NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
441088 |
2ka7   |
16016 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ka7
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 2284
_Distance_constraint_stats_list.Viol_count 3963
_Distance_constraint_stats_list.Viol_total 6630.995
_Distance_constraint_stats_list.Viol_max 0.998
_Distance_constraint_stats_list.Viol_rms 0.0367
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0073
_Distance_constraint_stats_list.Viol_average_violations_only 0.0837
_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 2 LYS 0.364 0.107 8 0 "[ . 1 . 2]"
1 3 MET 1.399 0.144 15 0 "[ . 1 . 2]"
1 4 LYS 0.102 0.102 9 0 "[ . 1 . 2]"
1 5 LYS 2.966 0.089 4 0 "[ . 1 . 2]"
1 6 TYR 3.221 0.095 3 0 "[ . 1 . 2]"
1 7 THR 3.983 0.262 8 0 "[ . 1 . 2]"
1 8 LYS 12.789 0.713 17 4 "[ . **1 . + -]"
1 9 THR 3.727 0.100 6 0 "[ . 1 . 2]"
1 10 HIS 1.778 0.082 2 0 "[ . 1 . 2]"
1 11 GLU 2.210 0.176 16 0 "[ . 1 . 2]"
1 12 TRP 5.541 0.341 6 0 "[ . 1 . 2]"
1 13 VAL 5.839 0.127 20 0 "[ . 1 . 2]"
1 14 SER 1.763 0.784 9 1 "[ . +1 . 2]"
1 15 ILE 11.590 0.784 9 1 "[ . +1 . 2]"
1 16 GLU 2.471 0.620 9 1 "[ . +1 . 2]"
1 17 ASP 3.678 0.439 7 0 "[ . 1 . 2]"
1 18 LYS 4.798 0.193 9 0 "[ . 1 . 2]"
1 19 VAL 3.686 0.439 7 0 "[ . 1 . 2]"
1 20 ALA 5.853 0.426 9 0 "[ . 1 . 2]"
1 21 THR 2.896 0.124 18 0 "[ . 1 . 2]"
1 22 VAL 3.552 0.115 1 0 "[ . 1 . 2]"
1 23 GLY 3.448 0.098 7 0 "[ . 1 . 2]"
1 24 ILE 2.738 0.176 16 0 "[ . 1 . 2]"
1 25 THR 3.863 0.568 6 1 "[ .+ 1 . 2]"
1 26 ASN 6.196 0.784 2 2 "[ + -. 1 . 2]"
1 27 HIS 2.686 0.115 11 0 "[ . 1 . 2]"
1 28 ALA 6.818 0.998 15 2 "[ . 1 - + 2]"
1 29 GLN 12.666 0.998 15 2 "[ . 1 - + 2]"
1 30 GLU 7.428 0.701 13 4 "[ - .* 1 + . *2]"
1 31 GLN 3.860 0.734 5 5 "[ + * *-.* 2]"
1 32 LEU 2.308 0.081 2 0 "[ . 1 . 2]"
1 33 GLY 0.824 0.083 14 0 "[ . 1 . 2]"
1 34 ASP 4.161 0.929 7 2 "[ .-+ 1 . 2]"
1 35 VAL 6.081 0.131 1 0 "[ . 1 . 2]"
1 36 VAL 5.819 0.131 1 0 "[ . 1 . 2]"
1 37 TYR 5.916 0.107 14 0 "[ . 1 . 2]"
1 38 VAL 4.068 0.124 19 0 "[ . 1 . 2]"
1 39 ASP 5.746 0.276 6 0 "[ . 1 . 2]"
1 40 LEU 5.661 0.098 19 0 "[ . 1 . 2]"
1 41 PRO 6.560 0.111 4 0 "[ . 1 . 2]"
1 42 GLU 7.999 0.957 11 4 "[ .* -+ *. 2]"
1 43 VAL 6.841 0.116 10 0 "[ . 1 . 2]"
1 44 GLY 3.671 0.098 11 0 "[ . 1 . 2]"
1 45 ARG 4.790 0.314 1 0 "[ . 1 . 2]"
1 46 GLU 4.788 0.629 4 1 "[ +. 1 . 2]"
1 47 VAL 5.849 0.910 10 4 "[ *.* +- . 2]"
1 48 LYS 12.823 0.910 10 6 "[ *.- * +* . *2]"
1 49 LYS 2.104 0.118 5 0 "[ . 1 . 2]"
1 50 GLY 0.978 0.081 7 0 "[ . 1 . 2]"
1 51 GLU 8.953 0.424 11 0 "[ . 1 . 2]"
1 52 VAL 9.110 0.407 13 0 "[ . 1 . 2]"
1 53 VAL 7.262 0.136 4 0 "[ . 1 . 2]"
1 54 ALA 3.283 0.110 5 0 "[ . 1 . 2]"
1 55 SER 6.874 0.388 2 0 "[ . 1 . 2]"
1 56 ILE 8.806 0.335 6 0 "[ . 1 . 2]"
1 57 GLU 3.112 0.088 6 0 "[ . 1 . 2]"
1 58 SER 2.174 0.088 13 0 "[ . 1 . 2]"
1 59 VAL 4.657 0.929 7 2 "[ .-+ 1 . 2]"
1 60 LYS 1.389 0.088 16 0 "[ . 1 . 2]"
1 61 ALA 0.737 0.085 12 0 "[ . 1 . 2]"
1 62 ALA 1.138 0.087 6 0 "[ . 1 . 2]"
1 63 ALA 1.299 0.112 12 0 "[ . 1 . 2]"
1 64 ASP 6.109 0.388 2 0 "[ . 1 . 2]"
1 65 VAL 8.576 0.203 16 0 "[ . 1 . 2]"
1 66 TYR 8.699 0.110 5 0 "[ . 1 . 2]"
1 67 ALA 6.212 0.122 20 0 "[ . 1 . 2]"
1 68 PRO 1.577 0.087 10 0 "[ . 1 . 2]"
1 69 LEU 2.987 0.080 15 0 "[ . 1 . 2]"
1 70 SER 2.906 0.638 19 1 "[ . 1 . +2]"
1 71 GLY 2.037 0.260 8 0 "[ . 1 . 2]"
1 72 LYS 1.901 0.629 4 1 "[ +. 1 . 2]"
1 73 ILE 1.421 0.089 15 0 "[ . 1 . 2]"
1 74 VAL 6.042 0.116 10 0 "[ . 1 . 2]"
1 75 GLU 3.526 0.114 17 0 "[ . 1 . 2]"
1 76 VAL 4.581 0.957 11 4 "[ .* -+ *. 2]"
1 77 ASN 5.515 0.095 2 0 "[ . 1 . 2]"
1 78 GLU 5.405 0.344 15 0 "[ . 1 . 2]"
1 79 LYS 12.836 0.499 20 0 "[ . 1 . 2]"
1 80 LEU 6.372 0.112 4 0 "[ . 1 . 2]"
1 81 ASP 5.826 0.522 9 2 "[ . +1- . 2]"
1 82 THR 6.364 0.522 9 2 "[ . +1- . 2]"
1 83 GLU 9.251 0.552 19 2 "[ . 1 - . +2]"
1 84 PRO 9.210 0.552 19 2 "[ . 1 - . +2]"
1 85 GLU 7.104 0.582 12 4 "[ - . 1 + . **2]"
1 86 LEU 8.052 0.684 13 4 "[ .* * + - 2]"
1 87 ILE 4.354 0.207 5 0 "[ . 1 . 2]"
1 88 ASN 8.408 0.506 19 1 "[ . 1 . +2]"
1 89 LYS 8.410 0.684 13 4 "[ .* * + - 2]"
1 90 ASP 3.112 0.093 3 0 "[ . 1 . 2]"
1 91 PRO 2.762 0.092 13 0 "[ . 1 . 2]"
1 92 GLU 12.604 0.991 15 7 "[ * *** 1* + - 2]"
1 93 GLY 0.447 0.243 13 0 "[ . 1 . 2]"
1 94 GLU 2.817 0.363 20 0 "[ . 1 . 2]"
1 95 GLY 6.933 0.102 2 0 "[ . 1 . 2]"
1 96 TRP 3.217 0.096 13 0 "[ . 1 . 2]"
1 97 LEU 10.684 0.124 11 0 "[ . 1 . 2]"
1 98 PHE 3.855 0.136 4 0 "[ . 1 . 2]"
1 99 LYS 1.814 0.078 19 0 "[ . 1 . 2]"
1 100 MET 1.839 0.132 3 0 "[ . 1 . 2]"
1 101 GLU 0.664 0.090 9 0 "[ . 1 . 2]"
1 102 ILE 12.800 0.745 9 1 "[ . +1 . 2]"
1 103 SER 2.326 0.457 18 0 "[ . 1 . 2]"
1 104 ASP 4.086 0.547 7 1 "[ . + 1 . 2]"
1 105 GLU 4.628 0.304 7 0 "[ . 1 . 2]"
1 106 GLY 2.308 0.547 7 1 "[ . + 1 . 2]"
1 107 GLU 0.978 0.073 11 0 "[ . 1 . 2]"
1 108 LEU 5.848 0.791 12 2 "[ . 1 + . -2]"
1 109 GLU 2.125 0.791 12 2 "[ . 1 + . -2]"
1 110 ASP 0.012 0.012 3 0 "[ . 1 . 2]"
1 111 LEU 2.773 0.096 2 0 "[ . 1 . 2]"
1 112 LEU 5.696 0.713 17 3 "[ . *1 . + -]"
1 113 ASP 0.435 0.117 15 0 "[ . 1 . 2]"
1 114 GLU 5.838 0.117 9 0 "[ . 1 . 2]"
1 115 GLN 3.969 0.111 11 0 "[ . 1 . 2]"
1 116 ALA 1.758 0.117 15 0 "[ . 1 . 2]"
1 117 TYR 4.424 0.117 9 0 "[ . 1 . 2]"
1 118 GLN 4.830 0.656 17 4 "[ . 1* *. + -]"
1 119 GLU 3.584 0.298 20 0 "[ . 1 . 2]"
1 120 PHE 6.923 0.344 20 0 "[ . 1 . 2]"
1 121 CYS 0.374 0.077 6 0 "[ . 1 . 2]"
1 122 ALA 2.380 0.112 12 0 "[ . 1 . 2]"
1 123 GLN 6.042 0.415 1 0 "[ . 1 . 2]"
1 124 GLU 2.428 0.177 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 LYS HA 1 3 MET H . . 2.880 2.324 2.193 2.580 . 0 0 "[ . 1 . 2]" 1
2 1 2 LYS HA 1 15 ILE MG . . 5.440 3.748 2.253 4.843 . 0 0 "[ . 1 . 2]" 1
3 1 2 LYS HA 1 16 GLU HA . . 3.140 2.481 2.131 3.219 0.079 7 0 "[ . 1 . 2]" 1
4 1 2 LYS HB2 1 3 MET H . . 4.630 4.261 2.825 4.737 0.107 8 0 "[ . 1 . 2]" 1
5 1 3 MET H 1 3 MET QB . . 3.850 2.814 2.395 3.312 . 0 0 "[ . 1 . 2]" 1
6 1 3 MET H 1 3 MET QG . . 4.310 3.444 2.137 4.125 . 0 0 "[ . 1 . 2]" 1
7 1 3 MET H 1 4 LYS HA . . 5.030 4.641 4.444 4.921 . 0 0 "[ . 1 . 2]" 1
8 1 3 MET H 1 15 ILE H . . 3.870 3.425 3.060 3.842 . 0 0 "[ . 1 . 2]" 1
9 1 3 MET H 1 15 ILE HB . . 3.780 2.933 2.142 3.688 . 0 0 "[ . 1 . 2]" 1
10 1 3 MET H 1 15 ILE MG . . 4.890 3.274 2.277 3.972 . 0 0 "[ . 1 . 2]" 1
11 1 3 MET HA 1 3 MET ME . . 5.160 3.979 2.361 4.420 . 0 0 "[ . 1 . 2]" 1
12 1 3 MET HA 1 4 LYS H . . 2.830 2.428 2.188 2.746 . 0 0 "[ . 1 . 2]" 1
13 1 3 MET HA 1 4 LYS HA . . 4.680 4.520 4.406 4.649 . 0 0 "[ . 1 . 2]" 1
14 1 3 MET QB 1 3 MET ME . . 2.400 2.147 1.951 2.447 0.047 11 0 "[ . 1 . 2]" 1
15 1 3 MET QB 1 3 MET QG . . 2.400 2.069 1.968 2.107 . 0 0 "[ . 1 . 2]" 1
16 1 3 MET QB 1 4 LYS H . . 4.150 3.236 2.263 3.823 . 0 0 "[ . 1 . 2]" 1
17 1 3 MET QB 1 15 ILE HB . . 4.330 3.007 2.032 4.045 . 0 0 "[ . 1 . 2]" 1
18 1 3 MET QB 1 15 ILE MG . . 5.010 3.335 2.123 4.393 . 0 0 "[ . 1 . 2]" 1
19 1 3 MET ME 1 15 ILE MG . . 4.040 3.634 2.298 4.184 0.144 15 0 "[ . 1 . 2]" 1
20 1 3 MET ME 1 108 LEU QD . . 3.970 2.571 1.933 3.618 . 0 0 "[ . 1 . 2]" 1
21 1 3 MET QG 1 4 LYS H . . 4.450 2.838 1.981 4.142 . 0 0 "[ . 1 . 2]" 1
22 1 3 MET QG 1 4 LYS HA . . 4.910 3.712 2.895 4.425 . 0 0 "[ . 1 . 2]" 1
23 1 3 MET QG 1 5 LYS QG . . 4.900 3.436 2.297 4.624 . 0 0 "[ . 1 . 2]" 1
24 1 3 MET QG 1 15 ILE HB . . 4.110 3.103 1.926 4.069 . 0 0 "[ . 1 . 2]" 1
25 1 3 MET QG 1 15 ILE MD . . 4.630 2.993 2.140 4.570 . 0 0 "[ . 1 . 2]" 1
26 1 4 LYS H 1 4 LYS QB . . 3.450 2.772 2.404 3.288 . 0 0 "[ . 1 . 2]" 1
27 1 4 LYS HA 1 5 LYS H . . 2.780 2.233 2.065 2.673 . 0 0 "[ . 1 . 2]" 1
28 1 4 LYS HA 1 15 ILE H . . 4.050 2.945 2.458 3.333 . 0 0 "[ . 1 . 2]" 1
29 1 4 LYS HA 1 15 ILE HB . . 4.910 4.180 3.257 4.655 . 0 0 "[ . 1 . 2]" 1
30 1 4 LYS HA 1 15 ILE MD . . 4.790 3.365 2.247 4.892 0.102 9 0 "[ . 1 . 2]" 1
31 1 4 LYS QB 1 14 SER HA . . 4.240 2.666 2.123 3.192 . 0 0 "[ . 1 . 2]" 1
32 1 4 LYS QB 1 14 SER QB . . 5.060 4.341 3.772 4.605 . 0 0 "[ . 1 . 2]" 1
33 1 5 LYS H 1 5 LYS HB2 . . 3.410 2.556 2.336 3.020 . 0 0 "[ . 1 . 2]" 1
34 1 5 LYS H 1 5 LYS QG . . 4.500 3.147 2.554 4.048 . 0 0 "[ . 1 . 2]" 1
35 1 5 LYS H 1 6 TYR H . . 5.150 4.515 4.335 4.666 . 0 0 "[ . 1 . 2]" 1
36 1 5 LYS H 1 6 TYR QD . . 5.420 5.109 4.589 5.468 0.048 14 0 "[ . 1 . 2]" 1
37 1 5 LYS H 1 13 VAL HB . . 3.870 2.646 2.174 3.245 . 0 0 "[ . 1 . 2]" 1
38 1 5 LYS H 1 13 VAL QG . . 4.580 3.378 2.197 3.780 . 0 0 "[ . 1 . 2]" 1
39 1 5 LYS H 1 108 LEU QD . . 4.560 4.290 3.734 4.563 0.003 18 0 "[ . 1 . 2]" 1
40 1 5 LYS HA 1 5 LYS QG . . 3.270 2.402 2.094 2.730 . 0 0 "[ . 1 . 2]" 1
41 1 5 LYS HA 1 6 TYR H . . 3.090 2.554 2.403 2.641 . 0 0 "[ . 1 . 2]" 1
42 1 5 LYS HA 1 6 TYR HA . . 4.860 4.520 4.446 4.593 . 0 0 "[ . 1 . 2]" 1
43 1 5 LYS HA 1 6 TYR QD . . 3.550 2.671 2.384 3.060 . 0 0 "[ . 1 . 2]" 1
44 1 5 LYS HA 1 6 TYR QE . . 4.520 3.708 3.243 4.268 . 0 0 "[ . 1 . 2]" 1
45 1 5 LYS HA 1 13 VAL HB . . 4.780 4.839 4.678 4.869 0.089 4 0 "[ . 1 . 2]" 1
46 1 5 LYS HA 1 114 GLU H . . 5.500 4.833 4.478 5.460 . 0 0 "[ . 1 . 2]" 1
47 1 5 LYS HB2 1 6 TYR H . . 3.650 3.467 3.113 3.714 0.064 3 0 "[ . 1 . 2]" 1
48 1 5 LYS HB2 1 13 VAL H . . 5.280 5.148 4.700 5.324 0.044 4 0 "[ . 1 . 2]" 1
49 1 5 LYS HB2 1 13 VAL HB . . 3.510 3.459 3.084 3.592 0.082 7 0 "[ . 1 . 2]" 1
50 1 5 LYS HB2 1 13 VAL QG . . 4.590 3.341 2.686 3.786 . 0 0 "[ . 1 . 2]" 1
51 1 5 LYS HB2 1 111 LEU HB2 . . 3.770 3.123 2.499 3.798 0.028 15 0 "[ . 1 . 2]" 1
52 1 5 LYS HB2 1 111 LEU QD . . 3.520 2.841 2.160 3.440 . 0 0 "[ . 1 . 2]" 1
53 1 5 LYS HB3 1 6 TYR H . . 3.170 2.179 1.968 2.315 . 0 0 "[ . 1 . 2]" 1
54 1 5 LYS HB3 1 111 LEU H . . 4.800 4.661 4.264 4.884 0.084 18 0 "[ . 1 . 2]" 1
55 1 5 LYS HB3 1 111 LEU HB2 . . 3.310 2.381 2.060 2.999 . 0 0 "[ . 1 . 2]" 1
56 1 5 LYS HB3 1 111 LEU QD . . 3.850 3.001 2.390 3.578 . 0 0 "[ . 1 . 2]" 1
57 1 5 LYS HB3 1 112 LEU H . . 4.640 3.624 2.870 4.099 . 0 0 "[ . 1 . 2]" 1
58 1 5 LYS QG 1 6 TYR H . . 5.070 3.771 2.986 4.248 . 0 0 "[ . 1 . 2]" 1
59 1 5 LYS QG 1 111 LEU QD . . 5.020 3.690 2.356 4.501 . 0 0 "[ . 1 . 2]" 1
60 1 5 LYS QG 1 113 ASP HA . . 4.030 3.458 2.398 4.016 . 0 0 "[ . 1 . 2]" 1
61 1 6 TYR H 1 6 TYR HB2 . . 3.550 2.568 2.430 2.741 . 0 0 "[ . 1 . 2]" 1
62 1 6 TYR H 1 6 TYR HB3 . . 3.900 3.736 3.651 3.832 . 0 0 "[ . 1 . 2]" 1
63 1 6 TYR H 1 6 TYR QD . . 3.270 2.698 2.620 2.802 . 0 0 "[ . 1 . 2]" 1
64 1 6 TYR H 1 6 TYR QE . . 4.740 4.808 4.722 4.835 0.095 3 0 "[ . 1 . 2]" 1
65 1 6 TYR H 1 7 THR H . . 4.830 4.510 4.431 4.593 . 0 0 "[ . 1 . 2]" 1
66 1 6 TYR H 1 111 LEU QD . . 5.170 3.677 3.136 4.086 . 0 0 "[ . 1 . 2]" 1
67 1 6 TYR H 1 112 LEU HB2 . . 3.990 3.263 2.895 3.723 . 0 0 "[ . 1 . 2]" 1
68 1 6 TYR H 1 113 ASP HA . . 4.750 4.387 4.024 4.769 0.019 8 0 "[ . 1 . 2]" 1
69 1 6 TYR H 1 117 TYR HB2 . . 5.020 4.406 4.027 4.770 . 0 0 "[ . 1 . 2]" 1
70 1 6 TYR HA 1 6 TYR QD . . 3.750 3.154 3.011 3.284 . 0 0 "[ . 1 . 2]" 1
71 1 6 TYR HA 1 6 TYR QE . . 5.020 4.799 4.566 4.980 . 0 0 "[ . 1 . 2]" 1
72 1 6 TYR HA 1 7 THR H . . 3.060 2.572 2.419 2.789 . 0 0 "[ . 1 . 2]" 1
73 1 6 TYR HA 1 7 THR HA . . 5.100 4.524 4.401 4.635 . 0 0 "[ . 1 . 2]" 1
74 1 6 TYR HA 1 7 THR MG . . 4.970 3.423 3.233 3.872 . 0 0 "[ . 1 . 2]" 1
75 1 6 TYR HA 1 12 TRP HA . . 3.090 2.243 2.072 2.573 . 0 0 "[ . 1 . 2]" 1
76 1 6 TYR HA 1 12 TRP QB . . 4.270 3.887 3.638 4.279 0.009 4 0 "[ . 1 . 2]" 1
77 1 6 TYR HA 1 13 VAL H . . 3.930 3.461 3.145 3.937 0.007 20 0 "[ . 1 . 2]" 1
78 1 6 TYR HA 1 13 VAL QG . . 5.390 2.732 2.337 4.056 . 0 0 "[ . 1 . 2]" 1
79 1 6 TYR HA 1 112 LEU H . . 5.300 5.121 4.591 5.358 0.058 10 0 "[ . 1 . 2]" 1
80 1 6 TYR HB2 1 7 THR H . . 4.220 3.615 3.292 3.934 . 0 0 "[ . 1 . 2]" 1
81 1 6 TYR HB2 1 112 LEU HB2 . . 3.660 2.399 2.161 2.786 . 0 0 "[ . 1 . 2]" 1
82 1 6 TYR HB2 1 112 LEU HB3 . . 3.990 3.603 3.250 4.031 0.041 5 0 "[ . 1 . 2]" 1
83 1 6 TYR HB2 1 112 LEU QD . . 5.260 3.248 2.469 3.804 . 0 0 "[ . 1 . 2]" 1
84 1 6 TYR HB2 1 117 TYR HB2 . . 3.710 2.186 2.005 2.342 . 0 0 "[ . 1 . 2]" 1
85 1 6 TYR HB2 1 117 TYR HB3 . . 4.010 3.492 3.127 3.898 . 0 0 "[ . 1 . 2]" 1
86 1 6 TYR HB3 1 7 THR H . . 3.470 2.491 2.150 2.877 . 0 0 "[ . 1 . 2]" 1
87 1 6 TYR HB3 1 112 LEU HB2 . . 3.920 3.713 3.272 3.982 0.062 14 0 "[ . 1 . 2]" 1
88 1 6 TYR HB3 1 112 LEU QD . . 5.160 3.610 2.970 4.126 . 0 0 "[ . 1 . 2]" 1
89 1 6 TYR HB3 1 117 TYR QE . . 4.610 4.006 3.288 4.583 . 0 0 "[ . 1 . 2]" 1
90 1 6 TYR QD 1 7 THR H . . 4.610 3.972 3.642 4.231 . 0 0 "[ . 1 . 2]" 1
91 1 6 TYR QD 1 12 TRP HA . . 4.420 2.966 2.619 3.273 . 0 0 "[ . 1 . 2]" 1
92 1 6 TYR QD 1 12 TRP QB . . 3.500 2.679 2.335 3.276 . 0 0 "[ . 1 . 2]" 1
93 1 6 TYR QD 1 13 VAL H . . 5.430 4.546 4.316 4.876 . 0 0 "[ . 1 . 2]" 1
94 1 6 TYR QD 1 25 THR MG . . 2.870 2.360 2.157 2.624 . 0 0 "[ . 1 . 2]" 1
95 1 6 TYR QD 1 112 LEU HB2 . . 4.390 3.979 3.279 4.457 0.067 11 0 "[ . 1 . 2]" 1
96 1 6 TYR QD 1 113 ASP HA . . 4.150 3.675 2.722 4.113 . 0 0 "[ . 1 . 2]" 1
97 1 6 TYR QD 1 114 GLU HA . . 3.500 2.917 2.649 3.364 . 0 0 "[ . 1 . 2]" 1
98 1 6 TYR QE 1 25 THR MG . . 3.030 2.770 2.300 3.117 0.087 14 0 "[ . 1 . 2]" 1
99 1 6 TYR QE 1 114 GLU H . . 3.870 3.791 2.966 3.951 0.081 8 0 "[ . 1 . 2]" 1
100 1 6 TYR QE 1 114 GLU HA . . 3.130 2.666 2.110 3.221 0.091 7 0 "[ . 1 . 2]" 1
101 1 6 TYR QE 1 114 GLU HB2 . . 3.610 2.362 2.158 2.984 . 0 0 "[ . 1 . 2]" 1
102 1 6 TYR QE 1 114 GLU HB3 . . 4.440 3.983 3.832 4.350 . 0 0 "[ . 1 . 2]" 1
103 1 6 TYR QE 1 114 GLU QG . . 4.260 2.931 2.644 3.356 . 0 0 "[ . 1 . 2]" 1
104 1 7 THR H 1 7 THR MG . . 3.610 2.771 2.352 3.165 . 0 0 "[ . 1 . 2]" 1
105 1 7 THR H 1 8 LYS H . . 4.200 4.284 4.261 4.292 0.092 20 0 "[ . 1 . 2]" 1
106 1 7 THR H 1 10 HIS HA . . 5.090 4.697 4.011 5.167 0.077 2 0 "[ . 1 . 2]" 1
107 1 7 THR H 1 11 GLU H . . 3.820 2.915 2.257 3.779 . 0 0 "[ . 1 . 2]" 1
108 1 7 THR H 1 11 GLU QB . . 5.380 3.519 2.631 4.285 . 0 0 "[ . 1 . 2]" 1
109 1 7 THR H 1 12 TRP HA . . 4.460 3.923 3.382 4.345 . 0 0 "[ . 1 . 2]" 1
110 1 7 THR H 1 112 LEU QD . . 5.500 3.706 3.112 4.342 . 0 0 "[ . 1 . 2]" 1
111 1 7 THR HA 1 7 THR HB . . 2.970 2.450 2.323 2.568 . 0 0 "[ . 1 . 2]" 1
112 1 7 THR HA 1 7 THR MG . . 3.370 2.478 2.342 2.702 . 0 0 "[ . 1 . 2]" 1
113 1 7 THR HA 1 8 LYS H . . 2.970 2.419 2.269 2.674 . 0 0 "[ . 1 . 2]" 1
114 1 7 THR HA 1 9 THR H . . 4.530 4.147 3.768 4.494 . 0 0 "[ . 1 . 2]" 1
115 1 7 THR HA 1 111 LEU QD . . 4.460 2.964 2.169 3.696 . 0 0 "[ . 1 . 2]" 1
116 1 7 THR HA 1 112 LEU H . . 4.120 3.651 3.169 4.110 . 0 0 "[ . 1 . 2]" 1
117 1 7 THR HA 1 112 LEU QD . . 4.430 2.795 1.926 3.713 . 0 0 "[ . 1 . 2]" 1
118 1 7 THR HA 1 112 LEU HG . . 4.410 4.059 2.814 4.504 0.094 17 0 "[ . 1 . 2]" 1
119 1 7 THR HB 1 8 LYS H . . 3.140 2.099 1.794 2.418 . 0 0 "[ . 1 . 2]" 1
120 1 7 THR HB 1 8 LYS HB2 . . 4.540 4.449 4.190 4.802 0.262 8 0 "[ . 1 . 2]" 1
121 1 7 THR HB 1 9 THR H . . 3.310 2.598 2.114 3.368 0.058 16 0 "[ . 1 . 2]" 1
122 1 7 THR HB 1 11 GLU H . . 4.960 4.513 3.906 5.033 0.073 12 0 "[ . 1 . 2]" 1
123 1 7 THR MG 1 8 LYS H . . 4.640 3.592 3.350 3.715 . 0 0 "[ . 1 . 2]" 1
124 1 7 THR MG 1 9 THR H . . 4.920 3.959 3.615 4.497 . 0 0 "[ . 1 . 2]" 1
125 1 7 THR MG 1 11 GLU H . . 4.780 4.012 3.497 4.873 0.093 8 0 "[ . 1 . 2]" 1
126 1 7 THR MG 1 11 GLU QB . . 4.070 2.600 2.154 3.537 . 0 0 "[ . 1 . 2]" 1
127 1 7 THR MG 1 68 PRO HA . . 3.670 2.230 1.963 2.694 . 0 0 "[ . 1 . 2]" 1
128 1 7 THR MG 1 68 PRO HB2 . . 3.210 2.772 2.381 3.088 . 0 0 "[ . 1 . 2]" 1
129 1 7 THR MG 1 68 PRO HB3 . . 3.720 2.181 1.991 2.386 . 0 0 "[ . 1 . 2]" 1
130 1 7 THR MG 1 68 PRO HG3 . . 4.210 4.047 3.675 4.297 0.087 10 0 "[ . 1 . 2]" 1
131 1 7 THR MG 1 69 LEU H . . 5.500 4.966 4.741 5.344 . 0 0 "[ . 1 . 2]" 1
132 1 7 THR MG 1 111 LEU QD . . 3.130 2.184 1.879 3.070 . 0 0 "[ . 1 . 2]" 1
133 1 7 THR MG 1 112 LEU H . . 5.260 4.638 3.736 5.324 0.064 7 0 "[ . 1 . 2]" 1
134 1 8 LYS H 1 8 LYS HB2 . . 3.220 2.734 2.508 3.558 0.338 8 0 "[ . 1 . 2]" 1
135 1 8 LYS H 1 8 LYS HB3 . . 3.880 3.653 2.886 3.805 . 0 0 "[ . 1 . 2]" 1
136 1 8 LYS H 1 8 LYS HG2 . . 4.320 3.451 1.782 4.400 0.080 4 0 "[ . 1 . 2]" 1
137 1 8 LYS H 1 8 LYS HG3 . . 3.470 2.721 2.039 3.440 . 0 0 "[ . 1 . 2]" 1
138 1 8 LYS H 1 9 THR H . . 3.460 2.550 2.297 2.842 . 0 0 "[ . 1 . 2]" 1
139 1 8 LYS H 1 9 THR MG . . 5.150 3.750 3.410 4.229 . 0 0 "[ . 1 . 2]" 1
140 1 8 LYS H 1 10 HIS H . . 5.080 4.684 4.014 5.135 0.055 16 0 "[ . 1 . 2]" 1
141 1 8 LYS H 1 112 LEU QD . . 4.800 3.322 2.767 4.065 . 0 0 "[ . 1 . 2]" 1
142 1 8 LYS HA 1 8 LYS HG2 . . 3.400 2.923 2.250 3.491 0.091 8 0 "[ . 1 . 2]" 1
143 1 8 LYS HA 1 8 LYS HG3 . . 3.870 3.147 2.300 3.929 0.059 16 0 "[ . 1 . 2]" 1
144 1 8 LYS HA 1 9 THR HA . . 4.980 4.608 4.330 4.799 . 0 0 "[ . 1 . 2]" 1
145 1 8 LYS HA 1 10 HIS H . . 3.900 3.548 3.131 3.926 0.026 7 0 "[ . 1 . 2]" 1
146 1 8 LYS HA 1 112 LEU QD . . 4.400 2.962 2.208 3.445 . 0 0 "[ . 1 . 2]" 1
147 1 8 LYS HA 1 120 PHE QD . . 4.030 2.857 2.298 3.493 . 0 0 "[ . 1 . 2]" 1
148 1 8 LYS HA 1 120 PHE QE . . 4.070 2.600 2.212 2.948 . 0 0 "[ . 1 . 2]" 1
149 1 8 LYS HA 1 120 PHE HZ . . 4.630 4.193 3.795 4.548 . 0 0 "[ . 1 . 2]" 1
150 1 8 LYS HB2 1 8 LYS HE2 . . 3.410 3.333 2.651 3.494 0.084 5 0 "[ . 1 . 2]" 1
151 1 8 LYS HB2 1 8 LYS HE3 . . 3.390 3.054 2.108 3.935 0.545 8 1 "[ . + 1 . 2]" 1
152 1 8 LYS HB2 1 8 LYS HG3 . . 3.040 2.595 2.224 2.987 . 0 0 "[ . 1 . 2]" 1
153 1 8 LYS HB2 1 9 THR H . . 4.370 3.583 2.809 4.160 . 0 0 "[ . 1 . 2]" 1
154 1 8 LYS HB2 1 120 PHE QE . . 4.470 3.959 2.179 4.434 . 0 0 "[ . 1 . 2]" 1
155 1 8 LYS HB2 1 120 PHE HZ . . 4.240 4.249 3.665 4.326 0.086 5 0 "[ . 1 . 2]" 1
156 1 8 LYS HB3 1 120 PHE QE . . 5.500 2.602 2.101 3.011 . 0 0 "[ . 1 . 2]" 1
157 1 8 LYS HB3 1 120 PHE HZ . . 4.110 2.760 2.465 4.320 0.210 8 0 "[ . 1 . 2]" 1
158 1 8 LYS HE2 1 112 LEU QD . . 4.360 3.681 2.001 5.073 0.713 17 3 "[ . *1 . + -]" 1
159 1 8 LYS HE2 1 120 PHE QD . . 5.220 5.268 4.558 5.564 0.344 20 0 "[ . 1 . 2]" 1
160 1 8 LYS HE3 1 8 LYS HG2 . . 4.280 2.998 2.064 3.961 . 0 0 "[ . 1 . 2]" 1
161 1 8 LYS HE3 1 8 LYS HG3 . . 4.240 3.277 2.856 3.635 . 0 0 "[ . 1 . 2]" 1
162 1 8 LYS HE3 1 120 PHE QD . . 5.500 4.729 3.830 5.607 0.107 18 0 "[ . 1 . 2]" 1
163 1 8 LYS HG2 1 112 LEU QD . . 4.040 2.745 2.074 3.703 . 0 0 "[ . 1 . 2]" 1
164 1 8 LYS HG2 1 120 PHE QD . . 4.800 4.037 2.936 4.902 0.102 8 0 "[ . 1 . 2]" 1
165 1 8 LYS HG2 1 120 PHE QE . . 5.490 3.615 2.569 4.909 . 0 0 "[ . 1 . 2]" 1
166 1 9 THR H 1 9 THR MG . . 4.030 2.540 1.876 3.123 . 0 0 "[ . 1 . 2]" 1
167 1 9 THR H 1 10 HIS H . . 3.330 2.930 2.407 3.358 0.028 18 0 "[ . 1 . 2]" 1
168 1 9 THR H 1 120 PHE QE . . 5.090 5.048 4.554 5.171 0.081 8 0 "[ . 1 . 2]" 1
169 1 9 THR HA 1 9 THR HB . . 3.030 2.490 2.363 2.630 . 0 0 "[ . 1 . 2]" 1
170 1 9 THR HA 1 9 THR MG . . 3.160 2.585 2.244 3.254 0.094 1 0 "[ . 1 . 2]" 1
171 1 9 THR HA 1 10 HIS HD2 . . 3.540 3.512 3.307 3.621 0.081 13 0 "[ . 1 . 2]" 1
172 1 9 THR HB 1 66 TYR QD . . 3.810 2.290 1.986 2.730 . 0 0 "[ . 1 . 2]" 1
173 1 9 THR HB 1 66 TYR QE . . 3.680 3.767 3.732 3.780 0.100 6 0 "[ . 1 . 2]" 1
174 1 9 THR MG 1 10 HIS H . . 5.500 4.268 3.706 4.469 . 0 0 "[ . 1 . 2]" 1
175 1 9 THR MG 1 66 TYR QD . . 4.000 2.459 2.077 3.119 . 0 0 "[ . 1 . 2]" 1
176 1 9 THR MG 1 66 TYR QE . . 4.400 3.609 3.009 4.480 0.080 10 0 "[ . 1 . 2]" 1
177 1 10 HIS H 1 10 HIS HA . . 2.920 2.254 2.179 2.325 . 0 0 "[ . 1 . 2]" 1
178 1 10 HIS H 1 11 GLU H . . 3.570 3.045 2.665 3.467 . 0 0 "[ . 1 . 2]" 1
179 1 10 HIS H 1 117 TYR QE . . 4.630 4.128 3.123 4.712 0.082 2 0 "[ . 1 . 2]" 1
180 1 10 HIS HA 1 11 GLU H . . 3.590 2.606 2.407 2.881 . 0 0 "[ . 1 . 2]" 1
181 1 10 HIS HA 1 25 THR MG . . 4.250 3.431 3.025 3.924 . 0 0 "[ . 1 . 2]" 1
182 1 10 HIS HA 1 28 ALA MB . . 4.900 4.488 4.163 4.962 0.062 14 0 "[ . 1 . 2]" 1
183 1 10 HIS HA 1 117 TYR QE . . 3.690 2.832 2.251 3.321 . 0 0 "[ . 1 . 2]" 1
184 1 10 HIS QB 1 10 HIS HD2 . . 3.510 2.593 2.534 2.696 . 0 0 "[ . 1 . 2]" 1
185 1 10 HIS QB 1 10 HIS HE1 . . 4.790 4.505 4.467 4.522 . 0 0 "[ . 1 . 2]" 1
186 1 10 HIS QB 1 25 THR H . . 4.420 3.247 2.806 3.498 . 0 0 "[ . 1 . 2]" 1
187 1 10 HIS QB 1 25 THR MG . . 5.150 3.906 3.591 4.266 . 0 0 "[ . 1 . 2]" 1
188 1 10 HIS QB 1 28 ALA H . . 4.500 3.520 2.874 4.417 . 0 0 "[ . 1 . 2]" 1
189 1 10 HIS QB 1 28 ALA MB . . 3.320 2.246 2.055 2.617 . 0 0 "[ . 1 . 2]" 1
190 1 10 HIS QB 1 117 TYR QE . . 4.700 3.894 2.951 4.617 . 0 0 "[ . 1 . 2]" 1
191 1 10 HIS HD2 1 28 ALA MB . . 4.820 4.378 3.427 4.832 0.012 17 0 "[ . 1 . 2]" 1
192 1 11 GLU H 1 11 GLU QB . . 3.540 2.560 2.115 2.858 . 0 0 "[ . 1 . 2]" 1
193 1 11 GLU H 1 11 GLU HG2 . . 4.990 4.504 4.044 4.793 . 0 0 "[ . 1 . 2]" 1
194 1 11 GLU H 1 11 GLU HG3 . . 5.080 3.678 2.970 4.772 . 0 0 "[ . 1 . 2]" 1
195 1 11 GLU H 1 25 THR H . . 4.380 4.375 4.018 4.468 0.088 17 0 "[ . 1 . 2]" 1
196 1 11 GLU H 1 25 THR MG . . 5.280 3.467 3.100 4.015 . 0 0 "[ . 1 . 2]" 1
197 1 11 GLU HA 1 11 GLU HG2 . . 4.040 2.802 2.353 3.546 . 0 0 "[ . 1 . 2]" 1
198 1 11 GLU HA 1 11 GLU HG3 . . 3.850 2.751 2.360 3.291 . 0 0 "[ . 1 . 2]" 1
199 1 11 GLU HA 1 12 TRP H . . 2.980 2.255 2.197 2.362 . 0 0 "[ . 1 . 2]" 1
200 1 11 GLU HA 1 12 TRP HD1 . . 5.010 3.868 3.512 4.361 . 0 0 "[ . 1 . 2]" 1
201 1 11 GLU HA 1 24 ILE HA . . 2.880 1.994 1.915 2.104 . 0 0 "[ . 1 . 2]" 1
202 1 11 GLU HA 1 24 ILE HB . . 4.630 4.073 3.838 4.380 . 0 0 "[ . 1 . 2]" 1
203 1 11 GLU HA 1 24 ILE MG . . 4.470 3.277 2.731 3.816 . 0 0 "[ . 1 . 2]" 1
204 1 11 GLU HA 1 25 THR H . . 3.900 2.883 2.450 3.098 . 0 0 "[ . 1 . 2]" 1
205 1 11 GLU HA 1 25 THR MG . . 4.110 2.841 2.402 3.325 . 0 0 "[ . 1 . 2]" 1
206 1 11 GLU QB 1 12 TRP H . . 3.310 2.889 2.221 3.395 0.085 1 0 "[ . 1 . 2]" 1
207 1 11 GLU QB 1 22 VAL QG . . 3.970 3.198 2.283 4.019 0.049 1 0 "[ . 1 . 2]" 1
208 1 11 GLU QB 1 23 GLY H . . 5.340 4.134 3.103 5.287 . 0 0 "[ . 1 . 2]" 1
209 1 11 GLU QB 1 24 ILE HA . . 5.150 3.740 3.299 4.087 . 0 0 "[ . 1 . 2]" 1
210 1 11 GLU QB 1 24 ILE MG . . 4.430 3.820 3.020 4.316 . 0 0 "[ . 1 . 2]" 1
211 1 11 GLU QB 1 65 VAL MG1 . . 4.640 3.748 2.923 4.438 . 0 0 "[ . 1 . 2]" 1
212 1 11 GLU HG2 1 22 VAL QG . . 5.240 3.047 2.293 4.134 . 0 0 "[ . 1 . 2]" 1
213 1 11 GLU HG2 1 24 ILE HA . . 5.130 3.206 2.412 4.167 . 0 0 "[ . 1 . 2]" 1
214 1 11 GLU HG2 1 24 ILE MG . . 3.970 2.869 2.058 4.146 0.176 16 0 "[ . 1 . 2]" 1
215 1 11 GLU HG2 1 65 VAL MG1 . . 4.140 2.691 2.120 3.911 . 0 0 "[ . 1 . 2]" 1
216 1 11 GLU HG3 1 22 VAL QG . . 5.330 4.192 2.774 5.292 . 0 0 "[ . 1 . 2]" 1
217 1 11 GLU HG3 1 24 ILE HA . . 5.160 3.242 2.569 3.995 . 0 0 "[ . 1 . 2]" 1
218 1 11 GLU HG3 1 25 THR MG . . 5.500 5.099 4.573 5.595 0.095 16 0 "[ . 1 . 2]" 1
219 1 11 GLU HG3 1 65 VAL MG1 . . 4.010 2.978 2.206 3.959 . 0 0 "[ . 1 . 2]" 1
220 1 12 TRP H 1 12 TRP HD1 . . 3.660 2.968 2.618 3.335 . 0 0 "[ . 1 . 2]" 1
221 1 12 TRP H 1 13 VAL H . . 5.190 4.456 4.365 4.552 . 0 0 "[ . 1 . 2]" 1
222 1 12 TRP H 1 22 VAL HA . . 5.170 4.487 4.121 4.801 . 0 0 "[ . 1 . 2]" 1
223 1 12 TRP H 1 22 VAL QG . . 4.680 4.011 3.639 4.596 . 0 0 "[ . 1 . 2]" 1
224 1 12 TRP H 1 23 GLY H . . 3.350 2.992 2.719 3.412 0.062 7 0 "[ . 1 . 2]" 1
225 1 12 TRP H 1 24 ILE HA . . 3.820 3.382 3.138 3.622 . 0 0 "[ . 1 . 2]" 1
226 1 12 TRP H 1 25 THR H . . 4.220 4.278 4.174 4.306 0.086 5 0 "[ . 1 . 2]" 1
227 1 12 TRP H 1 25 THR MG . . 4.620 3.087 2.542 3.451 . 0 0 "[ . 1 . 2]" 1
228 1 12 TRP HA 1 12 TRP HD1 . . 5.140 4.401 4.206 4.526 . 0 0 "[ . 1 . 2]" 1
229 1 12 TRP HA 1 13 VAL H . . 2.840 2.377 2.229 2.535 . 0 0 "[ . 1 . 2]" 1
230 1 12 TRP HA 1 13 VAL QG . . 4.800 3.017 2.660 3.925 . 0 0 "[ . 1 . 2]" 1
231 1 12 TRP HA 1 25 THR MG . . 5.230 3.607 3.377 3.849 . 0 0 "[ . 1 . 2]" 1
232 1 12 TRP QB 1 12 TRP HD1 . . 3.230 2.544 2.469 2.624 . 0 0 "[ . 1 . 2]" 1
