NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
569157 |
2mcz   |
19459 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mcz
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 2546
_Distance_constraint_stats_list.Viol_count 5486
_Distance_constraint_stats_list.Viol_total 18656.633
_Distance_constraint_stats_list.Viol_max 1.047
_Distance_constraint_stats_list.Viol_rms 0.0720
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0183
_Distance_constraint_stats_list.Viol_average_violations_only 0.1700
_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 7 GLN 10.534 0.538 1 1 "[+ . 1 . 2]"
1 8 CYS 13.422 0.516 20 1 "[ . 1 . +]"
1 9 ASN 4.092 0.516 20 1 "[ . 1 . +]"
1 10 ALA 9.107 0.531 3 1 "[ + . 1 . 2]"
1 11 PRO 24.219 0.684 8 4 "[ . + * * . *2]"
1 12 GLU 13.329 0.733 6 5 "[ .+ - * . **2]"
1 13 TRP 6.055 0.468 5 0 "[ . 1 . 2]"
1 14 LEU 20.290 0.459 20 0 "[ . 1 . 2]"
1 15 PRO 6.523 0.399 18 0 "[ . 1 . 2]"
1 16 PHE 19.991 0.946 20 1 "[ . 1 . +]"
1 17 ALA 10.706 0.461 15 0 "[ . 1 . 2]"
1 18 ARG 0.957 0.333 1 0 "[ . 1 . 2]"
1 19 PRO 23.327 0.857 8 17 "[* -****+ ********* *]"
1 20 THR 28.559 0.720 17 14 "[* **.** 1******+- *]"
1 21 GLN 49.440 0.857 8 13 "[* * * *+ 1* **.***-*]"
1 22 LEU 36.246 0.734 13 13 "[* * .**-*1 *+ .*****]"
1 23 THR 11.883 0.654 20 3 "[ . - 1 . * +]"
1 24 ASP 14.729 0.566 3 7 "[ + .-** 1* . **]"
1 25 GLU 16.327 0.734 13 9 "[ *** **1 *+ .* - 2]"
1 26 PHE 27.256 0.537 13 4 "[ .-* 1* + . 2]"
1 27 GLU 15.213 0.557 4 5 "[ *+* * 1 . - 2]"
1 28 PHE 9.086 0.538 1 1 "[+ . 1 . 2]"
1 29 PRO 2.016 0.242 3 0 "[ . 1 . 2]"
1 30 ILE 9.673 0.593 6 2 "[ .+ 1 - . 2]"
1 31 GLY 5.381 0.337 20 0 "[ . 1 . 2]"
1 32 THR 14.128 0.693 14 1 "[ . 1 +. 2]"
1 33 TYR 15.965 0.516 17 1 "[ . 1 . + 2]"
1 34 LEU 25.697 0.832 8 5 "[ . + 1* **. -]"
1 35 ASN 29.588 0.511 19 1 "[ . 1 . +2]"
1 36 TYR 30.875 0.681 10 8 "[* - ** + * ** 2]"
1 37 GLU 4.886 0.417 11 0 "[ . 1 . 2]"
1 38 CYS 3.669 0.417 11 0 "[ . 1 . 2]"
1 39 ARG 4.231 0.519 7 1 "[ . + 1 . 2]"
1 40 PRO 0.530 0.268 4 0 "[ . 1 . 2]"
1 41 GLY 1.465 0.323 7 0 "[ . 1 . 2]"
1 42 TYR 10.478 0.946 20 2 "[ . - 1 . +]"
1 43 SER 15.616 0.579 20 2 "[- . 1 . +]"
1 44 GLY 8.582 0.672 2 3 "[-+ . 1 *. 2]"
1 45 ARG 5.223 0.672 2 2 "[ + . -1 . 2]"
1 46 PRO 5.900 0.615 9 1 "[ . +1 . 2]"
1 47 PHE 6.467 0.429 2 0 "[ . 1 . 2]"
1 48 SER 5.880 0.487 12 0 "[ . 1 . 2]"
1 49 ILE 19.721 0.496 12 0 "[ . 1 . 2]"
1 50 ILE 32.212 0.652 12 2 "[ . 1 +- . 2]"
1 51 CYS 8.175 0.693 14 1 "[ . 1 +. 2]"
1 52 LEU 32.973 0.618 16 7 "[ * .* * * .+- *2]"
1 53 LYS 17.753 0.753 3 8 "[* +*. * 1*- . **]"
1 54 ASN 5.757 0.553 1 2 "[+ . 1 . -]"
1 55 SER 8.307 0.488 11 0 "[ . 1 . 2]"
1 56 VAL 7.923 0.618 16 4 "[ * . * .+ -2]"
1 57 TRP 22.805 0.425 1 0 "[ . 1 . 2]"
1 58 THR 22.607 0.652 12 2 "[ . 1 +- . 2]"
1 59 GLY 3.306 0.434 8 0 "[ . 1 . 2]"
1 60 ALA 9.052 0.489 2 0 "[ . 1 . 2]"
1 61 LYS 29.712 0.731 13 14 "[* * -** *** +** * **]"
1 62 ASP 10.589 0.606 19 2 "[ . 1 . - +2]"
1 63 ARG 22.310 0.606 19 8 "[* * - * ** . +*]"
1 64 CYS 23.990 0.579 20 3 "[- *. 1 . +]"
1 65 ARG 13.801 0.553 4 2 "[ +. 1 -. 2]"
1 66 ARG 27.273 0.659 6 3 "[ * .+ 1 . - 2]"
1 67 LYS 33.129 0.789 11 11 "[ * .*** -+**** * 2]"
1 68 SER 20.450 0.789 11 10 "[ .*** -+**** * 2]"
1 69 CYS 10.628 0.692 17 1 "[ . 1 . + 2]"
1 70 ARG 14.927 0.654 2 1 "[ + . 1 . 2]"
1 71 ASN 15.944 0.586 18 2 "[ - . 1 . + 2]"
1 73 PRO 6.572 0.586 18 2 "[ - . 1 . + 2]"
1 74 ASP 10.594 0.491 18 0 "[ . 1 . 2]"
1 75 PRO 6.947 0.527 9 2 "[ . - +1 . 2]"
1 76 VAL 1.154 0.474 11 0 "[ . 1 . 2]"
1 77 ASN 5.313 0.682 19 3 "[ . 1 .-* +2]"
1 78 GLY 5.323 0.554 9 3 "[ *-. +1 . 2]"
1 79 MET 23.991 0.933 9 6 "[ **.* +1 . * *2]"
1 80 VAL 30.322 0.716 12 7 "[ .*- ** +* . *]"
1 81 HIS 11.178 0.356 6 0 "[ . 1 . 2]"
1 82 VAL 10.616 0.510 15 1 "[ . 1 + 2]"
1 83 ILE 19.670 0.372 8 0 "[ . 1 . 2]"
1 84 LYS 13.252 0.468 15 0 "[ . 1 . 2]"
1 85 GLY 5.351 0.430 1 0 "[ . 1 . 2]"
1 86 ILE 16.362 0.565 12 1 "[ . 1 + . 2]"
1 87 GLN 23.689 0.718 16 5 "[ . * 1 * .+* -]"
1 88 PHE 28.517 0.659 6 3 "[ .+ 1 . - *]"
1 89 GLY 1.997 0.245 19 0 "[ . 1 . 2]"
1 90 SER 2.608 0.454 1 0 "[ . 1 . 2]"
1 91 GLN 23.262 0.443 1 0 "[ . 1 . 2]"
1 92 ILE 13.742 0.654 1 1 "[+ . 1 . 2]"
1 93 LYS 37.261 0.802 7 9 "[* *** +* - . **]"
1 94 TYR 15.428 0.716 12 9 "[ **.*-*** + . *]"
1 95 SER 14.107 0.844 17 8 "[ * * ** - . + **]"
1 96 CYS 16.956 0.622 19 5 "[ *.- 1 ** +2]"
1 97 THR 23.555 0.933 9 6 "[ .* +1 * .-* *2]"
1 98 LYS 29.416 1.047 9 20 [*******-+***********]
1 99 GLY 11.788 1.047 9 3 "[ .* +1 - 2]"
1 100 TYR 31.785 0.941 8 10 "[ * ** +** *.-* *]"
1 101 ARG 28.529 0.859 4 12 "[* +-*** ** *. * **]"
1 102 LEU 39.855 0.684 15 5 "[ **.- 1 +* 2]"
1 103 ILE 8.447 0.684 15 2 "[ - . 1 + 2]"
1 104 GLY 7.518 0.537 16 2 "[ - . 1 .+ 2]"
1 105 SER 14.938 0.688 9 2 "[ . +1- . 2]"
1 106 SER 8.807 0.356 16 0 "[ . 1 . 2]"
1 107 SER 14.553 0.758 8 4 "[ *-. + * . 2]"
1 108 ALA 10.822 0.511 6 1 "[ .+ 1 . 2]"
1 109 THR 6.627 0.258 15 0 "[ . 1 . 2]"
1 110 CYS 3.162 0.300 15 0 "[ . 1 . 2]"
1 111 ILE 7.590 0.302 19 0 "[ . 1 . 2]"
1 112 ILE 18.717 0.564 20 2 "[ - . 1 . +]"
1 113 SER 7.505 0.388 14 0 "[ . 1 . 2]"
1 114 GLY 1.162 0.171 7 0 "[ . 1 . 2]"
1 115 ASP 4.221 0.278 17 0 "[ . 1 . 2]"
1 116 THR 9.024 0.388 14 0 "[ . 1 . 2]"
1 117 VAL 21.212 0.718 16 4 "[ - . * 1 .+ * 2]"
1 118 ILE 5.287 0.425 7 0 "[ . 1 . 2]"
1 119 TRP 25.222 0.654 2 2 "[ + . 1 . * 2]"
1 120 ASP 2.616 0.302 19 0 "[ . 1 . 2]"
1 121 GLN 13.004 0.688 9 2 "[ . +1- . 2]"
1 122 GLU 13.905 0.511 6 1 "[ .+ 1 . 2]"
1 123 THR 3.020 0.313 3 0 "[ . 1 . 2]"
1 124 PRO 1.420 0.247 16 0 "[ . 1 . 2]"
1 125 ILE 29.145 0.627 19 8 "[* - . * 1* .* *+*]"
1 126 CYS 10.865 0.437 13 0 "[ . 1 . 2]"
1 127 ASP 21.732 0.859 4 10 "[* +-* * 1* *. * **]"
1 128 ARG 11.209 0.596 8 3 "[ . +*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 7 GLN H 1 7 GLN HB2 2.325 . 2.929 2.434 2.191 2.868 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLN H 1 7 GLN HB3 2.775 . 3.896 3.614 3.374 3.873 . 0 0 "[ . 1 . 2]" 1
3 1 7 GLN H 1 7 GLN HE21 3.050 . 4.488 3.027 1.731 3.851 0.069 6 0 "[ . 1 . 2]" 1
4 1 7 GLN H 1 7 GLN HE22 3.395 . 5.229 4.545 2.661 5.393 0.164 20 0 "[ . 1 . 2]" 1
5 1 7 GLN H 1 8 CYS H 2.775 . 3.896 2.741 2.302 3.061 . 0 0 "[ . 1 . 2]" 1
6 1 7 GLN H 1 8 CYS HB2 3.650 . 5.778 4.987 4.201 5.559 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLN H 1 9 ASN H 3.650 . 5.778 2.757 1.907 3.880 . 0 0 "[ . 1 . 2]" 1
8 1 7 GLN H 1 28 PHE H 3.535 . 5.530 4.173 3.222 4.787 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLN H 1 28 PHE HA 3.630 . 5.734 5.739 4.643 6.272 0.538 1 1 "[+ . 1 . 2]" 1
10 1 7 GLN HA 1 9 ASN H 3.095 . 4.584 4.236 3.952 4.554 . 0 0 "[ . 1 . 2]" 1
11 1 7 GLN HB2 1 7 GLN HE21 2.405 . 3.101 2.731 1.766 3.323 0.223 10 0 "[ . 1 . 2]" 1
12 1 7 GLN HB2 1 7 GLN HE22 2.665 . 3.660 3.642 3.124 3.870 0.210 4 0 "[ . 1 . 2]" 1
13 1 7 GLN HB2 1 9 ASN H 3.235 . 4.885 3.870 3.327 4.592 . 0 0 "[ . 1 . 2]" 1
14 1 7 GLN HB2 1 28 PHE H 2.660 . 3.649 3.359 2.786 3.895 0.246 6 0 "[ . 1 . 2]" 1
15 1 7 GLN HB3 1 7 GLN HE21 2.955 . 4.283 3.887 3.355 4.138 . 0 0 "[ . 1 . 2]" 1
16 1 7 GLN HB3 1 7 GLN HE22 3.430 . 5.305 4.573 4.389 5.062 . 0 0 "[ . 1 . 2]" 1
17 1 7 GLN HB3 1 8 CYS H 2.625 . 3.574 2.869 2.602 3.411 . 0 0 "[ . 1 . 2]" 1
18 1 7 GLN HE21 1 8 CYS H 3.020 . 4.423 4.345 2.982 4.783 0.360 4 0 "[ . 1 . 2]" 1
19 1 7 GLN HE21 1 27 GLU QB 2.785 . 3.918 3.106 2.508 4.066 0.149 10 0 "[ . 1 . 2]" 1
20 1 7 GLN HE21 1 29 PRO HA 3.375 . 5.186 4.598 3.511 5.245 0.058 9 0 "[ . 1 . 2]" 1
21 1 7 GLN HE21 1 29 PRO QD 3.500 . 5.455 4.449 3.778 5.600 0.145 10 0 "[ . 1 . 2]" 1
22 1 7 GLN HE22 1 27 GLU QB 2.775 . 3.896 3.985 3.657 4.281 0.385 6 0 "[ . 1 . 2]" 1
23 1 7 GLN HE22 1 29 PRO HA 3.455 . 5.358 4.036 2.300 5.044 . 0 0 "[ . 1 . 2]" 1
24 1 7 GLN HE22 1 29 PRO QD 3.505 . 5.466 3.220 2.598 4.545 . 0 0 "[ . 1 . 2]" 1
25 1 8 CYS H 1 8 CYS HB2 2.655 . 3.638 2.728 2.298 3.247 . 0 0 "[ . 1 . 2]" 1
26 1 8 CYS H 1 8 CYS HB3 2.835 . 4.025 3.637 3.499 3.842 . 0 0 "[ . 1 . 2]" 1
27 1 8 CYS H 1 9 ASN H 2.930 . 4.229 2.403 2.176 2.818 . 0 0 "[ . 1 . 2]" 1
28 1 8 CYS H 1 27 GLU HA 2.945 . 4.262 3.736 3.056 4.212 . 0 0 "[ . 1 . 2]" 1
29 1 8 CYS H 1 28 PHE H 2.740 . 3.821 2.857 2.239 3.306 . 0 0 "[ . 1 . 2]" 1
30 1 8 CYS H 1 28 PHE HB2 3.545 . 5.552 4.883 4.101 5.670 0.118 18 0 "[ . 1 . 2]" 1
31 1 8 CYS H 1 57 TRP HE1 3.495 . 5.444 5.559 5.287 5.769 0.325 15 0 "[ . 1 . 2]" 1
32 1 8 CYS H 1 57 TRP HZ2 3.325 . 5.079 5.005 4.428 5.452 0.373 8 0 "[ . 1 . 2]" 1
33 1 8 CYS HA 1 9 ASN H 2.615 . 3.552 3.361 3.079 3.431 . 0 0 "[ . 1 . 2]" 1
34 1 8 CYS HA 1 9 ASN QB 3.315 . 5.057 4.082 3.820 4.678 . 0 0 "[ . 1 . 2]" 1
35 1 8 CYS HA 1 9 ASN QD 3.650 . 5.778 4.991 3.268 6.294 0.516 20 1 "[ . 1 . +]" 1
36 1 8 CYS HA 1 57 TRP HE1 3.290 . 5.003 4.670 4.081 5.388 0.384 15 0 "[ . 1 . 2]" 1
37 1 8 CYS HB2 1 9 ASN H 3.295 . 5.014 3.238 2.865 3.691 . 0 0 "[ . 1 . 2]" 1
38 1 8 CYS HB2 1 10 ALA MB 3.480 . 5.412 5.122 4.800 5.643 0.231 16 0 "[ . 1 . 2]" 1
39 1 8 CYS HB2 1 11 PRO HA 3.650 . 5.778 5.312 4.273 6.013 0.236 8 0 "[ . 1 . 2]" 1
40 1 8 CYS HB2 1 11 PRO HB3 3.650 . 5.778 5.865 5.231 6.104 0.327 1 0 "[ . 1 . 2]" 1
41 1 8 CYS HB2 1 57 TRP HD1 3.360 . 5.154 5.022 4.115 5.452 0.298 10 0 "[ . 1 . 2]" 1
42 1 8 CYS HB2 1 57 TRP HE1 2.650 . 3.628 2.986 2.472 3.417 . 0 0 "[ . 1 . 2]" 1
43 1 8 CYS HB2 1 57 TRP HZ2 3.345 . 5.122 2.680 2.377 3.036 . 0 0 "[ . 1 . 2]" 1
44 1 8 CYS HB3 1 28 PHE H 3.550 . 5.563 4.579 3.968 5.373 . 0 0 "[ . 1 . 2]" 1
45 1 8 CYS HB3 1 57 TRP HD1 3.070 . 4.530 3.937 3.491 4.353 . 0 0 "[ . 1 . 2]" 1
46 1 8 CYS HB3 1 57 TRP HE1 2.500 . 3.305 2.695 2.145 3.598 0.293 2 0 "[ . 1 . 2]" 1
47 1 8 CYS HB3 1 57 TRP HZ2 2.975 . 4.326 3.371 2.847 4.250 . 0 0 "[ . 1 . 2]" 1
48 1 9 ASN H 1 9 ASN QB 2.385 . 3.058 2.991 2.777 3.298 0.240 4 0 "[ . 1 . 2]" 1
49 1 9 ASN H 1 9 ASN QD 3.335 . 5.100 3.991 2.669 5.031 . 0 0 "[ . 1 . 2]" 1
50 1 9 ASN H 1 10 ALA H 2.835 . 4.025 2.692 2.376 2.865 . 0 0 "[ . 1 . 2]" 1
51 1 9 ASN H 1 10 ALA MB 3.425 . 5.294 4.791 4.565 4.968 . 0 0 "[ . 1 . 2]" 1
52 1 9 ASN H 1 28 PHE H 3.285 . 4.993 4.122 3.270 4.792 . 0 0 "[ . 1 . 2]" 1
53 1 9 ASN H 1 57 TRP HZ2 3.650 . 5.778 5.514 4.943 5.963 0.186 16 0 "[ . 1 . 2]" 1
54 1 9 ASN HA 1 9 ASN QD 3.070 . 4.530 3.283 1.618 4.145 0.182 12 0 "[ . 1 . 2]" 1
55 1 9 ASN HA 1 10 ALA H 2.405 . 3.101 2.813 2.587 2.956 . 0 0 "[ . 1 . 2]" 1
56 1 9 ASN HA 1 10 ALA MB 2.785 . 3.918 3.730 3.435 3.919 0.001 20 0 "[ . 1 . 2]" 1
57 1 9 ASN HA 1 27 GLU QG 3.260 . 4.939 2.904 1.883 5.234 0.295 3 0 "[ . 1 . 2]" 1
58 1 9 ASN QB 1 10 ALA MB 3.100 . 4.595 4.263 3.571 4.670 0.075 15 0 "[ . 1 . 2]" 1
59 1 9 ASN QD 1 10 ALA H 3.410 . 5.261 4.736 3.831 5.308 0.046 17 0 "[ . 1 . 2]" 1
60 1 9 ASN QD 1 10 ALA MB 3.650 . 5.778 4.743 3.289 5.665 . 0 0 "[ . 1 . 2]" 1
61 1 10 ALA H 1 10 ALA MB 2.355 . 2.993 2.870 2.725 3.009 0.016 10 0 "[ . 1 . 2]" 1
62 1 10 ALA H 1 26 PHE HA 3.380 . 5.197 5.018 4.426 5.432 0.235 2 0 "[ . 1 . 2]" 1
63 1 10 ALA H 1 27 GLU H 3.535 . 5.530 5.112 4.734 5.658 0.127 7 0 "[ . 1 . 2]" 1
64 1 10 ALA H 1 27 GLU HA 2.815 . 3.982 2.996 2.332 3.416 . 0 0 "[ . 1 . 2]" 1
65 1 10 ALA H 1 27 GLU QB 3.570 . 5.606 4.354 3.484 5.265 . 0 0 "[ . 1 . 2]" 1
66 1 10 ALA H 1 28 PHE H 3.210 . 4.832 4.266 3.571 4.864 0.033 8 0 "[ . 1 . 2]" 1
67 1 10 ALA H 1 57 TRP HE1 2.865 . 4.090 3.671 3.091 4.200 0.110 19 0 "[ . 1 . 2]" 1
68 1 10 ALA H 1 57 TRP HZ2 3.450 . 5.347 4.051 3.505 4.604 . 0 0 "[ . 1 . 2]" 1
69 1 10 ALA HA 1 11 PRO HD2 2.780 . 3.907 2.162 1.941 2.667 . 0 0 "[ . 1 . 2]" 1
70 1 10 ALA HA 1 11 PRO QG 3.220 . 4.853 3.838 3.754 3.941 . 0 0 "[ . 1 . 2]" 1
71 1 10 ALA HA 1 26 PHE H 3.575 . 5.616 5.589 5.225 5.769 0.153 7 0 "[ . 1 . 2]" 1
72 1 10 ALA HA 1 26 PHE HA 3.310 . 5.047 3.474 3.052 3.860 . 0 0 "[ . 1 . 2]" 1
73 1 10 ALA HA 1 26 PHE HB3 3.165 . 4.735 2.992 2.476 3.993 . 0 0 "[ . 1 . 2]" 1
74 1 10 ALA HA 1 26 PHE QD 3.105 . 4.606 3.740 3.081 4.406 . 0 0 "[ . 1 . 2]" 1
75 1 10 ALA HA 1 27 GLU H 3.560 . 5.584 5.042 4.638 5.527 . 0 0 "[ . 1 . 2]" 1
76 1 10 ALA HA 1 34 LEU QD 3.480 . 5.412 4.877 4.371 5.220 . 0 0 "[ . 1 . 2]" 1
77 1 10 ALA HA 1 57 TRP HZ2 3.630 . 5.734 3.711 3.133 4.449 . 0 0 "[ . 1 . 2]" 1
78 1 10 ALA MB 1 11 PRO HA 3.170 . 4.746 4.606 4.361 4.773 0.027 1 0 "[ . 1 . 2]" 1
79 1 10 ALA MB 1 11 PRO HD2 3.025 . 4.434 2.781 2.479 3.197 . 0 0 "[ . 1 . 2]" 1
80 1 10 ALA MB 1 11 PRO HD3 2.705 . 3.746 3.732 3.223 4.015 0.270 5 0 "[ . 1 . 2]" 1
81 1 10 ALA MB 1 11 PRO QG 3.150 . 4.702 4.115 3.700 4.551 . 0 0 "[ . 1 . 2]" 1
82 1 10 ALA MB 1 12 GLU H 3.450 . 5.347 3.821 2.876 5.378 0.030 8 0 "[ . 1 . 2]" 1
83 1 10 ALA MB 1 26 PHE HA 2.495 . 3.294 3.406 2.396 3.648 0.354 6 0 "[ . 1 . 2]" 1
84 1 10 ALA MB 1 26 PHE HB2 2.710 . 3.757 3.208 2.906 3.774 0.018 19 0 "[ . 1 . 2]" 1
85 1 10 ALA MB 1 26 PHE QD 2.455 . 3.208 2.263 1.878 2.865 . 0 0 "[ . 1 . 2]" 1
86 1 10 ALA MB 1 27 GLU HA 3.195 . 4.799 4.365 3.755 4.699 . 0 0 "[ . 1 . 2]" 1
87 1 10 ALA MB 1 27 GLU QG 3.050 . 4.488 3.396 2.383 5.019 0.531 3 1 "[ + . 1 . 2]" 1
88 1 10 ALA MB 1 34 LEU QD 3.565 . 5.595 5.378 4.851 5.708 0.113 2 0 "[ . 1 . 2]" 1
89 1 10 ALA MB 1 57 TRP HE1 3.160 . 4.724 4.505 4.250 4.904 0.180 19 0 "[ . 1 . 2]" 1
90 1 10 ALA MB 1 57 TRP HZ2 3.405 . 5.251 5.116 4.650 5.574 0.324 10 0 "[ . 1 . 2]" 1
91 1 11 PRO HA 1 12 GLU H 2.660 . 3.649 3.423 2.136 3.557 . 0 0 "[ . 1 . 2]" 1
92 1 11 PRO HA 1 12 GLU QB 3.255 . 4.928 4.413 3.937 4.796 . 0 0 "[ . 1 . 2]" 1
93 1 11 PRO HA 1 12 GLU QG 3.570 . 5.606 4.447 3.697 5.886 0.281 6 0 "[ . 1 . 2]" 1
94 1 11 PRO HA 1 49 ILE MD 3.050 . 4.488 4.066 3.652 4.506 0.018 12 0 "[ . 1 . 2]" 1
95 1 11 PRO HA 1 57 TRP HB2 3.025 . 4.434 4.227 3.926 4.439 0.005 8 0 "[ . 1 . 2]" 1
96 1 11 PRO HA 1 57 TRP HD1 2.835 . 4.025 2.190 1.834 2.544 . 0 0 "[ . 1 . 2]" 1
97 1 11 PRO HA 1 57 TRP HE1 3.130 . 4.660 2.410 1.877 2.985 . 0 0 "[ . 1 . 2]" 1
98 1 11 PRO HA 1 57 TRP HZ2 3.490 . 5.433 4.833 3.716 5.502 0.068 17 0 "[ . 1 . 2]" 1
99 1 11 PRO HB2 1 12 GLU H 2.515 . 3.337 2.391 1.706 2.962 0.094 14 0 "[ . 1 . 2]" 1
100 1 11 PRO HB2 1 12 GLU HA 3.185 . 4.778 4.585 4.151 4.948 0.170 3 0 "[ . 1 . 2]" 1
101 1 11 PRO HB2 1 12 GLU QG 2.885 . 4.133 3.355 2.241 4.511 0.378 18 0 "[ . 1 . 2]" 1
102 1 11 PRO HB2 1 49 ILE MD 2.385 . 3.058 2.957 2.553 3.318 0.260 15 0 "[ . 1 . 2]" 1
103 1 11 PRO HB2 1 57 TRP HD1 3.210 . 4.832 4.330 3.637 4.994 0.162 13 0 "[ . 1 . 2]" 1
104 1 11 PRO HB2 1 57 TRP HE1 3.365 . 5.165 4.390 4.116 4.676 . 0 0 "[ . 1 . 2]" 1
105 1 11 PRO HB3 1 12 GLU H 2.635 . 3.595 3.630 3.244 3.915 0.319 5 0 "[ . 1 . 2]" 1
106 1 11 PRO HB3 1 12 GLU QG 3.570 . 5.606 4.619 3.565 5.964 0.359 18 0 "[ . 1 . 2]" 1
107 1 11 PRO HB3 1 36 TYR QE 3.505 . 5.466 4.914 4.280 5.486 0.020 12 0 "[ . 1 . 2]" 1
108 1 11 PRO HB3 1 49 ILE HB 3.110 . 4.616 4.586 4.086 5.034 0.418 15 0 "[ . 1 . 2]" 1
109 1 11 PRO HB3 1 49 ILE MD 2.440 . 3.176 2.252 1.941 2.644 . 0 0 "[ . 1 . 2]" 1
110 1 11 PRO HB3 1 57 TRP HB2 3.125 . 4.649 3.994 3.156 4.644 . 0 0 "[ . 1 . 2]" 1
111 1 11 PRO HB3 1 57 TRP HD1 3.030 . 4.444 3.118 2.438 3.965 . 0 0 "[ . 1 . 2]" 1
112 1 11 PRO HB3 1 57 TRP HE1 2.970 . 4.315 3.150 2.868 3.649 . 0 0 "[ . 1 . 2]" 1
113 1 11 PRO HD2 1 12 GLU H 3.145 . 4.692 3.129 2.487 5.376 0.684 8 1 "[ . + 1 . 2]" 1
114 1 11 PRO HD2 1 26 PHE H 3.580 . 5.627 5.799 5.135 6.164 0.537 13 1 "[ . 1 + . 2]" 1
115 1 11 PRO HD2 1 26 PHE HA 3.640 . 5.756 3.355 2.958 3.893 . 0 0 "[ . 1 . 2]" 1
116 1 11 PRO HD2 1 26 PHE HB3 3.250 . 4.918 3.944 3.279 5.122 0.205 3 0 "[ . 1 . 2]" 1
117 1 11 PRO HD2 1 26 PHE QD 3.220 . 4.853 3.330 2.448 4.223 . 0 0 "[ . 1 . 2]" 1
118 1 11 PRO HD2 1 26 PHE QE 3.650 . 5.778 5.222 4.414 5.873 0.096 19 0 "[ . 1 . 2]" 1
119 1 11 PRO HD2 1 28 PHE QD 3.650 . 5.778 5.371 4.436 6.029 0.252 5 0 "[ . 1 . 2]" 1
120 1 11 PRO HD2 1 34 LEU QD 3.025 . 4.434 4.027 3.404 4.632 0.199 2 0 "[ . 1 . 2]" 1
121 1 11 PRO HD2 1 36 TYR QE 3.515 . 5.487 5.585 5.151 5.937 0.450 14 0 "[ . 1 . 2]" 1
122 1 11 PRO HD2 1 57 TRP HE1 3.650 . 5.778 3.848 3.291 4.839 . 0 0 "[ . 1 . 2]" 1
123 1 11 PRO HD2 1 57 TRP HZ2 3.205 . 4.821 3.927 3.558 4.723 . 0 0 "[ . 1 . 2]" 1
124 1 11 PRO HD3 1 12 GLU H 3.210 . 4.832 4.082 3.722 5.346 0.514 8 1 "[ . + 1 . 2]" 1
125 1 11 PRO HD3 1 26 PHE QD 3.615 . 5.702 4.847 4.012 5.727 0.025 3 0 "[ . 1 . 2]" 1
126 1 11 PRO HD3 1 28 PHE QD 3.410 . 5.261 4.465 3.212 5.322 0.060 5 0 "[ . 1 . 2]" 1
127 1 11 PRO HD3 1 34 LEU QD 2.880 . 4.122 3.489 2.967 3.867 . 0 0 "[ . 1 . 2]" 1
128 1 11 PRO HD3 1 57 TRP HD1 3.650 . 5.778 4.654 4.002 5.927 0.149 10 0 "[ . 1 . 2]" 1
129 1 11 PRO QG 1 12 GLU H 3.085 . 4.563 2.362 1.781 4.090 0.019 4 0 "[ . 1 . 2]" 1
130 1 11 PRO QG 1 12 GLU HA 3.200 . 4.810 4.690 4.178 5.417 0.607 19 2 "[ . - . +2]" 1
131 1 11 PRO QG 1 26 PHE HA 3.650 . 5.778 4.608 3.824 5.366 . 0 0 "[ . 1 . 2]" 1
132 1 11 PRO QG 1 34 LEU QD 2.980 . 4.337 2.780 2.180 3.611 . 0 0 "[ . 1 . 2]" 1
133 1 11 PRO QG 1 49 ILE MD 2.720 . 3.778 2.153 1.790 2.783 0.010 17 0 "[ . 1 . 2]" 1
134 1 11 PRO QG 1 57 TRP HE1 3.485 . 5.423 3.579 2.856 4.240 . 0 0 "[ . 1 . 2]" 1
135 1 12 GLU H 1 12 GLU QB 2.765 . 3.875 3.362 2.616 3.493 . 0 0 "[ . 1 . 2]" 1
136 1 12 GLU H 1 12 GLU QG 2.540 . 3.391 3.333 2.248 4.124 0.733 6 2 "[ .+ 1 . - 2]" 1
137 1 12 GLU H 1 13 TRP H 3.190 . 4.788 4.312 4.146 4.662 . 0 0 "[ . 1 . 2]" 1
138 1 12 GLU H 1 49 ILE MD 3.070 . 4.530 4.574 4.125 4.945 0.415 3 0 "[ . 1 . 2]" 1
139 1 12 GLU HA 1 12 GLU QB 2.185 . 2.628 2.222 2.184 2.406 . 0 0 "[ . 1 . 2]" 1
140 1 12 GLU HA 1 12 GLU QG 2.665 . 3.660 3.325 2.864 3.523 . 0 0 "[ . 1 . 2]" 1
141 1 12 GLU HA 1 13 TRP H 2.305 . 2.886 2.567 2.320 2.821 . 0 0 "[ . 1 . 2]" 1
142 1 12 GLU QB 1 13 TRP H 2.775 . 3.896 2.277 1.751 3.405 0.049 20 0 "[ . 1 . 2]" 1
143 1 12 GLU QG 1 13 TRP H 3.025 . 4.434 3.008 2.039 3.865 . 0 0 "[ . 1 . 2]" 1
144 1 12 GLU QG 1 13 TRP HA 3.350 . 5.133 4.033 3.515 5.601 0.468 5 0 "[ . 1 . 2]" 1
145 1 12 GLU QG 1 14 LEU H 3.570 . 5.606 4.296 3.561 5.913 0.307 5 0 "[ . 1 . 2]" 1
146 1 12 GLU QG 1 14 LEU QD 3.165 . 4.735 3.476 2.645 4.513 . 0 0 "[ . 1 . 2]" 1
147 1 13 TRP H 1 13 TRP HB2 2.445 . 3.187 2.890 2.656 3.130 . 0 0 "[ . 1 . 2]" 1
148 1 13 TRP H 1 13 TRP HB3 2.445 . 3.187 2.459 2.387 2.595 . 0 0 "[ . 1 . 2]" 1
149 1 13 TRP H 1 13 TRP HD1 3.605 . 5.681 5.193 5.047 5.345 . 0 0 "[ . 1 . 2]" 1
150 1 13 TRP H 1 13 TRP HE3 3.285 . 4.993 4.422 4.183 4.600 . 0 0 "[ . 1 . 2]" 1
151 1 13 TRP H 1 14 LEU H 3.200 . 4.810 4.389 4.143 4.496 . 0 0 "[ . 1 . 2]" 1
152 1 13 TRP H 1 14 LEU HA 3.650 . 5.778 5.078 4.845 5.391 . 0 0 "[ . 1 . 2]" 1
153 1 13 TRP HA 1 13 TRP HD1 2.760 . 3.864 2.928 2.754 3.126 . 0 0 "[ . 1 . 2]" 1
154 1 13 TRP HA 1 13 TRP HE1 3.595 . 5.659 5.037 4.943 5.177 . 0 0 "[ . 1 . 2]" 1
155 1 13 TRP HA 1 13 TRP HE3 3.360 . 5.154 4.844 4.670 4.985 . 0 0 "[ . 1 . 2]" 1
156 1 13 TRP HA 1 14 LEU H 2.300 . 2.875 2.093 2.020 2.185 . 0 0 "[ . 1 . 2]" 1
157 1 13 TRP HA 1 14 LEU HA 3.160 . 4.724 4.325 4.258 4.411 . 0 0 "[ . 1 . 2]" 1
158 1 13 TRP HA 1 14 LEU HB3 3.475 . 5.401 4.668 4.457 4.873 . 0 0 "[ . 1 . 2]" 1
159 1 13 TRP HA 1 14 LEU MD1 3.650 . 5.778 5.335 5.026 5.635 . 0 0 "[ . 1 . 2]" 1
160 1 13 TRP HA 1 14 LEU QD 3.285 . 4.993 4.945 4.757 5.085 0.092 18 0 "[ . 1 . 2]" 1
161 1 13 TRP HA 1 14 LEU MD2 3.650 . 5.778 5.858 5.782 5.924 0.147 2 0 "[ . 1 . 2]" 1
162 1 13 TRP QB 1 13 TRP HE1 3.155 . 4.713 4.479 4.434 4.522 . 0 0 "[ . 1 . 2]" 1
163 1 13 TRP QB 1 14 LEU H 2.960 . 4.294 3.756 3.670 3.826 . 0 0 "[ . 1 . 2]" 1
164 1 13 TRP HD1 1 14 LEU H 2.905 . 4.176 3.570 3.133 3.967 . 0 0 "[ . 1 . 2]" 1
165 1 13 TRP HE1 1 14 LEU H 3.165 . 4.735 4.794 4.469 5.009 0.274 16 0 "[ . 1 . 2]" 1
166 1 13 TRP HE1 1 15 PRO HA 3.075 . 4.541 4.105 3.488 4.678 0.137 18 0 "[ . 1 . 2]" 1
167 1 13 TRP HE1 1 15 PRO HB3 3.650 . 5.778 5.705 5.048 5.982 0.204 19 0 "[ . 1 . 2]" 1
168 1 13 TRP HE3 1 14 LEU H 3.520 . 5.498 5.195 4.886 5.583 0.085 9 0 "[ . 1 . 2]" 1
169 1 13 TRP HE3 1 15 PRO HD2 3.650 . 5.778 5.092 4.338 5.765 . 0 0 "[ . 1 . 2]" 1
170 1 13 TRP HE3 1 15 PRO HD3 3.350 . 5.133 3.432 2.950 4.046 . 0 0 "[ . 1 . 2]" 1
171 1 13 TRP HH2 1 15 PRO HA 2.975 . 4.326 3.649 3.074 4.227 . 0 0 "[ . 1 . 2]" 1
172 1 13 TRP HH2 1 15 PRO HG3 3.650 . 5.778 4.386 3.401 5.450 . 0 0 "[ . 1 . 2]" 1
173 1 13 TRP HZ2 1 15 PRO HA 2.930 . 4.229 3.089 2.479 3.666 . 0 0 "[ . 1 . 2]" 1
174 1 13 TRP HZ2 1 15 PRO HB2 3.390 . 5.219 4.984 4.607 5.293 0.074 2 0 "[ . 1 . 2]" 1
175 1 13 TRP HZ2 1 15 PRO HB3 2.980 . 4.337 3.814 3.055 4.315 . 0 0 "[ . 1 . 2]" 1
176 1 13 TRP HZ3 1 15 PRO HA 3.525 . 5.509 4.600 3.891 5.330 . 0 0 "[ . 1 . 2]" 1
177 1 13 TRP HZ3 1 15 PRO HB2 3.650 . 5.778 5.030 4.234 5.705 . 0 0 "[ . 1 . 2]" 1
178 1 13 TRP HZ3 1 15 PRO HB3 3.125 . 4.649 3.431 2.714 4.387 . 0 0 "[ . 1 . 2]" 1
179 1 13 TRP HZ3 1 15 PRO HG3 3.145 . 4.692 3.766 3.079 4.670 . 0 0 "[ . 1 . 2]" 1
180 1 14 LEU H 1 14 LEU HB2 2.875 . 4.111 2.694 2.376 2.914 . 0 0 "[ . 1 . 2]" 1
181 1 14 LEU H 1 14 LEU HB3 2.635 . 3.595 2.689 2.504 2.894 . 0 0 "[ . 1 . 2]" 1
182 1 14 LEU H 1 14 LEU MD1 3.220 . 4.853 4.139 3.915 4.448 . 0 0 "[ . 1 . 2]" 1
183 1 14 LEU H 1 14 LEU QD 2.915 . 4.197 3.780 3.618 3.886 . 0 0 "[ . 1 . 2]" 1
184 1 14 LEU H 1 14 LEU MD2 3.220 . 4.853 4.386 4.068 4.580 . 0 0 "[ . 1 . 2]" 1
185 1 14 LEU H 1 15 PRO HD3 3.210 . 4.832 4.430 4.194 4.641 . 0 0 "[ . 1 . 2]" 1
186 1 14 LEU H 1 16 PHE H 3.615 . 5.702 5.355 5.189 5.555 . 0 0 "[ . 1 . 2]" 1
187 1 14 LEU H 1 17 ALA H 3.335 . 5.100 4.800 4.502 5.177 0.077 18 0 "[ . 1 . 2]" 1
188 1 14 LEU H 1 17 ALA MB 3.015 . 4.412 4.431 3.997 4.826 0.414 17 0 "[ . 1 . 2]" 1
189 1 14 LEU H 1 36 TYR QE 3.390 . 5.219 4.213 2.693 5.075 . 0 0 "[ . 1 . 2]" 1
190 1 14 LEU HA 1 14 LEU MD1 2.845 . 4.047 2.129 1.819 3.598 . 0 0 "[ . 1 . 2]" 1
191 1 14 LEU HA 1 14 LEU QD 2.460 . 3.219 2.052 1.816 2.873 . 0 0 "[ . 1 . 2]" 1
192 1 14 LEU HA 1 14 LEU MD2 2.845 . 4.047 3.752 2.962 3.893 . 0 0 "[ . 1 . 2]" 1
193 1 14 LEU HA 1 14 LEU HG 2.370 . 3.026 2.907 2.298 3.117 0.091 14 0 "[ . 1 . 2]" 1
194 1 14 LEU HA 1 15 PRO HA 3.220 . 4.853 4.486 4.411 4.551 . 0 0 "[ . 1 . 2]" 1
195 1 14 LEU HA 1 15 PRO HD2 2.745 . 3.832 2.017 1.887 2.180 . 0 0 "[ . 1 . 2]" 1
196 1 14 LEU HA 1 15 PRO HD3 2.910 . 4.187 2.418 2.162 2.608 . 0 0 "[ . 1 . 2]" 1
197 1 14 LEU HA 1 16 PHE H 3.295 . 5.014 3.751 3.516 3.921 . 0 0 "[ . 1 . 2]" 1
198 1 14 LEU HA 1 17 ALA H 3.610 . 5.692 4.590 4.268 4.819 . 0 0 "[ . 1 . 2]" 1
199 1 14 LEU HB2 1 14 LEU MD1 2.675 . 3.681 2.352 2.190 2.460 . 0 0 "[ . 1 . 2]" 1
200 1 14 LEU HB2 1 14 LEU MD2 2.675 . 3.681 2.447 2.237 3.084 . 0 0 "[ . 1 . 2]" 1
201 1 14 LEU HB2 1 17 ALA H 3.190 . 4.788 4.665 4.179 5.135 0.346 18 0 "[ . 1 . 2]" 1
202 1 14 LEU HB2 1 17 ALA MB 3.055 . 4.498 3.709 3.246 4.259 . 0 0 "[ . 1 . 2]" 1
203 1 14 LEU HB2 1 36 TYR QD 3.650 . 5.778 4.391 3.383 5.363 . 0 0 "[ . 1 . 2]" 1
204 1 14 LEU HB3 1 14 LEU MD1 2.780 . 3.907 3.131 2.571 3.217 . 0 0 "[ . 1 . 2]" 1
205 1 14 LEU HB3 1 14 LEU QD 2.440 . 3.176 2.247 2.006 2.332 . 0 0 "[ . 1 . 2]" 1
206 1 14 LEU HB3 1 14 LEU MD2 2.780 . 3.907 2.305 2.086 2.396 . 0 0 "[ . 1 . 2]" 1
207 1 14 LEU HB3 1 16 PHE H 2.925 . 4.219 3.966 3.718 4.187 . 0 0 "[ . 1 . 2]" 1
208 1 14 LEU HB3 1 17 ALA H 2.775 . 3.896 3.055 2.457 3.557 . 0 0 "[ . 1 . 2]" 1
209 1 14 LEU HB3 1 19 PRO QD 3.195 . 4.799 4.070 3.755 4.528 . 0 0 "[ . 1 . 2]" 1
210 1 14 LEU HB3 1 36 TYR QE 2.985 . 4.348 2.861 2.300 3.340 . 0 0 "[ . 1 . 2]" 1
211 1 14 LEU QD 1 15 PRO HA 3.620 . 5.713 4.940 4.123 5.193 . 0 0 "[ . 1 . 2]" 1
212 1 14 LEU QD 1 15 PRO HB3 3.620 . 5.713 5.338 4.954 5.598 . 0 0 "[ . 1 . 2]" 1
213 1 14 LEU QD 1 15 PRO HD2 2.515 . 3.337 2.177 1.802 2.888 . 0 0 "[ . 1 . 2]" 1
214 1 14 LEU QD 1 15 PRO HD3 2.615 . 3.552 3.447 3.062 3.951 0.399 18 0 "[ . 1 . 2]" 1
215 1 14 LEU QD 1 15 PRO HG2 2.935 . 4.240 3.764 3.373 4.221 . 0 0 "[ . 1 . 2]" 1
216 1 14 LEU QD 1 15 PRO HG3 3.200 . 4.810 4.442 4.140 4.850 0.040 18 0 "[ . 1 . 2]" 1
217 1 14 LEU QD 1 16 PHE H 2.835 . 4.025 3.085 1.678 3.498 0.122 17 0 "[ . 1 . 2]" 1
218 1 14 LEU QD 1 16 PHE QD 2.630 . 3.585 2.401 2.074 3.085 . 0 0 "[ . 1 . 2]" 1
219 1 14 LEU QD 1 16 PHE QE 2.315 . 2.907 2.512 2.045 3.027 0.120 17 0 "[ . 1 . 2]" 1
220 1 14 LEU QD 1 17 ALA H 2.955 . 4.283 3.255 2.068 3.867 . 0 0 "[ . 1 . 2]" 1
221 1 14 LEU QD 1 17 ALA HA 3.145 . 4.692 4.245 3.530 4.566 . 0 0 "[ . 1 . 2]" 1
222 1 14 LEU QD 1 17 ALA MB 2.460 . 3.219 1.992 1.746 2.261 0.054 18 0 "[ . 1 . 2]" 1
223 1 14 LEU QD 1 18 ARG H 3.620 . 5.713 5.345 4.848 5.677 . 0 0 "[ . 1 . 2]" 1
224 1 14 LEU QD 1 36 TYR QD 2.760 . 3.864 2.361 2.048 2.887 . 0 0 "[ . 1 . 2]" 1
225 1 14 LEU QD 1 36 TYR QE 2.750 . 3.842 2.405 2.051 3.091 . 0 0 "[ . 1 . 2]" 1
226 1 14 LEU QD 1 37 GLU H 3.620 . 5.713 5.508 5.155 5.798 0.085 16 0 "[ . 1 . 2]" 1
227 1 14 LEU QD 1 49 ILE MG 3.100 . 4.595 4.009 3.587 4.494 . 0 0 "[ . 1 . 2]" 1
228 1 14 LEU QD 1 60 ALA HA 2.990 . 4.359 3.924 3.167 4.643 0.284 12 0 "[ . 1 . 2]" 1
229 1 14 LEU QD 1 60 ALA MB 2.545 . 3.402 2.650 2.052 3.241 . 0 0 "[ . 1 . 2]" 1
230 1 14 LEU QD 1 62 ASP H 3.620 . 5.713 3.911 2.694 4.885 . 0 0 "[ . 1 . 2]" 1
231 1 14 LEU QD 1 63 ARG H 3.620 . 5.713 3.500 2.774 4.059 . 0 0 "[ . 1 . 2]" 1
232 1 14 LEU QD 1 63 ARG HA 3.620 . 5.713 4.997 4.194 6.015 0.302 20 0 "[ . 1 . 2]" 1
233 1 14 LEU QD 1 63 ARG QD 3.115 . 4.627 4.213 3.039 5.086 0.459 20 0 "[ . 1 . 2]" 1
234 1 14 LEU QD 1 63 ARG QG 2.745 . 3.832 2.946 1.862 4.116 0.285 2 0 "[ . 1 . 2]" 1
235 1 14 LEU MD1 1 15 PRO HD2 3.275 . 4.971 2.329 1.803 4.271 . 0 0 "[ . 1 . 2]" 1
236 1 14 LEU MD1 1 15 PRO HG2 3.650 . 5.778 4.026 3.401 5.809 0.032 18 0 "[ . 1 . 2]" 1
237 1 14 LEU MD1 1 16 PHE H 3.110 . 4.616 3.554 2.892 4.471 . 0 0 "[ . 1 . 2]" 1
238 1 14 LEU MD1 1 16 PHE QD 2.895 . 4.154 3.086 2.465 3.954 . 0 0 "[ . 1 . 2]" 1
239 1 14 LEU MD1 1 16 PHE QE 2.575 . 3.466 2.712 2.102 3.806 0.340 17 0 "[ . 1 . 2]" 1
240 1 14 LEU MD1 1 17 ALA H 3.405 . 5.251 4.444 4.079 4.928 . 0 0 "[ . 1 . 2]" 1
241 1 14 LEU MD1 1 17 ALA MB 2.780 . 3.907 3.965 3.018 4.234 0.327 15 0 "[ . 1 . 2]" 1
242 1 14 LEU MD1 1 36 TYR QE 3.240 . 4.896 3.926 2.191 4.717 . 0 0 "[ . 1 . 2]" 1
243 1 14 LEU MD2 1 15 PRO HD2 3.275 . 4.971 4.317 2.686 4.684 . 0 0 "[ . 1 . 2]" 1
244 1 14 LEU MD2 1 15 PRO HG2 3.650 . 5.778 5.456 3.532 5.889 0.112 10 0 "[ . 1 . 2]" 1
245 1 14 LEU MD2 1 16 PHE H 3.110 . 4.616 3.761 1.679 4.320 0.121 17 0 "[ . 1 . 2]" 1
246 1 14 LEU MD2 1 16 PHE QD 2.895 . 4.154 2.528 2.191 3.261 . 0 0 "[ . 1 . 2]" 1
247 1 14 LEU MD2 1 16 PHE QE 2.575 . 3.466 3.256 2.182 3.828 0.362 15 0 "[ . 1 . 2]" 1
248 1 14 LEU MD2 1 17 ALA H 3.405 . 5.251 3.372 2.073 4.043 . 0 0 "[ . 1 . 2]" 1
249 1 14 LEU MD2 1 17 ALA MB 2.780 . 3.907 2.000 1.757 2.310 0.043 18 0 "[ . 1 . 2]" 1
250 1 14 LEU MD2 1 36 TYR QE 3.240 . 4.896 2.564 2.058 3.742 . 0 0 "[ . 1 . 2]" 1
251 1 14 LEU HG 1 15 PRO HA 3.650 . 5.778 5.272 4.889 5.873 0.096 17 0 "[ . 1 . 2]" 1
252 1 14 LEU HG 1 15 PRO HD2 3.150 . 4.702 3.131 2.618 3.511 . 0 0 "[ . 1 . 2]" 1
253 1 14 LEU HG 1 15 PRO HD3 3.515 . 5.487 4.532 3.942 4.860 . 0 0 "[ . 1 . 2]" 1
254 1 14 LEU HG 1 16 PHE H 3.060 . 4.509 2.590 2.089 3.759 . 0 0 "[ . 1 . 2]" 1
255 1 14 LEU HG 1 16 PHE HB3 3.650 . 5.778 4.536 3.713 6.065 0.288 18 0 "[ . 1 . 2]" 1
256 1 14 LEU HG 1 16 PHE QD 3.235 . 4.885 3.024 1.768 4.440 0.032 15 0 "[ . 1 . 2]" 1
257 1 14 LEU HG 1 36 TYR QE 3.010 . 4.402 4.533 4.192 4.739 0.337 19 0 "[ . 1 . 2]" 1
258 1 15 PRO HA 1 17 ALA MB 3.650 . 5.778 5.618 5.197 5.977 0.199 19 0 "[ . 1 . 2]" 1
259 1 15 PRO HB2 1 16 PHE H 2.995 . 4.369 3.309 2.555 3.619 . 0 0 "[ . 1 . 2]" 1
260 1 15 PRO HB2 1 16 PHE QD 3.055 . 4.498 3.525 2.201 4.708 0.210 15 0 "[ . 1 . 2]" 1
261 1 15 PRO HB2 1 17 ALA H 3.650 . 5.778 5.121 4.744 5.358 . 0 0 "[ . 1 . 2]" 1
262 1 15 PRO HB3 1 16 PHE H 3.110 . 4.616 4.203 3.879 4.372 . 0 0 "[ . 1 . 2]" 1
