NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575755 |
2mdr   |
19502 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mdr
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 2116
_Distance_constraint_stats_list.Viol_count 1630
_Distance_constraint_stats_list.Viol_total 1251.667
_Distance_constraint_stats_list.Viol_max 0.313
_Distance_constraint_stats_list.Viol_rms 0.0108
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0015
_Distance_constraint_stats_list.Viol_average_violations_only 0.0384
_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 25 VAL 0.207 0.079 9 0 "[ . 1 . 2]"
1 27 LYS 1.399 0.208 17 0 "[ . 1 . 2]"
1 28 ILE 1.438 0.093 10 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLU 0.375 0.106 13 0 "[ . 1 . 2]"
1 31 LEU 5.386 0.104 13 0 "[ . 1 . 2]"
1 32 VAL 1.852 0.107 12 0 "[ . 1 . 2]"
1 33 ARG 1.846 0.132 16 0 "[ . 1 . 2]"
1 34 TYR 4.418 0.207 18 0 "[ . 1 . 2]"
1 35 LEU 0.402 0.050 2 0 "[ . 1 . 2]"
1 36 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 THR 0.022 0.007 1 0 "[ . 1 . 2]"
1 38 ASN 0.444 0.116 4 0 "[ . 1 . 2]"
1 39 PRO 0.890 0.053 2 0 "[ . 1 . 2]"
1 40 VAL 0.597 0.116 4 0 "[ . 1 . 2]"
1 41 GLY 0.917 0.096 18 0 "[ . 1 . 2]"
1 42 GLY 0.349 0.095 18 0 "[ . 1 . 2]"
1 43 LEU 0.995 0.058 3 0 "[ . 1 . 2]"
1 44 LEU 0.514 0.042 5 0 "[ . 1 . 2]"
1 45 GLU 7.536 0.313 12 0 "[ . 1 . 2]"
1 46 TYR 5.763 0.094 15 0 "[ . 1 . 2]"
1 47 ALA 2.278 0.098 19 0 "[ . 1 . 2]"
1 48 ARG 4.967 0.301 9 0 "[ . 1 . 2]"
1 49 SER 2.449 0.281 2 0 "[ . 1 . 2]"
1 50 HIS 2.650 0.093 10 0 "[ . 1 . 2]"
1 51 GLY 0.315 0.068 18 0 "[ . 1 . 2]"
1 52 PHE 2.496 0.085 2 0 "[ . 1 . 2]"
1 53 ALA 0.698 0.109 4 0 "[ . 1 . 2]"
1 54 ALA 0.714 0.046 1 0 "[ . 1 . 2]"
1 55 GLU 2.699 0.107 9 0 "[ . 1 . 2]"
1 56 PHE 2.324 0.107 9 0 "[ . 1 . 2]"
1 57 LYS 1.312 0.136 11 0 "[ . 1 . 2]"
1 58 LEU 0.880 0.083 1 0 "[ . 1 . 2]"
1 59 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ASP 0.027 0.027 1 0 "[ . 1 . 2]"
1 61 GLN 2.039 0.103 4 0 "[ . 1 . 2]"
1 62 SER 0.196 0.046 5 0 "[ . 1 . 2]"
1 63 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 PRO 1.092 0.113 9 0 "[ . 1 . 2]"
1 65 PRO 0.775 0.113 9 0 "[ . 1 . 2]"
1 66 HIS 0.514 0.042 19 0 "[ . 1 . 2]"
1 67 GLU 0.993 0.077 7 0 "[ . 1 . 2]"
1 68 PRO 0.907 0.085 10 0 "[ . 1 . 2]"
1 69 LYS 1.000 0.097 4 0 "[ . 1 . 2]"
1 70 PHE 2.032 0.099 10 0 "[ . 1 . 2]"
1 71 VAL 1.144 0.103 4 0 "[ . 1 . 2]"
1 72 TYR 1.052 0.076 5 0 "[ . 1 . 2]"
1 73 GLN 1.192 0.095 3 0 "[ . 1 . 2]"
1 74 ALA 0.495 0.057 2 0 "[ . 1 . 2]"
1 75 LYS 2.214 0.086 8 0 "[ . 1 . 2]"
1 76 VAL 2.787 0.109 4 0 "[ . 1 . 2]"
1 77 GLY 0.326 0.041 5 0 "[ . 1 . 2]"
1 79 ARG 0.582 0.093 20 0 "[ . 1 . 2]"
1 80 TRP 3.296 0.136 11 0 "[ . 1 . 2]"
1 81 PHE 1.893 0.095 3 0 "[ . 1 . 2]"
1 82 PRO 1.304 0.115 8 0 "[ . 1 . 2]"
1 83 ALA 0.112 0.036 16 0 "[ . 1 . 2]"
1 84 VAL 0.318 0.055 5 0 "[ . 1 . 2]"
1 85 CYS 0.046 0.021 7 0 "[ . 1 . 2]"
1 86 ALA 0.893 0.086 15 0 "[ . 1 . 2]"
1 87 HIS 0.456 0.119 17 0 "[ . 1 . 2]"
1 88 SER 0.265 0.071 19 0 "[ . 1 . 2]"
1 89 LYS 1.166 0.151 4 0 "[ . 1 . 2]"
1 90 LYS 0.387 0.091 9 0 "[ . 1 . 2]"
1 91 GLN 0.863 0.119 17 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LYS 2.156 0.151 4 0 "[ . 1 . 2]"
1 94 GLN 0.641 0.120 3 0 "[ . 1 . 2]"
1 95 GLU 0.220 0.059 6 0 "[ . 1 . 2]"
1 96 ALA 0.096 0.031 18 0 "[ . 1 . 2]"
1 97 ALA 0.481 0.053 2 0 "[ . 1 . 2]"
1 98 ASP 0.142 0.031 3 0 "[ . 1 . 2]"
1 99 ALA 0.617 0.055 5 0 "[ . 1 . 2]"
1 100 ALA 0.183 0.043 8 0 "[ . 1 . 2]"
1 101 LEU 4.693 0.105 20 0 "[ . 1 . 2]"
1 102 ARG 1.641 0.216 13 0 "[ . 1 . 2]"
1 103 VAL 2.677 0.132 3 0 "[ . 1 . 2]"
1 104 LEU 2.154 0.132 3 0 "[ . 1 . 2]"
1 105 ILE 4.497 0.107 12 0 "[ . 1 . 2]"
1 106 GLY 0.158 0.047 6 0 "[ . 1 . 2]"
1 107 GLU 0.163 0.044 19 0 "[ . 1 . 2]"
1 108 ASN 0.862 0.138 14 0 "[ . 1 . 2]"
1 109 GLU 0.380 0.103 9 0 "[ . 1 . 2]"
1 111 ALA 0.951 0.162 4 0 "[ . 1 . 2]"
1 112 GLU 0.754 0.162 4 0 "[ . 1 . 2]"
1 113 ARG 1.015 0.147 10 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 64 PRO HA 1 66 HIS HE1 5.130 . 5.390 4.958 4.620 5.148 . 0 0 "[ . 1 . 2]" 1
2 1 65 PRO HD2 1 66 HIS HE1 5.500 . 5.780 3.850 3.480 4.048 . 0 0 "[ . 1 . 2]" 1
3 1 65 PRO HD3 1 66 HIS HE1 5.500 . 5.780 5.486 4.501 5.796 0.016 12 0 "[ . 1 . 2]" 1
