NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
641960 |
6f2x   |
34300 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6f2x
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 1613
_Distance_constraint_stats_list.Viol_count 2420
_Distance_constraint_stats_list.Viol_total 2529.275
_Distance_constraint_stats_list.Viol_max 0.300
_Distance_constraint_stats_list.Viol_rms 0.0182
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0523
_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 1 GLY 0.007 0.007 15 0 "[ . 1 . 2]"
1 2 GLU 0.157 0.103 3 0 "[ . 1 . 2]"
1 3 SER 0.665 0.099 18 0 "[ . 1 . 2]"
1 4 PRO 2.128 0.187 12 0 "[ . 1 . 2]"
1 5 GLN 0.288 0.115 12 0 "[ . 1 . 2]"
1 6 LEU 1.229 0.268 12 0 "[ . 1 . 2]"
1 7 VAL 2.183 0.113 15 0 "[ . 1 . 2]"
1 8 ILE 5.603 0.168 5 0 "[ . 1 . 2]"
1 9 PHE 3.679 0.168 5 0 "[ . 1 . 2]"
1 10 ASP 1.429 0.188 6 0 "[ . 1 . 2]"
1 11 LEU 0.000 0.000 6 0 "[ . 1 . 2]"
1 14 THR 1.025 0.158 20 0 "[ . 1 . 2]"
1 15 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 THR 0.405 0.085 10 0 "[ . 1 . 2]"
1 17 ASP 0.622 0.131 5 0 "[ . 1 . 2]"
1 18 SER 0.437 0.086 1 0 "[ . 1 . 2]"
1 19 ALA 1.078 0.149 9 0 "[ . 1 . 2]"
1 20 ARG 1.525 0.174 7 0 "[ . 1 . 2]"
1 21 GLY 0.095 0.095 19 0 "[ . 1 . 2]"
1 22 ILE 0.062 0.058 13 0 "[ . 1 . 2]"
1 23 VAL 3.184 0.236 9 0 "[ . 1 . 2]"
1 24 SER 0.830 0.236 9 0 "[ . 1 . 2]"
1 25 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 PHE 3.481 0.207 9 0 "[ . 1 . 2]"
1 27 ARG 1.087 0.089 4 0 "[ . 1 . 2]"
1 28 HIS 0.277 0.041 1 0 "[ . 1 . 2]"
1 29 ALA 0.636 0.051 1 0 "[ . 1 . 2]"
1 30 LEU 3.657 0.153 9 0 "[ . 1 . 2]"
1 31 ASN 1.445 0.113 2 0 "[ . 1 . 2]"
1 32 HIS 0.456 0.069 1 0 "[ . 1 . 2]"
1 33 ILE 0.881 0.093 9 0 "[ . 1 . 2]"
1 34 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ALA 1.324 0.128 19 0 "[ . 1 . 2]"
1 36 PRO 2.404 0.190 11 0 "[ . 1 . 2]"
1 37 VAL 3.652 0.190 11 0 "[ . 1 . 2]"
1 38 PRO 0.391 0.082 3 0 "[ . 1 . 2]"
1 39 GLU 0.318 0.152 15 0 "[ . 1 . 2]"
1 40 GLY 0.064 0.064 17 0 "[ . 1 . 2]"
1 41 ASP 0.858 0.146 7 0 "[ . 1 . 2]"
1 42 LEU 2.620 0.207 9 0 "[ . 1 . 2]"
1 43 ALA 0.066 0.033 19 0 "[ . 1 . 2]"
1 44 THR 0.919 0.146 7 0 "[ . 1 . 2]"
1 45 HIS 0.061 0.025 17 0 "[ . 1 . 2]"
1 46 ILE 1.669 0.103 11 0 "[ . 1 . 2]"
1 47 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 HIS 0.137 0.108 15 0 "[ . 1 . 2]"
1 53 GLU 0.055 0.031 9 0 "[ . 1 . 2]"
1 54 THR 0.845 0.091 18 0 "[ . 1 . 2]"
1 55 LEU 3.311 0.161 9 0 "[ . 1 . 2]"
1 56 ARG 0.933 0.148 3 0 "[ . 1 . 2]"
1 57 ALA 0.988 0.130 18 0 "[ . 1 . 2]"
1 58 MET 3.907 0.151 15 0 "[ . 1 . 2]"
1 60 LEU 0.484 0.143 10 0 "[ . 1 . 2]"
1 62 GLU 0.195 0.086 12 0 "[ . 1 . 2]"
1 63 SER 0.172 0.037 12 0 "[ . 1 . 2]"
1 64 ALA 1.780 0.143 10 0 "[ . 1 . 2]"
1 65 GLU 0.760 0.070 10 0 "[ . 1 . 2]"
1 66 GLU 2.895 0.187 17 0 "[ . 1 . 2]"
1 67 ALA 4.472 0.187 17 0 "[ . 1 . 2]"
1 68 ILE 1.055 0.108 15 0 "[ . 1 . 2]"
1 69 VAL 1.005 0.144 9 0 "[ . 1 . 2]"
1 70 ALA 0.565 0.064 9 0 "[ . 1 . 2]"
1 71 TYR 3.088 0.161 9 0 "[ . 1 . 2]"
1 72 ARG 2.133 0.164 9 0 "[ . 1 . 2]"
1 73 ALA 1.724 0.164 9 0 "[ . 1 . 2]"
1 74 ASP 0.021 0.021 2 0 "[ . 1 . 2]"
1 75 TYR 0.210 0.068 2 0 "[ . 1 . 2]"
1 76 SER 1.001 0.109 16 0 "[ . 1 . 2]"
1 77 ALA 1.869 0.200 1 0 "[ . 1 . 2]"
1 78 ARG 1.113 0.200 1 0 "[ . 1 . 2]"
1 79 GLY 0.323 0.107 6 0 "[ . 1 . 2]"
1 80 TRP 1.096 0.093 19 0 "[ . 1 . 2]"
1 81 ALA 0.926 0.093 19 0 "[ . 1 . 2]"
1 82 MET 0.897 0.140 16 0 "[ . 1 . 2]"
1 83 ASN 0.692 0.140 16 0 "[ . 1 . 2]"
1 84 SER 2.150 0.150 3 0 "[ . 1 . 2]"
1 85 LEU 3.552 0.177 12 0 "[ . 1 . 2]"
1 86 PHE 0.963 0.217 1 0 "[ . 1 . 2]"
1 87 ASP 0.464 0.116 13 0 "[ . 1 . 2]"
1 88 GLY 0.124 0.044 4 0 "[ . 1 . 2]"
1 89 ILE 3.337 0.193 20 0 "[ . 1 . 2]"
1 90 GLY 1.133 0.193 20 0 "[ . 1 . 2]"
1 91 PRO 1.292 0.082 11 0 "[ . 1 . 2]"
1 92 LEU 6.068 0.150 8 0 "[ . 1 . 2]"
1 93 LEU 0.570 0.093 2 0 "[ . 1 . 2]"
1 94 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ASP 1.220 0.121 11 0 "[ . 1 . 2]"
1 96 LEU 4.304 0.195 16 0 "[ . 1 . 2]"
1 97 ARG 0.991 0.222 6 0 "[ . 1 . 2]"
1 98 THR 1.118 0.096 8 0 "[ . 1 . 2]"
1 99 ALA 1.290 0.117 4 0 "[ . 1 . 2]"
1 100 GLY 1.038 0.119 12 0 "[ . 1 . 2]"
1 101 VAL 1.911 0.222 6 0 "[ . 1 . 2]"
1 102 ARG 0.432 0.078 19 0 "[ . 1 . 2]"
1 103 LEU 0.735 0.078 19 0 "[ . 1 . 2]"
1 104 ALA 1.632 0.159 8 0 "[ . 1 . 2]"
1 105 VAL 4.356 0.186 10 0 "[ . 1 . 2]"
1 106 ALA 1.537 0.153 7 0 "[ . 1 . 2]"
1 107 THR 0.319 0.087 18 0 "[ . 1 . 2]"
1 110 ALA 0.483 0.205 18 0 "[ . 1 . 2]"
1 111 GLU 0.050 0.029 5 0 "[ . 1 . 2]"
1 112 PRO 0.261 0.122 2 0 "[ . 1 . 2]"
1 114 ALA 0.688 0.097 11 0 "[ . 1 . 2]"
1 115 ARG 0.309 0.098 6 0 "[ . 1 . 2]"
1 116 ARG 1.302 0.231 5 0 "[ . 1 . 2]"
1 117 ILE 0.069 0.048 12 0 "[ . 1 . 2]"
1 118 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 ARG 0.768 0.231 5 0 "[ . 1 . 2]"
1 120 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 PHE 3.259 0.177 12 0 "[ . 1 . 2]"
1 122 GLY 0.745 0.109 11 0 "[ . 1 . 2]"
1 123 ILE 0.492 0.072 1 0 "[ . 1 . 2]"
1 124 GLU 1.078 0.107 1 0 "[ . 1 . 2]"
1 125 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 PHE 1.401 0.126 7 0 "[ . 1 . 2]"
1 128 GLU 1.979 0.165 8 0 "[ . 1 . 2]"
1 129 VAL 1.432 0.159 8 0 "[ . 1 . 2]"
1 130 ILE 5.482 0.186 10 0 "[ . 1 . 2]"
1 131 ALA 0.245 0.087 1 0 "[ . 1 . 2]"
1 132 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 ALA 0.273 0.205 18 0 "[ . 1 . 2]"
1 134 SER 0.071 0.071 18 0 "[ . 1 . 2]"
1 145 VAL 0.253 0.087 18 0 "[ . 1 . 2]"
1 146 LEU 5.615 0.161 1 0 "[ . 1 . 2]"
1 147 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 HIS 0.210 0.049 10 0 "[ . 1 . 2]"
1 149 ALA 0.383 0.131 11 0 "[ . 1 . 2]"
1 150 LEU 1.214 0.182 7 0 "[ . 1 . 2]"
1 151 ALA 1.132 0.193 1 0 "[ . 1 . 2]"
1 152 GLN 0.933 0.140 15 0 "[ . 1 . 2]"
1 153 LEU 2.031 0.131 11 0 "[ . 1 . 2]"
1 154 ARG 4.002 0.225 20 0 "[ . 1 . 2]"
1 155 PRO 2.561 0.225 20 0 "[ . 1 . 2]"
1 156 LEU 1.888 0.162 15 0 "[ . 1 . 2]"
1 158 GLU 0.152 0.039 9 0 "[ . 1 . 2]"
1 159 ARG 0.251 0.115 12 0 "[ . 1 . 2]"
1 160 LEU 3.209 0.300 12 0 "[ . 1 . 2]"
1 161 VAL 0.858 0.071 12 0 "[ . 1 . 2]"
1 162 MET 9.628 0.246 3 0 "[ . 1 . 2]"
1 163 VAL 1.909 0.163 2 0 "[ . 1 . 2]"
1 164 GLY 0.047 0.047 2 0 "[ . 1 . 2]"
1 165 ASP 0.609 0.116 6 0 "[ . 1 . 2]"
1 166 ARG 0.202 0.083 1 0 "[ . 1 . 2]"
1 169 ASP 1.429 0.275 6 0 "[ . 1 . 2]"
1 170 VAL 1.432 0.275 6 0 "[ . 1 . 2]"
1 171 ASP 0.454 0.075 3 0 "[ . 1 . 2]"
1 172 GLY 0.418 0.075 3 0 "[ . 1 . 2]"
1 173 ALA 1.500 0.119 1 0 "[ . 1 . 2]"
1 174 ALA 0.664 0.063 13 0 "[ . 1 . 2]"
1 175 ALA 0.018 0.013 13 0 "[ . 1 . 2]"
1 176 HIS 1.916 0.182 7 0 "[ . 1 . 2]"
1 177 GLY 1.865 0.162 18 0 "[ . 1 . 2]"
1 178 ILE 5.020 0.300 12 0 "[ . 1 . 2]"
1 179 ASP 0.105 0.059 6 0 "[ . 1 . 2]"
1 180 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 181 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 185 TRP 2.314 0.094 1 0 "[ . 1 . 2]"
1 187 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 188 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 189 ARG 1.444 0.220 4 0 "[ . 1 . 2]"
1 190 ALA 1.191 0.220 4 0 "[ . 1 . 2]"
1 191 ASP 1.226 0.180 16 0 "[ . 1 . 2]"
1 192 PHE 0.845 0.180 16 0 "[ . 1 . 2]"
1 204 ALA 1.033 0.069 14 0 "[ . 1 . 2]"
1 205 ALA 0.481 0.090 20 0 "[ . 1 . 2]"
1 206 THR 0.549 0.094 1 0 "[ . 1 . 2]"
1 207 ILE 4.079 0.146 15 0 "[ . 1 . 2]"
1 208 ASP 0.609 0.132 5 0 "[ . 1 . 2]"
1 209 GLU 2.191 0.283 5 0 "[ . 1 . 2]"
1 210 LEU 3.124 0.152 18 0 "[ . 1 . 2]"
1 211 ARG 0.711 0.134 3 0 "[ . 1 . 2]"
1 212 GLU 0.658 0.080 5 0 "[ . 1 . 2]"
1 213 ALA 2.492 0.106 11 0 "[ . 1 . 2]"
1 214 LEU 4.850 0.152 18 0 "[ . 1 . 2]"
1 215 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 216 VAL 4.770 0.195 16 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 GLU HA 1 2 GLU QG 3.230 . 3.230 2.609 2.338 3.333 0.103 3 0 "[ . 1 . 2]" 1
2 1 2 GLU HA 1 2 GLU HG3 3.980 . 3.980 3.043 2.444 3.841 . 0 0 "[ . 1 . 2]" 1
3 1 2 GLU HA 1 2 GLU HG2 3.980 . 3.980 3.126 2.372 3.762 . 0 0 "[ . 1 . 2]" 1
4 1 6 LEU HA 1 6 LEU QD 3.550 . 3.550 2.276 1.864 2.907 . 0 0 "[ . 1 . 2]" 1
5 1 6 LEU H 1 6 LEU QD 4.430 . 4.430 3.928 3.093 4.064 . 0 0 "[ . 1 . 2]" 1
6 1 7 VAL H 1 7 VAL HB 4.080 . 4.080 2.730 2.627 2.801 . 0 0 "[ . 1 . 2]" 1
7 1 7 VAL H 1 7 VAL MG2 3.870 . 3.870 2.653 2.528 2.874 . 0 0 "[ . 1 . 2]" 1
8 1 8 ILE HA 1 8 ILE MD 3.740 . 3.740 2.346 1.964 2.913 . 0 0 "[ . 1 . 2]" 1
9 1 8 ILE HA 1 8 ILE QG 3.780 . 3.780 2.708 2.243 3.036 . 0 0 "[ . 1 . 2]" 1
10 1 8 ILE HA 1 8 ILE MG 3.440 . 3.440 2.451 2.299 2.725 . 0 0 "[ . 1 . 2]" 1
11 1 8 ILE HB 1 8 ILE MD 3.290 . 3.290 2.933 2.355 3.245 . 0 0 "[ . 1 . 2]" 1
12 1 8 ILE QG 1 8 ILE MG 3.180 . 3.180 2.231 2.062 2.337 . 0 0 "[ . 1 . 2]" 1
13 1 8 ILE H 1 8 ILE HB 4.080 . 4.080 2.510 2.313 2.663 . 0 0 "[ . 1 . 2]" 1
14 1 8 ILE H 1 8 ILE MD 3.710 . 3.710 3.179 2.236 3.696 . 0 0 "[ . 1 . 2]" 1
15 1 8 ILE H 1 8 ILE QG 4.060 . 4.060 2.910 2.315 3.827 . 0 0 "[ . 1 . 2]" 1
16 1 9 PHE HA 1 9 PHE QD 4.010 . 4.010 2.806 2.470 3.101 . 0 0 "[ . 1 . 2]" 1
17 1 9 PHE H 1 9 PHE QD 4.060 . 4.060 3.048 2.571 3.557 . 0 0 "[ . 1 . 2]" 1
18 1 14 THR H 1 14 THR HB 4.200 . 4.200 2.548 2.371 2.876 . 0 0 "[ . 1 . 2]" 1
19 1 16 THR HA 1 16 THR MG 3.250 . 3.250 2.303 2.195 2.402 . 0 0 "[ . 1 . 2]" 1
20 1 16 THR H 1 16 THR MG 4.060 . 4.060 3.383 2.515 4.040 . 0 0 "[ . 1 . 2]" 1
21 1 17 ASP H 1 17 ASP QB 3.860 . 3.860 2.369 2.274 2.740 . 0 0 "[ . 1 . 2]" 1
22 1 19 ALA H 1 19 ALA MB 3.420 . 3.420 2.241 2.211 2.277 . 0 0 "[ . 1 . 2]" 1
23 1 20 ARG HA 1 20 ARG QD 4.000 . 4.000 2.781 1.887 4.174 0.174 7 0 "[ . 1 . 2]" 1
24 1 20 ARG HA 1 20 ARG QG 3.510 . 3.510 2.744 2.290 3.177 . 0 0 "[ . 1 . 2]" 1
25 1 20 ARG HA 1 20 ARG HG3 4.250 . 4.250 3.502 2.732 3.849 . 0 0 "[ . 1 . 2]" 1
26 1 20 ARG HA 1 20 ARG HG2 4.250 . 4.250 2.885 2.366 3.384 . 0 0 "[ . 1 . 2]" 1
27 1 20 ARG QB 1 20 ARG QD 2.650 . 2.650 2.387 2.088 2.757 0.107 12 0 "[ . 1 . 2]" 1
28 1 20 ARG H 1 20 ARG QB 3.390 . 3.390 2.495 2.320 2.749 . 0 0 "[ . 1 . 2]" 1
29 1 20 ARG H 1 20 ARG QG 3.630 . 3.630 2.148 1.831 2.516 . 0 0 "[ . 1 . 2]" 1
30 1 22 ILE HA 1 22 ILE MG 3.490 . 3.490 2.437 2.384 2.506 . 0 0 "[ . 1 . 2]" 1
31 1 22 ILE H 1 22 ILE HB 3.960 . 3.960 2.486 2.392 2.562 . 0 0 "[ . 1 . 2]" 1
32 1 22 ILE H 1 22 ILE MD 4.340 . 4.340 3.614 3.212 3.725 . 0 0 "[ . 1 . 2]" 1
33 1 22 ILE H 1 22 ILE MG 4.190 . 4.190 3.771 3.745 3.791 . 0 0 "[ . 1 . 2]" 1
34 1 23 VAL HA 1 23 VAL QG 3.110 . 3.110 2.164 2.115 2.320 . 0 0 "[ . 1 . 2]" 1
35 1 23 VAL HA 1 23 VAL MG1 3.550 . 3.550 2.599 2.393 3.224 . 0 0 "[ . 1 . 2]" 1
36 1 23 VAL HA 1 23 VAL MG2 3.550 . 3.550 2.349 2.306 2.384 . 0 0 "[ . 1 . 2]" 1
37 1 23 VAL H 1 23 VAL HB 3.630 . 3.630 2.521 2.386 2.599 . 0 0 "[ . 1 . 2]" 1
38 1 23 VAL H 1 23 VAL QG 3.260 . 3.260 2.109 1.985 2.335 . 0 0 "[ . 1 . 2]" 1
39 1 23 VAL H 1 23 VAL MG1 3.790 . 3.790 3.465 2.129 3.786 . 0 0 "[ . 1 . 2]" 1
40 1 23 VAL H 1 23 VAL MG2 3.790 . 3.790 2.426 1.993 3.754 . 0 0 "[ . 1 . 2]" 1
41 1 24 SER H 1 24 SER QB 3.460 . 3.460 2.424 2.234 2.559 . 0 0 "[ . 1 . 2]" 1
42 1 26 PHE HA 1 26 PHE QD 3.790 . 3.790 3.029 2.710 3.424 . 0 0 "[ . 1 . 2]" 1
43 1 26 PHE H 1 26 PHE HB3 3.890 . 3.890 2.087 2.053 2.128 . 0 0 "[ . 1 . 2]" 1
44 1 26 PHE H 1 26 PHE HB2 3.890 . 3.890 3.075 2.870 3.400 . 0 0 "[ . 1 . 2]" 1
45 1 26 PHE H 1 26 PHE QD 3.830 . 3.830 3.737 3.234 3.961 0.131 1 0 "[ . 1 . 2]" 1
46 1 27 ARG HA 1 27 ARG QD 4.140 . 4.140 4.068 3.781 4.225 0.085 10 0 "[ . 1 . 2]" 1
47 1 27 ARG HA 1 27 ARG QG 3.720 . 3.720 2.400 2.317 2.495 . 0 0 "[ . 1 . 2]" 1
48 1 27 ARG H 1 27 ARG QB 3.730 . 3.730 2.418 2.278 2.596 . 0 0 "[ . 1 . 2]" 1
49 1 27 ARG H 1 27 ARG QG 4.090 . 4.090 2.314 2.066 2.560 . 0 0 "[ . 1 . 2]" 1
50 1 28 HIS H 1 28 HIS HB3 3.650 . 3.650 3.452 2.696 3.617 . 0 0 "[ . 1 . 2]" 1
51 1 28 HIS H 1 28 HIS HB2 3.650 . 3.650 2.354 2.055 2.462 . 0 0 "[ . 1 . 2]" 1
52 1 29 ALA H 1 29 ALA MB 3.280 . 3.280 2.224 2.210 2.239 . 0 0 "[ . 1 . 2]" 1
53 1 30 LEU HA 1 30 LEU HG 3.910 . 3.910 3.037 2.898 3.151 . 0 0 "[ . 1 . 2]" 1
54 1 30 LEU H 1 30 LEU HG 3.430 . 3.430 2.607 2.452 2.811 . 0 0 "[ . 1 . 2]" 1
55 1 31 ASN H 1 31 ASN QB 3.120 . 3.120 2.265 2.236 2.294 . 0 0 "[ . 1 . 2]" 1
56 1 31 ASN H 1 31 ASN HB3 3.570 . 3.570 2.586 2.443 2.708 . 0 0 "[ . 1 . 2]" 1
57 1 31 ASN H 1 31 ASN HB2 3.570 . 3.570 2.511 2.442 2.625 . 0 0 "[ . 1 . 2]" 1
58 1 32 HIS H 1 32 HIS QB 3.230 . 3.230 2.228 2.105 2.277 . 0 0 "[ . 1 . 2]" 1
59 1 32 HIS H 1 32 HIS HB3 3.790 . 3.790 2.508 2.269 3.425 . 0 0 "[ . 1 . 2]" 1
60 1 32 HIS H 1 32 HIS HB2 3.790 . 3.790 2.574 2.125 2.755 . 0 0 "[ . 1 . 2]" 1
61 1 33 ILE HA 1 33 ILE MD 4.390 . 4.390 4.180 4.166 4.191 . 0 0 "[ . 1 . 2]" 1
62 1 33 ILE HA 1 33 ILE MG 3.140 . 3.140 2.336 2.287 2.385 . 0 0 "[ . 1 . 2]" 1
63 1 33 ILE HB 1 33 ILE MD 3.440 . 3.440 2.433 2.391 2.484 . 0 0 "[ . 1 . 2]" 1
64 1 33 ILE MD 1 33 ILE MG 2.990 . 2.990 1.912 1.855 1.982 . 0 0 "[ . 1 . 2]" 1
65 1 33 ILE H 1 33 ILE HB 4.180 . 4.180 3.704 3.667 3.736 . 0 0 "[ . 1 . 2]" 1
66 1 33 ILE H 1 33 ILE MD 3.980 . 3.980 3.698 3.601 3.767 . 0 0 "[ . 1 . 2]" 1
67 1 33 ILE H 1 33 ILE MG 3.750 . 3.750 2.505 2.254 2.673 . 0 0 "[ . 1 . 2]" 1
68 1 35 ALA H 1 35 ALA MB 3.280 . 3.280 2.384 2.300 2.578 . 0 0 "[ . 1 . 2]" 1
69 1 37 VAL HA 1 37 VAL MG1 3.460 . 3.460 2.579 2.341 3.212 . 0 0 "[ . 1 . 2]" 1
70 1 37 VAL HA 1 37 VAL MG2 3.460 . 3.460 2.439 2.403 2.551 . 0 0 "[ . 1 . 2]" 1
71 1 37 VAL H 1 37 VAL HB 3.810 . 3.810 2.906 2.526 3.636 . 0 0 "[ . 1 . 2]" 1
72 1 37 VAL H 1 37 VAL QG 3.040 . 3.040 2.539 2.247 2.932 . 0 0 "[ . 1 . 2]" 1
73 1 37 VAL H 1 37 VAL MG1 3.950 . 3.950 3.519 2.442 3.963 0.013 18 0 "[ . 1 . 2]" 1
74 1 37 VAL H 1 37 VAL MG2 3.950 . 3.950 2.942 2.264 3.961 0.011 12 0 "[ . 1 . 2]" 1
75 1 39 GLU HA 1 39 GLU QG 3.500 . 3.500 3.045 2.293 3.458 . 0 0 "[ . 1 . 2]" 1
76 1 39 GLU HA 1 39 GLU HG3 4.070 . 4.070 3.657 2.958 4.222 0.152 15 0 "[ . 1 . 2]" 1
77 1 39 GLU HA 1 39 GLU HG2 4.070 . 4.070 3.305 2.361 3.823 . 0 0 "[ . 1 . 2]" 1
78 1 39 GLU H 1 39 GLU QB 2.980 . 2.980 2.674 2.355 2.976 . 0 0 "[ . 1 . 2]" 1
79 1 39 GLU H 1 39 GLU HB3 3.770 . 3.770 3.233 2.672 3.823 0.053 7 0 "[ . 1 . 2]" 1
80 1 39 GLU H 1 39 GLU HB2 3.770 . 3.770 3.191 2.386 3.763 . 0 0 "[ . 1 . 2]" 1
81 1 39 GLU H 1 39 GLU QG 3.170 . 3.170 2.348 1.749 3.219 0.049 7 0 "[ . 1 . 2]" 1
82 1 42 LEU HA 1 42 LEU QD 3.420 . 3.420 1.793 1.697 1.868 0.003 7 0 "[ . 1 . 2]" 1
83 1 42 LEU HA 1 42 LEU HG 4.190 . 4.190 3.598 3.137 3.660 . 0 0 "[ . 1 . 2]" 1
84 1 44 THR H 1 44 THR HB 3.790 . 3.790 2.644 2.488 2.812 . 0 0 "[ . 1 . 2]" 1
85 1 44 THR H 1 44 THR MG 3.600 . 3.600 2.033 1.857 2.226 . 0 0 "[ . 1 . 2]" 1
86 1 45 HIS H 1 45 HIS QB 3.190 . 3.190 2.269 2.138 2.342 . 0 0 "[ . 1 . 2]" 1
87 1 46 ILE HA 1 46 ILE MG 3.620 . 3.620 2.314 2.214 2.353 . 0 0 "[ . 1 . 2]" 1
88 1 46 ILE MD 1 46 ILE MG 3.280 . 3.280 1.907 1.867 1.950 . 0 0 "[ . 1 . 2]" 1
89 1 46 ILE H 1 46 ILE MG 3.690 . 3.690 2.608 2.428 2.864 . 0 0 "[ . 1 . 2]" 1
90 1 53 GLU HA 1 53 GLU QG 3.390 . 3.390 2.761 2.274 3.116 . 0 0 "[ . 1 . 2]" 1
91 1 53 GLU H 1 53 GLU QG 4.050 . 4.050 3.105 2.129 4.081 0.031 9 0 "[ . 1 . 2]" 1
92 1 54 THR HA 1 54 THR MG 3.430 . 3.430 2.372 2.324 2.446 . 0 0 "[ . 1 . 2]" 1
93 1 54 THR H 1 54 THR HB 3.650 . 3.650 2.597 2.481 2.679 . 0 0 "[ . 1 . 2]" 1
94 1 54 THR H 1 54 THR MG 3.860 . 3.860 3.755 3.730 3.772 . 0 0 "[ . 1 . 2]" 1
95 1 55 LEU HA 1 55 LEU HG 3.370 . 3.370 3.091 2.944 3.263 . 0 0 "[ . 1 . 2]" 1
96 1 55 LEU H 1 55 LEU QB 3.670 . 3.670 2.208 2.156 2.244 . 0 0 "[ . 1 . 2]" 1
97 1 55 LEU H 1 55 LEU QD 4.090 . 4.090 3.660 3.546 3.712 . 0 0 "[ . 1 . 2]" 1
98 1 55 LEU H 1 55 LEU HG 4.560 . 4.560 4.500 4.437 4.538 . 0 0 "[ . 1 . 2]" 1
99 1 56 ARG HA 1 56 ARG QD 4.020 . 4.020 3.303 1.946 4.168 0.148 3 0 "[ . 1 . 2]" 1
100 1 56 ARG HA 1 56 ARG QG 3.820 . 3.820 2.516 2.232 3.306 . 0 0 "[ . 1 . 2]" 1
101 1 56 ARG H 1 56 ARG QB 3.590 . 3.590 2.238 2.053 2.402 . 0 0 "[ . 1 . 2]" 1
102 1 57 ALA H 1 57 ALA MB 3.300 . 3.300 2.287 2.247 2.324 . 0 0 "[ . 1 . 2]" 1
103 1 58 MET HA 1 58 MET ME 3.680 . 3.680 3.398 2.935 3.831 0.151 15 0 "[ . 1 . 2]" 1
104 1 58 MET HA 1 58 MET HG3 3.840 . 3.840 3.519 3.050 3.773 . 0 0 "[ . 1 . 2]" 1
105 1 58 MET HA 1 58 MET HG2 3.840 . 3.840 2.814 2.368 3.881 0.041 11 0 "[ . 1 . 2]" 1
106 1 58 MET QB 1 58 MET ME 3.220 . 3.220 1.915 1.653 2.093 0.047 15 0 "[ . 1 . 2]" 1
107 1 58 MET ME 1 58 MET HG3 3.610 . 3.610 2.819 2.439 3.398 . 0 0 "[ . 1 . 2]" 1
108 1 58 MET ME 1 58 MET HG2 3.610 . 3.610 3.079 2.425 3.410 . 0 0 "[ . 1 . 2]" 1
109 1 58 MET H 1 58 MET QB 3.810 . 3.810 2.432 2.310 3.011 . 0 0 "[ . 1 . 2]" 1
110 1 58 MET H 1 58 MET HG3 3.860 . 3.860 3.291 2.529 3.919 0.059 5 0 "[ . 1 . 2]" 1
111 1 58 MET H 1 58 MET HG2 3.860 . 3.860 2.918 2.214 3.841 . 0 0 "[ . 1 . 2]" 1
112 1 62 GLU HA 1 62 GLU QG 3.420 . 3.420 2.703 2.347 3.506 0.086 12 0 "[ . 1 . 2]" 1
113 1 64 ALA H 1 64 ALA MB 2.990 . 2.990 2.230 2.214 2.245 . 0 0 "[ . 1 . 2]" 1
114 1 65 GLU H 1 65 GLU QB 3.280 . 3.280 2.511 2.329 2.773 . 0 0 "[ . 1 . 2]" 1
115 1 65 GLU H 1 65 GLU HB3 3.800 . 3.800 3.518 2.789 3.627 . 0 0 "[ . 1 . 2]" 1
116 1 65 GLU H 1 65 GLU HB2 3.800 . 3.800 2.643 2.360 3.598 . 0 0 "[ . 1 . 2]" 1
117 1 65 GLU H 1 65 GLU QG 3.240 . 3.240 2.168 1.739 2.477 . 0 0 "[ . 1 . 2]" 1
118 1 65 GLU H 1 65 GLU HG3 3.850 . 3.850 2.928 2.031 3.707 . 0 0 "[ . 1 . 2]" 1
119 1 65 GLU H 1 65 GLU HG2 3.850 . 3.850 2.688 1.754 3.516 . 0 0 "[ . 1 . 2]" 1
120 1 66 GLU HA 1 66 GLU QG 3.290 . 3.290 2.805 2.514 3.141 . 0 0 "[ . 1 . 2]" 1
121 1 66 GLU H 1 66 GLU HB3 3.450 . 3.450 2.356 2.255 2.450 . 0 0 "[ . 1 . 2]" 1
122 1 66 GLU H 1 66 GLU HB2 3.450 . 3.450 2.659 2.433 2.816 . 0 0 "[ . 1 . 2]" 1
123 1 66 GLU H 1 66 GLU QG 4.070 . 4.070 3.932 3.872 3.988 . 0 0 "[ . 1 . 2]" 1
124 1 67 ALA H 1 67 ALA MB 3.220 . 3.220 2.224 2.213 2.233 . 0 0 "[ . 1 . 2]" 1
125 1 68 ILE HA 1 68 ILE MD 3.950 . 3.950 1.907 1.859 2.002 . 0 0 "[ . 1 . 2]" 1
126 1 68 ILE HA 1 68 ILE MG 3.700 . 3.700 2.802 2.451 3.220 . 0 0 "[ . 1 . 2]" 1
127 1 68 ILE HB 1 68 ILE MD 3.600 . 3.600 2.894 2.358 3.244 . 0 0 "[ . 1 . 2]" 1
128 1 68 ILE H 1 68 ILE HB 3.600 . 3.600 2.433 2.364 2.520 . 0 0 "[ . 1 . 2]" 1
129 1 68 ILE H 1 68 ILE MD 4.310 . 4.310 3.635 3.317 4.049 . 0 0 "[ . 1 . 2]" 1
130 1 68 ILE H 1 68 ILE MG 3.950 . 3.950 3.182 2.208 3.770 . 0 0 "[ . 1 . 2]" 1
131 1 69 VAL HA 1 69 VAL MG1 3.300 . 3.300 3.101 2.392 3.229 . 0 0 "[ . 1 . 2]" 1
132 1 69 VAL HA 1 69 VAL MG2 3.300 . 3.300 2.375 2.291 3.200 . 0 0 "[ . 1 . 2]" 1
133 1 69 VAL H 1 69 VAL HB 3.500 . 3.500 2.647 2.515 3.644 0.144 9 0 "[ . 1 . 2]" 1
134 1 69 VAL H 1 69 VAL QG 3.020 . 3.020 2.135 1.911 2.217 . 0 0 "[ . 1 . 2]" 1
135 1 69 VAL H 1 69 VAL MG1 3.810 . 3.810 2.322 2.076 3.787 . 0 0 "[ . 1 . 2]" 1
136 1 69 VAL H 1 69 VAL MG2 3.810 . 3.810 3.556 2.017 3.817 0.007 14 0 "[ . 1 . 2]" 1
137 1 70 ALA H 1 70 ALA MB 3.220 . 3.220 2.243 2.230 2.257 . 0 0 "[ . 1 . 2]" 1
138 1 71 TYR HA 1 71 TYR QD 3.530 . 3.530 2.925 2.821 3.089 . 0 0 "[ . 1 . 2]" 1
139 1 71 TYR H 1 71 TYR QB 3.400 . 3.400 2.193 2.170 2.215 . 0 0 "[ . 1 . 2]" 1
140 1 71 TYR H 1 71 TYR HB3 3.870 . 3.870 2.374 2.280 2.512 . 0 0 "[ . 1 . 2]" 1
141 1 71 TYR H 1 71 TYR HB2 3.870 . 3.870 2.593 2.391 2.748 . 0 0 "[ . 1 . 2]" 1
142 1 71 TYR H 1 71 TYR QD 4.050 . 4.050 4.139 4.096 4.164 0.114 11 0 "[ . 1 . 2]" 1
143 1 72 ARG H 1 72 ARG QB 3.510 . 3.510 2.342 2.019 2.615 . 0 0 "[ . 1 . 2]" 1
144 1 72 ARG H 1 72 ARG QD 3.950 . 3.950 3.652 3.246 4.107 0.157 10 0 "[ . 1 . 2]" 1
145 1 72 ARG H 1 72 ARG QG 4.020 . 4.020 2.421 1.991 3.708 . 0 0 "[ . 1 . 2]" 1
146 1 73 ALA H 1 73 ALA MB 2.970 . 2.970 2.213 2.191 2.231 . 0 0 "[ . 1 . 2]" 1
147 1 75 TYR HA 1 75 TYR QD 4.210 . 4.210 2.796 2.384 3.140 . 0 0 "[ . 1 . 2]" 1
148 1 75 TYR H 1 75 TYR QB 3.680 . 3.680 2.244 2.136 2.300 . 0 0 "[ . 1 . 2]" 1
149 1 76 SER H 1 76 SER QB 3.100 . 3.100 2.403 2.248 2.528 . 0 0 "[ . 1 . 2]" 1
150 1 77 ALA H 1 77 ALA MB 2.990 . 2.990 2.316 2.275 2.351 . 0 0 "[ . 1 . 2]" 1
151 1 78 ARG H 1 78 ARG QB 3.660 . 3.660 2.469 2.243 2.908 . 0 0 "[ . 1 . 2]" 1
152 1 80 TRP H 1 80 TRP HD1 3.660 . 3.660 2.236 2.098 2.362 . 0 0 "[ . 1 . 2]" 1
153 1 80 TRP H 1 80 TRP HE1 4.660 . 4.660 4.403 4.188 4.617 . 0 0 "[ . 1 . 2]" 1
154 1 82 MET QB 1 82 MET ME 2.770 . 2.770 2.182 1.766 2.820 0.050 2 0 "[ . 1 . 2]" 1
155 1 82 MET H 1 82 MET QB 3.580 . 3.580 2.509 2.351 3.301 . 0 0 "[ . 1 . 2]" 1
