NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
518869 |
2lfr   |
17775 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lfr
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 1204
_Distance_constraint_stats_list.Viol_count 2361
_Distance_constraint_stats_list.Viol_total 4122.495
_Distance_constraint_stats_list.Viol_max 1.419
_Distance_constraint_stats_list.Viol_rms 0.0854
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0106
_Distance_constraint_stats_list.Viol_average_violations_only 0.0970
_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 5 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 6 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 7 THR 13.241 0.833 18 17 "[*********-*** ***+]"
1 8 ARG 0.135 0.024 3 0 "[ . 1 . ]"
1 9 PRO 0.186 0.018 10 0 "[ . 1 . ]"
1 10 ILE 0.038 0.018 3 0 "[ . 1 . ]"
1 11 ILE 1.164 0.374 9 0 "[ . 1 . ]"
1 12 GLU 0.748 0.052 16 0 "[ . 1 . ]"
1 13 LEU 0.742 0.043 16 0 "[ . 1 . ]"
1 14 SER 31.045 1.108 13 18 [***********-+*****]
1 15 ASN 1.407 0.052 16 0 "[ . 1 . ]"
1 16 THR 1.060 0.043 16 0 "[ . 1 . ]"
1 17 ALA 1.201 0.032 16 0 "[ . 1 . ]"
1 18 ASP 1.036 0.042 13 0 "[ . 1 . ]"
1 19 LYS 1.253 0.042 13 0 "[ . 1 . ]"
1 20 ILE 1.541 0.042 10 0 "[ . 1 . ]"
1 21 ALA 13.511 0.736 4 18 [***+***-**********]
1 22 GLU 1.400 0.077 14 0 "[ . 1 . ]"
1 23 GLY 0.896 0.077 14 0 "[ . 1 . ]"
1 24 ASN 0.244 0.030 15 0 "[ . 1 . ]"
1 25 LEU 0.086 0.027 4 0 "[ . 1 . ]"
1 26 GLU 0.048 0.019 6 0 "[ . 1 . ]"
1 27 ALA 0.038 0.027 4 0 "[ . 1 . ]"
1 28 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 29 VAL 0.296 0.038 8 0 "[ . 1 . ]"
1 30 PRO 0.166 0.024 11 0 "[ . 1 . ]"
1 31 HIS 0.579 0.039 8 0 "[ . 1 . ]"
1 32 GLN 0.296 0.038 8 0 "[ . 1 . ]"
1 33 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 34 ARG 1.242 0.065 9 0 "[ . 1 . ]"
1 35 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 37 GLU 15.224 0.836 11 17 "[-******* *+*******]"
1 38 ILE 0.867 0.065 9 0 "[ . 1 . ]"
1 39 GLY 0.053 0.011 5 0 "[ . 1 . ]"
1 40 ILE 0.162 0.017 18 0 "[ . 1 . ]"
1 41 LEU 30.634 1.095 8 18 [**-****+**********]
1 42 ALA 2.096 0.075 14 0 "[ . 1 . ]"
1 43 LYS 1.484 0.075 14 0 "[ . 1 . ]"
1 44 SER 0.869 0.035 1 0 "[ . 1 . ]"
1 45 ILE 0.678 0.035 1 0 "[ . 1 . ]"
1 46 GLU 0.696 0.039 1 0 "[ . 1 . ]"
1 47 ARG 1.188 0.043 17 0 "[ . 1 . ]"
1 48 LEU 57.274 1.419 14 18 [-************+****]
1 49 ARG 0.906 0.054 12 0 "[ . 1 . ]"
1 50 ARG 1.466 0.065 18 0 "[ . 1 . ]"
1 51 SER 1.705 0.064 11 0 "[ . 1 . ]"
1 52 LEU 1.300 0.047 1 0 "[ . 1 . ]"
1 53 LYS 1.459 0.065 18 0 "[ . 1 . ]"
1 54 GLN 1.585 0.064 11 0 "[ . 1 . ]"
1 55 LEU 0.850 0.036 5 0 "[ . 1 . ]"
1 56 ALA 1.258 0.048 18 0 "[ . 1 . ]"
1 57 ASP 0.893 0.051 14 0 "[ . 1 . ]"
1 60 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 63 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 66 VAL 0.013 0.013 16 0 "[ . 1 . ]"
1 67 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 70 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 74 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 75 THR 0.302 0.024 13 0 "[ . 1 . ]"
1 76 ARG 1.066 0.057 7 0 "[ . 1 . ]"
1 77 ILE 0.774 0.057 7 0 "[ . 1 . ]"
1 78 ARG 0.711 0.056 1 0 "[ . 1 . ]"
1 79 LEU 0.908 0.056 1 0 "[ . 1 . ]"
1 80 ALA 0.549 0.038 13 0 "[ . 1 . ]"
1 81 THR 0.373 0.038 7 0 "[ . 1 . ]"
1 82 GLU 0.031 0.015 10 0 "[ . 1 . ]"
1 83 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 84 MET 12.479 0.793 4 17 [*-*+*****1********]
1 85 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 86 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 87 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 88 ASP 0.071 0.035 6 0 "[ . 1 . ]"
1 89 GLY 0.071 0.035 6 0 "[ . 1 . ]"
1 90 TYR 0.007 0.007 16 0 "[ . 1 . ]"
1 91 LEU 13.095 0.793 4 17 [*-*+*****1********]
1 92 ALA 0.146 0.046 1 0 "[ . 1 . ]"
1 93 GLU 0.386 0.039 13 0 "[ . 1 . ]"
1 94 SER 1.200 0.067 1 0 "[ . 1 . ]"
1 95 ILE 0.194 0.046 1 0 "[ . 1 . ]"
1 96 ASN 0.831 0.039 13 0 "[ . 1 . ]"
1 97 LYS 1.288 0.045 5 0 "[ . 1 . ]"
1 98 ASP 1.213 0.070 1 0 "[ . 1 . ]"
1 99 ILE 0.912 0.070 1 0 "[ . 1 . ]"
1 102 CYS 0.000 0.000 . 0 "[ . 1 . ]"
1 105 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 106 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 109 PHE 0.028 0.007 10 0 "[ . 1 . ]"
2 5 THR 0.000 0.000 . 0 "[ . 1 . ]"
2 6 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 7 THR 13.854 0.836 11 17 "[-******* *+*******]"
2 8 ARG 0.264 0.032 9 0 "[ . 1 . ]"
2 9 PRO 0.130 0.024 15 0 "[ . 1 . ]"
2 10 ILE 0.270 0.182 12 0 "[ . 1 . ]"
2 11 ILE 1.387 0.332 16 0 "[ . 1 . ]"
2 12 GLU 0.866 0.060 10 0 "[ . 1 . ]"
2 13 LEU 0.833 0.040 15 0 "[ . 1 . ]"
2 14 SER 30.365 1.095 8 18 [**-****+**********]
2 15 ASN 1.557 0.060 10 0 "[ . 1 . ]"
2 16 THR 1.100 0.040 15 0 "[ . 1 . ]"
2 17 ALA 1.018 0.031 11 0 "[ . 1 . ]"
2 18 ASP 1.024 0.041 7 0 "[ . 1 . ]"
2 19 LYS 1.328 0.049 17 0 "[ . 1 . ]"
2 20 ILE 1.345 0.049 17 0 "[ . 1 . ]"
2 21 ALA 13.531 0.728 16 18 [-**************+**]
2 22 GLU 1.492 0.067 15 0 "[ . 1 . ]"
2 23 GLY 0.872 0.067 15 0 "[ . 1 . ]"
2 24 ASN 0.188 0.041 4 0 "[ . 1 . ]"
2 25 LEU 0.263 0.033 11 0 "[ . 1 . ]"
2 26 GLU 0.238 0.033 11 0 "[ . 1 . ]"
2 27 ALA 0.038 0.012 3 0 "[ . 1 . ]"
2 28 GLU 0.003 0.003 14 0 "[ . 1 . ]"
2 29 VAL 0.250 0.033 8 0 "[ . 1 . ]"
2 30 PRO 0.138 0.020 3 0 "[ . 1 . ]"
2 31 HIS 0.786 0.229 6 0 "[ . 1 . ]"
2 32 GLN 0.235 0.033 8 0 "[ . 1 . ]"
2 33 ASN 0.000 0.000 . 0 "[ . 1 . ]"
2 34 ARG 1.378 0.229 6 0 "[ . 1 . ]"
2 35 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 36 ASP 0.118 0.027 3 0 "[ . 1 . ]"
2 37 GLU 14.429 0.833 18 17 "[*********-*** ***+]"
2 38 ILE 0.812 0.070 6 0 "[ . 1 . ]"
2 39 GLY 0.000 0.000 . 0 "[ . 1 . ]"
2 40 ILE 0.165 0.030 14 0 "[ . 1 . ]"
2 41 LEU 31.326 1.108 13 18 [***********-+*****]
2 42 ALA 1.957 0.068 8 0 "[ . 1 . ]"
2 43 LYS 1.476 0.068 8 0 "[ . 1 . ]"
2 44 SER 1.049 0.044 10 0 "[ . 1 . ]"
2 45 ILE 0.724 0.044 10 0 "[ . 1 . ]"
2 46 GLU 0.578 0.039 16 0 "[ . 1 . ]"
2 47 ARG 1.208 0.051 5 0 "[ . 1 . ]"
2 48 LEU 57.456 1.419 14 18 [*******-*****+****]
2 49 ARG 0.826 0.053 12 0 "[ . 1 . ]"
2 50 ARG 1.259 0.053 12 0 "[ . 1 . ]"
2 51 SER 1.734 0.055 9 0 "[ . 1 . ]"
2 52 LEU 1.365 0.052 17 0 "[ . 1 . ]"
2 53 LYS 1.331 0.057 6 0 "[ . 1 . ]"
2 54 GLN 1.387 0.055 9 0 "[ . 1 . ]"
2 55 LEU 0.974 0.045 16 0 "[ . 1 . ]"
2 56 ALA 1.520 0.057 6 0 "[ . 1 . ]"
2 57 ASP 0.906 0.055 6 0 "[ . 1 . ]"
2 60 THR 0.000 0.000 . 0 "[ . 1 . ]"
2 62 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 63 MET 0.000 0.000 . 0 "[ . 1 . ]"
2 65 GLY 0.007 0.007 10 0 "[ . 1 . ]"
2 66 VAL 0.021 0.007 11 0 "[ . 1 . ]"
2 67 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 70 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
2 74 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 75 THR 0.371 0.033 3 0 "[ . 1 . ]"
2 76 ARG 1.224 0.062 13 0 "[ . 1 . ]"
2 77 ILE 0.948 0.062 13 0 "[ . 1 . ]"
2 78 ARG 0.848 0.056 7 0 "[ . 1 . ]"
2 79 LEU 0.915 0.056 7 0 "[ . 1 . ]"
2 80 ALA 0.460 0.026 13 0 "[ . 1 . ]"
2 81 THR 0.319 0.026 13 0 "[ . 1 . ]"
2 82 GLU 0.020 0.020 3 0 "[ . 1 . ]"
2 83 MET 0.000 0.000 . 0 "[ . 1 . ]"
2 84 MET 1.623 0.256 4 0 "[ . 1 . ]"
2 85 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 86 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 87 GLN 0.000 0.000 . 0 "[ . 1 . ]"
2 88 ASP 6.308 0.642 18 1 "[ . 1 . +]"
2 89 GLY 0.196 0.029 18 0 "[ . 1 . ]"
2 90 TYR 0.061 0.023 18 0 "[ . 1 . ]"
2 91 LEU 8.121 0.642 18 1 "[ . 1 . +]"
2 92 ALA 0.326 0.048 10 0 "[ . 1 . ]"
2 93 GLU 0.385 0.034 8 0 "[ . 1 . ]"
2 94 SER 1.034 0.052 18 0 "[ . 1 . ]"
2 95 ILE 0.509 0.048 10 0 "[ . 1 . ]"
2 96 ASN 0.821 0.046 2 0 "[ . 1 . ]"
2 97 LYS 1.192 0.050 7 0 "[ . 1 . ]"
2 98 ASP 1.110 0.066 17 0 "[ . 1 . ]"
2 99 ILE 0.881 0.066 17 0 "[ . 1 . ]"
2 102 CYS 0.000 0.000 . 0 "[ . 1 . ]"
2 105 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 106 ILE 0.008 0.006 7 0 "[ . 1 . ]"
2 109 PHE 0.022 0.013 16 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 H 1 6 ILE HA 2.700 2.700 7.700 2.849 2.837 2.871 . 0 0 "[ . 1 . ]" 1
2 1 6 ILE H 1 6 ILE QG 0.000 . 4.000 2.005 1.998 2.053 . 0 0 "[ . 1 . ]" 1
3 1 6 ILE H 1 6 ILE MG 0.000 . 4.800 3.770 3.764 3.779 . 0 0 "[ . 1 . ]" 1
4 1 7 THR H 1 7 THR HA 2.700 2.700 7.700 2.827 2.817 2.838 . 0 0 "[ . 1 . ]" 1
5 1 8 ARG H 1 8 ARG QB 0.000 . 3.500 2.374 2.219 2.461 . 0 0 "[ . 1 . ]" 1
6 1 8 ARG H 1 8 ARG HA 2.700 2.700 7.700 2.796 2.789 2.822 . 0 0 "[ . 1 . ]" 1
7 1 10 ILE HA 1 10 ILE MG 0.000 . 3.500 2.287 2.235 2.353 . 0 0 "[ . 1 . ]" 1
8 1 10 ILE H 1 10 ILE HB 0.000 . 2.700 2.599 2.540 2.643 . 0 0 "[ . 1 . ]" 1
9 1 10 ILE H 1 10 ILE HA 2.700 2.700 7.700 2.849 2.840 2.861 . 0 0 "[ . 1 . ]" 1
10 1 10 ILE H 1 10 ILE MD 0.000 . 4.000 3.062 2.989 3.123 . 0 0 "[ . 1 . ]" 1
11 1 10 ILE H 1 10 ILE QG 0.000 . 4.000 2.007 2.000 2.010 . 0 0 "[ . 1 . ]" 1
12 1 11 ILE H 1 11 ILE QG 0.000 . 4.000 2.008 2.005 2.016 . 0 0 "[ . 1 . ]" 1
13 1 11 ILE H 1 11 ILE HA 2.700 2.700 7.700 2.839 2.833 2.844 . 0 0 "[ . 1 . ]" 1
14 1 11 ILE H 1 11 ILE MD 0.000 . 4.800 3.083 3.024 3.153 . 0 0 "[ . 1 . ]" 1
15 1 11 ILE HA 1 11 ILE MG 0.000 . 3.500 2.362 2.323 2.404 . 0 0 "[ . 1 . ]" 1
16 1 11 ILE H 1 11 ILE HB 0.000 . 2.700 2.598 2.556 2.632 . 0 0 "[ . 1 . ]" 1
17 1 12 GLU H 1 12 GLU HB2 0.000 . 3.200 2.309 2.198 2.391 . 0 0 "[ . 1 . ]" 1
18 1 12 GLU H 1 12 GLU HA 2.700 2.700 7.700 2.825 2.823 2.827 . 0 0 "[ . 1 . ]" 1
19 1 13 LEU H 1 13 LEU MD1 0.000 . 4.000 3.295 3.147 3.337 . 0 0 "[ . 1 . ]" 1
20 1 13 LEU H 1 13 LEU HA 2.700 2.700 7.700 2.834 2.831 2.842 . 0 0 "[ . 1 . ]" 1
21 1 14 SER H 1 14 SER HA 2.700 2.700 7.700 2.816 2.811 2.819 . 0 0 "[ . 1 . ]" 1
22 1 15 ASN H 1 15 ASN HA 2.700 2.700 7.700 2.823 2.817 2.825 . 0 0 "[ . 1 . ]" 1
23 1 16 THR H 1 16 THR HB 0.000 . 2.700 2.683 2.624 2.712 0.012 4 0 "[ . 1 . ]" 1
24 1 16 THR H 1 16 THR HA 2.700 2.700 7.700 2.821 2.814 2.826 . 0 0 "[ . 1 . ]" 1
25 1 17 ALA H 1 17 ALA HA 2.700 2.700 7.700 2.816 2.811 2.821 . 0 0 "[ . 1 . ]" 1
26 1 18 ASP H 1 18 ASP HA 2.700 2.700 7.700 2.816 2.813 2.822 . 0 0 "[ . 1 . ]" 1
27 1 19 LYS H 1 19 LYS HA 2.700 2.700 7.700 2.811 2.807 2.818 . 0 0 "[ . 1 . ]" 1
28 1 20 ILE H 1 20 ILE HA 2.700 2.700 7.700 2.835 2.829 2.839 . 0 0 "[ . 1 . ]" 1
29 1 20 ILE H 1 20 ILE HB 0.000 . 3.200 2.541 2.499 2.565 . 0 0 "[ . 1 . ]" 1
30 1 21 ALA H 1 21 ALA HA 2.700 2.700 7.700 2.812 2.806 2.818 . 0 0 "[ . 1 . ]" 1
31 1 22 GLU H 1 22 GLU HA 2.700 2.700 7.700 2.866 2.860 2.876 . 0 0 "[ . 1 . ]" 1
32 1 23 GLY H 1 23 GLY HA2 0.000 . 2.700 2.447 2.413 2.484 . 0 0 "[ . 1 . ]" 1
33 1 23 GLY H 1 23 GLY HA3 2.700 2.700 7.700 2.960 2.951 2.965 . 0 0 "[ . 1 . ]" 1
34 1 24 ASN HB2 1 24 ASN HD21 0.000 . 2.700 2.321 2.247 2.701 0.001 11 0 "[ . 1 . ]" 1
35 1 24 ASN H 1 24 ASN HA 2.700 2.700 7.700 2.931 2.916 2.943 . 0 0 "[ . 1 . ]" 1
36 1 25 LEU H 1 25 LEU HG 0.000 . 2.700 2.012 2.003 2.016 . 0 0 "[ . 1 . ]" 1
37 1 25 LEU H 1 25 LEU HB2 0.000 . 3.200 2.638 2.583 2.682 . 0 0 "[ . 1 . ]" 1
38 1 25 LEU H 1 25 LEU MD2 0.000 . 4.800 3.016 2.918 3.124 . 0 0 "[ . 1 . ]" 1
39 1 25 LEU H 1 25 LEU HA 2.700 2.700 7.700 2.838 2.826 2.847 . 0 0 "[ . 1 . ]" 1
40 1 26 GLU H 1 26 GLU HB2 0.000 . 3.200 2.362 2.249 2.513 . 0 0 "[ . 1 . ]" 1
41 1 26 GLU H 1 26 GLU HA 2.700 2.700 7.700 2.908 2.907 2.910 . 0 0 "[ . 1 . ]" 1
42 1 26 GLU H 1 26 GLU HB3 0.000 . 4.000 3.595 3.536 3.639 . 0 0 "[ . 1 . ]" 1
43 1 26 GLU H 1 26 GLU QG 0.000 . 4.000 2.652 2.317 3.231 . 0 0 "[ . 1 . ]" 1
44 1 27 ALA H 1 27 ALA HA 2.700 2.700 7.700 2.812 2.808 2.817 . 0 0 "[ . 1 . ]" 1
45 1 28 GLU H 1 28 GLU QG 0.000 . 4.000 2.244 2.020 2.716 . 0 0 "[ . 1 . ]" 1
46 1 28 GLU H 1 28 GLU HA 2.700 2.700 7.700 2.857 2.846 2.881 . 0 0 "[ . 1 . ]" 1
47 1 29 VAL H 1 29 VAL HA 2.700 2.700 7.700 2.893 2.876 2.905 . 0 0 "[ . 1 . ]" 1
48 1 29 VAL H 1 29 VAL HB 0.000 . 3.200 2.574 2.548 2.616 . 0 0 "[ . 1 . ]" 1
49 1 29 VAL H 1 29 VAL MG2 0.000 . 3.500 2.123 2.061 2.247 . 0 0 "[ . 1 . ]" 1
50 1 31 HIS HB2 1 31 HIS HD2 0.000 . 3.200 2.743 2.734 2.751 . 0 0 "[ . 1 . ]" 1
51 1 31 HIS H 1 31 HIS HA 0.000 . 2.700 2.294 2.288 2.301 . 0 0 "[ . 1 . ]" 1
52 1 32 GLN HB3 1 32 GLN HE21 3.200 3.200 8.200 3.941 3.682 4.172 . 0 0 "[ . 1 . ]" 1
53 1 32 GLN H 1 32 GLN QG 0.000 . 3.500 2.564 2.274 2.753 . 0 0 "[ . 1 . ]" 1
54 1 32 GLN H 1 32 GLN HA 2.700 2.700 7.700 2.846 2.836 2.856 . 0 0 "[ . 1 . ]" 1
55 1 33 ASN H 1 33 ASN HA 2.700 2.700 7.700 2.891 2.888 2.917 . 0 0 "[ . 1 . ]" 1
56 1 34 ARG H 1 34 ARG QG 0.000 . 3.500 2.419 2.351 2.649 . 0 0 "[ . 1 . ]" 1
57 1 34 ARG H 1 34 ARG HA 2.700 2.700 7.700 2.832 2.830 2.838 . 0 0 "[ . 1 . ]" 1
58 1 34 ARG HB2 1 34 ARG HE 3.200 3.200 8.200 3.682 3.608 3.734 . 0 0 "[ . 1 . ]" 1
59 1 34 ARG HB3 1 34 ARG HE 0.000 . 3.200 2.432 2.359 2.540 . 0 0 "[ . 1 . ]" 1
60 1 36 ASP H 1 36 ASP HA 2.700 2.700 7.700 2.893 2.888 2.916 . 0 0 "[ . 1 . ]" 1
61 1 37 GLU H 1 37 GLU HA 2.700 2.700 7.700 2.766 2.756 2.775 . 0 0 "[ . 1 . ]" 1
62 1 38 ILE H 1 38 ILE HA 2.700 2.700 7.700 2.888 2.886 2.890 . 0 0 "[ . 1 . ]" 1
63 1 38 ILE H 1 38 ILE QG 0.000 . 4.000 2.062 2.028 2.088 . 0 0 "[ . 1 . ]" 1
64 1 39 GLY H 1 39 GLY HA2 2.700 2.700 7.700 2.832 2.825 2.838 . 0 0 "[ . 1 . ]" 1
65 1 39 GLY H 1 39 GLY HA3 0.000 . 2.700 2.307 2.298 2.312 . 0 0 "[ . 1 . ]" 1
66 1 40 ILE H 1 40 ILE HA 2.700 2.700 7.700 2.836 2.832 2.842 . 0 0 "[ . 1 . ]" 1
67 1 40 ILE H 1 40 ILE QG 0.000 . 3.500 1.997 1.991 2.002 . 0 0 "[ . 1 . ]" 1
68 1 41 LEU H 1 41 LEU HA 2.700 2.700 7.700 2.812 2.809 2.817 . 0 0 "[ . 1 . ]" 1
69 1 41 LEU H 1 41 LEU QD 0.000 . 4.800 3.671 3.660 3.679 . 0 0 "[ . 1 . ]" 1
70 1 42 ALA H 1 42 ALA HA 2.700 2.700 7.700 2.803 2.800 2.806 . 0 0 "[ . 1 . ]" 1
71 1 43 LYS H 1 43 LYS HA 2.700 2.700 7.700 2.816 2.813 2.821 . 0 0 "[ . 1 . ]" 1
72 1 44 SER H 1 44 SER HA 2.700 2.700 7.700 2.821 2.818 2.823 . 0 0 "[ . 1 . ]" 1
73 1 45 ILE H 1 45 ILE HA 2.700 2.700 7.700 2.833 2.826 2.841 . 0 0 "[ . 1 . ]" 1
74 1 45 ILE H 1 45 ILE QG 0.000 . 3.500 1.998 1.994 2.003 . 0 0 "[ . 1 . ]" 1
75 1 46 GLU H 1 46 GLU HA 2.700 2.700 7.700 2.817 2.814 2.822 . 0 0 "[ . 1 . ]" 1
76 1 47 ARG H 1 47 ARG HA 2.700 2.700 7.700 2.814 2.809 2.818 . 0 0 "[ . 1 . ]" 1
77 1 48 LEU H 1 48 LEU QD 0.000 . 4.800 2.990 2.947 3.047 . 0 0 "[ . 1 . ]" 1
78 1 48 LEU H 1 48 LEU HG 0.000 . 3.200 2.055 2.015 2.218 . 0 0 "[ . 1 . ]" 1
79 1 48 LEU H 1 48 LEU HA 2.700 2.700 7.700 2.826 2.822 2.830 . 0 0 "[ . 1 . ]" 1
80 1 49 ARG HB2 1 49 ARG HD3 0.000 . 2.700 2.153 2.095 2.207 . 0 0 "[ . 1 . ]" 1
81 1 49 ARG HB3 1 49 ARG HE 0.000 . 2.700 2.563 2.457 2.677 . 0 0 "[ . 1 . ]" 1
82 1 49 ARG HB2 1 49 ARG HE 2.700 2.700 4.000 2.945 2.838 3.043 . 0 0 "[ . 1 . ]" 1
83 1 49 ARG H 1 49 ARG HA 2.700 2.700 7.700 2.806 2.799 2.812 . 0 0 "[ . 1 . ]" 1
84 1 50 ARG H 1 50 ARG HA 2.700 2.700 7.700 2.817 2.813 2.822 . 0 0 "[ . 1 . ]" 1
85 1 51 SER H 1 51 SER HA 2.700 2.700 7.700 2.820 2.816 2.825 . 0 0 "[ . 1 . ]" 1
86 1 52 LEU H 1 52 LEU HA 2.700 2.700 7.700 2.831 2.829 2.835 . 0 0 "[ . 1 . ]" 1
87 1 53 LYS H 1 53 LYS HA 2.700 2.700 7.700 2.818 2.810 2.828 . 0 0 "[ . 1 . ]" 1
88 1 54 GLN H 1 54 GLN HA 2.700 2.700 7.700 2.827 2.822 2.844 . 0 0 "[ . 1 . ]" 1
89 1 55 LEU H 1 55 LEU HA 2.700 2.700 7.700 2.815 2.810 2.821 . 0 0 "[ . 1 . ]" 1
90 1 56 ALA H 1 56 ALA HA 2.700 2.700 7.700 2.831 2.825 2.837 . 0 0 "[ . 1 . ]" 1
91 1 57 ASP H 1 57 ASP HA 2.700 2.700 7.700 2.802 2.783 2.811 . 0 0 "[ . 1 . ]" 1
92 1 76 ARG H 1 76 ARG HA 2.700 2.700 7.700 2.817 2.813 2.823 . 0 0 "[ . 1 . ]" 1
93 1 77 ILE H 1 77 ILE HA 2.700 2.700 7.700 2.837 2.831 2.844 . 0 0 "[ . 1 . ]" 1
94 1 78 ARG H 1 78 ARG HA 2.700 2.700 7.700 2.812 2.805 2.817 . 0 0 "[ . 1 . ]" 1
95 1 79 LEU H 1 79 LEU HA 2.700 2.700 7.700 2.832 2.821 2.847 . 0 0 "[ . 1 . ]" 1
96 1 80 ALA H 1 80 ALA HA 2.700 2.700 7.700 2.818 2.810 2.825 . 0 0 "[ . 1 . ]" 1
97 1 81 THR H 1 81 THR HA 2.700 2.700 7.700 2.822 2.813 2.835 . 0 0 "[ . 1 . ]" 1
98 1 82 GLU H 1 82 GLU HA 2.700 2.700 7.700 2.858 2.829 2.878 . 0 0 "[ . 1 . ]" 1
99 1 83 MET H 1 83 MET HA 2.700 2.700 7.700 2.888 2.884 2.892 . 0 0 "[ . 1 . ]" 1
100 1 84 MET H 1 84 MET HA 2.700 2.700 7.700 2.795 2.788 2.805 . 0 0 "[ . 1 . ]" 1
