . 0 0 "[ . 1 . 2]" 1
1663 1 108 ASN H 1 109 PHE HE1 4.090 . 4.090 4.077 4.038 4.093 0.003 8 0 "[ . 1 . 2]" 1
1664 1 108 ASN HA 1 108 ASN HB2 2.590 . 2.590 2.309 2.298 2.316 . 0 0 "[ . 1 . 2]" 1
1665 1 108 ASN HA 1 108 ASN HD21 4.410 . 4.410 4.307 4.290 4.331 . 0 0 "[ . 1 . 2]" 1
1666 1 108 ASN HA 1 108 ASN HD22 4.960 . 4.960 4.843 4.837 4.850 . 0 0 "[ . 1 . 2]" 1
1667 1 108 ASN HA 1 109 PHE H 2.850 . 2.850 2.301 2.281 2.325 . 0 0 "[ . 1 . 2]" 1
1668 1 108 ASN HA 1 109 PHE HD1 3.700 . 3.700 2.917 2.883 2.935 . 0 0 "[ . 1 . 2]" 1
1669 1 108 ASN HB2 1 109 PHE H 3.680 . 3.680 3.686 3.682 3.691 0.011 10 0 "[ . 1 . 2]" 1
1670 1 108 ASN HB2 1 109 PHE HD1 5.200 . 5.200 5.203 5.166 5.213 0.013 18 0 "[ . 1 . 2]" 1
1671 1 108 ASN HB3 1 108 ASN HD21 3.230 . 3.230 2.193 2.178 2.210 . 0 0 "[ . 1 . 2]" 1
1672 1 108 ASN HB3 1 108 ASN HD22 3.640 . 3.640 3.488 3.479 3.500 . 0 0 "[ . 1 . 2]" 1
1673 1 108 ASN HD21 1 109 PHE H 4.240 . 4.240 4.247 4.243 4.253 0.013 14 0 "[ . 1 . 2]" 1
1674 1 108 ASN HD21 1 110 THR MG 4.300 . 4.300 3.964 3.851 4.091 . 0 0 "[ . 1 . 2]" 1
1675 1 108 ASN HD22 1 110 THR MG 4.470 . 4.470 3.005 2.908 3.183 . 0 0 "[ . 1 . 2]" 1
1676 1 109 PHE H 1 109 PHE HB2 3.390 . 3.390 2.699 2.666 2.727 . 0 0 "[ . 1 . 2]" 1
1677 1 109 PHE H 1 109 PHE HD1 3.650 . 3.650 2.847 2.768 2.889 . 0 0 "[ . 1 . 2]" 1
1678 1 109 PHE H 1 110 THR H 4.410 . 4.410 4.338 4.287 4.384 . 0 0 "[ . 1 . 2]" 1
1679 1 109 PHE H 1 114 VAL MG1 3.930 . 3.930 3.923 3.860 3.953 0.023 18 0 "[ . 1 . 2]" 1
1680 1 109 PHE HA 1 109 PHE HD1 4.100 . 4.100 3.930 3.869 3.983 . 0 0 "[ . 1 . 2]" 1
1681 1 109 PHE HA 1 109 PHE HD2 3.760 . 3.760 3.319 3.274 3.387 . 0 0 "[ . 1 . 2]" 1
1682 1 109 PHE HA 1 110 THR H 3.380 . 3.380 2.207 2.186 2.236 . 0 0 "[ . 1 . 2]" 1
1683 1 109 PHE HA 1 110 THR MG 3.600 . 3.600 3.612 3.604 3.617 0.017 18 0 "[ . 1 . 2]" 1
1684 1 109 PHE HA 1 113 ASP HB2 3.690 . 3.690 2.698 2.619 2.778 . 0 0 "[ . 1 . 2]" 1
1685 1 109 PHE HA 1 113 ASP HB3 3.660 . 3.660 3.100 2.964 3.198 . 0 0 "[ . 1 . 2]" 1
1686 1 109 PHE HA 1 114 VAL MG1 3.920 . 3.920 3.948 3.929 3.964 0.044 19 0 "[ . 1 . 2]" 1
1687 1 109 PHE HA 1 117 MET ME 4.680 . 4.680 4.538 4.500 4.603 . 0 0 "[ . 1 . 2]" 1
1688 1 109 PHE HB2 1 109 PHE HD1 3.270 . 3.270 2.590 2.554 2.629 . 0 0 "[ . 1 . 2]" 1
1689 1 109 PHE HB2 1 110 THR H 4.260 . 4.260 4.253 4.228 4.266 0.006 14 0 "[ . 1 . 2]" 1
1690 1 109 PHE HB2 1 110 THR HA 5.210 . 5.210 5.201 5.171 5.218 0.008 10 0 "[ . 1 . 2]" 1
1691 1 109 PHE HB2 1 113 ASP HB2 3.970 . 3.970 3.729 3.699 3.764 . 0 0 "[ . 1 . 2]" 1
1692 1 109 PHE HB2 1 113 ASP HB3 4.450 . 4.450 4.156 4.106 4.211 . 0 0 "[ . 1 . 2]" 1
1693 1 109 PHE HB2 1 114 VAL HB 4.640 . 4.640 4.657 4.643 4.673 0.033 12 0 "[ . 1 . 2]" 1
1694 1 109 PHE HB2 1 114 VAL MG1 3.180 . 3.180 2.085 2.068 2.099 . 0 0 "[ . 1 . 2]" 1
1695 1 109 PHE HB2 1 117 MET ME 3.120 . 3.120 2.952 2.903 3.049 . 0 0 "[ . 1 . 2]" 1
1696 1 109 PHE HB3 1 109 PHE HD2 3.200 . 3.200 2.401 2.376 2.422 . 0 0 "[ . 1 . 2]" 1
1697 1 109 PHE HB3 1 110 THR H 4.140 . 4.140 3.329 3.266 3.377 . 0 0 "[ . 1 . 2]" 1
1698 1 109 PHE HB3 1 113 ASP HB2 4.700 . 4.700 2.174 2.151 2.201 . 0 0 "[ . 1 . 2]" 1
1699 1 109 PHE HB3 1 113 ASP HB3 2.690 . 2.690 2.453 2.408 2.499 . 0 0 "[ . 1 . 2]" 1
1700 1 109 PHE HB3 1 114 VAL MG1 3.370 . 3.370 2.303 2.279 2.332 . 0 0 "[ . 1 . 2]" 1
1701 1 109 PHE HB3 1 117 MET ME 3.510 . 3.510 2.676 2.640 2.762 . 0 0 "[ . 1 . 2]" 1
1702 1 109 PHE HD1 1 114 VAL MG1 4.630 . 4.630 4.089 4.022 4.165 . 0 0 "[ . 1 . 2]" 1
1703 1 109 PHE HD2 1 110 THR H 4.700 . 4.700 4.566 4.488 4.635 . 0 0 "[ . 1 . 2]" 1
1704 1 109 PHE HD2 1 113 ASP HA 4.010 . 4.010 3.959 3.810 4.013 0.003 18 0 "[ . 1 . 2]" 1
1705 1 109 PHE HD2 1 113 ASP HB2 3.920 . 3.920 3.205 3.178 3.240 . 0 0 "[ . 1 . 2]" 1
1706 1 109 PHE HD2 1 113 ASP HB3 3.600 . 3.600 1.871 1.842 1.909 . 0 0 "[ . 1 . 2]" 1
1707 1 109 PHE HD2 1 114 VAL H 4.990 . 4.990 4.799 4.646 4.850 . 0 0 "[ . 1 . 2]" 1
1708 1 109 PHE HD2 1 114 VAL HA 4.350 . 4.350 4.329 4.104 4.361 0.011 19 0 "[ . 1 . 2]" 1
1709 1 109 PHE HD2 1 114 VAL MG1 4.210 . 4.210 4.091 4.013 4.150 . 0 0 "[ . 1 . 2]" 1
1710 1 109 PHE HD2 1 116 MET HG2 5.270 . 5.270 5.014 4.815 5.144 . 0 0 "[ . 1 . 2]" 1
1711 1 109 PHE HD2 1 117 MET ME 2.760 . 2.760 2.593 2.541 2.653 . 0 0 "[ . 1 . 2]" 1
1712 1 109 PHE HD2 1 117 MET HG2 5.500 . 5.500 4.909 4.662 4.987 . 0 0 "[ . 1 . 2]" 1
1713 1 109 PHE HE2 1 117 MET ME 5.110 . 5.110 2.983 2.882 3.040 . 0 0 "[ . 1 . 2]" 1
1714 1 110 THR H 1 110 THR MG 3.380 . 3.380 2.166 2.140 2.188 . 0 0 "[ . 1 . 2]" 1
1715 1 110 THR H 1 111 GLU H 4.610 . 4.610 4.570 4.559 4.588 . 0 0 "[ . 1 . 2]" 1
1716 1 110 THR H 1 112 THR H 4.770 . 4.770 4.782 4.774 4.792 0.022 18 0 "[ . 1 . 2]" 1
1717 1 110 THR H 1 113 ASP H 4.010 . 4.010 3.221 3.207 3.241 . 0 0 "[ . 1 . 2]" 1
1718 1 110 THR H 1 113 ASP HB2 3.940 . 3.940 2.036 2.001 2.071 . 0 0 "[ . 1 . 2]" 1
1719 1 110 THR H 1 113 ASP HB3 3.970 . 3.970 3.370 3.323 3.400 . 0 0 "[ . 1 . 2]" 1
1720 1 110 THR H 1 114 VAL H 4.560 . 4.560 4.103 4.041 4.133 . 0 0 "[ . 1 . 2]" 1
1721 1 110 THR H 1 114 VAL MG1 4.410 . 4.410 3.899 3.828 3.939 . 0 0 "[ . 1 . 2]" 1
1722 1 110 THR HA 1 110 THR HB 2.580 . 2.580 2.488 2.474 2.501 . 0 0 "[ . 1 . 2]" 1
1723 1 110 THR HA 1 110 THR MG 2.650 . 2.650 2.515 2.476 2.540 . 0 0 "[ . 1 . 2]" 1
1724 1 110 THR HA 1 111 GLU H 3.110 . 3.110 2.712 2.677 2.731 . 0 0 "[ . 1 . 2]" 1
1725 1 110 THR HA 1 111 GLU HB3 5.260 . 5.260 5.126 5.085 5.148 . 0 0 "[ . 1 . 2]" 1
1726 1 110 THR HA 1 112 THR H 4.680 . 4.680 4.574 4.521 4.616 . 0 0 "[ . 1 . 2]" 1
1727 1 110 THR HA 1 114 VAL MG1 3.870 . 3.870 3.949 3.903 4.006 0.136 18 0 "[ . 1 . 2]" 1
1728 1 110 THR HA 1 114 VAL MG2 5.390 . 5.390 4.656 4.603 4.727 . 0 0 "[ . 1 . 2]" 1
1729 1 110 THR HB 1 111 GLU H 3.300 . 3.300 2.089 2.054 2.150 . 0 0 "[ . 1 . 2]" 1
1730 1 110 THR HB 1 111 GLU HB3 4.300 . 4.300 3.990 3.913 4.031 . 0 0 "[ . 1 . 2]" 1
1731 1 110 THR HB 1 112 THR H 3.800 . 3.800 3.113 3.024 3.199 . 0 0 "[ . 1 . 2]" 1
1732 1 110 THR HB 1 112 THR HB 5.090 . 5.090 4.393 4.259 4.467 . 0 0 "[ . 1 . 2]" 1
1733 1 110 THR MG 1 111 GLU H 3.990 . 3.990 3.713 3.696 3.729 . 0 0 "[ . 1 . 2]" 1
1734 1 110 THR MG 1 112 THR H 4.380 . 4.380 4.268 4.247 4.282 . 0 0 "[ . 1 . 2]" 1
1735 1 110 THR MG 1 112 THR HB 4.370 . 4.370 4.408 4.386 4.430 0.060 12 0 "[ . 1 . 2]" 1
