NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
400090 |
1ujo   |
10068 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ujo
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 1876
_Distance_constraint_stats_list.Viol_count 2665
_Distance_constraint_stats_list.Viol_total 3687.750
_Distance_constraint_stats_list.Viol_max 0.960
_Distance_constraint_stats_list.Viol_rms 0.0390
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0049
_Distance_constraint_stats_list.Viol_average_violations_only 0.0692
_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 8 GLU 0.091 0.034 13 0 "[ . 1 . 2]"
1 9 GLU 0.028 0.028 17 0 "[ . 1 . 2]"
1 10 LEU 0.105 0.046 3 0 "[ . 1 . 2]"
1 11 GLU 0.309 0.086 4 0 "[ . 1 . 2]"
1 12 GLU 3.206 0.080 2 0 "[ . 1 . 2]"
1 13 ARG 2.562 0.366 7 0 "[ . 1 . 2]"
1 14 LEU 0.532 0.112 13 0 "[ . 1 . 2]"
1 15 VAL 3.794 0.545 19 2 "[ . 1 . +-]"
1 16 GLU 3.503 0.121 11 0 "[ . 1 . 2]"
1 17 TRP 4.696 0.121 11 0 "[ . 1 . 2]"
1 18 ILE 0.723 0.057 13 0 "[ . 1 . 2]"
1 19 VAL 1.369 0.105 7 0 "[ . 1 . 2]"
1 20 VAL 5.968 0.444 6 0 "[ . 1 . 2]"
1 21 GLN 5.494 0.576 7 2 "[ . + 1 - . 2]"
1 22 CYS 0.335 0.041 6 0 "[ . 1 . 2]"
1 23 GLY 0.511 0.076 20 0 "[ . 1 . 2]"
1 24 PRO 1.349 0.076 20 0 "[ . 1 . 2]"
1 25 ASP 0.045 0.013 7 0 "[ . 1 . 2]"
1 26 VAL 1.080 0.094 14 0 "[ . 1 . 2]"
1 27 GLY 0.682 0.055 4 0 "[ . 1 . 2]"
1 28 ARG 5.443 0.681 20 3 "[ . 1 . * *+]"
1 29 PRO 1.911 0.275 17 0 "[ . 1 . 2]"
1 30 ASP 3.349 0.501 8 1 "[ . + 1 . 2]"
1 31 ARG 10.322 0.501 8 1 "[ . + 1 . 2]"
1 32 GLY 2.781 0.373 4 0 "[ . 1 . 2]"
1 33 ARG 1.347 0.256 18 0 "[ . 1 . 2]"
1 34 LEU 3.384 0.307 17 0 "[ . 1 . 2]"
1 35 GLY 1.940 0.540 1 1 "[+ . 1 . 2]"
1 36 PHE 1.043 0.540 1 1 "[+ . 1 . 2]"
1 37 GLN 1.977 0.229 4 0 "[ . 1 . 2]"
1 38 VAL 0.455 0.187 4 0 "[ . 1 . 2]"
1 39 TRP 0.774 0.087 20 0 "[ . 1 . 2]"
1 40 LEU 0.513 0.039 4 0 "[ . 1 . 2]"
1 41 LYS 4.697 0.948 8 1 "[ . + 1 . 2]"
1 42 ASN 5.324 0.841 17 5 "[ * .- 1 * + *2]"
1 43 GLY 0.029 0.014 16 0 "[ . 1 . 2]"
1 44 VAL 1.370 0.170 3 0 "[ . 1 . 2]"
1 45 ILE 0.619 0.094 14 0 "[ . 1 . 2]"
1 46 LEU 0.056 0.014 4 0 "[ . 1 . 2]"
1 47 SER 0.012 0.006 10 0 "[ . 1 . 2]"
1 48 LYS 0.932 0.170 3 0 "[ . 1 . 2]"
1 49 LEU 4.925 0.193 15 0 "[ . 1 . 2]"
1 50 VAL 0.135 0.028 14 0 "[ . 1 . 2]"
1 51 ASN 0.209 0.049 13 0 "[ . 1 . 2]"
1 52 SER 0.252 0.042 7 0 "[ . 1 . 2]"
1 53 LEU 1.514 0.630 9 1 "[ . +1 . 2]"
1 54 TYR 2.922 0.191 11 0 "[ . 1 . 2]"
1 55 PRO 2.477 0.185 14 0 "[ . 1 . 2]"
1 56 GLU 0.542 0.116 6 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 SER 1.802 0.492 12 0 "[ . 1 . 2]"
1 59 LYS 3.246 0.849 12 2 "[ - 1 + . 2]"
1 60 PRO 0.136 0.024 6 0 "[ . 1 . 2]"
1 61 VAL 0.996 0.960 15 1 "[ . 1 + 2]"
1 62 LYS 0.194 0.043 17 0 "[ . 1 . 2]"
1 63 VAL 1.435 0.104 7 0 "[ . 1 . 2]"
1 64 PRO 1.405 0.104 7 0 "[ . 1 . 2]"
1 65 GLU 0.334 0.189 9 0 "[ . 1 . 2]"
1 66 ASN 8.531 0.857 12 6 "[ **. - 1*+ . * 2]"
1 67 PRO 7.945 0.857 12 6 "[ **. - 1*+ . * 2]"
1 68 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 SER 0.012 0.012 15 0 "[ . 1 . 2]"
1 70 MET 0.878 0.443 15 0 "[ . 1 . 2]"
1 71 VAL 1.923 0.429 16 0 "[ . 1 . 2]"
1 72 PHE 1.863 0.429 16 0 "[ . 1 . 2]"
1 73 LYS 0.231 0.083 16 0 "[ . 1 . 2]"
1 74 GLN 5.301 0.841 17 5 "[ * .- 1 * + *2]"
1 75 MET 5.517 0.689 11 6 "[- .* **1+ * . 2]"
1 76 GLU 0.202 0.083 16 0 "[ . 1 . 2]"
1 77 GLN 12.229 0.960 15 8 "[* .* **1* * + -]"
1 78 VAL 5.062 0.642 6 7 "[* .+ **1* * . -]"
1 79 ALA 0.544 0.040 16 0 "[ . 1 . 2]"
1 80 GLN 0.465 0.042 16 0 "[ . 1 . 2]"
1 81 PHE 1.178 0.052 5 0 "[ . 1 . 2]"
1 82 LEU 1.649 0.052 5 0 "[ . 1 . 2]"
1 83 LYS 0.199 0.110 7 0 "[ . 1 . 2]"
1 84 ALA 0.319 0.037 7 0 "[ . 1 . 2]"
1 85 ALA 3.611 0.271 2 0 "[ . 1 . 2]"
1 86 GLU 1.983 0.319 7 0 "[ . 1 . 2]"
1 87 ASP 0.368 0.319 7 0 "[ . 1 . 2]"
1 88 TYR 4.181 0.271 2 0 "[ . 1 . 2]"
1 89 GLY 0.218 0.030 17 0 "[ . 1 . 2]"
1 90 VAL 5.223 0.715 9 6 "[* . * +1 - .* * 2]"
1 91 ILE 10.629 0.776 7 6 "[* . + *1 - .* * 2]"
1 92 LYS 7.979 0.774 18 7 "[ ** . 1** - + *]"
1 93 THR 5.373 0.563 20 3 "[ * . 1 - +]"
1 94 ASP 14.044 0.776 7 6 "[* . + *1 - .* * 2]"
1 95 MET 4.030 0.154 7 0 "[ . 1 . 2]"
1 96 PHE 6.044 0.587 16 3 "[ . * 1 .+ -]"
1 97 GLN 0.795 0.121 18 0 "[ . 1 . 2]"
1 98 THR 0.201 0.040 16 0 "[ . 1 . 2]"
1 99 VAL 0.051 0.026 20 0 "[ . 1 . 2]"
1 100 ASP 0.306 0.188 18 0 "[ . 1 . 2]"
1 101 LEU 5.745 0.587 16 3 "[ . * 1 .+ -]"
1 102 TYR 4.416 0.948 8 1 "[ . + 1 . 2]"
1 103 GLU 0.236 0.039 13 0 "[ . 1 . 2]"
1 104 GLY 0.085 0.017 13 0 "[ . 1 . 2]"
1 105 LYS 1.368 0.224 13 0 "[ . 1 . 2]"
1 106 ASP 0.750 0.289 8 0 "[ . 1 . 2]"
1 107 MET 3.853 0.529 15 2 "[ . - 1 + 2]"
1 108 ALA 0.094 0.023 3 0 "[ . 1 . 2]"
1 109 ALA 1.644 0.289 8 0 "[ . 1 . 2]"
1 110 VAL 0.598 0.026 19 0 "[ . 1 . 2]"
1 111 GLN 2.283 0.066 17 0 "[ . 1 . 2]"
1 112 ARG 8.256 0.581 17 7 "[ * * 1 .*+*-*]"
1 113 THR 9.102 0.585 18 7 "[ * * 1 .**+-*]"
1 114 LEU 0.389 0.038 3 0 "[ . 1 . 2]"
1 115 MET 0.463 0.038 3 0 "[ . 1 . 2]"
1 116 ALA 0.090 0.090 13 0 "[ . 1 . 2]"
1 117 LEU 1.280 0.066 11 0 "[ . 1 . 2]"
1 118 GLY 0.259 0.039 2 0 "[ . 1 . 2]"
1 119 SER 0.226 0.041 2 0 "[ . 1 . 2]"
1 120 LEU 1.552 0.130 1 0 "[ . 1 . 2]"
1 121 ALA 0.616 0.046 9 0 "[ . 1 . 2]"
1 122 VAL 0.527 0.131 18 0 "[ . 1 . 2]"
1 123 THR 0.280 0.042 6 0 "[ . 1 . 2]"
1 124 LYS 4.133 0.683 10 5 "[ . * *+ -. *2]"
1 125 ASN 0.342 0.143 5 0 "[ . 1 . 2]"
1 126 ASP 0.183 0.081 9 0 "[ . 1 . 2]"
1 127 GLY 1.794 0.727 9 2 "[ . +1- . 2]"
1 128 ASN 4.521 0.727 9 2 "[ . +1* . 2]"
1 129 TYR 1.262 0.235 2 0 "[ . 1 . 2]"
1 130 ARG 1.476 0.324 10 0 "[ . 1 . 2]"
1 131 GLY 2.772 0.444 6 0 "[ . 1 . 2]"
1 132 ASP 4.740 0.645 10 5 "[- .* + * . * 2]"
1 133 PRO 0.136 0.131 18 0 "[ . 1 . 2]"
1 134 ASN 1.551 0.240 10 0 "[ . 1 . 2]"
1 135 TRP 6.587 0.645 10 5 "[- .* + * . * 2]"
1 136 PHE 1.076 0.112 13 0 "[ . 1 . 2]"
1 137 MET 2.339 0.381 3 0 "[ . 1 . 2]"
1 138 LYS 1.162 0.313 9 0 "[ . 1 . 2]"
1 140 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 GLU H 1 8 GLU HB2 . . 3.510 2.660 2.225 3.497 . 0 0 "[ . 1 . 2]" 1
2 1 8 GLU H 1 8 GLU HB3 . . 4.070 3.702 3.499 4.084 0.014 17 0 "[ . 1 . 2]" 1
3 1 8 GLU H 1 8 GLU QG . . 3.470 2.806 2.175 3.419 . 0 0 "[ . 1 . 2]" 1
4 1 8 GLU HA 1 8 GLU HB3 . . 2.660 2.616 2.552 2.694 0.034 13 0 "[ . 1 . 2]" 1
5 1 8 GLU HA 1 8 GLU QG . . 2.890 2.218 2.099 2.380 . 0 0 "[ . 1 . 2]" 1
6 1 8 GLU HA 1 9 GLU H . . 3.050 2.466 2.317 2.749 . 0 0 "[ . 1 . 2]" 1
7 1 8 GLU HB3 1 8 GLU QG . . 2.620 2.422 2.179 2.571 . 0 0 "[ . 1 . 2]" 1
8 1 8 GLU HB3 1 9 GLU H . . 3.010 2.575 1.962 2.964 . 0 0 "[ . 1 . 2]" 1
9 1 8 GLU HB3 1 10 LEU H . . 3.470 2.998 2.426 3.279 . 0 0 "[ . 1 . 2]" 1
10 1 8 GLU HB3 1 11 GLU H . . 4.470 3.393 2.370 4.457 . 0 0 "[ . 1 . 2]" 1
11 1 8 GLU QG 1 9 GLU H . . 4.000 3.792 3.393 3.971 . 0 0 "[ . 1 . 2]" 1
12 1 9 GLU H 1 9 GLU QG . . 3.890 3.070 1.957 3.918 0.028 17 0 "[ . 1 . 2]" 1
13 1 9 GLU H 1 10 LEU H . . 3.590 2.791 2.323 3.137 . 0 0 "[ . 1 . 2]" 1
14 1 9 GLU HA 1 9 GLU QG . . 3.470 2.231 1.978 3.332 . 0 0 "[ . 1 . 2]" 1
15 1 10 LEU H 1 10 LEU HB2 . . 3.390 2.424 1.980 3.311 . 0 0 "[ . 1 . 2]" 1
16 1 10 LEU H 1 10 LEU HB3 . . 3.230 2.787 1.979 3.232 0.002 5 0 "[ . 1 . 2]" 1
17 1 10 LEU H 1 10 LEU QD . . 4.120 3.549 3.463 3.623 . 0 0 "[ . 1 . 2]" 1
18 1 10 LEU H 1 10 LEU HG . . 3.560 3.547 3.478 3.606 0.046 3 0 "[ . 1 . 2]" 1
19 1 10 LEU HA 1 10 LEU QD . . 3.050 2.552 2.213 2.938 . 0 0 "[ . 1 . 2]" 1
20 1 10 LEU HB3 1 11 GLU H . . 3.280 2.671 2.174 3.272 . 0 0 "[ . 1 . 2]" 1
21 1 10 LEU QD 1 11 GLU H . . 4.920 3.476 2.920 3.795 . 0 0 "[ . 1 . 2]" 1
22 1 10 LEU QD 1 14 LEU QB . . 3.810 3.490 3.055 3.671 . 0 0 "[ . 1 . 2]" 1
23 1 10 LEU QD 1 115 MET ME . . 3.090 1.938 1.666 2.530 . 0 0 "[ . 1 . 2]" 1
24 1 10 LEU QD 1 115 MET HG3 . . 3.670 2.351 1.928 3.256 . 0 0 "[ . 1 . 2]" 1
25 1 10 LEU HG 1 115 MET ME . . 3.890 3.192 2.089 3.888 . 0 0 "[ . 1 . 2]" 1
26 1 11 GLU H 1 11 GLU HB2 . . 3.190 2.066 2.033 2.193 . 0 0 "[ . 1 . 2]" 1
27 1 11 GLU H 1 11 GLU HB3 . . 3.390 3.193 3.024 3.476 0.086 4 0 "[ . 1 . 2]" 1
28 1 11 GLU H 1 11 GLU QG . . 3.610 3.454 2.680 3.632 0.022 12 0 "[ . 1 . 2]" 1
29 1 11 GLU H 1 111 GLN HE22 . . 4.980 3.565 2.365 4.664 . 0 0 "[ . 1 . 2]" 1
30 1 11 GLU HA 1 11 GLU QG . . 3.170 2.086 1.961 2.256 . 0 0 "[ . 1 . 2]" 1
31 1 11 GLU HA 1 14 LEU H . . 3.990 3.375 3.135 3.537 . 0 0 "[ . 1 . 2]" 1
32 1 11 GLU HA 1 14 LEU QB . . 3.610 2.251 2.011 2.442 . 0 0 "[ . 1 . 2]" 1
33 1 11 GLU HA 1 14 LEU QD . . 3.390 2.246 1.975 2.559 . 0 0 "[ . 1 . 2]" 1
34 1 11 GLU HA 1 14 LEU HG . . 4.800 4.009 3.136 4.850 0.050 3 0 "[ . 1 . 2]" 1
35 1 11 GLU HB2 1 12 GLU H . . 3.990 3.168 2.612 3.429 . 0 0 "[ . 1 . 2]" 1
36 1 11 GLU HB3 1 12 GLU H . . 3.700 2.578 2.215 3.146 . 0 0 "[ . 1 . 2]" 1
37 1 11 GLU QG 1 12 GLU H . . 4.270 4.253 4.111 4.316 0.046 4 0 "[ . 1 . 2]" 1
38 1 11 GLU QG 1 14 LEU QD . . 3.810 2.972 2.507 3.427 . 0 0 "[ . 1 . 2]" 1
39 1 11 GLU QG 1 111 GLN HE21 . . 4.480 2.764 1.897 4.472 . 0 0 "[ . 1 . 2]" 1
40 1 11 GLU QG 1 111 GLN HE22 . . 4.480 3.588 2.540 4.448 . 0 0 "[ . 1 . 2]" 1
41 1 12 GLU H 1 12 GLU HB2 . . 3.170 2.634 2.469 2.705 . 0 0 "[ . 1 . 2]" 1
42 1 12 GLU H 1 12 GLU HB3 . . 3.500 3.559 3.548 3.568 0.068 4 0 "[ . 1 . 2]" 1
43 1 12 GLU H 1 12 GLU HG2 . . 3.390 2.106 2.062 2.168 . 0 0 "[ . 1 . 2]" 1
44 1 12 GLU H 1 12 GLU HG3 . . 3.560 2.710 2.471 3.578 0.018 9 0 "[ . 1 . 2]" 1
45 1 12 GLU H 1 13 ARG H . . 3.710 3.043 2.957 3.219 . 0 0 "[ . 1 . 2]" 1
46 1 12 GLU HA 1 12 GLU HG2 . . 2.980 2.475 2.436 2.910 . 0 0 "[ . 1 . 2]" 1
47 1 12 GLU HA 1 12 GLU HG3 . . 3.610 3.669 3.639 3.690 0.080 2 0 "[ . 1 . 2]" 1
48 1 12 GLU HB2 1 12 GLU HG2 . . 3.040 2.850 2.492 2.924 . 0 0 "[ . 1 . 2]" 1
49 1 12 GLU HB2 1 12 GLU HG3 . . 2.630 2.278 2.264 2.463 . 0 0 "[ . 1 . 2]" 1
50 1 12 GLU HB2 1 13 ARG H . . 3.470 2.462 2.184 2.634 . 0 0 "[ . 1 . 2]" 1
51 1 12 GLU HB3 1 12 GLU HG2 . . 2.990 2.907 2.846 3.056 0.066 9 0 "[ . 1 . 2]" 1
52 1 12 GLU HB3 1 13 ARG H . . 3.660 3.566 3.088 3.691 0.031 4 0 "[ . 1 . 2]" 1
53 1 12 GLU HG2 1 13 ARG H . . 4.440 4.469 4.447 4.495 0.055 4 0 "[ . 1 . 2]" 1
54 1 13 ARG H 1 13 ARG HB2 . . 3.390 2.166 2.021 3.551 0.161 20 0 "[ . 1 . 2]" 1
55 1 13 ARG H 1 13 ARG HB3 . . 3.330 3.159 2.212 3.464 0.134 14 0 "[ . 1 . 2]" 1
56 1 13 ARG H 1 13 ARG HG3 . . 4.120 3.765 3.191 4.486 0.366 7 0 "[ . 1 . 2]" 1
57 1 13 ARG H 1 14 LEU H . . 3.600 2.786 2.723 2.851 . 0 0 "[ . 1 . 2]" 1
58 1 13 ARG H 1 14 LEU QB . . 4.590 4.451 4.291 4.503 . 0 0 "[ . 1 . 2]" 1
59 1 13 ARG HA 1 13 ARG HG2 . . 3.890 3.009 2.091 3.674 . 0 0 "[ . 1 . 2]" 1
60 1 13 ARG HA 1 13 ARG HG3 . . 3.810 2.481 1.986 3.809 . 0 0 "[ . 1 . 2]" 1
61 1 13 ARG HA 1 16 GLU H . . 3.890 3.389 3.201 3.879 . 0 0 "[ . 1 . 2]" 1
62 1 13 ARG HA 1 16 GLU HB2 . . 3.670 2.125 2.063 2.268 . 0 0 "[ . 1 . 2]" 1
63 1 13 ARG HA 1 16 GLU HB3 . . 3.610 3.660 3.637 3.681 0.071 19 0 "[ . 1 . 2]" 1
64 1 13 ARG HA 1 16 GLU QG . . 3.730 2.905 2.350 3.651 . 0 0 "[ . 1 . 2]" 1
65 1 13 ARG HB2 1 13 ARG HD2 . . 3.730 2.709 1.975 3.817 0.087 20 0 "[ . 1 . 2]" 1
66 1 13 ARG HB2 1 14 LEU H . . 3.890 3.005 2.568 3.875 . 0 0 "[ . 1 . 2]" 1
67 1 13 ARG HB3 1 14 LEU H . . 3.890 2.721 2.304 3.945 0.055 20 0 "[ . 1 . 2]" 1
68 1 14 LEU H 1 14 LEU QB . . 3.510 2.254 2.101 2.361 . 0 0 "[ . 1 . 2]" 1
69 1 14 LEU H 1 14 LEU QD . . 3.430 2.781 1.921 3.194 . 0 0 "[ . 1 . 2]" 1
70 1 14 LEU H 1 14 LEU HG . . 5.230 2.999 2.298 4.166 . 0 0 "[ . 1 . 2]" 1
71 1 14 LEU H 1 15 VAL H . . 3.670 3.060 2.969 3.096 . 0 0 "[ . 1 . 2]" 1
72 1 14 LEU H 1 15 VAL HA . . 5.500 5.511 5.457 5.536 0.036 19 0 "[ . 1 . 2]" 1
73 1 14 LEU H 1 16 GLU H . . 4.690 4.444 4.274 4.696 0.006 15 0 "[ . 1 . 2]" 1
74 1 14 LEU HA 1 14 LEU QD . . 2.860 1.958 1.884 2.026 . 0 0 "[ . 1 . 2]" 1
75 1 14 LEU HA 1 17 TRP H . . 4.270 3.681 3.539 3.867 . 0 0 "[ . 1 . 2]" 1
76 1 14 LEU HA 1 17 TRP HB3 . . 3.670 2.967 2.787 3.196 . 0 0 "[ . 1 . 2]" 1
77 1 14 LEU HA 1 18 ILE H . . 4.920 4.171 3.974 4.484 . 0 0 "[ . 1 . 2]" 1
78 1 14 LEU QB 1 14 LEU QD . . 2.880 1.959 1.935 1.989 . 0 0 "[ . 1 . 2]" 1
79 1 14 LEU QB 1 15 VAL H . . 3.990 2.488 2.354 2.664 . 0 0 "[ . 1 . 2]" 1
80 1 14 LEU QB 1 36 PHE QE . . 3.820 3.127 2.769 3.388 . 0 0 "[ . 1 . 2]" 1
81 1 14 LEU QB 1 36 PHE HZ . . 3.460 2.879 2.498 3.168 . 0 0 "[ . 1 . 2]" 1
82 1 14 LEU QD 1 17 TRP H . . 4.920 4.843 4.805 4.877 . 0 0 "[ . 1 . 2]" 1
83 1 14 LEU QD 1 17 TRP HE3 . . 3.390 2.796 2.192 3.365 . 0 0 "[ . 1 . 2]" 1
84 1 14 LEU QD 1 36 PHE QE . . 3.890 3.252 2.816 3.501 . 0 0 "[ . 1 . 2]" 1
85 1 14 LEU QD 1 36 PHE HZ . . 3.510 2.524 2.051 2.742 . 0 0 "[ . 1 . 2]" 1
86 1 14 LEU QD 1 111 GLN HA . . 3.050 2.673 2.287 2.964 . 0 0 "[ . 1 . 2]" 1
87 1 14 LEU QD 1 111 GLN HB3 . . 3.810 2.855 2.200 3.197 . 0 0 "[ . 1 . 2]" 1
88 1 14 LEU QD 1 111 GLN HG2 . . 3.470 2.124 1.887 2.670 . 0 0 "[ . 1 . 2]" 1
89 1 14 LEU QD 1 111 GLN HG3 . . 3.890 3.348 3.045 3.830 . 0 0 "[ . 1 . 2]" 1
90 1 14 LEU QD 1 114 LEU H . . 4.870 3.971 3.863 4.092 . 0 0 "[ . 1 . 2]" 1
91 1 14 LEU QD 1 114 LEU HB3 . . 3.220 2.202 1.931 2.962 . 0 0 "[ . 1 . 2]" 1
92 1 14 LEU QD 1 115 MET H . . 4.120 3.202 2.943 3.369 . 0 0 "[ . 1 . 2]" 1
93 1 14 LEU QD 1 115 MET HA . . 3.810 3.100 2.704 3.363 . 0 0 "[ . 1 . 2]" 1
94 1 14 LEU QD 1 115 MET HG2 . . 3.730 2.927 2.319 3.255 . 0 0 "[ . 1 . 2]" 1
95 1 14 LEU QD 1 115 MET HG3 . . 4.120 3.604 2.858 3.845 . 0 0 "[ . 1 . 2]" 1
96 1 14 LEU QD 1 136 PHE QD . . 3.730 3.699 3.659 3.842 0.112 13 0 "[ . 1 . 2]" 1
97 1 14 LEU QD 1 136 PHE QE . . 3.300 1.959 1.836 2.082 . 0 0 "[ . 1 . 2]" 1
98 1 14 LEU QD 1 136 PHE HZ . . 3.530 2.213 1.812 2.978 . 0 0 "[ . 1 . 2]" 1
99 1 15 VAL H 1 15 VAL HB . . 3.240 2.440 2.331 2.524 . 0 0 "[ . 1 . 2]" 1
100 1 15 VAL H 1 15 VAL MG1 . . 3.810 3.700 3.690 3.705 . 0 0 "[ . 1 . 2]" 1
101 1 15 VAL H 1 15 VAL MG2 . . 2.940 2.028 1.908 2.316 . 0 0 "[ . 1 . 2]" 1
102 1 15 VAL H 1 16 GLU H . . 3.670 2.789 2.706 2.858 . 0 0 "[ . 1 . 2]" 1
103 1 15 VAL H 1 36 PHE QE . . 4.160 3.911 3.623 4.104 . 0 0 "[ . 1 . 2]" 1
104 1 15 VAL HA 1 15 VAL MG1 . . 3.090 2.414 2.324 2.498 . 0 0 "[ . 1 . 2]" 1
105 1 15 VAL HA 1 15 VAL MG2 . . 2.900 2.363 2.251 2.474 . 0 0 "[ . 1 . 2]" 1
106 1 15 VAL HA 1 18 ILE H . . 4.120 3.227 3.019 3.445 . 0 0 "[ . 1 . 2]" 1
107 1 15 VAL HA 1 18 ILE HB . . 3.150 2.436 2.280 2.575 . 0 0 "[ . 1 . 2]" 1
108 1 15 VAL HA 1 18 ILE MD . . 3.470 2.143 1.981 2.589 . 0 0 "[ . 1 . 2]" 1
109 1 15 VAL HA 1 18 ILE MG . . 3.890 3.885 3.776 3.947 0.057 13 0 "[ . 1 . 2]" 1
110 1 15 VAL HA 1 19 VAL H . . 4.480 3.970 3.782 4.129 . 0 0 "[ . 1 . 2]" 1
111 1 15 VAL HA 1 39 TRP HH2 . . 3.460 2.833 2.442 3.216 . 0 0 "[ . 1 . 2]" 1
112 1 15 VAL HA 1 39 TRP HZ3 . . 3.470 2.139 1.994 2.573 . 0 0 "[ . 1 . 2]" 1
113 1 15 VAL HB 1 16 GLU H . . 3.390 2.384 2.183 2.504 . 0 0 "[ . 1 . 2]" 1
114 1 15 VAL HB 1 17 TRP H . . 4.590 4.672 4.623 4.705 0.115 17 0 "[ . 1 . 2]" 1
115 1 15 VAL MG1 1 16 GLU H . . 3.730 3.320 2.955 3.541 . 0 0 "[ . 1 . 2]" 1
116 1 15 VAL MG1 1 16 GLU HA . . 3.890 3.497 3.278 3.731 . 0 0 "[ . 1 . 2]" 1
117 1 15 VAL MG1 1 19 VAL MG2 . . 3.110 2.063 1.893 2.374 . 0 0 "[ . 1 . 2]" 1
118 1 15 VAL MG1 1 28 ARG HA . . 3.810 3.075 2.664 3.286 . 0 0 "[ . 1 . 2]" 1
119 1 15 VAL MG1 1 28 ARG QD . . 3.990 2.262 1.713 2.990 . 0 0 "[ . 1 . 2]" 1
120 1 15 VAL MG1 1 28 ARG HG2 . . 3.560 2.352 1.875 4.105 0.545 19 2 "[ . 1 . +-]" 1
121 1 15 VAL MG1 1 28 ARG HG3 . . 3.810 3.120 2.805 3.482 . 0 0 "[ . 1 . 2]" 1
122 1 15 VAL MG1 1 29 PRO QD . . 3.330 1.826 1.680 1.924 . 0 0 "[ . 1 . 2]" 1
123 1 15 VAL MG1 1 39 TRP HH2 . . 3.400 2.397 2.083 2.597 . 0 0 "[ . 1 . 2]" 1
124 1 15 VAL MG2 1 16 GLU H . . 3.890 3.760 3.596 3.837 . 0 0 "[ . 1 . 2]" 1
125 1 15 VAL MG2 1 29 PRO QD . . 3.730 2.936 2.476 3.153 . 0 0 "[ . 1 . 2]" 1
126 1 15 VAL MG2 1 29 PRO HG2 . . 3.390 2.605 1.990 3.119 . 0 0 "[ . 1 . 2]" 1
127 1 15 VAL MG2 1 29 PRO HG3 . . 3.390 2.046 1.803 2.221 . 0 0 "[ . 1 . 2]" 1
128 1 15 VAL MG2 1 36 PHE QD . . 2.920 2.417 2.197 2.793 . 0 0 "[ . 1 . 2]" 1
129 1 15 VAL MG2 1 36 PHE QE . . 2.830 2.096 1.879 2.348 . 0 0 "[ . 1 . 2]" 1
130 1 15 VAL MG2 1 39 TRP HZ3 . . 3.430 2.224 1.980 2.677 . 0 0 "[ . 1 . 2]" 1
131 1 16 GLU H 1 16 GLU HB2 . . 3.330 2.403 2.347 2.456 . 0 0 "[ . 1 . 2]" 1
132 1 16 GLU H 1 16 GLU HB3 . . 3.640 3.548 3.537 3.562 . 0 0 "[ . 1 . 2]" 1
133 1 16 GLU H 1 16 GLU QG . . 3.170 2.398 2.290 2.510 . 0 0 "[ . 1 . 2]" 1
134 1 16 GLU H 1 17 TRP H . . 3.800 2.864 2.773 2.953 . 0 0 "[ . 1 . 2]" 1
135 1 16 GLU HA 1 16 GLU HB3 . . 3.010 2.614 2.590 2.648 . 0 0 "[ . 1 . 2]" 1
136 1 16 GLU HA 1 16 GLU QG . . 3.240 2.216 2.098 2.353 . 0 0 "[ . 1 . 2]" 1
137 1 16 GLU HA 1 19 VAL H . . 4.340 3.671 3.563 3.827 . 0 0 "[ . 1 . 2]" 1
138 1 16 GLU HA 1 19 VAL HB . . 3.240 2.657 2.501 2.760 . 0 0 "[ . 1 . 2]" 1
139 1 16 GLU HA 1 19 VAL MG1 . . 3.810 3.693 3.482 3.797 . 0 0 "[ . 1 . 2]" 1
140 1 16 GLU HA 1 19 VAL MG2 . . 3.390 2.640 2.374 2.896 . 0 0 "[ . 1 . 2]" 1
141 1 16 GLU HA 1 20 VAL H . . 4.480 4.527 4.493 4.570 0.090 14 0 "[ . 1 . 2]" 1
142 1 16 GLU HB2 1 17 TRP H . . 3.890 3.057 2.943 3.129 . 0 0 "[ . 1 . 2]" 1
143 1 16 GLU HB3 1 17 TRP H . . 3.890 3.832 3.687 3.915 0.025 16 0 "[ . 1 . 2]" 1
144 1 16 GLU QG 1 17 TRP H . . 4.270 4.339 4.306 4.391 0.121 11 0 "[ . 1 . 2]" 1
145 1 17 TRP H 1 17 TRP HB2 . . 3.560 2.726 2.603 2.886 . 0 0 "[ . 1 . 2]" 1
146 1 17 TRP H 1 17 TRP HB3 . . 3.610 2.330 2.192 2.383 . 0 0 "[ . 1 . 2]" 1
147 1 17 TRP H 1 17 TRP HE3 . . 5.040 4.610 4.350 4.710 . 0 0 "[ . 1 . 2]" 1
148 1 17 TRP H 1 18 ILE H . . 3.910 2.588 2.460 2.788 . 0 0 "[ . 1 . 2]" 1
149 1 17 TRP H 1 135 TRP HZ3 . . 4.870 4.654 4.320 4.871 0.001 13 0 "[ . 1 . 2]" 1
150 1 17 TRP HA 1 17 TRP HD1 . . 3.110 2.444 2.350 2.676 . 0 0 "[ . 1 . 2]" 1
151 1 17 TRP HA 1 17 TRP HE1 . . 5.190 5.008 4.931 5.221 0.031 13 0 "[ . 1 . 2]" 1
152 1 17 TRP HA 1 20 VAL H . . 4.470 3.231 3.137 3.335 . 0 0 "[ . 1 . 2]" 1
153 1 17 TRP HA 1 20 VAL MG1 . . 3.240 2.509 2.201 2.618 . 0 0 "[ . 1 . 2]" 1
154 1 17 TRP HA 1 20 VAL MG2 . . 3.300 2.475 2.320 2.721 . 0 0 "[ . 1 . 2]" 1
155 1 17 TRP HA 1 135 TRP HE3 . . 3.820 3.584 3.346 3.839 0.019 13 0 "[ . 1 . 2]" 1
156 1 17 TRP HA 1 135 TRP HH2 . . 3.820 3.711 3.221 3.855 0.035 15 0 "[ . 1 . 2]" 1
157 1 17 TRP HA 1 135 TRP HZ3 . . 3.460 2.094 1.979 2.390 . 0 0 "[ . 1 . 2]" 1
158 1 17 TRP HB2 1 17 TRP HE3 . . 3.890 3.444 3.351 3.557 . 0 0 "[ . 1 . 2]" 1
159 1 17 TRP HB2 1 18 ILE H . . 4.120 3.784 3.706 3.866 . 0 0 "[ . 1 . 2]" 1
160 1 17 TRP HB3 1 17 TRP HE3 . . 3.610 2.424 2.369 2.476 . 0 0 "[ . 1 . 2]" 1
161 1 17 TRP HB3 1 18 ILE H . . 3.730 2.328 2.205 2.471 . 0 0 "[ . 1 . 2]" 1
162 1 17 TRP HD1 1 20 VAL MG1 . . 3.670 3.660 3.457 3.709 0.039 19 0 "[ . 1 . 2]" 1
163 1 17 TRP HD1 1 20 VAL MG2 . . 3.350 2.083 1.946 2.251 . 0 0 "[ . 1 . 2]" 1
164 1 17 TRP HE1 1 20 VAL MG2 . . 4.480 3.609 3.487 3.805 . 0 0 "[ . 1 . 2]" 1
165 1 17 TRP HE1 1 21 GLN HB2 . . 4.620 4.531 3.558 4.706 0.086 14 0 "[ . 1 . 2]" 1
166 1 17 TRP HE1 1 21 GLN HB3 . . 5.110 4.744 4.575 5.114 0.004 15 0 "[ . 1 . 2]" 1
167 1 17 TRP HE1 1 21 GLN HG2 . . 4.180 2.384 2.005 2.577 . 0 0 "[ . 1 . 2]" 1
168 1 17 TRP HE1 1 21 GLN HG3 . . 4.090 2.737 2.536 3.884 . 0 0 "[ . 1 . 2]" 1
169 1 17 TRP HE1 1 49 LEU MD1 . . 4.270 3.986 3.511 4.289 0.019 15 0 "[ . 1 . 2]" 1
170 1 17 TRP HE1 1 53 LEU MD1 . . 5.270 4.952 3.797 5.273 0.003 3 0 "[ . 1 . 2]" 1
171 1 17 TRP HE1 1 53 LEU MD2 . . 4.120 3.360 2.356 3.805 . 0 0 "[ . 1 . 2]" 1
172 1 17 TRP HE1 1 129 TYR QD . . 3.820 3.197 2.146 3.727 . 0 0 "[ . 1 . 2]" 1
173 1 17 TRP HE1 1 129 TYR QE . . 4.300 3.486 2.388 4.352 0.052 6 0 "[ . 1 . 2]" 1
174 1 17 TRP HE1 1 130 ARG H . . 4.620 3.304 2.485 4.300 . 0 0 "[ . 1 . 2]" 1
