NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
520040 |
2lfs   |
17776 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lfs
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 1536
_Distance_constraint_stats_list.Viol_count 5813
_Distance_constraint_stats_list.Viol_total 4870.716
_Distance_constraint_stats_list.Viol_max 0.898
_Distance_constraint_stats_list.Viol_rms 0.0473
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0088
_Distance_constraint_stats_list.Viol_average_violations_only 0.0441
_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 6 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 7 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 8 ARG 0.835 0.031 7 0 "[ . 1 . ]"
1 9 PRO 1.961 0.054 14 0 "[ . 1 . ]"
1 10 ILE 0.784 0.052 17 0 "[ . 1 . ]"
1 11 ILE 0.612 0.031 7 0 "[ . 1 . ]"
1 12 GLU 1.907 0.054 14 0 "[ . 1 . ]"
1 13 LEU 1.844 0.052 17 0 "[ . 1 . ]"
1 14 SER 2.282 0.056 12 0 "[ . 1 . ]"
1 15 ASN 1.951 0.056 12 0 "[ . 1 . ]"
1 16 THR 1.455 0.042 2 0 "[ . 1 . ]"
1 17 PHE 36.437 0.602 3 19 [**+*******-********]
1 18 ASP 2.452 0.061 8 0 "[ . 1 . ]"
1 19 LYS 2.455 0.061 8 0 "[ . 1 . ]"
1 20 ILE 1.762 0.054 6 0 "[ . 1 . ]"
1 21 ALA 0.839 0.033 13 0 "[ . 1 . ]"
1 22 GLU 1.997 0.076 19 0 "[ . 1 . ]"
1 23 GLY 1.270 0.076 19 0 "[ . 1 . ]"
1 24 ASN 0.615 0.037 13 0 "[ . 1 . ]"
1 25 LEU 0.074 0.012 8 0 "[ . 1 . ]"
1 26 GLU 0.073 0.012 8 0 "[ . 1 . ]"
1 27 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 28 GLU 3.743 0.295 18 0 "[ . 1 . ]"
1 29 VAL 0.006 0.004 1 0 "[ . 1 . ]"
1 30 PRO 1.514 0.053 17 0 "[ . 1 . ]"
1 31 HIS 7.861 0.344 2 0 "[ . 1 . ]"
1 32 GLN 0.673 0.040 6 0 "[ . 1 . ]"
1 33 ASN 0.735 0.040 6 0 "[ . 1 . ]"
1 34 ARG 0.096 0.009 1 0 "[ . 1 . ]"
1 35 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 36 ASP 1.131 0.027 11 0 "[ . 1 . ]"
1 37 GLU 0.393 0.022 11 0 "[ . 1 . ]"
1 38 ILE 0.713 0.027 12 0 "[ . 1 . ]"
1 39 GLY 0.623 0.027 11 0 "[ . 1 . ]"
1 40 ILE 0.277 0.015 18 0 "[ . 1 . ]"
1 41 LEU 9.526 0.440 4 0 "[ . 1 . ]"
1 42 ALA 6.779 0.344 2 0 "[ . 1 . ]"
1 43 LYS 0.763 0.029 6 0 "[ . 1 . ]"
1 44 SER 1.786 0.051 5 0 "[ . 1 . ]"
1 45 ILE 13.614 0.610 19 19 [***************-**+]
1 46 GLU 1.634 0.056 18 0 "[ . 1 . ]"
1 47 ARG 1.862 0.046 19 0 "[ . 1 . ]"
1 48 LEU 10.814 0.589 13 1 "[ . 1 + . ]"
1 49 ARG 2.079 0.060 17 0 "[ . 1 . ]"
1 50 ARG 1.830 0.046 19 0 "[ . 1 . ]"
1 51 SER 0.976 0.024 4 0 "[ . 1 . ]"
1 52 LEU 2.791 0.060 17 0 "[ . 1 . ]"
1 53 LYS 1.831 0.038 17 0 "[ . 1 . ]"
1 54 GLN 1.502 0.035 1 0 "[ . 1 . ]"
1 55 LEU 1.549 0.043 17 0 "[ . 1 . ]"
1 56 ALA 2.217 0.053 11 0 "[ . 1 . ]"
1 57 ASP 2.090 0.038 2 0 "[ . 1 . ]"
1 58 ASP 1.415 0.030 17 0 "[ . 1 . ]"
1 59 ARG 2.301 0.053 11 0 "[ . 1 . ]"
1 60 THR 2.117 0.037 1 0 "[ . 1 . ]"
1 61 LEU 2.090 0.038 1 0 "[ . 1 . ]"
1 62 LEU 1.489 0.032 1 0 "[ . 1 . ]"
1 63 MET 2.920 0.064 4 0 "[ . 1 . ]"
1 64 ALA 2.460 0.048 13 0 "[ . 1 . ]"
1 65 GLY 1.135 0.041 11 0 "[ . 1 . ]"
1 66 VAL 2.621 0.064 4 0 "[ . 1 . ]"
1 67 SER 1.325 0.048 13 0 "[ . 1 . ]"
1 68 HIS 1.950 0.059 10 0 "[ . 1 . ]"
1 69 ASP 2.794 0.059 10 0 "[ . 1 . ]"
1 70 LEU 0.955 0.056 9 0 "[ . 1 . ]"
1 71 ARG 1.375 0.058 7 0 "[ . 1 . ]"
1 72 THR 1.260 0.058 7 0 "[ . 1 . ]"
1 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 74 LEU 1.046 0.042 13 0 "[ . 1 . ]"
1 75 THR 1.150 0.042 13 0 "[ . 1 . ]"
1 76 ARG 1.311 0.051 14 0 "[ . 1 . ]"
1 77 ILE 0.910 0.051 14 0 "[ . 1 . ]"
1 78 ARG 0.640 0.037 4 0 "[ . 1 . ]"
1 79 LEU 0.957 0.037 4 0 "[ . 1 . ]"
1 80 ALA 0.929 0.035 17 0 "[ . 1 . ]"
1 81 THR 1.020 0.035 17 0 "[ . 1 . ]"
1 82 GLU 0.448 0.027 11 0 "[ . 1 . ]"
1 83 MET 0.039 0.007 2 0 "[ . 1 . ]"
1 84 MET 16.515 0.886 1 19 [+*****-************]
1 85 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 86 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 87 GLN 0.174 0.017 12 0 "[ . 1 . ]"
1 88 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 89 GLY 1.034 0.043 17 0 "[ . 1 . ]"
1 90 TYR 0.819 0.043 17 0 "[ . 1 . ]"
1 91 LEU 17.066 0.886 1 19 [+*****-************]
1 92 ALA 0.969 0.028 1 0 "[ . 1 . ]"
1 93 GLU 1.158 0.025 3 0 "[ . 1 . ]"
1 94 SER 2.322 0.042 14 0 "[ . 1 . ]"
1 95 ILE 1.547 0.042 14 0 "[ . 1 . ]"
1 96 ASN 1.870 0.054 17 0 "[ . 1 . ]"
1 97 LYS 1.820 0.054 17 0 "[ . 1 . ]"
1 98 ASP 1.002 0.047 7 0 "[ . 1 . ]"
1 99 ILE 1.321 0.047 7 0 "[ . 1 . ]"
1 100 GLU 1.795 0.040 5 0 "[ . 1 . ]"
1 101 GLU 0.758 0.040 5 0 "[ . 1 . ]"
1 102 CYS 1.621 0.047 10 0 "[ . 1 . ]"
1 103 ASN 2.529 0.053 17 0 "[ . 1 . ]"
1 104 ALA 1.120 0.037 1 0 "[ . 1 . ]"
1 105 ILE 1.947 0.045 2 0 "[ . 1 . ]"
1 106 ILE 2.471 0.053 17 0 "[ . 1 . ]"
1 107 GLU 1.566 0.037 1 0 "[ . 1 . ]"
1 108 GLN 0.336 0.019 8 0 "[ . 1 . ]"
1 109 PHE 3.053 0.050 8 0 "[ . 1 . ]"
1 110 ILE 2.115 0.056 5 0 "[ . 1 . ]"
1 111 ASP 0.001 0.001 5 0 "[ . 1 . ]"
1 112 TYR 1.361 0.044 5 0 "[ . 1 . ]"
1 113 LEU 1.637 0.058 19 0 "[ . 1 . ]"
1 114 ARG 0.119 0.058 19 0 "[ . 1 . ]"
2 6 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 7 THR 0.000 0.000 . 0 "[ . 1 . ]"
2 8 ARG 0.837 0.032 12 0 "[ . 1 . ]"
2 9 PRO 1.853 0.050 18 0 "[ . 1 . ]"
2 10 ILE 0.764 0.050 6 0 "[ . 1 . ]"
2 11 ILE 0.660 0.032 12 0 "[ . 1 . ]"
2 12 GLU 1.854 0.050 18 0 "[ . 1 . ]"
2 13 LEU 1.748 0.050 6 0 "[ . 1 . ]"
2 14 SER 2.124 0.054 6 0 "[ . 1 . ]"
2 15 ASN 1.879 0.054 6 0 "[ . 1 . ]"
2 16 THR 1.427 0.040 16 0 "[ . 1 . ]"
2 17 PHE 32.954 0.610 19 19 [***************-**+]
2 18 ASP 2.382 0.064 6 0 "[ . 1 . ]"
2 19 LYS 2.403 0.064 6 0 "[ . 1 . ]"
2 20 ILE 1.838 0.055 11 0 "[ . 1 . ]"
2 21 ALA 0.886 0.031 17 0 "[ . 1 . ]"
2 22 GLU 1.958 0.077 6 0 "[ . 1 . ]"
2 23 GLY 1.217 0.077 6 0 "[ . 1 . ]"
2 24 ASN 0.684 0.037 12 0 "[ . 1 . ]"
2 25 LEU 0.018 0.008 19 0 "[ . 1 . ]"
2 26 GLU 0.018 0.008 19 0 "[ . 1 . ]"
2 27 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 28 GLU 3.064 0.280 1 0 "[ . 1 . ]"
2 29 VAL 0.000 0.000 . 0 "[ . 1 . ]"
2 30 PRO 1.390 0.052 16 0 "[ . 1 . ]"
2 31 HIS 10.555 0.347 5 0 "[ . 1 . ]"
2 32 GLN 0.698 0.045 15 0 "[ . 1 . ]"
2 33 ASN 0.817 0.045 15 0 "[ . 1 . ]"
2 34 ARG 0.129 0.013 8 0 "[ . 1 . ]"
2 35 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 36 ASP 1.188 0.027 11 0 "[ . 1 . ]"
2 37 GLU 0.387 0.024 1 0 "[ . 1 . ]"
2 38 ILE 0.694 0.026 1 0 "[ . 1 . ]"
2 39 GLY 0.666 0.027 11 0 "[ . 1 . ]"
2 40 ILE 0.285 0.015 1 0 "[ . 1 . ]"
2 41 LEU 9.388 0.436 1 0 "[ . 1 . ]"
2 42 ALA 9.711 0.347 5 0 "[ . 1 . ]"
2 43 LYS 0.889 0.035 10 0 "[ . 1 . ]"
2 44 SER 1.497 0.044 18 0 "[ . 1 . ]"
2 45 ILE 12.696 0.602 3 19 [**+***************-]
2 46 GLU 1.767 0.045 16 0 "[ . 1 . ]"
2 47 ARG 1.627 0.037 1 0 "[ . 1 . ]"
2 48 LEU 14.259 0.590 13 8 "[ *. **1- +*.** ]"
2 49 ARG 3.014 0.070 15 0 "[ . 1 . ]"
2 50 ARG 1.755 0.046 16 0 "[ . 1 . ]"
2 51 SER 0.907 0.025 2 0 "[ . 1 . ]"
2 52 LEU 2.805 0.070 15 0 "[ . 1 . ]"
2 53 LYS 1.698 0.038 17 0 "[ . 1 . ]"
2 54 GLN 1.377 0.031 14 0 "[ . 1 . ]"
2 55 LEU 1.503 0.047 15 0 "[ . 1 . ]"
2 56 ALA 2.066 0.044 15 0 "[ . 1 . ]"
2 57 ASP 2.015 0.038 7 0 "[ . 1 . ]"
2 58 ASP 1.362 0.032 15 0 "[ . 1 . ]"
2 59 ARG 2.107 0.044 15 0 "[ . 1 . ]"
2 60 THR 2.128 0.038 1 0 "[ . 1 . ]"
2 61 LEU 1.973 0.038 1 0 "[ . 1 . ]"
2 62 LEU 1.705 0.033 15 0 "[ . 1 . ]"
2 63 MET 3.118 0.062 5 0 "[ . 1 . ]"
2 64 ALA 2.732 0.062 7 0 "[ . 1 . ]"
2 65 GLY 1.304 0.034 17 0 "[ . 1 . ]"
2 66 VAL 2.782 0.062 5 0 "[ . 1 . ]"
2 67 SER 1.369 0.062 7 0 "[ . 1 . ]"
2 68 HIS 1.630 0.059 2 0 "[ . 1 . ]"
2 69 ASP 3.035 0.062 1 0 "[ . 1 . ]"
2 70 LEU 0.878 0.051 11 0 "[ . 1 . ]"
2 71 ARG 1.208 0.055 11 0 "[ . 1 . ]"
2 72 THR 1.241 0.055 11 0 "[ . 1 . ]"
2 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
2 74 LEU 1.062 0.045 12 0 "[ . 1 . ]"
2 75 THR 1.208 0.045 12 0 "[ . 1 . ]"
2 76 ARG 1.336 0.053 17 0 "[ . 1 . ]"
2 77 ILE 0.885 0.053 17 0 "[ . 1 . ]"
2 78 ARG 0.664 0.040 17 0 "[ . 1 . ]"
2 79 LEU 0.971 0.040 17 0 "[ . 1 . ]"
2 80 ALA 0.891 0.033 16 0 "[ . 1 . ]"
2 81 THR 1.032 0.033 16 0 "[ . 1 . ]"
2 82 GLU 0.478 0.029 2 0 "[ . 1 . ]"
2 83 MET 0.030 0.005 10 0 "[ . 1 . ]"
2 84 MET 16.539 0.898 17 19 [*******-********+**]
2 85 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 86 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 87 GLN 0.142 0.019 9 0 "[ . 1 . ]"
2 88 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 89 GLY 0.969 0.035 15 0 "[ . 1 . ]"
2 90 TYR 0.783 0.035 15 0 "[ . 1 . ]"
2 91 LEU 17.132 0.898 17 19 [*******-********+**]
2 92 ALA 0.989 0.033 10 0 "[ . 1 . ]"
2 93 GLU 1.147 0.025 11 0 "[ . 1 . ]"
2 94 SER 2.330 0.042 13 0 "[ . 1 . ]"
2 95 ILE 1.556 0.042 13 0 "[ . 1 . ]"
2 96 ASN 1.871 0.055 10 0 "[ . 1 . ]"
2 97 LYS 1.819 0.055 10 0 "[ . 1 . ]"
2 98 ASP 1.032 0.048 9 0 "[ . 1 . ]"
2 99 ILE 1.325 0.048 9 0 "[ . 1 . ]"
2 100 GLU 1.936 0.043 17 0 "[ . 1 . ]"
2 101 GLU 0.801 0.043 17 0 "[ . 1 . ]"
2 102 CYS 1.633 0.048 4 0 "[ . 1 . ]"
2 103 ASN 2.670 0.054 14 0 "[ . 1 . ]"
2 104 ALA 1.135 0.034 16 0 "[ . 1 . ]"
2 105 ILE 2.132 0.047 7 0 "[ . 1 . ]"
2 106 ILE 2.603 0.054 14 0 "[ . 1 . ]"
2 107 GLU 1.576 0.034 16 0 "[ . 1 . ]"
2 108 GLN 0.513 0.021 11 0 "[ . 1 . ]"
2 109 PHE 2.896 0.048 10 0 "[ . 1 . ]"
2 110 ILE 2.005 0.048 10 0 "[ . 1 . ]"
2 111 ASP 0.039 0.010 16 0 "[ . 1 . ]"
2 112 TYR 1.389 0.047 14 0 "[ . 1 . ]"
2 113 LEU 1.910 0.067 19 0 "[ . 1 . ]"
2 114 ARG 0.452 0.067 19 0 "[ . 1 . ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 ILE HA 1 7 THR H 3.200 3.200 8.200 3.522 3.519 3.546 . 0 0 "[ . 1 . ]" 1
2 1 6 ILE HB 1 7 THR H 0.000 . 4.000 2.768 2.615 2.825 . 0 0 "[ . 1 . ]" 1
3 1 7 THR H 1 7 THR HA 2.700 2.700 7.700 2.878 2.857 2.907 . 0 0 "[ . 1 . ]" 1
4 1 7 THR H 1 8 ARG H 0.000 . 2.700 2.482 2.386 2.557 . 0 0 "[ . 1 . ]" 1
5 1 7 THR HA 1 8 ARG H 3.200 3.200 8.200 3.516 3.507 3.519 . 0 0 "[ . 1 . ]" 1
6 1 7 THR HB 1 8 ARG H 0.000 . 4.000 3.912 3.861 3.984 . 0 0 "[ . 1 . ]" 1
7 1 7 THR O 1 11 ILE H 2.200 . 2.600 2.210 2.172 2.252 . 0 0 "[ . 1 . ]" 1
8 1 8 ARG H 1 8 ARG HA 2.700 2.700 7.700 2.785 2.767 2.795 . 0 0 "[ . 1 . ]" 1
9 1 8 ARG H 1 8 ARG QB 0.000 . 3.500 2.240 2.228 2.249 . 0 0 "[ . 1 . ]" 1
10 1 8 ARG H 1 9 PRO HD2 0.000 . 2.700 2.428 2.396 2.496 . 0 0 "[ . 1 . ]" 1
11 1 8 ARG HA 1 11 ILE H 0.000 . 4.000 3.930 3.874 3.997 . 0 0 "[ . 1 . ]" 1
12 1 8 ARG HA 1 11 ILE HB 0.000 . 3.200 3.227 3.222 3.231 0.031 7 0 "[ . 1 . ]" 1
13 1 8 ARG HB3 1 31 HIS HE1 4.000 3.500 4.500 4.349 4.143 4.505 0.005 16 0 "[ . 1 . ]" 1
14 1 8 ARG HG3 1 31 HIS HE1 3.200 2.700 3.700 3.716 3.706 3.727 0.027 9 0 "[ . 1 . ]" 1
15 1 8 ARG O 1 12 GLU H 2.200 . 2.600 2.091 2.032 2.147 . 0 0 "[ . 1 . ]" 1
16 1 9 PRO HA 1 10 ILE H 3.200 3.200 8.200 3.550 3.540 3.561 . 0 0 "[ . 1 . ]" 1
17 1 9 PRO HA 1 12 GLU H 0.000 . 3.500 3.529 3.525 3.533 0.033 9 0 "[ . 1 . ]" 1
18 1 9 PRO HA 1 12 GLU HB2 0.000 . 2.700 2.535 2.483 2.584 . 0 0 "[ . 1 . ]" 1
19 1 9 PRO HA 1 12 GLU HB3 0.000 . 4.000 4.040 4.030 4.054 0.054 14 0 "[ . 1 . ]" 1
20 1 9 PRO HA 1 13 LEU H 0.000 . 4.500 3.985 3.935 4.020 . 0 0 "[ . 1 . ]" 1
21 1 9 PRO HA 1 31 HIS HD2 0.000 . 4.000 3.519 3.359 3.692 . 0 0 "[ . 1 . ]" 1
22 1 9 PRO HA 1 31 HIS HE1 4.000 3.500 4.500 3.472 3.468 3.475 0.032 7 0 "[ . 1 . ]" 1
23 1 9 PRO HB2 1 31 HIS HD2 0.000 . 4.500 4.502 4.430 4.515 0.015 9 0 "[ . 1 . ]" 1
24 1 9 PRO HB3 1 31 HIS HE1 4.000 3.500 4.500 4.020 3.689 4.365 . 0 0 "[ . 1 . ]" 1
25 1 9 PRO HG2 1 38 ILE MD 0.000 . 4.800 3.764 3.446 4.001 . 0 0 "[ . 1 . ]" 1
26 1 9 PRO HG3 1 38 ILE MD 0.000 . 4.800 2.749 2.437 3.024 . 0 0 "[ . 1 . ]" 1
27 1 9 PRO O 1 13 LEU H 2.200 . 2.600 1.977 1.953 1.998 . 0 0 "[ . 1 . ]" 1
28 1 10 ILE H 1 10 ILE HA 2.700 2.700 7.700 2.851 2.847 2.856 . 0 0 "[ . 1 . ]" 1
29 1 10 ILE H 1 10 ILE HB 0.000 . 2.700 2.607 2.601 2.613 . 0 0 "[ . 1 . ]" 1
30 1 10 ILE H 1 10 ILE QG 0.000 . 3.500 2.007 2.002 2.010 . 0 0 "[ . 1 . ]" 1
31 1 10 ILE H 1 11 ILE H 0.000 . 2.700 2.644 2.616 2.674 . 0 0 "[ . 1 . ]" 1
32 1 10 ILE HA 1 10 ILE MG 0.000 . 3.500 2.368 2.355 2.382 . 0 0 "[ . 1 . ]" 1
33 1 10 ILE HA 1 11 ILE H 3.200 3.200 8.200 3.561 3.555 3.569 . 0 0 "[ . 1 . ]" 1
34 1 10 ILE HA 1 13 LEU H 0.000 . 3.500 3.541 3.529 3.552 0.052 17 0 "[ . 1 . ]" 1
35 1 10 ILE MG 2 37 GLU QG 0.000 . 4.800 2.551 2.348 2.767 . 0 0 "[ . 1 . ]" 1
36 1 10 ILE MG 2 41 LEU HB2 0.000 . 4.000 3.344 3.340 3.347 . 0 0 "[ . 1 . ]" 1
37 1 10 ILE O 1 14 SER H 2.200 . 2.600 2.177 2.148 2.207 . 0 0 "[ . 1 . ]" 1
38 1 11 ILE H 1 11 ILE HA 2.700 2.700 7.700 2.827 2.825 2.829 . 0 0 "[ . 1 . ]" 1
39 1 11 ILE H 1 11 ILE HB 0.000 . 2.700 2.554 2.551 2.559 . 0 0 "[ . 1 . ]" 1
40 1 11 ILE H 1 11 ILE QG 0.000 . 4.000 2.004 2.003 2.005 . 0 0 "[ . 1 . ]" 1
41 1 11 ILE H 1 12 GLU H 0.000 . 2.700 2.698 2.675 2.713 0.013 2 0 "[ . 1 . ]" 1
42 1 11 ILE HA 1 11 ILE MG 0.000 . 3.500 2.384 2.314 2.435 . 0 0 "[ . 1 . ]" 1
43 1 11 ILE HA 1 12 GLU H 3.200 3.200 8.200 3.550 3.540 3.559 . 0 0 "[ . 1 . ]" 1
44 1 11 ILE HA 1 14 SER H 0.000 . 4.000 3.583 3.561 3.612 . 0 0 "[ . 1 . ]" 1
45 1 11 ILE HG13 1 12 GLU H 0.000 . 4.500 4.219 4.215 4.225 . 0 0 "[ . 1 . ]" 1
46 1 11 ILE MG 1 15 ASN HD21 0.000 . 4.000 3.224 2.769 3.331 . 0 0 "[ . 1 . ]" 1
47 1 11 ILE MG 1 15 ASN HD22 0.000 . 3.200 2.363 2.258 2.428 . 0 0 "[ . 1 . ]" 1
48 1 11 ILE O 1 15 ASN H 2.200 . 2.600 2.264 2.232 2.294 . 0 0 "[ . 1 . ]" 1
49 1 12 GLU H 1 12 GLU HA 2.700 2.700 7.700 2.825 2.823 2.828 . 0 0 "[ . 1 . ]" 1
50 1 12 GLU H 1 12 GLU HB2 0.000 . 3.200 2.244 2.172 2.335 . 0 0 "[ . 1 . ]" 1
51 1 12 GLU H 1 13 LEU H 0.000 . 2.700 2.716 2.710 2.721 0.021 11 0 "[ . 1 . ]" 1
52 1 12 GLU H 1 14 SER H 3.200 3.200 5.000 4.145 4.098 4.185 . 0 0 "[ . 1 . ]" 1
53 1 12 GLU HA 1 13 LEU H 3.200 3.200 8.200 3.560 3.555 3.565 . 0 0 "[ . 1 . ]" 1
54 1 12 GLU HA 1 15 ASN H 0.000 . 3.500 3.510 3.491 3.532 0.032 14 0 "[ . 1 . ]" 1
55 1 12 GLU HA 1 15 ASN HD21 0.000 . 4.000 2.189 2.026 2.372 . 0 0 "[ . 1 . ]" 1
56 1 12 GLU HB2 1 31 HIS HD2 0.000 . 4.000 3.513 3.232 3.801 . 0 0 "[ . 1 . ]" 1
57 1 12 GLU HB3 1 31 HIS HD2 0.000 . 4.000 3.458 3.372 3.586 . 0 0 "[ . 1 . ]" 1
58 1 12 GLU O 1 16 THR H 2.200 . 2.600 2.194 2.165 2.209 . 0 0 "[ . 1 . ]" 1
59 1 13 LEU H 1 13 LEU HA 2.700 2.700 7.700 2.814 2.811 2.817 . 0 0 "[ . 1 . ]" 1
60 1 13 LEU H 1 13 LEU MD1 0.000 . 4.000 3.072 3.026 3.138 . 0 0 "[ . 1 . ]" 1
61 1 13 LEU H 1 14 SER H 0.000 . 2.700 2.710 2.697 2.720 0.020 18 0 "[ . 1 . ]" 1
62 1 13 LEU H 1 15 ASN H 3.200 3.200 5.000 4.328 4.307 4.350 . 0 0 "[ . 1 . ]" 1
63 1 13 LEU H 1 30 PRO HG3 0.000 . 4.500 4.526 4.516 4.534 0.034 13 0 "[ . 1 . ]" 1
64 1 13 LEU HA 1 14 SER H 3.200 3.200 8.200 3.546 3.543 3.555 . 0 0 "[ . 1 . ]" 1
65 1 13 LEU HA 1 16 THR H 0.000 . 3.500 3.394 3.360 3.425 . 0 0 "[ . 1 . ]" 1
66 1 13 LEU HA 1 16 THR HB 0.000 . 3.200 2.929 2.865 2.996 . 0 0 "[ . 1 . ]" 1
67 1 13 LEU HA 1 45 ILE MD 0.000 . 4.800 3.552 3.514 3.596 . 0 0 "[ . 1 . ]" 1
68 1 13 LEU MD1 1 31 HIS HD2 0.000 . 4.800 3.972 3.937 3.999 . 0 0 "[ . 1 . ]" 1
69 1 13 LEU MD2 1 17 PHE HE2 0.000 . 4.800 3.994 3.945 4.006 . 0 0 "[ . 1 . ]" 1
70 1 13 LEU MD2 1 31 HIS HD2 0.000 . 4.000 3.340 3.334 3.349 . 0 0 "[ . 1 . ]" 1
71 1 13 LEU MD2 1 42 ALA H 0.000 . 4.800 4.005 3.999 4.012 . 0 0 "[ . 1 . ]" 1
72 1 13 LEU MD2 1 42 ALA MB 0.000 . 4.800 2.980 2.809 3.118 . 0 0 "[ . 1 . ]" 1
73 1 13 LEU HG 1 31 HIS HD2 3.200 3.200 4.500 3.229 3.187 3.324 0.013 7 0 "[ . 1 . ]" 1
74 1 13 LEU O 1 17 PHE H 2.200 . 2.600 2.109 2.091 2.131 . 0 0 "[ . 1 . ]" 1
75 1 14 SER H 1 14 SER HA 2.700 2.700 7.700 2.810 2.807 2.817 . 0 0 "[ . 1 . ]" 1
76 1 14 SER H 1 15 ASN H 0.000 . 2.700 2.752 2.738 2.756 0.056 12 0 "[ . 1 . ]" 1
77 1 14 SER HA 1 15 ASN H 3.200 3.200 8.200 3.550 3.547 3.554 . 0 0 "[ . 1 . ]" 1
78 1 14 SER HA 1 17 PHE H 0.000 . 3.500 3.522 3.511 3.531 0.031 17 0 "[ . 1 . ]" 1
79 1 14 SER HA 1 17 PHE HD2 2.700 2.700 3.200 2.664 2.654 2.669 0.046 6 0 "[ . 1 . ]" 1
80 1 14 SER O 1 18 ASP H 2.200 . 2.600 2.231 2.215 2.248 . 0 0 "[ . 1 . ]" 1
81 1 15 ASN H 1 15 ASN HA 2.700 2.700 7.700 2.822 2.819 2.826 . 0 0 "[ . 1 . ]" 1
82 1 15 ASN H 1 16 THR H 0.000 . 2.700 2.720 2.712 2.725 0.025 8 0 "[ . 1 . ]" 1
83 1 15 ASN H 1 17 PHE H 3.200 3.200 5.000 4.298 4.282 4.313 . 0 0 "[ . 1 . ]" 1
84 1 15 ASN HA 1 16 THR H 3.200 3.200 8.200 3.541 3.537 3.543 . 0 0 "[ . 1 . ]" 1
85 1 15 ASN HA 1 18 ASP H 0.000 . 3.500 3.520 3.515 3.528 0.028 4 0 "[ . 1 . ]" 1
86 1 15 ASN HB2 1 16 THR H 0.000 . 3.200 2.637 2.611 2.686 . 0 0 "[ . 1 . ]" 1
87 1 15 ASN HB3 1 16 THR H 0.000 . 4.000 3.666 3.587 3.701 . 0 0 "[ . 1 . ]" 1
88 1 15 ASN O 1 19 LYS H 2.200 . 2.600 2.225 2.203 2.239 . 0 0 "[ . 1 . ]" 1
89 1 16 THR H 1 16 THR HA 2.700 2.700 7.700 2.819 2.816 2.821 . 0 0 "[ . 1 . ]" 1
90 1 16 THR H 1 16 THR HB 0.000 . 2.700 2.685 2.677 2.694 . 0 0 "[ . 1 . ]" 1
91 1 16 THR H 1 17 PHE H 0.000 . 2.700 2.739 2.735 2.742 0.042 2 0 "[ . 1 . ]" 1
92 1 16 THR HA 1 17 PHE H 3.200 3.200 8.200 3.562 3.556 3.565 . 0 0 "[ . 1 . ]" 1
93 1 16 THR HA 1 19 LYS H 0.000 . 3.500 3.517 3.505 3.534 0.034 13 0 "[ . 1 . ]" 1
94 1 16 THR HB 1 17 PHE H 0.000 . 2.700 2.530 2.515 2.543 . 0 0 "[ . 1 . ]" 1
95 1 16 THR MG 1 17 PHE H 0.000 . 4.800 3.642 3.635 3.652 . 0 0 "[ . 1 . ]" 1
96 1 16 THR MG 1 20 ILE H 0.000 . 4.800 4.004 3.998 4.010 . 0 0 "[ . 1 . ]" 1
