NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
382285 |
1jcu   |
5051 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1jcu
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 1413
_Distance_constraint_stats_list.Viol_count 2558
_Distance_constraint_stats_list.Viol_total 5177.678
_Distance_constraint_stats_list.Viol_max 1.000
_Distance_constraint_stats_list.Viol_rms 0.0593
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0092
_Distance_constraint_stats_list.Viol_average_violations_only 0.1012
_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 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 LEU 3.084 0.467 2 0 "[ . 1 . 2]"
1 3 ILE 1.788 0.311 3 0 "[ . 1 . 2]"
1 4 ARG 3.151 0.504 2 1 "[ + . 1 . 2]"
1 5 LYS 3.195 0.504 2 1 "[ + . 1 . 2]"
1 6 ILE 0.170 0.034 12 0 "[ . 1 . 2]"
1 7 THR 1.485 0.144 12 0 "[ . 1 . 2]"
1 8 ARG 1.100 0.220 2 0 "[ . 1 . 2]"
1 13 PRO 0.176 0.083 10 0 "[ . 1 . 2]"
1 14 ASP 0.770 0.203 5 0 "[ . 1 . 2]"
1 15 VAL 0.534 0.098 20 0 "[ . 1 . 2]"
1 16 LEU 5.133 0.865 12 1 "[ . 1 + . 2]"
1 17 GLU 2.627 0.459 9 0 "[ . 1 . 2]"
1 18 GLU 6.125 0.847 8 5 "[ *. + * *- 2]"
1 19 ALA 1.382 0.865 12 1 "[ . 1 + . 2]"
1 20 ILE 1.051 0.119 3 0 "[ . 1 . 2]"
1 21 SER 1.687 0.374 9 0 "[ . 1 . 2]"
1 22 VAL 0.112 0.060 1 0 "[ . 1 . 2]"
1 23 MET 1.977 0.374 9 0 "[ . 1 . 2]"
1 24 GLU 1.334 0.295 20 0 "[ . 1 . 2]"
1 25 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ILE 7.327 0.842 20 6 "[* * . - * .* +]"
1 29 VAL 3.054 0.153 8 0 "[ . 1 . 2]"
1 30 ILE 2.726 0.157 19 0 "[ . 1 . 2]"
1 31 TYR 3.699 0.157 19 0 "[ . 1 . 2]"
1 32 PRO 0.028 0.028 15 0 "[ . 1 . 2]"
1 33 THR 1.967 0.177 14 0 "[ . 1 . 2]"
1 34 ASP 0.576 0.103 9 0 "[ . 1 . 2]"
1 35 THR 0.041 0.039 17 0 "[ . 1 . 2]"
1 36 ILE 0.233 0.045 9 0 "[ . 1 . 2]"
1 37 TYR 0.593 0.064 15 0 "[ . 1 . 2]"
1 38 GLY 5.067 0.702 18 3 "[ . - . +*2]"
1 39 LEU 2.885 0.965 17 2 "[ . 1 . + *2]"
1 40 GLY 2.147 0.150 8 0 "[ . 1 . 2]"
1 41 VAL 0.649 0.138 15 0 "[ . 1 . 2]"
1 42 ASN 2.299 0.153 8 0 "[ . 1 . 2]"
1 43 ALA 0.966 0.545 11 1 "[ . 1+ . 2]"
1 44 LEU 5.285 0.452 3 0 "[ . 1 . 2]"
1 45 ASP 4.699 0.452 3 0 "[ . 1 . 2]"
1 46 GLU 0.381 0.038 14 0 "[ . 1 . 2]"
1 47 ASP 0.125 0.039 16 0 "[ . 1 . 2]"
1 48 ALA 0.439 0.107 20 0 "[ . 1 . 2]"
1 49 VAL 0.841 0.197 16 0 "[ . 1 . 2]"
1 50 ARG 0.159 0.038 14 0 "[ . 1 . 2]"
1 51 ARG 2.165 0.772 5 2 "[ + 1 .- 2]"
1 52 LEU 2.092 0.772 5 2 "[ + 1 .- 2]"
1 53 PHE 0.156 0.156 17 0 "[ . 1 . 2]"
1 54 ARG 6.992 0.729 11 3 "[ . -1+ . *]"
1 55 VAL 5.870 0.965 17 4 "[ . *1* . + *]"
1 56 LYS 2.123 0.661 11 2 "[ . -1+ . 2]"
1 57 GLY 0.150 0.027 16 0 "[ . 1 . 2]"
1 63 PRO 3.960 0.630 19 3 "[ * . - 1 . +2]"
1 64 VAL 4.245 0.630 19 3 "[ * . - 1 . +2]"
1 65 SER 1.099 0.302 15 0 "[ . 1 . 2]"
1 66 ILE 2.653 0.302 15 0 "[ . 1 . 2]"
1 67 CYS 8.367 0.926 19 9 "[-***** * 1 *. +2]"
1 68 VAL 1.564 0.080 18 0 "[ . 1 . 2]"
1 69 SER 1.422 0.059 6 0 "[ . 1 . 2]"
1 70 CYS 4.860 0.369 10 0 "[ . 1 . 2]"
1 71 VAL 2.112 0.209 12 0 "[ . 1 . 2]"
1 72 ASP 3.760 0.560 5 2 "[ + -1 . 2]"
1 73 GLU 3.735 0.221 13 0 "[ . 1 . 2]"
1 74 ILE 0.468 0.053 15 0 "[ . 1 . 2]"
1 77 PHE 0.285 0.054 20 0 "[ . 1 . 2]"
1 78 SER 0.226 0.041 10 0 "[ . 1 . 2]"
1 79 ARG 4.202 0.632 16 4 "[ * . * .+ -]"
1 80 PRO 0.010 0.010 10 0 "[ . 1 . 2]"
1 81 SER 0.010 0.010 10 0 "[ . 1 . 2]"
1 82 GLY 6.085 0.346 1 0 "[ . 1 . 2]"
1 83 ASP 11.985 0.968 4 10 "[ *-+* * 1* *** * 2]"
1 84 ALA 1.653 0.205 11 0 "[ . 1 . 2]"
1 85 MET 19.350 0.717 5 10 "[ ** + * 1*-*** * 2]"
1 86 GLU 1.293 0.510 18 1 "[ . 1 . + 2]"
1 87 LEU 4.563 0.968 4 5 "[ -+* 1 * * 2]"
1 88 MET 0.761 0.192 7 0 "[ . 1 . 2]"
1 89 GLU 2.610 0.414 8 0 "[ . 1 . 2]"
1 90 ARG 4.896 0.571 16 3 "[ *. 1 .+ -]"
1 91 ILE 0.672 0.277 20 0 "[ . 1 . 2]"
1 92 LEU 5.864 0.549 11 3 "[- . *1+ . 2]"
1 94 GLY 0.343 0.037 20 0 "[ . 1 . 2]"
1 95 PRO 0.212 0.060 19 0 "[ . 1 . 2]"
1 96 TYR 0.310 0.073 7 0 "[ . 1 . 2]"
1 97 THR 0.111 0.073 7 0 "[ . 1 . 2]"
1 98 VAL 8.564 0.843 3 9 "[ +** * 1** * *-2]"
1 99 VAL 2.407 0.773 8 1 "[ . + 1 . 2]"
1 100 LEU 2.659 0.678 10 1 "[ . + . 2]"
1 101 GLU 1.308 0.678 10 2 "[ - . + . 2]"
1 102 ARG 4.187 1.000 11 4 "[ . -+* . *]"
1 103 ASN 4.098 1.000 11 4 "[ . -+* . *]"
1 104 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 LEU 0.448 0.056 19 0 "[ . 1 . 2]"
1 106 ILE 0.368 0.129 10 0 "[ . 1 . 2]"
1 108 ASP 1.145 0.216 17 0 "[ . 1 . 2]"
1 109 VAL 0.725 0.147 5 0 "[ . 1 . 2]"
1 110 ILE 4.922 0.967 9 3 "[ . +* - . 2]"
1 111 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 GLY 2.807 0.967 9 3 "[ . +- * . 2]"
1 114 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 ARG 0.184 0.022 15 0 "[ . 1 . 2]"
1 117 VAL 0.426 0.054 3 0 "[ . 1 . 2]"
1 118 GLY 0.712 0.056 11 0 "[ . 1 . 2]"
1 119 ILE 1.112 0.092 11 0 "[ . 1 . 2]"
1 120 ARG 0.120 0.017 7 0 "[ . 1 . 2]"
1 121 VAL 0.145 0.028 1 0 "[ . 1 . 2]"
1 122 PRO 2.847 0.748 15 3 "[ - 1 + *]"
1 123 ASP 2.391 0.215 18 0 "[ . 1 . 2]"
1 124 ASP 2.909 0.748 15 3 "[ - 1 + *]"
1 125 GLU 0.074 0.074 13 0 "[ . 1 . 2]"
1 126 ILE 7.241 0.985 8 8 "[ * * *+** * . - 2]"
1 127 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 ARG 6.698 0.985 8 8 "[ * * *+** * . - 2]"
1 129 ARG 3.529 0.425 10 0 "[ . 1 . 2]"
1 130 ILE 0.262 0.028 17 0 "[ . 1 . 2]"
1 131 ALA 0.708 0.044 16 0 "[ . 1 . 2]"
1 132 ALA 0.414 0.242 20 0 "[ . 1 . 2]"
1 133 ARG 1.608 0.419 7 0 "[ . 1 . 2]"
1 134 PHE 1.199 0.419 7 0 "[ . 1 . 2]"
1 135 PRO 9.120 0.926 19 9 "[-***** * 1 *. +2]"
1 136 VAL 2.478 0.545 11 1 "[ . 1+ . 2]"
1 137 THR 0.860 0.073 20 0 "[ . 1 . 2]"
1 138 ALA 0.432 0.057 19 0 "[ . 1 . 2]"
1 139 THR 2.059 0.766 19 1 "[ . 1 . +2]"
1 141 ALA 5.788 0.702 18 3 "[ . - . +*2]"
1 142 ASN 1.299 0.205 17 0 "[ . 1 . 2]"
1 143 ILE 1.854 0.317 13 0 "[ . 1 . 2]"
1 144 SER 0.045 0.020 6 0 "[ . 1 . 2]"
1 147 PRO 0.436 0.034 20 0 "[ . 1 . 2]"
1 149 SER 0.058 0.020 11 0 "[ . 1 . 2]"
1 150 PRO 3.456 0.239 15 0 "[ . 1 . 2]"
1 151 ARG 8.687 0.386 5 0 "[ . 1 . 2]"
1 152 LEU 3.175 0.836 6 1 "[ .+ 1 . 2]"
1 153 GLU 4.722 0.641 11 1 "[ . 1+ . 2]"
1 154 GLU 4.514 0.641 11 1 "[ . 1+ . 2]"
1 155 ILE 2.654 0.836 6 1 "[ .+ 1 . 2]"
1 156 VAL 5.933 0.652 14 7 "[ ** * 1- *+. *2]"
1 157 ARG 15.727 0.793 7 11 "[ * * + *** **-* * 2]"
1 158 ASP 6.174 0.587 6 5 "[ * .+* 1 . - *2]"
1 159 LEU 7.407 0.932 13 6 "[ .** 1* +-. * 2]"
1 160 ASP 0.730 0.150 7 0 "[ . 1 . 2]"
1 161 ALA 3.524 0.932 13 4 "[ .*- 1* + . 2]"
1 162 VAL 0.604 0.124 9 0 "[ . 1 . 2]"
1 163 ASP 6.644 0.842 20 6 "[* * . - * .* +]"
1 164 LEU 0.810 0.052 11 0 "[ . 1 . 2]"
1 165 VAL 1.143 0.106 13 0 "[ . 1 . 2]"
1 166 LEU 4.519 0.662 20 4 "[ . *1- * . +]"
1 167 ASP 5.014 0.662 20 6 "[ . *1- **. * +]"
1 168 ALA 1.238 0.102 19 0 "[ . 1 . 2]"
1 169 GLY 3.027 0.535 18 3 "[ . 1 *. + -]"
1 170 ASP 1.498 0.177 14 0 "[ . 1 . 2]"
1 171 CYS 0.777 0.176 13 0 "[ . 1 . 2]"
1 172 LEU 0.654 0.176 13 0 "[ . 1 . 2]"
1 173 ASP 0.050 0.017 10 0 "[ . 1 . 2]"
1 174 MET 0.233 0.045 9 0 "[ . 1 . 2]"
1 178 THR 0.498 0.060 19 0 "[ . 1 . 2]"
1 179 VAL 2.302 0.156 4 0 "[ . 1 . 2]"
1 180 ILE 0.347 0.034 1 0 "[ . 1 . 2]"
1 181 ASP 2.771 0.872 19 1 "[ . 1 . +2]"
1 182 LEU 1.755 0.773 8 1 "[ . + 1 . 2]"
1 183 THR 1.848 0.125 20 0 "[ . 1 . 2]"
1 184 VAL 1.406 0.125 20 0 "[ . 1 . 2]"
1 185 ASN 1.941 0.138 7 0 "[ . 1 . 2]"
1 187 PRO 0.120 0.023 19 0 "[ . 1 . 2]"
1 188 ARG 1.834 0.096 13 0 "[ . 1 . 2]"
1 189 VAL 3.534 0.880 1 1 "[+ . 1 . 2]"
1 190 LEU 2.318 0.880 1 2 "[+ . 1 . -2]"
1 191 ARG 0.059 0.026 1 0 "[ . 1 . 2]"
1 192 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 193 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 194 LYS 0.953 0.274 16 0 "[ . 1 . 2]"
1 195 GLY 0.038 0.038 8 0 "[ . 1 . 2]"
1 200 VAL 0.068 0.068 3 0 "[ . 1 . 2]"
1 201 LEU 4.398 0.648 19 3 "[ . 1 * - +2]"
1 202 LEU 1.694 0.180 3 0 "[ . 1 . 2]"
1 203 ARG 0.957 0.278 16 0 "[ . 1 . 2]"
1 204 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 205 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 206 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 207 ASP 0.512 0.259 5 0 "[ . 1 . 2]"
1 208 VAL 0.558 0.259 5 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 2 LEU H 2.300 . 3.000 2.406 2.174 2.678 . 0 0 "[ . 1 . 2]" 1
2 1 1 MET HB2 1 2 LEU H 3.000 . 4.100 3.172 1.917 4.050 . 0 0 "[ . 1 . 2]" 1
3 1 1 MET HB3 1 2 LEU H 3.000 . 4.100 3.117 1.958 4.069 . 0 0 "[ . 1 . 2]" 1
4 1 2 LEU H 1 2 LEU HA 2.700 . 3.600 2.903 2.846 2.944 . 0 0 "[ . 1 . 2]" 1
5 1 2 LEU H 1 2 LEU HB2 2.800 . 3.800 2.794 2.184 3.596 . 0 0 "[ . 1 . 2]" 1
6 1 2 LEU H 1 2 LEU HB3 2.600 . 5.500 3.425 2.293 3.742 . 0 0 "[ . 1 . 2]" 1
7 1 2 LEU H 1 2 LEU MD2 2.800 . 3.800 3.084 1.772 4.267 0.467 2 0 "[ . 1 . 2]" 1
8 1 2 LEU H 1 2 LEU HG 2.900 . 4.000 2.813 1.810 4.113 0.113 11 0 "[ . 1 . 2]" 1
9 1 2 LEU H 1 3 ILE H 3.500 . 5.000 4.038 2.511 4.566 . 0 0 "[ . 1 . 2]" 1
10 1 2 LEU HB2 1 3 ILE H 2.600 . 3.400 2.674 1.812 3.527 0.127 11 0 "[ . 1 . 2]" 1
11 1 2 LEU HB3 1 3 ILE H 2.400 . 3.100 2.570 1.796 3.411 0.311 3 0 "[ . 1 . 2]" 1
12 1 3 ILE H 1 3 ILE HA 2.900 . 4.000 2.901 2.841 2.940 . 0 0 "[ . 1 . 2]" 1
13 1 3 ILE H 1 3 ILE MD 3.000 . 4.100 3.428 2.440 4.119 0.019 3 0 "[ . 1 . 2]" 1
14 1 3 ILE H 1 4 ARG H 3.900 . 5.500 4.111 2.059 4.626 . 0 0 "[ . 1 . 2]" 1
15 1 3 ILE HA 1 4 ARG H 2.500 . 3.300 2.431 2.139 3.420 0.120 10 0 "[ . 1 . 2]" 1
16 1 3 ILE MG 1 4 ARG H 3.000 . 4.100 2.945 2.035 4.127 0.027 5 0 "[ . 1 . 2]" 1
17 1 3 ILE MG 1 5 LYS H 3.800 . 5.500 4.991 3.706 5.502 0.002 13 0 "[ . 1 . 2]" 1
18 1 4 ARG H 1 4 ARG HB2 3.500 . 5.000 2.906 2.100 3.696 . 0 0 "[ . 1 . 2]" 1
19 1 4 ARG H 1 4 ARG HB3 2.900 . 4.000 3.199 2.398 3.699 . 0 0 "[ . 1 . 2]" 1
20 1 4 ARG H 1 4 ARG HG3 3.100 . 4.300 3.261 1.876 4.596 0.296 20 0 "[ . 1 . 2]" 1
21 1 4 ARG HA 1 5 LYS H 2.200 . 2.800 2.361 2.149 2.837 0.037 16 0 "[ . 1 . 2]" 1
22 1 4 ARG HB2 1 5 LYS H 3.000 . 4.100 3.472 1.961 4.604 0.504 2 1 "[ + . 1 . 2]" 1
23 1 5 LYS H 1 5 LYS HA 2.700 . 3.600 2.886 2.846 2.939 . 0 0 "[ . 1 . 2]" 1
24 1 5 LYS H 1 5 LYS HB3 2.200 . 2.800 2.734 2.596 2.839 0.039 2 0 "[ . 1 . 2]" 1
25 1 5 LYS H 1 5 LYS HE2 3.400 . 4.800 3.886 2.457 5.004 0.204 12 0 "[ . 1 . 2]" 1
26 1 5 LYS H 1 5 LYS HE3 3.500 . 5.000 3.915 2.435 5.000 . 0 0 "[ . 1 . 2]" 1
27 1 5 LYS H 1 5 LYS HG2 2.800 . 3.800 2.084 1.815 3.135 . 0 0 "[ . 1 . 2]" 1
28 1 5 LYS H 1 5 LYS HG3 2.900 . 4.000 3.391 1.786 3.794 0.014 12 0 "[ . 1 . 2]" 1
29 1 5 LYS HA 1 6 ILE H 2.200 . 2.800 2.536 2.311 2.771 . 0 0 "[ . 1 . 2]" 1
30 1 5 LYS HB2 1 6 ILE H 2.600 . 3.400 2.206 1.783 2.676 0.017 12 0 "[ . 1 . 2]" 1
31 1 5 LYS HG2 1 6 ILE H 3.400 . 4.800 4.165 3.461 4.678 . 0 0 "[ . 1 . 2]" 1
32 1 5 LYS HG3 1 6 ILE H 3.300 . 4.700 3.551 2.926 4.342 . 0 0 "[ . 1 . 2]" 1
33 1 5 LYS HG3 1 7 THR H 4.200 . 5.500 4.839 2.395 5.644 0.144 12 0 "[ . 1 . 2]" 1
34 1 6 ILE H 1 6 ILE HA 2.900 . 4.000 2.912 2.860 2.945 . 0 0 "[ . 1 . 2]" 1
35 1 6 ILE H 1 6 ILE HB 2.700 . 3.600 3.059 2.662 3.625 0.025 14 0 "[ . 1 . 2]" 1
36 1 6 ILE H 1 6 ILE MD 3.400 . 4.800 4.167 2.289 4.599 . 0 0 "[ . 1 . 2]" 1
37 1 6 ILE H 1 6 ILE HG12 3.500 . 5.000 3.808 1.966 4.672 0.034 12 0 "[ . 1 . 2]" 1
38 1 6 ILE H 1 6 ILE HG13 3.400 . 4.800 3.933 2.195 4.525 . 0 0 "[ . 1 . 2]" 1
39 1 6 ILE H 1 6 ILE MG 2.700 . 3.600 2.220 1.868 3.545 . 0 0 "[ . 1 . 2]" 1
40 1 6 ILE H 1 7 THR H 3.900 . 5.500 3.988 2.334 4.595 . 0 0 "[ . 1 . 2]" 1
41 1 6 ILE MD 1 7 THR H 2.900 . 4.000 3.674 2.782 4.008 0.008 11 0 "[ . 1 . 2]" 1
42 1 6 ILE HG12 1 7 THR H 2.700 . 3.600 3.237 2.042 3.632 0.032 2 0 "[ . 1 . 2]" 1
43 1 6 ILE HG13 1 7 THR H 2.700 . 3.600 2.179 1.887 3.252 . 0 0 "[ . 1 . 2]" 1
44 1 6 ILE MG 1 7 THR H 3.100 . 4.300 3.847 3.406 4.173 . 0 0 "[ . 1 . 2]" 1
45 1 7 THR H 1 7 THR HA 2.200 . 2.800 2.848 2.832 2.921 0.121 12 0 "[ . 1 . 2]" 1
46 1 7 THR H 1 7 THR HB 3.600 . 5.200 3.288 2.470 3.603 . 0 0 "[ . 1 . 2]" 1
47 1 7 THR H 1 7 THR MG 2.400 . 3.100 2.531 1.987 3.088 . 0 0 "[ . 1 . 2]" 1
48 1 7 THR H 1 8 ARG H 3.200 . 4.500 4.174 2.711 4.559 0.059 14 0 "[ . 1 . 2]" 1
49 1 7 THR HA 1 8 ARG H 2.700 . 3.600 2.641 2.139 3.568 . 0 0 "[ . 1 . 2]" 1
50 1 7 THR HB 1 8 ARG H 2.700 . 3.600 3.023 1.902 3.616 0.016 2 0 "[ . 1 . 2]" 1
51 1 8 ARG H 1 8 ARG HA 2.700 . 3.600 2.899 2.842 2.945 . 0 0 "[ . 1 . 2]" 1
52 1 8 ARG H 1 8 ARG HB2 2.600 . 3.400 2.454 2.082 3.430 0.030 6 0 "[ . 1 . 2]" 1
53 1 8 ARG H 1 8 ARG HB3 2.500 . 3.300 3.238 2.354 3.520 0.220 2 0 "[ . 1 . 2]" 1
54 1 8 ARG H 1 8 ARG QG 2.800 . 3.800 3.261 1.751 3.838 0.049 20 0 "[ . 1 . 2]" 1
55 1 13 PRO HA 1 14 ASP H 2.600 . 3.400 2.323 2.149 2.526 . 0 0 "[ . 1 . 2]" 1
56 1 13 PRO HA 1 15 VAL H 3.200 . 4.500 4.175 3.773 4.477 . 0 0 "[ . 1 . 2]" 1
57 1 13 PRO HA 1 16 LEU H 4.100 . 5.500 4.675 4.385 5.269 . 0 0 "[ . 1 . 2]" 1
58 1 13 PRO HA 1 17 GLU H 2.900 . 5.500 5.376 5.008 5.543 0.043 2 0 "[ . 1 . 2]" 1
59 1 13 PRO HB2 1 14 ASP H 2.700 . 3.600 3.206 2.359 3.683 0.083 10 0 "[ . 1 . 2]" 1
60 1 13 PRO HB3 1 14 ASP H 2.900 . 4.000 3.201 2.647 4.002 0.002 18 0 "[ . 1 . 2]" 1
61 1 14 ASP H 1 14 ASP HA 2.900 . 4.000 2.837 2.791 2.864 . 0 0 "[ . 1 . 2]" 1
62 1 14 ASP H 1 14 ASP HB2 2.600 . 3.400 2.455 2.072 3.603 0.203 5 0 "[ . 1 . 2]" 1
63 1 14 ASP H 1 14 ASP HB3 2.800 . 3.800 3.086 2.404 3.594 . 0 0 "[ . 1 . 2]" 1
64 1 14 ASP H 1 15 VAL H 2.700 . 3.600 2.572 2.457 2.792 . 0 0 "[ . 1 . 2]" 1
65 1 14 ASP H 1 16 LEU H 3.500 . 5.000 4.199 3.778 4.845 . 0 0 "[ . 1 . 2]" 1
66 1 14 ASP HA 1 15 VAL H 3.100 . 4.300 3.508 3.463 3.568 . 0 0 "[ . 1 . 2]" 1
67 1 14 ASP HA 1 16 LEU H 3.000 . 5.500 4.392 4.036 4.985 . 0 0 "[ . 1 . 2]" 1
68 1 14 ASP HA 1 17 GLU H 3.300 . 4.700 3.592 3.172 4.024 . 0 0 "[ . 1 . 2]" 1
69 1 14 ASP HB2 1 15 VAL H 2.900 . 4.000 3.375 2.428 4.098 0.098 20 0 "[ . 1 . 2]" 1
70 1 14 ASP HB3 1 15 VAL H 3.200 . 4.500 3.250 2.574 4.014 . 0 0 "[ . 1 . 2]" 1
71 1 15 VAL H 1 15 VAL HA 2.500 . 3.300 2.830 2.785 2.866 . 0 0 "[ . 1 . 2]" 1
72 1 15 VAL H 1 15 VAL HB 2.400 . 3.100 2.627 2.518 2.736 . 0 0 "[ . 1 . 2]" 1
73 1 15 VAL H 1 15 VAL MG1 2.800 . 3.800 3.768 3.756 3.779 . 0 0 "[ . 1 . 2]" 1
74 1 15 VAL H 1 15 VAL MG2 2.400 . 3.100 2.060 1.796 2.375 . 0 0 "[ . 1 . 2]" 1
75 1 15 VAL H 1 17 GLU H 3.600 . 5.200 4.202 3.826 4.820 . 0 0 "[ . 1 . 2]" 1
76 1 15 VAL H 1 18 GLU H 3.500 . 5.000 4.801 4.624 4.944 . 0 0 "[ . 1 . 2]" 1
77 1 15 VAL HA 1 16 LEU H 2.600 . 5.500 3.523 3.449 3.576 . 0 0 "[ . 1 . 2]" 1
78 1 15 VAL HA 1 17 GLU H 3.000 . 5.500 4.542 4.202 5.022 . 0 0 "[ . 1 . 2]" 1
79 1 15 VAL HA 1 18 GLU H 2.700 . 3.600 3.536 3.392 3.651 0.051 4 0 "[ . 1 . 2]" 1
80 1 15 VAL HB 1 16 LEU H 2.400 . 3.100 2.644 2.180 3.065 . 0 0 "[ . 1 . 2]" 1
81 1 15 VAL MG1 1 16 LEU H 3.200 . 4.500 3.630 3.006 4.038 . 0 0 "[ . 1 . 2]" 1
82 1 15 VAL MG1 1 17 GLU H 3.300 . 5.500 5.190 4.716 5.512 0.012 7 0 "[ . 1 . 2]" 1
83 1 15 VAL MG1 1 18 GLU H 3.200 . 4.500 4.479 4.401 4.525 0.025 11 0 "[ . 1 . 2]" 1
84 1 15 VAL MG1 1 19 ALA H 3.000 . 5.500 4.264 3.754 4.629 . 0 0 "[ . 1 . 2]" 1
85 1 15 VAL MG1 1 168 ALA MB 3.200 . 4.000 2.983 2.475 3.550 . 0 0 "[ . 1 . 2]" 1
86 1 15 VAL MG2 1 16 LEU H 3.100 . 4.300 3.740 3.532 3.872 . 0 0 "[ . 1 . 2]" 1
87 1 15 VAL MG2 1 18 GLU H 3.800 . 5.500 5.277 5.137 5.369 . 0 0 "[ . 1 . 2]" 1
88 1 15 VAL MG2 1 168 ALA MB 3.200 . 4.000 3.900 3.479 4.030 0.030 10 0 "[ . 1 . 2]" 1
89 1 16 LEU H 1 16 LEU HB2 2.800 . 3.800 2.191 2.053 2.739 . 0 0 "[ . 1 . 2]" 1
90 1 16 LEU H 1 16 LEU HB3 2.500 . 3.300 3.418 3.294 3.583 0.283 6 0 "[ . 1 . 2]" 1
91 1 16 LEU H 1 16 LEU MD2 2.600 . 3.400 2.488 1.431 3.464 0.369 10 0 "[ . 1 . 2]" 1
92 1 16 LEU H 1 17 GLU H 2.700 . 3.600 2.653 2.488 2.942 . 0 0 "[ . 1 . 2]" 1
93 1 16 LEU H 1 18 GLU H 3.500 . 5.000 3.882 3.661 4.120 . 0 0 "[ . 1 . 2]" 1
94 1 16 LEU HB2 1 17 GLU H 2.900 . 4.000 2.847 2.462 3.150 . 0 0 "[ . 1 . 2]" 1
95 1 16 LEU HB2 1 18 GLU H 4.300 . 5.500 4.917 4.717 5.165 . 0 0 "[ . 1 . 2]" 1
96 1 16 LEU HB3 1 17 GLU H 3.100 . 4.300 3.144 2.376 3.992 . 0 0 "[ . 1 . 2]" 1