156 1 82 MET H 1 82 MET ME 4.470 . 4.470 4.005 3.376 4.589 0.119 1 0 "[ . 1 . 2]" 1
157 1 83 ASN H 1 83 ASN QB 3.500 . 3.500 2.833 2.321 3.312 . 0 0 "[ . 1 . 2]" 1
158 1 85 LEU HA 1 85 LEU QD 3.590 . 3.590 3.258 1.905 3.434 . 0 0 "[ . 1 . 2]" 1
159 1 85 LEU HA 1 85 LEU HG 3.880 . 3.880 3.650 2.864 3.794 . 0 0 "[ . 1 . 2]" 1
160 1 85 LEU QB 1 85 LEU QD 2.820 . 2.820 1.901 1.872 1.940 . 0 0 "[ . 1 . 2]" 1
161 1 85 LEU H 1 85 LEU QB 3.220 . 3.220 2.903 2.256 3.254 0.034 1 0 "[ . 1 . 2]" 1
162 1 85 LEU H 1 85 LEU HB3 3.890 . 3.890 3.156 2.653 3.580 . 0 0 "[ . 1 . 2]" 1
163 1 85 LEU H 1 85 LEU HB2 3.890 . 3.890 3.647 2.282 3.982 0.092 6 0 "[ . 1 . 2]" 1
164 1 85 LEU H 1 85 LEU HG 3.980 . 3.980 2.333 1.784 2.940 . 0 0 "[ . 1 . 2]" 1
165 1 86 PHE HA 1 86 PHE QD 3.790 . 3.790 2.996 2.083 3.740 . 0 0 "[ . 1 . 2]" 1
166 1 86 PHE H 1 86 PHE QB 3.620 . 3.620 2.604 2.175 3.272 . 0 0 "[ . 1 . 2]" 1
167 1 86 PHE H 1 86 PHE QD 3.850 . 3.850 2.918 2.137 4.067 0.217 1 0 "[ . 1 . 2]" 1
168 1 87 ASP H 1 87 ASP QB 3.510 . 3.510 2.477 2.069 2.962 . 0 0 "[ . 1 . 2]" 1
169 1 89 ILE HA 1 89 ILE MD 3.260 . 3.260 2.339 1.932 2.992 . 0 0 "[ . 1 . 2]" 1
170 1 89 ILE HA 1 89 ILE QG 3.460 . 3.460 2.697 2.264 3.049 . 0 0 "[ . 1 . 2]" 1
171 1 89 ILE HA 1 89 ILE HG13 4.250 . 4.250 3.168 2.290 3.755 . 0 0 "[ . 1 . 2]" 1
172 1 89 ILE HA 1 89 ILE HG12 4.250 . 4.250 3.303 3.019 3.616 . 0 0 "[ . 1 . 2]" 1
173 1 89 ILE HB 1 89 ILE MD 3.610 . 3.610 2.896 2.335 3.242 . 0 0 "[ . 1 . 2]" 1
174 1 89 ILE H 1 89 ILE HB 3.460 . 3.460 2.494 2.323 2.620 . 0 0 "[ . 1 . 2]" 1
175 1 89 ILE H 1 89 ILE MD 3.640 . 3.640 2.612 1.718 3.353 . 0 0 "[ . 1 . 2]" 1
176 1 89 ILE H 1 89 ILE QG 3.450 . 3.450 2.557 1.989 3.382 . 0 0 "[ . 1 . 2]" 1
177 1 89 ILE H 1 89 ILE HG13 4.100 . 4.100 3.565 3.373 3.708 . 0 0 "[ . 1 . 2]" 1
178 1 89 ILE H 1 89 ILE HG12 4.100 . 4.100 2.816 2.000 3.967 . 0 0 "[ . 1 . 2]" 1
179 1 89 ILE H 1 89 ILE MG 3.900 . 3.900 3.754 3.703 3.796 . 0 0 "[ . 1 . 2]" 1
180 1 92 LEU HA 1 92 LEU HG 3.790 . 3.790 2.990 2.810 3.096 . 0 0 "[ . 1 . 2]" 1
181 1 92 LEU H 1 92 LEU QB 3.870 . 3.870 2.243 2.214 2.272 . 0 0 "[ . 1 . 2]" 1
182 1 93 LEU HA 1 93 LEU QD 3.770 . 3.770 2.072 1.774 2.450 . 0 0 "[ . 1 . 2]" 1
183 1 93 LEU H 1 93 LEU QD 3.790 . 3.790 2.897 2.233 3.646 . 0 0 "[ . 1 . 2]" 1
184 1 94 ALA H 1 94 ALA MB 3.060 . 3.060 2.239 2.227 2.249 . 0 0 "[ . 1 . 2]" 1
185 1 95 ASP H 1 95 ASP HB3 3.640 . 3.640 3.408 2.737 3.613 . 0 0 "[ . 1 . 2]" 1
186 1 95 ASP H 1 95 ASP HB2 3.640 . 3.640 2.390 2.126 3.639 . 0 0 "[ . 1 . 2]" 1
187 1 96 LEU HA 1 96 LEU QD 3.250 . 3.250 2.181 1.913 2.705 . 0 0 "[ . 1 . 2]" 1
188 1 96 LEU H 1 96 LEU QD 3.580 . 3.580 2.769 2.088 3.197 . 0 0 "[ . 1 . 2]" 1
189 1 96 LEU H 1 96 LEU MD1 4.340 . 4.340 3.141 2.096 3.901 . 0 0 "[ . 1 . 2]" 1
190 1 96 LEU H 1 96 LEU MD2 4.340 . 4.340 3.549 2.158 4.186 . 0 0 "[ . 1 . 2]" 1
191 1 97 ARG H 1 97 ARG QB 3.410 . 3.410 2.231 2.083 2.431 . 0 0 "[ . 1 . 2]" 1
192 1 98 THR HA 1 98 THR MG 2.990 . 2.990 2.415 2.386 2.468 . 0 0 "[ . 1 . 2]" 1
193 1 98 THR H 1 98 THR HB 3.310 . 3.310 2.508 2.444 2.560 . 0 0 "[ . 1 . 2]" 1
194 1 98 THR H 1 98 THR MG 3.840 . 3.840 3.749 3.728 3.767 . 0 0 "[ . 1 . 2]" 1
195 1 99 ALA H 1 99 ALA MB 3.140 . 3.140 2.235 2.223 2.257 . 0 0 "[ . 1 . 2]" 1
196 1 101 VAL HA 1 101 VAL QG 2.990 . 2.990 2.248 2.119 2.309 . 0 0 "[ . 1 . 2]" 1
197 1 101 VAL HA 1 101 VAL MG1 3.430 . 3.430 3.036 2.265 3.224 . 0 0 "[ . 1 . 2]" 1
198 1 101 VAL HA 1 101 VAL MG2 3.430 . 3.430 2.363 2.286 2.550 . 0 0 "[ . 1 . 2]" 1
199 1 101 VAL H 1 101 VAL HB 3.560 . 3.560 2.646 2.512 2.732 . 0 0 "[ . 1 . 2]" 1
200 1 101 VAL H 1 101 VAL QG 3.250 . 3.250 2.056 1.941 2.194 . 0 0 "[ . 1 . 2]" 1
201 1 101 VAL H 1 101 VAL MG1 4.010 . 4.010 2.408 1.963 3.798 . 0 0 "[ . 1 . 2]" 1
202 1 101 VAL H 1 101 VAL MG2 4.010 . 4.010 3.455 1.947 3.817 . 0 0 "[ . 1 . 2]" 1
203 1 102 ARG H 1 102 ARG QB 3.920 . 3.920 2.392 2.128 2.666 . 0 0 "[ . 1 . 2]" 1
204 1 103 LEU H 1 103 LEU QD 4.310 . 4.310 2.459 1.893 3.322 . 0 0 "[ . 1 . 2]" 1
205 1 104 ALA H 1 104 ALA MB 3.610 . 3.610 2.677 2.549 2.766 . 0 0 "[ . 1 . 2]" 1
206 1 105 VAL HA 1 105 VAL MG1 3.420 . 3.420 2.672 2.215 3.225 . 0 0 "[ . 1 . 2]" 1
207 1 105 VAL HA 1 105 VAL MG2 3.420 . 3.420 2.524 2.215 3.208 . 0 0 "[ . 1 . 2]" 1
208 1 105 VAL H 1 105 VAL MG1 3.930 . 3.930 3.178 1.976 3.909 . 0 0 "[ . 1 . 2]" 1
209 1 105 VAL H 1 105 VAL MG2 3.930 . 3.930 2.977 2.072 3.973 0.043 16 0 "[ . 1 . 2]" 1
210 1 110 ALA H 1 110 ALA MB 3.360 . 3.360 2.632 2.221 2.972 . 0 0 "[ . 1 . 2]" 1
211 1 121 PHE H 1 121 PHE QD 4.020 . 4.020 2.913 2.211 3.274 . 0 0 "[ . 1 . 2]" 1
212 1 123 ILE HB 1 123 ILE MD 3.670 . 3.670 2.557 2.396 3.251 . 0 0 "[ . 1 . 2]" 1
213 1 123 ILE MD 1 123 ILE MG 2.730 . 2.730 1.930 1.869 1.976 . 0 0 "[ . 1 . 2]" 1
214 1 123 ILE H 1 123 ILE MD 4.210 . 4.210 3.416 1.640 3.833 0.060 18 0 "[ . 1 . 2]" 1
215 1 123 ILE H 1 123 ILE QG 4.130 . 4.130 2.163 1.883 3.108 . 0 0 "[ . 1 . 2]" 1
216 1 123 ILE H 1 123 ILE MG 4.060 . 4.060 2.734 2.356 2.892 . 0 0 "[ . 1 . 2]" 1
217 1 125 GLN HA 1 125 GLN QG 3.850 . 3.850 2.631 2.311 3.486 . 0 0 "[ . 1 . 2]" 1
218 1 125 GLN H 1 125 GLN QG 4.610 . 4.610 3.017 1.774 4.068 . 0 0 "[ . 1 . 2]" 1
219 1 127 PHE HA 1 127 PHE QD 3.950 . 3.950 2.681 2.292 2.979 . 0 0 "[ . 1 . 2]" 1
220 1 127 PHE H 1 127 PHE HB3 4.070 . 4.070 3.665 3.534 3.746 . 0 0 "[ . 1 . 2]" 1
221 1 127 PHE H 1 127 PHE HB2 3.740 . 3.740 2.469 2.266 2.588 . 0 0 "[ . 1 . 2]" 1
222 1 128 GLU H 1 128 GLU HB3 3.650 . 3.650 2.574 2.335 2.787 . 0 0 "[ . 1 . 2]" 1
223 1 128 GLU H 1 128 GLU HB2 3.580 . 3.580 2.500 2.246 2.838 . 0 0 "[ . 1 . 2]" 1
224 1 128 GLU H 1 128 GLU QG 4.680 . 4.680 4.020 3.942 4.095 . 0 0 "[ . 1 . 2]" 1
225 1 129 VAL HA 1 129 VAL QG 2.960 . 2.960 2.156 2.127 2.236 . 0 0 "[ . 1 . 2]" 1
226 1 129 VAL HA 1 129 VAL MG1 3.520 . 3.520 2.568 2.369 3.217 . 0 0 "[ . 1 . 2]" 1
227 1 129 VAL HA 1 129 VAL MG2 3.520 . 3.520 2.373 2.218 2.438 . 0 0 "[ . 1 . 2]" 1
228 1 129 VAL H 1 129 VAL HB 3.700 . 3.700 2.791 2.591 3.191 . 0 0 "[ . 1 . 2]" 1
229 1 129 VAL H 1 129 VAL QG 3.370 . 3.370 2.678 2.393 2.863 . 0 0 "[ . 1 . 2]" 1
230 1 129 VAL H 1 129 VAL MG1 3.950 . 3.950 3.607 2.413 3.923 . 0 0 "[ . 1 . 2]" 1
231 1 129 VAL H 1 129 VAL MG2 3.950 . 3.950 3.026 2.522 4.011 0.061 4 0 "[ . 1 . 2]" 1
232 1 130 ILE HB 1 130 ILE MD 3.370 . 3.370 3.054 2.276 3.248 . 0 0 "[ . 1 . 2]" 1
233 1 130 ILE MD 1 130 ILE MG 3.080 . 3.080 2.237 1.902 3.221 0.141 16 0 "[ . 1 . 2]" 1
234 1 130 ILE H 1 130 ILE HB 3.650 . 3.650 2.680 2.430 2.782 . 0 0 "[ . 1 . 2]" 1
235 1 130 ILE H 1 130 ILE MD 3.830 . 3.830 3.044 2.097 3.528 . 0 0 "[ . 1 . 2]" 1
236 1 131 ALA H 1 131 ALA MB 3.490 . 3.490 2.373 2.286 2.639 . 0 0 "[ . 1 . 2]" 1
237 1 133 ALA H 1 133 ALA MB 3.420 . 3.420 2.370 2.229 2.908 . 0 0 "[ . 1 . 2]" 1
238 1 145 VAL H 1 145 VAL QG 3.940 . 3.940 1.895 1.802 2.073 . 0 0 "[ . 1 . 2]" 1
239 1 146 LEU HA 1 146 LEU QD 2.920 . 2.920 2.009 1.922 2.084 . 0 0 "[ . 1 . 2]" 1
240 1 146 LEU HA 1 146 LEU HG 4.270 . 4.270 2.952 2.816 3.068 . 0 0 "[ . 1 . 2]" 1
241 1 147 ALA H 1 147 ALA MB 3.090 . 3.090 2.237 2.224 2.248 . 0 0 "[ . 1 . 2]" 1
242 1 148 HIS H 1 148 HIS HB3 3.560 . 3.560 2.925 2.477 3.609 0.049 10 0 "[ . 1 . 2]" 1
243 1 148 HIS H 1 148 HIS HB2 3.560 . 3.560 2.412 2.130 2.557 . 0 0 "[ . 1 . 2]" 1
244 1 149 ALA H 1 149 ALA MB 3.480 . 3.480 2.236 2.218 2.251 . 0 0 "[ . 1 . 2]" 1
245 1 150 LEU HA 1 150 LEU QD 3.200 . 3.200 2.319 1.952 2.538 . 0 0 "[ . 1 . 2]" 1
246 1 150 LEU H 1 150 LEU QD 3.640 . 3.640 2.521 2.211 3.106 . 0 0 "[ . 1 . 2]" 1
247 1 150 LEU H 1 150 LEU MD1 4.260 . 4.260 2.649 2.227 3.657 . 0 0 "[ . 1 . 2]" 1
248 1 150 LEU H 1 150 LEU MD2 4.260 . 4.260 3.799 3.259 4.037 . 0 0 "[ . 1 . 2]" 1
249 1 151 ALA H 1 151 ALA MB 3.010 . 3.010 2.244 2.229 2.280 . 0 0 "[ . 1 . 2]" 1
250 1 152 GLN HA 1 152 GLN HG3 3.960 . 3.960 3.259 2.339 3.754 . 0 0 "[ . 1 . 2]" 1
251 1 152 GLN HA 1 152 GLN HG2 3.960 . 3.960 3.285 2.574 3.774 . 0 0 "[ . 1 . 2]" 1
252 1 152 GLN H 1 152 GLN QB 3.460 . 3.460 2.307 2.088 2.463 . 0 0 "[ . 1 . 2]" 1
253 1 152 GLN H 1 152 GLN QG 3.890 . 3.890 3.109 2.226 4.030 0.140 15 0 "[ . 1 . 2]" 1
254 1 152 GLN H 1 152 GLN HG3 4.630 . 4.630 3.990 2.254 4.488 . 0 0 "[ . 1 . 2]" 1
255 1 152 GLN H 1 152 GLN HG2 4.630 . 4.630 3.433 2.329 4.635 0.005 16 0 "[ . 1 . 2]" 1
256 1 153 LEU HA 1 153 LEU QD 3.990 . 3.990 3.420 3.374 3.443 . 0 0 "[ . 1 . 2]" 1
257 1 153 LEU HA 1 153 LEU HG 3.690 . 3.690 3.668 3.620 3.726 0.036 11 0 "[ . 1 . 2]" 1
258 1 153 LEU H 1 153 LEU QB 3.540 . 3.540 2.741 2.661 2.787 . 0 0 "[ . 1 . 2]" 1
259 1 153 LEU H 1 153 LEU QD 3.800 . 3.800 2.854 1.771 2.981 . 0 0 "[ . 1 . 2]" 1
260 1 153 LEU H 1 153 LEU HG 3.650 . 3.650 1.994 1.839 3.528 . 0 0 "[ . 1 . 2]" 1
261 1 154 ARG HA 1 154 ARG QG 3.640 . 3.640 2.538 2.227 3.369 . 0 0 "[ . 1 . 2]" 1
262 1 154 ARG H 1 154 ARG QB 3.130 . 3.130 2.448 2.241 2.786 . 0 0 "[ . 1 . 2]" 1
263 1 154 ARG H 1 154 ARG QD 4.530 . 4.530 4.110 3.579 4.379 . 0 0 "[ . 1 . 2]" 1
264 1 154 ARG H 1 154 ARG QG 3.210 . 3.210 2.312 1.699 2.729 0.001 7 0 "[ . 1 . 2]" 1
265 1 156 LEU HA 1 156 LEU QD 3.390 . 3.390 2.312 1.802 3.393 0.003 7 0 "[ . 1 . 2]" 1
266 1 156 LEU HA 1 156 LEU MD1 3.880 . 3.880 3.014 1.834 4.021 0.141 7 0 "[ . 1 . 2]" 1
267 1 156 LEU HA 1 156 LEU MD2 3.880 . 3.880 2.957 2.011 3.777 . 0 0 "[ . 1 . 2]" 1
268 1 156 LEU QB 1 156 LEU QD 2.490 . 2.490 1.964 1.854 2.076 . 0 0 "[ . 1 . 2]" 1
269 1 156 LEU HB3 1 156 LEU MD1 3.310 . 3.310 2.722 2.331 3.214 . 0 0 "[ . 1 . 2]" 1
270 1 156 LEU HB3 1 156 LEU MD2 3.310 . 3.310 2.496 2.159 3.210 . 0 0 "[ . 1 . 2]" 1
271 1 156 LEU HB2 1 156 LEU MD1 3.310 . 3.310 2.507 2.119 3.197 . 0 0 "[ . 1 . 2]" 1
272 1 156 LEU HB2 1 156 LEU MD2 3.310 . 3.310 2.722 2.289 3.200 . 0 0 "[ . 1 . 2]" 1
273 1 156 LEU H 1 156 LEU QB 3.510 . 3.510 2.391 2.101 2.932 . 0 0 "[ . 1 . 2]" 1
274 1 156 LEU H 1 156 LEU QD 4.130 . 4.130 2.462 1.803 3.242 . 0 0 "[ . 1 . 2]" 1
275 1 158 GLU HA 1 158 GLU QG 3.330 . 3.330 2.810 2.379 3.346 0.016 11 0 "[ . 1 . 2]" 1
276 1 158 GLU HA 1 158 GLU HG3 3.800 . 3.800 3.324 2.532 3.829 0.029 4 0 "[ . 1 . 2]" 1
277 1 158 GLU HA 1 158 GLU HG2 3.800 . 3.800 3.146 2.450 3.839 0.039 9 0 "[ . 1 . 2]" 1
278 1 158 GLU H 1 158 GLU QB 3.220 . 3.220 2.560 2.355 2.946 . 0 0 "[ . 1 . 2]" 1
279 1 158 GLU H 1 158 GLU HB3 3.940 . 3.940 3.370 2.598 3.637 . 0 0 "[ . 1 . 2]" 1
280 1 158 GLU H 1 158 GLU HB2 3.940 . 3.940 2.869 2.388 3.759 . 0 0 "[ . 1 . 2]" 1
281 1 158 GLU H 1 158 GLU QG 3.230 . 3.230 2.236 1.864 2.942 . 0 0 "[ . 1 . 2]" 1
282 1 158 GLU H 1 158 GLU HG3 3.870 . 3.870 2.726 1.875 3.823 . 0 0 "[ . 1 . 2]" 1
283 1 158 GLU H 1 158 GLU HG2 3.870 . 3.870 2.917 1.895 3.753 . 0 0 "[ . 1 . 2]" 1
284 1 160 LEU HA 1 160 LEU MD1 3.720 . 3.720 2.192 1.953 3.434 . 0 0 "[ . 1 . 2]" 1
285 1 160 LEU HA 1 160 LEU MD2 3.720 . 3.720 2.172 1.856 3.545 . 0 0 "[ . 1 . 2]" 1
286 1 160 LEU HA 1 160 LEU HG 4.250 . 4.250 3.685 3.629 4.273 0.023 12 0 "[ . 1 . 2]" 1
287 1 160 LEU QB 1 160 LEU QD 2.650 . 2.650 2.049 2.023 2.066 . 0 0 "[ . 1 . 2]" 1
288 1 160 LEU H 1 160 LEU QB 3.480 . 3.480 2.514 2.365 3.246 . 0 0 "[ . 1 . 2]" 1
289 1 160 LEU H 1 160 LEU HB3 3.970 . 3.970 3.220 2.895 3.423 . 0 0 "[ . 1 . 2]" 1
290 1 160 LEU H 1 160 LEU HB2 3.970 . 3.970 2.658 2.424 4.030 0.060 12 0 "[ . 1 . 2]" 1
291 1 160 LEU H 1 160 LEU QD 3.780 . 3.780 3.457 2.050 3.754 . 0 0 "[ . 1 . 2]" 1
292 1 160 LEU H 1 160 LEU MD1 4.490 . 4.490 4.217 2.059 4.390 . 0 0 "[ . 1 . 2]" 1
293 1 160 LEU H 1 160 LEU MD2 4.490 . 4.490 3.753 3.507 4.131 . 0 0 "[ . 1 . 2]" 1
294 1 161 VAL HA 1 161 VAL QG 3.110 . 3.110 2.309 2.267 2.383 . 0 0 "[ . 1 . 2]" 1
295 1 161 VAL H 1 161 VAL HB 4.210 . 4.210 3.354 3.313 3.398 . 0 0 "[ . 1 . 2]" 1
296 1 161 VAL H 1 161 VAL QG 3.260 . 3.260 2.380 2.208 2.491 . 0 0 "[ . 1 . 2]" 1
297 1 161 VAL H 1 161 VAL MG1 3.990 . 3.990 2.399 2.220 2.516 . 0 0 "[ . 1 . 2]" 1
298 1 161 VAL H 1 161 VAL MG2 3.990 . 3.990 3.972 3.894 4.010 0.020 16 0 "[ . 1 . 2]" 1
299 1 162 MET QB 1 162 MET ME 3.620 . 3.620 3.445 1.966 3.710 0.090 13 0 "[ . 1 . 2]" 1
300 1 162 MET ME 1 162 MET QG 3.200 . 3.200 2.222 2.155 2.457 . 0 0 "[ . 1 . 2]" 1
301 1 162 MET H 1 162 MET ME 5.500 . 5.500 5.592 4.945 5.746 0.246 3 0 "[ . 1 . 2]" 1
302 1 163 VAL HA 1 163 VAL MG1 3.590 . 3.590 2.385 2.295 2.441 . 0 0 "[ . 1 . 2]" 1
303 1 163 VAL HA 1 163 VAL MG2 3.590 . 3.590 2.443 2.327 3.203 . 0 0 "[ . 1 . 2]" 1
304 1 163 VAL H 1 163 VAL MG1 4.030 . 4.030 3.809 2.989 3.890 . 0 0 "[ . 1 . 2]" 1
305 1 163 VAL H 1 163 VAL MG2 4.030 . 4.030 2.620 2.082 2.839 . 0 0 "[ . 1 . 2]" 1
306 1 169 ASP H 1 169 ASP QB 3.920 . 3.920 2.636 2.418 2.925 . 0 0 "[ . 1 . 2]" 1
307 1 170 VAL H 1 170 VAL HB 3.550 . 3.550 2.529 2.253 3.628 0.078 8 0 "[ . 1 . 2]" 1
308 1 170 VAL H 1 170 VAL QG 3.460 . 3.460 2.152 1.888 2.338 . 0 0 "[ . 1 . 2]" 1
309 1 173 ALA H 1 173 ALA MB 3.140 . 3.140 2.241 2.227 2.252 . 0 0 "[ . 1 . 2]" 1
310 1 174 ALA H 1 174 ALA MB 3.370 . 3.370 2.246 2.231 2.261 . 0 0 "[ . 1 . 2]" 1
311 1 175 ALA H 1 175 ALA MB 2.960 . 2.960 2.238 2.224 2.257 . 0 0 "[ . 1 . 2]" 1
312 1 176 HIS H 1 176 HIS HB3 4.030 . 4.030 2.861 2.667 3.647 . 0 0 "[ . 1 . 2]" 1
313 1 176 HIS H 1 176 HIS HB2 4.030 . 4.030 2.571 2.271 2.734 . 0 0 "[ . 1 . 2]" 1
314 1 178 ILE HA 1 178 ILE MD 3.830 . 3.830 3.815 3.137 3.878 0.048 8 0 "[ . 1 . 2]" 1
315 1 178 ILE HA 1 178 ILE MG 3.710 . 3.710 2.466 2.405 2.545 . 0 0 "[ . 1 . 2]" 1
316 1 178 ILE HB 1 178 ILE MD 2.800 . 2.800 2.286 2.239 2.332 . 0 0 "[ . 1 . 2]" 1
317 1 178 ILE MD 1 178 ILE MG 3.590 . 3.590 2.267 2.092 3.148 . 0 0 "[ . 1 . 2]" 1
318 1 178 ILE H 1 178 ILE MD 3.980 . 3.980 3.586 2.636 3.876 . 0 0 "[ . 1 . 2]" 1
319 1 179 ASP H 1 179 ASP QB 3.570 . 3.570 2.326 2.179 2.835 . 0 0 "[ . 1 . 2]" 1
320 1 179 ASP H 1 179 ASP HB3 4.130 . 4.130 3.211 2.443 3.616 . 0 0 "[ . 1 . 2]" 1
321 1 179 ASP H 1 179 ASP HB2 4.130 . 4.130 2.449 2.248 3.583 . 0 0 "[ . 1 . 2]" 1
322 1 187 TYR HA 1 187 TYR QD 3.990 . 3.990 3.036 2.196 3.759 . 0 0 "[ . 1 . 2]" 1
323 1 189 ARG HA 1 189 ARG QD 4.350 . 4.350 3.556 1.947 4.466 0.116 15 0 "[ . 1 . 2]" 1
324 1 189 ARG HA 1 189 ARG QG 3.490 . 3.490 2.843 2.394 3.367 . 0 0 "[ . 1 . 2]" 1
325 1 189 ARG HA 1 189 ARG HG3 4.000 . 4.000 3.109 2.507 3.882 . 0 0 "[ . 1 . 2]" 1
326 1 189 ARG HA 1 189 ARG HG2 4.000 . 4.000 3.446 2.455 3.817 . 0 0 "[ . 1 . 2]" 1
327 1 189 ARG QB 1 189 ARG QD 3.130 . 3.130 2.306 2.094 2.891 . 0 0 "[ . 1 . 2]" 1
328 1 189 ARG HB3 1 189 ARG QD 3.730 . 3.730 2.742 2.172 3.511 . 0 0 "[ . 1 . 2]" 1
329 1 189 ARG HB2 1 189 ARG QD 3.730 . 3.730 2.643 2.302 3.228 . 0 0 "[ . 1 . 2]" 1
330 1 189 ARG H 1 189 ARG QB 3.290 . 3.290 2.775 2.252 3.286 . 0 0 "[ . 1 . 2]" 1
331 1 189 ARG H 1 189 ARG HB3 3.780 . 3.780 2.958 2.410 3.547 . 0 0 "[ . 1 . 2]" 1
332 1 189 ARG H 1 189 ARG HB2 3.780 . 3.780 3.384 2.691 3.881 0.101 20 0 "[ . 1 . 2]" 1
333 1 189 ARG H 1 189 ARG QG 4.330 . 4.330 3.670 1.847 4.395 0.065 19 0 "[ . 1 . 2]" 1
334 1 190 ALA H 1 190 ALA MB 3.410 . 3.410 2.308 2.227 2.746 . 0 0 "[ . 1 . 2]" 1
335 1 191 ASP H 1 191 ASP QB 3.590 . 3.590 2.396 2.146 2.685 . 0 0 "[ . 1 . 2]" 1
336 1 205 ALA H 1 205 ALA MB 3.340 . 3.340 2.263 2.227 2.281 . 0 0 "[ . 1 . 2]" 1
337 1 206 THR HA 1 206 THR MG 3.390 . 3.390 3.216 3.199 3.223 . 0 0 "[ . 1 . 2]" 1
338 1 206 THR H 1 206 THR MG 3.650 . 3.650 2.150 2.014 2.372 . 0 0 "[ . 1 . 2]" 1
339 1 207 ILE HA 1 207 ILE MD 3.570 . 3.570 2.064 1.849 2.173 . 0 0 "[ . 1 . 2]" 1
340 1 207 ILE HA 1 207 ILE MG 3.500 . 3.500 3.217 3.203 3.226 . 0 0 "[ . 1 . 2]" 1
341 1 207 ILE HB 1 207 ILE MD 3.610 . 3.610 2.322 2.234 2.386 . 0 0 "[ . 1 . 2]" 1
342 1 207 ILE MD 1 207 ILE MG 3.400 . 3.400 3.226 3.200 3.242 . 0 0 "[ . 1 . 2]" 1
343 1 207 ILE HG13 1 207 ILE MG 3.290 . 3.290 2.495 2.439 2.542 . 0 0 "[ . 1 . 2]" 1
344 1 207 ILE HG12 1 207 ILE MG 3.290 . 3.290 2.260 2.228 2.295 . 0 0 "[ . 1 . 2]" 1
345 1 207 ILE H 1 207 ILE HB 4.110 . 4.110 2.632 2.451 2.735 . 0 0 "[ . 1 . 2]" 1
346 1 208 ASP H 1 208 ASP HB3 3.550 . 3.550 2.966 2.408 3.589 0.039 10 0 "[ . 1 . 2]" 1
347 1 208 ASP H 1 208 ASP HB2 3.550 . 3.550 2.477 2.132 3.585 0.035 5 0 "[ . 1 . 2]" 1
348 1 209 GLU HA 1 209 GLU QG 3.430 . 3.430 2.526 2.356 3.343 . 0 0 "[ . 1 . 2]" 1
349 1 209 GLU HA 1 209 GLU HG3 4.100 . 4.100 3.075 2.563 3.816 . 0 0 "[ . 1 . 2]" 1
350 1 209 GLU HA 1 209 GLU HG2 4.100 . 4.100 2.764 2.436 3.878 . 0 0 "[ . 1 . 2]" 1
351 1 209 GLU H 1 209 GLU QB 3.870 . 3.870 2.388 2.071 2.615 . 0 0 "[ . 1 . 2]" 1
352 1 209 GLU H 1 209 GLU QG 3.500 . 3.500 2.457 1.975 3.783 0.283 5 0 "[ . 1 . 2]" 1
353 1 209 GLU H 1 209 GLU HG3 4.130 . 4.130 2.663 2.195 4.331 0.201 20 0 "[ . 1 . 2]" 1
354 1 209 GLU H 1 209 GLU HG2 4.130 . 4.130 3.494 1.991 4.340 0.210 5 0 "[ . 1 . 2]" 1
355 1 210 LEU HA 1 210 LEU QD 4.170 . 4.170 2.049 1.818 2.518 . 0 0 "[ . 1 . 2]" 1
356 1 211 ARG H 1 211 ARG HB3 4.030 . 4.030 2.594 2.300 3.606 . 0 0 "[ . 1 . 2]" 1
357 1 211 ARG H 1 211 ARG HB2 4.030 . 4.030 2.886 2.181 3.632 . 0 0 "[ . 1 . 2]" 1
358 1 212 GLU HA 1 212 GLU QG 3.400 . 3.400 3.325 2.885 3.357 . 0 0 "[ . 1 . 2]" 1
359 1 212 GLU HA 1 212 GLU HG3 3.880 . 3.880 3.672 2.980 3.813 . 0 0 "[ . 1 . 2]" 1
360 1 212 GLU HA 1 212 GLU HG2 3.880 . 3.880 3.818 3.709 3.917 0.037 6 0 "[ . 1 . 2]" 1
361 1 212 GLU H 1 212 GLU QB 3.100 . 3.100 2.534 2.081 2.658 . 0 0 "[ . 1 . 2]" 1
362 1 212 GLU H 1 212 GLU HB3 3.700 . 3.700 2.589 2.114 2.734 . 0 0 "[ . 1 . 2]" 1
363 1 212 GLU H 1 212 GLU HB2 3.700 . 3.700 3.606 3.119 3.648 . 0 0 "[ . 1 . 2]" 1
364 1 212 GLU H 1 212 GLU QG 3.700 . 3.700 2.260 1.977 3.612 . 0 0 "[ . 1 . 2]" 1
365 1 212 GLU H 1 212 GLU HG3 4.210 . 4.210 3.261 3.034 4.284 0.074 20 0 "[ . 1 . 2]" 1
366 1 212 GLU H 1 212 GLU HG2 4.210 . 4.210 2.314 1.996 3.891 . 0 0 "[ . 1 . 2]" 1
367 1 213 ALA H 1 213 ALA MB 3.040 . 3.040 2.226 2.200 2.244 . 0 0 "[ . 1 . 2]" 1
368 1 214 LEU HA 1 214 LEU QD 3.240 . 3.240 1.979 1.911 2.030 . 0 0 "[ . 1 . 2]" 1
369 1 214 LEU HB3 1 214 LEU QD 3.240 . 3.240 2.116 2.093 2.136 . 0 0 "[ . 1 . 2]" 1
370 1 214 LEU H 1 214 LEU HB3 3.870 . 3.870 3.607 3.593 3.629 . 0 0 "[ . 1 . 2]" 1
371 1 214 LEU H 1 214 LEU QD 4.050 . 4.050 2.938 2.842 3.033 . 0 0 "[ . 1 . 2]" 1
372 1 214 LEU H 1 214 LEU HG 3.830 . 3.830 2.339 2.197 2.490 . 0 0 "[ . 1 . 2]" 1
373 1 216 VAL HA 1 216 VAL QG 2.850 . 2.850 2.241 2.095 2.385 . 0 0 "[ . 1 . 2]" 1
374 1 216 VAL HA 1 216 VAL MG1 3.530 . 3.530 2.678 2.128 3.247 . 0 0 "[ . 1 . 2]" 1
375 1 216 VAL HA 1 216 VAL MG2 3.530 . 3.530 2.789 2.301 3.222 . 0 0 "[ . 1 . 2]" 1
376 1 216 VAL H 1 216 VAL QG 3.080 . 3.080 2.001 1.827 2.209 . 0 0 "[ . 1 . 2]" 1
377 1 216 VAL H 1 216 VAL MG1 3.960 . 3.960 2.547 1.956 3.785 . 0 0 "[ . 1 . 2]" 1
378 1 216 VAL H 1 216 VAL MG2 3.960 . 3.960 2.815 1.856 3.890 . 0 0 "[ . 1 . 2]" 1
379 1 1 GLY QA 1 2 GLU HA 4.100 . 4.100 3.973 3.922 4.107 0.007 15 0 "[ . 1 . 2]" 1
380 1 3 SER HA 1 4 PRO QD 3.190 . 3.190 2.126 1.872 2.334 . 0 0 "[ . 1 . 2]" 1
381 1 3 SER HA 1 4 PRO HD3 3.710 . 3.710 2.330 1.900 2.603 . 0 0 "[ . 1 . 2]" 1
382 1 3 SER HA 1 4 PRO HD2 3.710 . 3.710 2.523 2.193 3.204 . 0 0 "[ . 1 . 2]" 1
383 1 3 SER HA 1 4 PRO QG 4.240 . 4.240 4.037 3.803 4.249 0.009 11 0 "[ . 1 . 2]" 1
384 1 3 SER QB 1 4 PRO QD 4.000 . 4.000 2.149 1.717 2.685 . 0 0 "[ . 1 . 2]" 1
385 1 3 SER QB 1 4 PRO QG 4.140 . 4.140 3.745 3.260 4.196 0.056 19 0 "[ . 1 . 2]" 1
386 1 4 PRO HB2 1 5 GLN H 4.140 . 4.140 2.109 1.824 2.504 . 0 0 "[ . 1 . 2]" 1
387 1 5 GLN QB 1 6 LEU H 4.090 . 4.090 2.809 2.489 3.120 . 0 0 "[ . 1 . 2]" 1
388 1 5 GLN H 1 6 LEU H 4.120 . 4.120 2.243 2.137 2.336 . 0 0 "[ . 1 . 2]" 1
389 1 6 LEU HA 1 7 VAL MG2 4.310 . 4.310 3.429 3.277 3.545 . 0 0 "[ . 1 . 2]" 1
390 1 6 LEU QB 1 7 VAL H 3.950 . 3.950 3.517 3.126 3.732 . 0 0 "[ . 1 . 2]" 1
391 1 6 LEU QD 1 7 VAL H 3.550 . 3.550 2.258 1.794 3.166 . 0 0 "[ . 1 . 2]" 1
392 1 7 VAL HA 1 8 ILE H 3.480 . 3.480 2.149 2.113 2.189 . 0 0 "[ . 1 . 2]" 1
393 1 7 VAL MG1 1 8 ILE MD 4.960 . 4.960 4.740 4.198 5.032 0.072 3 0 "[ . 1 . 2]" 1
394 1 7 VAL MG1 1 8 ILE MG 5.100 . 5.100 4.848 4.642 4.993 . 0 0 "[ . 1 . 2]" 1
395 1 7 VAL MG1 1 8 ILE H 3.830 . 3.830 2.859 2.652 3.066 . 0 0 "[ . 1 . 2]" 1
396 1 7 VAL MG2 1 8 ILE H 4.220 . 4.220 4.172 4.035 4.250 0.030 13 0 "[ . 1 . 2]" 1
397 1 8 ILE MD 1 9 PHE H 4.520 . 4.520 4.024 3.578 4.688 0.168 5 0 "[ . 1 . 2]" 1
