NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
564713 |
2lw8   |
18613 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lw8
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 976
_Distance_constraint_stats_list.Viol_count 817
_Distance_constraint_stats_list.Viol_total 1127.094
_Distance_constraint_stats_list.Viol_max 1.575
_Distance_constraint_stats_list.Viol_rms 0.0846
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0115
_Distance_constraint_stats_list.Viol_average_violations_only 0.1380
_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 4 GLU 5.358 1.542 1 4 "[+ *. -* 1]"
1 6 THR 0.000 0.000 . 0 "[ . 1]"
1 7 LEU 6.652 1.575 10 6 "[* * * - *+]"
1 8 LEU 0.298 0.211 1 0 "[ . 1]"
1 9 ASP 3.927 0.864 7 4 "[* * + -]"
1 10 SER 0.250 0.081 7 0 "[ . 1]"
1 11 ARG 0.910 0.126 7 0 "[ . 1]"
1 12 SER 0.178 0.081 7 0 "[ . 1]"
1 13 VAL 0.565 0.294 8 0 "[ . 1]"
1 14 GLN 0.198 0.142 10 0 "[ . 1]"
1 15 GLY 0.326 0.294 8 0 "[ . 1]"
1 16 GLU 0.580 0.380 10 0 "[ . 1]"
1 17 LEU 1.326 0.380 10 0 "[ . 1]"
1 18 GLY 0.150 0.065 10 0 "[ . 1]"
1 19 TRP 0.596 0.237 10 0 "[ . 1]"
1 20 ILE 0.663 0.325 2 0 "[ . 1]"
1 21 ALA 0.129 0.086 3 0 "[ . 1]"
1 22 SER 0.086 0.086 3 0 "[ . 1]"
1 23 PRO 0.000 0.000 . 0 "[ . 1]"
1 24 LEU 0.160 0.093 3 0 "[ . 1]"
1 25 GLU 0.059 0.059 5 0 "[ . 1]"
1 26 GLY 0.576 0.518 5 1 "[ + 1]"
1 27 GLY 0.635 0.518 5 1 "[ + 1]"
1 28 TRP 0.301 0.148 5 0 "[ . 1]"
1 29 GLU 1.183 0.222 10 0 "[ . 1]"
1 30 GLU 6.332 0.910 10 7 "[* **.*- *+]"
1 31 VAL 0.670 0.108 7 0 "[ . 1]"
1 32 SER 0.000 0.000 . 0 "[ . 1]"
1 33 ILE 0.424 0.080 10 0 "[ . 1]"
1 34 MET 0.203 0.072 6 0 "[ . 1]"
1 35 ASP 4.178 1.128 6 4 "[ * .+-* 1]"
1 36 GLU 0.141 0.096 6 0 "[ . 1]"
1 37 LYS 4.301 1.128 6 4 "[ * .+-* 1]"
1 38 ASN 0.000 0.000 . 0 "[ . 1]"
1 39 THR 0.000 0.000 . 0 "[ . 1]"
1 40 PRO 0.129 0.050 1 0 "[ . 1]"
1 41 ILE 0.099 0.035 7 0 "[ . 1]"
1 42 ARG 0.000 0.000 . 0 "[ . 1]"
1 43 THR 9.270 0.910 10 7 "[* **.*- *+]"
1 44 TYR 1.111 0.164 10 0 "[ . 1]"
1 45 GLN 3.829 0.912 1 1 "[+ . 1]"
1 46 VAL 1.707 0.222 10 0 "[ . 1]"
1 47 CYS 4.875 0.585 5 7 "[* **+ * *-]"
1 48 ASN 0.000 0.000 . 0 "[ . 1]"
1 49 VAL 0.427 0.121 7 0 "[ . 1]"
1 52 PRO 0.251 0.239 6 0 "[ . 1]"
1 53 SER 0.239 0.239 6 0 "[ . 1]"
1 54 GLN 0.600 0.212 4 0 "[ . 1]"
1 55 ASN 3.694 0.731 10 4 "[* - *+]"
1 56 ASN 6.188 1.444 9 5 "[* - * +*]"
1 57 TRP 4.487 0.434 9 0 "[ . 1]"
1 58 LEU 0.133 0.050 1 0 "[ . 1]"
1 59 ARG 0.837 0.325 2 0 "[ . 1]"
1 60 THR 0.469 0.289 8 0 "[ . 1]"
1 64 THR 0.114 0.022 8 0 "[ . 1]"
1 65 ARG 1.521 0.729 5 1 "[ + 1]"
1 66 GLU 0.000 0.000 . 0 "[ . 1]"
1 67 GLY 0.000 0.000 . 0 "[ . 1]"
1 68 ALA 0.000 0.000 . 0 "[ . 1]"
1 70 ARG 0.287 0.100 6 0 "[ . 1]"
1 71 VAL 0.283 0.240 9 0 "[ . 1]"
1 72 TYR 0.165 0.060 6 0 "[ . 1]"
1 73 ILE 14.288 1.565 1 10 [+****-****]
1 74 GLU 2.966 0.885 7 3 "[ * + -1]"
1 75 ILE 1.685 0.204 5 0 "[ . 1]"
1 76 LYS 1.278 0.204 5 0 "[ . 1]"
1 77 PHE 1.065 0.128 3 0 "[ . 1]"
1 78 THR 0.058 0.037 2 0 "[ . 1]"
1 79 LEU 1.614 0.423 2 0 "[ . 1]"
1 80 ARG 2.405 0.490 5 0 "[ . 1]"
1 81 ASP 2.238 0.490 5 0 "[ . 1]"
1 82 CYS 0.146 0.080 7 0 "[ . 1]"
1 83 ASN 0.002 0.002 10 0 "[ . 1]"
1 84 SER 0.063 0.034 5 0 "[ . 1]"
1 85 LEU 0.211 0.080 7 0 "[ . 1]"
1 86 PRO 0.046 0.024 3 0 "[ . 1]"
1 87 GLY 0.508 0.472 10 0 "[ . 1]"
1 88 VAL 0.391 0.331 6 0 "[ . 1]"
1 89 MET 1.632 0.489 7 0 "[ . 1]"
1 90 GLY 2.400 0.556 10 2 "[ -. +]"
1 91 THR 3.067 0.556 10 2 "[ -. +]"
1 92 CYS 0.285 0.137 7 0 "[ . 1]"
1 93 LYS 0.446 0.121 7 0 "[ . 1]"
1 94 GLU 0.004 0.004 8 0 "[ . 1]"
1 95 THR 0.004 0.004 8 0 "[ . 1]"
1 96 PHE 0.304 0.061 5 0 "[ . 1]"
1 97 ASN 0.282 0.051 8 0 "[ . 1]"
1 98 LEU 0.329 0.090 5 0 "[ . 1]"
1 99 TYR 1.469 0.875 5 1 "[ + 1]"
1 100 TYR 0.372 0.106 7 0 "[ . 1]"
1 101 TYR 0.404 0.106 7 0 "[ . 1]"
1 102 GLU 4.027 1.181 6 3 "[*- .+ 1]"
1 103 SER 0.002 0.002 8 0 "[ . 1]"
1 104 ASP 0.000 0.000 . 0 "[ . 1]"
1 105 ASN 0.000 0.000 . 0 "[ . 1]"
1 110 PHE 0.000 0.000 . 0 "[ . 1]"
1 111 ILE 0.000 0.000 . 0 "[ . 1]"
1 112 ARG 0.227 0.175 9 0 "[ . 1]"
1 113 GLU 0.000 0.000 . 0 "[ . 1]"
1 114 ASN 0.227 0.175 9 0 "[ . 1]"
1 116 PHE 0.000 0.000 . 0 "[ . 1]"
1 117 VAL 0.110 0.053 10 0 "[ . 1]"
1 118 LYS 0.026 0.026 7 0 "[ . 1]"
1 119 ILE 0.562 0.168 5 0 "[ . 1]"
1 120 ASP 0.241 0.090 5 0 "[ . 1]"
1 121 THR 0.030 0.022 4 0 "[ . 1]"
1 122 ILE 1.739 0.168 5 0 "[ . 1]"
1 123 ALA 0.129 0.052 6 0 "[ . 1]"
1 124 ALA 0.000 0.000 . 0 "[ . 1]"
1 125 ASP 0.197 0.056 9 0 "[ . 1]"
1 126 GLU 0.000 0.000 . 0 "[ . 1]"
1 127 SER 0.101 0.021 8 0 "[ . 1]"
1 128 PHE 0.000 0.000 . 0 "[ . 1]"
1 129 THR 2.788 1.322 7 2 "[ . + -]"
1 130 GLN 0.272 0.116 9 0 "[ . 1]"
1 131 VAL 2.728 0.917 5 3 "[ + * -]"
1 132 ASP 3.813 0.541 1 6 "[+ * *- * *]"
1 133 ILE 4.122 0.541 1 6 "[+ * *- * *]"
1 134 GLY 0.617 0.131 7 0 "[ . 1]"
1 135 ASP 0.061 0.024 3 0 "[ . 1]"
1 139 LYS 2.713 1.322 7 2 "[ . + -]"
1 140 LEU 3.382 0.917 5 3 "[ + * -]"
1 141 ASN 0.548 0.094 10 0 "[ . 1]"
1 142 THR 0.735 0.095 10 0 "[ . 1]"
1 143 GLU 0.714 0.095 10 0 "[ . 1]"
1 144 ILE 13.163 1.565 1 10 [+****-****]
1 145 ARG 0.650 0.354 9 0 "[ . 1]"
1 146 ASP 0.439 0.240 9 0 "[ . 1]"
1 147 VAL 0.800 0.213 1 0 "[ . 1]"
1 148 GLY 0.478 0.213 1 0 "[ . 1]"
1 150 LEU 1.074 0.966 6 1 "[ .+ 1]"
1 153 LYS 0.000 0.000 . 0 "[ . 1]"
1 154 GLY 0.031 0.017 10 0 "[ . 1]"
1 155 PHE 2.965 1.181 6 3 "[*- .+ 1]"
1 156 TYR 0.210 0.102 7 0 "[ . 1]"
1 157 LEU 2.561 0.875 5 1 "[ + 1]"
1 158 ALA 0.687 0.219 5 0 "[ . 1]"
1 159 PHE 0.223 0.069 6 0 "[ . 1]"
1 160 GLN 0.267 0.069 6 0 "[ . 1]"
1 161 ASP 2.834 1.444 9 2 "[ . - +1]"
1 162 VAL 0.294 0.079 4 0 "[ . 1]"
1 163 GLY 0.824 0.212 4 0 "[ . 1]"
1 164 ALA 0.574 0.110 4 0 "[ . 1]"
1 165 CYS 2.651 0.492 2 0 "[ . 1]"
1 166 ILE 7.969 0.585 5 7 "[* **+ * *-]"
1 167 ALA 1.637 0.912 1 1 "[+ . 1]"
1 168 LEU 2.010 0.141 7 0 "[ . 1]"
1 169 VAL 0.405 0.070 6 0 "[ . 1]"
1 170 SER 1.189 0.137 4 0 "[ . 1]"
1 171 VAL 0.054 0.025 2 0 "[ . 1]"
1 172 ARG 0.189 0.066 1 0 "[ . 1]"
1 173 VAL 3.128 0.864 7 4 "[* * + -]"
1 174 PHE 6.539 1.575 10 6 "[* * * - *+]"
1 175 TYR 5.506 1.542 1 4 "[+ *. -* 1]"
1 176 LYS 1.544 0.390 1 0 "[ . 1]"
1 177 LYS 0.000 0.000 . 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 GLU HG3 1 175 TYR H . . 5.500 5.969 5.059 7.042 1.542 1 4 "[+ *. -* 1]" 1
2 1 6 THR HA 1 7 LEU H . . 5.500 2.263 2.187 2.338 . 0 0 "[ . 1]" 1
3 1 7 LEU H 1 7 LEU HB3 . . 4.000 2.973 2.506 3.410 . 0 0 "[ . 1]" 1
4 1 7 LEU H 1 8 LEU H . . 5.500 2.693 2.330 2.862 . 0 0 "[ . 1]" 1
5 1 7 LEU H 1 173 VAL HB . . 4.000 3.972 3.823 4.066 0.066 10 0 "[ . 1]" 1
6 1 7 LEU H 1 174 PHE H . . 5.000 4.537 4.131 4.793 . 0 0 "[ . 1]" 1
7 1 7 LEU H 1 174 PHE HA . . 3.000 2.677 2.072 2.949 . 0 0 "[ . 1]" 1
8 1 7 LEU H 1 175 TYR H . . 5.000 4.848 4.299 5.036 0.036 3 0 "[ . 1]" 1
9 1 7 LEU HB3 1 8 LEU H . . 4.000 2.547 2.080 2.977 . 0 0 "[ . 1]" 1
10 1 7 LEU HB3 1 173 VAL MG2 . . 5.500 3.955 2.417 4.895 . 0 0 "[ . 1]" 1
11 1 7 LEU HB3 1 174 PHE H . . 4.000 4.609 3.681 5.575 1.575 10 6 "[* * * - *+]" 1
12 1 8 LEU H 1 8 LEU HA . . 3.000 2.862 2.827 2.925 . 0 0 "[ . 1]" 1
13 1 8 LEU H 1 9 ASP H . . 5.500 4.169 3.946 4.339 . 0 0 "[ . 1]" 1
14 1 8 LEU H 1 9 ASP HA . . 5.500 4.460 4.381 4.609 . 0 0 "[ . 1]" 1
15 1 8 LEU H 1 172 ARG HA . . 5.500 4.356 4.166 4.729 . 0 0 "[ . 1]" 1
16 1 8 LEU H 1 173 VAL H . . 4.000 2.559 2.232 3.074 . 0 0 "[ . 1]" 1
17 1 8 LEU H 1 173 VAL HA . . 5.500 4.641 4.227 4.969 . 0 0 "[ . 1]" 1
18 1 8 LEU H 1 173 VAL HB . . 4.000 2.596 1.933 3.897 . 0 0 "[ . 1]" 1
19 1 8 LEU H 1 173 VAL MG1 . . 5.500 3.895 3.296 4.690 . 0 0 "[ . 1]" 1
20 1 8 LEU H 1 173 VAL MG2 . . 5.500 3.570 1.926 4.185 . 0 0 "[ . 1]" 1
21 1 8 LEU H 1 174 PHE HA . . 5.000 4.734 4.507 5.020 0.020 1 0 "[ . 1]" 1
22 1 8 LEU HA 1 9 ASP H . . 3.000 2.248 2.177 2.485 . 0 0 "[ . 1]" 1
23 1 8 LEU HA 1 173 VAL H . . 5.500 4.816 4.408 5.390 . 0 0 "[ . 1]" 1
24 1 8 LEU HB3 1 9 ASP H . . 4.000 3.752 2.615 4.211 0.211 1 0 "[ . 1]" 1
25 1 9 ASP H 1 9 ASP HA . . 3.000 2.916 2.911 2.917 . 0 0 "[ . 1]" 1
26 1 9 ASP H 1 10 SER H . . 5.500 4.470 4.433 4.528 . 0 0 "[ . 1]" 1
27 1 9 ASP H 1 12 SER H . . 5.500 4.184 3.532 4.852 . 0 0 "[ . 1]" 1
28 1 9 ASP HA 1 10 SER H . . 3.000 2.405 2.344 2.494 . 0 0 "[ . 1]" 1
29 1 9 ASP HA 1 11 ARG H . . 4.000 4.066 3.999 4.126 0.126 7 0 "[ . 1]" 1
30 1 9 ASP HA 1 12 SER H . . 5.500 4.425 4.305 4.596 . 0 0 "[ . 1]" 1
31 1 9 ASP HA 1 171 VAL H . . 5.500 4.447 4.097 4.827 . 0 0 "[ . 1]" 1
32 1 9 ASP HA 1 172 ARG HA . . 5.500 2.298 1.978 2.674 . 0 0 "[ . 1]" 1
33 1 9 ASP HA 1 173 VAL H . . 4.000 3.794 3.416 4.029 0.029 9 0 "[ . 1]" 1
34 1 9 ASP HB3 1 10 SER H . . 4.000 3.394 2.526 4.002 0.002 6 0 "[ . 1]" 1
35 1 9 ASP HB3 1 12 SER H . . 5.500 2.499 1.912 3.467 . 0 0 "[ . 1]" 1
36 1 9 ASP HB3 1 173 VAL H . . 5.500 5.762 5.312 6.364 0.864 7 4 "[* * + -]" 1
37 1 10 SER H 1 10 SER HA . . 3.000 2.819 2.766 2.879 . 0 0 "[ . 1]" 1
38 1 10 SER H 1 11 ARG H . . 3.000 2.454 2.214 2.624 . 0 0 "[ . 1]" 1
39 1 10 SER H 1 11 ARG HB3 . . 5.000 4.752 4.428 5.002 0.002 7 0 "[ . 1]" 1
40 1 10 SER H 1 12 SER H . . 4.000 3.997 3.893 4.081 0.081 7 0 "[ . 1]" 1
41 1 10 SER H 1 17 LEU QD . . 5.500 4.176 3.269 4.687 . 0 0 "[ . 1]" 1
42 1 10 SER H 1 170 SER HA . . 5.000 4.720 4.371 5.021 0.021 10 0 "[ . 1]" 1
43 1 10 SER H 1 171 VAL H . . 4.000 2.809 2.400 3.156 . 0 0 "[ . 1]" 1
44 1 10 SER H 1 172 ARG HA . . 4.000 3.793 3.402 4.018 0.018 7 0 "[ . 1]" 1
45 1 10 SER HA 1 11 ARG H . . 4.000 3.551 3.533 3.558 . 0 0 "[ . 1]" 1
46 1 10 SER HA 1 13 VAL H . . 4.000 3.645 3.486 3.932 . 0 0 "[ . 1]" 1
47 1 11 ARG H 1 11 ARG HA . . 3.000 2.839 2.787 2.889 . 0 0 "[ . 1]" 1
48 1 11 ARG H 1 11 ARG HB3 . . 3.000 2.496 2.364 2.670 . 0 0 "[ . 1]" 1
49 1 11 ARG H 1 12 SER H . . 3.000 2.398 2.173 2.581 . 0 0 "[ . 1]" 1
50 1 11 ARG H 1 13 VAL H . . 5.000 3.767 3.436 4.165 . 0 0 "[ . 1]" 1
51 1 11 ARG H 1 170 SER HA . . 5.000 4.909 4.371 5.049 0.049 3 0 "[ . 1]" 1