97 1 16 LEU HB3 1 18 GLU H 3.600 . 5.200 4.982 4.545 5.503 0.303 6 0 "[ . 1 . 2]" 1
98 1 16 LEU HB3 1 20 ILE H 2.300 . 5.500 5.158 4.436 5.520 0.020 7 0 "[ . 1 . 2]" 1
99 1 16 LEU MD1 1 19 ALA H 3.800 . 5.500 4.681 4.286 6.365 0.865 12 1 "[ . 1 + . 2]" 1
100 1 16 LEU MD1 1 126 ILE MD 3.200 . 4.000 3.815 2.430 4.037 0.037 18 0 "[ . 1 . 2]" 1
101 1 16 LEU MD1 1 130 ILE MD 3.200 . 4.000 2.280 1.843 3.851 . 0 0 "[ . 1 . 2]" 1
102 1 16 LEU MD2 1 126 ILE H 3.700 . 5.400 5.318 4.959 5.623 0.223 6 0 "[ . 1 . 2]" 1
103 1 16 LEU MD2 1 126 ILE MD 3.200 . 4.000 2.551 2.003 3.853 . 0 0 "[ . 1 . 2]" 1
104 1 16 LEU MD2 1 130 ILE MD 3.200 . 4.000 3.736 3.159 4.028 0.028 17 0 "[ . 1 . 2]" 1
105 1 17 GLU H 1 17 GLU HA 2.700 . 3.600 2.825 2.775 2.858 . 0 0 "[ . 1 . 2]" 1
106 1 17 GLU H 1 17 GLU HB2 2.500 . 5.500 2.897 2.072 3.604 . 0 0 "[ . 1 . 2]" 1
107 1 17 GLU H 1 17 GLU HB3 2.500 . 3.300 3.014 2.204 3.589 0.289 2 0 "[ . 1 . 2]" 1
108 1 17 GLU H 1 17 GLU HG3 2.600 . 3.400 2.998 2.398 3.859 0.459 9 0 "[ . 1 . 2]" 1
109 1 17 GLU H 1 18 GLU H 2.600 . 3.400 2.582 2.480 2.716 . 0 0 "[ . 1 . 2]" 1
110 1 18 GLU H 1 18 GLU HA 2.500 . 3.300 2.867 2.834 2.889 . 0 0 "[ . 1 . 2]" 1
111 1 18 GLU H 1 18 GLU HB3 2.100 . 2.700 2.523 2.152 3.547 0.847 8 5 "[ *. + * *- 2]" 1
112 1 18 GLU H 1 18 GLU QG 2.300 . 3.000 2.945 2.732 3.025 0.025 2 0 "[ . 1 . 2]" 1
113 1 18 GLU H 1 19 ALA H 2.600 . 3.400 2.450 2.300 2.664 . 0 0 "[ . 1 . 2]" 1
114 1 18 GLU H 1 20 ILE H 2.900 . 4.000 4.032 3.968 4.119 0.119 3 0 "[ . 1 . 2]" 1
115 1 18 GLU HA 1 19 ALA H 2.800 . 3.800 3.509 3.477 3.555 . 0 0 "[ . 1 . 2]" 1
116 1 18 GLU QB 1 19 ALA H 2.500 . 3.300 3.157 2.526 3.344 0.044 3 0 "[ . 1 . 2]" 1
117 1 18 GLU QG 1 19 ALA H 2.500 . 5.500 2.747 1.999 4.346 . 0 0 "[ . 1 . 2]" 1
118 1 19 ALA H 1 19 ALA HA 2.400 . 3.100 2.842 2.818 2.865 . 0 0 "[ . 1 . 2]" 1
119 1 19 ALA H 1 19 ALA MB 2.100 . 2.700 2.135 2.026 2.255 . 0 0 "[ . 1 . 2]" 1
120 1 19 ALA H 1 20 ILE H 2.700 . 3.600 2.590 2.510 2.663 . 0 0 "[ . 1 . 2]" 1
121 1 19 ALA H 1 21 SER H 3.500 . 5.000 3.896 3.733 4.170 . 0 0 "[ . 1 . 2]" 1
122 1 19 ALA HA 1 21 SER H 3.100 . 4.300 4.116 3.932 4.313 0.013 2 0 "[ . 1 . 2]" 1
123 1 19 ALA MB 1 23 MET H 3.900 . 5.500 4.972 4.513 5.111 . 0 0 "[ . 1 . 2]" 1
124 1 19 ALA MB 1 29 VAL MG1 3.200 . 4.000 3.196 2.141 3.906 . 0 0 "[ . 1 . 2]" 1
125 1 19 ALA MB 1 29 VAL MG2 3.200 . 4.000 3.813 2.979 4.049 0.049 2 0 "[ . 1 . 2]" 1
126 1 20 ILE H 1 20 ILE HA 2.800 . 3.800 2.850 2.792 2.881 . 0 0 "[ . 1 . 2]" 1
127 1 20 ILE H 1 20 ILE HB 2.900 . 4.000 2.876 2.110 3.606 . 0 0 "[ . 1 . 2]" 1
128 1 20 ILE H 1 20 ILE MD 2.400 . 3.100 2.766 1.978 3.152 0.052 5 0 "[ . 1 . 2]" 1
129 1 20 ILE H 1 20 ILE MG 2.800 . 3.800 3.096 1.816 3.781 . 0 0 "[ . 1 . 2]" 1
130 1 20 ILE H 1 130 ILE MD 4.200 . 5.500 5.086 4.307 5.519 0.019 17 0 "[ . 1 . 2]" 1
131 1 20 ILE HA 1 21 SER H 4.000 . 5.500 3.460 3.394 3.530 . 0 0 "[ . 1 . 2]" 1
132 1 20 ILE HA 1 23 MET H 3.300 . 4.700 3.400 3.248 3.651 . 0 0 "[ . 1 . 2]" 1
133 1 20 ILE HA 1 24 GLU H 3.600 . 5.200 4.522 4.149 4.826 . 0 0 "[ . 1 . 2]" 1
134 1 20 ILE HB 1 21 SER H 3.500 . 5.000 3.483 2.795 4.411 . 0 0 "[ . 1 . 2]" 1
135 1 20 ILE MD 1 23 MET H 2.900 . 5.500 5.214 4.957 5.502 0.002 6 0 "[ . 1 . 2]" 1
136 1 21 SER H 1 21 SER HA 2.600 . 3.400 2.832 2.790 2.863 . 0 0 "[ . 1 . 2]" 1
137 1 21 SER H 1 21 SER HB2 2.800 . 3.800 2.567 2.078 3.590 . 0 0 "[ . 1 . 2]" 1
138 1 21 SER H 1 21 SER HB3 3.000 . 4.100 2.781 2.174 3.579 . 0 0 "[ . 1 . 2]" 1
139 1 21 SER H 1 23 MET H 2.700 . 5.500 3.882 3.722 4.129 . 0 0 "[ . 1 . 2]" 1
140 1 21 SER H 1 24 GLU H 3.600 . 5.200 5.027 4.739 5.211 0.011 19 0 "[ . 1 . 2]" 1
141 1 21 SER HA 1 23 MET H 3.100 . 4.300 4.219 4.037 4.318 0.018 12 0 "[ . 1 . 2]" 1
142 1 21 SER HB2 1 23 MET H 4.100 . 5.500 5.421 4.762 5.874 0.374 9 0 "[ . 1 . 2]" 1
143 1 21 SER HB3 1 22 VAL H 3.600 . 5.200 2.820 2.168 3.764 . 0 0 "[ . 1 . 2]" 1
144 1 22 VAL H 1 22 VAL HB 2.300 . 3.000 2.600 2.379 2.792 . 0 0 "[ . 1 . 2]" 1
145 1 22 VAL H 1 22 VAL MG1 3.000 . 4.100 2.582 1.840 3.772 0.060 1 0 "[ . 1 . 2]" 1
146 1 22 VAL HA 1 23 MET H 3.600 . 5.200 3.487 3.441 3.510 . 0 0 "[ . 1 . 2]" 1
147 1 22 VAL MG1 1 23 MET H 3.200 . 4.500 2.535 1.952 3.949 . 0 0 "[ . 1 . 2]" 1
148 1 22 VAL MG1 1 24 GLU H 3.900 . 5.500 4.564 4.097 5.402 . 0 0 "[ . 1 . 2]" 1
149 1 22 VAL MG1 1 29 VAL MG1 3.200 . 4.000 2.431 1.935 3.701 . 0 0 "[ . 1 . 2]" 1
150 1 22 VAL MG1 1 29 VAL MG2 3.200 . 4.000 2.367 1.907 3.202 . 0 0 "[ . 1 . 2]" 1
151 1 22 VAL MG2 1 29 VAL MG1 3.200 . 4.000 3.264 2.019 4.036 0.036 4 0 "[ . 1 . 2]" 1
152 1 22 VAL MG2 1 29 VAL MG2 3.200 . 4.000 3.290 2.616 4.015 0.015 2 0 "[ . 1 . 2]" 1
153 1 23 MET H 1 23 MET HA 2.900 . 4.000 2.812 2.779 2.860 . 0 0 "[ . 1 . 2]" 1
154 1 23 MET H 1 23 MET HB2 3.000 . 4.100 2.443 2.200 3.605 . 0 0 "[ . 1 . 2]" 1
155 1 23 MET H 1 23 MET HG2 2.700 . 3.600 2.855 1.949 3.613 0.013 17 0 "[ . 1 . 2]" 1
156 1 23 MET H 1 23 MET HG3 2.700 . 3.600 3.083 2.257 3.590 . 0 0 "[ . 1 . 2]" 1
157 1 23 MET H 1 24 GLU H 2.800 . 3.800 2.673 2.455 2.844 . 0 0 "[ . 1 . 2]" 1
158 1 23 MET H 1 29 VAL MG2 3.200 . 5.500 4.359 3.530 5.045 . 0 0 "[ . 1 . 2]" 1
159 1 23 MET HB2 1 24 GLU H 3.800 . 5.500 2.780 2.373 4.017 . 0 0 "[ . 1 . 2]" 1
160 1 23 MET HB3 1 24 GLU H 3.300 . 4.700 3.567 3.165 3.918 . 0 0 "[ . 1 . 2]" 1
161 1 23 MET ME 1 29 VAL MG1 3.200 . 4.000 3.809 3.095 4.011 0.011 7 0 "[ . 1 . 2]" 1
162 1 23 MET ME 1 29 VAL MG2 3.200 . 4.000 2.427 2.034 2.830 . 0 0 "[ . 1 . 2]" 1
163 1 23 MET HG2 1 24 GLU H 3.000 . 5.500 4.565 2.692 5.155 . 0 0 "[ . 1 . 2]" 1
164 1 23 MET HG3 1 24 GLU H 3.400 . 4.800 4.608 2.523 4.946 0.146 9 0 "[ . 1 . 2]" 1
165 1 24 GLU H 1 24 GLU HA 2.700 . 3.600 2.849 2.810 2.864 . 0 0 "[ . 1 . 2]" 1
166 1 24 GLU H 1 24 GLU HB2 2.600 . 3.400 2.273 2.074 3.482 0.082 14 0 "[ . 1 . 2]" 1
167 1 24 GLU H 1 24 GLU HB3 2.400 . 3.100 2.957 2.182 3.395 0.295 20 0 "[ . 1 . 2]" 1
168 1 24 GLU H 1 24 GLU QG 3.400 . 4.800 3.703 2.838 4.020 . 0 0 "[ . 1 . 2]" 1
169 1 24 GLU H 1 25 GLY H 2.500 . 3.300 2.530 2.459 2.657 . 0 0 "[ . 1 . 2]" 1
170 1 27 GLY H 1 28 ILE H 3.400 . 4.800 4.482 4.436 4.522 . 0 0 "[ . 1 . 2]" 1
171 1 27 GLY HA2 1 28 ILE H 2.600 . 3.400 2.433 2.239 2.555 . 0 0 "[ . 1 . 2]" 1
172 1 27 GLY HA3 1 28 ILE H 2.500 . 3.300 2.715 2.570 2.958 . 0 0 "[ . 1 . 2]" 1
173 1 28 ILE H 1 28 ILE HA 3.000 . 4.100 2.924 2.914 2.929 . 0 0 "[ . 1 . 2]" 1
174 1 28 ILE H 1 28 ILE HB 2.700 . 3.600 2.726 2.339 3.216 . 0 0 "[ . 1 . 2]" 1
175 1 28 ILE H 1 28 ILE MG 2.600 . 3.400 2.335 1.847 2.919 . 0 0 "[ . 1 . 2]" 1
176 1 28 ILE H 1 29 VAL H 3.200 . 4.500 4.544 4.516 4.561 0.061 15 0 "[ . 1 . 2]" 1
177 1 28 ILE H 1 162 VAL HA 4.000 . 5.000 3.976 3.511 4.415 . 0 0 "[ . 1 . 2]" 1
178 1 28 ILE H 1 162 VAL QG 2.800 . 3.800 3.575 2.634 3.778 . 0 0 "[ . 1 . 2]" 1
179 1 28 ILE H 1 163 ASP H 4.000 . 5.000 5.019 4.750 5.063 0.063 13 0 "[ . 1 . 2]" 1
180 1 28 ILE H 1 163 ASP HB3 2.700 . 5.500 5.305 4.401 6.342 0.842 20 6 "[* * . - * .* +]" 1
181 1 28 ILE H 1 164 LEU H 4.000 . 5.000 4.042 3.492 4.719 . 0 0 "[ . 1 . 2]" 1
182 1 28 ILE HA 1 29 VAL H 2.300 . 3.000 2.237 2.176 2.320 . 0 0 "[ . 1 . 2]" 1
183 1 28 ILE HB 1 29 VAL H 3.300 . 4.700 4.076 3.755 4.262 . 0 0 "[ . 1 . 2]" 1
184 1 28 ILE MD 1 29 VAL H 3.100 . 4.300 1.967 1.881 2.299 0.019 15 0 "[ . 1 . 2]" 1
185 1 28 ILE MD 1 30 ILE H 3.100 . 4.300 4.197 3.678 4.366 0.066 16 0 "[ . 1 . 2]" 1
186 1 28 ILE MD 1 40 GLY H 3.200 . 4.500 2.782 2.372 3.430 . 0 0 "[ . 1 . 2]" 1
187 1 28 ILE MD 1 139 THR H 3.600 . 5.200 5.216 5.152 5.250 0.050 5 0 "[ . 1 . 2]" 1
188 1 28 ILE MG 1 164 LEU H 2.600 . 3.400 3.394 3.007 3.451 0.051 7 0 "[ . 1 . 2]" 1
189 1 29 VAL H 1 29 VAL HB 2.900 . 4.000 3.116 3.006 3.186 . 0 0 "[ . 1 . 2]" 1
190 1 29 VAL H 1 29 VAL MG2 2.700 . 3.600 2.150 1.972 2.243 . 0 0 "[ . 1 . 2]" 1
191 1 29 VAL H 1 30 ILE H 3.900 . 5.500 4.399 4.177 4.511 . 0 0 "[ . 1 . 2]" 1
192 1 29 VAL H 1 40 GLY H 3.200 . 4.000 3.765 3.626 3.937 . 0 0 "[ . 1 . 2]" 1
193 1 29 VAL H 1 40 GLY HA3 3.800 . 5.500 5.191 5.004 5.524 0.024 19 0 "[ . 1 . 2]" 1
194 1 29 VAL H 1 41 VAL HB 3.400 . 4.800 3.344 2.167 4.818 0.018 19 0 "[ . 1 . 2]" 1
195 1 29 VAL HA 1 30 ILE H 2.400 . 3.100 2.204 2.166 2.284 . 0 0 "[ . 1 . 2]" 1
196 1 29 VAL HA 1 164 LEU H 2.700 . 3.600 3.114 2.404 3.584 . 0 0 "[ . 1 . 2]" 1
197 1 29 VAL HB 1 30 ILE H 3.000 . 4.100 3.652 3.299 3.989 . 0 0 "[ . 1 . 2]" 1
198 1 29 VAL HB 1 40 GLY H 3.900 . 5.500 3.662 3.314 3.964 . 0 0 "[ . 1 . 2]" 1
199 1 29 VAL MG2 1 30 ILE H 3.400 . 4.800 4.361 4.201 4.485 . 0 0 "[ . 1 . 2]" 1
200 1 29 VAL MG2 1 40 GLY H 3.400 . 4.800 4.263 4.077 4.507 . 0 0 "[ . 1 . 2]" 1
201 1 29 VAL MG2 1 41 VAL H 3.300 . 4.700 4.487 4.394 4.608 . 0 0 "[ . 1 . 2]" 1
202 1 29 VAL MG2 1 42 ASN H 2.900 . 4.000 4.096 4.064 4.153 0.153 8 0 "[ . 1 . 2]" 1
203 1 30 ILE H 1 30 ILE HB 2.900 . 4.000 3.399 2.770 3.560 . 0 0 "[ . 1 . 2]" 1
204 1 30 ILE H 1 30 ILE MD 2.800 . 3.800 3.180 2.404 3.872 0.072 19 0 "[ . 1 . 2]" 1
205 1 30 ILE H 1 31 TYR H 3.700 . 5.400 4.544 4.498 4.573 . 0 0 "[ . 1 . 2]" 1
206 1 30 ILE H 1 164 LEU H 3.200 . 4.500 4.382 3.140 4.552 0.052 11 0 "[ . 1 . 2]" 1
207 1 30 ILE H 1 165 VAL HA 3.200 . 4.500 4.010 3.362 4.506 0.006 7 0 "[ . 1 . 2]" 1
208 1 30 ILE HA 1 31 TYR H 2.400 . 3.100 2.391 2.274 2.537 . 0 0 "[ . 1 . 2]" 1
209 1 30 ILE HA 1 38 GLY H 4.000 . 5.000 4.980 4.686 5.050 0.050 3 0 "[ . 1 . 2]" 1
210 1 30 ILE HA 1 39 LEU HA 2.600 . 3.000 2.154 1.760 2.393 0.040 19 0 "[ . 1 . 2]" 1
211 1 30 ILE HA 1 40 GLY H 3.500 . 5.000 2.899 2.586 3.201 . 0 0 "[ . 1 . 2]" 1
212 1 30 ILE HB 1 31 TYR H 3.300 . 4.700 2.699 2.400 3.607 . 0 0 "[ . 1 . 2]" 1
213 1 30 ILE MD 1 31 TYR H 3.000 . 4.100 4.122 4.070 4.257 0.157 19 0 "[ . 1 . 2]" 1
214 1 30 ILE MD 1 155 ILE MD 3.200 . 4.000 2.645 1.945 4.035 0.035 19 0 "[ . 1 . 2]" 1
215 1 30 ILE MD 1 155 ILE MG 2.600 . 3.000 2.606 1.867 3.047 0.047 16 0 "[ . 1 . 2]" 1
216 1 30 ILE MG 1 31 TYR H 2.700 . 3.600 2.792 1.774 3.244 0.026 19 0 "[ . 1 . 2]" 1
217 1 30 ILE MG 1 38 GLY H 2.900 . 4.000 3.886 3.109 4.041 0.041 11 0 "[ . 1 . 2]" 1
218 1 30 ILE MG 1 141 ALA H 3.200 . 4.500 4.537 4.505 4.591 0.091 15 0 "[ . 1 . 2]" 1
219 1 31 TYR H 1 31 TYR HB3 3.700 . 5.400 3.635 3.587 3.686 . 0 0 "[ . 1 . 2]" 1
220 1 31 TYR H 1 31 TYR QD 3.500 . 5.000 4.314 3.957 4.455 . 0 0 "[ . 1 . 2]" 1
221 1 31 TYR H 1 38 GLY H 3.200 . 4.000 2.957 2.732 3.126 . 0 0 "[ . 1 . 2]" 1
222 1 31 TYR H 1 39 LEU HA 3.500 . 5.000 3.210 2.972 3.483 . 0 0 "[ . 1 . 2]" 1
223 1 31 TYR H 1 40 GLY H 4.500 . 5.500 4.439 4.164 4.905 . 0 0 "[ . 1 . 2]" 1
224 1 31 TYR HA 1 166 LEU H 3.700 . 5.400 5.414 5.256 5.500 0.100 20 0 "[ . 1 . 2]" 1
225 1 31 TYR QD 1 40 GLY H 3.400 . 4.800 4.876 4.828 4.950 0.150 8 0 "[ . 1 . 2]" 1
226 1 31 TYR QD 1 168 ALA MB 3.200 . 4.000 3.707 3.387 4.027 0.027 13 0 "[ . 1 . 2]" 1
227 1 31 TYR QD 1 169 GLY H 4.300 . 5.500 4.483 3.815 5.289 . 0 0 "[ . 1 . 2]" 1
228 1 31 TYR QE 1 168 ALA H 3.200 . 4.000 3.356 2.748 3.835 . 0 0 "[ . 1 . 2]" 1
229 1 31 TYR QE 1 168 ALA MB 2.600 . 3.000 1.888 1.782 2.175 0.018 4 0 "[ . 1 . 2]" 1
230 1 31 TYR HH 1 168 ALA H 3.200 . 4.000 2.331 2.099 2.530 . 0 0 "[ . 1 . 2]" 1
231 1 31 TYR HH 1 169 GLY H 3.200 . 4.000 4.050 4.022 4.086 0.086 12 0 "[ . 1 . 2]" 1
232 1 32 PRO HA 1 37 TYR HA 2.600 . 3.000 2.224 1.772 2.714 0.028 15 0 "[ . 1 . 2]" 1
233 1 32 PRO HA 1 38 GLY H 3.300 . 4.700 2.379 2.130 2.845 . 0 0 "[ . 1 . 2]" 1
234 1 33 THR H 1 35 THR H 4.000 . 5.000 3.675 3.345 4.336 . 0 0 "[ . 1 . 2]" 1
235 1 33 THR H 1 38 GLY H 4.000 . 5.500 4.307 3.851 4.700 . 0 0 "[ . 1 . 2]" 1
236 1 33 THR HA 1 34 ASP H 2.900 . 4.000 3.040 2.838 3.531 . 0 0 "[ . 1 . 2]" 1
237 1 33 THR HA 1 170 ASP HA 2.700 . 3.600 3.648 3.571 3.777 0.177 14 0 "[ . 1 . 2]" 1
238 1 33 THR HB 1 34 ASP H 3.200 . 4.500 1.937 1.844 2.156 0.056 10 0 "[ . 1 . 2]" 1
239 1 33 THR HB 1 35 THR H 3.300 . 4.700 2.962 2.342 4.739 0.039 17 0 "[ . 1 . 2]" 1
240 1 33 THR HB 1 123 ASP H 3.400 . 5.500 3.707 2.554 4.117 . 0 0 "[ . 1 . 2]" 1
241 1 33 THR MG 1 34 ASP H 3.000 . 4.100 2.149 1.897 3.541 0.003 19 0 "[ . 1 . 2]" 1
242 1 33 THR MG 1 35 THR H 4.000 . 5.000 4.102 3.585 5.002 0.002 17 0 "[ . 1 . 2]" 1
243 1 33 THR MG 1 123 ASP HA 3.200 . 4.000 4.033 4.000 4.061 0.061 19 0 "[ . 1 . 2]" 1
244 1 33 THR MG 1 123 ASP HB2 3.200 . 4.000 2.647 2.306 3.104 . 0 0 "[ . 1 . 2]" 1
245 1 33 THR MG 1 123 ASP HB3 3.200 . 4.000 3.142 2.538 3.622 . 0 0 "[ . 1 . 2]" 1
246 1 34 ASP H 1 34 ASP HA 2.500 . 3.300 2.786 2.755 2.850 . 0 0 "[ . 1 . 2]" 1
247 1 34 ASP H 1 34 ASP HB2 3.400 . 4.800 2.770 2.065 3.584 . 0 0 "[ . 1 . 2]" 1
248 1 34 ASP H 1 34 ASP HB3 3.600 . 5.200 3.273 2.453 3.586 . 0 0 "[ . 1 . 2]" 1
249 1 34 ASP H 1 35 THR H 2.800 . 3.800 2.754 2.568 3.034 . 0 0 "[ . 1 . 2]" 1
250 1 34 ASP HA 1 35 THR H 2.800 . 3.800 3.466 3.374 3.572 . 0 0 "[ . 1 . 2]" 1
251 1 34 ASP HA 1 172 LEU H 3.200 . 4.000 2.445 1.780 4.103 0.103 9 0 "[ . 1 . 2]" 1
252 1 34 ASP HA 1 173 ASP H 3.200 . 4.000 3.567 1.816 4.017 0.017 10 0 "[ . 1 . 2]" 1
253 1 35 THR H 1 35 THR HB 3.300 . 4.700 3.188 2.774 3.610 . 0 0 "[ . 1 . 2]" 1
254 1 36 ILE MD 1 174 MET ME 2.600 . 3.000 2.719 1.780 3.012 0.020 20 0 "[ . 1 . 2]" 1
255 1 36 ILE MD 1 174 MET QG 3.200 . 4.000 3.531 1.795 4.045 0.045 9 0 "[ . 1 . 2]" 1
256 1 36 ILE MG 1 174 MET ME 3.200 . 4.000 2.978 1.860 4.025 0.025 6 0 "[ . 1 . 2]" 1
257 1 37 TYR H 1 37 TYR HB2 2.700 . 3.600 2.201 2.074 3.635 0.035 15 0 "[ . 1 . 2]" 1
258 1 37 TYR H 1 37 TYR HB3 2.800 . 3.800 3.332 2.464 3.533 . 0 0 "[ . 1 . 2]" 1
259 1 37 TYR H 1 37 TYR QD 3.000 . 4.100 2.799 1.919 3.921 . 0 0 "[ . 1 . 2]" 1
260 1 37 TYR H 1 38 GLY H 4.400 . 5.500 4.564 4.442 4.632 . 0 0 "[ . 1 . 2]" 1
261 1 37 TYR H 1 141 ALA H 4.000 . 5.000 5.020 4.982 5.064 0.064 15 0 "[ . 1 . 2]" 1
262 1 37 TYR H 1 141 ALA MB 3.500 . 5.000 4.601 4.048 5.009 0.009 15 0 "[ . 1 . 2]" 1
263 1 37 TYR HA 1 38 GLY H 2.500 . 3.300 2.175 2.126 2.252 . 0 0 "[ . 1 . 2]" 1
264 1 37 TYR HA 1 141 ALA H 2.300 . 5.500 5.038 4.781 5.242 . 0 0 "[ . 1 . 2]" 1
265 1 37 TYR HB3 1 38 GLY H 3.500 . 5.000 3.415 3.030 4.337 . 0 0 "[ . 1 . 2]" 1
266 1 37 TYR QD 1 38 GLY H 3.100 . 4.300 3.761 2.014 4.312 0.012 15 0 "[ . 1 . 2]" 1
267 1 37 TYR QD 1 149 SER H 3.500 . 5.000 3.799 3.041 4.620 . 0 0 "[ . 1 . 2]" 1
268 1 37 TYR QE 1 149 SER H 3.200 . 4.000 3.273 2.694 4.005 0.005 8 0 "[ . 1 . 2]" 1
269 1 37 TYR QE 1 155 ILE MD 2.600 . 3.000 2.464 1.882 3.035 0.035 15 0 "[ . 1 . 2]" 1
270 1 37 TYR QE 1 155 ILE MG 3.200 . 4.000 3.896 3.542 4.011 0.011 8 0 "[ . 1 . 2]" 1
271 1 38 GLY H 1 38 GLY HA2 2.600 . 3.400 2.953 2.945 2.957 . 0 0 "[ . 1 . 2]" 1
272 1 38 GLY H 1 38 GLY HA3 2.900 . 4.000 2.493 2.453 2.568 . 0 0 "[ . 1 . 2]" 1
273 1 38 GLY H 1 39 LEU H 3.700 . 5.400 4.422 4.181 4.492 . 0 0 "[ . 1 . 2]" 1
274 1 38 GLY H 1 141 ALA MB 3.500 . 5.000 4.173 3.440 4.799 . 0 0 "[ . 1 . 2]" 1
275 1 38 GLY HA2 1 141 ALA H 3.500 . 5.000 2.538 1.868 3.085 0.132 15 0 "[ . 1 . 2]" 1
276 1 38 GLY HA3 1 39 LEU H 2.500 . 3.300 2.646 2.410 3.269 . 0 0 "[ . 1 . 2]" 1
277 1 38 GLY HA3 1 141 ALA H 3.000 . 4.100 4.247 3.565 4.802 0.702 18 3 "[ . - . +*2]" 1
278 1 39 LEU H 1 39 LEU HA 3.000 . 4.100 2.941 2.933 2.947 . 0 0 "[ . 1 . 2]" 1
279 1 39 LEU H 1 39 LEU HB2 2.800 . 3.800 2.675 2.374 3.714 . 0 0 "[ . 1 . 2]" 1
280 1 39 LEU H 1 39 LEU HB3 2.900 . 4.000 3.540 2.929 3.847 . 0 0 "[ . 1 . 2]" 1
281 1 39 LEU H 1 39 LEU MD1 3.200 . 4.500 3.402 2.831 3.884 . 0 0 "[ . 1 . 2]" 1
282 1 39 LEU H 1 40 GLY H 3.800 . 5.500 4.407 4.340 4.507 . 0 0 "[ . 1 . 2]" 1
283 1 39 LEU H 1 139 THR H 3.200 . 4.000 2.655 2.295 3.501 . 0 0 "[ . 1 . 2]" 1
284 1 39 LEU H 1 139 THR MG 2.900 . 4.000 3.855 3.183 4.019 0.019 19 0 "[ . 1 . 2]" 1
285 1 39 LEU H 1 141 ALA H 3.600 . 5.200 4.217 3.532 4.687 . 0 0 "[ . 1 . 2]" 1
286 1 39 LEU H 1 141 ALA MB 3.300 . 4.700 4.478 3.675 4.729 0.029 8 0 "[ . 1 . 2]" 1