175 1 17 TRP HE3 1 18 ILE H . . 4.980 3.908 3.440 4.235 . 0 0 "[ . 1 . 2]" 1
176 1 17 TRP HH2 1 53 LEU MD1 . . 3.400 3.094 2.711 3.402 0.002 3 0 "[ . 1 . 2]" 1
177 1 17 TRP HH2 1 117 LEU HB3 . . 3.700 2.929 2.023 3.372 . 0 0 "[ . 1 . 2]" 1
178 1 17 TRP HH2 1 117 LEU MD2 . . 3.140 2.856 2.341 3.143 0.003 4 0 "[ . 1 . 2]" 1
179 1 17 TRP HH2 1 117 LEU HG . . 3.110 2.528 2.002 2.835 . 0 0 "[ . 1 . 2]" 1
180 1 17 TRP HH2 1 118 GLY H . . 4.160 3.286 2.876 3.727 . 0 0 "[ . 1 . 2]" 1
181 1 17 TRP HH2 1 118 GLY HA2 . . 3.990 2.605 2.207 3.321 . 0 0 "[ . 1 . 2]" 1
182 1 17 TRP HH2 1 121 ALA MB . . 4.120 3.603 3.131 4.123 0.003 7 0 "[ . 1 . 2]" 1
183 1 17 TRP HZ2 1 53 LEU MD1 . . 3.400 2.836 1.955 3.254 . 0 0 "[ . 1 . 2]" 1
184 1 17 TRP HZ2 1 53 LEU MD2 . . 3.110 2.265 1.951 2.700 . 0 0 "[ . 1 . 2]" 1
185 1 17 TRP HZ2 1 121 ALA MB . . 3.210 2.914 2.264 3.234 0.024 9 0 "[ . 1 . 2]" 1
186 1 17 TRP HZ3 1 49 LEU MD2 . . 3.510 3.175 2.530 3.515 0.005 11 0 "[ . 1 . 2]" 1
187 1 17 TRP HZ3 1 117 LEU MD2 . . 3.610 3.548 3.200 3.624 0.014 19 0 "[ . 1 . 2]" 1
188 1 17 TRP HZ3 1 118 GLY H . . 4.410 2.982 2.585 3.431 . 0 0 "[ . 1 . 2]" 1
189 1 18 ILE H 1 18 ILE HB . . 3.300 2.424 2.351 2.504 . 0 0 "[ . 1 . 2]" 1
190 1 18 ILE H 1 18 ILE MD . . 3.560 2.813 2.574 3.059 . 0 0 "[ . 1 . 2]" 1
191 1 18 ILE H 1 18 ILE HG12 . . 3.630 3.629 3.545 3.656 0.026 17 0 "[ . 1 . 2]" 1
192 1 18 ILE H 1 18 ILE HG13 . . 3.510 2.168 2.039 2.227 . 0 0 "[ . 1 . 2]" 1
193 1 18 ILE H 1 18 ILE MG . . 3.730 3.706 3.691 3.717 . 0 0 "[ . 1 . 2]" 1
194 1 18 ILE H 1 19 VAL H . . 4.040 2.804 2.720 2.878 . 0 0 "[ . 1 . 2]" 1
195 1 18 ILE H 1 19 VAL MG2 . . 4.730 4.282 3.996 4.489 . 0 0 "[ . 1 . 2]" 1
196 1 18 ILE H 1 39 TRP HH2 . . 4.450 4.256 4.040 4.453 0.003 15 0 "[ . 1 . 2]" 1
197 1 18 ILE H 1 49 LEU MD1 . . 4.870 3.746 3.467 4.187 . 0 0 "[ . 1 . 2]" 1
198 1 18 ILE HA 1 18 ILE MD . . 3.810 3.800 3.763 3.827 0.017 1 0 "[ . 1 . 2]" 1
199 1 18 ILE HA 1 18 ILE HG12 . . 3.730 2.904 2.737 3.040 . 0 0 "[ . 1 . 2]" 1
200 1 18 ILE HA 1 18 ILE HG13 . . 3.300 2.490 2.421 2.581 . 0 0 "[ . 1 . 2]" 1
201 1 18 ILE HA 1 18 ILE MG . . 2.900 2.465 2.399 2.536 . 0 0 "[ . 1 . 2]" 1
202 1 18 ILE HA 1 21 GLN H . . 4.270 3.347 3.256 3.430 . 0 0 "[ . 1 . 2]" 1
203 1 18 ILE HA 1 21 GLN HB2 . . 3.810 2.100 1.989 2.364 . 0 0 "[ . 1 . 2]" 1
204 1 18 ILE HA 1 49 LEU MD1 . . 3.170 2.066 1.914 2.475 . 0 0 "[ . 1 . 2]" 1
205 1 18 ILE HB 1 18 ILE MD . . 3.110 2.012 1.930 2.181 . 0 0 "[ . 1 . 2]" 1
206 1 18 ILE HB 1 19 VAL H . . 3.810 3.140 3.042 3.264 . 0 0 "[ . 1 . 2]" 1
207 1 18 ILE HB 1 39 TRP HH2 . . 3.300 2.143 1.995 2.406 . 0 0 "[ . 1 . 2]" 1
208 1 18 ILE MD 1 18 ILE MG . . 2.950 2.554 2.229 2.748 . 0 0 "[ . 1 . 2]" 1
209 1 18 ILE MD 1 39 TRP HH2 . . 3.470 3.241 2.983 3.475 0.005 10 0 "[ . 1 . 2]" 1
210 1 18 ILE MD 1 39 TRP HZ3 . . 3.300 2.076 1.936 2.238 . 0 0 "[ . 1 . 2]" 1
211 1 18 ILE MD 1 40 LEU MD2 . . 2.910 2.419 2.019 2.762 . 0 0 "[ . 1 . 2]" 1
212 1 18 ILE HG12 1 40 LEU MD2 . . 3.670 3.651 3.564 3.698 0.028 17 0 "[ . 1 . 2]" 1
213 1 18 ILE HG12 1 49 LEU MD1 . . 3.890 2.387 1.972 2.973 . 0 0 "[ . 1 . 2]" 1
214 1 18 ILE HG13 1 49 LEU MD1 . . 3.810 2.445 2.016 3.083 . 0 0 "[ . 1 . 2]" 1
215 1 18 ILE MG 1 19 VAL H . . 3.890 3.746 3.656 3.827 . 0 0 "[ . 1 . 2]" 1
216 1 18 ILE MG 1 22 CYS H . . 4.270 3.194 2.985 3.482 . 0 0 "[ . 1 . 2]" 1
217 1 18 ILE MG 1 22 CYS HG . . 3.510 2.784 2.278 3.457 . 0 0 "[ . 1 . 2]" 1
218 1 18 ILE MG 1 39 TRP HH2 . . 3.210 2.255 2.030 2.492 . 0 0 "[ . 1 . 2]" 1
219 1 18 ILE MG 1 39 TRP HZ2 . . 3.700 3.128 2.738 3.421 . 0 0 "[ . 1 . 2]" 1
220 1 18 ILE MG 1 39 TRP HZ3 . . 3.890 3.155 2.835 3.459 . 0 0 "[ . 1 . 2]" 1
221 1 18 ILE MG 1 40 LEU MD2 . . 3.080 2.798 2.504 3.020 . 0 0 "[ . 1 . 2]" 1
222 1 19 VAL H 1 19 VAL HB . . 3.190 2.233 2.182 2.317 . 0 0 "[ . 1 . 2]" 1
223 1 19 VAL H 1 19 VAL MG1 . . 3.870 3.654 3.627 3.693 . 0 0 "[ . 1 . 2]" 1
224 1 19 VAL H 1 19 VAL MG2 . . 2.900 2.369 2.276 2.428 . 0 0 "[ . 1 . 2]" 1
225 1 19 VAL H 1 20 VAL H . . 3.700 2.660 2.530 2.761 . 0 0 "[ . 1 . 2]" 1
226 1 19 VAL H 1 39 TRP HH2 . . 4.980 3.627 3.045 3.926 . 0 0 "[ . 1 . 2]" 1
227 1 19 VAL HA 1 19 VAL MG1 . . 2.980 2.523 2.470 2.595 . 0 0 "[ . 1 . 2]" 1
228 1 19 VAL HA 1 19 VAL MG2 . . 2.590 2.305 2.211 2.398 . 0 0 "[ . 1 . 2]" 1
229 1 19 VAL HA 1 21 GLN H . . 5.190 4.516 4.382 4.835 . 0 0 "[ . 1 . 2]" 1
230 1 19 VAL HA 1 22 CYS H . . 4.120 4.127 3.950 4.161 0.041 6 0 "[ . 1 . 2]" 1
231 1 19 VAL HA 1 23 GLY H . . 3.980 3.022 2.854 3.249 . 0 0 "[ . 1 . 2]" 1
232 1 19 VAL HB 1 20 VAL H . . 3.610 2.507 2.476 2.599 . 0 0 "[ . 1 . 2]" 1
233 1 19 VAL MG1 1 20 VAL H . . 3.810 3.012 2.784 3.307 . 0 0 "[ . 1 . 2]" 1
234 1 19 VAL MG1 1 20 VAL HA . . 3.730 3.215 3.009 3.421 . 0 0 "[ . 1 . 2]" 1
235 1 19 VAL MG1 1 23 GLY H . . 4.730 3.960 3.818 4.042 . 0 0 "[ . 1 . 2]" 1
236 1 19 VAL MG2 1 20 VAL H . . 3.900 3.951 3.880 4.005 0.105 7 0 "[ . 1 . 2]" 1
237 1 19 VAL MG2 1 39 TRP HH2 . . 3.350 2.631 2.290 2.953 . 0 0 "[ . 1 . 2]" 1
238 1 19 VAL MG2 1 39 TRP HZ2 . . 3.560 3.323 2.861 3.564 0.004 4 0 "[ . 1 . 2]" 1
239 1 20 VAL H 1 20 VAL HB . . 3.490 3.489 3.479 3.498 0.008 3 0 "[ . 1 . 2]" 1
240 1 20 VAL H 1 20 VAL MG1 . . 3.150 1.867 1.833 1.904 . 0 0 "[ . 1 . 2]" 1
241 1 20 VAL H 1 20 VAL MG2 . . 3.150 2.518 2.484 2.582 . 0 0 "[ . 1 . 2]" 1
242 1 20 VAL H 1 21 GLN H . . 3.520 2.580 2.516 2.714 . 0 0 "[ . 1 . 2]" 1
243 1 20 VAL HA 1 20 VAL HB . . 2.900 2.295 2.285 2.307 . 0 0 "[ . 1 . 2]" 1
244 1 20 VAL HA 1 20 VAL MG1 . . 2.950 2.551 2.530 2.572 . 0 0 "[ . 1 . 2]" 1
245 1 20 VAL HA 1 23 GLY H . . 4.200 4.107 3.865 4.223 0.023 14 0 "[ . 1 . 2]" 1
246 1 20 VAL HB 1 21 GLN H . . 4.120 4.070 3.895 4.134 0.014 15 0 "[ . 1 . 2]" 1
247 1 20 VAL HB 1 135 TRP HH2 . . 3.700 3.669 3.266 3.752 0.052 14 0 "[ . 1 . 2]" 1
248 1 20 VAL MG1 1 21 GLN H . . 3.560 3.568 3.470 3.609 0.049 15 0 "[ . 1 . 2]" 1
249 1 20 VAL MG1 1 131 GLY HA2 . . 3.810 3.401 3.171 3.752 . 0 0 "[ . 1 . 2]" 1
250 1 20 VAL MG1 1 131 GLY HA3 . . 3.430 3.553 3.256 3.874 0.444 6 0 "[ . 1 . 2]" 1
251 1 20 VAL MG1 1 135 TRP HH2 . . 3.270 1.835 1.754 1.958 . 0 0 "[ . 1 . 2]" 1
252 1 20 VAL MG2 1 21 GLN H . . 3.470 2.077 1.849 2.206 . 0 0 "[ . 1 . 2]" 1
253 1 20 VAL MG2 1 21 GLN HE21 . . 3.360 3.220 1.945 3.481 0.121 10 0 "[ . 1 . 2]" 1
254 1 20 VAL MG2 1 130 ARG HB3 . . 3.610 2.825 1.969 3.553 . 0 0 "[ . 1 . 2]" 1
255 1 20 VAL MG2 1 131 GLY H . . 4.480 2.349 1.858 3.320 . 0 0 "[ . 1 . 2]" 1
256 1 20 VAL MG2 1 131 GLY HA2 . . 3.730 2.459 1.959 2.899 . 0 0 "[ . 1 . 2]" 1
257 1 20 VAL MG2 1 131 GLY HA3 . . 2.690 2.201 1.975 2.451 . 0 0 "[ . 1 . 2]" 1
258 1 20 VAL MG2 1 135 TRP HH2 . . 3.270 2.824 2.506 3.002 . 0 0 "[ . 1 . 2]" 1
259 1 20 VAL MG2 1 135 TRP HZ3 . . 3.700 2.254 1.981 2.562 . 0 0 "[ . 1 . 2]" 1
260 1 21 GLN H 1 21 GLN HB2 . . 3.730 2.234 2.019 2.441 . 0 0 "[ . 1 . 2]" 1
261 1 21 GLN H 1 21 GLN HB3 . . 4.020 3.467 3.219 3.545 . 0 0 "[ . 1 . 2]" 1
262 1 21 GLN H 1 21 GLN HG2 . . 4.270 2.817 2.304 4.170 . 0 0 "[ . 1 . 2]" 1
263 1 21 GLN H 1 21 GLN HG3 . . 3.970 3.518 3.020 4.408 0.438 13 0 "[ . 1 . 2]" 1
264 1 21 GLN H 1 22 CYS H . . 3.800 3.006 2.844 3.104 . 0 0 "[ . 1 . 2]" 1
265 1 21 GLN H 1 49 LEU MD1 . . 4.480 3.927 3.789 4.045 . 0 0 "[ . 1 . 2]" 1
266 1 21 GLN HA 1 21 GLN HE21 . . 3.890 2.033 1.914 3.027 . 0 0 "[ . 1 . 2]" 1
267 1 21 GLN HA 1 21 GLN HG2 . . 3.670 2.538 2.364 3.531 . 0 0 "[ . 1 . 2]" 1
268 1 21 GLN HA 1 21 GLN HG3 . . 3.810 3.528 2.667 3.680 . 0 0 "[ . 1 . 2]" 1
269 1 21 GLN HA 1 130 ARG H . . 5.110 4.008 3.319 5.056 . 0 0 "[ . 1 . 2]" 1
270 1 21 GLN HA 1 130 ARG HB2 . . 3.390 2.922 2.227 3.406 0.016 6 0 "[ . 1 . 2]" 1
271 1 21 GLN HA 1 130 ARG HG2 . . 3.990 3.891 2.981 4.010 0.020 13 0 "[ . 1 . 2]" 1
272 1 21 GLN HA 1 130 ARG HG3 . . 3.990 3.190 2.335 4.118 0.128 10 0 "[ . 1 . 2]" 1
273 1 21 GLN HB2 1 21 GLN HE21 . . 3.990 3.847 1.970 4.113 0.123 18 0 "[ . 1 . 2]" 1
274 1 21 GLN HB2 1 22 CYS H . . 3.980 2.356 2.108 2.912 . 0 0 "[ . 1 . 2]" 1
275 1 21 GLN HB2 1 49 LEU MD1 . . 3.430 2.192 1.992 2.399 . 0 0 "[ . 1 . 2]" 1
276 1 21 GLN HB3 1 21 GLN HE21 . . 4.120 3.333 2.793 3.860 . 0 0 "[ . 1 . 2]" 1
277 1 21 GLN HB3 1 21 GLN HE22 . . 4.270 3.998 3.573 4.846 0.576 7 2 "[ . + 1 - . 2]" 1
278 1 21 GLN HB3 1 22 CYS H . . 4.340 2.777 2.216 3.006 . 0 0 "[ . 1 . 2]" 1
279 1 21 GLN HB3 1 49 LEU MD1 . . 3.090 2.011 1.780 2.301 . 0 0 "[ . 1 . 2]" 1
280 1 21 GLN HE21 1 53 LEU MD2 . . 3.810 3.578 3.237 3.810 . 0 0 "[ . 1 . 2]" 1
281 1 21 GLN HE21 1 130 ARG H . . 5.110 2.732 2.056 4.227 . 0 0 "[ . 1 . 2]" 1
282 1 21 GLN HE22 1 53 LEU MD2 . . 3.610 2.391 1.910 3.728 0.118 13 0 "[ . 1 . 2]" 1
283 1 21 GLN HE22 1 130 ARG H . . 4.280 3.099 2.379 4.280 0.000 3 0 "[ . 1 . 2]" 1
284 1 21 GLN HG2 1 49 LEU MD1 . . 3.330 3.175 1.965 3.340 0.010 15 0 "[ . 1 . 2]" 1
285 1 21 GLN HG3 1 49 LEU MD1 . . 3.300 2.096 1.949 3.077 . 0 0 "[ . 1 . 2]" 1
286 1 22 CYS H 1 22 CYS HB2 . . 3.550 2.363 2.183 2.578 . 0 0 "[ . 1 . 2]" 1
287 1 22 CYS H 1 22 CYS HB3 . . 3.890 3.537 3.470 3.567 . 0 0 "[ . 1 . 2]" 1
288 1 22 CYS H 1 22 CYS HG . . 3.710 2.344 2.006 2.836 . 0 0 "[ . 1 . 2]" 1
289 1 22 CYS H 1 23 GLY H . . 3.390 2.712 2.639 2.827 . 0 0 "[ . 1 . 2]" 1
290 1 22 CYS H 1 26 VAL MG1 . . 4.980 4.914 4.759 4.983 0.003 8 0 "[ . 1 . 2]" 1
291 1 22 CYS H 1 26 VAL MG2 . . 4.440 4.144 3.918 4.262 . 0 0 "[ . 1 . 2]" 1
292 1 22 CYS H 1 49 LEU MD1 . . 4.120 3.221 2.904 3.463 . 0 0 "[ . 1 . 2]" 1
293 1 22 CYS HA 1 22 CYS HG . . 3.730 2.702 2.277 3.137 . 0 0 "[ . 1 . 2]" 1
294 1 22 CYS HB2 1 23 GLY H . . 4.120 2.523 2.402 2.673 . 0 0 "[ . 1 . 2]" 1
295 1 22 CYS HB2 1 26 VAL MG1 . . 3.390 3.038 2.830 3.199 . 0 0 "[ . 1 . 2]" 1
296 1 22 CYS HB2 1 26 VAL MG2 . . 3.510 2.134 1.972 2.487 . 0 0 "[ . 1 . 2]" 1
297 1 22 CYS HB3 1 23 GLY H . . 4.410 3.399 3.141 3.640 . 0 0 "[ . 1 . 2]" 1
298 1 22 CYS HB3 1 26 VAL MG1 . . 3.150 2.154 1.892 2.448 . 0 0 "[ . 1 . 2]" 1
299 1 22 CYS HB3 1 26 VAL MG2 . . 3.560 2.464 2.013 3.053 . 0 0 "[ . 1 . 2]" 1
300 1 22 CYS HG 1 23 GLY H . . 4.820 4.532 4.304 4.787 . 0 0 "[ . 1 . 2]" 1
301 1 22 CYS HG 1 49 LEU HA . . 3.810 2.948 2.454 3.474 . 0 0 "[ . 1 . 2]" 1
302 1 23 GLY H 1 24 PRO HD3 . . 4.480 4.501 4.445 4.556 0.076 20 0 "[ . 1 . 2]" 1
303 1 23 GLY H 1 26 VAL MG2 . . 4.360 3.480 3.291 3.582 . 0 0 "[ . 1 . 2]" 1
304 1 23 GLY HA2 1 24 PRO HD2 . . 3.240 3.029 2.972 3.101 . 0 0 "[ . 1 . 2]" 1
305 1 23 GLY HA2 1 24 PRO HD3 . . 3.300 2.218 2.172 2.280 . 0 0 "[ . 1 . 2]" 1
306 1 23 GLY HA3 1 24 PRO HD2 . . 3.390 2.511 2.452 2.557 . 0 0 "[ . 1 . 2]" 1
307 1 23 GLY HA3 1 24 PRO HD3 . . 3.240 2.844 2.771 2.901 . 0 0 "[ . 1 . 2]" 1
308 1 24 PRO HA 1 26 VAL MG2 . . 4.120 4.139 4.091 4.183 0.063 1 0 "[ . 1 . 2]" 1
309 1 24 PRO HA 1 27 GLY H . . 4.020 3.519 3.459 3.587 . 0 0 "[ . 1 . 2]" 1
310 1 24 PRO HA 1 27 GLY HA2 . . 4.120 4.140 4.095 4.175 0.055 4 0 "[ . 1 . 2]" 1
311 1 25 ASP H 1 25 ASP HB2 . . 3.810 2.695 2.464 3.638 . 0 0 "[ . 1 . 2]" 1
312 1 25 ASP H 1 25 ASP HB3 . . 3.990 3.134 2.675 3.768 . 0 0 "[ . 1 . 2]" 1
313 1 25 ASP H 1 26 VAL H . . 3.720 1.929 1.886 2.028 . 0 0 "[ . 1 . 2]" 1
314 1 25 ASP H 1 27 GLY H . . 5.110 2.852 2.801 2.957 . 0 0 "[ . 1 . 2]" 1
315 1 25 ASP HA 1 27 GLY H . . 4.270 4.210 4.049 4.283 0.013 7 0 "[ . 1 . 2]" 1
316 1 25 ASP HB2 1 26 VAL H . . 4.270 3.174 2.273 3.732 . 0 0 "[ . 1 . 2]" 1
317 1 25 ASP HB3 1 26 VAL H . . 4.280 2.761 2.300 3.988 . 0 0 "[ . 1 . 2]" 1
318 1 26 VAL H 1 26 VAL HB . . 4.120 3.529 3.500 3.539 . 0 0 "[ . 1 . 2]" 1
319 1 26 VAL H 1 26 VAL MG1 . . 3.130 2.231 2.118 2.496 . 0 0 "[ . 1 . 2]" 1
320 1 26 VAL H 1 26 VAL MG2 . . 2.960 1.923 1.894 1.980 . 0 0 "[ . 1 . 2]" 1
321 1 26 VAL H 1 27 GLY H . . 3.320 2.514 2.458 2.600 . 0 0 "[ . 1 . 2]" 1
322 1 26 VAL H 1 27 GLY HA2 . . 4.820 4.773 4.725 4.840 0.020 14 0 "[ . 1 . 2]" 1
323 1 26 VAL H 1 45 ILE MD . . 4.870 4.850 4.731 4.951 0.081 19 0 "[ . 1 . 2]" 1
324 1 26 VAL HA 1 26 VAL HB . . 2.900 2.470 2.436 2.550 . 0 0 "[ . 1 . 2]" 1
325 1 26 VAL HA 1 26 VAL MG1 . . 2.770 2.310 2.152 2.398 . 0 0 "[ . 1 . 2]" 1
326 1 26 VAL HA 1 26 VAL MG2 . . 3.360 3.210 3.198 3.219 . 0 0 "[ . 1 . 2]" 1
327 1 26 VAL HA 1 45 ILE MD . . 3.610 3.522 3.247 3.614 0.004 10 0 "[ . 1 . 2]" 1
328 1 26 VAL HB 1 27 GLY H . . 4.660 3.957 3.778 4.073 . 0 0 "[ . 1 . 2]" 1
329 1 26 VAL HB 1 39 TRP HE1 . . 4.590 3.199 2.732 3.620 . 0 0 "[ . 1 . 2]" 1
330 1 26 VAL HB 1 39 TRP HZ2 . . 3.820 3.636 2.757 3.843 0.023 15 0 "[ . 1 . 2]" 1
331 1 26 VAL HB 1 45 ILE MD . . 3.110 1.907 1.834 1.957 . 0 0 "[ . 1 . 2]" 1
332 1 26 VAL HB 1 45 ILE HG12 . . 3.670 3.055 2.286 3.696 0.026 19 0 "[ . 1 . 2]" 1
333 1 26 VAL HB 1 45 ILE MG . . 3.730 3.227 2.591 3.682 . 0 0 "[ . 1 . 2]" 1
334 1 26 VAL MG1 1 27 GLY H . . 4.440 4.041 3.965 4.158 . 0 0 "[ . 1 . 2]" 1
335 1 26 VAL MG1 1 45 ILE HA . . 3.670 3.236 2.958 3.505 . 0 0 "[ . 1 . 2]" 1
336 1 26 VAL MG1 1 45 ILE MD . . 3.390 2.625 2.070 2.995 . 0 0 "[ . 1 . 2]" 1
337 1 26 VAL MG1 1 45 ILE HG12 . . 3.810 2.216 1.946 2.593 . 0 0 "[ . 1 . 2]" 1
338 1 26 VAL MG1 1 45 ILE MG . . 3.110 2.541 1.934 3.115 0.005 5 0 "[ . 1 . 2]" 1
339 1 26 VAL MG1 1 48 LYS HD2 . . 3.610 3.513 3.241 3.615 0.005 7 0 "[ . 1 . 2]" 1
340 1 26 VAL MG1 1 48 LYS HD3 . . 3.730 3.142 2.430 3.710 . 0 0 "[ . 1 . 2]" 1
341 1 26 VAL MG2 1 27 GLY H . . 3.610 2.140 1.978 2.355 . 0 0 "[ . 1 . 2]" 1
342 1 26 VAL MG2 1 39 TRP HE1 . . 4.200 3.207 2.733 3.634 . 0 0 "[ . 1 . 2]" 1
343 1 26 VAL MG2 1 39 TRP HZ2 . . 2.880 1.997 1.944 2.118 . 0 0 "[ . 1 . 2]" 1
344 1 26 VAL MG2 1 45 ILE MD . . 3.270 2.814 2.556 3.364 0.094 14 0 "[ . 1 . 2]" 1
345 1 27 GLY H 1 27 GLY HA2 . . 2.870 2.307 2.282 2.332 . 0 0 "[ . 1 . 2]" 1
346 1 27 GLY H 1 45 ILE MD . . 5.460 5.096 4.926 5.373 . 0 0 "[ . 1 . 2]" 1
347 1 27 GLY HA2 1 28 ARG H . . 3.310 3.046 2.912 3.231 . 0 0 "[ . 1 . 2]" 1
348 1 27 GLY HA2 1 39 TRP HE1 . . 5.040 5.016 4.876 5.081 0.041 4 0 "[ . 1 . 2]" 1
349 1 27 GLY HA3 1 28 ARG H . . 2.870 2.287 2.210 2.369 . 0 0 "[ . 1 . 2]" 1
350 1 27 GLY HA3 1 39 TRP HE1 . . 4.520 3.942 3.686 4.069 . 0 0 "[ . 1 . 2]" 1
351 1 28 ARG H 1 28 ARG HB2 . . 3.580 2.761 2.390 3.482 . 0 0 "[ . 1 . 2]" 1
352 1 28 ARG H 1 28 ARG HB3 . . 3.810 3.232 2.666 3.532 . 0 0 "[ . 1 . 2]" 1
353 1 28 ARG H 1 29 PRO QD . . 4.820 4.281 4.184 4.311 . 0 0 "[ . 1 . 2]" 1
354 1 28 ARG H 1 39 TRP HE1 . . 4.320 3.932 3.446 4.268 . 0 0 "[ . 1 . 2]" 1
355 1 28 ARG HA 1 28 ARG HG2 . . 3.240 2.348 2.011 3.921 0.681 20 3 "[ . 1 . - *+]" 1
356 1 28 ARG HA 1 28 ARG HG3 . . 3.610 2.923 2.833 3.072 . 0 0 "[ . 1 . 2]" 1
357 1 28 ARG HA 1 29 PRO QD . . 2.990 2.094 1.904 2.209 . 0 0 "[ . 1 . 2]" 1
358 1 28 ARG HA 1 39 TRP HE1 . . 4.470 3.535 3.031 3.901 . 0 0 "[ . 1 . 2]" 1
359 1 28 ARG HA 1 39 TRP HZ2 . . 3.400 3.059 2.708 3.393 . 0 0 "[ . 1 . 2]" 1
360 1 28 ARG HB2 1 28 ARG QD . . 3.470 2.832 2.033 3.336 . 0 0 "[ . 1 . 2]" 1
361 1 28 ARG HB2 1 29 PRO QD . . 3.990 3.443 3.318 3.648 . 0 0 "[ . 1 . 2]" 1
362 1 28 ARG HB3 1 28 ARG QD . . 3.240 2.386 1.964 3.324 0.084 19 0 "[ . 1 . 2]" 1
363 1 28 ARG HB3 1 29 PRO QD . . 3.610 2.532 2.006 3.885 0.275 17 0 "[ . 1 . 2]" 1
364 1 28 ARG QD 1 29 PRO HG2 . . 3.360 3.343 3.277 3.445 0.085 17 0 "[ . 1 . 2]" 1
365 1 28 ARG HG2 1 29 PRO QD . . 3.170 2.075 1.771 3.369 0.199 17 0 "[ . 1 . 2]" 1
366 1 29 PRO HA 1 30 ASP H . . 2.810 2.350 2.150 2.714 . 0 0 "[ . 1 . 2]" 1
367 1 29 PRO HA 1 39 TRP HB2 . . 3.470 2.930 2.083 3.505 0.035 19 0 "[ . 1 . 2]" 1
368 1 29 PRO HA 1 39 TRP HD1 . . 3.820 3.498 2.764 3.854 0.034 19 0 "[ . 1 . 2]" 1
369 1 29 PRO HB2 1 30 ASP H . . 3.890 3.004 2.084 3.873 . 0 0 "[ . 1 . 2]" 1
370 1 29 PRO HB2 1 36 PHE H . . 4.780 3.250 2.996 3.592 . 0 0 "[ . 1 . 2]" 1
371 1 29 PRO HB2 1 36 PHE HA . . 3.610 2.711 2.240 3.201 . 0 0 "[ . 1 . 2]" 1
372 1 29 PRO HB2 1 36 PHE QD . . 4.270 3.789 3.093 4.167 . 0 0 "[ . 1 . 2]" 1
373 1 29 PRO HB2 1 39 TRP HB2 . . 3.890 3.516 2.963 3.897 0.007 7 0 "[ . 1 . 2]" 1
374 1 29 PRO HB3 1 30 ASP H . . 4.120 3.578 3.140 4.135 0.015 8 0 "[ . 1 . 2]" 1
375 1 29 PRO HB3 1 36 PHE H . . 4.920 3.965 3.512 4.267 . 0 0 "[ . 1 . 2]" 1
376 1 29 PRO HB3 1 36 PHE HA . . 3.430 2.142 2.002 2.336 . 0 0 "[ . 1 . 2]" 1
377 1 29 PRO HB3 1 36 PHE QD . . 3.350 3.240 2.816 3.364 0.014 1 0 "[ . 1 . 2]" 1
378 1 29 PRO HB3 1 39 TRP H . . 4.360 3.948 3.759 4.343 . 0 0 "[ . 1 . 2]" 1
379 1 29 PRO HB3 1 39 TRP HB2 . . 3.670 2.108 1.955 2.483 . 0 0 "[ . 1 . 2]" 1
380 1 29 PRO QD 1 39 TRP HE1 . . 4.920 4.349 3.894 4.715 . 0 0 "[ . 1 . 2]" 1
381 1 29 PRO HG3 1 36 PHE QD . . 3.460 2.547 2.288 2.784 . 0 0 "[ . 1 . 2]" 1
382 1 30 ASP H 1 30 ASP HB2 . . 3.190 2.517 2.032 3.550 0.360 20 0 "[ . 1 . 2]" 1
383 1 30 ASP H 1 30 ASP HB3 . . 3.510 3.220 2.679 3.526 0.016 1 0 "[ . 1 . 2]" 1
384 1 30 ASP H 1 39 TRP HB2 . . 5.110 4.018 2.618 4.597 . 0 0 "[ . 1 . 2]" 1
385 1 30 ASP HA 1 31 ARG H . . 2.920 2.646 2.305 2.941 0.021 16 0 "[ . 1 . 2]" 1
386 1 30 ASP HB2 1 31 ARG H . . 3.870 3.408 2.213 3.851 . 0 0 "[ . 1 . 2]" 1
387 1 30 ASP HB3 1 31 ARG H . . 3.390 2.602 1.952 3.891 0.501 8 1 "[ . + 1 . 2]" 1
388 1 31 ARG H 1 31 ARG HB2 . . 3.220 3.003 2.160 3.555 0.335 11 0 "[ . 1 . 2]" 1
389 1 31 ARG H 1 31 ARG HB3 . . 3.470 2.972 2.292 3.572 0.102 12 0 "[ . 1 . 2]" 1
390 1 31 ARG H 1 31 ARG QD . . 4.270 3.170 2.023 4.275 0.005 4 0 "[ . 1 . 2]" 1
391 1 31 ARG H 1 31 ARG HG2 . . 3.470 3.084 2.004 3.745 0.275 18 0 "[ . 1 . 2]" 1
392 1 31 ARG H 1 31 ARG HG3 . . 3.670 2.922 2.184 3.684 0.014 15 0 "[ . 1 . 2]" 1
393 1 31 ARG HA 1 31 ARG QD . . 3.890 3.841 3.608 3.992 0.102 18 0 "[ . 1 . 2]" 1
394 1 31 ARG HA 1 32 GLY H . . 2.950 2.580 2.433 2.772 . 0 0 "[ . 1 . 2]" 1
395 1 31 ARG HB2 1 31 ARG QD . . 3.890 2.623 1.967 3.323 . 0 0 "[ . 1 . 2]" 1
396 1 31 ARG HB2 1 32 GLY H . . 4.120 2.963 2.150 4.133 0.013 4 0 "[ . 1 . 2]" 1
397 1 31 ARG HB3 1 31 ARG QD . . 3.560 2.524 1.998 3.461 . 0 0 "[ . 1 . 2]" 1
398 1 31 ARG HB3 1 32 GLY H . . 4.120 3.136 2.002 3.831 . 0 0 "[ . 1 . 2]" 1
399 1 31 ARG HG2 1 32 GLY H . . 4.520 3.966 3.162 4.526 0.006 16 0 "[ . 1 . 2]" 1
400 1 31 ARG HG3 1 32 GLY H . . 4.180 4.232 3.688 4.553 0.373 4 0 "[ . 1 . 2]" 1
401 1 33 ARG HA 1 33 ARG HB3 . . 2.910 2.810 2.380 3.041 0.131 17 0 "[ . 1 . 2]" 1
402 1 33 ARG HA 1 33 ARG QD . . 3.610 3.012 2.173 3.708 0.098 8 0 "[ . 1 . 2]" 1
403 1 33 ARG HA 1 33 ARG QG . . 3.220 2.275 1.965 3.379 0.159 8 0 "[ . 1 . 2]" 1
404 1 33 ARG HB2 1 33 ARG QD . . 3.670 2.627 1.982 3.256 . 0 0 "[ . 1 . 2]" 1
405 1 33 ARG HB2 1 33 ARG QG . . 2.540 2.358 2.179 2.570 0.030 1 0 "[ . 1 . 2]" 1
406 1 33 ARG HB2 1 34 LEU H . . 3.690 3.157 2.254 3.946 0.256 18 0 "[ . 1 . 2]" 1
407 1 33 ARG HB3 1 33 ARG QD . . 3.610 2.670 1.964 3.357 . 0 0 "[ . 1 . 2]" 1
408 1 33 ARG HB3 1 33 ARG QG . . 2.740 2.368 2.179 2.571 . 0 0 "[ . 1 . 2]" 1
409 1 33 ARG HB3 1 34 LEU H . . 3.990 2.512 1.952 3.965 . 0 0 "[ . 1 . 2]" 1
410 1 34 LEU H 1 34 LEU HB2 . . 3.610 3.019 2.129 3.917 0.307 17 0 "[ . 1 . 2]" 1
411 1 34 LEU H 1 34 LEU HB3 . . 3.890 3.695 2.926 4.015 0.125 13 0 "[ . 1 . 2]" 1
412 1 34 LEU H 1 34 LEU QD . . 4.120 2.859 1.868 3.888 . 0 0 "[ . 1 . 2]" 1
413 1 34 LEU H 1 34 LEU HG . . 3.810 2.933 2.060 3.844 0.034 13 0 "[ . 1 . 2]" 1
414 1 34 LEU H 1 35 GLY H . . 3.530 2.897 1.849 3.596 0.066 9 0 "[ . 1 . 2]" 1
415 1 34 LEU HA 1 34 LEU QD . . 2.960 2.554 1.978 2.904 . 0 0 "[ . 1 . 2]" 1
416 1 34 LEU HA 1 34 LEU HG . . 3.890 3.103 2.135 3.700 . 0 0 "[ . 1 . 2]" 1
417 1 34 LEU HA 1 36 PHE H . . 5.110 4.505 3.825 4.976 . 0 0 "[ . 1 . 2]" 1
418 1 34 LEU HA 1 37 GLN H . . 4.280 3.737 3.270 4.273 . 0 0 "[ . 1 . 2]" 1
419 1 34 LEU HA 1 38 VAL H . . 5.040 4.653 3.813 5.055 0.015 1 0 "[ . 1 . 2]" 1
