NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
543017 |
2lpi   |
18261 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lpi
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 1959
_Distance_constraint_stats_list.Viol_count 3725
_Distance_constraint_stats_list.Viol_total 9126.479
_Distance_constraint_stats_list.Viol_max 0.990
_Distance_constraint_stats_list.Viol_rms 0.0536
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0116
_Distance_constraint_stats_list.Viol_average_violations_only 0.1225
_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 6 HIS 7.594 0.696 17 9 "[* * . ** *-* + *]"
1 7 THR 2.688 0.215 10 0 "[ . 1 . 2]"
1 8 THR 20.854 0.794 9 12 "[ * *. * +* *****- *2]"
1 9 PRO 17.816 0.627 12 10 "[ *. * ** +* **- *2]"
1 10 TRP 2.194 0.395 11 0 "[ . 1 . 2]"
1 11 THR 1.853 0.149 5 0 "[ . 1 . 2]"
1 12 ASN 14.375 0.896 9 3 "[ . *+- . 2]"
1 13 PRO 12.145 0.896 9 3 "[ . *+- . 2]"
1 14 GLY 1.926 0.222 1 0 "[ . 1 . 2]"
1 15 LEU 3.907 0.434 5 0 "[ . 1 . 2]"
1 16 ALA 1.078 0.143 15 0 "[ . 1 . 2]"
1 17 GLU 1.758 0.236 20 0 "[ . 1 . 2]"
1 18 ASN 6.248 0.434 5 0 "[ . 1 . 2]"
1 19 PHE 4.822 0.718 14 1 "[ . 1 +. 2]"
1 20 MET 5.082 0.718 14 1 "[ . 1 +. 2]"
1 21 ASN 9.536 0.716 16 3 "[ . -1 .+ *]"
1 22 SER 0.350 0.130 9 0 "[ . 1 . 2]"
1 23 PHE 6.478 0.300 2 0 "[ . 1 . 2]"
1 24 MET 8.111 0.569 14 1 "[ . 1 +. 2]"
1 25 GLN 6.384 0.382 16 0 "[ . 1 . 2]"
1 26 GLY 4.696 0.382 16 0 "[ . 1 . 2]"
1 27 LEU 3.634 0.200 14 0 "[ . 1 . 2]"
1 28 SER 3.392 0.673 3 1 "[ + . 1 . 2]"
1 29 SER 4.081 0.890 12 2 "[ . 1 + . -]"
1 30 MET 21.530 0.890 12 5 "[ - .** 1 + . *]"
1 31 PRO 12.471 0.725 7 3 "[ - .*+ 1 . 2]"
1 32 GLY 1.011 0.165 2 0 "[ . 1 . 2]"
1 33 PHE 2.285 0.186 17 0 "[ . 1 . 2]"
1 34 THR 3.406 0.179 4 0 "[ . 1 . 2]"
1 35 ALA 0.680 0.066 16 0 "[ . 1 . 2]"
1 36 SER 4.061 0.723 14 3 "[ . - +. *2]"
1 37 GLN 10.956 0.723 14 6 "[ . ***- +. *2]"
1 38 LEU 2.406 0.569 14 1 "[ . 1 +. 2]"
1 39 ASP 2.014 0.112 6 0 "[ . 1 . 2]"
1 40 ASP 13.319 0.576 18 4 "[- *. * 1 . + 2]"
1 41 MET 28.396 0.729 15 9 "[****. - 1 *+ **2]"
1 42 SER 2.455 0.176 4 0 "[ . 1 . 2]"
1 43 THR 1.793 0.908 15 1 "[ . 1 + 2]"
1 44 ILE 2.272 0.107 17 0 "[ . 1 . 2]"
1 45 ALA 1.267 0.106 15 0 "[ . 1 . 2]"
1 46 GLN 4.711 0.970 15 1 "[ . 1 + 2]"
1 47 SER 2.232 0.867 12 1 "[ . 1 + . 2]"
1 48 MET 5.259 0.234 12 0 "[ . 1 . 2]"
1 49 VAL 1.083 0.112 16 0 "[ . 1 . 2]"
1 50 GLN 7.477 0.897 8 1 "[ . + 1 . 2]"
1 51 SER 2.085 0.093 3 0 "[ . 1 . 2]"
1 52 ILE 3.574 0.143 15 0 "[ . 1 . 2]"
1 53 GLN 7.822 0.461 1 0 "[ . 1 . 2]"
1 54 SER 4.503 0.292 7 0 "[ . 1 . 2]"
1 55 LEU 1.700 0.152 17 0 "[ . 1 . 2]"
1 56 ALA 0.113 0.050 20 0 "[ . 1 . 2]"
1 57 ALA 3.224 0.246 12 0 "[ . 1 . 2]"
1 58 GLN 8.579 0.292 7 0 "[ . 1 . 2]"
1 59 GLY 0.812 0.104 2 0 "[ . 1 . 2]"
1 60 ARG 4.721 0.493 18 0 "[ . 1 . 2]"
1 61 THR 5.570 0.493 18 0 "[ . 1 . 2]"
1 62 SER 1.200 0.273 10 0 "[ . 1 . 2]"
1 63 PRO 1.056 0.167 9 0 "[ . 1 . 2]"
1 64 ASN 0.428 0.164 10 0 "[ . 1 . 2]"
1 65 LYS 10.880 0.321 19 0 "[ . 1 . 2]"
1 66 LEU 6.472 0.279 2 0 "[ . 1 . 2]"
1 67 GLN 7.910 0.990 12 4 "[ * * + . -2]"
1 68 ALA 3.229 0.168 9 0 "[ . 1 . 2]"
1 69 LEU 8.244 0.407 17 0 "[ . 1 . 2]"
1 70 ASN 4.342 0.407 17 0 "[ . 1 . 2]"
1 71 MET 8.884 0.990 12 4 "[ * * + . -2]"
1 72 ARG 7.190 0.523 1 1 "[+ . 1 . 2]"
1 73 PHE 3.695 0.397 8 0 "[ . 1 . 2]"
1 74 ALA 2.662 0.598 16 1 "[ . 1 .+ 2]"
1 75 SER 7.159 0.329 14 0 "[ . 1 . 2]"
1 76 SER 0.092 0.046 9 0 "[ . 1 . 2]"
1 77 MET 2.566 0.598 16 1 "[ . 1 .+ 2]"
1 78 ALA 0.160 0.122 14 0 "[ . 1 . 2]"
1 79 GLU 1.129 0.085 16 0 "[ . 1 . 2]"
1 80 ILE 10.725 0.729 15 3 "[ . -1 + *2]"
1 81 ALA 5.454 0.660 3 2 "[ + . 1 . - 2]"
1 82 ALA 2.840 0.393 19 0 "[ . 1 . 2]"
1 83 SER 4.508 0.433 3 0 "[ . 1 . 2]"
1 84 GLU 5.160 0.317 16 0 "[ . 1 . 2]"
1 85 GLU 2.976 0.225 6 0 "[ . 1 . 2]"
1 86 GLY 0.210 0.034 8 0 "[ . 1 . 2]"
1 87 GLY 0.748 0.134 5 0 "[ . 1 . 2]"
1 88 GLY 0.174 0.134 5 0 "[ . 1 . 2]"
1 89 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 LEU 3.638 0.770 2 1 "[ + . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 THR 1.171 0.124 10 0 "[ . 1 . 2]"
1 93 LYS 4.754 0.660 3 3 "[ + . 1* . - 2]"
1 94 THR 0.986 0.217 3 0 "[ . 1 . 2]"
1 95 SER 10.621 0.574 9 2 "[ . +1 . - 2]"
1 96 SER 8.198 0.574 9 2 "[ . +1 . - 2]"
1 97 ILE 3.952 0.351 4 0 "[ . 1 . 2]"
1 98 ALA 4.451 0.501 10 1 "[ . + . 2]"
1 99 SER 2.043 0.175 16 0 "[ . 1 . 2]"
1 100 ALA 2.323 0.123 17 0 "[ . 1 . 2]"
1 101 MET 20.154 0.598 10 2 "[ * . + . 2]"
1 102 SER 6.437 0.523 3 5 "[ + * * 1 - *. 2]"
1 103 ASN 8.987 0.641 6 1 "[ .+ 1 . 2]"
1 104 ALA 7.547 0.641 6 1 "[ .+ 1 . 2]"
1 105 PHE 4.658 0.690 16 3 "[ . *-1 .+ 2]"
1 106 LEU 10.547 0.410 12 0 "[ . 1 . 2]"
1 107 GLN 13.445 0.410 12 0 "[ . 1 . 2]"
1 108 THR 2.213 0.174 16 0 "[ . 1 . 2]"
1 109 THR 6.617 0.690 16 2 "[ . - 1 .+ 2]"
1 110 GLY 1.834 0.250 17 0 "[ . 1 . 2]"
1 111 VAL 1.980 0.121 6 0 "[ . 1 . 2]"
1 112 VAL 7.494 0.391 15 0 "[ . 1 . 2]"
1 113 ASN 16.668 0.794 9 5 "[ * . +1 * *- 2]"
1 114 GLN 4.775 0.549 9 1 "[ . +1 . 2]"
1 115 PRO 10.436 0.853 19 5 "[ . *1* - * +2]"
1 116 PHE 4.466 0.328 16 0 "[ . 1 . 2]"
1 117 ILE 7.279 0.598 10 2 "[ - . + . 2]"
1 118 ASN 10.351 0.853 19 5 "[ . *1* - * +2]"
1 119 GLU 2.936 0.219 8 0 "[ . 1 . 2]"
1 120 ILE 6.988 0.286 17 0 "[ . 1 . 2]"
1 121 THR 0.532 0.099 11 0 "[ . 1 . 2]"
1 122 GLN 3.646 0.506 5 1 "[ + 1 . 2]"
1 123 LEU 9.473 0.275 6 0 "[ . 1 . 2]"
1 124 VAL 10.028 0.481 7 0 "[ . 1 . 2]"
1 125 SER 11.173 0.481 7 0 "[ . 1 . 2]"
1 126 MET 20.256 0.300 17 0 "[ . 1 . 2]"
1 127 PHE 20.174 0.495 8 0 "[ . 1 . 2]"
1 128 ALA 2.620 0.292 12 0 "[ . 1 . 2]"
1 129 GLN 13.715 0.872 2 2 "[-+ . 1 . 2]"
1 130 ALA 2.697 0.478 17 0 "[ . 1 . 2]"
1 131 GLY 4.081 0.478 17 0 "[ . 1 . 2]"
1 132 MET 8.226 0.872 2 2 "[-+ . 1 . 2]"
1 133 ASN 6.661 0.735 14 3 "[ . - +* 2]"
1 134 ASP 3.392 0.672 15 1 "[ . 1 + 2]"
1 135 VAL 5.544 0.412 8 0 "[ . 1 . 2]"
1 136 SER 2.930 0.412 8 0 "[ . 1 . 2]"
1 137 ALA 0.601 0.172 19 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 6 HIS HA 1 6 HIS HB2 . . 2.950 2.678 2.389 3.025 0.075 19 0 "[ . 1 . 2]" 1
2 1 6 HIS HA 1 6 HIS HB3 . . 2.900 2.650 2.330 3.030 0.130 15 0 "[ . 1 . 2]" 1
3 1 6 HIS QB 1 6 HIS HD2 . . 3.130 2.819 2.647 3.147 0.017 4 0 "[ . 1 . 2]" 1
4 1 6 HIS HB2 1 6 HIS HD2 . . 3.270 3.415 2.729 3.966 0.696 17 9 "[* * . ** *-* + *]" 1
5 1 7 THR HA 1 7 THR HB . . 2.930 2.786 2.414 3.013 0.083 20 0 "[ . 1 . 2]" 1
6 1 7 THR HA 1 7 THR MG . . 2.980 2.667 2.268 3.195 0.215 10 0 "[ . 1 . 2]" 1
7 1 7 THR HA 1 8 THR H . . 3.040 2.231 2.092 2.613 . 0 0 "[ . 1 . 2]" 1
8 1 7 THR MG 1 8 THR H . . 4.040 3.398 2.857 4.033 . 0 0 "[ . 1 . 2]" 1
9 1 7 THR MG 1 8 THR HA . . 4.050 3.847 3.592 4.043 . 0 0 "[ . 1 . 2]" 1
10 1 7 THR MG 1 113 ASN HD21 . . 5.340 3.653 2.342 5.413 0.073 15 0 "[ . 1 . 2]" 1
11 1 7 THR MG 1 113 ASN QD . . 5.190 3.498 2.275 4.852 . 0 0 "[ . 1 . 2]" 1
12 1 8 THR H 1 8 THR MG . . 4.000 3.843 2.650 4.040 0.040 10 0 "[ . 1 . 2]" 1
13 1 8 THR H 1 9 PRO QD . . 5.040 4.300 4.179 4.436 . 0 0 "[ . 1 . 2]" 1
14 1 8 THR H 1 9 PRO HD3 . . 5.170 4.866 4.669 5.263 0.093 14 0 "[ . 1 . 2]" 1
15 1 8 THR H 1 10 TRP H . . 5.000 4.782 4.299 5.010 0.010 11 0 "[ . 1 . 2]" 1
16 1 8 THR HA 1 8 THR MG . . 3.680 2.250 2.183 2.325 . 0 0 "[ . 1 . 2]" 1
17 1 8 THR HA 1 9 PRO HD2 . . 3.540 2.242 2.147 2.445 . 0 0 "[ . 1 . 2]" 1
18 1 8 THR HA 1 9 PRO QD . . 3.250 2.052 2.007 2.255 . 0 0 "[ . 1 . 2]" 1
19 1 8 THR HA 1 9 PRO HD3 . . 3.770 2.406 2.160 2.644 . 0 0 "[ . 1 . 2]" 1
20 1 8 THR HA 1 9 PRO QG . . 4.630 3.957 3.907 4.147 . 0 0 "[ . 1 . 2]" 1
21 1 8 THR HA 1 9 PRO HG3 . . 4.810 4.482 4.384 4.721 . 0 0 "[ . 1 . 2]" 1
22 1 8 THR HA 1 113 ASN HD21 . . 4.500 3.951 3.299 5.014 0.514 14 1 "[ . 1 +. 2]" 1
23 1 8 THR HA 1 113 ASN QD . . 4.400 3.628 2.994 4.435 0.035 16 0 "[ . 1 . 2]" 1
24 1 8 THR HB 1 9 PRO HD2 . . 3.520 3.556 2.198 3.757 0.237 2 0 "[ . 1 . 2]" 1
25 1 8 THR HB 1 9 PRO QD . . 3.360 3.447 2.182 3.605 0.245 2 0 "[ . 1 . 2]" 1
26 1 8 THR HB 1 9 PRO HD3 . . 4.260 4.669 3.685 4.887 0.627 12 9 "[ *. * * +* **- *2]" 1
27 1 8 THR HB 1 10 TRP H . . 3.760 2.875 2.029 3.231 . 0 0 "[ . 1 . 2]" 1
28 1 8 THR HB 1 10 TRP QB . . 4.630 3.840 3.043 4.442 . 0 0 "[ . 1 . 2]" 1
29 1 8 THR HB 1 11 THR H . . 4.200 3.412 2.802 3.678 . 0 0 "[ . 1 . 2]" 1
30 1 8 THR MG 1 9 PRO HD2 . . 4.920 1.893 1.777 2.851 . 0 0 "[ . 1 . 2]" 1
31 1 8 THR MG 1 9 PRO QD . . 4.800 1.878 1.768 2.781 . 0 0 "[ . 1 . 2]" 1
32 1 8 THR MG 1 10 TRP H . . 3.720 2.386 1.823 3.812 0.092 1 0 "[ . 1 . 2]" 1
33 1 8 THR MG 1 10 TRP HE1 . . 4.550 4.075 3.528 4.573 0.023 14 0 "[ . 1 . 2]" 1
34 1 8 THR MG 1 113 ASN HD21 . . 5.500 4.886 4.007 5.567 0.067 14 0 "[ . 1 . 2]" 1
35 1 8 THR MG 1 113 ASN QD . . 4.460 4.253 3.562 4.570 0.110 9 0 "[ . 1 . 2]" 1
36 1 8 THR MG 1 113 ASN HD22 . . 4.720 4.741 3.990 5.514 0.794 9 3 "[ * . +1 - . 2]" 1
37 1 9 PRO HA 1 15 LEU QD . . 3.060 2.210 1.982 2.498 . 0 0 "[ . 1 . 2]" 1
38 1 9 PRO HA 1 15 LEU HG . . 3.810 3.116 2.453 3.831 0.021 14 0 "[ . 1 . 2]" 1
39 1 9 PRO QB 1 10 TRP H . . 3.950 3.470 3.277 3.614 . 0 0 "[ . 1 . 2]" 1
40 1 9 PRO QB 1 19 PHE QD . . 4.270 3.443 2.966 4.149 . 0 0 "[ . 1 . 2]" 1
41 1 9 PRO QB 1 105 PHE QE . . 4.700 2.485 2.026 3.222 . 0 0 "[ . 1 . 2]" 1
42 1 9 PRO HB2 1 10 TRP H . . 4.260 3.642 3.399 3.837 . 0 0 "[ . 1 . 2]" 1
43 1 9 PRO HB2 1 19 PHE QD . . 4.660 3.953 3.364 4.540 . 0 0 "[ . 1 . 2]" 1
44 1 9 PRO HB3 1 19 PHE QD . . 4.960 3.813 3.162 4.799 . 0 0 "[ . 1 . 2]" 1
45 1 9 PRO HB3 1 105 PHE QE . . 4.810 2.512 2.041 3.287 . 0 0 "[ . 1 . 2]" 1
46 1 9 PRO QD 1 10 TRP H . . 4.360 2.890 2.589 3.147 . 0 0 "[ . 1 . 2]" 1
47 1 9 PRO QD 1 105 PHE QE . . 4.750 2.954 2.195 4.068 . 0 0 "[ . 1 . 2]" 1
48 1 9 PRO HD2 1 10 TRP H . . 4.530 2.964 2.631 3.253 . 0 0 "[ . 1 . 2]" 1
49 1 9 PRO HD2 1 105 PHE QE . . 4.870 4.457 3.868 5.447 0.577 9 1 "[ . +1 . 2]" 1
50 1 9 PRO QG 1 10 TRP H . . 4.370 2.908 2.705 3.077 . 0 0 "[ . 1 . 2]" 1
51 1 9 PRO QG 1 105 PHE QE . . 4.090 3.434 2.377 4.129 0.039 14 0 "[ . 1 . 2]" 1
52 1 9 PRO HG2 1 10 TRP H . . 4.780 2.954 2.739 3.137 . 0 0 "[ . 1 . 2]" 1
53 1 9 PRO HG2 1 10 TRP HH2 . . 5.110 4.542 3.875 5.101 . 0 0 "[ . 1 . 2]" 1
54 1 9 PRO HG3 1 10 TRP H . . 5.060 4.350 4.188 4.491 . 0 0 "[ . 1 . 2]" 1
55 1 9 PRO HG3 1 10 TRP HH2 . . 5.040 4.920 4.399 5.129 0.089 16 0 "[ . 1 . 2]" 1
56 1 9 PRO HG3 1 105 PHE QE . . 4.170 3.564 2.393 4.412 0.242 14 0 "[ . 1 . 2]" 1
57 1 10 TRP H 1 10 TRP QB . . 3.510 2.641 2.573 2.757 . 0 0 "[ . 1 . 2]" 1
58 1 10 TRP H 1 11 THR H . . 3.300 2.514 2.295 2.728 . 0 0 "[ . 1 . 2]" 1
59 1 10 TRP H 1 11 THR MG . . 4.140 3.890 3.462 4.186 0.046 16 0 "[ . 1 . 2]" 1
60 1 10 TRP H 1 66 LEU QD . . 4.560 3.821 2.885 4.204 . 0 0 "[ . 1 . 2]" 1
61 1 10 TRP HA 1 10 TRP HE3 . . 3.260 2.096 1.982 2.272 . 0 0 "[ . 1 . 2]" 1
62 1 10 TRP HA 1 16 ALA MB . . 3.540 2.633 2.061 2.968 . 0 0 "[ . 1 . 2]" 1
63 1 10 TRP HA 1 52 ILE MD . . 3.720 2.391 2.162 2.936 . 0 0 "[ . 1 . 2]" 1
64 1 10 TRP HA 1 52 ILE MG . . 4.250 3.208 2.871 3.524 . 0 0 "[ . 1 . 2]" 1
65 1 10 TRP QB 1 10 TRP HD1 . . 3.330 2.479 2.462 2.495 . 0 0 "[ . 1 . 2]" 1
66 1 10 TRP QB 1 11 THR H . . 4.900 3.606 3.374 3.746 . 0 0 "[ . 1 . 2]" 1
67 1 10 TRP QB 1 52 ILE MD . . 3.550 2.462 1.989 2.861 . 0 0 "[ . 1 . 2]" 1
68 1 10 TRP QB 1 66 LEU QD . . 3.070 2.011 1.785 2.571 . 0 0 "[ . 1 . 2]" 1
69 1 10 TRP QB 1 69 LEU QD . . 3.930 2.990 2.367 3.755 . 0 0 "[ . 1 . 2]" 1
70 1 10 TRP HD1 1 66 LEU HA . . 3.990 3.074 2.557 3.545 . 0 0 "[ . 1 . 2]" 1
71 1 10 TRP HD1 1 66 LEU QD . . 3.290 2.773 1.909 3.332 0.042 9 0 "[ . 1 . 2]" 1
72 1 10 TRP HD1 1 69 LEU HB2 . . 4.850 3.285 2.349 5.245 0.395 11 0 "[ . 1 . 2]" 1
73 1 10 TRP HD1 1 69 LEU QB . . 4.730 3.162 2.290 4.913 0.183 11 0 "[ . 1 . 2]" 1
74 1 10 TRP HD1 1 69 LEU QD . . 3.790 3.389 1.912 3.918 0.128 16 0 "[ . 1 . 2]" 1
75 1 10 TRP HE1 1 48 MET ME . . 4.040 3.964 3.434 4.067 0.027 4 0 "[ . 1 . 2]" 1
76 1 10 TRP HE1 1 69 LEU QD . . 5.440 4.215 2.226 4.839 . 0 0 "[ . 1 . 2]" 1
77 1 10 TRP HE1 1 70 ASN H . . 4.970 4.214 3.463 5.072 0.102 11 0 "[ . 1 . 2]" 1
78 1 10 TRP HE1 1 70 ASN HA . . 3.930 3.257 2.045 3.973 0.043 11 0 "[ . 1 . 2]" 1
79 1 10 TRP HE1 1 70 ASN QB . . 5.020 3.886 3.250 4.681 . 0 0 "[ . 1 . 2]" 1
80 1 10 TRP HE3 1 16 ALA HA . . 4.510 3.375 2.647 3.719 . 0 0 "[ . 1 . 2]" 1
81 1 10 TRP HE3 1 16 ALA MB . . 3.620 2.345 1.927 2.808 . 0 0 "[ . 1 . 2]" 1
82 1 10 TRP HE3 1 52 ILE MD . . 3.510 2.335 2.130 3.063 . 0 0 "[ . 1 . 2]" 1
83 1 10 TRP HE3 1 52 ILE MG . . 4.700 4.080 3.768 4.456 . 0 0 "[ . 1 . 2]" 1
84 1 10 TRP HH2 1 20 MET ME . . 3.500 2.340 2.023 2.993 . 0 0 "[ . 1 . 2]" 1
85 1 10 TRP HH2 1 48 MET ME . . 4.170 3.662 3.189 4.132 . 0 0 "[ . 1 . 2]" 1
86 1 10 TRP HZ2 1 48 MET ME . . 3.700 3.317 3.078 3.719 0.019 15 0 "[ . 1 . 2]" 1
87 1 10 TRP HZ3 1 16 ALA HA . . 4.200 3.197 2.582 3.694 . 0 0 "[ . 1 . 2]" 1
88 1 10 TRP HZ3 1 16 ALA MB . . 4.550 2.912 2.391 3.511 . 0 0 "[ . 1 . 2]" 1
89 1 10 TRP HZ3 1 20 MET ME . . 3.660 2.314 2.054 3.557 . 0 0 "[ . 1 . 2]" 1
90 1 10 TRP HZ3 1 48 MET ME . . 4.610 4.188 3.324 4.665 0.055 3 0 "[ . 1 . 2]" 1
91 1 10 TRP HZ3 1 52 ILE MD . . 5.300 3.625 3.267 4.728 . 0 0 "[ . 1 . 2]" 1
92 1 11 THR H 1 11 THR HB . . 3.420 3.039 2.442 3.569 0.149 5 0 "[ . 1 . 2]" 1
93 1 11 THR H 1 11 THR MG . . 3.140 2.395 2.017 2.892 . 0 0 "[ . 1 . 2]" 1
94 1 11 THR H 1 15 LEU QD . . 4.170 3.559 2.831 4.246 0.076 3 0 "[ . 1 . 2]" 1
95 1 11 THR HA 1 11 THR HB . . 2.970 2.536 2.427 2.650 . 0 0 "[ . 1 . 2]" 1
96 1 11 THR HA 1 11 THR MG . . 3.330 2.726 2.187 3.229 . 0 0 "[ . 1 . 2]" 1
97 1 11 THR HB 1 12 ASN H . . 3.920 3.608 2.654 4.034 0.114 10 0 "[ . 1 . 2]" 1
98 1 11 THR MG 1 12 ASN H . . 4.550 3.132 2.038 4.386 . 0 0 "[ . 1 . 2]" 1
99 1 12 ASN H 1 12 ASN QB . . 3.270 2.559 2.289 2.706 . 0 0 "[ . 1 . 2]" 1
100 1 12 ASN H 1 15 LEU H . . 4.450 4.206 4.028 4.564 0.114 10 0 "[ . 1 . 2]" 1
101 1 12 ASN H 1 15 LEU HB2 . . 4.180 3.801 3.091 4.256 0.076 1 0 "[ . 1 . 2]" 1
102 1 12 ASN H 1 15 LEU HB3 . . 4.140 2.842 2.559 3.046 . 0 0 "[ . 1 . 2]" 1
103 1 12 ASN H 1 15 LEU QD . . 4.130 3.477 2.702 4.139 0.009 3 0 "[ . 1 . 2]" 1
104 1 12 ASN H 1 15 LEU HG . . 4.830 4.375 3.402 4.841 0.011 2 0 "[ . 1 . 2]" 1
105 1 12 ASN H 1 16 ALA H . . 4.290 3.988 3.507 4.310 0.020 18 0 "[ . 1 . 2]" 1
106 1 12 ASN HA 1 13 PRO QB . . 4.610 4.610 4.521 4.681 0.071 10 0 "[ . 1 . 2]" 1
107 1 12 ASN HA 1 13 PRO HD2 . . 3.100 2.291 1.979 2.624 . 0 0 "[ . 1 . 2]" 1
108 1 12 ASN HA 1 13 PRO HD3 . . 3.030 2.119 1.908 2.440 . 0 0 "[ . 1 . 2]" 1
109 1 12 ASN HA 1 14 GLY H . . 4.660 4.117 3.871 4.447 . 0 0 "[ . 1 . 2]" 1
110 1 12 ASN HA 1 52 ILE MG . . 4.230 3.933 3.449 4.312 0.082 1 0 "[ . 1 . 2]" 1
111 1 12 ASN HA 1 56 ALA MB . . 5.000 3.446 2.503 4.077 . 0 0 "[ . 1 . 2]" 1
112 1 12 ASN QB 1 13 PRO HD2 . . 3.660 2.929 2.201 3.478 . 0 0 "[ . 1 . 2]" 1
113 1 12 ASN QB 1 13 PRO QD . . 3.330 2.830 2.183 3.251 . 0 0 "[ . 1 . 2]" 1
114 1 12 ASN QB 1 13 PRO HD3 . . 3.840 3.825 3.482 4.152 0.312 3 0 "[ . 1 . 2]" 1
115 1 12 ASN QB 1 13 PRO HG2 . . 4.580 4.781 3.675 5.476 0.896 9 3 "[ . *+- . 2]" 1
116 1 12 ASN QB 1 13 PRO QG . . 4.480 4.435 3.539 4.974 0.494 9 0 "[ . 1 . 2]" 1
117 1 12 ASN QB 1 14 GLY H . . 4.730 3.209 2.451 3.975 . 0 0 "[ . 1 . 2]" 1
118 1 12 ASN QB 1 14 GLY QA . . 4.440 4.051 3.546 4.560 0.120 1 0 "[ . 1 . 2]" 1
119 1 12 ASN QB 1 14 GLY HA3 . . 4.540 4.218 3.669 4.762 0.222 1 0 "[ . 1 . 2]" 1
120 1 12 ASN QB 1 15 LEU H . . 3.970 2.674 2.093 3.569 . 0 0 "[ . 1 . 2]" 1
121 1 12 ASN QB 1 15 LEU HB2 . . 3.800 2.400 1.992 2.994 . 0 0 "[ . 1 . 2]" 1
122 1 12 ASN QB 1 15 LEU HB3 . . 3.890 2.743 2.219 3.279 . 0 0 "[ . 1 . 2]" 1
123 1 12 ASN QB 1 16 ALA H . . 4.400 4.079 3.866 4.403 0.003 18 0 "[ . 1 . 2]" 1
124 1 13 PRO HA 1 16 ALA H . . 3.870 3.629 3.202 3.945 0.075 10 0 "[ . 1 . 2]" 1
125 1 13 PRO HA 1 16 ALA MB . . 3.480 2.784 2.305 3.366 . 0 0 "[ . 1 . 2]" 1
126 1 13 PRO HA 1 52 ILE MD . . 4.720 3.965 3.351 4.731 0.011 15 0 "[ . 1 . 2]" 1
127 1 13 PRO HA 1 52 ILE MG . . 3.150 2.326 2.003 2.998 . 0 0 "[ . 1 . 2]" 1
128 1 13 PRO QB 1 14 GLY H . . 3.680 2.696 2.199 3.110 . 0 0 "[ . 1 . 2]" 1
129 1 13 PRO QB 1 14 GLY QA . . 4.480 3.604 3.412 3.817 . 0 0 "[ . 1 . 2]" 1
130 1 13 PRO QB 1 14 GLY HA3 . . 4.580 4.310 3.875 4.675 0.095 12 0 "[ . 1 . 2]" 1
131 1 13 PRO QB 1 15 LEU H . . 4.820 4.695 4.281 4.918 0.098 13 0 "[ . 1 . 2]" 1
132 1 13 PRO QB 1 56 ALA MB . . 4.130 3.499 2.639 4.136 0.006 15 0 "[ . 1 . 2]" 1
133 1 13 PRO QD 1 14 GLY H . . 3.090 2.758 2.616 2.967 . 0 0 "[ . 1 . 2]" 1
134 1 13 PRO QD 1 56 ALA MB . . 4.700 2.131 1.840 2.497 . 0 0 "[ . 1 . 2]" 1
135 1 13 PRO HD2 1 14 GLY H . . 3.130 2.811 2.656 3.052 . 0 0 "[ . 1 . 2]" 1
136 1 13 PRO HD2 1 52 ILE MG . . 5.050 4.290 3.661 4.760 . 0 0 "[ . 1 . 2]" 1
137 1 13 PRO HD2 1 56 ALA MB . . 4.810 3.230 2.594 3.563 . 0 0 "[ . 1 . 2]" 1
138 1 13 PRO HD3 1 14 GLY H . . 4.830 4.010 3.871 4.168 . 0 0 "[ . 1 . 2]" 1
139 1 13 PRO HD3 1 52 ILE MG . . 4.990 3.103 2.252 3.573 . 0 0 "[ . 1 . 2]" 1
140 1 13 PRO QG 1 14 GLY H . . 4.460 3.028 2.219 3.747 . 0 0 "[ . 1 . 2]" 1
141 1 13 PRO QG 1 56 ALA MB . . 3.410 2.279 1.954 2.647 . 0 0 "[ . 1 . 2]" 1
142 1 13 PRO HG2 1 14 GLY H . . 4.630 3.149 2.234 4.003 . 0 0 "[ . 1 . 2]" 1
143 1 13 PRO HG2 1 56 ALA MB . . 3.940 3.243 2.459 3.966 0.026 2 0 "[ . 1 . 2]" 1
144 1 13 PRO HG3 1 56 ALA MB . . 3.730 2.364 1.984 2.815 . 0 0 "[ . 1 . 2]" 1
145 1 14 GLY H 1 15 LEU H . . 3.390 2.666 2.469 3.203 . 0 0 "[ . 1 . 2]" 1
146 1 14 GLY H 1 52 ILE MG . . 5.500 4.946 4.613 5.541 0.041 10 0 "[ . 1 . 2]" 1
147 1 15 LEU H 1 15 LEU HB2 . . 3.190 2.545 2.246 3.031 . 0 0 "[ . 1 . 2]" 1
148 1 15 LEU H 1 15 LEU QB . . 2.930 2.261 2.155 2.647 . 0 0 "[ . 1 . 2]" 1
149 1 15 LEU H 1 15 LEU HB3 . . 3.400 2.575 2.393 2.919 . 0 0 "[ . 1 . 2]" 1
150 1 15 LEU H 1 15 LEU QD . . 3.800 3.705 3.567 3.796 . 0 0 "[ . 1 . 2]" 1
151 1 15 LEU H 1 16 ALA H . . 3.560 2.576 2.054 2.834 . 0 0 "[ . 1 . 2]" 1
152 1 15 LEU HA 1 15 LEU QD . . 2.910 2.041 1.952 2.178 . 0 0 "[ . 1 . 2]" 1
153 1 15 LEU HA 1 18 ASN H . . 4.010 3.650 3.363 3.861 . 0 0 "[ . 1 . 2]" 1
154 1 15 LEU HA 1 18 ASN QB . . 4.390 2.857 2.310 3.230 . 0 0 "[ . 1 . 2]" 1
155 1 15 LEU HA 1 18 ASN HB3 . . 4.490 4.457 3.679 4.924 0.434 5 0 "[ . 1 . 2]" 1
156 1 15 LEU HA 1 18 ASN HD21 . . 4.440 3.366 2.827 3.515 . 0 0 "[ . 1 . 2]" 1
157 1 15 LEU HA 1 18 ASN QD . . 4.130 3.310 2.800 3.453 . 0 0 "[ . 1 . 2]" 1
158 1 15 LEU HA 1 18 ASN HD22 . . 4.900 4.900 4.530 5.049 0.149 1 0 "[ . 1 . 2]" 1
159 1 15 LEU HA 1 19 PHE H . . 4.410 4.025 3.836 4.257 . 0 0 "[ . 1 . 2]" 1
160 1 15 LEU HA 1 108 THR MG . . 5.120 3.696 3.042 4.272 . 0 0 "[ . 1 . 2]" 1
161 1 15 LEU HB2 1 16 ALA H . . 4.080 3.670 3.352 3.916 . 0 0 "[ . 1 . 2]" 1
162 1 15 LEU HB3 1 16 ALA H . . 4.000 2.360 2.055 2.674 . 0 0 "[ . 1 . 2]" 1
163 1 15 LEU QD 1 16 ALA H . . 3.970 3.585 2.982 3.978 0.008 2 0 "[ . 1 . 2]" 1
164 1 15 LEU QD 1 18 ASN H . . 4.710 4.405 4.181 4.674 . 0 0 "[ . 1 . 2]" 1
165 1 15 LEU QD 1 18 ASN HD21 . . 5.180 4.304 3.494 4.645 . 0 0 "[ . 1 . 2]" 1
166 1 15 LEU QD 1 18 ASN QD . . 4.990 4.151 3.416 4.463 . 0 0 "[ . 1 . 2]" 1
167 1 15 LEU QD 1 19 PHE H . . 4.020 3.615 3.293 3.907 . 0 0 "[ . 1 . 2]" 1
168 1 15 LEU QD 1 19 PHE HB2 . . 3.340 2.991 2.349 3.351 0.011 1 0 "[ . 1 . 2]" 1
169 1 15 LEU QD 1 19 PHE QB . . 3.250 2.925 2.309 3.273 0.023 1 0 "[ . 1 . 2]" 1
170 1 15 LEU QD 1 19 PHE HB3 . . 4.600 4.154 3.408 4.589 . 0 0 "[ . 1 . 2]" 1
171 1 15 LEU QD 1 19 PHE QD . . 4.500 3.723 2.920 4.162 . 0 0 "[ . 1 . 2]" 1
172 1 15 LEU QD 1 105 PHE QE . . 4.000 3.132 2.009 3.995 . 0 0 "[ . 1 . 2]" 1
173 1 15 LEU QD 1 108 THR HA . . 4.510 3.914 3.247 4.502 . 0 0 "[ . 1 . 2]" 1
174 1 15 LEU QD 1 108 THR HB . . 3.220 2.068 1.811 2.523 . 0 0 "[ . 1 . 2]" 1
175 1 15 LEU QD 1 108 THR MG . . 3.000 2.551 2.118 2.852 . 0 0 "[ . 1 . 2]" 1
176 1 15 LEU QD 1 109 THR MG . . 2.910 2.617 2.164 2.961 0.051 14 0 "[ . 1 . 2]" 1
177 1 15 LEU HG 1 16 ALA H . . 4.320 3.995 3.400 4.439 0.119 10 0 "[ . 1 . 2]" 1
178 1 16 ALA H 1 16 ALA MB . . 3.110 2.223 2.206 2.237 . 0 0 "[ . 1 . 2]" 1
179 1 16 ALA H 1 17 GLU H . . 3.800 2.813 2.623 3.104 . 0 0 "[ . 1 . 2]" 1
180 1 16 ALA H 1 52 ILE MD . . 5.090 4.395 4.022 4.825 . 0 0 "[ . 1 . 2]" 1
181 1 16 ALA HA 1 19 PHE H . . 4.190 3.474 3.190 3.964 . 0 0 "[ . 1 . 2]" 1
182 1 16 ALA HA 1 19 PHE HB2 . . 3.870 3.148 2.527 3.764 . 0 0 "[ . 1 . 2]" 1
183 1 16 ALA HA 1 19 PHE HB3 . . 3.770 2.539 2.155 3.021 . 0 0 "[ . 1 . 2]" 1