97 1 16 THR MG 1 20 ILE MD 0.000 . 4.800 2.129 2.042 2.372 . 0 0 "[ . 1 . ]" 1
98 1 16 THR O 1 20 ILE H 2.200 . 2.600 2.122 2.105 2.131 . 0 0 "[ . 1 . ]" 1
99 1 17 PHE H 1 17 PHE HA 2.700 2.700 7.700 2.822 2.820 2.824 . 0 0 "[ . 1 . ]" 1
100 1 17 PHE H 1 17 PHE HD2 3.200 3.200 4.000 3.202 3.194 3.227 0.006 14 0 "[ . 1 . ]" 1
101 1 17 PHE H 1 18 ASP H 0.000 . 2.700 2.731 2.727 2.735 0.035 13 0 "[ . 1 . ]" 1
102 1 17 PHE H 1 19 LYS H 3.200 3.200 5.000 4.334 4.318 4.349 . 0 0 "[ . 1 . ]" 1
103 1 17 PHE HA 1 18 ASP H 3.200 3.200 8.200 3.547 3.545 3.549 . 0 0 "[ . 1 . ]" 1
104 1 17 PHE HA 1 20 ILE H 0.000 . 3.500 3.505 3.489 3.525 0.025 13 0 "[ . 1 . ]" 1
105 1 17 PHE HA 1 20 ILE HB 0.000 . 2.700 2.747 2.731 2.754 0.054 6 0 "[ . 1 . ]" 1
106 1 17 PHE HB2 1 18 ASP H 2.700 2.700 4.000 2.848 2.837 2.871 . 0 0 "[ . 1 . ]" 1
107 1 17 PHE HB3 1 18 ASP H 2.700 2.700 4.000 3.311 3.297 3.338 . 0 0 "[ . 1 . ]" 1
108 1 17 PHE HD1 1 20 ILE MG 0.000 . 4.800 4.027 4.020 4.037 . 0 0 "[ . 1 . ]" 1
109 1 17 PHE HD1 2 45 ILE HA 3.200 3.200 4.500 3.834 3.783 3.886 . 0 0 "[ . 1 . ]" 1
110 1 17 PHE HD1 2 48 LEU H 4.000 4.000 5.500 4.700 4.604 4.797 . 0 0 "[ . 1 . ]" 1
111 1 17 PHE HD1 2 48 LEU HB2 0.000 . 4.000 2.854 2.788 2.921 . 0 0 "[ . 1 . ]" 1
112 1 17 PHE HD1 2 48 LEU MD1 3.500 3.500 4.500 3.026 2.910 3.223 0.590 13 8 "[ *. **1- +*.** ]" 1
113 1 17 PHE HD1 2 48 LEU MD2 2.700 2.700 3.500 2.477 2.372 2.748 0.328 16 0 "[ . 1 . ]" 1
114 1 17 PHE HD2 1 45 ILE MD 3.500 3.500 4.800 4.010 4.004 4.015 . 0 0 "[ . 1 . ]" 1
115 1 17 PHE HD2 2 41 LEU MD1 0.000 . 3.500 2.938 2.934 2.944 . 0 0 "[ . 1 . ]" 1
116 1 17 PHE HD2 2 41 LEU HG 3.500 3.500 8.500 4.918 4.547 5.041 . 0 0 "[ . 1 . ]" 1
117 1 17 PHE HD2 2 44 SER HB2 2.700 2.700 4.000 3.803 3.619 3.939 . 0 0 "[ . 1 . ]" 1
118 1 17 PHE HD2 2 44 SER HB3 2.700 2.700 4.000 3.112 3.001 3.197 . 0 0 "[ . 1 . ]" 1
119 1 17 PHE HE1 1 45 ILE HG12 3.500 3.500 4.800 4.139 4.092 4.210 . 0 0 "[ . 1 . ]" 1
120 1 17 PHE HE1 2 45 ILE HA 2.700 2.700 4.000 2.822 2.765 2.869 . 0 0 "[ . 1 . ]" 1
121 1 17 PHE HE1 2 45 ILE MD 3.500 3.500 5.000 4.191 4.181 4.196 . 0 0 "[ . 1 . ]" 1
122 1 17 PHE HE1 2 48 LEU H 4.000 4.000 9.000 5.393 5.332 5.462 . 0 0 "[ . 1 . ]" 1
123 1 17 PHE HE1 2 48 LEU HB2 3.200 3.200 5.000 3.896 3.796 3.989 . 0 0 "[ . 1 . ]" 1
124 1 17 PHE HE1 2 48 LEU MD1 4.000 4.000 5.800 4.651 4.507 4.832 . 0 0 "[ . 1 . ]" 1
125 1 17 PHE HE1 2 48 LEU MD2 2.500 2.500 3.500 2.916 2.878 2.925 . 0 0 "[ . 1 . ]" 1
126 1 17 PHE HE2 1 45 ILE MD 3.200 3.200 4.000 3.262 3.213 3.325 . 0 0 "[ . 1 . ]" 1
127 1 17 PHE HE2 2 41 LEU HA 3.200 3.200 4.500 4.258 4.140 4.370 . 0 0 "[ . 1 . ]" 1
128 1 17 PHE HE2 2 41 LEU MD1 2.500 2.500 3.500 2.069 2.064 2.075 0.436 1 0 "[ . 1 . ]" 1
129 1 17 PHE HE2 2 41 LEU HG 2.700 2.700 4.200 3.013 2.719 3.134 . 0 0 "[ . 1 . ]" 1
130 1 17 PHE HE2 2 44 SER HB2 3.200 3.200 4.500 3.997 3.820 4.090 . 0 0 "[ . 1 . ]" 1
131 1 17 PHE HE2 2 44 SER HB3 3.200 3.200 4.000 4.011 4.002 4.016 0.016 6 0 "[ . 1 . ]" 1
132 1 17 PHE HZ 1 45 ILE HG12 3.500 3.500 4.500 3.556 3.496 3.641 0.004 3 0 "[ . 1 . ]" 1
133 1 17 PHE HZ 2 45 ILE MD 3.500 3.500 4.800 2.906 2.898 2.914 0.602 3 19 [**+***************-] 1
134 1 17 PHE O 1 21 ALA H 2.200 . 2.600 2.010 1.980 2.051 . 0 0 "[ . 1 . ]" 1
135 1 18 ASP H 1 18 ASP HA 2.700 2.700 7.700 2.817 2.815 2.821 . 0 0 "[ . 1 . ]" 1
136 1 18 ASP H 1 19 LYS H 0.000 . 2.700 2.755 2.745 2.761 0.061 8 0 "[ . 1 . ]" 1
137 1 18 ASP HA 1 19 LYS H 3.200 3.200 8.200 3.554 3.552 3.558 . 0 0 "[ . 1 . ]" 1
138 1 18 ASP HA 1 21 ALA H 0.000 . 3.500 3.523 3.516 3.533 0.033 13 0 "[ . 1 . ]" 1
139 1 18 ASP HA 1 21 ALA MB 0.000 . 4.000 2.692 2.579 2.879 . 0 0 "[ . 1 . ]" 1
140 1 18 ASP O 1 22 GLU H 2.200 . 2.600 2.184 2.155 2.217 . 0 0 "[ . 1 . ]" 1
141 1 19 LYS H 1 19 LYS HA 2.700 2.700 7.700 2.826 2.821 2.829 . 0 0 "[ . 1 . ]" 1
142 1 19 LYS H 1 20 ILE H 0.000 . 2.700 2.718 2.707 2.724 0.024 6 0 "[ . 1 . ]" 1
143 1 19 LYS H 1 21 ALA H 3.200 3.200 5.000 4.252 4.227 4.298 . 0 0 "[ . 1 . ]" 1
144 1 19 LYS HA 1 20 ILE H 3.200 3.200 8.200 3.543 3.540 3.546 . 0 0 "[ . 1 . ]" 1
145 1 19 LYS HA 1 22 GLU H 0.000 . 3.500 3.538 3.519 3.550 0.050 8 0 "[ . 1 . ]" 1
146 1 19 LYS HA 1 24 ASN H 0.000 . 4.500 4.218 4.162 4.273 . 0 0 "[ . 1 . ]" 1
147 1 19 LYS QB 1 27 ALA H 0.000 . 4.800 4.066 3.944 4.292 . 0 0 "[ . 1 . ]" 1
148 1 19 LYS QB 1 27 ALA MB 0.000 . 4.800 2.289 2.214 2.500 . 0 0 "[ . 1 . ]" 1
149 1 19 LYS HB3 1 24 ASN H 0.000 . 4.500 4.467 4.407 4.504 0.004 13 0 "[ . 1 . ]" 1
150 1 19 LYS QD 1 24 ASN HD21 0.000 . 4.000 2.309 1.945 3.128 . 0 0 "[ . 1 . ]" 1
151 1 19 LYS QD 1 27 ALA H 0.000 . 4.800 4.276 4.235 4.289 . 0 0 "[ . 1 . ]" 1
152 1 19 LYS QD 1 27 ALA MB 0.000 . 4.000 2.261 1.950 2.431 . 0 0 "[ . 1 . ]" 1
153 1 19 LYS O 1 24 ASN H 2.200 . 2.600 2.116 2.067 2.147 . 0 0 "[ . 1 . ]" 1
154 1 20 ILE H 1 20 ILE HA 2.700 2.700 7.700 2.828 2.827 2.831 . 0 0 "[ . 1 . ]" 1
155 1 20 ILE H 1 20 ILE HB 0.000 . 3.200 2.490 2.452 2.499 . 0 0 "[ . 1 . ]" 1
156 1 20 ILE H 1 21 ALA H 0.000 . 2.700 2.721 2.714 2.726 0.026 1 0 "[ . 1 . ]" 1
157 1 20 ILE H 1 24 ASN HB3 0.000 . 5.000 4.974 4.896 5.006 0.006 11 0 "[ . 1 . ]" 1
158 1 20 ILE HA 1 21 ALA H 3.200 3.200 8.200 3.566 3.563 3.575 . 0 0 "[ . 1 . ]" 1
159 1 20 ILE MD 1 45 ILE HA 0.000 . 4.800 3.873 3.815 3.926 . 0 0 "[ . 1 . ]" 1
160 1 20 ILE MD 1 49 ARG H 0.000 . 4.800 4.009 4.006 4.014 . 0 0 "[ . 1 . ]" 1
161 1 20 ILE MG 1 49 ARG HA 0.000 . 3.800 3.197 3.187 3.210 . 0 0 "[ . 1 . ]" 1
162 1 20 ILE MG 2 48 LEU MD1 0.000 . 4.200 1.981 1.883 2.197 . 0 0 "[ . 1 . ]" 1
163 1 20 ILE MG 2 48 LEU MD2 0.000 . 4.800 1.854 1.828 1.922 . 0 0 "[ . 1 . ]" 1
164 1 20 ILE O 1 23 GLY H 2.200 . 2.600 2.074 2.042 2.099 . 0 0 "[ . 1 . ]" 1
165 1 21 ALA H 1 21 ALA HA 2.700 2.700 7.700 2.805 2.802 2.808 . 0 0 "[ . 1 . ]" 1
166 1 21 ALA H 1 22 GLU H 2.700 2.700 3.200 2.747 2.735 2.758 . 0 0 "[ . 1 . ]" 1
167 1 21 ALA H 1 23 GLY H 3.200 3.200 5.000 4.242 4.204 4.265 . 0 0 "[ . 1 . ]" 1
168 1 21 ALA H 2 48 LEU MD1 0.000 . 4.000 2.696 2.597 2.874 . 0 0 "[ . 1 . ]" 1
169 1 21 ALA HA 1 22 GLU H 3.200 3.200 8.200 3.538 3.535 3.542 . 0 0 "[ . 1 . ]" 1
170 1 21 ALA HA 2 48 LEU MD1 0.000 . 4.000 2.062 1.977 2.186 . 0 0 "[ . 1 . ]" 1
171 1 21 ALA MB 1 22 GLU H 0.000 . 4.000 2.686 2.615 2.737 . 0 0 "[ . 1 . ]" 1
172 1 21 ALA MB 2 48 LEU HA 0.000 . 4.000 3.245 3.094 3.334 . 0 0 "[ . 1 . ]" 1
173 1 21 ALA MB 2 48 LEU QB 0.000 . 5.500 3.935 3.768 4.069 . 0 0 "[ . 1 . ]" 1
174 1 21 ALA MB 2 48 LEU MD1 0.000 . 4.200 2.231 2.051 2.554 . 0 0 "[ . 1 . ]" 1
175 1 21 ALA MB 2 51 SER HB3 0.000 . 4.800 3.587 3.291 3.828 . 0 0 "[ . 1 . ]" 1
176 1 22 GLU H 1 22 GLU HA 2.700 2.700 7.700 2.882 2.859 2.907 . 0 0 "[ . 1 . ]" 1
177 1 22 GLU H 1 23 GLY H 0.000 . 2.700 2.767 2.755 2.776 0.076 19 0 "[ . 1 . ]" 1
178 1 22 GLU H 1 24 ASN H 3.200 3.200 5.000 3.739 3.662 3.841 . 0 0 "[ . 1 . ]" 1
179 1 22 GLU HA 1 23 GLY H 3.200 3.200 8.200 3.316 3.244 3.391 . 0 0 "[ . 1 . ]" 1
180 1 22 GLU QB 1 24 ASN H 0.000 . 4.800 3.255 3.172 3.428 . 0 0 "[ . 1 . ]" 1
181 1 23 GLY H 1 23 GLY HA2 0.000 . 2.700 2.300 2.292 2.313 . 0 0 "[ . 1 . ]" 1
182 1 23 GLY H 1 23 GLY HA3 2.700 2.700 7.700 2.862 2.838 2.887 . 0 0 "[ . 1 . ]" 1
183 1 23 GLY H 1 24 ASN H 2.400 2.400 2.900 2.532 2.435 2.618 . 0 0 "[ . 1 . ]" 1
184 1 23 GLY HA2 1 24 ASN H 2.700 2.700 7.700 3.031 3.027 3.044 . 0 0 "[ . 1 . ]" 1
185 1 23 GLY HA2 1 52 LEU MD1 3.500 3.500 4.800 4.003 4.000 4.007 . 0 0 "[ . 1 . ]" 1
186 1 23 GLY HA3 1 24 ASN H 3.200 3.200 8.200 3.511 3.508 3.512 . 0 0 "[ . 1 . ]" 1
187 1 24 ASN H 1 24 ASN HA 2.700 2.700 7.700 2.932 2.927 2.938 . 0 0 "[ . 1 . ]" 1
188 1 24 ASN H 1 25 LEU H 2.700 2.700 4.500 4.094 4.059 4.148 . 0 0 "[ . 1 . ]" 1
189 1 24 ASN HA 1 25 LEU H 0.000 . 2.700 2.233 2.214 2.243 . 0 0 "[ . 1 . ]" 1
190 1 24 ASN HA 1 26 GLU H 0.000 . 4.000 3.361 3.330 3.437 . 0 0 "[ . 1 . ]" 1
191 1 24 ASN HB2 1 24 ASN HD21 0.000 . 2.700 2.532 2.523 2.560 . 0 0 "[ . 1 . ]" 1
192 1 24 ASN HB2 1 25 LEU H 3.200 3.200 5.000 4.579 4.552 4.589 . 0 0 "[ . 1 . ]" 1
193 1 24 ASN HB3 1 24 ASN HD21 0.000 . 2.700 2.731 2.715 2.737 0.037 13 0 "[ . 1 . ]" 1
194 1 24 ASN HB3 1 25 LEU H 3.200 3.200 5.000 4.428 4.402 4.439 . 0 0 "[ . 1 . ]" 1
195 1 24 ASN HB3 1 27 ALA MB 0.000 . 4.000 3.348 3.337 3.353 . 0 0 "[ . 1 . ]" 1
196 1 24 ASN HD22 1 27 ALA MB 0.000 . 4.000 3.335 3.333 3.341 . 0 0 "[ . 1 . ]" 1
197 1 25 LEU H 1 25 LEU HA 2.700 2.700 7.700 2.916 2.911 2.925 . 0 0 "[ . 1 . ]" 1
198 1 25 LEU H 1 25 LEU HB2 0.000 . 3.200 2.401 2.345 2.477 . 0 0 "[ . 1 . ]" 1
199 1 25 LEU H 1 25 LEU MD2 0.000 . 4.800 3.904 3.598 4.003 . 0 0 "[ . 1 . ]" 1
200 1 25 LEU H 1 25 LEU HG 0.000 . 2.700 2.579 2.352 2.701 0.001 9 0 "[ . 1 . ]" 1
201 1 25 LEU H 1 26 GLU H 0.000 . 2.700 2.696 2.645 2.712 0.012 8 0 "[ . 1 . ]" 1
202 1 25 LEU HA 1 26 GLU H 2.700 2.700 7.700 3.263 3.235 3.280 . 0 0 "[ . 1 . ]" 1
203 1 25 LEU HA 1 27 ALA H 0.000 . 4.000 3.826 3.396 3.869 . 0 0 "[ . 1 . ]" 1
204 1 25 LEU MD1 1 53 LYS H 0.000 . 4.800 3.000 2.641 3.133 . 0 0 "[ . 1 . ]" 1
205 1 25 LEU MD1 1 53 LYS HA 0.000 . 3.500 1.900 1.853 1.988 . 0 0 "[ . 1 . ]" 1
206 1 25 LEU MD1 1 56 ALA MB 0.000 . 4.300 2.986 2.971 2.991 . 0 0 "[ . 1 . ]" 1
207 1 25 LEU MD2 1 49 ARG HA 0.000 . 3.500 2.923 2.918 2.932 . 0 0 "[ . 1 . ]" 1
208 1 25 LEU MD2 1 52 LEU H 0.000 . 4.800 3.639 3.540 3.875 . 0 0 "[ . 1 . ]" 1
209 1 26 GLU H 1 26 GLU HA 2.700 2.700 7.700 2.911 2.905 2.934 . 0 0 "[ . 1 . ]" 1
210 1 26 GLU H 1 26 GLU HB2 0.000 . 3.200 2.428 2.366 2.481 . 0 0 "[ . 1 . ]" 1
211 1 26 GLU H 1 26 GLU HB3 0.000 . 4.000 3.616 3.595 3.662 . 0 0 "[ . 1 . ]" 1
212 1 26 GLU H 1 26 GLU QG 0.000 . 4.000 2.560 2.350 3.307 . 0 0 "[ . 1 . ]" 1
213 1 26 GLU H 1 27 ALA H 0.000 . 2.700 2.340 2.289 2.594 . 0 0 "[ . 1 . ]" 1
214 1 26 GLU H 1 27 ALA MB 0.000 . 4.800 3.946 3.876 3.963 . 0 0 "[ . 1 . ]" 1
215 1 26 GLU HA 1 27 ALA H 3.200 3.200 8.200 3.495 3.204 3.514 . 0 0 "[ . 1 . ]" 1
216 1 27 ALA H 1 27 ALA HA 2.700 2.700 7.700 2.851 2.827 2.928 . 0 0 "[ . 1 . ]" 1
217 1 27 ALA H 1 28 GLU H 3.200 3.200 8.200 4.609 4.559 4.636 . 0 0 "[ . 1 . ]" 1
218 1 27 ALA HA 1 28 GLU H 0.000 . 2.700 2.235 2.206 2.323 . 0 0 "[ . 1 . ]" 1
219 1 28 GLU H 1 28 GLU HA 2.700 2.700 7.700 2.937 2.928 2.939 . 0 0 "[ . 1 . ]" 1
220 1 28 GLU H 1 28 GLU QG 2.700 2.700 4.000 2.606 2.405 3.296 0.295 18 0 "[ . 1 . ]" 1
221 1 28 GLU H 1 29 VAL H 4.000 4.000 9.000 4.576 4.561 4.587 . 0 0 "[ . 1 . ]" 1
222 1 28 GLU HA 1 29 VAL H 0.000 . 2.700 2.289 2.223 2.297 . 0 0 "[ . 1 . ]" 1
223 1 28 GLU HA 1 29 VAL MG2 0.000 . 4.800 3.385 3.361 3.429 . 0 0 "[ . 1 . ]" 1
224 1 29 VAL H 1 29 VAL HA 2.700 2.700 7.700 2.921 2.906 2.949 . 0 0 "[ . 1 . ]" 1
225 1 29 VAL H 1 29 VAL HB 0.000 . 3.200 2.471 2.452 2.526 . 0 0 "[ . 1 . ]" 1
226 1 29 VAL H 1 29 VAL MG2 0.000 . 3.500 2.285 2.207 2.445 . 0 0 "[ . 1 . ]" 1
227 1 29 VAL H 1 30 PRO HD2 3.200 3.200 8.200 5.258 5.237 5.293 . 0 0 "[ . 1 . ]" 1
228 1 29 VAL H 1 30 PRO HD3 3.200 3.200 8.200 4.867 4.811 4.884 . 0 0 "[ . 1 . ]" 1
229 1 29 VAL H 1 32 GLN HE21 0.000 . 4.000 2.498 2.167 4.004 0.004 1 0 "[ . 1 . ]" 1
230 1 29 VAL H 1 32 GLN HE22 0.000 . 5.000 2.655 2.472 3.389 . 0 0 "[ . 1 . ]" 1
231 1 29 VAL HA 1 30 PRO QD 0.000 . 3.500 2.075 2.047 2.087 . 0 0 "[ . 1 . ]" 1
232 1 29 VAL MG1 1 30 PRO HD2 0.000 . 4.000 1.936 1.927 1.944 . 0 0 "[ . 1 . ]" 1
233 1 29 VAL MG1 1 32 GLN H 0.000 . 4.800 4.028 4.023 4.033 . 0 0 "[ . 1 . ]" 1
234 1 29 VAL MG1 1 32 GLN HA 0.000 . 4.800 3.905 3.867 3.967 . 0 0 "[ . 1 . ]" 1
235 1 29 VAL MG1 1 32 GLN HE21 2.700 2.700 4.000 3.345 3.336 3.352 . 0 0 "[ . 1 . ]" 1
236 1 29 VAL MG1 1 46 GLU H 0.000 . 4.800 3.135 2.993 3.239 . 0 0 "[ . 1 . ]" 1
237 1 29 VAL MG1 1 46 GLU HB2 0.000 . 4.000 2.906 2.600 3.086 . 0 0 "[ . 1 . ]" 1
238 1 29 VAL MG2 1 46 GLU H 0.000 . 4.800 3.243 3.112 3.663 . 0 0 "[ . 1 . ]" 1
239 1 29 VAL MG2 1 46 GLU HA 0.000 . 4.000 2.147 2.051 2.302 . 0 0 "[ . 1 . ]" 1
240 1 29 VAL MG2 1 46 GLU HB2 0.000 . 4.800 2.423 2.190 2.568 . 0 0 "[ . 1 . ]" 1
241 1 29 VAL MG2 1 49 ARG HD2 0.000 . 4.800 4.005 3.999 4.016 . 0 0 "[ . 1 . ]" 1
242 1 29 VAL MG2 1 49 ARG HD3 0.000 . 4.800 2.822 2.776 3.085 . 0 0 "[ . 1 . ]" 1
243 1 30 PRO HA 1 31 HIS H 0.000 . 2.700 2.356 2.320 2.387 . 0 0 "[ . 1 . ]" 1
244 1 30 PRO HA 1 32 GLN H 0.000 . 4.000 3.422 3.354 3.474 . 0 0 "[ . 1 . ]" 1
245 1 30 PRO HB2 1 31 HIS H 0.000 . 3.200 2.769 2.694 2.865 . 0 0 "[ . 1 . ]" 1
246 1 30 PRO HB3 1 31 HIS H 0.000 . 4.000 3.764 3.725 3.817 . 0 0 "[ . 1 . ]" 1
247 1 30 PRO HB3 1 31 HIS HD2 3.500 3.500 4.500 4.486 4.390 4.520 0.020 9 0 "[ . 1 . ]" 1
248 1 30 PRO HD2 1 31 HIS HD2 0.000 . 4.000 4.047 4.042 4.053 0.053 17 0 "[ . 1 . ]" 1
249 1 31 HIS H 1 31 HIS HA 0.000 . 2.700 2.293 2.291 2.294 . 0 0 "[ . 1 . ]" 1
250 1 31 HIS H 1 32 GLN H 0.000 . 3.200 2.787 2.767 2.810 . 0 0 "[ . 1 . ]" 1
251 1 31 HIS HA 1 32 GLN H 2.700 2.700 7.700 3.120 3.102 3.148 . 0 0 "[ . 1 . ]" 1
252 1 31 HIS HB2 1 38 ILE MG 0.000 . 4.800 3.431 3.376 3.475 . 0 0 "[ . 1 . ]" 1
253 1 31 HIS HB2 1 42 ALA MB 2.700 2.700 4.300 2.731 2.520 2.956 0.180 6 0 "[ . 1 . ]" 1
254 1 31 HIS HB3 1 34 ARG H 0.000 . 4.500 4.003 3.982 4.022 . 0 0 "[ . 1 . ]" 1
255 1 31 HIS HB3 1 38 ILE MG 0.000 . 4.800 3.356 3.091 3.515 . 0 0 "[ . 1 . ]" 1
256 1 31 HIS HB3 1 42 ALA MB 4.000 4.000 9.000 3.901 3.656 4.212 0.344 2 0 "[ . 1 . ]" 1
257 1 31 HIS HD2 1 38 ILE MG 0.000 . 4.800 4.016 4.004 4.025 . 0 0 "[ . 1 . ]" 1
258 1 31 HIS HD2 1 42 ALA MB 4.000 4.000 9.000 3.947 3.702 4.140 0.298 6 0 "[ . 1 . ]" 1
259 1 31 HIS O 1 34 ARG H 2.200 . 2.600 2.057 2.030 2.072 . 0 0 "[ . 1 . ]" 1
260 1 32 GLN H 1 32 GLN HA 2.700 2.700 7.700 2.802 2.800 2.805 . 0 0 "[ . 1 . ]" 1
261 1 32 GLN H 1 32 GLN QG 0.000 . 3.500 2.566 2.357 2.612 . 0 0 "[ . 1 . ]" 1
262 1 32 GLN H 1 33 ASN H 0.000 . 2.700 2.735 2.728 2.740 0.040 6 0 "[ . 1 . ]" 1
263 1 32 GLN HA 1 34 ARG H 0.000 . 4.000 3.824 3.769 3.870 . 0 0 "[ . 1 . ]" 1
264 1 32 GLN QG 1 43 LYS H 0.000 . 5.300 4.694 4.535 4.732 . 0 0 "[ . 1 . ]" 1
265 1 33 ASN H 1 34 ARG H 2.700 2.700 3.500 2.701 2.691 2.723 0.009 1 0 "[ . 1 . ]" 1
266 1 33 ASN HA 1 34 ARG H 3.200 3.200 8.200 3.308 3.264 3.382 . 0 0 "[ . 1 . ]" 1
267 1 33 ASN QB 1 34 ARG H 0.000 . 4.800 3.547 3.393 3.929 . 0 0 "[ . 1 . ]" 1
268 1 34 ARG H 1 34 ARG HA 2.700 2.700 7.700 2.844 2.821 2.860 . 0 0 "[ . 1 . ]" 1
269 1 34 ARG H 1 34 ARG QG 0.000 . 3.500 2.633 2.488 2.738 . 0 0 "[ . 1 . ]" 1
270 1 34 ARG H 1 39 GLY HA2 2.700 2.700 4.000 3.457 3.347 3.605 . 0 0 "[ . 1 . ]" 1
271 1 34 ARG H 1 39 GLY HA3 2.700 2.700 4.000 3.699 3.558 3.895 . 0 0 "[ . 1 . ]" 1
272 1 34 ARG HA 1 36 ASP H 4.000 4.000 9.000 4.118 4.073 4.152 . 0 0 "[ . 1 . ]" 1
273 1 34 ARG HB2 1 39 GLY HA2 0.000 . 2.700 2.019 2.017 2.022 . 0 0 "[ . 1 . ]" 1
274 1 34 ARG HB2 1 39 GLY HA3 0.000 . 3.200 2.342 2.310 2.372 . 0 0 "[ . 1 . ]" 1
275 1 34 ARG HB3 1 36 ASP H 0.000 . 3.200 2.944 2.919 2.967 . 0 0 "[ . 1 . ]" 1
276 1 34 ARG HB3 1 39 GLY HA2 0.000 . 3.200 3.178 3.129 3.205 0.005 4 0 "[ . 1 . ]" 1
277 1 34 ARG HD2 1 38 ILE MG 0.000 . 4.800 3.105 2.801 3.277 . 0 0 "[ . 1 . ]" 1
278 1 34 ARG HD3 1 38 ILE MG 0.000 . 3.500 2.456 2.268 2.589 . 0 0 "[ . 1 . ]" 1
279 1 34 ARG HE 1 39 GLY H 2.700 2.700 4.000 3.531 3.517 3.546 . 0 0 "[ . 1 . ]" 1
280 1 35 ALA HA 1 36 ASP H 2.700 2.700 7.700 3.510 3.508 3.513 . 0 0 "[ . 1 . ]" 1
281 1 35 ALA MB 1 36 ASP H 0.000 . 4.800 2.875 2.847 2.925 . 0 0 "[ . 1 . ]" 1
282 1 36 ASP H 1 36 ASP HA 2.700 2.700 7.700 2.889 2.885 2.893 . 0 0 "[ . 1 . ]" 1
283 1 36 ASP H 1 37 GLU H 3.200 3.200 8.200 4.520 4.514 4.524 . 0 0 "[ . 1 . ]" 1
284 1 36 ASP H 1 39 GLY H 2.700 2.700 3.500 3.522 3.517 3.527 0.027 11 0 "[ . 1 . ]" 1
285 1 36 ASP HA 1 37 GLU H 2.700 2.700 7.700 2.680 2.678 2.682 0.022 11 0 "[ . 1 . ]" 1
286 1 36 ASP HA 1 38 ILE H 0.000 . 4.500 4.444 4.431 4.458 . 0 0 "[ . 1 . ]" 1
287 1 36 ASP HB2 1 38 ILE H 0.000 . 4.000 3.331 3.303 3.345 . 0 0 "[ . 1 . ]" 1
288 1 36 ASP HB3 1 38 ILE H 0.000 . 4.500 4.518 4.509 4.523 0.023 6 0 "[ . 1 . ]" 1
289 1 36 ASP O 1 39 GLY H 2.200 . 2.600 2.067 2.052 2.079 . 0 0 "[ . 1 . ]" 1
290 1 36 ASP O 1 40 ILE H 2.200 . 2.600 2.322 2.311 2.334 . 0 0 "[ . 1 . ]" 1
291 1 37 GLU H 1 37 GLU HA 2.700 2.700 7.700 2.770 2.764 2.777 . 0 0 "[ . 1 . ]" 1
292 1 37 GLU H 1 37 GLU HG2 3.200 3.200 8.200 3.921 3.917 3.923 . 0 0 "[ . 1 . ]" 1
293 1 37 GLU H 1 37 GLU HG3 3.200 3.200 8.200 3.203 3.196 3.219 0.004 7 0 "[ . 1 . ]" 1
294 1 37 GLU H 1 38 ILE H 0.000 . 3.200 2.848 2.825 2.869 . 0 0 "[ . 1 . ]" 1
295 1 37 GLU HA 1 38 ILE H 3.200 3.200 8.200 3.508 3.505 3.514 . 0 0 "[ . 1 . ]" 1
296 1 37 GLU HA 1 40 ILE H 0.000 . 3.500 3.363 3.338 3.416 . 0 0 "[ . 1 . ]" 1
297 1 37 GLU HA 1 40 ILE HB 0.000 . 3.500 2.849 2.799 2.922 . 0 0 "[ . 1 . ]" 1
298 1 37 GLU HA 1 41 LEU H 0.000 . 4.500 4.168 4.136 4.224 . 0 0 "[ . 1 . ]" 1
299 1 37 GLU QG 2 10 ILE MG 0.000 . 4.800 2.647 2.447 2.791 . 0 0 "[ . 1 . ]" 1
300 1 37 GLU HG2 1 38 ILE H 3.500 3.500 8.500 5.421 5.407 5.436 . 0 0 "[ . 1 . ]" 1
301 1 37 GLU HG3 1 38 ILE H 3.500 3.500 8.500 4.972 4.964 4.984 . 0 0 "[ . 1 . ]" 1
302 1 37 GLU O 1 41 LEU H 2.200 . 2.600 2.136 2.116 2.168 . 0 0 "[ . 1 . ]" 1