263 1 15 PRO HD2 1 16 PHE QD 3.225 . 4.864 4.051 3.149 4.479 . 0 0 "[ . 1 . 2]" 1
264 1 15 PRO HD2 1 16 PHE QE 3.225 . 4.864 4.047 2.995 4.724 . 0 0 "[ . 1 . 2]" 1
265 1 15 PRO HD3 1 17 ALA H 3.650 . 5.778 5.524 5.344 5.722 . 0 0 "[ . 1 . 2]" 1
266 1 15 PRO HG2 1 16 PHE H 2.985 . 4.348 2.823 2.303 3.600 . 0 0 "[ . 1 . 2]" 1
267 1 15 PRO HG2 1 16 PHE QD 3.030 . 4.444 2.932 1.958 3.592 . 0 0 "[ . 1 . 2]" 1
268 1 15 PRO HG2 1 16 PHE QE 3.205 . 4.821 3.161 2.722 3.588 . 0 0 "[ . 1 . 2]" 1
269 1 15 PRO HG3 1 16 PHE H 3.250 . 4.918 4.191 3.817 4.531 . 0 0 "[ . 1 . 2]" 1
270 1 15 PRO HG3 1 16 PHE QD 3.130 . 4.660 4.515 3.693 4.983 0.324 12 0 "[ . 1 . 2]" 1
271 1 15 PRO HG3 1 16 PHE QE 3.025 . 4.434 4.413 3.730 4.817 0.384 1 0 "[ . 1 . 2]" 1
272 1 16 PHE H 1 16 PHE HB3 2.870 . 4.101 3.494 3.252 3.619 . 0 0 "[ . 1 . 2]" 1
273 1 16 PHE H 1 16 PHE QD 2.735 . 3.810 2.726 2.220 3.007 . 0 0 "[ . 1 . 2]" 1
274 1 16 PHE H 1 16 PHE QE 2.960 . 4.294 4.101 3.790 4.350 0.056 16 0 "[ . 1 . 2]" 1
275 1 16 PHE H 1 17 ALA H 2.485 . 3.273 2.484 2.428 2.523 . 0 0 "[ . 1 . 2]" 1
276 1 16 PHE H 1 17 ALA MB 3.170 . 4.746 4.040 3.808 4.234 . 0 0 "[ . 1 . 2]" 1
277 1 16 PHE HA 1 16 PHE QD 3.125 . 4.649 2.719 2.122 3.662 . 0 0 "[ . 1 . 2]" 1
278 1 16 PHE HA 1 39 ARG H 3.210 . 4.832 3.944 3.149 4.775 . 0 0 "[ . 1 . 2]" 1
279 1 16 PHE HA 1 42 TYR QE 2.825 . 4.004 3.466 2.036 4.950 0.946 20 1 "[ . 1 . +]" 1
280 1 16 PHE HA 1 64 CYS HB2 3.375 . 5.186 4.594 4.062 5.284 0.097 13 0 "[ . 1 . 2]" 1
281 1 16 PHE HA 1 64 CYS HB3 3.650 . 5.778 5.286 4.475 5.922 0.145 18 0 "[ . 1 . 2]" 1
282 1 16 PHE HB2 1 17 ALA HA 3.345 . 5.122 4.075 3.706 4.772 . 0 0 "[ . 1 . 2]" 1
283 1 16 PHE HB2 1 39 ARG H 3.170 . 4.746 4.510 3.313 5.091 0.346 1 0 "[ . 1 . 2]" 1
284 1 16 PHE HB3 1 17 ALA MB 3.650 . 5.778 4.134 3.324 5.688 . 0 0 "[ . 1 . 2]" 1
285 1 16 PHE HB3 1 42 TYR QE 2.865 . 4.090 3.767 2.872 4.415 0.325 2 0 "[ . 1 . 2]" 1
286 1 16 PHE HB3 1 64 CYS HB2 2.800 . 3.950 2.746 1.979 4.036 0.086 18 0 "[ . 1 . 2]" 1
287 1 16 PHE QD 1 17 ALA H 3.015 . 4.412 4.123 3.863 4.329 . 0 0 "[ . 1 . 2]" 1
288 1 16 PHE QD 1 17 ALA MB 2.620 . 3.563 3.728 2.959 4.024 0.461 15 0 "[ . 1 . 2]" 1
289 1 16 PHE QD 1 39 ARG H 3.650 . 5.778 5.359 4.120 5.927 0.150 4 0 "[ . 1 . 2]" 1
290 1 16 PHE QD 1 63 ARG HB3 3.355 . 5.143 4.621 3.989 5.298 0.155 18 0 "[ . 1 . 2]" 1
291 1 16 PHE QD 1 63 ARG QG 3.315 . 5.057 4.485 3.529 5.092 0.034 5 0 "[ . 1 . 2]" 1
292 1 16 PHE QD 1 64 CYS H 2.735 . 3.810 2.826 2.106 3.469 . 0 0 "[ . 1 . 2]" 1
293 1 16 PHE QD 1 64 CYS HA 3.400 . 5.240 4.803 4.442 5.096 . 0 0 "[ . 1 . 2]" 1
294 1 16 PHE QD 1 64 CYS HB2 3.245 . 4.907 2.550 1.954 3.026 . 0 0 "[ . 1 . 2]" 1
295 1 16 PHE QD 1 64 CYS HB3 2.930 . 4.229 3.985 3.093 4.346 0.117 14 0 "[ . 1 . 2]" 1
296 1 16 PHE QE 1 61 LYS HA 3.375 . 5.186 4.402 2.150 5.545 0.359 7 0 "[ . 1 . 2]" 1
297 1 16 PHE QE 1 63 ARG HB3 3.390 . 5.219 5.050 3.778 5.519 0.300 16 0 "[ . 1 . 2]" 1
298 1 16 PHE QE 1 64 CYS H 2.445 . 3.187 2.780 2.239 3.303 0.117 20 0 "[ . 1 . 2]" 1
299 1 17 ALA H 1 17 ALA MB 2.480 . 3.262 2.435 2.199 2.714 . 0 0 "[ . 1 . 2]" 1
300 1 17 ALA H 1 18 ARG H 3.130 . 4.660 4.437 4.324 4.593 . 0 0 "[ . 1 . 2]" 1
301 1 17 ALA H 1 19 PRO QD 3.505 . 5.466 4.592 4.029 4.966 . 0 0 "[ . 1 . 2]" 1
302 1 17 ALA H 1 39 ARG H 3.650 . 5.778 5.152 4.572 5.734 . 0 0 "[ . 1 . 2]" 1
303 1 17 ALA HA 1 18 ARG H 2.560 . 3.434 2.217 2.137 2.318 . 0 0 "[ . 1 . 2]" 1
304 1 17 ALA HA 1 19 PRO QD 3.300 . 5.025 4.293 3.405 4.819 . 0 0 "[ . 1 . 2]" 1
305 1 17 ALA MB 1 18 ARG H 2.515 . 3.337 2.727 2.487 3.033 . 0 0 "[ . 1 . 2]" 1
306 1 17 ALA MB 1 19 PRO QD 2.690 . 3.714 2.773 2.055 3.445 . 0 0 "[ . 1 . 2]" 1
307 1 17 ALA MB 1 36 TYR QD 2.625 . 3.574 2.187 1.775 2.659 0.025 19 0 "[ . 1 . 2]" 1
308 1 17 ALA MB 1 36 TYR QE 2.840 . 4.036 3.111 2.659 3.656 . 0 0 "[ . 1 . 2]" 1
309 1 17 ALA MB 1 37 GLU H 3.030 . 4.444 2.847 2.371 3.943 . 0 0 "[ . 1 . 2]" 1
310 1 18 ARG H 1 19 PRO HA 3.315 . 5.057 4.580 4.389 5.054 . 0 0 "[ . 1 . 2]" 1
311 1 18 ARG H 1 19 PRO HD2 3.190 . 4.788 4.519 4.133 4.899 0.111 17 0 "[ . 1 . 2]" 1
312 1 18 ARG H 1 19 PRO HD3 3.190 . 4.788 3.437 2.587 3.982 . 0 0 "[ . 1 . 2]" 1
313 1 18 ARG H 1 37 GLU H 2.765 . 3.875 3.003 2.460 3.539 . 0 0 "[ . 1 . 2]" 1
314 1 18 ARG H 1 37 GLU HB2 3.285 . 4.993 4.141 2.791 5.211 0.219 3 0 "[ . 1 . 2]" 1
315 1 18 ARG H 1 37 GLU QB 2.920 . 4.208 3.358 2.692 4.332 0.124 2 0 "[ . 1 . 2]" 1
316 1 18 ARG H 1 37 GLU HB3 3.285 . 4.993 4.043 2.722 4.943 . 0 0 "[ . 1 . 2]" 1
317 1 18 ARG H 1 38 CYS H 3.650 . 5.778 5.349 4.726 6.111 0.333 1 0 "[ . 1 . 2]" 1
318 1 19 PRO HA 1 20 THR H 2.370 . 3.026 2.170 2.035 2.286 . 0 0 "[ . 1 . 2]" 1
319 1 19 PRO HA 1 20 THR HA 3.235 . 4.885 4.197 4.100 4.347 . 0 0 "[ . 1 . 2]" 1
320 1 19 PRO HA 1 20 THR HB 3.150 . 4.702 5.039 4.083 5.423 0.720 17 14 "[* *-.** 1******+* *]" 1
321 1 19 PRO HA 1 20 THR MG 2.810 . 3.971 3.170 2.827 4.167 0.196 2 0 "[ . 1 . 2]" 1
322 1 19 PRO HA 1 22 LEU QD 3.470 . 5.391 4.901 4.208 5.302 . 0 0 "[ . 1 . 2]" 1
323 1 19 PRO HA 1 35 ASN HB3 3.120 . 4.638 4.082 3.564 4.560 . 0 0 "[ . 1 . 2]" 1
324 1 19 PRO HA 1 36 TYR H 3.315 . 5.057 4.876 4.538 5.112 0.055 16 0 "[ . 1 . 2]" 1
325 1 19 PRO HA 1 36 TYR HA 2.905 . 4.176 2.665 2.320 2.966 . 0 0 "[ . 1 . 2]" 1
326 1 19 PRO HA 1 37 GLU H 2.670 . 3.671 3.457 2.744 3.960 0.289 13 0 "[ . 1 . 2]" 1
327 1 19 PRO HA 1 37 GLU QB 3.140 . 4.681 4.485 4.075 4.841 0.160 13 0 "[ . 1 . 2]" 1
328 1 19 PRO HB2 1 20 THR H 2.590 . 3.499 3.124 2.732 3.427 . 0 0 "[ . 1 . 2]" 1
329 1 19 PRO HB2 1 21 GLN H 2.445 . 3.187 2.711 2.446 2.956 . 0 0 "[ . 1 . 2]" 1
330 1 19 PRO HB2 1 21 GLN HE21 3.070 . 4.530 3.236 2.615 4.740 0.210 11 0 "[ . 1 . 2]" 1
331 1 19 PRO HB2 1 21 GLN HE22 3.225 . 4.864 3.931 1.935 5.177 0.313 8 0 "[ . 1 . 2]" 1
332 1 19 PRO HB2 1 22 LEU H 2.730 . 3.799 2.562 2.086 3.151 . 0 0 "[ . 1 . 2]" 1
333 1 19 PRO HB2 1 22 LEU QD 2.805 . 3.961 3.138 2.083 3.711 . 0 0 "[ . 1 . 2]" 1
334 1 19 PRO HB2 1 36 TYR H 3.630 . 5.734 6.056 5.405 6.415 0.681 10 8 "[* - ** + * ** 2]" 1
335 1 19 PRO HB2 1 36 TYR HA 3.065 . 4.520 4.370 3.944 4.761 0.241 1 0 "[ . 1 . 2]" 1
336 1 19 PRO HB2 1 36 TYR QE 3.160 . 4.724 3.815 2.969 4.209 . 0 0 "[ . 1 . 2]" 1
337 1 19 PRO HB3 1 20 THR H 2.700 . 3.735 3.295 2.993 3.700 . 0 0 "[ . 1 . 2]" 1
338 1 19 PRO HB3 1 21 GLN H 3.175 . 4.756 3.834 3.382 4.485 . 0 0 "[ . 1 . 2]" 1
339 1 19 PRO HB3 1 21 GLN HE22 3.425 . 5.294 3.621 2.079 4.783 . 0 0 "[ . 1 . 2]" 1
340 1 19 PRO HB3 1 36 TYR H 3.125 . 4.649 4.533 4.103 4.794 0.146 20 0 "[ . 1 . 2]" 1
341 1 19 PRO HB3 1 36 TYR HA 2.505 . 3.316 2.847 2.389 3.229 . 0 0 "[ . 1 . 2]" 1
342 1 19 PRO QD 1 36 TYR QE 3.540 . 5.541 3.803 3.125 4.372 . 0 0 "[ . 1 . 2]" 1
343 1 19 PRO QG 1 20 THR H 3.090 . 4.574 4.428 4.120 4.666 0.092 10 0 "[ . 1 . 2]" 1
344 1 19 PRO QG 1 21 GLN HE22 3.225 . 4.864 4.932 3.515 5.721 0.857 8 3 "[ - + 1 * . 2]" 1
345 1 19 PRO QG 1 22 LEU MD1 3.045 . 4.477 2.563 1.823 3.908 . 0 0 "[ . 1 . 2]" 1
346 1 19 PRO QG 1 22 LEU QD 2.535 . 3.380 1.962 1.738 2.382 0.062 11 0 "[ . 1 . 2]" 1
347 1 19 PRO QG 1 22 LEU MD2 3.045 . 4.477 2.328 1.854 3.292 . 0 0 "[ . 1 . 2]" 1
348 1 20 THR H 1 20 THR HB 2.700 . 3.735 3.380 2.575 3.661 . 0 0 "[ . 1 . 2]" 1
349 1 20 THR H 1 20 THR MG 2.425 . 3.144 1.965 1.824 2.318 . 0 0 "[ . 1 . 2]" 1
350 1 20 THR H 1 21 GLN H 2.335 . 2.950 2.420 2.164 2.595 . 0 0 "[ . 1 . 2]" 1
351 1 20 THR H 1 21 GLN HA 3.200 . 4.810 4.924 4.734 5.130 0.320 1 0 "[ . 1 . 2]" 1
352 1 20 THR H 1 21 GLN HB2 3.335 . 5.100 4.622 4.163 5.334 0.234 18 0 "[ . 1 . 2]" 1
353 1 20 THR H 1 21 GLN QG 3.195 . 4.799 3.089 2.630 3.729 . 0 0 "[ . 1 . 2]" 1
354 1 20 THR H 1 35 ASN H 3.035 . 4.455 4.401 3.525 4.832 0.377 19 0 "[ . 1 . 2]" 1
355 1 20 THR H 1 35 ASN HB2 3.270 . 4.960 4.576 3.127 5.062 0.101 19 0 "[ . 1 . 2]" 1
356 1 20 THR H 1 35 ASN HB3 3.290 . 5.003 3.015 2.653 3.880 . 0 0 "[ . 1 . 2]" 1
357 1 20 THR H 1 36 TYR H 3.650 . 5.778 5.652 5.187 5.915 0.137 8 0 "[ . 1 . 2]" 1
358 1 20 THR H 1 36 TYR HA 3.185 . 4.778 4.378 3.868 4.760 . 0 0 "[ . 1 . 2]" 1
359 1 20 THR H 1 36 TYR QD 3.350 . 5.133 5.196 4.704 5.350 0.218 1 0 "[ . 1 . 2]" 1
360 1 20 THR H 1 36 TYR QE 3.650 . 5.778 5.987 5.387 6.254 0.477 17 0 "[ . 1 . 2]" 1
361 1 20 THR HA 1 20 THR MG 2.540 . 3.391 2.719 2.281 3.243 . 0 0 "[ . 1 . 2]" 1
362 1 20 THR HA 1 21 GLN H 2.505 . 3.316 3.302 3.131 3.440 0.124 17 0 "[ . 1 . 2]" 1
363 1 20 THR HA 1 21 GLN HA 3.235 . 4.885 4.637 4.453 4.739 . 0 0 "[ . 1 . 2]" 1
364 1 20 THR HA 1 21 GLN QG 3.380 . 5.197 4.336 4.107 4.634 . 0 0 "[ . 1 . 2]" 1
365 1 20 THR HB 1 21 GLN QG 3.515 . 5.487 4.128 3.405 4.779 . 0 0 "[ . 1 . 2]" 1
366 1 20 THR HB 1 35 ASN HB3 3.375 . 5.186 4.816 3.484 5.295 0.109 20 0 "[ . 1 . 2]" 1
367 1 20 THR MG 1 21 GLN H 2.835 . 4.025 3.627 3.046 4.026 0.000 13 0 "[ . 1 . 2]" 1
368 1 20 THR MG 1 21 GLN QG 2.380 . 3.047 3.138 1.847 3.739 0.692 1 7 "[+ * . * 1* * .* - 2]" 1
369 1 20 THR MG 1 35 ASN H 3.230 . 4.874 4.576 3.526 5.014 0.139 16 0 "[ . 1 . 2]" 1
370 1 20 THR MG 1 35 ASN HB2 2.855 . 4.068 3.796 2.875 4.290 0.222 17 0 "[ . 1 . 2]" 1
371 1 20 THR MG 1 35 ASN HB3 2.425 . 3.144 2.596 1.827 2.914 . 0 0 "[ . 1 . 2]" 1
372 1 20 THR MG 1 36 TYR H 3.650 . 5.778 5.488 5.158 5.819 0.041 1 0 "[ . 1 . 2]" 1
373 1 21 GLN H 1 21 GLN HB2 2.585 . 3.488 2.749 2.393 3.452 . 0 0 "[ . 1 . 2]" 1
374 1 21 GLN H 1 21 GLN HE21 2.775 . 3.896 2.570 1.731 3.920 0.069 2 0 "[ . 1 . 2]" 1
375 1 21 GLN H 1 21 GLN HE22 3.285 . 4.993 3.954 3.070 4.877 . 0 0 "[ . 1 . 2]" 1
376 1 21 GLN H 1 21 GLN QG 2.515 . 3.337 2.409 1.937 2.917 . 0 0 "[ . 1 . 2]" 1
377 1 21 GLN H 1 22 LEU H 2.700 . 3.735 1.866 1.728 2.138 0.072 3 0 "[ . 1 . 2]" 1
378 1 21 GLN H 1 22 LEU HA 3.630 . 5.734 4.540 4.408 4.735 . 0 0 "[ . 1 . 2]" 1
379 1 21 GLN H 1 22 LEU QD 2.895 . 4.154 4.502 3.547 4.843 0.689 17 4 "[* . * 1 . + -2]" 1
380 1 21 GLN H 1 23 THR H 3.650 . 5.778 3.742 3.489 4.204 . 0 0 "[ . 1 . 2]" 1
381 1 21 GLN H 1 23 THR HB 3.650 . 5.778 5.413 4.939 5.852 0.075 17 0 "[ . 1 . 2]" 1
382 1 21 GLN H 1 23 THR MG 3.140 . 4.681 4.250 3.595 4.833 0.152 1 0 "[ . 1 . 2]" 1
383 1 21 GLN H 1 34 LEU QD 3.620 . 5.713 4.370 3.066 5.068 . 0 0 "[ . 1 . 2]" 1
384 1 21 GLN H 1 35 ASN HB3 3.405 . 5.251 4.435 4.050 5.302 0.051 20 0 "[ . 1 . 2]" 1
385 1 21 GLN HA 1 21 GLN HB3 2.290 . 2.853 2.338 2.197 2.434 . 0 0 "[ . 1 . 2]" 1
386 1 21 GLN HA 1 21 GLN HE21 3.345 . 5.122 4.431 3.740 5.222 0.100 20 0 "[ . 1 . 2]" 1
387 1 21 GLN HA 1 21 GLN HE22 3.650 . 5.778 5.650 5.216 5.815 0.038 12 0 "[ . 1 . 2]" 1
388 1 21 GLN HA 1 21 GLN QG 2.500 . 3.305 2.703 2.456 3.217 . 0 0 "[ . 1 . 2]" 1
389 1 21 GLN HB2 1 21 GLN HE21 2.930 . 4.229 2.547 1.611 4.327 0.189 17 0 "[ . 1 . 2]" 1
390 1 21 GLN HB2 1 21 GLN HE22 3.170 . 4.746 3.358 2.958 4.635 . 0 0 "[ . 1 . 2]" 1
391 1 21 GLN HB2 1 22 LEU H 2.405 . 3.101 2.671 2.094 3.305 0.204 18 0 "[ . 1 . 2]" 1
392 1 21 GLN HB2 1 23 THR H 3.285 . 4.993 4.918 4.505 5.134 0.141 14 0 "[ . 1 . 2]" 1
393 1 21 GLN HB2 1 28 PHE QE 2.990 . 4.359 3.583 2.907 4.443 0.085 5 0 "[ . 1 . 2]" 1
394 1 21 GLN HB2 1 34 LEU MD1 3.015 . 4.412 4.243 2.364 4.619 0.207 3 0 "[ . 1 . 2]" 1
395 1 21 GLN HB2 1 34 LEU QD 2.510 . 3.326 2.939 1.719 3.627 0.301 18 0 "[ . 1 . 2]" 1
396 1 21 GLN HB2 1 34 LEU MD2 3.015 . 4.412 3.136 1.723 4.633 0.221 2 0 "[ . 1 . 2]" 1
397 1 21 GLN HB2 1 34 LEU HG 2.665 . 3.660 3.432 2.673 4.492 0.832 8 5 "[ . + 1* -*. *]" 1
398 1 21 GLN HB2 1 35 ASN HB2 3.450 . 5.347 5.656 4.864 5.858 0.511 19 1 "[ . 1 . +2]" 1
399 1 21 GLN HB3 1 21 GLN HE21 2.990 . 4.359 3.748 3.176 4.531 0.172 18 0 "[ . 1 . 2]" 1
400 1 21 GLN HB3 1 21 GLN HE22 3.340 . 5.111 4.527 3.948 5.308 0.197 20 0 "[ . 1 . 2]" 1
401 1 21 GLN HB3 1 21 GLN QG 2.175 . 2.606 2.179 2.119 2.255 . 0 0 "[ . 1 . 2]" 1
402 1 21 GLN HB3 1 23 THR H 3.650 . 5.778 5.503 4.991 5.836 0.058 14 0 "[ . 1 . 2]" 1
403 1 21 GLN HB3 1 34 LEU QD 3.380 . 5.197 3.866 2.661 4.711 . 0 0 "[ . 1 . 2]" 1
404 1 21 GLN HE21 1 21 GLN QG 2.670 . 3.671 2.261 2.034 2.698 . 0 0 "[ . 1 . 2]" 1
405 1 21 GLN HE21 1 22 LEU H 3.355 . 5.143 3.392 2.559 4.377 . 0 0 "[ . 1 . 2]" 1
406 1 21 GLN HE21 1 34 LEU QD 3.065 . 4.520 3.332 1.716 4.645 0.126 4 0 "[ . 1 . 2]" 1
407 1 21 GLN HE21 1 34 LEU HG 3.425 . 5.294 3.876 2.455 5.745 0.452 20 0 "[ . 1 . 2]" 1
408 1 21 GLN HE21 1 35 ASN H 3.195 . 4.799 2.585 1.744 3.172 0.056 8 0 "[ . 1 . 2]" 1
409 1 21 GLN HE21 1 36 TYR QD 3.515 . 5.487 4.311 2.866 5.511 0.023 11 0 "[ . 1 . 2]" 1
410 1 21 GLN HE22 1 22 LEU QB 3.650 . 5.778 4.563 2.648 5.418 . 0 0 "[ . 1 . 2]" 1
411 1 21 GLN HE22 1 22 LEU QD 3.620 . 5.713 5.276 3.586 6.148 0.435 13 0 "[ . 1 . 2]" 1
412 1 21 GLN HE22 1 34 LEU MD1 3.240 . 4.896 3.882 3.163 5.054 0.158 4 0 "[ . 1 . 2]" 1
413 1 21 GLN HE22 1 34 LEU QD 2.825 . 4.004 2.896 1.942 3.949 . 0 0 "[ . 1 . 2]" 1
414 1 21 GLN HE22 1 34 LEU MD2 3.240 . 4.896 3.146 1.944 5.073 0.177 2 0 "[ . 1 . 2]" 1
415 1 21 GLN HE22 1 34 LEU HG 3.650 . 5.778 3.097 1.861 5.412 . 0 0 "[ . 1 . 2]" 1
416 1 21 GLN HE22 1 35 ASN H 3.410 . 5.261 1.766 1.328 3.674 0.472 13 0 "[ . 1 . 2]" 1
417 1 21 GLN HE22 1 35 ASN HB2 3.650 . 5.778 3.738 3.024 5.409 . 0 0 "[ . 1 . 2]" 1
418 1 21 GLN HE22 1 36 TYR QD 2.905 . 4.176 3.558 2.238 4.475 0.300 8 0 "[ . 1 . 2]" 1
419 1 21 GLN QG 1 23 THR H 3.650 . 5.778 5.487 5.122 5.725 . 0 0 "[ . 1 . 2]" 1
420 1 21 GLN QG 1 23 THR MG 3.650 . 5.778 5.304 4.862 5.603 . 0 0 "[ . 1 . 2]" 1
421 1 21 GLN QG 1 34 LEU HG 3.650 . 5.778 4.483 3.201 5.701 . 0 0 "[ . 1 . 2]" 1
422 1 21 GLN QG 1 35 ASN HB2 2.670 . 3.671 3.660 2.016 3.927 0.257 9 0 "[ . 1 . 2]" 1
423 1 21 GLN QG 1 35 ASN HB3 2.525 . 3.359 3.206 2.463 3.631 0.272 2 0 "[ . 1 . 2]" 1
424 1 22 LEU H 1 22 LEU QB 2.100 . 2.445 2.097 1.983 2.173 . 0 0 "[ . 1 . 2]" 1
425 1 22 LEU H 1 22 LEU QD 2.465 . 3.230 3.435 2.633 3.564 0.334 7 0 "[ . 1 . 2]" 1
426 1 22 LEU H 1 23 THR H 2.475 . 3.251 2.679 2.439 2.870 . 0 0 "[ . 1 . 2]" 1
427 1 22 LEU H 1 23 THR MG 3.315 . 5.057 3.968 3.583 4.453 . 0 0 "[ . 1 . 2]" 1
428 1 22 LEU H 1 34 LEU HG 3.525 . 5.509 5.143 4.354 5.964 0.455 20 0 "[ . 1 . 2]" 1
429 1 22 LEU HA 1 22 LEU QB 2.260 . 2.789 2.234 2.132 2.291 . 0 0 "[ . 1 . 2]" 1
430 1 22 LEU HA 1 22 LEU MD1 3.000 . 4.380 3.322 2.067 4.051 . 0 0 "[ . 1 . 2]" 1
431 1 22 LEU HA 1 22 LEU QD 2.705 . 3.746 2.972 2.059 3.429 . 0 0 "[ . 1 . 2]" 1
432 1 22 LEU HA 1 22 LEU MD2 3.000 . 4.380 3.600 3.427 3.842 . 0 0 "[ . 1 . 2]" 1
433 1 22 LEU HA 1 22 LEU HG 2.805 . 3.961 2.873 2.626 3.498 . 0 0 "[ . 1 . 2]" 1
434 1 22 LEU HA 1 23 THR MG 3.160 . 4.724 4.721 4.526 4.912 0.188 14 0 "[ . 1 . 2]" 1
435 1 22 LEU HA 1 24 ASP H 2.750 . 3.842 4.175 3.937 4.409 0.566 3 4 "[ + . - 1 . **]" 1
436 1 22 LEU HA 1 25 GLU H 2.635 . 3.595 3.123 2.609 3.778 0.183 20 0 "[ . 1 . 2]" 1
437 1 22 LEU HA 1 25 GLU QB 2.585 . 3.488 3.249 2.438 4.221 0.734 13 5 "[ .- *1 *+ .* 2]" 1
438 1 22 LEU HA 1 26 PHE HA 3.645 . 5.767 3.244 2.922 3.561 . 0 0 "[ . 1 . 2]" 1
439 1 22 LEU HA 1 26 PHE HB2 3.650 . 5.778 5.667 5.369 6.018 0.240 18 0 "[ . 1 . 2]" 1
440 1 22 LEU HA 1 26 PHE QD 3.300 . 5.025 4.657 4.249 4.988 . 0 0 "[ . 1 . 2]" 1
441 1 22 LEU HA 1 28 PHE QE 2.980 . 4.337 3.267 2.702 4.396 0.059 5 0 "[ . 1 . 2]" 1
442 1 22 LEU HA 1 34 LEU QD 3.620 . 5.713 3.520 2.822 4.155 . 0 0 "[ . 1 . 2]" 1
443 1 22 LEU QB 1 22 LEU MD1 2.250 . 2.767 2.079 1.999 2.267 . 0 0 "[ . 1 . 2]" 1
444 1 22 LEU QB 1 22 LEU MD2 2.250 . 2.767 2.070 1.938 2.223 . 0 0 "[ . 1 . 2]" 1
445 1 22 LEU QB 1 26 PHE QD 3.335 . 5.100 4.800 3.669 5.138 0.038 19 0 "[ . 1 . 2]" 1
446 1 22 LEU QB 1 34 LEU HG 3.265 . 4.950 4.499 2.744 5.471 0.522 20 1 "[ . 1 . +]" 1
447 1 22 LEU QD 1 23 THR H 2.400 . 3.090 3.101 2.342 3.744 0.654 20 3 "[ . - 1 . * +]" 1
448 1 22 LEU QD 1 23 THR HA 2.565 . 3.445 2.691 2.226 3.729 0.285 7 0 "[ . 1 . 2]" 1
449 1 22 LEU QD 1 23 THR HB 2.985 . 4.348 3.712 3.011 4.520 0.172 20 0 "[ . 1 . 2]" 1
450 1 22 LEU QD 1 24 ASP H 3.150 . 4.702 4.670 4.333 4.930 0.227 18 0 "[ . 1 . 2]" 1
451 1 22 LEU QD 1 26 PHE QD 2.500 . 3.305 2.866 2.129 3.374 0.069 3 0 "[ . 1 . 2]" 1
452 1 22 LEU QD 1 26 PHE QE 3.245 . 4.907 2.750 2.330 3.522 . 0 0 "[ . 1 . 2]" 1
453 1 22 LEU QD 1 34 LEU QD 2.575 . 3.466 2.876 2.364 3.368 . 0 0 "[ . 1 . 2]" 1
454 1 22 LEU QD 1 36 TYR QD 3.045 . 4.477 4.472 3.986 4.829 0.352 20 0 "[ . 1 . 2]" 1
455 1 22 LEU QD 1 36 TYR QE 3.140 . 4.681 3.062 2.645 3.430 . 0 0 "[ . 1 . 2]" 1
456 1 22 LEU MD1 1 26 PHE QD 3.170 . 4.746 3.117 2.141 4.228 . 0 0 "[ . 1 . 2]" 1
457 1 22 LEU MD2 1 26 PHE QD 3.170 . 4.746 3.720 2.815 4.410 . 0 0 "[ . 1 . 2]" 1
458 1 22 LEU HG 1 23 THR HA 2.875 . 4.111 3.967 3.134 4.455 0.344 1 0 "[ . 1 . 2]" 1
459 1 22 LEU HG 1 26 PHE QD 2.695 . 3.724 3.116 2.728 3.689 . 0 0 "[ . 1 . 2]" 1
460 1 22 LEU HG 1 26 PHE QE 2.970 . 4.315 3.431 2.789 4.123 . 0 0 "[ . 1 . 2]" 1
461 1 23 THR H 1 23 THR HB 2.175 . 2.606 2.525 2.263 2.695 0.089 9 0 "[ . 1 . 2]" 1
462 1 23 THR H 1 23 THR MG 2.355 . 2.993 2.064 1.856 2.497 . 0 0 "[ . 1 . 2]" 1
463 1 23 THR H 1 24 ASP H 2.445 . 3.187 2.793 2.595 3.176 . 0 0 "[ . 1 . 2]" 1
464 1 23 THR H 1 24 ASP QB 3.570 . 5.606 4.959 4.421 5.404 . 0 0 "[ . 1 . 2]" 1
465 1 23 THR H 1 25 GLU H 3.070 . 4.530 3.672 3.255 4.078 . 0 0 "[ . 1 . 2]" 1
466 1 23 THR H 1 25 GLU QG 3.650 . 5.778 4.728 4.161 5.354 . 0 0 "[ . 1 . 2]" 1
467 1 23 THR H 1 26 PHE QD 3.650 . 5.778 5.952 5.674 6.136 0.358 2 0 "[ . 1 . 2]" 1
468 1 23 THR H 1 26 PHE QE 3.650 . 5.778 5.567 5.208 5.851 0.073 2 0 "[ . 1 . 2]" 1
469 1 23 THR HA 1 23 THR HB 2.180 . 2.617 2.449 2.371 2.589 . 0 0 "[ . 1 . 2]" 1
470 1 23 THR HA 1 23 THR MG 2.535 . 3.380 3.221 3.179 3.274 . 0 0 "[ . 1 . 2]" 1
471 1 23 THR HA 1 26 PHE QE 2.915 . 4.197 3.826 3.340 4.218 0.020 10 0 "[ . 1 . 2]" 1
472 1 23 THR MG 1 24 ASP H 2.615 . 3.552 2.098 1.920 2.238 . 0 0 "[ . 1 . 2]" 1
473 1 23 THR MG 1 24 ASP HA 2.975 . 4.326 3.714 3.463 4.003 . 0 0 "[ . 1 . 2]" 1
474 1 23 THR MG 1 24 ASP QB 2.525 . 3.359 2.781 2.141 3.277 . 0 0 "[ . 1 . 2]" 1
475 1 23 THR MG 1 25 GLU H 3.070 . 4.530 3.798 3.538 4.094 . 0 0 "[ . 1 . 2]" 1
476 1 23 THR MG 1 25 GLU QG 3.345 . 4.466 4.120 3.780 4.512 0.046 13 0 "[ . 1 . 2]" 1
477 1 24 ASP H 1 24 ASP QB 2.345 . 2.972 2.621 2.395 3.141 0.169 4 0 "[ . 1 . 2]" 1
478 1 24 ASP H 1 25 GLU H 2.295 . 2.864 2.068 1.710 2.412 0.090 20 0 "[ . 1 . 2]" 1
479 1 24 ASP H 1 25 GLU QB 3.010 . 4.402 3.938 3.382 4.795 0.394 13 0 "[ . 1 . 2]" 1
480 1 24 ASP H 1 25 GLU QG 2.895 . 4.154 3.114 2.819 3.866 . 0 0 "[ . 1 . 2]" 1
481 1 24 ASP H 1 26 PHE H 3.115 . 4.627 4.750 3.932 5.156 0.529 7 3 "[ .-+ 1* . 2]" 1
482 1 24 ASP H 1 26 PHE QE 3.405 . 5.251 5.012 4.590 5.340 0.090 6 0 "[ . 1 . 2]" 1
483 1 24 ASP HA 1 25 GLU HA 3.135 . 4.670 4.523 4.420 4.636 . 0 0 "[ . 1 . 2]" 1
484 1 24 ASP HA 1 26 PHE QE 2.745 . 3.832 3.466 2.733 4.065 0.233 6 0 "[ . 1 . 2]" 1
485 1 24 ASP QB 1 25 GLU H 3.060 . 4.509 3.539 2.990 4.011 . 0 0 "[ . 1 . 2]" 1
486 1 25 GLU H 1 25 GLU QB 2.370 . 3.026 2.709 2.274 3.280 0.254 6 0 "[ . 1 . 2]" 1
487 1 25 GLU H 1 25 GLU QG 2.855 . 3.294 2.715 2.248 3.317 0.023 10 0 "[ . 1 . 2]" 1
488 1 25 GLU H 1 26 PHE H 2.585 . 3.488 2.876 2.230 3.425 . 0 0 "[ . 1 . 2]" 1
489 1 25 GLU H 1 26 PHE HB2 3.315 . 5.057 5.022 4.500 5.367 0.310 16 0 "[ . 1 . 2]" 1
490 1 25 GLU H 1 26 PHE QD 2.860 . 4.079 3.899 3.373 4.297 0.218 18 0 "[ . 1 . 2]" 1
491 1 25 GLU H 1 26 PHE QE 3.080 . 4.552 4.494 4.030 4.830 0.278 14 0 "[ . 1 . 2]" 1
492 1 25 GLU H 1 27 GLU H 3.245 . 4.907 5.072 4.767 5.281 0.375 9 0 "[ . 1 . 2]" 1
493 1 25 GLU HA 1 25 GLU QG 2.925 . 3.499 2.644 2.307 3.309 . 0 0 "[ . 1 . 2]" 1
494 1 25 GLU HA 1 26 PHE HB2 3.245 . 4.907 4.389 4.001 4.648 . 0 0 "[ . 1 . 2]" 1
495 1 25 GLU HA 1 26 PHE QD 3.035 . 4.455 4.051 3.413 4.534 0.079 8 0 "[ . 1 . 2]" 1
496 1 25 GLU HA 1 27 GLU H 2.900 . 4.165 3.366 2.936 3.924 . 0 0 "[ . 1 . 2]" 1
497 1 25 GLU QB 1 26 PHE H 2.780 . 3.907 3.066 1.816 3.721 . 0 0 "[ . 1 . 2]" 1
498 1 25 GLU QB 1 27 GLU H 2.555 . 3.423 3.531 2.578 3.981 0.557 4 4 "[ +* * 1 . - 2]" 1
499 1 25 GLU QG 1 26 PHE H 3.060 . 4.509 4.079 3.657 4.346 . 0 0 "[ . 1 . 2]" 1
500 1 26 PHE H 1 26 PHE HB2 2.735 . 3.810 2.757 2.212 3.599 . 0 0 "[ . 1 . 2]" 1
501 1 26 PHE H 1 26 PHE QD 2.880 . 4.122 2.792 1.986 3.760 . 0 0 "[ . 1 . 2]" 1
502 1 26 PHE H 1 27 GLU H 2.280 . 2.832 2.817 2.360 3.316 0.484 1 0 "[ . 1 . 2]" 1
503 1 26 PHE HA 1 26 PHE QD 2.455 . 3.208 2.759 2.380 2.958 . 0 0 "[ . 1 . 2]" 1
504 1 26 PHE HB2 1 27 GLU H 2.865 . 4.090 2.970 2.655 3.479 . 0 0 "[ . 1 . 2]" 1
505 1 26 PHE HB2 1 27 GLU HA 3.545 . 5.552 4.601 4.288 4.797 . 0 0 "[ . 1 . 2]" 1
506 1 26 PHE HB2 1 27 GLU QG 2.855 . 4.068 3.057 2.600 3.920 . 0 0 "[ . 1 . 2]" 1
507 1 26 PHE QD 1 27 GLU QG 3.215 . 4.842 4.693 4.375 5.257 0.415 17 0 "[ . 1 . 2]" 1
508 1 27 GLU H 1 27 GLU HB2 2.995 . 4.369 2.587 2.362 3.570 . 0 0 "[ . 1 . 2]" 1
509 1 27 GLU H 1 27 GLU QB 2.605 . 3.531 2.521 2.333 3.024 . 0 0 "[ . 1 . 2]" 1
510 1 27 GLU H 1 27 GLU HB3 2.995 . 4.369 3.695 3.265 3.892 . 0 0 "[ . 1 . 2]" 1
511 1 27 GLU H 1 27 GLU QG 2.480 . 3.262 2.907 1.858 3.490 0.228 17 0 "[ . 1 . 2]" 1
512 1 27 GLU H 1 28 PHE H 3.080 . 4.552 4.443 4.296 4.556 0.004 12 0 "[ . 1 . 2]" 1
513 1 27 GLU HA 1 27 GLU QG 2.675 . 3.681 2.427 2.279 3.206 . 0 0 "[ . 1 . 2]" 1
514 1 27 GLU HA 1 28 PHE H 2.415 . 3.122 2.180 2.108 2.330 . 0 0 "[ . 1 . 2]" 1
515 1 27 GLU HA 1 28 PHE QD 3.275 . 4.971 3.814 3.185 4.415 . 0 0 "[ . 1 . 2]" 1
516 1 27 GLU QB 1 27 GLU QG 2.055 . 2.348 2.066 2.003 2.089 . 0 0 "[ . 1 . 2]" 1
517 1 27 GLU QB 1 28 PHE H 2.665 . 3.660 3.116 2.493 3.493 . 0 0 "[ . 1 . 2]" 1
518 1 27 GLU HB2 1 28 PHE H 3.080 . 4.552 4.163 3.556 4.446 . 0 0 "[ . 1 . 2]" 1
519 1 27 GLU HB3 1 28 PHE H 3.080 . 4.552 3.246 2.528 4.055 . 0 0 "[ . 1 . 2]" 1
520 1 28 PHE H 1 28 PHE HB2 2.705 . 3.746 2.731 2.527 2.868 . 0 0 "[ . 1 . 2]" 1
521 1 28 PHE H 1 28 PHE HB3 2.880 . 4.122 3.804 3.655 3.906 . 0 0 "[ . 1 . 2]" 1
522 1 28 PHE H 1 28 PHE QD 2.560 . 3.434 3.289 2.788 3.664 0.230 7 0 "[ . 1 . 2]" 1
523 1 28 PHE H 1 57 TRP HE1 3.650 . 5.778 5.654 5.102 5.937 0.159 19 0 "[ . 1 . 2]" 1
524 1 28 PHE HA 1 28 PHE QD 3.350 . 5.133 2.873 2.641 3.111 . 0 0 "[ . 1 . 2]" 1
525 1 28 PHE HA 1 29 PRO QB 3.385 . 5.208 4.666 4.455 4.866 . 0 0 "[ . 1 . 2]" 1
526 1 28 PHE HA 1 29 PRO QD 2.700 . 3.735 2.063 1.840 2.334 . 0 0 "[ . 1 . 2]" 1
527 1 28 PHE HA 1 29 PRO QG 3.230 . 4.874 3.962 3.676 4.237 . 0 0 "[ . 1 . 2]" 1
528 1 28 PHE HB2 1 29 PRO QG 3.650 . 5.778 5.216 4.492 5.600 . 0 0 "[ . 1 . 2]" 1
529 1 28 PHE HB2 1 32 THR H 3.650 . 5.778 5.351 4.262 5.941 0.163 20 0 "[ . 1 . 2]" 1
530 1 28 PHE HB2 1 32 THR HB 3.225 . 4.864 3.475 2.720 4.870 0.006 19 0 "[ . 1 . 2]" 1
531 1 28 PHE HB2 1 34 LEU QD 3.280 . 4.982 3.206 2.319 4.438 . 0 0 "[ . 1 . 2]" 1
532 1 28 PHE HB2 1 57 TRP HH2 3.420 . 5.283 2.631 1.849 3.793 . 0 0 "[ . 1 . 2]" 1
533 1 28 PHE HB2 1 57 TRP HZ2 3.005 . 4.391 3.575 2.831 4.554 0.163 5 0 "[ . 1 . 2]" 1
534 1 28 PHE HB3 1 29 PRO QD 3.370 . 5.175 2.160 1.779 2.408 0.021 9 0 "[ . 1 . 2]" 1
535 1 28 PHE HB3 1 29 PRO QG 2.875 . 4.111 3.868 3.477 4.353 0.242 3 0 "[ . 1 . 2]" 1
536 1 28 PHE HB3 1 32 THR H 3.480 . 5.412 4.761 4.318 5.529 0.117 10 0 "[ . 1 . 2]" 1
537 1 28 PHE HB3 1 32 THR HA 3.520 . 5.498 5.232 4.743 5.693 0.195 10 0 "[ . 1 . 2]" 1
538 1 28 PHE HB3 1 32 THR HB 3.060 . 4.509 2.641 2.132 3.485 . 0 0 "[ . 1 . 2]" 1
539 1 28 PHE QD 1 29 PRO QD 3.195 . 4.799 2.538 1.977 3.260 . 0 0 "[ . 1 . 2]" 1
540 1 28 PHE QD 1 29 PRO QG 3.220 . 4.853 4.188 3.619 4.912 0.059 9 0 "[ . 1 . 2]" 1
541 1 28 PHE QD 1 32 THR HB 3.235 . 4.885 3.803 2.061 5.066 0.181 10 0 "[ . 1 . 2]" 1
542 1 28 PHE QD 1 32 THR MG 2.615 . 3.552 2.391 1.700 3.391 0.100 14 0 "[ . 1 . 2]" 1
543 1 28 PHE QD 1 34 LEU MD1 2.970 . 4.315 2.814 2.177 3.274 . 0 0 "[ . 1 . 2]" 1
544 1 28 PHE QD 1 34 LEU QD 2.700 . 3.735 2.472 1.901 2.958 . 0 0 "[ . 1 . 2]" 1
545 1 28 PHE QD 1 34 LEU MD2 2.970 . 4.315 2.842 2.097 3.745 . 0 0 "[ . 1 . 2]" 1
546 1 28 PHE QD 1 34 LEU HG 3.535 . 5.530 4.065 3.196 4.764 . 0 0 "[ . 1 . 2]" 1
547 1 28 PHE QD 1 57 TRP HH2 3.285 . 4.993 2.780 1.982 3.538 . 0 0 "[ . 1 . 2]" 1
548 1 28 PHE QD 1 57 TRP HZ2 2.815 . 3.982 3.095 2.298 4.313 0.331 2 0 "[ . 1 . 2]" 1
549 1 28 PHE QE 1 34 LEU MD1 3.095 . 4.584 3.189 2.051 3.665 . 0 0 "[ . 1 . 2]" 1
550 1 28 PHE QE 1 34 LEU QD 2.400 . 3.090 2.272 1.742 2.857 0.058 9 0 "[ . 1 . 2]" 1
551 1 28 PHE QE 1 34 LEU MD2 3.095 . 4.584 2.397 1.773 3.663 0.027 9 0 "[ . 1 . 2]" 1
552 1 28 PHE QE 1 34 LEU HG 3.650 . 5.778 3.546 2.987 4.273 . 0 0 "[ . 1 . 2]" 1
553 1 29 PRO QB 1 30 ILE MD 3.340 . 5.111 4.406 3.658 5.300 0.189 18 0 "[ . 1 . 2]" 1
554 1 30 ILE H 1 30 ILE MD 3.165 . 4.735 2.694 1.790 4.911 0.177 5 0 "[ . 1 . 2]" 1
555 1 30 ILE H 1 30 ILE HG12 3.200 . 4.810 3.972 3.608 5.094 0.284 19 0 "[ . 1 . 2]" 1
556 1 30 ILE HA 1 30 ILE MD 2.850 . 4.057 3.282 2.428 3.870 . 0 0 "[ . 1 . 2]" 1
557 1 30 ILE HA 1 30 ILE HG12 2.865 . 4.090 3.220 2.529 3.696 . 0 0 "[ . 1 . 2]" 1
558 1 30 ILE HA 1 30 ILE HG13 2.970 . 4.315 2.547 2.295 2.855 . 0 0 "[ . 1 . 2]" 1
559 1 30 ILE HA 1 30 ILE MG 2.240 . 2.746 2.567 2.431 2.841 0.095 5 0 "[ . 1 . 2]" 1
560 1 30 ILE HA 1 31 GLY H 2.355 . 2.993 2.162 2.048 2.320 . 0 0 "[ . 1 . 2]" 1
561 1 30 ILE HA 1 32 THR H 2.985 . 4.348 3.376 3.124 3.770 . 0 0 "[ . 1 . 2]" 1
562 1 30 ILE HA 1 32 THR HB 3.650 . 5.778 4.803 4.364 5.156 . 0 0 "[ . 1 . 2]" 1
563 1 30 ILE HA 1 51 CYS H 3.075 . 4.541 3.734 3.242 4.367 . 0 0 "[ . 1 . 2]" 1
564 1 30 ILE HA 1 51 CYS HB2 3.155 . 4.713 2.365 1.791 3.641 0.009 17 0 "[ . 1 . 2]" 1
565 1 30 ILE HA 1 51 CYS QB 2.750 . 3.842 2.056 1.776 2.518 0.024 17 0 "[ . 1 . 2]" 1
566 1 30 ILE HA 1 51 CYS HB3 3.155 . 4.713 3.040 1.816 3.910 . 0 0 "[ . 1 . 2]" 1
567 1 30 ILE HA 1 55 SER HA 3.370 . 5.175 4.797 3.945 5.319 0.144 14 0 "[ . 1 . 2]" 1
568 1 30 ILE HB 1 30 ILE MD 2.540 . 3.391 2.348 2.193 2.534 . 0 0 "[ . 1 . 2]" 1
569 1 30 ILE HB 1 31 GLY H 3.145 . 4.692 4.142 4.019 4.302 . 0 0 "[ . 1 . 2]" 1
570 1 30 ILE MD 1 31 GLY H 3.225 . 4.864 4.764 4.338 5.001 0.137 13 0 "[ . 1 . 2]" 1
571 1 30 ILE MD 1 55 SER HA 3.320 . 5.068 3.433 2.530 4.144 . 0 0 "[ . 1 . 2]" 1
572 1 30 ILE HG12 1 30 ILE MG 2.100 . 2.445 2.266 2.107 2.361 . 0 0 "[ . 1 . 2]" 1
573 1 30 ILE HG12 1 55 SER HA 2.975 . 4.326 3.147 2.392 4.378 0.052 10 0 "[ . 1 . 2]" 1
574 1 30 ILE HG13 1 30 ILE MG 2.720 . 3.778 2.784 2.334 3.205 . 0 0 "[ . 1 . 2]" 1
575 1 30 ILE HG13 1 31 GLY H 3.015 . 4.412 4.297 3.612 4.749 0.337 20 0 "[ . 1 . 2]" 1
576 1 30 ILE HG13 1 52 LEU HA 3.300 . 5.025 5.199 4.328 5.618 0.593 6 2 "[ .+ 1 - . 2]" 1
577 1 30 ILE HG13 1 55 SER H 3.445 . 5.337 4.896 4.244 5.524 0.187 6 0 "[ . 1 . 2]" 1
578 1 30 ILE HG13 1 55 SER HA 2.815 . 3.982 3.117 2.303 3.682 . 0 0 "[ . 1 . 2]" 1
579 1 30 ILE MG 1 31 GLY H 2.405 . 3.101 2.455 2.175 2.667 . 0 0 "[ . 1 . 2]" 1
580 1 30 ILE MG 1 31 GLY HA3 3.195 . 4.799 3.196 2.736 3.404 . 0 0 "[ . 1 . 2]" 1
581 1 30 ILE MG 1 32 THR H 3.405 . 5.251 4.351 4.188 4.454 . 0 0 "[ . 1 . 2]" 1
582 1 30 ILE MG 1 51 CYS H 3.650 . 5.778 4.698 4.129 5.306 . 0 0 "[ . 1 . 2]" 1
583 1 30 ILE MG 1 52 LEU HA 2.725 . 3.789 3.040 2.037 3.909 0.120 5 0 "[ . 1 . 2]" 1
584 1 30 ILE MG 1 55 SER HA 3.155 . 4.713 4.105 3.426 4.715 0.002 16 0 "[ . 1 . 2]" 1
585 1 31 GLY H 1 32 THR H 2.635 . 3.595 2.380 2.196 2.672 . 0 0 "[ . 1 . 2]" 1
586 1 31 GLY H 1 32 THR HB 3.350 . 5.133 4.699 4.383 4.959 . 0 0 "[ . 1 . 2]" 1
587 1 31 GLY H 1 50 ILE HB 3.625 . 5.724 4.864 4.356 5.288 . 0 0 "[ . 1 . 2]" 1
588 1 31 GLY H 1 50 ILE MG 2.800 . 3.950 2.444 1.914 2.949 . 0 0 "[ . 1 . 2]" 1
589 1 31 GLY H 1 51 CYS H 2.770 . 3.885 3.332 2.728 3.757 . 0 0 "[ . 1 . 2]" 1
590 1 31 GLY H 1 51 CYS HA 3.385 . 5.208 5.033 4.597 5.477 0.269 16 0 "[ . 1 . 2]" 1
591 1 31 GLY H 1 51 CYS QB 2.795 . 3.939 3.068 2.420 3.619 . 0 0 "[ . 1 . 2]" 1