398 1 8 ILE QG 1 9 PHE H 4.620 . 4.620 4.367 3.580 4.734 0.114 1 0 "[ . 1 . 2]" 1
399 1 8 ILE MG 1 9 PHE H 3.730 . 3.730 2.650 2.330 2.935 . 0 0 "[ . 1 . 2]" 1
400 1 9 PHE QB 1 10 ASP H 4.180 . 4.180 2.853 2.405 3.124 . 0 0 "[ . 1 . 2]" 1
401 1 14 THR MG 1 15 LEU H 4.290 . 4.290 3.517 2.555 4.195 . 0 0 "[ . 1 . 2]" 1
402 1 16 THR MG 1 17 ASP H 4.060 . 4.060 3.083 1.849 3.766 . 0 0 "[ . 1 . 2]" 1
403 1 17 ASP HA 1 18 SER HA 4.500 . 4.500 4.473 4.398 4.558 0.058 6 0 "[ . 1 . 2]" 1
404 1 17 ASP HA 1 18 SER H 3.480 . 3.480 2.305 2.171 2.460 . 0 0 "[ . 1 . 2]" 1
405 1 18 SER HA 1 19 ALA MB 5.030 . 5.030 4.744 4.410 4.910 . 0 0 "[ . 1 . 2]" 1
406 1 18 SER H 1 19 ALA MB 4.650 . 4.650 4.093 3.442 4.666 0.016 13 0 "[ . 1 . 2]" 1
407 1 18 SER H 1 19 ALA H 3.820 . 3.820 2.502 1.676 3.380 0.024 2 0 "[ . 1 . 2]" 1
408 1 19 ALA MB 1 20 ARG HA 3.960 . 3.960 3.780 3.693 3.864 . 0 0 "[ . 1 . 2]" 1
409 1 19 ALA MB 1 20 ARG QG 4.340 . 4.340 3.220 2.966 3.427 . 0 0 "[ . 1 . 2]" 1
410 1 19 ALA MB 1 20 ARG H 3.650 . 3.650 2.288 2.003 2.581 . 0 0 "[ . 1 . 2]" 1
411 1 20 ARG QB 1 21 GLY QA 4.200 . 4.200 3.552 3.439 3.649 . 0 0 "[ . 1 . 2]" 1
412 1 20 ARG QB 1 21 GLY H 4.010 . 4.010 2.434 2.178 2.677 . 0 0 "[ . 1 . 2]" 1
413 1 20 ARG QD 1 21 GLY H 5.050 . 5.050 4.749 4.210 5.145 0.095 19 0 "[ . 1 . 2]" 1
414 1 20 ARG QG 1 21 GLY H 4.290 . 4.290 3.986 3.521 4.287 . 0 0 "[ . 1 . 2]" 1
415 1 20 ARG H 1 21 GLY H 4.000 . 4.000 2.857 2.740 2.984 . 0 0 "[ . 1 . 2]" 1
416 1 22 ILE HB 1 23 VAL H 4.260 . 4.260 2.499 2.279 2.707 . 0 0 "[ . 1 . 2]" 1
417 1 22 ILE MG 1 23 VAL HA 4.270 . 4.270 3.313 3.180 3.524 . 0 0 "[ . 1 . 2]" 1
418 1 23 VAL HB 1 24 SER H 3.640 . 3.640 2.921 2.522 3.876 0.236 9 0 "[ . 1 . 2]" 1
419 1 23 VAL QG 1 24 SER HA 4.000 . 4.000 3.315 2.999 3.536 . 0 0 "[ . 1 . 2]" 1
420 1 23 VAL QG 1 24 SER H 3.530 . 3.530 2.983 1.939 3.320 . 0 0 "[ . 1 . 2]" 1
421 1 23 VAL MG1 1 24 SER H 4.350 . 4.350 3.158 1.947 3.604 . 0 0 "[ . 1 . 2]" 1
422 1 23 VAL MG2 1 24 SER H 4.350 . 4.350 3.850 3.577 3.991 . 0 0 "[ . 1 . 2]" 1
423 1 23 VAL H 1 24 SER H 3.950 . 3.950 2.751 2.687 2.837 . 0 0 "[ . 1 . 2]" 1
424 1 24 SER QB 1 25 SER H 3.880 . 3.880 2.321 2.185 2.560 . 0 0 "[ . 1 . 2]" 1
425 1 24 SER H 1 25 SER H 3.980 . 3.980 2.800 2.658 2.883 . 0 0 "[ . 1 . 2]" 1
426 1 25 SER H 1 26 PHE H 3.970 . 3.970 2.667 2.582 2.771 . 0 0 "[ . 1 . 2]" 1
427 1 26 PHE QB 1 27 ARG H 4.090 . 4.090 2.877 2.651 3.295 . 0 0 "[ . 1 . 2]" 1
428 1 26 PHE QD 1 27 ARG HA 4.230 . 4.230 3.988 3.818 4.169 . 0 0 "[ . 1 . 2]" 1
429 1 26 PHE QD 1 27 ARG QB 4.740 . 4.740 4.372 4.076 4.694 . 0 0 "[ . 1 . 2]" 1
430 1 26 PHE QD 1 27 ARG H 4.020 . 4.020 3.008 2.795 3.353 . 0 0 "[ . 1 . 2]" 1
431 1 26 PHE QE 1 27 ARG QG 3.890 . 3.890 2.990 2.448 3.901 0.011 1 0 "[ . 1 . 2]" 1
432 1 26 PHE H 1 27 ARG H 3.950 . 3.950 2.739 2.651 2.842 . 0 0 "[ . 1 . 2]" 1
433 1 27 ARG QB 1 28 HIS H 4.040 . 4.040 2.527 2.315 2.679 . 0 0 "[ . 1 . 2]" 1
434 1 27 ARG H 1 28 HIS H 3.910 . 3.910 2.696 2.609 2.751 . 0 0 "[ . 1 . 2]" 1
435 1 28 HIS QB 1 29 ALA MB 4.060 . 4.060 3.836 3.662 4.033 . 0 0 "[ . 1 . 2]" 1
436 1 28 HIS HB3 1 29 ALA H 3.900 . 3.900 3.294 2.407 3.782 . 0 0 "[ . 1 . 2]" 1
437 1 28 HIS HB2 1 29 ALA H 3.900 . 3.900 2.815 2.509 3.804 . 0 0 "[ . 1 . 2]" 1
438 1 28 HIS H 1 29 ALA MB 4.310 . 4.310 4.316 4.271 4.351 0.041 1 0 "[ . 1 . 2]" 1
439 1 28 HIS H 1 29 ALA H 3.960 . 3.960 2.680 2.597 2.732 . 0 0 "[ . 1 . 2]" 1
440 1 29 ALA MB 1 30 LEU H 3.680 . 3.680 2.188 2.144 2.247 . 0 0 "[ . 1 . 2]" 1
441 1 29 ALA H 1 30 LEU H 4.060 . 4.060 2.949 2.910 2.994 . 0 0 "[ . 1 . 2]" 1
442 1 30 LEU HB3 1 31 ASN HA 4.130 . 4.130 4.181 4.111 4.243 0.113 2 0 "[ . 1 . 2]" 1
443 1 30 LEU HB2 1 31 ASN H 4.040 . 4.040 2.820 2.741 2.979 . 0 0 "[ . 1 . 2]" 1
444 1 30 LEU H 1 31 ASN H 3.790 . 3.790 2.786 2.743 2.840 . 0 0 "[ . 1 . 2]" 1
445 1 31 ASN QB 1 32 HIS HA 4.200 . 4.200 4.112 4.031 4.189 . 0 0 "[ . 1 . 2]" 1
446 1 31 ASN QB 1 32 HIS H 3.310 . 3.310 2.757 2.594 2.950 . 0 0 "[ . 1 . 2]" 1
447 1 31 ASN HB3 1 32 HIS H 3.960 . 3.960 2.816 2.631 3.034 . 0 0 "[ . 1 . 2]" 1
448 1 31 ASN HB2 1 32 HIS H 3.960 . 3.960 3.944 3.851 4.028 0.068 6 0 "[ . 1 . 2]" 1
449 1 32 HIS QB 1 33 ILE H 3.580 . 3.580 2.828 2.710 2.925 . 0 0 "[ . 1 . 2]" 1
450 1 32 HIS HB3 1 33 ILE H 4.090 . 4.090 2.907 2.760 3.436 . 0 0 "[ . 1 . 2]" 1
451 1 32 HIS HB2 1 33 ILE H 4.090 . 4.090 4.016 3.169 4.159 0.069 1 0 "[ . 1 . 2]" 1
452 1 32 HIS H 1 33 ILE MG 4.550 . 4.550 4.196 3.887 4.461 . 0 0 "[ . 1 . 2]" 1
453 1 32 HIS H 1 33 ILE H 4.030 . 4.030 2.624 2.529 2.798 . 0 0 "[ . 1 . 2]" 1
454 1 33 ILE HB 1 34 GLY H 4.650 . 4.650 4.310 4.240 4.394 . 0 0 "[ . 1 . 2]" 1
455 1 33 ILE MG 1 34 GLY H 4.480 . 4.480 4.190 4.110 4.303 . 0 0 "[ . 1 . 2]" 1
456 1 33 ILE H 1 34 GLY H 3.740 . 3.740 2.372 2.269 2.562 . 0 0 "[ . 1 . 2]" 1
457 1 34 GLY H 1 35 ALA MB 4.440 . 4.440 4.219 4.135 4.331 . 0 0 "[ . 1 . 2]" 1
458 1 34 GLY H 1 35 ALA H 3.520 . 3.520 2.499 2.316 2.720 . 0 0 "[ . 1 . 2]" 1
459 1 35 ALA MB 1 36 PRO HB2 5.140 . 5.140 4.988 4.461 5.201 0.061 20 0 "[ . 1 . 2]" 1
460 1 35 ALA MB 1 36 PRO QD 3.040 . 3.040 2.195 1.890 2.476 . 0 0 "[ . 1 . 2]" 1
461 1 35 ALA MB 1 36 PRO HD3 3.590 . 3.590 3.334 2.645 3.716 0.126 7 0 "[ . 1 . 2]" 1
462 1 35 ALA MB 1 36 PRO HD2 3.590 . 3.590 2.237 1.902 2.514 . 0 0 "[ . 1 . 2]" 1
463 1 35 ALA MB 1 36 PRO QG 3.820 . 3.820 3.672 3.307 3.948 0.128 19 0 "[ . 1 . 2]" 1
464 1 35 ALA H 1 36 PRO QD 4.860 . 4.860 4.384 4.301 4.422 . 0 0 "[ . 1 . 2]" 1
465 1 36 PRO HA 1 37 VAL HB 5.130 . 5.130 4.624 4.517 4.755 . 0 0 "[ . 1 . 2]" 1
466 1 36 PRO HA 1 37 VAL QG 3.770 . 3.770 3.433 3.099 3.633 . 0 0 "[ . 1 . 2]" 1
467 1 36 PRO HA 1 37 VAL H 2.940 . 2.940 2.247 2.124 2.501 . 0 0 "[ . 1 . 2]" 1
468 1 36 PRO HB3 1 37 VAL H 3.870 . 3.870 3.689 3.113 4.039 0.169 14 0 "[ . 1 . 2]" 1
469 1 36 PRO HB2 1 37 VAL HA 4.380 . 4.380 4.309 4.031 4.570 0.190 11 0 "[ . 1 . 2]" 1
470 1 36 PRO HB2 1 37 VAL H 3.880 . 3.880 3.285 2.449 3.893 0.013 17 0 "[ . 1 . 2]" 1
471 1 37 VAL HA 1 38 PRO QD 3.180 . 3.180 1.844 1.682 1.948 0.018 3 0 "[ . 1 . 2]" 1
472 1 37 VAL HA 1 38 PRO HD3 3.700 . 3.700 2.017 1.699 2.514 0.001 3 0 "[ . 1 . 2]" 1
473 1 37 VAL HA 1 38 PRO HD2 3.700 . 3.700 2.421 1.852 2.692 . 0 0 "[ . 1 . 2]" 1
474 1 37 VAL HA 1 38 PRO QG 4.060 . 4.060 3.759 3.592 3.875 . 0 0 "[ . 1 . 2]" 1
475 1 37 VAL QG 1 38 PRO QB 4.730 . 4.730 4.288 3.841 4.630 . 0 0 "[ . 1 . 2]" 1
476 1 37 VAL QG 1 38 PRO QD 3.030 . 3.030 2.627 2.308 3.002 . 0 0 "[ . 1 . 2]" 1
477 1 38 PRO HA 1 39 GLU H 2.900 . 2.900 2.215 2.157 2.436 . 0 0 "[ . 1 . 2]" 1
478 1 39 GLU HA 1 40 GLY H 3.180 . 3.180 2.544 2.114 3.244 0.064 17 0 "[ . 1 . 2]" 1
479 1 39 GLU QB 1 40 GLY H 4.150 . 4.150 3.041 1.795 4.058 . 0 0 "[ . 1 . 2]" 1
480 1 39 GLU HB3 1 40 GLY H 4.710 . 4.710 3.708 1.805 4.665 . 0 0 "[ . 1 . 2]" 1
481 1 39 GLU HB2 1 40 GLY H 4.710 . 4.710 3.579 1.892 4.519 . 0 0 "[ . 1 . 2]" 1
482 1 42 LEU QB 1 43 ALA H 4.390 . 4.390 3.134 2.830 3.379 . 0 0 "[ . 1 . 2]" 1
483 1 43 ALA MB 1 44 THR HA 4.510 . 4.510 3.805 3.755 3.847 . 0 0 "[ . 1 . 2]" 1
484 1 43 ALA MB 1 44 THR HB 4.970 . 4.970 3.885 3.753 4.058 . 0 0 "[ . 1 . 2]" 1
485 1 43 ALA MB 1 44 THR H 3.480 . 3.480 2.409 2.253 2.587 . 0 0 "[ . 1 . 2]" 1
486 1 43 ALA H 1 44 THR MG 5.010 . 5.010 3.902 3.530 4.119 . 0 0 "[ . 1 . 2]" 1
487 1 43 ALA H 1 44 THR H 4.060 . 4.060 2.745 2.508 2.878 . 0 0 "[ . 1 . 2]" 1
488 1 44 THR HB 1 45 HIS H 4.220 . 4.220 4.156 4.008 4.245 0.025 17 0 "[ . 1 . 2]" 1
489 1 44 THR MG 1 45 HIS QB 4.120 . 4.120 3.231 2.872 3.747 . 0 0 "[ . 1 . 2]" 1
490 1 44 THR MG 1 45 HIS H 3.860 . 3.860 2.529 2.323 2.814 . 0 0 "[ . 1 . 2]" 1
491 1 44 THR H 1 45 HIS QB 4.500 . 4.500 4.267 4.021 4.508 0.008 20 0 "[ . 1 . 2]" 1
492 1 44 THR H 1 45 HIS H 3.770 . 3.770 2.484 2.343 2.559 . 0 0 "[ . 1 . 2]" 1
493 1 45 HIS HA 1 46 ILE HA 4.850 . 4.850 4.581 4.553 4.621 . 0 0 "[ . 1 . 2]" 1
494 1 45 HIS QB 1 46 ILE MG 3.580 . 3.580 2.961 2.684 3.465 . 0 0 "[ . 1 . 2]" 1
495 1 45 HIS QB 1 46 ILE H 3.830 . 3.830 2.970 2.675 3.207 . 0 0 "[ . 1 . 2]" 1
496 1 45 HIS H 1 46 ILE MD 5.380 . 5.380 5.079 4.869 5.292 . 0 0 "[ . 1 . 2]" 1
497 1 45 HIS H 1 46 ILE MG 4.540 . 4.540 4.050 3.876 4.273 . 0 0 "[ . 1 . 2]" 1
498 1 45 HIS H 1 46 ILE H 3.840 . 3.840 2.451 2.345 2.701 . 0 0 "[ . 1 . 2]" 1
499 1 46 ILE H 1 47 VAL H 3.880 . 3.880 2.388 2.202 3.246 . 0 0 "[ . 1 . 2]" 1
500 1 53 GLU QB 1 54 THR H 3.820 . 3.820 2.601 2.382 2.916 . 0 0 "[ . 1 . 2]" 1
501 1 53 GLU H 1 54 THR H 3.830 . 3.830 2.473 2.374 2.581 . 0 0 "[ . 1 . 2]" 1
502 1 54 THR MG 1 55 LEU HA 4.130 . 4.130 3.593 3.440 3.729 . 0 0 "[ . 1 . 2]" 1
503 1 54 THR MG 1 55 LEU QB 4.360 . 4.360 4.312 4.137 4.390 0.030 6 0 "[ . 1 . 2]" 1
504 1 54 THR MG 1 55 LEU H 4.060 . 4.060 3.503 3.366 3.588 . 0 0 "[ . 1 . 2]" 1
505 1 54 THR H 1 55 LEU H 4.090 . 4.090 2.715 2.626 2.839 . 0 0 "[ . 1 . 2]" 1
506 1 55 LEU QB 1 56 ARG QB 4.180 . 4.180 3.906 3.663 4.247 0.067 12 0 "[ . 1 . 2]" 1
507 1 55 LEU HG 1 56 ARG H 4.270 . 4.270 4.074 3.701 4.302 0.032 12 0 "[ . 1 . 2]" 1
508 1 55 LEU H 1 56 ARG QB 4.510 . 4.510 4.381 4.187 4.610 0.100 15 0 "[ . 1 . 2]" 1
509 1 55 LEU H 1 56 ARG H 4.210 . 4.210 2.588 2.528 2.673 . 0 0 "[ . 1 . 2]" 1
510 1 56 ARG H 1 57 ALA H 3.840 . 3.840 2.422 2.305 2.502 . 0 0 "[ . 1 . 2]" 1
511 1 57 ALA MB 1 58 MET HA 4.020 . 4.020 3.927 3.848 4.053 0.033 11 0 "[ . 1 . 2]" 1
512 1 57 ALA MB 1 58 MET QB 4.620 . 4.620 4.331 3.344 4.585 . 0 0 "[ . 1 . 2]" 1
513 1 57 ALA MB 1 58 MET QG 3.830 . 3.830 3.284 3.153 3.517 . 0 0 "[ . 1 . 2]" 1
514 1 57 ALA MB 1 58 MET HG3 4.710 . 4.710 4.356 3.382 4.840 0.130 18 0 "[ . 1 . 2]" 1
515 1 57 ALA MB 1 58 MET HG2 4.710 . 4.710 3.608 3.200 4.256 . 0 0 "[ . 1 . 2]" 1
516 1 57 ALA MB 1 58 MET H 3.460 . 3.460 2.932 2.543 3.076 . 0 0 "[ . 1 . 2]" 1
517 1 57 ALA H 1 58 MET H 3.600 . 3.600 2.324 2.167 2.478 . 0 0 "[ . 1 . 2]" 1
518 1 64 ALA MB 1 65 GLU HA 3.810 . 3.810 3.809 3.749 3.880 0.070 10 0 "[ . 1 . 2]" 1
519 1 64 ALA MB 1 65 GLU QG 3.860 . 3.860 3.297 3.106 3.908 0.048 9 0 "[ . 1 . 2]" 1
520 1 64 ALA MB 1 65 GLU H 3.660 . 3.660 2.670 2.497 2.785 . 0 0 "[ . 1 . 2]" 1
521 1 64 ALA H 1 65 GLU H 3.820 . 3.820 2.661 2.530 2.767 . 0 0 "[ . 1 . 2]" 1
522 1 65 GLU HB3 1 66 GLU H 4.280 . 4.280 3.712 3.419 4.040 . 0 0 "[ . 1 . 2]" 1
523 1 65 GLU HB2 1 66 GLU H 4.280 . 4.280 2.676 2.334 3.645 . 0 0 "[ . 1 . 2]" 1
524 1 65 GLU QG 1 66 GLU H 4.060 . 4.060 3.770 2.091 4.121 0.061 14 0 "[ . 1 . 2]" 1
525 1 65 GLU H 1 66 GLU H 3.830 . 3.830 2.560 2.464 2.630 . 0 0 "[ . 1 . 2]" 1
526 1 66 GLU HA 1 67 ALA MB 5.190 . 5.190 5.015 4.992 5.032 . 0 0 "[ . 1 . 2]" 1
527 1 66 GLU QB 1 67 ALA H 3.540 . 3.540 2.543 2.297 2.756 . 0 0 "[ . 1 . 2]" 1
528 1 66 GLU HB3 1 67 ALA H 4.200 . 4.200 2.576 2.318 2.803 . 0 0 "[ . 1 . 2]" 1
529 1 66 GLU HB2 1 67 ALA H 4.200 . 4.200 3.921 3.730 4.066 . 0 0 "[ . 1 . 2]" 1
530 1 66 GLU QG 1 67 ALA MB 3.800 . 3.800 3.907 3.815 3.987 0.187 17 0 "[ . 1 . 2]" 1
531 1 66 GLU QG 1 67 ALA H 3.970 . 3.970 3.316 3.226 3.452 . 0 0 "[ . 1 . 2]" 1
532 1 66 GLU H 1 67 ALA H 3.650 . 3.650 2.659 2.500 2.833 . 0 0 "[ . 1 . 2]" 1
533 1 67 ALA MB 1 68 ILE MD 5.500 . 5.500 4.053 3.614 4.592 . 0 0 "[ . 1 . 2]" 1
534 1 67 ALA MB 1 68 ILE H 3.670 . 3.670 2.531 2.454 2.670 . 0 0 "[ . 1 . 2]" 1
535 1 67 ALA H 1 68 ILE H 3.950 . 3.950 2.685 2.574 2.735 . 0 0 "[ . 1 . 2]" 1
536 1 68 ILE HB 1 69 VAL H 4.180 . 4.180 3.173 2.545 4.023 . 0 0 "[ . 1 . 2]" 1
537 1 68 ILE MG 1 69 VAL HA 4.250 . 4.250 3.135 2.989 3.297 . 0 0 "[ . 1 . 2]" 1
538 1 68 ILE MG 1 69 VAL H 4.030 . 4.030 2.783 2.200 3.269 . 0 0 "[ . 1 . 2]" 1
539 1 68 ILE H 1 69 VAL H 4.090 . 4.090 2.787 2.646 2.938 . 0 0 "[ . 1 . 2]" 1
540 1 69 VAL HB 1 70 ALA H 4.050 . 4.050 3.849 2.487 4.045 . 0 0 "[ . 1 . 2]" 1
541 1 69 VAL QG 1 70 ALA HA 3.960 . 3.960 3.155 3.066 3.467 . 0 0 "[ . 1 . 2]" 1
542 1 69 VAL MG1 1 70 ALA H 3.780 . 3.780 2.444 2.138 3.844 0.064 9 0 "[ . 1 . 2]" 1
543 1 69 VAL MG2 1 70 ALA H 3.780 . 3.780 3.706 2.286 3.839 0.059 16 0 "[ . 1 . 2]" 1
544 1 69 VAL H 1 70 ALA MB 4.640 . 4.640 4.264 4.171 4.351 . 0 0 "[ . 1 . 2]" 1
545 1 69 VAL H 1 70 ALA H 4.120 . 4.120 2.574 2.472 2.660 . 0 0 "[ . 1 . 2]" 1
546 1 70 ALA MB 1 71 TYR H 3.620 . 3.620 2.457 2.326 2.545 . 0 0 "[ . 1 . 2]" 1
547 1 70 ALA H 1 71 TYR H 3.950 . 3.950 2.602 2.453 2.735 . 0 0 "[ . 1 . 2]" 1
548 1 71 TYR QD 1 72 ARG HA 3.820 . 3.820 3.223 2.873 3.470 . 0 0 "[ . 1 . 2]" 1
549 1 71 TYR QD 1 72 ARG QB 4.290 . 4.290 4.210 3.712 4.369 0.079 5 0 "[ . 1 . 2]" 1
550 1 71 TYR QD 1 72 ARG QG 3.940 . 3.940 2.686 2.346 3.921 . 0 0 "[ . 1 . 2]" 1
551 1 71 TYR QD 1 72 ARG H 3.890 . 3.890 3.053 2.890 3.172 . 0 0 "[ . 1 . 2]" 1
552 1 71 TYR H 1 72 ARG H 4.060 . 4.060 2.759 2.687 2.813 . 0 0 "[ . 1 . 2]" 1
553 1 72 ARG QB 1 73 ALA MB 3.660 . 3.660 3.724 3.641 3.824 0.164 9 0 "[ . 1 . 2]" 1
554 1 72 ARG QB 1 73 ALA H 3.510 . 3.510 2.482 2.330 2.659 . 0 0 "[ . 1 . 2]" 1
555 1 72 ARG H 1 73 ALA MB 4.600 . 4.600 4.363 4.245 4.469 . 0 0 "[ . 1 . 2]" 1
556 1 72 ARG H 1 73 ALA H 3.880 . 3.880 2.725 2.588 2.836 . 0 0 "[ . 1 . 2]" 1
557 1 73 ALA HA 1 74 ASP QB 5.340 . 5.340 5.243 5.220 5.361 0.021 2 0 "[ . 1 . 2]" 1
558 1 73 ALA MB 1 74 ASP QB 4.360 . 4.360 3.684 3.598 4.051 . 0 0 "[ . 1 . 2]" 1
559 1 73 ALA MB 1 74 ASP H 3.420 . 3.420 2.408 2.356 2.460 . 0 0 "[ . 1 . 2]" 1
560 1 73 ALA H 1 74 ASP H 3.610 . 3.610 2.810 2.739 2.870 . 0 0 "[ . 1 . 2]" 1
561 1 74 ASP H 1 75 TYR H 3.860 . 3.860 2.560 2.491 2.604 . 0 0 "[ . 1 . 2]" 1
562 1 75 TYR QB 1 76 SER H 3.580 . 3.580 2.506 2.334 2.595 . 0 0 "[ . 1 . 2]" 1
563 1 75 TYR HB3 1 76 SER H 4.150 . 4.150 2.543 2.362 2.635 . 0 0 "[ . 1 . 2]" 1
564 1 75 TYR HB2 1 76 SER H 4.150 . 4.150 3.786 3.615 3.932 . 0 0 "[ . 1 . 2]" 1
565 1 75 TYR QD 1 76 SER H 4.100 . 4.100 3.676 3.327 3.931 . 0 0 "[ . 1 . 2]" 1
566 1 75 TYR H 1 76 SER H 3.810 . 3.810 2.684 2.524 2.771 . 0 0 "[ . 1 . 2]" 1
567 1 76 SER HA 1 77 ALA HA 4.910 . 4.910 4.615 4.594 4.639 . 0 0 "[ . 1 . 2]" 1
568 1 76 SER HA 1 77 ALA H 3.550 . 3.550 3.419 3.358 3.480 . 0 0 "[ . 1 . 2]" 1
569 1 76 SER QB 1 77 ALA HA 5.180 . 5.180 4.139 3.986 4.377 . 0 0 "[ . 1 . 2]" 1
570 1 76 SER QB 1 77 ALA MB 3.920 . 3.920 3.751 3.578 3.921 0.001 5 0 "[ . 1 . 2]" 1
571 1 76 SER QB 1 77 ALA H 3.770 . 3.770 3.090 2.799 3.268 . 0 0 "[ . 1 . 2]" 1
572 1 76 SER H 1 77 ALA MB 4.140 . 4.140 4.188 4.092 4.249 0.109 16 0 "[ . 1 . 2]" 1
573 1 76 SER H 1 77 ALA H 3.590 . 3.590 2.539 2.474 2.576 . 0 0 "[ . 1 . 2]" 1
574 1 77 ALA MB 1 78 ARG QB 3.930 . 3.930 3.516 3.133 3.947 0.017 13 0 "[ . 1 . 2]" 1
575 1 77 ALA MB 1 78 ARG H 3.420 . 3.420 2.431 2.227 2.570 . 0 0 "[ . 1 . 2]" 1
576 1 77 ALA H 1 78 ARG QB 4.610 . 4.610 4.523 4.185 4.810 0.200 1 0 "[ . 1 . 2]" 1
577 1 77 ALA H 1 78 ARG H 3.580 . 3.580 2.357 2.248 2.466 . 0 0 "[ . 1 . 2]" 1
578 1 78 ARG QB 1 79 GLY H 3.690 . 3.690 2.925 2.607 3.710 0.020 1 0 "[ . 1 . 2]" 1
579 1 78 ARG HB3 1 79 GLY H 4.300 . 4.300 3.533 2.801 4.174 . 0 0 "[ . 1 . 2]" 1
580 1 78 ARG HB2 1 79 GLY H 4.300 . 4.300 3.434 2.656 4.155 . 0 0 "[ . 1 . 2]" 1
581 1 78 ARG QG 1 79 GLY H 4.530 . 4.530 4.038 2.653 4.637 0.107 6 0 "[ . 1 . 2]" 1
582 1 78 ARG H 1 79 GLY QA 4.220 . 4.220 3.947 3.742 4.132 . 0 0 "[ . 1 . 2]" 1
583 1 78 ARG H 1 79 GLY H 3.520 . 3.520 1.999 1.767 2.170 . 0 0 "[ . 1 . 2]" 1
584 1 79 GLY H 1 80 TRP H 4.230 . 4.230 2.795 2.578 2.983 . 0 0 "[ . 1 . 2]" 1
585 1 80 TRP HE1 1 81 ALA MB 4.210 . 4.210 3.927 3.651 4.231 0.021 19 0 "[ . 1 . 2]" 1
586 1 80 TRP HH2 1 81 ALA MB 4.210 . 4.210 4.057 3.790 4.263 0.053 13 0 "[ . 1 . 2]" 1
587 1 80 TRP HZ2 1 81 ALA MB 3.720 . 3.720 3.749 3.654 3.813 0.093 19 0 "[ . 1 . 2]" 1
588 1 81 ALA MB 1 82 MET H 4.010 . 4.010 3.196 2.710 3.705 . 0 0 "[ . 1 . 2]" 1
589 1 82 MET HA 1 83 ASN H 2.990 . 2.990 2.761 2.330 3.130 0.140 16 0 "[ . 1 . 2]" 1
590 1 82 MET QB 1 83 ASN H 4.110 . 4.110 3.812 3.459 4.035 . 0 0 "[ . 1 . 2]" 1
591 1 82 MET H 1 83 ASN QB 4.390 . 4.390 4.082 3.273 4.439 0.049 15 0 "[ . 1 . 2]" 1
592 1 83 ASN HA 1 84 SER H 3.310 . 3.310 2.311 2.194 2.451 . 0 0 "[ . 1 . 2]" 1
593 1 83 ASN QB 1 84 SER H 4.190 . 4.190 2.870 2.396 3.590 . 0 0 "[ . 1 . 2]" 1
594 1 84 SER HA 1 85 LEU QB 4.680 . 4.680 4.340 4.137 4.530 . 0 0 "[ . 1 . 2]" 1
595 1 84 SER HA 1 85 LEU HG 4.790 . 4.790 4.001 3.634 4.373 . 0 0 "[ . 1 . 2]" 1
596 1 84 SER HA 1 85 LEU H 3.290 . 3.290 2.358 2.154 2.749 . 0 0 "[ . 1 . 2]" 1
597 1 84 SER QB 1 85 LEU H 3.560 . 3.560 2.930 1.854 3.640 0.080 9 0 "[ . 1 . 2]" 1
598 1 84 SER HB3 1 85 LEU H 4.120 . 4.120 3.324 1.871 4.158 0.038 8 0 "[ . 1 . 2]" 1
599 1 84 SER HB2 1 85 LEU H 4.120 . 4.120 3.628 2.232 4.168 0.048 13 0 "[ . 1 . 2]" 1
600 1 85 LEU QB 1 86 PHE H 3.740 . 3.740 3.039 2.101 3.784 0.044 1 0 "[ . 1 . 2]" 1
601 1 85 LEU HB3 1 86 PHE H 4.340 . 4.340 3.971 2.117 4.380 0.040 1 0 "[ . 1 . 2]" 1
602 1 85 LEU HB2 1 86 PHE H 4.340 . 4.340 3.270 2.710 4.358 0.018 14 0 "[ . 1 . 2]" 1
603 1 85 LEU QD 1 86 PHE QD 5.310 . 5.310 4.701 3.069 5.325 0.015 17 0 "[ . 1 . 2]" 1
604 1 85 LEU QD 1 86 PHE H 3.960 . 3.960 3.422 2.388 3.955 . 0 0 "[ . 1 . 2]" 1
605 1 86 PHE HA 1 87 ASP H 3.470 . 3.470 2.898 2.099 3.520 0.050 16 0 "[ . 1 . 2]" 1
606 1 86 PHE QD 1 87 ASP H 4.410 . 4.410 3.816 2.792 4.526 0.116 13 0 "[ . 1 . 2]" 1
607 1 89 ILE HB 1 90 GLY H 4.260 . 4.260 2.697 2.478 3.051 . 0 0 "[ . 1 . 2]" 1
608 1 89 ILE QG 1 90 GLY H 4.320 . 4.320 4.191 3.901 4.513 0.193 20 0 "[ . 1 . 2]" 1
609 1 89 ILE MG 1 90 GLY QA 4.010 . 4.010 3.300 2.956 3.628 . 0 0 "[ . 1 . 2]" 1
610 1 89 ILE MG 1 90 GLY H 4.090 . 4.090 3.381 3.021 3.700 . 0 0 "[ . 1 . 2]" 1
611 1 89 ILE H 1 90 GLY H 3.930 . 3.930 2.656 2.509 2.789 . 0 0 "[ . 1 . 2]" 1
612 1 90 GLY H 1 91 PRO QD 3.520 . 3.520 2.286 2.203 2.360 . 0 0 "[ . 1 . 2]" 1
613 1 90 GLY H 1 91 PRO HD3 4.100 . 4.100 3.645 3.530 3.738 . 0 0 "[ . 1 . 2]" 1
614 1 90 GLY H 1 91 PRO HD2 4.100 . 4.100 2.310 2.224 2.386 . 0 0 "[ . 1 . 2]" 1
615 1 90 GLY H 1 91 PRO QG 4.410 . 4.410 4.086 4.009 4.135 . 0 0 "[ . 1 . 2]" 1
616 1 91 PRO QB 1 92 LEU H 4.240 . 4.240 3.190 3.072 3.266 . 0 0 "[ . 1 . 2]" 1
617 1 91 PRO HD3 1 92 LEU H 4.300 . 4.300 4.045 3.997 4.080 . 0 0 "[ . 1 . 2]" 1
618 1 91 PRO HD2 1 92 LEU H 4.300 . 4.300 3.021 2.959 3.084 . 0 0 "[ . 1 . 2]" 1
619 1 91 PRO QG 1 92 LEU HA 4.250 . 4.250 4.302 4.275 4.332 0.082 11 0 "[ . 1 . 2]" 1
620 1 92 LEU QB 1 93 LEU H 4.260 . 4.260 2.263 2.162 2.391 . 0 0 "[ . 1 . 2]" 1
621 1 92 LEU QD 1 93 LEU H 4.430 . 4.430 3.559 3.355 3.805 . 0 0 "[ . 1 . 2]" 1
622 1 92 LEU HG 1 93 LEU H 3.980 . 3.980 3.526 3.205 3.994 0.014 4 0 "[ . 1 . 2]" 1
623 1 92 LEU H 1 93 LEU H 3.930 . 3.930 2.802 2.706 2.890 . 0 0 "[ . 1 . 2]" 1
624 1 93 LEU HA 1 94 ALA MB 5.230 . 5.230 5.007 4.971 5.031 . 0 0 "[ . 1 . 2]" 1
625 1 93 LEU H 1 94 ALA H 3.900 . 3.900 2.641 2.566 2.763 . 0 0 "[ . 1 . 2]" 1
626 1 94 ALA MB 1 95 ASP QB 4.600 . 4.600 4.019 3.677 4.320 . 0 0 "[ . 1 . 2]" 1
627 1 94 ALA MB 1 95 ASP H 3.370 . 3.370 2.348 2.236 2.468 . 0 0 "[ . 1 . 2]" 1
628 1 94 ALA H 1 95 ASP H 3.760 . 3.760 2.738 2.651 2.813 . 0 0 "[ . 1 . 2]" 1
629 1 95 ASP QB 1 96 LEU H 3.700 . 3.700 2.593 2.306 3.389 . 0 0 "[ . 1 . 2]" 1
630 1 95 ASP HB3 1 96 LEU H 4.270 . 4.270 3.273 2.336 4.161 . 0 0 "[ . 1 . 2]" 1
631 1 95 ASP HB2 1 96 LEU H 4.270 . 4.270 2.878 2.365 3.589 . 0 0 "[ . 1 . 2]" 1
632 1 95 ASP H 1 96 LEU QD 4.760 . 4.760 4.488 3.934 4.829 0.069 5 0 "[ . 1 . 2]" 1
633 1 95 ASP H 1 96 LEU H 3.910 . 3.910 2.736 2.599 2.911 . 0 0 "[ . 1 . 2]" 1
634 1 96 LEU QB 1 97 ARG H 4.140 . 4.140 2.488 2.275 2.699 . 0 0 "[ . 1 . 2]" 1
635 1 96 LEU QD 1 97 ARG H 4.510 . 4.510 3.963 3.870 4.078 . 0 0 "[ . 1 . 2]" 1
636 1 96 LEU HG 1 97 ARG H 5.040 . 5.040 4.676 4.181 5.092 0.052 19 0 "[ . 1 . 2]" 1
637 1 96 LEU H 1 97 ARG QB 4.770 . 4.770 4.569 4.407 4.874 0.104 6 0 "[ . 1 . 2]" 1
638 1 96 LEU H 1 97 ARG H 4.110 . 4.110 2.804 2.709 2.966 . 0 0 "[ . 1 . 2]" 1
639 1 97 ARG QB 1 98 THR H 3.680 . 3.680 2.715 2.498 3.567 . 0 0 "[ . 1 . 2]" 1
640 1 97 ARG H 1 98 THR H 3.800 . 3.800 2.598 2.521 2.638 . 0 0 "[ . 1 . 2]" 1
641 1 98 THR HB 1 99 ALA MB 4.110 . 4.110 3.928 3.840 4.047 . 0 0 "[ . 1 . 2]" 1
642 1 98 THR HB 1 99 ALA H 3.840 . 3.840 2.697 2.601 2.782 . 0 0 "[ . 1 . 2]" 1
643 1 98 THR MG 1 99 ALA MB 4.010 . 4.010 4.066 4.014 4.106 0.096 8 0 "[ . 1 . 2]" 1
