NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
429077 |
2in2   |
5659 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2in2
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 1140
_Distance_constraint_stats_list.Viol_count 250
_Distance_constraint_stats_list.Viol_total 242.331
_Distance_constraint_stats_list.Viol_max 0.908
_Distance_constraint_stats_list.Viol_rms 0.0129
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0485
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 ASN 0.706 0.117 8 0 "[ . 1 . 2]"
1 4 THR 0.012 0.012 8 0 "[ . 1 . 2]"
1 5 GLU 0.070 0.046 18 0 "[ . 1 . 2]"
1 6 PHE 0.104 0.054 10 0 "[ . 1 . 2]"
1 7 ALA 0.003 0.003 10 0 "[ . 1 . 2]"
1 8 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LEU 0.095 0.095 12 0 "[ . 1 . 2]"
1 12 ARG 0.014 0.014 5 0 "[ . 1 . 2]"
1 13 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ASN 0.022 0.022 13 0 "[ . 1 . 2]"
1 15 ILE 0.140 0.095 12 0 "[ . 1 . 2]"
1 16 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 THR 0.281 0.056 20 0 "[ . 1 . 2]"
1 18 ILE 0.063 0.025 15 0 "[ . 1 . 2]"
1 19 THR 0.028 0.028 9 0 "[ . 1 . 2]"
1 20 THR 0.294 0.065 1 0 "[ . 1 . 2]"
1 21 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 LYS 0.186 0.024 10 0 "[ . 1 . 2]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 PHE 0.025 0.025 1 0 "[ . 1 . 2]"
1 26 THR 0.056 0.032 11 0 "[ . 1 . 2]"
1 27 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 LEU 0.673 0.120 17 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ILE 0.101 0.101 11 0 "[ . 1 . 2]"
1 31 HIS 0.110 0.036 4 0 "[ . 1 . 2]"
1 32 ASP 0.398 0.065 9 0 "[ . 1 . 2]"
1 33 ARG 0.165 0.065 9 0 "[ . 1 . 2]"
1 34 VAL 0.121 0.101 11 0 "[ . 1 . 2]"
1 35 CYS 0.110 0.036 4 0 "[ . 1 . 2]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 HIS 1.046 0.131 8 0 "[ . 1 . 2]"
1 41 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 PRO 0.294 0.065 1 0 "[ . 1 . 2]"
1 44 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 ASP 0.548 0.102 9 0 "[ . 1 . 2]"
1 47 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 LEU 0.065 0.038 20 0 "[ . 1 . 2]"
1 49 VAL 0.105 0.038 20 0 "[ . 1 . 2]"
1 50 ASN 0.159 0.056 20 0 "[ . 1 . 2]"
1 51 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ILE 0.439 0.102 9 0 "[ . 1 . 2]"
1 55 ARG 0.289 0.044 9 0 "[ . 1 . 2]"
1 56 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ASP 0.044 0.042 17 0 "[ . 1 . 2]"
1 59 LYS 0.338 0.030 19 0 "[ . 1 . 2]"
1 60 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLU 0.024 0.011 17 0 "[ . 1 . 2]"
1 67 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ILE 0.024 0.011 17 0 "[ . 1 . 2]"
1 69 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 GLU 1.036 0.131 8 0 "[ . 1 . 2]"
1 72 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LEU 0.219 0.030 19 0 "[ . 1 . 2]"
1 76 THR 0.044 0.042 17 0 "[ . 1 . 2]"
1 77 LEU 0.073 0.027 7 0 "[ . 1 . 2]"
1 78 ASP 0.114 0.036 6 0 "[ . 1 . 2]"
1 79 ARG 0.063 0.040 10 0 "[ . 1 . 2]"
1 80 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 LYS 0.256 0.065 5 0 "[ . 1 . 2]"
1 83 PHE 0.075 0.046 13 0 "[ . 1 . 2]"
1 84 ARG 0.022 0.022 13 0 "[ . 1 . 2]"
1 85 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 PHE 0.073 0.023 19 0 "[ . 1 . 2]"
1 90 ILE 0.013 0.013 4 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 GLU 0.111 0.032 15 0 "[ . 1 . 2]"
1 93 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LEU 0.296 0.091 9 0 "[ . 1 . 2]"
1 95 GLU 0.106 0.091 9 0 "[ . 1 . 2]"
1 96 GLY 0.049 0.028 15 0 "[ . 1 . 2]"
1 97 VAL 0.165 0.156 11 0 "[ . 1 . 2]"
1 98 ASP 0.156 0.156 11 0 "[ . 1 . 2]"
1 99 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LEU 0.030 0.030 1 0 "[ . 1 . 2]"
1 102 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 HIS 0.122 0.035 12 0 "[ . 1 . 2]"
1 105 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 ILE 0.012 0.012 8 0 "[ . 1 . 2]"
1 113 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 GLU 0.061 0.015 5 0 "[ . 1 . 2]"
1 115 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 GLY 0.061 0.015 5 0 "[ . 1 . 2]"
1 117 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 VAL 0.060 0.028 15 0 "[ . 1 . 2]"
1 119 THR 0.078 0.027 3 0 "[ . 1 . 2]"
1 120 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ALA 3.130 0.908 5 2 "[ + - . 2]"
1 122 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 ASN 0.359 0.193 14 0 "[ . 1 . 2]"
1 126 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 THR 0.359 0.193 14 0 "[ . 1 . 2]"
1 130 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 134 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 135 ILE 0.186 0.037 6 0 "[ . 1 . 2]"
1 136 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 138 ASP 0.011 0.009 12 0 "[ . 1 . 2]"
1 139 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 142 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 143 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 146 CYS 0.068 0.013 20 0 "[ . 1 . 2]"
1 147 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 149 VAL 0.673 0.120 17 0 "[ . 1 . 2]"
1 150 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 153 THR 0.824 0.117 8 0 "[ . 1 . 2]"
1 154 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 155 LYS 0.045 0.023 19 0 "[ . 1 . 2]"
1 156 ILE 0.015 0.015 1 0 "[ . 1 . 2]"
1 157 PHE 0.005 0.005 17 0 "[ . 1 . 2]"
1 158 GLY 0.019 0.019 2 0 "[ . 1 . 2]"
1 159 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 160 HIS 0.030 0.030 1 0 "[ . 1 . 2]"
1 161 VAL 0.057 0.031 12 0 "[ . 1 . 2]"
1 162 GLY 0.009 0.009 13 0 "[ . 1 . 2]"
1 163 GLY 1.732 0.817 10 2 "[ -. + . 2]"
1 164 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 165 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 166 ARG 0.011 0.009 12 0 "[ . 1 . 2]"
1 167 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 168 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 169 PHE 4.871 0.908 5 3 "[ *+ - . 2]"
1 170 SER 0.186 0.037 6 0 "[ . 1 . 2]"
1 171 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 172 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 173 LEU 0.019 0.019 2 0 "[ . 1 . 2]"
1 174 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 175 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 176 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 177 TYR 0.078 0.031 16 0 "[ . 1 . 2]"
1 178 PHE 0.108 0.031 16 0 "[ . 1 . 2]"
1 179 VAL 0.062 0.031 20 0 "[ . 1 . 2]"
1 180 GLU 0.031 0.031 20 0 "[ . 1 . 2]"
1 181 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 182 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 PRO QB 1 3 ASN HA 5.500 . 5.500 3.850 3.685 4.122 . 0 0 "[ . 1 . 2]" 1
2 1 3 ASN HA 1 4 THR H 4.200 . 4.200 3.509 3.443 3.562 . 0 0 "[ . 1 . 2]" 1
3 1 3 ASN QB 1 4 THR H 5.500 . 5.500 3.227 2.248 3.644 . 0 0 "[ . 1 . 2]" 1
4 1 4 THR H 1 4 THR HB 3.000 . 3.000 2.664 2.492 2.830 . 0 0 "[ . 1 . 2]" 1
5 1 2 PRO HA 1 5 GLU HB2 5.500 . 5.500 3.226 2.690 4.661 . 0 0 "[ . 1 . 2]" 1
6 1 3 ASN HA 1 5 GLU H 5.500 . 5.500 4.389 4.149 4.593 . 0 0 "[ . 1 . 2]" 1
7 1 3 ASN H 1 5 GLU H 4.200 . 4.200 4.072 3.886 4.246 0.046 18 0 "[ . 1 . 2]" 1
8 1 4 THR HB 1 5 GLU HA 5.500 . 5.500 4.036 3.846 4.417 . 0 0 "[ . 1 . 2]" 1
9 1 4 THR MG 1 5 GLU HA 5.500 . 5.500 3.995 3.717 4.347 . 0 0 "[ . 1 . 2]" 1
10 1 4 THR MG 1 5 GLU H 5.500 . 5.500 3.738 3.567 3.888 . 0 0 "[ . 1 . 2]" 1
11 1 4 THR H 1 5 GLU H 5.500 . 5.500 2.617 2.475 2.772 . 0 0 "[ . 1 . 2]" 1
12 1 3 ASN HA 1 6 PHE HB3 5.500 . 5.500 2.820 2.458 3.335 . 0 0 "[ . 1 . 2]" 1
13 1 3 ASN HA 1 6 PHE QD 5.500 . 5.500 4.227 3.687 4.740 . 0 0 "[ . 1 . 2]" 1
14 1 3 ASN HA 1 6 PHE H 5.500 . 5.500 3.519 3.274 3.714 . 0 0 "[ . 1 . 2]" 1
15 1 6 PHE HA 1 6 PHE QD 3.000 . 3.000 2.738 2.596 2.879 . 0 0 "[ . 1 . 2]" 1
16 1 6 PHE HA 1 6 PHE QE 5.500 . 5.500 4.648 4.539 4.729 . 0 0 "[ . 1 . 2]" 1
17 1 6 PHE H 1 6 PHE HA 3.000 . 3.000 2.809 2.786 2.832 . 0 0 "[ . 1 . 2]" 1
18 1 6 PHE H 1 6 PHE HB3 4.200 . 4.200 2.495 2.408 2.577 . 0 0 "[ . 1 . 2]" 1
19 1 6 PHE H 1 6 PHE QD 5.500 . 5.500 4.202 4.169 4.230 . 0 0 "[ . 1 . 2]" 1
20 1 4 THR HA 1 7 ALA MB 5.500 . 5.500 2.560 2.117 2.881 . 0 0 "[ . 1 . 2]" 1
21 1 5 GLU HA 1 7 ALA H 5.500 . 5.500 4.503 4.304 4.746 . 0 0 "[ . 1 . 2]" 1
22 1 6 PHE QD 1 7 ALA HA 5.500 . 5.500 3.407 3.192 3.555 . 0 0 "[ . 1 . 2]" 1
23 1 6 PHE HA 1 7 ALA H 5.500 . 5.500 3.529 3.505 3.566 . 0 0 "[ . 1 . 2]" 1
24 1 6 PHE HB2 1 7 ALA H 5.500 . 5.500 3.844 3.760 3.949 . 0 0 "[ . 1 . 2]" 1
25 1 6 PHE QD 1 7 ALA H 5.500 . 5.500 3.402 3.238 3.606 . 0 0 "[ . 1 . 2]" 1
26 1 6 PHE H 1 7 ALA H 5.500 . 5.500 2.671 2.599 2.762 . 0 0 "[ . 1 . 2]" 1
27 1 5 GLU HA 1 8 LEU QB 5.500 . 5.500 2.798 2.074 3.439 . 0 0 "[ . 1 . 2]" 1
28 1 5 GLU HA 1 8 LEU QD 5.500 . 5.500 3.394 2.396 4.121 . 0 0 "[ . 1 . 2]" 1
29 1 7 ALA H 1 8 LEU H 5.500 . 5.500 2.727 2.613 2.878 . 0 0 "[ . 1 . 2]" 1
30 1 6 PHE HA 1 9 SER H 4.200 . 4.200 3.604 3.331 3.793 . 0 0 "[ . 1 . 2]" 1
31 1 7 ALA H 1 9 SER H 5.500 . 5.500 4.238 4.021 4.473 . 0 0 "[ . 1 . 2]" 1
32 1 8 LEU QB 1 9 SER H 4.200 . 4.200 2.587 2.330 2.752 . 0 0 "[ . 1 . 2]" 1
33 1 8 LEU QD 1 9 SER H 5.500 . 5.500 3.822 3.200 4.190 . 0 0 "[ . 1 . 2]" 1
34 1 8 LEU H 1 9 SER H 3.000 . 3.000 2.686 2.534 2.887 . 0 0 "[ . 1 . 2]" 1
35 1 9 SER H 1 9 SER HA 3.000 . 3.000 2.836 2.803 2.874 . 0 0 "[ . 1 . 2]" 1
36 1 9 SER H 1 9 SER QB 3.000 . 3.000 2.461 2.220 2.703 . 0 0 "[ . 1 . 2]" 1
37 1 7 ALA HA 1 10 LEU QD 5.500 . 5.500 3.049 2.774 3.375 . 0 0 "[ . 1 . 2]" 1
38 1 8 LEU H 1 10 LEU H 5.500 . 5.500 4.105 3.880 4.310 . 0 0 "[ . 1 . 2]" 1
39 1 9 SER H 1 10 LEU HB3 5.500 . 5.500 4.595 4.433 4.809 . 0 0 "[ . 1 . 2]" 1
40 1 9 SER HA 1 10 LEU H 5.500 . 5.500 3.511 3.465 3.554 . 0 0 "[ . 1 . 2]" 1
41 1 10 LEU H 1 10 LEU HB3 3.000 . 3.000 2.430 2.349 2.511 . 0 0 "[ . 1 . 2]" 1
42 1 10 LEU H 1 10 LEU HB2 3.000 . 3.000 2.443 2.344 2.546 . 0 0 "[ . 1 . 2]" 1
43 1 7 ALA HA 1 11 LEU H 5.500 . 5.500 3.848 3.629 4.016 . 0 0 "[ . 1 . 2]" 1
44 1 8 LEU HA 1 11 LEU QB 5.500 . 5.500 2.519 2.316 3.139 . 0 0 "[ . 1 . 2]" 1
45 1 8 LEU HA 1 11 LEU QD 5.500 . 5.500 2.981 2.608 3.957 . 0 0 "[ . 1 . 2]" 1
46 1 10 LEU HG 1 11 LEU HA 5.500 . 5.500 3.854 3.395 4.147 . 0 0 "[ . 1 . 2]" 1
47 1 10 LEU HB3 1 11 LEU H 5.500 . 5.500 2.445 2.096 2.717 . 0 0 "[ . 1 . 2]" 1
48 1 10 LEU H 1 11 LEU H 5.500 . 5.500 2.559 2.382 2.776 . 0 0 "[ . 1 . 2]" 1
49 1 11 LEU H 1 11 LEU HG 5.500 . 5.500 4.460 4.363 4.530 . 0 0 "[ . 1 . 2]" 1
50 1 9 SER HA 1 12 ARG QG 5.500 . 5.500 4.162 3.342 4.683 . 0 0 "[ . 1 . 2]" 1
51 1 11 LEU QD 1 12 ARG HA 5.500 . 5.500 3.680 2.568 4.160 . 0 0 "[ . 1 . 2]" 1
52 1 11 LEU HG 1 12 ARG HA 5.500 . 5.500 3.850 3.214 5.301 . 0 0 "[ . 1 . 2]" 1
53 1 11 LEU QD 1 12 ARG H 5.500 . 5.500 3.510 3.120 3.798 . 0 0 "[ . 1 . 2]" 1
54 1 11 LEU H 1 12 ARG H 5.500 . 5.500 2.899 2.713 3.103 . 0 0 "[ . 1 . 2]" 1
55 1 12 ARG HA 1 12 ARG QG 3.000 . 3.000 2.425 2.328 2.615 . 0 0 "[ . 1 . 2]" 1
56 1 12 ARG H 1 12 ARG QB 3.000 . 3.000 2.446 2.345 2.564 . 0 0 "[ . 1 . 2]" 1
57 1 12 ARG H 1 12 ARG QG 4.200 . 4.200 2.269 1.986 2.439 . 0 0 "[ . 1 . 2]" 1
58 1 12 ARG HA 1 13 LYS HA 5.500 . 5.500 4.439 4.333 4.657 . 0 0 "[ . 1 . 2]" 1
59 1 12 ARG HA 1 13 LYS H 5.500 . 5.500 3.252 3.085 3.461 . 0 0 "[ . 1 . 2]" 1
60 1 10 LEU HA 1 14 ASN QB 5.500 . 5.500 3.827 3.180 4.472 . 0 0 "[ . 1 . 2]" 1
61 1 10 LEU QD 1 14 ASN QB 5.500 . 5.500 2.261 2.004 2.642 . 0 0 "[ . 1 . 2]" 1
62 1 13 LYS QB 1 14 ASN HA 5.500 . 5.500 4.014 3.748 4.366 . 0 0 "[ . 1 . 2]" 1
63 1 13 LYS H 1 14 ASN H 5.500 . 5.500 2.209 1.941 2.554 . 0 0 "[ . 1 . 2]" 1
64 1 10 LEU HG 1 15 ILE MD 5.500 . 5.500 2.506 1.922 3.212 . 0 0 "[ . 1 . 2]" 1
65 1 11 LEU HA 1 15 ILE HB 5.500 . 5.500 1.996 1.810 3.493 . 0 0 "[ . 1 . 2]" 1
66 1 11 LEU HG 1 15 ILE HB 5.500 . 5.500 3.647 2.192 4.768 . 0 0 "[ . 1 . 2]" 1
67 1 11 LEU HA 1 15 ILE MD 5.500 . 5.500 1.971 1.853 2.714 . 0 0 "[ . 1 . 2]" 1
68 1 11 LEU QB 1 15 ILE MD 5.500 . 5.500 2.842 2.159 3.811 . 0 0 "[ . 1 . 2]" 1
69 1 11 LEU H 1 15 ILE MD 5.500 . 5.500 3.255 2.991 4.457 . 0 0 "[ . 1 . 2]" 1
70 1 11 LEU HA 1 15 ILE QG 5.500 . 5.500 2.507 1.705 2.898 0.095 12 0 "[ . 1 . 2]" 1
71 1 11 LEU HA 1 15 ILE H 4.200 . 4.200 3.338 2.926 3.827 . 0 0 "[ . 1 . 2]" 1
72 1 12 ARG HA 1 15 ILE HB 5.500 . 5.500 5.007 4.465 5.514 0.014 5 0 "[ . 1 . 2]" 1
73 1 14 ASN H 1 15 ILE HB 5.500 . 5.500 4.369 4.086 4.830 . 0 0 "[ . 1 . 2]" 1
74 1 14 ASN QB 1 15 ILE H 5.500 . 5.500 3.386 3.044 3.587 . 0 0 "[ . 1 . 2]" 1
75 1 14 ASN H 1 15 ILE H 4.200 . 4.200 2.235 1.993 2.730 . 0 0 "[ . 1 . 2]" 1
76 1 15 ILE H 1 15 ILE HA 3.000 . 3.000 2.917 2.883 2.945 . 0 0 "[ . 1 . 2]" 1
77 1 15 ILE H 1 15 ILE HB 4.200 . 4.200 2.529 2.347 2.699 . 0 0 "[ . 1 . 2]" 1
78 1 15 ILE H 1 15 ILE MD 5.500 . 5.500 3.849 2.473 4.168 . 0 0 "[ . 1 . 2]" 1
79 1 15 ILE MG 1 16 MET HA 5.500 . 5.500 3.622 3.120 4.016 . 0 0 "[ . 1 . 2]" 1
80 1 15 ILE HA 1 16 MET H 5.500 . 5.500 2.128 2.013 2.225 . 0 0 "[ . 1 . 2]" 1
81 1 15 ILE HB 1 16 MET H 5.500 . 5.500 4.284 4.021 4.435 . 0 0 "[ . 1 . 2]" 1
82 1 15 ILE QG 1 16 MET H 5.500 . 5.500 4.167 3.911 4.602 . 0 0 "[ . 1 . 2]" 1
83 1 15 ILE QG 1 16 MET H 5.500 . 5.500 2.834 2.330 3.180 . 0 0 "[ . 1 . 2]" 1
84 1 16 MET HA 1 17 THR H 4.200 . 4.200 2.280 2.087 2.492 . 0 0 "[ . 1 . 2]" 1
85 1 16 MET QB 1 17 THR H 5.500 . 5.500 2.899 2.263 3.711 . 0 0 "[ . 1 . 2]" 1
86 1 17 THR H 1 17 THR HB 4.200 . 4.200 2.583 2.455 3.095 . 0 0 "[ . 1 . 2]" 1
87 1 17 THR HA 1 18 ILE H 3.000 . 3.000 2.189 2.117 2.295 . 0 0 "[ . 1 . 2]" 1
88 1 17 THR HB 1 18 ILE H 5.500 . 5.500 4.194 3.897 4.390 . 0 0 "[ . 1 . 2]" 1
89 1 17 THR MG 1 18 ILE H 5.500 . 5.500 2.970 2.559 3.504 . 0 0 "[ . 1 . 2]" 1
90 1 18 ILE HA 1 18 ILE HG12 4.200 . 4.200 2.491 2.372 2.554 . 0 0 "[ . 1 . 2]" 1
91 1 18 ILE QG 1 19 THR HA 5.500 . 5.500 3.865 3.704 3.966 . 0 0 "[ . 1 . 2]" 1
92 1 18 ILE H 1 19 THR HA 5.500 . 5.500 4.870 4.649 5.072 . 0 0 "[ . 1 . 2]" 1
93 1 18 ILE HA 1 19 THR H 3.000 . 3.000 2.108 2.050 2.158 . 0 0 "[ . 1 . 2]" 1
94 1 18 ILE HG13 1 19 THR H 5.500 . 5.500 5.080 5.019 5.145 . 0 0 "[ . 1 . 2]" 1
95 1 18 ILE QG 1 19 THR H 5.500 . 5.500 2.910 2.696 3.152 . 0 0 "[ . 1 . 2]" 1
96 1 18 ILE H 1 19 THR H 5.500 . 5.500 4.199 4.007 4.337 . 0 0 "[ . 1 . 2]" 1
97 1 19 THR H 1 19 THR HB 4.200 . 4.200 2.618 2.408 3.478 . 0 0 "[ . 1 . 2]" 1