592 1 31 GLY H 1 52 LEU HG 3.375 . 5.186 4.761 4.050 5.128 . 0 0 "[ . 1 . 2]" 1
593 1 31 GLY HA2 1 33 TYR QE 3.085 . 4.563 3.872 3.225 4.667 0.104 10 0 "[ . 1 . 2]" 1
594 1 31 GLY HA2 1 50 ILE HB 3.095 . 4.584 4.646 4.246 4.796 0.211 17 0 "[ . 1 . 2]" 1
595 1 31 GLY HA2 1 50 ILE MD 3.650 . 5.778 5.507 5.078 5.810 0.033 17 0 "[ . 1 . 2]" 1
596 1 31 GLY HA2 1 50 ILE MG 2.475 . 3.251 2.245 2.069 2.380 . 0 0 "[ . 1 . 2]" 1
597 1 31 GLY HA2 1 52 LEU QD 2.665 . 3.660 3.075 2.546 3.466 . 0 0 "[ . 1 . 2]" 1
598 1 31 GLY HA3 1 32 THR HA 3.245 . 4.907 4.515 4.450 4.580 . 0 0 "[ . 1 . 2]" 1
599 1 31 GLY HA3 1 50 ILE MG 2.660 . 3.649 3.592 3.390 3.709 0.060 9 0 "[ . 1 . 2]" 1
600 1 32 THR H 1 32 THR HB 2.580 . 3.477 2.606 2.388 2.896 . 0 0 "[ . 1 . 2]" 1
601 1 32 THR H 1 32 THR MG 2.940 . 4.251 3.650 2.220 3.869 . 0 0 "[ . 1 . 2]" 1
602 1 32 THR H 1 33 TYR H 2.945 . 4.262 4.373 4.318 4.496 0.234 11 0 "[ . 1 . 2]" 1
603 1 32 THR H 1 33 TYR QD 3.255 . 4.928 4.594 4.129 4.998 0.070 17 0 "[ . 1 . 2]" 1
604 1 32 THR H 1 50 ILE HA 3.325 . 5.079 3.887 3.311 4.932 . 0 0 "[ . 1 . 2]" 1
605 1 32 THR H 1 50 ILE MG 3.075 . 4.541 2.597 2.227 3.480 . 0 0 "[ . 1 . 2]" 1
606 1 32 THR H 1 51 CYS H 2.820 . 3.993 3.265 2.716 4.039 0.046 11 0 "[ . 1 . 2]" 1
607 1 32 THR H 1 51 CYS QB 2.915 . 4.197 3.910 2.931 4.890 0.693 14 1 "[ . 1 +. 2]" 1
608 1 32 THR H 1 52 LEU QD 3.620 . 5.713 4.731 4.212 5.520 . 0 0 "[ . 1 . 2]" 1
609 1 32 THR H 1 57 TRP HH2 3.650 . 5.778 5.685 5.163 5.998 0.221 12 0 "[ . 1 . 2]" 1
610 1 32 THR H 1 57 TRP HZ3 3.425 . 5.294 4.867 4.112 5.316 0.022 11 0 "[ . 1 . 2]" 1
611 1 32 THR HA 1 32 THR MG 2.535 . 3.380 2.440 2.232 3.204 . 0 0 "[ . 1 . 2]" 1
612 1 32 THR HA 1 33 TYR H 2.520 . 3.348 2.116 2.054 2.212 . 0 0 "[ . 1 . 2]" 1
613 1 32 THR HA 1 33 TYR HA 3.230 . 4.874 4.341 4.270 4.384 . 0 0 "[ . 1 . 2]" 1
614 1 32 THR HA 1 33 TYR HB2 3.515 . 5.487 4.264 4.115 4.411 . 0 0 "[ . 1 . 2]" 1
615 1 32 THR HA 1 33 TYR QD 2.940 . 4.251 2.992 2.634 3.476 . 0 0 "[ . 1 . 2]" 1
616 1 32 THR HA 1 33 TYR QE 3.650 . 5.778 4.748 4.347 5.267 . 0 0 "[ . 1 . 2]" 1
617 1 32 THR HA 1 34 LEU H 3.650 . 5.778 5.933 5.839 6.032 0.255 15 0 "[ . 1 . 2]" 1
618 1 32 THR HB 1 34 LEU QD 3.015 . 4.412 3.745 2.844 4.881 0.469 14 0 "[ . 1 . 2]" 1
619 1 32 THR HB 1 50 ILE MG 2.900 . 4.165 4.217 3.969 4.515 0.350 19 0 "[ . 1 . 2]" 1
620 1 32 THR HB 1 51 CYS H 3.155 . 4.713 4.269 3.562 5.013 0.300 19 0 "[ . 1 . 2]" 1
621 1 32 THR MG 1 33 TYR HA 3.115 . 4.627 3.917 3.567 4.187 . 0 0 "[ . 1 . 2]" 1
622 1 32 THR MG 1 33 TYR QD 3.395 . 5.229 4.343 3.940 4.828 . 0 0 "[ . 1 . 2]" 1
623 1 32 THR MG 1 34 LEU QD 3.340 . 5.111 2.487 1.856 3.846 . 0 0 "[ . 1 . 2]" 1
624 1 32 THR MG 1 57 TRP HH2 3.080 . 4.552 3.957 2.366 4.623 0.071 16 0 "[ . 1 . 2]" 1
625 1 32 THR MG 1 57 TRP HZ3 3.600 . 5.670 4.228 2.317 4.959 . 0 0 "[ . 1 . 2]" 1
626 1 33 TYR H 1 33 TYR HB2 2.610 . 3.542 2.301 2.162 2.408 . 0 0 "[ . 1 . 2]" 1
627 1 33 TYR H 1 33 TYR HB3 2.685 . 3.703 3.565 3.465 3.642 . 0 0 "[ . 1 . 2]" 1
628 1 33 TYR H 1 33 TYR QD 2.680 . 3.692 2.382 2.048 2.693 . 0 0 "[ . 1 . 2]" 1
629 1 33 TYR H 1 33 TYR QE 3.235 . 4.885 4.699 4.402 5.019 0.133 10 0 "[ . 1 . 2]" 1
630 1 33 TYR H 1 34 LEU H 3.100 . 4.595 4.390 4.290 4.500 . 0 0 "[ . 1 . 2]" 1
631 1 33 TYR H 1 34 LEU QD 3.590 . 5.648 4.193 3.642 5.391 . 0 0 "[ . 1 . 2]" 1
632 1 33 TYR H 1 50 ILE MG 3.305 . 5.036 3.845 3.513 4.047 . 0 0 "[ . 1 . 2]" 1
633 1 33 TYR HA 1 33 TYR QD 2.600 . 3.520 3.168 3.124 3.215 . 0 0 "[ . 1 . 2]" 1
634 1 33 TYR HA 1 33 TYR QE 3.295 . 5.014 4.739 4.679 4.807 . 0 0 "[ . 1 . 2]" 1
635 1 33 TYR HA 1 34 LEU H 2.340 . 2.961 2.127 2.031 2.218 . 0 0 "[ . 1 . 2]" 1
636 1 33 TYR HA 1 50 ILE HA 3.110 . 4.616 3.137 2.643 3.490 . 0 0 "[ . 1 . 2]" 1
637 1 33 TYR HA 1 50 ILE HB 3.325 . 5.079 4.977 4.728 5.216 0.137 10 0 "[ . 1 . 2]" 1
638 1 33 TYR HA 1 50 ILE MD 2.885 . 4.133 4.000 3.630 4.215 0.082 8 0 "[ . 1 . 2]" 1
639 1 33 TYR HA 1 50 ILE HG12 3.090 . 4.574 3.384 2.887 3.783 . 0 0 "[ . 1 . 2]" 1
640 1 33 TYR HA 1 50 ILE HG13 3.055 . 4.498 2.470 2.118 2.967 . 0 0 "[ . 1 . 2]" 1
641 1 33 TYR HA 1 50 ILE MG 2.635 . 3.595 3.113 2.756 3.376 . 0 0 "[ . 1 . 2]" 1
642 1 33 TYR HB2 1 34 LEU H 3.240 . 4.896 4.265 4.189 4.424 . 0 0 "[ . 1 . 2]" 1
643 1 33 TYR HB2 1 48 SER HB2 3.575 . 5.616 4.585 3.805 5.255 . 0 0 "[ . 1 . 2]" 1
644 1 33 TYR HB2 1 48 SER HB3 3.335 . 5.100 4.058 3.695 4.355 . 0 0 "[ . 1 . 2]" 1
645 1 33 TYR HB2 1 50 ILE MD 3.650 . 5.778 5.437 5.069 5.704 . 0 0 "[ . 1 . 2]" 1
646 1 33 TYR HB2 1 50 ILE HG12 3.295 . 5.014 4.813 4.476 5.084 0.070 8 0 "[ . 1 . 2]" 1
647 1 33 TYR HB2 1 50 ILE MG 3.045 . 4.477 4.653 4.455 4.815 0.339 16 0 "[ . 1 . 2]" 1
648 1 33 TYR HB3 1 34 LEU H 2.940 . 4.251 3.335 3.183 3.575 . 0 0 "[ . 1 . 2]" 1
649 1 33 TYR HB3 1 48 SER HB2 2.755 . 3.853 2.912 2.077 3.669 . 0 0 "[ . 1 . 2]" 1
650 1 33 TYR HB3 1 48 SER HB3 3.110 . 4.616 2.399 2.072 2.666 . 0 0 "[ . 1 . 2]" 1
651 1 33 TYR HB3 1 50 ILE HG12 3.095 . 4.584 4.380 3.795 4.642 0.058 20 0 "[ . 1 . 2]" 1
652 1 33 TYR HB3 1 50 ILE MG 3.240 . 4.896 4.793 4.427 5.121 0.225 10 0 "[ . 1 . 2]" 1
653 1 33 TYR QD 1 34 LEU H 3.250 . 4.918 4.401 4.118 4.614 . 0 0 "[ . 1 . 2]" 1
654 1 33 TYR QD 1 48 SER HB2 2.505 . 3.316 2.104 1.786 3.086 0.014 14 0 "[ . 1 . 2]" 1
655 1 33 TYR QD 1 48 SER HB3 2.785 . 3.918 2.964 2.335 3.480 . 0 0 "[ . 1 . 2]" 1
656 1 33 TYR QD 1 50 ILE HB 3.400 . 5.240 5.158 4.960 5.328 0.088 10 0 "[ . 1 . 2]" 1
657 1 33 TYR QD 1 50 ILE MD 2.610 . 3.542 2.987 2.729 3.376 . 0 0 "[ . 1 . 2]" 1
658 1 33 TYR QD 1 50 ILE HG12 2.700 . 3.735 3.025 2.376 3.222 . 0 0 "[ . 1 . 2]" 1
659 1 33 TYR QD 1 50 ILE HG13 2.770 . 3.885 3.240 2.843 3.790 . 0 0 "[ . 1 . 2]" 1
660 1 33 TYR QD 1 50 ILE MG 2.345 . 2.972 3.090 2.975 3.228 0.257 4 0 "[ . 1 . 2]" 1
661 1 33 TYR QE 1 48 SER H 3.650 . 5.778 5.548 4.834 5.965 0.187 7 0 "[ . 1 . 2]" 1
662 1 33 TYR QE 1 48 SER HB2 3.310 . 5.047 3.980 3.399 5.104 0.058 12 0 "[ . 1 . 2]" 1
663 1 33 TYR QE 1 48 SER HB3 3.650 . 5.778 5.135 4.480 5.722 . 0 0 "[ . 1 . 2]" 1
664 1 33 TYR QE 1 50 ILE HB 3.170 . 4.746 4.813 4.653 4.925 0.180 10 0 "[ . 1 . 2]" 1
665 1 33 TYR QE 1 50 ILE MD 2.435 . 3.165 2.663 2.443 2.897 . 0 0 "[ . 1 . 2]" 1
666 1 33 TYR QE 1 50 ILE HG12 2.655 . 3.638 2.920 2.611 3.139 . 0 0 "[ . 1 . 2]" 1
667 1 33 TYR QE 1 50 ILE HG13 3.005 . 4.391 3.969 3.688 4.279 . 0 0 "[ . 1 . 2]" 1
668 1 33 TYR QE 1 50 ILE MG 2.425 . 3.144 3.070 2.957 3.192 0.048 18 0 "[ . 1 . 2]" 1
669 1 33 TYR QE 1 52 LEU QD 2.770 . 3.885 4.079 3.836 4.401 0.516 17 1 "[ . 1 . + 2]" 1
670 1 34 LEU H 1 34 LEU HB2 2.825 . 4.004 2.472 2.373 2.663 . 0 0 "[ . 1 . 2]" 1
671 1 34 LEU H 1 34 LEU HB3 2.735 . 3.810 3.660 3.601 3.782 . 0 0 "[ . 1 . 2]" 1
672 1 34 LEU H 1 34 LEU MD1 2.965 . 4.305 3.048 2.551 4.086 . 0 0 "[ . 1 . 2]" 1
673 1 34 LEU H 1 34 LEU QD 2.585 . 3.488 2.890 2.287 3.588 0.100 13 0 "[ . 1 . 2]" 1
674 1 34 LEU H 1 34 LEU MD2 2.965 . 4.305 4.096 2.347 4.379 0.074 15 0 "[ . 1 . 2]" 1
675 1 34 LEU H 1 34 LEU HG 3.355 . 5.143 4.043 3.033 4.475 . 0 0 "[ . 1 . 2]" 1
676 1 34 LEU H 1 35 ASN H 3.235 . 4.885 4.475 4.319 4.603 . 0 0 "[ . 1 . 2]" 1
677 1 34 LEU H 1 48 SER HB2 3.170 . 4.746 3.944 1.839 4.638 . 0 0 "[ . 1 . 2]" 1
678 1 34 LEU H 1 48 SER HB3 3.170 . 4.746 2.533 2.114 2.993 . 0 0 "[ . 1 . 2]" 1
679 1 34 LEU H 1 49 ILE H 2.785 . 3.918 2.731 2.259 3.098 . 0 0 "[ . 1 . 2]" 1
680 1 34 LEU H 1 49 ILE HA 3.500 . 5.455 4.694 4.345 5.345 . 0 0 "[ . 1 . 2]" 1
681 1 34 LEU H 1 49 ILE MD 3.305 . 5.036 4.866 4.494 5.120 0.084 2 0 "[ . 1 . 2]" 1
682 1 34 LEU H 1 50 ILE HA 2.990 . 4.359 4.042 3.512 4.383 0.025 2 0 "[ . 1 . 2]" 1
683 1 34 LEU H 1 50 ILE HG13 3.545 . 5.552 3.678 3.291 3.962 . 0 0 "[ . 1 . 2]" 1
684 1 34 LEU H 1 50 ILE MG 3.110 . 4.616 4.750 4.497 4.970 0.354 13 0 "[ . 1 . 2]" 1
685 1 34 LEU H 1 57 TRP HE3 3.650 . 5.778 5.158 4.589 5.762 . 0 0 "[ . 1 . 2]" 1
686 1 34 LEU H 1 57 TRP HZ3 3.010 . 4.402 3.717 3.251 4.227 . 0 0 "[ . 1 . 2]" 1
687 1 34 LEU HA 1 34 LEU MD1 2.855 . 4.068 2.810 1.965 3.866 . 0 0 "[ . 1 . 2]" 1
688 1 34 LEU HA 1 34 LEU QD 2.305 . 2.886 2.344 1.938 2.614 . 0 0 "[ . 1 . 2]" 1
689 1 34 LEU HA 1 34 LEU MD2 2.855 . 4.068 3.317 1.943 3.825 . 0 0 "[ . 1 . 2]" 1
690 1 34 LEU HA 1 34 LEU HG 2.605 . 3.531 2.621 2.363 3.560 0.030 2 0 "[ . 1 . 2]" 1
691 1 34 LEU HA 1 35 ASN HB2 3.065 . 4.520 4.061 3.860 4.275 . 0 0 "[ . 1 . 2]" 1
692 1 34 LEU HA 1 36 TYR QD 3.390 . 5.219 4.534 4.245 4.936 . 0 0 "[ . 1 . 2]" 1
693 1 34 LEU HB2 1 34 LEU MD1 2.810 . 3.971 2.380 2.164 3.145 . 0 0 "[ . 1 . 2]" 1
694 1 34 LEU HB2 1 34 LEU MD2 2.810 . 3.971 2.565 2.179 3.155 . 0 0 "[ . 1 . 2]" 1
695 1 34 LEU HB2 1 35 ASN H 2.780 . 3.907 4.024 3.899 4.127 0.220 11 0 "[ . 1 . 2]" 1
696 1 34 LEU HB2 1 36 TYR QE 3.270 . 4.960 2.946 2.084 3.525 . 0 0 "[ . 1 . 2]" 1
697 1 34 LEU HB2 1 49 ILE H 3.080 . 4.552 2.911 2.529 3.866 . 0 0 "[ . 1 . 2]" 1
698 1 34 LEU HB3 1 34 LEU MD1 2.930 . 4.229 2.978 2.391 3.221 . 0 0 "[ . 1 . 2]" 1
699 1 34 LEU HB3 1 34 LEU QD 2.445 . 3.187 2.196 2.045 2.493 . 0 0 "[ . 1 . 2]" 1
700 1 34 LEU HB3 1 34 LEU MD2 2.930 . 4.229 2.301 2.117 3.074 . 0 0 "[ . 1 . 2]" 1
701 1 34 LEU HB3 1 35 ASN H 3.410 . 5.261 2.828 2.617 3.118 . 0 0 "[ . 1 . 2]" 1
702 1 34 LEU HB3 1 35 ASN HB3 3.395 . 5.229 4.967 4.751 5.608 0.379 20 0 "[ . 1 . 2]" 1
703 1 34 LEU HB3 1 36 TYR QD 2.960 . 4.294 2.587 2.200 3.195 . 0 0 "[ . 1 . 2]" 1
704 1 34 LEU HB3 1 36 TYR QE 3.180 . 4.767 2.479 1.985 3.519 . 0 0 "[ . 1 . 2]" 1
705 1 34 LEU QD 1 35 ASN H 2.640 . 3.606 3.540 2.724 3.879 0.273 1 0 "[ . 1 . 2]" 1
706 1 34 LEU QD 1 36 TYR QD 2.865 . 4.090 3.705 3.359 4.108 0.018 2 0 "[ . 1 . 2]" 1
707 1 34 LEU QD 1 36 TYR QE 2.685 . 3.703 2.265 1.900 3.094 . 0 0 "[ . 1 . 2]" 1
708 1 34 LEU QD 1 50 ILE HA 3.620 . 5.713 4.045 3.532 5.091 . 0 0 "[ . 1 . 2]" 1
709 1 34 LEU QD 1 57 TRP HE1 3.620 . 5.713 4.723 4.293 5.560 . 0 0 "[ . 1 . 2]" 1
710 1 34 LEU QD 1 57 TRP HH2 2.715 . 3.767 2.008 1.821 2.465 . 0 0 "[ . 1 . 2]" 1
711 1 34 LEU QD 1 57 TRP HZ2 3.325 . 5.079 3.053 2.608 3.477 . 0 0 "[ . 1 . 2]" 1
712 1 34 LEU QD 1 57 TRP HZ3 3.050 . 4.488 2.331 1.810 3.426 . 0 0 "[ . 1 . 2]" 1
713 1 34 LEU MD1 1 35 ASN H 3.050 . 4.488 4.276 3.205 4.906 0.418 11 0 "[ . 1 . 2]" 1
714 1 34 LEU MD1 1 36 TYR QE 3.265 . 4.950 3.863 1.921 4.719 . 0 0 "[ . 1 . 2]" 1
715 1 34 LEU MD1 1 57 TRP HH2 3.190 . 4.788 2.173 1.863 4.090 . 0 0 "[ . 1 . 2]" 1
716 1 34 LEU MD2 1 35 ASN H 3.050 . 4.488 3.991 2.742 4.768 0.280 2 0 "[ . 1 . 2]" 1
717 1 34 LEU MD2 1 36 TYR QE 3.265 . 4.950 2.606 2.014 4.860 . 0 0 "[ . 1 . 2]" 1
718 1 34 LEU MD2 1 57 TRP HH2 3.190 . 4.788 2.801 1.939 3.804 . 0 0 "[ . 1 . 2]" 1
719 1 34 LEU HG 1 36 TYR QE 3.430 . 5.305 4.243 3.789 5.289 . 0 0 "[ . 1 . 2]" 1
720 1 34 LEU HG 1 57 TRP HH2 3.410 . 5.261 3.839 2.311 4.428 . 0 0 "[ . 1 . 2]" 1
721 1 34 LEU HG 1 57 TRP HZ2 3.650 . 5.778 5.544 4.247 6.034 0.256 9 0 "[ . 1 . 2]" 1
722 1 34 LEU HG 1 57 TRP HZ3 3.650 . 5.778 4.582 2.937 5.451 . 0 0 "[ . 1 . 2]" 1
723 1 35 ASN H 1 35 ASN HB2 2.580 . 3.477 2.421 2.206 2.646 . 0 0 "[ . 1 . 2]" 1
724 1 35 ASN H 1 35 ASN HB3 2.495 . 3.294 2.600 2.382 3.454 0.160 20 0 "[ . 1 . 2]" 1
725 1 35 ASN H 1 36 TYR H 2.725 . 3.789 4.079 3.885 4.182 0.393 14 0 "[ . 1 . 2]" 1
726 1 35 ASN H 1 36 TYR QE 3.580 . 5.627 4.956 4.417 5.732 0.105 20 0 "[ . 1 . 2]" 1
727 1 35 ASN H 1 48 SER HA 3.650 . 5.778 5.173 4.648 5.729 . 0 0 "[ . 1 . 2]" 1
728 1 35 ASN HA 1 36 TYR H 2.555 . 3.423 2.127 2.004 2.475 . 0 0 "[ . 1 . 2]" 1
729 1 35 ASN HA 1 48 SER HA 3.350 . 5.133 3.831 3.073 4.517 . 0 0 "[ . 1 . 2]" 1
730 1 35 ASN HA 1 48 SER HB3 3.145 . 4.692 4.399 3.121 4.775 0.083 3 0 "[ . 1 . 2]" 1
731 1 35 ASN HB2 1 36 TYR H 3.150 . 4.702 4.489 4.418 4.544 . 0 0 "[ . 1 . 2]" 1
732 1 35 ASN HB3 1 36 TYR H 3.040 . 4.466 4.219 4.145 4.352 . 0 0 "[ . 1 . 2]" 1
733 1 35 ASN HB3 1 36 TYR HA 3.240 . 4.896 4.675 4.525 4.844 . 0 0 "[ . 1 . 2]" 1
734 1 36 TYR H 1 36 TYR QD 2.905 . 4.176 2.867 2.646 3.153 . 0 0 "[ . 1 . 2]" 1
735 1 36 TYR H 1 36 TYR QE 3.590 . 5.648 5.173 4.957 5.436 . 0 0 "[ . 1 . 2]" 1
736 1 36 TYR H 1 37 GLU H 3.250 . 4.918 4.434 4.331 4.506 . 0 0 "[ . 1 . 2]" 1
737 1 36 TYR H 1 48 SER HA 2.765 . 3.875 3.248 2.108 3.982 0.107 12 0 "[ . 1 . 2]" 1
738 1 36 TYR H 1 48 SER HB3 3.305 . 5.036 4.885 3.823 5.312 0.276 9 0 "[ . 1 . 2]" 1
739 1 36 TYR HA 1 37 GLU H 2.600 . 3.520 2.109 2.013 2.207 . 0 0 "[ . 1 . 2]" 1
740 1 36 TYR QD 1 37 GLU H 3.215 . 4.842 4.151 3.897 4.382 . 0 0 "[ . 1 . 2]" 1
741 1 36 TYR QD 1 49 ILE H 3.040 . 4.466 3.828 3.427 4.703 0.237 12 0 "[ . 1 . 2]" 1
742 1 36 TYR QD 1 49 ILE MD 2.820 . 3.993 3.780 3.287 4.089 0.096 2 0 "[ . 1 . 2]" 1
743 1 36 TYR QE 1 49 ILE H 3.650 . 5.778 4.511 3.937 5.041 . 0 0 "[ . 1 . 2]" 1
744 1 36 TYR QE 1 49 ILE MD 2.735 . 3.810 2.413 2.068 2.877 . 0 0 "[ . 1 . 2]" 1
745 1 36 TYR QE 1 49 ILE MG 3.175 . 4.756 3.876 3.160 4.481 . 0 0 "[ . 1 . 2]" 1
746 1 36 TYR QE 1 60 ALA MB 2.920 . 4.208 3.746 3.048 4.414 0.206 13 0 "[ . 1 . 2]" 1
747 1 37 GLU H 1 37 GLU QB 2.660 . 3.649 2.529 2.357 2.966 . 0 0 "[ . 1 . 2]" 1
748 1 37 GLU H 1 38 CYS H 3.280 . 4.982 4.346 4.231 4.481 . 0 0 "[ . 1 . 2]" 1
749 1 37 GLU HA 1 38 CYS H 2.555 . 3.423 2.216 2.069 2.556 . 0 0 "[ . 1 . 2]" 1
750 1 37 GLU HA 1 38 CYS HA 3.175 . 4.756 4.378 4.306 4.471 . 0 0 "[ . 1 . 2]" 1
751 1 37 GLU HA 1 46 PRO QB 2.900 . 4.165 2.830 1.893 4.268 0.103 2 0 "[ . 1 . 2]" 1
752 1 37 GLU QB 1 38 CYS H 2.510 . 3.326 3.252 2.127 3.744 0.417 11 0 "[ . 1 . 2]" 1
753 1 38 CYS H 1 38 CYS HB2 2.665 . 3.660 2.472 2.397 2.551 . 0 0 "[ . 1 . 2]" 1
754 1 38 CYS H 1 38 CYS QB 2.405 . 3.101 2.435 2.364 2.509 . 0 0 "[ . 1 . 2]" 1
755 1 38 CYS H 1 38 CYS HB3 2.665 . 3.660 3.660 3.580 3.730 0.070 6 0 "[ . 1 . 2]" 1
756 1 38 CYS H 1 39 ARG H 3.225 . 4.864 4.527 4.437 4.607 . 0 0 "[ . 1 . 2]" 1
757 1 38 CYS HA 1 39 ARG H 2.485 . 3.273 2.235 2.152 2.382 . 0 0 "[ . 1 . 2]" 1
758 1 38 CYS QB 1 39 ARG H 2.720 . 3.778 2.787 2.293 3.363 . 0 0 "[ . 1 . 2]" 1
759 1 38 CYS QB 1 42 TYR HB2 3.110 . 4.616 2.405 1.792 3.154 0.008 2 0 "[ . 1 . 2]" 1
760 1 38 CYS HB2 1 39 ARG H 2.985 . 4.348 3.972 3.622 4.302 . 0 0 "[ . 1 . 2]" 1
761 1 38 CYS HB3 1 39 ARG H 2.985 . 4.348 2.852 2.315 3.511 . 0 0 "[ . 1 . 2]" 1
762 1 39 ARG H 1 42 TYR HB2 3.170 . 4.746 4.261 3.155 4.932 0.186 14 0 "[ . 1 . 2]" 1
763 1 39 ARG H 1 42 TYR HB3 3.650 . 5.778 5.493 4.743 6.245 0.468 19 0 "[ . 1 . 2]" 1
764 1 39 ARG H 1 42 TYR QE 3.195 . 4.799 3.943 1.918 5.319 0.519 7 1 "[ . + 1 . 2]" 1
765 1 40 PRO HA 1 41 GLY H 2.425 . 3.144 2.346 2.139 3.412 0.268 4 0 "[ . 1 . 2]" 1
766 1 40 PRO HA 1 42 TYR H 3.175 . 4.756 3.527 2.974 4.828 0.072 19 0 "[ . 1 . 2]" 1
767 1 40 PRO HA 1 42 TYR QD 3.650 . 5.778 4.671 3.874 5.964 0.186 4 0 "[ . 1 . 2]" 1
768 1 40 PRO QB 1 41 GLY QA 3.300 . 5.025 3.735 3.564 4.264 . 0 0 "[ . 1 . 2]" 1
769 1 41 GLY H 1 42 TYR H 2.515 . 3.337 2.528 2.314 2.864 . 0 0 "[ . 1 . 2]" 1
770 1 41 GLY H 1 42 TYR HB2 3.275 . 4.971 4.851 4.564 5.294 0.323 7 0 "[ . 1 . 2]" 1
771 1 41 GLY QA 1 42 TYR HA 3.155 . 4.713 3.971 3.886 4.076 . 0 0 "[ . 1 . 2]" 1
772 1 41 GLY QA 1 112 ILE MD 3.075 . 4.541 3.326 1.916 4.807 0.265 1 0 "[ . 1 . 2]" 1
773 1 41 GLY QA 1 112 ILE HG13 3.030 . 4.444 3.042 1.947 4.505 0.061 1 0 "[ . 1 . 2]" 1
774 1 41 GLY QA 1 112 ILE MG 3.540 . 5.541 2.015 1.686 3.413 0.114 13 0 "[ . 1 . 2]" 1
775 1 42 TYR H 1 42 TYR HB2 2.625 . 3.574 2.506 2.440 2.697 . 0 0 "[ . 1 . 2]" 1
776 1 42 TYR H 1 42 TYR HB3 2.755 . 3.853 3.696 3.624 3.830 . 0 0 "[ . 1 . 2]" 1
777 1 42 TYR H 1 43 SER H 3.290 . 5.003 4.452 4.340 4.598 . 0 0 "[ . 1 . 2]" 1
778 1 42 TYR HA 1 42 TYR QE 3.175 . 4.756 4.491 4.228 4.748 . 0 0 "[ . 1 . 2]" 1
779 1 42 TYR HA 1 43 SER H 2.515 . 3.337 2.080 1.982 2.236 . 0 0 "[ . 1 . 2]" 1
780 1 42 TYR HA 1 43 SER HA 3.175 . 4.756 4.254 4.116 4.349 . 0 0 "[ . 1 . 2]" 1
781 1 42 TYR HA 1 43 SER QB 3.375 . 5.186 4.249 3.848 4.577 . 0 0 "[ . 1 . 2]" 1
782 1 42 TYR HA 1 65 ARG H 3.115 . 4.627 3.528 3.135 3.973 . 0 0 "[ . 1 . 2]" 1
783 1 42 TYR HA 1 66 ARG H 3.380 . 5.197 5.098 4.452 5.554 0.357 20 0 "[ . 1 . 2]" 1
784 1 42 TYR HA 1 66 ARG HA 3.000 . 4.380 3.567 2.563 4.704 0.324 1 0 "[ . 1 . 2]" 1
785 1 42 TYR HB2 1 43 SER H 2.900 . 4.165 4.052 3.885 4.160 . 0 0 "[ . 1 . 2]" 1
786 1 42 TYR HB2 1 65 ARG H 3.345 . 5.122 3.981 3.629 4.462 . 0 0 "[ . 1 . 2]" 1
787 1 42 TYR HB3 1 43 SER H 2.810 . 3.971 2.909 2.722 3.135 . 0 0 "[ . 1 . 2]" 1
788 1 42 TYR HB3 1 43 SER HA 3.650 . 5.778 4.886 4.425 5.055 . 0 0 "[ . 1 . 2]" 1
789 1 42 TYR HB3 1 64 CYS HA 3.425 . 5.294 3.111 2.679 3.540 . 0 0 "[ . 1 . 2]" 1
790 1 42 TYR HB3 1 66 ARG H 3.650 . 5.778 5.411 4.874 5.780 0.003 17 0 "[ . 1 . 2]" 1
791 1 42 TYR QD 1 43 SER QB 3.410 . 5.261 5.059 4.445 5.654 0.392 7 0 "[ . 1 . 2]" 1
792 1 42 TYR QD 1 65 ARG HB2 3.365 . 5.165 4.484 4.141 4.822 . 0 0 "[ . 1 . 2]" 1
793 1 42 TYR QD 1 65 ARG HB3 3.545 . 5.552 4.843 4.553 5.128 . 0 0 "[ . 1 . 2]" 1
794 1 42 TYR QE 1 43 SER H 3.585 . 5.638 5.608 5.255 5.830 0.192 8 0 "[ . 1 . 2]" 1
795 1 42 TYR QE 1 64 CYS HB2 3.365 . 5.165 4.319 3.530 4.977 . 0 0 "[ . 1 . 2]" 1
796 1 42 TYR QE 1 65 ARG H 3.435 . 5.315 4.917 4.495 5.286 . 0 0 "[ . 1 . 2]" 1
797 1 42 TYR QE 1 65 ARG HA 3.080 . 4.552 4.153 3.630 4.685 0.133 10 0 "[ . 1 . 2]" 1
798 1 42 TYR QE 1 66 ARG H 2.790 . 3.928 3.557 3.019 4.140 0.211 4 0 "[ . 1 . 2]" 1
799 1 42 TYR QE 1 66 ARG HA 2.930 . 4.229 3.672 2.777 4.340 0.110 11 0 "[ . 1 . 2]" 1
800 1 42 TYR QE 1 66 ARG QB 2.895 . 4.154 2.361 1.932 3.324 . 0 0 "[ . 1 . 2]" 1
801 1 42 TYR QE 1 66 ARG QD 3.485 . 5.423 4.017 3.031 4.765 . 0 0 "[ . 1 . 2]" 1
802 1 42 TYR QE 1 67 LYS H 3.640 . 5.756 5.584 4.602 6.056 0.300 4 0 "[ . 1 . 2]" 1
803 1 43 SER H 1 43 SER QB 2.410 . 3.112 2.433 2.212 2.715 . 0 0 "[ . 1 . 2]" 1
804 1 43 SER H 1 44 GLY H 2.855 . 4.068 2.941 2.524 4.477 0.409 7 0 "[ . 1 . 2]" 1
805 1 43 SER H 1 64 CYS HA 3.065 . 4.520 4.565 4.120 4.896 0.376 4 0 "[ . 1 . 2]" 1
806 1 43 SER H 1 64 CYS HB3 3.000 . 4.380 4.612 4.414 4.959 0.579 20 1 "[ . 1 . +]" 1
807 1 43 SER H 1 65 ARG H 2.640 . 3.606 2.603 2.268 2.901 . 0 0 "[ . 1 . 2]" 1
808 1 43 SER H 1 65 ARG HA 3.325 . 5.079 4.555 4.265 4.789 . 0 0 "[ . 1 . 2]" 1
809 1 43 SER H 1 65 ARG HB2 3.140 . 4.681 3.108 2.549 3.677 . 0 0 "[ . 1 . 2]" 1
810 1 43 SER H 1 65 ARG HB3 3.410 . 5.261 4.354 3.890 4.830 . 0 0 "[ . 1 . 2]" 1
811 1 43 SER H 1 65 ARG QG 3.510 . 5.477 4.641 4.261 5.124 . 0 0 "[ . 1 . 2]" 1
812 1 43 SER H 1 66 ARG H 3.375 . 5.186 4.942 4.575 5.297 0.111 1 0 "[ . 1 . 2]" 1
813 1 43 SER HA 1 65 ARG H 3.285 . 4.993 4.714 4.114 5.015 0.022 18 0 "[ . 1 . 2]" 1
814 1 43 SER HA 1 65 ARG HB2 3.375 . 5.186 4.696 4.379 5.121 . 0 0 "[ . 1 . 2]" 1
815 1 43 SER QB 1 44 GLY H 2.295 . 2.864 2.647 2.028 3.390 0.526 1 1 "[+ . 1 . 2]" 1
816 1 43 SER QB 1 64 CYS HA 3.125 . 4.649 4.794 4.221 5.202 0.553 1 1 "[+ . 1 . 2]" 1
817 1 43 SER QB 1 65 ARG H 2.815 . 3.982 3.373 2.834 4.010 0.027 7 0 "[ . 1 . 2]" 1
818 1 43 SER QB 1 65 ARG HB2 2.835 . 4.025 2.102 1.763 3.154 0.037 2 0 "[ . 1 . 2]" 1
819 1 43 SER QB 1 65 ARG QD 2.630 . 3.585 3.149 2.208 3.780 0.195 19 0 "[ . 1 . 2]" 1
820 1 43 SER QB 1 65 ARG QG 2.820 . 3.993 3.792 3.238 4.358 0.365 1 0 "[ . 1 . 2]" 1
821 1 44 GLY H 1 64 CYS HA 3.125 . 4.649 2.951 2.182 4.738 0.089 11 0 "[ . 1 . 2]" 1
822 1 44 GLY H 1 65 ARG H 3.145 . 4.692 2.432 1.791 4.489 0.009 4 0 "[ . 1 . 2]" 1
823 1 44 GLY H 1 65 ARG HB2 3.030 . 4.444 3.267 2.668 4.462 0.017 7 0 "[ . 1 . 2]" 1
824 1 44 GLY H 1 65 ARG QG 2.885 . 4.133 3.718 3.150 4.543 0.410 3 0 "[ . 1 . 2]" 1
825 1 44 GLY HA2 1 45 ARG H 2.245 . 2.757 2.381 2.103 3.428 0.672 2 1 "[ + . 1 . 2]" 1
826 1 44 GLY HA2 1 45 ARG HB2 3.560 . 5.584 4.295 3.878 4.841 . 0 0 "[ . 1 . 2]" 1
827 1 44 GLY HA2 1 45 ARG QB 3.135 . 4.670 4.118 3.747 4.598 . 0 0 "[ . 1 . 2]" 1
828 1 44 GLY HA2 1 45 ARG HB3 3.560 . 5.584 5.329 4.724 5.733 0.149 10 0 "[ . 1 . 2]" 1
829 1 44 GLY HA2 1 64 CYS HA 2.945 . 4.262 4.069 3.301 4.377 0.115 20 0 "[ . 1 . 2]" 1
830 1 44 GLY HA2 1 65 ARG H 3.455 . 5.358 4.630 4.108 5.089 . 0 0 "[ . 1 . 2]" 1
831 1 44 GLY HA3 1 45 ARG H 2.435 . 3.165 2.820 2.405 3.130 . 0 0 "[ . 1 . 2]" 1
832 1 44 GLY HA3 1 45 ARG HA 3.240 . 4.896 4.554 4.313 5.008 0.112 11 0 "[ . 1 . 2]" 1
833 1 44 GLY HA3 1 64 CYS H 3.310 . 5.047 4.850 4.297 5.347 0.301 5 0 "[ . 1 . 2]" 1
834 1 44 GLY HA3 1 64 CYS HA 2.900 . 4.165 2.447 1.912 2.783 . 0 0 "[ . 1 . 2]" 1
835 1 44 GLY HA3 1 65 ARG QD 2.875 . 4.111 4.165 3.567 4.665 0.553 14 1 "[ . 1 +. 2]" 1
836 1 45 ARG H 1 45 ARG QB 2.180 . 2.617 2.411 2.014 2.855 0.238 11 0 "[ . 1 . 2]" 1
837 1 45 ARG H 1 46 PRO QD 3.270 . 4.960 4.045 2.505 4.489 . 0 0 "[ . 1 . 2]" 1
838 1 45 ARG H 1 64 CYS HA 3.490 . 5.433 4.849 3.476 5.495 0.062 20 0 "[ . 1 . 2]" 1
839 1 45 ARG HA 1 45 ARG QD 2.370 . 3.026 2.285 1.847 3.240 0.214 9 0 "[ . 1 . 2]" 1
840 1 45 ARG HA 1 46 PRO QD 2.700 . 3.735 2.033 1.798 2.949 0.002 8 0 "[ . 1 . 2]" 1
841 1 45 ARG QB 1 45 ARG QD 2.395 . 3.079 2.451 2.002 3.009 . 0 0 "[ . 1 . 2]" 1
842 1 45 ARG QB 1 46 PRO QD 2.620 . 3.563 3.045 1.891 3.776 0.213 3 0 "[ . 1 . 2]" 1
843 1 45 ARG QD 1 46 PRO QD 2.265 . 2.800 2.721 2.024 3.415 0.615 9 1 "[ . +1 . 2]" 1
844 1 46 PRO HA 1 47 PHE H 2.410 . 3.112 2.207 2.053 3.436 0.325 17 0 "[ . 1 . 2]" 1
845 1 46 PRO QB 1 47 PHE H 2.860 . 4.079 3.095 2.797 3.510 . 0 0 "[ . 1 . 2]" 1
846 1 46 PRO QB 1 47 PHE HA 3.190 . 4.788 3.954 3.720 4.164 . 0 0 "[ . 1 . 2]" 1
847 1 46 PRO QD 1 47 PHE H 3.380 . 5.197 4.809 2.836 5.020 . 0 0 "[ . 1 . 2]" 1
848 1 46 PRO QG 1 47 PHE HA 3.490 . 5.433 5.325 4.243 5.820 0.387 19 0 "[ . 1 . 2]" 1
849 1 47 PHE H 1 47 PHE QB 2.660 . 3.649 2.714 2.321 3.342 . 0 0 "[ . 1 . 2]" 1
850 1 47 PHE H 1 47 PHE QD 3.065 . 4.520 3.753 3.288 4.427 . 0 0 "[ . 1 . 2]" 1
851 1 47 PHE H 1 48 SER H 3.175 . 4.756 4.187 2.642 4.644 . 0 0 "[ . 1 . 2]" 1
852 1 47 PHE HA 1 47 PHE QD 3.170 . 4.746 2.690 2.438 3.717 . 0 0 "[ . 1 . 2]" 1
853 1 47 PHE HA 1 48 SER H 2.370 . 3.026 2.457 2.118 3.455 0.429 2 0 "[ . 1 . 2]" 1
854 1 47 PHE QB 1 48 SER H 2.350 . 2.983 2.583 1.698 3.387 0.404 9 0 "[ . 1 . 2]" 1
855 1 47 PHE QB 1 49 ILE H 3.570 . 5.606 5.564 5.190 5.864 0.259 8 0 "[ . 1 . 2]" 1
856 1 47 PHE QD 1 48 SER H 2.845 . 4.047 3.279 2.251 3.704 . 0 0 "[ . 1 . 2]" 1
857 1 48 SER H 1 48 SER HB2 2.685 . 3.703 2.641 2.390 3.513 . 0 0 "[ . 1 . 2]" 1
858 1 48 SER HA 1 49 ILE H 2.435 . 3.165 2.248 2.097 2.426 . 0 0 "[ . 1 . 2]" 1
859 1 48 SER HA 1 49 ILE MD 3.600 . 5.670 5.351 4.690 5.560 . 0 0 "[ . 1 . 2]" 1
860 1 48 SER HA 1 49 ILE MG 2.995 . 4.369 3.903 3.642 4.775 0.406 12 0 "[ . 1 . 2]" 1
861 1 48 SER HA 1 50 ILE MD 3.510 . 5.477 4.931 4.615 5.568 0.091 10 0 "[ . 1 . 2]" 1
862 1 48 SER HB2 1 49 ILE H 3.120 . 4.638 3.812 2.590 4.234 . 0 0 "[ . 1 . 2]" 1
863 1 48 SER HB2 1 50 ILE MD 3.005 . 4.391 3.316 2.881 3.957 . 0 0 "[ . 1 . 2]" 1
864 1 48 SER HB2 1 50 ILE HG12 3.555 . 5.573 4.444 3.282 5.017 . 0 0 "[ . 1 . 2]" 1
865 1 48 SER HB2 1 50 ILE HG13 3.105 . 4.606 3.683 2.445 4.261 . 0 0 "[ . 1 . 2]" 1
866 1 48 SER HB3 1 49 ILE H 2.700 . 3.735 2.943 2.284 3.730 . 0 0 "[ . 1 . 2]" 1
867 1 48 SER HB3 1 49 ILE HA 3.420 . 5.283 4.736 4.433 5.770 0.487 12 0 "[ . 1 . 2]" 1
868 1 48 SER HB3 1 50 ILE MD 3.135 . 4.670 4.117 3.700 4.629 . 0 0 "[ . 1 . 2]" 1
869 1 48 SER HB3 1 50 ILE HG13 3.130 . 4.660 3.778 3.166 4.223 . 0 0 "[ . 1 . 2]" 1
870 1 48 SER HB3 1 50 ILE MG 3.650 . 5.778 5.458 4.991 5.749 . 0 0 "[ . 1 . 2]" 1
871 1 49 ILE H 1 49 ILE MD 2.805 . 3.961 3.832 3.465 3.978 0.017 15 0 "[ . 1 . 2]" 1
872 1 49 ILE H 1 49 ILE MG 2.715 . 3.767 2.841 2.539 3.599 . 0 0 "[ . 1 . 2]" 1
873 1 49 ILE H 1 50 ILE HA 3.650 . 5.778 5.009 4.411 5.216 . 0 0 "[ . 1 . 2]" 1
874 1 49 ILE H 1 57 TRP HE3 3.425 . 5.294 4.896 4.149 5.401 0.108 16 0 "[ . 1 . 2]" 1
875 1 49 ILE H 1 57 TRP HZ3 3.545 . 5.552 4.705 3.740 5.087 . 0 0 "[ . 1 . 2]" 1
876 1 49 ILE HA 1 49 ILE MD 3.110 . 4.616 4.174 4.004 4.231 . 0 0 "[ . 1 . 2]" 1
877 1 49 ILE HA 1 49 ILE MG 2.655 . 3.638 2.337 2.047 2.435 . 0 0 "[ . 1 . 2]" 1
878 1 49 ILE HA 1 50 ILE H 2.570 . 3.455 2.194 2.044 3.209 . 0 0 "[ . 1 . 2]" 1
879 1 49 ILE HA 1 50 ILE HB 3.495 . 5.444 4.744 4.523 5.018 . 0 0 "[ . 1 . 2]" 1
880 1 49 ILE HA 1 50 ILE MD 3.310 . 5.047 2.736 2.156 3.417 . 0 0 "[ . 1 . 2]" 1
881 1 49 ILE HA 1 50 ILE HG12 3.495 . 5.444 5.139 4.852 5.501 0.057 12 0 "[ . 1 . 2]" 1
882 1 49 ILE HA 1 52 LEU QD 3.555 . 5.573 5.158 4.666 5.633 0.060 19 0 "[ . 1 . 2]" 1
883 1 49 ILE HA 1 58 THR H 3.160 . 4.724 3.819 3.493 4.149 . 0 0 "[ . 1 . 2]" 1
884 1 49 ILE HA 1 58 THR MG 3.245 . 4.907 2.582 1.966 3.297 . 0 0 "[ . 1 . 2]" 1
885 1 49 ILE HA 1 60 ALA H 3.650 . 5.778 5.625 4.729 6.266 0.489 2 0 "[ . 1 . 2]" 1
886 1 49 ILE HB 1 49 ILE MD 2.695 . 3.724 2.376 2.292 2.441 . 0 0 "[ . 1 . 2]" 1
887 1 49 ILE HB 1 50 ILE H 2.735 . 3.810 2.971 2.586 3.291 . 0 0 "[ . 1 . 2]" 1
888 1 49 ILE HB 1 50 ILE HG13 3.470 . 5.391 5.186 4.617 5.422 0.032 16 0 "[ . 1 . 2]" 1
889 1 49 ILE HB 1 57 TRP HD1 3.650 . 5.778 5.652 5.220 5.925 0.148 13 0 "[ . 1 . 2]" 1
890 1 49 ILE HB 1 57 TRP HE3 3.295 . 5.014 2.452 1.827 2.735 . 0 0 "[ . 1 . 2]" 1
891 1 49 ILE HB 1 58 THR H 3.225 . 4.864 3.165 2.832 3.542 . 0 0 "[ . 1 . 2]" 1
892 1 49 ILE HB 1 58 THR MG 2.625 . 3.574 3.319 2.290 4.070 0.496 12 0 "[ . 1 . 2]" 1
893 1 49 ILE HB 1 60 ALA H 3.495 . 5.444 4.696 4.168 5.380 . 0 0 "[ . 1 . 2]" 1
894 1 49 ILE MD 1 49 ILE MG 2.440 . 3.176 1.920 1.793 2.113 0.007 20 0 "[ . 1 . 2]" 1
895 1 49 ILE MD 1 50 ILE H 3.480 . 5.412 4.719 4.432 4.904 . 0 0 "[ . 1 . 2]" 1
896 1 49 ILE MD 1 50 ILE MD 3.650 . 5.778 5.714 5.348 6.110 0.332 10 0 "[ . 1 . 2]" 1
897 1 49 ILE MD 1 57 TRP HB3 2.715 . 3.767 3.111 2.601 3.861 0.094 12 0 "[ . 1 . 2]" 1
898 1 49 ILE MD 1 57 TRP HD1 3.430 . 5.305 4.193 3.730 4.846 . 0 0 "[ . 1 . 2]" 1
899 1 49 ILE MD 1 57 TRP HE3 2.775 . 3.896 3.168 2.873 3.486 . 0 0 "[ . 1 . 2]" 1
900 1 49 ILE MD 1 57 TRP HZ3 2.860 . 4.079 3.846 3.529 4.101 0.022 3 0 "[ . 1 . 2]" 1
901 1 49 ILE MD 1 58 THR H 3.575 . 5.616 4.636 4.189 5.143 . 0 0 "[ . 1 . 2]" 1
902 1 49 ILE MD 1 59 GLY H 3.650 . 5.778 4.745 4.231 5.181 . 0 0 "[ . 1 . 2]" 1
903 1 49 ILE MD 1 60 ALA H 3.650 . 5.778 4.705 3.665 5.898 0.120 20 0 "[ . 1 . 2]" 1
904 1 49 ILE MD 1 60 ALA MB 2.625 . 3.574 2.630 1.944 3.738 0.165 20 0 "[ . 1 . 2]" 1
905 1 49 ILE MG 1 50 ILE H 2.820 . 3.993 3.800 3.535 4.158 0.165 12 0 "[ . 1 . 2]" 1
906 1 49 ILE MG 1 57 TRP HB3 2.775 . 3.896 3.456 2.153 3.910 0.014 9 0 "[ . 1 . 2]" 1
907 1 49 ILE MG 1 57 TRP HD1 3.650 . 5.778 5.830 4.696 6.194 0.416 10 0 "[ . 1 . 2]" 1
908 1 49 ILE MG 1 57 TRP HE3 2.950 . 4.273 4.061 3.169 4.313 0.040 16 0 "[ . 1 . 2]" 1
909 1 49 ILE MG 1 58 THR HA 3.650 . 5.778 5.571 4.766 5.903 0.126 1 0 "[ . 1 . 2]" 1
910 1 49 ILE MG 1 59 GLY H 3.125 . 4.649 3.298 2.198 4.200 . 0 0 "[ . 1 . 2]" 1
911 1 49 ILE MG 1 59 GLY QA 3.180 . 4.767 4.319 3.479 5.038 0.271 17 0 "[ . 1 . 2]" 1
912 1 49 ILE MG 1 60 ALA H 2.810 . 3.971 3.285 2.538 3.834 . 0 0 "[ . 1 . 2]" 1
913 1 49 ILE MG 1 60 ALA HA 2.705 . 3.746 2.661 2.250 3.860 0.114 20 0 "[ . 1 . 2]" 1
914 1 49 ILE MG 1 60 ALA MB 2.255 . 2.778 1.985 1.713 2.729 0.087 20 0 "[ . 1 . 2]" 1
915 1 49 ILE MG 1 61 LYS H 3.310 . 5.047 4.841 4.418 5.175 0.129 4 0 "[ . 1 . 2]" 1
916 1 49 ILE MG 1 63 ARG QD 3.265 . 4.950 3.752 2.764 5.265 0.315 20 0 "[ . 1 . 2]" 1
917 1 50 ILE H 1 50 ILE HB 2.860 . 4.079 2.920 2.731 3.566 . 0 0 "[ . 1 . 2]" 1
918 1 50 ILE H 1 50 ILE MD 2.880 . 4.122 2.242 1.848 3.143 . 0 0 "[ . 1 . 2]" 1
919 1 50 ILE H 1 50 ILE HG12 3.025 . 4.434 4.114 3.261 4.391 . 0 0 "[ . 1 . 2]" 1
920 1 50 ILE H 1 50 ILE HG13 3.140 . 4.681 2.946 1.667 3.303 0.133 12 0 "[ . 1 . 2]" 1
921 1 50 ILE H 1 50 ILE MG 2.925 . 4.219 3.887 3.549 3.993 . 0 0 "[ . 1 . 2]" 1
922 1 50 ILE H 1 51 CYS H 3.275 . 4.971 4.378 4.238 4.504 . 0 0 "[ . 1 . 2]" 1