1736 1 110 THR MG 1 113 ASP HB2 4.580 . 4.580 3.879 3.831 3.931 . 0 0 "[ . 1 . 2]" 1
1737 1 111 GLU H 1 111 GLU HB2 3.340 . 3.340 2.753 2.723 2.790 . 0 0 "[ . 1 . 2]" 1
1738 1 111 GLU H 1 111 GLU HB3 3.470 . 3.470 2.425 2.390 2.442 . 0 0 "[ . 1 . 2]" 1
1739 1 111 GLU H 1 111 GLU HG2 4.360 . 4.360 4.364 4.361 4.370 0.010 19 0 "[ . 1 . 2]" 1
1740 1 111 GLU H 1 112 THR H 3.510 . 3.510 2.711 2.694 2.737 . 0 0 "[ . 1 . 2]" 1
1741 1 111 GLU H 1 112 THR HB 4.940 . 4.940 4.950 4.944 4.962 0.022 12 0 "[ . 1 . 2]" 1
1742 1 111 GLU H 1 113 ASP H 4.550 . 4.550 4.122 4.097 4.153 . 0 0 "[ . 1 . 2]" 1
1743 1 111 GLU H 1 114 VAL H 5.120 . 5.120 4.698 4.687 4.709 . 0 0 "[ . 1 . 2]" 1
1744 1 111 GLU H 1 114 VAL MG1 4.940 . 4.940 4.700 4.679 4.738 . 0 0 "[ . 1 . 2]" 1
1745 1 111 GLU H 1 114 VAL MG2 5.130 . 5.130 4.134 4.106 4.164 . 0 0 "[ . 1 . 2]" 1
1746 1 111 GLU HA 1 111 GLU HB2 2.460 . 2.460 2.369 2.354 2.390 . 0 0 "[ . 1 . 2]" 1
1747 1 111 GLU HA 1 111 GLU HG2 3.540 . 3.540 3.345 3.288 3.389 . 0 0 "[ . 1 . 2]" 1
1748 1 111 GLU HA 1 111 GLU HG3 2.750 . 2.750 2.525 2.480 2.699 . 0 0 "[ . 1 . 2]" 1
1749 1 111 GLU HA 1 114 VAL H 5.240 . 5.240 3.412 3.362 3.489 . 0 0 "[ . 1 . 2]" 1
1750 1 111 GLU HA 1 114 VAL MG2 2.400 . 2.400 1.934 1.913 2.003 . 0 0 "[ . 1 . 2]" 1
1751 1 111 GLU HB2 1 111 GLU HG3 2.520 . 2.520 2.527 2.511 2.538 0.018 18 0 "[ . 1 . 2]" 1
1752 1 111 GLU HB2 1 112 THR H 4.530 . 4.530 4.026 3.996 4.053 . 0 0 "[ . 1 . 2]" 1
1753 1 111 GLU HB3 1 111 GLU HG2 2.480 . 2.480 2.390 2.371 2.456 . 0 0 "[ . 1 . 2]" 1
1754 1 111 GLU HB3 1 112 THR H 3.310 . 3.310 2.702 2.658 2.743 . 0 0 "[ . 1 . 2]" 1
1755 1 111 GLU HG2 1 112 THR H 4.510 . 4.510 3.417 3.393 3.438 . 0 0 "[ . 1 . 2]" 1
1756 1 111 GLU HG2 1 112 THR HA 4.460 . 4.460 3.271 3.237 3.314 . 0 0 "[ . 1 . 2]" 1
1757 1 111 GLU HG2 1 112 THR HB 5.320 . 5.320 5.334 5.323 5.349 0.029 18 0 "[ . 1 . 2]" 1
1758 1 111 GLU HG2 1 112 THR MG 5.470 . 5.470 4.912 4.875 4.961 . 0 0 "[ . 1 . 2]" 1
1759 1 111 GLU HG2 1 114 VAL MG2 4.180 . 4.180 4.147 4.092 4.183 0.003 18 0 "[ . 1 . 2]" 1
1760 1 111 GLU HG2 1 115 LYS HB2 4.210 . 4.210 4.205 4.000 4.222 0.012 19 0 "[ . 1 . 2]" 1
1761 1 111 GLU HG2 1 115 LYS HG3 3.770 . 3.770 2.874 2.522 3.170 . 0 0 "[ . 1 . 2]" 1
1762 1 111 GLU HG3 1 114 VAL MG2 3.770 . 3.770 3.241 3.158 3.540 . 0 0 "[ . 1 . 2]" 1
1763 1 111 GLU HG3 1 115 LYS HB3 5.500 . 5.500 5.448 5.358 5.512 0.012 14 0 "[ . 1 . 2]" 1
1764 1 111 GLU HG3 1 115 LYS HG2 4.370 . 4.370 2.820 2.697 3.084 . 0 0 "[ . 1 . 2]" 1
1765 1 111 GLU HG3 1 115 LYS HG3 4.550 . 4.550 3.070 2.848 3.217 . 0 0 "[ . 1 . 2]" 1
1766 1 112 THR H 1 112 THR MG 3.930 . 3.930 3.755 3.744 3.770 . 0 0 "[ . 1 . 2]" 1
1767 1 112 THR H 1 113 ASP H 3.390 . 3.390 2.555 2.529 2.587 . 0 0 "[ . 1 . 2]" 1
1768 1 112 THR H 1 113 ASP HB2 4.730 . 4.730 4.723 4.690 4.733 0.003 18 0 "[ . 1 . 2]" 1
1769 1 112 THR H 1 114 VAL H 4.090 . 4.090 4.102 4.094 4.113 0.023 12 0 "[ . 1 . 2]" 1
1770 1 112 THR H 1 114 VAL MG2 5.040 . 5.040 4.341 4.309 4.370 . 0 0 "[ . 1 . 2]" 1
1771 1 112 THR H 1 115 LYS H 4.750 . 4.750 4.694 4.677 4.714 . 0 0 "[ . 1 . 2]" 1
1772 1 112 THR HA 1 112 THR MG 2.740 . 2.740 2.403 2.388 2.416 . 0 0 "[ . 1 . 2]" 1
1773 1 112 THR HA 1 113 ASP HA 4.900 . 4.900 4.740 4.727 4.758 . 0 0 "[ . 1 . 2]" 1
1774 1 112 THR HA 1 114 VAL H 5.090 . 5.090 4.498 4.473 4.531 . 0 0 "[ . 1 . 2]" 1
1775 1 112 THR HA 1 115 LYS H 4.050 . 4.050 3.519 3.501 3.546 . 0 0 "[ . 1 . 2]" 1
1776 1 112 THR HA 1 115 LYS HB2 2.920 . 2.920 2.793 2.708 2.857 . 0 0 "[ . 1 . 2]" 1
1777 1 112 THR HA 1 115 LYS HG3 4.180 . 4.180 3.570 3.192 4.158 . 0 0 "[ . 1 . 2]" 1
1778 1 112 THR HA 1 116 MET H 5.440 . 5.440 3.993 3.903 4.064 . 0 0 "[ . 1 . 2]" 1
1779 1 112 THR HA 1 116 MET ME 3.900 . 3.900 3.939 3.919 3.965 0.065 18 0 "[ . 1 . 2]" 1
1780 1 112 THR HA 1 116 MET HG2 4.920 . 4.920 4.927 4.921 4.937 0.017 12 0 "[ . 1 . 2]" 1
1781 1 112 THR HB 1 113 ASP HA 4.600 . 4.600 4.115 4.068 4.152 . 0 0 "[ . 1 . 2]" 1
1782 1 112 THR HB 1 113 ASP HB2 5.240 . 5.240 4.724 4.634 4.783 . 0 0 "[ . 1 . 2]" 1
1783 1 112 THR MG 1 113 ASP H 4.110 . 4.110 3.642 3.595 3.674 . 0 0 "[ . 1 . 2]" 1
1784 1 112 THR MG 1 113 ASP HA 3.700 . 3.700 3.704 3.680 3.721 0.021 8 0 "[ . 1 . 2]" 1
1785 1 112 THR MG 1 115 LYS H 4.620 . 4.620 4.663 4.638 4.694 0.074 18 0 "[ . 1 . 2]" 1
1786 1 112 THR MG 1 115 LYS HB2 4.150 . 4.150 3.990 3.916 4.156 0.006 14 0 "[ . 1 . 2]" 1
1787 1 112 THR MG 1 116 MET H 4.540 . 4.540 3.956 3.899 3.996 . 0 0 "[ . 1 . 2]" 1
1788 1 112 THR MG 1 116 MET HB3 3.130 . 3.130 3.133 3.108 3.143 0.013 19 0 "[ . 1 . 2]" 1
1789 1 112 THR MG 1 116 MET ME 2.640 . 2.640 1.943 1.911 1.962 . 0 0 "[ . 1 . 2]" 1
1790 1 112 THR MG 1 116 MET HG2 3.710 . 3.710 3.732 3.716 3.754 0.044 12 0 "[ . 1 . 2]" 1
1791 1 113 ASP H 1 113 ASP HB2 4.030 . 4.030 2.432 2.410 2.455 . 0 0 "[ . 1 . 2]" 1
1792 1 113 ASP H 1 114 VAL H 3.350 . 3.350 2.661 2.646 2.699 . 0 0 "[ . 1 . 2]" 1
1793 1 113 ASP H 1 114 VAL MG1 4.290 . 4.290 4.212 4.180 4.254 . 0 0 "[ . 1 . 2]" 1
1794 1 113 ASP H 1 114 VAL MG2 4.090 . 4.090 4.118 4.103 4.136 0.046 8 0 "[ . 1 . 2]" 1
1795 1 113 ASP H 1 115 LYS H 4.230 . 4.230 3.970 3.939 3.997 . 0 0 "[ . 1 . 2]" 1
1796 1 113 ASP H 1 116 MET H 4.890 . 4.890 4.687 4.654 4.723 . 0 0 "[ . 1 . 2]" 1
1797 1 113 ASP H 1 116 MET ME 4.070 . 4.070 3.546 3.493 3.660 . 0 0 "[ . 1 . 2]" 1
1798 1 113 ASP H 1 116 MET HG2 5.140 . 5.140 4.329 4.308 4.364 . 0 0 "[ . 1 . 2]" 1
1799 1 113 ASP HA 1 116 MET H 4.780 . 4.780 3.480 3.439 3.546 . 0 0 "[ . 1 . 2]" 1
1800 1 113 ASP HA 1 116 MET HB2 4.810 . 4.810 4.738 4.709 4.810 0.000 16 0 "[ . 1 . 2]" 1
1801 1 113 ASP HA 1 116 MET HB3 3.990 . 3.990 3.895 3.855 3.961 . 0 0 "[ . 1 . 2]" 1
1802 1 113 ASP HA 1 116 MET ME 3.930 . 3.930 2.167 2.120 2.301 . 0 0 "[ . 1 . 2]" 1
1803 1 113 ASP HA 1 116 MET HG2 3.500 . 3.500 1.870 1.843 1.919 . 0 0 "[ . 1 . 2]" 1
1804 1 113 ASP HA 1 117 MET HB3 4.590 . 4.590 4.602 4.593 4.612 0.022 18 0 "[ . 1 . 2]" 1
1805 1 113 ASP HB3 1 114 VAL H 4.490 . 4.490 3.698 3.649 3.751 . 0 0 "[ . 1 . 2]" 1
1806 1 113 ASP HB3 1 114 VAL MG1 4.100 . 4.100 4.022 3.956 4.077 . 0 0 "[ . 1 . 2]" 1
1807 1 113 ASP HB3 1 117 MET ME 3.840 . 3.840 3.532 3.393 3.694 . 0 0 "[ . 1 . 2]" 1
1808 1 114 VAL H 1 114 VAL HB 3.850 . 3.850 3.721 3.711 3.729 . 0 0 "[ . 1 . 2]" 1