98 1 18 ILE HB 1 20 THR MG 5.500 . 5.500 3.231 3.028 3.548 . 0 0 "[ . 1 . 2]" 1
99 1 18 ILE QG 1 20 THR H 5.500 . 5.500 3.549 3.349 3.613 . 0 0 "[ . 1 . 2]" 1
100 1 19 THR HA 1 20 THR H 3.000 . 3.000 2.124 2.053 2.210 . 0 0 "[ . 1 . 2]" 1
101 1 19 THR MG 1 20 THR H 5.500 . 5.500 3.288 2.985 4.075 . 0 0 "[ . 1 . 2]" 1
102 1 20 THR HA 1 20 THR HB 3.000 . 3.000 2.475 2.438 2.519 . 0 0 "[ . 1 . 2]" 1
103 1 20 THR HA 1 21 SER HA 5.500 . 5.500 4.375 4.301 4.480 . 0 0 "[ . 1 . 2]" 1
104 1 20 THR HB 1 21 SER HA 5.500 . 5.500 4.540 4.429 4.667 . 0 0 "[ . 1 . 2]" 1
105 1 20 THR HB 1 22 LYS H 4.200 . 4.200 2.953 2.756 3.800 . 0 0 "[ . 1 . 2]" 1
106 1 20 THR H 1 22 LYS H 5.500 . 5.500 4.113 3.587 4.913 . 0 0 "[ . 1 . 2]" 1
107 1 21 SER HA 1 22 LYS H 5.500 . 5.500 3.427 3.246 3.573 . 0 0 "[ . 1 . 2]" 1
108 1 21 SER QB 1 22 LYS H 5.500 . 5.500 3.115 2.612 3.445 . 0 0 "[ . 1 . 2]" 1
109 1 22 LYS HA 1 22 LYS HB3 3.000 . 3.000 2.772 2.459 3.024 0.024 10 0 "[ . 1 . 2]" 1
110 1 22 LYS HA 1 22 LYS QD 3.000 . 3.000 2.086 1.906 2.226 . 0 0 "[ . 1 . 2]" 1
111 1 22 LYS HA 1 22 LYS QE 5.500 . 5.500 3.644 2.363 4.175 . 0 0 "[ . 1 . 2]" 1
112 1 22 LYS H 1 22 LYS HB3 4.200 . 4.200 3.120 2.423 3.754 . 0 0 "[ . 1 . 2]" 1
113 1 20 THR H 1 23 GLY H 5.500 . 5.500 3.163 2.750 4.182 . 0 0 "[ . 1 . 2]" 1
114 1 22 LYS H 1 23 GLY QA 5.500 . 5.500 4.275 4.057 4.479 . 0 0 "[ . 1 . 2]" 1
115 1 22 LYS H 1 23 GLY H 4.200 . 4.200 2.311 2.042 2.522 . 0 0 "[ . 1 . 2]" 1
116 1 17 THR MG 1 24 GLU HA 5.500 . 5.500 3.432 2.931 3.989 . 0 0 "[ . 1 . 2]" 1
117 1 17 THR MG 1 24 GLU QB 4.200 . 4.200 2.187 1.867 2.824 . 0 0 "[ . 1 . 2]" 1
118 1 17 THR MG 1 24 GLU QG 5.500 . 5.500 3.212 2.345 3.857 . 0 0 "[ . 1 . 2]" 1
119 1 19 THR HA 1 24 GLU HA 3.000 . 3.000 2.207 1.928 2.574 . 0 0 "[ . 1 . 2]" 1
120 1 19 THR MG 1 24 GLU HA 5.500 . 5.500 3.441 2.733 3.942 . 0 0 "[ . 1 . 2]" 1
121 1 19 THR HA 1 24 GLU QB 5.500 . 5.500 3.886 3.040 4.511 . 0 0 "[ . 1 . 2]" 1
122 1 19 THR HA 1 24 GLU QG 5.500 . 5.500 2.972 1.864 4.608 . 0 0 "[ . 1 . 2]" 1
123 1 20 THR H 1 24 GLU HA 4.200 . 4.200 3.268 2.506 3.783 . 0 0 "[ . 1 . 2]" 1
124 1 23 GLY QA 1 24 GLU H 5.500 . 5.500 2.214 2.143 2.270 . 0 0 "[ . 1 . 2]" 1
125 1 24 GLU H 1 24 GLU QG 4.200 . 4.200 2.807 2.233 3.620 . 0 0 "[ . 1 . 2]" 1
126 1 17 THR MG 1 25 PHE H 5.500 . 5.500 3.764 3.290 4.307 . 0 0 "[ . 1 . 2]" 1
127 1 18 ILE HB 1 25 PHE H 5.500 . 5.500 3.845 3.591 4.079 . 0 0 "[ . 1 . 2]" 1
128 1 18 ILE QG 1 25 PHE H 5.500 . 5.500 4.088 3.902 4.212 . 0 0 "[ . 1 . 2]" 1
129 1 18 ILE H 1 25 PHE H 5.500 . 5.500 3.322 2.975 3.663 . 0 0 "[ . 1 . 2]" 1
130 1 19 THR HA 1 25 PHE H 4.200 . 4.200 3.397 3.004 4.027 . 0 0 "[ . 1 . 2]" 1
131 1 20 THR MG 1 25 PHE QB 5.500 . 5.500 3.154 2.224 3.673 . 0 0 "[ . 1 . 2]" 1
132 1 22 LYS H 1 25 PHE QE 5.500 . 5.500 3.550 3.398 4.130 . 0 0 "[ . 1 . 2]" 1
133 1 24 GLU HA 1 25 PHE QD 5.500 . 5.500 3.916 3.500 4.696 . 0 0 "[ . 1 . 2]" 1
134 1 24 GLU HA 1 25 PHE H 5.500 . 5.500 2.115 2.037 2.253 . 0 0 "[ . 1 . 2]" 1
135 1 24 GLU QB 1 25 PHE H 5.500 . 5.500 3.487 3.312 3.664 . 0 0 "[ . 1 . 2]" 1
136 1 15 ILE MG 1 26 THR HA 5.500 . 5.500 4.084 3.484 4.533 . 0 0 "[ . 1 . 2]" 1
137 1 15 ILE MG 1 26 THR MG 5.500 . 5.500 2.226 1.768 3.712 0.032 11 0 "[ . 1 . 2]" 1
138 1 25 PHE HA 1 26 THR H 5.500 . 5.500 2.606 2.242 2.811 . 0 0 "[ . 1 . 2]" 1
139 1 25 PHE QB 1 26 THR H 5.500 . 5.500 2.206 1.775 3.044 0.025 1 0 "[ . 1 . 2]" 1
140 1 18 ILE MD 1 27 GLY QA 5.500 . 5.500 2.053 1.915 2.347 . 0 0 "[ . 1 . 2]" 1
141 1 18 ILE HB 1 27 GLY QA 5.500 . 5.500 3.734 3.264 4.268 . 0 0 "[ . 1 . 2]" 1
142 1 26 THR MG 1 27 GLY H 5.500 . 5.500 3.061 2.498 4.309 . 0 0 "[ . 1 . 2]" 1
143 1 15 ILE HA 1 28 LEU HA 5.500 . 5.500 2.892 2.674 3.148 . 0 0 "[ . 1 . 2]" 1
144 1 15 ILE QG 1 28 LEU HA 5.500 . 5.500 3.661 2.948 4.765 . 0 0 "[ . 1 . 2]" 1
145 1 27 GLY QA 1 28 LEU H 5.500 . 5.500 2.105 2.074 2.163 . 0 0 "[ . 1 . 2]" 1
146 1 16 MET H 1 29 GLY H 5.500 . 5.500 4.197 3.558 5.002 . 0 0 "[ . 1 . 2]" 1
147 1 28 LEU HA 1 29 GLY H 4.200 . 4.200 2.106 2.062 2.145 . 0 0 "[ . 1 . 2]" 1
148 1 28 LEU QB 1 29 GLY H 5.500 . 5.500 3.837 3.798 3.896 . 0 0 "[ . 1 . 2]" 1
149 1 28 LEU QD 1 30 ILE MD 5.500 . 5.500 2.307 2.116 2.597 . 0 0 "[ . 1 . 2]" 1
150 1 28 LEU HG 1 30 ILE MD 5.500 . 5.500 2.301 2.096 2.530 . 0 0 "[ . 1 . 2]" 1
151 1 28 LEU HG 1 30 ILE H 5.500 . 5.500 4.513 4.072 4.847 . 0 0 "[ . 1 . 2]" 1
152 1 29 GLY HA2 1 30 ILE HA 5.500 . 5.500 4.373 4.342 4.416 . 0 0 "[ . 1 . 2]" 1
153 1 29 GLY HA3 1 30 ILE H 5.500 . 5.500 3.194 3.061 3.321 . 0 0 "[ . 1 . 2]" 1
154 1 29 GLY HA2 1 30 ILE H 5.500 . 5.500 2.158 2.103 2.217 . 0 0 "[ . 1 . 2]" 1
155 1 29 GLY H 1 30 ILE H 5.500 . 5.500 4.447 4.243 4.553 . 0 0 "[ . 1 . 2]" 1
156 1 30 ILE H 1 30 ILE MD 5.500 . 5.500 3.423 3.202 3.710 . 0 0 "[ . 1 . 2]" 1
157 1 30 ILE HB 1 31 HIS H 3.000 . 3.000 2.367 2.199 2.512 . 0 0 "[ . 1 . 2]" 1
158 1 30 ILE HG12 1 31 HIS H 5.500 . 5.500 4.065 3.940 4.224 . 0 0 "[ . 1 . 2]" 1
159 1 30 ILE MG 1 31 HIS H 5.500 . 5.500 3.312 3.129 3.454 . 0 0 "[ . 1 . 2]" 1
160 1 30 ILE H 1 31 HIS H 5.500 . 5.500 2.374 2.177 2.618 . 0 0 "[ . 1 . 2]" 1
161 1 31 HIS HA 1 32 ASP H 4.200 . 4.200 2.216 2.090 2.424 . 0 0 "[ . 1 . 2]" 1
162 1 31 HIS QB 1 32 ASP H 5.500 . 5.500 3.007 2.176 3.950 . 0 0 "[ . 1 . 2]" 1
163 1 32 ASP H 1 32 ASP HA 3.000 . 3.000 2.233 2.200 2.302 . 0 0 "[ . 1 . 2]" 1
164 1 32 ASP QB 1 33 ARG H 3.000 . 3.000 1.995 1.735 2.315 0.065 9 0 "[ . 1 . 2]" 1
165 1 30 ILE HB 1 34 VAL HB 5.500 . 5.500 2.981 2.514 4.913 . 0 0 "[ . 1 . 2]" 1
166 1 30 ILE H 1 34 VAL HB 5.500 . 5.500 3.865 3.459 5.601 0.101 11 0 "[ . 1 . 2]" 1
167 1 30 ILE HB 1 34 VAL QG 5.500 . 5.500 2.493 1.944 2.640 . 0 0 "[ . 1 . 2]" 1
168 1 30 ILE QG 1 34 VAL QG 5.500 . 5.500 2.649 2.334 2.773 . 0 0 "[ . 1 . 2]" 1
169 1 30 ILE H 1 34 VAL QG 5.500 . 5.500 3.427 2.980 3.649 . 0 0 "[ . 1 . 2]" 1
170 1 31 HIS H 1 34 VAL QG 5.500 . 5.500 3.275 2.117 3.497 . 0 0 "[ . 1 . 2]" 1
171 1 31 HIS HA 1 34 VAL H 5.500 . 5.500 4.786 4.694 4.894 . 0 0 "[ . 1 . 2]" 1
172 1 31 HIS QB 1 34 VAL H 5.500 . 5.500 4.745 4.034 5.009 . 0 0 "[ . 1 . 2]" 1
173 1 31 HIS H 1 34 VAL H 5.500 . 5.500 3.232 3.057 3.382 . 0 0 "[ . 1 . 2]" 1
174 1 32 ASP H 1 34 VAL H 5.500 . 5.500 4.523 4.347 4.600 . 0 0 "[ . 1 . 2]" 1
175 1 33 ARG H 1 34 VAL HB 5.500 . 5.500 3.970 3.704 4.490 . 0 0 "[ . 1 . 2]" 1
176 1 33 ARG HA 1 34 VAL H 5.500 . 5.500 3.101 2.930 3.223 . 0 0 "[ . 1 . 2]" 1
177 1 33 ARG QG 1 34 VAL H 5.500 . 5.500 3.948 3.193 4.918 . 0 0 "[ . 1 . 2]" 1
178 1 33 ARG H 1 34 VAL H 4.200 . 4.200 1.990 1.793 2.611 0.007 2 0 "[ . 1 . 2]" 1
179 1 34 VAL H 1 34 VAL HB 3.000 . 3.000 2.434 2.316 2.917 . 0 0 "[ . 1 . 2]" 1
180 1 34 VAL H 1 34 VAL QG 4.200 . 4.200 2.356 2.152 2.542 . 0 0 "[ . 1 . 2]" 1
181 1 18 ILE MD 1 35 CYS QB 5.500 . 5.500 3.237 2.829 3.688 . 0 0 "[ . 1 . 2]" 1
182 1 29 GLY HA3 1 35 CYS HA 5.500 . 5.500 3.841 3.728 4.005 . 0 0 "[ . 1 . 2]" 1
183 1 29 GLY HA2 1 35 CYS HA 4.200 . 4.200 2.089 1.979 2.264 . 0 0 "[ . 1 . 2]" 1
184 1 29 GLY HA3 1 35 CYS QB 5.500 . 5.500 4.096 3.251 4.594 . 0 0 "[ . 1 . 2]" 1
185 1 29 GLY HA2 1 35 CYS QB 5.500 . 5.500 2.955 2.224 3.409 . 0 0 "[ . 1 . 2]" 1
186 1 30 ILE HB 1 35 CYS HA 5.500 . 5.500 4.320 4.085 4.597 . 0 0 "[ . 1 . 2]" 1
187 1 30 ILE MD 1 35 CYS HA 5.500 . 5.500 4.332 3.824 4.563 . 0 0 "[ . 1 . 2]" 1
188 1 30 ILE HG12 1 35 CYS HA 5.500 . 5.500 3.068 2.591 3.319 . 0 0 "[ . 1 . 2]" 1
189 1 30 ILE H 1 35 CYS HA 4.200 . 4.200 2.579 2.337 2.840 . 0 0 "[ . 1 . 2]" 1
190 1 30 ILE H 1 35 CYS QB 5.500 . 5.500 4.312 3.703 4.661 . 0 0 "[ . 1 . 2]" 1
191 1 30 ILE H 1 35 CYS H 5.500 . 5.500 4.590 4.475 4.735 . 0 0 "[ . 1 . 2]" 1
192 1 31 HIS H 1 35 CYS H 5.500 . 5.500 5.464 5.370 5.536 0.036 4 0 "[ . 1 . 2]" 1
193 1 34 VAL HA 1 35 CYS HA 5.500 . 5.500 4.382 4.334 4.420 . 0 0 "[ . 1 . 2]" 1
194 1 34 VAL QG 1 35 CYS HA 5.500 . 5.500 3.553 3.242 3.678 . 0 0 "[ . 1 . 2]" 1
195 1 34 VAL HA 1 35 CYS H 3.000 . 3.000 2.141 2.043 2.206 . 0 0 "[ . 1 . 2]" 1
196 1 34 VAL QG 1 35 CYS H 4.200 . 4.200 2.964 2.776 3.077 . 0 0 "[ . 1 . 2]" 1
197 1 30 ILE MD 1 36 VAL QG 5.500 . 5.500 2.329 2.002 2.818 . 0 0 "[ . 1 . 2]" 1
198 1 18 ILE HB 1 37 ILE MD 5.500 . 5.500 2.384 2.050 3.029 . 0 0 "[ . 1 . 2]" 1
199 1 18 ILE MD 1 37 ILE MD 5.500 . 5.500 2.263 1.988 2.653 . 0 0 "[ . 1 . 2]" 1
200 1 18 ILE MG 1 37 ILE MD 5.500 . 5.500 2.620 2.220 3.054 . 0 0 "[ . 1 . 2]" 1
201 1 20 THR MG 1 37 ILE MD 5.500 . 5.500 2.282 1.986 2.959 . 0 0 "[ . 1 . 2]" 1
202 1 25 PHE QB 1 37 ILE MD 5.500 . 5.500 2.371 1.930 3.049 . 0 0 "[ . 1 . 2]" 1
203 1 27 GLY QA 1 37 ILE HA 5.500 . 5.500 3.514 3.074 4.091 . 0 0 "[ . 1 . 2]" 1
204 1 27 GLY QA 1 37 ILE MD 5.500 . 5.500 3.086 2.075 3.808 . 0 0 "[ . 1 . 2]" 1
205 1 37 ILE HA 1 37 ILE HG12 4.200 . 4.200 3.239 2.787 3.825 . 0 0 "[ . 1 . 2]" 1
206 1 37 ILE HA 1 38 PRO QG 5.500 . 5.500 3.910 3.818 4.105 . 0 0 "[ . 1 . 2]" 1
207 1 25 PHE QB 1 41 ALA MB 5.500 . 5.500 3.127 2.425 3.927 . 0 0 "[ . 1 . 2]" 1
208 1 37 ILE MD 1 41 ALA MB 5.500 . 5.500 2.718 2.205 3.654 . 0 0 "[ . 1 . 2]" 1
209 1 21 SER QB 1 42 GLN QB 5.500 . 5.500 2.325 1.817 3.113 . 0 0 "[ . 1 . 2]" 1
210 1 41 ALA MB 1 42 GLN H 5.500 . 5.500 2.843 2.659 3.002 . 0 0 "[ . 1 . 2]" 1
211 1 41 ALA H 1 42 GLN H 4.200 . 4.200 2.308 2.145 2.457 . 0 0 "[ . 1 . 2]" 1
212 1 42 GLN H 1 42 GLN HA 3.000 . 3.000 2.209 2.177 2.250 . 0 0 "[ . 1 . 2]" 1
213 1 42 GLN H 1 42 GLN QG 4.200 . 4.200 2.827 2.581 3.360 . 0 0 "[ . 1 . 2]" 1
214 1 20 THR HA 1 43 PRO HA 4.200 . 4.200 3.167 2.720 3.592 . 0 0 "[ . 1 . 2]" 1
215 1 20 THR HB 1 43 PRO HA 3.000 . 3.000 2.857 2.388 3.065 0.065 1 0 "[ . 1 . 2]" 1
216 1 20 THR MG 1 43 PRO HA 5.500 . 5.500 2.589 2.241 2.964 . 0 0 "[ . 1 . 2]" 1
217 1 42 GLN H 1 43 PRO QD 5.500 . 5.500 2.427 2.062 2.739 . 0 0 "[ . 1 . 2]" 1
218 1 43 PRO HA 1 43 PRO HB3 3.000 . 3.000 2.297 2.275 2.331 . 0 0 "[ . 1 . 2]" 1
219 1 20 THR HA 1 44 GLY H 5.500 . 5.500 4.016 3.406 5.004 . 0 0 "[ . 1 . 2]" 1
220 1 20 THR HB 1 44 GLY H 5.500 . 5.500 4.704 3.992 5.422 . 0 0 "[ . 1 . 2]" 1
221 1 43 PRO HA 1 44 GLY H 3.000 . 3.000 2.323 2.171 2.653 . 0 0 "[ . 1 . 2]" 1
222 1 43 PRO HB3 1 44 GLY H 4.200 . 4.200 3.618 3.138 3.947 . 0 0 "[ . 1 . 2]" 1
223 1 43 PRO HB2 1 44 GLY H 4.200 . 4.200 3.211 2.174 3.906 . 0 0 "[ . 1 . 2]" 1
224 1 44 GLY QA 1 45 ASP HA 5.500 . 5.500 3.929 3.871 3.992 . 0 0 "[ . 1 . 2]" 1
225 1 44 GLY QA 1 45 ASP H 3.000 . 3.000 2.195 2.062 2.283 . 0 0 "[ . 1 . 2]" 1
226 1 44 GLY H 1 45 ASP H 5.500 . 5.500 4.204 3.804 4.480 . 0 0 "[ . 1 . 2]" 1
227 1 45 ASP H 1 45 ASP HA 3.000 . 3.000 2.897 2.831 2.936 . 0 0 "[ . 1 . 2]" 1
228 1 44 GLY QA 1 46 ASP H 5.500 . 5.500 3.187 2.886 4.050 . 0 0 "[ . 1 . 2]" 1
229 1 44 GLY H 1 46 ASP H 5.500 . 5.500 4.390 3.726 5.192 . 0 0 "[ . 1 . 2]" 1
230 1 45 ASP HA 1 46 ASP HA 5.500 . 5.500 4.430 4.263 4.622 . 0 0 "[ . 1 . 2]" 1
231 1 45 ASP H 1 46 ASP H 3.000 . 3.000 2.282 2.115 2.565 . 0 0 "[ . 1 . 2]" 1
232 1 46 ASP H 1 46 ASP HA 3.000 . 3.000 2.887 2.830 2.919 . 0 0 "[ . 1 . 2]" 1
233 1 18 ILE MG 1 47 VAL HB 5.500 . 5.500 2.488 1.909 4.087 . 0 0 "[ . 1 . 2]" 1
234 1 20 THR HA 1 47 VAL QG 5.500 . 5.500 2.932 2.327 3.440 . 0 0 "[ . 1 . 2]" 1
235 1 43 PRO HA 1 47 VAL QG 5.500 . 5.500 2.935 2.609 3.303 . 0 0 "[ . 1 . 2]" 1
236 1 44 GLY H 1 47 VAL HA 5.500 . 5.500 4.465 3.954 4.941 . 0 0 "[ . 1 . 2]" 1
237 1 44 GLY H 1 47 VAL QG 5.500 . 5.500 2.418 1.998 3.242 . 0 0 "[ . 1 . 2]" 1
238 1 46 ASP H 1 47 VAL HA 5.500 . 5.500 4.525 4.251 4.717 . 0 0 "[ . 1 . 2]" 1
239 1 46 ASP HA 1 47 VAL QG 5.500 . 5.500 3.209 3.040 3.594 . 0 0 "[ . 1 . 2]" 1
240 1 46 ASP HA 1 47 VAL H 3.000 . 3.000 2.171 1.986 2.282 . 0 0 "[ . 1 . 2]" 1
241 1 47 VAL HA 1 47 VAL HB 3.000 . 3.000 2.486 2.451 2.526 . 0 0 "[ . 1 . 2]" 1
242 1 47 VAL H 1 47 VAL HB 4.200 . 4.200 3.729 3.039 3.897 . 0 0 "[ . 1 . 2]" 1
243 1 19 THR H 1 48 LEU HA 5.500 . 5.500 4.821 4.537 5.295 . 0 0 "[ . 1 . 2]" 1
244 1 19 THR H 1 48 LEU HB3 5.500 . 5.500 4.311 3.651 5.528 0.028 9 0 "[ . 1 . 2]" 1
245 1 19 THR HB 1 48 LEU QD 5.500 . 5.500 2.872 1.983 3.996 . 0 0 "[ . 1 . 2]" 1
246 1 19 THR H 1 48 LEU H 5.500 . 5.500 3.479 2.938 4.584 . 0 0 "[ . 1 . 2]" 1
247 1 47 VAL HA 1 48 LEU H 4.200 . 4.200 2.372 2.157 2.703 . 0 0 "[ . 1 . 2]" 1
248 1 47 VAL HB 1 48 LEU H 4.200 . 4.200 2.670 1.895 3.992 . 0 0 "[ . 1 . 2]" 1
249 1 47 VAL QG 1 48 LEU H 5.500 . 5.500 2.987 1.877 3.364 . 0 0 "[ . 1 . 2]" 1
250 1 16 MET QB 1 49 VAL QG 5.500 . 5.500 2.168 1.818 2.911 . 0 0 "[ . 1 . 2]" 1
251 1 16 MET QG 1 49 VAL QG 5.500 . 5.500 2.494 1.915 3.142 . 0 0 "[ . 1 . 2]" 1
252 1 18 ILE HA 1 49 VAL HA 4.200 . 4.200 2.517 2.155 2.710 . 0 0 "[ . 1 . 2]" 1
253 1 18 ILE HB 1 49 VAL HA 5.500 . 5.500 5.292 4.869 5.516 0.016 17 0 "[ . 1 . 2]" 1
254 1 18 ILE HG12 1 49 VAL HA 5.500 . 5.500 3.280 2.366 3.783 . 0 0 "[ . 1 . 2]" 1
255 1 18 ILE HA 1 49 VAL HB 5.500 . 5.500 4.683 3.284 5.525 0.025 15 0 "[ . 1 . 2]" 1
256 1 18 ILE HA 1 49 VAL QG 5.500 . 5.500 3.342 2.778 3.905 . 0 0 "[ . 1 . 2]" 1
257 1 19 THR H 1 49 VAL HA 5.500 . 5.500 3.456 2.775 3.883 . 0 0 "[ . 1 . 2]" 1
258 1 48 LEU HA 1 49 VAL H 3.000 . 3.000 2.114 2.023 2.211 . 0 0 "[ . 1 . 2]" 1
259 1 48 LEU HG 1 49 VAL H 5.500 . 5.500 4.990 4.038 5.538 0.038 20 0 "[ . 1 . 2]" 1
260 1 48 LEU H 1 49 VAL H 5.500 . 5.500 4.201 4.112 4.329 . 0 0 "[ . 1 . 2]" 1
261 1 17 THR HB 1 50 ASN HA 3.000 . 3.000 2.747 2.331 3.056 0.056 20 0 "[ . 1 . 2]" 1
262 1 17 THR HB 1 50 ASN H 5.500 . 5.500 3.153 2.427 4.039 . 0 0 "[ . 1 . 2]" 1
263 1 17 THR H 1 50 ASN H 5.500 . 5.500 4.222 3.445 5.295 . 0 0 "[ . 1 . 2]" 1
264 1 18 ILE HA 1 50 ASN H 5.500 . 5.500 3.318 2.728 3.884 . 0 0 "[ . 1 . 2]" 1
265 1 49 VAL QG 1 50 ASN QB 5.500 . 5.500 3.008 2.608 3.617 . 0 0 "[ . 1 . 2]" 1
266 1 49 VAL HB 1 50 ASN H 5.500 . 5.500 4.372 3.733 4.495 . 0 0 "[ . 1 . 2]" 1
267 1 49 VAL QG 1 50 ASN H 5.500 . 5.500 3.240 2.860 3.600 . 0 0 "[ . 1 . 2]" 1
268 1 49 VAL H 1 50 ASN H 5.500 . 5.500 4.008 3.797 4.246 . 0 0 "[ . 1 . 2]" 1
269 1 50 ASN H 1 50 ASN HA 3.000 . 3.000 2.255 2.216 2.289 . 0 0 "[ . 1 . 2]" 1
270 1 48 LEU QD 1 51 GLY QA 5.500 . 5.500 2.743 2.290 3.327 . 0 0 "[ . 1 . 2]" 1
271 1 48 LEU QD 1 51 GLY H 5.500 . 5.500 3.689 1.802 3.997 . 0 0 "[ . 1 . 2]" 1