184 1 16 ALA HA 1 20 MET H . . 4.550 4.028 3.662 4.513 . 0 0 "[ . 1 . 2]" 1
185 1 16 ALA HA 1 52 ILE MD . . 4.400 4.113 3.851 4.543 0.143 15 0 "[ . 1 . 2]" 1
186 1 16 ALA MB 1 17 GLU H . . 3.550 2.475 2.279 2.610 . 0 0 "[ . 1 . 2]" 1
187 1 16 ALA MB 1 49 VAL HA . . 4.610 3.109 2.721 3.639 . 0 0 "[ . 1 . 2]" 1
188 1 16 ALA MB 1 49 VAL QG . . 3.710 2.523 1.985 3.317 . 0 0 "[ . 1 . 2]" 1
189 1 16 ALA MB 1 52 ILE MD . . 3.470 2.083 1.940 2.621 . 0 0 "[ . 1 . 2]" 1
190 1 16 ALA MB 1 52 ILE MG . . 3.500 2.645 2.055 3.154 . 0 0 "[ . 1 . 2]" 1
191 1 17 GLU H 1 17 GLU HB2 . . 3.350 2.777 2.312 3.586 0.236 20 0 "[ . 1 . 2]" 1
192 1 17 GLU H 1 17 GLU HB3 . . 3.290 2.609 2.420 3.014 . 0 0 "[ . 1 . 2]" 1
193 1 17 GLU H 1 18 ASN HB2 . . 5.190 4.722 4.436 4.935 . 0 0 "[ . 1 . 2]" 1
194 1 17 GLU H 1 18 ASN QB . . 5.050 4.582 4.318 4.778 . 0 0 "[ . 1 . 2]" 1
195 1 17 GLU H 1 19 PHE H . . 4.820 3.968 3.813 4.152 . 0 0 "[ . 1 . 2]" 1
196 1 17 GLU H 1 20 MET H . . 5.220 4.849 4.655 5.149 . 0 0 "[ . 1 . 2]" 1
197 1 17 GLU H 1 49 VAL QG . . 3.610 3.146 2.642 3.616 0.006 3 0 "[ . 1 . 2]" 1
198 1 17 GLU HA 1 17 GLU HB2 . . 2.520 2.489 2.421 2.620 0.100 10 0 "[ . 1 . 2]" 1
199 1 17 GLU HA 1 17 GLU QB . . 2.400 2.312 2.148 2.427 0.027 9 0 "[ . 1 . 2]" 1
200 1 17 GLU HA 1 20 MET H . . 4.110 3.701 3.164 4.103 . 0 0 "[ . 1 . 2]" 1
201 1 17 GLU HA 1 49 VAL QG . . 2.880 2.271 1.996 2.992 0.112 16 0 "[ . 1 . 2]" 1
202 1 17 GLU QB 1 49 VAL QG . . 3.860 2.366 1.878 3.324 . 0 0 "[ . 1 . 2]" 1
203 1 17 GLU HB2 1 49 VAL QG . . 4.230 2.696 1.889 3.591 . 0 0 "[ . 1 . 2]" 1
204 1 17 GLU HB3 1 49 VAL QG . . 4.990 3.291 1.965 4.549 . 0 0 "[ . 1 . 2]" 1
205 1 17 GLU QG 1 18 ASN H . . 3.910 3.202 1.845 4.042 0.132 9 0 "[ . 1 . 2]" 1
206 1 17 GLU QG 1 21 ASN HD21 . . 4.970 3.373 2.226 4.919 . 0 0 "[ . 1 . 2]" 1
207 1 17 GLU QG 1 21 ASN QD . . 4.720 3.163 2.060 4.724 0.004 20 0 "[ . 1 . 2]" 1
208 1 17 GLU QG 1 49 VAL QG . . 4.320 3.072 2.172 3.991 . 0 0 "[ . 1 . 2]" 1
209 1 18 ASN H 1 18 ASN HB2 . . 3.080 2.273 2.126 2.361 . 0 0 "[ . 1 . 2]" 1
210 1 18 ASN H 1 18 ASN QB . . 2.850 2.247 2.107 2.328 . 0 0 "[ . 1 . 2]" 1
211 1 18 ASN H 1 18 ASN HB3 . . 3.360 3.527 3.444 3.557 0.197 7 0 "[ . 1 . 2]" 1
212 1 18 ASN H 1 18 ASN HD21 . . 4.280 2.826 2.217 3.873 . 0 0 "[ . 1 . 2]" 1
213 1 18 ASN H 1 18 ASN QD . . 3.920 2.747 2.196 3.644 . 0 0 "[ . 1 . 2]" 1
214 1 18 ASN H 1 18 ASN HD22 . . 4.560 4.016 3.560 4.629 0.069 13 0 "[ . 1 . 2]" 1
215 1 18 ASN H 1 19 PHE H . . 3.440 2.568 2.418 2.775 . 0 0 "[ . 1 . 2]" 1
216 1 18 ASN H 1 108 THR MG . . 5.170 4.168 3.772 4.516 . 0 0 "[ . 1 . 2]" 1
217 1 18 ASN HA 1 18 ASN HD21 . . 4.620 3.909 3.598 4.429 . 0 0 "[ . 1 . 2]" 1
218 1 18 ASN HA 1 18 ASN QD . . 4.260 3.617 3.376 4.027 . 0 0 "[ . 1 . 2]" 1
219 1 18 ASN HA 1 18 ASN HD22 . . 4.990 4.277 4.079 4.626 . 0 0 "[ . 1 . 2]" 1
220 1 18 ASN HA 1 19 PHE H . . 3.500 3.505 3.475 3.529 0.029 13 0 "[ . 1 . 2]" 1
221 1 18 ASN HA 1 20 MET H . . 4.920 4.569 4.301 4.824 . 0 0 "[ . 1 . 2]" 1
222 1 18 ASN HA 1 21 ASN HB2 . . 3.010 2.290 2.021 2.597 . 0 0 "[ . 1 . 2]" 1
223 1 18 ASN HA 1 21 ASN QB . . 2.980 2.261 2.009 2.568 . 0 0 "[ . 1 . 2]" 1
224 1 18 ASN QB 1 18 ASN QD . . 3.010 2.164 2.108 2.198 . 0 0 "[ . 1 . 2]" 1
225 1 18 ASN QB 1 19 PHE H . . 3.350 2.739 2.632 2.858 . 0 0 "[ . 1 . 2]" 1
226 1 18 ASN QB 1 108 THR MG . . 2.990 1.969 1.813 2.318 . 0 0 "[ . 1 . 2]" 1
227 1 18 ASN HB2 1 18 ASN HD21 . . 3.460 2.235 2.191 2.269 . 0 0 "[ . 1 . 2]" 1
228 1 18 ASN HB2 1 18 ASN HD22 . . 3.780 3.478 3.457 3.496 . 0 0 "[ . 1 . 2]" 1
229 1 18 ASN HB2 1 19 PHE H . . 3.830 2.855 2.716 2.977 . 0 0 "[ . 1 . 2]" 1
230 1 18 ASN HB2 1 108 THR MG . . 3.980 2.571 1.961 3.214 . 0 0 "[ . 1 . 2]" 1
231 1 18 ASN HB3 1 19 PHE H . . 3.700 3.544 3.103 3.695 . 0 0 "[ . 1 . 2]" 1
232 1 18 ASN HB3 1 108 THR MG . . 3.090 2.076 1.834 2.506 . 0 0 "[ . 1 . 2]" 1
233 1 18 ASN QD 1 108 THR MG . . 4.460 3.940 3.428 4.297 . 0 0 "[ . 1 . 2]" 1
234 1 18 ASN HD21 1 108 THR MG . . 4.920 4.130 3.514 4.601 . 0 0 "[ . 1 . 2]" 1
235 1 18 ASN HD22 1 108 THR MG . . 5.100 5.016 4.764 5.153 0.053 16 0 "[ . 1 . 2]" 1
236 1 19 PHE H 1 19 PHE HB2 . . 3.470 2.509 2.385 2.602 . 0 0 "[ . 1 . 2]" 1
237 1 19 PHE H 1 19 PHE QB . . 3.260 2.248 2.229 2.269 . 0 0 "[ . 1 . 2]" 1
238 1 19 PHE H 1 19 PHE HB3 . . 3.940 2.545 2.463 2.678 . 0 0 "[ . 1 . 2]" 1
239 1 19 PHE H 1 19 PHE QD . . 4.480 4.183 4.137 4.202 . 0 0 "[ . 1 . 2]" 1
240 1 19 PHE H 1 20 MET H . . 3.760 2.780 2.728 2.871 . 0 0 "[ . 1 . 2]" 1
241 1 19 PHE H 1 21 ASN H . . 4.830 4.010 3.753 4.157 . 0 0 "[ . 1 . 2]" 1
242 1 19 PHE H 1 108 THR MG . . 3.770 2.940 2.576 3.149 . 0 0 "[ . 1 . 2]" 1
243 1 19 PHE HA 1 19 PHE QD . . 3.890 2.713 2.373 2.943 . 0 0 "[ . 1 . 2]" 1
244 1 19 PHE HA 1 104 ALA MB . . 3.670 2.748 2.173 3.195 . 0 0 "[ . 1 . 2]" 1
245 1 19 PHE HA 1 108 THR MG . . 3.420 2.376 1.933 2.747 . 0 0 "[ . 1 . 2]" 1
246 1 19 PHE QB 1 20 MET H . . 3.830 2.365 2.173 2.460 . 0 0 "[ . 1 . 2]" 1
247 1 19 PHE QB 1 108 THR MG . . 4.980 2.840 2.371 3.267 . 0 0 "[ . 1 . 2]" 1
248 1 19 PHE HB2 1 20 MET H . . 4.440 3.761 3.558 3.843 . 0 0 "[ . 1 . 2]" 1
249 1 19 PHE HB3 1 20 MET H . . 4.180 2.391 2.192 2.489 . 0 0 "[ . 1 . 2]" 1
250 1 19 PHE HB3 1 108 THR MG . . 5.110 4.119 3.739 4.462 . 0 0 "[ . 1 . 2]" 1
251 1 19 PHE QD 1 20 MET H . . 4.260 3.340 3.002 3.722 . 0 0 "[ . 1 . 2]" 1
252 1 19 PHE QD 1 20 MET HA . . 4.700 3.457 3.101 3.985 . 0 0 "[ . 1 . 2]" 1
253 1 19 PHE QD 1 20 MET QG . . 4.580 3.281 2.692 4.292 . 0 0 "[ . 1 . 2]" 1
254 1 19 PHE QD 1 20 MET HG3 . . 4.690 4.576 4.035 5.408 0.718 14 1 "[ . 1 +. 2]" 1
255 1 19 PHE QD 1 104 ALA MB . . 3.820 2.971 2.676 3.390 . 0 0 "[ . 1 . 2]" 1
256 1 19 PHE QD 1 108 THR MG . . 4.220 3.254 2.833 3.510 . 0 0 "[ . 1 . 2]" 1
257 1 19 PHE QE 1 20 MET ME . . 4.680 3.782 3.296 4.678 . 0 0 "[ . 1 . 2]" 1
258 1 19 PHE QE 1 101 MET ME . . 4.150 4.297 4.227 4.414 0.264 10 0 "[ . 1 . 2]" 1
259 1 19 PHE QE 1 101 MET HG2 . . 4.910 3.058 2.716 3.483 . 0 0 "[ . 1 . 2]" 1
260 1 19 PHE QE 1 101 MET QG . . 4.430 2.952 2.258 3.392 . 0 0 "[ . 1 . 2]" 1
261 1 19 PHE QE 1 101 MET HG3 . . 5.050 4.146 2.414 4.786 . 0 0 "[ . 1 . 2]" 1
262 1 19 PHE QE 1 104 ALA MB . . 3.820 2.809 2.548 3.088 . 0 0 "[ . 1 . 2]" 1
263 1 19 PHE QE 1 105 PHE H . . 4.580 2.846 2.440 3.484 . 0 0 "[ . 1 . 2]" 1
264 1 19 PHE HZ 1 101 MET HA . . 4.180 3.132 2.636 3.829 . 0 0 "[ . 1 . 2]" 1
265 1 19 PHE HZ 1 101 MET HB2 . . 4.920 4.275 3.657 4.827 . 0 0 "[ . 1 . 2]" 1
266 1 19 PHE HZ 1 101 MET QB . . 4.800 2.843 1.937 3.862 . 0 0 "[ . 1 . 2]" 1
267 1 19 PHE HZ 1 101 MET ME . . 3.940 3.583 3.343 3.954 0.014 16 0 "[ . 1 . 2]" 1
268 1 19 PHE HZ 1 101 MET HG2 . . 3.470 2.429 1.895 2.965 . 0 0 "[ . 1 . 2]" 1
269 1 19 PHE HZ 1 101 MET QG . . 3.330 2.386 1.760 2.927 . 0 0 "[ . 1 . 2]" 1
270 1 19 PHE HZ 1 101 MET HG3 . . 4.270 3.735 1.992 4.531 0.261 14 0 "[ . 1 . 2]" 1
271 1 19 PHE HZ 1 104 ALA MB . . 3.910 3.670 3.424 3.906 . 0 0 "[ . 1 . 2]" 1
272 1 20 MET H 1 20 MET HB2 . . 3.900 2.500 2.197 3.613 . 0 0 "[ . 1 . 2]" 1
273 1 20 MET H 1 20 MET QB . . 3.400 2.415 2.176 2.754 . 0 0 "[ . 1 . 2]" 1
274 1 20 MET H 1 20 MET HB3 . . 3.750 3.541 2.761 3.606 . 0 0 "[ . 1 . 2]" 1
275 1 20 MET H 1 20 MET ME . . 5.500 4.306 3.965 4.598 . 0 0 "[ . 1 . 2]" 1
276 1 20 MET H 1 20 MET HG2 . . 4.340 2.521 1.840 4.013 . 0 0 "[ . 1 . 2]" 1
277 1 20 MET H 1 20 MET QG . . 3.500 2.433 1.833 3.558 0.058 19 0 "[ . 1 . 2]" 1
278 1 20 MET H 1 20 MET HG3 . . 3.690 3.713 3.437 3.974 0.284 19 0 "[ . 1 . 2]" 1
279 1 20 MET H 1 21 ASN H . . 3.680 2.642 2.433 2.733 . 0 0 "[ . 1 . 2]" 1
280 1 20 MET H 1 21 ASN HB2 . . 4.480 4.468 4.241 4.564 0.084 6 0 "[ . 1 . 2]" 1
281 1 20 MET H 1 21 ASN QB . . 4.390 4.336 4.110 4.439 0.049 6 0 "[ . 1 . 2]" 1
282 1 20 MET H 1 22 SER H . . 4.630 4.458 4.222 4.612 . 0 0 "[ . 1 . 2]" 1
283 1 20 MET H 1 49 VAL QG . . 4.310 4.006 3.635 4.381 0.071 14 0 "[ . 1 . 2]" 1
284 1 20 MET HA 1 20 MET ME . . 4.420 3.995 3.650 4.101 . 0 0 "[ . 1 . 2]" 1
285 1 20 MET HA 1 23 PHE H . . 3.830 3.329 3.068 3.469 . 0 0 "[ . 1 . 2]" 1
286 1 20 MET HA 1 23 PHE HA . . 4.850 4.845 4.488 4.934 0.084 6 0 "[ . 1 . 2]" 1
287 1 20 MET HA 1 23 PHE HB2 . . 4.010 2.811 2.504 2.945 . 0 0 "[ . 1 . 2]" 1
288 1 20 MET HA 1 23 PHE QB . . 3.680 2.091 1.773 2.314 . 0 0 "[ . 1 . 2]" 1
289 1 20 MET HA 1 23 PHE HB3 . . 4.280 2.162 1.813 2.463 . 0 0 "[ . 1 . 2]" 1
290 1 20 MET HA 1 23 PHE QD . . 4.390 3.530 3.219 3.958 . 0 0 "[ . 1 . 2]" 1
291 1 20 MET HB2 1 21 ASN H . . 3.860 2.812 2.581 3.910 0.050 14 0 "[ . 1 . 2]" 1
292 1 20 MET HB3 1 21 ASN H . . 3.940 3.681 3.328 4.148 0.208 14 0 "[ . 1 . 2]" 1
293 1 20 MET ME 1 20 MET HG2 . . 3.540 2.604 2.454 3.400 . 0 0 "[ . 1 . 2]" 1
294 1 20 MET ME 1 20 MET QG . . 3.070 2.239 2.202 2.533 . 0 0 "[ . 1 . 2]" 1
295 1 20 MET ME 1 20 MET HG3 . . 3.360 2.472 2.249 2.613 . 0 0 "[ . 1 . 2]" 1
296 1 20 MET ME 1 48 MET ME . . 3.370 3.151 2.567 3.443 0.073 14 0 "[ . 1 . 2]" 1
297 1 20 MET ME 1 48 MET QG . . 2.870 2.557 1.890 3.031 0.161 12 0 "[ . 1 . 2]" 1
298 1 20 MET ME 1 49 VAL H . . 4.070 3.889 3.277 4.138 0.068 16 0 "[ . 1 . 2]" 1
299 1 20 MET ME 1 49 VAL QG . . 3.400 3.003 2.544 3.446 0.046 4 0 "[ . 1 . 2]" 1
300 1 20 MET ME 1 73 PHE QD . . 3.820 3.185 2.362 3.815 . 0 0 "[ . 1 . 2]" 1
301 1 20 MET ME 1 73 PHE QE . . 3.790 2.346 1.968 2.809 . 0 0 "[ . 1 . 2]" 1
302 1 20 MET ME 1 73 PHE HZ . . 4.040 3.559 2.931 4.038 . 0 0 "[ . 1 . 2]" 1
303 1 20 MET QG 1 49 VAL QG . . 3.390 2.224 1.977 2.601 . 0 0 "[ . 1 . 2]" 1
304 1 20 MET HG2 1 49 VAL QG . . 3.820 2.848 2.317 3.242 . 0 0 "[ . 1 . 2]" 1
305 1 20 MET HG3 1 49 VAL QG . . 3.830 2.504 2.051 3.863 0.033 3 0 "[ . 1 . 2]" 1
306 1 21 ASN H 1 21 ASN HB2 . . 3.110 2.121 2.020 2.179 . 0 0 "[ . 1 . 2]" 1
307 1 21 ASN H 1 21 ASN QB . . 2.840 2.101 1.996 2.158 . 0 0 "[ . 1 . 2]" 1
308 1 21 ASN H 1 21 ASN HB3 . . 3.280 3.384 3.105 3.478 0.198 18 0 "[ . 1 . 2]" 1
309 1 21 ASN H 1 21 ASN HD21 . . 4.790 2.916 2.378 3.950 . 0 0 "[ . 1 . 2]" 1
310 1 21 ASN H 1 21 ASN QD . . 4.070 2.867 2.359 3.825 . 0 0 "[ . 1 . 2]" 1
311 1 21 ASN H 1 21 ASN HD22 . . 4.400 4.352 3.909 5.116 0.716 16 3 "[ . -1 .+ *]" 1
312 1 21 ASN H 1 22 SER H . . 3.340 2.825 2.715 3.035 . 0 0 "[ . 1 . 2]" 1
313 1 21 ASN H 1 23 PHE H . . 4.850 3.842 3.692 3.995 . 0 0 "[ . 1 . 2]" 1
314 1 21 ASN H 1 49 VAL QG . . 5.400 4.833 4.471 5.352 . 0 0 "[ . 1 . 2]" 1
315 1 21 ASN HA 1 21 ASN QB . . 2.590 2.505 2.481 2.539 . 0 0 "[ . 1 . 2]" 1
316 1 21 ASN HA 1 21 ASN HB3 . . 2.810 2.745 2.656 2.936 0.126 20 0 "[ . 1 . 2]" 1
317 1 21 ASN HA 1 21 ASN HD21 . . 4.220 3.537 3.042 4.190 . 0 0 "[ . 1 . 2]" 1
318 1 21 ASN HA 1 21 ASN QD . . 3.610 3.305 2.906 3.780 0.170 17 0 "[ . 1 . 2]" 1
319 1 21 ASN HA 1 21 ASN HD22 . . 3.920 3.982 3.686 4.301 0.381 17 0 "[ . 1 . 2]" 1
320 1 21 ASN QB 1 21 ASN QD . . 2.990 2.166 2.052 2.220 . 0 0 "[ . 1 . 2]" 1
321 1 21 ASN HB2 1 21 ASN HD22 . . 3.460 3.473 3.396 3.502 0.042 15 0 "[ . 1 . 2]" 1
322 1 21 ASN HB2 1 22 SER H . . 3.580 2.758 2.561 3.146 . 0 0 "[ . 1 . 2]" 1
323 1 21 ASN HB3 1 22 SER H . . 3.630 2.805 2.210 3.053 . 0 0 "[ . 1 . 2]" 1
324 1 21 ASN QD 1 22 SER H . . 4.910 4.588 4.389 4.901 . 0 0 "[ . 1 . 2]" 1
325 1 21 ASN HD21 1 22 SER H . . 5.040 4.766 4.528 5.170 0.130 9 0 "[ . 1 . 2]" 1
326 1 22 SER H 1 22 SER QB . . 2.890 2.417 2.249 2.652 . 0 0 "[ . 1 . 2]" 1
327 1 22 SER H 1 23 PHE H . . 3.370 2.575 2.518 2.623 . 0 0 "[ . 1 . 2]" 1
328 1 22 SER QB 1 23 PHE H . . 3.540 2.762 2.604 3.409 . 0 0 "[ . 1 . 2]" 1
329 1 22 SER QB 1 104 ALA H . . 4.890 4.508 4.037 4.931 0.041 13 0 "[ . 1 . 2]" 1
330 1 22 SER QB 1 104 ALA HA . . 3.830 2.311 1.927 2.789 . 0 0 "[ . 1 . 2]" 1
331 1 22 SER QB 1 104 ALA MB . . 3.540 2.270 1.986 3.357 . 0 0 "[ . 1 . 2]" 1
332 1 23 PHE H 1 23 PHE HB2 . . 3.610 2.577 2.509 2.642 . 0 0 "[ . 1 . 2]" 1
333 1 23 PHE H 1 23 PHE HB3 . . 3.630 2.461 2.388 2.520 . 0 0 "[ . 1 . 2]" 1
334 1 23 PHE H 1 23 PHE QD . . 4.240 4.179 4.156 4.196 . 0 0 "[ . 1 . 2]" 1
335 1 23 PHE H 1 24 MET H . . 3.690 2.832 2.755 2.929 . 0 0 "[ . 1 . 2]" 1
336 1 23 PHE H 1 104 ALA MB . . 3.790 2.815 2.645 3.051 . 0 0 "[ . 1 . 2]" 1
337 1 23 PHE HA 1 23 PHE QD . . 3.120 2.678 2.466 2.974 . 0 0 "[ . 1 . 2]" 1
338 1 23 PHE HA 1 27 LEU QD . . 4.980 4.669 4.157 5.029 0.049 15 0 "[ . 1 . 2]" 1
339 1 23 PHE HA 1 100 ALA MB . . 4.280 2.878 2.535 3.360 . 0 0 "[ . 1 . 2]" 1
340 1 23 PHE HA 1 104 ALA MB . . 3.320 2.340 1.954 2.687 . 0 0 "[ . 1 . 2]" 1
341 1 23 PHE QB 1 24 MET H . . 3.390 2.373 2.269 2.449 . 0 0 "[ . 1 . 2]" 1
342 1 23 PHE QB 1 104 ALA MB . . 3.580 2.745 2.363 2.897 . 0 0 "[ . 1 . 2]" 1
343 1 23 PHE HB2 1 24 MET H . . 3.550 3.803 3.717 3.850 0.300 2 0 "[ . 1 . 2]" 1
344 1 23 PHE HB2 1 104 ALA MB . . 3.940 2.801 2.398 2.967 . 0 0 "[ . 1 . 2]" 1
345 1 23 PHE HB3 1 24 MET H . . 4.300 2.397 2.289 2.477 . 0 0 "[ . 1 . 2]" 1
346 1 23 PHE HB3 1 104 ALA MB . . 4.120 3.939 3.569 4.133 0.013 5 0 "[ . 1 . 2]" 1
347 1 23 PHE QD 1 24 MET H . . 3.940 3.181 2.747 3.463 . 0 0 "[ . 1 . 2]" 1
348 1 23 PHE QD 1 24 MET ME . . 3.250 2.892 2.445 3.354 0.104 5 0 "[ . 1 . 2]" 1
349 1 23 PHE QD 1 24 MET QG . . 4.440 2.944 2.211 4.527 0.087 15 0 "[ . 1 . 2]" 1
350 1 23 PHE QD 1 100 ALA MB . . 3.940 2.842 2.486 3.272 . 0 0 "[ . 1 . 2]" 1
351 1 23 PHE QD 1 101 MET HA . . 3.920 2.505 1.991 2.769 . 0 0 "[ . 1 . 2]" 1
352 1 23 PHE QD 1 101 MET HG2 . . 4.130 3.386 2.480 4.318 0.188 16 0 "[ . 1 . 2]" 1
353 1 23 PHE QD 1 101 MET QG . . 4.050 2.573 2.276 3.270 . 0 0 "[ . 1 . 2]" 1
354 1 23 PHE QD 1 104 ALA MB . . 4.220 3.296 2.903 3.507 . 0 0 "[ . 1 . 2]" 1
355 1 23 PHE QE 1 24 MET HA . . 4.950 4.454 3.901 4.873 . 0 0 "[ . 1 . 2]" 1
356 1 23 PHE QE 1 27 LEU QD . . 4.030 2.536 2.051 2.975 . 0 0 "[ . 1 . 2]" 1
357 1 23 PHE QE 1 97 ILE HA . . 4.320 2.883 2.398 3.401 . 0 0 "[ . 1 . 2]" 1
358 1 23 PHE QE 1 97 ILE MG . . 3.750 2.105 1.896 2.353 . 0 0 "[ . 1 . 2]" 1
359 1 23 PHE QE 1 100 ALA H . . 5.000 4.609 4.179 5.021 0.021 5 0 "[ . 1 . 2]" 1
360 1 23 PHE QE 1 100 ALA MB . . 4.050 2.789 2.428 3.149 . 0 0 "[ . 1 . 2]" 1
361 1 23 PHE QE 1 101 MET H . . 4.550 3.420 2.907 3.780 . 0 0 "[ . 1 . 2]" 1
362 1 23 PHE QE 1 101 MET QG . . 3.910 2.293 1.913 3.459 . 0 0 "[ . 1 . 2]" 1
363 1 23 PHE QE 1 101 MET HG3 . . 3.980 2.325 1.924 3.540 . 0 0 "[ . 1 . 2]" 1
364 1 23 PHE HZ 1 97 ILE MG . . 3.820 2.110 1.997 2.372 . 0 0 "[ . 1 . 2]" 1
365 1 24 MET H 1 24 MET QG . . 3.610 2.499 2.039 3.864 0.254 6 0 "[ . 1 . 2]" 1
366 1 24 MET H 1 25 GLN H . . 3.720 2.619 2.539 2.691 . 0 0 "[ . 1 . 2]" 1
367 1 24 MET H 1 104 ALA MB . . 5.000 4.838 4.625 5.009 0.009 5 0 "[ . 1 . 2]" 1
368 1 24 MET HA 1 24 MET ME . . 3.470 2.286 1.771 3.634 0.164 8 0 "[ . 1 . 2]" 1
369 1 24 MET HA 1 24 MET QG . . 3.730 2.872 2.500 3.199 . 0 0 "[ . 1 . 2]" 1
370 1 24 MET HA 1 27 LEU H . . 3.450 3.149 2.897 3.324 . 0 0 "[ . 1 . 2]" 1
371 1 24 MET HA 1 27 LEU HB2 . . 3.960 2.744 2.363 3.127 . 0 0 "[ . 1 . 2]" 1
372 1 24 MET HA 1 27 LEU QB . . 3.430 2.292 2.112 2.445 . 0 0 "[ . 1 . 2]" 1
373 1 24 MET HA 1 27 LEU HB3 . . 3.750 2.526 2.157 2.835 . 0 0 "[ . 1 . 2]" 1
374 1 24 MET HA 1 27 LEU QD . . 4.490 3.636 3.148 4.036 . 0 0 "[ . 1 . 2]" 1
375 1 24 MET HA 1 28 SER H . . 4.620 3.745 3.374 4.181 . 0 0 "[ . 1 . 2]" 1
376 1 24 MET ME 1 24 MET QG . . 3.060 2.422 2.213 2.541 . 0 0 "[ . 1 . 2]" 1
377 1 24 MET ME 1 27 LEU QB . . 4.360 2.733 2.090 3.738 . 0 0 "[ . 1 . 2]" 1
378 1 24 MET ME 1 27 LEU HB3 . . 4.450 2.853 2.172 3.973 . 0 0 "[ . 1 . 2]" 1
379 1 24 MET ME 1 38 LEU HA . . 3.180 2.933 2.262 3.221 0.041 8 0 "[ . 1 . 2]" 1
380 1 24 MET ME 1 38 LEU QB . . 3.800 3.361 2.604 3.922 0.122 14 0 "[ . 1 . 2]" 1
381 1 24 MET ME 1 38 LEU HB3 . . 3.860 3.485 2.650 4.429 0.569 14 1 "[ . 1 +. 2]" 1
382 1 24 MET QG 1 42 SER HA . . 4.160 3.390 2.946 3.845 . 0 0 "[ . 1 . 2]" 1
383 1 24 MET QG 1 42 SER QB . . 3.960 3.249 2.311 4.038 0.078 16 0 "[ . 1 . 2]" 1
384 1 25 GLN H 1 25 GLN QB . . 2.810 2.423 2.350 2.535 . 0 0 "[ . 1 . 2]" 1
385 1 25 GLN H 1 25 GLN HG2 . . 3.310 2.996 2.057 3.629 0.319 16 0 "[ . 1 . 2]" 1
386 1 25 GLN H 1 25 GLN QG . . 3.050 2.233 2.039 2.364 . 0 0 "[ . 1 . 2]" 1
387 1 25 GLN H 1 25 GLN HG3 . . 3.580 2.808 2.060 3.667 0.087 8 0 "[ . 1 . 2]" 1
388 1 25 GLN HA 1 25 GLN QB . . 2.560 2.389 2.354 2.409 . 0 0 "[ . 1 . 2]" 1
389 1 25 GLN HA 1 25 GLN HG2 . . 3.110 2.720 2.508 3.126 0.016 20 0 "[ . 1 . 2]" 1
390 1 25 GLN HA 1 25 GLN QG . . 3.040 2.596 2.374 2.988 . 0 0 "[ . 1 . 2]" 1
391 1 25 GLN HA 1 28 SER H . . 4.670 3.964 3.661 4.330 . 0 0 "[ . 1 . 2]" 1
392 1 25 GLN QB 1 25 GLN HG2 . . 2.400 2.341 2.310 2.396 . 0 0 "[ . 1 . 2]" 1
393 1 25 GLN QB 1 25 GLN QG . . 2.310 2.051 1.991 2.089 . 0 0 "[ . 1 . 2]" 1
394 1 25 GLN QB 1 26 GLY H . . 2.690 2.611 2.358 2.768 0.078 16 0 "[ . 1 . 2]" 1
395 1 25 GLN QG 1 26 GLY H . . 4.640 4.110 3.939 4.234 . 0 0 "[ . 1 . 2]" 1
396 1 25 GLN HG2 1 26 GLY H . . 4.750 4.770 4.226 5.132 0.382 16 0 "[ . 1 . 2]" 1
397 1 26 GLY H 1 26 GLY HA2 . . 2.840 2.891 2.853 2.918 0.078 8 0 "[ . 1 . 2]" 1
398 1 26 GLY H 1 26 GLY HA3 . . 2.870 2.328 2.303 2.355 . 0 0 "[ . 1 . 2]" 1
399 1 26 GLY H 1 27 LEU H . . 3.360 2.396 2.253 2.555 . 0 0 "[ . 1 . 2]" 1
400 1 26 GLY H 1 27 LEU HB2 . . 4.860 4.350 4.121 4.680 . 0 0 "[ . 1 . 2]" 1
401 1 26 GLY H 1 27 LEU QB . . 4.740 4.082 3.955 4.246 . 0 0 "[ . 1 . 2]" 1
402 1 26 GLY H 1 28 SER H . . 4.250 4.071 3.936 4.223 . 0 0 "[ . 1 . 2]" 1
403 1 26 GLY H 1 100 ALA MB . . 4.810 3.758 3.539 4.089 . 0 0 "[ . 1 . 2]" 1
404 1 26 GLY QA 1 100 ALA MB . . 4.890 2.938 2.617 3.710 . 0 0 "[ . 1 . 2]" 1
405 1 26 GLY HA3 1 100 ALA MB . . 5.020 2.994 2.654 3.812 . 0 0 "[ . 1 . 2]" 1
406 1 27 LEU H 1 27 LEU HB2 . . 3.350 2.223 2.023 2.415 . 0 0 "[ . 1 . 2]" 1
407 1 27 LEU H 1 27 LEU HB3 . . 3.340 2.829 2.624 3.070 . 0 0 "[ . 1 . 2]" 1
408 1 27 LEU H 1 27 LEU QD . . 3.840 3.494 3.208 3.670 . 0 0 "[ . 1 . 2]" 1
409 1 27 LEU H 1 28 SER H . . 3.340 2.656 2.455 2.749 . 0 0 "[ . 1 . 2]" 1
410 1 27 LEU H 1 100 ALA MB . . 4.010 2.898 2.582 3.270 . 0 0 "[ . 1 . 2]" 1
411 1 27 LEU HA 1 27 LEU QD . . 2.880 2.005 1.848 2.293 . 0 0 "[ . 1 . 2]" 1
412 1 27 LEU HA 1 30 MET H . . 3.840 3.474 3.196 3.765 . 0 0 "[ . 1 . 2]" 1
413 1 27 LEU HA 1 30 MET HB2 . . 4.130 2.978 2.692 3.453 . 0 0 "[ . 1 . 2]" 1
414 1 27 LEU HA 1 30 MET QB . . 4.050 2.918 2.649 3.374 . 0 0 "[ . 1 . 2]" 1
415 1 27 LEU HA 1 30 MET ME . . 5.240 3.509 2.930 3.898 . 0 0 "[ . 1 . 2]" 1
416 1 27 LEU HA 1 30 MET QG . . 3.750 2.083 1.864 2.513 . 0 0 "[ . 1 . 2]" 1
417 1 27 LEU HA 1 100 ALA MB . . 3.370 2.737 2.387 2.994 . 0 0 "[ . 1 . 2]" 1
418 1 27 LEU QB 1 28 SER H . . 3.330 2.726 2.555 2.930 . 0 0 "[ . 1 . 2]" 1
419 1 27 LEU QB 1 100 ALA MB . . 4.480 2.849 2.471 3.313 . 0 0 "[ . 1 . 2]" 1
420 1 27 LEU HB2 1 28 SER H . . 3.870 3.696 3.429 3.921 0.051 6 0 "[ . 1 . 2]" 1
421 1 27 LEU HB2 1 100 ALA MB . . 4.580 2.900 2.503 3.395 . 0 0 "[ . 1 . 2]" 1
422 1 27 LEU HB3 1 28 SER H . . 3.630 2.811 2.622 3.025 . 0 0 "[ . 1 . 2]" 1
423 1 27 LEU QD 1 28 SER H . . 4.960 3.937 3.680 4.256 . 0 0 "[ . 1 . 2]" 1
424 1 27 LEU QD 1 30 MET H . . 4.590 3.998 3.575 4.482 . 0 0 "[ . 1 . 2]" 1
425 1 27 LEU QD 1 30 MET HB2 . . 3.950 2.765 2.340 3.232 . 0 0 "[ . 1 . 2]" 1
426 1 27 LEU QD 1 30 MET QB . . 3.860 2.680 2.291 3.118 . 0 0 "[ . 1 . 2]" 1
427 1 27 LEU QD 1 30 MET ME . . 3.910 3.581 3.261 3.923 0.013 15 0 "[ . 1 . 2]" 1
428 1 27 LEU QD 1 30 MET QG . . 3.990 2.385 1.938 3.626 . 0 0 "[ . 1 . 2]" 1
429 1 27 LEU QD 1 33 PHE QD . . 3.770 2.622 2.057 3.339 . 0 0 "[ . 1 . 2]" 1
430 1 27 LEU QD 1 33 PHE QE . . 3.380 2.661 2.137 3.009 . 0 0 "[ . 1 . 2]" 1
431 1 27 LEU QD 1 38 LEU QD . . 3.230 1.981 1.780 2.748 . 0 0 "[ . 1 . 2]" 1
432 1 27 LEU QD 1 41 MET ME . . 2.900 2.881 2.547 2.991 0.091 14 0 "[ . 1 . 2]" 1
433 1 27 LEU QD 1 41 MET HG2 . . 4.540 4.032 2.434 4.650 0.110 9 0 "[ . 1 . 2]" 1
434 1 27 LEU QD 1 41 MET QG . . 4.100 3.672 2.396 4.214 0.114 11 0 "[ . 1 . 2]" 1
435 1 27 LEU QD 1 41 MET HG3 . . 4.760 4.416 2.945 4.960 0.200 14 0 "[ . 1 . 2]" 1
436 1 27 LEU QD 1 96 SER HA . . 4.270 4.296 4.151 4.422 0.152 12 0 "[ . 1 . 2]" 1
437 1 27 LEU QD 1 96 SER QB . . 3.660 2.916 2.608 3.514 . 0 0 "[ . 1 . 2]" 1
438 1 27 LEU QD 1 97 ILE H . . 5.150 3.583 3.371 3.825 . 0 0 "[ . 1 . 2]" 1
439 1 27 LEU QD 1 97 ILE HA . . 3.880 2.172 1.892 2.646 . 0 0 "[ . 1 . 2]" 1
440 1 27 LEU QD 1 97 ILE MD . . 4.690 3.645 3.436 4.032 . 0 0 "[ . 1 . 2]" 1