1809 1 114 VAL H 1 114 VAL MG1 3.380 . 3.380 2.318 2.300 2.345 . 0 0 "[ . 1 . 2]" 1
1810 1 114 VAL H 1 114 VAL MG2 3.500 . 3.500 2.168 2.144 2.185 . 0 0 "[ . 1 . 2]" 1
1811 1 114 VAL H 1 115 LYS H 3.300 . 3.300 2.522 2.498 2.542 . 0 0 "[ . 1 . 2]" 1
1812 1 114 VAL H 1 117 MET H 5.010 . 5.010 4.751 4.725 4.786 . 0 0 "[ . 1 . 2]" 1
1813 1 114 VAL H 1 117 MET ME 5.480 . 5.480 4.020 3.947 4.127 . 0 0 "[ . 1 . 2]" 1
1814 1 114 VAL H 1 117 MET HG2 4.500 . 4.500 4.507 4.502 4.512 0.012 12 0 "[ . 1 . 2]" 1
1815 1 114 VAL HA 1 114 VAL MG1 2.750 . 2.750 2.415 2.407 2.428 . 0 0 "[ . 1 . 2]" 1
1816 1 114 VAL HA 1 114 VAL MG2 3.250 . 3.250 3.220 3.211 3.236 . 0 0 "[ . 1 . 2]" 1
1817 1 114 VAL HA 1 115 LYS HA 4.770 . 4.770 4.723 4.661 4.754 . 0 0 "[ . 1 . 2]" 1
1818 1 114 VAL HA 1 117 MET H 4.460 . 4.460 3.408 3.385 3.447 . 0 0 "[ . 1 . 2]" 1
1819 1 114 VAL HA 1 117 MET HB2 4.540 . 4.540 4.544 4.534 4.555 0.015 18 0 "[ . 1 . 2]" 1
1820 1 114 VAL HA 1 117 MET ME 2.800 . 2.800 2.042 1.972 2.102 . 0 0 "[ . 1 . 2]" 1
1821 1 114 VAL HA 1 117 MET HG2 3.480 . 3.480 1.884 1.867 1.903 . 0 0 "[ . 1 . 2]" 1
1822 1 114 VAL HA 1 117 MET HG3 3.760 . 3.760 3.511 3.490 3.535 . 0 0 "[ . 1 . 2]" 1
1823 1 114 VAL HB 1 115 LYS H 4.180 . 4.180 4.183 4.175 4.187 0.007 2 0 "[ . 1 . 2]" 1
1824 1 114 VAL MG2 1 115 LYS H 3.370 . 3.370 2.603 2.571 2.616 . 0 0 "[ . 1 . 2]" 1
1825 1 115 LYS H 1 115 LYS HB3 3.640 . 3.640 3.627 3.610 3.642 0.002 6 0 "[ . 1 . 2]" 1
1826 1 115 LYS H 1 115 LYS HG2 3.430 . 3.430 2.613 2.504 2.686 . 0 0 "[ . 1 . 2]" 1
1827 1 115 LYS H 1 116 MET H 3.550 . 3.550 2.436 2.400 2.481 . 0 0 "[ . 1 . 2]" 1
1828 1 115 LYS H 1 117 MET H 4.350 . 4.350 3.905 3.884 3.938 . 0 0 "[ . 1 . 2]" 1
1829 1 115 LYS HA 1 115 LYS HB3 2.630 . 2.630 2.544 2.516 2.574 . 0 0 "[ . 1 . 2]" 1
1830 1 115 LYS HA 1 115 LYS HD3 2.830 . 2.830 2.456 2.020 2.838 0.008 19 0 "[ . 1 . 2]" 1
1831 1 115 LYS HA 1 115 LYS HG2 2.840 . 2.840 2.810 2.659 2.853 0.013 14 0 "[ . 1 . 2]" 1
1832 1 115 LYS HB2 1 115 LYS HG3 2.840 . 2.840 2.304 2.207 2.405 . 0 0 "[ . 1 . 2]" 1
1833 1 115 LYS HB3 1 115 LYS HD2 2.470 . 2.470 2.414 2.344 2.477 0.007 14 0 "[ . 1 . 2]" 1
1834 1 115 LYS HB3 1 115 LYS HG3 2.960 . 2.960 2.590 2.509 2.709 . 0 0 "[ . 1 . 2]" 1
1835 1 115 LYS QE 1 115 LYS HG2 3.340 . 3.340 2.567 2.302 3.077 . 0 0 "[ . 1 . 2]" 1
1836 1 115 LYS QE 1 115 LYS HG3 3.050 . 3.050 2.418 2.160 2.938 . 0 0 "[ . 1 . 2]" 1
1837 1 115 LYS HG2 1 116 MET H 4.800 . 4.800 4.474 4.394 4.539 . 0 0 "[ . 1 . 2]" 1
1838 1 116 MET H 1 116 MET HB3 3.050 . 3.050 2.540 2.521 2.558 . 0 0 "[ . 1 . 2]" 1
1839 1 116 MET H 1 116 MET HG2 3.640 . 3.640 2.350 2.308 2.401 . 0 0 "[ . 1 . 2]" 1
1840 1 116 MET H 1 117 MET H 3.490 . 3.490 2.534 2.489 2.592 . 0 0 "[ . 1 . 2]" 1
1841 1 116 MET H 1 118 GLU H 4.150 . 4.150 4.170 4.159 4.186 0.036 12 0 "[ . 1 . 2]" 1
1842 1 116 MET HA 1 116 MET HB3 2.910 . 2.910 2.509 2.497 2.516 . 0 0 "[ . 1 . 2]" 1
1843 1 116 MET HA 1 116 MET HG2 3.870 . 3.870 3.830 3.816 3.863 . 0 0 "[ . 1 . 2]" 1
1844 1 116 MET HA 1 117 MET HA 4.900 . 4.900 4.726 4.714 4.733 . 0 0 "[ . 1 . 2]" 1
1845 1 116 MET HA 1 119 ARG H 4.170 . 4.170 3.050 2.953 3.122 . 0 0 "[ . 1 . 2]" 1
1846 1 116 MET HB2 1 116 MET ME 2.960 . 2.960 2.994 2.971 3.021 0.061 12 0 "[ . 1 . 2]" 1
1847 1 116 MET HB2 1 116 MET HG3 2.960 . 2.960 2.479 2.473 2.485 . 0 0 "[ . 1 . 2]" 1
1848 1 116 MET HB3 1 116 MET ME 2.680 . 2.680 2.148 2.085 2.196 . 0 0 "[ . 1 . 2]" 1
1849 1 116 MET ME 1 116 MET HG2 2.860 . 2.860 2.360 2.333 2.416 . 0 0 "[ . 1 . 2]" 1
1850 1 116 MET HG2 1 117 MET H 4.690 . 4.690 2.815 2.781 2.844 . 0 0 "[ . 1 . 2]" 1
1851 1 116 MET HG2 1 117 MET HA 5.100 . 5.100 4.518 4.485 4.557 . 0 0 "[ . 1 . 2]" 1
1852 1 116 MET HG2 1 117 MET ME 5.150 . 5.150 4.880 4.782 4.932 . 0 0 "[ . 1 . 2]" 1
1853 1 116 MET HG2 1 120 VAL MG1 5.500 . 5.500 4.845 4.764 4.952 . 0 0 "[ . 1 . 2]" 1
1854 1 117 MET H 1 117 MET ME 3.800 . 3.800 3.802 3.773 3.818 0.018 14 0 "[ . 1 . 2]" 1
1855 1 117 MET H 1 117 MET HG2 3.090 . 3.090 2.384 2.349 2.412 . 0 0 "[ . 1 . 2]" 1
1856 1 117 MET H 1 117 MET HG3 3.420 . 3.420 3.264 3.187 3.298 . 0 0 "[ . 1 . 2]" 1
1857 1 117 MET H 1 118 GLU H 3.700 . 3.700 2.668 2.637 2.700 . 0 0 "[ . 1 . 2]" 1
1858 1 117 MET H 1 119 ARG H 4.760 . 4.760 4.139 4.081 4.173 . 0 0 "[ . 1 . 2]" 1
1859 1 117 MET H 1 120 VAL MG2 4.580 . 4.580 4.609 4.587 4.633 0.053 10 0 "[ . 1 . 2]" 1
1860 1 117 MET HA 1 117 MET HG3 3.790 . 3.790 3.688 3.670 3.698 . 0 0 "[ . 1 . 2]" 1
1861 1 117 MET HA 1 119 ARG H 5.100 . 5.100 4.337 4.295 4.379 . 0 0 "[ . 1 . 2]" 1
1862 1 117 MET HA 1 120 VAL H 4.460 . 4.460 3.491 3.370 3.573 . 0 0 "[ . 1 . 2]" 1
1863 1 117 MET HA 1 120 VAL MG1 3.020 . 3.020 2.991 2.811 3.049 0.029 10 0 "[ . 1 . 2]" 1
1864 1 117 MET HA 1 120 VAL MG2 3.490 . 3.490 2.263 2.189 2.327 . 0 0 "[ . 1 . 2]" 1
1865 1 117 MET HA 1 121 VAL H 4.790 . 4.790 4.504 4.373 4.650 . 0 0 "[ . 1 . 2]" 1
1866 1 117 MET HB2 1 117 MET ME 2.830 . 2.830 2.657 2.559 2.744 . 0 0 "[ . 1 . 2]" 1
1867 1 117 MET ME 1 117 MET HG2 2.700 . 2.700 2.438 2.411 2.458 . 0 0 "[ . 1 . 2]" 1
1868 1 117 MET ME 1 118 GLU H 5.390 . 5.390 5.005 4.966 5.051 . 0 0 "[ . 1 . 2]" 1
1869 1 117 MET HG2 1 118 GLU H 3.200 . 3.200 3.126 3.071 3.187 . 0 0 "[ . 1 . 2]" 1
1870 1 117 MET HG3 1 118 GLU H 3.700 . 3.700 2.580 2.536 2.630 . 0 0 "[ . 1 . 2]" 1
1871 1 117 MET HG3 1 118 GLU HA 4.100 . 4.100 3.539 3.484 3.593 . 0 0 "[ . 1 . 2]" 1
1872 1 118 GLU H 1 118 GLU QG 4.020 . 4.020 2.678 2.588 2.830 . 0 0 "[ . 1 . 2]" 1
1873 1 118 GLU H 1 119 ARG H 3.610 . 3.610 2.447 2.413 2.502 . 0 0 "[ . 1 . 2]" 1
1874 1 118 GLU H 1 120 VAL H 4.190 . 4.190 4.167 4.137 4.201 0.011 12 0 "[ . 1 . 2]" 1
1875 1 118 GLU H 1 120 VAL MG1 5.500 . 5.500 5.028 4.975 5.097 . 0 0 "[ . 1 . 2]" 1
1876 1 118 GLU H 1 120 VAL MG2 4.480 . 4.480 4.488 4.430 4.521 0.041 18 0 "[ . 1 . 2]" 1
1877 1 118 GLU HA 1 118 GLU HG2 3.380 . 3.380 2.317 2.236 2.479 . 0 0 "[ . 1 . 2]" 1
1878 1 118 GLU HA 1 118 GLU HG3 3.380 . 3.380 3.153 2.983 3.232 . 0 0 "[ . 1 . 2]" 1
1879 1 118 GLU HA 1 121 VAL H 3.790 . 3.790 3.663 3.577 3.796 0.006 18 0 "[ . 1 . 2]" 1
1880 1 118 GLU HA 1 121 VAL QG 4.670 . 4.670 2.958 2.064 3.499 . 0 0 "[ . 1 . 2]" 1
1881 1 118 GLU HA 1 122 GLU H 4.320 . 4.320 4.150 4.053 4.300 . 0 0 "[ . 1 . 2]" 1