287 1 39 LEU HA 1 40 GLY H 2.700 . 3.600 2.196 2.159 2.232 . 0 0 "[ . 1 . 2]" 1
288 1 39 LEU HB2 1 40 GLY H 3.800 . 5.500 4.043 2.805 4.329 . 0 0 "[ . 1 . 2]" 1
289 1 39 LEU HB3 1 40 GLY H 3.600 . 5.200 3.182 2.896 4.073 . 0 0 "[ . 1 . 2]" 1
290 1 39 LEU HB3 1 139 THR H 3.500 . 5.000 3.366 2.457 5.766 0.766 19 1 "[ . 1 . +2]" 1
291 1 39 LEU MD1 1 55 VAL MG2 2.600 . 3.000 2.763 1.941 3.548 0.548 17 1 "[ . 1 . + 2]" 1
292 1 39 LEU MD1 1 139 THR H 3.200 . 4.500 3.713 3.073 4.236 . 0 0 "[ . 1 . 2]" 1
293 1 39 LEU MD2 1 55 VAL MG2 2.600 . 3.000 2.807 2.290 3.965 0.965 17 1 "[ . 1 . + 2]" 1
294 1 40 GLY H 1 40 GLY HA2 3.000 . 4.100 2.922 2.916 2.931 . 0 0 "[ . 1 . 2]" 1
295 1 40 GLY H 1 40 GLY HA3 2.800 . 3.800 2.615 2.597 2.638 . 0 0 "[ . 1 . 2]" 1
296 1 40 GLY H 1 41 VAL H 3.800 . 5.500 4.146 3.935 4.416 . 0 0 "[ . 1 . 2]" 1
297 1 40 GLY HA2 1 41 VAL H 2.700 . 3.600 2.164 2.126 2.437 . 0 0 "[ . 1 . 2]" 1
298 1 40 GLY HA2 1 137 THR H 3.100 . 4.300 3.820 3.633 4.311 0.011 18 0 "[ . 1 . 2]" 1
299 1 40 GLY HA3 1 137 THR H 4.000 . 5.000 4.962 4.171 5.073 0.073 20 0 "[ . 1 . 2]" 1
300 1 41 VAL H 1 41 VAL HA 2.600 . 3.400 2.890 2.836 2.910 . 0 0 "[ . 1 . 2]" 1
301 1 41 VAL H 1 41 VAL HB 2.900 . 4.000 3.553 3.169 3.928 . 0 0 "[ . 1 . 2]" 1
302 1 41 VAL H 1 41 VAL QG 3.700 . 4.000 2.442 2.115 2.870 . 0 0 "[ . 1 . 2]" 1
303 1 41 VAL H 1 43 ALA H 4.100 . 5.500 5.079 4.588 5.501 0.001 18 0 "[ . 1 . 2]" 1
304 1 41 VAL H 1 136 VAL HA 3.600 . 5.200 4.261 3.823 4.648 . 0 0 "[ . 1 . 2]" 1
305 1 41 VAL H 1 136 VAL MG1 3.400 . 4.800 2.340 1.987 4.116 0.013 4 0 "[ . 1 . 2]" 1
306 1 41 VAL H 1 137 THR H 2.600 . 3.400 2.374 2.201 2.670 . 0 0 "[ . 1 . 2]" 1
307 1 41 VAL H 1 137 THR HA 2.900 . 5.500 4.422 4.252 4.523 . 0 0 "[ . 1 . 2]" 1
308 1 41 VAL H 1 137 THR HB 2.200 . 2.800 2.494 2.297 2.815 0.015 8 0 "[ . 1 . 2]" 1
309 1 41 VAL H 1 137 THR MG 3.000 . 4.100 3.919 2.316 4.122 0.022 6 0 "[ . 1 . 2]" 1
310 1 41 VAL HA 1 42 ASN H 2.500 . 3.300 2.493 2.284 2.732 . 0 0 "[ . 1 . 2]" 1
311 1 41 VAL QG 1 42 ASN H 3.000 . 4.100 2.361 1.762 3.091 0.138 15 0 "[ . 1 . 2]" 1
312 1 41 VAL QG 1 45 ASP H 4.000 . 5.500 4.897 4.418 5.403 . 0 0 "[ . 1 . 2]" 1
313 1 41 VAL QG 1 48 ALA H 3.700 . 5.400 3.758 3.294 4.207 . 0 0 "[ . 1 . 2]" 1
314 1 41 VAL QG 1 48 ALA MB 2.600 . 3.000 2.091 1.693 2.539 0.107 20 0 "[ . 1 . 2]" 1
315 1 41 VAL QG 1 49 VAL H 3.100 . 5.500 4.972 4.573 5.301 . 0 0 "[ . 1 . 2]" 1
316 1 41 VAL QG 1 137 THR H 3.800 . 4.500 3.372 2.984 3.786 . 0 0 "[ . 1 . 2]" 1
317 1 42 ASN H 1 42 ASN HB2 2.700 . 3.600 2.278 2.076 3.468 . 0 0 "[ . 1 . 2]" 1
318 1 42 ASN H 1 42 ASN HB3 2.900 . 4.000 3.225 2.795 3.599 . 0 0 "[ . 1 . 2]" 1
319 1 42 ASN H 1 43 ALA H 3.300 . 4.700 4.384 4.224 4.513 . 0 0 "[ . 1 . 2]" 1
320 1 42 ASN HA 1 137 THR H 4.000 . 5.000 4.230 3.956 4.382 . 0 0 "[ . 1 . 2]" 1
321 1 42 ASN HB3 1 43 ALA H 3.900 . 5.500 3.942 3.506 4.241 . 0 0 "[ . 1 . 2]" 1
322 1 43 ALA H 1 43 ALA HA 2.900 . 4.000 2.784 2.759 2.826 . 0 0 "[ . 1 . 2]" 1
323 1 43 ALA H 1 43 ALA MB 2.400 . 3.100 2.129 2.018 2.226 . 0 0 "[ . 1 . 2]" 1
324 1 43 ALA H 1 44 LEU H 3.000 . 4.100 2.872 2.679 3.124 . 0 0 "[ . 1 . 2]" 1
325 1 43 ALA H 1 136 VAL HA 2.800 . 3.800 2.747 2.183 3.157 . 0 0 "[ . 1 . 2]" 1
326 1 43 ALA H 1 136 VAL MG2 3.300 . 4.700 4.593 4.011 5.245 0.545 11 1 "[ . 1+ . 2]" 1
327 1 43 ALA H 1 137 THR MG 3.300 . 5.500 5.373 4.678 5.530 0.030 10 0 "[ . 1 . 2]" 1
328 1 43 ALA HA 1 45 ASP H 3.200 . 5.500 3.630 3.340 4.236 . 0 0 "[ . 1 . 2]" 1
329 1 43 ALA HA 1 137 THR H 4.100 . 5.500 3.715 3.100 4.422 . 0 0 "[ . 1 . 2]" 1
330 1 43 ALA MB 1 137 THR H 3.300 . 4.700 3.232 2.594 3.897 . 0 0 "[ . 1 . 2]" 1
331 1 44 LEU HA 1 45 ASP H 3.000 . 4.100 2.964 2.767 3.464 . 0 0 "[ . 1 . 2]" 1
332 1 44 LEU HB2 1 45 ASP H 2.900 . 5.500 4.097 2.943 4.379 . 0 0 "[ . 1 . 2]" 1
333 1 44 LEU HB3 1 45 ASP H 3.200 . 4.500 4.172 3.340 4.355 . 0 0 "[ . 1 . 2]" 1
334 1 44 LEU MD1 1 45 ASP H 3.000 . 4.100 4.301 4.128 4.552 0.452 3 0 "[ . 1 . 2]" 1
335 1 44 LEU MD1 1 105 LEU MD1 3.200 . 4.000 3.911 2.749 4.056 0.056 19 0 "[ . 1 . 2]" 1
336 1 44 LEU MD1 1 105 LEU MD2 3.200 . 4.000 3.723 2.963 4.021 0.021 13 0 "[ . 1 . 2]" 1
337 1 44 LEU MD1 1 110 ILE MD 2.600 . 3.000 2.761 1.994 3.026 0.026 2 0 "[ . 1 . 2]" 1
338 1 44 LEU MD2 1 45 ASP H 3.200 . 4.500 4.404 4.147 4.762 0.262 8 0 "[ . 1 . 2]" 1
339 1 44 LEU MD2 1 105 LEU MD1 3.200 . 4.000 3.654 2.722 4.031 0.031 2 0 "[ . 1 . 2]" 1
340 1 44 LEU MD2 1 105 LEU MD2 3.200 . 4.000 3.803 2.937 4.027 0.027 16 0 "[ . 1 . 2]" 1
341 1 44 LEU MD2 1 110 ILE MD 2.600 . 3.000 2.937 2.502 3.063 0.063 8 0 "[ . 1 . 2]" 1
342 1 45 ASP H 1 45 ASP HA 2.400 . 3.100 2.942 2.882 2.948 . 0 0 "[ . 1 . 2]" 1
343 1 45 ASP H 1 45 ASP QB 2.500 . 3.300 2.323 2.097 2.371 . 0 0 "[ . 1 . 2]" 1
344 1 45 ASP H 1 46 GLU H 3.400 . 4.800 4.518 4.498 4.611 . 0 0 "[ . 1 . 2]" 1
345 1 45 ASP H 1 47 ASP H 3.700 . 5.400 5.118 4.634 5.389 . 0 0 "[ . 1 . 2]" 1
346 1 45 ASP HA 1 46 GLU H 3.400 . 4.800 2.300 2.252 2.396 . 0 0 "[ . 1 . 2]" 1
347 1 45 ASP HA 1 47 ASP H 4.200 . 5.500 3.991 3.848 4.270 . 0 0 "[ . 1 . 2]" 1
348 1 45 ASP QB 1 49 VAL H 3.700 . 5.400 4.817 4.431 5.419 0.019 8 0 "[ . 1 . 2]" 1
349 1 45 ASP HB3 1 46 GLU H 2.300 . 3.000 2.975 2.808 3.016 0.016 13 0 "[ . 1 . 2]" 1
350 1 45 ASP HB3 1 47 ASP H 3.100 . 4.300 2.417 2.178 2.649 . 0 0 "[ . 1 . 2]" 1
351 1 45 ASP HB3 1 48 ALA H 3.700 . 5.400 2.908 2.592 3.780 . 0 0 "[ . 1 . 2]" 1
352 1 46 GLU H 1 46 GLU HA 2.600 . 3.400 2.857 2.787 2.870 . 0 0 "[ . 1 . 2]" 1
353 1 46 GLU H 1 46 GLU QB 2.200 . 2.800 2.180 2.048 2.536 . 0 0 "[ . 1 . 2]" 1
354 1 46 GLU H 1 46 GLU QG 2.600 . 5.500 3.297 2.050 3.821 . 0 0 "[ . 1 . 2]" 1
355 1 46 GLU H 1 47 ASP H 2.600 . 3.400 2.475 2.411 2.753 . 0 0 "[ . 1 . 2]" 1
356 1 46 GLU H 1 48 ALA H 3.600 . 5.200 4.154 3.994 4.572 . 0 0 "[ . 1 . 2]" 1
357 1 46 GLU HA 1 47 ASP H 2.900 . 4.000 3.454 3.374 3.515 . 0 0 "[ . 1 . 2]" 1
358 1 46 GLU HA 1 48 ALA H 3.600 . 5.200 3.813 3.688 4.014 . 0 0 "[ . 1 . 2]" 1
359 1 46 GLU HA 1 49 VAL H 2.800 . 3.800 3.253 3.062 3.394 . 0 0 "[ . 1 . 2]" 1
360 1 46 GLU QB 1 47 ASP H 2.900 . 4.000 3.141 2.769 3.600 . 0 0 "[ . 1 . 2]" 1
361 1 46 GLU QB 1 48 ALA H 3.500 . 5.000 4.697 4.506 5.008 0.008 9 0 "[ . 1 . 2]" 1
362 1 46 GLU QB 1 50 ARG H 3.500 . 5.000 4.816 4.657 4.856 . 0 0 "[ . 1 . 2]" 1
363 1 46 GLU QG 1 47 ASP H 3.300 . 4.700 3.959 2.072 4.678 . 0 0 "[ . 1 . 2]" 1
364 1 46 GLU QG 1 48 ALA H 3.700 . 5.400 5.146 4.307 5.423 0.023 15 0 "[ . 1 . 2]" 1
365 1 46 GLU QG 1 49 VAL H 3.900 . 5.500 4.732 4.383 5.147 . 0 0 "[ . 1 . 2]" 1
366 1 46 GLU QG 1 50 ARG H 3.500 . 5.000 4.908 4.281 5.038 0.038 14 0 "[ . 1 . 2]" 1
367 1 47 ASP H 1 47 ASP HA 2.600 . 3.400 2.814 2.788 2.857 . 0 0 "[ . 1 . 2]" 1
368 1 47 ASP H 1 47 ASP QB 2.300 . 3.000 2.360 2.081 2.720 . 0 0 "[ . 1 . 2]" 1
369 1 47 ASP H 1 49 VAL H 3.100 . 4.300 4.227 4.038 4.339 0.039 16 0 "[ . 1 . 2]" 1
370 1 47 ASP HA 1 48 ALA H 3.100 . 4.300 3.471 3.431 3.501 . 0 0 "[ . 1 . 2]" 1
371 1 47 ASP QB 1 48 ALA H 2.700 . 3.600 2.870 2.727 3.029 . 0 0 "[ . 1 . 2]" 1
372 1 48 ALA H 1 48 ALA HA 2.700 . 3.600 2.856 2.828 2.871 . 0 0 "[ . 1 . 2]" 1
373 1 48 ALA H 1 48 ALA MB 2.300 . 3.000 2.185 2.073 2.257 . 0 0 "[ . 1 . 2]" 1
374 1 48 ALA H 1 49 VAL H 2.500 . 3.300 2.521 2.449 2.572 . 0 0 "[ . 1 . 2]" 1
375 1 48 ALA HA 1 49 VAL H 3.200 . 4.500 3.517 3.450 3.561 . 0 0 "[ . 1 . 2]" 1
376 1 48 ALA HA 1 50 ARG H 2.500 . 5.500 4.479 3.864 4.787 . 0 0 "[ . 1 . 2]" 1
377 1 48 ALA HA 1 51 ARG H 2.700 . 3.600 3.596 3.372 3.626 0.026 16 0 "[ . 1 . 2]" 1
378 1 48 ALA HA 1 52 LEU H 3.600 . 5.200 4.078 3.666 4.526 . 0 0 "[ . 1 . 2]" 1
379 1 48 ALA MB 1 49 VAL H 2.500 . 3.300 2.673 2.427 2.914 . 0 0 "[ . 1 . 2]" 1
380 1 48 ALA MB 1 137 THR MG 2.600 . 3.000 2.591 1.868 3.021 0.021 16 0 "[ . 1 . 2]" 1
381 1 49 VAL H 1 49 VAL HA 2.800 . 3.800 2.835 2.796 2.867 . 0 0 "[ . 1 . 2]" 1
382 1 49 VAL H 1 49 VAL MG2 2.700 . 3.600 2.391 1.814 3.797 0.197 16 0 "[ . 1 . 2]" 1
383 1 49 VAL H 1 50 ARG H 2.600 . 3.400 2.629 2.489 2.755 . 0 0 "[ . 1 . 2]" 1
384 1 49 VAL HA 1 50 ARG H 3.200 . 4.500 3.533 3.432 3.571 . 0 0 "[ . 1 . 2]" 1
385 1 49 VAL HA 1 51 ARG H 2.900 . 5.500 4.530 4.153 4.891 . 0 0 "[ . 1 . 2]" 1
386 1 49 VAL HA 1 52 LEU H 2.900 . 4.000 3.612 3.414 3.918 . 0 0 "[ . 1 . 2]" 1
387 1 49 VAL HB 1 50 ARG H 3.500 . 5.000 2.929 2.270 4.050 . 0 0 "[ . 1 . 2]" 1
388 1 49 VAL MG1 1 109 VAL QG 2.600 . 3.000 2.307 1.793 2.958 0.007 19 0 "[ . 1 . 2]" 1
389 1 49 VAL MG2 1 50 ARG H 3.300 . 4.700 3.533 2.080 4.048 . 0 0 "[ . 1 . 2]" 1
390 1 49 VAL MG2 1 109 VAL QG 2.600 . 3.000 2.179 1.811 2.881 . 0 0 "[ . 1 . 2]" 1
391 1 50 ARG H 1 50 ARG HA 2.500 . 3.300 2.833 2.807 2.865 . 0 0 "[ . 1 . 2]" 1
392 1 50 ARG H 1 50 ARG QB 2.500 . 3.300 2.236 2.038 2.620 . 0 0 "[ . 1 . 2]" 1
393 1 51 ARG H 1 51 ARG HA 2.600 . 3.400 2.831 2.805 2.865 . 0 0 "[ . 1 . 2]" 1
394 1 51 ARG H 1 51 ARG HB2 2.500 . 3.300 2.407 2.068 3.446 0.146 16 0 "[ . 1 . 2]" 1
395 1 51 ARG H 1 51 ARG HG2 2.900 . 4.000 2.969 1.859 4.018 0.018 20 0 "[ . 1 . 2]" 1
396 1 51 ARG H 1 51 ARG HG3 3.100 . 4.300 3.712 3.094 4.273 . 0 0 "[ . 1 . 2]" 1
397 1 51 ARG H 1 52 LEU H 2.300 . 3.000 2.607 2.459 2.803 . 0 0 "[ . 1 . 2]" 1
398 1 51 ARG HA 1 52 LEU H 3.200 . 4.500 3.496 3.381 3.570 . 0 0 "[ . 1 . 2]" 1
399 1 51 ARG HA 1 54 ARG H 2.900 . 4.000 3.425 3.254 3.675 . 0 0 "[ . 1 . 2]" 1
400 1 51 ARG HA 1 55 VAL H 3.400 . 4.800 4.427 3.798 4.808 0.008 7 0 "[ . 1 . 2]" 1
401 1 51 ARG HB2 1 52 LEU H 2.600 . 3.400 3.065 2.598 4.172 0.772 5 2 "[ + 1 .- 2]" 1
402 1 51 ARG HG2 1 52 LEU H 3.400 . 4.800 4.532 3.548 4.855 0.055 15 0 "[ . 1 . 2]" 1
403 1 52 LEU H 1 52 LEU HA 2.700 . 3.600 2.821 2.769 2.864 . 0 0 "[ . 1 . 2]" 1
404 1 52 LEU H 1 52 LEU HB2 2.600 . 3.400 2.249 2.050 3.464 0.064 14 0 "[ . 1 . 2]" 1
405 1 52 LEU H 1 52 LEU HB3 2.500 . 3.300 3.036 2.155 3.405 0.105 13 0 "[ . 1 . 2]" 1
406 1 52 LEU H 1 52 LEU QD 2.700 . 3.600 3.130 2.351 3.464 . 0 0 "[ . 1 . 2]" 1
407 1 52 LEU H 1 52 LEU HG 3.500 . 5.000 4.116 3.128 4.625 . 0 0 "[ . 1 . 2]" 1
408 1 52 LEU H 1 54 ARG H 4.200 . 5.500 4.079 3.666 4.716 . 0 0 "[ . 1 . 2]" 1
409 1 52 LEU HA 1 55 VAL H 3.000 . 4.100 3.709 3.431 4.115 0.015 17 0 "[ . 1 . 2]" 1
410 1 52 LEU HB3 1 53 PHE H 3.800 . 5.500 3.015 2.385 3.895 . 0 0 "[ . 1 . 2]" 1
411 1 52 LEU QD 1 55 VAL H 2.800 . 5.500 4.684 3.926 5.200 . 0 0 "[ . 1 . 2]" 1
412 1 52 LEU QD 1 56 LYS H 3.800 . 5.500 3.786 3.062 5.147 . 0 0 "[ . 1 . 2]" 1
413 1 53 PHE H 1 53 PHE HB3 3.500 . 5.000 3.010 2.643 3.556 . 0 0 "[ . 1 . 2]" 1
414 1 53 PHE H 1 54 ARG H 3.700 . 5.400 2.565 2.462 2.750 . 0 0 "[ . 1 . 2]" 1
415 1 53 PHE HA 1 54 ARG H 3.000 . 4.100 3.489 3.387 3.564 . 0 0 "[ . 1 . 2]" 1
416 1 53 PHE HA 1 56 LYS H 3.400 . 4.800 3.853 3.558 4.347 . 0 0 "[ . 1 . 2]" 1
417 1 53 PHE HA 1 57 GLY H 3.300 . 4.700 3.185 2.072 4.403 . 0 0 "[ . 1 . 2]" 1
418 1 53 PHE HB2 1 54 ARG H 3.000 . 4.100 3.566 3.042 3.953 . 0 0 "[ . 1 . 2]" 1
419 1 53 PHE HB3 1 54 ARG H 2.800 . 3.800 2.987 2.336 3.956 0.156 17 0 "[ . 1 . 2]" 1
420 1 53 PHE QD 1 54 ARG H 3.600 . 5.200 4.430 3.842 4.821 . 0 0 "[ . 1 . 2]" 1
421 1 54 ARG H 1 54 ARG HA 2.600 . 3.400 2.828 2.762 2.863 . 0 0 "[ . 1 . 2]" 1
422 1 54 ARG H 1 54 ARG HB2 2.200 . 2.800 2.609 2.218 3.455 0.655 20 1 "[ . 1 . +]" 1
423 1 54 ARG H 1 54 ARG HB3 3.400 . 4.800 3.353 2.084 3.597 . 0 0 "[ . 1 . 2]" 1
424 1 54 ARG H 1 54 ARG HG2 3.000 . 4.100 2.740 1.807 4.020 0.093 2 0 "[ . 1 . 2]" 1
425 1 54 ARG H 1 54 ARG HG3 2.800 . 3.800 3.164 2.390 4.116 0.316 11 0 "[ . 1 . 2]" 1
426 1 54 ARG H 1 55 VAL H 2.600 . 3.400 2.715 2.530 2.902 . 0 0 "[ . 1 . 2]" 1
427 1 54 ARG HA 1 55 VAL H 3.200 . 4.500 3.553 3.515 3.573 . 0 0 "[ . 1 . 2]" 1
428 1 54 ARG HB2 1 55 VAL H 2.600 . 3.400 2.701 2.179 4.129 0.729 11 3 "[ . -1+ . *]" 1
429 1 54 ARG HB2 1 56 LYS H 3.500 . 5.500 5.170 4.530 6.161 0.661 11 2 "[ . -1+ . 2]" 1
430 1 54 ARG HG3 1 55 VAL H 3.200 . 4.500 4.216 2.428 4.738 0.238 10 0 "[ . 1 . 2]" 1
431 1 55 VAL H 1 55 VAL HA 2.600 . 3.400 2.846 2.808 2.863 . 0 0 "[ . 1 . 2]" 1
432 1 55 VAL H 1 55 VAL HB 2.500 . 3.300 2.403 2.127 2.565 . 0 0 "[ . 1 . 2]" 1
433 1 55 VAL H 1 55 VAL MG1 2.900 . 4.000 3.710 3.134 3.778 . 0 0 "[ . 1 . 2]" 1
434 1 55 VAL H 1 55 VAL MG2 2.400 . 3.100 2.443 2.042 3.425 0.325 17 0 "[ . 1 . 2]" 1
435 1 55 VAL H 1 56 LYS H 2.700 . 3.600 2.660 2.522 2.798 . 0 0 "[ . 1 . 2]" 1
436 1 55 VAL H 1 57 GLY H 3.400 . 4.800 4.237 3.687 4.812 0.012 5 0 "[ . 1 . 2]" 1
437 1 55 VAL HB 1 56 LYS H 2.500 . 3.300 2.554 2.294 3.318 0.018 17 0 "[ . 1 . 2]" 1
438 1 55 VAL HB 1 57 GLY H 4.100 . 5.500 4.987 4.540 5.428 . 0 0 "[ . 1 . 2]" 1
439 1 55 VAL MG1 1 57 GLY H 3.600 . 5.200 4.862 4.098 5.227 0.027 16 0 "[ . 1 . 2]" 1
440 1 55 VAL MG1 1 141 ALA MB 3.200 . 4.000 3.838 3.330 4.020 0.020 16 0 "[ . 1 . 2]" 1
441 1 55 VAL MG1 1 143 ILE MD 3.200 . 4.000 2.981 1.788 3.997 0.012 20 0 "[ . 1 . 2]" 1
442 1 55 VAL MG1 1 147 PRO QB 4.000 . 5.000 4.794 4.027 5.014 0.014 4 0 "[ . 1 . 2]" 1
443 1 55 VAL MG1 1 147 PRO QG 4.000 . 5.000 4.586 3.870 5.007 0.007 17 0 "[ . 1 . 2]" 1
444 1 55 VAL MG2 1 56 LYS H 2.900 . 4.000 3.899 3.752 4.217 0.217 17 0 "[ . 1 . 2]" 1
445 1 55 VAL MG2 1 141 ALA MB 3.200 . 4.000 3.614 2.884 4.008 0.008 12 0 "[ . 1 . 2]" 1
446 1 55 VAL MG2 1 143 ILE MD 3.200 . 4.000 2.992 1.925 4.030 0.030 8 0 "[ . 1 . 2]" 1
447 1 55 VAL MG2 1 147 PRO QB 4.000 . 5.000 4.814 3.754 5.034 0.034 20 0 "[ . 1 . 2]" 1
448 1 55 VAL MG2 1 147 PRO QG 4.000 . 5.000 4.821 3.726 5.028 0.028 19 0 "[ . 1 . 2]" 1
449 1 56 LYS H 1 56 LYS HA 3.000 . 4.100 2.884 2.867 2.917 . 0 0 "[ . 1 . 2]" 1
450 1 56 LYS H 1 56 LYS HB2 2.600 . 3.400 2.312 2.108 3.613 0.213 8 0 "[ . 1 . 2]" 1
451 1 56 LYS H 1 56 LYS HB3 2.900 . 4.000 3.285 2.483 3.611 . 0 0 "[ . 1 . 2]" 1
452 1 56 LYS H 1 56 LYS QD 3.700 . 5.400 4.101 3.110 4.655 . 0 0 "[ . 1 . 2]" 1
453 1 56 LYS H 1 56 LYS QG 3.100 . 4.300 3.286 2.445 4.017 . 0 0 "[ . 1 . 2]" 1
454 1 56 LYS HA 1 57 GLY H 3.200 . 4.500 3.439 3.219 3.571 . 0 0 "[ . 1 . 2]" 1
455 1 56 LYS HB2 1 57 GLY H 3.200 . 4.500 3.143 1.897 4.464 0.003 7 0 "[ . 1 . 2]" 1
456 1 56 LYS HB3 1 57 GLY H 3.200 . 4.500 3.138 1.945 4.366 . 0 0 "[ . 1 . 2]" 1
457 1 56 LYS QD 1 57 GLY H 4.000 . 5.500 4.768 4.018 5.506 0.006 17 0 "[ . 1 . 2]" 1
458 1 56 LYS QG 1 57 GLY H 3.700 . 5.400 4.165 3.013 4.790 . 0 0 "[ . 1 . 2]" 1
459 1 57 GLY H 1 57 GLY HA2 2.600 . 3.400 2.297 2.295 2.300 . 0 0 "[ . 1 . 2]" 1
460 1 57 GLY H 1 57 GLY HA3 2.900 . 4.000 2.815 2.782 2.834 . 0 0 "[ . 1 . 2]" 1
461 1 63 PRO HA 1 64 VAL H 3.300 . 4.700 2.392 2.222 2.703 . 0 0 "[ . 1 . 2]" 1
462 1 63 PRO HA 1 116 ARG H 3.200 . 5.500 5.479 5.128 5.522 0.022 15 0 "[ . 1 . 2]" 1
463 1 63 PRO HB2 1 64 VAL H 2.800 . 3.800 2.956 2.384 3.644 . 0 0 "[ . 1 . 2]" 1
464 1 63 PRO HB3 1 64 VAL H 3.200 . 4.500 3.139 2.540 3.604 . 0 0 "[ . 1 . 2]" 1
465 1 63 PRO HG2 1 64 VAL H 3.400 . 4.800 4.839 4.273 5.430 0.630 19 3 "[ * . - 1 . +2]" 1
466 1 64 VAL H 1 64 VAL HA 2.800 . 3.800 2.948 2.946 2.949 . 0 0 "[ . 1 . 2]" 1
467 1 64 VAL H 1 64 VAL HB 3.000 . 4.100 3.358 2.737 3.811 . 0 0 "[ . 1 . 2]" 1
468 1 64 VAL H 1 64 VAL QG 2.500 . 3.300 2.145 1.902 2.463 . 0 0 "[ . 1 . 2]" 1
469 1 64 VAL H 1 65 SER H 3.600 . 5.200 4.499 4.426 4.520 . 0 0 "[ . 1 . 2]" 1
470 1 64 VAL H 1 117 VAL HA 4.000 . 5.000 3.780 3.492 4.182 . 0 0 "[ . 1 . 2]" 1
471 1 64 VAL HA 1 65 SER H 2.400 . 3.100 2.311 2.183 2.481 . 0 0 "[ . 1 . 2]" 1
472 1 64 VAL HB 1 65 SER H 2.700 . 5.500 3.281 2.349 4.130 . 0 0 "[ . 1 . 2]" 1
473 1 64 VAL QG 1 65 SER H 3.200 . 4.300 2.579 1.884 3.247 0.016 14 0 "[ . 1 . 2]" 1
474 1 64 VAL QG 1 110 ILE H 3.500 . 5.000 4.433 4.174 4.916 . 0 0 "[ . 1 . 2]" 1
475 1 64 VAL QG 1 110 ILE HA 2.600 . 3.000 2.191 1.801 2.699 . 0 0 "[ . 1 . 2]" 1
476 1 64 VAL QG 1 110 ILE MG 2.600 . 3.000 2.062 1.615 2.716 0.185 18 0 "[ . 1 . 2]" 1