923 1 50 ILE H 1 52 LEU QD 3.495 . 5.444 3.956 3.377 4.955 . 0 0 "[ . 1 . 2]" 1
924 1 50 ILE H 1 57 TRP HE3 3.180 . 4.767 2.923 2.376 3.274 . 0 0 "[ . 1 . 2]" 1
925 1 50 ILE H 1 58 THR H 2.775 . 3.896 2.775 2.065 4.549 0.652 12 1 "[ . 1 + . 2]" 1
926 1 50 ILE H 1 58 THR MG 2.525 . 3.359 1.880 1.584 3.440 0.216 17 0 "[ . 1 . 2]" 1
927 1 50 ILE H 1 60 ALA MB 3.650 . 5.778 5.772 4.880 6.176 0.398 19 0 "[ . 1 . 2]" 1
928 1 50 ILE HA 1 50 ILE MD 2.740 . 3.821 3.652 3.550 3.902 0.081 12 0 "[ . 1 . 2]" 1
929 1 50 ILE HA 1 50 ILE HG12 2.930 . 4.229 3.547 3.160 3.687 . 0 0 "[ . 1 . 2]" 1
930 1 50 ILE HA 1 50 ILE HG13 2.905 . 4.176 2.612 2.530 2.803 . 0 0 "[ . 1 . 2]" 1
931 1 50 ILE HA 1 50 ILE MG 2.445 . 3.187 2.234 2.130 2.316 . 0 0 "[ . 1 . 2]" 1
932 1 50 ILE HA 1 51 CYS H 2.465 . 3.230 2.280 2.143 2.486 . 0 0 "[ . 1 . 2]" 1
933 1 50 ILE HA 1 51 CYS QB 3.570 . 5.606 4.535 3.914 5.153 . 0 0 "[ . 1 . 2]" 1
934 1 50 ILE HA 1 52 LEU QD 3.450 . 5.347 4.308 4.040 4.491 . 0 0 "[ . 1 . 2]" 1
935 1 50 ILE HA 1 52 LEU HG 3.400 . 5.240 4.305 4.058 4.458 . 0 0 "[ . 1 . 2]" 1
936 1 50 ILE HA 1 57 TRP HE3 3.500 . 5.455 3.052 2.718 3.477 . 0 0 "[ . 1 . 2]" 1
937 1 50 ILE HB 1 50 ILE MD 2.265 . 2.800 2.228 2.170 2.267 . 0 0 "[ . 1 . 2]" 1
938 1 50 ILE HB 1 51 CYS H 2.845 . 4.047 3.996 3.794 4.095 0.048 10 0 "[ . 1 . 2]" 1
939 1 50 ILE HB 1 51 CYS HA 3.405 . 5.251 5.128 4.849 5.307 0.057 10 0 "[ . 1 . 2]" 1
940 1 50 ILE HB 1 52 LEU H 3.185 . 4.778 3.731 3.163 4.662 . 0 0 "[ . 1 . 2]" 1
941 1 50 ILE HB 1 52 LEU MD1 2.175 . 2.606 2.508 2.088 2.712 0.106 8 0 "[ . 1 . 2]" 1
942 1 50 ILE HB 1 52 LEU MD2 2.175 . 2.606 2.726 2.437 2.981 0.375 18 0 "[ . 1 . 2]" 1
943 1 50 ILE HB 1 52 LEU HG 2.765 . 3.875 1.876 1.739 2.062 0.061 18 0 "[ . 1 . 2]" 1
944 1 50 ILE HB 1 58 THR H 3.650 . 5.778 4.463 4.093 5.251 . 0 0 "[ . 1 . 2]" 1
945 1 50 ILE HB 1 58 THR HA 3.605 . 5.681 5.183 4.882 5.636 . 0 0 "[ . 1 . 2]" 1
946 1 50 ILE HB 1 58 THR HB 3.095 . 4.584 4.344 2.630 5.126 0.542 13 1 "[ . 1 + . 2]" 1
947 1 50 ILE MD 1 51 CYS H 3.400 . 5.240 5.145 4.992 5.340 0.100 10 0 "[ . 1 . 2]" 1
948 1 50 ILE MD 1 52 LEU HG 3.630 . 5.734 3.394 3.141 3.607 . 0 0 "[ . 1 . 2]" 1
949 1 50 ILE MD 1 57 TRP HA 3.625 . 5.724 5.627 5.347 5.893 0.169 10 0 "[ . 1 . 2]" 1
950 1 50 ILE MD 1 57 TRP HB3 3.650 . 5.778 5.683 5.446 5.904 0.126 12 0 "[ . 1 . 2]" 1
951 1 50 ILE MD 1 58 THR H 3.280 . 4.982 4.207 3.836 4.623 . 0 0 "[ . 1 . 2]" 1
952 1 50 ILE MD 1 58 THR HA 3.215 . 4.842 4.841 4.521 4.978 0.136 20 0 "[ . 1 . 2]" 1
953 1 50 ILE MD 1 58 THR HB 2.640 . 3.606 3.341 2.318 3.867 0.261 13 0 "[ . 1 . 2]" 1
954 1 50 ILE MD 1 58 THR MG 2.190 . 2.638 1.948 1.754 2.669 0.046 10 0 "[ . 1 . 2]" 1
955 1 50 ILE HG12 1 50 ILE MG 2.265 . 2.800 2.116 1.998 2.172 . 0 0 "[ . 1 . 2]" 1
956 1 50 ILE HG12 1 51 CYS H 3.650 . 5.778 5.320 5.113 5.504 . 0 0 "[ . 1 . 2]" 1
957 1 50 ILE HG13 1 50 ILE MG 2.335 . 2.950 2.672 2.568 2.933 . 0 0 "[ . 1 . 2]" 1
958 1 50 ILE HG13 1 51 CYS H 3.370 . 5.175 4.785 4.657 4.942 . 0 0 "[ . 1 . 2]" 1
959 1 50 ILE HG13 1 58 THR MG 2.985 . 4.348 3.729 2.948 4.417 0.069 11 0 "[ . 1 . 2]" 1
960 1 50 ILE MG 1 51 CYS H 2.520 . 3.348 2.597 2.222 2.899 . 0 0 "[ . 1 . 2]" 1
961 1 50 ILE MG 1 51 CYS HA 3.210 . 4.832 4.466 4.216 4.675 . 0 0 "[ . 1 . 2]" 1
962 1 50 ILE MG 1 52 LEU H 3.345 . 5.122 3.909 3.326 4.690 . 0 0 "[ . 1 . 2]" 1
963 1 50 ILE MG 1 52 LEU QD 2.100 . 2.445 2.199 1.924 2.441 . 0 0 "[ . 1 . 2]" 1
964 1 50 ILE MG 1 52 LEU HG 3.140 . 4.681 2.836 2.428 3.053 . 0 0 "[ . 1 . 2]" 1
965 1 50 ILE MG 1 57 TRP HE3 3.650 . 5.778 4.578 4.364 4.861 . 0 0 "[ . 1 . 2]" 1
966 1 51 CYS H 1 51 CYS QB 2.625 . 3.574 2.487 2.031 2.993 . 0 0 "[ . 1 . 2]" 1
967 1 51 CYS H 1 52 LEU H 3.210 . 4.832 3.787 3.246 4.294 . 0 0 "[ . 1 . 2]" 1
968 1 51 CYS H 1 52 LEU QD 3.620 . 5.713 4.285 4.075 4.504 . 0 0 "[ . 1 . 2]" 1
969 1 51 CYS H 1 57 TRP HB3 3.650 . 5.778 5.614 4.764 5.954 0.176 2 0 "[ . 1 . 2]" 1
970 1 51 CYS H 1 57 TRP HE3 3.075 . 4.541 3.352 2.942 4.039 . 0 0 "[ . 1 . 2]" 1
971 1 51 CYS H 1 57 TRP HZ3 2.840 . 4.036 3.036 2.488 4.077 0.041 14 0 "[ . 1 . 2]" 1
972 1 51 CYS HA 1 52 LEU H 2.495 . 3.294 2.534 2.168 2.908 . 0 0 "[ . 1 . 2]" 1
973 1 51 CYS HA 1 52 LEU MD1 3.650 . 5.778 5.690 5.213 6.001 0.224 15 0 "[ . 1 . 2]" 1
974 1 51 CYS HA 1 52 LEU MD2 3.650 . 5.778 5.003 4.604 5.492 . 0 0 "[ . 1 . 2]" 1
975 1 51 CYS HA 1 52 LEU HG 3.145 . 4.692 4.591 4.109 4.914 0.223 2 0 "[ . 1 . 2]" 1
976 1 51 CYS HA 1 56 VAL H 3.280 . 4.982 4.162 3.661 4.826 . 0 0 "[ . 1 . 2]" 1
977 1 51 CYS HA 1 56 VAL HB 3.650 . 5.778 5.249 4.772 5.957 0.179 10 0 "[ . 1 . 2]" 1
978 1 51 CYS HA 1 56 VAL QG 3.620 . 5.713 4.595 4.197 5.419 . 0 0 "[ . 1 . 2]" 1
979 1 51 CYS HA 1 57 TRP H 3.390 . 5.219 3.735 2.691 4.230 . 0 0 "[ . 1 . 2]" 1
980 1 51 CYS HA 1 57 TRP HA 2.805 . 3.961 2.029 1.758 2.353 0.042 17 0 "[ . 1 . 2]" 1
981 1 51 CYS HA 1 58 THR H 2.965 . 4.305 4.092 3.666 4.440 0.135 8 0 "[ . 1 . 2]" 1
982 1 51 CYS HA 1 58 THR MG 3.650 . 5.778 4.704 3.877 5.825 0.047 6 0 "[ . 1 . 2]" 1
983 1 51 CYS QB 1 57 TRP HA 3.295 . 5.014 4.106 3.787 4.362 . 0 0 "[ . 1 . 2]" 1
984 1 51 CYS HB2 1 52 LEU H 3.185 . 4.778 4.361 4.063 4.715 . 0 0 "[ . 1 . 2]" 1
985 1 51 CYS HB2 1 57 TRP HA 3.650 . 5.778 4.829 4.419 5.249 . 0 0 "[ . 1 . 2]" 1
986 1 51 CYS HB3 1 52 LEU H 3.185 . 4.778 4.298 3.944 4.531 . 0 0 "[ . 1 . 2]" 1
987 1 51 CYS HB3 1 57 TRP HA 3.650 . 5.778 4.511 4.030 5.107 . 0 0 "[ . 1 . 2]" 1
988 1 52 LEU H 1 52 LEU QD 2.635 . 3.595 3.199 2.858 3.540 . 0 0 "[ . 1 . 2]" 1
989 1 52 LEU H 1 52 LEU HG 2.685 . 3.703 2.522 2.106 3.097 . 0 0 "[ . 1 . 2]" 1
990 1 52 LEU H 1 53 LYS H 2.905 . 4.176 2.530 2.078 2.785 . 0 0 "[ . 1 . 2]" 1
991 1 52 LEU H 1 55 SER H 3.445 . 5.337 5.344 4.689 5.663 0.326 13 0 "[ . 1 . 2]" 1
992 1 52 LEU H 1 55 SER HA 3.310 . 5.047 4.916 3.619 5.336 0.289 15 0 "[ . 1 . 2]" 1
993 1 52 LEU H 1 56 VAL H 3.060 . 4.509 4.723 4.056 5.127 0.618 16 4 "[ * . * .+ -2]" 1
994 1 52 LEU H 1 57 TRP H 3.310 . 5.047 4.359 3.307 5.321 0.274 14 0 "[ . 1 . 2]" 1
995 1 52 LEU H 1 57 TRP HA 2.760 . 3.864 2.821 2.173 3.172 . 0 0 "[ . 1 . 2]" 1
996 1 52 LEU H 1 58 THR H 2.865 . 4.090 3.568 3.297 4.236 0.146 8 0 "[ . 1 . 2]" 1
997 1 52 LEU H 1 58 THR HB 3.555 . 5.573 4.952 3.638 5.668 0.095 8 0 "[ . 1 . 2]" 1
998 1 52 LEU HA 1 52 LEU QD 2.760 . 3.864 2.024 1.864 2.156 . 0 0 "[ . 1 . 2]" 1
999 1 52 LEU QB 1 53 LYS H 2.560 . 3.434 2.405 1.923 2.737 . 0 0 "[ . 1 . 2]" 1
1000 1 52 LEU QD 1 53 LYS H 2.855 . 4.068 3.983 3.679 4.161 0.093 1 0 "[ . 1 . 2]" 1
1001 1 52 LEU QD 1 57 TRP HA 3.430 . 5.305 4.939 4.518 5.192 . 0 0 "[ . 1 . 2]" 1
1002 1 52 LEU QD 1 57 TRP HE3 3.620 . 5.713 5.380 4.942 5.765 0.052 14 0 "[ . 1 . 2]" 1
1003 1 52 LEU QD 1 58 THR HA 2.500 . 3.305 3.327 2.872 3.588 0.283 14 0 "[ . 1 . 2]" 1
1004 1 52 LEU QD 1 58 THR HB 2.405 . 3.101 2.881 1.958 3.316 0.215 10 0 "[ . 1 . 2]" 1
1005 1 52 LEU HG 1 53 LYS H 2.900 . 4.165 4.257 4.073 4.430 0.265 2 0 "[ . 1 . 2]" 1
1006 1 52 LEU HG 1 57 TRP HA 3.615 . 5.702 4.787 4.207 5.105 . 0 0 "[ . 1 . 2]" 1
1007 1 52 LEU HG 1 58 THR H 3.520 . 5.498 4.391 3.969 4.895 . 0 0 "[ . 1 . 2]" 1
1008 1 52 LEU HG 1 58 THR HB 3.095 . 4.584 4.263 2.922 4.824 0.240 10 0 "[ . 1 . 2]" 1
1009 1 53 LYS H 1 53 LYS QB 2.680 . 3.692 2.320 2.049 2.551 . 0 0 "[ . 1 . 2]" 1
1010 1 53 LYS H 1 54 ASN H 3.270 . 4.960 4.279 3.467 4.467 . 0 0 "[ . 1 . 2]" 1
1011 1 53 LYS H 1 55 SER H 3.075 . 4.541 4.260 3.990 4.662 0.121 9 0 "[ . 1 . 2]" 1
1012 1 53 LYS H 1 56 VAL H 3.185 . 4.778 3.713 3.022 4.195 . 0 0 "[ . 1 . 2]" 1
1013 1 53 LYS H 1 57 TRP H 3.285 . 4.993 3.700 2.949 5.135 0.142 1 0 "[ . 1 . 2]" 1
1014 1 53 LYS H 1 58 THR HA 3.040 . 4.466 3.558 2.545 4.498 0.032 1 0 "[ . 1 . 2]" 1
1015 1 53 LYS HA 1 53 LYS QB 2.175 . 2.606 2.343 2.135 2.485 . 0 0 "[ . 1 . 2]" 1
1016 1 53 LYS HA 1 53 LYS QE 2.425 . 2.692 2.913 1.766 3.445 0.753 3 7 "[ +*. * 1*- . **]" 1
1017 1 53 LYS HA 1 53 LYS QG 2.380 . 3.047 2.591 2.118 3.112 0.065 6 0 "[ . 1 . 2]" 1
1018 1 53 LYS HA 1 54 ASN H 2.455 . 3.208 2.127 1.959 3.370 0.162 20 0 "[ . 1 . 2]" 1
1019 1 53 LYS QB 1 53 LYS QE 2.565 . 3.445 2.685 1.741 3.661 0.216 4 0 "[ . 1 . 2]" 1
1020 1 53 LYS QB 1 56 VAL H 3.385 . 5.208 4.059 3.662 4.343 . 0 0 "[ . 1 . 2]" 1
1021 1 53 LYS QB 1 58 THR HA 2.925 . 4.219 3.484 2.428 4.549 0.330 10 0 "[ . 1 . 2]" 1
1022 1 53 LYS QD 1 53 LYS QE 2.040 . 2.316 2.015 1.836 2.101 . 0 0 "[ . 1 . 2]" 1
1023 1 53 LYS QE 1 53 LYS QG 2.160 . 2.574 2.148 1.905 2.383 . 0 0 "[ . 1 . 2]" 1
1024 1 53 LYS QE 1 54 ASN H 2.755 . 3.853 3.719 1.994 4.406 0.553 1 2 "[+ . 1 . -]" 1
1025 1 53 LYS QG 1 54 ASN H 2.665 . 3.660 3.108 2.067 4.058 0.398 1 0 "[ . 1 . 2]" 1
1026 1 53 LYS QG 1 54 ASN QB 3.075 . 4.541 3.165 2.521 5.076 0.534 1 1 "[+ . 1 . 2]" 1
1027 1 53 LYS QG 1 55 SER H 3.320 . 5.068 4.979 4.402 5.441 0.373 1 0 "[ . 1 . 2]" 1
1028 1 53 LYS QG 1 56 VAL H 3.345 . 5.122 4.697 4.047 5.458 0.336 8 0 "[ . 1 . 2]" 1
1029 1 53 LYS QG 1 56 VAL QG 3.325 . 5.079 4.268 3.174 5.043 . 0 0 "[ . 1 . 2]" 1
1030 1 54 ASN H 1 54 ASN HB2 2.985 . 4.348 3.320 2.428 3.625 . 0 0 "[ . 1 . 2]" 1
1031 1 54 ASN H 1 54 ASN QB 2.655 . 3.638 3.156 2.394 3.368 . 0 0 "[ . 1 . 2]" 1
1032 1 54 ASN H 1 54 ASN HB3 2.985 . 4.348 3.964 3.634 4.109 . 0 0 "[ . 1 . 2]" 1
1033 1 54 ASN H 1 56 VAL H 3.225 . 4.864 4.039 2.623 4.227 . 0 0 "[ . 1 . 2]" 1
1034 1 54 ASN H 1 56 VAL QG 3.475 . 5.401 4.655 3.005 5.025 . 0 0 "[ . 1 . 2]" 1
1035 1 54 ASN HA 1 55 SER H 2.550 . 3.412 2.845 2.778 2.906 . 0 0 "[ . 1 . 2]" 1
1036 1 54 ASN HA 1 56 VAL H 3.245 . 4.907 4.265 4.097 4.489 . 0 0 "[ . 1 . 2]" 1
1037 1 54 ASN QB 1 55 SER H 2.865 . 4.090 3.831 3.764 3.905 . 0 0 "[ . 1 . 2]" 1
1038 1 54 ASN QB 1 55 SER QB 3.190 . 4.788 4.608 4.225 5.276 0.488 11 0 "[ . 1 . 2]" 1
1039 1 54 ASN QB 1 56 VAL H 3.200 . 4.810 3.284 3.013 3.691 . 0 0 "[ . 1 . 2]" 1
1040 1 54 ASN QB 1 56 VAL HB 2.935 . 4.240 3.288 2.883 3.700 . 0 0 "[ . 1 . 2]" 1
1041 1 54 ASN QB 1 56 VAL QG 2.215 . 2.692 2.245 1.806 2.810 0.117 14 0 "[ . 1 . 2]" 1
1042 1 54 ASN HB2 1 55 SER H 3.170 . 4.746 4.264 4.120 4.615 . 0 0 "[ . 1 . 2]" 1
1043 1 54 ASN HB2 1 56 VAL H 3.615 . 5.702 3.669 3.137 4.862 . 0 0 "[ . 1 . 2]" 1
1044 1 54 ASN HB3 1 55 SER H 3.170 . 4.746 4.369 4.094 4.475 . 0 0 "[ . 1 . 2]" 1
1045 1 54 ASN HB3 1 56 VAL H 3.615 . 5.702 4.063 3.095 4.683 . 0 0 "[ . 1 . 2]" 1
1046 1 55 SER H 1 55 SER HA 2.275 . 2.821 2.256 2.219 2.294 . 0 0 "[ . 1 . 2]" 1
1047 1 55 SER H 1 55 SER QB 2.715 . 3.767 3.305 2.882 3.452 . 0 0 "[ . 1 . 2]" 1
1048 1 55 SER H 1 56 VAL H 2.410 . 3.112 2.757 2.568 2.897 . 0 0 "[ . 1 . 2]" 1
1049 1 55 SER H 1 56 VAL QG 3.570 . 5.606 4.174 4.087 4.307 . 0 0 "[ . 1 . 2]" 1
1050 1 55 SER HA 1 56 VAL H 2.485 . 3.273 3.015 2.820 3.157 . 0 0 "[ . 1 . 2]" 1
1051 1 55 SER HA 1 56 VAL QG 3.275 . 4.971 4.472 4.337 4.681 . 0 0 "[ . 1 . 2]" 1
1052 1 55 SER QB 1 56 VAL H 3.000 . 4.380 3.835 3.655 4.110 . 0 0 "[ . 1 . 2]" 1
1053 1 56 VAL H 1 56 VAL HB 2.635 . 3.595 2.590 2.454 2.763 . 0 0 "[ . 1 . 2]" 1
1054 1 56 VAL H 1 56 VAL QG 2.350 . 2.983 2.506 2.117 2.871 . 0 0 "[ . 1 . 2]" 1
1055 1 56 VAL H 1 57 TRP H 2.750 . 3.842 3.039 1.989 4.267 0.425 1 0 "[ . 1 . 2]" 1
1056 1 56 VAL H 1 57 TRP HA 3.500 . 5.455 4.589 4.190 4.833 . 0 0 "[ . 1 . 2]" 1
1057 1 56 VAL HA 1 56 VAL MG1 2.330 . 2.940 2.436 2.339 2.587 . 0 0 "[ . 1 . 2]" 1
1058 1 56 VAL HA 1 56 VAL QG 2.060 . 2.359 2.156 2.120 2.212 . 0 0 "[ . 1 . 2]" 1
1059 1 56 VAL HA 1 56 VAL MG2 2.330 . 2.940 2.409 2.345 2.485 . 0 0 "[ . 1 . 2]" 1
1060 1 56 VAL HA 1 57 TRP HB2 3.515 . 5.487 5.085 4.231 5.376 . 0 0 "[ . 1 . 2]" 1
1061 1 56 VAL HA 1 57 TRP HD1 3.185 . 4.778 4.051 2.791 4.603 . 0 0 "[ . 1 . 2]" 1
1062 1 56 VAL HB 1 57 TRP H 2.735 . 3.810 2.165 1.733 3.634 0.067 18 0 "[ . 1 . 2]" 1
1063 1 56 VAL QG 1 57 TRP H 2.685 . 3.703 2.456 1.861 3.502 . 0 0 "[ . 1 . 2]" 1
1064 1 56 VAL QG 1 57 TRP HA 3.620 . 5.713 4.036 3.835 4.746 . 0 0 "[ . 1 . 2]" 1
1065 1 56 VAL QG 1 57 TRP HD1 2.895 . 4.154 2.509 1.910 3.972 . 0 0 "[ . 1 . 2]" 1
1066 1 57 TRP H 1 57 TRP HB2 2.465 . 3.230 3.059 2.493 3.630 0.400 19 0 "[ . 1 . 2]" 1
1067 1 57 TRP H 1 57 TRP HD1 3.050 . 4.488 3.874 2.033 4.867 0.379 16 0 "[ . 1 . 2]" 1
1068 1 57 TRP H 1 57 TRP HE3 3.640 . 5.756 5.396 5.009 5.657 . 0 0 "[ . 1 . 2]" 1
1069 1 57 TRP H 1 58 THR H 3.100 . 4.595 4.383 4.150 4.605 0.010 1 0 "[ . 1 . 2]" 1
1070 1 57 TRP HA 1 57 TRP HE3 3.650 . 5.778 2.830 2.539 3.759 . 0 0 "[ . 1 . 2]" 1
1071 1 57 TRP HA 1 58 THR H 2.445 . 3.187 2.431 2.236 2.782 . 0 0 "[ . 1 . 2]" 1
1072 1 57 TRP HA 1 58 THR MG 3.025 . 4.434 3.710 3.119 4.548 0.114 19 0 "[ . 1 . 2]" 1
1073 1 57 TRP HB3 1 57 TRP HD1 2.845 . 4.047 3.733 3.614 3.871 . 0 0 "[ . 1 . 2]" 1
1074 1 57 TRP HB3 1 58 THR MG 2.655 . 3.638 3.633 2.902 4.007 0.368 12 0 "[ . 1 . 2]" 1
1075 1 57 TRP HB3 1 59 GLY H 3.125 . 4.649 2.804 2.192 3.344 . 0 0 "[ . 1 . 2]" 1
1076 1 57 TRP HE3 1 58 THR H 3.035 . 4.455 3.115 2.703 3.645 . 0 0 "[ . 1 . 2]" 1
1077 1 57 TRP HE3 1 58 THR MG 2.950 . 4.273 3.608 3.194 4.105 . 0 0 "[ . 1 . 2]" 1
1078 1 58 THR H 1 58 THR HB 2.945 . 4.262 3.205 2.287 3.693 . 0 0 "[ . 1 . 2]" 1
1079 1 58 THR H 1 58 THR MG 2.435 . 3.165 2.016 1.756 2.646 0.044 1 0 "[ . 1 . 2]" 1
1080 1 58 THR H 1 59 GLY H 2.750 . 3.842 2.592 2.180 2.875 . 0 0 "[ . 1 . 2]" 1
1081 1 58 THR HA 1 58 THR MG 2.580 . 3.477 2.637 2.132 3.240 . 0 0 "[ . 1 . 2]" 1
1082 1 58 THR HB 1 59 GLY H 2.985 . 4.348 3.891 3.517 4.381 0.033 11 0 "[ . 1 . 2]" 1
1083 1 58 THR MG 1 59 GLY H 2.605 . 3.531 3.207 1.975 3.964 0.434 8 0 "[ . 1 . 2]" 1
1084 1 59 GLY H 1 60 ALA H 2.505 . 3.316 2.767 2.233 3.283 . 0 0 "[ . 1 . 2]" 1
1085 1 59 GLY H 1 60 ALA MB 2.960 . 4.294 3.778 3.415 4.120 . 0 0 "[ . 1 . 2]" 1
1086 1 59 GLY QA 1 60 ALA H 2.375 . 3.036 2.458 2.067 2.872 . 0 0 "[ . 1 . 2]" 1
1087 1 59 GLY QA 1 60 ALA HA 3.295 . 5.014 4.223 3.956 4.575 . 0 0 "[ . 1 . 2]" 1
1088 1 59 GLY QA 1 61 LYS H 2.710 . 3.757 3.256 2.694 3.804 0.047 5 0 "[ . 1 . 2]" 1
1089 1 60 ALA H 1 60 ALA MB 2.370 . 3.026 2.431 2.115 2.780 . 0 0 "[ . 1 . 2]" 1
1090 1 60 ALA H 1 61 LYS H 2.410 . 3.112 2.870 2.383 3.524 0.413 5 0 "[ . 1 . 2]" 1
1091 1 60 ALA H 1 63 ARG QG 3.570 . 5.606 4.732 4.100 5.391 . 0 0 "[ . 1 . 2]" 1
1092 1 60 ALA HA 1 61 LYS H 2.650 . 3.628 3.012 2.449 3.383 . 0 0 "[ . 1 . 2]" 1
1093 1 60 ALA HA 1 61 LYS HA 3.330 . 5.089 4.626 4.336 4.832 . 0 0 "[ . 1 . 2]" 1
1094 1 60 ALA HA 1 61 LYS QB 3.510 . 5.477 4.920 4.622 5.151 . 0 0 "[ . 1 . 2]" 1
1095 1 60 ALA HA 1 63 ARG H 3.650 . 5.778 5.115 4.652 5.498 . 0 0 "[ . 1 . 2]" 1
1096 1 60 ALA HA 1 63 ARG HD2 3.150 . 4.702 3.900 2.158 4.595 . 0 0 "[ . 1 . 2]" 1
1097 1 60 ALA HA 1 63 ARG QD 2.780 . 3.907 2.548 1.939 3.389 . 0 0 "[ . 1 . 2]" 1
1098 1 60 ALA HA 1 63 ARG HD3 3.150 . 4.702 2.655 1.948 3.825 . 0 0 "[ . 1 . 2]" 1
1099 1 60 ALA HA 1 63 ARG QG 3.040 . 4.466 2.657 2.167 3.474 . 0 0 "[ . 1 . 2]" 1
1100 1 60 ALA MB 1 61 LYS H 2.800 . 3.950 3.482 3.015 3.724 . 0 0 "[ . 1 . 2]" 1
1101 1 60 ALA MB 1 61 LYS HA 3.095 . 4.584 4.093 3.837 4.324 . 0 0 "[ . 1 . 2]" 1
1102 1 60 ALA MB 1 63 ARG QD 2.850 . 4.057 3.869 2.801 4.505 0.448 18 0 "[ . 1 . 2]" 1
1103 1 60 ALA MB 1 63 ARG QG 3.010 . 4.402 3.280 2.049 4.352 . 0 0 "[ . 1 . 2]" 1
1104 1 61 LYS H 1 61 LYS QB 2.360 . 3.004 2.434 2.157 2.968 . 0 0 "[ . 1 . 2]" 1
1105 1 61 LYS H 1 61 LYS QE 3.280 . 4.982 4.944 4.053 5.713 0.731 13 9 "[* .** -* +** *2]" 1
1106 1 61 LYS H 1 61 LYS QG 2.755 . 3.853 3.232 2.159 3.960 0.106 9 0 "[ . 1 . 2]" 1
1107 1 61 LYS H 1 63 ARG HD2 3.545 . 5.552 4.459 3.128 5.841 0.289 19 0 "[ . 1 . 2]" 1
1108 1 61 LYS H 1 63 ARG HD3 3.545 . 5.552 3.842 2.424 5.776 0.225 2 0 "[ . 1 . 2]" 1
1109 1 61 LYS H 1 63 ARG QG 3.140 . 4.681 3.496 2.624 4.125 . 0 0 "[ . 1 . 2]" 1
1110 1 61 LYS HA 1 61 LYS QE 3.315 . 5.057 4.565 4.072 5.365 0.308 18 0 "[ . 1 . 2]" 1
1111 1 61 LYS HA 1 61 LYS QG 2.610 . 3.542 2.750 2.182 3.344 . 0 0 "[ . 1 . 2]" 1
1112 1 61 LYS HA 1 62 ASP H 2.250 . 2.767 2.209 1.971 2.985 0.218 18 0 "[ . 1 . 2]" 1
1113 1 61 LYS HA 1 62 ASP HA 3.245 . 4.907 4.389 4.250 4.522 . 0 0 "[ . 1 . 2]" 1
1114 1 61 LYS HA 1 62 ASP QB 3.445 . 5.337 4.431 3.988 4.723 . 0 0 "[ . 1 . 2]" 1
1115 1 61 LYS HA 1 63 ARG H 2.885 . 4.133 3.663 3.002 4.394 0.261 7 0 "[ . 1 . 2]" 1
1116 1 61 LYS HA 1 63 ARG QD 3.100 . 4.595 4.793 4.262 5.170 0.575 9 3 "[ * . +1 . -2]" 1
1117 1 61 LYS QB 1 61 LYS QE 3.060 . 4.509 3.055 1.889 3.532 . 0 0 "[ . 1 . 2]" 1
1118 1 61 LYS QB 1 61 LYS QG 1.990 . 2.208 2.063 1.976 2.091 . 0 0 "[ . 1 . 2]" 1
1119 1 61 LYS QB 1 62 ASP H 2.520 . 3.348 3.167 1.757 3.738 0.390 9 0 "[ . 1 . 2]" 1
1120 1 61 LYS QD 1 61 LYS QG 2.080 . 2.402 2.056 2.007 2.091 . 0 0 "[ . 1 . 2]" 1
1121 1 61 LYS QE 1 61 LYS QG 2.065 . 2.370 2.027 1.921 2.230 . 0 0 "[ . 1 . 2]" 1
1122 1 61 LYS QE 1 62 ASP H 3.195 . 4.799 4.278 3.337 5.344 0.545 17 1 "[ . 1 . + 2]" 1
1123 1 61 LYS QE 1 62 ASP QB 2.415 . 3.122 3.201 2.733 3.529 0.406 20 0 "[ . 1 . 2]" 1
1124 1 61 LYS QE 1 63 ARG H 3.570 . 5.606 5.953 5.332 6.138 0.532 7 5 "[* - + * . *]" 1
1125 1 61 LYS QG 1 62 ASP H 2.555 . 3.423 2.740 1.901 3.515 0.092 17 0 "[ . 1 . 2]" 1
1126 1 61 LYS QG 1 62 ASP HA 2.990 . 4.359 3.968 3.471 4.596 0.237 8 0 "[ . 1 . 2]" 1
1127 1 61 LYS QG 1 62 ASP QB 2.550 . 3.412 2.587 2.175 3.403 . 0 0 "[ . 1 . 2]" 1
1128 1 62 ASP H 1 62 ASP HA 2.285 . 2.843 2.320 2.230 2.850 0.008 18 0 "[ . 1 . 2]" 1
1129 1 62 ASP H 1 62 ASP QB 2.595 . 3.509 3.041 2.199 3.306 . 0 0 "[ . 1 . 2]" 1
1130 1 62 ASP H 1 63 ARG H 2.555 . 3.423 2.776 2.532 3.626 0.202 18 0 "[ . 1 . 2]" 1
1131 1 62 ASP H 1 63 ARG QD 3.300 . 5.025 5.092 4.447 5.631 0.606 19 1 "[ . 1 . +2]" 1
1132 1 62 ASP H 1 63 ARG QG 3.280 . 4.982 4.059 3.720 4.657 . 0 0 "[ . 1 . 2]" 1
1133 1 62 ASP HA 1 63 ARG H 2.490 . 3.283 2.801 2.262 3.039 . 0 0 "[ . 1 . 2]" 1
1134 1 63 ARG H 1 63 ARG HB2 2.460 . 3.219 2.465 2.301 2.621 . 0 0 "[ . 1 . 2]" 1
1135 1 63 ARG H 1 63 ARG HB3 2.745 . 3.832 3.592 3.514 3.684 . 0 0 "[ . 1 . 2]" 1
1136 1 63 ARG H 1 63 ARG HD2 3.170 . 4.746 3.629 3.213 4.727 . 0 0 "[ . 1 . 2]" 1
1137 1 63 ARG H 1 63 ARG QD 2.850 . 4.057 3.415 3.115 4.119 0.062 19 0 "[ . 1 . 2]" 1
1138 1 63 ARG H 1 63 ARG HD3 3.170 . 4.746 4.328 3.568 4.727 . 0 0 "[ . 1 . 2]" 1
1139 1 63 ARG H 1 63 ARG HG2 2.775 . 3.896 2.383 2.031 3.651 . 0 0 "[ . 1 . 2]" 1
1140 1 63 ARG H 1 63 ARG QG 2.380 . 3.047 2.240 2.017 2.413 . 0 0 "[ . 1 . 2]" 1
1141 1 63 ARG H 1 63 ARG HG3 2.775 . 3.896 3.532 2.252 3.853 . 0 0 "[ . 1 . 2]" 1
1142 1 63 ARG H 1 64 CYS H 2.345 . 2.972 2.697 2.528 2.878 . 0 0 "[ . 1 . 2]" 1
1143 1 63 ARG H 1 64 CYS HA 3.650 . 5.778 5.324 5.196 5.479 . 0 0 "[ . 1 . 2]" 1
1144 1 63 ARG H 1 64 CYS HB2 3.650 . 5.778 5.084 4.790 5.459 . 0 0 "[ . 1 . 2]" 1
1145 1 63 ARG HA 1 63 ARG HD2 2.880 . 4.122 2.276 1.896 4.306 0.184 2 0 "[ . 1 . 2]" 1
1146 1 63 ARG HA 1 63 ARG QD 2.495 . 3.294 2.176 1.888 3.749 0.455 2 0 "[ . 1 . 2]" 1
1147 1 63 ARG HA 1 63 ARG HD3 2.880 . 4.122 3.587 1.960 4.317 0.195 19 0 "[ . 1 . 2]" 1
1148 1 63 ARG HA 1 63 ARG HG2 2.955 . 4.283 2.950 2.170 3.250 . 0 0 "[ . 1 . 2]" 1
1149 1 63 ARG HA 1 63 ARG HG3 2.955 . 4.283 3.610 2.573 3.806 . 0 0 "[ . 1 . 2]" 1
1150 1 63 ARG HB2 1 64 CYS H 2.570 . 3.455 2.689 2.442 3.131 . 0 0 "[ . 1 . 2]" 1
1151 1 63 ARG HB3 1 63 ARG QD 2.730 . 3.799 2.853 2.301 3.064 . 0 0 "[ . 1 . 2]" 1
1152 1 63 ARG HB3 1 64 CYS H 2.980 . 4.337 3.634 3.407 3.821 . 0 0 "[ . 1 . 2]" 1
1153 1 63 ARG QG 1 64 CYS H 2.915 . 4.197 4.091 3.858 4.338 0.141 2 0 "[ . 1 . 2]" 1
1154 1 64 CYS H 1 64 CYS HB2 2.775 . 3.896 2.595 2.430 2.890 . 0 0 "[ . 1 . 2]" 1
1155 1 64 CYS H 1 64 CYS HB3 2.880 . 4.122 3.709 3.616 3.876 . 0 0 "[ . 1 . 2]" 1
1156 1 64 CYS H 1 65 ARG H 3.220 . 4.853 4.445 4.325 4.549 . 0 0 "[ . 1 . 2]" 1
1157 1 64 CYS H 1 65 ARG QG 3.185 . 4.778 3.887 3.616 4.159 . 0 0 "[ . 1 . 2]" 1
1158 1 64 CYS HA 1 65 ARG H 2.280 . 2.832 2.296 2.166 2.508 . 0 0 "[ . 1 . 2]" 1
1159 1 64 CYS HA 1 65 ARG HB2 3.340 . 5.111 4.240 3.776 4.487 . 0 0 "[ . 1 . 2]" 1
1160 1 64 CYS HA 1 65 ARG HD2 3.440 . 5.326 5.239 4.582 5.572 0.246 16 0 "[ . 1 . 2]" 1
1161 1 64 CYS HA 1 65 ARG QD 3.015 . 4.412 4.629 4.355 4.819 0.407 3 0 "[ . 1 . 2]" 1
1162 1 64 CYS HA 1 65 ARG HD3 3.440 . 5.326 5.254 4.829 5.879 0.553 4 1 "[ +. 1 . 2]" 1
1163 1 64 CYS HA 1 65 ARG QG 2.795 . 3.939 3.130 2.705 3.368 . 0 0 "[ . 1 . 2]" 1
1164 1 64 CYS HB2 1 65 ARG H 3.000 . 4.380 3.897 3.662 4.151 . 0 0 "[ . 1 . 2]" 1
1165 1 64 CYS HB2 1 65 ARG HA 3.480 . 5.412 4.723 4.241 5.415 0.003 15 0 "[ . 1 . 2]" 1
1166 1 64 CYS HB3 1 65 ARG H 2.790 . 3.928 2.895 2.582 3.100 . 0 0 "[ . 1 . 2]" 1
1167 1 64 CYS HB3 1 65 ARG QG 3.545 . 5.552 4.789 4.530 4.998 . 0 0 "[ . 1 . 2]" 1
1168 1 64 CYS HB3 1 66 ARG H 3.650 . 5.778 5.891 5.203 6.256 0.478 4 0 "[ . 1 . 2]" 1
1169 1 65 ARG H 1 65 ARG HB2 2.585 . 3.488 2.568 2.422 2.678 . 0 0 "[ . 1 . 2]" 1
1170 1 65 ARG H 1 65 ARG HB3 2.865 . 4.090 3.734 3.640 3.800 . 0 0 "[ . 1 . 2]" 1
1171 1 65 ARG H 1 65 ARG QG 2.570 . 3.455 2.852 2.602 2.986 . 0 0 "[ . 1 . 2]" 1
1172 1 65 ARG H 1 66 ARG H 3.075 . 4.541 4.331 4.068 4.477 . 0 0 "[ . 1 . 2]" 1
1173 1 65 ARG HA 1 65 ARG QD 3.190 . 4.788 4.110 3.916 4.200 . 0 0 "[ . 1 . 2]" 1
1174 1 65 ARG HA 1 65 ARG QG 2.265 . 2.800 2.366 2.260 2.451 . 0 0 "[ . 1 . 2]" 1
1175 1 65 ARG HB2 1 65 ARG QD 2.295 . 2.864 2.433 2.284 2.808 . 0 0 "[ . 1 . 2]" 1
1176 1 65 ARG HB3 1 65 ARG QD 2.515 . 3.337 2.821 2.406 3.005 . 0 0 "[ . 1 . 2]" 1
1177 1 65 ARG HB3 1 66 ARG H 2.825 . 4.004 3.149 2.839 3.595 . 0 0 "[ . 1 . 2]" 1
1178 1 65 ARG QG 1 66 ARG H 3.330 . 5.089 3.992 3.744 4.264 . 0 0 "[ . 1 . 2]" 1
1179 1 66 ARG H 1 66 ARG HB2 2.950 . 4.273 3.366 2.320 3.728 . 0 0 "[ . 1 . 2]" 1
1180 1 66 ARG H 1 66 ARG QB 2.670 . 3.671 2.534 1.890 2.925 . 0 0 "[ . 1 . 2]" 1
1181 1 66 ARG H 1 66 ARG HB3 2.950 . 4.273 2.632 1.994 3.136 . 0 0 "[ . 1 . 2]" 1
1182 1 66 ARG H 1 66 ARG HD2 3.385 . 5.208 4.437 2.529 5.517 0.309 1 0 "[ . 1 . 2]" 1
1183 1 66 ARG H 1 66 ARG QD 2.975 . 4.326 3.864 2.510 4.346 0.020 1 0 "[ . 1 . 2]" 1
1184 1 66 ARG H 1 66 ARG HD3 3.385 . 5.208 4.441 3.727 5.580 0.372 19 0 "[ . 1 . 2]" 1
1185 1 66 ARG H 1 66 ARG QG 2.855 . 4.068 2.402 1.679 3.791 0.121 8 0 "[ . 1 . 2]" 1
1186 1 66 ARG H 1 67 LYS H 3.215 . 4.842 4.519 4.328 4.638 . 0 0 "[ . 1 . 2]" 1
1187 1 66 ARG H 1 88 PHE HB3 3.650 . 5.778 5.739 5.147 6.128 0.350 1 0 "[ . 1 . 2]" 1
1188 1 66 ARG H 1 88 PHE QD 3.295 . 5.014 5.251 4.901 5.499 0.485 2 0 "[ . 1 . 2]" 1
1189 1 66 ARG HA 1 66 ARG QD 3.525 . 5.509 4.311 3.770 4.521 . 0 0 "[ . 1 . 2]" 1
1190 1 66 ARG HA 1 66 ARG QG 2.760 . 3.864 3.141 2.452 3.340 . 0 0 "[ . 1 . 2]" 1
1191 1 66 ARG HA 1 67 LYS H 2.535 . 3.380 2.332 2.181 2.607 . 0 0 "[ . 1 . 2]" 1
1192 1 66 ARG HA 1 88 PHE HB3 3.650 . 5.778 4.747 4.111 5.691 . 0 0 "[ . 1 . 2]" 1
1193 1 66 ARG HA 1 88 PHE QD 3.085 . 4.563 4.357 3.831 4.853 0.290 14 0 "[ . 1 . 2]" 1
1194 1 66 ARG HA 1 88 PHE QE 3.515 . 5.487 5.360 4.716 5.791 0.303 14 0 "[ . 1 . 2]" 1
1195 1 66 ARG HA 1 112 ILE MD 2.815 . 3.982 3.166 2.146 4.032 0.050 5 0 "[ . 1 . 2]" 1
1196 1 66 ARG HA 1 117 VAL MG1 3.390 . 5.219 4.131 3.555 4.466 . 0 0 "[ . 1 . 2]" 1
1197 1 66 ARG QB 1 67 LYS H 2.735 . 3.810 2.863 1.861 3.798 . 0 0 "[ . 1 . 2]" 1
1198 1 66 ARG QB 1 88 PHE QD 2.755 . 3.853 2.414 1.959 3.182 . 0 0 "[ . 1 . 2]" 1
1199 1 66 ARG QB 1 112 ILE MD 2.675 . 3.681 3.119 2.490 3.715 0.034 2 0 "[ . 1 . 2]" 1
1200 1 66 ARG HB2 1 88 PHE QD 3.115 . 4.627 2.607 2.145 3.275 . 0 0 "[ . 1 . 2]" 1
1201 1 66 ARG HB2 1 112 ILE MD 3.005 . 4.391 3.280 2.516 3.927 . 0 0 "[ . 1 . 2]" 1
1202 1 66 ARG HB2 1 112 ILE HG13 3.650 . 5.778 5.300 4.366 5.955 0.177 8 0 "[ . 1 . 2]" 1
1203 1 66 ARG HB3 1 88 PHE QD 3.115 . 4.627 2.996 2.265 4.321 . 0 0 "[ . 1 . 2]" 1
1204 1 66 ARG HB3 1 112 ILE MD 3.005 . 4.391 3.993 3.116 4.586 0.195 2 0 "[ . 1 . 2]" 1
1205 1 66 ARG HB3 1 112 ILE HG13 3.650 . 5.778 5.751 4.990 6.338 0.561 2 1 "[ + . 1 . 2]" 1
1206 1 66 ARG QD 1 67 LYS H 3.405 . 5.251 4.669 3.888 5.294 0.043 17 0 "[ . 1 . 2]" 1
1207 1 66 ARG QD 1 87 GLN HE21 3.255 . 4.928 2.560 1.665 4.252 0.135 20 0 "[ . 1 . 2]" 1
1208 1 66 ARG QD 1 87 GLN HE22 3.160 . 4.724 3.452 2.221 4.831 0.107 18 0 "[ . 1 . 2]" 1
1209 1 66 ARG QD 1 88 PHE H 3.155 . 4.713 3.441 2.713 4.900 0.187 17 0 "[ . 1 . 2]" 1
1210 1 66 ARG QD 1 88 PHE HA 3.395 . 5.229 4.763 4.140 5.889 0.659 6 2 "[ .+ 1 . - 2]" 1
1211 1 66 ARG QD 1 88 PHE HB3 2.475 . 3.251 2.182 1.759 3.278 0.041 5 0 "[ . 1 . 2]" 1
1212 1 66 ARG QD 1 88 PHE QD 2.495 . 3.294 2.348 1.806 3.352 0.057 6 0 "[ . 1 . 2]" 1
1213 1 66 ARG QD 1 88 PHE QE 3.380 . 5.197 4.251 3.498 5.184 . 0 0 "[ . 1 . 2]" 1
1214 1 66 ARG QD 1 112 ILE MD 3.445 . 5.337 4.577 3.926 5.428 0.092 6 0 "[ . 1 . 2]" 1
1215 1 66 ARG HD2 1 88 PHE H 3.555 . 5.573 4.090 2.739 5.797 0.224 6 0 "[ . 1 . 2]" 1
1216 1 66 ARG HD2 1 88 PHE QD 2.730 . 3.799 3.037 1.858 3.943 0.143 14 0 "[ . 1 . 2]" 1
1217 1 66 ARG HD3 1 88 PHE H 3.555 . 5.573 4.287 2.933 5.658 0.085 17 0 "[ . 1 . 2]" 1
1218 1 66 ARG HD3 1 88 PHE QD 2.730 . 3.799 2.757 1.938 3.875 0.075 6 0 "[ . 1 . 2]" 1
1219 1 66 ARG QG 1 67 LYS H 2.615 . 3.552 3.421 2.273 3.846 0.294 3 0 "[ . 1 . 2]" 1
1220 1 66 ARG QG 1 67 LYS HA 3.105 . 4.606 4.033 3.551 4.674 0.068 8 0 "[ . 1 . 2]" 1
1221 1 66 ARG QG 1 87 GLN HE21 3.125 . 4.649 2.470 1.600 3.999 0.200 11 0 "[ . 1 . 2]" 1
1222 1 66 ARG QG 1 88 PHE H 3.225 . 4.864 3.921 2.912 5.123 0.259 8 0 "[ . 1 . 2]" 1
1223 1 66 ARG QG 1 88 PHE HB2 3.105 . 4.606 3.819 2.340 4.758 0.153 8 0 "[ . 1 . 2]" 1
1224 1 66 ARG QG 1 88 PHE HB3 2.785 . 3.918 2.894 1.727 4.058 0.141 16 0 "[ . 1 . 2]" 1
1225 1 66 ARG QG 1 88 PHE QD 2.860 . 4.079 3.213 1.745 4.259 0.180 16 0 "[ . 1 . 2]" 1
1226 1 66 ARG QG 1 117 VAL MG1 3.175 . 4.756 4.314 2.723 5.056 0.300 11 0 "[ . 1 . 2]" 1
1227 1 67 LYS H 1 67 LYS QD 3.495 . 5.444 4.413 4.152 4.721 . 0 0 "[ . 1 . 2]" 1
1228 1 67 LYS H 1 67 LYS QE 3.570 . 5.606 5.570 5.021 5.997 0.391 20 0 "[ . 1 . 2]" 1
1229 1 67 LYS H 1 67 LYS QG 3.290 . 5.003 3.677 2.879 4.191 . 0 0 "[ . 1 . 2]" 1
1230 1 67 LYS H 1 87 GLN HE21 3.650 . 5.778 4.846 3.788 6.201 0.423 16 0 "[ . 1 . 2]" 1
1231 1 67 LYS H 1 88 PHE HB2 3.100 . 4.595 3.691 2.847 4.411 . 0 0 "[ . 1 . 2]" 1
1232 1 67 LYS H 1 88 PHE HB3 3.300 . 5.025 4.238 3.376 4.882 . 0 0 "[ . 1 . 2]" 1
1233 1 67 LYS H 1 88 PHE QD 3.155 . 4.713 4.643 4.036 4.941 0.228 14 0 "[ . 1 . 2]" 1
1234 1 67 LYS H 1 117 VAL H 3.595 . 5.659 5.612 4.956 6.017 0.357 7 0 "[ . 1 . 2]" 1
1235 1 67 LYS H 1 117 VAL MG1 2.855 . 4.068 2.514 2.062 2.823 . 0 0 "[ . 1 . 2]" 1
1236 1 67 LYS HA 1 67 LYS QD 3.010 . 4.402 3.281 1.825 4.084 . 0 0 "[ . 1 . 2]" 1
1237 1 67 LYS HA 1 68 SER H 2.285 . 2.843 2.221 2.097 2.686 . 0 0 "[ . 1 . 2]" 1
1238 1 67 LYS HA 1 68 SER QB 3.000 . 4.380 4.109 3.849 4.497 0.117 17 0 "[ . 1 . 2]" 1
1239 1 67 LYS HA 1 117 VAL MG1 2.960 . 4.294 3.966 3.769 4.151 . 0 0 "[ . 1 . 2]" 1
1240 1 67 LYS HA 1 117 VAL MG2 3.190 . 4.788 4.277 3.947 4.752 . 0 0 "[ . 1 . 2]" 1
1241 1 67 LYS HB2 1 67 LYS QD 2.645 . 3.617 2.814 2.307 3.503 . 0 0 "[ . 1 . 2]" 1
1242 1 67 LYS HB2 1 68 SER H 2.810 . 3.971 3.912 3.648 4.205 0.234 9 0 "[ . 1 . 2]" 1
1243 1 67 LYS HB2 1 117 VAL MG1 2.995 . 4.369 2.618 1.768 3.292 0.032 11 0 "[ . 1 . 2]" 1
1244 1 67 LYS HB2 1 117 VAL MG2 2.745 . 3.832 3.496 2.615 3.999 0.167 19 0 "[ . 1 . 2]" 1
1245 1 67 LYS HB3 1 67 LYS QD 2.680 . 3.692 2.559 2.271 3.280 . 0 0 "[ . 1 . 2]" 1
1246 1 67 LYS HB3 1 67 LYS QE 3.040 . 4.466 3.177 1.877 4.162 . 0 0 "[ . 1 . 2]" 1
1247 1 67 LYS HB3 1 68 SER H 3.105 . 4.606 3.095 2.301 3.967 . 0 0 "[ . 1 . 2]" 1
1248 1 67 LYS HB3 1 68 SER HA 3.155 . 4.713 4.760 4.338 5.048 0.335 16 0 "[ . 1 . 2]" 1
1249 1 67 LYS HB3 1 69 CYS H 3.650 . 5.778 5.774 5.462 5.981 0.203 5 0 "[ . 1 . 2]" 1
1250 1 67 LYS HB3 1 117 VAL HA 3.365 . 5.165 5.018 4.093 5.806 0.641 18 2 "[ - . 1 . + 2]" 1