101 1 88 ASP H 1 88 ASP HA 2.700 2.700 7.700 2.964 2.945 2.970 . 0 0 "[ . 1 . ]" 1
102 1 89 GLY H 1 89 GLY HA2 2.700 2.700 7.700 2.831 2.822 2.834 . 0 0 "[ . 1 . ]" 1
103 1 89 GLY H 1 89 GLY HA3 0.000 . 2.700 2.293 2.289 2.298 . 0 0 "[ . 1 . ]" 1
104 1 90 TYR H 1 90 TYR HA 2.700 2.700 7.700 2.823 2.814 2.840 . 0 0 "[ . 1 . ]" 1
105 1 91 LEU H 1 91 LEU HA 2.700 2.700 7.700 2.870 2.844 2.892 . 0 0 "[ . 1 . ]" 1
106 1 92 ALA H 1 92 ALA HA 2.700 2.700 7.700 2.832 2.823 2.843 . 0 0 "[ . 1 . ]" 1
107 1 93 GLU H 1 93 GLU HA 2.700 2.700 7.700 2.820 2.817 2.824 . 0 0 "[ . 1 . ]" 1
108 1 94 SER H 1 94 SER HA 2.700 2.700 7.700 2.839 2.834 2.845 . 0 0 "[ . 1 . ]" 1
109 1 95 ILE H 1 95 ILE HA 2.700 2.700 7.700 2.838 2.829 2.844 . 0 0 "[ . 1 . ]" 1
110 1 96 ASN H 1 96 ASN HA 2.700 2.700 7.700 2.819 2.815 2.825 . 0 0 "[ . 1 . ]" 1
111 1 97 LYS H 1 97 LYS HA 2.700 2.700 7.700 2.815 2.806 2.820 . 0 0 "[ . 1 . ]" 1
112 1 98 ASP H 1 98 ASP HA 2.700 2.700 7.700 2.820 2.813 2.825 . 0 0 "[ . 1 . ]" 1
113 2 6 ILE H 2 6 ILE HA 2.700 2.700 7.700 2.840 2.832 2.849 . 0 0 "[ . 1 . ]" 1
114 2 6 ILE H 2 6 ILE QG 0.000 . 4.000 1.999 1.995 2.005 . 0 0 "[ . 1 . ]" 1
115 2 6 ILE H 2 6 ILE MG 0.000 . 4.800 3.771 3.767 3.775 . 0 0 "[ . 1 . ]" 1
116 2 7 THR H 2 7 THR HA 2.700 2.700 7.700 2.827 2.810 2.840 . 0 0 "[ . 1 . ]" 1
117 2 8 ARG H 2 8 ARG QB 0.000 . 3.500 2.327 2.247 2.478 . 0 0 "[ . 1 . ]" 1
118 2 8 ARG H 2 8 ARG HA 2.700 2.700 7.700 2.806 2.795 2.841 . 0 0 "[ . 1 . ]" 1
119 2 10 ILE HA 2 10 ILE MG 0.000 . 3.500 2.276 2.235 2.327 . 0 0 "[ . 1 . ]" 1
120 2 10 ILE H 2 10 ILE HB 0.000 . 2.700 2.599 2.564 2.652 . 0 0 "[ . 1 . ]" 1
121 2 10 ILE H 2 10 ILE HA 2.700 2.700 7.700 2.846 2.839 2.853 . 0 0 "[ . 1 . ]" 1
122 2 10 ILE H 2 10 ILE MD 0.000 . 4.000 3.066 2.964 3.181 . 0 0 "[ . 1 . ]" 1
123 2 10 ILE H 2 10 ILE QG 0.000 . 4.000 2.006 2.000 2.010 . 0 0 "[ . 1 . ]" 1
124 2 11 ILE H 2 11 ILE QG 0.000 . 4.000 2.016 2.001 2.145 . 0 0 "[ . 1 . ]" 1
125 2 11 ILE H 2 11 ILE HA 2.700 2.700 7.700 2.836 2.828 2.842 . 0 0 "[ . 1 . ]" 1
126 2 11 ILE H 2 11 ILE MD 0.000 . 4.800 3.107 3.003 3.324 . 0 0 "[ . 1 . ]" 1
127 2 11 ILE HA 2 11 ILE MG 0.000 . 3.500 2.361 2.267 2.463 . 0 0 "[ . 1 . ]" 1
128 2 11 ILE H 2 11 ILE HB 0.000 . 2.700 2.576 2.474 2.636 . 0 0 "[ . 1 . ]" 1
129 2 12 GLU H 2 12 GLU HB2 0.000 . 3.200 2.341 2.230 2.495 . 0 0 "[ . 1 . ]" 1
130 2 12 GLU H 2 12 GLU HA 2.700 2.700 7.700 2.825 2.824 2.830 . 0 0 "[ . 1 . ]" 1
131 2 13 LEU H 2 13 LEU MD1 0.000 . 4.000 3.276 3.121 3.350 . 0 0 "[ . 1 . ]" 1
132 2 13 LEU H 2 13 LEU HA 2.700 2.700 7.700 2.831 2.829 2.836 . 0 0 "[ . 1 . ]" 1
133 2 14 SER H 2 14 SER HA 2.700 2.700 7.700 2.817 2.808 2.822 . 0 0 "[ . 1 . ]" 1
134 2 15 ASN H 2 15 ASN HA 2.700 2.700 7.700 2.823 2.820 2.828 . 0 0 "[ . 1 . ]" 1
135 2 16 THR H 2 16 THR HB 0.000 . 2.700 2.677 2.627 2.722 0.022 18 0 "[ . 1 . ]" 1
136 2 16 THR H 2 16 THR HA 2.700 2.700 7.700 2.821 2.815 2.825 . 0 0 "[ . 1 . ]" 1
137 2 17 ALA H 2 17 ALA HA 2.700 2.700 7.700 2.815 2.811 2.821 . 0 0 "[ . 1 . ]" 1
138 2 18 ASP H 2 18 ASP HA 2.700 2.700 7.700 2.816 2.812 2.822 . 0 0 "[ . 1 . ]" 1
139 2 19 LYS H 2 19 LYS HA 2.700 2.700 7.700 2.812 2.808 2.818 . 0 0 "[ . 1 . ]" 1
140 2 20 ILE H 2 20 ILE HA 2.700 2.700 7.700 2.836 2.830 2.842 . 0 0 "[ . 1 . ]" 1
141 2 20 ILE H 2 20 ILE HB 0.000 . 3.200 2.549 2.521 2.572 . 0 0 "[ . 1 . ]" 1
142 2 21 ALA H 2 21 ALA HA 2.700 2.700 7.700 2.810 2.806 2.815 . 0 0 "[ . 1 . ]" 1
143 2 22 GLU H 2 22 GLU HA 2.700 2.700 7.700 2.870 2.864 2.880 . 0 0 "[ . 1 . ]" 1
144 2 23 GLY H 2 23 GLY HA2 0.000 . 2.700 2.398 2.388 2.405 . 0 0 "[ . 1 . ]" 1
145 2 23 GLY H 2 23 GLY HA3 2.700 2.700 7.700 2.947 2.942 2.951 . 0 0 "[ . 1 . ]" 1
146 2 24 ASN HB2 2 24 ASN HD21 0.000 . 2.700 2.331 2.246 2.637 . 0 0 "[ . 1 . ]" 1
147 2 24 ASN H 2 24 ASN HA 2.700 2.700 7.700 2.941 2.924 2.954 . 0 0 "[ . 1 . ]" 1
148 2 25 LEU H 2 25 LEU HG 0.000 . 2.700 2.019 2.012 2.075 . 0 0 "[ . 1 . ]" 1
149 2 25 LEU H 2 25 LEU HB2 0.000 . 3.200 2.599 2.517 2.691 . 0 0 "[ . 1 . ]" 1
150 2 25 LEU H 2 25 LEU MD2 0.000 . 4.800 3.092 2.872 3.240 . 0 0 "[ . 1 . ]" 1
151 2 25 LEU H 2 25 LEU HA 2.700 2.700 7.700 2.829 2.812 2.846 . 0 0 "[ . 1 . ]" 1
152 2 26 GLU H 2 26 GLU HB2 0.000 . 3.200 2.348 2.236 2.450 . 0 0 "[ . 1 . ]" 1
153 2 26 GLU H 2 26 GLU HA 2.700 2.700 7.700 2.910 2.907 2.912 . 0 0 "[ . 1 . ]" 1
154 2 26 GLU H 2 26 GLU HB3 0.000 . 4.000 3.592 3.524 3.630 . 0 0 "[ . 1 . ]" 1
155 2 26 GLU H 2 26 GLU QG 0.000 . 4.000 2.717 2.391 3.501 . 0 0 "[ . 1 . ]" 1
156 2 27 ALA H 2 27 ALA HA 2.700 2.700 7.700 2.812 2.810 2.815 . 0 0 "[ . 1 . ]" 1
157 2 28 GLU H 2 28 GLU QG 0.000 . 4.000 2.263 2.040 2.688 . 0 0 "[ . 1 . ]" 1
158 2 28 GLU H 2 28 GLU HA 2.700 2.700 7.700 2.868 2.848 2.895 . 0 0 "[ . 1 . ]" 1
159 2 29 VAL H 2 29 VAL HA 2.700 2.700 7.700 2.896 2.882 2.904 . 0 0 "[ . 1 . ]" 1
160 2 29 VAL H 2 29 VAL HB 0.000 . 3.200 2.581 2.545 2.618 . 0 0 "[ . 1 . ]" 1
161 2 29 VAL H 2 29 VAL MG2 0.000 . 3.500 2.121 2.076 2.208 . 0 0 "[ . 1 . ]" 1
162 2 31 HIS HB2 2 31 HIS HD2 0.000 . 3.200 2.743 2.734 2.761 . 0 0 "[ . 1 . ]" 1
163 2 31 HIS H 2 31 HIS HA 0.000 . 2.700 2.291 2.284 2.295 . 0 0 "[ . 1 . ]" 1
164 2 32 GLN HB3 2 32 GLN HE21 3.200 3.200 8.200 3.988 3.676 4.229 . 0 0 "[ . 1 . ]" 1
165 2 32 GLN H 2 32 GLN QG 0.000 . 3.500 2.565 2.351 2.764 . 0 0 "[ . 1 . ]" 1
166 2 32 GLN H 2 32 GLN HA 2.700 2.700 7.700 2.841 2.832 2.850 . 0 0 "[ . 1 . ]" 1
167 2 33 ASN H 2 33 ASN HA 2.700 2.700 7.700 2.888 2.885 2.892 . 0 0 "[ . 1 . ]" 1
168 2 34 ARG H 2 34 ARG QG 0.000 . 3.500 2.442 2.203 2.643 . 0 0 "[ . 1 . ]" 1
169 2 34 ARG H 2 34 ARG HA 2.700 2.700 7.700 2.834 2.832 2.846 . 0 0 "[ . 1 . ]" 1
170 2 34 ARG HB2 2 34 ARG HE 3.200 3.200 8.200 3.697 3.549 3.893 . 0 0 "[ . 1 . ]" 1
171 2 34 ARG HB3 2 34 ARG HE 0.000 . 3.200 2.450 2.255 2.671 . 0 0 "[ . 1 . ]" 1
172 2 36 ASP H 2 36 ASP HA 2.700 2.700 7.700 2.895 2.886 2.922 . 0 0 "[ . 1 . ]" 1
173 2 37 GLU H 2 37 GLU HA 2.700 2.700 7.700 2.768 2.752 2.782 . 0 0 "[ . 1 . ]" 1
174 2 38 ILE H 2 38 ILE HA 2.700 2.700 7.700 2.887 2.885 2.890 . 0 0 "[ . 1 . ]" 1
175 2 38 ILE H 2 38 ILE QG 0.000 . 4.000 2.064 2.036 2.152 . 0 0 "[ . 1 . ]" 1
176 2 39 GLY H 2 39 GLY HA2 2.700 2.700 7.700 2.839 2.833 2.841 . 0 0 "[ . 1 . ]" 1
177 2 39 GLY H 2 39 GLY HA3 0.000 . 2.700 2.322 2.315 2.329 . 0 0 "[ . 1 . ]" 1
178 2 40 ILE H 2 40 ILE HA 2.700 2.700 7.700 2.840 2.836 2.846 . 0 0 "[ . 1 . ]" 1
179 2 40 ILE H 2 40 ILE QG 0.000 . 3.500 1.999 1.992 2.005 . 0 0 "[ . 1 . ]" 1
180 2 41 LEU H 2 41 LEU HA 2.700 2.700 7.700 2.806 2.801 2.811 . 0 0 "[ . 1 . ]" 1
181 2 41 LEU H 2 41 LEU QD 0.000 . 4.800 3.675 3.666 3.687 . 0 0 "[ . 1 . ]" 1
182 2 42 ALA H 2 42 ALA HA 2.700 2.700 7.700 2.803 2.801 2.806 . 0 0 "[ . 1 . ]" 1
183 2 43 LYS H 2 43 LYS HA 2.700 2.700 7.700 2.814 2.810 2.821 . 0 0 "[ . 1 . ]" 1
184 2 44 SER H 2 44 SER HA 2.700 2.700 7.700 2.823 2.819 2.845 . 0 0 "[ . 1 . ]" 1
185 2 45 ILE H 2 45 ILE HA 2.700 2.700 7.700 2.831 2.826 2.835 . 0 0 "[ . 1 . ]" 1
186 2 45 ILE H 2 45 ILE QG 0.000 . 3.500 2.003 1.994 2.062 . 0 0 "[ . 1 . ]" 1
187 2 46 GLU H 2 46 GLU HA 2.700 2.700 7.700 2.818 2.815 2.822 . 0 0 "[ . 1 . ]" 1
188 2 47 ARG H 2 47 ARG HA 2.700 2.700 7.700 2.814 2.809 2.819 . 0 0 "[ . 1 . ]" 1
189 2 48 LEU H 2 48 LEU QD 0.000 . 4.800 2.999 2.920 3.102 . 0 0 "[ . 1 . ]" 1
190 2 48 LEU H 2 48 LEU HG 0.000 . 3.200 2.094 2.010 2.279 . 0 0 "[ . 1 . ]" 1
191 2 48 LEU H 2 48 LEU HA 2.700 2.700 7.700 2.826 2.822 2.832 . 0 0 "[ . 1 . ]" 1
192 2 49 ARG HB2 2 49 ARG HD3 0.000 . 2.700 2.142 2.111 2.197 . 0 0 "[ . 1 . ]" 1
193 2 49 ARG HB3 2 49 ARG HE 0.000 . 2.700 2.580 2.505 2.650 . 0 0 "[ . 1 . ]" 1
194 2 49 ARG HB2 2 49 ARG HE 2.700 2.700 4.000 2.971 2.871 3.050 . 0 0 "[ . 1 . ]" 1
195 2 49 ARG H 2 49 ARG HA 2.700 2.700 7.700 2.808 2.800 2.812 . 0 0 "[ . 1 . ]" 1
196 2 50 ARG H 2 50 ARG HA 2.700 2.700 7.700 2.816 2.813 2.825 . 0 0 "[ . 1 . ]" 1
197 2 51 SER H 2 51 SER HA 2.700 2.700 7.700 2.819 2.814 2.825 . 0 0 "[ . 1 . ]" 1
198 2 52 LEU H 2 52 LEU HA 2.700 2.700 7.700 2.833 2.830 2.837 . 0 0 "[ . 1 . ]" 1
199 2 53 LYS H 2 53 LYS HA 2.700 2.700 7.700 2.819 2.812 2.827 . 0 0 "[ . 1 . ]" 1
200 2 54 GLN H 2 54 GLN HA 2.700 2.700 7.700 2.825 2.815 2.835 . 0 0 "[ . 1 . ]" 1
201 2 55 LEU H 2 55 LEU HA 2.700 2.700 7.700 2.815 2.810 2.822 . 0 0 "[ . 1 . ]" 1
202 2 56 ALA H 2 56 ALA HA 2.700 2.700 7.700 2.831 2.824 2.836 . 0 0 "[ . 1 . ]" 1
203 2 57 ASP H 2 57 ASP HA 2.700 2.700 7.700 2.804 2.791 2.816 . 0 0 "[ . 1 . ]" 1
204 2 76 ARG H 2 76 ARG HA 2.700 2.700 7.700 2.816 2.811 2.823 . 0 0 "[ . 1 . ]" 1
205 2 77 ILE H 2 77 ILE HA 2.700 2.700 7.700 2.837 2.829 2.848 . 0 0 "[ . 1 . ]" 1
206 2 78 ARG H 2 78 ARG HA 2.700 2.700 7.700 2.815 2.809 2.823 . 0 0 "[ . 1 . ]" 1
207 2 79 LEU H 2 79 LEU HA 2.700 2.700 7.700 2.834 2.824 2.853 . 0 0 "[ . 1 . ]" 1
208 2 80 ALA H 2 80 ALA HA 2.700 2.700 7.700 2.813 2.807 2.824 . 0 0 "[ . 1 . ]" 1
209 2 81 THR H 2 81 THR HA 2.700 2.700 7.700 2.838 2.816 2.863 . 0 0 "[ . 1 . ]" 1
210 2 82 GLU H 2 82 GLU HA 2.700 2.700 7.700 2.839 2.823 2.865 . 0 0 "[ . 1 . ]" 1
211 2 83 MET H 2 83 MET HA 2.700 2.700 7.700 2.889 2.886 2.899 . 0 0 "[ . 1 . ]" 1
212 2 84 MET H 2 84 MET HA 2.700 2.700 7.700 2.804 2.796 2.827 . 0 0 "[ . 1 . ]" 1
213 2 88 ASP H 2 88 ASP HA 2.700 2.700 7.700 2.958 2.946 2.965 . 0 0 "[ . 1 . ]" 1
214 2 89 GLY H 2 89 GLY HA2 2.700 2.700 7.700 2.832 2.827 2.835 . 0 0 "[ . 1 . ]" 1
215 2 89 GLY H 2 89 GLY HA3 0.000 . 2.700 2.295 2.289 2.298 . 0 0 "[ . 1 . ]" 1
216 2 90 TYR H 2 90 TYR HA 2.700 2.700 7.700 2.828 2.814 2.868 . 0 0 "[ . 1 . ]" 1
217 2 91 LEU H 2 91 LEU HA 2.700 2.700 7.700 2.900 2.891 2.910 . 0 0 "[ . 1 . ]" 1
218 2 92 ALA H 2 92 ALA HA 2.700 2.700 7.700 2.838 2.830 2.854 . 0 0 "[ . 1 . ]" 1
219 2 93 GLU H 2 93 GLU HA 2.700 2.700 7.700 2.823 2.817 2.831 . 0 0 "[ . 1 . ]" 1
220 2 94 SER H 2 94 SER HA 2.700 2.700 7.700 2.838 2.832 2.845 . 0 0 "[ . 1 . ]" 1
221 2 95 ILE H 2 95 ILE HA 2.700 2.700 7.700 2.838 2.832 2.843 . 0 0 "[ . 1 . ]" 1
222 2 96 ASN H 2 96 ASN HA 2.700 2.700 7.700 2.816 2.808 2.823 . 0 0 "[ . 1 . ]" 1
223 2 97 LYS H 2 97 LYS HA 2.700 2.700 7.700 2.816 2.810 2.823 . 0 0 "[ . 1 . ]" 1
224 2 98 ASP H 2 98 ASP HA 2.700 2.700 7.700 2.819 2.814 2.825 . 0 0 "[ . 1 . ]" 1
225 1 6 ILE H 1 7 THR H 0.000 . 2.700 2.579 2.532 2.623 . 0 0 "[ . 1 . ]" 1
226 1 5 THR HA 1 6 ILE H 3.200 3.200 8.200 3.540 3.511 3.553 . 0 0 "[ . 1 . ]" 1
227 1 6 ILE HA 1 7 THR H 3.200 3.200 8.200 3.516 3.487 3.521 . 0 0 "[ . 1 . ]" 1
228 1 6 ILE HB 1 7 THR H 0.000 . 4.000 2.869 2.794 3.216 . 0 0 "[ . 1 . ]" 1
229 1 7 THR H 1 8 ARG H 0.000 . 2.700 2.664 2.626 2.709 0.009 14 0 "[ . 1 . ]" 1
230 1 7 THR HA 1 8 ARG H 3.200 3.200 8.200 3.517 3.505 3.553 . 0 0 "[ . 1 . ]" 1
231 1 8 ARG H 1 9 PRO QD 0.000 . 3.500 2.267 2.241 2.329 . 0 0 "[ . 1 . ]" 1
232 1 7 THR HB 1 8 ARG H 0.000 . 4.000 2.856 2.650 3.015 . 0 0 "[ . 1 . ]" 1
233 1 9 PRO HB2 1 10 ILE H 0.000 . 4.000 3.313 3.227 3.367 . 0 0 "[ . 1 . ]" 1
234 1 9 PRO HA 1 10 ILE H 3.200 3.200 8.200 3.524 3.511 3.548 . 0 0 "[ . 1 . ]" 1
235 1 10 ILE H 1 11 ILE H 0.000 . 2.700 2.651 2.628 2.693 . 0 0 "[ . 1 . ]" 1
236 1 10 ILE HA 1 11 ILE H 3.200 3.200 8.200 3.570 3.558 3.582 . 0 0 "[ . 1 . ]" 1
237 1 11 ILE H 1 12 GLU H 0.000 . 2.700 2.638 2.614 2.661 . 0 0 "[ . 1 . ]" 1
238 1 11 ILE HA 1 12 GLU H 3.200 3.200 8.200 3.542 3.532 3.555 . 0 0 "[ . 1 . ]" 1
239 1 12 GLU H 1 13 LEU H 0.000 . 2.700 2.698 2.678 2.707 0.007 13 0 "[ . 1 . ]" 1
240 1 12 GLU HA 1 13 LEU H 3.200 3.200 8.200 3.550 3.541 3.556 . 0 0 "[ . 1 . ]" 1
241 1 13 LEU H 1 14 SER H 0.000 . 2.700 2.693 2.670 2.709 0.009 1 0 "[ . 1 . ]" 1
242 1 13 LEU HA 1 14 SER H 3.200 3.200 8.200 3.565 3.557 3.574 . 0 0 "[ . 1 . ]" 1
243 1 14 SER H 1 15 ASN H 0.000 . 2.700 2.723 2.715 2.729 0.029 6 0 "[ . 1 . ]" 1
244 1 14 SER HG 1 15 ASN H 0.000 . 3.500 2.846 2.191 3.324 . 0 0 "[ . 1 . ]" 1
245 1 14 SER HA 1 15 ASN H 3.200 3.200 8.200 3.548 3.537 3.557 . 0 0 "[ . 1 . ]" 1
246 1 15 ASN H 1 16 THR H 0.000 . 2.700 2.719 2.710 2.734 0.034 10 0 "[ . 1 . ]" 1
247 1 15 ASN HB3 1 16 THR H 0.000 . 4.000 3.404 3.253 3.506 . 0 0 "[ . 1 . ]" 1
248 1 15 ASN HB2 1 16 THR H 0.000 . 3.200 2.717 2.628 2.787 . 0 0 "[ . 1 . ]" 1
249 1 15 ASN HA 1 16 THR H 3.200 3.200 8.200 3.563 3.550 3.570 . 0 0 "[ . 1 . ]" 1
250 1 16 THR H 1 17 ALA H 0.000 . 2.700 2.712 2.688 2.726 0.026 11 0 "[ . 1 . ]" 1
251 1 16 THR HA 1 17 ALA H 3.200 3.200 8.200 3.554 3.543 3.561 . 0 0 "[ . 1 . ]" 1
252 1 17 ALA H 1 18 ASP H 0.000 . 2.700 2.724 2.711 2.730 0.030 9 0 "[ . 1 . ]" 1
253 1 16 THR HB 1 17 ALA H 0.000 . 2.700 2.595 2.512 2.650 . 0 0 "[ . 1 . ]" 1
254 1 16 THR MG 1 17 ALA H 0.000 . 4.800 3.732 3.664 3.788 . 0 0 "[ . 1 . ]" 1
255 1 18 ASP H 1 19 LYS H 0.000 . 2.700 2.732 2.721 2.742 0.042 13 0 "[ . 1 . ]" 1
256 1 17 ALA HA 1 18 ASP H 3.200 3.200 8.200 3.549 3.541 3.557 . 0 0 "[ . 1 . ]" 1
257 1 17 ALA MB 1 18 ASP H 0.000 . 3.500 2.551 2.490 2.627 . 0 0 "[ . 1 . ]" 1
258 1 18 ASP HA 1 19 LYS H 3.200 3.200 8.200 3.552 3.547 3.558 . 0 0 "[ . 1 . ]" 1
259 1 19 LYS H 1 20 ILE H 0.000 . 2.700 2.736 2.730 2.742 0.042 10 0 "[ . 1 . ]" 1
260 1 19 LYS HA 1 20 ILE H 3.200 3.200 8.200 3.537 3.531 3.542 . 0 0 "[ . 1 . ]" 1
261 1 20 ILE H 1 21 ALA H 0.000 . 2.700 2.720 2.707 2.738 0.038 14 0 "[ . 1 . ]" 1
262 1 21 ALA H 1 22 GLU H 0.000 . 2.700 2.728 2.721 2.734 0.034 6 0 "[ . 1 . ]" 1
263 1 20 ILE HA 1 21 ALA H 3.200 3.200 8.200 3.564 3.556 3.569 . 0 0 "[ . 1 . ]" 1
264 1 21 ALA HA 1 22 GLU H 3.200 3.200 8.200 3.529 3.524 3.535 . 0 0 "[ . 1 . ]" 1
265 1 21 ALA MB 1 22 GLU H 0.000 . 4.000 2.679 2.623 2.731 . 0 0 "[ . 1 . ]" 1
266 1 22 GLU H 1 23 GLY H 0.000 . 2.700 2.750 2.720 2.777 0.077 14 0 "[ . 1 . ]" 1
267 1 23 GLY H 1 24 ASN H 0.000 . 3.200 2.216 2.165 2.270 . 0 0 "[ . 1 . ]" 1
268 1 22 GLU HA 1 23 GLY H 3.200 3.200 8.200 3.377 3.333 3.410 . 0 0 "[ . 1 . ]" 1
269 1 23 GLY HA3 1 24 ASN H 2.700 2.700 7.700 3.404 3.361 3.475 . 0 0 "[ . 1 . ]" 1
270 1 24 ASN H 1 25 LEU H 2.700 2.700 4.000 3.886 3.853 3.925 . 0 0 "[ . 1 . ]" 1
271 1 23 GLY HA2 1 24 ASN H 2.700 2.700 7.700 3.320 3.202 3.368 . 0 0 "[ . 1 . ]" 1
272 1 25 LEU H 1 26 GLU H 0.000 . 2.700 2.681 2.648 2.719 0.019 6 0 "[ . 1 . ]" 1
273 1 24 ASN QB 1 25 LEU H 0.000 . 4.800 3.842 3.826 3.861 . 0 0 "[ . 1 . ]" 1
274 1 24 ASN HA 1 25 LEU H 0.000 . 2.700 2.315 2.298 2.335 . 0 0 "[ . 1 . ]" 1
275 1 26 GLU H 1 27 ALA H 0.000 . 2.700 2.536 2.459 2.649 . 0 0 "[ . 1 . ]" 1
276 1 25 LEU HA 1 26 GLU H 2.700 2.700 7.700 3.486 3.455 3.501 . 0 0 "[ . 1 . ]" 1
277 1 26 GLU HA 1 27 ALA H 2.700 2.700 7.700 3.406 3.318 3.456 . 0 0 "[ . 1 . ]" 1
278 1 27 ALA H 1 28 GLU H 3.200 3.200 8.200 4.480 4.418 4.544 . 0 0 "[ . 1 . ]" 1
279 1 28 GLU HA 1 29 VAL MG2 0.000 . 4.800 3.528 3.448 3.670 . 0 0 "[ . 1 . ]" 1
280 1 27 ALA HA 1 28 GLU H 0.000 . 2.700 2.148 2.138 2.159 . 0 0 "[ . 1 . ]" 1
281 1 28 GLU H 1 29 VAL H 4.000 4.000 9.000 4.591 4.548 4.617 . 0 0 "[ . 1 . ]" 1
282 1 29 VAL MG1 1 30 PRO HD2 0.000 . 3.500 1.998 1.897 2.101 . 0 0 "[ . 1 . ]" 1
283 1 29 VAL MG1 1 30 PRO HD3 0.000 . 4.800 2.974 2.867 3.201 . 0 0 "[ . 1 . ]" 1
284 1 29 VAL HA 1 30 PRO HD3 0.000 . 2.700 2.117 2.067 2.231 . 0 0 "[ . 1 . ]" 1
285 1 29 VAL H 1 30 PRO HD3 3.200 3.200 8.200 4.808 4.769 4.882 . 0 0 "[ . 1 . ]" 1
286 1 29 VAL H 1 30 PRO HD2 3.200 3.200 8.200 5.285 5.199 5.321 . 0 0 "[ . 1 . ]" 1
287 1 28 GLU HA 1 29 VAL H 0.000 . 2.700 2.184 2.159 2.218 . 0 0 "[ . 1 . ]" 1
288 1 29 VAL HA 1 30 PRO HD2 0.000 . 2.700 2.686 2.538 2.724 0.024 11 0 "[ . 1 . ]" 1
289 1 30 PRO HG2 1 31 HIS HD2 0.000 . 3.200 2.347 2.165 2.442 . 0 0 "[ . 1 . ]" 1
290 1 30 PRO HG3 1 31 HIS HD2 0.000 . 4.000 3.922 3.765 4.004 0.004 16 0 "[ . 1 . ]" 1
291 1 30 PRO HB3 1 31 HIS H 0.000 . 4.000 3.525 3.468 3.604 . 0 0 "[ . 1 . ]" 1
292 1 31 HIS H 1 32 GLN H 0.000 . 3.200 2.782 2.705 2.821 . 0 0 "[ . 1 . ]" 1
293 1 30 PRO HB2 1 31 HIS H 0.000 . 3.200 2.525 2.405 2.662 . 0 0 "[ . 1 . ]" 1
294 1 30 PRO HA 1 31 HIS H 0.000 . 2.700 2.443 2.400 2.484 . 0 0 "[ . 1 . ]" 1
295 1 31 HIS HA 1 32 GLN H 0.000 . 3.200 3.053 2.931 3.112 . 0 0 "[ . 1 . ]" 1