477 1 64 VAL QG 1 112 GLY H 4.300 . 5.500 4.520 3.812 5.295 . 0 0 "[ . 1 . 2]" 1
478 1 64 VAL QG 1 138 ALA H 3.400 . 4.800 4.078 3.388 4.722 . 0 0 "[ . 1 . 2]" 1
479 1 65 SER H 1 65 SER HA 3.000 . 4.100 2.929 2.916 2.946 . 0 0 "[ . 1 . 2]" 1
480 1 65 SER H 1 65 SER HB2 3.200 . 4.500 2.864 2.255 3.445 . 0 0 "[ . 1 . 2]" 1
481 1 65 SER H 1 65 SER HB3 3.000 . 4.100 3.065 2.366 3.702 . 0 0 "[ . 1 . 2]" 1
482 1 65 SER H 1 139 THR HB 3.900 . 5.500 4.662 3.983 5.422 . 0 0 "[ . 1 . 2]" 1
483 1 65 SER H 1 139 THR MG 3.600 . 5.200 4.762 4.100 5.207 0.007 19 0 "[ . 1 . 2]" 1
484 1 65 SER HA 1 66 ILE H 2.600 . 3.400 2.199 2.151 2.267 . 0 0 "[ . 1 . 2]" 1
485 1 65 SER HA 1 118 GLY H 3.400 . 4.800 2.752 2.314 3.260 . 0 0 "[ . 1 . 2]" 1
486 1 65 SER HB2 1 66 ILE H 3.000 . 4.100 3.916 3.260 4.402 0.302 15 0 "[ . 1 . 2]" 1
487 1 65 SER HB3 1 66 ILE H 3.200 . 4.500 3.655 2.851 4.319 . 0 0 "[ . 1 . 2]" 1
488 1 66 ILE H 1 66 ILE HB 3.000 . 4.100 3.450 2.702 3.813 . 0 0 "[ . 1 . 2]" 1
489 1 66 ILE H 1 66 ILE MD 3.500 . 5.000 3.669 3.197 4.129 . 0 0 "[ . 1 . 2]" 1
490 1 66 ILE H 1 66 ILE MG 3.000 . 4.100 3.212 2.580 3.901 . 0 0 "[ . 1 . 2]" 1
491 1 66 ILE H 1 67 CYS H 3.900 . 5.500 4.490 4.463 4.527 . 0 0 "[ . 1 . 2]" 1
492 1 66 ILE H 1 117 VAL MG1 3.200 . 4.500 3.507 2.818 4.049 . 0 0 "[ . 1 . 2]" 1
493 1 66 ILE H 1 118 GLY H 3.200 . 4.000 4.033 4.006 4.056 0.056 11 0 "[ . 1 . 2]" 1
494 1 66 ILE H 1 119 ILE HA 3.000 . 4.100 2.495 2.331 2.926 . 0 0 "[ . 1 . 2]" 1
495 1 66 ILE H 1 119 ILE HB 3.600 . 5.200 5.228 5.178 5.292 0.092 11 0 "[ . 1 . 2]" 1
496 1 66 ILE H 1 119 ILE QG 3.400 . 4.800 3.641 2.893 4.629 . 0 0 "[ . 1 . 2]" 1
497 1 66 ILE H 1 120 ARG H 4.000 . 5.000 4.326 4.116 4.875 . 0 0 "[ . 1 . 2]" 1
498 1 66 ILE H 1 138 ALA H 4.400 . 5.500 4.648 4.213 5.059 . 0 0 "[ . 1 . 2]" 1
499 1 66 ILE H 1 138 ALA MB 2.700 . 5.500 3.915 3.438 4.379 . 0 0 "[ . 1 . 2]" 1
500 1 66 ILE HA 1 67 CYS H 2.500 . 3.300 2.434 2.266 2.523 . 0 0 "[ . 1 . 2]" 1
501 1 66 ILE HA 1 136 VAL H 4.000 . 5.000 4.973 4.713 5.039 0.039 2 0 "[ . 1 . 2]" 1
502 1 66 ILE HA 1 137 THR HA 2.600 . 3.000 2.719 2.419 3.021 0.021 12 0 "[ . 1 . 2]" 1
503 1 66 ILE HB 1 67 CYS H 3.400 . 4.800 2.611 2.087 3.666 . 0 0 "[ . 1 . 2]" 1
504 1 66 ILE HB 1 120 ARG H 4.000 . 5.500 5.212 4.292 5.517 0.017 7 0 "[ . 1 . 2]" 1
505 1 66 ILE MD 1 67 CYS H 4.000 . 5.500 3.709 2.776 4.627 . 0 0 "[ . 1 . 2]" 1
506 1 66 ILE MD 1 136 VAL H 4.100 . 5.500 4.354 3.123 5.306 . 0 0 "[ . 1 . 2]" 1
507 1 66 ILE MG 1 67 CYS H 3.100 . 4.300 3.059 1.908 3.799 . 0 0 "[ . 1 . 2]" 1
508 1 66 ILE MG 1 138 ALA H 3.100 . 4.300 3.759 3.114 4.319 0.019 20 0 "[ . 1 . 2]" 1
509 1 67 CYS H 1 67 CYS HB2 3.000 . 4.100 3.049 2.381 3.810 . 0 0 "[ . 1 . 2]" 1
510 1 67 CYS H 1 67 CYS HB3 3.100 . 4.300 2.815 2.465 3.525 . 0 0 "[ . 1 . 2]" 1
511 1 67 CYS H 1 68 VAL H 3.700 . 5.400 4.366 4.218 4.440 . 0 0 "[ . 1 . 2]" 1
512 1 67 CYS H 1 119 ILE HA 3.900 . 5.500 4.981 4.797 5.376 . 0 0 "[ . 1 . 2]" 1
513 1 67 CYS H 1 135 PRO HB3 3.500 . 5.000 5.356 4.385 5.926 0.926 19 9 "[-***** * 1 *. +2]" 1
514 1 67 CYS H 1 136 VAL H 3.000 . 4.100 3.077 2.906 3.300 . 0 0 "[ . 1 . 2]" 1
515 1 67 CYS H 1 136 VAL MG2 3.300 . 4.700 4.297 2.484 4.709 0.009 15 0 "[ . 1 . 2]" 1
516 1 67 CYS H 1 137 THR HA 4.000 . 5.000 3.771 3.665 3.949 . 0 0 "[ . 1 . 2]" 1
517 1 67 CYS H 1 138 ALA H 3.500 . 5.000 4.037 3.673 4.502 . 0 0 "[ . 1 . 2]" 1
518 1 67 CYS H 1 138 ALA MB 3.000 . 4.100 3.006 2.610 3.447 . 0 0 "[ . 1 . 2]" 1
519 1 67 CYS HA 1 68 VAL H 2.300 . 3.000 2.167 2.131 2.226 . 0 0 "[ . 1 . 2]" 1
520 1 67 CYS HA 1 120 ARG H 3.000 . 4.100 2.668 2.380 3.083 . 0 0 "[ . 1 . 2]" 1
521 1 67 CYS HB2 1 68 VAL H 3.600 . 5.200 4.090 3.182 4.543 . 0 0 "[ . 1 . 2]" 1
522 1 67 CYS HB3 1 68 VAL H 3.400 . 4.800 4.030 3.291 4.420 . 0 0 "[ . 1 . 2]" 1
523 1 67 CYS HB3 1 136 VAL H 3.600 . 5.200 4.043 3.177 5.633 0.433 8 0 "[ . 1 . 2]" 1
524 1 68 VAL H 1 68 VAL HA 3.000 . 4.100 2.926 2.903 2.937 . 0 0 "[ . 1 . 2]" 1
525 1 68 VAL H 1 68 VAL HB 3.200 . 4.500 3.027 2.952 3.124 . 0 0 "[ . 1 . 2]" 1
526 1 68 VAL H 1 68 VAL MG1 3.000 . 4.100 2.599 2.492 2.705 . 0 0 "[ . 1 . 2]" 1
527 1 68 VAL H 1 68 VAL MG2 2.900 . 4.000 3.989 3.967 4.019 0.019 1 0 "[ . 1 . 2]" 1
528 1 68 VAL H 1 69 SER H 4.000 . 5.500 4.404 4.379 4.441 . 0 0 "[ . 1 . 2]" 1
529 1 68 VAL H 1 120 ARG H 3.200 . 4.000 3.372 2.896 3.716 . 0 0 "[ . 1 . 2]" 1
530 1 68 VAL H 1 121 VAL HA 3.600 . 5.200 3.631 3.367 3.939 . 0 0 "[ . 1 . 2]" 1
531 1 68 VAL H 1 131 ALA MB 3.600 . 5.200 3.531 3.263 3.837 . 0 0 "[ . 1 . 2]" 1
532 1 68 VAL HA 1 69 SER H 2.500 . 3.300 2.591 2.502 2.687 . 0 0 "[ . 1 . 2]" 1
533 1 68 VAL HA 1 70 CYS H 3.400 . 4.800 4.601 4.329 4.833 0.033 5 0 "[ . 1 . 2]" 1
534 1 68 VAL HA 1 135 PRO HA 3.200 . 4.000 4.045 4.022 4.080 0.080 18 0 "[ . 1 . 2]" 1
535 1 68 VAL MG1 1 69 SER H 3.000 . 5.500 2.575 2.287 2.841 . 0 0 "[ . 1 . 2]" 1
536 1 68 VAL MG1 1 70 CYS H 2.700 . 3.600 2.042 1.835 2.334 . 0 0 "[ . 1 . 2]" 1
537 1 68 VAL MG1 1 73 GLU H 2.900 . 4.000 3.929 3.663 4.028 0.028 19 0 "[ . 1 . 2]" 1
538 1 68 VAL MG2 1 69 SER H 3.100 . 4.300 1.899 1.876 1.964 0.024 4 0 "[ . 1 . 2]" 1
539 1 68 VAL MG2 1 131 ALA H 3.400 . 5.500 5.405 5.045 5.538 0.038 5 0 "[ . 1 . 2]" 1
540 1 68 VAL MG2 1 131 ALA MB 2.600 . 3.000 2.952 2.580 3.034 0.034 7 0 "[ . 1 . 2]" 1
541 1 68 VAL MG2 1 132 ALA H 3.000 . 5.500 4.223 3.955 4.521 . 0 0 "[ . 1 . 2]" 1
542 1 69 SER H 1 69 SER HA 2.900 . 4.000 2.902 2.858 2.919 . 0 0 "[ . 1 . 2]" 1
543 1 69 SER H 1 69 SER HB2 2.900 . 4.000 2.887 2.220 3.363 . 0 0 "[ . 1 . 2]" 1
544 1 69 SER H 1 69 SER HB3 2.800 . 3.800 2.500 2.098 3.430 . 0 0 "[ . 1 . 2]" 1
545 1 69 SER H 1 70 CYS H 2.800 . 3.800 2.344 2.177 2.593 . 0 0 "[ . 1 . 2]" 1
546 1 69 SER H 1 73 GLU H 4.000 . 5.000 5.040 5.020 5.059 0.059 6 0 "[ . 1 . 2]" 1
547 1 69 SER H 1 131 ALA MB 2.900 . 4.000 3.136 2.942 3.320 . 0 0 "[ . 1 . 2]" 1
548 1 69 SER HA 1 70 CYS H 3.200 . 4.500 3.532 3.494 3.565 . 0 0 "[ . 1 . 2]" 1
549 1 69 SER HA 1 128 ARG HA 2.600 . 3.000 2.997 2.536 3.050 0.050 2 0 "[ . 1 . 2]" 1
550 1 69 SER HB2 1 70 CYS H 3.400 . 4.800 3.833 2.979 4.145 . 0 0 "[ . 1 . 2]" 1
551 1 69 SER HB2 1 132 ALA H 3.900 . 5.500 3.385 2.957 5.154 . 0 0 "[ . 1 . 2]" 1
552 1 69 SER HB3 1 70 CYS H 3.300 . 4.700 2.802 2.443 4.124 . 0 0 "[ . 1 . 2]" 1
553 1 70 CYS H 1 70 CYS HA 2.800 . 3.800 2.857 2.850 2.865 . 0 0 "[ . 1 . 2]" 1
554 1 70 CYS H 1 70 CYS HB2 3.400 . 4.800 3.083 2.894 3.344 . 0 0 "[ . 1 . 2]" 1
555 1 70 CYS H 1 70 CYS HB3 3.200 . 4.500 3.439 3.133 3.774 . 0 0 "[ . 1 . 2]" 1
556 1 70 CYS H 1 71 VAL H 3.600 . 5.200 4.363 4.335 4.379 . 0 0 "[ . 1 . 2]" 1
557 1 70 CYS H 1 73 GLU H 3.200 . 4.000 3.287 3.030 3.454 . 0 0 "[ . 1 . 2]" 1
558 1 70 CYS H 1 121 VAL QG 3.400 . 4.800 3.959 3.496 4.664 . 0 0 "[ . 1 . 2]" 1
559 1 70 CYS H 1 131 ALA MB 3.600 . 5.200 5.105 4.918 5.222 0.022 16 0 "[ . 1 . 2]" 1
560 1 70 CYS HA 1 71 VAL H 2.500 . 3.300 2.475 2.378 2.564 . 0 0 "[ . 1 . 2]" 1
561 1 70 CYS HA 1 72 ASP H 3.400 . 4.800 4.289 4.054 4.505 . 0 0 "[ . 1 . 2]" 1
562 1 70 CYS HB2 1 71 VAL H 2.800 . 3.800 3.892 3.621 4.009 0.209 12 0 "[ . 1 . 2]" 1
563 1 70 CYS HB2 1 72 ASP H 2.900 . 4.000 4.069 3.650 4.369 0.369 10 0 "[ . 1 . 2]" 1
564 1 70 CYS HB3 1 71 VAL H 3.000 . 4.100 2.830 2.116 3.501 . 0 0 "[ . 1 . 2]" 1
565 1 70 CYS HB3 1 72 ASP H 3.300 . 4.700 2.447 2.160 2.892 . 0 0 "[ . 1 . 2]" 1
566 1 71 VAL H 1 71 VAL HA 2.900 . 4.000 2.789 2.759 2.800 . 0 0 "[ . 1 . 2]" 1
567 1 71 VAL H 1 71 VAL HB 2.500 . 3.300 2.731 2.624 2.829 . 0 0 "[ . 1 . 2]" 1
568 1 71 VAL H 1 71 VAL MG1 3.100 . 4.300 3.749 3.725 3.762 . 0 0 "[ . 1 . 2]" 1
569 1 71 VAL H 1 71 VAL MG2 2.600 . 3.400 1.934 1.791 2.138 0.009 15 0 "[ . 1 . 2]" 1
570 1 71 VAL H 1 73 GLU H 4.200 . 5.500 4.120 3.994 4.673 . 0 0 "[ . 1 . 2]" 1
571 1 71 VAL H 1 121 VAL QG 3.800 . 5.500 4.168 3.238 4.988 . 0 0 "[ . 1 . 2]" 1
572 1 71 VAL HA 1 72 ASP H 3.000 . 4.100 3.500 3.438 3.531 . 0 0 "[ . 1 . 2]" 1
573 1 71 VAL HA 1 73 GLU H 3.400 . 4.800 4.016 3.870 4.606 . 0 0 "[ . 1 . 2]" 1
574 1 71 VAL HB 1 72 ASP H 2.500 . 3.300 2.788 2.633 3.083 . 0 0 "[ . 1 . 2]" 1
575 1 71 VAL MG1 1 72 ASP H 2.900 . 4.000 3.807 3.548 3.971 . 0 0 "[ . 1 . 2]" 1
576 1 71 VAL MG2 1 72 ASP H 3.000 . 4.100 3.711 3.571 3.841 . 0 0 "[ . 1 . 2]" 1
577 1 71 VAL MG2 1 89 GLU H 3.700 . 5.400 4.744 3.398 5.419 0.019 2 0 "[ . 1 . 2]" 1
578 1 72 ASP H 1 72 ASP HA 2.500 . 3.300 2.833 2.829 2.851 . 0 0 "[ . 1 . 2]" 1
579 1 72 ASP H 1 72 ASP HB2 2.300 . 3.000 2.451 2.072 3.560 0.560 5 2 "[ + -1 . 2]" 1
580 1 72 ASP H 1 73 GLU H 2.600 . 3.400 2.568 2.529 2.667 . 0 0 "[ . 1 . 2]" 1
581 1 72 ASP QB 1 73 GLU H 2.800 . 3.800 2.940 2.353 3.512 . 0 0 "[ . 1 . 2]" 1
582 1 73 GLU H 1 73 GLU HA 2.500 . 3.300 2.871 2.843 2.889 . 0 0 "[ . 1 . 2]" 1
583 1 73 GLU H 1 73 GLU HB2 2.500 . 5.500 2.376 2.124 2.722 . 0 0 "[ . 1 . 2]" 1
584 1 73 GLU H 1 73 GLU HB3 2.600 . 3.400 3.523 3.040 3.621 0.221 13 0 "[ . 1 . 2]" 1
585 1 73 GLU H 1 73 GLU HG2 2.500 . 5.500 3.127 1.956 4.583 . 0 0 "[ . 1 . 2]" 1
586 1 74 ILE MD 1 79 ARG H 3.800 . 5.500 5.349 4.990 5.532 0.032 12 0 "[ . 1 . 2]" 1
587 1 74 ILE MD 1 119 ILE MD 2.600 . 3.000 2.088 1.820 2.989 . 0 0 "[ . 1 . 2]" 1
588 1 74 ILE MD 1 119 ILE MG 2.600 . 3.000 2.646 1.941 3.005 0.005 17 0 "[ . 1 . 2]" 1
589 1 74 ILE MG 1 119 ILE MD 2.600 . 3.000 2.816 1.813 3.027 0.027 18 0 "[ . 1 . 2]" 1
590 1 74 ILE MG 1 119 ILE MG 2.600 . 3.000 2.904 1.912 3.053 0.053 15 0 "[ . 1 . 2]" 1
591 1 77 PHE QD 1 135 PRO QB 2.600 . 3.000 2.966 2.746 3.054 0.054 20 0 "[ . 1 . 2]" 1
592 1 77 PHE QD 1 135 PRO QG 2.600 . 3.000 2.744 2.047 3.040 0.040 20 0 "[ . 1 . 2]" 1
593 1 77 PHE QE 1 135 PRO QB 2.600 . 3.000 2.599 1.980 2.997 . 0 0 "[ . 1 . 2]" 1
594 1 77 PHE QE 1 135 PRO QG 2.600 . 3.000 2.202 1.783 2.939 0.017 1 0 "[ . 1 . 2]" 1
595 1 78 SER H 1 79 ARG H 3.800 . 5.500 4.435 4.386 4.494 . 0 0 "[ . 1 . 2]" 1
596 1 78 SER HA 1 79 ARG H 2.400 . 3.100 2.535 2.351 2.671 . 0 0 "[ . 1 . 2]" 1
597 1 78 SER HA 1 102 ARG HA 2.600 . 3.000 2.822 2.380 3.021 0.021 4 0 "[ . 1 . 2]" 1
598 1 78 SER QB 1 101 GLU H 3.600 . 5.500 4.314 3.469 5.479 . 0 0 "[ . 1 . 2]" 1
599 1 78 SER QB 1 103 ASN H 3.300 . 4.700 4.619 4.164 4.741 0.041 10 0 "[ . 1 . 2]" 1
600 1 78 SER HB2 1 79 ARG H 2.300 . 5.500 2.590 1.932 3.852 . 0 0 "[ . 1 . 2]" 1
601 1 79 ARG H 1 79 ARG HB2 2.500 . 3.300 2.745 2.362 3.663 0.363 4 0 "[ . 1 . 2]" 1
602 1 79 ARG H 1 79 ARG HG2 3.000 . 4.100 3.981 1.935 4.732 0.632 16 4 "[ * . * .+ -]" 1
603 1 79 ARG H 1 100 LEU HB3 3.300 . 4.700 3.654 2.768 4.909 0.209 6 0 "[ . 1 . 2]" 1
604 1 79 ARG H 1 103 ASN H 3.600 . 5.200 4.336 3.624 4.844 . 0 0 "[ . 1 . 2]" 1
605 1 79 ARG H 1 103 ASN QB 3.400 . 5.500 4.684 3.993 5.349 . 0 0 "[ . 1 . 2]" 1
606 1 79 ARG H 1 119 ILE MD 3.500 . 5.000 4.804 3.979 5.027 0.027 18 0 "[ . 1 . 2]" 1
607 1 80 PRO HA 1 81 SER H 3.000 . 4.100 2.579 2.426 2.722 . 0 0 "[ . 1 . 2]" 1
608 1 80 PRO HB2 1 81 SER H 2.500 . 5.500 2.183 1.898 2.462 . 0 0 "[ . 1 . 2]" 1
609 1 80 PRO QG 1 81 SER H 2.900 . 4.000 3.780 3.498 4.010 0.010 10 0 "[ . 1 . 2]" 1
610 1 81 SER H 1 81 SER HB2 2.800 . 3.800 2.917 2.594 3.354 . 0 0 "[ . 1 . 2]" 1
611 1 81 SER H 1 85 MET H 3.700 . 5.400 3.533 3.356 3.864 . 0 0 "[ . 1 . 2]" 1
612 1 81 SER H 1 100 LEU QD 3.100 . 4.300 3.541 2.942 4.143 . 0 0 "[ . 1 . 2]" 1
613 1 82 GLY HA2 1 83 ASP H 3.300 . 4.700 3.504 3.339 3.566 . 0 0 "[ . 1 . 2]" 1
614 1 82 GLY HA2 1 84 ALA H 4.000 . 5.500 4.349 4.233 4.500 . 0 0 "[ . 1 . 2]" 1
615 1 82 GLY HA2 1 85 MET H 3.400 . 4.800 3.982 3.670 4.395 . 0 0 "[ . 1 . 2]" 1
616 1 82 GLY HA3 1 84 ALA H 3.800 . 5.500 4.084 3.704 4.575 . 0 0 "[ . 1 . 2]" 1
617 1 82 GLY HA3 1 85 MET H 3.200 . 4.500 4.804 4.576 4.846 0.346 1 0 "[ . 1 . 2]" 1
618 1 83 ASP H 1 83 ASP HB2 2.700 . 3.600 2.759 2.063 3.542 . 0 0 "[ . 1 . 2]" 1
619 1 83 ASP H 1 83 ASP HB3 3.100 . 4.300 3.255 2.851 3.550 . 0 0 "[ . 1 . 2]" 1
620 1 83 ASP HA 1 84 ALA H 3.000 . 4.100 3.481 3.457 3.531 . 0 0 "[ . 1 . 2]" 1
621 1 83 ASP HA 1 86 GLU H 3.000 . 4.100 3.288 3.192 3.578 . 0 0 "[ . 1 . 2]" 1
622 1 83 ASP HA 1 87 LEU H 3.600 . 5.200 4.513 4.186 4.820 . 0 0 "[ . 1 . 2]" 1
623 1 83 ASP HB2 1 84 ALA H 2.800 . 5.500 3.285 2.922 3.780 . 0 0 "[ . 1 . 2]" 1
624 1 83 ASP HB3 1 84 ALA H 3.000 . 4.100 3.789 3.026 4.305 0.205 11 0 "[ . 1 . 2]" 1
625 1 83 ASP HB3 1 85 MET H 3.000 . 5.500 5.829 5.254 6.217 0.717 5 9 "[ ** + * 1* *-* * 2]" 1
626 1 83 ASP HB3 1 86 GLU H 3.300 . 5.500 5.154 4.958 5.512 0.012 4 0 "[ . 1 . 2]" 1
627 1 83 ASP HB3 1 87 LEU H 4.300 . 5.500 5.564 4.962 6.468 0.968 4 5 "[ -+* 1 * * 2]" 1
628 1 84 ALA H 1 84 ALA HA 2.600 . 3.400 2.806 2.788 2.826 . 0 0 "[ . 1 . 2]" 1
629 1 84 ALA H 1 84 ALA MB 2.300 . 3.000 2.184 2.039 2.236 . 0 0 "[ . 1 . 2]" 1
630 1 84 ALA H 1 86 GLU H 3.900 . 5.500 3.798 3.657 3.977 . 0 0 "[ . 1 . 2]" 1
631 1 84 ALA H 1 87 LEU H 3.800 . 5.500 5.196 4.909 5.387 . 0 0 "[ . 1 . 2]" 1
632 1 84 ALA HA 1 85 MET H 3.000 . 4.100 3.555 3.519 3.575 . 0 0 "[ . 1 . 2]" 1
633 1 84 ALA HA 1 86 GLU H 3.300 . 4.700 3.992 3.766 4.235 . 0 0 "[ . 1 . 2]" 1
634 1 84 ALA MB 1 85 MET H 2.500 . 3.300 2.428 2.314 2.637 . 0 0 "[ . 1 . 2]" 1
635 1 84 ALA MB 1 86 GLU H 3.500 . 5.000 4.177 4.034 4.337 . 0 0 "[ . 1 . 2]" 1
636 1 84 ALA MB 1 87 LEU H 3.500 . 5.000 4.917 4.685 5.016 0.016 17 0 "[ . 1 . 2]" 1
637 1 84 ALA MB 1 88 MET H 3.600 . 5.200 5.180 5.080 5.232 0.032 16 0 "[ . 1 . 2]" 1
638 1 84 ALA MB 1 184 VAL QG 2.600 . 3.000 3.010 2.975 3.085 0.085 16 0 "[ . 1 . 2]" 1
639 1 85 MET H 1 85 MET HA 2.700 . 3.600 2.849 2.833 2.862 . 0 0 "[ . 1 . 2]" 1
640 1 85 MET H 1 85 MET HB2 2.400 . 3.100 2.300 2.094 3.064 . 0 0 "[ . 1 . 2]" 1
641 1 85 MET H 1 85 MET HB3 2.700 . 3.600 3.447 2.130 3.590 . 0 0 "[ . 1 . 2]" 1
642 1 85 MET H 1 85 MET HG3 2.800 . 3.800 4.095 3.926 4.414 0.614 3 3 "[ + . 1 - . * 2]" 1
643 1 85 MET H 1 86 GLU H 2.600 . 3.400 2.525 2.423 2.567 . 0 0 "[ . 1 . 2]" 1
644 1 85 MET H 1 87 LEU H 3.600 . 5.200 4.554 4.265 4.771 . 0 0 "[ . 1 . 2]" 1
645 1 85 MET HA 1 86 GLU H 3.100 . 4.300 3.406 3.323 3.472 . 0 0 "[ . 1 . 2]" 1
646 1 85 MET HA 1 87 LEU H 4.000 . 5.500 4.385 3.989 4.698 . 0 0 "[ . 1 . 2]" 1
647 1 85 MET HA 1 88 MET H 3.100 . 4.300 3.273 2.953 3.470 . 0 0 "[ . 1 . 2]" 1
648 1 85 MET HA 1 89 GLU H 3.500 . 5.000 3.958 3.629 4.206 . 0 0 "[ . 1 . 2]" 1
649 1 85 MET ME 1 100 LEU QD 2.600 . 3.000 1.891 1.693 2.561 0.107 8 0 "[ . 1 . 2]" 1
650 1 85 MET ME 1 182 LEU QD 2.600 . 3.000 2.126 1.816 2.574 . 0 0 "[ . 1 . 2]" 1
651 1 85 MET QG 1 86 GLU H 3.300 . 4.700 4.538 3.282 4.801 0.101 17 0 "[ . 1 . 2]" 1
652 1 86 GLU H 1 86 GLU HA 2.500 . 3.300 2.831 2.786 2.861 . 0 0 "[ . 1 . 2]" 1
653 1 86 GLU H 1 86 GLU QB 2.100 . 2.700 2.264 2.046 2.486 . 0 0 "[ . 1 . 2]" 1
654 1 86 GLU H 1 86 GLU HG3 2.800 . 3.800 3.268 2.720 4.310 0.510 18 1 "[ . 1 . + 2]" 1
655 1 86 GLU H 1 87 LEU H 2.600 . 3.400 2.663 2.463 2.864 . 0 0 "[ . 1 . 2]" 1
656 1 86 GLU H 1 88 MET H 3.800 . 5.500 3.959 3.768 4.201 . 0 0 "[ . 1 . 2]" 1
657 1 86 GLU HA 1 87 LEU H 3.000 . 4.100 3.548 3.510 3.562 . 0 0 "[ . 1 . 2]" 1
658 1 86 GLU HA 1 88 MET H 3.800 . 5.500 4.367 4.044 4.635 . 0 0 "[ . 1 . 2]" 1
659 1 86 GLU HA 1 89 GLU H 3.000 . 4.100 3.580 3.344 4.077 . 0 0 "[ . 1 . 2]" 1
660 1 86 GLU HA 1 90 ARG H 3.600 . 5.200 4.711 4.426 4.878 . 0 0 "[ . 1 . 2]" 1
661 1 86 GLU QB 1 87 LEU H 2.400 . 3.100 2.495 2.364 2.985 . 0 0 "[ . 1 . 2]" 1
662 1 86 GLU HG2 1 87 LEU H 3.400 . 4.800 4.527 2.736 4.800 0.000 16 0 "[ . 1 . 2]" 1
663 1 86 GLU HG3 1 87 LEU H 3.300 . 4.700 4.445 2.844 4.813 0.113 9 0 "[ . 1 . 2]" 1
664 1 87 LEU H 1 87 LEU HA 2.500 . 3.300 2.810 2.777 2.838 . 0 0 "[ . 1 . 2]" 1
665 1 87 LEU H 1 87 LEU HB3 2.200 . 2.800 2.333 2.118 2.644 . 0 0 "[ . 1 . 2]" 1
666 1 87 LEU H 1 87 LEU MD1 3.700 . 5.400 4.267 4.090 4.392 . 0 0 "[ . 1 . 2]" 1
667 1 87 LEU H 1 87 LEU MD2 2.800 . 5.500 3.969 3.515 4.109 . 0 0 "[ . 1 . 2]" 1