272 1 49 VAL H 1 51 GLY H 5.500 . 5.500 3.495 3.080 4.521 . 0 0 "[ . 1 . 2]" 1
273 1 50 ASN HA 1 51 GLY H 4.200 . 4.200 3.037 2.429 3.343 . 0 0 "[ . 1 . 2]" 1
274 1 50 ASN QB 1 51 GLY H 5.500 . 5.500 3.625 3.283 4.017 . 0 0 "[ . 1 . 2]" 1
275 1 50 ASN H 1 51 GLY H 5.500 . 5.500 2.687 2.483 2.971 . 0 0 "[ . 1 . 2]" 1
276 1 48 LEU HA 1 52 GLN HA 5.500 . 5.500 4.873 4.637 5.200 . 0 0 "[ . 1 . 2]" 1
277 1 48 LEU HA 1 52 GLN H 5.500 . 5.500 4.395 3.951 4.794 . 0 0 "[ . 1 . 2]" 1
278 1 49 VAL H 1 52 GLN H 4.200 . 4.200 3.466 3.069 3.872 . 0 0 "[ . 1 . 2]" 1
279 1 51 GLY QA 1 52 GLN HA 5.500 . 5.500 4.018 3.914 4.073 . 0 0 "[ . 1 . 2]" 1
280 1 51 GLY QA 1 52 GLN H 4.200 . 4.200 2.792 2.615 2.926 . 0 0 "[ . 1 . 2]" 1
281 1 51 GLY H 1 52 GLN H 5.500 . 5.500 2.429 2.010 3.103 . 0 0 "[ . 1 . 2]" 1
282 1 52 GLN H 1 52 GLN HA 3.000 . 3.000 2.880 2.837 2.940 . 0 0 "[ . 1 . 2]" 1
283 1 47 VAL HA 1 53 LYS HA 5.500 . 5.500 4.963 4.484 5.500 . 0 0 "[ . 1 . 2]" 1
284 1 48 LEU HA 1 53 LYS HA 5.500 . 5.500 2.324 1.893 2.719 . 0 0 "[ . 1 . 2]" 1
285 1 48 LEU QD 1 53 LYS HA 5.500 . 5.500 2.614 2.001 4.195 . 0 0 "[ . 1 . 2]" 1
286 1 48 LEU HA 1 53 LYS H 5.500 . 5.500 4.226 3.853 4.649 . 0 0 "[ . 1 . 2]" 1
287 1 49 VAL H 1 53 LYS HA 4.200 . 4.200 3.430 2.765 4.067 . 0 0 "[ . 1 . 2]" 1
288 1 52 GLN HA 1 53 LYS H 3.000 . 3.000 2.185 2.099 2.282 . 0 0 "[ . 1 . 2]" 1
289 1 52 GLN QB 1 53 LYS H 4.200 . 4.200 3.515 2.980 3.856 . 0 0 "[ . 1 . 2]" 1
290 1 52 GLN H 1 53 LYS H 5.500 . 5.500 4.443 4.314 4.582 . 0 0 "[ . 1 . 2]" 1
291 1 53 LYS HA 1 53 LYS QE 5.500 . 5.500 4.316 2.701 5.083 . 0 0 "[ . 1 . 2]" 1
292 1 53 LYS H 1 53 LYS QE 5.500 . 5.500 4.371 3.690 4.867 . 0 0 "[ . 1 . 2]" 1
293 1 53 LYS H 1 53 LYS QG 4.200 . 4.200 2.940 2.079 3.915 . 0 0 "[ . 1 . 2]" 1
294 1 46 ASP HA 1 54 ILE HA 5.500 . 5.500 5.411 5.006 5.602 0.102 9 0 "[ . 1 . 2]" 1
295 1 46 ASP HA 1 54 ILE H 5.500 . 5.500 4.532 4.191 4.875 . 0 0 "[ . 1 . 2]" 1
296 1 47 VAL QG 1 54 ILE QG 5.500 . 5.500 2.117 1.949 2.233 . 0 0 "[ . 1 . 2]" 1
297 1 47 VAL H 1 54 ILE H 5.500 . 5.500 2.953 2.619 3.235 . 0 0 "[ . 1 . 2]" 1
298 1 48 LEU HA 1 54 ILE H 5.500 . 5.500 3.341 2.863 3.702 . 0 0 "[ . 1 . 2]" 1
299 1 49 VAL HB 1 54 ILE HB 5.500 . 5.500 4.414 3.343 5.505 0.005 9 0 "[ . 1 . 2]" 1
300 1 49 VAL H 1 54 ILE HB 5.500 . 5.500 4.361 3.567 5.089 . 0 0 "[ . 1 . 2]" 1
301 1 53 LYS HA 1 54 ILE H 3.000 . 3.000 2.099 2.004 2.179 . 0 0 "[ . 1 . 2]" 1
302 1 54 ILE HA 1 54 ILE HG12 4.200 . 4.200 3.606 2.547 3.833 . 0 0 "[ . 1 . 2]" 1
303 1 46 ASP HA 1 55 ARG HA 3.000 . 3.000 2.202 1.905 2.700 . 0 0 "[ . 1 . 2]" 1
304 1 46 ASP HB3 1 55 ARG HA 3.000 . 3.000 2.696 2.090 3.044 0.044 9 0 "[ . 1 . 2]" 1
305 1 46 ASP HB2 1 55 ARG HA 3.000 . 3.000 2.881 2.693 3.044 0.044 15 0 "[ . 1 . 2]" 1
306 1 46 ASP HA 1 55 ARG QG 5.500 . 5.500 3.832 3.219 4.711 . 0 0 "[ . 1 . 2]" 1
307 1 46 ASP HB3 1 55 ARG QG 5.500 . 5.500 2.653 1.921 4.289 . 0 0 "[ . 1 . 2]" 1
308 1 46 ASP HB2 1 55 ARG QG 5.500 . 5.500 3.342 2.726 4.580 . 0 0 "[ . 1 . 2]" 1
309 1 54 ILE HG13 1 55 ARG H 5.500 . 5.500 2.858 2.210 4.803 . 0 0 "[ . 1 . 2]" 1
310 1 55 ARG HA 1 55 ARG QG 3.000 . 3.000 2.435 2.267 2.733 . 0 0 "[ . 1 . 2]" 1
311 1 55 ARG H 1 55 ARG QB 3.000 . 3.000 2.371 2.181 2.497 . 0 0 "[ . 1 . 2]" 1
312 1 55 ARG H 1 55 ARG QG 4.200 . 4.200 2.890 2.204 3.901 . 0 0 "[ . 1 . 2]" 1
313 1 46 ASP HA 1 56 VAL HA 5.500 . 5.500 4.967 4.632 5.384 . 0 0 "[ . 1 . 2]" 1
314 1 46 ASP HA 1 56 VAL HB 5.500 . 5.500 4.251 3.780 4.837 . 0 0 "[ . 1 . 2]" 1
315 1 46 ASP HA 1 56 VAL QG 5.500 . 5.500 2.623 2.150 3.222 . 0 0 "[ . 1 . 2]" 1
316 1 46 ASP HA 1 56 VAL H 3.000 . 3.000 2.642 2.294 2.915 . 0 0 "[ . 1 . 2]" 1
317 1 46 ASP HB3 1 56 VAL H 5.500 . 5.500 3.921 3.578 4.475 . 0 0 "[ . 1 . 2]" 1
318 1 46 ASP HB2 1 56 VAL H 5.500 . 5.500 4.513 4.139 4.962 . 0 0 "[ . 1 . 2]" 1
319 1 47 VAL H 1 56 VAL H 5.500 . 5.500 4.301 3.763 4.703 . 0 0 "[ . 1 . 2]" 1
320 1 55 ARG HA 1 56 VAL H 3.000 . 3.000 2.172 2.031 2.299 . 0 0 "[ . 1 . 2]" 1
321 1 55 ARG QG 1 56 VAL H 5.500 . 5.500 3.676 2.236 4.492 . 0 0 "[ . 1 . 2]" 1
322 1 55 ARG H 1 56 VAL H 5.500 . 5.500 4.475 4.291 4.561 . 0 0 "[ . 1 . 2]" 1
323 1 56 VAL H 1 56 VAL HB 3.000 . 3.000 2.518 2.454 2.592 . 0 0 "[ . 1 . 2]" 1
324 1 56 VAL H 1 56 VAL QG 4.200 . 4.200 2.267 2.005 2.529 . 0 0 "[ . 1 . 2]" 1
325 1 56 VAL HA 1 57 LYS H 4.200 . 4.200 2.162 2.089 2.280 . 0 0 "[ . 1 . 2]" 1
326 1 56 VAL HB 1 57 LYS H 5.500 . 5.500 4.084 3.896 4.270 . 0 0 "[ . 1 . 2]" 1
327 1 56 VAL QG 1 57 LYS H 5.500 . 5.500 2.602 2.323 3.143 . 0 0 "[ . 1 . 2]" 1
328 1 56 VAL H 1 57 LYS H 5.500 . 5.500 4.414 4.106 4.604 . 0 0 "[ . 1 . 2]" 1
329 1 57 LYS HA 1 57 LYS QE 5.500 . 5.500 4.560 3.807 4.862 . 0 0 "[ . 1 . 2]" 1
330 1 57 LYS HA 1 57 LYS QG 3.000 . 3.000 2.474 2.338 2.645 . 0 0 "[ . 1 . 2]" 1
331 1 57 LYS QB 1 58 ASP H 3.000 . 3.000 2.150 1.892 2.457 . 0 0 "[ . 1 . 2]" 1
332 1 57 LYS H 1 58 ASP H 4.200 . 4.200 2.601 2.274 3.036 . 0 0 "[ . 1 . 2]" 1
333 1 58 ASP HA 1 59 LYS QG 4.200 . 4.200 3.405 3.192 3.619 . 0 0 "[ . 1 . 2]" 1
334 1 58 ASP HA 1 59 LYS H 3.000 . 3.000 2.236 2.076 2.483 . 0 0 "[ . 1 . 2]" 1
335 1 58 ASP H 1 59 LYS H 5.500 . 5.500 4.319 4.202 4.458 . 0 0 "[ . 1 . 2]" 1
336 1 59 LYS HA 1 59 LYS HB3 3.000 . 3.000 2.417 2.295 2.494 . 0 0 "[ . 1 . 2]" 1
337 1 59 LYS HA 1 59 LYS HB2 3.000 . 3.000 2.933 2.522 3.027 0.027 9 0 "[ . 1 . 2]" 1
338 1 59 LYS H 1 59 LYS HA 3.000 . 3.000 2.924 2.856 2.959 . 0 0 "[ . 1 . 2]" 1
339 1 59 LYS H 1 59 LYS HB3 4.200 . 4.200 3.705 3.371 3.874 . 0 0 "[ . 1 . 2]" 1
340 1 59 LYS H 1 59 LYS HB2 4.200 . 4.200 2.885 2.497 3.894 . 0 0 "[ . 1 . 2]" 1
341 1 59 LYS HA 1 60 TYR QD 5.500 . 5.500 4.172 3.630 4.630 . 0 0 "[ . 1 . 2]" 1
342 1 59 LYS HA 1 60 TYR H 3.000 . 3.000 2.194 2.030 2.265 . 0 0 "[ . 1 . 2]" 1
343 1 60 TYR HA 1 61 LYS H 3.000 . 3.000 2.170 2.078 2.248 . 0 0 "[ . 1 . 2]" 1
344 1 60 TYR QB 1 61 LYS H 5.500 . 5.500 3.414 2.954 3.694 . 0 0 "[ . 1 . 2]" 1
345 1 60 TYR QB 1 62 LEU HA 5.500 . 5.500 4.342 3.801 4.805 . 0 0 "[ . 1 . 2]" 1
346 1 61 LYS QB 1 63 VAL QG 5.500 . 5.500 2.873 2.078 3.671 . 0 0 "[ . 1 . 2]" 1
347 1 62 LEU HA 1 63 VAL HA 5.500 . 5.500 4.301 4.127 4.379 . 0 0 "[ . 1 . 2]" 1
348 1 63 VAL HA 1 64 ASP H 5.500 . 5.500 2.295 2.005 2.628 . 0 0 "[ . 1 . 2]" 1
349 1 63 VAL HB 1 64 ASP H 5.500 . 5.500 3.190 2.014 4.150 . 0 0 "[ . 1 . 2]" 1
350 1 63 VAL QG 1 64 ASP H 5.500 . 5.500 2.855 2.120 3.345 . 0 0 "[ . 1 . 2]" 1
351 1 66 GLU H 1 67 ASN H 4.200 . 4.200 2.559 2.366 2.851 . 0 0 "[ . 1 . 2]" 1
352 1 64 ASP H 1 68 ILE H 5.500 . 5.500 3.439 2.579 4.291 . 0 0 "[ . 1 . 2]" 1
353 1 66 GLU QB 1 68 ILE H 5.500 . 5.500 3.540 2.815 4.576 . 0 0 "[ . 1 . 2]" 1
354 1 66 GLU H 1 68 ILE H 4.200 . 4.200 3.618 3.278 4.211 0.011 17 0 "[ . 1 . 2]" 1
355 1 68 ILE H 1 68 ILE HG13 5.500 . 5.500 3.195 2.234 4.016 . 0 0 "[ . 1 . 2]" 1
356 1 68 ILE H 1 68 ILE HG12 5.500 . 5.500 3.166 2.237 4.097 . 0 0 "[ . 1 . 2]" 1
357 1 63 VAL QG 1 69 ASN HA 5.500 . 5.500 2.415 1.907 3.258 . 0 0 "[ . 1 . 2]" 1
358 1 37 ILE H 1 72 LEU HA 5.500 . 5.500 4.552 4.114 4.874 . 0 0 "[ . 1 . 2]" 1
359 1 62 LEU QB 1 72 LEU QB 5.500 . 5.500 2.329 2.004 2.648 . 0 0 "[ . 1 . 2]" 1
360 1 37 ILE QG 1 73 THR H 5.500 . 5.500 3.706 3.357 4.173 . 0 0 "[ . 1 . 2]" 1
361 1 59 LYS HA 1 73 THR MG 5.500 . 5.500 3.566 3.047 4.464 . 0 0 "[ . 1 . 2]" 1
362 1 60 TYR H 1 73 THR MG 5.500 . 5.500 3.444 2.837 3.979 . 0 0 "[ . 1 . 2]" 1
363 1 61 LYS HA 1 73 THR HA 3.000 . 3.000 2.463 2.063 2.734 . 0 0 "[ . 1 . 2]" 1
364 1 61 LYS HA 1 73 THR MG 5.500 . 5.500 2.679 2.205 3.255 . 0 0 "[ . 1 . 2]" 1
365 1 72 LEU HA 1 73 THR H 5.500 . 5.500 2.197 2.099 2.273 . 0 0 "[ . 1 . 2]" 1
366 1 36 VAL HA 1 74 VAL HA 5.500 . 5.500 2.531 2.228 2.982 . 0 0 "[ . 1 . 2]" 1
367 1 36 VAL QG 1 74 VAL HA 5.500 . 5.500 2.780 2.283 3.447 . 0 0 "[ . 1 . 2]" 1
368 1 36 VAL HA 1 74 VAL QG 5.500 . 5.500 3.436 3.010 3.968 . 0 0 "[ . 1 . 2]" 1
369 1 59 LYS HA 1 74 VAL H 5.500 . 5.500 4.947 4.524 5.362 . 0 0 "[ . 1 . 2]" 1
370 1 60 TYR QB 1 74 VAL HB 5.500 . 5.500 1.943 1.813 2.313 . 0 0 "[ . 1 . 2]" 1
371 1 60 TYR H 1 74 VAL HB 4.200 . 4.200 3.246 2.834 3.803 . 0 0 "[ . 1 . 2]" 1
372 1 60 TYR QB 1 74 VAL QG 5.500 . 5.500 2.789 2.440 3.048 . 0 0 "[ . 1 . 2]" 1
373 1 60 TYR QD 1 74 VAL QG 5.500 . 5.500 2.597 2.106 3.132 . 0 0 "[ . 1 . 2]" 1
374 1 60 TYR H 1 74 VAL H 5.500 . 5.500 3.423 3.142 3.833 . 0 0 "[ . 1 . 2]" 1
375 1 73 THR HA 1 74 VAL QG 5.500 . 5.500 3.552 3.385 3.791 . 0 0 "[ . 1 . 2]" 1
376 1 18 ILE MD 1 75 LEU HG 5.500 . 5.500 4.183 2.988 4.608 . 0 0 "[ . 1 . 2]" 1
377 1 34 VAL HA 1 75 LEU H 5.500 . 5.500 4.787 4.367 5.151 . 0 0 "[ . 1 . 2]" 1
378 1 35 CYS H 1 75 LEU HB3 5.500 . 5.500 4.299 3.253 5.474 . 0 0 "[ . 1 . 2]" 1
379 1 35 CYS H 1 75 LEU HB2 5.500 . 5.500 4.329 3.208 5.210 . 0 0 "[ . 1 . 2]" 1
380 1 35 CYS H 1 75 LEU H 5.500 . 5.500 3.294 2.990 3.584 . 0 0 "[ . 1 . 2]" 1
381 1 56 VAL QG 1 75 LEU HA 5.500 . 5.500 3.101 2.355 3.628 . 0 0 "[ . 1 . 2]" 1
382 1 56 VAL QG 1 75 LEU HG 5.500 . 5.500 3.221 2.207 3.962 . 0 0 "[ . 1 . 2]" 1
383 1 59 LYS HA 1 75 LEU HA 3.000 . 3.000 2.697 2.347 3.030 0.030 19 0 "[ . 1 . 2]" 1
384 1 59 LYS HA 1 75 LEU QD 5.500 . 5.500 2.980 2.113 4.158 . 0 0 "[ . 1 . 2]" 1
385 1 60 TYR H 1 75 LEU HA 5.500 . 5.500 3.578 2.968 3.909 . 0 0 "[ . 1 . 2]" 1
386 1 74 VAL HB 1 75 LEU HA 5.500 . 5.500 4.920 4.574 5.105 . 0 0 "[ . 1 . 2]" 1
387 1 74 VAL HA 1 75 LEU H 4.200 . 4.200 2.094 1.991 2.220 . 0 0 "[ . 1 . 2]" 1
388 1 74 VAL HB 1 75 LEU H 5.500 . 5.500 4.253 4.095 4.364 . 0 0 "[ . 1 . 2]" 1
389 1 74 VAL QG 1 75 LEU H 5.500 . 5.500 2.900 2.618 3.178 . 0 0 "[ . 1 . 2]" 1
390 1 74 VAL H 1 75 LEU H 5.500 . 5.500 4.252 4.099 4.413 . 0 0 "[ . 1 . 2]" 1
391 1 75 LEU HA 1 75 LEU HB2 3.000 . 3.000 2.777 2.394 3.020 0.020 18 0 "[ . 1 . 2]" 1
392 1 75 LEU H 1 75 LEU HB3 4.200 . 4.200 3.134 2.450 3.714 . 0 0 "[ . 1 . 2]" 1
393 1 75 LEU H 1 75 LEU HG 5.500 . 5.500 3.879 2.646 4.641 . 0 0 "[ . 1 . 2]" 1
394 1 34 VAL HA 1 76 THR MG 5.500 . 5.500 3.697 3.106 4.296 . 0 0 "[ . 1 . 2]" 1
395 1 57 LYS QB 1 76 THR HB 5.500 . 5.500 2.636 1.993 3.221 . 0 0 "[ . 1 . 2]" 1
396 1 57 LYS QD 1 76 THR HB 5.500 . 5.500 4.055 3.374 4.949 . 0 0 "[ . 1 . 2]" 1
397 1 57 LYS QB 1 76 THR MG 5.500 . 5.500 2.633 1.814 3.374 . 0 0 "[ . 1 . 2]" 1
398 1 57 LYS QB 1 76 THR H 5.500 . 5.500 4.570 4.304 4.822 . 0 0 "[ . 1 . 2]" 1
399 1 58 ASP QB 1 76 THR HB 5.500 . 5.500 2.713 1.965 4.367 . 0 0 "[ . 1 . 2]" 1
400 1 58 ASP H 1 76 THR HB 3.000 . 3.000 2.090 1.758 2.629 0.042 17 0 "[ . 1 . 2]" 1
401 1 58 ASP H 1 76 THR MG 5.500 . 5.500 3.463 3.036 4.011 . 0 0 "[ . 1 . 2]" 1
402 1 58 ASP H 1 76 THR H 4.200 . 4.200 3.259 2.845 3.498 . 0 0 "[ . 1 . 2]" 1
403 1 59 LYS HA 1 76 THR H 5.500 . 5.500 3.284 2.750 3.855 . 0 0 "[ . 1 . 2]" 1
404 1 75 LEU HA 1 76 THR H 3.000 . 3.000 2.165 2.100 2.249 . 0 0 "[ . 1 . 2]" 1
405 1 75 LEU H 1 76 THR H 5.500 . 5.500 4.309 4.109 4.438 . 0 0 "[ . 1 . 2]" 1
406 1 76 THR H 1 76 THR HB 3.000 . 3.000 2.558 2.425 2.640 . 0 0 "[ . 1 . 2]" 1
407 1 33 ARG HA 1 77 LEU H 5.500 . 5.500 4.258 3.588 4.999 . 0 0 "[ . 1 . 2]" 1
408 1 34 VAL H 1 77 LEU H 5.500 . 5.500 5.186 4.942 5.511 0.011 5 0 "[ . 1 . 2]" 1
409 1 35 CYS H 1 77 LEU H 4.200 . 4.200 3.812 3.243 4.184 . 0 0 "[ . 1 . 2]" 1
410 1 54 ILE MG 1 77 LEU HA 5.500 . 5.500 4.188 3.612 4.488 . 0 0 "[ . 1 . 2]" 1
411 1 56 VAL HA 1 77 LEU HA 3.000 . 3.000 2.536 2.084 2.881 . 0 0 "[ . 1 . 2]" 1
412 1 56 VAL HA 1 77 LEU HG 5.500 . 5.500 4.626 3.555 5.441 . 0 0 "[ . 1 . 2]" 1
413 1 57 LYS H 1 77 LEU HA 4.200 . 4.200 3.213 2.622 3.987 . 0 0 "[ . 1 . 2]" 1
414 1 75 LEU HA 1 77 LEU H 5.500 . 5.500 5.250 4.668 5.527 0.027 7 0 "[ . 1 . 2]" 1
415 1 76 THR HA 1 77 LEU HA 5.500 . 5.500 4.434 4.312 4.541 . 0 0 "[ . 1 . 2]" 1
416 1 76 THR HA 1 77 LEU H 3.000 . 3.000 2.130 1.994 2.270 . 0 0 "[ . 1 . 2]" 1
417 1 76 THR H 1 77 LEU H 5.500 . 5.500 4.087 3.791 4.246 . 0 0 "[ . 1 . 2]" 1
418 1 77 LEU H 1 77 LEU HG 5.500 . 5.500 3.652 2.291 4.554 . 0 0 "[ . 1 . 2]" 1
419 1 54 ILE MD 1 78 ASP QB 5.500 . 5.500 2.852 1.969 3.710 . 0 0 "[ . 1 . 2]" 1
420 1 54 ILE MD 1 78 ASP H 5.500 . 5.500 3.111 1.831 4.182 . 0 0 "[ . 1 . 2]" 1
421 1 54 ILE HG13 1 78 ASP H 4.200 . 4.200 3.147 2.305 4.236 0.036 6 0 "[ . 1 . 2]" 1
422 1 54 ILE HG12 1 78 ASP H 4.200 . 4.200 3.648 2.981 4.216 0.016 6 0 "[ . 1 . 2]" 1
423 1 54 ILE QG 1 78 ASP H 5.500 . 5.500 2.871 2.243 3.584 . 0 0 "[ . 1 . 2]" 1
424 1 57 LYS QB 1 78 ASP QB 5.500 . 5.500 3.045 1.997 4.189 . 0 0 "[ . 1 . 2]" 1
425 1 57 LYS H 1 78 ASP H 5.500 . 5.500 3.600 3.096 4.427 . 0 0 "[ . 1 . 2]" 1
426 1 77 LEU QB 1 78 ASP H 5.500 . 5.500 3.196 2.361 3.873 . 0 0 "[ . 1 . 2]" 1
427 1 77 LEU QD 1 78 ASP H 5.500 . 5.500 3.451 2.709 4.194 . 0 0 "[ . 1 . 2]" 1
428 1 77 LEU H 1 78 ASP H 5.500 . 5.500 4.524 4.291 4.630 . 0 0 "[ . 1 . 2]" 1
429 1 78 ASP H 1 78 ASP QB 3.000 . 3.000 2.333 2.251 2.432 . 0 0 "[ . 1 . 2]" 1
430 1 33 ARG QB 1 79 ARG H 4.200 . 4.200 3.057 1.866 3.854 . 0 0 "[ . 1 . 2]" 1
431 1 77 LEU QB 1 79 ARG H 5.500 . 5.500 3.881 3.352 4.968 . 0 0 "[ . 1 . 2]" 1
432 1 78 ASP H 1 79 ARG HA 5.500 . 5.500 5.170 4.545 5.487 . 0 0 "[ . 1 . 2]" 1
433 1 78 ASP QB 1 79 ARG H 5.500 . 5.500 3.957 3.640 4.021 . 0 0 "[ . 1 . 2]" 1
434 1 79 ARG H 1 79 ARG HA 3.000 . 3.000 2.914 2.776 2.968 . 0 0 "[ . 1 . 2]" 1
435 1 79 ARG HA 1 80 ASN HA 5.500 . 5.500 4.359 4.272 4.434 . 0 0 "[ . 1 . 2]" 1
436 1 79 ARG HA 1 81 GLU H 5.500 . 5.500 3.770 3.010 4.720 . 0 0 "[ . 1 . 2]" 1
437 1 80 ASN HA 1 81 GLU HA 5.500 . 5.500 4.637 4.450 4.814 . 0 0 "[ . 1 . 2]" 1
438 1 80 ASN HA 1 81 GLU H 4.200 . 4.200 3.433 3.186 3.571 . 0 0 "[ . 1 . 2]" 1
439 1 80 ASN QB 1 81 GLU H 4.200 . 4.200 2.878 1.969 3.712 . 0 0 "[ . 1 . 2]" 1
440 1 81 GLU H 1 81 GLU HA 3.000 . 3.000 2.870 2.795 2.918 . 0 0 "[ . 1 . 2]" 1
441 1 81 GLU H 1 81 GLU QB 3.000 . 3.000 2.384 2.241 2.690 . 0 0 "[ . 1 . 2]" 1
442 1 32 ASP HA 1 82 LYS HA 4.200 . 4.200 3.388 1.895 4.236 0.036 18 0 "[ . 1 . 2]" 1
443 1 32 ASP H 1 82 LYS HA 5.500 . 5.500 4.874 3.165 5.565 0.065 5 0 "[ . 1 . 2]" 1
444 1 81 GLU HA 1 82 LYS QB 5.500 . 5.500 4.269 3.836 4.563 . 0 0 "[ . 1 . 2]" 1
445 1 81 GLU HA 1 82 LYS H 3.000 . 3.000 2.166 2.068 2.358 . 0 0 "[ . 1 . 2]" 1
446 1 31 HIS HA 1 83 PHE QB 5.500 . 5.500 3.462 2.561 4.580 . 0 0 "[ . 1 . 2]" 1