233 1 12 TRP QB 1 12 TRP HE3 . . 3.380 2.767 2.671 2.885 . 0 0 "[ . 1 . 2]" 1
234 1 12 TRP QB 1 13 VAL H . . 3.280 2.506 2.295 2.864 . 0 0 "[ . 1 . 2]" 1
235 1 12 TRP QB 1 25 THR MG . . 3.470 2.385 2.160 2.725 . 0 0 "[ . 1 . 2]" 1
236 1 12 TRP HD1 1 24 ILE HA . . 4.290 3.950 3.543 4.352 0.062 7 0 "[ . 1 . 2]" 1
237 1 12 TRP HD1 1 25 THR H . . 4.090 3.604 3.151 4.121 0.031 7 0 "[ . 1 . 2]" 1
238 1 12 TRP HD1 1 25 THR HA . . 2.880 2.386 2.084 2.832 . 0 0 "[ . 1 . 2]" 1
239 1 12 TRP HD1 1 25 THR MG . . 2.990 2.173 1.938 2.406 . 0 0 "[ . 1 . 2]" 1
240 1 12 TRP HD1 1 26 ASN H . . 5.060 4.678 4.364 5.123 0.063 13 0 "[ . 1 . 2]" 1
241 1 12 TRP HD1 1 92 GLU HA . . 4.850 4.361 3.718 4.900 0.050 3 0 "[ . 1 . 2]" 1
242 1 12 TRP HD1 1 92 GLU HG2 . . 4.350 3.390 2.623 4.691 0.341 6 0 "[ . 1 . 2]" 1
243 1 12 TRP HE1 1 23 GLY HA2 . . 4.630 4.422 4.197 4.684 0.054 7 0 "[ . 1 . 2]" 1
244 1 12 TRP HE1 1 23 GLY HA3 . . 3.910 2.946 2.634 3.635 . 0 0 "[ . 1 . 2]" 1
245 1 12 TRP HE1 1 91 PRO HB2 . . 5.150 3.254 2.894 3.771 . 0 0 "[ . 1 . 2]" 1
246 1 12 TRP HE1 1 92 GLU HA . . 3.440 2.604 2.328 3.004 . 0 0 "[ . 1 . 2]" 1
247 1 12 TRP HE1 1 92 GLU HG2 . . 4.680 3.267 2.253 4.873 0.193 6 0 "[ . 1 . 2]" 1
248 1 12 TRP HE3 1 13 VAL H . . 3.920 3.267 2.950 3.629 . 0 0 "[ . 1 . 2]" 1
249 1 12 TRP HE3 1 13 VAL HA . . 3.670 3.248 2.588 3.714 0.044 13 0 "[ . 1 . 2]" 1
250 1 12 TRP HE3 1 14 SER H . . 3.630 3.271 2.385 3.690 0.060 1 0 "[ . 1 . 2]" 1
251 1 12 TRP HE3 1 14 SER HA . . 4.710 4.130 3.841 4.525 . 0 0 "[ . 1 . 2]" 1
252 1 12 TRP HE3 1 14 SER QB . . 3.930 3.136 2.566 3.523 . 0 0 "[ . 1 . 2]" 1
253 1 12 TRP HE3 1 21 THR MG . . 4.900 4.617 4.002 4.956 0.056 6 0 "[ . 1 . 2]" 1
254 1 12 TRP HE3 1 22 VAL HA . . 5.500 4.134 3.438 4.795 . 0 0 "[ . 1 . 2]" 1
255 1 12 TRP HE3 1 23 GLY H . . 5.500 4.222 3.791 4.756 . 0 0 "[ . 1 . 2]" 1
256 1 12 TRP HH2 1 21 THR MG . . 3.020 2.302 2.098 2.910 . 0 0 "[ . 1 . 2]" 1
257 1 12 TRP HH2 1 96 TRP HA . . 4.450 3.906 3.584 4.176 . 0 0 "[ . 1 . 2]" 1
258 1 12 TRP HH2 1 96 TRP HB2 . . 3.630 3.285 2.607 3.668 0.038 2 0 "[ . 1 . 2]" 1
259 1 12 TRP HH2 1 96 TRP HB3 . . 3.160 2.343 2.109 2.636 . 0 0 "[ . 1 . 2]" 1
260 1 12 TRP HZ2 1 21 THR MG . . 4.860 4.008 3.664 4.586 . 0 0 "[ . 1 . 2]" 1
261 1 12 TRP HZ2 1 23 GLY H . . 5.320 4.494 3.663 5.015 . 0 0 "[ . 1 . 2]" 1
262 1 12 TRP HZ2 1 23 GLY HA2 . . 4.810 4.373 3.976 4.870 0.060 11 0 "[ . 1 . 2]" 1
263 1 12 TRP HZ2 1 23 GLY HA3 . . 3.840 2.733 2.304 3.208 . 0 0 "[ . 1 . 2]" 1
264 1 12 TRP HZ2 1 92 GLU H . . 5.500 4.659 4.191 4.902 . 0 0 "[ . 1 . 2]" 1
265 1 12 TRP HZ2 1 92 GLU HA . . 2.890 2.292 2.165 2.785 . 0 0 "[ . 1 . 2]" 1
266 1 12 TRP HZ2 1 92 GLU HB2 . . 5.000 5.070 4.884 5.091 0.091 9 0 "[ . 1 . 2]" 1
267 1 12 TRP HZ2 1 96 TRP HA . . 3.660 2.897 2.530 3.366 . 0 0 "[ . 1 . 2]" 1
268 1 12 TRP HZ2 1 96 TRP HB2 . . 4.190 3.969 3.455 4.267 0.077 8 0 "[ . 1 . 2]" 1
269 1 12 TRP HZ2 1 96 TRP HB3 . . 3.590 2.942 2.424 3.283 . 0 0 "[ . 1 . 2]" 1
270 1 12 TRP HZ3 1 14 SER H . . 3.840 3.475 2.715 3.909 0.069 10 0 "[ . 1 . 2]" 1
271 1 12 TRP HZ3 1 14 SER QB . . 3.450 2.041 1.927 2.275 . 0 0 "[ . 1 . 2]" 1
272 1 12 TRP HZ3 1 21 THR HB . . 4.040 2.331 2.073 2.893 . 0 0 "[ . 1 . 2]" 1
273 1 12 TRP HZ3 1 21 THR MG . . 3.550 2.829 2.357 3.207 . 0 0 "[ . 1 . 2]" 1
274 1 13 VAL H 1 13 VAL HB . . 3.640 2.831 2.407 2.997 . 0 0 "[ . 1 . 2]" 1
275 1 13 VAL H 1 13 VAL QG . . 3.720 2.539 2.334 3.007 . 0 0 "[ . 1 . 2]" 1
276 1 13 VAL H 1 14 SER H . . 5.160 4.207 3.927 4.438 . 0 0 "[ . 1 . 2]" 1
277 1 13 VAL HA 1 14 SER H . . 2.850 2.289 2.185 2.431 . 0 0 "[ . 1 . 2]" 1
278 1 13 VAL HA 1 22 VAL H . . 4.990 5.004 4.583 5.086 0.096 9 0 "[ . 1 . 2]" 1
279 1 13 VAL HA 1 22 VAL HA . . 3.390 2.868 2.500 3.206 . 0 0 "[ . 1 . 2]" 1
280 1 13 VAL HA 1 22 VAL QG . . 4.190 3.435 2.955 4.075 . 0 0 "[ . 1 . 2]" 1
281 1 13 VAL HA 1 23 GLY H . . 4.740 4.269 3.957 4.835 0.095 7 0 "[ . 1 . 2]" 1
282 1 13 VAL HB 1 14 SER H . . 4.380 3.999 3.423 4.439 0.059 9 0 "[ . 1 . 2]" 1
283 1 13 VAL HB 1 15 ILE MD . . 4.190 2.908 2.194 4.287 0.097 9 0 "[ . 1 . 2]" 1
284 1 13 VAL HB 1 20 ALA MB . . 3.880 3.990 3.896 4.007 0.127 20 0 "[ . 1 . 2]" 1
285 1 13 VAL QG 1 14 SER H . . 3.900 2.778 2.022 3.531 . 0 0 "[ . 1 . 2]" 1
286 1 13 VAL QG 1 14 SER HA . . 4.760 4.156 3.310 4.637 . 0 0 "[ . 1 . 2]" 1
287 1 13 VAL QG 1 15 ILE HA . . 5.500 4.247 3.795 4.734 . 0 0 "[ . 1 . 2]" 1
288 1 13 VAL QG 1 15 ILE HB . . 5.500 4.380 3.386 4.787 . 0 0 "[ . 1 . 2]" 1
289 1 13 VAL QG 1 15 ILE HG12 . . 4.760 3.638 2.200 4.203 . 0 0 "[ . 1 . 2]" 1
290 1 13 VAL QG 1 15 ILE HG13 . . 3.440 2.729 2.127 3.518 0.078 1 0 "[ . 1 . 2]" 1
291 1 13 VAL QG 1 20 ALA HA . . 5.000 3.750 3.032 4.088 . 0 0 "[ . 1 . 2]" 1
292 1 13 VAL QG 1 20 ALA MB . . 3.230 1.895 1.807 1.997 . 0 0 "[ . 1 . 2]" 1
293 1 13 VAL QG 1 21 THR H . . 5.050 4.169 3.314 4.521 . 0 0 "[ . 1 . 2]" 1
294 1 13 VAL QG 1 22 VAL HA . . 4.390 3.548 3.320 3.954 . 0 0 "[ . 1 . 2]" 1
295 1 13 VAL QG 1 22 VAL QG . . 3.510 2.749 2.189 3.474 . 0 0 "[ . 1 . 2]" 1
296 1 13 VAL QG 1 68 PRO HA . . 5.500 4.033 3.809 4.425 . 0 0 "[ . 1 . 2]" 1
297 1 13 VAL QG 1 68 PRO HB2 . . 4.000 2.134 1.941 2.317 . 0 0 "[ . 1 . 2]" 1
298 1 13 VAL QG 1 68 PRO HB3 . . 3.870 2.462 2.133 3.061 . 0 0 "[ . 1 . 2]" 1
299 1 13 VAL QG 1 68 PRO HG2 . . 4.240 2.591 2.418 2.949 . 0 0 "[ . 1 . 2]" 1
300 1 13 VAL QG 1 68 PRO HG3 . . 3.970 2.204 1.928 2.614 . 0 0 "[ . 1 . 2]" 1
301 1 14 SER H 1 14 SER QB . . 3.650 2.277 2.035 2.557 . 0 0 "[ . 1 . 2]" 1
302 1 14 SER H 1 15 ILE H . . 4.440 3.893 3.519 4.233 . 0 0 "[ . 1 . 2]" 1
303 1 14 SER H 1 15 ILE MD . . 5.230 4.133 3.561 5.028 . 0 0 "[ . 1 . 2]" 1
304 1 14 SER H 1 20 ALA HA . . 4.770 3.661 2.780 4.398 . 0 0 "[ . 1 . 2]" 1
305 1 14 SER H 1 20 ALA MB . . 3.700 2.867 2.218 3.532 . 0 0 "[ . 1 . 2]" 1
306 1 14 SER H 1 22 VAL HA . . 4.580 4.027 3.687 4.463 . 0 0 "[ . 1 . 2]" 1
307 1 14 SER H 1 22 VAL QG . . 4.670 4.308 3.823 4.627 . 0 0 "[ . 1 . 2]" 1
308 1 14 SER HA 1 15 ILE H . . 2.830 2.291 2.075 2.394 . 0 0 "[ . 1 . 2]" 1
309 1 14 SER HA 1 15 ILE MD . . 5.500 4.001 3.271 5.294 . 0 0 "[ . 1 . 2]" 1
310 1 14 SER HA 1 15 ILE HG13 . . 5.080 4.906 4.114 5.864 0.784 9 1 "[ . +1 . 2]" 1
311 1 14 SER QB 1 15 ILE H . . 4.650 3.840 3.743 3.914 . 0 0 "[ . 1 . 2]" 1
312 1 14 SER QB 1 20 ALA HA . . 4.170 3.867 3.613 3.908 . 0 0 "[ . 1 . 2]" 1
313 1 14 SER QB 1 21 THR H . . 3.600 2.581 2.101 2.820 . 0 0 "[ . 1 . 2]" 1
314 1 14 SER QB 1 21 THR HB . . 4.240 2.035 1.894 2.406 . 0 0 "[ . 1 . 2]" 1
315 1 14 SER QB 1 21 THR MG . . 5.500 3.467 2.996 3.828 . 0 0 "[ . 1 . 2]" 1
316 1 15 ILE H 1 15 ILE HB . . 3.300 2.324 2.023 2.567 . 0 0 "[ . 1 . 2]" 1
317 1 15 ILE H 1 15 ILE MD . . 4.260 2.568 1.829 3.880 . 0 0 "[ . 1 . 2]" 1
318 1 15 ILE H 1 15 ILE HG12 . . 4.590 4.005 2.588 4.380 . 0 0 "[ . 1 . 2]" 1
319 1 15 ILE H 1 15 ILE HG13 . . 4.130 3.145 2.814 3.768 . 0 0 "[ . 1 . 2]" 1
320 1 15 ILE H 1 15 ILE MG . . 4.420 3.700 3.453 3.823 . 0 0 "[ . 1 . 2]" 1
321 1 15 ILE H 1 21 THR H . . 4.800 4.773 4.426 4.870 0.070 16 0 "[ . 1 . 2]" 1
322 1 15 ILE HA 1 15 ILE MD . . 4.250 3.471 2.176 3.747 . 0 0 "[ . 1 . 2]" 1
323 1 15 ILE HA 1 15 ILE HG12 . . 3.930 3.199 2.331 3.595 . 0 0 "[ . 1 . 2]" 1
324 1 15 ILE HA 1 15 ILE HG13 . . 3.890 2.431 2.089 3.758 . 0 0 "[ . 1 . 2]" 1
325 1 15 ILE HA 1 15 ILE MG . . 3.410 2.552 2.320 2.914 . 0 0 "[ . 1 . 2]" 1
326 1 15 ILE HA 1 16 GLU H . . 2.780 2.177 2.093 2.272 . 0 0 "[ . 1 . 2]" 1
327 1 15 ILE HA 1 20 ALA HA . . 2.990 2.315 2.140 2.593 . 0 0 "[ . 1 . 2]" 1
328 1 15 ILE HA 1 20 ALA MB . . 4.100 2.993 2.557 3.829 . 0 0 "[ . 1 . 2]" 1
329 1 15 ILE HA 1 21 THR H . . 4.020 3.983 3.704 4.103 0.083 15 0 "[ . 1 . 2]" 1
330 1 15 ILE HB 1 15 ILE MD . . 3.430 2.307 2.171 3.187 . 0 0 "[ . 1 . 2]" 1
331 1 15 ILE HB 1 16 GLU H . . 4.610 4.358 4.003 4.646 0.036 18 0 "[ . 1 . 2]" 1
332 1 15 ILE HB 1 20 ALA HA . . 5.080 4.928 4.498 5.143 0.063 4 0 "[ . 1 . 2]" 1
333 1 15 ILE HB 1 20 ALA MB . . 4.230 4.311 4.185 4.340 0.110 8 0 "[ . 1 . 2]" 1
334 1 15 ILE MD 1 20 ALA HA . . 4.490 4.126 2.621 4.558 0.068 2 0 "[ . 1 . 2]" 1
335 1 15 ILE MD 1 20 ALA MB . . 3.230 2.702 1.868 3.263 0.033 20 0 "[ . 1 . 2]" 1
336 1 15 ILE MD 1 21 THR H . . 5.170 5.184 4.461 5.294 0.124 18 0 "[ . 1 . 2]" 1
337 1 15 ILE MD 1 108 LEU HB3 . . 4.910 3.691 2.760 5.014 0.104 9 0 "[ . 1 . 2]" 1
338 1 15 ILE MD 1 108 LEU QD . . 2.400 1.976 1.770 2.184 . 0 0 "[ . 1 . 2]" 1
339 1 15 ILE HG12 1 16 GLU H . . 5.500 4.946 4.200 5.581 0.081 17 0 "[ . 1 . 2]" 1
340 1 15 ILE HG12 1 20 ALA HA . . 4.890 4.395 2.767 4.969 0.079 6 0 "[ . 1 . 2]" 1
341 1 15 ILE HG12 1 102 ILE MG . . 3.160 2.707 2.131 3.905 0.745 9 1 "[ . +1 . 2]" 1
342 1 15 ILE HG13 1 16 GLU H . . 4.920 4.472 3.934 5.540 0.620 9 1 "[ . +1 . 2]" 1
343 1 15 ILE HG13 1 20 ALA HA . . 4.550 3.199 2.204 4.976 0.426 9 0 "[ . 1 . 2]" 1
344 1 15 ILE HG13 1 20 ALA MB . . 3.730 2.103 1.923 3.467 . 0 0 "[ . 1 . 2]" 1
345 1 15 ILE HG13 1 102 ILE MG . . 3.820 3.105 2.476 3.652 . 0 0 "[ . 1 . 2]" 1
346 1 15 ILE MG 1 16 GLU H . . 3.780 3.031 2.404 3.661 . 0 0 "[ . 1 . 2]" 1
347 1 15 ILE MG 1 16 GLU HA . . 4.950 3.861 3.333 4.483 . 0 0 "[ . 1 . 2]" 1
348 1 15 ILE MG 1 17 ASP H . . 5.230 4.141 3.286 5.200 . 0 0 "[ . 1 . 2]" 1
349 1 15 ILE MG 1 18 LYS H . . 5.010 4.979 4.153 5.125 0.115 15 0 "[ . 1 . 2]" 1
350 1 15 ILE MG 1 19 VAL H . . 4.500 4.052 3.035 4.573 0.073 11 0 "[ . 1 . 2]" 1
351 1 15 ILE MG 1 20 ALA HA . . 4.820 4.251 3.679 4.882 0.062 15 0 "[ . 1 . 2]" 1
352 1 16 GLU H 1 16 GLU HB2 . . 3.880 3.484 2.608 3.879 . 0 0 "[ . 1 . 2]" 1
353 1 16 GLU H 1 16 GLU HB3 . . 3.750 3.044 2.516 3.626 . 0 0 "[ . 1 . 2]" 1
354 1 16 GLU H 1 16 GLU QG . . 4.600 2.842 1.856 4.127 . 0 0 "[ . 1 . 2]" 1
355 1 16 GLU H 1 17 ASP H . . 4.770 2.757 1.878 4.009 . 0 0 "[ . 1 . 2]" 1
356 1 16 GLU H 1 19 VAL H . . 4.030 3.452 3.002 4.074 0.044 18 0 "[ . 1 . 2]" 1
357 1 16 GLU H 1 19 VAL HB . . 4.720 4.675 4.391 4.799 0.079 15 0 "[ . 1 . 2]" 1
358 1 16 GLU H 1 19 VAL QG . . 5.500 4.638 4.195 4.895 . 0 0 "[ . 1 . 2]" 1
359 1 16 GLU H 1 20 ALA HA . . 4.060 3.549 2.693 4.112 0.052 14 0 "[ . 1 . 2]" 1
360 1 16 GLU HA 1 16 GLU QG . . 3.670 3.114 2.206 3.445 . 0 0 "[ . 1 . 2]" 1
361 1 16 GLU HA 1 17 ASP H . . 3.580 3.528 3.242 3.631 0.051 13 0 "[ . 1 . 2]" 1
362 1 16 GLU HB2 1 16 GLU QG . . 2.750 2.392 2.209 2.569 . 0 0 "[ . 1 . 2]" 1
363 1 16 GLU QG 1 17 ASP H . . 4.070 2.225 1.646 3.180 . 0 0 "[ . 1 . 2]" 1
364 1 16 GLU QG 1 17 ASP HB2 . . 4.490 3.397 2.450 4.612 0.122 9 0 "[ . 1 . 2]" 1
365 1 16 GLU QG 1 17 ASP HB3 . . 4.580 4.213 3.214 4.672 0.092 1 0 "[ . 1 . 2]" 1
366 1 17 ASP H 1 18 LYS H . . 4.570 2.848 2.398 3.470 . 0 0 "[ . 1 . 2]" 1
367 1 17 ASP HB2 1 18 LYS H . . 3.110 2.901 1.892 3.303 0.193 9 0 "[ . 1 . 2]" 1
368 1 17 ASP HB2 1 19 VAL H . . 4.510 4.336 3.497 4.949 0.439 7 0 "[ . 1 . 2]" 1
369 1 17 ASP HB3 1 18 LYS H . . 3.220 2.164 1.736 3.081 . 0 0 "[ . 1 . 2]" 1
370 1 17 ASP HB3 1 19 VAL H . . 4.900 4.071 3.113 4.967 0.067 20 0 "[ . 1 . 2]" 1
371 1 18 LYS H 1 18 LYS HB2 . . 3.530 2.844 2.502 3.612 0.082 10 0 "[ . 1 . 2]" 1
372 1 18 LYS H 1 18 LYS HB3 . . 4.020 3.818 3.113 4.000 . 0 0 "[ . 1 . 2]" 1
373 1 18 LYS H 1 18 LYS HG2 . . 4.470 3.721 1.839 4.512 0.042 4 0 "[ . 1 . 2]" 1
374 1 18 LYS H 1 18 LYS HG3 . . 4.630 3.132 2.566 4.235 . 0 0 "[ . 1 . 2]" 1
375 1 18 LYS H 1 19 VAL H . . 3.380 2.181 1.769 2.840 . 0 0 "[ . 1 . 2]" 1
376 1 18 LYS H 1 19 VAL QG . . 4.910 3.367 2.765 3.744 . 0 0 "[ . 1 . 2]" 1
377 1 18 LYS HA 1 18 LYS HG2 . . 4.020 2.835 2.484 3.714 . 0 0 "[ . 1 . 2]" 1
378 1 18 LYS HA 1 18 LYS HG3 . . 3.990 3.336 2.614 3.974 . 0 0 "[ . 1 . 2]" 1
379 1 18 LYS HA 1 102 ILE H . . 5.250 3.914 3.276 4.299 . 0 0 "[ . 1 . 2]" 1
380 1 18 LYS HA 1 102 ILE MD . . 3.860 2.625 2.217 3.108 . 0 0 "[ . 1 . 2]" 1
381 1 18 LYS HA 1 102 ILE HG12 . . 4.060 2.836 2.532 3.008 . 0 0 "[ . 1 . 2]" 1
382 1 18 LYS HA 1 102 ILE MG . . 4.540 4.585 4.307 4.649 0.109 6 0 "[ . 1 . 2]" 1
383 1 18 LYS HB2 1 102 ILE H . . 4.870 4.793 3.518 4.953 0.083 14 0 "[ . 1 . 2]" 1
384 1 18 LYS HB3 1 102 ILE H . . 4.410 3.988 3.543 4.495 0.085 10 0 "[ . 1 . 2]" 1
385 1 18 LYS HB3 1 102 ILE HG12 . . 5.160 4.160 3.652 4.499 . 0 0 "[ . 1 . 2]" 1
386 1 19 VAL H 1 19 VAL HB . . 3.110 2.663 2.518 3.037 . 0 0 "[ . 1 . 2]" 1
387 1 19 VAL H 1 19 VAL QG . . 3.570 2.947 2.742 3.195 . 0 0 "[ . 1 . 2]" 1
388 1 19 VAL H 1 20 ALA H . . 4.780 4.270 3.840 4.432 . 0 0 "[ . 1 . 2]" 1
389 1 19 VAL H 1 101 GLU HA . . 5.500 4.776 4.551 5.108 . 0 0 "[ . 1 . 2]" 1
390 1 19 VAL H 1 102 ILE MD . . 4.250 4.237 3.808 4.342 0.092 1 0 "[ . 1 . 2]" 1
391 1 19 VAL HA 1 19 VAL QG . . 3.040 2.162 2.115 2.242 . 0 0 "[ . 1 . 2]" 1
392 1 19 VAL HA 1 20 ALA H . . 2.800 2.220 2.102 2.394 . 0 0 "[ . 1 . 2]" 1
393 1 19 VAL HA 1 101 GLU HA . . 3.350 2.417 2.166 2.795 . 0 0 "[ . 1 . 2]" 1
394 1 19 VAL HA 1 102 ILE H . . 4.020 3.071 2.558 4.095 0.075 10 0 "[ . 1 . 2]" 1
395 1 19 VAL QG 1 20 ALA H . . 3.560 2.548 2.279 2.882 . 0 0 "[ . 1 . 2]" 1
396 1 19 VAL QG 1 20 ALA HA . . 4.930 3.681 3.420 4.003 . 0 0 "[ . 1 . 2]" 1
397 1 19 VAL QG 1 74 VAL HB . . 4.860 4.005 3.737 4.149 . 0 0 "[ . 1 . 2]" 1
398 1 19 VAL QG 1 74 VAL QG . . 2.400 2.112 1.962 2.317 . 0 0 "[ . 1 . 2]" 1
399 1 19 VAL QG 1 99 LYS HA . . 4.510 3.521 3.217 3.705 . 0 0 "[ . 1 . 2]" 1
400 1 19 VAL QG 1 99 LYS HB2 . . 4.060 3.058 2.754 3.223 . 0 0 "[ . 1 . 2]" 1
401 1 19 VAL QG 1 99 LYS HB3 . . 3.460 2.041 1.925 2.228 . 0 0 "[ . 1 . 2]" 1
402 1 19 VAL QG 1 100 MET H . . 4.000 2.569 2.362 2.929 . 0 0 "[ . 1 . 2]" 1
403 1 19 VAL QG 1 100 MET HA . . 4.570 3.546 3.265 3.909 . 0 0 "[ . 1 . 2]" 1
404 1 19 VAL QG 1 100 MET QG . . 5.380 4.010 3.767 4.264 . 0 0 "[ . 1 . 2]" 1
405 1 19 VAL QG 1 101 GLU H . . 4.810 3.591 3.288 4.053 . 0 0 "[ . 1 . 2]" 1
406 1 19 VAL QG 1 101 GLU HA . . 4.140 2.482 2.206 3.260 . 0 0 "[ . 1 . 2]" 1
407 1 19 VAL QG 1 101 GLU HG2 . . 4.880 4.555 4.064 4.823 . 0 0 "[ . 1 . 2]" 1
408 1 19 VAL QG 1 101 GLU HG3 . . 4.140 3.512 2.801 4.095 . 0 0 "[ . 1 . 2]" 1
409 1 20 ALA H 1 20 ALA MB . . 3.190 2.472 2.247 2.660 . 0 0 "[ . 1 . 2]" 1
410 1 20 ALA H 1 99 LYS HA . . 5.190 4.567 4.299 4.969 . 0 0 "[ . 1 . 2]" 1
411 1 20 ALA H 1 99 LYS HB3 . . 4.760 4.297 3.702 4.830 0.070 14 0 "[ . 1 . 2]" 1
412 1 20 ALA H 1 100 MET H . . 3.700 2.807 2.495 3.123 . 0 0 "[ . 1 . 2]" 1
413 1 20 ALA H 1 100 MET QG . . 4.570 3.318 2.994 3.619 . 0 0 "[ . 1 . 2]" 1
414 1 20 ALA H 1 101 GLU HA . . 4.410 3.943 3.685 4.285 . 0 0 "[ . 1 . 2]" 1
415 1 20 ALA H 1 102 ILE H . . 5.140 4.212 3.887 4.723 . 0 0 "[ . 1 . 2]" 1
416 1 20 ALA H 1 102 ILE MG . . 4.320 3.036 2.447 3.519 . 0 0 "[ . 1 . 2]" 1
417 1 20 ALA HA 1 21 THR H . . 2.770 2.152 1.991 2.244 . 0 0 "[ . 1 . 2]" 1
418 1 20 ALA HA 1 21 THR HB . . 4.900 4.693 4.325 4.886 . 0 0 "[ . 1 . 2]" 1
419 1 20 ALA MB 1 21 THR H . . 3.930 3.009 2.386 3.506 . 0 0 "[ . 1 . 2]" 1
420 1 20 ALA MB 1 22 VAL QG . . 3.740 3.104 2.510 3.801 0.061 16 0 "[ . 1 . 2]" 1
421 1 20 ALA MB 1 99 LYS HA . . 5.340 4.463 4.105 4.730 . 0 0 "[ . 1 . 2]" 1
422 1 20 ALA MB 1 100 MET H . . 4.080 3.582 3.307 3.854 . 0 0 "[ . 1 . 2]" 1
423 1 20 ALA MB 1 100 MET QB . . 5.260 4.453 4.124 4.808 . 0 0 "[ . 1 . 2]" 1
424 1 20 ALA MB 1 100 MET QG . . 3.480 2.657 2.396 3.028 . 0 0 "[ . 1 . 2]" 1
425 1 21 THR H 1 21 THR HB . . 3.210 2.586 2.268 2.898 . 0 0 "[ . 1 . 2]" 1
426 1 21 THR H 1 21 THR MG . . 4.350 3.838 3.733 4.016 . 0 0 "[ . 1 . 2]" 1
427 1 21 THR H 1 22 VAL H . . 4.920 4.517 4.391 4.629 . 0 0 "[ . 1 . 2]" 1
428 1 21 THR HA 1 21 THR MG . . 3.380 2.384 2.317 2.721 . 0 0 "[ . 1 . 2]" 1
429 1 21 THR HA 1 22 VAL H . . 2.880 2.209 2.045 2.345 . 0 0 "[ . 1 . 2]" 1
430 1 21 THR HA 1 22 VAL HB . . 5.210 4.781 4.319 5.280 0.070 10 0 "[ . 1 . 2]" 1
431 1 21 THR HA 1 22 VAL QG . . 4.890 3.409 3.133 3.732 . 0 0 "[ . 1 . 2]" 1
432 1 21 THR HA 1 99 LYS HA . . 3.050 2.395 2.249 2.606 . 0 0 "[ . 1 . 2]" 1
433 1 21 THR HA 1 99 LYS HB2 . . 4.700 4.479 4.186 4.760 0.060 7 0 "[ . 1 . 2]" 1
434 1 21 THR HA 1 99 LYS HB3 . . 4.850 3.531 2.902 4.125 . 0 0 "[ . 1 . 2]" 1
435 1 21 THR HA 1 99 LYS HG2 . . 3.720 2.158 1.999 2.723 . 0 0 "[ . 1 . 2]" 1
436 1 21 THR HA 1 99 LYS HG3 . . 4.150 3.390 2.354 4.176 0.026 7 0 "[ . 1 . 2]" 1
437 1 21 THR HA 1 100 MET H . . 4.340 3.896 3.642 4.126 . 0 0 "[ . 1 . 2]" 1
438 1 21 THR MG 1 22 VAL H . . 3.620 2.712 2.199 3.445 . 0 0 "[ . 1 . 2]" 1
439 1 21 THR MG 1 96 TRP HA . . 4.560 3.887 3.588 4.124 . 0 0 "[ . 1 . 2]" 1
440 1 21 THR MG 1 96 TRP HB2 . . 3.440 2.187 2.068 2.383 . 0 0 "[ . 1 . 2]" 1
441 1 21 THR MG 1 96 TRP HB3 . . 3.760 2.566 2.258 2.928 . 0 0 "[ . 1 . 2]" 1
442 1 21 THR MG 1 96 TRP HD1 . . 4.520 4.002 3.594 4.522 0.002 15 0 "[ . 1 . 2]" 1
443 1 21 THR MG 1 96 TRP HE3 . . 3.430 2.729 2.560 3.526 0.096 13 0 "[ . 1 . 2]" 1
444 1 21 THR MG 1 99 LYS HA . . 4.770 3.900 3.404 4.582 . 0 0 "[ . 1 . 2]" 1
445 1 22 VAL H 1 22 VAL HB . . 3.260 2.740 2.383 3.347 0.087 18 0 "[ . 1 . 2]" 1
446 1 22 VAL H 1 22 VAL QG . . 3.510 2.328 1.857 2.632 . 0 0 "[ . 1 . 2]" 1
447 1 22 VAL H 1 23 GLY H . . 5.160 4.468 4.241 4.649 . 0 0 "[ . 1 . 2]" 1
448 1 22 VAL H 1 96 TRP HB2 . . 4.950 3.978 3.456 4.426 . 0 0 "[ . 1 . 2]" 1
449 1 22 VAL H 1 96 TRP HE3 . . 5.290 3.953 3.523 4.466 . 0 0 "[ . 1 . 2]" 1
450 1 22 VAL H 1 97 LEU H . . 5.070 4.221 3.902 4.520 . 0 0 "[ . 1 . 2]" 1
451 1 22 VAL H 1 97 LEU MD1 . . 5.270 5.151 4.597 5.371 0.101 10 0 "[ . 1 . 2]" 1
452 1 22 VAL H 1 98 PHE H . . 3.670 3.359 2.926 3.733 0.063 7 0 "[ . 1 . 2]" 1
453 1 22 VAL H 1 99 LYS HA . . 3.940 3.036 2.702 3.647 . 0 0 "[ . 1 . 2]" 1
454 1 22 VAL H 1 99 LYS HG2 . . 5.390 3.755 3.325 4.337 . 0 0 "[ . 1 . 2]" 1
455 1 22 VAL H 1 100 MET H . . 5.280 4.788 4.268 5.350 0.070 7 0 "[ . 1 . 2]" 1
456 1 22 VAL H 1 100 MET QG . . 5.060 4.314 3.994 4.888 . 0 0 "[ . 1 . 2]" 1
457 1 22 VAL HA 1 22 VAL QG . . 3.110 2.283 2.153 2.670 . 0 0 "[ . 1 . 2]" 1
458 1 22 VAL HA 1 23 GLY H . . 2.800 2.239 2.139 2.327 . 0 0 "[ . 1 . 2]" 1
459 1 22 VAL HB 1 23 GLY H . . 4.590 3.917 3.336 4.300 . 0 0 "[ . 1 . 2]" 1
460 1 22 VAL HB 1 68 PRO HG3 . . 5.260 4.417 2.429 5.330 0.070 7 0 "[ . 1 . 2]" 1
461 1 22 VAL HB 1 97 LEU H . . 4.970 4.406 4.092 5.072 0.102 18 0 "[ . 1 . 2]" 1
462 1 22 VAL HB 1 98 PHE H . . 3.920 3.271 2.539 4.035 0.115 1 0 "[ . 1 . 2]" 1
463 1 22 VAL HB 1 98 PHE QD . . 4.780 3.881 3.395 4.864 0.084 18 0 "[ . 1 . 2]" 1
464 1 22 VAL HB 1 98 PHE QE . . 4.760 3.690 2.938 4.572 . 0 0 "[ . 1 . 2]" 1
465 1 22 VAL QG 1 23 GLY H . . 3.440 2.625 2.334 2.908 . 0 0 "[ . 1 . 2]" 1
466 1 22 VAL QG 1 23 GLY HA2 . . 4.700 3.211 2.735 3.877 . 0 0 "[ . 1 . 2]" 1
467 1 22 VAL QG 1 23 GLY HA3 . . 4.940 4.146 3.827 4.623 . 0 0 "[ . 1 . 2]" 1
468 1 22 VAL QG 1 24 ILE MG . . 5.500 4.147 3.600 4.452 . 0 0 "[ . 1 . 2]" 1
469 1 22 VAL QG 1 68 PRO HB2 . . 5.490 4.297 3.798 5.104 . 0 0 "[ . 1 . 2]" 1
470 1 22 VAL QG 1 68 PRO HB3 . . 5.500 3.634 3.123 4.484 . 0 0 "[ . 1 . 2]" 1
471 1 22 VAL QG 1 68 PRO HD2 . . 3.800 2.506 2.077 3.344 . 0 0 "[ . 1 . 2]" 1
472 1 22 VAL QG 1 68 PRO HD3 . . 3.740 2.282 1.983 3.074 . 0 0 "[ . 1 . 2]" 1
473 1 22 VAL QG 1 68 PRO HG2 . . 3.880 3.083 2.701 3.834 . 0 0 "[ . 1 . 2]" 1
474 1 22 VAL QG 1 68 PRO HG3 . . 3.710 2.358 1.960 3.122 . 0 0 "[ . 1 . 2]" 1
475 1 22 VAL QG 1 73 ILE MG . . 5.320 5.032 4.447 5.237 . 0 0 "[ . 1 . 2]" 1
476 1 22 VAL QG 1 97 LEU H . . 5.040 3.995 2.610 4.574 . 0 0 "[ . 1 . 2]" 1
477 1 22 VAL QG 1 97 LEU MD1 . . 4.500 2.552 1.940 3.352 . 0 0 "[ . 1 . 2]" 1
478 1 22 VAL QG 1 98 PHE H . . 4.740 3.362 1.693 3.965 . 0 0 "[ . 1 . 2]" 1
479 1 22 VAL QG 1 98 PHE QE . . 3.100 2.348 2.026 2.614 . 0 0 "[ . 1 . 2]" 1
480 1 22 VAL QG 1 98 PHE HZ . . 3.380 2.704 2.325 3.080 . 0 0 "[ . 1 . 2]" 1
481 1 22 VAL QG 1 99 LYS HA . . 4.710 3.089 2.523 3.537 . 0 0 "[ . 1 . 2]" 1
482 1 22 VAL QG 1 100 MET H . . 5.070 3.697 3.176 4.192 . 0 0 "[ . 1 . 2]" 1
483 1 22 VAL QG 1 100 MET QG . . 4.210 2.318 2.044 2.797 . 0 0 "[ . 1 . 2]" 1
484 1 23 GLY H 1 24 ILE H . . 4.810 4.219 2.160 4.392 . 0 0 "[ . 1 . 2]" 1
485 1 23 GLY H 1 97 LEU H . . 5.380 4.621 4.081 4.953 . 0 0 "[ . 1 . 2]" 1
486 1 23 GLY H 1 97 LEU MD1 . . 5.500 3.767 3.424 4.108 . 0 0 "[ . 1 . 2]" 1
487 1 23 GLY HA2 1 24 ILE H . . 3.490 2.539 2.425 2.631 . 0 0 "[ . 1 . 2]" 1
488 1 23 GLY HA2 1 24 ILE HA . . 4.420 4.448 4.356 4.518 0.098 7 0 "[ . 1 . 2]" 1
489 1 23 GLY HA2 1 24 ILE MG . . 5.050 3.969 3.536 4.413 . 0 0 "[ . 1 . 2]" 1
490 1 23 GLY HA2 1 96 TRP HA . . 4.030 3.052 2.595 3.629 . 0 0 "[ . 1 . 2]" 1
491 1 23 GLY HA2 1 97 LEU H . . 3.730 2.775 2.123 3.280 . 0 0 "[ . 1 . 2]" 1
492 1 23 GLY HA2 1 97 LEU HB2 . . 4.780 3.567 3.196 3.835 . 0 0 "[ . 1 . 2]" 1
493 1 23 GLY HA2 1 97 LEU MD1 . . 3.750 2.006 1.865 2.216 . 0 0 "[ . 1 . 2]" 1
494 1 23 GLY HA2 1 97 LEU MD2 . . 4.970 4.050 3.738 4.291 . 0 0 "[ . 1 . 2]" 1
495 1 23 GLY HA2 1 97 LEU HG . . 3.570 2.710 2.356 3.280 . 0 0 "[ . 1 . 2]" 1
496 1 23 GLY HA3 1 24 ILE H . . 3.270 2.775 2.641 3.340 0.070 7 0 "[ . 1 . 2]" 1
497 1 23 GLY HA3 1 96 TRP HA . . 3.630 2.460 1.921 2.936 . 0 0 "[ . 1 . 2]" 1
498 1 23 GLY HA3 1 97 LEU H . . 4.070 3.465 3.112 3.718 . 0 0 "[ . 1 . 2]" 1
499 1 23 GLY HA3 1 97 LEU HB2 . . 5.050 5.081 4.792 5.135 0.085 13 0 "[ . 1 . 2]" 1
500 1 23 GLY HA3 1 97 LEU MD1 . . 4.350 3.473 3.197 3.753 . 0 0 "[ . 1 . 2]" 1
501 1 23 GLY HA3 1 97 LEU MD2 . . 5.210 5.169 4.919 5.289 0.079 1 0 "[ . 1 . 2]" 1
502 1 23 GLY HA3 1 97 LEU HG . . 3.870 3.900 3.694 3.951 0.081 15 0 "[ . 1 . 2]" 1
503 1 24 ILE H 1 24 ILE MD . . 5.030 3.884 3.489 4.763 . 0 0 "[ . 1 . 2]" 1
504 1 24 ILE H 1 24 ILE HG12 . . 3.640 2.435 2.111 3.622 . 0 0 "[ . 1 . 2]" 1
505 1 24 ILE H 1 24 ILE HG13 . . 4.030 2.723 1.972 4.110 0.080 7 0 "[ . 1 . 2]" 1
506 1 24 ILE H 1 24 ILE MG . . 3.850 2.818 2.392 3.165 . 0 0 "[ . 1 . 2]" 1
507 1 24 ILE H 1 25 THR H . . 5.080 4.608 4.496 4.725 . 0 0 "[ . 1 . 2]" 1
508 1 24 ILE H 1 96 TRP HA . . 4.880 4.394 4.059 4.954 0.074 7 0 "[ . 1 . 2]" 1
509 1 24 ILE H 1 97 LEU H . . 5.280 4.970 4.425 5.337 0.057 15 0 "[ . 1 . 2]" 1
510 1 24 ILE H 1 97 LEU MD1 . . 3.950 2.704 2.286 3.120 . 0 0 "[ . 1 . 2]" 1
511 1 24 ILE H 1 97 LEU HG . . 5.030 3.576 2.900 4.731 . 0 0 "[ . 1 . 2]" 1
512 1 24 ILE HA 1 24 ILE MG . . 3.350 2.235 2.155 2.370 . 0 0 "[ . 1 . 2]" 1
513 1 24 ILE HA 1 25 THR H . . 3.020 2.364 2.166 2.575 . 0 0 "[ . 1 . 2]" 1
514 1 24 ILE HA 1 25 THR HA . . 4.900 4.371 4.274 4.463 . 0 0 "[ . 1 . 2]" 1
515 1 24 ILE HA 1 25 THR MG . . 4.240 3.597 3.352 3.887 . 0 0 "[ . 1 . 2]" 1
516 1 24 ILE HA 1 28 ALA MB . . 4.620 3.956 3.564 4.195 . 0 0 "[ . 1 . 2]" 1
517 1 24 ILE HA 1 65 VAL MG2 . . 5.500 4.684 4.453 5.078 . 0 0 "[ . 1 . 2]" 1
518 1 24 ILE HB 1 24 ILE MD . . 3.490 2.342 2.049 2.438 . 0 0 "[ . 1 . 2]" 1
519 1 24 ILE HB 1 25 THR H . . 3.310 2.630 2.344 2.929 . 0 0 "[ . 1 . 2]" 1
520 1 24 ILE HB 1 28 ALA HA . . 5.130 4.879 4.524 5.198 0.068 4 0 "[ . 1 . 2]" 1
521 1 24 ILE HB 1 28 ALA MB . . 3.190 2.146 1.928 2.475 . 0 0 "[ . 1 . 2]" 1
522 1 24 ILE HB 1 56 ILE MD . . 4.750 4.132 3.844 4.442 . 0 0 "[ . 1 . 2]" 1
523 1 24 ILE MD 1 24 ILE MG . . 2.890 2.183 2.061 3.028 0.138 20 0 "[ . 1 . 2]" 1
524 1 24 ILE MD 1 25 THR H . . 5.120 4.350 3.324 4.680 . 0 0 "[ . 1 . 2]" 1
525 1 24 ILE MD 1 28 ALA H . . 5.440 4.144 3.510 4.471 . 0 0 "[ . 1 . 2]" 1
526 1 24 ILE MD 1 28 ALA MB . . 3.430 1.954 1.909 2.071 . 0 0 "[ . 1 . 2]" 1
527 1 24 ILE MD 1 29 GLN H . . 4.330 2.974 2.251 3.410 . 0 0 "[ . 1 . 2]" 1
528 1 24 ILE MD 1 29 GLN HA . . 3.790 3.283 2.473 3.693 . 0 0 "[ . 1 . 2]" 1
529 1 24 ILE MD 1 29 GLN HB2 . . 4.510 4.314 3.101 4.619 0.109 10 0 "[ . 1 . 2]" 1