668 1 87 LEU H 1 87 LEU HG 3.300 . 4.700 4.370 4.065 4.592 . 0 0 "[ . 1 . 2]" 1
669 1 87 LEU H 1 88 MET H 2.600 . 3.400 2.661 2.569 2.763 . 0 0 "[ . 1 . 2]" 1
670 1 87 LEU H 1 89 GLU H 3.500 . 5.000 4.275 3.858 4.534 . 0 0 "[ . 1 . 2]" 1
671 1 87 LEU HA 1 88 MET H 2.900 . 4.000 3.525 3.469 3.555 . 0 0 "[ . 1 . 2]" 1
672 1 87 LEU MD1 1 88 MET H 3.300 . 4.700 4.040 3.038 4.725 0.025 9 0 "[ . 1 . 2]" 1
673 1 87 LEU MD1 1 189 VAL MG1 4.000 . 5.000 4.617 2.941 5.022 0.022 3 0 "[ . 1 . 2]" 1
674 1 87 LEU MD1 1 189 VAL MG2 4.000 . 5.000 3.520 2.609 4.229 . 0 0 "[ . 1 . 2]" 1
675 1 87 LEU MD2 1 88 MET H 3.200 . 4.500 3.817 2.464 4.356 . 0 0 "[ . 1 . 2]" 1
676 1 87 LEU MD2 1 189 VAL MG1 4.000 . 5.000 4.821 3.903 5.027 0.027 20 0 "[ . 1 . 2]" 1
677 1 87 LEU MD2 1 189 VAL MG2 4.000 . 5.000 3.498 2.892 5.000 0.000 1 0 "[ . 1 . 2]" 1
678 1 87 LEU HG 1 88 MET H 3.500 . 5.000 3.984 2.987 5.016 0.016 6 0 "[ . 1 . 2]" 1
679 1 88 MET H 1 88 MET HA 2.800 . 3.800 2.834 2.807 2.865 . 0 0 "[ . 1 . 2]" 1
680 1 88 MET H 1 88 MET HB3 2.600 . 3.400 2.735 2.427 3.592 0.192 7 0 "[ . 1 . 2]" 1
681 1 88 MET H 1 88 MET QG 2.600 . 5.500 3.950 2.299 4.082 . 0 0 "[ . 1 . 2]" 1
682 1 88 MET H 1 89 GLU H 2.800 . 3.800 2.662 2.484 2.868 . 0 0 "[ . 1 . 2]" 1
683 1 88 MET H 1 182 LEU QD 3.200 . 4.500 3.001 2.143 3.837 . 0 0 "[ . 1 . 2]" 1
684 1 88 MET HA 1 89 GLU H 3.500 . 5.000 3.541 3.471 3.571 . 0 0 "[ . 1 . 2]" 1
685 1 88 MET HA 1 90 ARG H 3.500 . 5.000 3.748 3.548 4.228 . 0 0 "[ . 1 . 2]" 1
686 1 88 MET HA 1 91 ILE H 3.200 . 4.500 3.780 3.305 4.322 . 0 0 "[ . 1 . 2]" 1
687 1 88 MET HB2 1 89 GLU H 3.100 . 4.300 3.649 2.504 4.068 . 0 0 "[ . 1 . 2]" 1
688 1 88 MET HB3 1 89 GLU H 3.000 . 4.100 2.605 2.202 3.635 . 0 0 "[ . 1 . 2]" 1
689 1 88 MET HB3 1 90 ARG H 2.600 . 5.500 4.680 4.377 5.320 . 0 0 "[ . 1 . 2]" 1
690 1 88 MET ME 1 98 VAL MG1 2.600 . 3.000 2.689 1.842 3.094 0.094 17 0 "[ . 1 . 2]" 1
691 1 88 MET ME 1 98 VAL MG2 2.600 . 3.000 2.338 1.800 3.011 0.011 16 0 "[ . 1 . 2]" 1
692 1 88 MET ME 1 180 ILE MD 2.600 . 3.000 2.558 1.853 3.021 0.021 13 0 "[ . 1 . 2]" 1
693 1 88 MET QG 1 89 GLU H 2.900 . 4.000 3.857 3.392 4.024 0.024 4 0 "[ . 1 . 2]" 1
694 1 89 GLU H 1 89 GLU HA 2.500 . 3.300 2.820 2.775 2.857 . 0 0 "[ . 1 . 2]" 1
695 1 89 GLU H 1 89 GLU QB 2.200 . 2.800 2.289 2.047 2.600 . 0 0 "[ . 1 . 2]" 1
696 1 89 GLU H 1 89 GLU HG2 2.900 . 4.000 3.297 2.569 4.013 0.013 1 0 "[ . 1 . 2]" 1
697 1 89 GLU H 1 89 GLU HG3 2.700 . 3.600 2.895 2.024 3.853 0.253 8 0 "[ . 1 . 2]" 1
698 1 89 GLU H 1 90 ARG H 2.600 . 3.400 2.626 2.494 2.731 . 0 0 "[ . 1 . 2]" 1
699 1 89 GLU H 1 90 ARG HA 4.000 . 5.500 5.131 4.969 5.339 . 0 0 "[ . 1 . 2]" 1
700 1 89 GLU H 1 91 ILE H 3.700 . 5.400 4.556 3.966 5.063 . 0 0 "[ . 1 . 2]" 1
701 1 89 GLU HA 1 90 ARG H 2.500 . 3.300 3.357 3.288 3.494 0.194 20 0 "[ . 1 . 2]" 1
702 1 89 GLU HA 1 91 ILE H 3.700 . 5.400 4.166 3.566 4.811 . 0 0 "[ . 1 . 2]" 1
703 1 89 GLU HA 1 92 LEU H 3.600 . 5.500 4.057 3.466 4.642 . 0 0 "[ . 1 . 2]" 1
704 1 89 GLU QB 1 90 ARG H 2.800 . 3.800 3.409 2.703 3.843 0.043 19 0 "[ . 1 . 2]" 1
705 1 89 GLU HG3 1 90 ARG H 3.500 . 5.000 3.999 2.530 5.414 0.414 8 0 "[ . 1 . 2]" 1
706 1 90 ARG H 1 90 ARG HA 2.600 . 3.400 2.850 2.805 2.865 . 0 0 "[ . 1 . 2]" 1
707 1 90 ARG H 1 90 ARG HB2 2.400 . 3.100 2.505 2.073 3.602 0.502 20 1 "[ . 1 . +]" 1
708 1 90 ARG H 1 90 ARG HG3 2.900 . 4.000 3.754 2.799 4.571 0.571 16 2 "[ -. 1 .+ 2]" 1
709 1 90 ARG HA 1 91 ILE H 3.200 . 4.500 3.514 3.386 3.577 . 0 0 "[ . 1 . 2]" 1
710 1 90 ARG HA 1 92 LEU H 4.200 . 5.500 4.230 3.860 4.874 . 0 0 "[ . 1 . 2]" 1
711 1 90 ARG HB3 1 91 ILE H 2.900 . 4.000 3.130 2.476 4.277 0.277 20 0 "[ . 1 . 2]" 1
712 1 91 ILE H 1 91 ILE HA 3.000 . 4.100 2.944 2.928 2.949 . 0 0 "[ . 1 . 2]" 1
713 1 91 ILE H 1 91 ILE HB 3.100 . 4.300 3.494 2.767 3.714 . 0 0 "[ . 1 . 2]" 1
714 1 91 ILE H 1 91 ILE MD 3.200 . 4.500 3.639 3.444 3.783 . 0 0 "[ . 1 . 2]" 1
715 1 91 ILE H 1 91 ILE HG12 2.700 . 3.600 2.522 2.151 3.394 . 0 0 "[ . 1 . 2]" 1
716 1 91 ILE H 1 91 ILE HG13 2.600 . 3.400 2.102 1.812 2.489 . 0 0 "[ . 1 . 2]" 1
717 1 91 ILE H 1 91 ILE MG 2.800 . 3.800 3.318 2.897 3.842 0.042 17 0 "[ . 1 . 2]" 1
718 1 91 ILE H 1 92 LEU H 2.500 . 5.500 3.058 2.208 3.618 . 0 0 "[ . 1 . 2]" 1
719 1 91 ILE HA 1 92 LEU H 3.100 . 4.300 2.733 2.403 3.371 . 0 0 "[ . 1 . 2]" 1
720 1 91 ILE HB 1 92 LEU H 2.700 . 5.500 4.231 3.348 4.395 . 0 0 "[ . 1 . 2]" 1
721 1 91 ILE MD 1 92 LEU H 3.700 . 5.400 5.298 4.832 5.424 0.024 12 0 "[ . 1 . 2]" 1
722 1 91 ILE MD 1 189 VAL MG1 3.200 . 4.000 3.809 3.428 4.047 0.047 1 0 "[ . 1 . 2]" 1
723 1 91 ILE MD 1 189 VAL MG2 3.200 . 4.000 3.932 3.043 4.032 0.032 17 0 "[ . 1 . 2]" 1
724 1 91 ILE HG12 1 92 LEU H 2.600 . 5.500 5.061 4.419 5.494 . 0 0 "[ . 1 . 2]" 1
725 1 91 ILE HG13 1 92 LEU H 2.500 . 5.500 4.267 3.439 4.630 . 0 0 "[ . 1 . 2]" 1
726 1 91 ILE MG 1 92 LEU H 3.200 . 4.500 4.295 4.157 4.407 . 0 0 "[ . 1 . 2]" 1
727 1 92 LEU H 1 92 LEU HA 2.900 . 4.000 2.941 2.933 2.949 . 0 0 "[ . 1 . 2]" 1
728 1 92 LEU H 1 92 LEU HB2 2.600 . 3.400 3.447 2.546 3.905 0.505 1 1 "[+ . 1 . 2]" 1
729 1 92 LEU H 1 92 LEU MD2 3.000 . 4.100 3.831 3.180 4.649 0.549 11 2 "[ . -1+ . 2]" 1
730 1 94 GLY H 1 123 ASP H 3.600 . 5.200 5.213 5.171 5.237 0.037 20 0 "[ . 1 . 2]" 1
731 1 95 PRO HA 1 96 TYR H 2.700 . 3.600 2.896 2.777 3.026 . 0 0 "[ . 1 . 2]" 1
732 1 95 PRO HA 1 178 THR H 3.500 . 5.500 5.453 5.197 5.560 0.060 19 0 "[ . 1 . 2]" 1
733 1 95 PRO HB2 1 96 TYR H 3.300 . 4.700 4.320 4.173 4.368 . 0 0 "[ . 1 . 2]" 1
734 1 95 PRO HB3 1 96 TYR H 3.800 . 5.500 4.663 4.636 4.677 . 0 0 "[ . 1 . 2]" 1
735 1 95 PRO HG2 1 96 TYR H 3.900 . 5.500 4.397 4.034 5.285 . 0 0 "[ . 1 . 2]" 1
736 1 95 PRO HG3 1 96 TYR H 3.700 . 5.400 5.254 5.086 5.424 0.024 18 0 "[ . 1 . 2]" 1
737 1 96 TYR H 1 96 TYR HB2 3.000 . 4.100 3.173 2.510 3.757 . 0 0 "[ . 1 . 2]" 1
738 1 96 TYR H 1 96 TYR HB3 3.300 . 4.700 3.353 2.611 3.757 . 0 0 "[ . 1 . 2]" 1
739 1 96 TYR H 1 96 TYR QD 3.200 . 4.500 2.659 1.909 4.204 . 0 0 "[ . 1 . 2]" 1
740 1 96 TYR H 1 97 THR H 4.100 . 5.500 4.488 4.298 4.558 . 0 0 "[ . 1 . 2]" 1
741 1 96 TYR H 1 121 VAL H 4.000 . 5.000 4.933 4.554 5.028 0.028 1 0 "[ . 1 . 2]" 1
742 1 96 TYR H 1 178 THR HB 4.200 . 5.500 4.548 4.142 5.305 . 0 0 "[ . 1 . 2]" 1
743 1 96 TYR H 1 178 THR MG 4.200 . 5.500 5.325 4.871 5.531 0.031 17 0 "[ . 1 . 2]" 1
744 1 96 TYR HA 1 97 THR H 2.600 . 3.400 2.292 2.142 2.618 . 0 0 "[ . 1 . 2]" 1
745 1 96 TYR HB2 1 97 THR H 3.300 . 4.700 3.244 1.956 4.248 . 0 0 "[ . 1 . 2]" 1
746 1 96 TYR HB3 1 97 THR H 3.000 . 4.100 3.418 2.607 4.173 0.073 7 0 "[ . 1 . 2]" 1
747 1 96 TYR QD 1 97 THR H 3.400 . 4.800 3.984 2.951 4.714 . 0 0 "[ . 1 . 2]" 1
748 1 97 THR H 1 97 THR HB 2.900 . 4.000 2.716 2.441 3.103 . 0 0 "[ . 1 . 2]" 1
749 1 97 THR H 1 97 THR MG 3.200 . 4.500 3.752 2.242 3.896 . 0 0 "[ . 1 . 2]" 1
750 1 97 THR H 1 178 THR MG 3.900 . 5.500 3.591 2.700 4.453 . 0 0 "[ . 1 . 2]" 1
751 1 97 THR H 1 179 VAL HA 3.000 . 4.100 3.031 2.325 3.868 . 0 0 "[ . 1 . 2]" 1
752 1 97 THR H 1 180 ILE H 3.200 . 4.000 3.135 2.530 3.930 . 0 0 "[ . 1 . 2]" 1
753 1 97 THR H 1 180 ILE HB 4.100 . 5.500 4.609 3.967 5.512 0.012 9 0 "[ . 1 . 2]" 1
754 1 97 THR H 1 180 ILE MD 3.200 . 4.500 3.716 2.564 4.508 0.008 17 0 "[ . 1 . 2]" 1
755 1 97 THR H 1 180 ILE HG13 3.900 . 5.500 4.162 2.995 5.051 . 0 0 "[ . 1 . 2]" 1
756 1 97 THR HA 1 98 VAL H 2.400 . 3.100 2.187 2.144 2.268 . 0 0 "[ . 1 . 2]" 1
757 1 97 THR HA 1 120 ARG HA 2.600 . 3.400 3.112 2.394 3.413 0.013 4 0 "[ . 1 . 2]" 1
758 1 97 THR HA 1 121 VAL H 4.000 . 5.000 4.366 3.272 4.897 . 0 0 "[ . 1 . 2]" 1
759 1 97 THR MG 1 98 VAL H 2.700 . 3.600 2.634 2.133 3.598 . 0 0 "[ . 1 . 2]" 1
760 1 98 VAL H 1 98 VAL HB 3.200 . 4.500 3.143 2.647 3.649 . 0 0 "[ . 1 . 2]" 1
761 1 98 VAL H 1 98 VAL MG1 2.400 . 3.100 3.047 1.697 3.943 0.843 3 9 "[ +** * 1** * *-2]" 1
762 1 98 VAL H 1 99 VAL H 3.900 . 5.500 4.158 3.795 4.463 . 0 0 "[ . 1 . 2]" 1
763 1 98 VAL H 1 119 ILE H 3.000 . 4.100 3.496 2.693 4.053 . 0 0 "[ . 1 . 2]" 1
764 1 98 VAL H 1 119 ILE HB 3.200 . 4.500 4.107 3.335 4.526 0.026 20 0 "[ . 1 . 2]" 1
765 1 98 VAL H 1 120 ARG HA 3.600 . 5.200 3.089 2.438 3.765 . 0 0 "[ . 1 . 2]" 1
766 1 98 VAL H 1 120 ARG HB2 3.600 . 5.200 4.654 4.017 5.202 0.002 12 0 "[ . 1 . 2]" 1
767 1 98 VAL H 1 120 ARG QG 4.300 . 5.500 4.122 2.833 5.097 . 0 0 "[ . 1 . 2]" 1
768 1 98 VAL HA 1 99 VAL H 2.300 . 3.000 2.159 2.127 2.249 . 0 0 "[ . 1 . 2]" 1
769 1 98 VAL HA 1 180 ILE H 3.200 . 4.000 3.834 3.055 4.025 0.025 18 0 "[ . 1 . 2]" 1
770 1 98 VAL HA 1 182 LEU H 3.900 . 5.500 3.332 2.748 3.838 . 0 0 "[ . 1 . 2]" 1
771 1 98 VAL MG2 1 99 VAL H 3.100 . 4.300 3.851 2.709 4.440 0.140 3 0 "[ . 1 . 2]" 1
772 1 99 VAL H 1 99 VAL HB 2.500 . 3.300 2.655 2.298 2.767 . 0 0 "[ . 1 . 2]" 1
773 1 99 VAL H 1 99 VAL MG2 2.900 . 4.000 2.363 1.958 2.995 . 0 0 "[ . 1 . 2]" 1
774 1 99 VAL H 1 100 LEU H 3.500 . 5.000 4.434 4.367 4.495 . 0 0 "[ . 1 . 2]" 1
775 1 99 VAL H 1 119 ILE H 4.300 . 5.500 4.547 4.276 4.958 . 0 0 "[ . 1 . 2]" 1
776 1 99 VAL H 1 181 ASP HA 2.600 . 3.400 2.381 2.067 2.658 . 0 0 "[ . 1 . 2]" 1
777 1 99 VAL H 1 181 ASP HB2 4.000 . 5.500 5.229 4.519 5.591 0.091 17 0 "[ . 1 . 2]" 1
778 1 99 VAL H 1 182 LEU H 3.200 . 4.000 2.454 2.099 2.794 . 0 0 "[ . 1 . 2]" 1
779 1 99 VAL H 1 182 LEU HB3 3.000 . 4.100 4.093 3.676 4.873 0.773 8 1 "[ . + 1 . 2]" 1
780 1 99 VAL HA 1 100 LEU H 2.300 . 3.000 2.144 2.126 2.180 . 0 0 "[ . 1 . 2]" 1
781 1 99 VAL HA 1 118 GLY H 3.600 . 5.200 4.767 4.238 5.202 0.002 19 0 "[ . 1 . 2]" 1
782 1 99 VAL HA 1 119 ILE H 4.000 . 5.000 2.880 2.526 3.626 . 0 0 "[ . 1 . 2]" 1
783 1 99 VAL MG1 1 117 VAL H 3.000 . 4.100 3.461 3.034 4.109 0.009 2 0 "[ . 1 . 2]" 1
784 1 100 LEU H 1 100 LEU HB2 2.900 . 4.000 2.732 2.463 3.559 . 0 0 "[ . 1 . 2]" 1
785 1 100 LEU H 1 100 LEU HB3 2.800 . 3.800 3.390 2.535 3.836 0.036 16 0 "[ . 1 . 2]" 1
786 1 100 LEU H 1 100 LEU HG 3.500 . 5.000 3.948 2.272 4.768 . 0 0 "[ . 1 . 2]" 1
787 1 100 LEU H 1 117 VAL H 2.900 . 4.000 3.595 2.767 4.012 0.012 8 0 "[ . 1 . 2]" 1
788 1 100 LEU H 1 117 VAL MG1 3.400 . 4.800 4.719 4.477 4.808 0.008 19 0 "[ . 1 . 2]" 1
789 1 100 LEU H 1 118 GLY HA2 3.200 . 4.500 3.049 2.376 3.439 . 0 0 "[ . 1 . 2]" 1
790 1 100 LEU H 1 118 GLY HA3 4.000 . 5.000 4.750 4.128 5.033 0.033 12 0 "[ . 1 . 2]" 1
791 1 100 LEU H 1 119 ILE H 3.800 . 5.500 4.245 3.708 5.165 . 0 0 "[ . 1 . 2]" 1
792 1 100 LEU H 1 183 THR MG 3.400 . 4.800 4.865 4.832 4.900 0.100 16 0 "[ . 1 . 2]" 1
793 1 100 LEU HA 1 101 GLU H 2.500 . 3.300 2.640 2.407 2.773 . 0 0 "[ . 1 . 2]" 1
794 1 100 LEU HA 1 182 LEU H 4.000 . 5.000 4.805 4.705 4.917 . 0 0 "[ . 1 . 2]" 1
795 1 100 LEU HA 1 183 THR H 3.700 . 5.400 4.470 4.207 4.783 . 0 0 "[ . 1 . 2]" 1
796 1 100 LEU HB2 1 101 GLU H 3.000 . 4.100 3.361 2.199 3.794 . 0 0 "[ . 1 . 2]" 1
797 1 100 LEU HB3 1 101 GLU H 2.500 . 3.300 2.379 1.746 3.978 0.678 10 1 "[ . + . 2]" 1
798 1 100 LEU QD 1 101 GLU H 2.900 . 4.000 2.584 1.862 3.519 0.038 10 0 "[ . 1 . 2]" 1
799 1 100 LEU QD 1 183 THR H 3.300 . 4.700 4.437 4.010 4.650 . 0 0 "[ . 1 . 2]" 1
800 1 101 GLU H 1 101 GLU HA 2.900 . 4.000 2.868 2.820 2.876 . 0 0 "[ . 1 . 2]" 1
801 1 101 GLU H 1 101 GLU HB2 2.300 . 3.000 2.255 2.098 3.543 0.543 2 1 "[ + . 1 . 2]" 1
802 1 101 GLU H 1 101 GLU HG3 3.000 . 4.100 3.455 2.146 4.102 0.002 12 0 "[ . 1 . 2]" 1
803 1 101 GLU H 1 102 ARG H 3.800 . 5.500 4.538 4.440 4.630 . 0 0 "[ . 1 . 2]" 1
804 1 101 GLU H 1 183 THR HA 4.000 . 5.000 3.350 2.803 3.782 . 0 0 "[ . 1 . 2]" 1
805 1 101 GLU H 1 183 THR MG 2.600 . 5.500 3.684 2.765 4.365 . 0 0 "[ . 1 . 2]" 1
806 1 101 GLU HA 1 102 ARG H 2.300 . 3.000 2.614 2.375 2.771 . 0 0 "[ . 1 . 2]" 1
807 1 101 GLU HA 1 116 ARG HA 2.600 . 3.000 2.421 2.108 2.787 . 0 0 "[ . 1 . 2]" 1
808 1 101 GLU HA 1 117 VAL H 3.200 . 4.500 3.397 2.990 3.942 . 0 0 "[ . 1 . 2]" 1
809 1 101 GLU HB3 1 102 ARG H 2.700 . 3.600 2.297 1.789 3.300 0.011 11 0 "[ . 1 . 2]" 1
810 1 101 GLU HG2 1 102 ARG H 3.100 . 4.300 3.271 2.297 4.149 . 0 0 "[ . 1 . 2]" 1
811 1 102 ARG H 1 102 ARG HA 2.900 . 4.000 2.946 2.941 2.949 . 0 0 "[ . 1 . 2]" 1
812 1 102 ARG H 1 102 ARG HB3 2.500 . 3.300 2.726 2.435 3.334 0.034 11 0 "[ . 1 . 2]" 1
813 1 102 ARG H 1 102 ARG QG 2.900 . 4.000 3.328 2.208 4.086 0.086 10 0 "[ . 1 . 2]" 1
814 1 102 ARG H 1 103 ASN H 3.700 . 5.400 4.458 4.418 4.498 . 0 0 "[ . 1 . 2]" 1
815 1 102 ARG H 1 116 ARG HA 4.000 . 5.000 3.050 2.376 3.570 . 0 0 "[ . 1 . 2]" 1
816 1 102 ARG H 1 117 VAL H 3.600 . 5.200 4.449 3.754 5.196 . 0 0 "[ . 1 . 2]" 1
817 1 102 ARG H 1 117 VAL MG2 3.100 . 4.300 4.278 4.088 4.330 0.030 20 0 "[ . 1 . 2]" 1
818 1 102 ARG HA 1 103 ASN H 2.900 . 4.000 2.205 2.153 2.316 . 0 0 "[ . 1 . 2]" 1
819 1 102 ARG HB2 1 103 ASN H 2.600 . 3.400 3.466 2.910 4.400 1.000 11 4 "[ . -+* . *]" 1
820 1 103 ASN H 1 103 ASN HA 2.800 . 3.800 2.862 2.849 2.870 . 0 0 "[ . 1 . 2]" 1
821 1 103 ASN H 1 103 ASN QB 3.500 . 4.500 2.191 2.063 2.565 . 0 0 "[ . 1 . 2]" 1
822 1 103 ASN H 1 104 GLU H 4.000 . 5.500 4.440 4.283 4.566 . 0 0 "[ . 1 . 2]" 1
823 1 103 ASN H 1 105 LEU H 4.200 . 5.500 4.082 3.642 4.852 . 0 0 "[ . 1 . 2]" 1
824 1 103 ASN H 1 117 VAL HB 3.400 . 5.500 5.087 4.416 5.527 0.027 10 0 "[ . 1 . 2]" 1
825 1 103 ASN H 1 117 VAL MG2 3.200 . 4.500 3.885 2.859 4.554 0.054 3 0 "[ . 1 . 2]" 1
826 1 103 ASN HA 1 104 GLU H 2.600 . 3.400 2.737 2.537 2.936 . 0 0 "[ . 1 . 2]" 1
827 1 103 ASN QB 1 104 GLU H 2.400 . 5.500 2.246 1.694 2.646 . 0 0 "[ . 1 . 2]" 1
828 1 103 ASN QB 1 105 LEU H 3.400 . 4.000 3.026 2.181 3.812 . 0 0 "[ . 1 . 2]" 1
829 1 104 GLU H 1 104 GLU HA 2.700 . 3.600 2.865 2.830 2.877 . 0 0 "[ . 1 . 2]" 1
830 1 104 GLU H 1 104 GLU HB2 2.700 . 3.600 2.472 2.074 3.591 . 0 0 "[ . 1 . 2]" 1
831 1 104 GLU H 1 104 GLU HB3 2.800 . 3.800 3.243 2.754 3.605 . 0 0 "[ . 1 . 2]" 1
832 1 104 GLU H 1 105 LEU H 3.200 . 4.500 3.120 2.561 3.622 . 0 0 "[ . 1 . 2]" 1
833 1 104 GLU HA 1 105 LEU H 3.100 . 4.300 2.936 2.567 3.535 . 0 0 "[ . 1 . 2]" 1
834 1 105 LEU H 1 105 LEU HA 2.500 . 3.300 2.855 2.837 2.910 . 0 0 "[ . 1 . 2]" 1
835 1 105 LEU H 1 105 LEU HB2 2.300 . 5.500 2.253 2.068 2.766 . 0 0 "[ . 1 . 2]" 1
836 1 105 LEU H 1 105 LEU HB3 2.400 . 5.500 2.976 2.311 3.348 . 0 0 "[ . 1 . 2]" 1
837 1 105 LEU H 1 105 LEU MD1 2.800 . 5.500 4.017 3.686 4.368 . 0 0 "[ . 1 . 2]" 1
838 1 105 LEU H 1 105 LEU MD2 3.500 . 5.000 4.138 3.323 4.405 . 0 0 "[ . 1 . 2]" 1
839 1 105 LEU H 1 106 ILE H 2.500 . 5.500 4.498 4.072 4.635 . 0 0 "[ . 1 . 2]" 1
840 1 105 LEU HA 1 106 ILE H 3.000 . 4.100 2.263 2.129 2.686 . 0 0 "[ . 1 . 2]" 1
841 1 105 LEU HB2 1 106 ILE H 3.000 . 5.500 4.261 3.618 4.635 . 0 0 "[ . 1 . 2]" 1
842 1 105 LEU HB3 1 106 ILE H 3.300 . 4.600 3.548 2.131 4.514 . 0 0 "[ . 1 . 2]" 1
843 1 106 ILE H 1 106 ILE HA 2.900 . 4.000 2.850 2.789 2.891 . 0 0 "[ . 1 . 2]" 1
844 1 106 ILE H 1 106 ILE HB 2.900 . 4.000 2.750 2.361 3.590 . 0 0 "[ . 1 . 2]" 1
845 1 106 ILE H 1 106 ILE MD 3.400 . 4.800 3.020 2.013 4.381 . 0 0 "[ . 1 . 2]" 1
846 1 106 ILE H 1 106 ILE HG12 3.200 . 4.500 3.231 1.895 4.629 0.129 10 0 "[ . 1 . 2]" 1
847 1 106 ILE H 1 106 ILE HG13 3.400 . 4.800 2.709 1.899 4.400 0.101 11 0 "[ . 1 . 2]" 1
848 1 106 ILE H 1 106 ILE MG 2.800 . 3.800 3.496 1.835 3.792 . 0 0 "[ . 1 . 2]" 1
849 1 108 ASP H 1 108 ASP HA 2.300 . 3.000 2.855 2.787 2.890 . 0 0 "[ . 1 . 2]" 1
850 1 108 ASP H 1 108 ASP HB2 2.600 . 3.400 2.359 2.078 3.616 0.216 17 0 "[ . 1 . 2]" 1
851 1 108 ASP H 1 108 ASP HB3 2.800 . 3.800 3.194 2.535 3.555 . 0 0 "[ . 1 . 2]" 1
852 1 108 ASP H 1 109 VAL H 3.200 . 4.500 2.812 2.360 3.537 . 0 0 "[ . 1 . 2]" 1
853 1 108 ASP HA 1 109 VAL H 3.300 . 4.700 3.362 3.212 3.531 . 0 0 "[ . 1 . 2]" 1
854 1 108 ASP HA 1 110 ILE H 3.800 . 5.500 3.805 3.429 4.298 . 0 0 "[ . 1 . 2]" 1
855 1 108 ASP HB2 1 109 VAL H 2.900 . 4.000 3.435 2.223 4.147 0.147 5 0 "[ . 1 . 2]" 1
856 1 108 ASP HB3 1 109 VAL H 3.000 . 4.100 3.241 1.779 4.097 0.121 11 0 "[ . 1 . 2]" 1