52 1 11 ARG HA 1 12 SER H . . 4.000 3.599 3.572 3.624 . 0 0 "[ . 1]" 1
53 1 11 ARG HA 1 13 VAL H . . 4.000 3.923 3.642 4.045 0.045 7 0 "[ . 1]" 1
54 1 11 ARG HB3 1 12 SER H . . 5.000 2.662 2.499 2.842 . 0 0 "[ . 1]" 1
55 1 12 SER H 1 12 SER HA . . 3.000 2.764 2.732 2.806 . 0 0 "[ . 1]" 1
56 1 12 SER H 1 13 VAL H . . 3.000 2.640 2.514 2.733 . 0 0 "[ . 1]" 1
57 1 13 VAL H 1 13 VAL HB . . 4.000 2.824 2.119 3.602 . 0 0 "[ . 1]" 1
58 1 13 VAL H 1 13 VAL QG . . 3.000 1.983 1.820 2.631 . 0 0 "[ . 1]" 1
59 1 13 VAL H 1 14 GLN H . . 3.000 2.515 2.232 3.142 0.142 10 0 "[ . 1]" 1
60 1 13 VAL HA 1 14 GLN H . . 4.000 3.532 2.834 3.641 . 0 0 "[ . 1]" 1
61 1 13 VAL HB 1 17 LEU QD . . 5.500 3.797 2.397 5.130 . 0 0 "[ . 1]" 1
62 1 13 VAL QG 1 14 GLN H . . 5.500 2.164 1.729 3.495 . 0 0 "[ . 1]" 1
63 1 13 VAL QG 1 15 GLY H . . 3.000 2.731 1.989 3.294 0.294 8 0 "[ . 1]" 1
64 1 13 VAL QG 1 16 GLU H . . 5.500 4.027 2.022 4.920 . 0 0 "[ . 1]" 1
65 1 13 VAL QG 1 17 LEU QD . . 5.500 1.952 1.584 2.841 . 0 0 "[ . 1]" 1
66 1 14 GLN H 1 14 GLN HA . . 3.000 2.228 2.174 2.624 . 0 0 "[ . 1]" 1
67 1 14 GLN H 1 14 GLN HG3 . . 4.000 3.407 2.488 4.055 0.055 8 0 "[ . 1]" 1
68 1 14 GLN H 1 15 GLY H . . 5.500 3.509 2.941 3.802 . 0 0 "[ . 1]" 1
69 1 14 GLN HG3 1 15 GLY H . . 5.500 4.450 3.905 5.011 . 0 0 "[ . 1]" 1
70 1 15 GLY H 1 15 GLY HA3 . . 3.000 2.319 2.246 2.952 . 0 0 "[ . 1]" 1
71 1 15 GLY HA3 1 16 GLU H . . 3.000 2.480 2.202 2.773 . 0 0 "[ . 1]" 1
72 1 15 GLY HA3 1 16 GLU HA . . 5.000 4.511 4.254 4.693 . 0 0 "[ . 1]" 1
73 1 16 GLU H 1 16 GLU HA . . 3.000 2.751 2.722 2.790 . 0 0 "[ . 1]" 1
74 1 16 GLU H 1 16 GLU HB3 . . 4.000 3.333 2.499 3.553 . 0 0 "[ . 1]" 1
75 1 16 GLU HA 1 17 LEU H . . 3.000 2.604 2.207 3.380 0.380 10 0 "[ . 1]" 1
76 1 16 GLU HA 1 18 GLY H . . 4.000 3.625 3.000 3.960 . 0 0 "[ . 1]" 1
77 1 16 GLU HB3 1 18 GLY H . . 5.500 3.134 2.369 4.355 . 0 0 "[ . 1]" 1
78 1 17 LEU H 1 19 TRP H . . 3.000 3.039 2.792 3.237 0.237 10 0 "[ . 1]" 1
79 1 17 LEU HA 1 19 TRP H . . 5.500 4.436 3.078 5.216 . 0 0 "[ . 1]" 1
80 1 17 LEU HB3 1 18 GLY H . . 4.000 3.799 3.359 4.065 0.065 10 0 "[ . 1]" 1
81 1 17 LEU QD 1 18 GLY H . . 5.500 4.094 3.888 4.493 . 0 0 "[ . 1]" 1
82 1 17 LEU QD 1 19 TRP H . . 5.500 4.561 3.965 5.037 . 0 0 "[ . 1]" 1
83 1 18 GLY H 1 18 GLY HA3 . . 3.000 2.742 2.251 2.961 . 0 0 "[ . 1]" 1
84 1 18 GLY H 1 19 TRP H . . 3.000 2.223 1.879 2.813 . 0 0 "[ . 1]" 1
85 1 18 GLY HA3 1 19 TRP H . . 4.000 3.452 3.152 3.605 . 0 0 "[ . 1]" 1
86 1 20 ILE H 1 59 ARG H . . 4.000 4.011 3.474 4.325 0.325 2 0 "[ . 1]" 1
87 1 21 ALA HA 1 22 SER H . . 3.000 2.419 2.205 3.086 0.086 3 0 "[ . 1]" 1
88 1 21 ALA HA 1 22 SER HA . . 5.000 4.538 4.378 4.966 . 0 0 "[ . 1]" 1
89 1 21 ALA HA 1 58 LEU QD . . 4.000 3.739 3.341 4.027 0.027 9 0 "[ . 1]" 1
90 1 21 ALA MB 1 22 SER H . . 5.000 2.698 1.880 3.181 . 0 0 "[ . 1]" 1
91 1 23 PRO HA 1 24 LEU H . . 3.000 2.738 2.403 2.845 . 0 0 "[ . 1]" 1
92 1 23 PRO HA 1 25 GLU H . . 5.500 4.580 4.342 4.692 . 0 0 "[ . 1]" 1
93 1 24 LEU H 1 24 LEU HA . . 3.000 2.825 2.807 2.857 . 0 0 "[ . 1]" 1
94 1 24 LEU H 1 24 LEU MD1 . . 4.000 3.419 2.350 4.093 0.093 3 0 "[ . 1]" 1
95 1 24 LEU H 1 25 GLU H . . 3.000 2.570 2.451 2.618 . 0 0 "[ . 1]" 1
96 1 24 LEU H 1 25 GLU HA . . 5.500 4.871 4.756 5.003 . 0 0 "[ . 1]" 1
97 1 24 LEU HA 1 25 GLU H . . 5.000 3.598 3.579 3.608 . 0 0 "[ . 1]" 1
98 1 25 GLU H 1 25 GLU HA . . 3.000 2.666 2.619 2.867 . 0 0 "[ . 1]" 1
99 1 25 GLU H 1 26 GLY H . . 5.500 4.110 3.853 4.386 . 0 0 "[ . 1]" 1
100 1 25 GLU H 1 26 GLY HA3 . . 5.500 4.661 4.538 4.763 . 0 0 "[ . 1]" 1
101 1 25 GLU H 1 27 GLY H . . 4.000 3.449 3.117 4.059 0.059 5 0 "[ . 1]" 1
102 1 25 GLU HA 1 26 GLY H . . 3.000 2.338 2.227 2.496 . 0 0 "[ . 1]" 1
103 1 26 GLY H 1 26 GLY HA3 . . 3.000 2.937 2.914 2.958 . 0 0 "[ . 1]" 1
104 1 26 GLY H 1 27 GLY H . . 3.000 2.869 2.176 3.020 0.020 6 0 "[ . 1]" 1
105 1 26 GLY HA3 1 27 GLY H . . 3.000 3.018 2.834 3.518 0.518 5 1 "[ + 1]" 1
106 1 27 GLY H 1 27 GLY HA3 . . 3.000 2.292 2.246 2.489 . 0 0 "[ . 1]" 1
107 1 27 GLY H 1 28 TRP H . . 4.000 3.576 3.067 3.874 . 0 0 "[ . 1]" 1
108 1 27 GLY H 1 46 VAL QG . . 5.500 4.501 4.200 4.843 . 0 0 "[ . 1]" 1
109 1 27 GLY HA3 1 28 TRP H . . 3.000 2.231 2.198 2.335 . 0 0 "[ . 1]" 1
110 1 27 GLY HA3 1 46 VAL QG . . 4.000 2.936 2.517 3.277 . 0 0 "[ . 1]" 1
111 1 28 TRP H 1 29 GLU H . . 5.500 4.591 4.537 4.633 . 0 0 "[ . 1]" 1
112 1 28 TRP H 1 46 VAL HB . . 5.500 4.333 3.539 5.571 0.071 9 0 "[ . 1]" 1
113 1 28 TRP H 1 46 VAL QG . . 5.500 2.655 2.085 2.923 . 0 0 "[ . 1]" 1
114 1 28 TRP HA 1 29 GLU H . . 3.000 2.244 2.209 2.279 . 0 0 "[ . 1]" 1
115 1 28 TRP HA 1 45 GLN H . . 4.500 4.249 3.976 4.516 0.016 1 0 "[ . 1]" 1
116 1 28 TRP HA 1 46 VAL H . . 5.500 4.615 4.082 5.176 . 0 0 "[ . 1]" 1
117 1 28 TRP HA 1 47 CYS H . . 5.500 4.994 4.365 5.648 0.148 5 0 "[ . 1]" 1
118 1 28 TRP HB3 1 29 GLU H . . 5.500 4.210 3.488 4.575 . 0 0 "[ . 1]" 1
119 1 29 GLU H 1 29 GLU HA . . 3.000 2.895 2.882 2.919 . 0 0 "[ . 1]" 1
120 1 29 GLU H 1 29 GLU HG3 . . 5.500 3.522 3.209 3.807 . 0 0 "[ . 1]" 1
121 1 29 GLU H 1 30 GLU H . . 5.000 4.404 4.375 4.476 . 0 0 "[ . 1]" 1
122 1 29 GLU H 1 31 VAL QG . . 5.500 4.548 4.088 5.371 . 0 0 "[ . 1]" 1
123 1 29 GLU H 1 44 TYR HA . . 4.000 4.043 3.912 4.164 0.164 10 0 "[ . 1]" 1
124 1 29 GLU H 1 45 GLN H . . 4.000 2.664 2.366 2.875 . 0 0 "[ . 1]" 1
125 1 29 GLU H 1 45 GLN HA . . 5.500 4.654 4.409 4.912 . 0 0 "[ . 1]" 1
126 1 29 GLU H 1 45 GLN HG3 . . 6.000 5.147 4.255 6.032 0.032 9 0 "[ . 1]" 1
127 1 29 GLU H 1 45 GLN O . . 3.000 2.145 1.789 2.493 . 0 0 "[ . 1]" 1
128 1 29 GLU H 1 46 VAL H . . 5.500 5.057 4.815 5.269 . 0 0 "[ . 1]" 1
129 1 29 GLU H 1 46 VAL HA . . 4.000 3.879 3.640 4.048 0.048 1 0 "[ . 1]" 1
130 1 29 GLU H 1 46 VAL HB . . 5.500 4.390 3.649 5.722 0.222 10 0 "[ . 1]" 1
131 1 29 GLU H 1 46 VAL QG . . 5.500 3.895 2.795 4.362 . 0 0 "[ . 1]" 1
132 1 29 GLU HA 1 30 GLU H . . 3.000 2.352 2.301 2.406 . 0 0 "[ . 1]" 1
133 1 29 GLU HA 1 45 GLN H . . 5.500 4.846 4.475 5.019 . 0 0 "[ . 1]" 1
134 1 29 GLU HB3 1 30 GLU H . . 4.000 2.843 2.704 3.008 . 0 0 "[ . 1]" 1
135 1 29 GLU O 1 45 GLN H . . 3.000 2.111 1.736 2.258 . 0 0 "[ . 1]" 1
136 1 30 GLU H 1 30 GLU HA . . 3.000 2.895 2.882 2.903 . 0 0 "[ . 1]" 1
137 1 30 GLU H 1 30 GLU HB3 . . 4.000 2.957 2.765 3.627 . 0 0 "[ . 1]" 1
138 1 30 GLU H 1 31 VAL QG . . 5.500 4.100 3.774 5.123 . 0 0 "[ . 1]" 1
139 1 30 GLU H 1 44 TYR HA . . 5.500 4.895 4.669 5.091 . 0 0 "[ . 1]" 1
140 1 30 GLU H 1 45 GLN H . . 5.500 5.241 4.883 5.412 . 0 0 "[ . 1]" 1
141 1 30 GLU HA 1 31 VAL QG . . 4.000 3.418 3.181 3.910 . 0 0 "[ . 1]" 1
142 1 30 GLU HA 1 44 TYR HA . . 3.000 2.573 2.287 2.764 . 0 0 "[ . 1]" 1
143 1 30 GLU HA 1 45 GLN H . . 4.000 4.003 3.669 4.088 0.088 7 0 "[ . 1]" 1
144 1 30 GLU HB3 1 43 THR H . . 5.500 6.071 5.282 6.410 0.910 10 7 "[* **.*- *+]" 1
145 1 30 GLU HB3 1 44 TYR HA . . 5.500 4.670 4.265 5.043 . 0 0 "[ . 1]" 1
146 1 31 VAL H 1 43 THR H . . 4.000 3.233 2.972 3.519 . 0 0 "[ . 1]" 1
147 1 31 VAL H 1 44 TYR HA . . 3.000 2.975 2.799 3.099 0.099 4 0 "[ . 1]" 1
148 1 31 VAL HA 1 32 SER H . . 3.000 2.230 2.198 2.248 . 0 0 "[ . 1]" 1
149 1 31 VAL HB 1 45 GLN HE22 . . 4.000 3.905 2.698 4.108 0.108 7 0 "[ . 1]" 1
150 1 31 VAL QG 1 32 SER HA . . 5.000 4.226 3.495 4.443 . 0 0 "[ . 1]" 1
151 1 31 VAL QG 1 43 THR H . . 5.500 3.679 3.144 4.177 . 0 0 "[ . 1]" 1
152 1 31 VAL QG 1 45 GLN H . . 4.000 3.213 2.877 3.697 . 0 0 "[ . 1]" 1
153 1 31 VAL QG 1 45 GLN HE22 . . 4.000 2.299 1.759 2.827 . 0 0 "[ . 1]" 1
154 1 31 VAL QG 1 45 GLN HG3 . . 5.500 2.923 1.820 3.829 . 0 0 "[ . 1]" 1
155 1 31 VAL O 1 43 THR H . . 3.000 1.825 1.478 2.231 . 0 0 "[ . 1]" 1
156 1 32 SER HA 1 33 ILE H . . 3.000 2.243 2.227 2.280 . 0 0 "[ . 1]" 1
157 1 32 SER HA 1 42 ARG H . . 5.500 4.625 4.445 5.046 . 0 0 "[ . 1]" 1
158 1 32 SER HA 1 42 ARG HA . . 4.000 2.172 1.959 2.669 . 0 0 "[ . 1]" 1
159 1 32 SER HA 1 43 THR H . . 4.000 2.549 2.351 2.692 . 0 0 "[ . 1]" 1
160 1 33 ILE H 1 33 ILE HA . . 3.000 2.931 2.918 2.940 . 0 0 "[ . 1]" 1
161 1 33 ILE H 1 33 ILE MG . . 3.000 2.964 2.838 3.080 0.080 10 0 "[ . 1]" 1
162 1 33 ILE H 1 34 MET H . . 5.500 4.441 4.410 4.468 . 0 0 "[ . 1]" 1
163 1 33 ILE H 1 40 PRO HA . . 5.000 4.988 4.843 5.050 0.050 1 0 "[ . 1]" 1
164 1 33 ILE H 1 41 ILE H . . 4.000 3.309 3.092 3.454 . 0 0 "[ . 1]" 1
165 1 33 ILE H 1 41 ILE HB . . 6.000 5.752 5.212 5.985 . 0 0 "[ . 1]" 1
166 1 33 ILE H 1 41 ILE MD . . 5.500 4.459 2.475 5.002 . 0 0 "[ . 1]" 1
167 1 33 ILE H 1 42 ARG HA . . 5.000 3.767 3.483 4.210 . 0 0 "[ . 1]" 1
168 1 33 ILE HA 1 34 MET H . . 3.000 2.550 2.523 2.565 . 0 0 "[ . 1]" 1
169 1 33 ILE HB 1 34 MET H . . 3.000 2.325 2.303 2.368 . 0 0 "[ . 1]" 1
170 1 33 ILE MD 1 33 ILE MG . . 4.000 2.937 2.630 3.263 . 0 0 "[ . 1]" 1
171 1 33 ILE MD 1 34 MET H . . 3.000 2.877 2.563 3.072 0.072 6 0 "[ . 1]" 1
172 1 33 ILE MD 1 43 THR HB . . 5.500 4.565 4.164 4.924 . 0 0 "[ . 1]" 1
173 1 33 ILE MG 1 34 MET H . . 5.500 3.667 3.591 3.713 . 0 0 "[ . 1]" 1
174 1 33 ILE MG 1 45 GLN HE22 . . 4.000 2.962 2.235 3.747 . 0 0 "[ . 1]" 1
175 1 34 MET H 1 34 MET HA . . 3.000 2.868 2.855 2.892 . 0 0 "[ . 1]" 1
176 1 34 MET H 1 35 ASP H . . 5.500 4.567 4.536 4.616 . 0 0 "[ . 1]" 1
177 1 34 MET H 1 133 ILE MD . . 5.500 5.136 4.891 5.519 0.019 9 0 "[ . 1]" 1
178 1 34 MET HA 1 35 ASP H . . 3.000 2.245 2.218 2.309 . 0 0 "[ . 1]" 1
179 1 34 MET HB3 1 40 PRO HA . . 7.000 5.501 4.906 6.272 . 0 0 "[ . 1]" 1
180 1 34 MET HB3 1 135 ASP HA . . 5.500 4.770 3.299 5.515 0.015 4 0 "[ . 1]" 1
181 1 34 MET ME 1 35 ASP H . . 4.000 3.751 3.235 4.011 0.011 1 0 "[ . 1]" 1
182 1 34 MET HG3 1 35 ASP H . . 5.500 3.614 2.160 4.703 . 0 0 "[ . 1]" 1
183 1 35 ASP H 1 35 ASP HA . . 3.000 2.903 2.878 2.912 . 0 0 "[ . 1]" 1
184 1 35 ASP H 1 35 ASP HB3 . . 4.000 3.115 2.980 3.252 . 0 0 "[ . 1]" 1
185 1 35 ASP H 1 36 GLU H . . 5.500 4.441 4.399 4.527 . 0 0 "[ . 1]" 1