1251 1 67 LYS HB3 1 117 VAL HB 3.590 . 5.648 4.670 4.117 5.387 . 0 0 "[ . 1 . 2]" 1
1252 1 67 LYS HB3 1 117 VAL MG1 2.450 . 3.197 2.306 1.763 3.227 0.037 1 0 "[ . 1 . 2]" 1
1253 1 67 LYS HB3 1 117 VAL MG2 2.580 . 3.477 2.419 2.004 2.962 . 0 0 "[ . 1 . 2]" 1
1254 1 67 LYS QD 1 68 SER QB 3.450 . 5.347 4.191 2.532 5.664 0.317 7 0 "[ . 1 . 2]" 1
1255 1 67 LYS QD 1 117 VAL H 3.570 . 5.606 3.611 2.318 5.793 0.188 11 0 "[ . 1 . 2]" 1
1256 1 67 LYS QD 1 117 VAL MG1 3.395 . 5.229 3.633 3.240 4.746 . 0 0 "[ . 1 . 2]" 1
1257 1 67 LYS QD 1 117 VAL MG2 3.565 . 5.595 3.182 1.779 4.757 0.021 5 0 "[ . 1 . 2]" 1
1258 1 67 LYS QE 1 67 LYS QG 2.480 . 3.262 2.140 2.040 2.305 . 0 0 "[ . 1 . 2]" 1
1259 1 67 LYS QE 1 68 SER H 3.185 . 4.778 3.255 2.105 3.768 . 0 0 "[ . 1 . 2]" 1
1260 1 67 LYS QE 1 68 SER QB 2.505 . 3.316 3.714 3.466 3.987 0.671 15 8 "[ .-** 1 ***+ * 2]" 1
1261 1 67 LYS QE 1 117 VAL H 3.505 . 5.466 4.243 3.041 5.296 . 0 0 "[ . 1 . 2]" 1
1262 1 67 LYS QE 1 117 VAL MG2 2.995 . 4.369 3.707 3.076 4.432 0.063 15 0 "[ . 1 . 2]" 1
1263 1 67 LYS HE2 1 117 VAL MG1 3.570 . 5.606 5.094 3.260 5.869 0.264 15 0 "[ . 1 . 2]" 1
1264 1 67 LYS HE2 1 117 VAL MG2 3.325 . 5.079 4.168 3.133 5.352 0.273 15 0 "[ . 1 . 2]" 1
1265 1 67 LYS HE3 1 117 VAL MG1 3.570 . 5.606 5.368 4.554 5.808 0.202 17 0 "[ . 1 . 2]" 1
1266 1 67 LYS HE3 1 117 VAL MG2 3.325 . 5.079 4.480 3.616 5.112 0.033 18 0 "[ . 1 . 2]" 1
1267 1 67 LYS QG 1 68 SER H 2.710 . 3.757 2.797 1.989 3.822 0.065 10 0 "[ . 1 . 2]" 1
1268 1 67 LYS QG 1 68 SER HA 3.570 . 5.606 5.032 3.758 5.937 0.332 10 0 "[ . 1 . 2]" 1
1269 1 67 LYS QG 1 68 SER QB 3.110 . 4.616 4.176 2.996 5.406 0.789 11 2 "[ . -+ . 2]" 1
1270 1 67 LYS QG 1 117 VAL H 3.480 . 5.412 4.324 2.259 5.502 0.090 6 0 "[ . 1 . 2]" 1
1271 1 67 LYS QG 1 117 VAL MG1 3.215 . 4.842 3.664 3.320 3.950 . 0 0 "[ . 1 . 2]" 1
1272 1 67 LYS QG 1 117 VAL MG2 3.570 . 5.606 3.607 2.000 4.673 . 0 0 "[ . 1 . 2]" 1
1273 1 68 SER H 1 68 SER HB2 2.675 . 3.681 2.635 2.354 3.462 . 0 0 "[ . 1 . 2]" 1
1274 1 68 SER H 1 68 SER QB 2.445 . 3.187 2.286 2.110 2.570 . 0 0 "[ . 1 . 2]" 1
1275 1 68 SER H 1 68 SER HB3 2.675 . 3.681 2.715 2.301 3.646 . 0 0 "[ . 1 . 2]" 1
1276 1 68 SER H 1 117 VAL MG2 2.625 . 3.574 3.719 2.779 4.017 0.444 3 0 "[ . 1 . 2]" 1
1277 1 68 SER HA 1 69 CYS HA 3.100 . 4.595 4.389 4.269 4.534 . 0 0 "[ . 1 . 2]" 1
1278 1 68 SER HA 1 117 VAL MG1 3.220 . 4.853 4.555 4.144 4.992 0.139 11 0 "[ . 1 . 2]" 1
1279 1 68 SER HA 1 117 VAL MG2 2.975 . 4.326 3.539 3.004 3.792 . 0 0 "[ . 1 . 2]" 1
1280 1 68 SER QB 1 69 CYS H 2.835 . 4.025 3.319 2.608 3.719 . 0 0 "[ . 1 . 2]" 1
1281 1 68 SER QB 1 69 CYS HA 3.415 . 5.272 4.612 3.969 4.927 . 0 0 "[ . 1 . 2]" 1
1282 1 68 SER QB 1 70 ARG HB3 3.570 . 5.606 5.494 4.670 5.894 0.289 11 0 "[ . 1 . 2]" 1
1283 1 68 SER QB 1 117 VAL MG2 3.055 . 4.498 4.118 3.833 4.286 . 0 0 "[ . 1 . 2]" 1
1284 1 68 SER HB2 1 69 CYS H 3.225 . 4.864 3.883 2.916 4.227 . 0 0 "[ . 1 . 2]" 1
1285 1 68 SER HB2 1 117 VAL MG2 3.370 . 5.175 4.798 4.072 5.256 0.081 3 0 "[ . 1 . 2]" 1
1286 1 68 SER HB3 1 69 CYS H 3.225 . 4.864 3.746 2.654 4.127 . 0 0 "[ . 1 . 2]" 1
1287 1 68 SER HB3 1 117 VAL MG2 3.370 . 5.175 4.562 4.196 5.104 . 0 0 "[ . 1 . 2]" 1
1288 1 69 CYS H 1 69 CYS HB2 2.615 . 3.552 2.422 2.171 3.845 0.293 17 0 "[ . 1 . 2]" 1
1289 1 69 CYS H 1 69 CYS QB 2.375 . 3.036 2.339 2.145 2.794 . 0 0 "[ . 1 . 2]" 1
1290 1 69 CYS H 1 69 CYS HB3 2.615 . 3.552 3.502 2.869 3.641 0.089 7 0 "[ . 1 . 2]" 1
1291 1 69 CYS H 1 86 ILE MG 3.250 . 4.918 3.121 2.315 3.928 . 0 0 "[ . 1 . 2]" 1
1292 1 69 CYS H 1 87 GLN H 3.630 . 5.734 4.532 3.358 5.480 . 0 0 "[ . 1 . 2]" 1
1293 1 69 CYS H 1 87 GLN HA 2.610 . 3.542 2.246 1.712 2.861 0.088 19 0 "[ . 1 . 2]" 1
1294 1 69 CYS H 1 87 GLN QB 2.900 . 4.165 4.079 2.919 4.452 0.287 16 0 "[ . 1 . 2]" 1
1295 1 69 CYS H 1 88 PHE H 2.930 . 4.229 3.893 3.128 4.280 0.051 7 0 "[ . 1 . 2]" 1
1296 1 69 CYS H 1 117 VAL MG2 2.830 . 4.015 3.268 2.846 3.515 . 0 0 "[ . 1 . 2]" 1
1297 1 69 CYS HA 1 70 ARG H 2.300 . 2.875 2.451 2.254 2.924 0.049 17 0 "[ . 1 . 2]" 1
1298 1 69 CYS HA 1 70 ARG HB3 2.970 . 4.315 4.156 3.822 4.449 0.134 5 0 "[ . 1 . 2]" 1
1299 1 69 CYS HA 1 70 ARG QD 3.095 . 4.584 3.550 2.797 4.986 0.402 5 0 "[ . 1 . 2]" 1
1300 1 69 CYS HA 1 117 VAL MG2 2.310 . 2.897 2.006 1.694 2.535 0.106 18 0 "[ . 1 . 2]" 1
1301 1 69 CYS QB 1 70 ARG H 2.425 . 3.144 2.487 1.945 2.822 . 0 0 "[ . 1 . 2]" 1
1302 1 69 CYS QB 1 87 GLN H 2.705 . 3.746 3.297 2.963 4.437 0.692 17 1 "[ . 1 . + 2]" 1
1303 1 69 CYS QB 1 87 GLN HA 3.470 . 5.391 2.564 1.860 4.116 . 0 0 "[ . 1 . 2]" 1
1304 1 69 CYS QB 1 87 GLN QB 3.490 . 5.433 4.286 3.807 5.640 0.207 17 0 "[ . 1 . 2]" 1
1305 1 69 CYS QB 1 88 PHE H 3.120 . 4.638 4.082 3.439 4.628 . 0 0 "[ . 1 . 2]" 1
1306 1 69 CYS QB 1 117 VAL HB 3.570 . 5.606 4.294 2.403 5.045 . 0 0 "[ . 1 . 2]" 1
1307 1 69 CYS QB 1 117 VAL MG2 2.965 . 4.305 3.188 1.867 3.634 . 0 0 "[ . 1 . 2]" 1
1308 1 69 CYS QB 1 119 TRP H 3.570 . 5.606 5.676 4.595 6.009 0.403 12 0 "[ . 1 . 2]" 1
1309 1 69 CYS QB 1 119 TRP HD1 3.385 . 5.208 4.664 4.146 4.975 . 0 0 "[ . 1 . 2]" 1
1310 1 69 CYS QB 1 119 TRP HE1 2.505 . 3.316 3.010 2.324 3.947 0.631 17 1 "[ . 1 . + 2]" 1
1311 1 69 CYS QB 1 119 TRP HZ2 3.215 . 4.842 2.731 2.223 4.758 . 0 0 "[ . 1 . 2]" 1
1312 1 69 CYS HB2 1 117 VAL MG2 3.255 . 4.928 3.617 2.244 4.165 . 0 0 "[ . 1 . 2]" 1
1313 1 69 CYS HB3 1 117 VAL MG2 3.255 . 4.928 3.601 1.997 4.131 . 0 0 "[ . 1 . 2]" 1
1314 1 70 ARG H 1 70 ARG QG 2.845 . 4.047 2.776 1.900 3.378 . 0 0 "[ . 1 . 2]" 1
1315 1 70 ARG H 1 71 ASN H 3.080 . 4.552 4.380 4.281 4.493 . 0 0 "[ . 1 . 2]" 1
1316 1 70 ARG H 1 86 ILE MD 3.355 . 5.143 5.060 4.367 5.490 0.347 10 0 "[ . 1 . 2]" 1
1317 1 70 ARG H 1 86 ILE MG 3.395 . 5.229 3.489 2.876 4.024 . 0 0 "[ . 1 . 2]" 1
1318 1 70 ARG H 1 119 TRP HD1 2.840 . 4.036 4.060 3.155 4.368 0.332 15 0 "[ . 1 . 2]" 1
1319 1 70 ARG H 1 119 TRP HE1 2.700 . 3.735 2.664 1.899 3.121 . 0 0 "[ . 1 . 2]" 1
1320 1 70 ARG HA 1 70 ARG HB2 2.255 . 2.778 2.419 2.360 2.499 . 0 0 "[ . 1 . 2]" 1
1321 1 70 ARG HA 1 70 ARG QD 2.830 . 4.015 3.863 3.617 4.358 0.343 11 0 "[ . 1 . 2]" 1
1322 1 70 ARG HA 1 70 ARG QG 2.755 . 3.853 3.440 3.273 3.546 . 0 0 "[ . 1 . 2]" 1
1323 1 70 ARG HA 1 71 ASN H 2.195 . 2.649 2.318 2.207 2.537 . 0 0 "[ . 1 . 2]" 1
1324 1 70 ARG HA 1 71 ASN QB 3.005 . 4.391 4.004 3.740 4.353 . 0 0 "[ . 1 . 2]" 1
1325 1 70 ARG HA 1 119 TRP HE1 2.940 . 4.251 4.031 3.633 4.400 0.149 16 0 "[ . 1 . 2]" 1
1326 1 70 ARG HA 1 119 TRP HZ2 3.330 . 5.089 4.880 4.486 5.200 0.110 11 0 "[ . 1 . 2]" 1
1327 1 70 ARG HB2 1 70 ARG QD 2.705 . 3.746 3.118 2.304 3.534 . 0 0 "[ . 1 . 2]" 1
1328 1 70 ARG HB2 1 71 ASN H 2.535 . 3.380 2.943 2.640 3.314 . 0 0 "[ . 1 . 2]" 1
1329 1 70 ARG HB2 1 119 TRP HE1 3.650 . 5.778 5.120 4.447 5.682 . 0 0 "[ . 1 . 2]" 1
1330 1 70 ARG QD 1 70 ARG QG 2.115 . 2.477 2.044 1.970 2.101 . 0 0 "[ . 1 . 2]" 1
1331 1 70 ARG QD 1 71 ASN H 3.400 . 5.240 4.834 3.506 5.476 0.236 11 0 "[ . 1 . 2]" 1
1332 1 70 ARG QD 1 119 TRP HD1 2.910 . 4.187 4.338 3.637 4.804 0.618 2 1 "[ + . 1 . 2]" 1
1333 1 70 ARG QD 1 119 TRP HE1 2.975 . 4.326 4.199 3.530 4.980 0.654 2 1 "[ + . 1 . 2]" 1
1334 1 70 ARG QG 1 71 ASN H 2.885 . 4.133 3.781 3.395 4.446 0.313 5 0 "[ . 1 . 2]" 1
1335 1 70 ARG QG 1 119 TRP HE1 3.320 . 5.068 3.809 2.529 4.546 . 0 0 "[ . 1 . 2]" 1
1336 1 71 ASN H 1 71 ASN QB 2.345 . 2.972 2.681 2.406 3.092 0.120 2 0 "[ . 1 . 2]" 1
1337 1 71 ASN H 1 71 ASN HD21 3.090 . 4.574 4.132 1.799 4.912 0.338 9 0 "[ . 1 . 2]" 1
1338 1 71 ASN H 1 71 ASN HD22 3.650 . 5.778 5.430 3.500 5.994 0.217 9 0 "[ . 1 . 2]" 1
1339 1 71 ASN H 1 73 PRO QD 3.575 . 5.616 4.114 3.689 4.549 . 0 0 "[ . 1 . 2]" 1
1340 1 71 ASN H 1 86 ILE MD 2.980 . 4.337 4.245 3.696 4.556 0.219 19 0 "[ . 1 . 2]" 1
1341 1 71 ASN H 1 86 ILE MG 3.410 . 5.261 3.414 2.944 3.796 . 0 0 "[ . 1 . 2]" 1
1342 1 71 ASN H 1 119 TRP HE1 3.340 . 5.111 4.200 3.829 4.776 . 0 0 "[ . 1 . 2]" 1
1343 1 71 ASN H 1 119 TRP HZ2 3.650 . 5.778 5.265 4.968 5.683 . 0 0 "[ . 1 . 2]" 1
1344 1 71 ASN HA 1 71 ASN HD21 3.375 . 5.186 3.007 1.641 4.416 0.159 4 0 "[ . 1 . 2]" 1
1345 1 71 ASN HA 1 71 ASN HD22 3.585 . 5.638 4.021 3.193 4.997 . 0 0 "[ . 1 . 2]" 1
1346 1 71 ASN HA 1 73 PRO QD 2.910 . 4.187 2.245 1.938 2.652 . 0 0 "[ . 1 . 2]" 1
1347 1 71 ASN HA 1 73 PRO HG2 2.985 . 4.348 3.283 2.647 4.047 . 0 0 "[ . 1 . 2]" 1
1348 1 71 ASN HA 1 73 PRO HG3 2.770 . 3.885 3.908 3.389 4.150 0.264 20 0 "[ . 1 . 2]" 1
1349 1 71 ASN QB 1 71 ASN HD21 2.305 . 2.886 2.421 2.028 2.875 . 0 0 "[ . 1 . 2]" 1
1350 1 71 ASN QB 1 71 ASN HD22 2.640 . 3.606 3.335 3.166 3.494 . 0 0 "[ . 1 . 2]" 1
1351 1 71 ASN QB 1 73 PRO HG2 3.070 . 4.530 4.303 2.556 4.865 0.335 16 0 "[ . 1 . 2]" 1
1352 1 71 ASN QB 1 80 VAL QG 3.035 . 4.455 3.762 3.123 4.247 . 0 0 "[ . 1 . 2]" 1
1353 1 71 ASN QB 1 86 ILE MD 2.505 . 3.316 2.488 1.888 3.407 0.091 18 0 "[ . 1 . 2]" 1
1354 1 71 ASN QB 1 86 ILE MG 2.615 . 3.552 3.133 2.318 3.847 0.295 18 0 "[ . 1 . 2]" 1
1355 1 71 ASN QB 1 92 ILE MD 3.225 . 4.864 3.643 2.798 4.624 . 0 0 "[ . 1 . 2]" 1
1356 1 71 ASN QB 1 119 TRP HZ2 3.015 . 4.412 3.545 2.936 4.304 . 0 0 "[ . 1 . 2]" 1
1357 1 71 ASN HB2 1 92 ILE MD 3.605 . 5.681 3.927 2.998 5.126 . 0 0 "[ . 1 . 2]" 1
1358 1 71 ASN HB2 1 119 TRP HZ2 3.410 . 5.261 3.917 3.085 5.305 0.044 18 0 "[ . 1 . 2]" 1
1359 1 71 ASN HB3 1 92 ILE MD 3.605 . 5.681 4.418 3.056 5.358 . 0 0 "[ . 1 . 2]" 1
1360 1 71 ASN HB3 1 119 TRP HZ2 3.410 . 5.261 4.736 3.414 5.632 0.370 7 0 "[ . 1 . 2]" 1
1361 1 71 ASN HD21 1 73 PRO HG2 3.650 . 5.778 4.373 2.508 5.740 . 0 0 "[ . 1 . 2]" 1
1362 1 71 ASN HD21 1 74 ASP HA 3.650 . 5.778 5.154 3.211 6.012 0.235 12 0 "[ . 1 . 2]" 1
1363 1 71 ASN HD21 1 80 VAL MG1 3.650 . 5.778 4.489 2.899 5.596 . 0 0 "[ . 1 . 2]" 1
1364 1 71 ASN HD21 1 80 VAL QG 3.275 . 4.971 3.817 2.514 4.733 . 0 0 "[ . 1 . 2]" 1
1365 1 71 ASN HD21 1 80 VAL MG2 3.650 . 5.778 4.256 2.598 5.237 . 0 0 "[ . 1 . 2]" 1
1366 1 71 ASN HD21 1 86 ILE MD 2.915 . 4.197 3.443 2.171 4.444 0.247 17 0 "[ . 1 . 2]" 1
1367 1 71 ASN HD21 1 86 ILE MG 3.270 . 4.960 4.461 3.457 5.376 0.416 10 0 "[ . 1 . 2]" 1
1368 1 71 ASN HD21 1 92 ILE MD 3.305 . 5.036 3.599 2.405 5.167 0.132 2 0 "[ . 1 . 2]" 1
1369 1 71 ASN HD21 1 92 ILE MG 3.650 . 5.778 4.684 2.969 5.802 0.024 18 0 "[ . 1 . 2]" 1
1370 1 71 ASN HD22 1 73 PRO HG2 3.650 . 5.778 4.420 2.762 6.363 0.586 18 2 "[ - . 1 . + 2]" 1
1371 1 71 ASN HD22 1 74 ASP HA 3.650 . 5.778 4.416 2.544 5.936 0.158 17 0 "[ . 1 . 2]" 1
1372 1 71 ASN HD22 1 80 VAL QG 3.620 . 5.713 2.955 1.812 3.893 . 0 0 "[ . 1 . 2]" 1
1373 1 71 ASN HD22 1 86 ILE MD 3.275 . 4.971 3.908 2.511 4.981 0.010 8 0 "[ . 1 . 2]" 1
1374 1 71 ASN HD22 1 92 ILE MG 3.650 . 5.778 4.532 2.946 5.435 . 0 0 "[ . 1 . 2]" 1
1375 1 71 ASN HD22 1 119 TRP HE1 3.650 . 5.778 5.004 3.112 6.090 0.313 5 0 "[ . 1 . 2]" 1
1376 1 73 PRO HA 1 74 ASP QB 3.350 . 5.133 4.739 4.034 5.307 0.174 7 0 "[ . 1 . 2]" 1
1377 1 73 PRO QB 1 74 ASP H 2.695 . 3.724 2.996 2.278 3.799 0.075 10 0 "[ . 1 . 2]" 1
1378 1 73 PRO HD2 1 74 ASP H 2.990 . 4.359 3.103 2.575 3.477 . 0 0 "[ . 1 . 2]" 1
1379 1 73 PRO HD3 1 74 ASP H 2.990 . 4.359 4.057 3.842 4.252 . 0 0 "[ . 1 . 2]" 1
1380 1 73 PRO HG2 1 74 ASP H 2.755 . 3.853 2.792 2.174 3.696 . 0 0 "[ . 1 . 2]" 1
1381 1 73 PRO HG2 1 74 ASP HA 3.250 . 4.918 4.379 3.837 5.091 0.174 20 0 "[ . 1 . 2]" 1
1382 1 73 PRO HG2 1 74 ASP QB 3.570 . 5.606 5.240 4.580 5.890 0.284 20 0 "[ . 1 . 2]" 1
1383 1 74 ASP H 1 74 ASP HB2 2.980 . 4.337 3.496 2.354 4.009 . 0 0 "[ . 1 . 2]" 1
1384 1 74 ASP H 1 74 ASP QB 2.580 . 3.477 2.858 2.323 3.288 . 0 0 "[ . 1 . 2]" 1
1385 1 74 ASP H 1 74 ASP HB3 2.980 . 4.337 3.233 2.372 4.101 . 0 0 "[ . 1 . 2]" 1
1386 1 74 ASP H 1 75 PRO HA 3.650 . 5.778 5.806 5.665 5.946 0.169 16 0 "[ . 1 . 2]" 1
1387 1 74 ASP H 1 75 PRO QD 3.115 . 4.627 4.010 3.695 4.277 . 0 0 "[ . 1 . 2]" 1
1388 1 74 ASP H 1 80 VAL QG 3.380 . 5.197 4.519 3.923 4.891 . 0 0 "[ . 1 . 2]" 1
1389 1 74 ASP HA 1 75 PRO HA 3.175 . 4.756 4.415 4.259 4.508 . 0 0 "[ . 1 . 2]" 1
1390 1 74 ASP HA 1 80 VAL HB 2.990 . 4.359 4.250 3.366 4.676 0.318 9 0 "[ . 1 . 2]" 1
1391 1 74 ASP HA 1 80 VAL QG 2.535 . 3.380 3.113 2.194 3.578 0.197 12 0 "[ . 1 . 2]" 1
1392 1 74 ASP QB 1 75 PRO HA 3.455 . 5.358 4.775 4.168 5.298 . 0 0 "[ . 1 . 2]" 1
1393 1 74 ASP QB 1 75 PRO QD 3.230 . 4.874 2.262 1.824 3.324 . 0 0 "[ . 1 . 2]" 1
1394 1 74 ASP QB 1 79 MET H 3.570 . 5.606 5.608 4.842 5.936 0.330 6 0 "[ . 1 . 2]" 1
1395 1 74 ASP QB 1 80 VAL HB 3.270 . 4.960 4.879 3.988 5.451 0.491 18 0 "[ . 1 . 2]" 1
1396 1 74 ASP QB 1 80 VAL QG 2.790 . 3.928 3.622 2.673 4.247 0.319 19 0 "[ . 1 . 2]" 1
1397 1 75 PRO HA 1 76 VAL H 2.305 . 2.886 2.316 2.212 2.521 . 0 0 "[ . 1 . 2]" 1
1398 1 75 PRO HA 1 76 VAL HA 3.100 . 4.595 4.281 4.175 4.372 . 0 0 "[ . 1 . 2]" 1
1399 1 75 PRO HA 1 76 VAL QG 2.800 . 3.950 3.647 3.496 3.923 . 0 0 "[ . 1 . 2]" 1
1400 1 75 PRO HB2 1 76 VAL H 2.735 . 3.810 3.121 2.171 3.580 . 0 0 "[ . 1 . 2]" 1
1401 1 75 PRO HB2 1 78 GLY H 2.780 . 3.907 2.371 1.611 3.184 0.189 19 0 "[ . 1 . 2]" 1
1402 1 75 PRO HB2 1 78 GLY QA 2.905 . 4.176 3.562 2.612 4.335 0.159 16 0 "[ . 1 . 2]" 1
1403 1 75 PRO HB2 1 79 MET H 2.915 . 4.197 2.433 1.704 3.928 0.096 3 0 "[ . 1 . 2]" 1
1404 1 75 PRO HB2 1 94 TYR QD 3.215 . 4.842 3.987 3.492 4.860 0.018 14 0 "[ . 1 . 2]" 1
1405 1 75 PRO HB3 1 78 GLY H 3.275 . 4.971 3.968 3.205 4.760 . 0 0 "[ . 1 . 2]" 1
1406 1 75 PRO HB3 1 80 VAL H 3.410 . 5.261 5.178 3.364 5.788 0.527 9 2 "[ . - +1 . 2]" 1
1407 1 75 PRO QD 1 78 GLY H 3.490 . 5.433 3.802 3.066 4.253 . 0 0 "[ . 1 . 2]" 1
1408 1 75 PRO QD 1 78 GLY QA 3.115 . 4.627 2.740 1.882 3.529 . 0 0 "[ . 1 . 2]" 1
1409 1 75 PRO QD 1 79 MET H 3.195 . 4.799 3.711 2.875 4.501 . 0 0 "[ . 1 . 2]" 1
1410 1 75 PRO QD 1 80 VAL H 2.965 . 4.305 3.611 2.564 4.269 . 0 0 "[ . 1 . 2]" 1
1411 1 75 PRO QD 1 80 VAL HA 3.030 . 4.444 4.326 3.796 4.780 0.336 19 0 "[ . 1 . 2]" 1
1412 1 75 PRO QD 1 80 VAL HB 3.365 . 5.165 2.561 1.797 3.670 0.003 5 0 "[ . 1 . 2]" 1
1413 1 75 PRO QD 1 80 VAL QG 2.775 . 3.896 2.103 1.659 2.513 0.141 16 0 "[ . 1 . 2]" 1
1414 1 75 PRO QD 1 94 TYR QD 3.225 . 4.864 3.267 1.987 4.668 . 0 0 "[ . 1 . 2]" 1
1415 1 75 PRO HD2 1 80 VAL MG1 3.980 . 6.487 3.586 2.194 5.333 . 0 0 "[ . 1 . 2]" 1
1416 1 75 PRO HD2 1 80 VAL MG2 3.980 . 6.487 3.764 1.914 4.685 . 0 0 "[ . 1 . 2]" 1
1417 1 75 PRO HD3 1 80 VAL MG1 3.980 . 6.487 3.235 2.212 4.289 . 0 0 "[ . 1 . 2]" 1
1418 1 75 PRO HD3 1 80 VAL MG2 3.980 . 6.487 2.793 1.740 3.628 0.060 8 0 "[ . 1 . 2]" 1
1419 1 75 PRO QG 1 78 GLY H 3.020 . 4.423 3.016 2.000 4.399 . 0 0 "[ . 1 . 2]" 1
1420 1 75 PRO QG 1 80 VAL HA 2.650 . 3.628 3.328 2.944 3.750 0.123 16 0 "[ . 1 . 2]" 1
1421 1 75 PRO QG 1 94 TYR QD 3.050 . 4.488 2.559 1.792 3.740 0.008 12 0 "[ . 1 . 2]" 1
1422 1 76 VAL H 1 76 VAL HB 2.330 . 2.940 2.482 2.370 2.554 . 0 0 "[ . 1 . 2]" 1
1423 1 76 VAL H 1 76 VAL MG1 2.790 . 3.928 3.577 1.956 3.815 . 0 0 "[ . 1 . 2]" 1
1424 1 76 VAL H 1 76 VAL QG 2.250 . 2.767 2.103 1.949 2.221 . 0 0 "[ . 1 . 2]" 1
1425 1 76 VAL H 1 76 VAL MG2 2.790 . 3.928 2.291 2.062 3.791 . 0 0 "[ . 1 . 2]" 1
1426 1 76 VAL H 1 77 ASN H 2.945 . 4.262 2.757 2.558 2.951 . 0 0 "[ . 1 . 2]" 1
1427 1 76 VAL H 1 77 ASN HA 3.650 . 5.778 5.327 5.235 5.417 . 0 0 "[ . 1 . 2]" 1
1428 1 76 VAL H 1 77 ASN QB 3.570 . 5.606 4.764 4.329 5.280 . 0 0 "[ . 1 . 2]" 1
1429 1 76 VAL H 1 78 GLY H 3.100 . 4.595 3.899 3.604 4.412 . 0 0 "[ . 1 . 2]" 1
1430 1 76 VAL H 1 79 MET H 3.650 . 5.778 5.209 4.676 5.733 . 0 0 "[ . 1 . 2]" 1
1431 1 76 VAL HA 1 76 VAL MG1 2.225 . 2.714 2.541 2.419 3.188 0.474 11 0 "[ . 1 . 2]" 1
1432 1 76 VAL HA 1 76 VAL QG 2.015 . 2.262 2.155 2.099 2.286 0.023 11 0 "[ . 1 . 2]" 1
1433 1 76 VAL HA 1 76 VAL MG2 2.225 . 2.714 2.349 2.271 2.429 . 0 0 "[ . 1 . 2]" 1
1434 1 76 VAL HA 1 78 GLY H 3.065 . 4.520 4.204 3.758 4.482 . 0 0 "[ . 1 . 2]" 1
1435 1 76 VAL HB 1 78 GLY H 3.650 . 5.778 4.884 4.541 5.645 . 0 0 "[ . 1 . 2]" 1
1436 1 76 VAL QG 1 77 ASN H 2.485 . 3.273 2.985 1.774 3.353 0.080 14 0 "[ . 1 . 2]" 1
1437 1 76 VAL QG 1 77 ASN HA 2.840 . 4.036 3.357 3.127 3.564 . 0 0 "[ . 1 . 2]" 1
1438 1 76 VAL QG 1 77 ASN QB 3.180 . 4.767 3.796 2.814 4.385 . 0 0 "[ . 1 . 2]" 1
1439 1 76 VAL QG 1 78 GLY H 3.110 . 4.616 4.383 3.782 4.655 0.039 8 0 "[ . 1 . 2]" 1
1440 1 76 VAL MG1 1 77 ASN H 2.880 . 4.122 3.140 1.781 3.621 0.019 11 0 "[ . 1 . 2]" 1
1441 1 76 VAL MG1 1 78 GLY H 3.500 . 5.455 4.743 3.915 5.090 . 0 0 "[ . 1 . 2]" 1
1442 1 76 VAL MG2 1 77 ASN H 2.880 . 4.122 3.824 3.368 4.074 . 0 0 "[ . 1 . 2]" 1
1443 1 76 VAL MG2 1 78 GLY H 3.500 . 5.455 5.178 4.845 5.478 0.023 17 0 "[ . 1 . 2]" 1
1444 1 77 ASN H 1 78 GLY H 2.515 . 3.337 2.582 2.373 2.804 . 0 0 "[ . 1 . 2]" 1
1445 1 77 ASN HA 1 78 GLY H 2.660 . 3.649 3.391 3.103 3.561 . 0 0 "[ . 1 . 2]" 1
1446 1 77 ASN QB 1 78 GLY H 2.810 . 3.971 3.193 2.581 4.121 0.149 17 0 "[ . 1 . 2]" 1
1447 1 77 ASN QB 1 78 GLY QA 3.390 . 5.219 4.255 3.922 4.730 . 0 0 "[ . 1 . 2]" 1
1448 1 77 ASN QB 1 79 MET H 3.570 . 5.606 3.489 2.487 4.819 . 0 0 "[ . 1 . 2]" 1
1449 1 77 ASN QB 1 79 MET ME 2.795 . 3.939 3.569 2.276 4.171 0.232 11 0 "[ . 1 . 2]" 1
1450 1 77 ASN QB 1 97 THR H 3.570 . 5.606 5.323 4.378 6.288 0.682 19 3 "[ . 1 .-* +2]" 1
1451 1 77 ASN HB2 1 78 GLY H 3.150 . 4.702 3.900 2.831 4.698 . 0 0 "[ . 1 . 2]" 1
1452 1 77 ASN HB2 1 79 MET ME 3.190 . 4.788 4.256 2.936 5.149 0.360 11 0 "[ . 1 . 2]" 1
1453 1 77 ASN HB3 1 78 GLY H 3.150 . 4.702 3.585 2.623 4.605 . 0 0 "[ . 1 . 2]" 1
1454 1 77 ASN HB3 1 79 MET ME 3.190 . 4.788 3.973 2.298 5.117 0.329 19 0 "[ . 1 . 2]" 1
1455 1 78 GLY H 1 79 MET H 2.720 . 3.778 2.323 1.957 2.790 . 0 0 "[ . 1 . 2]" 1
1456 1 78 GLY H 1 79 MET ME 3.650 . 5.778 5.769 4.514 6.325 0.548 3 2 "[ +-. 1 . 2]" 1
1457 1 78 GLY H 1 79 MET QG 3.415 . 5.272 4.254 3.092 5.826 0.554 9 1 "[ . +1 . 2]" 1
1458 1 78 GLY QA 1 79 MET H 2.365 . 3.015 2.804 2.633 2.945 . 0 0 "[ . 1 . 2]" 1
1459 1 79 MET H 1 79 MET QB 2.535 . 3.380 2.407 2.257 2.652 . 0 0 "[ . 1 . 2]" 1
1460 1 79 MET H 1 79 MET ME 3.405 . 5.251 4.669 3.943 5.222 . 0 0 "[ . 1 . 2]" 1
1461 1 79 MET H 1 79 MET QG 2.725 . 3.789 2.904 2.016 3.958 0.169 12 0 "[ . 1 . 2]" 1
1462 1 79 MET H 1 80 VAL QG 3.220 . 4.853 4.195 3.737 4.637 . 0 0 "[ . 1 . 2]" 1
1463 1 79 MET H 1 94 TYR QD 3.650 . 5.778 5.352 4.598 6.134 0.356 17 0 "[ . 1 . 2]" 1
1464 1 79 MET HA 1 79 MET QG 2.705 . 3.746 2.454 2.301 2.946 . 0 0 "[ . 1 . 2]" 1
1465 1 79 MET HA 1 80 VAL H 2.535 . 3.380 2.584 2.055 3.518 0.137 17 0 "[ . 1 . 2]" 1
1466 1 79 MET QB 1 79 MET ME 2.735 . 3.810 2.767 1.979 3.627 . 0 0 "[ . 1 . 2]" 1
1467 1 79 MET QB 1 79 MET QG 2.125 . 2.499 2.061 1.987 2.084 . 0 0 "[ . 1 . 2]" 1
1468 1 79 MET QB 1 80 VAL H 2.860 . 4.079 3.668 2.716 4.058 . 0 0 "[ . 1 . 2]" 1
1469 1 79 MET QB 1 95 SER H 3.150 . 4.702 3.596 2.512 4.871 0.168 12 0 "[ . 1 . 2]" 1
1470 1 79 MET QB 1 95 SER QB 2.705 . 3.746 3.295 2.315 4.055 0.310 14 0 "[ . 1 . 2]" 1
1471 1 79 MET QB 1 96 CYS HA 2.960 . 4.294 3.160 2.127 4.224 . 0 0 "[ . 1 . 2]" 1
1472 1 79 MET QB 1 97 THR H 3.540 . 5.541 4.942 4.424 5.585 0.044 17 0 "[ . 1 . 2]" 1
1473 1 79 MET ME 1 96 CYS HA 2.730 . 3.799 3.734 2.631 4.421 0.622 19 1 "[ . 1 . +2]" 1
1474 1 79 MET ME 1 97 THR H 2.970 . 4.315 3.636 2.840 4.330 0.015 7 0 "[ . 1 . 2]" 1
1475 1 79 MET ME 1 97 THR HA 2.275 . 2.821 2.594 1.905 2.905 0.084 9 0 "[ . 1 . 2]" 1
1476 1 79 MET ME 1 97 THR HB 3.165 . 4.735 4.789 3.929 5.258 0.523 9 1 "[ . +1 . 2]" 1
1477 1 79 MET ME 1 98 LYS H 2.920 . 4.208 3.814 2.528 4.809 0.601 17 1 "[ . 1 . + 2]" 1
1478 1 79 MET ME 1 100 TYR QD 3.625 . 5.724 5.438 4.583 6.206 0.482 13 0 "[ . 1 . 2]" 1
1479 1 79 MET QG 1 80 VAL H 3.570 . 5.606 4.320 3.107 4.915 . 0 0 "[ . 1 . 2]" 1
1480 1 79 MET QG 1 96 CYS HA 3.005 . 4.391 3.887 2.041 4.866 0.475 1 0 "[ . 1 . 2]" 1
1481 1 79 MET QG 1 97 THR H 3.490 . 5.433 5.446 4.419 6.366 0.933 9 2 "[ .- +1 . 2]" 1
1482 1 80 VAL H 1 80 VAL HB 2.740 . 3.821 2.981 2.506 3.385 . 0 0 "[ . 1 . 2]" 1
1483 1 80 VAL H 1 80 VAL MG1 2.875 . 4.111 2.812 1.943 3.955 . 0 0 "[ . 1 . 2]" 1
1484 1 80 VAL H 1 80 VAL QG 2.365 . 3.015 2.315 1.937 2.884 . 0 0 "[ . 1 . 2]" 1
1485 1 80 VAL H 1 80 VAL MG2 2.875 . 4.111 3.394 2.182 3.954 . 0 0 "[ . 1 . 2]" 1
1486 1 80 VAL H 1 81 HIS H 3.295 . 5.014 4.373 4.132 4.556 . 0 0 "[ . 1 . 2]" 1
1487 1 80 VAL H 1 94 TYR QD 3.350 . 5.133 5.484 4.683 5.848 0.716 12 6 "[ .*- ** + . *]" 1
1488 1 80 VAL H 1 95 SER H 3.650 . 5.778 5.282 4.620 6.079 0.301 14 0 "[ . 1 . 2]" 1
1489 1 80 VAL HA 1 80 VAL MG1 2.910 . 4.187 2.928 2.488 3.228 . 0 0 "[ . 1 . 2]" 1
1490 1 80 VAL HA 1 80 VAL MG2 2.910 . 4.187 2.371 2.181 2.530 . 0 0 "[ . 1 . 2]" 1
1491 1 80 VAL HA 1 81 HIS H 2.430 . 3.155 2.133 2.017 2.255 . 0 0 "[ . 1 . 2]" 1
1492 1 80 VAL HA 1 81 HIS HB2 3.025 . 4.434 4.400 4.127 4.579 0.146 3 0 "[ . 1 . 2]" 1
1493 1 80 VAL HA 1 81 HIS HD2 3.455 . 5.358 4.080 3.236 4.475 . 0 0 "[ . 1 . 2]" 1
1494 1 80 VAL HA 1 93 LYS HB3 3.025 . 4.434 4.532 4.271 4.939 0.506 10 1 "[ . + . 2]" 1
1495 1 80 VAL HA 1 94 TYR HA 2.885 . 4.133 2.924 2.641 3.391 . 0 0 "[ . 1 . 2]" 1
1496 1 80 VAL HA 1 94 TYR QD 3.100 . 4.595 4.257 3.618 4.758 0.163 19 0 "[ . 1 . 2]" 1
1497 1 80 VAL HA 1 95 SER H 2.885 . 4.133 3.506 2.945 4.216 0.083 11 0 "[ . 1 . 2]" 1
1498 1 80 VAL HB 1 81 HIS H 3.100 . 4.595 4.136 3.974 4.397 . 0 0 "[ . 1 . 2]" 1
1499 1 80 VAL HB 1 92 ILE MD 3.530 . 5.519 4.727 3.990 5.807 0.287 10 0 "[ . 1 . 2]" 1
1500 1 80 VAL HB 1 93 LYS H 3.650 . 5.778 5.619 5.214 5.903 0.126 20 0 "[ . 1 . 2]" 1
1501 1 80 VAL QG 1 81 HIS H 2.445 . 3.187 2.478 2.297 3.010 . 0 0 "[ . 1 . 2]" 1
1502 1 80 VAL QG 1 81 HIS HA 2.800 . 3.950 3.406 3.237 3.821 . 0 0 "[ . 1 . 2]" 1
1503 1 80 VAL QG 1 81 HIS HB2 3.620 . 5.713 4.229 4.014 4.458 . 0 0 "[ . 1 . 2]" 1
1504 1 80 VAL QG 1 81 HIS HB3 3.500 . 5.455 4.802 4.677 5.082 . 0 0 "[ . 1 . 2]" 1
1505 1 80 VAL QG 1 82 VAL H 3.285 . 4.993 3.885 1.975 4.330 . 0 0 "[ . 1 . 2]" 1
1506 1 80 VAL QG 1 82 VAL HA 3.100 . 4.595 3.779 2.992 4.200 . 0 0 "[ . 1 . 2]" 1
1507 1 80 VAL QG 1 82 VAL QG 2.735 . 3.810 3.351 2.003 3.965 0.154 1 0 "[ . 1 . 2]" 1
1508 1 80 VAL QG 1 86 ILE MG 3.620 . 5.713 5.411 5.129 5.755 0.042 5 0 "[ . 1 . 2]" 1
1509 1 80 VAL QG 1 92 ILE H 3.620 . 5.713 5.113 4.766 5.512 . 0 0 "[ . 1 . 2]" 1
1510 1 80 VAL QG 1 92 ILE HB 2.545 . 3.402 2.341 1.954 2.777 . 0 0 "[ . 1 . 2]" 1
1511 1 80 VAL QG 1 92 ILE MD 2.545 . 3.402 2.493 1.840 3.432 0.031 3 0 "[ . 1 . 2]" 1
1512 1 80 VAL QG 1 93 LYS H 2.785 . 3.918 2.934 2.713 3.164 . 0 0 "[ . 1 . 2]" 1
1513 1 80 VAL QG 1 94 TYR HA 2.660 . 3.649 3.095 2.618 3.665 0.016 3 0 "[ . 1 . 2]" 1
1514 1 80 VAL QG 1 94 TYR QD 2.985 . 4.348 3.121 2.556 3.622 . 0 0 "[ . 1 . 2]" 1
1515 1 80 VAL QG 1 95 SER H 3.235 . 4.885 4.322 3.637 4.843 . 0 0 "[ . 1 . 2]" 1
1516 1 80 VAL QG 1 108 ALA H 3.620 . 5.713 5.142 4.778 5.609 . 0 0 "[ . 1 . 2]" 1
1517 1 80 VAL MG1 1 81 HIS H 3.090 . 4.574 3.376 2.327 3.985 . 0 0 "[ . 1 . 2]" 1
1518 1 80 VAL MG1 1 93 LYS H 3.275 . 4.971 4.338 2.746 5.439 0.467 2 0 "[ . 1 . 2]" 1
1519 1 80 VAL MG1 1 94 TYR HA 3.110 . 4.616 4.632 4.099 4.994 0.378 4 0 "[ . 1 . 2]" 1
1520 1 80 VAL MG1 1 94 TYR QD 3.295 . 5.014 4.446 4.217 4.709 . 0 0 "[ . 1 . 2]" 1
1521 1 80 VAL MG1 1 95 SER H 3.630 . 5.734 5.621 5.186 6.292 0.557 13 1 "[ . 1 + . 2]" 1
1522 1 80 VAL MG2 1 81 HIS H 3.090 . 4.574 2.950 2.333 4.022 . 0 0 "[ . 1 . 2]" 1
1523 1 80 VAL MG2 1 93 LYS H 3.275 . 4.971 3.534 2.773 4.762 . 0 0 "[ . 1 . 2]" 1
1524 1 80 VAL MG2 1 94 TYR HA 3.110 . 4.616 3.149 2.640 3.789 . 0 0 "[ . 1 . 2]" 1
1525 1 80 VAL MG2 1 94 TYR QD 3.295 . 5.014 3.209 2.576 3.800 . 0 0 "[ . 1 . 2]" 1
1526 1 80 VAL MG2 1 95 SER H 3.630 . 5.734 4.513 3.686 5.108 . 0 0 "[ . 1 . 2]" 1
1527 1 81 HIS H 1 81 HIS HB2 2.540 . 3.391 2.471 2.341 2.564 . 0 0 "[ . 1 . 2]" 1
1528 1 81 HIS H 1 81 HIS HD2 2.970 . 4.315 3.407 2.602 3.833 . 0 0 "[ . 1 . 2]" 1
1529 1 81 HIS H 1 82 VAL HA 3.515 . 5.487 4.803 4.678 4.917 . 0 0 "[ . 1 . 2]" 1
1530 1 81 HIS H 1 92 ILE HA 3.320 . 5.068 4.730 4.386 5.036 . 0 0 "[ . 1 . 2]" 1
1531 1 81 HIS H 1 92 ILE HB 2.980 . 4.337 3.843 3.558 4.233 . 0 0 "[ . 1 . 2]" 1
1532 1 81 HIS H 1 92 ILE MD 3.650 . 5.778 5.187 4.724 5.697 . 0 0 "[ . 1 . 2]" 1
1533 1 81 HIS H 1 93 LYS H 2.725 . 3.789 2.538 2.311 2.831 . 0 0 "[ . 1 . 2]" 1
1534 1 81 HIS H 1 93 LYS HB2 2.885 . 4.133 2.689 2.149 3.067 . 0 0 "[ . 1 . 2]" 1
1535 1 81 HIS H 1 93 LYS QD 3.480 . 5.412 4.541 3.932 5.315 . 0 0 "[ . 1 . 2]" 1
1536 1 81 HIS H 1 94 TYR H 3.545 . 5.552 4.955 4.552 5.370 . 0 0 "[ . 1 . 2]" 1
1537 1 81 HIS H 1 94 TYR HA 3.295 . 5.014 4.253 3.949 4.772 . 0 0 "[ . 1 . 2]" 1
1538 1 81 HIS HA 1 82 VAL H 2.440 . 3.176 2.297 2.059 3.425 0.249 9 0 "[ . 1 . 2]" 1
1539 1 81 HIS HA 1 82 VAL QG 2.745 . 3.832 3.417 3.020 3.601 . 0 0 "[ . 1 . 2]" 1
1540 1 81 HIS HA 1 93 LYS HB2 3.395 . 5.229 4.652 4.226 4.931 . 0 0 "[ . 1 . 2]" 1
1541 1 81 HIS HB2 1 93 LYS H 2.995 . 4.369 3.099 2.720 3.500 . 0 0 "[ . 1 . 2]" 1
1542 1 81 HIS HB2 1 93 LYS HB2 2.410 . 3.112 2.027 1.711 2.360 0.089 16 0 "[ . 1 . 2]" 1
1543 1 81 HIS HB2 1 93 LYS HB3 2.940 . 4.251 3.541 3.183 3.947 . 0 0 "[ . 1 . 2]" 1
1544 1 81 HIS HB2 1 93 LYS HG2 3.020 . 4.423 3.584 2.397 4.440 0.017 6 0 "[ . 1 . 2]" 1
1545 1 81 HIS HB3 1 82 VAL H 2.920 . 4.208 3.101 2.615 3.800 . 0 0 "[ . 1 . 2]" 1
1546 1 81 HIS HB3 1 82 VAL QG 3.435 . 5.315 4.455 4.144 4.811 . 0 0 "[ . 1 . 2]" 1
1547 1 81 HIS HB3 1 83 ILE H 3.315 . 5.057 4.980 4.674 5.367 0.310 10 0 "[ . 1 . 2]" 1
1548 1 81 HIS HB3 1 83 ILE HG12 3.330 . 5.089 5.143 4.536 5.446 0.356 6 0 "[ . 1 . 2]" 1
1549 1 81 HIS HB3 1 83 ILE HG13 3.095 . 4.584 4.651 4.399 4.881 0.297 6 0 "[ . 1 . 2]" 1
1550 1 81 HIS HB3 1 93 LYS H 2.890 . 4.143 4.183 4.044 4.434 0.290 11 0 "[ . 1 . 2]" 1
1551 1 81 HIS HB3 1 93 LYS HB3 3.485 . 5.423 5.204 4.841 5.458 0.036 17 0 "[ . 1 . 2]" 1
1552 1 81 HIS HD2 1 82 VAL H 3.650 . 5.778 5.423 4.502 6.104 0.326 6 0 "[ . 1 . 2]" 1
1553 1 81 HIS HD2 1 93 LYS HB2 3.370 . 5.175 4.103 2.313 5.216 0.040 13 0 "[ . 1 . 2]" 1
1554 1 81 HIS HD2 1 93 LYS HB3 3.650 . 5.778 4.739 2.356 6.038 0.261 4 0 "[ . 1 . 2]" 1
1555 1 82 VAL H 1 82 VAL HB 2.440 . 3.176 3.129 2.683 3.686 0.510 15 1 "[ . 1 + 2]" 1
1556 1 82 VAL H 1 82 VAL MG1 2.850 . 4.057 2.272 1.905 3.861 . 0 0 "[ . 1 . 2]" 1
1557 1 82 VAL H 1 82 VAL QG 2.340 . 2.961 2.075 1.900 3.020 0.059 9 0 "[ . 1 . 2]" 1
1558 1 82 VAL H 1 82 VAL MG2 2.850 . 4.057 3.492 1.986 3.991 . 0 0 "[ . 1 . 2]" 1
1559 1 82 VAL H 1 83 ILE H 3.060 . 4.509 4.206 3.514 4.390 . 0 0 "[ . 1 . 2]" 1
1560 1 82 VAL H 1 92 ILE HB 3.505 . 5.466 4.743 2.732 5.246 . 0 0 "[ . 1 . 2]" 1
1561 1 82 VAL H 1 93 LYS H 3.650 . 5.778 4.723 2.541 5.093 . 0 0 "[ . 1 . 2]" 1
1562 1 82 VAL HA 1 82 VAL MG1 2.520 . 3.348 3.054 2.329 3.249 . 0 0 "[ . 1 . 2]" 1
1563 1 82 VAL HA 1 82 VAL QG 2.205 . 2.671 2.358 2.148 2.448 . 0 0 "[ . 1 . 2]" 1
1564 1 82 VAL HA 1 82 VAL MG2 2.520 . 3.348 2.538 2.383 3.224 . 0 0 "[ . 1 . 2]" 1
1565 1 82 VAL HA 1 83 ILE H 2.290 . 2.853 2.144 2.041 2.235 . 0 0 "[ . 1 . 2]" 1
1566 1 82 VAL HA 1 86 ILE H 3.315 . 5.057 5.059 4.581 5.507 0.450 12 0 "[ . 1 . 2]" 1
1567 1 82 VAL HA 1 86 ILE MD 2.745 . 3.832 3.840 3.597 4.048 0.216 10 0 "[ . 1 . 2]" 1
1568 1 82 VAL HA 1 92 ILE HB 2.675 . 3.681 2.885 2.066 3.385 . 0 0 "[ . 1 . 2]" 1
1569 1 82 VAL HA 1 92 ILE MD 3.170 . 4.746 4.604 4.342 4.797 0.052 3 0 "[ . 1 . 2]" 1
1570 1 82 VAL HA 1 92 ILE MG 2.685 . 3.703 1.901 1.763 2.129 0.037 9 0 "[ . 1 . 2]" 1
1571 1 82 VAL HA 1 93 LYS H 3.195 . 4.799 3.705 3.471 4.177 . 0 0 "[ . 1 . 2]" 1
1572 1 82 VAL HB 1 86 ILE HA 3.650 . 5.778 5.182 3.991 6.185 0.407 12 0 "[ . 1 . 2]" 1
1573 1 82 VAL HB 1 86 ILE MD 2.845 . 4.047 2.811 2.031 4.191 0.144 12 0 "[ . 1 . 2]" 1
1574 1 82 VAL QG 1 83 ILE H 2.605 . 3.531 2.963 2.581 3.731 0.201 15 0 "[ . 1 . 2]" 1
1575 1 82 VAL QG 1 84 LYS H 2.625 . 3.574 2.876 1.983 4.041 0.468 15 0 "[ . 1 . 2]" 1