644 1 98 THR MG 1 99 ALA H 3.790 . 3.790 3.525 3.458 3.586 . 0 0 "[ . 1 . 2]" 1
645 1 98 THR H 1 99 ALA H 3.720 . 3.720 2.666 2.561 2.750 . 0 0 "[ . 1 . 2]" 1
646 1 99 ALA HA 1 100 GLY HA3 4.570 . 4.570 4.457 4.412 4.503 . 0 0 "[ . 1 . 2]" 1
647 1 99 ALA MB 1 100 GLY H 4.190 . 4.190 3.083 2.917 3.299 . 0 0 "[ . 1 . 2]" 1
648 1 99 ALA H 1 100 GLY H 3.760 . 3.760 2.591 2.507 2.636 . 0 0 "[ . 1 . 2]" 1
649 1 100 GLY H 1 101 VAL HB 4.840 . 4.840 4.854 4.573 4.959 0.119 12 0 "[ . 1 . 2]" 1
650 1 100 GLY H 1 101 VAL H 3.770 . 3.770 2.382 2.208 2.511 . 0 0 "[ . 1 . 2]" 1
651 1 101 VAL HA 1 102 ARG HA 4.540 . 4.540 4.358 4.330 4.403 . 0 0 "[ . 1 . 2]" 1
652 1 101 VAL QG 1 102 ARG H 3.600 . 3.600 2.377 2.125 2.817 . 0 0 "[ . 1 . 2]" 1
653 1 102 ARG HA 1 103 LEU QD 3.990 . 3.990 3.193 2.715 4.041 0.051 19 0 "[ . 1 . 2]" 1
654 1 102 ARG HA 1 103 LEU H 3.460 . 3.460 2.185 2.131 2.225 . 0 0 "[ . 1 . 2]" 1
655 1 102 ARG QB 1 103 LEU QD 4.330 . 4.330 4.126 3.888 4.408 0.078 19 0 "[ . 1 . 2]" 1
656 1 102 ARG QB 1 103 LEU H 3.890 . 3.890 3.338 3.021 3.886 . 0 0 "[ . 1 . 2]" 1
657 1 103 LEU HA 1 104 ALA MB 4.030 . 4.030 3.913 3.868 4.003 . 0 0 "[ . 1 . 2]" 1
658 1 103 LEU HA 1 104 ALA H 3.530 . 3.530 2.257 2.189 2.392 . 0 0 "[ . 1 . 2]" 1
659 1 103 LEU QB 1 104 ALA HA 4.150 . 4.150 3.931 3.818 4.113 . 0 0 "[ . 1 . 2]" 1
660 1 104 ALA HA 1 105 VAL QG 4.190 . 4.190 3.410 3.109 3.943 . 0 0 "[ . 1 . 2]" 1
661 1 104 ALA MB 1 105 VAL HA 4.210 . 4.210 4.087 3.909 4.268 0.058 12 0 "[ . 1 . 2]" 1
662 1 104 ALA MB 1 105 VAL H 3.460 . 3.460 2.491 2.174 3.010 . 0 0 "[ . 1 . 2]" 1
663 1 104 ALA H 1 105 VAL HA 4.790 . 4.790 4.651 4.466 4.819 0.029 12 0 "[ . 1 . 2]" 1
664 1 104 ALA H 1 105 VAL QG 5.320 . 5.320 4.597 3.955 5.160 . 0 0 "[ . 1 . 2]" 1
665 1 105 VAL HA 1 106 ALA H 3.440 . 3.440 2.178 2.100 2.277 . 0 0 "[ . 1 . 2]" 1
666 1 105 VAL HB 1 106 ALA H 4.170 . 4.170 3.893 2.791 4.237 0.067 18 0 "[ . 1 . 2]" 1
667 1 105 VAL QG 1 106 ALA HA 4.190 . 4.190 3.366 3.077 3.988 . 0 0 "[ . 1 . 2]" 1
668 1 105 VAL QG 1 106 ALA H 3.450 . 3.450 2.609 2.284 3.430 . 0 0 "[ . 1 . 2]" 1
669 1 105 VAL MG1 1 106 ALA H 4.410 . 4.410 3.140 2.337 4.103 . 0 0 "[ . 1 . 2]" 1
670 1 105 VAL MG2 1 106 ALA H 4.410 . 4.410 3.474 2.319 4.231 . 0 0 "[ . 1 . 2]" 1
671 1 106 ALA MB 1 107 THR H 3.690 . 3.690 3.484 3.245 3.667 . 0 0 "[ . 1 . 2]" 1
672 1 110 ALA MB 1 111 GLU H 4.280 . 4.280 2.756 2.478 3.211 . 0 0 "[ . 1 . 2]" 1
673 1 111 GLU QB 1 112 PRO QD 3.820 . 3.820 2.040 1.671 3.286 0.029 5 0 "[ . 1 . 2]" 1
674 1 111 GLU H 1 112 PRO QD 4.090 . 4.090 2.204 1.891 2.516 . 0 0 "[ . 1 . 2]" 1
675 1 111 GLU H 1 112 PRO QG 4.450 . 4.450 4.067 3.716 4.446 . 0 0 "[ . 1 . 2]" 1
676 1 115 ARG QB 1 116 ARG H 3.440 . 3.440 2.772 2.370 3.538 0.098 6 0 "[ . 1 . 2]" 1
677 1 116 ARG H 1 117 ILE H 4.080 . 4.080 2.655 2.483 2.773 . 0 0 "[ . 1 . 2]" 1
678 1 118 LEU H 1 119 ARG H 4.160 . 4.160 2.658 2.544 2.758 . 0 0 "[ . 1 . 2]" 1
679 1 120 HIS QB 1 121 PHE QD 4.360 . 4.360 3.557 2.690 4.106 . 0 0 "[ . 1 . 2]" 1
680 1 120 HIS H 1 121 PHE QD 5.370 . 5.370 4.851 4.014 5.293 . 0 0 "[ . 1 . 2]" 1
681 1 120 HIS H 1 121 PHE H 4.230 . 4.230 2.820 2.631 3.012 . 0 0 "[ . 1 . 2]" 1
682 1 121 PHE H 1 122 GLY H 3.930 . 3.930 2.425 2.318 2.602 . 0 0 "[ . 1 . 2]" 1
683 1 122 GLY QA 1 123 ILE MG 4.150 . 4.150 3.840 3.706 3.971 . 0 0 "[ . 1 . 2]" 1
684 1 122 GLY H 1 123 ILE MG 4.120 . 4.120 3.977 3.722 4.162 0.042 10 0 "[ . 1 . 2]" 1
685 1 123 ILE H 1 124 GLU H 4.030 . 4.030 2.276 2.120 2.384 . 0 0 "[ . 1 . 2]" 1
686 1 124 GLU QB 1 125 GLN H 4.150 . 4.150 2.554 2.212 3.517 . 0 0 "[ . 1 . 2]" 1
687 1 125 GLN H 1 126 HIS H 4.250 . 4.250 2.675 2.480 2.845 . 0 0 "[ . 1 . 2]" 1
688 1 126 HIS H 1 127 PHE H 3.950 . 3.950 2.366 2.275 2.438 . 0 0 "[ . 1 . 2]" 1
689 1 127 PHE HA 1 128 GLU HB3 4.860 . 4.860 4.758 4.486 4.986 0.126 7 0 "[ . 1 . 2]" 1
690 1 127 PHE HA 1 128 GLU H 3.450 . 3.450 2.210 2.116 2.365 . 0 0 "[ . 1 . 2]" 1
691 1 127 PHE QD 1 128 GLU H 4.240 . 4.240 3.634 2.888 3.994 . 0 0 "[ . 1 . 2]" 1
692 1 128 GLU HB3 1 129 VAL QG 4.120 . 4.120 2.885 2.434 3.256 . 0 0 "[ . 1 . 2]" 1
693 1 128 GLU HB3 1 129 VAL H 3.750 . 3.750 2.249 1.813 2.617 . 0 0 "[ . 1 . 2]" 1
694 1 128 GLU HB2 1 129 VAL H 4.270 . 4.270 3.617 3.313 3.892 . 0 0 "[ . 1 . 2]" 1
695 1 128 GLU QG 1 129 VAL HA 4.430 . 4.430 4.111 3.693 4.557 0.127 4 0 "[ . 1 . 2]" 1
696 1 128 GLU QG 1 129 VAL QG 3.700 . 3.700 2.391 1.664 3.719 0.036 6 0 "[ . 1 . 2]" 1
697 1 128 GLU QG 1 129 VAL H 4.470 . 4.470 3.444 3.000 3.800 . 0 0 "[ . 1 . 2]" 1
698 1 128 GLU H 1 129 VAL H 3.610 . 3.610 2.672 2.159 2.973 . 0 0 "[ . 1 . 2]" 1
699 1 129 VAL HA 1 130 ILE H 3.250 . 3.250 2.163 2.105 2.290 . 0 0 "[ . 1 . 2]" 1
700 1 129 VAL QG 1 130 ILE H 3.620 . 3.620 2.674 2.228 3.033 . 0 0 "[ . 1 . 2]" 1
701 1 129 VAL MG1 1 130 ILE H 4.230 . 4.230 2.958 2.524 3.792 . 0 0 "[ . 1 . 2]" 1
702 1 129 VAL MG2 1 130 ILE H 4.230 . 4.230 3.734 2.253 4.190 . 0 0 "[ . 1 . 2]" 1
703 1 129 VAL H 1 130 ILE HA 5.110 . 5.110 4.780 4.596 5.000 . 0 0 "[ . 1 . 2]" 1
704 1 130 ILE HA 1 131 ALA MB 4.270 . 4.270 4.091 3.982 4.180 . 0 0 "[ . 1 . 2]" 1
705 1 130 ILE HA 1 131 ALA H 3.490 . 3.490 2.193 2.142 2.256 . 0 0 "[ . 1 . 2]" 1
706 1 130 ILE MD 1 131 ALA H 4.970 . 4.970 4.240 3.943 4.934 . 0 0 "[ . 1 . 2]" 1
707 1 130 ILE MG 1 131 ALA MB 4.680 . 4.680 4.402 4.184 4.582 . 0 0 "[ . 1 . 2]" 1
708 1 130 ILE MG 1 131 ALA H 3.850 . 3.850 3.177 2.666 3.407 . 0 0 "[ . 1 . 2]" 1
709 1 131 ALA MB 1 132 GLY H 3.960 . 3.960 3.181 2.411 3.555 . 0 0 "[ . 1 . 2]" 1
710 1 133 ALA MB 1 134 SER H 4.040 . 4.040 2.798 1.994 3.448 . 0 0 "[ . 1 . 2]" 1
711 1 145 VAL QG 1 146 LEU H 4.140 . 4.140 2.961 1.754 3.196 . 0 0 "[ . 1 . 2]" 1
712 1 146 LEU HA 1 147 ALA MB 5.070 . 5.070 5.037 5.015 5.062 . 0 0 "[ . 1 . 2]" 1
713 1 146 LEU QD 1 147 ALA H 4.190 . 4.190 3.945 3.757 4.052 . 0 0 "[ . 1 . 2]" 1
714 1 146 LEU HG 1 147 ALA H 4.490 . 4.490 4.056 3.801 4.274 . 0 0 "[ . 1 . 2]" 1
715 1 147 ALA MB 1 148 HIS HA 4.310 . 4.310 3.804 3.759 3.854 . 0 0 "[ . 1 . 2]" 1
716 1 147 ALA MB 1 148 HIS H 3.660 . 3.660 2.492 2.335 2.664 . 0 0 "[ . 1 . 2]" 1
717 1 148 HIS QB 1 149 ALA H 3.700 . 3.700 2.638 2.352 2.880 . 0 0 "[ . 1 . 2]" 1
718 1 148 HIS HB3 1 149 ALA H 4.290 . 4.290 2.951 2.377 3.796 . 0 0 "[ . 1 . 2]" 1
719 1 148 HIS HB2 1 149 ALA H 4.290 . 4.290 3.516 2.727 3.966 . 0 0 "[ . 1 . 2]" 1
720 1 148 HIS H 1 149 ALA MB 4.510 . 4.510 4.320 4.223 4.480 . 0 0 "[ . 1 . 2]" 1
721 1 148 HIS H 1 149 ALA H 4.020 . 4.020 2.651 2.563 2.839 . 0 0 "[ . 1 . 2]" 1
722 1 149 ALA MB 1 150 LEU H 3.620 . 3.620 2.454 2.339 2.565 . 0 0 "[ . 1 . 2]" 1
723 1 149 ALA H 1 150 LEU H 4.100 . 4.100 2.663 2.597 2.739 . 0 0 "[ . 1 . 2]" 1
724 1 150 LEU QB 1 151 ALA H 3.780 . 3.780 2.763 2.557 2.939 . 0 0 "[ . 1 . 2]" 1
725 1 150 LEU QD 1 151 ALA H 5.290 . 5.290 4.022 3.876 4.183 . 0 0 "[ . 1 . 2]" 1
726 1 150 LEU H 1 151 ALA H 3.970 . 3.970 2.579 2.514 2.673 . 0 0 "[ . 1 . 2]" 1
727 1 151 ALA MB 1 152 GLN QB 4.650 . 4.650 4.175 3.745 4.582 . 0 0 "[ . 1 . 2]" 1
728 1 151 ALA MB 1 152 GLN H 3.630 . 3.630 2.811 2.702 2.965 . 0 0 "[ . 1 . 2]" 1
729 1 151 ALA H 1 152 GLN H 3.790 . 3.790 2.550 2.511 2.628 . 0 0 "[ . 1 . 2]" 1
730 1 152 GLN QB 1 153 LEU H 4.220 . 4.220 2.677 2.402 2.858 . 0 0 "[ . 1 . 2]" 1
731 1 152 GLN H 1 153 LEU H 3.590 . 3.590 2.510 2.401 2.687 . 0 0 "[ . 1 . 2]" 1
732 1 153 LEU QB 1 154 ARG H 4.370 . 4.370 3.999 3.914 4.042 . 0 0 "[ . 1 . 2]" 1
733 1 153 LEU HG 1 154 ARG HA 4.620 . 4.620 4.645 4.280 4.705 0.085 17 0 "[ . 1 . 2]" 1
734 1 153 LEU H 1 154 ARG H 3.450 . 3.450 2.774 2.490 2.983 . 0 0 "[ . 1 . 2]" 1
735 1 154 ARG HA 1 155 PRO HA 3.640 . 3.640 2.417 2.223 2.760 . 0 0 "[ . 1 . 2]" 1
736 1 154 ARG HA 1 155 PRO QB 4.520 . 4.520 3.994 3.920 4.124 . 0 0 "[ . 1 . 2]" 1
737 1 154 ARG HA 1 155 PRO QD 4.240 . 4.240 3.997 3.955 4.034 . 0 0 "[ . 1 . 2]" 1
738 1 154 ARG QB 1 155 PRO HA 3.500 . 3.500 2.053 1.689 2.367 0.011 11 0 "[ . 1 . 2]" 1
739 1 154 ARG QB 1 155 PRO QB 3.860 . 3.860 3.645 3.379 3.846 . 0 0 "[ . 1 . 2]" 1
740 1 154 ARG QB 1 155 PRO HB3 4.740 . 4.740 3.818 3.549 4.038 . 0 0 "[ . 1 . 2]" 1
741 1 154 ARG QB 1 155 PRO HB2 4.740 . 4.740 4.621 4.245 4.834 0.094 12 0 "[ . 1 . 2]" 1
742 1 154 ARG QB 1 155 PRO QD 4.560 . 4.560 3.781 3.694 3.936 . 0 0 "[ . 1 . 2]" 1
743 1 154 ARG QB 1 155 PRO QG 5.170 . 5.170 4.308 3.805 4.738 . 0 0 "[ . 1 . 2]" 1
744 1 154 ARG QD 1 155 PRO HA 3.840 . 3.840 3.806 3.447 4.065 0.225 20 0 "[ . 1 . 2]" 1
745 1 154 ARG QG 1 155 PRO HA 4.100 . 4.100 3.076 2.317 3.937 . 0 0 "[ . 1 . 2]" 1
746 1 154 ARG H 1 155 PRO HA 4.690 . 4.690 4.732 4.669 4.811 0.121 7 0 "[ . 1 . 2]" 1
747 1 155 PRO HA 1 156 LEU QD 4.730 . 4.730 3.266 2.684 4.070 . 0 0 "[ . 1 . 2]" 1
748 1 155 PRO QB 1 156 LEU QD 4.390 . 4.390 4.147 3.656 4.552 0.162 15 0 "[ . 1 . 2]" 1
749 1 155 PRO QB 1 156 LEU H 3.740 . 3.740 2.669 2.382 3.009 . 0 0 "[ . 1 . 2]" 1
750 1 158 GLU H 1 159 ARG H 3.860 . 3.860 2.522 1.905 3.033 . 0 0 "[ . 1 . 2]" 1
751 1 160 LEU HA 1 161 VAL QG 3.960 . 3.960 3.591 3.285 3.687 . 0 0 "[ . 1 . 2]" 1
752 1 160 LEU HA 1 161 VAL H 3.460 . 3.460 2.275 2.228 2.526 . 0 0 "[ . 1 . 2]" 1
753 1 160 LEU QB 1 161 VAL H 4.270 . 4.270 3.218 2.369 3.577 . 0 0 "[ . 1 . 2]" 1
754 1 160 LEU QD 1 161 VAL H 3.960 . 3.960 1.994 1.725 2.514 . 0 0 "[ . 1 . 2]" 1
755 1 161 VAL QG 1 162 MET H 3.350 . 3.350 2.423 2.159 2.589 . 0 0 "[ . 1 . 2]" 1
756 1 161 VAL MG1 1 162 MET H 4.250 . 4.250 3.865 3.625 4.016 . 0 0 "[ . 1 . 2]" 1
757 1 161 VAL MG2 1 162 MET H 4.250 . 4.250 2.448 2.175 2.624 . 0 0 "[ . 1 . 2]" 1
758 1 162 MET ME 1 163 VAL HB 4.760 . 4.760 4.612 4.205 4.876 0.116 16 0 "[ . 1 . 2]" 1
759 1 162 MET ME 1 163 VAL QG 4.440 . 4.440 4.267 3.244 4.496 0.056 7 0 "[ . 1 . 2]" 1
760 1 162 MET QG 1 163 VAL H 4.150 . 4.150 3.101 2.512 3.546 . 0 0 "[ . 1 . 2]" 1
761 1 162 MET H 1 163 VAL QG 4.160 . 4.160 4.233 4.172 4.323 0.163 2 0 "[ . 1 . 2]" 1
762 1 163 VAL HA 1 164 GLY QA 4.010 . 4.010 3.903 3.863 3.922 . 0 0 "[ . 1 . 2]" 1
763 1 163 VAL QG 1 164 GLY H 3.750 . 3.750 2.897 2.612 3.599 . 0 0 "[ . 1 . 2]" 1
764 1 163 VAL MG1 1 164 GLY H 4.360 . 4.360 2.972 2.646 3.934 . 0 0 "[ . 1 . 2]" 1
765 1 163 VAL MG2 1 164 GLY H 4.360 . 4.360 4.098 3.962 4.253 . 0 0 "[ . 1 . 2]" 1
766 1 164 GLY QA 1 165 ASP HA 4.040 . 4.040 3.961 3.933 3.992 . 0 0 "[ . 1 . 2]" 1
767 1 165 ASP H 1 166 ARG H 3.860 . 3.860 2.013 1.617 3.397 0.083 1 0 "[ . 1 . 2]" 1
768 1 169 ASP HA 1 170 VAL HA 4.840 . 4.840 4.773 4.705 4.833 . 0 0 "[ . 1 . 2]" 1
769 1 169 ASP QB 1 170 VAL HB 5.000 . 5.000 4.946 3.955 5.275 0.275 6 0 "[ . 1 . 2]" 1
770 1 169 ASP H 1 170 VAL H 3.890 . 3.890 2.417 2.254 2.661 . 0 0 "[ . 1 . 2]" 1
771 1 170 VAL HB 1 171 ASP H 4.290 . 4.290 3.072 2.454 4.012 . 0 0 "[ . 1 . 2]" 1
772 1 170 VAL QG 1 171 ASP HA 4.180 . 4.180 3.257 3.051 3.635 . 0 0 "[ . 1 . 2]" 1
773 1 170 VAL QG 1 171 ASP QB 4.230 . 4.230 3.643 2.659 4.210 . 0 0 "[ . 1 . 2]" 1
774 1 171 ASP QB 1 172 GLY QA 3.780 . 3.780 3.768 3.313 3.855 0.075 3 0 "[ . 1 . 2]" 1
775 1 171 ASP QB 1 172 GLY HA3 4.470 . 4.470 4.338 3.876 4.431 . 0 0 "[ . 1 . 2]" 1
776 1 171 ASP QB 1 172 GLY HA2 4.470 . 4.470 4.139 3.596 4.238 . 0 0 "[ . 1 . 2]" 1
777 1 171 ASP QB 1 172 GLY H 4.520 . 4.520 2.492 2.083 2.776 . 0 0 "[ . 1 . 2]" 1
778 1 173 ALA MB 1 174 ALA MB 4.130 . 4.130 3.681 3.623 3.740 . 0 0 "[ . 1 . 2]" 1
779 1 173 ALA MB 1 174 ALA H 3.830 . 3.830 2.520 2.430 2.610 . 0 0 "[ . 1 . 2]" 1
780 1 173 ALA H 1 174 ALA H 4.000 . 4.000 2.668 2.622 2.714 . 0 0 "[ . 1 . 2]" 1
781 1 174 ALA MB 1 175 ALA MB 4.520 . 4.520 3.793 3.684 3.944 . 0 0 "[ . 1 . 2]" 1
782 1 174 ALA MB 1 175 ALA H 3.430 . 3.430 2.649 2.491 2.807 . 0 0 "[ . 1 . 2]" 1
783 1 174 ALA H 1 175 ALA MB 4.300 . 4.300 4.248 4.167 4.313 0.013 13 0 "[ . 1 . 2]" 1
784 1 174 ALA H 1 175 ALA H 3.770 . 3.770 2.561 2.480 2.612 . 0 0 "[ . 1 . 2]" 1
785 1 175 ALA MB 1 176 HIS H 3.800 . 3.800 2.837 2.711 2.980 . 0 0 "[ . 1 . 2]" 1
786 1 176 HIS QB 1 177 GLY H 4.390 . 4.390 3.501 3.294 3.642 . 0 0 "[ . 1 . 2]" 1
787 1 176 HIS H 1 177 GLY H 3.520 . 3.520 2.389 2.206 2.490 . 0 0 "[ . 1 . 2]" 1
788 1 177 GLY QA 1 178 ILE MD 4.610 . 4.610 4.532 3.406 4.649 0.039 15 0 "[ . 1 . 2]" 1
789 1 177 GLY HA3 1 178 ILE MD 5.230 . 5.230 4.953 3.689 5.163 . 0 0 "[ . 1 . 2]" 1
790 1 177 GLY HA2 1 178 ILE MD 5.230 . 5.230 5.256 4.002 5.392 0.162 18 0 "[ . 1 . 2]" 1
791 1 177 GLY H 1 178 ILE HB 5.460 . 5.460 4.674 4.509 4.797 . 0 0 "[ . 1 . 2]" 1
792 1 178 ILE HB 1 179 ASP H 4.540 . 4.540 4.125 3.994 4.340 . 0 0 "[ . 1 . 2]" 1
793 1 178 ILE MG 1 179 ASP H 3.880 . 3.880 2.521 2.342 2.978 . 0 0 "[ . 1 . 2]" 1
794 1 188 GLY H 1 189 ARG H 4.620 . 4.620 4.010 2.277 4.605 . 0 0 "[ . 1 . 2]" 1
795 1 189 ARG QB 1 190 ALA MB 4.200 . 4.200 3.709 3.322 4.420 0.220 4 0 "[ . 1 . 2]" 1
796 1 189 ARG HB3 1 190 ALA H 4.200 . 4.200 2.867 1.951 4.274 0.074 17 0 "[ . 1 . 2]" 1
797 1 189 ARG HB2 1 190 ALA H 4.200 . 4.200 3.783 3.248 4.086 . 0 0 "[ . 1 . 2]" 1
798 1 189 ARG QG 1 190 ALA MB 3.990 . 3.990 3.477 2.687 4.165 0.175 13 0 "[ . 1 . 2]" 1
799 1 190 ALA MB 1 191 ASP HA 4.190 . 4.190 4.149 3.882 4.314 0.124 15 0 "[ . 1 . 2]" 1
800 1 190 ALA MB 1 191 ASP H 3.750 . 3.750 3.471 2.151 3.712 . 0 0 "[ . 1 . 2]" 1
801 1 190 ALA H 1 191 ASP H 3.890 . 3.890 2.828 2.244 3.226 . 0 0 "[ . 1 . 2]" 1
802 1 191 ASP HA 1 192 PHE QD 4.940 . 4.940 4.337 2.784 5.009 0.069 12 0 "[ . 1 . 2]" 1
803 1 191 ASP QB 1 192 PHE QD 4.100 . 4.100 2.670 1.983 4.028 . 0 0 "[ . 1 . 2]" 1
804 1 191 ASP QB 1 192 PHE QE 4.250 . 4.250 3.582 2.601 4.312 0.062 9 0 "[ . 1 . 2]" 1
805 1 191 ASP H 1 192 PHE QD 5.070 . 5.070 4.349 3.209 5.250 0.180 16 0 "[ . 1 . 2]" 1
806 1 204 ALA HA 1 205 ALA H 3.520 . 3.520 2.134 2.092 2.206 . 0 0 "[ . 1 . 2]" 1
807 1 204 ALA MB 1 205 ALA H 4.160 . 4.160 3.183 2.900 3.457 . 0 0 "[ . 1 . 2]" 1
808 1 205 ALA MB 1 206 THR MG 3.470 . 3.470 3.192 2.962 3.459 . 0 0 "[ . 1 . 2]" 1
809 1 205 ALA MB 1 206 THR H 3.640 . 3.640 2.526 2.185 2.871 . 0 0 "[ . 1 . 2]" 1
810 1 205 ALA H 1 206 THR H 3.810 . 3.810 2.480 2.249 2.712 . 0 0 "[ . 1 . 2]" 1
811 1 206 THR HA 1 207 ILE MG 4.290 . 4.290 4.185 4.010 4.359 0.069 1 0 "[ . 1 . 2]" 1
812 1 207 ILE HB 1 208 ASP H 4.090 . 4.090 4.038 3.962 4.095 0.005 4 0 "[ . 1 . 2]" 1
813 1 207 ILE MG 1 208 ASP HA 3.890 . 3.890 3.227 3.043 3.380 . 0 0 "[ . 1 . 2]" 1
814 1 207 ILE MG 1 208 ASP H 3.640 . 3.640 2.314 2.134 2.460 . 0 0 "[ . 1 . 2]" 1
815 1 208 ASP QB 1 209 GLU H 3.350 . 3.350 2.818 2.511 3.482 0.132 5 0 "[ . 1 . 2]" 1
816 1 208 ASP HB3 1 209 GLU H 3.970 . 3.970 3.206 2.649 4.084 0.114 5 0 "[ . 1 . 2]" 1
817 1 208 ASP HB2 1 209 GLU H 3.970 . 3.970 3.556 2.567 4.019 0.049 9 0 "[ . 1 . 2]" 1
818 1 208 ASP H 1 209 GLU H 3.920 . 3.920 2.673 2.568 2.818 . 0 0 "[ . 1 . 2]" 1
819 1 209 GLU QG 1 210 LEU H 4.400 . 4.400 3.940 2.367 4.312 . 0 0 "[ . 1 . 2]" 1
820 1 209 GLU H 1 210 LEU H 4.030 . 4.030 2.451 2.369 2.531 . 0 0 "[ . 1 . 2]" 1
821 1 210 LEU QB 1 211 ARG H 3.900 . 3.900 2.406 2.131 2.694 . 0 0 "[ . 1 . 2]" 1
822 1 210 LEU H 1 211 ARG H 3.990 . 3.990 2.638 2.458 2.846 . 0 0 "[ . 1 . 2]" 1
823 1 211 ARG QB 1 212 GLU H 4.070 . 4.070 2.728 2.221 3.516 . 0 0 "[ . 1 . 2]" 1
824 1 211 ARG H 1 212 GLU H 4.170 . 4.170 2.910 2.809 3.057 . 0 0 "[ . 1 . 2]" 1
825 1 212 GLU QB 1 213 ALA MB 5.060 . 5.060 4.603 4.219 4.707 . 0 0 "[ . 1 . 2]" 1
826 1 212 GLU QB 1 213 ALA H 3.980 . 3.980 3.522 2.919 3.619 . 0 0 "[ . 1 . 2]" 1
827 1 212 GLU QG 1 213 ALA H 4.020 . 4.020 2.313 2.135 2.742 . 0 0 "[ . 1 . 2]" 1
828 1 212 GLU HG3 1 213 ALA MB 4.050 . 4.050 3.241 3.008 4.123 0.073 20 0 "[ . 1 . 2]" 1
829 1 212 GLU HG2 1 213 ALA MB 4.050 . 4.050 4.007 3.431 4.130 0.080 5 0 "[ . 1 . 2]" 1
830 1 212 GLU H 1 213 ALA H 3.870 . 3.870 2.607 2.543 2.679 . 0 0 "[ . 1 . 2]" 1
831 1 213 ALA HA 1 214 LEU QD 4.810 . 4.810 4.786 4.562 4.886 0.076 3 0 "[ . 1 . 2]" 1
832 1 213 ALA MB 1 214 LEU HB3 5.390 . 5.390 5.212 5.052 5.313 . 0 0 "[ . 1 . 2]" 1
833 1 213 ALA MB 1 214 LEU QD 3.630 . 3.630 3.116 2.899 3.206 . 0 0 "[ . 1 . 2]" 1
834 1 213 ALA MB 1 214 LEU HG 3.600 . 3.600 3.297 2.962 3.517 . 0 0 "[ . 1 . 2]" 1
835 1 213 ALA MB 1 214 LEU H 3.870 . 3.870 2.533 2.411 2.639 . 0 0 "[ . 1 . 2]" 1
836 1 213 ALA H 1 214 LEU QD 4.580 . 4.580 4.632 4.541 4.686 0.106 11 0 "[ . 1 . 2]" 1
837 1 215 GLY QA 1 216 VAL QG 4.690 . 4.690 3.824 3.499 4.142 . 0 0 "[ . 1 . 2]" 1
838 1 3 SER QB 1 7 VAL MG2 5.190 . 5.190 4.095 3.398 4.858 . 0 0 "[ . 1 . 2]" 1
839 1 4 PRO HB2 1 6 LEU H 3.860 . 3.860 2.521 2.313 2.808 . 0 0 "[ . 1 . 2]" 1
840 1 4 PRO QD 1 7 VAL MG2 4.220 . 4.220 3.013 2.449 3.301 . 0 0 "[ . 1 . 2]" 1
841 1 4 PRO QG 1 7 VAL HA 4.780 . 4.780 3.971 3.747 4.265 . 0 0 "[ . 1 . 2]" 1
842 1 4 PRO QG 1 7 VAL MG2 3.770 . 3.770 2.004 1.808 2.408 . 0 0 "[ . 1 . 2]" 1
843 1 7 VAL HB 1 9 PHE QE 4.010 . 4.010 2.872 2.477 3.332 . 0 0 "[ . 1 . 2]" 1
844 1 7 VAL MG1 1 9 PHE QD 4.130 . 4.130 3.380 3.094 3.571 . 0 0 "[ . 1 . 2]" 1
845 1 7 VAL MG1 1 9 PHE QE 3.810 . 3.810 2.770 2.427 2.907 . 0 0 "[ . 1 . 2]" 1
846 1 7 VAL MG1 1 9 PHE HZ 4.100 . 4.100 2.733 2.482 3.075 . 0 0 "[ . 1 . 2]" 1
847 1 7 VAL MG2 1 9 PHE QE 4.370 . 4.370 3.939 3.710 4.309 . 0 0 "[ . 1 . 2]" 1
848 1 7 VAL MG2 1 9 PHE HZ 4.610 . 4.610 4.179 3.808 4.629 0.019 17 0 "[ . 1 . 2]" 1
849 1 17 ASP HA 1 19 ALA H 4.050 . 4.050 3.326 2.927 4.054 0.004 19 0 "[ . 1 . 2]" 1
850 1 17 ASP QB 1 19 ALA H 4.200 . 4.200 3.977 3.197 4.331 0.131 5 0 "[ . 1 . 2]" 1
851 1 19 ALA HA 1 22 ILE HB 4.040 . 4.040 2.853 2.209 3.715 . 0 0 "[ . 1 . 2]" 1
852 1 19 ALA HA 1 22 ILE H 4.060 . 4.060 3.553 3.159 4.000 . 0 0 "[ . 1 . 2]" 1
853 1 19 ALA HA 1 23 VAL QG 4.080 . 4.080 3.595 3.067 4.229 0.149 9 0 "[ . 1 . 2]" 1
854 1 19 ALA HA 1 23 VAL H 4.440 . 4.440 3.823 3.534 4.319 . 0 0 "[ . 1 . 2]" 1
855 1 19 ALA MB 1 22 ILE HB 4.980 . 4.980 4.308 3.678 5.038 0.058 13 0 "[ . 1 . 2]" 1
856 1 20 ARG HA 1 23 VAL HB 4.210 . 4.210 3.302 2.776 4.267 0.057 9 0 "[ . 1 . 2]" 1
857 1 20 ARG HA 1 23 VAL MG1 4.450 . 4.450 3.899 1.910 4.487 0.037 5 0 "[ . 1 . 2]" 1
858 1 20 ARG HA 1 23 VAL MG2 4.450 . 4.450 3.704 2.923 4.614 0.164 2 0 "[ . 1 . 2]" 1
859 1 20 ARG QB 1 22 ILE H 4.960 . 4.960 4.651 4.426 4.925 . 0 0 "[ . 1 . 2]" 1
860 1 22 ILE HA 1 26 PHE H 4.300 . 4.300 3.927 3.733 4.197 . 0 0 "[ . 1 . 2]" 1
861 1 22 ILE HB 1 24 SER H 5.310 . 5.310 4.978 4.764 5.291 . 0 0 "[ . 1 . 2]" 1
862 1 22 ILE MG 1 26 PHE QB 4.470 . 4.470 2.957 2.579 3.255 . 0 0 "[ . 1 . 2]" 1
863 1 22 ILE MG 1 26 PHE H 4.260 . 4.260 3.847 3.648 4.130 . 0 0 "[ . 1 . 2]" 1
864 1 23 VAL HA 1 26 PHE QB 4.440 . 4.440 2.359 1.917 3.023 . 0 0 "[ . 1 . 2]" 1
865 1 23 VAL HA 1 26 PHE QD 4.010 . 4.010 2.093 1.691 2.371 0.009 7 0 "[ . 1 . 2]" 1
866 1 23 VAL HA 1 26 PHE H 4.050 . 4.050 3.508 3.263 3.670 . 0 0 "[ . 1 . 2]" 1
867 1 23 VAL HA 1 27 ARG H 4.160 . 4.160 3.945 3.701 4.179 0.019 19 0 "[ . 1 . 2]" 1
868 1 23 VAL QG 1 26 PHE QD 3.640 . 3.640 2.394 1.943 2.680 . 0 0 "[ . 1 . 2]" 1
869 1 23 VAL QG 1 26 PHE QE 4.460 . 4.460 2.842 2.077 3.488 . 0 0 "[ . 1 . 2]" 1
870 1 23 VAL QG 1 27 ARG QD 3.840 . 3.840 2.623 2.035 3.067 . 0 0 "[ . 1 . 2]" 1
871 1 23 VAL QG 1 27 ARG QG 4.050 . 4.050 2.642 2.416 3.230 . 0 0 "[ . 1 . 2]" 1
872 1 23 VAL QG 1 27 ARG H 4.730 . 4.730 3.873 3.630 4.107 . 0 0 "[ . 1 . 2]" 1
873 1 23 VAL MG1 1 27 ARG QD 5.190 . 5.190 2.858 2.038 4.619 . 0 0 "[ . 1 . 2]" 1
874 1 23 VAL MG2 1 27 ARG QD 5.190 . 5.190 4.584 2.500 5.279 0.089 4 0 "[ . 1 . 2]" 1
875 1 23 VAL H 1 26 PHE QD 5.050 . 5.050 4.819 4.434 5.101 0.051 5 0 "[ . 1 . 2]" 1
876 1 24 SER QB 1 26 PHE H 5.240 . 5.240 4.547 4.380 4.888 . 0 0 "[ . 1 . 2]" 1
877 1 24 SER H 1 26 PHE H 4.560 . 4.560 4.018 3.825 4.318 . 0 0 "[ . 1 . 2]" 1
878 1 25 SER HA 1 28 HIS QB 3.870 . 3.870 2.521 2.276 2.885 . 0 0 "[ . 1 . 2]" 1
879 1 25 SER HA 1 28 HIS H 3.930 . 3.930 3.362 3.245 3.522 . 0 0 "[ . 1 . 2]" 1
880 1 25 SER HA 1 29 ALA H 4.180 . 4.180 3.893 3.701 4.071 . 0 0 "[ . 1 . 2]" 1
881 1 26 PHE QD 1 30 LEU HB2 4.300 . 4.300 4.344 3.846 4.404 0.104 5 0 "[ . 1 . 2]" 1
882 1 26 PHE QD 1 30 LEU QD 4.250 . 4.250 2.930 2.247 3.505 . 0 0 "[ . 1 . 2]" 1
883 1 26 PHE QE 1 30 LEU HB2 4.540 . 4.540 4.259 4.010 4.445 . 0 0 "[ . 1 . 2]" 1
884 1 26 PHE QE 1 30 LEU QD 3.570 . 3.570 1.897 1.800 2.040 . 0 0 "[ . 1 . 2]" 1
885 1 26 PHE QE 1 30 LEU HG 4.230 . 4.230 3.406 2.682 3.899 . 0 0 "[ . 1 . 2]" 1