296 1 32 GLN H 1 33 ASN H 0.000 . 2.700 2.594 2.553 2.628 . 0 0 "[ . 1 . ]" 1
297 1 33 ASN H 1 34 ARG H 0.000 . 2.700 2.568 2.525 2.633 . 0 0 "[ . 1 . ]" 1
298 1 32 GLN HA 1 33 ASN H 3.200 3.200 8.200 3.511 3.501 3.532 . 0 0 "[ . 1 . ]" 1
299 1 33 ASN HA 1 34 ARG H 2.700 2.700 7.700 3.443 3.329 3.471 . 0 0 "[ . 1 . ]" 1
300 1 33 ASN QB 1 34 ARG H 0.000 . 4.800 3.436 3.120 3.953 . 0 0 "[ . 1 . ]" 1
301 1 35 ALA MB 1 36 ASP H 0.000 . 4.000 2.968 2.911 3.102 . 0 0 "[ . 1 . ]" 1
302 1 36 ASP H 1 37 GLU H 3.200 3.200 8.200 4.475 4.449 4.499 . 0 0 "[ . 1 . ]" 1
303 1 35 ALA HA 1 36 ASP H 2.700 2.700 7.700 3.493 3.470 3.500 . 0 0 "[ . 1 . ]" 1
304 1 37 GLU H 1 38 ILE H 0.000 . 3.200 2.865 2.835 2.895 . 0 0 "[ . 1 . ]" 1
305 1 36 ASP HA 1 37 GLU H 2.700 2.700 7.700 2.734 2.702 2.769 . 0 0 "[ . 1 . ]" 1
306 1 38 ILE H 1 39 GLY H 0.000 . 3.200 2.435 2.426 2.448 . 0 0 "[ . 1 . ]" 1
307 1 37 GLU HG3 1 38 ILE H 3.500 3.500 8.500 5.028 4.952 5.123 . 0 0 "[ . 1 . ]" 1
308 1 37 GLU HG2 1 38 ILE H 3.500 3.500 8.500 5.420 5.378 5.474 . 0 0 "[ . 1 . ]" 1
309 1 37 GLU HA 1 38 ILE H 3.200 3.200 8.200 3.527 3.508 3.547 . 0 0 "[ . 1 . ]" 1
310 1 38 ILE HA 1 39 GLY H 3.200 3.200 8.200 3.526 3.520 3.531 . 0 0 "[ . 1 . ]" 1
311 1 39 GLY H 1 40 ILE H 0.000 . 2.700 2.690 2.657 2.711 0.011 5 0 "[ . 1 . ]" 1
312 1 38 ILE MG 1 39 GLY H 0.000 . 4.800 3.751 3.683 3.801 . 0 0 "[ . 1 . ]" 1
313 1 40 ILE H 1 41 LEU H 0.000 . 2.700 2.704 2.669 2.717 0.017 18 0 "[ . 1 . ]" 1
314 1 39 GLY HA3 1 40 ILE H 2.700 2.700 7.700 2.786 2.766 2.814 . 0 0 "[ . 1 . ]" 1
315 1 39 GLY HA2 1 40 ILE H 3.200 3.200 8.200 3.553 3.543 3.561 . 0 0 "[ . 1 . ]" 1
316 1 40 ILE HA 1 41 LEU H 3.200 3.200 8.200 3.559 3.537 3.567 . 0 0 "[ . 1 . ]" 1
317 1 41 LEU H 1 42 ALA H 0.000 . 2.700 2.749 2.739 2.757 0.057 18 0 "[ . 1 . ]" 1
318 1 40 ILE MG 1 41 LEU H 0.000 . 4.800 3.585 3.533 3.639 . 0 0 "[ . 1 . ]" 1
319 1 41 LEU HA 1 42 ALA H 3.200 3.200 8.200 3.556 3.550 3.563 . 0 0 "[ . 1 . ]" 1
320 1 42 ALA H 1 43 LYS H 0.000 . 2.700 2.757 2.744 2.775 0.075 14 0 "[ . 1 . ]" 1
321 1 43 LYS H 1 44 SER H 0.000 . 2.700 2.725 2.714 2.730 0.030 11 0 "[ . 1 . ]" 1
322 1 42 ALA HA 1 43 LYS H 3.200 3.200 8.200 3.549 3.541 3.554 . 0 0 "[ . 1 . ]" 1
323 1 43 LYS HA 1 44 SER H 3.200 3.200 8.200 3.545 3.542 3.551 . 0 0 "[ . 1 . ]" 1
324 1 44 SER H 1 45 ILE H 0.000 . 2.700 2.723 2.714 2.735 0.035 1 0 "[ . 1 . ]" 1
325 1 45 ILE H 1 46 GLU H 0.000 . 2.700 2.699 2.643 2.717 0.017 1 0 "[ . 1 . ]" 1
326 1 44 SER HA 1 45 ILE H 3.200 3.200 8.200 3.558 3.551 3.569 . 0 0 "[ . 1 . ]" 1
327 1 45 ILE HB 1 46 GLU H 0.000 . 3.200 2.731 2.680 2.795 . 0 0 "[ . 1 . ]" 1
328 1 46 GLU H 1 47 ARG H 0.000 . 2.700 2.730 2.724 2.739 0.039 1 0 "[ . 1 . ]" 1
329 1 45 ILE HA 1 46 GLU H 3.200 3.200 8.200 3.557 3.536 3.566 . 0 0 "[ . 1 . ]" 1
330 1 47 ARG H 1 48 LEU H 0.000 . 2.700 2.736 2.729 2.743 0.043 17 0 "[ . 1 . ]" 1
331 1 46 GLU HA 1 47 ARG H 3.200 3.200 8.200 3.555 3.547 3.560 . 0 0 "[ . 1 . ]" 1
332 1 46 GLU QB 1 47 ARG H 0.000 . 4.000 2.635 2.590 2.672 . 0 0 "[ . 1 . ]" 1
333 1 47 ARG HA 1 48 LEU H 3.200 3.200 8.200 3.547 3.540 3.553 . 0 0 "[ . 1 . ]" 1
334 1 48 LEU H 1 49 ARG H 0.000 . 2.700 2.710 2.692 2.727 0.027 15 0 "[ . 1 . ]" 1
335 1 47 ARG HB3 1 48 LEU H 0.000 . 4.000 3.474 3.391 3.583 . 0 0 "[ . 1 . ]" 1
336 1 47 ARG HB2 1 48 LEU H 0.000 . 4.000 2.628 2.543 2.700 . 0 0 "[ . 1 . ]" 1
337 1 48 LEU QB 1 49 ARG H 0.000 . 4.000 2.529 2.463 2.582 . 0 0 "[ . 1 . ]" 1
338 1 49 ARG H 1 50 ARG H 0.000 . 2.700 2.739 2.724 2.754 0.054 12 0 "[ . 1 . ]" 1
339 1 48 LEU HA 1 49 ARG H 3.200 3.200 8.200 3.548 3.540 3.554 . 0 0 "[ . 1 . ]" 1
340 1 50 ARG H 1 51 SER H 0.000 . 2.700 2.718 2.708 2.724 0.024 11 0 "[ . 1 . ]" 1
341 1 49 ARG HA 1 50 ARG H 3.200 3.200 8.200 3.539 3.532 3.546 . 0 0 "[ . 1 . ]" 1
342 1 49 ARG QB 1 50 ARG H 0.000 . 4.000 2.508 2.455 2.554 . 0 0 "[ . 1 . ]" 1
343 1 50 ARG QB 1 51 SER H 0.000 . 4.000 2.580 2.515 2.685 . 0 0 "[ . 1 . ]" 1
344 1 51 SER H 1 52 LEU H 0.000 . 2.700 2.737 2.728 2.747 0.047 1 0 "[ . 1 . ]" 1
345 1 50 ARG HA 1 51 SER H 3.200 3.200 8.200 3.553 3.543 3.561 . 0 0 "[ . 1 . ]" 1
346 1 52 LEU H 1 53 LYS H 0.000 . 2.700 2.723 2.711 2.740 0.040 11 0 "[ . 1 . ]" 1
347 1 51 SER HA 1 52 LEU H 3.200 3.200 8.200 3.550 3.545 3.556 . 0 0 "[ . 1 . ]" 1
348 1 53 LYS H 1 54 GLN H 0.000 . 2.700 2.716 2.686 2.727 0.027 15 0 "[ . 1 . ]" 1
349 1 52 LEU HA 1 53 LYS H 3.200 3.200 8.200 3.564 3.553 3.579 . 0 0 "[ . 1 . ]" 1
350 1 52 LEU QB 1 53 LYS H 0.000 . 4.000 2.518 2.464 2.581 . 0 0 "[ . 1 . ]" 1
351 1 54 GLN H 1 55 LEU H 0.000 . 2.700 2.711 2.696 2.723 0.023 1 0 "[ . 1 . ]" 1
352 1 53 LYS QB 1 54 GLN H 0.000 . 4.000 2.592 2.520 2.648 . 0 0 "[ . 1 . ]" 1
353 1 53 LYS HA 1 54 GLN H 3.200 3.200 8.200 3.550 3.540 3.562 . 0 0 "[ . 1 . ]" 1
354 1 54 GLN HA 1 55 LEU H 3.200 3.200 8.200 3.563 3.555 3.580 . 0 0 "[ . 1 . ]" 1
355 1 55 LEU H 1 56 ALA H 0.000 . 2.700 2.724 2.710 2.736 0.036 5 0 "[ . 1 . ]" 1
356 1 56 ALA H 1 57 ASP H 0.000 . 2.700 2.730 2.715 2.748 0.048 18 0 "[ . 1 . ]" 1
357 1 55 LEU QB 1 56 ALA H 0.000 . 3.200 2.690 2.594 2.781 . 0 0 "[ . 1 . ]" 1
358 1 55 LEU HA 1 56 ALA H 3.200 3.200 8.200 3.547 3.536 3.557 . 0 0 "[ . 1 . ]" 1
359 1 56 ALA HA 1 57 ASP H 3.200 3.200 8.200 3.562 3.556 3.569 . 0 0 "[ . 1 . ]" 1
360 1 75 THR H 1 76 ARG H 0.000 . 2.700 2.717 2.704 2.724 0.024 13 0 "[ . 1 . ]" 1
361 1 75 THR HA 1 76 ARG H 3.200 3.200 8.200 3.546 3.535 3.559 . 0 0 "[ . 1 . ]" 1
362 1 76 ARG H 1 77 ILE H 0.000 . 2.700 2.742 2.735 2.757 0.057 7 0 "[ . 1 . ]" 1
363 1 77 ILE H 1 78 ARG H 0.000 . 2.700 2.684 2.634 2.706 0.006 17 0 "[ . 1 . ]" 1
364 1 76 ARG HA 1 77 ILE H 3.200 3.200 8.200 3.550 3.542 3.558 . 0 0 "[ . 1 . ]" 1
365 1 77 ILE HA 1 78 ARG H 3.200 3.200 8.200 3.553 3.530 3.568 . 0 0 "[ . 1 . ]" 1
366 1 78 ARG H 1 79 LEU H 0.000 . 2.700 2.739 2.720 2.756 0.056 1 0 "[ . 1 . ]" 1
367 1 79 LEU H 1 80 ALA H 0.000 . 2.700 2.708 2.668 2.738 0.038 13 0 "[ . 1 . ]" 1
368 1 78 ARG HA 1 79 LEU H 3.200 3.200 8.200 3.544 3.528 3.557 . 0 0 "[ . 1 . ]" 1
369 1 80 ALA H 1 81 THR H 0.000 . 2.700 2.719 2.702 2.738 0.038 7 0 "[ . 1 . ]" 1
370 1 79 LEU HA 1 80 ALA H 3.200 3.200 8.200 3.558 3.547 3.569 . 0 0 "[ . 1 . ]" 1
371 1 80 ALA HA 1 81 THR H 3.200 3.200 8.200 3.551 3.530 3.562 . 0 0 "[ . 1 . ]" 1
372 1 81 THR H 1 82 GLU H 0.000 . 2.700 2.679 2.623 2.715 0.015 10 0 "[ . 1 . ]" 1
373 1 81 THR HA 1 82 GLU H 3.200 3.200 8.200 3.508 3.501 3.512 . 0 0 "[ . 1 . ]" 1
374 1 82 GLU H 1 83 MET H 0.000 . 2.700 2.571 2.505 2.656 . 0 0 "[ . 1 . ]" 1
375 1 82 GLU HA 1 83 MET H 3.200 3.200 8.200 3.507 3.481 3.515 . 0 0 "[ . 1 . ]" 1
376 1 83 MET H 1 84 MET H 0.000 . 2.700 2.509 2.460 2.556 . 0 0 "[ . 1 . ]" 1
377 1 83 MET HA 1 84 MET H 3.200 3.200 8.200 3.485 3.448 3.507 . 0 0 "[ . 1 . ]" 1
378 1 87 GLN HA 1 88 ASP H 3.200 3.200 8.200 3.514 3.506 3.538 . 0 0 "[ . 1 . ]" 1
379 1 88 ASP H 1 89 GLY H 0.000 . 2.700 2.675 2.608 2.735 0.035 6 0 "[ . 1 . ]" 1
380 1 89 GLY H 1 90 TYR H 0.000 . 2.700 2.654 2.626 2.693 . 0 0 "[ . 1 . ]" 1
381 1 88 ASP HA 1 89 GLY H 0.000 . 3.200 2.980 2.938 3.037 . 0 0 "[ . 1 . ]" 1
382 1 90 TYR QD 1 91 LEU QD 0.000 . 4.000 3.187 3.099 3.453 . 0 0 "[ . 1 . ]" 1
383 1 90 TYR QE 1 91 LEU QD 0.000 . 3.500 2.569 2.461 2.861 . 0 0 "[ . 1 . ]" 1
384 1 90 TYR HA 1 91 LEU H 3.200 3.200 8.200 3.531 3.507 3.559 . 0 0 "[ . 1 . ]" 1
385 1 91 LEU H 1 92 ALA H 0.000 . 2.700 2.499 2.413 2.582 . 0 0 "[ . 1 . ]" 1
386 1 91 LEU HA 1 92 ALA H 3.200 3.200 8.200 3.523 3.516 3.538 . 0 0 "[ . 1 . ]" 1
387 1 92 ALA H 1 93 GLU H 0.000 . 2.700 2.616 2.578 2.651 . 0 0 "[ . 1 . ]" 1
388 1 92 ALA HA 1 93 GLU H 3.200 3.200 8.200 3.523 3.517 3.537 . 0 0 "[ . 1 . ]" 1
389 1 93 GLU H 1 94 SER H 0.000 . 2.700 2.694 2.679 2.715 0.015 13 0 "[ . 1 . ]" 1
390 1 93 GLU HA 1 94 SER H 3.200 3.200 8.200 3.541 3.527 3.563 . 0 0 "[ . 1 . ]" 1
391 1 94 SER H 1 95 ILE H 0.000 . 2.700 2.699 2.665 2.709 0.009 18 0 "[ . 1 . ]" 1
392 1 94 SER HA 1 95 ILE H 3.200 3.200 8.200 3.564 3.550 3.572 . 0 0 "[ . 1 . ]" 1
393 1 95 ILE H 1 96 ASN H 0.000 . 2.700 2.639 2.602 2.678 . 0 0 "[ . 1 . ]" 1
394 1 96 ASN H 1 97 LYS H 0.000 . 2.700 2.726 2.710 2.738 0.038 10 0 "[ . 1 . ]" 1
395 1 95 ILE HA 1 96 ASN H 3.200 3.200 8.200 3.536 3.518 3.549 . 0 0 "[ . 1 . ]" 1
396 1 96 ASN HA 1 97 LYS H 3.200 3.200 8.200 3.564 3.556 3.572 . 0 0 "[ . 1 . ]" 1
397 1 97 LYS H 1 98 ASP H 0.000 . 2.700 2.717 2.704 2.735 0.035 6 0 "[ . 1 . ]" 1
398 1 98 ASP H 1 99 ILE H 0.000 . 2.700 2.751 2.729 2.770 0.070 1 0 "[ . 1 . ]" 1
399 1 97 LYS HA 1 98 ASP H 3.200 3.200 8.200 3.537 3.526 3.545 . 0 0 "[ . 1 . ]" 1
400 2 6 ILE H 2 7 THR H 0.000 . 2.700 2.625 2.586 2.646 . 0 0 "[ . 1 . ]" 1
401 2 5 THR HA 2 6 ILE H 3.200 3.200 8.200 3.540 3.512 3.556 . 0 0 "[ . 1 . ]" 1
402 2 6 ILE HA 2 7 THR H 3.200 3.200 8.200 3.513 3.504 3.519 . 0 0 "[ . 1 . ]" 1
403 2 6 ILE HB 2 7 THR H 0.000 . 4.000 2.957 2.878 3.092 . 0 0 "[ . 1 . ]" 1
404 2 7 THR H 2 8 ARG H 0.000 . 2.700 2.655 2.613 2.704 0.004 9 0 "[ . 1 . ]" 1
405 2 7 THR HA 2 8 ARG H 3.200 3.200 8.200 3.516 3.507 3.533 . 0 0 "[ . 1 . ]" 1
406 2 8 ARG H 2 9 PRO QD 0.000 . 3.500 2.251 2.157 2.311 . 0 0 "[ . 1 . ]" 1
407 2 7 THR HB 2 8 ARG H 0.000 . 4.000 2.847 2.769 2.986 . 0 0 "[ . 1 . ]" 1
408 2 9 PRO HB2 2 10 ILE H 0.000 . 4.000 3.300 3.221 3.378 . 0 0 "[ . 1 . ]" 1
409 2 9 PRO HA 2 10 ILE H 3.200 3.200 8.200 3.526 3.508 3.542 . 0 0 "[ . 1 . ]" 1
410 2 10 ILE H 2 11 ILE H 0.000 . 2.700 2.656 2.615 2.702 0.002 10 0 "[ . 1 . ]" 1
411 2 10 ILE HA 2 11 ILE H 3.200 3.200 8.200 3.568 3.555 3.586 . 0 0 "[ . 1 . ]" 1
412 2 11 ILE H 2 12 GLU H 0.000 . 2.700 2.636 2.617 2.672 . 0 0 "[ . 1 . ]" 1
413 2 11 ILE HA 2 12 GLU H 3.200 3.200 8.200 3.535 3.525 3.546 . 0 0 "[ . 1 . ]" 1
414 2 12 GLU H 2 13 LEU H 0.000 . 2.700 2.704 2.674 2.719 0.019 3 0 "[ . 1 . ]" 1
415 2 12 GLU HA 2 13 LEU H 3.200 3.200 8.200 3.555 3.543 3.564 . 0 0 "[ . 1 . ]" 1
416 2 13 LEU H 2 14 SER H 0.000 . 2.700 2.705 2.695 2.713 0.013 1 0 "[ . 1 . ]" 1
417 2 13 LEU HA 2 14 SER H 3.200 3.200 8.200 3.565 3.556 3.573 . 0 0 "[ . 1 . ]" 1
418 2 14 SER H 2 15 ASN H 0.000 . 2.700 2.721 2.712 2.738 0.038 10 0 "[ . 1 . ]" 1
419 2 14 SER HG 2 15 ASN H 0.000 . 3.500 2.982 2.412 3.391 . 0 0 "[ . 1 . ]" 1
420 2 14 SER HA 2 15 ASN H 3.200 3.200 8.200 3.549 3.538 3.567 . 0 0 "[ . 1 . ]" 1
421 2 15 ASN H 2 16 THR H 0.000 . 2.700 2.720 2.680 2.737 0.037 14 0 "[ . 1 . ]" 1
422 2 15 ASN HB3 2 16 THR H 0.000 . 4.000 3.383 3.266 3.540 . 0 0 "[ . 1 . ]" 1
423 2 15 ASN HB2 2 16 THR H 0.000 . 3.200 2.688 2.634 2.738 . 0 0 "[ . 1 . ]" 1
424 2 15 ASN HA 2 16 THR H 3.200 3.200 8.200 3.563 3.539 3.575 . 0 0 "[ . 1 . ]" 1
425 2 16 THR H 2 17 ALA H 0.000 . 2.700 2.712 2.696 2.727 0.027 10 0 "[ . 1 . ]" 1
426 2 16 THR HA 2 17 ALA H 3.200 3.200 8.200 3.551 3.534 3.563 . 0 0 "[ . 1 . ]" 1
427 2 17 ALA H 2 18 ASP H 0.000 . 2.700 2.722 2.714 2.731 0.031 11 0 "[ . 1 . ]" 1
428 2 16 THR HB 2 17 ALA H 0.000 . 2.700 2.606 2.478 2.654 . 0 0 "[ . 1 . ]" 1
429 2 16 THR MG 2 17 ALA H 0.000 . 4.800 3.720 3.593 3.764 . 0 0 "[ . 1 . ]" 1
430 2 18 ASP H 2 19 LYS H 0.000 . 2.700 2.733 2.721 2.741 0.041 7 0 "[ . 1 . ]" 1
431 2 17 ALA HA 2 18 ASP H 3.200 3.200 8.200 3.549 3.542 3.560 . 0 0 "[ . 1 . ]" 1
432 2 17 ALA MB 2 18 ASP H 0.000 . 3.500 2.572 2.476 2.634 . 0 0 "[ . 1 . ]" 1
433 2 18 ASP HA 2 19 LYS H 3.200 3.200 8.200 3.551 3.545 3.555 . 0 0 "[ . 1 . ]" 1
434 2 19 LYS H 2 20 ILE H 0.000 . 2.700 2.735 2.728 2.749 0.049 17 0 "[ . 1 . ]" 1
435 2 19 LYS HA 2 20 ILE H 3.200 3.200 8.200 3.536 3.528 3.543 . 0 0 "[ . 1 . ]" 1
436 2 20 ILE H 2 21 ALA H 0.000 . 2.700 2.720 2.708 2.734 0.034 18 0 "[ . 1 . ]" 1
437 2 21 ALA H 2 22 GLU H 0.000 . 2.700 2.734 2.724 2.741 0.041 17 0 "[ . 1 . ]" 1
438 2 20 ILE HA 2 21 ALA H 3.200 3.200 8.200 3.566 3.560 3.572 . 0 0 "[ . 1 . ]" 1
439 2 21 ALA HA 2 22 GLU H 3.200 3.200 8.200 3.530 3.522 3.537 . 0 0 "[ . 1 . ]" 1
440 2 21 ALA MB 2 22 GLU H 0.000 . 4.000 2.686 2.637 2.782 . 0 0 "[ . 1 . ]" 1
441 2 22 GLU H 2 23 GLY H 0.000 . 2.700 2.748 2.728 2.767 0.067 15 0 "[ . 1 . ]" 1
442 2 23 GLY H 2 24 ASN H 0.000 . 3.200 2.236 2.201 2.280 . 0 0 "[ . 1 . ]" 1
443 2 22 GLU HA 2 23 GLY H 3.200 3.200 8.200 3.372 3.333 3.402 . 0 0 "[ . 1 . ]" 1
444 2 23 GLY HA3 2 24 ASN H 2.700 2.700 7.700 3.464 3.447 3.484 . 0 0 "[ . 1 . ]" 1
445 2 24 ASN H 2 25 LEU H 2.700 2.700 4.000 3.795 3.725 3.912 . 0 0 "[ . 1 . ]" 1
446 2 23 GLY HA2 2 24 ASN H 2.700 2.700 7.700 3.220 3.186 3.252 . 0 0 "[ . 1 . ]" 1
447 2 25 LEU H 2 26 GLU H 0.000 . 2.700 2.710 2.674 2.733 0.033 11 0 "[ . 1 . ]" 1
448 2 24 ASN QB 2 25 LEU H 0.000 . 4.800 3.870 3.816 3.895 . 0 0 "[ . 1 . ]" 1
449 2 24 ASN HA 2 25 LEU H 0.000 . 2.700 2.345 2.296 2.388 . 0 0 "[ . 1 . ]" 1
450 2 26 GLU H 2 27 ALA H 0.000 . 2.700 2.534 2.464 2.682 . 0 0 "[ . 1 . ]" 1
451 2 25 LEU HA 2 26 GLU H 2.700 2.700 7.700 3.481 3.450 3.499 . 0 0 "[ . 1 . ]" 1
452 2 26 GLU HA 2 27 ALA H 2.700 2.700 7.700 3.407 3.286 3.453 . 0 0 "[ . 1 . ]" 1
453 2 27 ALA H 2 28 GLU H 3.200 3.200 8.200 4.508 4.426 4.576 . 0 0 "[ . 1 . ]" 1
454 2 28 GLU HA 2 29 VAL MG2 0.000 . 4.800 3.517 3.432 3.620 . 0 0 "[ . 1 . ]" 1
455 2 27 ALA HA 2 28 GLU H 0.000 . 2.700 2.149 2.139 2.166 . 0 0 "[ . 1 . ]" 1
456 2 28 GLU H 2 29 VAL H 4.000 4.000 9.000 4.595 4.566 4.619 . 0 0 "[ . 1 . ]" 1
457 2 29 VAL MG1 2 30 PRO HD2 0.000 . 3.500 2.030 1.898 2.369 . 0 0 "[ . 1 . ]" 1
458 2 29 VAL MG1 2 30 PRO HD3 0.000 . 4.800 3.024 2.884 3.605 . 0 0 "[ . 1 . ]" 1
459 2 29 VAL HA 2 30 PRO HD3 0.000 . 2.700 2.139 2.069 2.489 . 0 0 "[ . 1 . ]" 1
460 2 29 VAL H 2 30 PRO HD3 3.200 3.200 8.200 4.801 4.740 4.922 . 0 0 "[ . 1 . ]" 1
461 2 29 VAL H 2 30 PRO HD2 3.200 3.200 8.200 5.268 5.005 5.334 . 0 0 "[ . 1 . ]" 1
462 2 28 GLU HA 2 29 VAL H 0.000 . 2.700 2.194 2.165 2.221 . 0 0 "[ . 1 . ]" 1
463 2 29 VAL HA 2 30 PRO HD2 0.000 . 2.700 2.653 2.250 2.720 0.020 3 0 "[ . 1 . ]" 1
464 2 30 PRO HG2 2 31 HIS HD2 0.000 . 3.200 2.394 2.274 2.582 . 0 0 "[ . 1 . ]" 1
465 2 30 PRO HG3 2 31 HIS HD2 0.000 . 4.000 3.943 3.764 4.009 0.009 10 0 "[ . 1 . ]" 1
466 2 30 PRO HB3 2 31 HIS H 0.000 . 4.000 3.517 3.471 3.590 . 0 0 "[ . 1 . ]" 1
467 2 31 HIS H 2 32 GLN H 0.000 . 3.200 2.786 2.701 2.823 . 0 0 "[ . 1 . ]" 1
468 2 30 PRO HB2 2 31 HIS H 0.000 . 3.200 2.529 2.396 2.665 . 0 0 "[ . 1 . ]" 1
469 2 30 PRO HA 2 31 HIS H 0.000 . 2.700 2.440 2.390 2.493 . 0 0 "[ . 1 . ]" 1
470 2 31 HIS HA 2 32 GLN H 0.000 . 3.200 3.069 2.948 3.129 . 0 0 "[ . 1 . ]" 1
471 2 32 GLN H 2 33 ASN H 0.000 . 2.700 2.608 2.572 2.664 . 0 0 "[ . 1 . ]" 1
472 2 33 ASN H 2 34 ARG H 0.000 . 2.700 2.561 2.491 2.655 . 0 0 "[ . 1 . ]" 1
473 2 32 GLN HA 2 33 ASN H 3.200 3.200 8.200 3.510 3.495 3.519 . 0 0 "[ . 1 . ]" 1
474 2 33 ASN HA 2 34 ARG H 2.700 2.700 7.700 3.451 3.391 3.487 . 0 0 "[ . 1 . ]" 1
475 2 33 ASN QB 2 34 ARG H 0.000 . 4.800 3.391 3.052 3.884 . 0 0 "[ . 1 . ]" 1
476 2 35 ALA MB 2 36 ASP H 0.000 . 4.000 3.037 2.949 3.272 . 0 0 "[ . 1 . ]" 1
477 2 36 ASP H 2 37 GLU H 3.200 3.200 8.200 4.480 4.452 4.506 . 0 0 "[ . 1 . ]" 1
478 2 35 ALA HA 2 36 ASP H 2.700 2.700 7.700 3.477 3.412 3.495 . 0 0 "[ . 1 . ]" 1
479 2 37 GLU H 2 38 ILE H 0.000 . 3.200 2.860 2.822 2.891 . 0 0 "[ . 1 . ]" 1
480 2 36 ASP HA 2 37 GLU H 2.700 2.700 7.700 2.704 2.673 2.757 0.027 3 0 "[ . 1 . ]" 1
481 2 38 ILE H 2 39 GLY H 0.000 . 3.200 2.459 2.435 2.480 . 0 0 "[ . 1 . ]" 1
482 2 37 GLU HG3 2 38 ILE H 3.500 3.500 8.500 5.055 4.974 5.165 . 0 0 "[ . 1 . ]" 1
483 2 37 GLU HG2 2 38 ILE H 3.500 3.500 8.500 5.467 5.408 5.508 . 0 0 "[ . 1 . ]" 1
484 2 37 GLU HA 2 38 ILE H 3.200 3.200 8.200 3.513 3.498 3.528 . 0 0 "[ . 1 . ]" 1
485 2 38 ILE HA 2 39 GLY H 3.200 3.200 8.200 3.546 3.538 3.554 . 0 0 "[ . 1 . ]" 1
486 2 39 GLY H 2 40 ILE H 0.000 . 2.700 2.627 2.615 2.656 . 0 0 "[ . 1 . ]" 1
487 2 38 ILE MG 2 39 GLY H 0.000 . 4.800 3.640 3.605 3.689 . 0 0 "[ . 1 . ]" 1
488 2 40 ILE H 2 41 LEU H 0.000 . 2.700 2.705 2.678 2.730 0.030 14 0 "[ . 1 . ]" 1
489 2 39 GLY HA3 2 40 ILE H 2.700 2.700 7.700 2.945 2.911 3.007 . 0 0 "[ . 1 . ]" 1
490 2 39 GLY HA2 2 40 ILE H 3.200 3.200 8.200 3.530 3.523 3.549 . 0 0 "[ . 1 . ]" 1
491 2 40 ILE HA 2 41 LEU H 3.200 3.200 8.200 3.568 3.558 3.583 . 0 0 "[ . 1 . ]" 1