303 1 38 ILE H 1 38 ILE HA 2.700 2.700 7.700 2.864 2.861 2.867 . 0 0 "[ . 1 . ]" 1
304 1 38 ILE H 1 38 ILE QG 0.000 . 4.000 2.003 2.002 2.007 . 0 0 "[ . 1 . ]" 1
305 1 38 ILE H 1 39 GLY H 0.000 . 3.200 2.589 2.580 2.602 . 0 0 "[ . 1 . ]" 1
306 1 38 ILE HA 1 39 GLY H 3.200 3.200 8.200 3.558 3.556 3.560 . 0 0 "[ . 1 . ]" 1
307 1 38 ILE HA 1 41 LEU H 0.000 . 3.500 3.520 3.505 3.527 0.027 12 0 "[ . 1 . ]" 1
308 1 38 ILE HA 1 41 LEU HB3 0.000 . 3.200 2.997 2.978 3.016 . 0 0 "[ . 1 . ]" 1
309 1 38 ILE HA 1 41 LEU MD2 0.000 . 4.300 3.610 3.604 3.616 . 0 0 "[ . 1 . ]" 1
310 1 38 ILE HA 1 42 ALA H 0.000 . 4.500 4.185 4.151 4.213 . 0 0 "[ . 1 . ]" 1
311 1 38 ILE MG 1 39 GLY H 0.000 . 4.800 3.620 3.611 3.662 . 0 0 "[ . 1 . ]" 1
312 1 38 ILE MG 1 42 ALA H 0.000 . 4.800 3.999 3.996 4.018 . 0 0 "[ . 1 . ]" 1
313 1 38 ILE O 1 42 ALA H 2.200 . 2.600 2.079 2.063 2.092 . 0 0 "[ . 1 . ]" 1
314 1 39 GLY H 1 39 GLY HA2 2.700 2.700 7.700 2.826 2.824 2.827 . 0 0 "[ . 1 . ]" 1
315 1 39 GLY H 1 39 GLY HA3 0.000 . 2.700 2.304 2.302 2.306 . 0 0 "[ . 1 . ]" 1
316 1 39 GLY H 1 40 ILE H 2.700 2.700 3.500 2.690 2.685 2.694 0.015 18 0 "[ . 1 . ]" 1
317 1 39 GLY HA2 1 40 ILE H 3.200 3.200 8.200 3.544 3.541 3.547 . 0 0 "[ . 1 . ]" 1
318 1 39 GLY HA2 1 42 ALA H 0.000 . 4.000 3.569 3.528 3.612 . 0 0 "[ . 1 . ]" 1
319 1 39 GLY HA2 1 42 ALA MB 0.000 . 3.500 2.712 2.622 2.875 . 0 0 "[ . 1 . ]" 1
320 1 39 GLY HA2 1 43 LYS H 0.000 . 4.500 4.245 4.203 4.295 . 0 0 "[ . 1 . ]" 1
321 1 39 GLY HA3 1 40 ILE H 2.700 2.700 7.700 2.813 2.800 2.824 . 0 0 "[ . 1 . ]" 1
322 1 39 GLY O 1 43 LYS H 2.200 . 2.600 2.113 2.090 2.152 . 0 0 "[ . 1 . ]" 1
323 1 40 ILE H 1 40 ILE HA 2.700 2.700 7.700 2.838 2.836 2.841 . 0 0 "[ . 1 . ]" 1
324 1 40 ILE H 1 40 ILE QG 0.000 . 3.500 1.995 1.992 1.998 . 0 0 "[ . 1 . ]" 1
325 1 40 ILE H 1 41 LEU H 0.000 . 2.700 2.705 2.701 2.710 0.010 9 0 "[ . 1 . ]" 1
326 1 40 ILE H 1 42 ALA H 3.200 3.200 5.000 4.206 4.161 4.299 . 0 0 "[ . 1 . ]" 1
327 1 40 ILE HA 1 41 LEU H 3.200 3.200 8.200 3.559 3.554 3.564 . 0 0 "[ . 1 . ]" 1
328 1 40 ILE HA 1 43 LYS H 0.000 . 4.000 3.500 3.476 3.534 . 0 0 "[ . 1 . ]" 1
329 1 40 ILE MG 1 41 LEU H 0.000 . 4.800 3.533 3.511 3.566 . 0 0 "[ . 1 . ]" 1
330 1 40 ILE MG 1 44 SER H 0.000 . 5.800 4.248 4.187 4.304 . 0 0 "[ . 1 . ]" 1
331 1 40 ILE O 1 44 SER H 2.200 . 2.600 2.205 2.165 2.232 . 0 0 "[ . 1 . ]" 1
332 1 41 LEU H 1 41 LEU HA 2.700 2.700 7.700 2.820 2.816 2.824 . 0 0 "[ . 1 . ]" 1
333 1 41 LEU H 1 42 ALA H 0.000 . 2.700 2.731 2.724 2.748 0.048 6 0 "[ . 1 . ]" 1
334 1 41 LEU H 1 43 LYS H 3.200 3.200 5.000 4.171 4.112 4.212 . 0 0 "[ . 1 . ]" 1
335 1 41 LEU HA 1 42 ALA H 3.200 3.200 8.200 3.552 3.547 3.562 . 0 0 "[ . 1 . ]" 1
336 1 41 LEU HA 1 44 SER H 0.000 . 3.500 3.427 3.403 3.446 . 0 0 "[ . 1 . ]" 1
337 1 41 LEU HA 1 45 ILE H 0.000 . 4.500 4.510 4.502 4.519 0.019 3 0 "[ . 1 . ]" 1
338 1 41 LEU HA 2 17 PHE HE2 3.200 3.200 4.500 4.376 4.298 4.450 . 0 0 "[ . 1 . ]" 1
339 1 41 LEU HB2 2 10 ILE MG 0.000 . 4.000 3.342 3.337 3.348 . 0 0 "[ . 1 . ]" 1
340 1 41 LEU MD1 1 44 SER H 0.000 . 5.800 4.551 4.503 4.597 . 0 0 "[ . 1 . ]" 1
341 1 41 LEU MD1 2 17 PHE HD2 0.000 . 3.500 2.948 2.940 2.955 . 0 0 "[ . 1 . ]" 1
342 1 41 LEU MD1 2 17 PHE HE2 2.500 2.500 3.500 2.064 2.060 2.068 0.440 4 0 "[ . 1 . ]" 1
343 1 41 LEU MD2 1 42 ALA H 0.000 . 5.800 4.268 4.222 4.313 . 0 0 "[ . 1 . ]" 1
344 1 41 LEU HG 2 17 PHE HD2 3.500 3.500 8.500 5.076 5.051 5.099 . 0 0 "[ . 1 . ]" 1
345 1 41 LEU HG 2 17 PHE HE2 2.700 2.700 4.200 3.189 3.181 3.198 . 0 0 "[ . 1 . ]" 1
346 1 41 LEU O 1 45 ILE H 2.200 . 2.600 2.269 2.261 2.278 . 0 0 "[ . 1 . ]" 1
347 1 42 ALA H 1 42 ALA HA 2.700 2.700 7.700 2.813 2.812 2.815 . 0 0 "[ . 1 . ]" 1
348 1 42 ALA H 1 43 LYS H 0.000 . 2.700 2.721 2.716 2.729 0.029 6 0 "[ . 1 . ]" 1
349 1 42 ALA H 1 44 SER H 3.200 3.200 5.000 4.165 4.138 4.203 . 0 0 "[ . 1 . ]" 1
350 1 42 ALA HA 1 43 LYS H 3.200 3.200 8.200 3.547 3.542 3.552 . 0 0 "[ . 1 . ]" 1
351 1 42 ALA HA 1 45 ILE H 0.000 . 3.500 3.455 3.437 3.471 . 0 0 "[ . 1 . ]" 1
352 1 42 ALA HA 1 45 ILE MD 0.000 . 4.800 2.534 2.484 2.584 . 0 0 "[ . 1 . ]" 1
353 1 42 ALA O 1 46 GLU H 2.200 . 2.600 2.122 2.105 2.141 . 0 0 "[ . 1 . ]" 1
354 1 43 LYS H 1 43 LYS HA 2.700 2.700 7.700 2.810 2.808 2.813 . 0 0 "[ . 1 . ]" 1
355 1 43 LYS H 1 44 SER H 0.000 . 2.700 2.719 2.716 2.726 0.026 17 0 "[ . 1 . ]" 1
356 1 43 LYS HA 1 44 SER H 3.200 3.200 8.200 3.541 3.539 3.544 . 0 0 "[ . 1 . ]" 1
357 1 43 LYS HA 1 46 GLU H 0.000 . 3.500 3.420 3.394 3.448 . 0 0 "[ . 1 . ]" 1
358 1 43 LYS O 1 47 ARG H 2.200 . 2.600 2.109 2.095 2.121 . 0 0 "[ . 1 . ]" 1
359 1 44 SER H 1 44 SER HA 2.700 2.700 7.700 2.815 2.813 2.818 . 0 0 "[ . 1 . ]" 1
360 1 44 SER H 1 45 ILE H 0.000 . 2.700 2.748 2.745 2.751 0.051 5 0 "[ . 1 . ]" 1
361 1 44 SER HA 1 45 ILE H 3.200 3.200 8.200 3.552 3.550 3.554 . 0 0 "[ . 1 . ]" 1
362 1 44 SER HA 1 47 ARG H 0.000 . 3.500 3.511 3.506 3.521 0.021 19 0 "[ . 1 . ]" 1
363 1 44 SER HB2 2 17 PHE HD2 2.700 2.700 4.000 3.854 3.765 3.982 . 0 0 "[ . 1 . ]" 1
364 1 44 SER HB2 2 17 PHE HE2 3.200 3.200 4.500 4.065 4.013 4.123 . 0 0 "[ . 1 . ]" 1
365 1 44 SER HB3 2 17 PHE HD2 2.700 2.700 4.000 3.129 3.052 3.206 . 0 0 "[ . 1 . ]" 1
366 1 44 SER HB3 2 17 PHE HE2 3.200 3.200 4.000 4.015 4.010 4.025 0.025 19 0 "[ . 1 . ]" 1
367 1 44 SER O 1 48 LEU H 2.200 . 2.600 2.209 2.188 2.231 . 0 0 "[ . 1 . ]" 1
368 1 45 ILE H 1 45 ILE HA 2.700 2.700 7.700 2.824 2.822 2.826 . 0 0 "[ . 1 . ]" 1
369 1 45 ILE H 1 45 ILE QG 0.000 . 3.500 2.005 2.003 2.007 . 0 0 "[ . 1 . ]" 1
370 1 45 ILE H 1 46 GLU H 0.000 . 2.700 2.752 2.747 2.756 0.056 18 0 "[ . 1 . ]" 1
371 1 45 ILE H 1 47 ARG H 3.200 3.200 5.000 4.186 4.176 4.208 . 0 0 "[ . 1 . ]" 1
372 1 45 ILE HA 1 46 GLU H 3.200 3.200 8.200 3.551 3.547 3.553 . 0 0 "[ . 1 . ]" 1
373 1 45 ILE HA 1 48 LEU H 0.000 . 3.500 3.512 3.504 3.520 0.020 1 0 "[ . 1 . ]" 1
374 1 45 ILE HA 2 17 PHE HD1 3.200 3.200 4.500 3.830 3.743 3.887 . 0 0 "[ . 1 . ]" 1
375 1 45 ILE HA 2 17 PHE HE1 2.700 2.700 4.000 2.814 2.764 2.848 . 0 0 "[ . 1 . ]" 1
376 1 45 ILE HB 1 46 GLU H 0.000 . 3.200 2.607 2.598 2.614 . 0 0 "[ . 1 . ]" 1
377 1 45 ILE MD 2 17 PHE HE1 3.500 3.500 5.000 4.199 4.192 4.206 . 0 0 "[ . 1 . ]" 1
378 1 45 ILE MD 2 17 PHE HZ 3.500 3.500 4.800 2.906 2.890 2.914 0.610 19 19 [***************-**+] 1
379 1 45 ILE MG 1 49 ARG H 0.000 . 4.800 4.010 3.996 4.027 . 0 0 "[ . 1 . ]" 1
380 1 45 ILE O 1 49 ARG H 2.200 . 2.600 2.066 2.035 2.118 . 0 0 "[ . 1 . ]" 1
381 1 46 GLU H 1 46 GLU HA 2.700 2.700 7.700 2.816 2.811 2.818 . 0 0 "[ . 1 . ]" 1
382 1 46 GLU H 1 47 ARG H 0.000 . 2.700 2.719 2.715 2.727 0.027 17 0 "[ . 1 . ]" 1
383 1 46 GLU H 1 48 LEU H 3.200 3.200 5.000 4.323 4.278 4.355 . 0 0 "[ . 1 . ]" 1
384 1 46 GLU HA 1 47 ARG H 3.200 3.200 8.200 3.540 3.538 3.543 . 0 0 "[ . 1 . ]" 1
385 1 46 GLU HA 1 49 ARG H 0.000 . 3.500 3.494 3.459 3.519 0.019 4 0 "[ . 1 . ]" 1
386 1 46 GLU HA 1 49 ARG HB2 0.000 . 3.200 3.208 3.186 3.217 0.017 18 0 "[ . 1 . ]" 1
387 1 46 GLU QB 1 47 ARG H 0.000 . 4.000 2.697 2.673 2.719 . 0 0 "[ . 1 . ]" 1
388 1 46 GLU O 1 50 ARG H 2.200 . 2.600 2.064 2.047 2.088 . 0 0 "[ . 1 . ]" 1
389 1 47 ARG H 1 47 ARG HA 2.700 2.700 7.700 2.824 2.820 2.839 . 0 0 "[ . 1 . ]" 1
390 1 47 ARG H 1 47 ARG HD2 3.500 3.500 8.500 4.461 3.867 4.918 . 0 0 "[ . 1 . ]" 1
391 1 47 ARG H 1 47 ARG HD3 3.500 3.500 8.500 4.238 3.651 5.160 . 0 0 "[ . 1 . ]" 1
392 1 47 ARG H 1 48 LEU H 0.000 . 2.700 2.729 2.722 2.733 0.033 17 0 "[ . 1 . ]" 1
393 1 47 ARG HA 1 48 LEU H 3.200 3.200 8.200 3.567 3.560 3.585 . 0 0 "[ . 1 . ]" 1
394 1 47 ARG HA 1 50 ARG H 0.000 . 3.500 3.539 3.525 3.546 0.046 19 0 "[ . 1 . ]" 1
395 1 47 ARG QB 1 48 LEU H 0.000 . 4.800 2.510 2.460 2.551 . 0 0 "[ . 1 . ]" 1
396 1 47 ARG O 1 51 SER H 2.200 . 2.600 2.114 2.094 2.137 . 0 0 "[ . 1 . ]" 1
397 1 48 LEU H 1 48 LEU HA 2.700 2.700 7.700 2.824 2.820 2.826 . 0 0 "[ . 1 . ]" 1
398 1 48 LEU H 1 49 ARG H 0.000 . 2.700 2.711 2.704 2.718 0.018 11 0 "[ . 1 . ]" 1
399 1 48 LEU H 2 17 PHE HD1 4.000 4.000 5.500 4.686 4.587 4.773 . 0 0 "[ . 1 . ]" 1
400 1 48 LEU H 2 17 PHE HE1 4.000 4.000 9.000 5.383 5.324 5.432 . 0 0 "[ . 1 . ]" 1
401 1 48 LEU HA 1 49 ARG H 3.200 3.200 8.200 3.546 3.540 3.552 . 0 0 "[ . 1 . ]" 1
402 1 48 LEU HA 1 51 SER H 0.000 . 3.500 3.511 3.503 3.517 0.017 5 0 "[ . 1 . ]" 1
403 1 48 LEU HA 2 21 ALA MB 0.000 . 4.000 3.260 3.083 3.333 . 0 0 "[ . 1 . ]" 1
404 1 48 LEU QB 2 21 ALA MB 0.000 . 5.500 3.868 3.669 4.024 . 0 0 "[ . 1 . ]" 1
405 1 48 LEU HB2 2 17 PHE HD1 0.000 . 4.000 2.828 2.706 2.901 . 0 0 "[ . 1 . ]" 1
406 1 48 LEU HB2 2 17 PHE HE1 3.200 3.200 5.000 3.950 3.891 4.009 . 0 0 "[ . 1 . ]" 1
407 1 48 LEU MD1 2 17 PHE HD1 3.500 3.500 4.500 3.167 2.911 3.262 0.589 13 1 "[ . 1 + . ]" 1
408 1 48 LEU MD1 2 17 PHE HE1 4.000 4.000 5.800 4.754 4.530 4.833 . 0 0 "[ . 1 . ]" 1
409 1 48 LEU MD1 2 20 ILE MG 0.000 . 4.200 1.986 1.888 2.198 . 0 0 "[ . 1 . ]" 1
410 1 48 LEU MD1 2 21 ALA H 0.000 . 4.000 2.725 2.606 2.882 . 0 0 "[ . 1 . ]" 1
411 1 48 LEU MD1 2 21 ALA HA 0.000 . 4.000 2.052 1.925 2.171 . 0 0 "[ . 1 . ]" 1
412 1 48 LEU MD1 2 21 ALA MB 0.000 . 4.200 2.249 2.017 2.407 . 0 0 "[ . 1 . ]" 1
413 1 48 LEU MD2 2 17 PHE HD1 2.700 2.700 3.500 2.526 2.396 2.647 0.304 19 0 "[ . 1 . ]" 1
414 1 48 LEU MD2 2 17 PHE HE1 2.500 2.500 3.500 2.921 2.916 2.927 . 0 0 "[ . 1 . ]" 1
415 1 48 LEU MD2 2 20 ILE MG 0.000 . 4.800 1.850 1.817 1.924 . 0 0 "[ . 1 . ]" 1
416 1 48 LEU O 1 52 LEU H 2.200 . 2.600 2.224 2.209 2.245 . 0 0 "[ . 1 . ]" 1
417 1 49 ARG H 1 49 ARG HA 2.700 2.700 7.700 2.820 2.817 2.827 . 0 0 "[ . 1 . ]" 1
418 1 49 ARG H 1 50 ARG H 0.000 . 2.700 2.732 2.723 2.739 0.039 18 0 "[ . 1 . ]" 1
419 1 49 ARG H 1 51 SER H 3.200 3.200 5.000 4.202 4.181 4.222 . 0 0 "[ . 1 . ]" 1
420 1 49 ARG HA 1 50 ARG H 3.200 3.200 8.200 3.560 3.555 3.565 . 0 0 "[ . 1 . ]" 1
421 1 49 ARG HA 1 52 LEU H 0.000 . 3.500 3.553 3.542 3.560 0.060 17 0 "[ . 1 . ]" 1
422 1 49 ARG HA 1 52 LEU MD1 0.000 . 4.200 2.721 2.618 2.786 . 0 0 "[ . 1 . ]" 1
423 1 49 ARG QB 1 50 ARG H 0.000 . 4.000 2.467 2.444 2.488 . 0 0 "[ . 1 . ]" 1
424 1 49 ARG O 1 53 LYS H 2.200 . 2.600 2.247 2.221 2.271 . 0 0 "[ . 1 . ]" 1
425 1 50 ARG H 1 50 ARG HA 2.700 2.700 7.700 2.820 2.818 2.823 . 0 0 "[ . 1 . ]" 1
426 1 50 ARG H 1 51 SER H 0.000 . 2.700 2.708 2.705 2.714 0.014 17 0 "[ . 1 . ]" 1
427 1 50 ARG HA 1 51 SER H 3.200 3.200 8.200 3.552 3.549 3.559 . 0 0 "[ . 1 . ]" 1
428 1 50 ARG HA 1 53 LYS H 0.000 . 3.500 3.518 3.511 3.523 0.023 17 0 "[ . 1 . ]" 1
429 1 50 ARG QB 1 51 SER H 0.000 . 4.000 2.561 2.534 2.613 . 0 0 "[ . 1 . ]" 1
430 1 50 ARG O 1 54 GLN H 2.200 . 2.600 2.105 2.084 2.139 . 0 0 "[ . 1 . ]" 1
431 1 51 SER H 1 51 SER HA 2.700 2.700 7.700 2.814 2.811 2.832 . 0 0 "[ . 1 . ]" 1
432 1 51 SER H 1 52 LEU H 0.000 . 2.700 2.721 2.718 2.724 0.024 4 0 "[ . 1 . ]" 1
433 1 51 SER HA 1 52 LEU H 3.200 3.200 8.200 3.557 3.554 3.570 . 0 0 "[ . 1 . ]" 1
434 1 51 SER HA 1 54 GLN H 0.000 . 3.500 3.510 3.490 3.516 0.016 15 0 "[ . 1 . ]" 1
435 1 51 SER HB3 2 21 ALA MB 0.000 . 4.800 3.652 3.348 3.927 . 0 0 "[ . 1 . ]" 1
436 1 51 SER O 1 55 LEU H 2.200 . 2.600 2.109 2.088 2.125 . 0 0 "[ . 1 . ]" 1
437 1 52 LEU H 1 52 LEU HA 2.700 2.700 7.700 2.828 2.826 2.830 . 0 0 "[ . 1 . ]" 1
438 1 52 LEU H 1 52 LEU HG 0.000 . 3.200 2.718 2.630 2.786 . 0 0 "[ . 1 . ]" 1
439 1 52 LEU H 1 53 LYS H 0.000 . 2.700 2.734 2.730 2.738 0.038 17 0 "[ . 1 . ]" 1
440 1 52 LEU HA 1 53 LYS H 3.200 3.200 8.200 3.559 3.557 3.564 . 0 0 "[ . 1 . ]" 1
441 1 52 LEU HA 1 55 LEU H 0.000 . 3.500 3.538 3.534 3.543 0.043 17 0 "[ . 1 . ]" 1
442 1 52 LEU QB 1 53 LYS H 0.000 . 4.000 2.572 2.547 2.588 . 0 0 "[ . 1 . ]" 1
443 1 52 LEU O 1 56 ALA H 2.200 . 2.600 2.209 2.181 2.231 . 0 0 "[ . 1 . ]" 1
444 1 53 LYS H 1 53 LYS HA 2.700 2.700 7.700 2.823 2.821 2.825 . 0 0 "[ . 1 . ]" 1
445 1 53 LYS H 1 54 GLN H 0.000 . 2.700 2.722 2.719 2.727 0.027 3 0 "[ . 1 . ]" 1
446 1 53 LYS H 1 55 LEU H 3.200 3.200 5.000 4.230 4.217 4.244 . 0 0 "[ . 1 . ]" 1
447 1 53 LYS HA 1 54 GLN H 3.200 3.200 8.200 3.544 3.540 3.547 . 0 0 "[ . 1 . ]" 1
448 1 53 LYS HA 1 56 ALA H 0.000 . 3.500 3.522 3.517 3.526 0.026 1 0 "[ . 1 . ]" 1
449 1 53 LYS QB 1 54 GLN H 0.000 . 4.000 2.533 2.519 2.546 . 0 0 "[ . 1 . ]" 1
450 1 53 LYS O 1 57 ASP H 2.200 . 2.600 2.214 2.202 2.234 . 0 0 "[ . 1 . ]" 1
451 1 54 GLN H 1 54 GLN HA 2.700 2.700 7.700 2.819 2.817 2.822 . 0 0 "[ . 1 . ]" 1
452 1 54 GLN H 1 55 LEU H 0.000 . 2.700 2.717 2.714 2.721 0.021 17 0 "[ . 1 . ]" 1
453 1 54 GLN HA 1 55 LEU H 3.200 3.200 8.200 3.560 3.557 3.563 . 0 0 "[ . 1 . ]" 1
454 1 54 GLN HA 1 57 ASP H 0.000 . 3.500 3.529 3.522 3.535 0.035 1 0 "[ . 1 . ]" 1
455 1 54 GLN HA 1 57 ASP QB 0.000 . 4.000 2.937 2.904 2.969 . 0 0 "[ . 1 . ]" 1
456 1 54 GLN O 1 58 ASP H 2.200 . 2.600 2.105 2.081 2.129 . 0 0 "[ . 1 . ]" 1
457 1 55 LEU H 1 55 LEU HA 2.700 2.700 7.700 2.820 2.818 2.821 . 0 0 "[ . 1 . ]" 1
458 1 55 LEU H 1 56 ALA H 0.000 . 2.700 2.715 2.711 2.717 0.017 17 0 "[ . 1 . ]" 1
459 1 55 LEU HA 1 56 ALA H 3.200 3.200 8.200 3.553 3.549 3.554 . 0 0 "[ . 1 . ]" 1
460 1 55 LEU HA 1 58 ASP H 0.000 . 3.500 3.512 3.505 3.515 0.015 17 0 "[ . 1 . ]" 1
461 1 55 LEU QB 1 56 ALA H 0.000 . 3.200 2.626 2.616 2.635 . 0 0 "[ . 1 . ]" 1
462 1 55 LEU MD1 1 59 ARG H 0.000 . 4.800 4.018 4.017 4.019 . 0 0 "[ . 1 . ]" 1
463 1 55 LEU O 1 59 ARG H 2.200 . 2.600 2.067 2.050 2.080 . 0 0 "[ . 1 . ]" 1
464 1 56 ALA H 1 56 ALA HA 2.700 2.700 7.700 2.823 2.822 2.824 . 0 0 "[ . 1 . ]" 1
465 1 56 ALA H 1 57 ASP H 0.000 . 2.700 2.734 2.730 2.738 0.038 2 0 "[ . 1 . ]" 1
466 1 56 ALA HA 1 57 ASP H 3.200 3.200 8.200 3.559 3.557 3.561 . 0 0 "[ . 1 . ]" 1
467 1 56 ALA HA 1 59 ARG H 0.000 . 3.500 3.547 3.542 3.553 0.053 11 0 "[ . 1 . ]" 1
468 1 56 ALA O 1 60 THR H 2.200 . 2.600 2.185 2.163 2.214 . 0 0 "[ . 1 . ]" 1
469 1 57 ASP H 1 57 ASP HA 2.700 2.700 7.700 2.827 2.823 2.830 . 0 0 "[ . 1 . ]" 1
470 1 57 ASP H 1 58 ASP H 0.000 . 2.700 2.718 2.714 2.721 0.021 5 0 "[ . 1 . ]" 1
471 1 57 ASP HA 1 58 ASP H 3.200 3.200 8.200 3.549 3.543 3.552 . 0 0 "[ . 1 . ]" 1
472 1 57 ASP HA 1 60 THR H 0.000 . 3.500 3.530 3.526 3.537 0.037 1 0 "[ . 1 . ]" 1
473 1 57 ASP O 1 61 LEU H 2.200 . 2.600 2.199 2.175 2.216 . 0 0 "[ . 1 . ]" 1
474 1 58 ASP H 1 58 ASP HA 2.700 2.700 7.700 2.819 2.817 2.820 . 0 0 "[ . 1 . ]" 1
475 1 58 ASP H 1 59 ARG H 0.000 . 2.700 2.720 2.713 2.727 0.027 11 0 "[ . 1 . ]" 1
476 1 58 ASP HA 1 59 ARG H 3.200 3.200 8.200 3.560 3.554 3.566 . 0 0 "[ . 1 . ]" 1
477 1 58 ASP HA 1 61 LEU H 0.000 . 3.500 3.526 3.522 3.530 0.030 17 0 "[ . 1 . ]" 1
478 1 58 ASP O 1 62 LEU H 2.200 . 2.600 2.118 2.083 2.139 . 0 0 "[ . 1 . ]" 1
479 1 59 ARG H 1 59 ARG HA 2.700 2.700 7.700 2.817 2.815 2.819 . 0 0 "[ . 1 . ]" 1
480 1 59 ARG H 1 60 THR H 0.000 . 2.700 2.726 2.720 2.731 0.031 3 0 "[ . 1 . ]" 1
481 1 59 ARG HA 1 60 THR H 3.200 3.200 8.200 3.553 3.547 3.558 . 0 0 "[ . 1 . ]" 1
482 1 59 ARG HA 1 62 LEU H 0.000 . 3.500 3.529 3.521 3.532 0.032 1 0 "[ . 1 . ]" 1
483 1 59 ARG QD 1 113 LEU MD2 0.000 . 4.800 3.014 2.396 3.561 . 0 0 "[ . 1 . ]" 1
484 1 59 ARG O 1 63 MET H 2.200 . 2.600 2.131 2.119 2.152 . 0 0 "[ . 1 . ]" 1
485 1 60 THR H 1 60 THR HA 2.700 2.700 7.700 2.822 2.820 2.825 . 0 0 "[ . 1 . ]" 1
486 1 60 THR H 1 61 LEU H 0.000 . 2.700 2.730 2.726 2.735 0.035 11 0 "[ . 1 . ]" 1
487 1 60 THR HA 1 61 LEU H 3.200 3.200 8.200 3.557 3.555 3.559 . 0 0 "[ . 1 . ]" 1
488 1 60 THR HA 1 63 MET H 0.000 . 3.500 3.525 3.521 3.530 0.030 1 0 "[ . 1 . ]" 1
489 1 60 THR O 1 64 ALA H 2.200 . 2.600 2.216 2.196 2.237 . 0 0 "[ . 1 . ]" 1
490 1 61 LEU H 1 61 LEU HA 2.700 2.700 7.700 2.825 2.822 2.826 . 0 0 "[ . 1 . ]" 1
491 1 61 LEU H 1 62 LEU H 0.000 . 2.700 2.723 2.717 2.729 0.029 7 0 "[ . 1 . ]" 1
492 1 61 LEU HA 1 62 LEU H 3.200 3.200 8.200 3.556 3.554 3.560 . 0 0 "[ . 1 . ]" 1
493 1 61 LEU HA 1 64 ALA H 0.000 . 3.500 3.532 3.528 3.538 0.038 1 0 "[ . 1 . ]" 1
494 1 61 LEU O 1 65 GLY H 2.200 . 2.600 2.182 2.154 2.220 . 0 0 "[ . 1 . ]" 1
495 1 62 LEU H 1 62 LEU HA 2.700 2.700 7.700 2.819 2.817 2.821 . 0 0 "[ . 1 . ]" 1
496 1 62 LEU H 1 63 MET H 0.000 . 2.700 2.709 2.706 2.713 0.013 13 0 "[ . 1 . ]" 1
497 1 62 LEU HA 1 63 MET H 3.200 3.200 8.200 3.548 3.542 3.552 . 0 0 "[ . 1 . ]" 1
498 1 62 LEU HA 1 65 GLY H 0.000 . 3.500 3.507 3.502 3.511 0.011 5 0 "[ . 1 . ]" 1
499 1 62 LEU QB 2 109 PHE HE1 0.000 . 4.300 3.263 3.216 3.308 . 0 0 "[ . 1 . ]" 1
500 1 62 LEU MD1 2 109 PHE HD1 0.000 . 4.000 3.342 3.338 3.345 . 0 0 "[ . 1 . ]" 1
501 1 62 LEU MD2 2 109 PHE HD1 0.000 . 3.500 2.929 2.925 2.935 . 0 0 "[ . 1 . ]" 1
502 1 62 LEU MD2 2 109 PHE HE1 0.000 . 3.500 2.344 2.260 2.446 . 0 0 "[ . 1 . ]" 1
503 1 62 LEU HG 2 109 PHE HD1 2.500 2.500 4.000 2.969 2.909 3.041 . 0 0 "[ . 1 . ]" 1
504 1 62 LEU HG 2 109 PHE HE1 0.000 . 3.500 2.063 2.047 2.107 . 0 0 "[ . 1 . ]" 1
505 1 62 LEU HG 2 109 PHE HZ 3.500 3.500 4.500 4.511 4.505 4.519 0.019 19 0 "[ . 1 . ]" 1
506 1 62 LEU O 1 66 VAL H 2.200 . 2.600 2.134 2.115 2.158 . 0 0 "[ . 1 . ]" 1
507 1 63 MET H 1 63 MET HA 2.700 2.700 7.700 2.817 2.813 2.822 . 0 0 "[ . 1 . ]" 1
508 1 63 MET H 1 64 ALA H 0.000 . 2.700 2.741 2.735 2.746 0.046 11 0 "[ . 1 . ]" 1
509 1 63 MET HA 1 64 ALA H 3.200 3.200 8.200 3.559 3.555 3.561 . 0 0 "[ . 1 . ]" 1