886 1 26 PHE HZ 1 30 LEU QD 4.010 . 4.010 3.273 2.668 3.951 . 0 0 "[ . 1 . 2]" 1
887 1 27 ARG HA 1 30 LEU QD 4.080 . 4.080 3.876 3.704 4.132 0.052 1 0 "[ . 1 . 2]" 1
888 1 27 ARG HA 1 30 LEU H 4.340 . 4.340 3.927 3.735 4.084 . 0 0 "[ . 1 . 2]" 1
889 1 28 HIS HA 1 31 ASN QB 3.590 . 3.590 2.698 2.173 3.035 . 0 0 "[ . 1 . 2]" 1
890 1 28 HIS HA 1 31 ASN HB3 4.190 . 4.190 2.778 2.215 3.139 . 0 0 "[ . 1 . 2]" 1
891 1 28 HIS HA 1 31 ASN HB2 4.190 . 4.190 3.687 3.066 4.142 . 0 0 "[ . 1 . 2]" 1
892 1 28 HIS HA 1 32 HIS H 4.500 . 4.500 4.139 3.932 4.509 0.009 7 0 "[ . 1 . 2]" 1
893 1 29 ALA HA 1 31 ASN H 4.530 . 4.530 4.485 4.282 4.581 0.051 1 0 "[ . 1 . 2]" 1
894 1 29 ALA HA 1 32 HIS QB 3.450 . 3.450 2.806 2.511 2.974 . 0 0 "[ . 1 . 2]" 1
895 1 29 ALA HA 1 32 HIS HB3 3.940 . 3.940 3.014 2.667 3.977 0.037 6 0 "[ . 1 . 2]" 1
896 1 29 ALA HA 1 32 HIS HB2 3.940 . 3.940 3.545 2.538 3.842 . 0 0 "[ . 1 . 2]" 1
897 1 29 ALA HA 1 32 HIS H 4.010 . 4.010 3.620 3.435 3.732 . 0 0 "[ . 1 . 2]" 1
898 1 29 ALA MB 1 32 HIS QB 4.390 . 4.390 4.057 3.906 4.176 . 0 0 "[ . 1 . 2]" 1
899 1 29 ALA MB 1 33 ILE MD 4.650 . 4.650 4.229 3.834 4.540 . 0 0 "[ . 1 . 2]" 1
900 1 29 ALA MB 1 33 ILE MG 4.640 . 4.640 4.133 3.780 4.553 . 0 0 "[ . 1 . 2]" 1
901 1 30 LEU HA 1 33 ILE MD 3.540 . 3.540 2.540 2.308 2.744 . 0 0 "[ . 1 . 2]" 1
902 1 30 LEU HA 1 33 ILE MG 4.030 . 4.030 3.812 3.292 4.030 0.000 14 0 "[ . 1 . 2]" 1
903 1 30 LEU HA 1 33 ILE H 4.090 . 4.090 3.481 3.366 3.646 . 0 0 "[ . 1 . 2]" 1
904 1 30 LEU QD 1 33 ILE MG 4.430 . 4.430 4.017 3.637 4.295 . 0 0 "[ . 1 . 2]" 1
905 1 31 ASN HA 1 34 GLY H 3.930 . 3.930 3.444 3.259 3.779 . 0 0 "[ . 1 . 2]" 1
906 1 31 ASN HA 1 35 ALA H 4.380 . 4.380 3.365 2.971 3.731 . 0 0 "[ . 1 . 2]" 1
907 1 32 HIS QB 1 34 GLY H 4.830 . 4.830 4.560 4.479 4.644 . 0 0 "[ . 1 . 2]" 1
908 1 33 ILE MD 1 35 ALA MB 2.970 . 2.970 2.384 2.170 2.667 . 0 0 "[ . 1 . 2]" 1
909 1 33 ILE MD 1 35 ALA H 4.450 . 4.450 3.955 3.687 4.340 . 0 0 "[ . 1 . 2]" 1
910 1 33 ILE MG 1 35 ALA H 5.090 . 5.090 4.894 4.644 5.183 0.093 9 0 "[ . 1 . 2]" 1
911 1 33 ILE H 1 35 ALA H 4.130 . 4.130 3.572 3.331 4.009 . 0 0 "[ . 1 . 2]" 1
912 1 35 ALA MB 1 37 VAL QG 4.330 . 4.330 3.954 3.578 4.425 0.095 9 0 "[ . 1 . 2]" 1
913 1 38 PRO QG 1 42 LEU QD 3.820 . 3.820 2.192 1.726 3.054 . 0 0 "[ . 1 . 2]" 1
914 1 38 PRO QG 1 42 LEU HG 4.080 . 4.080 3.070 2.135 4.060 . 0 0 "[ . 1 . 2]" 1
915 1 41 ASP QB 1 44 THR MG 3.600 . 3.600 2.859 2.329 3.656 0.056 7 0 "[ . 1 . 2]" 1
916 1 41 ASP HB3 1 44 THR MG 4.110 . 4.110 3.243 2.371 4.256 0.146 7 0 "[ . 1 . 2]" 1
917 1 41 ASP HB2 1 44 THR MG 4.110 . 4.110 3.708 2.419 4.237 0.127 19 0 "[ . 1 . 2]" 1
918 1 42 LEU HA 1 45 HIS QB 4.030 . 4.030 2.380 1.935 2.909 . 0 0 "[ . 1 . 2]" 1
919 1 42 LEU HA 1 45 HIS H 3.570 . 3.570 3.259 3.093 3.506 . 0 0 "[ . 1 . 2]" 1
920 1 42 LEU HA 1 46 ILE MG 4.580 . 4.580 3.865 3.310 4.480 . 0 0 "[ . 1 . 2]" 1
921 1 42 LEU QB 1 46 ILE MD 3.990 . 3.990 3.395 2.906 3.864 . 0 0 "[ . 1 . 2]" 1
922 1 42 LEU QD 1 45 HIS QB 4.070 . 4.070 2.098 1.740 2.534 . 0 0 "[ . 1 . 2]" 1
923 1 42 LEU QD 1 45 HIS H 4.120 . 4.120 3.745 3.402 4.047 . 0 0 "[ . 1 . 2]" 1
924 1 42 LEU QD 1 46 ILE H 3.860 . 3.860 3.781 3.438 3.963 0.103 11 0 "[ . 1 . 2]" 1
925 1 42 LEU HG 1 45 HIS QB 5.420 . 5.420 4.724 3.796 5.135 . 0 0 "[ . 1 . 2]" 1
926 1 43 ALA HA 1 46 ILE MD 3.650 . 3.650 2.624 2.232 3.189 . 0 0 "[ . 1 . 2]" 1
927 1 54 THR HA 1 57 ALA MB 3.520 . 3.520 2.565 2.204 2.820 . 0 0 "[ . 1 . 2]" 1
928 1 54 THR MG 1 57 ALA MB 4.020 . 4.020 3.544 3.261 3.876 . 0 0 "[ . 1 . 2]" 1
929 1 54 THR MG 1 58 MET ME 4.630 . 4.630 4.374 4.039 4.664 0.034 18 0 "[ . 1 . 2]" 1
930 1 54 THR MG 1 58 MET QG 4.140 . 4.140 2.661 2.310 3.030 . 0 0 "[ . 1 . 2]" 1
931 1 56 ARG HA 1 58 MET H 4.480 . 4.480 4.040 3.747 4.514 0.034 11 0 "[ . 1 . 2]" 1
932 1 60 LEU QD 1 64 ALA HA 3.570 . 3.570 2.790 1.673 3.631 0.061 20 0 "[ . 1 . 2]" 1
933 1 60 LEU QD 1 64 ALA MB 3.650 . 3.650 3.021 1.674 3.793 0.143 10 0 "[ . 1 . 2]" 1
934 1 60 LEU QD 1 64 ALA H 4.110 . 4.110 3.393 2.252 4.138 0.028 14 0 "[ . 1 . 2]" 1
935 1 62 GLU HA 1 64 ALA MB 4.770 . 4.770 4.379 3.906 4.828 0.058 5 0 "[ . 1 . 2]" 1
936 1 62 GLU HA 1 64 ALA H 4.050 . 4.050 3.660 3.226 3.996 . 0 0 "[ . 1 . 2]" 1
937 1 63 SER HA 1 65 GLU H 4.320 . 4.320 3.562 3.320 3.867 . 0 0 "[ . 1 . 2]" 1
938 1 63 SER HA 1 66 GLU QG 5.320 . 5.320 5.028 4.319 5.355 0.035 20 0 "[ . 1 . 2]" 1
939 1 63 SER HA 1 66 GLU H 3.930 . 3.930 3.351 3.107 3.595 . 0 0 "[ . 1 . 2]" 1
940 1 63 SER HB3 1 66 GLU QB 3.530 . 3.530 2.666 2.260 3.362 . 0 0 "[ . 1 . 2]" 1
941 1 63 SER HB3 1 66 GLU H 4.410 . 4.410 4.125 3.772 4.447 0.037 12 0 "[ . 1 . 2]" 1
942 1 64 ALA HA 1 67 ALA MB 3.360 . 3.360 2.639 2.354 3.057 . 0 0 "[ . 1 . 2]" 1
943 1 64 ALA HA 1 67 ALA H 4.080 . 4.080 3.482 3.272 3.740 . 0 0 "[ . 1 . 2]" 1
944 1 64 ALA MB 1 68 ILE HB 5.030 . 5.030 4.492 3.681 5.106 0.076 5 0 "[ . 1 . 2]" 1
945 1 64 ALA MB 1 68 ILE MD 5.330 . 5.330 4.377 3.788 5.341 0.011 14 0 "[ . 1 . 2]" 1
946 1 64 ALA MB 1 68 ILE H 4.450 . 4.450 4.371 4.149 4.487 0.037 11 0 "[ . 1 . 2]" 1
947 1 65 GLU HA 1 68 ILE HB 3.990 . 3.990 3.176 2.471 4.030 0.040 6 0 "[ . 1 . 2]" 1
948 1 65 GLU HA 1 68 ILE MG 4.080 . 4.080 3.205 1.700 4.139 0.059 7 0 "[ . 1 . 2]" 1
949 1 65 GLU HA 1 68 ILE H 4.300 . 4.300 3.584 3.272 3.815 . 0 0 "[ . 1 . 2]" 1
950 1 65 GLU H 1 67 ALA H 4.650 . 4.650 4.037 3.910 4.263 . 0 0 "[ . 1 . 2]" 1
951 1 66 GLU HA 1 69 VAL QG 3.430 . 3.430 2.189 1.823 3.051 . 0 0 "[ . 1 . 2]" 1
952 1 66 GLU HA 1 69 VAL MG1 4.950 . 4.950 2.404 1.824 4.290 . 0 0 "[ . 1 . 2]" 1
953 1 66 GLU HA 1 69 VAL MG2 4.950 . 4.950 4.431 2.131 4.971 0.021 15 0 "[ . 1 . 2]" 1
954 1 66 GLU HA 1 69 VAL H 4.090 . 4.090 3.680 3.425 3.999 . 0 0 "[ . 1 . 2]" 1
955 1 66 GLU QG 1 69 VAL QG 4.190 . 4.190 3.595 3.043 4.291 0.101 5 0 "[ . 1 . 2]" 1
956 1 66 GLU QG 1 70 ALA MB 3.690 . 3.690 3.462 3.066 3.738 0.048 13 0 "[ . 1 . 2]" 1
957 1 67 ALA HA 1 70 ALA MB 3.740 . 3.740 2.627 2.368 2.794 . 0 0 "[ . 1 . 2]" 1
958 1 67 ALA HA 1 70 ALA H 4.080 . 4.080 3.528 3.108 3.685 . 0 0 "[ . 1 . 2]" 1
959 1 67 ALA MB 1 71 TYR H 4.560 . 4.560 4.469 4.301 4.589 0.029 14 0 "[ . 1 . 2]" 1
960 1 67 ALA H 1 70 ALA MB 4.770 . 4.770 4.691 4.473 4.805 0.035 4 0 "[ . 1 . 2]" 1
961 1 68 ILE HA 1 71 TYR QD 3.980 . 3.980 3.918 3.562 4.068 0.088 20 0 "[ . 1 . 2]" 1
962 1 68 ILE HA 1 71 TYR H 4.220 . 4.220 3.485 3.300 3.767 . 0 0 "[ . 1 . 2]" 1
963 1 68 ILE HA 1 72 ARG H 4.790 . 4.790 4.070 3.809 4.360 . 0 0 "[ . 1 . 2]" 1
964 1 68 ILE MD 1 71 TYR QD 4.080 . 4.080 3.524 2.583 4.102 0.022 9 0 "[ . 1 . 2]" 1
965 1 69 VAL HA 1 72 ARG QD 4.300 . 4.300 2.391 1.680 3.190 0.020 14 0 "[ . 1 . 2]" 1
966 1 69 VAL HA 1 72 ARG H 4.990 . 4.990 3.317 3.123 3.518 . 0 0 "[ . 1 . 2]" 1
967 1 69 VAL HB 1 72 ARG QD 4.700 . 4.700 4.202 3.475 4.794 0.094 5 0 "[ . 1 . 2]" 1
968 1 69 VAL QG 1 73 ALA MB 3.790 . 3.790 3.208 2.905 3.693 . 0 0 "[ . 1 . 2]" 1
969 1 69 VAL QG 1 73 ALA H 4.180 . 4.180 3.805 3.634 4.301 0.121 9 0 "[ . 1 . 2]" 1
970 1 70 ALA HA 1 73 ALA MB 3.650 . 3.650 2.634 2.436 2.865 . 0 0 "[ . 1 . 2]" 1
971 1 73 ALA HA 1 77 ALA MB 4.380 . 4.380 4.304 3.951 4.459 0.079 8 0 "[ . 1 . 2]" 1
972 1 73 ALA HA 1 77 ALA H 4.790 . 4.790 4.486 4.147 4.630 . 0 0 "[ . 1 . 2]" 1
973 1 73 ALA MB 1 75 TYR H 5.120 . 5.120 4.394 4.295 4.490 . 0 0 "[ . 1 . 2]" 1
974 1 74 ASP HA 1 77 ALA MB 3.320 . 3.320 2.465 2.065 2.942 . 0 0 "[ . 1 . 2]" 1
975 1 74 ASP HA 1 77 ALA H 3.910 . 3.910 3.313 3.055 3.585 . 0 0 "[ . 1 . 2]" 1
976 1 75 TYR HA 1 78 ARG H 4.030 . 4.030 3.797 3.505 4.098 0.068 2 0 "[ . 1 . 2]" 1
977 1 75 TYR HA 1 79 GLY H 3.730 . 3.730 2.535 2.257 2.804 . 0 0 "[ . 1 . 2]" 1
978 1 75 TYR QB 1 77 ALA H 4.900 . 4.900 4.448 4.322 4.612 . 0 0 "[ . 1 . 2]" 1
979 1 75 TYR H 1 77 ALA MB 5.500 . 5.500 4.738 4.457 4.966 . 0 0 "[ . 1 . 2]" 1
980 1 75 TYR H 1 79 GLY H 4.770 . 4.770 4.548 4.318 4.833 0.063 6 0 "[ . 1 . 2]" 1
981 1 77 ALA HA 1 80 TRP HE1 4.730 . 4.730 3.249 2.882 3.759 . 0 0 "[ . 1 . 2]" 1
982 1 77 ALA MB 1 80 TRP HE1 5.200 . 5.200 4.344 4.167 4.595 . 0 0 "[ . 1 . 2]" 1
983 1 77 ALA H 1 80 TRP HD1 4.560 . 4.560 3.907 3.499 4.473 . 0 0 "[ . 1 . 2]" 1
984 1 78 ARG HA 1 80 TRP HD1 4.230 . 4.230 3.852 3.427 4.246 0.016 15 0 "[ . 1 . 2]" 1
985 1 78 ARG HA 1 80 TRP HE1 4.080 . 4.080 3.660 3.051 4.011 . 0 0 "[ . 1 . 2]" 1
986 1 78 ARG H 1 80 TRP HD1 4.090 . 4.090 3.746 3.464 4.131 0.041 20 0 "[ . 1 . 2]" 1
987 1 78 ARG H 1 80 TRP H 4.300 . 4.300 4.044 3.722 4.352 0.052 15 0 "[ . 1 . 2]" 1
988 1 88 GLY QA 1 91 PRO QG 3.970 . 3.970 2.497 2.147 2.952 . 0 0 "[ . 1 . 2]" 1
989 1 89 ILE HA 1 92 LEU QB 4.240 . 4.240 2.337 2.086 2.566 . 0 0 "[ . 1 . 2]" 1
990 1 89 ILE HA 1 92 LEU QD 4.240 . 4.240 2.801 2.609 3.103 . 0 0 "[ . 1 . 2]" 1
991 1 89 ILE HA 1 92 LEU H 4.110 . 4.110 3.573 3.416 3.707 . 0 0 "[ . 1 . 2]" 1
992 1 89 ILE MG 1 91 PRO QD 5.350 . 5.350 4.791 4.519 5.009 . 0 0 "[ . 1 . 2]" 1
993 1 89 ILE MG 1 92 LEU QB 4.100 . 4.100 3.337 2.905 3.669 . 0 0 "[ . 1 . 2]" 1
994 1 89 ILE MG 1 92 LEU H 4.560 . 4.560 4.617 4.542 4.710 0.150 8 0 "[ . 1 . 2]" 1
995 1 89 ILE MG 1 93 LEU H 4.140 . 4.140 3.778 3.437 3.989 . 0 0 "[ . 1 . 2]" 1
996 1 89 ILE H 1 91 PRO QD 4.780 . 4.780 3.676 3.521 3.852 . 0 0 "[ . 1 . 2]" 1
997 1 89 ILE H 1 92 LEU QB 4.580 . 4.580 4.435 4.301 4.633 0.053 13 0 "[ . 1 . 2]" 1
998 1 89 ILE H 1 92 LEU H 5.200 . 5.200 4.831 4.701 4.981 . 0 0 "[ . 1 . 2]" 1
999 1 91 PRO HA 1 94 ALA MB 3.260 . 3.260 2.321 2.079 2.640 . 0 0 "[ . 1 . 2]" 1
1000 1 91 PRO HA 1 94 ALA H 4.140 . 4.140 3.336 3.175 3.598 . 0 0 "[ . 1 . 2]" 1
1001 1 92 LEU HA 1 95 ASP H 4.140 . 4.140 3.712 3.309 3.980 . 0 0 "[ . 1 . 2]" 1
1002 1 92 LEU HA 1 96 LEU QD 4.020 . 4.020 3.631 3.002 4.078 0.058 9 0 "[ . 1 . 2]" 1
1003 1 92 LEU H 1 94 ALA MB 5.050 . 5.050 4.559 4.353 4.803 . 0 0 "[ . 1 . 2]" 1
1004 1 93 LEU HA 1 96 LEU QB 4.190 . 4.190 2.568 2.287 3.039 . 0 0 "[ . 1 . 2]" 1
1005 1 93 LEU HA 1 96 LEU QD 4.910 . 4.910 2.567 1.827 3.529 . 0 0 "[ . 1 . 2]" 1
1006 1 94 ALA MB 1 96 LEU H 4.830 . 4.830 4.493 4.317 4.700 . 0 0 "[ . 1 . 2]" 1
1007 1 95 ASP HA 1 97 ARG H 4.820 . 4.820 4.535 4.295 4.821 0.001 12 0 "[ . 1 . 2]" 1
1008 1 95 ASP HA 1 98 THR MG 4.260 . 4.260 3.887 3.645 4.105 . 0 0 "[ . 1 . 2]" 1
1009 1 95 ASP HA 1 98 THR H 4.060 . 4.060 3.483 3.171 3.715 . 0 0 "[ . 1 . 2]" 1
1010 1 96 LEU HA 1 99 ALA MB 3.490 . 3.490 2.896 2.649 3.127 . 0 0 "[ . 1 . 2]" 1
1011 1 96 LEU HA 1 99 ALA H 4.110 . 4.110 3.478 3.314 3.707 . 0 0 "[ . 1 . 2]" 1
1012 1 97 ARG HA 1 100 GLY H 3.930 . 3.930 3.434 3.118 3.636 . 0 0 "[ . 1 . 2]" 1
1013 1 97 ARG HA 1 101 VAL H 4.020 . 4.020 3.633 2.972 4.033 0.013 2 0 "[ . 1 . 2]" 1
1014 1 97 ARG H 1 101 VAL QG 4.250 . 4.250 4.157 3.843 4.472 0.222 6 0 "[ . 1 . 2]" 1
1015 1 98 THR HA 1 100 GLY H 4.300 . 4.300 3.820 3.633 4.081 . 0 0 "[ . 1 . 2]" 1
1016 1 99 ALA MB 1 101 VAL HA 5.370 . 5.370 4.856 4.588 5.236 . 0 0 "[ . 1 . 2]" 1
1017 1 99 ALA MB 1 101 VAL QG 3.200 . 3.200 2.625 2.042 3.014 . 0 0 "[ . 1 . 2]" 1
1018 1 99 ALA MB 1 101 VAL H 4.140 . 4.140 2.917 2.764 3.176 . 0 0 "[ . 1 . 2]" 1
1019 1 110 ALA MB 1 112 PRO QD 3.380 . 3.380 2.297 1.771 2.750 . 0 0 "[ . 1 . 2]" 1
1020 1 110 ALA MB 1 112 PRO QG 3.630 . 3.630 2.636 2.156 3.214 . 0 0 "[ . 1 . 2]" 1
1021 1 110 ALA MB 1 112 PRO HG3 4.210 . 4.210 3.742 3.292 4.332 0.122 2 0 "[ . 1 . 2]" 1
1022 1 110 ALA MB 1 112 PRO HG2 4.210 . 4.210 2.696 2.186 3.318 . 0 0 "[ . 1 . 2]" 1
1023 1 114 ALA HA 1 116 ARG H 4.950 . 4.950 4.407 4.119 4.715 . 0 0 "[ . 1 . 2]" 1
1024 1 114 ALA HA 1 117 ILE HB 4.200 . 4.200 2.977 2.573 3.346 . 0 0 "[ . 1 . 2]" 1
1025 1 114 ALA MB 1 116 ARG H 4.540 . 4.540 4.482 4.242 4.609 0.069 5 0 "[ . 1 . 2]" 1
1026 1 114 ALA MB 1 117 ILE HB 4.480 . 4.480 4.293 3.979 4.528 0.048 12 0 "[ . 1 . 2]" 1
1027 1 114 ALA MB 1 118 LEU H 4.860 . 4.860 4.386 4.071 4.662 . 0 0 "[ . 1 . 2]" 1
1028 1 115 ARG HA 1 119 ARG QB 4.470 . 4.470 4.193 3.258 4.472 0.002 3 0 "[ . 1 . 2]" 1
1029 1 116 ARG HA 1 119 ARG QB 4.230 . 4.230 2.967 2.540 3.892 . 0 0 "[ . 1 . 2]" 1
1030 1 116 ARG H 1 119 ARG QB 4.770 . 4.770 4.756 4.517 5.001 0.231 5 0 "[ . 1 . 2]" 1
1031 1 119 ARG QB 1 121 PHE H 5.090 . 5.090 4.907 4.726 5.149 0.059 5 0 "[ . 1 . 2]" 1
1032 1 121 PHE QB 1 123 ILE MD 4.090 . 4.090 2.697 1.660 3.033 0.040 15 0 "[ . 1 . 2]" 1
1033 1 121 PHE QD 1 123 ILE MD 4.290 . 4.290 3.057 2.417 4.104 . 0 0 "[ . 1 . 2]" 1
1034 1 123 ILE MD 1 127 PHE QE 4.050 . 4.050 2.532 1.677 4.018 0.023 7 0 "[ . 1 . 2]" 1
1035 1 123 ILE QG 1 127 PHE QD 4.140 . 4.140 3.470 2.606 4.140 . 0 0 "[ . 1 . 2]" 1
1036 1 123 ILE QG 1 127 PHE QE 4.780 . 4.780 2.524 1.924 2.873 . 0 0 "[ . 1 . 2]" 1
1037 1 124 GLU HA 1 127 PHE QD 4.220 . 4.220 2.750 2.085 3.371 . 0 0 "[ . 1 . 2]" 1
1038 1 124 GLU HA 1 127 PHE H 4.160 . 4.160 3.926 3.556 4.212 0.052 9 0 "[ . 1 . 2]" 1
1039 1 124 GLU QB 1 127 PHE H 5.250 . 5.250 5.101 4.685 5.294 0.044 18 0 "[ . 1 . 2]" 1
1040 1 127 PHE HA 1 129 VAL H 4.880 . 4.880 4.460 4.001 4.730 . 0 0 "[ . 1 . 2]" 1
1041 1 127 PHE HB3 1 129 VAL H 4.200 . 4.200 3.441 2.961 4.229 0.029 15 0 "[ . 1 . 2]" 1
1042 1 127 PHE HB3 1 130 ILE MD 4.170 . 4.170 2.469 1.992 2.793 . 0 0 "[ . 1 . 2]" 1
1043 1 127 PHE HB2 1 130 ILE MD 4.050 . 4.050 1.957 1.719 2.190 . 0 0 "[ . 1 . 2]" 1
1044 1 127 PHE QD 1 130 ILE MD 3.910 . 3.910 3.010 2.587 3.654 . 0 0 "[ . 1 . 2]" 1
1045 1 128 GLU H 1 130 ILE MD 4.400 . 4.400 4.438 4.334 4.565 0.165 8 0 "[ . 1 . 2]" 1
1046 1 129 VAL QG 1 131 ALA MB 3.780 . 3.780 2.862 2.388 3.206 . 0 0 "[ . 1 . 2]" 1
1047 1 129 VAL QG 1 131 ALA H 4.320 . 4.320 3.474 3.141 3.880 . 0 0 "[ . 1 . 2]" 1
1048 1 145 VAL HA 1 148 HIS QB 4.160 . 4.160 2.991 2.607 3.631 . 0 0 "[ . 1 . 2]" 1
1049 1 145 VAL QG 1 149 ALA MB 4.320 . 4.320 3.610 3.331 4.206 . 0 0 "[ . 1 . 2]" 1
1050 1 146 LEU HA 1 148 HIS H 5.340 . 5.340 4.497 4.204 4.680 . 0 0 "[ . 1 . 2]" 1
1051 1 146 LEU HA 1 149 ALA MB 3.850 . 3.850 2.780 2.492 3.324 . 0 0 "[ . 1 . 2]" 1
1052 1 146 LEU HA 1 150 LEU QD 4.260 . 4.260 3.669 3.241 4.297 0.037 12 0 "[ . 1 . 2]" 1
1053 1 146 LEU QD 1 150 LEU QD 3.040 . 3.040 2.660 2.432 2.828 . 0 0 "[ . 1 . 2]" 1
1054 1 146 LEU QD 1 150 LEU MD1 3.650 . 3.650 2.767 2.478 3.034 . 0 0 "[ . 1 . 2]" 1
1055 1 146 LEU QD 1 150 LEU MD2 3.650 . 3.650 3.501 3.221 3.708 0.058 9 0 "[ . 1 . 2]" 1
1056 1 146 LEU QD 1 150 LEU H 5.150 . 5.150 4.513 4.135 4.719 . 0 0 "[ . 1 . 2]" 1
1057 1 146 LEU HG 1 150 LEU QD 3.690 . 3.690 2.436 2.061 2.657 . 0 0 "[ . 1 . 2]" 1
1058 1 147 ALA HA 1 150 LEU QB 4.210 . 4.210 2.863 2.617 3.279 . 0 0 "[ . 1 . 2]" 1
1059 1 147 ALA HA 1 150 LEU QD 3.770 . 3.770 3.049 2.537 3.473 . 0 0 "[ . 1 . 2]" 1
1060 1 147 ALA MB 1 149 ALA H 4.850 . 4.850 4.489 4.328 4.737 . 0 0 "[ . 1 . 2]" 1
1061 1 147 ALA H 1 150 LEU QD 4.920 . 4.920 4.390 4.128 4.522 . 0 0 "[ . 1 . 2]" 1
1062 1 148 HIS HA 1 151 ALA MB 3.480 . 3.480 2.533 2.284 2.806 . 0 0 "[ . 1 . 2]" 1
1063 1 148 HIS HA 1 151 ALA H 4.030 . 4.030 3.341 3.023 3.630 . 0 0 "[ . 1 . 2]" 1
1064 1 148 HIS H 1 150 LEU H 4.560 . 4.560 4.204 3.965 4.478 . 0 0 "[ . 1 . 2]" 1
1065 1 149 ALA MB 1 153 LEU QD 3.050 . 3.050 2.973 2.767 3.181 0.131 11 0 "[ . 1 . 2]" 1
1066 1 150 LEU HA 1 153 LEU QD 3.770 . 3.770 2.052 1.837 2.766 . 0 0 "[ . 1 . 2]" 1
1067 1 150 LEU HA 1 153 LEU H 4.190 . 4.190 3.346 3.138 3.642 . 0 0 "[ . 1 . 2]" 1
1068 1 151 ALA HA 1 154 ARG QD 4.210 . 4.210 3.354 2.410 4.323 0.113 7 0 "[ . 1 . 2]" 1
1069 1 151 ALA HA 1 154 ARG QG 3.680 . 3.680 2.523 1.998 3.295 . 0 0 "[ . 1 . 2]" 1
1070 1 151 ALA MB 1 154 ARG QG 3.710 . 3.710 3.624 3.321 3.903 0.193 1 0 "[ . 1 . 2]" 1
1071 1 151 ALA MB 1 154 ARG H 5.090 . 5.090 4.924 4.715 5.099 0.009 15 0 "[ . 1 . 2]" 1
1072 1 152 GLN HA 1 154 ARG H 4.190 . 4.190 3.669 3.457 3.940 . 0 0 "[ . 1 . 2]" 1
1073 1 152 GLN QB 1 154 ARG H 5.240 . 5.240 4.450 4.375 4.591 . 0 0 "[ . 1 . 2]" 1
1074 1 152 GLN H 1 154 ARG H 4.420 . 4.420 4.122 3.813 4.325 . 0 0 "[ . 1 . 2]" 1
1075 1 153 LEU H 1 156 LEU QD 4.680 . 4.680 4.596 4.278 4.787 0.107 11 0 "[ . 1 . 2]" 1
1076 1 154 ARG HA 1 156 LEU HA 3.960 . 3.960 3.456 3.103 3.707 . 0 0 "[ . 1 . 2]" 1
1077 1 154 ARG HA 1 156 LEU QD 4.070 . 4.070 2.660 2.346 3.283 . 0 0 "[ . 1 . 2]" 1
1078 1 154 ARG HA 1 156 LEU H 4.130 . 4.130 3.336 2.877 3.673 . 0 0 "[ . 1 . 2]" 1
1079 1 154 ARG QD 1 156 LEU QD 4.040 . 4.040 3.320 2.248 4.114 0.074 7 0 "[ . 1 . 2]" 1
1080 1 154 ARG QG 1 156 LEU QD 4.170 . 4.170 2.420 1.640 4.127 0.060 12 0 "[ . 1 . 2]" 1
1081 1 154 ARG H 1 156 LEU QD 4.540 . 4.540 3.980 3.764 4.389 . 0 0 "[ . 1 . 2]" 1
1082 1 161 VAL QG 1 163 VAL QG 3.120 . 3.120 2.531 2.263 2.916 . 0 0 "[ . 1 . 2]" 1
1083 1 161 VAL QG 1 163 VAL H 4.230 . 4.230 4.060 3.647 4.266 0.036 1 0 "[ . 1 . 2]" 1
1084 1 161 VAL MG1 1 163 VAL H 4.950 . 4.950 4.755 4.479 4.969 0.019 3 0 "[ . 1 . 2]" 1
1085 1 161 VAL MG2 1 163 VAL H 4.950 . 4.950 4.409 3.856 4.669 . 0 0 "[ . 1 . 2]" 1
1086 1 170 VAL HA 1 173 ALA MB 3.950 . 3.950 2.898 2.479 3.159 . 0 0 "[ . 1 . 2]" 1
1087 1 170 VAL QG 1 174 ALA MB 3.720 . 3.720 3.241 2.676 3.763 0.043 8 0 "[ . 1 . 2]" 1
1088 1 170 VAL H 1 173 ALA MB 5.150 . 5.150 4.883 4.694 5.116 . 0 0 "[ . 1 . 2]" 1
1089 1 171 ASP HA 1 174 ALA MB 3.300 . 3.300 2.818 2.565 3.336 0.036 11 0 "[ . 1 . 2]" 1
1090 1 173 ALA H 1 175 ALA H 4.610 . 4.610 4.009 3.852 4.141 . 0 0 "[ . 1 . 2]" 1
1091 1 174 ALA HA 1 178 ILE H 3.990 . 3.990 2.752 2.522 2.919 . 0 0 "[ . 1 . 2]" 1
1092 1 174 ALA MB 1 176 HIS H 4.930 . 4.930 4.420 4.301 4.585 . 0 0 "[ . 1 . 2]" 1
1093 1 174 ALA MB 1 177 GLY H 4.980 . 4.980 4.385 4.232 4.534 . 0 0 "[ . 1 . 2]" 1
1094 1 174 ALA MB 1 178 ILE H 4.420 . 4.420 4.354 4.174 4.463 0.043 19 0 "[ . 1 . 2]" 1
1095 1 174 ALA H 1 176 HIS H 4.530 . 4.530 4.037 3.888 4.253 . 0 0 "[ . 1 . 2]" 1
1096 1 175 ALA MB 1 177 GLY H 4.470 . 4.470 4.275 4.198 4.365 . 0 0 "[ . 1 . 2]" 1
1097 1 175 ALA H 1 177 GLY H 4.990 . 4.990 3.944 3.746 4.062 . 0 0 "[ . 1 . 2]" 1
1098 1 176 HIS HA 1 178 ILE MD 4.230 . 4.230 4.278 3.923 4.337 0.107 14 0 "[ . 1 . 2]" 1
1099 1 176 HIS HB3 1 178 ILE MD 3.640 . 3.640 1.806 1.655 2.513 0.045 1 0 "[ . 1 . 2]" 1
1100 1 176 HIS HB2 1 178 ILE MD 3.640 . 3.640 2.988 1.920 3.254 . 0 0 "[ . 1 . 2]" 1
1101 1 176 HIS H 1 178 ILE HB 5.200 . 5.200 4.493 4.343 4.977 . 0 0 "[ . 1 . 2]" 1
1102 1 176 HIS H 1 178 ILE MD 4.950 . 4.950 3.750 3.375 4.033 . 0 0 "[ . 1 . 2]" 1
1103 1 204 ALA HA 1 206 THR H 4.470 . 4.470 3.913 3.310 4.451 . 0 0 "[ . 1 . 2]" 1
1104 1 204 ALA MB 1 206 THR H 4.320 . 4.320 3.461 2.990 4.011 . 0 0 "[ . 1 . 2]" 1
1105 1 205 ALA MB 1 209 GLU QG 4.110 . 4.110 4.019 2.559 4.200 0.090 20 0 "[ . 1 . 2]" 1
1106 1 206 THR HA 1 208 ASP H 4.530 . 4.530 4.319 4.166 4.558 0.028 5 0 "[ . 1 . 2]" 1
1107 1 206 THR MG 1 208 ASP QB 4.050 . 4.050 2.293 1.867 3.755 . 0 0 "[ . 1 . 2]" 1
1108 1 206 THR MG 1 208 ASP H 4.260 . 4.260 2.280 1.882 2.891 . 0 0 "[ . 1 . 2]" 1
1109 1 206 THR MG 1 209 GLU HA 4.170 . 4.170 4.003 3.664 4.223 0.053 6 0 "[ . 1 . 2]" 1
1110 1 206 THR MG 1 209 GLU QB 4.170 . 4.170 2.988 2.069 3.354 . 0 0 "[ . 1 . 2]" 1
1111 1 206 THR MG 1 209 GLU H 4.290 . 4.290 1.970 1.729 2.206 . 0 0 "[ . 1 . 2]" 1
1112 1 206 THR H 1 209 GLU QB 3.830 . 3.830 3.052 2.308 3.907 0.077 18 0 "[ . 1 . 2]" 1
1113 1 206 THR H 1 209 GLU QG 3.990 . 3.990 3.059 1.824 3.586 . 0 0 "[ . 1 . 2]" 1
1114 1 207 ILE HA 1 210 LEU QD 4.140 . 4.140 3.043 1.855 3.918 . 0 0 "[ . 1 . 2]" 1
1115 1 207 ILE MD 1 210 LEU QD 4.220 . 4.220 2.212 1.711 3.453 . 0 0 "[ . 1 . 2]" 1
1116 1 210 LEU HA 1 213 ALA MB 3.800 . 3.800 2.649 2.332 2.853 . 0 0 "[ . 1 . 2]" 1
1117 1 210 LEU HA 1 214 LEU HG 4.060 . 4.060 3.623 2.906 4.084 0.024 18 0 "[ . 1 . 2]" 1
1118 1 210 LEU QB 1 214 LEU HG 4.160 . 4.160 3.887 2.760 4.312 0.152 18 0 "[ . 1 . 2]" 1
1119 1 210 LEU QD 1 214 LEU QD 4.360 . 4.360 2.221 1.919 2.564 . 0 0 "[ . 1 . 2]" 1
1120 1 210 LEU QD 1 214 LEU HG 2.950 . 2.950 2.596 1.870 3.042 0.092 4 0 "[ . 1 . 2]" 1
1121 1 210 LEU H 1 213 ALA MB 4.540 . 4.540 4.551 4.422 4.638 0.098 20 0 "[ . 1 . 2]" 1
1122 1 211 ARG H 1 214 LEU HG 5.500 . 5.500 4.884 4.382 5.202 . 0 0 "[ . 1 . 2]" 1
1123 1 212 GLU HA 1 215 GLY H 3.920 . 3.920 3.368 3.115 3.609 . 0 0 "[ . 1 . 2]" 1
1124 1 212 GLU H 1 216 VAL QG 4.450 . 4.450 4.207 3.468 4.528 0.078 4 0 "[ . 1 . 2]" 1
1125 1 213 ALA H 1 215 GLY H 4.120 . 4.120 3.852 3.712 3.997 . 0 0 "[ . 1 . 2]" 1