4 1 64 PRO HD3 1 66 HIS HE1 5.500 . 5.780 5.421 5.112 5.623 . 0 0 "[ . 1 . 2]" 1
5 1 64 PRO HG2 1 66 HIS HE1 4.110 . 4.320 4.014 3.573 4.347 0.027 14 0 "[ . 1 . 2]" 1
6 1 75 LYS HG3 1 80 TRP HZ2 5.500 . 5.780 4.029 3.507 4.542 . 0 0 "[ . 1 . 2]" 1
7 1 75 LYS HA 1 80 TRP HE3 5.440 . 5.710 3.788 3.521 3.965 . 0 0 "[ . 1 . 2]" 1
8 1 57 LYS QD 1 80 TRP HE3 5.500 . 5.780 3.566 2.892 4.148 . 0 0 "[ . 1 . 2]" 1
9 1 46 TYR QE 1 52 PHE QE 4.120 . 4.330 4.167 3.764 4.347 0.017 16 0 "[ . 1 . 2]" 1
10 1 50 HIS HA 1 52 PHE QE 4.910 . 5.160 4.829 4.675 5.171 0.011 8 0 "[ . 1 . 2]" 1
11 1 47 ALA HA 1 52 PHE QE 5.140 . 5.400 5.007 4.689 5.121 . 0 0 "[ . 1 . 2]" 1
12 1 68 PRO HG2 1 70 PHE HZ 5.190 . 5.450 4.013 2.606 5.298 . 0 0 "[ . 1 . 2]" 1
13 1 70 PHE HZ 1 88 SER HA 5.360 . 5.630 4.894 4.157 5.672 0.042 15 0 "[ . 1 . 2]" 1
14 1 34 TYR QD 1 38 ASN HA 4.990 . 5.240 4.923 4.516 5.254 0.014 8 0 "[ . 1 . 2]" 1
15 1 69 LYS HA 1 70 PHE QE 4.720 . 4.960 4.901 4.306 5.057 0.097 4 0 "[ . 1 . 2]" 1
16 1 75 LYS HE3 1 80 TRP HH2 4.580 . 4.810 3.515 3.172 3.789 . 0 0 "[ . 1 . 2]" 1
17 1 57 LYS HG2 1 80 TRP HH2 4.830 . 5.070 4.575 3.164 5.079 0.009 1 0 "[ . 1 . 2]" 1
18 1 75 LYS HG3 1 80 TRP HH2 5.500 . 5.780 4.288 3.799 4.823 . 0 0 "[ . 1 . 2]" 1
19 1 56 PHE QE 1 72 TYR QD 5.500 . 5.780 5.647 5.036 5.847 0.067 5 0 "[ . 1 . 2]" 1
20 1 54 ALA HA 1 56 PHE QE 5.500 . 5.780 5.595 5.263 5.820 0.040 4 0 "[ . 1 . 2]" 1
21 1 56 PHE HA 1 56 PHE QE 4.830 . 5.070 4.672 4.627 4.764 . 0 0 "[ . 1 . 2]" 1
22 1 55 GLU HA 1 56 PHE QE 5.090 . 5.340 4.919 4.364 5.348 0.008 8 0 "[ . 1 . 2]" 1
23 1 56 PHE QE 1 96 ALA HA 5.280 . 5.540 4.843 4.530 5.250 . 0 0 "[ . 1 . 2]" 1
24 1 56 PHE QE 1 97 ALA HA 3.740 . 3.930 3.018 2.656 3.467 . 0 0 "[ . 1 . 2]" 1
25 1 56 PHE QE 1 94 GLN HA 5.070 . 5.320 5.026 4.785 5.264 . 0 0 "[ . 1 . 2]" 1
26 1 40 VAL HA 1 56 PHE QE 4.150 . 4.360 3.872 3.653 4.110 . 0 0 "[ . 1 . 2]" 1
27 1 44 LEU HG 1 56 PHE QE 4.330 . 4.550 2.779 2.503 3.167 . 0 0 "[ . 1 . 2]" 1
28 1 56 PHE QE 1 96 ALA MB 3.510 . 3.690 2.412 2.176 2.771 . 0 0 "[ . 1 . 2]" 1
29 1 43 LEU HB3 1 56 PHE QE 5.480 . 5.750 3.586 3.264 3.950 . 0 0 "[ . 1 . 2]" 1
30 1 56 PHE QE 1 93 LYS HB3 4.670 . 4.900 4.268 3.982 4.533 . 0 0 "[ . 1 . 2]" 1
31 1 54 ALA MB 1 56 PHE QE 4.020 . 4.220 3.395 2.943 3.833 . 0 0 "[ . 1 . 2]" 1
32 1 44 LEU MD1 1 56 PHE QE 3.630 . 3.810 3.293 3.120 3.518 . 0 0 "[ . 1 . 2]" 1
33 1 40 VAL MG2 1 56 PHE QE 4.230 . 4.440 3.933 3.640 4.124 . 0 0 "[ . 1 . 2]" 1
34 1 40 VAL MG1 1 56 PHE QE 4.230 . 4.440 2.886 2.672 3.135 . 0 0 "[ . 1 . 2]" 1
35 1 56 PHE QD 1 72 TYR QD 4.390 . 4.610 3.499 2.869 3.765 . 0 0 "[ . 1 . 2]" 1
36 1 56 PHE HA 1 56 PHE QD 3.520 . 3.700 2.984 2.879 3.152 . 0 0 "[ . 1 . 2]" 1
37 1 56 PHE QD 1 93 LYS HB3 4.780 . 5.020 3.834 3.347 4.257 . 0 0 "[ . 1 . 2]" 1
38 1 66 HIS HA 1 66 HIS HD2 4.830 . 5.070 4.625 4.544 4.689 . 0 0 "[ . 1 . 2]" 1
39 1 46 TYR QE 1 52 PHE QD 3.750 . 3.940 3.713 3.099 3.884 . 0 0 "[ . 1 . 2]" 1
40 1 52 PHE HA 1 52 PHE QD 2.950 . 3.100 2.760 2.307 2.989 . 0 0 "[ . 1 . 2]" 1
41 1 76 VAL HB 1 81 PHE QE 3.340 . 3.510 2.625 1.952 3.241 . 0 0 "[ . 1 . 2]" 1
42 1 70 PHE QD 1 72 TYR QE 3.930 . 4.130 3.648 3.079 4.142 0.012 12 0 "[ . 1 . 2]" 1
43 1 70 PHE HA 1 70 PHE QD 3.650 . 3.830 2.888 2.757 3.060 . 0 0 "[ . 1 . 2]" 1
44 1 69 LYS HA 1 70 PHE QD 4.380 . 4.600 3.701 3.163 4.012 . 0 0 "[ . 1 . 2]" 1
45 1 61 GLN QB 1 70 PHE QD 3.530 . 3.710 2.632 1.923 3.415 . 0 0 "[ . 1 . 2]" 1
46 1 58 LEU MD1 1 70 PHE QD 3.650 . 3.830 2.098 1.785 2.544 0.015 7 0 "[ . 1 . 2]" 1
47 1 70 PHE QD 1 87 HIS HA 4.050 . 4.250 3.479 2.581 4.282 0.032 20 0 "[ . 1 . 2]" 1
48 1 40 VAL HA 1 56 PHE HZ 3.680 . 3.860 2.947 2.678 3.232 . 0 0 "[ . 1 . 2]" 1
49 1 43 LEU HB3 1 56 PHE HZ 4.670 . 4.900 2.443 2.141 2.876 . 0 0 "[ . 1 . 2]" 1
50 1 31 LEU MD1 1 46 TYR QD 3.350 . 3.520 3.225 2.780 3.554 0.034 6 0 "[ . 1 . 2]" 1
51 1 81 PHE QD 1 103 VAL HB 3.780 . 3.970 3.057 2.840 3.519 . 0 0 "[ . 1 . 2]" 1
52 1 80 TRP HA 1 80 TRP HZ3 5.500 . 5.780 5.533 5.208 5.695 . 0 0 "[ . 1 . 2]" 1
53 1 80 TRP QB 1 80 TRP HZ3 5.500 . 5.780 4.727 4.679 4.818 . 0 0 "[ . 1 . 2]" 1
54 1 57 LYS HB2 1 80 TRP HZ3 4.960 . 5.210 4.802 4.322 5.057 . 0 0 "[ . 1 . 2]" 1