510 1 63 MET HA 1 66 VAL H 0.000 . 3.500 3.557 3.552 3.564 0.064 4 0 "[ . 1 . ]" 1
511 1 63 MET HA 1 66 VAL MG2 0.000 . 3.500 2.920 2.917 2.922 . 0 0 "[ . 1 . ]" 1
512 1 63 MET ME 1 109 PHE QB 0.000 . 4.800 3.591 3.583 3.595 . 0 0 "[ . 1 . ]" 1
513 1 63 MET ME 1 109 PHE HD2 0.000 . 4.800 2.451 2.359 2.615 . 0 0 "[ . 1 . ]" 1
514 1 63 MET ME 1 109 PHE HE2 0.000 . 4.800 3.099 2.936 3.272 . 0 0 "[ . 1 . ]" 1
515 1 63 MET ME 1 109 PHE HZ 4.000 4.000 5.800 4.727 4.562 4.837 . 0 0 "[ . 1 . ]" 1
516 1 63 MET ME 1 113 LEU H 0.000 . 4.800 3.699 3.424 4.005 . 0 0 "[ . 1 . ]" 1
517 1 63 MET HG2 2 109 PHE HE1 3.200 3.200 4.500 4.219 4.099 4.349 . 0 0 "[ . 1 . ]" 1
518 1 63 MET HG2 2 109 PHE HZ 4.000 4.000 5.500 3.991 3.987 3.996 0.013 19 0 "[ . 1 . ]" 1
519 1 63 MET HG3 2 109 PHE HE1 4.000 4.000 5.500 3.988 3.983 3.995 0.017 4 0 "[ . 1 . ]" 1
520 1 63 MET HG3 2 109 PHE HZ 4.000 4.000 5.500 4.047 3.993 4.163 0.007 14 0 "[ . 1 . ]" 1
521 1 63 MET O 1 67 SER H 2.200 . 2.600 2.111 2.090 2.126 . 0 0 "[ . 1 . ]" 1
522 1 64 ALA H 1 64 ALA HA 2.700 2.700 7.700 2.827 2.824 2.829 . 0 0 "[ . 1 . ]" 1
523 1 64 ALA H 1 65 GLY H 0.000 . 2.700 2.714 2.712 2.717 0.017 14 0 "[ . 1 . ]" 1
524 1 64 ALA HA 1 65 GLY H 3.200 3.200 8.200 3.545 3.542 3.548 . 0 0 "[ . 1 . ]" 1
525 1 64 ALA HA 1 67 SER H 0.000 . 3.500 3.543 3.536 3.548 0.048 13 0 "[ . 1 . ]" 1
526 1 64 ALA HA 1 68 HIS H 0.000 . 4.500 4.277 4.256 4.306 . 0 0 "[ . 1 . ]" 1
527 1 64 ALA O 1 68 HIS H 2.200 . 2.600 2.208 2.184 2.226 . 0 0 "[ . 1 . ]" 1
528 1 65 GLY H 1 65 GLY HA2 2.700 2.700 7.700 2.814 2.813 2.815 . 0 0 "[ . 1 . ]" 1
529 1 65 GLY H 1 65 GLY HA3 0.000 . 2.700 2.301 2.300 2.303 . 0 0 "[ . 1 . ]" 1
530 1 65 GLY H 1 66 VAL H 0.000 . 2.700 2.739 2.736 2.741 0.041 11 0 "[ . 1 . ]" 1
531 1 65 GLY HA2 1 66 VAL H 3.200 3.200 8.200 3.564 3.562 3.566 . 0 0 "[ . 1 . ]" 1
532 1 65 GLY HA3 1 66 VAL H 2.700 2.700 7.700 2.792 2.789 2.796 . 0 0 "[ . 1 . ]" 1
533 1 65 GLY O 1 69 ASP H 2.200 . 2.600 2.186 2.165 2.195 . 0 0 "[ . 1 . ]" 1
534 1 66 VAL H 1 66 VAL HA 2.700 2.700 7.700 2.837 2.835 2.840 . 0 0 "[ . 1 . ]" 1
535 1 66 VAL H 1 67 SER H 0.000 . 2.700 2.700 2.697 2.706 0.006 1 0 "[ . 1 . ]" 1
536 1 66 VAL HA 1 67 SER H 3.200 3.200 8.200 3.570 3.567 3.575 . 0 0 "[ . 1 . ]" 1
537 1 66 VAL HA 1 69 ASP H 0.000 . 3.500 3.541 3.534 3.559 0.059 15 0 "[ . 1 . ]" 1
538 1 66 VAL MG1 2 109 PHE HD1 0.000 . 4.000 3.344 3.340 3.348 . 0 0 "[ . 1 . ]" 1
539 1 66 VAL MG2 2 109 PHE HD1 0.000 . 4.300 1.990 1.905 2.095 . 0 0 "[ . 1 . ]" 1
540 1 66 VAL MG2 2 109 PHE HE1 0.000 . 4.300 2.552 2.416 2.668 . 0 0 "[ . 1 . ]" 1
541 1 66 VAL MG2 2 109 PHE HZ 0.000 . 5.800 4.394 4.278 4.533 . 0 0 "[ . 1 . ]" 1
542 1 66 VAL O 1 70 LEU H 2.200 . 2.600 2.170 2.130 2.219 . 0 0 "[ . 1 . ]" 1
543 1 67 SER H 1 67 SER HA 2.700 2.700 7.700 2.815 2.813 2.818 . 0 0 "[ . 1 . ]" 1
544 1 67 SER H 1 68 HIS H 0.000 . 2.700 2.726 2.719 2.733 0.033 16 0 "[ . 1 . ]" 1
545 1 67 SER HA 1 68 HIS H 3.200 3.200 8.200 3.546 3.543 3.548 . 0 0 "[ . 1 . ]" 1
546 1 67 SER QB 1 70 LEU H 0.000 . 5.800 5.167 5.123 5.200 . 0 0 "[ . 1 . ]" 1
547 1 67 SER O 1 71 ARG H 2.200 . 2.600 2.303 2.276 2.323 . 0 0 "[ . 1 . ]" 1
548 1 68 HIS H 1 68 HIS HA 2.700 2.700 7.700 2.821 2.818 2.825 . 0 0 "[ . 1 . ]" 1
549 1 68 HIS H 1 69 ASP H 0.000 . 2.700 2.755 2.751 2.759 0.059 10 0 "[ . 1 . ]" 1
550 1 68 HIS HA 1 69 ASP H 3.200 3.200 8.200 3.571 3.567 3.577 . 0 0 "[ . 1 . ]" 1
551 1 68 HIS HA 1 71 ARG H 0.000 . 3.500 3.522 3.515 3.528 0.028 9 0 "[ . 1 . ]" 1
552 1 68 HIS O 1 71 ARG H 2.200 . 2.600 2.169 2.159 2.183 . 0 0 "[ . 1 . ]" 1
553 1 69 ASP H 1 69 ASP HA 2.700 2.700 7.700 2.815 2.813 2.817 . 0 0 "[ . 1 . ]" 1
554 1 69 ASP H 1 70 LEU H 0.000 . 2.700 2.750 2.741 2.756 0.056 9 0 "[ . 1 . ]" 1
555 1 69 ASP H 2 105 ILE MG 0.000 . 5.300 4.197 4.077 4.324 . 0 0 "[ . 1 . ]" 1
556 1 69 ASP HA 1 70 LEU H 3.200 3.200 8.200 3.547 3.537 3.553 . 0 0 "[ . 1 . ]" 1
557 1 69 ASP HA 1 72 THR H 0.000 . 4.000 3.850 3.819 3.884 . 0 0 "[ . 1 . ]" 1
558 1 69 ASP HB2 2 105 ILE MG 0.000 . 4.000 2.152 2.016 2.348 . 0 0 "[ . 1 . ]" 1
559 1 69 ASP HB3 2 105 ILE MG 0.000 . 3.500 2.617 2.498 2.732 . 0 0 "[ . 1 . ]" 1
560 1 70 LEU H 1 70 LEU HA 2.700 2.700 7.700 2.859 2.852 2.866 . 0 0 "[ . 1 . ]" 1
561 1 70 LEU H 1 71 ARG H 0.000 . 2.700 2.608 2.575 2.621 . 0 0 "[ . 1 . ]" 1
562 1 70 LEU HA 1 71 ARG H 3.200 3.200 8.200 3.501 3.496 3.505 . 0 0 "[ . 1 . ]" 1
563 1 70 LEU MD1 2 106 ILE H 0.000 . 4.800 4.036 4.033 4.039 . 0 0 "[ . 1 . ]" 1
564 1 70 LEU O 1 74 LEU H 2.200 . 2.600 2.534 2.525 2.542 . 0 0 "[ . 1 . ]" 1
565 1 71 ARG H 1 71 ARG HA 2.700 2.700 7.700 2.789 2.784 2.792 . 0 0 "[ . 1 . ]" 1
566 1 71 ARG H 1 72 THR H 0.000 . 2.700 2.751 2.743 2.758 0.058 7 0 "[ . 1 . ]" 1
567 1 71 ARG HA 1 72 THR H 3.200 3.200 8.200 3.513 3.512 3.514 . 0 0 "[ . 1 . ]" 1
568 1 71 ARG HA 1 74 LEU H 0.000 . 4.000 3.885 3.862 3.913 . 0 0 "[ . 1 . ]" 1
569 1 71 ARG HA 1 75 THR H 0.000 . 4.500 4.189 4.168 4.219 . 0 0 "[ . 1 . ]" 1
570 1 71 ARG O 1 75 THR H 2.200 . 2.600 2.173 2.158 2.190 . 0 0 "[ . 1 . ]" 1
571 1 72 THR H 1 72 THR HA 2.700 2.700 7.700 2.827 2.824 2.830 . 0 0 "[ . 1 . ]" 1
572 1 72 THR H 1 73 PRO HD3 0.000 . 3.500 3.472 3.469 3.477 . 0 0 "[ . 1 . ]" 1
573 1 72 THR HA 1 74 LEU H 0.000 . 4.500 4.516 4.512 4.520 0.020 16 0 "[ . 1 . ]" 1
574 1 72 THR HA 1 76 ARG QG 0.000 . 4.800 3.907 3.792 4.180 . 0 0 "[ . 1 . ]" 1
575 1 72 THR HB 1 73 PRO HD2 0.000 . 3.200 2.569 2.536 2.616 . 0 0 "[ . 1 . ]" 1
576 1 72 THR HB 1 73 PRO HD3 0.000 . 2.700 2.064 2.047 2.076 . 0 0 "[ . 1 . ]" 1
577 1 72 THR MG 1 73 PRO HD3 0.000 . 4.200 3.396 3.277 3.506 . 0 0 "[ . 1 . ]" 1
578 1 72 THR O 1 76 ARG H 2.200 . 2.600 2.173 2.159 2.183 . 0 0 "[ . 1 . ]" 1
579 1 73 PRO HA 1 74 LEU H 3.200 3.200 8.200 3.589 3.587 3.591 . 0 0 "[ . 1 . ]" 1
580 1 73 PRO HD2 1 74 LEU H 0.000 . 3.500 3.143 3.131 3.158 . 0 0 "[ . 1 . ]" 1
581 1 73 PRO HD3 1 74 LEU H 3.200 3.200 4.500 4.120 4.114 4.129 . 0 0 "[ . 1 . ]" 1
582 1 73 PRO HD3 2 105 ILE MD 0.000 . 4.800 2.958 2.872 3.060 . 0 0 "[ . 1 . ]" 1
583 1 73 PRO QG 2 102 CYS HB3 0.000 . 4.800 4.266 4.161 4.289 . 0 0 "[ . 1 . ]" 1
584 1 73 PRO O 1 77 ILE H 2.200 . 2.600 2.191 2.152 2.206 . 0 0 "[ . 1 . ]" 1
585 1 74 LEU H 1 74 LEU HA 2.700 2.700 7.700 2.844 2.841 2.846 . 0 0 "[ . 1 . ]" 1
586 1 74 LEU H 1 75 THR H 0.000 . 2.700 2.739 2.736 2.742 0.042 13 0 "[ . 1 . ]" 1
587 1 74 LEU HA 1 75 THR H 3.200 3.200 8.200 3.561 3.559 3.564 . 0 0 "[ . 1 . ]" 1
588 1 74 LEU HA 1 77 ILE H 0.000 . 4.000 3.724 3.708 3.740 . 0 0 "[ . 1 . ]" 1
589 1 74 LEU HA 1 99 ILE MD 0.000 . 3.800 3.193 3.187 3.203 . 0 0 "[ . 1 . ]" 1
590 1 74 LEU MD2 1 103 ASN HB2 0.000 . 4.000 3.348 3.344 3.352 . 0 0 "[ . 1 . ]" 1
591 1 74 LEU O 1 78 ARG H 2.200 . 2.600 2.321 2.301 2.342 . 0 0 "[ . 1 . ]" 1
592 1 75 THR H 1 75 THR HA 2.700 2.700 7.700 2.810 2.808 2.812 . 0 0 "[ . 1 . ]" 1
593 1 75 THR H 1 76 ARG H 0.000 . 2.700 2.721 2.716 2.733 0.033 10 0 "[ . 1 . ]" 1
594 1 75 THR HA 1 76 ARG H 3.200 3.200 8.200 3.533 3.530 3.538 . 0 0 "[ . 1 . ]" 1
595 1 75 THR HA 1 78 ARG H 0.000 . 4.000 3.621 3.595 3.652 . 0 0 "[ . 1 . ]" 1
596 1 75 THR O 1 79 LEU H 2.200 . 2.600 2.206 2.188 2.238 . 0 0 "[ . 1 . ]" 1
597 1 76 ARG H 1 76 ARG HA 2.700 2.700 7.700 2.818 2.816 2.820 . 0 0 "[ . 1 . ]" 1
598 1 76 ARG H 1 77 ILE H 0.000 . 2.700 2.748 2.737 2.751 0.051 14 0 "[ . 1 . ]" 1
599 1 76 ARG HA 1 77 ILE H 3.200 3.200 8.200 3.563 3.561 3.564 . 0 0 "[ . 1 . ]" 1
600 1 76 ARG HA 1 79 LEU H 0.000 . 4.000 3.796 3.726 3.826 . 0 0 "[ . 1 . ]" 1
601 1 76 ARG O 1 80 ALA H 2.200 . 2.600 2.166 2.147 2.191 . 0 0 "[ . 1 . ]" 1
602 1 77 ILE H 1 77 ILE HA 2.700 2.700 7.700 2.837 2.833 2.841 . 0 0 "[ . 1 . ]" 1
603 1 77 ILE H 1 78 ARG H 0.000 . 2.700 2.672 2.652 2.685 . 0 0 "[ . 1 . ]" 1
604 1 77 ILE HA 1 78 ARG H 3.200 3.200 8.200 3.538 3.534 3.542 . 0 0 "[ . 1 . ]" 1
605 1 77 ILE HA 1 80 ALA H 0.000 . 4.000 3.635 3.556 3.674 . 0 0 "[ . 1 . ]" 1
606 1 77 ILE HA 1 80 ALA MB 0.000 . 3.500 2.693 2.502 2.877 . 0 0 "[ . 1 . ]" 1
607 1 77 ILE MD 2 98 ASP HB2 0.000 . 3.500 2.875 2.746 2.916 . 0 0 "[ . 1 . ]" 1
608 1 77 ILE MD 2 98 ASP HB3 0.000 . 3.500 2.654 2.463 2.791 . 0 0 "[ . 1 . ]" 1
609 1 77 ILE MG 1 81 THR H 0.000 . 4.800 3.946 3.912 3.985 . 0 0 "[ . 1 . ]" 1
610 1 77 ILE MG 2 95 ILE MD 0.000 . 3.500 2.449 2.447 2.452 . 0 0 "[ . 1 . ]" 1
611 1 77 ILE O 1 81 THR H 2.200 . 2.600 2.088 2.064 2.104 . 0 0 "[ . 1 . ]" 1
612 1 78 ARG H 1 78 ARG HA 2.700 2.700 7.700 2.840 2.836 2.855 . 0 0 "[ . 1 . ]" 1
613 1 78 ARG H 1 79 LEU H 0.000 . 2.700 2.734 2.730 2.737 0.037 4 0 "[ . 1 . ]" 1
614 1 78 ARG H 1 99 ILE MD 0.000 . 4.800 2.947 2.795 3.226 . 0 0 "[ . 1 . ]" 1
615 1 78 ARG HA 1 79 LEU H 3.200 3.200 8.200 3.565 3.562 3.578 . 0 0 "[ . 1 . ]" 1
616 1 78 ARG HA 1 81 THR H 0.000 . 4.000 3.829 3.780 3.868 . 0 0 "[ . 1 . ]" 1
617 1 78 ARG O 1 82 GLU H 2.200 . 2.600 2.278 2.260 2.299 . 0 0 "[ . 1 . ]" 1
618 1 79 LEU H 1 79 LEU HA 2.700 2.700 7.700 2.817 2.815 2.818 . 0 0 "[ . 1 . ]" 1
619 1 79 LEU H 1 80 ALA H 0.000 . 2.700 2.717 2.712 2.722 0.022 16 0 "[ . 1 . ]" 1
620 1 79 LEU HA 1 80 ALA H 3.200 3.200 8.200 3.541 3.537 3.544 . 0 0 "[ . 1 . ]" 1
621 1 79 LEU HA 1 82 GLU H 0.000 . 4.000 3.845 3.795 3.933 . 0 0 "[ . 1 . ]" 1
622 1 80 ALA H 1 80 ALA HA 2.700 2.700 7.700 2.829 2.827 2.834 . 0 0 "[ . 1 . ]" 1
623 1 80 ALA H 1 81 THR H 0.000 . 2.700 2.730 2.727 2.735 0.035 17 0 "[ . 1 . ]" 1
624 1 80 ALA HA 1 81 THR H 3.200 3.200 8.200 3.568 3.566 3.572 . 0 0 "[ . 1 . ]" 1
625 1 80 ALA HA 1 83 MET H 0.000 . 4.000 4.001 3.991 4.007 0.007 2 0 "[ . 1 . ]" 1
626 1 80 ALA HA 2 91 LEU QD 0.000 . 3.500 2.682 2.620 2.741 . 0 0 "[ . 1 . ]" 1
627 1 80 ALA MB 2 91 LEU QD 0.000 . 4.000 2.265 2.145 2.384 . 0 0 "[ . 1 . ]" 1
628 1 80 ALA MB 2 95 ILE MD 0.000 . 4.000 2.782 2.780 2.785 . 0 0 "[ . 1 . ]" 1
629 1 80 ALA O 1 83 MET H 2.200 . 2.600 2.084 2.069 2.097 . 0 0 "[ . 1 . ]" 1
630 1 81 THR H 1 81 THR HA 2.700 2.700 7.700 2.807 2.805 2.810 . 0 0 "[ . 1 . ]" 1
631 1 81 THR H 1 82 GLU H 0.000 . 2.700 2.724 2.719 2.727 0.027 11 0 "[ . 1 . ]" 1
632 1 81 THR HA 1 82 GLU H 3.200 3.200 8.200 3.531 3.522 3.536 . 0 0 "[ . 1 . ]" 1
633 1 81 THR HA 1 84 MET H 0.000 . 4.000 3.787 3.745 3.853 . 0 0 "[ . 1 . ]" 1
634 1 81 THR HA 1 84 MET QG 0.000 . 4.000 3.025 2.552 3.232 . 0 0 "[ . 1 . ]" 1
635 1 81 THR HB 1 92 ALA MB 0.000 . 3.500 2.333 2.006 2.638 . 0 0 "[ . 1 . ]" 1
636 1 81 THR MG 1 95 ILE HB 0.000 . 3.500 2.406 2.237 2.525 . 0 0 "[ . 1 . ]" 1
637 1 81 THR MG 1 95 ILE MG 0.000 . 3.800 2.359 2.225 2.498 . 0 0 "[ . 1 . ]" 1
638 1 81 THR MG 1 96 ASN H 0.000 . 4.800 3.998 3.980 4.007 . 0 0 "[ . 1 . ]" 1
639 1 81 THR MG 2 95 ILE MD 0.000 . 2.700 1.888 1.881 1.905 . 0 0 "[ . 1 . ]" 1
640 1 81 THR O 1 84 MET H 2.200 . 2.600 2.057 2.040 2.083 . 0 0 "[ . 1 . ]" 1
641 1 82 GLU H 1 82 GLU HA 2.700 2.700 7.700 2.781 2.779 2.783 . 0 0 "[ . 1 . ]" 1
642 1 82 GLU H 1 83 MET H 0.000 . 3.200 2.883 2.878 2.890 . 0 0 "[ . 1 . ]" 1
643 1 82 GLU HA 1 83 MET H 3.200 3.200 8.200 3.484 3.482 3.486 . 0 0 "[ . 1 . ]" 1
644 1 83 MET H 1 83 MET HA 2.700 2.700 7.700 2.926 2.921 2.931 . 0 0 "[ . 1 . ]" 1
645 1 83 MET H 1 84 MET H 0.000 . 2.700 2.557 2.541 2.582 . 0 0 "[ . 1 . ]" 1
646 1 83 MET H 2 91 LEU QD 0.000 . 4.800 3.379 3.329 3.429 . 0 0 "[ . 1 . ]" 1
647 1 83 MET HA 1 84 MET H 3.200 3.200 8.200 3.310 3.307 3.316 . 0 0 "[ . 1 . ]" 1
648 1 84 MET H 1 84 MET HA 2.700 2.700 7.700 2.873 2.864 2.880 . 0 0 "[ . 1 . ]" 1
649 1 84 MET H 2 91 LEU QD 0.000 . 4.800 3.429 3.387 3.490 . 0 0 "[ . 1 . ]" 1
650 1 84 MET HA 2 91 LEU QD 0.000 . 3.500 2.472 2.379 2.540 . 0 0 "[ . 1 . ]" 1
651 1 84 MET QB 1 92 ALA MB 0.000 . 4.200 2.672 2.545 2.768 . 0 0 "[ . 1 . ]" 1
652 1 84 MET ME 1 88 ASP HB3 0.000 . 3.200 2.683 2.677 2.694 . 0 0 "[ . 1 . ]" 1
653 1 84 MET ME 1 91 LEU QB 3.500 3.500 5.000 2.631 2.614 2.648 0.886 1 19 [+*****-************] 1
654 1 84 MET ME 1 95 ILE MD 0.000 . 4.800 3.329 3.279 3.340 . 0 0 "[ . 1 . ]" 1
655 1 84 MET QG 2 91 LEU QD 0.000 . 4.000 1.896 1.848 2.000 . 0 0 "[ . 1 . ]" 1
656 1 85 SER QB 1 88 ASP H 0.000 . 4.800 3.358 3.239 4.142 . 0 0 "[ . 1 . ]" 1
657 1 86 GLU HA 1 89 GLY H 0.000 . 4.500 3.693 3.663 3.773 . 0 0 "[ . 1 . ]" 1
658 1 86 GLU O 1 89 GLY H 2.200 . 2.600 2.057 2.047 2.073 . 0 0 "[ . 1 . ]" 1
659 1 87 GLN HA 1 88 ASP H 3.200 3.200 8.200 3.497 3.496 3.502 . 0 0 "[ . 1 . ]" 1
660 1 87 GLN HA 1 89 GLY H 0.000 . 4.000 4.006 3.955 4.017 0.017 12 0 "[ . 1 . ]" 1
661 1 88 ASP H 1 88 ASP HA 2.700 2.700 7.700 2.966 2.963 2.969 . 0 0 "[ . 1 . ]" 1
662 1 88 ASP H 1 89 GLY H 0.000 . 2.700 2.642 2.625 2.667 . 0 0 "[ . 1 . ]" 1
663 1 88 ASP HA 1 89 GLY H 0.000 . 3.200 2.969 2.947 3.023 . 0 0 "[ . 1 . ]" 1
664 1 88 ASP HA 1 90 TYR HD1 0.000 . 4.000 3.852 3.777 3.910 . 0 0 "[ . 1 . ]" 1
665 1 88 ASP HA 1 90 TYR HE1 0.000 . 3.500 3.163 3.109 3.211 . 0 0 "[ . 1 . ]" 1
666 1 88 ASP HA 1 91 LEU H 0.000 . 4.000 3.631 3.605 3.662 . 0 0 "[ . 1 . ]" 1
667 1 88 ASP HA 1 91 LEU QB 3.200 3.200 5.000 3.807 3.746 3.850 . 0 0 "[ . 1 . ]" 1
668 1 88 ASP HA 1 91 LEU QD 0.000 . 4.000 3.215 3.153 3.307 . 0 0 "[ . 1 . ]" 1
669 1 88 ASP HA 1 91 LEU HG 3.200 3.200 5.000 4.335 4.280 4.391 . 0 0 "[ . 1 . ]" 1
670 1 88 ASP O 1 91 LEU H 2.200 . 2.600 2.124 2.114 2.147 . 0 0 "[ . 1 . ]" 1
671 1 88 ASP O 1 92 ALA H 2.200 . 2.600 2.367 2.350 2.380 . 0 0 "[ . 1 . ]" 1
672 1 89 GLY H 1 89 GLY HA2 2.700 2.700 7.700 2.803 2.799 2.805 . 0 0 "[ . 1 . ]" 1
673 1 89 GLY H 1 89 GLY HA3 0.000 . 2.700 2.297 2.293 2.299 . 0 0 "[ . 1 . ]" 1
674 1 89 GLY H 1 90 TYR H 0.000 . 2.700 2.734 2.731 2.743 0.043 17 0 "[ . 1 . ]" 1
675 1 89 GLY HA2 1 92 ALA H 0.000 . 3.500 3.512 3.508 3.514 0.014 10 0 "[ . 1 . ]" 1
676 1 89 GLY HA2 1 92 ALA MB 0.000 . 4.000 2.803 2.690 2.963 . 0 0 "[ . 1 . ]" 1
677 1 89 GLY HA2 1 93 GLU H 0.000 . 4.500 4.229 4.197 4.251 . 0 0 "[ . 1 . ]" 1
678 1 89 GLY O 1 93 GLU H 2.200 . 2.600 2.099 2.075 2.114 . 0 0 "[ . 1 . ]" 1
679 1 90 TYR H 1 90 TYR HA 2.700 2.700 7.700 2.835 2.832 2.837 . 0 0 "[ . 1 . ]" 1
680 1 90 TYR HA 1 91 LEU H 3.200 3.200 8.200 3.511 3.509 3.515 . 0 0 "[ . 1 . ]" 1
681 1 90 TYR HA 1 93 GLU H 0.000 . 3.500 3.509 3.506 3.512 0.012 7 0 "[ . 1 . ]" 1
682 1 90 TYR HD2 1 91 LEU QD 0.000 . 4.000 3.191 3.173 3.214 . 0 0 "[ . 1 . ]" 1
683 1 90 TYR HE2 1 91 LEU QD 0.000 . 3.500 2.521 2.460 2.580 . 0 0 "[ . 1 . ]" 1
684 1 90 TYR O 1 94 SER H 2.200 . 2.600 2.241 2.231 2.257 . 0 0 "[ . 1 . ]" 1
685 1 91 LEU H 1 91 LEU HA 2.700 2.700 7.700 2.869 2.867 2.871 . 0 0 "[ . 1 . ]" 1
686 1 91 LEU H 1 92 ALA H 0.000 . 2.700 2.513 2.502 2.521 . 0 0 "[ . 1 . ]" 1
687 1 91 LEU HA 1 92 ALA H 3.200 3.200 8.200 3.551 3.549 3.552 . 0 0 "[ . 1 . ]" 1
688 1 91 LEU HA 1 94 SER H 0.000 . 3.500 3.529 3.524 3.536 0.036 17 0 "[ . 1 . ]" 1
689 1 91 LEU QD 2 80 ALA HA 0.000 . 3.500 2.660 2.605 2.735 . 0 0 "[ . 1 . ]" 1
690 1 91 LEU QD 2 80 ALA MB 0.000 . 4.000 2.209 2.046 2.388 . 0 0 "[ . 1 . ]" 1
691 1 91 LEU QD 2 83 MET H 0.000 . 4.800 3.373 3.317 3.428 . 0 0 "[ . 1 . ]" 1
692 1 91 LEU QD 2 84 MET H 0.000 . 4.800 3.430 3.369 3.452 . 0 0 "[ . 1 . ]" 1
693 1 91 LEU QD 2 84 MET HA 0.000 . 3.500 2.488 2.363 2.554 . 0 0 "[ . 1 . ]" 1
694 1 91 LEU QD 2 84 MET QG 0.000 . 4.000 1.900 1.871 2.030 . 0 0 "[ . 1 . ]" 1
695 1 91 LEU O 1 95 ILE H 2.200 . 2.600 2.205 2.193 2.223 . 0 0 "[ . 1 . ]" 1
696 1 92 ALA H 1 92 ALA HA 2.700 2.700 7.700 2.823 2.822 2.825 . 0 0 "[ . 1 . ]" 1
697 1 92 ALA H 1 93 GLU H 0.000 . 2.700 2.715 2.710 2.718 0.018 9 0 "[ . 1 . ]" 1
698 1 92 ALA HA 1 93 GLU H 3.200 3.200 8.200 3.541 3.538 3.543 . 0 0 "[ . 1 . ]" 1
699 1 92 ALA HA 1 95 ILE H 0.000 . 3.500 3.525 3.522 3.528 0.028 1 0 "[ . 1 . ]" 1
700 1 92 ALA HA 1 95 ILE HB 0.000 . 3.500 2.948 2.890 2.985 . 0 0 "[ . 1 . ]" 1
701 1 92 ALA O 1 96 ASN H 2.200 . 2.600 2.129 2.111 2.147 . 0 0 "[ . 1 . ]" 1
702 1 93 GLU H 1 93 GLU HA 2.700 2.700 7.700 2.817 2.815 2.819 . 0 0 "[ . 1 . ]" 1
703 1 93 GLU H 1 94 SER H 0.000 . 2.700 2.723 2.721 2.725 0.025 3 0 "[ . 1 . ]" 1
704 1 93 GLU HA 1 94 SER H 3.200 3.200 8.200 3.563 3.560 3.568 . 0 0 "[ . 1 . ]" 1
705 1 93 GLU HA 1 96 ASN H 0.000 . 3.500 3.514 3.510 3.517 0.017 17 0 "[ . 1 . ]" 1
706 1 93 GLU O 1 97 LYS H 2.200 . 2.600 2.159 2.148 2.172 . 0 0 "[ . 1 . ]" 1
707 1 94 SER H 1 94 SER HA 2.700 2.700 7.700 2.820 2.819 2.822 . 0 0 "[ . 1 . ]" 1
708 1 94 SER H 1 95 ILE H 0.000 . 2.700 2.738 2.734 2.742 0.042 14 0 "[ . 1 . ]" 1
709 1 94 SER HA 1 95 ILE H 3.200 3.200 8.200 3.559 3.554 3.561 . 0 0 "[ . 1 . ]" 1
710 1 94 SER HA 1 97 LYS H 0.000 . 3.500 3.532 3.526 3.536 0.036 17 0 "[ . 1 . ]" 1
711 1 94 SER O 1 98 ASP H 2.200 . 2.600 2.184 2.167 2.200 . 0 0 "[ . 1 . ]" 1
712 1 95 ILE H 1 95 ILE HA 2.700 2.700 7.700 2.832 2.830 2.834 . 0 0 "[ . 1 . ]" 1
713 1 95 ILE H 1 96 ASN H 0.000 . 2.700 2.718 2.712 2.724 0.024 17 0 "[ . 1 . ]" 1
714 1 95 ILE HA 1 96 ASN H 3.200 3.200 8.200 3.562 3.560 3.565 . 0 0 "[ . 1 . ]" 1
715 1 95 ILE HA 1 98 ASP H 0.000 . 3.500 3.352 3.323 3.389 . 0 0 "[ . 1 . ]" 1
716 1 95 ILE MD 2 77 ILE MG 0.000 . 3.500 2.448 2.442 2.451 . 0 0 "[ . 1 . ]" 1
717 1 95 ILE MD 2 80 ALA MB 0.000 . 4.000 2.781 2.778 2.784 . 0 0 "[ . 1 . ]" 1