1882 1 118 GLU HB3 1 122 GLU H 5.030 . 5.030 4.742 4.658 4.918 . 0 0 "[ . 1 . 2]" 1
1883 1 118 GLU QG 1 119 ARG H 5.340 . 5.340 4.234 4.180 4.318 . 0 0 "[ . 1 . 2]" 1
1884 1 118 GLU QG 1 121 VAL QG 5.280 . 5.280 4.161 3.433 4.627 . 0 0 "[ . 1 . 2]" 1
1885 1 119 ARG H 1 119 ARG HB2 3.170 . 3.170 2.022 1.988 2.061 . 0 0 "[ . 1 . 2]" 1
1886 1 119 ARG H 1 119 ARG HB3 3.080 . 3.080 3.080 3.067 3.086 0.006 10 0 "[ . 1 . 2]" 1
1887 1 119 ARG H 1 119 ARG HD2 5.260 . 5.260 5.123 5.070 5.193 . 0 0 "[ . 1 . 2]" 1
1888 1 119 ARG H 1 119 ARG HD3 4.700 . 4.700 4.592 4.484 4.655 . 0 0 "[ . 1 . 2]" 1
1889 1 119 ARG H 1 119 ARG HG2 4.280 . 4.280 3.786 3.735 3.858 . 0 0 "[ . 1 . 2]" 1
1890 1 119 ARG H 1 119 ARG HG3 4.680 . 4.680 4.403 4.354 4.461 . 0 0 "[ . 1 . 2]" 1
1891 1 119 ARG H 1 120 VAL H 3.510 . 3.510 2.755 2.705 2.799 . 0 0 "[ . 1 . 2]" 1
1892 1 119 ARG H 1 120 VAL MG1 4.320 . 4.320 4.263 4.181 4.328 0.008 18 0 "[ . 1 . 2]" 1
1893 1 119 ARG H 1 120 VAL MG2 4.650 . 4.650 4.302 4.203 4.370 . 0 0 "[ . 1 . 2]" 1
1894 1 119 ARG H 1 121 VAL H 4.730 . 4.730 4.197 4.080 4.495 . 0 0 "[ . 1 . 2]" 1
1895 1 119 ARG H 1 122 GLU HG3 5.500 . 5.500 4.967 4.628 5.185 . 0 0 "[ . 1 . 2]" 1
1896 1 119 ARG HA 1 119 ARG HD2 3.300 . 3.300 3.274 3.238 3.312 0.012 12 0 "[ . 1 . 2]" 1
1897 1 119 ARG HA 1 119 ARG HD3 3.200 . 3.200 2.049 1.951 2.127 . 0 0 "[ . 1 . 2]" 1
1898 1 119 ARG HA 1 119 ARG HG2 3.150 . 3.150 2.552 2.518 2.601 . 0 0 "[ . 1 . 2]" 1
1899 1 119 ARG HA 1 119 ARG HG3 3.720 . 3.720 3.604 3.572 3.631 . 0 0 "[ . 1 . 2]" 1
1900 1 119 ARG HA 1 121 VAL H 5.220 . 5.220 4.131 3.905 4.449 . 0 0 "[ . 1 . 2]" 1
1901 1 119 ARG HA 1 122 GLU H 4.360 . 4.360 3.221 2.993 3.379 . 0 0 "[ . 1 . 2]" 1
1902 1 119 ARG HA 1 122 GLU HA 5.500 . 5.500 5.127 4.898 5.356 . 0 0 "[ . 1 . 2]" 1
1903 1 119 ARG HA 1 122 GLU HB2 4.270 . 4.270 2.405 2.245 2.578 . 0 0 "[ . 1 . 2]" 1
1904 1 119 ARG HB2 1 119 ARG HD2 4.050 . 4.050 3.763 3.728 3.812 . 0 0 "[ . 1 . 2]" 1
1905 1 119 ARG HB2 1 119 ARG HD3 4.190 . 4.190 3.711 3.645 3.745 . 0 0 "[ . 1 . 2]" 1
1906 1 119 ARG HB2 1 119 ARG HG3 2.960 . 2.960 2.478 2.454 2.496 . 0 0 "[ . 1 . 2]" 1
1907 1 119 ARG HB2 1 120 VAL H 3.600 . 3.600 3.450 3.402 3.476 . 0 0 "[ . 1 . 2]" 1
1908 1 119 ARG HB3 1 120 VAL H 3.500 . 3.500 2.896 2.819 2.932 . 0 0 "[ . 1 . 2]" 1
1909 1 119 ARG HD2 1 119 ARG HG3 2.870 . 2.870 2.457 2.403 2.474 . 0 0 "[ . 1 . 2]" 1
1910 1 119 ARG HD2 1 120 VAL H 4.810 . 4.810 4.825 4.808 4.870 0.060 12 0 "[ . 1 . 2]" 1
1911 1 119 ARG HD2 1 123 GLN HB2 4.220 . 4.220 4.105 3.915 4.222 0.002 2 0 "[ . 1 . 2]" 1
1912 1 119 ARG HD2 1 123 GLN HE22 3.660 . 3.660 2.522 2.415 2.651 . 0 0 "[ . 1 . 2]" 1
1913 1 119 ARG HD3 1 120 VAL H 4.820 . 4.820 4.771 4.573 4.832 0.012 14 0 "[ . 1 . 2]" 1
1914 1 119 ARG HD3 1 120 VAL MG1 5.500 . 5.500 5.525 5.467 5.553 0.053 10 0 "[ . 1 . 2]" 1
1915 1 119 ARG HD3 1 123 GLN HB2 4.480 . 4.480 4.181 4.035 4.301 . 0 0 "[ . 1 . 2]" 1
1916 1 119 ARG HD3 1 123 GLN HE22 3.680 . 3.680 3.688 3.682 3.703 0.023 12 0 "[ . 1 . 2]" 1
1917 1 119 ARG HG2 1 120 VAL H 5.300 . 5.300 5.190 5.131 5.225 . 0 0 "[ . 1 . 2]" 1
1918 1 119 ARG HG3 1 120 VAL H 5.220 . 5.220 5.201 5.113 5.223 0.003 13 0 "[ . 1 . 2]" 1
1919 1 120 VAL H 1 120 VAL MG1 3.160 . 3.160 2.283 2.251 2.302 . 0 0 "[ . 1 . 2]" 1
1920 1 120 VAL H 1 120 VAL MG2 4.000 . 4.000 2.380 2.336 2.473 . 0 0 "[ . 1 . 2]" 1
1921 1 120 VAL H 1 121 VAL H 3.620 . 3.620 2.660 2.596 2.874 . 0 0 "[ . 1 . 2]" 1
1922 1 120 VAL H 1 122 GLU H 4.500 . 4.500 4.115 3.994 4.182 . 0 0 "[ . 1 . 2]" 1
1923 1 120 VAL HA 1 120 VAL MG1 3.000 . 3.000 2.340 2.290 2.382 . 0 0 "[ . 1 . 2]" 1
1924 1 120 VAL HA 1 120 VAL MG2 3.470 . 3.470 3.290 3.275 3.306 . 0 0 "[ . 1 . 2]" 1
1925 1 120 VAL HA 1 123 GLN HB2 3.590 . 3.590 3.400 3.256 3.473 . 0 0 "[ . 1 . 2]" 1
1926 1 120 VAL HA 1 123 GLN HG2 5.300 . 5.300 5.294 5.205 5.308 0.008 15 0 "[ . 1 . 2]" 1
1927 1 120 VAL HB 1 121 VAL H 4.250 . 4.250 4.045 3.928 4.117 . 0 0 "[ . 1 . 2]" 1
1928 1 120 VAL MG2 1 121 VAL H 3.430 . 3.430 2.436 2.296 2.524 . 0 0 "[ . 1 . 2]" 1
1929 1 121 VAL H 1 121 VAL HB 3.440 . 3.440 2.643 2.498 3.471 0.031 13 0 "[ . 1 . 2]" 1
1930 1 121 VAL H 1 121 VAL QG 3.870 . 3.870 2.108 1.815 2.245 . 0 0 "[ . 1 . 2]" 1
1931 1 121 VAL H 1 122 GLU H 3.880 . 3.880 2.400 2.342 2.468 . 0 0 "[ . 1 . 2]" 1
1932 1 121 VAL H 1 122 GLU HG3 4.810 . 4.810 4.628 4.401 4.814 0.004 14 0 "[ . 1 . 2]" 1
1933 1 121 VAL H 1 123 GLN HB2 5.500 . 5.500 5.295 5.223 5.469 . 0 0 "[ . 1 . 2]" 1
1934 1 121 VAL HA 1 123 GLN H 4.720 . 4.720 4.350 4.240 4.458 . 0 0 "[ . 1 . 2]" 1
1935 1 121 VAL HA 1 124 MET H 4.790 . 4.790 3.297 3.132 3.451 . 0 0 "[ . 1 . 2]" 1
1936 1 121 VAL HA 1 124 MET HG3 3.540 . 3.540 2.936 2.613 3.112 . 0 0 "[ . 1 . 2]" 1
1937 1 121 VAL HB 1 122 GLU H 4.870 . 4.870 3.150 2.637 4.209 . 0 0 "[ . 1 . 2]" 1
1938 1 121 VAL QG 1 122 GLU H 4.330 . 4.330 2.974 2.304 3.313 . 0 0 "[ . 1 . 2]" 1
1939 1 121 VAL QG 1 123 GLN H 5.400 . 5.400 4.575 4.286 4.698 . 0 0 "[ . 1 . 2]" 1
1940 1 121 VAL QG 1 124 MET ME 3.220 . 3.220 2.085 1.965 2.217 . 0 0 "[ . 1 . 2]" 1
1941 1 122 GLU H 1 122 GLU HB2 3.490 . 3.490 2.320 2.240 2.469 . 0 0 "[ . 1 . 2]" 1
1942 1 122 GLU H 1 122 GLU HG3 3.190 . 3.190 2.656 2.443 2.865 . 0 0 "[ . 1 . 2]" 1
1943 1 122 GLU H 1 123 GLN H 4.040 . 4.040 2.826 2.731 2.901 . 0 0 "[ . 1 . 2]" 1
1944 1 122 GLU H 1 124 MET ME 5.220 . 5.220 4.905 4.802 5.025 . 0 0 "[ . 1 . 2]" 1
1945 1 122 GLU H 1 124 MET HG3 5.350 . 5.350 5.238 5.045 5.351 0.001 13 0 "[ . 1 . 2]" 1
1946 1 122 GLU HA 1 122 GLU HG3 3.020 . 3.020 2.872 2.786 2.974 . 0 0 "[ . 1 . 2]" 1
1947 1 122 GLU HA 1 124 MET H 4.870 . 4.870 4.430 4.282 4.503 . 0 0 "[ . 1 . 2]" 1
1948 1 122 GLU HA 1 125 CYS H 4.430 . 4.430 3.476 3.346 3.570 . 0 0 "[ . 1 . 2]" 1
1949 1 122 GLU HG2 1 123 GLN H 5.270 . 5.270 5.013 4.949 5.080 . 0 0 "[ . 1 . 2]" 1
1950 1 122 GLU HG3 1 123 GLN H 4.930 . 4.930 4.599 4.404 4.682 . 0 0 "[ . 1 . 2]" 1
1951 1 123 GLN H 1 123 GLN HB2 3.020 . 3.020 2.020 1.989 2.070 . 0 0 "[ . 1 . 2]" 1
1952 1 123 GLN H 1 123 GLN HE21 4.920 . 4.920 4.869 4.407 4.926 0.006 10 0 "[ . 1 . 2]" 1
1953 1 123 GLN H 1 123 GLN HE22 5.500 . 5.500 4.963 4.796 5.066 . 0 0 "[ . 1 . 2]" 1
1954 1 123 GLN H 1 123 GLN HG3 4.450 . 4.450 4.225 4.144 4.303 . 0 0 "[ . 1 . 2]" 1
1955 1 123 GLN H 1 124 MET H 3.890 . 3.890 2.832 2.774 2.866 . 0 0 "[ . 1 . 2]" 1