492 2 41 LEU H 2 42 ALA H 0.000 . 2.700 2.749 2.737 2.758 0.058 13 0 "[ . 1 . ]" 1
493 2 40 ILE MG 2 41 LEU H 0.000 . 4.800 3.528 3.459 3.586 . 0 0 "[ . 1 . ]" 1
494 2 41 LEU HA 2 42 ALA H 3.200 3.200 8.200 3.544 3.534 3.552 . 0 0 "[ . 1 . ]" 1
495 2 42 ALA H 2 43 LYS H 0.000 . 2.700 2.754 2.742 2.768 0.068 8 0 "[ . 1 . ]" 1
496 2 43 LYS H 2 44 SER H 0.000 . 2.700 2.728 2.712 2.736 0.036 4 0 "[ . 1 . ]" 1
497 2 42 ALA HA 2 43 LYS H 3.200 3.200 8.200 3.549 3.543 3.555 . 0 0 "[ . 1 . ]" 1
498 2 43 LYS HA 2 44 SER H 3.200 3.200 8.200 3.547 3.537 3.554 . 0 0 "[ . 1 . ]" 1
499 2 44 SER H 2 45 ILE H 0.000 . 2.700 2.730 2.725 2.744 0.044 10 0 "[ . 1 . ]" 1
500 2 45 ILE H 2 46 GLU H 0.000 . 2.700 2.698 2.674 2.716 0.016 14 0 "[ . 1 . ]" 1
501 2 44 SER HA 2 45 ILE H 3.200 3.200 8.200 3.561 3.552 3.589 . 0 0 "[ . 1 . ]" 1
502 2 45 ILE HB 2 46 GLU H 0.000 . 3.200 2.769 2.717 2.841 . 0 0 "[ . 1 . ]" 1
503 2 46 GLU H 2 47 ARG H 0.000 . 2.700 2.725 2.717 2.739 0.039 16 0 "[ . 1 . ]" 1
504 2 45 ILE HA 2 46 GLU H 3.200 3.200 8.200 3.552 3.541 3.563 . 0 0 "[ . 1 . ]" 1
505 2 47 ARG H 2 48 LEU H 0.000 . 2.700 2.741 2.729 2.751 0.051 5 0 "[ . 1 . ]" 1
506 2 46 GLU HA 2 47 ARG H 3.200 3.200 8.200 3.556 3.550 3.561 . 0 0 "[ . 1 . ]" 1
507 2 46 GLU QB 2 47 ARG H 0.000 . 4.000 2.625 2.588 2.705 . 0 0 "[ . 1 . ]" 1
508 2 47 ARG HA 2 48 LEU H 3.200 3.200 8.200 3.549 3.543 3.556 . 0 0 "[ . 1 . ]" 1
509 2 48 LEU H 2 49 ARG H 0.000 . 2.700 2.711 2.686 2.719 0.019 8 0 "[ . 1 . ]" 1
510 2 47 ARG HB3 2 48 LEU H 0.000 . 4.000 3.461 3.281 3.558 . 0 0 "[ . 1 . ]" 1
511 2 47 ARG HB2 2 48 LEU H 0.000 . 4.000 2.590 2.509 2.693 . 0 0 "[ . 1 . ]" 1
512 2 48 LEU QB 2 49 ARG H 0.000 . 4.000 2.533 2.480 2.583 . 0 0 "[ . 1 . ]" 1
513 2 49 ARG H 2 50 ARG H 0.000 . 2.700 2.734 2.718 2.753 0.053 12 0 "[ . 1 . ]" 1
514 2 48 LEU HA 2 49 ARG H 3.200 3.200 8.200 3.548 3.541 3.558 . 0 0 "[ . 1 . ]" 1
515 2 50 ARG H 2 51 SER H 0.000 . 2.700 2.719 2.706 2.736 0.036 8 0 "[ . 1 . ]" 1
516 2 49 ARG HA 2 50 ARG H 3.200 3.200 8.200 3.538 3.529 3.544 . 0 0 "[ . 1 . ]" 1
517 2 49 ARG QB 2 50 ARG H 0.000 . 4.000 2.521 2.458 2.576 . 0 0 "[ . 1 . ]" 1
518 2 50 ARG QB 2 51 SER H 0.000 . 4.000 2.568 2.487 2.714 . 0 0 "[ . 1 . ]" 1
519 2 51 SER H 2 52 LEU H 0.000 . 2.700 2.741 2.731 2.752 0.052 17 0 "[ . 1 . ]" 1
520 2 50 ARG HA 2 51 SER H 3.200 3.200 8.200 3.553 3.546 3.560 . 0 0 "[ . 1 . ]" 1
521 2 52 LEU H 2 53 LYS H 0.000 . 2.700 2.715 2.672 2.736 0.036 12 0 "[ . 1 . ]" 1
522 2 51 SER HA 2 52 LEU H 3.200 3.200 8.200 3.552 3.544 3.559 . 0 0 "[ . 1 . ]" 1
523 2 53 LYS H 2 54 GLN H 0.000 . 2.700 2.715 2.697 2.737 0.037 11 0 "[ . 1 . ]" 1
524 2 52 LEU HA 2 53 LYS H 3.200 3.200 8.200 3.558 3.534 3.571 . 0 0 "[ . 1 . ]" 1
525 2 52 LEU QB 2 53 LYS H 0.000 . 4.000 2.550 2.450 2.608 . 0 0 "[ . 1 . ]" 1
526 2 54 GLN H 2 55 LEU H 0.000 . 2.700 2.708 2.681 2.730 0.030 4 0 "[ . 1 . ]" 1
527 2 53 LYS QB 2 54 GLN H 0.000 . 4.000 2.563 2.485 2.677 . 0 0 "[ . 1 . ]" 1
528 2 53 LYS HA 2 54 GLN H 3.200 3.200 8.200 3.552 3.539 3.564 . 0 0 "[ . 1 . ]" 1
529 2 54 GLN HA 2 55 LEU H 3.200 3.200 8.200 3.562 3.552 3.573 . 0 0 "[ . 1 . ]" 1
530 2 55 LEU H 2 56 ALA H 0.000 . 2.700 2.725 2.713 2.733 0.033 15 0 "[ . 1 . ]" 1
531 2 56 ALA H 2 57 ASP H 0.000 . 2.700 2.734 2.713 2.749 0.049 2 0 "[ . 1 . ]" 1
532 2 55 LEU QB 2 56 ALA H 0.000 . 3.200 2.691 2.609 2.789 . 0 0 "[ . 1 . ]" 1
533 2 55 LEU HA 2 56 ALA H 3.200 3.200 8.200 3.553 3.540 3.566 . 0 0 "[ . 1 . ]" 1
534 2 56 ALA HA 2 57 ASP H 3.200 3.200 8.200 3.562 3.552 3.570 . 0 0 "[ . 1 . ]" 1
535 2 75 THR H 2 76 ARG H 0.000 . 2.700 2.720 2.692 2.733 0.033 3 0 "[ . 1 . ]" 1
536 2 75 THR HA 2 76 ARG H 3.200 3.200 8.200 3.543 3.529 3.562 . 0 0 "[ . 1 . ]" 1
537 2 76 ARG H 2 77 ILE H 0.000 . 2.700 2.747 2.731 2.762 0.062 13 0 "[ . 1 . ]" 1
538 2 77 ILE H 2 78 ARG H 0.000 . 2.700 2.691 2.650 2.729 0.029 1 0 "[ . 1 . ]" 1
539 2 76 ARG HA 2 77 ILE H 3.200 3.200 8.200 3.553 3.548 3.559 . 0 0 "[ . 1 . ]" 1
540 2 77 ILE HA 2 78 ARG H 3.200 3.200 8.200 3.557 3.542 3.575 . 0 0 "[ . 1 . ]" 1
541 2 78 ARG H 2 79 LEU H 0.000 . 2.700 2.742 2.726 2.756 0.056 7 0 "[ . 1 . ]" 1
542 2 79 LEU H 2 80 ALA H 0.000 . 2.700 2.705 2.655 2.726 0.026 9 0 "[ . 1 . ]" 1
543 2 78 ARG HA 2 79 LEU H 3.200 3.200 8.200 3.548 3.533 3.557 . 0 0 "[ . 1 . ]" 1
544 2 80 ALA H 2 81 THR H 0.000 . 2.700 2.717 2.705 2.726 0.026 13 0 "[ . 1 . ]" 1
545 2 79 LEU HA 2 80 ALA H 3.200 3.200 8.200 3.559 3.546 3.568 . 0 0 "[ . 1 . ]" 1
546 2 80 ALA HA 2 81 THR H 3.200 3.200 8.200 3.543 3.527 3.564 . 0 0 "[ . 1 . ]" 1
547 2 81 THR H 2 82 GLU H 0.000 . 2.700 2.613 2.537 2.720 0.020 3 0 "[ . 1 . ]" 1
548 2 81 THR HA 2 82 GLU H 3.200 3.200 8.200 3.514 3.502 3.522 . 0 0 "[ . 1 . ]" 1
549 2 82 GLU H 2 83 MET H 0.000 . 2.700 2.633 2.551 2.683 . 0 0 "[ . 1 . ]" 1
550 2 82 GLU HA 2 83 MET H 3.200 3.200 8.200 3.510 3.500 3.523 . 0 0 "[ . 1 . ]" 1
551 2 83 MET H 2 84 MET H 0.000 . 2.700 2.510 2.458 2.611 . 0 0 "[ . 1 . ]" 1
552 2 83 MET HA 2 84 MET H 3.200 3.200 8.200 3.479 3.420 3.501 . 0 0 "[ . 1 . ]" 1
553 2 87 GLN HA 2 88 ASP H 3.200 3.200 8.200 3.516 3.479 3.540 . 0 0 "[ . 1 . ]" 1
554 2 88 ASP H 2 89 GLY H 0.000 . 2.700 2.705 2.648 2.729 0.029 18 0 "[ . 1 . ]" 1
555 2 89 GLY H 2 90 TYR H 0.000 . 2.700 2.651 2.626 2.687 . 0 0 "[ . 1 . ]" 1
556 2 88 ASP HA 2 89 GLY H 0.000 . 3.200 2.994 2.949 3.072 . 0 0 "[ . 1 . ]" 1
557 2 90 TYR QD 2 91 LEU QD 0.000 . 4.000 3.182 3.060 3.435 . 0 0 "[ . 1 . ]" 1
558 2 90 TYR QE 2 91 LEU QD 0.000 . 3.500 2.533 2.260 2.674 . 0 0 "[ . 1 . ]" 1
559 2 90 TYR HA 2 91 LEU H 3.200 3.200 8.200 3.504 3.491 3.521 . 0 0 "[ . 1 . ]" 1
560 2 91 LEU H 2 92 ALA H 0.000 . 2.700 2.366 2.313 2.398 . 0 0 "[ . 1 . ]" 1
561 2 91 LEU HA 2 92 ALA H 3.200 3.200 8.200 3.521 3.515 3.532 . 0 0 "[ . 1 . ]" 1
562 2 92 ALA H 2 93 GLU H 0.000 . 2.700 2.593 2.526 2.626 . 0 0 "[ . 1 . ]" 1
563 2 92 ALA HA 2 93 GLU H 3.200 3.200 8.200 3.527 3.520 3.545 . 0 0 "[ . 1 . ]" 1
564 2 93 GLU H 2 94 SER H 0.000 . 2.700 2.689 2.666 2.707 0.007 13 0 "[ . 1 . ]" 1
565 2 93 GLU HA 2 94 SER H 3.200 3.200 8.200 3.542 3.528 3.554 . 0 0 "[ . 1 . ]" 1
566 2 94 SER H 2 95 ILE H 0.000 . 2.700 2.710 2.704 2.718 0.018 1 0 "[ . 1 . ]" 1
567 2 94 SER HA 2 95 ILE H 3.200 3.200 8.200 3.570 3.563 3.578 . 0 0 "[ . 1 . ]" 1
568 2 95 ILE H 2 96 ASN H 0.000 . 2.700 2.650 2.629 2.684 . 0 0 "[ . 1 . ]" 1
569 2 96 ASN H 2 97 LYS H 0.000 . 2.700 2.728 2.714 2.746 0.046 2 0 "[ . 1 . ]" 1
570 2 95 ILE HA 2 96 ASN H 3.200 3.200 8.200 3.535 3.523 3.548 . 0 0 "[ . 1 . ]" 1
571 2 96 ASN HA 2 97 LYS H 3.200 3.200 8.200 3.561 3.549 3.574 . 0 0 "[ . 1 . ]" 1
572 2 97 LYS H 2 98 ASP H 0.000 . 2.700 2.713 2.701 2.726 0.026 6 0 "[ . 1 . ]" 1
573 2 98 ASP H 2 99 ILE H 0.000 . 2.700 2.749 2.735 2.766 0.066 17 0 "[ . 1 . ]" 1
574 2 97 LYS HA 2 98 ASP H 3.200 3.200 8.200 3.537 3.528 3.546 . 0 0 "[ . 1 . ]" 1
575 1 6 ILE HA 1 9 PRO QD 0.000 . 4.000 2.922 2.811 3.113 . 0 0 "[ . 1 . ]" 1
576 1 8 ARG HA 1 11 ILE HB 0.000 . 3.200 3.192 3.104 3.224 0.024 3 0 "[ . 1 . ]" 1
577 1 9 PRO HA 1 12 GLU H 0.000 . 3.600 3.344 3.257 3.419 . 0 0 "[ . 1 . ]" 1
578 1 9 PRO HA 1 12 GLU HB2 0.000 . 2.700 2.399 2.270 2.469 . 0 0 "[ . 1 . ]" 1
579 1 9 PRO HA 1 12 GLU HB3 0.000 . 4.000 3.970 3.820 4.018 0.018 10 0 "[ . 1 . ]" 1
580 1 10 ILE H 1 12 GLU H 3.200 3.200 5.000 3.978 3.912 4.041 . 0 0 "[ . 1 . ]" 1
581 1 7 THR HA 1 10 ILE H 0.000 . 4.500 3.822 3.598 4.237 . 0 0 "[ . 1 . ]" 1
582 1 11 ILE HA 1 14 SER HG 0.000 . 4.000 2.897 2.024 3.525 . 0 0 "[ . 1 . ]" 1
583 1 8 ARG HA 1 11 ILE H 0.000 . 4.000 3.539 3.452 3.655 . 0 0 "[ . 1 . ]" 1
584 1 12 GLU H 1 14 SER H 3.200 3.200 5.000 4.251 4.194 4.296 . 0 0 "[ . 1 . ]" 1
585 1 10 ILE HA 1 13 LEU H 0.000 . 3.600 3.549 3.412 3.618 0.018 3 0 "[ . 1 . ]" 1
586 1 9 PRO HA 1 13 LEU H 0.000 . 4.500 4.093 3.950 4.250 . 0 0 "[ . 1 . ]" 1
587 1 10 ILE HA 1 13 LEU HB2 0.000 . 3.200 2.949 2.761 3.098 . 0 0 "[ . 1 . ]" 1
588 1 13 LEU H 1 15 ASN H 3.200 3.200 5.000 4.186 4.103 4.225 . 0 0 "[ . 1 . ]" 1
589 1 10 ILE HA 1 13 LEU MD1 0.000 . 4.000 2.473 2.237 2.690 . 0 0 "[ . 1 . ]" 1
590 1 10 ILE MG 1 13 LEU H 0.000 . 5.800 4.783 4.709 4.832 . 0 0 "[ . 1 . ]" 1
591 1 11 ILE HA 1 14 SER H 0.000 . 4.000 3.563 3.434 3.639 . 0 0 "[ . 1 . ]" 1
592 1 10 ILE HA 1 14 SER H 0.000 . 5.000 4.253 4.122 4.347 . 0 0 "[ . 1 . ]" 1
593 1 14 SER HA 1 17 ALA MB 0.000 . 4.000 2.757 2.658 2.869 . 0 0 "[ . 1 . ]" 1
594 1 15 ASN H 1 17 ALA H 3.200 3.200 5.000 4.191 4.100 4.276 . 0 0 "[ . 1 . ]" 1
595 1 12 GLU HA 1 15 ASN H 0.000 . 3.600 3.633 3.604 3.652 0.052 16 0 "[ . 1 . ]" 1
596 1 11 ILE MG 1 15 ASN HB3 0.000 . 5.800 4.869 4.857 4.896 . 0 0 "[ . 1 . ]" 1
597 1 12 GLU HA 1 15 ASN HD21 0.000 . 4.000 2.996 2.708 3.904 . 0 0 "[ . 1 . ]" 1
598 1 11 ILE MG 1 15 ASN HD21 0.000 . 4.000 2.338 2.034 2.612 . 0 0 "[ . 1 . ]" 1
599 1 11 ILE MG 1 15 ASN HB2 0.000 . 4.800 3.952 3.814 4.015 . 0 0 "[ . 1 . ]" 1
600 1 11 ILE HA 1 15 ASN H 0.000 . 4.500 4.098 4.044 4.156 . 0 0 "[ . 1 . ]" 1
601 1 11 ILE MG 1 15 ASN HD22 0.000 . 3.200 2.140 1.955 2.518 . 0 0 "[ . 1 . ]" 1
602 1 13 LEU HA 1 16 THR HB 0.000 . 3.200 3.149 3.056 3.211 0.011 10 0 "[ . 1 . ]" 1
603 1 16 THR HA 1 19 LYS QG 0.000 . 4.800 3.185 2.877 3.557 . 0 0 "[ . 1 . ]" 1
604 1 16 THR HA 1 19 LYS HB2 0.000 . 3.500 2.870 2.689 2.999 . 0 0 "[ . 1 . ]" 1
605 1 16 THR HA 1 19 LYS QD 0.000 . 4.000 2.598 2.208 2.857 . 0 0 "[ . 1 . ]" 1
606 1 13 LEU HA 1 16 THR H 0.000 . 3.600 3.623 3.582 3.643 0.043 16 0 "[ . 1 . ]" 1
607 1 16 THR MG 1 20 ILE MD 0.000 . 4.800 2.592 2.283 2.864 . 0 0 "[ . 1 . ]" 1
608 1 16 THR H 1 18 ASP H 3.200 3.200 5.000 4.248 4.192 4.313 . 0 0 "[ . 1 . ]" 1
609 1 16 THR H 1 19 LYS QD 0.000 . 5.800 4.953 4.497 5.168 . 0 0 "[ . 1 . ]" 1
610 1 12 GLU HA 1 16 THR H 0.000 . 4.500 4.161 4.105 4.195 . 0 0 "[ . 1 . ]" 1
611 1 16 THR H 1 19 LYS QG 0.000 . 5.800 4.873 4.658 5.122 . 0 0 "[ . 1 . ]" 1
612 1 14 SER HA 1 17 ALA H 0.000 . 3.600 3.612 3.548 3.632 0.032 16 0 "[ . 1 . ]" 1
613 1 17 ALA H 1 19 LYS H 3.200 3.200 5.000 4.228 4.165 4.292 . 0 0 "[ . 1 . ]" 1
614 1 13 LEU HA 1 17 ALA H 0.000 . 4.500 4.253 4.146 4.342 . 0 0 "[ . 1 . ]" 1
615 1 15 ASN HA 1 18 ASP H 0.000 . 3.600 3.568 3.487 3.614 0.014 16 0 "[ . 1 . ]" 1
616 1 14 SER HA 1 18 ASP H 0.000 . 4.500 4.379 4.279 4.428 . 0 0 "[ . 1 . ]" 1
617 1 19 LYS H 1 21 ALA H 3.200 3.200 5.000 4.322 4.230 4.399 . 0 0 "[ . 1 . ]" 1
618 1 15 ASN HA 1 19 LYS H 0.000 . 4.500 4.468 4.318 4.510 0.010 10 0 "[ . 1 . ]" 1
619 1 16 THR HA 1 19 LYS H 0.000 . 3.600 3.465 3.328 3.587 . 0 0 "[ . 1 . ]" 1
620 1 20 ILE H 1 22 GLU H 3.200 3.200 5.000 4.181 4.135 4.242 . 0 0 "[ . 1 . ]" 1
621 1 17 ALA HA 1 20 ILE H 0.000 . 3.600 3.491 3.418 3.570 . 0 0 "[ . 1 . ]" 1
622 1 16 THR MG 1 20 ILE H 0.000 . 5.300 4.239 4.115 4.333 . 0 0 "[ . 1 . ]" 1
623 1 16 THR HA 1 20 ILE H 0.000 . 4.500 4.463 4.382 4.507 0.007 3 0 "[ . 1 . ]" 1
624 1 17 ALA HA 1 20 ILE HB 0.000 . 3.000 3.014 2.989 3.029 0.029 7 0 "[ . 1 . ]" 1
625 1 18 ASP HA 1 21 ALA H 0.000 . 3.600 3.505 3.408 3.602 0.002 15 0 "[ . 1 . ]" 1
626 1 17 ALA HA 1 21 ALA H 0.000 . 4.500 4.354 4.262 4.418 . 0 0 "[ . 1 . ]" 1
627 1 21 ALA H 1 23 GLY H 3.200 3.200 5.000 4.248 4.204 4.275 . 0 0 "[ . 1 . ]" 1
628 1 22 GLU H 1 24 ASN H 3.200 3.200 5.000 3.840 3.773 3.920 . 0 0 "[ . 1 . ]" 1
629 1 19 LYS HA 1 22 GLU H 0.000 . 4.000 3.677 3.627 3.714 . 0 0 "[ . 1 . ]" 1
630 1 23 GLY HA2 1 25 LEU MD2 0.000 . 4.000 3.276 3.070 3.350 . 0 0 "[ . 1 . ]" 1
631 1 23 GLY H 1 25 LEU MD2 0.000 . 4.800 4.013 3.996 4.028 . 0 0 "[ . 1 . ]" 1
632 1 20 ILE HA 1 23 GLY H 0.000 . 4.000 3.860 3.759 3.956 . 0 0 "[ . 1 . ]" 1
633 1 20 ILE HA 1 24 ASN H 0.000 . 3.200 3.212 3.188 3.230 0.030 15 0 "[ . 1 . ]" 1
634 1 23 GLY HA2 1 25 LEU H 0.000 . 4.500 4.336 4.288 4.384 . 0 0 "[ . 1 . ]" 1
635 1 23 GLY HA2 1 25 LEU HG 0.000 . 4.000 3.827 3.669 3.957 . 0 0 "[ . 1 . ]" 1
636 1 24 ASN HA 1 26 GLU H 0.000 . 4.000 3.356 3.268 3.421 . 0 0 "[ . 1 . ]" 1
637 1 24 ASN HB3 1 26 GLU H 0.000 . 4.500 3.720 3.533 3.855 . 0 0 "[ . 1 . ]" 1
638 1 24 ASN HB3 1 27 ALA H 0.000 . 4.000 3.173 2.961 3.301 . 0 0 "[ . 1 . ]" 1
639 1 25 LEU HA 1 27 ALA H 0.000 . 4.000 3.924 3.756 4.027 0.027 4 0 "[ . 1 . ]" 1
640 1 24 ASN HB3 1 27 ALA MB 0.000 . 4.000 2.671 2.382 3.008 . 0 0 "[ . 1 . ]" 1
641 1 29 VAL H 1 32 GLN HE22 0.000 . 4.000 3.377 2.927 3.728 . 0 0 "[ . 1 . ]" 1
642 1 29 VAL H 1 32 GLN HE21 0.000 . 3.200 2.994 2.756 3.238 0.038 8 0 "[ . 1 . ]" 1
643 1 29 VAL MG2 1 32 GLN HE21 0.000 . 4.800 3.911 3.496 4.000 . 0 0 "[ . 1 . ]" 1
644 1 31 HIS HB3 1 34 ARG HB2 0.000 . 3.200 3.133 2.954 3.206 0.006 16 0 "[ . 1 . ]" 1
645 1 28 GLU HA 1 32 GLN HE22 0.000 . 5.000 4.509 4.010 4.978 . 0 0 "[ . 1 . ]" 1
646 1 30 PRO HA 1 32 GLN H 0.000 . 4.000 3.374 3.302 3.437 . 0 0 "[ . 1 . ]" 1
647 1 29 VAL HB 1 32 GLN HE22 2.700 2.700 4.000 3.400 2.985 3.992 . 0 0 "[ . 1 . ]" 1
648 1 29 VAL HB 1 32 GLN HE21 2.700 2.700 4.000 2.719 2.669 2.790 0.031 8 0 "[ . 1 . ]" 1
649 1 31 HIS HA 1 33 ASN H 0.000 . 4.000 3.495 3.392 3.648 . 0 0 "[ . 1 . ]" 1
650 1 34 ARG HD2 1 38 ILE MG 0.000 . 4.800 3.531 3.324 3.751 . 0 0 "[ . 1 . ]" 1
651 1 34 ARG HE 1 38 ILE MG 0.000 . 4.800 3.859 3.774 3.925 . 0 0 "[ . 1 . ]" 1
652 1 34 ARG HD3 1 38 ILE MG 0.000 . 3.600 2.699 2.518 2.883 . 0 0 "[ . 1 . ]" 1
653 1 31 HIS HA 1 34 ARG HD3 0.000 . 4.000 4.011 3.954 4.039 0.039 8 0 "[ . 1 . ]" 1
654 1 31 HIS HA 1 34 ARG HD2 0.000 . 4.000 3.699 3.512 3.812 . 0 0 "[ . 1 . ]" 1
655 1 34 ARG HD3 1 38 ILE HB 0.000 . 4.000 2.409 2.273 2.572 . 0 0 "[ . 1 . ]" 1
656 1 32 GLN HA 1 34 ARG H 0.000 . 4.000 3.987 3.930 4.032 0.032 8 0 "[ . 1 . ]" 1
657 1 34 ARG HD2 1 38 ILE HB 0.000 . 4.000 3.847 3.740 3.962 . 0 0 "[ . 1 . ]" 1
658 1 34 ARG HB3 1 36 ASP H 0.000 . 3.000 2.848 2.786 2.908 . 0 0 "[ . 1 . ]" 1
659 1 34 ARG HA 1 36 ASP H 0.000 . 4.500 3.973 3.895 4.059 . 0 0 "[ . 1 . ]" 1
660 1 38 ILE HA 1 41 LEU HB2 0.000 . 4.000 3.353 3.069 3.532 . 0 0 "[ . 1 . ]" 1
661 1 34 ARG HE 1 38 ILE HB 2.700 2.700 4.000 2.652 2.635 2.670 0.065 9 0 "[ . 1 . ]" 1
662 1 34 ARG QD 1 38 ILE H 0.000 . 5.800 4.625 4.530 4.700 . 0 0 "[ . 1 . ]" 1
663 1 38 ILE HA 1 41 LEU HB3 0.000 . 3.200 2.733 2.489 2.858 . 0 0 "[ . 1 . ]" 1
664 1 34 ARG QB 1 38 ILE H 0.000 . 4.800 4.323 4.299 4.347 . 0 0 "[ . 1 . ]" 1
665 1 36 ASP HB2 1 38 ILE H 0.000 . 4.000 3.517 3.354 3.677 . 0 0 "[ . 1 . ]" 1
666 1 37 GLU HA 1 40 ILE H 0.000 . 3.600 3.420 3.333 3.512 . 0 0 "[ . 1 . ]" 1
667 1 37 GLU HA 1 40 ILE HB 0.000 . 3.200 2.970 2.828 3.094 . 0 0 "[ . 1 . ]" 1
668 1 40 ILE H 1 42 ALA H 3.200 3.200 5.000 4.202 4.090 4.258 . 0 0 "[ . 1 . ]" 1
669 1 41 LEU H 1 43 LYS H 3.200 3.200 5.000 4.230 4.143 4.321 . 0 0 "[ . 1 . ]" 1
670 1 38 ILE HA 1 41 LEU H 0.000 . 3.600 3.400 3.306 3.479 . 0 0 "[ . 1 . ]" 1
671 1 37 GLU HA 1 41 LEU H 0.000 . 4.500 4.253 4.184 4.344 . 0 0 "[ . 1 . ]" 1
672 1 38 ILE MG 1 42 ALA H 0.000 . 4.800 3.996 3.940 4.031 . 0 0 "[ . 1 . ]" 1
673 1 42 ALA HA 1 45 ILE HB 0.000 . 3.200 3.156 3.074 3.208 0.008 1 0 "[ . 1 . ]" 1
674 1 42 ALA H 1 44 SER H 3.200 3.200 5.000 4.202 4.150 4.250 . 0 0 "[ . 1 . ]" 1
675 1 38 ILE HA 1 42 ALA H 0.000 . 4.500 4.238 4.155 4.327 . 0 0 "[ . 1 . ]" 1
676 1 39 GLY HA2 1 42 ALA MB 0.000 . 4.000 2.701 2.527 2.831 . 0 0 "[ . 1 . ]" 1
677 1 39 GLY HA2 1 42 ALA H 0.000 . 4.000 3.503 3.344 3.601 . 0 0 "[ . 1 . ]" 1
678 1 40 ILE HA 1 43 LYS QD 0.000 . 4.000 2.658 2.019 3.136 . 0 0 "[ . 1 . ]" 1
679 1 39 GLY HA2 1 43 LYS H 0.000 . 4.500 4.369 4.263 4.464 . 0 0 "[ . 1 . ]" 1
680 1 40 ILE HA 1 43 LYS HB2 0.000 . 3.200 2.685 2.505 2.854 . 0 0 "[ . 1 . ]" 1
681 1 39 GLY HA3 1 43 LYS QE 0.000 . 4.800 3.950 3.378 4.249 . 0 0 "[ . 1 . ]" 1
682 1 40 ILE HA 1 43 LYS H 0.000 . 4.000 3.380 3.253 3.482 . 0 0 "[ . 1 . ]" 1
683 1 40 ILE HA 1 43 LYS QE 0.000 . 4.800 3.631 3.013 4.100 . 0 0 "[ . 1 . ]" 1
684 1 41 LEU HA 1 44 SER H 0.000 . 3.600 3.473 3.367 3.542 . 0 0 "[ . 1 . ]" 1
685 1 45 ILE H 1 47 ARG H 3.200 3.200 5.000 4.164 4.099 4.256 . 0 0 "[ . 1 . ]" 1
686 1 42 ALA HA 1 45 ILE H 0.000 . 3.600 3.605 3.561 3.626 0.026 17 0 "[ . 1 . ]" 1
687 1 43 LYS HA 1 46 GLU H 0.000 . 3.600 3.433 3.332 3.561 . 0 0 "[ . 1 . ]" 1