718 1 95 ILE MD 2 81 THR MG 0.000 . 2.700 1.889 1.881 1.901 . 0 0 "[ . 1 . ]" 1
719 1 95 ILE O 1 99 ILE H 2.200 . 2.600 2.174 2.146 2.190 . 0 0 "[ . 1 . ]" 1
720 1 96 ASN H 1 96 ASN HA 2.700 2.700 7.700 2.810 2.808 2.813 . 0 0 "[ . 1 . ]" 1
721 1 96 ASN H 1 97 LYS H 0.000 . 2.700 2.752 2.748 2.754 0.054 17 0 "[ . 1 . ]" 1
722 1 96 ASN HA 1 97 LYS H 3.200 3.200 8.200 3.551 3.550 3.553 . 0 0 "[ . 1 . ]" 1
723 1 96 ASN HA 1 99 ILE H 0.000 . 3.500 3.512 3.508 3.518 0.018 17 0 "[ . 1 . ]" 1
724 1 96 ASN HA 1 99 ILE HB 0.000 . 3.200 3.190 3.130 3.208 0.008 14 0 "[ . 1 . ]" 1
725 1 96 ASN O 1 100 GLU H 2.200 . 2.600 2.264 2.250 2.280 . 0 0 "[ . 1 . ]" 1
726 1 97 LYS H 1 97 LYS HA 2.700 2.700 7.700 2.823 2.821 2.825 . 0 0 "[ . 1 . ]" 1
727 1 97 LYS H 1 98 ASP H 0.000 . 2.700 2.705 2.700 2.707 0.007 19 0 "[ . 1 . ]" 1
728 1 97 LYS HA 1 98 ASP H 3.200 3.200 8.200 3.538 3.535 3.542 . 0 0 "[ . 1 . ]" 1
729 1 97 LYS HA 1 100 GLU H 0.000 . 3.500 3.507 3.501 3.514 0.014 3 0 "[ . 1 . ]" 1
730 1 97 LYS O 1 101 GLU H 2.200 . 2.600 2.181 2.164 2.199 . 0 0 "[ . 1 . ]" 1
731 1 98 ASP H 1 98 ASP HA 2.700 2.700 7.700 2.812 2.809 2.813 . 0 0 "[ . 1 . ]" 1
732 1 98 ASP H 1 99 ILE H 0.000 . 2.700 2.746 2.744 2.747 0.047 7 0 "[ . 1 . ]" 1
733 1 98 ASP HA 1 99 ILE H 3.200 3.200 8.200 3.564 3.558 3.569 . 0 0 "[ . 1 . ]" 1
734 1 98 ASP HA 1 101 GLU H 0.000 . 3.500 3.500 3.477 3.511 0.011 7 0 "[ . 1 . ]" 1
735 1 98 ASP HB2 2 77 ILE MD 0.000 . 3.500 2.896 2.808 2.916 . 0 0 "[ . 1 . ]" 1
736 1 98 ASP HB3 2 77 ILE MD 0.000 . 3.500 2.652 2.505 2.790 . 0 0 "[ . 1 . ]" 1
737 1 98 ASP O 1 102 CYS H 2.200 . 2.600 2.113 2.098 2.123 . 0 0 "[ . 1 . ]" 1
738 1 99 ILE H 1 99 ILE HA 2.700 2.700 7.700 2.837 2.830 2.839 . 0 0 "[ . 1 . ]" 1
739 1 99 ILE H 1 100 GLU H 0.000 . 2.700 2.710 2.704 2.715 0.015 17 0 "[ . 1 . ]" 1
740 1 99 ILE HA 1 100 GLU H 3.200 3.200 8.200 3.560 3.554 3.563 . 0 0 "[ . 1 . ]" 1
741 1 99 ILE HA 1 102 CYS H 0.000 . 3.500 3.353 3.332 3.373 . 0 0 "[ . 1 . ]" 1
742 1 99 ILE HA 1 102 CYS HB2 0.000 . 3.200 3.066 3.031 3.099 . 0 0 "[ . 1 . ]" 1
743 1 99 ILE HA 1 102 CYS HB3 0.000 . 3.200 2.802 2.743 2.843 . 0 0 "[ . 1 . ]" 1
744 1 99 ILE MG 1 102 CYS HB3 0.000 . 4.000 3.332 3.212 3.345 . 0 0 "[ . 1 . ]" 1
745 1 99 ILE O 1 103 ASN H 2.200 . 2.600 2.072 2.026 2.098 . 0 0 "[ . 1 . ]" 1
746 1 100 GLU H 1 100 GLU HA 2.700 2.700 7.700 2.822 2.819 2.834 . 0 0 "[ . 1 . ]" 1
747 1 100 GLU H 1 101 GLU H 0.000 . 2.700 2.737 2.735 2.740 0.040 5 0 "[ . 1 . ]" 1
748 1 100 GLU HA 1 101 GLU H 3.200 3.200 8.200 3.557 3.553 3.567 . 0 0 "[ . 1 . ]" 1
749 1 100 GLU HA 1 103 ASN H 0.000 . 3.500 3.511 3.485 3.518 0.018 1 0 "[ . 1 . ]" 1
750 1 100 GLU HA 1 103 ASN HB2 0.000 . 3.200 3.228 3.203 3.237 0.037 1 0 "[ . 1 . ]" 1
751 1 100 GLU O 1 104 ALA H 2.200 . 2.600 2.140 2.124 2.148 . 0 0 "[ . 1 . ]" 1
752 1 101 GLU H 1 101 GLU HA 2.700 2.700 7.700 2.826 2.823 2.830 . 0 0 "[ . 1 . ]" 1
753 1 101 GLU H 1 102 CYS H 0.000 . 2.700 2.691 2.674 2.702 0.002 17 0 "[ . 1 . ]" 1
754 1 101 GLU HA 1 102 CYS H 3.200 3.200 8.200 3.545 3.542 3.547 . 0 0 "[ . 1 . ]" 1
755 1 101 GLU HA 1 104 ALA H 0.000 . 3.500 3.450 3.418 3.485 . 0 0 "[ . 1 . ]" 1
756 1 101 GLU O 1 105 ILE H 2.200 . 2.600 2.151 2.140 2.160 . 0 0 "[ . 1 . ]" 1
757 1 102 CYS H 1 102 CYS HA 2.700 2.700 7.700 2.811 2.809 2.813 . 0 0 "[ . 1 . ]" 1
758 1 102 CYS H 1 103 ASN H 0.000 . 2.700 2.745 2.741 2.747 0.047 10 0 "[ . 1 . ]" 1
759 1 102 CYS HA 1 103 ASN H 3.200 3.200 8.200 3.544 3.543 3.546 . 0 0 "[ . 1 . ]" 1
760 1 102 CYS HA 1 105 ILE H 0.000 . 3.500 3.540 3.535 3.545 0.045 2 0 "[ . 1 . ]" 1
761 1 102 CYS HA 1 105 ILE MD 0.000 . 3.500 1.990 1.971 2.000 . 0 0 "[ . 1 . ]" 1
762 1 102 CYS HB2 1 105 ILE MD 0.000 . 4.800 3.973 3.923 4.002 . 0 0 "[ . 1 . ]" 1
763 1 102 CYS HB3 2 73 PRO QG 0.000 . 4.800 4.272 4.188 4.283 . 0 0 "[ . 1 . ]" 1
764 1 102 CYS O 1 106 ILE H 2.200 . 2.600 2.281 2.257 2.301 . 0 0 "[ . 1 . ]" 1
765 1 103 ASN H 1 103 ASN HA 2.700 2.700 7.700 2.833 2.830 2.835 . 0 0 "[ . 1 . ]" 1
766 1 103 ASN H 1 104 ALA H 0.000 . 2.700 2.634 2.617 2.644 . 0 0 "[ . 1 . ]" 1
767 1 103 ASN HA 1 104 ALA H 3.200 3.200 8.200 3.533 3.530 3.536 . 0 0 "[ . 1 . ]" 1
768 1 103 ASN HA 1 106 ILE H 0.000 . 3.500 3.548 3.543 3.553 0.053 17 0 "[ . 1 . ]" 1
769 1 103 ASN O 1 107 GLU H 2.200 . 2.600 2.056 2.042 2.074 . 0 0 "[ . 1 . ]" 1
770 1 104 ALA H 1 104 ALA HA 2.700 2.700 7.700 2.812 2.810 2.813 . 0 0 "[ . 1 . ]" 1
771 1 104 ALA H 1 105 ILE H 0.000 . 2.700 2.729 2.726 2.731 0.031 4 0 "[ . 1 . ]" 1
772 1 104 ALA HA 1 105 ILE H 3.200 3.200 8.200 3.560 3.558 3.562 . 0 0 "[ . 1 . ]" 1
773 1 104 ALA HA 1 107 GLU H 0.000 . 3.500 3.530 3.525 3.537 0.037 1 0 "[ . 1 . ]" 1
774 1 104 ALA O 1 108 GLN H 2.200 . 2.600 1.984 1.965 2.001 . 0 0 "[ . 1 . ]" 1
775 1 105 ILE H 1 105 ILE HA 2.700 2.700 7.700 2.835 2.833 2.837 . 0 0 "[ . 1 . ]" 1
776 1 105 ILE H 1 106 ILE H 0.000 . 2.700 2.733 2.730 2.738 0.038 7 0 "[ . 1 . ]" 1
777 1 105 ILE HA 1 106 ILE H 3.200 3.200 8.200 3.578 3.575 3.580 . 0 0 "[ . 1 . ]" 1
778 1 105 ILE HA 1 108 GLN H 0.000 . 3.500 3.471 3.441 3.504 0.004 16 0 "[ . 1 . ]" 1
779 1 105 ILE MD 2 73 PRO HD3 0.000 . 4.800 2.937 2.834 3.036 . 0 0 "[ . 1 . ]" 1
780 1 105 ILE MG 2 69 ASP H 0.000 . 5.300 4.072 4.017 4.107 . 0 0 "[ . 1 . ]" 1
781 1 105 ILE MG 2 69 ASP HB2 0.000 . 4.000 2.067 1.983 2.149 . 0 0 "[ . 1 . ]" 1
782 1 105 ILE MG 2 69 ASP HB3 0.000 . 3.500 2.566 2.491 2.688 . 0 0 "[ . 1 . ]" 1
783 1 105 ILE O 1 109 PHE H 2.200 . 2.600 2.245 2.228 2.265 . 0 0 "[ . 1 . ]" 1
784 1 106 ILE H 1 106 ILE HA 2.700 2.700 7.700 2.835 2.833 2.837 . 0 0 "[ . 1 . ]" 1
785 1 106 ILE H 1 107 GLU H 0.000 . 2.700 2.732 2.724 2.736 0.036 4 0 "[ . 1 . ]" 1
786 1 106 ILE H 2 70 LEU MD1 0.000 . 4.800 4.036 4.033 4.039 . 0 0 "[ . 1 . ]" 1
787 1 106 ILE HA 1 107 GLU H 3.200 3.200 8.200 3.559 3.557 3.561 . 0 0 "[ . 1 . ]" 1
788 1 106 ILE HA 1 109 PHE H 0.000 . 3.500 3.517 3.509 3.524 0.024 11 0 "[ . 1 . ]" 1
789 1 106 ILE O 1 110 ILE H 2.200 . 2.600 2.329 2.297 2.350 . 0 0 "[ . 1 . ]" 1
790 1 107 GLU H 1 107 GLU HA 2.700 2.700 7.700 2.823 2.820 2.826 . 0 0 "[ . 1 . ]" 1
791 1 107 GLU H 1 108 GLN H 0.000 . 2.700 2.693 2.674 2.704 0.004 16 0 "[ . 1 . ]" 1
792 1 107 GLU HA 1 108 GLN H 3.200 3.200 8.200 3.541 3.535 3.549 . 0 0 "[ . 1 . ]" 1
793 1 107 GLU HA 1 110 ILE H 0.000 . 3.500 3.519 3.513 3.525 0.025 1 0 "[ . 1 . ]" 1
794 1 107 GLU O 1 111 ASP H 2.200 . 2.600 2.071 2.064 2.088 . 0 0 "[ . 1 . ]" 1
795 1 108 GLN H 1 108 GLN HA 2.700 2.700 7.700 2.806 2.804 2.808 . 0 0 "[ . 1 . ]" 1
796 1 108 GLN H 1 109 PHE H 0.000 . 2.700 2.716 2.713 2.719 0.019 8 0 "[ . 1 . ]" 1
797 1 108 GLN HA 1 109 PHE H 3.200 3.200 8.200 3.548 3.543 3.552 . 0 0 "[ . 1 . ]" 1
798 1 108 GLN HA 1 111 ASP H 0.000 . 3.500 3.469 3.435 3.501 0.001 5 0 "[ . 1 . ]" 1
799 1 108 GLN O 1 112 TYR H 2.200 . 2.600 2.096 2.076 2.122 . 0 0 "[ . 1 . ]" 1
800 1 109 PHE H 1 109 PHE HA 2.700 2.700 7.700 2.820 2.818 2.821 . 0 0 "[ . 1 . ]" 1
801 1 109 PHE H 1 110 ILE H 0.000 . 2.700 2.747 2.743 2.750 0.050 8 0 "[ . 1 . ]" 1
802 1 109 PHE HA 1 110 ILE H 3.200 3.200 8.200 3.558 3.556 3.562 . 0 0 "[ . 1 . ]" 1
803 1 109 PHE HA 1 112 TYR H 0.000 . 3.500 3.536 3.524 3.544 0.044 5 0 "[ . 1 . ]" 1
804 1 109 PHE HD1 2 62 LEU MD1 0.000 . 4.000 3.339 3.332 3.344 . 0 0 "[ . 1 . ]" 1
805 1 109 PHE HD1 2 62 LEU MD2 0.000 . 3.500 2.921 2.916 2.926 . 0 0 "[ . 1 . ]" 1
806 1 109 PHE HD1 2 62 LEU HG 2.500 2.500 4.000 3.119 3.068 3.156 . 0 0 "[ . 1 . ]" 1
807 1 109 PHE HD1 2 66 VAL MG1 0.000 . 4.000 3.352 3.347 3.356 . 0 0 "[ . 1 . ]" 1
808 1 109 PHE HD1 2 66 VAL MG2 0.000 . 4.300 2.123 2.042 2.200 . 0 0 "[ . 1 . ]" 1
809 1 109 PHE HE1 2 62 LEU QB 0.000 . 4.300 3.347 3.312 3.364 . 0 0 "[ . 1 . ]" 1
810 1 109 PHE HE1 2 62 LEU MD2 0.000 . 3.500 2.169 2.109 2.236 . 0 0 "[ . 1 . ]" 1
811 1 109 PHE HE1 2 62 LEU HG 0.000 . 3.500 2.070 2.061 2.082 . 0 0 "[ . 1 . ]" 1
812 1 109 PHE HE1 2 63 MET HG2 3.200 3.200 4.500 4.413 4.317 4.484 . 0 0 "[ . 1 . ]" 1
813 1 109 PHE HE1 2 63 MET HG3 4.000 4.000 5.500 4.217 4.157 4.296 . 0 0 "[ . 1 . ]" 1
814 1 109 PHE HE1 2 66 VAL MG2 0.000 . 4.300 2.592 2.476 2.679 . 0 0 "[ . 1 . ]" 1
815 1 109 PHE HZ 2 62 LEU HG 3.500 3.500 4.500 4.514 4.505 4.521 0.021 10 0 "[ . 1 . ]" 1
816 1 109 PHE HZ 2 63 MET HG2 4.000 4.000 5.500 3.978 3.974 3.981 0.026 14 0 "[ . 1 . ]" 1
817 1 109 PHE HZ 2 63 MET HG3 4.000 4.000 5.500 3.993 3.989 3.997 0.011 2 0 "[ . 1 . ]" 1
818 1 109 PHE HZ 2 66 VAL MG2 0.000 . 5.800 4.314 4.242 4.426 . 0 0 "[ . 1 . ]" 1
819 1 109 PHE O 1 113 LEU H 2.200 . 2.600 2.197 2.172 2.218 . 0 0 "[ . 1 . ]" 1
820 1 110 ILE H 1 110 ILE HA 2.700 2.700 7.700 2.842 2.838 2.845 . 0 0 "[ . 1 . ]" 1
821 1 110 ILE H 1 111 ASP H 0.000 . 2.700 2.652 2.633 2.674 . 0 0 "[ . 1 . ]" 1
822 1 110 ILE HA 1 111 ASP H 3.200 3.200 8.200 3.520 3.513 3.528 . 0 0 "[ . 1 . ]" 1
823 1 110 ILE HA 1 113 LEU H 0.000 . 3.500 3.545 3.535 3.556 0.056 5 0 "[ . 1 . ]" 1
824 1 111 ASP H 1 111 ASP HA 2.700 2.700 7.700 2.825 2.819 2.837 . 0 0 "[ . 1 . ]" 1
825 1 111 ASP H 1 112 TYR H 0.000 . 2.700 2.664 2.610 2.693 . 0 0 "[ . 1 . ]" 1
826 1 111 ASP HA 1 112 TYR H 3.200 3.200 8.200 3.550 3.537 3.557 . 0 0 "[ . 1 . ]" 1
827 1 112 TYR H 1 112 TYR HA 2.700 2.700 7.700 2.823 2.819 2.825 . 0 0 "[ . 1 . ]" 1
828 1 112 TYR H 1 113 LEU H 0.000 . 2.700 2.735 2.728 2.740 0.040 9 0 "[ . 1 . ]" 1
829 1 112 TYR HA 1 113 LEU H 3.200 3.200 8.200 3.580 3.575 3.585 . 0 0 "[ . 1 . ]" 1
830 1 113 LEU H 1 113 LEU HA 2.700 2.700 7.700 2.877 2.857 2.947 . 0 0 "[ . 1 . ]" 1
831 1 113 LEU H 1 114 ARG H 0.000 . 2.700 2.570 2.461 2.758 0.058 19 0 "[ . 1 . ]" 1
832 2 6 ILE HA 2 7 THR H 3.200 3.200 8.200 3.521 3.519 3.532 . 0 0 "[ . 1 . ]" 1
833 2 6 ILE HB 2 7 THR H 0.000 . 4.000 2.809 2.676 2.883 . 0 0 "[ . 1 . ]" 1
834 2 7 THR H 2 7 THR HA 2.700 2.700 7.700 2.865 2.843 2.887 . 0 0 "[ . 1 . ]" 1
835 2 7 THR H 2 8 ARG H 0.000 . 2.700 2.528 2.447 2.599 . 0 0 "[ . 1 . ]" 1
836 2 7 THR HA 2 8 ARG H 3.200 3.200 8.200 3.515 3.511 3.517 . 0 0 "[ . 1 . ]" 1
837 2 7 THR HB 2 8 ARG H 0.000 . 4.000 3.874 3.728 3.972 . 0 0 "[ . 1 . ]" 1
838 2 7 THR O 2 11 ILE H 2.200 . 2.600 2.199 2.163 2.239 . 0 0 "[ . 1 . ]" 1
839 2 8 ARG H 2 8 ARG HA 2.700 2.700 7.700 2.786 2.777 2.797 . 0 0 "[ . 1 . ]" 1
840 2 8 ARG H 2 8 ARG QB 0.000 . 3.500 2.238 2.233 2.248 . 0 0 "[ . 1 . ]" 1
841 2 8 ARG H 2 9 PRO HD2 0.000 . 2.700 2.412 2.347 2.462 . 0 0 "[ . 1 . ]" 1
842 2 8 ARG HA 2 11 ILE H 0.000 . 4.000 3.906 3.845 3.993 . 0 0 "[ . 1 . ]" 1
843 2 8 ARG HA 2 11 ILE HB 0.000 . 3.200 3.229 3.223 3.232 0.032 12 0 "[ . 1 . ]" 1
844 2 8 ARG HB3 2 31 HIS HE1 4.000 3.500 4.500 4.416 4.243 4.503 0.003 9 0 "[ . 1 . ]" 1
845 2 8 ARG HG3 2 31 HIS HE1 3.200 2.700 3.700 3.715 3.706 3.728 0.028 14 0 "[ . 1 . ]" 1
846 2 8 ARG O 2 12 GLU H 2.200 . 2.600 2.115 2.037 2.155 . 0 0 "[ . 1 . ]" 1
847 2 9 PRO HA 2 10 ILE H 3.200 3.200 8.200 3.548 3.541 3.563 . 0 0 "[ . 1 . ]" 1
848 2 9 PRO HA 2 12 GLU H 0.000 . 3.500 3.529 3.524 3.535 0.035 3 0 "[ . 1 . ]" 1
849 2 9 PRO HA 2 12 GLU HB2 0.000 . 2.700 2.549 2.475 2.580 . 0 0 "[ . 1 . ]" 1
850 2 9 PRO HA 2 12 GLU HB3 0.000 . 4.000 4.034 4.026 4.050 0.050 18 0 "[ . 1 . ]" 1
851 2 9 PRO HA 2 13 LEU H 0.000 . 4.500 3.998 3.936 4.037 . 0 0 "[ . 1 . ]" 1
852 2 9 PRO HA 2 31 HIS HD2 0.000 . 4.000 3.577 3.335 3.679 . 0 0 "[ . 1 . ]" 1
853 2 9 PRO HA 2 31 HIS HE1 4.000 3.500 4.500 3.472 3.467 3.479 0.033 6 0 "[ . 1 . ]" 1
854 2 9 PRO HB2 2 31 HIS HD2 0.000 . 4.500 4.506 4.491 4.518 0.018 18 0 "[ . 1 . ]" 1
855 2 9 PRO HB3 2 31 HIS HE1 4.000 3.500 4.500 3.852 3.661 4.304 . 0 0 "[ . 1 . ]" 1
856 2 9 PRO HG2 2 38 ILE MD 0.000 . 4.800 3.834 3.500 4.002 . 0 0 "[ . 1 . ]" 1
857 2 9 PRO HG3 2 38 ILE MD 0.000 . 4.800 2.826 2.496 3.042 . 0 0 "[ . 1 . ]" 1
858 2 9 PRO O 2 13 LEU H 2.200 . 2.600 1.982 1.950 2.000 . 0 0 "[ . 1 . ]" 1
859 2 10 ILE H 2 10 ILE HA 2.700 2.700 7.700 2.851 2.848 2.856 . 0 0 "[ . 1 . ]" 1
860 2 10 ILE H 2 10 ILE HB 0.000 . 2.700 2.604 2.596 2.619 . 0 0 "[ . 1 . ]" 1
861 2 10 ILE H 2 10 ILE QG 0.000 . 3.500 2.006 2.002 2.008 . 0 0 "[ . 1 . ]" 1
862 2 10 ILE H 2 11 ILE H 0.000 . 2.700 2.641 2.619 2.681 . 0 0 "[ . 1 . ]" 1
863 2 10 ILE HA 2 10 ILE MG 0.000 . 3.500 2.371 2.353 2.382 . 0 0 "[ . 1 . ]" 1
864 2 10 ILE HA 2 11 ILE H 3.200 3.200 8.200 3.558 3.554 3.568 . 0 0 "[ . 1 . ]" 1
865 2 10 ILE HA 2 13 LEU H 0.000 . 3.500 3.540 3.534 3.550 0.050 6 0 "[ . 1 . ]" 1
866 2 10 ILE O 2 14 SER H 2.200 . 2.600 2.178 2.159 2.218 . 0 0 "[ . 1 . ]" 1
867 2 11 ILE H 2 11 ILE HA 2.700 2.700 7.700 2.826 2.824 2.829 . 0 0 "[ . 1 . ]" 1
868 2 11 ILE H 2 11 ILE HB 0.000 . 2.700 2.552 2.549 2.558 . 0 0 "[ . 1 . ]" 1
869 2 11 ILE H 2 11 ILE QG 0.000 . 4.000 2.004 2.003 2.005 . 0 0 "[ . 1 . ]" 1
870 2 11 ILE H 2 12 GLU H 0.000 . 2.700 2.702 2.680 2.713 0.013 5 0 "[ . 1 . ]" 1
871 2 11 ILE HA 2 11 ILE MG 0.000 . 3.500 2.385 2.301 2.428 . 0 0 "[ . 1 . ]" 1
872 2 11 ILE HA 2 12 GLU H 3.200 3.200 8.200 3.552 3.540 3.559 . 0 0 "[ . 1 . ]" 1
873 2 11 ILE HA 2 14 SER H 0.000 . 4.000 3.599 3.575 3.623 . 0 0 "[ . 1 . ]" 1
874 2 11 ILE HG13 2 12 GLU H 0.000 . 4.500 4.221 4.217 4.228 . 0 0 "[ . 1 . ]" 1
875 2 11 ILE MG 2 15 ASN HD21 0.000 . 4.000 3.205 2.727 3.332 . 0 0 "[ . 1 . ]" 1
876 2 11 ILE MG 2 15 ASN HD22 0.000 . 3.200 2.362 2.224 2.471 . 0 0 "[ . 1 . ]" 1
877 2 11 ILE O 2 15 ASN H 2.200 . 2.600 2.262 2.244 2.281 . 0 0 "[ . 1 . ]" 1
878 2 12 GLU H 2 12 GLU HA 2.700 2.700 7.700 2.826 2.823 2.828 . 0 0 "[ . 1 . ]" 1
879 2 12 GLU H 2 12 GLU HB2 0.000 . 3.200 2.219 2.173 2.354 . 0 0 "[ . 1 . ]" 1
880 2 12 GLU H 2 13 LEU H 0.000 . 2.700 2.718 2.709 2.722 0.022 16 0 "[ . 1 . ]" 1
881 2 12 GLU H 2 14 SER H 3.200 3.200 5.000 4.155 4.115 4.173 . 0 0 "[ . 1 . ]" 1
882 2 12 GLU HA 2 13 LEU H 3.200 3.200 8.200 3.561 3.557 3.563 . 0 0 "[ . 1 . ]" 1
883 2 12 GLU HA 2 15 ASN H 0.000 . 3.500 3.510 3.503 3.519 0.019 12 0 "[ . 1 . ]" 1
884 2 12 GLU HA 2 15 ASN HD21 0.000 . 4.000 2.236 2.025 2.457 . 0 0 "[ . 1 . ]" 1
885 2 12 GLU HB2 2 31 HIS HD2 0.000 . 4.000 3.624 3.198 3.839 . 0 0 "[ . 1 . ]" 1
886 2 12 GLU HB3 2 31 HIS HD2 0.000 . 4.000 3.509 3.392 3.645 . 0 0 "[ . 1 . ]" 1
887 2 12 GLU O 2 16 THR H 2.200 . 2.600 2.194 2.169 2.206 . 0 0 "[ . 1 . ]" 1
888 2 13 LEU H 2 13 LEU HA 2.700 2.700 7.700 2.814 2.811 2.817 . 0 0 "[ . 1 . ]" 1
889 2 13 LEU H 2 13 LEU MD1 0.000 . 4.000 3.079 3.023 3.129 . 0 0 "[ . 1 . ]" 1
890 2 13 LEU H 2 14 SER H 0.000 . 2.700 2.709 2.691 2.718 0.018 1 0 "[ . 1 . ]" 1
891 2 13 LEU H 2 15 ASN H 3.200 3.200 5.000 4.326 4.309 4.352 . 0 0 "[ . 1 . ]" 1
892 2 13 LEU H 2 30 PRO HG3 0.000 . 4.500 4.522 4.512 4.533 0.033 19 0 "[ . 1 . ]" 1
893 2 13 LEU HA 2 14 SER H 3.200 3.200 8.200 3.545 3.542 3.547 . 0 0 "[ . 1 . ]" 1
894 2 13 LEU HA 2 16 THR H 0.000 . 3.500 3.412 3.382 3.441 . 0 0 "[ . 1 . ]" 1
895 2 13 LEU HA 2 16 THR HB 0.000 . 3.200 2.955 2.924 2.999 . 0 0 "[ . 1 . ]" 1
896 2 13 LEU HA 2 45 ILE MD 0.000 . 4.800 3.523 3.423 3.593 . 0 0 "[ . 1 . ]" 1
897 2 13 LEU MD1 2 31 HIS HD2 0.000 . 4.800 3.965 3.905 3.999 . 0 0 "[ . 1 . ]" 1
898 2 13 LEU MD2 2 17 PHE HE2 0.000 . 4.800 3.980 3.901 3.999 . 0 0 "[ . 1 . ]" 1
899 2 13 LEU MD2 2 31 HIS HD2 0.000 . 4.000 3.337 3.332 3.344 . 0 0 "[ . 1 . ]" 1
900 2 13 LEU MD2 2 42 ALA H 0.000 . 4.800 4.006 4.000 4.010 . 0 0 "[ . 1 . ]" 1
901 2 13 LEU MD2 2 42 ALA MB 0.000 . 4.800 3.012 2.871 3.166 . 0 0 "[ . 1 . ]" 1
902 2 13 LEU HG 2 31 HIS HD2 3.200 3.200 4.500 3.271 3.191 3.385 0.009 12 0 "[ . 1 . ]" 1
903 2 13 LEU O 2 17 PHE H 2.200 . 2.600 2.125 2.103 2.139 . 0 0 "[ . 1 . ]" 1
904 2 14 SER H 2 14 SER HA 2.700 2.700 7.700 2.812 2.809 2.815 . 0 0 "[ . 1 . ]" 1
905 2 14 SER H 2 15 ASN H 0.000 . 2.700 2.749 2.747 2.754 0.054 6 0 "[ . 1 . ]" 1
906 2 14 SER HA 2 15 ASN H 3.200 3.200 8.200 3.552 3.548 3.556 . 0 0 "[ . 1 . ]" 1
907 2 14 SER HA 2 17 PHE H 0.000 . 3.500 3.521 3.515 3.528 0.028 3 0 "[ . 1 . ]" 1
908 2 14 SER HA 2 17 PHE HD2 2.700 2.700 3.200 2.668 2.665 2.671 0.035 11 0 "[ . 1 . ]" 1
909 2 14 SER O 2 18 ASP H 2.200 . 2.600 2.233 2.215 2.254 . 0 0 "[ . 1 . ]" 1
910 2 15 ASN H 2 15 ASN HA 2.700 2.700 7.700 2.821 2.819 2.825 . 0 0 "[ . 1 . ]" 1
911 2 15 ASN H 2 16 THR H 0.000 . 2.700 2.722 2.716 2.724 0.024 8 0 "[ . 1 . ]" 1
912 2 15 ASN H 2 17 PHE H 3.200 3.200 5.000 4.300 4.280 4.313 . 0 0 "[ . 1 . ]" 1
913 2 15 ASN HA 2 16 THR H 3.200 3.200 8.200 3.540 3.535 3.543 . 0 0 "[ . 1 . ]" 1
914 2 15 ASN HA 2 18 ASP H 0.000 . 3.500 3.518 3.512 3.524 0.024 12 0 "[ . 1 . ]" 1
915 2 15 ASN HB2 2 16 THR H 0.000 . 3.200 2.643 2.614 2.678 . 0 0 "[ . 1 . ]" 1
916 2 15 ASN HB3 2 16 THR H 0.000 . 4.000 3.661 3.584 3.718 . 0 0 "[ . 1 . ]" 1
917 2 15 ASN O 2 19 LYS H 2.200 . 2.600 2.232 2.219 2.241 . 0 0 "[ . 1 . ]" 1
918 2 16 THR H 2 16 THR HA 2.700 2.700 7.700 2.819 2.818 2.821 . 0 0 "[ . 1 . ]" 1
919 2 16 THR H 2 16 THR HB 0.000 . 2.700 2.686 2.677 2.694 . 0 0 "[ . 1 . ]" 1
920 2 16 THR H 2 17 PHE H 0.000 . 2.700 2.738 2.735 2.740 0.040 16 0 "[ . 1 . ]" 1
921 2 16 THR HA 2 17 PHE H 3.200 3.200 8.200 3.562 3.558 3.564 . 0 0 "[ . 1 . ]" 1
922 2 16 THR HA 2 19 LYS H 0.000 . 3.500 3.515 3.506 3.529 0.029 15 0 "[ . 1 . ]" 1