186 1 35 ASP H 1 37 LYS HB3 . . 5.500 5.855 5.042 6.628 1.128 6 4 "[ * .+-* 1]" 1
187 1 35 ASP HA 1 36 GLU H . . 3.000 2.744 2.597 2.807 . 0 0 "[ . 1]" 1
188 1 35 ASP HA 1 41 ILE MG . . 5.500 5.011 4.209 5.507 0.007 2 0 "[ . 1]" 1
189 1 35 ASP HB3 1 36 GLU H . . 4.000 2.871 2.118 3.557 . 0 0 "[ . 1]" 1
190 1 35 ASP HB3 1 37 LYS H . . 4.000 3.090 1.994 4.039 0.039 1 0 "[ . 1]" 1
191 1 35 ASP HB3 1 41 ILE MG . . 5.500 3.292 1.978 4.115 . 0 0 "[ . 1]" 1
192 1 36 GLU H 1 36 GLU HA . . 3.000 2.741 2.720 2.788 . 0 0 "[ . 1]" 1
193 1 36 GLU H 1 36 GLU HB3 . . 4.000 2.845 2.380 3.446 . 0 0 "[ . 1]" 1
194 1 36 GLU H 1 37 LYS H . . 5.000 2.715 2.583 2.770 . 0 0 "[ . 1]" 1
195 1 36 GLU HA 1 37 LYS H . . 4.000 3.511 3.463 3.571 . 0 0 "[ . 1]" 1
196 1 36 GLU HB3 1 37 LYS H . . 4.000 3.583 3.003 4.096 0.096 6 0 "[ . 1]" 1
197 1 37 LYS HA 1 38 ASN H . . 3.000 2.505 2.437 2.572 . 0 0 "[ . 1]" 1
198 1 37 LYS HB3 1 38 ASN H . . 4.000 2.666 2.288 3.247 . 0 0 "[ . 1]" 1
199 1 38 ASN H 1 38 ASN HA . . 3.000 2.761 2.722 2.771 . 0 0 "[ . 1]" 1
200 1 38 ASN H 1 38 ASN HB3 . . 4.000 3.300 2.726 3.547 . 0 0 "[ . 1]" 1
201 1 38 ASN HA 1 39 THR H . . 4.000 3.206 2.456 3.655 . 0 0 "[ . 1]" 1
202 1 38 ASN HB3 1 39 THR H . . 4.000 2.362 1.992 2.640 . 0 0 "[ . 1]" 1
203 1 39 THR H 1 39 THR HA . . 3.000 2.558 2.223 2.814 . 0 0 "[ . 1]" 1
204 1 39 THR H 1 39 THR HB . . 4.000 2.961 2.276 3.599 . 0 0 "[ . 1]" 1
205 1 40 PRO HA 1 41 ILE H . . 3.000 2.344 2.322 2.393 . 0 0 "[ . 1]" 1
206 1 41 ILE H 1 41 ILE HA . . 3.000 2.935 2.930 2.939 . 0 0 "[ . 1]" 1
207 1 41 ILE H 1 41 ILE MD . . 4.000 3.734 1.828 4.035 0.035 7 0 "[ . 1]" 1
208 1 41 ILE H 1 41 ILE HG13 . . 4.000 2.519 2.157 3.962 . 0 0 "[ . 1]" 1
209 1 41 ILE H 1 41 ILE MG . . 4.000 2.864 2.225 3.016 . 0 0 "[ . 1]" 1
210 1 41 ILE H 1 42 ARG H . . 5.500 4.454 4.403 4.526 . 0 0 "[ . 1]" 1
211 1 41 ILE H 1 42 ARG HA . . 6.000 4.828 4.755 4.948 . 0 0 "[ . 1]" 1
212 1 41 ILE HA 1 41 ILE MD . . 4.000 3.838 3.463 4.029 0.029 9 0 "[ . 1]" 1
213 1 41 ILE HA 1 42 ARG H . . 3.000 2.326 2.213 2.369 . 0 0 "[ . 1]" 1
214 1 41 ILE HB 1 42 ARG H . . 4.000 2.864 2.713 3.229 . 0 0 "[ . 1]" 1
215 1 41 ILE MD 1 42 ARG H . . 5.000 3.775 2.993 4.537 . 0 0 "[ . 1]" 1
216 1 41 ILE HG13 1 42 ARG H . . 5.500 4.203 4.012 4.517 . 0 0 "[ . 1]" 1
217 1 41 ILE MG 1 42 ARG H . . 5.500 3.947 3.834 4.203 . 0 0 "[ . 1]" 1
218 1 42 ARG H 1 42 ARG HA . . 3.000 2.827 2.796 2.863 . 0 0 "[ . 1]" 1
219 1 42 ARG H 1 43 THR H . . 5.500 4.546 4.513 4.586 . 0 0 "[ . 1]" 1
220 1 42 ARG HA 1 43 THR H . . 3.000 2.240 2.236 2.251 . 0 0 "[ . 1]" 1
221 1 43 THR H 1 43 THR MG . . 3.000 3.081 3.018 3.155 0.155 10 0 "[ . 1]" 1
222 1 43 THR HA 1 44 TYR H . . 3.000 2.478 2.296 2.746 . 0 0 "[ . 1]" 1
223 1 43 THR HA 1 168 LEU H . . 5.500 5.556 5.497 5.641 0.141 7 0 "[ . 1]" 1
224 1 43 THR HB 1 44 TYR H . . 5.500 2.538 2.002 2.979 . 0 0 "[ . 1]" 1
225 1 43 THR HB 1 45 GLN H . . 5.500 5.609 5.557 5.660 0.160 9 0 "[ . 1]" 1
226 1 43 THR HB 1 45 GLN HE22 . . 4.000 3.796 2.820 4.668 0.668 1 1 "[+ . 1]" 1
227 1 43 THR HB 1 167 ALA MB . . 5.500 4.172 3.898 4.406 . 0 0 "[ . 1]" 1
228 1 43 THR MG 1 44 TYR H . . 5.500 3.560 3.423 3.703 . 0 0 "[ . 1]" 1
229 1 43 THR MG 1 168 LEU H . . 5.500 5.169 4.957 5.297 . 0 0 "[ . 1]" 1
230 1 44 TYR H 1 44 TYR HB3 . . 4.000 3.642 3.104 3.812 . 0 0 "[ . 1]" 1
231 1 44 TYR H 1 168 LEU H . . 5.500 3.365 3.093 3.654 . 0 0 "[ . 1]" 1
232 1 44 TYR H 1 168 LEU HB3 . . 5.500 4.292 3.751 4.602 . 0 0 "[ . 1]" 1
233 1 44 TYR H 1 168 LEU O . . 3.000 2.999 2.796 3.097 0.097 8 0 "[ . 1]" 1
234 1 44 TYR H 1 169 VAL HA . . 5.500 5.180 4.770 5.432 . 0 0 "[ . 1]" 1
235 1 44 TYR HA 1 45 GLN H . . 3.000 2.235 2.230 2.245 . 0 0 "[ . 1]" 1
236 1 44 TYR O 1 168 LEU H . . 3.000 1.748 1.542 2.027 . 0 0 "[ . 1]" 1
237 1 45 GLN H 1 45 GLN HA . . 3.000 2.900 2.874 2.916 . 0 0 "[ . 1]" 1
238 1 45 GLN H 1 45 GLN HB3 . . 4.000 3.630 3.298 3.829 . 0 0 "[ . 1]" 1
239 1 45 GLN H 1 45 GLN HE21 . . 5.000 4.005 3.187 5.044 0.044 4 0 "[ . 1]" 1
240 1 45 GLN H 1 45 GLN HG3 . . 4.000 3.289 2.619 4.064 0.064 9 0 "[ . 1]" 1
241 1 45 GLN H 1 46 VAL H . . 5.500 4.397 4.363 4.467 . 0 0 "[ . 1]" 1
242 1 45 GLN H 1 167 ALA HA . . 5.500 4.751 4.637 5.024 . 0 0 "[ . 1]" 1
243 1 45 GLN HA 1 46 VAL H . . 3.000 2.337 2.251 2.409 . 0 0 "[ . 1]" 1
244 1 45 GLN HA 1 166 ILE H . . 5.500 5.218 4.964 5.395 . 0 0 "[ . 1]" 1
245 1 45 GLN HA 1 167 ALA H . . 5.500 4.810 4.705 4.987 . 0 0 "[ . 1]" 1
246 1 45 GLN HA 1 167 ALA HA . . 5.500 2.059 1.914 2.449 . 0 0 "[ . 1]" 1
247 1 45 GLN HA 1 167 ALA MB . . 5.500 2.796 2.318 3.375 . 0 0 "[ . 1]" 1
248 1 45 GLN HA 1 168 LEU H . . 5.500 3.119 2.826 3.661 . 0 0 "[ . 1]" 1
249 1 45 GLN HB3 1 46 VAL H . . 4.000 3.470 2.997 3.986 . 0 0 "[ . 1]" 1
250 1 45 GLN HB3 1 167 ALA MB . . 5.500 2.251 1.772 3.883 . 0 0 "[ . 1]" 1
251 1 45 GLN HE22 1 167 ALA MB . . 4.000 3.767 3.245 4.912 0.912 1 1 "[+ . 1]" 1
252 1 45 GLN HG3 1 46 VAL H . . 5.500 4.547 3.547 5.167 . 0 0 "[ . 1]" 1
253 1 45 GLN HG3 1 167 ALA MB . . 5.500 3.316 1.743 4.212 . 0 0 "[ . 1]" 1
254 1 46 VAL H 1 46 VAL HA . . 3.000 2.924 2.922 2.929 . 0 0 "[ . 1]" 1
255 1 46 VAL H 1 46 VAL HB . . 4.000 3.206 2.595 3.583 . 0 0 "[ . 1]" 1
256 1 46 VAL H 1 46 VAL QG . . 3.000 2.242 2.084 3.071 0.071 9 0 "[ . 1]" 1
257 1 46 VAL H 1 47 CYS H . . 5.000 4.157 3.993 4.405 . 0 0 "[ . 1]" 1
258 1 46 VAL H 1 166 ILE H . . 4.000 3.320 3.054 3.568 . 0 0 "[ . 1]" 1
259 1 46 VAL H 1 166 ILE MD . . 4.000 3.410 3.009 4.017 0.017 8 0 "[ . 1]" 1
260 1 46 VAL H 1 166 ILE O . . 3.000 2.013 1.774 2.223 . 0 0 "[ . 1]" 1
261 1 46 VAL H 1 167 ALA HA . . 3.000 3.047 2.906 3.137 0.137 6 0 "[ . 1]" 1
262 1 46 VAL H 1 167 ALA MB . . 5.500 3.743 3.335 4.104 . 0 0 "[ . 1]" 1
263 1 46 VAL HA 1 47 CYS H . . 3.000 2.222 2.181 2.333 . 0 0 "[ . 1]" 1
264 1 46 VAL HB 1 47 CYS H . . 5.000 4.144 2.978 4.507 . 0 0 "[ . 1]" 1
265 1 46 VAL HB 1 168 LEU QD . . 5.500 4.768 3.878 5.413 . 0 0 "[ . 1]" 1
266 1 46 VAL QG 1 47 CYS H . . 3.000 2.852 2.296 3.131 0.131 10 0 "[ . 1]" 1
267 1 46 VAL QG 1 48 ASN H . . 5.500 4.224 3.493 4.987 . 0 0 "[ . 1]" 1
268 1 46 VAL QG 1 56 ASN H . . 5.500 4.705 3.625 5.240 . 0 0 "[ . 1]" 1
269 1 46 VAL QG 1 161 ASP H . . 5.500 4.566 3.896 4.973 . 0 0 "[ . 1]" 1
270 1 46 VAL QG 1 166 ILE H . . 4.000 2.850 2.366 3.139 . 0 0 "[ . 1]" 1
271 1 46 VAL QG 1 166 ILE HB . . 5.500 4.946 4.556 5.388 . 0 0 "[ . 1]" 1
272 1 46 VAL QG 1 166 ILE MD . . 5.500 2.169 1.849 2.656 . 0 0 "[ . 1]" 1
273 1 46 VAL O 1 166 ILE H . . 3.000 2.210 2.037 2.429 . 0 0 "[ . 1]" 1
274 1 47 CYS H 1 47 CYS HA . . 3.000 2.890 2.786 2.930 . 0 0 "[ . 1]" 1
275 1 47 CYS H 1 48 ASN H . . 5.500 4.036 3.498 4.303 . 0 0 "[ . 1]" 1
276 1 47 CYS HA 1 48 ASN H . . 3.000 2.233 2.220 2.252 . 0 0 "[ . 1]" 1
277 1 47 CYS HA 1 49 VAL H . . 5.500 5.466 5.352 5.550 0.050 2 0 "[ . 1]" 1
278 1 47 CYS HA 1 49 VAL QG . . 5.000 4.280 3.874 4.690 . 0 0 "[ . 1]" 1
279 1 47 CYS HA 1 165 CYS H . . 5.500 4.480 4.270 4.684 . 0 0 "[ . 1]" 1
280 1 47 CYS HA 1 165 CYS HA . . 5.500 1.977 1.909 2.106 . 0 0 "[ . 1]" 1
281 1 47 CYS HA 1 165 CYS HB3 . . 5.000 3.500 2.839 4.161 . 0 0 "[ . 1]" 1
282 1 47 CYS HA 1 166 ILE H . . 4.000 3.594 3.427 3.836 . 0 0 "[ . 1]" 1
283 1 47 CYS HB3 1 166 ILE H . . 5.000 5.427 4.944 5.585 0.585 5 7 "[* **+ * *-]" 1
284 1 48 ASN H 1 48 ASN HB3 . . 4.000 3.434 3.054 3.845 . 0 0 "[ . 1]" 1
285 1 48 ASN H 1 49 VAL H . . 5.500 3.680 3.430 3.855 . 0 0 "[ . 1]" 1
286 1 48 ASN H 1 165 CYS HA . . 5.500 3.552 3.341 3.880 . 0 0 "[ . 1]" 1
287 1 48 ASN HA 1 49 VAL H . . 3.000 2.275 2.272 2.277 . 0 0 "[ . 1]" 1
288 1 48 ASN HB3 1 49 VAL H . . 5.500 4.107 3.901 4.310 . 0 0 "[ . 1]" 1
289 1 49 VAL H 1 49 VAL HA . . 3.000 2.930 2.916 2.940 . 0 0 "[ . 1]" 1
290 1 49 VAL H 1 49 VAL HB . . 4.000 3.385 2.627 3.728 . 0 0 "[ . 1]" 1
291 1 49 VAL H 1 49 VAL QG . . 4.000 2.160 1.843 3.118 . 0 0 "[ . 1]" 1
292 1 49 VAL HA 1 93 LYS H . . 5.500 5.386 4.359 5.621 0.121 7 0 "[ . 1]" 1
293 1 49 VAL HB 1 93 LYS H . . 5.500 4.921 4.418 5.441 . 0 0 "[ . 1]" 1
294 1 49 VAL QG 1 93 LYS H . . 5.500 3.036 2.452 3.905 . 0 0 "[ . 1]" 1
295 1 49 VAL QG 1 164 ALA HA . . 5.500 2.964 2.242 4.311 . 0 0 "[ . 1]" 1
296 1 49 VAL QG 1 165 CYS H . . 5.500 3.930 3.444 4.669 . 0 0 "[ . 1]" 1
297 1 49 VAL QG 1 165 CYS HB3 . . 5.500 4.708 3.749 5.026 . 0 0 "[ . 1]" 1
298 1 52 PRO HA 1 53 SER H . . 3.000 2.388 2.149 3.239 0.239 6 0 "[ . 1]" 1
299 1 52 PRO HA 1 54 GLN H . . 5.500 4.822 2.877 5.512 0.012 4 0 "[ . 1]" 1
300 1 53 SER H 1 53 SER HA . . 3.000 2.522 2.172 2.914 . 0 0 "[ . 1]" 1
301 1 53 SER H 1 53 SER HB3 . . 4.000 3.262 2.578 3.989 . 0 0 "[ . 1]" 1
302 1 53 SER H 1 53 SER HG . . 4.000 3.274 2.120 3.968 . 0 0 "[ . 1]" 1
303 1 53 SER HA 1 54 GLN H . . 4.000 2.807 2.230 3.614 . 0 0 "[ . 1]" 1
304 1 54 GLN H 1 54 GLN HB3 . . 4.000 3.364 2.482 3.607 . 0 0 "[ . 1]" 1
305 1 54 GLN H 1 54 GLN HG3 . . 4.000 2.970 1.938 3.548 . 0 0 "[ . 1]" 1
306 1 54 GLN H 1 55 ASN H . . 5.500 4.621 4.565 4.670 . 0 0 "[ . 1]" 1
307 1 54 GLN H 1 162 VAL HA . . 4.000 3.754 3.316 4.079 0.079 4 0 "[ . 1]" 1
308 1 54 GLN H 1 162 VAL QG . . 5.500 3.626 2.338 4.720 . 0 0 "[ . 1]" 1
309 1 54 GLN H 1 163 GLY HA3 . . 5.500 4.876 4.159 5.712 0.212 4 0 "[ . 1]" 1
310 1 54 GLN HA 1 55 ASN H . . 4.000 2.310 2.230 2.379 . 0 0 "[ . 1]" 1
311 1 54 GLN HA 1 56 ASN H . . 5.500 4.837 3.970 5.504 0.004 7 0 "[ . 1]" 1
312 1 54 GLN HB3 1 55 ASN H . . 4.000 3.223 2.785 3.977 . 0 0 "[ . 1]" 1
313 1 54 GLN HG3 1 55 ASN H . . 5.500 5.048 3.952 5.478 . 0 0 "[ . 1]" 1
314 1 54 GLN HG3 1 163 GLY H . . 5.500 4.480 3.193 5.653 0.153 2 0 "[ . 1]" 1
315 1 55 ASN H 1 55 ASN HA . . 3.000 2.899 2.853 2.917 . 0 0 "[ . 1]" 1
316 1 55 ASN H 1 55 ASN QD . . 3.000 2.569 1.815 3.088 0.088 6 0 "[ . 1]" 1
317 1 55 ASN H 1 56 ASN H . . 4.000 3.203 1.819 4.017 0.017 7 0 "[ . 1]" 1
318 1 55 ASN H 1 162 VAL HA . . 5.500 4.789 3.246 5.545 0.045 8 0 "[ . 1]" 1