55 1 73 GLN QB 1 80 TRP HZ3 5.450 . 5.720 4.220 3.579 4.911 . 0 0 "[ . 1 . 2]" 1
56 1 57 LYS QD 1 80 TRP HZ3 4.610 . 4.840 1.934 1.765 2.670 0.035 7 0 "[ . 1 . 2]" 1
57 1 31 LEU HA 1 34 TYR QE 3.700 . 3.890 3.936 3.818 3.994 0.104 13 0 "[ . 1 . 2]" 1
58 1 30 GLU HA 1 34 TYR QE 4.950 . 5.200 4.537 3.884 5.079 . 0 0 "[ . 1 . 2]" 1
59 1 34 TYR QE 1 37 THR HB 5.360 . 5.630 4.748 4.183 5.436 . 0 0 "[ . 1 . 2]" 1
60 1 33 ARG QB 1 34 TYR QE 5.230 . 5.490 5.302 5.003 5.569 0.079 11 0 "[ . 1 . 2]" 1
61 1 33 ARG HG3 1 34 TYR QE 5.090 . 5.340 4.400 4.030 5.185 . 0 0 "[ . 1 . 2]" 1
62 1 31 LEU MD2 1 34 TYR QE 4.450 . 4.670 4.426 3.947 4.677 0.007 16 0 "[ . 1 . 2]" 1
63 1 31 LEU MD1 1 34 TYR QE 3.840 . 4.030 3.516 3.227 3.912 . 0 0 "[ . 1 . 2]" 1
64 1 70 PHE QD 1 72 TYR QD 5.060 . 5.310 4.448 4.194 4.881 . 0 0 "[ . 1 . 2]" 1
65 1 72 TYR HA 1 72 TYR QD 3.640 . 3.820 3.001 2.939 3.070 . 0 0 "[ . 1 . 2]" 1
66 1 56 PHE HA 1 72 TYR QD 4.280 . 4.490 3.721 3.381 4.279 . 0 0 "[ . 1 . 2]" 1
67 1 57 LYS HA 1 72 TYR QD 5.310 . 5.580 4.212 3.901 4.854 . 0 0 "[ . 1 . 2]" 1
68 1 58 LEU HA 1 72 TYR QD 4.530 . 4.760 3.574 3.411 3.661 . 0 0 "[ . 1 . 2]" 1
69 1 72 TYR QD 1 89 LYS HA 4.300 . 4.510 3.918 3.638 4.245 . 0 0 "[ . 1 . 2]" 1
70 1 72 TYR QD 1 92 GLY QA 3.620 . 3.800 2.728 2.141 3.421 . 0 0 "[ . 1 . 2]" 1
71 1 72 TYR QD 1 93 LYS HA 4.160 . 4.370 3.747 3.474 4.154 . 0 0 "[ . 1 . 2]" 1
72 1 58 LEU HB2 1 72 TYR QD 5.500 . 5.780 4.277 4.000 4.615 . 0 0 "[ . 1 . 2]" 1
73 1 72 TYR QD 1 86 ALA MB 4.620 . 4.850 4.437 3.130 4.882 0.032 8 0 "[ . 1 . 2]" 1
74 1 72 TYR QD 1 93 LYS QD 5.500 . 5.780 4.884 4.248 5.414 . 0 0 "[ . 1 . 2]" 1
75 1 72 TYR QD 1 89 LYS QG 4.540 . 4.770 4.241 3.710 4.660 . 0 0 "[ . 1 . 2]" 1
76 1 72 TYR QD 1 93 LYS HG3 5.500 . 5.780 4.069 3.620 4.370 . 0 0 "[ . 1 . 2]" 1
77 1 46 TYR QE 1 76 VAL HA 5.420 . 5.690 5.507 5.268 5.700 0.010 6 0 "[ . 1 . 2]" 1
78 1 43 LEU HA 1 46 TYR QE 5.500 . 5.780 5.723 5.499 5.810 0.030 1 0 "[ . 1 . 2]" 1
79 1 46 TYR QE 1 47 ALA MB 4.020 . 4.220 3.903 3.818 3.999 . 0 0 "[ . 1 . 2]" 1
80 1 46 TYR QE 1 104 LEU MD1 3.750 . 3.940 3.001 2.872 3.150 . 0 0 "[ . 1 . 2]" 1
81 1 46 TYR QE 1 104 LEU MD2 3.750 . 3.940 2.891 2.693 3.068 . 0 0 "[ . 1 . 2]" 1
82 1 56 PHE QD 1 72 TYR QE 5.170 . 5.430 4.822 4.007 5.356 . 0 0 "[ . 1 . 2]" 1
83 1 72 TYR HA 1 72 TYR QE 4.610 . 4.840 4.469 4.427 4.548 . 0 0 "[ . 1 . 2]" 1
84 1 58 LEU HA 1 72 TYR QE 4.550 . 4.780 3.846 3.666 4.089 . 0 0 "[ . 1 . 2]" 1
85 1 72 TYR QE 1 92 GLY QA 4.510 . 4.740 3.982 3.398 4.695 . 0 0 "[ . 1 . 2]" 1
86 1 72 TYR QE 1 89 LYS HB2 4.830 . 5.070 3.932 3.689 4.251 . 0 0 "[ . 1 . 2]" 1
87 1 72 TYR QE 1 89 LYS HB3 4.830 . 5.070 4.851 4.543 5.094 0.024 14 0 "[ . 1 . 2]" 1
88 1 72 TYR QE 1 93 LYS QD 4.130 . 4.340 3.743 3.177 4.273 . 0 0 "[ . 1 . 2]" 1
89 1 58 LEU MD1 1 72 TYR QE 4.320 . 4.540 2.462 1.940 2.792 . 0 0 "[ . 1 . 2]" 1
90 1 72 TYR QE 1 89 LYS QG 4.060 . 4.260 2.419 1.769 3.103 0.031 18 0 "[ . 1 . 2]" 1
91 1 58 LEU MD2 1 72 TYR QE 4.320 . 4.540 3.981 3.186 4.551 0.011 7 0 "[ . 1 . 2]" 1
92 1 57 LYS HA 1 72 TYR QE 5.500 . 5.780 3.522 2.897 4.036 . 0 0 "[ . 1 . 2]" 1
93 1 72 TYR HA 1 73 GLN HA 5.170 . 5.430 4.401 4.381 4.426 . 0 0 "[ . 1 . 2]" 1
94 1 58 LEU HA 1 72 TYR HA 3.650 . 3.830 2.592 2.383 2.793 . 0 0 "[ . 1 . 2]" 1
95 1 59 VAL HA 1 72 TYR HA 5.500 . 5.780 5.480 5.293 5.661 . 0 0 "[ . 1 . 2]" 1
96 1 58 LEU HB2 1 72 TYR HA 5.500 . 5.780 4.827 4.543 5.115 . 0 0 "[ . 1 . 2]" 1
97 1 59 VAL HB 1 72 TYR HA 5.000 . 5.250 4.409 4.188 4.744 . 0 0 "[ . 1 . 2]" 1
98 1 71 VAL HA 1 85 CYS HA 3.350 . 3.520 2.247 1.909 2.577 . 0 0 "[ . 1 . 2]" 1
99 1 84 VAL HA 1 85 CYS HA 5.270 . 5.530 4.428 4.353 4.495 . 0 0 "[ . 1 . 2]" 1
100 1 71 VAL MG2 1 85 CYS HA 4.810 . 5.050 3.287 2.816 3.826 . 0 0 "[ . 1 . 2]" 1
101 1 71 VAL HA 1 72 TYR HB2 5.390 . 5.660 4.318 4.246 4.411 . 0 0 "[ . 1 . 2]" 1
102 1 70 PHE QB 1 71 VAL HA 5.400 . 5.670 4.380 4.183 4.474 . 0 0 "[ . 1 . 2]" 1
103 1 71 VAL HA 1 71 VAL MG2 3.340 . 3.510 2.450 2.390 2.515 . 0 0 "[ . 1 . 2]" 1
104 1 71 VAL HA 1 72 TYR QD 5.380 . 5.650 4.368 3.878 4.675 . 0 0 "[ . 1 . 2]" 1
105 1 71 VAL HA 1 85 CYS HB2 5.430 . 5.700 4.010 3.461 4.872 . 0 0 "[ . 1 . 2]" 1
106 1 71 VAL HA 1 85 CYS HB3 5.430 . 5.700 3.138 2.505 3.906 . 0 0 "[ . 1 . 2]" 1