420 1 34 LEU HB2 1 34 LEU QD . . 3.070 2.123 1.954 2.452 . 0 0 "[ . 1 . 2]" 1
421 1 34 LEU HB2 1 35 GLY H . . 4.200 3.422 2.036 4.463 0.263 18 0 "[ . 1 . 2]" 1
422 1 34 LEU HB3 1 34 LEU QD . . 3.090 2.117 1.947 2.241 . 0 0 "[ . 1 . 2]" 1
423 1 34 LEU HB3 1 34 LEU HG . . 2.950 2.860 2.486 3.030 0.080 13 0 "[ . 1 . 2]" 1
424 1 34 LEU HB3 1 35 GLY H . . 4.200 3.816 2.632 4.479 0.279 18 0 "[ . 1 . 2]" 1
425 1 34 LEU QD 1 35 GLY H . . 4.870 4.089 3.064 4.583 . 0 0 "[ . 1 . 2]" 1
426 1 35 GLY H 1 36 PHE H . . 3.730 2.949 1.932 3.604 . 0 0 "[ . 1 . 2]" 1
427 1 35 GLY H 1 36 PHE HB2 . . 5.500 5.095 4.235 6.040 0.540 1 1 "[+ . 1 . 2]" 1
428 1 35 GLY HA2 1 38 VAL HB . . 3.990 3.133 2.768 3.422 . 0 0 "[ . 1 . 2]" 1
429 1 35 GLY HA2 1 38 VAL MG2 . . 3.670 3.338 2.953 3.670 . 6 0 "[ . 1 . 2]" 1
430 1 36 PHE H 1 36 PHE HB2 . . 3.300 2.293 2.198 2.448 . 0 0 "[ . 1 . 2]" 1
431 1 36 PHE H 1 36 PHE HB3 . . 3.390 2.465 2.283 2.608 . 0 0 "[ . 1 . 2]" 1
432 1 36 PHE H 1 36 PHE QD . . 4.390 4.054 4.008 4.085 . 0 0 "[ . 1 . 2]" 1
433 1 36 PHE H 1 37 GLN H . . 3.670 3.002 2.619 3.179 . 0 0 "[ . 1 . 2]" 1
434 1 36 PHE H 1 38 VAL H . . 4.980 4.570 3.908 4.909 . 0 0 "[ . 1 . 2]" 1
435 1 36 PHE HA 1 36 PHE QD . . 3.130 2.399 2.288 2.652 . 0 0 "[ . 1 . 2]" 1
436 1 36 PHE HA 1 39 TRP H . . 3.990 3.320 3.028 3.487 . 0 0 "[ . 1 . 2]" 1
437 1 36 PHE HA 1 39 TRP HB3 . . 3.730 2.570 2.226 3.202 . 0 0 "[ . 1 . 2]" 1
438 1 36 PHE HA 1 39 TRP HE3 . . 3.960 3.517 2.814 3.970 0.010 10 0 "[ . 1 . 2]" 1
439 1 36 PHE HB2 1 37 GLN H . . 3.890 3.694 3.535 3.909 0.019 8 0 "[ . 1 . 2]" 1
440 1 36 PHE HB3 1 37 GLN H . . 3.630 2.245 2.036 2.604 . 0 0 "[ . 1 . 2]" 1
441 1 36 PHE QD 1 37 GLN H . . 3.820 3.425 3.147 3.811 . 0 0 "[ . 1 . 2]" 1
442 1 36 PHE QD 1 37 GLN HA . . 3.810 3.749 3.477 3.833 0.023 4 0 "[ . 1 . 2]" 1
443 1 36 PHE QD 1 37 GLN HB2 . . 4.480 4.245 3.884 4.443 . 0 0 "[ . 1 . 2]" 1
444 1 36 PHE QD 1 40 LEU MD1 . . 3.700 3.602 3.412 3.706 0.006 2 0 "[ . 1 . 2]" 1
445 1 36 PHE QD 1 107 MET ME . . 2.740 2.557 1.951 2.747 0.007 4 0 "[ . 1 . 2]" 1
446 1 36 PHE QE 1 39 TRP HZ3 . . 3.400 2.946 2.510 3.296 . 0 0 "[ . 1 . 2]" 1
447 1 36 PHE QE 1 40 LEU MD1 . . 3.110 2.224 2.017 2.393 . 0 0 "[ . 1 . 2]" 1
448 1 36 PHE QE 1 40 LEU HG . . 3.530 3.540 3.497 3.569 0.039 4 0 "[ . 1 . 2]" 1
449 1 36 PHE QE 1 114 LEU MD1 . . 3.560 3.298 2.819 3.577 0.017 16 0 "[ . 1 . 2]" 1
450 1 36 PHE HZ 1 40 LEU MD1 . . 3.610 2.430 2.187 2.705 . 0 0 "[ . 1 . 2]" 1
451 1 36 PHE HZ 1 114 LEU MD1 . . 2.960 2.479 2.037 2.789 . 0 0 "[ . 1 . 2]" 1
452 1 37 GLN H 1 37 GLN HB2 . . 3.190 2.306 2.126 2.466 . 0 0 "[ . 1 . 2]" 1
453 1 37 GLN H 1 37 GLN HB3 . . 3.420 2.685 2.498 2.951 . 0 0 "[ . 1 . 2]" 1
454 1 37 GLN H 1 38 VAL H . . 3.560 3.012 2.719 3.249 . 0 0 "[ . 1 . 2]" 1
455 1 37 GLN H 1 107 MET ME . . 3.470 3.224 2.675 3.456 . 0 0 "[ . 1 . 2]" 1
456 1 37 GLN HA 1 37 GLN HG2 . . 3.330 2.362 2.290 2.505 . 0 0 "[ . 1 . 2]" 1
457 1 37 GLN HA 1 37 GLN HG3 . . 3.360 3.260 3.072 3.589 0.229 4 0 "[ . 1 . 2]" 1
458 1 37 GLN HA 1 101 LEU MD1 . . 3.390 2.711 2.509 2.925 . 0 0 "[ . 1 . 2]" 1
459 1 37 GLN HA 1 107 MET ME . . 2.960 2.216 1.940 2.783 . 0 0 "[ . 1 . 2]" 1
460 1 37 GLN HB2 1 37 GLN HE21 . . 4.480 4.464 4.121 4.584 0.104 16 0 "[ . 1 . 2]" 1
461 1 37 GLN HB2 1 38 VAL H . . 3.990 3.704 3.350 3.978 . 0 0 "[ . 1 . 2]" 1
462 1 37 GLN HB3 1 38 VAL H . . 3.640 2.368 2.044 2.790 . 0 0 "[ . 1 . 2]" 1
463 1 37 GLN HB3 1 38 VAL MG2 . . 3.730 2.952 2.783 3.157 . 0 0 "[ . 1 . 2]" 1
464 1 37 GLN HB3 1 107 MET ME . . 3.470 3.447 3.327 3.520 0.050 15 0 "[ . 1 . 2]" 1
465 1 37 GLN HE21 1 37 GLN HG2 . . 3.430 2.236 2.103 3.349 . 0 0 "[ . 1 . 2]" 1
466 1 37 GLN HE21 1 37 GLN HG3 . . 3.670 3.185 2.124 3.353 . 0 0 "[ . 1 . 2]" 1
467 1 37 GLN HE21 1 41 LYS HA . . 4.870 3.704 3.328 4.894 0.024 10 0 "[ . 1 . 2]" 1
468 1 37 GLN HE21 1 41 LYS HD2 . . 4.780 3.537 3.081 4.273 . 0 0 "[ . 1 . 2]" 1
469 1 37 GLN HE21 1 41 LYS HG3 . . 4.480 3.353 2.865 3.982 . 0 0 "[ . 1 . 2]" 1
470 1 37 GLN HE21 1 101 LEU MD1 . . 4.270 3.046 2.518 4.289 0.019 4 0 "[ . 1 . 2]" 1
471 1 37 GLN HE21 1 103 GLU HA . . 4.980 4.784 3.714 5.002 0.022 16 0 "[ . 1 . 2]" 1
472 1 37 GLN HE21 1 104 GLY H . . 4.410 3.495 2.801 4.400 . 0 0 "[ . 1 . 2]" 1
473 1 37 GLN HE21 1 104 GLY HA2 . . 4.480 4.358 3.861 4.487 0.007 9 0 "[ . 1 . 2]" 1
474 1 37 GLN HE22 1 37 GLN HG2 . . 3.890 3.508 3.445 4.037 0.147 4 0 "[ . 1 . 2]" 1
475 1 37 GLN HE22 1 41 LYS HA . . 4.980 4.673 3.473 4.994 0.014 16 0 "[ . 1 . 2]" 1
476 1 37 GLN HE22 1 41 LYS HB2 . . 5.040 3.106 2.698 3.404 . 0 0 "[ . 1 . 2]" 1
477 1 37 GLN HE22 1 41 LYS HD2 . . 4.120 2.758 2.422 3.108 . 0 0 "[ . 1 . 2]" 1
478 1 37 GLN HE22 1 41 LYS HD3 . . 4.800 4.282 3.667 4.683 . 0 0 "[ . 1 . 2]" 1
479 1 37 GLN HE22 1 41 LYS HG3 . . 4.820 3.322 2.195 3.722 . 0 0 "[ . 1 . 2]" 1
480 1 37 GLN HE22 1 103 GLU HA . . 5.040 3.843 3.123 4.485 . 0 0 "[ . 1 . 2]" 1
481 1 37 GLN HE22 1 104 GLY H . . 4.730 3.631 3.077 4.477 . 0 0 "[ . 1 . 2]" 1
482 1 37 GLN HE22 1 104 GLY HA2 . . 5.190 4.854 4.489 5.192 0.002 10 0 "[ . 1 . 2]" 1
483 1 37 GLN HG2 1 38 VAL H . . 4.480 4.237 3.967 4.667 0.187 4 0 "[ . 1 . 2]" 1
484 1 37 GLN HG2 1 101 LEU MD1 . . 3.730 2.266 2.043 2.578 . 0 0 "[ . 1 . 2]" 1
485 1 37 GLN HG3 1 101 LEU MD1 . . 3.990 3.372 3.043 3.764 . 0 0 "[ . 1 . 2]" 1
486 1 37 GLN HG3 1 104 GLY H . . 4.480 3.474 3.159 4.045 . 0 0 "[ . 1 . 2]" 1
487 1 37 GLN HG3 1 104 GLY HA2 . . 3.990 2.419 2.033 3.151 . 0 0 "[ . 1 . 2]" 1
488 1 37 GLN HG3 1 104 GLY HA3 . . 3.990 2.447 2.108 2.848 . 0 0 "[ . 1 . 2]" 1
489 1 37 GLN HG3 1 107 MET ME . . 3.990 2.308 1.947 3.104 . 0 0 "[ . 1 . 2]" 1
490 1 38 VAL H 1 38 VAL HB . . 3.050 2.441 2.379 2.574 . 0 0 "[ . 1 . 2]" 1
491 1 38 VAL H 1 38 VAL MG1 . . 4.020 3.704 3.694 3.734 . 0 0 "[ . 1 . 2]" 1
492 1 38 VAL H 1 38 VAL MG2 . . 2.790 2.059 1.916 2.259 . 0 0 "[ . 1 . 2]" 1
493 1 38 VAL H 1 39 TRP H . . 3.740 2.701 2.322 2.966 . 0 0 "[ . 1 . 2]" 1
494 1 38 VAL H 1 40 LEU H . . 4.690 4.117 3.852 4.485 . 0 0 "[ . 1 . 2]" 1
495 1 38 VAL HA 1 38 VAL MG1 . . 3.050 2.366 2.286 2.475 . 0 0 "[ . 1 . 2]" 1
496 1 38 VAL HA 1 38 VAL MG2 . . 2.830 2.359 2.251 2.439 . 0 0 "[ . 1 . 2]" 1
497 1 38 VAL HA 1 41 LYS H . . 3.730 3.541 3.354 3.737 0.007 14 0 "[ . 1 . 2]" 1
498 1 38 VAL HA 1 41 LYS HB2 . . 3.430 2.016 1.985 2.090 . 0 0 "[ . 1 . 2]" 1
499 1 38 VAL HA 1 41 LYS HB3 . . 3.730 2.126 1.994 2.383 . 0 0 "[ . 1 . 2]" 1
500 1 38 VAL HA 1 41 LYS HD2 . . 3.810 3.108 2.656 3.658 . 0 0 "[ . 1 . 2]" 1
501 1 38 VAL HA 1 41 LYS HD3 . . 3.890 3.073 2.592 3.592 . 0 0 "[ . 1 . 2]" 1
502 1 38 VAL HB 1 39 TRP H . . 3.560 2.655 2.517 2.953 . 0 0 "[ . 1 . 2]" 1
503 1 38 VAL HB 1 40 LEU H . . 5.190 4.991 4.711 5.212 0.022 4 0 "[ . 1 . 2]" 1
504 1 38 VAL MG1 1 39 TRP H . . 3.890 3.534 3.263 3.880 . 0 0 "[ . 1 . 2]" 1
505 1 38 VAL MG2 1 39 TRP H . . 3.890 3.863 3.799 3.902 0.012 7 0 "[ . 1 . 2]" 1
506 1 39 TRP H 1 39 TRP HB2 . . 3.430 2.234 2.106 2.355 . 0 0 "[ . 1 . 2]" 1
507 1 39 TRP H 1 39 TRP HB3 . . 3.470 2.719 2.564 2.893 . 0 0 "[ . 1 . 2]" 1
508 1 39 TRP H 1 40 LEU H . . 3.630 2.780 2.594 2.913 . 0 0 "[ . 1 . 2]" 1
509 1 39 TRP HA 1 39 TRP HD1 . . 3.000 2.416 2.199 2.571 . 0 0 "[ . 1 . 2]" 1
510 1 39 TRP HA 1 39 TRP HE1 . . 4.980 4.793 4.626 4.894 . 0 0 "[ . 1 . 2]" 1
511 1 39 TRP HB2 1 39 TRP HD1 . . 3.700 3.090 2.996 3.213 . 0 0 "[ . 1 . 2]" 1
512 1 39 TRP HB2 1 39 TRP HE3 . . 3.700 3.679 3.532 3.787 0.087 20 0 "[ . 1 . 2]" 1
513 1 39 TRP HB2 1 40 LEU H . . 4.040 3.807 3.506 4.003 . 0 0 "[ . 1 . 2]" 1
514 1 39 TRP HB3 1 39 TRP HE3 . . 3.300 2.340 2.330 2.380 . 0 0 "[ . 1 . 2]" 1
515 1 39 TRP HB3 1 40 LEU H . . 3.390 2.735 2.472 2.982 . 0 0 "[ . 1 . 2]" 1
516 1 39 TRP HB3 1 40 LEU MD1 . . 5.500 4.197 3.900 4.521 . 0 0 "[ . 1 . 2]" 1
517 1 39 TRP HB3 1 40 LEU HG . . 3.730 2.723 2.422 3.028 . 0 0 "[ . 1 . 2]" 1
518 1 39 TRP HD1 1 45 ILE MD . . 3.400 3.297 3.055 3.413 0.013 19 0 "[ . 1 . 2]" 1
519 1 39 TRP HE1 1 45 ILE MD . . 3.270 2.857 2.510 3.140 . 0 0 "[ . 1 . 2]" 1
520 1 39 TRP HE3 1 40 LEU MD2 . . 3.240 2.636 2.232 3.031 . 0 0 "[ . 1 . 2]" 1
521 1 39 TRP HE3 1 40 LEU HG . . 3.210 2.489 2.145 2.919 . 0 0 "[ . 1 . 2]" 1
522 1 39 TRP HZ2 1 45 ILE MD . . 3.890 3.547 3.199 3.920 0.030 4 0 "[ . 1 . 2]" 1
523 1 39 TRP HZ3 1 40 LEU MD2 . . 3.610 3.200 2.935 3.520 . 0 0 "[ . 1 . 2]" 1
524 1 40 LEU H 1 40 LEU HB2 . . 3.210 2.619 2.518 2.796 . 0 0 "[ . 1 . 2]" 1
525 1 40 LEU H 1 40 LEU HB3 . . 3.840 3.706 3.673 3.737 . 0 0 "[ . 1 . 2]" 1
526 1 40 LEU H 1 40 LEU MD2 . . 3.760 3.392 3.083 3.552 . 0 0 "[ . 1 . 2]" 1
527 1 40 LEU H 1 40 LEU HG . . 3.330 2.705 2.276 3.061 . 0 0 "[ . 1 . 2]" 1
528 1 40 LEU H 1 41 LYS H . . 3.310 3.005 2.775 3.182 . 0 0 "[ . 1 . 2]" 1
529 1 40 LEU H 1 41 LYS HB2 . . 4.980 4.305 4.170 4.424 . 0 0 "[ . 1 . 2]" 1
530 1 40 LEU H 1 101 LEU MD1 . . 3.730 3.577 3.453 3.734 0.004 4 0 "[ . 1 . 2]" 1
531 1 40 LEU H 1 101 LEU MD2 . . 4.920 4.898 4.826 4.935 0.015 15 0 "[ . 1 . 2]" 1
532 1 40 LEU HA 1 40 LEU MD1 . . 3.990 3.849 3.745 3.953 . 0 0 "[ . 1 . 2]" 1
533 1 40 LEU HA 1 40 LEU MD2 . . 3.040 2.048 1.951 2.409 . 0 0 "[ . 1 . 2]" 1
534 1 40 LEU HA 1 42 ASN H . . 5.190 4.482 4.302 4.676 . 0 0 "[ . 1 . 2]" 1
535 1 40 LEU HA 1 46 LEU H . . 5.040 4.138 3.937 4.329 . 0 0 "[ . 1 . 2]" 1
536 1 40 LEU HA 1 46 LEU HG . . 3.220 3.115 2.807 3.223 0.003 7 0 "[ . 1 . 2]" 1
537 1 40 LEU HB2 1 40 LEU MD1 . . 3.300 2.310 2.217 2.413 . 0 0 "[ . 1 . 2]" 1
538 1 40 LEU HB2 1 101 LEU MD1 . . 3.730 2.251 2.110 2.388 . 0 0 "[ . 1 . 2]" 1
539 1 40 LEU HB3 1 40 LEU MD1 . . 3.110 2.389 2.285 2.471 . 0 0 "[ . 1 . 2]" 1
540 1 40 LEU HB3 1 40 LEU MD2 . . 3.330 2.456 2.344 2.543 . 0 0 "[ . 1 . 2]" 1
541 1 40 LEU HB3 1 46 LEU MD1 . . 3.990 2.271 1.965 2.781 . 0 0 "[ . 1 . 2]" 1
542 1 40 LEU HB3 1 101 LEU MD1 . . 3.990 3.003 2.532 3.422 . 0 0 "[ . 1 . 2]" 1
543 1 40 LEU MD1 1 46 LEU MD2 . . 2.880 2.268 1.943 2.704 . 0 0 "[ . 1 . 2]" 1
544 1 40 LEU MD1 1 101 LEU MD1 . . 3.510 3.426 3.292 3.525 0.015 14 0 "[ . 1 . 2]" 1
545 1 40 LEU MD1 1 101 LEU MD2 . . 3.990 3.731 3.557 3.874 . 0 0 "[ . 1 . 2]" 1
546 1 40 LEU MD2 1 41 LYS H . . 4.690 4.282 4.158 4.389 . 0 0 "[ . 1 . 2]" 1
547 1 40 LEU MD2 1 45 ILE HB . . 3.150 2.933 2.486 3.154 0.004 4 0 "[ . 1 . 2]" 1
548 1 40 LEU MD2 1 46 LEU H . . 4.120 3.616 3.390 3.960 . 0 0 "[ . 1 . 2]" 1
549 1 40 LEU MD2 1 46 LEU MD2 . . 3.470 2.710 2.424 3.074 . 0 0 "[ . 1 . 2]" 1
550 1 40 LEU MD2 1 46 LEU HG . . 3.470 2.397 2.012 3.018 . 0 0 "[ . 1 . 2]" 1
551 1 41 LYS H 1 41 LYS HB2 . . 3.240 3.093 2.988 3.174 . 0 0 "[ . 1 . 2]" 1
552 1 41 LYS H 1 41 LYS HB3 . . 3.390 2.378 2.307 2.420 . 0 0 "[ . 1 . 2]" 1
553 1 41 LYS H 1 41 LYS HG2 . . 4.160 4.150 4.064 4.184 0.024 10 0 "[ . 1 . 2]" 1
554 1 41 LYS H 1 42 ASN H . . 3.900 2.294 2.182 2.440 . 0 0 "[ . 1 . 2]" 1
555 1 41 LYS H 1 42 ASN HA . . 4.870 4.780 4.699 4.905 0.035 10 0 "[ . 1 . 2]" 1
556 1 41 LYS H 1 101 LEU MD1 . . 4.270 4.152 3.799 4.306 0.036 4 0 "[ . 1 . 2]" 1
557 1 41 LYS H 1 101 LEU MD2 . . 4.690 4.694 4.638 4.740 0.050 14 0 "[ . 1 . 2]" 1
558 1 41 LYS HA 1 41 LYS HG3 . . 3.510 2.756 2.709 2.777 . 0 0 "[ . 1 . 2]" 1
559 1 41 LYS HA 1 43 GLY H . . 4.690 4.524 4.152 4.699 0.009 4 0 "[ . 1 . 2]" 1
560 1 41 LYS HA 1 101 LEU MD1 . . 2.940 2.902 2.582 2.953 0.013 19 0 "[ . 1 . 2]" 1
561 1 41 LYS HA 1 101 LEU MD2 . . 3.390 3.253 3.134 3.395 0.005 10 0 "[ . 1 . 2]" 1
562 1 41 LYS HA 1 101 LEU HG . . 3.240 2.603 2.485 2.772 . 0 0 "[ . 1 . 2]" 1
563 1 41 LYS HA 1 102 TYR QD . . 3.820 3.716 3.338 3.850 0.030 19 0 "[ . 1 . 2]" 1
564 1 41 LYS HB2 1 41 LYS HD2 . . 3.990 2.757 2.468 3.094 . 0 0 "[ . 1 . 2]" 1
565 1 41 LYS HB2 1 41 LYS HD3 . . 3.610 3.087 2.740 3.425 . 0 0 "[ . 1 . 2]" 1
566 1 41 LYS HB2 1 42 ASN H . . 4.440 3.912 3.837 3.981 . 0 0 "[ . 1 . 2]" 1
567 1 41 LYS HB2 1 102 TYR HA . . 4.120 3.594 3.303 4.121 0.001 10 0 "[ . 1 . 2]" 1
568 1 41 LYS HB3 1 42 ASN H . . 3.890 2.501 2.389 2.602 . 0 0 "[ . 1 . 2]" 1
569 1 41 LYS HE2 1 41 LYS HG3 . . 3.510 2.929 2.237 3.498 . 0 0 "[ . 1 . 2]" 1
570 1 41 LYS HE3 1 41 LYS HG2 . . 3.990 3.219 2.640 3.812 . 0 0 "[ . 1 . 2]" 1
571 1 41 LYS HE3 1 41 LYS HG3 . . 3.130 2.951 2.280 3.450 0.320 4 0 "[ . 1 . 2]" 1
572 1 41 LYS HE3 1 102 TYR QE . . 3.610 3.377 2.338 4.558 0.948 8 1 "[ . + 1 . 2]" 1
573 1 41 LYS HG2 1 42 ASN H . . 4.590 3.084 2.684 3.288 . 0 0 "[ . 1 . 2]" 1
574 1 41 LYS HG2 1 102 TYR HA . . 3.810 3.641 3.406 3.815 0.005 5 0 "[ . 1 . 2]" 1
575 1 41 LYS HG2 1 102 TYR QD . . 3.300 2.815 2.487 3.087 . 0 0 "[ . 1 . 2]" 1
576 1 41 LYS HG2 1 102 TYR QE . . 3.350 3.164 2.651 3.359 0.009 14 0 "[ . 1 . 2]" 1
577 1 41 LYS HG3 1 42 ASN H . . 4.550 4.392 4.058 4.545 . 0 0 "[ . 1 . 2]" 1
578 1 41 LYS HG3 1 102 TYR HA . . 3.610 2.110 1.995 2.535 . 0 0 "[ . 1 . 2]" 1
579 1 42 ASN H 1 42 ASN HB2 . . 3.620 2.439 2.087 3.562 . 0 0 "[ . 1 . 2]" 1
580 1 42 ASN H 1 42 ASN HB3 . . 3.990 3.281 2.564 3.567 . 0 0 "[ . 1 . 2]" 1
581 1 42 ASN H 1 43 GLY H . . 3.600 3.011 2.836 3.116 . 0 0 "[ . 1 . 2]" 1
582 1 42 ASN HA 1 74 GLN HB3 . . 3.810 3.154 2.493 3.602 . 0 0 "[ . 1 . 2]" 1
583 1 42 ASN HA 1 74 GLN HE21 . . 3.980 3.089 2.025 3.974 . 0 0 "[ . 1 . 2]" 1
584 1 42 ASN HA 1 74 GLN HE22 . . 4.100 3.160 2.337 4.017 . 0 0 "[ . 1 . 2]" 1
585 1 42 ASN HA 1 74 GLN QG . . 4.120 3.259 2.110 3.912 . 0 0 "[ . 1 . 2]" 1
586 1 42 ASN HB2 1 43 GLY H . . 4.870 2.841 2.337 3.727 . 0 0 "[ . 1 . 2]" 1
587 1 42 ASN HB2 1 74 GLN HE21 . . 5.190 4.698 3.409 6.031 0.841 17 3 "[ * . 1 - + 2]" 1
588 1 42 ASN HB2 1 74 GLN HE22 . . 4.980 4.532 2.385 5.530 0.550 19 2 "[ .- 1 . +2]" 1
589 1 42 ASN HB3 1 43 GLY H . . 3.990 2.998 2.144 3.955 . 0 0 "[ . 1 . 2]" 1
590 1 42 ASN QD 1 44 VAL MG2 . . 3.730 2.909 2.147 3.533 . 0 0 "[ . 1 . 2]" 1
591 1 42 ASN QD 1 67 PRO HB2 . . 4.270 2.248 1.917 2.665 . 0 0 "[ . 1 . 2]" 1
592 1 42 ASN QD 1 67 PRO HB3 . . 4.120 2.500 1.940 3.019 . 0 0 "[ . 1 . 2]" 1
593 1 42 ASN QD 1 67 PRO HG2 . . 4.440 3.571 2.670 4.125 . 0 0 "[ . 1 . 2]" 1
594 1 43 GLY H 1 44 VAL H . . 3.910 2.695 2.099 2.963 . 0 0 "[ . 1 . 2]" 1
595 1 43 GLY H 1 44 VAL MG2 . . 4.820 4.427 3.972 4.685 . 0 0 "[ . 1 . 2]" 1
596 1 43 GLY H 1 78 VAL MG2 . . 3.810 3.638 3.327 3.824 0.014 16 0 "[ . 1 . 2]" 1
597 1 43 GLY HA2 1 78 VAL MG2 . . 3.240 2.225 1.972 2.449 . 0 0 "[ . 1 . 2]" 1
598 1 43 GLY HA3 1 78 VAL MG2 . . 3.430 2.136 1.846 2.407 . 0 0 "[ . 1 . 2]" 1
599 1 44 VAL H 1 44 VAL HB . . 3.330 2.357 2.226 2.476 . 0 0 "[ . 1 . 2]" 1
600 1 44 VAL H 1 44 VAL MG1 . . 3.670 3.690 3.652 3.708 0.038 11 0 "[ . 1 . 2]" 1
601 1 44 VAL H 1 44 VAL MG2 . . 3.010 2.157 1.933 2.454 . 0 0 "[ . 1 . 2]" 1
602 1 44 VAL H 1 45 ILE H . . 4.030 2.906 2.597 3.051 . 0 0 "[ . 1 . 2]" 1
603 1 44 VAL HA 1 44 VAL MG2 . . 2.730 2.318 2.191 2.392 . 0 0 "[ . 1 . 2]" 1
604 1 44 VAL HA 1 47 SER H . . 3.670 3.507 3.319 3.660 . 0 0 "[ . 1 . 2]" 1
605 1 44 VAL HA 1 47 SER QB . . 3.510 2.925 2.453 3.428 . 0 0 "[ . 1 . 2]" 1
606 1 44 VAL HB 1 45 ILE H . . 3.610 2.555 2.383 2.752 . 0 0 "[ . 1 . 2]" 1
607 1 44 VAL MG1 1 45 ILE H . . 4.060 3.235 2.940 3.495 . 0 0 "[ . 1 . 2]" 1
608 1 44 VAL MG1 1 48 LYS HD2 . . 3.360 2.326 1.965 2.846 . 0 0 "[ . 1 . 2]" 1
609 1 44 VAL MG1 1 48 LYS HE2 . . 3.130 3.123 2.929 3.300 0.170 3 0 "[ . 1 . 2]" 1
610 1 44 VAL MG1 1 48 LYS HE3 . . 3.300 2.803 1.889 3.301 0.001 5 0 "[ . 1 . 2]" 1
611 1 44 VAL MG2 1 45 ILE H . . 4.070 3.951 3.881 4.056 . 0 0 "[ . 1 . 2]" 1
612 1 44 VAL MG2 1 64 PRO HD2 . . 3.890 3.040 2.810 3.309 . 0 0 "[ . 1 . 2]" 1
613 1 44 VAL MG2 1 64 PRO HG2 . . 3.890 3.732 2.794 3.910 0.020 16 0 "[ . 1 . 2]" 1
614 1 44 VAL MG2 1 67 PRO HA . . 3.430 2.343 2.073 2.911 . 0 0 "[ . 1 . 2]" 1
615 1 44 VAL MG2 1 67 PRO HB2 . . 3.390 3.143 2.783 3.412 0.022 7 0 "[ . 1 . 2]" 1
616 1 44 VAL MG2 1 67 PRO HB3 . . 3.390 2.091 1.795 2.553 . 0 0 "[ . 1 . 2]" 1
617 1 44 VAL MG2 1 68 PRO HD2 . . 3.390 2.379 1.898 3.100 . 0 0 "[ . 1 . 2]" 1
618 1 45 ILE H 1 45 ILE HB . . 3.660 2.329 2.135 2.452 . 0 0 "[ . 1 . 2]" 1
619 1 45 ILE H 1 45 ILE MD . . 3.870 3.718 3.513 3.837 . 0 0 "[ . 1 . 2]" 1
620 1 45 ILE H 1 45 ILE HG12 . . 4.120 3.266 2.929 3.769 . 0 0 "[ . 1 . 2]" 1
621 1 45 ILE H 1 45 ILE HG13 . . 3.750 2.273 1.979 2.680 . 0 0 "[ . 1 . 2]" 1
622 1 45 ILE H 1 45 ILE MG . . 4.120 3.677 3.581 3.714 . 0 0 "[ . 1 . 2]" 1
623 1 45 ILE H 1 46 LEU H . . 4.180 2.769 2.624 3.008 . 0 0 "[ . 1 . 2]" 1
624 1 45 ILE H 1 48 LYS HD2 . . 4.800 4.424 3.927 4.783 . 0 0 "[ . 1 . 2]" 1
625 1 45 ILE HA 1 45 ILE MD . . 3.810 3.681 3.581 3.803 . 0 0 "[ . 1 . 2]" 1
626 1 45 ILE HA 1 45 ILE HG12 . . 3.330 2.349 2.251 2.482 . 0 0 "[ . 1 . 2]" 1
627 1 45 ILE HA 1 45 ILE HG13 . . 3.670 3.071 2.738 3.318 . 0 0 "[ . 1 . 2]" 1
628 1 45 ILE HA 1 45 ILE MG . . 3.010 2.529 2.363 2.651 . 0 0 "[ . 1 . 2]" 1
629 1 45 ILE HA 1 47 SER H . . 4.730 4.491 4.257 4.721 . 0 0 "[ . 1 . 2]" 1
630 1 45 ILE HA 1 48 LYS H . . 3.890 3.227 3.052 3.395 . 0 0 "[ . 1 . 2]" 1
631 1 45 ILE HA 1 48 LYS HB2 . . 3.560 2.295 2.127 2.393 . 0 0 "[ . 1 . 2]" 1
632 1 45 ILE HA 1 48 LYS HB3 . . 3.890 3.851 3.642 3.927 0.037 7 0 "[ . 1 . 2]" 1
633 1 45 ILE HA 1 48 LYS HD2 . . 3.240 2.754 2.285 3.090 . 0 0 "[ . 1 . 2]" 1
634 1 45 ILE HA 1 48 LYS HG3 . . 4.120 3.843 3.297 4.122 0.002 20 0 "[ . 1 . 2]" 1
635 1 45 ILE HA 1 49 LEU H . . 4.920 4.201 4.002 4.381 . 0 0 "[ . 1 . 2]" 1
636 1 45 ILE HB 1 45 ILE MD . . 3.390 2.461 2.271 2.612 . 0 0 "[ . 1 . 2]" 1
637 1 45 ILE HB 1 46 LEU H . . 3.990 2.610 2.371 2.856 . 0 0 "[ . 1 . 2]" 1
638 1 45 ILE HG12 1 45 ILE MG . . 3.430 2.556 2.403 2.679 . 0 0 "[ . 1 . 2]" 1
639 1 45 ILE HG13 1 45 ILE MG . . 3.390 3.219 3.193 3.242 . 0 0 "[ . 1 . 2]" 1
640 1 45 ILE MG 1 46 LEU H . . 3.700 3.198 2.806 3.564 . 0 0 "[ . 1 . 2]" 1
641 1 45 ILE MG 1 48 LYS H . . 4.920 4.412 4.141 4.648 . 0 0 "[ . 1 . 2]" 1
642 1 46 LEU H 1 46 LEU HB2 . . 3.510 2.236 2.162 2.347 . 0 0 "[ . 1 . 2]" 1
643 1 46 LEU H 1 46 LEU MD1 . . 3.990 3.547 3.425 3.711 . 0 0 "[ . 1 . 2]" 1
644 1 46 LEU H 1 46 LEU MD2 . . 3.810 3.737 3.619 3.813 0.003 6 0 "[ . 1 . 2]" 1
645 1 46 LEU H 1 46 LEU HG . . 3.600 2.590 2.352 2.744 . 0 0 "[ . 1 . 2]" 1
646 1 46 LEU H 1 47 SER H . . 3.740 2.814 2.636 2.988 . 0 0 "[ . 1 . 2]" 1
647 1 46 LEU H 1 48 LYS H . . 4.920 4.045 3.865 4.196 . 0 0 "[ . 1 . 2]" 1
648 1 46 LEU HA 1 46 LEU MD1 . . 3.880 3.834 3.804 3.876 . 0 0 "[ . 1 . 2]" 1
649 1 46 LEU HA 1 46 LEU MD2 . . 2.910 1.998 1.971 2.056 . 0 0 "[ . 1 . 2]" 1
650 1 46 LEU HA 1 46 LEU HG . . 3.890 2.750 2.695 2.831 . 0 0 "[ . 1 . 2]" 1
651 1 46 LEU HA 1 49 LEU H . . 4.120 3.290 3.175 3.380 . 0 0 "[ . 1 . 2]" 1
652 1 46 LEU HA 1 49 LEU HB2 . . 3.990 3.032 2.838 3.357 . 0 0 "[ . 1 . 2]" 1
653 1 46 LEU HA 1 49 LEU HB3 . . 3.360 2.992 2.815 3.179 . 0 0 "[ . 1 . 2]" 1
654 1 46 LEU HA 1 49 LEU MD2 . . 3.560 3.284 3.074 3.444 . 0 0 "[ . 1 . 2]" 1
655 1 46 LEU HA 1 50 VAL H . . 4.480 4.305 4.040 4.432 . 0 0 "[ . 1 . 2]" 1
656 1 46 LEU HB2 1 46 LEU MD1 . . 2.790 2.235 2.127 2.341 . 0 0 "[ . 1 . 2]" 1
657 1 46 LEU HB2 1 47 SER H . . 3.970 2.725 2.610 2.848 . 0 0 "[ . 1 . 2]" 1
658 1 46 LEU HB3 1 46 LEU MD1 . . 3.070 2.440 2.330 2.524 . 0 0 "[ . 1 . 2]" 1
659 1 46 LEU HB3 1 47 SER H . . 4.240 3.389 3.210 3.525 . 0 0 "[ . 1 . 2]" 1
660 1 46 LEU HB3 1 81 PHE QD . . 4.270 2.760 2.363 3.069 . 0 0 "[ . 1 . 2]" 1
661 1 46 LEU MD1 1 47 SER H . . 4.730 4.542 4.389 4.661 . 0 0 "[ . 1 . 2]" 1
662 1 46 LEU MD1 1 78 VAL HA . . 3.990 3.441 2.987 3.736 . 0 0 "[ . 1 . 2]" 1
663 1 46 LEU MD1 1 78 VAL MG1 . . 3.890 2.424 1.966 2.769 . 0 0 "[ . 1 . 2]" 1
664 1 46 LEU MD1 1 78 VAL MG2 . . 3.890 2.614 2.226 2.989 . 0 0 "[ . 1 . 2]" 1
665 1 46 LEU MD1 1 81 PHE QD . . 3.190 2.704 2.248 3.035 . 0 0 "[ . 1 . 2]" 1