319 1 55 ASN HA 1 56 ASN H . . 4.000 2.770 2.312 3.637 . 0 0 "[ . 1]" 1
320 1 55 ASN HB3 1 56 ASN H . . 4.000 4.169 3.423 4.731 0.731 10 4 "[* - *+]" 1
321 1 55 ASN QD 1 56 ASN H . . 4.000 3.885 2.943 4.152 0.152 9 0 "[ . 1]" 1
322 1 56 ASN H 1 57 TRP HA . . 5.500 5.087 4.384 5.548 0.048 10 0 "[ . 1]" 1
323 1 56 ASN H 1 161 ASP H . . 4.000 3.295 2.921 4.046 0.046 2 0 "[ . 1]" 1
324 1 56 ASN H 1 161 ASP HB3 . . 4.000 3.878 2.979 5.444 1.444 9 2 "[ . - +1]" 1
325 1 56 ASN H 1 161 ASP O . . 3.000 2.635 2.197 3.143 0.143 2 0 "[ . 1]" 1
326 1 56 ASN HA 1 57 TRP H . . 3.000 2.284 2.252 2.403 . 0 0 "[ . 1]" 1
327 1 56 ASN O 1 161 ASP H . . 3.000 2.598 2.024 3.064 0.064 5 0 "[ . 1]" 1
328 1 57 TRP HA 1 57 TRP HE1 . . 5.000 5.038 5.005 5.076 0.076 3 0 "[ . 1]" 1
329 1 57 TRP HA 1 58 LEU H . . 3.000 2.227 2.205 2.300 . 0 0 "[ . 1]" 1
330 1 57 TRP HB3 1 57 TRP HE1 . . 5.000 5.393 5.079 5.434 0.434 9 0 "[ . 1]" 1
331 1 57 TRP HB3 1 58 LEU H . . 5.000 4.335 4.130 4.483 . 0 0 "[ . 1]" 1
332 1 57 TRP HE1 1 58 LEU H . . 6.000 4.533 3.935 4.937 . 0 0 "[ . 1]" 1
333 1 57 TRP HE1 1 59 ARG H . . 5.500 5.499 5.449 5.528 0.028 10 0 "[ . 1]" 1
334 1 58 LEU H 1 58 LEU HA . . 3.000 2.923 2.910 2.938 . 0 0 "[ . 1]" 1
335 1 58 LEU H 1 159 PHE H . . 5.500 3.361 2.870 3.865 . 0 0 "[ . 1]" 1
336 1 58 LEU H 1 160 GLN HA . . 5.500 3.658 2.998 4.130 . 0 0 "[ . 1]" 1
337 1 58 LEU H 1 161 ASP H . . 5.500 5.140 4.461 5.550 0.050 1 0 "[ . 1]" 1
338 1 58 LEU HA 1 59 ARG H . . 3.000 2.225 2.186 2.286 . 0 0 "[ . 1]" 1
339 1 58 LEU HA 1 159 PHE H . . 5.500 4.809 4.276 5.350 . 0 0 "[ . 1]" 1
340 1 58 LEU O 1 159 PHE H . . 3.000 2.027 1.790 2.281 . 0 0 "[ . 1]" 1
341 1 59 ARG H 1 159 PHE H . . 5.000 4.912 4.699 5.030 0.030 9 0 "[ . 1]" 1
342 1 60 THR H 1 60 THR HA . . 3.000 2.939 2.925 2.947 . 0 0 "[ . 1]" 1
343 1 60 THR H 1 60 THR HB . . 3.000 2.579 2.361 3.030 0.030 2 0 "[ . 1]" 1
344 1 60 THR H 1 60 THR MG . . 4.000 3.541 2.317 3.835 . 0 0 "[ . 1]" 1
345 1 60 THR H 1 157 LEU HA . . 5.000 4.963 4.656 5.289 0.289 8 0 "[ . 1]" 1
346 1 60 THR H 1 157 LEU O . . 3.000 2.090 1.573 2.829 . 0 0 "[ . 1]" 1
347 1 60 THR O 1 157 LEU H . . 3.000 2.650 2.047 3.019 0.019 6 0 "[ . 1]" 1
348 1 64 THR HA 1 65 ARG H . . 4.000 2.219 2.150 2.262 . 0 0 "[ . 1]" 1
349 1 64 THR HA 1 154 GLY H . . 5.500 4.673 2.016 5.517 0.017 10 0 "[ . 1]" 1
350 1 64 THR HA 1 155 PHE H . . 5.000 4.156 3.127 5.012 0.012 1 0 "[ . 1]" 1
351 1 64 THR HB 1 65 ARG H . . 4.000 3.877 3.241 4.022 0.022 8 0 "[ . 1]" 1
352 1 65 ARG H 1 65 ARG HA . . 3.000 2.902 2.875 2.911 . 0 0 "[ . 1]" 1
353 1 65 ARG H 1 65 ARG HB3 . . 3.000 3.065 2.669 3.729 0.729 5 1 "[ + 1]" 1
354 1 66 GLU HA 1 67 GLY H . . 3.000 2.544 2.370 2.716 . 0 0 "[ . 1]" 1
355 1 68 ALA H 1 68 ALA HA . . 3.000 2.828 2.687 2.935 . 0 0 "[ . 1]" 1
356 1 68 ALA H 1 68 ALA MB . . 3.000 2.123 1.961 2.345 . 0 0 "[ . 1]" 1
357 1 70 ARG H 1 70 ARG HA . . 3.000 2.897 2.893 2.905 . 0 0 "[ . 1]" 1
358 1 70 ARG HA 1 71 VAL H . . 3.000 2.466 2.349 2.775 . 0 0 "[ . 1]" 1
359 1 70 ARG HA 1 147 VAL H . . 4.000 3.919 3.608 4.100 0.100 6 0 "[ . 1]" 1
360 1 70 ARG HG3 1 147 VAL H . . 5.500 4.524 3.786 5.460 . 0 0 "[ . 1]" 1
361 1 71 VAL H 1 71 VAL HA . . 3.000 2.929 2.915 2.937 . 0 0 "[ . 1]" 1
362 1 71 VAL H 1 71 VAL HB . . 4.000 3.825 3.777 3.847 . 0 0 "[ . 1]" 1
363 1 71 VAL H 1 71 VAL QG . . 4.000 2.250 2.145 2.318 . 0 0 "[ . 1]" 1
364 1 71 VAL H 1 72 TYR H . . 5.500 4.349 4.246 4.443 . 0 0 "[ . 1]" 1
365 1 71 VAL H 1 146 ASP HA . . 5.500 3.833 3.479 4.165 . 0 0 "[ . 1]" 1
366 1 71 VAL H 1 146 ASP HB3 . . 5.500 4.622 3.990 5.740 0.240 9 0 "[ . 1]" 1
367 1 71 VAL H 1 147 VAL H . . 4.000 2.170 1.888 2.428 . 0 0 "[ . 1]" 1
368 1 71 VAL H 1 147 VAL QG . . 5.500 3.578 2.864 4.063 . 0 0 "[ . 1]" 1
369 1 71 VAL H 1 147 VAL O . . 3.000 2.047 1.793 2.419 . 0 0 "[ . 1]" 1
370 1 71 VAL H 1 148 GLY QA . . 4.000 3.833 3.708 4.044 0.044 7 0 "[ . 1]" 1
371 1 71 VAL HA 1 72 TYR H . . 4.000 2.724 2.524 2.899 . 0 0 "[ . 1]" 1
372 1 71 VAL HB 1 72 TYR H . . 4.000 2.397 2.097 3.103 . 0 0 "[ . 1]" 1
373 1 71 VAL HB 1 174 PHE H . . 5.000 4.501 4.279 4.893 . 0 0 "[ . 1]" 1
374 1 71 VAL HB 1 175 TYR H . . 5.500 4.886 4.303 5.339 . 0 0 "[ . 1]" 1
375 1 71 VAL QG 1 72 TYR H . . 4.000 2.286 1.884 2.907 . 0 0 "[ . 1]" 1
376 1 71 VAL QG 1 73 ILE MG . . 5.500 4.566 3.474 4.961 . 0 0 "[ . 1]" 1
377 1 71 VAL QG 1 147 VAL H . . 4.000 2.403 1.956 2.925 . 0 0 "[ . 1]" 1
378 1 71 VAL QG 1 147 VAL HB . . 5.000 3.173 1.736 4.399 . 0 0 "[ . 1]" 1
379 1 71 VAL QG 1 147 VAL QG . . 3.000 2.022 1.703 2.469 . 0 0 "[ . 1]" 1
380 1 71 VAL QG 1 174 PHE H . . 5.500 3.624 2.840 4.446 . 0 0 "[ . 1]" 1
381 1 72 TYR H 1 72 TYR HA . . 3.000 2.922 2.883 2.943 . 0 0 "[ . 1]" 1
382 1 72 TYR H 1 72 TYR HB3 . . 4.000 3.518 3.170 3.818 . 0 0 "[ . 1]" 1
383 1 72 TYR H 1 73 ILE H . . 5.500 4.303 4.175 4.460 . 0 0 "[ . 1]" 1
384 1 72 TYR H 1 73 ILE HB . . 5.500 5.368 4.802 5.560 0.060 6 0 "[ . 1]" 1
385 1 72 TYR H 1 146 ASP HA . . 5.500 4.754 4.488 4.974 . 0 0 "[ . 1]" 1
386 1 72 TYR H 1 173 VAL HA . . 5.500 5.355 5.065 5.502 0.002 4 0 "[ . 1]" 1
387 1 72 TYR H 1 174 PHE H . . 4.000 3.423 3.078 3.711 . 0 0 "[ . 1]" 1
388 1 72 TYR H 1 174 PHE O . . 3.000 2.058 1.797 2.289 . 0 0 "[ . 1]" 1
389 1 72 TYR H 1 175 TYR HB3 . . 5.500 5.048 4.604 5.435 . 0 0 "[ . 1]" 1
390 1 72 TYR HA 1 73 ILE H . . 3.000 2.214 2.203 2.279 . 0 0 "[ . 1]" 1
391 1 72 TYR HA 1 145 ARG H . . 5.500 4.267 3.862 4.910 . 0 0 "[ . 1]" 1
392 1 72 TYR HA 1 146 ASP H . . 5.500 4.979 4.529 5.246 . 0 0 "[ . 1]" 1
393 1 72 TYR HA 1 146 ASP HA . . 5.500 2.714 2.142 3.064 . 0 0 "[ . 1]" 1
394 1 72 TYR HA 1 147 VAL H . . 5.000 4.304 3.893 4.810 . 0 0 "[ . 1]" 1
395 1 72 TYR HA 1 174 PHE H . . 5.500 5.051 4.693 5.381 . 0 0 "[ . 1]" 1
396 1 72 TYR HB3 1 73 ILE H . . 5.500 3.453 3.148 3.638 . 0 0 "[ . 1]" 1
397 1 72 TYR HB3 1 174 PHE H . . 5.000 4.499 3.442 4.900 . 0 0 "[ . 1]" 1
398 1 72 TYR O 1 174 PHE H . . 3.000 1.911 1.509 2.212 . 0 0 "[ . 1]" 1
399 1 73 ILE H 1 73 ILE HA . . 3.000 2.931 2.919 2.939 . 0 0 "[ . 1]" 1
400 1 73 ILE H 1 73 ILE HB . . 3.000 2.602 2.365 3.139 0.139 1 0 "[ . 1]" 1
401 1 73 ILE H 1 73 ILE MD . . 4.000 3.274 2.668 4.115 0.115 5 0 "[ . 1]" 1
402 1 73 ILE H 1 73 ILE MG . . 4.000 3.356 2.365 3.742 . 0 0 "[ . 1]" 1
403 1 73 ILE H 1 74 GLU H . . 5.500 4.380 4.292 4.469 . 0 0 "[ . 1]" 1
404 1 73 ILE H 1 144 ILE HA . . 5.500 4.237 3.861 4.583 . 0 0 "[ . 1]" 1
405 1 73 ILE H 1 144 ILE HG13 . . 5.000 6.278 6.030 6.565 1.565 1 10 [+****-****] 1
406 1 73 ILE H 1 144 ILE MG . . 5.000 3.372 3.000 3.711 . 0 0 "[ . 1]" 1
407 1 73 ILE H 1 145 ARG H . . 3.000 2.579 2.217 3.048 0.048 1 0 "[ . 1]" 1
408 1 73 ILE H 1 145 ARG HA . . 5.500 4.541 4.037 4.833 . 0 0 "[ . 1]" 1
409 1 73 ILE H 1 145 ARG O . . 3.000 1.973 1.490 2.505 . 0 0 "[ . 1]" 1
410 1 73 ILE H 1 146 ASP H . . 5.000 4.783 4.159 5.023 0.023 8 0 "[ . 1]" 1
411 1 73 ILE H 1 146 ASP HA . . 4.000 3.544 2.945 3.885 . 0 0 "[ . 1]" 1
412 1 73 ILE H 1 147 VAL H . . 5.500 5.411 5.157 5.553 0.053 6 0 "[ . 1]" 1
413 1 73 ILE H 1 173 VAL HA . . 5.500 5.132 4.802 5.520 0.020 10 0 "[ . 1]" 1
414 1 73 ILE H 1 174 PHE H . . 5.500 4.947 4.602 5.190 . 0 0 "[ . 1]" 1
415 1 73 ILE HA 1 74 GLU H . . 3.000 2.241 2.192 2.349 . 0 0 "[ . 1]" 1
416 1 73 ILE HA 1 172 ARG H . . 5.500 5.267 4.847 5.514 0.014 8 0 "[ . 1]" 1
417 1 73 ILE HA 1 174 PHE H . . 4.000 3.141 2.955 3.502 . 0 0 "[ . 1]" 1
418 1 73 ILE MD 1 74 GLU H . . 5.500 4.453 2.177 5.100 . 0 0 "[ . 1]" 1
419 1 73 ILE MD 1 144 ILE MG . . 5.500 5.507 5.420 5.564 0.064 10 0 "[ . 1]" 1
420 1 73 ILE MD 1 145 ARG H . . 5.500 4.539 3.688 5.074 . 0 0 "[ . 1]" 1
421 1 73 ILE MD 1 146 ASP HA . . 5.500 4.209 2.941 5.620 0.120 1 0 "[ . 1]" 1
422 1 73 ILE MD 1 147 VAL QG . . 5.500 2.757 1.725 5.014 . 0 0 "[ . 1]" 1
423 1 73 ILE MD 1 157 LEU QD . . 4.000 3.294 1.913 3.957 . 0 0 "[ . 1]" 1
424 1 73 ILE HG13 1 174 PHE H . . 5.500 3.456 2.268 5.392 . 0 0 "[ . 1]" 1
425 1 73 ILE MG 1 75 ILE MG . . 4.000 3.906 2.860 4.116 0.116 5 0 "[ . 1]" 1
426 1 73 ILE MG 1 122 ILE MD . . 6.000 5.610 5.228 6.019 0.019 2 0 "[ . 1]" 1
427 1 73 ILE MG 1 145 ARG H . . 5.500 3.402 2.256 4.175 . 0 0 "[ . 1]" 1
428 1 73 ILE MG 1 172 ARG H . . 5.500 4.398 3.907 5.566 0.066 1 0 "[ . 1]" 1
429 1 73 ILE O 1 145 ARG H . . 3.000 1.879 1.466 2.187 . 0 0 "[ . 1]" 1
430 1 74 GLU H 1 74 GLU HA . . 3.000 2.913 2.903 2.919 . 0 0 "[ . 1]" 1
431 1 74 GLU H 1 74 GLU HB3 . . 3.000 3.234 2.923 3.885 0.885 7 3 "[ * + -1]" 1
432 1 74 GLU H 1 75 ILE H . . 5.500 4.292 4.170 4.429 . 0 0 "[ . 1]" 1
433 1 74 GLU H 1 75 ILE HA . . 5.500 4.782 4.685 4.924 . 0 0 "[ . 1]" 1
434 1 74 GLU H 1 144 ILE HA . . 5.500 4.888 4.692 5.166 . 0 0 "[ . 1]" 1
435 1 74 GLU H 1 171 VAL HA . . 5.500 4.986 4.773 5.389 . 0 0 "[ . 1]" 1
436 1 74 GLU H 1 172 ARG H . . 4.000 3.388 2.990 3.729 . 0 0 "[ . 1]" 1
437 1 74 GLU H 1 172 ARG HB3 . . 5.000 4.295 3.677 5.038 0.038 8 0 "[ . 1]" 1
438 1 74 GLU H 1 172 ARG O . . 3.000 2.000 1.664 2.359 . 0 0 "[ . 1]" 1
439 1 74 GLU H 1 173 VAL HA . . 4.000 3.227 2.766 3.471 . 0 0 "[ . 1]" 1
440 1 74 GLU H 1 174 PHE H . . 5.500 4.755 4.521 5.218 . 0 0 "[ . 1]" 1
441 1 74 GLU HA 1 75 ILE H . . 3.000 2.228 2.202 2.366 . 0 0 "[ . 1]" 1
442 1 74 GLU HA 1 144 ILE HA . . 3.000 2.554 2.337 2.730 . 0 0 "[ . 1]" 1
443 1 74 GLU HA 1 145 ARG H . . 4.000 3.640 2.896 4.079 0.079 8 0 "[ . 1]" 1
444 1 74 GLU HB3 1 75 ILE H . . 5.000 4.084 2.935 4.491 . 0 0 "[ . 1]" 1
445 1 74 GLU HB3 1 144 ILE MD . . 5.500 4.114 3.202 5.231 . 0 0 "[ . 1]" 1
446 1 74 GLU HB3 1 145 ARG H . . 5.500 5.216 4.761 5.854 0.354 9 0 "[ . 1]" 1
447 1 74 GLU HB3 1 172 ARG H . . 5.500 4.922 3.793 5.366 . 0 0 "[ . 1]" 1
448 1 74 GLU O 1 172 ARG H . . 3.000 1.862 1.550 2.006 . 0 0 "[ . 1]" 1
449 1 75 ILE H 1 75 ILE HA . . 3.000 2.932 2.924 2.938 . 0 0 "[ . 1]" 1
450 1 75 ILE H 1 75 ILE HG13 . . 4.000 2.391 1.936 3.664 . 0 0 "[ . 1]" 1