857 1 109 VAL H 1 109 VAL HA 2.700 . 3.600 2.868 2.829 2.908 . 0 0 "[ . 1 . 2]" 1
858 1 109 VAL H 1 109 VAL HB 3.200 . 4.500 3.009 2.471 3.630 . 0 0 "[ . 1 . 2]" 1
859 1 109 VAL H 1 109 VAL QG 2.900 . 3.400 2.072 1.819 2.459 . 0 0 "[ . 1 . 2]" 1
860 1 109 VAL H 1 110 ILE H 3.500 . 5.000 2.540 2.357 2.899 . 0 0 "[ . 1 . 2]" 1
861 1 109 VAL H 1 111 THR H 4.300 . 5.500 4.294 3.744 5.071 . 0 0 "[ . 1 . 2]" 1
862 1 109 VAL H 1 112 GLY H 4.300 . 5.500 4.776 4.487 5.184 . 0 0 "[ . 1 . 2]" 1
863 1 109 VAL HA 1 110 ILE H 3.300 . 4.700 3.351 3.021 3.470 . 0 0 "[ . 1 . 2]" 1
864 1 109 VAL HB 1 110 ILE H 3.400 . 4.800 4.057 3.034 4.519 . 0 0 "[ . 1 . 2]" 1
865 1 109 VAL QG 1 110 ILE H 2.900 . 4.000 2.587 1.987 3.456 . 0 0 "[ . 1 . 2]" 1
866 1 109 VAL QG 1 112 GLY H 4.000 . 5.500 4.668 4.385 4.994 . 0 0 "[ . 1 . 2]" 1
867 1 110 ILE H 1 110 ILE HA 2.900 . 4.000 2.933 2.920 2.948 . 0 0 "[ . 1 . 2]" 1
868 1 110 ILE H 1 110 ILE HB 2.900 . 4.000 2.934 2.521 3.636 . 0 0 "[ . 1 . 2]" 1
869 1 110 ILE H 1 110 ILE MD 3.000 . 4.100 3.507 3.197 3.803 . 0 0 "[ . 1 . 2]" 1
870 1 110 ILE H 1 110 ILE HG13 2.500 . 3.300 2.446 1.722 3.890 0.590 13 1 "[ . 1 + . 2]" 1
871 1 110 ILE H 1 110 ILE MG 2.900 . 4.000 3.676 2.811 3.863 . 0 0 "[ . 1 . 2]" 1
872 1 110 ILE H 1 111 THR H 2.600 . 3.400 2.229 1.959 2.566 . 0 0 "[ . 1 . 2]" 1
873 1 110 ILE H 1 112 GLY H 3.400 . 4.800 3.370 2.999 3.641 . 0 0 "[ . 1 . 2]" 1
874 1 110 ILE HA 1 112 GLY H 3.500 . 5.000 4.186 3.771 4.745 . 0 0 "[ . 1 . 2]" 1
875 1 110 ILE HB 1 112 GLY H 3.800 . 5.500 4.784 4.219 5.463 . 0 0 "[ . 1 . 2]" 1
876 1 110 ILE HG13 1 112 GLY H 3.900 . 5.500 5.331 4.301 6.467 0.967 9 3 "[ . +- * . 2]" 1
877 1 110 ILE MG 1 117 VAL MG1 4.000 . 5.000 3.570 2.589 4.778 . 0 0 "[ . 1 . 2]" 1
878 1 110 ILE MG 1 117 VAL MG2 4.000 . 5.000 3.649 2.007 5.016 0.016 6 0 "[ . 1 . 2]" 1
879 1 111 THR H 1 112 GLY H 2.600 . 3.400 2.420 2.265 2.593 . 0 0 "[ . 1 . 2]" 1
880 1 111 THR HA 1 112 GLY H 3.000 . 4.100 3.432 3.269 3.535 . 0 0 "[ . 1 . 2]" 1
881 1 111 THR HB 1 112 GLY H 4.000 . 5.500 3.946 2.869 4.359 . 0 0 "[ . 1 . 2]" 1
882 1 111 THR MG 1 112 GLY H 3.100 . 4.300 3.269 2.192 4.170 . 0 0 "[ . 1 . 2]" 1
883 1 112 GLY H 1 112 GLY HA2 2.600 . 3.400 2.308 2.298 2.329 . 0 0 "[ . 1 . 2]" 1
884 1 112 GLY H 1 112 GLY HA3 2.400 . 3.100 2.860 2.837 2.897 . 0 0 "[ . 1 . 2]" 1
885 1 114 SER HA 1 115 SER H 4.200 . 5.500 2.588 2.389 2.746 . 0 0 "[ . 1 . 2]" 1
886 1 115 SER HA 1 116 ARG H 3.200 . 4.500 2.655 2.414 2.898 . 0 0 "[ . 1 . 2]" 1
887 1 115 SER HB3 1 116 ARG H 3.300 . 4.700 4.468 4.210 4.669 . 0 0 "[ . 1 . 2]" 1
888 1 116 ARG H 1 116 ARG HA 2.900 . 4.000 2.929 2.898 2.936 . 0 0 "[ . 1 . 2]" 1
889 1 116 ARG H 1 116 ARG QB 2.200 . 2.800 2.633 2.543 2.784 . 0 0 "[ . 1 . 2]" 1
890 1 116 ARG H 1 116 ARG HG3 3.000 . 4.100 3.651 2.912 3.997 . 0 0 "[ . 1 . 2]" 1
891 1 116 ARG H 1 117 VAL H 3.500 . 5.000 4.398 4.252 4.438 . 0 0 "[ . 1 . 2]" 1
892 1 116 ARG HA 1 117 VAL H 2.300 . 3.000 2.308 2.157 2.433 . 0 0 "[ . 1 . 2]" 1
893 1 116 ARG QB 1 117 VAL H 2.700 . 3.600 2.672 2.325 3.186 . 0 0 "[ . 1 . 2]" 1
894 1 116 ARG HG2 1 117 VAL H 3.200 . 4.500 3.881 3.181 4.430 . 0 0 "[ . 1 . 2]" 1
895 1 117 VAL H 1 117 VAL HA 2.900 . 4.000 2.929 2.924 2.932 . 0 0 "[ . 1 . 2]" 1
896 1 117 VAL H 1 117 VAL HB 3.100 . 4.300 2.816 2.779 2.890 . 0 0 "[ . 1 . 2]" 1
897 1 117 VAL H 1 117 VAL MG1 3.100 . 4.300 3.908 3.869 3.954 . 0 0 "[ . 1 . 2]" 1
898 1 117 VAL H 1 117 VAL MG2 2.500 . 3.300 3.008 2.776 3.168 . 0 0 "[ . 1 . 2]" 1
899 1 117 VAL H 1 118 GLY H 3.300 . 4.700 4.317 4.107 4.389 . 0 0 "[ . 1 . 2]" 1
900 1 117 VAL H 1 183 THR MG 4.100 . 5.500 5.276 5.012 5.505 0.005 2 0 "[ . 1 . 2]" 1
901 1 117 VAL HA 1 118 GLY H 2.400 . 3.100 2.215 2.151 2.274 . 0 0 "[ . 1 . 2]" 1
902 1 117 VAL HB 1 118 GLY H 3.200 . 4.500 4.034 3.885 4.246 . 0 0 "[ . 1 . 2]" 1
903 1 117 VAL MG1 1 118 GLY H 2.600 . 3.400 2.283 1.949 2.841 . 0 0 "[ . 1 . 2]" 1
904 1 117 VAL MG2 1 118 GLY H 3.300 . 4.700 3.930 3.829 4.170 . 0 0 "[ . 1 . 2]" 1
905 1 118 GLY H 1 118 GLY HA2 2.900 . 4.000 2.914 2.877 2.939 . 0 0 "[ . 1 . 2]" 1
906 1 118 GLY H 1 118 GLY HA3 2.700 . 3.600 2.353 2.313 2.390 . 0 0 "[ . 1 . 2]" 1
907 1 118 GLY H 1 119 ILE H 3.700 . 5.400 4.570 4.436 4.610 . 0 0 "[ . 1 . 2]" 1
908 1 118 GLY HA2 1 119 ILE H 2.600 . 3.400 2.302 2.152 2.419 . 0 0 "[ . 1 . 2]" 1
909 1 118 GLY HA3 1 119 ILE H 2.800 . 3.800 2.861 2.700 3.301 . 0 0 "[ . 1 . 2]" 1
910 1 119 ILE H 1 119 ILE HA 2.800 . 3.800 2.919 2.908 2.948 . 0 0 "[ . 1 . 2]" 1
911 1 119 ILE H 1 119 ILE HB 2.600 . 3.400 2.978 2.817 3.426 0.026 7 0 "[ . 1 . 2]" 1
912 1 119 ILE H 1 119 ILE HG13 3.200 . 4.500 3.054 2.292 3.946 . 0 0 "[ . 1 . 2]" 1
913 1 119 ILE HA 1 120 ARG H 2.500 . 3.300 2.340 2.196 2.545 . 0 0 "[ . 1 . 2]" 1
914 1 119 ILE QG 1 120 ARG H 3.400 . 4.800 4.116 3.880 4.381 . 0 0 "[ . 1 . 2]" 1
915 1 119 ILE MG 1 120 ARG H 3.400 . 5.500 1.946 1.477 2.339 . 0 0 "[ . 1 . 2]" 1
916 1 120 ARG H 1 120 ARG HB2 2.900 . 4.000 3.290 2.734 3.952 . 0 0 "[ . 1 . 2]" 1
917 1 120 ARG H 1 120 ARG HB3 3.000 . 4.100 3.335 2.990 3.750 . 0 0 "[ . 1 . 2]" 1
918 1 120 ARG H 1 120 ARG QG 3.500 . 5.000 3.476 2.024 4.226 . 0 0 "[ . 1 . 2]" 1
919 1 120 ARG H 1 138 ALA MB 3.500 . 5.000 4.226 3.881 4.804 . 0 0 "[ . 1 . 2]" 1
920 1 120 ARG HA 1 121 VAL H 2.600 . 3.400 2.163 2.124 2.263 . 0 0 "[ . 1 . 2]" 1
921 1 120 ARG HB2 1 121 VAL H 3.200 . 4.500 3.904 2.728 4.516 0.016 12 0 "[ . 1 . 2]" 1
922 1 120 ARG QG 1 121 VAL H 3.300 . 4.700 3.433 2.294 4.387 . 0 0 "[ . 1 . 2]" 1
923 1 121 VAL H 1 121 VAL HB 3.300 . 4.700 2.871 2.614 3.644 . 0 0 "[ . 1 . 2]" 1
924 1 121 VAL H 1 121 VAL QG 3.100 . 4.300 2.336 1.974 2.611 . 0 0 "[ . 1 . 2]" 1
925 1 122 PRO HA 1 123 ASP H 2.600 . 3.400 2.534 2.494 2.638 . 0 0 "[ . 1 . 2]" 1
926 1 122 PRO QB 1 123 ASP H 3.000 . 4.100 2.245 2.028 2.416 . 0 0 "[ . 1 . 2]" 1
927 1 122 PRO HG2 1 123 ASP H 3.300 . 4.700 4.214 3.850 4.847 0.147 15 0 "[ . 1 . 2]" 1
928 1 122 PRO HG2 1 124 ASP H 3.600 . 5.200 3.058 2.449 4.311 . 0 0 "[ . 1 . 2]" 1
929 1 122 PRO HG3 1 123 ASP H 3.400 . 4.800 4.791 4.627 4.841 0.041 1 0 "[ . 1 . 2]" 1
930 1 122 PRO HG3 1 124 ASP H 3.100 . 4.300 4.274 4.044 5.048 0.748 15 3 "[ - 1 + *]" 1
931 1 123 ASP H 1 123 ASP HA 2.800 . 3.800 2.909 2.888 2.917 . 0 0 "[ . 1 . 2]" 1
932 1 123 ASP H 1 123 ASP HB2 2.900 . 4.000 2.227 2.136 2.346 . 0 0 "[ . 1 . 2]" 1
933 1 123 ASP H 1 123 ASP HB3 2.800 . 3.800 3.230 2.906 3.522 . 0 0 "[ . 1 . 2]" 1
934 1 123 ASP H 1 124 ASP H 3.400 . 4.800 2.503 2.313 2.773 . 0 0 "[ . 1 . 2]" 1
935 1 123 ASP HB2 1 124 ASP H 3.000 . 4.100 3.961 3.546 4.315 0.215 18 0 "[ . 1 . 2]" 1
936 1 123 ASP HB3 1 124 ASP H 3.300 . 4.700 3.921 3.696 4.072 . 0 0 "[ . 1 . 2]" 1
937 1 124 ASP H 1 124 ASP HB2 2.700 . 3.600 2.299 2.072 3.537 . 0 0 "[ . 1 . 2]" 1
938 1 124 ASP H 1 124 ASP HB3 3.100 . 4.300 3.243 2.770 3.619 . 0 0 "[ . 1 . 2]" 1
939 1 124 ASP H 1 125 GLU H 3.700 . 5.400 4.313 4.176 4.430 . 0 0 "[ . 1 . 2]" 1
940 1 124 ASP HA 1 125 GLU H 2.500 . 3.300 2.168 2.133 2.219 . 0 0 "[ . 1 . 2]" 1
941 1 124 ASP HB2 1 127 CYS H 3.500 . 5.000 3.840 2.331 4.343 . 0 0 "[ . 1 . 2]" 1
942 1 124 ASP HB2 1 128 ARG H 3.700 . 5.400 4.746 3.859 5.321 . 0 0 "[ . 1 . 2]" 1
943 1 124 ASP HB3 1 125 GLU H 3.400 . 4.800 3.986 3.680 4.265 . 0 0 "[ . 1 . 2]" 1
944 1 125 GLU H 1 125 GLU HB2 2.800 . 3.800 2.553 2.112 3.580 . 0 0 "[ . 1 . 2]" 1
945 1 125 GLU H 1 125 GLU HB3 2.700 . 3.600 3.021 2.503 3.585 . 0 0 "[ . 1 . 2]" 1
946 1 125 GLU H 1 125 GLU HG3 3.500 . 5.000 3.572 2.216 4.499 . 0 0 "[ . 1 . 2]" 1
947 1 125 GLU HA 1 126 ILE H 3.500 . 5.000 3.549 3.502 3.575 . 0 0 "[ . 1 . 2]" 1
948 1 125 GLU HB2 1 126 ILE H 3.100 . 4.300 3.266 2.453 3.928 . 0 0 "[ . 1 . 2]" 1
949 1 125 GLU HB3 1 126 ILE H 3.200 . 4.500 3.053 2.344 4.017 . 0 0 "[ . 1 . 2]" 1
950 1 125 GLU HG2 1 126 ILE H 3.600 . 5.200 4.136 1.926 5.199 0.074 13 0 "[ . 1 . 2]" 1
951 1 126 ILE H 1 126 ILE HA 2.800 . 3.800 2.810 2.787 2.844 . 0 0 "[ . 1 . 2]" 1
952 1 126 ILE H 1 126 ILE HB 2.600 . 3.400 2.575 2.278 2.758 . 0 0 "[ . 1 . 2]" 1
953 1 126 ILE H 1 126 ILE MD 2.800 . 3.800 3.177 2.401 3.533 . 0 0 "[ . 1 . 2]" 1
954 1 126 ILE H 1 126 ILE HG12 3.300 . 4.700 2.600 1.897 4.186 0.003 4 0 "[ . 1 . 2]" 1
955 1 126 ILE H 1 126 ILE MG 2.700 . 5.500 3.758 3.679 3.772 . 0 0 "[ . 1 . 2]" 1
956 1 126 ILE H 1 127 CYS H 2.800 . 3.800 2.780 2.670 2.874 . 0 0 "[ . 1 . 2]" 1
957 1 126 ILE HA 1 127 CYS H 3.600 . 5.200 3.563 3.557 3.570 . 0 0 "[ . 1 . 2]" 1
958 1 126 ILE HA 1 128 ARG H 4.700 . 5.500 3.863 3.691 3.997 . 0 0 "[ . 1 . 2]" 1
959 1 126 ILE HA 1 129 ARG H 3.600 . 5.200 3.541 3.342 3.636 . 0 0 "[ . 1 . 2]" 1
960 1 126 ILE HA 1 130 ILE H 3.900 . 5.500 4.526 4.094 4.703 . 0 0 "[ . 1 . 2]" 1
961 1 126 ILE MD 1 127 CYS H 3.500 . 5.000 4.440 3.870 4.636 . 0 0 "[ . 1 . 2]" 1
962 1 126 ILE HG12 1 127 CYS H 4.000 . 5.500 4.401 3.963 5.057 . 0 0 "[ . 1 . 2]" 1
963 1 126 ILE HG12 1 128 ARG H 4.000 . 5.500 5.812 5.505 6.485 0.985 8 8 "[ * * *+** * . - 2]" 1
964 1 126 ILE MG 1 127 CYS H 3.000 . 4.100 3.317 2.900 3.640 . 0 0 "[ . 1 . 2]" 1
965 1 126 ILE MG 1 130 ILE H 2.900 . 4.000 3.952 3.530 4.023 0.023 13 0 "[ . 1 . 2]" 1
966 1 127 CYS H 1 127 CYS HA 3.000 . 4.100 2.804 2.784 2.826 . 0 0 "[ . 1 . 2]" 1
967 1 127 CYS H 1 127 CYS HB2 3.100 . 4.300 2.365 2.060 3.459 . 0 0 "[ . 1 . 2]" 1
968 1 127 CYS H 1 127 CYS HB3 2.900 . 4.000 3.003 2.134 3.587 . 0 0 "[ . 1 . 2]" 1
969 1 127 CYS H 1 128 ARG H 3.000 . 4.100 2.644 2.574 2.711 . 0 0 "[ . 1 . 2]" 1
970 1 127 CYS H 1 129 ARG H 4.200 . 5.500 4.429 4.189 4.793 . 0 0 "[ . 1 . 2]" 1
971 1 127 CYS HA 1 128 ARG H 2.700 . 3.600 3.422 3.373 3.476 . 0 0 "[ . 1 . 2]" 1
972 1 127 CYS HB2 1 128 ARG H 3.300 . 4.700 3.741 3.116 4.323 . 0 0 "[ . 1 . 2]" 1
973 1 127 CYS HB3 1 128 ARG H 3.100 . 4.300 3.439 2.939 4.048 . 0 0 "[ . 1 . 2]" 1
974 1 128 ARG H 1 128 ARG HB2 2.700 . 3.600 2.243 2.079 2.599 . 0 0 "[ . 1 . 2]" 1
975 1 128 ARG H 1 128 ARG HB3 2.700 . 3.600 3.018 2.509 3.549 . 0 0 "[ . 1 . 2]" 1
976 1 128 ARG H 1 128 ARG QG 3.000 . 4.100 3.664 2.690 4.065 . 0 0 "[ . 1 . 2]" 1
977 1 128 ARG H 1 129 ARG H 2.700 . 3.600 2.537 2.444 2.639 . 0 0 "[ . 1 . 2]" 1
978 1 128 ARG H 1 130 ILE H 3.400 . 4.800 4.336 4.099 4.586 . 0 0 "[ . 1 . 2]" 1
979 1 128 ARG HA 1 129 ARG H 2.800 . 3.800 3.523 3.472 3.565 . 0 0 "[ . 1 . 2]" 1
980 1 129 ARG H 1 129 ARG HB2 2.600 . 3.400 2.197 2.080 2.666 . 0 0 "[ . 1 . 2]" 1
981 1 129 ARG H 1 129 ARG HB3 2.300 . 3.000 3.078 2.435 3.425 0.425 10 0 "[ . 1 . 2]" 1
982 1 129 ARG H 1 129 ARG QG 3.000 . 4.100 3.676 3.173 4.026 . 0 0 "[ . 1 . 2]" 1
983 1 129 ARG H 1 130 ILE H 2.700 . 3.600 2.711 2.570 2.833 . 0 0 "[ . 1 . 2]" 1
984 1 129 ARG H 1 131 ALA H 3.600 . 5.200 4.147 3.894 4.431 . 0 0 "[ . 1 . 2]" 1
985 1 129 ARG HB3 1 130 ILE H 2.800 . 3.800 2.533 2.205 3.055 . 0 0 "[ . 1 . 2]" 1
986 1 129 ARG HB3 1 131 ALA H 3.700 . 5.400 5.087 4.661 5.400 0.000 11 0 "[ . 1 . 2]" 1
987 1 130 ILE H 1 130 ILE HB 2.500 . 3.300 2.639 2.443 2.797 . 0 0 "[ . 1 . 2]" 1
988 1 130 ILE H 1 130 ILE MD 3.300 . 4.700 3.455 2.696 4.343 . 0 0 "[ . 1 . 2]" 1
989 1 130 ILE H 1 131 ALA H 2.600 . 3.400 2.795 2.668 2.860 . 0 0 "[ . 1 . 2]" 1
990 1 130 ILE H 1 132 ALA H 3.600 . 5.200 3.972 3.868 4.068 . 0 0 "[ . 1 . 2]" 1
991 1 130 ILE H 1 133 ARG H 3.800 . 5.500 5.326 5.230 5.432 . 0 0 "[ . 1 . 2]" 1
992 1 130 ILE HA 1 132 ALA H 3.200 . 4.500 4.122 4.084 4.176 . 0 0 "[ . 1 . 2]" 1
993 1 130 ILE HB 1 131 ALA H 3.000 . 4.100 2.832 2.246 3.999 . 0 0 "[ . 1 . 2]" 1
994 1 130 ILE MD 1 131 ALA H 3.600 . 5.200 4.320 3.777 4.962 . 0 0 "[ . 1 . 2]" 1
995 1 130 ILE MG 1 131 ALA H 2.700 . 3.600 3.003 1.854 3.596 . 0 0 "[ . 1 . 2]" 1
996 1 130 ILE MG 1 132 ALA H 3.700 . 5.400 4.588 4.001 4.903 . 0 0 "[ . 1 . 2]" 1
997 1 131 ALA H 1 131 ALA HA 2.800 . 3.800 2.816 2.784 2.851 . 0 0 "[ . 1 . 2]" 1
998 1 131 ALA H 1 131 ALA MB 2.300 . 3.000 2.152 2.037 2.239 . 0 0 "[ . 1 . 2]" 1
999 1 131 ALA H 1 132 ALA H 2.500 . 3.300 2.621 2.508 2.722 . 0 0 "[ . 1 . 2]" 1
1000 1 131 ALA H 1 136 VAL MG2 3.200 . 4.500 3.592 3.106 4.252 . 0 0 "[ . 1 . 2]" 1
1001 1 131 ALA HA 1 132 ALA H 2.900 . 4.000 3.478 3.464 3.492 . 0 0 "[ . 1 . 2]" 1
1002 1 131 ALA HA 1 133 ARG H 3.200 . 4.500 4.507 4.383 4.544 0.044 16 0 "[ . 1 . 2]" 1
1003 1 131 ALA HA 1 134 PHE H 2.600 . 5.500 4.563 4.443 4.671 . 0 0 "[ . 1 . 2]" 1
1004 1 131 ALA HA 1 136 VAL H 3.700 . 5.400 3.738 3.215 4.085 . 0 0 "[ . 1 . 2]" 1
1005 1 131 ALA MB 1 132 ALA H 3.000 . 4.100 2.876 2.788 2.972 . 0 0 "[ . 1 . 2]" 1
1006 1 131 ALA MB 1 133 ARG H 3.900 . 5.500 4.866 4.782 4.923 . 0 0 "[ . 1 . 2]" 1
1007 1 131 ALA MB 1 136 VAL H 2.800 . 3.800 3.353 2.942 3.727 . 0 0 "[ . 1 . 2]" 1
1008 1 132 ALA H 1 132 ALA HA 2.400 . 3.100 2.787 2.782 2.791 . 0 0 "[ . 1 . 2]" 1
1009 1 132 ALA H 1 132 ALA MB 2.200 . 2.800 2.127 2.039 2.240 . 0 0 "[ . 1 . 2]" 1
1010 1 132 ALA H 1 133 ARG H 2.900 . 4.000 2.845 2.797 2.871 . 0 0 "[ . 1 . 2]" 1
1011 1 132 ALA H 1 136 VAL MG2 3.500 . 5.500 5.093 4.726 5.742 0.242 20 0 "[ . 1 . 2]" 1
1012 1 132 ALA HA 1 133 ARG H 3.200 . 4.500 3.557 3.551 3.560 . 0 0 "[ . 1 . 2]" 1
1013 1 132 ALA MB 1 133 ARG H 2.500 . 3.300 2.314 2.170 2.511 . 0 0 "[ . 1 . 2]" 1
1014 1 133 ARG H 1 133 ARG HA 2.800 . 3.800 2.878 2.872 2.885 . 0 0 "[ . 1 . 2]" 1
1015 1 133 ARG H 1 133 ARG HB2 2.700 . 3.600 2.291 2.101 2.746 . 0 0 "[ . 1 . 2]" 1
1016 1 133 ARG H 1 133 ARG HB3 2.800 . 3.800 3.294 2.579 3.614 . 0 0 "[ . 1 . 2]" 1
1017 1 133 ARG H 1 134 PHE H 2.400 . 5.500 3.105 3.007 3.173 . 0 0 "[ . 1 . 2]" 1
1018 1 133 ARG HA 1 134 PHE H 3.100 . 4.300 3.516 3.505 3.532 . 0 0 "[ . 1 . 2]" 1
1019 1 133 ARG HB2 1 134 PHE H 3.400 . 4.800 2.437 1.581 3.301 0.419 7 0 "[ . 1 . 2]" 1
1020 1 133 ARG HB3 1 134 PHE H 3.100 . 5.500 2.062 1.538 2.927 . 0 0 "[ . 1 . 2]" 1
1021 1 134 PHE H 1 134 PHE HB2 3.600 . 5.200 2.222 2.102 2.479 . 0 0 "[ . 1 . 2]" 1
1022 1 134 PHE H 1 134 PHE HB3 3.500 . 5.000 3.304 2.842 3.615 . 0 0 "[ . 1 . 2]" 1
1023 1 135 PRO HA 1 136 VAL H 2.500 . 3.300 2.272 2.185 2.374 . 0 0 "[ . 1 . 2]" 1
1024 1 135 PRO HB2 1 136 VAL H 3.200 . 4.500 3.204 2.829 3.821 . 0 0 "[ . 1 . 2]" 1
1025 1 135 PRO HB3 1 136 VAL H 2.900 . 4.000 3.535 3.018 3.866 . 0 0 "[ . 1 . 2]" 1
1026 1 136 VAL H 1 136 VAL HA 3.000 . 4.100 2.944 2.927 2.951 . 0 0 "[ . 1 . 2]" 1
1027 1 136 VAL H 1 136 VAL HB 2.600 . 3.400 3.005 2.791 3.663 0.263 20 0 "[ . 1 . 2]" 1
1028 1 136 VAL H 1 136 VAL MG2 2.200 . 2.800 2.446 1.805 2.750 . 0 0 "[ . 1 . 2]" 1
1029 1 136 VAL HA 1 137 THR H 2.500 . 3.300 2.348 2.180 2.472 . 0 0 "[ . 1 . 2]" 1
1030 1 136 VAL HB 1 137 THR H 3.200 . 4.500 3.327 2.221 3.981 . 0 0 "[ . 1 . 2]" 1
1031 1 136 VAL MG2 1 137 THR H 3.400 . 4.800 3.938 3.241 4.126 . 0 0 "[ . 1 . 2]" 1
1032 1 137 THR H 1 137 THR HB 3.000 . 4.100 2.595 2.151 2.960 . 0 0 "[ . 1 . 2]" 1
1033 1 137 THR H 1 137 THR MG 2.600 . 5.500 3.725 3.208 3.784 . 0 0 "[ . 1 . 2]" 1
1034 1 137 THR H 1 138 ALA H 3.500 . 5.000 4.565 4.488 4.624 . 0 0 "[ . 1 . 2]" 1
1035 1 137 THR HA 1 138 ALA H 2.900 . 4.000 2.221 2.164 2.339 . 0 0 "[ . 1 . 2]" 1
1036 1 137 THR HB 1 138 ALA H 2.400 . 5.500 3.946 3.385 4.396 . 0 0 "[ . 1 . 2]" 1
1037 1 137 THR MG 1 138 ALA H 3.100 . 4.300 2.480 2.213 2.963 . 0 0 "[ . 1 . 2]" 1
1038 1 138 ALA H 1 138 ALA MB 2.700 . 3.600 2.535 2.370 2.641 . 0 0 "[ . 1 . 2]" 1
1039 1 138 ALA H 1 139 THR H 2.900 . 4.000 3.996 3.812 4.057 0.057 19 0 "[ . 1 . 2]" 1
1040 1 138 ALA HA 1 139 THR H 2.500 . 3.300 2.164 2.122 2.219 . 0 0 "[ . 1 . 2]" 1
1041 1 139 THR H 1 139 THR HA 2.800 . 3.800 2.938 2.921 2.947 . 0 0 "[ . 1 . 2]" 1
1042 1 139 THR H 1 139 THR HB 2.800 . 3.800 3.667 3.418 3.824 0.024 9 0 "[ . 1 . 2]" 1
1043 1 139 THR H 1 139 THR MG 2.300 . 3.000 2.025 1.750 2.233 . 0 0 "[ . 1 . 2]" 1
1044 1 141 ALA H 1 141 ALA HA 2.900 . 4.000 2.881 2.832 2.908 . 0 0 "[ . 1 . 2]" 1