1956 1 123 GLN H 1 125 CYS H 4.650 . 4.650 4.224 4.155 4.324 . 0 0 "[ . 1 . 2]" 1
1957 1 123 GLN H 1 126 ILE MD 5.500 . 5.500 4.466 4.320 4.580 . 0 0 "[ . 1 . 2]" 1
1958 1 123 GLN HB2 1 123 GLN HE21 3.860 . 3.860 3.166 2.573 3.284 . 0 0 "[ . 1 . 2]" 1
1959 1 123 GLN HB2 1 123 GLN HE22 3.990 . 3.990 3.832 3.547 3.916 . 0 0 "[ . 1 . 2]" 1
1960 1 123 GLN HE21 1 123 GLN HG2 3.420 . 3.420 2.157 2.119 2.360 . 0 0 "[ . 1 . 2]" 1
1961 1 123 GLN HE22 1 123 GLN HG2 3.820 . 3.820 3.460 3.441 3.540 . 0 0 "[ . 1 . 2]" 1
1962 1 123 GLN HG2 1 124 MET H 5.230 . 5.230 5.083 4.995 5.173 . 0 0 "[ . 1 . 2]" 1
1963 1 123 GLN HG3 1 124 MET H 5.500 . 5.500 4.866 4.795 4.914 . 0 0 "[ . 1 . 2]" 1
1964 1 124 MET H 1 124 MET HB2 3.190 . 3.190 2.584 2.501 2.671 . 0 0 "[ . 1 . 2]" 1
1965 1 124 MET H 1 124 MET ME 3.930 . 3.930 3.515 3.451 3.623 . 0 0 "[ . 1 . 2]" 1
1966 1 124 MET H 1 124 MET HG2 4.630 . 4.630 3.096 2.958 3.208 . 0 0 "[ . 1 . 2]" 1
1967 1 124 MET H 1 124 MET HG3 4.900 . 4.900 1.921 1.833 2.027 . 0 0 "[ . 1 . 2]" 1
1968 1 124 MET H 1 125 CYS H 3.650 . 3.650 2.534 2.466 2.608 . 0 0 "[ . 1 . 2]" 1
1969 1 124 MET H 1 125 CYS QB 5.030 . 5.030 4.354 4.266 4.517 . 0 0 "[ . 1 . 2]" 1
1970 1 124 MET H 1 126 ILE H 3.950 . 3.950 3.787 3.731 3.864 . 0 0 "[ . 1 . 2]" 1
1971 1 124 MET HA 1 124 MET HG2 4.010 . 4.010 2.541 2.474 2.593 . 0 0 "[ . 1 . 2]" 1
1972 1 124 MET HA 1 127 THR H 4.040 . 4.040 3.138 3.085 3.202 . 0 0 "[ . 1 . 2]" 1
1973 1 124 MET HA 1 127 THR HB 3.350 . 3.350 2.231 2.137 2.405 . 0 0 "[ . 1 . 2]" 1
1974 1 124 MET HA 1 127 THR MG 3.520 . 3.520 3.424 3.284 3.528 0.008 7 0 "[ . 1 . 2]" 1
1975 1 124 MET HB3 1 125 CYS H 3.890 . 3.890 3.794 3.704 3.850 . 0 0 "[ . 1 . 2]" 1
1976 1 124 MET ME 1 124 MET HG2 3.530 . 3.530 3.428 3.378 3.447 . 0 0 "[ . 1 . 2]" 1
1977 1 124 MET ME 1 124 MET HG3 2.700 . 2.700 2.621 2.553 2.709 0.009 10 0 "[ . 1 . 2]" 1
1978 1 124 MET ME 1 125 CYS H 3.890 . 3.890 3.916 3.892 3.957 0.067 13 0 "[ . 1 . 2]" 1
1979 1 124 MET HG3 1 126 ILE H 5.500 . 5.500 5.528 5.508 5.554 0.054 12 0 "[ . 1 . 2]" 1
1980 1 125 CYS H 1 125 CYS HB2 3.920 . 3.920 2.440 2.393 2.479 . 0 0 "[ . 1 . 2]" 1
1981 1 125 CYS H 1 125 CYS QB 3.260 . 3.260 2.273 2.252 2.361 . 0 0 "[ . 1 . 2]" 1
1982 1 125 CYS H 1 125 CYS HB3 3.920 . 3.920 2.740 2.653 3.619 . 0 0 "[ . 1 . 2]" 1
1983 1 125 CYS H 1 126 ILE H 3.850 . 3.850 2.521 2.492 2.566 . 0 0 "[ . 1 . 2]" 1
1984 1 125 CYS H 1 126 ILE MD 4.250 . 4.250 4.271 4.252 4.303 0.053 14 0 "[ . 1 . 2]" 1
1985 1 125 CYS H 1 127 THR H 4.720 . 4.720 4.024 3.966 4.079 . 0 0 "[ . 1 . 2]" 1
1986 1 125 CYS H 1 128 GLN H 5.440 . 5.440 4.829 4.720 5.028 . 0 0 "[ . 1 . 2]" 1
1987 1 125 CYS HA 1 126 ILE HA 4.910 . 4.910 4.767 4.747 4.790 . 0 0 "[ . 1 . 2]" 1
1988 1 125 CYS HA 1 126 ILE MD 4.810 . 4.810 4.840 4.818 4.867 0.057 18 0 "[ . 1 . 2]" 1
1989 1 125 CYS HA 1 128 GLN H 4.270 . 4.270 3.254 3.056 3.426 . 0 0 "[ . 1 . 2]" 1
1990 1 125 CYS HA 1 128 GLN HB2 3.850 . 3.850 2.926 2.549 3.359 . 0 0 "[ . 1 . 2]" 1
1991 1 125 CYS HA 1 129 TYR H 4.660 . 4.660 3.948 3.823 4.046 . 0 0 "[ . 1 . 2]" 1
1992 1 125 CYS QB 1 126 ILE H 4.380 . 4.380 2.837 2.763 2.946 . 0 0 "[ . 1 . 2]" 1
1993 1 125 CYS QB 1 126 ILE MD 3.500 . 3.500 3.041 2.982 3.116 . 0 0 "[ . 1 . 2]" 1
1994 1 125 CYS QB 1 127 THR H 5.340 . 5.340 4.782 4.711 4.845 . 0 0 "[ . 1 . 2]" 1
1995 1 125 CYS HB2 1 126 ILE H 5.180 . 5.180 3.883 2.951 4.016 . 0 0 "[ . 1 . 2]" 1
1996 1 125 CYS HB3 1 126 ILE H 5.180 . 5.180 2.953 2.827 3.794 . 0 0 "[ . 1 . 2]" 1
1997 1 126 ILE H 1 126 ILE HB 3.300 . 3.300 2.186 2.165 2.223 . 0 0 "[ . 1 . 2]" 1
1998 1 126 ILE H 1 126 ILE MD 3.190 . 3.190 2.676 2.618 2.738 . 0 0 "[ . 1 . 2]" 1
1999 1 126 ILE H 1 126 ILE MG 3.740 . 3.740 3.554 3.515 3.596 . 0 0 "[ . 1 . 2]" 1
2000 1 126 ILE H 1 127 THR H 3.450 . 3.450 2.472 2.426 2.538 . 0 0 "[ . 1 . 2]" 1
2001 1 126 ILE H 1 128 GLN H 5.060 . 5.060 4.074 3.949 4.257 . 0 0 "[ . 1 . 2]" 1
2002 1 126 ILE H 1 129 TYR H 5.500 . 5.500 4.520 4.458 4.621 . 0 0 "[ . 1 . 2]" 1
2003 1 126 ILE HA 1 126 ILE MD 2.860 . 2.860 2.274 2.218 2.332 . 0 0 "[ . 1 . 2]" 1
2004 1 126 ILE HA 1 126 ILE MG 2.890 . 2.890 2.888 2.860 2.901 0.011 6 0 "[ . 1 . 2]" 1
2005 1 126 ILE HA 1 129 TYR H 4.770 . 4.770 3.119 3.063 3.171 . 0 0 "[ . 1 . 2]" 1
2006 1 126 ILE HA 1 129 TYR HA 5.040 . 5.040 4.901 4.810 5.002 . 0 0 "[ . 1 . 2]" 1
2007 1 126 ILE HA 1 129 TYR HB2 4.690 . 4.690 3.137 2.993 3.301 . 0 0 "[ . 1 . 2]" 1
2008 1 126 ILE HA 1 129 TYR HB3 4.390 . 4.390 2.089 2.007 2.149 . 0 0 "[ . 1 . 2]" 1
2009 1 126 ILE HA 1 129 TYR HD2 4.430 . 4.430 3.069 2.986 3.098 . 0 0 "[ . 1 . 2]" 1
2010 1 126 ILE HA 1 129 TYR HE2 5.500 . 5.500 5.502 5.434 5.514 0.014 18 0 "[ . 1 . 2]" 1
2011 1 126 ILE HA 1 130 LYS HD2 5.110 . 5.110 4.977 4.584 5.085 . 0 0 "[ . 1 . 2]" 1
2012 1 126 ILE HB 1 126 ILE MD 2.580 . 2.580 2.371 2.357 2.392 . 0 0 "[ . 1 . 2]" 1
2013 1 126 ILE HB 1 127 THR H 3.360 . 3.360 2.968 2.886 3.037 . 0 0 "[ . 1 . 2]" 1
2014 1 126 ILE HB 1 129 TYR HB3 5.130 . 5.130 5.006 4.906 5.076 . 0 0 "[ . 1 . 2]" 1
2015 1 126 ILE MD 1 127 THR H 4.230 . 4.230 4.310 4.270 4.351 0.121 6 0 "[ . 1 . 2]" 1
2016 1 126 ILE MD 1 129 TYR H 4.970 . 4.970 4.750 4.663 4.838 . 0 0 "[ . 1 . 2]" 1
2017 1 126 ILE MD 1 129 TYR HB2 4.580 . 4.580 4.072 3.897 4.191 . 0 0 "[ . 1 . 2]" 1
2018 1 126 ILE MD 1 129 TYR HB3 5.270 . 5.270 3.740 3.535 3.841 . 0 0 "[ . 1 . 2]" 1
2019 1 126 ILE MD 1 129 TYR HD2 4.380 . 4.380 3.583 3.354 3.754 . 0 0 "[ . 1 . 2]" 1
2020 1 126 ILE MD 1 129 TYR HE2 5.070 . 5.070 4.913 4.680 5.080 0.010 11 0 "[ . 1 . 2]" 1
2021 1 126 ILE HG13 1 129 TYR HB3 4.980 . 4.980 3.496 3.360 3.599 . 0 0 "[ . 1 . 2]" 1
2022 1 126 ILE HG13 1 129 TYR HD2 5.270 . 5.270 2.706 2.557 2.868 . 0 0 "[ . 1 . 2]" 1
2023 1 126 ILE HG13 1 130 LYS HD3 3.500 . 3.500 2.853 2.527 3.090 . 0 0 "[ . 1 . 2]" 1
2024 1 126 ILE MG 1 127 THR H 3.420 . 3.420 2.687 2.641 2.742 . 0 0 "[ . 1 . 2]" 1
2025 1 126 ILE MG 1 127 THR HA 3.590 . 3.590 2.956 2.895 3.048 . 0 0 "[ . 1 . 2]" 1
2026 1 126 ILE MG 1 127 THR HB 4.000 . 4.000 4.034 4.009 4.094 0.094 14 0 "[ . 1 . 2]" 1
2027 1 126 ILE MG 1 128 GLN H 4.680 . 4.680 4.667 4.613 4.714 0.034 6 0 "[ . 1 . 2]" 1
2028 1 126 ILE MG 1 129 TYR H 4.960 . 4.960 4.629 4.519 4.688 . 0 0 "[ . 1 . 2]" 1