451 1 75 ILE H 1 76 LYS H . . 5.500 4.457 4.358 4.541 . 0 0 "[ . 1]" 1
452 1 75 ILE H 1 143 GLU H . . 4.000 2.854 2.558 3.539 . 0 0 "[ . 1]" 1
453 1 75 ILE H 1 143 GLU HA . . 5.500 4.843 4.494 5.224 . 0 0 "[ . 1]" 1
454 1 75 ILE H 1 144 ILE HA . . 4.000 3.809 3.602 4.015 0.015 9 0 "[ . 1]" 1
455 1 75 ILE H 1 145 ARG H . . 5.500 4.934 4.532 5.280 . 0 0 "[ . 1]" 1
456 1 75 ILE HA 1 76 LYS H . . 3.000 2.226 2.196 2.346 . 0 0 "[ . 1]" 1
457 1 75 ILE HA 1 170 SER H . . 5.000 4.927 4.847 5.069 0.069 4 0 "[ . 1]" 1
458 1 75 ILE HA 1 172 ARG H . . 4.000 3.378 3.015 3.663 . 0 0 "[ . 1]" 1
459 1 75 ILE HB 1 76 LYS H . . 4.000 3.775 2.959 4.089 0.089 2 0 "[ . 1]" 1
460 1 75 ILE HB 1 143 GLU H . . 5.500 3.897 3.230 4.538 . 0 0 "[ . 1]" 1
461 1 75 ILE MD 1 122 ILE MG . . 5.500 3.705 2.915 5.436 . 0 0 "[ . 1]" 1
462 1 75 ILE MG 1 76 LYS H . . 3.000 2.658 2.280 3.204 0.204 5 0 "[ . 1]" 1
463 1 75 ILE MG 1 122 ILE MG . . 5.500 5.541 5.514 5.586 0.086 6 0 "[ . 1]" 1
464 1 75 ILE MG 1 143 GLU H . . 5.500 4.970 4.450 5.491 . 0 0 "[ . 1]" 1
465 1 75 ILE MG 1 157 LEU HG . . 5.500 5.505 5.352 5.558 0.058 8 0 "[ . 1]" 1
466 1 75 ILE MG 1 168 LEU QD . . 5.500 3.199 2.672 4.235 . 0 0 "[ . 1]" 1
467 1 75 ILE O 1 143 GLU H . . 3.000 2.116 1.837 2.385 . 0 0 "[ . 1]" 1
468 1 76 LYS H 1 76 LYS HA . . 3.000 2.937 2.929 2.939 . 0 0 "[ . 1]" 1
469 1 76 LYS H 1 76 LYS HB3 . . 4.000 3.274 3.189 3.433 . 0 0 "[ . 1]" 1
470 1 76 LYS H 1 168 LEU HA . . 5.500 5.490 5.376 5.576 0.076 3 0 "[ . 1]" 1
471 1 76 LYS H 1 169 VAL MG2 . . 5.500 5.528 5.460 5.570 0.070 6 0 "[ . 1]" 1
472 1 76 LYS H 1 170 SER H . . 3.000 2.879 2.834 2.986 . 0 0 "[ . 1]" 1
473 1 76 LYS H 1 170 SER O . . 3.000 1.572 1.490 1.745 . 0 0 "[ . 1]" 1
474 1 76 LYS H 1 171 VAL HA . . 3.000 2.933 2.808 3.025 0.025 2 0 "[ . 1]" 1
475 1 76 LYS H 1 171 VAL QG . . 4.000 3.018 2.522 3.764 . 0 0 "[ . 1]" 1
476 1 76 LYS HA 1 77 PHE H . . 3.000 2.177 2.176 2.178 . 0 0 "[ . 1]" 1
477 1 76 LYS HA 1 141 ASN H . . 5.500 4.429 4.271 4.588 . 0 0 "[ . 1]" 1
478 1 76 LYS HA 1 142 THR H . . 5.500 5.066 4.855 5.261 . 0 0 "[ . 1]" 1
479 1 76 LYS HA 1 142 THR HA . . 5.500 2.713 2.468 3.001 . 0 0 "[ . 1]" 1
480 1 76 LYS HA 1 143 GLU H . . 4.000 3.916 3.713 4.037 0.037 7 0 "[ . 1]" 1
481 1 76 LYS HA 1 170 SER H . . 5.500 4.281 4.205 4.370 . 0 0 "[ . 1]" 1
482 1 76 LYS HB3 1 77 PHE H . . 4.000 3.852 3.779 3.916 . 0 0 "[ . 1]" 1
483 1 76 LYS HB3 1 170 SER H . . 4.000 2.581 2.401 2.671 . 0 0 "[ . 1]" 1
484 1 76 LYS HG3 1 143 GLU H . . 5.500 4.742 4.152 5.058 . 0 0 "[ . 1]" 1
485 1 76 LYS O 1 170 SER H . . 3.000 1.866 1.646 1.985 . 0 0 "[ . 1]" 1
486 1 77 PHE H 1 77 PHE HA . . 3.000 2.916 2.914 2.919 . 0 0 "[ . 1]" 1
487 1 77 PHE H 1 77 PHE HB3 . . 4.000 3.245 3.057 3.796 . 0 0 "[ . 1]" 1
488 1 77 PHE H 1 78 THR H . . 5.500 4.436 4.424 4.443 . 0 0 "[ . 1]" 1
489 1 77 PHE H 1 140 LEU HA . . 5.000 5.082 5.036 5.128 0.128 3 0 "[ . 1]" 1
490 1 77 PHE H 1 141 ASN H . . 4.000 3.243 3.134 3.475 . 0 0 "[ . 1]" 1
491 1 77 PHE H 1 141 ASN HD21 . . 5.500 5.362 5.035 5.594 0.094 10 0 "[ . 1]" 1
492 1 77 PHE H 1 141 ASN O . . 3.000 2.068 1.824 2.451 . 0 0 "[ . 1]" 1
493 1 77 PHE H 1 142 THR H . . 5.500 5.170 4.988 5.525 0.025 9 0 "[ . 1]" 1
494 1 77 PHE H 1 142 THR HA . . 4.000 3.768 3.392 4.014 0.014 6 0 "[ . 1]" 1
495 1 77 PHE H 1 142 THR MG . . 5.500 4.775 4.253 5.125 . 0 0 "[ . 1]" 1
496 1 77 PHE H 1 168 LEU HA . . 5.500 5.212 4.989 5.408 . 0 0 "[ . 1]" 1
497 1 77 PHE H 1 169 VAL HB . . 4.000 3.718 3.477 4.030 0.030 10 0 "[ . 1]" 1
498 1 77 PHE HA 1 78 THR H . . 3.000 2.434 2.372 2.453 . 0 0 "[ . 1]" 1
499 1 77 PHE HA 1 167 ALA H . . 5.000 4.491 4.264 4.755 . 0 0 "[ . 1]" 1
500 1 77 PHE HA 1 168 LEU QD . . 5.500 3.793 3.211 4.336 . 0 0 "[ . 1]" 1
501 1 77 PHE HA 1 169 VAL H . . 3.000 1.894 1.766 1.963 . 0 0 "[ . 1]" 1
502 1 77 PHE HA 1 170 SER H . . 4.000 3.935 3.658 4.013 0.013 6 0 "[ . 1]" 1
503 1 77 PHE HB3 1 78 THR H . . 4.000 3.793 2.656 4.007 0.007 8 0 "[ . 1]" 1
504 1 77 PHE HB3 1 169 VAL H . . 4.000 3.661 3.475 3.837 . 0 0 "[ . 1]" 1
505 1 78 THR H 1 78 THR HA . . 3.000 2.942 2.928 2.949 . 0 0 "[ . 1]" 1
506 1 78 THR H 1 78 THR HB . . 4.000 2.795 2.418 3.692 . 0 0 "[ . 1]" 1
507 1 78 THR H 1 79 LEU H . . 5.500 4.341 4.259 4.483 . 0 0 "[ . 1]" 1
508 1 78 THR H 1 166 ILE HA . . 5.000 4.461 4.289 4.638 . 0 0 "[ . 1]" 1
509 1 78 THR H 1 166 ILE HB . . 5.500 4.735 3.930 5.233 . 0 0 "[ . 1]" 1
510 1 78 THR H 1 166 ILE MD . . 5.500 5.065 4.733 5.537 0.037 2 0 "[ . 1]" 1
511 1 78 THR H 1 167 ALA H . . 3.000 2.438 2.219 2.664 . 0 0 "[ . 1]" 1
512 1 78 THR H 1 167 ALA HA . . 5.500 4.337 4.214 4.644 . 0 0 "[ . 1]" 1
513 1 78 THR H 1 167 ALA MB . . 4.000 2.788 2.453 3.320 . 0 0 "[ . 1]" 1
514 1 78 THR H 1 168 LEU HA . . 5.000 3.891 3.627 4.074 . 0 0 "[ . 1]" 1
515 1 78 THR H 1 168 LEU QD . . 5.500 4.616 4.131 5.272 . 0 0 "[ . 1]" 1
516 1 78 THR H 1 169 VAL H . . 5.000 3.844 3.659 3.967 . 0 0 "[ . 1]" 1
517 1 78 THR H 1 169 VAL HB . . 5.000 4.727 4.349 5.015 0.015 10 0 "[ . 1]" 1
518 1 78 THR H 1 169 VAL MG2 . . 4.000 2.898 2.585 3.104 . 0 0 "[ . 1]" 1
519 1 78 THR HA 1 79 LEU H . . 3.000 2.174 2.158 2.268 . 0 0 "[ . 1]" 1
520 1 78 THR HA 1 141 ASN HD21 . . 5.500 4.069 3.362 4.491 . 0 0 "[ . 1]" 1
521 1 78 THR HA 1 166 ILE HA . . 5.500 5.268 5.173 5.385 . 0 0 "[ . 1]" 1
522 1 78 THR HA 1 167 ALA H . . 5.500 4.312 4.216 4.451 . 0 0 "[ . 1]" 1
523 1 79 LEU H 1 79 LEU HA . . 3.000 2.934 2.929 2.939 . 0 0 "[ . 1]" 1
524 1 79 LEU H 1 80 ARG H . . 5.500 4.493 4.443 4.550 . 0 0 "[ . 1]" 1
525 1 79 LEU H 1 141 ASN HD22 . . 3.000 2.586 1.885 2.952 . 0 0 "[ . 1]" 1
526 1 79 LEU HA 1 80 ARG H . . 3.000 2.319 2.216 2.460 . 0 0 "[ . 1]" 1
527 1 79 LEU HA 1 166 ILE HA . . 5.500 2.116 1.937 2.390 . 0 0 "[ . 1]" 1
528 1 79 LEU HA 1 166 ILE HB . . 5.500 3.526 2.967 3.924 . 0 0 "[ . 1]" 1
529 1 79 LEU HA 1 166 ILE MD . . 5.500 5.234 5.144 5.411 . 0 0 "[ . 1]" 1
530 1 79 LEU HA 1 166 ILE HG13 . . 5.500 5.541 5.175 5.923 0.423 2 0 "[ . 1]" 1
531 1 79 LEU QD 1 124 ALA HA . . 5.500 3.827 3.275 4.310 . 0 0 "[ . 1]" 1
532 1 79 LEU QD 1 124 ALA MB . . 5.500 2.194 1.850 2.522 . 0 0 "[ . 1]" 1
533 1 79 LEU QD 1 164 ALA MB . . 5.500 3.286 2.833 3.756 . 0 0 "[ . 1]" 1
534 1 79 LEU QD 1 166 ILE HA . . 5.500 3.579 2.929 4.046 . 0 0 "[ . 1]" 1
535 1 79 LEU QD 1 166 ILE HG13 . . 5.500 4.263 3.017 5.022 . 0 0 "[ . 1]" 1
536 1 79 LEU QD 1 166 ILE MG . . 5.500 2.337 1.769 3.326 . 0 0 "[ . 1]" 1
537 1 79 LEU QD 1 167 ALA H . . 5.500 4.682 3.625 5.131 . 0 0 "[ . 1]" 1
538 1 79 LEU HG 1 80 ARG H . . 5.000 2.781 2.207 3.403 . 0 0 "[ . 1]" 1
539 1 79 LEU HG 1 165 CYS H . . 4.000 4.007 3.829 4.111 0.111 7 0 "[ . 1]" 1
540 1 80 ARG H 1 80 ARG HA . . 3.000 2.857 2.828 2.879 . 0 0 "[ . 1]" 1
541 1 80 ARG H 1 81 ASP H . . 5.500 4.543 4.380 4.636 . 0 0 "[ . 1]" 1
542 1 80 ARG H 1 165 CYS HB3 . . 4.000 3.422 2.752 4.005 0.005 9 0 "[ . 1]" 1
543 1 80 ARG H 1 166 ILE H . . 5.500 5.041 4.825 5.230 . 0 0 "[ . 1]" 1
544 1 80 ARG H 1 166 ILE HA . . 4.000 3.564 3.277 3.725 . 0 0 "[ . 1]" 1
545 1 80 ARG H 1 166 ILE HB . . 5.500 5.169 4.696 5.536 0.036 8 0 "[ . 1]" 1
546 1 80 ARG H 1 167 ALA H . . 5.500 5.336 4.978 5.554 0.054 5 0 "[ . 1]" 1
547 1 80 ARG HA 1 81 ASP H . . 3.000 2.296 2.226 2.465 . 0 0 "[ . 1]" 1
548 1 80 ARG HB3 1 81 ASP H . . 4.000 3.909 2.588 4.490 0.490 5 0 "[ . 1]" 1
549 1 81 ASP H 1 82 CYS H . . 5.500 4.561 4.511 4.637 . 0 0 "[ . 1]" 1
550 1 81 ASP HA 1 82 CYS H . . 3.000 2.279 2.256 2.378 . 0 0 "[ . 1]" 1
551 1 81 ASP HA 1 83 ASN H . . 4.000 3.645 3.432 3.834 . 0 0 "[ . 1]" 1
552 1 82 CYS H 1 82 CYS HA . . 3.000 2.852 2.779 2.925 . 0 0 "[ . 1]" 1
553 1 82 CYS H 1 82 CYS HB3 . . 4.000 3.250 2.745 3.570 . 0 0 "[ . 1]" 1
554 1 82 CYS H 1 83 ASN H . . 3.000 2.315 1.896 2.611 . 0 0 "[ . 1]" 1
555 1 82 CYS H 1 83 ASN HA . . 5.500 4.823 4.497 5.112 . 0 0 "[ . 1]" 1
556 1 82 CYS H 1 84 SER H . . 5.500 3.899 3.509 4.256 . 0 0 "[ . 1]" 1
557 1 82 CYS HA 1 83 ASN H . . 4.000 3.519 3.431 3.593 . 0 0 "[ . 1]" 1
558 1 82 CYS HA 1 85 LEU H . . 3.000 3.000 2.930 3.080 0.080 7 0 "[ . 1]" 1
559 1 82 CYS HB3 1 83 ASN H . . 4.000 3.560 3.131 3.959 . 0 0 "[ . 1]" 1
560 1 83 ASN H 1 83 ASN HA . . 3.000 2.777 2.725 2.828 . 0 0 "[ . 1]" 1
561 1 83 ASN H 1 83 ASN HB3 . . 4.000 3.278 2.990 3.482 . 0 0 "[ . 1]" 1
562 1 83 ASN H 1 84 SER H . . 3.000 2.541 2.379 2.682 . 0 0 "[ . 1]" 1
563 1 83 ASN H 1 84 SER HA . . 5.500 5.080 4.954 5.198 . 0 0 "[ . 1]" 1
564 1 83 ASN H 1 85 LEU H . . 4.000 3.855 3.715 4.002 0.002 10 0 "[ . 1]" 1
565 1 83 ASN H 1 85 LEU QD . . 5.500 4.912 4.572 5.303 . 0 0 "[ . 1]" 1
566 1 83 ASN HA 1 84 SER H . . 4.000 3.529 3.507 3.567 . 0 0 "[ . 1]" 1
567 1 83 ASN HA 1 85 LEU H . . 4.000 3.945 3.861 3.997 . 0 0 "[ . 1]" 1
568 1 83 ASN HB3 1 84 SER H . . 4.000 3.424 3.139 3.769 . 0 0 "[ . 1]" 1
569 1 84 SER H 1 84 SER HA . . 3.000 2.868 2.835 2.887 . 0 0 "[ . 1]" 1
570 1 84 SER H 1 85 LEU H . . 3.000 2.286 2.203 2.407 . 0 0 "[ . 1]" 1
571 1 84 SER H 1 85 LEU HA . . 5.500 4.813 4.699 4.939 . 0 0 "[ . 1]" 1
572 1 84 SER H 1 85 LEU HB3 . . 5.500 5.461 5.289 5.534 0.034 5 0 "[ . 1]" 1
573 1 84 SER HA 1 85 LEU H . . 4.000 3.465 3.415 3.506 . 0 0 "[ . 1]" 1
574 1 85 LEU H 1 85 LEU HA . . 3.000 2.844 2.814 2.897 . 0 0 "[ . 1]" 1
575 1 85 LEU H 1 85 LEU HG . . 5.000 4.019 3.484 4.440 . 0 0 "[ . 1]" 1
576 1 85 LEU H 1 86 PRO HD3 . . 5.500 4.513 4.324 4.797 . 0 0 "[ . 1]" 1
577 1 85 LEU HB3 1 87 GLY H . . 5.500 4.074 3.217 5.447 . 0 0 "[ . 1]" 1
578 1 85 LEU HB3 1 88 VAL H . . 5.500 3.439 2.483 4.340 . 0 0 "[ . 1]" 1
579 1 85 LEU QD 1 165 CYS HB3 . . 5.500 4.691 3.674 5.391 . 0 0 "[ . 1]" 1
580 1 86 PRO HA 1 87 GLY H . . 5.000 2.495 2.154 3.472 . 0 0 "[ . 1]" 1
581 1 86 PRO HA 1 88 VAL H . . 5.000 4.589 3.388 5.024 0.024 3 0 "[ . 1]" 1
582 1 86 PRO HB3 1 87 GLY H . . 5.000 4.413 3.467 4.711 . 0 0 "[ . 1]" 1
583 1 87 GLY H 1 88 VAL H . . 3.000 2.596 1.919 3.014 0.014 2 0 "[ . 1]" 1