441 1 27 LEU QD 1 97 ILE HG12 . . 5.060 2.484 2.273 3.034 . 0 0 "[ . 1 . 2]" 1
442 1 27 LEU QD 1 97 ILE QG . . 4.080 2.407 2.224 2.904 . 0 0 "[ . 1 . 2]" 1
443 1 27 LEU QD 1 97 ILE HG13 . . 4.440 3.250 2.888 3.707 . 0 0 "[ . 1 . 2]" 1
444 1 27 LEU QD 1 97 ILE MG . . 4.220 3.122 2.905 3.536 . 0 0 "[ . 1 . 2]" 1
445 1 27 LEU QD 1 100 ALA H . . 4.690 3.834 3.634 4.025 . 0 0 "[ . 1 . 2]" 1
446 1 27 LEU QD 1 100 ALA MB . . 3.370 2.209 1.982 2.485 . 0 0 "[ . 1 . 2]" 1
447 1 27 LEU HG 1 28 SER H . . 5.500 4.783 4.113 5.289 . 0 0 "[ . 1 . 2]" 1
448 1 27 LEU HG 1 38 LEU QD . . 3.420 3.120 2.425 3.501 0.081 5 0 "[ . 1 . 2]" 1
449 1 28 SER H 1 28 SER HB2 . . 3.400 3.430 2.521 3.538 0.138 20 0 "[ . 1 . 2]" 1
450 1 28 SER H 1 28 SER QB . . 2.730 2.636 2.269 2.719 . 0 0 "[ . 1 . 2]" 1
451 1 28 SER H 1 28 SER HB3 . . 2.880 2.787 2.534 3.553 0.673 3 1 "[ + . 1 . 2]" 1
452 1 28 SER H 1 29 SER HA . . 5.210 5.188 5.140 5.242 0.032 1 0 "[ . 1 . 2]" 1
453 1 28 SER H 1 38 LEU QD . . 4.420 3.458 2.610 3.871 . 0 0 "[ . 1 . 2]" 1
454 1 28 SER HA 1 28 SER HB2 . . 2.890 2.579 2.473 3.029 0.139 3 0 "[ . 1 . 2]" 1
455 1 28 SER HA 1 28 SER QB . . 2.630 2.197 2.174 2.369 . 0 0 "[ . 1 . 2]" 1
456 1 28 SER HA 1 38 LEU QD . . 2.810 2.122 1.829 2.464 . 0 0 "[ . 1 . 2]" 1
457 1 28 SER QB 1 38 LEU QD . . 4.320 2.321 1.801 2.849 . 0 0 "[ . 1 . 2]" 1
458 1 28 SER HB2 1 38 LEU QD . . 4.710 3.129 2.538 3.856 . 0 0 "[ . 1 . 2]" 1
459 1 28 SER HB3 1 38 LEU QD . . 5.120 2.458 1.817 3.696 . 0 0 "[ . 1 . 2]" 1
460 1 29 SER H 1 29 SER HB2 . . 3.440 2.573 2.491 2.969 . 0 0 "[ . 1 . 2]" 1
461 1 29 SER H 1 29 SER QB . . 3.130 2.470 2.317 2.533 . 0 0 "[ . 1 . 2]" 1
462 1 29 SER H 1 29 SER HB3 . . 3.610 3.496 2.470 3.713 0.103 11 0 "[ . 1 . 2]" 1
463 1 29 SER H 1 30 MET H . . 2.900 2.276 2.114 2.440 . 0 0 "[ . 1 . 2]" 1
464 1 29 SER H 1 30 MET HA . . 5.140 4.700 4.508 4.826 . 0 0 "[ . 1 . 2]" 1
465 1 29 SER H 1 30 MET HB2 . . 4.780 4.371 4.039 4.544 . 0 0 "[ . 1 . 2]" 1
466 1 29 SER H 1 30 MET QB . . 4.670 4.222 3.929 4.370 . 0 0 "[ . 1 . 2]" 1
467 1 29 SER H 1 30 MET QG . . 4.070 3.235 3.098 3.419 . 0 0 "[ . 1 . 2]" 1
468 1 29 SER HA 1 29 SER HB2 . . 2.980 2.944 2.457 3.028 0.048 17 0 "[ . 1 . 2]" 1
469 1 29 SER HA 1 29 SER HB3 . . 2.950 2.529 2.404 3.030 0.080 20 0 "[ . 1 . 2]" 1
470 1 29 SER QB 1 30 MET H . . 3.980 3.453 3.321 3.586 . 0 0 "[ . 1 . 2]" 1
471 1 29 SER QB 1 30 MET QG . . 4.210 3.595 3.244 3.951 . 0 0 "[ . 1 . 2]" 1
472 1 29 SER HB2 1 30 MET H . . 4.270 3.732 3.459 4.416 0.146 12 0 "[ . 1 . 2]" 1
473 1 29 SER HB2 1 30 MET QG . . 4.390 3.894 3.328 5.280 0.890 12 2 "[ . 1 + . -]" 1
474 1 29 SER HB3 1 30 MET H . . 4.760 4.252 3.516 4.440 . 0 0 "[ . 1 . 2]" 1
475 1 30 MET H 1 30 MET HB2 . . 3.330 2.483 2.358 2.586 . 0 0 "[ . 1 . 2]" 1
476 1 30 MET H 1 30 MET QB . . 3.090 2.444 2.328 2.538 . 0 0 "[ . 1 . 2]" 1
477 1 30 MET H 1 30 MET HB3 . . 3.650 3.639 3.592 3.684 0.034 17 0 "[ . 1 . 2]" 1
478 1 30 MET H 1 30 MET ME . . 4.610 4.588 4.300 4.687 0.077 16 0 "[ . 1 . 2]" 1
479 1 30 MET H 1 30 MET QG . . 3.500 2.504 2.331 2.716 . 0 0 "[ . 1 . 2]" 1
480 1 30 MET H 1 31 PRO HD2 . . 4.660 4.929 4.782 5.385 0.725 7 3 "[ - .*+ 1 . 2]" 1
481 1 30 MET H 1 31 PRO QD . . 4.560 4.250 4.061 4.344 . 0 0 "[ . 1 . 2]" 1
482 1 30 MET HA 1 30 MET QG . . 3.600 2.923 2.433 3.030 . 0 0 "[ . 1 . 2]" 1
483 1 30 MET HA 1 31 PRO HD2 . . 3.660 2.201 1.997 2.765 . 0 0 "[ . 1 . 2]" 1
484 1 30 MET HA 1 31 PRO QD . . 3.210 1.928 1.807 1.975 . 0 0 "[ . 1 . 2]" 1
485 1 30 MET HA 1 31 PRO HD3 . . 3.550 2.231 1.831 2.431 . 0 0 "[ . 1 . 2]" 1
486 1 30 MET HA 1 31 PRO HG2 . . 4.020 4.304 4.193 4.431 0.411 6 0 "[ . 1 . 2]" 1
487 1 30 MET HA 1 31 PRO QG . . 3.820 3.830 3.699 3.879 0.059 12 0 "[ . 1 . 2]" 1
488 1 30 MET HA 1 31 PRO HG3 . . 4.780 4.308 3.965 4.413 . 0 0 "[ . 1 . 2]" 1
489 1 30 MET ME 1 99 SER H . . 3.630 3.732 3.681 3.805 0.175 16 0 "[ . 1 . 2]" 1
490 1 30 MET ME 1 99 SER QB . . 2.850 2.016 1.875 2.333 . 0 0 "[ . 1 . 2]" 1
491 1 30 MET ME 1 100 ALA H . . 3.140 2.415 2.278 2.647 . 0 0 "[ . 1 . 2]" 1
492 1 30 MET ME 1 100 ALA HA . . 2.770 2.748 2.356 2.893 0.123 17 0 "[ . 1 . 2]" 1
493 1 30 MET ME 1 100 ALA MB . . 3.040 2.288 2.034 2.593 . 0 0 "[ . 1 . 2]" 1
494 1 30 MET ME 1 103 ASN QB . . 4.190 3.871 3.387 4.200 0.010 2 0 "[ . 1 . 2]" 1
495 1 30 MET ME 1 103 ASN HD21 . . 4.020 4.135 3.555 4.356 0.336 15 0 "[ . 1 . 2]" 1
496 1 30 MET ME 1 103 ASN QD . . 3.950 3.986 3.471 4.131 0.181 15 0 "[ . 1 . 2]" 1
497 1 30 MET QG 1 100 ALA MB . . 4.630 2.758 2.227 3.969 . 0 0 "[ . 1 . 2]" 1
498 1 31 PRO HA 1 32 GLY H . . 3.150 2.355 2.147 3.255 0.105 2 0 "[ . 1 . 2]" 1
499 1 31 PRO HA 1 33 PHE H . . 4.560 3.761 3.246 4.332 . 0 0 "[ . 1 . 2]" 1
500 1 31 PRO QB 1 32 GLY H . . 3.630 3.321 2.740 3.658 0.028 13 0 "[ . 1 . 2]" 1
501 1 31 PRO QB 1 92 THR MG . . 4.160 3.288 2.390 4.191 0.031 17 0 "[ . 1 . 2]" 1
502 1 31 PRO HB2 1 32 GLY H . . 3.940 3.557 2.831 3.926 . 0 0 "[ . 1 . 2]" 1
503 1 31 PRO HB2 1 92 THR MG . . 4.240 3.359 2.413 4.337 0.097 17 0 "[ . 1 . 2]" 1
504 1 31 PRO HB3 1 32 GLY H . . 4.240 4.014 3.116 4.405 0.165 2 0 "[ . 1 . 2]" 1
505 1 31 PRO QG 1 92 THR MG . . 4.230 3.156 2.144 4.223 . 0 0 "[ . 1 . 2]" 1
506 1 31 PRO HG2 1 92 THR MG . . 4.320 3.227 2.166 4.387 0.067 2 0 "[ . 1 . 2]" 1
507 1 32 GLY H 1 33 PHE H . . 3.270 2.443 2.004 2.837 . 0 0 "[ . 1 . 2]" 1
508 1 32 GLY H 1 33 PHE QD . . 5.140 4.888 4.129 5.185 0.045 1 0 "[ . 1 . 2]" 1
509 1 32 GLY H 1 92 THR MG . . 4.740 4.240 3.172 4.834 0.094 9 0 "[ . 1 . 2]" 1
510 1 32 GLY QA 1 33 PHE QB . . 5.000 4.438 4.344 4.534 . 0 0 "[ . 1 . 2]" 1
511 1 32 GLY QA 1 93 LYS QG . . 4.040 2.679 1.919 3.184 . 0 0 "[ . 1 . 2]" 1
512 1 32 GLY HA2 1 92 THR MG . . 4.050 3.342 2.603 4.116 0.066 8 0 "[ . 1 . 2]" 1
513 1 32 GLY HA2 1 93 LYS HG3 . . 4.510 3.971 3.227 4.430 . 0 0 "[ . 1 . 2]" 1
514 1 32 GLY HA3 1 33 PHE HB2 . . 5.290 4.946 4.812 5.106 . 0 0 "[ . 1 . 2]" 1
515 1 32 GLY HA3 1 92 THR MG . . 4.060 2.955 2.459 3.411 . 0 0 "[ . 1 . 2]" 1
516 1 32 GLY HA3 1 93 LYS HG3 . . 4.810 3.453 2.634 3.910 . 0 0 "[ . 1 . 2]" 1
517 1 33 PHE H 1 33 PHE HB2 . . 3.260 2.478 2.310 2.690 . 0 0 "[ . 1 . 2]" 1
518 1 33 PHE H 1 33 PHE QB . . 3.160 2.441 2.283 2.638 . 0 0 "[ . 1 . 2]" 1
519 1 33 PHE H 1 33 PHE QD . . 3.270 2.989 2.634 3.312 0.042 16 0 "[ . 1 . 2]" 1
520 1 33 PHE H 1 34 THR H . . 4.590 4.434 4.324 4.571 . 0 0 "[ . 1 . 2]" 1
521 1 33 PHE H 1 38 LEU QD . . 4.900 4.456 3.983 4.918 0.018 11 0 "[ . 1 . 2]" 1
522 1 33 PHE H 1 92 THR MG . . 5.320 5.111 4.682 5.352 0.032 11 0 "[ . 1 . 2]" 1
523 1 33 PHE HA 1 33 PHE QD . . 3.420 2.733 2.470 2.883 . 0 0 "[ . 1 . 2]" 1
524 1 33 PHE HA 1 34 THR H . . 3.110 2.503 2.100 2.756 . 0 0 "[ . 1 . 2]" 1
525 1 33 PHE HA 1 34 THR MG . . 4.480 3.699 3.256 4.007 . 0 0 "[ . 1 . 2]" 1
526 1 33 PHE HA 1 38 LEU QD . . 4.790 4.609 4.194 4.904 0.114 9 0 "[ . 1 . 2]" 1
527 1 33 PHE HA 1 93 LYS QE . . 4.330 3.142 2.119 4.390 0.060 9 0 "[ . 1 . 2]" 1
528 1 33 PHE QB 1 34 THR H . . 4.100 2.207 1.767 3.139 . 0 0 "[ . 1 . 2]" 1
529 1 33 PHE QB 1 38 LEU QD . . 3.340 2.379 2.067 2.650 . 0 0 "[ . 1 . 2]" 1
530 1 33 PHE HB2 1 34 THR H . . 4.530 3.487 3.035 4.273 . 0 0 "[ . 1 . 2]" 1
531 1 33 PHE HB2 1 38 LEU QD . . 3.460 2.656 2.171 3.051 . 0 0 "[ . 1 . 2]" 1
532 1 33 PHE HB3 1 34 THR H . . 4.690 2.237 1.778 3.229 . 0 0 "[ . 1 . 2]" 1
533 1 33 PHE HB3 1 38 LEU QD . . 4.770 2.722 2.289 3.004 . 0 0 "[ . 1 . 2]" 1
534 1 33 PHE QD 1 34 THR H . . 3.800 3.468 3.103 3.821 0.021 19 0 "[ . 1 . 2]" 1
535 1 33 PHE QD 1 37 GLN HB2 . . 3.470 2.943 2.700 3.278 . 0 0 "[ . 1 . 2]" 1
536 1 33 PHE QD 1 37 GLN QB . . 3.200 2.234 1.945 2.582 . 0 0 "[ . 1 . 2]" 1
537 1 33 PHE QD 1 37 GLN HB3 . . 3.740 2.331 1.990 2.736 . 0 0 "[ . 1 . 2]" 1
538 1 33 PHE QD 1 38 LEU QD . . 3.940 3.522 2.888 3.866 . 0 0 "[ . 1 . 2]" 1
539 1 33 PHE QD 1 41 MET ME . . 3.830 3.370 2.735 3.815 . 0 0 "[ . 1 . 2]" 1
540 1 33 PHE QD 1 81 ALA HA . . 3.710 3.768 3.710 3.828 0.118 5 0 "[ . 1 . 2]" 1
541 1 33 PHE QE 1 41 MET ME . . 3.030 2.657 2.232 2.989 . 0 0 "[ . 1 . 2]" 1
542 1 33 PHE QE 1 80 ILE MG . . 3.250 3.243 3.213 3.277 0.027 10 0 "[ . 1 . 2]" 1
543 1 33 PHE QE 1 81 ALA HA . . 3.270 2.305 1.896 2.711 . 0 0 "[ . 1 . 2]" 1
544 1 33 PHE QE 1 81 ALA MB . . 4.000 2.446 2.084 2.749 . 0 0 "[ . 1 . 2]" 1
545 1 33 PHE QE 1 93 LYS HA . . 3.520 2.930 2.482 3.295 . 0 0 "[ . 1 . 2]" 1
546 1 33 PHE QE 1 93 LYS HB2 . . 4.780 4.288 3.970 4.526 . 0 0 "[ . 1 . 2]" 1
547 1 33 PHE QE 1 93 LYS QB . . 4.670 2.936 2.710 3.169 . 0 0 "[ . 1 . 2]" 1
548 1 33 PHE QE 1 93 LYS HD2 . . 4.940 4.037 2.731 4.854 . 0 0 "[ . 1 . 2]" 1
549 1 33 PHE QE 1 93 LYS QD . . 4.330 2.858 2.279 4.372 0.042 17 0 "[ . 1 . 2]" 1
550 1 33 PHE QE 1 93 LYS HD3 . . 4.780 3.299 2.293 4.966 0.186 17 0 "[ . 1 . 2]" 1
551 1 33 PHE QE 1 93 LYS QE . . 3.430 3.113 2.506 3.473 0.043 7 0 "[ . 1 . 2]" 1
552 1 33 PHE QE 1 96 SER H . . 4.600 4.383 4.032 4.645 0.045 12 0 "[ . 1 . 2]" 1
553 1 33 PHE QE 1 96 SER QB . . 4.870 2.456 1.881 3.899 . 0 0 "[ . 1 . 2]" 1
554 1 33 PHE QE 1 97 ILE H . . 4.570 3.340 2.917 3.653 . 0 0 "[ . 1 . 2]" 1
555 1 33 PHE QE 1 97 ILE MD . . 3.650 3.264 3.044 3.580 . 0 0 "[ . 1 . 2]" 1
556 1 33 PHE QE 1 97 ILE QG . . 3.690 2.435 2.094 2.901 . 0 0 "[ . 1 . 2]" 1
557 1 33 PHE QE 1 97 ILE HG13 . . 3.750 2.542 2.177 3.029 . 0 0 "[ . 1 . 2]" 1
558 1 33 PHE HZ 1 97 ILE MD . . 3.800 2.190 2.005 2.645 . 0 0 "[ . 1 . 2]" 1
559 1 33 PHE HZ 1 97 ILE HG12 . . 3.810 3.275 2.740 3.659 . 0 0 "[ . 1 . 2]" 1
560 1 33 PHE HZ 1 97 ILE QG . . 3.690 2.651 2.276 3.023 . 0 0 "[ . 1 . 2]" 1
561 1 33 PHE HZ 1 97 ILE HG13 . . 4.920 2.808 2.422 3.261 . 0 0 "[ . 1 . 2]" 1
562 1 34 THR H 1 34 THR MG . . 2.720 2.278 1.863 2.568 . 0 0 "[ . 1 . 2]" 1
563 1 34 THR H 1 37 GLN H . . 4.080 3.459 3.232 3.945 . 0 0 "[ . 1 . 2]" 1
564 1 34 THR H 1 37 GLN HB2 . . 4.160 2.275 1.946 2.809 . 0 0 "[ . 1 . 2]" 1
565 1 34 THR H 1 37 GLN QB . . 3.800 2.250 1.928 2.761 . 0 0 "[ . 1 . 2]" 1
566 1 34 THR H 1 37 GLN HB3 . . 4.380 3.587 3.029 4.080 . 0 0 "[ . 1 . 2]" 1
567 1 34 THR H 1 38 LEU H . . 4.610 3.889 3.398 4.570 . 0 0 "[ . 1 . 2]" 1
568 1 34 THR H 1 38 LEU QD . . 5.000 3.811 2.730 5.031 0.031 14 0 "[ . 1 . 2]" 1
569 1 34 THR HA 1 34 THR MG . . 3.350 3.215 3.201 3.232 . 0 0 "[ . 1 . 2]" 1
570 1 34 THR HA 1 35 ALA H . . 3.120 2.497 2.387 2.575 . 0 0 "[ . 1 . 2]" 1
571 1 34 THR HA 1 35 ALA MB . . 4.170 4.201 4.115 4.236 0.066 16 0 "[ . 1 . 2]" 1
572 1 34 THR HA 1 36 SER H . . 4.450 4.480 4.241 4.629 0.179 4 0 "[ . 1 . 2]" 1
573 1 34 THR MG 1 35 ALA H . . 3.970 3.253 2.936 3.754 . 0 0 "[ . 1 . 2]" 1
574 1 34 THR MG 1 36 SER H . . 4.710 2.307 1.908 3.022 . 0 0 "[ . 1 . 2]" 1
575 1 34 THR MG 1 36 SER QB . . 2.780 2.343 2.030 2.747 . 0 0 "[ . 1 . 2]" 1
576 1 34 THR MG 1 37 GLN H . . 4.920 1.915 1.786 2.108 . 0 0 "[ . 1 . 2]" 1
577 1 34 THR MG 1 37 GLN HA . . 4.050 4.055 3.965 4.133 0.083 6 0 "[ . 1 . 2]" 1
578 1 34 THR MG 1 37 GLN HE21 . . 5.500 2.913 2.100 4.808 . 0 0 "[ . 1 . 2]" 1
579 1 34 THR MG 1 37 GLN QE . . 5.340 2.679 1.981 4.116 . 0 0 "[ . 1 . 2]" 1
580 1 34 THR MG 1 85 GLU QB . . 4.680 3.953 1.923 4.842 0.162 14 0 "[ . 1 . 2]" 1
581 1 34 THR MG 1 86 GLY H . . 5.250 3.725 2.277 4.870 . 0 0 "[ . 1 . 2]" 1
582 1 34 THR MG 1 86 GLY HA2 . . 4.350 3.520 2.059 4.384 0.034 8 0 "[ . 1 . 2]" 1
583 1 34 THR MG 1 86 GLY HA3 . . 4.330 2.650 1.886 3.638 . 0 0 "[ . 1 . 2]" 1
584 1 34 THR MG 1 87 GLY H . . 4.780 4.601 3.351 4.872 0.092 11 0 "[ . 1 . 2]" 1
585 1 35 ALA H 1 35 ALA MB . . 3.030 2.225 2.211 2.233 . 0 0 "[ . 1 . 2]" 1
586 1 35 ALA H 1 36 SER H . . 3.490 2.760 2.662 2.859 . 0 0 "[ . 1 . 2]" 1
587 1 35 ALA H 1 37 GLN H . . 4.900 4.321 4.161 4.752 . 0 0 "[ . 1 . 2]" 1
588 1 35 ALA H 1 38 LEU QD . . 5.220 4.040 3.676 4.784 . 0 0 "[ . 1 . 2]" 1
589 1 35 ALA HA 1 38 LEU H . . 4.110 3.365 3.081 3.670 . 0 0 "[ . 1 . 2]" 1
590 1 35 ALA HA 1 38 LEU HB2 . . 4.410 2.527 2.303 2.832 . 0 0 "[ . 1 . 2]" 1
591 1 35 ALA HA 1 38 LEU HB3 . . 4.420 3.836 2.446 4.422 0.002 4 0 "[ . 1 . 2]" 1
592 1 35 ALA HA 1 38 LEU QD . . 3.510 2.442 1.960 3.104 . 0 0 "[ . 1 . 2]" 1
593 1 35 ALA MB 1 36 SER H . . 3.360 2.614 2.517 2.766 . 0 0 "[ . 1 . 2]" 1
594 1 35 ALA MB 1 38 LEU QD . . 5.440 3.499 2.918 3.897 . 0 0 "[ . 1 . 2]" 1
595 1 36 SER H 1 36 SER QB . . 2.940 2.422 2.231 2.641 . 0 0 "[ . 1 . 2]" 1
596 1 36 SER H 1 37 GLN H . . 3.480 2.685 2.587 2.844 . 0 0 "[ . 1 . 2]" 1
597 1 36 SER HA 1 39 ASP H . . 3.560 3.556 3.380 3.672 0.112 6 0 "[ . 1 . 2]" 1
598 1 36 SER HA 1 39 ASP HB2 . . 3.550 3.426 3.096 3.565 0.015 18 0 "[ . 1 . 2]" 1
599 1 36 SER HA 1 39 ASP HB3 . . 3.460 3.104 2.645 3.409 . 0 0 "[ . 1 . 2]" 1
600 1 36 SER QB 1 37 GLN H . . 3.640 2.545 2.161 2.785 . 0 0 "[ . 1 . 2]" 1
601 1 36 SER QB 1 37 GLN HE21 . . 4.740 4.476 3.393 5.463 0.723 14 3 "[ . - +. *2]" 1
602 1 36 SER QB 1 37 GLN QE . . 4.510 3.889 2.999 4.549 0.039 9 0 "[ . 1 . 2]" 1
603 1 37 GLN H 1 37 GLN HB2 . . 3.920 2.299 2.085 2.553 . 0 0 "[ . 1 . 2]" 1
604 1 37 GLN H 1 37 GLN QB . . 3.600 2.269 2.066 2.503 . 0 0 "[ . 1 . 2]" 1
605 1 37 GLN H 1 37 GLN HG2 . . 4.910 3.644 2.095 4.471 . 0 0 "[ . 1 . 2]" 1
606 1 37 GLN H 1 37 GLN QG . . 4.790 2.985 2.079 3.761 . 0 0 "[ . 1 . 2]" 1
607 1 37 GLN H 1 38 LEU H . . 3.260 2.535 2.368 2.684 . 0 0 "[ . 1 . 2]" 1
608 1 37 GLN H 1 80 ILE MG . . 5.280 4.668 4.478 4.808 . 0 0 "[ . 1 . 2]" 1
609 1 37 GLN HA 1 37 GLN QG . . 3.500 2.475 2.106 3.114 . 0 0 "[ . 1 . 2]" 1
610 1 37 GLN HA 1 37 GLN HG3 . . 3.720 2.817 2.153 3.814 0.094 9 0 "[ . 1 . 2]" 1
611 1 37 GLN HA 1 40 ASP H . . 4.090 3.607 3.263 3.911 . 0 0 "[ . 1 . 2]" 1
612 1 37 GLN HA 1 40 ASP HB2 . . 3.520 3.201 2.465 3.936 0.416 7 0 "[ . 1 . 2]" 1
613 1 37 GLN HA 1 40 ASP QB . . 3.410 3.036 2.444 3.438 0.028 8 0 "[ . 1 . 2]" 1
614 1 37 GLN HA 1 40 ASP HB3 . . 4.590 4.215 3.169 5.132 0.542 8 1 "[ . + 1 . 2]" 1
615 1 37 GLN HA 1 80 ILE HB . . 5.360 5.414 5.256 5.521 0.161 20 0 "[ . 1 . 2]" 1
616 1 37 GLN HA 1 80 ILE MG . . 4.000 2.557 2.370 2.714 . 0 0 "[ . 1 . 2]" 1
617 1 37 GLN QB 1 80 ILE MG . . 4.470 2.452 1.940 3.034 . 0 0 "[ . 1 . 2]" 1
618 1 37 GLN HB2 1 38 LEU H . . 4.260 2.835 2.443 3.122 . 0 0 "[ . 1 . 2]" 1
619 1 37 GLN HB2 1 80 ILE MG . . 4.920 3.765 3.339 4.150 . 0 0 "[ . 1 . 2]" 1
620 1 37 GLN HB3 1 38 LEU H . . 4.260 3.487 3.093 3.874 . 0 0 "[ . 1 . 2]" 1
621 1 37 GLN HB3 1 80 ILE MG . . 5.140 2.489 1.953 3.125 . 0 0 "[ . 1 . 2]" 1
622 1 37 GLN QE 1 80 ILE MG . . 4.740 3.815 2.088 4.737 . 0 0 "[ . 1 . 2]" 1
623 1 37 GLN QE 1 93 LYS QE . . 4.250 3.774 2.798 4.291 0.041 5 0 "[ . 1 . 2]" 1
624 1 37 GLN HE21 1 80 ILE MG . . 5.260 4.137 2.162 5.255 . 0 0 "[ . 1 . 2]" 1
625 1 37 GLN HE21 1 93 LYS QE . . 4.800 4.415 3.123 5.307 0.507 11 1 "[ . 1+ . 2]" 1
626 1 37 GLN HE22 1 37 GLN HG3 . . 3.890 3.726 3.459 4.042 0.152 13 0 "[ . 1 . 2]" 1
627 1 37 GLN HE22 1 80 ILE MG . . 5.380 4.580 2.406 5.434 0.054 18 0 "[ . 1 . 2]" 1
628 1 37 GLN QG 1 80 ILE MG . . 3.340 2.370 1.817 3.483 0.143 1 0 "[ . 1 . 2]" 1
629 1 37 GLN HG2 1 80 ILE MG . . 3.420 3.043 2.011 4.126 0.706 19 2 "[ . -1 . +2]" 1
630 1 37 GLN HG3 1 80 ILE MG . . 4.690 2.887 1.827 4.173 . 0 0 "[ . 1 . 2]" 1
631 1 38 LEU H 1 38 LEU HB2 . . 3.420 2.371 2.059 2.553 . 0 0 "[ . 1 . 2]" 1
632 1 38 LEU H 1 38 LEU QB . . 3.130 2.330 2.039 2.501 . 0 0 "[ . 1 . 2]" 1
633 1 38 LEU H 1 38 LEU HB3 . . 3.630 3.453 2.811 3.604 . 0 0 "[ . 1 . 2]" 1
634 1 38 LEU H 1 38 LEU QD . . 3.320 2.923 2.249 3.422 0.102 18 0 "[ . 1 . 2]" 1
635 1 38 LEU H 1 39 ASP H . . 3.260 2.629 2.519 2.772 . 0 0 "[ . 1 . 2]" 1
636 1 38 LEU HA 1 38 LEU QD . . 2.910 2.130 1.981 2.575 . 0 0 "[ . 1 . 2]" 1
637 1 38 LEU HA 1 41 MET H . . 4.100 3.552 3.339 3.773 . 0 0 "[ . 1 . 2]" 1
638 1 38 LEU HA 1 41 MET HB2 . . 3.720 3.232 2.406 3.710 . 0 0 "[ . 1 . 2]" 1
639 1 38 LEU HA 1 41 MET QB . . 3.440 2.539 2.252 2.790 . 0 0 "[ . 1 . 2]" 1
640 1 38 LEU HA 1 41 MET HB3 . . 4.040 2.910 2.328 4.079 0.039 9 0 "[ . 1 . 2]" 1
641 1 38 LEU HA 1 42 SER H . . 4.810 3.943 3.611 4.184 . 0 0 "[ . 1 . 2]" 1
642 1 38 LEU QB 1 38 LEU QD . . 2.620 1.937 1.881 1.962 . 0 0 "[ . 1 . 2]" 1
643 1 38 LEU QB 1 39 ASP H . . 3.420 2.576 2.293 2.827 . 0 0 "[ . 1 . 2]" 1
644 1 38 LEU HB2 1 39 ASP H . . 3.680 2.809 2.491 3.527 . 0 0 "[ . 1 . 2]" 1
645 1 38 LEU HB3 1 38 LEU QD . . 2.980 2.161 2.106 2.343 . 0 0 "[ . 1 . 2]" 1
646 1 38 LEU HB3 1 39 ASP H . . 4.070 3.402 2.329 3.783 . 0 0 "[ . 1 . 2]" 1
647 1 38 LEU QD 1 39 ASP H . . 5.010 4.027 3.874 4.114 . 0 0 "[ . 1 . 2]" 1
648 1 38 LEU QD 1 41 MET H . . 5.020 4.924 4.689 5.047 0.027 19 0 "[ . 1 . 2]" 1
649 1 38 LEU QD 1 41 MET QB . . 4.850 3.586 3.336 3.989 . 0 0 "[ . 1 . 2]" 1
650 1 38 LEU QD 1 41 MET HB3 . . 5.030 3.969 3.504 4.719 . 0 0 "[ . 1 . 2]" 1
651 1 38 LEU QD 1 42 SER H . . 5.350 5.008 4.609 5.276 . 0 0 "[ . 1 . 2]" 1
652 1 39 ASP H 1 39 ASP HB2 . . 3.080 2.451 2.376 2.536 . 0 0 "[ . 1 . 2]" 1
653 1 39 ASP H 1 39 ASP HB3 . . 3.040 2.594 2.507 2.701 . 0 0 "[ . 1 . 2]" 1
654 1 39 ASP HA 1 39 ASP HB2 . . 2.890 2.486 2.445 2.546 . 0 0 "[ . 1 . 2]" 1
655 1 39 ASP HA 1 39 ASP HB3 . . 2.940 3.009 3.004 3.012 0.072 3 0 "[ . 1 . 2]" 1
656 1 39 ASP HA 1 42 SER H . . 3.920 3.665 3.421 3.893 . 0 0 "[ . 1 . 2]" 1
657 1 39 ASP HA 1 42 SER QB . . 3.300 2.967 2.499 3.307 0.007 17 0 "[ . 1 . 2]" 1
658 1 40 ASP H 1 40 ASP HB2 . . 3.020 2.269 2.136 2.417 . 0 0 "[ . 1 . 2]" 1
659 1 40 ASP H 1 40 ASP QB . . 2.820 2.214 2.116 2.337 . 0 0 "[ . 1 . 2]" 1
660 1 40 ASP H 1 40 ASP HB3 . . 3.370 3.258 2.714 3.558 0.188 3 0 "[ . 1 . 2]" 1
661 1 40 ASP H 1 41 MET H . . 3.430 2.629 2.552 2.704 . 0 0 "[ . 1 . 2]" 1
662 1 40 ASP H 1 41 MET HB2 . . 4.380 4.754 4.420 4.956 0.576 18 3 "[- *. 1 . + 2]" 1
663 1 40 ASP H 1 41 MET QB . . 4.290 4.333 4.220 4.385 0.095 4 0 "[ . 1 . 2]" 1
664 1 40 ASP H 1 80 ILE MG . . 4.870 4.319 3.822 4.657 . 0 0 "[ . 1 . 2]" 1
665 1 40 ASP HA 1 43 THR MG . . 4.500 4.169 3.862 4.459 . 0 0 "[ . 1 . 2]" 1
666 1 40 ASP HA 1 44 ILE MD . . 4.640 4.578 4.369 4.643 0.003 20 0 "[ . 1 . 2]" 1
667 1 40 ASP HA 1 80 ILE MD . . 4.650 4.237 3.854 4.500 . 0 0 "[ . 1 . 2]" 1
668 1 40 ASP QB 1 41 MET H . . 3.550 2.519 2.331 2.738 . 0 0 "[ . 1 . 2]" 1
669 1 40 ASP QB 1 80 ILE MD . . 3.030 2.349 1.987 2.776 . 0 0 "[ . 1 . 2]" 1
670 1 40 ASP QB 1 80 ILE QG . . 4.300 2.832 2.136 3.211 . 0 0 "[ . 1 . 2]" 1
671 1 40 ASP QB 1 80 ILE MG . . 4.000 2.759 2.065 3.077 . 0 0 "[ . 1 . 2]" 1
672 1 40 ASP HB2 1 41 MET H . . 3.790 3.002 2.531 3.677 . 0 0 "[ . 1 . 2]" 1
673 1 40 ASP HB2 1 80 ILE MD . . 3.490 3.319 2.724 3.643 0.153 14 0 "[ . 1 . 2]" 1
674 1 40 ASP HB2 1 80 ILE MG . . 4.190 3.227 2.147 4.164 . 0 0 "[ . 1 . 2]" 1
675 1 40 ASP HB3 1 41 MET H . . 4.290 2.993 2.369 3.428 . 0 0 "[ . 1 . 2]" 1
676 1 40 ASP HB3 1 80 ILE MD . . 3.320 2.442 1.997 2.948 . 0 0 "[ . 1 . 2]" 1
677 1 40 ASP HB3 1 80 ILE HG12 . . 4.500 2.984 2.185 3.412 . 0 0 "[ . 1 . 2]" 1
678 1 40 ASP HB3 1 80 ILE MG . . 5.050 3.194 2.401 3.914 . 0 0 "[ . 1 . 2]" 1
679 1 41 MET H 1 41 MET HB2 . . 3.940 2.381 2.266 2.518 . 0 0 "[ . 1 . 2]" 1
680 1 41 MET H 1 41 MET HB3 . . 3.980 2.795 2.530 3.591 . 0 0 "[ . 1 . 2]" 1
681 1 41 MET H 1 41 MET ME . . 4.000 3.996 3.861 4.194 0.194 5 0 "[ . 1 . 2]" 1
682 1 41 MET H 1 41 MET QG . . 3.780 3.642 2.120 3.992 0.212 15 0 "[ . 1 . 2]" 1
683 1 41 MET H 1 41 MET HG3 . . 3.840 4.132 2.227 4.427 0.587 15 7 "[ ** . - 1 *+ **2]" 1
684 1 41 MET H 1 42 SER H . . 3.530 2.759 2.618 3.032 . 0 0 "[ . 1 . 2]" 1
685 1 41 MET H 1 80 ILE MD . . 3.880 2.706 2.417 2.914 . 0 0 "[ . 1 . 2]" 1
686 1 41 MET H 1 80 ILE MG . . 5.080 3.258 2.898 3.605 . 0 0 "[ . 1 . 2]" 1
687 1 41 MET HA 1 41 MET HB2 . . 3.000 2.604 2.476 3.019 0.019 16 0 "[ . 1 . 2]" 1
688 1 41 MET HA 1 41 MET HG2 . . 4.110 3.113 2.443 3.762 . 0 0 "[ . 1 . 2]" 1
689 1 41 MET HA 1 41 MET QG . . 3.720 2.423 2.312 2.860 . 0 0 "[ . 1 . 2]" 1
690 1 41 MET HA 1 44 ILE HB . . 3.800 2.935 2.707 3.206 . 0 0 "[ . 1 . 2]" 1
691 1 41 MET HA 1 44 ILE QG . . 4.150 3.065 2.473 3.579 . 0 0 "[ . 1 . 2]" 1
692 1 41 MET HA 1 44 ILE HG13 . . 4.230 3.705 3.061 4.257 0.027 5 0 "[ . 1 . 2]" 1
693 1 41 MET HA 1 80 ILE MD . . 3.270 2.172 1.898 2.645 . 0 0 "[ . 1 . 2]" 1
694 1 41 MET HA 1 80 ILE MG . . 4.340 3.924 3.413 4.444 0.104 20 0 "[ . 1 . 2]" 1
695 1 41 MET QB 1 41 MET QG . . 2.260 2.061 1.994 2.081 . 0 0 "[ . 1 . 2]" 1
696 1 41 MET QB 1 42 SER H . . 3.310 2.505 2.304 2.628 . 0 0 "[ . 1 . 2]" 1
697 1 41 MET HB2 1 41 MET HG3 . . 2.560 2.521 2.358 3.005 0.445 5 0 "[ . 1 . 2]" 1