666 1 46 LEU MD1 1 96 PHE QE . . 3.890 3.819 3.570 3.904 0.014 4 0 "[ . 1 . 2]" 1
667 1 46 LEU MD1 1 96 PHE HZ . . 3.210 2.927 2.631 3.076 . 0 0 "[ . 1 . 2]" 1
668 1 46 LEU MD2 1 47 SER H . . 4.800 4.734 4.627 4.798 . 0 0 "[ . 1 . 2]" 1
669 1 46 LEU MD2 1 49 LEU H . . 5.040 4.714 4.595 4.854 . 0 0 "[ . 1 . 2]" 1
670 1 46 LEU MD2 1 49 LEU HB3 . . 3.610 3.545 3.332 3.614 0.004 6 0 "[ . 1 . 2]" 1
671 1 46 LEU MD2 1 49 LEU MD2 . . 3.430 2.683 2.486 2.883 . 0 0 "[ . 1 . 2]" 1
672 1 46 LEU MD2 1 81 PHE QD . . 3.730 3.493 3.216 3.695 . 0 0 "[ . 1 . 2]" 1
673 1 46 LEU MD2 1 81 PHE HZ . . 3.890 2.848 2.409 3.253 . 0 0 "[ . 1 . 2]" 1
674 1 46 LEU MD2 1 114 LEU MD1 . . 3.360 3.106 2.875 3.367 0.007 3 0 "[ . 1 . 2]" 1
675 1 46 LEU MD2 1 114 LEU MD2 . . 2.840 2.314 1.992 2.795 . 0 0 "[ . 1 . 2]" 1
676 1 46 LEU HG 1 47 SER H . . 4.780 4.714 4.534 4.786 0.006 10 0 "[ . 1 . 2]" 1
677 1 47 SER H 1 47 SER QB . . 3.560 2.369 2.279 2.483 . 0 0 "[ . 1 . 2]" 1
678 1 47 SER H 1 48 LYS H . . 3.670 2.673 2.571 2.787 . 0 0 "[ . 1 . 2]" 1
679 1 47 SER H 1 49 LEU H . . 4.980 4.081 3.959 4.323 . 0 0 "[ . 1 . 2]" 1
680 1 47 SER H 1 50 VAL MG1 . . 5.190 4.365 4.056 4.818 . 0 0 "[ . 1 . 2]" 1
681 1 47 SER H 1 61 VAL QG . . 4.620 4.298 4.150 4.439 . 0 0 "[ . 1 . 2]" 1
682 1 47 SER HA 1 50 VAL H . . 4.480 3.892 3.674 4.046 . 0 0 "[ . 1 . 2]" 1
683 1 47 SER HA 1 50 VAL MG1 . . 2.830 2.221 1.968 2.540 . 0 0 "[ . 1 . 2]" 1
684 1 47 SER HA 1 61 VAL QG . . 3.510 2.897 2.655 3.071 . 0 0 "[ . 1 . 2]" 1
685 1 47 SER QB 1 48 LYS H . . 3.910 3.029 2.509 3.536 . 0 0 "[ . 1 . 2]" 1
686 1 47 SER QB 1 61 VAL HB . . 3.890 2.921 2.618 3.250 . 0 0 "[ . 1 . 2]" 1
687 1 47 SER QB 1 61 VAL QG . . 3.470 1.948 1.787 2.315 . 0 0 "[ . 1 . 2]" 1
688 1 47 SER QB 1 63 VAL QG . . 3.190 2.552 1.949 2.977 . 0 0 "[ . 1 . 2]" 1
689 1 48 LYS H 1 48 LYS HB2 . . 3.600 2.199 2.115 2.310 . 0 0 "[ . 1 . 2]" 1
690 1 48 LYS H 1 48 LYS HB3 . . 3.890 3.473 3.421 3.517 . 0 0 "[ . 1 . 2]" 1
691 1 48 LYS H 1 48 LYS HD2 . . 4.360 3.922 3.479 4.186 . 0 0 "[ . 1 . 2]" 1
692 1 48 LYS H 1 48 LYS HG2 . . 4.120 3.877 3.659 4.044 . 0 0 "[ . 1 . 2]" 1
693 1 48 LYS H 1 48 LYS HG3 . . 3.700 2.696 2.386 2.928 . 0 0 "[ . 1 . 2]" 1
694 1 48 LYS H 1 49 LEU H . . 3.640 2.597 2.421 2.750 . 0 0 "[ . 1 . 2]" 1
695 1 48 LYS H 1 49 LEU HB2 . . 4.920 4.729 4.525 4.899 . 0 0 "[ . 1 . 2]" 1
696 1 48 LYS H 1 63 VAL QG . . 4.120 3.320 3.027 3.514 . 0 0 "[ . 1 . 2]" 1
697 1 48 LYS HA 1 48 LYS HG2 . . 3.300 2.431 2.325 2.626 . 0 0 "[ . 1 . 2]" 1
698 1 48 LYS HA 1 48 LYS HG3 . . 3.560 2.634 2.437 2.833 . 0 0 "[ . 1 . 2]" 1
699 1 48 LYS HA 1 51 ASN H . . 3.730 3.637 3.452 3.723 . 0 0 "[ . 1 . 2]" 1
700 1 48 LYS HA 1 51 ASN HB2 . . 3.470 2.233 2.012 2.364 . 0 0 "[ . 1 . 2]" 1
701 1 48 LYS HA 1 51 ASN HB3 . . 3.730 3.426 3.200 3.649 . 0 0 "[ . 1 . 2]" 1
702 1 48 LYS HA 1 51 ASN HD21 . . 3.890 3.112 2.743 3.787 . 0 0 "[ . 1 . 2]" 1
703 1 48 LYS HA 1 51 ASN HD22 . . 4.920 4.492 4.191 4.915 . 0 0 "[ . 1 . 2]" 1
704 1 48 LYS HA 1 63 VAL QG . . 3.810 2.662 2.348 2.999 . 0 0 "[ . 1 . 2]" 1
705 1 48 LYS HB2 1 48 LYS HD2 . . 3.890 2.683 2.446 2.892 . 0 0 "[ . 1 . 2]" 1
706 1 48 LYS HB2 1 48 LYS HD3 . . 3.890 2.723 2.453 2.988 . 0 0 "[ . 1 . 2]" 1
707 1 48 LYS HB2 1 49 LEU H . . 3.870 2.981 2.761 3.089 . 0 0 "[ . 1 . 2]" 1
708 1 48 LYS HB3 1 48 LYS HD2 . . 3.890 3.392 3.152 3.622 . 0 0 "[ . 1 . 2]" 1
709 1 48 LYS HB3 1 48 LYS HD3 . . 3.130 2.501 2.354 2.713 . 0 0 "[ . 1 . 2]" 1
710 1 48 LYS HB3 1 48 LYS HG2 . . 2.920 2.454 2.371 2.510 . 0 0 "[ . 1 . 2]" 1
711 1 48 LYS HB3 1 49 LEU H . . 4.390 3.617 3.325 3.814 . 0 0 "[ . 1 . 2]" 1
712 1 48 LYS HD2 1 63 VAL QG . . 3.330 3.137 2.965 3.265 . 0 0 "[ . 1 . 2]" 1
713 1 48 LYS HE2 1 63 VAL QG . . 3.560 2.069 1.834 2.642 . 0 0 "[ . 1 . 2]" 1
714 1 48 LYS HE3 1 48 LYS HG2 . . 3.990 3.609 3.349 3.762 . 0 0 "[ . 1 . 2]" 1
715 1 48 LYS HE3 1 63 VAL QG . . 3.560 3.011 1.974 3.279 . 0 0 "[ . 1 . 2]" 1
716 1 48 LYS HG2 1 63 VAL QG . . 3.810 2.362 1.940 2.774 . 0 0 "[ . 1 . 2]" 1
717 1 48 LYS HG3 1 49 LEU H . . 4.920 4.757 4.596 4.883 . 0 0 "[ . 1 . 2]" 1
718 1 48 LYS HG3 1 63 VAL QG . . 3.330 1.948 1.806 2.178 . 0 0 "[ . 1 . 2]" 1
719 1 49 LEU H 1 49 LEU HB2 . . 3.400 2.324 2.294 2.355 . 0 0 "[ . 1 . 2]" 1
720 1 49 LEU H 1 49 LEU HB3 . . 3.440 2.552 2.520 2.584 . 0 0 "[ . 1 . 2]" 1
721 1 49 LEU H 1 49 LEU MD1 . . 3.810 3.856 3.838 3.877 0.067 13 0 "[ . 1 . 2]" 1
722 1 49 LEU H 1 49 LEU MD2 . . 4.160 4.158 4.143 4.173 0.013 16 0 "[ . 1 . 2]" 1
723 1 49 LEU H 1 49 LEU HG . . 4.270 4.452 4.441 4.463 0.193 15 0 "[ . 1 . 2]" 1
724 1 49 LEU H 1 50 VAL H . . 3.870 3.073 2.979 3.128 . 0 0 "[ . 1 . 2]" 1
725 1 49 LEU H 1 50 VAL MG1 . . 4.730 3.830 3.677 4.147 . 0 0 "[ . 1 . 2]" 1
726 1 49 LEU HA 1 49 LEU MD1 . . 3.020 2.130 1.981 2.309 . 0 0 "[ . 1 . 2]" 1
727 1 49 LEU HA 1 49 LEU MD2 . . 3.950 3.891 3.860 3.907 . 0 0 "[ . 1 . 2]" 1
728 1 49 LEU HA 1 49 LEU HG . . 4.120 2.921 2.815 3.080 . 0 0 "[ . 1 . 2]" 1
729 1 49 LEU HA 1 51 ASN H . . 4.550 4.474 4.209 4.599 0.049 13 0 "[ . 1 . 2]" 1
730 1 49 LEU HA 1 52 SER H . . 3.990 3.475 3.287 3.622 . 0 0 "[ . 1 . 2]" 1
731 1 49 LEU HA 1 52 SER HG . . 3.470 2.257 1.993 2.839 . 0 0 "[ . 1 . 2]" 1
732 1 49 LEU HB2 1 49 LEU MD1 . . 3.670 2.290 2.196 2.368 . 0 0 "[ . 1 . 2]" 1
733 1 49 LEU HB2 1 49 LEU MD2 . . 3.470 2.502 2.402 2.601 . 0 0 "[ . 1 . 2]" 1
734 1 49 LEU HB2 1 50 VAL H . . 3.570 3.563 3.533 3.598 0.028 14 0 "[ . 1 . 2]" 1
735 1 49 LEU HB3 1 49 LEU MD2 . . 3.110 2.151 2.058 2.244 . 0 0 "[ . 1 . 2]" 1
736 1 49 LEU HB3 1 50 VAL H . . 3.180 2.048 2.017 2.093 . 0 0 "[ . 1 . 2]" 1
737 1 49 LEU MD1 1 50 VAL H . . 4.480 4.394 4.258 4.484 0.004 9 0 "[ . 1 . 2]" 1
738 1 49 LEU MD1 1 52 SER H . . 5.040 4.995 4.771 5.073 0.033 7 0 "[ . 1 . 2]" 1
739 1 49 LEU MD1 1 52 SER HG . . 3.730 3.205 2.916 3.510 . 0 0 "[ . 1 . 2]" 1
740 1 49 LEU MD2 1 50 VAL H . . 4.270 3.607 3.429 3.746 . 0 0 "[ . 1 . 2]" 1
741 1 49 LEU HG 1 50 VAL H . . 4.480 3.391 3.248 3.534 . 0 0 "[ . 1 . 2]" 1
742 1 50 VAL H 1 50 VAL HB . . 3.300 2.296 2.116 2.440 . 0 0 "[ . 1 . 2]" 1
743 1 50 VAL H 1 50 VAL MG1 . . 2.960 2.214 1.956 2.570 . 0 0 "[ . 1 . 2]" 1
744 1 50 VAL H 1 50 VAL MG2 . . 3.810 3.674 3.582 3.703 . 0 0 "[ . 1 . 2]" 1
745 1 50 VAL H 1 51 ASN H . . 3.610 2.953 2.856 3.019 . 0 0 "[ . 1 . 2]" 1
746 1 50 VAL H 1 51 ASN HB2 . . 5.190 4.736 4.651 4.857 . 0 0 "[ . 1 . 2]" 1
747 1 50 VAL H 1 81 PHE QD . . 4.360 3.580 2.991 3.976 . 0 0 "[ . 1 . 2]" 1
748 1 50 VAL HA 1 50 VAL MG2 . . 2.820 2.249 2.064 2.349 . 0 0 "[ . 1 . 2]" 1
749 1 50 VAL HA 1 53 LEU H . . 3.990 3.500 3.357 3.599 . 0 0 "[ . 1 . 2]" 1
750 1 50 VAL HA 1 53 LEU MD1 . . 3.090 2.188 1.929 2.828 . 0 0 "[ . 1 . 2]" 1
751 1 50 VAL HA 1 53 LEU HG . . 3.510 3.139 2.827 3.506 . 0 0 "[ . 1 . 2]" 1
752 1 50 VAL HB 1 51 ASN H . . 4.270 3.860 3.705 3.985 . 0 0 "[ . 1 . 2]" 1
753 1 50 VAL HB 1 81 PHE QD . . 3.240 2.184 1.994 2.530 . 0 0 "[ . 1 . 2]" 1
754 1 50 VAL MG1 1 51 ASN H . . 3.170 1.934 1.860 2.166 . 0 0 "[ . 1 . 2]" 1
755 1 50 VAL MG1 1 52 SER H . . 5.040 4.325 4.111 4.522 . 0 0 "[ . 1 . 2]" 1
756 1 50 VAL MG1 1 60 PRO HG2 . . 3.810 3.038 2.629 3.550 . 0 0 "[ . 1 . 2]" 1
757 1 50 VAL MG1 1 61 VAL H . . 4.690 3.516 3.157 3.966 . 0 0 "[ . 1 . 2]" 1
758 1 50 VAL MG1 1 61 VAL QG . . 2.940 2.191 1.937 2.403 . 0 0 "[ . 1 . 2]" 1
759 1 50 VAL MG1 1 81 PHE QD . . 3.050 2.325 1.890 2.663 . 0 0 "[ . 1 . 2]" 1
760 1 50 VAL MG2 1 51 ASN H . . 4.270 3.677 3.492 4.016 . 0 0 "[ . 1 . 2]" 1
761 1 50 VAL MG2 1 53 LEU MD1 . . 3.300 3.025 2.539 3.298 . 0 0 "[ . 1 . 2]" 1
762 1 50 VAL MG2 1 54 TYR QD . . 3.700 2.229 1.987 2.544 . 0 0 "[ . 1 . 2]" 1
763 1 50 VAL MG2 1 54 TYR QE . . 2.900 2.044 1.868 2.525 . 0 0 "[ . 1 . 2]" 1
764 1 50 VAL MG2 1 81 PHE QD . . 3.460 3.063 2.384 3.467 0.007 13 0 "[ . 1 . 2]" 1
765 1 50 VAL MG2 1 84 ALA H . . 5.190 4.736 4.292 5.084 . 0 0 "[ . 1 . 2]" 1
766 1 50 VAL MG2 1 84 ALA MB . . 3.110 2.048 1.800 2.350 . 0 0 "[ . 1 . 2]" 1
767 1 50 VAL MG2 1 85 ALA H . . 3.890 3.764 3.333 3.913 0.023 7 0 "[ . 1 . 2]" 1
768 1 50 VAL MG2 1 85 ALA HA . . 3.190 3.122 2.871 3.198 0.008 17 0 "[ . 1 . 2]" 1
769 1 51 ASN H 1 51 ASN HB2 . . 3.300 2.115 2.059 2.180 . 0 0 "[ . 1 . 2]" 1
770 1 51 ASN H 1 51 ASN HB3 . . 3.470 3.416 3.352 3.468 . 0 0 "[ . 1 . 2]" 1
771 1 51 ASN H 1 61 VAL QG . . 4.660 4.336 4.174 4.408 . 0 0 "[ . 1 . 2]" 1
772 1 51 ASN HA 1 53 LEU H . . 4.870 4.350 3.981 4.684 . 0 0 "[ . 1 . 2]" 1
773 1 51 ASN HA 1 54 TYR H . . 4.660 3.980 3.608 4.241 . 0 0 "[ . 1 . 2]" 1
774 1 51 ASN HA 1 54 TYR QD . . 3.610 3.389 3.029 3.620 0.010 13 0 "[ . 1 . 2]" 1
775 1 51 ASN HA 1 60 PRO HD2 . . 3.510 2.752 2.589 2.923 . 0 0 "[ . 1 . 2]" 1
776 1 51 ASN HA 1 60 PRO HD3 . . 3.810 3.785 3.588 3.834 0.024 6 0 "[ . 1 . 2]" 1
777 1 51 ASN HB2 1 51 ASN HD21 . . 3.610 2.192 2.102 2.320 . 0 0 "[ . 1 . 2]" 1
778 1 51 ASN HB2 1 52 SER H . . 4.040 2.648 2.562 2.853 . 0 0 "[ . 1 . 2]" 1
779 1 51 ASN HB2 1 53 LEU H . . 5.190 5.119 4.895 5.208 0.018 16 0 "[ . 1 . 2]" 1
780 1 51 ASN HB3 1 51 ASN HD21 . . 3.560 3.403 3.215 3.521 . 0 0 "[ . 1 . 2]" 1
781 1 51 ASN HB3 1 52 SER H . . 4.320 2.828 2.611 3.165 . 0 0 "[ . 1 . 2]" 1
782 1 51 ASN HD21 1 61 VAL H . . 4.490 4.182 3.607 4.499 0.009 7 0 "[ . 1 . 2]" 1
783 1 51 ASN HD21 1 61 VAL HB . . 3.990 2.729 2.222 3.076 . 0 0 "[ . 1 . 2]" 1
784 1 51 ASN HD21 1 61 VAL QG . . 4.980 3.303 3.062 3.551 . 0 0 "[ . 1 . 2]" 1
785 1 51 ASN HD21 1 63 VAL QG . . 3.220 2.695 2.163 3.194 . 0 0 "[ . 1 . 2]" 1
786 1 51 ASN HD22 1 61 VAL H . . 3.860 3.227 2.920 3.469 . 0 0 "[ . 1 . 2]" 1
787 1 51 ASN HD22 1 61 VAL HB . . 3.560 2.121 1.948 2.508 . 0 0 "[ . 1 . 2]" 1
788 1 51 ASN HD22 1 61 VAL QG . . 3.990 2.862 2.401 3.346 . 0 0 "[ . 1 . 2]" 1
789 1 51 ASN HD22 1 63 VAL QG . . 3.240 2.640 2.176 3.000 . 0 0 "[ . 1 . 2]" 1
790 1 52 SER H 1 52 SER HB2 . . 3.730 3.374 3.069 3.551 . 0 0 "[ . 1 . 2]" 1
791 1 52 SER H 1 52 SER HB3 . . 3.450 2.559 2.114 3.432 . 0 0 "[ . 1 . 2]" 1
792 1 52 SER H 1 52 SER HG . . 3.430 2.589 1.953 3.147 . 0 0 "[ . 1 . 2]" 1
793 1 52 SER H 1 53 LEU H . . 3.670 2.968 2.802 3.072 . 0 0 "[ . 1 . 2]" 1
794 1 52 SER H 1 53 LEU HG . . 4.590 4.549 4.412 4.632 0.042 7 0 "[ . 1 . 2]" 1
795 1 52 SER HA 1 52 SER HG . . 3.990 3.773 3.532 3.990 . 0 0 "[ . 1 . 2]" 1
796 1 52 SER HG 1 53 LEU H . . 4.180 2.728 2.073 3.343 . 0 0 "[ . 1 . 2]" 1
797 1 52 SER HG 1 53 LEU HG . . 4.120 3.117 2.405 4.111 . 0 0 "[ . 1 . 2]" 1
798 1 53 LEU H 1 53 LEU HB2 . . 3.550 2.500 2.366 2.574 . 0 0 "[ . 1 . 2]" 1
799 1 53 LEU H 1 53 LEU HB3 . . 3.940 3.537 3.521 3.565 . 0 0 "[ . 1 . 2]" 1
800 1 53 LEU H 1 53 LEU MD1 . . 3.890 3.450 3.256 3.607 . 0 0 "[ . 1 . 2]" 1
801 1 53 LEU H 1 53 LEU MD2 . . 3.810 3.258 2.945 3.561 . 0 0 "[ . 1 . 2]" 1
802 1 53 LEU H 1 53 LEU HG . . 3.530 2.089 1.949 2.307 . 0 0 "[ . 1 . 2]" 1
803 1 53 LEU H 1 54 TYR H . . 3.270 3.173 2.864 3.288 0.018 7 0 "[ . 1 . 2]" 1
804 1 53 LEU H 1 54 TYR HB2 . . 4.980 4.579 4.195 4.794 . 0 0 "[ . 1 . 2]" 1
805 1 53 LEU HA 1 53 LEU MD2 . . 3.010 2.207 1.985 2.487 . 0 0 "[ . 1 . 2]" 1
806 1 53 LEU HA 1 53 LEU HG . . 4.120 3.067 2.887 3.246 . 0 0 "[ . 1 . 2]" 1
807 1 53 LEU HA 1 128 ASN HB2 . . 3.730 3.306 2.014 3.743 0.013 3 0 "[ . 1 . 2]" 1
808 1 53 LEU HA 1 128 ASN HB3 . . 3.470 2.518 1.992 3.697 0.227 11 0 "[ . 1 . 2]" 1
809 1 53 LEU HB2 1 53 LEU MD1 . . 2.830 2.253 2.138 2.399 . 0 0 "[ . 1 . 2]" 1
810 1 53 LEU HB2 1 54 TYR H . . 4.470 1.986 1.922 2.177 . 0 0 "[ . 1 . 2]" 1
811 1 53 LEU HB2 1 54 TYR QD . . 3.530 3.248 2.896 3.528 . 0 0 "[ . 1 . 2]" 1
812 1 53 LEU HB3 1 53 LEU MD1 . . 3.360 2.472 2.335 2.594 . 0 0 "[ . 1 . 2]" 1
813 1 53 LEU HB3 1 53 LEU MD2 . . 3.430 2.286 2.135 2.411 . 0 0 "[ . 1 . 2]" 1
814 1 53 LEU HB3 1 54 TYR H . . 4.480 2.972 2.789 3.278 . 0 0 "[ . 1 . 2]" 1
815 1 53 LEU HB3 1 88 TYR QE . . 3.990 2.871 2.083 3.467 . 0 0 "[ . 1 . 2]" 1
816 1 53 LEU MD1 1 88 TYR QE . . 3.350 2.865 2.180 3.365 0.015 7 0 "[ . 1 . 2]" 1
817 1 53 LEU MD1 1 117 LEU HG . . 3.670 2.752 2.310 3.156 . 0 0 "[ . 1 . 2]" 1
818 1 53 LEU MD2 1 54 TYR H . . 4.780 4.490 4.407 4.602 . 0 0 "[ . 1 . 2]" 1
819 1 53 LEU MD2 1 128 ASN HB3 . . 3.990 2.927 1.989 4.620 0.630 9 1 "[ . +1 . 2]" 1
820 1 53 LEU MD2 1 129 TYR H . . 4.480 3.718 3.057 4.518 0.038 9 0 "[ . 1 . 2]" 1
821 1 53 LEU HG 1 54 TYR H . . 4.730 4.196 4.060 4.396 . 0 0 "[ . 1 . 2]" 1
822 1 54 TYR H 1 54 TYR HB2 . . 3.480 2.270 2.149 2.405 . 0 0 "[ . 1 . 2]" 1
823 1 54 TYR H 1 54 TYR HB3 . . 3.770 3.467 3.420 3.493 . 0 0 "[ . 1 . 2]" 1
824 1 54 TYR H 1 54 TYR QD . . 3.350 2.358 2.056 2.638 . 0 0 "[ . 1 . 2]" 1
825 1 54 TYR H 1 54 TYR QE . . 4.450 4.368 4.233 4.496 0.046 13 0 "[ . 1 . 2]" 1
826 1 54 TYR H 1 55 PRO HD3 . . 4.470 4.587 4.489 4.655 0.185 14 0 "[ . 1 . 2]" 1
827 1 54 TYR H 1 128 ASN HB3 . . 5.110 4.915 4.447 5.301 0.191 11 0 "[ . 1 . 2]" 1
828 1 54 TYR HB3 1 55 PRO HD2 . . 3.430 2.619 2.336 3.099 . 0 0 "[ . 1 . 2]" 1
829 1 54 TYR HB3 1 58 SER HB2 . . 3.890 3.487 2.831 3.897 0.007 15 0 "[ . 1 . 2]" 1
830 1 54 TYR HB3 1 58 SER HB3 . . 3.990 2.627 1.997 3.984 . 0 0 "[ . 1 . 2]" 1
831 1 54 TYR QD 1 55 PRO HD2 . . 3.080 2.406 2.151 2.686 . 0 0 "[ . 1 . 2]" 1
832 1 54 TYR QD 1 58 SER HB2 . . 3.890 3.380 2.667 3.795 . 0 0 "[ . 1 . 2]" 1
833 1 54 TYR QD 1 58 SER HB3 . . 3.460 2.643 2.110 3.346 . 0 0 "[ . 1 . 2]" 1
834 1 54 TYR QD 1 60 PRO HD2 . . 3.990 3.640 2.901 3.889 . 0 0 "[ . 1 . 2]" 1
835 1 54 TYR QD 1 60 PRO HD3 . . 3.990 3.137 2.642 3.420 . 0 0 "[ . 1 . 2]" 1
836 1 54 TYR QD 1 60 PRO HG3 . . 4.120 2.831 2.483 3.171 . 0 0 "[ . 1 . 2]" 1
837 1 54 TYR QE 1 60 PRO HG2 . . 3.610 3.458 3.194 3.623 0.013 11 0 "[ . 1 . 2]" 1
838 1 54 TYR QE 1 60 PRO HG3 . . 3.460 2.848 2.540 3.026 . 0 0 "[ . 1 . 2]" 1
839 1 55 PRO HA 1 56 GLU H . . 3.100 2.567 2.283 2.783 . 0 0 "[ . 1 . 2]" 1
840 1 55 PRO HB2 1 56 GLU H . . 3.810 2.418 1.947 3.129 . 0 0 "[ . 1 . 2]" 1
841 1 55 PRO HB3 1 56 GLU H . . 3.890 3.279 3.100 3.627 . 0 0 "[ . 1 . 2]" 1
842 1 55 PRO HG2 1 58 SER H . . 4.440 4.234 3.777 4.486 0.046 12 0 "[ . 1 . 2]" 1
843 1 55 PRO HG2 1 58 SER HB2 . . 3.470 2.452 1.987 3.303 . 0 0 "[ . 1 . 2]" 1
844 1 55 PRO HG2 1 58 SER HB3 . . 3.810 3.682 3.452 3.821 0.011 15 0 "[ . 1 . 2]" 1
845 1 56 GLU H 1 56 GLU QB . . 3.000 2.275 2.003 2.793 . 0 0 "[ . 1 . 2]" 1
846 1 56 GLU H 1 56 GLU QG . . 3.510 2.638 1.882 3.477 . 0 0 "[ . 1 . 2]" 1
847 1 56 GLU H 1 59 LYS QE . . 4.480 4.275 3.841 4.502 0.022 5 0 "[ . 1 . 2]" 1
848 1 56 GLU HA 1 58 SER H . . 4.300 3.528 3.202 3.828 . 0 0 "[ . 1 . 2]" 1
849 1 56 GLU HA 1 59 LYS HD3 . . 3.890 2.532 1.986 3.451 . 0 0 "[ . 1 . 2]" 1
850 1 56 GLU HA 1 59 LYS QE . . 3.300 2.044 1.921 2.188 . 0 0 "[ . 1 . 2]" 1
851 1 56 GLU QB 1 58 SER H . . 4.470 4.491 4.414 4.586 0.116 6 0 "[ . 1 . 2]" 1
852 1 57 GLY H 1 58 SER H . . 4.620 3.098 2.685 3.531 . 0 0 "[ . 1 . 2]" 1
853 1 58 SER H 1 58 SER HB2 . . 3.450 2.722 2.126 3.080 . 0 0 "[ . 1 . 2]" 1
854 1 58 SER H 1 58 SER HB3 . . 3.890 3.202 2.337 3.952 0.062 11 0 "[ . 1 . 2]" 1
855 1 58 SER H 1 59 LYS H . . 3.580 2.509 1.955 3.352 . 0 0 "[ . 1 . 2]" 1
856 1 58 SER H 1 59 LYS HB2 . . 5.040 4.023 3.345 5.532 0.492 12 0 "[ . 1 . 2]" 1
857 1 58 SER H 1 59 LYS HD2 . . 4.520 3.347 2.785 4.450 . 0 0 "[ . 1 . 2]" 1
858 1 58 SER H 1 59 LYS HD3 . . 4.520 3.416 2.452 3.972 . 0 0 "[ . 1 . 2]" 1
859 1 58 SER H 1 59 LYS QE . . 5.040 4.554 3.878 4.782 . 0 0 "[ . 1 . 2]" 1
860 1 58 SER HB2 1 59 LYS H . . 4.360 3.587 2.068 4.399 0.039 13 0 "[ . 1 . 2]" 1
861 1 59 LYS H 1 59 LYS HB2 . . 3.400 2.799 2.054 3.516 0.116 12 0 "[ . 1 . 2]" 1
862 1 59 LYS H 1 59 LYS HB3 . . 3.990 3.644 2.814 3.982 . 0 0 "[ . 1 . 2]" 1
863 1 59 LYS H 1 59 LYS HD2 . . 3.680 2.559 1.949 3.530 . 0 0 "[ . 1 . 2]" 1
864 1 59 LYS H 1 59 LYS HD3 . . 3.600 3.066 1.918 3.603 0.003 14 0 "[ . 1 . 2]" 1
865 1 59 LYS H 1 60 PRO HD3 . . 4.870 3.418 2.723 4.322 . 0 0 "[ . 1 . 2]" 1
866 1 59 LYS HA 1 59 LYS HD2 . . 3.890 2.918 2.564 3.916 0.026 5 0 "[ . 1 . 2]" 1
867 1 59 LYS HA 1 59 LYS HD3 . . 3.990 3.788 2.928 4.097 0.107 5 0 "[ . 1 . 2]" 1
868 1 59 LYS HA 1 60 PRO HD2 . . 3.240 2.204 2.180 2.233 . 0 0 "[ . 1 . 2]" 1
869 1 59 LYS HA 1 60 PRO HD3 . . 3.040 2.187 1.993 2.370 . 0 0 "[ . 1 . 2]" 1
870 1 59 LYS HB2 1 59 LYS HD3 . . 3.170 2.575 2.084 4.019 0.849 12 2 "[ - 1 + . 2]" 1
871 1 60 PRO HB2 1 61 VAL QG . . 3.890 2.815 2.705 2.977 . 0 0 "[ . 1 . 2]" 1
872 1 60 PRO HB2 1 84 ALA MB . . 3.300 2.352 1.994 3.094 . 0 0 "[ . 1 . 2]" 1
873 1 60 PRO HD2 1 61 VAL H . . 4.120 2.467 2.285 2.739 . 0 0 "[ . 1 . 2]" 1
874 1 60 PRO HD3 1 61 VAL H . . 4.440 3.821 3.699 3.994 . 0 0 "[ . 1 . 2]" 1
875 1 60 PRO HG2 1 61 VAL H . . 3.630 2.407 2.216 2.664 . 0 0 "[ . 1 . 2]" 1
876 1 60 PRO HG2 1 61 VAL QG . . 3.070 2.867 2.650 3.050 . 0 0 "[ . 1 . 2]" 1
877 1 60 PRO HG3 1 61 VAL H . . 3.950 3.811 3.685 3.972 0.022 7 0 "[ . 1 . 2]" 1
878 1 61 VAL H 1 61 VAL HB . . 3.270 2.418 2.361 2.465 . 0 0 "[ . 1 . 2]" 1
879 1 61 VAL H 1 61 VAL QG . . 3.190 2.350 2.087 2.555 . 0 0 "[ . 1 . 2]" 1
880 1 61 VAL HA 1 61 VAL QG . . 2.650 2.078 2.057 2.108 . 0 0 "[ . 1 . 2]" 1
881 1 61 VAL HA 1 62 LYS H . . 2.860 2.437 2.322 2.521 . 0 0 "[ . 1 . 2]" 1
882 1 61 VAL HB 1 62 LYS H . . 4.820 3.705 3.525 3.929 . 0 0 "[ . 1 . 2]" 1
883 1 61 VAL QG 1 62 LYS H . . 3.300 1.901 1.786 2.129 . 0 0 "[ . 1 . 2]" 1
884 1 61 VAL QG 1 77 GLN HE21 . . 3.190 3.067 2.266 4.150 0.960 15 1 "[ . 1 + 2]" 1
885 1 61 VAL QG 1 80 GLN H . . 5.110 4.129 3.786 4.540 . 0 0 "[ . 1 . 2]" 1
886 1 61 VAL QG 1 80 GLN HB2 . . 3.730 2.386 2.024 2.795 . 0 0 "[ . 1 . 2]" 1
887 1 61 VAL QG 1 80 GLN HB3 . . 3.300 2.021 1.802 2.464 . 0 0 "[ . 1 . 2]" 1
888 1 61 VAL QG 1 81 PHE H . . 3.990 3.018 2.636 3.400 . 0 0 "[ . 1 . 2]" 1
889 1 61 VAL QG 1 81 PHE HA . . 3.090 2.080 1.856 2.267 . 0 0 "[ . 1 . 2]" 1
890 1 61 VAL QG 1 84 ALA H . . 3.890 3.695 3.362 3.834 . 0 0 "[ . 1 . 2]" 1
891 1 61 VAL QG 1 84 ALA MB . . 2.660 2.150 1.816 2.481 . 0 0 "[ . 1 . 2]" 1
892 1 62 LYS H 1 62 LYS QB . . 3.090 2.502 2.366 2.629 . 0 0 "[ . 1 . 2]" 1
893 1 62 LYS H 1 62 LYS QG . . 4.270 3.386 2.953 3.921 . 0 0 "[ . 1 . 2]" 1
894 1 62 LYS HA 1 62 LYS QD . . 3.810 3.496 2.865 3.722 . 0 0 "[ . 1 . 2]" 1
895 1 62 LYS HA 1 62 LYS QG . . 3.810 2.215 2.037 2.654 . 0 0 "[ . 1 . 2]" 1
896 1 62 LYS HA 1 63 VAL H . . 2.820 2.209 2.176 2.233 . 0 0 "[ . 1 . 2]" 1
897 1 62 LYS HA 1 63 VAL QG . . 3.810 3.568 3.254 3.729 . 0 0 "[ . 1 . 2]" 1
898 1 62 LYS QB 1 63 VAL H . . 3.730 3.708 3.558 3.773 0.043 17 0 "[ . 1 . 2]" 1
899 1 62 LYS QG 1 63 VAL H . . 4.480 4.012 2.436 4.297 . 0 0 "[ . 1 . 2]" 1
900 1 63 VAL H 1 63 VAL HB . . 3.240 2.738 2.348 3.257 0.017 3 0 "[ . 1 . 2]" 1
901 1 63 VAL H 1 63 VAL QG . . 3.300 2.062 1.863 2.543 . 0 0 "[ . 1 . 2]" 1
902 1 63 VAL H 1 64 PRO HD2 . . 4.920 4.980 4.901 5.024 0.104 7 0 "[ . 1 . 2]" 1
903 1 63 VAL H 1 64 PRO HD3 . . 5.110 4.314 4.125 4.455 . 0 0 "[ . 1 . 2]" 1
904 1 63 VAL HA 1 63 VAL QG . . 3.050 2.225 2.034 2.474 . 0 0 "[ . 1 . 2]" 1
905 1 63 VAL HA 1 64 PRO HD2 . . 2.940 2.253 2.207 2.344 . 0 0 "[ . 1 . 2]" 1
906 1 63 VAL HA 1 64 PRO HD3 . . 2.920 1.990 1.926 2.046 . 0 0 "[ . 1 . 2]" 1
907 1 63 VAL HA 1 77 GLN HE21 . . 4.270 3.504 2.596 4.259 . 0 0 "[ . 1 . 2]" 1
908 1 63 VAL HA 1 77 GLN HE22 . . 3.810 3.100 2.134 3.819 0.009 5 0 "[ . 1 . 2]" 1
909 1 63 VAL QG 1 64 PRO HD2 . . 3.010 2.352 1.972 2.498 . 0 0 "[ . 1 . 2]" 1
910 1 63 VAL QG 1 64 PRO HD3 . . 3.510 3.315 3.115 3.442 . 0 0 "[ . 1 . 2]" 1
911 1 64 PRO HA 1 65 GLU H . . 3.420 2.542 2.199 3.241 . 0 0 "[ . 1 . 2]" 1
912 1 64 PRO HA 1 66 ASN H . . 4.920 4.646 4.283 4.925 0.005 4 0 "[ . 1 . 2]" 1
913 1 64 PRO HB2 1 65 GLU H . . 4.100 2.958 2.220 4.118 0.018 2 0 "[ . 1 . 2]" 1