530 1 24 ILE MD 1 29 GLN HB3 . . 4.370 3.076 2.133 3.507 . 0 0 "[ . 1 . 2]" 1
531 1 24 ILE HG12 1 24 ILE MG . . 3.490 2.334 2.111 2.481 . 0 0 "[ . 1 . 2]" 1
532 1 24 ILE HG12 1 28 ALA MB . . 5.240 3.935 3.658 4.198 . 0 0 "[ . 1 . 2]" 1
533 1 24 ILE HG12 1 56 ILE MD . . 4.210 2.849 2.262 3.923 . 0 0 "[ . 1 . 2]" 1
534 1 24 ILE HG12 1 65 VAL MG2 . . 4.920 3.888 3.321 5.005 0.085 13 0 "[ . 1 . 2]" 1
535 1 24 ILE HG12 1 87 ILE MG . . 3.600 2.627 2.082 3.239 . 0 0 "[ . 1 . 2]" 1
536 1 24 ILE HG13 1 25 THR H . . 4.940 4.173 3.521 4.678 . 0 0 "[ . 1 . 2]" 1
537 1 24 ILE HG13 1 28 ALA MB . . 4.310 3.193 2.366 4.357 0.047 20 0 "[ . 1 . 2]" 1
538 1 24 ILE HG13 1 29 GLN H . . 5.040 4.341 3.117 5.098 0.058 20 0 "[ . 1 . 2]" 1
539 1 24 ILE HG13 1 56 ILE MD . . 4.800 3.950 3.503 4.741 . 0 0 "[ . 1 . 2]" 1
540 1 24 ILE MG 1 25 THR H . . 4.390 3.610 3.343 3.961 . 0 0 "[ . 1 . 2]" 1
541 1 24 ILE MG 1 28 ALA MB . . 4.240 3.003 2.804 3.422 . 0 0 "[ . 1 . 2]" 1
542 1 24 ILE MG 1 65 VAL HA . . 5.100 3.643 3.289 4.074 . 0 0 "[ . 1 . 2]" 1
543 1 24 ILE MG 1 65 VAL MG2 . . 3.070 2.063 1.953 2.285 . 0 0 "[ . 1 . 2]" 1
544 1 24 ILE MG 1 66 TYR H . . 5.310 4.901 4.499 5.358 0.048 1 0 "[ . 1 . 2]" 1
545 1 25 THR H 1 25 THR MG . . 3.170 2.445 2.239 2.815 . 0 0 "[ . 1 . 2]" 1
546 1 25 THR H 1 28 ALA H . . 4.610 4.088 3.732 4.686 0.076 20 0 "[ . 1 . 2]" 1
547 1 25 THR H 1 28 ALA MB . . 3.430 3.028 2.536 3.469 0.039 9 0 "[ . 1 . 2]" 1
548 1 25 THR HA 1 25 THR MG . . 3.380 2.356 2.294 2.488 . 0 0 "[ . 1 . 2]" 1
549 1 25 THR HA 1 26 ASN H . . 3.050 2.457 2.219 2.652 . 0 0 "[ . 1 . 2]" 1
550 1 25 THR HA 1 91 PRO HB2 . . 4.730 3.183 2.483 3.705 . 0 0 "[ . 1 . 2]" 1
551 1 25 THR HA 1 92 GLU HB3 . . 5.110 4.788 4.163 5.182 0.072 17 0 "[ . 1 . 2]" 1
552 1 25 THR HA 1 92 GLU HG2 . . 3.970 3.103 2.222 4.538 0.568 6 1 "[ .+ 1 . 2]" 1
553 1 25 THR HB 1 26 ASN H . . 3.140 2.382 1.985 2.585 . 0 0 "[ . 1 . 2]" 1
554 1 25 THR HB 1 27 HIS H . . 3.490 2.965 2.658 3.360 . 0 0 "[ . 1 . 2]" 1
555 1 25 THR HB 1 28 ALA H . . 4.690 4.372 3.822 4.763 0.073 15 0 "[ . 1 . 2]" 1
556 1 25 THR HB 1 117 TYR QE . . 4.230 3.652 3.072 4.007 . 0 0 "[ . 1 . 2]" 1
557 1 25 THR MG 1 26 ASN H . . 4.380 3.607 3.389 3.842 . 0 0 "[ . 1 . 2]" 1
558 1 25 THR MG 1 27 HIS H . . 5.230 4.480 4.238 4.711 . 0 0 "[ . 1 . 2]" 1
559 1 25 THR MG 1 28 ALA MB . . 5.440 4.509 3.959 4.959 . 0 0 "[ . 1 . 2]" 1
560 1 25 THR MG 1 117 TYR QE . . 3.800 2.814 2.324 3.162 . 0 0 "[ . 1 . 2]" 1
561 1 26 ASN H 1 26 ASN QB . . 3.300 2.109 1.909 2.290 . 0 0 "[ . 1 . 2]" 1
562 1 26 ASN H 1 27 HIS H . . 3.680 2.849 2.624 3.121 . 0 0 "[ . 1 . 2]" 1
563 1 26 ASN H 1 28 ALA H . . 5.080 4.329 4.026 4.659 . 0 0 "[ . 1 . 2]" 1
564 1 26 ASN H 1 92 GLU HG2 . . 4.030 3.869 3.182 4.431 0.401 6 0 "[ . 1 . 2]" 1
565 1 26 ASN HA 1 28 ALA MB . . 5.440 4.460 4.022 4.716 . 0 0 "[ . 1 . 2]" 1
566 1 26 ASN HA 1 29 GLN H . . 4.210 3.371 2.853 3.931 . 0 0 "[ . 1 . 2]" 1
567 1 26 ASN HA 1 29 GLN HB2 . . 4.890 4.972 4.943 5.004 0.114 13 0 "[ . 1 . 2]" 1
568 1 26 ASN HA 1 29 GLN HB3 . . 4.340 4.107 3.701 4.395 0.055 4 0 "[ . 1 . 2]" 1
569 1 26 ASN HA 1 29 GLN HE21 . . 4.100 3.252 2.892 3.746 . 0 0 "[ . 1 . 2]" 1
570 1 26 ASN HA 1 29 GLN HE22 . . 5.200 4.202 1.677 5.068 . 0 0 "[ . 1 . 2]" 1
571 1 26 ASN HA 1 29 GLN QG . . 3.500 2.218 1.996 3.355 . 0 0 "[ . 1 . 2]" 1
572 1 26 ASN HA 1 30 GLU H . . 4.540 4.345 3.405 4.630 0.090 9 0 "[ . 1 . 2]" 1
573 1 26 ASN HA 1 91 PRO HB2 . . 4.270 3.809 3.382 4.356 0.086 13 0 "[ . 1 . 2]" 1
574 1 26 ASN HA 1 91 PRO HG2 . . 3.910 3.053 2.597 3.962 0.052 13 0 "[ . 1 . 2]" 1
575 1 26 ASN HA 1 91 PRO HG3 . . 3.500 2.348 2.043 3.581 0.081 13 0 "[ . 1 . 2]" 1
576 1 26 ASN QB 1 27 HIS H . . 3.950 3.077 2.575 3.646 . 0 0 "[ . 1 . 2]" 1
577 1 26 ASN QB 1 91 PRO HG3 . . 5.010 3.410 2.528 4.069 . 0 0 "[ . 1 . 2]" 1
578 1 26 ASN QB 1 92 GLU HG2 . . 4.630 4.547 3.731 5.414 0.784 2 2 "[ + -. 1 . 2]" 1
579 1 26 ASN HD21 1 29 GLN HE21 . . 5.430 3.248 2.066 5.167 . 0 0 "[ . 1 . 2]" 1
580 1 27 HIS H 1 27 HIS HB2 . . 3.180 2.449 2.222 2.864 . 0 0 "[ . 1 . 2]" 1
581 1 27 HIS H 1 27 HIS HB3 . . 3.230 2.662 2.322 2.827 . 0 0 "[ . 1 . 2]" 1
582 1 27 HIS H 1 28 ALA H . . 3.520 2.760 2.051 2.989 . 0 0 "[ . 1 . 2]" 1
583 1 27 HIS H 1 28 ALA MB . . 4.420 4.256 2.918 4.514 0.094 14 0 "[ . 1 . 2]" 1
584 1 27 HIS HA 1 30 GLU H . . 4.430 3.776 3.409 4.437 0.007 15 0 "[ . 1 . 2]" 1
585 1 27 HIS HA 1 30 GLU HB2 . . 4.040 2.972 2.181 4.155 0.115 11 0 "[ . 1 . 2]" 1
586 1 27 HIS HA 1 30 GLU HB3 . . 4.080 3.624 2.390 4.169 0.089 9 0 "[ . 1 . 2]" 1
587 1 27 HIS HA 1 30 GLU HG3 . . 4.960 3.767 2.641 5.014 0.054 11 0 "[ . 1 . 2]" 1
588 1 27 HIS HB2 1 28 ALA H . . 4.190 4.116 3.838 4.243 0.053 4 0 "[ . 1 . 2]" 1
589 1 27 HIS HB3 1 27 HIS HD2 . . 3.900 2.828 2.692 3.712 . 0 0 "[ . 1 . 2]" 1
590 1 27 HIS HB3 1 28 ALA H . . 3.510 3.109 2.649 3.582 0.072 15 0 "[ . 1 . 2]" 1
591 1 27 HIS HD2 1 28 ALA H . . 5.120 4.466 3.992 5.132 0.012 15 0 "[ . 1 . 2]" 1
592 1 27 HIS HD2 1 28 ALA HA . . 4.150 3.745 3.241 4.211 0.061 20 0 "[ . 1 . 2]" 1
593 1 27 HIS HD2 1 28 ALA MB . . 4.360 4.368 4.093 4.464 0.104 20 0 "[ . 1 . 2]" 1
594 1 27 HIS HD2 1 31 GLN QG . . 4.540 4.029 2.897 4.494 . 0 0 "[ . 1 . 2]" 1
595 1 28 ALA H 1 28 ALA MB . . 3.170 2.160 1.857 2.314 . 0 0 "[ . 1 . 2]" 1
596 1 28 ALA H 1 29 GLN H . . 3.400 2.577 2.249 3.075 . 0 0 "[ . 1 . 2]" 1
597 1 28 ALA H 1 30 GLU H . . 4.200 3.758 3.150 4.258 0.058 9 0 "[ . 1 . 2]" 1
598 1 28 ALA HA 1 30 GLU H . . 4.930 4.143 3.762 4.489 . 0 0 "[ . 1 . 2]" 1
599 1 28 ALA HA 1 31 GLN H . . 3.880 3.666 3.235 3.953 0.073 13 0 "[ . 1 . 2]" 1
600 1 28 ALA HA 1 31 GLN QG . . 3.950 3.227 2.237 3.935 . 0 0 "[ . 1 . 2]" 1
601 1 28 ALA HA 1 32 LEU H . . 4.900 4.699 4.075 4.974 0.074 9 0 "[ . 1 . 2]" 1
602 1 28 ALA MB 1 29 GLN H . . 3.440 2.342 2.021 2.610 . 0 0 "[ . 1 . 2]" 1
603 1 28 ALA MB 1 29 GLN HE21 . . 5.240 5.416 5.314 6.238 0.998 15 2 "[ . 1 - + 2]" 1
604 1 28 ALA MB 1 30 GLU H . . 5.410 4.282 4.022 4.410 . 0 0 "[ . 1 . 2]" 1
605 1 29 GLN H 1 29 GLN HB2 . . 3.690 3.603 3.364 3.687 . 0 0 "[ . 1 . 2]" 1
606 1 29 GLN H 1 29 GLN HB3 . . 3.680 2.509 1.993 2.738 . 0 0 "[ . 1 . 2]" 1
607 1 29 GLN H 1 29 GLN HE21 . . 5.400 3.729 3.390 4.995 . 0 0 "[ . 1 . 2]" 1
608 1 29 GLN H 1 29 GLN QG . . 3.650 2.420 2.058 3.417 . 0 0 "[ . 1 . 2]" 1
609 1 29 GLN H 1 30 GLU H . . 3.370 2.781 2.675 2.982 . 0 0 "[ . 1 . 2]" 1
610 1 29 GLN H 1 31 GLN H . . 4.990 4.465 4.202 4.887 . 0 0 "[ . 1 . 2]" 1
611 1 29 GLN H 1 87 ILE MG . . 4.970 3.763 3.208 4.308 . 0 0 "[ . 1 . 2]" 1
612 1 29 GLN H 1 91 PRO HG3 . . 4.540 4.485 3.914 4.632 0.092 13 0 "[ . 1 . 2]" 1
613 1 29 GLN HA 1 30 GLU HA . . 5.060 4.885 4.750 4.999 . 0 0 "[ . 1 . 2]" 1
614 1 29 GLN HA 1 31 GLN H . . 4.910 4.025 3.505 4.810 . 0 0 "[ . 1 . 2]" 1
615 1 29 GLN HA 1 32 LEU H . . 3.850 3.274 2.834 3.732 . 0 0 "[ . 1 . 2]" 1
616 1 29 GLN HA 1 32 LEU HB2 . . 3.350 2.816 2.250 3.420 0.070 20 0 "[ . 1 . 2]" 1
617 1 29 GLN HA 1 32 LEU HG . . 4.390 4.023 3.401 4.468 0.078 3 0 "[ . 1 . 2]" 1
618 1 29 GLN HA 1 87 ILE MG . . 4.440 3.579 2.788 4.522 0.082 19 0 "[ . 1 . 2]" 1
619 1 29 GLN HA 1 88 ASN HD21 . . 5.410 5.270 4.364 5.487 0.077 5 0 "[ . 1 . 2]" 1
620 1 29 GLN HB2 1 87 ILE MG . . 4.310 3.290 2.532 4.374 0.064 19 0 "[ . 1 . 2]" 1
621 1 29 GLN HB2 1 88 ASN HA . . 4.040 2.543 2.151 2.849 . 0 0 "[ . 1 . 2]" 1
622 1 29 GLN HB2 1 88 ASN HB3 . . 4.590 4.540 4.175 4.674 0.084 13 0 "[ . 1 . 2]" 1
623 1 29 GLN HB2 1 88 ASN HD21 . . 4.020 3.736 2.444 4.010 . 0 0 "[ . 1 . 2]" 1
624 1 29 GLN HB2 1 88 ASN HD22 . . 4.590 3.700 3.231 4.162 . 0 0 "[ . 1 . 2]" 1
625 1 29 GLN HB3 1 29 GLN HE21 . . 4.480 4.357 4.227 4.506 0.026 15 0 "[ . 1 . 2]" 1
626 1 29 GLN HB3 1 29 GLN HE22 . . 5.140 5.126 4.514 5.229 0.089 3 0 "[ . 1 . 2]" 1
627 1 29 GLN HB3 1 30 GLU H . . 4.560 4.189 3.566 4.370 . 0 0 "[ . 1 . 2]" 1
628 1 29 GLN HB3 1 87 ILE MG . . 4.230 2.244 1.992 2.962 . 0 0 "[ . 1 . 2]" 1
629 1 29 GLN HB3 1 88 ASN HA . . 4.560 3.447 3.035 3.695 . 0 0 "[ . 1 . 2]" 1
630 1 29 GLN HB3 1 88 ASN HD21 . . 5.010 4.793 3.680 5.073 0.063 15 0 "[ . 1 . 2]" 1
631 1 29 GLN HE21 1 30 GLU H . . 4.870 2.397 2.012 3.820 . 0 0 "[ . 1 . 2]" 1
632 1 29 GLN HE21 1 30 GLU HA . . 4.830 3.372 3.019 4.087 . 0 0 "[ . 1 . 2]" 1
633 1 29 GLN HE21 1 30 GLU HB3 . . 5.460 4.076 2.134 5.342 . 0 0 "[ . 1 . 2]" 1
634 1 29 GLN HE21 1 30 GLU HG2 . . 4.880 3.310 2.076 4.964 0.084 8 0 "[ . 1 . 2]" 1
635 1 29 GLN HE21 1 30 GLU HG3 . . 4.920 3.609 2.116 5.008 0.088 11 0 "[ . 1 . 2]" 1
636 1 29 GLN HE22 1 30 GLU HA . . 4.350 3.229 2.453 4.922 0.572 13 1 "[ . 1 + . 2]" 1
637 1 29 GLN HE22 1 30 GLU HB2 . . 5.250 3.584 2.257 5.005 . 0 0 "[ . 1 . 2]" 1
638 1 29 GLN HE22 1 30 GLU HB3 . . 5.170 4.431 2.856 5.871 0.701 13 1 "[ . 1 + . 2]" 1
639 1 29 GLN HE22 1 30 GLU HG2 . . 5.130 3.334 2.134 5.217 0.087 14 0 "[ . 1 . 2]" 1
640 1 29 GLN HE22 1 30 GLU HG3 . . 5.070 3.618 2.079 5.133 0.063 2 0 "[ . 1 . 2]" 1
641 1 29 GLN QG 1 30 GLU H . . 3.890 3.030 2.876 3.156 . 0 0 "[ . 1 . 2]" 1
642 1 29 GLN QG 1 87 ILE MG . . 5.380 3.298 2.597 3.720 . 0 0 "[ . 1 . 2]" 1
643 1 29 GLN QG 1 88 ASN HA . . 3.880 2.319 2.107 2.589 . 0 0 "[ . 1 . 2]" 1
644 1 29 GLN QG 1 91 PRO HD2 . . 5.110 4.354 3.685 4.971 . 0 0 "[ . 1 . 2]" 1
645 1 29 GLN QG 1 91 PRO HD3 . . 5.500 3.265 2.477 3.967 . 0 0 "[ . 1 . 2]" 1
646 1 29 GLN QG 1 91 PRO HG3 . . 4.160 2.274 2.082 2.887 . 0 0 "[ . 1 . 2]" 1
647 1 30 GLU H 1 30 GLU HB2 . . 3.070 2.181 1.830 3.280 0.210 2 0 "[ . 1 . 2]" 1
648 1 30 GLU H 1 30 GLU HB3 . . 3.200 2.952 1.827 3.293 0.093 16 0 "[ . 1 . 2]" 1
649 1 30 GLU H 1 30 GLU HG2 . . 3.660 3.411 2.757 4.204 0.544 19 3 "[ - .* 1 . +2]" 1
650 1 30 GLU H 1 30 GLU HG3 . . 4.130 3.679 2.781 4.225 0.095 9 0 "[ . 1 . 2]" 1
651 1 30 GLU H 1 31 GLN H . . 3.410 2.815 2.580 2.989 . 0 0 "[ . 1 . 2]" 1
652 1 30 GLU HA 1 30 GLU HG2 . . 4.070 2.670 2.151 3.843 . 0 0 "[ . 1 . 2]" 1
653 1 30 GLU HA 1 30 GLU HG3 . . 3.510 3.307 2.405 3.604 0.094 7 0 "[ . 1 . 2]" 1
654 1 30 GLU HA 1 31 GLN HA . . 5.110 4.683 4.351 4.851 . 0 0 "[ . 1 . 2]" 1
655 1 30 GLU HA 1 32 LEU H . . 5.120 4.738 4.239 5.187 0.067 17 0 "[ . 1 . 2]" 1
656 1 30 GLU HB2 1 31 GLN H . . 3.930 3.415 2.629 4.017 0.087 14 0 "[ . 1 . 2]" 1
657 1 30 GLU HB3 1 31 GLN H . . 3.840 3.293 2.592 3.851 0.011 5 0 "[ . 1 . 2]" 1
658 1 31 GLN H 1 31 GLN HB2 . . 3.010 2.848 2.460 3.744 0.734 5 5 "[ + * *-.* 2]" 1
659 1 31 GLN H 1 31 GLN HB3 . . 3.670 3.521 3.061 3.735 0.065 17 0 "[ . 1 . 2]" 1
660 1 31 GLN H 1 31 GLN QG . . 3.150 2.273 1.749 2.880 . 0 0 "[ . 1 . 2]" 1
661 1 31 GLN H 1 32 LEU H . . 3.110 2.460 2.076 2.875 . 0 0 "[ . 1 . 2]" 1
662 1 31 GLN H 1 32 LEU QD . . 5.500 4.276 3.751 4.844 . 0 0 "[ . 1 . 2]" 1
663 1 31 GLN HA 1 31 GLN HB3 . . 3.040 2.355 2.057 2.551 . 0 0 "[ . 1 . 2]" 1
664 1 31 GLN HA 1 31 GLN HE21 . . 5.410 4.212 1.587 5.336 . 0 0 "[ . 1 . 2]" 1
665 1 31 GLN HA 1 31 GLN QG . . 3.250 2.900 2.346 3.142 . 0 0 "[ . 1 . 2]" 1
666 1 31 GLN HB2 1 31 GLN QG . . 2.740 2.283 2.141 2.480 . 0 0 "[ . 1 . 2]" 1
667 1 31 GLN HB2 1 32 LEU H . . 4.120 3.018 2.476 3.915 . 0 0 "[ . 1 . 2]" 1
668 1 31 GLN HB3 1 32 LEU H . . 4.360 3.943 3.528 4.236 . 0 0 "[ . 1 . 2]" 1
669 1 31 GLN QG 1 32 LEU H . . 4.700 3.689 2.137 4.464 . 0 0 "[ . 1 . 2]" 1
670 1 31 GLN QG 1 32 LEU QD . . 5.500 4.063 2.218 4.965 . 0 0 "[ . 1 . 2]" 1
671 1 32 LEU H 1 32 LEU HB2 . . 2.990 2.461 2.191 2.682 . 0 0 "[ . 1 . 2]" 1
672 1 32 LEU H 1 32 LEU HB3 . . 3.600 3.623 3.489 3.674 0.074 1 0 "[ . 1 . 2]" 1
673 1 32 LEU H 1 32 LEU QD . . 4.320 2.824 2.242 3.399 . 0 0 "[ . 1 . 2]" 1
674 1 32 LEU H 1 32 LEU HG . . 3.620 2.995 2.416 3.701 0.081 2 0 "[ . 1 . 2]" 1
675 1 32 LEU H 1 33 GLY H . . 3.300 2.575 2.176 2.877 . 0 0 "[ . 1 . 2]" 1
676 1 32 LEU HA 1 32 LEU HG . . 3.900 3.332 2.295 3.814 . 0 0 "[ . 1 . 2]" 1
677 1 32 LEU HA 1 58 SER QB . . 4.940 3.655 3.405 4.152 . 0 0 "[ . 1 . 2]" 1
678 1 32 LEU HA 1 58 SER HG . . 4.210 3.280 2.425 4.289 0.079 16 0 "[ . 1 . 2]" 1
679 1 32 LEU HA 1 61 ALA MB . . 3.820 3.051 1.999 3.792 . 0 0 "[ . 1 . 2]" 1
680 1 32 LEU HB2 1 33 GLY H . . 3.670 2.781 2.251 3.221 . 0 0 "[ . 1 . 2]" 1
681 1 32 LEU HB2 1 58 SER QB . . 4.620 3.783 3.474 4.046 . 0 0 "[ . 1 . 2]" 1
682 1 32 LEU HB3 1 33 GLY H . . 3.880 3.608 3.176 3.949 0.069 19 0 "[ . 1 . 2]" 1
683 1 32 LEU HB3 1 35 VAL QG . . 4.110 2.888 2.432 3.479 . 0 0 "[ . 1 . 2]" 1
684 1 32 LEU HB3 1 58 SER QB . . 3.620 2.299 2.068 2.534 . 0 0 "[ . 1 . 2]" 1
685 1 32 LEU HB3 1 58 SER HG . . 4.380 3.142 2.527 3.716 . 0 0 "[ . 1 . 2]" 1
686 1 32 LEU QD 1 33 GLY H . . 5.150 4.164 3.970 4.397 . 0 0 "[ . 1 . 2]" 1
687 1 32 LEU QD 1 35 VAL QG . . 3.770 2.532 2.199 3.035 . 0 0 "[ . 1 . 2]" 1
688 1 32 LEU QD 1 56 ILE MG . . 3.120 2.286 1.851 2.893 . 0 0 "[ . 1 . 2]" 1
689 1 32 LEU QD 1 58 SER H . . 4.830 3.288 2.789 4.062 . 0 0 "[ . 1 . 2]" 1
690 1 32 LEU QD 1 58 SER QB . . 4.290 2.150 1.843 2.646 . 0 0 "[ . 1 . 2]" 1
691 1 32 LEU QD 1 58 SER HG . . 4.680 2.687 2.114 3.717 . 0 0 "[ . 1 . 2]" 1
692 1 32 LEU QD 1 61 ALA H . . 5.420 3.989 3.483 4.374 . 0 0 "[ . 1 . 2]" 1
693 1 32 LEU QD 1 61 ALA MB . . 3.610 2.046 1.819 2.384 . 0 0 "[ . 1 . 2]" 1
694 1 32 LEU QD 1 62 ALA H . . 4.620 3.805 3.371 4.464 . 0 0 "[ . 1 . 2]" 1
695 1 32 LEU QD 1 62 ALA HA . . 4.530 3.486 3.050 3.722 . 0 0 "[ . 1 . 2]" 1
696 1 32 LEU QD 1 62 ALA MB . . 4.640 4.314 3.905 4.636 . 0 0 "[ . 1 . 2]" 1
697 1 32 LEU QD 1 63 ALA H . . 4.290 3.122 2.423 3.896 . 0 0 "[ . 1 . 2]" 1
698 1 32 LEU QD 1 63 ALA HA . . 5.040 3.852 3.505 4.384 . 0 0 "[ . 1 . 2]" 1
699 1 32 LEU QD 1 63 ALA MB . . 3.250 1.989 1.806 2.428 . 0 0 "[ . 1 . 2]" 1
700 1 32 LEU HG 1 58 SER QB . . 4.760 4.353 3.885 4.640 . 0 0 "[ . 1 . 2]" 1
701 1 33 GLY H 1 34 ASP H . . 4.570 4.472 4.319 4.587 0.017 6 0 "[ . 1 . 2]" 1
702 1 33 GLY HA2 1 34 ASP H . . 3.190 3.121 2.772 3.273 0.083 14 0 "[ . 1 . 2]" 1
703 1 33 GLY HA3 1 34 ASP H . . 2.980 2.151 2.055 2.245 . 0 0 "[ . 1 . 2]" 1
704 1 33 GLY HA3 1 34 ASP HA . . 4.610 4.457 4.160 4.612 0.002 2 0 "[ . 1 . 2]" 1
705 1 33 GLY HA3 1 59 VAL QG . . 4.780 4.114 3.079 4.676 . 0 0 "[ . 1 . 2]" 1
706 1 34 ASP H 1 34 ASP HB2 . . 3.060 2.374 1.997 2.807 . 0 0 "[ . 1 . 2]" 1
707 1 34 ASP H 1 35 VAL H . . 4.710 4.299 3.321 4.659 . 0 0 "[ . 1 . 2]" 1
708 1 34 ASP H 1 59 VAL H . . 5.500 5.164 4.593 5.561 0.061 4 0 "[ . 1 . 2]" 1
709 1 34 ASP H 1 59 VAL QG . . 3.670 3.310 2.941 3.571 . 0 0 "[ . 1 . 2]" 1
710 1 34 ASP HA 1 35 VAL H . . 2.650 2.262 2.109 2.622 . 0 0 "[ . 1 . 2]" 1
711 1 34 ASP HA 1 35 VAL HA . . 5.220 4.448 4.277 4.545 . 0 0 "[ . 1 . 2]" 1
712 1 34 ASP HA 1 35 VAL QG . . 4.640 3.828 3.394 4.173 . 0 0 "[ . 1 . 2]" 1
713 1 34 ASP HA 1 59 VAL QG . . 5.390 4.156 3.845 4.549 . 0 0 "[ . 1 . 2]" 1
714 1 34 ASP HA 1 88 ASN HD21 . . 4.580 4.209 3.716 4.646 0.066 10 0 "[ . 1 . 2]" 1
715 1 34 ASP HA 1 88 ASN HD22 . . 3.640 3.112 2.656 3.522 . 0 0 "[ . 1 . 2]" 1
716 1 34 ASP HB2 1 59 VAL H . . 4.650 4.572 3.951 5.579 0.929 7 2 "[ .-+ 1 . 2]" 1
717 1 34 ASP HB2 1 59 VAL QG . . 3.640 2.487 2.116 3.347 . 0 0 "[ . 1 . 2]" 1
718 1 34 ASP HB3 1 35 VAL H . . 4.490 3.725 2.818 4.344 . 0 0 "[ . 1 . 2]" 1
719 1 34 ASP HB3 1 36 VAL QG . . 5.500 4.469 3.601 5.327 . 0 0 "[ . 1 . 2]" 1
720 1 34 ASP HB3 1 59 VAL H . . 5.500 4.833 4.054 5.577 0.077 1 0 "[ . 1 . 2]" 1
721 1 34 ASP HB3 1 59 VAL QG . . 3.650 2.748 2.073 3.462 . 0 0 "[ . 1 . 2]" 1
722 1 35 VAL H 1 35 VAL HB . . 3.070 2.872 2.400 3.137 0.067 15 0 "[ . 1 . 2]" 1
723 1 35 VAL H 1 35 VAL QG . . 3.190 2.428 1.976 2.806 . 0 0 "[ . 1 . 2]" 1
724 1 35 VAL H 1 36 VAL H . . 5.280 4.286 3.895 4.421 . 0 0 "[ . 1 . 2]" 1
725 1 35 VAL H 1 85 GLU HA . . 4.690 3.284 2.338 4.130 . 0 0 "[ . 1 . 2]" 1
726 1 35 VAL H 1 88 ASN HD21 . . 4.870 3.885 3.289 4.416 . 0 0 "[ . 1 . 2]" 1
727 1 35 VAL H 1 88 ASN HD22 . . 3.970 3.240 2.570 4.033 0.063 7 0 "[ . 1 . 2]" 1
728 1 35 VAL HA 1 35 VAL QG . . 3.190 2.132 2.031 2.294 . 0 0 "[ . 1 . 2]" 1
729 1 35 VAL HA 1 36 VAL HA . . 5.090 4.610 4.180 4.958 . 0 0 "[ . 1 . 2]" 1
730 1 35 VAL HA 1 36 VAL QG . . 4.130 2.919 2.091 3.999 . 0 0 "[ . 1 . 2]" 1
731 1 35 VAL HA 1 37 TYR H . . 4.520 4.023 3.716 4.581 0.061 19 0 "[ . 1 . 2]" 1
732 1 35 VAL HA 1 56 ILE MG . . 4.540 4.570 4.282 4.658 0.118 2 0 "[ . 1 . 2]" 1
733 1 35 VAL HA 1 58 SER HA . . 2.790 2.263 2.013 2.858 0.068 19 0 "[ . 1 . 2]" 1
734 1 35 VAL HA 1 58 SER QB . . 3.770 2.475 1.802 3.100 . 0 0 "[ . 1 . 2]" 1
735 1 35 VAL HA 1 59 VAL H . . 4.370 3.136 2.617 3.615 . 0 0 "[ . 1 . 2]" 1
736 1 35 VAL HA 1 59 VAL QG . . 5.500 3.458 2.951 4.221 . 0 0 "[ . 1 . 2]" 1
737 1 35 VAL HB 1 36 VAL H . . 5.150 2.823 2.014 3.701 . 0 0 "[ . 1 . 2]" 1
738 1 35 VAL HB 1 37 TYR H . . 4.640 4.164 3.664 4.740 0.100 2 0 "[ . 1 . 2]" 1
739 1 35 VAL HB 1 85 GLU HA . . 3.610 3.595 3.255 3.724 0.114 15 0 "[ . 1 . 2]" 1
740 1 35 VAL HB 1 88 ASN HD22 . . 4.970 4.517 3.427 5.055 0.085 12 0 "[ . 1 . 2]" 1
741 1 35 VAL QG 1 36 VAL H . . 3.460 1.634 1.462 1.990 . 0 0 "[ . 1 . 2]" 1
742 1 35 VAL QG 1 36 VAL HA . . 5.230 3.953 3.707 4.093 . 0 0 "[ . 1 . 2]" 1
743 1 35 VAL QG 1 36 VAL QG . . 2.400 2.504 2.478 2.531 0.131 1 0 "[ . 1 . 2]" 1
744 1 35 VAL QG 1 37 TYR H . . 3.290 1.921 1.739 2.237 . 0 0 "[ . 1 . 2]" 1
745 1 35 VAL QG 1 37 TYR HA . . 5.040 4.057 3.806 4.268 . 0 0 "[ . 1 . 2]" 1
746 1 35 VAL QG 1 57 GLU H . . 4.350 3.429 3.034 3.811 . 0 0 "[ . 1 . 2]" 1
747 1 35 VAL QG 1 57 GLU HB2 . . 5.010 4.749 4.568 4.997 . 0 0 "[ . 1 . 2]" 1
748 1 35 VAL QG 1 58 SER HA . . 4.250 2.181 1.942 2.658 . 0 0 "[ . 1 . 2]" 1
749 1 35 VAL QG 1 58 SER QB . . 4.090 2.264 1.917 2.625 . 0 0 "[ . 1 . 2]" 1
750 1 35 VAL QG 1 58 SER HG . . 5.500 4.050 3.395 4.522 . 0 0 "[ . 1 . 2]" 1
751 1 35 VAL QG 1 84 PRO HA . . 4.750 3.971 3.452 4.443 . 0 0 "[ . 1 . 2]" 1
752 1 35 VAL QG 1 84 PRO HB2 . . 3.080 2.548 2.096 2.974 . 0 0 "[ . 1 . 2]" 1
753 1 35 VAL QG 1 84 PRO HB3 . . 4.120 3.478 3.135 3.960 . 0 0 "[ . 1 . 2]" 1
754 1 35 VAL QG 1 84 PRO HG2 . . 4.470 3.911 3.175 4.330 . 0 0 "[ . 1 . 2]" 1
755 1 35 VAL QG 1 85 GLU HA . . 3.880 2.929 1.820 3.840 . 0 0 "[ . 1 . 2]" 1
756 1 35 VAL QG 1 87 ILE HB . . 3.320 3.057 2.293 3.371 0.051 10 0 "[ . 1 . 2]" 1
757 1 35 VAL QG 1 88 ASN H . . 4.830 4.205 3.333 4.745 . 0 0 "[ . 1 . 2]" 1
758 1 35 VAL QG 1 88 ASN HD21 . . 4.630 2.995 2.236 3.487 . 0 0 "[ . 1 . 2]" 1
759 1 35 VAL QG 1 88 ASN HD22 . . 3.600 2.871 2.376 3.287 . 0 0 "[ . 1 . 2]" 1
760 1 36 VAL H 1 36 VAL HB . . 3.930 3.451 2.929 3.902 . 0 0 "[ . 1 . 2]" 1
761 1 36 VAL H 1 36 VAL QG . . 3.140 2.457 1.911 3.077 . 0 0 "[ . 1 . 2]" 1
762 1 36 VAL H 1 37 TYR H . . 2.780 1.795 1.553 2.226 . 0 0 "[ . 1 . 2]" 1
763 1 36 VAL H 1 56 ILE MG . . 5.290 4.369 4.151 4.775 . 0 0 "[ . 1 . 2]" 1
764 1 36 VAL H 1 58 SER HA . . 3.520 3.196 2.781 3.600 0.080 19 0 "[ . 1 . 2]" 1
765 1 36 VAL H 1 58 SER QB . . 4.920 4.378 3.981 4.762 . 0 0 "[ . 1 . 2]" 1
766 1 36 VAL HA 1 36 VAL QG . . 3.210 2.208 2.100 2.444 . 0 0 "[ . 1 . 2]" 1
767 1 36 VAL HA 1 84 PRO HB2 . . 4.020 3.958 3.491 4.119 0.099 14 0 "[ . 1 . 2]" 1
768 1 36 VAL HA 1 84 PRO HG2 . . 4.250 2.892 2.479 3.332 . 0 0 "[ . 1 . 2]" 1
769 1 36 VAL HA 1 84 PRO HG3 . . 4.920 3.479 2.569 4.235 . 0 0 "[ . 1 . 2]" 1
770 1 36 VAL HB 1 37 TYR H . . 3.440 3.529 3.508 3.547 0.107 14 0 "[ . 1 . 2]" 1
771 1 36 VAL HB 1 37 TYR HB2 . . 5.060 4.242 3.362 5.145 0.085 17 0 "[ . 1 . 2]" 1
772 1 36 VAL HB 1 58 SER HA . . 4.900 4.042 2.244 4.988 0.088 13 0 "[ . 1 . 2]" 1
773 1 36 VAL QG 1 37 TYR H . . 3.610 2.217 1.940 2.511 . 0 0 "[ . 1 . 2]" 1
774 1 36 VAL QG 1 37 TYR HB2 . . 4.050 3.111 2.288 3.989 . 0 0 "[ . 1 . 2]" 1
775 1 36 VAL QG 1 37 TYR HB3 . . 4.220 2.978 2.218 3.795 . 0 0 "[ . 1 . 2]" 1
776 1 36 VAL QG 1 57 GLU H . . 5.500 4.233 3.623 4.762 . 0 0 "[ . 1 . 2]" 1
777 1 36 VAL QG 1 57 GLU HB2 . . 4.540 4.000 3.080 4.579 0.039 6 0 "[ . 1 . 2]" 1
778 1 36 VAL QG 1 57 GLU HB3 . . 4.820 3.231 2.406 4.087 . 0 0 "[ . 1 . 2]" 1
779 1 36 VAL QG 1 58 SER H . . 5.180 3.746 3.059 4.112 . 0 0 "[ . 1 . 2]" 1
780 1 36 VAL QG 1 58 SER HA . . 3.490 2.043 1.840 2.164 . 0 0 "[ . 1 . 2]" 1
781 1 36 VAL QG 1 59 VAL H . . 3.970 3.078 2.818 3.362 . 0 0 "[ . 1 . 2]" 1
782 1 36 VAL QG 1 59 VAL HA . . 4.290 2.698 2.312 3.142 . 0 0 "[ . 1 . 2]" 1
783 1 36 VAL QG 1 59 VAL QG . . 3.330 2.518 2.069 3.064 . 0 0 "[ . 1 . 2]" 1
784 1 37 TYR H 1 37 TYR HB2 . . 3.910 3.334 3.164 3.494 . 0 0 "[ . 1 . 2]" 1
785 1 37 TYR H 1 37 TYR HB3 . . 3.610 2.871 2.707 3.046 . 0 0 "[ . 1 . 2]" 1
786 1 37 TYR H 1 37 TYR QD . . 4.750 4.460 4.393 4.546 . 0 0 "[ . 1 . 2]" 1
787 1 37 TYR H 1 38 VAL H . . 4.770 4.426 4.342 4.515 . 0 0 "[ . 1 . 2]" 1
788 1 37 TYR H 1 38 VAL QG . . 4.850 3.880 3.583 4.222 . 0 0 "[ . 1 . 2]" 1
789 1 37 TYR H 1 56 ILE MG . . 4.630 4.018 3.700 4.379 . 0 0 "[ . 1 . 2]" 1
790 1 37 TYR H 1 57 GLU H . . 3.910 3.890 3.546 3.989 0.079 1 0 "[ . 1 . 2]" 1
791 1 37 TYR H 1 57 GLU HB2 . . 4.740 4.672 4.440 4.819 0.079 4 0 "[ . 1 . 2]" 1
792 1 37 TYR H 1 58 SER HA . . 4.350 3.494 3.225 3.844 . 0 0 "[ . 1 . 2]" 1
793 1 37 TYR H 1 84 PRO HB2 . . 5.080 3.416 3.037 3.830 . 0 0 "[ . 1 . 2]" 1
794 1 37 TYR H 1 84 PRO HB3 . . 5.020 3.958 3.433 4.406 . 0 0 "[ . 1 . 2]" 1
795 1 37 TYR HA 1 37 TYR QD . . 3.130 2.391 2.256 2.649 . 0 0 "[ . 1 . 2]" 1
796 1 37 TYR HA 1 38 VAL H . . 2.750 2.334 2.206 2.482 . 0 0 "[ . 1 . 2]" 1
797 1 37 TYR HA 1 38 VAL QG . . 4.850 3.516 3.047 3.948 . 0 0 "[ . 1 . 2]" 1
798 1 37 TYR HA 1 84 PRO HB2 . . 4.530 3.922 3.588 4.450 . 0 0 "[ . 1 . 2]" 1
799 1 37 TYR HA 1 84 PRO HB3 . . 4.000 3.101 2.721 3.695 . 0 0 "[ . 1 . 2]" 1
800 1 37 TYR HA 1 84 PRO HG3 . . 4.430 3.182 2.599 4.354 . 0 0 "[ . 1 . 2]" 1
801 1 37 TYR HB2 1 38 VAL H . . 4.180 3.958 3.749 4.082 . 0 0 "[ . 1 . 2]" 1
802 1 37 TYR HB2 1 57 GLU HB2 . . 5.500 4.364 3.970 4.826 . 0 0 "[ . 1 . 2]" 1
803 1 37 TYR HB2 1 57 GLU HB3 . . 4.820 4.683 3.724 4.891 0.071 5 0 "[ . 1 . 2]" 1
804 1 37 TYR HB3 1 38 VAL H . . 4.580 3.802 3.585 4.061 . 0 0 "[ . 1 . 2]" 1
805 1 37 TYR HB3 1 57 GLU H . . 4.450 3.334 2.892 3.779 . 0 0 "[ . 1 . 2]" 1
806 1 37 TYR HB3 1 57 GLU HB2 . . 3.570 2.752 2.428 3.121 . 0 0 "[ . 1 . 2]" 1
807 1 37 TYR HB3 1 57 GLU HB3 . . 3.650 3.329 2.215 3.704 0.054 16 0 "[ . 1 . 2]" 1
808 1 37 TYR QD 1 38 VAL H . . 3.720 2.762 2.394 2.977 . 0 0 "[ . 1 . 2]" 1
809 1 37 TYR QD 1 38 VAL HA . . 4.610 3.898 3.312 4.274 . 0 0 "[ . 1 . 2]" 1
810 1 37 TYR QD 1 39 ASP H . . 5.440 4.378 3.909 4.864 . 0 0 "[ . 1 . 2]" 1
811 1 37 TYR QD 1 57 GLU H . . 5.480 3.398 2.773 3.954 . 0 0 "[ . 1 . 2]" 1
812 1 37 TYR QD 1 57 GLU HB2 . . 4.170 2.464 2.206 2.579 . 0 0 "[ . 1 . 2]" 1
813 1 37 TYR QD 1 57 GLU HB3 . . 4.790 3.922 3.297 4.238 . 0 0 "[ . 1 . 2]" 1
814 1 37 TYR QD 1 57 GLU QG . . 4.340 4.049 3.448 4.211 . 0 0 "[ . 1 . 2]" 1
815 1 37 TYR QE 1 39 ASP H . . 5.070 3.967 3.230 4.512 . 0 0 "[ . 1 . 2]" 1
816 1 37 TYR QE 1 39 ASP HA . . 3.610 3.150 2.615 3.623 0.013 19 0 "[ . 1 . 2]" 1
817 1 37 TYR QE 1 39 ASP HB2 . . 3.180 2.678 2.218 3.033 . 0 0 "[ . 1 . 2]" 1
818 1 37 TYR QE 1 39 ASP HB3 . . 4.170 4.070 3.444 4.246 0.076 9 0 "[ . 1 . 2]" 1
819 1 37 TYR QE 1 57 GLU HB2 . . 4.610 4.563 4.275 4.698 0.088 6 0 "[ . 1 . 2]" 1
820 1 38 VAL H 1 38 VAL QG . . 3.740 2.796 2.486 3.162 . 0 0 "[ . 1 . 2]" 1
821 1 38 VAL H 1 39 ASP H . . 4.860 4.106 3.901 4.243 . 0 0 "[ . 1 . 2]" 1
822 1 38 VAL H 1 84 PRO HB3 . . 5.190 3.874 3.285 4.355 . 0 0 "[ . 1 . 2]" 1
823 1 38 VAL HA 1 38 VAL QG . . 3.290 2.427 2.111 2.694 . 0 0 "[ . 1 . 2]" 1
824 1 38 VAL HA 1 39 ASP H . . 2.770 2.039 1.921 2.184 . 0 0 "[ . 1 . 2]" 1
825 1 38 VAL HA 1 39 ASP HA . . 4.150 4.244 4.237 4.249 0.099 2 0 "[ . 1 . 2]" 1