923 2 16 THR HB 2 17 PHE H 0.000 . 2.700 2.526 2.506 2.549 . 0 0 "[ . 1 . ]" 1
924 2 16 THR MG 2 17 PHE H 0.000 . 4.800 3.638 3.629 3.653 . 0 0 "[ . 1 . ]" 1
925 2 16 THR MG 2 20 ILE H 0.000 . 4.800 4.005 3.999 4.011 . 0 0 "[ . 1 . ]" 1
926 2 16 THR MG 2 20 ILE MD 0.000 . 4.800 2.171 2.054 2.427 . 0 0 "[ . 1 . ]" 1
927 2 16 THR O 2 20 ILE H 2.200 . 2.600 2.122 2.111 2.131 . 0 0 "[ . 1 . ]" 1
928 2 17 PHE H 2 17 PHE HA 2.700 2.700 7.700 2.822 2.819 2.825 . 0 0 "[ . 1 . ]" 1
929 2 17 PHE H 2 17 PHE HD2 3.200 3.200 4.000 3.195 3.184 3.209 0.016 17 0 "[ . 1 . ]" 1
930 2 17 PHE H 2 18 ASP H 0.000 . 2.700 2.731 2.725 2.736 0.036 15 0 "[ . 1 . ]" 1
931 2 17 PHE H 2 19 LYS H 3.200 3.200 5.000 4.338 4.316 4.362 . 0 0 "[ . 1 . ]" 1
932 2 17 PHE HA 2 18 ASP H 3.200 3.200 8.200 3.546 3.543 3.552 . 0 0 "[ . 1 . ]" 1
933 2 17 PHE HA 2 20 ILE H 0.000 . 3.500 3.504 3.498 3.517 0.017 15 0 "[ . 1 . ]" 1
934 2 17 PHE HA 2 20 ILE HB 0.000 . 2.700 2.748 2.733 2.755 0.055 11 0 "[ . 1 . ]" 1
935 2 17 PHE HB2 2 18 ASP H 2.700 2.700 4.000 2.857 2.844 2.864 . 0 0 "[ . 1 . ]" 1
936 2 17 PHE HB3 2 18 ASP H 2.700 2.700 4.000 3.320 3.305 3.327 . 0 0 "[ . 1 . ]" 1
937 2 17 PHE HD1 2 20 ILE MG 0.000 . 4.800 4.026 4.022 4.030 . 0 0 "[ . 1 . ]" 1
938 2 17 PHE HD2 2 45 ILE MD 3.500 3.500 4.800 4.008 4.004 4.013 . 0 0 "[ . 1 . ]" 1
939 2 17 PHE HE1 2 45 ILE HG12 3.500 3.500 4.800 4.174 4.093 4.237 . 0 0 "[ . 1 . ]" 1
940 2 17 PHE HE2 2 45 ILE MD 3.200 3.200 4.000 3.250 3.215 3.333 . 0 0 "[ . 1 . ]" 1
941 2 17 PHE HZ 2 45 ILE HG12 3.500 3.500 4.500 3.523 3.485 3.629 0.015 19 0 "[ . 1 . ]" 1
942 2 17 PHE O 2 21 ALA H 2.200 . 2.600 2.016 1.989 2.047 . 0 0 "[ . 1 . ]" 1
943 2 18 ASP H 2 18 ASP HA 2.700 2.700 7.700 2.818 2.812 2.823 . 0 0 "[ . 1 . ]" 1
944 2 18 ASP H 2 19 LYS H 0.000 . 2.700 2.753 2.747 2.764 0.064 6 0 "[ . 1 . ]" 1
945 2 18 ASP HA 2 19 LYS H 3.200 3.200 8.200 3.556 3.552 3.561 . 0 0 "[ . 1 . ]" 1
946 2 18 ASP HA 2 21 ALA H 0.000 . 3.500 3.524 3.516 3.531 0.031 17 0 "[ . 1 . ]" 1
947 2 18 ASP HA 2 21 ALA MB 0.000 . 4.000 2.714 2.561 2.890 . 0 0 "[ . 1 . ]" 1
948 2 18 ASP O 2 22 GLU H 2.200 . 2.600 2.178 2.164 2.212 . 0 0 "[ . 1 . ]" 1
949 2 19 LYS H 2 19 LYS HA 2.700 2.700 7.700 2.826 2.823 2.828 . 0 0 "[ . 1 . ]" 1
950 2 19 LYS H 2 20 ILE H 0.000 . 2.700 2.719 2.709 2.724 0.024 9 0 "[ . 1 . ]" 1
951 2 19 LYS H 2 21 ALA H 3.200 3.200 5.000 4.257 4.215 4.309 . 0 0 "[ . 1 . ]" 1
952 2 19 LYS HA 2 20 ILE H 3.200 3.200 8.200 3.542 3.540 3.544 . 0 0 "[ . 1 . ]" 1
953 2 19 LYS HA 2 22 GLU H 0.000 . 3.500 3.539 3.518 3.546 0.046 19 0 "[ . 1 . ]" 1
954 2 19 LYS HA 2 24 ASN H 0.000 . 4.500 4.239 4.158 4.291 . 0 0 "[ . 1 . ]" 1
955 2 19 LYS QB 2 27 ALA H 0.000 . 4.800 4.062 3.947 4.291 . 0 0 "[ . 1 . ]" 1
956 2 19 LYS QB 2 27 ALA MB 0.000 . 4.800 2.291 2.211 2.461 . 0 0 "[ . 1 . ]" 1
957 2 19 LYS HB3 2 24 ASN H 0.000 . 4.500 4.472 4.438 4.505 0.005 17 0 "[ . 1 . ]" 1
958 2 19 LYS QD 2 24 ASN HD21 0.000 . 4.000 2.303 2.096 3.146 . 0 0 "[ . 1 . ]" 1
959 2 19 LYS QD 2 27 ALA H 0.000 . 4.800 4.279 4.277 4.287 . 0 0 "[ . 1 . ]" 1
960 2 19 LYS QD 2 27 ALA MB 0.000 . 4.000 2.294 1.944 2.415 . 0 0 "[ . 1 . ]" 1
961 2 19 LYS O 2 24 ASN H 2.200 . 2.600 2.122 2.085 2.142 . 0 0 "[ . 1 . ]" 1
962 2 20 ILE H 2 20 ILE HA 2.700 2.700 7.700 2.828 2.826 2.831 . 0 0 "[ . 1 . ]" 1
963 2 20 ILE H 2 20 ILE HB 0.000 . 3.200 2.492 2.467 2.498 . 0 0 "[ . 1 . ]" 1
964 2 20 ILE H 2 21 ALA H 0.000 . 2.700 2.723 2.717 2.729 0.029 11 0 "[ . 1 . ]" 1
965 2 20 ILE H 2 24 ASN HB3 0.000 . 5.000 4.993 4.931 5.006 0.006 6 0 "[ . 1 . ]" 1
966 2 20 ILE HA 2 21 ALA H 3.200 3.200 8.200 3.566 3.562 3.575 . 0 0 "[ . 1 . ]" 1
967 2 20 ILE MD 2 45 ILE HA 0.000 . 4.800 3.864 3.791 3.918 . 0 0 "[ . 1 . ]" 1
968 2 20 ILE MD 2 49 ARG H 0.000 . 4.800 4.008 4.006 4.011 . 0 0 "[ . 1 . ]" 1
969 2 20 ILE MG 2 49 ARG HA 0.000 . 3.800 3.196 3.191 3.202 . 0 0 "[ . 1 . ]" 1
970 2 20 ILE O 2 23 GLY H 2.200 . 2.600 2.075 2.053 2.097 . 0 0 "[ . 1 . ]" 1
971 2 21 ALA H 2 21 ALA HA 2.700 2.700 7.700 2.805 2.801 2.808 . 0 0 "[ . 1 . ]" 1
972 2 21 ALA H 2 22 GLU H 2.700 2.700 3.200 2.749 2.737 2.758 . 0 0 "[ . 1 . ]" 1
973 2 21 ALA H 2 23 GLY H 3.200 3.200 5.000 4.237 4.207 4.266 . 0 0 "[ . 1 . ]" 1
974 2 21 ALA HA 2 22 GLU H 3.200 3.200 8.200 3.539 3.531 3.542 . 0 0 "[ . 1 . ]" 1
975 2 21 ALA MB 2 22 GLU H 0.000 . 4.000 2.676 2.636 2.727 . 0 0 "[ . 1 . ]" 1
976 2 22 GLU H 2 22 GLU HA 2.700 2.700 7.700 2.877 2.857 2.899 . 0 0 "[ . 1 . ]" 1
977 2 22 GLU H 2 23 GLY H 0.000 . 2.700 2.764 2.744 2.777 0.077 6 0 "[ . 1 . ]" 1
978 2 22 GLU H 2 24 ASN H 3.200 3.200 5.000 3.758 3.683 3.855 . 0 0 "[ . 1 . ]" 1
979 2 22 GLU HA 2 23 GLY H 3.200 3.200 8.200 3.335 3.256 3.408 . 0 0 "[ . 1 . ]" 1
980 2 22 GLU QB 2 24 ASN H 0.000 . 4.800 3.248 3.157 3.403 . 0 0 "[ . 1 . ]" 1
981 2 23 GLY H 2 23 GLY HA2 0.000 . 2.700 2.304 2.293 2.321 . 0 0 "[ . 1 . ]" 1
982 2 23 GLY H 2 23 GLY HA3 2.700 2.700 7.700 2.870 2.843 2.896 . 0 0 "[ . 1 . ]" 1
983 2 23 GLY H 2 24 ASN H 2.400 2.400 2.900 2.501 2.397 2.594 0.003 17 0 "[ . 1 . ]" 1
984 2 23 GLY HA2 2 24 ASN H 2.700 2.700 7.700 3.032 3.026 3.042 . 0 0 "[ . 1 . ]" 1
985 2 23 GLY HA2 2 52 LEU MD1 3.500 3.500 4.800 4.001 3.999 4.005 . 0 0 "[ . 1 . ]" 1
986 2 23 GLY HA3 2 24 ASN H 3.200 3.200 8.200 3.511 3.509 3.513 . 0 0 "[ . 1 . ]" 1
987 2 24 ASN H 2 24 ASN HA 2.700 2.700 7.700 2.936 2.934 2.939 . 0 0 "[ . 1 . ]" 1
988 2 24 ASN H 2 25 LEU H 2.700 2.700 4.500 4.106 4.043 4.170 . 0 0 "[ . 1 . ]" 1
989 2 24 ASN HA 2 25 LEU H 0.000 . 2.700 2.221 2.192 2.248 . 0 0 "[ . 1 . ]" 1
990 2 24 ASN HA 2 26 GLU H 0.000 . 4.000 3.384 3.335 3.427 . 0 0 "[ . 1 . ]" 1
991 2 24 ASN HB2 2 24 ASN HD21 0.000 . 2.700 2.528 2.519 2.537 . 0 0 "[ . 1 . ]" 1
992 2 24 ASN HB2 2 25 LEU H 3.200 3.200 5.000 4.567 4.541 4.591 . 0 0 "[ . 1 . ]" 1
993 2 24 ASN HB3 2 24 ASN HD21 0.000 . 2.700 2.733 2.729 2.737 0.037 12 0 "[ . 1 . ]" 1
994 2 24 ASN HB3 2 25 LEU H 3.200 3.200 5.000 4.419 4.387 4.437 . 0 0 "[ . 1 . ]" 1
995 2 24 ASN HB3 2 27 ALA MB 0.000 . 4.000 3.344 3.340 3.353 . 0 0 "[ . 1 . ]" 1
996 2 24 ASN HD22 2 27 ALA MB 0.000 . 4.000 3.334 3.332 3.336 . 0 0 "[ . 1 . ]" 1
997 2 25 LEU H 2 25 LEU HA 2.700 2.700 7.700 2.917 2.911 2.927 . 0 0 "[ . 1 . ]" 1
998 2 25 LEU H 2 25 LEU HB2 0.000 . 3.200 2.455 2.387 2.475 . 0 0 "[ . 1 . ]" 1
999 2 25 LEU H 2 25 LEU MD2 0.000 . 4.800 3.846 3.609 3.954 . 0 0 "[ . 1 . ]" 1
1000 2 25 LEU H 2 25 LEU HG 0.000 . 2.700 2.445 2.339 2.596 . 0 0 "[ . 1 . ]" 1
1001 2 25 LEU H 2 26 GLU H 0.000 . 2.700 2.670 2.592 2.708 0.008 19 0 "[ . 1 . ]" 1
1002 2 25 LEU HA 2 26 GLU H 2.700 2.700 7.700 3.286 3.245 3.311 . 0 0 "[ . 1 . ]" 1
1003 2 25 LEU HA 2 27 ALA H 0.000 . 4.000 3.895 3.829 3.928 . 0 0 "[ . 1 . ]" 1
1004 2 25 LEU MD1 2 53 LYS H 0.000 . 4.800 3.108 2.635 3.288 . 0 0 "[ . 1 . ]" 1
1005 2 25 LEU MD1 2 53 LYS HA 0.000 . 3.500 1.898 1.852 1.940 . 0 0 "[ . 1 . ]" 1
1006 2 25 LEU MD1 2 56 ALA MB 0.000 . 4.300 2.973 2.899 2.990 . 0 0 "[ . 1 . ]" 1
1007 2 25 LEU MD2 2 49 ARG HA 0.000 . 3.500 2.916 2.900 2.919 . 0 0 "[ . 1 . ]" 1
1008 2 25 LEU MD2 2 52 LEU H 0.000 . 4.800 3.595 3.489 3.872 . 0 0 "[ . 1 . ]" 1
1009 2 26 GLU H 2 26 GLU HA 2.700 2.700 7.700 2.915 2.908 2.919 . 0 0 "[ . 1 . ]" 1
1010 2 26 GLU H 2 26 GLU HB2 0.000 . 3.200 2.448 2.405 2.470 . 0 0 "[ . 1 . ]" 1
1011 2 26 GLU H 2 26 GLU HB3 0.000 . 4.000 3.625 3.615 3.634 . 0 0 "[ . 1 . ]" 1
1012 2 26 GLU H 2 26 GLU QG 0.000 . 4.000 2.465 2.354 3.274 . 0 0 "[ . 1 . ]" 1
1013 2 26 GLU H 2 27 ALA H 0.000 . 2.700 2.313 2.301 2.335 . 0 0 "[ . 1 . ]" 1
1014 2 26 GLU H 2 27 ALA MB 0.000 . 4.800 3.941 3.927 3.950 . 0 0 "[ . 1 . ]" 1
1015 2 26 GLU HA 2 27 ALA H 3.200 3.200 8.200 3.499 3.487 3.515 . 0 0 "[ . 1 . ]" 1
1016 2 27 ALA H 2 27 ALA HA 2.700 2.700 7.700 2.827 2.815 2.847 . 0 0 "[ . 1 . ]" 1
1017 2 27 ALA H 2 28 GLU H 3.200 3.200 8.200 4.629 4.610 4.637 . 0 0 "[ . 1 . ]" 1
1018 2 27 ALA HA 2 28 GLU H 0.000 . 2.700 2.304 2.225 2.341 . 0 0 "[ . 1 . ]" 1
1019 2 28 GLU H 2 28 GLU HA 2.700 2.700 7.700 2.937 2.932 2.938 . 0 0 "[ . 1 . ]" 1
1020 2 28 GLU H 2 28 GLU QG 2.700 2.700 4.000 2.733 2.420 3.381 0.280 1 0 "[ . 1 . ]" 1
1021 2 28 GLU H 2 29 VAL H 4.000 4.000 9.000 4.569 4.557 4.584 . 0 0 "[ . 1 . ]" 1
1022 2 28 GLU HA 2 29 VAL H 0.000 . 2.700 2.260 2.225 2.294 . 0 0 "[ . 1 . ]" 1
1023 2 28 GLU HA 2 29 VAL MG2 0.000 . 4.800 3.461 3.367 3.522 . 0 0 "[ . 1 . ]" 1
1024 2 29 VAL H 2 29 VAL HA 2.700 2.700 7.700 2.939 2.925 2.951 . 0 0 "[ . 1 . ]" 1
1025 2 29 VAL H 2 29 VAL HB 0.000 . 3.200 2.437 2.396 2.491 . 0 0 "[ . 1 . ]" 1
1026 2 29 VAL H 2 29 VAL MG2 0.000 . 3.500 2.465 2.312 2.549 . 0 0 "[ . 1 . ]" 1
1027 2 29 VAL H 2 30 PRO HD2 3.200 3.200 8.200 5.302 5.246 5.319 . 0 0 "[ . 1 . ]" 1
1028 2 29 VAL H 2 30 PRO HD3 3.200 3.200 8.200 4.816 4.790 4.871 . 0 0 "[ . 1 . ]" 1
1029 2 29 VAL H 2 32 GLN HE21 0.000 . 4.000 2.475 2.211 2.592 . 0 0 "[ . 1 . ]" 1
1030 2 29 VAL H 2 32 GLN HE22 0.000 . 5.000 2.682 2.517 2.778 . 0 0 "[ . 1 . ]" 1
1031 2 29 VAL HA 2 30 PRO QD 0.000 . 3.500 2.041 2.029 2.081 . 0 0 "[ . 1 . ]" 1
1032 2 29 VAL MG1 2 30 PRO HD2 0.000 . 4.000 2.064 1.935 2.122 . 0 0 "[ . 1 . ]" 1
1033 2 29 VAL MG1 2 32 GLN H 0.000 . 4.800 4.028 4.025 4.031 . 0 0 "[ . 1 . ]" 1
1034 2 29 VAL MG1 2 32 GLN HA 0.000 . 4.800 3.935 3.888 3.959 . 0 0 "[ . 1 . ]" 1
1035 2 29 VAL MG1 2 32 GLN HE21 2.700 2.700 4.000 3.275 3.216 3.350 . 0 0 "[ . 1 . ]" 1
1036 2 29 VAL MG1 2 46 GLU H 0.000 . 4.800 3.128 3.014 3.174 . 0 0 "[ . 1 . ]" 1
1037 2 29 VAL MG1 2 46 GLU HB2 0.000 . 4.000 3.304 2.715 3.361 . 0 0 "[ . 1 . ]" 1
1038 2 29 VAL MG2 2 46 GLU H 0.000 . 4.800 3.606 3.299 3.685 . 0 0 "[ . 1 . ]" 1
1039 2 29 VAL MG2 2 46 GLU HA 0.000 . 4.000 2.347 2.066 2.401 . 0 0 "[ . 1 . ]" 1
1040 2 29 VAL MG2 2 46 GLU HB2 0.000 . 4.800 3.716 2.400 3.900 . 0 0 "[ . 1 . ]" 1
1041 2 29 VAL MG2 2 49 ARG HD2 0.000 . 4.800 4.015 3.927 4.023 . 0 0 "[ . 1 . ]" 1
1042 2 29 VAL MG2 2 49 ARG HD3 0.000 . 4.800 2.769 2.734 2.786 . 0 0 "[ . 1 . ]" 1
1043 2 30 PRO HA 2 31 HIS H 0.000 . 2.700 2.356 2.333 2.377 . 0 0 "[ . 1 . ]" 1
1044 2 30 PRO HA 2 32 GLN H 0.000 . 4.000 3.426 3.391 3.466 . 0 0 "[ . 1 . ]" 1
1045 2 30 PRO HB2 2 31 HIS H 0.000 . 3.200 2.763 2.725 2.814 . 0 0 "[ . 1 . ]" 1
1046 2 30 PRO HB3 2 31 HIS H 0.000 . 4.000 3.773 3.742 3.793 . 0 0 "[ . 1 . ]" 1
1047 2 30 PRO HB3 2 31 HIS HD2 3.500 3.500 4.500 4.440 4.382 4.513 0.013 14 0 "[ . 1 . ]" 1
1048 2 30 PRO HD2 2 31 HIS HD2 0.000 . 4.000 4.048 4.045 4.052 0.052 16 0 "[ . 1 . ]" 1
1049 2 31 HIS H 2 31 HIS HA 0.000 . 2.700 2.292 2.291 2.293 . 0 0 "[ . 1 . ]" 1
1050 2 31 HIS H 2 32 GLN H 0.000 . 3.200 2.795 2.775 2.804 . 0 0 "[ . 1 . ]" 1
1051 2 31 HIS HA 2 32 GLN H 2.700 2.700 7.700 3.125 3.113 3.134 . 0 0 "[ . 1 . ]" 1
1052 2 31 HIS HB2 2 38 ILE MG 0.000 . 4.800 3.445 3.357 3.495 . 0 0 "[ . 1 . ]" 1
1053 2 31 HIS HB2 2 42 ALA MB 2.700 2.700 4.300 2.627 2.511 2.875 0.189 7 0 "[ . 1 . ]" 1
1054 2 31 HIS HB3 2 34 ARG H 0.000 . 4.500 3.999 3.964 4.052 . 0 0 "[ . 1 . ]" 1
1055 2 31 HIS HB3 2 38 ILE MG 0.000 . 4.800 3.305 3.050 3.448 . 0 0 "[ . 1 . ]" 1
1056 2 31 HIS HB3 2 42 ALA MB 4.000 4.000 9.000 3.771 3.653 4.048 0.347 5 0 "[ . 1 . ]" 1
1057 2 31 HIS HD2 2 38 ILE MG 0.000 . 4.800 4.012 4.006 4.020 . 0 0 "[ . 1 . ]" 1
1058 2 31 HIS HD2 2 42 ALA MB 4.000 4.000 9.000 3.901 3.793 4.064 0.207 8 0 "[ . 1 . ]" 1
1059 2 31 HIS O 2 34 ARG H 2.200 . 2.600 2.065 2.049 2.080 . 0 0 "[ . 1 . ]" 1
1060 2 32 GLN H 2 32 GLN HA 2.700 2.700 7.700 2.801 2.797 2.803 . 0 0 "[ . 1 . ]" 1
1061 2 32 GLN H 2 32 GLN QG 0.000 . 3.500 2.510 2.437 2.596 . 0 0 "[ . 1 . ]" 1
1062 2 32 GLN H 2 33 ASN H 0.000 . 2.700 2.737 2.733 2.745 0.045 15 0 "[ . 1 . ]" 1
1063 2 32 GLN HA 2 34 ARG H 0.000 . 4.000 3.849 3.790 3.885 . 0 0 "[ . 1 . ]" 1
1064 2 32 GLN QG 2 43 LYS H 0.000 . 5.300 4.730 4.722 4.735 . 0 0 "[ . 1 . ]" 1
1065 2 33 ASN H 2 34 ARG H 2.700 2.700 3.500 2.696 2.687 2.714 0.013 8 0 "[ . 1 . ]" 1
1066 2 33 ASN HA 2 34 ARG H 3.200 3.200 8.200 3.286 3.264 3.346 . 0 0 "[ . 1 . ]" 1
1067 2 33 ASN QB 2 34 ARG H 0.000 . 4.800 3.556 3.463 3.589 . 0 0 "[ . 1 . ]" 1
1068 2 34 ARG H 2 34 ARG HA 2.700 2.700 7.700 2.852 2.833 2.860 . 0 0 "[ . 1 . ]" 1
1069 2 34 ARG H 2 34 ARG QG 0.000 . 3.500 2.679 2.559 2.745 . 0 0 "[ . 1 . ]" 1
1070 2 34 ARG H 2 39 GLY HA2 2.700 2.700 4.000 3.429 3.367 3.509 . 0 0 "[ . 1 . ]" 1
1071 2 34 ARG H 2 39 GLY HA3 2.700 2.700 4.000 3.645 3.567 3.786 . 0 0 "[ . 1 . ]" 1
1072 2 34 ARG HA 2 36 ASP H 4.000 4.000 9.000 4.131 4.097 4.153 . 0 0 "[ . 1 . ]" 1
1073 2 34 ARG HB2 2 39 GLY HA2 0.000 . 2.700 2.019 2.017 2.021 . 0 0 "[ . 1 . ]" 1
1074 2 34 ARG HB2 2 39 GLY HA3 0.000 . 3.200 2.330 2.303 2.358 . 0 0 "[ . 1 . ]" 1
1075 2 34 ARG HB3 2 36 ASP H 0.000 . 3.200 2.946 2.923 2.962 . 0 0 "[ . 1 . ]" 1
1076 2 34 ARG HB3 2 39 GLY HA2 0.000 . 3.200 3.158 3.117 3.204 0.004 18 0 "[ . 1 . ]" 1
1077 2 34 ARG HD2 2 38 ILE MG 0.000 . 4.800 3.167 2.956 3.343 . 0 0 "[ . 1 . ]" 1
1078 2 34 ARG HD3 2 38 ILE MG 0.000 . 3.500 2.503 2.320 2.633 . 0 0 "[ . 1 . ]" 1
1079 2 34 ARG HE 2 39 GLY H 2.700 2.700 4.000 3.526 3.509 3.558 . 0 0 "[ . 1 . ]" 1
1080 2 35 ALA HA 2 36 ASP H 2.700 2.700 7.700 3.511 3.508 3.512 . 0 0 "[ . 1 . ]" 1
1081 2 35 ALA MB 2 36 ASP H 0.000 . 4.800 2.869 2.843 2.922 . 0 0 "[ . 1 . ]" 1
1082 2 36 ASP H 2 36 ASP HA 2.700 2.700 7.700 2.891 2.887 2.895 . 0 0 "[ . 1 . ]" 1
1083 2 36 ASP H 2 37 GLU H 3.200 3.200 8.200 4.521 4.516 4.526 . 0 0 "[ . 1 . ]" 1
1084 2 36 ASP H 2 39 GLY H 2.700 2.700 3.500 3.523 3.518 3.527 0.027 11 0 "[ . 1 . ]" 1
1085 2 36 ASP HA 2 37 GLU H 2.700 2.700 7.700 2.680 2.676 2.681 0.024 1 0 "[ . 1 . ]" 1
1086 2 36 ASP HA 2 38 ILE H 0.000 . 4.500 4.446 4.435 4.455 . 0 0 "[ . 1 . ]" 1
1087 2 36 ASP HB2 2 38 ILE H 0.000 . 4.000 3.330 3.308 3.341 . 0 0 "[ . 1 . ]" 1
1088 2 36 ASP HB3 2 38 ILE H 0.000 . 4.500 4.519 4.512 4.526 0.026 1 0 "[ . 1 . ]" 1
1089 2 36 ASP O 2 39 GLY H 2.200 . 2.600 2.073 2.058 2.084 . 0 0 "[ . 1 . ]" 1
1090 2 36 ASP O 2 40 ILE H 2.200 . 2.600 2.319 2.310 2.342 . 0 0 "[ . 1 . ]" 1
1091 2 37 GLU H 2 37 GLU HA 2.700 2.700 7.700 2.771 2.767 2.776 . 0 0 "[ . 1 . ]" 1
1092 2 37 GLU H 2 37 GLU HG2 3.200 3.200 8.200 3.922 3.920 3.928 . 0 0 "[ . 1 . ]" 1
1093 2 37 GLU H 2 37 GLU HG3 3.200 3.200 8.200 3.209 3.197 3.242 0.003 9 0 "[ . 1 . ]" 1
1094 2 37 GLU H 2 38 ILE H 0.000 . 3.200 2.843 2.827 2.854 . 0 0 "[ . 1 . ]" 1
1095 2 37 GLU HA 2 38 ILE H 3.200 3.200 8.200 3.508 3.506 3.513 . 0 0 "[ . 1 . ]" 1
1096 2 37 GLU HA 2 40 ILE H 0.000 . 3.500 3.370 3.337 3.423 . 0 0 "[ . 1 . ]" 1
1097 2 37 GLU HA 2 40 ILE HB 0.000 . 3.500 2.854 2.822 2.939 . 0 0 "[ . 1 . ]" 1
1098 2 37 GLU HA 2 41 LEU H 0.000 . 4.500 4.177 4.145 4.219 . 0 0 "[ . 1 . ]" 1
1099 2 37 GLU HG2 2 38 ILE H 3.500 3.500 8.500 5.415 5.406 5.433 . 0 0 "[ . 1 . ]" 1
1100 2 37 GLU HG3 2 38 ILE H 3.500 3.500 8.500 4.970 4.960 4.978 . 0 0 "[ . 1 . ]" 1
1101 2 37 GLU O 2 41 LEU H 2.200 . 2.600 2.139 2.122 2.162 . 0 0 "[ . 1 . ]" 1
1102 2 38 ILE H 2 38 ILE HA 2.700 2.700 7.700 2.864 2.861 2.868 . 0 0 "[ . 1 . ]" 1
1103 2 38 ILE H 2 38 ILE QG 0.000 . 4.000 2.003 2.001 2.006 . 0 0 "[ . 1 . ]" 1
1104 2 38 ILE H 2 39 GLY H 0.000 . 3.200 2.589 2.583 2.595 . 0 0 "[ . 1 . ]" 1
1105 2 38 ILE HA 2 39 GLY H 3.200 3.200 8.200 3.558 3.557 3.560 . 0 0 "[ . 1 . ]" 1
1106 2 38 ILE HA 2 41 LEU H 0.000 . 3.500 3.517 3.505 3.525 0.025 1 0 "[ . 1 . ]" 1
1107 2 38 ILE HA 2 41 LEU HB3 0.000 . 3.200 3.043 2.994 3.132 . 0 0 "[ . 1 . ]" 1
1108 2 38 ILE HA 2 41 LEU MD2 0.000 . 4.300 3.612 3.607 3.616 . 0 0 "[ . 1 . ]" 1
1109 2 38 ILE HA 2 42 ALA H 0.000 . 4.500 4.198 4.148 4.239 . 0 0 "[ . 1 . ]" 1
1110 2 38 ILE MG 2 39 GLY H 0.000 . 4.800 3.623 3.612 3.651 . 0 0 "[ . 1 . ]" 1
1111 2 38 ILE MG 2 42 ALA H 0.000 . 4.800 3.999 3.996 4.022 . 0 0 "[ . 1 . ]" 1
1112 2 38 ILE O 2 42 ALA H 2.200 . 2.600 2.086 2.046 2.113 . 0 0 "[ . 1 . ]" 1
1113 2 39 GLY H 2 39 GLY HA2 2.700 2.700 7.700 2.826 2.824 2.828 . 0 0 "[ . 1 . ]" 1
1114 2 39 GLY H 2 39 GLY HA3 0.000 . 2.700 2.304 2.303 2.305 . 0 0 "[ . 1 . ]" 1
1115 2 39 GLY H 2 40 ILE H 2.700 2.700 3.500 2.689 2.685 2.693 0.015 1 0 "[ . 1 . ]" 1
1116 2 39 GLY HA2 2 40 ILE H 3.200 3.200 8.200 3.545 3.543 3.551 . 0 0 "[ . 1 . ]" 1
1117 2 39 GLY HA2 2 42 ALA H 0.000 . 4.000 3.561 3.529 3.580 . 0 0 "[ . 1 . ]" 1
1118 2 39 GLY HA2 2 42 ALA MB 0.000 . 3.500 2.740 2.636 2.851 . 0 0 "[ . 1 . ]" 1
1119 2 39 GLY HA2 2 43 LYS H 0.000 . 4.500 4.233 4.191 4.264 . 0 0 "[ . 1 . ]" 1
1120 2 39 GLY HA3 2 40 ILE H 2.700 2.700 7.700 2.813 2.796 2.823 . 0 0 "[ . 1 . ]" 1
1121 2 39 GLY O 2 43 LYS H 2.200 . 2.600 2.110 2.095 2.126 . 0 0 "[ . 1 . ]" 1
1122 2 40 ILE H 2 40 ILE HA 2.700 2.700 7.700 2.837 2.835 2.840 . 0 0 "[ . 1 . ]" 1
1123 2 40 ILE H 2 40 ILE QG 0.000 . 3.500 1.995 1.993 2.002 . 0 0 "[ . 1 . ]" 1
1124 2 40 ILE H 2 41 LEU H 0.000 . 2.700 2.704 2.701 2.707 0.007 6 0 "[ . 1 . ]" 1
1125 2 40 ILE H 2 42 ALA H 3.200 3.200 5.000 4.215 4.167 4.246 . 0 0 "[ . 1 . ]" 1
1126 2 40 ILE HA 2 41 LEU H 3.200 3.200 8.200 3.558 3.553 3.561 . 0 0 "[ . 1 . ]" 1
1127 2 40 ILE HA 2 43 LYS H 0.000 . 4.000 3.518 3.489 3.558 . 0 0 "[ . 1 . ]" 1
1128 2 40 ILE MG 2 41 LEU H 0.000 . 4.800 3.537 3.505 3.575 . 0 0 "[ . 1 . ]" 1