2029 1 126 ILE MG 1 129 TYR HB3 4.500 . 4.500 3.898 3.805 4.021 . 0 0 "[ . 1 . 2]" 1
2030 1 126 ILE MG 1 129 TYR HD2 4.010 . 4.010 3.920 3.759 4.016 0.006 6 0 "[ . 1 . 2]" 1
2031 1 126 ILE MG 1 130 LYS H 4.440 . 4.440 3.693 3.582 3.783 . 0 0 "[ . 1 . 2]" 1
2032 1 126 ILE MG 1 130 LYS HD3 2.760 . 2.760 2.712 2.316 2.775 0.015 12 0 "[ . 1 . 2]" 1
2033 1 126 ILE MG 1 130 LYS QE 2.800 . 2.800 2.856 2.817 2.995 0.195 14 0 "[ . 1 . 2]" 1
2034 1 126 ILE MG 1 130 LYS HG2 3.240 . 3.240 2.296 2.158 2.547 . 0 0 "[ . 1 . 2]" 1
2035 1 126 ILE MG 1 130 LYS HG3 3.260 . 3.260 3.057 2.862 3.238 . 0 0 "[ . 1 . 2]" 1
2036 1 127 THR H 1 127 THR HB 3.440 . 3.440 2.112 2.091 2.131 . 0 0 "[ . 1 . 2]" 1
2037 1 127 THR H 1 127 THR MG 3.730 . 3.730 3.561 3.475 3.635 . 0 0 "[ . 1 . 2]" 1
2038 1 127 THR H 1 128 GLN H 3.560 . 3.560 2.821 2.756 2.900 . 0 0 "[ . 1 . 2]" 1
2039 1 127 THR H 1 128 GLN QG 4.670 . 4.670 4.618 4.428 4.683 0.013 2 0 "[ . 1 . 2]" 1
2040 1 127 THR HA 1 127 THR MG 3.170 . 3.170 2.855 2.733 2.932 . 0 0 "[ . 1 . 2]" 1
2041 1 127 THR HA 1 130 LYS HG2 3.970 . 3.970 3.657 3.406 3.832 . 0 0 "[ . 1 . 2]" 1
2042 1 127 THR HB 1 128 GLN H 4.130 . 4.130 3.094 2.880 3.240 . 0 0 "[ . 1 . 2]" 1
2043 1 127 THR HB 1 128 GLN HA 5.500 . 5.500 5.157 4.955 5.286 . 0 0 "[ . 1 . 2]" 1
2044 1 127 THR MG 1 128 GLN H 3.510 . 3.510 2.755 2.652 2.918 . 0 0 "[ . 1 . 2]" 1
2045 1 127 THR MG 1 128 GLN HA 3.210 . 3.210 3.232 3.218 3.253 0.043 18 0 "[ . 1 . 2]" 1
2046 1 127 THR MG 1 128 GLN QG 3.280 . 3.280 2.603 2.294 3.014 . 0 0 "[ . 1 . 2]" 1
2047 1 128 GLN H 1 128 GLN HB3 3.690 . 3.690 3.604 3.545 3.642 . 0 0 "[ . 1 . 2]" 1
2048 1 128 GLN H 1 128 GLN HE21 5.500 . 5.500 4.362 3.960 5.034 . 0 0 "[ . 1 . 2]" 1
2049 1 128 GLN H 1 128 GLN QE 4.720 . 4.720 4.188 3.875 4.665 . 0 0 "[ . 1 . 2]" 1
2050 1 128 GLN H 1 128 GLN HE22 5.500 . 5.500 5.479 5.356 5.528 0.028 6 0 "[ . 1 . 2]" 1
2051 1 128 GLN H 1 128 GLN QG 3.980 . 3.980 2.400 2.150 2.492 . 0 0 "[ . 1 . 2]" 1
2052 1 128 GLN HA 1 128 GLN QG 3.640 . 3.640 2.852 2.377 3.084 . 0 0 "[ . 1 . 2]" 1
2053 1 128 GLN HA 1 131 ARG QB 3.020 . 3.020 2.972 2.654 3.076 0.056 12 0 "[ . 1 . 2]" 1
2054 1 128 GLN HA 1 131 ARG QG 4.570 . 4.570 4.197 3.451 4.651 0.081 18 0 "[ . 1 . 2]" 1
2055 1 128 GLN HA 1 132 GLU H 5.270 . 5.270 4.915 4.415 5.226 . 0 0 "[ . 1 . 2]" 1
2056 1 128 GLN HB2 1 129 TYR H 4.660 . 4.660 2.640 2.513 2.774 . 0 0 "[ . 1 . 2]" 1
2057 1 128 GLN HB2 1 130 LYS H 5.500 . 5.500 5.442 5.351 5.504 0.004 10 0 "[ . 1 . 2]" 1
2058 1 128 GLN QG 1 129 TYR H 4.420 . 4.420 4.090 3.890 4.190 . 0 0 "[ . 1 . 2]" 1
2059 1 129 TYR H 1 129 TYR HD1 5.500 . 5.500 4.744 4.675 4.792 . 0 0 "[ . 1 . 2]" 1
2060 1 129 TYR H 1 129 TYR HD2 5.500 . 5.500 4.693 4.633 4.772 . 0 0 "[ . 1 . 2]" 1
2061 1 129 TYR H 1 130 LYS H 3.780 . 3.780 2.996 2.859 3.068 . 0 0 "[ . 1 . 2]" 1
2062 1 129 TYR H 1 130 LYS HG2 4.780 . 4.780 4.677 4.558 4.783 0.003 13 0 "[ . 1 . 2]" 1
2063 1 129 TYR HA 1 129 TYR HD1 3.950 . 3.950 2.310 2.204 2.369 . 0 0 "[ . 1 . 2]" 1
2064 1 129 TYR HA 1 129 TYR HE1 4.830 . 4.830 4.729 4.622 4.799 . 0 0 "[ . 1 . 2]" 1
2065 1 129 TYR HA 1 132 GLU QB 4.950 . 4.950 3.530 2.844 4.958 0.008 15 0 "[ . 1 . 2]" 1
2066 1 129 TYR HA 1 132 GLU HG2 5.500 . 5.500 4.113 2.676 5.084 . 0 0 "[ . 1 . 2]" 1
2067 1 129 TYR HA 1 132 GLU QG 4.830 . 4.830 3.912 2.599 4.694 . 0 0 "[ . 1 . 2]" 1
2068 1 129 TYR HA 1 132 GLU HG3 5.500 . 5.500 4.956 3.422 5.515 0.015 1 0 "[ . 1 . 2]" 1
2069 1 129 TYR HA 1 133 SER H 4.840 . 4.840 4.042 3.864 4.278 . 0 0 "[ . 1 . 2]" 1
2070 1 129 TYR HB2 1 129 TYR HE1 4.980 . 4.980 4.987 4.966 4.993 0.013 2 0 "[ . 1 . 2]" 1
2071 1 129 TYR HB2 1 130 LYS H 4.270 . 4.270 3.932 3.861 4.011 . 0 0 "[ . 1 . 2]" 1
2072 1 129 TYR HB3 1 130 LYS HD2 3.960 . 3.960 3.941 3.455 3.975 0.015 18 0 "[ . 1 . 2]" 1
2073 1 129 TYR HB3 1 133 SER HB3 5.440 . 5.440 4.887 4.625 5.312 . 0 0 "[ . 1 . 2]" 1
2074 1 129 TYR HD1 1 133 SER HB3 5.190 . 5.190 3.414 3.214 4.272 . 0 0 "[ . 1 . 2]" 1
2075 1 129 TYR HD2 1 130 LYS H 4.780 . 4.780 3.745 3.645 3.874 . 0 0 "[ . 1 . 2]" 1
2076 1 129 TYR HD2 1 130 LYS HA 4.540 . 4.540 4.322 4.223 4.449 . 0 0 "[ . 1 . 2]" 1
2077 1 129 TYR HD2 1 130 LYS HB3 5.500 . 5.500 5.511 5.503 5.521 0.021 12 0 "[ . 1 . 2]" 1
2078 1 129 TYR HD2 1 130 LYS HD3 3.840 . 3.840 2.087 2.002 2.266 . 0 0 "[ . 1 . 2]" 1
2079 1 129 TYR HD2 1 130 LYS HG2 4.860 . 4.860 4.024 3.919 4.250 . 0 0 "[ . 1 . 2]" 1
2080 1 129 TYR HD2 1 130 LYS HG3 5.010 . 5.010 4.916 4.861 4.961 . 0 0 "[ . 1 . 2]" 1
2081 1 129 TYR HE1 1 130 LYS HA 5.500 . 5.500 5.417 5.302 5.505 0.005 8 0 "[ . 1 . 2]" 1
2082 1 129 TYR HE1 1 133 SER HB2 4.130 . 4.130 3.280 2.705 3.829 . 0 0 "[ . 1 . 2]" 1
2083 1 129 TYR HE1 1 133 SER HB3 4.160 . 4.160 3.303 3.017 4.164 0.004 6 0 "[ . 1 . 2]" 1
2084 1 129 TYR HE2 1 130 LYS HA 5.500 . 5.500 5.006 4.904 5.142 . 0 0 "[ . 1 . 2]" 1
2085 1 129 TYR HE2 1 130 LYS HD2 3.920 . 3.920 3.537 3.463 3.634 . 0 0 "[ . 1 . 2]" 1
2086 1 129 TYR HE2 1 130 LYS HD3 4.210 . 4.210 3.607 3.507 3.913 . 0 0 "[ . 1 . 2]" 1
2087 1 129 TYR HE2 1 130 LYS QE 4.490 . 4.490 3.551 3.021 4.402 . 0 0 "[ . 1 . 2]" 1
2088 1 130 LYS H 1 130 LYS HB3 3.560 . 3.560 3.585 3.569 3.598 0.038 12 0 "[ . 1 . 2]" 1
2089 1 130 LYS H 1 130 LYS HD2 3.280 . 3.280 3.209 2.868 3.276 . 0 0 "[ . 1 . 2]" 1
2090 1 130 LYS H 1 130 LYS HE2 5.500 . 5.500 5.077 4.878 5.239 . 0 0 "[ . 1 . 2]" 1
2091 1 130 LYS H 1 130 LYS QE 4.750 . 4.750 4.472 4.408 4.532 . 0 0 "[ . 1 . 2]" 1
2092 1 130 LYS H 1 130 LYS HE3 5.500 . 5.500 4.978 4.873 5.115 . 0 0 "[ . 1 . 2]" 1
2093 1 130 LYS H 1 130 LYS HG2 3.820 . 3.820 2.213 2.076 2.363 . 0 0 "[ . 1 . 2]" 1
2094 1 130 LYS H 1 131 ARG QB 4.700 . 4.700 4.468 4.271 4.705 0.005 12 0 "[ . 1 . 2]" 1
2095 1 130 LYS H 1 132 GLU H 4.900 . 4.900 4.284 4.100 4.552 . 0 0 "[ . 1 . 2]" 1
2096 1 130 LYS H 1 133 SER H 4.770 . 4.770 4.530 4.450 4.620 . 0 0 "[ . 1 . 2]" 1
2097 1 130 LYS HA 1 130 LYS HB3 2.820 . 2.820 2.338 2.308 2.375 . 0 0 "[ . 1 . 2]" 1
2098 1 130 LYS HA 1 130 LYS HD2 2.980 . 2.980 2.170 2.109 2.234 . 0 0 "[ . 1 . 2]" 1
2099 1 130 LYS HA 1 130 LYS HG2 3.660 . 3.660 3.578 3.529 3.637 . 0 0 "[ . 1 . 2]" 1
2100 1 130 LYS HA 1 132 GLU H 5.500 . 5.500 3.983 3.797 4.150 . 0 0 "[ . 1 . 2]" 1
2101 1 130 LYS HA 1 133 SER HB3 3.890 . 3.890 2.418 1.890 2.645 . 0 0 "[ . 1 . 2]" 1