826 1 38 VAL HA 1 39 ASP HB2 . . 4.720 4.552 4.228 4.766 0.046 13 0 "[ . 1 . 2]" 1
827 1 38 VAL HA 1 39 ASP HB3 . . 4.530 4.200 3.806 4.603 0.073 20 0 "[ . 1 . 2]" 1
828 1 38 VAL HA 1 56 ILE MG . . 4.260 3.189 2.393 3.861 . 0 0 "[ . 1 . 2]" 1
829 1 38 VAL HA 1 57 GLU H . . 3.930 3.275 2.883 3.707 . 0 0 "[ . 1 . 2]" 1
830 1 38 VAL HB 1 39 ASP H . . 4.690 3.616 2.716 4.407 . 0 0 "[ . 1 . 2]" 1
831 1 38 VAL HB 1 56 ILE MG . . 4.030 3.644 2.268 4.154 0.124 19 0 "[ . 1 . 2]" 1
832 1 38 VAL QG 1 39 ASP H . . 3.670 2.861 2.300 3.399 . 0 0 "[ . 1 . 2]" 1
833 1 38 VAL QG 1 39 ASP HA . . 5.220 3.882 3.597 4.099 . 0 0 "[ . 1 . 2]" 1
834 1 38 VAL QG 1 40 LEU H . . 4.550 4.372 3.559 4.569 0.019 12 0 "[ . 1 . 2]" 1
835 1 38 VAL QG 1 40 LEU HA . . 5.020 4.017 3.660 4.301 . 0 0 "[ . 1 . 2]" 1
836 1 38 VAL QG 1 40 LEU HG . . 3.570 2.882 2.064 3.663 0.093 16 0 "[ . 1 . 2]" 1
837 1 38 VAL QG 1 56 ILE HA . . 4.530 3.198 2.255 4.072 . 0 0 "[ . 1 . 2]" 1
838 1 38 VAL QG 1 57 GLU H . . 4.810 4.097 3.562 4.643 . 0 0 "[ . 1 . 2]" 1
839 1 38 VAL QG 1 80 LEU H . . 5.500 4.404 3.924 4.835 . 0 0 "[ . 1 . 2]" 1
840 1 38 VAL QG 1 80 LEU HA . . 4.840 3.689 3.486 4.001 . 0 0 "[ . 1 . 2]" 1
841 1 38 VAL QG 1 80 LEU HB3 . . 3.540 2.060 1.918 2.295 . 0 0 "[ . 1 . 2]" 1
842 1 38 VAL QG 1 81 ASP H . . 5.500 4.510 3.676 5.164 . 0 0 "[ . 1 . 2]" 1
843 1 38 VAL QG 1 84 PRO HA . . 4.230 2.684 2.285 3.346 . 0 0 "[ . 1 . 2]" 1
844 1 38 VAL QG 1 84 PRO HB2 . . 3.420 3.054 2.471 3.504 0.084 19 0 "[ . 1 . 2]" 1
845 1 38 VAL QG 1 84 PRO HB3 . . 3.930 2.365 2.070 2.779 . 0 0 "[ . 1 . 2]" 1
846 1 38 VAL QG 1 84 PRO HG3 . . 4.900 4.206 3.723 4.657 . 0 0 "[ . 1 . 2]" 1
847 1 38 VAL QG 1 87 ILE MD . . 2.430 2.158 1.909 2.448 0.018 17 0 "[ . 1 . 2]" 1
848 1 39 ASP H 1 39 ASP HB2 . . 3.440 2.932 2.539 3.204 . 0 0 "[ . 1 . 2]" 1
849 1 39 ASP H 1 39 ASP HB3 . . 3.390 2.281 2.111 2.575 . 0 0 "[ . 1 . 2]" 1
850 1 39 ASP H 1 40 LEU H . . 5.050 4.504 4.031 4.622 . 0 0 "[ . 1 . 2]" 1
851 1 39 ASP H 1 54 ALA MB . . 4.980 4.733 4.451 5.058 0.078 13 0 "[ . 1 . 2]" 1
852 1 39 ASP H 1 55 SER HB2 . . 4.830 4.428 3.824 4.991 0.161 6 0 "[ . 1 . 2]" 1
853 1 39 ASP H 1 55 SER HB3 . . 4.910 4.344 3.439 4.832 . 0 0 "[ . 1 . 2]" 1
854 1 39 ASP H 1 56 ILE HA . . 4.560 3.189 2.732 3.533 . 0 0 "[ . 1 . 2]" 1
855 1 39 ASP HA 1 40 LEU H . . 2.760 2.310 2.168 2.513 . 0 0 "[ . 1 . 2]" 1
856 1 39 ASP HA 1 40 LEU HB2 . . 5.000 4.520 4.231 4.737 . 0 0 "[ . 1 . 2]" 1
857 1 39 ASP HA 1 40 LEU QD . . 4.950 3.934 2.876 4.674 . 0 0 "[ . 1 . 2]" 1
858 1 39 ASP HA 1 40 LEU HG . . 5.500 4.523 3.706 5.598 0.098 19 0 "[ . 1 . 2]" 1
859 1 39 ASP HB2 1 40 LEU H . . 5.010 4.084 3.813 4.654 . 0 0 "[ . 1 . 2]" 1
860 1 39 ASP HB2 1 55 SER H . . 4.050 3.893 3.443 4.131 0.081 1 0 "[ . 1 . 2]" 1
861 1 39 ASP HB2 1 55 SER HB2 . . 4.000 3.535 2.701 4.276 0.276 6 0 "[ . 1 . 2]" 1
862 1 39 ASP HB2 1 55 SER HB3 . . 4.190 3.853 2.915 4.274 0.084 9 0 "[ . 1 . 2]" 1
863 1 39 ASP HB3 1 40 LEU H . . 4.990 4.187 3.878 4.557 . 0 0 "[ . 1 . 2]" 1
864 1 39 ASP HB3 1 54 ALA HA . . 4.520 3.419 2.466 4.123 . 0 0 "[ . 1 . 2]" 1
865 1 39 ASP HB3 1 54 ALA MB . . 5.140 4.675 4.069 5.201 0.061 1 0 "[ . 1 . 2]" 1
866 1 39 ASP HB3 1 55 SER H . . 3.310 2.434 2.056 2.718 . 0 0 "[ . 1 . 2]" 1
867 1 39 ASP HB3 1 55 SER HB2 . . 3.720 2.748 2.179 3.832 0.112 6 0 "[ . 1 . 2]" 1
868 1 39 ASP HB3 1 55 SER HB3 . . 3.750 3.235 2.151 3.834 0.084 17 0 "[ . 1 . 2]" 1
869 1 40 LEU H 1 40 LEU HB2 . . 3.130 2.732 2.316 2.835 . 0 0 "[ . 1 . 2]" 1
870 1 40 LEU H 1 40 LEU HB3 . . 3.780 3.809 3.591 3.852 0.072 2 0 "[ . 1 . 2]" 1
871 1 40 LEU H 1 40 LEU QD . . 4.280 3.423 2.874 3.829 . 0 0 "[ . 1 . 2]" 1
872 1 40 LEU H 1 41 PRO HD2 . . 4.980 4.984 4.824 5.050 0.070 18 0 "[ . 1 . 2]" 1
873 1 40 LEU H 1 41 PRO HD3 . . 5.480 4.622 4.406 4.881 . 0 0 "[ . 1 . 2]" 1
874 1 40 LEU HA 1 40 LEU QD . . 3.040 2.237 2.072 2.902 . 0 0 "[ . 1 . 2]" 1
875 1 40 LEU HA 1 40 LEU HG . . 4.030 3.177 2.186 3.767 . 0 0 "[ . 1 . 2]" 1
876 1 40 LEU HA 1 41 PRO HD2 . . 3.260 2.574 2.289 2.796 . 0 0 "[ . 1 . 2]" 1
877 1 40 LEU HA 1 41 PRO HD3 . . 3.190 2.059 2.005 2.094 . 0 0 "[ . 1 . 2]" 1
878 1 40 LEU HA 1 41 PRO HG3 . . 4.200 4.272 4.260 4.283 0.083 9 0 "[ . 1 . 2]" 1
879 1 40 LEU HA 1 54 ALA MB . . 3.530 3.203 2.805 3.617 0.087 6 0 "[ . 1 . 2]" 1
880 1 40 LEU HA 1 76 VAL QG . . 5.140 4.317 3.934 4.670 . 0 0 "[ . 1 . 2]" 1
881 1 40 LEU HB2 1 40 LEU QD . . 3.050 2.235 2.170 2.287 . 0 0 "[ . 1 . 2]" 1
882 1 40 LEU HB2 1 41 PRO HD2 . . 4.020 3.958 3.721 4.099 0.079 11 0 "[ . 1 . 2]" 1
883 1 40 LEU HB2 1 41 PRO HD3 . . 4.990 4.608 4.386 4.773 . 0 0 "[ . 1 . 2]" 1
884 1 40 LEU HB2 1 76 VAL HB . . 4.000 3.858 3.186 4.081 0.081 17 0 "[ . 1 . 2]" 1
885 1 40 LEU HB2 1 76 VAL QG . . 4.690 3.656 3.166 4.022 . 0 0 "[ . 1 . 2]" 1
886 1 40 LEU HB3 1 41 PRO HD2 . . 3.200 2.445 2.160 2.769 . 0 0 "[ . 1 . 2]" 1
887 1 40 LEU HB3 1 41 PRO HD3 . . 4.550 3.523 3.191 3.873 . 0 0 "[ . 1 . 2]" 1
888 1 40 LEU HB3 1 76 VAL HB . . 4.060 2.639 2.154 3.167 . 0 0 "[ . 1 . 2]" 1
889 1 40 LEU HB3 1 76 VAL QG . . 3.410 2.809 2.382 3.155 . 0 0 "[ . 1 . 2]" 1
890 1 40 LEU QD 1 41 PRO HD2 . . 3.650 2.836 2.401 3.348 . 0 0 "[ . 1 . 2]" 1
891 1 40 LEU QD 1 41 PRO HD3 . . 4.180 3.172 2.545 3.765 . 0 0 "[ . 1 . 2]" 1
892 1 40 LEU QD 1 54 ALA MB . . 3.640 2.950 2.261 3.699 0.059 6 0 "[ . 1 . 2]" 1
893 1 40 LEU QD 1 76 VAL HB . . 4.040 2.641 2.170 3.245 . 0 0 "[ . 1 . 2]" 1
894 1 40 LEU QD 1 77 ASN H . . 3.820 2.601 2.132 3.027 . 0 0 "[ . 1 . 2]" 1
895 1 40 LEU QD 1 77 ASN HB2 . . 5.050 4.024 3.724 4.229 . 0 0 "[ . 1 . 2]" 1
896 1 40 LEU QD 1 77 ASN HB3 . . 4.680 3.224 2.797 3.687 . 0 0 "[ . 1 . 2]" 1
897 1 40 LEU QD 1 78 GLU HA . . 4.010 2.990 2.099 3.939 . 0 0 "[ . 1 . 2]" 1
898 1 40 LEU QD 1 80 LEU H . . 4.710 3.571 3.094 4.175 . 0 0 "[ . 1 . 2]" 1
899 1 40 LEU QD 1 80 LEU HB2 . . 3.960 2.427 2.124 3.014 . 0 0 "[ . 1 . 2]" 1
900 1 40 LEU QD 1 80 LEU HB3 . . 4.460 3.420 2.907 3.967 . 0 0 "[ . 1 . 2]" 1
901 1 40 LEU QD 1 80 LEU QD . . 4.730 3.174 1.792 3.949 . 0 0 "[ . 1 . 2]" 1
902 1 40 LEU QD 1 81 ASP H . . 4.780 3.715 2.654 4.384 . 0 0 "[ . 1 . 2]" 1
903 1 40 LEU QD 1 97 LEU HA . . 3.970 2.687 2.362 3.103 . 0 0 "[ . 1 . 2]" 1
904 1 40 LEU QD 1 97 LEU HB3 . . 3.070 2.511 2.068 3.155 0.085 6 0 "[ . 1 . 2]" 1
905 1 40 LEU QD 1 98 PHE HA . . 5.160 3.793 3.225 4.183 . 0 0 "[ . 1 . 2]" 1
906 1 40 LEU QD 1 98 PHE HB2 . . 5.340 4.209 3.549 4.864 . 0 0 "[ . 1 . 2]" 1
907 1 40 LEU QD 1 98 PHE HB3 . . 4.680 2.833 2.285 3.598 . 0 0 "[ . 1 . 2]" 1
908 1 40 LEU QD 1 98 PHE QD . . 4.400 3.213 2.437 4.209 . 0 0 "[ . 1 . 2]" 1
909 1 40 LEU HG 1 41 PRO HD2 . . 5.090 4.551 3.584 5.135 0.045 2 0 "[ . 1 . 2]" 1
910 1 40 LEU HG 1 76 VAL HB . . 5.460 4.308 2.430 5.313 . 0 0 "[ . 1 . 2]" 1
911 1 41 PRO HA 1 42 GLU H . . 2.820 2.615 2.474 2.878 0.058 4 0 "[ . 1 . 2]" 1
912 1 41 PRO HA 1 42 GLU HA . . 4.690 4.493 4.373 4.649 . 0 0 "[ . 1 . 2]" 1
913 1 41 PRO HA 1 53 VAL MG2 . . 5.220 5.224 4.784 5.331 0.111 4 0 "[ . 1 . 2]" 1
914 1 41 PRO HB2 1 42 GLU H . . 3.480 2.328 1.946 2.455 . 0 0 "[ . 1 . 2]" 1
915 1 41 PRO HB2 1 45 ARG HD3 . . 4.370 3.219 2.224 4.410 0.040 20 0 "[ . 1 . 2]" 1
916 1 41 PRO HB2 1 53 VAL MG2 . . 5.500 4.313 3.977 4.863 . 0 0 "[ . 1 . 2]" 1
917 1 41 PRO HB2 1 73 ILE MD . . 4.330 3.805 3.219 4.335 0.005 4 0 "[ . 1 . 2]" 1
918 1 41 PRO HB2 1 73 ILE HG13 . . 4.030 2.278 2.048 2.835 . 0 0 "[ . 1 . 2]" 1
919 1 41 PRO HB3 1 42 GLU H . . 3.380 3.302 3.118 3.451 0.071 7 0 "[ . 1 . 2]" 1
920 1 41 PRO HB3 1 45 ARG HD2 . . 5.220 3.769 2.934 4.561 . 0 0 "[ . 1 . 2]" 1
921 1 41 PRO HB3 1 45 ARG HD3 . . 4.760 3.071 2.213 4.641 . 0 0 "[ . 1 . 2]" 1
922 1 41 PRO HB3 1 53 VAL HA . . 4.250 3.966 3.180 4.316 0.066 3 0 "[ . 1 . 2]" 1
923 1 41 PRO HB3 1 53 VAL HB . . 3.740 2.202 2.068 2.432 . 0 0 "[ . 1 . 2]" 1
924 1 41 PRO HB3 1 53 VAL MG1 . . 4.850 3.509 3.020 3.841 . 0 0 "[ . 1 . 2]" 1
925 1 41 PRO HB3 1 53 VAL MG2 . . 4.300 3.482 3.121 3.874 . 0 0 "[ . 1 . 2]" 1
926 1 41 PRO HB3 1 54 ALA MB . . 5.130 4.722 4.313 5.075 . 0 0 "[ . 1 . 2]" 1
927 1 41 PRO HB3 1 73 ILE MD . . 4.990 4.130 3.398 4.777 . 0 0 "[ . 1 . 2]" 1
928 1 41 PRO HB3 1 73 ILE HG13 . . 4.260 3.291 2.582 3.839 . 0 0 "[ . 1 . 2]" 1
929 1 41 PRO HD2 1 54 ALA MB . . 4.140 3.817 3.561 4.206 0.066 1 0 "[ . 1 . 2]" 1
930 1 41 PRO HD2 1 73 ILE MD . . 5.500 4.794 3.980 5.327 . 0 0 "[ . 1 . 2]" 1
931 1 41 PRO HD2 1 73 ILE MG . . 4.950 3.646 3.362 3.800 . 0 0 "[ . 1 . 2]" 1
932 1 41 PRO HD2 1 76 VAL HB . . 5.090 3.614 2.797 4.283 . 0 0 "[ . 1 . 2]" 1
933 1 41 PRO HD2 1 76 VAL QG . . 3.680 2.581 2.179 2.993 . 0 0 "[ . 1 . 2]" 1
934 1 41 PRO HD2 1 98 PHE QD . . 4.840 3.603 2.764 4.107 . 0 0 "[ . 1 . 2]" 1
935 1 41 PRO HD3 1 53 VAL MG2 . . 4.800 3.795 3.366 4.187 . 0 0 "[ . 1 . 2]" 1
936 1 41 PRO HD3 1 54 ALA HA . . 4.990 3.212 2.680 3.523 . 0 0 "[ . 1 . 2]" 1
937 1 41 PRO HD3 1 54 ALA MB . . 3.410 2.553 2.240 2.939 . 0 0 "[ . 1 . 2]" 1
938 1 41 PRO HD3 1 76 VAL QG . . 4.760 4.020 3.586 4.429 . 0 0 "[ . 1 . 2]" 1
939 1 41 PRO HD3 1 98 PHE QD . . 5.400 3.269 2.635 3.900 . 0 0 "[ . 1 . 2]" 1
940 1 41 PRO HG2 1 73 ILE MD . . 4.690 3.153 2.372 3.770 . 0 0 "[ . 1 . 2]" 1
941 1 41 PRO HG2 1 73 ILE MG . . 4.100 2.104 1.993 2.206 . 0 0 "[ . 1 . 2]" 1
942 1 41 PRO HG2 1 76 VAL QG . . 3.560 2.818 2.315 3.262 . 0 0 "[ . 1 . 2]" 1
943 1 41 PRO HG2 1 98 PHE HB2 . . 5.280 3.227 2.647 3.834 . 0 0 "[ . 1 . 2]" 1
944 1 41 PRO HG3 1 42 GLU H . . 4.910 4.926 4.600 4.992 0.082 9 0 "[ . 1 . 2]" 1
945 1 41 PRO HG3 1 53 VAL HB . . 3.910 2.818 2.443 3.057 . 0 0 "[ . 1 . 2]" 1
946 1 41 PRO HG3 1 53 VAL MG1 . . 4.260 4.232 3.712 4.359 0.099 14 0 "[ . 1 . 2]" 1
947 1 41 PRO HG3 1 53 VAL MG2 . . 4.390 2.700 2.335 2.993 . 0 0 "[ . 1 . 2]" 1
948 1 41 PRO HG3 1 54 ALA MB . . 3.710 3.429 2.992 3.785 0.075 5 0 "[ . 1 . 2]" 1
949 1 41 PRO HG3 1 73 ILE MD . . 3.800 3.017 2.147 3.609 . 0 0 "[ . 1 . 2]" 1
950 1 41 PRO HG3 1 98 PHE HB2 . . 5.500 4.112 3.625 4.430 . 0 0 "[ . 1 . 2]" 1
951 1 41 PRO HG3 1 98 PHE QD . . 4.050 3.529 3.135 3.925 . 0 0 "[ . 1 . 2]" 1
952 1 42 GLU H 1 42 GLU HB2 . . 3.320 2.473 2.119 2.821 . 0 0 "[ . 1 . 2]" 1
953 1 42 GLU H 1 42 GLU HB3 . . 2.960 2.696 2.362 3.380 0.420 14 0 "[ . 1 . 2]" 1
954 1 42 GLU H 1 42 GLU HG3 . . 4.440 4.417 3.995 4.530 0.090 18 0 "[ . 1 . 2]" 1
955 1 42 GLU H 1 45 ARG HB2 . . 5.300 2.776 2.301 3.370 . 0 0 "[ . 1 . 2]" 1
956 1 42 GLU H 1 45 ARG HD2 . . 4.450 2.955 2.531 3.613 . 0 0 "[ . 1 . 2]" 1
957 1 42 GLU H 1 45 ARG HD3 . . 4.620 3.624 2.676 4.696 0.076 11 0 "[ . 1 . 2]" 1
958 1 42 GLU HA 1 42 GLU HG2 . . 3.910 2.674 2.105 3.588 . 0 0 "[ . 1 . 2]" 1
959 1 42 GLU HA 1 42 GLU HG3 . . 3.680 2.749 2.003 3.521 . 0 0 "[ . 1 . 2]" 1
960 1 42 GLU HA 1 43 VAL H . . 2.810 2.335 2.158 2.608 . 0 0 "[ . 1 . 2]" 1
961 1 42 GLU HA 1 43 VAL HA . . 4.510 4.295 4.199 4.414 . 0 0 "[ . 1 . 2]" 1
962 1 42 GLU HA 1 76 VAL QG . . 4.320 3.534 3.235 3.830 . 0 0 "[ . 1 . 2]" 1
963 1 42 GLU HB2 1 45 ARG H . . 4.960 4.830 3.958 5.274 0.314 1 0 "[ . 1 . 2]" 1
964 1 42 GLU HB3 1 43 VAL H . . 4.160 3.551 2.568 4.021 . 0 0 "[ . 1 . 2]" 1
965 1 42 GLU HG2 1 43 VAL H . . 4.370 2.539 1.992 3.750 . 0 0 "[ . 1 . 2]" 1
966 1 42 GLU HG2 1 76 VAL QG . . 5.190 5.158 4.771 6.147 0.957 11 4 "[ .* -+ *. 2]" 1
967 1 42 GLU HG3 1 43 VAL H . . 3.670 3.320 2.241 3.751 0.081 17 0 "[ . 1 . 2]" 1
968 1 43 VAL H 1 43 VAL HB . . 2.880 2.067 1.809 2.511 . 0 0 "[ . 1 . 2]" 1
969 1 43 VAL H 1 43 VAL MG1 . . 3.950 2.652 2.402 3.002 . 0 0 "[ . 1 . 2]" 1
970 1 43 VAL H 1 43 VAL MG2 . . 3.860 3.524 3.164 3.790 . 0 0 "[ . 1 . 2]" 1
971 1 43 VAL H 1 44 GLY H . . 5.320 2.999 2.565 3.210 . 0 0 "[ . 1 . 2]" 1
972 1 43 VAL H 1 73 ILE MG . . 5.140 4.292 3.960 4.565 . 0 0 "[ . 1 . 2]" 1
973 1 43 VAL H 1 76 VAL QG . . 4.360 3.688 3.115 4.136 . 0 0 "[ . 1 . 2]" 1
974 1 43 VAL HA 1 43 VAL MG1 . . 3.300 3.209 3.192 3.224 . 0 0 "[ . 1 . 2]" 1
975 1 43 VAL HA 1 43 VAL MG2 . . 3.170 2.206 2.147 2.259 . 0 0 "[ . 1 . 2]" 1
976 1 43 VAL HA 1 44 GLY HA2 . . 4.480 4.466 4.384 4.533 0.053 3 0 "[ . 1 . 2]" 1
977 1 43 VAL HA 1 45 ARG H . . 3.910 3.966 3.743 3.997 0.087 4 0 "[ . 1 . 2]" 1
978 1 43 VAL HA 1 73 ILE HB . . 3.560 3.345 2.999 3.620 0.060 18 0 "[ . 1 . 2]" 1
979 1 43 VAL HA 1 73 ILE MG . . 3.150 2.317 2.079 2.666 . 0 0 "[ . 1 . 2]" 1
980 1 43 VAL HA 1 74 VAL HA . . 4.840 3.275 2.775 3.601 . 0 0 "[ . 1 . 2]" 1
981 1 43 VAL HA 1 76 VAL QG . . 4.160 3.020 2.549 3.430 . 0 0 "[ . 1 . 2]" 1
982 1 43 VAL HB 1 44 GLY H . . 4.670 4.298 4.212 4.405 . 0 0 "[ . 1 . 2]" 1
983 1 43 VAL MG1 1 44 GLY H . . 3.450 3.520 3.342 3.548 0.098 11 0 "[ . 1 . 2]" 1
984 1 43 VAL MG1 1 44 GLY HA2 . . 4.670 4.234 4.117 4.378 . 0 0 "[ . 1 . 2]" 1
985 1 43 VAL MG1 1 44 GLY HA3 . . 4.820 3.880 3.770 4.072 . 0 0 "[ . 1 . 2]" 1
986 1 43 VAL MG1 1 74 VAL HA . . 3.570 3.675 3.655 3.686 0.116 10 0 "[ . 1 . 2]" 1
987 1 43 VAL MG1 1 75 GLU QG . . 5.500 5.426 4.729 5.579 0.079 17 0 "[ . 1 . 2]" 1
988 1 43 VAL MG2 1 44 GLY H . . 4.420 4.370 4.179 4.458 0.038 2 0 "[ . 1 . 2]" 1
989 1 43 VAL MG2 1 44 GLY HA3 . . 5.500 5.370 5.222 5.498 . 0 0 "[ . 1 . 2]" 1
990 1 43 VAL MG2 1 74 VAL HA . . 4.180 2.576 2.103 3.052 . 0 0 "[ . 1 . 2]" 1
991 1 43 VAL MG2 1 74 VAL HB . . 4.250 4.061 3.653 4.366 0.116 20 0 "[ . 1 . 2]" 1
992 1 43 VAL MG2 1 75 GLU H . . 4.140 3.253 2.921 3.671 . 0 0 "[ . 1 . 2]" 1
993 1 43 VAL MG2 1 75 GLU HA . . 3.310 2.220 1.966 2.378 . 0 0 "[ . 1 . 2]" 1
994 1 43 VAL MG2 1 75 GLU QG . . 4.980 3.495 2.907 3.714 . 0 0 "[ . 1 . 2]" 1
995 1 43 VAL MG2 1 76 VAL H . . 3.730 3.365 2.921 3.787 0.057 16 0 "[ . 1 . 2]" 1
996 1 44 GLY H 1 45 ARG H . . 3.250 1.848 1.676 2.187 . 0 0 "[ . 1 . 2]" 1
997 1 44 GLY H 1 45 ARG HB3 . . 5.020 4.171 3.895 4.504 . 0 0 "[ . 1 . 2]" 1
998 1 44 GLY H 1 73 ILE H . . 5.500 4.968 4.676 5.391 . 0 0 "[ . 1 . 2]" 1
999 1 44 GLY H 1 73 ILE HB . . 3.930 3.272 2.916 3.908 . 0 0 "[ . 1 . 2]" 1
1000 1 44 GLY H 1 74 VAL HA . . 4.630 4.719 4.710 4.726 0.096 13 0 "[ . 1 . 2]" 1
1001 1 44 GLY HA2 1 73 ILE HB . . 4.940 4.153 3.663 4.615 . 0 0 "[ . 1 . 2]" 1
1002 1 44 GLY HA2 1 74 VAL HA . . 5.260 3.919 3.533 4.288 . 0 0 "[ . 1 . 2]" 1
1003 1 44 GLY HA2 1 74 VAL QG . . 5.180 3.512 3.164 3.997 . 0 0 "[ . 1 . 2]" 1
1004 1 45 ARG H 1 45 ARG HB2 . . 3.100 2.518 2.357 2.733 . 0 0 "[ . 1 . 2]" 1
1005 1 45 ARG H 1 45 ARG HB3 . . 3.160 2.568 2.379 2.809 . 0 0 "[ . 1 . 2]" 1
1006 1 45 ARG H 1 45 ARG HD3 . . 5.070 4.978 4.733 5.144 0.074 15 0 "[ . 1 . 2]" 1
1007 1 45 ARG H 1 45 ARG HG2 . . 4.720 4.511 4.341 4.617 . 0 0 "[ . 1 . 2]" 1
1008 1 45 ARG H 1 45 ARG HG3 . . 5.200 4.462 4.306 4.705 . 0 0 "[ . 1 . 2]" 1
1009 1 45 ARG H 1 46 GLU H . . 4.830 4.665 4.562 4.793 . 0 0 "[ . 1 . 2]" 1
1010 1 45 ARG H 1 47 VAL QG . . 5.500 4.691 4.511 4.884 . 0 0 "[ . 1 . 2]" 1
1011 1 45 ARG H 1 73 ILE H . . 4.450 3.553 3.062 3.847 . 0 0 "[ . 1 . 2]" 1
1012 1 45 ARG H 1 73 ILE HB . . 3.390 2.387 2.178 2.680 . 0 0 "[ . 1 . 2]" 1
1013 1 45 ARG H 1 73 ILE MD . . 5.500 4.890 4.646 5.206 . 0 0 "[ . 1 . 2]" 1
1014 1 45 ARG H 1 73 ILE HG12 . . 5.150 3.630 3.313 4.043 . 0 0 "[ . 1 . 2]" 1
1015 1 45 ARG H 1 73 ILE MG . . 4.770 3.779 3.559 4.038 . 0 0 "[ . 1 . 2]" 1
1016 1 45 ARG HA 1 45 ARG HD2 . . 4.970 4.268 3.844 4.649 . 0 0 "[ . 1 . 2]" 1
1017 1 45 ARG HA 1 45 ARG HD3 . . 4.880 4.602 4.375 4.715 . 0 0 "[ . 1 . 2]" 1
1018 1 45 ARG HA 1 45 ARG HG2 . . 3.410 3.010 2.557 3.410 . 0 0 "[ . 1 . 2]" 1
1019 1 45 ARG HA 1 45 ARG HG3 . . 3.790 2.526 2.391 2.990 . 0 0 "[ . 1 . 2]" 1
1020 1 45 ARG HA 1 46 GLU H . . 2.540 2.313 2.234 2.489 . 0 0 "[ . 1 . 2]" 1
1021 1 45 ARG HA 1 46 GLU HA . . 5.420 4.503 4.437 4.543 . 0 0 "[ . 1 . 2]" 1
1022 1 45 ARG HB2 1 45 ARG HD2 . . 3.580 2.452 2.197 2.930 . 0 0 "[ . 1 . 2]" 1
1023 1 45 ARG HB2 1 45 ARG HD3 . . 3.810 3.083 2.656 3.577 . 0 0 "[ . 1 . 2]" 1
1024 1 45 ARG HB2 1 45 ARG HE . . 5.310 4.634 4.387 4.998 . 0 0 "[ . 1 . 2]" 1
1025 1 45 ARG HB2 1 46 GLU H . . 4.540 4.376 4.277 4.471 . 0 0 "[ . 1 . 2]" 1
1026 1 45 ARG HB2 1 47 VAL QG . . 5.450 4.480 4.186 4.858 . 0 0 "[ . 1 . 2]" 1
1027 1 45 ARG HB3 1 45 ARG HD3 . . 3.550 2.551 2.322 2.750 . 0 0 "[ . 1 . 2]" 1
1028 1 45 ARG HB3 1 46 GLU H . . 4.970 4.125 3.737 4.441 . 0 0 "[ . 1 . 2]" 1
1029 1 45 ARG HB3 1 47 VAL QG . . 4.900 3.189 2.861 3.512 . 0 0 "[ . 1 . 2]" 1
1030 1 45 ARG HB3 1 73 ILE H . . 3.750 3.749 3.616 3.831 0.081 15 0 "[ . 1 . 2]" 1
1031 1 45 ARG HB3 1 73 ILE HB . . 4.130 3.119 2.726 3.716 . 0 0 "[ . 1 . 2]" 1
1032 1 45 ARG HD2 1 46 GLU H . . 5.380 5.402 5.054 5.465 0.085 14 0 "[ . 1 . 2]" 1
1033 1 45 ARG HD2 1 47 VAL QG . . 4.540 4.396 3.712 4.612 0.072 2 0 "[ . 1 . 2]" 1
1034 1 45 ARG HD3 1 47 VAL QG . . 4.110 3.178 2.483 3.710 . 0 0 "[ . 1 . 2]" 1
1035 1 45 ARG HD3 1 73 ILE MD . . 5.130 4.774 4.110 5.219 0.089 15 0 "[ . 1 . 2]" 1
1036 1 45 ARG HE 1 47 VAL QG . . 4.490 3.750 2.372 4.542 0.052 11 0 "[ . 1 . 2]" 1
1037 1 45 ARG HG2 1 46 GLU H . . 3.740 2.955 2.282 3.795 0.055 6 0 "[ . 1 . 2]" 1
1038 1 45 ARG HG2 1 47 VAL QG . . 3.910 2.945 2.199 3.852 . 0 0 "[ . 1 . 2]" 1
1039 1 45 ARG HG3 1 46 GLU H . . 3.920 3.299 2.746 3.966 0.046 20 0 "[ . 1 . 2]" 1
1040 1 46 GLU H 1 46 GLU HB2 . . 3.080 2.287 2.103 2.811 . 0 0 "[ . 1 . 2]" 1
1041 1 46 GLU H 1 46 GLU HB3 . . 3.440 3.399 2.190 3.533 0.093 20 0 "[ . 1 . 2]" 1
1042 1 46 GLU H 1 46 GLU HG2 . . 4.200 3.879 3.122 4.269 0.069 13 0 "[ . 1 . 2]" 1
1043 1 46 GLU H 1 46 GLU HG3 . . 3.840 3.247 2.306 4.275 0.435 4 0 "[ . 1 . 2]" 1
1044 1 46 GLU H 1 47 VAL H . . 5.210 4.608 4.490 4.676 . 0 0 "[ . 1 . 2]" 1
1045 1 46 GLU H 1 47 VAL QG . . 4.760 4.088 3.907 4.369 . 0 0 "[ . 1 . 2]" 1
1046 1 46 GLU H 1 72 LYS HA . . 5.010 4.665 4.475 4.968 . 0 0 "[ . 1 . 2]" 1
1047 1 46 GLU HA 1 46 GLU HG2 . . 3.820 2.249 2.052 3.199 . 0 0 "[ . 1 . 2]" 1
1048 1 46 GLU HA 1 46 GLU HG3 . . 3.960 2.985 2.354 3.415 . 0 0 "[ . 1 . 2]" 1
1049 1 46 GLU HA 1 47 VAL H . . 2.630 2.301 2.238 2.398 . 0 0 "[ . 1 . 2]" 1
1050 1 46 GLU HA 1 47 VAL QG . . 4.260 3.123 2.536 3.322 . 0 0 "[ . 1 . 2]" 1
1051 1 46 GLU HA 1 72 LYS HA . . 2.870 2.121 1.973 2.490 . 0 0 "[ . 1 . 2]" 1
1052 1 46 GLU HA 1 72 LYS QB . . 4.220 2.982 2.128 3.893 . 0 0 "[ . 1 . 2]" 1
1053 1 46 GLU HA 1 73 ILE H . . 3.960 3.496 3.292 3.708 . 0 0 "[ . 1 . 2]" 1
1054 1 46 GLU HB2 1 46 GLU HG3 . . 2.900 2.381 2.215 2.513 . 0 0 "[ . 1 . 2]" 1
1055 1 46 GLU HB2 1 47 VAL H . . 4.290 4.181 3.946 4.357 0.067 3 0 "[ . 1 . 2]" 1
1056 1 46 GLU HB3 1 47 VAL H . . 3.950 3.035 2.716 4.010 0.060 4 0 "[ . 1 . 2]" 1
1057 1 46 GLU HG2 1 47 VAL H . . 5.120 3.618 2.586 4.234 . 0 0 "[ . 1 . 2]" 1
1058 1 46 GLU HG2 1 72 LYS HA . . 4.770 3.458 3.054 4.842 0.072 4 0 "[ . 1 . 2]" 1
1059 1 46 GLU HG2 1 72 LYS QB . . 3.850 2.641 2.145 4.479 0.629 4 1 "[ +. 1 . 2]" 1
1060 1 46 GLU HG3 1 47 VAL H . . 4.980 4.697 2.130 5.087 0.107 20 0 "[ . 1 . 2]" 1
1061 1 46 GLU HG3 1 72 LYS HA . . 4.780 4.464 3.595 4.862 0.082 3 0 "[ . 1 . 2]" 1
1062 1 47 VAL H 1 47 VAL QG . . 3.060 2.314 2.083 2.400 . 0 0 "[ . 1 . 2]" 1
1063 1 47 VAL H 1 70 SER HA . . 5.120 4.566 4.182 4.964 . 0 0 "[ . 1 . 2]" 1
1064 1 47 VAL H 1 71 GLY H . . 3.450 3.069 2.841 3.521 0.071 16 0 "[ . 1 . 2]" 1
1065 1 47 VAL H 1 72 LYS HA . . 3.650 3.048 2.836 3.323 . 0 0 "[ . 1 . 2]" 1
1066 1 47 VAL H 1 73 ILE H . . 4.890 4.547 4.319 4.775 . 0 0 "[ . 1 . 2]" 1
1067 1 47 VAL H 1 73 ILE MD . . 5.400 4.590 4.156 5.453 0.053 5 0 "[ . 1 . 2]" 1
1068 1 47 VAL H 1 100 MET ME . . 4.600 4.329 3.846 4.704 0.104 11 0 "[ . 1 . 2]" 1
1069 1 47 VAL HA 1 47 VAL HB . . 2.940 2.488 2.391 3.020 0.080 12 0 "[ . 1 . 2]" 1
1070 1 47 VAL HA 1 47 VAL QG . . 3.140 2.293 2.030 2.450 . 0 0 "[ . 1 . 2]" 1
1071 1 47 VAL HA 1 48 LYS H . . 2.670 2.503 2.290 2.724 0.054 16 0 "[ . 1 . 2]" 1
1072 1 47 VAL HA 1 48 LYS HG3 . . 4.960 4.414 3.315 5.870 0.910 10 4 "[ *.* +- . 2]" 1
1073 1 47 VAL HB 1 48 LYS H . . 3.090 2.474 2.124 3.185 0.095 20 0 "[ . 1 . 2]" 1
1074 1 47 VAL HB 1 53 VAL MG1 . . 3.680 3.266 2.597 3.798 0.118 20 0 "[ . 1 . 2]" 1
1075 1 47 VAL HB 1 53 VAL MG2 . . 5.470 3.387 2.542 4.721 . 0 0 "[ . 1 . 2]" 1
1076 1 47 VAL HB 1 67 ALA MB . . 3.500 2.858 2.419 3.622 0.122 20 0 "[ . 1 . 2]" 1
1077 1 47 VAL QG 1 48 LYS H . . 3.990 2.970 1.796 3.502 . 0 0 "[ . 1 . 2]" 1
1078 1 47 VAL QG 1 49 LYS H . . 5.490 4.973 4.616 5.269 . 0 0 "[ . 1 . 2]" 1
1079 1 47 VAL QG 1 49 LYS HA . . 5.330 4.709 4.338 4.960 . 0 0 "[ . 1 . 2]" 1
1080 1 47 VAL QG 1 51 GLU QG . . 4.630 3.492 2.438 4.452 . 0 0 "[ . 1 . 2]" 1
1081 1 47 VAL QG 1 53 VAL HA . . 5.440 4.806 4.448 5.069 . 0 0 "[ . 1 . 2]" 1
1082 1 47 VAL QG 1 53 VAL MG2 . . 3.980 2.153 1.955 2.541 . 0 0 "[ . 1 . 2]" 1
1083 1 47 VAL QG 1 67 ALA MB . . 3.220 2.351 1.858 2.675 . 0 0 "[ . 1 . 2]" 1
1084 1 47 VAL QG 1 70 SER HA . . 3.940 3.188 2.780 3.560 . 0 0 "[ . 1 . 2]" 1
1085 1 47 VAL QG 1 70 SER QB . . 4.970 4.621 4.307 4.897 . 0 0 "[ . 1 . 2]" 1
1086 1 47 VAL QG 1 71 GLY H . . 3.490 2.896 2.517 3.355 . 0 0 "[ . 1 . 2]" 1
1087 1 47 VAL QG 1 71 GLY HA2 . . 5.380 4.413 4.150 4.721 . 0 0 "[ . 1 . 2]" 1
1088 1 47 VAL QG 1 72 LYS HA . . 4.570 2.829 2.178 3.293 . 0 0 "[ . 1 . 2]" 1
1089 1 47 VAL QG 1 73 ILE H . . 4.600 3.013 2.441 3.311 . 0 0 "[ . 1 . 2]" 1
1090 1 47 VAL QG 1 73 ILE MD . . 3.310 1.965 1.823 2.522 . 0 0 "[ . 1 . 2]" 1
1091 1 47 VAL QG 1 73 ILE HG12 . . 3.880 2.262 2.064 2.722 . 0 0 "[ . 1 . 2]" 1
1092 1 47 VAL QG 1 73 ILE HG13 . . 4.330 3.071 2.738 3.626 . 0 0 "[ . 1 . 2]" 1
1093 1 47 VAL QG 1 100 MET ME . . 2.980 2.195 1.926 2.619 . 0 0 "[ . 1 . 2]" 1
1094 1 47 VAL QG 1 100 MET QG . . 5.500 4.031 3.654 4.382 . 0 0 "[ . 1 . 2]" 1
1095 1 48 LYS H 1 48 LYS HB2 . . 3.210 2.495 2.240 2.698 . 0 0 "[ . 1 . 2]" 1
1096 1 48 LYS H 1 48 LYS HB3 . . 3.580 3.632 3.482 3.681 0.101 20 0 "[ . 1 . 2]" 1
1097 1 48 LYS H 1 48 LYS HG3 . . 3.690 3.606 2.650 4.447 0.757 4 6 "[ +.- * ** . *2]" 1
1098 1 48 LYS H 1 49 LYS H . . 4.960 4.375 4.255 4.562 . 0 0 "[ . 1 . 2]" 1
1099 1 48 LYS H 1 51 GLU H . . 4.970 4.098 3.221 4.920 . 0 0 "[ . 1 . 2]" 1
1100 1 48 LYS H 1 51 GLU HB2 . . 3.980 2.152 1.679 2.799 . 0 0 "[ . 1 . 2]" 1
1101 1 48 LYS H 1 51 GLU HB3 . . 4.070 3.147 2.289 3.994 . 0 0 "[ . 1 . 2]" 1
1102 1 48 LYS H 1 51 GLU QG . . 3.760 2.734 1.891 3.816 0.056 9 0 "[ . 1 . 2]" 1
1103 1 48 LYS H 1 53 VAL MG1 . . 5.500 4.372 3.873 4.880 . 0 0 "[ . 1 . 2]" 1
1104 1 48 LYS H 1 67 ALA MB . . 4.820 3.472 2.932 4.324 . 0 0 "[ . 1 . 2]" 1
1105 1 48 LYS H 1 71 GLY H . . 5.500 4.893 4.125 5.360 . 0 0 "[ . 1 . 2]" 1
1106 1 48 LYS HA 1 48 LYS HG2 . . 4.030 2.560 2.182 2.928 . 0 0 "[ . 1 . 2]" 1
1107 1 48 LYS HA 1 48 LYS HG3 . . 4.030 3.167 2.396 3.749 . 0 0 "[ . 1 . 2]" 1
1108 1 48 LYS HA 1 49 LYS H . . 2.740 2.385 2.252 2.545 . 0 0 "[ . 1 . 2]" 1
1109 1 48 LYS HA 1 49 LYS HA . . 4.640 4.349 4.054 4.493 . 0 0 "[ . 1 . 2]" 1
1110 1 48 LYS HA 1 70 SER HA . . 3.210 2.111 1.905 2.378 . 0 0 "[ . 1 . 2]" 1
1111 1 48 LYS HA 1 70 SER QB . . 2.840 2.727 2.381 2.926 0.086 5 0 "[ . 1 . 2]" 1
1112 1 48 LYS HB2 1 48 LYS HG3 . . 2.710 2.486 2.332 2.752 0.042 13 0 "[ . 1 . 2]" 1
1113 1 48 LYS HB2 1 49 LYS H . . 4.360 3.749 3.431 3.930 . 0 0 "[ . 1 . 2]" 1
1114 1 48 LYS HB2 1 51 GLU H . . 4.640 4.517 3.874 4.719 0.079 3 0 "[ . 1 . 2]" 1
1115 1 48 LYS HB2 1 51 GLU QG . . 3.940 3.157 2.078 4.041 0.101 11 0 "[ . 1 . 2]" 1
1116 1 48 LYS HB3 1 48 LYS HG3 . . 3.030 2.866 2.403 3.061 0.031 20 0 "[ . 1 . 2]" 1
1117 1 48 LYS HB3 1 49 LYS H . . 3.700 2.472 2.243 2.712 . 0 0 "[ . 1 . 2]" 1
1118 1 48 LYS HG3 1 49 LYS H . . 5.180 4.705 4.287 4.903 . 0 0 "[ . 1 . 2]" 1
1119 1 48 LYS HG3 1 51 GLU QG . . 5.390 4.349 2.877 5.814 0.424 11 0 "[ . 1 . 2]" 1