688 1 42 ALA HA 1 46 GLU H 0.000 . 4.500 4.414 4.329 4.496 . 0 0 "[ . 1 . ]" 1
689 1 44 SER HA 1 47 ARG QD 0.000 . 3.600 2.677 2.181 3.207 . 0 0 "[ . 1 . ]" 1
690 1 44 SER HA 1 47 ARG QG 0.000 . 4.800 3.157 2.928 3.378 . 0 0 "[ . 1 . ]" 1
691 1 43 LYS HA 1 47 ARG H 0.000 . 4.500 4.342 4.254 4.415 . 0 0 "[ . 1 . ]" 1
692 1 44 SER HA 1 47 ARG HB2 0.000 . 3.200 2.776 2.668 2.942 . 0 0 "[ . 1 . ]" 1
693 1 47 ARG H 1 49 ARG H 3.200 3.200 5.000 4.157 4.106 4.226 . 0 0 "[ . 1 . ]" 1
694 1 44 SER HA 1 47 ARG H 0.000 . 3.600 3.370 3.224 3.552 . 0 0 "[ . 1 . ]" 1
695 1 45 ILE HA 1 48 LEU H 0.000 . 3.600 3.425 3.354 3.545 . 0 0 "[ . 1 . ]" 1
696 1 45 ILE HA 1 48 LEU QB 0.000 . 3.200 2.970 2.881 3.029 . 0 0 "[ . 1 . ]" 1
697 1 45 ILE HA 1 48 LEU QD 0.000 . 4.800 2.013 1.952 2.117 . 0 0 "[ . 1 . ]" 1
698 1 48 LEU H 1 50 ARG H 3.200 3.200 5.000 4.172 4.082 4.248 . 0 0 "[ . 1 . ]" 1
699 1 44 SER HA 1 48 LEU H 0.000 . 4.500 4.463 4.394 4.508 0.008 15 0 "[ . 1 . ]" 1
700 1 46 GLU HA 1 49 ARG HB3 0.000 . 3.200 2.845 2.693 2.980 . 0 0 "[ . 1 . ]" 1
701 1 46 GLU HA 1 49 ARG H 0.000 . 3.600 3.357 3.274 3.410 . 0 0 "[ . 1 . ]" 1
702 1 45 ILE MG 1 49 ARG H 0.000 . 5.300 4.100 3.938 4.202 . 0 0 "[ . 1 . ]" 1
703 1 49 ARG HA 1 52 LEU MD1 0.000 . 4.200 2.756 2.446 3.111 . 0 0 "[ . 1 . ]" 1
704 1 49 ARG H 1 51 SER H 3.200 3.200 5.000 4.276 4.184 4.336 . 0 0 "[ . 1 . ]" 1
705 1 45 ILE HA 1 49 ARG H 0.000 . 4.500 4.357 4.244 4.428 . 0 0 "[ . 1 . ]" 1
706 1 46 GLU HA 1 49 ARG HB2 0.000 . 4.000 3.016 2.916 3.125 . 0 0 "[ . 1 . ]" 1
707 1 47 ARG HA 1 50 ARG H 0.000 . 3.600 3.430 3.378 3.503 . 0 0 "[ . 1 . ]" 1
708 1 46 GLU HA 1 50 ARG H 0.000 . 4.500 4.273 4.174 4.374 . 0 0 "[ . 1 . ]" 1
709 1 50 ARG H 1 52 LEU H 3.200 3.200 5.000 4.317 4.262 4.401 . 0 0 "[ . 1 . ]" 1
710 1 47 ARG HA 1 51 SER H 0.000 . 4.500 4.426 4.369 4.500 0.000 4 0 "[ . 1 . ]" 1
711 1 51 SER H 1 53 LYS H 3.200 3.200 5.000 4.265 4.212 4.314 . 0 0 "[ . 1 . ]" 1
712 1 48 LEU HA 1 51 SER H 0.000 . 3.600 3.468 3.395 3.590 . 0 0 "[ . 1 . ]" 1
713 1 52 LEU HA 1 55 LEU QB 0.000 . 4.000 2.828 2.665 2.892 . 0 0 "[ . 1 . ]" 1
714 1 52 LEU QD 1 55 LEU QB 0.000 . 5.500 3.587 3.440 3.647 . 0 0 "[ . 1 . ]" 1
715 1 48 LEU HA 1 52 LEU H 0.000 . 4.500 4.390 4.282 4.456 . 0 0 "[ . 1 . ]" 1
716 1 49 ARG HA 1 52 LEU H 0.000 . 4.000 3.658 3.538 3.747 . 0 0 "[ . 1 . ]" 1
717 1 49 ARG HA 1 52 LEU HB2 0.000 . 3.200 2.994 2.840 3.139 . 0 0 "[ . 1 . ]" 1
718 1 50 ARG HA 1 53 LYS H 0.000 . 3.600 3.624 3.599 3.665 0.065 18 0 "[ . 1 . ]" 1
719 1 53 LYS H 1 55 LEU H 3.200 3.200 5.000 4.314 4.213 4.387 . 0 0 "[ . 1 . ]" 1
720 1 50 ARG HA 1 53 LYS QB 0.000 . 4.000 2.883 2.797 2.977 . 0 0 "[ . 1 . ]" 1
721 1 54 GLN H 1 56 ALA H 3.200 3.200 5.000 4.188 4.060 4.278 . 0 0 "[ . 1 . ]" 1
722 1 54 GLN HA 1 57 ASP QB 0.000 . 4.000 2.828 2.658 2.967 . 0 0 "[ . 1 . ]" 1
723 1 51 SER HA 1 54 GLN H 0.000 . 3.600 3.640 3.619 3.664 0.064 11 0 "[ . 1 . ]" 1
724 1 55 LEU H 1 57 ASP H 3.200 3.200 5.000 4.383 4.321 4.441 . 0 0 "[ . 1 . ]" 1
725 1 51 SER HA 1 55 LEU H 0.000 . 4.500 4.246 4.176 4.320 . 0 0 "[ . 1 . ]" 1
726 1 52 LEU HA 1 55 LEU H 0.000 . 3.600 3.604 3.527 3.628 0.028 8 0 "[ . 1 . ]" 1
727 1 52 LEU HA 1 56 ALA H 0.000 . 4.500 4.351 4.294 4.425 . 0 0 "[ . 1 . ]" 1
728 1 53 LYS HA 1 56 ALA H 0.000 . 3.600 3.610 3.529 3.632 0.032 4 0 "[ . 1 . ]" 1
729 1 54 GLN HA 1 57 ASP H 0.000 . 3.600 3.620 3.602 3.651 0.051 14 0 "[ . 1 . ]" 1
730 1 60 THR HA 1 63 MET ME 0.000 . 4.800 3.795 3.439 3.996 . 0 0 "[ . 1 . ]" 1
731 1 74 LEU HA 1 77 ILE H 0.000 . 4.000 3.734 3.529 3.851 . 0 0 "[ . 1 . ]" 1
732 1 75 THR HA 1 78 ARG H 0.000 . 4.000 3.547 3.374 3.624 . 0 0 "[ . 1 . ]" 1
733 1 76 ARG HA 1 79 LEU H 0.000 . 4.000 3.662 3.461 3.834 . 0 0 "[ . 1 . ]" 1
734 1 77 ILE HA 1 80 ALA H 0.000 . 4.000 3.553 3.419 3.668 . 0 0 "[ . 1 . ]" 1
735 1 77 ILE HA 1 80 ALA MB 0.000 . 3.500 2.784 2.540 2.919 . 0 0 "[ . 1 . ]" 1
736 1 81 THR HA 1 84 MET QG 0.000 . 4.000 2.953 2.360 3.183 . 0 0 "[ . 1 . ]" 1
737 1 77 ILE MG 1 81 THR H 0.000 . 4.800 3.936 3.834 4.007 . 0 0 "[ . 1 . ]" 1
738 1 78 ARG HA 1 81 THR H 0.000 . 4.000 3.792 3.683 3.930 . 0 0 "[ . 1 . ]" 1
739 1 79 LEU HA 1 82 GLU H 0.000 . 4.000 3.696 3.430 3.869 . 0 0 "[ . 1 . ]" 1
740 1 80 ALA HA 1 83 MET H 0.000 . 4.000 3.506 3.368 3.682 . 0 0 "[ . 1 . ]" 1
741 1 81 THR HA 1 84 MET H 0.000 . 4.000 3.515 3.369 3.779 . 0 0 "[ . 1 . ]" 1
742 1 85 SER QB 1 88 ASP H 0.000 . 4.800 4.104 3.901 4.271 . 0 0 "[ . 1 . ]" 1
743 1 88 ASP HA 1 91 LEU QD 0.000 . 4.000 3.242 3.052 3.333 . 0 0 "[ . 1 . ]" 1
744 1 88 ASP HA 1 91 LEU QB 3.200 3.200 5.000 3.690 3.294 3.931 . 0 0 "[ . 1 . ]" 1
745 1 84 MET ME 1 88 ASP HA 0.000 . 4.800 3.981 3.889 4.016 . 0 0 "[ . 1 . ]" 1
746 1 88 ASP HA 1 91 LEU HG 3.200 3.200 5.000 4.332 4.053 4.627 . 0 0 "[ . 1 . ]" 1
747 1 89 GLY HA2 1 92 ALA MB 0.000 . 4.000 2.412 2.208 2.690 . 0 0 "[ . 1 . ]" 1
748 1 87 GLN HA 1 89 GLY H 0.000 . 4.000 3.913 3.711 4.000 . 0 0 "[ . 1 . ]" 1
749 1 86 GLU HA 1 89 GLY H 0.000 . 4.500 3.462 3.220 3.672 . 0 0 "[ . 1 . ]" 1
750 1 88 ASP HA 1 90 TYR QD 0.000 . 4.000 3.863 3.386 3.957 . 0 0 "[ . 1 . ]" 1
751 1 88 ASP HA 1 90 TYR QE 0.000 . 3.500 3.298 2.672 3.459 . 0 0 "[ . 1 . ]" 1
752 1 88 ASP HA 1 91 LEU H 0.000 . 4.000 3.571 3.349 3.694 . 0 0 "[ . 1 . ]" 1
753 1 89 GLY HA2 1 92 ALA H 0.000 . 3.500 3.273 3.199 3.372 . 0 0 "[ . 1 . ]" 1
754 1 92 ALA HA 1 95 ILE HB 0.000 . 3.500 3.115 2.860 3.235 . 0 0 "[ . 1 . ]" 1
755 1 89 GLY HA2 1 93 GLU H 0.000 . 4.500 4.230 3.939 4.431 . 0 0 "[ . 1 . ]" 1
756 1 90 TYR HA 1 93 GLU H 0.000 . 3.500 3.326 3.103 3.507 0.007 16 0 "[ . 1 . ]" 1
757 1 91 LEU HA 1 94 SER H 0.000 . 3.500 3.534 3.492 3.567 0.067 1 0 "[ . 1 . ]" 1
758 1 92 ALA HA 1 95 ILE H 0.000 . 3.500 3.499 3.416 3.546 0.046 1 0 "[ . 1 . ]" 1
759 1 93 GLU HA 1 96 ASN H 0.000 . 3.500 3.513 3.434 3.539 0.039 13 0 "[ . 1 . ]" 1
760 1 94 SER HA 1 97 LYS H 0.000 . 3.500 3.528 3.509 3.545 0.045 5 0 "[ . 1 . ]" 1
761 1 95 ILE HA 1 98 ASP H 0.000 . 3.500 3.372 3.269 3.446 . 0 0 "[ . 1 . ]" 1
762 1 105 ILE MG 1 109 PHE HE2 0.000 . 4.000 2.173 1.984 2.359 . 0 0 "[ . 1 . ]" 1
763 1 105 ILE MG 1 109 PHE HD2 0.000 . 4.300 2.454 2.150 2.686 . 0 0 "[ . 1 . ]" 1
764 1 106 ILE HA 1 109 PHE HD2 2.700 2.700 4.000 2.908 2.725 3.166 . 0 0 "[ . 1 . ]" 1
765 2 6 ILE HA 2 9 PRO QD 0.000 . 4.000 2.874 2.757 3.089 . 0 0 "[ . 1 . ]" 1
766 2 8 ARG HA 2 11 ILE HB 0.000 . 3.200 3.206 3.139 3.232 0.032 9 0 "[ . 1 . ]" 1
767 2 9 PRO HA 2 12 GLU H 0.000 . 3.600 3.312 3.194 3.454 . 0 0 "[ . 1 . ]" 1
768 2 9 PRO HA 2 12 GLU HB2 0.000 . 2.700 2.416 2.292 2.559 . 0 0 "[ . 1 . ]" 1
769 2 9 PRO HA 2 12 GLU HB3 0.000 . 4.000 3.968 3.831 4.020 0.020 11 0 "[ . 1 . ]" 1
770 2 10 ILE H 2 12 GLU H 3.200 3.200 5.000 3.944 3.892 4.004 . 0 0 "[ . 1 . ]" 1
771 2 7 THR HA 2 10 ILE H 0.000 . 4.500 3.996 3.726 4.250 . 0 0 "[ . 1 . ]" 1
772 2 11 ILE HA 2 14 SER HG 0.000 . 4.000 2.738 2.021 3.247 . 0 0 "[ . 1 . ]" 1
773 2 8 ARG HA 2 11 ILE H 0.000 . 4.000 3.607 3.405 3.756 . 0 0 "[ . 1 . ]" 1
774 2 12 GLU H 2 14 SER H 3.200 3.200 5.000 4.242 4.158 4.368 . 0 0 "[ . 1 . ]" 1
775 2 10 ILE HA 2 13 LEU H 0.000 . 3.600 3.537 3.422 3.613 0.013 12 0 "[ . 1 . ]" 1
776 2 9 PRO HA 2 13 LEU H 0.000 . 4.500 4.133 3.992 4.264 . 0 0 "[ . 1 . ]" 1
777 2 10 ILE HA 2 13 LEU HB2 0.000 . 3.200 3.010 2.721 3.119 . 0 0 "[ . 1 . ]" 1
778 2 13 LEU H 2 15 ASN H 3.200 3.200 5.000 4.176 4.107 4.270 . 0 0 "[ . 1 . ]" 1
779 2 10 ILE HA 2 13 LEU MD1 0.000 . 4.000 2.570 2.277 2.795 . 0 0 "[ . 1 . ]" 1
780 2 10 ILE MG 2 13 LEU H 0.000 . 5.800 4.782 4.686 4.837 . 0 0 "[ . 1 . ]" 1
781 2 11 ILE HA 2 14 SER H 0.000 . 4.000 3.612 3.495 3.710 . 0 0 "[ . 1 . ]" 1
782 2 10 ILE HA 2 14 SER H 0.000 . 5.000 4.250 4.015 4.359 . 0 0 "[ . 1 . ]" 1
783 2 14 SER HA 2 17 ALA MB 0.000 . 4.000 2.709 2.599 2.829 . 0 0 "[ . 1 . ]" 1
784 2 15 ASN H 2 17 ALA H 3.200 3.200 5.000 4.174 4.089 4.264 . 0 0 "[ . 1 . ]" 1
785 2 12 GLU HA 2 15 ASN H 0.000 . 3.600 3.638 3.624 3.660 0.060 10 0 "[ . 1 . ]" 1
786 2 11 ILE MG 2 15 ASN HB3 0.000 . 5.800 4.864 4.846 4.882 . 0 0 "[ . 1 . ]" 1
787 2 12 GLU HA 2 15 ASN HD21 0.000 . 4.000 2.909 2.765 3.338 . 0 0 "[ . 1 . ]" 1
788 2 11 ILE MG 2 15 ASN HD21 0.000 . 4.000 2.336 1.999 2.800 . 0 0 "[ . 1 . ]" 1
789 2 11 ILE MG 2 15 ASN HB2 0.000 . 4.800 3.988 3.920 4.021 . 0 0 "[ . 1 . ]" 1
790 2 11 ILE HA 2 15 ASN H 0.000 . 4.500 4.103 3.979 4.194 . 0 0 "[ . 1 . ]" 1
791 2 11 ILE MG 2 15 ASN HD22 0.000 . 3.200 2.077 1.927 2.378 . 0 0 "[ . 1 . ]" 1
792 2 13 LEU HA 2 16 THR HB 0.000 . 3.200 3.155 2.923 3.212 0.012 18 0 "[ . 1 . ]" 1
793 2 16 THR HA 2 19 LYS QG 0.000 . 4.800 3.156 2.917 3.514 . 0 0 "[ . 1 . ]" 1
794 2 16 THR HA 2 19 LYS HB2 0.000 . 3.500 2.866 2.654 2.997 . 0 0 "[ . 1 . ]" 1
795 2 16 THR HA 2 19 LYS QD 0.000 . 4.000 2.597 2.103 2.879 . 0 0 "[ . 1 . ]" 1
796 2 13 LEU HA 2 16 THR H 0.000 . 3.600 3.620 3.572 3.640 0.040 15 0 "[ . 1 . ]" 1
797 2 16 THR MG 2 20 ILE MD 0.000 . 4.800 2.551 2.382 2.733 . 0 0 "[ . 1 . ]" 1
798 2 16 THR H 2 18 ASP H 3.200 3.200 5.000 4.248 4.140 4.305 . 0 0 "[ . 1 . ]" 1
799 2 16 THR H 2 19 LYS QD 0.000 . 5.800 4.954 4.548 5.151 . 0 0 "[ . 1 . ]" 1
800 2 12 GLU HA 2 16 THR H 0.000 . 4.500 4.177 4.097 4.236 . 0 0 "[ . 1 . ]" 1
801 2 16 THR H 2 19 LYS QG 0.000 . 5.800 4.876 4.703 5.078 . 0 0 "[ . 1 . ]" 1
802 2 14 SER HA 2 17 ALA H 0.000 . 3.600 3.610 3.532 3.626 0.026 8 0 "[ . 1 . ]" 1
803 2 17 ALA H 2 19 LYS H 3.200 3.200 5.000 4.229 4.118 4.312 . 0 0 "[ . 1 . ]" 1
804 2 13 LEU HA 2 17 ALA H 0.000 . 4.500 4.245 4.165 4.335 . 0 0 "[ . 1 . ]" 1
805 2 15 ASN HA 2 18 ASP H 0.000 . 3.600 3.566 3.472 3.611 0.011 5 0 "[ . 1 . ]" 1
806 2 14 SER HA 2 18 ASP H 0.000 . 4.500 4.376 4.264 4.495 . 0 0 "[ . 1 . ]" 1
807 2 19 LYS H 2 21 ALA H 3.200 3.200 5.000 4.328 4.264 4.384 . 0 0 "[ . 1 . ]" 1
808 2 15 ASN HA 2 19 LYS H 0.000 . 4.500 4.491 4.409 4.530 0.030 17 0 "[ . 1 . ]" 1
809 2 16 THR HA 2 19 LYS H 0.000 . 3.600 3.453 3.396 3.536 . 0 0 "[ . 1 . ]" 1
810 2 20 ILE H 2 22 GLU H 3.200 3.200 5.000 4.184 4.116 4.250 . 0 0 "[ . 1 . ]" 1
811 2 17 ALA HA 2 20 ILE H 0.000 . 3.600 3.473 3.410 3.532 . 0 0 "[ . 1 . ]" 1
812 2 16 THR MG 2 20 ILE H 0.000 . 5.300 4.218 4.009 4.383 . 0 0 "[ . 1 . ]" 1
813 2 16 THR HA 2 20 ILE H 0.000 . 4.500 4.462 4.365 4.514 0.014 16 0 "[ . 1 . ]" 1
814 2 17 ALA HA 2 20 ILE HB 0.000 . 3.000 3.002 2.948 3.017 0.017 4 0 "[ . 1 . ]" 1
815 2 18 ASP HA 2 21 ALA H 0.000 . 3.600 3.506 3.431 3.612 0.012 1 0 "[ . 1 . ]" 1
816 2 17 ALA HA 2 21 ALA H 0.000 . 4.500 4.335 4.257 4.390 . 0 0 "[ . 1 . ]" 1
817 2 21 ALA H 2 23 GLY H 3.200 3.200 5.000 4.244 4.211 4.279 . 0 0 "[ . 1 . ]" 1
818 2 22 GLU H 2 24 ASN H 3.200 3.200 5.000 3.840 3.776 3.900 . 0 0 "[ . 1 . ]" 1
819 2 19 LYS HA 2 22 GLU H 0.000 . 4.000 3.700 3.653 3.751 . 0 0 "[ . 1 . ]" 1
820 2 23 GLY HA2 2 25 LEU MD2 0.000 . 4.000 3.218 2.931 3.346 . 0 0 "[ . 1 . ]" 1
821 2 23 GLY H 2 25 LEU MD2 0.000 . 4.800 4.008 3.853 4.035 . 0 0 "[ . 1 . ]" 1
822 2 20 ILE HA 2 23 GLY H 0.000 . 4.000 3.837 3.772 3.906 . 0 0 "[ . 1 . ]" 1
823 2 20 ILE HA 2 24 ASN H 0.000 . 3.200 3.182 3.031 3.241 0.041 4 0 "[ . 1 . ]" 1
824 2 23 GLY HA2 2 25 LEU H 0.000 . 4.500 4.153 3.970 4.351 . 0 0 "[ . 1 . ]" 1
825 2 23 GLY HA2 2 25 LEU HG 0.000 . 4.000 3.547 3.279 3.817 . 0 0 "[ . 1 . ]" 1
826 2 24 ASN HA 2 26 GLU H 0.000 . 4.000 3.386 3.271 3.514 . 0 0 "[ . 1 . ]" 1
827 2 24 ASN HB3 2 26 GLU H 0.000 . 4.500 3.783 3.557 3.978 . 0 0 "[ . 1 . ]" 1
828 2 24 ASN HB3 2 27 ALA H 0.000 . 4.000 3.221 3.026 3.499 . 0 0 "[ . 1 . ]" 1
829 2 25 LEU HA 2 27 ALA H 0.000 . 4.000 3.909 3.622 4.012 0.012 3 0 "[ . 1 . ]" 1
830 2 24 ASN HB3 2 27 ALA MB 0.000 . 4.000 2.673 2.274 3.137 . 0 0 "[ . 1 . ]" 1
831 2 29 VAL H 2 32 GLN HE22 0.000 . 4.000 3.560 3.124 3.949 . 0 0 "[ . 1 . ]" 1
832 2 29 VAL H 2 32 GLN HE21 0.000 . 3.200 3.010 2.812 3.233 0.033 8 0 "[ . 1 . ]" 1
833 2 29 VAL MG2 2 32 GLN HE21 0.000 . 4.800 3.873 3.414 3.999 . 0 0 "[ . 1 . ]" 1
834 2 31 HIS HB3 2 34 ARG HB2 0.000 . 3.200 2.969 2.605 3.173 . 0 0 "[ . 1 . ]" 1
835 2 28 GLU HA 2 32 GLN HE22 0.000 . 5.000 4.709 3.975 5.003 0.003 14 0 "[ . 1 . ]" 1
836 2 30 PRO HA 2 32 GLN H 0.000 . 4.000 3.362 3.284 3.469 . 0 0 "[ . 1 . ]" 1
837 2 29 VAL HB 2 32 GLN HE22 2.700 2.700 4.000 3.524 3.054 3.973 . 0 0 "[ . 1 . ]" 1
838 2 29 VAL HB 2 32 GLN HE21 2.700 2.700 4.000 2.721 2.669 2.852 0.031 8 0 "[ . 1 . ]" 1
839 2 31 HIS HA 2 33 ASN H 0.000 . 4.000 3.409 3.314 3.524 . 0 0 "[ . 1 . ]" 1
840 2 34 ARG HD2 2 38 ILE MG 0.000 . 4.800 3.646 3.394 3.841 . 0 0 "[ . 1 . ]" 1
841 2 34 ARG HE 2 38 ILE MG 0.000 . 4.800 3.831 3.728 3.911 . 0 0 "[ . 1 . ]" 1
842 2 34 ARG HD3 2 38 ILE MG 0.000 . 3.600 2.823 2.494 2.984 . 0 0 "[ . 1 . ]" 1
843 2 31 HIS HA 2 34 ARG HD3 0.000 . 4.000 4.027 3.952 4.229 0.229 6 0 "[ . 1 . ]" 1
844 2 31 HIS HA 2 34 ARG HD2 0.000 . 4.000 3.720 3.551 3.912 . 0 0 "[ . 1 . ]" 1
845 2 34 ARG HD3 2 38 ILE HB 0.000 . 4.000 2.535 2.407 2.628 . 0 0 "[ . 1 . ]" 1
846 2 32 GLN HA 2 34 ARG H 0.000 . 4.000 3.958 3.863 4.026 0.026 12 0 "[ . 1 . ]" 1
847 2 34 ARG HD2 2 38 ILE HB 0.000 . 4.000 3.961 3.829 4.012 0.012 18 0 "[ . 1 . ]" 1
848 2 34 ARG HB3 2 36 ASP H 0.000 . 3.000 2.829 2.636 2.999 . 0 0 "[ . 1 . ]" 1
849 2 34 ARG HA 2 36 ASP H 0.000 . 4.500 3.915 3.798 3.974 . 0 0 "[ . 1 . ]" 1
850 2 38 ILE HA 2 41 LEU HB2 0.000 . 4.000 3.357 3.133 3.513 . 0 0 "[ . 1 . ]" 1
851 2 34 ARG HE 2 38 ILE HB 2.700 2.700 4.000 2.656 2.630 2.675 0.070 6 0 "[ . 1 . ]" 1
852 2 34 ARG QD 2 38 ILE H 0.000 . 5.800 4.702 4.544 4.775 . 0 0 "[ . 1 . ]" 1
853 2 38 ILE HA 2 41 LEU HB3 0.000 . 3.200 2.794 2.598 2.907 . 0 0 "[ . 1 . ]" 1
854 2 34 ARG QB 2 38 ILE H 0.000 . 4.800 4.335 4.313 4.351 . 0 0 "[ . 1 . ]" 1
855 2 36 ASP HB2 2 38 ILE H 0.000 . 4.000 3.455 3.293 3.637 . 0 0 "[ . 1 . ]" 1
856 2 37 GLU HA 2 40 ILE H 0.000 . 3.600 3.516 3.351 3.623 0.023 12 0 "[ . 1 . ]" 1
857 2 37 GLU HA 2 40 ILE HB 0.000 . 3.200 2.878 2.777 3.061 . 0 0 "[ . 1 . ]" 1
858 2 40 ILE H 2 42 ALA H 3.200 3.200 5.000 4.050 3.911 4.117 . 0 0 "[ . 1 . ]" 1
859 2 41 LEU H 2 43 LYS H 3.200 3.200 5.000 4.249 4.194 4.325 . 0 0 "[ . 1 . ]" 1
860 2 38 ILE HA 2 41 LEU H 0.000 . 3.600 3.384 3.193 3.520 . 0 0 "[ . 1 . ]" 1
861 2 37 GLU HA 2 41 LEU H 0.000 . 4.500 4.300 4.216 4.463 . 0 0 "[ . 1 . ]" 1
862 2 38 ILE MG 2 42 ALA H 0.000 . 4.800 4.002 3.915 4.018 . 0 0 "[ . 1 . ]" 1
863 2 42 ALA HA 2 45 ILE HB 0.000 . 3.200 3.114 3.020 3.182 . 0 0 "[ . 1 . ]" 1
864 2 42 ALA H 2 44 SER H 3.200 3.200 5.000 4.188 4.087 4.245 . 0 0 "[ . 1 . ]" 1
865 2 38 ILE HA 2 42 ALA H 0.000 . 4.500 4.352 4.254 4.407 . 0 0 "[ . 1 . ]" 1
866 2 39 GLY HA2 2 42 ALA MB 0.000 . 4.000 2.417 2.158 2.567 . 0 0 "[ . 1 . ]" 1
867 2 39 GLY HA2 2 42 ALA H 0.000 . 4.000 3.156 3.077 3.221 . 0 0 "[ . 1 . ]" 1
868 2 40 ILE HA 2 43 LYS QD 0.000 . 4.000 2.488 2.015 3.046 . 0 0 "[ . 1 . ]" 1
869 2 39 GLY HA2 2 43 LYS H 0.000 . 4.500 4.280 4.183 4.352 . 0 0 "[ . 1 . ]" 1
870 2 40 ILE HA 2 43 LYS HB2 0.000 . 3.200 2.738 2.563 2.919 . 0 0 "[ . 1 . ]" 1
871 2 39 GLY HA3 2 43 LYS QE 0.000 . 4.800 4.096 3.609 4.290 . 0 0 "[ . 1 . ]" 1
872 2 40 ILE HA 2 43 LYS H 0.000 . 4.000 3.306 3.230 3.378 . 0 0 "[ . 1 . ]" 1
873 2 40 ILE HA 2 43 LYS QE 0.000 . 4.800 3.475 2.842 4.036 . 0 0 "[ . 1 . ]" 1
874 2 41 LEU HA 2 44 SER H 0.000 . 3.600 3.391 3.276 3.470 . 0 0 "[ . 1 . ]" 1
875 2 45 ILE H 2 47 ARG H 3.200 3.200 5.000 4.186 4.098 4.249 . 0 0 "[ . 1 . ]" 1
876 2 42 ALA HA 2 45 ILE H 0.000 . 3.600 3.594 3.547 3.619 0.019 8 0 "[ . 1 . ]" 1
877 2 43 LYS HA 2 46 GLU H 0.000 . 3.600 3.406 3.304 3.479 . 0 0 "[ . 1 . ]" 1
878 2 42 ALA HA 2 46 GLU H 0.000 . 4.500 4.421 4.311 4.494 . 0 0 "[ . 1 . ]" 1
879 2 44 SER HA 2 47 ARG QD 0.000 . 3.600 2.694 2.193 3.181 . 0 0 "[ . 1 . ]" 1
880 2 44 SER HA 2 47 ARG QG 0.000 . 4.800 3.092 2.690 3.465 . 0 0 "[ . 1 . ]" 1
881 2 43 LYS HA 2 47 ARG H 0.000 . 4.500 4.365 4.310 4.451 . 0 0 "[ . 1 . ]" 1
882 2 44 SER HA 2 47 ARG HB2 0.000 . 3.200 2.796 2.554 2.939 . 0 0 "[ . 1 . ]" 1
883 2 47 ARG H 2 49 ARG H 3.200 3.200 5.000 4.140 4.079 4.180 . 0 0 "[ . 1 . ]" 1
884 2 44 SER HA 2 47 ARG H 0.000 . 3.600 3.339 3.244 3.406 . 0 0 "[ . 1 . ]" 1