584 1 87 GLY HA2 1 88 VAL H . . 4.000 2.797 2.431 3.635 . 0 0 "[ . 1]" 1
585 1 87 GLY HA2 1 89 MET H . . 4.000 3.656 3.074 4.472 0.472 10 0 "[ . 1]" 1
586 1 88 VAL H 1 88 VAL HA . . 3.000 2.676 2.210 2.940 . 0 0 "[ . 1]" 1
587 1 88 VAL H 1 88 VAL HB . . 4.000 2.555 2.035 3.286 . 0 0 "[ . 1]" 1
588 1 88 VAL H 1 89 MET HA . . 5.500 4.980 4.678 5.416 . 0 0 "[ . 1]" 1
589 1 88 VAL HA 1 89 MET H . . 4.000 3.408 2.562 3.641 . 0 0 "[ . 1]" 1
590 1 88 VAL HB 1 89 MET H . . 5.000 3.801 2.577 4.689 . 0 0 "[ . 1]" 1
591 1 88 VAL QG 1 89 MET H . . 5.000 2.452 1.829 3.550 . 0 0 "[ . 1]" 1
592 1 88 VAL QG 1 90 GLY H . . 4.000 2.505 1.718 4.331 0.331 6 0 "[ . 1]" 1
593 1 88 VAL QG 1 91 THR H . . 4.000 3.551 2.988 3.928 . 0 0 "[ . 1]" 1
594 1 88 VAL QG 1 92 CYS H . . 5.500 3.582 3.075 4.208 . 0 0 "[ . 1]" 1
595 1 89 MET H 1 89 MET HA . . 3.000 2.230 2.173 2.640 . 0 0 "[ . 1]" 1
596 1 89 MET H 1 89 MET HB3 . . 4.000 4.027 3.900 4.096 0.096 8 0 "[ . 1]" 1
597 1 89 MET H 1 89 MET HG3 . . 5.000 4.200 3.619 4.819 . 0 0 "[ . 1]" 1
598 1 89 MET H 1 91 THR H . . 5.500 5.065 4.404 5.505 0.005 2 0 "[ . 1]" 1
599 1 89 MET HA 1 90 GLY H . . 4.000 3.425 2.389 3.645 . 0 0 "[ . 1]" 1
600 1 89 MET HA 1 91 THR H . . 5.500 4.675 4.130 5.064 . 0 0 "[ . 1]" 1
601 1 89 MET HB3 1 90 GLY H . . 4.000 2.903 1.874 4.018 0.018 9 0 "[ . 1]" 1
602 1 89 MET HB3 1 91 THR H . . 3.000 2.847 2.195 3.489 0.489 7 0 "[ . 1]" 1
603 1 89 MET HG3 1 90 GLY H . . 5.500 4.928 4.133 5.393 . 0 0 "[ . 1]" 1
604 1 90 GLY H 1 90 GLY HA2 . . 3.000 2.468 2.245 2.863 . 0 0 "[ . 1]" 1
605 1 90 GLY H 1 91 THR H . . 3.000 2.348 1.780 3.365 0.365 6 0 "[ . 1]" 1
606 1 90 GLY HA2 1 91 THR H . . 3.000 3.157 2.883 3.556 0.556 10 2 "[ -. +]" 1
607 1 90 GLY HA2 1 92 CYS H . . 4.000 3.605 3.183 3.906 . 0 0 "[ . 1]" 1
608 1 91 THR H 1 91 THR HA . . 3.000 2.923 2.897 2.946 . 0 0 "[ . 1]" 1
609 1 91 THR H 1 91 THR HB . . 3.000 2.931 2.601 3.076 0.076 5 0 "[ . 1]" 1
610 1 91 THR H 1 91 THR MG . . 3.000 2.321 2.008 2.628 . 0 0 "[ . 1]" 1
611 1 91 THR H 1 92 CYS H . . 3.000 2.614 2.401 2.919 . 0 0 "[ . 1]" 1
612 1 91 THR H 1 92 CYS HA . . 5.500 4.553 4.309 5.025 . 0 0 "[ . 1]" 1
613 1 91 THR HA 1 91 THR HB . . 3.000 2.583 2.437 2.656 . 0 0 "[ . 1]" 1
614 1 91 THR HA 1 92 CYS H . . 3.000 2.903 2.698 3.137 0.137 7 0 "[ . 1]" 1
615 1 91 THR HB 1 92 CYS H . . 5.000 4.633 4.558 4.711 . 0 0 "[ . 1]" 1
616 1 91 THR MG 1 92 CYS H . . 4.000 3.646 3.236 3.908 . 0 0 "[ . 1]" 1
617 1 92 CYS H 1 93 LYS H . . 5.500 4.410 4.323 4.494 . 0 0 "[ . 1]" 1
618 1 92 CYS HA 1 93 LYS H . . 3.000 2.262 2.233 2.361 . 0 0 "[ . 1]" 1
619 1 92 CYS HA 1 164 ALA HA . . 5.500 4.183 3.643 5.058 . 0 0 "[ . 1]" 1
620 1 93 LYS H 1 93 LYS HB3 . . 4.000 3.137 2.661 3.532 . 0 0 "[ . 1]" 1
621 1 93 LYS H 1 162 VAL QG . . 5.500 4.876 4.446 5.220 . 0 0 "[ . 1]" 1
622 1 93 LYS H 1 164 ALA HA . . 3.000 2.947 2.751 3.042 0.042 4 0 "[ . 1]" 1
623 1 93 LYS H 1 164 ALA MB . . 5.500 3.257 2.703 3.718 . 0 0 "[ . 1]" 1
624 1 93 LYS H 1 165 CYS H . . 5.500 4.975 4.732 5.357 . 0 0 "[ . 1]" 1
625 1 93 LYS HA 1 94 GLU H . . 3.000 2.411 2.208 2.501 . 0 0 "[ . 1]" 1
626 1 93 LYS HB3 1 94 GLU H . . 5.000 3.120 2.777 3.998 . 0 0 "[ . 1]" 1
627 1 94 GLU H 1 94 GLU HB3 . . 4.000 3.473 3.006 3.834 . 0 0 "[ . 1]" 1
628 1 94 GLU H 1 95 THR H . . 5.500 2.613 2.244 3.204 . 0 0 "[ . 1]" 1
629 1 94 GLU H 1 95 THR HA . . 5.500 4.655 4.529 5.043 . 0 0 "[ . 1]" 1
630 1 94 GLU H 1 95 THR MG . . 5.500 2.799 2.106 3.496 . 0 0 "[ . 1]" 1
631 1 94 GLU H 1 164 ALA MB . . 5.500 4.168 3.281 4.749 . 0 0 "[ . 1]" 1
632 1 94 GLU HA 1 95 THR H . . 3.000 2.804 2.498 3.004 0.004 8 0 "[ . 1]" 1
633 1 95 THR H 1 95 THR HA . . 3.000 2.905 2.865 2.940 . 0 0 "[ . 1]" 1
634 1 95 THR H 1 95 THR HB . . 4.000 3.835 3.744 3.948 . 0 0 "[ . 1]" 1
635 1 95 THR H 1 95 THR MG . . 4.000 3.035 2.624 3.355 . 0 0 "[ . 1]" 1
636 1 95 THR H 1 96 PHE H . . 5.500 4.353 4.215 4.429 . 0 0 "[ . 1]" 1
637 1 95 THR H 1 164 ALA MB . . 5.500 3.257 2.178 3.887 . 0 0 "[ . 1]" 1
638 1 95 THR HA 1 96 PHE H . . 3.000 2.302 2.162 2.485 . 0 0 "[ . 1]" 1
639 1 95 THR HA 1 122 ILE H . . 5.500 4.876 4.626 5.087 . 0 0 "[ . 1]" 1
640 1 95 THR HA 1 123 ALA MB . . 4.000 2.560 2.134 3.132 . 0 0 "[ . 1]" 1
641 1 95 THR HB 1 122 ILE H . . 5.500 4.876 4.141 5.371 . 0 0 "[ . 1]" 1
642 1 95 THR MG 1 96 PHE H . . 5.000 3.913 3.629 4.215 . 0 0 "[ . 1]" 1
643 1 95 THR MG 1 123 ALA H . . 5.500 5.229 4.847 5.495 . 0 0 "[ . 1]" 1
644 1 96 PHE H 1 96 PHE HA . . 3.000 2.925 2.898 2.938 . 0 0 "[ . 1]" 1
645 1 96 PHE H 1 96 PHE HB3 . . 4.000 3.550 2.773 3.872 . 0 0 "[ . 1]" 1
646 1 96 PHE H 1 97 ASN H . . 5.500 4.446 4.277 4.510 . 0 0 "[ . 1]" 1
647 1 96 PHE H 1 121 THR HA . . 5.500 4.243 3.698 4.460 . 0 0 "[ . 1]" 1
648 1 96 PHE H 1 121 THR MG . . 4.000 3.047 2.341 3.623 . 0 0 "[ . 1]" 1
649 1 96 PHE H 1 122 ILE H . . 3.000 3.011 2.879 3.061 0.061 5 0 "[ . 1]" 1
650 1 96 PHE H 1 122 ILE HA . . 5.500 4.834 4.652 5.171 . 0 0 "[ . 1]" 1
651 1 96 PHE H 1 122 ILE HB . . 6.000 5.171 4.515 5.955 . 0 0 "[ . 1]" 1
652 1 96 PHE H 1 122 ILE MD . . 5.500 5.009 4.711 5.548 0.048 8 0 "[ . 1]" 1
653 1 96 PHE H 1 123 ALA MB . . 5.500 3.794 3.508 4.216 . 0 0 "[ . 1]" 1
654 1 96 PHE HA 1 97 ASN H . . 3.000 2.390 2.227 2.530 . 0 0 "[ . 1]" 1
655 1 96 PHE HB3 1 97 ASN H . . 4.000 3.090 2.551 3.781 . 0 0 "[ . 1]" 1
656 1 97 ASN H 1 97 ASN HA . . 3.000 2.902 2.872 2.915 . 0 0 "[ . 1]" 1
657 1 97 ASN H 1 97 ASN HB3 . . 4.000 3.627 3.045 3.772 . 0 0 "[ . 1]" 1
658 1 97 ASN H 1 98 LEU H . . 5.500 4.427 4.218 4.568 . 0 0 "[ . 1]" 1
659 1 97 ASN H 1 160 GLN H . . 4.000 3.152 2.842 3.522 . 0 0 "[ . 1]" 1
660 1 97 ASN H 1 160 GLN O . . 3.000 2.946 2.766 3.051 0.051 8 0 "[ . 1]" 1
661 1 97 ASN H 1 161 ASP HA . . 5.500 4.730 4.498 4.995 . 0 0 "[ . 1]" 1
662 1 97 ASN H 1 162 VAL QG . . 5.500 4.735 3.982 5.247 . 0 0 "[ . 1]" 1
663 1 97 ASN HA 1 98 LEU H . . 3.000 2.299 2.253 2.377 . 0 0 "[ . 1]" 1
664 1 97 ASN HA 1 121 THR H . . 5.500 5.145 4.765 5.522 0.022 4 0 "[ . 1]" 1
665 1 97 ASN HA 1 121 THR HA . . 5.500 2.697 2.276 3.013 . 0 0 "[ . 1]" 1
666 1 97 ASN HA 1 122 ILE H . . 4.000 3.756 3.364 4.029 0.029 9 0 "[ . 1]" 1
667 1 97 ASN HA 1 160 GLN H . . 5.500 5.309 5.185 5.490 . 0 0 "[ . 1]" 1
668 1 97 ASN HB3 1 98 LEU H . . 4.000 3.364 2.946 4.037 0.037 3 0 "[ . 1]" 1
669 1 97 ASN HB3 1 160 GLN H . . 5.500 5.247 4.677 5.539 0.039 3 0 "[ . 1]" 1
670 1 97 ASN QD 1 162 VAL QG . . 5.500 2.964 2.306 3.424 . 0 0 "[ . 1]" 1
671 1 97 ASN HD22 1 162 VAL QG . . 4.000 3.198 2.477 3.713 . 0 0 "[ . 1]" 1
672 1 97 ASN O 1 160 GLN H . . 3.000 2.648 2.492 2.851 . 0 0 "[ . 1]" 1
673 1 98 LEU H 1 98 LEU HG . . 5.500 4.154 2.895 4.703 . 0 0 "[ . 1]" 1
674 1 98 LEU H 1 120 ASP H . . 4.000 3.010 2.606 3.354 . 0 0 "[ . 1]" 1
675 1 98 LEU H 1 121 THR HA . . 4.000 3.551 3.198 3.708 . 0 0 "[ . 1]" 1
676 1 98 LEU H 1 122 ILE MG . . 5.500 4.844 4.196 5.449 . 0 0 "[ . 1]" 1
677 1 98 LEU HA 1 99 TYR H . . 3.000 2.238 2.179 2.291 . 0 0 "[ . 1]" 1
678 1 98 LEU HB3 1 99 TYR H . . 4.000 3.590 3.002 4.045 0.045 3 0 "[ . 1]" 1
679 1 98 LEU QD 1 99 TYR H . . 5.500 3.177 2.150 3.833 . 0 0 "[ . 1]" 1
680 1 98 LEU QD 1 145 ARG HB3 . . 5.500 4.427 3.385 5.049 . 0 0 "[ . 1]" 1
681 1 98 LEU QD 1 158 ALA H . . 5.500 3.740 2.679 4.627 . 0 0 "[ . 1]" 1
682 1 98 LEU QD 1 159 PHE H . . 5.500 4.691 4.352 5.038 . 0 0 "[ . 1]" 1
683 1 98 LEU QD 1 160 GLN H . . 5.500 4.615 3.684 5.274 . 0 0 "[ . 1]" 1
684 1 98 LEU HG 1 99 TYR H . . 5.500 3.601 2.259 4.860 . 0 0 "[ . 1]" 1
685 1 98 LEU O 1 120 ASP H . . 3.000 3.016 2.959 3.090 0.090 5 0 "[ . 1]" 1
686 1 99 TYR H 1 99 TYR HB3 . . 4.000 3.415 2.399 3.764 . 0 0 "[ . 1]" 1
687 1 99 TYR H 1 157 LEU HA . . 5.000 4.539 4.238 4.936 . 0 0 "[ . 1]" 1
688 1 99 TYR H 1 157 LEU HB3 . . 5.500 5.527 5.014 6.375 0.875 5 1 "[ + 1]" 1
689 1 99 TYR H 1 157 LEU QD . . 5.500 4.276 2.430 5.265 . 0 0 "[ . 1]" 1
690 1 99 TYR H 1 158 ALA H . . 4.000 2.810 2.552 3.066 . 0 0 "[ . 1]" 1
691 1 99 TYR H 1 158 ALA HA . . 5.000 4.821 4.318 5.027 0.027 6 0 "[ . 1]" 1
692 1 99 TYR H 1 158 ALA O . . 3.000 2.053 1.834 2.269 . 0 0 "[ . 1]" 1
693 1 99 TYR H 1 159 PHE HA . . 4.000 3.784 3.441 4.045 0.045 3 0 "[ . 1]" 1
694 1 99 TYR HA 1 100 TYR H . . 3.000 2.440 2.314 2.530 . 0 0 "[ . 1]" 1
695 1 99 TYR HA 1 117 VAL H . . 5.500 4.549 4.154 5.053 . 0 0 "[ . 1]" 1
696 1 99 TYR HA 1 118 LYS HA . . 5.500 2.302 2.000 3.174 . 0 0 "[ . 1]" 1
697 1 99 TYR HA 1 119 ILE H . . 3.000 2.523 2.207 2.704 . 0 0 "[ . 1]" 1
698 1 99 TYR HA 1 120 ASP H . . 5.500 4.928 4.603 5.140 . 0 0 "[ . 1]" 1
699 1 99 TYR HB3 1 100 TYR H . . 4.000 2.976 2.431 4.028 0.028 3 0 "[ . 1]" 1
700 1 99 TYR HB3 1 117 VAL H . . 5.500 4.078 3.353 5.553 0.053 10 0 "[ . 1]" 1
701 1 99 TYR HB3 1 158 ALA H . . 5.500 4.640 4.001 5.184 . 0 0 "[ . 1]" 1
702 1 99 TYR O 1 158 ALA H . . 3.000 2.122 1.767 2.395 . 0 0 "[ . 1]" 1
703 1 100 TYR H 1 100 TYR HB3 . . 4.000 3.186 2.820 3.589 . 0 0 "[ . 1]" 1
704 1 100 TYR H 1 117 VAL H . . 3.000 2.788 2.150 3.010 0.010 10 0 "[ . 1]" 1
705 1 100 TYR H 1 117 VAL HA . . 5.000 4.728 4.105 5.022 0.022 1 0 "[ . 1]" 1
706 1 100 TYR H 1 117 VAL MG1 . . 5.500 4.293 3.601 4.880 . 0 0 "[ . 1]" 1
707 1 100 TYR H 1 117 VAL MG2 . . 5.500 4.688 4.236 5.361 . 0 0 "[ . 1]" 1
708 1 100 TYR H 1 118 LYS HA . . 4.000 3.821 3.647 4.026 0.026 7 0 "[ . 1]" 1
709 1 100 TYR H 1 157 LEU HA . . 5.500 5.157 4.621 5.508 0.008 7 0 "[ . 1]" 1
710 1 100 TYR HA 1 101 TYR H . . 3.000 2.470 2.411 2.531 . 0 0 "[ . 1]" 1
711 1 100 TYR HA 1 117 VAL H . . 5.500 4.941 4.325 5.353 . 0 0 "[ . 1]" 1
712 1 100 TYR HA 1 158 ALA H . . 4.000 3.756 3.393 4.024 0.024 5 0 "[ . 1]" 1
713 1 100 TYR HB3 1 101 TYR H . . 4.000 3.370 2.526 4.106 0.106 7 0 "[ . 1]" 1
714 1 101 TYR HA 1 102 GLU H . . 3.000 2.218 2.188 2.319 . 0 0 "[ . 1]" 1
715 1 101 TYR O 1 156 TYR H . . 3.000 2.947 2.420 3.102 0.102 7 0 "[ . 1]" 1
716 1 102 GLU H 1 102 GLU HA . . 3.000 2.897 2.848 2.916 . 0 0 "[ . 1]" 1