447 1 32 ASP H 1 83 PHE QB 5.500 . 5.500 3.432 2.662 4.579 . 0 0 "[ . 1 . 2]" 1
448 1 32 ASP HA 1 83 PHE H 5.500 . 5.500 2.978 1.754 3.899 0.046 13 0 "[ . 1 . 2]" 1
449 1 32 ASP H 1 83 PHE H 5.500 . 5.500 3.527 2.723 4.143 . 0 0 "[ . 1 . 2]" 1
450 1 33 ARG HA 1 83 PHE H 5.500 . 5.500 4.164 3.569 5.332 . 0 0 "[ . 1 . 2]" 1
451 1 82 LYS HA 1 83 PHE HA 5.500 . 5.500 4.320 4.122 4.436 . 0 0 "[ . 1 . 2]" 1
452 1 82 LYS HA 1 83 PHE H 3.000 . 3.000 2.205 2.056 2.464 . 0 0 "[ . 1 . 2]" 1
453 1 82 LYS H 1 83 PHE H 5.500 . 5.500 4.408 4.160 4.558 . 0 0 "[ . 1 . 2]" 1
454 1 83 PHE HA 1 83 PHE QD 3.000 . 3.000 2.717 2.485 3.029 0.029 5 0 "[ . 1 . 2]" 1
455 1 83 PHE HA 1 83 PHE QE 5.500 . 5.500 4.583 4.491 4.698 . 0 0 "[ . 1 . 2]" 1
456 1 14 ASN QD 1 84 ARG QB 5.500 . 5.500 2.846 2.251 3.537 . 0 0 "[ . 1 . 2]" 1
457 1 83 PHE HA 1 84 ARG HA 5.500 . 5.500 4.315 4.165 4.410 . 0 0 "[ . 1 . 2]" 1
458 1 83 PHE HA 1 84 ARG H 3.000 . 3.000 2.306 2.104 2.574 . 0 0 "[ . 1 . 2]" 1
459 1 83 PHE QB 1 84 ARG H 5.500 . 5.500 2.528 2.057 2.906 . 0 0 "[ . 1 . 2]" 1
460 1 31 HIS HA 1 85 ASP HA 4.200 . 4.200 2.491 2.026 3.095 . 0 0 "[ . 1 . 2]" 1
461 1 31 HIS QB 1 85 ASP HA 4.200 . 4.200 2.434 1.871 3.534 . 0 0 "[ . 1 . 2]" 1
462 1 32 ASP H 1 85 ASP HA 5.500 . 5.500 4.054 3.358 4.800 . 0 0 "[ . 1 . 2]" 1
463 1 84 ARG HA 1 85 ASP H 3.000 . 3.000 2.207 2.070 2.302 . 0 0 "[ . 1 . 2]" 1
464 1 84 ARG QG 1 85 ASP H 5.500 . 5.500 2.904 2.407 3.589 . 0 0 "[ . 1 . 2]" 1
465 1 10 LEU HA 1 86 ILE QG 5.500 . 5.500 3.837 3.645 4.105 . 0 0 "[ . 1 . 2]" 1
466 1 10 LEU QD 1 86 ILE MG 5.500 . 5.500 2.017 1.869 2.147 . 0 0 "[ . 1 . 2]" 1
467 1 14 ASN QB 1 86 ILE MD 5.500 . 5.500 2.969 2.252 4.074 . 0 0 "[ . 1 . 2]" 1
468 1 14 ASN QB 1 86 ILE MG 5.500 . 5.500 3.171 2.848 3.432 . 0 0 "[ . 1 . 2]" 1
469 1 30 ILE HA 1 86 ILE MD 4.200 . 4.200 2.352 1.917 2.740 . 0 0 "[ . 1 . 2]" 1
470 1 30 ILE MD 1 86 ILE MD 5.500 . 5.500 2.343 1.999 2.922 . 0 0 "[ . 1 . 2]" 1
471 1 30 ILE HA 1 86 ILE HG13 4.200 . 4.200 2.755 2.472 2.999 . 0 0 "[ . 1 . 2]" 1
472 1 30 ILE MD 1 86 ILE HG13 5.500 . 5.500 3.481 2.586 4.158 . 0 0 "[ . 1 . 2]" 1
473 1 30 ILE HA 1 86 ILE HG12 5.500 . 5.500 2.914 2.254 3.811 . 0 0 "[ . 1 . 2]" 1
474 1 30 ILE MD 1 86 ILE HG12 5.500 . 5.500 3.894 3.350 4.386 . 0 0 "[ . 1 . 2]" 1
475 1 30 ILE QG 1 86 ILE H 5.500 . 5.500 3.719 3.534 3.910 . 0 0 "[ . 1 . 2]" 1
476 1 84 ARG QG 1 86 ILE HA 5.500 . 5.500 3.759 3.289 4.693 . 0 0 "[ . 1 . 2]" 1
477 1 84 ARG QB 1 86 ILE QG 5.500 . 5.500 2.984 2.577 3.283 . 0 0 "[ . 1 . 2]" 1
478 1 84 ARG QG 1 86 ILE MG 5.500 . 5.500 2.698 2.138 3.791 . 0 0 "[ . 1 . 2]" 1
479 1 85 ASP HA 1 86 ILE MG 5.500 . 5.500 4.117 3.801 4.386 . 0 0 "[ . 1 . 2]" 1
480 1 85 ASP HA 1 86 ILE H 3.000 . 3.000 2.126 1.955 2.254 . 0 0 "[ . 1 . 2]" 1
481 1 85 ASP QB 1 86 ILE H 5.500 . 5.500 3.690 3.168 4.015 . 0 0 "[ . 1 . 2]" 1
482 1 86 ILE HA 1 86 ILE HB 3.000 . 3.000 2.522 2.462 2.562 . 0 0 "[ . 1 . 2]" 1
483 1 86 ILE H 1 86 ILE HG12 4.200 . 4.200 2.564 1.874 3.686 . 0 0 "[ . 1 . 2]" 1
484 1 30 ILE QG 1 87 ARG HA 5.500 . 5.500 3.083 2.401 3.644 . 0 0 "[ . 1 . 2]" 1
485 1 85 ASP QB 1 87 ARG QB 5.500 . 5.500 3.310 2.358 4.141 . 0 0 "[ . 1 . 2]" 1
486 1 85 ASP HA 1 87 ARG H 5.500 . 5.500 3.245 2.995 3.609 . 0 0 "[ . 1 . 2]" 1
487 1 85 ASP QB 1 87 ARG H 5.500 . 5.500 3.176 2.554 3.851 . 0 0 "[ . 1 . 2]" 1
488 1 86 ILE HB 1 87 ARG HA 5.500 . 5.500 4.913 4.797 5.039 . 0 0 "[ . 1 . 2]" 1
489 1 86 ILE H 1 87 ARG QB 5.500 . 5.500 4.110 3.709 4.818 . 0 0 "[ . 1 . 2]" 1
490 1 86 ILE HA 1 87 ARG H 5.500 . 5.500 2.861 2.752 3.008 . 0 0 "[ . 1 . 2]" 1
491 1 86 ILE HB 1 87 ARG H 5.500 . 5.500 4.330 4.273 4.399 . 0 0 "[ . 1 . 2]" 1
492 1 86 ILE QG 1 87 ARG H 5.500 . 5.500 3.451 3.103 3.831 . 0 0 "[ . 1 . 2]" 1
493 1 86 ILE H 1 87 ARG H 5.500 . 5.500 2.605 2.415 2.769 . 0 0 "[ . 1 . 2]" 1
494 1 87 ARG HA 1 88 GLY QA 5.500 . 5.500 4.406 4.372 4.444 . 0 0 "[ . 1 . 2]" 1
495 1 87 ARG H 1 88 GLY QA 5.500 . 5.500 4.437 4.208 4.581 . 0 0 "[ . 1 . 2]" 1
496 1 86 ILE QG 1 89 PHE HB2 5.500 . 5.500 3.671 3.230 3.966 . 0 0 "[ . 1 . 2]" 1
497 1 86 ILE HA 1 89 PHE QD 4.200 . 4.200 2.030 1.908 2.183 . 0 0 "[ . 1 . 2]" 1
498 1 86 ILE HB 1 89 PHE QD 5.500 . 5.500 2.627 2.113 3.688 . 0 0 "[ . 1 . 2]" 1
499 1 86 ILE MG 1 89 PHE QD 5.500 . 5.500 2.700 2.214 3.302 . 0 0 "[ . 1 . 2]" 1
500 1 86 ILE HA 1 89 PHE QE 5.500 . 5.500 3.115 2.694 3.698 . 0 0 "[ . 1 . 2]" 1
501 1 86 ILE MG 1 89 PHE QE 5.500 . 5.500 3.075 2.524 4.048 . 0 0 "[ . 1 . 2]" 1
502 1 86 ILE HB 1 89 PHE H 5.500 . 5.500 4.004 3.736 4.284 . 0 0 "[ . 1 . 2]" 1
503 1 87 ARG HA 1 89 PHE H 5.500 . 5.500 3.688 3.494 3.856 . 0 0 "[ . 1 . 2]" 1
504 1 88 GLY QA 1 89 PHE HA 5.500 . 5.500 4.005 3.968 4.059 . 0 0 "[ . 1 . 2]" 1
505 1 88 GLY QA 1 89 PHE H 5.500 . 5.500 2.909 2.821 2.947 . 0 0 "[ . 1 . 2]" 1
506 1 88 GLY H 1 89 PHE H 5.500 . 5.500 2.586 2.500 2.695 . 0 0 "[ . 1 . 2]" 1
507 1 30 ILE MD 1 90 ILE MD 5.500 . 5.500 2.689 2.278 3.050 . 0 0 "[ . 1 . 2]" 1
508 1 30 ILE QG 1 90 ILE MD 5.500 . 5.500 2.461 2.054 2.733 . 0 0 "[ . 1 . 2]" 1
509 1 87 ARG HA 1 90 ILE MD 5.500 . 5.500 2.371 2.083 2.995 . 0 0 "[ . 1 . 2]" 1
510 1 87 ARG HA 1 90 ILE H 5.500 . 5.500 3.546 3.223 4.037 . 0 0 "[ . 1 . 2]" 1
511 1 88 GLY QA 1 90 ILE H 5.500 . 5.500 3.516 3.350 3.713 . 0 0 "[ . 1 . 2]" 1
512 1 89 PHE H 1 90 ILE HG12 5.500 . 5.500 5.168 4.870 5.513 0.013 4 0 "[ . 1 . 2]" 1
513 1 89 PHE HB3 1 90 ILE H 5.500 . 5.500 4.198 4.093 4.319 . 0 0 "[ . 1 . 2]" 1
514 1 89 PHE H 1 90 ILE H 3.000 . 3.000 2.222 2.072 2.358 . 0 0 "[ . 1 . 2]" 1
515 1 90 ILE H 1 90 ILE HB 3.000 . 3.000 2.425 2.314 2.513 . 0 0 "[ . 1 . 2]" 1
516 1 90 ILE H 1 90 ILE MD 5.500 . 5.500 3.740 3.603 3.850 . 0 0 "[ . 1 . 2]" 1
517 1 90 ILE H 1 90 ILE QG 4.200 . 4.200 2.390 2.200 2.599 . 0 0 "[ . 1 . 2]" 1
518 1 90 ILE H 1 90 ILE QG 4.200 . 4.200 2.363 2.186 2.552 . 0 0 "[ . 1 . 2]" 1
519 1 90 ILE HA 1 91 SER HA 5.500 . 5.500 4.307 4.223 4.355 . 0 0 "[ . 1 . 2]" 1
520 1 90 ILE QG 1 91 SER HA 5.500 . 5.500 3.556 3.234 3.818 . 0 0 "[ . 1 . 2]" 1
521 1 90 ILE HA 1 91 SER H 3.000 . 3.000 2.084 2.025 2.163 . 0 0 "[ . 1 . 2]" 1
522 1 90 ILE QG 1 91 SER H 4.200 . 4.200 2.655 2.500 2.950 . 0 0 "[ . 1 . 2]" 1
523 1 90 ILE H 1 91 SER H 5.500 . 5.500 4.454 4.309 4.569 . 0 0 "[ . 1 . 2]" 1
524 1 90 ILE QG 1 92 GLU HA 5.500 . 5.500 3.553 3.353 3.711 . 0 0 "[ . 1 . 2]" 1
525 1 90 ILE QG 1 92 GLU H 5.500 . 5.500 3.309 2.827 3.590 . 0 0 "[ . 1 . 2]" 1
526 1 91 SER HA 1 92 GLU QG 5.500 . 5.500 3.949 3.549 4.905 . 0 0 "[ . 1 . 2]" 1
527 1 91 SER QB 1 92 GLU H 5.500 . 5.500 3.764 3.376 3.952 . 0 0 "[ . 1 . 2]" 1
528 1 92 GLU H 1 93 ASP QB 5.500 . 5.500 4.230 3.832 4.827 . 0 0 "[ . 1 . 2]" 1
529 1 92 GLU HA 1 93 ASP H 4.200 . 4.200 3.264 3.067 3.449 . 0 0 "[ . 1 . 2]" 1
530 1 92 GLU H 1 93 ASP H 3.000 . 3.000 2.348 2.160 2.602 . 0 0 "[ . 1 . 2]" 1
531 1 93 ASP H 1 93 ASP HA 3.000 . 3.000 2.917 2.865 2.946 . 0 0 "[ . 1 . 2]" 1
532 1 91 SER QB 1 94 LEU HA 5.500 . 5.500 4.298 3.221 4.952 . 0 0 "[ . 1 . 2]" 1
533 1 92 GLU HA 1 94 LEU QD 5.500 . 5.500 2.789 2.314 3.492 . 0 0 "[ . 1 . 2]" 1
534 1 92 GLU HA 1 94 LEU HG 5.500 . 5.500 4.252 3.399 5.483 . 0 0 "[ . 1 . 2]" 1
535 1 92 GLU HA 1 94 LEU H 5.500 . 5.500 5.361 4.819 5.532 0.032 15 0 "[ . 1 . 2]" 1
536 1 93 ASP QB 1 94 LEU H 5.500 . 5.500 3.680 3.298 3.903 . 0 0 "[ . 1 . 2]" 1
537 1 93 ASP H 1 94 LEU H 5.500 . 5.500 4.312 4.113 4.437 . 0 0 "[ . 1 . 2]" 1
538 1 94 LEU H 1 94 LEU HB3 4.200 . 4.200 3.652 3.207 3.807 . 0 0 "[ . 1 . 2]" 1
539 1 94 LEU H 1 94 LEU HB2 4.200 . 4.200 2.766 2.529 3.961 . 0 0 "[ . 1 . 2]" 1
540 1 94 LEU HB3 1 95 GLU HA 5.500 . 5.500 4.202 3.651 5.493 . 0 0 "[ . 1 . 2]" 1
541 1 94 LEU HA 1 95 GLU H 4.200 . 4.200 3.526 3.415 3.575 . 0 0 "[ . 1 . 2]" 1
542 1 94 LEU HB3 1 95 GLU H 4.200 . 4.200 3.503 3.194 4.291 0.091 9 0 "[ . 1 . 2]" 1
543 1 94 LEU HB2 1 95 GLU H 5.500 . 5.500 2.323 1.816 4.084 . 0 0 "[ . 1 . 2]" 1
544 1 94 LEU H 1 95 GLU H 3.000 . 3.000 2.231 1.843 2.556 . 0 0 "[ . 1 . 2]" 1
545 1 95 GLU H 1 95 GLU HA 3.000 . 3.000 2.792 2.683 2.841 . 0 0 "[ . 1 . 2]" 1
546 1 95 GLU QG 1 96 GLY QA 5.500 . 5.500 3.523 2.988 4.038 . 0 0 "[ . 1 . 2]" 1
547 1 95 GLU HA 1 96 GLY H 3.000 . 3.000 2.079 2.001 2.178 . 0 0 "[ . 1 . 2]" 1
548 1 95 GLU QG 1 96 GLY H 5.500 . 5.500 3.367 2.712 4.276 . 0 0 "[ . 1 . 2]" 1
549 1 95 GLU H 1 96 GLY H 5.500 . 5.500 4.476 4.276 4.591 . 0 0 "[ . 1 . 2]" 1
550 1 96 GLY QA 1 97 VAL H 5.500 . 5.500 2.874 2.741 2.939 . 0 0 "[ . 1 . 2]" 1
551 1 96 GLY H 1 97 VAL H 5.500 . 5.500 2.438 2.190 2.865 . 0 0 "[ . 1 . 2]" 1
552 1 97 VAL H 1 97 VAL HB 3.000 . 3.000 2.636 2.548 3.008 0.008 11 0 "[ . 1 . 2]" 1
553 1 97 VAL HA 1 98 ASP H 3.000 . 3.000 2.266 2.110 2.467 . 0 0 "[ . 1 . 2]" 1
554 1 97 VAL HB 1 98 ASP H 4.200 . 4.200 3.865 3.611 4.045 . 0 0 "[ . 1 . 2]" 1
555 1 97 VAL QG 1 98 ASP H 5.500 . 5.500 2.273 1.845 2.538 . 0 0 "[ . 1 . 2]" 1
556 1 97 VAL H 1 98 ASP H 5.500 . 5.500 4.513 4.362 4.624 . 0 0 "[ . 1 . 2]" 1
557 1 98 ASP H 1 98 ASP QB 3.000 . 3.000 2.441 2.172 2.645 . 0 0 "[ . 1 . 2]" 1
558 1 98 ASP HA 1 99 ALA HA 5.500 . 5.500 4.353 4.273 4.479 . 0 0 "[ . 1 . 2]" 1
559 1 98 ASP HA 1 99 ALA MB 5.500 . 5.500 3.888 3.726 4.010 . 0 0 "[ . 1 . 2]" 1
560 1 98 ASP HA 1 99 ALA H 3.000 . 3.000 2.167 2.072 2.347 . 0 0 "[ . 1 . 2]" 1
561 1 98 ASP QB 1 99 ALA H 5.500 . 5.500 3.178 2.623 3.845 . 0 0 "[ . 1 . 2]" 1
562 1 3 ASN QB 1 100 THR MG 5.500 . 5.500 3.280 2.680 3.704 . 0 0 "[ . 1 . 2]" 1
563 1 7 ALA MB 1 100 THR HB 5.500 . 5.500 4.120 3.602 4.447 . 0 0 "[ . 1 . 2]" 1
564 1 7 ALA MB 1 100 THR MG 5.500 . 5.500 3.513 3.137 3.712 . 0 0 "[ . 1 . 2]" 1
565 1 99 ALA HA 1 100 THR HB 5.500 . 5.500 4.464 4.229 4.601 . 0 0 "[ . 1 . 2]" 1
566 1 99 ALA MB 1 100 THR H 5.500 . 5.500 2.396 2.145 2.611 . 0 0 "[ . 1 . 2]" 1
567 1 100 THR H 1 100 THR HB 4.200 . 4.200 2.577 2.501 2.712 . 0 0 "[ . 1 . 2]" 1
568 1 100 THR HB 1 101 LEU HA 5.500 . 5.500 4.826 4.655 5.103 . 0 0 "[ . 1 . 2]" 1
569 1 100 THR HA 1 101 LEU QB 5.500 . 5.500 4.016 3.872 4.345 . 0 0 "[ . 1 . 2]" 1
570 1 100 THR HA 1 101 LEU H 3.000 . 3.000 2.237 2.158 2.378 . 0 0 "[ . 1 . 2]" 1
571 1 100 THR HB 1 101 LEU H 5.500 . 5.500 4.047 3.927 4.202 . 0 0 "[ . 1 . 2]" 1
572 1 100 THR MG 1 101 LEU H 5.500 . 5.500 2.588 2.343 2.835 . 0 0 "[ . 1 . 2]" 1
573 1 101 LEU HA 1 102 VAL H 4.200 . 4.200 2.133 2.087 2.174 . 0 0 "[ . 1 . 2]" 1
574 1 101 LEU QB 1 102 VAL H 5.500 . 5.500 3.796 3.207 3.904 . 0 0 "[ . 1 . 2]" 1
575 1 101 LEU H 1 102 VAL H 5.500 . 5.500 4.290 4.158 4.366 . 0 0 "[ . 1 . 2]" 1
576 1 11 LEU QD 1 104 HIS QB 5.500 . 5.500 2.544 1.973 3.438 . 0 0 "[ . 1 . 2]" 1
577 1 15 ILE QG 1 104 HIS QB 5.500 . 5.500 2.238 1.801 3.632 . 0 0 "[ . 1 . 2]" 1
578 1 15 ILE MG 1 104 HIS HD2 5.500 . 5.500 3.451 1.865 4.594 . 0 0 "[ . 1 . 2]" 1
579 1 17 THR H 1 104 HIS HD2 5.500 . 5.500 4.107 2.126 5.535 0.035 12 0 "[ . 1 . 2]" 1
580 1 17 THR MG 1 105 SER HA 5.500 . 5.500 2.421 1.938 4.484 . 0 0 "[ . 1 . 2]" 1
581 1 17 THR MG 1 105 SER QB 5.500 . 5.500 3.523 2.389 4.084 . 0 0 "[ . 1 . 2]" 1
582 1 24 GLU QB 1 105 SER QB 5.500 . 5.500 3.169 1.873 4.463 . 0 0 "[ . 1 . 2]" 1
583 1 24 GLU QB 1 106 ASN HA 5.500 . 5.500 4.222 2.725 4.955 . 0 0 "[ . 1 . 2]" 1
584 1 24 GLU QB 1 106 ASN QB 5.500 . 5.500 2.779 1.904 4.456 . 0 0 "[ . 1 . 2]" 1
585 1 106 ASN HA 1 107 ASN H 5.500 . 5.500 3.463 3.274 3.598 . 0 0 "[ . 1 . 2]" 1
586 1 106 ASN QB 1 107 ASN H 5.500 . 5.500 2.798 1.916 3.667 . 0 0 "[ . 1 . 2]" 1
587 1 104 HIS HA 1 109 THR MG 5.500 . 5.500 4.127 3.373 4.502 . 0 0 "[ . 1 . 2]" 1
588 1 108 PHE QB 1 109 THR H 5.500 . 5.500 3.647 2.892 3.941 . 0 0 "[ . 1 . 2]" 1
589 1 11 LEU QD 1 110 ASN HA 5.500 . 5.500 2.795 2.081 3.723 . 0 0 "[ . 1 . 2]" 1
590 1 11 LEU QD 1 110 ASN QB 5.500 . 5.500 2.812 2.039 3.670 . 0 0 "[ . 1 . 2]" 1
591 1 109 THR HB 1 110 ASN QB 5.500 . 5.500 3.989 3.263 4.582 . 0 0 "[ . 1 . 2]" 1
592 1 104 HIS HA 1 111 THR H 5.500 . 5.500 3.718 3.283 4.112 . 0 0 "[ . 1 . 2]" 1
593 1 4 THR HA 1 112 ILE HB 5.500 . 5.500 4.735 4.106 5.512 0.012 8 0 "[ . 1 . 2]" 1
594 1 4 THR MG 1 112 ILE HB 5.500 . 5.500 3.325 2.454 4.221 . 0 0 "[ . 1 . 2]" 1
595 1 4 THR HA 1 112 ILE MD 5.500 . 5.500 2.591 2.121 3.147 . 0 0 "[ . 1 . 2]" 1
596 1 4 THR HB 1 112 ILE MD 5.500 . 5.500 4.396 4.061 4.579 . 0 0 "[ . 1 . 2]" 1
597 1 4 THR MG 1 112 ILE MD 5.500 . 5.500 2.194 1.954 2.446 . 0 0 "[ . 1 . 2]" 1
598 1 4 THR HA 1 112 ILE QG 5.500 . 5.500 2.455 1.901 3.173 . 0 0 "[ . 1 . 2]" 1
599 1 7 ALA MB 1 112 ILE MD 5.500 . 5.500 2.189 2.016 2.478 . 0 0 "[ . 1 . 2]" 1
600 1 7 ALA H 1 112 ILE MD 5.500 . 5.500 4.322 4.004 4.474 . 0 0 "[ . 1 . 2]" 1
601 1 8 LEU HA 1 112 ILE MD 5.500 . 5.500 3.419 2.290 4.169 . 0 0 "[ . 1 . 2]" 1
602 1 100 THR MG 1 112 ILE HA 5.500 . 5.500 3.301 2.995 3.731 . 0 0 "[ . 1 . 2]" 1
603 1 100 THR HB 1 112 ILE QG 5.500 . 5.500 3.800 3.674 3.898 . 0 0 "[ . 1 . 2]" 1
604 1 100 THR MG 1 112 ILE QG 5.500 . 5.500 1.941 1.823 2.012 . 0 0 "[ . 1 . 2]" 1
605 1 102 VAL HA 1 112 ILE HA 3.000 . 3.000 2.464 2.283 2.655 . 0 0 "[ . 1 . 2]" 1
606 1 111 THR H 1 112 ILE H 5.500 . 5.500 4.112 3.760 4.368 . 0 0 "[ . 1 . 2]" 1
607 1 100 THR MG 1 113 LEU HA 5.500 . 5.500 3.815 3.270 4.201 . 0 0 "[ . 1 . 2]" 1
608 1 100 THR MG 1 113 LEU H 5.500 . 5.500 2.990 2.687 3.420 . 0 0 "[ . 1 . 2]" 1
609 1 101 LEU H 1 113 LEU HA 5.500 . 5.500 4.779 4.671 4.890 . 0 0 "[ . 1 . 2]" 1
610 1 101 LEU H 1 113 LEU HG 5.500 . 5.500 4.576 4.072 5.041 . 0 0 "[ . 1 . 2]" 1
611 1 101 LEU H 1 113 LEU H 4.200 . 4.200 3.327 3.113 3.730 . 0 0 "[ . 1 . 2]" 1
612 1 112 ILE HB 1 113 LEU HA 5.500 . 5.500 4.855 4.517 5.040 . 0 0 "[ . 1 . 2]" 1
613 1 112 ILE QG 1 113 LEU HA 5.500 . 5.500 3.838 3.601 3.971 . 0 0 "[ . 1 . 2]" 1
614 1 100 THR HA 1 114 GLU HA 3.000 . 3.000 2.013 1.812 2.431 . 0 0 "[ . 1 . 2]" 1
615 1 100 THR HB 1 114 GLU HA 5.500 . 5.500 4.385 4.171 4.589 . 0 0 "[ . 1 . 2]" 1
616 1 100 THR MG 1 114 GLU HA 5.500 . 5.500 2.298 1.940 2.688 . 0 0 "[ . 1 . 2]" 1
617 1 100 THR MG 1 114 GLU QG 5.500 . 5.500 2.597 1.998 3.907 . 0 0 "[ . 1 . 2]" 1
618 1 100 THR HA 1 114 GLU QG 5.500 . 5.500 3.836 3.147 4.920 . 0 0 "[ . 1 . 2]" 1
619 1 100 THR MG 1 114 GLU H 5.500 . 5.500 3.244 2.906 3.488 . 0 0 "[ . 1 . 2]" 1