107 1 70 PHE QE 1 87 HIS HA 4.930 . 5.180 4.338 3.414 5.111 . 0 0 "[ . 1 . 2]" 1
108 1 69 LYS HA 1 87 HIS HA 3.460 . 3.630 2.374 1.742 3.254 0.058 6 0 "[ . 1 . 2]" 1
109 1 69 LYS QB 1 87 HIS HA 4.670 . 4.900 4.018 2.771 4.887 . 0 0 "[ . 1 . 2]" 1
110 1 86 ALA MB 1 87 HIS HA 5.050 . 5.300 4.245 3.958 4.372 . 0 0 "[ . 1 . 2]" 1
111 1 73 GLN QG 1 83 ALA HA 4.140 . 4.350 2.923 2.551 3.336 . 0 0 "[ . 1 . 2]" 1
112 1 73 GLN QB 1 83 ALA HA 4.080 . 4.280 2.978 2.645 3.208 . 0 0 "[ . 1 . 2]" 1
113 1 52 PHE HA 1 52 PHE QE 4.480 . 4.700 4.592 4.469 4.670 . 0 0 "[ . 1 . 2]" 1
114 1 52 PHE HA 1 77 GLY HA2 5.490 . 5.760 3.611 3.212 4.024 . 0 0 "[ . 1 . 2]" 1
115 1 56 PHE HB2 1 74 ALA HA 5.410 . 5.680 5.430 5.105 5.644 . 0 0 "[ . 1 . 2]" 1
116 1 47 ALA MB 1 52 PHE HA 4.240 . 4.450 4.153 4.035 4.351 . 0 0 "[ . 1 . 2]" 1
117 1 37 THR HA 1 38 ASN HA 5.030 . 5.280 4.622 4.565 4.664 . 0 0 "[ . 1 . 2]" 1
118 1 34 TYR HA 1 38 ASN HA 5.500 . 5.780 5.014 4.751 5.359 . 0 0 "[ . 1 . 2]" 1
119 1 38 ASN HA 1 39 PRO HA 4.760 . 5.000 4.511 4.487 4.534 . 0 0 "[ . 1 . 2]" 1
120 1 38 ASN HA 1 39 PRO HD2 3.210 . 3.370 1.854 1.815 1.891 . 0 0 "[ . 1 . 2]" 1
121 1 38 ASN HA 1 39 PRO HD3 3.210 . 3.370 2.572 2.495 2.621 . 0 0 "[ . 1 . 2]" 1
122 1 38 ASN HA 1 39 PRO HG2 4.500 . 4.730 4.045 3.994 4.094 . 0 0 "[ . 1 . 2]" 1
123 1 38 ASN HA 1 39 PRO HB3 4.950 . 5.200 5.055 5.004 5.090 . 0 0 "[ . 1 . 2]" 1
124 1 37 THR MG 1 38 ASN HA 5.330 . 5.600 4.015 3.736 4.185 . 0 0 "[ . 1 . 2]" 1
125 1 70 PHE HA 1 72 TYR QE 5.280 . 5.540 4.989 4.333 5.413 . 0 0 "[ . 1 . 2]" 1
126 1 54 ALA HA 1 76 VAL HA 3.460 . 3.630 2.449 1.929 2.823 . 0 0 "[ . 1 . 2]" 1
127 1 54 ALA HA 1 76 VAL HB 5.500 . 5.780 5.003 4.662 5.191 . 0 0 "[ . 1 . 2]" 1
128 1 47 ALA MB 1 54 ALA HA 3.830 . 4.020 3.435 3.284 3.670 . 0 0 "[ . 1 . 2]" 1
129 1 53 ALA MB 1 54 ALA HA 4.640 . 4.870 4.285 4.044 4.399 . 0 0 "[ . 1 . 2]" 1
130 1 54 ALA HA 1 76 VAL MG1 3.740 . 3.930 3.435 3.203 3.695 . 0 0 "[ . 1 . 2]" 1
131 1 75 LYS HA 1 80 TRP QB 4.850 . 5.090 4.095 3.960 4.329 . 0 0 "[ . 1 . 2]" 1
132 1 75 LYS HA 1 75 LYS HG2 4.070 . 4.270 3.059 2.759 3.237 . 0 0 "[ . 1 . 2]" 1
133 1 75 LYS HA 1 75 LYS HG3 4.070 . 4.270 2.691 2.627 2.823 . 0 0 "[ . 1 . 2]" 1
134 1 73 GLN HA 1 83 ALA HA 3.310 . 3.480 2.504 2.226 2.828 . 0 0 "[ . 1 . 2]" 1
135 1 56 PHE HA 1 72 TYR QE 5.390 . 5.660 4.767 4.191 5.732 0.072 17 0 "[ . 1 . 2]" 1
136 1 56 PHE HA 1 74 ALA HA 3.180 . 3.340 2.700 2.367 3.014 . 0 0 "[ . 1 . 2]" 1
137 1 73 GLN HA 1 83 ALA MB 4.600 . 4.830 3.793 3.484 4.170 . 0 0 "[ . 1 . 2]" 1
138 1 83 ALA MB 1 84 VAL HA 4.860 . 5.100 4.193 4.051 4.260 . 0 0 "[ . 1 . 2]" 1
139 1 85 CYS HA 1 86 ALA HA 5.250 . 5.510 4.408 4.387 4.475 . 0 0 "[ . 1 . 2]" 1
140 1 60 ASP HA 1 61 GLN HA 5.440 . 5.710 4.440 4.376 4.527 . 0 0 "[ . 1 . 2]" 1
141 1 61 GLN HA 1 62 SER HA 5.500 . 5.780 4.393 4.354 4.528 . 0 0 "[ . 1 . 2]" 1
142 1 70 PHE QD 1 88 SER HA 3.880 . 4.070 3.104 2.511 3.560 . 0 0 "[ . 1 . 2]" 1
143 1 82 PRO HA 1 103 VAL MG1 5.370 . 5.640 5.653 5.484 5.755 0.115 8 0 "[ . 1 . 2]" 1
144 1 47 ALA MB 1 53 ALA HA 3.650 . 3.830 3.064 2.678 3.386 . 0 0 "[ . 1 . 2]" 1
145 1 68 PRO HA 1 70 PHE QE 5.500 . 5.780 4.946 4.486 5.338 . 0 0 "[ . 1 . 2]" 1
146 1 73 GLN QG 1 80 TRP HA 5.390 . 5.660 3.336 3.069 3.513 . 0 0 "[ . 1 . 2]" 1
147 1 57 LYS HA 1 57 LYS HG2 4.070 . 4.270 3.887 3.730 4.181 . 0 0 "[ . 1 . 2]" 1
148 1 80 TRP HA 1 81 PHE QD 4.370 . 4.590 3.726 3.520 3.883 . 0 0 "[ . 1 . 2]" 1
149 1 75 LYS HA 1 80 TRP HA 3.460 . 3.630 2.368 2.193 2.522 . 0 0 "[ . 1 . 2]" 1
150 1 75 LYS HG2 1 80 TRP HA 4.760 . 5.000 4.948 4.389 5.061 0.061 7 0 "[ . 1 . 2]" 1
151 1 75 LYS HG3 1 80 TRP HA 4.760 . 5.000 3.903 3.445 4.179 . 0 0 "[ . 1 . 2]" 1
152 1 54 ALA MB 1 55 GLU HA 4.460 . 4.680 4.083 3.949 4.206 . 0 0 "[ . 1 . 2]" 1
153 1 37 THR HA 1 37 THR MG 2.710 . 2.850 2.336 2.300 2.376 . 0 0 "[ . 1 . 2]" 1
154 1 27 LYS HA 1 27 LYS HG2 3.590 . 3.770 3.073 2.373 3.759 . 0 0 "[ . 1 . 2]" 1
155 1 79 ARG HA 1 81 PHE QD 5.080 . 5.330 4.100 3.753 4.341 . 0 0 "[ . 1 . 2]" 1
156 1 79 ARG HA 1 79 ARG HG3 3.900 . 4.100 3.310 2.380 3.748 . 0 0 "[ . 1 . 2]" 1
157 1 34 TYR HA 1 35 LEU HA 5.000 . 5.250 4.807 4.746 4.846 . 0 0 "[ . 1 . 2]" 1