914 1 64 PRO HB2 1 66 ASN H . . 4.480 3.112 2.419 3.663 . 0 0 "[ . 1 . 2]" 1
915 1 64 PRO HD3 1 77 GLN HE22 . . 3.810 2.754 2.063 3.912 0.102 15 0 "[ . 1 . 2]" 1
916 1 65 GLU H 1 65 GLU QB . . 3.430 2.212 1.998 3.142 . 0 0 "[ . 1 . 2]" 1
917 1 65 GLU H 1 66 ASN H . . 4.340 3.013 2.560 3.893 . 0 0 "[ . 1 . 2]" 1
918 1 65 GLU HA 1 65 GLU QB . . 2.690 2.556 2.504 2.566 . 0 0 "[ . 1 . 2]" 1
919 1 65 GLU HA 1 65 GLU HG3 . . 3.360 2.609 2.083 3.549 0.189 9 0 "[ . 1 . 2]" 1
920 1 65 GLU QB 1 66 ASN H . . 3.730 2.429 2.070 2.901 . 0 0 "[ . 1 . 2]" 1
921 1 66 ASN H 1 66 ASN HB3 . . 3.890 3.005 2.515 3.572 . 0 0 "[ . 1 . 2]" 1
922 1 66 ASN HA 1 67 PRO HD2 . . 2.980 2.630 2.393 2.925 . 0 0 "[ . 1 . 2]" 1
923 1 66 ASN HA 1 67 PRO HD3 . . 2.890 2.021 1.969 2.157 . 0 0 "[ . 1 . 2]" 1
924 1 66 ASN HA 1 67 PRO HG3 . . 4.480 4.290 4.242 4.411 . 0 0 "[ . 1 . 2]" 1
925 1 66 ASN HB2 1 67 PRO HD2 . . 3.610 3.008 2.000 4.362 0.752 12 4 "[ *. - 1 + . * 2]" 1
926 1 66 ASN HB2 1 67 PRO HD3 . . 3.890 3.811 2.972 4.747 0.857 12 6 "[ -*. * 1*+ . * 2]" 1
927 1 66 ASN HB3 1 66 ASN HD22 . . 3.970 3.812 3.448 4.142 0.172 8 0 "[ . 1 . 2]" 1
928 1 67 PRO HA 1 68 PRO HD3 . . 2.680 1.975 1.935 2.151 . 0 0 "[ . 1 . 2]" 1
929 1 67 PRO HB2 1 68 PRO HD2 . . 3.390 2.894 2.085 3.274 . 0 0 "[ . 1 . 2]" 1
930 1 67 PRO HB3 1 68 PRO HD2 . . 3.430 3.182 2.787 3.401 . 0 0 "[ . 1 . 2]" 1
931 1 69 SER HA 1 74 GLN HE21 . . 3.670 3.133 2.064 3.682 0.012 15 0 "[ . 1 . 2]" 1
932 1 69 SER HA 1 74 GLN HE22 . . 4.120 3.706 2.858 4.117 . 0 0 "[ . 1 . 2]" 1
933 1 69 SER HB2 1 70 MET H . . 5.110 3.313 2.873 3.683 . 0 0 "[ . 1 . 2]" 1
934 1 69 SER HB3 1 70 MET H . . 4.480 2.577 2.067 4.027 . 0 0 "[ . 1 . 2]" 1
935 1 70 MET H 1 70 MET HB3 . . 3.610 3.465 3.220 4.053 0.443 15 0 "[ . 1 . 2]" 1
936 1 70 MET H 1 70 MET HG2 . . 4.120 3.493 2.586 4.060 . 0 0 "[ . 1 . 2]" 1
937 1 70 MET H 1 70 MET HG3 . . 3.990 3.123 2.679 3.785 . 0 0 "[ . 1 . 2]" 1
938 1 70 MET HA 1 70 MET HG2 . . 3.730 2.269 2.028 2.880 . 0 0 "[ . 1 . 2]" 1
939 1 70 MET HA 1 70 MET HG3 . . 3.810 3.047 2.301 3.605 . 0 0 "[ . 1 . 2]" 1
940 1 70 MET HB3 1 72 PHE H . . 4.730 3.472 3.146 3.834 . 0 0 "[ . 1 . 2]" 1
941 1 71 VAL HA 1 71 VAL QG . . 2.790 2.149 2.050 2.473 . 0 0 "[ . 1 . 2]" 1
942 1 71 VAL HA 1 73 LYS H . . 4.980 4.294 3.843 4.604 . 0 0 "[ . 1 . 2]" 1
943 1 71 VAL HA 1 74 GLN H . . 3.810 3.645 3.376 3.831 0.021 12 0 "[ . 1 . 2]" 1
944 1 71 VAL HA 1 74 GLN HB2 . . 3.510 2.701 2.469 3.192 . 0 0 "[ . 1 . 2]" 1
945 1 71 VAL HA 1 75 MET H . . 3.730 3.558 3.369 3.736 0.006 7 0 "[ . 1 . 2]" 1
946 1 71 VAL HA 1 102 TYR QE . . 3.700 3.288 1.981 3.731 0.031 4 0 "[ . 1 . 2]" 1
947 1 71 VAL HB 1 72 PHE H . . 3.540 2.487 2.113 3.786 0.246 16 0 "[ . 1 . 2]" 1
948 1 71 VAL HB 1 72 PHE QD . . 3.820 3.479 3.008 4.249 0.429 16 0 "[ . 1 . 2]" 1
949 1 71 VAL QG 1 72 PHE H . . 3.810 2.649 1.749 2.980 . 0 0 "[ . 1 . 2]" 1
950 1 71 VAL QG 1 72 PHE HA . . 3.730 3.156 2.808 3.375 . 0 0 "[ . 1 . 2]" 1
951 1 71 VAL QG 1 75 MET H . . 4.270 3.552 3.295 3.862 . 0 0 "[ . 1 . 2]" 1
952 1 71 VAL QG 1 75 MET ME . . 3.670 3.203 1.862 3.614 . 0 0 "[ . 1 . 2]" 1
953 1 71 VAL QG 1 102 TYR QD . . 3.990 3.576 2.687 3.862 . 0 0 "[ . 1 . 2]" 1
954 1 71 VAL QG 1 102 TYR QE . . 3.060 2.161 1.855 2.665 . 0 0 "[ . 1 . 2]" 1
955 1 72 PHE H 1 72 PHE HB2 . . 3.510 2.218 1.988 2.602 . 0 0 "[ . 1 . 2]" 1
956 1 72 PHE H 1 72 PHE HB3 . . 3.510 3.437 3.326 3.497 . 0 0 "[ . 1 . 2]" 1
957 1 72 PHE H 1 72 PHE QD . . 3.960 2.219 1.813 2.665 . 0 0 "[ . 1 . 2]" 1
958 1 72 PHE H 1 73 LYS H . . 3.900 2.982 2.795 3.121 . 0 0 "[ . 1 . 2]" 1
959 1 72 PHE HA 1 75 MET H . . 3.990 3.931 3.820 3.992 0.002 17 0 "[ . 1 . 2]" 1
960 1 72 PHE HA 1 75 MET HG3 . . 3.890 3.696 2.315 3.891 0.001 13 0 "[ . 1 . 2]" 1
961 1 72 PHE HB2 1 73 LYS H . . 3.990 2.683 2.186 3.070 . 0 0 "[ . 1 . 2]" 1
962 1 72 PHE HB3 1 73 LYS H . . 4.690 3.269 2.785 3.815 . 0 0 "[ . 1 . 2]" 1
963 1 73 LYS H 1 73 LYS HB2 . . 3.670 2.145 2.064 2.333 . 0 0 "[ . 1 . 2]" 1
964 1 73 LYS H 1 73 LYS HB3 . . 3.500 3.434 3.369 3.523 0.023 19 0 "[ . 1 . 2]" 1
965 1 73 LYS H 1 73 LYS HG2 . . 3.730 3.092 2.543 3.502 . 0 0 "[ . 1 . 2]" 1
966 1 73 LYS H 1 73 LYS HG3 . . 3.990 3.488 3.098 3.989 . 0 0 "[ . 1 . 2]" 1
967 1 73 LYS H 1 74 GLN H . . 3.430 2.858 2.490 3.024 . 0 0 "[ . 1 . 2]" 1
968 1 73 LYS H 1 74 GLN HB2 . . 4.820 4.689 4.321 4.839 0.019 15 0 "[ . 1 . 2]" 1
969 1 73 LYS H 1 74 GLN QG . . 5.110 4.655 4.371 4.935 . 0 0 "[ . 1 . 2]" 1
970 1 73 LYS H 1 75 MET H . . 4.870 4.162 3.609 4.539 . 0 0 "[ . 1 . 2]" 1
971 1 73 LYS HA 1 73 LYS QD . . 3.360 2.791 2.202 3.272 . 0 0 "[ . 1 . 2]" 1
972 1 73 LYS HA 1 73 LYS HG2 . . 3.390 2.213 1.965 2.488 . 0 0 "[ . 1 . 2]" 1
973 1 73 LYS HA 1 75 MET H . . 4.870 4.695 4.486 4.868 . 0 0 "[ . 1 . 2]" 1
974 1 73 LYS HA 1 76 GLU H . . 3.610 3.545 3.421 3.693 0.083 16 0 "[ . 1 . 2]" 1
975 1 73 LYS HA 1 76 GLU HG3 . . 3.990 3.719 3.031 3.942 . 0 0 "[ . 1 . 2]" 1
976 1 73 LYS HB2 1 74 GLN H . . 3.920 2.567 2.374 2.698 . 0 0 "[ . 1 . 2]" 1
977 1 73 LYS HB2 1 74 GLN QG . . 4.120 3.813 3.527 3.986 . 0 0 "[ . 1 . 2]" 1
978 1 73 LYS HG2 1 74 GLN H . . 4.870 4.735 4.570 4.810 . 0 0 "[ . 1 . 2]" 1
979 1 73 LYS HG3 1 74 GLN H . . 4.870 4.777 4.577 4.874 0.004 4 0 "[ . 1 . 2]" 1
980 1 74 GLN H 1 74 GLN HB2 . . 3.440 2.415 2.267 2.574 . 0 0 "[ . 1 . 2]" 1
981 1 74 GLN H 1 74 GLN HB3 . . 4.120 3.545 3.507 3.567 . 0 0 "[ . 1 . 2]" 1
982 1 74 GLN H 1 74 GLN QG . . 3.620 2.234 1.935 2.528 . 0 0 "[ . 1 . 2]" 1
983 1 74 GLN H 1 75 MET H . . 3.690 3.015 2.790 3.178 . 0 0 "[ . 1 . 2]" 1
984 1 74 GLN HA 1 74 GLN QG . . 3.730 2.375 2.128 2.735 . 0 0 "[ . 1 . 2]" 1
985 1 74 GLN HA 1 77 GLN H . . 4.240 3.447 3.212 3.704 . 0 0 "[ . 1 . 2]" 1
986 1 74 GLN HA 1 77 GLN HB2 . . 3.890 2.780 2.437 3.224 . 0 0 "[ . 1 . 2]" 1
987 1 74 GLN HB2 1 75 MET H . . 3.760 2.515 2.339 2.728 . 0 0 "[ . 1 . 2]" 1
988 1 74 GLN HB2 1 102 TYR QE . . 3.080 2.625 2.075 3.011 . 0 0 "[ . 1 . 2]" 1
989 1 74 GLN HB3 1 75 MET H . . 4.480 3.324 3.053 3.591 . 0 0 "[ . 1 . 2]" 1
990 1 74 GLN HB3 1 102 TYR QE . . 3.110 2.385 1.992 2.718 . 0 0 "[ . 1 . 2]" 1
991 1 74 GLN QG 1 75 MET H . . 4.870 4.157 3.989 4.288 . 0 0 "[ . 1 . 2]" 1
992 1 75 MET H 1 75 MET HB2 . . 3.810 2.281 2.065 2.624 . 0 0 "[ . 1 . 2]" 1
993 1 75 MET H 1 75 MET HG2 . . 3.540 2.920 1.946 3.441 . 0 0 "[ . 1 . 2]" 1
994 1 75 MET H 1 75 MET HG3 . . 3.500 2.877 2.264 3.528 0.028 4 0 "[ . 1 . 2]" 1
995 1 75 MET H 1 76 GLU H . . 3.710 2.931 2.860 3.007 . 0 0 "[ . 1 . 2]" 1
996 1 75 MET H 1 77 GLN HB2 . . 5.190 5.366 4.991 5.879 0.689 11 6 "[- .* **1+ * . 2]" 1
997 1 75 MET H 1 102 TYR QE . . 4.160 4.104 3.947 4.206 0.046 16 0 "[ . 1 . 2]" 1
998 1 75 MET HA 1 75 MET ME . . 3.990 3.709 3.268 3.989 . 0 0 "[ . 1 . 2]" 1
999 1 75 MET HA 1 75 MET HG3 . . 3.470 3.380 2.971 3.758 0.288 16 0 "[ . 1 . 2]" 1
1000 1 75 MET HA 1 78 VAL H . . 3.990 3.712 3.507 3.883 . 0 0 "[ . 1 . 2]" 1
1001 1 75 MET HA 1 78 VAL HB . . 3.510 3.408 3.063 3.517 0.007 7 0 "[ . 1 . 2]" 1
1002 1 75 MET HA 1 98 THR MG . . 3.270 2.313 1.907 2.733 . 0 0 "[ . 1 . 2]" 1
1003 1 75 MET HB2 1 75 MET HG3 . . 2.820 2.331 2.269 2.466 . 0 0 "[ . 1 . 2]" 1
1004 1 75 MET HB3 1 76 GLU H . . 3.790 3.265 2.697 3.704 . 0 0 "[ . 1 . 2]" 1
1005 1 75 MET ME 1 98 THR HB . . 3.670 2.785 1.977 3.621 . 0 0 "[ . 1 . 2]" 1
1006 1 75 MET ME 1 98 THR MG . . 2.960 2.527 1.946 2.922 . 0 0 "[ . 1 . 2]" 1
1007 1 75 MET ME 1 99 VAL HA . . 3.810 2.742 2.192 3.285 . 0 0 "[ . 1 . 2]" 1
1008 1 75 MET ME 1 99 VAL QG . . 3.040 2.690 1.784 2.973 . 0 0 "[ . 1 . 2]" 1
1009 1 75 MET ME 1 102 TYR QD . . 3.430 2.273 1.850 2.998 . 0 0 "[ . 1 . 2]" 1
1010 1 76 GLU H 1 76 GLU HB2 . . 3.220 2.220 2.099 2.372 . 0 0 "[ . 1 . 2]" 1
1011 1 76 GLU H 1 76 GLU HG3 . . 3.560 2.911 2.463 3.501 . 0 0 "[ . 1 . 2]" 1
1012 1 76 GLU H 1 79 ALA H . . 4.870 4.747 4.500 4.887 0.017 2 0 "[ . 1 . 2]" 1
1013 1 76 GLU H 1 79 ALA MB . . 4.980 4.400 4.125 4.569 . 0 0 "[ . 1 . 2]" 1
1014 1 76 GLU HA 1 76 GLU HB3 . . 2.900 2.684 2.588 2.782 . 0 0 "[ . 1 . 2]" 1
1015 1 76 GLU HA 1 76 GLU HG2 . . 2.890 2.142 2.009 2.474 . 0 0 "[ . 1 . 2]" 1
1016 1 76 GLU HA 1 76 GLU HG3 . . 3.470 3.219 2.692 3.432 . 0 0 "[ . 1 . 2]" 1
1017 1 76 GLU HA 1 78 VAL H . . 4.870 4.395 4.092 4.838 . 0 0 "[ . 1 . 2]" 1
1018 1 76 GLU HA 1 79 ALA H . . 3.560 3.236 3.082 3.488 . 0 0 "[ . 1 . 2]" 1
1019 1 76 GLU HA 1 79 ALA MB . . 2.440 2.223 2.071 2.335 . 0 0 "[ . 1 . 2]" 1
1020 1 76 GLU HA 1 80 GLN HE21 . . 4.820 4.166 3.935 4.437 . 0 0 "[ . 1 . 2]" 1
1021 1 76 GLU HB2 1 77 GLN H . . 3.680 2.701 2.530 2.874 . 0 0 "[ . 1 . 2]" 1
1022 1 76 GLU HB3 1 77 GLN H . . 3.790 3.266 2.954 3.531 . 0 0 "[ . 1 . 2]" 1
1023 1 77 GLN H 1 77 GLN HB2 . . 3.530 2.183 2.042 2.430 . 0 0 "[ . 1 . 2]" 1
1024 1 77 GLN H 1 77 GLN HB3 . . 3.330 2.970 2.561 3.372 0.042 16 0 "[ . 1 . 2]" 1
1025 1 77 GLN H 1 78 VAL H . . 3.630 3.026 2.876 3.156 . 0 0 "[ . 1 . 2]" 1
1026 1 77 GLN HA 1 77 GLN HE21 . . 4.120 3.029 2.025 3.705 . 0 0 "[ . 1 . 2]" 1
1027 1 77 GLN HA 1 77 GLN HE22 . . 4.480 3.717 3.128 4.287 . 0 0 "[ . 1 . 2]" 1
1028 1 77 GLN HA 1 77 GLN HG2 . . 3.560 3.457 2.150 3.823 0.263 11 0 "[ . 1 . 2]" 1
1029 1 77 GLN HA 1 80 GLN H . . 3.810 3.701 3.532 3.789 . 0 0 "[ . 1 . 2]" 1
1030 1 77 GLN HA 1 80 GLN HE21 . . 4.820 2.367 1.991 2.975 . 0 0 "[ . 1 . 2]" 1
1031 1 77 GLN HA 1 80 GLN HE22 . . 5.110 2.914 2.594 3.405 . 0 0 "[ . 1 . 2]" 1
1032 1 77 GLN HA 1 80 GLN HG3 . . 3.990 3.361 3.104 3.614 . 0 0 "[ . 1 . 2]" 1
1033 1 77 GLN HB2 1 78 VAL H . . 3.890 3.476 2.801 3.948 0.058 11 0 "[ . 1 . 2]" 1
1034 1 77 GLN HB2 1 78 VAL MG2 . . 3.990 4.159 3.539 4.632 0.642 6 7 "[* .+ **1* * . -]" 1
1035 1 77 GLN HB3 1 78 VAL H . . 4.200 2.587 2.351 2.773 . 0 0 "[ . 1 . 2]" 1
1036 1 77 GLN HE22 1 77 GLN HG2 . . 4.120 3.895 3.449 4.148 0.028 11 0 "[ . 1 . 2]" 1
1037 1 77 GLN HG2 1 78 VAL H . . 5.440 4.717 4.168 5.103 . 0 0 "[ . 1 . 2]" 1
1038 1 77 GLN HG3 1 78 VAL H . . 4.780 4.363 3.702 4.951 0.171 16 0 "[ . 1 . 2]" 1
1039 1 78 VAL H 1 78 VAL HB . . 3.270 2.408 2.348 2.473 . 0 0 "[ . 1 . 2]" 1
1040 1 78 VAL H 1 78 VAL MG1 . . 3.810 3.701 3.693 3.716 . 0 0 "[ . 1 . 2]" 1
1041 1 78 VAL H 1 78 VAL MG2 . . 2.940 2.019 1.925 2.156 . 0 0 "[ . 1 . 2]" 1
1042 1 78 VAL H 1 79 ALA H . . 3.610 2.717 2.490 2.865 . 0 0 "[ . 1 . 2]" 1
1043 1 78 VAL H 1 79 ALA MB . . 4.690 4.230 4.088 4.379 . 0 0 "[ . 1 . 2]" 1
1044 1 78 VAL H 1 98 THR MG . . 3.890 3.802 3.644 3.930 0.040 16 0 "[ . 1 . 2]" 1
1045 1 78 VAL HA 1 78 VAL MG1 . . 3.040 2.400 2.316 2.479 . 0 0 "[ . 1 . 2]" 1
1046 1 78 VAL HA 1 78 VAL MG2 . . 2.870 2.368 2.305 2.490 . 0 0 "[ . 1 . 2]" 1
1047 1 78 VAL HA 1 81 PHE HB2 . . 3.990 3.944 3.821 4.003 0.013 9 0 "[ . 1 . 2]" 1
1048 1 78 VAL HA 1 81 PHE QD . . 3.990 3.110 2.717 3.542 . 0 0 "[ . 1 . 2]" 1
1049 1 78 VAL HA 1 82 LEU H . . 3.990 3.946 3.781 4.008 0.018 9 0 "[ . 1 . 2]" 1
1050 1 78 VAL HB 1 79 ALA H . . 3.470 2.455 2.342 2.722 . 0 0 "[ . 1 . 2]" 1
1051 1 78 VAL HB 1 98 THR MG . . 3.150 2.003 1.946 2.108 . 0 0 "[ . 1 . 2]" 1
1052 1 78 VAL MG1 1 79 ALA H . . 3.810 3.343 3.093 3.701 . 0 0 "[ . 1 . 2]" 1
1053 1 78 VAL MG1 1 79 ALA HA . . 3.990 3.518 3.269 3.799 . 0 0 "[ . 1 . 2]" 1
1054 1 78 VAL MG1 1 80 GLN H . . 5.190 4.985 4.823 5.198 0.008 12 0 "[ . 1 . 2]" 1
1055 1 78 VAL MG1 1 81 PHE H . . 4.730 4.258 4.028 4.428 . 0 0 "[ . 1 . 2]" 1
1056 1 78 VAL MG1 1 81 PHE QD . . 3.360 2.395 2.108 2.738 . 0 0 "[ . 1 . 2]" 1
1057 1 78 VAL MG1 1 82 LEU H . . 4.120 3.401 3.185 3.551 . 0 0 "[ . 1 . 2]" 1
1058 1 78 VAL MG1 1 82 LEU HB2 . . 3.990 3.749 3.630 3.897 . 0 0 "[ . 1 . 2]" 1
1059 1 78 VAL MG1 1 82 LEU MD1 . . 3.270 2.075 1.933 2.300 . 0 0 "[ . 1 . 2]" 1
1060 1 78 VAL MG1 1 82 LEU MD2 . . 3.890 3.052 2.795 3.229 . 0 0 "[ . 1 . 2]" 1
1061 1 78 VAL MG1 1 96 PHE QE . . 3.110 2.617 2.282 2.909 . 0 0 "[ . 1 . 2]" 1
1062 1 78 VAL MG1 1 96 PHE HZ . . 3.460 2.892 2.343 3.204 . 0 0 "[ . 1 . 2]" 1
1063 1 78 VAL MG1 1 101 LEU MD2 . . 3.130 2.303 1.978 2.654 . 0 0 "[ . 1 . 2]" 1
1064 1 78 VAL MG2 1 79 ALA H . . 3.810 3.797 3.719 3.817 0.007 15 0 "[ . 1 . 2]" 1
1065 1 78 VAL MG2 1 81 PHE H . . 5.190 5.076 5.025 5.179 . 0 0 "[ . 1 . 2]" 1
1066 1 78 VAL MG2 1 101 LEU MD2 . . 3.430 2.682 2.331 3.036 . 0 0 "[ . 1 . 2]" 1
1067 1 79 ALA H 1 79 ALA MB . . 2.770 2.138 2.103 2.177 . 0 0 "[ . 1 . 2]" 1
1068 1 79 ALA H 1 82 LEU MD1 . . 4.480 3.822 3.576 4.109 . 0 0 "[ . 1 . 2]" 1
1069 1 79 ALA H 1 98 THR MG . . 3.430 3.108 2.814 3.406 . 0 0 "[ . 1 . 2]" 1
1070 1 79 ALA HA 1 82 LEU H . . 3.430 3.247 3.169 3.306 . 0 0 "[ . 1 . 2]" 1
1071 1 79 ALA HA 1 82 LEU HB2 . . 3.360 2.179 2.137 2.221 . 0 0 "[ . 1 . 2]" 1
1072 1 79 ALA HA 1 82 LEU HB3 . . 3.730 3.748 3.724 3.770 0.040 16 0 "[ . 1 . 2]" 1
1073 1 79 ALA HA 1 82 LEU MD1 . . 3.070 2.580 2.349 2.722 . 0 0 "[ . 1 . 2]" 1
1074 1 79 ALA HA 1 82 LEU HG . . 3.430 3.432 3.388 3.448 0.018 12 0 "[ . 1 . 2]" 1
1075 1 79 ALA MB 1 80 GLN H . . 3.240 2.477 2.369 2.590 . 0 0 "[ . 1 . 2]" 1
1076 1 79 ALA MB 1 80 GLN HE21 . . 4.480 4.454 4.420 4.488 0.008 8 0 "[ . 1 . 2]" 1
1077 1 79 ALA MB 1 81 PHE H . . 4.660 4.529 4.432 4.673 0.013 19 0 "[ . 1 . 2]" 1
1078 1 79 ALA MB 1 82 LEU MD1 . . 3.810 3.572 3.425 3.662 . 0 0 "[ . 1 . 2]" 1
1079 1 80 GLN H 1 80 GLN HB2 . . 3.300 2.470 2.416 2.538 . 0 0 "[ . 1 . 2]" 1
1080 1 80 GLN H 1 80 GLN HB3 . . 3.790 3.548 3.544 3.552 . 0 0 "[ . 1 . 2]" 1
1081 1 80 GLN H 1 80 GLN HG2 . . 3.390 3.330 3.193 3.404 0.014 16 0 "[ . 1 . 2]" 1
1082 1 80 GLN H 1 80 GLN HG3 . . 3.360 2.084 1.966 2.196 . 0 0 "[ . 1 . 2]" 1
1083 1 80 GLN H 1 81 PHE H . . 3.570 2.840 2.790 2.917 . 0 0 "[ . 1 . 2]" 1
1084 1 80 GLN H 1 81 PHE HB3 . . 4.550 4.571 4.554 4.592 0.042 16 0 "[ . 1 . 2]" 1
1085 1 80 GLN HA 1 80 GLN HG2 . . 3.270 2.478 2.421 2.521 . 0 0 "[ . 1 . 2]" 1
1086 1 80 GLN HA 1 80 GLN HG3 . . 3.360 2.932 2.892 3.004 . 0 0 "[ . 1 . 2]" 1
1087 1 80 GLN HB2 1 81 PHE H . . 3.670 2.647 2.542 2.748 . 0 0 "[ . 1 . 2]" 1
1088 1 80 GLN HB3 1 80 GLN HE21 . . 4.820 4.310 4.017 4.465 . 0 0 "[ . 1 . 2]" 1
1089 1 80 GLN HB3 1 81 PHE H . . 4.120 3.636 3.513 3.727 . 0 0 "[ . 1 . 2]" 1
1090 1 81 PHE H 1 81 PHE HB2 . . 3.390 2.839 2.738 2.940 . 0 0 "[ . 1 . 2]" 1
1091 1 81 PHE H 1 81 PHE HB3 . . 3.230 1.979 1.933 2.030 . 0 0 "[ . 1 . 2]" 1
1092 1 81 PHE H 1 81 PHE QD . . 3.960 3.839 3.759 3.925 . 0 0 "[ . 1 . 2]" 1
1093 1 81 PHE H 1 82 LEU H . . 3.270 2.575 2.511 2.667 . 0 0 "[ . 1 . 2]" 1
1094 1 81 PHE H 1 82 LEU HA . . 5.200 5.119 5.069 5.196 . 0 0 "[ . 1 . 2]" 1
1095 1 81 PHE H 1 82 LEU HB2 . . 4.780 4.494 4.426 4.562 . 0 0 "[ . 1 . 2]" 1
1096 1 81 PHE H 1 84 ALA MB . . 4.480 4.222 4.080 4.403 . 0 0 "[ . 1 . 2]" 1
1097 1 81 PHE HA 1 81 PHE QD . . 3.190 2.766 2.659 2.963 . 0 0 "[ . 1 . 2]" 1
1098 1 81 PHE HA 1 84 ALA H . . 3.990 3.277 3.118 3.462 . 0 0 "[ . 1 . 2]" 1
1099 1 81 PHE HA 1 84 ALA MB . . 3.190 2.061 1.965 2.238 . 0 0 "[ . 1 . 2]" 1
1100 1 81 PHE HA 1 85 ALA H . . 4.480 3.896 3.785 4.045 . 0 0 "[ . 1 . 2]" 1
1101 1 81 PHE HB2 1 82 LEU H . . 3.990 4.012 3.985 4.037 0.047 13 0 "[ . 1 . 2]" 1
1102 1 81 PHE HB3 1 82 LEU H . . 3.730 2.684 2.637 2.755 . 0 0 "[ . 1 . 2]" 1
1103 1 81 PHE QD 1 82 LEU H . . 3.820 3.127 2.763 3.294 . 0 0 "[ . 1 . 2]" 1
1104 1 81 PHE QD 1 82 LEU HA . . 3.810 3.708 3.274 3.862 0.052 5 0 "[ . 1 . 2]" 1
1105 1 81 PHE QD 1 82 LEU MD2 . . 3.700 3.164 2.804 3.586 . 0 0 "[ . 1 . 2]" 1
1106 1 81 PHE QD 1 82 LEU HG . . 3.360 2.937 2.598 3.283 . 0 0 "[ . 1 . 2]" 1
1107 1 81 PHE QD 1 85 ALA MB . . 3.990 3.575 3.166 3.941 . 0 0 "[ . 1 . 2]" 1
1108 1 81 PHE QD 1 117 LEU MD2 . . 3.810 3.809 3.750 3.833 0.023 13 0 "[ . 1 . 2]" 1
1109 1 81 PHE HZ 1 85 ALA MB . . 3.730 3.452 3.275 3.607 . 0 0 "[ . 1 . 2]" 1
1110 1 81 PHE HZ 1 113 THR MG . . 3.390 3.038 2.449 3.390 . 0 0 "[ . 1 . 2]" 1
1111 1 81 PHE HZ 1 117 LEU MD2 . . 3.300 2.579 1.977 3.081 . 0 0 "[ . 1 . 2]" 1
1112 1 82 LEU H 1 82 LEU HB2 . . 3.580 2.288 2.259 2.313 . 0 0 "[ . 1 . 2]" 1
1113 1 82 LEU H 1 82 LEU HB3 . . 3.810 3.505 3.497 3.513 . 0 0 "[ . 1 . 2]" 1
1114 1 82 LEU H 1 82 LEU MD1 . . 3.670 3.651 3.546 3.705 0.035 7 0 "[ . 1 . 2]" 1
1115 1 82 LEU H 1 82 LEU MD2 . . 3.670 3.518 3.449 3.609 . 0 0 "[ . 1 . 2]" 1
1116 1 82 LEU H 1 82 LEU HG . . 3.390 2.470 2.416 2.528 . 0 0 "[ . 1 . 2]" 1
1117 1 82 LEU H 1 83 LYS H . . 3.630 3.007 2.915 3.140 . 0 0 "[ . 1 . 2]" 1
1118 1 82 LEU H 1 84 ALA H . . 4.470 4.011 3.910 4.147 . 0 0 "[ . 1 . 2]" 1
1119 1 82 LEU H 1 85 ALA H . . 4.520 4.465 4.422 4.513 . 0 0 "[ . 1 . 2]" 1
1120 1 82 LEU H 1 85 ALA MB . . 4.370 4.352 4.239 4.386 0.016 2 0 "[ . 1 . 2]" 1
1121 1 82 LEU HA 1 82 LEU MD1 . . 3.890 3.819 3.808 3.838 . 0 0 "[ . 1 . 2]" 1
1122 1 82 LEU HA 1 82 LEU MD2 . . 2.820 2.040 1.947 2.131 . 0 0 "[ . 1 . 2]" 1
1123 1 82 LEU HA 1 82 LEU HG . . 3.560 2.899 2.848 2.968 . 0 0 "[ . 1 . 2]" 1
1124 1 82 LEU HA 1 85 ALA H . . 3.990 3.294 3.178 3.376 . 0 0 "[ . 1 . 2]" 1
1125 1 82 LEU HA 1 85 ALA MB . . 3.220 2.377 2.206 2.471 . 0 0 "[ . 1 . 2]" 1
1126 1 82 LEU HA 1 86 GLU H . . 5.040 4.391 4.146 4.573 . 0 0 "[ . 1 . 2]" 1
1127 1 82 LEU HA 1 95 MET ME . . 3.170 2.206 1.997 2.849 . 0 0 "[ . 1 . 2]" 1
1128 1 82 LEU HB2 1 82 LEU MD1 . . 3.050 2.347 2.221 2.424 . 0 0 "[ . 1 . 2]" 1
1129 1 82 LEU HB2 1 83 LYS H . . 3.890 2.470 2.296 2.621 . 0 0 "[ . 1 . 2]" 1
1130 1 82 LEU HB3 1 82 LEU MD1 . . 3.390 2.327 2.273 2.424 . 0 0 "[ . 1 . 2]" 1
1131 1 82 LEU HB3 1 82 LEU MD2 . . 3.190 2.350 2.309 2.393 . 0 0 "[ . 1 . 2]" 1
1132 1 82 LEU HB3 1 83 LYS H . . 3.910 3.134 2.877 3.303 . 0 0 "[ . 1 . 2]" 1
1133 1 82 LEU HB3 1 95 MET ME . . 3.240 2.391 2.043 2.678 . 0 0 "[ . 1 . 2]" 1
1134 1 82 LEU MD1 1 83 LYS H . . 4.480 4.366 4.176 4.504 0.024 7 0 "[ . 1 . 2]" 1
1135 1 82 LEU MD1 1 95 MET ME . . 3.670 3.621 3.502 3.690 0.020 6 0 "[ . 1 . 2]" 1
1136 1 82 LEU MD1 1 96 PHE H . . 5.040 4.025 3.664 4.307 . 0 0 "[ . 1 . 2]" 1
1137 1 82 LEU MD1 1 96 PHE QD . . 4.120 3.292 2.917 3.749 . 0 0 "[ . 1 . 2]" 1
1138 1 82 LEU MD1 1 96 PHE QE . . 3.730 2.736 2.322 3.229 . 0 0 "[ . 1 . 2]" 1
1139 1 82 LEU MD1 1 96 PHE HZ . . 3.810 3.722 3.453 3.822 0.012 12 0 "[ . 1 . 2]" 1
1140 1 82 LEU MD1 1 97 GLN HA . . 3.510 3.499 3.436 3.534 0.024 13 0 "[ . 1 . 2]" 1
1141 1 82 LEU MD1 1 98 THR H . . 4.270 2.975 2.701 3.218 . 0 0 "[ . 1 . 2]" 1
1142 1 82 LEU MD1 1 98 THR HA . . 3.610 2.800 2.555 3.105 . 0 0 "[ . 1 . 2]" 1
1143 1 82 LEU MD1 1 98 THR MG . . 3.070 3.070 3.033 3.099 0.029 13 0 "[ . 1 . 2]" 1
1144 1 82 LEU MD2 1 83 LYS H . . 4.820 4.600 4.473 4.707 . 0 0 "[ . 1 . 2]" 1
1145 1 82 LEU MD2 1 85 ALA MB . . 3.730 3.250 3.047 3.409 . 0 0 "[ . 1 . 2]" 1
1146 1 82 LEU MD2 1 95 MET ME . . 2.750 2.025 1.852 2.211 . 0 0 "[ . 1 . 2]" 1
1147 1 82 LEU MD2 1 96 PHE H . . 3.670 2.972 2.773 3.207 . 0 0 "[ . 1 . 2]" 1
1148 1 82 LEU MD2 1 96 PHE QD . . 3.820 3.229 2.939 3.372 . 0 0 "[ . 1 . 2]" 1
1149 1 82 LEU MD2 1 96 PHE QE . . 3.430 2.566 2.040 2.742 . 0 0 "[ . 1 . 2]" 1
1150 1 82 LEU MD2 1 96 PHE HZ . . 3.130 2.557 2.155 2.835 . 0 0 "[ . 1 . 2]" 1
1151 1 83 LYS H 1 83 LYS QB . . 2.900 2.170 2.041 2.397 . 0 0 "[ . 1 . 2]" 1
1152 1 83 LYS H 1 83 LYS QG . . 3.990 3.422 2.101 3.987 . 0 0 "[ . 1 . 2]" 1
1153 1 83 LYS H 1 84 ALA H . . 3.580 2.758 2.646 2.893 . 0 0 "[ . 1 . 2]" 1
1154 1 83 LYS H 1 85 ALA H . . 4.820 4.174 4.080 4.266 . 0 0 "[ . 1 . 2]" 1
1155 1 83 LYS HA 1 83 LYS QB . . 2.720 2.447 2.395 2.499 . 0 0 "[ . 1 . 2]" 1
1156 1 83 LYS HA 1 83 LYS QG . . 3.360 2.222 2.028 2.404 . 0 0 "[ . 1 . 2]" 1
1157 1 83 LYS HA 1 85 ALA H . . 4.520 4.353 4.181 4.516 . 0 0 "[ . 1 . 2]" 1
1158 1 83 LYS HA 1 86 GLU H . . 3.810 3.396 3.200 3.920 0.110 7 0 "[ . 1 . 2]" 1