1120 1 48 LYS HG3 1 70 SER QB . . 5.020 4.707 3.398 5.658 0.638 19 1 "[ . 1 . +2]" 1
1121 1 49 LYS H 1 49 LYS QB . . 2.800 2.218 1.953 2.478 . 0 0 "[ . 1 . 2]" 1
1122 1 49 LYS H 1 50 GLY H . . 4.900 3.158 3.012 3.267 . 0 0 "[ . 1 . 2]" 1
1123 1 49 LYS H 1 69 LEU HA . . 4.840 4.254 3.846 4.593 . 0 0 "[ . 1 . 2]" 1
1124 1 49 LYS H 1 70 SER HA . . 3.610 3.157 2.857 3.658 0.048 1 0 "[ . 1 . 2]" 1
1125 1 49 LYS H 1 70 SER QB . . 3.980 3.576 3.015 4.056 0.076 11 0 "[ . 1 . 2]" 1
1126 1 49 LYS HA 1 50 GLY HA2 . . 4.740 4.272 4.106 4.431 . 0 0 "[ . 1 . 2]" 1
1127 1 49 LYS HA 1 50 GLY HA3 . . 5.030 4.882 4.741 4.982 . 0 0 "[ . 1 . 2]" 1
1128 1 49 LYS HA 1 67 ALA MB . . 3.500 3.575 3.158 3.618 0.118 5 0 "[ . 1 . 2]" 1
1129 1 49 LYS HA 1 69 LEU H . . 4.030 3.067 2.689 3.424 . 0 0 "[ . 1 . 2]" 1
1130 1 49 LYS HA 1 69 LEU HA . . 4.010 3.023 2.630 3.352 . 0 0 "[ . 1 . 2]" 1
1131 1 49 LYS QB 1 50 GLY H . . 4.340 3.930 3.644 4.026 . 0 0 "[ . 1 . 2]" 1
1132 1 49 LYS QB 1 69 LEU HA . . 3.300 2.301 1.979 3.230 . 0 0 "[ . 1 . 2]" 1
1133 1 49 LYS QB 1 70 SER H . . 3.580 2.639 2.201 3.130 . 0 0 "[ . 1 . 2]" 1
1134 1 49 LYS QB 1 70 SER HA . . 4.830 3.979 3.644 4.450 . 0 0 "[ . 1 . 2]" 1
1135 1 50 GLY H 1 51 GLU H . . 3.310 2.582 1.881 3.330 0.020 16 0 "[ . 1 . 2]" 1
1136 1 50 GLY H 1 51 GLU QG . . 5.490 4.494 3.029 5.273 . 0 0 "[ . 1 . 2]" 1
1137 1 50 GLY H 1 66 TYR HB3 . . 5.040 4.696 4.462 4.990 . 0 0 "[ . 1 . 2]" 1
1138 1 50 GLY H 1 67 ALA H . . 5.130 4.976 4.523 5.177 0.047 8 0 "[ . 1 . 2]" 1
1139 1 50 GLY H 1 67 ALA MB . . 3.550 3.491 3.085 3.631 0.081 7 0 "[ . 1 . 2]" 1
1140 1 50 GLY HA2 1 66 TYR HB2 . . 4.600 3.419 2.896 3.796 . 0 0 "[ . 1 . 2]" 1
1141 1 50 GLY HA2 1 66 TYR HB3 . . 3.970 2.168 2.015 2.365 . 0 0 "[ . 1 . 2]" 1
1142 1 50 GLY HA2 1 66 TYR QD . . 5.090 3.838 2.812 4.194 . 0 0 "[ . 1 . 2]" 1
1143 1 50 GLY HA2 1 67 ALA MB . . 5.500 4.132 3.565 4.528 . 0 0 "[ . 1 . 2]" 1
1144 1 50 GLY HA3 1 66 TYR HB3 . . 4.580 3.354 2.848 3.735 . 0 0 "[ . 1 . 2]" 1
1145 1 50 GLY HA3 1 67 ALA MB . . 5.500 5.220 4.773 5.558 0.058 7 0 "[ . 1 . 2]" 1
1146 1 51 GLU H 1 51 GLU HB2 . . 3.340 2.560 2.087 3.051 . 0 0 "[ . 1 . 2]" 1
1147 1 51 GLU H 1 51 GLU HB3 . . 3.210 3.154 2.719 3.427 0.217 4 0 "[ . 1 . 2]" 1
1148 1 51 GLU H 1 52 VAL H . . 5.070 4.326 4.129 4.574 . 0 0 "[ . 1 . 2]" 1
1149 1 51 GLU H 1 53 VAL MG1 . . 5.390 4.579 4.027 4.874 . 0 0 "[ . 1 . 2]" 1
1150 1 51 GLU H 1 67 ALA H . . 4.180 2.719 2.166 3.527 . 0 0 "[ . 1 . 2]" 1
1151 1 51 GLU H 1 67 ALA MB . . 3.530 2.437 1.993 2.873 . 0 0 "[ . 1 . 2]" 1
1152 1 51 GLU HA 1 51 GLU QG . . 3.560 2.348 2.047 2.672 . 0 0 "[ . 1 . 2]" 1
1153 1 51 GLU HA 1 52 VAL H . . 2.630 2.221 2.071 2.349 . 0 0 "[ . 1 . 2]" 1
1154 1 51 GLU HA 1 52 VAL HA . . 4.970 4.389 4.261 4.480 . 0 0 "[ . 1 . 2]" 1
1155 1 51 GLU HA 1 52 VAL HB . . 4.930 4.677 4.121 4.975 0.045 13 0 "[ . 1 . 2]" 1
1156 1 51 GLU HA 1 52 VAL QG . . 4.140 3.348 2.917 3.787 . 0 0 "[ . 1 . 2]" 1
1157 1 51 GLU HA 1 66 TYR QD . . 4.360 3.708 3.091 4.357 . 0 0 "[ . 1 . 2]" 1
1158 1 51 GLU HB2 1 52 VAL H . . 4.270 4.473 4.057 4.677 0.407 13 0 "[ . 1 . 2]" 1
1159 1 51 GLU HB2 1 53 VAL MG1 . . 4.790 3.603 2.528 4.033 . 0 0 "[ . 1 . 2]" 1
1160 1 51 GLU HB3 1 53 VAL MG1 . . 4.190 2.283 1.982 2.790 . 0 0 "[ . 1 . 2]" 1
1161 1 51 GLU HB3 1 67 ALA MB . . 4.080 3.018 2.215 4.068 . 0 0 "[ . 1 . 2]" 1
1162 1 51 GLU QG 1 52 VAL H . . 3.700 3.420 2.734 3.790 0.090 3 0 "[ . 1 . 2]" 1
1163 1 51 GLU QG 1 53 VAL MG1 . . 3.910 3.003 1.974 3.956 0.046 5 0 "[ . 1 . 2]" 1
1164 1 52 VAL H 1 52 VAL HB . . 2.930 2.688 2.146 3.016 0.086 2 0 "[ . 1 . 2]" 1
1165 1 52 VAL H 1 52 VAL QG . . 3.080 2.089 1.692 2.729 . 0 0 "[ . 1 . 2]" 1
1166 1 52 VAL H 1 53 VAL H . . 4.290 3.630 3.191 4.275 . 0 0 "[ . 1 . 2]" 1
1167 1 52 VAL H 1 53 VAL MG1 . . 5.500 3.616 3.215 4.047 . 0 0 "[ . 1 . 2]" 1
1168 1 52 VAL H 1 53 VAL MG2 . . 4.570 4.655 4.610 4.687 0.117 9 0 "[ . 1 . 2]" 1
1169 1 52 VAL H 1 66 TYR QD . . 4.320 3.605 2.834 4.388 0.068 4 0 "[ . 1 . 2]" 1
1170 1 52 VAL HA 1 52 VAL QG . . 3.180 2.343 2.067 2.641 . 0 0 "[ . 1 . 2]" 1
1171 1 52 VAL HA 1 53 VAL H . . 3.150 2.546 2.025 3.010 . 0 0 "[ . 1 . 2]" 1
1172 1 52 VAL HA 1 53 VAL HA . . 4.780 4.592 4.405 4.823 0.043 16 0 "[ . 1 . 2]" 1
1173 1 52 VAL HA 1 53 VAL MG1 . . 4.780 4.215 3.439 4.581 . 0 0 "[ . 1 . 2]" 1
1174 1 52 VAL HA 1 53 VAL MG2 . . 4.520 3.942 3.307 4.312 . 0 0 "[ . 1 . 2]" 1
1175 1 52 VAL HA 1 54 ALA H . . 3.940 3.427 2.986 3.671 . 0 0 "[ . 1 . 2]" 1
1176 1 52 VAL HA 1 66 TYR HA . . 3.050 2.625 2.174 2.987 . 0 0 "[ . 1 . 2]" 1
1177 1 52 VAL HA 1 66 TYR QD . . 3.940 3.705 3.275 4.026 0.086 4 0 "[ . 1 . 2]" 1
1178 1 52 VAL HA 1 67 ALA H . . 4.260 3.672 3.335 4.086 . 0 0 "[ . 1 . 2]" 1
1179 1 52 VAL HB 1 53 VAL H . . 5.210 4.424 4.011 4.693 . 0 0 "[ . 1 . 2]" 1
1180 1 52 VAL HB 1 64 ASP HB3 . . 3.960 3.232 2.108 4.055 0.095 14 0 "[ . 1 . 2]" 1
1181 1 52 VAL QG 1 53 VAL H . . 4.260 3.545 2.907 3.836 . 0 0 "[ . 1 . 2]" 1
1182 1 52 VAL QG 1 53 VAL HA . . 4.080 3.933 3.672 4.081 0.001 14 0 "[ . 1 . 2]" 1
1183 1 52 VAL QG 1 54 ALA H . . 3.470 3.285 2.619 3.516 0.046 16 0 "[ . 1 . 2]" 1
1184 1 52 VAL QG 1 55 SER H . . 4.610 3.596 3.250 3.877 . 0 0 "[ . 1 . 2]" 1
1185 1 52 VAL QG 1 55 SER HB3 . . 5.370 4.124 3.509 4.534 . 0 0 "[ . 1 . 2]" 1
1186 1 52 VAL QG 1 64 ASP HA . . 3.760 2.509 2.037 3.038 . 0 0 "[ . 1 . 2]" 1
1187 1 52 VAL QG 1 64 ASP HB2 . . 4.030 2.947 2.229 3.417 . 0 0 "[ . 1 . 2]" 1
1188 1 52 VAL QG 1 64 ASP HB3 . . 3.300 1.950 1.829 2.239 . 0 0 "[ . 1 . 2]" 1
1189 1 52 VAL QG 1 65 VAL H . . 3.790 3.056 2.561 3.730 . 0 0 "[ . 1 . 2]" 1
1190 1 52 VAL QG 1 66 TYR HA . . 4.130 3.576 2.927 3.972 . 0 0 "[ . 1 . 2]" 1
1191 1 52 VAL QG 1 66 TYR QD . . 3.240 2.518 2.234 2.866 . 0 0 "[ . 1 . 2]" 1
1192 1 52 VAL QG 1 66 TYR QE . . 2.880 2.486 2.240 2.887 0.007 1 0 "[ . 1 . 2]" 1
1193 1 53 VAL H 1 53 VAL MG1 . . 3.920 2.495 1.984 3.069 . 0 0 "[ . 1 . 2]" 1
1194 1 53 VAL H 1 53 VAL MG2 . . 3.220 2.005 1.882 2.212 . 0 0 "[ . 1 . 2]" 1
1195 1 53 VAL H 1 54 ALA MB . . 4.790 4.081 3.380 4.638 . 0 0 "[ . 1 . 2]" 1
1196 1 53 VAL H 1 65 VAL HB . . 5.420 4.817 3.777 5.452 0.032 5 0 "[ . 1 . 2]" 1
1197 1 53 VAL H 1 66 TYR HA . . 4.160 3.874 3.561 4.155 . 0 0 "[ . 1 . 2]" 1
1198 1 53 VAL H 1 67 ALA H . . 4.650 3.464 3.123 3.847 . 0 0 "[ . 1 . 2]" 1
1199 1 53 VAL H 1 67 ALA MB . . 5.130 3.820 3.336 4.397 . 0 0 "[ . 1 . 2]" 1
1200 1 53 VAL HA 1 53 VAL MG1 . . 3.360 2.310 2.152 2.513 . 0 0 "[ . 1 . 2]" 1
1201 1 53 VAL HA 1 53 VAL MG2 . . 3.740 3.248 3.204 3.269 . 0 0 "[ . 1 . 2]" 1
1202 1 53 VAL HB 1 54 ALA H . . 5.070 4.434 4.290 4.535 . 0 0 "[ . 1 . 2]" 1
1203 1 53 VAL HB 1 73 ILE MD . . 5.340 3.936 2.571 4.411 . 0 0 "[ . 1 . 2]" 1
1204 1 53 VAL MG1 1 54 ALA H . . 4.570 4.386 4.284 4.491 . 0 0 "[ . 1 . 2]" 1
1205 1 53 VAL MG1 1 66 TYR HA . . 5.340 5.155 4.579 5.415 0.075 14 0 "[ . 1 . 2]" 1
1206 1 53 VAL MG1 1 67 ALA H . . 4.580 4.347 3.602 4.660 0.080 11 0 "[ . 1 . 2]" 1
1207 1 53 VAL MG1 1 73 ILE MD . . 4.460 3.860 3.145 4.162 . 0 0 "[ . 1 . 2]" 1
1208 1 53 VAL MG1 1 98 PHE QE . . 4.920 4.966 4.643 5.056 0.136 4 0 "[ . 1 . 2]" 1
1209 1 53 VAL MG2 1 54 ALA H . . 4.050 3.320 3.084 3.700 . 0 0 "[ . 1 . 2]" 1
1210 1 53 VAL MG2 1 54 ALA MB . . 4.060 2.825 2.195 3.441 . 0 0 "[ . 1 . 2]" 1
1211 1 53 VAL MG2 1 65 VAL HB . . 5.060 4.556 3.930 4.963 . 0 0 "[ . 1 . 2]" 1
1212 1 53 VAL MG2 1 66 TYR HA . . 4.350 4.291 3.805 4.447 0.097 10 0 "[ . 1 . 2]" 1
1213 1 53 VAL MG2 1 67 ALA H . . 4.080 3.013 2.508 3.274 . 0 0 "[ . 1 . 2]" 1
1214 1 53 VAL MG2 1 67 ALA HA . . 4.090 3.786 3.292 4.128 0.038 17 0 "[ . 1 . 2]" 1
1215 1 53 VAL MG2 1 67 ALA MB . . 3.940 2.207 1.979 2.447 . 0 0 "[ . 1 . 2]" 1
1216 1 53 VAL MG2 1 98 PHE QE . . 3.760 2.624 2.279 2.973 . 0 0 "[ . 1 . 2]" 1
1217 1 53 VAL MG2 1 98 PHE HZ . . 3.810 2.781 2.398 3.336 . 0 0 "[ . 1 . 2]" 1
1218 1 54 ALA H 1 54 ALA MB . . 3.550 2.723 2.602 2.952 . 0 0 "[ . 1 . 2]" 1
1219 1 54 ALA H 1 64 ASP HA . . 4.890 4.826 4.455 4.968 0.078 1 0 "[ . 1 . 2]" 1
1220 1 54 ALA H 1 65 VAL H . . 4.000 3.458 3.074 3.667 . 0 0 "[ . 1 . 2]" 1
1221 1 54 ALA H 1 65 VAL HB . . 3.920 3.248 2.891 3.641 . 0 0 "[ . 1 . 2]" 1
1222 1 54 ALA H 1 65 VAL MG2 . . 4.910 4.507 4.291 4.728 . 0 0 "[ . 1 . 2]" 1
1223 1 54 ALA HA 1 55 SER H . . 3.020 2.593 2.349 2.736 . 0 0 "[ . 1 . 2]" 1
1224 1 54 ALA HA 1 65 VAL MG2 . . 5.170 4.844 4.714 5.087 . 0 0 "[ . 1 . 2]" 1
1225 1 54 ALA MB 1 55 SER HA . . 4.870 4.492 4.401 4.601 . 0 0 "[ . 1 . 2]" 1
1226 1 54 ALA MB 1 65 VAL H . . 4.640 3.971 3.642 4.212 . 0 0 "[ . 1 . 2]" 1
1227 1 54 ALA MB 1 65 VAL HA . . 5.500 4.780 4.619 4.967 . 0 0 "[ . 1 . 2]" 1
1228 1 54 ALA MB 1 65 VAL HB . . 2.940 2.172 2.060 2.347 . 0 0 "[ . 1 . 2]" 1
1229 1 54 ALA MB 1 65 VAL MG1 . . 3.460 2.573 2.101 2.990 . 0 0 "[ . 1 . 2]" 1
1230 1 54 ALA MB 1 65 VAL MG2 . . 3.810 3.023 2.871 3.352 . 0 0 "[ . 1 . 2]" 1
1231 1 54 ALA MB 1 66 TYR HA . . 5.500 5.582 5.330 5.610 0.110 5 0 "[ . 1 . 2]" 1
1232 1 54 ALA MB 1 98 PHE QD . . 4.640 2.244 2.066 2.532 . 0 0 "[ . 1 . 2]" 1
1233 1 54 ALA MB 1 98 PHE QE . . 3.900 2.051 1.961 2.178 . 0 0 "[ . 1 . 2]" 1
1234 1 55 SER H 1 55 SER HB2 . . 3.880 2.206 2.021 3.272 . 0 0 "[ . 1 . 2]" 1
1235 1 55 SER H 1 55 SER HB3 . . 3.910 3.234 2.045 3.554 . 0 0 "[ . 1 . 2]" 1
1236 1 55 SER H 1 56 ILE H . . 4.710 4.641 4.560 4.687 . 0 0 "[ . 1 . 2]" 1
1237 1 55 SER H 1 64 ASP HA . . 5.500 4.593 4.177 4.974 . 0 0 "[ . 1 . 2]" 1
1238 1 55 SER H 1 65 VAL H . . 4.160 4.098 3.657 4.241 0.081 12 0 "[ . 1 . 2]" 1
1239 1 55 SER H 1 65 VAL HB . . 5.380 4.592 4.100 5.083 . 0 0 "[ . 1 . 2]" 1
1240 1 55 SER H 1 65 VAL MG2 . . 5.300 4.793 4.525 5.050 . 0 0 "[ . 1 . 2]" 1
1241 1 55 SER HA 1 56 ILE H . . 2.730 2.319 2.138 2.560 . 0 0 "[ . 1 . 2]" 1
1242 1 55 SER HA 1 56 ILE HB . . 4.780 4.694 4.359 4.849 0.069 12 0 "[ . 1 . 2]" 1
1243 1 55 SER HA 1 56 ILE MD . . 4.960 4.724 4.286 4.948 . 0 0 "[ . 1 . 2]" 1
1244 1 55 SER HA 1 56 ILE HG12 . . 4.600 4.369 4.040 4.667 0.067 9 0 "[ . 1 . 2]" 1
1245 1 55 SER HA 1 56 ILE HG13 . . 4.950 3.271 2.880 3.488 . 0 0 "[ . 1 . 2]" 1
1246 1 55 SER HA 1 64 ASP HA . . 3.170 2.411 1.986 2.795 . 0 0 "[ . 1 . 2]" 1
1247 1 55 SER HA 1 65 VAL H . . 3.690 2.451 2.059 2.761 . 0 0 "[ . 1 . 2]" 1
1248 1 55 SER HA 1 65 VAL HB . . 4.290 3.964 3.505 4.362 0.072 12 0 "[ . 1 . 2]" 1
1249 1 55 SER HA 1 65 VAL MG1 . . 5.500 5.291 4.924 5.594 0.094 12 0 "[ . 1 . 2]" 1
1250 1 55 SER HA 1 65 VAL MG2 . . 3.930 3.226 2.745 3.709 . 0 0 "[ . 1 . 2]" 1
1251 1 55 SER HB2 1 56 ILE H . . 4.050 3.972 2.979 4.137 0.087 3 0 "[ . 1 . 2]" 1
1252 1 55 SER HB2 1 64 ASP HA . . 4.300 4.216 3.385 4.688 0.388 2 0 "[ . 1 . 2]" 1
1253 1 55 SER HB2 1 65 VAL H . . 5.040 4.796 4.325 5.243 0.203 16 0 "[ . 1 . 2]" 1
1254 1 55 SER HB3 1 56 ILE H . . 3.780 2.998 2.535 4.115 0.335 6 0 "[ . 1 . 2]" 1
1255 1 55 SER HB3 1 64 ASP HA . . 4.610 4.147 3.507 4.702 0.092 4 0 "[ . 1 . 2]" 1
1256 1 56 ILE H 1 56 ILE HB . . 3.130 2.848 2.618 3.089 . 0 0 "[ . 1 . 2]" 1
1257 1 56 ILE H 1 56 ILE MD . . 4.480 4.088 3.858 4.361 . 0 0 "[ . 1 . 2]" 1
1258 1 56 ILE H 1 56 ILE HG12 . . 3.890 3.738 3.414 3.967 0.077 12 0 "[ . 1 . 2]" 1
1259 1 56 ILE H 1 56 ILE HG13 . . 3.990 2.740 2.512 3.043 . 0 0 "[ . 1 . 2]" 1
1260 1 56 ILE H 1 64 ASP HA . . 4.340 3.705 3.347 4.111 . 0 0 "[ . 1 . 2]" 1
1261 1 56 ILE H 1 65 VAL H . . 5.070 4.275 3.627 4.820 . 0 0 "[ . 1 . 2]" 1
1262 1 56 ILE H 1 65 VAL MG2 . . 4.310 3.831 3.343 4.387 0.077 12 0 "[ . 1 . 2]" 1
1263 1 56 ILE HA 1 56 ILE MD . . 4.550 3.987 3.897 4.112 . 0 0 "[ . 1 . 2]" 1
1264 1 56 ILE HA 1 56 ILE HG12 . . 3.970 2.823 2.603 3.070 . 0 0 "[ . 1 . 2]" 1
1265 1 56 ILE HA 1 56 ILE HG13 . . 3.940 3.421 3.209 3.625 . 0 0 "[ . 1 . 2]" 1
1266 1 56 ILE HA 1 56 ILE MG . . 3.290 2.254 2.103 2.422 . 0 0 "[ . 1 . 2]" 1
1267 1 56 ILE HA 1 57 GLU H . . 2.750 2.259 2.178 2.426 . 0 0 "[ . 1 . 2]" 1
1268 1 56 ILE HB 1 56 ILE MD . . 3.450 2.395 2.265 2.517 . 0 0 "[ . 1 . 2]" 1
1269 1 56 ILE HB 1 56 ILE HG12 . . 2.900 2.984 2.962 2.989 0.089 3 0 "[ . 1 . 2]" 1
1270 1 56 ILE HB 1 57 GLU H . . 4.570 4.182 3.709 4.455 . 0 0 "[ . 1 . 2]" 1
1271 1 56 ILE HB 1 57 GLU HA . . 4.960 4.693 4.358 4.965 0.005 4 0 "[ . 1 . 2]" 1
1272 1 56 ILE HB 1 62 ALA HA . . 5.110 4.484 3.803 4.802 . 0 0 "[ . 1 . 2]" 1
1273 1 56 ILE HB 1 63 ALA MB . . 3.350 2.450 2.116 3.462 0.112 12 0 "[ . 1 . 2]" 1
1274 1 56 ILE MD 1 56 ILE MG . . 2.400 2.062 2.008 2.095 . 0 0 "[ . 1 . 2]" 1
1275 1 56 ILE MD 1 63 ALA HA . . 5.300 5.269 4.685 5.390 0.090 10 0 "[ . 1 . 2]" 1
1276 1 56 ILE MD 1 63 ALA MB . . 4.200 2.621 2.127 2.857 . 0 0 "[ . 1 . 2]" 1
1277 1 56 ILE HG12 1 65 VAL MG2 . . 3.580 2.940 2.743 3.220 . 0 0 "[ . 1 . 2]" 1
1278 1 56 ILE HG13 1 65 VAL HA . . 4.860 4.945 4.922 4.960 0.100 8 0 "[ . 1 . 2]" 1
1279 1 56 ILE MG 1 57 GLU H . . 3.310 2.822 2.191 3.312 0.002 8 0 "[ . 1 . 2]" 1
1280 1 56 ILE MG 1 57 GLU HA . . 4.960 4.035 3.215 4.585 . 0 0 "[ . 1 . 2]" 1
1281 1 56 ILE MG 1 58 SER H . . 5.450 4.319 3.865 5.320 . 0 0 "[ . 1 . 2]" 1
1282 1 56 ILE MG 1 58 SER QB . . 4.680 3.519 3.191 3.923 . 0 0 "[ . 1 . 2]" 1
1283 1 56 ILE MG 1 63 ALA MB . . 4.550 3.701 3.043 4.528 . 0 0 "[ . 1 . 2]" 1
1284 1 57 GLU H 1 57 GLU HB2 . . 3.450 2.485 2.288 2.836 . 0 0 "[ . 1 . 2]" 1
1285 1 57 GLU H 1 57 GLU HB3 . . 3.710 3.470 3.019 3.678 . 0 0 "[ . 1 . 2]" 1
1286 1 57 GLU H 1 57 GLU QG . . 4.340 3.658 3.229 4.012 . 0 0 "[ . 1 . 2]" 1
1287 1 57 GLU H 1 58 SER H . . 4.940 4.263 4.056 4.585 . 0 0 "[ . 1 . 2]" 1
1288 1 57 GLU HA 1 57 GLU QG . . 3.760 2.092 1.951 2.214 . 0 0 "[ . 1 . 2]" 1
1289 1 57 GLU HA 1 58 SER H . . 2.770 2.188 2.028 2.516 . 0 0 "[ . 1 . 2]" 1
1290 1 57 GLU HA 1 61 ALA H . . 4.880 4.474 4.101 4.924 0.044 3 0 "[ . 1 . 2]" 1
1291 1 57 GLU HA 1 61 ALA MB . . 5.260 4.717 4.352 5.027 . 0 0 "[ . 1 . 2]" 1
1292 1 57 GLU HA 1 62 ALA HA . . 2.990 2.378 2.060 3.059 0.069 12 0 "[ . 1 . 2]" 1
1293 1 57 GLU HA 1 62 ALA MB . . 3.850 3.297 2.489 3.624 . 0 0 "[ . 1 . 2]" 1
1294 1 57 GLU HA 1 63 ALA H . . 4.620 3.875 3.486 4.604 . 0 0 "[ . 1 . 2]" 1
1295 1 57 GLU HB2 1 62 ALA MB . . 5.070 4.880 4.450 5.146 0.076 1 0 "[ . 1 . 2]" 1
1296 1 57 GLU HB3 1 57 GLU QG . . 2.620 2.361 2.070 2.496 . 0 0 "[ . 1 . 2]" 1
1297 1 57 GLU HB3 1 58 SER H . . 4.240 3.426 2.466 3.993 . 0 0 "[ . 1 . 2]" 1
1298 1 57 GLU HB3 1 62 ALA MB . . 5.500 4.807 4.334 5.583 0.083 15 0 "[ . 1 . 2]" 1
1299 1 57 GLU QG 1 58 SER H . . 4.370 3.431 2.905 3.869 . 0 0 "[ . 1 . 2]" 1
1300 1 57 GLU QG 1 61 ALA H . . 5.500 4.789 3.716 5.385 . 0 0 "[ . 1 . 2]" 1
1301 1 57 GLU QG 1 61 ALA MB . . 5.500 5.277 4.806 5.397 . 0 0 "[ . 1 . 2]" 1
1302 1 57 GLU QG 1 62 ALA HA . . 4.890 3.076 2.524 3.576 . 0 0 "[ . 1 . 2]" 1
1303 1 57 GLU QG 1 62 ALA MB . . 4.250 2.538 2.096 3.163 . 0 0 "[ . 1 . 2]" 1
1304 1 58 SER H 1 58 SER QB . . 3.800 2.841 2.252 3.236 . 0 0 "[ . 1 . 2]" 1
1305 1 58 SER H 1 58 SER HG . . 4.840 3.334 1.909 4.580 . 0 0 "[ . 1 . 2]" 1
1306 1 58 SER H 1 60 LYS H . . 5.200 4.172 3.792 4.511 . 0 0 "[ . 1 . 2]" 1
1307 1 58 SER H 1 61 ALA H . . 3.810 2.770 2.447 3.009 . 0 0 "[ . 1 . 2]" 1
1308 1 58 SER H 1 61 ALA MB . . 4.630 3.646 3.121 4.072 . 0 0 "[ . 1 . 2]" 1
1309 1 58 SER H 1 62 ALA HA . . 3.780 3.475 3.030 3.861 0.081 12 0 "[ . 1 . 2]" 1
1310 1 58 SER H 1 62 ALA MB . . 4.830 4.419 3.904 4.752 . 0 0 "[ . 1 . 2]" 1
1311 1 58 SER HA 1 59 VAL H . . 3.090 2.699 2.522 2.866 . 0 0 "[ . 1 . 2]" 1
1312 1 58 SER HA 1 59 VAL HA . . 4.580 4.354 4.178 4.483 . 0 0 "[ . 1 . 2]" 1
1313 1 58 SER HA 1 59 VAL QG . . 4.860 3.715 3.461 4.290 . 0 0 "[ . 1 . 2]" 1
1314 1 58 SER HA 1 60 LYS H . . 5.070 4.585 4.325 4.979 . 0 0 "[ . 1 . 2]" 1
1315 1 58 SER QB 1 59 VAL H . . 2.940 2.141 1.904 2.874 . 0 0 "[ . 1 . 2]" 1
1316 1 58 SER QB 1 59 VAL QG . . 3.980 2.750 2.438 3.371 . 0 0 "[ . 1 . 2]" 1
1317 1 58 SER QB 1 60 LYS H . . 3.950 3.492 2.772 3.855 . 0 0 "[ . 1 . 2]" 1
1318 1 58 SER QB 1 61 ALA H . . 4.570 3.638 1.920 4.149 . 0 0 "[ . 1 . 2]" 1
1319 1 58 SER QB 1 61 ALA MB . . 5.370 3.411 2.012 3.933 . 0 0 "[ . 1 . 2]" 1
1320 1 58 SER HG 1 59 VAL H . . 4.370 3.523 2.356 4.213 . 0 0 "[ . 1 . 2]" 1
1321 1 58 SER HG 1 59 VAL QG . . 5.500 3.429 2.429 4.768 . 0 0 "[ . 1 . 2]" 1
1322 1 58 SER HG 1 60 LYS H . . 3.470 3.308 2.770 3.546 0.076 3 0 "[ . 1 . 2]" 1
1323 1 58 SER HG 1 61 ALA H . . 3.510 3.056 2.219 3.595 0.085 12 0 "[ . 1 . 2]" 1
1324 1 58 SER HG 1 61 ALA MB . . 4.110 2.549 2.100 3.245 . 0 0 "[ . 1 . 2]" 1
1325 1 59 VAL H 1 59 VAL HB . . 3.510 3.438 1.833 3.588 0.078 7 0 "[ . 1 . 2]" 1
1326 1 59 VAL H 1 59 VAL QG . . 3.030 1.846 1.692 2.489 . 0 0 "[ . 1 . 2]" 1
1327 1 59 VAL H 1 60 LYS H . . 3.380 2.982 2.404 3.217 . 0 0 "[ . 1 . 2]" 1
1328 1 59 VAL H 1 60 LYS HA . . 5.210 5.215 4.942 5.298 0.088 16 0 "[ . 1 . 2]" 1
1329 1 59 VAL H 1 61 ALA H . . 5.050 4.279 3.390 4.966 . 0 0 "[ . 1 . 2]" 1
1330 1 59 VAL HA 1 59 VAL HB . . 2.830 2.562 2.498 2.632 . 0 0 "[ . 1 . 2]" 1
1331 1 59 VAL HA 1 59 VAL QG . . 3.170 2.224 2.171 2.292 . 0 0 "[ . 1 . 2]" 1
1332 1 59 VAL HA 1 61 ALA H . . 5.390 5.066 4.839 5.381 . 0 0 "[ . 1 . 2]" 1
1333 1 59 VAL HB 1 60 LYS H . . 4.610 3.733 3.325 3.977 . 0 0 "[ . 1 . 2]" 1
1334 1 59 VAL QG 1 60 LYS H . . 3.680 2.315 1.967 2.672 . 0 0 "[ . 1 . 2]" 1
1335 1 59 VAL QG 1 61 ALA H . . 5.280 4.055 3.375 4.648 . 0 0 "[ . 1 . 2]" 1
1336 1 60 LYS HA 1 61 ALA H . . 3.350 2.887 2.243 3.321 . 0 0 "[ . 1 . 2]" 1
1337 1 61 ALA H 1 61 ALA MB . . 3.630 2.651 2.340 2.981 . 0 0 "[ . 1 . 2]" 1
1338 1 61 ALA HA 1 62 ALA H . . 2.930 2.442 2.190 2.708 . 0 0 "[ . 1 . 2]" 1
1339 1 61 ALA MB 1 62 ALA H . . 2.840 2.357 1.979 2.917 0.077 5 0 "[ . 1 . 2]" 1
1340 1 61 ALA MB 1 62 ALA HA . . 3.950 3.864 3.604 4.011 0.061 9 0 "[ . 1 . 2]" 1
1341 1 62 ALA H 1 62 ALA MB . . 2.990 2.591 2.385 2.774 . 0 0 "[ . 1 . 2]" 1
1342 1 62 ALA H 1 63 ALA H . . 5.040 4.187 3.552 4.515 . 0 0 "[ . 1 . 2]" 1
1343 1 62 ALA HA 1 63 ALA H . . 2.760 2.277 2.100 2.460 . 0 0 "[ . 1 . 2]" 1
1344 1 62 ALA HA 1 63 ALA MB . . 4.710 4.086 3.770 4.278 . 0 0 "[ . 1 . 2]" 1
1345 1 62 ALA MB 1 63 ALA HA . . 4.360 4.037 3.744 4.447 0.087 6 0 "[ . 1 . 2]" 1
1346 1 63 ALA H 1 63 ALA MB . . 3.190 2.598 2.334 2.870 . 0 0 "[ . 1 . 2]" 1
1347 1 63 ALA H 1 64 ASP H . . 5.110 3.998 3.109 4.527 . 0 0 "[ . 1 . 2]" 1
1348 1 63 ALA HA 1 64 ASP H . . 2.730 2.235 2.082 2.560 . 0 0 "[ . 1 . 2]" 1
1349 1 63 ALA MB 1 64 ASP H . . 3.700 3.312 2.159 3.688 . 0 0 "[ . 1 . 2]" 1
1350 1 63 ALA MB 1 64 ASP HA . . 5.170 4.510 4.209 4.883 . 0 0 "[ . 1 . 2]" 1
1351 1 64 ASP H 1 64 ASP HB2 . . 3.030 2.796 2.320 3.120 0.090 8 0 "[ . 1 . 2]" 1
1352 1 64 ASP H 1 64 ASP HB3 . . 3.480 3.479 3.159 3.574 0.094 18 0 "[ . 1 . 2]" 1
1353 1 64 ASP HA 1 65 VAL H . . 2.710 2.296 2.141 2.405 . 0 0 "[ . 1 . 2]" 1
1354 1 64 ASP HA 1 65 VAL HB . . 4.660 4.687 4.531 4.742 0.082 16 0 "[ . 1 . 2]" 1
1355 1 64 ASP HA 1 65 VAL MG2 . . 4.770 3.933 3.445 4.154 . 0 0 "[ . 1 . 2]" 1
1356 1 64 ASP HB2 1 65 VAL H . . 4.530 4.071 3.444 4.547 0.017 10 0 "[ . 1 . 2]" 1
1357 1 64 ASP HB2 1 66 TYR H . . 5.260 4.879 3.891 5.330 0.070 6 0 "[ . 1 . 2]" 1
1358 1 64 ASP HB2 1 66 TYR QE . . 3.990 3.013 2.627 3.679 . 0 0 "[ . 1 . 2]" 1
1359 1 64 ASP HB3 1 65 VAL H . . 3.780 3.731 3.337 3.869 0.089 1 0 "[ . 1 . 2]" 1
1360 1 64 ASP HB3 1 66 TYR QE . . 4.450 3.788 3.156 4.311 . 0 0 "[ . 1 . 2]" 1
1361 1 65 VAL H 1 65 VAL HB . . 3.290 2.439 2.272 2.621 . 0 0 "[ . 1 . 2]" 1
1362 1 65 VAL H 1 65 VAL MG1 . . 4.590 3.800 3.711 3.862 . 0 0 "[ . 1 . 2]" 1
1363 1 65 VAL H 1 65 VAL MG2 . . 3.480 2.502 2.176 2.801 . 0 0 "[ . 1 . 2]" 1
1364 1 65 VAL H 1 97 LEU MD2 . . 5.270 5.363 5.307 5.387 0.117 3 0 "[ . 1 . 2]" 1
1365 1 65 VAL HA 1 65 VAL MG1 . . 3.380 2.453 2.261 2.635 . 0 0 "[ . 1 . 2]" 1
1366 1 65 VAL HA 1 65 VAL MG2 . . 3.270 2.319 2.214 2.399 . 0 0 "[ . 1 . 2]" 1
1367 1 65 VAL HA 1 66 TYR H . . 2.810 2.304 2.139 2.425 . 0 0 "[ . 1 . 2]" 1
1368 1 65 VAL HA 1 66 TYR QD . . 4.220 3.909 3.308 4.293 0.073 16 0 "[ . 1 . 2]" 1
1369 1 65 VAL HB 1 66 TYR H . . 5.250 4.371 4.066 4.515 . 0 0 "[ . 1 . 2]" 1
1370 1 65 VAL MG1 1 66 TYR H . . 3.670 3.027 2.451 3.415 . 0 0 "[ . 1 . 2]" 1
1371 1 65 VAL MG1 1 66 TYR HA . . 4.800 4.128 3.887 4.530 . 0 0 "[ . 1 . 2]" 1
1372 1 65 VAL MG1 1 66 TYR QD . . 5.090 4.922 4.413 5.179 0.089 7 0 "[ . 1 . 2]" 1
1373 1 65 VAL MG1 1 67 ALA HA . . 4.760 3.568 2.878 4.409 . 0 0 "[ . 1 . 2]" 1
1374 1 65 VAL MG1 1 98 PHE QE . . 3.550 2.848 2.165 3.625 0.075 8 0 "[ . 1 . 2]" 1
1375 1 65 VAL MG1 1 98 PHE HZ . . 4.610 3.781 2.931 4.658 0.048 1 0 "[ . 1 . 2]" 1
1376 1 65 VAL MG2 1 66 TYR H . . 4.440 4.152 3.982 4.374 . 0 0 "[ . 1 . 2]" 1
1377 1 65 VAL MG2 1 97 LEU MD1 . . 3.480 2.289 1.983 3.192 . 0 0 "[ . 1 . 2]" 1
1378 1 65 VAL MG2 1 97 LEU MD2 . . 2.470 2.497 2.259 2.594 0.124 11 0 "[ . 1 . 2]" 1
1379 1 65 VAL MG2 1 98 PHE QE . . 5.450 4.599 3.731 5.189 . 0 0 "[ . 1 . 2]" 1
1380 1 66 TYR H 1 66 TYR HB2 . . 3.370 2.597 2.456 2.826 . 0 0 "[ . 1 . 2]" 1
1381 1 66 TYR H 1 66 TYR HB3 . . 3.900 3.688 3.624 3.781 . 0 0 "[ . 1 . 2]" 1
1382 1 66 TYR H 1 66 TYR QD . . 3.220 2.603 2.319 2.837 . 0 0 "[ . 1 . 2]" 1
1383 1 66 TYR H 1 66 TYR QE . . 4.750 4.571 4.071 4.831 0.081 18 0 "[ . 1 . 2]" 1
1384 1 66 TYR H 1 67 ALA H . . 5.090 4.146 3.943 4.495 . 0 0 "[ . 1 . 2]" 1
1385 1 66 TYR HA 1 66 TYR QD . . 3.160 2.901 2.768 3.040 . 0 0 "[ . 1 . 2]" 1
1386 1 66 TYR HA 1 67 ALA H . . 2.920 2.118 2.004 2.232 . 0 0 "[ . 1 . 2]" 1
1387 1 66 TYR HA 1 67 ALA MB . . 4.590 3.944 3.776 4.085 . 0 0 "[ . 1 . 2]" 1
1388 1 66 TYR HB2 1 67 ALA H . . 4.500 4.324 4.186 4.405 . 0 0 "[ . 1 . 2]" 1
1389 1 66 TYR HB3 1 67 ALA H . . 3.980 3.681 3.493 3.806 . 0 0 "[ . 1 . 2]" 1
1390 1 66 TYR HB3 1 67 ALA HA . . 5.350 5.404 5.210 5.431 0.081 4 0 "[ . 1 . 2]" 1
1391 1 66 TYR QD 1 67 ALA H . . 4.480 4.553 4.501 4.578 0.098 17 0 "[ . 1 . 2]" 1
1392 1 67 ALA H 1 67 ALA MB . . 3.150 2.244 2.149 2.308 . 0 0 "[ . 1 . 2]" 1
1393 1 67 ALA HA 1 98 PHE QE . . 3.970 3.735 3.434 4.031 0.061 7 0 "[ . 1 . 2]" 1
1394 1 67 ALA HA 1 98 PHE HZ . . 3.460 2.572 2.285 2.995 . 0 0 "[ . 1 . 2]" 1
1395 1 67 ALA MB 1 68 PRO HD2 . . 4.280 2.628 2.196 3.213 . 0 0 "[ . 1 . 2]" 1
1396 1 67 ALA MB 1 69 LEU H . . 3.650 3.257 2.926 3.493 . 0 0 "[ . 1 . 2]" 1
1397 1 67 ALA MB 1 69 LEU QD . . 5.500 5.088 4.851 5.362 . 0 0 "[ . 1 . 2]" 1
1398 1 67 ALA MB 1 70 SER HA . . 5.410 4.629 4.268 5.196 . 0 0 "[ . 1 . 2]" 1
1399 1 67 ALA MB 1 98 PHE HZ . . 4.580 2.500 2.103 3.735 . 0 0 "[ . 1 . 2]" 1
1400 1 68 PRO HA 1 111 LEU QD . . 4.870 3.555 3.146 4.174 . 0 0 "[ . 1 . 2]" 1
1401 1 68 PRO HB2 1 69 LEU HB2 . . 4.590 4.438 3.914 4.663 0.073 6 0 "[ . 1 . 2]" 1
1402 1 68 PRO HB2 1 111 LEU QD . . 4.640 2.712 2.347 3.738 . 0 0 "[ . 1 . 2]" 1
1403 1 68 PRO HB3 1 69 LEU H . . 4.400 4.270 4.154 4.421 0.021 17 0 "[ . 1 . 2]" 1
1404 1 68 PRO HB3 1 69 LEU QD . . 4.290 3.751 3.485 4.207 . 0 0 "[ . 1 . 2]" 1
1405 1 68 PRO HD2 1 69 LEU H . . 3.500 2.821 2.441 3.096 . 0 0 "[ . 1 . 2]" 1
1406 1 68 PRO HD2 1 98 PHE QE . . 4.400 3.499 2.970 3.982 . 0 0 "[ . 1 . 2]" 1
1407 1 68 PRO HD2 1 98 PHE HZ . . 3.960 3.342 2.669 4.022 0.062 7 0 "[ . 1 . 2]" 1
1408 1 68 PRO HD2 1 100 MET ME . . 4.650 3.698 2.787 4.523 . 0 0 "[ . 1 . 2]" 1
1409 1 68 PRO HD3 1 69 LEU H . . 3.990 3.955 3.776 4.061 0.071 11 0 "[ . 1 . 2]" 1
1410 1 68 PRO HG2 1 69 LEU H . . 3.620 2.524 2.307 2.833 . 0 0 "[ . 1 . 2]" 1
1411 1 68 PRO HG2 1 69 LEU HB2 . . 4.170 3.287 2.526 3.776 . 0 0 "[ . 1 . 2]" 1
1412 1 68 PRO HG2 1 69 LEU HG . . 4.960 4.490 3.251 5.014 0.054 9 0 "[ . 1 . 2]" 1
1413 1 68 PRO HG3 1 69 LEU H . . 4.470 4.061 3.849 4.317 . 0 0 "[ . 1 . 2]" 1