885 2 45 ILE HA 2 48 LEU H 0.000 . 3.600 3.417 3.325 3.520 . 0 0 "[ . 1 . ]" 1
886 2 45 ILE HA 2 48 LEU QB 0.000 . 3.200 2.898 2.721 3.025 . 0 0 "[ . 1 . ]" 1
887 2 45 ILE HA 2 48 LEU QD 0.000 . 4.800 2.018 1.974 2.276 . 0 0 "[ . 1 . ]" 1
888 2 48 LEU H 2 50 ARG H 3.200 3.200 5.000 4.159 4.068 4.241 . 0 0 "[ . 1 . ]" 1
889 2 44 SER HA 2 48 LEU H 0.000 . 4.500 4.429 4.349 4.492 . 0 0 "[ . 1 . ]" 1
890 2 46 GLU HA 2 49 ARG HB3 0.000 . 3.200 2.814 2.730 2.921 . 0 0 "[ . 1 . ]" 1
891 2 46 GLU HA 2 49 ARG H 0.000 . 3.600 3.369 3.296 3.460 . 0 0 "[ . 1 . ]" 1
892 2 45 ILE MG 2 49 ARG H 0.000 . 5.300 4.072 4.016 4.147 . 0 0 "[ . 1 . ]" 1
893 2 49 ARG HA 2 52 LEU MD1 0.000 . 4.200 2.719 2.488 2.997 . 0 0 "[ . 1 . ]" 1
894 2 49 ARG H 2 51 SER H 3.200 3.200 5.000 4.288 4.208 4.420 . 0 0 "[ . 1 . ]" 1
895 2 45 ILE HA 2 49 ARG H 0.000 . 4.500 4.290 4.195 4.396 . 0 0 "[ . 1 . ]" 1
896 2 46 GLU HA 2 49 ARG HB2 0.000 . 4.000 3.001 2.855 3.091 . 0 0 "[ . 1 . ]" 1
897 2 47 ARG HA 2 50 ARG H 0.000 . 3.600 3.423 3.316 3.507 . 0 0 "[ . 1 . ]" 1
898 2 46 GLU HA 2 50 ARG H 0.000 . 4.500 4.275 4.156 4.369 . 0 0 "[ . 1 . ]" 1
899 2 50 ARG H 2 52 LEU H 3.200 3.200 5.000 4.314 4.244 4.381 . 0 0 "[ . 1 . ]" 1
900 2 47 ARG HA 2 51 SER H 0.000 . 4.500 4.454 4.382 4.509 0.009 16 0 "[ . 1 . ]" 1
901 2 51 SER H 2 53 LYS H 3.200 3.200 5.000 4.245 4.093 4.358 . 0 0 "[ . 1 . ]" 1
902 2 48 LEU HA 2 51 SER H 0.000 . 3.600 3.465 3.348 3.563 . 0 0 "[ . 1 . ]" 1
903 2 52 LEU HA 2 55 LEU QB 0.000 . 4.000 2.811 2.672 2.968 . 0 0 "[ . 1 . ]" 1
904 2 52 LEU QD 2 55 LEU QB 0.000 . 5.500 3.581 3.474 3.644 . 0 0 "[ . 1 . ]" 1
905 2 48 LEU HA 2 52 LEU H 0.000 . 4.500 4.412 4.329 4.485 . 0 0 "[ . 1 . ]" 1
906 2 49 ARG HA 2 52 LEU H 0.000 . 4.000 3.654 3.568 3.765 . 0 0 "[ . 1 . ]" 1
907 2 49 ARG HA 2 52 LEU HB2 0.000 . 3.200 3.000 2.876 3.151 . 0 0 "[ . 1 . ]" 1
908 2 50 ARG HA 2 53 LYS H 0.000 . 3.600 3.609 3.539 3.646 0.046 8 0 "[ . 1 . ]" 1
909 2 53 LYS H 2 55 LEU H 3.200 3.200 5.000 4.282 4.207 4.356 . 0 0 "[ . 1 . ]" 1
910 2 50 ARG HA 2 53 LYS QB 0.000 . 4.000 2.861 2.636 3.004 . 0 0 "[ . 1 . ]" 1
911 2 54 GLN H 2 56 ALA H 3.200 3.200 5.000 4.205 4.128 4.260 . 0 0 "[ . 1 . ]" 1
912 2 54 GLN HA 2 57 ASP QB 0.000 . 4.000 2.786 2.614 2.940 . 0 0 "[ . 1 . ]" 1
913 2 51 SER HA 2 54 GLN H 0.000 . 3.600 3.635 3.599 3.655 0.055 9 0 "[ . 1 . ]" 1
914 2 55 LEU H 2 57 ASP H 3.200 3.200 5.000 4.372 4.284 4.455 . 0 0 "[ . 1 . ]" 1
915 2 51 SER HA 2 55 LEU H 0.000 . 4.500 4.229 4.125 4.353 . 0 0 "[ . 1 . ]" 1
916 2 52 LEU HA 2 55 LEU H 0.000 . 3.600 3.611 3.479 3.645 0.045 16 0 "[ . 1 . ]" 1
917 2 52 LEU HA 2 56 ALA H 0.000 . 4.500 4.333 4.250 4.411 . 0 0 "[ . 1 . ]" 1
918 2 53 LYS HA 2 56 ALA H 0.000 . 3.600 3.620 3.536 3.657 0.057 6 0 "[ . 1 . ]" 1
919 2 54 GLN HA 2 57 ASP H 0.000 . 3.600 3.608 3.554 3.655 0.055 6 0 "[ . 1 . ]" 1
920 2 60 THR HA 2 63 MET ME 0.000 . 4.800 3.812 3.289 3.990 . 0 0 "[ . 1 . ]" 1
921 2 74 LEU HA 2 77 ILE H 0.000 . 4.000 3.778 3.656 3.882 . 0 0 "[ . 1 . ]" 1
922 2 75 THR HA 2 78 ARG H 0.000 . 4.000 3.597 3.426 3.693 . 0 0 "[ . 1 . ]" 1
923 2 76 ARG HA 2 79 LEU H 0.000 . 4.000 3.743 3.565 3.859 . 0 0 "[ . 1 . ]" 1
924 2 77 ILE HA 2 80 ALA H 0.000 . 4.000 3.580 3.478 3.676 . 0 0 "[ . 1 . ]" 1
925 2 77 ILE HA 2 80 ALA MB 0.000 . 3.500 2.727 2.539 2.901 . 0 0 "[ . 1 . ]" 1
926 2 81 THR HA 2 84 MET QG 0.000 . 4.000 2.925 2.117 3.141 . 0 0 "[ . 1 . ]" 1
927 2 77 ILE MG 2 81 THR H 0.000 . 4.800 3.989 3.902 4.027 . 0 0 "[ . 1 . ]" 1
928 2 78 ARG HA 2 81 THR H 0.000 . 4.000 3.767 3.642 3.988 . 0 0 "[ . 1 . ]" 1
929 2 79 LEU HA 2 82 GLU H 0.000 . 4.000 3.583 3.391 3.816 . 0 0 "[ . 1 . ]" 1
930 2 80 ALA HA 2 83 MET H 0.000 . 4.000 3.574 3.454 3.742 . 0 0 "[ . 1 . ]" 1
931 2 81 THR HA 2 84 MET H 0.000 . 4.000 3.528 3.376 3.675 . 0 0 "[ . 1 . ]" 1
932 2 85 SER QB 2 88 ASP H 0.000 . 4.800 4.101 3.686 4.259 . 0 0 "[ . 1 . ]" 1
933 2 88 ASP HA 2 91 LEU QD 0.000 . 4.000 3.202 2.994 3.315 . 0 0 "[ . 1 . ]" 1
934 2 88 ASP HA 2 91 LEU HB3 3.200 3.200 5.000 5.340 5.083 5.642 0.642 18 1 "[ . 1 . +]" 1
935 2 84 MET ME 2 88 ASP HA 0.000 . 4.800 3.999 3.979 4.018 . 0 0 "[ . 1 . ]" 1
936 2 88 ASP HA 2 91 LEU HG 3.200 3.200 5.000 4.288 4.094 4.522 . 0 0 "[ . 1 . ]" 1
937 2 89 GLY HA2 2 92 ALA MB 0.000 . 4.000 2.381 2.110 2.618 . 0 0 "[ . 1 . ]" 1
938 2 87 GLN HA 2 89 GLY H 0.000 . 4.000 3.876 3.668 3.981 . 0 0 "[ . 1 . ]" 1
939 2 86 GLU HA 2 89 GLY H 0.000 . 4.500 3.583 3.422 3.828 . 0 0 "[ . 1 . ]" 1
940 2 88 ASP HA 2 90 TYR QD 0.000 . 4.000 3.791 3.393 3.934 . 0 0 "[ . 1 . ]" 1
941 2 88 ASP HA 2 90 TYR QE 0.000 . 3.500 3.344 3.016 3.474 . 0 0 "[ . 1 . ]" 1
942 2 88 ASP HA 2 91 LEU H 0.000 . 4.000 3.489 3.336 3.595 . 0 0 "[ . 1 . ]" 1
943 2 89 GLY HA2 2 92 ALA H 0.000 . 3.500 3.251 3.126 3.342 . 0 0 "[ . 1 . ]" 1
944 2 92 ALA HA 2 95 ILE HB 0.000 . 3.500 3.092 3.025 3.178 . 0 0 "[ . 1 . ]" 1
945 2 89 GLY HA2 2 93 GLU H 0.000 . 4.500 4.018 3.828 4.383 . 0 0 "[ . 1 . ]" 1
946 2 90 TYR HA 2 93 GLU H 0.000 . 3.500 3.445 3.360 3.523 0.023 18 0 "[ . 1 . ]" 1
947 2 91 LEU HA 2 94 SER H 0.000 . 3.500 3.518 3.476 3.552 0.052 18 0 "[ . 1 . ]" 1
948 2 92 ALA HA 2 95 ILE H 0.000 . 3.500 3.518 3.507 3.548 0.048 10 0 "[ . 1 . ]" 1
949 2 93 GLU HA 2 96 ASN H 0.000 . 3.500 3.508 3.354 3.534 0.034 8 0 "[ . 1 . ]" 1
950 2 94 SER HA 2 97 LYS H 0.000 . 3.500 3.523 3.467 3.550 0.050 7 0 "[ . 1 . ]" 1
951 2 95 ILE HA 2 98 ASP H 0.000 . 3.500 3.344 3.263 3.447 . 0 0 "[ . 1 . ]" 1
952 2 105 ILE MG 2 109 PHE HE2 0.000 . 4.000 2.129 1.963 2.396 . 0 0 "[ . 1 . ]" 1
953 2 105 ILE MG 2 109 PHE HD2 0.000 . 4.300 2.413 2.196 2.760 . 0 0 "[ . 1 . ]" 1
954 2 106 ILE HA 2 109 PHE HD2 2.700 2.700 4.000 2.896 2.694 3.196 0.006 7 0 "[ . 1 . ]" 1
955 1 9 PRO HB2 1 38 ILE MG 0.000 . 3.500 2.344 2.067 2.533 . 0 0 "[ . 1 . ]" 1
956 1 9 PRO HA 1 31 HIS HD2 0.000 . 4.000 3.938 3.685 4.017 0.017 13 0 "[ . 1 . ]" 1
957 1 9 PRO HB3 1 38 ILE MG 0.000 . 4.800 3.240 2.830 3.463 . 0 0 "[ . 1 . ]" 1
958 1 13 LEU MD1 1 31 HIS HD2 0.000 . 4.000 2.851 2.711 2.960 . 0 0 "[ . 1 . ]" 1
959 1 13 LEU HG 1 31 HIS HD2 0.000 . 2.700 2.056 2.019 2.115 . 0 0 "[ . 1 . ]" 1
960 1 13 LEU HA 1 31 HIS HD2 0.000 . 4.000 4.003 3.888 4.033 0.033 13 0 "[ . 1 . ]" 1
961 1 13 LEU MD2 1 31 HIS HD2 0.000 . 4.800 2.447 2.104 2.931 . 0 0 "[ . 1 . ]" 1
962 1 13 LEU H 1 31 HIS HD2 0.000 . 4.000 3.923 3.756 4.007 0.007 1 0 "[ . 1 . ]" 1
963 1 16 THR MG 1 30 PRO QG 0.000 . 4.800 3.532 3.420 3.583 . 0 0 "[ . 1 . ]" 1
964 1 16 THR MG 1 29 VAL MG2 0.000 . 4.800 2.534 2.178 2.855 . 0 0 "[ . 1 . ]" 1
965 1 19 LYS HA 1 24 ASN H 0.000 . 5.000 4.557 4.439 4.643 . 0 0 "[ . 1 . ]" 1
966 1 20 ILE QG 1 27 ALA MB 0.000 . 4.000 2.530 2.101 2.936 . 0 0 "[ . 1 . ]" 1
967 1 16 THR MG 1 27 ALA MB 0.000 . 4.800 2.765 2.516 3.148 . 0 0 "[ . 1 . ]" 1
968 1 27 ALA H 1 49 ARG HD2 0.000 . 4.000 3.667 3.234 4.000 0.000 6 0 "[ . 1 . ]" 1
969 1 19 LYS HD2 1 27 ALA MB 0.000 . 4.000 3.245 3.002 3.331 . 0 0 "[ . 1 . ]" 1
970 1 16 THR MG 1 29 VAL HA 0.000 . 3.500 1.997 1.876 2.169 . 0 0 "[ . 1 . ]" 1
971 1 16 THR MG 1 30 PRO HD3 0.000 . 4.000 2.032 1.987 2.217 . 0 0 "[ . 1 . ]" 1
972 1 13 LEU H 1 30 PRO HG2 0.000 . 4.500 4.243 4.029 4.416 . 0 0 "[ . 1 . ]" 1
973 1 12 GLU HB2 1 31 HIS HD2 0.000 . 4.000 3.573 3.337 3.882 . 0 0 "[ . 1 . ]" 1
974 1 31 HIS HB3 1 38 ILE MG 0.000 . 4.000 2.787 2.576 3.052 . 0 0 "[ . 1 . ]" 1
975 1 31 HIS HB2 1 42 ALA MB 0.000 . 4.000 2.174 2.031 2.432 . 0 0 "[ . 1 . ]" 1
976 1 31 HIS HB2 1 38 ILE MG 0.000 . 4.800 3.204 2.967 3.518 . 0 0 "[ . 1 . ]" 1
977 1 12 GLU HB3 1 31 HIS HD2 0.000 . 4.000 3.842 3.642 3.999 . 0 0 "[ . 1 . ]" 1
978 1 32 GLN H 1 42 ALA MB 0.000 . 4.800 3.344 3.192 3.646 . 0 0 "[ . 1 . ]" 1
979 1 34 ARG HB2 1 39 GLY HA2 0.000 . 3.200 2.037 2.010 2.115 . 0 0 "[ . 1 . ]" 1
980 1 34 ARG H 1 39 GLY HA3 0.000 . 4.000 3.837 3.622 3.965 . 0 0 "[ . 1 . ]" 1
981 1 34 ARG HD3 1 39 GLY H 0.000 . 4.000 3.695 3.565 3.795 . 0 0 "[ . 1 . ]" 1
982 1 34 ARG HB3 1 39 GLY HA2 0.000 . 4.000 3.363 3.223 3.527 . 0 0 "[ . 1 . ]" 1
983 1 34 ARG H 1 39 GLY HA2 0.000 . 4.000 3.458 3.320 3.561 . 0 0 "[ . 1 . ]" 1
984 1 34 ARG HB3 1 39 GLY HA3 0.000 . 4.000 2.898 2.723 3.068 . 0 0 "[ . 1 . ]" 1
985 1 34 ARG HB2 1 39 GLY HA3 0.000 . 3.200 2.396 2.267 2.478 . 0 0 "[ . 1 . ]" 1
986 1 10 ILE QG 1 38 ILE MD 0.000 . 4.800 3.549 3.380 3.580 . 0 0 "[ . 1 . ]" 1
987 1 13 LEU MD1 1 38 ILE MG 0.000 . 4.800 2.121 1.931 2.388 . 0 0 "[ . 1 . ]" 1
988 1 31 HIS HD2 1 38 ILE MG 0.000 . 4.800 3.784 3.561 3.992 . 0 0 "[ . 1 . ]" 1
989 1 34 ARG HE 1 39 GLY H 0.000 . 4.000 3.766 3.659 3.816 . 0 0 "[ . 1 . ]" 1
990 1 34 ARG QB 1 39 GLY H 0.000 . 4.000 2.685 2.643 2.722 . 0 0 "[ . 1 . ]" 1
991 1 31 HIS HB3 1 42 ALA MB 0.000 . 4.800 3.243 3.112 3.391 . 0 0 "[ . 1 . ]" 1
992 1 13 LEU MD2 1 42 ALA MB 0.000 . 4.800 2.352 2.060 2.652 . 0 0 "[ . 1 . ]" 1
993 1 17 ALA H 1 45 ILE MD 0.000 . 5.800 3.889 3.722 4.143 . 0 0 "[ . 1 . ]" 1
994 1 29 VAL MG2 1 45 ILE H 0.000 . 5.800 4.760 4.455 4.843 . 0 0 "[ . 1 . ]" 1
995 1 16 THR MG 1 45 ILE MG 0.000 . 5.600 3.364 3.062 3.702 . 0 0 "[ . 1 . ]" 1
996 1 13 LEU MD2 1 45 ILE H 0.000 . 5.800 4.772 4.665 4.832 . 0 0 "[ . 1 . ]" 1
997 1 17 ALA H 1 45 ILE MG 0.000 . 4.800 3.749 3.597 3.945 . 0 0 "[ . 1 . ]" 1
998 1 16 THR HB 1 45 ILE MG 0.000 . 4.800 3.533 3.304 3.904 . 0 0 "[ . 1 . ]" 1
999 1 29 VAL MG1 1 45 ILE H 0.000 . 5.800 3.887 3.767 3.998 . 0 0 "[ . 1 . ]" 1
1000 1 17 ALA MB 1 45 ILE MD 0.000 . 4.000 2.782 2.759 2.791 . 0 0 "[ . 1 . ]" 1
1001 1 17 ALA MB 1 45 ILE MG 0.000 . 5.100 2.550 2.390 2.810 . 0 0 "[ . 1 . ]" 1
1002 1 29 VAL MG1 1 46 GLU H 0.000 . 4.800 3.083 2.942 3.269 . 0 0 "[ . 1 . ]" 1
1003 1 29 VAL MG2 1 46 GLU H 0.000 . 4.800 3.047 2.939 3.210 . 0 0 "[ . 1 . ]" 1
1004 1 32 GLN HE22 1 46 GLU HG2 0.000 . 5.000 3.609 3.249 3.754 . 0 0 "[ . 1 . ]" 1
1005 1 32 GLN HE22 1 46 GLU HG3 0.000 . 5.000 4.927 4.633 5.020 0.020 8 0 "[ . 1 . ]" 1
1006 1 29 VAL MG2 1 49 ARG HE 0.000 . 4.000 2.527 2.256 2.767 . 0 0 "[ . 1 . ]" 1
1007 1 29 VAL MG2 1 49 ARG HB2 0.000 . 4.000 3.318 3.250 3.360 . 0 0 "[ . 1 . ]" 1
1008 1 29 VAL MG2 1 49 ARG H 0.000 . 5.300 4.412 4.352 4.442 . 0 0 "[ . 1 . ]" 1
1009 1 20 ILE MG 1 49 ARG H 0.000 . 4.800 3.992 3.863 4.031 . 0 0 "[ . 1 . ]" 1
1010 1 20 ILE MD 1 49 ARG HB2 0.000 . 4.000 2.429 2.141 2.762 . 0 0 "[ . 1 . ]" 1
1011 1 20 ILE MD 1 49 ARG H 0.000 . 4.800 3.834 3.635 4.004 . 0 0 "[ . 1 . ]" 1
1012 1 20 ILE MD 1 49 ARG HD2 0.000 . 4.800 3.442 3.280 3.573 . 0 0 "[ . 1 . ]" 1
1013 1 29 VAL MG2 1 49 ARG HB3 0.000 . 4.800 3.839 3.708 3.944 . 0 0 "[ . 1 . ]" 1
1014 1 29 VAL MG2 1 49 ARG HD3 0.000 . 4.800 2.932 2.750 3.020 . 0 0 "[ . 1 . ]" 1
1015 1 20 ILE HG12 1 49 ARG HD3 0.000 . 4.000 2.561 2.306 2.731 . 0 0 "[ . 1 . ]" 1
1016 1 20 ILE MG 1 52 LEU MD1 0.000 . 4.800 2.212 1.956 2.484 . 0 0 "[ . 1 . ]" 1
1017 1 25 LEU MD1 1 57 ASP H 0.000 . 5.800 4.862 4.839 4.887 . 0 0 "[ . 1 . ]" 1
1018 1 67 SER QB 1 106 ILE MG 0.000 . 5.100 2.541 1.950 3.503 . 0 0 "[ . 1 . ]" 1
1019 1 81 THR HB 1 92 ALA MB 0.000 . 3.500 2.836 2.565 2.927 . 0 0 "[ . 1 . ]" 1
1020 1 81 THR MG 1 95 ILE HB 0.000 . 3.500 2.426 2.181 2.622 . 0 0 "[ . 1 . ]" 1
1021 1 81 THR MG 1 95 ILE MG 0.000 . 3.800 2.292 1.969 2.535 . 0 0 "[ . 1 . ]" 1
1022 1 84 MET ME 1 91 LEU QB 3.500 3.500 5.000 2.807 2.707 3.041 0.793 4 17 [*-*+*****1********] 1
1023 1 84 MET QB 1 92 ALA MB 0.000 . 4.200 2.832 2.400 3.030 . 0 0 "[ . 1 . ]" 1
1024 1 81 THR MG 1 96 ASN H 0.000 . 4.800 3.942 3.708 4.018 . 0 0 "[ . 1 . ]" 1
1025 1 74 LEU MD1 1 102 CYS HB3 0.000 . 4.200 2.973 2.483 3.434 . 0 0 "[ . 1 . ]" 1
1026 1 67 SER HA 1 106 ILE MG 0.000 . 4.000 2.877 2.433 3.351 . 0 0 "[ . 1 . ]" 1
1027 2 9 PRO HB2 2 38 ILE MG 0.000 . 3.500 2.354 2.141 2.502 . 0 0 "[ . 1 . ]" 1
1028 2 9 PRO HA 2 31 HIS HD2 0.000 . 4.000 3.950 3.594 4.024 0.024 15 0 "[ . 1 . ]" 1
1029 2 9 PRO HB3 2 38 ILE MG 0.000 . 4.800 3.371 3.000 3.682 . 0 0 "[ . 1 . ]" 1
1030 2 13 LEU MD1 2 31 HIS HD2 0.000 . 4.000 2.931 2.773 3.177 . 0 0 "[ . 1 . ]" 1
1031 2 13 LEU HG 2 31 HIS HD2 0.000 . 2.700 2.083 2.020 2.244 . 0 0 "[ . 1 . ]" 1
1032 2 13 LEU HA 2 31 HIS HD2 0.000 . 4.000 4.004 3.933 4.030 0.030 8 0 "[ . 1 . ]" 1
1033 2 13 LEU MD2 2 31 HIS HD2 0.000 . 4.800 2.533 2.205 2.964 . 0 0 "[ . 1 . ]" 1
1034 2 13 LEU H 2 31 HIS HD2 0.000 . 4.000 3.851 3.701 4.002 0.002 12 0 "[ . 1 . ]" 1
1035 2 16 THR MG 2 30 PRO QG 0.000 . 4.800 3.534 3.426 3.568 . 0 0 "[ . 1 . ]" 1
1036 2 16 THR MG 2 29 VAL MG2 0.000 . 4.800 2.585 2.304 3.034 . 0 0 "[ . 1 . ]" 1
1037 2 19 LYS HA 2 24 ASN H 0.000 . 5.000 4.568 4.486 4.643 . 0 0 "[ . 1 . ]" 1
1038 2 20 ILE QG 2 27 ALA MB 0.000 . 4.000 2.641 2.222 2.955 . 0 0 "[ . 1 . ]" 1
1039 2 16 THR MG 2 27 ALA MB 0.000 . 4.800 2.798 2.564 3.266 . 0 0 "[ . 1 . ]" 1
1040 2 27 ALA H 2 49 ARG HD2 0.000 . 4.000 3.809 3.474 4.007 0.007 13 0 "[ . 1 . ]" 1
1041 2 19 LYS HD2 2 27 ALA MB 0.000 . 4.000 3.212 3.023 3.336 . 0 0 "[ . 1 . ]" 1
1042 2 16 THR MG 2 29 VAL HA 0.000 . 3.500 1.983 1.905 2.063 . 0 0 "[ . 1 . ]" 1
1043 2 16 THR MG 2 30 PRO HD3 0.000 . 4.000 2.019 1.984 2.161 . 0 0 "[ . 1 . ]" 1
1044 2 13 LEU H 2 30 PRO HG2 0.000 . 4.500 4.212 3.950 4.412 . 0 0 "[ . 1 . ]" 1
1045 2 12 GLU HB2 2 31 HIS HD2 0.000 . 4.000 3.383 3.062 3.742 . 0 0 "[ . 1 . ]" 1
1046 2 31 HIS HB3 2 38 ILE MG 0.000 . 4.000 3.145 2.900 3.288 . 0 0 "[ . 1 . ]" 1
1047 2 31 HIS HB2 2 42 ALA MB 0.000 . 4.000 2.308 2.088 2.630 . 0 0 "[ . 1 . ]" 1
1048 2 31 HIS HB2 2 38 ILE MG 0.000 . 4.800 3.451 3.347 3.594 . 0 0 "[ . 1 . ]" 1
1049 2 12 GLU HB3 2 31 HIS HD2 0.000 . 4.000 3.714 3.422 3.908 . 0 0 "[ . 1 . ]" 1
1050 2 32 GLN H 2 42 ALA MB 0.000 . 4.800 3.423 3.234 3.714 . 0 0 "[ . 1 . ]" 1
1051 2 34 ARG HB2 2 39 GLY HA2 0.000 . 3.200 2.324 2.236 2.461 . 0 0 "[ . 1 . ]" 1
1052 2 34 ARG H 2 39 GLY HA3 0.000 . 4.000 3.574 3.451 3.828 . 0 0 "[ . 1 . ]" 1
1053 2 34 ARG HD3 2 39 GLY H 0.000 . 4.000 3.549 3.453 3.754 . 0 0 "[ . 1 . ]" 1
1054 2 34 ARG HB3 2 39 GLY HA2 0.000 . 4.000 3.617 3.393 3.795 . 0 0 "[ . 1 . ]" 1
1055 2 34 ARG H 2 39 GLY HA2 0.000 . 4.000 3.807 3.676 3.996 . 0 0 "[ . 1 . ]" 1
1056 2 34 ARG HB3 2 39 GLY HA3 0.000 . 4.000 2.753 2.497 2.954 . 0 0 "[ . 1 . ]" 1
1057 2 34 ARG HB2 2 39 GLY HA3 0.000 . 3.200 2.053 2.017 2.178 . 0 0 "[ . 1 . ]" 1
1058 2 10 ILE QG 2 38 ILE MD 0.000 . 4.800 3.559 3.462 3.590 . 0 0 "[ . 1 . ]" 1
1059 2 13 LEU MD1 2 38 ILE MG 0.000 . 4.800 1.999 1.856 2.136 . 0 0 "[ . 1 . ]" 1
1060 2 31 HIS HD2 2 38 ILE MG 0.000 . 4.800 3.881 3.736 4.002 . 0 0 "[ . 1 . ]" 1
1061 2 34 ARG HE 2 39 GLY H 0.000 . 4.000 3.658 3.581 3.743 . 0 0 "[ . 1 . ]" 1
1062 2 34 ARG QB 2 39 GLY H 0.000 . 4.000 2.632 2.553 2.693 . 0 0 "[ . 1 . ]" 1
1063 2 31 HIS HB3 2 42 ALA MB 0.000 . 4.800 3.311 3.077 3.504 . 0 0 "[ . 1 . ]" 1
1064 2 13 LEU MD2 2 42 ALA MB 0.000 . 4.800 2.347 2.033 2.729 . 0 0 "[ . 1 . ]" 1
1065 2 17 ALA H 2 45 ILE MD 0.000 . 5.800 3.867 3.659 4.089 . 0 0 "[ . 1 . ]" 1
1066 2 29 VAL MG2 2 45 ILE H 0.000 . 5.800 4.786 4.552 4.850 . 0 0 "[ . 1 . ]" 1
1067 2 16 THR MG 2 45 ILE MG 0.000 . 5.600 3.348 2.954 3.611 . 0 0 "[ . 1 . ]" 1
1068 2 13 LEU MD2 2 45 ILE H 0.000 . 5.800 4.771 4.625 4.835 . 0 0 "[ . 1 . ]" 1
1069 2 17 ALA H 2 45 ILE MG 0.000 . 4.800 3.746 3.549 3.993 . 0 0 "[ . 1 . ]" 1
1070 2 16 THR HB 2 45 ILE MG 0.000 . 4.800 3.522 3.253 3.737 . 0 0 "[ . 1 . ]" 1
1071 2 29 VAL MG1 2 45 ILE H 0.000 . 5.800 3.896 3.787 4.075 . 0 0 "[ . 1 . ]" 1
1072 2 17 ALA MB 2 45 ILE MD 0.000 . 4.000 2.780 2.749 2.792 . 0 0 "[ . 1 . ]" 1
1073 2 17 ALA MB 2 45 ILE MG 0.000 . 5.100 2.557 2.323 2.758 . 0 0 "[ . 1 . ]" 1
1074 2 29 VAL MG1 2 46 GLU H 0.000 . 4.800 3.117 2.929 3.497 . 0 0 "[ . 1 . ]" 1
1075 2 29 VAL MG2 2 46 GLU H 0.000 . 4.800 3.084 2.874 3.244 . 0 0 "[ . 1 . ]" 1
1076 2 32 GLN HE22 2 46 GLU HG2 0.000 . 5.000 3.628 3.420 3.823 . 0 0 "[ . 1 . ]" 1
1077 2 32 GLN HE22 2 46 GLU HG3 0.000 . 5.000 4.956 4.725 5.018 0.018 17 0 "[ . 1 . ]" 1
1078 2 29 VAL MG2 2 49 ARG HE 0.000 . 4.000 2.479 2.261 2.796 . 0 0 "[ . 1 . ]" 1
1079 2 29 VAL MG2 2 49 ARG HB2 0.000 . 4.000 3.285 3.122 3.362 . 0 0 "[ . 1 . ]" 1
1080 2 29 VAL MG2 2 49 ARG H 0.000 . 5.300 4.412 4.316 4.458 . 0 0 "[ . 1 . ]" 1