717 1 102 GLU H 1 150 LEU MD2 . . 5.500 5.427 4.591 6.466 0.966 6 1 "[ .+ 1]" 1
718 1 102 GLU H 1 150 LEU HG . . 5.500 5.316 4.812 5.541 0.041 7 0 "[ . 1]" 1
719 1 102 GLU HA 1 103 SER H . . 3.000 2.329 2.251 2.419 . 0 0 "[ . 1]" 1
720 1 102 GLU HG3 1 155 PHE H . . 5.500 5.173 3.294 6.681 1.181 6 3 "[*- .+ 1]" 1
721 1 103 SER H 1 104 ASP H . . 5.500 4.409 4.306 4.608 . 0 0 "[ . 1]" 1
722 1 103 SER H 1 154 GLY O . . 5.500 4.214 3.033 5.502 0.002 8 0 "[ . 1]" 1
723 1 103 SER HA 1 104 ASP H . . 3.000 2.476 2.303 2.596 . 0 0 "[ . 1]" 1
724 1 104 ASP H 1 104 ASP HA . . 3.000 2.871 2.813 2.904 . 0 0 "[ . 1]" 1
725 1 104 ASP H 1 104 ASP HB3 . . 4.000 2.898 2.535 3.329 . 0 0 "[ . 1]" 1
726 1 104 ASP HA 1 105 ASN H . . 3.000 2.611 2.436 2.718 . 0 0 "[ . 1]" 1
727 1 104 ASP HB3 1 105 ASN H . . 4.000 3.295 2.391 3.786 . 0 0 "[ . 1]" 1
728 1 105 ASN H 1 105 ASN HB3 . . 4.000 3.110 2.390 3.515 . 0 0 "[ . 1]" 1
729 1 110 PHE HA 1 111 ILE H . . 3.000 2.272 2.225 2.291 . 0 0 "[ . 1]" 1
730 1 110 PHE HB3 1 111 ILE H . . 4.000 3.122 3.026 3.369 . 0 0 "[ . 1]" 1
731 1 110 PHE HB3 1 112 ARG H . . 4.000 2.894 2.705 3.306 . 0 0 "[ . 1]" 1
732 1 111 ILE H 1 112 ARG H . . 5.500 2.547 2.282 2.785 . 0 0 "[ . 1]" 1
733 1 111 ILE HA 1 112 ARG H . . 4.000 3.565 3.525 3.601 . 0 0 "[ . 1]" 1
734 1 111 ILE HB 1 112 ARG H . . 5.000 3.619 2.741 4.010 . 0 0 "[ . 1]" 1
735 1 111 ILE MD 1 111 ILE MG . . 4.000 2.401 1.929 3.073 . 0 0 "[ . 1]" 1
736 1 111 ILE MD 1 112 ARG H . . 5.500 4.041 2.770 4.996 . 0 0 "[ . 1]" 1
737 1 111 ILE MG 1 112 ARG H . . 5.500 3.745 2.135 4.202 . 0 0 "[ . 1]" 1
738 1 112 ARG H 1 112 ARG HA . . 3.000 2.765 2.735 2.784 . 0 0 "[ . 1]" 1
739 1 112 ARG H 1 112 ARG HG3 . . 5.000 3.457 2.314 4.575 . 0 0 "[ . 1]" 1
740 1 112 ARG H 1 113 GLU H . . 5.500 2.695 2.622 2.824 . 0 0 "[ . 1]" 1
741 1 112 ARG H 1 113 GLU HA . . 5.500 5.207 5.143 5.308 . 0 0 "[ . 1]" 1
742 1 112 ARG HA 1 113 GLU H . . 4.000 3.619 3.570 3.640 . 0 0 "[ . 1]" 1
743 1 112 ARG HB3 1 114 ASN H . . 5.500 5.326 4.957 5.675 0.175 9 0 "[ . 1]" 1
744 1 113 GLU H 1 113 GLU HA . . 3.000 2.775 2.728 2.848 . 0 0 "[ . 1]" 1
745 1 113 GLU H 1 113 GLU HB3 . . 4.000 3.000 2.542 3.465 . 0 0 "[ . 1]" 1
746 1 113 GLU HA 1 114 ASN H . . 4.000 3.619 3.567 3.638 . 0 0 "[ . 1]" 1
747 1 114 ASN H 1 114 ASN HA . . 3.000 2.745 2.711 2.774 . 0 0 "[ . 1]" 1
748 1 116 PHE HA 1 117 VAL H . . 3.000 2.510 2.395 2.718 . 0 0 "[ . 1]" 1
749 1 116 PHE HB3 1 117 VAL H . . 4.000 3.222 2.108 3.878 . 0 0 "[ . 1]" 1
750 1 117 VAL H 1 118 LYS H . . 5.500 4.209 4.005 4.430 . 0 0 "[ . 1]" 1
751 1 117 VAL HA 1 118 LYS H . . 3.000 2.191 2.182 2.220 . 0 0 "[ . 1]" 1
752 1 117 VAL MG1 1 118 LYS H . . 5.000 2.911 2.714 3.200 . 0 0 "[ . 1]" 1
753 1 117 VAL MG2 1 118 LYS H . . 5.000 4.128 3.881 4.348 . 0 0 "[ . 1]" 1
754 1 118 LYS H 1 118 LYS HA . . 3.000 2.827 2.770 2.884 . 0 0 "[ . 1]" 1
755 1 118 LYS H 1 118 LYS HB3 . . 4.000 2.516 2.289 3.527 . 0 0 "[ . 1]" 1
756 1 118 LYS H 1 118 LYS HD3 . . 5.000 4.236 3.361 4.891 . 0 0 "[ . 1]" 1
757 1 118 LYS H 1 118 LYS HG3 . . 5.000 3.363 2.427 4.535 . 0 0 "[ . 1]" 1
758 1 118 LYS HA 1 119 ILE H . . 3.000 2.237 2.190 2.319 . 0 0 "[ . 1]" 1
759 1 118 LYS HA 1 120 ASP H . . 5.500 4.808 4.579 5.305 . 0 0 "[ . 1]" 1
760 1 118 LYS HB3 1 119 ILE H . . 5.500 4.174 3.233 4.436 . 0 0 "[ . 1]" 1
761 1 119 ILE H 1 119 ILE MD . . 5.000 3.667 3.157 4.042 . 0 0 "[ . 1]" 1
762 1 119 ILE H 1 120 ASP H . . 5.500 2.772 2.458 3.102 . 0 0 "[ . 1]" 1
763 1 119 ILE HA 1 120 ASP H . . 4.000 3.620 3.541 3.639 . 0 0 "[ . 1]" 1
764 1 119 ILE HB 1 122 ILE MD . . 5.500 5.522 5.163 5.668 0.168 5 0 "[ . 1]" 1
765 1 119 ILE MD 1 120 ASP H . . 5.500 4.471 3.953 4.692 . 0 0 "[ . 1]" 1
766 1 119 ILE HG13 1 147 VAL QG . . 5.500 4.625 3.303 5.443 . 0 0 "[ . 1]" 1
767 1 119 ILE MG 1 120 ASP H . . 5.500 2.633 2.077 2.869 . 0 0 "[ . 1]" 1
768 1 119 ILE MG 1 121 THR H . . 5.500 5.392 5.133 5.507 0.007 3 0 "[ . 1]" 1
769 1 120 ASP HA 1 121 THR H . . 3.000 2.664 2.501 2.701 . 0 0 "[ . 1]" 1
770 1 120 ASP HB3 1 121 THR H . . 4.000 2.728 2.246 3.712 . 0 0 "[ . 1]" 1
771 1 120 ASP HB3 1 122 ILE MG . . 5.500 3.701 3.286 5.016 . 0 0 "[ . 1]" 1
772 1 121 THR H 1 121 THR HA . . 3.000 2.931 2.915 2.943 . 0 0 "[ . 1]" 1
773 1 121 THR H 1 121 THR HB . . 4.000 2.549 2.209 3.511 . 0 0 "[ . 1]" 1
774 1 121 THR H 1 122 ILE H . . 5.500 4.497 4.452 4.531 . 0 0 "[ . 1]" 1
775 1 121 THR H 1 122 ILE MG . . 5.500 4.486 4.262 4.981 . 0 0 "[ . 1]" 1
776 1 121 THR HA 1 122 ILE H . . 3.000 2.170 2.154 2.190 . 0 0 "[ . 1]" 1
777 1 121 THR MG 1 122 ILE H . . 5.000 2.921 2.556 3.897 . 0 0 "[ . 1]" 1
778 1 122 ILE H 1 122 ILE HA . . 3.000 2.938 2.933 2.940 . 0 0 "[ . 1]" 1
779 1 122 ILE H 1 122 ILE HB . . 4.000 3.635 3.415 3.721 . 0 0 "[ . 1]" 1
780 1 122 ILE H 1 122 ILE HG13 . . 5.000 2.868 2.080 3.325 . 0 0 "[ . 1]" 1
781 1 122 ILE H 1 123 ALA H . . 5.500 4.481 4.454 4.521 . 0 0 "[ . 1]" 1
782 1 122 ILE HA 1 123 ALA H . . 3.000 2.264 2.241 2.287 . 0 0 "[ . 1]" 1
783 1 122 ILE MD 1 123 ALA H . . 5.000 4.992 4.891 5.052 0.052 6 0 "[ . 1]" 1
784 1 122 ILE MD 1 143 GLU H . . 5.500 5.486 5.136 5.593 0.093 8 0 "[ . 1]" 1
785 1 122 ILE MD 1 143 GLU HG3 . . 5.500 3.747 2.691 4.752 . 0 0 "[ . 1]" 1
786 1 122 ILE HG13 1 123 ALA H . . 5.500 4.442 4.164 4.890 . 0 0 "[ . 1]" 1
787 1 123 ALA H 1 123 ALA MB . . 3.000 2.585 2.458 2.670 . 0 0 "[ . 1]" 1
788 1 123 ALA H 1 124 ALA H . . 5.500 4.404 4.386 4.437 . 0 0 "[ . 1]" 1
789 1 124 ALA H 1 125 ASP H . . 5.500 4.392 4.193 4.629 . 0 0 "[ . 1]" 1
790 1 124 ALA HA 1 125 ASP H . . 3.000 2.346 2.187 2.606 . 0 0 "[ . 1]" 1
791 1 124 ALA MB 1 125 ASP H . . 5.000 3.206 2.272 3.668 . 0 0 "[ . 1]" 1
792 1 124 ALA MB 1 141 ASN HD21 . . 3.000 2.285 1.893 2.823 . 0 0 "[ . 1]" 1
793 1 125 ASP H 1 141 ASN HD21 . . 4.000 3.998 3.911 4.056 0.056 9 0 "[ . 1]" 1
794 1 125 ASP HA 1 127 SER H . . 4.000 3.978 3.832 4.020 0.020 7 0 "[ . 1]" 1
795 1 126 GLU H 1 127 SER H . . 5.500 3.585 3.005 3.755 . 0 0 "[ . 1]" 1
796 1 126 GLU HA 1 127 SER H . . 4.000 3.637 3.599 3.646 . 0 0 "[ . 1]" 1
797 1 127 SER H 1 127 SER HB3 . . 4.000 3.497 2.922 3.881 . 0 0 "[ . 1]" 1
798 1 127 SER H 1 128 PHE H . . 5.500 3.273 2.662 4.010 . 0 0 "[ . 1]" 1
799 1 127 SER H 1 142 THR HB . . 5.000 4.916 4.404 5.021 0.021 8 0 "[ . 1]" 1
800 1 128 PHE H 1 128 PHE HA . . 3.000 2.887 2.806 2.937 . 0 0 "[ . 1]" 1
801 1 128 PHE H 1 129 THR H . . 5.500 4.460 4.320 4.549 . 0 0 "[ . 1]" 1
802 1 128 PHE HA 1 129 THR H . . 3.000 2.198 2.194 2.205 . 0 0 "[ . 1]" 1
803 1 129 THR H 1 129 THR HA . . 3.000 2.941 2.916 2.947 . 0 0 "[ . 1]" 1
804 1 129 THR H 1 129 THR HB . . 4.000 3.017 2.571 3.804 . 0 0 "[ . 1]" 1
805 1 129 THR H 1 130 GLN H . . 5.500 4.381 4.117 4.526 . 0 0 "[ . 1]" 1
806 1 129 THR H 1 130 GLN HA . . 5.500 4.731 4.578 4.920 . 0 0 "[ . 1]" 1
807 1 129 THR H 1 139 LYS HG3 . . 5.500 5.429 4.287 6.822 1.322 7 2 "[ . + -]" 1
808 1 129 THR H 1 140 LEU HA . . 5.500 5.004 4.424 5.372 . 0 0 "[ . 1]" 1
809 1 129 THR H 1 140 LEU QD . . 4.000 3.525 2.191 3.947 . 0 0 "[ . 1]" 1
810 1 129 THR HA 1 130 GLN H . . 3.000 2.214 2.149 2.262 . 0 0 "[ . 1]" 1
811 1 129 THR HB 1 130 GLN H . . 4.000 3.908 3.564 4.035 0.035 9 0 "[ . 1]" 1
812 1 129 THR HB 1 140 LEU QD . . 5.500 3.353 1.841 4.732 . 0 0 "[ . 1]" 1
813 1 130 GLN H 1 130 GLN HB3 . . 4.000 2.818 2.426 3.315 . 0 0 "[ . 1]" 1
814 1 130 GLN HA 1 140 LEU H . . 4.000 3.986 3.693 4.116 0.116 9 0 "[ . 1]" 1
815 1 131 VAL HA 1 132 ASP H . . 3.000 2.280 2.269 2.296 . 0 0 "[ . 1]" 1
816 1 131 VAL HB 1 132 ASP H . . 4.000 4.034 3.990 4.164 0.164 5 0 "[ . 1]" 1
817 1 131 VAL HB 1 140 LEU H . . 5.500 5.204 3.258 5.530 0.030 5 0 "[ . 1]" 1
818 1 131 VAL MG2 1 132 ASP H . . 5.000 3.496 2.028 4.090 . 0 0 "[ . 1]" 1
819 1 131 VAL MG2 1 140 LEU H . . 5.500 4.825 2.301 6.417 0.917 5 3 "[ + * -]" 1
820 1 132 ASP H 1 132 ASP HA . . 3.000 2.832 2.804 2.870 . 0 0 "[ . 1]" 1
821 1 132 ASP H 1 133 ILE MG . . 5.500 5.281 4.803 5.700 0.200 9 0 "[ . 1]" 1
822 1 132 ASP HA 1 133 ILE H . . 3.000 2.334 2.310 2.418 . 0 0 "[ . 1]" 1
823 1 132 ASP HB3 1 133 ILE H . . 4.000 4.208 2.908 4.541 0.541 1 6 "[+ * *- * *]" 1
824 1 133 ILE H 1 133 ILE HA . . 3.000 2.931 2.883 2.939 . 0 0 "[ . 1]" 1
825 1 133 ILE H 1 133 ILE MD . . 5.000 4.422 3.542 4.634 . 0 0 "[ . 1]" 1
826 1 133 ILE H 1 133 ILE HG13 . . 5.000 4.497 4.414 4.644 . 0 0 "[ . 1]" 1
827 1 133 ILE H 1 134 GLY H . . 5.500 4.504 4.465 4.624 . 0 0 "[ . 1]" 1
828 1 133 ILE HA 1 134 GLY H . . 3.000 2.371 2.300 2.435 . 0 0 "[ . 1]" 1
829 1 133 ILE HA 1 135 ASP H . . 4.000 3.834 3.330 4.024 0.024 3 0 "[ . 1]" 1
830 1 133 ILE HB 1 134 GLY H . . 4.000 4.041 3.789 4.131 0.131 7 0 "[ . 1]" 1
831 1 133 ILE MD 1 134 GLY H . . 5.000 3.617 2.479 3.889 . 0 0 "[ . 1]" 1
832 1 133 ILE MD 1 135 ASP H . . 5.500 3.587 3.282 4.088 . 0 0 "[ . 1]" 1
833 1 133 ILE HG13 1 134 GLY H . . 5.500 2.306 1.930 3.694 . 0 0 "[ . 1]" 1
834 1 133 ILE MG 1 135 ASP H . . 5.500 3.158 2.066 4.700 . 0 0 "[ . 1]" 1
835 1 134 GLY H 1 134 GLY HA3 . . 3.000 2.495 2.375 2.920 . 0 0 "[ . 1]" 1
836 1 134 GLY H 1 135 ASP H . . 5.500 2.196 1.835 2.954 . 0 0 "[ . 1]" 1
837 1 134 GLY HA3 1 135 ASP H . . 5.000 3.326 3.000 3.514 . 0 0 "[ . 1]" 1
838 1 139 LYS HA 1 140 LEU H . . 3.000 2.212 2.199 2.229 . 0 0 "[ . 1]" 1
839 1 140 LEU H 1 140 LEU HA . . 3.000 2.891 2.880 2.904 . 0 0 "[ . 1]" 1
840 1 140 LEU H 1 140 LEU HB3 . . 4.000 3.096 2.277 3.597 . 0 0 "[ . 1]" 1
841 1 140 LEU H 1 140 LEU QD . . 5.000 2.540 1.823 3.657 . 0 0 "[ . 1]" 1
842 1 140 LEU HA 1 141 ASN H . . 3.000 2.218 2.176 2.259 . 0 0 "[ . 1]" 1
843 1 140 LEU QD 1 169 VAL MG1 . . 5.500 3.307 2.551 4.145 . 0 0 "[ . 1]" 1
844 1 141 ASN H 1 141 ASN HD21 . . 5.000 4.396 3.400 4.770 . 0 0 "[ . 1]" 1
845 1 141 ASN H 1 141 ASN QD . . 5.000 3.980 3.233 4.238 . 0 0 "[ . 1]" 1
846 1 141 ASN H 1 142 THR HG1 . . 5.500 4.126 3.821 4.473 . 0 0 "[ . 1]" 1