620 1 101 LEU H 1 114 GLU HA 5.500 . 5.500 3.181 2.297 3.455 . 0 0 "[ . 1 . 2]" 1
621 1 101 LEU H 1 114 GLU H 5.500 . 5.500 4.655 4.309 4.830 . 0 0 "[ . 1 . 2]" 1
622 1 113 LEU HG 1 114 GLU HA 5.500 . 5.500 4.497 4.221 4.799 . 0 0 "[ . 1 . 2]" 1
623 1 113 LEU HA 1 114 GLU QB 5.500 . 5.500 4.451 4.299 4.729 . 0 0 "[ . 1 . 2]" 1
624 1 113 LEU HA 1 114 GLU QG 5.500 . 5.500 4.019 3.688 4.800 . 0 0 "[ . 1 . 2]" 1
625 1 113 LEU HA 1 114 GLU H 3.000 . 3.000 2.156 2.092 2.237 . 0 0 "[ . 1 . 2]" 1
626 1 113 LEU QD 1 114 GLU H 5.500 . 5.500 2.677 2.156 3.065 . 0 0 "[ . 1 . 2]" 1
627 1 114 GLU H 1 114 GLU QG 4.200 . 4.200 2.420 1.872 3.185 . 0 0 "[ . 1 . 2]" 1
628 1 99 ALA MB 1 115 VAL QG 5.500 . 5.500 2.679 2.050 3.257 . 0 0 "[ . 1 . 2]" 1
629 1 100 THR HA 1 115 VAL QG 5.500 . 5.500 2.843 2.191 3.384 . 0 0 "[ . 1 . 2]" 1
630 1 100 THR HA 1 115 VAL H 5.500 . 5.500 2.510 2.178 2.754 . 0 0 "[ . 1 . 2]" 1
631 1 101 LEU QB 1 115 VAL QG 5.500 . 5.500 2.266 1.983 2.940 . 0 0 "[ . 1 . 2]" 1
632 1 101 LEU H 1 115 VAL QG 5.500 . 5.500 2.668 2.299 3.038 . 0 0 "[ . 1 . 2]" 1
633 1 113 LEU HG 1 115 VAL HA 5.500 . 5.500 3.978 3.355 4.755 . 0 0 "[ . 1 . 2]" 1
634 1 114 GLU HA 1 115 VAL H 4.200 . 4.200 2.176 2.087 2.265 . 0 0 "[ . 1 . 2]" 1
635 1 98 ASP HA 1 116 GLY QA 5.500 . 5.500 3.618 3.125 4.206 . 0 0 "[ . 1 . 2]" 1
636 1 98 ASP QB 1 116 GLY H 5.500 . 5.500 4.045 3.344 4.980 . 0 0 "[ . 1 . 2]" 1
637 1 99 ALA H 1 116 GLY QA 5.500 . 5.500 3.699 2.986 3.934 . 0 0 "[ . 1 . 2]" 1
638 1 99 ALA H 1 116 GLY H 5.500 . 5.500 3.026 2.624 3.394 . 0 0 "[ . 1 . 2]" 1
639 1 114 GLU HA 1 116 GLY H 4.200 . 4.200 3.972 3.648 4.215 0.015 5 0 "[ . 1 . 2]" 1
640 1 115 VAL HA 1 116 GLY H 5.500 . 5.500 3.477 3.313 3.579 . 0 0 "[ . 1 . 2]" 1
641 1 115 VAL QG 1 116 GLY H 5.500 . 5.500 2.602 2.082 3.118 . 0 0 "[ . 1 . 2]" 1
642 1 115 VAL H 1 116 GLY H 5.500 . 5.500 2.212 2.001 2.597 . 0 0 "[ . 1 . 2]" 1
643 1 98 ASP HA 1 117 PRO HA 3.000 . 3.000 2.201 1.923 2.755 . 0 0 "[ . 1 . 2]" 1
644 1 98 ASP HA 1 117 PRO QB 5.500 . 5.500 3.893 3.528 4.209 . 0 0 "[ . 1 . 2]" 1
645 1 99 ALA H 1 117 PRO HA 5.500 . 5.500 3.647 3.308 3.991 . 0 0 "[ . 1 . 2]" 1
646 1 116 GLY QA 1 117 PRO QG 5.500 . 5.500 3.650 3.551 3.745 . 0 0 "[ . 1 . 2]" 1
647 1 96 GLY H 1 118 VAL H 5.500 . 5.500 3.687 3.343 3.910 . 0 0 "[ . 1 . 2]" 1
648 1 99 ALA H 1 118 VAL QG 5.500 . 5.500 2.912 2.551 3.788 . 0 0 "[ . 1 . 2]" 1
649 1 99 ALA MB 1 118 VAL QG 5.500 . 5.500 1.947 1.840 2.097 . 0 0 "[ . 1 . 2]" 1
650 1 117 PRO HA 1 118 VAL H 5.500 . 5.500 2.116 2.070 2.203 . 0 0 "[ . 1 . 2]" 1
651 1 117 PRO QG 1 118 VAL H 5.500 . 5.500 4.740 4.480 4.892 . 0 0 "[ . 1 . 2]" 1
652 1 95 GLU HA 1 119 THR HA 4.200 . 4.200 2.644 1.999 3.372 . 0 0 "[ . 1 . 2]" 1
653 1 96 GLY H 1 119 THR HA 5.500 . 5.500 3.559 2.954 4.255 . 0 0 "[ . 1 . 2]" 1
654 1 118 VAL HA 1 119 THR HA 5.500 . 5.500 4.414 4.331 4.492 . 0 0 "[ . 1 . 2]" 1
655 1 118 VAL HB 1 119 THR HA 5.500 . 5.500 4.412 4.153 4.678 . 0 0 "[ . 1 . 2]" 1
656 1 118 VAL HA 1 119 THR H 3.000 . 3.000 2.296 2.100 2.449 . 0 0 "[ . 1 . 2]" 1
657 1 118 VAL HB 1 119 THR H 3.000 . 3.000 2.597 2.357 3.011 0.011 8 0 "[ . 1 . 2]" 1
658 1 118 VAL QG 1 119 THR H 5.500 . 5.500 3.255 3.147 3.427 . 0 0 "[ . 1 . 2]" 1
659 1 119 THR HA 1 119 THR HB 3.000 . 3.000 2.630 2.467 3.027 0.027 3 0 "[ . 1 . 2]" 1
660 1 119 THR H 1 119 THR HB 4.200 . 4.200 3.479 2.557 3.797 . 0 0 "[ . 1 . 2]" 1
661 1 119 THR HA 1 120 MET H 3.000 . 3.000 2.478 2.359 2.718 . 0 0 "[ . 1 . 2]" 1
662 1 119 THR HB 1 120 MET H 4.200 . 4.200 2.899 2.109 3.968 . 0 0 "[ . 1 . 2]" 1
663 1 119 THR MG 1 120 MET H 5.500 . 5.500 3.303 2.256 3.638 . 0 0 "[ . 1 . 2]" 1
664 1 120 MET HA 1 121 ALA HA 5.500 . 5.500 4.365 4.325 4.415 . 0 0 "[ . 1 . 2]" 1
665 1 120 MET QB 1 122 GLY H 5.500 . 5.500 4.356 2.861 4.887 . 0 0 "[ . 1 . 2]" 1
666 1 120 MET QG 1 122 GLY H 4.200 . 4.200 2.753 2.066 3.718 . 0 0 "[ . 1 . 2]" 1
667 1 121 ALA MB 1 122 GLY QA 5.500 . 5.500 3.798 3.666 3.961 . 0 0 "[ . 1 . 2]" 1
668 1 121 ALA HA 1 122 GLY H 5.500 . 5.500 3.493 3.422 3.551 . 0 0 "[ . 1 . 2]" 1
669 1 121 ALA MB 1 122 GLY H 5.500 . 5.500 2.529 2.251 2.826 . 0 0 "[ . 1 . 2]" 1
670 1 123 LEU QB 1 124 ILE H 5.500 . 5.500 3.298 2.501 3.929 . 0 0 "[ . 1 . 2]" 1
671 1 123 LEU QD 1 124 ILE H 5.500 . 5.500 3.373 2.243 4.255 . 0 0 "[ . 1 . 2]" 1
672 1 69 ASN QB 1 129 THR MG 5.500 . 5.500 2.808 2.214 3.667 . 0 0 "[ . 1 . 2]" 1
673 1 128 SER QB 1 129 THR HA 5.500 . 5.500 4.340 4.150 4.605 . 0 0 "[ . 1 . 2]" 1
674 1 129 THR H 1 129 THR HB 3.000 . 3.000 2.597 2.428 2.756 . 0 0 "[ . 1 . 2]" 1
675 1 124 ILE H 1 130 PRO HA 5.500 . 5.500 4.355 3.003 4.930 . 0 0 "[ . 1 . 2]" 1
676 1 129 THR HA 1 130 PRO QD 3.000 . 3.000 1.981 1.860 2.049 . 0 0 "[ . 1 . 2]" 1
677 1 129 THR HB 1 130 PRO QD 5.500 . 5.500 4.256 4.102 4.380 . 0 0 "[ . 1 . 2]" 1
678 1 129 THR MG 1 130 PRO QD 5.500 . 5.500 2.758 2.418 3.262 . 0 0 "[ . 1 . 2]" 1
679 1 64 ASP QB 1 132 ASN H 5.500 . 5.500 4.650 3.837 5.067 . 0 0 "[ . 1 . 2]" 1
680 1 68 ILE MG 1 132 ASN QB 5.500 . 5.500 2.073 1.807 3.358 . 0 0 "[ . 1 . 2]" 1
681 1 68 ILE QG 1 132 ASN H 5.500 . 5.500 2.437 2.054 2.689 . 0 0 "[ . 1 . 2]" 1
682 1 69 ASN HA 1 132 ASN H 5.500 . 5.500 5.013 4.163 5.497 . 0 0 "[ . 1 . 2]" 1
683 1 69 ASN H 1 132 ASN H 5.500 . 5.500 4.193 3.503 4.835 . 0 0 "[ . 1 . 2]" 1
684 1 123 LEU HA 1 132 ASN H 5.500 . 5.500 4.811 4.527 5.482 . 0 0 "[ . 1 . 2]" 1
685 1 121 ALA MB 1 134 MET QB 4.200 . 4.200 2.418 1.938 3.008 . 0 0 "[ . 1 . 2]" 1
686 1 122 GLY H 1 134 MET QB 5.500 . 5.500 3.551 2.914 4.579 . 0 0 "[ . 1 . 2]" 1
687 1 122 GLY H 1 134 MET H 4.200 . 4.200 3.243 2.852 3.820 . 0 0 "[ . 1 . 2]" 1
688 1 124 ILE H 1 134 MET QB 5.500 . 5.500 3.957 2.934 4.571 . 0 0 "[ . 1 . 2]" 1
689 1 121 ALA HA 1 135 ILE HA 5.500 . 5.500 4.934 4.508 5.472 . 0 0 "[ . 1 . 2]" 1
690 1 122 GLY H 1 135 ILE HA 5.500 . 5.500 4.003 3.684 4.275 . 0 0 "[ . 1 . 2]" 1
691 1 119 THR H 1 136 ARG H 5.500 . 5.500 3.291 3.036 3.635 . 0 0 "[ . 1 . 2]" 1
692 1 120 MET HA 1 136 ARG H 4.200 . 4.200 3.119 2.644 3.648 . 0 0 "[ . 1 . 2]" 1
693 1 121 ALA HA 1 136 ARG QB 5.500 . 5.500 3.419 2.352 4.659 . 0 0 "[ . 1 . 2]" 1
694 1 121 ALA HA 1 136 ARG QD 5.500 . 5.500 3.977 2.811 4.892 . 0 0 "[ . 1 . 2]" 1
695 1 121 ALA MB 1 136 ARG QD 5.500 . 5.500 3.120 2.310 4.012 . 0 0 "[ . 1 . 2]" 1
696 1 135 ILE HB 1 136 ARG H 5.500 . 5.500 3.966 3.813 4.123 . 0 0 "[ . 1 . 2]" 1
697 1 135 ILE MD 1 136 ARG H 5.500 . 5.500 4.058 3.903 4.292 . 0 0 "[ . 1 . 2]" 1
698 1 101 LEU QD 1 137 TYR QE 5.500 . 5.500 3.138 2.425 3.735 . 0 0 "[ . 1 . 2]" 1
699 1 115 VAL QG 1 137 TYR QB 5.500 . 5.500 2.734 2.013 3.187 . 0 0 "[ . 1 . 2]" 1
700 1 115 VAL QG 1 137 TYR QD 5.500 . 5.500 2.802 2.319 3.142 . 0 0 "[ . 1 . 2]" 1
701 1 118 VAL HA 1 137 TYR HA 5.500 . 5.500 3.279 2.439 3.596 . 0 0 "[ . 1 . 2]" 1
702 1 118 VAL HA 1 137 TYR QB 5.500 . 5.500 2.428 1.942 3.256 . 0 0 "[ . 1 . 2]" 1
703 1 118 VAL QG 1 137 TYR QB 5.500 . 5.500 2.022 1.885 2.303 . 0 0 "[ . 1 . 2]" 1
704 1 118 VAL HA 1 137 TYR QD 5.500 . 5.500 4.066 3.551 4.644 . 0 0 "[ . 1 . 2]" 1
705 1 136 ARG QG 1 137 TYR HA 5.500 . 5.500 3.322 2.887 3.887 . 0 0 "[ . 1 . 2]" 1
706 1 136 ARG HA 1 137 TYR H 3.000 . 3.000 2.188 2.085 2.357 . 0 0 "[ . 1 . 2]" 1
707 1 136 ARG QB 1 137 TYR H 5.500 . 5.500 3.503 2.346 3.716 . 0 0 "[ . 1 . 2]" 1
708 1 136 ARG QD 1 137 TYR H 5.500 . 5.500 4.485 3.320 4.775 . 0 0 "[ . 1 . 2]" 1
709 1 136 ARG H 1 137 TYR H 5.500 . 5.500 4.326 4.207 4.403 . 0 0 "[ . 1 . 2]" 1
710 1 137 TYR H 1 137 TYR QD 5.500 . 5.500 3.178 2.849 3.373 . 0 0 "[ . 1 . 2]" 1
711 1 137 TYR HA 1 138 ASP QB 5.500 . 5.500 4.150 3.925 4.404 . 0 0 "[ . 1 . 2]" 1
712 1 137 TYR HA 1 138 ASP H 4.200 . 4.200 2.220 2.067 2.365 . 0 0 "[ . 1 . 2]" 1
713 1 137 TYR QB 1 138 ASP H 5.500 . 5.500 2.836 2.313 3.360 . 0 0 "[ . 1 . 2]" 1
714 1 137 TYR H 1 138 ASP H 5.500 . 5.500 4.265 4.029 4.392 . 0 0 "[ . 1 . 2]" 1
715 1 113 LEU QD 1 139 TYR QE 5.500 . 5.500 2.346 1.883 3.343 . 0 0 "[ . 1 . 2]" 1
716 1 115 VAL QG 1 139 TYR QB 5.500 . 5.500 2.839 2.075 3.361 . 0 0 "[ . 1 . 2]" 1
717 1 115 VAL HA 1 139 TYR QB 5.500 . 5.500 3.775 2.996 4.413 . 0 0 "[ . 1 . 2]" 1
718 1 137 TYR QB 1 139 TYR QB 5.500 . 5.500 3.578 3.211 3.985 . 0 0 "[ . 1 . 2]" 1
719 1 137 TYR QD 1 139 TYR QB 5.500 . 5.500 2.165 1.865 2.776 . 0 0 "[ . 1 . 2]" 1
720 1 138 ASP HA 1 139 TYR H 4.200 . 4.200 2.083 1.967 2.169 . 0 0 "[ . 1 . 2]" 1
721 1 139 TYR HA 1 139 TYR QD 4.200 . 4.200 2.806 2.605 3.069 . 0 0 "[ . 1 . 2]" 1
722 1 139 TYR HA 1 139 TYR QE 5.500 . 5.500 4.669 4.534 4.793 . 0 0 "[ . 1 . 2]" 1
723 1 139 TYR HA 1 140 ALA MB 5.500 . 5.500 4.017 3.916 4.142 . 0 0 "[ . 1 . 2]" 1
724 1 139 TYR HA 1 140 ALA H 4.200 . 4.200 2.198 2.076 2.308 . 0 0 "[ . 1 . 2]" 1
725 1 139 TYR QD 1 141 THR HA 5.500 . 5.500 3.332 2.682 4.276 . 0 0 "[ . 1 . 2]" 1
726 1 142 LYS HA 1 143 THR H 3.000 . 3.000 2.271 2.043 2.526 . 0 0 "[ . 1 . 2]" 1
727 1 25 PHE QE 1 146 CYS QB 5.500 . 5.500 2.659 2.122 4.151 . 0 0 "[ . 1 . 2]" 1
728 1 25 PHE QD 1 146 CYS QB 5.500 . 5.500 2.425 1.961 3.653 . 0 0 "[ . 1 . 2]" 1
729 1 146 CYS QB 1 147 GLY H 5.500 . 5.500 3.307 2.766 3.843 . 0 0 "[ . 1 . 2]" 1
730 1 101 LEU QD 1 148 GLY QA 5.500 . 5.500 2.479 2.073 3.098 . 0 0 "[ . 1 . 2]" 1
731 1 147 GLY QA 1 148 GLY QA 5.500 . 5.500 3.824 3.789 3.856 . 0 0 "[ . 1 . 2]" 1
732 1 28 LEU QD 1 149 VAL HA 5.500 . 5.500 3.348 2.907 3.768 . 0 0 "[ . 1 . 2]" 1
733 1 28 LEU QD 1 149 VAL QG 5.500 . 5.500 1.841 1.680 2.045 0.120 17 0 "[ . 1 . 2]" 1
734 1 102 VAL H 1 149 VAL QG 5.500 . 5.500 3.517 2.648 4.082 . 0 0 "[ . 1 . 2]" 1
735 1 102 VAL H 1 149 VAL H 5.500 . 5.500 3.387 3.245 3.570 . 0 0 "[ . 1 . 2]" 1
736 1 148 GLY H 1 149 VAL H 5.500 . 5.500 4.541 4.421 4.608 . 0 0 "[ . 1 . 2]" 1
737 1 99 ALA MB 1 150 LEU QD 5.500 . 5.500 2.105 1.984 2.221 . 0 0 "[ . 1 . 2]" 1
738 1 99 ALA HA 1 150 LEU HG 5.500 . 5.500 4.846 4.468 5.308 . 0 0 "[ . 1 . 2]" 1
739 1 99 ALA MB 1 150 LEU HG 5.500 . 5.500 2.392 2.157 2.711 . 0 0 "[ . 1 . 2]" 1
740 1 100 THR H 1 150 LEU HG 5.500 . 5.500 4.441 4.195 4.914 . 0 0 "[ . 1 . 2]" 1
741 1 101 LEU QB 1 150 LEU HA 5.500 . 5.500 3.816 3.626 4.379 . 0 0 "[ . 1 . 2]" 1
742 1 101 LEU HA 1 150 LEU QB 5.500 . 5.500 3.987 3.739 4.226 . 0 0 "[ . 1 . 2]" 1
743 1 101 LEU QD 1 150 LEU QB 5.500 . 5.500 2.576 2.239 2.793 . 0 0 "[ . 1 . 2]" 1
744 1 101 LEU HA 1 150 LEU QD 5.500 . 5.500 2.874 2.553 3.254 . 0 0 "[ . 1 . 2]" 1
745 1 115 VAL QG 1 150 LEU QD 5.500 . 5.500 2.218 1.951 2.483 . 0 0 "[ . 1 . 2]" 1
746 1 135 ILE MG 1 150 LEU QD 5.500 . 5.500 2.489 2.196 2.667 . 0 0 "[ . 1 . 2]" 1
747 1 149 VAL HA 1 150 LEU QB 5.500 . 5.500 3.952 3.857 4.067 . 0 0 "[ . 1 . 2]" 1
748 1 149 VAL HA 1 150 LEU H 4.200 . 4.200 2.040 1.977 2.123 . 0 0 "[ . 1 . 2]" 1
749 1 149 VAL QG 1 150 LEU H 5.500 . 5.500 2.853 2.628 3.126 . 0 0 "[ . 1 . 2]" 1
750 1 150 LEU HA 1 150 LEU HG 4.200 . 4.200 3.053 2.945 3.110 . 0 0 "[ . 1 . 2]" 1
751 1 6 PHE QE 1 151 CYS QB 5.500 . 5.500 2.467 2.159 2.782 . 0 0 "[ . 1 . 2]" 1
752 1 99 ALA HA 1 151 CYS HA 5.500 . 5.500 4.999 4.637 5.376 . 0 0 "[ . 1 . 2]" 1
753 1 99 ALA MB 1 151 CYS HA 5.500 . 5.500 3.965 3.613 4.432 . 0 0 "[ . 1 . 2]" 1
754 1 100 THR H 1 151 CYS H 5.500 . 5.500 2.973 2.803 3.143 . 0 0 "[ . 1 . 2]" 1
755 1 149 VAL QG 1 151 CYS QB 5.500 . 5.500 2.176 1.971 2.678 . 0 0 "[ . 1 . 2]" 1
756 1 150 LEU H 1 151 CYS HA 5.500 . 5.500 5.042 4.857 5.159 . 0 0 "[ . 1 . 2]" 1
757 1 150 LEU HA 1 151 CYS H 3.000 . 3.000 2.169 2.119 2.214 . 0 0 "[ . 1 . 2]" 1
758 1 150 LEU QB 1 151 CYS H 5.500 . 5.500 3.922 3.884 3.956 . 0 0 "[ . 1 . 2]" 1
759 1 150 LEU QD 1 151 CYS H 5.500 . 5.500 3.122 2.923 3.318 . 0 0 "[ . 1 . 2]" 1
760 1 150 LEU HG 1 151 CYS H 5.500 . 5.500 3.652 3.512 3.848 . 0 0 "[ . 1 . 2]" 1
761 1 151 CYS H 1 151 CYS HA 3.000 . 3.000 2.903 2.883 2.919 . 0 0 "[ . 1 . 2]" 1
762 1 3 ASN HA 1 152 ALA HA 5.500 . 5.500 3.896 3.033 5.015 . 0 0 "[ . 1 . 2]" 1
763 1 3 ASN QB 1 152 ALA HA 4.200 . 4.200 2.822 2.215 3.637 . 0 0 "[ . 1 . 2]" 1
764 1 6 PHE QE 1 152 ALA H 5.500 . 5.500 3.944 3.518 4.248 . 0 0 "[ . 1 . 2]" 1
765 1 99 ALA HA 1 152 ALA HA 5.500 . 5.500 3.648 2.691 4.342 . 0 0 "[ . 1 . 2]" 1
766 1 99 ALA HA 1 152 ALA MB 4.200 . 4.200 2.329 2.055 2.556 . 0 0 "[ . 1 . 2]" 1
767 1 100 THR HB 1 152 ALA HA 5.500 . 5.500 3.506 3.067 3.867 . 0 0 "[ . 1 . 2]" 1
768 1 100 THR H 1 152 ALA MB 5.500 . 5.500 3.466 2.993 3.776 . 0 0 "[ . 1 . 2]" 1
769 1 151 CYS HA 1 152 ALA MB 5.500 . 5.500 3.859 3.752 3.931 . 0 0 "[ . 1 . 2]" 1
770 1 151 CYS HA 1 152 ALA H 3.000 . 3.000 2.420 2.199 2.692 . 0 0 "[ . 1 . 2]" 1
771 1 151 CYS QB 1 152 ALA H 4.200 . 4.200 2.175 1.934 2.527 . 0 0 "[ . 1 . 2]" 1
772 1 151 CYS H 1 152 ALA H 5.500 . 5.500 4.306 4.270 4.336 . 0 0 "[ . 1 . 2]" 1
773 1 3 ASN HA 1 153 THR HA 5.500 . 5.500 2.859 2.106 3.401 . 0 0 "[ . 1 . 2]" 1
774 1 3 ASN QB 1 153 THR HA 5.500 . 5.500 4.176 3.311 4.849 . 0 0 "[ . 1 . 2]" 1
775 1 3 ASN HA 1 153 THR HB 4.200 . 4.200 3.145 2.134 4.317 0.117 8 0 "[ . 1 . 2]" 1
776 1 3 ASN QB 1 153 THR HB 5.500 . 5.500 3.907 2.638 4.827 . 0 0 "[ . 1 . 2]" 1
777 1 3 ASN HA 1 153 THR MG 5.500 . 5.500 3.524 1.941 4.306 . 0 0 "[ . 1 . 2]" 1
778 1 3 ASN QB 1 153 THR H 4.200 . 4.200 3.127 2.509 3.759 . 0 0 "[ . 1 . 2]" 1
779 1 6 PHE HA 1 153 THR HA 5.500 . 5.500 5.067 4.549 5.554 0.054 10 0 "[ . 1 . 2]" 1
780 1 6 PHE HB2 1 153 THR HA 5.500 . 5.500 2.735 2.148 3.258 . 0 0 "[ . 1 . 2]" 1
781 1 6 PHE QD 1 153 THR HA 4.200 . 4.200 3.444 2.936 4.072 . 0 0 "[ . 1 . 2]" 1
782 1 7 ALA H 1 153 THR HA 5.500 . 5.500 5.147 4.738 5.503 0.003 10 0 "[ . 1 . 2]" 1
783 1 152 ALA HA 1 153 THR H 3.000 . 3.000 2.674 2.574 2.768 . 0 0 "[ . 1 . 2]" 1
784 1 152 ALA MB 1 153 THR H 5.500 . 5.500 2.088 1.883 2.269 . 0 0 "[ . 1 . 2]" 1
785 1 152 ALA H 1 153 THR H 5.500 . 5.500 4.246 4.195 4.314 . 0 0 "[ . 1 . 2]" 1
786 1 153 THR HA 1 153 THR HB 3.000 . 3.000 2.574 2.359 3.021 0.021 1 0 "[ . 1 . 2]" 1
787 1 153 THR H 1 153 THR HB 4.200 . 4.200 2.740 2.547 3.557 . 0 0 "[ . 1 . 2]" 1
788 1 89 PHE QD 1 154 GLY QA 5.500 . 5.500 2.413 1.957 2.997 . 0 0 "[ . 1 . 2]" 1
789 1 153 THR H 1 154 GLY H 5.500 . 5.500 4.251 3.947 4.341 . 0 0 "[ . 1 . 2]" 1
790 1 89 PHE HA 1 155 LYS HA 5.500 . 5.500 4.074 3.505 4.712 . 0 0 "[ . 1 . 2]" 1
791 1 89 PHE HB3 1 155 LYS HA 5.500 . 5.500 3.696 3.084 4.255 . 0 0 "[ . 1 . 2]" 1