158 1 50 HIS HA 1 52 PHE QD 4.740 . 4.980 4.593 4.277 5.000 0.020 2 0 "[ . 1 . 2]" 1
159 1 107 GLU HA 1 108 ASN HA 5.290 . 5.550 4.682 4.563 4.773 . 0 0 "[ . 1 . 2]" 1
160 1 108 ASN HA 1 109 GLU HA 5.500 . 5.780 4.782 4.661 4.874 . 0 0 "[ . 1 . 2]" 1
161 1 34 TYR HA 1 34 TYR QE 4.510 . 4.740 4.376 4.221 4.496 . 0 0 "[ . 1 . 2]" 1
162 1 106 GLY HA2 1 109 GLU HA 5.380 . 5.650 5.197 4.539 5.631 . 0 0 "[ . 1 . 2]" 1
163 1 45 GLU HA 1 48 ARG HD3 4.380 . 4.600 2.395 2.160 2.703 . 0 0 "[ . 1 . 2]" 1
164 1 30 GLU HA 1 33 ARG QB 3.750 . 3.940 2.903 1.930 3.678 . 0 0 "[ . 1 . 2]" 1
165 1 30 GLU HA 1 31 LEU MD2 4.730 . 4.970 4.565 4.420 4.881 . 0 0 "[ . 1 . 2]" 1
166 1 95 GLU HA 1 98 ASP HB3 3.340 . 3.510 2.523 2.003 2.943 . 0 0 "[ . 1 . 2]" 1
167 1 31 LEU MD1 1 46 TYR HA 3.680 . 3.860 3.392 3.025 3.588 . 0 0 "[ . 1 . 2]" 1
168 1 49 SER HA 1 50 HIS HA 4.730 . 4.970 4.598 4.530 4.633 . 0 0 "[ . 1 . 2]" 1
169 1 49 SER HA 1 49 SER HB2 2.980 . 3.130 2.493 2.379 3.015 . 0 0 "[ . 1 . 2]" 1
170 1 39 PRO HB2 1 98 ASP HA 3.760 . 3.950 2.742 2.599 2.969 . 0 0 "[ . 1 . 2]" 1
171 1 84 VAL MG1 1 96 ALA HA 4.110 . 4.320 2.533 2.188 3.323 . 0 0 "[ . 1 . 2]" 1
172 1 96 ALA HA 1 100 ALA MB 4.790 . 5.030 4.307 4.197 4.396 . 0 0 "[ . 1 . 2]" 1
173 1 56 PHE QD 1 96 ALA HA 5.500 . 5.780 5.519 5.205 5.798 0.018 17 0 "[ . 1 . 2]" 1
174 1 73 GLN HA 1 96 ALA HA 5.200 . 5.460 5.153 4.871 5.403 . 0 0 "[ . 1 . 2]" 1
175 1 27 LYS HA 1 28 ILE HA 4.630 . 4.860 4.486 4.255 4.864 0.004 6 0 "[ . 1 . 2]" 1
176 1 44 LEU HA 1 46 TYR QD 5.500 . 5.780 5.433 5.240 5.611 . 0 0 "[ . 1 . 2]" 1
177 1 106 GLY HA2 1 107 GLU HA 5.250 . 5.510 4.778 4.667 4.888 . 0 0 "[ . 1 . 2]" 1
178 1 106 GLY HA2 1 109 GLU QG 3.870 . 4.060 3.539 2.324 4.107 0.047 6 0 "[ . 1 . 2]" 1
179 1 44 LEU HA 1 44 LEU HG 2.970 . 3.120 3.054 2.991 3.119 . 0 0 "[ . 1 . 2]" 1
180 1 44 LEU HA 1 44 LEU MD1 3.990 . 4.190 3.869 3.843 3.894 . 0 0 "[ . 1 . 2]" 1
181 1 34 TYR QD 1 39 PRO HA 4.460 . 4.680 4.525 4.415 4.700 0.020 5 0 "[ . 1 . 2]" 1
182 1 44 LEU HA 1 54 ALA HA 5.500 . 5.780 5.138 4.732 5.403 . 0 0 "[ . 1 . 2]" 1
183 1 39 PRO HA 1 41 GLY QA 5.500 . 5.780 5.606 5.510 5.705 . 0 0 "[ . 1 . 2]" 1
184 1 41 GLY QA 1 44 LEU HA 5.500 . 5.780 5.363 5.179 5.573 . 0 0 "[ . 1 . 2]" 1
185 1 43 LEU HA 1 43 LEU MD1 4.110 . 4.320 3.160 3.098 3.219 . 0 0 "[ . 1 . 2]" 1
186 1 81 PHE QE 1 104 LEU HA 5.360 . 5.630 4.489 4.146 4.760 . 0 0 "[ . 1 . 2]" 1
187 1 43 LEU HA 1 46 TYR QD 3.610 . 3.790 3.783 3.545 3.848 0.058 3 0 "[ . 1 . 2]" 1
188 1 46 TYR QE 1 104 LEU HA 5.420 . 5.690 5.153 4.877 5.466 . 0 0 "[ . 1 . 2]" 1
189 1 91 GLN HA 1 92 GLY QA 4.520 . 4.750 4.498 4.477 4.525 . 0 0 "[ . 1 . 2]" 1
190 1 43 LEU HA 1 46 TYR HB3 3.810 . 4.000 2.603 2.467 2.812 . 0 0 "[ . 1 . 2]" 1
191 1 105 ILE MG 1 106 GLY HA3 4.230 . 4.440 4.227 4.044 4.404 . 0 0 "[ . 1 . 2]" 1
192 1 91 GLN HA 1 94 GLN QB 3.260 . 3.420 2.585 2.298 3.020 . 0 0 "[ . 1 . 2]" 1
193 1 35 LEU HA 1 35 LEU MD2 3.900 . 4.100 1.994 1.914 2.068 . 0 0 "[ . 1 . 2]" 1
194 1 98 ASP HB3 1 99 ALA HA 4.930 . 5.180 4.225 4.047 4.366 . 0 0 "[ . 1 . 2]" 1
195 1 99 ALA HA 1 102 ARG HD2 4.820 . 5.060 3.706 1.782 4.863 0.018 10 0 "[ . 1 . 2]" 1
196 1 99 ALA HA 1 102 ARG HD3 4.820 . 5.060 3.486 1.981 4.527 . 0 0 "[ . 1 . 2]" 1
197 1 102 ARG HA 1 105 ILE HB 3.210 . 3.370 2.633 2.066 2.967 . 0 0 "[ . 1 . 2]" 1
198 1 102 ARG HA 1 102 ARG QG 3.600 . 3.780 2.678 2.179 3.203 . 0 0 "[ . 1 . 2]" 1
199 1 103 VAL HA 1 103 VAL MG2 3.190 . 3.350 2.426 2.377 2.464 . 0 0 "[ . 1 . 2]" 1
200 1 58 LEU HA 1 58 LEU MD1 3.990 . 4.190 2.994 2.029 3.782 . 0 0 "[ . 1 . 2]" 1
201 1 51 GLY HA3 1 52 PHE QD 5.330 . 5.600 4.828 4.555 5.128 . 0 0 "[ . 1 . 2]" 1
202 1 51 GLY HA3 1 52 PHE HA 4.930 . 5.180 4.477 4.419 4.529 . 0 0 "[ . 1 . 2]" 1
203 1 46 TYR QE 1 47 ALA HA 4.260 . 4.470 3.791 3.665 3.916 . 0 0 "[ . 1 . 2]" 1
204 1 47 ALA HA 1 52 PHE HA 5.010 . 5.260 4.902 4.743 5.028 . 0 0 "[ . 1 . 2]" 1
205 1 47 ALA HA 1 52 PHE HB3 3.940 . 4.140 3.788 3.514 3.982 . 0 0 "[ . 1 . 2]" 1
206 1 34 TYR QD 1 41 GLY QA 4.500 . 4.730 3.926 3.382 4.447 . 0 0 "[ . 1 . 2]" 1
207 1 56 PHE HZ 1 94 GLN HA 5.500 . 5.780 5.748 5.548 5.828 0.048 11 0 "[ . 1 . 2]" 1
208 1 40 VAL HA 1 94 GLN HA 4.420 . 4.640 4.347 4.088 4.599 . 0 0 "[ . 1 . 2]" 1