698 1 41 MET HB2 1 42 SER H . . 3.660 3.526 2.350 3.836 0.176 4 0 "[ . 1 . 2]" 1
699 1 41 MET HB3 1 42 SER H . . 3.780 2.708 2.482 3.359 . 0 0 "[ . 1 . 2]" 1
700 1 41 MET ME 1 41 MET QG . . 3.300 2.377 2.139 2.450 . 0 0 "[ . 1 . 2]" 1
701 1 41 MET ME 1 41 MET HG3 . . 3.380 2.524 2.349 3.390 0.010 15 0 "[ . 1 . 2]" 1
702 1 41 MET ME 1 80 ILE HB . . 2.690 2.651 2.186 2.827 0.137 14 0 "[ . 1 . 2]" 1
703 1 41 MET ME 1 80 ILE MD . . 3.150 2.667 2.309 2.941 . 0 0 "[ . 1 . 2]" 1
704 1 41 MET ME 1 80 ILE MG . . 2.850 2.343 1.953 2.554 . 0 0 "[ . 1 . 2]" 1
705 1 41 MET ME 1 81 ALA H . . 3.860 3.830 3.067 4.026 0.166 19 0 "[ . 1 . 2]" 1
706 1 41 MET QG 1 42 SER H . . 4.900 3.837 3.644 4.385 . 0 0 "[ . 1 . 2]" 1
707 1 41 MET QG 1 80 ILE MD . . 3.720 2.715 2.029 3.695 . 0 0 "[ . 1 . 2]" 1
708 1 41 MET QG 1 80 ILE MG . . 4.100 3.795 2.267 4.148 0.048 7 0 "[ . 1 . 2]" 1
709 1 41 MET HG2 1 80 ILE MD . . 4.330 3.803 2.305 4.332 0.002 5 0 "[ . 1 . 2]" 1
710 1 41 MET HG3 1 42 SER H . . 5.030 4.712 3.919 4.911 . 0 0 "[ . 1 . 2]" 1
711 1 41 MET HG3 1 80 ILE MD . . 4.060 2.911 2.252 4.011 . 0 0 "[ . 1 . 2]" 1
712 1 41 MET HG3 1 80 ILE MG . . 4.180 4.120 2.310 4.909 0.729 15 1 "[ . 1 + 2]" 1
713 1 42 SER H 1 42 SER QB . . 2.830 2.288 2.227 2.563 . 0 0 "[ . 1 . 2]" 1
714 1 42 SER H 1 43 THR H . . 3.340 2.656 2.582 2.732 . 0 0 "[ . 1 . 2]" 1
715 1 42 SER H 1 43 THR HB . . 4.930 4.923 4.856 4.971 0.041 9 0 "[ . 1 . 2]" 1
716 1 42 SER H 1 80 ILE MD . . 5.100 4.590 4.410 4.974 . 0 0 "[ . 1 . 2]" 1
717 1 42 SER HA 1 42 SER QB . . 2.610 2.379 2.330 2.425 . 0 0 "[ . 1 . 2]" 1
718 1 42 SER HA 1 43 THR H . . 3.540 3.522 3.502 3.538 . 0 0 "[ . 1 . 2]" 1
719 1 42 SER HA 1 45 ALA H . . 4.360 3.511 3.342 3.751 . 0 0 "[ . 1 . 2]" 1
720 1 42 SER HA 1 45 ALA MB . . 3.320 2.493 2.360 2.812 . 0 0 "[ . 1 . 2]" 1
721 1 42 SER QB 1 43 THR H . . 3.110 2.565 2.433 2.686 . 0 0 "[ . 1 . 2]" 1
722 1 43 THR H 1 43 THR HB . . 2.930 2.561 2.494 2.635 . 0 0 "[ . 1 . 2]" 1
723 1 43 THR H 1 43 THR MG . . 3.880 3.756 3.741 3.768 . 0 0 "[ . 1 . 2]" 1
724 1 43 THR H 1 45 ALA H . . 4.530 4.007 3.925 4.104 . 0 0 "[ . 1 . 2]" 1
725 1 43 THR HA 1 43 THR MG . . 2.680 2.368 2.330 2.422 . 0 0 "[ . 1 . 2]" 1
726 1 43 THR HA 1 45 ALA H . . 4.680 4.397 4.195 4.477 . 0 0 "[ . 1 . 2]" 1
727 1 43 THR HA 1 46 GLN H . . 4.220 3.368 3.151 3.696 . 0 0 "[ . 1 . 2]" 1
728 1 43 THR HA 1 46 GLN QB . . 3.570 3.011 2.801 3.387 . 0 0 "[ . 1 . 2]" 1
729 1 43 THR HA 1 46 GLN HE21 . . 4.340 4.380 4.142 5.248 0.908 15 1 "[ . 1 + 2]" 1
730 1 43 THR HA 1 46 GLN QE . . 4.250 4.219 4.034 4.254 0.004 17 0 "[ . 1 . 2]" 1
731 1 43 THR HB 1 44 ILE H . . 3.580 2.587 2.505 2.759 . 0 0 "[ . 1 . 2]" 1
732 1 43 THR MG 1 44 ILE H . . 3.770 3.523 3.435 3.652 . 0 0 "[ . 1 . 2]" 1
733 1 43 THR MG 1 45 ALA H . . 5.070 5.073 4.952 5.126 0.056 4 0 "[ . 1 . 2]" 1
734 1 43 THR MG 1 46 GLN QB . . 3.520 3.499 3.104 3.603 0.083 15 0 "[ . 1 . 2]" 1
735 1 43 THR MG 1 47 SER H . . 4.960 4.416 4.151 4.829 . 0 0 "[ . 1 . 2]" 1
736 1 44 ILE H 1 44 ILE HB . . 3.420 2.591 2.535 2.639 . 0 0 "[ . 1 . 2]" 1
737 1 44 ILE H 1 44 ILE MD . . 3.750 3.045 2.968 3.127 . 0 0 "[ . 1 . 2]" 1
738 1 44 ILE H 1 44 ILE HG12 . . 3.630 2.125 2.061 2.195 . 0 0 "[ . 1 . 2]" 1
739 1 44 ILE H 1 44 ILE QG . . 3.330 2.111 2.049 2.179 . 0 0 "[ . 1 . 2]" 1
740 1 44 ILE H 1 44 ILE HG13 . . 3.870 3.640 3.590 3.683 . 0 0 "[ . 1 . 2]" 1
741 1 44 ILE H 1 44 ILE MG . . 3.920 3.778 3.772 3.783 . 0 0 "[ . 1 . 2]" 1
742 1 44 ILE H 1 45 ALA H . . 3.410 2.582 2.538 2.617 . 0 0 "[ . 1 . 2]" 1
743 1 44 ILE H 1 45 ALA MB . . 4.240 4.214 4.169 4.236 . 0 0 "[ . 1 . 2]" 1
744 1 44 ILE HA 1 44 ILE MD . . 3.220 2.025 1.982 2.074 . 0 0 "[ . 1 . 2]" 1
745 1 44 ILE HA 1 44 ILE HG12 . . 3.750 3.166 3.118 3.211 . 0 0 "[ . 1 . 2]" 1
746 1 44 ILE HA 1 44 ILE HG13 . . 3.830 3.728 3.700 3.756 . 0 0 "[ . 1 . 2]" 1
747 1 44 ILE HA 1 47 SER H . . 3.730 3.168 2.990 3.404 . 0 0 "[ . 1 . 2]" 1
748 1 44 ILE HB 1 44 ILE MD . . 3.240 3.231 3.228 3.236 . 0 0 "[ . 1 . 2]" 1
749 1 44 ILE HB 1 45 ALA H . . 3.520 2.606 2.514 2.753 . 0 0 "[ . 1 . 2]" 1
750 1 44 ILE MD 1 44 ILE MG . . 2.780 1.996 1.966 2.033 . 0 0 "[ . 1 . 2]" 1
751 1 44 ILE MD 1 45 ALA H . . 4.510 4.541 4.522 4.562 0.052 14 0 "[ . 1 . 2]" 1
752 1 44 ILE QG 1 45 ALA H . . 4.060 3.916 3.858 3.984 . 0 0 "[ . 1 . 2]" 1
753 1 44 ILE HG12 1 45 ALA H . . 4.330 4.111 4.038 4.178 . 0 0 "[ . 1 . 2]" 1
754 1 44 ILE HG13 1 45 ALA H . . 4.920 4.924 4.864 5.026 0.106 15 0 "[ . 1 . 2]" 1
755 1 44 ILE MG 1 45 ALA H . . 3.740 3.509 3.412 3.595 . 0 0 "[ . 1 . 2]" 1
756 1 44 ILE MG 1 45 ALA HA . . 4.510 3.626 3.508 3.757 . 0 0 "[ . 1 . 2]" 1
757 1 44 ILE MG 1 47 SER H . . 4.130 4.198 4.145 4.237 0.107 17 0 "[ . 1 . 2]" 1
758 1 45 ALA H 1 45 ALA MB . . 2.910 2.229 2.219 2.246 . 0 0 "[ . 1 . 2]" 1
759 1 45 ALA H 1 46 GLN H . . 3.470 2.752 2.662 3.165 . 0 0 "[ . 1 . 2]" 1
760 1 45 ALA HA 1 49 VAL H . . 4.560 4.318 3.975 4.621 0.061 13 0 "[ . 1 . 2]" 1
761 1 45 ALA HA 1 73 PHE QE . . 4.690 4.205 3.534 4.691 0.001 16 0 "[ . 1 . 2]" 1
762 1 45 ALA MB 1 46 GLN H . . 3.110 2.581 2.074 2.739 . 0 0 "[ . 1 . 2]" 1
763 1 45 ALA MB 1 46 GLN QB . . 4.660 4.409 4.014 4.521 . 0 0 "[ . 1 . 2]" 1
764 1 45 ALA MB 1 49 VAL QG . . 3.520 3.369 2.889 3.526 0.006 17 0 "[ . 1 . 2]" 1
765 1 46 GLN H 1 46 GLN QB . . 2.830 2.497 2.407 2.551 . 0 0 "[ . 1 . 2]" 1
766 1 46 GLN H 1 46 GLN HE21 . . 4.440 2.570 2.422 2.852 . 0 0 "[ . 1 . 2]" 1
767 1 46 GLN H 1 46 GLN QE . . 4.340 2.537 2.366 2.822 . 0 0 "[ . 1 . 2]" 1
768 1 46 GLN H 1 46 GLN HG2 . . 2.870 2.394 2.131 3.840 0.970 15 1 "[ . 1 + 2]" 1
769 1 46 GLN H 1 46 GLN QG . . 2.780 2.336 2.116 3.071 0.291 15 0 "[ . 1 . 2]" 1
770 1 46 GLN H 1 46 GLN HG3 . . 3.720 3.753 3.230 3.894 0.174 13 0 "[ . 1 . 2]" 1
771 1 46 GLN HA 1 46 GLN QE . . 4.290 2.767 2.515 2.963 . 0 0 "[ . 1 . 2]" 1
772 1 46 GLN HA 1 46 GLN HE22 . . 4.380 3.358 3.238 4.431 0.051 15 0 "[ . 1 . 2]" 1
773 1 46 GLN HA 1 49 VAL H . . 3.400 3.355 3.200 3.491 0.091 16 0 "[ . 1 . 2]" 1
774 1 46 GLN HA 1 49 VAL HB . . 3.210 2.673 2.298 3.184 . 0 0 "[ . 1 . 2]" 1
775 1 46 GLN HA 1 49 VAL QG . . 3.890 2.859 2.459 3.511 . 0 0 "[ . 1 . 2]" 1
776 1 46 GLN QB 1 46 GLN HE21 . . 3.910 3.576 3.542 3.591 . 0 0 "[ . 1 . 2]" 1
777 1 46 GLN QB 1 46 GLN QE . . 3.760 3.401 3.353 3.418 . 0 0 "[ . 1 . 2]" 1
778 1 46 GLN QB 1 46 GLN HE22 . . 4.900 4.261 4.075 4.326 . 0 0 "[ . 1 . 2]" 1
779 1 46 GLN QB 1 46 GLN QG . . 2.370 1.967 1.940 2.009 . 0 0 "[ . 1 . 2]" 1
780 1 46 GLN QB 1 46 GLN HG3 . . 2.480 2.166 2.142 2.414 . 0 0 "[ . 1 . 2]" 1
781 1 46 GLN QE 1 49 VAL QG . . 4.880 3.260 3.013 3.554 . 0 0 "[ . 1 . 2]" 1
782 1 46 GLN HE21 1 49 VAL QG . . 5.060 3.949 3.595 4.144 . 0 0 "[ . 1 . 2]" 1
783 1 46 GLN HE22 1 46 GLN HG2 . . 3.620 3.489 3.453 4.017 0.397 15 0 "[ . 1 . 2]" 1
784 1 47 SER H 1 47 SER HB2 . . 2.760 2.564 2.295 3.627 0.867 12 1 "[ . 1 + . 2]" 1
785 1 47 SER H 1 47 SER QB . . 2.730 2.358 2.189 2.591 . 0 0 "[ . 1 . 2]" 1
786 1 48 MET H 1 48 MET HB2 . . 4.040 2.772 2.332 3.650 . 0 0 "[ . 1 . 2]" 1
787 1 48 MET H 1 48 MET QB . . 3.230 2.387 2.199 2.631 . 0 0 "[ . 1 . 2]" 1
788 1 48 MET H 1 48 MET HB3 . . 3.400 3.025 2.306 3.634 0.234 12 0 "[ . 1 . 2]" 1
789 1 48 MET H 1 48 MET QG . . 3.780 2.780 2.099 3.957 0.177 5 0 "[ . 1 . 2]" 1
790 1 48 MET H 1 49 VAL H . . 3.010 2.622 2.372 2.775 . 0 0 "[ . 1 . 2]" 1
791 1 48 MET HA 1 48 MET ME . . 3.790 3.460 2.964 3.942 0.152 16 0 "[ . 1 . 2]" 1
792 1 48 MET HA 1 48 MET QG . . 3.380 2.889 2.365 3.473 0.093 15 0 "[ . 1 . 2]" 1
793 1 48 MET HB2 1 49 VAL H . . 4.610 3.188 2.353 4.096 . 0 0 "[ . 1 . 2]" 1
794 1 48 MET ME 1 69 LEU HB2 . . 4.960 3.627 2.314 4.232 . 0 0 "[ . 1 . 2]" 1
795 1 48 MET ME 1 69 LEU QB . . 4.840 2.214 1.950 2.692 . 0 0 "[ . 1 . 2]" 1
796 1 48 MET ME 1 69 LEU QD . . 3.040 2.226 1.893 2.564 . 0 0 "[ . 1 . 2]" 1
797 1 48 MET ME 1 70 ASN H . . 5.150 5.038 4.471 5.273 0.123 13 0 "[ . 1 . 2]" 1
798 1 48 MET ME 1 73 PHE H . . 4.320 3.801 3.249 4.323 0.003 9 0 "[ . 1 . 2]" 1
799 1 48 MET ME 1 73 PHE HB2 . . 3.680 2.199 1.892 2.572 . 0 0 "[ . 1 . 2]" 1
800 1 48 MET ME 1 73 PHE QB . . 3.380 2.180 1.875 2.539 . 0 0 "[ . 1 . 2]" 1
801 1 48 MET ME 1 73 PHE HB3 . . 3.930 3.589 3.091 3.909 . 0 0 "[ . 1 . 2]" 1
802 1 48 MET ME 1 73 PHE QD . . 4.010 2.939 2.289 3.596 . 0 0 "[ . 1 . 2]" 1
803 1 48 MET QG 1 49 VAL H . . 4.080 3.412 2.244 4.120 0.040 1 0 "[ . 1 . 2]" 1
804 1 49 VAL H 1 49 VAL HB . . 3.200 2.546 2.421 2.625 . 0 0 "[ . 1 . 2]" 1
805 1 49 VAL H 1 49 VAL QG . . 2.940 2.071 1.970 2.401 . 0 0 "[ . 1 . 2]" 1
806 1 49 VAL H 1 50 GLN H . . 3.700 2.764 2.580 2.854 . 0 0 "[ . 1 . 2]" 1
807 1 49 VAL H 1 52 ILE MD . . 5.250 4.295 4.047 5.266 0.016 15 0 "[ . 1 . 2]" 1
808 1 49 VAL HA 1 49 VAL QG . . 3.180 2.132 2.116 2.142 . 0 0 "[ . 1 . 2]" 1
809 1 49 VAL HA 1 50 GLN HA . . 4.920 4.786 4.736 4.867 . 0 0 "[ . 1 . 2]" 1
810 1 49 VAL HA 1 52 ILE H . . 4.410 3.432 2.961 3.625 . 0 0 "[ . 1 . 2]" 1
811 1 49 VAL HA 1 52 ILE HB . . 3.870 2.860 2.636 3.051 . 0 0 "[ . 1 . 2]" 1
812 1 49 VAL HA 1 52 ILE MD . . 4.010 2.566 2.153 3.449 . 0 0 "[ . 1 . 2]" 1
813 1 49 VAL HA 1 52 ILE MG . . 4.500 4.197 3.745 4.395 . 0 0 "[ . 1 . 2]" 1
814 1 49 VAL HA 1 53 GLN H . . 4.670 4.174 4.005 4.428 . 0 0 "[ . 1 . 2]" 1
815 1 49 VAL HB 1 50 GLN H . . 3.650 2.542 2.331 2.971 . 0 0 "[ . 1 . 2]" 1
816 1 49 VAL QG 1 50 GLN H . . 3.410 3.139 3.041 3.390 . 0 0 "[ . 1 . 2]" 1
817 1 49 VAL QG 1 50 GLN HA . . 3.510 3.300 3.175 3.600 0.090 15 0 "[ . 1 . 2]" 1
818 1 49 VAL QG 1 52 ILE MD . . 4.610 3.284 2.796 3.716 . 0 0 "[ . 1 . 2]" 1
819 1 49 VAL QG 1 53 GLN H . . 4.730 3.824 3.429 4.103 . 0 0 "[ . 1 . 2]" 1
820 1 49 VAL QG 1 53 GLN HE21 . . 4.030 2.276 1.792 4.033 0.003 16 0 "[ . 1 . 2]" 1
821 1 49 VAL QG 1 53 GLN QE . . 3.540 2.193 1.781 3.543 0.003 10 0 "[ . 1 . 2]" 1
822 1 49 VAL QG 1 53 GLN HE22 . . 3.960 3.337 2.856 3.935 . 0 0 "[ . 1 . 2]" 1
823 1 49 VAL QG 1 53 GLN HG2 . . 3.880 2.557 2.114 2.959 . 0 0 "[ . 1 . 2]" 1
824 1 49 VAL QG 1 53 GLN QG . . 3.560 2.458 2.039 2.872 . 0 0 "[ . 1 . 2]" 1
825 1 49 VAL QG 1 53 GLN HG3 . . 4.190 3.209 2.674 3.883 . 0 0 "[ . 1 . 2]" 1
826 1 50 GLN H 1 50 GLN HA . . 2.910 2.802 2.774 2.831 . 0 0 "[ . 1 . 2]" 1
827 1 50 GLN H 1 50 GLN QB . . 2.830 2.390 2.326 2.441 . 0 0 "[ . 1 . 2]" 1
828 1 50 GLN H 1 50 GLN HG2 . . 2.920 2.427 2.258 3.335 0.415 8 0 "[ . 1 . 2]" 1
829 1 50 GLN H 1 50 GLN QG . . 2.820 2.366 2.239 3.134 0.314 8 0 "[ . 1 . 2]" 1
830 1 50 GLN H 1 50 GLN HG3 . . 3.720 3.666 2.487 3.808 0.088 8 0 "[ . 1 . 2]" 1
831 1 50 GLN HA 1 50 GLN HE21 . . 4.310 3.018 2.323 4.080 . 0 0 "[ . 1 . 2]" 1
832 1 50 GLN HA 1 50 GLN QE . . 4.000 2.816 2.265 3.606 . 0 0 "[ . 1 . 2]" 1
833 1 50 GLN HA 1 50 GLN HE22 . . 4.740 3.524 3.094 4.902 0.162 1 0 "[ . 1 . 2]" 1
834 1 50 GLN HA 1 50 GLN HG2 . . 2.840 2.989 2.263 3.737 0.897 8 1 "[ . + 1 . 2]" 1
835 1 50 GLN HA 1 50 GLN QG . . 2.800 2.830 2.230 2.939 0.139 13 0 "[ . 1 . 2]" 1
836 1 50 GLN HA 1 51 SER H . . 3.450 3.498 3.414 3.527 0.077 15 0 "[ . 1 . 2]" 1
837 1 50 GLN HA 1 53 GLN H . . 4.150 3.374 3.107 3.616 . 0 0 "[ . 1 . 2]" 1
838 1 50 GLN HA 1 53 GLN HB2 . . 4.080 2.817 2.377 3.276 . 0 0 "[ . 1 . 2]" 1
839 1 50 GLN HA 1 53 GLN QB . . 4.010 2.773 2.356 3.202 . 0 0 "[ . 1 . 2]" 1
840 1 50 GLN QB 1 50 GLN HE22 . . 4.780 4.167 3.479 4.446 . 0 0 "[ . 1 . 2]" 1
841 1 50 GLN QB 1 50 GLN QG . . 2.310 1.992 1.926 2.056 . 0 0 "[ . 1 . 2]" 1
842 1 50 GLN QB 1 50 GLN HG3 . . 2.400 2.165 2.158 2.203 . 0 0 "[ . 1 . 2]" 1
843 1 50 GLN QB 1 51 SER H . . 3.230 2.794 2.661 3.080 . 0 0 "[ . 1 . 2]" 1
844 1 50 GLN QE 1 50 GLN QG . . 3.000 2.167 2.124 2.220 . 0 0 "[ . 1 . 2]" 1
845 1 50 GLN HE21 1 50 GLN HG2 . . 3.560 2.418 2.205 3.489 . 0 0 "[ . 1 . 2]" 1
846 1 50 GLN HE21 1 50 GLN HG3 . . 3.660 3.144 2.240 3.479 . 0 0 "[ . 1 . 2]" 1
847 1 50 GLN HE22 1 50 GLN HG2 . . 3.950 3.565 3.468 4.058 0.108 18 0 "[ . 1 . 2]" 1
848 1 50 GLN HE22 1 50 GLN HG3 . . 4.090 3.900 3.497 4.058 . 0 0 "[ . 1 . 2]" 1
849 1 51 SER H 1 51 SER QB . . 3.580 2.428 2.256 2.871 . 0 0 "[ . 1 . 2]" 1
850 1 51 SER H 1 52 ILE MD . . 4.890 4.945 4.915 4.983 0.093 3 0 "[ . 1 . 2]" 1
851 1 51 SER QB 1 52 ILE H . . 4.070 2.602 2.420 3.532 . 0 0 "[ . 1 . 2]" 1
852 1 52 ILE H 1 52 ILE HB . . 3.430 2.502 2.451 2.624 . 0 0 "[ . 1 . 2]" 1
853 1 52 ILE H 1 52 ILE MD . . 4.060 3.442 3.351 3.516 . 0 0 "[ . 1 . 2]" 1
854 1 52 ILE H 1 52 ILE HG12 . . 4.010 3.390 2.007 3.620 . 0 0 "[ . 1 . 2]" 1
855 1 52 ILE H 1 52 ILE QG . . 3.500 2.084 1.983 2.225 . 0 0 "[ . 1 . 2]" 1
856 1 52 ILE H 1 52 ILE HG13 . . 3.850 2.173 1.998 3.433 . 0 0 "[ . 1 . 2]" 1
857 1 52 ILE H 1 52 ILE MG . . 3.880 3.758 3.747 3.777 . 0 0 "[ . 1 . 2]" 1
858 1 52 ILE H 1 53 GLN H . . 3.860 2.569 2.454 2.655 . 0 0 "[ . 1 . 2]" 1
859 1 52 ILE HA 1 52 ILE MD . . 3.750 3.761 2.280 3.858 0.108 1 0 "[ . 1 . 2]" 1
860 1 52 ILE HA 1 52 ILE HG13 . . 4.180 2.954 2.819 3.854 . 0 0 "[ . 1 . 2]" 1
861 1 52 ILE HA 1 52 ILE MG . . 3.320 2.410 2.345 2.461 . 0 0 "[ . 1 . 2]" 1
862 1 52 ILE HA 1 55 LEU H . . 3.980 3.069 2.841 3.316 . 0 0 "[ . 1 . 2]" 1
863 1 52 ILE HA 1 55 LEU QB . . 4.320 2.150 1.843 2.407 . 0 0 "[ . 1 . 2]" 1
864 1 52 ILE HA 1 55 LEU QD . . 3.780 2.550 2.035 3.131 . 0 0 "[ . 1 . 2]" 1
865 1 52 ILE HB 1 53 GLN H . . 3.730 2.754 2.524 2.909 . 0 0 "[ . 1 . 2]" 1
866 1 52 ILE MD 1 52 ILE MG . . 3.030 2.011 1.942 2.081 . 0 0 "[ . 1 . 2]" 1
867 1 52 ILE MD 1 53 GLN H . . 4.820 4.618 4.425 4.754 . 0 0 "[ . 1 . 2]" 1
868 1 52 ILE QG 1 52 ILE MG . . 3.090 2.282 2.241 2.403 . 0 0 "[ . 1 . 2]" 1
869 1 52 ILE HG12 1 52 ILE MG . . 3.300 2.372 2.290 3.195 . 0 0 "[ . 1 . 2]" 1
870 1 52 ILE HG13 1 52 ILE MG . . 3.710 3.165 2.485 3.212 . 0 0 "[ . 1 . 2]" 1
871 1 52 ILE MG 1 53 GLN H . . 3.810 3.559 3.399 3.716 . 0 0 "[ . 1 . 2]" 1
872 1 52 ILE MG 1 53 GLN HG2 . . 5.050 4.601 4.361 4.828 . 0 0 "[ . 1 . 2]" 1
873 1 52 ILE MG 1 53 GLN QG . . 4.920 4.457 4.242 4.671 . 0 0 "[ . 1 . 2]" 1
874 1 52 ILE MG 1 54 SER H . . 4.990 4.969 4.835 5.067 0.077 9 0 "[ . 1 . 2]" 1
875 1 52 ILE MG 1 56 ALA MB . . 3.640 2.932 2.251 3.510 . 0 0 "[ . 1 . 2]" 1
876 1 53 GLN H 1 53 GLN HB2 . . 3.330 2.543 2.438 2.705 . 0 0 "[ . 1 . 2]" 1
877 1 53 GLN H 1 53 GLN QB . . 3.080 2.493 2.401 2.631 . 0 0 "[ . 1 . 2]" 1
878 1 53 GLN H 1 53 GLN HB3 . . 3.630 3.605 3.595 3.614 . 0 0 "[ . 1 . 2]" 1
879 1 53 GLN H 1 53 GLN QE . . 4.900 4.053 3.795 4.708 . 0 0 "[ . 1 . 2]" 1
880 1 53 GLN H 1 53 GLN HE22 . . 5.030 5.183 4.941 5.491 0.461 1 0 "[ . 1 . 2]" 1
881 1 53 GLN H 1 53 GLN HG2 . . 3.520 2.183 1.961 2.344 . 0 0 "[ . 1 . 2]" 1
882 1 53 GLN H 1 53 GLN QG . . 3.210 2.166 1.952 2.320 . 0 0 "[ . 1 . 2]" 1
883 1 53 GLN H 1 53 GLN HG3 . . 3.690 3.617 3.524 3.722 0.032 11 0 "[ . 1 . 2]" 1
884 1 53 GLN H 1 54 SER H . . 3.490 2.798 2.677 2.927 . 0 0 "[ . 1 . 2]" 1
885 1 53 GLN HA 1 53 GLN QE . . 4.290 3.650 3.546 3.751 . 0 0 "[ . 1 . 2]" 1
886 1 53 GLN HA 1 53 GLN HE22 . . 4.380 4.118 3.989 4.201 . 0 0 "[ . 1 . 2]" 1
887 1 53 GLN HA 1 53 GLN HG2 . . 3.770 3.055 2.961 3.290 . 0 0 "[ . 1 . 2]" 1
888 1 53 GLN HA 1 53 GLN QG . . 3.530 2.929 2.848 3.107 . 0 0 "[ . 1 . 2]" 1
889 1 53 GLN QB 1 54 SER H . . 3.330 2.486 2.288 2.684 . 0 0 "[ . 1 . 2]" 1
890 1 53 GLN HB2 1 54 SER H . . 3.650 2.539 2.327 2.751 . 0 0 "[ . 1 . 2]" 1
891 1 53 GLN HB3 1 54 SER H . . 3.830 3.559 3.382 3.780 . 0 0 "[ . 1 . 2]" 1
892 1 53 GLN QE 1 53 GLN QG . . 3.000 2.150 2.134 2.198 . 0 0 "[ . 1 . 2]" 1
893 1 53 GLN HE22 1 53 GLN HG2 . . 3.800 3.573 3.484 4.044 0.244 16 0 "[ . 1 . 2]" 1
894 1 53 GLN HE22 1 53 GLN HG3 . . 3.540 3.722 3.477 3.777 0.237 17 0 "[ . 1 . 2]" 1
895 1 54 SER H 1 54 SER HB2 . . 2.840 2.558 2.423 2.636 . 0 0 "[ . 1 . 2]" 1
896 1 54 SER H 1 54 SER QB . . 2.800 2.507 2.390 2.574 . 0 0 "[ . 1 . 2]" 1
897 1 54 SER H 1 55 LEU H . . 3.470 2.469 2.189 2.687 . 0 0 "[ . 1 . 2]" 1
898 1 54 SER HA 1 54 SER QB . . 2.570 2.333 2.298 2.401 . 0 0 "[ . 1 . 2]" 1
899 1 54 SER HA 1 54 SER HB3 . . 2.770 2.427 2.383 2.520 . 0 0 "[ . 1 . 2]" 1
900 1 54 SER QB 1 55 LEU H . . 3.320 2.630 2.439 2.890 . 0 0 "[ . 1 . 2]" 1
901 1 54 SER QB 1 58 GLN H . . 4.510 4.497 4.234 4.565 0.055 7 0 "[ . 1 . 2]" 1
902 1 54 SER QB 1 58 GLN QE . . 3.690 3.150 2.163 3.737 0.047 16 0 "[ . 1 . 2]" 1
903 1 54 SER HB2 1 55 LEU H . . 3.360 2.681 2.479 2.956 . 0 0 "[ . 1 . 2]" 1
904 1 54 SER HB3 1 58 GLN H . . 4.610 4.783 4.493 4.902 0.292 7 0 "[ . 1 . 2]" 1
905 1 54 SER HB3 1 58 GLN QE . . 3.900 3.329 2.179 3.893 . 0 0 "[ . 1 . 2]" 1
906 1 55 LEU H 1 55 LEU QB . . 2.800 2.266 2.081 2.395 . 0 0 "[ . 1 . 2]" 1
907 1 55 LEU HA 1 55 LEU QD . . 2.820 1.997 1.942 2.086 . 0 0 "[ . 1 . 2]" 1
908 1 55 LEU HA 1 55 LEU HG . . 3.030 2.972 2.577 3.051 0.021 6 0 "[ . 1 . 2]" 1
909 1 55 LEU HA 1 58 GLN H . . 4.330 3.717 3.375 4.024 . 0 0 "[ . 1 . 2]" 1
910 1 55 LEU HA 1 60 ARG HB2 . . 4.420 3.080 2.659 3.451 . 0 0 "[ . 1 . 2]" 1
911 1 55 LEU HA 1 60 ARG QB . . 4.330 3.039 2.636 3.388 . 0 0 "[ . 1 . 2]" 1
912 1 55 LEU HA 1 61 THR MG . . 5.160 4.758 3.639 5.312 0.152 17 0 "[ . 1 . 2]" 1
913 1 55 LEU QB 1 55 LEU QD . . 2.750 1.939 1.918 1.953 . 0 0 "[ . 1 . 2]" 1
914 1 55 LEU QB 1 56 ALA H . . 3.380 2.488 2.314 2.705 . 0 0 "[ . 1 . 2]" 1
915 1 55 LEU QD 1 58 GLN QE . . 5.090 3.473 2.307 5.062 . 0 0 "[ . 1 . 2]" 1
916 1 55 LEU QD 1 60 ARG HA . . 4.320 4.261 4.104 4.398 0.078 15 0 "[ . 1 . 2]" 1
917 1 55 LEU QD 1 60 ARG HB2 . . 3.010 2.391 2.077 2.838 . 0 0 "[ . 1 . 2]" 1
918 1 55 LEU QD 1 60 ARG QB . . 2.800 2.303 2.033 2.644 . 0 0 "[ . 1 . 2]" 1
919 1 55 LEU QD 1 60 ARG HB3 . . 3.360 3.079 2.863 3.323 . 0 0 "[ . 1 . 2]" 1
920 1 55 LEU QD 1 60 ARG QD . . 3.890 3.600 3.199 3.941 0.051 10 0 "[ . 1 . 2]" 1
921 1 55 LEU QD 1 61 THR H . . 4.450 3.785 3.388 4.570 0.120 18 0 "[ . 1 . 2]" 1
922 1 55 LEU QD 1 61 THR HA . . 3.520 2.466 1.989 3.322 . 0 0 "[ . 1 . 2]" 1
923 1 55 LEU QD 1 61 THR MG . . 3.730 2.486 1.989 3.731 0.001 2 0 "[ . 1 . 2]" 1
924 1 55 LEU QD 1 65 LYS QD . . 3.320 2.571 1.834 3.346 0.026 1 0 "[ . 1 . 2]" 1
925 1 55 LEU QD 1 65 LYS QE . . 3.790 3.073 2.021 3.891 0.101 2 0 "[ . 1 . 2]" 1
926 1 55 LEU HG 1 61 THR MG . . 4.570 3.743 2.084 4.668 0.098 16 0 "[ . 1 . 2]" 1
927 1 56 ALA H 1 56 ALA MB . . 2.670 2.263 2.234 2.317 . 0 0 "[ . 1 . 2]" 1
928 1 56 ALA HA 1 61 THR MG . . 4.670 3.647 2.156 4.720 0.050 20 0 "[ . 1 . 2]" 1
929 1 57 ALA H 1 57 ALA MB . . 2.800 2.335 2.281 2.402 . 0 0 "[ . 1 . 2]" 1
930 1 57 ALA H 1 58 GLN H . . 3.300 2.072 1.923 2.173 . 0 0 "[ . 1 . 2]" 1
931 1 57 ALA H 1 58 GLN HA . . 4.620 4.778 4.663 4.866 0.246 12 0 "[ . 1 . 2]" 1
932 1 57 ALA MB 1 58 GLN H . . 3.580 2.645 2.472 2.744 . 0 0 "[ . 1 . 2]" 1
933 1 57 ALA MB 1 58 GLN HA . . 4.520 3.919 3.840 3.974 . 0 0 "[ . 1 . 2]" 1
934 1 57 ALA MB 1 58 GLN QG . . 4.160 3.028 2.818 3.172 . 0 0 "[ . 1 . 2]" 1
935 1 57 ALA MB 1 58 GLN HG3 . . 4.240 3.106 2.871 3.270 . 0 0 "[ . 1 . 2]" 1
936 1 57 ALA MB 1 59 GLY H . . 4.370 4.251 4.084 4.400 0.030 16 0 "[ . 1 . 2]" 1
937 1 58 GLN H 1 58 GLN HB2 . . 3.350 2.424 2.305 2.528 . 0 0 "[ . 1 . 2]" 1
938 1 58 GLN H 1 58 GLN QB . . 3.080 2.389 2.278 2.482 . 0 0 "[ . 1 . 2]" 1
939 1 58 GLN H 1 58 GLN HB3 . . 3.590 3.607 3.562 3.622 0.032 14 0 "[ . 1 . 2]" 1
940 1 58 GLN H 1 58 GLN HG2 . . 3.790 3.695 3.512 3.838 0.048 3 0 "[ . 1 . 2]" 1
941 1 58 GLN H 1 58 GLN QG . . 3.270 2.461 2.219 2.667 . 0 0 "[ . 1 . 2]" 1
942 1 58 GLN H 1 58 GLN HG3 . . 3.580 2.500 2.244 2.721 . 0 0 "[ . 1 . 2]" 1
943 1 58 GLN H 1 59 GLY H . . 3.320 2.390 2.292 2.565 . 0 0 "[ . 1 . 2]" 1
944 1 58 GLN HA 1 58 GLN HB3 . . 2.960 2.498 2.435 2.559 . 0 0 "[ . 1 . 2]" 1
945 1 58 GLN HA 1 58 GLN HG2 . . 3.100 2.548 2.444 2.670 . 0 0 "[ . 1 . 2]" 1
946 1 58 GLN HA 1 58 GLN QG . . 2.870 2.414 2.330 2.522 . 0 0 "[ . 1 . 2]" 1
947 1 58 GLN HA 1 58 GLN HG3 . . 3.400 3.000 2.893 3.102 . 0 0 "[ . 1 . 2]" 1
948 1 58 GLN QB 1 59 GLY H . . 3.780 3.168 2.763 3.428 . 0 0 "[ . 1 . 2]" 1
949 1 58 GLN QB 1 60 ARG QD . . 3.760 3.005 2.336 3.510 . 0 0 "[ . 1 . 2]" 1
950 1 58 GLN QB 1 60 ARG QG . . 4.040 2.330 2.072 2.871 . 0 0 "[ . 1 . 2]" 1
951 1 58 GLN HB2 1 59 GLY H . . 4.080 3.300 2.825 3.609 . 0 0 "[ . 1 . 2]" 1
952 1 58 GLN HB2 1 60 ARG QD . . 4.650 3.458 2.830 3.911 . 0 0 "[ . 1 . 2]" 1
953 1 58 GLN HB3 1 59 GLY H . . 4.480 4.103 3.777 4.277 . 0 0 "[ . 1 . 2]" 1
954 1 58 GLN HB3 1 60 ARG QD . . 3.970 3.342 2.488 4.037 0.067 13 0 "[ . 1 . 2]" 1
955 1 58 GLN HB3 1 60 ARG HG3 . . 4.210 2.566 2.242 3.096 . 0 0 "[ . 1 . 2]" 1