792 1 89 PHE HB2 1 155 LYS HA 5.500 . 5.500 5.080 4.597 5.523 0.023 19 0 "[ . 1 . 2]" 1
793 1 91 SER QB 1 155 LYS HA 5.500 . 5.500 2.902 2.280 4.030 . 0 0 "[ . 1 . 2]" 1
794 1 91 SER H 1 155 LYS HA 5.500 . 5.500 3.970 3.444 4.526 . 0 0 "[ . 1 . 2]" 1
795 1 91 SER QB 1 155 LYS QD 5.500 . 5.500 2.860 2.051 3.617 . 0 0 "[ . 1 . 2]" 1
796 1 151 CYS HA 1 155 LYS QB 5.500 . 5.500 4.157 3.606 4.478 . 0 0 "[ . 1 . 2]" 1
797 1 151 CYS QB 1 155 LYS H 5.500 . 5.500 3.886 3.700 4.073 . 0 0 "[ . 1 . 2]" 1
798 1 152 ALA MB 1 155 LYS QB 5.500 . 5.500 2.003 1.843 2.214 . 0 0 "[ . 1 . 2]" 1
799 1 152 ALA H 1 155 LYS QB 5.500 . 5.500 2.992 2.584 3.283 . 0 0 "[ . 1 . 2]" 1
800 1 152 ALA MB 1 155 LYS H 5.500 . 5.500 3.539 3.217 3.802 . 0 0 "[ . 1 . 2]" 1
801 1 152 ALA H 1 155 LYS H 5.500 . 5.500 2.983 2.828 3.124 . 0 0 "[ . 1 . 2]" 1
802 1 154 GLY QA 1 155 LYS H 4.200 . 4.200 2.880 2.796 2.944 . 0 0 "[ . 1 . 2]" 1
803 1 155 LYS H 1 155 LYS QD 5.500 . 5.500 4.443 3.967 4.958 . 0 0 "[ . 1 . 2]" 1
804 1 6 PHE QE 1 156 ILE MD 5.500 . 5.500 3.052 2.248 3.518 . 0 0 "[ . 1 . 2]" 1
805 1 10 LEU QD 1 156 ILE MD 5.500 . 5.500 2.122 1.945 2.476 . 0 0 "[ . 1 . 2]" 1
806 1 28 LEU QD 1 156 ILE MD 5.500 . 5.500 2.515 2.018 3.334 . 0 0 "[ . 1 . 2]" 1
807 1 86 ILE HB 1 156 ILE MD 5.500 . 5.500 2.404 2.027 2.739 . 0 0 "[ . 1 . 2]" 1
808 1 89 PHE HB3 1 156 ILE MD 5.500 . 5.500 3.310 2.578 3.781 . 0 0 "[ . 1 . 2]" 1
809 1 89 PHE HB2 1 156 ILE MD 5.500 . 5.500 2.623 2.315 2.966 . 0 0 "[ . 1 . 2]" 1
810 1 89 PHE QD 1 156 ILE MD 5.500 . 5.500 3.770 3.122 4.208 . 0 0 "[ . 1 . 2]" 1
811 1 89 PHE HB3 1 156 ILE HG12 5.500 . 5.500 4.703 4.368 5.515 0.015 1 0 "[ . 1 . 2]" 1
812 1 89 PHE HA 1 156 ILE H 5.500 . 5.500 4.424 4.188 4.742 . 0 0 "[ . 1 . 2]" 1
813 1 89 PHE HB3 1 156 ILE H 5.500 . 5.500 3.540 3.239 4.048 . 0 0 "[ . 1 . 2]" 1
814 1 90 ILE HA 1 156 ILE HA 5.500 . 5.500 4.618 4.451 4.803 . 0 0 "[ . 1 . 2]" 1
815 1 90 ILE HA 1 156 ILE HB 3.000 . 3.000 2.409 2.167 2.684 . 0 0 "[ . 1 . 2]" 1
816 1 90 ILE MD 1 156 ILE HB 5.500 . 5.500 4.382 3.960 4.651 . 0 0 "[ . 1 . 2]" 1
817 1 90 ILE H 1 156 ILE HB 5.500 . 5.500 4.323 4.017 4.723 . 0 0 "[ . 1 . 2]" 1
818 1 90 ILE HA 1 156 ILE MD 5.500 . 5.500 3.938 3.294 4.219 . 0 0 "[ . 1 . 2]" 1
819 1 149 VAL HA 1 156 ILE QG 5.500 . 5.500 4.011 3.913 4.229 . 0 0 "[ . 1 . 2]" 1
820 1 151 CYS HA 1 156 ILE HA 4.200 . 4.200 2.214 1.902 2.660 . 0 0 "[ . 1 . 2]" 1
821 1 151 CYS QB 1 156 ILE HA 5.500 . 5.500 2.471 2.170 3.145 . 0 0 "[ . 1 . 2]" 1
822 1 151 CYS QB 1 156 ILE MD 5.500 . 5.500 3.561 3.310 3.747 . 0 0 "[ . 1 . 2]" 1
823 1 151 CYS HA 1 156 ILE QG 5.500 . 5.500 3.309 3.015 3.861 . 0 0 "[ . 1 . 2]" 1
824 1 151 CYS QB 1 156 ILE QG 5.500 . 5.500 2.141 1.825 3.304 . 0 0 "[ . 1 . 2]" 1
825 1 152 ALA H 1 156 ILE HA 5.500 . 5.500 3.445 3.250 3.785 . 0 0 "[ . 1 . 2]" 1
826 1 155 LYS HA 1 156 ILE H 5.500 . 5.500 2.210 2.130 2.324 . 0 0 "[ . 1 . 2]" 1
827 1 155 LYS QB 1 156 ILE H 5.500 . 5.500 3.363 2.681 3.737 . 0 0 "[ . 1 . 2]" 1
828 1 155 LYS H 1 156 ILE H 5.500 . 5.500 4.030 3.639 4.357 . 0 0 "[ . 1 . 2]" 1
829 1 156 ILE HA 1 156 ILE HG12 4.200 . 4.200 2.715 2.557 3.762 . 0 0 "[ . 1 . 2]" 1
830 1 156 ILE H 1 156 ILE HG13 5.500 . 5.500 2.862 2.502 3.904 . 0 0 "[ . 1 . 2]" 1
831 1 91 SER QB 1 157 PHE HA 5.500 . 5.500 3.635 2.926 4.614 . 0 0 "[ . 1 . 2]" 1
832 1 91 SER H 1 157 PHE HA 5.500 . 5.500 3.437 3.117 3.631 . 0 0 "[ . 1 . 2]" 1
833 1 94 LEU HA 1 157 PHE HD1 5.500 . 5.500 2.401 2.000 3.418 . 0 0 "[ . 1 . 2]" 1
834 1 94 LEU HA 1 157 PHE QE 4.200 . 4.200 2.525 2.265 2.986 . 0 0 "[ . 1 . 2]" 1
835 1 99 ALA MB 1 157 PHE HD2 5.500 . 5.500 2.638 2.229 2.918 . 0 0 "[ . 1 . 2]" 1
836 1 99 ALA HA 1 157 PHE QE 5.500 . 5.500 2.789 2.269 3.180 . 0 0 "[ . 1 . 2]" 1
837 1 99 ALA MB 1 157 PHE QE 5.500 . 5.500 2.449 2.031 2.816 . 0 0 "[ . 1 . 2]" 1
838 1 118 VAL QG 1 157 PHE HD2 5.500 . 5.500 3.667 3.001 4.061 . 0 0 "[ . 1 . 2]" 1
839 1 118 VAL QG 1 157 PHE QE 5.500 . 5.500 3.379 3.030 3.648 . 0 0 "[ . 1 . 2]" 1
840 1 135 ILE MD 1 157 PHE HA 5.500 . 5.500 4.359 3.897 4.607 . 0 0 "[ . 1 . 2]" 1
841 1 135 ILE MD 1 157 PHE QB 5.500 . 5.500 2.321 1.938 2.609 . 0 0 "[ . 1 . 2]" 1
842 1 135 ILE QG 1 157 PHE QB 5.500 . 5.500 3.151 2.730 3.515 . 0 0 "[ . 1 . 2]" 1
843 1 135 ILE MD 1 157 PHE HD1 5.500 . 5.500 3.623 2.867 4.265 . 0 0 "[ . 1 . 2]" 1
844 1 150 LEU HG 1 157 PHE QB 5.500 . 5.500 2.719 2.411 3.041 . 0 0 "[ . 1 . 2]" 1
845 1 150 LEU QB 1 157 PHE H 5.500 . 5.500 3.658 3.414 3.844 . 0 0 "[ . 1 . 2]" 1
846 1 151 CYS HA 1 157 PHE QE 5.500 . 5.500 3.475 3.078 4.090 . 0 0 "[ . 1 . 2]" 1
847 1 151 CYS HA 1 157 PHE H 4.200 . 4.200 2.637 2.472 2.847 . 0 0 "[ . 1 . 2]" 1
848 1 152 ALA H 1 157 PHE HD2 5.500 . 5.500 4.303 3.848 5.020 . 0 0 "[ . 1 . 2]" 1
849 1 152 ALA H 1 157 PHE QE 5.500 . 5.500 3.560 3.125 4.325 . 0 0 "[ . 1 . 2]" 1
850 1 156 ILE QG 1 157 PHE HA 5.500 . 5.500 3.885 3.738 3.981 . 0 0 "[ . 1 . 2]" 1
851 1 156 ILE HA 1 157 PHE HD2 5.500 . 5.500 3.952 3.488 4.763 . 0 0 "[ . 1 . 2]" 1
852 1 156 ILE HA 1 157 PHE H 4.200 . 4.200 2.141 2.074 2.207 . 0 0 "[ . 1 . 2]" 1
853 1 156 ILE HB 1 157 PHE H 5.500 . 5.500 4.181 4.098 4.312 . 0 0 "[ . 1 . 2]" 1
854 1 156 ILE QG 1 157 PHE H 5.500 . 5.500 2.643 2.543 2.789 . 0 0 "[ . 1 . 2]" 1
855 1 157 PHE HA 1 157 PHE HD1 3.000 . 3.000 2.714 2.290 3.005 0.005 17 0 "[ . 1 . 2]" 1
856 1 157 PHE HA 1 157 PHE QE 5.500 . 5.500 4.588 4.459 4.694 . 0 0 "[ . 1 . 2]" 1
857 1 135 ILE MG 1 158 GLY QA 5.500 . 5.500 3.551 3.036 3.822 . 0 0 "[ . 1 . 2]" 1
858 1 149 VAL HA 1 158 GLY H 5.500 . 5.500 4.806 4.582 5.085 . 0 0 "[ . 1 . 2]" 1
859 1 150 LEU QB 1 158 GLY H 5.500 . 5.500 2.607 2.331 2.848 . 0 0 "[ . 1 . 2]" 1
860 1 156 ILE HA 1 158 GLY H 5.500 . 5.500 3.916 3.696 4.108 . 0 0 "[ . 1 . 2]" 1
861 1 156 ILE QG 1 158 GLY H 5.500 . 5.500 2.644 2.364 2.928 . 0 0 "[ . 1 . 2]" 1
862 1 157 PHE QB 1 158 GLY H 5.500 . 5.500 2.610 2.286 2.920 . 0 0 "[ . 1 . 2]" 1
863 1 157 PHE H 1 158 GLY H 5.500 . 5.500 2.174 2.092 2.292 . 0 0 "[ . 1 . 2]" 1
864 1 28 LEU QB 1 159 ILE QG 5.500 . 5.500 2.591 2.265 2.939 . 0 0 "[ . 1 . 2]" 1
865 1 28 LEU QD 1 159 ILE MG 5.500 . 5.500 2.492 2.093 2.864 . 0 0 "[ . 1 . 2]" 1
866 1 36 VAL QG 1 159 ILE MD 5.500 . 5.500 2.019 1.836 2.154 . 0 0 "[ . 1 . 2]" 1
867 1 37 ILE HA 1 159 ILE MD 5.500 . 5.500 2.843 2.017 3.521 . 0 0 "[ . 1 . 2]" 1
868 1 72 LEU QD 1 159 ILE MD 5.500 . 5.500 2.263 1.909 3.369 . 0 0 "[ . 1 . 2]" 1
869 1 147 GLY QA 1 159 ILE MD 5.500 . 5.500 2.481 1.978 3.511 . 0 0 "[ . 1 . 2]" 1
870 1 149 VAL HA 1 159 ILE HA 5.500 . 5.500 2.674 2.480 2.964 . 0 0 "[ . 1 . 2]" 1
871 1 149 VAL QG 1 159 ILE HA 5.500 . 5.500 3.905 3.666 4.112 . 0 0 "[ . 1 . 2]" 1
872 1 149 VAL HA 1 159 ILE MG 5.500 . 5.500 2.298 1.956 3.064 . 0 0 "[ . 1 . 2]" 1
873 1 150 LEU H 1 159 ILE HB 5.500 . 5.500 4.837 4.437 5.439 . 0 0 "[ . 1 . 2]" 1
874 1 158 GLY QA 1 159 ILE MG 5.500 . 5.500 3.369 3.252 3.578 . 0 0 "[ . 1 . 2]" 1
875 1 158 GLY QA 1 159 ILE H 5.500 . 5.500 2.187 2.132 2.239 . 0 0 "[ . 1 . 2]" 1
876 1 159 ILE H 1 159 ILE MD 5.500 . 5.500 3.996 3.833 4.188 . 0 0 "[ . 1 . 2]" 1
877 1 159 ILE H 1 159 ILE HG13 5.500 . 5.500 2.974 2.727 3.160 . 0 0 "[ . 1 . 2]" 1
878 1 101 LEU QD 1 160 HIS QB 5.500 . 5.500 1.920 1.770 2.098 0.030 1 0 "[ . 1 . 2]" 1
879 1 101 LEU QD 1 160 HIS HD2 5.500 . 5.500 3.650 2.233 4.056 . 0 0 "[ . 1 . 2]" 1
880 1 148 GLY H 1 160 HIS QB 5.500 . 5.500 2.576 1.888 3.097 . 0 0 "[ . 1 . 2]" 1
881 1 38 PRO QB 1 161 VAL QG 5.500 . 5.500 2.579 1.932 3.235 . 0 0 "[ . 1 . 2]" 1
882 1 40 HIS HE1 1 161 VAL HB 5.500 . 5.500 3.534 1.980 4.849 . 0 0 "[ . 1 . 2]" 1
883 1 71 GLU QB 1 161 VAL HB 5.500 . 5.500 4.236 3.045 4.968 . 0 0 "[ . 1 . 2]" 1
884 1 71 GLU QB 1 161 VAL QG 5.500 . 5.500 2.498 2.074 3.085 . 0 0 "[ . 1 . 2]" 1
885 1 71 GLU QG 1 161 VAL QG 5.500 . 5.500 2.168 1.769 2.880 0.031 12 0 "[ . 1 . 2]" 1
886 1 134 MET ME 1 161 VAL HB 5.500 . 5.500 3.565 2.149 5.090 . 0 0 "[ . 1 . 2]" 1
887 1 161 VAL QG 1 162 GLY H 5.500 . 5.500 2.711 1.883 3.319 . 0 0 "[ . 1 . 2]" 1
888 1 161 VAL H 1 162 GLY H 4.200 . 4.200 2.242 1.971 2.533 . 0 0 "[ . 1 . 2]" 1
889 1 162 GLY QA 1 163 GLY H 4.200 . 4.200 2.170 2.041 2.255 . 0 0 "[ . 1 . 2]" 1
890 1 162 GLY H 1 163 GLY H 5.500 . 5.500 4.084 3.135 4.422 . 0 0 "[ . 1 . 2]" 1
891 1 163 GLY QA 1 164 ASN H 4.200 . 4.200 2.182 2.075 2.535 . 0 0 "[ . 1 . 2]" 1
892 1 164 ASN H 1 165 GLY H 5.500 . 5.500 3.975 3.642 4.363 . 0 0 "[ . 1 . 2]" 1
893 1 138 ASP HA 1 166 ARG HA 5.500 . 5.500 5.025 4.508 5.509 0.009 12 0 "[ . 1 . 2]" 1
894 1 138 ASP HA 1 166 ARG QB 5.500 . 5.500 4.055 3.268 4.851 . 0 0 "[ . 1 . 2]" 1
895 1 140 ALA HA 1 166 ARG HA 4.200 . 4.200 2.410 1.905 3.018 . 0 0 "[ . 1 . 2]" 1
896 1 140 ALA MB 1 166 ARG HA 5.500 . 5.500 3.144 2.156 4.415 . 0 0 "[ . 1 . 2]" 1
897 1 165 GLY QA 1 166 ARG HA 5.500 . 5.500 3.921 3.847 3.952 . 0 0 "[ . 1 . 2]" 1
898 1 138 ASP HA 1 167 GLN QG 4.200 . 4.200 3.333 2.076 3.804 . 0 0 "[ . 1 . 2]" 1
899 1 138 ASP HA 1 167 GLN H 5.500 . 5.500 4.991 4.617 5.379 . 0 0 "[ . 1 . 2]" 1
900 1 139 TYR H 1 167 GLN H 5.500 . 5.500 4.724 4.485 5.172 . 0 0 "[ . 1 . 2]" 1
901 1 164 ASN H 1 167 GLN H 5.500 . 5.500 3.739 3.420 4.844 . 0 0 "[ . 1 . 2]" 1
902 1 166 ARG QB 1 167 GLN HA 5.500 . 5.500 4.211 3.874 4.714 . 0 0 "[ . 1 . 2]" 1
903 1 166 ARG QB 1 167 GLN H 5.500 . 5.500 3.523 3.121 4.017 . 0 0 "[ . 1 . 2]" 1
904 1 166 ARG QG 1 167 GLN H 5.500 . 5.500 4.203 2.797 4.868 . 0 0 "[ . 1 . 2]" 1
905 1 166 ARG H 1 167 GLN H 5.500 . 5.500 2.317 2.056 2.612 . 0 0 "[ . 1 . 2]" 1
906 1 136 ARG QG 1 168 GLY H 5.500 . 5.500 4.042 3.261 4.894 . 0 0 "[ . 1 . 2]" 1
907 1 139 TYR H 1 168 GLY H 5.500 . 5.500 3.155 2.429 3.533 . 0 0 "[ . 1 . 2]" 1
908 1 163 GLY QA 1 168 GLY QA 5.500 . 5.500 2.195 1.877 2.800 . 0 0 "[ . 1 . 2]" 1
909 1 167 GLN HA 1 168 GLY H 4.200 . 4.200 2.079 2.029 2.181 . 0 0 "[ . 1 . 2]" 1
910 1 121 ALA MB 1 169 PHE HD1 5.500 . 5.500 3.559 2.586 6.339 0.839 5 2 "[ + - . 2]" 1
911 1 121 ALA MB 1 169 PHE HE1 5.500 . 5.500 3.399 2.218 6.408 0.908 5 1 "[ + 1 . 2]" 1
912 1 136 ARG HA 1 169 PHE HA 4.200 . 4.200 2.748 2.423 3.165 . 0 0 "[ . 1 . 2]" 1
913 1 136 ARG QB 1 169 PHE HA 5.500 . 5.500 3.948 2.903 4.667 . 0 0 "[ . 1 . 2]" 1
914 1 136 ARG QG 1 169 PHE HA 5.500 . 5.500 4.276 3.745 4.956 . 0 0 "[ . 1 . 2]" 1
915 1 137 TYR QE 1 169 PHE HA 5.500 . 5.500 4.658 4.300 5.127 . 0 0 "[ . 1 . 2]" 1
916 1 137 TYR QE 1 169 PHE H 5.500 . 5.500 4.885 4.341 5.237 . 0 0 "[ . 1 . 2]" 1
917 1 162 GLY H 1 169 PHE HA 5.500 . 5.500 5.101 4.622 5.509 0.009 13 0 "[ . 1 . 2]" 1
918 1 162 GLY H 1 169 PHE QB 5.500 . 5.500 3.382 2.698 4.075 . 0 0 "[ . 1 . 2]" 1
919 1 162 GLY H 1 169 PHE H 5.500 . 5.500 3.498 3.114 4.182 . 0 0 "[ . 1 . 2]" 1
920 1 163 GLY QA 1 169 PHE HD2 5.500 . 5.500 3.494 2.010 6.317 0.817 10 2 "[ -. + . 2]" 1
921 1 163 GLY H 1 169 PHE H 5.500 . 5.500 4.343 2.378 5.038 . 0 0 "[ . 1 . 2]" 1
922 1 168 GLY QA 1 169 PHE H 5.500 . 5.500 2.129 2.068 2.179 . 0 0 "[ . 1 . 2]" 1
923 1 135 ILE QG 1 170 SER HA 5.500 . 5.500 3.790 3.698 3.857 . 0 0 "[ . 1 . 2]" 1
924 1 135 ILE HB 1 170 SER QB 5.500 . 5.500 4.511 4.279 4.665 . 0 0 "[ . 1 . 2]" 1
925 1 135 ILE QG 1 170 SER QB 5.500 . 5.500 1.803 1.763 1.856 0.037 6 0 "[ . 1 . 2]" 1
926 1 135 ILE MD 1 170 SER QB 5.500 . 5.500 3.537 3.225 3.751 . 0 0 "[ . 1 . 2]" 1
927 1 135 ILE QG 1 170 SER H 5.500 . 5.500 2.678 2.405 3.121 . 0 0 "[ . 1 . 2]" 1
928 1 137 TYR QE 1 170 SER QB 5.500 . 5.500 2.628 1.827 3.284 . 0 0 "[ . 1 . 2]" 1
929 1 150 LEU QB 1 170 SER QB 5.500 . 5.500 3.236 2.978 3.345 . 0 0 "[ . 1 . 2]" 1
930 1 150 LEU QD 1 170 SER QB 5.500 . 5.500 2.305 2.121 2.728 . 0 0 "[ . 1 . 2]" 1
931 1 160 HIS QB 1 170 SER HA 5.500 . 5.500 4.443 4.056 4.974 . 0 0 "[ . 1 . 2]" 1
932 1 160 HIS HA 1 170 SER QB 5.500 . 5.500 2.519 2.221 2.863 . 0 0 "[ . 1 . 2]" 1
933 1 161 VAL QG 1 170 SER HA 5.500 . 5.500 2.363 2.031 2.725 . 0 0 "[ . 1 . 2]" 1
934 1 161 VAL H 1 170 SER H 5.500 . 5.500 4.508 4.329 4.914 . 0 0 "[ . 1 . 2]" 1
935 1 169 PHE HA 1 170 SER H 4.200 . 4.200 2.082 2.024 2.177 . 0 0 "[ . 1 . 2]" 1
936 1 169 PHE QB 1 170 SER H 5.500 . 5.500 3.104 2.806 3.313 . 0 0 "[ . 1 . 2]" 1
937 1 161 VAL QG 1 171 ALA H 5.500 . 5.500 2.388 2.016 3.108 . 0 0 "[ . 1 . 2]" 1
938 1 94 LEU QD 1 172 GLN QB 5.500 . 5.500 2.701 2.004 3.273 . 0 0 "[ . 1 . 2]" 1
939 1 135 ILE MG 1 172 GLN QG 5.500 . 5.500 3.100 2.273 3.854 . 0 0 "[ . 1 . 2]" 1
940 1 90 ILE MD 1 173 LEU QB 5.500 . 5.500 3.092 2.329 3.703 . 0 0 "[ . 1 . 2]" 1
941 1 158 GLY QA 1 173 LEU QD 5.500 . 5.500 2.091 1.781 2.420 0.019 2 0 "[ . 1 . 2]" 1
942 1 159 ILE H 1 173 LEU QD 5.500 . 5.500 3.034 2.027 3.846 . 0 0 "[ . 1 . 2]" 1
943 1 90 ILE MD 1 174 LYS HA 5.500 . 5.500 4.105 3.477 4.432 . 0 0 "[ . 1 . 2]" 1
944 1 90 ILE QG 1 174 LYS HA 5.500 . 5.500 2.727 2.102 3.150 . 0 0 "[ . 1 . 2]" 1
945 1 92 GLU QB 1 174 LYS QE 5.500 . 5.500 3.151 1.953 4.273 . 0 0 "[ . 1 . 2]" 1
946 1 173 LEU HA 1 174 LYS QG 5.500 . 5.500 4.113 3.640 4.658 . 0 0 "[ . 1 . 2]" 1
947 1 173 LEU HA 1 174 LYS H 5.500 . 5.500 2.168 2.038 2.860 . 0 0 "[ . 1 . 2]" 1
948 1 87 ARG QG 1 175 LYS HA 5.500 . 5.500 3.505 2.949 4.143 . 0 0 "[ . 1 . 2]" 1
949 1 88 GLY QA 1 175 LYS QE 5.500 . 5.500 3.282 2.371 4.113 . 0 0 "[ . 1 . 2]" 1
950 1 90 ILE HB 1 175 LYS HA 5.500 . 5.500 4.112 3.532 4.600 . 0 0 "[ . 1 . 2]" 1
951 1 90 ILE MD 1 175 LYS HA 4.200 . 4.200 2.578 2.313 2.917 . 0 0 "[ . 1 . 2]" 1
952 1 90 ILE MG 1 175 LYS HA 5.500 . 5.500 3.136 2.758 3.664 . 0 0 "[ . 1 . 2]" 1
953 1 90 ILE MG 1 175 LYS QB 5.500 . 5.500 2.760 2.150 3.997 . 0 0 "[ . 1 . 2]" 1
954 1 90 ILE HB 1 175 LYS QG 5.500 . 5.500 3.459 1.947 4.519 . 0 0 "[ . 1 . 2]" 1
955 1 90 ILE QG 1 175 LYS H 5.500 . 5.500 2.512 2.130 3.320 . 0 0 "[ . 1 . 2]" 1
956 1 174 LYS HA 1 175 LYS HA 5.500 . 5.500 4.262 4.182 4.340 . 0 0 "[ . 1 . 2]" 1
957 1 174 LYS HA 1 175 LYS H 3.000 . 3.000 2.203 2.035 2.375 . 0 0 "[ . 1 . 2]" 1
958 1 174 LYS QB 1 175 LYS H 5.500 . 5.500 2.818 2.510 3.209 . 0 0 "[ . 1 . 2]" 1
959 1 174 LYS QG 1 175 LYS H 5.500 . 5.500 4.061 3.431 4.772 . 0 0 "[ . 1 . 2]" 1
960 1 175 LYS HA 1 175 LYS QE 5.500 . 5.500 4.314 4.011 4.707 . 0 0 "[ . 1 . 2]" 1
961 1 175 LYS H 1 175 LYS QB 3.000 . 3.000 2.448 2.075 2.639 . 0 0 "[ . 1 . 2]" 1