209 1 94 GLN HA 1 97 ALA MB 3.500 . 3.680 2.800 2.535 3.069 . 0 0 "[ . 1 . 2]" 1
210 1 90 LYS HA 1 93 LYS HG3 5.330 . 5.600 3.469 2.854 4.043 . 0 0 "[ . 1 . 2]" 1
211 1 105 ILE HA 1 108 ASN HB3 4.330 . 4.550 3.317 2.783 3.934 . 0 0 "[ . 1 . 2]" 1
212 1 105 ILE HA 1 108 ASN HB2 4.040 . 4.240 4.084 3.518 4.305 0.065 6 0 "[ . 1 . 2]" 1
213 1 28 ILE MG 1 105 ILE HA 2.970 . 3.120 1.983 1.742 2.253 0.058 19 0 "[ . 1 . 2]" 1
214 1 64 PRO HD2 1 67 GLU HA 5.220 . 5.480 5.122 4.835 5.370 . 0 0 "[ . 1 . 2]" 1
215 1 31 LEU HA 1 32 VAL HA 5.380 . 5.650 4.793 4.742 4.823 . 0 0 "[ . 1 . 2]" 1
216 1 100 ALA HA 1 103 VAL HB 3.980 . 4.180 3.000 2.861 3.215 . 0 0 "[ . 1 . 2]" 1
217 1 32 VAL HA 1 35 LEU HG 3.220 . 3.380 2.630 2.210 3.227 . 0 0 "[ . 1 . 2]" 1
218 1 32 VAL HA 1 32 VAL MG2 3.310 . 3.480 2.416 2.352 2.502 . 0 0 "[ . 1 . 2]" 1
219 1 101 LEU HA 1 101 LEU MD1 4.040 . 4.240 3.833 3.797 3.879 . 0 0 "[ . 1 . 2]" 1
220 1 101 LEU HA 1 105 ILE HG13 4.090 . 4.290 3.813 3.690 3.970 . 0 0 "[ . 1 . 2]" 1
221 1 66 HIS HA 1 68 PRO HD2 5.350 . 5.620 4.721 4.374 5.154 . 0 0 "[ . 1 . 2]" 1
222 1 38 ASN QB 1 39 PRO HD3 4.930 . 5.180 4.542 4.503 4.588 . 0 0 "[ . 1 . 2]" 1
223 1 70 PHE QD 1 89 LYS HA 5.180 . 5.440 3.621 2.878 4.938 . 0 0 "[ . 1 . 2]" 1
224 1 89 LYS HA 1 89 LYS QG 3.750 . 3.940 2.430 2.313 2.570 . 0 0 "[ . 1 . 2]" 1
225 1 67 GLU HB2 1 68 PRO HD3 5.500 . 5.780 4.907 4.546 5.102 . 0 0 "[ . 1 . 2]" 1
226 1 65 PRO HA 1 68 PRO HD3 5.230 . 5.490 4.030 3.757 4.302 . 0 0 "[ . 1 . 2]" 1
227 1 40 VAL HA 1 97 ALA HA 4.400 . 4.620 4.381 4.209 4.492 . 0 0 "[ . 1 . 2]" 1
228 1 92 GLY QA 1 95 GLU QG 5.030 . 5.280 3.554 2.950 4.006 . 0 0 "[ . 1 . 2]" 1
229 1 39 PRO HB2 1 40 VAL HA 5.040 . 5.290 3.917 3.841 3.985 . 0 0 "[ . 1 . 2]" 1
230 1 40 VAL HA 1 43 LEU HB3 4.530 . 4.760 3.196 2.959 3.313 . 0 0 "[ . 1 . 2]" 1
231 1 52 PHE HB3 1 76 VAL HA 5.350 . 5.620 3.716 3.444 3.935 . 0 0 "[ . 1 . 2]" 1
232 1 52 PHE HB3 1 54 ALA HA 5.370 . 5.640 5.044 4.739 5.379 . 0 0 "[ . 1 . 2]" 1
233 1 102 ARG HA 1 102 ARG HD2 4.400 . 4.620 3.634 2.072 4.724 0.104 17 0 "[ . 1 . 2]" 1
234 1 47 ALA MB 1 52 PHE HB3 3.440 . 3.610 3.051 2.809 3.419 . 0 0 "[ . 1 . 2]" 1
235 1 52 PHE HB3 1 54 ALA MB 5.500 . 5.780 4.908 4.450 5.273 . 0 0 "[ . 1 . 2]" 1
236 1 113 ARG HB3 1 113 ARG QD 3.740 . 3.930 2.589 2.252 3.243 . 0 0 "[ . 1 . 2]" 1
237 1 46 TYR HB3 1 76 VAL MG1 5.500 . 5.780 4.879 4.557 5.224 . 0 0 "[ . 1 . 2]" 1
238 1 43 LEU HB3 1 46 TYR HB3 5.500 . 5.780 5.333 5.170 5.581 . 0 0 "[ . 1 . 2]" 1
239 1 56 PHE HB2 1 72 TYR QD 4.760 . 5.000 4.190 3.600 4.700 . 0 0 "[ . 1 . 2]" 1
240 1 34 TYR HB3 1 101 LEU MD2 4.800 . 5.040 4.444 4.260 4.660 . 0 0 "[ . 1 . 2]" 1
241 1 34 TYR HB3 1 41 GLY QA 5.130 . 5.390 5.019 4.710 5.269 . 0 0 "[ . 1 . 2]" 1
242 1 34 TYR QE 1 38 ASN QB 4.420 . 4.640 4.244 3.648 4.650 0.010 15 0 "[ . 1 . 2]" 1
243 1 37 THR HA 1 38 ASN QB 5.020 . 5.270 4.461 4.336 4.545 . 0 0 "[ . 1 . 2]" 1
244 1 46 TYR HB2 1 101 LEU HA 5.500 . 5.780 5.690 5.420 5.845 0.065 20 0 "[ . 1 . 2]" 1
245 1 56 PHE QD 1 93 LYS HA 3.740 . 3.930 2.746 2.498 3.013 . 0 0 "[ . 1 . 2]" 1
246 1 93 LYS HA 1 93 LYS HG2 3.840 . 4.030 2.581 2.473 2.692 . 0 0 "[ . 1 . 2]" 1
247 1 65 PRO HB2 1 66 HIS HB3 4.470 . 4.690 4.305 4.040 4.485 . 0 0 "[ . 1 . 2]" 1
248 1 102 ARG HA 1 102 ARG HD3 4.400 . 4.620 3.881 2.183 4.511 . 0 0 "[ . 1 . 2]" 1
249 1 42 GLY HA3 1 101 LEU MD1 4.270 . 4.480 2.614 2.228 2.981 . 0 0 "[ . 1 . 2]" 1
250 1 34 TYR HB2 1 101 LEU MD2 4.160 . 4.370 4.026 3.767 4.369 . 0 0 "[ . 1 . 2]" 1
251 1 34 TYR HB2 1 101 LEU HG 5.500 . 5.780 5.308 5.169 5.532 . 0 0 "[ . 1 . 2]" 1
252 1 32 VAL HA 1 34 TYR HB2 4.850 . 5.090 5.019 4.823 5.099 0.009 5 0 "[ . 1 . 2]" 1
253 1 81 PHE QB 1 82 PRO HA 4.590 . 4.820 2.469 2.305 2.599 . 0 0 "[ . 1 . 2]" 1
254 1 39 PRO HB2 1 98 ASP HB3 4.890 . 5.130 4.338 4.070 4.696 . 0 0 "[ . 1 . 2]" 1
255 1 39 PRO HG2 1 98 ASP HB3 5.500 . 5.780 5.195 4.985 5.666 . 0 0 "[ . 1 . 2]" 1
256 1 52 PHE HA 1 77 GLY HA3 5.490 . 5.760 3.770 2.862 4.232 . 0 0 "[ . 1 . 2]" 1
257 1 52 PHE HB3 1 77 GLY HA3 5.110 . 5.370 3.058 2.687 3.426 . 0 0 "[ . 1 . 2]" 1
258 1 107 GLU QB 1 108 ASN HB2 4.200 . 4.410 3.928 3.530 4.427 0.017 17 0 "[ . 1 . 2]" 1