1126 1 214 LEU HB3 1 216 VAL QG 4.790 . 4.790 3.746 3.101 4.789 . 0 0 "[ . 1 . 2]" 1
1127 1 214 LEU HB2 1 216 VAL QG 3.620 . 3.620 2.851 2.232 3.679 0.059 3 0 "[ . 1 . 2]" 1
1128 1 214 LEU H 1 216 VAL QG 4.370 . 4.370 4.069 3.646 4.412 0.042 1 0 "[ . 1 . 2]" 1
1129 1 214 LEU H 1 216 VAL H 4.710 . 4.710 4.303 3.986 4.645 . 0 0 "[ . 1 . 2]" 1
1130 1 3 SER HA 1 214 LEU HB3 4.560 . 4.560 4.495 4.243 4.659 0.099 18 0 "[ . 1 . 2]" 1
1131 1 3 SER HA 1 214 LEU QD 5.020 . 5.020 4.926 4.674 5.089 0.069 15 0 "[ . 1 . 2]" 1
1132 1 4 PRO HB2 1 160 LEU HA 3.770 . 3.770 3.381 2.184 3.700 . 0 0 "[ . 1 . 2]" 1
1133 1 4 PRO HB2 1 160 LEU QD 4.510 . 4.510 4.079 3.685 4.573 0.063 12 0 "[ . 1 . 2]" 1
1134 1 4 PRO HB2 1 161 VAL QG 3.630 . 3.630 3.244 2.937 3.701 0.071 12 0 "[ . 1 . 2]" 1
1135 1 4 PRO HB2 1 161 VAL H 4.870 . 4.870 4.250 3.815 4.625 . 0 0 "[ . 1 . 2]" 1
1136 1 4 PRO QD 1 161 VAL QG 3.850 . 3.850 3.368 3.125 3.760 . 0 0 "[ . 1 . 2]" 1
1137 1 4 PRO QD 1 214 LEU HA 4.070 . 4.070 3.284 2.865 3.668 . 0 0 "[ . 1 . 2]" 1
1138 1 4 PRO QD 1 214 LEU HB3 4.950 . 4.950 3.286 2.970 3.607 . 0 0 "[ . 1 . 2]" 1
1139 1 4 PRO QD 1 214 LEU QD 3.840 . 3.840 3.451 3.198 3.696 . 0 0 "[ . 1 . 2]" 1
1140 1 4 PRO QG 1 160 LEU QD 4.460 . 4.460 4.551 4.345 4.647 0.187 12 0 "[ . 1 . 2]" 1
1141 1 4 PRO QG 1 161 VAL QG 2.890 . 2.890 1.986 1.819 2.314 . 0 0 "[ . 1 . 2]" 1
1142 1 4 PRO QG 1 161 VAL H 4.440 . 4.440 4.142 3.436 4.386 . 0 0 "[ . 1 . 2]" 1
1143 1 5 GLN QB 1 159 ARG QG 5.040 . 5.040 4.359 2.499 5.155 0.115 12 0 "[ . 1 . 2]" 1
1144 1 5 GLN QG 1 101 VAL QG 5.270 . 5.270 4.861 4.263 5.299 0.029 3 0 "[ . 1 . 2]" 1
1145 1 5 GLN H 1 160 LEU HA 4.280 . 4.280 4.035 3.253 4.262 . 0 0 "[ . 1 . 2]" 1
1146 1 6 LEU HA 1 102 ARG QB 4.290 . 4.290 2.638 2.209 3.042 . 0 0 "[ . 1 . 2]" 1
1147 1 6 LEU HA 1 102 ARG H 4.260 . 4.260 3.165 2.650 3.550 . 0 0 "[ . 1 . 2]" 1
1148 1 6 LEU HA 1 103 LEU QD 4.280 . 4.280 4.147 3.855 4.306 0.026 1 0 "[ . 1 . 2]" 1
1149 1 6 LEU QB 1 160 LEU QD 4.750 . 4.750 1.846 1.655 3.385 0.045 16 0 "[ . 1 . 2]" 1
1150 1 6 LEU QD 1 102 ARG HA 4.760 . 4.760 4.054 3.714 4.516 . 0 0 "[ . 1 . 2]" 1
1151 1 6 LEU QD 1 102 ARG QB 4.040 . 4.040 2.183 1.666 2.991 0.034 10 0 "[ . 1 . 2]" 1
1152 1 6 LEU QD 1 103 LEU H 4.000 . 4.000 3.924 3.603 4.056 0.056 6 0 "[ . 1 . 2]" 1
1153 1 6 LEU QD 1 104 ALA MB 2.840 . 2.840 2.004 1.703 2.486 . 0 0 "[ . 1 . 2]" 1
1154 1 6 LEU QD 1 128 GLU HB3 4.080 . 4.080 3.447 2.897 4.135 0.055 11 0 "[ . 1 . 2]" 1
1155 1 6 LEU QD 1 128 GLU HB2 4.700 . 4.700 4.076 3.169 4.815 0.115 20 0 "[ . 1 . 2]" 1
1156 1 6 LEU H 1 160 LEU HA 3.990 . 3.990 3.053 2.416 3.218 . 0 0 "[ . 1 . 2]" 1
1157 1 6 LEU H 1 160 LEU QB 5.160 . 5.160 4.862 2.594 5.155 . 0 0 "[ . 1 . 2]" 1
1158 1 6 LEU H 1 160 LEU QD 3.960 . 3.960 2.941 2.426 4.228 0.268 12 0 "[ . 1 . 2]" 1
1159 1 6 LEU H 1 160 LEU MD1 4.810 . 4.810 3.911 3.468 4.773 . 0 0 "[ . 1 . 2]" 1
1160 1 6 LEU H 1 160 LEU MD2 4.810 . 4.810 3.072 2.467 4.829 0.019 12 0 "[ . 1 . 2]" 1
1161 1 6 LEU H 1 161 VAL QG 4.790 . 4.790 4.298 4.167 4.559 . 0 0 "[ . 1 . 2]" 1
1162 1 7 VAL HA 1 161 VAL QG 3.870 . 3.870 2.377 2.121 2.516 . 0 0 "[ . 1 . 2]" 1
1163 1 7 VAL HA 1 161 VAL H 3.980 . 3.980 2.834 2.316 3.015 . 0 0 "[ . 1 . 2]" 1
1164 1 7 VAL HA 1 162 MET HA 5.150 . 5.150 4.504 4.119 4.991 . 0 0 "[ . 1 . 2]" 1
1165 1 7 VAL HB 1 101 VAL QG 3.860 . 3.860 3.409 3.112 3.648 . 0 0 "[ . 1 . 2]" 1
1166 1 7 VAL HB 1 103 LEU HA 4.270 . 4.270 3.030 2.817 3.268 . 0 0 "[ . 1 . 2]" 1
1167 1 7 VAL HB 1 103 LEU QB 4.790 . 4.790 4.158 3.789 4.594 . 0 0 "[ . 1 . 2]" 1
1168 1 7 VAL HB 1 104 ALA H 4.430 . 4.430 4.026 3.778 4.362 . 0 0 "[ . 1 . 2]" 1
1169 1 7 VAL HB 1 214 LEU QD 4.080 . 4.080 3.698 3.438 3.833 . 0 0 "[ . 1 . 2]" 1
1170 1 7 VAL MG1 1 96 LEU QD 3.460 . 3.460 3.210 2.868 3.528 0.068 1 0 "[ . 1 . 2]" 1
1171 1 7 VAL MG1 1 96 LEU MD1 4.720 . 4.720 3.996 3.232 4.833 0.113 15 0 "[ . 1 . 2]" 1
1172 1 7 VAL MG1 1 96 LEU MD2 4.720 . 4.720 3.662 2.894 4.781 0.061 1 0 "[ . 1 . 2]" 1
1173 1 7 VAL MG1 1 161 VAL QG 3.060 . 3.060 1.781 1.682 1.990 0.018 19 0 "[ . 1 . 2]" 1
1174 1 7 VAL MG1 1 161 VAL MG1 4.000 . 4.000 1.788 1.690 1.999 0.010 19 0 "[ . 1 . 2]" 1
1175 1 7 VAL MG1 1 161 VAL MG2 4.000 . 4.000 3.371 3.108 3.606 . 0 0 "[ . 1 . 2]" 1
1176 1 7 VAL MG1 1 163 VAL QG 3.100 . 3.100 2.211 1.967 2.619 . 0 0 "[ . 1 . 2]" 1
1177 1 7 VAL MG1 1 214 LEU HB3 4.180 . 4.180 4.119 3.863 4.256 0.076 13 0 "[ . 1 . 2]" 1
1178 1 7 VAL MG1 1 214 LEU QD 3.550 . 3.550 2.121 1.940 2.209 . 0 0 "[ . 1 . 2]" 1
1179 1 7 VAL MG1 1 214 LEU HG 4.510 . 4.510 4.473 4.270 4.588 0.078 5 0 "[ . 1 . 2]" 1
1180 1 7 VAL MG2 1 96 LEU QD 3.370 . 3.370 2.861 1.994 3.320 . 0 0 "[ . 1 . 2]" 1
1181 1 7 VAL MG2 1 101 VAL HA 5.300 . 5.300 4.910 4.483 5.319 0.019 15 0 "[ . 1 . 2]" 1
1182 1 7 VAL MG2 1 101 VAL QG 2.740 . 2.740 1.995 1.814 2.290 . 0 0 "[ . 1 . 2]" 1
1183 1 7 VAL MG2 1 101 VAL MG1 3.810 . 3.810 2.819 2.003 3.178 . 0 0 "[ . 1 . 2]" 1
1184 1 7 VAL MG2 1 101 VAL MG2 3.810 . 3.810 2.372 1.836 3.844 0.034 6 0 "[ . 1 . 2]" 1
1185 1 7 VAL MG2 1 161 VAL H 3.980 . 3.980 3.903 3.403 4.028 0.048 1 0 "[ . 1 . 2]" 1
1186 1 7 VAL MG2 1 163 VAL QG 4.380 . 4.380 3.961 3.692 4.392 0.012 16 0 "[ . 1 . 2]" 1
1187 1 7 VAL MG2 1 214 LEU HA 4.770 . 4.770 4.492 3.896 4.765 . 0 0 "[ . 1 . 2]" 1
1188 1 7 VAL MG2 1 214 LEU HB3 3.440 . 3.440 3.278 2.834 3.469 0.029 20 0 "[ . 1 . 2]" 1
1189 1 7 VAL H 1 101 VAL QG 3.560 . 3.560 3.276 3.029 3.548 . 0 0 "[ . 1 . 2]" 1
1190 1 7 VAL H 1 102 ARG QB 4.290 . 4.290 3.983 3.610 4.244 . 0 0 "[ . 1 . 2]" 1
1191 1 7 VAL H 1 103 LEU QD 3.870 . 3.870 3.097 2.738 3.688 . 0 0 "[ . 1 . 2]" 1
1192 1 7 VAL H 1 104 ALA MB 4.590 . 4.590 4.282 4.048 4.605 0.015 8 0 "[ . 1 . 2]" 1
1193 1 7 VAL H 1 161 VAL QG 4.530 . 4.530 4.438 4.289 4.600 0.070 12 0 "[ . 1 . 2]" 1
1194 1 8 ILE HA 1 104 ALA MB 3.670 . 3.670 2.947 2.465 3.394 . 0 0 "[ . 1 . 2]" 1
1195 1 8 ILE HA 1 104 ALA H 3.930 . 3.930 3.038 2.679 3.567 . 0 0 "[ . 1 . 2]" 1
1196 1 8 ILE HA 1 146 LEU QD 4.890 . 4.890 4.632 4.446 4.839 . 0 0 "[ . 1 . 2]" 1
1197 1 8 ILE MD 1 104 ALA MB 2.840 . 2.840 2.059 1.692 2.737 0.008 3 0 "[ . 1 . 2]" 1
1198 1 8 ILE MD 1 105 VAL HA 5.500 . 5.500 4.724 3.807 5.621 0.121 17 0 "[ . 1 . 2]" 1
1199 1 8 ILE MD 1 146 LEU HA 5.220 . 5.220 4.581 3.810 5.314 0.094 5 0 "[ . 1 . 2]" 1
1200 1 8 ILE MD 1 146 LEU QD 3.190 . 3.190 2.729 2.477 2.977 . 0 0 "[ . 1 . 2]" 1
1201 1 8 ILE MD 1 146 LEU HG 4.300 . 4.300 4.382 4.296 4.454 0.154 19 0 "[ . 1 . 2]" 1
1202 1 8 ILE MD 1 160 LEU QD 3.020 . 3.020 2.530 1.757 3.065 0.045 12 0 "[ . 1 . 2]" 1
1203 1 8 ILE MD 1 162 MET HA 5.500 . 5.500 4.659 3.940 5.197 . 0 0 "[ . 1 . 2]" 1
1204 1 8 ILE QG 1 106 ALA MB 3.870 . 3.870 3.506 2.570 3.952 0.082 8 0 "[ . 1 . 2]" 1
1205 1 8 ILE QG 1 146 LEU HA 4.510 . 4.510 4.452 4.028 4.671 0.161 1 0 "[ . 1 . 2]" 1
1206 1 8 ILE QG 1 146 LEU QB 4.980 . 4.980 4.870 4.560 5.023 0.043 5 0 "[ . 1 . 2]" 1
1207 1 8 ILE QG 1 146 LEU QD 2.730 . 2.730 1.944 1.684 2.283 0.016 8 0 "[ . 1 . 2]" 1
1208 1 8 ILE QG 1 146 LEU HG 4.300 . 4.300 3.919 3.496 4.343 0.043 13 0 "[ . 1 . 2]" 1
1209 1 8 ILE QG 1 150 LEU QD 3.540 . 3.540 3.012 2.620 3.361 . 0 0 "[ . 1 . 2]" 1
1210 1 8 ILE MG 1 105 VAL HA 3.820 . 3.820 3.178 2.463 3.823 0.003 12 0 "[ . 1 . 2]" 1
1211 1 8 ILE MG 1 106 ALA MB 3.060 . 3.060 1.924 1.683 2.221 0.017 7 0 "[ . 1 . 2]" 1
1212 1 8 ILE MG 1 106 ALA H 4.030 . 4.030 2.704 2.039 3.084 . 0 0 "[ . 1 . 2]" 1
1213 1 8 ILE MG 1 162 MET HA 4.100 . 4.100 3.603 2.852 3.937 . 0 0 "[ . 1 . 2]" 1
1214 1 8 ILE MG 1 162 MET ME 3.060 . 3.060 2.211 1.666 2.840 0.034 7 0 "[ . 1 . 2]" 1
1215 1 8 ILE H 1 104 ALA MB 5.260 . 5.260 4.816 4.261 5.273 0.013 7 0 "[ . 1 . 2]" 1
1216 1 8 ILE H 1 161 VAL QG 3.810 . 3.810 3.330 2.976 3.542 . 0 0 "[ . 1 . 2]" 1
1217 1 8 ILE H 1 162 MET HA 4.320 . 4.320 2.859 2.586 3.208 . 0 0 "[ . 1 . 2]" 1
1218 1 9 PHE HA 1 162 MET ME 3.600 . 3.600 3.530 3.080 3.675 0.075 17 0 "[ . 1 . 2]" 1
1219 1 9 PHE HA 1 163 VAL HB 4.820 . 4.820 2.677 2.324 4.257 . 0 0 "[ . 1 . 2]" 1
1220 1 9 PHE HA 1 163 VAL QG 4.550 . 4.550 3.368 1.730 3.644 . 0 0 "[ . 1 . 2]" 1
1221 1 9 PHE QB 1 14 THR MG 4.010 . 4.010 3.871 3.149 4.168 0.158 20 0 "[ . 1 . 2]" 1
1222 1 9 PHE QB 1 93 LEU QD 4.470 . 4.470 4.118 3.715 4.563 0.093 2 0 "[ . 1 . 2]" 1
1223 1 9 PHE QB 1 163 VAL QG 4.790 . 4.790 3.944 2.944 4.455 . 0 0 "[ . 1 . 2]" 1
1224 1 9 PHE QD 1 14 THR MG 3.470 . 3.470 3.067 2.723 3.485 0.015 20 0 "[ . 1 . 2]" 1
1225 1 9 PHE QD 1 93 LEU QD 4.250 . 4.250 3.685 3.292 4.008 . 0 0 "[ . 1 . 2]" 1
1226 1 9 PHE QD 1 127 PHE QE 3.870 . 3.870 2.437 1.838 3.147 . 0 0 "[ . 1 . 2]" 1
1227 1 9 PHE QD 1 127 PHE HZ 4.730 . 4.730 4.326 3.861 4.754 0.024 2 0 "[ . 1 . 2]" 1
1228 1 9 PHE QD 1 163 VAL HB 4.520 . 4.520 2.519 2.073 4.344 . 0 0 "[ . 1 . 2]" 1
1229 1 9 PHE QD 1 163 VAL QG 3.450 . 3.450 2.481 2.252 2.903 . 0 0 "[ . 1 . 2]" 1
1230 1 9 PHE QD 1 163 VAL MG1 4.550 . 4.550 2.632 2.289 4.045 . 0 0 "[ . 1 . 2]" 1
1231 1 9 PHE QD 1 163 VAL MG2 4.550 . 4.550 3.422 2.285 3.907 . 0 0 "[ . 1 . 2]" 1
1232 1 9 PHE QE 1 14 THR MG 4.410 . 4.410 4.217 3.821 4.459 0.049 1 0 "[ . 1 . 2]" 1
1233 1 9 PHE QE 1 93 LEU QD 3.430 . 3.430 3.344 2.903 3.472 0.042 7 0 "[ . 1 . 2]" 1
1234 1 9 PHE QE 1 96 LEU QD 4.140 . 4.140 2.705 2.152 3.836 . 0 0 "[ . 1 . 2]" 1
1235 1 9 PHE QE 1 103 LEU HA 4.500 . 4.500 3.861 3.449 4.283 . 0 0 "[ . 1 . 2]" 1
1236 1 9 PHE QE 1 163 VAL QG 3.520 . 3.520 2.182 2.010 2.800 . 0 0 "[ . 1 . 2]" 1
1237 1 9 PHE QE 1 163 VAL MG1 4.120 . 4.120 2.351 2.082 3.572 . 0 0 "[ . 1 . 2]" 1
1238 1 9 PHE QE 1 163 VAL MG2 4.120 . 4.120 2.701 2.395 3.108 . 0 0 "[ . 1 . 2]" 1
1239 1 9 PHE QE 1 210 LEU QD 3.860 . 3.860 2.521 1.797 3.117 . 0 0 "[ . 1 . 2]" 1
1240 1 9 PHE QE 1 214 LEU QD 4.220 . 4.220 2.878 2.507 3.135 . 0 0 "[ . 1 . 2]" 1
1241 1 9 PHE H 1 104 ALA MB 4.430 . 4.430 4.152 3.840 4.354 . 0 0 "[ . 1 . 2]" 1
1242 1 9 PHE H 1 105 VAL HA 3.970 . 3.970 2.518 2.021 2.806 . 0 0 "[ . 1 . 2]" 1
1243 1 9 PHE H 1 105 VAL QG 4.790 . 4.790 3.613 2.841 4.048 . 0 0 "[ . 1 . 2]" 1
1244 1 9 PHE H 1 106 ALA H 4.270 . 4.270 3.561 3.053 4.125 . 0 0 "[ . 1 . 2]" 1
1245 1 9 PHE HZ 1 92 LEU QD 4.070 . 4.070 2.941 2.462 3.385 . 0 0 "[ . 1 . 2]" 1
1246 1 9 PHE HZ 1 96 LEU QD 3.530 . 3.530 2.370 1.893 3.368 . 0 0 "[ . 1 . 2]" 1
1247 1 9 PHE HZ 1 96 LEU MD1 4.040 . 4.040 2.969 1.906 4.095 0.055 8 0 "[ . 1 . 2]" 1
1248 1 9 PHE HZ 1 96 LEU MD2 4.040 . 4.040 3.199 2.062 4.063 0.023 10 0 "[ . 1 . 2]" 1
1249 1 9 PHE HZ 1 210 LEU QD 3.890 . 3.890 3.603 2.881 3.983 0.093 20 0 "[ . 1 . 2]" 1
1250 1 9 PHE HZ 1 214 LEU HG 4.860 . 4.860 4.857 4.364 4.930 0.070 8 0 "[ . 1 . 2]" 1
1251 1 10 ASP HA 1 162 MET ME 3.530 . 3.530 3.491 2.804 3.718 0.188 6 0 "[ . 1 . 2]" 1
1252 1 10 ASP QB 1 105 VAL QG 5.060 . 5.060 4.812 4.108 5.180 0.120 4 0 "[ . 1 . 2]" 1
1253 1 10 ASP H 1 105 VAL QG 4.960 . 4.960 4.657 4.246 5.039 0.079 6 0 "[ . 1 . 2]" 1
1254 1 10 ASP H 1 162 MET ME 3.730 . 3.730 3.229 2.697 3.836 0.106 1 0 "[ . 1 . 2]" 1
1255 1 11 LEU H 1 105 VAL QG 4.720 . 4.720 3.928 3.217 4.720 0.000 6 0 "[ . 1 . 2]" 1
1256 1 14 THR MG 1 163 VAL QG 2.920 . 2.920 2.253 1.734 2.876 . 0 0 "[ . 1 . 2]" 1
1257 1 14 THR MG 1 164 GLY QA 4.250 . 4.250 2.967 2.193 4.297 0.047 2 0 "[ . 1 . 2]" 1
1258 1 14 THR MG 1 165 ASP QB 4.350 . 4.350 4.025 3.536 4.389 0.039 14 0 "[ . 1 . 2]" 1
1259 1 14 THR MG 1 165 ASP H 5.090 . 5.090 4.842 4.157 5.206 0.116 6 0 "[ . 1 . 2]" 1
1260 1 16 THR HA 1 85 LEU HA 4.200 . 4.200 3.045 2.014 3.916 . 0 0 "[ . 1 . 2]" 1
1261 1 16 THR HA 1 85 LEU QD 4.760 . 4.760 4.065 2.264 4.845 0.085 10 0 "[ . 1 . 2]" 1
1262 1 16 THR MG 1 84 SER H 4.910 . 4.910 3.455 2.466 4.847 . 0 0 "[ . 1 . 2]" 1
1263 1 16 THR MG 1 85 LEU HA 4.770 . 4.770 3.364 2.147 4.768 . 0 0 "[ . 1 . 2]" 1
1264 1 16 THR MG 1 85 LEU QB 3.680 . 3.680 2.670 1.668 3.734 0.054 2 0 "[ . 1 . 2]" 1
1265 1 16 THR MG 1 85 LEU QD 3.870 . 3.870 3.050 1.769 3.936 0.066 13 0 "[ . 1 . 2]" 1
1266 1 16 THR MG 1 121 PHE QE 3.490 . 3.490 2.375 1.691 3.496 0.009 9 0 "[ . 1 . 2]" 1
1267 1 17 ASP H 1 85 LEU HA 4.330 . 4.330 3.398 2.499 4.353 0.023 14 0 "[ . 1 . 2]" 1
1268 1 18 SER HA 1 84 SER H 5.310 . 5.310 4.705 3.298 5.396 0.086 1 0 "[ . 1 . 2]" 1
1269 1 22 ILE MG 1 46 ILE MD 3.190 . 3.190 2.097 1.696 3.043 0.004 11 0 "[ . 1 . 2]" 1
1270 1 23 VAL HA 1 46 ILE MD 4.060 . 4.060 3.153 2.587 3.835 . 0 0 "[ . 1 . 2]" 1
1271 1 23 VAL QG 1 42 LEU QB 3.400 . 3.400 3.241 2.822 3.555 0.155 13 0 "[ . 1 . 2]" 1
1272 1 23 VAL QG 1 43 ALA HA 3.740 . 3.740 3.063 2.177 3.773 0.033 19 0 "[ . 1 . 2]" 1
1273 1 23 VAL QG 1 43 ALA MB 3.510 . 3.510 2.648 1.931 3.441 . 0 0 "[ . 1 . 2]" 1
1274 1 23 VAL QG 1 46 ILE MD 3.440 . 3.440 2.578 1.791 3.284 . 0 0 "[ . 1 . 2]" 1
1275 1 23 VAL MG1 1 46 ILE MD 4.570 . 4.570 4.060 3.398 4.634 0.064 9 0 "[ . 1 . 2]" 1
1276 1 23 VAL MG2 1 46 ILE MD 4.570 . 4.570 2.615 1.798 3.370 . 0 0 "[ . 1 . 2]" 1
1277 1 26 PHE HA 1 71 TYR QD 3.430 . 3.430 2.584 2.040 3.029 . 0 0 "[ . 1 . 2]" 1
1278 1 26 PHE QB 1 46 ILE MD 3.790 . 3.790 3.207 2.753 3.782 . 0 0 "[ . 1 . 2]" 1
1279 1 26 PHE HB3 1 46 ILE MD 4.590 . 4.590 3.612 3.104 4.122 . 0 0 "[ . 1 . 2]" 1
1280 1 26 PHE HB2 1 46 ILE MD 4.590 . 4.590 3.615 3.077 4.587 . 0 0 "[ . 1 . 2]" 1
1281 1 26 PHE QD 1 42 LEU QB 4.350 . 4.350 4.127 3.507 4.557 0.207 9 0 "[ . 1 . 2]" 1
1282 1 26 PHE QD 1 46 ILE MD 4.000 . 4.000 3.523 2.885 4.019 0.019 5 0 "[ . 1 . 2]" 1
1283 1 26 PHE QD 1 46 ILE MG 4.230 . 4.230 4.012 3.690 4.325 0.095 3 0 "[ . 1 . 2]" 1
1284 1 26 PHE QD 1 58 MET ME 4.940 . 4.940 3.871 3.088 4.582 . 0 0 "[ . 1 . 2]" 1
1285 1 26 PHE QE 1 37 VAL QG 3.720 . 3.720 2.799 2.517 3.369 . 0 0 "[ . 1 . 2]" 1
1286 1 26 PHE QE 1 38 PRO QD 4.340 . 4.340 3.249 2.348 4.350 0.010 9 0 "[ . 1 . 2]" 1
1287 1 26 PHE QE 1 42 LEU QD 3.570 . 3.570 3.174 1.679 3.616 0.046 3 0 "[ . 1 . 2]" 1
1288 1 26 PHE QE 1 42 LEU HG 3.710 . 3.710 3.040 2.360 3.399 . 0 0 "[ . 1 . 2]" 1
1289 1 26 PHE QE 1 46 ILE MG 4.600 . 4.600 4.094 3.341 4.584 . 0 0 "[ . 1 . 2]" 1
1290 1 26 PHE QE 1 58 MET ME 3.200 . 3.200 2.121 1.674 2.862 0.026 17 0 "[ . 1 . 2]" 1
1291 1 26 PHE H 1 46 ILE MD 5.320 . 5.320 5.008 4.537 5.365 0.045 7 0 "[ . 1 . 2]" 1
1292 1 26 PHE H 1 71 TYR QD 4.210 . 4.210 3.502 2.950 4.207 . 0 0 "[ . 1 . 2]" 1
1293 1 26 PHE H 1 71 TYR QE 3.790 . 3.790 3.372 2.938 3.806 0.016 3 0 "[ . 1 . 2]" 1
1294 1 26 PHE HZ 1 37 VAL HA 4.290 . 4.290 3.823 3.243 4.318 0.028 9 0 "[ . 1 . 2]" 1
1295 1 26 PHE HZ 1 37 VAL QG 3.700 . 3.700 2.593 2.150 3.499 . 0 0 "[ . 1 . 2]" 1
1296 1 26 PHE HZ 1 37 VAL MG1 4.850 . 4.850 3.283 2.461 4.984 0.134 3 0 "[ . 1 . 2]" 1
1297 1 26 PHE HZ 1 37 VAL MG2 4.850 . 4.850 3.929 2.153 4.858 0.008 7 0 "[ . 1 . 2]" 1
1298 1 26 PHE HZ 1 38 PRO QD 4.820 . 4.820 2.265 1.782 3.361 . 0 0 "[ . 1 . 2]" 1
1299 1 26 PHE HZ 1 38 PRO QG 3.790 . 3.790 3.517 2.522 3.811 0.021 5 0 "[ . 1 . 2]" 1
1300 1 26 PHE HZ 1 42 LEU HG 4.120 . 4.120 2.448 1.861 3.484 . 0 0 "[ . 1 . 2]" 1
1301 1 26 PHE HZ 1 58 MET ME 4.140 . 4.140 2.652 1.673 3.484 0.027 9 0 "[ . 1 . 2]" 1
1302 1 27 ARG HA 1 37 VAL HB 4.660 . 4.660 4.302 3.848 4.694 0.034 17 0 "[ . 1 . 2]" 1
1303 1 27 ARG HA 1 37 VAL QG 3.290 . 3.290 2.081 1.665 2.327 0.035 12 0 "[ . 1 . 2]" 1
1304 1 27 ARG HA 1 37 VAL MG1 3.840 . 3.840 2.571 1.970 3.788 . 0 0 "[ . 1 . 2]" 1
1305 1 27 ARG HA 1 37 VAL MG2 3.840 . 3.840 2.403 1.670 2.899 0.030 12 0 "[ . 1 . 2]" 1
1306 1 27 ARG QD 1 37 VAL QG 4.070 . 4.070 3.375 2.381 4.056 . 0 0 "[ . 1 . 2]" 1
1307 1 27 ARG QD 1 37 VAL MG1 5.220 . 5.220 3.688 2.399 5.233 0.013 10 0 "[ . 1 . 2]" 1
1308 1 27 ARG QD 1 37 VAL MG2 5.220 . 5.220 4.547 3.587 5.278 0.058 7 0 "[ . 1 . 2]" 1
1309 1 27 ARG QG 1 37 VAL QG 3.280 . 3.280 1.979 1.656 2.785 0.044 20 0 "[ . 1 . 2]" 1
1310 1 29 ALA HA 1 67 ALA HA 4.820 . 4.820 3.845 3.548 4.503 . 0 0 "[ . 1 . 2]" 1
1311 1 29 ALA HA 1 70 ALA MB 3.350 . 3.350 2.355 2.061 2.669 . 0 0 "[ . 1 . 2]" 1
1312 1 29 ALA MB 1 55 LEU QD 4.140 . 4.140 3.323 3.033 3.791 . 0 0 "[ . 1 . 2]" 1
1313 1 29 ALA MB 1 67 ALA HA 3.860 . 3.860 2.957 2.520 3.259 . 0 0 "[ . 1 . 2]" 1
1314 1 29 ALA MB 1 67 ALA MB 3.440 . 3.440 2.619 2.283 3.279 . 0 0 "[ . 1 . 2]" 1
1315 1 29 ALA MB 1 70 ALA HA 5.090 . 5.090 4.957 4.788 5.110 0.020 17 0 "[ . 1 . 2]" 1
1316 1 29 ALA MB 1 70 ALA MB 3.220 . 3.220 2.749 2.520 2.947 . 0 0 "[ . 1 . 2]" 1
1317 1 29 ALA MB 1 70 ALA H 4.980 . 4.980 4.413 4.162 4.615 . 0 0 "[ . 1 . 2]" 1
1318 1 29 ALA MB 1 71 TYR HA 3.450 . 3.450 2.576 2.119 2.939 . 0 0 "[ . 1 . 2]" 1
1319 1 29 ALA MB 1 71 TYR HB3 3.710 . 3.710 3.568 3.233 3.741 0.031 7 0 "[ . 1 . 2]" 1
1320 1 29 ALA MB 1 71 TYR HB2 3.710 . 3.710 2.291 2.084 2.487 . 0 0 "[ . 1 . 2]" 1
1321 1 29 ALA MB 1 71 TYR QD 3.450 . 3.450 3.072 2.479 3.450 . 0 0 "[ . 1 . 2]" 1
1322 1 29 ALA MB 1 71 TYR QE 5.340 . 5.340 4.930 4.252 5.326 . 0 0 "[ . 1 . 2]" 1
1323 1 29 ALA MB 1 71 TYR H 3.630 . 3.630 2.889 2.635 3.086 . 0 0 "[ . 1 . 2]" 1
1324 1 29 ALA H 1 71 TYR QD 4.790 . 4.790 4.469 3.983 4.798 0.008 5 0 "[ . 1 . 2]" 1
1325 1 30 LEU HA 1 35 ALA MB 3.500 . 3.500 2.860 2.645 3.381 . 0 0 "[ . 1 . 2]" 1
1326 1 30 LEU HA 1 37 VAL QG 4.580 . 4.580 4.341 4.101 4.733 0.153 9 0 "[ . 1 . 2]" 1
1327 1 30 LEU HB3 1 35 ALA MB 4.830 . 4.830 2.475 1.970 3.053 . 0 0 "[ . 1 . 2]" 1
1328 1 30 LEU HB2 1 37 VAL QG 4.110 . 4.110 2.172 1.754 2.765 . 0 0 "[ . 1 . 2]" 1
1329 1 30 LEU QD 1 37 VAL HA 3.720 . 3.720 2.764 2.453 3.070 . 0 0 "[ . 1 . 2]" 1
1330 1 30 LEU QD 1 37 VAL QG 2.970 . 2.970 2.302 2.050 2.632 . 0 0 "[ . 1 . 2]" 1
1331 1 30 LEU QD 1 37 VAL MG1 3.470 . 3.470 3.058 2.750 3.477 0.007 12 0 "[ . 1 . 2]" 1
1332 1 30 LEU QD 1 37 VAL MG2 3.470 . 3.470 2.413 2.068 2.949 . 0 0 "[ . 1 . 2]" 1
1333 1 30 LEU QD 1 38 PRO QD 3.450 . 3.450 3.001 2.502 3.274 . 0 0 "[ . 1 . 2]" 1
1334 1 30 LEU QD 1 38 PRO HD3 4.050 . 4.050 3.425 2.767 4.089 0.039 9 0 "[ . 1 . 2]" 1
1335 1 30 LEU QD 1 38 PRO HD2 4.050 . 4.050 3.394 2.854 3.837 . 0 0 "[ . 1 . 2]" 1
1336 1 30 LEU QD 1 38 PRO QG 4.530 . 4.530 4.265 3.477 4.612 0.082 3 0 "[ . 1 . 2]" 1
1337 1 30 LEU QD 1 55 LEU HG 4.890 . 4.890 4.057 3.212 4.569 . 0 0 "[ . 1 . 2]" 1
1338 1 30 LEU QD 1 58 MET HA 5.100 . 5.100 4.951 4.298 5.233 0.133 9 0 "[ . 1 . 2]" 1
1339 1 30 LEU QD 1 58 MET ME 2.800 . 2.800 2.418 2.039 2.850 0.050 5 0 "[ . 1 . 2]" 1
1340 1 30 LEU HG 1 55 LEU QD 4.090 . 4.090 3.349 2.718 3.855 . 0 0 "[ . 1 . 2]" 1
1341 1 31 ASN H 1 37 VAL QG 4.290 . 4.290 3.153 2.830 3.798 . 0 0 "[ . 1 . 2]" 1
1342 1 32 HIS QB 1 70 ALA MB 3.450 . 3.450 2.855 2.389 3.396 . 0 0 "[ . 1 . 2]" 1
1343 1 32 HIS HB3 1 70 ALA MB 4.080 . 4.080 3.075 2.614 3.664 . 0 0 "[ . 1 . 2]" 1
1344 1 32 HIS HB2 1 70 ALA MB 4.080 . 4.080 3.413 2.764 4.014 . 0 0 "[ . 1 . 2]" 1
1345 1 33 ILE HB 1 63 SER HB3 4.560 . 4.560 3.454 2.516 4.134 . 0 0 "[ . 1 . 2]" 1
1346 1 33 ILE HB 1 63 SER HB2 4.530 . 4.530 3.561 3.204 4.437 . 0 0 "[ . 1 . 2]" 1
1347 1 33 ILE MD 1 63 SER HB3 4.110 . 4.110 3.644 2.892 4.126 0.016 13 0 "[ . 1 . 2]" 1
1348 1 33 ILE MD 1 63 SER HB2 3.970 . 3.970 2.930 2.447 3.433 . 0 0 "[ . 1 . 2]" 1
1349 1 33 ILE MD 1 66 GLU QG 4.460 . 4.460 4.377 4.038 4.512 0.052 8 0 "[ . 1 . 2]" 1
1350 1 33 ILE MD 1 67 ALA HA 4.280 . 4.280 3.686 3.370 4.038 . 0 0 "[ . 1 . 2]" 1
1351 1 33 ILE MD 1 67 ALA MB 2.790 . 2.790 1.908 1.662 2.302 0.038 19 0 "[ . 1 . 2]" 1
1352 1 33 ILE MD 1 67 ALA H 4.750 . 4.750 3.907 3.516 4.211 . 0 0 "[ . 1 . 2]" 1
1353 1 33 ILE MG 1 63 SER HB3 3.980 . 3.980 2.968 2.513 3.401 . 0 0 "[ . 1 . 2]" 1
1354 1 33 ILE MG 1 63 SER HB2 4.450 . 4.450 3.434 2.776 4.054 . 0 0 "[ . 1 . 2]" 1
1355 1 33 ILE MG 1 66 GLU QB 3.520 . 3.520 2.844 2.498 3.235 . 0 0 "[ . 1 . 2]" 1
1356 1 33 ILE MG 1 66 GLU QG 3.270 . 3.270 2.080 1.670 2.670 0.030 11 0 "[ . 1 . 2]" 1
1357 1 33 ILE MG 1 66 GLU H 5.070 . 5.070 4.595 4.333 4.952 . 0 0 "[ . 1 . 2]" 1
1358 1 33 ILE MG 1 67 ALA HA 3.960 . 3.960 2.775 2.438 3.305 . 0 0 "[ . 1 . 2]" 1
1359 1 33 ILE MG 1 67 ALA MB 3.220 . 3.220 2.241 1.948 2.548 . 0 0 "[ . 1 . 2]" 1
1360 1 33 ILE MG 1 67 ALA H 4.040 . 4.040 3.107 2.787 3.535 . 0 0 "[ . 1 . 2]" 1
1361 1 33 ILE MG 1 70 ALA MB 4.080 . 4.080 3.707 3.265 4.126 0.046 8 0 "[ . 1 . 2]" 1
1362 1 37 VAL HA 1 58 MET ME 4.040 . 4.040 3.996 3.547 4.180 0.140 1 0 "[ . 1 . 2]" 1
1363 1 38 PRO QD 1 58 MET ME 3.280 . 3.280 2.622 2.165 3.069 . 0 0 "[ . 1 . 2]" 1
1364 1 38 PRO HD3 1 58 MET ME 3.750 . 3.750 3.230 2.914 3.735 . 0 0 "[ . 1 . 2]" 1