956 1 58 GLN QE 1 58 GLN QG . . 2.970 2.600 2.154 2.684 . 0 0 "[ . 1 . 2]" 1
957 1 58 GLN QE 1 60 ARG QG . . 4.160 3.494 3.002 4.210 0.050 15 0 "[ . 1 . 2]" 1
958 1 58 GLN QE 1 60 ARG HG3 . . 4.340 3.585 3.044 4.358 0.018 15 0 "[ . 1 . 2]" 1
959 1 58 GLN QG 1 59 GLY H . . 5.040 4.282 3.985 4.385 . 0 0 "[ . 1 . 2]" 1
960 1 58 GLN HG2 1 59 GLY H . . 5.180 5.200 5.027 5.284 0.104 2 0 "[ . 1 . 2]" 1
961 1 59 GLY H 1 60 ARG H . . 3.660 2.583 2.252 2.786 . 0 0 "[ . 1 . 2]" 1
962 1 59 GLY QA 1 60 ARG H . . 3.090 2.707 2.594 2.884 . 0 0 "[ . 1 . 2]" 1
963 1 59 GLY HA2 1 60 ARG H . . 3.390 2.819 2.666 3.116 . 0 0 "[ . 1 . 2]" 1
964 1 60 ARG H 1 60 ARG HB2 . . 3.080 2.563 2.290 2.669 . 0 0 "[ . 1 . 2]" 1
965 1 60 ARG H 1 60 ARG QB . . 2.960 2.520 2.264 2.618 . 0 0 "[ . 1 . 2]" 1
966 1 60 ARG H 1 60 ARG HB3 . . 3.820 3.724 3.561 3.791 . 0 0 "[ . 1 . 2]" 1
967 1 60 ARG HA 1 60 ARG QB . . 2.620 2.377 2.326 2.446 . 0 0 "[ . 1 . 2]" 1
968 1 60 ARG HA 1 60 ARG HB3 . . 2.880 2.491 2.420 2.598 . 0 0 "[ . 1 . 2]" 1
969 1 60 ARG HA 1 60 ARG QD . . 3.680 3.846 3.754 3.941 0.261 14 0 "[ . 1 . 2]" 1
970 1 60 ARG HA 1 60 ARG HG2 . . 2.940 2.418 2.298 2.513 . 0 0 "[ . 1 . 2]" 1
971 1 60 ARG HA 1 60 ARG QG . . 2.840 2.343 2.224 2.440 . 0 0 "[ . 1 . 2]" 1
972 1 60 ARG HA 1 60 ARG HG3 . . 3.780 3.163 2.744 3.348 . 0 0 "[ . 1 . 2]" 1
973 1 60 ARG QB 1 60 ARG QD . . 2.920 2.101 2.073 2.132 . 0 0 "[ . 1 . 2]" 1
974 1 60 ARG QB 1 61 THR HA . . 4.460 4.214 4.008 4.342 . 0 0 "[ . 1 . 2]" 1
975 1 60 ARG HB2 1 60 ARG QD . . 3.740 2.476 2.345 2.566 . 0 0 "[ . 1 . 2]" 1
976 1 60 ARG HB2 1 61 THR HA . . 4.730 4.680 4.332 5.223 0.493 18 0 "[ . 1 . 2]" 1
977 1 60 ARG HB3 1 60 ARG QD . . 3.050 2.276 2.200 2.382 . 0 0 "[ . 1 . 2]" 1
978 1 60 ARG HB3 1 61 THR HA . . 5.460 4.810 4.513 4.994 . 0 0 "[ . 1 . 2]" 1
979 1 61 THR HA 1 65 LYS HB2 . . 4.740 3.659 3.136 4.840 0.100 18 0 "[ . 1 . 2]" 1
980 1 61 THR HA 1 65 LYS QB . . 4.140 3.456 2.978 4.196 0.056 18 0 "[ . 1 . 2]" 1
981 1 61 THR HA 1 65 LYS HB3 . . 4.570 4.401 3.529 4.758 0.188 9 0 "[ . 1 . 2]" 1
982 1 61 THR HA 1 65 LYS QD . . 3.560 3.414 2.236 3.775 0.215 11 0 "[ . 1 . 2]" 1
983 1 61 THR HA 1 65 LYS QG . . 4.040 3.630 1.788 4.161 0.121 4 0 "[ . 1 . 2]" 1
984 1 61 THR HA 1 66 LEU QD . . 3.790 3.363 2.772 3.799 0.009 3 0 "[ . 1 . 2]" 1
985 1 61 THR MG 1 62 SER H . . 4.060 3.696 3.113 4.196 0.136 4 0 "[ . 1 . 2]" 1
986 1 61 THR MG 1 66 LEU QD . . 3.550 2.225 1.793 3.526 . 0 0 "[ . 1 . 2]" 1
987 1 62 SER H 1 62 SER QB . . 3.040 2.630 2.233 2.912 . 0 0 "[ . 1 . 2]" 1
988 1 62 SER H 1 65 LYS QD . . 4.150 2.974 1.851 4.423 0.273 10 0 "[ . 1 . 2]" 1
989 1 62 SER HA 1 63 PRO QD . . 2.840 2.053 1.947 2.217 . 0 0 "[ . 1 . 2]" 1
990 1 62 SER QB 1 63 PRO QD . . 3.490 2.463 1.871 3.232 . 0 0 "[ . 1 . 2]" 1
991 1 62 SER QB 1 65 LYS QD . . 3.810 3.305 1.976 3.940 0.130 15 0 "[ . 1 . 2]" 1
992 1 63 PRO HA 1 66 LEU H . . 4.000 3.440 3.055 3.813 . 0 0 "[ . 1 . 2]" 1
993 1 63 PRO HA 1 66 LEU QD . . 3.690 2.517 1.985 3.674 . 0 0 "[ . 1 . 2]" 1
994 1 63 PRO HA 1 66 LEU HG . . 4.560 4.134 2.657 4.727 0.167 9 0 "[ . 1 . 2]" 1
995 1 63 PRO HA 1 67 GLN H . . 4.260 4.092 3.848 4.336 0.076 3 0 "[ . 1 . 2]" 1
996 1 64 ASN HA 1 67 GLN H . . 4.060 3.473 3.265 3.863 . 0 0 "[ . 1 . 2]" 1
997 1 64 ASN HA 1 67 GLN QB . . 3.210 2.733 2.183 3.374 0.164 10 0 "[ . 1 . 2]" 1
998 1 64 ASN HA 1 68 ALA H . . 5.200 4.350 4.033 5.076 . 0 0 "[ . 1 . 2]" 1
999 1 64 ASN QB 1 65 LYS H . . 3.960 2.868 2.335 3.798 . 0 0 "[ . 1 . 2]" 1
1000 1 65 LYS H 1 65 LYS HB2 . . 3.890 2.551 2.327 3.509 . 0 0 "[ . 1 . 2]" 1
1001 1 65 LYS H 1 65 LYS QB . . 3.180 2.420 2.199 2.643 . 0 0 "[ . 1 . 2]" 1
1002 1 65 LYS H 1 65 LYS HB3 . . 3.380 3.468 2.222 3.621 0.241 11 0 "[ . 1 . 2]" 1
1003 1 65 LYS H 1 65 LYS QD . . 5.130 3.355 1.933 4.749 . 0 0 "[ . 1 . 2]" 1
1004 1 65 LYS H 1 65 LYS QE . . 4.700 4.400 3.877 4.780 0.080 7 0 "[ . 1 . 2]" 1
1005 1 65 LYS H 1 65 LYS QG . . 3.570 2.777 2.007 3.891 0.321 19 0 "[ . 1 . 2]" 1
1006 1 65 LYS H 1 66 LEU H . . 3.720 2.532 2.235 2.685 . 0 0 "[ . 1 . 2]" 1
1007 1 65 LYS HA 1 65 LYS QD . . 3.520 3.247 2.309 3.724 0.204 18 0 "[ . 1 . 2]" 1
1008 1 65 LYS HA 1 65 LYS QE . . 4.470 4.127 1.990 4.763 0.293 5 0 "[ . 1 . 2]" 1
1009 1 65 LYS HA 1 65 LYS QG . . 3.110 2.494 2.224 3.261 0.151 18 0 "[ . 1 . 2]" 1
1010 1 65 LYS QB 1 66 LEU H . . 4.100 2.548 2.308 3.431 . 0 0 "[ . 1 . 2]" 1
1011 1 65 LYS HB2 1 66 LEU H . . 4.180 2.707 2.343 4.176 . 0 0 "[ . 1 . 2]" 1
1012 1 65 LYS QD 1 69 LEU QD . . 5.350 4.623 2.707 5.321 . 0 0 "[ . 1 . 2]" 1
1013 1 65 LYS QE 1 65 LYS QG . . 2.960 2.246 2.120 2.406 . 0 0 "[ . 1 . 2]" 1
1014 1 66 LEU H 1 66 LEU HB2 . . 3.630 2.429 2.211 2.621 . 0 0 "[ . 1 . 2]" 1
1015 1 66 LEU H 1 66 LEU QB . . 3.090 2.389 2.188 2.559 . 0 0 "[ . 1 . 2]" 1
1016 1 66 LEU H 1 66 LEU HB3 . . 3.340 3.565 3.497 3.619 0.279 2 0 "[ . 1 . 2]" 1
1017 1 66 LEU H 1 66 LEU QD . . 3.360 2.311 1.767 3.020 . 0 0 "[ . 1 . 2]" 1
1018 1 66 LEU H 1 66 LEU HG . . 4.500 3.339 2.004 4.163 . 0 0 "[ . 1 . 2]" 1
1019 1 66 LEU H 1 67 GLN H . . 4.010 2.566 2.425 2.716 . 0 0 "[ . 1 . 2]" 1
1020 1 66 LEU HA 1 66 LEU QD . . 2.790 2.080 1.899 2.524 . 0 0 "[ . 1 . 2]" 1
1021 1 66 LEU HA 1 69 LEU H . . 3.490 3.199 2.900 3.514 0.024 4 0 "[ . 1 . 2]" 1
1022 1 66 LEU HA 1 69 LEU QD . . 3.640 2.254 1.867 2.837 . 0 0 "[ . 1 . 2]" 1
1023 1 66 LEU QB 1 66 LEU QD . . 2.700 1.998 1.953 2.073 . 0 0 "[ . 1 . 2]" 1
1024 1 66 LEU HB2 1 66 LEU QD . . 3.030 2.204 2.101 2.346 . 0 0 "[ . 1 . 2]" 1
1025 1 66 LEU HB2 1 67 GLN H . . 3.720 2.803 2.652 2.996 . 0 0 "[ . 1 . 2]" 1
1026 1 66 LEU HB3 1 66 LEU QD . . 3.180 2.352 2.113 2.578 . 0 0 "[ . 1 . 2]" 1
1027 1 66 LEU HB3 1 67 GLN H . . 3.750 3.715 3.403 3.922 0.172 15 0 "[ . 1 . 2]" 1
1028 1 66 LEU QD 1 67 GLN H . . 4.420 3.856 3.515 4.112 . 0 0 "[ . 1 . 2]" 1
1029 1 66 LEU QD 1 69 LEU QD . . 3.080 2.303 1.806 2.993 . 0 0 "[ . 1 . 2]" 1
1030 1 67 GLN H 1 67 GLN QB . . 2.790 2.269 2.123 2.532 . 0 0 "[ . 1 . 2]" 1
1031 1 67 GLN H 1 68 ALA H . . 3.500 2.650 2.556 2.810 . 0 0 "[ . 1 . 2]" 1
1032 1 67 GLN HA 1 67 GLN QG . . 3.520 2.670 2.335 3.495 . 0 0 "[ . 1 . 2]" 1
1033 1 67 GLN HA 1 70 ASN H . . 4.380 3.516 3.311 3.863 . 0 0 "[ . 1 . 2]" 1
1034 1 67 GLN HA 1 70 ASN QB . . 3.570 2.763 2.422 3.119 . 0 0 "[ . 1 . 2]" 1
1035 1 67 GLN QB 1 68 ALA H . . 3.430 2.731 2.336 3.515 0.085 5 0 "[ . 1 . 2]" 1
1036 1 67 GLN QB 1 68 ALA HA . . 4.450 4.221 3.861 4.522 0.072 10 0 "[ . 1 . 2]" 1
1037 1 67 GLN QE 1 71 MET ME . . 3.180 2.624 1.951 3.262 0.082 11 0 "[ . 1 . 2]" 1
1038 1 67 GLN HE21 1 68 ALA MB . . 5.500 4.216 2.402 5.611 0.111 4 0 "[ . 1 . 2]" 1
1039 1 67 GLN HE21 1 71 MET ME . . 3.220 3.233 2.480 4.210 0.990 12 4 "[ * * + . -2]" 1
1040 1 67 GLN HE22 1 67 GLN QG . . 3.330 3.267 3.210 3.490 0.160 13 0 "[ . 1 . 2]" 1
1041 1 67 GLN HE22 1 68 ALA MB . . 5.400 4.580 2.545 5.568 0.168 9 0 "[ . 1 . 2]" 1
1042 1 67 GLN HE22 1 71 MET ME . . 4.980 3.191 1.983 4.558 . 0 0 "[ . 1 . 2]" 1
1043 1 67 GLN QG 1 68 ALA H . . 4.170 3.561 2.260 4.313 0.143 17 0 "[ . 1 . 2]" 1
1044 1 68 ALA H 1 68 ALA MB . . 2.720 2.246 2.229 2.266 . 0 0 "[ . 1 . 2]" 1
1045 1 68 ALA H 1 69 LEU QD . . 5.400 4.439 3.417 4.829 . 0 0 "[ . 1 . 2]" 1
1046 1 68 ALA HA 1 70 ASN H . . 4.000 3.974 3.521 4.096 0.096 11 0 "[ . 1 . 2]" 1
1047 1 68 ALA MB 1 71 MET ME . . 3.160 3.048 2.819 3.226 0.066 17 0 "[ . 1 . 2]" 1
1048 1 69 LEU H 1 69 LEU HB2 . . 3.940 2.498 2.279 3.610 . 0 0 "[ . 1 . 2]" 1
1049 1 69 LEU H 1 69 LEU QB . . 3.150 2.419 2.253 2.755 . 0 0 "[ . 1 . 2]" 1
1050 1 69 LEU H 1 69 LEU HB3 . . 3.310 3.551 2.858 3.616 0.306 17 0 "[ . 1 . 2]" 1
1051 1 69 LEU H 1 69 LEU QD . . 3.550 2.850 1.889 3.143 . 0 0 "[ . 1 . 2]" 1
1052 1 69 LEU H 1 69 LEU HG . . 3.680 2.629 1.874 3.899 0.219 16 0 "[ . 1 . 2]" 1
1053 1 69 LEU H 1 70 ASN H . . 3.770 2.623 2.554 2.735 . 0 0 "[ . 1 . 2]" 1
1054 1 69 LEU HA 1 69 LEU HG . . 3.850 3.258 2.961 3.729 . 0 0 "[ . 1 . 2]" 1
1055 1 69 LEU QB 1 70 ASN H . . 3.650 2.887 2.673 3.635 . 0 0 "[ . 1 . 2]" 1
1056 1 69 LEU HB2 1 70 ASN H . . 4.340 2.992 2.752 3.921 . 0 0 "[ . 1 . 2]" 1
1057 1 69 LEU HB3 1 70 ASN H . . 3.920 3.835 3.475 4.327 0.407 17 0 "[ . 1 . 2]" 1
1058 1 70 ASN H 1 70 ASN QB . . 3.270 2.224 2.093 2.353 . 0 0 "[ . 1 . 2]" 1
1059 1 70 ASN H 1 71 MET H . . 3.380 2.754 2.237 2.941 . 0 0 "[ . 1 . 2]" 1
1060 1 70 ASN HA 1 73 PHE QB . . 3.710 2.951 2.743 3.182 . 0 0 "[ . 1 . 2]" 1
1061 1 70 ASN HA 1 73 PHE HB3 . . 3.770 3.036 2.808 3.281 . 0 0 "[ . 1 . 2]" 1
1062 1 70 ASN HA 1 73 PHE QD . . 4.390 3.728 3.368 3.882 . 0 0 "[ . 1 . 2]" 1
1063 1 70 ASN HA 1 74 ALA MB . . 5.080 4.706 4.234 4.984 . 0 0 "[ . 1 . 2]" 1
1064 1 70 ASN HA 1 120 ILE MD . . 3.630 2.669 2.403 2.975 . 0 0 "[ . 1 . 2]" 1
1065 1 70 ASN QB 1 71 MET H . . 3.720 2.320 2.109 2.523 . 0 0 "[ . 1 . 2]" 1
1066 1 70 ASN QB 1 71 MET ME . . 3.840 3.852 3.563 3.927 0.087 15 0 "[ . 1 . 2]" 1
1067 1 70 ASN QB 1 71 MET QG . . 4.690 3.024 2.788 4.003 . 0 0 "[ . 1 . 2]" 1
1068 1 70 ASN QB 1 71 MET HG3 . . 4.940 3.081 2.832 4.215 . 0 0 "[ . 1 . 2]" 1
1069 1 70 ASN QB 1 120 ILE MD . . 3.430 3.440 3.089 3.583 0.153 2 0 "[ . 1 . 2]" 1
1070 1 70 ASN QD 1 120 ILE MD . . 3.960 2.511 2.079 3.537 . 0 0 "[ . 1 . 2]" 1
1071 1 70 ASN QD 1 123 LEU QD . . 5.060 3.841 2.670 4.564 . 0 0 "[ . 1 . 2]" 1
1072 1 70 ASN HD21 1 120 ILE MD . . 4.890 3.256 2.647 4.370 . 0 0 "[ . 1 . 2]" 1
1073 1 70 ASN HD22 1 120 ILE MD . . 4.180 2.619 2.172 3.737 . 0 0 "[ . 1 . 2]" 1
1074 1 70 ASN HD22 1 123 LEU QD . . 5.260 4.116 2.729 4.853 . 0 0 "[ . 1 . 2]" 1
1075 1 71 MET H 1 71 MET QB . . 3.420 2.375 2.321 2.438 . 0 0 "[ . 1 . 2]" 1
1076 1 71 MET H 1 71 MET ME . . 4.290 3.114 2.802 3.266 . 0 0 "[ . 1 . 2]" 1
1077 1 71 MET H 1 71 MET HG2 . . 3.990 3.586 3.428 3.926 . 0 0 "[ . 1 . 2]" 1
1078 1 71 MET H 1 71 MET QG . . 3.490 2.307 2.110 3.247 . 0 0 "[ . 1 . 2]" 1
1079 1 71 MET H 1 71 MET HG3 . . 3.860 2.342 2.130 3.463 . 0 0 "[ . 1 . 2]" 1
1080 1 71 MET HA 1 71 MET HG2 . . 3.760 2.607 2.508 3.615 . 0 0 "[ . 1 . 2]" 1
1081 1 71 MET HA 1 71 MET HG3 . . 3.730 2.895 2.365 3.023 . 0 0 "[ . 1 . 2]" 1
1082 1 71 MET HA 1 74 ALA H . . 4.400 3.665 3.391 3.868 . 0 0 "[ . 1 . 2]" 1
1083 1 71 MET HA 1 74 ALA MB . . 3.880 2.944 2.673 3.270 . 0 0 "[ . 1 . 2]" 1
1084 1 71 MET HA 1 75 SER H . . 5.200 4.166 3.879 4.392 . 0 0 "[ . 1 . 2]" 1
1085 1 71 MET HA 1 123 LEU QD . . 3.900 2.053 1.893 2.595 . 0 0 "[ . 1 . 2]" 1
1086 1 71 MET HA 1 127 PHE QE . . 4.170 3.944 3.166 4.226 0.056 15 0 "[ . 1 . 2]" 1
1087 1 71 MET QB 1 71 MET ME . . 2.820 2.038 1.917 2.137 . 0 0 "[ . 1 . 2]" 1
1088 1 71 MET ME 1 71 MET HG2 . . 3.430 3.335 2.380 3.400 . 0 0 "[ . 1 . 2]" 1
1089 1 71 MET ME 1 71 MET HG3 . . 3.460 2.475 2.389 3.383 . 0 0 "[ . 1 . 2]" 1
1090 1 71 MET ME 1 72 ARG H . . 4.080 3.811 3.551 3.975 . 0 0 "[ . 1 . 2]" 1
1091 1 71 MET QG 1 72 ARG H . . 4.260 4.042 3.943 4.301 0.041 8 0 "[ . 1 . 2]" 1
1092 1 71 MET QG 1 123 LEU QD . . 4.150 2.143 1.897 2.657 . 0 0 "[ . 1 . 2]" 1
1093 1 71 MET QG 1 127 PHE QE . . 4.150 4.024 3.549 4.301 0.151 17 0 "[ . 1 . 2]" 1
1094 1 71 MET HG2 1 72 ARG H . . 4.840 4.924 4.822 4.962 0.122 10 0 "[ . 1 . 2]" 1
1095 1 71 MET HG2 1 123 LEU QD . . 4.960 2.242 1.915 3.268 . 0 0 "[ . 1 . 2]" 1
1096 1 71 MET HG2 1 127 PHE QE . . 4.230 4.161 3.611 4.725 0.495 8 0 "[ . 1 . 2]" 1
1097 1 71 MET HG3 1 72 ARG H . . 4.730 4.303 4.171 4.833 0.103 8 0 "[ . 1 . 2]" 1
1098 1 71 MET HG3 1 123 LEU QD . . 5.100 3.194 1.975 3.483 . 0 0 "[ . 1 . 2]" 1
1099 1 72 ARG H 1 72 ARG QD . . 4.380 3.844 2.307 4.424 0.044 7 0 "[ . 1 . 2]" 1
1100 1 72 ARG H 1 72 ARG HG2 . . 4.110 3.583 2.213 4.633 0.523 1 1 "[+ . 1 . 2]" 1
1101 1 72 ARG H 1 72 ARG QG . . 4.030 2.975 2.080 4.060 0.030 1 0 "[ . 1 . 2]" 1
1102 1 72 ARG H 1 73 PHE H . . 4.210 2.704 2.579 2.860 . 0 0 "[ . 1 . 2]" 1
1103 1 72 ARG HA 1 72 ARG QD . . 3.990 3.068 1.834 4.166 0.176 3 0 "[ . 1 . 2]" 1
1104 1 72 ARG HA 1 72 ARG HG2 . . 3.740 2.829 2.419 3.727 . 0 0 "[ . 1 . 2]" 1
1105 1 72 ARG HA 1 72 ARG HG3 . . 3.770 3.167 2.421 3.724 . 0 0 "[ . 1 . 2]" 1
1106 1 72 ARG QB 1 73 PHE H . . 4.000 2.610 2.133 3.016 . 0 0 "[ . 1 . 2]" 1
1107 1 72 ARG HB2 1 73 PHE H . . 4.070 3.071 2.466 3.929 . 0 0 "[ . 1 . 2]" 1
1108 1 72 ARG QD 1 73 PHE H . . 4.690 4.514 3.265 4.779 0.089 4 0 "[ . 1 . 2]" 1
1109 1 72 ARG QG 1 73 PHE H . . 4.680 4.114 3.442 4.722 0.042 17 0 "[ . 1 . 2]" 1
1110 1 72 ARG HG2 1 73 PHE H . . 4.790 4.674 3.556 5.187 0.397 8 0 "[ . 1 . 2]" 1
1111 1 73 PHE H 1 73 PHE HB2 . . 3.720 2.569 2.497 2.660 . 0 0 "[ . 1 . 2]" 1
1112 1 73 PHE H 1 73 PHE HB3 . . 3.750 2.412 2.356 2.459 . 0 0 "[ . 1 . 2]" 1
1113 1 73 PHE H 1 73 PHE QD . . 4.470 4.165 4.145 4.189 . 0 0 "[ . 1 . 2]" 1
1114 1 73 PHE H 1 74 ALA MB . . 5.120 4.397 4.322 4.469 . 0 0 "[ . 1 . 2]" 1
1115 1 73 PHE HA 1 73 PHE QD . . 3.050 2.427 2.330 2.494 . 0 0 "[ . 1 . 2]" 1
1116 1 73 PHE HA 1 77 MET ME . . 4.950 4.192 3.845 4.390 . 0 0 "[ . 1 . 2]" 1
1117 1 73 PHE QB 1 74 ALA H . . 4.130 2.438 2.325 2.544 . 0 0 "[ . 1 . 2]" 1
1118 1 73 PHE HB2 1 74 ALA H . . 4.210 3.840 3.772 3.905 . 0 0 "[ . 1 . 2]" 1
1119 1 73 PHE QD 1 74 ALA H . . 4.890 3.569 3.343 3.910 . 0 0 "[ . 1 . 2]" 1
1120 1 73 PHE QD 1 120 ILE MD . . 3.450 2.775 2.590 2.888 . 0 0 "[ . 1 . 2]" 1
1121 1 73 PHE QE 1 120 ILE MD . . 3.840 3.858 3.830 3.888 0.048 6 0 "[ . 1 . 2]" 1
1122 1 73 PHE QE 1 120 ILE QG . . 4.530 2.527 2.384 2.789 . 0 0 "[ . 1 . 2]" 1
1123 1 73 PHE QE 1 120 ILE HG13 . . 4.630 3.979 3.789 4.374 . 0 0 "[ . 1 . 2]" 1
1124 1 73 PHE QE 1 120 ILE MG . . 3.770 3.029 2.687 3.468 . 0 0 "[ . 1 . 2]" 1
1125 1 74 ALA H 1 74 ALA MB . . 3.130 2.220 2.202 2.235 . 0 0 "[ . 1 . 2]" 1
1126 1 74 ALA H 1 75 SER H . . 3.930 2.765 2.638 2.908 . 0 0 "[ . 1 . 2]" 1
1127 1 74 ALA H 1 77 MET ME . . 3.840 3.824 3.797 3.861 0.021 16 0 "[ . 1 . 2]" 1
1128 1 74 ALA H 1 120 ILE MG . . 4.320 4.260 3.884 4.350 0.030 4 0 "[ . 1 . 2]" 1
1129 1 74 ALA HA 1 77 MET H . . 4.580 3.914 3.753 4.105 . 0 0 "[ . 1 . 2]" 1
1130 1 74 ALA HA 1 77 MET HB2 . . 4.560 3.505 3.153 5.158 0.598 16 1 "[ . 1 .+ 2]" 1
1131 1 74 ALA HA 1 77 MET QB . . 4.460 3.404 3.113 4.104 . 0 0 "[ . 1 . 2]" 1
1132 1 74 ALA HA 1 77 MET ME . . 3.050 2.136 2.038 2.363 . 0 0 "[ . 1 . 2]" 1
1133 1 74 ALA HA 1 120 ILE QG . . 3.230 3.202 2.989 3.290 0.060 12 0 "[ . 1 . 2]" 1
1134 1 74 ALA HA 1 120 ILE HG13 . . 3.270 3.308 3.060 3.394 0.124 3 0 "[ . 1 . 2]" 1
1135 1 74 ALA HA 1 120 ILE MG . . 4.080 2.546 2.188 2.654 . 0 0 "[ . 1 . 2]" 1
1136 1 74 ALA MB 1 75 SER H . . 3.320 2.446 2.252 2.527 . 0 0 "[ . 1 . 2]" 1
1137 1 74 ALA MB 1 120 ILE HA . . 4.500 2.109 1.958 2.353 . 0 0 "[ . 1 . 2]" 1
1138 1 74 ALA MB 1 120 ILE MD . . 3.700 3.244 2.949 3.441 . 0 0 "[ . 1 . 2]" 1
1139 1 74 ALA MB 1 120 ILE MG . . 3.420 2.554 2.294 2.789 . 0 0 "[ . 1 . 2]" 1
1140 1 74 ALA MB 1 123 LEU H . . 4.190 3.692 3.468 3.799 . 0 0 "[ . 1 . 2]" 1
1141 1 74 ALA MB 1 123 LEU HB2 . . 3.670 2.136 1.818 2.386 . 0 0 "[ . 1 . 2]" 1
1142 1 74 ALA MB 1 123 LEU QB . . 3.530 1.950 1.788 2.072 . 0 0 "[ . 1 . 2]" 1
1143 1 74 ALA MB 1 123 LEU HB3 . . 4.580 2.375 2.152 2.752 . 0 0 "[ . 1 . 2]" 1
1144 1 74 ALA MB 1 123 LEU QD . . 3.360 2.453 2.265 2.623 . 0 0 "[ . 1 . 2]" 1
1145 1 74 ALA MB 1 124 VAL H . . 4.850 2.708 2.484 3.042 . 0 0 "[ . 1 . 2]" 1
1146 1 74 ALA MB 1 124 VAL QG . . 3.380 2.345 2.194 2.576 . 0 0 "[ . 1 . 2]" 1
1147 1 74 ALA MB 1 124 VAL MG2 . . 3.390 2.355 2.201 2.592 . 0 0 "[ . 1 . 2]" 1
1148 1 74 ALA MB 1 127 PHE HB2 . . 5.180 4.565 4.360 4.736 . 0 0 "[ . 1 . 2]" 1
1149 1 74 ALA MB 1 127 PHE QB . . 5.040 4.380 4.195 4.545 . 0 0 "[ . 1 . 2]" 1
1150 1 74 ALA MB 1 127 PHE QD . . 3.400 3.322 3.009 3.451 0.051 14 0 "[ . 1 . 2]" 1
1151 1 74 ALA MB 1 127 PHE QE . . 3.790 3.776 3.085 3.862 0.072 17 0 "[ . 1 . 2]" 1
1152 1 75 SER H 1 75 SER QB . . 3.700 2.672 2.553 2.771 . 0 0 "[ . 1 . 2]" 1
1153 1 75 SER H 1 76 SER H . . 3.680 2.621 2.536 2.803 . 0 0 "[ . 1 . 2]" 1
1154 1 75 SER H 1 123 LEU QD . . 4.400 4.209 3.751 4.521 0.121 14 0 "[ . 1 . 2]" 1
1155 1 75 SER H 1 127 PHE QD . . 4.930 3.953 3.457 4.330 . 0 0 "[ . 1 . 2]" 1
1156 1 75 SER HA 1 78 ALA MB . . 3.920 2.164 2.032 2.289 . 0 0 "[ . 1 . 2]" 1
1157 1 75 SER HA 1 127 PHE HB2 . . 4.740 2.687 2.450 2.909 . 0 0 "[ . 1 . 2]" 1
1158 1 75 SER HA 1 127 PHE QB . . 4.630 2.509 2.297 2.686 . 0 0 "[ . 1 . 2]" 1
1159 1 75 SER HA 1 127 PHE QD . . 4.030 3.024 2.647 3.513 . 0 0 "[ . 1 . 2]" 1
1160 1 75 SER QB 1 76 SER H . . 4.080 3.452 2.883 3.717 . 0 0 "[ . 1 . 2]" 1
1161 1 75 SER QB 1 78 ALA MB . . 4.230 3.405 3.134 3.590 . 0 0 "[ . 1 . 2]" 1
1162 1 75 SER QB 1 127 PHE QB . . 2.670 2.770 2.707 2.826 0.156 15 0 "[ . 1 . 2]" 1
1163 1 75 SER QB 1 127 PHE HB3 . . 2.710 2.960 2.889 3.039 0.329 14 0 "[ . 1 . 2]" 1
1164 1 75 SER QB 1 127 PHE QD . . 4.470 2.686 2.257 3.417 . 0 0 "[ . 1 . 2]" 1
1165 1 75 SER QB 1 127 PHE QE . . 4.270 3.352 2.971 4.194 . 0 0 "[ . 1 . 2]" 1
1166 1 76 SER H 1 76 SER HB2 . . 3.850 2.952 2.471 3.643 . 0 0 "[ . 1 . 2]" 1
1167 1 76 SER H 1 76 SER QB . . 3.570 2.534 2.430 2.682 . 0 0 "[ . 1 . 2]" 1
1168 1 76 SER H 1 77 MET H . . 3.830 2.662 2.572 2.739 . 0 0 "[ . 1 . 2]" 1
1169 1 76 SER HA 1 79 GLU H . . 4.470 3.515 3.264 3.839 . 0 0 "[ . 1 . 2]" 1
1170 1 76 SER HA 1 79 GLU QB . . 3.860 3.325 2.981 3.906 0.046 9 0 "[ . 1 . 2]" 1
1171 1 76 SER HA 1 79 GLU QG . . 4.510 2.859 2.349 3.247 . 0 0 "[ . 1 . 2]" 1
1172 1 76 SER HA 1 79 GLU HG3 . . 4.610 2.963 2.559 3.473 . 0 0 "[ . 1 . 2]" 1
1173 1 76 SER QB 1 77 MET H . . 4.010 2.906 2.505 3.423 . 0 0 "[ . 1 . 2]" 1
1174 1 76 SER HB2 1 77 MET H . . 4.080 3.045 2.558 3.824 . 0 0 "[ . 1 . 2]" 1
1175 1 77 MET H 1 77 MET QB . . 3.520 2.416 2.342 2.463 . 0 0 "[ . 1 . 2]" 1
1176 1 77 MET H 1 77 MET HB3 . . 3.770 3.552 2.460 3.620 . 0 0 "[ . 1 . 2]" 1
1177 1 77 MET H 1 77 MET ME . . 3.800 3.396 2.977 3.557 . 0 0 "[ . 1 . 2]" 1
1178 1 77 MET H 1 77 MET HG2 . . 4.350 3.542 2.379 4.114 . 0 0 "[ . 1 . 2]" 1
1179 1 77 MET H 1 77 MET QG . . 3.610 2.461 2.242 3.267 . 0 0 "[ . 1 . 2]" 1
1180 1 77 MET H 1 77 MET HG3 . . 3.850 2.570 2.274 3.517 . 0 0 "[ . 1 . 2]" 1
1181 1 77 MET H 1 78 ALA H . . 3.490 2.474 2.369 2.578 . 0 0 "[ . 1 . 2]" 1
1182 1 77 MET H 1 78 ALA MB . . 4.500 4.145 4.029 4.261 . 0 0 "[ . 1 . 2]" 1
1183 1 77 MET H 1 79 GLU H . . 4.410 4.216 4.033 4.376 . 0 0 "[ . 1 . 2]" 1
1184 1 77 MET H 1 80 ILE MD . . 5.050 4.647 4.208 5.040 . 0 0 "[ . 1 . 2]" 1
1185 1 77 MET HA 1 77 MET HG2 . . 4.090 2.742 2.462 3.805 . 0 0 "[ . 1 . 2]" 1
1186 1 77 MET HA 1 77 MET HG3 . . 4.050 3.005 2.291 3.686 . 0 0 "[ . 1 . 2]" 1
1187 1 77 MET HA 1 80 ILE H . . 4.090 3.402 3.231 3.595 . 0 0 "[ . 1 . 2]" 1
1188 1 77 MET HA 1 80 ILE MD . . 3.210 2.450 2.115 2.805 . 0 0 "[ . 1 . 2]" 1
1189 1 77 MET QB 1 78 ALA H . . 4.000 2.760 2.608 3.589 . 0 0 "[ . 1 . 2]" 1
1190 1 77 MET QB 1 97 ILE MD . . 2.960 2.351 2.051 2.809 . 0 0 "[ . 1 . 2]" 1
1191 1 77 MET HB2 1 77 MET ME . . 3.060 2.045 1.893 2.995 . 0 0 "[ . 1 . 2]" 1
1192 1 77 MET HB2 1 78 ALA H . . 4.700 2.852 2.666 4.079 . 0 0 "[ . 1 . 2]" 1
1193 1 77 MET HB2 1 97 ILE MD . . 3.180 3.090 2.291 3.531 0.351 4 0 "[ . 1 . 2]" 1
1194 1 77 MET HB3 1 77 MET ME . . 3.040 2.891 2.086 3.186 0.146 13 0 "[ . 1 . 2]" 1
1195 1 77 MET HB3 1 78 ALA H . . 4.330 3.768 3.669 3.982 . 0 0 "[ . 1 . 2]" 1
1196 1 77 MET HB3 1 97 ILE MD . . 3.530 2.490 2.107 3.473 . 0 0 "[ . 1 . 2]" 1
1197 1 77 MET ME 1 77 MET QG . . 3.270 2.443 2.407 2.470 . 0 0 "[ . 1 . 2]" 1
1198 1 77 MET ME 1 77 MET HG3 . . 3.350 2.689 2.491 3.396 0.046 16 0 "[ . 1 . 2]" 1
1199 1 77 MET ME 1 120 ILE MG . . 2.910 2.198 2.001 2.445 . 0 0 "[ . 1 . 2]" 1
1200 1 77 MET QG 1 80 ILE MD . . 4.940 3.476 2.936 4.811 . 0 0 "[ . 1 . 2]" 1
1201 1 77 MET HG3 1 80 ILE MD . . 5.070 4.415 2.985 5.378 0.308 16 0 "[ . 1 . 2]" 1
1202 1 78 ALA H 1 78 ALA MB . . 3.080 2.223 2.203 2.244 . 0 0 "[ . 1 . 2]" 1
1203 1 78 ALA H 1 79 GLU H . . 3.590 2.719 2.578 2.812 . 0 0 "[ . 1 . 2]" 1
1204 1 78 ALA H 1 124 VAL MG1 . . 3.940 3.511 3.198 4.062 0.122 14 0 "[ . 1 . 2]" 1
1205 1 78 ALA H 1 124 VAL QG . . 3.790 3.194 2.963 3.528 . 0 0 "[ . 1 . 2]" 1
1206 1 78 ALA H 1 124 VAL MG2 . . 4.900 3.708 3.439 3.972 . 0 0 "[ . 1 . 2]" 1
1207 1 78 ALA HA 1 124 VAL MG1 . . 3.140 2.389 2.049 2.677 . 0 0 "[ . 1 . 2]" 1
1208 1 78 ALA HA 1 124 VAL QG . . 3.080 2.374 2.039 2.653 . 0 0 "[ . 1 . 2]" 1
1209 1 78 ALA HA 1 124 VAL MG2 . . 4.470 4.135 3.683 4.507 0.037 13 0 "[ . 1 . 2]" 1