962 1 175 LYS H 1 175 LYS QE 5.500 . 5.500 4.126 3.004 4.765 . 0 0 "[ . 1 . 2]" 1
963 1 174 LYS QB 1 176 GLN QG 5.500 . 5.500 3.169 1.866 4.456 . 0 0 "[ . 1 . 2]" 1
964 1 174 LYS QB 1 176 GLN H 5.500 . 5.500 2.589 2.284 3.086 . 0 0 "[ . 1 . 2]" 1
965 1 175 LYS HA 1 176 GLN HA 5.500 . 5.500 4.862 4.701 5.020 . 0 0 "[ . 1 . 2]" 1
966 1 175 LYS QB 1 176 GLN H 4.200 . 4.200 3.273 2.613 3.775 . 0 0 "[ . 1 . 2]" 1
967 1 175 LYS H 1 176 GLN H 5.500 . 5.500 2.534 2.270 2.845 . 0 0 "[ . 1 . 2]" 1
968 1 62 LEU QD 1 177 TYR HB3 5.500 . 5.500 2.337 1.954 2.792 . 0 0 "[ . 1 . 2]" 1
969 1 62 LEU QD 1 177 TYR HB2 5.500 . 5.500 3.312 2.816 3.999 . 0 0 "[ . 1 . 2]" 1
970 1 62 LEU QD 1 177 TYR QD 4.200 . 4.200 2.468 2.040 2.780 . 0 0 "[ . 1 . 2]" 1
971 1 62 LEU QD 1 177 TYR QE 5.500 . 5.500 3.128 2.574 3.590 . 0 0 "[ . 1 . 2]" 1
972 1 174 LYS QB 1 177 TYR QE 5.500 . 5.500 2.759 2.175 3.487 . 0 0 "[ . 1 . 2]" 1
973 1 174 LYS H 1 177 TYR H 5.500 . 5.500 4.711 4.267 5.486 . 0 0 "[ . 1 . 2]" 1
974 1 175 LYS HA 1 177 TYR H 5.500 . 5.500 3.625 3.367 3.951 . 0 0 "[ . 1 . 2]" 1
975 1 176 GLN HA 1 177 TYR HA 5.500 . 5.500 4.705 4.595 4.811 . 0 0 "[ . 1 . 2]" 1
976 1 176 GLN HA 1 177 TYR H 5.500 . 5.500 3.479 3.332 3.560 . 0 0 "[ . 1 . 2]" 1
977 1 176 GLN QB 1 177 TYR H 4.200 . 4.200 3.095 2.602 3.852 . 0 0 "[ . 1 . 2]" 1
978 1 176 GLN H 1 177 TYR H 5.500 . 5.500 2.744 2.621 2.901 . 0 0 "[ . 1 . 2]" 1
979 1 177 TYR HA 1 177 TYR QD 3.000 . 3.000 2.459 2.117 2.878 . 0 0 "[ . 1 . 2]" 1
980 1 30 ILE QG 1 178 PHE HB3 5.500 . 5.500 2.973 2.383 3.599 . 0 0 "[ . 1 . 2]" 1
981 1 30 ILE QG 1 178 PHE HB2 5.500 . 5.500 3.462 2.869 3.858 . 0 0 "[ . 1 . 2]" 1
982 1 30 ILE MD 1 178 PHE QE 5.500 . 5.500 3.500 3.053 3.832 . 0 0 "[ . 1 . 2]" 1
983 1 36 VAL QG 1 178 PHE QE 5.500 . 5.500 2.576 1.996 3.493 . 0 0 "[ . 1 . 2]" 1
984 1 36 VAL QG 1 178 PHE HZ 5.500 . 5.500 2.281 1.898 2.942 . 0 0 "[ . 1 . 2]" 1
985 1 74 VAL QG 1 178 PHE QE 5.500 . 5.500 2.512 1.929 3.155 . 0 0 "[ . 1 . 2]" 1
986 1 90 ILE MD 1 178 PHE QD 5.500 . 5.500 2.639 2.219 3.212 . 0 0 "[ . 1 . 2]" 1
987 1 90 ILE MD 1 178 PHE QE 5.500 . 5.500 2.748 2.283 3.095 . 0 0 "[ . 1 . 2]" 1
988 1 90 ILE MD 1 178 PHE HZ 5.500 . 5.500 4.350 3.552 4.596 . 0 0 "[ . 1 . 2]" 1
989 1 175 LYS HA 1 178 PHE HB2 5.500 . 5.500 3.152 2.699 4.047 . 0 0 "[ . 1 . 2]" 1
990 1 175 LYS HA 1 178 PHE QD 4.200 . 4.200 2.139 1.890 2.406 . 0 0 "[ . 1 . 2]" 1
991 1 175 LYS HA 1 178 PHE QE 5.500 . 5.500 3.875 2.913 4.308 . 0 0 "[ . 1 . 2]" 1
992 1 176 GLN HA 1 178 PHE H 4.200 . 4.200 3.868 3.513 4.152 . 0 0 "[ . 1 . 2]" 1
993 1 177 TYR HA 1 178 PHE H 5.500 . 5.500 3.389 3.301 3.459 . 0 0 "[ . 1 . 2]" 1
994 1 177 TYR HB3 1 178 PHE H 4.200 . 4.200 4.058 3.904 4.231 0.031 16 0 "[ . 1 . 2]" 1
995 1 177 TYR HB2 1 178 PHE H 5.500 . 5.500 3.173 2.785 3.477 . 0 0 "[ . 1 . 2]" 1
996 1 177 TYR H 1 178 PHE H 3.000 . 3.000 2.352 2.143 2.509 . 0 0 "[ . 1 . 2]" 1
997 1 178 PHE HA 1 178 PHE QD 3.000 . 3.000 2.582 2.373 2.767 . 0 0 "[ . 1 . 2]" 1
998 1 178 PHE H 1 178 PHE HA 3.000 . 3.000 2.930 2.912 2.954 . 0 0 "[ . 1 . 2]" 1
999 1 178 PHE H 1 178 PHE HB3 4.200 . 4.200 3.713 3.642 3.806 . 0 0 "[ . 1 . 2]" 1
1000 1 176 GLN HA 1 179 VAL QG 5.500 . 5.500 2.373 1.812 3.573 . 0 0 "[ . 1 . 2]" 1
1001 1 177 TYR H 1 179 VAL H 5.500 . 5.500 4.112 3.732 4.738 . 0 0 "[ . 1 . 2]" 1
1002 1 178 PHE HA 1 179 VAL HA 5.500 . 5.500 4.526 4.306 4.778 . 0 0 "[ . 1 . 2]" 1
1003 1 178 PHE H 1 179 VAL QG 5.500 . 5.500 3.276 2.957 3.850 . 0 0 "[ . 1 . 2]" 1
1004 1 178 PHE HA 1 179 VAL H 4.200 . 4.200 3.104 2.545 3.474 . 0 0 "[ . 1 . 2]" 1
1005 1 178 PHE HB3 1 179 VAL H 5.500 . 5.500 4.348 3.948 4.453 . 0 0 "[ . 1 . 2]" 1
1006 1 178 PHE HB2 1 179 VAL H 5.500 . 5.500 3.736 2.898 4.247 . 0 0 "[ . 1 . 2]" 1
1007 1 178 PHE H 1 179 VAL H 3.000 . 3.000 2.339 2.018 3.031 0.031 6 0 "[ . 1 . 2]" 1
1008 1 179 VAL H 1 179 VAL QG 4.200 . 4.200 2.144 1.830 2.656 . 0 0 "[ . 1 . 2]" 1
1009 1 179 VAL HA 1 180 GLU QB 5.500 . 5.500 4.248 3.752 4.743 . 0 0 "[ . 1 . 2]" 1
1010 1 179 VAL HA 1 180 GLU H 5.500 . 5.500 2.228 2.019 2.665 . 0 0 "[ . 1 . 2]" 1
1011 1 179 VAL QG 1 180 GLU H 4.200 . 4.200 2.814 1.769 3.282 0.031 20 0 "[ . 1 . 2]" 1
1012 1 179 VAL H 1 180 GLU H 5.500 . 5.500 4.409 4.127 4.610 . 0 0 "[ . 1 . 2]" 1
1013 1 180 GLU H 1 180 GLU HA 3.000 . 3.000 2.854 2.750 2.914 . 0 0 "[ . 1 . 2]" 1
1014 1 180 GLU H 1 180 GLU QB 3.000 . 3.000 2.337 2.169 2.620 . 0 0 "[ . 1 . 2]" 1
1015 1 180 GLU QB 1 181 LYS QG 5.500 . 5.500 3.257 2.631 4.576 . 0 0 "[ . 1 . 2]" 1
1016 1 180 GLU QG 1 181 LYS H 5.500 . 5.500 3.799 1.825 4.715 . 0 0 "[ . 1 . 2]" 1
1017 1 181 LYS HA 1 182 GLN H 3.000 . 3.000 2.165 2.063 2.305 . 0 0 "[ . 1 . 2]" 1
1018 1 181 LYS QG 1 182 GLN H 5.500 . 5.500 4.237 2.512 4.810 . 0 0 "[ . 1 . 2]" 1
1019 1 181 LYS H 1 182 GLN H 5.500 . 5.500 4.247 3.890 4.447 . 0 0 "[ . 1 . 2]" 1
1020 1 182 GLN HA 1 182 GLN QG 3.000 . 3.000 2.460 2.372 2.594 . 0 0 "[ . 1 . 2]" 1
1021 1 2 PRO QD 1 4 THR H 5.500 . 5.500 4.384 3.927 4.815 . 0 0 "[ . 1 . 2]" 1
1022 1 4 THR HB 1 5 GLU H 5.500 . 5.500 2.512 2.274 2.909 . 0 0 "[ . 1 . 2]" 1
1023 1 3 ASN H 1 6 PHE H 5.500 . 5.500 4.768 4.647 4.975 . 0 0 "[ . 1 . 2]" 1
1024 1 5 GLU HA 1 6 PHE H 5.500 . 5.500 3.535 3.485 3.577 . 0 0 "[ . 1 . 2]" 1
1025 1 6 PHE H 1 7 ALA HA 5.500 . 5.500 5.266 5.193 5.347 . 0 0 "[ . 1 . 2]" 1
1026 1 4 THR HA 1 7 ALA H 5.500 . 5.500 3.572 3.228 3.835 . 0 0 "[ . 1 . 2]" 1
1027 1 5 GLU HA 1 8 LEU H 5.500 . 5.500 3.510 2.951 3.886 . 0 0 "[ . 1 . 2]" 1
1028 1 6 PHE H 1 9 SER H 5.500 . 5.500 4.862 4.671 5.166 . 0 0 "[ . 1 . 2]" 1
1029 1 7 ALA HA 1 10 LEU H 5.500 . 5.500 3.548 3.341 3.760 . 0 0 "[ . 1 . 2]" 1
1030 1 10 LEU QB 1 11 LEU H 5.500 . 5.500 2.413 2.082 2.668 . 0 0 "[ . 1 . 2]" 1
1031 1 11 LEU H 1 12 ARG QG 5.500 . 5.500 4.461 4.164 4.679 . 0 0 "[ . 1 . 2]" 1
1032 1 11 LEU HA 1 14 ASN H 5.500 . 5.500 4.252 3.949 4.461 . 0 0 "[ . 1 . 2]" 1
1033 1 14 ASN HA 1 15 ILE H 5.500 . 5.500 3.330 3.203 3.473 . 0 0 "[ . 1 . 2]" 1
1034 1 15 ILE H 1 16 MET H 5.500 . 5.500 4.301 4.089 4.521 . 0 0 "[ . 1 . 2]" 1
1035 1 16 MET H 1 27 GLY QA 5.500 . 5.500 3.955 3.645 4.228 . 0 0 "[ . 1 . 2]" 1
1036 1 16 MET H 1 28 LEU HA 5.500 . 5.500 3.641 3.109 4.150 . 0 0 "[ . 1 . 2]" 1
1037 1 20 THR HA 1 22 LYS H 5.500 . 5.500 4.322 4.064 4.816 . 0 0 "[ . 1 . 2]" 1
1038 1 17 THR HA 1 27 GLY H 5.500 . 5.500 3.491 3.089 3.734 . 0 0 "[ . 1 . 2]" 1
1039 1 15 ILE HA 1 27 GLY H 5.500 . 5.500 4.660 4.362 4.859 . 0 0 "[ . 1 . 2]" 1
1040 1 31 HIS H 1 34 VAL HB 5.500 . 5.500 2.630 2.154 4.649 . 0 0 "[ . 1 . 2]" 1
1041 1 32 ASP H 1 85 ASP QB 5.500 . 5.500 4.162 2.981 5.003 . 0 0 "[ . 1 . 2]" 1
1042 1 32 ASP QB 1 34 VAL H 5.500 . 5.500 3.268 2.661 4.105 . 0 0 "[ . 1 . 2]" 1
1043 1 20 THR HB 1 42 GLN H 5.500 . 5.500 4.728 4.251 5.102 . 0 0 "[ . 1 . 2]" 1
1044 1 45 ASP HA 1 46 ASP H 5.500 . 5.500 3.370 3.009 3.522 . 0 0 "[ . 1 . 2]" 1
1045 1 45 ASP QB 1 46 ASP H 5.500 . 5.500 2.917 2.118 3.736 . 0 0 "[ . 1 . 2]" 1
1046 1 46 ASP H 1 55 ARG HA 5.500 . 5.500 4.687 4.371 4.972 . 0 0 "[ . 1 . 2]" 1
1047 1 46 ASP QB 1 47 VAL H 5.500 . 5.500 2.915 2.612 3.218 . 0 0 "[ . 1 . 2]" 1
1048 1 47 VAL H 1 53 LYS HA 5.500 . 5.500 4.347 3.966 4.910 . 0 0 "[ . 1 . 2]" 1
1049 1 47 VAL H 1 54 ILE HA 5.500 . 5.500 4.824 4.715 5.055 . 0 0 "[ . 1 . 2]" 1
1050 1 47 VAL H 1 55 ARG HA 5.500 . 5.500 3.583 3.124 4.071 . 0 0 "[ . 1 . 2]" 1
1051 1 53 LYS H 1 54 ILE H 5.500 . 5.500 4.395 4.097 4.539 . 0 0 "[ . 1 . 2]" 1
1052 1 54 ILE MD 1 55 ARG H 5.500 . 5.500 2.389 1.770 4.086 0.030 4 0 "[ . 1 . 2]" 1
1053 1 45 ASP HA 1 56 VAL H 5.500 . 5.500 3.982 3.642 4.801 . 0 0 "[ . 1 . 2]" 1
1054 1 57 LYS H 1 76 THR HB 5.500 . 5.500 3.583 2.409 4.084 . 0 0 "[ . 1 . 2]" 1
1055 1 56 VAL QG 1 58 ASP H 5.500 . 5.500 2.807 2.387 3.379 . 0 0 "[ . 1 . 2]" 1
1056 1 57 LYS HA 1 58 ASP H 5.500 . 5.500 3.553 3.519 3.593 . 0 0 "[ . 1 . 2]" 1
1057 1 59 LYS H 1 60 TYR HA 5.500 . 5.500 4.538 4.130 4.848 . 0 0 "[ . 1 . 2]" 1
1058 1 64 ASP H 1 68 ILE HB 5.500 . 5.500 3.852 3.153 4.816 . 0 0 "[ . 1 . 2]" 1
1059 1 66 GLU H 1 68 ILE HB 5.500 . 5.500 4.599 4.139 4.989 . 0 0 "[ . 1 . 2]" 1
1060 1 65 PRO QG 1 66 GLU H 5.500 . 5.500 3.740 2.642 4.288 . 0 0 "[ . 1 . 2]" 1
1061 1 60 TYR HA 1 74 VAL H 5.500 . 5.500 4.752 4.500 4.895 . 0 0 "[ . 1 . 2]" 1
1062 1 33 ARG HA 1 79 ARG H 5.500 . 5.500 4.689 3.657 5.540 0.040 10 0 "[ . 1 . 2]" 1
1063 1 81 GLU QB 1 82 LYS H 5.500 . 5.500 3.410 2.339 4.046 . 0 0 "[ . 1 . 2]" 1
1064 1 81 GLU QG 1 82 LYS H 5.500 . 5.500 3.961 2.500 4.865 . 0 0 "[ . 1 . 2]" 1
1065 1 82 LYS QG 1 83 PHE H 5.500 . 5.500 3.645 2.572 4.258 . 0 0 "[ . 1 . 2]" 1
1066 1 82 LYS QB 1 83 PHE H 5.500 . 5.500 3.010 2.148 3.991 . 0 0 "[ . 1 . 2]" 1
1067 1 14 ASN HA 1 84 ARG H 5.500 . 5.500 4.786 4.233 5.522 0.022 13 0 "[ . 1 . 2]" 1
1068 1 84 ARG QB 1 85 ASP H 5.500 . 5.500 3.704 3.539 3.907 . 0 0 "[ . 1 . 2]" 1
1069 1 85 ASP H 1 86 ILE H 5.500 . 5.500 4.194 4.011 4.338 . 0 0 "[ . 1 . 2]" 1
1070 1 90 ILE HB 1 91 SER H 5.500 . 5.500 4.238 4.111 4.381 . 0 0 "[ . 1 . 2]" 1
1071 1 91 SER H 1 92 GLU H 5.500 . 5.500 4.054 3.785 4.239 . 0 0 "[ . 1 . 2]" 1
1072 1 91 SER QB 1 93 ASP H 5.500 . 5.500 3.542 2.769 4.113 . 0 0 "[ . 1 . 2]" 1
1073 1 94 LEU H 1 94 LEU HG 4.200 . 4.200 2.804 2.007 4.229 0.029 12 0 "[ . 1 . 2]" 1
1074 1 94 LEU HG 1 95 GLU H 5.500 . 5.500 3.961 3.263 4.904 . 0 0 "[ . 1 . 2]" 1
1075 1 95 GLU QB 1 96 GLY H 5.500 . 5.500 3.402 2.377 3.943 . 0 0 "[ . 1 . 2]" 1
1076 1 96 GLY H 1 118 VAL HB 5.500 . 5.500 5.290 4.958 5.528 0.028 15 0 "[ . 1 . 2]" 1
1077 1 102 VAL H 1 150 LEU HA 5.500 . 5.500 3.527 3.289 3.806 . 0 0 "[ . 1 . 2]" 1
1078 1 101 LEU QB 1 113 LEU H 5.500 . 5.500 3.602 3.358 3.959 . 0 0 "[ . 1 . 2]" 1
1079 1 115 VAL HB 1 116 GLY H 5.500 . 5.500 3.573 2.171 4.227 . 0 0 "[ . 1 . 2]" 1
1080 1 122 GLY H 1 133 ARG H 5.500 . 5.500 4.750 4.052 5.232 . 0 0 "[ . 1 . 2]" 1
1081 1 125 ASN HA 1 129 THR H 5.500 . 5.500 4.363 3.844 5.693 0.193 14 0 "[ . 1 . 2]" 1
1082 1 126 LEU HA 1 129 THR H 5.500 . 5.500 4.467 4.209 5.056 . 0 0 "[ . 1 . 2]" 1
1083 1 127 SER HA 1 129 THR H 5.500 . 5.500 4.232 3.958 5.088 . 0 0 "[ . 1 . 2]" 1
1084 1 128 SER QB 1 129 THR H 5.500 . 5.500 3.660 3.130 4.031 . 0 0 "[ . 1 . 2]" 1
1085 1 140 ALA H 1 166 ARG HA 5.500 . 5.500 3.996 3.144 4.959 . 0 0 "[ . 1 . 2]" 1
1086 1 140 ALA MB 1 141 THR H 5.500 . 5.500 3.459 3.280 3.585 . 0 0 "[ . 1 . 2]" 1
1087 1 150 LEU H 1 157 PHE H 5.500 . 5.500 4.523 4.335 4.723 . 0 0 "[ . 1 . 2]" 1
1088 1 100 THR HA 1 151 CYS H 5.500 . 5.500 4.834 4.752 4.942 . 0 0 "[ . 1 . 2]" 1
1089 1 101 LEU HA 1 151 CYS H 5.500 . 5.500 3.366 3.172 3.583 . 0 0 "[ . 1 . 2]" 1
1090 1 152 ALA H 1 155 LYS HA 5.500 . 5.500 4.632 4.512 4.755 . 0 0 "[ . 1 . 2]" 1
1091 1 6 PHE QE 1 155 LYS H 5.500 . 5.500 3.713 3.403 4.161 . 0 0 "[ . 1 . 2]" 1
1092 1 150 LEU HG 1 157 PHE H 5.500 . 5.500 4.099 3.863 4.346 . 0 0 "[ . 1 . 2]" 1
1093 1 160 HIS HA 1 162 GLY H 5.500 . 5.500 4.009 3.558 4.488 . 0 0 "[ . 1 . 2]" 1
1094 1 138 ASP HA 1 168 GLY H 5.500 . 5.500 3.448 2.942 3.985 . 0 0 "[ . 1 . 2]" 1
1095 1 174 LYS H 1 174 LYS QD 5.500 . 5.500 3.896 3.245 4.347 . 0 0 "[ . 1 . 2]" 1
1096 1 90 ILE HB 1 175 LYS H 5.500 . 5.500 4.234 3.533 4.834 . 0 0 "[ . 1 . 2]" 1
1097 1 175 LYS QG 1 176 GLN H 5.500 . 5.500 3.310 2.522 4.250 . 0 0 "[ . 1 . 2]" 1
1098 1 174 LYS HA 1 177 TYR H 5.500 . 5.500 4.905 4.571 5.120 . 0 0 "[ . 1 . 2]" 1
1099 1 178 PHE H 1 178 PHE QD 5.500 . 5.500 2.949 2.618 3.262 . 0 0 "[ . 1 . 2]" 1
1100 1 179 VAL HB 1 180 GLU H 5.500 . 5.500 3.577 2.054 4.319 . 0 0 "[ . 1 . 2]" 1
1101 1 7 ALA HA 1 10 LEU QB 5.500 . 5.500 2.499 2.271 2.760 . 0 0 "[ . 1 . 2]" 1
1102 1 11 LEU HG 1 15 ILE MG 5.500 . 5.500 3.974 2.320 4.516 . 0 0 "[ . 1 . 2]" 1
1103 1 15 ILE MD 1 149 VAL HB 5.500 . 5.500 3.207 2.484 4.005 . 0 0 "[ . 1 . 2]" 1
1104 1 15 ILE MD 1 102 VAL HB 5.500 . 5.500 3.271 2.471 4.499 . 0 0 "[ . 1 . 2]" 1
1105 1 37 ILE QG 1 41 ALA MB 5.500 . 5.500 2.444 2.047 2.910 . 0 0 "[ . 1 . 2]" 1
1106 1 45 ASP HA 1 56 VAL HB 5.500 . 5.500 3.036 2.231 4.403 . 0 0 "[ . 1 . 2]" 1
1107 1 45 ASP HA 1 59 LYS QE 5.500 . 5.500 3.464 1.966 4.827 . 0 0 "[ . 1 . 2]" 1
1108 1 43 PRO QB 1 47 VAL QG 5.500 . 5.500 2.666 2.002 3.474 . 0 0 "[ . 1 . 2]" 1
1109 1 18 ILE QG 1 49 VAL QG 5.500 . 5.500 2.380 1.884 3.152 . 0 0 "[ . 1 . 2]" 1
1110 1 49 VAL QG 1 52 GLN QB 5.500 . 5.500 2.719 1.834 3.522 . 0 0 "[ . 1 . 2]" 1
1111 1 53 LYS HA 1 54 ILE HB 5.500 . 5.500 4.470 4.068 4.916 . 0 0 "[ . 1 . 2]" 1
1112 1 54 ILE HB 1 77 LEU QD 5.500 . 5.500 3.645 3.359 3.968 . 0 0 "[ . 1 . 2]" 1
1113 1 54 ILE QG 1 78 ASP QB 5.500 . 5.500 3.521 2.870 4.092 . 0 0 "[ . 1 . 2]" 1
1114 1 59 LYS QB 1 73 THR MG 5.500 . 5.500 2.835 2.137 3.773 . 0 0 "[ . 1 . 2]" 1
1115 1 56 VAL HB 1 59 LYS QD 5.500 . 5.500 3.940 2.508 4.990 . 0 0 "[ . 1 . 2]" 1
1116 1 62 LEU QD 1 177 TYR HA 5.500 . 5.500 3.639 2.917 4.087 . 0 0 "[ . 1 . 2]" 1
1117 1 63 VAL HA 1 64 ASP QB 5.500 . 5.500 4.101 3.873 4.300 . 0 0 "[ . 1 . 2]" 1
1118 1 66 GLU HA 1 67 ASN HA 5.500 . 5.500 5.000 4.879 5.126 . 0 0 "[ . 1 . 2]" 1
1119 1 67 ASN HA 1 68 ILE HA 5.500 . 5.500 4.436 4.220 4.572 . 0 0 "[ . 1 . 2]" 1
1120 1 68 ILE MG 1 130 PRO QB 5.500 . 5.500 2.175 1.905 2.595 . 0 0 "[ . 1 . 2]" 1
1121 1 68 ILE MD 1 130 PRO QG 5.500 . 5.500 3.430 2.145 4.094 . 0 0 "[ . 1 . 2]" 1
1122 1 55 ARG QB 1 78 ASP QB 5.500 . 5.500 3.341 2.050 4.026 . 0 0 "[ . 1 . 2]" 1
1123 1 80 ASN QB 1 81 GLU HA 5.500 . 5.500 4.238 3.900 4.488 . 0 0 "[ . 1 . 2]" 1
1124 1 81 GLU HA 1 82 LYS HA 5.500 . 5.500 4.342 4.255 4.411 . 0 0 "[ . 1 . 2]" 1
1125 1 94 LEU QB 1 135 ILE HB 5.500 . 5.500 3.917 3.473 4.696 . 0 0 "[ . 1 . 2]" 1
1126 1 97 VAL HB 1 98 ASP HA 5.500 . 5.500 5.024 4.653 5.656 0.156 11 0 "[ . 1 . 2]" 1
1127 1 24 GLU QB 1 105 SER HA 5.500 . 5.500 3.500 2.368 4.970 . 0 0 "[ . 1 . 2]" 1
1128 1 99 ALA MB 1 115 VAL MG2 5.500 . 5.500 2.839 2.388 3.532 . 0 0 "[ . 1 . 2]" 1
1129 1 139 TYR QE 1 141 THR HA 5.500 . 5.500 3.344 2.688 3.886 . 0 0 "[ . 1 . 2]" 1
1130 1 143 THR MG 1 144 GLY QA 5.500 . 5.500 3.409 3.160 3.707 . 0 0 "[ . 1 . 2]" 1
1131 1 143 THR HA 1 144 GLY QA 5.500 . 5.500 3.982 3.895 4.108 . 0 0 "[ . 1 . 2]" 1
1132 1 150 LEU HG 1 151 CYS HA 5.500 . 5.500 4.149 4.032 4.326 . 0 0 "[ . 1 . 2]" 1