259 1 56 PHE HB3 1 74 ALA HA 4.820 . 5.060 4.683 4.248 4.952 . 0 0 "[ . 1 . 2]" 1
260 1 56 PHE HB3 1 72 TYR QD 4.020 . 4.220 2.616 2.101 3.082 . 0 0 "[ . 1 . 2]" 1
261 1 95 GLU HA 1 98 ASP HB2 3.420 . 3.590 3.337 2.906 3.612 0.022 3 0 "[ . 1 . 2]" 1
262 1 31 LEU MD1 1 42 GLY HA2 3.870 . 4.060 3.475 3.255 3.735 . 0 0 "[ . 1 . 2]" 1
263 1 72 TYR HB2 1 92 GLY QA 5.500 . 5.780 2.660 2.468 2.818 . 0 0 "[ . 1 . 2]" 1
264 1 72 TYR HB2 1 96 ALA MB 3.920 . 4.120 3.466 3.134 3.856 . 0 0 "[ . 1 . 2]" 1
265 1 73 GLN QG 1 80 TRP HE3 4.280 . 4.490 2.718 1.955 3.035 . 0 0 "[ . 1 . 2]" 1
266 1 100 ALA MB 1 103 VAL HB 4.380 . 4.600 4.071 3.879 4.205 . 0 0 "[ . 1 . 2]" 1
267 1 72 TYR HB3 1 93 LYS HG3 5.500 . 5.780 5.160 4.579 5.680 . 0 0 "[ . 1 . 2]" 1
268 1 47 ALA HA 1 52 PHE HB2 3.950 . 4.150 2.125 1.891 2.290 . 0 0 "[ . 1 . 2]" 1
269 1 52 PHE HB2 1 53 ALA HA 5.500 . 5.780 4.690 4.448 4.867 . 0 0 "[ . 1 . 2]" 1
270 1 52 PHE HB2 1 76 VAL HA 5.500 . 5.780 4.793 4.396 4.946 . 0 0 "[ . 1 . 2]" 1
271 1 65 PRO HB3 1 66 HIS HA 5.500 . 5.780 5.466 5.196 5.584 . 0 0 "[ . 1 . 2]" 1
272 1 40 VAL HA 1 94 GLN QG 5.400 . 5.670 5.234 4.976 5.507 . 0 0 "[ . 1 . 2]" 1
273 1 30 GLU HA 1 30 GLU HG3 3.660 . 3.840 3.398 2.486 3.796 . 0 0 "[ . 1 . 2]" 1
274 1 39 PRO HB2 1 101 LEU HG 5.500 . 5.780 4.027 3.781 4.216 . 0 0 "[ . 1 . 2]" 1
275 1 112 GLU QG 1 113 ARG QG 5.500 . 5.780 4.824 2.398 5.927 0.147 10 0 "[ . 1 . 2]" 1
276 1 67 GLU HA 1 68 PRO HG3 5.500 . 5.780 4.755 4.629 4.889 . 0 0 "[ . 1 . 2]" 1
277 1 46 TYR QE 1 50 HIS HB3 4.780 . 5.020 4.656 4.405 4.883 . 0 0 "[ . 1 . 2]" 1
278 1 39 PRO HG3 1 98 ASP HB3 5.500 . 5.780 4.268 4.019 4.814 . 0 0 "[ . 1 . 2]" 1
279 1 73 GLN QB 1 83 ALA MB 4.250 . 4.460 3.017 2.656 3.518 . 0 0 "[ . 1 . 2]" 1
280 1 40 VAL HB 1 56 PHE HZ 5.500 . 5.780 5.521 5.310 5.773 . 0 0 "[ . 1 . 2]" 1
281 1 28 ILE HB 1 105 ILE HA 5.120 . 5.380 4.582 4.007 4.964 . 0 0 "[ . 1 . 2]" 1
282 1 31 LEU HB2 1 105 ILE HA 5.480 . 5.750 4.722 4.558 4.896 . 0 0 "[ . 1 . 2]" 1
283 1 38 ASN QB 1 40 VAL HB 5.410 . 5.680 4.685 4.467 4.959 . 0 0 "[ . 1 . 2]" 1
284 1 42 GLY HA3 1 101 LEU HB3 5.450 . 5.720 5.511 5.099 5.749 0.029 18 0 "[ . 1 . 2]" 1
285 1 28 ILE HB 1 108 ASN HB3 5.500 . 5.780 4.340 3.626 4.959 . 0 0 "[ . 1 . 2]" 1
286 1 43 LEU HB2 1 56 PHE HZ 4.600 . 4.830 3.488 3.160 3.983 . 0 0 "[ . 1 . 2]" 1
287 1 40 VAL HA 1 43 LEU HB2 4.700 . 4.940 3.677 3.521 3.831 . 0 0 "[ . 1 . 2]" 1
288 1 43 LEU HB2 1 43 LEU MD1 3.280 . 3.440 3.166 3.154 3.175 . 0 0 "[ . 1 . 2]" 1
289 1 64 PRO HB3 1 65 PRO HD2 4.110 . 4.320 2.896 2.685 3.606 . 0 0 "[ . 1 . 2]" 1
290 1 113 ARG HB2 1 113 ARG QD 3.740 . 3.930 3.044 2.159 3.500 . 0 0 "[ . 1 . 2]" 1
291 1 61 GLN QB 1 70 PHE HZ 5.500 . 5.780 5.126 4.179 5.879 0.099 10 0 "[ . 1 . 2]" 1
292 1 39 PRO HB3 1 98 ASP HB3 5.200 . 5.460 4.297 4.019 4.705 . 0 0 "[ . 1 . 2]" 1
293 1 57 LYS HB2 1 57 LYS QD 3.610 . 3.790 2.374 2.315 2.476 . 0 0 "[ . 1 . 2]" 1
294 1 71 VAL HB 1 85 CYS HA 5.360 . 5.630 5.126 4.713 5.544 . 0 0 "[ . 1 . 2]" 1
295 1 102 ARG HA 1 105 ILE HG13 4.520 . 4.750 3.918 3.269 4.236 . 0 0 "[ . 1 . 2]" 1
296 1 35 LEU HA 1 35 LEU HG 3.730 . 3.920 3.068 2.927 3.134 . 0 0 "[ . 1 . 2]" 1
297 1 79 ARG HA 1 79 ARG HG2 3.900 . 4.100 2.681 2.288 3.681 . 0 0 "[ . 1 . 2]" 1
298 1 72 TYR QD 1 96 ALA MB 4.320 . 4.540 4.041 3.356 4.511 . 0 0 "[ . 1 . 2]" 1
299 1 83 ALA HA 1 96 ALA MB 5.030 . 5.280 4.534 4.091 4.956 . 0 0 "[ . 1 . 2]" 1
300 1 73 GLN HA 1 96 ALA MB 3.450 . 3.620 3.475 3.296 3.636 0.016 7 0 "[ . 1 . 2]" 1
301 1 59 VAL HB 1 71 VAL HA 5.500 . 5.780 4.995 4.488 5.659 . 0 0 "[ . 1 . 2]" 1
302 1 44 LEU HA 1 47 ALA MB 3.210 . 3.370 3.028 2.755 3.373 0.003 14 0 "[ . 1 . 2]" 1
303 1 47 ALA MB 1 52 PHE QD 3.700 . 3.890 3.897 3.716 3.933 0.043 5 0 "[ . 1 . 2]" 1
304 1 101 LEU HA 1 104 LEU HG 4.580 . 4.810 2.730 2.568 2.984 . 0 0 "[ . 1 . 2]" 1
305 1 64 PRO HG3 1 67 GLU HB3 4.010 . 4.210 4.132 3.195 4.240 0.030 20 0 "[ . 1 . 2]" 1
306 1 40 VAL MG2 1 97 ALA MB 3.310 . 3.480 2.444 2.300 2.554 . 0 0 "[ . 1 . 2]" 1
307 1 31 LEU HB3 1 32 VAL HA 5.500 . 5.780 4.400 4.178 4.498 . 0 0 "[ . 1 . 2]" 1
308 1 31 LEU HB3 1 101 LEU HA 5.500 . 5.780 3.871 3.526 4.246 . 0 0 "[ . 1 . 2]" 1
309 1 43 LEU HB3 1 97 ALA HA 4.600 . 4.830 3.775 3.573 3.980 . 0 0 "[ . 1 . 2]" 1