1045 1 141 ALA H 1 141 ALA MB 2.500 . 3.300 2.171 2.072 2.258 . 0 0 "[ . 1 . 2]" 1
1046 1 141 ALA H 1 142 ASN H 3.600 . 5.200 4.315 3.927 4.613 . 0 0 "[ . 1 . 2]" 1
1047 1 141 ALA HA 1 142 ASN H 3.400 . 4.800 2.207 2.138 2.336 . 0 0 "[ . 1 . 2]" 1
1048 1 141 ALA MB 1 142 ASN H 2.800 . 3.800 3.339 2.793 3.651 . 0 0 "[ . 1 . 2]" 1
1049 1 142 ASN H 1 142 ASN HA 2.800 . 3.800 2.874 2.847 2.905 . 0 0 "[ . 1 . 2]" 1
1050 1 142 ASN H 1 142 ASN HB2 2.800 . 3.800 3.231 2.777 4.005 0.205 17 0 "[ . 1 . 2]" 1
1051 1 142 ASN H 1 142 ASN HB3 2.900 . 4.000 3.405 3.104 3.748 . 0 0 "[ . 1 . 2]" 1
1052 1 142 ASN H 1 143 ILE H 4.400 . 5.500 2.173 1.931 2.783 0.069 7 0 "[ . 1 . 2]" 1
1053 1 142 ASN HA 1 143 ILE H 2.600 . 5.500 2.936 2.517 3.549 . 0 0 "[ . 1 . 2]" 1
1054 1 142 ASN HA 1 147 PRO HA 4.000 . 5.000 4.855 4.297 5.015 0.015 1 0 "[ . 1 . 2]" 1
1055 1 142 ASN HB2 1 143 ILE H 3.200 . 4.500 4.310 3.010 4.611 0.111 15 0 "[ . 1 . 2]" 1
1056 1 142 ASN HB3 1 143 ILE H 3.400 . 4.800 4.061 2.606 4.670 . 0 0 "[ . 1 . 2]" 1
1057 1 143 ILE H 1 143 ILE HB 2.800 . 3.800 3.155 2.337 3.636 . 0 0 "[ . 1 . 2]" 1
1058 1 143 ILE H 1 143 ILE MD 3.500 . 5.000 3.294 1.977 4.180 0.023 10 0 "[ . 1 . 2]" 1
1059 1 143 ILE H 1 143 ILE HG12 2.900 . 5.500 2.783 1.668 4.692 . 0 0 "[ . 1 . 2]" 1
1060 1 143 ILE H 1 143 ILE HG13 3.500 . 5.000 2.711 1.683 4.480 0.317 13 0 "[ . 1 . 2]" 1
1061 1 143 ILE H 1 143 ILE MG 3.200 . 4.500 2.991 2.355 3.769 . 0 0 "[ . 1 . 2]" 1
1062 1 143 ILE HA 1 144 SER H 2.900 . 4.000 2.823 2.313 3.415 . 0 0 "[ . 1 . 2]" 1
1063 1 143 ILE HB 1 144 SER H 2.600 . 5.500 2.249 1.505 3.878 . 0 0 "[ . 1 . 2]" 1
1064 1 143 ILE MD 1 144 SER H 3.300 . 4.700 3.118 2.110 4.623 . 0 0 "[ . 1 . 2]" 1
1065 1 143 ILE HG12 1 144 SER H 3.500 . 5.000 3.973 1.989 4.994 0.011 18 0 "[ . 1 . 2]" 1
1066 1 143 ILE HG13 1 144 SER H 3.000 . 5.500 3.526 1.498 5.095 . 0 0 "[ . 1 . 2]" 1
1067 1 143 ILE MG 1 144 SER H 3.400 . 4.800 2.816 1.980 3.455 0.020 6 0 "[ . 1 . 2]" 1
1068 1 144 SER H 1 144 SER HB2 2.800 . 3.800 2.546 2.064 3.568 . 0 0 "[ . 1 . 2]" 1
1069 1 144 SER H 1 144 SER HB3 3.000 . 4.100 3.160 2.348 3.563 . 0 0 "[ . 1 . 2]" 1
1070 1 149 SER HB2 1 155 ILE MD 2.600 . 3.000 2.715 2.234 3.020 0.020 11 0 "[ . 1 . 2]" 1
1071 1 149 SER HB3 1 155 ILE MD 2.600 . 3.000 2.706 2.106 3.019 0.019 13 0 "[ . 1 . 2]" 1
1072 1 150 PRO HA 1 151 ARG H 3.000 . 4.100 3.449 3.401 3.571 . 0 0 "[ . 1 . 2]" 1
1073 1 150 PRO HB2 1 151 ARG H 3.100 . 4.300 3.711 3.114 3.855 . 0 0 "[ . 1 . 2]" 1
1074 1 150 PRO HB3 1 151 ARG H 3.000 . 4.100 4.265 3.936 4.339 0.239 15 0 "[ . 1 . 2]" 1
1075 1 151 ARG H 1 151 ARG HB2 2.700 . 3.600 2.801 2.511 3.512 . 0 0 "[ . 1 . 2]" 1
1076 1 151 ARG H 1 151 ARG HB3 2.500 . 3.300 3.449 2.558 3.686 0.386 5 0 "[ . 1 . 2]" 1
1077 1 151 ARG H 1 151 ARG QG 2.800 . 3.800 3.569 2.118 3.874 0.074 13 0 "[ . 1 . 2]" 1
1078 1 151 ARG H 1 152 LEU H 3.700 . 5.400 4.281 4.131 4.380 . 0 0 "[ . 1 . 2]" 1
1079 1 151 ARG H 1 154 GLU H 4.700 . 5.500 4.345 3.986 4.632 . 0 0 "[ . 1 . 2]" 1
1080 1 151 ARG HA 1 152 LEU H 3.300 . 4.700 2.166 2.128 2.211 . 0 0 "[ . 1 . 2]" 1
1081 1 151 ARG HB2 1 154 GLU H 3.300 . 4.700 3.389 2.165 4.237 . 0 0 "[ . 1 . 2]" 1
1082 1 151 ARG HB3 1 152 LEU H 3.600 . 5.200 3.529 3.091 4.393 . 0 0 "[ . 1 . 2]" 1
1083 1 151 ARG HB3 1 153 GLU H 3.400 . 4.800 3.250 2.401 4.571 . 0 0 "[ . 1 . 2]" 1
1084 1 151 ARG HB3 1 154 GLU H 3.000 . 4.100 2.590 2.134 3.867 . 0 0 "[ . 1 . 2]" 1
1085 1 151 ARG QG 1 152 LEU H 3.300 . 4.700 3.660 2.505 4.674 . 0 0 "[ . 1 . 2]" 1
1086 1 152 LEU H 1 152 LEU HA 3.000 . 4.100 2.807 2.778 2.847 . 0 0 "[ . 1 . 2]" 1
1087 1 152 LEU H 1 152 LEU HB2 2.600 . 3.400 2.184 2.051 2.425 . 0 0 "[ . 1 . 2]" 1
1088 1 152 LEU H 1 152 LEU HB3 3.400 . 4.800 3.264 2.816 3.576 . 0 0 "[ . 1 . 2]" 1
1089 1 152 LEU H 1 152 LEU MD1 3.600 . 5.200 3.584 3.225 3.789 . 0 0 "[ . 1 . 2]" 1
1090 1 152 LEU H 1 152 LEU MD2 4.000 . 5.500 4.140 3.368 4.471 . 0 0 "[ . 1 . 2]" 1
1091 1 152 LEU H 1 153 GLU H 2.900 . 4.000 2.675 2.531 2.776 . 0 0 "[ . 1 . 2]" 1
1092 1 152 LEU H 1 154 GLU H 4.300 . 5.500 3.995 3.746 4.316 . 0 0 "[ . 1 . 2]" 1
1093 1 152 LEU HA 1 153 GLU H 3.400 . 4.800 3.521 3.468 3.547 . 0 0 "[ . 1 . 2]" 1
1094 1 152 LEU HA 1 155 ILE H 3.200 . 4.500 3.658 3.495 3.829 . 0 0 "[ . 1 . 2]" 1
1095 1 152 LEU HA 1 156 VAL H 3.400 . 4.800 4.671 4.138 4.839 0.039 15 0 "[ . 1 . 2]" 1
1096 1 152 LEU HB2 1 153 GLU H 3.000 . 4.100 3.155 2.599 3.662 . 0 0 "[ . 1 . 2]" 1
1097 1 152 LEU HB3 1 153 GLU H 2.800 . 3.800 3.092 2.588 3.818 0.018 11 0 "[ . 1 . 2]" 1
1098 1 152 LEU MD1 1 153 GLU H 4.100 . 5.500 4.750 4.396 4.977 . 0 0 "[ . 1 . 2]" 1
1099 1 152 LEU MD1 1 166 LEU MD1 3.200 . 4.000 3.664 2.408 4.041 0.041 19 0 "[ . 1 . 2]" 1
1100 1 152 LEU MD1 1 166 LEU MD2 3.200 . 4.000 2.844 1.768 4.016 0.032 6 0 "[ . 1 . 2]" 1
1101 1 152 LEU MD1 1 168 ALA H 4.000 . 5.000 4.975 4.577 5.070 0.070 6 0 "[ . 1 . 2]" 1
1102 1 152 LEU MD1 1 169 GLY H 3.300 . 4.700 3.989 3.521 4.473 . 0 0 "[ . 1 . 2]" 1
1103 1 152 LEU MD1 1 170 ASP H 4.200 . 5.500 4.459 3.821 5.533 0.033 4 0 "[ . 1 . 2]" 1
1104 1 152 LEU MD2 1 153 GLU H 4.000 . 5.500 4.438 3.991 4.916 . 0 0 "[ . 1 . 2]" 1
1105 1 152 LEU MD2 1 155 ILE H 4.000 . 5.500 5.288 4.709 6.336 0.836 6 1 "[ .+ 1 . 2]" 1
1106 1 152 LEU MD2 1 156 VAL H 3.600 . 5.200 5.061 4.598 5.723 0.523 6 1 "[ .+ 1 . 2]" 1
1107 1 152 LEU MD2 1 166 LEU MD1 3.200 . 4.000 3.468 1.960 4.062 0.062 6 0 "[ . 1 . 2]" 1
1108 1 152 LEU MD2 1 166 LEU MD2 3.200 . 4.000 2.762 1.796 4.034 0.034 19 0 "[ . 1 . 2]" 1
1109 1 152 LEU MD2 1 168 ALA H 4.000 . 5.000 4.985 4.733 5.080 0.080 19 0 "[ . 1 . 2]" 1
1110 1 152 LEU MD2 1 169 GLY H 4.000 . 5.000 4.526 3.716 5.022 0.022 15 0 "[ . 1 . 2]" 1
1111 1 153 GLU H 1 153 GLU HA 2.600 . 3.400 2.842 2.809 2.864 . 0 0 "[ . 1 . 2]" 1
1112 1 153 GLU H 1 153 GLU HB2 2.500 . 3.300 2.157 2.063 2.773 . 0 0 "[ . 1 . 2]" 1
1113 1 153 GLU H 1 153 GLU HB3 2.500 . 3.300 3.055 2.272 3.317 0.017 15 0 "[ . 1 . 2]" 1
1114 1 153 GLU H 1 153 GLU QG 2.800 . 3.800 3.737 3.535 3.868 0.068 11 0 "[ . 1 . 2]" 1
1115 1 153 GLU H 1 154 GLU H 2.900 . 4.000 2.536 2.456 2.661 . 0 0 "[ . 1 . 2]" 1
1116 1 153 GLU H 1 155 ILE H 4.000 . 5.500 4.335 4.088 4.516 . 0 0 "[ . 1 . 2]" 1
1117 1 153 GLU HA 1 154 GLU H 3.100 . 4.300 3.453 3.404 3.534 . 0 0 "[ . 1 . 2]" 1
1118 1 153 GLU HA 1 155 ILE H 4.200 . 5.500 4.260 3.986 4.800 . 0 0 "[ . 1 . 2]" 1
1119 1 153 GLU HA 1 156 VAL H 3.500 . 5.000 3.524 3.281 3.794 . 0 0 "[ . 1 . 2]" 1
1120 1 153 GLU HA 1 157 ARG H 3.800 . 5.500 4.307 3.998 4.777 . 0 0 "[ . 1 . 2]" 1
1121 1 153 GLU HB2 1 154 GLU H 2.600 . 3.400 3.613 3.218 4.041 0.641 11 1 "[ . 1+ . 2]" 1
1122 1 153 GLU HB3 1 154 GLU H 2.900 . 4.000 3.175 2.724 3.415 . 0 0 "[ . 1 . 2]" 1
1123 1 153 GLU QG 1 157 ARG H 3.800 . 5.500 4.825 4.162 5.284 . 0 0 "[ . 1 . 2]" 1
1124 1 154 GLU H 1 154 GLU HA 2.700 . 3.600 2.831 2.770 2.864 . 0 0 "[ . 1 . 2]" 1
1125 1 154 GLU H 1 154 GLU HB2 2.400 . 3.100 2.311 2.090 2.556 . 0 0 "[ . 1 . 2]" 1
1126 1 154 GLU H 1 154 GLU HB3 2.400 . 3.100 2.791 2.517 3.099 . 0 0 "[ . 1 . 2]" 1
1127 1 154 GLU H 1 155 ILE H 2.500 . 3.300 2.616 2.479 2.886 . 0 0 "[ . 1 . 2]" 1
1128 1 154 GLU H 1 156 VAL H 3.500 . 5.000 4.250 3.970 4.483 . 0 0 "[ . 1 . 2]" 1
1129 1 154 GLU HA 1 155 ILE H 3.300 . 4.700 3.527 3.481 3.572 . 0 0 "[ . 1 . 2]" 1
1130 1 154 GLU HA 1 156 VAL H 4.400 . 5.500 4.679 4.340 4.941 . 0 0 "[ . 1 . 2]" 1
1131 1 154 GLU HA 1 157 ARG H 3.400 . 4.800 3.762 3.532 4.038 . 0 0 "[ . 1 . 2]" 1
1132 1 154 GLU HB3 1 155 ILE H 3.300 . 4.700 2.694 2.369 2.952 . 0 0 "[ . 1 . 2]" 1
1133 1 154 GLU HB3 1 156 VAL H 3.800 . 5.500 5.173 4.801 5.458 . 0 0 "[ . 1 . 2]" 1
1134 1 155 ILE H 1 155 ILE HA 2.900 . 4.000 2.843 2.801 2.865 . 0 0 "[ . 1 . 2]" 1
1135 1 155 ILE H 1 155 ILE HB 2.600 . 3.400 2.899 2.416 3.502 0.102 11 0 "[ . 1 . 2]" 1
1136 1 155 ILE H 1 155 ILE MD 3.100 . 4.300 3.388 3.180 3.694 . 0 0 "[ . 1 . 2]" 1
1137 1 155 ILE H 1 155 ILE HG13 2.800 . 5.500 1.766 1.437 2.376 . 0 0 "[ . 1 . 2]" 1
1138 1 155 ILE H 1 155 ILE MG 2.900 . 4.000 3.642 2.965 3.784 . 0 0 "[ . 1 . 2]" 1
1139 1 155 ILE H 1 156 VAL H 2.800 . 3.800 2.645 2.494 2.809 . 0 0 "[ . 1 . 2]" 1
1140 1 155 ILE H 1 157 ARG H 3.700 . 5.400 4.044 3.830 4.523 . 0 0 "[ . 1 . 2]" 1
1141 1 155 ILE HA 1 156 VAL H 3.400 . 4.800 3.550 3.510 3.574 . 0 0 "[ . 1 . 2]" 1
1142 1 155 ILE HA 1 157 ARG H 3.600 . 5.200 4.194 3.778 4.537 . 0 0 "[ . 1 . 2]" 1
1143 1 155 ILE HA 1 158 ASP H 3.400 . 4.800 3.558 3.163 3.840 . 0 0 "[ . 1 . 2]" 1
1144 1 155 ILE HA 1 159 LEU H 3.900 . 5.500 3.823 3.227 4.286 . 0 0 "[ . 1 . 2]" 1
1145 1 155 ILE HB 1 156 VAL H 3.400 . 4.800 2.618 2.228 3.172 . 0 0 "[ . 1 . 2]" 1
1146 1 155 ILE MD 1 156 VAL H 2.800 . 5.500 4.058 3.445 4.563 . 0 0 "[ . 1 . 2]" 1
1147 1 155 ILE MD 1 165 VAL H 3.300 . 4.700 4.731 4.522 4.806 0.106 13 0 "[ . 1 . 2]" 1
1148 1 155 ILE MD 1 166 LEU H 3.500 . 5.000 3.955 3.412 4.825 . 0 0 "[ . 1 . 2]" 1
1149 1 155 ILE QG 1 158 ASP H 4.100 . 5.500 5.507 5.350 5.555 0.055 15 0 "[ . 1 . 2]" 1
1150 1 155 ILE HG13 1 156 VAL H 3.500 . 5.000 3.510 2.041 4.331 . 0 0 "[ . 1 . 2]" 1
1151 1 156 VAL H 1 156 VAL HA 2.800 . 3.800 2.790 2.731 2.840 . 0 0 "[ . 1 . 2]" 1
1152 1 156 VAL H 1 156 VAL HB 2.900 . 4.000 2.892 2.221 3.609 . 0 0 "[ . 1 . 2]" 1
1153 1 156 VAL H 1 156 VAL MG2 2.400 . 3.100 2.425 1.740 3.752 0.652 14 6 "[ * * 1- *+. *2]" 1
1154 1 156 VAL H 1 157 ARG H 2.700 . 3.600 2.718 2.506 2.926 . 0 0 "[ . 1 . 2]" 1
1155 1 156 VAL H 1 158 ASP H 3.700 . 5.400 4.445 4.042 4.725 . 0 0 "[ . 1 . 2]" 1
1156 1 156 VAL HA 1 157 ARG H 3.200 . 4.500 3.504 3.418 3.561 . 0 0 "[ . 1 . 2]" 1
1157 1 156 VAL HA 1 158 ASP H 3.700 . 5.400 4.776 4.334 5.107 . 0 0 "[ . 1 . 2]" 1
1158 1 156 VAL HA 1 159 LEU H 3.000 . 4.100 3.806 3.382 4.124 0.024 1 0 "[ . 1 . 2]" 1
1159 1 156 VAL HB 1 157 ARG H 2.800 . 3.800 3.328 2.436 3.867 0.067 14 0 "[ . 1 . 2]" 1
1160 1 156 VAL MG2 1 157 ARG H 2.800 . 3.800 3.274 2.095 4.255 0.455 19 0 "[ . 1 . 2]" 1
1161 1 157 ARG H 1 157 ARG HA 2.500 . 3.300 2.851 2.820 2.869 . 0 0 "[ . 1 . 2]" 1
1162 1 157 ARG H 1 157 ARG HB3 2.200 . 2.800 2.810 2.125 3.593 0.793 7 8 "[ - * + 1* **.* * 2]" 1
1163 1 157 ARG H 1 157 ARG HG2 3.200 . 4.500 3.730 2.425 4.507 0.007 20 0 "[ . 1 . 2]" 1
1164 1 157 ARG H 1 157 ARG HG3 2.900 . 4.000 3.918 2.052 4.516 0.516 10 3 "[ . *+ - 2]" 1
1165 1 157 ARG H 1 158 ASP H 2.600 . 3.400 2.627 2.475 2.769 . 0 0 "[ . 1 . 2]" 1
1166 1 157 ARG H 1 159 LEU H 3.500 . 5.000 3.939 3.610 4.255 . 0 0 "[ . 1 . 2]" 1
1167 1 157 ARG HA 1 158 ASP H 2.900 . 4.000 3.557 3.497 3.573 . 0 0 "[ . 1 . 2]" 1
1168 1 157 ARG HB3 1 158 ASP H 2.600 . 3.400 2.874 2.178 3.985 0.585 7 1 "[ . + 1 . 2]" 1
1169 1 157 ARG HB3 1 159 LEU H 3.500 . 5.000 5.088 4.744 5.655 0.655 18 3 "[ . * 1 -. + 2]" 1
1170 1 157 ARG HG2 1 158 ASP H 3.300 . 4.700 3.937 2.635 4.874 0.174 16 0 "[ . 1 . 2]" 1
1171 1 157 ARG HG3 1 158 ASP H 3.500 . 5.000 4.203 2.613 4.946 . 0 0 "[ . 1 . 2]" 1
1172 1 158 ASP H 1 158 ASP HA 2.700 . 3.600 2.833 2.777 2.864 . 0 0 "[ . 1 . 2]" 1
1173 1 158 ASP H 1 158 ASP HB3 2.300 . 3.000 3.160 2.625 3.587 0.587 6 4 "[ * .+ 1 . - *2]" 1
1174 1 158 ASP H 1 159 LEU H 2.500 . 3.300 2.623 2.460 2.795 . 0 0 "[ . 1 . 2]" 1
1175 1 158 ASP HA 1 159 LEU H 3.200 . 4.500 3.505 3.432 3.570 . 0 0 "[ . 1 . 2]" 1
1176 1 158 ASP QB 1 159 LEU H 2.600 . 3.400 2.761 2.270 3.082 . 0 0 "[ . 1 . 2]" 1
1177 1 159 LEU H 1 159 LEU HA 2.700 . 3.600 2.932 2.906 2.945 . 0 0 "[ . 1 . 2]" 1
1178 1 159 LEU H 1 159 LEU HB2 2.700 . 3.600 2.722 2.376 3.673 0.073 6 0 "[ . 1 . 2]" 1
1179 1 159 LEU H 1 159 LEU HB3 2.900 . 4.000 3.539 2.914 3.720 . 0 0 "[ . 1 . 2]" 1
1180 1 159 LEU H 1 159 LEU QD 3.000 . 4.100 2.524 1.877 3.417 0.023 12 0 "[ . 1 . 2]" 1
1181 1 159 LEU H 1 160 ASP H 3.000 . 5.500 3.493 2.995 3.780 . 0 0 "[ . 1 . 2]" 1
1182 1 159 LEU HA 1 160 ASP H 2.700 . 3.600 2.476 2.312 2.822 . 0 0 "[ . 1 . 2]" 1
1183 1 159 LEU HB2 1 160 ASP H 3.500 . 5.000 4.438 4.376 4.482 . 0 0 "[ . 1 . 2]" 1
1184 1 159 LEU HB2 1 165 VAL H 2.700 . 5.500 5.259 4.181 5.548 0.048 3 0 "[ . 1 . 2]" 1
1185 1 159 LEU HB3 1 160 ASP H 3.200 . 4.500 4.317 4.129 4.650 0.150 7 0 "[ . 1 . 2]" 1
1186 1 159 LEU HB3 1 161 ALA H 3.300 . 4.700 4.349 3.549 5.632 0.932 13 4 "[ .*- 1* + . 2]" 1
1187 1 159 LEU HB3 1 162 VAL H 3.300 . 4.700 3.144 2.217 4.797 0.097 13 0 "[ . 1 . 2]" 1
1188 1 159 LEU QD 1 160 ASP H 2.900 . 4.000 3.826 3.657 3.966 . 0 0 "[ . 1 . 2]" 1
1189 1 159 LEU QD 1 161 ALA H 3.500 . 5.000 4.576 4.079 4.823 . 0 0 "[ . 1 . 2]" 1
1190 1 159 LEU QD 1 162 VAL H 3.500 . 5.000 3.909 3.311 4.108 . 0 0 "[ . 1 . 2]" 1
1191 1 159 LEU QD 1 163 ASP H 3.900 . 5.500 3.166 1.938 3.851 0.062 9 0 "[ . 1 . 2]" 1
1192 1 160 ASP H 1 160 ASP HB2 2.500 . 3.300 2.340 2.106 3.089 . 0 0 "[ . 1 . 2]" 1
1193 1 160 ASP H 1 160 ASP HB3 2.600 . 3.400 3.165 2.750 3.460 0.060 20 0 "[ . 1 . 2]" 1
1194 1 160 ASP H 1 161 ALA H 2.900 . 4.000 3.380 3.042 3.584 . 0 0 "[ . 1 . 2]" 1
1195 1 160 ASP H 1 162 VAL H 3.500 . 5.000 4.219 3.907 4.431 . 0 0 "[ . 1 . 2]" 1
1196 1 160 ASP HA 1 161 ALA H 2.700 . 3.600 3.567 3.507 3.580 . 0 0 "[ . 1 . 2]" 1
1197 1 160 ASP HB2 1 161 ALA H 3.300 . 4.700 3.417 2.677 4.029 . 0 0 "[ . 1 . 2]" 1
1198 1 160 ASP HB2 1 162 VAL H 4.000 . 5.500 4.958 4.452 5.624 0.124 9 0 "[ . 1 . 2]" 1
1199 1 160 ASP HB3 1 161 ALA H 3.300 . 4.700 2.403 2.025 3.989 . 0 0 "[ . 1 . 2]" 1
1200 1 161 ALA H 1 161 ALA HA 2.300 . 3.000 2.884 2.836 2.905 . 0 0 "[ . 1 . 2]" 1
1201 1 161 ALA H 1 161 ALA MB 2.200 . 5.500 2.739 2.643 2.893 . 0 0 "[ . 1 . 2]" 1
1202 1 161 ALA H 1 162 VAL H 2.500 . 5.500 1.832 1.630 2.014 . 0 0 "[ . 1 . 2]" 1
1203 1 161 ALA HA 1 162 VAL H 2.400 . 5.500 3.072 2.973 3.187 . 0 0 "[ . 1 . 2]" 1
1204 1 161 ALA MB 1 162 VAL H 2.700 . 3.600 3.533 3.429 3.608 0.008 17 0 "[ . 1 . 2]" 1
1205 1 162 VAL H 1 162 VAL HA 2.600 . 3.400 2.894 2.886 2.899 . 0 0 "[ . 1 . 2]" 1
1206 1 162 VAL H 1 162 VAL HB 2.500 . 3.300 2.884 2.566 3.043 . 0 0 "[ . 1 . 2]" 1
1207 1 162 VAL H 1 162 VAL QG 2.200 . 2.800 1.910 1.581 2.324 0.019 12 0 "[ . 1 . 2]" 1
1208 1 162 VAL H 1 163 ASP H 3.300 . 4.700 2.901 2.404 3.332 . 0 0 "[ . 1 . 2]" 1
1209 1 162 VAL HA 1 164 LEU H 3.400 . 5.500 5.286 4.948 5.538 0.038 19 0 "[ . 1 . 2]" 1
1210 1 162 VAL HB 1 163 ASP H 2.900 . 4.000 3.135 1.732 3.936 0.068 5 0 "[ . 1 . 2]" 1
1211 1 163 ASP H 1 163 ASP HA 2.800 . 3.800 2.932 2.879 2.944 . 0 0 "[ . 1 . 2]" 1
1212 1 163 ASP H 1 163 ASP HB3 2.500 . 3.300 3.089 2.312 3.737 0.437 19 0 "[ . 1 . 2]" 1
1213 1 163 ASP H 1 164 LEU H 2.600 . 5.500 4.052 3.934 4.286 . 0 0 "[ . 1 . 2]" 1
1214 1 163 ASP HA 1 164 LEU H 3.100 . 4.300 2.207 2.144 2.279 . 0 0 "[ . 1 . 2]" 1
1215 1 163 ASP HB2 1 164 LEU H 3.500 . 5.000 4.242 3.811 4.671 . 0 0 "[ . 1 . 2]" 1
1216 1 163 ASP HB3 1 164 LEU H 2.600 . 5.500 4.299 3.659 4.513 . 0 0 "[ . 1 . 2]" 1
1217 1 164 LEU H 1 164 LEU HA 2.900 . 4.000 2.814 2.767 2.860 . 0 0 "[ . 1 . 2]" 1
1218 1 164 LEU H 1 164 LEU HB2 2.900 . 4.000 2.238 2.043 3.571 . 0 0 "[ . 1 . 2]" 1
1219 1 164 LEU H 1 164 LEU HB3 2.800 . 3.800 3.166 2.114 3.574 . 0 0 "[ . 1 . 2]" 1
1220 1 164 LEU H 1 164 LEU QD 2.600 . 3.400 2.855 2.298 3.325 . 0 0 "[ . 1 . 2]" 1
1221 1 164 LEU H 1 164 LEU HG 3.100 . 4.300 4.010 1.876 4.339 0.039 5 0 "[ . 1 . 2]" 1
1222 1 164 LEU H 1 165 VAL H 3.700 . 5.400 4.506 3.697 4.615 . 0 0 "[ . 1 . 2]" 1
1223 1 164 LEU HA 1 165 VAL H 2.500 . 3.300 2.166 2.123 2.502 . 0 0 "[ . 1 . 2]" 1
1224 1 164 LEU HB3 1 165 VAL H 3.400 . 4.800 3.672 3.259 4.303 . 0 0 "[ . 1 . 2]" 1
1225 1 165 VAL H 1 165 VAL HB 3.200 . 4.500 2.721 2.238 3.614 . 0 0 "[ . 1 . 2]" 1
1226 1 165 VAL H 1 165 VAL MG1 2.700 . 3.600 2.510 2.040 3.651 0.051 19 0 "[ . 1 . 2]" 1
1227 1 165 VAL H 1 166 LEU H 3.700 . 5.400 4.444 2.916 4.593 . 0 0 "[ . 1 . 2]" 1
1228 1 165 VAL HA 1 166 LEU H 2.400 . 3.100 2.691 2.491 3.048 . 0 0 "[ . 1 . 2]" 1