1210 1 78 ALA HA 1 128 ALA HA . . 4.500 3.882 3.351 4.360 . 0 0 "[ . 1 . 2]" 1
1211 1 78 ALA HA 1 128 ALA MB . . 3.990 2.721 2.350 3.268 . 0 0 "[ . 1 . 2]" 1
1212 1 78 ALA MB 1 79 GLU H . . 3.790 2.511 2.343 2.653 . 0 0 "[ . 1 . 2]" 1
1213 1 78 ALA MB 1 79 GLU QG . . 5.070 3.267 3.074 3.421 . 0 0 "[ . 1 . 2]" 1
1214 1 78 ALA MB 1 79 GLU HG3 . . 5.210 3.786 3.235 5.040 . 0 0 "[ . 1 . 2]" 1
1215 1 78 ALA MB 1 124 VAL HA . . 3.280 1.981 1.840 2.213 . 0 0 "[ . 1 . 2]" 1
1216 1 78 ALA MB 1 124 VAL MG1 . . 3.340 2.630 2.369 2.845 . 0 0 "[ . 1 . 2]" 1
1217 1 78 ALA MB 1 124 VAL QG . . 3.210 2.519 2.287 2.656 . 0 0 "[ . 1 . 2]" 1
1218 1 78 ALA MB 1 124 VAL MG2 . . 4.160 3.264 2.946 3.502 . 0 0 "[ . 1 . 2]" 1
1219 1 78 ALA MB 1 127 PHE HB2 . . 3.480 2.440 2.336 2.562 . 0 0 "[ . 1 . 2]" 1
1220 1 78 ALA MB 1 127 PHE HB3 . . 3.410 2.710 2.506 3.013 . 0 0 "[ . 1 . 2]" 1
1221 1 78 ALA MB 1 127 PHE QD . . 4.510 3.673 3.561 3.860 . 0 0 "[ . 1 . 2]" 1
1222 1 78 ALA MB 1 128 ALA H . . 3.440 2.447 2.336 2.628 . 0 0 "[ . 1 . 2]" 1
1223 1 78 ALA MB 1 128 ALA HA . . 3.770 2.420 2.189 2.770 . 0 0 "[ . 1 . 2]" 1
1224 1 79 GLU H 1 79 GLU QB . . 3.070 2.486 2.412 2.575 . 0 0 "[ . 1 . 2]" 1
1225 1 79 GLU H 1 79 GLU HG2 . . 3.980 2.946 1.924 3.382 . 0 0 "[ . 1 . 2]" 1
1226 1 79 GLU H 1 79 GLU QG . . 3.460 2.095 1.912 2.232 . 0 0 "[ . 1 . 2]" 1
1227 1 79 GLU H 1 79 GLU HG3 . . 3.800 2.461 2.026 3.530 . 0 0 "[ . 1 . 2]" 1
1228 1 79 GLU H 1 80 ILE H . . 3.650 2.694 2.538 2.788 . 0 0 "[ . 1 . 2]" 1
1229 1 79 GLU H 1 80 ILE MD . . 5.500 5.168 4.896 5.430 . 0 0 "[ . 1 . 2]" 1
1230 1 79 GLU HA 1 79 GLU HG2 . . 3.870 2.628 2.454 3.036 . 0 0 "[ . 1 . 2]" 1
1231 1 79 GLU HA 1 79 GLU HG3 . . 3.770 3.314 3.017 3.835 0.065 11 0 "[ . 1 . 2]" 1
1232 1 79 GLU HA 1 82 ALA MB . . 3.400 2.762 2.281 3.366 . 0 0 "[ . 1 . 2]" 1
1233 1 79 GLU QB 1 80 ILE H . . 3.980 2.534 2.327 2.854 . 0 0 "[ . 1 . 2]" 1
1234 1 79 GLU QB 1 80 ILE MG . . 5.160 4.990 4.873 5.197 0.037 17 0 "[ . 1 . 2]" 1
1235 1 79 GLU QB 1 81 ALA H . . 5.170 4.744 4.512 4.921 . 0 0 "[ . 1 . 2]" 1
1236 1 79 GLU HG2 1 80 ILE H . . 4.830 4.722 4.148 4.915 0.085 16 0 "[ . 1 . 2]" 1
1237 1 79 GLU HG3 1 80 ILE H . . 4.760 4.333 4.089 4.838 0.078 11 0 "[ . 1 . 2]" 1
1238 1 80 ILE H 1 80 ILE HB . . 3.170 2.514 2.410 2.695 . 0 0 "[ . 1 . 2]" 1
1239 1 80 ILE H 1 80 ILE MD . . 3.560 3.519 3.438 3.624 0.064 11 0 "[ . 1 . 2]" 1
1240 1 80 ILE H 1 80 ILE HG12 . . 3.840 3.404 2.993 3.688 . 0 0 "[ . 1 . 2]" 1
1241 1 80 ILE H 1 80 ILE QG . . 3.310 2.089 1.805 2.379 . 0 0 "[ . 1 . 2]" 1
1242 1 80 ILE H 1 80 ILE HG13 . . 3.620 2.109 1.820 2.409 . 0 0 "[ . 1 . 2]" 1
1243 1 80 ILE H 1 80 ILE MG . . 4.150 3.758 3.734 3.778 . 0 0 "[ . 1 . 2]" 1
1244 1 80 ILE H 1 81 ALA H . . 3.400 2.568 2.325 2.746 . 0 0 "[ . 1 . 2]" 1
1245 1 80 ILE HA 1 80 ILE HG12 . . 3.720 2.566 2.453 2.656 . 0 0 "[ . 1 . 2]" 1
1246 1 80 ILE HA 1 80 ILE QG . . 3.360 2.428 2.356 2.505 . 0 0 "[ . 1 . 2]" 1
1247 1 80 ILE HA 1 80 ILE HG13 . . 3.830 3.001 2.906 3.190 . 0 0 "[ . 1 . 2]" 1
1248 1 80 ILE HA 1 80 ILE MG . . 2.900 2.383 2.311 2.438 . 0 0 "[ . 1 . 2]" 1
1249 1 80 ILE HB 1 80 ILE MD . . 3.140 2.397 2.374 2.444 . 0 0 "[ . 1 . 2]" 1
1250 1 80 ILE HB 1 81 ALA H . . 3.480 2.461 2.303 2.603 . 0 0 "[ . 1 . 2]" 1
1251 1 80 ILE HB 1 82 ALA H . . 4.660 4.736 4.695 4.823 0.163 20 0 "[ . 1 . 2]" 1
1252 1 80 ILE MD 1 80 ILE MG . . 2.940 1.944 1.856 2.000 . 0 0 "[ . 1 . 2]" 1
1253 1 80 ILE MD 1 81 ALA H . . 4.380 4.406 4.305 4.535 0.155 6 0 "[ . 1 . 2]" 1
1254 1 80 ILE MG 1 81 ALA H . . 4.140 3.369 3.200 3.598 . 0 0 "[ . 1 . 2]" 1
1255 1 81 ALA H 1 81 ALA MB . . 3.020 2.228 2.210 2.245 . 0 0 "[ . 1 . 2]" 1
1256 1 81 ALA H 1 82 ALA H . . 3.310 2.615 2.516 2.693 . 0 0 "[ . 1 . 2]" 1
1257 1 81 ALA H 1 82 ALA MB . . 4.490 4.297 4.194 4.387 . 0 0 "[ . 1 . 2]" 1
1258 1 81 ALA H 1 83 SER H . . 4.410 4.180 3.974 4.404 . 0 0 "[ . 1 . 2]" 1
1259 1 81 ALA HA 1 82 ALA H . . 3.570 3.465 3.399 3.526 . 0 0 "[ . 1 . 2]" 1
1260 1 81 ALA HA 1 83 SER H . . 4.530 3.837 3.290 4.539 0.009 8 0 "[ . 1 . 2]" 1
1261 1 81 ALA HA 1 93 LYS QD . . 4.150 2.676 1.840 4.329 0.179 17 0 "[ . 1 . 2]" 1
1262 1 81 ALA HA 1 93 LYS HD3 . . 4.230 3.018 1.865 4.890 0.660 3 2 "[ + . 1 . - 2]" 1
1263 1 81 ALA HA 1 93 LYS QE . . 3.530 2.531 2.164 2.897 . 0 0 "[ . 1 . 2]" 1
1264 1 81 ALA MB 1 82 ALA H . . 3.420 2.845 2.655 3.076 . 0 0 "[ . 1 . 2]" 1
1265 1 81 ALA MB 1 82 ALA HA . . 4.890 3.926 3.785 4.053 . 0 0 "[ . 1 . 2]" 1
1266 1 81 ALA MB 1 83 SER H . . 4.750 4.394 4.133 4.680 . 0 0 "[ . 1 . 2]" 1
1267 1 81 ALA MB 1 90 LEU QD . . 3.180 2.223 1.884 2.789 . 0 0 "[ . 1 . 2]" 1
1268 1 81 ALA MB 1 93 LYS QE . . 4.300 3.110 1.959 3.924 . 0 0 "[ . 1 . 2]" 1
1269 1 81 ALA MB 1 93 LYS QG . . 4.900 3.833 3.513 4.412 . 0 0 "[ . 1 . 2]" 1
1270 1 81 ALA MB 1 93 LYS HG3 . . 5.030 4.426 4.102 5.081 0.051 17 0 "[ . 1 . 2]" 1
1271 1 81 ALA MB 1 97 ILE MD . . 3.860 2.965 2.342 3.402 . 0 0 "[ . 1 . 2]" 1
1272 1 81 ALA MB 1 132 MET ME . . 4.740 4.294 3.867 4.722 . 0 0 "[ . 1 . 2]" 1
1273 1 82 ALA H 1 82 ALA MB . . 2.760 2.251 2.226 2.308 . 0 0 "[ . 1 . 2]" 1
1274 1 82 ALA H 1 83 SER H . . 3.180 2.545 2.320 2.659 . 0 0 "[ . 1 . 2]" 1
1275 1 82 ALA H 1 90 LEU QD . . 4.330 4.049 3.031 4.358 0.028 9 0 "[ . 1 . 2]" 1
1276 1 82 ALA HA 1 90 LEU HB2 . . 4.750 4.391 3.059 4.891 0.141 9 0 "[ . 1 . 2]" 1
1277 1 82 ALA HA 1 90 LEU QB . . 4.640 4.274 3.010 4.694 0.054 9 0 "[ . 1 . 2]" 1
1278 1 82 ALA HA 1 90 LEU QD . . 3.790 3.210 2.093 3.776 . 0 0 "[ . 1 . 2]" 1
1279 1 82 ALA HA 1 132 MET ME . . 5.060 1.965 1.832 2.233 . 0 0 "[ . 1 . 2]" 1
1280 1 82 ALA HA 1 132 MET HG2 . . 4.540 3.597 2.287 4.488 . 0 0 "[ . 1 . 2]" 1
1281 1 82 ALA HA 1 132 MET QG . . 3.940 3.226 2.239 3.921 . 0 0 "[ . 1 . 2]" 1
1282 1 82 ALA HA 1 132 MET HG3 . . 4.330 3.751 3.115 4.723 0.393 19 0 "[ . 1 . 2]" 1
1283 1 82 ALA MB 1 83 SER H . . 3.670 2.938 2.454 3.371 . 0 0 "[ . 1 . 2]" 1
1284 1 82 ALA MB 1 83 SER HA . . 4.260 3.946 3.769 4.127 . 0 0 "[ . 1 . 2]" 1
1285 1 82 ALA MB 1 83 SER HB2 . . 5.030 4.121 3.670 4.652 . 0 0 "[ . 1 . 2]" 1
1286 1 82 ALA MB 1 83 SER QB . . 4.900 3.914 3.510 4.372 . 0 0 "[ . 1 . 2]" 1
1287 1 82 ALA MB 1 132 MET ME . . 3.060 2.638 2.030 3.098 0.038 19 0 "[ . 1 . 2]" 1
1288 1 82 ALA MB 1 132 MET HG2 . . 3.980 2.701 1.996 3.838 . 0 0 "[ . 1 . 2]" 1
1289 1 82 ALA MB 1 132 MET QG . . 3.600 2.277 1.907 3.512 . 0 0 "[ . 1 . 2]" 1
1290 1 82 ALA MB 1 132 MET HG3 . . 4.120 2.535 2.021 4.178 0.058 19 0 "[ . 1 . 2]" 1
1291 1 83 SER H 1 83 SER HB2 . . 3.010 2.620 2.326 3.033 0.023 11 0 "[ . 1 . 2]" 1
1292 1 83 SER H 1 83 SER HB3 . . 3.060 2.633 2.521 3.493 0.433 3 0 "[ . 1 . 2]" 1
1293 1 83 SER H 1 84 GLU H . . 3.720 3.613 2.478 4.037 0.317 16 0 "[ . 1 . 2]" 1
1294 1 83 SER H 1 132 MET ME . . 4.570 4.636 4.409 4.767 0.197 12 0 "[ . 1 . 2]" 1
1295 1 83 SER HA 1 84 GLU H . . 3.290 2.475 2.043 3.513 0.223 14 0 "[ . 1 . 2]" 1
1296 1 84 GLU H 1 84 GLU HB2 . . 3.750 2.992 2.109 3.629 . 0 0 "[ . 1 . 2]" 1
1297 1 84 GLU H 1 84 GLU QB . . 3.490 2.601 2.090 3.278 . 0 0 "[ . 1 . 2]" 1
1298 1 84 GLU H 1 84 GLU HB3 . . 4.150 3.270 2.452 3.986 . 0 0 "[ . 1 . 2]" 1
1299 1 84 GLU H 1 84 GLU QG . . 3.770 2.508 1.769 4.063 0.293 20 0 "[ . 1 . 2]" 1
1300 1 84 GLU H 1 85 GLU H . . 4.760 3.310 2.399 4.583 . 0 0 "[ . 1 . 2]" 1
1301 1 84 GLU HA 1 84 GLU HB2 . . 2.980 2.747 2.397 3.022 0.042 14 0 "[ . 1 . 2]" 1
1302 1 84 GLU HA 1 84 GLU HB3 . . 2.970 2.535 2.323 3.013 0.043 20 0 "[ . 1 . 2]" 1
1303 1 84 GLU HA 1 85 GLU H . . 3.300 2.763 2.054 3.516 0.216 16 0 "[ . 1 . 2]" 1
1304 1 84 GLU QB 1 84 GLU QG . . 2.310 2.065 2.001 2.086 . 0 0 "[ . 1 . 2]" 1
1305 1 84 GLU HB2 1 84 GLU QG . . 2.470 2.300 2.144 2.415 . 0 0 "[ . 1 . 2]" 1
1306 1 84 GLU HB3 1 84 GLU QG . . 2.790 2.347 2.252 2.433 . 0 0 "[ . 1 . 2]" 1
1307 1 84 GLU QG 1 85 GLU H . . 4.140 3.882 2.474 4.365 0.225 6 0 "[ . 1 . 2]" 1
1308 1 85 GLU H 1 85 GLU QB . . 3.260 2.528 2.168 3.033 . 0 0 "[ . 1 . 2]" 1
1309 1 85 GLU H 1 85 GLU QG . . 4.260 2.786 1.755 4.365 0.105 20 0 "[ . 1 . 2]" 1
1310 1 85 GLU HA 1 85 GLU QG . . 3.150 2.731 2.323 3.303 0.153 11 0 "[ . 1 . 2]" 1
1311 1 85 GLU HA 1 86 GLY H . . 3.520 2.924 2.135 3.551 0.031 14 0 "[ . 1 . 2]" 1
1312 1 85 GLU QB 1 86 GLY H . . 4.740 2.968 2.002 3.953 . 0 0 "[ . 1 . 2]" 1
1313 1 86 GLY H 1 87 GLY H . . 4.630 3.234 1.779 4.407 . 0 0 "[ . 1 . 2]" 1
1314 1 87 GLY H 1 88 GLY H . . 4.410 3.497 2.110 4.544 0.134 5 0 "[ . 1 . 2]" 1
1315 1 89 SER HA 1 92 THR H . . 5.160 4.583 3.897 5.124 . 0 0 "[ . 1 . 2]" 1
1316 1 89 SER QB 1 90 LEU H . . 4.450 3.163 2.026 4.023 . 0 0 "[ . 1 . 2]" 1
1317 1 89 SER HB3 1 90 LEU H . . 4.550 3.564 2.044 4.442 . 0 0 "[ . 1 . 2]" 1
1318 1 90 LEU H 1 90 LEU HG . . 4.750 4.456 4.293 4.597 . 0 0 "[ . 1 . 2]" 1
1319 1 90 LEU HA 1 90 LEU QD . . 2.870 2.204 1.926 3.026 0.156 2 0 "[ . 1 . 2]" 1
1320 1 90 LEU HA 1 90 LEU HG . . 3.860 3.146 2.367 3.684 . 0 0 "[ . 1 . 2]" 1
1321 1 90 LEU HA 1 92 THR H . . 4.290 4.104 3.682 4.345 0.055 1 0 "[ . 1 . 2]" 1
1322 1 90 LEU HA 1 93 LYS H . . 4.050 3.128 2.784 3.359 . 0 0 "[ . 1 . 2]" 1
1323 1 90 LEU HA 1 93 LYS HB2 . . 4.730 2.377 1.929 3.064 . 0 0 "[ . 1 . 2]" 1
1324 1 90 LEU HA 1 93 LYS QB . . 4.620 2.359 1.921 3.030 . 0 0 "[ . 1 . 2]" 1
1325 1 90 LEU QD 1 93 LYS QG . . 5.150 3.911 3.231 4.514 . 0 0 "[ . 1 . 2]" 1
1326 1 90 LEU QD 1 93 LYS HG3 . . 5.360 4.168 3.375 4.761 . 0 0 "[ . 1 . 2]" 1
1327 1 90 LEU QD 1 94 THR H . . 4.090 3.218 2.299 3.984 . 0 0 "[ . 1 . 2]" 1
1328 1 90 LEU QD 1 94 THR MG . . 2.910 2.583 1.750 3.006 0.096 6 0 "[ . 1 . 2]" 1
1329 1 90 LEU QD 1 125 SER HA . . 3.560 2.406 1.836 3.273 . 0 0 "[ . 1 . 2]" 1
1330 1 90 LEU QD 1 128 ALA MB . . 2.780 1.972 1.763 2.271 . 0 0 "[ . 1 . 2]" 1
1331 1 90 LEU QD 1 129 GLN H . . 4.170 3.595 3.168 4.184 0.014 2 0 "[ . 1 . 2]" 1
1332 1 90 LEU QD 1 129 GLN HE21 . . 4.230 2.563 1.901 4.117 . 0 0 "[ . 1 . 2]" 1
1333 1 90 LEU QD 1 129 GLN QE . . 3.820 2.452 1.890 3.591 . 0 0 "[ . 1 . 2]" 1
1334 1 90 LEU QD 1 129 GLN HE22 . . 4.620 3.443 2.284 4.131 . 0 0 "[ . 1 . 2]" 1
1335 1 90 LEU QD 1 129 GLN HG2 . . 4.100 2.954 2.439 3.826 . 0 0 "[ . 1 . 2]" 1
1336 1 90 LEU QD 1 129 GLN QG . . 3.610 2.687 2.085 3.688 0.078 2 0 "[ . 1 . 2]" 1
1337 1 90 LEU QD 1 129 GLN HG3 . . 4.060 3.356 2.195 4.830 0.770 2 1 "[ + . 1 . 2]" 1
1338 1 90 LEU QD 1 132 MET ME . . 3.130 2.232 1.830 3.095 . 0 0 "[ . 1 . 2]" 1
1339 1 90 LEU HG 1 94 THR H . . 5.120 4.340 3.702 5.337 0.217 3 0 "[ . 1 . 2]" 1
1340 1 91 SER H 1 92 THR H . . 5.030 2.718 2.537 2.838 . 0 0 "[ . 1 . 2]" 1
1341 1 92 THR H 1 92 THR HB . . 3.300 2.619 2.543 2.735 . 0 0 "[ . 1 . 2]" 1
1342 1 92 THR H 1 92 THR MG . . 4.140 3.762 3.726 3.797 . 0 0 "[ . 1 . 2]" 1
1343 1 92 THR H 1 93 LYS H . . 3.850 2.448 2.265 2.640 . 0 0 "[ . 1 . 2]" 1
1344 1 92 THR H 1 94 THR H . . 4.780 4.268 4.008 4.558 . 0 0 "[ . 1 . 2]" 1
1345 1 92 THR HA 1 92 THR MG . . 2.880 2.324 2.252 2.392 . 0 0 "[ . 1 . 2]" 1
1346 1 92 THR HB 1 93 LYS H . . 3.360 2.707 2.509 2.977 . 0 0 "[ . 1 . 2]" 1
1347 1 92 THR MG 1 93 LYS H . . 3.760 3.741 3.521 3.884 0.124 10 0 "[ . 1 . 2]" 1
1348 1 92 THR MG 1 93 LYS QG . . 4.900 4.033 3.288 4.461 . 0 0 "[ . 1 . 2]" 1
1349 1 92 THR MG 1 93 LYS HG3 . . 5.030 4.436 3.906 4.882 . 0 0 "[ . 1 . 2]" 1
1350 1 93 LYS H 1 93 LYS HB2 . . 3.910 2.393 2.257 2.509 . 0 0 "[ . 1 . 2]" 1
1351 1 93 LYS H 1 93 LYS QB . . 3.600 2.359 2.231 2.466 . 0 0 "[ . 1 . 2]" 1
1352 1 93 LYS H 1 93 LYS HG2 . . 4.880 3.562 3.216 3.858 . 0 0 "[ . 1 . 2]" 1
1353 1 93 LYS H 1 93 LYS QG . . 3.950 2.419 2.219 2.543 . 0 0 "[ . 1 . 2]" 1
1354 1 93 LYS H 1 93 LYS HG3 . . 4.170 2.463 2.250 2.620 . 0 0 "[ . 1 . 2]" 1
1355 1 93 LYS H 1 94 THR H . . 3.050 2.710 2.449 2.893 . 0 0 "[ . 1 . 2]" 1
1356 1 93 LYS HA 1 93 LYS QD . . 4.680 3.944 3.735 4.148 . 0 0 "[ . 1 . 2]" 1
1357 1 93 LYS HA 1 93 LYS HD3 . . 4.790 4.419 4.188 4.738 . 0 0 "[ . 1 . 2]" 1
1358 1 93 LYS HA 1 93 LYS HG2 . . 3.900 2.483 2.359 2.665 . 0 0 "[ . 1 . 2]" 1
1359 1 93 LYS HA 1 93 LYS HG3 . . 3.870 3.008 2.667 3.333 . 0 0 "[ . 1 . 2]" 1
1360 1 93 LYS HA 1 94 THR HA . . 4.880 4.771 4.695 4.877 . 0 0 "[ . 1 . 2]" 1
1361 1 93 LYS QB 1 93 LYS QE . . 4.150 3.123 2.075 3.615 . 0 0 "[ . 1 . 2]" 1
1362 1 93 LYS HB2 1 93 LYS QE . . 4.680 3.600 2.147 4.228 . 0 0 "[ . 1 . 2]" 1
1363 1 93 LYS HB2 1 94 THR H . . 4.120 2.636 2.429 3.084 . 0 0 "[ . 1 . 2]" 1
1364 1 93 LYS HB3 1 93 LYS QE . . 4.900 3.471 2.244 3.940 . 0 0 "[ . 1 . 2]" 1
1365 1 93 LYS HB3 1 94 THR H . . 4.070 3.498 3.109 4.036 . 0 0 "[ . 1 . 2]" 1
1366 1 93 LYS QE 1 93 LYS HG2 . . 3.680 2.673 2.234 3.507 . 0 0 "[ . 1 . 2]" 1
1367 1 93 LYS QE 1 93 LYS QG . . 3.200 2.412 2.124 2.848 . 0 0 "[ . 1 . 2]" 1
1368 1 94 THR H 1 94 THR HB . . 3.940 3.207 2.536 3.597 . 0 0 "[ . 1 . 2]" 1
1369 1 94 THR H 1 94 THR MG . . 3.600 2.368 1.860 3.622 0.022 9 0 "[ . 1 . 2]" 1
1370 1 94 THR H 1 95 SER H . . 3.200 2.714 2.578 2.843 . 0 0 "[ . 1 . 2]" 1
1371 1 94 THR HA 1 97 ILE H . . 4.530 3.700 3.349 4.051 . 0 0 "[ . 1 . 2]" 1
1372 1 94 THR HA 1 97 ILE HB . . 3.850 3.446 2.821 3.856 0.006 17 0 "[ . 1 . 2]" 1
1373 1 94 THR HA 1 97 ILE MD . . 3.500 2.749 2.212 3.427 . 0 0 "[ . 1 . 2]" 1
1374 1 94 THR MG 1 95 SER H . . 4.200 3.444 2.076 4.139 . 0 0 "[ . 1 . 2]" 1
1375 1 95 SER H 1 95 SER HB2 . . 3.150 2.521 2.465 2.587 . 0 0 "[ . 1 . 2]" 1
1376 1 95 SER H 1 95 SER QB . . 2.900 2.471 2.425 2.526 . 0 0 "[ . 1 . 2]" 1
1377 1 95 SER H 1 95 SER HB3 . . 3.390 3.549 3.525 3.598 0.208 6 0 "[ . 1 . 2]" 1
1378 1 95 SER H 1 96 SER H . . 3.240 2.507 2.228 2.689 . 0 0 "[ . 1 . 2]" 1
1379 1 95 SER HA 1 95 SER HB3 . . 2.930 2.425 2.403 2.444 . 0 0 "[ . 1 . 2]" 1
1380 1 95 SER HA 1 98 ALA H . . 4.000 3.626 3.391 3.849 . 0 0 "[ . 1 . 2]" 1
1381 1 95 SER HA 1 98 ALA MB . . 3.080 2.991 2.704 3.165 0.085 14 0 "[ . 1 . 2]" 1
1382 1 95 SER QB 1 96 SER H . . 3.450 2.680 2.439 2.939 . 0 0 "[ . 1 . 2]" 1
1383 1 95 SER QB 1 98 ALA MB . . 4.740 4.301 3.965 4.531 . 0 0 "[ . 1 . 2]" 1
1384 1 95 SER HB3 1 96 SER H . . 3.500 3.852 3.653 4.074 0.574 9 2 "[ . +1 . - 2]" 1
1385 1 95 SER HB3 1 98 ALA MB . . 4.860 4.531 4.125 4.821 . 0 0 "[ . 1 . 2]" 1
1386 1 96 SER H 1 96 SER QB . . 3.450 2.423 2.176 2.836 . 0 0 "[ . 1 . 2]" 1
1387 1 97 ILE H 1 97 ILE HB . . 3.480 2.566 2.491 2.624 . 0 0 "[ . 1 . 2]" 1
1388 1 97 ILE H 1 97 ILE MD . . 3.670 3.564 3.448 3.624 . 0 0 "[ . 1 . 2]" 1
1389 1 97 ILE H 1 97 ILE QG . . 4.400 2.046 1.937 2.206 . 0 0 "[ . 1 . 2]" 1
1390 1 97 ILE H 1 97 ILE HG13 . . 4.500 2.065 1.953 2.230 . 0 0 "[ . 1 . 2]" 1
1391 1 97 ILE HA 1 97 ILE MD . . 3.830 3.827 3.808 3.845 0.015 20 0 "[ . 1 . 2]" 1
1392 1 97 ILE HA 1 97 ILE MG . . 3.400 2.409 2.361 2.497 . 0 0 "[ . 1 . 2]" 1
1393 1 97 ILE HA 1 100 ALA H . . 4.450 3.672 3.544 3.958 . 0 0 "[ . 1 . 2]" 1
1394 1 97 ILE HA 1 100 ALA MB . . 4.290 2.877 2.653 3.208 . 0 0 "[ . 1 . 2]" 1
1395 1 97 ILE HB 1 98 ALA H . . 3.740 2.473 2.381 2.664 . 0 0 "[ . 1 . 2]" 1
1396 1 97 ILE MG 1 98 ALA H . . 3.810 3.322 3.118 3.458 . 0 0 "[ . 1 . 2]" 1
1397 1 97 ILE MG 1 98 ALA HA . . 3.850 3.268 3.056 3.405 . 0 0 "[ . 1 . 2]" 1
1398 1 97 ILE MG 1 99 SER H . . 5.500 4.897 4.733 5.073 . 0 0 "[ . 1 . 2]" 1
1399 1 97 ILE MG 1 101 MET H . . 4.760 3.900 3.779 4.004 . 0 0 "[ . 1 . 2]" 1
1400 1 97 ILE MG 1 101 MET HA . . 4.760 4.882 4.783 4.926 0.166 12 0 "[ . 1 . 2]" 1
1401 1 97 ILE MG 1 101 MET ME . . 3.550 3.134 2.124 3.528 . 0 0 "[ . 1 . 2]" 1
1402 1 97 ILE MG 1 101 MET QG . . 3.900 2.814 2.191 3.938 0.038 16 0 "[ . 1 . 2]" 1
1403 1 97 ILE MG 1 101 MET HG3 . . 3.970 2.894 2.220 4.116 0.146 3 0 "[ . 1 . 2]" 1
1404 1 98 ALA H 1 98 ALA MB . . 2.870 2.232 2.220 2.245 . 0 0 "[ . 1 . 2]" 1
1405 1 98 ALA H 1 99 SER H . . 3.640 2.706 2.599 2.797 . 0 0 "[ . 1 . 2]" 1
1406 1 98 ALA H 1 101 MET ME . . 4.950 4.633 3.962 4.908 . 0 0 "[ . 1 . 2]" 1
1407 1 98 ALA H 1 121 THR MG . . 3.980 3.525 3.150 3.922 . 0 0 "[ . 1 . 2]" 1
1408 1 98 ALA HA 1 101 MET H . . 4.310 3.362 3.226 3.678 . 0 0 "[ . 1 . 2]" 1
1409 1 98 ALA HA 1 101 MET QB . . 3.960 2.423 2.195 2.858 . 0 0 "[ . 1 . 2]" 1
1410 1 98 ALA HA 1 101 MET HB3 . . 4.030 3.752 2.800 4.531 0.501 10 1 "[ . + . 2]" 1
1411 1 98 ALA HA 1 101 MET ME . . 3.310 2.549 2.169 2.731 . 0 0 "[ . 1 . 2]" 1
1412 1 98 ALA HA 1 117 ILE MG . . 3.350 2.720 2.217 3.104 . 0 0 "[ . 1 . 2]" 1
1413 1 98 ALA MB 1 99 SER H . . 3.100 2.678 2.498 2.985 . 0 0 "[ . 1 . 2]" 1
1414 1 98 ALA MB 1 101 MET ME . . 3.260 3.400 3.356 3.432 0.172 17 0 "[ . 1 . 2]" 1
1415 1 98 ALA MB 1 117 ILE MG . . 3.110 2.236 1.949 2.738 . 0 0 "[ . 1 . 2]" 1
1416 1 98 ALA MB 1 121 THR MG . . 3.100 1.915 1.780 2.090 . 0 0 "[ . 1 . 2]" 1
1417 1 99 SER H 1 99 SER QB . . 3.110 2.349 2.238 2.701 . 0 0 "[ . 1 . 2]" 1
1418 1 99 SER H 1 100 ALA H . . 3.430 2.512 2.282 2.613 . 0 0 "[ . 1 . 2]" 1
1419 1 99 SER HA 1 99 SER QB . . 2.430 2.349 2.167 2.416 . 0 0 "[ . 1 . 2]" 1
1420 1 99 SER QB 1 100 ALA H . . 3.260 2.673 2.528 3.142 . 0 0 "[ . 1 . 2]" 1
1421 1 100 ALA H 1 100 ALA MB . . 3.130 2.246 2.231 2.268 . 0 0 "[ . 1 . 2]" 1
1422 1 100 ALA HA 1 103 ASN H . . 4.470 3.561 3.332 3.734 . 0 0 "[ . 1 . 2]" 1
1423 1 100 ALA HA 1 103 ASN QB . . 3.130 2.467 2.334 2.639 . 0 0 "[ . 1 . 2]" 1
1424 1 100 ALA HA 1 103 ASN HD21 . . 4.430 3.159 3.008 3.348 . 0 0 "[ . 1 . 2]" 1
1425 1 100 ALA HA 1 103 ASN QD . . 4.090 3.119 2.969 3.289 . 0 0 "[ . 1 . 2]" 1
1426 1 100 ALA HA 1 103 ASN HD22 . . 4.800 4.823 4.556 4.909 0.109 17 0 "[ . 1 . 2]" 1
1427 1 100 ALA MB 1 101 MET H . . 3.970 2.631 2.510 2.713 . 0 0 "[ . 1 . 2]" 1
1428 1 100 ALA MB 1 101 MET QG . . 5.110 3.704 3.303 4.955 . 0 0 "[ . 1 . 2]" 1
1429 1 100 ALA MB 1 101 MET HG3 . . 5.250 3.842 3.453 5.349 0.099 18 0 "[ . 1 . 2]" 1
1430 1 100 ALA MB 1 102 SER H . . 5.280 4.686 4.595 4.758 . 0 0 "[ . 1 . 2]" 1
1431 1 100 ALA MB 1 103 ASN QB . . 4.050 3.856 3.549 4.022 . 0 0 "[ . 1 . 2]" 1
1432 1 101 MET H 1 101 MET HB2 . . 3.610 2.263 2.042 2.446 . 0 0 "[ . 1 . 2]" 1
1433 1 101 MET H 1 101 MET QB . . 3.280 2.227 2.004 2.409 . 0 0 "[ . 1 . 2]" 1
1434 1 101 MET H 1 101 MET HB3 . . 3.770 3.392 2.751 3.612 . 0 0 "[ . 1 . 2]" 1
1435 1 101 MET H 1 101 MET ME . . 4.010 4.061 3.756 4.173 0.163 1 0 "[ . 1 . 2]" 1
1436 1 101 MET H 1 101 MET HG2 . . 4.270 3.960 3.395 4.477 0.207 13 0 "[ . 1 . 2]" 1
1437 1 101 MET H 1 101 MET QG . . 3.630 2.813 2.409 3.825 0.195 18 0 "[ . 1 . 2]" 1
1438 1 101 MET H 1 101 MET HG3 . . 3.930 2.911 2.461 4.203 0.273 18 0 "[ . 1 . 2]" 1
1439 1 101 MET H 1 102 SER H . . 3.530 2.692 2.635 2.801 . 0 0 "[ . 1 . 2]" 1
1440 1 101 MET H 1 117 ILE MD . . 4.520 4.524 4.248 4.621 0.101 3 0 "[ . 1 . 2]" 1
1441 1 101 MET HA 1 101 MET HG2 . . 3.480 2.626 2.317 2.872 . 0 0 "[ . 1 . 2]" 1
1442 1 101 MET HA 1 101 MET QG . . 3.270 2.317 2.148 2.369 . 0 0 "[ . 1 . 2]" 1
1443 1 101 MET HA 1 101 MET HG3 . . 3.980 2.656 2.223 3.171 . 0 0 "[ . 1 . 2]" 1
1444 1 101 MET HA 1 104 ALA H . . 3.920 3.390 3.195 3.639 . 0 0 "[ . 1 . 2]" 1
1445 1 101 MET HA 1 104 ALA MB . . 4.360 2.581 2.396 2.840 . 0 0 "[ . 1 . 2]" 1
1446 1 101 MET HA 1 117 ILE MD . . 5.020 4.615 4.415 4.810 . 0 0 "[ . 1 . 2]" 1
1447 1 101 MET QB 1 101 MET ME . . 3.510 1.939 1.877 2.088 . 0 0 "[ . 1 . 2]" 1
1448 1 101 MET QB 1 117 ILE MD . . 3.760 2.616 2.144 2.753 . 0 0 "[ . 1 . 2]" 1
1449 1 101 MET HB2 1 102 SER H . . 3.940 2.776 2.518 3.579 . 0 0 "[ . 1 . 2]" 1
1450 1 101 MET HB2 1 117 ILE MD . . 4.140 3.197 2.817 4.165 0.025 3 0 "[ . 1 . 2]" 1
1451 1 101 MET HB3 1 101 MET ME . . 3.560 2.188 2.038 2.540 . 0 0 "[ . 1 . 2]" 1
1452 1 101 MET HB3 1 102 SER H . . 3.920 3.164 2.354 3.566 . 0 0 "[ . 1 . 2]" 1
1453 1 101 MET HB3 1 117 ILE MD . . 4.310 2.879 2.160 3.255 . 0 0 "[ . 1 . 2]" 1
1454 1 101 MET ME 1 101 MET QG . . 3.400 2.553 2.455 2.606 . 0 0 "[ . 1 . 2]" 1
1455 1 101 MET ME 1 101 MET HG3 . . 3.500 3.168 2.522 3.389 . 0 0 "[ . 1 . 2]" 1
1456 1 101 MET ME 1 102 SER H . . 5.370 4.128 3.969 4.502 . 0 0 "[ . 1 . 2]" 1
1457 1 101 MET ME 1 117 ILE HA . . 3.630 2.311 2.012 2.977 . 0 0 "[ . 1 . 2]" 1
1458 1 101 MET ME 1 117 ILE MD . . 2.820 2.768 2.492 2.960 0.140 16 0 "[ . 1 . 2]" 1
1459 1 101 MET ME 1 120 ILE MD . . 3.730 3.512 3.050 3.796 0.066 13 0 "[ . 1 . 2]" 1
1460 1 101 MET ME 1 120 ILE MG . . 2.870 2.362 2.081 2.633 . 0 0 "[ . 1 . 2]" 1
1461 1 101 MET ME 1 121 THR MG . . 3.640 3.269 2.778 3.604 . 0 0 "[ . 1 . 2]" 1
1462 1 101 MET QG 1 117 ILE MD . . 4.550 4.223 3.091 4.559 0.009 6 0 "[ . 1 . 2]" 1
1463 1 101 MET HG2 1 117 ILE MD . . 4.650 4.621 3.181 5.248 0.598 10 2 "[ - . + . 2]" 1