1576 1 82 VAL QG 1 85 GLY H 2.590 . 3.499 1.908 1.627 2.796 0.173 16 0 "[ . 1 . 2]" 1
1577 1 82 VAL QG 1 85 GLY HA2 2.345 . 2.972 2.272 1.858 2.566 . 0 0 "[ . 1 . 2]" 1
1578 1 82 VAL QG 1 85 GLY HA3 2.900 . 4.165 3.454 3.150 3.640 . 0 0 "[ . 1 . 2]" 1
1579 1 82 VAL QG 1 86 ILE H 2.730 . 3.799 2.299 1.677 3.722 0.123 18 0 "[ . 1 . 2]" 1
1580 1 82 VAL QG 1 92 ILE HB 3.355 . 5.143 3.758 2.584 4.377 . 0 0 "[ . 1 . 2]" 1
1581 1 82 VAL QG 1 92 ILE MD 3.380 . 5.197 4.147 3.318 4.646 . 0 0 "[ . 1 . 2]" 1
1582 1 82 VAL QG 1 119 TRP HZ2 3.220 . 4.853 4.527 3.965 5.099 0.246 1 0 "[ . 1 . 2]" 1
1583 1 82 VAL MG1 1 83 ILE H 3.050 . 4.488 4.065 2.609 4.334 . 0 0 "[ . 1 . 2]" 1
1584 1 82 VAL MG2 1 83 ILE H 3.050 . 4.488 3.193 2.610 4.322 . 0 0 "[ . 1 . 2]" 1
1585 1 83 ILE H 1 83 ILE HB 2.450 . 3.197 2.449 2.330 2.571 . 0 0 "[ . 1 . 2]" 1
1586 1 83 ILE H 1 83 ILE MD 2.675 . 3.681 3.482 3.318 3.708 0.027 4 0 "[ . 1 . 2]" 1
1587 1 83 ILE H 1 83 ILE HG12 2.765 . 3.875 3.561 3.333 3.777 . 0 0 "[ . 1 . 2]" 1
1588 1 83 ILE H 1 83 ILE HG13 2.575 . 3.466 2.235 1.955 2.519 . 0 0 "[ . 1 . 2]" 1
1589 1 83 ILE H 1 83 ILE MG 2.800 . 3.950 3.749 3.690 3.814 . 0 0 "[ . 1 . 2]" 1
1590 1 83 ILE H 1 92 ILE HA 2.810 . 3.971 2.729 2.278 3.221 . 0 0 "[ . 1 . 2]" 1
1591 1 83 ILE H 1 92 ILE HB 3.060 . 4.509 4.316 3.571 4.783 0.274 19 0 "[ . 1 . 2]" 1
1592 1 83 ILE H 1 92 ILE MG 2.550 . 3.412 2.791 2.550 3.077 . 0 0 "[ . 1 . 2]" 1
1593 1 83 ILE H 1 93 LYS H 3.280 . 4.982 4.520 3.910 5.059 0.077 19 0 "[ . 1 . 2]" 1
1594 1 83 ILE HA 1 83 ILE MD 2.900 . 4.165 3.840 3.780 3.911 . 0 0 "[ . 1 . 2]" 1
1595 1 83 ILE HA 1 83 ILE HG12 2.330 . 2.940 2.595 2.500 2.686 . 0 0 "[ . 1 . 2]" 1
1596 1 83 ILE HA 1 83 ILE HG13 2.365 . 3.015 2.926 2.776 3.024 0.009 1 0 "[ . 1 . 2]" 1
1597 1 83 ILE HA 1 83 ILE MG 2.175 . 2.606 2.444 2.366 2.514 . 0 0 "[ . 1 . 2]" 1
1598 1 83 ILE HA 1 84 LYS QE 3.455 . 5.358 5.390 5.066 5.683 0.324 10 0 "[ . 1 . 2]" 1
1599 1 83 ILE HB 1 83 ILE MD 2.100 . 2.445 2.336 2.192 2.464 0.019 10 0 "[ . 1 . 2]" 1
1600 1 83 ILE HB 1 83 ILE HG13 2.185 . 2.628 2.509 2.485 2.560 . 0 0 "[ . 1 . 2]" 1
1601 1 83 ILE HB 1 84 LYS H 2.455 . 3.208 2.382 1.868 2.642 . 0 0 "[ . 1 . 2]" 1
1602 1 83 ILE HB 1 90 SER HA 3.410 . 5.261 4.664 3.864 5.308 0.046 1 0 "[ . 1 . 2]" 1
1603 1 83 ILE HB 1 91 GLN H 2.490 . 3.283 3.077 2.671 3.359 0.076 16 0 "[ . 1 . 2]" 1
1604 1 83 ILE MD 1 84 LYS H 2.900 . 4.165 4.309 3.817 4.537 0.372 8 0 "[ . 1 . 2]" 1
1605 1 83 ILE MD 1 91 GLN HA 3.185 . 4.778 4.301 4.059 4.503 . 0 0 "[ . 1 . 2]" 1
1606 1 83 ILE MD 1 91 GLN HB2 2.855 . 4.068 3.798 3.478 4.132 0.063 6 0 "[ . 1 . 2]" 1
1607 1 83 ILE MD 1 91 GLN HB3 2.440 . 3.176 2.268 1.890 2.692 . 0 0 "[ . 1 . 2]" 1
1608 1 83 ILE MD 1 91 GLN HG2 2.205 . 2.671 2.649 1.951 2.908 0.238 19 0 "[ . 1 . 2]" 1
1609 1 83 ILE MD 1 91 GLN HG3 2.875 . 4.111 4.042 3.416 4.184 0.073 16 0 "[ . 1 . 2]" 1
1610 1 83 ILE MD 1 92 ILE HA 2.805 . 3.961 3.591 3.265 3.939 . 0 0 "[ . 1 . 2]" 1
1611 1 83 ILE MD 1 93 LYS QE 2.170 . 2.595 1.884 1.676 2.448 0.124 1 0 "[ . 1 . 2]" 1
1612 1 83 ILE HG12 1 83 ILE MG 2.100 . 2.445 2.346 2.290 2.427 . 0 0 "[ . 1 . 2]" 1
1613 1 83 ILE HG12 1 84 LYS H 3.300 . 5.025 4.927 4.638 5.079 0.054 8 0 "[ . 1 . 2]" 1
1614 1 83 ILE HG12 1 93 LYS QE 2.630 . 3.585 3.366 2.559 3.791 0.206 2 0 "[ . 1 . 2]" 1
1615 1 83 ILE HG13 1 84 LYS H 3.060 . 4.509 4.233 3.910 4.417 . 0 0 "[ . 1 . 2]" 1
1616 1 83 ILE HG13 1 91 GLN HG2 2.990 . 4.359 4.435 4.000 4.710 0.352 2 0 "[ . 1 . 2]" 1
1617 1 83 ILE HG13 1 93 LYS QE 2.460 . 3.219 3.161 1.995 3.477 0.258 2 0 "[ . 1 . 2]" 1
1618 1 83 ILE MG 1 84 LYS H 2.490 . 3.283 3.140 2.486 3.342 0.058 9 0 "[ . 1 . 2]" 1
1619 1 83 ILE MG 1 84 LYS HA 2.595 . 3.509 3.159 2.839 3.384 . 0 0 "[ . 1 . 2]" 1
1620 1 83 ILE MG 1 84 LYS QD 2.810 . 3.971 2.489 2.251 2.945 . 0 0 "[ . 1 . 2]" 1
1621 1 83 ILE MG 1 84 LYS QE 2.175 . 2.606 2.268 1.995 2.970 0.363 20 0 "[ . 1 . 2]" 1
1622 1 83 ILE MG 1 84 LYS QG 2.225 . 2.714 2.310 1.917 2.632 . 0 0 "[ . 1 . 2]" 1
1623 1 84 LYS H 1 84 LYS HB2 2.560 . 3.434 2.532 2.332 2.689 . 0 0 "[ . 1 . 2]" 1
1624 1 84 LYS H 1 84 LYS HB3 2.700 . 3.735 3.697 3.558 3.801 0.066 20 0 "[ . 1 . 2]" 1
1625 1 84 LYS H 1 84 LYS QG 2.515 . 3.337 2.627 2.157 2.938 . 0 0 "[ . 1 . 2]" 1
1626 1 84 LYS H 1 85 GLY H 2.525 . 3.359 2.451 1.875 2.797 . 0 0 "[ . 1 . 2]" 1
1627 1 84 LYS H 1 90 SER HA 3.170 . 4.746 4.214 3.453 4.751 0.005 6 0 "[ . 1 . 2]" 1
1628 1 84 LYS H 1 91 GLN H 3.650 . 5.778 3.450 2.586 3.843 . 0 0 "[ . 1 . 2]" 1
1629 1 84 LYS H 1 92 ILE MG 3.040 . 4.466 3.783 3.278 4.365 . 0 0 "[ . 1 . 2]" 1
1630 1 84 LYS HA 1 84 LYS HB3 2.180 . 2.617 2.461 2.436 2.491 . 0 0 "[ . 1 . 2]" 1
1631 1 84 LYS HA 1 84 LYS QD 2.240 . 2.746 1.965 1.873 2.038 . 0 0 "[ . 1 . 2]" 1
1632 1 84 LYS HA 1 84 LYS QE 2.630 . 3.585 3.891 3.617 3.983 0.398 20 0 "[ . 1 . 2]" 1
1633 1 84 LYS HA 1 84 LYS QG 2.425 . 3.144 2.848 2.788 2.924 . 0 0 "[ . 1 . 2]" 1
1634 1 84 LYS HB2 1 84 LYS HG2 2.185 . 2.628 2.469 2.420 2.505 . 0 0 "[ . 1 . 2]" 1
1635 1 84 LYS HB2 1 84 LYS HG3 2.185 . 2.628 2.402 2.370 2.433 . 0 0 "[ . 1 . 2]" 1
1636 1 84 LYS HB2 1 86 ILE HA 3.650 . 5.778 4.877 3.719 5.957 0.180 1 0 "[ . 1 . 2]" 1
1637 1 84 LYS HB2 1 90 SER QB 2.700 . 3.735 2.276 1.744 2.977 0.056 6 0 "[ . 1 . 2]" 1
1638 1 84 LYS HB3 1 84 LYS QG 2.185 . 2.628 2.354 2.336 2.379 . 0 0 "[ . 1 . 2]" 1
1639 1 84 LYS HB3 1 90 SER HA 3.230 . 4.874 3.607 2.558 4.315 . 0 0 "[ . 1 . 2]" 1
1640 1 84 LYS QD 1 84 LYS QE 2.050 . 2.338 2.068 1.955 2.101 . 0 0 "[ . 1 . 2]" 1
1641 1 84 LYS QE 1 84 LYS QG 2.145 . 2.542 2.139 2.064 2.487 . 0 0 "[ . 1 . 2]" 1
1642 1 84 LYS QE 1 90 SER HA 3.570 . 5.606 4.271 3.548 5.182 . 0 0 "[ . 1 . 2]" 1
1643 1 84 LYS QG 1 90 SER HA 3.010 . 4.402 2.322 1.777 2.696 0.023 2 0 "[ . 1 . 2]" 1
1644 1 84 LYS QG 1 91 GLN H 3.485 . 5.423 2.826 2.277 3.249 . 0 0 "[ . 1 . 2]" 1
1645 1 85 GLY H 1 85 GLY HA2 2.325 . 2.929 2.402 2.334 2.600 . 0 0 "[ . 1 . 2]" 1
1646 1 85 GLY H 1 86 ILE H 2.610 . 3.542 2.540 1.826 3.972 0.430 1 0 "[ . 1 . 2]" 1
1647 1 85 GLY H 1 87 GLN H 3.310 . 5.047 5.147 4.480 5.378 0.331 14 0 "[ . 1 . 2]" 1
1648 1 85 GLY HA2 1 86 ILE H 2.470 . 3.240 3.007 2.137 3.293 0.052 16 0 "[ . 1 . 2]" 1
1649 1 85 GLY HA2 1 86 ILE HB 3.235 . 4.885 4.432 4.319 4.778 . 0 0 "[ . 1 . 2]" 1
1650 1 86 ILE H 1 86 ILE HB 2.945 . 4.262 3.525 2.534 3.761 . 0 0 "[ . 1 . 2]" 1
1651 1 86 ILE H 1 86 ILE MD 2.770 . 3.885 3.080 2.727 4.111 0.225 2 0 "[ . 1 . 2]" 1
1652 1 86 ILE H 1 86 ILE MG 2.895 . 4.154 4.037 3.763 4.158 0.004 16 0 "[ . 1 . 2]" 1
1653 1 86 ILE H 1 87 GLN H 2.515 . 3.337 3.168 2.768 3.902 0.565 12 1 "[ . 1 + . 2]" 1
1654 1 86 ILE H 1 87 GLN QB 3.335 . 5.100 4.425 3.930 5.116 0.016 10 0 "[ . 1 . 2]" 1
1655 1 86 ILE H 1 91 GLN H 3.575 . 5.616 5.605 5.065 6.060 0.443 1 0 "[ . 1 . 2]" 1
1656 1 86 ILE H 1 119 TRP HZ2 3.465 . 5.380 4.961 4.507 5.395 0.015 2 0 "[ . 1 . 2]" 1
1657 1 86 ILE HA 1 86 ILE MD 2.610 . 3.542 2.139 1.918 3.706 0.164 2 0 "[ . 1 . 2]" 1
1658 1 86 ILE HA 1 86 ILE MG 2.605 . 3.531 2.439 2.325 2.546 . 0 0 "[ . 1 . 2]" 1
1659 1 86 ILE HA 1 87 GLN HA 3.155 . 4.713 4.334 4.127 4.745 0.032 1 0 "[ . 1 . 2]" 1
1660 1 86 ILE HA 1 87 GLN QB 3.295 . 5.014 4.424 4.131 5.075 0.060 1 0 "[ . 1 . 2]" 1
1661 1 86 ILE HA 1 119 TRP HH2 3.190 . 4.788 2.663 2.060 3.137 . 0 0 "[ . 1 . 2]" 1
1662 1 86 ILE HB 1 86 ILE MD 2.610 . 3.542 3.191 2.304 3.257 . 0 0 "[ . 1 . 2]" 1
1663 1 86 ILE HB 1 119 TRP HZ2 3.075 . 4.541 4.595 4.216 4.884 0.343 7 0 "[ . 1 . 2]" 1
1664 1 86 ILE MD 1 92 ILE MD 2.980 . 4.337 2.998 2.597 3.556 . 0 0 "[ . 1 . 2]" 1
1665 1 86 ILE MD 1 119 TRP HD1 3.650 . 5.778 5.769 5.306 6.140 0.362 2 0 "[ . 1 . 2]" 1
1666 1 86 ILE MD 1 119 TRP HE1 3.185 . 4.778 3.798 3.300 4.227 . 0 0 "[ . 1 . 2]" 1
1667 1 86 ILE MD 1 119 TRP HH2 2.860 . 4.079 2.654 2.209 3.717 . 0 0 "[ . 1 . 2]" 1
1668 1 86 ILE MD 1 119 TRP HZ2 2.705 . 3.746 2.104 1.815 2.818 . 0 0 "[ . 1 . 2]" 1
1669 1 86 ILE MG 1 87 GLN H 2.830 . 4.015 3.610 3.330 3.787 . 0 0 "[ . 1 . 2]" 1
1670 1 86 ILE MG 1 87 GLN HA 2.905 . 4.176 3.603 3.150 3.877 . 0 0 "[ . 1 . 2]" 1
1671 1 86 ILE MG 1 92 ILE MD 3.210 . 4.832 4.489 4.050 4.972 0.141 12 0 "[ . 1 . 2]" 1
1672 1 86 ILE MG 1 119 TRP HE1 2.910 . 4.187 3.382 2.948 3.695 . 0 0 "[ . 1 . 2]" 1
1673 1 86 ILE MG 1 119 TRP HH2 2.785 . 3.918 3.687 3.264 3.933 0.016 15 0 "[ . 1 . 2]" 1
1674 1 86 ILE MG 1 119 TRP HZ2 2.705 . 3.746 1.941 1.778 2.125 0.022 2 0 "[ . 1 . 2]" 1
1675 1 87 GLN H 1 87 GLN QB 2.515 . 3.337 2.763 2.231 3.324 . 0 0 "[ . 1 . 2]" 1
1676 1 87 GLN H 1 88 PHE H 3.135 . 4.670 4.391 4.238 4.536 . 0 0 "[ . 1 . 2]" 1
1677 1 87 GLN H 1 90 SER H 2.970 . 4.315 3.783 3.422 4.770 0.454 1 0 "[ . 1 . 2]" 1
1678 1 87 GLN H 1 91 GLN H 3.650 . 5.778 5.571 5.162 5.837 0.059 17 0 "[ . 1 . 2]" 1
1679 1 87 GLN H 1 92 ILE MG 3.410 . 5.261 4.785 4.486 5.322 0.060 1 0 "[ . 1 . 2]" 1
1680 1 87 GLN H 1 119 TRP HH2 3.110 . 4.616 3.554 2.980 4.647 0.030 1 0 "[ . 1 . 2]" 1
1681 1 87 GLN H 1 119 TRP HZ2 3.650 . 5.778 4.269 3.832 5.199 . 0 0 "[ . 1 . 2]" 1
1682 1 87 GLN HA 1 88 PHE HA 3.185 . 4.778 4.385 4.264 4.535 . 0 0 "[ . 1 . 2]" 1
1683 1 87 GLN HA 1 88 PHE HB2 3.415 . 5.272 4.857 4.719 5.032 . 0 0 "[ . 1 . 2]" 1
1684 1 87 GLN HA 1 117 VAL MG2 3.050 . 4.488 4.250 3.294 4.675 0.187 5 0 "[ . 1 . 2]" 1
1685 1 87 GLN QB 1 87 GLN HE22 2.980 . 4.337 4.122 3.089 4.397 0.060 13 0 "[ . 1 . 2]" 1
1686 1 87 GLN QB 1 88 PHE H 2.555 . 3.423 3.005 1.831 3.397 . 0 0 "[ . 1 . 2]" 1
1687 1 87 GLN QB 1 88 PHE HB2 3.340 . 5.111 5.285 4.252 5.662 0.551 20 1 "[ . 1 . +]" 1
1688 1 87 GLN HB2 1 87 GLN HE21 2.995 . 4.369 4.190 1.657 4.483 0.143 4 0 "[ . 1 . 2]" 1
1689 1 87 GLN HB2 1 88 PHE H 2.935 . 4.240 3.710 1.839 3.981 . 0 0 "[ . 1 . 2]" 1
1690 1 87 GLN HB3 1 87 GLN HE21 2.995 . 4.369 4.043 1.656 4.498 0.144 18 0 "[ . 1 . 2]" 1
1691 1 87 GLN HB3 1 88 PHE H 2.935 . 4.240 3.285 1.878 3.735 . 0 0 "[ . 1 . 2]" 1
1692 1 87 GLN HE21 1 88 PHE HB3 2.795 . 3.939 2.983 2.011 4.014 0.074 7 0 "[ . 1 . 2]" 1
1693 1 87 GLN HE21 1 117 VAL MG1 3.420 . 5.283 4.783 3.995 5.432 0.149 18 0 "[ . 1 . 2]" 1
1694 1 87 GLN HE21 1 117 VAL MG2 3.650 . 5.778 5.186 4.275 6.108 0.331 16 0 "[ . 1 . 2]" 1
1695 1 87 GLN HE22 1 88 PHE HB3 3.005 . 4.391 4.255 2.954 4.826 0.435 19 0 "[ . 1 . 2]" 1
1696 1 87 GLN HE22 1 117 VAL MG1 3.650 . 5.778 5.364 3.952 6.496 0.718 16 2 "[ . - 1 .+ 2]" 1
1697 1 88 PHE H 1 88 PHE HB2 2.570 . 3.455 2.620 2.539 2.709 . 0 0 "[ . 1 . 2]" 1
1698 1 88 PHE H 1 88 PHE HB3 2.585 . 3.488 2.364 2.276 2.459 . 0 0 "[ . 1 . 2]" 1
1699 1 88 PHE H 1 88 PHE QD 3.010 . 4.402 4.163 4.116 4.248 . 0 0 "[ . 1 . 2]" 1
1700 1 88 PHE H 1 89 GLY H 3.210 . 4.832 4.529 4.463 4.586 . 0 0 "[ . 1 . 2]" 1
1701 1 88 PHE H 1 117 VAL MG1 2.995 . 4.369 3.919 3.025 4.470 0.101 6 0 "[ . 1 . 2]" 1
1702 1 88 PHE H 1 117 VAL MG2 3.115 . 4.627 3.986 3.429 4.455 . 0 0 "[ . 1 . 2]" 1
1703 1 88 PHE HA 1 88 PHE QD 2.815 . 3.982 2.453 2.233 2.664 . 0 0 "[ . 1 . 2]" 1
1704 1 88 PHE HA 1 88 PHE QE 3.135 . 4.670 4.603 4.514 4.708 0.038 12 0 "[ . 1 . 2]" 1
1705 1 88 PHE HA 1 89 GLY H 2.400 . 3.090 2.112 2.047 2.170 . 0 0 "[ . 1 . 2]" 1
1706 1 88 PHE HA 1 112 ILE H 3.650 . 5.778 6.031 5.739 6.341 0.564 20 1 "[ . 1 . +]" 1
1707 1 88 PHE HA 1 112 ILE MD 3.410 . 5.261 4.284 3.728 4.743 . 0 0 "[ . 1 . 2]" 1
1708 1 88 PHE HA 1 117 VAL MG1 3.500 . 5.455 3.720 3.210 4.054 . 0 0 "[ . 1 . 2]" 1
1709 1 88 PHE HA 1 117 VAL MG2 3.060 . 4.509 4.205 3.554 4.539 0.030 14 0 "[ . 1 . 2]" 1
1710 1 88 PHE HB2 1 89 GLY H 3.080 . 4.552 4.056 3.892 4.205 . 0 0 "[ . 1 . 2]" 1
1711 1 88 PHE HB2 1 112 ILE MD 2.600 . 3.520 2.899 2.175 3.437 . 0 0 "[ . 1 . 2]" 1
1712 1 88 PHE HB2 1 117 VAL HB 3.105 . 4.606 3.493 3.112 4.194 . 0 0 "[ . 1 . 2]" 1
1713 1 88 PHE HB2 1 117 VAL MG1 2.660 . 3.649 2.217 1.780 2.612 0.020 16 0 "[ . 1 . 2]" 1
1714 1 88 PHE HB2 1 117 VAL MG2 2.685 . 3.703 3.552 2.837 3.908 0.206 4 0 "[ . 1 . 2]" 1
1715 1 88 PHE HB3 1 89 GLY H 3.180 . 4.767 4.214 4.126 4.329 . 0 0 "[ . 1 . 2]" 1
1716 1 88 PHE HB3 1 117 VAL MG1 3.010 . 4.402 3.603 3.094 4.167 . 0 0 "[ . 1 . 2]" 1
1717 1 88 PHE HB3 1 117 VAL MG2 3.340 . 5.111 4.804 4.123 5.149 0.038 6 0 "[ . 1 . 2]" 1
1718 1 88 PHE QD 1 89 GLY H 2.685 . 3.703 2.729 2.411 3.212 . 0 0 "[ . 1 . 2]" 1
1719 1 88 PHE QD 1 90 SER H 3.255 . 4.928 4.805 4.393 5.022 0.094 3 0 "[ . 1 . 2]" 1
1720 1 88 PHE QD 1 110 CYS QB 2.965 . 4.305 3.668 2.667 4.444 0.140 12 0 "[ . 1 . 2]" 1
1721 1 88 PHE QD 1 111 ILE HB 3.455 . 5.358 4.713 4.217 5.283 . 0 0 "[ . 1 . 2]" 1
1722 1 88 PHE QD 1 111 ILE MD 3.650 . 5.778 5.210 4.931 5.453 . 0 0 "[ . 1 . 2]" 1
1723 1 88 PHE QD 1 111 ILE MG 3.055 . 4.498 4.173 3.685 4.590 0.091 20 0 "[ . 1 . 2]" 1
1724 1 88 PHE QD 1 112 ILE H 2.960 . 4.294 3.622 3.253 4.047 . 0 0 "[ . 1 . 2]" 1
1725 1 88 PHE QD 1 112 ILE HA 3.355 . 5.143 4.308 3.926 4.580 . 0 0 "[ . 1 . 2]" 1
1726 1 88 PHE QD 1 112 ILE HB 3.650 . 5.778 5.335 4.929 5.571 . 0 0 "[ . 1 . 2]" 1
1727 1 88 PHE QD 1 112 ILE MD 2.550 . 3.412 2.695 2.370 3.174 . 0 0 "[ . 1 . 2]" 1
1728 1 88 PHE QD 1 112 ILE HG12 2.985 . 4.348 3.384 2.864 3.715 . 0 0 "[ . 1 . 2]" 1
1729 1 88 PHE QD 1 112 ILE HG13 3.320 . 5.068 4.500 3.973 4.914 . 0 0 "[ . 1 . 2]" 1
1730 1 88 PHE QD 1 117 VAL MG1 2.680 . 3.692 3.163 2.451 3.613 . 0 0 "[ . 1 . 2]" 1
1731 1 88 PHE QD 1 117 VAL MG2 3.410 . 5.261 4.665 4.104 5.167 . 0 0 "[ . 1 . 2]" 1
1732 1 88 PHE QE 1 89 GLY H 3.215 . 4.842 4.040 3.878 4.335 . 0 0 "[ . 1 . 2]" 1
1733 1 88 PHE QE 1 89 GLY HA3 3.385 . 5.208 4.853 4.339 5.185 . 0 0 "[ . 1 . 2]" 1
1734 1 88 PHE QE 1 109 THR MG 3.650 . 5.778 5.262 4.946 5.627 . 0 0 "[ . 1 . 2]" 1
1735 1 88 PHE QE 1 111 ILE H 3.640 . 5.756 4.816 4.584 5.170 . 0 0 "[ . 1 . 2]" 1
1736 1 88 PHE QE 1 111 ILE HA 2.990 . 4.359 1.987 1.776 2.357 0.024 9 0 "[ . 1 . 2]" 1
1737 1 88 PHE QE 1 111 ILE MD 3.650 . 5.778 5.152 4.723 5.424 . 0 0 "[ . 1 . 2]" 1
1738 1 88 PHE QE 1 112 ILE H 2.645 . 3.617 2.392 1.877 3.097 . 0 0 "[ . 1 . 2]" 1
1739 1 88 PHE QE 1 112 ILE HA 3.425 . 5.294 4.555 4.137 5.063 . 0 0 "[ . 1 . 2]" 1
1740 1 88 PHE QE 1 112 ILE HB 3.190 . 4.788 4.268 3.694 4.809 0.020 19 0 "[ . 1 . 2]" 1
1741 1 88 PHE QE 1 112 ILE MD 2.460 . 3.219 3.221 2.879 3.453 0.234 4 0 "[ . 1 . 2]" 1
1742 1 88 PHE QE 1 112 ILE HG12 2.790 . 3.928 2.518 2.110 2.945 . 0 0 "[ . 1 . 2]" 1
1743 1 88 PHE QE 1 112 ILE HG13 3.025 . 4.434 3.825 3.489 4.186 . 0 0 "[ . 1 . 2]" 1
1744 1 88 PHE QE 1 112 ILE MG 3.325 . 5.079 4.858 4.635 5.105 0.026 7 0 "[ . 1 . 2]" 1
1745 1 88 PHE QE 1 117 VAL MG1 3.530 . 5.519 4.423 3.878 4.979 . 0 0 "[ . 1 . 2]" 1
1746 1 89 GLY H 1 90 SER H 2.520 . 3.348 2.468 2.199 2.617 . 0 0 "[ . 1 . 2]" 1
1747 1 89 GLY H 1 109 THR MG 3.235 . 4.885 4.056 3.449 4.394 . 0 0 "[ . 1 . 2]" 1
1748 1 89 GLY H 1 110 CYS H 3.085 . 4.563 3.861 3.607 4.178 . 0 0 "[ . 1 . 2]" 1
1749 1 89 GLY H 1 110 CYS QB 2.785 . 3.918 2.692 1.971 3.757 . 0 0 "[ . 1 . 2]" 1
1750 1 89 GLY H 1 111 ILE H 3.650 . 5.778 4.957 4.677 5.158 . 0 0 "[ . 1 . 2]" 1
1751 1 89 GLY H 1 111 ILE MD 3.650 . 5.778 5.739 5.445 5.930 0.152 4 0 "[ . 1 . 2]" 1
1752 1 89 GLY H 1 111 ILE MG 3.435 . 5.315 4.398 3.844 4.983 . 0 0 "[ . 1 . 2]" 1
1753 1 89 GLY H 1 117 VAL HB 3.490 . 5.433 5.386 5.029 5.678 0.245 19 0 "[ . 1 . 2]" 1
1754 1 89 GLY H 1 117 VAL MG1 3.470 . 5.391 5.151 4.643 5.462 0.071 14 0 "[ . 1 . 2]" 1
1755 1 89 GLY HA2 1 109 THR MG 2.935 . 4.240 3.546 3.022 4.031 . 0 0 "[ . 1 . 2]" 1
1756 1 90 SER H 1 90 SER QB 2.205 . 2.671 2.419 2.266 2.668 . 0 0 "[ . 1 . 2]" 1
1757 1 90 SER H 1 91 GLN H 3.240 . 4.896 4.551 4.394 4.609 . 0 0 "[ . 1 . 2]" 1
1758 1 90 SER H 1 109 THR HA 3.650 . 5.778 5.324 4.655 5.634 . 0 0 "[ . 1 . 2]" 1
1759 1 90 SER H 1 109 THR MG 3.275 . 4.971 4.459 3.481 4.895 . 0 0 "[ . 1 . 2]" 1
1760 1 90 SER H 1 110 CYS H 2.740 . 3.821 3.661 3.022 3.934 0.113 10 0 "[ . 1 . 2]" 1
1761 1 90 SER H 1 110 CYS QB 2.695 . 3.724 2.804 2.258 3.469 . 0 0 "[ . 1 . 2]" 1
1762 1 90 SER H 1 119 TRP HH2 3.650 . 5.778 4.832 4.423 5.379 . 0 0 "[ . 1 . 2]" 1
1763 1 90 SER H 1 119 TRP HZ3 3.445 . 5.337 4.791 4.416 5.296 . 0 0 "[ . 1 . 2]" 1
1764 1 90 SER HA 1 91 GLN H 2.225 . 2.714 2.226 2.104 2.493 . 0 0 "[ . 1 . 2]" 1
1765 1 90 SER HA 1 91 GLN HA 3.195 . 4.799 4.388 4.324 4.486 . 0 0 "[ . 1 . 2]" 1
1766 1 90 SER HA 1 91 GLN HB2 3.580 . 5.627 4.404 4.179 4.555 . 0 0 "[ . 1 . 2]" 1
1767 1 90 SER HA 1 109 THR MG 3.330 . 5.089 4.838 4.144 5.252 0.162 11 0 "[ . 1 . 2]" 1
1768 1 90 SER QB 1 91 GLN H 2.780 . 3.907 2.854 2.282 3.577 . 0 0 "[ . 1 . 2]" 1
1769 1 90 SER QB 1 92 ILE MD 3.570 . 5.606 5.090 4.287 5.911 0.305 13 0 "[ . 1 . 2]" 1
1770 1 90 SER QB 1 92 ILE MG 3.105 . 4.606 3.424 2.887 4.192 . 0 0 "[ . 1 . 2]" 1
1771 1 90 SER QB 1 109 THR HA 3.570 . 5.606 5.105 4.789 5.382 . 0 0 "[ . 1 . 2]" 1
1772 1 90 SER QB 1 110 CYS H 2.975 . 4.326 4.042 3.612 4.626 0.300 15 0 "[ . 1 . 2]" 1
1773 1 90 SER QB 1 119 TRP HH2 3.115 . 4.627 2.596 2.021 3.357 . 0 0 "[ . 1 . 2]" 1
1774 1 90 SER QB 1 119 TRP HZ2 3.380 . 5.197 4.284 3.524 5.188 . 0 0 "[ . 1 . 2]" 1
1775 1 91 GLN H 1 91 GLN HB2 2.705 . 3.746 3.156 3.026 3.365 . 0 0 "[ . 1 . 2]" 1
1776 1 91 GLN H 1 91 GLN HB3 2.435 . 3.165 2.679 2.509 2.937 . 0 0 "[ . 1 . 2]" 1
1777 1 91 GLN H 1 91 GLN HG2 3.160 . 4.724 4.393 4.301 4.562 . 0 0 "[ . 1 . 2]" 1
1778 1 91 GLN H 1 92 ILE H 3.145 . 4.692 4.294 4.097 4.394 . 0 0 "[ . 1 . 2]" 1
1779 1 91 GLN H 1 92 ILE HA 3.585 . 5.638 4.778 4.525 4.902 . 0 0 "[ . 1 . 2]" 1
1780 1 91 GLN H 1 92 ILE MG 3.175 . 4.756 3.852 3.369 4.106 . 0 0 "[ . 1 . 2]" 1
1781 1 91 GLN H 1 109 THR HA 3.380 . 5.197 4.839 4.472 5.045 . 0 0 "[ . 1 . 2]" 1
1782 1 91 GLN H 1 109 THR MG 3.410 . 5.261 4.811 4.178 5.070 . 0 0 "[ . 1 . 2]" 1
1783 1 91 GLN H 1 110 CYS QB 3.570 . 5.606 5.557 5.315 5.894 0.289 17 0 "[ . 1 . 2]" 1
1784 1 91 GLN H 1 119 TRP HH2 3.650 . 5.778 4.580 3.718 5.026 . 0 0 "[ . 1 . 2]" 1
1785 1 91 GLN H 1 119 TRP HZ3 3.590 . 5.648 4.126 3.435 4.464 . 0 0 "[ . 1 . 2]" 1
1786 1 91 GLN HA 1 91 GLN HG2 2.615 . 3.552 3.174 3.043 3.258 . 0 0 "[ . 1 . 2]" 1
1787 1 91 GLN HA 1 91 GLN HG3 2.620 . 3.563 2.556 2.507 2.641 . 0 0 "[ . 1 . 2]" 1
1788 1 91 GLN HA 1 92 ILE H 2.505 . 3.316 2.171 2.081 2.279 . 0 0 "[ . 1 . 2]" 1
1789 1 91 GLN HA 1 92 ILE MD 3.175 . 4.756 4.468 3.303 5.023 0.267 8 0 "[ . 1 . 2]" 1
1790 1 91 GLN HA 1 92 ILE MG 3.115 . 4.627 3.477 3.311 3.644 . 0 0 "[ . 1 . 2]" 1
1791 1 91 GLN HA 1 107 SER QB 3.570 . 5.606 4.851 4.248 5.734 0.128 8 0 "[ . 1 . 2]" 1
1792 1 91 GLN HA 1 108 ALA H 3.430 . 5.305 4.439 4.004 5.332 0.028 1 0 "[ . 1 . 2]" 1
1793 1 91 GLN HA 1 108 ALA MB 3.140 . 4.681 4.463 4.290 4.706 0.025 15 0 "[ . 1 . 2]" 1
1794 1 91 GLN HA 1 109 THR H 3.390 . 5.219 4.814 4.514 5.060 . 0 0 "[ . 1 . 2]" 1
1795 1 91 GLN HA 1 109 THR HA 2.855 . 4.068 2.422 2.146 2.606 . 0 0 "[ . 1 . 2]" 1
1796 1 91 GLN HA 1 109 THR HB 3.650 . 5.778 5.273 4.887 5.492 . 0 0 "[ . 1 . 2]" 1
1797 1 91 GLN HA 1 109 THR MG 2.725 . 3.789 3.653 3.368 3.851 0.063 2 0 "[ . 1 . 2]" 1
1798 1 91 GLN HA 1 110 CYS H 2.830 . 4.015 3.602 3.451 3.842 . 0 0 "[ . 1 . 2]" 1
1799 1 91 GLN HB2 1 91 GLN HG3 2.305 . 2.886 2.488 2.437 2.546 . 0 0 "[ . 1 . 2]" 1
1800 1 91 GLN HB2 1 92 ILE H 2.980 . 4.337 4.091 3.904 4.327 . 0 0 "[ . 1 . 2]" 1
1801 1 91 GLN HB2 1 109 THR HA 2.810 . 3.971 3.405 3.175 3.575 . 0 0 "[ . 1 . 2]" 1
1802 1 91 GLN HB2 1 109 THR MG 2.320 . 2.918 3.003 2.833 3.127 0.209 3 0 "[ . 1 . 2]" 1
1803 1 91 GLN HB2 1 110 CYS H 3.265 . 4.950 4.739 4.440 4.961 0.011 15 0 "[ . 1 . 2]" 1
1804 1 91 GLN HB2 1 119 TRP HZ3 3.160 . 4.724 4.667 4.324 4.857 0.133 14 0 "[ . 1 . 2]" 1
1805 1 91 GLN HB3 1 91 GLN HG2 2.230 . 2.724 2.395 2.324 2.479 . 0 0 "[ . 1 . 2]" 1
1806 1 91 GLN HB3 1 92 ILE H 3.050 . 4.488 4.047 3.853 4.258 . 0 0 "[ . 1 . 2]" 1
1807 1 91 GLN HB3 1 109 THR HA 3.215 . 4.842 4.815 4.634 5.010 0.168 18 0 "[ . 1 . 2]" 1
1808 1 91 GLN HB3 1 119 TRP HZ3 3.545 . 5.552 5.278 4.973 5.491 . 0 0 "[ . 1 . 2]" 1
1809 1 91 GLN HG2 1 92 ILE H 3.015 . 4.412 2.897 2.465 3.423 . 0 0 "[ . 1 . 2]" 1
1810 1 91 GLN HG2 1 92 ILE HA 3.005 . 4.391 3.917 3.661 4.128 . 0 0 "[ . 1 . 2]" 1
1811 1 91 GLN HG2 1 92 ILE MD 3.650 . 5.778 5.627 4.349 6.111 0.334 11 0 "[ . 1 . 2]" 1
1812 1 91 GLN HG2 1 93 LYS QD 2.755 . 3.853 3.350 2.751 4.007 0.153 12 0 "[ . 1 . 2]" 1
1813 1 91 GLN HG2 1 93 LYS QE 2.805 . 3.961 3.692 3.204 4.122 0.161 16 0 "[ . 1 . 2]" 1
1814 1 91 GLN HG2 1 107 SER HA 3.330 . 5.089 4.557 4.092 4.797 . 0 0 "[ . 1 . 2]" 1
1815 1 91 GLN HG2 1 107 SER QB 2.650 . 3.628 2.731 2.005 3.678 0.051 11 0 "[ . 1 . 2]" 1
1816 1 91 GLN HG2 1 108 ALA H 3.295 . 5.014 4.167 3.480 4.987 . 0 0 "[ . 1 . 2]" 1
1817 1 91 GLN HG2 1 109 THR MG 3.375 . 5.186 5.240 5.008 5.397 0.210 6 0 "[ . 1 . 2]" 1
1818 1 91 GLN HG2 1 119 TRP HZ3 3.650 . 5.778 5.327 4.959 5.661 . 0 0 "[ . 1 . 2]" 1
1819 1 91 GLN HG3 1 92 ILE H 2.885 . 4.133 2.813 2.540 3.194 . 0 0 "[ . 1 . 2]" 1
1820 1 91 GLN HG3 1 92 ILE MD 3.625 . 5.724 5.420 4.148 5.964 0.240 8 0 "[ . 1 . 2]" 1
1821 1 91 GLN HG3 1 107 SER HA 3.100 . 4.595 4.617 4.220 4.828 0.233 10 0 "[ . 1 . 2]" 1
1822 1 91 GLN HG3 1 107 SER QB 2.455 . 3.208 2.832 2.358 3.625 0.417 8 0 "[ . 1 . 2]" 1
1823 1 91 GLN HG3 1 108 ALA H 2.900 . 4.165 3.631 2.996 4.372 0.207 1 0 "[ . 1 . 2]" 1
1824 1 91 GLN HG3 1 108 ALA HA 3.340 . 5.111 4.544 4.141 4.806 . 0 0 "[ . 1 . 2]" 1
1825 1 91 GLN HG3 1 109 THR H 3.460 . 5.369 4.619 4.305 4.917 . 0 0 "[ . 1 . 2]" 1
1826 1 91 GLN HG3 1 109 THR HA 2.820 . 3.993 3.380 3.049 3.734 . 0 0 "[ . 1 . 2]" 1
1827 1 91 GLN HG3 1 110 CYS H 3.650 . 5.778 5.409 5.110 5.809 0.032 6 0 "[ . 1 . 2]" 1
1828 1 91 GLN HG3 1 119 TRP HZ3 3.280 . 4.982 4.628 4.204 4.953 . 0 0 "[ . 1 . 2]" 1
1829 1 92 ILE H 1 92 ILE MD 2.875 . 4.111 3.247 1.818 3.884 . 0 0 "[ . 1 . 2]" 1
1830 1 92 ILE H 1 92 ILE MG 2.745 . 3.832 2.843 2.635 3.029 . 0 0 "[ . 1 . 2]" 1
1831 1 92 ILE H 1 93 LYS H 3.140 . 4.681 4.475 4.402 4.542 . 0 0 "[ . 1 . 2]" 1
1832 1 92 ILE H 1 93 LYS HA 3.500 . 5.455 4.791 4.623 4.918 . 0 0 "[ . 1 . 2]" 1
1833 1 92 ILE H 1 107 SER HA 3.130 . 4.660 4.277 3.750 4.563 . 0 0 "[ . 1 . 2]" 1
1834 1 92 ILE H 1 107 SER HB2 3.650 . 5.778 4.470 3.405 5.632 . 0 0 "[ . 1 . 2]" 1
1835 1 92 ILE H 1 107 SER QB 3.280 . 4.982 3.867 3.336 4.823 . 0 0 "[ . 1 . 2]" 1
1836 1 92 ILE H 1 107 SER HB3 3.650 . 5.778 4.749 3.539 5.444 . 0 0 "[ . 1 . 2]" 1
1837 1 92 ILE H 1 108 ALA H 2.680 . 3.692 2.834 2.426 3.539 . 0 0 "[ . 1 . 2]" 1
1838 1 92 ILE H 1 108 ALA HA 3.650 . 5.778 4.792 4.635 4.977 . 0 0 "[ . 1 . 2]" 1
1839 1 92 ILE H 1 108 ALA MB 2.910 . 4.187 3.499 3.214 3.804 . 0 0 "[ . 1 . 2]" 1
1840 1 92 ILE H 1 109 THR H 3.650 . 5.778 5.125 4.883 5.446 . 0 0 "[ . 1 . 2]" 1
1841 1 92 ILE H 1 109 THR HA 3.090 . 4.574 3.847 3.604 4.178 . 0 0 "[ . 1 . 2]" 1
1842 1 92 ILE H 1 109 THR MG 3.515 . 5.487 5.289 5.124 5.594 0.107 2 0 "[ . 1 . 2]" 1
1843 1 92 ILE H 1 110 CYS H 3.550 . 5.563 5.203 4.971 5.467 . 0 0 "[ . 1 . 2]" 1
1844 1 92 ILE H 1 119 TRP HE3 3.450 . 5.347 4.235 3.925 4.551 . 0 0 "[ . 1 . 2]" 1
1845 1 92 ILE H 1 119 TRP HZ3 3.030 . 4.444 3.072 2.620 3.323 . 0 0 "[ . 1 . 2]" 1
1846 1 92 ILE HA 1 92 ILE MD 3.060 . 4.509 4.008 3.561 4.193 . 0 0 "[ . 1 . 2]" 1
1847 1 92 ILE HA 1 92 ILE MG 2.490 . 3.283 2.376 2.220 2.569 . 0 0 "[ . 1 . 2]" 1
1848 1 92 ILE HA 1 93 LYS HA 3.230 . 4.874 4.339 4.180 4.430 . 0 0 "[ . 1 . 2]" 1
1849 1 92 ILE HA 1 93 LYS HB2 3.145 . 4.692 4.435 4.183 4.708 0.016 4 0 "[ . 1 . 2]" 1
1850 1 92 ILE HA 1 93 LYS QE 2.950 . 4.273 4.362 3.065 4.926 0.654 1 1 "[+ . 1 . 2]" 1
1851 1 92 ILE HA 1 108 ALA H 3.650 . 5.778 4.826 4.478 5.337 . 0 0 "[ . 1 . 2]" 1
1852 1 92 ILE HB 1 92 ILE MD 2.555 . 3.423 2.636 2.330 3.250 . 0 0 "[ . 1 . 2]" 1
1853 1 92 ILE HB 1 93 LYS H 2.560 . 3.434 2.436 2.278 2.558 . 0 0 "[ . 1 . 2]" 1
1854 1 92 ILE HB 1 93 LYS QD 3.570 . 5.606 4.660 4.236 5.607 0.002 3 0 "[ . 1 . 2]" 1
1855 1 92 ILE HB 1 108 ALA MB 3.650 . 5.778 4.822 4.234 5.716 . 0 0 "[ . 1 . 2]" 1
1856 1 92 ILE MD 1 92 ILE MG 2.295 . 2.864 1.995 1.836 2.183 . 0 0 "[ . 1 . 2]" 1
1857 1 92 ILE MD 1 93 LYS H 3.145 . 4.692 4.223 4.051 4.358 . 0 0 "[ . 1 . 2]" 1
1858 1 92 ILE MD 1 94 TYR QB 3.650 . 5.778 5.188 4.943 5.456 . 0 0 "[ . 1 . 2]" 1
1859 1 92 ILE MD 1 94 TYR QD 3.520 . 5.498 3.835 3.523 4.249 . 0 0 "[ . 1 . 2]" 1
1860 1 92 ILE MD 1 108 ALA H 2.910 . 4.187 3.497 2.526 4.081 . 0 0 "[ . 1 . 2]" 1
1861 1 92 ILE MD 1 108 ALA HA 3.325 . 5.079 4.724 4.063 5.148 0.069 16 0 "[ . 1 . 2]" 1
1862 1 92 ILE MD 1 108 ALA MB 2.435 . 3.165 2.151 1.767 2.461 0.033 3 0 "[ . 1 . 2]" 1
1863 1 92 ILE MD 1 109 THR H 3.565 . 5.595 5.248 4.498 5.636 0.041 19 0 "[ . 1 . 2]" 1
1864 1 92 ILE MD 1 110 CYS H 3.640 . 5.756 5.455 4.734 5.960 0.204 20 0 "[ . 1 . 2]" 1
1865 1 92 ILE MD 1 119 TRP HB2 3.560 . 5.584 4.675 4.034 5.318 . 0 0 "[ . 1 . 2]" 1
1866 1 92 ILE MD 1 119 TRP HB3 3.095 . 4.584 3.887 3.221 4.422 . 0 0 "[ . 1 . 2]" 1
1867 1 92 ILE MD 1 119 TRP HD1 3.650 . 5.778 4.753 4.336 5.356 . 0 0 "[ . 1 . 2]" 1
1868 1 92 ILE MD 1 119 TRP HE1 3.170 . 4.746 4.191 3.799 4.697 . 0 0 "[ . 1 . 2]" 1
1869 1 92 ILE MD 1 119 TRP HE3 2.990 . 4.359 3.424 2.774 4.021 . 0 0 "[ . 1 . 2]" 1
1870 1 92 ILE MD 1 119 TRP HH2 3.315 . 5.057 3.304 2.717 3.795 . 0 0 "[ . 1 . 2]" 1
1871 1 92 ILE MD 1 119 TRP HZ2 2.810 . 3.971 3.435 2.970 3.770 . 0 0 "[ . 1 . 2]" 1
1872 1 92 ILE MD 1 119 TRP HZ3 2.830 . 4.015 3.363 2.503 3.872 . 0 0 "[ . 1 . 2]" 1
1873 1 92 ILE MG 1 93 LYS H 3.015 . 4.412 3.749 3.630 3.900 . 0 0 "[ . 1 . 2]" 1
1874 1 92 ILE MG 1 109 THR HA 3.510 . 5.477 4.996 4.850 5.336 . 0 0 "[ . 1 . 2]" 1
1875 1 92 ILE MG 1 110 CYS H 3.490 . 5.433 5.133 4.929 5.426 . 0 0 "[ . 1 . 2]" 1
1876 1 92 ILE MG 1 119 TRP HE1 3.615 . 5.702 5.216 4.688 5.748 0.046 2 0 "[ . 1 . 2]" 1
1877 1 92 ILE MG 1 119 TRP HH2 2.715 . 3.767 2.197 1.943 2.458 . 0 0 "[ . 1 . 2]" 1
1878 1 92 ILE MG 1 119 TRP HZ2 2.750 . 3.842 3.406 3.178 3.729 . 0 0 "[ . 1 . 2]" 1
1879 1 92 ILE MG 1 119 TRP HZ3 2.725 . 3.789 2.734 2.339 3.211 . 0 0 "[ . 1 . 2]" 1
1880 1 93 LYS H 1 93 LYS HB2 2.645 . 3.617 2.429 2.258 2.584 . 0 0 "[ . 1 . 2]" 1
1881 1 93 LYS H 1 93 LYS HB3 2.820 . 3.993 3.621 3.521 3.745 . 0 0 "[ . 1 . 2]" 1
1882 1 93 LYS H 1 94 TYR H 3.265 . 4.950 4.412 4.321 4.504 . 0 0 "[ . 1 . 2]" 1
1883 1 93 LYS H 1 107 SER HA 3.255 . 4.928 4.630 4.409 4.845 . 0 0 "[ . 1 . 2]" 1
1884 1 93 LYS H 1 107 SER QB 3.570 . 5.606 5.001 4.598 5.665 0.060 11 0 "[ . 1 . 2]" 1
1885 1 93 LYS HA 1 93 LYS QD 2.330 . 2.940 2.432 1.953 2.977 0.037 12 0 "[ . 1 . 2]" 1
1886 1 93 LYS HA 1 93 LYS HG2 2.875 . 4.111 3.555 3.097 3.732 . 0 0 "[ . 1 . 2]" 1
1887 1 93 LYS HA 1 93 LYS HG3 2.520 . 3.348 2.708 2.319 3.567 0.219 3 0 "[ . 1 . 2]" 1
1888 1 93 LYS HA 1 94 TYR H 2.415 . 3.122 2.104 2.017 2.197 . 0 0 "[ . 1 . 2]" 1
1889 1 93 LYS HA 1 106 SER HA 3.340 . 5.111 4.980 4.628 5.305 0.194 8 0 "[ . 1 . 2]" 1
1890 1 93 LYS HA 1 107 SER QB 2.750 . 3.842 3.034 2.548 3.422 . 0 0 "[ . 1 . 2]" 1
1891 1 93 LYS HB2 1 93 LYS QE 2.890 . 4.143 3.933 2.071 4.299 0.155 5 0 "[ . 1 . 2]" 1
1892 1 93 LYS HB2 1 94 TYR H 3.030 . 4.444 3.998 3.552 4.232 . 0 0 "[ . 1 . 2]" 1
1893 1 93 LYS HB2 1 95 SER H 3.070 . 4.530 4.521 3.480 5.333 0.802 7 5 "[ * + - . **]" 1
1894 1 93 LYS HB3 1 93 LYS QD 2.685 . 3.703 3.140 2.441 3.506 . 0 0 "[ . 1 . 2]" 1
1895 1 93 LYS HB3 1 94 TYR H 2.735 . 3.810 2.863 2.390 3.113 . 0 0 "[ . 1 . 2]" 1
1896 1 93 LYS HB3 1 94 TYR QD 3.650 . 5.778 5.542 4.870 5.887 0.109 13 0 "[ . 1 . 2]" 1
1897 1 93 LYS HB3 1 95 SER H 3.650 . 5.778 3.527 2.326 4.968 . 0 0 "[ . 1 . 2]" 1
1898 1 93 LYS HB3 1 95 SER QB 2.785 . 3.918 3.805 2.675 4.186 0.269 10 0 "[ . 1 . 2]" 1
1899 1 93 LYS HB3 1 107 SER HA 3.420 . 5.283 4.670 3.900 5.122 . 0 0 "[ . 1 . 2]" 1
1900 1 93 LYS QD 1 93 LYS QE 2.025 . 2.284 2.024 1.964 2.093 . 0 0 "[ . 1 . 2]" 1
1901 1 93 LYS QD 1 107 SER HA 2.750 . 3.842 3.526 2.600 4.225 0.382 20 0 "[ . 1 . 2]" 1