1365 1 38 PRO HD2 1 58 MET ME 3.750 . 3.750 2.804 2.230 3.429 . 0 0 "[ . 1 . 2]" 1
1366 1 42 LEU HA 1 58 MET ME 5.320 . 5.320 5.212 4.734 5.378 0.058 12 0 "[ . 1 . 2]" 1
1367 1 42 LEU QD 1 58 MET HA 5.270 . 5.270 5.139 4.769 5.397 0.127 3 0 "[ . 1 . 2]" 1
1368 1 42 LEU QD 1 58 MET QB 4.670 . 4.670 4.325 3.239 4.722 0.052 1 0 "[ . 1 . 2]" 1
1369 1 42 LEU QD 1 58 MET ME 2.950 . 2.950 2.133 1.723 2.362 . 0 0 "[ . 1 . 2]" 1
1370 1 42 LEU QD 1 58 MET QG 4.050 . 4.050 3.680 3.164 4.061 0.011 2 0 "[ . 1 . 2]" 1
1371 1 42 LEU HG 1 58 MET ME 3.280 . 3.280 2.997 2.516 3.350 0.070 7 0 "[ . 1 . 2]" 1
1372 1 45 HIS QB 1 54 THR MG 5.500 . 5.500 4.760 4.168 5.415 . 0 0 "[ . 1 . 2]" 1
1373 1 46 ILE HB 1 54 THR HB 4.770 . 4.770 4.545 4.121 4.826 0.056 16 0 "[ . 1 . 2]" 1
1374 1 46 ILE MD 1 54 THR MG 4.080 . 4.080 3.940 2.890 4.171 0.091 18 0 "[ . 1 . 2]" 1
1375 1 46 ILE MG 1 54 THR MG 3.160 . 3.160 2.068 1.666 2.655 0.034 16 0 "[ . 1 . 2]" 1
1376 1 46 ILE MG 1 58 MET ME 4.460 . 4.460 3.722 2.975 4.338 . 0 0 "[ . 1 . 2]" 1
1377 1 52 HIS HA 1 68 ILE MD 3.590 . 3.590 2.895 2.036 3.619 0.029 13 0 "[ . 1 . 2]" 1
1378 1 52 HIS QB 1 68 ILE MD 4.550 . 4.550 3.929 2.985 4.658 0.108 15 0 "[ . 1 . 2]" 1
1379 1 55 LEU QB 1 64 ALA MB 4.670 . 4.670 3.836 3.052 4.640 . 0 0 "[ . 1 . 2]" 1
1380 1 55 LEU QB 1 67 ALA MB 5.040 . 5.040 4.248 4.006 4.365 . 0 0 "[ . 1 . 2]" 1
1381 1 55 LEU QD 1 64 ALA HA 4.110 . 4.110 2.477 1.808 3.165 . 0 0 "[ . 1 . 2]" 1
1382 1 55 LEU QD 1 67 ALA HA 3.870 . 3.870 3.928 3.827 4.002 0.132 17 0 "[ . 1 . 2]" 1
1383 1 55 LEU QD 1 67 ALA MB 3.250 . 3.250 1.675 1.594 1.776 0.106 8 0 "[ . 1 . 2]" 1
1384 1 55 LEU QD 1 67 ALA H 4.160 . 4.160 3.727 3.463 3.986 . 0 0 "[ . 1 . 2]" 1
1385 1 55 LEU QD 1 68 ILE HA 3.530 . 3.530 3.156 2.516 3.544 0.014 8 0 "[ . 1 . 2]" 1
1386 1 55 LEU QD 1 68 ILE H 3.910 . 3.910 2.944 2.457 3.246 . 0 0 "[ . 1 . 2]" 1
1387 1 55 LEU QD 1 71 TYR QB 4.180 . 4.180 3.807 3.419 4.091 . 0 0 "[ . 1 . 2]" 1
1388 1 55 LEU QD 1 71 TYR QD 4.790 . 4.790 4.618 3.738 4.951 0.161 9 0 "[ . 1 . 2]" 1
1389 1 55 LEU HG 1 64 ALA MB 4.110 . 4.110 3.656 2.772 4.215 0.105 6 0 "[ . 1 . 2]" 1
1390 1 55 LEU HG 1 67 ALA MB 3.600 . 3.600 3.534 3.297 3.671 0.071 8 0 "[ . 1 . 2]" 1
1391 1 56 ARG QB 1 64 ALA MB 5.340 . 5.340 4.256 3.692 5.250 . 0 0 "[ . 1 . 2]" 1
1392 1 56 ARG QD 1 64 ALA MB 4.980 . 4.980 4.531 3.194 5.081 0.101 15 0 "[ . 1 . 2]" 1
1393 1 83 ASN QB 1 121 PHE QE 4.070 . 4.070 3.660 2.945 4.170 0.100 13 0 "[ . 1 . 2]" 1
1394 1 83 ASN QB 1 121 PHE HZ 4.030 . 4.030 2.934 2.103 3.669 . 0 0 "[ . 1 . 2]" 1
1395 1 84 SER HA 1 121 PHE QD 4.340 . 4.340 4.165 3.797 4.406 0.066 2 0 "[ . 1 . 2]" 1
1396 1 84 SER HA 1 121 PHE QE 3.870 . 3.870 1.956 1.598 3.035 0.102 13 0 "[ . 1 . 2]" 1
1397 1 84 SER HA 1 121 PHE HZ 3.870 . 3.870 2.363 1.689 3.250 0.011 12 0 "[ . 1 . 2]" 1
1398 1 84 SER H 1 121 PHE QE 4.100 . 4.100 4.105 3.807 4.250 0.150 3 0 "[ . 1 . 2]" 1
1399 1 85 LEU QB 1 121 PHE QD 4.070 . 4.070 4.037 3.569 4.247 0.177 12 0 "[ . 1 . 2]" 1
1400 1 85 LEU QB 1 121 PHE QE 3.690 . 3.690 3.674 3.470 3.747 0.057 1 0 "[ . 1 . 2]" 1
1401 1 85 LEU QD 1 121 PHE HB3 4.040 . 4.040 2.389 2.263 2.612 . 0 0 "[ . 1 . 2]" 1
1402 1 85 LEU QD 1 121 PHE HB2 4.040 . 4.040 3.278 2.889 3.700 . 0 0 "[ . 1 . 2]" 1
1403 1 85 LEU QD 1 121 PHE QD 4.000 . 4.000 2.551 2.021 2.778 . 0 0 "[ . 1 . 2]" 1
1404 1 85 LEU QD 1 121 PHE QE 4.210 . 4.210 3.271 2.978 3.546 . 0 0 "[ . 1 . 2]" 1
1405 1 85 LEU QD 1 122 GLY H 5.350 . 5.350 5.323 5.007 5.459 0.109 11 0 "[ . 1 . 2]" 1
1406 1 85 LEU QD 1 123 ILE HB 5.260 . 5.260 4.709 3.963 5.214 . 0 0 "[ . 1 . 2]" 1
1407 1 85 LEU QD 1 123 ILE MD 3.230 . 3.230 2.518 1.841 3.153 . 0 0 "[ . 1 . 2]" 1
1408 1 85 LEU QD 1 123 ILE MG 3.630 . 3.630 2.737 2.091 3.113 . 0 0 "[ . 1 . 2]" 1
1409 1 85 LEU HG 1 121 PHE QB 4.720 . 4.720 3.945 3.349 4.466 . 0 0 "[ . 1 . 2]" 1
1410 1 85 LEU HG 1 121 PHE QD 3.990 . 3.990 3.113 2.203 3.920 . 0 0 "[ . 1 . 2]" 1
1411 1 85 LEU HG 1 121 PHE QE 5.110 . 5.110 3.255 2.352 4.045 . 0 0 "[ . 1 . 2]" 1
1412 1 85 LEU H 1 121 PHE QE 4.090 . 4.090 2.698 1.717 3.862 . 0 0 "[ . 1 . 2]" 1
1413 1 88 GLY HA3 1 207 ILE MG 3.890 . 3.890 2.394 1.715 3.182 . 0 0 "[ . 1 . 2]" 1
1414 1 88 GLY HA2 1 207 ILE MG 3.890 . 3.890 3.273 2.244 3.934 0.044 4 0 "[ . 1 . 2]" 1
1415 1 89 ILE HA 1 207 ILE MD 3.980 . 3.980 2.768 2.347 3.232 . 0 0 "[ . 1 . 2]" 1
1416 1 89 ILE MD 1 185 TRP HE1 4.290 . 4.290 3.016 2.229 3.734 . 0 0 "[ . 1 . 2]" 1
1417 1 89 ILE MD 1 185 TRP HH2 4.020 . 4.020 3.823 2.830 4.091 0.071 9 0 "[ . 1 . 2]" 1
1418 1 89 ILE MD 1 185 TRP HZ2 3.390 . 3.390 2.237 1.686 2.827 0.014 7 0 "[ . 1 . 2]" 1
1419 1 89 ILE MD 1 207 ILE HB 4.160 . 4.160 3.919 3.145 4.225 0.065 5 0 "[ . 1 . 2]" 1
1420 1 89 ILE QG 1 185 TRP HZ2 4.150 . 4.150 3.536 2.635 3.994 . 0 0 "[ . 1 . 2]" 1
1421 1 89 ILE QG 1 207 ILE MD 4.060 . 4.060 3.374 2.344 4.091 0.031 10 0 "[ . 1 . 2]" 1
1422 1 89 ILE H 1 185 TRP HZ2 5.500 . 5.500 5.369 4.703 5.573 0.073 14 0 "[ . 1 . 2]" 1
1423 1 91 PRO QG 1 207 ILE MG 4.250 . 4.250 4.090 3.448 4.327 0.077 12 0 "[ . 1 . 2]" 1
1424 1 92 LEU HA 1 216 VAL QG 4.220 . 4.220 4.085 3.725 4.351 0.131 3 0 "[ . 1 . 2]" 1
1425 1 92 LEU QD 1 207 ILE HB 4.250 . 4.250 4.346 4.283 4.396 0.146 15 0 "[ . 1 . 2]" 1
1426 1 92 LEU QD 1 207 ILE MD 3.530 . 3.530 1.634 1.584 1.674 0.116 6 0 "[ . 1 . 2]" 1
1427 1 92 LEU QD 1 210 LEU QD 3.510 . 3.510 2.185 1.805 2.780 . 0 0 "[ . 1 . 2]" 1
1428 1 92 LEU HG 1 207 ILE MD 4.710 . 4.710 3.854 3.685 4.227 . 0 0 "[ . 1 . 2]" 1
1429 1 93 LEU QD 1 123 ILE HB 3.820 . 3.820 2.691 2.031 3.748 . 0 0 "[ . 1 . 2]" 1
1430 1 93 LEU QD 1 123 ILE QG 4.100 . 4.100 3.768 2.887 4.172 0.072 1 0 "[ . 1 . 2]" 1
1431 1 93 LEU QD 1 127 PHE QD 4.240 . 4.240 3.580 3.090 4.121 . 0 0 "[ . 1 . 2]" 1
1432 1 93 LEU QD 1 127 PHE QE 3.220 . 3.220 2.522 2.123 2.804 . 0 0 "[ . 1 . 2]" 1
1433 1 93 LEU QD 1 127 PHE HZ 3.620 . 3.620 2.369 2.021 2.724 . 0 0 "[ . 1 . 2]" 1
1434 1 95 ASP QB 1 216 VAL QG 3.270 . 3.270 2.153 1.675 2.567 0.025 4 0 "[ . 1 . 2]" 1
1435 1 95 ASP HB3 1 216 VAL MG1 4.220 . 4.220 3.062 1.696 4.299 0.079 3 0 "[ . 1 . 2]" 1
1436 1 95 ASP HB3 1 216 VAL MG2 4.220 . 4.220 2.524 1.787 3.534 . 0 0 "[ . 1 . 2]" 1
1437 1 95 ASP HB2 1 216 VAL MG1 4.220 . 4.220 3.656 2.920 4.282 0.062 10 0 "[ . 1 . 2]" 1
1438 1 95 ASP HB2 1 216 VAL MG2 4.220 . 4.220 3.084 2.090 3.951 . 0 0 "[ . 1 . 2]" 1
1439 1 95 ASP H 1 216 VAL QG 4.340 . 4.340 4.337 4.130 4.461 0.121 11 0 "[ . 1 . 2]" 1
1440 1 96 LEU HA 1 101 VAL QG 4.000 . 4.000 2.751 2.430 2.954 . 0 0 "[ . 1 . 2]" 1
1441 1 96 LEU HA 1 103 LEU QD 4.180 . 4.180 3.889 3.633 4.204 0.024 13 0 "[ . 1 . 2]" 1
1442 1 96 LEU HA 1 216 VAL HA 4.620 . 4.620 4.668 4.231 4.815 0.195 16 0 "[ . 1 . 2]" 1
1443 1 96 LEU HA 1 216 VAL QG 3.290 . 3.290 2.049 1.642 2.564 0.058 9 0 "[ . 1 . 2]" 1
1444 1 96 LEU HA 1 216 VAL MG1 4.600 . 4.600 2.696 1.645 4.157 0.055 9 0 "[ . 1 . 2]" 1
1445 1 96 LEU HA 1 216 VAL MG2 4.600 . 4.600 3.087 2.049 4.293 . 0 0 "[ . 1 . 2]" 1
1446 1 96 LEU QB 1 216 VAL QG 4.420 . 4.420 3.462 3.105 3.829 . 0 0 "[ . 1 . 2]" 1
1447 1 96 LEU QB 1 216 VAL MG1 5.050 . 5.050 3.895 3.182 4.972 . 0 0 "[ . 1 . 2]" 1
1448 1 96 LEU QB 1 216 VAL MG2 5.050 . 5.050 4.266 3.590 5.120 0.070 2 0 "[ . 1 . 2]" 1
1449 1 96 LEU QD 1 210 LEU QD 3.960 . 3.960 3.744 3.260 4.100 0.140 1 0 "[ . 1 . 2]" 1
1450 1 96 LEU QD 1 211 ARG H 5.370 . 5.370 5.078 4.226 5.442 0.072 5 0 "[ . 1 . 2]" 1
1451 1 96 LEU QD 1 214 LEU HB3 3.770 . 3.770 2.752 2.347 3.529 . 0 0 "[ . 1 . 2]" 1
1452 1 96 LEU QD 1 214 LEU HB2 4.240 . 4.240 2.650 2.369 3.180 . 0 0 "[ . 1 . 2]" 1
1453 1 96 LEU QD 1 214 LEU QD 3.070 . 3.070 1.797 1.646 1.999 0.054 13 0 "[ . 1 . 2]" 1
1454 1 96 LEU QD 1 216 VAL HA 4.690 . 4.690 4.302 3.831 4.762 0.072 7 0 "[ . 1 . 2]" 1
1455 1 96 LEU QD 1 216 VAL HB 4.210 . 4.210 3.053 1.920 4.194 . 0 0 "[ . 1 . 2]" 1
1456 1 96 LEU QD 1 216 VAL QG 2.520 . 2.520 1.850 1.615 2.193 0.085 16 0 "[ . 1 . 2]" 1
1457 1 96 LEU MD1 1 216 VAL MG1 4.910 . 4.910 3.169 1.686 4.471 0.014 11 0 "[ . 1 . 2]" 1
1458 1 96 LEU MD1 1 216 VAL MG2 4.910 . 4.910 3.452 1.772 4.779 . 0 0 "[ . 1 . 2]" 1
1459 1 96 LEU MD2 1 216 VAL MG1 4.910 . 4.910 2.696 1.680 4.866 0.020 16 0 "[ . 1 . 2]" 1
1460 1 96 LEU MD2 1 216 VAL MG2 4.910 . 4.910 3.270 2.120 4.704 . 0 0 "[ . 1 . 2]" 1
1461 1 96 LEU H 1 216 VAL QG 4.010 . 4.010 2.991 2.812 3.242 . 0 0 "[ . 1 . 2]" 1
1462 1 97 ARG H 1 103 LEU QD 4.100 . 4.100 3.169 2.649 3.751 . 0 0 "[ . 1 . 2]" 1
1463 1 99 ALA MB 1 216 VAL HA 4.180 . 4.180 2.977 2.403 3.682 . 0 0 "[ . 1 . 2]" 1
1464 1 99 ALA MB 1 216 VAL HB 4.000 . 4.000 3.504 2.801 4.117 0.117 4 0 "[ . 1 . 2]" 1
1465 1 99 ALA MB 1 216 VAL QG 3.160 . 3.160 2.109 1.687 2.578 0.013 1 0 "[ . 1 . 2]" 1
1466 1 99 ALA MB 1 216 VAL MG1 4.650 . 4.650 3.096 1.720 4.617 . 0 0 "[ . 1 . 2]" 1
1467 1 99 ALA MB 1 216 VAL MG2 4.650 . 4.650 3.262 1.689 4.599 0.011 1 0 "[ . 1 . 2]" 1
1468 1 104 ALA HA 1 127 PHE HB3 4.300 . 4.300 2.719 1.946 3.860 . 0 0 "[ . 1 . 2]" 1
1469 1 104 ALA HA 1 128 GLU H 4.230 . 4.230 3.090 2.667 3.495 . 0 0 "[ . 1 . 2]" 1
1470 1 104 ALA HA 1 129 VAL H 3.870 . 3.870 2.668 2.350 2.945 . 0 0 "[ . 1 . 2]" 1
1471 1 104 ALA HA 1 130 ILE HA 4.770 . 4.770 4.651 4.433 4.858 0.088 1 0 "[ . 1 . 2]" 1
1472 1 104 ALA MB 1 128 GLU HB3 3.750 . 3.750 3.024 2.455 3.745 . 0 0 "[ . 1 . 2]" 1
1473 1 104 ALA MB 1 128 GLU H 4.290 . 4.290 3.771 3.203 4.323 0.033 11 0 "[ . 1 . 2]" 1
1474 1 104 ALA MB 1 129 VAL HB 3.570 . 3.570 2.810 2.004 3.729 0.159 8 0 "[ . 1 . 2]" 1
1475 1 104 ALA MB 1 129 VAL QG 3.740 . 3.740 2.884 1.685 3.555 0.015 12 0 "[ . 1 . 2]" 1
1476 1 104 ALA MB 1 129 VAL H 3.680 . 3.680 2.701 2.259 3.057 . 0 0 "[ . 1 . 2]" 1
1477 1 104 ALA MB 1 130 ILE HA 4.600 . 4.600 4.473 4.079 4.664 0.064 12 0 "[ . 1 . 2]" 1
1478 1 104 ALA MB 1 153 LEU QD 3.250 . 3.250 2.924 2.526 3.304 0.054 5 0 "[ . 1 . 2]" 1
1479 1 104 ALA H 1 127 PHE QD 4.150 . 4.150 3.263 2.610 4.169 0.019 11 0 "[ . 1 . 2]" 1
1480 1 104 ALA H 1 129 VAL H 5.290 . 5.290 5.212 5.028 5.335 0.045 9 0 "[ . 1 . 2]" 1
1481 1 105 VAL HB 1 130 ILE HA 5.500 . 5.500 3.257 1.795 4.869 . 0 0 "[ . 1 . 2]" 1
1482 1 105 VAL HB 1 130 ILE MD 4.180 . 4.180 3.573 1.787 4.318 0.138 1 0 "[ . 1 . 2]" 1
1483 1 105 VAL HB 1 130 ILE MG 4.520 . 4.520 3.314 2.091 4.616 0.096 2 0 "[ . 1 . 2]" 1
1484 1 105 VAL QG 1 114 ALA MB 4.360 . 4.360 3.733 3.057 4.317 . 0 0 "[ . 1 . 2]" 1
1485 1 105 VAL QG 1 127 PHE HB3 3.740 . 3.740 2.848 2.405 3.445 . 0 0 "[ . 1 . 2]" 1
1486 1 105 VAL QG 1 127 PHE QD 4.250 . 4.250 2.921 2.677 3.438 . 0 0 "[ . 1 . 2]" 1
1487 1 105 VAL QG 1 127 PHE QE 3.530 . 3.530 3.169 2.617 3.555 0.025 15 0 "[ . 1 . 2]" 1
1488 1 105 VAL QG 1 127 PHE HZ 4.880 . 4.880 3.702 3.207 4.504 . 0 0 "[ . 1 . 2]" 1
1489 1 105 VAL QG 1 130 ILE HA 4.260 . 4.260 2.402 1.639 3.004 0.061 16 0 "[ . 1 . 2]" 1
1490 1 105 VAL QG 1 130 ILE HB 4.180 . 4.180 4.159 3.678 4.366 0.186 10 0 "[ . 1 . 2]" 1
1491 1 105 VAL QG 1 130 ILE MD 3.330 . 3.330 2.225 1.836 3.346 0.016 19 0 "[ . 1 . 2]" 1
1492 1 105 VAL QG 1 130 ILE MG 3.050 . 3.050 2.127 1.874 2.407 . 0 0 "[ . 1 . 2]" 1
1493 1 105 VAL QG 1 131 ALA H 4.480 . 4.480 2.894 2.244 3.563 . 0 0 "[ . 1 . 2]" 1
1494 1 105 VAL MG1 1 127 PHE QE 4.700 . 4.700 4.182 2.645 4.815 0.115 8 0 "[ . 1 . 2]" 1
1495 1 105 VAL MG1 1 130 ILE MG 3.910 . 3.910 2.564 2.025 4.051 0.141 4 0 "[ . 1 . 2]" 1
1496 1 105 VAL MG2 1 127 PHE QE 4.700 . 4.700 3.556 2.801 4.550 . 0 0 "[ . 1 . 2]" 1
1497 1 105 VAL MG2 1 130 ILE MG 3.910 . 3.910 2.945 1.877 3.957 0.047 16 0 "[ . 1 . 2]" 1
1498 1 105 VAL H 1 127 PHE QD 4.330 . 4.330 3.975 3.029 4.345 0.015 17 0 "[ . 1 . 2]" 1
1499 1 105 VAL H 1 129 VAL H 4.260 . 4.260 3.847 3.520 4.275 0.015 18 0 "[ . 1 . 2]" 1
1500 1 105 VAL H 1 130 ILE HA 4.160 . 4.160 2.921 2.584 3.348 . 0 0 "[ . 1 . 2]" 1
1501 1 105 VAL H 1 131 ALA H 4.000 . 4.000 3.442 3.160 3.891 . 0 0 "[ . 1 . 2]" 1
1502 1 106 ALA HA 1 131 ALA MB 3.860 . 3.860 2.148 1.677 2.750 0.023 2 0 "[ . 1 . 2]" 1
1503 1 106 ALA HA 1 131 ALA H 4.320 . 4.320 3.207 2.596 3.770 . 0 0 "[ . 1 . 2]" 1
1504 1 106 ALA HA 1 145 VAL QG 3.790 . 3.790 3.118 2.325 3.834 0.044 15 0 "[ . 1 . 2]" 1
1505 1 106 ALA MB 1 131 ALA H 4.630 . 4.630 4.080 3.553 4.624 . 0 0 "[ . 1 . 2]" 1
1506 1 106 ALA MB 1 146 LEU HA 4.100 . 4.100 2.966 2.566 3.495 . 0 0 "[ . 1 . 2]" 1
1507 1 106 ALA MB 1 146 LEU QD 2.950 . 2.950 2.489 2.182 2.891 . 0 0 "[ . 1 . 2]" 1
1508 1 106 ALA MB 1 149 ALA MB 3.520 . 3.520 3.050 2.704 3.614 0.094 2 0 "[ . 1 . 2]" 1
1509 1 106 ALA MB 1 162 MET ME 3.110 . 3.110 3.161 3.115 3.263 0.153 7 0 "[ . 1 . 2]" 1
1510 1 106 ALA H 1 162 MET ME 4.940 . 4.940 4.034 3.425 4.542 . 0 0 "[ . 1 . 2]" 1
1511 1 107 THR H 1 131 ALA MB 4.140 . 4.140 3.722 3.167 4.227 0.087 1 0 "[ . 1 . 2]" 1
1512 1 107 THR H 1 145 VAL QG 3.930 . 3.930 3.412 2.845 4.017 0.087 18 0 "[ . 1 . 2]" 1
1513 1 110 ALA MB 1 133 ALA MB 4.210 . 4.210 3.640 3.097 4.415 0.205 18 0 "[ . 1 . 2]" 1
1514 1 110 ALA H 1 133 ALA MB 4.160 . 4.160 3.670 3.106 4.206 0.046 18 0 "[ . 1 . 2]" 1
1515 1 114 ALA MB 1 130 ILE MD 5.350 . 5.350 5.098 4.676 5.447 0.097 11 0 "[ . 1 . 2]" 1
1516 1 114 ALA MB 1 130 ILE MG 3.450 . 3.450 3.045 2.467 3.501 0.051 15 0 "[ . 1 . 2]" 1
1517 1 124 GLU HA 1 130 ILE MD 3.790 . 3.790 3.225 2.781 3.797 0.007 11 0 "[ . 1 . 2]" 1
1518 1 124 GLU QB 1 130 ILE MD 4.530 . 4.530 4.138 2.848 4.637 0.107 1 0 "[ . 1 . 2]" 1
1519 1 124 GLU QB 1 130 ILE QG 4.820 . 4.820 4.338 2.750 4.915 0.095 15 0 "[ . 1 . 2]" 1
1520 1 124 GLU QG 1 130 ILE MD 4.080 . 4.080 3.370 2.436 4.141 0.061 17 0 "[ . 1 . 2]" 1
1521 1 124 GLU QG 1 130 ILE QG 4.190 . 4.190 3.334 2.419 4.277 0.087 7 0 "[ . 1 . 2]" 1
1522 1 129 VAL QG 1 149 ALA HA 3.410 . 3.410 2.687 1.840 3.273 . 0 0 "[ . 1 . 2]" 1
1523 1 129 VAL QG 1 149 ALA MB 4.010 . 4.010 2.705 2.055 3.268 . 0 0 "[ . 1 . 2]" 1
1524 1 129 VAL QG 1 152 GLN QB 3.440 . 3.440 2.504 1.919 3.228 . 0 0 "[ . 1 . 2]" 1
1525 1 129 VAL QG 1 152 GLN QG 4.250 . 4.250 3.113 1.946 4.198 . 0 0 "[ . 1 . 2]" 1
1526 1 129 VAL QG 1 152 GLN H 4.960 . 4.960 4.210 3.533 4.890 . 0 0 "[ . 1 . 2]" 1
1527 1 129 VAL QG 1 153 LEU H 4.130 . 4.130 3.459 2.617 4.026 . 0 0 "[ . 1 . 2]" 1
1528 1 129 VAL MG1 1 153 LEU QD 3.590 . 3.590 3.019 1.864 3.642 0.052 19 0 "[ . 1 . 2]" 1
1529 1 129 VAL MG1 1 153 LEU H 4.730 . 4.730 4.217 3.634 4.656 . 0 0 "[ . 1 . 2]" 1
1530 1 129 VAL MG2 1 153 LEU QD 3.590 . 3.590 2.788 1.855 3.613 0.023 12 0 "[ . 1 . 2]" 1
1531 1 129 VAL MG2 1 153 LEU H 4.730 . 4.730 3.720 2.661 4.407 . 0 0 "[ . 1 . 2]" 1
1532 1 131 ALA MB 1 149 ALA HA 3.560 . 3.560 3.194 2.714 3.592 0.032 3 0 "[ . 1 . 2]" 1
1533 1 131 ALA MB 1 153 LEU QD 5.300 . 5.300 4.944 4.378 5.266 . 0 0 "[ . 1 . 2]" 1
1534 1 133 ALA HA 1 145 VAL QG 3.990 . 3.990 2.935 1.956 3.940 . 0 0 "[ . 1 . 2]" 1
1535 1 133 ALA MB 1 145 VAL QG 4.410 . 4.410 3.180 2.654 3.958 . 0 0 "[ . 1 . 2]" 1
1536 1 134 SER H 1 145 VAL QG 5.260 . 5.260 4.291 3.276 5.331 0.071 18 0 "[ . 1 . 2]" 1
1537 1 146 LEU QD 1 162 MET ME 3.770 . 3.770 3.377 3.113 3.792 0.022 12 0 "[ . 1 . 2]" 1
1538 1 146 LEU QD 1 162 MET QG 4.040 . 4.040 2.970 2.294 3.599 . 0 0 "[ . 1 . 2]" 1
1539 1 146 LEU QD 1 173 ALA HA 3.110 . 3.110 2.351 2.006 2.499 . 0 0 "[ . 1 . 2]" 1
1540 1 146 LEU QD 1 173 ALA MB 2.830 . 2.830 2.726 2.491 2.926 0.096 9 0 "[ . 1 . 2]" 1
1541 1 146 LEU QD 1 173 ALA H 3.690 . 3.690 3.690 3.388 3.798 0.108 10 0 "[ . 1 . 2]" 1
1542 1 146 LEU QD 1 174 ALA H 5.050 . 5.050 5.033 4.760 5.113 0.063 13 0 "[ . 1 . 2]" 1
1543 1 146 LEU QD 1 176 HIS QB 3.830 . 3.830 2.877 2.493 3.629 . 0 0 "[ . 1 . 2]" 1
1544 1 146 LEU QD 1 176 HIS H 4.680 . 4.680 4.392 3.915 4.731 0.051 8 0 "[ . 1 . 2]" 1
1545 1 146 LEU QD 1 178 ILE MG 2.990 . 2.990 2.998 2.755 3.093 0.103 7 0 "[ . 1 . 2]" 1
1546 1 146 LEU HG 1 178 ILE MD 3.480 . 3.480 3.209 2.886 3.541 0.061 19 0 "[ . 1 . 2]" 1
1547 1 150 LEU HA 1 156 LEU QD 3.830 . 3.830 3.587 3.039 3.895 0.065 12 0 "[ . 1 . 2]" 1
1548 1 150 LEU QD 1 160 LEU QB 4.180 . 4.180 3.526 3.190 3.835 . 0 0 "[ . 1 . 2]" 1
1549 1 150 LEU QD 1 160 LEU QD 2.800 . 2.800 2.402 1.967 2.740 . 0 0 "[ . 1 . 2]" 1
1550 1 150 LEU QD 1 160 LEU HG 2.770 . 2.770 2.294 1.845 2.753 . 0 0 "[ . 1 . 2]" 1
1551 1 150 LEU QD 1 176 HIS QB 4.420 . 4.420 4.216 3.689 4.602 0.182 7 0 "[ . 1 . 2]" 1
1552 1 150 LEU QD 1 178 ILE MD 3.100 . 3.100 2.509 2.085 2.997 . 0 0 "[ . 1 . 2]" 1
1553 1 150 LEU MD1 1 160 LEU MD1 4.300 . 4.300 2.907 2.428 3.825 . 0 0 "[ . 1 . 2]" 1
1554 1 150 LEU MD1 1 160 LEU MD2 4.300 . 4.300 3.528 3.010 4.051 . 0 0 "[ . 1 . 2]" 1
1555 1 150 LEU MD1 1 160 LEU HG 3.260 . 3.260 3.184 2.661 3.344 0.084 12 0 "[ . 1 . 2]" 1
1556 1 150 LEU MD2 1 160 LEU MD1 4.300 . 4.300 3.197 2.157 3.830 . 0 0 "[ . 1 . 2]" 1
1557 1 150 LEU MD2 1 160 LEU MD2 4.300 . 4.300 3.101 2.326 3.940 . 0 0 "[ . 1 . 2]" 1
1558 1 150 LEU MD2 1 160 LEU HG 3.260 . 3.260 2.383 1.855 2.967 . 0 0 "[ . 1 . 2]" 1
1559 1 150 LEU H 1 156 LEU QD 5.440 . 5.440 4.637 4.277 4.909 . 0 0 "[ . 1 . 2]" 1
1560 1 151 ALA HA 1 156 LEU QD 3.440 . 3.440 2.678 2.339 3.017 . 0 0 "[ . 1 . 2]" 1
1561 1 151 ALA HA 1 156 LEU MD1 4.260 . 4.260 3.412 2.518 4.337 0.077 6 0 "[ . 1 . 2]" 1
1562 1 151 ALA HA 1 156 LEU MD2 4.260 . 4.260 3.329 2.409 4.321 0.061 16 0 "[ . 1 . 2]" 1
1563 1 160 LEU QB 1 178 ILE MG 3.580 . 3.580 2.186 1.661 3.880 0.300 12 0 "[ . 1 . 2]" 1
1564 1 160 LEU QD 1 178 ILE MG 3.230 . 3.230 2.585 1.655 3.054 0.045 12 0 "[ . 1 . 2]" 1
1565 1 160 LEU HG 1 178 ILE MG 4.070 . 4.070 3.632 3.134 4.082 0.012 19 0 "[ . 1 . 2]" 1
1566 1 161 VAL HA 1 178 ILE MG 3.520 . 3.520 2.571 2.319 3.113 . 0 0 "[ . 1 . 2]" 1
1567 1 161 VAL HA 1 179 ASP QB 4.190 . 4.190 3.202 2.280 4.249 0.059 6 0 "[ . 1 . 2]" 1
1568 1 161 VAL HA 1 179 ASP H 4.240 . 4.240 3.562 3.125 4.039 . 0 0 "[ . 1 . 2]" 1
1569 1 161 VAL HB 1 179 ASP QB 4.390 . 4.390 3.443 2.452 4.436 0.046 6 0 "[ . 1 . 2]" 1
1570 1 161 VAL HB 1 214 LEU QD 4.530 . 4.530 4.294 3.753 4.593 0.063 18 0 "[ . 1 . 2]" 1
1571 1 161 VAL QG 1 179 ASP QB 3.410 . 3.410 2.762 2.097 3.371 . 0 0 "[ . 1 . 2]" 1
1572 1 161 VAL QG 1 180 THR HA 4.370 . 4.370 2.808 2.379 3.736 . 0 0 "[ . 1 . 2]" 1
1573 1 161 VAL QG 1 181 VAL H 4.160 . 4.160 3.207 2.776 3.627 . 0 0 "[ . 1 . 2]" 1
1574 1 162 MET HA 1 173 ALA MB 4.500 . 4.500 4.482 4.252 4.619 0.119 1 0 "[ . 1 . 2]" 1
1575 1 162 MET QB 1 173 ALA MB 3.590 . 3.590 2.193 2.028 2.328 . 0 0 "[ . 1 . 2]" 1
1576 1 162 MET ME 1 169 ASP HA 4.570 . 4.570 3.973 2.332 4.633 0.063 14 0 "[ . 1 . 2]" 1
1577 1 162 MET ME 1 169 ASP QB 3.160 . 3.160 2.364 1.880 2.834 . 0 0 "[ . 1 . 2]" 1
1578 1 162 MET QG 1 173 ALA MB 3.410 . 3.410 2.254 1.905 2.815 . 0 0 "[ . 1 . 2]" 1
1579 1 162 MET QG 1 178 ILE MG 4.670 . 4.670 4.034 2.583 4.621 . 0 0 "[ . 1 . 2]" 1
1580 1 162 MET H 1 173 ALA MB 4.130 . 4.130 3.814 3.566 4.107 . 0 0 "[ . 1 . 2]" 1
1581 1 162 MET H 1 178 ILE MG 4.050 . 4.050 2.764 2.393 3.199 . 0 0 "[ . 1 . 2]" 1
1582 1 163 VAL QG 1 214 LEU QD 3.110 . 3.110 2.289 1.910 2.614 . 0 0 "[ . 1 . 2]" 1
1583 1 173 ALA HA 1 178 ILE HB 4.020 . 4.020 2.828 2.354 3.180 . 0 0 "[ . 1 . 2]" 1
1584 1 173 ALA HA 1 178 ILE MG 4.290 . 4.290 3.872 3.359 4.184 . 0 0 "[ . 1 . 2]" 1
1585 1 173 ALA MB 1 178 ILE HB 3.150 . 3.150 2.391 2.089 2.729 . 0 0 "[ . 1 . 2]" 1
1586 1 173 ALA MB 1 178 ILE MD 4.280 . 4.280 3.436 2.999 3.730 . 0 0 "[ . 1 . 2]" 1
1587 1 173 ALA MB 1 178 ILE MG 2.890 . 2.890 2.643 2.378 2.852 . 0 0 "[ . 1 . 2]" 1
1588 1 185 TRP HE3 1 206 THR HA 4.910 . 4.910 3.547 2.334 5.004 0.094 1 0 "[ . 1 . 2]" 1
1589 1 185 TRP HH2 1 204 ALA MB 4.600 . 4.600 4.416 3.708 4.645 0.045 5 0 "[ . 1 . 2]" 1
1590 1 185 TRP HH2 1 207 ILE HA 4.300 . 4.300 2.246 1.916 2.738 . 0 0 "[ . 1 . 2]" 1
1591 1 185 TRP HH2 1 207 ILE HB 4.360 . 4.360 2.930 2.480 3.422 . 0 0 "[ . 1 . 2]" 1
1592 1 185 TRP HH2 1 207 ILE MD 3.890 . 3.890 2.329 2.001 2.960 . 0 0 "[ . 1 . 2]" 1
1593 1 185 TRP HH2 1 207 ILE MG 4.670 . 4.670 4.340 4.052 4.667 . 0 0 "[ . 1 . 2]" 1
1594 1 185 TRP HH2 1 210 LEU QB 4.260 . 4.260 3.662 2.709 4.264 0.004 1 0 "[ . 1 . 2]" 1
1595 1 185 TRP HH2 1 210 LEU QD 3.580 . 3.580 2.635 1.994 3.196 . 0 0 "[ . 1 . 2]" 1
1596 1 185 TRP HZ2 1 207 ILE MD 3.820 . 3.820 2.822 1.904 3.651 . 0 0 "[ . 1 . 2]" 1
1597 1 185 TRP HZ2 1 210 LEU QB 5.500 . 5.500 5.199 4.211 5.558 0.058 13 0 "[ . 1 . 2]" 1
1598 1 185 TRP HZ2 1 210 LEU QD 3.830 . 3.830 3.461 2.571 3.914 0.084 9 0 "[ . 1 . 2]" 1