1081 2 20 ILE MG 2 49 ARG H 0.000 . 4.800 3.985 3.866 4.021 . 0 0 "[ . 1 . ]" 1
1082 2 20 ILE MD 2 49 ARG HB2 0.000 . 4.000 2.429 2.151 2.859 . 0 0 "[ . 1 . ]" 1
1083 2 20 ILE MD 2 49 ARG H 0.000 . 4.800 3.827 3.612 3.971 . 0 0 "[ . 1 . ]" 1
1084 2 20 ILE MD 2 49 ARG HD2 0.000 . 4.800 3.446 3.232 3.891 . 0 0 "[ . 1 . ]" 1
1085 2 29 VAL MG2 2 49 ARG HB3 0.000 . 4.800 3.811 3.594 3.927 . 0 0 "[ . 1 . ]" 1
1086 2 29 VAL MG2 2 49 ARG HD3 0.000 . 4.800 2.844 2.590 3.014 . 0 0 "[ . 1 . ]" 1
1087 2 20 ILE HG12 2 49 ARG HD3 0.000 . 4.000 2.591 2.352 2.832 . 0 0 "[ . 1 . ]" 1
1088 2 20 ILE MG 2 52 LEU MD1 0.000 . 4.800 2.121 1.924 2.410 . 0 0 "[ . 1 . ]" 1
1089 2 25 LEU MD1 2 57 ASP H 0.000 . 5.800 4.852 4.785 4.879 . 0 0 "[ . 1 . ]" 1
1090 2 67 SER QB 2 106 ILE MG 0.000 . 5.100 2.601 1.954 3.723 . 0 0 "[ . 1 . ]" 1
1091 2 81 THR HB 2 92 ALA MB 0.000 . 3.500 2.569 2.266 2.829 . 0 0 "[ . 1 . ]" 1
1092 2 81 THR MG 2 95 ILE HB 0.000 . 3.500 2.383 2.163 2.558 . 0 0 "[ . 1 . ]" 1
1093 2 81 THR MG 2 95 ILE MG 0.000 . 3.800 2.335 2.068 2.600 . 0 0 "[ . 1 . ]" 1
1094 2 84 MET ME 2 91 LEU HB3 3.500 3.500 5.000 3.442 3.244 3.699 0.256 4 0 "[ . 1 . ]" 1
1095 2 84 MET QB 2 92 ALA MB 0.000 . 4.200 2.825 2.624 3.065 . 0 0 "[ . 1 . ]" 1
1096 2 81 THR MG 2 96 ASN H 0.000 . 4.800 3.939 3.703 4.017 . 0 0 "[ . 1 . ]" 1
1097 2 74 LEU MD1 2 102 CYS HB3 0.000 . 4.200 2.974 2.356 3.500 . 0 0 "[ . 1 . ]" 1
1098 2 67 SER HA 2 106 ILE MG 0.000 . 4.000 2.846 2.342 3.313 . 0 0 "[ . 1 . ]" 1
1099 1 21 ALA MB 2 47 ARG QD 0.000 . 4.800 3.064 2.689 3.527 . 0 0 "[ . 1 . ]" 1
1100 1 47 ARG QD 2 21 ALA MB 0.000 . 4.800 3.039 2.770 3.504 . 0 0 "[ . 1 . ]" 1
1101 1 21 ALA MB 2 47 ARG QB 0.000 . 4.300 2.283 2.044 2.490 . 0 0 "[ . 1 . ]" 1
1102 1 47 ARG QB 2 21 ALA MB 0.000 . 4.300 2.164 1.943 2.646 . 0 0 "[ . 1 . ]" 1
1103 1 21 ALA MB 2 48 LEU HA 0.000 . 4.000 3.327 3.249 3.357 . 0 0 "[ . 1 . ]" 1
1104 1 48 LEU HA 2 21 ALA MB 0.000 . 4.000 3.232 3.011 3.346 . 0 0 "[ . 1 . ]" 1
1105 1 21 ALA HA 2 48 LEU QD 4.000 4.000 4.800 3.298 3.264 3.325 0.736 4 18 [***+***-**********] 1
1106 1 48 LEU QD 2 21 ALA HA 4.000 4.000 4.800 3.303 3.272 3.340 0.728 16 18 [-**************+**] 1
1107 1 21 ALA H 2 48 LEU QD 0.000 . 4.800 3.078 2.974 3.249 . 0 0 "[ . 1 . ]" 1
1108 1 48 LEU QD 2 21 ALA H 0.000 . 4.800 3.058 2.931 3.259 . 0 0 "[ . 1 . ]" 1
1109 1 20 ILE HB 2 48 LEU QD 0.000 . 4.300 2.305 2.058 2.489 . 0 0 "[ . 1 . ]" 1
1110 1 48 LEU QD 2 20 ILE HB 0.000 . 4.300 2.229 2.037 2.440 . 0 0 "[ . 1 . ]" 1
1111 1 20 ILE MD 2 48 LEU QD 0.000 . 5.100 2.685 2.474 2.919 . 0 0 "[ . 1 . ]" 1
1112 1 48 LEU QD 2 20 ILE MD 0.000 . 5.100 2.584 2.383 2.839 . 0 0 "[ . 1 . ]" 1
1113 1 14 SER H 2 41 LEU QD 4.000 4.000 4.800 3.411 3.299 3.514 0.701 15 15 "[****** * **-**+** ]" 1
1114 1 41 LEU QD 2 14 SER H 4.000 4.000 4.800 3.440 3.357 3.574 0.643 9 17 "[**-*****+**** ****]" 1
1115 1 14 SER HA 2 41 LEU QD 0.000 . 4.800 2.858 2.701 2.984 . 0 0 "[ . 1 . ]" 1
1116 1 41 LEU QD 2 14 SER HA 0.000 . 4.800 2.984 2.832 3.156 . 0 0 "[ . 1 . ]" 1
1117 1 14 SER QB 2 41 LEU QD 4.000 4.000 4.800 2.905 2.892 2.914 1.108 13 18 [********-***+*****] 1
1118 1 41 LEU QD 2 14 SER QB 4.000 4.000 4.800 2.913 2.905 2.923 1.095 8 18 [*******+*******-**] 1
1119 1 14 SER QB 2 40 ILE MG 0.000 . 4.300 2.768 2.369 2.985 . 0 0 "[ . 1 . ]" 1
1120 1 40 ILE MG 2 14 SER QB 0.000 . 4.300 2.425 2.112 2.961 . 0 0 "[ . 1 . ]" 1
1121 1 14 SER QB 2 41 LEU HB2 0.000 . 4.000 3.601 3.589 3.614 . 0 0 "[ . 1 . ]" 1
1122 1 41 LEU HB2 2 14 SER QB 0.000 . 4.000 3.600 3.578 3.615 . 0 0 "[ . 1 . ]" 1
1123 1 14 SER QB 2 41 LEU H 0.000 . 4.800 4.232 4.101 4.293 . 0 0 "[ . 1 . ]" 1
1124 1 41 LEU H 2 14 SER QB 0.000 . 4.800 4.083 3.899 4.282 . 0 0 "[ . 1 . ]" 1
1125 1 17 ALA HA 2 48 LEU QD 0.000 . 4.800 2.916 2.794 3.153 . 0 0 "[ . 1 . ]" 1
1126 1 48 LEU QD 2 17 ALA HA 0.000 . 4.800 2.843 2.642 2.960 . 0 0 "[ . 1 . ]" 1
1127 1 17 ALA MB 2 48 LEU QD 0.000 . 4.300 2.143 1.981 2.415 . 0 0 "[ . 1 . ]" 1
1128 1 48 LEU QD 2 17 ALA MB 0.000 . 4.300 2.152 2.001 2.340 . 0 0 "[ . 1 . ]" 1
1129 1 17 ALA MB 2 44 SER QB 0.000 . 4.300 2.013 1.873 2.149 . 0 0 "[ . 1 . ]" 1
1130 1 44 SER QB 2 17 ALA MB 0.000 . 4.300 1.909 1.847 2.075 . 0 0 "[ . 1 . ]" 1
1131 1 18 ASP HA 2 47 ARG QD 0.000 . 5.300 3.349 2.956 3.675 . 0 0 "[ . 1 . ]" 1
1132 1 47 ARG QD 2 18 ASP HA 0.000 . 5.300 3.132 2.855 3.610 . 0 0 "[ . 1 . ]" 1
1133 1 11 ILE MD 2 37 GLU QB 3.200 3.200 4.800 3.211 2.826 3.411 0.374 9 0 "[ . 1 . ]" 1
1134 1 37 GLU QB 2 11 ILE MD 3.200 3.200 4.800 3.243 2.868 3.559 0.332 16 0 "[ . 1 . ]" 1
1135 1 11 ILE MD 2 37 GLU HA 3.200 3.200 4.800 3.850 3.562 3.999 . 0 0 "[ . 1 . ]" 1
1136 1 37 GLU HA 2 11 ILE MD 3.200 3.200 4.800 3.545 3.291 3.921 . 0 0 "[ . 1 . ]" 1
1137 1 7 THR MG 2 37 GLU QG 3.200 3.200 5.600 2.465 2.367 2.875 0.833 18 17 "[*********-*** ***+]" 1
1138 1 37 GLU QG 2 7 THR MG 3.200 3.200 5.600 2.431 2.364 2.749 0.836 11 17 "[-******* *+*******]" 1
1139 1 10 ILE MG 2 37 GLU QG 3.200 3.200 5.600 3.455 3.189 3.731 0.011 1 0 "[ . 1 . ]" 1
1140 1 37 GLU QG 2 10 ILE MG 3.200 3.200 5.600 3.338 3.018 3.815 0.182 12 0 "[ . 1 . ]" 1
1141 1 13 LEU HB3 2 41 LEU QD 0.000 . 3.800 2.941 2.757 3.121 . 0 0 "[ . 1 . ]" 1
1142 1 41 LEU QD 2 13 LEU HB3 0.000 . 3.800 3.032 2.860 3.105 . 0 0 "[ . 1 . ]" 1
1143 1 41 LEU QD 2 45 ILE MD 0.000 . 5.600 2.962 2.857 3.074 . 0 0 "[ . 1 . ]" 1
1144 1 45 ILE MD 2 41 LEU QD 0.000 . 5.600 2.868 2.628 3.165 . 0 0 "[ . 1 . ]" 1
1145 1 41 LEU QD 2 10 ILE MG 0.000 . 5.600 2.632 2.295 2.876 . 0 0 "[ . 1 . ]" 1
1146 1 10 ILE MG 2 41 LEU QD 0.000 . 5.600 2.733 2.398 2.852 . 0 0 "[ . 1 . ]" 1
1147 1 41 LEU QD 2 10 ILE HA 0.000 . 4.800 3.694 3.572 3.782 . 0 0 "[ . 1 . ]" 1
1148 1 10 ILE HA 2 41 LEU QD 0.000 . 4.800 3.736 3.614 3.786 . 0 0 "[ . 1 . ]" 1
1149 1 41 LEU HB2 2 10 ILE MG 0.000 . 4.000 2.920 2.658 3.127 . 0 0 "[ . 1 . ]" 1
1150 1 10 ILE MG 2 41 LEU HB2 0.000 . 4.000 3.071 2.772 3.202 . 0 0 "[ . 1 . ]" 1
1151 1 48 LEU H 2 21 ALA MB 0.000 . 4.800 3.770 3.553 3.948 . 0 0 "[ . 1 . ]" 1
1152 1 21 ALA MB 2 48 LEU H 0.000 . 4.800 3.855 3.723 3.950 . 0 0 "[ . 1 . ]" 1
1153 1 52 LEU HA 2 51 SER QB 0.000 . 5.300 4.745 4.712 4.778 . 0 0 "[ . 1 . ]" 1
1154 1 51 SER QB 2 52 LEU HA 0.000 . 5.300 4.747 4.711 4.790 . 0 0 "[ . 1 . ]" 1
1155 1 48 LEU QB 2 48 LEU QD . 3.500 4.000 2.280 2.081 2.370 1.419 14 18 [**-**********+****] 1
1156 1 48 LEU QD 2 48 LEU QB . 3.500 4.000 2.282 2.181 2.429 1.319 16 18 [-**************+**] 1
1157 1 52 LEU MD2 2 51 SER QB 0.000 . 4.000 1.777 1.721 1.861 . 0 0 "[ . 1 . ]" 1
1158 1 51 SER QB 2 52 LEU MD2 0.000 . 4.000 1.780 1.748 1.855 . 0 0 "[ . 1 . ]" 1
1159 1 55 LEU QB 2 55 LEU QB 0.000 . 4.300 2.136 1.974 2.524 . 0 0 "[ . 1 . ]" 1
1160 1 55 LEU QB 2 52 LEU MD2 0.000 . 4.800 3.567 3.513 3.594 . 0 0 "[ . 1 . ]" 1
1161 1 52 LEU MD2 2 55 LEU QB 0.000 . 4.800 3.573 3.518 3.599 . 0 0 "[ . 1 . ]" 1
1162 1 41 LEU QD 2 41 LEU QD 0.000 . 4.300 1.710 1.653 1.803 . 0 0 "[ . 1 . ]" 1
1163 1 73 PRO HD3 2 105 ILE MD 0.000 . 4.800 3.943 3.627 4.028 . 0 0 "[ . 1 . ]" 1
1164 1 77 ILE MG 2 95 ILE MD 0.000 . 3.500 2.422 2.357 2.446 . 0 0 "[ . 1 . ]" 1
1165 1 77 ILE MD 2 98 ASP HB3 0.000 . 3.500 2.391 2.108 2.646 . 0 0 "[ . 1 . ]" 1
1166 1 77 ILE MD 2 98 ASP HB2 0.000 . 3.500 2.717 2.370 2.915 . 0 0 "[ . 1 . ]" 1
1167 1 80 ALA HA 2 91 LEU QD 0.000 . 3.500 2.556 2.253 2.872 . 0 0 "[ . 1 . ]" 1
1168 1 80 ALA MB 2 91 LEU QD 0.000 . 4.000 2.500 2.348 2.684 . 0 0 "[ . 1 . ]" 1
1169 1 80 ALA MB 2 95 ILE MD 0.000 . 4.000 2.703 2.495 2.787 . 0 0 "[ . 1 . ]" 1
1170 1 81 THR MG 2 95 ILE MD 0.000 . 2.700 1.898 1.881 1.920 . 0 0 "[ . 1 . ]" 1
1171 1 83 MET H 2 91 LEU QD 0.000 . 4.800 3.278 3.210 3.382 . 0 0 "[ . 1 . ]" 1
1172 1 84 MET H 2 91 LEU QD 0.000 . 4.800 2.663 2.571 2.793 . 0 0 "[ . 1 . ]" 1
1173 1 91 LEU QD 2 84 MET QG 0.000 . 4.000 1.848 1.781 1.918 . 0 0 "[ . 1 . ]" 1
1174 1 91 LEU QD 2 80 ALA HA 0.000 . 3.500 2.602 2.269 2.888 . 0 0 "[ . 1 . ]" 1
1175 1 91 LEU QD 2 84 MET HA 0.000 . 3.500 2.048 1.925 2.238 . 0 0 "[ . 1 . ]" 1
1176 1 95 ILE MD 2 81 THR MG 0.000 . 2.700 1.887 1.873 1.918 . 0 0 "[ . 1 . ]" 1
1177 1 105 ILE MD 2 73 PRO HD3 0.000 . 4.800 3.987 3.806 4.033 . 0 0 "[ . 1 . ]" 1
1178 1 95 ILE MD 2 77 ILE MG 0.000 . 3.500 2.425 2.363 2.444 . 0 0 "[ . 1 . ]" 1
1179 1 98 ASP HB3 2 77 ILE MD 0.000 . 3.500 2.414 2.177 2.747 . 0 0 "[ . 1 . ]" 1
1180 1 98 ASP HB2 2 77 ILE MD 0.000 . 3.500 2.708 2.425 2.918 . 0 0 "[ . 1 . ]" 1
1181 1 91 LEU QD 2 80 ALA MB 0.000 . 4.000 2.595 2.349 2.732 . 0 0 "[ . 1 . ]" 1
1182 1 95 ILE MD 2 80 ALA MB 0.000 . 4.000 2.776 2.694 2.794 . 0 0 "[ . 1 . ]" 1
1183 1 91 LEU QD 2 83 MET H 0.000 . 4.800 3.346 3.264 3.418 . 0 0 "[ . 1 . ]" 1
1184 1 91 LEU QD 2 84 MET H 0.000 . 4.800 2.722 2.652 2.869 . 0 0 "[ . 1 . ]" 1
1185 1 84 MET QG 2 91 LEU QD 0.000 . 4.000 1.909 1.772 2.055 . 0 0 "[ . 1 . ]" 1
1186 1 84 MET HA 2 91 LEU QD 0.000 . 3.500 1.992 1.901 2.100 . 0 0 "[ . 1 . ]" 1
1187 1 109 PHE HD1 2 62 LEU MD1 0.000 . 3.800 2.987 2.664 3.168 . 0 0 "[ . 1 . ]" 1
1188 1 62 LEU MD1 2 109 PHE HD1 0.000 . 3.800 2.939 2.556 3.170 . 0 0 "[ . 1 . ]" 1
1189 1 109 PHE HE2 2 66 VAL HA 2.700 2.700 4.000 3.711 3.323 4.006 0.006 13 0 "[ . 1 . ]" 1
1190 1 66 VAL HA 2 109 PHE HE2 2.700 2.700 4.000 3.607 3.373 3.989 . 0 0 "[ . 1 . ]" 1
1191 1 109 PHE HE1 2 66 VAL MG2 0.000 . 4.800 3.725 3.189 3.998 . 0 0 "[ . 1 . ]" 1
1192 1 66 VAL MG2 2 109 PHE HE1 0.000 . 4.800 3.657 3.437 3.859 . 0 0 "[ . 1 . ]" 1
1193 1 109 PHE HE2 2 66 VAL MG2 0.000 . 4.800 3.377 3.009 3.763 . 0 0 "[ . 1 . ]" 1
1194 1 66 VAL MG2 2 109 PHE HE2 0.000 . 4.800 3.123 2.740 3.478 . 0 0 "[ . 1 . ]" 1
1195 1 109 PHE HZ 2 66 VAL MG2 0.000 . 4.300 2.914 2.272 3.403 . 0 0 "[ . 1 . ]" 1
1196 1 66 VAL MG2 2 109 PHE HZ 0.000 . 4.300 2.803 2.451 3.038 . 0 0 "[ . 1 . ]" 1
1197 1 109 PHE HZ 2 66 VAL HA 3.500 3.500 5.000 3.871 3.493 4.241 0.007 11 0 "[ . 1 . ]" 1
1198 1 66 VAL HA 2 109 PHE HZ 3.500 3.500 5.000 3.799 3.578 4.284 . 0 0 "[ . 1 . ]" 1
1199 1 109 PHE HZ 2 65 GLY HA3 3.500 3.500 5.000 4.002 3.493 4.551 0.007 10 0 "[ . 1 . ]" 1
1200 1 65 GLY HA3 2 109 PHE HZ 3.500 3.500 5.000 4.125 3.603 4.737 . 0 0 "[ . 1 . ]" 1
1201 1 109 PHE HE1 2 62 LEU HG 3.000 3.000 8.000 4.082 3.330 4.674 . 0 0 "[ . 1 . ]" 1
1202 1 66 VAL CG2 2 109 PHE CZ 3.500 3.400 4.000 3.805 3.500 4.013 0.013 16 0 "[ . 1 . ]" 1
1203 1 70 LEU MD2 2 105 ILE MD 0.000 . 4.200 2.857 2.676 2.920 . 0 0 "[ . 1 . ]" 1
1204 1 105 ILE MD 2 70 LEU MD2 0.000 . 4.200 2.874 2.682 2.918 . 0 0 "[ . 1 . ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 1
_Distance_constraint_stats_list.Viol_count 9
_Distance_constraint_stats_list.Viol_total 1.278
_Distance_constraint_stats_list.Viol_max 0.015
_Distance_constraint_stats_list.Viol_rms 0.0050
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0079
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 62 LEU 0.071 0.015 11 0 "[ . 1 . ]"
2 62 LEU 0.071 0.015 11 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 62 LEU CD2 2 62 LEU CD2 3.800 3.700 3.900 3.868 3.739 3.915 0.015 11 0 "[ . 1 . ]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 158
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 10 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 11 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 12 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 13 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 14 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 15 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 16 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 17 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 18 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 19 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 20 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 21 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 22 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 24 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 34 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 36 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 38 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 40 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 41 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 42 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 43 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 44 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 45 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 46 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 47 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 48 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 49 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 50 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 51 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 52 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 54 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 55 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 56 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 57 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 58 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 59 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 60 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 61 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 63 MET 0.000 0.000 . 0 "[ . 1 . ]"
1 64 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . ]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . ]"
1 67 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 68 HIS 0.000 0.000 . 0 "[ . 1 . ]"
1 69 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 70 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 71 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 72 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 74 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 75 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 76 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 77 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 78 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 79 LEU 0.000 0.000 . 0 "[ . 1 . ]"
1 80 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 92 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 93 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 94 SER 0.000 0.000 . 0 "[ . 1 . ]"
1 95 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 96 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 97 LYS 0.000 0.000 . 0 "[ . 1 . ]"
1 98 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 99 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 100 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 101 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 102 CYS 0.000 0.000 . 0 "[ . 1 . ]"
1 103 ASN 0.000 0.000 . 0 "[ . 1 . ]"
1 104 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 105 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 106 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 107 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 108 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 109 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 110 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 111 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 112 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 113 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 10 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 11 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 12 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 13 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 14 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 15 ASN 0.000 0.000 . 0 "[ . 1 . ]"
2 16 THR 0.000 0.000 . 0 "[ . 1 . ]"
2 17 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 18 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 19 LYS 0.000 0.000 . 0 "[ . 1 . ]"
2 20 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 21 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 22 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 23 GLY 0.000 0.000 . 0 "[ . 1 . ]"