1414 1 69 LEU H 1 69 LEU HB2 . . 3.290 2.643 2.548 2.854 . 0 0 "[ . 1 . 2]" 1
1415 1 69 LEU H 1 69 LEU HB3 . . 3.940 3.733 3.644 3.855 . 0 0 "[ . 1 . 2]" 1
1416 1 69 LEU H 1 69 LEU QD . . 4.570 3.099 2.832 3.610 . 0 0 "[ . 1 . 2]" 1
1417 1 69 LEU H 1 69 LEU HG . . 4.610 4.373 3.394 4.679 0.069 8 0 "[ . 1 . 2]" 1
1418 1 69 LEU H 1 70 SER H . . 5.150 4.365 4.277 4.471 . 0 0 "[ . 1 . 2]" 1
1419 1 69 LEU H 1 100 MET ME . . 3.860 3.098 2.472 3.703 . 0 0 "[ . 1 . 2]" 1
1420 1 69 LEU HA 1 69 LEU QD . . 3.150 2.245 2.005 2.931 . 0 0 "[ . 1 . 2]" 1
1421 1 69 LEU HA 1 70 SER H . . 3.040 2.401 2.273 2.557 . 0 0 "[ . 1 . 2]" 1
1422 1 69 LEU HA 1 107 GLU HB2 . . 5.010 4.695 4.127 5.077 0.067 16 0 "[ . 1 . 2]" 1
1423 1 69 LEU HA 1 107 GLU HB3 . . 5.020 4.357 3.690 5.063 0.043 15 0 "[ . 1 . 2]" 1
1424 1 69 LEU HA 1 108 LEU QD . . 5.500 4.942 4.722 5.436 . 0 0 "[ . 1 . 2]" 1
1425 1 69 LEU HB2 1 69 LEU QD . . 2.510 2.232 2.087 2.424 . 0 0 "[ . 1 . 2]" 1
1426 1 69 LEU HB2 1 70 SER H . . 4.170 3.815 3.535 4.140 . 0 0 "[ . 1 . 2]" 1
1427 1 69 LEU HB2 1 102 ILE MG . . 4.060 3.343 3.047 3.959 . 0 0 "[ . 1 . 2]" 1
1428 1 69 LEU HB3 1 70 SER H . . 3.570 2.581 2.248 3.011 . 0 0 "[ . 1 . 2]" 1
1429 1 69 LEU HB3 1 71 GLY H . . 5.500 5.425 4.294 5.576 0.076 7 0 "[ . 1 . 2]" 1
1430 1 69 LEU HB3 1 102 ILE HB . . 4.980 4.903 4.601 5.060 0.080 15 0 "[ . 1 . 2]" 1
1431 1 69 LEU HB3 1 102 ILE MG . . 4.540 3.644 2.973 4.368 . 0 0 "[ . 1 . 2]" 1
1432 1 69 LEU QD 1 70 SER H . . 4.630 3.299 2.906 3.720 . 0 0 "[ . 1 . 2]" 1
1433 1 69 LEU QD 1 107 GLU H . . 4.650 3.776 3.135 4.264 . 0 0 "[ . 1 . 2]" 1
1434 1 69 LEU QD 1 107 GLU HA . . 5.130 4.085 3.833 4.397 . 0 0 "[ . 1 . 2]" 1
1435 1 69 LEU QD 1 107 GLU HB2 . . 3.400 2.354 2.047 2.841 . 0 0 "[ . 1 . 2]" 1
1436 1 69 LEU QD 1 107 GLU HB3 . . 3.400 2.453 2.083 2.971 . 0 0 "[ . 1 . 2]" 1
1437 1 69 LEU QD 1 107 GLU QG . . 4.600 3.725 3.247 4.317 . 0 0 "[ . 1 . 2]" 1
1438 1 69 LEU QD 1 108 LEU H . . 4.530 3.106 2.541 3.510 . 0 0 "[ . 1 . 2]" 1
1439 1 69 LEU QD 1 108 LEU HA . . 3.680 2.345 2.111 2.817 . 0 0 "[ . 1 . 2]" 1
1440 1 69 LEU QD 1 108 LEU HB2 . . 4.440 4.242 3.538 4.399 . 0 0 "[ . 1 . 2]" 1
1441 1 69 LEU QD 1 108 LEU HB3 . . 4.410 3.764 2.236 4.163 . 0 0 "[ . 1 . 2]" 1
1442 1 69 LEU QD 1 108 LEU QD . . 2.430 1.874 1.726 2.383 . 0 0 "[ . 1 . 2]" 1
1443 1 69 LEU QD 1 108 LEU HG . . 3.810 3.444 2.416 3.787 . 0 0 "[ . 1 . 2]" 1
1444 1 69 LEU QD 1 111 LEU QD . . 2.410 1.861 1.758 2.045 . 0 0 "[ . 1 . 2]" 1
1445 1 69 LEU HG 1 108 LEU QD . . 3.950 2.627 2.060 3.941 . 0 0 "[ . 1 . 2]" 1
1446 1 70 SER H 1 70 SER QB . . 3.140 2.471 2.327 2.730 . 0 0 "[ . 1 . 2]" 1
1447 1 70 SER H 1 71 GLY H . . 5.020 4.557 3.568 4.689 . 0 0 "[ . 1 . 2]" 1
1448 1 70 SER H 1 100 MET ME . . 5.210 4.334 3.582 4.978 . 0 0 "[ . 1 . 2]" 1
1449 1 70 SER HA 1 71 GLY H . . 2.830 2.300 2.158 2.481 . 0 0 "[ . 1 . 2]" 1
1450 1 70 SER HA 1 100 MET ME . . 4.090 3.580 3.169 3.901 . 0 0 "[ . 1 . 2]" 1
1451 1 70 SER QB 1 71 GLY H . . 3.650 3.038 2.683 3.756 0.106 16 0 "[ . 1 . 2]" 1
1452 1 70 SER QB 1 103 SER HB2 . . 4.840 4.030 3.012 4.927 0.087 8 0 "[ . 1 . 2]" 1
1453 1 70 SER QB 1 104 ASP H . . 4.970 4.895 4.481 5.061 0.091 16 0 "[ . 1 . 2]" 1
1454 1 71 GLY H 1 72 LYS H . . 4.860 4.324 4.234 4.385 . 0 0 "[ . 1 . 2]" 1
1455 1 71 GLY H 1 100 MET ME . . 3.690 3.245 2.224 3.753 0.063 2 0 "[ . 1 . 2]" 1
1456 1 71 GLY HA2 1 72 LYS H . . 3.150 2.764 2.523 2.919 . 0 0 "[ . 1 . 2]" 1
1457 1 71 GLY HA2 1 72 LYS QB . . 4.870 4.093 3.673 4.673 . 0 0 "[ . 1 . 2]" 1
1458 1 71 GLY HA2 1 100 MET ME . . 4.050 3.630 3.383 4.121 0.071 3 0 "[ . 1 . 2]" 1
1459 1 71 GLY HA2 1 102 ILE HA . . 3.950 3.932 3.557 4.022 0.072 2 0 "[ . 1 . 2]" 1
1460 1 71 GLY HA2 1 103 SER H . . 4.050 2.818 2.389 3.794 . 0 0 "[ . 1 . 2]" 1
1461 1 71 GLY HA2 1 103 SER HB2 . . 3.870 2.725 1.902 4.130 0.260 8 0 "[ . 1 . 2]" 1
1462 1 71 GLY HA3 1 72 LYS H . . 3.080 2.451 2.391 2.523 . 0 0 "[ . 1 . 2]" 1
1463 1 71 GLY HA3 1 100 MET QB . . 5.190 3.417 3.197 3.660 . 0 0 "[ . 1 . 2]" 1
1464 1 71 GLY HA3 1 100 MET ME . . 3.290 2.203 1.967 2.597 . 0 0 "[ . 1 . 2]" 1
1465 1 71 GLY HA3 1 102 ILE HA . . 4.060 3.297 2.790 3.718 . 0 0 "[ . 1 . 2]" 1
1466 1 71 GLY HA3 1 103 SER H . . 3.940 3.191 2.896 3.938 . 0 0 "[ . 1 . 2]" 1
1467 1 72 LYS H 1 72 LYS QB . . 3.080 2.666 2.445 2.948 . 0 0 "[ . 1 . 2]" 1
1468 1 72 LYS H 1 73 ILE H . . 5.030 4.345 4.280 4.487 . 0 0 "[ . 1 . 2]" 1
1469 1 72 LYS H 1 74 VAL QG . . 5.500 4.240 4.017 4.906 . 0 0 "[ . 1 . 2]" 1
1470 1 72 LYS H 1 100 MET HA . . 4.890 4.334 4.094 4.598 . 0 0 "[ . 1 . 2]" 1
1471 1 72 LYS H 1 100 MET QB . . 3.750 3.076 2.738 3.368 . 0 0 "[ . 1 . 2]" 1
1472 1 72 LYS H 1 100 MET ME . . 3.780 3.259 2.750 3.719 . 0 0 "[ . 1 . 2]" 1
1473 1 72 LYS H 1 101 GLU H . . 3.550 2.981 2.548 3.179 . 0 0 "[ . 1 . 2]" 1
1474 1 72 LYS H 1 101 GLU QB . . 4.420 2.796 2.439 3.214 . 0 0 "[ . 1 . 2]" 1
1475 1 72 LYS H 1 102 ILE HA . . 4.610 4.509 4.223 4.692 0.082 2 0 "[ . 1 . 2]" 1
1476 1 72 LYS HA 1 73 ILE H . . 2.720 2.204 2.111 2.328 . 0 0 "[ . 1 . 2]" 1
1477 1 72 LYS HA 1 73 ILE HB . . 4.730 4.699 4.546 4.802 0.072 5 0 "[ . 1 . 2]" 1
1478 1 72 LYS HA 1 73 ILE HG12 . . 4.660 3.833 3.607 4.003 . 0 0 "[ . 1 . 2]" 1
1479 1 72 LYS QB 1 73 ILE H . . 4.360 3.513 2.861 3.786 . 0 0 "[ . 1 . 2]" 1
1480 1 72 LYS QB 1 101 GLU H . . 4.380 3.800 3.189 4.282 . 0 0 "[ . 1 . 2]" 1
1481 1 72 LYS QB 1 101 GLU QB . . 3.620 2.905 2.287 3.391 . 0 0 "[ . 1 . 2]" 1
1482 1 73 ILE H 1 73 ILE HB . . 3.090 2.512 2.420 2.578 . 0 0 "[ . 1 . 2]" 1
1483 1 73 ILE H 1 73 ILE MD . . 4.170 2.792 2.562 3.169 . 0 0 "[ . 1 . 2]" 1
1484 1 73 ILE H 1 73 ILE HG12 . . 3.250 2.161 1.992 2.281 . 0 0 "[ . 1 . 2]" 1
1485 1 73 ILE H 1 73 ILE HG13 . . 3.780 3.620 3.447 3.728 . 0 0 "[ . 1 . 2]" 1
1486 1 73 ILE H 1 73 ILE MG . . 4.600 3.776 3.720 3.828 . 0 0 "[ . 1 . 2]" 1
1487 1 73 ILE HA 1 73 ILE MD . . 3.390 2.278 2.222 2.408 . 0 0 "[ . 1 . 2]" 1
1488 1 73 ILE HA 1 73 ILE HG12 . . 4.170 3.465 3.275 3.568 . 0 0 "[ . 1 . 2]" 1
1489 1 73 ILE HA 1 73 ILE MG . . 3.260 2.423 2.361 2.491 . 0 0 "[ . 1 . 2]" 1
1490 1 73 ILE HA 1 74 VAL H . . 2.710 2.279 2.232 2.337 . 0 0 "[ . 1 . 2]" 1
1491 1 73 ILE HA 1 74 VAL HA . . 4.510 4.507 4.430 4.538 0.028 14 0 "[ . 1 . 2]" 1
1492 1 73 ILE HA 1 74 VAL QG . . 4.700 3.371 3.198 3.937 . 0 0 "[ . 1 . 2]" 1
1493 1 73 ILE HA 1 75 GLU H . . 3.990 3.750 3.588 3.885 . 0 0 "[ . 1 . 2]" 1
1494 1 73 ILE HA 1 100 MET HA . . 3.060 2.245 2.129 2.433 . 0 0 "[ . 1 . 2]" 1
1495 1 73 ILE HA 1 100 MET QB . . 3.650 2.288 1.942 2.622 . 0 0 "[ . 1 . 2]" 1
1496 1 73 ILE HA 1 101 GLU H . . 4.530 3.776 3.563 3.968 . 0 0 "[ . 1 . 2]" 1
1497 1 73 ILE HB 1 73 ILE MD . . 3.640 3.249 3.224 3.267 . 0 0 "[ . 1 . 2]" 1
1498 1 73 ILE HB 1 74 VAL H . . 4.400 3.919 3.735 4.076 . 0 0 "[ . 1 . 2]" 1
1499 1 73 ILE MD 1 73 ILE MG . . 3.350 2.214 2.069 2.337 . 0 0 "[ . 1 . 2]" 1
1500 1 73 ILE MD 1 74 VAL H . . 4.470 3.945 3.737 4.093 . 0 0 "[ . 1 . 2]" 1
1501 1 73 ILE MD 1 98 PHE HB2 . . 4.510 3.409 2.789 3.944 . 0 0 "[ . 1 . 2]" 1
1502 1 73 ILE MD 1 98 PHE HB3 . . 5.190 4.394 3.616 4.897 . 0 0 "[ . 1 . 2]" 1
1503 1 73 ILE MD 1 98 PHE QD . . 3.320 2.284 1.991 2.762 . 0 0 "[ . 1 . 2]" 1
1504 1 73 ILE MD 1 98 PHE QE . . 4.230 2.490 2.071 3.197 . 0 0 "[ . 1 . 2]" 1
1505 1 73 ILE MD 1 100 MET HA . . 4.880 3.605 3.347 3.976 . 0 0 "[ . 1 . 2]" 1
1506 1 73 ILE MD 1 100 MET QB . . 3.630 2.127 1.960 2.426 . 0 0 "[ . 1 . 2]" 1
1507 1 73 ILE MD 1 100 MET ME . . 4.050 3.130 2.297 3.734 . 0 0 "[ . 1 . 2]" 1
1508 1 73 ILE HG12 1 98 PHE QD . . 5.370 5.134 4.690 5.451 0.081 4 0 "[ . 1 . 2]" 1
1509 1 73 ILE MG 1 75 GLU H . . 3.280 2.503 2.157 2.781 . 0 0 "[ . 1 . 2]" 1
1510 1 73 ILE MG 1 98 PHE HB2 . . 3.670 2.452 2.221 2.736 . 0 0 "[ . 1 . 2]" 1
1511 1 73 ILE MG 1 98 PHE HB3 . . 4.480 3.656 3.416 3.993 . 0 0 "[ . 1 . 2]" 1
1512 1 73 ILE MG 1 98 PHE QD . . 4.200 2.899 2.448 3.253 . 0 0 "[ . 1 . 2]" 1
1513 1 73 ILE MG 1 99 LYS H . . 4.370 3.132 2.944 3.374 . 0 0 "[ . 1 . 2]" 1
1514 1 73 ILE MG 1 100 MET QB . . 5.260 3.672 3.330 3.932 . 0 0 "[ . 1 . 2]" 1
1515 1 74 VAL H 1 74 VAL QG . . 2.910 2.427 2.308 2.905 . 0 0 "[ . 1 . 2]" 1
1516 1 74 VAL H 1 75 GLU H . . 2.730 1.785 1.543 1.889 . 0 0 "[ . 1 . 2]" 1
1517 1 74 VAL H 1 75 GLU HB3 . . 4.840 4.881 4.746 4.923 0.083 14 0 "[ . 1 . 2]" 1
1518 1 74 VAL H 1 99 LYS H . . 4.740 3.843 3.722 3.992 . 0 0 "[ . 1 . 2]" 1
1519 1 74 VAL H 1 99 LYS HB3 . . 5.010 4.750 4.140 5.069 0.059 20 0 "[ . 1 . 2]" 1
1520 1 74 VAL H 1 100 MET HA . . 3.120 2.656 2.423 2.961 . 0 0 "[ . 1 . 2]" 1
1521 1 74 VAL H 1 100 MET QB . . 4.980 3.885 3.457 4.177 . 0 0 "[ . 1 . 2]" 1
1522 1 74 VAL HA 1 74 VAL HB . . 2.910 2.556 2.462 2.801 . 0 0 "[ . 1 . 2]" 1
1523 1 74 VAL HA 1 74 VAL QG . . 3.060 2.326 2.216 2.440 . 0 0 "[ . 1 . 2]" 1
1524 1 74 VAL HB 1 75 GLU H . . 4.580 4.263 3.430 4.472 . 0 0 "[ . 1 . 2]" 1
1525 1 74 VAL HB 1 75 GLU HA . . 5.220 5.082 4.856 5.334 0.114 17 0 "[ . 1 . 2]" 1
1526 1 74 VAL QG 1 75 GLU H . . 5.000 3.016 2.751 3.226 . 0 0 "[ . 1 . 2]" 1
1527 1 74 VAL QG 1 75 GLU HA . . 4.820 4.271 3.747 4.481 . 0 0 "[ . 1 . 2]" 1
1528 1 74 VAL QG 1 75 GLU HB3 . . 4.840 4.155 3.736 4.459 . 0 0 "[ . 1 . 2]" 1
1529 1 74 VAL QG 1 75 GLU QG . . 4.550 4.296 3.244 4.541 . 0 0 "[ . 1 . 2]" 1
1530 1 74 VAL QG 1 99 LYS HB3 . . 3.960 3.407 3.029 3.759 . 0 0 "[ . 1 . 2]" 1
1531 1 74 VAL QG 1 100 MET H . . 4.420 3.712 3.409 3.941 . 0 0 "[ . 1 . 2]" 1
1532 1 74 VAL QG 1 100 MET HA . . 3.260 2.348 2.059 2.960 . 0 0 "[ . 1 . 2]" 1
1533 1 74 VAL QG 1 100 MET QB . . 4.990 3.750 3.452 4.191 . 0 0 "[ . 1 . 2]" 1
1534 1 74 VAL QG 1 101 GLU H . . 3.290 2.417 2.074 2.958 . 0 0 "[ . 1 . 2]" 1
1535 1 74 VAL QG 1 101 GLU HA . . 4.410 3.391 3.204 3.670 . 0 0 "[ . 1 . 2]" 1
1536 1 74 VAL QG 1 101 GLU QB . . 3.580 2.293 1.975 2.504 . 0 0 "[ . 1 . 2]" 1
1537 1 74 VAL QG 1 101 GLU HG3 . . 5.130 3.965 3.440 4.267 . 0 0 "[ . 1 . 2]" 1
1538 1 75 GLU H 1 75 GLU HB2 . . 3.960 3.007 2.836 3.181 . 0 0 "[ . 1 . 2]" 1
1539 1 75 GLU H 1 75 GLU HB3 . . 3.820 3.313 3.059 3.526 . 0 0 "[ . 1 . 2]" 1
1540 1 75 GLU H 1 76 VAL H . . 4.800 4.302 4.183 4.389 . 0 0 "[ . 1 . 2]" 1
1541 1 75 GLU H 1 76 VAL QG . . 5.070 3.589 3.353 3.817 . 0 0 "[ . 1 . 2]" 1
1542 1 75 GLU H 1 98 PHE HB2 . . 4.700 4.156 3.878 4.573 . 0 0 "[ . 1 . 2]" 1
1543 1 75 GLU H 1 99 LYS H . . 3.530 2.919 2.701 3.248 . 0 0 "[ . 1 . 2]" 1
1544 1 75 GLU H 1 99 LYS HB2 . . 3.930 3.090 2.884 3.376 . 0 0 "[ . 1 . 2]" 1
1545 1 75 GLU H 1 99 LYS HB3 . . 4.370 4.395 4.046 4.448 0.078 19 0 "[ . 1 . 2]" 1
1546 1 75 GLU H 1 100 MET HA . . 4.220 4.076 3.789 4.279 0.059 14 0 "[ . 1 . 2]" 1
1547 1 75 GLU HA 1 75 GLU QG . . 3.390 2.233 2.038 2.335 . 0 0 "[ . 1 . 2]" 1
1548 1 75 GLU HA 1 76 VAL H . . 2.810 2.441 2.339 2.526 . 0 0 "[ . 1 . 2]" 1
1549 1 75 GLU HA 1 76 VAL QG . . 4.490 3.239 2.860 3.433 . 0 0 "[ . 1 . 2]" 1
1550 1 75 GLU HB2 1 96 TRP HH2 . . 5.180 4.870 4.633 5.241 0.061 11 0 "[ . 1 . 2]" 1
1551 1 75 GLU HB2 1 96 TRP HZ3 . . 4.990 4.748 4.283 5.038 0.048 4 0 "[ . 1 . 2]" 1
1552 1 75 GLU HB2 1 99 LYS H . . 4.850 4.277 3.817 4.559 . 0 0 "[ . 1 . 2]" 1
1553 1 75 GLU HB2 1 99 LYS HB2 . . 4.070 2.388 2.113 2.787 . 0 0 "[ . 1 . 2]" 1
1554 1 75 GLU HB3 1 76 VAL H . . 4.290 3.331 3.061 3.733 . 0 0 "[ . 1 . 2]" 1
1555 1 75 GLU HB3 1 96 TRP HH2 . . 4.010 3.301 2.904 3.864 . 0 0 "[ . 1 . 2]" 1
1556 1 75 GLU HB3 1 96 TRP HZ3 . . 4.740 3.049 2.718 3.339 . 0 0 "[ . 1 . 2]" 1
1557 1 75 GLU HB3 1 99 LYS H . . 4.580 3.413 3.079 3.863 . 0 0 "[ . 1 . 2]" 1
1558 1 75 GLU HB3 1 99 LYS HB2 . . 4.210 2.216 2.059 2.358 . 0 0 "[ . 1 . 2]" 1
1559 1 75 GLU QG 1 76 VAL H . . 3.370 2.643 2.095 3.246 . 0 0 "[ . 1 . 2]" 1
1560 1 75 GLU QG 1 76 VAL HA . . 5.170 4.777 4.376 5.225 0.055 17 0 "[ . 1 . 2]" 1
1561 1 75 GLU QG 1 96 TRP HH2 . . 3.210 2.923 2.372 3.296 0.086 17 0 "[ . 1 . 2]" 1
1562 1 75 GLU QG 1 96 TRP HZ3 . . 5.060 4.080 3.431 4.518 . 0 0 "[ . 1 . 2]" 1
1563 1 76 VAL H 1 76 VAL HB . . 4.040 3.878 3.822 3.947 . 0 0 "[ . 1 . 2]" 1
1564 1 76 VAL H 1 76 VAL QG . . 3.160 2.274 2.184 2.388 . 0 0 "[ . 1 . 2]" 1
1565 1 76 VAL H 1 77 ASN H . . 5.040 4.403 4.335 4.490 . 0 0 "[ . 1 . 2]" 1
1566 1 76 VAL H 1 98 PHE HA . . 5.020 4.626 4.382 4.799 . 0 0 "[ . 1 . 2]" 1
1567 1 76 VAL HA 1 77 ASN H . . 2.890 2.423 2.267 2.636 . 0 0 "[ . 1 . 2]" 1
1568 1 76 VAL HA 1 77 ASN HB2 . . 4.860 4.217 3.981 4.430 . 0 0 "[ . 1 . 2]" 1
1569 1 76 VAL HA 1 96 TRP HH2 . . 5.190 4.068 3.870 4.396 . 0 0 "[ . 1 . 2]" 1
1570 1 76 VAL HA 1 96 TRP HZ3 . . 3.660 2.629 2.384 2.878 . 0 0 "[ . 1 . 2]" 1
1571 1 76 VAL HA 1 98 PHE H . . 5.280 4.900 4.751 5.177 . 0 0 "[ . 1 . 2]" 1
1572 1 76 VAL HA 1 98 PHE HA . . 2.860 2.089 1.978 2.268 . 0 0 "[ . 1 . 2]" 1
1573 1 76 VAL HA 1 98 PHE HB2 . . 3.920 3.120 2.883 3.325 . 0 0 "[ . 1 . 2]" 1
1574 1 76 VAL HA 1 98 PHE HB3 . . 3.870 3.091 2.959 3.278 . 0 0 "[ . 1 . 2]" 1
1575 1 76 VAL HA 1 99 LYS H . . 4.080 3.346 3.184 3.522 . 0 0 "[ . 1 . 2]" 1
1576 1 76 VAL HB 1 77 ASN H . . 3.270 2.740 2.328 3.179 . 0 0 "[ . 1 . 2]" 1
1577 1 76 VAL HB 1 98 PHE HA . . 4.980 4.163 3.863 4.518 . 0 0 "[ . 1 . 2]" 1
1578 1 76 VAL HB 1 98 PHE HB3 . . 4.800 3.890 3.328 4.334 . 0 0 "[ . 1 . 2]" 1
1579 1 76 VAL QG 1 77 ASN H . . 4.170 3.298 2.937 3.569 . 0 0 "[ . 1 . 2]" 1
1580 1 76 VAL QG 1 78 GLU H . . 4.560 3.073 2.622 3.588 . 0 0 "[ . 1 . 2]" 1
1581 1 76 VAL QG 1 78 GLU HA . . 3.950 3.903 3.617 3.996 0.046 19 0 "[ . 1 . 2]" 1
1582 1 76 VAL QG 1 78 GLU HB3 . . 5.350 4.581 2.745 5.154 . 0 0 "[ . 1 . 2]" 1
1583 1 76 VAL QG 1 78 GLU HG3 . . 4.660 2.751 2.088 4.686 0.026 15 0 "[ . 1 . 2]" 1
1584 1 76 VAL QG 1 96 TRP HZ3 . . 4.710 4.131 4.013 4.283 . 0 0 "[ . 1 . 2]" 1
1585 1 76 VAL QG 1 98 PHE HA . . 4.320 3.502 3.301 3.832 . 0 0 "[ . 1 . 2]" 1
1586 1 76 VAL QG 1 98 PHE HB2 . . 3.680 2.714 2.266 3.082 . 0 0 "[ . 1 . 2]" 1
1587 1 76 VAL QG 1 98 PHE HB3 . . 3.580 2.892 2.480 3.407 . 0 0 "[ . 1 . 2]" 1
1588 1 76 VAL QG 1 98 PHE QD . . 5.040 4.202 3.880 4.508 . 0 0 "[ . 1 . 2]" 1
1589 1 76 VAL QG 1 99 LYS H . . 4.790 3.707 3.453 3.897 . 0 0 "[ . 1 . 2]" 1
1590 1 77 ASN H 1 77 ASN HB2 . . 3.250 2.643 2.448 2.848 . 0 0 "[ . 1 . 2]" 1
1591 1 77 ASN H 1 77 ASN HB3 . . 3.250 2.669 2.517 2.835 . 0 0 "[ . 1 . 2]" 1
1592 1 77 ASN H 1 78 GLU H . . 4.930 3.868 3.544 4.080 . 0 0 "[ . 1 . 2]" 1
1593 1 77 ASN H 1 96 TRP HZ3 . . 4.520 3.482 3.160 3.828 . 0 0 "[ . 1 . 2]" 1
1594 1 77 ASN H 1 97 LEU HA . . 4.540 3.999 3.615 4.340 . 0 0 "[ . 1 . 2]" 1
1595 1 77 ASN H 1 98 PHE HA . . 3.780 3.201 2.758 3.688 . 0 0 "[ . 1 . 2]" 1
1596 1 77 ASN H 1 98 PHE HB3 . . 4.920 4.040 3.675 4.317 . 0 0 "[ . 1 . 2]" 1
1597 1 77 ASN HA 1 78 GLU H . . 2.610 2.396 2.231 2.511 . 0 0 "[ . 1 . 2]" 1
1598 1 77 ASN HA 1 79 LYS H . . 4.130 3.228 2.825 3.396 . 0 0 "[ . 1 . 2]" 1
1599 1 77 ASN HA 1 96 TRP HH2 . . 3.540 3.100 2.841 3.413 . 0 0 "[ . 1 . 2]" 1
1600 1 77 ASN HA 1 96 TRP HZ2 . . 4.050 3.322 2.848 3.676 . 0 0 "[ . 1 . 2]" 1
1601 1 77 ASN HA 1 96 TRP HZ3 . . 4.590 4.070 3.801 4.384 . 0 0 "[ . 1 . 2]" 1
1602 1 77 ASN HB2 1 77 ASN HD21 . . 3.570 2.744 2.527 2.932 . 0 0 "[ . 1 . 2]" 1
1603 1 77 ASN HB2 1 78 GLU H . . 4.690 4.706 4.598 4.749 0.059 16 0 "[ . 1 . 2]" 1
1604 1 77 ASN HB2 1 80 LEU QD . . 4.950 3.885 3.639 4.165 . 0 0 "[ . 1 . 2]" 1
1605 1 77 ASN HB2 1 80 LEU HG . . 4.110 4.107 3.845 4.191 0.081 1 0 "[ . 1 . 2]" 1
1606 1 77 ASN HB2 1 96 TRP HE3 . . 4.340 3.112 2.915 3.323 . 0 0 "[ . 1 . 2]" 1
1607 1 77 ASN HB2 1 96 TRP HH2 . . 4.610 3.780 3.599 4.047 . 0 0 "[ . 1 . 2]" 1
1608 1 77 ASN HB2 1 96 TRP HZ2 . . 4.570 3.870 3.618 4.094 . 0 0 "[ . 1 . 2]" 1
1609 1 77 ASN HB2 1 96 TRP HZ3 . . 4.610 3.337 3.119 3.611 . 0 0 "[ . 1 . 2]" 1
1610 1 77 ASN HB2 1 97 LEU HA . . 4.410 3.698 3.306 4.088 . 0 0 "[ . 1 . 2]" 1
1611 1 77 ASN HB3 1 80 LEU H . . 4.560 3.504 3.306 3.745 . 0 0 "[ . 1 . 2]" 1
1612 1 77 ASN HB3 1 80 LEU QD . . 4.160 2.833 2.522 3.345 . 0 0 "[ . 1 . 2]" 1
1613 1 77 ASN HB3 1 80 LEU HG . . 3.430 2.590 2.414 2.846 . 0 0 "[ . 1 . 2]" 1
1614 1 77 ASN HB3 1 96 TRP HZ2 . . 5.130 5.196 5.121 5.211 0.081 9 0 "[ . 1 . 2]" 1
1615 1 77 ASN HB3 1 97 LEU HA . . 4.240 3.065 2.388 3.443 . 0 0 "[ . 1 . 2]" 1
1616 1 77 ASN HD21 1 79 LYS HB3 . . 4.850 4.917 4.844 4.936 0.086 14 0 "[ . 1 . 2]" 1
1617 1 77 ASN HD21 1 80 LEU H . . 4.860 4.293 3.717 4.707 . 0 0 "[ . 1 . 2]" 1
1618 1 77 ASN HD21 1 80 LEU QD . . 4.640 2.200 2.017 2.845 . 0 0 "[ . 1 . 2]" 1
1619 1 77 ASN HD21 1 80 LEU HG . . 4.210 2.769 2.186 3.206 . 0 0 "[ . 1 . 2]" 1
1620 1 77 ASN HD21 1 95 GLY HA2 . . 4.660 3.593 3.303 3.871 . 0 0 "[ . 1 . 2]" 1
1621 1 77 ASN HD21 1 95 GLY HA3 . . 5.200 5.072 4.835 5.260 0.060 5 0 "[ . 1 . 2]" 1
1622 1 77 ASN HD21 1 96 TRP H . . 4.480 3.001 2.770 3.439 . 0 0 "[ . 1 . 2]" 1
1623 1 77 ASN HD21 1 97 LEU HA . . 5.130 3.776 3.161 4.126 . 0 0 "[ . 1 . 2]" 1
1624 1 77 ASN HD22 1 79 LYS HB2 . . 4.940 3.124 2.213 3.724 . 0 0 "[ . 1 . 2]" 1
1625 1 77 ASN HD22 1 79 LYS HB3 . . 5.310 3.926 3.475 4.127 . 0 0 "[ . 1 . 2]" 1
1626 1 77 ASN HD22 1 79 LYS QE . . 5.370 4.340 2.198 5.451 0.081 19 0 "[ . 1 . 2]" 1
1627 1 77 ASN HD22 1 80 LEU QD . . 4.530 2.559 2.198 3.487 . 0 0 "[ . 1 . 2]" 1
1628 1 77 ASN HD22 1 80 LEU HG . . 4.720 4.046 2.912 4.539 . 0 0 "[ . 1 . 2]" 1
1629 1 77 ASN HD22 1 95 GLY HA2 . . 4.730 3.599 3.274 3.783 . 0 0 "[ . 1 . 2]" 1
1630 1 77 ASN HD22 1 95 GLY HA3 . . 5.120 5.177 4.890 5.215 0.095 2 0 "[ . 1 . 2]" 1
1631 1 77 ASN HD22 1 96 TRP H . . 5.470 3.157 2.835 3.882 . 0 0 "[ . 1 . 2]" 1
1632 1 77 ASN HD22 1 96 TRP HD1 . . 4.390 3.534 3.192 4.385 . 0 0 "[ . 1 . 2]" 1
1633 1 77 ASN HD22 1 96 TRP HE1 . . 4.690 3.424 3.031 4.457 . 0 0 "[ . 1 . 2]" 1
1634 1 78 GLU H 1 78 GLU HB2 . . 3.190 2.431 2.097 3.534 0.344 15 0 "[ . 1 . 2]" 1
1635 1 78 GLU H 1 78 GLU HB3 . . 3.460 3.418 2.514 3.542 0.082 16 0 "[ . 1 . 2]" 1
1636 1 78 GLU H 1 78 GLU HG2 . . 3.960 3.437 2.034 4.031 0.071 19 0 "[ . 1 . 2]" 1
1637 1 78 GLU H 1 78 GLU HG3 . . 3.560 2.772 2.226 3.437 . 0 0 "[ . 1 . 2]" 1
1638 1 78 GLU H 1 79 LYS H . . 3.350 2.772 2.552 3.007 . 0 0 "[ . 1 . 2]" 1
1639 1 78 GLU H 1 80 LEU H . . 5.220 4.570 4.447 4.867 . 0 0 "[ . 1 . 2]" 1
1640 1 78 GLU H 1 96 TRP HH2 . . 5.200 4.765 4.168 5.261 0.061 9 0 "[ . 1 . 2]" 1
1641 1 78 GLU HA 1 78 GLU HG2 . . 3.640 2.613 2.085 3.810 0.170 15 0 "[ . 1 . 2]" 1
1642 1 78 GLU HA 1 78 GLU HG3 . . 3.870 3.100 2.661 3.713 . 0 0 "[ . 1 . 2]" 1
1643 1 78 GLU HA 1 79 LYS H . . 3.240 3.317 3.280 3.333 0.093 10 0 "[ . 1 . 2]" 1
1644 1 78 GLU HA 1 80 LEU H . . 4.050 3.637 3.365 4.121 0.071 17 0 "[ . 1 . 2]" 1
1645 1 78 GLU HA 1 81 ASP H . . 4.160 3.395 3.059 3.831 . 0 0 "[ . 1 . 2]" 1
1646 1 78 GLU HA 1 81 ASP HB2 . . 4.790 3.475 2.698 4.454 . 0 0 "[ . 1 . 2]" 1
1647 1 78 GLU HB2 1 79 LYS H . . 4.550 3.495 3.143 4.142 . 0 0 "[ . 1 . 2]" 1
1648 1 78 GLU HB3 1 78 GLU HG2 . . 2.740 2.548 2.255 2.978 0.238 7 0 "[ . 1 . 2]" 1
1649 1 78 GLU HB3 1 79 LYS H . . 4.960 3.987 3.602 4.417 . 0 0 "[ . 1 . 2]" 1
1650 1 79 LYS H 1 79 LYS HB2 . . 2.920 2.281 2.061 2.493 . 0 0 "[ . 1 . 2]" 1
1651 1 79 LYS H 1 79 LYS HB3 . . 3.530 3.524 3.329 3.604 0.074 12 0 "[ . 1 . 2]" 1
1652 1 79 LYS H 1 79 LYS QD . . 4.580 4.062 3.095 4.654 0.074 15 0 "[ . 1 . 2]" 1
1653 1 79 LYS H 1 79 LYS HG2 . . 3.880 3.287 2.222 3.967 0.087 15 0 "[ . 1 . 2]" 1
1654 1 79 LYS H 1 79 LYS HG3 . . 3.700 3.089 2.209 3.943 0.243 1 0 "[ . 1 . 2]" 1
1655 1 79 LYS H 1 80 LEU H . . 3.150 2.731 2.562 2.867 . 0 0 "[ . 1 . 2]" 1
1656 1 79 LYS H 1 80 LEU QD . . 5.210 3.869 3.457 4.900 . 0 0 "[ . 1 . 2]" 1
1657 1 79 LYS HA 1 79 LYS HB3 . . 2.960 2.650 2.453 2.821 . 0 0 "[ . 1 . 2]" 1
1658 1 79 LYS HA 1 79 LYS QD . . 5.020 3.315 2.129 4.255 . 0 0 "[ . 1 . 2]" 1
1659 1 79 LYS HA 1 79 LYS HG2 . . 3.930 2.512 2.059 3.272 . 0 0 "[ . 1 . 2]" 1
1660 1 79 LYS HA 1 79 LYS HG3 . . 3.430 3.259 2.726 3.804 0.374 6 0 "[ . 1 . 2]" 1
1661 1 79 LYS HA 1 82 THR H . . 4.350 3.730 3.407 4.118 . 0 0 "[ . 1 . 2]" 1
1662 1 79 LYS HB2 1 79 LYS QD . . 3.370 2.948 2.299 3.471 0.101 19 0 "[ . 1 . 2]" 1
1663 1 79 LYS HB2 1 79 LYS QE . . 5.000 3.304 2.088 4.036 . 0 0 "[ . 1 . 2]" 1
1664 1 79 LYS HB2 1 80 LEU H . . 4.440 2.930 2.528 3.411 . 0 0 "[ . 1 . 2]" 1
1665 1 79 LYS HB2 1 80 LEU HA . . 5.280 4.572 4.119 5.158 . 0 0 "[ . 1 . 2]" 1
1666 1 79 LYS HB3 1 79 LYS QE . . 3.080 2.603 2.012 3.176 0.096 11 0 "[ . 1 . 2]" 1
1667 1 79 LYS HB3 1 79 LYS HG2 . . 2.540 2.734 2.372 3.039 0.499 20 0 "[ . 1 . 2]" 1
1668 1 79 LYS HB3 1 79 LYS HG3 . . 2.970 2.823 2.432 3.044 0.074 2 0 "[ . 1 . 2]" 1
1669 1 79 LYS HB3 1 80 LEU H . . 4.400 3.575 3.079 3.880 . 0 0 "[ . 1 . 2]" 1
1670 1 79 LYS QD 1 80 LEU H . . 5.230 5.075 4.752 5.324 0.094 2 0 "[ . 1 . 2]" 1
1671 1 79 LYS QE 1 79 LYS HG2 . . 3.740 3.018 2.113 3.597 . 0 0 "[ . 1 . 2]" 1
1672 1 80 LEU H 1 80 LEU HB2 . . 3.120 2.352 2.216 2.488 . 0 0 "[ . 1 . 2]" 1
1673 1 80 LEU H 1 80 LEU HB3 . . 3.650 3.534 3.377 3.604 . 0 0 "[ . 1 . 2]" 1
1674 1 80 LEU H 1 80 LEU QD . . 3.250 2.398 2.092 3.093 . 0 0 "[ . 1 . 2]" 1
1675 1 80 LEU H 1 80 LEU HG . . 4.000 3.129 2.024 3.560 . 0 0 "[ . 1 . 2]" 1
1676 1 80 LEU HA 1 80 LEU QD . . 2.930 2.123 2.044 2.259 . 0 0 "[ . 1 . 2]" 1
1677 1 80 LEU HA 1 82 THR H . . 4.430 3.663 3.216 4.119 . 0 0 "[ . 1 . 2]" 1
1678 1 80 LEU HA 1 83 GLU H . . 3.500 2.957 2.588 3.268 . 0 0 "[ . 1 . 2]" 1
1679 1 80 LEU HA 1 84 PRO HA . . 3.360 2.833 2.395 3.399 0.039 20 0 "[ . 1 . 2]" 1
1680 1 80 LEU HA 1 87 ILE MD . . 5.430 5.005 4.193 5.391 . 0 0 "[ . 1 . 2]" 1
1681 1 80 LEU HB2 1 81 ASP H . . 3.990 3.344 3.005 3.656 . 0 0 "[ . 1 . 2]" 1
1682 1 80 LEU HB2 1 81 ASP HA . . 5.290 4.831 4.476 5.204 . 0 0 "[ . 1 . 2]" 1
1683 1 80 LEU HB2 1 84 PRO HA . . 5.020 4.621 4.331 5.067 0.047 20 0 "[ . 1 . 2]" 1
1684 1 80 LEU HB3 1 80 LEU QD . . 3.170 2.102 2.011 2.167 . 0 0 "[ . 1 . 2]" 1
1685 1 80 LEU HB3 1 80 LEU HG . . 3.030 2.810 2.627 3.085 0.055 12 0 "[ . 1 . 2]" 1
1686 1 80 LEU HB3 1 81 ASP H . . 4.410 4.077 3.718 4.287 . 0 0 "[ . 1 . 2]" 1
1687 1 80 LEU HB3 1 84 PRO HA . . 3.860 3.047 2.713 3.584 . 0 0 "[ . 1 . 2]" 1
1688 1 80 LEU HB3 1 87 ILE MD . . 3.790 3.810 2.888 3.902 0.112 4 0 "[ . 1 . 2]" 1
1689 1 80 LEU QD 1 81 ASP H . . 5.280 4.176 3.991 4.491 . 0 0 "[ . 1 . 2]" 1
1690 1 80 LEU QD 1 84 PRO HA . . 3.370 2.451 2.088 2.904 . 0 0 "[ . 1 . 2]" 1
1691 1 80 LEU QD 1 86 LEU H . . 3.950 3.542 2.613 3.996 0.046 15 0 "[ . 1 . 2]" 1
1692 1 80 LEU QD 1 87 ILE H . . 3.940 3.299 2.754 3.548 . 0 0 "[ . 1 . 2]" 1
1693 1 80 LEU QD 1 87 ILE HA . . 5.020 4.020 3.736 4.323 . 0 0 "[ . 1 . 2]" 1
1694 1 80 LEU QD 1 87 ILE HG12 . . 3.950 2.649 2.131 3.475 . 0 0 "[ . 1 . 2]" 1
1695 1 80 LEU QD 1 87 ILE HG13 . . 3.890 2.413 2.053 3.922 0.032 5 0 "[ . 1 . 2]" 1
1696 1 80 LEU QD 1 95 GLY HA2 . . 3.690 2.296 1.990 3.000 . 0 0 "[ . 1 . 2]" 1
1697 1 80 LEU QD 1 95 GLY HA3 . . 4.310 3.351 2.960 3.859 . 0 0 "[ . 1 . 2]" 1
1698 1 80 LEU HG 1 84 PRO HA . . 5.410 5.027 4.631 5.486 0.076 3 0 "[ . 1 . 2]" 1
1699 1 80 LEU HG 1 95 GLY HA2 . . 4.690 4.468 4.057 4.761 0.071 7 0 "[ . 1 . 2]" 1
1700 1 80 LEU HG 1 97 LEU HA . . 3.130 3.021 2.774 3.224 0.094 15 0 "[ . 1 . 2]" 1
1701 1 80 LEU HG 1 97 LEU HB3 . . 4.910 4.980 4.900 4.999 0.089 12 0 "[ . 1 . 2]" 1
1702 1 80 LEU HG 1 97 LEU HG . . 4.840 4.835 4.509 4.934 0.094 15 0 "[ . 1 . 2]" 1
1703 1 81 ASP H 1 81 ASP HB2 . . 2.990 2.407 2.116 2.721 . 0 0 "[ . 1 . 2]" 1
1704 1 81 ASP H 1 81 ASP HB3 . . 3.130 2.529 2.338 2.805 . 0 0 "[ . 1 . 2]" 1
1705 1 81 ASP H 1 82 THR H . . 3.230 2.601 2.408 2.952 . 0 0 "[ . 1 . 2]" 1
1706 1 81 ASP H 1 82 THR MG . . 5.000 4.098 3.673 4.627 . 0 0 "[ . 1 . 2]" 1