1159 1 83 LYS QB 1 84 ALA H . . 3.330 2.741 2.604 2.915 . 0 0 "[ . 1 . 2]" 1
1160 1 83 LYS QB 1 85 ALA H . . 4.820 4.784 4.694 4.829 0.009 13 0 "[ . 1 . 2]" 1
1161 1 83 LYS QE 1 83 LYS QG . . 2.960 2.103 1.942 2.272 . 0 0 "[ . 1 . 2]" 1
1162 1 83 LYS QG 1 84 ALA H . . 4.270 4.184 3.963 4.292 0.022 7 0 "[ . 1 . 2]" 1
1163 1 84 ALA H 1 84 ALA MB . . 2.860 1.963 1.937 2.013 . 0 0 "[ . 1 . 2]" 1
1164 1 84 ALA H 1 85 ALA H . . 3.350 2.647 2.486 2.706 . 0 0 "[ . 1 . 2]" 1
1165 1 84 ALA H 1 85 ALA MB . . 4.120 4.123 3.970 4.153 0.033 13 0 "[ . 1 . 2]" 1
1166 1 84 ALA H 1 86 GLU H . . 4.690 4.201 3.900 4.704 0.014 7 0 "[ . 1 . 2]" 1
1167 1 84 ALA HA 1 87 ASP H . . 3.560 3.367 3.129 3.597 0.037 7 0 "[ . 1 . 2]" 1
1168 1 84 ALA HA 1 87 ASP QB . . 3.020 2.702 2.272 3.026 0.006 3 0 "[ . 1 . 2]" 1
1169 1 84 ALA MB 1 85 ALA H . . 3.240 2.732 2.644 2.818 . 0 0 "[ . 1 . 2]" 1
1170 1 84 ALA MB 1 87 ASP QB . . 4.120 3.862 3.627 4.115 . 0 0 "[ . 1 . 2]" 1
1171 1 85 ALA H 1 85 ALA MB . . 2.810 1.938 1.932 1.954 . 0 0 "[ . 1 . 2]" 1
1172 1 85 ALA H 1 86 GLU H . . 3.500 2.779 2.571 3.062 . 0 0 "[ . 1 . 2]" 1
1173 1 85 ALA H 1 95 MET ME . . 4.120 3.609 3.135 4.050 . 0 0 "[ . 1 . 2]" 1
1174 1 85 ALA HA 1 88 TYR H . . 3.610 3.496 3.306 3.605 . 0 0 "[ . 1 . 2]" 1
1175 1 85 ALA HA 1 88 TYR HB2 . . 3.730 2.720 2.506 2.865 . 0 0 "[ . 1 . 2]" 1
1176 1 85 ALA HA 1 88 TYR HB3 . . 3.470 3.632 3.482 3.741 0.271 2 0 "[ . 1 . 2]" 1
1177 1 85 ALA MB 1 86 GLU H . . 3.170 2.667 2.178 2.952 . 0 0 "[ . 1 . 2]" 1
1178 1 85 ALA MB 1 90 VAL HB . . 3.610 3.241 2.743 3.581 . 0 0 "[ . 1 . 2]" 1
1179 1 85 ALA MB 1 95 MET ME . . 2.920 2.251 1.831 2.741 . 0 0 "[ . 1 . 2]" 1
1180 1 86 GLU H 1 86 GLU HB2 . . 3.240 2.130 2.022 3.434 0.194 7 0 "[ . 1 . 2]" 1
1181 1 86 GLU H 1 86 GLU HB3 . . 3.230 3.049 2.917 3.186 . 0 0 "[ . 1 . 2]" 1
1182 1 86 GLU H 1 86 GLU HG3 . . 4.120 3.905 1.915 4.275 0.155 3 0 "[ . 1 . 2]" 1
1183 1 86 GLU H 1 87 ASP H . . 3.470 2.839 2.658 3.094 . 0 0 "[ . 1 . 2]" 1
1184 1 86 GLU H 1 90 VAL HB . . 4.870 3.994 3.225 4.430 . 0 0 "[ . 1 . 2]" 1
1185 1 86 GLU H 1 95 MET ME . . 3.240 2.586 2.190 2.941 . 0 0 "[ . 1 . 2]" 1
1186 1 86 GLU HA 1 86 GLU HG2 . . 3.670 2.272 1.986 3.376 . 0 0 "[ . 1 . 2]" 1
1187 1 86 GLU HA 1 86 GLU HG3 . . 3.390 3.019 2.172 3.564 0.174 7 0 "[ . 1 . 2]" 1
1188 1 86 GLU HA 1 90 VAL H . . 3.270 2.696 2.301 3.302 0.032 13 0 "[ . 1 . 2]" 1
1189 1 86 GLU HA 1 90 VAL HB . . 3.560 2.151 1.986 2.358 . 0 0 "[ . 1 . 2]" 1
1190 1 86 GLU HA 1 90 VAL MG2 . . 3.730 3.564 3.296 3.737 0.007 3 0 "[ . 1 . 2]" 1
1191 1 86 GLU HA 1 95 MET ME . . 3.510 3.431 3.030 3.540 0.030 18 0 "[ . 1 . 2]" 1
1192 1 86 GLU HB3 1 87 ASP H . . 3.800 2.661 2.311 4.119 0.319 7 0 "[ . 1 . 2]" 1
1193 1 86 GLU HG3 1 95 MET ME . . 3.560 3.235 2.708 3.714 0.154 7 0 "[ . 1 . 2]" 1
1194 1 87 ASP H 1 87 ASP QB . . 2.870 2.173 1.986 2.555 . 0 0 "[ . 1 . 2]" 1
1195 1 87 ASP QB 1 88 TYR H . . 3.610 2.509 2.270 2.750 . 0 0 "[ . 1 . 2]" 1
1196 1 87 ASP QB 1 88 TYR HA . . 3.990 3.683 3.533 3.870 . 0 0 "[ . 1 . 2]" 1
1197 1 88 TYR H 1 88 TYR HB2 . . 3.270 1.958 1.938 1.998 . 0 0 "[ . 1 . 2]" 1
1198 1 88 TYR H 1 88 TYR HB3 . . 3.380 2.816 2.787 2.874 . 0 0 "[ . 1 . 2]" 1
1199 1 88 TYR H 1 88 TYR QD . . 3.700 3.719 3.666 3.766 0.066 3 0 "[ . 1 . 2]" 1
1200 1 88 TYR H 1 89 GLY H . . 3.510 2.933 2.868 3.001 . 0 0 "[ . 1 . 2]" 1
1201 1 88 TYR H 1 90 VAL H . . 4.300 4.282 4.164 4.333 0.033 6 0 "[ . 1 . 2]" 1
1202 1 88 TYR H 1 90 VAL MG2 . . 4.810 4.407 4.200 4.517 . 0 0 "[ . 1 . 2]" 1
1203 1 88 TYR HA 1 88 TYR QD . . 3.030 2.376 2.064 2.597 . 0 0 "[ . 1 . 2]" 1
1204 1 88 TYR HB2 1 89 GLY H . . 4.270 3.439 3.302 3.664 . 0 0 "[ . 1 . 2]" 1
1205 1 88 TYR HB2 1 90 VAL MG2 . . 3.810 3.717 3.550 3.828 0.018 19 0 "[ . 1 . 2]" 1
1206 1 88 TYR HB2 1 117 LEU MD1 . . 4.120 2.934 2.737 3.082 . 0 0 "[ . 1 . 2]" 1
1207 1 88 TYR HB3 1 89 GLY H . . 4.270 2.389 2.137 2.785 . 0 0 "[ . 1 . 2]" 1
1208 1 88 TYR HB3 1 90 VAL H . . 4.800 3.292 2.555 3.669 . 0 0 "[ . 1 . 2]" 1
1209 1 88 TYR HB3 1 90 VAL MG2 . . 3.810 2.564 2.393 2.713 . 0 0 "[ . 1 . 2]" 1
1210 1 88 TYR HB3 1 117 LEU MD1 . . 3.990 2.891 2.696 3.049 . 0 0 "[ . 1 . 2]" 1
1211 1 88 TYR QD 1 89 GLY H . . 5.040 4.135 3.911 4.428 . 0 0 "[ . 1 . 2]" 1
1212 1 88 TYR QD 1 117 LEU MD1 . . 2.900 2.217 2.033 2.471 . 0 0 "[ . 1 . 2]" 1
1213 1 88 TYR QD 1 120 LEU HB2 . . 3.700 2.659 2.468 2.872 . 0 0 "[ . 1 . 2]" 1
1214 1 88 TYR QD 1 120 LEU HB3 . . 3.610 2.240 2.047 2.625 . 0 0 "[ . 1 . 2]" 1
1215 1 88 TYR QD 1 120 LEU MD1 . . 3.000 2.151 1.993 2.300 . 0 0 "[ . 1 . 2]" 1
1216 1 88 TYR QD 1 120 LEU MD2 . . 3.510 3.396 3.120 3.490 . 0 0 "[ . 1 . 2]" 1
1217 1 88 TYR QE 1 117 LEU HA . . 3.700 3.646 3.340 3.714 0.014 5 0 "[ . 1 . 2]" 1
1218 1 88 TYR QE 1 117 LEU MD1 . . 3.210 3.148 3.020 3.226 0.016 6 0 "[ . 1 . 2]" 1
1219 1 88 TYR QE 1 120 LEU H . . 4.160 4.038 3.836 4.164 0.004 6 0 "[ . 1 . 2]" 1
1220 1 88 TYR QE 1 120 LEU HB2 . . 3.210 2.804 2.558 3.135 . 0 0 "[ . 1 . 2]" 1
1221 1 88 TYR QE 1 120 LEU HB3 . . 2.940 2.138 1.994 2.253 . 0 0 "[ . 1 . 2]" 1
1222 1 88 TYR QE 1 120 LEU MD1 . . 3.820 3.768 3.515 3.843 0.023 20 0 "[ . 1 . 2]" 1
1223 1 88 TYR QE 1 120 LEU MD2 . . 3.990 3.911 3.724 4.002 0.012 9 0 "[ . 1 . 2]" 1
1224 1 88 TYR QE 1 121 ALA H . . 3.460 2.411 2.164 2.835 . 0 0 "[ . 1 . 2]" 1
1225 1 88 TYR QE 1 121 ALA MB . . 3.110 2.522 2.349 2.729 . 0 0 "[ . 1 . 2]" 1
1226 1 89 GLY H 1 90 VAL H . . 3.120 1.884 1.860 1.908 . 0 0 "[ . 1 . 2]" 1
1227 1 89 GLY H 1 90 VAL HB . . 4.390 3.688 3.634 3.821 . 0 0 "[ . 1 . 2]" 1
1228 1 89 GLY H 1 90 VAL MG2 . . 3.990 3.142 2.762 3.493 . 0 0 "[ . 1 . 2]" 1
1229 1 89 GLY H 1 120 LEU MD1 . . 4.390 3.005 2.549 3.273 . 0 0 "[ . 1 . 2]" 1
1230 1 89 GLY HA2 1 120 LEU MD1 . . 3.610 3.572 3.324 3.640 0.030 17 0 "[ . 1 . 2]" 1
1231 1 89 GLY HA2 1 120 LEU MD2 . . 3.810 3.712 3.504 3.822 0.012 2 0 "[ . 1 . 2]" 1
1232 1 89 GLY HA3 1 120 LEU MD1 . . 3.610 2.504 2.007 2.708 . 0 0 "[ . 1 . 2]" 1
1233 1 89 GLY HA3 1 120 LEU MD2 . . 3.330 2.146 1.957 2.298 . 0 0 "[ . 1 . 2]" 1
1234 1 90 VAL H 1 90 VAL HB . . 3.290 2.393 2.269 2.498 . 0 0 "[ . 1 . 2]" 1
1235 1 90 VAL H 1 90 VAL MG1 . . 4.280 3.709 3.665 3.755 . 0 0 "[ . 1 . 2]" 1
1236 1 90 VAL H 1 90 VAL MG2 . . 2.900 2.522 2.055 2.815 . 0 0 "[ . 1 . 2]" 1
1237 1 90 VAL H 1 91 ILE H . . 4.780 4.555 4.445 4.672 . 0 0 "[ . 1 . 2]" 1
1238 1 90 VAL H 1 120 LEU MD1 . . 3.810 2.881 2.089 3.286 . 0 0 "[ . 1 . 2]" 1
1239 1 90 VAL HA 1 90 VAL MG1 . . 2.940 2.482 2.399 2.526 . 0 0 "[ . 1 . 2]" 1
1240 1 90 VAL HA 1 90 VAL MG2 . . 2.980 2.260 2.195 2.355 . 0 0 "[ . 1 . 2]" 1
1241 1 90 VAL HA 1 91 ILE H . . 2.750 2.271 2.204 2.403 . 0 0 "[ . 1 . 2]" 1
1242 1 90 VAL HA 1 116 ALA MB . . 3.990 3.160 2.573 3.823 . 0 0 "[ . 1 . 2]" 1
1243 1 90 VAL HA 1 120 LEU MD1 . . 3.270 2.306 2.115 2.463 . 0 0 "[ . 1 . 2]" 1
1244 1 90 VAL HB 1 91 ILE H . . 4.340 4.146 3.905 4.351 0.011 15 0 "[ . 1 . 2]" 1
1245 1 90 VAL HB 1 120 LEU MD1 . . 3.810 3.751 3.592 3.827 0.017 11 0 "[ . 1 . 2]" 1
1246 1 90 VAL MG1 1 91 ILE H . . 3.190 2.228 1.894 2.498 . 0 0 "[ . 1 . 2]" 1
1247 1 90 VAL MG1 1 94 ASP HB2 . . 4.180 2.630 1.940 3.302 . 0 0 "[ . 1 . 2]" 1
1248 1 90 VAL MG1 1 94 ASP HB3 . . 3.240 3.020 2.437 3.955 0.715 9 6 "[* . * +1 - .* * 2]" 1
1249 1 90 VAL MG1 1 95 MET H . . 4.120 3.564 3.372 3.736 . 0 0 "[ . 1 . 2]" 1
1250 1 90 VAL MG1 1 95 MET ME . . 3.390 3.297 2.349 3.454 0.064 20 0 "[ . 1 . 2]" 1
1251 1 90 VAL MG1 1 95 MET HG2 . . 3.470 2.108 1.922 2.538 . 0 0 "[ . 1 . 2]" 1
1252 1 90 VAL MG1 1 95 MET HG3 . . 3.730 3.157 2.876 3.565 . 0 0 "[ . 1 . 2]" 1
1253 1 90 VAL MG1 1 113 THR HA . . 3.670 3.178 2.710 3.598 . 0 0 "[ . 1 . 2]" 1
1254 1 90 VAL MG1 1 113 THR MG . . 3.050 2.973 2.690 3.075 0.025 9 0 "[ . 1 . 2]" 1
1255 1 90 VAL MG1 1 116 ALA MB . . 2.920 2.395 2.054 2.759 . 0 0 "[ . 1 . 2]" 1
1256 1 90 VAL MG2 1 113 THR MG . . 3.610 3.406 3.152 3.618 0.008 20 0 "[ . 1 . 2]" 1
1257 1 90 VAL MG2 1 117 LEU H . . 3.430 3.092 2.815 3.406 . 0 0 "[ . 1 . 2]" 1
1258 1 90 VAL MG2 1 117 LEU HA . . 3.300 2.736 2.490 2.870 . 0 0 "[ . 1 . 2]" 1
1259 1 90 VAL MG2 1 117 LEU HB2 . . 3.070 3.072 2.963 3.104 0.034 2 0 "[ . 1 . 2]" 1
1260 1 90 VAL MG2 1 120 LEU H . . 4.780 4.725 4.560 4.836 0.056 13 0 "[ . 1 . 2]" 1
1261 1 90 VAL MG2 1 120 LEU MD1 . . 2.990 1.787 1.627 1.972 . 0 0 "[ . 1 . 2]" 1
1262 1 91 ILE H 1 91 ILE HB . . 3.560 3.536 3.505 3.588 0.028 1 0 "[ . 1 . 2]" 1
1263 1 91 ILE H 1 91 ILE MD . . 3.730 3.561 3.365 3.640 . 0 0 "[ . 1 . 2]" 1
1264 1 91 ILE H 1 91 ILE HG12 . . 3.240 1.904 1.809 1.950 . 0 0 "[ . 1 . 2]" 1
1265 1 91 ILE H 1 91 ILE HG13 . . 3.610 2.679 2.340 3.236 . 0 0 "[ . 1 . 2]" 1
1266 1 91 ILE H 1 91 ILE MG . . 2.990 2.601 2.197 3.094 0.104 7 0 "[ . 1 . 2]" 1
1267 1 91 ILE H 1 94 ASP HB2 . . 4.520 3.605 3.060 4.636 0.116 13 0 "[ . 1 . 2]" 1
1268 1 91 ILE H 1 94 ASP HB3 . . 4.480 4.430 4.161 4.545 0.065 12 0 "[ . 1 . 2]" 1
1269 1 91 ILE H 1 120 LEU MD1 . . 4.150 4.155 3.946 4.201 0.051 8 0 "[ . 1 . 2]" 1
1270 1 91 ILE HA 1 91 ILE HB . . 2.910 2.526 2.467 2.581 . 0 0 "[ . 1 . 2]" 1
1271 1 91 ILE HA 1 91 ILE HG13 . . 4.120 3.709 3.648 3.809 . 0 0 "[ . 1 . 2]" 1
1272 1 91 ILE HA 1 91 ILE MG . . 2.820 2.210 2.037 2.364 . 0 0 "[ . 1 . 2]" 1
1273 1 91 ILE HA 1 92 LYS H . . 2.750 2.680 2.511 2.807 0.057 13 0 "[ . 1 . 2]" 1
1274 1 91 ILE HB 1 91 ILE MD . . 2.700 2.210 2.070 2.395 . 0 0 "[ . 1 . 2]" 1
1275 1 91 ILE HB 1 92 LYS H . . 3.150 2.092 1.906 2.392 . 0 0 "[ . 1 . 2]" 1
1276 1 91 ILE HB 1 93 THR H . . 4.270 2.399 2.252 2.518 . 0 0 "[ . 1 . 2]" 1
1277 1 91 ILE MD 1 91 ILE MG . . 3.070 2.133 1.853 2.331 . 0 0 "[ . 1 . 2]" 1
1278 1 91 ILE MD 1 92 LYS H . . 3.990 3.802 3.560 4.017 0.027 17 0 "[ . 1 . 2]" 1
1279 1 91 ILE MD 1 93 THR H . . 3.990 2.809 2.617 3.204 . 0 0 "[ . 1 . 2]" 1
1280 1 91 ILE MD 1 94 ASP H . . 3.410 3.242 2.940 3.432 0.022 18 0 "[ . 1 . 2]" 1
1281 1 91 ILE HG12 1 91 ILE MG . . 3.220 2.376 2.238 2.604 . 0 0 "[ . 1 . 2]" 1
1282 1 91 ILE HG12 1 93 THR H . . 4.260 3.965 3.688 4.290 0.030 20 0 "[ . 1 . 2]" 1
1283 1 91 ILE HG12 1 94 ASP H . . 3.990 3.733 3.357 4.011 0.021 5 0 "[ . 1 . 2]" 1
1284 1 91 ILE HG12 1 94 ASP HB2 . . 4.120 3.155 1.991 4.784 0.664 7 1 "[ . + 1 . 2]" 1
1285 1 91 ILE HG13 1 91 ILE MG . . 3.470 3.221 3.202 3.238 . 0 0 "[ . 1 . 2]" 1
1286 1 91 ILE HG13 1 92 LYS H . . 4.440 3.558 3.115 4.079 . 0 0 "[ . 1 . 2]" 1
1287 1 91 ILE HG13 1 93 THR H . . 4.120 2.401 2.017 2.915 . 0 0 "[ . 1 . 2]" 1
1288 1 91 ILE HG13 1 94 ASP H . . 3.610 2.118 1.940 2.295 . 0 0 "[ . 1 . 2]" 1
1289 1 91 ILE HG13 1 94 ASP HB2 . . 3.430 2.627 1.979 4.206 0.776 7 6 "[* . + *1 - .* * 2]" 1
1290 1 91 ILE HG13 1 95 MET H . . 4.980 3.868 3.637 4.048 . 0 0 "[ . 1 . 2]" 1
1291 1 91 ILE MG 1 92 LYS H . . 3.430 3.476 3.346 3.581 0.151 11 0 "[ . 1 . 2]" 1
1292 1 91 ILE MG 1 93 THR H . . 3.900 4.013 3.941 4.071 0.171 15 0 "[ . 1 . 2]" 1
1293 1 92 LYS H 1 92 LYS HB2 . . 3.190 2.498 2.248 3.556 0.366 20 0 "[ . 1 . 2]" 1
1294 1 92 LYS H 1 92 LYS HG2 . . 3.810 3.790 3.168 4.584 0.774 18 4 "[ * . 1*- . + 2]" 1
1295 1 92 LYS H 1 93 THR H . . 3.980 2.239 2.005 2.518 . 0 0 "[ . 1 . 2]" 1
1296 1 92 LYS H 1 94 ASP H . . 4.870 3.939 3.682 4.195 . 0 0 "[ . 1 . 2]" 1
1297 1 92 LYS HA 1 92 LYS HB3 . . 2.990 2.631 2.483 2.982 . 0 0 "[ . 1 . 2]" 1
1298 1 92 LYS HA 1 92 LYS QD . . 3.610 3.409 2.940 3.785 0.175 3 0 "[ . 1 . 2]" 1
1299 1 92 LYS HA 1 92 LYS HG3 . . 3.430 2.951 2.030 3.551 0.121 20 0 "[ . 1 . 2]" 1
1300 1 92 LYS HA 1 94 ASP H . . 4.120 3.578 3.438 3.737 . 0 0 "[ . 1 . 2]" 1
1301 1 92 LYS HA 1 95 MET H . . 3.890 3.227 2.962 3.407 . 0 0 "[ . 1 . 2]" 1
1302 1 92 LYS HA 1 95 MET HB2 . . 3.560 2.834 2.217 3.571 0.011 6 0 "[ . 1 . 2]" 1
1303 1 92 LYS HA 1 95 MET HG2 . . 3.360 3.226 2.963 3.405 0.045 9 0 "[ . 1 . 2]" 1
1304 1 92 LYS HA 1 95 MET HG3 . . 3.360 3.047 2.001 3.379 0.019 12 0 "[ . 1 . 2]" 1
1305 1 92 LYS HB2 1 93 THR H . . 3.970 3.837 3.483 4.533 0.563 20 3 "[ * . 1 - +]" 1
1306 1 92 LYS QD 1 92 LYS HG2 . . 2.530 2.358 2.185 2.572 0.042 2 0 "[ . 1 . 2]" 1
1307 1 92 LYS QE 1 92 LYS HG2 . . 3.300 2.657 1.998 3.475 0.175 8 0 "[ . 1 . 2]" 1
1308 1 93 THR H 1 93 THR MG . . 3.300 2.709 1.967 3.380 0.080 17 0 "[ . 1 . 2]" 1
1309 1 93 THR H 1 94 ASP H . . 3.650 2.225 2.045 2.449 . 0 0 "[ . 1 . 2]" 1
1310 1 93 THR HA 1 93 THR HB . . 2.950 2.653 2.354 2.967 0.017 17 0 "[ . 1 . 2]" 1
1311 1 93 THR HA 1 93 THR MG . . 2.730 2.659 2.256 2.806 0.076 5 0 "[ . 1 . 2]" 1
1312 1 93 THR HA 1 95 MET H . . 3.990 3.976 3.850 4.044 0.054 19 0 "[ . 1 . 2]" 1
1313 1 94 ASP H 1 94 ASP HB2 . . 3.510 2.669 2.185 3.645 0.135 13 0 "[ . 1 . 2]" 1
1314 1 94 ASP H 1 94 ASP HB3 . . 3.670 3.337 3.072 3.589 . 0 0 "[ . 1 . 2]" 1
1315 1 94 ASP H 1 95 MET H . . 3.100 1.955 1.877 2.078 . 0 0 "[ . 1 . 2]" 1
1316 1 94 ASP HA 1 112 ARG HD2 . . 3.990 3.331 2.044 4.136 0.146 14 0 "[ . 1 . 2]" 1
1317 1 94 ASP HA 1 112 ARG HD3 . . 4.120 2.826 1.995 3.721 . 0 0 "[ . 1 . 2]" 1
1318 1 94 ASP HB2 1 116 ALA MB . . 3.670 3.159 2.209 3.563 . 0 0 "[ . 1 . 2]" 1
1319 1 94 ASP HB3 1 95 MET H . . 4.480 3.913 3.552 4.438 . 0 0 "[ . 1 . 2]" 1
1320 1 94 ASP HB3 1 113 THR HA . . 3.990 3.066 2.210 4.575 0.585 18 1 "[ . 1 . + 2]" 1
1321 1 94 ASP HB3 1 116 ALA MB . . 3.330 2.880 2.385 3.420 0.090 13 0 "[ . 1 . 2]" 1
1322 1 95 MET H 1 95 MET HB2 . . 3.210 2.300 2.166 2.520 . 0 0 "[ . 1 . 2]" 1
1323 1 95 MET H 1 95 MET HB3 . . 3.650 3.511 3.454 3.536 . 0 0 "[ . 1 . 2]" 1
1324 1 95 MET H 1 95 MET HG2 . . 3.390 2.473 2.211 2.895 . 0 0 "[ . 1 . 2]" 1
1325 1 95 MET H 1 95 MET HG3 . . 3.670 3.562 2.673 3.722 0.052 20 0 "[ . 1 . 2]" 1
1326 1 95 MET H 1 96 PHE H . . 4.550 4.629 4.592 4.656 0.106 16 0 "[ . 1 . 2]" 1
1327 1 95 MET H 1 113 THR HA . . 4.980 4.956 4.746 5.055 0.075 13 0 "[ . 1 . 2]" 1
1328 1 95 MET H 1 113 THR HG1 . . 4.820 4.280 3.879 4.796 . 0 0 "[ . 1 . 2]" 1
1329 1 95 MET H 1 113 THR MG . . 5.500 5.037 4.154 5.498 . 0 0 "[ . 1 . 2]" 1
1330 1 95 MET HA 1 95 MET ME . . 3.730 3.515 2.045 3.822 0.092 9 0 "[ . 1 . 2]" 1
1331 1 95 MET HA 1 96 PHE H . . 3.130 2.341 2.226 2.545 . 0 0 "[ . 1 . 2]" 1
1332 1 95 MET HA 1 113 THR HG1 . . 3.610 2.307 1.953 2.711 . 0 0 "[ . 1 . 2]" 1
1333 1 95 MET HA 1 113 THR MG . . 3.510 2.927 1.986 3.476 . 0 0 "[ . 1 . 2]" 1
1334 1 95 MET HB2 1 96 PHE H . . 4.180 4.055 3.633 4.203 0.023 7 0 "[ . 1 . 2]" 1
1335 1 95 MET HB3 1 96 PHE H . . 3.800 2.914 2.368 3.338 . 0 0 "[ . 1 . 2]" 1
1336 1 95 MET ME 1 95 MET HG3 . . 3.470 2.420 2.210 3.348 . 0 0 "[ . 1 . 2]" 1
1337 1 95 MET ME 1 96 PHE H . . 4.640 3.939 3.179 4.277 . 0 0 "[ . 1 . 2]" 1
1338 1 95 MET ME 1 113 THR MG . . 3.610 3.182 2.409 3.631 0.021 13 0 "[ . 1 . 2]" 1
1339 1 96 PHE H 1 96 PHE HB3 . . 3.990 2.884 2.733 3.025 . 0 0 "[ . 1 . 2]" 1
1340 1 96 PHE H 1 96 PHE QD . . 3.210 2.646 2.086 2.994 . 0 0 "[ . 1 . 2]" 1
1341 1 96 PHE H 1 97 GLN H . . 4.920 4.456 4.387 4.507 . 0 0 "[ . 1 . 2]" 1
1342 1 96 PHE H 1 110 VAL HA . . 4.920 4.787 4.456 4.946 0.026 19 0 "[ . 1 . 2]" 1
1343 1 96 PHE H 1 113 THR HG1 . . 3.600 3.206 2.844 3.614 0.014 3 0 "[ . 1 . 2]" 1
1344 1 96 PHE H 1 113 THR MG . . 3.730 3.410 2.500 3.768 0.038 15 0 "[ . 1 . 2]" 1
1345 1 96 PHE HA 1 97 GLN H . . 3.310 2.645 2.583 2.749 . 0 0 "[ . 1 . 2]" 1
1346 1 96 PHE HA 1 109 ALA MB . . 3.470 3.134 2.718 3.373 . 0 0 "[ . 1 . 2]" 1
1347 1 96 PHE HB2 1 97 GLN H . . 3.530 2.224 2.022 2.328 . 0 0 "[ . 1 . 2]" 1
1348 1 96 PHE HB2 1 100 ASP HB2 . . 4.120 2.438 2.228 2.842 . 0 0 "[ . 1 . 2]" 1
1349 1 96 PHE HB2 1 109 ALA MB . . 3.470 2.547 2.156 2.890 . 0 0 "[ . 1 . 2]" 1
1350 1 96 PHE HB2 1 110 VAL MG2 . . 3.890 3.231 2.524 3.557 . 0 0 "[ . 1 . 2]" 1
1351 1 96 PHE HB3 1 97 GLN H . . 3.730 3.700 3.557 3.759 0.029 10 0 "[ . 1 . 2]" 1
1352 1 96 PHE HB3 1 109 ALA MB . . 3.040 2.323 1.968 2.900 . 0 0 "[ . 1 . 2]" 1
1353 1 96 PHE HB3 1 110 VAL H . . 4.920 3.680 3.303 3.886 . 0 0 "[ . 1 . 2]" 1
1354 1 96 PHE HB3 1 110 VAL HA . . 3.730 3.089 2.310 3.520 . 0 0 "[ . 1 . 2]" 1
1355 1 96 PHE HB3 1 110 VAL MG2 . . 4.120 3.691 3.313 4.038 . 0 0 "[ . 1 . 2]" 1
1356 1 96 PHE QD 1 97 GLN H . . 3.700 2.762 2.568 3.132 . 0 0 "[ . 1 . 2]" 1
1357 1 96 PHE QD 1 100 ASP HB2 . . 3.400 2.491 2.049 2.947 . 0 0 "[ . 1 . 2]" 1
1358 1 96 PHE QD 1 101 LEU HB2 . . 3.820 3.633 3.194 3.936 0.116 20 0 "[ . 1 . 2]" 1
1359 1 96 PHE QD 1 110 VAL HA . . 3.000 2.354 2.054 2.872 . 0 0 "[ . 1 . 2]" 1
1360 1 96 PHE QD 1 110 VAL MG1 . . 3.960 3.815 3.278 3.979 0.019 10 0 "[ . 1 . 2]" 1
1361 1 96 PHE QD 1 110 VAL MG2 . . 3.530 3.160 2.241 3.544 0.014 4 0 "[ . 1 . 2]" 1
1362 1 96 PHE QD 1 113 THR H . . 3.820 3.348 3.007 3.875 0.055 3 0 "[ . 1 . 2]" 1
1363 1 96 PHE QD 1 113 THR HB . . 2.920 2.331 1.992 2.751 . 0 0 "[ . 1 . 2]" 1
1364 1 96 PHE QD 1 113 THR HG1 . . 3.700 2.620 2.032 3.562 . 0 0 "[ . 1 . 2]" 1
1365 1 96 PHE QD 1 113 THR MG . . 3.180 2.977 2.210 3.180 0.000 4 0 "[ . 1 . 2]" 1
1366 1 96 PHE QE 1 101 LEU HB2 . . 2.920 2.941 2.256 3.507 0.587 16 3 "[ . * 1 .+ -]" 1
1367 1 96 PHE QE 1 101 LEU HB3 . . 3.530 2.455 2.000 2.920 . 0 0 "[ . 1 . 2]" 1
1368 1 96 PHE QE 1 101 LEU MD2 . . 3.300 2.395 2.048 2.696 . 0 0 "[ . 1 . 2]" 1
1369 1 96 PHE QE 1 110 VAL HA . . 3.810 3.181 2.757 3.813 0.003 3 0 "[ . 1 . 2]" 1
1370 1 96 PHE QE 1 110 VAL MG1 . . 3.350 3.158 2.988 3.360 0.010 5 0 "[ . 1 . 2]" 1
1371 1 96 PHE QE 1 110 VAL MG2 . . 3.810 3.568 2.933 3.825 0.015 9 0 "[ . 1 . 2]" 1
1372 1 96 PHE QE 1 113 THR HB . . 3.530 2.557 2.180 3.340 . 0 0 "[ . 1 . 2]" 1
1373 1 96 PHE QE 1 113 THR MG . . 3.190 2.443 2.034 2.932 . 0 0 "[ . 1 . 2]" 1
1374 1 96 PHE HZ 1 101 LEU MD2 . . 3.400 2.202 1.944 2.687 . 0 0 "[ . 1 . 2]" 1
1375 1 97 GLN H 1 97 GLN HB2 . . 3.810 2.285 2.209 2.435 . 0 0 "[ . 1 . 2]" 1
1376 1 97 GLN H 1 97 GLN HB3 . . 3.510 3.522 3.448 3.631 0.121 18 0 "[ . 1 . 2]" 1
1377 1 97 GLN H 1 97 GLN HG2 . . 3.810 3.537 3.198 3.740 . 0 0 "[ . 1 . 2]" 1
1378 1 97 GLN H 1 97 GLN HG3 . . 3.670 3.394 3.018 3.703 0.033 1 0 "[ . 1 . 2]" 1
1379 1 97 GLN H 1 99 VAL QG . . 5.270 4.123 3.970 4.210 . 0 0 "[ . 1 . 2]" 1
1380 1 97 GLN H 1 100 ASP H . . 4.730 3.543 3.303 3.708 . 0 0 "[ . 1 . 2]" 1
1381 1 97 GLN H 1 100 ASP HB2 . . 4.220 2.434 2.092 2.702 . 0 0 "[ . 1 . 2]" 1
1382 1 97 GLN H 1 100 ASP HB3 . . 4.270 3.519 3.255 3.645 . 0 0 "[ . 1 . 2]" 1
1383 1 97 GLN H 1 109 ALA MB . . 4.120 3.871 3.257 4.116 . 0 0 "[ . 1 . 2]" 1
1384 1 97 GLN H 1 110 VAL MG2 . . 5.110 4.660 3.797 5.044 . 0 0 "[ . 1 . 2]" 1
1385 1 97 GLN HA 1 97 GLN HG2 . . 3.730 2.128 2.038 2.280 . 0 0 "[ . 1 . 2]" 1
1386 1 97 GLN HA 1 97 GLN HG3 . . 3.560 3.355 3.209 3.566 0.006 5 0 "[ . 1 . 2]" 1
1387 1 97 GLN HB2 1 97 GLN HG3 . . 2.870 2.282 2.265 2.323 . 0 0 "[ . 1 . 2]" 1
1388 1 97 GLN HB2 1 98 THR H . . 4.550 4.316 4.197 4.371 . 0 0 "[ . 1 . 2]" 1
1389 1 97 GLN HB2 1 100 ASP H . . 4.550 2.691 2.448 2.971 . 0 0 "[ . 1 . 2]" 1
1390 1 97 GLN HB3 1 97 GLN HG3 . . 3.020 2.928 2.819 2.998 . 0 0 "[ . 1 . 2]" 1
1391 1 97 GLN HB3 1 98 THR H . . 4.920 3.207 3.055 3.345 . 0 0 "[ . 1 . 2]" 1
1392 1 97 GLN HB3 1 99 VAL H . . 4.820 2.620 2.298 2.829 . 0 0 "[ . 1 . 2]" 1
1393 1 97 GLN HB3 1 99 VAL QG . . 3.220 2.034 1.955 2.254 . 0 0 "[ . 1 . 2]" 1
1394 1 97 GLN HB3 1 100 ASP H . . 4.490 2.922 2.713 3.163 . 0 0 "[ . 1 . 2]" 1
1395 1 97 GLN HE22 1 97 GLN HG2 . . 4.150 3.612 3.447 4.099 . 0 0 "[ . 1 . 2]" 1
1396 1 97 GLN HE22 1 97 GLN HG3 . . 4.120 3.793 3.460 4.130 0.010 10 0 "[ . 1 . 2]" 1
1397 1 97 GLN HG2 1 98 THR H . . 5.500 4.010 3.788 4.373 . 0 0 "[ . 1 . 2]" 1
1398 1 98 THR H 1 98 THR MG . . 4.270 3.617 3.527 3.673 . 0 0 "[ . 1 . 2]" 1
1399 1 98 THR H 1 99 VAL H . . 4.870 2.983 2.832 3.101 . 0 0 "[ . 1 . 2]" 1
1400 1 98 THR H 1 99 VAL QG . . 5.190 4.018 3.548 4.211 . 0 0 "[ . 1 . 2]" 1