847 1 141 ASN H 1 142 THR MG . . 5.500 5.472 5.191 5.542 0.042 6 0 "[ . 1]" 1
848 1 141 ASN HA 1 142 THR H . . 3.000 2.274 2.260 2.345 . 0 0 "[ . 1]" 1
849 1 141 ASN HB3 1 142 THR H . . 4.000 3.502 3.348 4.087 0.087 9 0 "[ . 1]" 1
850 1 142 THR H 1 142 THR HA . . 3.000 2.947 2.945 2.949 . 0 0 "[ . 1]" 1
851 1 142 THR H 1 142 THR HB . . 4.000 2.842 2.742 2.948 . 0 0 "[ . 1]" 1
852 1 142 THR H 1 143 GLU H . . 5.500 4.395 4.316 4.444 . 0 0 "[ . 1]" 1
853 1 142 THR HA 1 143 GLU H . . 3.000 2.183 2.155 2.219 . 0 0 "[ . 1]" 1
854 1 142 THR HB 1 143 GLU H . . 4.000 4.033 3.969 4.095 0.095 10 0 "[ . 1]" 1
855 1 142 THR HG1 1 143 GLU H . . 5.000 4.764 4.475 5.013 0.013 3 0 "[ . 1]" 1
856 1 142 THR MG 1 143 GLU H . . 5.000 2.829 2.536 3.066 . 0 0 "[ . 1]" 1
857 1 143 GLU H 1 143 GLU HA . . 3.000 2.913 2.900 2.919 . 0 0 "[ . 1]" 1
858 1 143 GLU H 1 143 GLU HB3 . . 4.000 3.231 2.823 3.767 . 0 0 "[ . 1]" 1
859 1 143 GLU H 1 143 GLU HG3 . . 5.000 4.638 3.517 4.921 . 0 0 "[ . 1]" 1
860 1 143 GLU H 1 144 ILE H . . 5.500 4.359 4.286 4.417 . 0 0 "[ . 1]" 1
861 1 143 GLU HA 1 144 ILE H . . 3.000 2.235 2.229 2.238 . 0 0 "[ . 1]" 1
862 1 143 GLU HG3 1 144 ILE H . . 5.000 4.320 2.899 5.010 0.010 3 0 "[ . 1]" 1
863 1 144 ILE H 1 144 ILE HA . . 3.000 2.927 2.911 2.938 . 0 0 "[ . 1]" 1
864 1 144 ILE H 1 144 ILE HB . . 4.000 2.305 2.160 2.459 . 0 0 "[ . 1]" 1
865 1 144 ILE H 1 144 ILE MD . . 5.000 3.879 3.685 4.121 . 0 0 "[ . 1]" 1
866 1 144 ILE H 1 144 ILE HG13 . . 5.000 3.133 2.941 3.400 . 0 0 "[ . 1]" 1
867 1 144 ILE HA 1 145 ARG H . . 3.000 2.230 2.176 2.316 . 0 0 "[ . 1]" 1
868 1 144 ILE MD 1 145 ARG H . . 5.000 4.969 4.831 5.081 0.081 5 0 "[ . 1]" 1
869 1 144 ILE HG13 1 145 ARG H . . 5.000 4.734 4.424 4.926 . 0 0 "[ . 1]" 1
870 1 145 ARG H 1 145 ARG HA . . 3.000 2.898 2.857 2.913 . 0 0 "[ . 1]" 1
871 1 145 ARG H 1 145 ARG HB3 . . 4.000 3.280 2.773 3.688 . 0 0 "[ . 1]" 1
872 1 145 ARG H 1 146 ASP H . . 5.500 4.449 4.383 4.495 . 0 0 "[ . 1]" 1
873 1 145 ARG HA 1 146 ASP H . . 3.000 2.548 2.318 2.680 . 0 0 "[ . 1]" 1
874 1 146 ASP H 1 146 ASP HA . . 3.000 2.908 2.903 2.915 . 0 0 "[ . 1]" 1
875 1 146 ASP H 1 146 ASP HB3 . . 4.000 3.399 3.309 3.589 . 0 0 "[ . 1]" 1
876 1 146 ASP H 1 147 VAL HA . . 5.500 4.849 4.668 4.947 . 0 0 "[ . 1]" 1
877 1 146 ASP H 1 147 VAL QG . . 5.500 4.148 3.319 4.878 . 0 0 "[ . 1]" 1
878 1 146 ASP HA 1 147 VAL H . . 3.000 2.415 2.335 2.511 . 0 0 "[ . 1]" 1
879 1 146 ASP HB3 1 147 VAL H . . 4.000 3.797 3.480 4.004 0.004 3 0 "[ . 1]" 1
880 1 147 VAL H 1 147 VAL HA . . 3.000 2.879 2.858 2.937 . 0 0 "[ . 1]" 1
881 1 147 VAL H 1 147 VAL HB . . 4.000 3.219 2.912 3.808 . 0 0 "[ . 1]" 1
882 1 147 VAL H 1 148 GLY H . . 5.500 4.351 4.246 4.459 . 0 0 "[ . 1]" 1
883 1 147 VAL HA 1 148 GLY H . . 3.000 2.419 2.273 2.504 . 0 0 "[ . 1]" 1
884 1 147 VAL HB 1 148 GLY H . . 4.000 3.650 2.509 4.213 0.213 1 0 "[ . 1]" 1
885 1 147 VAL QG 1 148 GLY H . . 5.000 2.250 1.866 3.257 . 0 0 "[ . 1]" 1
886 1 153 LYS HA 1 154 GLY H . . 3.000 2.490 2.178 2.913 . 0 0 "[ . 1]" 1
887 1 154 GLY H 1 155 PHE H . . 5.500 3.452 2.225 4.393 . 0 0 "[ . 1]" 1
888 1 155 PHE H 1 155 PHE HA . . 3.000 2.914 2.897 2.936 . 0 0 "[ . 1]" 1
889 1 155 PHE H 1 155 PHE HB3 . . 4.000 3.095 2.244 3.780 . 0 0 "[ . 1]" 1
890 1 156 TYR HA 1 157 LEU H . . 3.000 2.359 2.190 2.658 . 0 0 "[ . 1]" 1
891 1 156 TYR HB3 1 157 LEU H . . 4.000 3.395 2.560 3.896 . 0 0 "[ . 1]" 1
892 1 157 LEU H 1 157 LEU HB3 . . 4.000 3.225 2.338 3.668 . 0 0 "[ . 1]" 1
893 1 157 LEU HA 1 158 ALA H . . 3.000 2.302 2.236 2.342 . 0 0 "[ . 1]" 1
894 1 157 LEU HB3 1 158 ALA H . . 4.000 3.659 2.864 4.219 0.219 5 0 "[ . 1]" 1
895 1 158 ALA HA 1 159 PHE H . . 3.000 2.321 2.229 2.418 . 0 0 "[ . 1]" 1
896 1 158 ALA MB 1 159 PHE H . . 4.000 2.848 2.562 3.113 . 0 0 "[ . 1]" 1
897 1 159 PHE HA 1 160 GLN H . . 3.000 2.363 2.282 2.439 . 0 0 "[ . 1]" 1
898 1 159 PHE HB3 1 160 GLN H . . 4.000 3.525 2.623 4.069 0.069 6 0 "[ . 1]" 1
899 1 160 GLN H 1 161 ASP H . . 5.500 4.255 4.097 4.427 . 0 0 "[ . 1]" 1
900 1 160 GLN HA 1 161 ASP H . . 3.000 2.223 2.202 2.277 . 0 0 "[ . 1]" 1
901 1 160 GLN HB3 1 161 ASP H . . 5.500 3.867 3.531 4.067 . 0 0 "[ . 1]" 1
902 1 161 ASP H 1 161 ASP HB3 . . 4.000 2.853 2.190 3.682 . 0 0 "[ . 1]" 1
903 1 162 VAL HA 1 163 GLY H . . 3.000 2.219 2.182 2.327 . 0 0 "[ . 1]" 1
904 1 162 VAL HB 1 163 GLY H . . 5.500 4.182 3.433 4.669 . 0 0 "[ . 1]" 1
905 1 162 VAL QG 1 163 GLY H . . 5.500 3.343 2.808 3.756 . 0 0 "[ . 1]" 1
906 1 163 GLY H 1 163 GLY HA3 . . 3.000 2.683 2.612 2.739 . 0 0 "[ . 1]" 1
907 1 163 GLY H 1 164 ALA H . . 5.500 3.148 2.923 3.372 . 0 0 "[ . 1]" 1
908 1 163 GLY H 1 164 ALA HA . . 5.500 5.525 5.404 5.610 0.110 4 0 "[ . 1]" 1
909 1 163 GLY H 1 164 ALA MB . . 5.500 4.446 4.341 4.546 . 0 0 "[ . 1]" 1
910 1 163 GLY HA3 1 164 ALA H . . 4.000 3.641 3.634 3.645 . 0 0 "[ . 1]" 1
911 1 164 ALA H 1 165 CYS H . . 5.500 4.390 4.278 4.439 . 0 0 "[ . 1]" 1
912 1 164 ALA HA 1 165 CYS H . . 3.000 2.435 2.270 2.511 . 0 0 "[ . 1]" 1
913 1 164 ALA MB 1 165 CYS H . . 4.000 2.605 2.441 2.921 . 0 0 "[ . 1]" 1
914 1 164 ALA MB 1 166 ILE HB . . 5.500 4.719 4.423 5.468 . 0 0 "[ . 1]" 1
915 1 164 ALA MB 1 166 ILE MG . . 5.500 2.518 2.137 3.431 . 0 0 "[ . 1]" 1
916 1 165 CYS H 1 165 CYS HB3 . . 4.000 3.580 2.302 3.864 . 0 0 "[ . 1]" 1
917 1 165 CYS H 1 166 ILE H . . 5.500 4.107 3.908 4.399 . 0 0 "[ . 1]" 1
918 1 165 CYS H 1 166 ILE HB . . 5.500 5.463 5.016 5.921 0.421 9 0 "[ . 1]" 1
919 1 165 CYS H 1 166 ILE MD . . 5.500 5.523 5.174 5.652 0.152 2 0 "[ . 1]" 1
920 1 165 CYS H 1 166 ILE MG . . 5.500 3.174 3.080 3.444 . 0 0 "[ . 1]" 1
921 1 165 CYS HA 1 166 ILE H . . 3.000 2.247 2.221 2.265 . 0 0 "[ . 1]" 1
922 1 165 CYS HB3 1 166 ILE H . . 4.000 3.916 3.677 4.492 0.492 2 0 "[ . 1]" 1
923 1 166 ILE H 1 166 ILE HA . . 3.000 2.907 2.894 2.926 . 0 0 "[ . 1]" 1
924 1 166 ILE H 1 166 ILE HB . . 4.000 3.814 3.732 3.888 . 0 0 "[ . 1]" 1
925 1 166 ILE H 1 166 ILE MD . . 5.000 2.649 2.131 3.574 . 0 0 "[ . 1]" 1
926 1 166 ILE HA 1 167 ALA H . . 3.000 2.330 2.217 2.458 . 0 0 "[ . 1]" 1
927 1 166 ILE HB 1 167 ALA H . . 4.000 3.209 2.522 3.696 . 0 0 "[ . 1]" 1
928 1 166 ILE MD 1 167 ALA H . . 5.000 3.672 3.501 3.881 . 0 0 "[ . 1]" 1
929 1 166 ILE MD 1 168 LEU H . . 5.500 4.380 4.014 4.991 . 0 0 "[ . 1]" 1
930 1 166 ILE MD 1 168 LEU QD . . 5.500 2.660 2.149 2.951 . 0 0 "[ . 1]" 1
931 1 166 ILE MG 1 167 ALA H . . 5.500 4.156 3.385 4.428 . 0 0 "[ . 1]" 1
932 1 166 ILE MG 1 168 LEU QD . . 5.500 4.765 4.356 4.958 . 0 0 "[ . 1]" 1
933 1 167 ALA H 1 167 ALA HA . . 3.000 2.938 2.935 2.943 . 0 0 "[ . 1]" 1
934 1 167 ALA HA 1 168 LEU H . . 3.000 2.373 2.335 2.404 . 0 0 "[ . 1]" 1
935 1 167 ALA MB 1 168 LEU H . . 4.000 2.687 2.626 2.767 . 0 0 "[ . 1]" 1
936 1 168 LEU H 1 168 LEU HB3 . . 4.000 3.590 3.520 3.644 . 0 0 "[ . 1]" 1
937 1 168 LEU H 1 169 VAL H . . 5.500 4.316 4.207 4.510 . 0 0 "[ . 1]" 1
938 1 168 LEU H 1 169 VAL HA . . 5.500 4.937 4.800 5.106 . 0 0 "[ . 1]" 1
939 1 168 LEU HA 1 169 VAL H . . 3.000 2.189 2.176 2.198 . 0 0 "[ . 1]" 1
940 1 168 LEU HA 1 170 SER H . . 4.000 4.090 4.025 4.137 0.137 4 0 "[ . 1]" 1
941 1 168 LEU HB3 1 170 SER H . . 5.500 4.362 4.086 4.479 . 0 0 "[ . 1]" 1
942 1 168 LEU QD 1 169 VAL H . . 5.500 3.570 3.028 4.166 . 0 0 "[ . 1]" 1
943 1 168 LEU QD 1 169 VAL MG2 . . 5.500 4.833 4.434 5.221 . 0 0 "[ . 1]" 1
944 1 168 LEU QD 1 170 SER H . . 5.500 4.334 3.911 4.823 . 0 0 "[ . 1]" 1
945 1 169 VAL H 1 169 VAL HA . . 3.000 2.877 2.856 2.916 . 0 0 "[ . 1]" 1
946 1 169 VAL H 1 169 VAL HB . . 4.000 2.241 2.180 2.332 . 0 0 "[ . 1]" 1
947 1 169 VAL H 1 170 SER H . . 5.500 2.514 2.271 2.615 . 0 0 "[ . 1]" 1
948 1 169 VAL HA 1 170 SER H . . 4.000 3.636 3.628 3.639 . 0 0 "[ . 1]" 1
949 1 169 VAL MG2 1 170 SER H . . 5.000 3.930 3.805 3.972 . 0 0 "[ . 1]" 1
950 1 170 SER H 1 171 VAL H . . 5.500 4.347 4.338 4.352 . 0 0 "[ . 1]" 1
951 1 170 SER H 1 171 VAL QG . . 5.500 3.850 3.299 4.818 . 0 0 "[ . 1]" 1
952 1 170 SER HA 1 171 VAL H . . 4.000 2.574 2.493 2.734 . 0 0 "[ . 1]" 1
953 1 171 VAL H 1 171 VAL HB . . 4.000 3.374 2.866 3.948 . 0 0 "[ . 1]" 1
954 1 171 VAL H 1 172 ARG H . . 5.500 4.010 3.816 4.395 . 0 0 "[ . 1]" 1
955 1 171 VAL HA 1 172 ARG H . . 4.000 2.217 2.181 2.397 . 0 0 "[ . 1]" 1
956 1 171 VAL QG 1 172 ARG H . . 5.000 3.139 2.065 3.740 . 0 0 "[ . 1]" 1
957 1 172 ARG H 1 172 ARG HB3 . . 4.000 3.432 2.433 3.751 . 0 0 "[ . 1]" 1
958 1 172 ARG H 1 172 ARG HG3 . . 5.500 3.691 2.925 4.795 . 0 0 "[ . 1]" 1
959 1 172 ARG H 1 173 VAL H . . 5.500 4.507 4.368 4.569 . 0 0 "[ . 1]" 1
960 1 172 ARG HA 1 173 VAL H . . 3.000 2.441 2.351 2.503 . 0 0 "[ . 1]" 1
961 1 172 ARG HB3 1 173 VAL H . . 4.000 2.886 2.498 4.014 0.014 1 0 "[ . 1]" 1
962 1 173 VAL H 1 173 VAL HB . . 4.000 2.727 2.396 3.600 . 0 0 "[ . 1]" 1
963 1 173 VAL HA 1 174 PHE H . . 3.000 2.323 2.216 2.473 . 0 0 "[ . 1]" 1
964 1 173 VAL HB 1 174 PHE H . . 5.000 3.889 3.352 4.147 . 0 0 "[ . 1]" 1
965 1 173 VAL MG1 1 174 PHE H . . 5.000 2.263 1.866 3.552 . 0 0 "[ . 1]" 1
966 1 173 VAL MG2 1 174 PHE H . . 5.000 3.963 3.665 4.334 . 0 0 "[ . 1]" 1
967 1 174 PHE H 1 175 TYR H . . 5.500 4.392 4.346 4.409 . 0 0 "[ . 1]" 1
968 1 174 PHE HA 1 175 TYR H . . 3.000 2.482 2.329 2.530 . 0 0 "[ . 1]" 1
969 1 175 TYR H 1 175 TYR HA . . 3.000 2.930 2.906 2.944 . 0 0 "[ . 1]" 1
970 1 175 TYR H 1 175 TYR HB3 . . 4.000 2.920 2.536 3.435 . 0 0 "[ . 1]" 1
971 1 175 TYR HA 1 176 LYS H . . 3.000 2.453 2.300 2.583 . 0 0 "[ . 1]" 1
972 1 175 TYR HB3 1 176 LYS H . . 4.000 3.855 2.791 4.059 0.059 5 0 "[ . 1]" 1
973 1 176 LYS H 1 176 LYS HA . . 3.000 2.926 2.920 2.936 . 0 0 "[ . 1]" 1
974 1 176 LYS H 1 176 LYS HB3 . . 4.000 2.954 2.774 3.246 . 0 0 "[ . 1]" 1
975 1 176 LYS H 1 176 LYS HD3 . . 5.500 5.466 4.995 5.890 0.390 1 0 "[ . 1]" 1
976 1 176 LYS H 1 177 LYS H . . 5.500 4.341 3.874 4.453 . 0 0 "[ . 1]" 1
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