1707 1 81 ASP H 1 83 GLU H . . 4.330 3.941 3.637 4.096 . 0 0 "[ . 1 . 2]" 1
1708 1 81 ASP HA 1 81 ASP HB3 . . 3.000 3.039 3.021 3.066 0.066 14 0 "[ . 1 . 2]" 1
1709 1 81 ASP HB2 1 82 THR H . . 3.730 3.961 3.445 4.252 0.522 9 2 "[ . +1- . 2]" 1
1710 1 81 ASP HB2 1 82 THR MG . . 4.130 4.006 3.805 4.190 0.060 13 0 "[ . 1 . 2]" 1
1711 1 81 ASP HB3 1 82 THR H . . 4.220 2.878 2.243 3.431 . 0 0 "[ . 1 . 2]" 1
1712 1 81 ASP HB3 1 82 THR MG . . 3.920 2.484 2.262 2.752 . 0 0 "[ . 1 . 2]" 1
1713 1 82 THR H 1 82 THR HB . . 3.990 3.740 3.541 3.921 . 0 0 "[ . 1 . 2]" 1
1714 1 82 THR H 1 82 THR MG . . 3.740 2.746 2.246 3.044 . 0 0 "[ . 1 . 2]" 1
1715 1 82 THR H 1 83 GLU H . . 2.790 2.034 1.798 2.531 . 0 0 "[ . 1 . 2]" 1
1716 1 82 THR H 1 83 GLU HB2 . . 4.880 4.256 3.802 4.949 0.069 3 0 "[ . 1 . 2]" 1
1717 1 82 THR H 1 83 GLU QG . . 5.150 4.670 4.014 5.145 . 0 0 "[ . 1 . 2]" 1
1718 1 82 THR H 1 84 PRO HD3 . . 5.200 3.624 3.010 4.628 . 0 0 "[ . 1 . 2]" 1
1719 1 82 THR HA 1 82 THR HB . . 2.750 2.433 2.261 2.561 . 0 0 "[ . 1 . 2]" 1
1720 1 82 THR HA 1 82 THR MG . . 3.120 2.378 2.248 2.700 . 0 0 "[ . 1 . 2]" 1
1721 1 82 THR HA 1 84 PRO HD2 . . 5.200 4.395 3.997 5.111 . 0 0 "[ . 1 . 2]" 1
1722 1 82 THR HA 1 84 PRO HD3 . . 4.660 3.349 2.891 4.399 . 0 0 "[ . 1 . 2]" 1
1723 1 82 THR HB 1 83 GLU HA . . 5.170 5.096 4.832 5.245 0.075 9 0 "[ . 1 . 2]" 1
1724 1 82 THR HB 1 83 GLU QG . . 4.920 3.928 2.501 4.588 . 0 0 "[ . 1 . 2]" 1
1725 1 82 THR MG 1 83 GLU H . . 5.070 4.082 3.650 4.210 . 0 0 "[ . 1 . 2]" 1
1726 1 82 THR MG 1 83 GLU QG . . 4.960 4.878 3.858 5.069 0.109 4 0 "[ . 1 . 2]" 1
1727 1 83 GLU H 1 83 GLU HB2 . . 3.430 2.478 2.191 2.859 . 0 0 "[ . 1 . 2]" 1
1728 1 83 GLU H 1 83 GLU HB3 . . 3.900 3.675 3.316 3.934 0.034 3 0 "[ . 1 . 2]" 1
1729 1 83 GLU H 1 83 GLU QG . . 4.020 3.303 2.798 3.565 . 0 0 "[ . 1 . 2]" 1
1730 1 83 GLU H 1 84 PRO HD3 . . 4.150 2.846 2.603 3.199 . 0 0 "[ . 1 . 2]" 1
1731 1 83 GLU HA 1 83 GLU QG . . 3.460 2.613 2.278 3.147 . 0 0 "[ . 1 . 2]" 1
1732 1 83 GLU HA 1 84 PRO HD2 . . 2.900 2.295 2.100 2.547 . 0 0 "[ . 1 . 2]" 1
1733 1 83 GLU HA 1 84 PRO HD3 . . 3.520 2.976 2.860 3.170 . 0 0 "[ . 1 . 2]" 1
1734 1 83 GLU HA 1 85 GLU H . . 3.830 3.209 2.656 3.877 0.047 3 0 "[ . 1 . 2]" 1
1735 1 83 GLU HA 1 86 LEU H . . 4.960 4.046 3.343 4.777 . 0 0 "[ . 1 . 2]" 1
1736 1 83 GLU HB2 1 84 PRO HD2 . . 4.560 4.906 4.649 5.112 0.552 19 2 "[ . 1 - . +2]" 1
1737 1 83 GLU HB3 1 86 LEU HG . . 3.370 2.866 2.083 3.458 0.088 19 0 "[ . 1 . 2]" 1
1738 1 83 GLU QG 1 86 LEU QD . . 4.700 3.576 2.330 4.400 . 0 0 "[ . 1 . 2]" 1
1739 1 83 GLU QG 1 86 LEU HG . . 4.290 4.039 3.322 4.397 0.107 2 0 "[ . 1 . 2]" 1
1740 1 84 PRO HA 1 86 LEU H . . 4.230 3.672 3.335 3.940 . 0 0 "[ . 1 . 2]" 1
1741 1 84 PRO HA 1 87 ILE H . . 4.570 4.287 3.867 4.641 0.071 3 0 "[ . 1 . 2]" 1
1742 1 84 PRO HA 1 87 ILE MD . . 4.550 3.646 2.565 4.343 . 0 0 "[ . 1 . 2]" 1
1743 1 84 PRO HB2 1 85 GLU H . . 3.960 3.479 2.931 3.946 . 0 0 "[ . 1 . 2]" 1
1744 1 84 PRO HB2 1 85 GLU HA . . 4.340 4.285 3.966 4.418 0.078 19 0 "[ . 1 . 2]" 1
1745 1 84 PRO HB3 1 87 ILE MD . . 5.270 4.594 3.729 5.345 0.075 5 0 "[ . 1 . 2]" 1
1746 1 84 PRO HD2 1 85 GLU H . . 3.840 2.544 1.983 3.266 . 0 0 "[ . 1 . 2]" 1
1747 1 84 PRO HD3 1 85 GLU H . . 4.530 3.785 3.452 4.330 . 0 0 "[ . 1 . 2]" 1
1748 1 84 PRO HG2 1 85 GLU H . . 3.560 2.938 2.119 3.576 0.016 1 0 "[ . 1 . 2]" 1
1749 1 85 GLU H 1 85 GLU HB2 . . 3.100 2.653 2.180 3.682 0.582 12 3 "[ - . 1 + . * 2]" 1
1750 1 85 GLU H 1 85 GLU HB3 . . 3.630 2.850 2.172 3.629 . 0 0 "[ . 1 . 2]" 1
1751 1 85 GLU H 1 85 GLU QG . . 4.220 3.093 1.916 4.051 . 0 0 "[ . 1 . 2]" 1
1752 1 85 GLU H 1 86 LEU H . . 3.430 2.828 2.562 3.209 . 0 0 "[ . 1 . 2]" 1
1753 1 85 GLU HA 1 87 ILE H . . 3.820 3.626 3.315 3.834 0.014 12 0 "[ . 1 . 2]" 1
1754 1 85 GLU HA 1 88 ASN H . . 3.510 3.466 2.986 3.604 0.094 11 0 "[ . 1 . 2]" 1
1755 1 85 GLU HA 1 88 ASN HB2 . . 4.720 4.101 3.687 4.412 . 0 0 "[ . 1 . 2]" 1
1756 1 85 GLU HA 1 88 ASN HD21 . . 4.560 2.774 2.409 4.575 0.015 13 0 "[ . 1 . 2]" 1
1757 1 85 GLU HB2 1 88 ASN H . . 5.360 5.184 4.084 5.866 0.506 19 1 "[ . 1 . +2]" 1
1758 1 85 GLU HB3 1 85 GLU QG . . 2.550 2.403 2.280 2.577 0.027 7 0 "[ . 1 . 2]" 1
1759 1 85 GLU QG 1 86 LEU H . . 4.420 4.193 2.918 4.512 0.092 7 0 "[ . 1 . 2]" 1
1760 1 86 LEU H 1 86 LEU HB2 . . 2.800 2.149 1.908 2.377 . 0 0 "[ . 1 . 2]" 1
1761 1 86 LEU H 1 86 LEU HB3 . . 3.560 3.266 2.858 3.595 0.035 9 0 "[ . 1 . 2]" 1
1762 1 86 LEU H 1 86 LEU QD . . 3.910 3.503 3.200 3.717 . 0 0 "[ . 1 . 2]" 1
1763 1 86 LEU H 1 87 ILE H . . 3.360 2.733 2.360 2.903 . 0 0 "[ . 1 . 2]" 1
1764 1 86 LEU H 1 88 ASN H . . 5.000 4.267 3.997 4.443 . 0 0 "[ . 1 . 2]" 1
1765 1 86 LEU H 1 95 GLY HA3 . . 5.500 5.515 5.200 5.581 0.081 11 0 "[ . 1 . 2]" 1
1766 1 86 LEU HA 1 86 LEU QD . . 3.080 1.935 1.856 2.027 . 0 0 "[ . 1 . 2]" 1
1767 1 86 LEU HA 1 86 LEU HG . . 4.040 3.180 2.583 3.740 . 0 0 "[ . 1 . 2]" 1
1768 1 86 LEU HA 1 88 ASN H . . 4.670 3.572 3.367 3.863 . 0 0 "[ . 1 . 2]" 1
1769 1 86 LEU HA 1 88 ASN HB2 . . 4.810 4.223 4.086 4.333 . 0 0 "[ . 1 . 2]" 1
1770 1 86 LEU HA 1 89 LYS H . . 3.690 2.773 2.441 3.120 . 0 0 "[ . 1 . 2]" 1
1771 1 86 LEU HA 1 89 LYS HB2 . . 3.690 2.130 1.877 2.322 . 0 0 "[ . 1 . 2]" 1
1772 1 86 LEU HA 1 89 LYS HB3 . . 3.070 3.227 2.791 3.754 0.684 13 4 "[ .* * + - 2]" 1
1773 1 86 LEU HA 1 89 LYS HG2 . . 4.750 4.459 2.873 4.824 0.074 12 0 "[ . 1 . 2]" 1
1774 1 86 LEU HA 1 89 LYS HG3 . . 4.650 3.777 2.362 4.115 . 0 0 "[ . 1 . 2]" 1
1775 1 86 LEU HA 1 90 ASP H . . 3.900 3.636 3.179 3.965 0.065 15 0 "[ . 1 . 2]" 1
1776 1 86 LEU HB2 1 86 LEU QD . . 2.740 2.389 2.239 2.613 . 0 0 "[ . 1 . 2]" 1
1777 1 86 LEU HB2 1 87 ILE H . . 4.020 3.575 3.307 3.823 . 0 0 "[ . 1 . 2]" 1
1778 1 86 LEU HB2 1 95 GLY HA2 . . 3.990 3.707 2.853 4.077 0.087 2 0 "[ . 1 . 2]" 1
1779 1 86 LEU HB2 1 95 GLY HA3 . . 4.720 4.460 3.719 4.780 0.060 15 0 "[ . 1 . 2]" 1
1780 1 86 LEU HB3 1 87 ILE H . . 4.320 3.453 2.948 4.028 . 0 0 "[ . 1 . 2]" 1
1781 1 86 LEU HB3 1 95 GLY H . . 4.880 3.904 3.350 4.361 . 0 0 "[ . 1 . 2]" 1
1782 1 86 LEU HB3 1 95 GLY HA2 . . 3.790 2.566 2.272 2.765 . 0 0 "[ . 1 . 2]" 1
1783 1 86 LEU HB3 1 95 GLY HA3 . . 4.030 3.029 2.811 3.190 . 0 0 "[ . 1 . 2]" 1
1784 1 86 LEU QD 1 88 ASN HB2 . . 4.920 4.898 4.725 4.961 0.041 17 0 "[ . 1 . 2]" 1
1785 1 86 LEU QD 1 89 LYS H . . 5.500 3.423 3.092 3.703 . 0 0 "[ . 1 . 2]" 1
1786 1 86 LEU QD 1 89 LYS HB2 . . 4.590 2.183 1.946 2.563 . 0 0 "[ . 1 . 2]" 1
1787 1 86 LEU QD 1 89 LYS HB3 . . 3.700 2.117 1.927 2.538 . 0 0 "[ . 1 . 2]" 1
1788 1 86 LEU QD 1 90 ASP H . . 4.050 2.901 2.101 3.659 . 0 0 "[ . 1 . 2]" 1
1789 1 86 LEU QD 1 90 ASP HB2 . . 4.380 3.089 2.115 3.911 . 0 0 "[ . 1 . 2]" 1
1790 1 86 LEU QD 1 90 ASP HB3 . . 4.330 3.602 2.324 4.204 . 0 0 "[ . 1 . 2]" 1
1791 1 86 LEU QD 1 94 GLU H . . 5.430 3.732 3.251 4.768 . 0 0 "[ . 1 . 2]" 1
1792 1 86 LEU QD 1 94 GLU HA . . 5.500 4.039 3.647 4.608 . 0 0 "[ . 1 . 2]" 1
1793 1 86 LEU QD 1 94 GLU HB2 . . 3.660 2.391 1.997 3.253 . 0 0 "[ . 1 . 2]" 1
1794 1 86 LEU QD 1 94 GLU HB3 . . 3.740 2.383 1.989 3.253 . 0 0 "[ . 1 . 2]" 1
1795 1 86 LEU QD 1 94 GLU HG2 . . 5.250 4.258 3.757 4.734 . 0 0 "[ . 1 . 2]" 1
1796 1 86 LEU QD 1 94 GLU HG3 . . 5.500 3.678 2.968 4.332 . 0 0 "[ . 1 . 2]" 1
1797 1 86 LEU QD 1 95 GLY H . . 4.990 3.192 2.372 4.100 . 0 0 "[ . 1 . 2]" 1
1798 1 87 ILE H 1 87 ILE HB . . 2.730 2.589 2.234 2.799 0.069 5 0 "[ . 1 . 2]" 1
1799 1 87 ILE H 1 87 ILE MD . . 3.920 3.238 1.857 3.896 . 0 0 "[ . 1 . 2]" 1
1800 1 87 ILE H 1 87 ILE HG12 . . 3.790 3.224 2.210 3.857 0.067 10 0 "[ . 1 . 2]" 1
1801 1 87 ILE H 1 87 ILE HG13 . . 3.420 2.327 1.833 3.627 0.207 5 0 "[ . 1 . 2]" 1
1802 1 87 ILE H 1 87 ILE MG . . 4.170 3.759 3.653 3.814 . 0 0 "[ . 1 . 2]" 1
1803 1 87 ILE H 1 88 ASN H . . 3.250 2.703 2.600 2.882 . 0 0 "[ . 1 . 2]" 1
1804 1 87 ILE H 1 95 GLY HA2 . . 5.400 4.353 4.033 4.753 . 0 0 "[ . 1 . 2]" 1
1805 1 87 ILE HA 1 87 ILE MD . . 4.230 3.703 2.414 4.034 . 0 0 "[ . 1 . 2]" 1
1806 1 87 ILE HA 1 87 ILE HG12 . . 3.560 2.826 2.323 3.602 0.042 10 0 "[ . 1 . 2]" 1
1807 1 87 ILE HA 1 87 ILE HG13 . . 3.480 3.113 2.536 3.656 0.176 5 0 "[ . 1 . 2]" 1
1808 1 87 ILE HA 1 87 ILE MG . . 3.360 2.354 2.210 2.551 . 0 0 "[ . 1 . 2]" 1
1809 1 87 ILE HA 1 90 ASP H . . 4.640 3.847 3.623 4.351 . 0 0 "[ . 1 . 2]" 1
1810 1 87 ILE HA 1 91 PRO HA . . 3.260 2.320 2.071 2.563 . 0 0 "[ . 1 . 2]" 1
1811 1 87 ILE HA 1 91 PRO HB3 . . 4.060 3.245 2.728 3.693 . 0 0 "[ . 1 . 2]" 1
1812 1 87 ILE HA 1 91 PRO HD3 . . 4.580 4.121 3.728 4.513 . 0 0 "[ . 1 . 2]" 1
1813 1 87 ILE HA 1 95 GLY H . . 5.290 4.501 3.953 5.267 . 0 0 "[ . 1 . 2]" 1
1814 1 87 ILE HA 1 95 GLY HA2 . . 4.250 3.925 3.429 4.319 0.069 12 0 "[ . 1 . 2]" 1
1815 1 87 ILE HA 1 95 GLY HA3 . . 3.650 2.580 2.097 3.240 . 0 0 "[ . 1 . 2]" 1
1816 1 87 ILE HB 1 88 ASN H . . 3.500 3.131 2.752 3.545 0.045 4 0 "[ . 1 . 2]" 1
1817 1 87 ILE HG12 1 87 ILE MG . . 3.450 2.433 2.123 3.119 . 0 0 "[ . 1 . 2]" 1
1818 1 87 ILE MG 1 88 ASN H . . 4.260 3.920 3.525 4.175 . 0 0 "[ . 1 . 2]" 1
1819 1 87 ILE MG 1 88 ASN HA . . 4.560 4.057 3.529 4.520 . 0 0 "[ . 1 . 2]" 1
1820 1 87 ILE MG 1 91 PRO HA . . 4.480 2.986 2.252 3.738 . 0 0 "[ . 1 . 2]" 1
1821 1 87 ILE MG 1 91 PRO HB2 . . 4.860 3.633 3.256 4.415 . 0 0 "[ . 1 . 2]" 1
1822 1 87 ILE MG 1 91 PRO HB3 . . 4.390 2.389 2.024 3.125 . 0 0 "[ . 1 . 2]" 1
1823 1 87 ILE MG 1 95 GLY HA2 . . 5.350 5.067 4.148 5.452 0.102 2 0 "[ . 1 . 2]" 1
1824 1 87 ILE MG 1 95 GLY HA3 . . 5.390 4.086 2.993 4.676 . 0 0 "[ . 1 . 2]" 1
1825 1 88 ASN H 1 88 ASN HB2 . . 3.640 2.385 2.311 2.517 . 0 0 "[ . 1 . 2]" 1
1826 1 88 ASN H 1 88 ASN HB3 . . 3.510 3.574 3.557 3.591 0.081 6 0 "[ . 1 . 2]" 1
1827 1 88 ASN H 1 89 LYS H . . 2.930 2.373 2.237 2.463 . 0 0 "[ . 1 . 2]" 1
1828 1 88 ASN H 1 90 ASP H . . 4.670 4.203 3.840 4.421 . 0 0 "[ . 1 . 2]" 1
1829 1 88 ASN HA 1 88 ASN HD21 . . 3.450 3.349 2.074 3.531 0.081 11 0 "[ . 1 . 2]" 1
1830 1 88 ASN HA 1 88 ASN HD22 . . 4.150 4.043 3.703 4.183 0.033 5 0 "[ . 1 . 2]" 1
1831 1 88 ASN HB2 1 89 LYS H . . 3.860 2.237 2.066 2.431 . 0 0 "[ . 1 . 2]" 1
1832 1 88 ASN HB2 1 89 LYS HA . . 4.970 3.926 3.694 4.120 . 0 0 "[ . 1 . 2]" 1
1833 1 88 ASN HB2 1 89 LYS HB2 . . 5.040 3.709 3.355 4.152 . 0 0 "[ . 1 . 2]" 1
1834 1 88 ASN HB2 1 89 LYS HG2 . . 4.760 4.118 2.573 5.137 0.377 16 0 "[ . 1 . 2]" 1
1835 1 88 ASN HB3 1 89 LYS H . . 3.640 3.204 3.025 3.407 . 0 0 "[ . 1 . 2]" 1
1836 1 88 ASN HB3 1 89 LYS HA . . 4.860 3.809 3.472 4.170 . 0 0 "[ . 1 . 2]" 1
1837 1 88 ASN HB3 1 89 LYS HG2 . . 5.260 4.529 3.402 5.553 0.293 16 0 "[ . 1 . 2]" 1
1838 1 89 LYS H 1 89 LYS HB2 . . 3.410 2.028 1.905 2.237 . 0 0 "[ . 1 . 2]" 1
1839 1 89 LYS H 1 89 LYS HB3 . . 3.340 3.235 2.991 3.464 0.124 13 0 "[ . 1 . 2]" 1
1840 1 89 LYS H 1 89 LYS HG2 . . 3.870 3.456 2.328 4.145 0.275 16 0 "[ . 1 . 2]" 1
1841 1 89 LYS H 1 89 LYS HG3 . . 4.120 3.811 2.505 4.189 0.069 12 0 "[ . 1 . 2]" 1
1842 1 89 LYS H 1 90 ASP H . . 3.280 2.827 2.663 2.978 . 0 0 "[ . 1 . 2]" 1
1843 1 89 LYS HA 1 89 LYS HG2 . . 4.010 2.322 2.160 3.382 . 0 0 "[ . 1 . 2]" 1
1844 1 89 LYS HA 1 89 LYS HG3 . . 3.410 3.414 2.509 3.750 0.340 6 0 "[ . 1 . 2]" 1
1845 1 89 LYS HB2 1 90 ASP H . . 4.060 3.108 2.112 3.516 . 0 0 "[ . 1 . 2]" 1
1846 1 89 LYS HB2 1 90 ASP HB2 . . 4.850 4.674 3.631 4.943 0.093 3 0 "[ . 1 . 2]" 1
1847 1 89 LYS HB3 1 90 ASP H . . 3.530 2.955 2.444 3.375 . 0 0 "[ . 1 . 2]" 1
1848 1 89 LYS HB3 1 90 ASP HB2 . . 5.090 3.441 3.034 4.051 . 0 0 "[ . 1 . 2]" 1
1849 1 89 LYS HB3 1 90 ASP HB3 . . 4.890 4.671 4.056 4.957 0.067 19 0 "[ . 1 . 2]" 1
1850 1 90 ASP H 1 90 ASP HB2 . . 3.910 3.050 2.582 3.322 . 0 0 "[ . 1 . 2]" 1
1851 1 90 ASP H 1 90 ASP HB3 . . 4.040 3.562 3.039 3.850 . 0 0 "[ . 1 . 2]" 1
1852 1 90 ASP H 1 91 PRO HD2 . . 4.160 3.869 3.648 4.209 0.049 3 0 "[ . 1 . 2]" 1
1853 1 90 ASP H 1 91 PRO HD3 . . 4.180 2.948 2.604 3.293 . 0 0 "[ . 1 . 2]" 1
1854 1 90 ASP H 1 92 GLU H . . 5.150 5.006 4.808 5.129 . 0 0 "[ . 1 . 2]" 1
1855 1 90 ASP HA 1 91 PRO HD2 . . 3.700 2.221 2.116 2.400 . 0 0 "[ . 1 . 2]" 1
1856 1 90 ASP HA 1 91 PRO HD3 . . 2.980 2.904 2.545 3.063 0.083 13 0 "[ . 1 . 2]" 1
1857 1 90 ASP HA 1 91 PRO HG2 . . 4.750 4.385 4.211 4.572 . 0 0 "[ . 1 . 2]" 1
1858 1 90 ASP HA 1 92 GLU H . . 4.190 3.411 3.107 3.665 . 0 0 "[ . 1 . 2]" 1
1859 1 90 ASP HA 1 93 GLY H . . 5.000 4.143 3.659 4.623 . 0 0 "[ . 1 . 2]" 1
1860 1 90 ASP HB2 1 94 GLU H . . 4.060 3.293 2.527 3.763 . 0 0 "[ . 1 . 2]" 1
1861 1 90 ASP HB2 1 94 GLU HB2 . . 4.280 3.534 2.453 4.310 0.030 3 0 "[ . 1 . 2]" 1
1862 1 90 ASP HB2 1 95 GLY H . . 4.160 3.942 2.672 4.250 0.090 3 0 "[ . 1 . 2]" 1
1863 1 90 ASP HB3 1 92 GLU H . . 4.560 4.090 3.531 4.629 0.069 2 0 "[ . 1 . 2]" 1
1864 1 90 ASP HB3 1 93 GLY H . . 4.900 3.059 2.411 3.511 . 0 0 "[ . 1 . 2]" 1
1865 1 90 ASP HB3 1 93 GLY HA3 . . 4.920 2.936 2.391 3.846 . 0 0 "[ . 1 . 2]" 1
1866 1 90 ASP HB3 1 94 GLU H . . 3.410 2.195 1.937 2.568 . 0 0 "[ . 1 . 2]" 1
1867 1 90 ASP HB3 1 95 GLY H . . 3.790 3.046 2.544 3.786 . 0 0 "[ . 1 . 2]" 1
1868 1 91 PRO HA 1 95 GLY HA2 . . 4.470 4.496 4.279 4.553 0.083 15 0 "[ . 1 . 2]" 1
1869 1 91 PRO HA 1 95 GLY HA3 . . 3.740 2.821 2.539 2.965 . 0 0 "[ . 1 . 2]" 1
1870 1 91 PRO HB2 1 92 GLU H . . 4.660 3.508 3.148 3.826 . 0 0 "[ . 1 . 2]" 1
1871 1 91 PRO HD2 1 92 GLU H . . 4.820 2.954 2.742 3.215 . 0 0 "[ . 1 . 2]" 1
1872 1 91 PRO HD3 1 92 GLU H . . 4.200 4.036 3.896 4.184 . 0 0 "[ . 1 . 2]" 1
1873 1 91 PRO HG2 1 92 GLU H . . 4.120 3.200 2.697 3.659 . 0 0 "[ . 1 . 2]" 1
1874 1 92 GLU H 1 92 GLU HB2 . . 3.370 3.082 2.697 3.451 0.081 6 0 "[ . 1 . 2]" 1
1875 1 92 GLU H 1 92 GLU HG2 . . 3.420 3.397 2.088 4.411 0.991 15 4 "[ * 1* + - 2]" 1
1876 1 92 GLU H 1 93 GLY H . . 3.160 2.336 2.043 2.609 . 0 0 "[ . 1 . 2]" 1
1877 1 92 GLU H 1 95 GLY H . . 4.550 4.507 4.175 4.626 0.076 5 0 "[ . 1 . 2]" 1
1878 1 92 GLU HA 1 92 GLU HG2 . . 4.050 3.266 2.714 4.151 0.101 6 0 "[ . 1 . 2]" 1
1879 1 92 GLU HB2 1 93 GLY H . . 4.530 4.029 3.520 4.358 . 0 0 "[ . 1 . 2]" 1
1880 1 93 GLY H 1 94 GLU H . . 4.020 3.007 2.414 3.567 . 0 0 "[ . 1 . 2]" 1
1881 1 93 GLY H 1 94 GLU HB2 . . 5.340 5.095 4.735 5.398 0.058 3 0 "[ . 1 . 2]" 1
1882 1 93 GLY H 1 95 GLY H . . 3.730 3.008 2.734 3.569 . 0 0 "[ . 1 . 2]" 1
1883 1 93 GLY HA2 1 94 GLU H . . 3.640 3.504 3.267 3.638 . 0 0 "[ . 1 . 2]" 1
1884 1 93 GLY HA3 1 94 GLU H . . 2.860 2.320 2.128 2.592 . 0 0 "[ . 1 . 2]" 1
1885 1 93 GLY HA3 1 94 GLU HB2 . . 4.810 4.441 4.114 4.789 . 0 0 "[ . 1 . 2]" 1
1886 1 93 GLY HA3 1 94 GLU HG2 . . 4.860 4.067 3.444 5.103 0.243 13 0 "[ . 1 . 2]" 1
1887 1 93 GLY HA3 1 95 GLY H . . 4.670 4.149 3.866 4.582 . 0 0 "[ . 1 . 2]" 1
1888 1 94 GLU H 1 94 GLU HB2 . . 3.160 2.310 2.141 2.642 . 0 0 "[ . 1 . 2]" 1
1889 1 94 GLU H 1 94 GLU HB3 . . 3.700 3.562 3.446 3.752 0.052 1 0 "[ . 1 . 2]" 1
1890 1 94 GLU H 1 94 GLU HG2 . . 3.490 2.930 2.433 3.853 0.363 20 0 "[ . 1 . 2]" 1
1891 1 94 GLU H 1 94 GLU HG3 . . 3.770 3.488 2.560 3.852 0.082 9 0 "[ . 1 . 2]" 1
1892 1 94 GLU H 1 95 GLY H . . 3.490 2.492 2.012 2.942 . 0 0 "[ . 1 . 2]" 1
1893 1 94 GLU HA 1 94 GLU HG2 . . 3.550 2.538 2.136 3.090 . 0 0 "[ . 1 . 2]" 1
1894 1 94 GLU HA 1 94 GLU HG3 . . 4.040 3.546 2.701 3.760 . 0 0 "[ . 1 . 2]" 1
1895 1 94 GLU HA 1 96 TRP H . . 4.170 3.514 3.098 3.907 . 0 0 "[ . 1 . 2]" 1
1896 1 94 GLU HA 1 96 TRP HD1 . . 2.880 2.552 2.070 2.946 0.066 2 0 "[ . 1 . 2]" 1
1897 1 94 GLU HA 1 96 TRP HE1 . . 4.260 3.582 2.733 4.169 . 0 0 "[ . 1 . 2]" 1
1898 1 94 GLU HB2 1 94 GLU HG2 . . 3.050 2.681 2.403 3.025 . 0 0 "[ . 1 . 2]" 1
1899 1 94 GLU HB2 1 95 GLY H . . 4.250 3.259 2.963 3.699 . 0 0 "[ . 1 . 2]" 1
1900 1 94 GLU HB3 1 94 GLU HG3 . . 2.820 2.672 2.435 3.035 0.215 1 0 "[ . 1 . 2]" 1
1901 1 94 GLU HB3 1 95 GLY H . . 4.670 3.957 3.511 4.237 . 0 0 "[ . 1 . 2]" 1
1902 1 95 GLY H 1 96 TRP H . . 3.790 3.274 2.902 3.610 . 0 0 "[ . 1 . 2]" 1
1903 1 95 GLY H 1 96 TRP HD1 . . 4.860 4.338 3.917 4.539 . 0 0 "[ . 1 . 2]" 1
1904 1 96 TRP H 1 96 TRP HB2 . . 3.960 3.655 3.593 3.716 . 0 0 "[ . 1 . 2]" 1
1905 1 96 TRP H 1 96 TRP HB3 . . 3.650 2.768 2.597 2.954 . 0 0 "[ . 1 . 2]" 1
1906 1 96 TRP H 1 96 TRP HD1 . . 2.850 2.171 1.935 2.365 . 0 0 "[ . 1 . 2]" 1
1907 1 96 TRP H 1 96 TRP HE1 . . 4.630 4.210 4.049 4.357 . 0 0 "[ . 1 . 2]" 1
1908 1 96 TRP HA 1 97 LEU H . . 2.900 2.443 2.290 2.553 . 0 0 "[ . 1 . 2]" 1
1909 1 96 TRP HA 1 97 LEU HB2 . . 4.980 4.872 4.650 5.053 0.073 18 0 "[ . 1 . 2]" 1
1910 1 96 TRP HA 1 97 LEU MD2 . . 5.340 5.039 4.742 5.408 0.068 1 0 "[ . 1 . 2]" 1
1911 1 96 TRP HA 1 97 LEU HG . . 4.940 3.604 3.339 3.985 . 0 0 "[ . 1 . 2]" 1
1912 1 96 TRP HA 1 98 PHE H . . 5.450 4.797 4.520 5.093 . 0 0 "[ . 1 . 2]" 1
1913 1 96 TRP HB2 1 96 TRP HE3 . . 3.340 2.642 2.565 2.938 . 0 0 "[ . 1 . 2]" 1
1914 1 96 TRP HB2 1 97 LEU H . . 3.600 2.507 2.320 2.829 . 0 0 "[ . 1 . 2]" 1
1915 1 96 TRP HB3 1 96 TRP HD1 . . 3.420 2.719 2.620 2.839 . 0 0 "[ . 1 . 2]" 1
1916 1 96 TRP HB3 1 97 LEU H . . 4.160 3.842 3.687 4.050 . 0 0 "[ . 1 . 2]" 1
1917 1 96 TRP HE3 1 97 LEU H . . 4.050 3.317 3.058 3.535 . 0 0 "[ . 1 . 2]" 1
1918 1 96 TRP HE3 1 98 PHE H . . 3.250 3.014 2.798 3.309 0.059 10 0 "[ . 1 . 2]" 1
1919 1 96 TRP HE3 1 98 PHE HA . . 3.720 2.858 2.689 3.008 . 0 0 "[ . 1 . 2]" 1
1920 1 96 TRP HE3 1 99 LYS H . . 4.630 4.267 3.870 4.637 0.007 16 0 "[ . 1 . 2]" 1
1921 1 96 TRP HH2 1 98 PHE HA . . 4.750 4.580 4.398 4.770 0.020 11 0 "[ . 1 . 2]" 1
1922 1 96 TRP HZ3 1 98 PHE HA . . 3.020 2.254 2.063 2.454 . 0 0 "[ . 1 . 2]" 1
1923 1 96 TRP HZ3 1 98 PHE HB3 . . 4.770 4.608 4.390 4.820 0.050 11 0 "[ . 1 . 2]" 1
1924 1 96 TRP HZ3 1 99 LYS H . . 3.910 3.164 2.771 3.471 . 0 0 "[ . 1 . 2]" 1
1925 1 96 TRP HZ3 1 99 LYS HG3 . . 3.490 2.711 2.269 3.389 . 0 0 "[ . 1 . 2]" 1
1926 1 97 LEU H 1 97 LEU HB2 . . 3.350 2.673 2.482 2.863 . 0 0 "[ . 1 . 2]" 1
1927 1 97 LEU H 1 97 LEU HB3 . . 4.090 3.758 3.645 3.879 . 0 0 "[ . 1 . 2]" 1
1928 1 97 LEU H 1 97 LEU MD1 . . 4.450 3.123 2.866 3.389 . 0 0 "[ . 1 . 2]" 1
1929 1 97 LEU H 1 97 LEU MD2 . . 4.790 4.239 4.011 4.392 . 0 0 "[ . 1 . 2]" 1
1930 1 97 LEU H 1 97 LEU HG . . 3.680 2.848 2.621 3.047 . 0 0 "[ . 1 . 2]" 1
1931 1 97 LEU H 1 98 PHE H . . 3.120 2.423 2.190 2.639 . 0 0 "[ . 1 . 2]" 1
1932 1 97 LEU HA 1 97 LEU MD1 . . 4.540 3.954 3.904 3.992 . 0 0 "[ . 1 . 2]" 1
1933 1 97 LEU HA 1 97 LEU MD2 . . 3.190 2.917 2.598 3.268 0.078 15 0 "[ . 1 . 2]" 1
1934 1 97 LEU HA 1 97 LEU HG . . 3.950 2.891 2.742 3.002 . 0 0 "[ . 1 . 2]" 1
1935 1 97 LEU HA 1 98 PHE QD . . 4.750 4.569 4.167 4.830 0.080 7 0 "[ . 1 . 2]" 1
1936 1 97 LEU HB2 1 97 LEU MD1 . . 3.320 2.099 2.015 2.156 . 0 0 "[ . 1 . 2]" 1
1937 1 97 LEU HB2 1 98 PHE H . . 3.240 2.271 1.920 2.603 . 0 0 "[ . 1 . 2]" 1
1938 1 97 LEU HB2 1 98 PHE QD . . 3.250 2.637 2.134 3.245 . 0 0 "[ . 1 . 2]" 1
1939 1 97 LEU HB3 1 97 LEU MD1 . . 3.420 2.793 2.573 3.002 . 0 0 "[ . 1 . 2]" 1
1940 1 97 LEU HB3 1 97 LEU MD2 . . 3.290 2.248 2.065 2.339 . 0 0 "[ . 1 . 2]" 1
1941 1 97 LEU HB3 1 98 PHE H . . 3.820 3.506 3.183 3.868 0.048 19 0 "[ . 1 . 2]" 1
1942 1 97 LEU HB3 1 98 PHE QD . . 2.960 2.783 2.182 3.039 0.079 17 0 "[ . 1 . 2]" 1
1943 1 97 LEU MD1 1 98 PHE H . . 5.290 3.619 3.288 3.780 . 0 0 "[ . 1 . 2]" 1
1944 1 97 LEU MD1 1 98 PHE QD . . 4.770 3.608 3.094 4.346 . 0 0 "[ . 1 . 2]" 1
1945 1 97 LEU MD1 1 98 PHE QE . . 4.760 3.406 2.375 4.138 . 0 0 "[ . 1 . 2]" 1
1946 1 97 LEU MD2 1 98 PHE QD . . 4.940 4.165 3.768 4.495 . 0 0 "[ . 1 . 2]" 1
1947 1 97 LEU MD2 1 98 PHE QE . . 5.480 4.646 3.956 5.047 . 0 0 "[ . 1 . 2]" 1
1948 1 97 LEU HG 1 98 PHE H . . 5.090 4.391 4.177 4.643 . 0 0 "[ . 1 . 2]" 1
1949 1 98 PHE H 1 98 PHE QD . . 3.810 3.148 2.772 3.404 . 0 0 "[ . 1 . 2]" 1
1950 1 98 PHE H 1 99 LYS H . . 5.120 4.404 4.288 4.494 . 0 0 "[ . 1 . 2]" 1
1951 1 98 PHE HA 1 99 LYS H . . 3.060 2.498 2.268 2.654 . 0 0 "[ . 1 . 2]" 1
1952 1 98 PHE HB2 1 99 LYS H . . 3.230 2.290 2.061 2.737 . 0 0 "[ . 1 . 2]" 1
1953 1 98 PHE HB3 1 99 LYS H . . 3.910 3.695 3.521 3.970 0.060 13 0 "[ . 1 . 2]" 1
1954 1 98 PHE QD 1 99 LYS H . . 3.840 3.053 2.784 3.347 . 0 0 "[ . 1 . 2]" 1
1955 1 98 PHE QD 1 99 LYS HA . . 4.760 3.503 3.005 4.224 . 0 0 "[ . 1 . 2]" 1
1956 1 98 PHE QD 1 100 MET H . . 5.480 4.208 3.844 4.856 . 0 0 "[ . 1 . 2]" 1
1957 1 98 PHE QD 1 100 MET QB . . 3.650 3.142 2.611 3.568 . 0 0 "[ . 1 . 2]" 1
1958 1 98 PHE QD 1 100 MET ME . . 5.260 4.915 4.270 5.339 0.079 11 0 "[ . 1 . 2]" 1
1959 1 98 PHE QD 1 100 MET QG . . 5.120 2.788 2.330 3.504 . 0 0 "[ . 1 . 2]" 1
1960 1 98 PHE QE 1 100 MET QB . . 4.570 3.166 2.546 3.987 . 0 0 "[ . 1 . 2]" 1
1961 1 98 PHE QE 1 100 MET ME . . 4.320 3.673 2.800 4.143 . 0 0 "[ . 1 . 2]" 1
1962 1 98 PHE QE 1 100 MET QG . . 3.960 2.536 2.187 3.252 . 0 0 "[ . 1 . 2]" 1
1963 1 99 LYS H 1 99 LYS HB2 . . 3.510 2.766 2.456 2.952 . 0 0 "[ . 1 . 2]" 1
1964 1 99 LYS H 1 99 LYS HB3 . . 3.850 3.807 3.611 3.910 0.060 1 0 "[ . 1 . 2]" 1
1965 1 99 LYS H 1 99 LYS HG2 . . 4.660 4.079 3.510 4.587 . 0 0 "[ . 1 . 2]" 1
1966 1 99 LYS H 1 99 LYS HG3 . . 3.930 3.280 2.903 3.755 . 0 0 "[ . 1 . 2]" 1
1967 1 99 LYS HA 1 99 LYS HG2 . . 3.750 2.619 2.387 2.875 . 0 0 "[ . 1 . 2]" 1
1968 1 99 LYS HA 1 100 MET H . . 2.790 2.274 2.129 2.343 . 0 0 "[ . 1 . 2]" 1
1969 1 99 LYS HA 1 100 MET QG . . 4.500 3.155 2.848 3.578 . 0 0 "[ . 1 . 2]" 1
1970 1 99 LYS HB2 1 100 MET H . . 4.170 3.806 3.597 4.236 0.066 10 0 "[ . 1 . 2]" 1
1971 1 99 LYS HB3 1 100 MET H . . 3.680 2.737 2.537 3.297 . 0 0 "[ . 1 . 2]" 1
1972 1 100 MET H 1 100 MET QG . . 3.430 2.287 1.985 2.515 . 0 0 "[ . 1 . 2]" 1
1973 1 100 MET H 1 101 GLU H . . 4.540 4.335 4.246 4.429 . 0 0 "[ . 1 . 2]" 1
1974 1 100 MET HA 1 100 MET ME . . 4.630 4.224 3.954 4.447 . 0 0 "[ . 1 . 2]" 1
1975 1 100 MET HA 1 101 GLU H . . 2.570 2.196 2.134 2.284 . 0 0 "[ . 1 . 2]" 1
1976 1 100 MET HA 1 101 GLU HA . . 4.870 4.424 4.333 4.495 . 0 0 "[ . 1 . 2]" 1
1977 1 100 MET HA 1 101 GLU QB . . 4.970 4.002 3.864 4.159 . 0 0 "[ . 1 . 2]" 1
1978 1 100 MET QB 1 100 MET ME . . 2.890 2.024 1.891 2.136 . 0 0 "[ . 1 . 2]" 1
1979 1 100 MET QB 1 101 GLU H . . 3.690 2.837 2.656 2.985 . 0 0 "[ . 1 . 2]" 1
1980 1 100 MET ME 1 100 MET QG . . 3.440 2.657 2.325 2.896 . 0 0 "[ . 1 . 2]" 1
1981 1 100 MET ME 1 101 GLU H . . 4.520 4.285 4.023 4.599 0.079 14 0 "[ . 1 . 2]" 1
1982 1 100 MET ME 1 102 ILE MG . . 3.960 3.502 2.556 4.092 0.132 3 0 "[ . 1 . 2]" 1
1983 1 100 MET ME 1 103 SER H . . 4.740 4.329 3.431 4.836 0.096 14 0 "[ . 1 . 2]" 1
1984 1 101 GLU H 1 101 GLU QB . . 3.020 2.177 2.032 2.298 . 0 0 "[ . 1 . 2]" 1
1985 1 101 GLU H 1 101 GLU HG2 . . 4.830 4.374 4.213 4.482 . 0 0 "[ . 1 . 2]" 1
1986 1 101 GLU H 1 101 GLU HG3 . . 4.840 4.446 4.386 4.527 . 0 0 "[ . 1 . 2]" 1
1987 1 101 GLU H 1 102 ILE H . . 5.160 4.526 4.398 4.624 . 0 0 "[ . 1 . 2]" 1
1988 1 101 GLU HA 1 101 GLU HG2 . . 3.810 3.023 2.644 3.277 . 0 0 "[ . 1 . 2]" 1
1989 1 101 GLU HA 1 101 GLU HG3 . . 3.730 2.594 2.393 2.770 . 0 0 "[ . 1 . 2]" 1
1990 1 101 GLU HA 1 102 ILE H . . 2.720 2.226 2.125 2.318 . 0 0 "[ . 1 . 2]" 1
1991 1 101 GLU HA 1 102 ILE HG12 . . 4.330 3.998 3.712 4.219 . 0 0 "[ . 1 . 2]" 1
1992 1 101 GLU HA 1 102 ILE HG13 . . 4.960 4.614 4.158 5.044 0.084 1 0 "[ . 1 . 2]" 1
1993 1 101 GLU HA 1 102 ILE MG . . 4.340 4.054 3.786 4.430 0.090 9 0 "[ . 1 . 2]" 1
1994 1 101 GLU QB 1 102 ILE H . . 4.460 3.782 3.559 3.992 . 0 0 "[ . 1 . 2]" 1
1995 1 101 GLU HG2 1 102 ILE H . . 5.000 2.992 2.288 3.583 . 0 0 "[ . 1 . 2]" 1
1996 1 101 GLU HG2 1 102 ILE HG13 . . 4.830 4.381 3.781 4.909 0.079 20 0 "[ . 1 . 2]" 1
1997 1 101 GLU HG3 1 102 ILE H . . 4.720 3.332 2.860 3.834 . 0 0 "[ . 1 . 2]" 1
1998 1 102 ILE H 1 102 ILE HB . . 3.540 3.610 3.589 3.623 0.083 8 0 "[ . 1 . 2]" 1