1129 2 40 ILE MG 2 44 SER H 0.000 . 5.800 4.234 4.175 4.324 . 0 0 "[ . 1 . ]" 1
1130 2 40 ILE O 2 44 SER H 2.200 . 2.600 2.187 2.171 2.215 . 0 0 "[ . 1 . ]" 1
1131 2 41 LEU H 2 41 LEU HA 2.700 2.700 7.700 2.820 2.817 2.824 . 0 0 "[ . 1 . ]" 1
1132 2 41 LEU H 2 42 ALA H 0.000 . 2.700 2.732 2.725 2.741 0.041 10 0 "[ . 1 . ]" 1
1133 2 41 LEU H 2 43 LYS H 3.200 3.200 5.000 4.191 4.166 4.220 . 0 0 "[ . 1 . ]" 1
1134 2 41 LEU HA 2 42 ALA H 3.200 3.200 8.200 3.553 3.548 3.560 . 0 0 "[ . 1 . ]" 1
1135 2 41 LEU HA 2 44 SER H 0.000 . 3.500 3.438 3.403 3.470 . 0 0 "[ . 1 . ]" 1
1136 2 41 LEU HA 2 45 ILE H 0.000 . 4.500 4.510 4.504 4.518 0.018 19 0 "[ . 1 . ]" 1
1137 2 41 LEU MD1 2 44 SER H 0.000 . 5.800 4.665 4.562 4.824 . 0 0 "[ . 1 . ]" 1
1138 2 41 LEU MD2 2 42 ALA H 0.000 . 5.800 4.266 4.165 4.325 . 0 0 "[ . 1 . ]" 1
1139 2 41 LEU O 2 45 ILE H 2.200 . 2.600 2.264 2.256 2.273 . 0 0 "[ . 1 . ]" 1
1140 2 42 ALA H 2 42 ALA HA 2.700 2.700 7.700 2.814 2.812 2.816 . 0 0 "[ . 1 . ]" 1
1141 2 42 ALA H 2 43 LYS H 0.000 . 2.700 2.725 2.721 2.735 0.035 10 0 "[ . 1 . ]" 1
1142 2 42 ALA H 2 44 SER H 3.200 3.200 5.000 4.153 4.135 4.185 . 0 0 "[ . 1 . ]" 1
1143 2 42 ALA HA 2 43 LYS H 3.200 3.200 8.200 3.548 3.546 3.551 . 0 0 "[ . 1 . ]" 1
1144 2 42 ALA HA 2 45 ILE H 0.000 . 3.500 3.441 3.412 3.463 . 0 0 "[ . 1 . ]" 1
1145 2 42 ALA HA 2 45 ILE MD 0.000 . 4.800 2.503 2.442 2.553 . 0 0 "[ . 1 . ]" 1
1146 2 42 ALA O 2 46 GLU H 2.200 . 2.600 2.122 2.108 2.139 . 0 0 "[ . 1 . ]" 1
1147 2 43 LYS H 2 43 LYS HA 2.700 2.700 7.700 2.809 2.807 2.810 . 0 0 "[ . 1 . ]" 1
1148 2 43 LYS H 2 44 SER H 0.000 . 2.700 2.721 2.717 2.724 0.024 15 0 "[ . 1 . ]" 1
1149 2 43 LYS HA 2 44 SER H 3.200 3.200 8.200 3.540 3.537 3.544 . 0 0 "[ . 1 . ]" 1
1150 2 43 LYS HA 2 46 GLU H 0.000 . 3.500 3.365 3.343 3.395 . 0 0 "[ . 1 . ]" 1
1151 2 43 LYS O 2 47 ARG H 2.200 . 2.600 2.100 2.076 2.113 . 0 0 "[ . 1 . ]" 1
1152 2 44 SER H 2 44 SER HA 2.700 2.700 7.700 2.813 2.812 2.816 . 0 0 "[ . 1 . ]" 1
1153 2 44 SER H 2 45 ILE H 0.000 . 2.700 2.740 2.737 2.744 0.044 18 0 "[ . 1 . ]" 1
1154 2 44 SER HA 2 45 ILE H 3.200 3.200 8.200 3.550 3.547 3.553 . 0 0 "[ . 1 . ]" 1
1155 2 44 SER HA 2 47 ARG H 0.000 . 3.500 3.507 3.500 3.516 0.016 6 0 "[ . 1 . ]" 1
1156 2 44 SER O 2 48 LEU H 2.200 . 2.600 2.217 2.199 2.226 . 0 0 "[ . 1 . ]" 1
1157 2 45 ILE H 2 45 ILE HA 2.700 2.700 7.700 2.831 2.829 2.833 . 0 0 "[ . 1 . ]" 1
1158 2 45 ILE H 2 45 ILE QG 0.000 . 3.500 2.004 2.001 2.006 . 0 0 "[ . 1 . ]" 1
1159 2 45 ILE H 2 46 GLU H 0.000 . 2.700 2.720 2.716 2.731 0.031 19 0 "[ . 1 . ]" 1
1160 2 45 ILE H 2 47 ARG H 3.200 3.200 5.000 4.207 4.150 4.226 . 0 0 "[ . 1 . ]" 1
1161 2 45 ILE HA 2 46 GLU H 3.200 3.200 8.200 3.553 3.550 3.559 . 0 0 "[ . 1 . ]" 1
1162 2 45 ILE HA 2 48 LEU H 0.000 . 3.500 3.494 3.465 3.509 0.009 1 0 "[ . 1 . ]" 1
1163 2 45 ILE HB 2 46 GLU H 0.000 . 3.200 2.657 2.608 2.671 . 0 0 "[ . 1 . ]" 1
1164 2 45 ILE MG 2 49 ARG H 0.000 . 4.800 4.012 3.999 4.031 . 0 0 "[ . 1 . ]" 1
1165 2 45 ILE O 2 49 ARG H 2.200 . 2.600 2.092 2.060 2.114 . 0 0 "[ . 1 . ]" 1
1166 2 46 GLU H 2 46 GLU HA 2.700 2.700 7.700 2.818 2.815 2.819 . 0 0 "[ . 1 . ]" 1
1167 2 46 GLU H 2 47 ARG H 0.000 . 2.700 2.723 2.714 2.726 0.026 10 0 "[ . 1 . ]" 1
1168 2 46 GLU H 2 48 LEU H 3.200 3.200 5.000 4.295 4.276 4.332 . 0 0 "[ . 1 . ]" 1
1169 2 46 GLU HA 2 47 ARG H 3.200 3.200 8.200 3.545 3.539 3.550 . 0 0 "[ . 1 . ]" 1
1170 2 46 GLU HA 2 49 ARG H 0.000 . 3.500 3.509 3.459 3.515 0.015 15 0 "[ . 1 . ]" 1
1171 2 46 GLU HA 2 49 ARG HB2 0.000 . 3.200 3.239 3.206 3.245 0.045 16 0 "[ . 1 . ]" 1
1172 2 46 GLU QB 2 47 ARG H 0.000 . 4.000 2.741 2.694 2.759 . 0 0 "[ . 1 . ]" 1
1173 2 46 GLU O 2 50 ARG H 2.200 . 2.600 2.070 2.043 2.099 . 0 0 "[ . 1 . ]" 1
1174 2 47 ARG H 2 47 ARG HA 2.700 2.700 7.700 2.820 2.817 2.823 . 0 0 "[ . 1 . ]" 1
1175 2 47 ARG H 2 47 ARG HD2 3.500 3.500 8.500 4.954 4.714 5.887 . 0 0 "[ . 1 . ]" 1
1176 2 47 ARG H 2 47 ARG HD3 3.500 3.500 8.500 5.168 4.693 5.938 . 0 0 "[ . 1 . ]" 1
1177 2 47 ARG H 2 48 LEU H 0.000 . 2.700 2.729 2.727 2.733 0.033 15 0 "[ . 1 . ]" 1
1178 2 47 ARG HA 2 48 LEU H 3.200 3.200 8.200 3.564 3.560 3.567 . 0 0 "[ . 1 . ]" 1
1179 2 47 ARG HA 2 50 ARG H 0.000 . 3.500 3.527 3.520 3.537 0.037 1 0 "[ . 1 . ]" 1
1180 2 47 ARG QB 2 48 LEU H 0.000 . 4.800 2.491 2.459 2.510 . 0 0 "[ . 1 . ]" 1
1181 2 47 ARG O 2 51 SER H 2.200 . 2.600 2.118 2.094 2.139 . 0 0 "[ . 1 . ]" 1
1182 2 48 LEU H 2 48 LEU HA 2.700 2.700 7.700 2.822 2.819 2.826 . 0 0 "[ . 1 . ]" 1
1183 2 48 LEU H 2 49 ARG H 0.000 . 2.700 2.714 2.708 2.718 0.018 15 0 "[ . 1 . ]" 1
1184 2 48 LEU HA 2 49 ARG H 3.200 3.200 8.200 3.553 3.547 3.558 . 0 0 "[ . 1 . ]" 1
1185 2 48 LEU HA 2 51 SER H 0.000 . 3.500 3.506 3.492 3.516 0.016 15 0 "[ . 1 . ]" 1
1186 2 48 LEU O 2 52 LEU H 2.200 . 2.600 2.223 2.205 2.261 . 0 0 "[ . 1 . ]" 1
1187 2 49 ARG H 2 49 ARG HA 2.700 2.700 7.700 2.816 2.813 2.823 . 0 0 "[ . 1 . ]" 1
1188 2 49 ARG H 2 50 ARG H 0.000 . 2.700 2.738 2.716 2.746 0.046 16 0 "[ . 1 . ]" 1
1189 2 49 ARG H 2 51 SER H 3.200 3.200 5.000 4.208 4.190 4.230 . 0 0 "[ . 1 . ]" 1
1190 2 49 ARG HA 2 50 ARG H 3.200 3.200 8.200 3.554 3.550 3.560 . 0 0 "[ . 1 . ]" 1
1191 2 49 ARG HA 2 52 LEU H 0.000 . 3.500 3.557 3.544 3.570 0.070 15 0 "[ . 1 . ]" 1
1192 2 49 ARG HA 2 52 LEU MD1 0.000 . 4.200 2.677 2.494 2.771 . 0 0 "[ . 1 . ]" 1
1193 2 49 ARG QB 2 50 ARG H 0.000 . 4.000 2.447 2.435 2.498 . 0 0 "[ . 1 . ]" 1
1194 2 49 ARG O 2 53 LYS H 2.200 . 2.600 2.237 2.217 2.253 . 0 0 "[ . 1 . ]" 1
1195 2 50 ARG H 2 50 ARG HA 2.700 2.700 7.700 2.820 2.817 2.822 . 0 0 "[ . 1 . ]" 1
1196 2 50 ARG H 2 51 SER H 0.000 . 2.700 2.710 2.706 2.714 0.014 15 0 "[ . 1 . ]" 1
1197 2 50 ARG HA 2 51 SER H 3.200 3.200 8.200 3.550 3.549 3.555 . 0 0 "[ . 1 . ]" 1
1198 2 50 ARG HA 2 53 LYS H 0.000 . 3.500 3.516 3.506 3.522 0.022 14 0 "[ . 1 . ]" 1
1199 2 50 ARG QB 2 51 SER H 0.000 . 4.000 2.564 2.543 2.600 . 0 0 "[ . 1 . ]" 1
1200 2 50 ARG O 2 54 GLN H 2.200 . 2.600 2.099 2.078 2.119 . 0 0 "[ . 1 . ]" 1
1201 2 51 SER H 2 51 SER HA 2.700 2.700 7.700 2.814 2.812 2.833 . 0 0 "[ . 1 . ]" 1
1202 2 51 SER H 2 52 LEU H 0.000 . 2.700 2.723 2.717 2.725 0.025 2 0 "[ . 1 . ]" 1
1203 2 51 SER HA 2 52 LEU H 3.200 3.200 8.200 3.558 3.554 3.576 . 0 0 "[ . 1 . ]" 1
1204 2 51 SER HA 2 54 GLN H 0.000 . 3.500 3.508 3.492 3.514 0.014 7 0 "[ . 1 . ]" 1
1205 2 51 SER O 2 55 LEU H 2.200 . 2.600 2.114 2.096 2.131 . 0 0 "[ . 1 . ]" 1
1206 2 52 LEU H 2 52 LEU HA 2.700 2.700 7.700 2.829 2.827 2.831 . 0 0 "[ . 1 . ]" 1
1207 2 52 LEU H 2 52 LEU HG 0.000 . 3.200 2.662 2.435 2.744 . 0 0 "[ . 1 . ]" 1
1208 2 52 LEU H 2 53 LYS H 0.000 . 2.700 2.734 2.731 2.738 0.038 17 0 "[ . 1 . ]" 1
1209 2 52 LEU HA 2 53 LYS H 3.200 3.200 8.200 3.559 3.556 3.562 . 0 0 "[ . 1 . ]" 1
1210 2 52 LEU HA 2 55 LEU H 0.000 . 3.500 3.534 3.528 3.547 0.047 15 0 "[ . 1 . ]" 1
1211 2 52 LEU QB 2 53 LYS H 0.000 . 4.000 2.560 2.519 2.582 . 0 0 "[ . 1 . ]" 1
1212 2 52 LEU O 2 56 ALA H 2.200 . 2.600 2.220 2.193 2.244 . 0 0 "[ . 1 . ]" 1
1213 2 53 LYS H 2 53 LYS HA 2.700 2.700 7.700 2.823 2.820 2.825 . 0 0 "[ . 1 . ]" 1
1214 2 53 LYS H 2 54 GLN H 0.000 . 2.700 2.721 2.717 2.726 0.026 19 0 "[ . 1 . ]" 1
1215 2 53 LYS H 2 55 LEU H 3.200 3.200 5.000 4.232 4.215 4.249 . 0 0 "[ . 1 . ]" 1
1216 2 53 LYS HA 2 54 GLN H 3.200 3.200 8.200 3.544 3.540 3.546 . 0 0 "[ . 1 . ]" 1
1217 2 53 LYS HA 2 56 ALA H 0.000 . 3.500 3.518 3.514 3.522 0.022 15 0 "[ . 1 . ]" 1
1218 2 53 LYS QB 2 54 GLN H 0.000 . 4.000 2.536 2.518 2.550 . 0 0 "[ . 1 . ]" 1
1219 2 53 LYS O 2 57 ASP H 2.200 . 2.600 2.214 2.187 2.224 . 0 0 "[ . 1 . ]" 1
1220 2 54 GLN H 2 54 GLN HA 2.700 2.700 7.700 2.818 2.816 2.820 . 0 0 "[ . 1 . ]" 1
1221 2 54 GLN H 2 55 LEU H 0.000 . 2.700 2.718 2.713 2.722 0.022 15 0 "[ . 1 . ]" 1
1222 2 54 GLN HA 2 55 LEU H 3.200 3.200 8.200 3.559 3.557 3.564 . 0 0 "[ . 1 . ]" 1
1223 2 54 GLN HA 2 57 ASP H 0.000 . 3.500 3.525 3.520 3.531 0.031 14 0 "[ . 1 . ]" 1
1224 2 54 GLN HA 2 57 ASP QB 0.000 . 4.000 2.924 2.877 2.986 . 0 0 "[ . 1 . ]" 1
1225 2 54 GLN O 2 58 ASP H 2.200 . 2.600 2.100 2.076 2.125 . 0 0 "[ . 1 . ]" 1
1226 2 55 LEU H 2 55 LEU HA 2.700 2.700 7.700 2.819 2.817 2.824 . 0 0 "[ . 1 . ]" 1
1227 2 55 LEU H 2 56 ALA H 0.000 . 2.700 2.716 2.713 2.719 0.019 12 0 "[ . 1 . ]" 1
1228 2 55 LEU HA 2 56 ALA H 3.200 3.200 8.200 3.552 3.549 3.555 . 0 0 "[ . 1 . ]" 1
1229 2 55 LEU HA 2 58 ASP H 0.000 . 3.500 3.510 3.505 3.518 0.018 15 0 "[ . 1 . ]" 1
1230 2 55 LEU QB 2 56 ALA H 0.000 . 3.200 2.624 2.618 2.635 . 0 0 "[ . 1 . ]" 1
1231 2 55 LEU MD1 2 59 ARG H 0.000 . 4.800 4.018 4.018 4.020 . 0 0 "[ . 1 . ]" 1
1232 2 55 LEU O 2 59 ARG H 2.200 . 2.600 2.061 2.040 2.074 . 0 0 "[ . 1 . ]" 1
1233 2 56 ALA H 2 56 ALA HA 2.700 2.700 7.700 2.823 2.821 2.824 . 0 0 "[ . 1 . ]" 1
1234 2 56 ALA H 2 57 ASP H 0.000 . 2.700 2.735 2.728 2.738 0.038 7 0 "[ . 1 . ]" 1
1235 2 56 ALA HA 2 57 ASP H 3.200 3.200 8.200 3.559 3.557 3.561 . 0 0 "[ . 1 . ]" 1
1236 2 56 ALA HA 2 59 ARG H 0.000 . 3.500 3.540 3.534 3.544 0.044 15 0 "[ . 1 . ]" 1
1237 2 56 ALA O 2 60 THR H 2.200 . 2.600 2.193 2.156 2.213 . 0 0 "[ . 1 . ]" 1
1238 2 57 ASP H 2 57 ASP HA 2.700 2.700 7.700 2.826 2.824 2.828 . 0 0 "[ . 1 . ]" 1
1239 2 57 ASP H 2 58 ASP H 0.000 . 2.700 2.719 2.716 2.724 0.024 3 0 "[ . 1 . ]" 1
1240 2 57 ASP HA 2 58 ASP H 3.200 3.200 8.200 3.549 3.547 3.552 . 0 0 "[ . 1 . ]" 1
1241 2 57 ASP HA 2 60 THR H 0.000 . 3.500 3.527 3.522 3.531 0.031 14 0 "[ . 1 . ]" 1
1242 2 57 ASP O 2 61 LEU H 2.200 . 2.600 2.205 2.191 2.219 . 0 0 "[ . 1 . ]" 1
1243 2 58 ASP H 2 58 ASP HA 2.700 2.700 7.700 2.819 2.817 2.821 . 0 0 "[ . 1 . ]" 1
1244 2 58 ASP H 2 59 ARG H 0.000 . 2.700 2.718 2.712 2.721 0.021 8 0 "[ . 1 . ]" 1
1245 2 58 ASP HA 2 59 ARG H 3.200 3.200 8.200 3.559 3.555 3.561 . 0 0 "[ . 1 . ]" 1
1246 2 58 ASP HA 2 61 LEU H 0.000 . 3.500 3.524 3.519 3.532 0.032 15 0 "[ . 1 . ]" 1
1247 2 58 ASP O 2 62 LEU H 2.200 . 2.600 2.105 2.060 2.133 . 0 0 "[ . 1 . ]" 1
1248 2 59 ARG H 2 59 ARG HA 2.700 2.700 7.700 2.814 2.813 2.817 . 0 0 "[ . 1 . ]" 1
1249 2 59 ARG H 2 60 THR H 0.000 . 2.700 2.728 2.723 2.731 0.031 10 0 "[ . 1 . ]" 1
1250 2 59 ARG HA 2 60 THR H 3.200 3.200 8.200 3.552 3.549 3.554 . 0 0 "[ . 1 . ]" 1
1251 2 59 ARG HA 2 62 LEU H 0.000 . 3.500 3.525 3.520 3.533 0.033 15 0 "[ . 1 . ]" 1
1252 2 59 ARG QD 2 113 LEU MD2 0.000 . 4.800 3.157 2.489 3.563 . 0 0 "[ . 1 . ]" 1
1253 2 59 ARG O 2 63 MET H 2.200 . 2.600 2.118 2.099 2.139 . 0 0 "[ . 1 . ]" 1
1254 2 60 THR H 2 60 THR HA 2.700 2.700 7.700 2.823 2.821 2.826 . 0 0 "[ . 1 . ]" 1
1255 2 60 THR H 2 61 LEU H 0.000 . 2.700 2.734 2.729 2.738 0.038 1 0 "[ . 1 . ]" 1
1256 2 60 THR HA 2 61 LEU H 3.200 3.200 8.200 3.559 3.557 3.561 . 0 0 "[ . 1 . ]" 1
1257 2 60 THR HA 2 63 MET H 0.000 . 3.500 3.524 3.518 3.530 0.030 19 0 "[ . 1 . ]" 1
1258 2 60 THR O 2 64 ALA H 2.200 . 2.600 2.222 2.193 2.242 . 0 0 "[ . 1 . ]" 1
1259 2 61 LEU H 2 61 LEU HA 2.700 2.700 7.700 2.825 2.822 2.827 . 0 0 "[ . 1 . ]" 1
1260 2 61 LEU H 2 62 LEU H 0.000 . 2.700 2.719 2.710 2.723 0.023 11 0 "[ . 1 . ]" 1
1261 2 61 LEU HA 2 62 LEU H 3.200 3.200 8.200 3.550 3.543 3.554 . 0 0 "[ . 1 . ]" 1
1262 2 61 LEU HA 2 64 ALA H 0.000 . 3.500 3.528 3.523 3.534 0.034 19 0 "[ . 1 . ]" 1
1263 2 61 LEU O 2 65 GLY H 2.200 . 2.600 2.185 2.161 2.207 . 0 0 "[ . 1 . ]" 1
1264 2 62 LEU H 2 62 LEU HA 2.700 2.700 7.700 2.818 2.817 2.821 . 0 0 "[ . 1 . ]" 1
1265 2 62 LEU H 2 63 MET H 0.000 . 2.700 2.712 2.708 2.717 0.017 10 0 "[ . 1 . ]" 1
1266 2 62 LEU HA 2 63 MET H 3.200 3.200 8.200 3.549 3.546 3.552 . 0 0 "[ . 1 . ]" 1
1267 2 62 LEU HA 2 65 GLY H 0.000 . 3.500 3.519 3.513 3.525 0.025 15 0 "[ . 1 . ]" 1
1268 2 62 LEU O 2 66 VAL H 2.200 . 2.600 2.113 2.092 2.127 . 0 0 "[ . 1 . ]" 1
1269 2 63 MET H 2 63 MET HA 2.700 2.700 7.700 2.815 2.812 2.817 . 0 0 "[ . 1 . ]" 1
1270 2 63 MET H 2 64 ALA H 0.000 . 2.700 2.741 2.734 2.747 0.047 13 0 "[ . 1 . ]" 1
1271 2 63 MET HA 2 64 ALA H 3.200 3.200 8.200 3.554 3.551 3.556 . 0 0 "[ . 1 . ]" 1
1272 2 63 MET HA 2 66 VAL H 0.000 . 3.500 3.558 3.553 3.562 0.062 5 0 "[ . 1 . ]" 1
1273 2 63 MET HA 2 66 VAL MG2 0.000 . 3.500 2.920 2.915 2.923 . 0 0 "[ . 1 . ]" 1
1274 2 63 MET ME 2 109 PHE QB 0.000 . 4.800 3.567 3.564 3.570 . 0 0 "[ . 1 . ]" 1
1275 2 63 MET ME 2 109 PHE HD2 0.000 . 4.800 2.120 2.060 2.187 . 0 0 "[ . 1 . ]" 1
1276 2 63 MET ME 2 109 PHE HE2 0.000 . 4.800 2.841 2.708 2.884 . 0 0 "[ . 1 . ]" 1
1277 2 63 MET ME 2 109 PHE HZ 4.000 4.000 5.800 4.727 4.549 4.787 . 0 0 "[ . 1 . ]" 1
1278 2 63 MET ME 2 113 LEU H 0.000 . 4.800 3.974 3.714 4.002 . 0 0 "[ . 1 . ]" 1
1279 2 63 MET O 2 67 SER H 2.200 . 2.600 2.071 2.047 2.086 . 0 0 "[ . 1 . ]" 1
1280 2 64 ALA H 2 64 ALA HA 2.700 2.700 7.700 2.829 2.827 2.830 . 0 0 "[ . 1 . ]" 1
1281 2 64 ALA H 2 65 GLY H 0.000 . 2.700 2.717 2.713 2.721 0.021 8 0 "[ . 1 . ]" 1
1282 2 64 ALA HA 2 65 GLY H 3.200 3.200 8.200 3.552 3.549 3.553 . 0 0 "[ . 1 . ]" 1
1283 2 64 ALA HA 2 67 SER H 0.000 . 3.500 3.557 3.553 3.562 0.062 7 0 "[ . 1 . ]" 1
1284 2 64 ALA HA 2 68 HIS H 0.000 . 4.500 4.228 4.197 4.258 . 0 0 "[ . 1 . ]" 1
1285 2 64 ALA O 2 68 HIS H 2.200 . 2.600 2.177 2.164 2.191 . 0 0 "[ . 1 . ]" 1
1286 2 65 GLY H 2 65 GLY HA2 2.700 2.700 7.700 2.817 2.815 2.819 . 0 0 "[ . 1 . ]" 1
1287 2 65 GLY H 2 65 GLY HA3 0.000 . 2.700 2.304 2.302 2.306 . 0 0 "[ . 1 . ]" 1
1288 2 65 GLY H 2 66 VAL H 0.000 . 2.700 2.732 2.730 2.734 0.034 17 0 "[ . 1 . ]" 1
1289 2 65 GLY HA2 2 66 VAL H 3.200 3.200 8.200 3.559 3.558 3.561 . 0 0 "[ . 1 . ]" 1
1290 2 65 GLY HA3 2 66 VAL H 2.700 2.700 7.700 2.790 2.784 2.795 . 0 0 "[ . 1 . ]" 1
1291 2 65 GLY O 2 69 ASP H 2.200 . 2.600 2.191 2.172 2.203 . 0 0 "[ . 1 . ]" 1
1292 2 66 VAL H 2 66 VAL HA 2.700 2.700 7.700 2.837 2.835 2.838 . 0 0 "[ . 1 . ]" 1
1293 2 66 VAL H 2 67 SER H 0.000 . 2.700 2.699 2.687 2.703 0.003 7 0 "[ . 1 . ]" 1
1294 2 66 VAL HA 2 67 SER H 3.200 3.200 8.200 3.574 3.571 3.577 . 0 0 "[ . 1 . ]" 1
1295 2 66 VAL HA 2 69 ASP H 0.000 . 3.500 3.556 3.550 3.562 0.062 1 0 "[ . 1 . ]" 1
1296 2 66 VAL O 2 70 LEU H 2.200 . 2.600 2.252 2.235 2.270 . 0 0 "[ . 1 . ]" 1
1297 2 67 SER H 2 67 SER HA 2.700 2.700 7.700 2.817 2.815 2.819 . 0 0 "[ . 1 . ]" 1
1298 2 67 SER H 2 68 HIS H 0.000 . 2.700 2.714 2.710 2.719 0.019 10 0 "[ . 1 . ]" 1
1299 2 67 SER HA 2 68 HIS H 3.200 3.200 8.200 3.545 3.543 3.546 . 0 0 "[ . 1 . ]" 1
1300 2 67 SER QB 2 70 LEU H 0.000 . 5.800 5.149 5.105 5.191 . 0 0 "[ . 1 . ]" 1
1301 2 67 SER O 2 71 ARG H 2.200 . 2.600 2.303 2.273 2.328 . 0 0 "[ . 1 . ]" 1
1302 2 68 HIS H 2 68 HIS HA 2.700 2.700 7.700 2.818 2.816 2.819 . 0 0 "[ . 1 . ]" 1
1303 2 68 HIS H 2 69 ASP H 0.000 . 2.700 2.757 2.754 2.759 0.059 2 0 "[ . 1 . ]" 1
1304 2 68 HIS HA 2 69 ASP H 3.200 3.200 8.200 3.573 3.571 3.575 . 0 0 "[ . 1 . ]" 1
1305 2 68 HIS HA 2 71 ARG H 0.000 . 3.500 3.514 3.510 3.520 0.020 15 0 "[ . 1 . ]" 1
1306 2 68 HIS O 2 71 ARG H 2.200 . 2.600 2.174 2.165 2.186 . 0 0 "[ . 1 . ]" 1
1307 2 69 ASP H 2 69 ASP HA 2.700 2.700 7.700 2.815 2.813 2.816 . 0 0 "[ . 1 . ]" 1
1308 2 69 ASP H 2 70 LEU H 0.000 . 2.700 2.746 2.740 2.751 0.051 11 0 "[ . 1 . ]" 1
1309 2 69 ASP HA 2 70 LEU H 3.200 3.200 8.200 3.540 3.537 3.542 . 0 0 "[ . 1 . ]" 1
1310 2 69 ASP HA 2 72 THR H 0.000 . 4.000 3.858 3.829 3.884 . 0 0 "[ . 1 . ]" 1
1311 2 70 LEU H 2 70 LEU HA 2.700 2.700 7.700 2.865 2.860 2.870 . 0 0 "[ . 1 . ]" 1
1312 2 70 LEU H 2 71 ARG H 0.000 . 2.700 2.586 2.566 2.602 . 0 0 "[ . 1 . ]" 1
1313 2 70 LEU HA 2 71 ARG H 3.200 3.200 8.200 3.501 3.498 3.503 . 0 0 "[ . 1 . ]" 1
1314 2 70 LEU O 2 74 LEU H 2.200 . 2.600 2.529 2.519 2.538 . 0 0 "[ . 1 . ]" 1
1315 2 71 ARG H 2 71 ARG HA 2.700 2.700 7.700 2.789 2.786 2.791 . 0 0 "[ . 1 . ]" 1
1316 2 71 ARG H 2 72 THR H 0.000 . 2.700 2.749 2.744 2.755 0.055 11 0 "[ . 1 . ]" 1
1317 2 71 ARG HA 2 72 THR H 3.200 3.200 8.200 3.513 3.512 3.515 . 0 0 "[ . 1 . ]" 1
1318 2 71 ARG HA 2 74 LEU H 0.000 . 4.000 3.889 3.865 3.910 . 0 0 "[ . 1 . ]" 1
1319 2 71 ARG HA 2 75 THR H 0.000 . 4.500 4.191 4.160 4.215 . 0 0 "[ . 1 . ]" 1
1320 2 71 ARG O 2 75 THR H 2.200 . 2.600 2.179 2.164 2.191 . 0 0 "[ . 1 . ]" 1
1321 2 72 THR H 2 72 THR HA 2.700 2.700 7.700 2.828 2.826 2.829 . 0 0 "[ . 1 . ]" 1
1322 2 72 THR H 2 73 PRO HD3 0.000 . 3.500 3.469 3.464 3.477 . 0 0 "[ . 1 . ]" 1
1323 2 72 THR HA 2 74 LEU H 0.000 . 4.500 4.516 4.512 4.520 0.020 5 0 "[ . 1 . ]" 1
1324 2 72 THR HA 2 76 ARG QG 0.000 . 4.800 3.888 3.804 4.144 . 0 0 "[ . 1 . ]" 1
1325 2 72 THR HB 2 73 PRO HD2 0.000 . 3.200 2.572 2.534 2.614 . 0 0 "[ . 1 . ]" 1
1326 2 72 THR HB 2 73 PRO HD3 0.000 . 2.700 2.063 2.050 2.074 . 0 0 "[ . 1 . ]" 1
1327 2 72 THR MG 2 73 PRO HD3 0.000 . 4.200 3.397 3.277 3.506 . 0 0 "[ . 1 . ]" 1
1328 2 72 THR O 2 76 ARG H 2.200 . 2.600 2.172 2.159 2.184 . 0 0 "[ . 1 . ]" 1
1329 2 73 PRO HA 2 74 LEU H 3.200 3.200 8.200 3.589 3.588 3.591 . 0 0 "[ . 1 . ]" 1
1330 2 73 PRO HD2 2 74 LEU H 0.000 . 3.500 3.144 3.131 3.154 . 0 0 "[ . 1 . ]" 1
1331 2 73 PRO HD3 2 74 LEU H 3.200 3.200 4.500 4.122 4.113 4.127 . 0 0 "[ . 1 . ]" 1
1332 2 73 PRO O 2 77 ILE H 2.200 . 2.600 2.187 2.173 2.202 . 0 0 "[ . 1 . ]" 1
1333 2 74 LEU H 2 74 LEU HA 2.700 2.700 7.700 2.843 2.840 2.845 . 0 0 "[ . 1 . ]" 1