1401 1 98 THR HA 1 98 THR MG . . 2.960 2.376 2.268 2.489 . 0 0 "[ . 1 . 2]" 1
1402 1 98 THR HA 1 100 ASP H . . 5.040 4.656 4.439 4.758 . 0 0 "[ . 1 . 2]" 1
1403 1 98 THR HA 1 101 LEU H . . 4.590 3.638 3.537 3.859 . 0 0 "[ . 1 . 2]" 1
1404 1 98 THR HB 1 99 VAL H . . 3.510 2.750 2.481 3.145 . 0 0 "[ . 1 . 2]" 1
1405 1 98 THR MG 1 99 VAL H . . 4.550 3.840 3.646 4.102 . 0 0 "[ . 1 . 2]" 1
1406 1 98 THR MG 1 102 TYR HB2 . . 3.470 2.517 2.334 2.857 . 0 0 "[ . 1 . 2]" 1
1407 1 98 THR MG 1 102 TYR HB3 . . 3.890 3.651 3.466 3.911 0.021 12 0 "[ . 1 . 2]" 1
1408 1 99 VAL H 1 99 VAL HB . . 3.560 2.669 2.256 3.586 0.026 20 0 "[ . 1 . 2]" 1
1409 1 99 VAL H 1 99 VAL QG . . 3.180 2.077 1.848 2.220 . 0 0 "[ . 1 . 2]" 1
1410 1 99 VAL H 1 100 ASP H . . 4.100 2.676 2.261 2.855 . 0 0 "[ . 1 . 2]" 1
1411 1 99 VAL HA 1 99 VAL HB . . 2.940 2.457 2.295 2.532 . 0 0 "[ . 1 . 2]" 1
1412 1 99 VAL HA 1 99 VAL QG . . 2.820 2.242 2.138 2.447 . 0 0 "[ . 1 . 2]" 1
1413 1 99 VAL HA 1 101 LEU H . . 4.270 3.651 3.487 3.703 . 0 0 "[ . 1 . 2]" 1
1414 1 99 VAL HA 1 102 TYR H . . 3.730 3.312 3.207 3.619 . 0 0 "[ . 1 . 2]" 1
1415 1 99 VAL HA 1 102 TYR HB2 . . 3.560 3.218 2.988 3.531 . 0 0 "[ . 1 . 2]" 1
1416 1 99 VAL HA 1 102 TYR HB3 . . 3.300 2.081 1.969 2.341 . 0 0 "[ . 1 . 2]" 1
1417 1 99 VAL HA 1 102 TYR QD . . 3.810 3.502 3.234 3.836 0.026 16 0 "[ . 1 . 2]" 1
1418 1 99 VAL HA 1 103 GLU H . . 3.390 2.328 2.002 2.484 . 0 0 "[ . 1 . 2]" 1
1419 1 99 VAL QG 1 100 ASP H . . 3.610 1.839 1.775 2.113 . 0 0 "[ . 1 . 2]" 1
1420 1 99 VAL QG 1 100 ASP HA . . 3.990 2.793 2.756 2.858 . 0 0 "[ . 1 . 2]" 1
1421 1 99 VAL QG 1 103 GLU H . . 4.270 3.121 2.717 3.870 . 0 0 "[ . 1 . 2]" 1
1422 1 99 VAL QG 1 103 GLU HB2 . . 3.990 2.249 1.769 3.307 . 0 0 "[ . 1 . 2]" 1
1423 1 99 VAL QG 1 103 GLU HG3 . . 3.610 2.377 1.913 3.412 . 0 0 "[ . 1 . 2]" 1
1424 1 99 VAL QG 1 105 LYS H . . 4.120 3.393 3.064 3.900 . 0 0 "[ . 1 . 2]" 1
1425 1 99 VAL QG 1 105 LYS HB2 . . 3.990 2.318 1.864 3.209 . 0 0 "[ . 1 . 2]" 1
1426 1 99 VAL QG 1 105 LYS QD . . 3.330 2.653 1.962 3.130 . 0 0 "[ . 1 . 2]" 1
1427 1 99 VAL QG 1 105 LYS QE . . 3.670 2.530 1.737 3.570 . 0 0 "[ . 1 . 2]" 1
1428 1 100 ASP H 1 100 ASP HB2 . . 3.670 2.593 2.386 2.706 . 0 0 "[ . 1 . 2]" 1
1429 1 100 ASP H 1 100 ASP HB3 . . 3.810 3.570 3.542 3.580 . 0 0 "[ . 1 . 2]" 1
1430 1 100 ASP H 1 101 LEU H . . 3.610 2.866 2.765 2.922 . 0 0 "[ . 1 . 2]" 1
1431 1 100 ASP H 1 105 LYS HB2 . . 4.870 3.613 3.140 4.138 . 0 0 "[ . 1 . 2]" 1
1432 1 100 ASP HA 1 105 LYS H . . 3.510 2.464 2.202 2.730 . 0 0 "[ . 1 . 2]" 1
1433 1 100 ASP HA 1 105 LYS HB2 . . 3.360 1.999 1.918 2.061 . 0 0 "[ . 1 . 2]" 1
1434 1 100 ASP HA 1 105 LYS HB3 . . 3.330 2.942 2.166 3.518 0.188 18 0 "[ . 1 . 2]" 1
1435 1 100 ASP HA 1 106 ASP H . . 3.170 2.076 1.934 2.488 . 0 0 "[ . 1 . 2]" 1
1436 1 100 ASP HA 1 106 ASP HB2 . . 3.990 3.359 2.983 3.936 . 0 0 "[ . 1 . 2]" 1
1437 1 100 ASP HB2 1 101 LEU H . . 4.120 2.875 2.788 3.045 . 0 0 "[ . 1 . 2]" 1
1438 1 100 ASP HB2 1 109 ALA MB . . 3.990 3.743 3.264 4.005 0.015 16 0 "[ . 1 . 2]" 1
1439 1 100 ASP HB2 1 110 VAL MG2 . . 3.990 3.081 2.221 3.435 . 0 0 "[ . 1 . 2]" 1
1440 1 100 ASP HB3 1 101 LEU H . . 3.990 3.884 3.767 4.000 0.010 18 0 "[ . 1 . 2]" 1
1441 1 100 ASP HB3 1 106 ASP H . . 4.270 2.781 2.425 3.069 . 0 0 "[ . 1 . 2]" 1
1442 1 100 ASP HB3 1 106 ASP HB3 . . 3.890 3.167 2.111 3.859 . 0 0 "[ . 1 . 2]" 1
1443 1 100 ASP HB3 1 109 ALA MB . . 3.730 2.964 2.524 3.364 . 0 0 "[ . 1 . 2]" 1
1444 1 100 ASP HB3 1 110 VAL MG2 . . 3.730 2.824 2.099 3.459 . 0 0 "[ . 1 . 2]" 1
1445 1 101 LEU H 1 101 LEU HB2 . . 3.760 3.030 2.971 3.128 . 0 0 "[ . 1 . 2]" 1
1446 1 101 LEU H 1 101 LEU HB3 . . 3.610 2.317 2.274 2.357 . 0 0 "[ . 1 . 2]" 1
1447 1 101 LEU H 1 101 LEU MD1 . . 4.480 4.228 4.203 4.304 . 0 0 "[ . 1 . 2]" 1
1448 1 101 LEU H 1 101 LEU MD2 . . 4.270 4.278 4.248 4.310 0.040 13 0 "[ . 1 . 2]" 1
1449 1 101 LEU H 1 102 TYR H . . 3.530 2.419 2.317 2.528 . 0 0 "[ . 1 . 2]" 1
1450 1 101 LEU H 1 102 TYR HB2 . . 4.180 4.233 4.136 4.347 0.167 14 0 "[ . 1 . 2]" 1
1451 1 101 LEU H 1 102 TYR HB3 . . 4.730 4.278 4.191 4.484 . 0 0 "[ . 1 . 2]" 1
1452 1 101 LEU H 1 103 GLU H . . 4.320 3.702 3.501 3.849 . 0 0 "[ . 1 . 2]" 1
1453 1 101 LEU H 1 104 GLY H . . 4.490 4.026 3.485 4.266 . 0 0 "[ . 1 . 2]" 1
1454 1 101 LEU H 1 104 GLY HA2 . . 4.920 4.644 4.532 4.793 . 0 0 "[ . 1 . 2]" 1
1455 1 101 LEU H 1 110 VAL MG2 . . 3.990 3.488 2.998 3.826 . 0 0 "[ . 1 . 2]" 1
1456 1 101 LEU HA 1 101 LEU MD1 . . 3.010 2.029 1.968 2.205 . 0 0 "[ . 1 . 2]" 1
1457 1 101 LEU HA 1 101 LEU MD2 . . 4.120 3.902 3.877 3.945 . 0 0 "[ . 1 . 2]" 1
1458 1 101 LEU HA 1 107 MET ME . . 3.990 3.348 2.703 3.978 . 0 0 "[ . 1 . 2]" 1
1459 1 101 LEU HA 1 110 VAL MG2 . . 3.300 2.113 1.934 2.487 . 0 0 "[ . 1 . 2]" 1
1460 1 101 LEU HB2 1 101 LEU MD2 . . 2.960 2.362 2.314 2.413 . 0 0 "[ . 1 . 2]" 1
1461 1 101 LEU HB2 1 102 TYR H . . 4.260 3.848 3.772 3.905 . 0 0 "[ . 1 . 2]" 1
1462 1 101 LEU HB2 1 110 VAL MG1 . . 3.990 2.680 2.055 3.327 . 0 0 "[ . 1 . 2]" 1
1463 1 101 LEU HB2 1 110 VAL MG2 . . 3.240 1.932 1.784 2.154 . 0 0 "[ . 1 . 2]" 1
1464 1 101 LEU HB3 1 101 LEU MD2 . . 3.330 2.290 2.249 2.330 . 0 0 "[ . 1 . 2]" 1
1465 1 101 LEU HB3 1 102 TYR H . . 3.890 2.409 2.332 2.492 . 0 0 "[ . 1 . 2]" 1
1466 1 101 LEU HB3 1 110 VAL MG2 . . 3.610 3.291 3.071 3.533 . 0 0 "[ . 1 . 2]" 1
1467 1 101 LEU MD1 1 102 TYR HA . . 4.270 4.006 3.823 4.242 . 0 0 "[ . 1 . 2]" 1
1468 1 101 LEU MD1 1 107 MET ME . . 2.990 2.717 2.075 2.999 0.009 4 0 "[ . 1 . 2]" 1
1469 1 101 LEU MD1 1 110 VAL MG1 . . 3.220 2.098 1.831 2.403 . 0 0 "[ . 1 . 2]" 1
1470 1 101 LEU MD1 1 110 VAL MG2 . . 3.220 2.281 1.922 3.114 . 0 0 "[ . 1 . 2]" 1
1471 1 101 LEU MD2 1 102 TYR H . . 4.800 3.901 3.578 4.005 . 0 0 "[ . 1 . 2]" 1
1472 1 101 LEU MD2 1 102 TYR HA . . 4.710 4.628 4.392 4.702 . 0 0 "[ . 1 . 2]" 1
1473 1 101 LEU MD2 1 110 VAL MG1 . . 2.940 2.695 2.341 2.952 0.012 1 0 "[ . 1 . 2]" 1
1474 1 101 LEU MD2 1 110 VAL MG2 . . 3.810 3.374 2.984 3.583 . 0 0 "[ . 1 . 2]" 1
1475 1 101 LEU HG 1 102 TYR H . . 4.480 2.931 2.604 3.068 . 0 0 "[ . 1 . 2]" 1
1476 1 101 LEU HG 1 102 TYR HA . . 3.810 3.264 3.080 3.343 . 0 0 "[ . 1 . 2]" 1
1477 1 102 TYR H 1 102 TYR HB2 . . 3.430 2.076 1.989 2.148 . 0 0 "[ . 1 . 2]" 1
1478 1 102 TYR H 1 102 TYR HB3 . . 3.670 2.654 2.544 2.766 . 0 0 "[ . 1 . 2]" 1
1479 1 102 TYR H 1 102 TYR QD . . 4.300 3.917 3.789 3.998 . 0 0 "[ . 1 . 2]" 1
1480 1 102 TYR H 1 103 GLU H . . 4.090 3.028 2.951 3.099 . 0 0 "[ . 1 . 2]" 1
1481 1 102 TYR H 1 104 GLY H . . 5.110 3.840 3.601 4.027 . 0 0 "[ . 1 . 2]" 1
1482 1 102 TYR HA 1 102 TYR QD . . 3.000 2.371 2.069 2.911 . 0 0 "[ . 1 . 2]" 1
1483 1 102 TYR HB2 1 103 GLU H . . 3.810 3.497 3.386 3.645 . 0 0 "[ . 1 . 2]" 1
1484 1 102 TYR HB3 1 103 GLU H . . 4.120 2.140 2.042 2.279 . 0 0 "[ . 1 . 2]" 1
1485 1 102 TYR QD 1 103 GLU H . . 3.820 3.662 3.306 3.835 0.015 12 0 "[ . 1 . 2]" 1
1486 1 102 TYR QD 1 103 GLU HG2 . . 3.000 2.313 1.988 2.919 . 0 0 "[ . 1 . 2]" 1
1487 1 103 GLU H 1 103 GLU HB2 . . 3.580 2.433 2.253 2.670 . 0 0 "[ . 1 . 2]" 1
1488 1 103 GLU H 1 103 GLU HB3 . . 3.670 3.607 3.518 3.709 0.039 13 0 "[ . 1 . 2]" 1
1489 1 103 GLU H 1 103 GLU HG2 . . 3.810 2.685 2.274 3.382 . 0 0 "[ . 1 . 2]" 1
1490 1 103 GLU H 1 104 GLY H . . 3.350 2.564 2.249 2.713 . 0 0 "[ . 1 . 2]" 1
1491 1 103 GLU H 1 104 GLY HA3 . . 5.110 5.057 4.903 5.124 0.014 3 0 "[ . 1 . 2]" 1
1492 1 103 GLU H 1 105 LYS H . . 4.410 3.549 3.213 3.964 . 0 0 "[ . 1 . 2]" 1
1493 1 103 GLU HA 1 103 GLU HG2 . . 3.360 2.728 2.426 3.129 . 0 0 "[ . 1 . 2]" 1
1494 1 103 GLU HA 1 105 LYS H . . 4.980 4.522 4.282 4.920 . 0 0 "[ . 1 . 2]" 1
1495 1 103 GLU HB2 1 104 GLY H . . 4.260 3.824 2.967 4.160 . 0 0 "[ . 1 . 2]" 1
1496 1 103 GLU HB2 1 105 LYS H . . 4.120 3.163 2.890 3.459 . 0 0 "[ . 1 . 2]" 1
1497 1 103 GLU HB2 1 105 LYS HG2 . . 4.120 3.878 2.331 4.139 0.019 14 0 "[ . 1 . 2]" 1
1498 1 103 GLU HB2 1 105 LYS HG3 . . 3.890 2.570 2.094 3.146 . 0 0 "[ . 1 . 2]" 1
1499 1 103 GLU HB3 1 104 GLY H . . 4.590 4.382 3.685 4.607 0.017 13 0 "[ . 1 . 2]" 1
1500 1 105 LYS H 1 105 LYS HB2 . . 3.300 2.133 2.006 2.743 . 0 0 "[ . 1 . 2]" 1
1501 1 105 LYS H 1 105 LYS HB3 . . 3.650 3.393 3.230 3.531 . 0 0 "[ . 1 . 2]" 1
1502 1 105 LYS H 1 105 LYS QE . . 5.110 4.861 4.180 5.166 0.056 9 0 "[ . 1 . 2]" 1
1503 1 105 LYS H 1 105 LYS HG2 . . 3.890 3.564 2.162 3.838 . 0 0 "[ . 1 . 2]" 1
1504 1 105 LYS H 1 105 LYS HG3 . . 3.990 3.109 2.236 3.749 . 0 0 "[ . 1 . 2]" 1
1505 1 105 LYS H 1 106 ASP H . . 3.490 2.719 2.477 2.988 . 0 0 "[ . 1 . 2]" 1
1506 1 105 LYS HA 1 105 LYS HG2 . . 3.810 2.070 1.919 2.629 . 0 0 "[ . 1 . 2]" 1
1507 1 105 LYS HA 1 105 LYS HG3 . . 3.610 3.089 2.749 3.703 0.093 18 0 "[ . 1 . 2]" 1
1508 1 105 LYS HB2 1 106 ASP H . . 3.990 3.032 2.032 3.553 . 0 0 "[ . 1 . 2]" 1
1509 1 105 LYS HB3 1 106 ASP H . . 3.670 3.378 2.821 3.658 . 0 0 "[ . 1 . 2]" 1
1510 1 105 LYS QE 1 105 LYS HG2 . . 3.110 2.811 2.120 3.334 0.224 13 0 "[ . 1 . 2]" 1
1511 1 105 LYS QE 1 105 LYS HG3 . . 3.560 2.399 1.978 3.465 . 0 0 "[ . 1 . 2]" 1
1512 1 106 ASP H 1 106 ASP HB3 . . 4.120 3.522 2.815 3.827 . 0 0 "[ . 1 . 2]" 1
1513 1 106 ASP H 1 107 MET H . . 4.470 3.869 3.519 4.230 . 0 0 "[ . 1 . 2]" 1
1514 1 106 ASP HA 1 107 MET H . . 3.140 2.276 2.253 2.342 . 0 0 "[ . 1 . 2]" 1
1515 1 106 ASP HA 1 109 ALA H . . 4.590 4.414 4.115 4.599 0.009 7 0 "[ . 1 . 2]" 1
1516 1 106 ASP HB2 1 109 ALA H . . 4.620 4.278 3.791 4.909 0.289 8 0 "[ . 1 . 2]" 1
1517 1 106 ASP HB2 1 109 ALA MB . . 3.730 3.287 2.696 3.842 0.112 8 0 "[ . 1 . 2]" 1
1518 1 106 ASP HB3 1 107 MET H . . 4.730 3.945 3.657 4.321 . 0 0 "[ . 1 . 2]" 1
1519 1 106 ASP HB3 1 109 ALA MB . . 3.810 2.489 2.028 2.848 . 0 0 "[ . 1 . 2]" 1
1520 1 107 MET H 1 107 MET HB2 . . 3.540 2.534 2.229 3.084 . 0 0 "[ . 1 . 2]" 1
1521 1 107 MET H 1 107 MET HB3 . . 3.990 3.240 2.012 3.571 . 0 0 "[ . 1 . 2]" 1
1522 1 107 MET H 1 107 MET ME . . 4.120 4.138 3.993 4.317 0.197 15 0 "[ . 1 . 2]" 1
1523 1 107 MET H 1 107 MET HG2 . . 3.990 2.813 1.949 4.347 0.357 14 0 "[ . 1 . 2]" 1
1524 1 107 MET H 1 107 MET HG3 . . 3.730 3.341 2.778 4.259 0.529 15 2 "[ . - 1 + 2]" 1
1525 1 107 MET H 1 108 ALA H . . 3.500 2.439 2.223 2.635 . 0 0 "[ . 1 . 2]" 1
1526 1 107 MET H 1 108 ALA MB . . 4.270 3.923 3.716 4.098 . 0 0 "[ . 1 . 2]" 1
1527 1 107 MET H 1 109 ALA H . . 5.040 4.104 3.843 4.589 . 0 0 "[ . 1 . 2]" 1
1528 1 107 MET H 1 110 VAL MG2 . . 5.270 4.283 4.017 4.478 . 0 0 "[ . 1 . 2]" 1
1529 1 107 MET HA 1 107 MET ME . . 3.430 2.241 2.012 2.676 . 0 0 "[ . 1 . 2]" 1
1530 1 107 MET HA 1 110 VAL H . . 3.870 3.075 2.741 3.433 . 0 0 "[ . 1 . 2]" 1
1531 1 107 MET HA 1 110 VAL HB . . 3.510 2.530 2.159 2.903 . 0 0 "[ . 1 . 2]" 1
1532 1 107 MET HA 1 110 VAL MG2 . . 3.330 2.180 1.967 2.622 . 0 0 "[ . 1 . 2]" 1
1533 1 107 MET HA 1 111 GLN H . . 4.690 4.442 4.114 4.623 . 0 0 "[ . 1 . 2]" 1
1534 1 107 MET HB2 1 107 MET HG2 . . 3.040 2.727 2.413 2.986 . 0 0 "[ . 1 . 2]" 1
1535 1 107 MET HB2 1 108 ALA H . . 4.220 2.977 2.352 4.144 . 0 0 "[ . 1 . 2]" 1
1536 1 107 MET ME 1 107 MET HG2 . . 3.190 2.641 2.082 3.388 0.198 3 0 "[ . 1 . 2]" 1
1537 1 107 MET ME 1 107 MET HG3 . . 3.430 3.036 2.421 3.369 . 0 0 "[ . 1 . 2]" 1
1538 1 107 MET ME 1 110 VAL H . . 4.780 4.458 4.254 4.787 0.007 3 0 "[ . 1 . 2]" 1
1539 1 107 MET ME 1 110 VAL HB . . 3.890 2.840 2.594 3.239 . 0 0 "[ . 1 . 2]" 1
1540 1 107 MET ME 1 110 VAL MG1 . . 3.040 2.793 2.365 3.060 0.020 8 0 "[ . 1 . 2]" 1
1541 1 107 MET ME 1 110 VAL MG2 . . 3.390 2.600 2.198 3.098 . 0 0 "[ . 1 . 2]" 1
1542 1 107 MET HG2 1 108 ALA H . . 5.040 4.241 3.300 4.667 . 0 0 "[ . 1 . 2]" 1
1543 1 108 ALA H 1 108 ALA MB . . 2.790 1.980 1.933 2.174 . 0 0 "[ . 1 . 2]" 1
1544 1 108 ALA H 1 109 ALA H . . 3.370 2.852 2.692 3.034 . 0 0 "[ . 1 . 2]" 1
1545 1 108 ALA H 1 110 VAL H . . 4.730 4.448 4.246 4.604 . 0 0 "[ . 1 . 2]" 1
1546 1 108 ALA HA 1 110 VAL H . . 4.870 4.852 4.774 4.893 0.023 3 0 "[ . 1 . 2]" 1
1547 1 108 ALA HA 1 111 GLN H . . 3.890 3.712 3.483 3.886 . 0 0 "[ . 1 . 2]" 1
1548 1 108 ALA HA 1 111 GLN HB2 . . 3.390 3.135 2.743 3.399 0.009 8 0 "[ . 1 . 2]" 1
1549 1 109 ALA H 1 109 ALA MB . . 2.770 2.138 2.056 2.207 . 0 0 "[ . 1 . 2]" 1
1550 1 109 ALA H 1 110 VAL H . . 3.530 2.667 2.435 3.050 . 0 0 "[ . 1 . 2]" 1
1551 1 109 ALA H 1 110 VAL MG2 . . 4.660 3.985 3.805 4.254 . 0 0 "[ . 1 . 2]" 1
1552 1 109 ALA HA 1 112 ARG H . . 4.120 2.945 2.885 3.061 . 0 0 "[ . 1 . 2]" 1
1553 1 109 ALA HA 1 112 ARG HB2 . . 3.390 2.205 1.999 2.464 . 0 0 "[ . 1 . 2]" 1
1554 1 109 ALA HA 1 112 ARG HB3 . . 3.430 3.290 3.012 3.447 0.017 14 0 "[ . 1 . 2]" 1
1555 1 109 ALA MB 1 110 VAL H . . 3.300 2.335 2.173 2.486 . 0 0 "[ . 1 . 2]" 1
1556 1 109 ALA MB 1 110 VAL HA . . 3.890 3.719 3.671 3.768 . 0 0 "[ . 1 . 2]" 1
1557 1 109 ALA MB 1 110 VAL MG2 . . 3.670 3.167 2.915 3.319 . 0 0 "[ . 1 . 2]" 1
1558 1 109 ALA MB 1 111 GLN H . . 4.960 4.194 4.119 4.290 . 0 0 "[ . 1 . 2]" 1
1559 1 109 ALA MB 1 112 ARG H . . 4.280 4.322 4.284 4.377 0.097 3 0 "[ . 1 . 2]" 1
1560 1 110 VAL H 1 110 VAL HB . . 3.270 2.500 2.416 2.677 . 0 0 "[ . 1 . 2]" 1
1561 1 110 VAL H 1 110 VAL MG1 . . 3.700 3.709 3.690 3.713 0.013 13 0 "[ . 1 . 2]" 1
1562 1 110 VAL H 1 110 VAL MG2 . . 2.920 2.013 1.876 2.235 . 0 0 "[ . 1 . 2]" 1
1563 1 110 VAL H 1 111 GLN H . . 3.570 2.897 2.788 2.966 . 0 0 "[ . 1 . 2]" 1
1564 1 110 VAL H 1 111 GLN HA . . 5.500 5.373 5.284 5.426 . 0 0 "[ . 1 . 2]" 1
1565 1 110 VAL H 1 112 ARG H . . 4.780 4.530 4.347 4.633 . 0 0 "[ . 1 . 2]" 1
1566 1 110 VAL HA 1 110 VAL MG1 . . 3.110 2.417 2.311 2.511 . 0 0 "[ . 1 . 2]" 1
1567 1 110 VAL HA 1 110 VAL MG2 . . 3.090 2.299 2.175 2.406 . 0 0 "[ . 1 . 2]" 1
1568 1 110 VAL HA 1 113 THR H . . 3.990 3.879 3.781 3.981 . 0 0 "[ . 1 . 2]" 1
1569 1 110 VAL HB 1 111 GLN H . . 3.300 2.914 2.673 3.043 . 0 0 "[ . 1 . 2]" 1
1570 1 110 VAL MG1 1 111 GLN H . . 3.730 3.678 3.450 3.744 0.014 9 0 "[ . 1 . 2]" 1
1571 1 110 VAL MG1 1 111 GLN HA . . 3.890 3.646 3.411 3.869 . 0 0 "[ . 1 . 2]" 1
1572 1 110 VAL MG1 1 113 THR H . . 5.270 4.819 4.664 4.988 . 0 0 "[ . 1 . 2]" 1
1573 1 110 VAL MG1 1 114 LEU H . . 4.690 4.387 4.196 4.592 . 0 0 "[ . 1 . 2]" 1
1574 1 110 VAL MG1 1 114 LEU MD1 . . 3.170 2.710 2.321 3.070 . 0 0 "[ . 1 . 2]" 1
1575 1 110 VAL MG1 1 114 LEU HG . . 3.890 3.692 3.332 3.902 0.012 3 0 "[ . 1 . 2]" 1
1576 1 110 VAL MG2 1 111 GLN H . . 4.120 3.999 3.752 4.104 . 0 0 "[ . 1 . 2]" 1
1577 1 111 GLN H 1 111 GLN HB2 . . 3.390 2.305 2.219 2.345 . 0 0 "[ . 1 . 2]" 1
1578 1 111 GLN H 1 111 GLN HB3 . . 3.730 3.537 3.495 3.556 . 0 0 "[ . 1 . 2]" 1
1579 1 111 GLN H 1 111 GLN HG2 . . 3.880 3.843 3.589 3.893 0.013 5 0 "[ . 1 . 2]" 1
1580 1 111 GLN H 1 111 GLN HG3 . . 3.430 2.604 2.472 2.865 . 0 0 "[ . 1 . 2]" 1
1581 1 111 GLN H 1 112 ARG H . . 3.790 2.540 2.458 2.663 . 0 0 "[ . 1 . 2]" 1
1582 1 111 GLN H 1 114 LEU MD1 . . 4.920 4.645 4.177 4.921 0.001 14 0 "[ . 1 . 2]" 1
1583 1 111 GLN HA 1 111 GLN HB2 . . 2.990 3.039 3.023 3.045 0.055 8 0 "[ . 1 . 2]" 1
1584 1 111 GLN HA 1 111 GLN HG2 . . 2.760 2.548 2.194 2.741 . 0 0 "[ . 1 . 2]" 1
1585 1 111 GLN HA 1 111 GLN HG3 . . 3.560 2.724 2.523 3.023 . 0 0 "[ . 1 . 2]" 1
1586 1 111 GLN HA 1 114 LEU H . . 4.390 3.313 3.059 3.501 . 0 0 "[ . 1 . 2]" 1
1587 1 111 GLN HA 1 114 LEU HB2 . . 3.890 2.938 2.582 3.146 . 0 0 "[ . 1 . 2]" 1
1588 1 111 GLN HA 1 114 LEU MD1 . . 3.560 2.619 2.036 2.989 . 0 0 "[ . 1 . 2]" 1
1589 1 111 GLN HA 1 115 MET H . . 4.480 3.665 3.396 4.076 . 0 0 "[ . 1 . 2]" 1
1590 1 111 GLN HB2 1 112 ARG H . . 3.770 2.525 2.443 2.703 . 0 0 "[ . 1 . 2]" 1
1591 1 111 GLN HB2 1 113 THR H . . 4.820 4.862 4.842 4.886 0.066 17 0 "[ . 1 . 2]" 1
1592 1 111 GLN HB3 1 112 ARG H . . 3.370 3.385 3.362 3.418 0.048 3 0 "[ . 1 . 2]" 1
1593 1 111 GLN HE22 1 111 GLN HG3 . . 4.120 3.865 3.585 4.086 . 0 0 "[ . 1 . 2]" 1
1594 1 111 GLN HG3 1 112 ARG H . . 4.690 4.499 4.424 4.672 . 0 0 "[ . 1 . 2]" 1
1595 1 112 ARG H 1 112 ARG HB2 . . 3.190 2.068 2.045 2.101 . 0 0 "[ . 1 . 2]" 1
1596 1 112 ARG H 1 112 ARG HB3 . . 3.220 3.155 3.075 3.253 0.033 9 0 "[ . 1 . 2]" 1
1597 1 112 ARG H 1 112 ARG HG3 . . 3.890 3.869 3.630 3.968 0.078 13 0 "[ . 1 . 2]" 1
1598 1 112 ARG H 1 113 THR H . . 3.890 2.922 2.859 2.959 . 0 0 "[ . 1 . 2]" 1
1599 1 112 ARG HA 1 112 ARG HG2 . . 3.610 2.664 2.017 3.236 . 0 0 "[ . 1 . 2]" 1
1600 1 112 ARG HA 1 112 ARG HG3 . . 3.670 2.548 2.018 3.271 . 0 0 "[ . 1 . 2]" 1
1601 1 112 ARG HA 1 115 MET H . . 3.890 3.861 3.756 3.914 0.024 13 0 "[ . 1 . 2]" 1
1602 1 112 ARG HA 1 115 MET QB . . 3.270 2.458 2.303 2.635 . 0 0 "[ . 1 . 2]" 1
1603 1 112 ARG HB2 1 112 ARG HD2 . . 3.670 2.638 2.015 3.525 . 0 0 "[ . 1 . 2]" 1
1604 1 112 ARG HB2 1 112 ARG HD3 . . 3.560 3.474 3.104 3.716 0.156 19 0 "[ . 1 . 2]" 1
1605 1 112 ARG HB2 1 113 THR H . . 3.720 3.538 3.413 3.631 . 0 0 "[ . 1 . 2]" 1
1606 1 112 ARG HB3 1 112 ARG HD2 . . 3.670 2.807 2.384 3.209 . 0 0 "[ . 1 . 2]" 1
1607 1 112 ARG HB3 1 112 ARG HD3 . . 3.730 3.035 1.993 3.748 0.018 6 0 "[ . 1 . 2]" 1
1608 1 112 ARG HB3 1 113 THR H . . 3.730 2.980 2.828 3.153 . 0 0 "[ . 1 . 2]" 1
1609 1 112 ARG HG3 1 113 THR H . . 4.870 5.147 4.930 5.451 0.581 17 7 "[ * * 1 .*+*-*]" 1
1610 1 113 THR H 1 113 THR HB . . 3.460 2.266 2.088 2.491 . 0 0 "[ . 1 . 2]" 1
1611 1 113 THR H 1 113 THR HG1 . . 3.670 2.699 2.038 3.598 . 0 0 "[ . 1 . 2]" 1
1612 1 113 THR H 1 113 THR MG . . 3.810 3.658 3.589 3.699 . 0 0 "[ . 1 . 2]" 1
1613 1 113 THR H 1 114 LEU H . . 3.350 2.818 2.643 2.928 . 0 0 "[ . 1 . 2]" 1
1614 1 113 THR HA 1 113 THR HG1 . . 3.020 2.401 1.980 2.874 . 0 0 "[ . 1 . 2]" 1
1615 1 113 THR HA 1 113 THR MG . . 2.920 2.422 2.225 2.608 . 0 0 "[ . 1 . 2]" 1
1616 1 113 THR HA 1 116 ALA H . . 3.730 3.545 3.333 3.666 . 0 0 "[ . 1 . 2]" 1
1617 1 113 THR HA 1 116 ALA MB . . 3.240 2.971 2.667 3.225 . 0 0 "[ . 1 . 2]" 1
1618 1 113 THR HB 1 114 LEU H . . 3.840 2.323 2.123 2.570 . 0 0 "[ . 1 . 2]" 1
1619 1 113 THR HG1 1 113 THR MG . . 3.110 2.706 2.291 3.017 . 0 0 "[ . 1 . 2]" 1
1620 1 113 THR MG 1 114 LEU H . . 3.730 2.971 2.554 3.404 . 0 0 "[ . 1 . 2]" 1
1621 1 113 THR MG 1 114 LEU HG . . 3.890 3.272 2.614 3.910 0.020 3 0 "[ . 1 . 2]" 1
1622 1 114 LEU H 1 114 LEU HB2 . . 3.570 2.511 2.390 2.586 . 0 0 "[ . 1 . 2]" 1
1623 1 114 LEU H 1 114 LEU HB3 . . 3.810 3.535 3.527 3.544 . 0 0 "[ . 1 . 2]" 1
1624 1 114 LEU H 1 114 LEU MD1 . . 3.890 3.212 3.046 3.335 . 0 0 "[ . 1 . 2]" 1
1625 1 114 LEU H 1 114 LEU MD2 . . 3.670 3.460 3.283 3.670 0.000 8 0 "[ . 1 . 2]" 1
1626 1 114 LEU H 1 114 LEU HG . . 3.240 2.061 1.929 2.297 . 0 0 "[ . 1 . 2]" 1
1627 1 114 LEU H 1 115 MET H . . 3.650 2.881 2.784 2.991 . 0 0 "[ . 1 . 2]" 1
1628 1 114 LEU HA 1 114 LEU MD2 . . 2.820 2.292 2.142 2.570 . 0 0 "[ . 1 . 2]" 1
1629 1 114 LEU HA 1 114 LEU HG . . 3.810 2.877 2.716 2.977 . 0 0 "[ . 1 . 2]" 1
1630 1 114 LEU HA 1 116 ALA H . . 4.150 3.932 3.683 4.145 . 0 0 "[ . 1 . 2]" 1
1631 1 114 LEU HA 1 117 LEU H . . 3.920 3.107 2.841 3.344 . 0 0 "[ . 1 . 2]" 1
1632 1 114 LEU HA 1 117 LEU HB2 . . 3.670 2.832 2.490 3.081 . 0 0 "[ . 1 . 2]" 1
1633 1 114 LEU HA 1 117 LEU HB3 . . 3.360 2.454 2.270 2.667 . 0 0 "[ . 1 . 2]" 1
1634 1 114 LEU HA 1 118 GLY H . . 4.260 3.506 3.198 3.765 . 0 0 "[ . 1 . 2]" 1
1635 1 114 LEU HB2 1 114 LEU MD1 . . 3.130 2.175 2.022 2.274 . 0 0 "[ . 1 . 2]" 1
1636 1 114 LEU HB2 1 114 LEU MD2 . . 3.470 3.184 3.151 3.198 . 0 0 "[ . 1 . 2]" 1
1637 1 114 LEU HB3 1 114 LEU MD1 . . 3.240 2.581 2.497 2.735 . 0 0 "[ . 1 . 2]" 1
1638 1 114 LEU HB3 1 115 MET H . . 4.030 3.632 3.490 3.811 . 0 0 "[ . 1 . 2]" 1
1639 1 114 LEU MD1 1 115 MET H . . 4.320 4.262 4.045 4.326 0.006 19 0 "[ . 1 . 2]" 1
1640 1 114 LEU MD2 1 115 MET H . . 4.810 4.823 4.775 4.848 0.038 3 0 "[ . 1 . 2]" 1