1902 1 93 LYS QD 1 107 SER QB 2.295 . 2.864 2.666 1.635 3.191 0.327 14 0 "[ . 1 . 2]" 1
1903 1 93 LYS QE 1 93 LYS HG2 2.670 . 3.671 2.435 2.219 2.878 . 0 0 "[ . 1 . 2]" 1
1904 1 93 LYS HG3 1 94 TYR H 2.780 . 3.907 3.881 3.430 4.547 0.640 8 4 "[ -*. + * . 2]" 1
1905 1 93 LYS HG3 1 107 SER HA 3.070 . 4.530 4.292 3.340 5.220 0.690 8 4 "[ *-. + * . 2]" 1
1906 1 93 LYS HG3 1 107 SER QB 2.600 . 3.520 3.451 2.579 4.278 0.758 8 4 "[ *-. + * . 2]" 1
1907 1 94 TYR H 1 94 TYR QB 2.765 . 3.875 2.368 2.246 2.556 . 0 0 "[ . 1 . 2]" 1
1908 1 94 TYR H 1 94 TYR QD 3.025 . 4.434 3.286 2.789 3.999 . 0 0 "[ . 1 . 2]" 1
1909 1 94 TYR H 1 95 SER H 2.850 . 4.057 3.504 2.522 4.183 0.125 5 0 "[ . 1 . 2]" 1
1910 1 94 TYR H 1 102 LEU QD 3.125 . 4.649 3.889 3.629 4.240 . 0 0 "[ . 1 . 2]" 1
1911 1 94 TYR H 1 106 SER HA 2.960 . 4.294 3.403 3.072 3.726 . 0 0 "[ . 1 . 2]" 1
1912 1 94 TYR H 1 106 SER QB 3.565 . 5.595 3.997 3.449 4.715 . 0 0 "[ . 1 . 2]" 1
1913 1 94 TYR H 1 107 SER H 3.395 . 5.229 4.475 4.094 4.838 . 0 0 "[ . 1 . 2]" 1
1914 1 94 TYR H 1 107 SER HA 2.805 . 3.961 2.938 2.480 3.525 . 0 0 "[ . 1 . 2]" 1
1915 1 94 TYR H 1 108 ALA H 3.505 . 5.466 4.727 4.264 5.358 . 0 0 "[ . 1 . 2]" 1
1916 1 94 TYR HA 1 94 TYR QD 2.895 . 4.154 2.598 1.972 2.962 . 0 0 "[ . 1 . 2]" 1
1917 1 94 TYR HA 1 95 SER H 2.470 . 3.240 2.361 1.967 2.844 . 0 0 "[ . 1 . 2]" 1
1918 1 94 TYR HA 1 95 SER HA 3.340 . 5.111 4.454 4.261 4.727 . 0 0 "[ . 1 . 2]" 1
1919 1 94 TYR HA 1 102 LEU QD 3.620 . 5.713 4.298 4.059 4.720 . 0 0 "[ . 1 . 2]" 1
1920 1 94 TYR QB 1 95 SER H 3.175 . 4.756 3.688 3.252 3.913 . 0 0 "[ . 1 . 2]" 1
1921 1 94 TYR QB 1 102 LEU MD1 2.920 . 4.208 3.024 2.160 3.972 . 0 0 "[ . 1 . 2]" 1
1922 1 94 TYR QB 1 102 LEU QD 2.685 . 3.273 2.429 2.139 2.935 . 0 0 "[ . 1 . 2]" 1
1923 1 94 TYR QB 1 102 LEU MD2 2.920 . 4.208 2.956 2.205 3.858 . 0 0 "[ . 1 . 2]" 1
1924 1 94 TYR QB 1 102 LEU HG 3.505 . 5.466 4.805 4.467 5.271 . 0 0 "[ . 1 . 2]" 1
1925 1 94 TYR QB 1 106 SER H 3.420 . 5.283 4.864 4.671 5.007 . 0 0 "[ . 1 . 2]" 1
1926 1 94 TYR QB 1 107 SER H 3.355 . 5.143 4.372 3.709 5.026 . 0 0 "[ . 1 . 2]" 1
1927 1 94 TYR QB 1 125 ILE H 3.125 . 4.649 4.477 4.033 4.689 0.041 19 0 "[ . 1 . 2]" 1
1928 1 94 TYR QD 1 102 LEU QD 3.060 . 4.509 3.936 3.670 4.430 . 0 0 "[ . 1 . 2]" 1
1929 1 94 TYR QD 1 106 SER HA 3.250 . 4.918 4.339 3.873 4.970 0.052 4 0 "[ . 1 . 2]" 1
1930 1 94 TYR QD 1 107 SER H 3.090 . 4.574 4.313 3.592 4.815 0.241 14 0 "[ . 1 . 2]" 1
1931 1 95 SER H 1 102 LEU QD 3.620 . 5.713 4.424 3.833 4.746 . 0 0 "[ . 1 . 2]" 1
1932 1 95 SER H 1 106 SER HA 3.590 . 5.648 5.532 4.487 5.910 0.261 1 0 "[ . 1 . 2]" 1
1933 1 95 SER HA 1 96 CYS H 2.445 . 3.187 2.181 1.978 2.397 . 0 0 "[ . 1 . 2]" 1
1934 1 95 SER HA 1 96 CYS HA 3.170 . 4.746 4.411 4.224 4.519 . 0 0 "[ . 1 . 2]" 1
1935 1 95 SER HA 1 97 THR H 3.195 . 4.799 4.218 3.420 5.643 0.844 17 3 "[ . *1 - . + 2]" 1
1936 1 95 SER HA 1 100 TYR QE 3.080 . 4.552 3.186 1.958 4.026 . 0 0 "[ . 1 . 2]" 1
1937 1 95 SER QB 1 96 CYS H 2.860 . 4.079 3.243 2.534 3.814 . 0 0 "[ . 1 . 2]" 1
1938 1 96 CYS H 1 96 CYS HB2 2.750 . 3.842 2.559 2.390 3.343 . 0 0 "[ . 1 . 2]" 1
1939 1 96 CYS H 1 96 CYS QB 2.415 . 3.122 2.474 2.353 2.700 . 0 0 "[ . 1 . 2]" 1
1940 1 96 CYS H 1 96 CYS HB3 2.750 . 3.842 3.563 2.599 3.730 . 0 0 "[ . 1 . 2]" 1
1941 1 96 CYS H 1 100 TYR QE 3.215 . 4.842 2.637 2.063 3.078 . 0 0 "[ . 1 . 2]" 1
1942 1 96 CYS H 1 102 LEU H 3.650 . 5.778 6.145 5.948 6.325 0.547 4 3 "[ +.- 1 * 2]" 1
1943 1 96 CYS H 1 102 LEU HB2 3.465 . 5.380 4.242 3.868 4.588 . 0 0 "[ . 1 . 2]" 1
1944 1 96 CYS H 1 102 LEU QD 2.830 . 4.015 3.500 2.970 4.054 0.039 2 0 "[ . 1 . 2]" 1
1945 1 96 CYS HA 1 97 THR HA 3.200 . 4.810 4.654 4.459 4.799 . 0 0 "[ . 1 . 2]" 1
1946 1 96 CYS HA 1 97 THR HB 3.510 . 5.477 5.163 4.779 5.396 . 0 0 "[ . 1 . 2]" 1
1947 1 96 CYS QB 1 97 THR H 2.710 . 3.757 2.374 1.604 2.937 0.196 14 0 "[ . 1 . 2]" 1
1948 1 96 CYS QB 1 100 TYR QD 2.765 . 3.875 2.844 2.520 3.220 . 0 0 "[ . 1 . 2]" 1
1949 1 96 CYS QB 1 100 TYR QE 2.815 . 3.982 2.781 2.371 3.177 . 0 0 "[ . 1 . 2]" 1
1950 1 96 CYS QB 1 102 LEU QD 2.625 . 3.574 3.754 3.106 4.132 0.559 16 1 "[ . 1 .+ 2]" 1
1951 1 96 CYS QB 1 126 CYS HA 2.770 . 3.885 3.669 3.053 3.986 0.101 14 0 "[ . 1 . 2]" 1
1952 1 96 CYS QB 1 126 CYS QB 2.835 . 4.025 2.616 2.373 3.350 . 0 0 "[ . 1 . 2]" 1
1953 1 96 CYS QB 1 127 ASP H 3.290 . 5.003 4.716 4.414 5.064 0.061 14 0 "[ . 1 . 2]" 1
1954 1 96 CYS HB2 1 97 THR H 3.050 . 4.488 2.505 1.611 4.105 0.189 14 0 "[ . 1 . 2]" 1
1955 1 96 CYS HB2 1 126 CYS HA 3.045 . 4.477 4.045 3.815 4.289 . 0 0 "[ . 1 . 2]" 1
1956 1 96 CYS HB3 1 97 THR H 3.050 . 4.488 3.356 1.737 4.041 0.063 17 0 "[ . 1 . 2]" 1
1957 1 96 CYS HB3 1 126 CYS HA 3.045 . 4.477 4.247 3.156 4.736 0.260 14 0 "[ . 1 . 2]" 1
1958 1 97 THR H 1 97 THR HB 2.535 . 3.380 2.661 2.062 2.993 . 0 0 "[ . 1 . 2]" 1
1959 1 97 THR H 1 97 THR MG 2.870 . 4.101 3.809 3.519 3.922 . 0 0 "[ . 1 . 2]" 1
1960 1 97 THR H 1 98 LYS H 3.190 . 4.788 4.428 4.304 4.714 . 0 0 "[ . 1 . 2]" 1
1961 1 97 THR H 1 100 TYR HB3 3.330 . 5.089 4.009 3.225 4.492 . 0 0 "[ . 1 . 2]" 1
1962 1 97 THR H 1 100 TYR QD 3.050 . 4.488 2.972 2.482 3.619 . 0 0 "[ . 1 . 2]" 1
1963 1 97 THR H 1 100 TYR QE 3.325 . 5.079 2.857 2.154 4.020 . 0 0 "[ . 1 . 2]" 1
1964 1 97 THR HA 1 97 THR MG 2.250 . 2.767 2.580 2.421 2.734 . 0 0 "[ . 1 . 2]" 1
1965 1 97 THR HA 1 98 LYS H 2.405 . 3.101 2.465 2.249 2.589 . 0 0 "[ . 1 . 2]" 1
1966 1 97 THR HA 1 100 TYR QD 3.325 . 5.079 4.429 4.100 4.863 . 0 0 "[ . 1 . 2]" 1
1967 1 97 THR HB 1 98 LYS H 3.080 . 4.552 3.998 3.803 4.280 . 0 0 "[ . 1 . 2]" 1
1968 1 97 THR HB 1 100 TYR H 3.155 . 4.713 4.126 3.265 4.661 . 0 0 "[ . 1 . 2]" 1
1969 1 97 THR HB 1 100 TYR HB2 2.730 . 3.799 3.210 2.978 3.419 . 0 0 "[ . 1 . 2]" 1
1970 1 97 THR HB 1 100 TYR HB3 2.880 . 4.122 1.877 1.702 2.145 0.098 15 0 "[ . 1 . 2]" 1
1971 1 97 THR HB 1 100 TYR QD 2.590 . 3.499 2.815 2.339 3.451 . 0 0 "[ . 1 . 2]" 1
1972 1 97 THR HB 1 100 TYR QE 3.165 . 4.735 4.312 3.849 4.858 0.124 14 0 "[ . 1 . 2]" 1
1973 1 97 THR MG 1 98 LYS H 2.380 . 3.047 2.212 1.986 2.616 . 0 0 "[ . 1 . 2]" 1
1974 1 97 THR MG 1 98 LYS HB3 2.805 . 3.961 3.432 2.837 4.189 0.228 5 0 "[ . 1 . 2]" 1
1975 1 97 THR MG 1 100 TYR H 3.075 . 4.541 3.497 2.647 3.940 . 0 0 "[ . 1 . 2]" 1
1976 1 97 THR MG 1 100 TYR HA 3.080 . 4.552 4.132 3.929 4.283 . 0 0 "[ . 1 . 2]" 1
1977 1 97 THR MG 1 100 TYR HB2 2.650 . 3.628 3.818 3.557 4.010 0.382 20 0 "[ . 1 . 2]" 1
1978 1 97 THR MG 1 100 TYR HB3 2.590 . 3.499 2.442 2.179 2.570 . 0 0 "[ . 1 . 2]" 1
1979 1 97 THR MG 1 100 TYR QD 2.465 . 3.230 3.256 2.936 3.717 0.487 9 0 "[ . 1 . 2]" 1
1980 1 97 THR MG 1 101 ARG H 3.510 . 5.477 5.696 5.436 5.829 0.352 20 0 "[ . 1 . 2]" 1
1981 1 98 LYS H 1 98 LYS HA 2.365 . 3.015 2.802 2.718 2.879 . 0 0 "[ . 1 . 2]" 1
1982 1 98 LYS H 1 98 LYS HB2 2.460 . 3.219 2.662 2.273 3.545 0.326 20 0 "[ . 1 . 2]" 1
1983 1 98 LYS H 1 98 LYS HB3 2.250 . 2.767 2.492 2.387 2.705 . 0 0 "[ . 1 . 2]" 1
1984 1 98 LYS H 1 98 LYS QD 3.305 . 5.036 4.230 3.677 4.898 . 0 0 "[ . 1 . 2]" 1
1985 1 98 LYS H 1 98 LYS QE 3.360 . 5.154 5.251 3.564 5.802 0.648 13 13 "[* * .**- 1**+*** **2]" 1
1986 1 98 LYS H 1 98 LYS QG 3.245 . 4.907 3.750 1.765 4.013 0.035 5 0 "[ . 1 . 2]" 1
1987 1 98 LYS H 1 99 GLY H 2.460 . 3.219 2.954 2.667 4.266 1.047 9 3 "[ .* +1 - 2]" 1
1988 1 98 LYS H 1 100 TYR QD 3.355 . 5.143 4.511 4.263 4.997 . 0 0 "[ . 1 . 2]" 1
1989 1 98 LYS HA 1 98 LYS HB2 2.265 . 2.800 2.418 2.285 2.517 . 0 0 "[ . 1 . 2]" 1
1990 1 98 LYS HA 1 98 LYS QE 3.230 . 4.874 4.165 3.769 5.316 0.441 5 0 "[ . 1 . 2]" 1
1991 1 98 LYS HA 1 98 LYS HG2 2.885 . 4.133 3.520 2.970 3.787 . 0 0 "[ . 1 . 2]" 1
1992 1 98 LYS HA 1 98 LYS QG 2.510 . 3.326 2.789 2.294 3.330 0.003 20 0 "[ . 1 . 2]" 1
1993 1 98 LYS HA 1 98 LYS HG3 2.885 . 4.133 2.938 2.380 3.753 . 0 0 "[ . 1 . 2]" 1
1994 1 98 LYS HA 1 99 GLY HA2 3.320 . 5.068 4.512 4.260 4.706 . 0 0 "[ . 1 . 2]" 1
1995 1 98 LYS HB2 1 99 GLY H 2.830 . 4.015 3.863 3.303 4.271 0.256 15 0 "[ . 1 . 2]" 1
1996 1 98 LYS HB3 1 98 LYS QE 2.980 . 4.337 3.671 2.021 4.399 0.062 13 0 "[ . 1 . 2]" 1
1997 1 98 LYS HB3 1 99 GLY H 2.615 . 3.552 2.860 2.046 4.131 0.579 6 2 "[ .+ 1 - 2]" 1
1998 1 98 LYS QD 1 98 LYS QG 2.030 . 2.295 2.035 1.918 2.102 . 0 0 "[ . 1 . 2]" 1
1999 1 98 LYS QD 1 99 GLY H 3.115 . 4.627 4.115 2.642 4.943 0.316 10 0 "[ . 1 . 2]" 1
2000 1 98 LYS QD 1 99 GLY HA2 3.040 . 4.466 4.669 4.251 4.954 0.488 10 0 "[ . 1 . 2]" 1
2001 1 98 LYS QD 1 100 TYR H 3.460 . 5.369 5.646 4.676 6.310 0.941 8 8 "[ * *- + * *. * *]" 1
2002 1 98 LYS QE 1 98 LYS QG 2.310 . 2.897 2.138 2.019 2.317 . 0 0 "[ . 1 . 2]" 1
2003 1 98 LYS QE 1 99 GLY H 3.570 . 5.606 4.842 3.537 5.970 0.365 18 0 "[ . 1 . 2]" 1
2004 1 98 LYS QG 1 99 GLY H 2.545 . 3.402 3.187 1.765 3.532 0.130 12 0 "[ . 1 . 2]" 1
2005 1 98 LYS QG 1 99 GLY HA2 2.775 . 3.896 3.564 2.965 4.059 0.163 15 0 "[ . 1 . 2]" 1
2006 1 99 GLY H 1 99 GLY HA3 2.340 . 2.961 2.493 2.318 2.971 0.010 15 0 "[ . 1 . 2]" 1
2007 1 99 GLY H 1 100 TYR H 2.640 . 3.606 3.340 2.341 3.773 0.167 13 0 "[ . 1 . 2]" 1
2008 1 99 GLY H 1 100 TYR HA 3.650 . 5.778 5.147 4.927 5.334 . 0 0 "[ . 1 . 2]" 1
2009 1 99 GLY H 1 100 TYR HB3 3.400 . 5.240 4.070 3.740 4.877 . 0 0 "[ . 1 . 2]" 1
2010 1 99 GLY H 1 100 TYR QD 3.255 . 4.928 3.839 2.673 4.240 . 0 0 "[ . 1 . 2]" 1
2011 1 99 GLY HA2 1 100 TYR HA 3.470 . 5.391 4.416 4.311 4.589 . 0 0 "[ . 1 . 2]" 1
2012 1 100 TYR H 1 100 TYR HB3 2.500 . 3.305 3.049 2.727 3.173 . 0 0 "[ . 1 . 2]" 1
2013 1 100 TYR H 1 100 TYR QD 2.490 . 3.283 2.205 1.930 2.380 . 0 0 "[ . 1 . 2]" 1
2014 1 100 TYR H 1 101 ARG H 3.250 . 4.918 4.390 4.299 4.483 . 0 0 "[ . 1 . 2]" 1
2015 1 100 TYR HA 1 100 TYR QD 2.930 . 4.229 3.672 3.634 3.719 . 0 0 "[ . 1 . 2]" 1
2016 1 100 TYR HA 1 101 ARG H 2.450 . 3.197 2.538 2.442 2.704 . 0 0 "[ . 1 . 2]" 1
2017 1 100 TYR HA 1 128 ARG H 3.355 . 5.143 3.918 3.280 4.423 . 0 0 "[ . 1 . 2]" 1
2018 1 100 TYR HA 1 128 ARG HA 2.475 . 3.251 3.324 2.480 3.628 0.377 15 0 "[ . 1 . 2]" 1
2019 1 100 TYR HB2 1 101 ARG H 2.560 . 3.434 2.600 2.415 2.764 . 0 0 "[ . 1 . 2]" 1
2020 1 100 TYR HB2 1 102 LEU H 3.650 . 5.778 5.985 5.853 6.145 0.367 5 0 "[ . 1 . 2]" 1
2021 1 100 TYR HB3 1 101 ARG H 2.890 . 4.143 3.941 3.764 4.084 . 0 0 "[ . 1 . 2]" 1
2022 1 100 TYR HB3 1 128 ARG QB 2.995 . 4.369 3.946 2.555 4.616 0.247 7 0 "[ . 1 . 2]" 1
2023 1 100 TYR QD 1 101 ARG H 2.730 . 3.799 2.975 2.666 3.309 . 0 0 "[ . 1 . 2]" 1
2024 1 100 TYR QD 1 101 ARG QG 3.385 . 5.208 4.789 4.412 5.134 . 0 0 "[ . 1 . 2]" 1
2025 1 100 TYR QD 1 102 LEU HA 3.135 . 4.670 3.719 3.393 4.010 . 0 0 "[ . 1 . 2]" 1
2026 1 100 TYR QD 1 126 CYS H 3.650 . 5.778 5.696 4.890 6.154 0.376 15 0 "[ . 1 . 2]" 1
2027 1 100 TYR QD 1 126 CYS HA 2.935 . 4.240 3.047 2.112 3.601 . 0 0 "[ . 1 . 2]" 1
2028 1 100 TYR QD 1 126 CYS QB 3.205 . 4.821 3.227 2.627 3.692 . 0 0 "[ . 1 . 2]" 1
2029 1 100 TYR QD 1 127 ASP H 2.840 . 4.036 2.589 2.027 2.913 . 0 0 "[ . 1 . 2]" 1
2030 1 100 TYR QD 1 127 ASP HA 3.250 . 4.918 4.906 4.478 5.234 0.317 11 0 "[ . 1 . 2]" 1
2031 1 100 TYR QD 1 127 ASP HB3 2.895 . 4.154 3.491 2.899 3.971 . 0 0 "[ . 1 . 2]" 1
2032 1 100 TYR QD 1 128 ARG H 2.530 . 3.369 2.329 1.728 2.983 0.072 9 0 "[ . 1 . 2]" 1
2033 1 100 TYR QD 1 128 ARG HA 3.150 . 4.702 3.875 3.075 4.980 0.278 20 0 "[ . 1 . 2]" 1
2034 1 100 TYR QD 1 128 ARG QB 2.640 . 3.606 3.799 2.929 4.202 0.596 8 3 "[ . +*1 .- 2]" 1
2035 1 100 TYR QE 1 101 ARG H 3.385 . 5.208 4.559 4.205 4.856 . 0 0 "[ . 1 . 2]" 1
2036 1 100 TYR QE 1 102 LEU HA 3.145 . 4.692 2.600 2.288 2.859 . 0 0 "[ . 1 . 2]" 1
2037 1 100 TYR QE 1 102 LEU HB2 2.710 . 3.757 2.371 1.929 3.031 . 0 0 "[ . 1 . 2]" 1
2038 1 100 TYR QE 1 102 LEU QD 2.515 . 3.337 2.278 1.886 2.903 . 0 0 "[ . 1 . 2]" 1
2039 1 100 TYR QE 1 102 LEU HG 3.060 . 4.509 3.899 2.873 4.586 0.077 18 0 "[ . 1 . 2]" 1
2040 1 100 TYR QE 1 103 ILE H 3.595 . 5.659 4.528 4.255 4.820 . 0 0 "[ . 1 . 2]" 1
2041 1 100 TYR QE 1 126 CYS H 3.650 . 5.778 5.424 4.628 5.910 0.132 17 0 "[ . 1 . 2]" 1
2042 1 100 TYR QE 1 126 CYS HA 2.970 . 4.315 2.634 1.989 3.145 . 0 0 "[ . 1 . 2]" 1
2043 1 100 TYR QE 1 126 CYS QB 2.910 . 4.187 3.826 3.240 4.291 0.104 6 0 "[ . 1 . 2]" 1
2044 1 100 TYR QE 1 128 ARG H 3.490 . 5.433 4.536 3.921 5.207 . 0 0 "[ . 1 . 2]" 1
2045 1 101 ARG H 1 101 ARG HB2 2.885 . 4.133 3.039 2.446 3.910 . 0 0 "[ . 1 . 2]" 1
2046 1 101 ARG H 1 101 ARG HB3 2.915 . 4.197 3.447 2.555 3.783 . 0 0 "[ . 1 . 2]" 1
2047 1 101 ARG H 1 101 ARG QG 2.480 . 3.262 2.653 2.327 3.886 0.624 10 2 "[ . - + . 2]" 1
2048 1 101 ARG H 1 102 LEU H 2.870 . 4.101 4.356 4.276 4.441 0.341 8 0 "[ . 1 . 2]" 1
2049 1 101 ARG H 1 103 ILE MD 3.370 . 5.175 5.076 4.723 5.478 0.303 3 0 "[ . 1 . 2]" 1
2050 1 101 ARG H 1 127 ASP H 2.670 . 3.671 3.698 3.029 4.150 0.480 16 0 "[ . 1 . 2]" 1
2051 1 101 ARG H 1 127 ASP HA 3.475 . 5.401 5.030 4.445 5.587 0.186 12 0 "[ . 1 . 2]" 1
2052 1 101 ARG H 1 127 ASP HB3 2.980 . 4.337 2.177 1.677 2.785 0.123 17 0 "[ . 1 . 2]" 1
2053 1 101 ARG H 1 128 ARG H 3.230 . 4.874 2.910 2.559 3.453 . 0 0 "[ . 1 . 2]" 1
2054 1 101 ARG H 1 128 ARG HA 2.950 . 4.273 3.896 3.091 4.313 0.040 7 0 "[ . 1 . 2]" 1
2055 1 101 ARG HA 1 101 ARG HB3 2.380 . 3.047 2.501 2.311 3.025 . 0 0 "[ . 1 . 2]" 1
2056 1 101 ARG HA 1 101 ARG QG 2.635 . 3.595 2.790 2.312 3.555 . 0 0 "[ . 1 . 2]" 1
2057 1 101 ARG HA 1 102 LEU H 2.290 . 2.853 2.252 2.171 2.338 . 0 0 "[ . 1 . 2]" 1
2058 1 101 ARG HA 1 127 ASP H 3.650 . 5.778 5.144 4.774 5.608 . 0 0 "[ . 1 . 2]" 1
2059 1 101 ARG HB2 1 127 ASP HB2 3.340 . 5.111 3.406 1.999 5.209 0.098 2 0 "[ . 1 . 2]" 1
2060 1 101 ARG HB2 1 127 ASP HB3 3.130 . 4.660 3.125 1.782 4.934 0.274 2 0 "[ . 1 . 2]" 1
2061 1 101 ARG HB3 1 102 LEU H 3.195 . 4.799 3.558 2.911 4.187 . 0 0 "[ . 1 . 2]" 1
2062 1 101 ARG QG 1 127 ASP H 3.300 . 5.025 4.844 4.025 5.434 0.409 19 0 "[ . 1 . 2]" 1
2063 1 101 ARG QG 1 127 ASP HA 3.365 . 5.165 5.456 4.702 6.024 0.859 4 10 "[* +-* * 1* *. * **]" 1
2064 1 101 ARG QG 1 127 ASP HB2 2.780 . 3.907 3.555 2.716 4.306 0.399 4 0 "[ . 1 . 2]" 1
2065 1 101 ARG QG 1 127 ASP HB3 2.795 . 3.939 3.041 2.141 3.840 . 0 0 "[ . 1 . 2]" 1
2066 1 102 LEU H 1 102 LEU HB2 2.385 . 3.058 2.700 2.619 2.810 . 0 0 "[ . 1 . 2]" 1
2067 1 102 LEU H 1 102 LEU HB3 2.410 . 3.112 2.591 2.483 2.703 . 0 0 "[ . 1 . 2]" 1
2068 1 102 LEU H 1 102 LEU MD1 3.115 . 4.627 4.216 4.051 4.492 . 0 0 "[ . 1 . 2]" 1
2069 1 102 LEU H 1 102 LEU QD 2.700 . 3.735 3.764 3.705 3.841 0.106 8 0 "[ . 1 . 2]" 1
2070 1 102 LEU H 1 102 LEU MD2 3.115 . 4.627 4.254 4.065 4.379 . 0 0 "[ . 1 . 2]" 1
2071 1 102 LEU H 1 102 LEU HG 3.275 . 4.971 4.513 4.426 4.577 . 0 0 "[ . 1 . 2]" 1
2072 1 102 LEU H 1 103 ILE H 3.350 . 5.133 4.330 4.196 4.441 . 0 0 "[ . 1 . 2]" 1
2073 1 102 LEU H 1 103 ILE MD 3.485 . 5.423 4.953 4.488 6.107 0.684 15 2 "[ - . 1 + 2]" 1
2074 1 102 LEU H 1 106 SER QB 3.570 . 5.606 5.096 3.833 5.720 0.115 7 0 "[ . 1 . 2]" 1
2075 1 102 LEU H 1 126 CYS HA 3.650 . 5.778 5.697 5.353 6.039 0.261 2 0 "[ . 1 . 2]" 1
2076 1 102 LEU H 1 127 ASP H 3.450 . 5.347 4.865 4.568 5.235 . 0 0 "[ . 1 . 2]" 1
2077 1 102 LEU H 1 127 ASP HB2 3.650 . 5.778 5.106 4.619 5.595 . 0 0 "[ . 1 . 2]" 1
2078 1 102 LEU H 1 127 ASP HB3 3.560 . 5.584 5.013 4.703 5.294 . 0 0 "[ . 1 . 2]" 1
2079 1 102 LEU HA 1 102 LEU MD1 2.890 . 4.143 2.551 1.913 3.651 . 0 0 "[ . 1 . 2]" 1
2080 1 102 LEU HA 1 102 LEU QD 2.190 . 2.638 2.336 1.908 3.029 0.391 12 0 "[ . 1 . 2]" 1
2081 1 102 LEU HA 1 102 LEU MD2 2.890 . 4.143 3.585 2.995 3.867 . 0 0 "[ . 1 . 2]" 1
2082 1 102 LEU HA 1 102 LEU HG 2.700 . 3.735 2.773 2.335 3.187 . 0 0 "[ . 1 . 2]" 1
2083 1 102 LEU HA 1 103 ILE H 2.620 . 3.563 2.110 1.979 2.234 . 0 0 "[ . 1 . 2]" 1
2084 1 102 LEU HA 1 103 ILE HA 3.130 . 4.660 4.328 4.213 4.449 . 0 0 "[ . 1 . 2]" 1
2085 1 102 LEU HA 1 103 ILE QG 3.005 . 4.391 3.562 3.158 3.772 . 0 0 "[ . 1 . 2]" 1
2086 1 102 LEU HA 1 125 ILE MD 3.585 . 5.638 5.267 4.836 5.546 . 0 0 "[ . 1 . 2]" 1
2087 1 102 LEU HA 1 125 ILE MG 3.290 . 5.003 3.669 2.959 4.711 . 0 0 "[ . 1 . 2]" 1
2088 1 102 LEU HA 1 126 CYS HA 2.840 . 4.036 3.155 2.676 3.615 . 0 0 "[ . 1 . 2]" 1
2089 1 102 LEU HA 1 127 ASP H 2.845 . 4.047 2.781 2.528 3.262 . 0 0 "[ . 1 . 2]" 1
2090 1 102 LEU HB2 1 102 LEU MD1 2.470 . 3.240 2.244 2.105 2.422 . 0 0 "[ . 1 . 2]" 1
2091 1 102 LEU HB2 1 102 LEU QD 2.180 . 2.617 2.092 2.044 2.212 . 0 0 "[ . 1 . 2]" 1
2092 1 102 LEU HB2 1 102 LEU MD2 2.470 . 3.240 2.639 2.262 3.175 . 0 0 "[ . 1 . 2]" 1
2093 1 102 LEU HB2 1 103 ILE H 3.190 . 4.788 4.344 4.178 4.452 . 0 0 "[ . 1 . 2]" 1
2094 1 102 LEU HB2 1 106 SER H 3.650 . 5.778 5.818 5.353 6.094 0.316 20 0 "[ . 1 . 2]" 1
2095 1 102 LEU HB3 1 102 LEU MD1 2.770 . 3.885 2.959 2.514 3.182 . 0 0 "[ . 1 . 2]" 1
2096 1 102 LEU HB3 1 102 LEU QD 2.465 . 3.230 2.167 2.029 2.271 . 0 0 "[ . 1 . 2]" 1
2097 1 102 LEU HB3 1 102 LEU MD2 2.770 . 3.885 2.237 2.097 2.333 . 0 0 "[ . 1 . 2]" 1
2098 1 102 LEU HB3 1 103 ILE H 3.465 . 5.380 4.132 3.978 4.219 . 0 0 "[ . 1 . 2]" 1
2099 1 102 LEU HB3 1 106 SER H 3.245 . 4.907 4.509 3.708 5.089 0.182 4 0 "[ . 1 . 2]" 1
2100 1 102 LEU HB3 1 106 SER HA 3.130 . 4.660 3.773 2.334 4.431 . 0 0 "[ . 1 . 2]" 1
2101 1 102 LEU QD 1 103 ILE H 2.690 . 3.714 2.792 2.288 3.228 . 0 0 "[ . 1 . 2]" 1
2102 1 102 LEU QD 1 104 GLY H 2.760 . 3.864 2.706 1.840 3.395 . 0 0 "[ . 1 . 2]" 1
2103 1 102 LEU QD 1 104 GLY HA2 3.260 . 4.939 4.307 3.622 4.873 . 0 0 "[ . 1 . 2]" 1
2104 1 102 LEU QD 1 105 SER H 2.875 . 4.111 3.538 2.834 4.062 . 0 0 "[ . 1 . 2]" 1
2105 1 102 LEU QD 1 105 SER QB 3.220 . 4.853 4.002 3.546 4.340 . 0 0 "[ . 1 . 2]" 1
2106 1 102 LEU QD 1 106 SER H 2.645 . 3.617 2.832 2.468 3.253 . 0 0 "[ . 1 . 2]" 1
2107 1 102 LEU QD 1 106 SER HA 2.375 . 3.036 1.797 1.647 2.027 0.153 14 0 "[ . 1 . 2]" 1
2108 1 102 LEU QD 1 106 SER QB 2.265 . 2.800 2.613 2.117 3.156 0.356 16 0 "[ . 1 . 2]" 1
2109 1 102 LEU QD 1 107 SER H 3.040 . 4.466 4.121 3.821 4.342 . 0 0 "[ . 1 . 2]" 1
2110 1 102 LEU QD 1 124 PRO HA 3.340 . 5.111 3.666 2.584 4.817 . 0 0 "[ . 1 . 2]" 1
2111 1 102 LEU QD 1 125 ILE HA 3.075 . 4.541 4.061 3.724 4.463 . 0 0 "[ . 1 . 2]" 1
2112 1 102 LEU QD 1 125 ILE HB 3.015 . 4.412 2.491 1.790 3.601 0.010 18 0 "[ . 1 . 2]" 1
2113 1 102 LEU QD 1 125 ILE MD 2.610 . 3.542 3.159 2.622 3.938 0.397 9 0 "[ . 1 . 2]" 1
2114 1 102 LEU QD 1 125 ILE MG 2.985 . 4.348 3.138 2.098 4.122 . 0 0 "[ . 1 . 2]" 1
2115 1 102 LEU QD 1 126 CYS H 3.060 . 4.509 4.177 3.580 4.797 0.288 20 0 "[ . 1 . 2]" 1
2116 1 102 LEU QD 1 126 CYS HA 3.010 . 4.402 2.870 2.102 3.647 . 0 0 "[ . 1 . 2]" 1
2117 1 102 LEU QD 1 126 CYS QB 3.110 . 4.616 4.166 3.629 4.657 0.041 20 0 "[ . 1 . 2]" 1
2118 1 102 LEU QD 1 127 ASP H 3.245 . 4.907 3.850 3.113 4.627 . 0 0 "[ . 1 . 2]" 1
2119 1 102 LEU MD1 1 103 ILE H 3.030 . 4.444 3.397 2.294 4.679 0.235 13 0 "[ . 1 . 2]" 1
2120 1 102 LEU MD1 1 104 GLY H 3.350 . 5.133 3.708 2.814 4.677 . 0 0 "[ . 1 . 2]" 1
2121 1 102 LEU MD1 1 105 SER H 3.635 . 5.745 4.943 4.267 5.586 . 0 0 "[ . 1 . 2]" 1
2122 1 102 LEU MD1 1 106 SER HA 2.905 . 4.176 3.342 1.789 4.185 0.011 13 0 "[ . 1 . 2]" 1
2123 1 102 LEU MD1 1 125 ILE H 2.860 . 4.079 2.693 1.922 3.500 . 0 0 "[ . 1 . 2]" 1
2124 1 102 LEU MD1 1 125 ILE MD 3.080 . 4.552 3.887 2.790 4.886 0.334 12 0 "[ . 1 . 2]" 1
2125 1 102 LEU MD2 1 103 ILE H 3.030 . 4.444 3.992 2.686 4.670 0.225 19 0 "[ . 1 . 2]" 1
2126 1 102 LEU MD2 1 104 GLY H 3.350 . 5.133 3.233 1.841 4.123 . 0 0 "[ . 1 . 2]" 1
2127 1 102 LEU MD2 1 105 SER H 3.635 . 5.745 3.653 2.864 4.294 . 0 0 "[ . 1 . 2]" 1
2128 1 102 LEU MD2 1 106 SER HA 2.905 . 4.176 1.968 1.648 3.030 0.152 14 0 "[ . 1 . 2]" 1
2129 1 102 LEU MD2 1 125 ILE H 2.860 . 4.079 3.623 2.437 4.420 0.341 7 0 "[ . 1 . 2]" 1
2130 1 102 LEU MD2 1 125 ILE MD 3.080 . 4.552 3.631 2.785 4.630 0.078 11 0 "[ . 1 . 2]" 1
2131 1 102 LEU HG 1 103 ILE H 2.665 . 3.660 3.163 2.963 3.392 . 0 0 "[ . 1 . 2]" 1
2132 1 102 LEU HG 1 105 SER H 3.650 . 5.778 4.893 4.091 5.841 0.063 3 0 "[ . 1 . 2]" 1
2133 1 102 LEU HG 1 106 SER QB 3.465 . 5.380 4.860 4.190 5.646 0.266 12 0 "[ . 1 . 2]" 1
2134 1 102 LEU HG 1 125 ILE H 3.285 . 4.993 3.991 2.508 5.257 0.265 15 0 "[ . 1 . 2]" 1
2135 1 102 LEU HG 1 125 ILE HB 2.560 . 3.434 3.115 2.405 3.670 0.236 14 0 "[ . 1 . 2]" 1
2136 1 102 LEU HG 1 126 CYS HA 3.650 . 5.778 4.362 2.914 5.979 0.202 18 0 "[ . 1 . 2]" 1
2137 1 103 ILE H 1 103 ILE MD 2.780 . 3.907 3.099 2.997 3.249 . 0 0 "[ . 1 . 2]" 1
2138 1 103 ILE H 1 103 ILE HG12 3.035 . 4.455 2.191 1.968 3.548 . 0 0 "[ . 1 . 2]" 1
2139 1 103 ILE H 1 103 ILE QG 2.670 . 3.671 2.038 1.874 2.143 . 0 0 "[ . 1 . 2]" 1
2140 1 103 ILE H 1 103 ILE HG13 3.035 . 4.455 3.414 1.884 3.633 . 0 0 "[ . 1 . 2]" 1
2141 1 103 ILE H 1 104 GLY H 2.935 . 4.240 2.718 2.560 2.843 . 0 0 "[ . 1 . 2]" 1
2142 1 103 ILE H 1 125 ILE HB 2.790 . 3.928 3.238 2.316 4.041 0.113 15 0 "[ . 1 . 2]" 1
2143 1 103 ILE H 1 125 ILE MD 3.105 . 4.606 4.074 3.649 4.455 . 0 0 "[ . 1 . 2]" 1
2144 1 103 ILE H 1 125 ILE MG 2.865 . 4.090 2.499 1.942 3.340 . 0 0 "[ . 1 . 2]" 1
2145 1 103 ILE H 1 126 CYS H 3.420 . 5.283 5.005 4.672 5.364 0.081 2 0 "[ . 1 . 2]" 1
2146 1 103 ILE H 1 126 CYS HA 3.420 . 5.283 4.065 3.566 4.531 . 0 0 "[ . 1 . 2]" 1
2147 1 103 ILE H 1 127 ASP H 3.235 . 4.885 3.454 3.105 3.877 . 0 0 "[ . 1 . 2]" 1
2148 1 103 ILE H 1 127 ASP HB2 3.350 . 5.133 3.638 3.284 4.134 . 0 0 "[ . 1 . 2]" 1
2149 1 103 ILE H 1 127 ASP HB3 3.650 . 5.778 4.794 4.392 5.206 . 0 0 "[ . 1 . 2]" 1
2150 1 103 ILE HA 1 103 ILE MD 2.875 . 4.111 2.228 1.930 3.743 . 0 0 "[ . 1 . 2]" 1
2151 1 103 ILE HA 1 103 ILE HG12 2.860 . 4.079 3.059 2.444 3.169 . 0 0 "[ . 1 . 2]" 1
2152 1 103 ILE HA 1 103 ILE QG 2.530 . 3.369 2.907 2.260 3.011 . 0 0 "[ . 1 . 2]" 1
2153 1 103 ILE HA 1 103 ILE HG13 2.860 . 4.079 3.637 2.637 3.779 . 0 0 "[ . 1 . 2]" 1
2154 1 103 ILE HA 1 103 ILE MG 2.245 . 2.757 2.384 2.336 2.450 . 0 0 "[ . 1 . 2]" 1
2155 1 103 ILE HA 1 104 GLY HA2 3.280 . 4.982 4.606 4.514 4.729 . 0 0 "[ . 1 . 2]" 1
2156 1 103 ILE HB 1 103 ILE MD 2.520 . 3.348 3.163 2.338 3.270 . 0 0 "[ . 1 . 2]" 1
2157 1 103 ILE HB 1 104 GLY H 2.870 . 4.101 2.615 2.473 2.831 . 0 0 "[ . 1 . 2]" 1
2158 1 103 ILE HB 1 104 GLY HA2 3.295 . 5.014 4.407 4.251 4.833 . 0 0 "[ . 1 . 2]" 1
2159 1 103 ILE HB 1 126 CYS H 3.650 . 5.778 5.449 4.912 5.872 0.094 12 0 "[ . 1 . 2]" 1
2160 1 103 ILE MD 1 126 CYS HA 3.650 . 5.778 5.578 4.565 5.868 0.090 19 0 "[ . 1 . 2]" 1
2161 1 103 ILE MD 1 127 ASP H 2.970 . 4.315 4.104 3.445 4.371 0.056 1 0 "[ . 1 . 2]" 1
2162 1 103 ILE MD 1 127 ASP HA 2.735 . 3.810 3.456 2.558 3.978 0.168 2 0 "[ . 1 . 2]" 1
2163 1 103 ILE MD 1 127 ASP HB2 2.410 . 3.112 2.275 2.124 2.533 . 0 0 "[ . 1 . 2]" 1
2164 1 103 ILE MD 1 127 ASP HB3 2.630 . 3.585 3.639 3.355 3.897 0.313 1 0 "[ . 1 . 2]" 1
2165 1 103 ILE QG 1 103 ILE MG 2.095 . 2.434 2.311 2.225 2.365 . 0 0 "[ . 1 . 2]" 1
2166 1 103 ILE QG 1 104 GLY H 3.235 . 4.885 3.969 3.806 4.228 . 0 0 "[ . 1 . 2]" 1
2167 1 103 ILE QG 1 126 CYS H 3.560 . 5.584 4.798 4.268 5.666 0.082 3 0 "[ . 1 . 2]" 1
2168 1 103 ILE QG 1 127 ASP H 2.990 . 4.359 3.387 3.167 3.787 . 0 0 "[ . 1 . 2]" 1
2169 1 103 ILE QG 1 127 ASP HA 2.930 . 4.229 3.272 2.588 3.838 . 0 0 "[ . 1 . 2]" 1
2170 1 103 ILE QG 1 127 ASP HB2 2.515 . 3.337 2.494 2.055 2.984 . 0 0 "[ . 1 . 2]" 1
2171 1 103 ILE QG 1 127 ASP HB3 3.375 . 5.186 3.998 3.555 4.406 . 0 0 "[ . 1 . 2]" 1
2172 1 103 ILE HG12 1 127 ASP HA 3.205 . 4.821 3.559 2.726 4.985 0.164 15 0 "[ . 1 . 2]" 1
2173 1 103 ILE HG13 1 127 ASP HA 3.205 . 4.821 3.956 3.222 4.623 . 0 0 "[ . 1 . 2]" 1
2174 1 104 GLY H 1 105 SER H 2.995 . 4.369 3.954 3.707 4.378 0.009 9 0 "[ . 1 . 2]" 1
2175 1 104 GLY H 1 125 ILE H 3.630 . 5.734 4.626 3.202 5.679 . 0 0 "[ . 1 . 2]" 1
2176 1 104 GLY H 1 125 ILE MD 2.345 . 2.972 2.153 1.835 2.437 . 0 0 "[ . 1 . 2]" 1
2177 1 104 GLY H 1 125 ILE HG12 2.680 . 3.692 3.962 2.731 4.229 0.537 16 2 "[ - . 1 .+ 2]" 1
2178 1 104 GLY HA2 1 105 SER H 2.575 . 3.466 3.114 2.587 3.403 . 0 0 "[ . 1 . 2]" 1
2179 1 104 GLY HA2 1 106 SER H 3.650 . 5.778 5.563 4.760 5.930 0.152 13 0 "[ . 1 . 2]" 1
2180 1 104 GLY HA2 1 125 ILE MD 3.160 . 4.724 2.994 2.329 3.402 . 0 0 "[ . 1 . 2]" 1
2181 1 104 GLY HA3 1 105 SER H 2.335 . 2.950 2.182 2.105 2.343 . 0 0 "[ . 1 . 2]" 1
2182 1 104 GLY HA3 1 125 ILE HB 3.065 . 4.520 3.786 3.496 4.097 . 0 0 "[ . 1 . 2]" 1
2183 1 104 GLY HA3 1 125 ILE MD 2.200 . 2.660 1.828 1.703 2.086 0.097 15 0 "[ . 1 . 2]" 1
2184 1 105 SER H 1 105 SER HB2 2.720 . 3.778 2.719 2.243 3.557 . 0 0 "[ . 1 . 2]" 1
2185 1 105 SER H 1 105 SER QB 2.385 . 3.058 2.430 2.219 2.763 . 0 0 "[ . 1 . 2]" 1
2186 1 105 SER H 1 105 SER HB3 2.720 . 3.778 3.116 2.295 3.611 . 0 0 "[ . 1 . 2]" 1
2187 1 105 SER H 1 106 SER H 3.155 . 4.713 4.318 3.986 4.550 . 0 0 "[ . 1 . 2]" 1
2188 1 105 SER H 1 121 GLN QB 3.560 . 5.584 5.108 3.723 5.801 0.217 3 0 "[ . 1 . 2]" 1
2189 1 105 SER H 1 121 GLN QG 3.570 . 5.606 4.054 2.673 5.654 0.048 2 0 "[ . 1 . 2]" 1
2190 1 105 SER H 1 122 GLU H 2.820 . 3.993 3.921 3.227 4.347 0.354 18 0 "[ . 1 . 2]" 1
2191 1 105 SER H 1 122 GLU QB 3.135 . 4.670 3.931 3.466 4.586 . 0 0 "[ . 1 . 2]" 1
2192 1 105 SER H 1 122 GLU QG 3.570 . 5.606 4.745 2.826 5.755 0.150 17 0 "[ . 1 . 2]" 1
2193 1 105 SER H 1 123 THR MG 3.650 . 5.778 5.294 4.657 5.728 . 0 0 "[ . 1 . 2]" 1
2194 1 105 SER H 1 125 ILE H 3.650 . 5.778 5.498 4.738 6.018 0.240 5 0 "[ . 1 . 2]" 1
2195 1 105 SER H 1 125 ILE MD 2.945 . 4.262 2.961 2.142 4.000 . 0 0 "[ . 1 . 2]" 1
2196 1 105 SER H 1 125 ILE HG12 3.650 . 5.778 5.686 4.193 6.325 0.547 11 1 "[ . 1+ . 2]" 1
2197 1 105 SER HA 1 105 SER HB2 2.370 . 3.026 2.795 2.416 3.037 0.012 18 0 "[ . 1 . 2]" 1
2198 1 105 SER HA 1 105 SER HB3 2.370 . 3.026 2.630 2.343 3.024 . 0 0 "[ . 1 . 2]" 1
2199 1 105 SER HA 1 106 SER H 2.220 . 2.703 2.150 2.048 2.273 . 0 0 "[ . 1 . 2]" 1
2200 1 105 SER HA 1 107 SER H 2.755 . 3.853 3.441 3.146 3.916 0.062 19 0 "[ . 1 . 2]" 1
2201 1 105 SER QB 1 106 SER H 2.930 . 4.229 3.588 3.322 4.006 . 0 0 "[ . 1 . 2]" 1
2202 1 105 SER QB 1 108 ALA HA 2.890 . 4.143 3.687 2.806 4.249 0.106 15 0 "[ . 1 . 2]" 1
2203 1 105 SER QB 1 108 ALA MB 2.975 . 4.326 3.777 3.065 4.321 . 0 0 "[ . 1 . 2]" 1
2204 1 105 SER QB 1 121 GLN HA 2.440 . 3.176 2.704 1.830 3.315 0.139 7 0 "[ . 1 . 2]" 1
2205 1 105 SER QB 1 121 GLN QB 2.515 . 3.337 3.093 1.950 3.654 0.316 4 0 "[ . 1 . 2]" 1
2206 1 105 SER QB 1 121 GLN QG 3.045 . 4.477 2.987 1.736 4.504 0.064 18 0 "[ . 1 . 2]" 1
2207 1 105 SER QB 1 122 GLU QB 2.945 . 4.262 4.336 3.655 4.677 0.415 4 0 "[ . 1 . 2]" 1
2208 1 105 SER HB2 1 121 GLN H 3.650 . 5.778 5.256 4.443 5.886 0.109 15 0 "[ . 1 . 2]" 1
2209 1 105 SER HB2 1 121 GLN HA 2.690 . 3.714 3.018 2.200 3.854 0.140 4 0 "[ . 1 . 2]" 1
2210 1 105 SER HB2 1 121 GLN QB 2.785 . 3.918 3.566 1.983 4.606 0.688 9 1 "[ . +1 . 2]" 1
2211 1 105 SER HB2 1 122 GLU H 3.255 . 4.928 3.533 2.562 4.984 0.055 4 0 "[ . 1 . 2]" 1
2212 1 105 SER HB3 1 121 GLN H 3.650 . 5.778 5.243 4.405 5.941 0.163 2 0 "[ . 1 . 2]" 1
2213 1 105 SER HB3 1 121 GLN HA 2.690 . 3.714 3.197 1.935 3.919 0.206 18 0 "[ . 1 . 2]" 1
2214 1 105 SER HB3 1 121 GLN QB 2.785 . 3.918 3.670 2.768 4.511 0.593 11 1 "[ . 1+ . 2]" 1
2215 1 105 SER HB3 1 122 GLU H 3.255 . 4.928 4.000 2.978 4.861 . 0 0 "[ . 1 . 2]" 1
2216 1 106 SER H 1 106 SER HB2 2.785 . 3.918 2.911 2.362 3.674 . 0 0 "[ . 1 . 2]" 1
2217 1 106 SER H 1 106 SER HB3 2.785 . 3.918 2.999 2.500 3.594 . 0 0 "[ . 1 . 2]" 1
2218 1 106 SER H 1 107 SER H 2.305 . 2.886 2.537 2.202 2.798 . 0 0 "[ . 1 . 2]" 1
2219 1 106 SER H 1 107 SER HA 3.650 . 5.778 5.119 4.882 5.291 . 0 0 "[ . 1 . 2]" 1
2220 1 107 SER H 1 107 SER QB 2.740 . 3.821 2.942 2.556 3.276 . 0 0 "[ . 1 . 2]" 1
2221 1 107 SER H 1 108 ALA H 3.040 . 4.466 4.240 3.928 4.436 . 0 0 "[ . 1 . 2]" 1
2222 1 107 SER H 1 108 ALA HA 3.650 . 5.778 4.660 4.440 4.869 . 0 0 "[ . 1 . 2]" 1
2223 1 107 SER HA 1 108 ALA H 2.360 . 3.004 2.274 2.086 2.439 . 0 0 "[ . 1 . 2]" 1
2224 1 107 SER QB 1 108 ALA H 2.810 . 3.971 3.007 2.496 3.889 . 0 0 "[ . 1 . 2]" 1