1999 1 102 ILE H 1 102 ILE MD . . 4.190 3.728 3.519 3.793 . 0 0 "[ . 1 . 2]" 1
2000 1 102 ILE H 1 102 ILE HG12 . . 3.490 2.175 1.885 2.362 . 0 0 "[ . 1 . 2]" 1
2001 1 102 ILE H 1 102 ILE HG13 . . 3.520 2.528 2.197 3.053 . 0 0 "[ . 1 . 2]" 1
2002 1 102 ILE H 1 102 ILE MG . . 3.420 2.781 2.467 3.014 . 0 0 "[ . 1 . 2]" 1
2003 1 102 ILE HA 1 102 ILE HG12 . . 3.750 3.805 3.750 3.831 0.081 13 0 "[ . 1 . 2]" 1
2004 1 102 ILE HA 1 102 ILE MG . . 3.190 2.204 2.138 2.293 . 0 0 "[ . 1 . 2]" 1
2005 1 102 ILE HA 1 103 SER H . . 2.880 2.177 2.094 2.322 . 0 0 "[ . 1 . 2]" 1
2006 1 102 ILE HA 1 104 ASP H . . 4.690 3.457 3.145 3.999 . 0 0 "[ . 1 . 2]" 1
2007 1 102 ILE HB 1 102 ILE MD . . 3.240 2.367 2.161 2.536 . 0 0 "[ . 1 . 2]" 1
2008 1 102 ILE HB 1 103 SER H . . 3.750 3.507 2.619 3.832 0.082 2 0 "[ . 1 . 2]" 1
2009 1 102 ILE HB 1 104 ASP H . . 4.190 3.074 2.738 3.300 . 0 0 "[ . 1 . 2]" 1
2010 1 102 ILE MD 1 104 ASP H . . 5.080 4.581 4.070 4.923 . 0 0 "[ . 1 . 2]" 1
2011 1 102 ILE MD 1 105 GLU H . . 5.500 3.795 2.994 4.400 . 0 0 "[ . 1 . 2]" 1
2012 1 102 ILE MD 1 105 GLU HA . . 3.750 3.027 2.605 3.829 0.079 18 0 "[ . 1 . 2]" 1
2013 1 102 ILE MD 1 105 GLU HB2 . . 5.040 2.124 1.963 2.389 . 0 0 "[ . 1 . 2]" 1
2014 1 102 ILE HG13 1 103 SER H . . 5.500 4.711 4.086 4.951 . 0 0 "[ . 1 . 2]" 1
2015 1 102 ILE HG13 1 104 ASP H . . 5.090 4.840 4.175 5.162 0.072 16 0 "[ . 1 . 2]" 1
2016 1 102 ILE HG13 1 105 GLU HB2 . . 4.310 4.355 4.083 4.400 0.090 20 0 "[ . 1 . 2]" 1
2017 1 102 ILE MG 1 103 SER H . . 4.300 3.863 3.475 4.027 . 0 0 "[ . 1 . 2]" 1
2018 1 102 ILE MG 1 104 ASP H . . 4.190 4.142 3.860 4.282 0.092 1 0 "[ . 1 . 2]" 1
2019 1 102 ILE MG 1 105 GLU HA . . 4.150 4.050 3.543 4.241 0.091 18 0 "[ . 1 . 2]" 1
2020 1 103 SER H 1 103 SER HB2 . . 3.830 2.477 2.135 3.667 . 0 0 "[ . 1 . 2]" 1
2021 1 103 SER H 1 103 SER HB3 . . 3.620 3.440 2.740 3.695 0.075 10 0 "[ . 1 . 2]" 1
2022 1 103 SER H 1 104 ASP H . . 3.200 2.372 1.841 2.754 . 0 0 "[ . 1 . 2]" 1
2023 1 103 SER HB2 1 104 ASP H . . 4.600 3.326 2.814 4.078 . 0 0 "[ . 1 . 2]" 1
2024 1 103 SER HB3 1 104 ASP H . . 4.250 3.863 2.965 4.311 0.061 6 0 "[ . 1 . 2]" 1
2025 1 103 SER HB3 1 104 ASP HB2 . . 5.360 4.928 3.781 5.817 0.457 18 0 "[ . 1 . 2]" 1
2026 1 104 ASP H 1 104 ASP HB2 . . 3.970 2.833 2.462 3.815 . 0 0 "[ . 1 . 2]" 1
2027 1 104 ASP H 1 104 ASP HB3 . . 3.920 3.758 3.459 3.967 0.047 16 0 "[ . 1 . 2]" 1
2028 1 104 ASP H 1 105 GLU H . . 4.830 3.629 3.110 4.171 . 0 0 "[ . 1 . 2]" 1
2029 1 104 ASP HA 1 105 GLU H . . 2.800 2.359 2.204 2.551 . 0 0 "[ . 1 . 2]" 1
2030 1 104 ASP HA 1 105 GLU HA . . 4.760 4.558 4.425 4.799 0.039 14 0 "[ . 1 . 2]" 1
2031 1 104 ASP HA 1 105 GLU HB3 . . 5.120 4.413 4.058 4.681 . 0 0 "[ . 1 . 2]" 1
2032 1 104 ASP HA 1 106 GLY H . . 4.100 3.067 2.631 3.469 . 0 0 "[ . 1 . 2]" 1
2033 1 104 ASP HA 1 107 GLU H . . 5.360 4.327 3.873 4.717 . 0 0 "[ . 1 . 2]" 1
2034 1 104 ASP HB2 1 105 GLU H . . 4.760 4.536 4.262 4.673 . 0 0 "[ . 1 . 2]" 1
2035 1 104 ASP HB2 1 105 GLU HA . . 5.500 5.152 4.798 5.804 0.304 7 0 "[ . 1 . 2]" 1
2036 1 104 ASP HB2 1 106 GLY H . . 4.410 4.237 3.059 4.957 0.547 7 1 "[ . + 1 . 2]" 1
2037 1 104 ASP HB3 1 106 GLY H . . 4.890 3.313 2.312 4.133 . 0 0 "[ . 1 . 2]" 1
2038 1 104 ASP HB3 1 107 GLU H . . 4.570 3.058 1.938 4.354 . 0 0 "[ . 1 . 2]" 1
2039 1 105 GLU H 1 105 GLU HB2 . . 3.900 3.269 2.883 3.590 . 0 0 "[ . 1 . 2]" 1
2040 1 105 GLU H 1 105 GLU HB3 . . 3.240 2.108 1.916 2.337 . 0 0 "[ . 1 . 2]" 1
2041 1 105 GLU H 1 105 GLU QG . . 3.450 3.364 2.995 3.559 0.109 10 0 "[ . 1 . 2]" 1
2042 1 105 GLU H 1 106 GLY H . . 3.470 2.543 2.124 2.829 . 0 0 "[ . 1 . 2]" 1
2043 1 105 GLU HA 1 105 GLU QG . . 3.350 3.093 2.753 3.437 0.087 18 0 "[ . 1 . 2]" 1
2044 1 105 GLU HA 1 107 GLU H . . 4.340 3.907 3.174 4.413 0.073 11 0 "[ . 1 . 2]" 1
2045 1 105 GLU HA 1 108 LEU H . . 4.040 3.513 3.203 3.866 . 0 0 "[ . 1 . 2]" 1
2046 1 105 GLU HA 1 108 LEU QD . . 3.690 2.381 1.763 2.747 . 0 0 "[ . 1 . 2]" 1
2047 1 105 GLU HA 1 108 LEU HG . . 3.610 2.587 1.944 3.727 0.117 14 0 "[ . 1 . 2]" 1
2048 1 105 GLU HB2 1 108 LEU QD . . 3.790 2.882 2.178 3.254 . 0 0 "[ . 1 . 2]" 1
2049 1 105 GLU HB3 1 106 GLY H . . 3.940 3.823 3.161 4.035 0.095 18 0 "[ . 1 . 2]" 1
2050 1 105 GLU HB3 1 108 LEU QD . . 4.530 4.029 3.355 4.398 . 0 0 "[ . 1 . 2]" 1
2051 1 105 GLU QG 1 106 GLY H . . 4.410 3.518 3.099 4.057 . 0 0 "[ . 1 . 2]" 1
2052 1 105 GLU QG 1 108 LEU QD . . 3.870 2.995 2.158 3.827 . 0 0 "[ . 1 . 2]" 1
2053 1 106 GLY H 1 106 GLY QA . . 2.770 2.268 2.180 2.431 . 0 0 "[ . 1 . 2]" 1
2054 1 106 GLY H 1 107 GLU H . . 3.250 2.490 2.125 2.893 . 0 0 "[ . 1 . 2]" 1
2055 1 106 GLY H 1 108 LEU H . . 4.960 4.054 3.567 4.642 . 0 0 "[ . 1 . 2]" 1
2056 1 106 GLY H 1 108 LEU QD . . 4.960 4.369 3.202 4.707 . 0 0 "[ . 1 . 2]" 1
2057 1 106 GLY QA 1 107 GLU H . . 3.570 2.818 2.505 2.996 . 0 0 "[ . 1 . 2]" 1
2058 1 106 GLY QA 1 108 LEU H . . 4.260 3.695 3.213 4.132 . 0 0 "[ . 1 . 2]" 1
2059 1 106 GLY QA 1 109 GLU H . . 4.620 3.951 3.556 4.245 . 0 0 "[ . 1 . 2]" 1
2060 1 106 GLY QA 1 109 GLU HG2 . . 5.270 4.440 3.447 5.333 0.063 8 0 "[ . 1 . 2]" 1
2061 1 106 GLY QA 1 109 GLU HG3 . . 4.840 4.280 3.330 4.917 0.077 4 0 "[ . 1 . 2]" 1
2062 1 107 GLU H 1 107 GLU HB2 . . 2.920 2.313 2.123 2.456 . 0 0 "[ . 1 . 2]" 1
2063 1 107 GLU H 1 107 GLU HB3 . . 3.550 3.536 3.269 3.607 0.057 12 0 "[ . 1 . 2]" 1
2064 1 107 GLU H 1 107 GLU QG . . 3.770 2.781 2.109 3.735 . 0 0 "[ . 1 . 2]" 1
2065 1 107 GLU H 1 108 LEU H . . 3.300 2.659 2.361 3.051 . 0 0 "[ . 1 . 2]" 1
2066 1 107 GLU HA 1 107 GLU QG . . 3.440 2.486 2.080 2.929 . 0 0 "[ . 1 . 2]" 1
2067 1 107 GLU HA 1 109 GLU H . . 4.340 3.760 3.176 4.388 0.048 19 0 "[ . 1 . 2]" 1
2068 1 107 GLU HB2 1 107 GLU QG . . 2.400 2.263 2.164 2.366 . 0 0 "[ . 1 . 2]" 1
2069 1 107 GLU HB2 1 108 LEU H . . 4.270 3.392 2.915 3.923 . 0 0 "[ . 1 . 2]" 1
2070 1 107 GLU HB2 1 108 LEU QD . . 5.340 3.723 3.155 4.926 . 0 0 "[ . 1 . 2]" 1
2071 1 107 GLU HB3 1 108 LEU H . . 4.660 3.975 3.544 4.332 . 0 0 "[ . 1 . 2]" 1
2072 1 107 GLU HB3 1 108 LEU HA . . 5.340 4.535 3.960 4.976 . 0 0 "[ . 1 . 2]" 1
2073 1 107 GLU HB3 1 108 LEU QD . . 5.000 4.342 3.725 4.808 . 0 0 "[ . 1 . 2]" 1
2074 1 108 LEU H 1 108 LEU HB2 . . 3.030 2.677 2.283 3.497 0.467 19 0 "[ . 1 . 2]" 1
2075 1 108 LEU H 1 108 LEU HB3 . . 3.710 3.553 3.118 3.690 . 0 0 "[ . 1 . 2]" 1
2076 1 108 LEU H 1 108 LEU QD . . 4.290 2.449 1.671 2.971 . 0 0 "[ . 1 . 2]" 1
2077 1 108 LEU H 1 108 LEU HG . . 3.240 2.539 1.925 3.337 0.097 15 0 "[ . 1 . 2]" 1
2078 1 108 LEU H 1 109 GLU H . . 3.260 2.767 2.454 3.192 . 0 0 "[ . 1 . 2]" 1
2079 1 108 LEU H 1 111 LEU HG . . 5.480 5.168 4.321 5.576 0.096 2 0 "[ . 1 . 2]" 1
2080 1 108 LEU HA 1 108 LEU QD . . 3.060 2.432 2.094 3.073 0.013 19 0 "[ . 1 . 2]" 1
2081 1 108 LEU HA 1 108 LEU HG . . 3.630 3.302 2.581 3.634 0.004 12 0 "[ . 1 . 2]" 1
2082 1 108 LEU HA 1 110 ASP H . . 4.280 3.865 3.609 4.292 0.012 3 0 "[ . 1 . 2]" 1
2083 1 108 LEU HA 1 111 LEU H . . 4.210 3.555 3.229 3.868 . 0 0 "[ . 1 . 2]" 1
2084 1 108 LEU HA 1 111 LEU QD . . 3.480 2.396 1.951 3.436 . 0 0 "[ . 1 . 2]" 1
2085 1 108 LEU HA 1 111 LEU HG . . 3.760 2.819 2.106 3.709 . 0 0 "[ . 1 . 2]" 1
2086 1 108 LEU HB2 1 108 LEU HG . . 2.970 2.501 2.299 3.042 0.072 18 0 "[ . 1 . 2]" 1
2087 1 108 LEU HB2 1 109 GLU H . . 4.050 2.832 2.442 3.301 . 0 0 "[ . 1 . 2]" 1
2088 1 108 LEU HB2 1 111 LEU H . . 5.380 5.347 4.801 5.463 0.083 10 0 "[ . 1 . 2]" 1
2089 1 108 LEU HB3 1 108 LEU HG . . 2.910 2.866 2.335 2.991 0.081 8 0 "[ . 1 . 2]" 1
2090 1 108 LEU HB3 1 109 GLU H . . 4.390 3.861 3.469 4.217 . 0 0 "[ . 1 . 2]" 1
2091 1 108 LEU HB3 1 109 GLU HA . . 4.850 4.550 4.167 5.641 0.791 12 2 "[ . 1 + . -2]" 1
2092 1 108 LEU QD 1 109 GLU H . . 5.450 4.051 3.459 4.314 . 0 0 "[ . 1 . 2]" 1
2093 1 108 LEU HG 1 109 GLU H . . 5.070 4.363 2.738 5.145 0.075 18 0 "[ . 1 . 2]" 1
2094 1 109 GLU H 1 109 GLU QB . . 2.950 2.352 2.197 2.546 . 0 0 "[ . 1 . 2]" 1
2095 1 109 GLU H 1 109 GLU HG2 . . 3.780 2.684 2.159 3.393 . 0 0 "[ . 1 . 2]" 1
2096 1 109 GLU H 1 109 GLU HG3 . . 3.940 3.338 1.918 3.955 0.015 6 0 "[ . 1 . 2]" 1
2097 1 109 GLU H 1 110 ASP H . . 3.280 2.602 2.440 2.786 . 0 0 "[ . 1 . 2]" 1
2098 1 109 GLU HA 1 109 GLU HG2 . . 3.900 2.862 2.308 4.175 0.275 9 0 "[ . 1 . 2]" 1
2099 1 109 GLU HA 1 109 GLU HG3 . . 4.120 3.671 3.130 3.844 . 0 0 "[ . 1 . 2]" 1
2100 1 109 GLU HA 1 111 LEU H . . 4.010 3.683 3.093 3.959 . 0 0 "[ . 1 . 2]" 1
2101 1 109 GLU QB 1 110 ASP H . . 4.000 3.231 2.822 3.779 . 0 0 "[ . 1 . 2]" 1
2102 1 109 GLU QB 1 110 ASP HA . . 4.820 4.245 3.965 4.665 . 0 0 "[ . 1 . 2]" 1
2103 1 110 ASP H 1 110 ASP QB . . 3.110 2.322 2.069 2.675 . 0 0 "[ . 1 . 2]" 1
2104 1 110 ASP H 1 111 LEU H . . 3.220 2.356 1.954 2.551 . 0 0 "[ . 1 . 2]" 1
2105 1 110 ASP H 1 111 LEU QD . . 5.280 3.899 2.896 4.794 . 0 0 "[ . 1 . 2]" 1
2106 1 110 ASP QB 1 111 LEU H . . 4.250 3.149 2.730 3.607 . 0 0 "[ . 1 . 2]" 1
2107 1 111 LEU H 1 111 LEU HB2 . . 3.000 2.427 2.178 2.670 . 0 0 "[ . 1 . 2]" 1
2108 1 111 LEU H 1 111 LEU QD . . 4.170 2.809 1.784 3.536 . 0 0 "[ . 1 . 2]" 1
2109 1 111 LEU H 1 111 LEU HG . . 3.520 2.921 2.292 3.611 0.091 9 0 "[ . 1 . 2]" 1
2110 1 111 LEU H 1 112 LEU H . . 4.830 4.502 4.336 4.713 . 0 0 "[ . 1 . 2]" 1
2111 1 111 LEU HA 1 111 LEU QD . . 3.070 2.232 2.053 2.413 . 0 0 "[ . 1 . 2]" 1
2112 1 111 LEU HA 1 111 LEU HG . . 3.930 3.481 3.015 3.977 0.047 5 0 "[ . 1 . 2]" 1
2113 1 111 LEU HA 1 112 LEU H . . 3.050 2.510 2.246 2.877 . 0 0 "[ . 1 . 2]" 1
2114 1 111 LEU HA 1 112 LEU QD . . 4.510 3.796 2.570 4.272 . 0 0 "[ . 1 . 2]" 1
2115 1 111 LEU HB2 1 112 LEU H . . 3.500 3.301 2.762 3.582 0.082 17 0 "[ . 1 . 2]" 1
2116 1 111 LEU HB3 1 111 LEU QD . . 2.770 2.139 2.054 2.302 . 0 0 "[ . 1 . 2]" 1
2117 1 111 LEU QD 1 112 LEU H . . 4.070 3.265 2.559 3.653 . 0 0 "[ . 1 . 2]" 1
2118 1 112 LEU H 1 112 LEU HB2 . . 2.840 2.450 2.311 2.882 0.042 5 0 "[ . 1 . 2]" 1
2119 1 112 LEU H 1 112 LEU HB3 . . 3.570 3.575 3.527 3.640 0.070 3 0 "[ . 1 . 2]" 1
2120 1 112 LEU H 1 112 LEU QD . . 4.100 2.835 1.725 3.408 . 0 0 "[ . 1 . 2]" 1
2121 1 112 LEU H 1 112 LEU HG . . 3.620 2.737 2.119 3.714 0.094 17 0 "[ . 1 . 2]" 1
2122 1 112 LEU H 1 113 ASP H . . 4.930 4.492 4.394 4.624 . 0 0 "[ . 1 . 2]" 1
2123 1 112 LEU HA 1 112 LEU QD . . 3.300 2.307 2.168 2.505 . 0 0 "[ . 1 . 2]" 1
2124 1 112 LEU HA 1 112 LEU HG . . 3.960 3.111 2.757 3.812 . 0 0 "[ . 1 . 2]" 1
2125 1 112 LEU HA 1 113 ASP H . . 2.780 2.167 2.050 2.310 . 0 0 "[ . 1 . 2]" 1
2126 1 112 LEU HA 1 116 ALA MB . . 4.020 2.908 2.442 4.036 0.016 15 0 "[ . 1 . 2]" 1
2127 1 112 LEU HB2 1 113 ASP H . . 4.810 4.120 3.798 4.375 . 0 0 "[ . 1 . 2]" 1
2128 1 112 LEU HB2 1 117 TYR H . . 4.920 4.054 3.183 4.974 0.054 15 0 "[ . 1 . 2]" 1
2129 1 112 LEU HB2 1 117 TYR HB2 . . 4.620 2.744 2.288 3.201 . 0 0 "[ . 1 . 2]" 1
2130 1 112 LEU HB2 1 117 TYR HB3 . . 4.900 4.268 3.820 4.773 . 0 0 "[ . 1 . 2]" 1
2131 1 112 LEU HB3 1 113 ASP H . . 3.560 3.258 2.853 3.605 0.045 9 0 "[ . 1 . 2]" 1
2132 1 112 LEU HB3 1 117 TYR H . . 3.820 2.947 2.471 3.469 . 0 0 "[ . 1 . 2]" 1
2133 1 112 LEU HB3 1 117 TYR HA . . 4.700 2.983 2.458 3.430 . 0 0 "[ . 1 . 2]" 1
2134 1 112 LEU HB3 1 117 TYR HB2 . . 4.390 2.927 2.334 3.505 . 0 0 "[ . 1 . 2]" 1
2135 1 112 LEU HB3 1 117 TYR HB3 . . 4.820 3.996 3.586 4.351 . 0 0 "[ . 1 . 2]" 1
2136 1 112 LEU QD 1 113 ASP H . . 4.630 3.707 3.118 4.102 . 0 0 "[ . 1 . 2]" 1
2137 1 112 LEU QD 1 116 ALA MB . . 3.400 2.522 1.988 3.326 . 0 0 "[ . 1 . 2]" 1
2138 1 112 LEU QD 1 117 TYR H . . 4.730 3.820 3.415 4.332 . 0 0 "[ . 1 . 2]" 1
2139 1 112 LEU QD 1 117 TYR HA . . 3.580 2.489 2.110 3.147 . 0 0 "[ . 1 . 2]" 1
2140 1 112 LEU QD 1 117 TYR HB2 . . 4.980 3.129 2.432 3.585 . 0 0 "[ . 1 . 2]" 1
2141 1 112 LEU QD 1 117 TYR HB3 . . 5.340 4.323 3.768 4.792 . 0 0 "[ . 1 . 2]" 1
2142 1 112 LEU QD 1 117 TYR QD . . 4.090 2.948 2.473 3.138 . 0 0 "[ . 1 . 2]" 1
2143 1 112 LEU QD 1 117 TYR QE . . 4.730 4.640 4.224 4.764 0.034 17 0 "[ . 1 . 2]" 1
2144 1 112 LEU QD 1 120 PHE H . . 5.200 3.969 3.296 4.712 . 0 0 "[ . 1 . 2]" 1
2145 1 112 LEU QD 1 120 PHE HB2 . . 4.460 2.772 2.169 3.452 . 0 0 "[ . 1 . 2]" 1
2146 1 112 LEU QD 1 120 PHE HB3 . . 4.520 3.139 2.658 3.569 . 0 0 "[ . 1 . 2]" 1
2147 1 112 LEU QD 1 120 PHE QD . . 5.120 3.100 2.057 3.727 . 0 0 "[ . 1 . 2]" 1
2148 1 113 ASP H 1 113 ASP QB . . 3.580 2.402 2.151 2.865 . 0 0 "[ . 1 . 2]" 1
2149 1 113 ASP H 1 114 GLU H . . 5.070 4.516 4.375 4.640 . 0 0 "[ . 1 . 2]" 1
2150 1 113 ASP H 1 116 ALA MB . . 3.440 2.260 1.931 3.070 . 0 0 "[ . 1 . 2]" 1
2151 1 113 ASP H 1 117 TYR H . . 5.240 4.257 3.817 4.617 . 0 0 "[ . 1 . 2]" 1
2152 1 113 ASP HA 1 114 GLU H . . 2.980 2.514 2.372 2.871 . 0 0 "[ . 1 . 2]" 1
2153 1 113 ASP HA 1 114 GLU HA . . 5.000 4.303 3.978 4.490 . 0 0 "[ . 1 . 2]" 1
2154 1 113 ASP HA 1 115 GLN H . . 5.040 4.762 4.435 5.086 0.046 15 0 "[ . 1 . 2]" 1
2155 1 113 ASP HA 1 116 ALA MB . . 4.360 4.171 3.951 4.477 0.117 15 0 "[ . 1 . 2]" 1
2156 1 113 ASP QB 1 114 GLU H . . 3.070 2.195 2.003 2.684 . 0 0 "[ . 1 . 2]" 1
2157 1 113 ASP QB 1 114 GLU HA . . 4.850 4.409 4.196 4.683 . 0 0 "[ . 1 . 2]" 1
2158 1 113 ASP QB 1 115 GLN H . . 4.440 2.910 2.367 3.531 . 0 0 "[ . 1 . 2]" 1
2159 1 113 ASP QB 1 116 ALA MB . . 5.310 2.578 2.151 3.858 . 0 0 "[ . 1 . 2]" 1
2160 1 114 GLU H 1 114 GLU HB2 . . 3.020 2.459 2.332 2.672 . 0 0 "[ . 1 . 2]" 1
2161 1 114 GLU H 1 114 GLU HB3 . . 3.200 2.480 2.264 2.689 . 0 0 "[ . 1 . 2]" 1
2162 1 114 GLU H 1 114 GLU QG . . 4.060 3.973 3.924 4.034 . 0 0 "[ . 1 . 2]" 1
2163 1 114 GLU H 1 115 GLN H . . 3.540 2.720 2.467 3.032 . 0 0 "[ . 1 . 2]" 1
2164 1 114 GLU H 1 116 ALA H . . 4.660 3.916 3.682 4.143 . 0 0 "[ . 1 . 2]" 1
2165 1 114 GLU H 1 117 TYR H . . 4.390 4.474 4.456 4.486 0.096 14 0 "[ . 1 . 2]" 1
2166 1 114 GLU HA 1 114 GLU QG . . 3.260 2.390 2.201 2.584 . 0 0 "[ . 1 . 2]" 1
2167 1 114 GLU HA 1 117 TYR H . . 4.150 3.433 3.193 3.675 . 0 0 "[ . 1 . 2]" 1
2168 1 114 GLU HA 1 117 TYR HB2 . . 4.140 3.644 3.245 3.932 . 0 0 "[ . 1 . 2]" 1
2169 1 114 GLU HA 1 117 TYR HB3 . . 3.530 2.505 2.305 2.707 . 0 0 "[ . 1 . 2]" 1
2170 1 114 GLU HA 1 118 GLN H . . 4.750 4.257 3.894 4.807 0.057 17 0 "[ . 1 . 2]" 1
2171 1 114 GLU HB2 1 115 GLN H . . 4.070 3.892 3.730 3.992 . 0 0 "[ . 1 . 2]" 1
2172 1 114 GLU HB3 1 114 GLU QG . . 2.560 2.324 2.252 2.390 . 0 0 "[ . 1 . 2]" 1
2173 1 114 GLU HB3 1 115 GLN H . . 2.800 2.580 2.322 2.730 . 0 0 "[ . 1 . 2]" 1
2174 1 114 GLU HB3 1 116 ALA H . . 4.860 4.905 4.630 4.941 0.081 5 0 "[ . 1 . 2]" 1
2175 1 114 GLU QG 1 115 GLN H . . 4.430 3.687 3.390 3.900 . 0 0 "[ . 1 . 2]" 1
2176 1 114 GLU QG 1 115 GLN HA . . 3.920 3.920 3.710 4.020 0.100 17 0 "[ . 1 . 2]" 1
2177 1 114 GLU QG 1 117 TYR QE . . 4.690 4.732 4.279 4.807 0.117 9 0 "[ . 1 . 2]" 1
2178 1 115 GLN H 1 115 GLN HB2 . . 3.130 2.510 1.996 2.928 . 0 0 "[ . 1 . 2]" 1
2179 1 115 GLN H 1 115 GLN HB3 . . 3.160 2.273 2.063 2.877 . 0 0 "[ . 1 . 2]" 1
2180 1 115 GLN H 1 115 GLN QG . . 3.650 3.749 3.728 3.761 0.111 11 0 "[ . 1 . 2]" 1
2181 1 115 GLN H 1 116 ALA H . . 2.980 2.587 2.382 2.808 . 0 0 "[ . 1 . 2]" 1
2182 1 115 GLN H 1 116 ALA MB . . 4.730 4.272 4.044 4.485 . 0 0 "[ . 1 . 2]" 1
2183 1 115 GLN HA 1 115 GLN HB2 . . 2.820 2.448 2.316 2.674 . 0 0 "[ . 1 . 2]" 1
2184 1 115 GLN HA 1 115 GLN HB3 . . 3.010 3.038 2.990 3.065 0.055 9 0 "[ . 1 . 2]" 1
2185 1 115 GLN HA 1 115 GLN QG . . 3.290 2.595 2.177 3.308 0.018 2 0 "[ . 1 . 2]" 1
2186 1 115 GLN HA 1 117 TYR H . . 5.070 4.428 4.222 4.622 . 0 0 "[ . 1 . 2]" 1
2187 1 115 GLN HA 1 118 GLN H . . 3.890 3.460 3.109 3.773 . 0 0 "[ . 1 . 2]" 1
2188 1 115 GLN HA 1 118 GLN QG . . 4.580 3.312 2.250 4.204 . 0 0 "[ . 1 . 2]" 1
2189 1 115 GLN HA 1 119 GLU H . . 4.580 4.277 3.855 4.618 0.038 7 0 "[ . 1 . 2]" 1
2190 1 115 GLN HB2 1 115 GLN QG . . 2.400 2.360 2.253 2.439 0.039 18 0 "[ . 1 . 2]" 1
2191 1 115 GLN HB2 1 116 ALA H . . 4.200 3.898 3.563 4.138 . 0 0 "[ . 1 . 2]" 1
2192 1 115 GLN HB3 1 115 GLN QG . . 2.640 2.303 2.105 2.460 . 0 0 "[ . 1 . 2]" 1
2193 1 115 GLN HB3 1 116 ALA H . . 3.350 2.629 2.436 2.913 . 0 0 "[ . 1 . 2]" 1
2194 1 115 GLN HB3 1 116 ALA MB . . 4.220 3.982 3.434 4.314 0.094 1 0 "[ . 1 . 2]" 1
2195 1 115 GLN QG 1 116 ALA H . . 4.240 3.404 2.979 4.209 . 0 0 "[ . 1 . 2]" 1
2196 1 115 GLN QG 1 116 ALA HA . . 4.530 3.599 2.959 4.607 0.077 18 0 "[ . 1 . 2]" 1
2197 1 115 GLN QG 1 116 ALA MB . . 5.200 4.064 3.342 5.089 . 0 0 "[ . 1 . 2]" 1
2198 1 116 ALA H 1 116 ALA MB . . 2.790 2.230 2.043 2.288 . 0 0 "[ . 1 . 2]" 1
2199 1 116 ALA H 1 117 TYR H . . 3.170 2.655 2.482 2.831 . 0 0 "[ . 1 . 2]" 1
2200 1 116 ALA HA 1 119 GLU H . . 3.710 3.315 3.027 3.647 . 0 0 "[ . 1 . 2]" 1
2201 1 116 ALA HA 1 119 GLU QB . . 3.250 2.494 2.052 3.005 . 0 0 "[ . 1 . 2]" 1
2202 1 116 ALA HA 1 119 GLU QG . . 5.060 4.004 2.488 5.072 0.012 6 0 "[ . 1 . 2]" 1
2203 1 116 ALA MB 1 117 TYR H . . 3.560 2.687 2.533 2.947 . 0 0 "[ . 1 . 2]" 1
2204 1 116 ALA MB 1 117 TYR HA . . 5.500 4.028 3.886 4.372 . 0 0 "[ . 1 . 2]" 1
2205 1 116 ALA MB 1 119 GLU H . . 5.500 4.603 4.361 4.861 . 0 0 "[ . 1 . 2]" 1
2206 1 117 TYR H 1 117 TYR HB2 . . 3.250 2.710 2.513 2.893 . 0 0 "[ . 1 . 2]" 1
2207 1 117 TYR H 1 117 TYR HB3 . . 3.170 2.193 2.045 2.327 . 0 0 "[ . 1 . 2]" 1
2208 1 117 TYR H 1 117 TYR QD . . 4.430 4.051 3.881 4.186 . 0 0 "[ . 1 . 2]" 1
2209 1 117 TYR H 1 118 GLN H . . 3.270 2.748 2.586 2.939 . 0 0 "[ . 1 . 2]" 1
2210 1 117 TYR H 1 119 GLU H . . 4.910 4.248 4.000 4.458 . 0 0 "[ . 1 . 2]" 1
2211 1 117 TYR HA 1 117 TYR QD . . 3.560 2.652 2.410 2.896 . 0 0 "[ . 1 . 2]" 1
2212 1 117 TYR HA 1 119 GLU H . . 4.940 4.572 4.321 4.923 . 0 0 "[ . 1 . 2]" 1
2213 1 117 TYR HA 1 120 PHE H . . 4.160 3.369 3.032 3.763 . 0 0 "[ . 1 . 2]" 1
2214 1 117 TYR HA 1 120 PHE HB2 . . 3.930 3.362 2.465 3.997 0.067 10 0 "[ . 1 . 2]" 1
2215 1 117 TYR HA 1 120 PHE HB3 . . 3.430 2.912 2.447 3.344 . 0 0 "[ . 1 . 2]" 1
2216 1 117 TYR HB2 1 118 GLN H . . 4.060 4.051 3.860 4.130 0.070 15 0 "[ . 1 . 2]" 1
2217 1 117 TYR HB3 1 118 GLN H . . 3.240 2.749 2.459 2.900 . 0 0 "[ . 1 . 2]" 1
2218 1 117 TYR QD 1 118 GLN H . . 4.680 3.367 3.048 3.957 . 0 0 "[ . 1 . 2]" 1
2219 1 117 TYR QD 1 118 GLN HA . . 5.140 4.061 3.689 4.540 . 0 0 "[ . 1 . 2]" 1
2220 1 117 TYR QD 1 120 PHE QD . . 4.920 3.939 2.809 4.723 . 0 0 "[ . 1 . 2]" 1
2221 1 118 GLN H 1 118 GLN HB3 . . 3.020 2.374 1.976 3.676 0.656 17 4 "[ . 1* *. + -]" 1
2222 1 118 GLN H 1 118 GLN QG . . 3.840 3.234 1.935 3.645 . 0 0 "[ . 1 . 2]" 1
2223 1 118 GLN H 1 119 GLU H . . 3.310 2.770 2.439 3.010 . 0 0 "[ . 1 . 2]" 1
2224 1 118 GLN HA 1 118 GLN QG . . 3.670 3.031 2.691 3.289 . 0 0 "[ . 1 . 2]" 1
2225 1 118 GLN HA 1 121 CYS H . . 4.200 3.406 3.195 3.760 . 0 0 "[ . 1 . 2]" 1
2226 1 118 GLN HA 1 121 CYS QB . . 3.490 2.727 2.141 3.164 . 0 0 "[ . 1 . 2]" 1
2227 1 118 GLN HA 1 122 ALA H . . 5.130 4.705 4.022 5.189 0.059 20 0 "[ . 1 . 2]" 1
2228 1 118 GLN HB2 1 119 GLU H . . 4.190 3.817 2.475 4.244 0.054 7 0 "[ . 1 . 2]" 1
2229 1 118 GLN HB3 1 119 GLU H . . 3.770 3.272 2.709 4.068 0.298 20 0 "[ . 1 . 2]" 1
2230 1 118 GLN HB3 1 119 GLU HA . . 5.160 5.156 4.728 5.235 0.075 1 0 "[ . 1 . 2]" 1
2231 1 118 GLN QG 1 119 GLU H . . 3.430 2.645 2.190 3.392 . 0 0 "[ . 1 . 2]" 1
2232 1 119 GLU H 1 119 GLU QB . . 2.790 2.150 1.997 2.740 . 0 0 "[ . 1 . 2]" 1
2233 1 119 GLU H 1 119 GLU QG . . 3.680 3.472 2.170 3.793 0.113 7 0 "[ . 1 . 2]" 1
2234 1 119 GLU H 1 120 PHE H . . 3.070 2.901 2.727 3.120 0.050 18 0 "[ . 1 . 2]" 1
2235 1 119 GLU H 1 122 ALA MB . . 5.500 4.898 4.542 5.459 . 0 0 "[ . 1 . 2]" 1
2236 1 119 GLU HA 1 119 GLU QG . . 3.450 2.466 2.119 3.258 . 0 0 "[ . 1 . 2]" 1
2237 1 119 GLU HA 1 122 ALA H . . 3.860 3.456 2.755 3.916 0.056 8 0 "[ . 1 . 2]" 1
2238 1 119 GLU HA 1 122 ALA MB . . 3.350 2.825 2.334 3.437 0.087 5 0 "[ . 1 . 2]" 1
2239 1 119 GLU HA 1 123 GLN H . . 5.160 4.926 4.181 5.236 0.076 17 0 "[ . 1 . 2]" 1
2240 1 119 GLU QB 1 120 PHE H . . 3.330 2.652 2.309 3.217 . 0 0 "[ . 1 . 2]" 1
2241 1 120 PHE H 1 120 PHE HB2 . . 3.120 2.412 2.098 2.704 . 0 0 "[ . 1 . 2]" 1
2242 1 120 PHE H 1 120 PHE HB3 . . 3.060 2.616 2.449 2.840 . 0 0 "[ . 1 . 2]" 1
2243 1 120 PHE H 1 120 PHE QD . . 4.720 4.163 3.948 4.304 . 0 0 "[ . 1 . 2]" 1
2244 1 120 PHE H 1 122 ALA H . . 4.860 4.117 3.910 4.340 . 0 0 "[ . 1 . 2]" 1
2245 1 120 PHE HA 1 120 PHE QD . . 3.520 2.385 2.115 2.755 . 0 0 "[ . 1 . 2]" 1
2246 1 120 PHE HA 1 120 PHE QE . . 4.280 4.348 4.173 4.370 0.090 20 0 "[ . 1 . 2]" 1
2247 1 120 PHE HA 1 121 CYS HA . . 5.090 4.781 4.717 4.885 . 0 0 "[ . 1 . 2]" 1
2248 1 120 PHE HA 1 123 GLN H . . 4.180 3.500 2.987 3.885 . 0 0 "[ . 1 . 2]" 1
2249 1 120 PHE HA 1 123 GLN HB2 . . 5.080 3.565 2.169 5.144 0.064 10 0 "[ . 1 . 2]" 1
2250 1 120 PHE HA 1 123 GLN HG2 . . 5.140 3.805 2.172 5.195 0.055 11 0 "[ . 1 . 2]" 1
2251 1 120 PHE HA 1 123 GLN HG3 . . 4.540 3.159 2.254 4.064 . 0 0 "[ . 1 . 2]" 1
2252 1 120 PHE HB2 1 121 CYS H . . 4.030 3.924 3.599 4.107 0.077 6 0 "[ . 1 . 2]" 1
2253 1 120 PHE HB3 1 121 CYS H . . 3.520 2.787 2.329 3.169 . 0 0 "[ . 1 . 2]" 1
2254 1 120 PHE QD 1 121 CYS H . . 4.500 4.136 3.512 4.475 . 0 0 "[ . 1 . 2]" 1
2255 1 121 CYS H 1 121 CYS QB . . 3.220 2.253 2.004 2.457 . 0 0 "[ . 1 . 2]" 1
2256 1 121 CYS H 1 122 ALA H . . 3.300 2.674 2.406 2.939 . 0 0 "[ . 1 . 2]" 1
2257 1 121 CYS H 1 122 ALA MB . . 5.340 4.346 3.954 4.594 . 0 0 "[ . 1 . 2]" 1
2258 1 121 CYS HA 1 123 GLN H . . 4.720 3.901 3.462 4.783 0.063 20 0 "[ . 1 . 2]" 1
2259 1 121 CYS HA 1 124 GLU H . . 5.170 3.745 2.984 4.612 . 0 0 "[ . 1 . 2]" 1
2260 1 121 CYS HA 1 124 GLU HB3 . . 4.880 3.497 2.480 4.821 . 0 0 "[ . 1 . 2]" 1
2261 1 121 CYS QB 1 122 ALA H . . 3.760 3.168 2.523 3.586 . 0 0 "[ . 1 . 2]" 1
2262 1 121 CYS QB 1 122 ALA MB . . 5.390 4.106 3.782 4.838 . 0 0 "[ . 1 . 2]" 1
2263 1 122 ALA H 1 122 ALA MB . . 2.890 2.302 2.237 2.398 . 0 0 "[ . 1 . 2]" 1
2264 1 122 ALA H 1 124 GLU H . . 4.110 4.087 3.357 4.192 0.082 18 0 "[ . 1 . 2]" 1
2265 1 122 ALA HA 1 124 GLU H . . 5.020 3.705 3.021 4.307 . 0 0 "[ . 1 . 2]" 1
2266 1 122 ALA MB 1 123 GLN H . . 4.200 3.028 2.419 3.535 . 0 0 "[ . 1 . 2]" 1
2267 1 122 ALA MB 1 123 GLN HA . . 4.150 4.133 3.817 4.262 0.112 12 0 "[ . 1 . 2]" 1
2268 1 122 ALA MB 1 123 GLN HG2 . . 5.410 3.815 2.817 4.602 . 0 0 "[ . 1 . 2]" 1
2269 1 122 ALA MB 1 123 GLN HG3 . . 5.190 4.444 2.857 5.266 0.076 7 0 "[ . 1 . 2]" 1
2270 1 122 ALA MB 1 124 GLU H . . 5.500 4.449 4.208 4.622 . 0 0 "[ . 1 . 2]" 1
2271 1 123 GLN H 1 123 GLN HB2 . . 3.630 2.817 2.102 3.712 0.082 17 0 "[ . 1 . 2]" 1
2272 1 123 GLN H 1 123 GLN HB3 . . 3.290 3.378 2.939 3.705 0.415 1 0 "[ . 1 . 2]" 1
2273 1 123 GLN H 1 123 GLN HG2 . . 4.030 2.968 1.896 3.962 . 0 0 "[ . 1 . 2]" 1
2274 1 123 GLN H 1 123 GLN HG3 . . 3.820 3.089 2.215 3.887 0.067 16 0 "[ . 1 . 2]" 1
2275 1 123 GLN H 1 124 GLU H . . 3.250 2.553 1.992 3.296 0.046 20 0 "[ . 1 . 2]" 1
2276 1 123 GLN HA 1 123 GLN HG2 . . 4.000 2.994 2.302 4.076 0.076 19 0 "[ . 1 . 2]" 1
2277 1 123 GLN HA 1 124 GLU H . . 3.450 3.214 2.629 3.487 0.037 6 0 "[ . 1 . 2]" 1
2278 1 123 GLN HB2 1 123 GLN HG3 . . 2.980 2.442 2.227 2.878 . 0 0 "[ . 1 . 2]" 1
2279 1 123 GLN HB2 1 124 GLU H . . 5.040 4.010 3.404 4.541 . 0 0 "[ . 1 . 2]" 1
2280 1 124 GLU H 1 124 GLU HB2 . . 3.810 2.769 2.343 3.607 . 0 0 "[ . 1 . 2]" 1
2281 1 124 GLU H 1 124 GLU HB3 . . 3.570 2.819 2.431 3.654 0.084 1 0 "[ . 1 . 2]" 1
2282 1 124 GLU H 1 124 GLU QG . . 4.060 3.780 2.164 4.138 0.078 18 0 "[ . 1 . 2]" 1
2283 1 124 GLU HB2 1 124 GLU QG . . 2.400 2.390 2.156 2.577 0.177 14 0 "[ . 1 . 2]" 1
2284 1 124 GLU HB3 1 124 GLU QG . . 2.800 2.326 2.140 2.471 . 0 0 "[ . 1 . 2]" 1
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