2102 1 130 LYS HA 1 136 TYR HE2 5.500 . 5.500 5.519 5.508 5.532 0.032 6 0 "[ . 1 . 2]" 1
2103 1 130 LYS HB3 1 130 LYS HG3 2.900 . 2.900 2.339 2.296 2.373 . 0 0 "[ . 1 . 2]" 1
2104 1 130 LYS HB3 1 133 SER HB3 5.060 . 5.060 4.640 3.940 4.820 . 0 0 "[ . 1 . 2]" 1
2105 1 130 LYS HD2 1 133 SER HB2 4.780 . 4.780 4.349 4.162 4.701 . 0 0 "[ . 1 . 2]" 1
2106 1 130 LYS HD2 1 133 SER HB3 4.490 . 4.490 3.540 3.280 3.787 . 0 0 "[ . 1 . 2]" 1
2107 1 130 LYS HD3 1 130 LYS HG2 2.660 . 2.660 2.214 2.199 2.241 . 0 0 "[ . 1 . 2]" 1
2108 1 131 ARG HA 1 131 ARG QG 2.840 . 2.840 2.445 2.232 2.855 0.015 19 0 "[ . 1 . 2]" 1
2109 1 131 ARG HA 1 134 GLN H 4.410 . 4.410 4.118 3.847 4.366 . 0 0 "[ . 1 . 2]" 1
2110 1 131 ARG QB 1 132 GLU H 3.810 . 3.810 2.751 2.545 2.940 . 0 0 "[ . 1 . 2]" 1
2111 1 132 GLU H 1 132 GLU HB2 4.080 . 4.080 2.749 2.346 3.762 . 0 0 "[ . 1 . 2]" 1
2112 1 132 GLU H 1 132 GLU HB3 4.080 . 4.080 3.024 2.469 3.716 . 0 0 "[ . 1 . 2]" 1
2113 1 132 GLU H 1 132 GLU HG2 5.360 . 5.360 3.445 1.798 4.645 . 0 0 "[ . 1 . 2]" 1
2114 1 132 GLU H 1 132 GLU QG 4.500 . 4.500 3.147 1.792 4.052 . 0 0 "[ . 1 . 2]" 1
2115 1 132 GLU H 1 132 GLU HG3 5.360 . 5.360 4.090 3.431 4.492 . 0 0 "[ . 1 . 2]" 1
2116 1 132 GLU H 1 134 GLN H 4.500 . 4.500 4.010 3.861 4.172 . 0 0 "[ . 1 . 2]" 1
2117 1 132 GLU HA 1 135 ALA MB 3.380 . 3.380 3.269 2.918 3.404 0.024 7 0 "[ . 1 . 2]" 1
2118 1 132 GLU HA 1 136 TYR H 5.500 . 5.500 5.276 4.962 5.430 . 0 0 "[ . 1 . 2]" 1
2119 1 132 GLU QB 1 133 SER H 4.150 . 4.150 2.821 2.493 3.714 . 0 0 "[ . 1 . 2]" 1
2120 1 132 GLU QB 1 133 SER HA 4.550 . 4.550 3.911 3.653 4.557 0.007 8 0 "[ . 1 . 2]" 1
2121 1 132 GLU QG 1 133 SER H 4.720 . 4.720 3.708 2.470 4.107 . 0 0 "[ . 1 . 2]" 1
2122 1 132 GLU HG2 1 133 SER H 5.500 . 5.500 4.221 2.488 5.074 . 0 0 "[ . 1 . 2]" 1
2123 1 132 GLU HG3 1 133 SER H 5.500 . 5.500 4.400 2.989 5.295 . 0 0 "[ . 1 . 2]" 1
2124 1 133 SER H 1 133 SER HB2 3.830 . 3.830 3.467 2.907 3.566 . 0 0 "[ . 1 . 2]" 1
2125 1 133 SER H 1 133 SER HB3 3.870 . 3.870 2.203 2.045 2.300 . 0 0 "[ . 1 . 2]" 1
2126 1 133 SER H 1 134 GLN H 3.550 . 3.550 2.700 2.640 2.775 . 0 0 "[ . 1 . 2]" 1
2127 1 133 SER H 1 134 GLN HB3 5.110 . 5.110 4.958 4.802 5.061 . 0 0 "[ . 1 . 2]" 1
2128 1 133 SER H 1 136 TYR HD2 5.460 . 5.460 4.917 4.796 5.034 . 0 0 "[ . 1 . 2]" 1
2129 1 133 SER HA 1 135 ALA MB 4.420 . 4.420 4.422 4.345 4.450 0.030 19 0 "[ . 1 . 2]" 1
2130 1 133 SER HA 1 136 TYR H 4.080 . 4.080 3.244 3.201 3.302 . 0 0 "[ . 1 . 2]" 1
2131 1 133 SER HA 1 136 TYR HB3 3.930 . 3.930 3.933 3.923 3.939 0.009 7 0 "[ . 1 . 2]" 1
2132 1 133 SER HA 1 136 TYR HD2 3.500 . 3.500 2.185 2.085 2.303 . 0 0 "[ . 1 . 2]" 1
2133 1 133 SER HA 1 136 TYR HE2 4.020 . 4.020 2.718 2.556 2.944 . 0 0 "[ . 1 . 2]" 1
2134 1 133 SER HA 1 137 TYR H 4.610 . 4.610 4.317 4.209 4.439 . 0 0 "[ . 1 . 2]" 1
2135 1 133 SER HA 1 137 TYR HB2 5.140 . 5.140 5.055 4.909 5.146 0.006 18 0 "[ . 1 . 2]" 1
2136 1 133 SER HB2 1 136 TYR HE2 4.070 . 4.070 1.922 1.862 2.183 . 0 0 "[ . 1 . 2]" 1
2137 1 133 SER HB3 1 134 GLN H 4.660 . 4.660 3.759 3.074 3.934 . 0 0 "[ . 1 . 2]" 1
2138 1 133 SER HB3 1 136 TYR HE2 4.410 . 4.410 3.317 3.019 3.746 . 0 0 "[ . 1 . 2]" 1
2139 1 134 GLN H 1 134 GLN HB3 2.870 . 2.870 2.462 2.321 2.499 . 0 0 "[ . 1 . 2]" 1
2140 1 134 GLN H 1 134 GLN HG2 4.180 . 4.180 2.223 2.107 2.576 . 0 0 "[ . 1 . 2]" 1
2141 1 134 GLN HA 1 134 GLN HB2 2.400 . 2.400 2.397 2.343 2.407 0.007 10 0 "[ . 1 . 2]" 1
2142 1 134 GLN HA 1 134 GLN HB3 2.850 . 2.850 2.496 2.463 2.583 . 0 0 "[ . 1 . 2]" 1
2143 1 134 GLN HA 1 134 GLN HG2 4.110 . 4.110 3.742 3.718 3.768 . 0 0 "[ . 1 . 2]" 1
2144 1 134 GLN HA 1 134 GLN HG3 3.970 . 3.970 3.787 3.732 3.816 . 0 0 "[ . 1 . 2]" 1
2145 1 134 GLN HA 1 137 TYR H 3.620 . 3.620 3.346 3.265 3.443 . 0 0 "[ . 1 . 2]" 1
2146 1 134 GLN HA 1 137 TYR HB2 3.340 . 3.340 2.938 2.743 3.092 . 0 0 "[ . 1 . 2]" 1
2147 1 134 GLN HA 1 137 TYR HB3 3.470 . 3.470 2.591 2.500 2.666 . 0 0 "[ . 1 . 2]" 1
2148 1 134 GLN HA 1 138 GLN HE21 5.160 . 5.160 5.142 5.029 5.170 0.010 3 0 "[ . 1 . 2]" 1
2149 1 134 GLN HA 1 138 GLN HG2 4.440 . 4.440 4.141 3.954 4.308 . 0 0 "[ . 1 . 2]" 1
2150 1 134 GLN HB2 1 134 GLN HG3 2.640 . 2.640 2.411 2.379 2.426 . 0 0 "[ . 1 . 2]" 1
2151 1 134 GLN HB2 1 137 TYR HB3 4.650 . 4.650 4.152 3.984 4.317 . 0 0 "[ . 1 . 2]" 1
2152 1 134 GLN HB3 1 134 GLN HG2 2.830 . 2.830 2.527 2.508 2.572 . 0 0 "[ . 1 . 2]" 1
2153 1 134 GLN HB3 1 137 TYR HB3 5.340 . 5.340 4.923 4.792 5.048 . 0 0 "[ . 1 . 2]" 1
2154 1 134 GLN HE21 1 134 GLN HG2 3.150 . 3.150 2.817 2.197 3.166 0.016 3 0 "[ . 1 . 2]" 1
2155 1 134 GLN HE21 1 135 ALA MB 4.440 . 4.440 4.432 4.304 4.466 0.026 12 0 "[ . 1 . 2]" 1
2156 1 134 GLN HG2 1 135 ALA H 4.450 . 4.450 2.691 2.534 2.761 . 0 0 "[ . 1 . 2]" 1
2157 1 134 GLN HG2 1 135 ALA MB 3.750 . 3.750 3.641 3.282 3.748 . 0 0 "[ . 1 . 2]" 1
2158 1 134 GLN HG3 1 135 ALA MB 4.040 . 4.040 3.477 3.375 3.667 . 0 0 "[ . 1 . 2]" 1
2159 1 135 ALA H 1 135 ALA MB 2.900 . 2.900 2.251 2.241 2.258 . 0 0 "[ . 1 . 2]" 1
2160 1 135 ALA H 1 136 TYR H 3.390 . 3.390 2.588 2.543 2.642 . 0 0 "[ . 1 . 2]" 1
2161 1 135 ALA H 1 136 TYR HB3 5.000 . 5.000 4.982 4.929 5.002 0.002 14 0 "[ . 1 . 2]" 1
2162 1 135 ALA H 1 137 TYR H 4.220 . 4.220 3.687 3.619 3.767 . 0 0 "[ . 1 . 2]" 1
2163 1 135 ALA H 1 138 GLN H 4.440 . 4.440 4.463 4.448 4.485 0.045 12 0 "[ . 1 . 2]" 1
2164 1 135 ALA HA 1 138 GLN HB2 2.790 . 2.790 2.577 2.492 2.741 . 0 0 "[ . 1 . 2]" 1
2165 1 135 ALA MB 1 136 TYR H 3.430 . 3.430 2.596 2.544 2.648 . 0 0 "[ . 1 . 2]" 1
2166 1 135 ALA MB 1 137 TYR H 4.310 . 4.310 4.295 4.272 4.316 0.006 12 0 "[ . 1 . 2]" 1
2167 1 135 ALA MB 1 138 GLN H 4.650 . 4.650 4.504 4.439 4.602 . 0 0 "[ . 1 . 2]" 1
2168 1 136 TYR H 1 136 TYR HB3 3.380 . 3.380 2.515 2.476 2.554 . 0 0 "[ . 1 . 2]" 1
2169 1 136 TYR H 1 136 TYR HD2 4.050 . 4.050 3.170 3.073 3.267 . 0 0 "[ . 1 . 2]" 1
2170 1 136 TYR H 1 137 TYR H 3.410 . 3.410 2.437 2.379 2.483 . 0 0 "[ . 1 . 2]" 1
2171 1 136 TYR H 1 138 GLN H 4.470 . 4.470 4.111 4.025 4.151 . 0 0 "[ . 1 . 2]" 1
2172 1 136 TYR HA 1 136 TYR HB3 3.020 . 3.020 2.570 2.544 2.594 . 0 0 "[ . 1 . 2]" 1
2173 1 136 TYR HA 1 136 TYR HD1 3.840 . 3.840 3.846 3.842 3.851 0.011 19 0 "[ . 1 . 2]" 1
2174 1 136 TYR HB2 1 136 TYR HD1 3.130 . 3.130 2.743 2.701 2.792 . 0 0 "[ . 1 . 2]" 1
2175 1 136 TYR HB2 1 137 TYR H 4.680 . 4.680 4.189 4.157 4.215 . 0 0 "[ . 1 . 2]" 1