1334 2 74 LEU H 2 75 THR H 0.000 . 2.700 2.740 2.737 2.745 0.045 12 0 "[ . 1 . ]" 1
1335 2 74 LEU HA 2 75 THR H 3.200 3.200 8.200 3.561 3.560 3.563 . 0 0 "[ . 1 . ]" 1
1336 2 74 LEU HA 2 77 ILE H 0.000 . 4.000 3.718 3.701 3.739 . 0 0 "[ . 1 . ]" 1
1337 2 74 LEU HA 2 99 ILE MD 0.000 . 3.800 3.191 3.187 3.195 . 0 0 "[ . 1 . ]" 1
1338 2 74 LEU MD2 2 103 ASN HB2 0.000 . 4.000 3.348 3.345 3.351 . 0 0 "[ . 1 . ]" 1
1339 2 74 LEU O 2 78 ARG H 2.200 . 2.600 2.323 2.302 2.341 . 0 0 "[ . 1 . ]" 1
1340 2 75 THR H 2 75 THR HA 2.700 2.700 7.700 2.809 2.806 2.812 . 0 0 "[ . 1 . ]" 1
1341 2 75 THR H 2 76 ARG H 0.000 . 2.700 2.724 2.714 2.732 0.032 8 0 "[ . 1 . ]" 1
1342 2 75 THR HA 2 76 ARG H 3.200 3.200 8.200 3.532 3.529 3.535 . 0 0 "[ . 1 . ]" 1
1343 2 75 THR HA 2 78 ARG H 0.000 . 4.000 3.635 3.592 3.665 . 0 0 "[ . 1 . ]" 1
1344 2 75 THR O 2 79 LEU H 2.200 . 2.600 2.209 2.192 2.227 . 0 0 "[ . 1 . ]" 1
1345 2 76 ARG H 2 76 ARG HA 2.700 2.700 7.700 2.818 2.816 2.820 . 0 0 "[ . 1 . ]" 1
1346 2 76 ARG H 2 77 ILE H 0.000 . 2.700 2.747 2.743 2.753 0.053 17 0 "[ . 1 . ]" 1
1347 2 76 ARG HA 2 77 ILE H 3.200 3.200 8.200 3.562 3.560 3.566 . 0 0 "[ . 1 . ]" 1
1348 2 76 ARG HA 2 79 LEU H 0.000 . 4.000 3.817 3.785 3.856 . 0 0 "[ . 1 . ]" 1
1349 2 76 ARG O 2 80 ALA H 2.200 . 2.600 2.167 2.151 2.196 . 0 0 "[ . 1 . ]" 1
1350 2 77 ILE H 2 77 ILE HA 2.700 2.700 7.700 2.837 2.833 2.840 . 0 0 "[ . 1 . ]" 1
1351 2 77 ILE H 2 78 ARG H 0.000 . 2.700 2.670 2.660 2.684 . 0 0 "[ . 1 . ]" 1
1352 2 77 ILE HA 2 78 ARG H 3.200 3.200 8.200 3.540 3.534 3.546 . 0 0 "[ . 1 . ]" 1
1353 2 77 ILE HA 2 80 ALA H 0.000 . 4.000 3.661 3.613 3.695 . 0 0 "[ . 1 . ]" 1
1354 2 77 ILE HA 2 80 ALA MB 0.000 . 3.500 2.767 2.587 2.899 . 0 0 "[ . 1 . ]" 1
1355 2 77 ILE MG 2 81 THR H 0.000 . 4.800 3.959 3.919 3.986 . 0 0 "[ . 1 . ]" 1
1356 2 77 ILE O 2 81 THR H 2.200 . 2.600 2.087 2.066 2.104 . 0 0 "[ . 1 . ]" 1
1357 2 78 ARG H 2 78 ARG HA 2.700 2.700 7.700 2.840 2.835 2.851 . 0 0 "[ . 1 . ]" 1
1358 2 78 ARG H 2 79 LEU H 0.000 . 2.700 2.735 2.731 2.740 0.040 17 0 "[ . 1 . ]" 1
1359 2 78 ARG H 2 99 ILE MD 0.000 . 4.800 3.003 2.828 3.242 . 0 0 "[ . 1 . ]" 1
1360 2 78 ARG HA 2 79 LEU H 3.200 3.200 8.200 3.565 3.562 3.577 . 0 0 "[ . 1 . ]" 1
1361 2 78 ARG HA 2 81 THR H 0.000 . 4.000 3.836 3.787 3.874 . 0 0 "[ . 1 . ]" 1
1362 2 78 ARG O 2 82 GLU H 2.200 . 2.600 2.284 2.267 2.302 . 0 0 "[ . 1 . ]" 1
1363 2 79 LEU H 2 79 LEU HA 2.700 2.700 7.700 2.817 2.815 2.819 . 0 0 "[ . 1 . ]" 1
1364 2 79 LEU H 2 80 ALA H 0.000 . 2.700 2.716 2.711 2.719 0.019 8 0 "[ . 1 . ]" 1
1365 2 79 LEU HA 2 80 ALA H 3.200 3.200 8.200 3.541 3.539 3.543 . 0 0 "[ . 1 . ]" 1
1366 2 79 LEU HA 2 82 GLU H 0.000 . 4.000 3.859 3.831 3.899 . 0 0 "[ . 1 . ]" 1
1367 2 80 ALA H 2 80 ALA HA 2.700 2.700 7.700 2.830 2.827 2.832 . 0 0 "[ . 1 . ]" 1
1368 2 80 ALA H 2 81 THR H 0.000 . 2.700 2.729 2.727 2.733 0.033 16 0 "[ . 1 . ]" 1
1369 2 80 ALA HA 2 81 THR H 3.200 3.200 8.200 3.570 3.568 3.572 . 0 0 "[ . 1 . ]" 1
1370 2 80 ALA HA 2 83 MET H 0.000 . 4.000 4.000 3.986 4.005 0.005 10 0 "[ . 1 . ]" 1
1371 2 80 ALA O 2 83 MET H 2.200 . 2.600 2.080 2.070 2.097 . 0 0 "[ . 1 . ]" 1
1372 2 81 THR H 2 81 THR HA 2.700 2.700 7.700 2.807 2.805 2.811 . 0 0 "[ . 1 . ]" 1
1373 2 81 THR H 2 82 GLU H 0.000 . 2.700 2.725 2.720 2.729 0.029 2 0 "[ . 1 . ]" 1
1374 2 81 THR HA 2 82 GLU H 3.200 3.200 8.200 3.530 3.527 3.535 . 0 0 "[ . 1 . ]" 1
1375 2 81 THR HA 2 84 MET H 0.000 . 4.000 3.796 3.703 3.839 . 0 0 "[ . 1 . ]" 1
1376 2 81 THR HA 2 84 MET QG 0.000 . 4.000 3.091 2.555 3.301 . 0 0 "[ . 1 . ]" 1
1377 2 81 THR HB 2 92 ALA MB 0.000 . 3.500 2.219 2.004 2.504 . 0 0 "[ . 1 . ]" 1
1378 2 81 THR MG 2 95 ILE HB 0.000 . 3.500 2.406 2.222 2.568 . 0 0 "[ . 1 . ]" 1
1379 2 81 THR MG 2 95 ILE MG 0.000 . 3.800 2.403 2.273 2.546 . 0 0 "[ . 1 . ]" 1
1380 2 81 THR MG 2 96 ASN H 0.000 . 4.800 4.002 3.998 4.007 . 0 0 "[ . 1 . ]" 1
1381 2 81 THR O 2 84 MET H 2.200 . 2.600 2.063 2.038 2.078 . 0 0 "[ . 1 . ]" 1
1382 2 82 GLU H 2 82 GLU HA 2.700 2.700 7.700 2.782 2.780 2.786 . 0 0 "[ . 1 . ]" 1
1383 2 82 GLU H 2 83 MET H 0.000 . 3.200 2.883 2.877 2.887 . 0 0 "[ . 1 . ]" 1
1384 2 82 GLU HA 2 83 MET H 3.200 3.200 8.200 3.484 3.483 3.485 . 0 0 "[ . 1 . ]" 1
1385 2 83 MET H 2 83 MET HA 2.700 2.700 7.700 2.927 2.923 2.932 . 0 0 "[ . 1 . ]" 1
1386 2 83 MET H 2 84 MET H 0.000 . 2.700 2.554 2.525 2.569 . 0 0 "[ . 1 . ]" 1
1387 2 83 MET HA 2 84 MET H 3.200 3.200 8.200 3.311 3.306 3.316 . 0 0 "[ . 1 . ]" 1
1388 2 84 MET H 2 84 MET HA 2.700 2.700 7.700 2.874 2.860 2.879 . 0 0 "[ . 1 . ]" 1
1389 2 84 MET QB 2 92 ALA MB 0.000 . 4.200 2.730 2.512 2.898 . 0 0 "[ . 1 . ]" 1
1390 2 84 MET ME 2 88 ASP HB3 0.000 . 3.200 2.685 2.677 2.691 . 0 0 "[ . 1 . ]" 1
1391 2 84 MET ME 2 91 LEU QB 3.500 3.500 5.000 2.630 2.602 2.644 0.898 17 19 [*******-********+**] 1
1392 2 84 MET ME 2 95 ILE MD 0.000 . 4.800 3.333 3.298 3.339 . 0 0 "[ . 1 . ]" 1
1393 2 85 SER QB 2 88 ASP H 0.000 . 4.800 3.423 3.203 4.198 . 0 0 "[ . 1 . ]" 1
1394 2 86 GLU HA 2 89 GLY H 0.000 . 4.500 3.696 3.673 3.729 . 0 0 "[ . 1 . ]" 1
1395 2 86 GLU O 2 89 GLY H 2.200 . 2.600 2.059 2.048 2.070 . 0 0 "[ . 1 . ]" 1
1396 2 87 GLN HA 2 88 ASP H 3.200 3.200 8.200 3.497 3.495 3.498 . 0 0 "[ . 1 . ]" 1
1397 2 87 GLN HA 2 89 GLY H 0.000 . 4.000 4.007 4.000 4.019 0.019 9 0 "[ . 1 . ]" 1
1398 2 88 ASP H 2 88 ASP HA 2.700 2.700 7.700 2.966 2.963 2.968 . 0 0 "[ . 1 . ]" 1
1399 2 88 ASP H 2 89 GLY H 0.000 . 2.700 2.636 2.627 2.648 . 0 0 "[ . 1 . ]" 1
1400 2 88 ASP HA 2 89 GLY H 0.000 . 3.200 2.986 2.949 3.020 . 0 0 "[ . 1 . ]" 1
1401 2 88 ASP HA 2 90 TYR HD1 0.000 . 4.000 3.858 3.801 3.935 . 0 0 "[ . 1 . ]" 1
1402 2 88 ASP HA 2 90 TYR HE1 0.000 . 3.500 3.166 3.117 3.237 . 0 0 "[ . 1 . ]" 1
1403 2 88 ASP HA 2 91 LEU H 0.000 . 4.000 3.637 3.610 3.660 . 0 0 "[ . 1 . ]" 1
1404 2 88 ASP HA 2 91 LEU QB 3.200 3.200 5.000 3.801 3.757 3.843 . 0 0 "[ . 1 . ]" 1
1405 2 88 ASP HA 2 91 LEU QD 0.000 . 4.000 3.224 3.139 3.308 . 0 0 "[ . 1 . ]" 1
1406 2 88 ASP HA 2 91 LEU HG 3.200 3.200 5.000 4.338 4.270 4.401 . 0 0 "[ . 1 . ]" 1
1407 2 88 ASP O 2 91 LEU H 2.200 . 2.600 2.132 2.115 2.149 . 0 0 "[ . 1 . ]" 1
1408 2 88 ASP O 2 92 ALA H 2.200 . 2.600 2.374 2.359 2.387 . 0 0 "[ . 1 . ]" 1
1409 2 89 GLY H 2 89 GLY HA2 2.700 2.700 7.700 2.803 2.801 2.805 . 0 0 "[ . 1 . ]" 1
1410 2 89 GLY H 2 89 GLY HA3 0.000 . 2.700 2.296 2.293 2.298 . 0 0 "[ . 1 . ]" 1
1411 2 89 GLY H 2 90 TYR H 0.000 . 2.700 2.732 2.727 2.735 0.035 15 0 "[ . 1 . ]" 1
1412 2 89 GLY HA2 2 92 ALA H 0.000 . 3.500 3.512 3.508 3.517 0.017 17 0 "[ . 1 . ]" 1
1413 2 89 GLY HA2 2 92 ALA MB 0.000 . 4.000 2.865 2.706 2.970 . 0 0 "[ . 1 . ]" 1
1414 2 89 GLY HA2 2 93 GLU H 0.000 . 4.500 4.225 4.204 4.251 . 0 0 "[ . 1 . ]" 1
1415 2 89 GLY O 2 93 GLU H 2.200 . 2.600 2.093 2.077 2.115 . 0 0 "[ . 1 . ]" 1
1416 2 90 TYR H 2 90 TYR HA 2.700 2.700 7.700 2.833 2.832 2.837 . 0 0 "[ . 1 . ]" 1
1417 2 90 TYR HA 2 91 LEU H 3.200 3.200 8.200 3.512 3.509 3.517 . 0 0 "[ . 1 . ]" 1
1418 2 90 TYR HA 2 93 GLU H 0.000 . 3.500 3.510 3.505 3.514 0.014 10 0 "[ . 1 . ]" 1
1419 2 90 TYR HD2 2 91 LEU QD 0.000 . 4.000 3.196 3.177 3.216 . 0 0 "[ . 1 . ]" 1
1420 2 90 TYR HE2 2 91 LEU QD 0.000 . 3.500 2.540 2.483 2.661 . 0 0 "[ . 1 . ]" 1
1421 2 90 TYR O 2 94 SER H 2.200 . 2.600 2.237 2.212 2.257 . 0 0 "[ . 1 . ]" 1
1422 2 91 LEU H 2 91 LEU HA 2.700 2.700 7.700 2.869 2.867 2.870 . 0 0 "[ . 1 . ]" 1
1423 2 91 LEU H 2 92 ALA H 0.000 . 2.700 2.518 2.510 2.525 . 0 0 "[ . 1 . ]" 1
1424 2 91 LEU HA 2 92 ALA H 3.200 3.200 8.200 3.551 3.550 3.553 . 0 0 "[ . 1 . ]" 1
1425 2 91 LEU HA 2 94 SER H 0.000 . 3.500 3.531 3.525 3.538 0.038 10 0 "[ . 1 . ]" 1
1426 2 91 LEU O 2 95 ILE H 2.200 . 2.600 2.199 2.173 2.216 . 0 0 "[ . 1 . ]" 1
1427 2 92 ALA H 2 92 ALA HA 2.700 2.700 7.700 2.823 2.822 2.825 . 0 0 "[ . 1 . ]" 1
1428 2 92 ALA H 2 93 GLU H 0.000 . 2.700 2.714 2.711 2.717 0.017 9 0 "[ . 1 . ]" 1
1429 2 92 ALA HA 2 93 GLU H 3.200 3.200 8.200 3.540 3.538 3.545 . 0 0 "[ . 1 . ]" 1
1430 2 92 ALA HA 2 95 ILE H 0.000 . 3.500 3.526 3.520 3.533 0.033 10 0 "[ . 1 . ]" 1
1431 2 92 ALA HA 2 95 ILE HB 0.000 . 3.500 2.933 2.895 2.966 . 0 0 "[ . 1 . ]" 1
1432 2 92 ALA O 2 96 ASN H 2.200 . 2.600 2.128 2.115 2.145 . 0 0 "[ . 1 . ]" 1
1433 2 93 GLU H 2 93 GLU HA 2.700 2.700 7.700 2.817 2.816 2.818 . 0 0 "[ . 1 . ]" 1
1434 2 93 GLU H 2 94 SER H 0.000 . 2.700 2.723 2.719 2.725 0.025 11 0 "[ . 1 . ]" 1
1435 2 93 GLU HA 2 94 SER H 3.200 3.200 8.200 3.564 3.561 3.568 . 0 0 "[ . 1 . ]" 1
1436 2 93 GLU HA 2 96 ASN H 0.000 . 3.500 3.514 3.509 3.520 0.020 10 0 "[ . 1 . ]" 1
1437 2 93 GLU O 2 97 LYS H 2.200 . 2.600 2.162 2.148 2.180 . 0 0 "[ . 1 . ]" 1
1438 2 94 SER H 2 94 SER HA 2.700 2.700 7.700 2.820 2.819 2.822 . 0 0 "[ . 1 . ]" 1
1439 2 94 SER H 2 95 ILE H 0.000 . 2.700 2.736 2.733 2.742 0.042 13 0 "[ . 1 . ]" 1
1440 2 94 SER HA 2 95 ILE H 3.200 3.200 8.200 3.558 3.555 3.562 . 0 0 "[ . 1 . ]" 1
1441 2 94 SER HA 2 97 LYS H 0.000 . 3.500 3.532 3.529 3.537 0.037 10 0 "[ . 1 . ]" 1
1442 2 94 SER O 2 98 ASP H 2.200 . 2.600 2.184 2.170 2.198 . 0 0 "[ . 1 . ]" 1
1443 2 95 ILE H 2 95 ILE HA 2.700 2.700 7.700 2.831 2.829 2.833 . 0 0 "[ . 1 . ]" 1
1444 2 95 ILE H 2 96 ASN H 0.000 . 2.700 2.719 2.714 2.723 0.023 11 0 "[ . 1 . ]" 1
1445 2 95 ILE HA 2 96 ASN H 3.200 3.200 8.200 3.563 3.561 3.565 . 0 0 "[ . 1 . ]" 1
1446 2 95 ILE HA 2 98 ASP H 0.000 . 3.500 3.357 3.310 3.385 . 0 0 "[ . 1 . ]" 1
1447 2 95 ILE O 2 99 ILE H 2.200 . 2.600 2.172 2.155 2.209 . 0 0 "[ . 1 . ]" 1
1448 2 96 ASN H 2 96 ASN HA 2.700 2.700 7.700 2.810 2.808 2.814 . 0 0 "[ . 1 . ]" 1
1449 2 96 ASN H 2 97 LYS H 0.000 . 2.700 2.751 2.745 2.755 0.055 10 0 "[ . 1 . ]" 1
1450 2 96 ASN HA 2 97 LYS H 3.200 3.200 8.200 3.551 3.549 3.556 . 0 0 "[ . 1 . ]" 1
1451 2 96 ASN HA 2 99 ILE H 0.000 . 3.500 3.513 3.503 3.516 0.016 11 0 "[ . 1 . ]" 1
1452 2 96 ASN HA 2 99 ILE HB 0.000 . 3.200 3.173 3.105 3.210 0.010 17 0 "[ . 1 . ]" 1
1453 2 96 ASN O 2 100 GLU H 2.200 . 2.600 2.266 2.254 2.281 . 0 0 "[ . 1 . ]" 1
1454 2 97 LYS H 2 97 LYS HA 2.700 2.700 7.700 2.824 2.821 2.837 . 0 0 "[ . 1 . ]" 1
1455 2 97 LYS H 2 98 ASP H 0.000 . 2.700 2.705 2.699 2.710 0.010 16 0 "[ . 1 . ]" 1
1456 2 97 LYS HA 2 98 ASP H 3.200 3.200 8.200 3.540 3.532 3.550 . 0 0 "[ . 1 . ]" 1
1457 2 97 LYS HA 2 100 GLU H 0.000 . 3.500 3.506 3.478 3.513 0.013 5 0 "[ . 1 . ]" 1
1458 2 97 LYS O 2 101 GLU H 2.200 . 2.600 2.186 2.168 2.214 . 0 0 "[ . 1 . ]" 1
1459 2 98 ASP H 2 98 ASP HA 2.700 2.700 7.700 2.812 2.810 2.813 . 0 0 "[ . 1 . ]" 1
1460 2 98 ASP H 2 99 ILE H 0.000 . 2.700 2.745 2.742 2.748 0.048 9 0 "[ . 1 . ]" 1
1461 2 98 ASP HA 2 99 ILE H 3.200 3.200 8.200 3.563 3.559 3.566 . 0 0 "[ . 1 . ]" 1
1462 2 98 ASP HA 2 101 GLU H 0.000 . 3.500 3.504 3.493 3.510 0.010 11 0 "[ . 1 . ]" 1
1463 2 98 ASP O 2 102 CYS H 2.200 . 2.600 2.112 2.089 2.130 . 0 0 "[ . 1 . ]" 1
1464 2 99 ILE H 2 99 ILE HA 2.700 2.700 7.700 2.835 2.829 2.838 . 0 0 "[ . 1 . ]" 1
1465 2 99 ILE H 2 100 GLU H 0.000 . 2.700 2.711 2.705 2.719 0.019 14 0 "[ . 1 . ]" 1
1466 2 99 ILE HA 2 100 GLU H 3.200 3.200 8.200 3.560 3.557 3.563 . 0 0 "[ . 1 . ]" 1
1467 2 99 ILE HA 2 102 CYS H 0.000 . 3.500 3.369 3.343 3.393 . 0 0 "[ . 1 . ]" 1
1468 2 99 ILE HA 2 102 CYS HB2 0.000 . 3.200 3.083 3.042 3.134 . 0 0 "[ . 1 . ]" 1
1469 2 99 ILE HA 2 102 CYS HB3 0.000 . 3.200 2.799 2.742 2.843 . 0 0 "[ . 1 . ]" 1
1470 2 99 ILE MG 2 102 CYS HB3 0.000 . 4.000 3.335 3.314 3.343 . 0 0 "[ . 1 . ]" 1
1471 2 99 ILE O 2 103 ASN H 2.200 . 2.600 2.070 2.038 2.101 . 0 0 "[ . 1 . ]" 1
1472 2 100 GLU H 2 100 GLU HA 2.700 2.700 7.700 2.821 2.818 2.824 . 0 0 "[ . 1 . ]" 1
1473 2 100 GLU H 2 101 GLU H 0.000 . 2.700 2.738 2.735 2.743 0.043 17 0 "[ . 1 . ]" 1
1474 2 100 GLU HA 2 101 GLU H 3.200 3.200 8.200 3.557 3.554 3.561 . 0 0 "[ . 1 . ]" 1
1475 2 100 GLU HA 2 103 ASN H 0.000 . 3.500 3.514 3.509 3.522 0.022 14 0 "[ . 1 . ]" 1
1476 2 100 GLU HA 2 103 ASN HB2 0.000 . 3.200 3.232 3.227 3.237 0.037 5 0 "[ . 1 . ]" 1
1477 2 100 GLU O 2 104 ALA H 2.200 . 2.600 2.140 2.129 2.157 . 0 0 "[ . 1 . ]" 1
1478 2 101 GLU H 2 101 GLU HA 2.700 2.700 7.700 2.827 2.825 2.830 . 0 0 "[ . 1 . ]" 1
1479 2 101 GLU H 2 102 CYS H 0.000 . 2.700 2.689 2.678 2.697 . 0 0 "[ . 1 . ]" 1
1480 2 101 GLU HA 2 102 CYS H 3.200 3.200 8.200 3.544 3.540 3.546 . 0 0 "[ . 1 . ]" 1
1481 2 101 GLU HA 2 104 ALA H 0.000 . 3.500 3.448 3.415 3.485 . 0 0 "[ . 1 . ]" 1
1482 2 101 GLU O 2 105 ILE H 2.200 . 2.600 2.163 2.145 2.177 . 0 0 "[ . 1 . ]" 1
1483 2 102 CYS H 2 102 CYS HA 2.700 2.700 7.700 2.811 2.809 2.812 . 0 0 "[ . 1 . ]" 1
1484 2 102 CYS H 2 103 ASN H 0.000 . 2.700 2.745 2.742 2.748 0.048 4 0 "[ . 1 . ]" 1
1485 2 102 CYS HA 2 103 ASN H 3.200 3.200 8.200 3.545 3.542 3.547 . 0 0 "[ . 1 . ]" 1
1486 2 102 CYS HA 2 105 ILE H 0.000 . 3.500 3.541 3.531 3.547 0.047 7 0 "[ . 1 . ]" 1
1487 2 102 CYS HA 2 105 ILE MD 0.000 . 3.500 1.989 1.972 2.000 . 0 0 "[ . 1 . ]" 1
1488 2 102 CYS HB2 2 105 ILE MD 0.000 . 4.800 3.971 3.930 3.996 . 0 0 "[ . 1 . ]" 1
1489 2 102 CYS O 2 106 ILE H 2.200 . 2.600 2.288 2.271 2.308 . 0 0 "[ . 1 . ]" 1
1490 2 103 ASN H 2 103 ASN HA 2.700 2.700 7.700 2.834 2.832 2.835 . 0 0 "[ . 1 . ]" 1
1491 2 103 ASN H 2 104 ALA H 0.000 . 2.700 2.631 2.623 2.635 . 0 0 "[ . 1 . ]" 1
1492 2 103 ASN HA 2 104 ALA H 3.200 3.200 8.200 3.533 3.531 3.538 . 0 0 "[ . 1 . ]" 1
1493 2 103 ASN HA 2 106 ILE H 0.000 . 3.500 3.550 3.542 3.554 0.054 14 0 "[ . 1 . ]" 1
1494 2 103 ASN O 2 107 GLU H 2.200 . 2.600 2.041 2.008 2.068 . 0 0 "[ . 1 . ]" 1
1495 2 104 ALA H 2 104 ALA HA 2.700 2.700 7.700 2.811 2.810 2.812 . 0 0 "[ . 1 . ]" 1
1496 2 104 ALA H 2 105 ILE H 0.000 . 2.700 2.728 2.725 2.731 0.031 13 0 "[ . 1 . ]" 1
1497 2 104 ALA HA 2 105 ILE H 3.200 3.200 8.200 3.559 3.556 3.561 . 0 0 "[ . 1 . ]" 1
1498 2 104 ALA HA 2 107 GLU H 0.000 . 3.500 3.532 3.528 3.534 0.034 16 0 "[ . 1 . ]" 1
1499 2 104 ALA O 2 108 GLN H 2.200 . 2.600 2.002 1.985 2.017 . 0 0 "[ . 1 . ]" 1
1500 2 105 ILE H 2 105 ILE HA 2.700 2.700 7.700 2.836 2.833 2.841 . 0 0 "[ . 1 . ]" 1
1501 2 105 ILE H 2 106 ILE H 0.000 . 2.700 2.735 2.732 2.739 0.039 14 0 "[ . 1 . ]" 1
1502 2 105 ILE HA 2 106 ILE H 3.200 3.200 8.200 3.578 3.577 3.580 . 0 0 "[ . 1 . ]" 1
1503 2 105 ILE HA 2 108 GLN H 0.000 . 3.500 3.506 3.481 3.518 0.018 8 0 "[ . 1 . ]" 1
1504 2 105 ILE O 2 109 PHE H 2.200 . 2.600 2.258 2.233 2.270 . 0 0 "[ . 1 . ]" 1
1505 2 106 ILE H 2 106 ILE HA 2.700 2.700 7.700 2.836 2.834 2.839 . 0 0 "[ . 1 . ]" 1
1506 2 106 ILE H 2 107 GLU H 0.000 . 2.700 2.726 2.717 2.733 0.033 13 0 "[ . 1 . ]" 1
1507 2 106 ILE HA 2 107 GLU H 3.200 3.200 8.200 3.558 3.554 3.560 . 0 0 "[ . 1 . ]" 1
1508 2 106 ILE HA 2 109 PHE H 0.000 . 3.500 3.526 3.520 3.530 0.030 11 0 "[ . 1 . ]" 1
1509 2 106 ILE O 2 110 ILE H 2.200 . 2.600 2.291 2.254 2.316 . 0 0 "[ . 1 . ]" 1
1510 2 107 GLU H 2 107 GLU HA 2.700 2.700 7.700 2.822 2.820 2.825 . 0 0 "[ . 1 . ]" 1
1511 2 107 GLU H 2 108 GLN H 0.000 . 2.700 2.699 2.690 2.703 0.003 4 0 "[ . 1 . ]" 1
1512 2 107 GLU HA 2 108 GLN H 3.200 3.200 8.200 3.545 3.540 3.551 . 0 0 "[ . 1 . ]" 1
1513 2 107 GLU HA 2 110 ILE H 0.000 . 3.500 3.525 3.518 3.530 0.030 7 0 "[ . 1 . ]" 1
1514 2 107 GLU O 2 111 ASP H 2.200 . 2.600 2.066 2.051 2.087 . 0 0 "[ . 1 . ]" 1
1515 2 108 GLN H 2 108 GLN HA 2.700 2.700 7.700 2.810 2.806 2.825 . 0 0 "[ . 1 . ]" 1
1516 2 108 GLN H 2 109 PHE H 0.000 . 2.700 2.718 2.713 2.721 0.021 11 0 "[ . 1 . ]" 1
1517 2 108 GLN HA 2 109 PHE H 3.200 3.200 8.200 3.553 3.542 3.565 . 0 0 "[ . 1 . ]" 1
1518 2 108 GLN HA 2 111 ASP H 0.000 . 3.500 3.492 3.464 3.510 0.010 16 0 "[ . 1 . ]" 1
1519 2 108 GLN O 2 112 TYR H 2.200 . 2.600 2.117 2.082 2.140 . 0 0 "[ . 1 . ]" 1
1520 2 109 PHE H 2 109 PHE HA 2.700 2.700 7.700 2.822 2.819 2.824 . 0 0 "[ . 1 . ]" 1
1521 2 109 PHE H 2 110 ILE H 0.000 . 2.700 2.745 2.741 2.748 0.048 10 0 "[ . 1 . ]" 1
1522 2 109 PHE HA 2 110 ILE H 3.200 3.200 8.200 3.560 3.557 3.562 . 0 0 "[ . 1 . ]" 1
1523 2 109 PHE HA 2 112 TYR H 0.000 . 3.500 3.531 3.521 3.546 0.046 17 0 "[ . 1 . ]" 1
1524 2 109 PHE O 2 113 LEU H 2.200 . 2.600 2.211 2.196 2.230 . 0 0 "[ . 1 . ]" 1
1525 2 110 ILE H 2 110 ILE HA 2.700 2.700 7.700 2.840 2.835 2.845 . 0 0 "[ . 1 . ]" 1
1526 2 110 ILE H 2 111 ASP H 0.000 . 2.700 2.665 2.634 2.694 . 0 0 "[ . 1 . ]" 1
1527 2 110 ILE HA 2 111 ASP H 3.200 3.200 8.200 3.529 3.514 3.541 . 0 0 "[ . 1 . ]" 1
1528 2 110 ILE HA 2 113 LEU H 0.000 . 3.500 3.535 3.529 3.541 0.041 3 0 "[ . 1 . ]" 1
1529 2 111 ASP H 2 111 ASP HA 2.700 2.700 7.700 2.821 2.814 2.831 . 0 0 "[ . 1 . ]" 1
1530 2 111 ASP H 2 112 TYR H 0.000 . 2.700 2.677 2.629 2.705 0.005 17 0 "[ . 1 . ]" 1
1531 2 111 ASP HA 2 112 TYR H 3.200 3.200 8.200 3.549 3.539 3.556 . 0 0 "[ . 1 . ]" 1
1532 2 112 TYR H 2 112 TYR HA 2.700 2.700 7.700 2.821 2.818 2.824 . 0 0 "[ . 1 . ]" 1
1533 2 112 TYR H 2 113 LEU H 0.000 . 2.700 2.741 2.734 2.747 0.047 14 0 "[ . 1 . ]" 1
1534 2 112 TYR HA 2 113 LEU H 3.200 3.200 8.200 3.577 3.572 3.581 . 0 0 "[ . 1 . ]" 1
1535 2 113 LEU H 2 113 LEU HA 2.700 2.700 7.700 2.887 2.849 2.943 . 0 0 "[ . 1 . ]" 1
1536 2 113 LEU H 2 114 ARG H 0.000 . 2.700 2.686 2.532 2.767 0.067 19 0 "[ . 1 . ]" 1
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