1229 1 165 VAL HB 1 166 LEU H 3.200 . 4.500 3.166 1.864 4.037 0.036 10 0 "[ . 1 . 2]" 1
1230 1 165 VAL MG2 1 166 LEU H 2.600 . 5.500 2.082 1.332 3.981 . 0 0 "[ . 1 . 2]" 1
1231 1 166 LEU H 1 166 LEU HB2 3.000 . 4.100 3.726 3.588 3.935 . 0 0 "[ . 1 . 2]" 1
1232 1 166 LEU H 1 166 LEU HB3 2.900 . 4.000 3.297 3.026 3.560 . 0 0 "[ . 1 . 2]" 1
1233 1 166 LEU H 1 166 LEU MD2 3.200 . 4.500 2.408 1.706 3.956 0.194 11 0 "[ . 1 . 2]" 1
1234 1 166 LEU H 1 166 LEU HG 3.900 . 5.500 3.487 2.108 3.923 . 0 0 "[ . 1 . 2]" 1
1235 1 166 LEU HA 1 167 ASP H 2.300 . 3.000 2.294 2.128 2.882 . 0 0 "[ . 1 . 2]" 1
1236 1 166 LEU HB2 1 167 ASP H 3.200 . 4.500 2.954 2.317 4.491 . 0 0 "[ . 1 . 2]" 1
1237 1 166 LEU HB3 1 167 ASP H 3.200 . 4.500 3.851 3.432 4.581 0.081 19 0 "[ . 1 . 2]" 1
1238 1 166 LEU MD1 1 168 ALA H 3.600 . 5.200 4.477 2.914 5.302 0.102 19 0 "[ . 1 . 2]" 1
1239 1 166 LEU MD2 1 167 ASP H 3.100 . 4.300 4.040 3.418 4.962 0.662 20 4 "[ . *1- * . +]" 1
1240 1 167 ASP H 1 167 ASP HA 2.900 . 4.000 2.910 2.832 2.923 . 0 0 "[ . 1 . 2]" 1
1241 1 167 ASP H 1 167 ASP HB2 2.600 . 3.400 2.525 2.176 3.464 0.064 20 0 "[ . 1 . 2]" 1
1242 1 167 ASP H 1 169 GLY H 3.400 . 4.800 4.299 3.673 4.668 . 0 0 "[ . 1 . 2]" 1
1243 1 167 ASP HA 1 168 ALA H 2.400 . 5.500 3.397 3.265 3.531 . 0 0 "[ . 1 . 2]" 1
1244 1 167 ASP HB2 1 168 ALA H 3.800 . 5.500 3.736 2.206 4.119 . 0 0 "[ . 1 . 2]" 1
1245 1 167 ASP HB3 1 168 ALA H 3.400 . 4.800 3.425 2.330 4.571 . 0 0 "[ . 1 . 2]" 1
1246 1 167 ASP HB3 1 169 GLY H 4.100 . 5.500 5.536 4.478 6.035 0.535 18 3 "[ . 1 *. + -]" 1
1247 1 168 ALA H 1 168 ALA HA 3.000 . 4.100 2.867 2.815 2.919 . 0 0 "[ . 1 . 2]" 1
1248 1 168 ALA H 1 168 ALA MB 2.700 . 3.600 2.169 2.048 2.290 . 0 0 "[ . 1 . 2]" 1
1249 1 168 ALA H 1 169 GLY H 2.800 . 5.500 2.542 2.203 2.984 . 0 0 "[ . 1 . 2]" 1
1250 1 168 ALA HA 1 169 GLY H 2.900 . 4.000 3.538 3.493 3.570 . 0 0 "[ . 1 . 2]" 1
1251 1 168 ALA MB 1 169 GLY H 3.100 . 4.300 2.509 2.101 2.817 . 0 0 "[ . 1 . 2]" 1
1252 1 169 GLY H 1 169 GLY HA2 2.500 . 3.300 2.366 2.320 2.403 . 0 0 "[ . 1 . 2]" 1
1253 1 169 GLY H 1 169 GLY HA3 2.500 . 3.300 2.924 2.883 2.947 . 0 0 "[ . 1 . 2]" 1
1254 1 169 GLY H 1 170 ASP H 3.300 . 4.700 3.983 2.383 4.597 . 0 0 "[ . 1 . 2]" 1
1255 1 169 GLY HA2 1 170 ASP H 2.700 . 3.600 2.633 2.122 2.969 . 0 0 "[ . 1 . 2]" 1
1256 1 169 GLY HA3 1 170 ASP H 2.700 . 3.600 2.794 2.297 3.570 . 0 0 "[ . 1 . 2]" 1
1257 1 170 ASP H 1 170 ASP HA 3.000 . 4.100 2.848 2.807 2.863 . 0 0 "[ . 1 . 2]" 1
1258 1 170 ASP H 1 170 ASP HB2 2.800 . 3.800 3.034 2.080 3.600 . 0 0 "[ . 1 . 2]" 1
1259 1 170 ASP H 1 170 ASP HB3 2.800 . 3.800 3.049 2.468 3.594 . 0 0 "[ . 1 . 2]" 1
1260 1 170 ASP H 1 171 CYS H 3.900 . 5.500 4.372 3.755 4.563 . 0 0 "[ . 1 . 2]" 1
1261 1 170 ASP HA 1 171 CYS H 2.900 . 4.000 2.745 2.125 3.350 . 0 0 "[ . 1 . 2]" 1
1262 1 170 ASP HB2 1 171 CYS H 3.100 . 4.300 2.537 1.779 4.329 0.121 8 0 "[ . 1 . 2]" 1
1263 1 170 ASP HB3 1 171 CYS H 2.900 . 4.000 2.940 1.787 3.820 0.013 18 0 "[ . 1 . 2]" 1
1264 1 171 CYS H 1 171 CYS HA 3.000 . 4.100 2.913 2.872 2.933 . 0 0 "[ . 1 . 2]" 1
1265 1 171 CYS H 1 171 CYS QB 2.600 . 3.400 2.706 2.586 3.354 . 0 0 "[ . 1 . 2]" 1
1266 1 171 CYS H 1 172 LEU H 3.900 . 5.500 2.956 2.116 4.316 . 0 0 "[ . 1 . 2]" 1
1267 1 171 CYS HB2 1 172 LEU H 3.100 . 4.300 3.166 2.366 4.476 0.176 13 0 "[ . 1 . 2]" 1
1268 1 172 LEU H 1 172 LEU HA 2.400 . 3.100 2.929 2.882 2.945 . 0 0 "[ . 1 . 2]" 1
1269 1 172 LEU H 1 172 LEU QB 2.400 . 3.100 2.566 2.443 2.749 . 0 0 "[ . 1 . 2]" 1
1270 1 172 LEU H 1 172 LEU MD1 3.600 . 5.200 4.173 3.571 4.438 . 0 0 "[ . 1 . 2]" 1
1271 1 172 LEU H 1 172 LEU MD2 3.400 . 4.800 4.412 3.534 4.857 0.057 14 0 "[ . 1 . 2]" 1
1272 1 172 LEU H 1 173 ASP H 2.900 . 4.000 3.478 1.835 3.988 . 0 0 "[ . 1 . 2]" 1
1273 1 172 LEU HA 1 173 ASP H 2.700 . 3.600 3.183 2.842 3.437 . 0 0 "[ . 1 . 2]" 1
1274 1 172 LEU QB 1 173 ASP H 2.800 . 5.500 1.921 1.319 3.874 . 0 0 "[ . 1 . 2]" 1
1275 1 173 ASP H 1 173 ASP QB 3.000 . 4.100 2.223 2.115 2.695 . 0 0 "[ . 1 . 2]" 1
1276 1 178 THR H 1 178 THR HA 2.400 . 3.100 2.933 2.927 2.936 . 0 0 "[ . 1 . 2]" 1
1277 1 178 THR H 1 178 THR HB 2.800 . 3.800 2.656 2.317 3.249 . 0 0 "[ . 1 . 2]" 1
1278 1 178 THR H 1 178 THR MG 2.800 . 3.800 3.782 3.560 3.827 0.027 14 0 "[ . 1 . 2]" 1
1279 1 178 THR H 1 179 VAL H 3.600 . 5.200 4.515 4.428 4.548 . 0 0 "[ . 1 . 2]" 1
1280 1 178 THR HA 1 179 VAL H 3.800 . 5.500 2.197 2.139 2.299 . 0 0 "[ . 1 . 2]" 1
1281 1 178 THR HA 1 191 ARG HA 2.600 . 3.000 2.270 2.148 2.447 . 0 0 "[ . 1 . 2]" 1
1282 1 178 THR MG 1 179 VAL H 2.800 . 3.800 2.369 1.854 3.144 . 0 0 "[ . 1 . 2]" 1
1283 1 179 VAL H 1 179 VAL HB 2.900 . 4.000 2.899 2.722 3.658 . 0 0 "[ . 1 . 2]" 1
1284 1 179 VAL H 1 179 VAL MG1 2.800 . 3.800 3.892 3.455 3.956 0.156 4 0 "[ . 1 . 2]" 1
1285 1 179 VAL H 1 179 VAL MG2 3.000 . 4.100 2.632 1.819 2.955 0.081 14 0 "[ . 1 . 2]" 1
1286 1 179 VAL H 1 190 LEU H 4.400 . 5.500 4.101 3.744 4.275 . 0 0 "[ . 1 . 2]" 1
1287 1 179 VAL H 1 190 LEU HA 3.700 . 5.400 5.211 4.919 5.402 0.002 18 0 "[ . 1 . 2]" 1
1288 1 179 VAL H 1 191 ARG H 4.000 . 5.000 4.420 4.101 4.756 . 0 0 "[ . 1 . 2]" 1
1289 1 179 VAL H 1 191 ARG HA 4.000 . 5.000 2.286 1.898 2.640 . 0 0 "[ . 1 . 2]" 1
1290 1 179 VAL H 1 191 ARG QB 3.200 . 4.500 3.751 3.110 4.324 . 0 0 "[ . 1 . 2]" 1
1291 1 179 VAL HB 1 190 LEU H 3.600 . 5.200 4.611 4.295 5.207 0.007 11 0 "[ . 1 . 2]" 1
1292 1 180 ILE HA 1 181 ASP H 2.200 . 2.800 2.171 2.136 2.196 . 0 0 "[ . 1 . 2]" 1
1293 1 180 ILE HA 1 189 VAL HA 2.600 . 3.000 2.693 2.395 3.019 0.019 18 0 "[ . 1 . 2]" 1
1294 1 180 ILE HA 1 190 LEU H 3.000 . 4.100 2.304 2.151 2.537 . 0 0 "[ . 1 . 2]" 1
1295 1 180 ILE HB 1 181 ASP H 3.000 . 4.100 4.053 3.958 4.134 0.034 1 0 "[ . 1 . 2]" 1
1296 1 180 ILE HG12 1 181 ASP H 3.800 . 5.500 4.632 4.285 5.087 . 0 0 "[ . 1 . 2]" 1
1297 1 180 ILE HG12 1 189 VAL H 4.200 . 5.500 4.509 4.232 5.318 . 0 0 "[ . 1 . 2]" 1
1298 1 180 ILE HG13 1 181 ASP H 4.100 . 5.500 4.854 4.507 5.038 . 0 0 "[ . 1 . 2]" 1
1299 1 180 ILE MG 1 181 ASP H 2.600 . 3.400 2.356 2.088 2.638 . 0 0 "[ . 1 . 2]" 1
1300 1 180 ILE MG 1 189 VAL H 2.800 . 3.800 3.008 2.844 3.484 . 0 0 "[ . 1 . 2]" 1
1301 1 181 ASP H 1 181 ASP HB2 2.800 . 3.800 2.540 2.196 2.910 . 0 0 "[ . 1 . 2]" 1
1302 1 181 ASP H 1 181 ASP HB3 2.700 . 3.600 3.478 2.787 3.754 0.154 14 0 "[ . 1 . 2]" 1
1303 1 181 ASP H 1 182 LEU H 3.900 . 5.500 3.566 3.346 3.801 . 0 0 "[ . 1 . 2]" 1
1304 1 181 ASP H 1 187 PRO HA 4.000 . 5.500 5.311 4.909 5.507 0.007 1 0 "[ . 1 . 2]" 1
1305 1 181 ASP H 1 187 PRO QB 4.300 . 5.500 5.393 4.082 5.523 0.023 19 0 "[ . 1 . 2]" 1
1306 1 181 ASP H 1 188 ARG H 3.100 . 4.300 3.387 3.077 3.592 . 0 0 "[ . 1 . 2]" 1
1307 1 181 ASP H 1 188 ARG HB3 3.500 . 5.000 3.108 2.384 4.987 . 0 0 "[ . 1 . 2]" 1
1308 1 181 ASP H 1 189 VAL HA 3.200 . 4.500 3.871 3.558 4.261 . 0 0 "[ . 1 . 2]" 1
1309 1 181 ASP H 1 190 LEU H 3.600 . 5.200 3.916 3.637 4.271 . 0 0 "[ . 1 . 2]" 1
1310 1 181 ASP H 1 190 LEU HB2 3.100 . 4.300 4.356 4.229 5.172 0.872 19 1 "[ . 1 . +2]" 1
1311 1 181 ASP H 1 190 LEU HB3 4.300 . 5.500 5.405 4.365 5.533 0.033 1 0 "[ . 1 . 2]" 1
1312 1 181 ASP HA 1 182 LEU H 2.400 . 3.100 2.435 2.355 2.520 . 0 0 "[ . 1 . 2]" 1
1313 1 181 ASP HB2 1 182 LEU H 3.500 . 5.000 4.511 4.357 4.658 . 0 0 "[ . 1 . 2]" 1
1314 1 181 ASP HB3 1 188 ARG H 3.800 . 5.500 4.492 3.384 5.319 . 0 0 "[ . 1 . 2]" 1
1315 1 182 LEU H 1 182 LEU HB2 2.600 . 3.400 2.529 2.109 2.892 . 0 0 "[ . 1 . 2]" 1
1316 1 182 LEU H 1 182 LEU HB3 2.600 . 3.400 2.556 2.226 3.119 . 0 0 "[ . 1 . 2]" 1
1317 1 182 LEU H 1 182 LEU QD 3.500 . 5.000 3.662 3.216 3.763 . 0 0 "[ . 1 . 2]" 1
1318 1 182 LEU H 1 183 THR H 3.200 . 4.500 4.109 3.925 4.338 . 0 0 "[ . 1 . 2]" 1
1319 1 182 LEU H 1 183 THR MG 3.300 . 5.500 5.278 4.792 5.481 . 0 0 "[ . 1 . 2]" 1
1320 1 182 LEU HA 1 183 THR H 2.800 . 3.800 2.290 2.163 2.403 . 0 0 "[ . 1 . 2]" 1
1321 1 182 LEU HA 1 184 VAL H 2.700 . 5.500 4.772 4.565 5.186 . 0 0 "[ . 1 . 2]" 1
1322 1 182 LEU HA 1 187 PRO HA 2.600 . 3.000 2.463 1.971 3.008 0.008 16 0 "[ . 1 . 2]" 1
1323 1 182 LEU HA 1 188 ARG H 4.000 . 5.000 2.860 2.205 3.936 . 0 0 "[ . 1 . 2]" 1
1324 1 182 LEU HB2 1 183 THR H 3.500 . 5.000 4.568 4.364 4.681 . 0 0 "[ . 1 . 2]" 1
1325 1 182 LEU HB3 1 183 THR H 3.300 . 4.700 4.447 4.242 4.564 . 0 0 "[ . 1 . 2]" 1
1326 1 182 LEU QD 1 184 VAL H 3.300 . 4.700 3.975 3.403 4.557 . 0 0 "[ . 1 . 2]" 1
1327 1 182 LEU QD 1 188 ARG H 3.500 . 5.500 4.041 3.579 4.922 . 0 0 "[ . 1 . 2]" 1
1328 1 183 THR H 1 183 THR HA 2.800 . 3.800 2.881 2.840 2.900 . 0 0 "[ . 1 . 2]" 1
1329 1 183 THR H 1 183 THR MG 2.700 . 3.600 3.221 2.981 3.382 . 0 0 "[ . 1 . 2]" 1
1330 1 183 THR H 1 184 VAL H 2.400 . 3.100 3.025 2.860 3.225 0.125 20 0 "[ . 1 . 2]" 1
1331 1 183 THR HA 1 184 VAL H 2.900 . 4.000 3.543 3.468 3.573 . 0 0 "[ . 1 . 2]" 1
1332 1 183 THR HB 1 184 VAL H 3.200 . 4.500 2.142 1.954 2.423 . 0 0 "[ . 1 . 2]" 1
1333 1 183 THR HB 1 185 ASN H 3.700 . 5.400 5.252 4.061 5.456 0.056 2 0 "[ . 1 . 2]" 1
1334 1 183 THR MG 1 184 VAL H 3.000 . 5.500 3.693 3.557 3.827 . 0 0 "[ . 1 . 2]" 1
1335 1 184 VAL H 1 184 VAL HA 2.500 . 3.300 2.944 2.939 2.946 . 0 0 "[ . 1 . 2]" 1
1336 1 184 VAL H 1 184 VAL HB 2.800 . 3.800 2.866 2.747 3.323 . 0 0 "[ . 1 . 2]" 1
1337 1 184 VAL H 1 184 VAL QG 2.300 . 3.000 2.462 1.851 2.768 . 0 0 "[ . 1 . 2]" 1
1338 1 184 VAL H 1 185 ASN H 3.400 . 4.800 3.524 2.308 3.831 . 0 0 "[ . 1 . 2]" 1
1339 1 184 VAL HA 1 185 ASN H 2.100 . 5.500 3.343 3.231 3.551 . 0 0 "[ . 1 . 2]" 1
1340 1 184 VAL HB 1 185 ASN H 2.700 . 3.600 1.855 1.741 3.476 0.059 15 0 "[ . 1 . 2]" 1
1341 1 184 VAL QG 1 185 ASN H 2.600 . 3.400 2.108 1.697 3.017 0.103 9 0 "[ . 1 . 2]" 1
1342 1 185 ASN H 1 185 ASN HA 2.700 . 3.600 2.821 2.779 2.902 . 0 0 "[ . 1 . 2]" 1
1343 1 185 ASN H 1 185 ASN HB2 2.600 . 3.400 2.445 2.068 3.275 . 0 0 "[ . 1 . 2]" 1
1344 1 185 ASN H 1 185 ASN HB3 2.500 . 3.300 3.155 2.643 3.438 0.138 7 0 "[ . 1 . 2]" 1
1345 1 187 PRO HA 1 188 ARG H 2.900 . 4.000 2.173 2.153 2.271 . 0 0 "[ . 1 . 2]" 1
1346 1 187 PRO QB 1 188 ARG H 3.700 . 5.400 3.298 2.787 3.531 . 0 0 "[ . 1 . 2]" 1
1347 1 188 ARG H 1 188 ARG HB2 3.400 . 4.800 2.417 2.183 3.616 . 0 0 "[ . 1 . 2]" 1
1348 1 188 ARG H 1 188 ARG HB3 3.400 . 4.800 3.547 3.183 3.682 . 0 0 "[ . 1 . 2]" 1
1349 1 188 ARG H 1 188 ARG QG 3.700 . 5.400 2.885 2.112 3.659 . 0 0 "[ . 1 . 2]" 1
1350 1 188 ARG H 1 189 VAL H 4.500 . 5.500 3.395 3.062 4.138 . 0 0 "[ . 1 . 2]" 1
1351 1 188 ARG HA 1 189 VAL H 2.200 . 2.800 2.598 2.165 2.780 . 0 0 "[ . 1 . 2]" 1
1352 1 188 ARG HB2 1 189 VAL H 3.100 . 4.300 4.337 3.851 4.396 0.096 13 0 "[ . 1 . 2]" 1
1353 1 188 ARG HB3 1 189 VAL H 3.100 . 4.300 4.332 4.300 4.360 0.060 18 0 "[ . 1 . 2]" 1
1354 1 188 ARG QG 1 189 VAL H 3.400 . 4.800 4.551 4.488 4.630 . 0 0 "[ . 1 . 2]" 1
1355 1 189 VAL H 1 189 VAL HB 2.600 . 3.400 2.712 2.556 2.926 . 0 0 "[ . 1 . 2]" 1
1356 1 189 VAL H 1 189 VAL MG2 2.600 . 3.400 2.101 1.807 3.763 0.363 1 0 "[ . 1 . 2]" 1
1357 1 189 VAL H 1 190 LEU H 4.600 . 5.500 4.311 4.179 4.426 . 0 0 "[ . 1 . 2]" 1
1358 1 189 VAL HA 1 190 LEU H 2.500 . 3.300 2.180 2.152 2.243 . 0 0 "[ . 1 . 2]" 1
1359 1 189 VAL HB 1 190 LEU H 3.900 . 5.500 4.340 4.174 4.435 . 0 0 "[ . 1 . 2]" 1
1360 1 189 VAL MG1 1 190 LEU H 2.600 . 3.400 3.179 2.831 4.280 0.880 1 1 "[+ . 1 . 2]" 1
1361 1 190 LEU H 1 190 LEU HB2 2.700 . 3.600 2.632 2.501 3.129 . 0 0 "[ . 1 . 2]" 1
1362 1 190 LEU H 1 190 LEU HB3 2.900 . 4.000 3.154 2.524 3.365 . 0 0 "[ . 1 . 2]" 1
1363 1 190 LEU H 1 191 ARG H 2.800 . 3.800 3.711 3.473 3.826 0.026 1 0 "[ . 1 . 2]" 1
1364 1 192 ARG QB 1 193 GLY H 3.300 . 4.700 3.436 2.120 3.999 . 0 0 "[ . 1 . 2]" 1
1365 1 193 GLY H 1 193 GLY HA2 2.500 . 3.300 2.912 2.880 2.936 . 0 0 "[ . 1 . 2]" 1
1366 1 193 GLY H 1 193 GLY HA3 2.800 . 3.800 2.347 2.315 2.379 . 0 0 "[ . 1 . 2]" 1
1367 1 193 GLY H 1 194 LYS H 3.500 . 5.000 4.194 2.768 4.609 . 0 0 "[ . 1 . 2]" 1
1368 1 193 GLY HA2 1 194 LYS H 2.500 . 3.300 2.409 2.137 3.074 . 0 0 "[ . 1 . 2]" 1
1369 1 193 GLY HA3 1 194 LYS H 2.700 . 3.600 3.115 2.281 3.567 . 0 0 "[ . 1 . 2]" 1
1370 1 194 LYS H 1 194 LYS HA 2.700 . 3.600 2.930 2.907 2.944 . 0 0 "[ . 1 . 2]" 1
1371 1 194 LYS H 1 194 LYS HB2 2.700 . 3.600 2.520 2.219 3.616 0.016 7 0 "[ . 1 . 2]" 1
1372 1 194 LYS H 1 194 LYS HB3 2.500 . 3.300 3.118 2.568 3.574 0.274 16 0 "[ . 1 . 2]" 1
1373 1 194 LYS H 1 194 LYS HG2 3.600 . 5.200 4.212 2.174 4.819 . 0 0 "[ . 1 . 2]" 1
1374 1 194 LYS H 1 194 LYS HG3 3.400 . 4.800 3.986 2.163 4.751 . 0 0 "[ . 1 . 2]" 1
1375 1 194 LYS H 1 195 GLY H 3.200 . 4.500 3.177 2.090 4.538 0.038 8 0 "[ . 1 . 2]" 1
1376 1 200 VAL H 1 200 VAL HA 2.900 . 4.000 2.831 2.774 2.868 . 0 0 "[ . 1 . 2]" 1
1377 1 200 VAL H 1 201 LEU H 2.700 . 5.500 4.344 2.901 4.636 . 0 0 "[ . 1 . 2]" 1
1378 1 200 VAL HA 1 201 LEU H 2.900 . 4.000 2.476 2.138 3.576 . 0 0 "[ . 1 . 2]" 1
1379 1 200 VAL HB 1 201 LEU H 2.700 . 5.500 3.304 1.563 4.355 . 0 0 "[ . 1 . 2]" 1
1380 1 200 VAL HB 1 202 LEU H 3.600 . 5.200 3.934 2.632 5.268 0.068 3 0 "[ . 1 . 2]" 1
1381 1 201 LEU H 1 201 LEU HA 2.600 . 3.400 2.931 2.897 2.947 . 0 0 "[ . 1 . 2]" 1
1382 1 201 LEU H 1 201 LEU HB2 2.700 . 5.500 3.058 2.150 3.725 . 0 0 "[ . 1 . 2]" 1
1383 1 201 LEU H 1 201 LEU HB3 2.500 . 3.300 3.292 2.921 3.668 0.368 7 0 "[ . 1 . 2]" 1
1384 1 201 LEU H 1 201 LEU MD2 2.800 . 3.800 3.085 1.893 4.448 0.648 19 3 "[ . 1 * - +2]" 1
1385 1 201 LEU H 1 201 LEU HG 3.800 . 5.500 2.908 1.976 4.772 0.024 6 0 "[ . 1 . 2]" 1
1386 1 201 LEU HA 1 202 LEU H 2.300 . 3.000 2.698 2.140 3.058 0.058 3 0 "[ . 1 . 2]" 1
1387 1 202 LEU H 1 202 LEU HB2 2.500 . 3.300 2.224 2.052 2.628 . 0 0 "[ . 1 . 2]" 1
1388 1 202 LEU H 1 202 LEU HB3 2.400 . 3.100 2.964 2.609 3.280 0.180 3 0 "[ . 1 . 2]" 1
1389 1 202 LEU H 1 202 LEU MD2 3.100 . 4.300 4.232 2.719 4.462 0.162 13 0 "[ . 1 . 2]" 1
1390 1 202 LEU HB2 1 203 ARG H 3.100 . 4.300 3.605 3.028 4.069 . 0 0 "[ . 1 . 2]" 1
1391 1 202 LEU HB3 1 203 ARG H 2.800 . 3.800 2.733 1.969 3.716 . 0 0 "[ . 1 . 2]" 1
1392 1 202 LEU MD1 1 203 ARG H 3.700 . 5.400 4.325 2.524 5.038 . 0 0 "[ . 1 . 2]" 1
1393 1 202 LEU MD2 1 203 ARG H 3.600 . 5.200 3.777 2.079 4.855 . 0 0 "[ . 1 . 2]" 1
1394 1 203 ARG H 1 203 ARG HA 2.400 . 3.100 2.896 2.851 2.937 . 0 0 "[ . 1 . 2]" 1
1395 1 203 ARG H 1 203 ARG HB2 2.600 . 3.400 2.596 2.089 3.678 0.278 16 0 "[ . 1 . 2]" 1
1396 1 203 ARG H 1 203 ARG HB3 2.900 . 4.000 3.329 2.590 3.650 . 0 0 "[ . 1 . 2]" 1
1397 1 203 ARG H 1 204 GLY H 3.700 . 5.400 3.563 2.223 4.610 . 0 0 "[ . 1 . 2]" 1
1398 1 203 ARG HA 1 204 GLY H 3.200 . 4.500 2.784 2.144 3.571 . 0 0 "[ . 1 . 2]" 1
1399 1 203 ARG HB2 1 204 GLY H 4.100 . 5.500 3.604 2.219 4.621 . 0 0 "[ . 1 . 2]" 1
1400 1 203 ARG HB3 1 204 GLY H 3.900 . 5.500 3.510 2.097 4.439 . 0 0 "[ . 1 . 2]" 1
1401 1 204 GLY H 1 204 GLY HA2 2.900 . 4.000 2.794 2.307 2.956 . 0 0 "[ . 1 . 2]" 1
1402 1 204 GLY HA2 1 205 ALA H 3.000 . 4.100 2.615 2.136 3.570 . 0 0 "[ . 1 . 2]" 1
1403 1 205 ALA H 1 205 ALA HA 2.700 . 3.600 2.917 2.849 2.944 . 0 0 "[ . 1 . 2]" 1
1404 1 205 ALA H 1 205 ALA MB 2.400 . 3.100 2.253 2.044 2.402 . 0 0 "[ . 1 . 2]" 1
1405 1 206 GLY HA2 1 207 ASP H 3.000 . 4.100 2.831 2.139 3.554 . 0 0 "[ . 1 . 2]" 1
1406 1 207 ASP H 1 207 ASP HB2 3.300 . 4.700 2.584 2.169 3.626 . 0 0 "[ . 1 . 2]" 1
1407 1 207 ASP H 1 207 ASP HB3 3.900 . 5.500 3.243 2.647 3.706 . 0 0 "[ . 1 . 2]" 1
1408 1 207 ASP H 1 208 VAL QG 2.800 . 3.800 3.331 2.952 3.678 . 0 0 "[ . 1 . 2]" 1
1409 1 207 ASP HB2 1 208 VAL H 3.700 . 5.400 3.656 2.443 4.261 . 0 0 "[ . 1 . 2]" 1
1410 1 207 ASP HB3 1 208 VAL H 3.100 . 4.300 3.724 2.065 4.559 0.259 5 0 "[ . 1 . 2]" 1
1411 1 208 VAL H 1 208 VAL HA 2.900 . 4.000 2.910 2.850 2.945 . 0 0 "[ . 1 . 2]" 1
1412 1 208 VAL H 1 208 VAL HB 3.600 . 5.200 3.122 2.563 3.692 . 0 0 "[ . 1 . 2]" 1
1413 1 208 VAL H 1 208 VAL QG 2.800 . 3.800 2.100 1.754 2.492 0.046 20 0 "[ . 1 . 2]" 1
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