2 24 ASN 0.000 0.000 . 0 "[ . 1 . ]"
2 34 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 36 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 37 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 38 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 39 GLY 0.000 0.000 . 0 "[ . 1 . ]"
2 40 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 41 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 42 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 43 LYS 0.000 0.000 . 0 "[ . 1 . ]"
2 44 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 45 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 46 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 47 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 48 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 49 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 50 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 51 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 52 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 53 LYS 0.000 0.000 . 0 "[ . 1 . ]"
2 54 GLN 0.000 0.000 . 0 "[ . 1 . ]"
2 55 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 56 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 57 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 58 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 59 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 60 THR 0.000 0.000 . 0 "[ . 1 . ]"
2 61 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 62 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 63 MET 0.000 0.000 . 0 "[ . 1 . ]"
2 64 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 65 GLY 0.000 0.000 . 0 "[ . 1 . ]"
2 66 VAL 0.000 0.000 . 0 "[ . 1 . ]"
2 67 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 68 HIS 0.000 0.000 . 0 "[ . 1 . ]"
2 69 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 70 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 71 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 72 THR 0.000 0.000 . 0 "[ . 1 . ]"
2 73 PRO 0.000 0.000 . 0 "[ . 1 . ]"
2 74 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 75 THR 0.000 0.000 . 0 "[ . 1 . ]"
2 76 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 77 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 78 ARG 0.000 0.000 . 0 "[ . 1 . ]"
2 79 LEU 0.000 0.000 . 0 "[ . 1 . ]"
2 80 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 92 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 93 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 94 SER 0.000 0.000 . 0 "[ . 1 . ]"
2 95 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 96 ASN 0.000 0.000 . 0 "[ . 1 . ]"
2 97 LYS 0.000 0.000 . 0 "[ . 1 . ]"
2 98 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 99 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 100 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 101 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 102 CYS 0.000 0.000 . 0 "[ . 1 . ]"
2 103 ASN 0.000 0.000 . 0 "[ . 1 . ]"
2 104 ALA 0.000 0.000 . 0 "[ . 1 . ]"
2 105 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 106 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 107 GLU 0.000 0.000 . 0 "[ . 1 . ]"
2 108 GLN 0.000 0.000 . 0 "[ . 1 . ]"
2 109 PHE 0.000 0.000 . 0 "[ . 1 . ]"
2 110 ILE 0.000 0.000 . 0 "[ . 1 . ]"
2 111 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 112 TYR 0.000 0.000 . 0 "[ . 1 . ]"
2 113 LEU 0.000 0.000 . 0 "[ . 1 . ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 10 ILE O 1 14 SER H 2.200 . 2.600 2.164 2.116 2.231 . 0 0 "[ . 1 . ]" 3
2 1 11 ILE O 1 15 ASN H 2.200 . 2.600 2.039 2.000 2.074 . 0 0 "[ . 1 . ]" 3
3 1 12 GLU O 1 16 THR H 2.200 . 2.600 2.119 2.076 2.152 . 0 0 "[ . 1 . ]" 3
4 1 13 LEU O 1 17 ALA H 2.200 . 2.600 2.148 2.084 2.223 . 0 0 "[ . 1 . ]" 3
5 1 14 SER O 1 18 ASP H 2.200 . 2.600 2.200 2.115 2.243 . 0 0 "[ . 1 . ]" 3
6 1 15 ASN O 1 19 LYS H 2.200 . 2.600 2.257 2.128 2.306 . 0 0 "[ . 1 . ]" 3
7 1 16 THR O 1 20 ILE H 2.200 . 2.600 2.240 2.194 2.272 . 0 0 "[ . 1 . ]" 3
8 1 17 ALA O 1 21 ALA H 2.200 . 2.600 2.175 2.131 2.211 . 0 0 "[ . 1 . ]" 3
9 1 18 ASP O 1 22 GLU H 2.200 . 2.600 2.208 2.144 2.268 . 0 0 "[ . 1 . ]" 3
10 1 20 ILE O 1 23 GLY H 2.200 . 2.600 2.103 2.074 2.148 . 0 0 "[ . 1 . ]" 3
11 1 19 LYS O 1 24 ASN H 2.200 . 2.600 2.235 2.146 2.296 . 0 0 "[ . 1 . ]" 3
12 1 36 ASP O 1 40 ILE H 2.200 . 2.600 2.252 2.212 2.307 . 0 0 "[ . 1 . ]" 3
13 1 37 GLU O 1 41 LEU H 2.200 . 2.600 2.174 2.122 2.242 . 0 0 "[ . 1 . ]" 3
14 1 38 ILE O 1 42 ALA H 2.200 . 2.600 2.131 2.024 2.181 . 0 0 "[ . 1 . ]" 3
15 1 39 GLY O 1 43 LYS H 2.200 . 2.600 2.146 2.049 2.230 . 0 0 "[ . 1 . ]" 3
16 1 40 ILE O 1 44 SER H 2.200 . 2.600 2.131 2.087 2.222 . 0 0 "[ . 1 . ]" 3
17 1 41 LEU O 1 45 ILE H 2.200 . 2.600 2.248 2.198 2.273 . 0 0 "[ . 1 . ]" 3
18 1 42 ALA O 1 46 GLU H 2.200 . 2.600 2.162 2.120 2.225 . 0 0 "[ . 1 . ]" 3
19 1 43 LYS O 1 47 ARG H 2.200 . 2.600 2.130 2.075 2.192 . 0 0 "[ . 1 . ]" 3
20 1 44 SER O 1 48 LEU H 2.200 . 2.600 2.259 2.221 2.298 . 0 0 "[ . 1 . ]" 3
21 1 45 ILE O 1 49 ARG H 2.200 . 2.600 2.159 2.089 2.211 . 0 0 "[ . 1 . ]" 3
22 1 46 GLU O 1 50 ARG H 2.200 . 2.600 2.073 2.022 2.127 . 0 0 "[ . 1 . ]" 3
23 1 47 ARG O 1 51 SER H 2.200 . 2.600 2.247 2.198 2.309 . 0 0 "[ . 1 . ]" 3
24 1 48 LEU O 1 52 LEU H 2.200 . 2.600 2.237 2.183 2.277 . 0 0 "[ . 1 . ]" 3
25 1 49 ARG O 1 53 LYS H 2.200 . 2.600 2.085 2.022 2.170 . 0 0 "[ . 1 . ]" 3
26 1 50 ARG O 1 54 GLN H 2.200 . 2.600 2.061 1.998 2.095 . 0 0 "[ . 1 . ]" 3
27 1 51 SER O 1 55 LEU H 2.200 . 2.600 2.145 2.101 2.188 . 0 0 "[ . 1 . ]" 3
28 1 52 LEU O 1 56 ALA H 2.200 . 2.600 2.196 2.126 2.246 . 0 0 "[ . 1 . ]" 3
29 1 53 LYS O 1 57 ASP H 2.200 . 2.600 2.137 2.102 2.189 . 0 0 "[ . 1 . ]" 3
30 1 54 GLN O 1 58 ASP H 2.200 . 2.600 2.054 1.971 2.115 . 0 0 "[ . 1 . ]" 3
31 1 55 LEU O 1 59 ARG H 2.200 . 2.600 2.244 2.164 2.321 . 0 0 "[ . 1 . ]" 3
32 1 56 ALA O 1 60 THR H 2.200 . 2.600 2.344 2.281 2.428 . 0 0 "[ . 1 . ]" 3
33 1 57 ASP O 1 61 LEU H 2.200 . 2.600 2.163 2.111 2.242 . 0 0 "[ . 1 . ]" 3
34 1 58 ASP O 1 62 LEU H 2.200 . 2.600 2.092 2.018 2.169 . 0 0 "[ . 1 . ]" 3
35 1 59 ARG O 1 63 MET H 2.200 . 2.600 2.301 2.227 2.393 . 0 0 "[ . 1 . ]" 3
36 1 60 THR O 1 64 ALA H 2.200 . 2.600 2.287 2.243 2.342 . 0 0 "[ . 1 . ]" 3
37 1 61 LEU O 1 65 GLY H 2.200 . 2.600 2.137 2.090 2.201 . 0 0 "[ . 1 . ]" 3
38 1 62 LEU O 1 66 VAL H 2.200 . 2.600 2.242 2.161 2.378 . 0 0 "[ . 1 . ]" 3
39 1 63 MET O 1 67 SER H 2.200 . 2.600 2.262 2.202 2.380 . 0 0 "[ . 1 . ]" 3
40 1 64 ALA O 1 68 HIS H 2.200 . 2.600 2.189 2.120 2.273 . 0 0 "[ . 1 . ]" 3
41 1 65 GLY O 1 69 ASP H 2.200 . 2.600 2.257 2.180 2.334 . 0 0 "[ . 1 . ]" 3
42 1 66 VAL O 1 70 LEU H 2.200 . 2.600 2.202 2.136 2.247 . 0 0 "[ . 1 . ]" 3
43 1 67 SER O 1 71 ARG H 2.200 . 2.600 2.446 2.375 2.531 . 0 0 "[ . 1 . ]" 3
44 1 68 HIS O 1 71 ARG H 2.200 . 2.600 2.171 2.132 2.204 . 0 0 "[ . 1 . ]" 3
45 1 70 LEU O 1 74 LEU H 2.200 . 2.600 2.365 2.303 2.439 . 0 0 "[ . 1 . ]" 3
46 1 71 ARG O 1 75 THR H 2.200 . 2.600 2.152 2.026 2.211 . 0 0 "[ . 1 . ]" 3
47 1 72 THR O 1 76 ARG H 2.200 . 2.600 2.302 2.198 2.404 . 0 0 "[ . 1 . ]" 3
48 1 73 PRO O 1 77 ILE H 2.200 . 2.600 2.211 2.131 2.265 . 0 0 "[ . 1 . ]" 3
49 1 74 LEU O 1 78 ARG H 2.200 . 2.600 2.249 2.185 2.298 . 0 0 "[ . 1 . ]" 3
50 1 75 THR O 1 79 LEU H 2.200 . 2.600 2.196 2.141 2.249 . 0 0 "[ . 1 . ]" 3
51 1 76 ARG O 1 80 ALA H 2.200 . 2.600 2.160 2.099 2.207 . 0 0 "[ . 1 . ]" 3
52 1 92 ALA O 1 96 ASN H 2.200 . 2.600 2.099 2.023 2.172 . 0 0 "[ . 1 . ]" 3
53 1 93 GLU O 1 97 LYS H 2.200 . 2.600 2.146 2.088 2.189 . 0 0 "[ . 1 . ]" 3
54 1 94 SER O 1 98 ASP H 2.200 . 2.600 2.216 2.197 2.247 . 0 0 "[ . 1 . ]" 3
55 1 95 ILE O 1 99 ILE H 2.200 . 2.600 2.199 2.158 2.245 . 0 0 "[ . 1 . ]" 3
56 1 96 ASN O 1 100 GLU H 2.200 . 2.600 2.191 2.147 2.288 . 0 0 "[ . 1 . ]" 3
57 1 97 LYS O 1 101 GLU H 2.200 . 2.600 2.186 2.102 2.268 . 0 0 "[ . 1 . ]" 3
58 1 98 ASP O 1 102 CYS H 2.200 . 2.600 2.200 2.133 2.283 . 0 0 "[ . 1 . ]" 3
59 1 99 ILE O 1 103 ASN H 2.200 . 2.600 2.178 2.099 2.236 . 0 0 "[ . 1 . ]" 3
60 1 100 GLU O 1 104 ALA H 2.200 . 2.600 2.174 2.069 2.268 . 0 0 "[ . 1 . ]" 3
61 1 101 GLU O 1 105 ILE H 2.200 . 2.600 2.205 2.147 2.268 . 0 0 "[ . 1 . ]" 3
62 1 102 CYS O 1 106 ILE H 2.200 . 2.600 2.256 2.164 2.301 . 0 0 "[ . 1 . ]" 3
63 1 103 ASN O 1 107 GLU H 2.200 . 2.600 2.114 2.042 2.177 . 0 0 "[ . 1 . ]" 3
64 1 104 ALA O 1 108 GLN H 2.200 . 2.600 2.159 2.089 2.200 . 0 0 "[ . 1 . ]" 3
65 1 105 ILE O 1 109 PHE H 2.200 . 2.600 2.328 2.262 2.415 . 0 0 "[ . 1 . ]" 3
66 1 106 ILE O 1 110 ILE H 2.200 . 2.600 2.269 2.229 2.336 . 0 0 "[ . 1 . ]" 3
67 1 107 GLU O 1 111 ASP H 2.200 . 2.600 2.125 2.039 2.231 . 0 0 "[ . 1 . ]" 3
68 1 108 GLN O 1 112 TYR H 2.200 . 2.600 2.171 2.080 2.242 . 0 0 "[ . 1 . ]" 3
69 1 109 PHE O 1 113 LEU H 2.200 . 2.600 2.210 2.116 2.290 . 0 0 "[ . 1 . ]" 3
70 1 36 ASP OD1 1 39 GLY H 2.200 . 2.600 2.399 2.367 2.416 . 0 0 "[ . 1 . ]" 3
71 1 36 ASP OD1 1 39 GLY N 3.100 2.600 3.500 3.304 3.270 3.324 . 0 0 "[ . 1 . ]" 3
72 1 34 ARG HE 1 36 ASP OD1 2.200 . 2.600 2.328 2.306 2.363 . 0 0 "[ . 1 . ]" 3
73 1 34 ARG NE 1 36 ASP OD1 3.100 2.600 3.500 3.288 3.270 3.317 . 0 0 "[ . 1 . ]" 3
74 1 34 ARG HH21 1 36 ASP OD2 2.200 . 2.600 2.087 2.065 2.119 . 0 0 "[ . 1 . ]" 3
75 1 34 ARG NH2 1 36 ASP OD2 3.100 2.600 3.500 3.055 3.036 3.094 . 0 0 "[ . 1 . ]" 3
76 1 46 GLU OE2 1 49 ARG HE 2.200 . 2.600 2.227 2.199 2.282 . 0 0 "[ . 1 . ]" 3
77 1 46 GLU OE2 1 49 ARG NE 3.100 2.600 3.500 2.961 2.920 3.044 . 0 0 "[ . 1 . ]" 3
78 1 46 GLU OE1 1 49 ARG HH21 2.200 . 2.600 2.255 2.171 2.299 . 0 0 "[ . 1 . ]" 3
79 1 46 GLU OE1 1 49 ARG NH2 3.100 2.600 3.500 3.223 3.142 3.258 . 0 0 "[ . 1 . ]" 3
80 2 10 ILE O 2 14 SER H 2.200 . 2.600 2.182 1.991 2.264 . 0 0 "[ . 1 . ]" 3
81 2 11 ILE O 2 15 ASN H 2.200 . 2.600 2.057 2.034 2.091 . 0 0 "[ . 1 . ]" 3
82 2 12 GLU O 2 16 THR H 2.200 . 2.600 2.105 2.061 2.154 . 0 0 "[ . 1 . ]" 3
83 2 13 LEU O 2 17 ALA H 2.200 . 2.600 2.145 2.067 2.196 . 0 0 "[ . 1 . ]" 3
84 2 14 SER O 2 18 ASP H 2.200 . 2.600 2.211 2.161 2.282 . 0 0 "[ . 1 . ]" 3
85 2 15 ASN O 2 19 LYS H 2.200 . 2.600 2.262 2.218 2.303 . 0 0 "[ . 1 . ]" 3
86 2 16 THR O 2 20 ILE H 2.200 . 2.600 2.235 2.176 2.269 . 0 0 "[ . 1 . ]" 3
87 2 17 ALA O 2 21 ALA H 2.200 . 2.600 2.160 2.130 2.199 . 0 0 "[ . 1 . ]" 3
88 2 18 ASP O 2 22 GLU H 2.200 . 2.600 2.234 2.168 2.276 . 0 0 "[ . 1 . ]" 3
89 2 20 ILE O 2 23 GLY H 2.200 . 2.600 2.066 2.041 2.099 . 0 0 "[ . 1 . ]" 3
90 2 19 LYS O 2 24 ASN H 2.200 . 2.600 2.238 2.186 2.292 . 0 0 "[ . 1 . ]" 3
91 2 36 ASP O 2 40 ILE H 2.200 . 2.600 2.256 2.208 2.361 . 0 0 "[ . 1 . ]" 3
92 2 37 GLU O 2 41 LEU H 2.200 . 2.600 2.197 2.137 2.275 . 0 0 "[ . 1 . ]" 3
93 2 38 ILE O 2 42 ALA H 2.200 . 2.600 2.070 2.010 2.124 . 0 0 "[ . 1 . ]" 3
94 2 39 GLY O 2 43 LYS H 2.200 . 2.600 2.156 2.094 2.211 . 0 0 "[ . 1 . ]" 3
95 2 40 ILE O 2 44 SER H 2.200 . 2.600 2.154 2.082 2.201 . 0 0 "[ . 1 . ]" 3
96 2 41 LEU O 2 45 ILE H 2.200 . 2.600 2.220 2.133 2.267 . 0 0 "[ . 1 . ]" 3
97 2 42 ALA O 2 46 GLU H 2.200 . 2.600 2.167 2.122 2.241 . 0 0 "[ . 1 . ]" 3
98 2 43 LYS O 2 47 ARG H 2.200 . 2.600 2.131 2.088 2.206 . 0 0 "[ . 1 . ]" 3
99 2 44 SER O 2 48 LEU H 2.200 . 2.600 2.228 2.131 2.294 . 0 0 "[ . 1 . ]" 3
100 2 45 ILE O 2 49 ARG H 2.200 . 2.600 2.133 2.087 2.209 . 0 0 "[ . 1 . ]" 3
101 2 46 GLU O 2 50 ARG H 2.200 . 2.600 2.075 2.027 2.121 . 0 0 "[ . 1 . ]" 3
102 2 47 ARG O 2 51 SER H 2.200 . 2.600 2.253 2.186 2.311 . 0 0 "[ . 1 . ]" 3
103 2 48 LEU O 2 52 LEU H 2.200 . 2.600 2.251 2.187 2.301 . 0 0 "[ . 1 . ]" 3
104 2 49 ARG O 2 53 LYS H 2.200 . 2.600 2.108 2.048 2.203 . 0 0 "[ . 1 . ]" 3
105 2 50 ARG O 2 54 GLN H 2.200 . 2.600 2.059 2.002 2.128 . 0 0 "[ . 1 . ]" 3
106 2 51 SER O 2 55 LEU H 2.200 . 2.600 2.137 2.092 2.208 . 0 0 "[ . 1 . ]" 3
107 2 52 LEU O 2 56 ALA H 2.200 . 2.600 2.203 2.157 2.239 . 0 0 "[ . 1 . ]" 3
108 2 53 LYS O 2 57 ASP H 2.200 . 2.600 2.142 2.078 2.229 . 0 0 "[ . 1 . ]" 3
109 2 54 GLN O 2 58 ASP H 2.200 . 2.600 2.049 1.968 2.139 . 0 0 "[ . 1 . ]" 3
110 2 55 LEU O 2 59 ARG H 2.200 . 2.600 2.248 2.199 2.307 . 0 0 "[ . 1 . ]" 3
111 2 56 ALA O 2 60 THR H 2.200 . 2.600 2.353 2.304 2.406 . 0 0 "[ . 1 . ]" 3
112 2 57 ASP O 2 61 LEU H 2.200 . 2.600 2.173 2.097 2.247 . 0 0 "[ . 1 . ]" 3
113 2 58 ASP O 2 62 LEU H 2.200 . 2.600 2.081 2.003 2.149 . 0 0 "[ . 1 . ]" 3
114 2 59 ARG O 2 63 MET H 2.200 . 2.600 2.287 2.175 2.395 . 0 0 "[ . 1 . ]" 3
115 2 60 THR O 2 64 ALA H 2.200 . 2.600 2.297 2.237 2.393 . 0 0 "[ . 1 . ]" 3
116 2 61 LEU O 2 65 GLY H 2.200 . 2.600 2.134 2.067 2.190 . 0 0 "[ . 1 . ]" 3
117 2 62 LEU O 2 66 VAL H 2.200 . 2.600 2.222 2.160 2.341 . 0 0 "[ . 1 . ]" 3
118 2 63 MET O 2 67 SER H 2.200 . 2.600 2.256 2.196 2.347 . 0 0 "[ . 1 . ]" 3
119 2 64 ALA O 2 68 HIS H 2.200 . 2.600 2.177 2.104 2.226 . 0 0 "[ . 1 . ]" 3
120 2 65 GLY O 2 69 ASP H 2.200 . 2.600 2.227 2.186 2.273 . 0 0 "[ . 1 . ]" 3
121 2 66 VAL O 2 70 LEU H 2.200 . 2.600 2.226 2.161 2.335 . 0 0 "[ . 1 . ]" 3
122 2 67 SER O 2 71 ARG H 2.200 . 2.600 2.392 2.330 2.469 . 0 0 "[ . 1 . ]" 3
123 2 68 HIS O 2 71 ARG H 2.200 . 2.600 2.177 2.107 2.231 . 0 0 "[ . 1 . ]" 3
124 2 70 LEU O 2 74 LEU H 2.200 . 2.600 2.353 2.296 2.409 . 0 0 "[ . 1 . ]" 3
125 2 71 ARG O 2 75 THR H 2.200 . 2.600 2.176 2.119 2.303 . 0 0 "[ . 1 . ]" 3
126 2 72 THR O 2 76 ARG H 2.200 . 2.600 2.273 2.180 2.333 . 0 0 "[ . 1 . ]" 3
127 2 73 PRO O 2 77 ILE H 2.200 . 2.600 2.207 2.130 2.297 . 0 0 "[ . 1 . ]" 3
128 2 74 LEU O 2 78 ARG H 2.200 . 2.600 2.270 2.198 2.335 . 0 0 "[ . 1 . ]" 3
129 2 75 THR O 2 79 LEU H 2.200 . 2.600 2.208 2.157 2.288 . 0 0 "[ . 1 . ]" 3
130 2 76 ARG O 2 80 ALA H 2.200 . 2.600 2.129 2.084 2.225 . 0 0 "[ . 1 . ]" 3
131 2 92 ALA O 2 96 ASN H 2.200 . 2.600 2.082 1.998 2.150 . 0 0 "[ . 1 . ]" 3
132 2 93 GLU O 2 97 LYS H 2.200 . 2.600 2.158 2.096 2.199 . 0 0 "[ . 1 . ]" 3
133 2 94 SER O 2 98 ASP H 2.200 . 2.600 2.243 2.189 2.303 . 0 0 "[ . 1 . ]" 3
134 2 95 ILE O 2 99 ILE H 2.200 . 2.600 2.185 2.097 2.249 . 0 0 "[ . 1 . ]" 3
135 2 96 ASN O 2 100 GLU H 2.200 . 2.600 2.179 2.144 2.217 . 0 0 "[ . 1 . ]" 3
136 2 97 LYS O 2 101 GLU H 2.200 . 2.600 2.188 2.152 2.240 . 0 0 "[ . 1 . ]" 3
137 2 98 ASP O 2 102 CYS H 2.200 . 2.600 2.223 2.133 2.287 . 0 0 "[ . 1 . ]" 3
138 2 99 ILE O 2 103 ASN H 2.200 . 2.600 2.176 2.098 2.235 . 0 0 "[ . 1 . ]" 3
139 2 100 GLU O 2 104 ALA H 2.200 . 2.600 2.162 2.080 2.229 . 0 0 "[ . 1 . ]" 3
140 2 101 GLU O 2 105 ILE H 2.200 . 2.600 2.220 2.138 2.289 . 0 0 "[ . 1 . ]" 3
141 2 102 CYS O 2 106 ILE H 2.200 . 2.600 2.261 2.191 2.327 . 0 0 "[ . 1 . ]" 3
142 2 103 ASN O 2 107 GLU H 2.200 . 2.600 2.106 2.041 2.173 . 0 0 "[ . 1 . ]" 3
143 2 104 ALA O 2 108 GLN H 2.200 . 2.600 2.143 2.083 2.188 . 0 0 "[ . 1 . ]" 3
144 2 105 ILE O 2 109 PHE H 2.200 . 2.600 2.305 2.203 2.392 . 0 0 "[ . 1 . ]" 3
145 2 106 ILE O 2 110 ILE H 2.200 . 2.600 2.272 2.215 2.397 . 0 0 "[ . 1 . ]" 3
146 2 107 GLU O 2 111 ASP H 2.200 . 2.600 2.120 1.979 2.197 . 0 0 "[ . 1 . ]" 3
147 2 108 GLN O 2 112 TYR H 2.200 . 2.600 2.179 2.110 2.238 . 0 0 "[ . 1 . ]" 3
148 2 109 PHE O 2 113 LEU H 2.200 . 2.600 2.187 2.098 2.291 . 0 0 "[ . 1 . ]" 3
149 2 36 ASP OD1 2 39 GLY H 2.200 . 2.600 2.407 2.364 2.435 . 0 0 "[ . 1 . ]" 3
150 2 36 ASP OD1 2 39 GLY N 3.100 2.600 3.500 3.347 3.302 3.379 . 0 0 "[ . 1 . ]" 3
151 2 34 ARG HE 2 36 ASP OD1 2.200 . 2.600 2.315 2.188 2.350 . 0 0 "[ . 1 . ]" 3
152 2 34 ARG NE 2 36 ASP OD1 3.100 2.600 3.500 3.273 3.148 3.310 . 0 0 "[ . 1 . ]" 3
153 2 34 ARG HH21 2 36 ASP OD2 2.200 . 2.600 2.050 1.867 2.103 . 0 0 "[ . 1 . ]" 3
154 2 34 ARG NH2 2 36 ASP OD2 3.100 2.600 3.500 3.016 2.808 3.080 . 0 0 "[ . 1 . ]" 3
155 2 46 GLU OE2 2 49 ARG HE 2.200 . 2.600 2.238 2.201 2.287 . 0 0 "[ . 1 . ]" 3
156 2 46 GLU OE2 2 49 ARG NE 3.100 2.600 3.500 2.979 2.926 3.044 . 0 0 "[ . 1 . ]" 3
157 2 46 GLU OE1 2 49 ARG HH21 2.200 . 2.600 2.265 2.229 2.302 . 0 0 "[ . 1 . ]" 3
158 2 46 GLU OE1 2 49 ARG NH2 3.100 2.600 3.500 3.233 3.204 3.272 . 0 0 "[ . 1 . ]" 3
stop_
save_
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