2225 1 107 SER HB2 1 108 ALA H 3.120 . 4.638 3.427 2.534 4.509 . 0 0 "[ . 1 . 2]" 1
2226 1 107 SER HB3 1 108 ALA H 3.120 . 4.638 3.728 2.778 4.313 . 0 0 "[ . 1 . 2]" 1
2227 1 108 ALA H 1 108 ALA MB 2.825 . 4.004 2.413 2.202 2.567 . 0 0 "[ . 1 . 2]" 1
2228 1 108 ALA H 1 109 THR H 3.320 . 5.068 4.426 4.272 4.658 . 0 0 "[ . 1 . 2]" 1
2229 1 108 ALA H 1 109 THR HA 3.645 . 5.767 4.904 4.597 5.379 . 0 0 "[ . 1 . 2]" 1
2230 1 108 ALA H 1 121 GLN H 3.650 . 5.778 5.872 5.324 6.044 0.267 10 0 "[ . 1 . 2]" 1
2231 1 108 ALA HA 1 109 THR H 2.390 . 3.069 2.238 2.123 2.310 . 0 0 "[ . 1 . 2]" 1
2232 1 108 ALA HA 1 109 THR HB 3.630 . 5.734 4.559 4.448 4.683 . 0 0 "[ . 1 . 2]" 1
2233 1 108 ALA HA 1 109 THR MG 3.650 . 5.778 5.373 5.274 5.445 . 0 0 "[ . 1 . 2]" 1
2234 1 108 ALA HA 1 119 TRP HB3 3.195 . 4.799 4.317 3.781 4.589 . 0 0 "[ . 1 . 2]" 1
2235 1 108 ALA HA 1 121 GLN H 2.645 . 3.617 3.542 3.022 3.758 0.141 16 0 "[ . 1 . 2]" 1
2236 1 108 ALA HA 1 121 GLN HA 2.975 . 4.326 4.044 3.854 4.320 . 0 0 "[ . 1 . 2]" 1
2237 1 108 ALA HA 1 121 GLN QB 2.840 . 4.036 3.141 2.535 3.728 . 0 0 "[ . 1 . 2]" 1
2238 1 108 ALA HA 1 121 GLN QG 3.570 . 5.606 4.929 4.400 5.592 . 0 0 "[ . 1 . 2]" 1
2239 1 108 ALA HA 1 122 GLU H 3.650 . 5.778 6.073 5.878 6.288 0.511 6 1 "[ .+ 1 . 2]" 1
2240 1 108 ALA MB 1 109 THR H 2.495 . 3.294 2.744 2.645 2.868 . 0 0 "[ . 1 . 2]" 1
2241 1 108 ALA MB 1 109 THR HA 2.990 . 4.359 4.057 3.995 4.151 . 0 0 "[ . 1 . 2]" 1
2242 1 108 ALA MB 1 119 TRP H 3.530 . 5.519 5.179 4.912 5.386 . 0 0 "[ . 1 . 2]" 1
2243 1 108 ALA MB 1 119 TRP HB2 2.660 . 3.649 3.469 2.969 3.711 0.062 2 0 "[ . 1 . 2]" 1
2244 1 108 ALA MB 1 119 TRP HB3 2.695 . 3.724 2.056 1.884 2.264 . 0 0 "[ . 1 . 2]" 1
2245 1 108 ALA MB 1 119 TRP HD1 3.340 . 5.111 4.962 4.636 5.159 0.048 2 0 "[ . 1 . 2]" 1
2246 1 108 ALA MB 1 119 TRP HE3 2.600 . 3.520 2.468 2.216 2.687 . 0 0 "[ . 1 . 2]" 1
2247 1 108 ALA MB 1 119 TRP HZ3 3.040 . 4.466 3.802 3.365 4.185 . 0 0 "[ . 1 . 2]" 1
2248 1 108 ALA MB 1 120 ASP H 2.895 . 4.154 3.143 2.527 3.516 . 0 0 "[ . 1 . 2]" 1
2249 1 108 ALA MB 1 121 GLN H 2.420 . 3.133 2.491 2.027 2.997 . 0 0 "[ . 1 . 2]" 1
2250 1 108 ALA MB 1 121 GLN HA 2.985 . 4.348 3.661 3.094 4.187 . 0 0 "[ . 1 . 2]" 1
2251 1 108 ALA MB 1 121 GLN QB 2.510 . 3.326 1.902 1.751 2.131 0.049 14 0 "[ . 1 . 2]" 1
2252 1 108 ALA MB 1 121 GLN QG 2.920 . 4.208 3.424 2.522 3.897 . 0 0 "[ . 1 . 2]" 1
2253 1 108 ALA MB 1 122 GLU H 3.470 . 5.391 5.275 4.886 5.564 0.173 19 0 "[ . 1 . 2]" 1
2254 1 109 THR H 1 109 THR HB 2.565 . 3.445 2.635 2.546 2.686 . 0 0 "[ . 1 . 2]" 1
2255 1 109 THR H 1 109 THR MG 2.925 . 4.219 3.843 3.820 3.872 . 0 0 "[ . 1 . 2]" 1
2256 1 109 THR H 1 110 CYS H 3.230 . 4.874 4.364 4.293 4.402 . 0 0 "[ . 1 . 2]" 1
2257 1 109 THR H 1 111 ILE MD 3.070 . 4.530 4.302 3.870 4.569 0.039 2 0 "[ . 1 . 2]" 1
2258 1 109 THR H 1 119 TRP HE3 3.105 . 4.606 3.195 2.774 3.439 . 0 0 "[ . 1 . 2]" 1
2259 1 109 THR H 1 120 ASP H 2.680 . 3.692 2.480 2.263 2.679 . 0 0 "[ . 1 . 2]" 1
2260 1 109 THR H 1 120 ASP QB 3.500 . 5.455 3.341 1.798 3.900 0.002 13 0 "[ . 1 . 2]" 1
2261 1 109 THR H 1 121 GLN H 2.925 . 4.219 3.601 3.138 3.880 . 0 0 "[ . 1 . 2]" 1
2262 1 109 THR H 1 121 GLN QB 3.625 . 5.724 4.392 4.021 4.777 . 0 0 "[ . 1 . 2]" 1
2263 1 109 THR HA 1 109 THR MG 2.405 . 3.101 2.346 2.271 2.398 . 0 0 "[ . 1 . 2]" 1
2264 1 109 THR HA 1 110 CYS H 2.455 . 3.208 2.221 2.172 2.270 . 0 0 "[ . 1 . 2]" 1
2265 1 109 THR HA 1 110 CYS HA 3.175 . 4.756 4.390 4.288 4.442 . 0 0 "[ . 1 . 2]" 1
2266 1 109 THR HA 1 119 TRP HE3 3.435 . 5.315 3.032 2.768 3.215 . 0 0 "[ . 1 . 2]" 1
2267 1 109 THR HA 1 119 TRP HZ3 3.225 . 4.864 2.874 2.572 3.189 . 0 0 "[ . 1 . 2]" 1
2268 1 109 THR HB 1 110 CYS H 3.025 . 4.434 4.170 4.060 4.237 . 0 0 "[ . 1 . 2]" 1
2269 1 109 THR HB 1 110 CYS HA 3.445 . 5.337 4.989 4.855 5.148 . 0 0 "[ . 1 . 2]" 1
2270 1 109 THR HB 1 111 ILE MD 2.725 . 3.789 3.708 3.198 3.943 0.155 3 0 "[ . 1 . 2]" 1
2271 1 109 THR HB 1 119 TRP HA 3.650 . 5.778 5.220 4.988 5.509 . 0 0 "[ . 1 . 2]" 1
2272 1 109 THR HB 1 120 ASP H 3.220 . 4.853 3.870 3.735 4.103 . 0 0 "[ . 1 . 2]" 1
2273 1 109 THR HB 1 120 ASP HB2 3.170 . 4.746 4.353 2.673 4.834 0.088 16 0 "[ . 1 . 2]" 1
2274 1 109 THR HB 1 120 ASP HB3 3.170 . 4.746 3.705 3.128 4.599 . 0 0 "[ . 1 . 2]" 1
2275 1 109 THR HB 1 121 GLN H 3.650 . 5.778 5.785 5.369 6.036 0.258 15 0 "[ . 1 . 2]" 1
2276 1 109 THR MG 1 110 CYS H 2.470 . 3.240 2.666 2.554 2.782 . 0 0 "[ . 1 . 2]" 1
2277 1 109 THR MG 1 110 CYS HA 3.650 . 5.778 4.083 3.956 4.239 . 0 0 "[ . 1 . 2]" 1
2278 1 109 THR MG 1 110 CYS QB 3.240 . 4.896 4.042 3.709 4.293 . 0 0 "[ . 1 . 2]" 1
2279 1 109 THR MG 1 111 ILE H 3.650 . 5.778 4.548 4.241 4.847 . 0 0 "[ . 1 . 2]" 1
2280 1 109 THR MG 1 119 TRP HA 3.650 . 5.778 5.104 4.920 5.336 . 0 0 "[ . 1 . 2]" 1
2281 1 109 THR MG 1 119 TRP HE3 3.220 . 4.853 4.572 4.412 4.700 . 0 0 "[ . 1 . 2]" 1
2282 1 109 THR MG 1 119 TRP HZ3 3.120 . 4.638 4.416 4.216 4.573 . 0 0 "[ . 1 . 2]" 1
2283 1 109 THR MG 1 120 ASP H 3.650 . 5.778 4.716 4.440 4.858 . 0 0 "[ . 1 . 2]" 1
2284 1 110 CYS H 1 110 CYS QB 2.560 . 3.434 2.284 2.101 2.514 . 0 0 "[ . 1 . 2]" 1
2285 1 110 CYS H 1 111 ILE H 3.270 . 4.960 4.458 4.374 4.537 . 0 0 "[ . 1 . 2]" 1
2286 1 110 CYS H 1 111 ILE MD 3.175 . 4.756 4.625 4.396 4.806 0.050 17 0 "[ . 1 . 2]" 1
2287 1 110 CYS H 1 119 TRP HA 3.355 . 5.143 4.237 3.899 4.524 . 0 0 "[ . 1 . 2]" 1
2288 1 110 CYS H 1 119 TRP HE3 2.830 . 4.015 3.129 2.930 3.373 . 0 0 "[ . 1 . 2]" 1
2289 1 110 CYS H 1 119 TRP HZ3 2.655 . 3.638 2.778 2.532 3.078 . 0 0 "[ . 1 . 2]" 1
2290 1 110 CYS H 1 120 ASP H 3.650 . 5.778 4.892 4.655 5.215 . 0 0 "[ . 1 . 2]" 1
2291 1 110 CYS HA 1 111 ILE H 2.465 . 3.230 2.071 2.000 2.181 . 0 0 "[ . 1 . 2]" 1
2292 1 110 CYS HA 1 111 ILE HA 3.185 . 4.778 4.365 4.282 4.456 . 0 0 "[ . 1 . 2]" 1
2293 1 110 CYS HA 1 111 ILE MD 2.455 . 3.208 2.838 2.619 3.139 . 0 0 "[ . 1 . 2]" 1
2294 1 110 CYS HA 1 111 ILE MG 2.960 . 4.294 3.762 3.590 3.976 . 0 0 "[ . 1 . 2]" 1
2295 1 110 CYS HA 1 118 ILE H 3.110 . 4.616 4.397 4.174 4.626 0.010 9 0 "[ . 1 . 2]" 1
2296 1 110 CYS HA 1 119 TRP HA 2.905 . 4.176 2.173 1.873 2.429 . 0 0 "[ . 1 . 2]" 1
2297 1 110 CYS HA 1 119 TRP HB2 3.580 . 5.627 5.032 4.798 5.234 . 0 0 "[ . 1 . 2]" 1
2298 1 110 CYS HA 1 119 TRP HB3 3.140 . 4.681 4.414 3.951 4.742 0.061 15 0 "[ . 1 . 2]" 1
2299 1 110 CYS HA 1 119 TRP HD1 3.650 . 5.778 5.577 5.199 5.857 0.080 4 0 "[ . 1 . 2]" 1
2300 1 110 CYS HA 1 120 ASP H 3.030 . 4.444 3.725 3.338 4.079 . 0 0 "[ . 1 . 2]" 1
2301 1 110 CYS HA 1 120 ASP QB 3.570 . 5.606 5.044 4.527 5.842 0.236 17 0 "[ . 1 . 2]" 1
2302 1 110 CYS QB 1 111 ILE HA 3.570 . 5.606 4.443 3.987 4.806 . 0 0 "[ . 1 . 2]" 1
2303 1 110 CYS QB 1 119 TRP HH2 3.570 . 5.606 3.562 3.180 4.910 . 0 0 "[ . 1 . 2]" 1
2304 1 110 CYS QB 1 119 TRP HZ3 3.375 . 5.186 3.226 2.746 4.699 . 0 0 "[ . 1 . 2]" 1
2305 1 111 ILE H 1 111 ILE MD 2.425 . 3.144 1.848 1.764 1.994 0.036 10 0 "[ . 1 . 2]" 1
2306 1 111 ILE H 1 112 ILE H 3.140 . 4.681 4.452 4.390 4.540 . 0 0 "[ . 1 . 2]" 1
2307 1 111 ILE H 1 117 VAL HA 3.420 . 5.283 4.617 4.334 4.794 . 0 0 "[ . 1 . 2]" 1
2308 1 111 ILE H 1 117 VAL HB 3.175 . 4.756 4.231 3.899 4.570 . 0 0 "[ . 1 . 2]" 1
2309 1 111 ILE H 1 117 VAL MG1 3.650 . 5.778 4.952 4.614 5.272 . 0 0 "[ . 1 . 2]" 1
2310 1 111 ILE H 1 117 VAL MG2 3.650 . 5.778 5.327 4.701 5.644 . 0 0 "[ . 1 . 2]" 1
2311 1 111 ILE H 1 118 ILE H 2.800 . 3.950 3.148 2.867 3.385 . 0 0 "[ . 1 . 2]" 1
2312 1 111 ILE H 1 119 TRP H 3.325 . 5.079 4.854 4.634 5.064 . 0 0 "[ . 1 . 2]" 1
2313 1 111 ILE H 1 119 TRP HA 2.805 . 3.961 3.378 3.169 3.646 . 0 0 "[ . 1 . 2]" 1
2314 1 111 ILE H 1 119 TRP HE3 3.650 . 5.778 5.395 5.097 5.822 0.045 12 0 "[ . 1 . 2]" 1
2315 1 111 ILE H 1 120 ASP HA 3.650 . 5.778 5.639 5.293 6.033 0.255 2 0 "[ . 1 . 2]" 1
2316 1 111 ILE H 1 120 ASP QB 3.570 . 5.606 4.973 4.443 5.761 0.156 17 0 "[ . 1 . 2]" 1
2317 1 111 ILE HA 1 111 ILE MD 2.990 . 4.359 3.639 3.547 3.720 . 0 0 "[ . 1 . 2]" 1
2318 1 111 ILE HA 1 111 ILE MG 2.595 . 3.509 2.364 2.297 2.413 . 0 0 "[ . 1 . 2]" 1
2319 1 111 ILE HA 1 112 ILE H 2.620 . 3.563 2.437 2.303 2.549 . 0 0 "[ . 1 . 2]" 1
2320 1 111 ILE HA 1 112 ILE HB 3.490 . 5.433 4.960 4.717 5.223 . 0 0 "[ . 1 . 2]" 1
2321 1 111 ILE HA 1 112 ILE MD 3.235 . 4.885 3.934 3.557 4.338 . 0 0 "[ . 1 . 2]" 1
2322 1 111 ILE HA 1 112 ILE HG12 3.060 . 4.509 3.701 3.261 3.926 . 0 0 "[ . 1 . 2]" 1
2323 1 111 ILE HA 1 112 ILE HG13 3.650 . 5.778 5.439 5.026 5.664 . 0 0 "[ . 1 . 2]" 1
2324 1 111 ILE HA 1 117 VAL HB 3.380 . 5.197 4.862 4.434 5.251 0.054 4 0 "[ . 1 . 2]" 1
2325 1 111 ILE HA 1 117 VAL MG1 3.480 . 5.412 4.529 4.144 4.956 . 0 0 "[ . 1 . 2]" 1
2326 1 111 ILE HB 1 111 ILE MD 2.525 . 3.359 3.226 3.179 3.280 . 0 0 "[ . 1 . 2]" 1
2327 1 111 ILE HB 1 112 ILE H 2.450 . 3.197 2.379 2.273 2.459 . 0 0 "[ . 1 . 2]" 1
2328 1 111 ILE HB 1 112 ILE MD 3.395 . 5.229 5.097 4.894 5.342 0.113 8 0 "[ . 1 . 2]" 1
2329 1 111 ILE MD 1 112 ILE H 3.360 . 5.154 4.645 4.517 4.772 . 0 0 "[ . 1 . 2]" 1
2330 1 111 ILE MD 1 112 ILE MD 3.650 . 5.778 5.842 5.603 5.964 0.186 8 0 "[ . 1 . 2]" 1
2331 1 111 ILE MD 1 118 ILE H 2.980 . 4.337 3.881 3.529 4.196 . 0 0 "[ . 1 . 2]" 1
2332 1 111 ILE MD 1 120 ASP H 2.750 . 3.842 2.948 2.553 3.209 . 0 0 "[ . 1 . 2]" 1
2333 1 111 ILE MD 1 120 ASP HA 2.475 . 3.251 2.772 2.302 3.283 0.032 2 0 "[ . 1 . 2]" 1
2334 1 111 ILE MD 1 120 ASP HB2 2.620 . 3.563 3.324 2.260 3.722 0.159 1 0 "[ . 1 . 2]" 1
2335 1 111 ILE MD 1 120 ASP HB3 2.620 . 3.563 2.406 1.813 3.865 0.302 19 0 "[ . 1 . 2]" 1
2336 1 111 ILE MD 1 121 GLN H 3.270 . 4.960 4.732 4.267 5.101 0.141 2 0 "[ . 1 . 2]" 1
2337 1 111 ILE MG 1 112 ILE MD 3.475 . 5.401 5.299 5.048 5.608 0.207 8 0 "[ . 1 . 2]" 1
2338 1 111 ILE MG 1 119 TRP HA 3.265 . 4.950 4.728 4.360 5.005 0.055 6 0 "[ . 1 . 2]" 1
2339 1 111 ILE MG 1 119 TRP HE3 3.650 . 5.778 5.735 5.438 5.938 0.160 6 0 "[ . 1 . 2]" 1
2340 1 112 ILE H 1 112 ILE HB 2.450 . 3.197 2.577 2.425 2.831 . 0 0 "[ . 1 . 2]" 1
2341 1 112 ILE H 1 112 ILE MD 2.590 . 3.499 3.206 2.953 3.393 . 0 0 "[ . 1 . 2]" 1
2342 1 112 ILE H 1 112 ILE HG12 2.555 . 3.423 2.235 1.950 2.527 . 0 0 "[ . 1 . 2]" 1
2343 1 112 ILE H 1 112 ILE HG13 2.915 . 4.197 3.695 3.495 3.950 . 0 0 "[ . 1 . 2]" 1
2344 1 112 ILE H 1 112 ILE MG 2.810 . 3.971 3.780 3.729 3.856 . 0 0 "[ . 1 . 2]" 1
2345 1 112 ILE H 1 117 VAL MG1 3.245 . 4.907 4.220 3.720 4.914 0.007 4 0 "[ . 1 . 2]" 1
2346 1 112 ILE HA 1 112 ILE MD 2.480 . 3.262 2.230 1.966 2.467 . 0 0 "[ . 1 . 2]" 1
2347 1 112 ILE HA 1 112 ILE HG12 2.745 . 3.832 3.215 3.075 3.392 . 0 0 "[ . 1 . 2]" 1
2348 1 112 ILE HA 1 112 ILE HG13 2.960 . 4.294 3.832 3.704 3.947 . 0 0 "[ . 1 . 2]" 1
2349 1 112 ILE HA 1 112 ILE MG 2.200 . 2.660 2.335 2.162 2.488 . 0 0 "[ . 1 . 2]" 1
2350 1 112 ILE HA 1 113 SER H 2.355 . 2.993 2.217 2.110 2.303 . 0 0 "[ . 1 . 2]" 1
2351 1 112 ILE HA 1 117 VAL HA 2.850 . 4.057 2.341 2.087 2.700 . 0 0 "[ . 1 . 2]" 1
2352 1 112 ILE HA 1 117 VAL MG1 2.490 . 3.283 2.456 1.915 3.131 . 0 0 "[ . 1 . 2]" 1
2353 1 112 ILE HA 1 118 ILE H 2.730 . 3.799 3.616 3.222 3.934 0.134 1 0 "[ . 1 . 2]" 1
2354 1 112 ILE HB 1 112 ILE MD 2.540 . 3.391 3.218 3.163 3.264 . 0 0 "[ . 1 . 2]" 1
2355 1 112 ILE HB 1 113 SER H 2.890 . 4.143 4.187 4.047 4.253 0.109 10 0 "[ . 1 . 2]" 1
2356 1 112 ILE HB 1 113 SER HA 3.330 . 5.089 4.872 4.574 5.221 0.132 8 0 "[ . 1 . 2]" 1
2357 1 112 ILE HB 1 114 GLY H 3.650 . 5.778 3.958 3.602 4.417 . 0 0 "[ . 1 . 2]" 1
2358 1 112 ILE HB 1 117 VAL HA 3.650 . 5.778 5.341 5.061 5.705 . 0 0 "[ . 1 . 2]" 1
2359 1 112 ILE MD 1 112 ILE MG 2.100 . 2.445 1.970 1.825 2.080 . 0 0 "[ . 1 . 2]" 1
2360 1 112 ILE MD 1 114 GLY H 3.190 . 4.788 4.242 3.741 4.757 . 0 0 "[ . 1 . 2]" 1
2361 1 112 ILE MD 1 117 VAL HA 2.810 . 3.971 3.292 2.560 3.690 . 0 0 "[ . 1 . 2]" 1
2362 1 112 ILE MD 1 118 ILE H 3.145 . 4.692 4.663 3.865 4.971 0.279 1 0 "[ . 1 . 2]" 1
2363 1 112 ILE HG13 1 112 ILE MG 2.575 . 3.466 2.329 2.270 2.412 . 0 0 "[ . 1 . 2]" 1
2364 1 112 ILE MG 1 113 SER H 2.345 . 2.972 2.830 2.648 2.946 . 0 0 "[ . 1 . 2]" 1
2365 1 112 ILE MG 1 113 SER HA 3.020 . 4.423 3.952 3.471 4.242 . 0 0 "[ . 1 . 2]" 1
2366 1 112 ILE MG 1 114 GLY H 2.510 . 3.326 1.825 1.629 2.122 0.171 7 0 "[ . 1 . 2]" 1
2367 1 112 ILE MG 1 114 GLY HA2 3.185 . 4.778 2.475 2.160 3.029 . 0 0 "[ . 1 . 2]" 1
2368 1 112 ILE MG 1 115 ASP H 3.090 . 4.574 4.323 3.396 4.706 0.132 20 0 "[ . 1 . 2]" 1
2369 1 112 ILE MG 1 116 THR H 2.745 . 3.832 3.738 2.985 4.181 0.350 6 0 "[ . 1 . 2]" 1
2370 1 112 ILE MG 1 117 VAL HA 2.935 . 4.240 3.798 3.264 4.222 . 0 0 "[ . 1 . 2]" 1
2371 1 112 ILE MG 1 117 VAL MG1 2.705 . 3.746 3.057 2.095 3.733 . 0 0 "[ . 1 . 2]" 1
2372 1 113 SER H 1 113 SER QB 2.500 . 3.305 2.565 2.233 2.851 . 0 0 "[ . 1 . 2]" 1
2373 1 113 SER H 1 114 GLY H 2.850 . 4.057 2.308 2.143 2.490 . 0 0 "[ . 1 . 2]" 1
2374 1 113 SER H 1 114 GLY HA2 3.345 . 5.122 4.766 4.595 4.946 . 0 0 "[ . 1 . 2]" 1
2375 1 113 SER H 1 114 GLY HA3 3.420 . 5.283 4.995 4.730 5.175 . 0 0 "[ . 1 . 2]" 1
2376 1 113 SER H 1 116 THR H 2.530 . 3.369 3.536 3.217 3.757 0.388 14 0 "[ . 1 . 2]" 1
2377 1 113 SER H 1 116 THR HA 3.310 . 5.047 4.913 4.749 5.095 0.048 20 0 "[ . 1 . 2]" 1
2378 1 113 SER H 1 116 THR MG 3.080 . 4.552 3.724 3.448 4.068 . 0 0 "[ . 1 . 2]" 1
2379 1 113 SER H 1 117 VAL H 3.420 . 5.283 4.635 4.350 4.897 . 0 0 "[ . 1 . 2]" 1
2380 1 113 SER H 1 117 VAL HA 2.610 . 3.542 2.627 2.245 3.134 . 0 0 "[ . 1 . 2]" 1
2381 1 113 SER H 1 117 VAL MG1 3.415 . 5.272 3.842 3.420 4.465 . 0 0 "[ . 1 . 2]" 1
2382 1 113 SER H 1 117 VAL MG2 3.650 . 5.778 5.217 4.893 5.618 . 0 0 "[ . 1 . 2]" 1
2383 1 113 SER H 1 118 ILE H 2.995 . 4.369 3.474 3.025 3.982 . 0 0 "[ . 1 . 2]" 1
2384 1 113 SER HA 1 114 GLY H 2.585 . 3.488 3.350 3.241 3.445 . 0 0 "[ . 1 . 2]" 1
2385 1 113 SER HA 1 115 ASP H 3.485 . 5.423 5.313 4.588 5.692 0.269 20 0 "[ . 1 . 2]" 1
2386 1 113 SER HA 1 116 THR H 3.620 . 5.713 5.189 4.929 5.394 . 0 0 "[ . 1 . 2]" 1
2387 1 113 SER QB 1 114 GLY H 2.930 . 4.229 3.292 2.476 3.796 . 0 0 "[ . 1 . 2]" 1
2388 1 113 SER QB 1 116 THR H 2.975 . 4.326 3.475 2.334 4.412 0.085 20 0 "[ . 1 . 2]" 1
2389 1 113 SER QB 1 116 THR MG 2.630 . 3.585 2.942 2.040 3.546 . 0 0 "[ . 1 . 2]" 1
2390 1 113 SER QB 1 117 VAL MG1 3.570 . 5.606 5.386 4.764 5.839 0.234 5 0 "[ . 1 . 2]" 1
2391 1 113 SER QB 1 118 ILE H 3.005 . 4.391 4.123 3.685 4.601 0.210 8 0 "[ . 1 . 2]" 1
2392 1 113 SER QB 1 118 ILE MG 2.470 . 3.240 2.896 1.932 3.321 0.081 20 0 "[ . 1 . 2]" 1
2393 1 114 GLY H 1 114 GLY HA2 2.315 . 2.907 2.546 2.391 2.711 . 0 0 "[ . 1 . 2]" 1
2394 1 114 GLY H 1 115 ASP H 2.615 . 3.552 3.271 2.105 3.672 0.120 20 0 "[ . 1 . 2]" 1
2395 1 114 GLY H 1 115 ASP HA 3.555 . 5.573 4.871 4.303 5.312 . 0 0 "[ . 1 . 2]" 1
2396 1 114 GLY H 1 116 THR H 2.980 . 4.337 2.862 2.306 3.351 . 0 0 "[ . 1 . 2]" 1
2397 1 114 GLY H 1 116 THR HA 3.650 . 5.778 4.953 4.647 5.298 . 0 0 "[ . 1 . 2]" 1
2398 1 114 GLY H 1 116 THR MG 3.540 . 5.541 4.343 3.744 4.842 . 0 0 "[ . 1 . 2]" 1
2399 1 114 GLY HA2 1 116 THR H 3.255 . 4.928 4.461 4.178 4.952 0.024 5 0 "[ . 1 . 2]" 1
2400 1 114 GLY HA3 1 115 ASP H 2.290 . 2.853 2.409 2.128 2.923 0.069 5 0 "[ . 1 . 2]" 1
2401 1 115 ASP H 1 115 ASP HB2 2.700 . 3.735 3.070 2.251 3.760 0.025 5 0 "[ . 1 . 2]" 1
2402 1 115 ASP H 1 115 ASP QB 2.445 . 3.187 2.544 2.227 2.976 . 0 0 "[ . 1 . 2]" 1
2403 1 115 ASP H 1 115 ASP HB3 2.700 . 3.735 2.974 2.459 3.710 . 0 0 "[ . 1 . 2]" 1
2404 1 115 ASP H 1 116 THR H 2.385 . 3.058 2.441 1.921 2.661 . 0 0 "[ . 1 . 2]" 1
2405 1 115 ASP H 1 116 THR MG 2.835 . 4.025 3.835 3.196 4.252 0.226 9 0 "[ . 1 . 2]" 1
2406 1 115 ASP HA 1 115 ASP HB2 2.365 . 3.015 2.622 2.419 3.033 0.019 20 0 "[ . 1 . 2]" 1
2407 1 115 ASP HA 1 115 ASP QB 2.180 . 2.617 2.292 2.164 2.460 . 0 0 "[ . 1 . 2]" 1
2408 1 115 ASP HA 1 115 ASP HB3 2.365 . 3.015 2.605 2.388 3.031 0.016 3 0 "[ . 1 . 2]" 1
2409 1 115 ASP QB 1 116 THR H 2.755 . 3.853 3.271 2.542 3.865 0.012 8 0 "[ . 1 . 2]" 1
2410 1 115 ASP QB 1 116 THR HB 2.785 . 3.918 3.688 3.155 4.044 0.127 1 0 "[ . 1 . 2]" 1
2411 1 115 ASP QB 1 116 THR MG 2.790 . 3.928 3.587 2.683 4.206 0.278 17 0 "[ . 1 . 2]" 1
2412 1 115 ASP HB2 1 116 THR H 3.105 . 4.606 3.773 2.853 4.338 . 0 0 "[ . 1 . 2]" 1
2413 1 115 ASP HB3 1 116 THR H 3.105 . 4.606 3.788 2.580 4.443 . 0 0 "[ . 1 . 2]" 1
2414 1 116 THR H 1 116 THR HB 2.690 . 3.714 3.289 3.097 3.413 . 0 0 "[ . 1 . 2]" 1
2415 1 116 THR H 1 116 THR MG 2.325 . 2.929 2.465 2.267 2.665 . 0 0 "[ . 1 . 2]" 1
2416 1 116 THR H 1 117 VAL H 3.145 . 4.692 4.362 4.243 4.477 . 0 0 "[ . 1 . 2]" 1
2417 1 116 THR H 1 117 VAL HA 3.410 . 5.261 4.671 4.515 4.876 . 0 0 "[ . 1 . 2]" 1
2418 1 116 THR H 1 117 VAL MG1 3.490 . 5.433 4.777 4.326 5.173 . 0 0 "[ . 1 . 2]" 1
2419 1 116 THR HA 1 116 THR HB 2.305 . 2.886 2.502 2.429 2.583 . 0 0 "[ . 1 . 2]" 1
2420 1 116 THR HA 1 116 THR MG 2.575 . 3.466 3.214 3.182 3.236 . 0 0 "[ . 1 . 2]" 1
2421 1 116 THR HA 1 117 VAL H 2.520 . 3.348 2.564 2.415 2.738 . 0 0 "[ . 1 . 2]" 1
2422 1 116 THR HA 1 117 VAL HA 3.195 . 4.799 4.408 4.325 4.477 . 0 0 "[ . 1 . 2]" 1
2423 1 116 THR HA 1 117 VAL MG1 2.785 . 3.918 3.487 3.235 3.758 . 0 0 "[ . 1 . 2]" 1
2424 1 116 THR HA 1 117 VAL MG2 3.300 . 5.025 3.831 3.610 4.269 . 0 0 "[ . 1 . 2]" 1
2425 1 116 THR HB 1 117 VAL H 2.935 . 4.240 3.726 3.463 3.960 . 0 0 "[ . 1 . 2]" 1
2426 1 116 THR HB 1 118 ILE MG 3.365 . 5.165 4.934 4.622 5.334 0.169 7 0 "[ . 1 . 2]" 1
2427 1 116 THR MG 1 117 VAL H 2.570 . 3.455 2.999 2.569 3.314 . 0 0 "[ . 1 . 2]" 1
2428 1 116 THR MG 1 117 VAL HA 2.885 . 4.133 3.784 3.394 4.024 . 0 0 "[ . 1 . 2]" 1
2429 1 116 THR MG 1 118 ILE H 3.210 . 4.832 4.290 3.889 4.442 . 0 0 "[ . 1 . 2]" 1
2430 1 116 THR MG 1 118 ILE HB 3.300 . 5.025 4.888 3.119 5.266 0.241 19 0 "[ . 1 . 2]" 1
2431 1 116 THR MG 1 118 ILE MG 2.100 . 2.445 2.324 2.114 2.587 0.142 7 0 "[ . 1 . 2]" 1
2432 1 117 VAL H 1 117 VAL HB 2.860 . 4.079 3.725 3.626 3.805 . 0 0 "[ . 1 . 2]" 1
2433 1 117 VAL H 1 117 VAL MG1 2.835 . 4.025 2.760 2.576 2.938 . 0 0 "[ . 1 . 2]" 1
2434 1 117 VAL H 1 117 VAL MG2 2.335 . 2.950 2.016 1.827 2.229 . 0 0 "[ . 1 . 2]" 1
2435 1 117 VAL H 1 118 ILE H 3.220 . 4.853 4.395 4.328 4.447 . 0 0 "[ . 1 . 2]" 1
2436 1 117 VAL H 1 118 ILE MG 2.955 . 4.283 4.043 3.782 4.493 0.210 7 0 "[ . 1 . 2]" 1
2437 1 117 VAL HA 1 117 VAL MG1 2.680 . 3.692 2.318 2.220 2.446 . 0 0 "[ . 1 . 2]" 1
2438 1 117 VAL HA 1 117 VAL MG2 2.685 . 3.703 3.186 3.146 3.226 . 0 0 "[ . 1 . 2]" 1
2439 1 117 VAL HA 1 118 ILE H 2.385 . 3.058 2.173 2.074 2.250 . 0 0 "[ . 1 . 2]" 1
2440 1 117 VAL HA 1 118 ILE HA 3.120 . 4.638 4.412 4.312 4.496 . 0 0 "[ . 1 . 2]" 1
2441 1 117 VAL HA 1 118 ILE MG 2.720 . 3.778 3.687 3.092 3.920 0.142 13 0 "[ . 1 . 2]" 1
2442 1 117 VAL HB 1 118 ILE H 2.525 . 3.359 3.169 3.029 3.361 0.002 15 0 "[ . 1 . 2]" 1
2443 1 117 VAL MG1 1 118 ILE H 2.920 . 4.208 3.876 3.700 4.018 . 0 0 "[ . 1 . 2]" 1
2444 1 117 VAL MG2 1 118 ILE H 2.835 . 4.025 3.915 3.709 4.014 . 0 0 "[ . 1 . 2]" 1
2445 1 117 VAL MG2 1 118 ILE HA 2.840 . 4.036 3.894 3.560 4.088 0.052 17 0 "[ . 1 . 2]" 1
2446 1 117 VAL MG2 1 119 TRP H 3.650 . 5.778 5.650 5.203 5.963 0.186 17 0 "[ . 1 . 2]" 1
2447 1 118 ILE H 1 118 ILE MG 2.460 . 3.219 2.947 2.183 3.189 . 0 0 "[ . 1 . 2]" 1
2448 1 118 ILE H 1 119 TRP H 3.080 . 4.552 4.425 4.331 4.489 . 0 0 "[ . 1 . 2]" 1
2449 1 118 ILE HA 1 118 ILE MG 2.205 . 2.671 2.382 2.219 3.096 0.425 7 0 "[ . 1 . 2]" 1
2450 1 118 ILE HA 1 119 TRP H 2.405 . 3.101 2.354 2.089 2.441 . 0 0 "[ . 1 . 2]" 1
2451 1 118 ILE HA 1 119 TRP HA 3.140 . 4.681 4.349 4.270 4.424 . 0 0 "[ . 1 . 2]" 1
2452 1 118 ILE HA 1 119 TRP HD1 3.065 . 4.520 3.898 3.279 4.407 . 0 0 "[ . 1 . 2]" 1
2453 1 118 ILE HB 1 119 TRP H 2.490 . 3.283 2.404 2.087 3.575 0.292 7 0 "[ . 1 . 2]" 1
2454 1 118 ILE MG 1 119 TRP HD1 3.650 . 5.778 5.103 4.514 5.864 0.087 7 0 "[ . 1 . 2]" 1
2455 1 119 TRP H 1 119 TRP HB2 2.535 . 3.380 2.390 2.293 2.597 . 0 0 "[ . 1 . 2]" 1
2456 1 119 TRP H 1 119 TRP HB3 2.700 . 3.735 3.580 3.500 3.675 . 0 0 "[ . 1 . 2]" 1
2457 1 119 TRP H 1 119 TRP HD1 2.615 . 3.552 2.808 2.407 3.078 . 0 0 "[ . 1 . 2]" 1
2458 1 119 TRP H 1 119 TRP HE1 3.175 . 4.756 4.880 4.547 5.123 0.367 5 0 "[ . 1 . 2]" 1
2459 1 119 TRP H 1 120 ASP H 3.275 . 4.971 4.575 4.505 4.649 . 0 0 "[ . 1 . 2]" 1
2460 1 119 TRP HA 1 119 TRP HE3 3.035 . 4.455 2.911 2.639 3.280 . 0 0 "[ . 1 . 2]" 1
2461 1 119 TRP HA 1 120 ASP H 2.465 . 3.230 2.305 2.218 2.404 . 0 0 "[ . 1 . 2]" 1
2462 1 119 TRP HA 1 120 ASP HA 3.145 . 4.692 4.366 4.279 4.422 . 0 0 "[ . 1 . 2]" 1
2463 1 119 TRP HB2 1 121 GLN H 2.670 . 3.671 3.476 3.009 3.782 0.112 15 0 "[ . 1 . 2]" 1
2464 1 119 TRP HB3 1 121 GLN H 2.720 . 3.778 2.691 2.180 3.152 . 0 0 "[ . 1 . 2]" 1
2465 1 119 TRP HE3 1 120 ASP H 3.170 . 4.746 3.501 3.256 3.973 . 0 0 "[ . 1 . 2]" 1
2466 1 120 ASP H 1 120 ASP QB 2.630 . 3.585 2.574 2.254 2.754 . 0 0 "[ . 1 . 2]" 1
2467 1 120 ASP H 1 121 GLN H 2.560 . 3.434 2.573 2.432 2.745 . 0 0 "[ . 1 . 2]" 1
2468 1 120 ASP HA 1 121 GLN H 2.655 . 3.638 3.319 3.185 3.529 . 0 0 "[ . 1 . 2]" 1
2469 1 121 GLN H 1 121 GLN QB 2.995 . 4.369 2.250 2.104 2.562 . 0 0 "[ . 1 . 2]" 1
2470 1 121 GLN H 1 122 GLU H 3.315 . 5.057 4.513 4.390 4.633 . 0 0 "[ . 1 . 2]" 1
2471 1 121 GLN HA 1 121 GLN QG 2.630 . 3.585 2.697 2.411 3.297 . 0 0 "[ . 1 . 2]" 1
2472 1 121 GLN QB 1 122 GLU H 2.750 . 3.842 3.541 2.201 3.820 . 0 0 "[ . 1 . 2]" 1
2473 1 121 GLN QB 1 123 THR H 3.230 . 4.874 3.996 3.318 4.456 . 0 0 "[ . 1 . 2]" 1
2474 1 121 GLN QB 1 123 THR HA 3.650 . 5.778 4.726 4.278 5.223 . 0 0 "[ . 1 . 2]" 1
2475 1 121 GLN QG 1 122 GLU H 2.345 . 2.972 2.779 2.166 3.264 0.292 11 0 "[ . 1 . 2]" 1
2476 1 121 GLN QG 1 122 GLU HA 2.960 . 4.294 4.192 3.895 4.385 0.091 9 0 "[ . 1 . 2]" 1
2477 1 121 GLN QG 1 123 THR H 2.620 . 3.563 2.120 1.782 2.658 0.018 12 0 "[ . 1 . 2]" 1
2478 1 121 GLN QG 1 123 THR MG 3.570 . 5.606 4.391 3.973 4.975 . 0 0 "[ . 1 . 2]" 1
2479 1 122 GLU H 1 122 GLU HB2 2.845 . 4.047 2.495 2.358 3.536 . 0 0 "[ . 1 . 2]" 1
2480 1 122 GLU H 1 122 GLU QB 2.500 . 3.305 2.340 2.167 2.448 . 0 0 "[ . 1 . 2]" 1
2481 1 122 GLU H 1 122 GLU HB3 2.845 . 4.047 3.257 2.411 3.646 . 0 0 "[ . 1 . 2]" 1
2482 1 122 GLU H 1 122 GLU QG 3.145 . 4.692 2.825 2.065 4.054 . 0 0 "[ . 1 . 2]" 1
2483 1 122 GLU H 1 123 THR H 2.830 . 4.015 2.651 2.504 2.823 . 0 0 "[ . 1 . 2]" 1
2484 1 122 GLU H 1 125 ILE MD 3.650 . 5.778 4.713 3.790 5.587 . 0 0 "[ . 1 . 2]" 1
2485 1 122 GLU HA 1 122 GLU HB2 2.400 . 3.090 2.844 2.417 3.034 . 0 0 "[ . 1 . 2]" 1
2486 1 122 GLU HA 1 122 GLU HB3 2.400 . 3.090 2.643 2.445 3.030 . 0 0 "[ . 1 . 2]" 1
2487 1 122 GLU HA 1 122 GLU QG 2.625 . 3.574 2.714 2.366 3.353 . 0 0 "[ . 1 . 2]" 1
2488 1 122 GLU HA 1 123 THR HA 3.390 . 5.219 4.861 4.714 4.997 . 0 0 "[ . 1 . 2]" 1
2489 1 122 GLU HA 1 123 THR HB 3.200 . 4.810 4.439 4.184 4.651 . 0 0 "[ . 1 . 2]" 1
2490 1 122 GLU QB 1 122 GLU QG 1.990 . 2.208 2.030 1.975 2.098 . 0 0 "[ . 1 . 2]" 1
2491 1 122 GLU QB 1 123 THR H 2.315 . 2.907 2.499 2.336 3.221 0.313 3 0 "[ . 1 . 2]" 1
2492 1 122 GLU QB 1 123 THR HA 3.385 . 5.208 4.566 4.408 5.049 . 0 0 "[ . 1 . 2]" 1
2493 1 122 GLU HB2 1 123 THR H 2.605 . 3.531 2.894 2.379 3.784 0.253 7 0 "[ . 1 . 2]" 1
2494 1 122 GLU HB3 1 123 THR H 2.605 . 3.531 3.249 2.363 3.655 0.124 3 0 "[ . 1 . 2]" 1
2495 1 122 GLU QG 1 123 THR H 3.260 . 4.939 3.868 1.941 4.331 . 0 0 "[ . 1 . 2]" 1
2496 1 122 GLU QG 1 123 THR MG 3.570 . 5.606 3.963 2.103 5.436 . 0 0 "[ . 1 . 2]" 1
2497 1 123 THR H 1 123 THR HB 2.645 . 3.617 3.520 3.356 3.644 0.028 12 0 "[ . 1 . 2]" 1
2498 1 123 THR H 1 123 THR MG 2.590 . 3.499 3.006 2.633 3.359 . 0 0 "[ . 1 . 2]" 1
2499 1 123 THR H 1 125 ILE MD 2.950 . 4.273 3.664 3.072 4.442 0.170 12 0 "[ . 1 . 2]" 1
2500 1 123 THR H 1 125 ILE HG13 3.395 . 5.229 4.569 3.938 5.377 0.148 10 0 "[ . 1 . 2]" 1
2501 1 123 THR HA 1 123 THR MG 2.555 . 3.423 3.221 3.183 3.247 . 0 0 "[ . 1 . 2]" 1
2502 1 123 THR HB 1 125 ILE MD 3.505 . 5.466 4.878 4.290 5.330 . 0 0 "[ . 1 . 2]" 1
2503 1 123 THR MG 1 124 PRO HA 3.100 . 4.595 4.204 3.987 4.480 . 0 0 "[ . 1 . 2]" 1
2504 1 123 THR MG 1 125 ILE H 3.535 . 5.530 4.506 4.051 4.773 . 0 0 "[ . 1 . 2]" 1
2505 1 123 THR MG 1 125 ILE HA 2.900 . 4.165 4.082 3.818 4.305 0.140 1 0 "[ . 1 . 2]" 1
2506 1 124 PRO HA 1 125 ILE H 2.375 . 3.036 2.209 2.126 2.307 . 0 0 "[ . 1 . 2]" 1
2507 1 124 PRO HA 1 125 ILE HA 3.160 . 4.724 4.459 4.387 4.531 . 0 0 "[ . 1 . 2]" 1
2508 1 124 PRO HA 1 125 ILE MD 3.020 . 4.423 4.034 3.028 4.670 0.247 16 0 "[ . 1 . 2]" 1
2509 1 125 ILE H 1 125 ILE HB 2.460 . 3.219 2.697 2.465 3.025 . 0 0 "[ . 1 . 2]" 1
2510 1 125 ILE H 1 125 ILE MD 2.460 . 3.219 3.305 1.908 3.846 0.627 19 7 "[* - . * 1 .* *+*]" 1
2511 1 125 ILE H 1 125 ILE HG12 3.425 . 5.294 4.202 3.651 4.624 . 0 0 "[ . 1 . 2]" 1
2512 1 125 ILE H 1 125 ILE HG13 2.840 . 4.036 2.997 2.253 3.620 . 0 0 "[ . 1 . 2]" 1
2513 1 125 ILE H 1 125 ILE MG 2.885 . 4.133 3.862 3.771 4.006 . 0 0 "[ . 1 . 2]" 1
2514 1 125 ILE H 1 126 CYS H 3.150 . 4.702 4.322 4.193 4.442 . 0 0 "[ . 1 . 2]" 1
2515 1 125 ILE HA 1 125 ILE MD 3.145 . 4.692 3.746 3.518 3.931 . 0 0 "[ . 1 . 2]" 1
2516 1 125 ILE HA 1 125 ILE HG12 2.755 . 3.853 2.959 2.524 3.673 . 0 0 "[ . 1 . 2]" 1
2517 1 125 ILE HA 1 125 ILE HG13 2.690 . 3.714 2.719 2.453 3.049 . 0 0 "[ . 1 . 2]" 1
2518 1 125 ILE HA 1 125 ILE MG 2.335 . 2.950 2.309 2.218 2.461 . 0 0 "[ . 1 . 2]" 1
2519 1 125 ILE HA 1 126 CYS H 2.265 . 2.800 2.288 2.177 2.419 . 0 0 "[ . 1 . 2]" 1
2520 1 125 ILE HB 1 125 ILE MD 2.100 . 2.445 2.262 2.131 2.353 . 0 0 "[ . 1 . 2]" 1
2521 1 125 ILE HB 1 125 ILE HG13 2.405 . 3.101 2.718 2.524 2.993 . 0 0 "[ . 1 . 2]" 1
2522 1 125 ILE HB 1 126 CYS H 2.720 . 3.778 4.046 3.731 4.215 0.437 13 0 "[ . 1 . 2]" 1
2523 1 125 ILE HB 1 126 CYS HA 3.215 . 4.842 4.373 3.958 4.573 . 0 0 "[ . 1 . 2]" 1
2524 1 125 ILE HG12 1 125 ILE MG 2.100 . 2.445 2.161 1.954 2.334 . 0 0 "[ . 1 . 2]" 1
2525 1 125 ILE HG12 1 126 CYS H 3.395 . 5.229 4.723 4.299 5.481 0.252 14 0 "[ . 1 . 2]" 1
2526 1 125 ILE HG13 1 126 CYS H 3.285 . 4.993 4.846 4.566 5.130 0.137 11 0 "[ . 1 . 2]" 1
2527 1 125 ILE MG 1 126 CYS H 2.445 . 3.187 2.537 2.004 3.152 . 0 0 "[ . 1 . 2]" 1
2528 1 125 ILE MG 1 126 CYS HA 2.940 . 4.251 3.428 2.867 4.230 . 0 0 "[ . 1 . 2]" 1
2529 1 125 ILE MG 1 127 ASP H 3.150 . 4.702 3.614 3.236 4.303 . 0 0 "[ . 1 . 2]" 1
2530 1 126 CYS H 1 127 ASP H 3.000 . 4.380 4.156 3.966 4.424 0.044 14 0 "[ . 1 . 2]" 1
2531 1 126 CYS HA 1 127 ASP H 2.300 . 2.875 2.268 2.201 2.371 . 0 0 "[ . 1 . 2]" 1
2532 1 126 CYS HA 1 127 ASP HB2 3.350 . 5.133 4.759 4.521 4.914 . 0 0 "[ . 1 . 2]" 1
2533 1 126 CYS HA 1 127 ASP HB3 3.310 . 5.047 4.774 4.535 4.992 . 0 0 "[ . 1 . 2]" 1
2534 1 126 CYS HA 1 128 ARG H 3.355 . 5.143 4.012 3.743 4.273 . 0 0 "[ . 1 . 2]" 1
2535 1 126 CYS HB2 1 127 ASP H 3.300 . 5.025 4.484 4.276 4.575 . 0 0 "[ . 1 . 2]" 1
2536 1 126 CYS HB3 1 127 ASP H 3.300 . 5.025 3.732 3.449 3.968 . 0 0 "[ . 1 . 2]" 1
2537 1 127 ASP H 1 127 ASP HB2 2.495 . 3.294 2.586 2.427 2.680 . 0 0 "[ . 1 . 2]" 1
2538 1 127 ASP H 1 127 ASP HB3 2.665 . 3.660 2.563 2.413 2.765 . 0 0 "[ . 1 . 2]" 1
2539 1 127 ASP H 1 128 ARG H 2.810 . 3.971 2.671 2.479 2.851 . 0 0 "[ . 1 . 2]" 1
2540 1 127 ASP H 1 128 ARG HA 3.650 . 5.778 4.979 4.759 5.199 . 0 0 "[ . 1 . 2]" 1
2541 1 127 ASP H 1 128 ARG QB 3.540 . 5.541 4.535 4.157 4.886 . 0 0 "[ . 1 . 2]" 1
2542 1 127 ASP HA 1 128 ARG QB 3.180 . 4.767 4.584 4.131 5.067 0.300 13 0 "[ . 1 . 2]" 1
2543 1 127 ASP HB2 1 128 ARG H 2.785 . 3.918 3.806 3.624 3.951 0.033 13 0 "[ . 1 . 2]" 1
2544 1 127 ASP HB3 1 128 ARG H 2.480 . 3.262 2.506 2.333 2.677 . 0 0 "[ . 1 . 2]" 1
2545 1 128 ARG H 1 128 ARG HB2 2.665 . 3.660 2.988 2.519 3.822 0.162 17 0 "[ . 1 . 2]" 1
2546 1 128 ARG H 1 128 ARG HB3 2.665 . 3.660 3.314 2.616 4.009 0.349 9 0 "[ . 1 . 2]" 1
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