1133 1 6 PHE QB 1 153 THR HB 5.500 . 5.500 3.901 2.391 4.946 . 0 0 "[ . 1 . 2]" 1
1134 1 6 PHE QB 1 153 THR HA 5.500 . 5.500 2.441 2.011 2.896 . 0 0 "[ . 1 . 2]" 1
1135 1 36 VAL QG 1 159 ILE QG 5.500 . 5.500 2.644 2.281 2.968 . 0 0 "[ . 1 . 2]" 1
1136 1 159 ILE QG 1 173 LEU HG 5.500 . 5.500 3.204 2.500 4.101 . 0 0 "[ . 1 . 2]" 1
1137 1 173 LEU HA 1 177 TYR QE 5.500 . 5.500 3.515 2.194 4.401 . 0 0 "[ . 1 . 2]" 1
1138 1 173 LEU HA 1 178 PHE HZ 5.500 . 5.500 4.278 3.451 4.958 . 0 0 "[ . 1 . 2]" 1
1139 1 40 HIS HD1 1 71 GLU OE1 5.000 . 5.000 1.908 1.669 3.441 0.131 8 0 "[ . 1 . 2]" 1
1140 1 40 HIS NE2 1 146 CYS HG 2.800 . 2.800 2.473 1.823 2.813 0.013 20 0 "[ . 1 . 2]" 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 127
_Distance_constraint_stats_list.Viol_count 118
_Distance_constraint_stats_list.Viol_total 104.617
_Distance_constraint_stats_list.Viol_max 0.161
_Distance_constraint_stats_list.Viol_rms 0.0122
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0021
_Distance_constraint_stats_list.Viol_average_violations_only 0.0443
_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 1 GLY 0.005 0.005 4 0 "[ . 1 . 2]"
1 2 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 0.005 0.005 4 0 "[ . 1 . 2]"
1 6 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LEU 0.584 0.077 12 0 "[ . 1 . 2]"
1 14 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ILE 0.584 0.077 12 0 "[ . 1 . 2]"
1 16 MET 0.006 0.006 20 0 "[ . 1 . 2]"
1 18 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 THR 1.224 0.115 20 0 "[ . 1 . 2]"
1 27 GLY 0.006 0.006 20 0 "[ . 1 . 2]"
1 28 LEU 0.048 0.023 1 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 HIS 0.453 0.073 17 0 "[ . 1 . 2]"
1 32 ASP 0.058 0.047 13 0 "[ . 1 . 2]"
1 33 ARG 0.007 0.007 17 0 "[ . 1 . 2]"
1 34 VAL 0.453 0.073 17 0 "[ . 1 . 2]"
1 35 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 VAL 0.048 0.023 1 0 "[ . 1 . 2]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 VAL 0.038 0.031 18 0 "[ . 1 . 2]"
1 52 GLN 0.038 0.031 18 0 "[ . 1 . 2]"
1 54 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ASN 0.151 0.044 6 0 "[ . 1 . 2]"
1 73 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 LEU 0.007 0.007 17 0 "[ . 1 . 2]"
1 83 PHE 0.058 0.047 13 0 "[ . 1 . 2]"
1 85 ASP 1.936 0.161 10 0 "[ . 1 . 2]"
1 86 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ARG 1.967 0.161 10 0 "[ . 1 . 2]"
1 89 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ILE 0.031 0.013 8 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 VAL 0.043 0.023 20 0 "[ . 1 . 2]"
1 103 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ALA 0.019 0.019 3 0 "[ . 1 . 2]"
1 122 GLY 0.255 0.052 5 0 "[ . 1 . 2]"
1 126 LEU 0.173 0.046 14 0 "[ . 1 . 2]"
1 129 THR 0.173 0.046 14 0 "[ . 1 . 2]"
1 130 PRO 0.112 0.044 6 0 "[ . 1 . 2]"
1 132 ASN 0.039 0.039 7 0 "[ . 1 . 2]"
1 133 ARG 0.209 0.052 5 0 "[ . 1 . 2]"
1 134 MET 0.065 0.041 14 0 "[ . 1 . 2]"
1 135 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 139 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 GLY 1.224 0.115 20 0 "[ . 1 . 2]"
1 149 VAL 0.043 0.023 20 0 "[ . 1 . 2]"
1 150 LEU 0.024 0.017 13 0 "[ . 1 . 2]"
1 151 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 155 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 156 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 157 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 158 GLY 0.024 0.017 13 0 "[ . 1 . 2]"
1 159 ILE 0.176 0.092 1 0 "[ . 1 . 2]"
1 166 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 168 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 170 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 171 ALA 0.176 0.092 1 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY O 1 5 GLU N 2.500 2.300 3.500 3.000 2.706 3.380 . 0 0 "[ . 1 . 2]" 2
2 1 1 GLY O 1 5 GLU H 1.500 . 2.500 2.075 1.763 2.505 0.005 4 0 "[ . 1 . 2]" 2
3 1 2 PRO O 1 6 PHE N 2.500 2.300 3.500 3.020 2.883 3.309 . 0 0 "[ . 1 . 2]" 2
4 1 2 PRO O 1 6 PHE H 1.500 . 2.500 2.078 1.922 2.363 . 0 0 "[ . 1 . 2]" 2
5 1 6 PHE O 1 10 LEU N 2.500 2.300 3.500 2.856 2.724 3.015 . 0 0 "[ . 1 . 2]" 2
6 1 6 PHE O 1 10 LEU H 1.500 . 2.500 1.924 1.777 2.108 . 0 0 "[ . 1 . 2]" 2
7 1 10 LEU O 1 14 ASN N 2.500 2.300 3.500 2.791 2.706 2.960 . 0 0 "[ . 1 . 2]" 2
8 1 10 LEU O 1 14 ASN H 1.500 . 2.500 1.835 1.731 2.008 . 0 0 "[ . 1 . 2]" 2
9 1 11 LEU O 1 15 ILE N 2.500 2.300 3.500 3.329 3.214 3.455 . 0 0 "[ . 1 . 2]" 2
10 1 11 LEU O 1 15 ILE H 1.500 . 2.500 2.506 2.386 2.577 0.077 12 0 "[ . 1 . 2]" 2
11 1 16 MET N 1 27 GLY O 2.500 2.300 3.500 3.015 2.776 3.309 . 0 0 "[ . 1 . 2]" 2
12 1 16 MET H 1 27 GLY O 1.500 . 2.500 2.064 1.806 2.506 0.006 20 0 "[ . 1 . 2]" 2
13 1 16 MET O 1 27 GLY N 2.800 2.400 3.400 2.772 2.684 2.908 . 0 0 "[ . 1 . 2]" 2
14 1 16 MET O 1 27 GLY H 1.800 . 2.400 1.799 1.714 1.936 . 0 0 "[ . 1 . 2]" 2
15 1 18 ILE N 1 25 PHE O 2.500 2.300 3.500 2.765 2.654 2.995 . 0 0 "[ . 1 . 2]" 2
16 1 18 ILE H 1 25 PHE O 1.500 . 2.500 1.831 1.668 2.054 . 0 0 "[ . 1 . 2]" 2
17 1 18 ILE O 1 25 PHE N 2.500 2.300 3.500 2.896 2.787 3.080 . 0 0 "[ . 1 . 2]" 2
18 1 18 ILE O 1 25 PHE H 1.500 . 2.500 1.955 1.808 2.357 . 0 0 "[ . 1 . 2]" 2
19 1 19 THR N 1 48 LEU O 2.500 2.300 3.500 2.847 2.732 3.278 . 0 0 "[ . 1 . 2]" 2
20 1 19 THR H 1 48 LEU O 1.500 . 2.500 1.896 1.774 2.374 . 0 0 "[ . 1 . 2]" 2
21 1 26 THR H 1 147 GLY O 2.500 . 4.000 4.061 4.022 4.115 0.115 20 0 "[ . 1 . 2]" 2
22 1 20 THR N 1 23 GLY O 2.500 . 4.000 2.828 2.758 2.982 . 0 0 "[ . 1 . 2]" 2
23 1 20 THR H 1 23 GLY O 1.500 . 2.500 1.908 1.828 2.118 . 0 0 "[ . 1 . 2]" 2
24 1 35 CYS N 1 75 LEU O 2.500 2.300 3.500 2.909 2.691 3.190 . 0 0 "[ . 1 . 2]" 2
25 1 35 CYS H 1 75 LEU O 1.500 . 2.500 1.949 1.711 2.293 . 0 0 "[ . 1 . 2]" 2
26 1 35 CYS O 1 75 LEU N 2.500 2.300 3.500 2.709 2.663 2.794 . 0 0 "[ . 1 . 2]" 2
27 1 35 CYS O 1 75 LEU H 1.500 . 2.500 1.784 1.721 1.871 . 0 0 "[ . 1 . 2]" 2
28 1 28 LEU O 1 36 VAL N 2.500 2.300 3.500 2.819 2.730 2.976 . 0 0 "[ . 1 . 2]" 2
29 1 28 LEU O 1 36 VAL H 1.500 . 2.500 1.893 1.775 2.137 . 0 0 "[ . 1 . 2]" 2
30 1 28 LEU N 1 36 VAL O 2.500 2.300 3.500 3.169 2.816 3.463 . 0 0 "[ . 1 . 2]" 2
31 1 28 LEU H 1 36 VAL O 1.500 . 2.500 2.233 1.882 2.523 0.023 1 0 "[ . 1 . 2]" 2
32 1 37 ILE N 1 73 THR O 2.500 2.300 3.500 2.973 2.808 3.153 . 0 0 "[ . 1 . 2]" 2
33 1 37 ILE H 1 73 THR O 1.500 . 2.500 2.024 1.877 2.209 . 0 0 "[ . 1 . 2]" 2
34 1 37 ILE O 1 73 THR N 2.800 2.400 3.400 2.823 2.672 3.081 . 0 0 "[ . 1 . 2]" 2
35 1 37 ILE O 1 73 THR H 1.800 . 2.400 1.927 1.728 2.230 . 0 0 "[ . 1 . 2]" 2
36 1 14 ASN O 1 29 GLY N 2.500 2.300 3.500 2.828 2.707 3.070 . 0 0 "[ . 1 . 2]" 2
37 1 14 ASN O 1 29 GLY H 1.500 . 2.500 1.852 1.731 2.103 . 0 0 "[ . 1 . 2]" 2
38 1 31 HIS O 1 34 VAL N 2.500 2.300 3.500 2.748 2.691 2.914 . 0 0 "[ . 1 . 2]" 2
39 1 31 HIS O 1 34 VAL H 1.500 . 2.500 1.800 1.737 1.941 . 0 0 "[ . 1 . 2]" 2
40 1 30 ILE N 1 34 VAL O 2.500 2.300 3.500 2.707 2.659 2.804 . 0 0 "[ . 1 . 2]" 2
41 1 30 ILE H 1 34 VAL O 1.500 . 2.500 1.770 1.679 1.931 . 0 0 "[ . 1 . 2]" 2
42 1 31 HIS N 1 34 VAL O 2.500 2.300 3.500 3.440 3.325 3.523 0.023 17 0 "[ . 1 . 2]" 2
43 1 31 HIS H 1 34 VAL O 1.500 . 2.500 2.508 2.373 2.573 0.073 17 0 "[ . 1 . 2]" 2
44 1 45 ASP O 1 56 VAL N 3.500 2.300 5.000 2.802 2.685 3.348 . 0 0 "[ . 1 . 2]" 2
45 1 45 ASP O 1 56 VAL H 2.500 . 4.000 1.855 1.716 2.613 . 0 0 "[ . 1 . 2]" 2
46 1 47 VAL N 1 54 ILE O 2.500 2.300 3.500 2.849 2.735 2.939 . 0 0 "[ . 1 . 2]" 2
47 1 47 VAL H 1 54 ILE O 1.500 . 2.500 1.909 1.749 2.003 . 0 0 "[ . 1 . 2]" 2
48 1 47 VAL O 1 54 ILE N 2.500 2.300 3.500 2.791 2.688 2.971 . 0 0 "[ . 1 . 2]" 2
49 1 47 VAL O 1 54 ILE H 1.500 . 2.500 1.828 1.707 2.041 . 0 0 "[ . 1 . 2]" 2
50 1 49 VAL O 1 52 GLN N 2.500 2.300 3.500 3.042 2.789 3.307 . 0 0 "[ . 1 . 2]" 2
51 1 49 VAL O 1 52 GLN H 1.500 . 2.500 2.150 1.843 2.531 0.031 18 0 "[ . 1 . 2]" 2
52 1 49 VAL N 1 52 GLN O 2.500 2.300 3.500 2.714 2.646 2.834 . 0 0 "[ . 1 . 2]" 2
53 1 49 VAL H 1 52 GLN O 1.500 . 2.500 1.785 1.675 1.921 . 0 0 "[ . 1 . 2]" 2
54 1 60 TYR N 1 74 VAL O 2.500 2.300 3.500 2.820 2.716 2.943 . 0 0 "[ . 1 . 2]" 2
55 1 60 TYR H 1 74 VAL O 1.500 . 2.500 1.881 1.757 2.036 . 0 0 "[ . 1 . 2]" 2
56 1 60 TYR O 1 74 VAL N 2.500 2.300 3.500 2.735 2.638 2.855 . 0 0 "[ . 1 . 2]" 2
57 1 60 TYR O 1 74 VAL H 1.500 . 2.500 1.783 1.675 1.926 . 0 0 "[ . 1 . 2]" 2
58 1 33 ARG O 1 77 LEU N 2.500 2.300 3.500 3.002 2.774 3.299 . 0 0 "[ . 1 . 2]" 2
59 1 33 ARG O 1 77 LEU H 1.500 . 2.500 2.108 1.846 2.507 0.007 17 0 "[ . 1 . 2]" 2
60 1 58 ASP O 1 76 THR N 2.500 2.300 3.500 2.902 2.667 3.307 . 0 0 "[ . 1 . 2]" 2
61 1 58 ASP O 1 76 THR H 1.500 . 2.500 1.955 1.695 2.330 . 0 0 "[ . 1 . 2]" 2
62 1 97 VAL O 1 118 VAL N 2.500 2.300 3.500 2.921 2.789 3.125 . 0 0 "[ . 1 . 2]" 2
63 1 97 VAL O 1 118 VAL H 1.500 . 2.500 1.960 1.807 2.170 . 0 0 "[ . 1 . 2]" 2
64 1 100 THR O 1 151 CYS N 2.500 2.300 3.500 2.800 2.742 2.910 . 0 0 "[ . 1 . 2]" 2
65 1 100 THR O 1 151 CYS H 1.500 . 2.500 1.831 1.763 1.926 . 0 0 "[ . 1 . 2]" 2
66 1 100 THR N 1 151 CYS O 2.500 2.300 3.500 2.663 2.616 2.766 . 0 0 "[ . 1 . 2]" 2
67 1 100 THR H 1 151 CYS O 1.500 . 2.500 1.712 1.637 1.945 . 0 0 "[ . 1 . 2]" 2
68 1 101 LEU O 1 113 LEU N 2.500 2.300 3.500 2.853 2.738 3.140 . 0 0 "[ . 1 . 2]" 2
69 1 101 LEU O 1 113 LEU H 1.500 . 2.500 1.882 1.768 2.162 . 0 0 "[ . 1 . 2]" 2
70 1 101 LEU N 1 113 LEU O 2.500 2.300 3.500 2.706 2.653 2.778 . 0 0 "[ . 1 . 2]" 2
71 1 101 LEU H 1 113 LEU O 1.500 . 2.500 1.745 1.678 1.843 . 0 0 "[ . 1 . 2]" 2
72 1 103 VAL N 1 111 THR O 2.500 2.300 3.500 2.935 2.726 3.151 . 0 0 "[ . 1 . 2]" 2
73 1 103 VAL H 1 111 THR O 1.500 . 2.500 2.003 1.795 2.442 . 0 0 "[ . 1 . 2]" 2
74 1 102 VAL O 1 149 VAL N 2.500 2.300 3.500 2.935 2.727 3.270 . 0 0 "[ . 1 . 2]" 2
75 1 102 VAL O 1 149 VAL H 1.500 . 2.500 2.110 1.887 2.523 0.023 20 0 "[ . 1 . 2]" 2
76 1 102 VAL N 1 149 VAL O 2.500 2.300 3.500 2.829 2.745 2.923 . 0 0 "[ . 1 . 2]" 2
77 1 102 VAL H 1 149 VAL O 1.500 . 2.500 1.859 1.761 2.009 . 0 0 "[ . 1 . 2]" 2
78 1 119 THR O 1 136 ARG N 2.500 2.300 3.500 2.807 2.680 2.943 . 0 0 "[ . 1 . 2]" 2
79 1 119 THR O 1 136 ARG H 1.500 . 2.500 1.838 1.706 1.973 . 0 0 "[ . 1 . 2]" 2
80 1 119 THR N 1 136 ARG O 2.500 2.300 3.500 2.877 2.685 3.249 . 0 0 "[ . 1 . 2]" 2
81 1 119 THR H 1 136 ARG O 1.500 . 2.500 1.949 1.747 2.280 . 0 0 "[ . 1 . 2]" 2
82 1 121 ALA N 1 134 MET O 2.500 2.300 3.500 2.927 2.736 3.314 . 0 0 "[ . 1 . 2]" 2
83 1 121 ALA H 1 134 MET O 1.500 . 2.500 2.051 1.835 2.519 0.019 3 0 "[ . 1 . 2]" 2
84 1 122 GLY N 1 134 MET O 2.500 2.300 3.500 3.133 2.914 3.398 . 0 0 "[ . 1 . 2]" 2
85 1 122 GLY H 1 134 MET O 1.500 . 2.500 2.215 1.942 2.541 0.041 14 0 "[ . 1 . 2]" 2
86 1 122 GLY O 1 133 ARG N 2.500 2.300 3.500 2.928 2.712 3.139 . 0 0 "[ . 1 . 2]" 2
87 1 122 GLY O 1 133 ARG H 1.500 . 2.500 2.338 2.028 2.552 0.052 5 0 "[ . 1 . 2]" 2
88 1 137 TYR O 1 168 GLY N 2.500 2.300 3.500 2.852 2.727 3.125 . 0 0 "[ . 1 . 2]" 2
89 1 137 TYR O 1 168 GLY H 1.500 . 2.500 1.907 1.744 2.238 . 0 0 "[ . 1 . 2]" 2
90 1 137 TYR N 1 168 GLY O 2.500 2.300 3.500 3.096 2.893 3.366 . 0 0 "[ . 1 . 2]" 2
91 1 137 TYR H 1 168 GLY O 1.500 . 2.500 2.177 1.952 2.476 . 0 0 "[ . 1 . 2]" 2
92 1 139 TYR N 1 166 ARG O 2.500 2.300 3.500 2.804 2.706 3.030 . 0 0 "[ . 1 . 2]" 2
93 1 139 TYR H 1 166 ARG O 1.500 . 2.500 2.032 1.786 2.494 . 0 0 "[ . 1 . 2]" 2
94 1 152 ALA N 1 155 LYS O 2.500 2.300 3.500 2.703 2.643 2.834 . 0 0 "[ . 1 . 2]" 2
95 1 152 ALA H 1 155 LYS O 1.500 . 2.500 1.789 1.674 1.941 . 0 0 "[ . 1 . 2]" 2
96 1 152 ALA O 1 155 LYS N 2.500 2.300 3.500 3.019 2.885 3.274 . 0 0 "[ . 1 . 2]" 2
97 1 152 ALA O 1 155 LYS H 1.500 . 2.500 2.053 1.924 2.293 . 0 0 "[ . 1 . 2]" 2
98 1 150 LEU O 1 157 PHE N 2.500 2.300 3.500 2.826 2.729 2.905 . 0 0 "[ . 1 . 2]" 2
99 1 150 LEU O 1 157 PHE H 1.500 . 2.500 1.872 1.793 1.934 . 0 0 "[ . 1 . 2]" 2
100 1 150 LEU O 1 158 GLY N 2.500 2.300 3.500 3.324 3.166 3.451 . 0 0 "[ . 1 . 2]" 2
101 1 150 LEU O 1 158 GLY H 1.500 . 2.500 2.380 2.213 2.517 0.017 13 0 "[ . 1 . 2]" 2
102 1 150 LEU N 1 158 GLY O 2.500 2.300 3.500 2.773 2.706 2.915 . 0 0 "[ . 1 . 2]" 2
103 1 150 LEU H 1 158 GLY O 1.500 . 2.500 1.837 1.743 2.027 . 0 0 "[ . 1 . 2]" 2
104 1 159 ILE N 1 171 ALA O 2.500 2.300 3.500 3.219 2.987 3.447 . 0 0 "[ . 1 . 2]" 2
105 1 159 ILE H 1 171 ALA O 1.500 . 2.500 2.349 2.062 2.592 0.092 1 0 "[ . 1 . 2]" 2
106 1 32 ASP O 1 83 PHE N 2.500 2.300 4.000 3.106 2.681 3.991 . 0 0 "[ . 1 . 2]" 2
107 1 32 ASP O 1 83 PHE H 1.500 . 3.000 2.155 1.721 3.047 0.047 13 0 "[ . 1 . 2]" 2
108 1 30 ILE O 1 86 ILE N 2.500 2.300 3.500 2.890 2.773 3.044 . 0 0 "[ . 1 . 2]" 2
109 1 30 ILE O 1 86 ILE H 1.500 . 2.500 1.986 1.833 2.155 . 0 0 "[ . 1 . 2]" 2
110 1 87 ARG O 1 90 ILE N 2.500 2.300 3.500 3.251 3.028 3.454 . 0 0 "[ . 1 . 2]" 2
111 1 87 ARG O 1 90 ILE H 1.500 . 2.500 2.343 2.108 2.513 0.013 8 0 "[ . 1 . 2]" 2
112 1 85 ASP O 1 87 ARG N 2.500 2.300 3.500 3.290 3.156 3.403 . 0 0 "[ . 1 . 2]" 2
113 1 85 ASP O 1 87 ARG H 1.500 . 2.500 2.597 2.530 2.661 0.161 10 0 "[ . 1 . 2]" 2
114 1 91 SER N 1 156 ILE O 2.500 2.300 3.500 2.798 2.675 2.912 . 0 0 "[ . 1 . 2]" 2
115 1 91 SER H 1 156 ILE O 1.500 . 2.500 1.830 1.695 1.935 . 0 0 "[ . 1 . 2]" 2
116 1 89 PHE O 1 156 ILE N 2.500 2.300 3.500 2.786 2.693 2.985 . 0 0 "[ . 1 . 2]" 2
117 1 89 PHE O 1 156 ILE H 1.500 . 2.500 1.867 1.729 2.201 . 0 0 "[ . 1 . 2]" 2
118 1 69 ASN O 1 132 ASN N 2.500 2.300 3.500 2.961 2.698 3.369 . 0 0 "[ . 1 . 2]" 2
119 1 69 ASN O 1 132 ASN H 1.500 . 2.500 2.064 1.739 2.539 0.039 7 0 "[ . 1 . 2]" 2
120 1 69 ASN N 1 130 PRO O 2.500 2.300 3.500 3.092 2.701 3.393 . 0 0 "[ . 1 . 2]" 2
121 1 69 ASN H 1 130 PRO O 1.500 . 2.500 2.270 1.743 2.544 0.044 6 0 "[ . 1 . 2]" 2
122 1 135 ILE O 1 170 SER N 2.500 2.300 3.500 2.881 2.692 3.002 . 0 0 "[ . 1 . 2]" 2
123 1 135 ILE O 1 170 SER H 1.500 . 2.500 1.910 1.706 2.050 . 0 0 "[ . 1 . 2]" 2
124 1 126 LEU O 1 129 THR N 2.500 2.300 3.500 3.051 2.854 3.375 . 0 0 "[ . 1 . 2]" 2
125 1 126 LEU O 1 129 THR H 1.500 . 2.500 2.229 1.928 2.546 0.046 14 0 "[ . 1 . 2]" 2
126 1 126 LEU N 1 129 THR O 2.500 2.300 3.500 2.913 2.728 3.420 . 0 0 "[ . 1 . 2]" 2
127 1 126 LEU H 1 129 THR O 1.500 . 2.500 2.031 1.753 2.532 0.032 14 0 "[ . 1 . 2]" 2
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