1464 1 102 SER H 1 102 SER QB . . 3.050 2.419 2.229 2.686 . 0 0 "[ . 1 . 2]" 1
1465 1 102 SER H 1 102 SER HB3 . . 3.130 2.848 2.472 3.588 0.458 7 0 "[ . 1 . 2]" 1
1466 1 102 SER H 1 103 ASN H . . 3.320 2.691 2.572 2.795 . 0 0 "[ . 1 . 2]" 1
1467 1 102 SER H 1 104 ALA H . . 4.610 4.040 3.937 4.164 . 0 0 "[ . 1 . 2]" 1
1468 1 102 SER H 1 112 VAL QG . . 4.700 4.385 3.970 4.733 0.033 13 0 "[ . 1 . 2]" 1
1469 1 102 SER H 1 117 ILE MD . . 3.700 2.885 2.763 3.040 . 0 0 "[ . 1 . 2]" 1
1470 1 102 SER HA 1 102 SER HB2 . . 2.510 2.633 2.432 3.033 0.523 3 5 "[ + * * 1 - *. 2]" 1
1471 1 102 SER HA 1 102 SER QB . . 2.400 2.317 2.184 2.399 . 0 0 "[ . 1 . 2]" 1
1472 1 102 SER HA 1 104 ALA H . . 4.570 4.363 4.227 4.521 . 0 0 "[ . 1 . 2]" 1
1473 1 102 SER HA 1 105 PHE HB2 . . 4.320 3.272 2.647 4.121 . 0 0 "[ . 1 . 2]" 1
1474 1 102 SER HA 1 105 PHE QB . . 4.230 3.034 2.574 3.651 . 0 0 "[ . 1 . 2]" 1
1475 1 102 SER HA 1 112 VAL QG . . 4.170 2.376 1.919 2.974 . 0 0 "[ . 1 . 2]" 1
1476 1 102 SER HA 1 117 ILE MD . . 3.420 2.384 2.138 2.727 . 0 0 "[ . 1 . 2]" 1
1477 1 102 SER QB 1 103 ASN H . . 3.710 2.613 2.300 3.346 . 0 0 "[ . 1 . 2]" 1
1478 1 102 SER QB 1 112 VAL QG . . 4.330 2.544 2.089 3.203 . 0 0 "[ . 1 . 2]" 1
1479 1 102 SER HB2 1 117 ILE MD . . 3.770 3.050 2.279 3.886 0.116 7 0 "[ . 1 . 2]" 1
1480 1 102 SER HB3 1 103 ASN H . . 3.770 3.108 2.329 4.042 0.272 1 0 "[ . 1 . 2]" 1
1481 1 102 SER HB3 1 112 VAL QG . . 4.460 3.067 2.103 3.920 . 0 0 "[ . 1 . 2]" 1
1482 1 102 SER HB3 1 117 ILE MD . . 3.830 3.298 2.069 3.861 0.031 11 0 "[ . 1 . 2]" 1
1483 1 103 ASN H 1 103 ASN QB . . 2.830 2.186 2.155 2.216 . 0 0 "[ . 1 . 2]" 1
1484 1 103 ASN H 1 104 ALA H . . 3.120 2.694 2.577 2.788 . 0 0 "[ . 1 . 2]" 1
1485 1 103 ASN HA 1 106 LEU H . . 3.730 3.424 3.180 3.617 . 0 0 "[ . 1 . 2]" 1
1486 1 103 ASN HA 1 106 LEU QB . . 3.150 2.359 2.113 2.472 . 0 0 "[ . 1 . 2]" 1
1487 1 103 ASN HA 1 106 LEU QD . . 3.280 2.367 2.047 2.687 . 0 0 "[ . 1 . 2]" 1
1488 1 103 ASN HA 1 106 LEU HG . . 4.480 4.110 2.963 4.652 0.172 5 0 "[ . 1 . 2]" 1
1489 1 103 ASN QB 1 103 ASN HD21 . . 3.120 2.136 2.113 2.172 . 0 0 "[ . 1 . 2]" 1
1490 1 103 ASN QB 1 103 ASN QD . . 2.920 2.106 2.084 2.138 . 0 0 "[ . 1 . 2]" 1
1491 1 103 ASN QB 1 103 ASN HD22 . . 3.500 3.212 3.187 3.268 . 0 0 "[ . 1 . 2]" 1
1492 1 103 ASN QB 1 104 ALA H . . 3.290 2.670 2.375 2.868 . 0 0 "[ . 1 . 2]" 1
1493 1 103 ASN QB 1 106 LEU QD . . 3.830 3.705 3.430 3.901 0.071 20 0 "[ . 1 . 2]" 1
1494 1 103 ASN QB 1 107 GLN HE21 . . 4.390 4.140 3.847 4.493 0.103 3 0 "[ . 1 . 2]" 1
1495 1 103 ASN QB 1 107 GLN QE . . 4.220 3.996 3.724 4.281 0.061 3 0 "[ . 1 . 2]" 1
1496 1 103 ASN QB 1 107 GLN HE22 . . 5.500 5.284 4.968 5.457 . 0 0 "[ . 1 . 2]" 1
1497 1 103 ASN QD 1 104 ALA MB . . 4.990 4.301 3.290 5.219 0.229 6 0 "[ . 1 . 2]" 1
1498 1 103 ASN QD 1 107 GLN QG . . 4.140 3.586 2.624 4.117 . 0 0 "[ . 1 . 2]" 1
1499 1 103 ASN HD21 1 104 ALA MB . . 5.130 4.571 3.411 5.771 0.641 6 1 "[ .+ 1 . 2]" 1
1500 1 103 ASN HD22 1 107 GLN QG . . 4.220 3.761 2.755 4.311 0.091 6 0 "[ . 1 . 2]" 1
1501 1 104 ALA H 1 104 ALA MB . . 3.200 2.231 2.192 2.246 . 0 0 "[ . 1 . 2]" 1
1502 1 104 ALA H 1 105 PHE H . . 3.440 2.697 2.643 2.759 . 0 0 "[ . 1 . 2]" 1
1503 1 104 ALA H 1 106 LEU QB . . 5.170 4.500 4.296 4.764 . 0 0 "[ . 1 . 2]" 1
1504 1 104 ALA HA 1 107 GLN H . . 3.860 3.322 3.091 3.556 . 0 0 "[ . 1 . 2]" 1
1505 1 104 ALA HA 1 107 GLN HB2 . . 4.380 3.159 2.664 3.527 . 0 0 "[ . 1 . 2]" 1
1506 1 104 ALA HA 1 107 GLN QB . . 4.290 3.111 2.635 3.461 . 0 0 "[ . 1 . 2]" 1
1507 1 104 ALA HA 1 107 GLN QG . . 4.320 2.668 2.316 2.800 . 0 0 "[ . 1 . 2]" 1
1508 1 104 ALA MB 1 105 PHE H . . 3.830 2.513 2.361 2.645 . 0 0 "[ . 1 . 2]" 1
1509 1 104 ALA MB 1 105 PHE HA . . 4.420 3.884 3.781 3.991 . 0 0 "[ . 1 . 2]" 1
1510 1 104 ALA MB 1 107 GLN H . . 4.660 4.405 4.285 4.480 . 0 0 "[ . 1 . 2]" 1
1511 1 104 ALA MB 1 107 GLN HE21 . . 5.420 5.614 5.574 5.670 0.250 12 0 "[ . 1 . 2]" 1
1512 1 104 ALA MB 1 107 GLN QE . . 5.260 5.394 5.352 5.446 0.186 12 0 "[ . 1 . 2]" 1
1513 1 105 PHE H 1 105 PHE HB2 . . 3.580 2.240 2.044 2.374 . 0 0 "[ . 1 . 2]" 1
1514 1 105 PHE H 1 105 PHE QB . . 3.390 2.188 2.022 2.323 . 0 0 "[ . 1 . 2]" 1
1515 1 105 PHE H 1 105 PHE QD . . 4.090 3.574 2.846 4.109 0.019 10 0 "[ . 1 . 2]" 1
1516 1 105 PHE H 1 106 LEU H . . 3.900 2.560 2.458 2.692 . 0 0 "[ . 1 . 2]" 1
1517 1 105 PHE H 1 107 GLN H . . 4.960 4.029 3.916 4.167 . 0 0 "[ . 1 . 2]" 1
1518 1 105 PHE H 1 112 VAL QG . . 4.920 4.412 3.786 4.921 0.001 10 0 "[ . 1 . 2]" 1
1519 1 105 PHE HA 1 105 PHE QD . . 3.100 2.414 2.023 3.000 . 0 0 "[ . 1 . 2]" 1
1520 1 105 PHE HA 1 108 THR H . . 3.760 3.339 3.157 3.586 . 0 0 "[ . 1 . 2]" 1
1521 1 105 PHE HA 1 109 THR H . . 4.750 3.595 3.309 3.993 . 0 0 "[ . 1 . 2]" 1
1522 1 105 PHE HA 1 109 THR MG . . 4.800 3.326 2.761 3.963 . 0 0 "[ . 1 . 2]" 1
1523 1 105 PHE QB 1 106 LEU H . . 3.690 2.696 2.522 2.863 . 0 0 "[ . 1 . 2]" 1
1524 1 105 PHE QB 1 109 THR MG . . 4.860 3.850 3.010 4.616 . 0 0 "[ . 1 . 2]" 1
1525 1 105 PHE QB 1 112 VAL HA . . 3.880 2.480 1.970 3.174 . 0 0 "[ . 1 . 2]" 1
1526 1 105 PHE QB 1 112 VAL QG . . 4.260 2.889 2.086 3.589 . 0 0 "[ . 1 . 2]" 1
1527 1 105 PHE HB2 1 106 LEU H . . 3.890 3.255 2.612 3.779 . 0 0 "[ . 1 . 2]" 1
1528 1 105 PHE HB2 1 109 THR MG . . 4.980 4.897 4.390 5.670 0.690 16 2 "[ . - 1 .+ 2]" 1
1529 1 105 PHE HB2 1 112 VAL QG . . 4.810 3.475 2.165 4.776 . 0 0 "[ . 1 . 2]" 1
1530 1 105 PHE HB3 1 106 LEU H . . 4.600 3.053 2.735 3.511 . 0 0 "[ . 1 . 2]" 1
1531 1 105 PHE HB3 1 112 VAL HA . . 3.950 2.553 2.026 3.219 . 0 0 "[ . 1 . 2]" 1
1532 1 105 PHE QD 1 109 THR MG . . 3.950 2.889 1.984 3.640 . 0 0 "[ . 1 . 2]" 1
1533 1 105 PHE QD 1 112 VAL HA . . 4.360 2.827 1.966 3.998 . 0 0 "[ . 1 . 2]" 1
1534 1 105 PHE QD 1 112 VAL QG . . 3.830 3.285 2.124 3.868 0.038 20 0 "[ . 1 . 2]" 1
1535 1 106 LEU H 1 106 LEU QB . . 3.060 2.121 1.970 2.337 . 0 0 "[ . 1 . 2]" 1
1536 1 106 LEU H 1 106 LEU QD . . 3.190 3.094 2.286 3.409 0.219 9 0 "[ . 1 . 2]" 1
1537 1 106 LEU H 1 112 VAL QG . . 4.320 3.844 2.989 4.362 0.042 12 0 "[ . 1 . 2]" 1
1538 1 106 LEU HA 1 106 LEU QD . . 2.810 1.969 1.845 2.272 . 0 0 "[ . 1 . 2]" 1
1539 1 106 LEU HA 1 106 LEU HG . . 3.910 2.949 2.585 3.129 . 0 0 "[ . 1 . 2]" 1
1540 1 106 LEU HA 1 107 GLN HE21 . . 4.970 5.169 4.391 5.380 0.410 12 0 "[ . 1 . 2]" 1
1541 1 106 LEU HA 1 107 GLN QE . . 4.840 4.758 4.136 4.925 0.085 4 0 "[ . 1 . 2]" 1
1542 1 106 LEU HA 1 108 THR H . . 4.720 4.242 3.948 4.524 . 0 0 "[ . 1 . 2]" 1
1543 1 106 LEU HA 1 109 THR H . . 4.620 4.323 3.963 4.632 0.012 7 0 "[ . 1 . 2]" 1
1544 1 106 LEU HA 1 110 GLY H . . 3.840 3.009 2.740 3.407 . 0 0 "[ . 1 . 2]" 1
1545 1 106 LEU HA 1 110 GLY HA2 . . 3.730 2.781 2.163 3.320 . 0 0 "[ . 1 . 2]" 1
1546 1 106 LEU HA 1 110 GLY QA . . 3.670 2.745 2.152 3.256 . 0 0 "[ . 1 . 2]" 1
1547 1 106 LEU HA 1 111 VAL H . . 4.180 3.544 2.709 4.111 . 0 0 "[ . 1 . 2]" 1
1548 1 106 LEU QB 1 106 LEU QD . . 2.540 1.932 1.890 1.975 . 0 0 "[ . 1 . 2]" 1
1549 1 106 LEU QB 1 107 GLN H . . 3.100 2.848 2.723 3.025 . 0 0 "[ . 1 . 2]" 1
1550 1 106 LEU QB 1 107 GLN HE21 . . 5.070 2.511 2.151 2.737 . 0 0 "[ . 1 . 2]" 1
1551 1 106 LEU QB 1 107 GLN QE . . 4.190 2.403 2.052 2.593 . 0 0 "[ . 1 . 2]" 1
1552 1 106 LEU QB 1 107 GLN HE22 . . 4.970 3.106 2.591 3.350 . 0 0 "[ . 1 . 2]" 1
1553 1 106 LEU QB 1 107 GLN QG . . 4.310 3.212 2.990 3.601 . 0 0 "[ . 1 . 2]" 1
1554 1 106 LEU QB 1 112 VAL QG . . 4.460 3.692 2.546 4.634 0.174 5 0 "[ . 1 . 2]" 1
1555 1 106 LEU QD 1 107 GLN HE21 . . 5.360 3.438 2.977 3.777 . 0 0 "[ . 1 . 2]" 1
1556 1 106 LEU QD 1 107 GLN QE . . 4.780 3.096 2.593 3.523 . 0 0 "[ . 1 . 2]" 1
1557 1 106 LEU QD 1 107 GLN HE22 . . 5.500 3.540 2.854 4.267 . 0 0 "[ . 1 . 2]" 1
1558 1 106 LEU QD 1 107 GLN QG . . 4.840 4.422 4.183 4.770 . 0 0 "[ . 1 . 2]" 1
1559 1 106 LEU QD 1 110 GLY H . . 4.560 4.063 3.651 4.420 . 0 0 "[ . 1 . 2]" 1
1560 1 106 LEU QD 1 110 GLY HA2 . . 3.810 3.208 2.753 3.856 0.046 5 0 "[ . 1 . 2]" 1
1561 1 106 LEU QD 1 110 GLY QA . . 3.730 3.125 2.702 3.739 0.009 5 0 "[ . 1 . 2]" 1
1562 1 106 LEU QD 1 111 VAL H . . 4.010 3.794 3.068 4.062 0.052 2 0 "[ . 1 . 2]" 1
1563 1 106 LEU QD 1 111 VAL HA . . 3.580 3.254 3.010 3.606 0.026 3 0 "[ . 1 . 2]" 1
1564 1 106 LEU QD 1 112 VAL H . . 3.640 3.575 3.125 3.715 0.075 6 0 "[ . 1 . 2]" 1
1565 1 106 LEU QD 1 112 VAL HA . . 4.690 3.756 3.198 4.348 . 0 0 "[ . 1 . 2]" 1
1566 1 106 LEU QD 1 112 VAL QG . . 2.810 2.120 1.853 2.668 . 0 0 "[ . 1 . 2]" 1
1567 1 107 GLN H 1 107 GLN HB2 . . 3.560 2.628 2.527 2.682 . 0 0 "[ . 1 . 2]" 1
1568 1 107 GLN H 1 107 GLN QB . . 3.380 2.573 2.484 2.620 . 0 0 "[ . 1 . 2]" 1
1569 1 107 GLN H 1 107 GLN QG . . 3.340 2.326 2.114 2.612 . 0 0 "[ . 1 . 2]" 1
1570 1 107 GLN H 1 108 THR H . . 3.470 2.308 2.174 2.523 . 0 0 "[ . 1 . 2]" 1
1571 1 107 GLN H 1 109 THR H . . 4.860 4.276 3.890 4.766 . 0 0 "[ . 1 . 2]" 1
1572 1 107 GLN HA 1 107 GLN HB3 . . 2.960 2.405 2.378 2.463 . 0 0 "[ . 1 . 2]" 1
1573 1 107 GLN HA 1 107 GLN HE21 . . 4.370 3.978 2.942 4.270 . 0 0 "[ . 1 . 2]" 1
1574 1 107 GLN HA 1 107 GLN QE . . 3.990 3.529 2.766 3.761 . 0 0 "[ . 1 . 2]" 1
1575 1 107 GLN HA 1 107 GLN HE22 . . 4.620 3.960 3.361 4.182 . 0 0 "[ . 1 . 2]" 1
1576 1 107 GLN HA 1 108 THR H . . 3.460 3.435 3.321 3.499 0.039 8 0 "[ . 1 . 2]" 1
1577 1 107 GLN QB 1 108 THR H . . 3.990 3.002 2.805 3.320 . 0 0 "[ . 1 . 2]" 1
1578 1 107 GLN QB 1 108 THR MG . . 4.250 3.073 2.786 3.273 . 0 0 "[ . 1 . 2]" 1
1579 1 107 GLN HB2 1 107 GLN HE22 . . 5.500 5.246 5.002 5.307 . 0 0 "[ . 1 . 2]" 1
1580 1 107 GLN HB2 1 108 THR H . . 4.370 3.088 2.875 3.450 . 0 0 "[ . 1 . 2]" 1
1581 1 107 GLN HB2 1 108 THR MG . . 5.010 3.154 2.877 3.366 . 0 0 "[ . 1 . 2]" 1
1582 1 107 GLN HB3 1 108 THR H . . 4.610 4.107 3.902 4.318 . 0 0 "[ . 1 . 2]" 1
1583 1 107 GLN HB3 1 108 THR MG . . 4.600 4.249 3.723 4.486 . 0 0 "[ . 1 . 2]" 1
1584 1 107 GLN QG 1 108 THR MG . . 5.010 4.538 4.358 4.743 . 0 0 "[ . 1 . 2]" 1
1585 1 108 THR H 1 108 THR HB . . 4.080 3.574 3.528 3.621 . 0 0 "[ . 1 . 2]" 1
1586 1 108 THR H 1 108 THR MG . . 3.590 2.826 2.641 3.041 . 0 0 "[ . 1 . 2]" 1
1587 1 108 THR H 1 109 THR H . . 3.360 2.431 2.092 2.685 . 0 0 "[ . 1 . 2]" 1
1588 1 108 THR H 1 109 THR MG . . 3.800 3.889 3.821 3.974 0.174 16 0 "[ . 1 . 2]" 1
1589 1 108 THR H 1 110 GLY H . . 3.780 3.329 3.047 3.597 . 0 0 "[ . 1 . 2]" 1
1590 1 108 THR HA 1 108 THR MG . . 2.690 2.226 2.184 2.255 . 0 0 "[ . 1 . 2]" 1
1591 1 108 THR HA 1 109 THR MG . . 4.950 4.583 4.133 4.915 . 0 0 "[ . 1 . 2]" 1
1592 1 108 THR HB 1 109 THR H . . 3.990 3.217 2.875 3.623 . 0 0 "[ . 1 . 2]" 1
1593 1 108 THR HB 1 109 THR MG . . 3.620 3.204 2.522 3.661 0.041 1 0 "[ . 1 . 2]" 1
1594 1 109 THR H 1 109 THR MG . . 3.220 2.143 1.801 2.673 . 0 0 "[ . 1 . 2]" 1
1595 1 109 THR H 1 110 GLY H . . 3.150 2.008 1.773 2.161 . 0 0 "[ . 1 . 2]" 1
1596 1 109 THR H 1 110 GLY HA2 . . 4.240 4.297 4.042 4.490 0.250 17 0 "[ . 1 . 2]" 1
1597 1 109 THR H 1 110 GLY QA . . 4.160 3.985 3.767 4.150 . 0 0 "[ . 1 . 2]" 1
1598 1 109 THR H 1 111 VAL H . . 3.910 3.651 3.393 3.897 . 0 0 "[ . 1 . 2]" 1
1599 1 109 THR HA 1 109 THR HB . . 2.880 2.390 2.311 2.437 . 0 0 "[ . 1 . 2]" 1
1600 1 109 THR HA 1 109 THR MG . . 3.240 2.895 2.415 3.206 . 0 0 "[ . 1 . 2]" 1
1601 1 109 THR MG 1 110 GLY H . . 3.990 3.110 2.279 3.796 . 0 0 "[ . 1 . 2]" 1
1602 1 109 THR MG 1 111 VAL H . . 5.160 2.759 1.815 3.972 . 0 0 "[ . 1 . 2]" 1
1603 1 109 THR MG 1 111 VAL HB . . 4.990 3.509 2.303 4.529 . 0 0 "[ . 1 . 2]" 1
1604 1 110 GLY H 1 111 VAL H . . 3.320 2.430 2.174 2.660 . 0 0 "[ . 1 . 2]" 1
1605 1 110 GLY H 1 111 VAL QG . . 4.480 4.178 4.004 4.376 . 0 0 "[ . 1 . 2]" 1
1606 1 110 GLY H 1 111 VAL MG2 . . 4.510 4.277 4.075 4.505 . 0 0 "[ . 1 . 2]" 1
1607 1 110 GLY QA 1 111 VAL QG . . 4.090 3.311 3.177 3.427 . 0 0 "[ . 1 . 2]" 1
1608 1 110 GLY HA3 1 111 VAL MG2 . . 4.200 3.485 3.316 3.676 . 0 0 "[ . 1 . 2]" 1
1609 1 111 VAL H 1 111 VAL HB . . 3.220 2.785 2.692 2.921 . 0 0 "[ . 1 . 2]" 1
1610 1 111 VAL H 1 111 VAL QG . . 3.240 2.513 2.342 2.705 . 0 0 "[ . 1 . 2]" 1
1611 1 111 VAL H 1 111 VAL MG2 . . 3.250 2.544 2.361 2.755 . 0 0 "[ . 1 . 2]" 1
1612 1 111 VAL H 1 112 VAL H . . 4.470 4.437 4.331 4.481 0.011 1 0 "[ . 1 . 2]" 1
1613 1 111 VAL HA 1 111 VAL MG1 . . 2.920 2.327 2.271 2.368 . 0 0 "[ . 1 . 2]" 1
1614 1 111 VAL HA 1 111 VAL QG . . 2.650 2.148 2.131 2.159 . 0 0 "[ . 1 . 2]" 1
1615 1 111 VAL HA 1 111 VAL MG2 . . 3.040 2.524 2.477 2.580 . 0 0 "[ . 1 . 2]" 1
1616 1 111 VAL HA 1 112 VAL H . . 2.850 2.294 2.183 2.366 . 0 0 "[ . 1 . 2]" 1
1617 1 111 VAL HA 1 112 VAL HA . . 4.320 4.370 4.340 4.414 0.094 12 0 "[ . 1 . 2]" 1
1618 1 111 VAL HA 1 112 VAL HB . . 4.760 4.618 4.390 4.789 0.029 18 0 "[ . 1 . 2]" 1
1619 1 111 VAL HA 1 112 VAL QG . . 4.050 3.468 3.317 3.758 . 0 0 "[ . 1 . 2]" 1
1620 1 111 VAL HB 1 112 VAL H . . 3.640 3.668 3.603 3.761 0.121 6 0 "[ . 1 . 2]" 1
1621 1 111 VAL QG 1 112 VAL H . . 3.020 2.088 1.953 2.296 . 0 0 "[ . 1 . 2]" 1
1622 1 111 VAL MG1 1 112 VAL H . . 3.030 2.095 1.957 2.308 . 0 0 "[ . 1 . 2]" 1
1623 1 112 VAL H 1 112 VAL HB . . 3.690 2.776 2.532 3.211 . 0 0 "[ . 1 . 2]" 1
1624 1 112 VAL H 1 112 VAL QG . . 2.960 2.323 2.003 2.640 . 0 0 "[ . 1 . 2]" 1
1625 1 112 VAL HA 1 112 VAL QG . . 3.120 2.202 2.127 2.361 . 0 0 "[ . 1 . 2]" 1
1626 1 112 VAL HA 1 113 ASN HB2 . . 4.300 4.539 4.305 4.691 0.391 15 0 "[ . 1 . 2]" 1
1627 1 112 VAL HA 1 113 ASN QB . . 4.210 4.117 4.033 4.195 . 0 0 "[ . 1 . 2]" 1
1628 1 112 VAL QG 1 113 ASN HA . . 4.340 3.745 3.508 3.989 . 0 0 "[ . 1 . 2]" 1
1629 1 112 VAL QG 1 114 GLN H . . 4.640 3.408 2.783 4.131 . 0 0 "[ . 1 . 2]" 1
1630 1 112 VAL QG 1 117 ILE MD . . 3.240 2.491 2.063 2.777 . 0 0 "[ . 1 . 2]" 1
1631 1 113 ASN HA 1 113 ASN QD . . 4.160 3.494 2.807 4.105 . 0 0 "[ . 1 . 2]" 1
1632 1 113 ASN HA 1 113 ASN HD22 . . 4.240 4.279 3.856 4.750 0.510 15 1 "[ . 1 + 2]" 1
1633 1 113 ASN HA 1 114 GLN H . . 3.170 2.178 2.113 2.309 . 0 0 "[ . 1 . 2]" 1
1634 1 113 ASN HA 1 114 GLN QB . . 4.460 4.098 3.942 4.199 . 0 0 "[ . 1 . 2]" 1
1635 1 113 ASN HA 1 114 GLN HB3 . . 4.560 4.685 4.603 4.954 0.394 9 0 "[ . 1 . 2]" 1
1636 1 113 ASN HA 1 115 PRO HD2 . . 4.250 3.033 2.705 3.974 . 0 0 "[ . 1 . 2]" 1
1637 1 113 ASN HA 1 115 PRO QD . . 4.170 2.974 2.667 3.603 . 0 0 "[ . 1 . 2]" 1
1638 1 113 ASN HB3 1 113 ASN HD22 . . 4.060 3.834 3.483 4.051 . 0 0 "[ . 1 . 2]" 1
1639 1 113 ASN QD 1 116 PHE QB . . 4.370 3.456 2.418 4.263 . 0 0 "[ . 1 . 2]" 1
1640 1 113 ASN HD21 1 116 PHE HB2 . . 4.950 4.328 3.202 5.278 0.328 16 0 "[ . 1 . 2]" 1
1641 1 113 ASN HD22 1 116 PHE HB2 . . 5.130 3.850 2.507 5.194 0.064 9 0 "[ . 1 . 2]" 1
1642 1 114 GLN H 1 114 GLN HB2 . . 3.690 2.495 2.085 2.682 . 0 0 "[ . 1 . 2]" 1
1643 1 114 GLN H 1 114 GLN QB . . 3.330 2.246 2.044 2.306 . 0 0 "[ . 1 . 2]" 1
1644 1 114 GLN H 1 114 GLN HB3 . . 3.800 2.581 2.477 2.941 . 0 0 "[ . 1 . 2]" 1
1645 1 114 GLN H 1 114 GLN HG2 . . 4.690 4.585 4.012 4.665 . 0 0 "[ . 1 . 2]" 1
1646 1 114 GLN H 1 114 GLN QG . . 4.240 4.029 3.710 4.064 . 0 0 "[ . 1 . 2]" 1
1647 1 114 GLN H 1 114 GLN HG3 . . 4.840 4.469 4.371 4.512 . 0 0 "[ . 1 . 2]" 1
1648 1 114 GLN H 1 115 PRO HD2 . . 3.650 2.105 1.793 2.689 . 0 0 "[ . 1 . 2]" 1
1649 1 114 GLN H 1 115 PRO QD . . 3.350 2.021 1.777 2.314 . 0 0 "[ . 1 . 2]" 1
1650 1 114 GLN H 1 115 PRO HD3 . . 3.910 3.005 2.182 3.432 . 0 0 "[ . 1 . 2]" 1
1651 1 114 GLN H 1 116 PHE H . . 4.880 4.530 4.186 4.891 0.011 9 0 "[ . 1 . 2]" 1
1652 1 114 GLN H 1 117 ILE MD . . 5.500 4.833 4.359 5.415 . 0 0 "[ . 1 . 2]" 1
1653 1 114 GLN HA 1 114 GLN HE21 . . 4.520 2.542 2.356 2.665 . 0 0 "[ . 1 . 2]" 1
1654 1 114 GLN HA 1 114 GLN QE . . 4.420 2.456 2.298 2.562 . 0 0 "[ . 1 . 2]" 1
1655 1 114 GLN HA 1 117 ILE H . . 4.490 3.642 3.388 4.003 . 0 0 "[ . 1 . 2]" 1
1656 1 114 GLN HA 1 117 ILE MD . . 4.160 3.014 2.491 3.687 . 0 0 "[ . 1 . 2]" 1
1657 1 114 GLN QB 1 115 PRO QD . . 3.740 2.040 1.832 2.204 . 0 0 "[ . 1 . 2]" 1
1658 1 114 GLN HB2 1 115 PRO HD3 . . 4.320 3.708 3.326 4.013 . 0 0 "[ . 1 . 2]" 1
1659 1 114 GLN HB3 1 115 PRO HD3 . . 4.240 2.141 1.848 2.390 . 0 0 "[ . 1 . 2]" 1
1660 1 114 GLN QE 1 114 GLN QG . . 3.070 2.175 2.152 2.192 . 0 0 "[ . 1 . 2]" 1
1661 1 114 GLN QE 1 117 ILE MD . . 4.930 3.206 2.635 3.833 . 0 0 "[ . 1 . 2]" 1
1662 1 114 GLN QE 1 117 ILE MG . . 4.210 2.766 2.224 3.538 . 0 0 "[ . 1 . 2]" 1
1663 1 114 GLN QE 1 118 ASN H . . 4.580 3.124 2.841 3.552 . 0 0 "[ . 1 . 2]" 1
1664 1 114 GLN HE21 1 117 ILE MD . . 5.060 3.831 3.319 4.394 . 0 0 "[ . 1 . 2]" 1
1665 1 114 GLN HE21 1 117 ILE MG . . 4.300 3.357 2.976 3.982 . 0 0 "[ . 1 . 2]" 1
1666 1 114 GLN HE22 1 114 GLN HG3 . . 3.490 3.511 3.471 4.039 0.549 9 1 "[ . +1 . 2]" 1
1667 1 114 GLN HE22 1 118 ASN H . . 4.690 4.479 3.420 5.039 0.349 1 0 "[ . 1 . 2]" 1
1668 1 114 GLN QG 1 115 PRO QD . . 4.670 3.440 3.216 4.005 . 0 0 "[ . 1 . 2]" 1
1669 1 114 GLN QG 1 118 ASN QD . . 4.050 2.280 1.780 3.969 . 0 0 "[ . 1 . 2]" 1
1670 1 114 GLN HG2 1 115 PRO HD3 . . 4.910 4.352 4.015 5.211 0.301 9 0 "[ . 1 . 2]" 1
1671 1 114 GLN HG2 1 118 ASN QD . . 4.380 3.435 2.900 4.658 0.278 9 0 "[ . 1 . 2]" 1
1672 1 115 PRO HA 1 118 ASN QB . . 4.130 2.998 2.331 3.448 . 0 0 "[ . 1 . 2]" 1
1673 1 115 PRO HA 1 118 ASN HB3 . . 4.210 4.556 3.838 5.063 0.853 19 5 "[ . *1* - * +2]" 1
1674 1 115 PRO HA 1 118 ASN QD . . 3.840 2.653 2.203 3.480 . 0 0 "[ . 1 . 2]" 1
1675 1 115 PRO QB 1 116 PHE H . . 3.930 2.673 2.276 2.999 . 0 0 "[ . 1 . 2]" 1
1676 1 115 PRO QB 1 116 PHE QD . . 4.180 3.659 2.634 4.353 0.173 5 0 "[ . 1 . 2]" 1
1677 1 115 PRO QB 1 118 ASN QD . . 4.510 4.204 3.837 4.574 0.064 12 0 "[ . 1 . 2]" 1
1678 1 115 PRO HB2 1 116 PHE H . . 4.230 2.719 2.296 3.075 . 0 0 "[ . 1 . 2]" 1
1679 1 115 PRO HB2 1 116 PHE QD . . 4.260 3.740 2.659 4.506 0.246 5 0 "[ . 1 . 2]" 1
1680 1 115 PRO HB3 1 118 ASN QD . . 4.730 4.441 4.049 4.894 0.164 14 0 "[ . 1 . 2]" 1
1681 1 115 PRO QD 1 116 PHE H . . 4.440 3.205 2.601 3.457 . 0 0 "[ . 1 . 2]" 1
1682 1 115 PRO HD2 1 116 PHE H . . 4.650 3.317 2.639 3.614 . 0 0 "[ . 1 . 2]" 1
1683 1 116 PHE H 1 116 PHE HB2 . . 3.660 2.304 2.204 2.424 . 0 0 "[ . 1 . 2]" 1
1684 1 116 PHE H 1 116 PHE HB3 . . 3.730 3.305 2.771 3.612 . 0 0 "[ . 1 . 2]" 1
1685 1 116 PHE H 1 117 ILE H . . 3.630 2.500 2.457 2.540 . 0 0 "[ . 1 . 2]" 1
1686 1 116 PHE H 1 117 ILE HA . . 5.050 5.110 5.022 5.141 0.091 10 0 "[ . 1 . 2]" 1
1687 1 116 PHE HA 1 116 PHE QD . . 3.400 2.771 2.104 3.083 . 0 0 "[ . 1 . 2]" 1
1688 1 116 PHE QB 1 117 ILE H . . 4.450 2.788 2.532 3.525 . 0 0 "[ . 1 . 2]" 1
1689 1 116 PHE HB3 1 117 ILE H . . 4.550 3.351 2.588 4.269 . 0 0 "[ . 1 . 2]" 1
1690 1 117 ILE H 1 117 ILE HB . . 3.630 2.483 2.422 2.571 . 0 0 "[ . 1 . 2]" 1
1691 1 117 ILE H 1 117 ILE HG12 . . 4.190 3.374 3.068 3.921 . 0 0 "[ . 1 . 2]" 1
1692 1 117 ILE H 1 117 ILE QG . . 3.660 2.282 2.112 2.878 . 0 0 "[ . 1 . 2]" 1
1693 1 117 ILE H 1 117 ILE HG13 . . 4.030 2.322 2.138 2.961 . 0 0 "[ . 1 . 2]" 1
1694 1 117 ILE H 1 117 ILE MG . . 3.930 3.767 3.745 3.791 . 0 0 "[ . 1 . 2]" 1
1695 1 117 ILE H 1 118 ASN H . . 3.610 2.526 2.090 2.636 . 0 0 "[ . 1 . 2]" 1
1696 1 117 ILE HA 1 117 ILE MD . . 4.110 3.740 3.633 3.808 . 0 0 "[ . 1 . 2]" 1
1697 1 117 ILE HA 1 117 ILE HG12 . . 3.740 2.394 2.325 2.485 . 0 0 "[ . 1 . 2]" 1
1698 1 117 ILE HA 1 117 ILE QG . . 3.440 2.316 2.259 2.376 . 0 0 "[ . 1 . 2]" 1
1699 1 117 ILE HA 1 117 ILE HG13 . . 4.010 3.090 3.004 3.293 . 0 0 "[ . 1 . 2]" 1
1700 1 117 ILE HA 1 117 ILE MG . . 3.370 2.456 2.418 2.543 . 0 0 "[ . 1 . 2]" 1
1701 1 117 ILE HA 1 120 ILE H . . 4.120 3.532 3.330 3.680 . 0 0 "[ . 1 . 2]" 1
1702 1 117 ILE HA 1 120 ILE HB . . 3.970 2.781 2.522 3.085 . 0 0 "[ . 1 . 2]" 1
1703 1 117 ILE HA 1 120 ILE MD . . 4.180 3.440 2.957 3.768 . 0 0 "[ . 1 . 2]" 1
1704 1 117 ILE HA 1 121 THR H . . 4.880 4.005 3.738 4.537 . 0 0 "[ . 1 . 2]" 1
1705 1 117 ILE HB 1 118 ASN H . . 3.490 2.786 2.642 2.930 . 0 0 "[ . 1 . 2]" 1
1706 1 117 ILE QG 1 118 ASN H . . 4.470 4.074 3.976 4.174 . 0 0 "[ . 1 . 2]" 1
1707 1 117 ILE HG13 1 118 ASN H . . 4.570 4.335 4.205 4.472 . 0 0 "[ . 1 . 2]" 1
1708 1 117 ILE MG 1 118 ASN H . . 4.010 3.491 3.250 3.619 . 0 0 "[ . 1 . 2]" 1
1709 1 117 ILE MG 1 118 ASN HA . . 4.640 3.478 3.145 3.633 . 0 0 "[ . 1 . 2]" 1
1710 1 117 ILE MG 1 121 THR H . . 3.990 3.854 3.601 4.030 0.040 11 0 "[ . 1 . 2]" 1
1711 1 118 ASN H 1 118 ASN HB2 . . 3.580 2.445 2.273 2.544 . 0 0 "[ . 1 . 2]" 1
1712 1 118 ASN H 1 118 ASN QB . . 3.270 2.407 2.248 2.495 . 0 0 "[ . 1 . 2]" 1