2176 1 136 TYR HB3 1 136 TYR HD2 3.170 . 3.170 2.305 2.291 2.328 . 0 0 "[ . 1 . 2]" 1
2177 1 136 TYR HB3 1 136 TYR HE2 4.650 . 4.650 4.654 4.647 4.665 0.015 18 0 "[ . 1 . 2]" 1
2178 1 136 TYR HD1 1 137 TYR H 4.760 . 4.760 3.437 3.288 3.565 . 0 0 "[ . 1 . 2]" 1
2179 1 136 TYR HD1 1 137 TYR HA 3.820 . 3.820 2.733 2.646 2.832 . 0 0 "[ . 1 . 2]" 1
2180 1 136 TYR HD1 1 137 TYR HD2 4.470 . 4.470 4.192 4.128 4.248 . 0 0 "[ . 1 . 2]" 1
2181 1 136 TYR HD1 1 138 GLN H 5.500 . 5.500 5.290 5.166 5.402 . 0 0 "[ . 1 . 2]" 1
2182 1 136 TYR HD2 1 137 TYR H 4.450 . 4.450 4.322 4.139 4.451 0.001 9 0 "[ . 1 . 2]" 1
2183 1 136 TYR HE1 1 137 TYR HA 3.550 . 3.550 3.549 3.510 3.559 0.009 6 0 "[ . 1 . 2]" 1
2184 1 136 TYR HE1 1 137 TYR HB2 3.980 . 3.980 3.690 3.548 3.805 . 0 0 "[ . 1 . 2]" 1
2185 1 136 TYR HE1 1 137 TYR HD2 2.700 . 2.700 2.707 2.702 2.715 0.015 10 0 "[ . 1 . 2]" 1
2186 1 137 TYR H 1 137 TYR HB2 3.260 . 3.260 2.347 2.299 2.388 . 0 0 "[ . 1 . 2]" 1
2187 1 137 TYR H 1 137 TYR HB3 3.090 . 3.090 2.718 2.663 2.785 . 0 0 "[ . 1 . 2]" 1
2188 1 137 TYR H 1 137 TYR HD2 4.610 . 4.610 4.470 4.387 4.532 . 0 0 "[ . 1 . 2]" 1
2189 1 137 TYR H 1 138 GLN H 3.180 . 3.180 2.535 2.504 2.563 . 0 0 "[ . 1 . 2]" 1
2190 1 137 TYR H 1 138 GLN HB2 4.520 . 4.520 4.527 4.521 4.534 0.014 12 0 "[ . 1 . 2]" 1
2191 1 137 TYR H 1 138 GLN HG2 5.000 . 5.000 4.777 4.679 4.896 . 0 0 "[ . 1 . 2]" 1
2192 1 137 TYR HA 1 137 TYR HB2 2.800 . 2.800 2.582 2.559 2.606 . 0 0 "[ . 1 . 2]" 1
2193 1 137 TYR HA 1 137 TYR HD2 3.350 . 3.350 3.144 3.076 3.226 . 0 0 "[ . 1 . 2]" 1
2194 1 137 TYR HB2 1 137 TYR HD2 2.960 . 2.960 2.410 2.387 2.435 . 0 0 "[ . 1 . 2]" 1
2195 1 137 TYR HB2 1 138 GLN H 3.890 . 3.890 3.688 3.636 3.737 . 0 0 "[ . 1 . 2]" 1
2196 1 137 TYR HB2 1 138 GLN HG2 5.500 . 5.500 5.150 5.049 5.284 . 0 0 "[ . 1 . 2]" 1
2197 1 137 TYR HB3 1 137 TYR HD1 2.920 . 2.920 2.521 2.481 2.560 . 0 0 "[ . 1 . 2]" 1
2198 1 137 TYR HB3 1 138 GLN H 3.520 . 3.520 2.589 2.544 2.706 . 0 0 "[ . 1 . 2]" 1
2199 1 137 TYR HB3 1 138 GLN HE21 3.970 . 3.970 3.799 3.708 3.847 . 0 0 "[ . 1 . 2]" 1
2200 1 137 TYR HB3 1 138 GLN HE22 5.500 . 5.500 5.498 5.447 5.506 0.006 6 0 "[ . 1 . 2]" 1
2201 1 137 TYR HD1 1 138 GLN H 4.420 . 4.420 3.942 3.839 4.167 . 0 0 "[ . 1 . 2]" 1
2202 1 137 TYR HD1 1 138 GLN HA 3.940 . 3.940 3.506 3.324 3.663 . 0 0 "[ . 1 . 2]" 1
2203 1 137 TYR HD1 1 138 GLN HG2 4.770 . 4.770 3.993 3.758 4.421 . 0 0 "[ . 1 . 2]" 1
2204 1 137 TYR HD1 1 139 ARG H 5.500 . 5.500 5.510 5.503 5.520 0.020 10 0 "[ . 1 . 2]" 1
2205 1 137 TYR HD1 1 140 GLY H 5.500 . 5.500 4.987 4.838 5.122 . 0 0 "[ . 1 . 2]" 1
2206 1 138 GLN H 1 138 GLN HB2 2.780 . 2.780 2.280 2.240 2.319 . 0 0 "[ . 1 . 2]" 1
2207 1 138 GLN H 1 138 GLN HE21 4.890 . 4.890 3.949 3.803 4.074 . 0 0 "[ . 1 . 2]" 1
2208 1 138 GLN H 1 138 GLN HG2 3.280 . 3.280 2.633 2.558 2.729 . 0 0 "[ . 1 . 2]" 1
2209 1 138 GLN HA 1 138 GLN HB3 2.700 . 2.700 2.589 2.568 2.613 . 0 0 "[ . 1 . 2]" 1
2210 1 138 GLN HA 1 138 GLN HE21 4.100 . 4.100 2.751 2.477 2.917 . 0 0 "[ . 1 . 2]" 1
2211 1 138 GLN HA 1 138 GLN HE22 3.940 . 3.940 3.396 3.327 3.476 . 0 0 "[ . 1 . 2]" 1
2212 1 138 GLN HA 1 138 GLN HG2 2.880 . 2.880 2.839 2.798 2.872 . 0 0 "[ . 1 . 2]" 1
2213 1 138 GLN HA 1 140 GLY H 4.040 . 4.040 3.563 3.389 3.782 . 0 0 "[ . 1 . 2]" 1
2214 1 138 GLN HB2 1 138 GLN HG2 2.880 . 2.880 2.517 2.482 2.544 . 0 0 "[ . 1 . 2]" 1
2215 1 138 GLN HB2 1 138 GLN HG3 2.980 . 2.980 2.412 2.390 2.438 . 0 0 "[ . 1 . 2]" 1
2216 1 138 GLN HB2 1 139 ARG H 3.310 . 3.310 3.113 2.915 3.294 . 0 0 "[ . 1 . 2]" 1
2217 1 138 GLN HB2 1 140 GLY H 5.500 . 5.500 5.027 4.950 5.379 . 0 0 "[ . 1 . 2]" 1
2218 1 138 GLN HB3 1 138 GLN HE21 4.190 . 4.190 4.122 3.948 4.198 0.008 20 0 "[ . 1 . 2]" 1
2219 1 138 GLN HB3 1 138 GLN HG3 3.000 . 3.000 2.504 2.448 2.531 . 0 0 "[ . 1 . 2]" 1
2220 1 138 GLN HB3 1 140 GLY H 5.500 . 5.500 5.092 4.977 5.301 . 0 0 "[ . 1 . 2]" 1
2221 1 138 GLN HG2 1 139 ARG H 5.130 . 5.130 4.747 4.639 4.888 . 0 0 "[ . 1 . 2]" 1
2222 1 139 ARG H 1 139 ARG HB2 3.320 . 3.320 2.059 1.938 2.474 . 0 0 "[ . 1 . 2]" 1
2223 1 139 ARG H 1 139 ARG QB 2.730 . 2.730 2.011 1.852 2.058 . 0 0 "[ . 1 . 2]" 1
2224 1 139 ARG H 1 139 ARG HB3 3.320 . 3.320 3.241 1.913 3.379 0.059 18 0 "[ . 1 . 2]" 1
2225 1 139 ARG H 1 139 ARG QD 4.880 . 4.880 4.227 2.461 4.520 . 0 0 "[ . 1 . 2]" 1
2226 1 139 ARG H 1 139 ARG QG 3.280 . 3.280 3.277 2.887 3.475 0.195 17 0 "[ . 1 . 2]" 1
2227 1 139 ARG H 1 140 GLY H 3.390 . 3.390 2.574 2.400 2.731 . 0 0 "[ . 1 . 2]" 1
2228 1 139 ARG H 1 141 SER H 4.860 . 4.860 4.204 3.420 4.439 . 0 0 "[ . 1 . 2]" 1
2229 1 139 ARG HA 1 139 ARG QB 2.610 . 2.610 2.530 2.290 2.555 . 0 0 "[ . 1 . 2]" 1
2230 1 139 ARG HA 1 139 ARG HD2 3.350 . 3.350 3.036 2.074 3.353 0.003 1 0 "[ . 1 . 2]" 1
2231 1 139 ARG HA 1 139 ARG QD 2.710 . 2.710 2.151 2.004 2.715 0.005 9 0 "[ . 1 . 2]" 1
2232 1 139 ARG HA 1 139 ARG HD3 3.350 . 3.350 2.404 2.026 3.365 0.015 18 0 "[ . 1 . 2]" 1
2233 1 139 ARG HA 1 139 ARG QG 2.870 . 2.870 2.458 2.132 2.916 0.046 17 0 "[ . 1 . 2]" 1
2234 1 139 ARG HA 1 141 SER H 4.310 . 4.310 3.644 3.332 4.314 0.004 16 0 "[ . 1 . 2]" 1
2235 1 139 ARG QB 1 139 ARG QD 2.370 . 2.370 2.277 2.158 2.514 0.144 10 0 "[ . 1 . 2]" 1
2236 1 139 ARG QB 1 139 ARG QG 2.250 . 2.250 1.995 1.871 2.025 . 0 0 "[ . 1 . 2]" 1
2237 1 139 ARG QB 1 140 GLY H 3.600 . 3.600 3.158 2.835 3.343 . 0 0 "[ . 1 . 2]" 1
2238 1 139 ARG HB2 1 140 GLY H 4.340 . 4.340 3.543 3.257 4.236 . 0 0 "[ . 1 . 2]" 1
2239 1 139 ARG HB2 1 141 SER H 5.500 . 5.500 4.999 3.085 5.502 0.002 11 0 "[ . 1 . 2]" 1
2240 1 139 ARG HB3 1 140 GLY H 4.340 . 4.340 3.587 3.118 3.923 . 0 0 "[ . 1 . 2]" 1
2241 1 139 ARG HB3 1 141 SER H 5.500 . 5.500 4.673 2.202 5.388 . 0 0 "[ . 1 . 2]" 1
2242 1 139 ARG QD 1 139 ARG QG 2.340 . 2.340 2.102 2.037 2.121 . 0 0 "[ . 1 . 2]" 1
2243 1 139 ARG QD 1 140 GLY H 5.340 . 5.340 4.742 4.413 5.016 . 0 0 "[ . 1 . 2]" 1
2244 1 139 ARG QD 1 141 SER H 5.340 . 5.340 4.829 3.440 5.352 0.012 11 0 "[ . 1 . 2]" 1
2245 1 139 ARG QG 1 140 GLY H 4.890 . 4.890 4.689 3.766 4.841 . 0 0 "[ . 1 . 2]" 1
2246 1 141 SER H 1 141 SER QB 3.580 . 3.580 2.796 2.246 3.420 . 0 0 "[ . 1 . 2]" 1
2247 1 142 SER HA 1 142 SER QB 2.310 . 2.310 2.296 2.208 2.344 0.034 19 0 "[ . 1 . 2]" 1
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