1599 1 185 TRP HZ3 1 204 ALA MB 4.250 . 4.250 3.951 2.924 4.319 0.069 14 0 "[ . 1 . 2]" 1
1600 1 185 TRP HZ3 1 206 THR HA 4.450 . 4.450 2.698 1.918 4.216 . 0 0 "[ . 1 . 2]" 1
1601 1 185 TRP HZ3 1 206 THR H 4.900 . 4.900 4.132 3.563 4.707 . 0 0 "[ . 1 . 2]" 1
1602 1 185 TRP HZ3 1 207 ILE HA 4.060 . 4.060 3.203 2.092 4.077 0.017 11 0 "[ . 1 . 2]" 1
1603 1 185 TRP HZ3 1 210 LEU QD 4.190 . 4.190 4.061 2.872 4.274 0.084 10 0 "[ . 1 . 2]" 1
1604 1 204 ALA MB 1 209 GLU QB 3.950 . 3.950 2.284 1.688 3.817 0.012 6 0 "[ . 1 . 2]" 1
1605 1 204 ALA MB 1 209 GLU H 4.230 . 4.230 3.999 3.537 4.275 0.045 18 0 "[ . 1 . 2]" 1
1606 1 204 ALA MB 1 210 LEU HA 3.840 . 3.840 3.182 2.845 3.717 . 0 0 "[ . 1 . 2]" 1
1607 1 204 ALA MB 1 210 LEU QB 4.000 . 4.000 3.313 2.194 4.065 0.065 11 0 "[ . 1 . 2]" 1
1608 1 204 ALA MB 1 210 LEU H 4.140 . 4.140 3.139 2.756 3.563 . 0 0 "[ . 1 . 2]" 1
1609 1 204 ALA MB 1 213 ALA MB 4.050 . 4.050 3.881 3.528 4.106 0.056 14 0 "[ . 1 . 2]" 1
1610 1 211 ARG HA 1 216 VAL QG 3.340 . 3.340 2.477 2.088 3.047 . 0 0 "[ . 1 . 2]" 1
1611 1 211 ARG HA 1 216 VAL MG1 4.770 . 4.770 3.433 2.091 4.867 0.097 16 0 "[ . 1 . 2]" 1
1612 1 211 ARG HA 1 216 VAL MG2 4.770 . 4.770 3.533 2.196 4.904 0.134 3 0 "[ . 1 . 2]" 1
1613 1 211 ARG QB 1 216 VAL QG 3.640 . 3.640 2.656 1.702 3.383 . 0 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 164
_Distance_constraint_stats_list.Viol_count 378
_Distance_constraint_stats_list.Viol_total 343.298
_Distance_constraint_stats_list.Viol_max 0.178
_Distance_constraint_stats_list.Viol_rms 0.0186
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0052
_Distance_constraint_stats_list.Viol_average_violations_only 0.0454
_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 5 GLN 0.544 0.100 19 0 "[ . 1 . 2]"
1 6 LEU 2.311 0.129 19 0 "[ . 1 . 2]"
1 7 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 PHE 0.123 0.044 4 0 "[ . 1 . 2]"
1 10 ASP 1.336 0.178 9 0 "[ . 1 . 2]"
1 18 SER 0.081 0.068 10 0 "[ . 1 . 2]"
1 19 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ARG 0.047 0.035 1 0 "[ . 1 . 2]"
1 21 GLY 0.053 0.024 11 0 "[ . 1 . 2]"
1 22 ILE 0.081 0.068 10 0 "[ . 1 . 2]"
1 23 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 SER 0.170 0.063 14 0 "[ . 1 . 2]"
1 25 SER 0.053 0.024 11 0 "[ . 1 . 2]"
1 26 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 ARG 0.017 0.017 7 0 "[ . 1 . 2]"
1 28 HIS 0.124 0.063 14 0 "[ . 1 . 2]"
1 29 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 ASN 0.017 0.017 7 0 "[ . 1 . 2]"
1 32 HIS 0.001 0.001 7 0 "[ . 1 . 2]"
1 42 LEU 0.374 0.076 12 0 "[ . 1 . 2]"
1 46 ILE 0.374 0.076 12 0 "[ . 1 . 2]"
1 50 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 MET 0.036 0.036 2 0 "[ . 1 . 2]"
1 52 HIS 1.135 0.133 10 0 "[ . 1 . 2]"
1 53 GLU 0.012 0.012 10 0 "[ . 1 . 2]"
1 54 THR 0.817 0.135 9 0 "[ . 1 . 2]"
1 55 LEU 0.036 0.036 2 0 "[ . 1 . 2]"
1 56 ARG 1.135 0.133 10 0 "[ . 1 . 2]"
1 57 ALA 0.012 0.012 10 0 "[ . 1 . 2]"
1 58 MET 0.817 0.135 9 0 "[ . 1 . 2]"
1 63 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 GLU 0.109 0.042 12 0 "[ . 1 . 2]"
1 66 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 VAL 0.109 0.042 12 0 "[ . 1 . 2]"
1 70 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 ALA 0.525 0.110 1 0 "[ . 1 . 2]"
1 74 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ALA 0.525 0.110 1 0 "[ . 1 . 2]"
1 78 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 GLY 0.297 0.078 3 0 "[ . 1 . 2]"
1 89 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLY 0.598 0.104 4 0 "[ . 1 . 2]"
1 91 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 LEU 0.297 0.078 3 0 "[ . 1 . 2]"
1 93 LEU 0.052 0.028 7 0 "[ . 1 . 2]"
1 94 ALA 0.640 0.104 4 0 "[ . 1 . 2]"
1 95 ASP 0.007 0.007 13 0 "[ . 1 . 2]"
1 96 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ARG 0.052 0.028 7 0 "[ . 1 . 2]"
1 98 THR 0.042 0.042 12 0 "[ . 1 . 2]"
1 99 ALA 0.007 0.007 13 0 "[ . 1 . 2]"
1 102 ARG 0.544 0.100 19 0 "[ . 1 . 2]"
1 104 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 VAL 0.169 0.044 7 0 "[ . 1 . 2]"
1 106 ALA 0.123 0.044 4 0 "[ . 1 . 2]"
1 107 THR 0.256 0.069 17 0 "[ . 1 . 2]"
1 110 ALA 0.143 0.052 4 0 "[ . 1 . 2]"
1 111 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 PRO 0.504 0.125 10 0 "[ . 1 . 2]"
1 113 THR 0.290 0.065 14 0 "[ . 1 . 2]"
1 114 ALA 0.143 0.052 4 0 "[ . 1 . 2]"
1 115 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 ARG 0.606 0.125 10 0 "[ . 1 . 2]"
1 117 ILE 0.829 0.130 9 0 "[ . 1 . 2]"
1 118 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 HIS 0.102 0.045 6 0 "[ . 1 . 2]"
1 121 PHE 0.539 0.130 9 0 "[ . 1 . 2]"
1 129 VAL 0.151 0.044 7 0 "[ . 1 . 2]"
1 131 ALA 0.274 0.069 17 0 "[ . 1 . 2]"
1 143 VAL 0.339 0.092 19 0 "[ . 1 . 2]"
1 144 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 145 VAL 0.127 0.044 18 0 "[ . 1 . 2]"
1 146 LEU 0.047 0.024 8 0 "[ . 1 . 2]"
1 147 ALA 0.339 0.092 19 0 "[ . 1 . 2]"
1 148 HIS 0.158 0.034 19 0 "[ . 1 . 2]"
1 149 ALA 0.419 0.051 14 0 "[ . 1 . 2]"
1 150 LEU 0.047 0.024 8 0 "[ . 1 . 2]"
1 151 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 GLN 0.158 0.034 19 0 "[ . 1 . 2]"
1 153 LEU 0.291 0.051 14 0 "[ . 1 . 2]"
1 159 ARG 1.153 0.110 11 0 "[ . 1 . 2]"
1 161 VAL 1.158 0.129 19 0 "[ . 1 . 2]"
1 162 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 163 VAL 1.336 0.178 9 0 "[ . 1 . 2]"
1 164 GLY 0.269 0.040 2 0 "[ . 1 . 2]"
1 166 ARG 1.198 0.167 9 0 "[ . 1 . 2]"
1 167 SER 0.357 0.083 11 0 "[ . 1 . 2]"
1 168 HIS 0.418 0.097 14 0 "[ . 1 . 2]"
1 169 ASP 0.057 0.040 8 0 "[ . 1 . 2]"
1 170 VAL 1.316 0.167 9 0 "[ . 1 . 2]"
1 171 ASP 0.357 0.083 11 0 "[ . 1 . 2]"
1 172 GLY 1.846 0.150 1 0 "[ . 1 . 2]"
1 173 ALA 0.057 0.040 8 0 "[ . 1 . 2]"
1 174 ALA 0.118 0.060 16 0 "[ . 1 . 2]"
1 175 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 176 HIS 1.428 0.150 1 0 "[ . 1 . 2]"
1 179 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 181 VAL 0.178 0.036 6 0 "[ . 1 . 2]"
1 182 VAL 0.227 0.058 5 0 "[ . 1 . 2]"
1 183 VAL 0.091 0.040 2 0 "[ . 1 . 2]"
1 184 GLY 1.042 0.133 10 0 "[ . 1 . 2]"
1 202 THR 0.227 0.058 5 0 "[ . 1 . 2]"
1 204 ALA 1.042 0.133 10 0 "[ . 1 . 2]"
1 208 ASP 0.444 0.108 8 0 "[ . 1 . 2]"
1 209 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 210 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 212 GLU 0.444 0.108 8 0 "[ . 1 . 2]"
1 213 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 214 LEU 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 5 GLN O 1 102 ARG H 1.900 . 2.300 2.276 2.023 2.400 0.100 19 0 "[ . 1 . 2]" 2
2 1 5 GLN O 1 102 ARG N 2.900 2.400 3.300 3.177 2.964 3.305 0.005 6 0 "[ . 1 . 2]" 2
3 1 7 VAL H 1 102 ARG O 1.900 . 2.300 2.002 1.831 2.219 . 0 0 "[ . 1 . 2]" 2
4 1 7 VAL N 1 102 ARG O 2.900 2.400 3.300 2.928 2.748 3.113 . 0 0 "[ . 1 . 2]" 2
5 1 7 VAL O 1 104 ALA H 1.900 . 2.300 1.998 1.758 2.208 . 0 0 "[ . 1 . 2]" 2
6 1 7 VAL O 1 104 ALA N 2.900 2.400 3.300 2.910 2.737 3.112 . 0 0 "[ . 1 . 2]" 2
7 1 9 PHE H 1 104 ALA O 1.900 . 2.300 1.910 1.754 2.079 . 0 0 "[ . 1 . 2]" 2
8 1 9 PHE N 1 104 ALA O 2.900 2.400 3.300 2.851 2.723 2.998 . 0 0 "[ . 1 . 2]" 2
9 1 9 PHE O 1 106 ALA H 1.900 . 2.300 2.090 1.730 2.344 0.044 4 0 "[ . 1 . 2]" 2
10 1 9 PHE O 1 106 ALA N 2.900 2.400 3.300 3.026 2.676 3.237 . 0 0 "[ . 1 . 2]" 2
11 1 6 LEU H 1 159 ARG O 1.900 . 2.300 2.349 2.279 2.410 0.110 11 0 "[ . 1 . 2]" 2
12 1 6 LEU N 1 159 ARG O 2.900 2.400 3.300 3.232 3.064 3.357 0.057 11 0 "[ . 1 . 2]" 2
13 1 6 LEU O 1 161 VAL H 1.900 . 2.300 2.353 2.257 2.429 0.129 19 0 "[ . 1 . 2]" 2
14 1 6 LEU O 1 161 VAL N 2.900 2.400 3.300 3.221 3.074 3.326 0.026 19 0 "[ . 1 . 2]" 2
15 1 8 ILE H 1 161 VAL O 1.900 . 2.300 1.914 1.696 2.187 . 0 0 "[ . 1 . 2]" 2
16 1 8 ILE N 1 161 VAL O 2.900 2.400 3.300 2.871 2.652 3.131 . 0 0 "[ . 1 . 2]" 2
17 1 8 ILE O 1 163 VAL H 1.900 . 2.300 1.807 1.680 1.970 . 0 0 "[ . 1 . 2]" 2
18 1 8 ILE O 1 163 VAL N 2.900 2.400 3.300 2.739 2.628 2.901 . 0 0 "[ . 1 . 2]" 2
19 1 10 ASP H 1 163 VAL O 1.900 . 2.300 2.343 2.137 2.478 0.178 9 0 "[ . 1 . 2]" 2
20 1 10 ASP N 1 163 VAL O 2.900 2.400 3.300 3.183 2.987 3.315 0.015 8 0 "[ . 1 . 2]" 2
21 1 105 VAL H 1 129 VAL O 1.900 . 2.300 2.020 1.790 2.344 0.044 7 0 "[ . 1 . 2]" 2
22 1 105 VAL N 1 129 VAL O 2.900 2.400 3.300 2.968 2.699 3.294 . 0 0 "[ . 1 . 2]" 2
23 1 105 VAL O 1 131 ALA H 1.900 . 2.300 1.831 1.632 2.318 0.018 12 0 "[ . 1 . 2]" 2
24 1 105 VAL O 1 131 ALA N 2.900 2.400 3.300 2.750 2.617 3.016 . 0 0 "[ . 1 . 2]" 2
25 1 107 THR H 1 131 ALA O 1.900 . 2.300 2.193 1.831 2.369 0.069 17 0 "[ . 1 . 2]" 2
26 1 107 THR N 1 131 ALA O 2.900 2.400 3.300 3.103 2.728 3.309 0.009 14 0 "[ . 1 . 2]" 2
27 1 162 MET H 1 179 ASP O 1.900 . 2.300 1.907 1.785 2.134 . 0 0 "[ . 1 . 2]" 2
28 1 162 MET N 1 179 ASP O 2.900 2.400 3.300 2.852 2.729 3.079 . 0 0 "[ . 1 . 2]" 2
29 1 162 MET O 1 181 VAL H 1.900 . 2.300 1.856 1.737 2.025 . 0 0 "[ . 1 . 2]" 2
30 1 162 MET O 1 181 VAL N 2.900 2.400 3.300 2.803 2.708 2.952 . 0 0 "[ . 1 . 2]" 2
31 1 164 GLY H 1 181 VAL O 1.900 . 2.300 2.233 1.875 2.336 0.036 6 0 "[ . 1 . 2]" 2
32 1 164 GLY N 1 181 VAL O 2.900 2.400 3.300 3.161 2.842 3.297 . 0 0 "[ . 1 . 2]" 2
33 1 164 GLY O 1 183 VAL H 1.900 . 2.300 2.026 1.764 2.340 0.040 2 0 "[ . 1 . 2]" 2
34 1 164 GLY O 1 183 VAL N 2.900 2.400 3.300 2.928 2.703 3.285 . 0 0 "[ . 1 . 2]" 2
35 1 182 VAL H 1 202 THR O 1.900 . 2.300 2.133 1.792 2.358 0.058 5 0 "[ . 1 . 2]" 2
36 1 182 VAL N 1 202 THR O 2.900 2.400 3.300 3.031 2.771 3.314 0.014 15 0 "[ . 1 . 2]" 2
37 1 182 VAL O 1 204 ALA H 1.900 . 2.300 1.929 1.660 2.290 . 0 0 "[ . 1 . 2]" 2
38 1 182 VAL O 1 204 ALA N 2.900 2.400 3.300 2.821 2.630 3.128 . 0 0 "[ . 1 . 2]" 2
39 1 184 GLY H 1 204 ALA O 1.900 . 2.300 2.265 1.792 2.433 0.133 10 0 "[ . 1 . 2]" 2
40 1 184 GLY N 1 204 ALA O 2.900 2.400 3.300 3.107 2.746 3.338 0.038 7 0 "[ . 1 . 2]" 2
41 1 18 SER O 1 22 ILE H 1.900 . 2.300 1.969 1.738 2.368 0.068 10 0 "[ . 1 . 2]" 2
42 1 18 SER O 1 22 ILE N 2.900 2.400 3.300 2.880 2.671 3.249 . 0 0 "[ . 1 . 2]" 2
43 1 19 ALA O 1 23 VAL H 1.900 . 2.300 1.875 1.687 2.261 . 0 0 "[ . 1 . 2]" 2
44 1 19 ALA O 1 23 VAL N 2.900 2.400 3.300 2.852 2.670 3.235 . 0 0 "[ . 1 . 2]" 2
45 1 20 ARG O 1 24 SER H 1.900 . 2.300 2.168 1.956 2.335 0.035 1 0 "[ . 1 . 2]" 2
46 1 20 ARG O 1 24 SER N 2.900 2.400 3.300 3.075 2.854 3.247 . 0 0 "[ . 1 . 2]" 2
47 1 21 GLY O 1 25 SER H 1.900 . 2.300 2.142 1.827 2.324 0.024 11 0 "[ . 1 . 2]" 2
48 1 21 GLY O 1 25 SER N 2.900 2.400 3.300 3.110 2.807 3.306 0.006 11 0 "[ . 1 . 2]" 2
49 1 22 ILE O 1 26 PHE H 1.900 . 2.300 1.822 1.719 2.001 . 0 0 "[ . 1 . 2]" 2
50 1 22 ILE O 1 26 PHE N 2.900 2.400 3.300 2.749 2.644 2.924 . 0 0 "[ . 1 . 2]" 2
51 1 23 VAL O 1 27 ARG H 1.900 . 2.300 2.022 1.873 2.255 . 0 0 "[ . 1 . 2]" 2
52 1 23 VAL O 1 27 ARG N 2.900 2.400 3.300 2.967 2.817 3.181 . 0 0 "[ . 1 . 2]" 2
53 1 24 SER O 1 28 HIS H 1.900 . 2.300 2.145 1.881 2.363 0.063 14 0 "[ . 1 . 2]" 2
54 1 24 SER O 1 28 HIS N 2.900 2.400 3.300 3.082 2.854 3.305 0.005 14 0 "[ . 1 . 2]" 2
55 1 25 SER O 1 29 ALA H 1.900 . 2.300 1.815 1.740 1.916 . 0 0 "[ . 1 . 2]" 2
56 1 25 SER O 1 29 ALA N 2.900 2.400 3.300 2.769 2.673 2.884 . 0 0 "[ . 1 . 2]" 2
57 1 26 PHE O 1 30 LEU H 1.900 . 2.300 2.099 1.989 2.195 . 0 0 "[ . 1 . 2]" 2
58 1 26 PHE O 1 30 LEU N 2.900 2.400 3.300 3.073 2.966 3.170 . 0 0 "[ . 1 . 2]" 2
59 1 27 ARG O 1 31 ASN H 1.900 . 2.300 2.085 1.901 2.317 0.017 7 0 "[ . 1 . 2]" 2
60 1 27 ARG O 1 31 ASN N 2.900 2.400 3.300 2.989 2.826 3.204 . 0 0 "[ . 1 . 2]" 2
61 1 28 HIS O 1 32 HIS H 1.900 . 2.300 2.076 1.868 2.301 0.001 7 0 "[ . 1 . 2]" 2
62 1 28 HIS O 1 32 HIS N 2.900 2.400 3.300 2.893 2.739 3.098 . 0 0 "[ . 1 . 2]" 2
63 1 42 LEU O 1 46 ILE H 1.900 . 2.300 2.209 1.872 2.376 0.076 12 0 "[ . 1 . 2]" 2
64 1 42 LEU O 1 46 ILE N 2.900 2.400 3.300 2.956 2.768 3.096 . 0 0 "[ . 1 . 2]" 2
65 1 50 PRO O 1 54 THR H 1.900 . 2.300 1.922 1.737 2.250 . 0 0 "[ . 1 . 2]" 2
66 1 50 PRO O 1 54 THR N 2.900 2.400 3.300 2.886 2.697 3.201 . 0 0 "[ . 1 . 2]" 2
67 1 51 MET O 1 55 LEU H 1.900 . 2.300 2.003 1.776 2.336 0.036 2 0 "[ . 1 . 2]" 2
68 1 51 MET O 1 55 LEU N 2.900 2.400 3.300 2.938 2.717 3.213 . 0 0 "[ . 1 . 2]" 2
69 1 52 HIS O 1 56 ARG H 1.900 . 2.300 2.348 2.160 2.433 0.133 10 0 "[ . 1 . 2]" 2
70 1 52 HIS O 1 56 ARG N 2.900 2.400 3.300 3.167 2.999 3.292 . 0 0 "[ . 1 . 2]" 2
71 1 53 GLU O 1 57 ALA H 1.900 . 2.300 2.129 1.978 2.312 0.012 10 0 "[ . 1 . 2]" 2
72 1 53 GLU O 1 57 ALA N 2.900 2.400 3.300 2.818 2.674 2.957 . 0 0 "[ . 1 . 2]" 2
73 1 54 THR O 1 58 MET H 1.900 . 2.300 2.303 2.006 2.435 0.135 9 0 "[ . 1 . 2]" 2
74 1 54 THR O 1 58 MET N 2.900 2.400 3.300 2.992 2.859 3.187 . 0 0 "[ . 1 . 2]" 2
75 1 63 SER O 1 67 ALA H 1.900 . 2.300 2.011 1.837 2.241 . 0 0 "[ . 1 . 2]" 2
76 1 63 SER O 1 67 ALA N 2.900 2.400 3.300 2.961 2.789 3.207 . 0 0 "[ . 1 . 2]" 2
77 1 64 ALA O 1 68 ILE H 1.900 . 2.300 1.863 1.745 1.948 . 0 0 "[ . 1 . 2]" 2
78 1 64 ALA O 1 68 ILE N 2.900 2.400 3.300 2.810 2.700 2.890 . 0 0 "[ . 1 . 2]" 2
79 1 65 GLU O 1 69 VAL H 1.900 . 2.300 2.164 1.931 2.342 0.042 12 0 "[ . 1 . 2]" 2
80 1 65 GLU O 1 69 VAL N 2.900 2.400 3.300 3.093 2.881 3.264 . 0 0 "[ . 1 . 2]" 2
81 1 66 GLU O 1 70 ALA H 1.900 . 2.300 2.124 1.879 2.280 . 0 0 "[ . 1 . 2]" 2
82 1 66 GLU O 1 70 ALA N 2.900 2.400 3.300 3.036 2.793 3.193 . 0 0 "[ . 1 . 2]" 2
83 1 67 ALA O 1 71 TYR H 1.900 . 2.300 1.893 1.778 1.999 . 0 0 "[ . 1 . 2]" 2
84 1 67 ALA O 1 71 TYR N 2.900 2.400 3.300 2.837 2.715 2.960 . 0 0 "[ . 1 . 2]" 2
85 1 68 ILE O 1 72 ARG H 1.900 . 2.300 1.994 1.840 2.184 . 0 0 "[ . 1 . 2]" 2
86 1 68 ILE O 1 72 ARG N 2.900 2.400 3.300 2.934 2.796 3.105 . 0 0 "[ . 1 . 2]" 2
87 1 69 VAL O 1 73 ALA H 1.900 . 2.300 1.961 1.728 2.254 . 0 0 "[ . 1 . 2]" 2
88 1 69 VAL O 1 73 ALA N 2.900 2.400 3.300 2.895 2.660 3.149 . 0 0 "[ . 1 . 2]" 2
89 1 70 ALA O 1 74 ASP H 1.900 . 2.300 2.003 1.832 2.192 . 0 0 "[ . 1 . 2]" 2
90 1 70 ALA O 1 74 ASP N 2.900 2.400 3.300 2.970 2.794 3.155 . 0 0 "[ . 1 . 2]" 2
91 1 71 TYR O 1 75 TYR H 1.900 . 2.300 1.998 1.743 2.189 . 0 0 "[ . 1 . 2]" 2
92 1 71 TYR O 1 75 TYR N 2.900 2.400 3.300 2.909 2.683 3.128 . 0 0 "[ . 1 . 2]" 2
93 1 72 ARG O 1 76 SER H 1.900 . 2.300 1.934 1.791 2.051 . 0 0 "[ . 1 . 2]" 2
94 1 72 ARG O 1 76 SER N 2.900 2.400 3.300 2.859 2.729 3.016 . 0 0 "[ . 1 . 2]" 2
95 1 73 ALA O 1 77 ALA H 1.900 . 2.300 2.301 2.084 2.410 0.110 1 0 "[ . 1 . 2]" 2
96 1 73 ALA O 1 77 ALA N 2.900 2.400 3.300 2.951 2.871 3.046 . 0 0 "[ . 1 . 2]" 2
97 1 74 ASP O 1 78 ARG H 1.900 . 2.300 1.708 1.652 1.782 . 0 0 "[ . 1 . 2]" 2
98 1 74 ASP O 1 78 ARG N 2.900 2.400 3.300 2.667 2.613 2.755 . 0 0 "[ . 1 . 2]" 2
99 1 88 GLY O 1 92 LEU H 1.900 . 2.300 2.251 2.059 2.378 0.078 3 0 "[ . 1 . 2]" 2
100 1 88 GLY O 1 92 LEU N 2.900 2.400 3.300 3.102 2.916 3.289 . 0 0 "[ . 1 . 2]" 2
101 1 89 ILE O 1 93 LEU H 1.900 . 2.300 2.042 1.791 2.217 . 0 0 "[ . 1 . 2]" 2
102 1 89 ILE O 1 93 LEU N 2.900 2.400 3.300 3.008 2.726 3.180 . 0 0 "[ . 1 . 2]" 2
103 1 90 GLY O 1 94 ALA H 1.900 . 2.300 2.289 1.988 2.404 0.104 4 0 "[ . 1 . 2]" 2
104 1 90 GLY O 1 94 ALA N 2.900 2.400 3.300 3.190 2.922 3.322 0.022 4 0 "[ . 1 . 2]" 2
105 1 91 PRO O 1 95 ASP H 1.900 . 2.300 1.865 1.720 2.030 . 0 0 "[ . 1 . 2]" 2
106 1 91 PRO O 1 95 ASP N 2.900 2.400 3.300 2.835 2.686 3.008 . 0 0 "[ . 1 . 2]" 2
107 1 92 LEU O 1 96 LEU H 1.900 . 2.300 1.980 1.749 2.179 . 0 0 "[ . 1 . 2]" 2
108 1 92 LEU O 1 96 LEU N 2.900 2.400 3.300 2.943 2.731 3.114 . 0 0 "[ . 1 . 2]" 2
109 1 93 LEU O 1 97 ARG H 1.900 . 2.300 2.132 1.940 2.328 0.028 7 0 "[ . 1 . 2]" 2
110 1 93 LEU O 1 97 ARG N 2.900 2.400 3.300 3.052 2.886 3.270 . 0 0 "[ . 1 . 2]" 2
111 1 94 ALA O 1 98 THR H 1.900 . 2.300 2.117 1.925 2.342 0.042 12 0 "[ . 1 . 2]" 2
112 1 94 ALA O 1 98 THR N 2.900 2.400 3.300 3.010 2.832 3.251 . 0 0 "[ . 1 . 2]" 2
113 1 95 ASP O 1 99 ALA H 1.900 . 2.300 2.147 1.993 2.307 0.007 13 0 "[ . 1 . 2]" 2
114 1 95 ASP O 1 99 ALA N 2.900 2.400 3.300 3.022 2.879 3.154 . 0 0 "[ . 1 . 2]" 2
115 1 110 ALA O 1 114 ALA H 1.900 . 2.300 2.040 1.700 2.352 0.052 4 0 "[ . 1 . 2]" 2
116 1 110 ALA O 1 114 ALA N 2.900 2.400 3.300 2.965 2.634 3.279 . 0 0 "[ . 1 . 2]" 2
117 1 111 GLU O 1 115 ARG H 1.900 . 2.300 1.904 1.607 2.264 . 0 0 "[ . 1 . 2]" 2
118 1 111 GLU O 1 115 ARG N 2.900 2.400 3.300 2.868 2.576 3.237 . 0 0 "[ . 1 . 2]" 2
119 1 112 PRO O 1 116 ARG H 1.900 . 2.300 2.264 2.007 2.425 0.125 10 0 "[ . 1 . 2]" 2
120 1 112 PRO O 1 116 ARG N 2.900 2.400 3.300 3.168 2.928 3.337 0.037 10 0 "[ . 1 . 2]" 2
121 1 113 THR O 1 117 ILE H 1.900 . 2.300 2.199 1.859 2.365 0.065 14 0 "[ . 1 . 2]" 2
122 1 113 THR O 1 117 ILE N 2.900 2.400 3.300 3.107 2.816 3.290 . 0 0 "[ . 1 . 2]" 2
123 1 114 ALA O 1 118 LEU H 1.900 . 2.300 1.840 1.724 2.054 . 0 0 "[ . 1 . 2]" 2
124 1 114 ALA O 1 118 LEU N 2.900 2.400 3.300 2.803 2.660 3.008 . 0 0 "[ . 1 . 2]" 2
125 1 115 ARG O 1 119 ARG H 1.900 . 2.300 1.951 1.741 2.256 . 0 0 "[ . 1 . 2]" 2
126 1 115 ARG O 1 119 ARG N 2.900 2.400 3.300 2.851 2.691 3.099 . 0 0 "[ . 1 . 2]" 2
127 1 116 ARG O 1 120 HIS H 1.900 . 2.300 2.117 1.904 2.345 0.045 6 0 "[ . 1 . 2]" 2
128 1 116 ARG O 1 120 HIS N 2.900 2.400 3.300 2.986 2.738 3.229 . 0 0 "[ . 1 . 2]" 2
129 1 117 ILE O 1 121 PHE H 1.900 . 2.300 2.256 1.990 2.430 0.130 9 0 "[ . 1 . 2]" 2
130 1 117 ILE O 1 121 PHE N 2.900 2.400 3.300 3.191 2.963 3.370 0.070 9 0 "[ . 1 . 2]" 2
131 1 143 VAL O 1 147 ALA H 1.900 . 2.300 2.082 1.715 2.392 0.092 19 0 "[ . 1 . 2]" 2
132 1 143 VAL O 1 147 ALA N 2.900 2.400 3.300 3.032 2.681 3.329 0.029 8 0 "[ . 1 . 2]" 2
133 1 144 ASP O 1 148 HIS H 1.900 . 2.300 1.760 1.631 1.977 . 0 0 "[ . 1 . 2]" 2
134 1 144 ASP O 1 148 HIS N 2.900 2.400 3.300 2.703 2.562 2.930 . 0 0 "[ . 1 . 2]" 2
135 1 145 VAL O 1 149 ALA H 1.900 . 2.300 2.177 1.952 2.344 0.044 18 0 "[ . 1 . 2]" 2
136 1 145 VAL O 1 149 ALA N 2.900 2.400 3.300 3.075 2.867 3.259 . 0 0 "[ . 1 . 2]" 2
137 1 146 LEU O 1 150 LEU H 1.900 . 2.300 2.178 2.023 2.324 0.024 8 0 "[ . 1 . 2]" 2
138 1 146 LEU O 1 150 LEU N 2.900 2.400 3.300 3.109 2.941 3.252 . 0 0 "[ . 1 . 2]" 2
139 1 147 ALA O 1 151 ALA H 1.900 . 2.300 2.052 1.786 2.283 . 0 0 "[ . 1 . 2]" 2
140 1 147 ALA O 1 151 ALA N 2.900 2.400 3.300 2.924 2.717 3.150 . 0 0 "[ . 1 . 2]" 2
141 1 148 HIS O 1 152 GLN H 1.900 . 2.300 2.229 2.045 2.334 0.034 19 0 "[ . 1 . 2]" 2
142 1 148 HIS O 1 152 GLN N 2.900 2.400 3.300 3.041 2.879 3.185 . 0 0 "[ . 1 . 2]" 2
143 1 149 ALA O 1 153 LEU H 1.900 . 2.300 2.247 2.019 2.351 0.051 14 0 "[ . 1 . 2]" 2
144 1 149 ALA O 1 153 LEU N 2.900 2.400 3.300 3.129 2.906 3.287 . 0 0 "[ . 1 . 2]" 2
145 1 166 ARG O 1 170 VAL H 1.900 . 2.300 2.309 2.145 2.467 0.167 9 0 "[ . 1 . 2]" 2
146 1 166 ARG O 1 170 VAL N 2.900 2.400 3.300 3.260 3.109 3.417 0.117 9 0 "[ . 1 . 2]" 2
147 1 167 SER O 1 171 ASP H 1.900 . 2.300 2.133 1.745 2.383 0.083 11 0 "[ . 1 . 2]" 2
148 1 167 SER O 1 171 ASP N 2.900 2.400 3.300 3.002 2.696 3.250 . 0 0 "[ . 1 . 2]" 2
149 1 168 HIS O 1 172 GLY H 1.900 . 2.300 2.213 1.907 2.397 0.097 14 0 "[ . 1 . 2]" 2
150 1 168 HIS O 1 172 GLY N 2.900 2.400 3.300 3.108 2.762 3.338 0.038 14 0 "[ . 1 . 2]" 2
151 1 169 ASP O 1 173 ALA H 1.900 . 2.300 2.054 1.768 2.340 0.040 8 0 "[ . 1 . 2]" 2
152 1 169 ASP O 1 173 ALA N 2.900 2.400 3.300 3.007 2.746 3.292 . 0 0 "[ . 1 . 2]" 2
153 1 170 VAL O 1 174 ALA H 1.900 . 2.300 2.080 1.763 2.360 0.060 16 0 "[ . 1 . 2]" 2
154 1 170 VAL O 1 174 ALA N 2.900 2.400 3.300 3.011 2.726 3.272 . 0 0 "[ . 1 . 2]" 2
155 1 171 ASP O 1 175 ALA H 1.900 . 2.300 1.934 1.763 2.276 . 0 0 "[ . 1 . 2]" 2
156 1 171 ASP O 1 175 ALA N 2.900 2.400 3.300 2.813 2.686 3.037 . 0 0 "[ . 1 . 2]" 2
157 1 172 GLY O 1 176 HIS H 1.900 . 2.300 2.371 2.305 2.450 0.150 1 0 "[ . 1 . 2]" 2
158 1 172 GLY O 1 176 HIS N 2.900 2.400 3.300 3.139 3.040 3.293 . 0 0 "[ . 1 . 2]" 2
159 1 208 ASP O 1 212 GLU H 1.900 . 2.300 2.228 1.968 2.408 0.108 8 0 "[ . 1 . 2]" 2
160 1 208 ASP O 1 212 GLU N 2.900 2.400 3.300 3.183 2.943 3.348 0.048 8 0 "[ . 1 . 2]" 2
161 1 209 GLU O 1 213 ALA H 1.900 . 2.300 2.007 1.831 2.287 . 0 0 "[ . 1 . 2]" 2
162 1 209 GLU O 1 213 ALA N 2.900 2.400 3.300 2.895 2.724 3.155 . 0 0 "[ . 1 . 2]" 2
163 1 210 LEU O 1 214 LEU H 1.900 . 2.300 1.950 1.739 2.160 . 0 0 "[ . 1 . 2]" 2
164 1 210 LEU O 1 214 LEU N 2.900 2.400 3.300 2.895 2.700 3.072 . 0 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Monday, May 13, 2024 9:21:16 PM GMT (wattos1)