1641 1 115 MET H 1 115 MET QB . . 3.050 2.182 2.049 2.422 . 0 0 "[ . 1 . 2]" 1
1642 1 115 MET H 1 115 MET HG2 . . 3.470 2.938 2.043 3.372 . 0 0 "[ . 1 . 2]" 1
1643 1 115 MET H 1 115 MET HG3 . . 3.560 3.181 2.602 3.543 . 0 0 "[ . 1 . 2]" 1
1644 1 115 MET H 1 116 ALA H . . 3.300 2.905 2.829 2.952 . 0 0 "[ . 1 . 2]" 1
1645 1 115 MET HA 1 115 MET ME . . 3.670 3.038 2.497 3.607 . 0 0 "[ . 1 . 2]" 1
1646 1 115 MET HA 1 115 MET HG2 . . 3.730 2.214 2.041 3.010 . 0 0 "[ . 1 . 2]" 1
1647 1 115 MET HA 1 115 MET HG3 . . 3.890 3.449 3.146 3.725 . 0 0 "[ . 1 . 2]" 1
1648 1 115 MET HA 1 136 PHE QD . . 3.460 2.750 2.112 3.476 0.016 13 0 "[ . 1 . 2]" 1
1649 1 115 MET HA 1 136 PHE QE . . 3.400 2.709 1.994 3.421 0.021 19 0 "[ . 1 . 2]" 1
1650 1 115 MET QB 1 116 ALA H . . 3.470 2.790 2.679 2.946 . 0 0 "[ . 1 . 2]" 1
1651 1 115 MET ME 1 115 MET HG3 . . 3.220 2.990 2.156 3.212 . 0 0 "[ . 1 . 2]" 1
1652 1 115 MET ME 1 136 PHE QD . . 3.250 2.662 1.975 3.230 . 0 0 "[ . 1 . 2]" 1
1653 1 115 MET ME 1 136 PHE QE . . 3.810 3.247 2.086 3.813 0.003 3 0 "[ . 1 . 2]" 1
1654 1 115 MET HG2 1 116 ALA H . . 5.360 4.871 4.482 5.056 . 0 0 "[ . 1 . 2]" 1
1655 1 116 ALA H 1 116 ALA MB . . 2.820 2.096 1.967 2.213 . 0 0 "[ . 1 . 2]" 1
1656 1 116 ALA H 1 117 LEU H . . 3.530 2.475 2.220 2.725 . 0 0 "[ . 1 . 2]" 1
1657 1 116 ALA HA 1 119 SER H . . 3.990 3.718 3.477 3.946 . 0 0 "[ . 1 . 2]" 1
1658 1 116 ALA MB 1 117 LEU H . . 3.130 2.465 2.282 2.669 . 0 0 "[ . 1 . 2]" 1
1659 1 116 ALA MB 1 120 LEU H . . 4.490 4.365 4.263 4.480 . 0 0 "[ . 1 . 2]" 1
1660 1 116 ALA MB 1 120 LEU MD1 . . 3.990 2.881 2.603 3.500 . 0 0 "[ . 1 . 2]" 1
1661 1 117 LEU H 1 117 LEU HB2 . . 3.220 2.188 2.136 2.236 . 0 0 "[ . 1 . 2]" 1
1662 1 117 LEU H 1 117 LEU HB3 . . 3.300 2.731 2.657 2.792 . 0 0 "[ . 1 . 2]" 1
1663 1 117 LEU H 1 117 LEU MD1 . . 3.730 3.687 3.618 3.744 0.014 2 0 "[ . 1 . 2]" 1
1664 1 117 LEU H 1 118 GLY H . . 3.700 3.035 2.881 3.234 . 0 0 "[ . 1 . 2]" 1
1665 1 117 LEU H 1 119 SER H . . 4.920 4.762 4.575 4.940 0.020 20 0 "[ . 1 . 2]" 1
1666 1 117 LEU HA 1 117 LEU MD1 . . 2.890 2.158 2.008 2.257 . 0 0 "[ . 1 . 2]" 1
1667 1 117 LEU HA 1 117 LEU MD2 . . 3.810 3.845 3.802 3.876 0.066 11 0 "[ . 1 . 2]" 1
1668 1 117 LEU HA 1 117 LEU HG . . 3.890 2.936 2.800 3.076 . 0 0 "[ . 1 . 2]" 1
1669 1 117 LEU HA 1 120 LEU MD1 . . 3.190 2.532 2.266 2.845 . 0 0 "[ . 1 . 2]" 1
1670 1 117 LEU HB2 1 118 GLY H . . 3.860 3.641 3.471 3.825 . 0 0 "[ . 1 . 2]" 1
1671 1 117 LEU HB3 1 117 LEU MD1 . . 3.670 3.210 3.200 3.219 . 0 0 "[ . 1 . 2]" 1
1672 1 117 LEU HB3 1 117 LEU MD2 . . 3.150 2.310 2.208 2.425 . 0 0 "[ . 1 . 2]" 1
1673 1 117 LEU HB3 1 118 GLY H . . 3.610 2.348 2.017 2.636 . 0 0 "[ . 1 . 2]" 1
1674 1 118 GLY H 1 119 SER H . . 3.610 3.086 2.946 3.220 . 0 0 "[ . 1 . 2]" 1
1675 1 118 GLY HA2 1 121 ALA H . . 4.270 3.381 3.271 3.457 . 0 0 "[ . 1 . 2]" 1
1676 1 118 GLY HA2 1 121 ALA MB . . 3.610 2.747 2.593 2.870 . 0 0 "[ . 1 . 2]" 1
1677 1 118 GLY HA2 1 122 VAL H . . 5.190 4.231 4.022 4.443 . 0 0 "[ . 1 . 2]" 1
1678 1 118 GLY HA3 1 121 ALA MB . . 4.120 4.126 4.015 4.159 0.039 2 0 "[ . 1 . 2]" 1
1679 1 119 SER H 1 119 SER HB2 . . 3.130 2.114 2.035 2.173 . 0 0 "[ . 1 . 2]" 1
1680 1 119 SER H 1 119 SER HB3 . . 3.270 2.970 2.854 3.264 . 0 0 "[ . 1 . 2]" 1
1681 1 119 SER H 1 120 LEU H . . 3.790 2.923 2.822 3.008 . 0 0 "[ . 1 . 2]" 1
1682 1 119 SER H 1 120 LEU HB2 . . 5.110 4.706 4.609 4.819 . 0 0 "[ . 1 . 2]" 1
1683 1 119 SER H 1 121 ALA H . . 4.520 4.344 4.099 4.520 . 0 0 "[ . 1 . 2]" 1
1684 1 119 SER H 1 122 VAL HB . . 4.660 4.640 4.537 4.701 0.041 2 0 "[ . 1 . 2]" 1
1685 1 119 SER H 1 122 VAL MG2 . . 5.190 3.911 3.360 4.291 . 0 0 "[ . 1 . 2]" 1
1686 1 119 SER H 1 136 PHE HB2 . . 4.490 3.784 2.704 4.238 . 0 0 "[ . 1 . 2]" 1
1687 1 119 SER H 1 136 PHE HB3 . . 4.360 3.341 2.592 3.826 . 0 0 "[ . 1 . 2]" 1
1688 1 119 SER H 1 136 PHE QD . . 3.960 3.649 2.983 3.999 0.039 13 0 "[ . 1 . 2]" 1
1689 1 119 SER HA 1 122 VAL H . . 4.280 3.109 2.916 3.366 . 0 0 "[ . 1 . 2]" 1
1690 1 119 SER HA 1 122 VAL HB . . 3.890 2.155 2.066 2.276 . 0 0 "[ . 1 . 2]" 1
1691 1 119 SER HA 1 122 VAL MG1 . . 3.560 3.498 3.378 3.563 0.003 7 0 "[ . 1 . 2]" 1
1692 1 119 SER HA 1 122 VAL MG2 . . 3.560 2.504 1.993 2.966 . 0 0 "[ . 1 . 2]" 1
1693 1 119 SER HA 1 123 THR H . . 4.180 3.865 3.475 4.190 0.010 20 0 "[ . 1 . 2]" 1
1694 1 119 SER HA 1 136 PHE HB2 . . 3.560 3.049 2.375 3.355 . 0 0 "[ . 1 . 2]" 1
1695 1 119 SER HA 1 136 PHE HB3 . . 3.430 3.324 2.807 3.447 0.017 13 0 "[ . 1 . 2]" 1
1696 1 119 SER HB2 1 120 LEU H . . 3.670 3.571 3.250 3.672 0.002 15 0 "[ . 1 . 2]" 1
1697 1 119 SER HB2 1 136 PHE HB3 . . 3.990 3.315 2.475 3.659 . 0 0 "[ . 1 . 2]" 1
1698 1 119 SER HB3 1 120 LEU H . . 3.560 2.670 2.478 2.958 . 0 0 "[ . 1 . 2]" 1
1699 1 120 LEU H 1 120 LEU HB2 . . 3.240 2.045 2.000 2.093 . 0 0 "[ . 1 . 2]" 1
1700 1 120 LEU H 1 120 LEU HB3 . . 3.520 3.357 3.286 3.409 . 0 0 "[ . 1 . 2]" 1
1701 1 120 LEU H 1 120 LEU MD1 . . 3.990 3.589 3.395 3.816 . 0 0 "[ . 1 . 2]" 1
1702 1 120 LEU H 1 120 LEU MD2 . . 4.120 4.117 4.028 4.207 0.087 9 0 "[ . 1 . 2]" 1
1703 1 120 LEU H 1 120 LEU HG . . 3.510 3.153 2.967 3.320 . 0 0 "[ . 1 . 2]" 1
1704 1 120 LEU H 1 121 ALA H . . 3.480 2.764 2.651 2.859 . 0 0 "[ . 1 . 2]" 1
1705 1 120 LEU HA 1 120 LEU HB2 . . 3.010 2.927 2.892 2.953 . 0 0 "[ . 1 . 2]" 1
1706 1 120 LEU HA 1 120 LEU MD2 . . 2.880 2.371 2.181 2.514 . 0 0 "[ . 1 . 2]" 1
1707 1 120 LEU HA 1 120 LEU HG . . 3.270 2.459 2.345 2.554 . 0 0 "[ . 1 . 2]" 1
1708 1 120 LEU HA 1 123 THR HB . . 3.430 2.791 2.497 3.077 . 0 0 "[ . 1 . 2]" 1
1709 1 120 LEU HA 1 124 LYS H . . 4.920 4.306 3.493 4.822 . 0 0 "[ . 1 . 2]" 1
1710 1 120 LEU HB2 1 120 LEU MD1 . . 3.130 2.096 2.016 2.218 . 0 0 "[ . 1 . 2]" 1
1711 1 120 LEU HB2 1 120 LEU MD2 . . 3.560 3.189 3.167 3.206 . 0 0 "[ . 1 . 2]" 1
1712 1 120 LEU HB2 1 121 ALA H . . 3.610 2.985 2.816 3.301 . 0 0 "[ . 1 . 2]" 1
1713 1 120 LEU HB3 1 120 LEU MD2 . . 3.110 2.230 2.119 2.374 . 0 0 "[ . 1 . 2]" 1
1714 1 120 LEU HB3 1 121 ALA H . . 3.890 3.164 3.017 3.377 . 0 0 "[ . 1 . 2]" 1
1715 1 120 LEU MD2 1 121 ALA H . . 4.590 4.588 4.519 4.632 0.042 6 0 "[ . 1 . 2]" 1
1716 1 120 LEU MD2 1 123 THR HB . . 3.890 3.641 3.252 3.918 0.028 2 0 "[ . 1 . 2]" 1
1717 1 120 LEU MD2 1 124 LYS H . . 5.040 4.653 3.887 5.064 0.024 3 0 "[ . 1 . 2]" 1
1718 1 120 LEU MD2 1 124 LYS HE2 . . 3.470 3.352 2.359 3.600 0.130 1 0 "[ . 1 . 2]" 1
1719 1 120 LEU MD2 1 124 LYS HE3 . . 3.610 3.261 2.124 3.627 0.017 11 0 "[ . 1 . 2]" 1
1720 1 121 ALA H 1 121 ALA MB . . 2.910 2.134 2.035 2.176 . 0 0 "[ . 1 . 2]" 1
1721 1 121 ALA H 1 122 VAL H . . 3.610 2.522 2.313 2.632 . 0 0 "[ . 1 . 2]" 1
1722 1 121 ALA H 1 122 VAL MG2 . . 4.590 3.997 3.714 4.223 . 0 0 "[ . 1 . 2]" 1
1723 1 121 ALA H 1 123 THR H . . 5.270 4.228 3.930 4.760 . 0 0 "[ . 1 . 2]" 1
1724 1 121 ALA H 1 129 TYR QD . . 5.040 4.585 3.614 5.061 0.021 6 0 "[ . 1 . 2]" 1
1725 1 121 ALA MB 1 122 VAL H . . 3.300 2.815 2.640 3.070 . 0 0 "[ . 1 . 2]" 1
1726 1 121 ALA MB 1 129 TYR H . . 4.270 3.900 2.861 4.316 0.046 9 0 "[ . 1 . 2]" 1
1727 1 121 ALA MB 1 129 TYR HB2 . . 3.670 2.942 1.996 3.620 . 0 0 "[ . 1 . 2]" 1
1728 1 121 ALA MB 1 129 TYR QD . . 3.060 2.059 1.769 2.567 . 0 0 "[ . 1 . 2]" 1
1729 1 122 VAL H 1 122 VAL HB . . 2.940 2.295 2.220 2.451 . 0 0 "[ . 1 . 2]" 1
1730 1 122 VAL H 1 122 VAL MG1 . . 3.720 3.678 3.649 3.727 0.007 2 0 "[ . 1 . 2]" 1
1731 1 122 VAL H 1 122 VAL MG2 . . 3.110 2.311 2.091 2.545 . 0 0 "[ . 1 . 2]" 1
1732 1 122 VAL H 1 123 THR H . . 3.580 2.605 2.389 2.718 . 0 0 "[ . 1 . 2]" 1
1733 1 122 VAL H 1 123 THR HA . . 5.190 5.161 5.015 5.232 0.042 6 0 "[ . 1 . 2]" 1
1734 1 122 VAL H 1 123 THR HB . . 5.110 4.529 4.404 4.657 . 0 0 "[ . 1 . 2]" 1
1735 1 122 VAL H 1 129 TYR QD . . 4.450 3.982 3.130 4.474 0.024 2 0 "[ . 1 . 2]" 1
1736 1 122 VAL HA 1 122 VAL MG1 . . 2.810 2.482 2.325 2.569 . 0 0 "[ . 1 . 2]" 1
1737 1 122 VAL HA 1 122 VAL MG2 . . 2.980 2.326 2.200 2.457 . 0 0 "[ . 1 . 2]" 1
1738 1 122 VAL HB 1 123 THR H . . 3.730 2.610 2.102 2.893 . 0 0 "[ . 1 . 2]" 1
1739 1 122 VAL MG1 1 123 THR H . . 3.730 3.298 3.044 3.614 . 0 0 "[ . 1 . 2]" 1
1740 1 122 VAL MG1 1 133 PRO HA . . 3.670 2.635 1.857 3.386 . 0 0 "[ . 1 . 2]" 1
1741 1 122 VAL MG1 1 133 PRO HB2 . . 3.610 2.380 1.785 3.034 . 0 0 "[ . 1 . 2]" 1
1742 1 122 VAL MG1 1 133 PRO HB3 . . 3.360 2.568 1.914 3.491 0.131 18 0 "[ . 1 . 2]" 1
1743 1 122 VAL MG1 1 136 PHE H . . 4.920 3.860 2.992 4.370 . 0 0 "[ . 1 . 2]" 1
1744 1 122 VAL MG1 1 137 MET H . . 5.040 3.714 2.727 4.903 . 0 0 "[ . 1 . 2]" 1
1745 1 122 VAL MG2 1 123 THR H . . 3.990 3.946 3.640 4.023 0.033 3 0 "[ . 1 . 2]" 1
1746 1 122 VAL MG2 1 133 PRO HA . . 3.270 2.140 1.891 2.623 . 0 0 "[ . 1 . 2]" 1
1747 1 122 VAL MG2 1 133 PRO HB3 . . 3.890 3.350 2.239 3.892 0.002 18 0 "[ . 1 . 2]" 1
1748 1 122 VAL MG2 1 136 PHE H . . 3.240 2.853 2.128 3.122 . 0 0 "[ . 1 . 2]" 1
1749 1 122 VAL MG2 1 136 PHE HB2 . . 3.270 2.180 1.912 2.484 . 0 0 "[ . 1 . 2]" 1
1750 1 122 VAL MG2 1 136 PHE QD . . 3.250 3.084 2.050 3.265 0.015 19 0 "[ . 1 . 2]" 1
1751 1 122 VAL MG2 1 137 MET H . . 5.110 3.896 2.499 5.050 . 0 0 "[ . 1 . 2]" 1
1752 1 123 THR H 1 123 THR HB . . 3.240 2.334 2.150 2.604 . 0 0 "[ . 1 . 2]" 1
1753 1 123 THR H 1 123 THR MG . . 3.780 3.671 3.630 3.683 . 0 0 "[ . 1 . 2]" 1
1754 1 123 THR H 1 124 LYS H . . 3.380 2.886 2.467 3.249 . 0 0 "[ . 1 . 2]" 1
1755 1 123 THR H 1 124 LYS HB2 . . 5.110 4.906 4.280 5.121 0.011 3 0 "[ . 1 . 2]" 1
1756 1 123 THR HA 1 123 THR MG . . 2.840 2.487 2.317 2.575 . 0 0 "[ . 1 . 2]" 1
1757 1 123 THR HB 1 124 LYS H . . 3.560 2.591 2.165 2.941 . 0 0 "[ . 1 . 2]" 1
1758 1 123 THR MG 1 124 LYS H . . 4.200 3.318 2.586 3.711 . 0 0 "[ . 1 . 2]" 1
1759 1 124 LYS H 1 124 LYS HB2 . . 3.400 2.371 2.125 2.586 . 0 0 "[ . 1 . 2]" 1
1760 1 124 LYS H 1 124 LYS HB3 . . 3.670 3.528 3.431 3.567 . 0 0 "[ . 1 . 2]" 1
1761 1 124 LYS H 1 124 LYS HG2 . . 3.990 3.335 2.769 4.011 0.021 14 0 "[ . 1 . 2]" 1
1762 1 124 LYS H 1 124 LYS HG3 . . 3.630 2.526 2.176 3.057 . 0 0 "[ . 1 . 2]" 1
1763 1 124 LYS H 1 125 ASN H . . 3.890 3.071 2.523 3.568 . 0 0 "[ . 1 . 2]" 1
1764 1 124 LYS HA 1 124 LYS HD3 . . 3.990 4.091 3.615 4.673 0.683 10 4 "[ . * + -. *2]" 1
1765 1 124 LYS HA 1 124 LYS HG2 . . 3.190 2.467 1.997 3.449 0.259 9 0 "[ . 1 . 2]" 1
1766 1 124 LYS HA 1 124 LYS HG3 . . 3.560 2.963 2.117 3.455 . 0 0 "[ . 1 . 2]" 1
1767 1 124 LYS HB2 1 125 ASN H . . 3.890 2.345 1.956 2.851 . 0 0 "[ . 1 . 2]" 1
1768 1 124 LYS HB2 1 126 ASP H . . 5.110 4.475 3.494 5.116 0.006 11 0 "[ . 1 . 2]" 1
1769 1 124 LYS HB3 1 125 ASN H . . 4.440 3.019 1.924 3.863 . 0 0 "[ . 1 . 2]" 1
1770 1 124 LYS HB3 1 126 ASP H . . 5.040 4.347 3.102 5.107 0.067 20 0 "[ . 1 . 2]" 1
1771 1 124 LYS HE2 1 124 LYS HG2 . . 3.390 2.795 2.544 3.298 . 0 0 "[ . 1 . 2]" 1
1772 1 124 LYS HE2 1 124 LYS HG3 . . 3.360 2.580 2.060 4.009 0.649 9 1 "[ . +1 . 2]" 1
1773 1 124 LYS HE3 1 124 LYS HG3 . . 3.330 2.726 2.158 3.354 0.024 7 0 "[ . 1 . 2]" 1
1774 1 124 LYS HG3 1 125 ASN H . . 5.190 4.442 4.067 4.812 . 0 0 "[ . 1 . 2]" 1
1775 1 125 ASN H 1 125 ASN HB3 . . 4.040 3.686 3.013 4.051 0.011 2 0 "[ . 1 . 2]" 1
1776 1 125 ASN H 1 126 ASP H . . 4.360 3.255 2.116 3.924 . 0 0 "[ . 1 . 2]" 1
1777 1 125 ASN HA 1 127 GLY H . . 4.280 4.104 3.242 4.296 0.016 11 0 "[ . 1 . 2]" 1
1778 1 125 ASN HB2 1 125 ASN HD21 . . 3.470 2.685 2.107 3.341 . 0 0 "[ . 1 . 2]" 1
1779 1 125 ASN HB2 1 125 ASN HD22 . . 3.890 3.707 3.447 4.033 0.143 5 0 "[ . 1 . 2]" 1
1780 1 126 ASP H 1 126 ASP HB2 . . 4.120 2.953 2.235 4.000 . 0 0 "[ . 1 . 2]" 1
1781 1 126 ASP H 1 127 GLY H . . 3.450 2.380 1.888 3.531 0.081 9 0 "[ . 1 . 2]" 1
1782 1 126 ASP HB2 1 127 GLY H . . 5.110 3.828 2.913 4.703 . 0 0 "[ . 1 . 2]" 1
1783 1 126 ASP HB3 1 127 GLY H . . 4.820 3.393 2.183 4.725 . 0 0 "[ . 1 . 2]" 1
1784 1 127 GLY H 1 128 ASN H . . 3.490 2.454 1.904 3.024 . 0 0 "[ . 1 . 2]" 1
1785 1 127 GLY H 1 128 ASN HB2 . . 5.110 4.687 3.909 5.837 0.727 9 2 "[ . +1- . 2]" 1
1786 1 127 GLY H 1 129 TYR H . . 4.390 3.775 2.732 4.432 0.042 6 0 "[ . 1 . 2]" 1
1787 1 127 GLY HA3 1 128 ASN QD . . 4.550 3.799 3.118 4.162 . 0 0 "[ . 1 . 2]" 1
1788 1 128 ASN H 1 128 ASN HB2 . . 3.560 2.986 2.253 3.992 0.432 9 0 "[ . 1 . 2]" 1
1789 1 128 ASN H 1 128 ASN HB3 . . 3.890 3.775 3.511 4.081 0.191 2 0 "[ . 1 . 2]" 1
1790 1 128 ASN H 1 128 ASN QD . . 4.060 2.693 1.887 3.678 . 0 0 "[ . 1 . 2]" 1
1791 1 128 ASN H 1 129 TYR H . . 3.500 2.202 1.893 2.790 . 0 0 "[ . 1 . 2]" 1
1792 1 128 ASN H 1 129 TYR HB3 . . 4.730 4.362 3.481 4.965 0.235 2 0 "[ . 1 . 2]" 1
1793 1 128 ASN HB2 1 129 TYR H . . 4.620 2.752 1.952 4.424 . 0 0 "[ . 1 . 2]" 1
1794 1 128 ASN HB3 1 129 TYR H . . 4.690 3.833 3.372 4.743 0.053 9 0 "[ . 1 . 2]" 1
1795 1 129 TYR H 1 129 TYR HB2 . . 3.470 2.251 1.926 3.473 0.003 6 0 "[ . 1 . 2]" 1
1796 1 129 TYR H 1 129 TYR HB3 . . 3.370 2.657 1.994 3.013 . 0 0 "[ . 1 . 2]" 1
1797 1 129 TYR H 1 129 TYR QD . . 4.220 3.701 1.916 4.276 0.056 3 0 "[ . 1 . 2]" 1
1798 1 129 TYR H 1 130 ARG H . . 4.820 4.485 4.286 4.671 . 0 0 "[ . 1 . 2]" 1
1799 1 129 TYR HA 1 129 TYR QD . . 3.250 2.977 1.988 3.475 0.225 15 0 "[ . 1 . 2]" 1
1800 1 129 TYR HB2 1 130 ARG H . . 4.730 4.283 2.047 4.727 . 0 0 "[ . 1 . 2]" 1
1801 1 129 TYR HB3 1 130 ARG H . . 4.870 4.046 3.338 4.529 . 0 0 "[ . 1 . 2]" 1
1802 1 129 TYR QD 1 130 ARG H . . 4.360 3.261 2.222 4.255 . 0 0 "[ . 1 . 2]" 1
1803 1 129 TYR QD 1 131 GLY H . . 4.550 2.736 1.948 4.417 . 0 0 "[ . 1 . 2]" 1
1804 1 130 ARG H 1 130 ARG HB2 . . 3.730 2.436 2.112 2.903 . 0 0 "[ . 1 . 2]" 1
1805 1 130 ARG H 1 130 ARG HB3 . . 3.890 3.526 2.264 3.849 . 0 0 "[ . 1 . 2]" 1
1806 1 130 ARG H 1 130 ARG QD . . 4.480 4.140 3.462 4.580 0.100 10 0 "[ . 1 . 2]" 1
1807 1 130 ARG H 1 130 ARG HG2 . . 4.120 2.827 2.170 4.285 0.165 10 0 "[ . 1 . 2]" 1
1808 1 130 ARG H 1 130 ARG HG3 . . 3.990 3.764 3.450 4.311 0.321 10 0 "[ . 1 . 2]" 1
1809 1 130 ARG H 1 131 GLY H . . 3.850 2.540 1.967 3.077 . 0 0 "[ . 1 . 2]" 1
1810 1 130 ARG HA 1 130 ARG QD . . 3.360 2.362 1.978 3.346 . 0 0 "[ . 1 . 2]" 1
1811 1 130 ARG HA 1 130 ARG HG2 . . 3.470 2.740 2.199 3.794 0.324 10 0 "[ . 1 . 2]" 1
1812 1 130 ARG HA 1 130 ARG HG3 . . 3.810 3.658 2.676 3.849 0.039 14 0 "[ . 1 . 2]" 1
1813 1 130 ARG HB2 1 130 ARG QD . . 3.510 3.269 2.184 3.521 0.011 18 0 "[ . 1 . 2]" 1
1814 1 130 ARG HB3 1 130 ARG QD . . 3.040 2.362 2.041 2.922 . 0 0 "[ . 1 . 2]" 1
1815 1 130 ARG HB3 1 130 ARG HG3 . . 2.780 2.645 2.471 2.931 0.151 10 0 "[ . 1 . 2]" 1
1816 1 130 ARG HB3 1 131 GLY H . . 4.780 3.569 2.502 4.566 . 0 0 "[ . 1 . 2]" 1
1817 1 131 GLY HA2 1 132 ASP H . . 3.610 2.858 2.229 3.391 . 0 0 "[ . 1 . 2]" 1
1818 1 131 GLY HA2 1 135 TRP HZ3 . . 3.890 3.416 2.430 3.914 0.024 10 0 "[ . 1 . 2]" 1
1819 1 131 GLY HA3 1 135 TRP HZ3 . . 3.810 2.270 1.993 2.551 . 0 0 "[ . 1 . 2]" 1
1820 1 132 ASP H 1 132 ASP HB2 . . 3.610 2.303 2.044 2.676 . 0 0 "[ . 1 . 2]" 1
1821 1 132 ASP H 1 132 ASP HB3 . . 3.560 3.406 2.994 3.612 0.052 4 0 "[ . 1 . 2]" 1
1822 1 132 ASP H 1 135 TRP HE3 . . 4.160 3.488 2.616 4.029 . 0 0 "[ . 1 . 2]" 1
1823 1 132 ASP H 1 135 TRP HH2 . . 4.450 3.684 3.386 4.097 . 0 0 "[ . 1 . 2]" 1
1824 1 132 ASP H 1 135 TRP HZ3 . . 5.470 3.570 3.061 3.946 . 0 0 "[ . 1 . 2]" 1
1825 1 132 ASP HA 1 133 PRO HD2 . . 3.050 2.676 2.529 2.797 . 0 0 "[ . 1 . 2]" 1
1826 1 132 ASP HA 1 133 PRO HD3 . . 3.110 2.018 1.973 2.074 . 0 0 "[ . 1 . 2]" 1
1827 1 132 ASP HB2 1 134 ASN H . . 4.730 4.143 3.424 4.804 0.074 3 0 "[ . 1 . 2]" 1
1828 1 132 ASP HB2 1 135 TRP H . . 4.550 4.523 3.551 5.195 0.645 10 5 "[- .* + * . * 2]" 1
1829 1 132 ASP HB2 1 135 TRP HE1 . . 4.260 2.958 2.517 3.851 . 0 0 "[ . 1 . 2]" 1
1830 1 132 ASP HB3 1 134 ASN H . . 4.800 2.647 2.209 3.225 . 0 0 "[ . 1 . 2]" 1
1831 1 132 ASP HB3 1 135 TRP H . . 5.190 3.850 2.396 5.055 . 0 0 "[ . 1 . 2]" 1
1832 1 132 ASP HB3 1 135 TRP HE1 . . 4.270 4.017 3.723 4.280 0.010 8 0 "[ . 1 . 2]" 1
1833 1 133 PRO HB2 1 134 ASN H . . 4.260 3.410 3.095 3.639 . 0 0 "[ . 1 . 2]" 1
1834 1 133 PRO HD2 1 134 ASN H . . 4.480 2.277 2.253 2.330 . 0 0 "[ . 1 . 2]" 1
1835 1 133 PRO HD3 1 134 ASN H . . 3.990 3.666 3.655 3.709 . 0 0 "[ . 1 . 2]" 1
1836 1 133 PRO HG2 1 134 ASN H . . 4.070 2.970 2.626 3.254 . 0 0 "[ . 1 . 2]" 1
1837 1 133 PRO HG2 1 134 ASN HD21 . . 5.190 3.709 2.569 5.192 0.002 16 0 "[ . 1 . 2]" 1
1838 1 134 ASN H 1 134 ASN HB2 . . 3.330 2.512 2.022 3.531 0.201 11 0 "[ . 1 . 2]" 1
1839 1 134 ASN H 1 134 ASN HB3 . . 3.510 3.262 2.275 3.597 0.087 16 0 "[ . 1 . 2]" 1
1840 1 134 ASN H 1 134 ASN HD21 . . 4.360 2.916 2.314 4.252 . 0 0 "[ . 1 . 2]" 1
1841 1 134 ASN H 1 134 ASN HD22 . . 4.590 4.047 3.423 4.582 . 0 0 "[ . 1 . 2]" 1
1842 1 134 ASN H 1 135 TRP H . . 3.460 3.125 2.645 3.525 0.065 15 0 "[ . 1 . 2]" 1
1843 1 134 ASN HA 1 136 PHE H . . 4.780 4.360 3.765 4.806 0.026 15 0 "[ . 1 . 2]" 1
1844 1 134 ASN HA 1 137 MET H . . 4.550 3.859 3.147 4.564 0.014 5 0 "[ . 1 . 2]" 1
1845 1 134 ASN HA 1 137 MET HB2 . . 4.120 3.448 2.654 4.360 0.240 10 0 "[ . 1 . 2]" 1
1846 1 134 ASN HB2 1 134 ASN HD22 . . 4.120 3.693 3.448 4.140 0.020 16 0 "[ . 1 . 2]" 1
1847 1 134 ASN HB2 1 135 TRP H . . 4.440 4.073 2.936 4.457 0.017 10 0 "[ . 1 . 2]" 1
1848 1 135 TRP H 1 135 TRP HB2 . . 3.570 2.357 2.272 2.447 . 0 0 "[ . 1 . 2]" 1
1849 1 135 TRP H 1 135 TRP HB3 . . 3.890 3.541 3.508 3.598 . 0 0 "[ . 1 . 2]" 1
1850 1 135 TRP H 1 135 TRP HD1 . . 3.820 3.612 2.924 3.896 0.076 15 0 "[ . 1 . 2]" 1
1851 1 135 TRP H 1 136 PHE H . . 3.810 2.430 1.896 3.097 . 0 0 "[ . 1 . 2]" 1
1852 1 135 TRP HA 1 135 TRP HD1 . . 2.850 2.073 2.015 2.137 . 0 0 "[ . 1 . 2]" 1
1853 1 135 TRP HA 1 135 TRP HE1 . . 4.550 4.613 4.575 4.673 0.123 14 0 "[ . 1 . 2]" 1
1854 1 135 TRP HB2 1 135 TRP HE3 . . 3.820 2.833 2.609 3.005 . 0 0 "[ . 1 . 2]" 1
1855 1 135 TRP HB2 1 136 PHE H . . 3.990 2.610 2.320 2.916 . 0 0 "[ . 1 . 2]" 1
1856 1 135 TRP HB3 1 135 TRP HE3 . . 3.960 2.918 2.746 3.167 . 0 0 "[ . 1 . 2]" 1
1857 1 135 TRP HB3 1 136 PHE H . . 3.990 3.237 2.783 3.649 . 0 0 "[ . 1 . 2]" 1
1858 1 135 TRP HB3 1 136 PHE QE . . 4.120 3.227 1.995 4.127 0.007 16 0 "[ . 1 . 2]" 1
1859 1 135 TRP HE3 1 136 PHE QE . . 3.610 3.178 2.354 3.620 0.010 9 0 "[ . 1 . 2]" 1
1860 1 136 PHE H 1 136 PHE HB2 . . 3.390 2.346 2.068 2.798 . 0 0 "[ . 1 . 2]" 1
1861 1 136 PHE H 1 137 MET H . . 3.420 2.828 2.185 3.459 0.039 8 0 "[ . 1 . 2]" 1
1862 1 136 PHE HB2 1 137 MET H . . 4.490 3.456 2.251 4.536 0.046 6 0 "[ . 1 . 2]" 1
1863 1 136 PHE HB3 1 137 MET H . . 4.240 3.844 2.887 4.334 0.094 8 0 "[ . 1 . 2]" 1
1864 1 137 MET H 1 137 MET HB2 . . 3.470 2.341 1.979 3.537 0.067 17 0 "[ . 1 . 2]" 1
1865 1 137 MET H 1 137 MET HB3 . . 3.370 2.988 2.179 3.459 0.089 4 0 "[ . 1 . 2]" 1
1866 1 137 MET H 1 137 MET HG2 . . 4.120 3.680 2.234 4.501 0.381 3 0 "[ . 1 . 2]" 1
1867 1 137 MET H 1 138 LYS H . . 4.920 4.358 2.514 4.673 . 0 0 "[ . 1 . 2]" 1
1868 1 137 MET HA 1 137 MET HG3 . . 3.990 3.292 2.319 3.824 . 0 0 "[ . 1 . 2]" 1
1869 1 137 MET HA 1 138 LYS H . . 3.530 2.431 2.203 3.631 0.101 2 0 "[ . 1 . 2]" 1
1870 1 137 MET HB2 1 138 LYS H . . 4.730 4.061 2.791 4.732 0.002 12 0 "[ . 1 . 2]" 1
1871 1 137 MET HG2 1 138 LYS H . . 5.190 3.896 2.102 5.399 0.209 17 0 "[ . 1 . 2]" 1
1872 1 138 LYS H 1 138 LYS HG3 . . 5.040 4.072 2.202 5.200 0.160 5 0 "[ . 1 . 2]" 1
1873 1 138 LYS HA 1 138 LYS HG2 . . 3.890 2.773 2.030 4.203 0.313 9 0 "[ . 1 . 2]" 1
1874 1 138 LYS QB 1 138 LYS QD . . 2.400 2.092 1.932 2.345 . 0 0 "[ . 1 . 2]" 1
1875 1 140 GLY HA2 1 141 PRO HD3 . . 3.150 2.308 1.946 2.803 . 0 0 "[ . 1 . 2]" 1
1876 1 140 GLY HA3 1 141 PRO HD2 . . 3.040 2.521 2.199 2.959 . 0 0 "[ . 1 . 2]" 1
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