1713 1 118 ASN H 1 118 ASN HB3 . . 3.780 3.594 3.551 3.614 . 0 0 "[ . 1 . 2]" 1
1714 1 118 ASN H 1 118 ASN QD . . 4.480 3.537 2.448 4.191 . 0 0 "[ . 1 . 2]" 1
1715 1 118 ASN H 1 119 GLU H . . 3.560 2.670 2.484 2.815 . 0 0 "[ . 1 . 2]" 1
1716 1 118 ASN HA 1 119 GLU HA . . 4.750 4.732 4.611 4.802 0.052 12 0 "[ . 1 . 2]" 1
1717 1 118 ASN QB 1 119 GLU H . . 3.480 2.617 2.337 3.061 . 0 0 "[ . 1 . 2]" 1
1718 1 118 ASN QB 1 119 GLU HA . . 4.600 3.844 3.717 3.972 . 0 0 "[ . 1 . 2]" 1
1719 1 118 ASN QB 1 119 GLU QG . . 3.800 3.145 2.894 3.445 . 0 0 "[ . 1 . 2]" 1
1720 1 118 ASN HB2 1 119 GLU H . . 3.790 2.689 2.376 3.161 . 0 0 "[ . 1 . 2]" 1
1721 1 118 ASN HB2 1 119 GLU HG2 . . 4.430 4.236 3.613 4.599 0.169 20 0 "[ . 1 . 2]" 1
1722 1 118 ASN HB2 1 119 GLU HG3 . . 4.640 3.403 3.093 3.813 . 0 0 "[ . 1 . 2]" 1
1723 1 118 ASN HB3 1 119 GLU H . . 4.060 3.614 3.388 4.087 0.027 11 0 "[ . 1 . 2]" 1
1724 1 118 ASN HB3 1 119 GLU HA . . 4.710 4.293 4.094 4.560 . 0 0 "[ . 1 . 2]" 1
1725 1 118 ASN HB3 1 119 GLU HG3 . . 4.820 4.527 4.136 4.694 . 0 0 "[ . 1 . 2]" 1
1726 1 119 GLU H 1 119 GLU HB2 . . 3.210 2.523 2.430 2.615 . 0 0 "[ . 1 . 2]" 1
1727 1 119 GLU H 1 119 GLU QB . . 3.120 2.476 2.393 2.557 . 0 0 "[ . 1 . 2]" 1
1728 1 119 GLU H 1 119 GLU HG2 . . 3.210 3.274 3.084 3.429 0.219 8 0 "[ . 1 . 2]" 1
1729 1 119 GLU H 1 119 GLU QG . . 2.950 2.189 1.949 2.454 . 0 0 "[ . 1 . 2]" 1
1730 1 119 GLU H 1 119 GLU HG3 . . 3.430 2.225 1.970 2.527 . 0 0 "[ . 1 . 2]" 1
1731 1 119 GLU HA 1 119 GLU QB . . 2.510 2.354 2.313 2.403 . 0 0 "[ . 1 . 2]" 1
1732 1 119 GLU HA 1 119 GLU HB3 . . 2.680 2.456 2.401 2.524 . 0 0 "[ . 1 . 2]" 1
1733 1 119 GLU HA 1 119 GLU HG2 . . 3.490 2.500 2.366 2.591 . 0 0 "[ . 1 . 2]" 1
1734 1 119 GLU HA 1 119 GLU QG . . 2.980 2.413 2.314 2.486 . 0 0 "[ . 1 . 2]" 1
1735 1 119 GLU HA 1 119 GLU HG3 . . 3.240 3.190 3.076 3.362 0.122 11 0 "[ . 1 . 2]" 1
1736 1 119 GLU QB 1 120 ILE MD . . 4.430 2.578 2.369 2.774 . 0 0 "[ . 1 . 2]" 1
1737 1 119 GLU HB2 1 120 ILE MD . . 4.890 2.655 2.417 2.859 . 0 0 "[ . 1 . 2]" 1
1738 1 119 GLU HB3 1 120 ILE MD . . 5.070 3.514 3.245 3.816 . 0 0 "[ . 1 . 2]" 1
1739 1 120 ILE H 1 120 ILE HB . . 3.320 2.272 2.195 2.346 . 0 0 "[ . 1 . 2]" 1
1740 1 120 ILE H 1 120 ILE MD . . 3.540 2.184 2.114 2.316 . 0 0 "[ . 1 . 2]" 1
1741 1 120 ILE H 1 120 ILE HG12 . . 4.020 4.000 3.928 4.048 0.028 16 0 "[ . 1 . 2]" 1
1742 1 120 ILE H 1 120 ILE QG . . 3.410 3.475 3.431 3.555 0.145 17 0 "[ . 1 . 2]" 1
1743 1 120 ILE H 1 120 ILE HG13 . . 3.680 3.818 3.725 3.966 0.286 17 0 "[ . 1 . 2]" 1
1744 1 120 ILE HA 1 120 ILE MD . . 3.040 2.523 2.338 2.677 . 0 0 "[ . 1 . 2]" 1
1745 1 120 ILE HA 1 120 ILE QG . . 3.670 2.286 2.246 2.357 . 0 0 "[ . 1 . 2]" 1
1746 1 120 ILE HA 1 120 ILE HG13 . . 4.010 2.313 2.270 2.391 . 0 0 "[ . 1 . 2]" 1
1747 1 120 ILE HA 1 120 ILE MG . . 3.090 2.696 2.653 2.742 . 0 0 "[ . 1 . 2]" 1
1748 1 120 ILE HB 1 121 THR H . . 3.780 2.792 2.684 2.910 . 0 0 "[ . 1 . 2]" 1
1749 1 120 ILE MD 1 121 THR H . . 4.470 4.265 4.199 4.320 . 0 0 "[ . 1 . 2]" 1
1750 1 120 ILE QG 1 120 ILE MG . . 2.650 2.087 2.071 2.097 . 0 0 "[ . 1 . 2]" 1
1751 1 120 ILE HG12 1 120 ILE MG . . 3.330 2.272 2.211 2.334 . 0 0 "[ . 1 . 2]" 1
1752 1 120 ILE HG13 1 120 ILE MG . . 2.780 2.436 2.368 2.496 . 0 0 "[ . 1 . 2]" 1
1753 1 120 ILE MG 1 121 THR H . . 3.590 2.744 2.591 2.853 . 0 0 "[ . 1 . 2]" 1
1754 1 120 ILE MG 1 121 THR HA . . 4.290 2.743 2.618 2.817 . 0 0 "[ . 1 . 2]" 1
1755 1 120 ILE MG 1 121 THR MG . . 3.650 2.901 2.681 3.104 . 0 0 "[ . 1 . 2]" 1
1756 1 120 ILE MG 1 122 GLN H . . 4.940 4.643 4.504 4.803 . 0 0 "[ . 1 . 2]" 1
1757 1 121 THR H 1 121 THR HB . . 3.720 3.594 3.521 3.626 . 0 0 "[ . 1 . 2]" 1
1758 1 121 THR H 1 121 THR MG . . 3.150 2.426 2.272 2.752 . 0 0 "[ . 1 . 2]" 1
1759 1 121 THR H 1 122 GLN H . . 3.170 2.804 2.739 2.905 . 0 0 "[ . 1 . 2]" 1
1760 1 121 THR HA 1 121 THR MG . . 2.990 2.240 2.171 2.289 . 0 0 "[ . 1 . 2]" 1
1761 1 121 THR HA 1 124 VAL H . . 3.980 3.516 3.220 3.747 . 0 0 "[ . 1 . 2]" 1
1762 1 121 THR HA 1 124 VAL HB . . 3.590 2.852 2.394 3.087 . 0 0 "[ . 1 . 2]" 1
1763 1 121 THR HA 1 124 VAL QG . . 3.210 2.664 2.213 3.119 . 0 0 "[ . 1 . 2]" 1
1764 1 121 THR HA 1 124 VAL MG2 . . 3.220 2.703 2.222 3.199 . 0 0 "[ . 1 . 2]" 1
1765 1 121 THR HA 1 125 SER H . . 4.150 4.072 3.529 4.249 0.099 11 0 "[ . 1 . 2]" 1
1766 1 121 THR HB 1 122 GLN H . . 3.640 3.474 3.233 3.645 0.005 7 0 "[ . 1 . 2]" 1
1767 1 121 THR MG 1 122 GLN H . . 4.660 4.055 3.946 4.163 . 0 0 "[ . 1 . 2]" 1
1768 1 122 GLN H 1 122 GLN HB2 . . 3.190 2.653 2.457 3.625 0.435 5 0 "[ . 1 . 2]" 1
1769 1 122 GLN H 1 122 GLN QB . . 3.100 2.518 2.418 2.758 . 0 0 "[ . 1 . 2]" 1
1770 1 122 GLN H 1 122 GLN HG2 . . 3.330 2.278 1.866 3.400 0.070 6 0 "[ . 1 . 2]" 1
1771 1 122 GLN H 1 122 GLN QG . . 3.170 2.148 1.852 2.342 . 0 0 "[ . 1 . 2]" 1
1772 1 122 GLN H 1 122 GLN HG3 . . 3.960 3.458 2.246 3.794 . 0 0 "[ . 1 . 2]" 1
1773 1 122 GLN HA 1 122 GLN QB . . 2.530 2.334 2.161 2.386 . 0 0 "[ . 1 . 2]" 1
1774 1 122 GLN HA 1 122 GLN HB3 . . 2.720 2.446 2.358 2.499 . 0 0 "[ . 1 . 2]" 1
1775 1 122 GLN HA 1 122 GLN HG2 . . 3.160 3.173 2.483 3.666 0.506 5 1 "[ + 1 . 2]" 1
1776 1 122 GLN HA 1 122 GLN QG . . 3.080 2.992 2.393 3.310 0.230 10 0 "[ . 1 . 2]" 1
1777 1 122 GLN QB 1 123 LEU QD . . 3.800 2.888 2.273 3.819 0.019 5 0 "[ . 1 . 2]" 1
1778 1 122 GLN HB2 1 123 LEU QD . . 3.950 3.017 2.324 3.964 0.014 5 0 "[ . 1 . 2]" 1
1779 1 122 GLN HB3 1 123 LEU QD . . 5.130 3.735 3.062 4.989 . 0 0 "[ . 1 . 2]" 1
1780 1 123 LEU H 1 123 LEU HB2 . . 3.480 2.332 2.186 2.565 . 0 0 "[ . 1 . 2]" 1
1781 1 123 LEU H 1 123 LEU QB . . 3.290 2.300 2.164 2.513 . 0 0 "[ . 1 . 2]" 1
1782 1 123 LEU H 1 123 LEU HB3 . . 4.040 3.546 3.478 3.655 . 0 0 "[ . 1 . 2]" 1
1783 1 123 LEU H 1 123 LEU QD . . 3.480 2.584 1.833 3.223 . 0 0 "[ . 1 . 2]" 1
1784 1 123 LEU H 1 124 VAL H . . 3.710 2.573 2.247 2.683 . 0 0 "[ . 1 . 2]" 1
1785 1 123 LEU H 1 124 VAL QG . . 4.200 3.922 3.632 4.117 . 0 0 "[ . 1 . 2]" 1
1786 1 123 LEU H 1 124 VAL MG2 . . 4.230 3.987 3.683 4.203 . 0 0 "[ . 1 . 2]" 1
1787 1 123 LEU HA 1 123 LEU QD . . 2.950 2.266 2.017 2.602 . 0 0 "[ . 1 . 2]" 1
1788 1 123 LEU HA 1 126 MET QB . . 4.290 2.475 2.166 2.761 . 0 0 "[ . 1 . 2]" 1
1789 1 123 LEU HA 1 126 MET HB3 . . 4.380 2.599 2.286 3.721 . 0 0 "[ . 1 . 2]" 1
1790 1 123 LEU HA 1 126 MET ME . . 3.530 2.309 2.105 2.838 . 0 0 "[ . 1 . 2]" 1
1791 1 123 LEU HA 1 127 PHE HB2 . . 4.450 4.632 4.588 4.684 0.234 6 0 "[ . 1 . 2]" 1
1792 1 123 LEU HA 1 127 PHE QB . . 4.360 4.500 4.460 4.549 0.189 6 0 "[ . 1 . 2]" 1
1793 1 123 LEU QB 1 124 VAL QG . . 3.860 3.449 3.267 3.573 . 0 0 "[ . 1 . 2]" 1
1794 1 123 LEU QB 1 126 MET ME . . 3.680 3.653 3.314 3.821 0.141 6 0 "[ . 1 . 2]" 1
1795 1 123 LEU QB 1 127 PHE QE . . 4.650 2.496 2.120 2.789 . 0 0 "[ . 1 . 2]" 1
1796 1 123 LEU HB2 1 124 VAL MG2 . . 3.950 3.706 3.408 3.898 . 0 0 "[ . 1 . 2]" 1
1797 1 123 LEU HB3 1 123 LEU QD . . 3.230 2.235 2.105 2.499 . 0 0 "[ . 1 . 2]" 1
1798 1 123 LEU HB3 1 124 VAL H . . 4.670 3.508 3.245 3.896 . 0 0 "[ . 1 . 2]" 1
1799 1 123 LEU HB3 1 126 MET ME . . 3.740 3.828 3.402 4.015 0.275 6 0 "[ . 1 . 2]" 1
1800 1 123 LEU HB3 1 127 PHE QE . . 4.760 2.522 2.133 2.826 . 0 0 "[ . 1 . 2]" 1
1801 1 123 LEU QD 1 126 MET ME . . 3.730 2.573 1.987 3.329 . 0 0 "[ . 1 . 2]" 1
1802 1 123 LEU QD 1 127 PHE QD . . 3.700 3.400 3.260 3.546 . 0 0 "[ . 1 . 2]" 1
1803 1 123 LEU QD 1 127 PHE QE . . 3.400 2.163 1.981 2.481 . 0 0 "[ . 1 . 2]" 1
1804 1 124 VAL H 1 124 VAL HB . . 3.430 2.604 2.535 2.700 . 0 0 "[ . 1 . 2]" 1
1805 1 124 VAL H 1 124 VAL MG1 . . 4.120 3.789 3.779 3.797 . 0 0 "[ . 1 . 2]" 1
1806 1 124 VAL H 1 124 VAL QG . . 3.420 2.058 1.952 2.188 . 0 0 "[ . 1 . 2]" 1
1807 1 124 VAL H 1 124 VAL MG2 . . 3.650 2.067 1.958 2.201 . 0 0 "[ . 1 . 2]" 1
1808 1 124 VAL H 1 125 SER H . . 3.370 2.841 2.715 2.962 . 0 0 "[ . 1 . 2]" 1
1809 1 124 VAL HA 1 124 VAL MG1 . . 3.320 2.411 2.347 2.473 . 0 0 "[ . 1 . 2]" 1
1810 1 124 VAL HA 1 124 VAL MG2 . . 3.290 2.388 2.337 2.449 . 0 0 "[ . 1 . 2]" 1
1811 1 124 VAL HB 1 125 SER H . . 3.400 2.214 1.991 2.398 . 0 0 "[ . 1 . 2]" 1
1812 1 124 VAL HB 1 125 SER HB2 . . 3.780 4.050 3.896 4.261 0.481 7 0 "[ . 1 . 2]" 1
1813 1 124 VAL HB 1 125 SER QB . . 3.720 3.877 3.770 4.069 0.349 7 0 "[ . 1 . 2]" 1
1814 1 124 VAL QG 1 125 SER HA . . 4.460 3.154 3.008 3.264 . 0 0 "[ . 1 . 2]" 1
1815 1 124 VAL QG 1 126 MET H . . 4.840 4.492 4.244 4.711 . 0 0 "[ . 1 . 2]" 1
1816 1 124 VAL QG 1 128 ALA H . . 4.920 4.053 3.895 4.198 . 0 0 "[ . 1 . 2]" 1
1817 1 124 VAL QG 1 128 ALA HA . . 4.960 4.797 4.572 5.007 0.047 13 0 "[ . 1 . 2]" 1
1818 1 124 VAL QG 1 128 ALA MB . . 3.600 2.890 2.722 3.030 . 0 0 "[ . 1 . 2]" 1
1819 1 124 VAL MG1 1 125 SER H . . 4.000 3.122 2.961 3.296 . 0 0 "[ . 1 . 2]" 1
1820 1 124 VAL MG1 1 125 SER HA . . 4.490 3.179 3.025 3.295 . 0 0 "[ . 1 . 2]" 1
1821 1 124 VAL MG1 1 126 MET H . . 4.880 4.843 4.548 5.097 0.217 11 0 "[ . 1 . 2]" 1
1822 1 124 VAL MG1 1 128 ALA H . . 4.960 4.159 3.992 4.341 . 0 0 "[ . 1 . 2]" 1
1823 1 124 VAL MG1 1 128 ALA HA . . 5.010 4.916 4.677 5.120 0.110 13 0 "[ . 1 . 2]" 1
1824 1 124 VAL MG1 1 128 ALA MB . . 3.610 2.912 2.739 3.062 . 0 0 "[ . 1 . 2]" 1
1825 1 124 VAL MG2 1 125 SER H . . 4.000 3.658 3.494 3.790 . 0 0 "[ . 1 . 2]" 1
1826 1 125 SER H 1 125 SER HB2 . . 3.020 2.348 2.224 2.464 . 0 0 "[ . 1 . 2]" 1
1827 1 125 SER H 1 125 SER QB . . 2.810 2.226 2.150 2.332 . 0 0 "[ . 1 . 2]" 1
1828 1 125 SER H 1 125 SER HB3 . . 3.360 2.954 2.490 3.492 0.132 13 0 "[ . 1 . 2]" 1
1829 1 125 SER H 1 126 MET H . . 3.610 2.748 2.574 2.850 . 0 0 "[ . 1 . 2]" 1
1830 1 125 SER HA 1 128 ALA MB . . 4.050 2.947 2.600 3.410 . 0 0 "[ . 1 . 2]" 1
1831 1 125 SER QB 1 126 MET H . . 3.260 2.590 2.367 2.976 . 0 0 "[ . 1 . 2]" 1
1832 1 125 SER HB2 1 126 MET H . . 3.810 3.382 2.502 3.874 0.064 18 0 "[ . 1 . 2]" 1
1833 1 125 SER HB3 1 126 MET H . . 3.550 3.004 2.392 3.850 0.300 17 0 "[ . 1 . 2]" 1
1834 1 126 MET H 1 126 MET HA . . 2.860 2.841 2.799 2.898 0.038 17 0 "[ . 1 . 2]" 1
1835 1 126 MET H 1 126 MET HB2 . . 3.230 2.578 2.285 2.785 . 0 0 "[ . 1 . 2]" 1
1836 1 126 MET H 1 126 MET QB . . 2.970 2.240 2.212 2.275 . 0 0 "[ . 1 . 2]" 1
1837 1 126 MET H 1 126 MET HB3 . . 3.460 2.508 2.370 3.535 0.075 14 0 "[ . 1 . 2]" 1
1838 1 126 MET H 1 126 MET HG2 . . 4.210 4.371 3.869 4.441 0.231 13 0 "[ . 1 . 2]" 1
1839 1 126 MET H 1 126 MET QG . . 3.910 3.888 2.536 3.992 0.082 20 0 "[ . 1 . 2]" 1
1840 1 126 MET H 1 126 MET HG3 . . 4.640 4.400 2.572 4.569 . 0 0 "[ . 1 . 2]" 1
1841 1 126 MET H 1 127 PHE H . . 3.470 2.675 2.461 2.870 . 0 0 "[ . 1 . 2]" 1
1842 1 126 MET HA 1 126 MET QB . . 2.590 2.348 2.314 2.435 . 0 0 "[ . 1 . 2]" 1
1843 1 126 MET HA 1 126 MET HB3 . . 2.820 2.999 2.575 3.025 0.205 3 0 "[ . 1 . 2]" 1
1844 1 126 MET HA 1 126 MET HG2 . . 3.300 3.033 2.381 3.266 . 0 0 "[ . 1 . 2]" 1
1845 1 126 MET HA 1 126 MET QG . . 3.190 2.469 2.347 2.529 . 0 0 "[ . 1 . 2]" 1
1846 1 126 MET QB 1 127 PHE H . . 3.550 2.373 2.078 2.526 . 0 0 "[ . 1 . 2]" 1
1847 1 126 MET HB2 1 127 PHE H . . 3.600 3.717 2.243 3.894 0.294 20 0 "[ . 1 . 2]" 1
1848 1 126 MET ME 1 126 MET HG2 . . 3.290 2.673 2.453 3.383 0.093 20 0 "[ . 1 . 2]" 1
1849 1 126 MET ME 1 126 MET HG3 . . 3.220 3.217 2.426 3.397 0.177 1 0 "[ . 1 . 2]" 1
1850 1 126 MET ME 1 127 PHE QD . . 4.840 3.471 3.035 4.540 . 0 0 "[ . 1 . 2]" 1
1851 1 126 MET QG 1 127 PHE H . . 4.670 3.484 3.267 4.091 . 0 0 "[ . 1 . 2]" 1
1852 1 126 MET HG2 1 127 PHE H . . 4.780 3.641 3.356 4.811 0.031 14 0 "[ . 1 . 2]" 1
1853 1 127 PHE H 1 127 PHE HB2 . . 3.740 2.303 2.241 2.382 . 0 0 "[ . 1 . 2]" 1
1854 1 127 PHE H 1 127 PHE QB . . 3.430 2.276 2.217 2.350 . 0 0 "[ . 1 . 2]" 1
1855 1 127 PHE H 1 127 PHE HB3 . . 3.980 3.563 3.531 3.595 . 0 0 "[ . 1 . 2]" 1
1856 1 127 PHE H 1 127 PHE QD . . 3.480 3.156 2.940 3.383 . 0 0 "[ . 1 . 2]" 1
1857 1 127 PHE HA 1 127 PHE QD . . 3.200 2.244 1.939 2.525 . 0 0 "[ . 1 . 2]" 1
1858 1 127 PHE HA 1 128 ALA HA . . 4.840 4.799 4.749 4.841 0.001 8 0 "[ . 1 . 2]" 1
1859 1 127 PHE HA 1 130 ALA MB . . 4.110 2.686 2.194 3.439 . 0 0 "[ . 1 . 2]" 1
1860 1 127 PHE QB 1 128 ALA H . . 4.270 2.932 2.734 3.105 . 0 0 "[ . 1 . 2]" 1
1861 1 127 PHE QB 1 128 ALA MB . . 4.500 4.094 3.922 4.274 . 0 0 "[ . 1 . 2]" 1
1862 1 127 PHE QB 1 130 ALA MB . . 4.630 4.016 3.469 4.289 . 0 0 "[ . 1 . 2]" 1
1863 1 127 PHE HB2 1 128 ALA MB . . 4.600 4.398 4.189 4.577 . 0 0 "[ . 1 . 2]" 1
1864 1 127 PHE HB3 1 128 ALA H . . 4.360 3.768 3.592 3.976 . 0 0 "[ . 1 . 2]" 1
1865 1 127 PHE HB3 1 130 ALA MB . . 4.740 4.214 3.560 4.512 . 0 0 "[ . 1 . 2]" 1
1866 1 128 ALA H 1 128 ALA MB . . 3.010 2.243 2.222 2.255 . 0 0 "[ . 1 . 2]" 1
1867 1 128 ALA H 1 129 GLN H . . 3.350 2.705 2.613 2.809 . 0 0 "[ . 1 . 2]" 1
1868 1 128 ALA H 1 130 ALA H . . 4.460 3.988 3.702 4.386 . 0 0 "[ . 1 . 2]" 1
1869 1 128 ALA MB 1 129 GLN H . . 3.560 2.421 2.183 2.747 . 0 0 "[ . 1 . 2]" 1
1870 1 128 ALA MB 1 129 GLN HB2 . . 4.670 4.481 4.254 4.685 0.015 12 0 "[ . 1 . 2]" 1
1871 1 128 ALA MB 1 129 GLN QB . . 4.560 4.211 4.061 4.381 . 0 0 "[ . 1 . 2]" 1
1872 1 128 ALA MB 1 129 GLN HE21 . . 5.060 4.183 2.585 5.018 . 0 0 "[ . 1 . 2]" 1
1873 1 128 ALA MB 1 129 GLN QE . . 4.930 4.015 2.551 4.696 . 0 0 "[ . 1 . 2]" 1
1874 1 128 ALA MB 1 129 GLN HG2 . . 4.480 3.512 2.892 4.270 . 0 0 "[ . 1 . 2]" 1
1875 1 128 ALA MB 1 129 GLN QG . . 3.940 2.977 2.766 3.130 . 0 0 "[ . 1 . 2]" 1
1876 1 128 ALA MB 1 129 GLN HG3 . . 4.370 3.810 2.834 4.662 0.292 12 0 "[ . 1 . 2]" 1
1877 1 129 GLN H 1 129 GLN HA . . 2.880 2.822 2.803 2.870 . 0 0 "[ . 1 . 2]" 1
1878 1 129 GLN H 1 129 GLN HB2 . . 3.110 2.482 2.321 2.573 . 0 0 "[ . 1 . 2]" 1
1879 1 129 GLN H 1 129 GLN QB . . 2.950 2.438 2.292 2.519 . 0 0 "[ . 1 . 2]" 1
1880 1 129 GLN H 1 129 GLN HB3 . . 3.650 3.575 3.552 3.590 . 0 0 "[ . 1 . 2]" 1
1881 1 129 GLN H 1 129 GLN HE21 . . 4.650 4.259 2.974 4.896 0.246 5 0 "[ . 1 . 2]" 1
1882 1 129 GLN H 1 129 GLN QE . . 4.540 4.091 2.940 4.634 0.094 5 0 "[ . 1 . 2]" 1
1883 1 129 GLN H 1 129 GLN HG2 . . 3.470 2.756 1.946 3.559 0.089 15 0 "[ . 1 . 2]" 1
1884 1 129 GLN H 1 129 GLN HG3 . . 3.450 2.813 1.996 3.538 0.088 13 0 "[ . 1 . 2]" 1
1885 1 129 GLN H 1 131 GLY H . . 4.770 4.060 3.820 4.845 0.075 17 0 "[ . 1 . 2]" 1
1886 1 129 GLN HA 1 129 GLN HG2 . . 3.310 2.726 2.491 3.085 . 0 0 "[ . 1 . 2]" 1
1887 1 129 GLN HA 1 129 GLN QG . . 3.200 2.621 2.365 2.957 . 0 0 "[ . 1 . 2]" 1
1888 1 129 GLN HA 1 132 MET ME . . 3.220 3.104 2.031 3.303 0.083 8 0 "[ . 1 . 2]" 1
1889 1 129 GLN QB 1 129 GLN QG . . 2.360 2.047 2.003 2.087 . 0 0 "[ . 1 . 2]" 1
1890 1 129 GLN QB 1 130 ALA H . . 3.520 2.823 2.229 3.414 . 0 0 "[ . 1 . 2]" 1
1891 1 129 GLN QB 1 131 GLY H . . 4.950 4.352 2.709 4.669 . 0 0 "[ . 1 . 2]" 1
1892 1 129 GLN HB2 1 129 GLN HE21 . . 4.450 4.264 4.038 4.540 0.090 12 0 "[ . 1 . 2]" 1
1893 1 129 GLN HB2 1 129 GLN HG2 . . 2.860 2.767 2.478 3.012 0.152 9 0 "[ . 1 . 2]" 1
1894 1 129 GLN HB2 1 130 ALA H . . 3.570 2.903 2.257 3.584 0.014 18 0 "[ . 1 . 2]" 1
1895 1 129 GLN HB3 1 131 GLY H . . 5.080 5.017 2.939 5.286 0.206 18 0 "[ . 1 . 2]" 1
1896 1 129 GLN QE 1 129 GLN QG . . 3.070 2.143 2.106 2.199 . 0 0 "[ . 1 . 2]" 1
1897 1 129 GLN QE 1 132 MET ME . . 4.340 3.662 2.206 4.431 0.091 9 0 "[ . 1 . 2]" 1
1898 1 129 GLN HE21 1 129 GLN HG3 . . 3.520 2.797 2.203 3.480 . 0 0 "[ . 1 . 2]" 1
1899 1 129 GLN HE21 1 132 MET ME . . 4.430 3.963 2.336 5.302 0.872 2 2 "[-+ . 1 . 2]" 1
1900 1 129 GLN QG 1 130 ALA H . . 4.850 4.090 3.795 4.321 . 0 0 "[ . 1 . 2]" 1
1901 1 129 GLN HG2 1 130 ALA H . . 4.970 4.686 4.148 5.217 0.247 18 0 "[ . 1 . 2]" 1
1902 1 130 ALA H 1 130 ALA MB . . 2.720 2.296 2.237 2.809 0.089 17 0 "[ . 1 . 2]" 1
1903 1 130 ALA H 1 131 GLY H . . 3.760 2.522 2.172 2.855 . 0 0 "[ . 1 . 2]" 1
1904 1 130 ALA HA 1 131 GLY H . . 3.270 3.300 3.197 3.388 0.118 5 0 "[ . 1 . 2]" 1
1905 1 130 ALA MB 1 131 GLY H . . 3.570 3.219 2.981 3.397 . 0 0 "[ . 1 . 2]" 1
1906 1 130 ALA MB 1 131 GLY HA2 . . 4.370 4.136 4.013 4.848 0.478 17 0 "[ . 1 . 2]" 1
1907 1 130 ALA MB 1 131 GLY QA . . 4.010 3.772 3.682 3.933 . 0 0 "[ . 1 . 2]" 1
1908 1 130 ALA MB 1 131 GLY HA3 . . 4.660 4.376 4.160 4.471 . 0 0 "[ . 1 . 2]" 1
1909 1 130 ALA MB 1 132 MET H . . 4.680 4.553 4.313 4.743 0.063 19 0 "[ . 1 . 2]" 1
1910 1 130 ALA MB 1 135 VAL MG1 . . 4.550 3.067 2.162 4.455 . 0 0 "[ . 1 . 2]" 1
1911 1 130 ALA MB 1 135 VAL MG2 . . 4.630 3.778 2.261 4.672 0.042 4 0 "[ . 1 . 2]" 1
1912 1 131 GLY H 1 132 MET H . . 2.960 2.101 1.831 2.341 . 0 0 "[ . 1 . 2]" 1
1913 1 131 GLY H 1 132 MET QB . . 3.990 4.056 3.788 4.179 0.189 19 0 "[ . 1 . 2]" 1
1914 1 132 MET H 1 132 MET QB . . 3.040 2.397 2.253 2.687 . 0 0 "[ . 1 . 2]" 1
1915 1 132 MET H 1 132 MET HG2 . . 3.880 3.650 1.927 4.056 0.176 12 0 "[ . 1 . 2]" 1
1916 1 132 MET H 1 132 MET HG3 . . 3.790 2.615 2.226 3.188 . 0 0 "[ . 1 . 2]" 1
1917 1 132 MET H 1 133 ASN H . . 3.750 2.556 2.089 3.131 . 0 0 "[ . 1 . 2]" 1
1918 1 132 MET HA 1 132 MET QB . . 2.620 2.385 2.169 2.462 . 0 0 "[ . 1 . 2]" 1
1919 1 132 MET HA 1 132 MET HG2 . . 3.560 2.580 2.412 3.717 0.157 19 0 "[ . 1 . 2]" 1
1920 1 132 MET HA 1 132 MET QG . . 3.230 2.447 2.289 3.301 0.071 19 0 "[ . 1 . 2]" 1
1921 1 132 MET HA 1 132 MET HG3 . . 3.700 3.064 2.849 3.693 . 0 0 "[ . 1 . 2]" 1
1922 1 132 MET QB 1 133 ASN H . . 3.510 2.318 1.783 3.508 . 0 0 "[ . 1 . 2]" 1
1923 1 132 MET ME 1 132 MET HG2 . . 3.100 2.552 2.366 3.339 0.239 12 0 "[ . 1 . 2]" 1
1924 1 132 MET ME 1 132 MET QG . . 2.820 2.228 2.202 2.321 . 0 0 "[ . 1 . 2]" 1
1925 1 132 MET ME 1 132 MET HG3 . . 3.240 2.509 2.302 3.353 0.113 19 0 "[ . 1 . 2]" 1
1926 1 133 ASN H 1 133 ASN HB2 . . 3.290 3.071 2.225 4.025 0.735 14 2 "[ . - +. 2]" 1
1927 1 133 ASN H 1 133 ASN QB . . 3.180 2.622 2.149 3.347 0.167 14 0 "[ . 1 . 2]" 1
1928 1 133 ASN H 1 133 ASN HD21 . . 4.510 4.420 1.750 4.881 0.371 14 0 "[ . 1 . 2]" 1
1929 1 133 ASN H 1 133 ASN QD . . 4.410 4.227 1.745 4.621 0.211 19 0 "[ . 1 . 2]" 1
1930 1 133 ASN HA 1 133 ASN HB2 . . 2.910 2.547 2.342 3.028 0.118 5 0 "[ . 1 . 2]" 1
1931 1 133 ASN HA 1 133 ASN QB . . 2.640 2.375 2.172 2.529 . 0 0 "[ . 1 . 2]" 1
1932 1 133 ASN HA 1 134 ASP H . . 2.810 2.408 2.097 3.482 0.672 15 1 "[ . 1 + 2]" 1
1933 1 133 ASN QB 1 133 ASN QD . . 2.930 2.380 2.106 2.716 . 0 0 "[ . 1 . 2]" 1
1934 1 133 ASN HB2 1 133 ASN HD21 . . 3.270 2.648 2.195 3.533 0.263 10 0 "[ . 1 . 2]" 1
1935 1 133 ASN HB2 1 133 ASN HD22 . . 4.010 3.662 3.452 4.073 0.063 5 0 "[ . 1 . 2]" 1
1936 1 134 ASP H 1 134 ASP QB . . 3.120 2.592 2.190 3.002 . 0 0 "[ . 1 . 2]" 1
1937 1 134 ASP H 1 135 VAL H . . 4.020 3.492 2.454 4.246 0.226 15 0 "[ . 1 . 2]" 1
1938 1 134 ASP HA 1 135 VAL H . . 2.840 2.457 2.132 2.978 0.138 9 0 "[ . 1 . 2]" 1
1939 1 134 ASP QB 1 135 VAL H . . 3.760 3.783 3.154 3.957 0.197 18 0 "[ . 1 . 2]" 1
1940 1 134 ASP QB 1 135 VAL HA . . 4.560 4.459 4.237 4.679 0.119 11 0 "[ . 1 . 2]" 1
1941 1 135 VAL H 1 135 VAL HB . . 3.140 2.931 2.565 3.291 0.151 11 0 "[ . 1 . 2]" 1
1942 1 135 VAL H 1 135 VAL MG1 . . 3.440 2.204 1.962 2.695 . 0 0 "[ . 1 . 2]" 1
1943 1 135 VAL H 1 135 VAL QG . . 3.240 2.192 1.956 2.658 . 0 0 "[ . 1 . 2]" 1
1944 1 135 VAL H 1 135 VAL MG2 . . 3.970 3.900 3.796 4.056 0.086 11 0 "[ . 1 . 2]" 1
1945 1 135 VAL H 1 136 SER H . . 3.350 2.166 1.778 3.469 0.119 7 0 "[ . 1 . 2]" 1
1946 1 135 VAL HA 1 135 VAL HB . . 2.740 2.505 2.376 2.538 . 0 0 "[ . 1 . 2]" 1
1947 1 135 VAL HA 1 135 VAL MG1 . . 3.570 3.210 3.195 3.221 . 0 0 "[ . 1 . 2]" 1
1948 1 135 VAL HA 1 135 VAL QG . . 2.950 2.273 2.235 2.384 . 0 0 "[ . 1 . 2]" 1
1949 1 135 VAL HA 1 135 VAL MG2 . . 3.140 2.325 2.280 2.459 . 0 0 "[ . 1 . 2]" 1
1950 1 135 VAL HA 1 136 SER H . . 3.040 3.101 2.378 3.452 0.412 8 0 "[ . 1 . 2]" 1
1951 1 135 VAL HB 1 136 SER H . . 4.460 4.304 3.797 4.547 0.087 7 0 "[ . 1 . 2]" 1
1952 1 135 VAL QG 1 136 SER H . . 4.350 3.035 1.784 3.542 . 0 0 "[ . 1 . 2]" 1
1953 1 135 VAL QG 1 137 ALA H . . 4.940 3.850 2.098 4.651 . 0 0 "[ . 1 . 2]" 1
1954 1 135 VAL MG1 1 136 SER H . . 5.200 3.146 1.794 4.117 . 0 0 "[ . 1 . 2]" 1
1955 1 135 VAL MG2 1 136 SER H . . 4.780 4.138 3.133 4.286 . 0 0 "[ . 1 . 2]" 1
1956 1 136 SER H 1 136 SER QB . . 3.540 2.696 2.439 3.355 . 0 0 "[ . 1 . 2]" 1
1957 1 136 SER H 1 137 ALA H . . 3.910 3.423 2.371 4.030 0.120 6 0 "[ . 1 . 2]" 1
1958 1 136 SER HA 1 137 ALA H . . 2.930 2.515 2.158 3.102 0.172 19 0 "[ . 1 . 2]" 1
1959 1 136 SER QB 1 137 ALA H . . 3.880 3.775 3.485 3.959 0.079 1 0 "[ . 1 . 2]" 1
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