310 1 56 PHE HA 1 57 LYS HG2 4.830 . 5.070 4.320 3.998 5.061 . 0 0 "[ . 1 . 2]" 1
311 1 96 ALA HA 1 99 ALA MB 3.440 . 3.610 3.069 2.782 3.284 . 0 0 "[ . 1 . 2]" 1
312 1 57 LYS HG2 1 80 TRP HZ3 4.940 . 5.190 2.626 1.999 3.065 . 0 0 "[ . 1 . 2]" 1
313 1 28 ILE HG12 1 108 ASN HB3 4.930 . 5.180 3.889 3.253 4.764 . 0 0 "[ . 1 . 2]" 1
314 1 31 LEU HA 1 101 LEU HB2 5.500 . 5.780 5.791 5.629 5.868 0.088 19 0 "[ . 1 . 2]" 1
315 1 103 VAL MG1 1 107 GLU HA 5.500 . 5.780 5.042 4.812 5.443 . 0 0 "[ . 1 . 2]" 1
316 1 34 TYR HA 1 37 THR MG 4.850 . 5.090 4.138 3.918 4.569 . 0 0 "[ . 1 . 2]" 1
317 1 58 LEU HB3 1 72 TYR HA 5.500 . 5.780 5.600 5.382 5.810 0.030 9 0 "[ . 1 . 2]" 1
318 1 54 ALA MB 1 56 PHE HZ 4.780 . 5.020 4.271 3.955 4.586 . 0 0 "[ . 1 . 2]" 1
319 1 54 ALA MB 1 76 VAL HA 4.530 . 4.760 3.705 3.117 4.135 . 0 0 "[ . 1 . 2]" 1
320 1 105 ILE HA 1 105 ILE HG12 3.800 . 3.990 2.584 2.543 2.637 . 0 0 "[ . 1 . 2]" 1
321 1 28 ILE MG 1 29 GLY HA3 4.920 . 5.170 4.715 4.403 5.029 . 0 0 "[ . 1 . 2]" 1
322 1 31 LEU MD2 1 46 TYR HA 4.180 . 4.390 4.099 3.430 4.413 0.023 7 0 "[ . 1 . 2]" 1
323 1 31 LEU HB2 1 31 LEU MD2 3.180 . 3.340 2.289 2.233 2.362 . 0 0 "[ . 1 . 2]" 1
324 1 31 LEU MD2 1 46 TYR QD 3.580 . 3.760 3.080 2.564 3.503 . 0 0 "[ . 1 . 2]" 1
325 1 74 ALA MB 1 80 TRP HA 5.350 . 5.620 4.825 4.687 4.956 . 0 0 "[ . 1 . 2]" 1
326 1 34 TYR QD 1 101 LEU MD1 4.860 . 5.100 3.641 3.505 3.855 . 0 0 "[ . 1 . 2]" 1
327 1 58 LEU MD1 1 70 PHE QE 5.280 . 5.540 3.678 2.806 4.449 . 0 0 "[ . 1 . 2]" 1
328 1 42 GLY HA2 1 101 LEU MD1 5.050 . 5.300 4.100 3.751 4.460 . 0 0 "[ . 1 . 2]" 1
329 1 40 VAL MG2 1 93 LYS HA 5.100 . 5.360 4.377 4.064 4.656 . 0 0 "[ . 1 . 2]" 1
330 1 76 VAL MG2 1 81 PHE QE 4.020 . 4.220 3.575 3.026 4.050 . 0 0 "[ . 1 . 2]" 1
331 1 46 TYR QD 1 76 VAL MG2 4.500 . 4.730 3.692 3.453 4.016 . 0 0 "[ . 1 . 2]" 1
332 1 84 VAL MG2 1 99 ALA MB 4.000 . 4.200 4.117 3.815 4.255 0.055 5 0 "[ . 1 . 2]" 1
333 1 39 PRO HA 1 101 LEU MD2 4.000 . 4.200 4.185 4.081 4.236 0.036 11 0 "[ . 1 . 2]" 1
334 1 72 TYR QE 1 93 LYS HG2 5.130 . 5.390 3.174 2.738 3.950 . 0 0 "[ . 1 . 2]" 1
335 1 72 TYR QD 1 93 LYS HG2 5.500 . 5.780 3.466 3.000 3.985 . 0 0 "[ . 1 . 2]" 1
336 1 82 PRO HA 1 100 ALA MB 5.130 . 5.390 5.189 4.932 5.300 . 0 0 "[ . 1 . 2]" 1
337 1 43 LEU HB3 1 43 LEU MD2 3.300 . 3.470 3.181 3.175 3.186 . 0 0 "[ . 1 . 2]" 1
338 1 75 LYS HG2 1 80 TRP HH2 5.500 . 5.780 5.375 5.112 5.625 . 0 0 "[ . 1 . 2]" 1
339 1 70 PHE QB 1 72 TYR QE 4.010 . 4.210 2.535 2.037 3.029 . 0 0 "[ . 1 . 2]" 1
340 1 56 PHE HB3 1 72 TYR QE 4.470 . 4.690 3.120 2.179 3.982 . 0 0 "[ . 1 . 2]" 1
341 1 73 GLN QB 1 80 TRP HE3 4.710 . 4.950 3.261 2.780 3.841 . 0 0 "[ . 1 . 2]" 1
342 1 33 ARG QB 1 34 TYR QD 4.780 . 5.020 4.772 4.309 5.035 0.015 7 0 "[ . 1 . 2]" 1
343 1 33 ARG QD 1 34 TYR QE 3.910 . 4.110 4.032 3.303 4.242 0.132 16 0 "[ . 1 . 2]" 1
344 1 56 PHE QE 1 74 ALA HA 4.660 . 4.890 4.474 4.096 4.810 . 0 0 "[ . 1 . 2]" 1
345 1 70 PHE HA 1 72 TYR QD 4.860 . 5.100 4.558 4.059 5.050 . 0 0 "[ . 1 . 2]" 1
346 1 70 PHE QE 1 88 SER HA 3.630 . 3.810 2.759 2.129 3.300 . 0 0 "[ . 1 . 2]" 1
347 1 81 PHE QD 1 82 PRO HA 3.790 . 3.980 3.972 3.779 4.051 0.071 20 0 "[ . 1 . 2]" 1
348 1 68 PRO HA 1 70 PHE HZ 5.500 . 5.780 5.488 4.881 5.826 0.046 7 0 "[ . 1 . 2]" 1
349 1 52 PHE QD 1 76 VAL HA 5.090 . 5.340 5.076 4.519 5.372 0.032 16 0 "[ . 1 . 2]" 1
350 1 80 TRP HA 1 80 TRP HE3 4.190 . 4.400 3.422 3.083 3.580 . 0 0 "[ . 1 . 2]" 1
351 1 79 ARG HA 1 81 PHE QE 5.500 . 5.780 4.882 4.463 5.441 . 0 0 "[ . 1 . 2]" 1
352 1 81 PHE QE 1 103 VAL HA 4.930 . 5.180 5.162 5.010 5.219 0.039 15 0 "[ . 1 . 2]" 1
353 1 81 PHE QE 1 100 ALA HA 4.050 . 4.250 3.321 2.994 3.719 . 0 0 "[ . 1 . 2]" 1
354 1 46 TYR QD 1 47 ALA HA 3.840 . 4.030 3.186 3.044 3.334 . 0 0 "[ . 1 . 2]" 1
355 1 46 TYR QD 1 50 HIS HB2 4.400 . 4.620 4.407 4.242 4.559 . 0 0 "[ . 1 . 2]" 1
356 1 79 ARG HB2 1 81 PHE QD 4.050 . 4.250 3.490 2.804 4.267 0.017 5 0 "[ . 1 . 2]" 1
357 1 79 ARG HB2 1 81 PHE QE 4.160 . 4.370 2.749 1.931 3.992 . 0 0 "[ . 1 . 2]" 1
358 1 46 TYR QD 1 47 ALA MB 3.390 . 3.560 2.868 2.798 2.936 . 0 0 "[ . 1 . 2]" 1
359 1 79 ARG HB3 1 81 PHE QD 4.050 . 4.250 2.290 1.902 2.814 . 0 0 "[ . 1 . 2]" 1
360 1 81 PHE QD 1 103 VAL MG1 3.350 . 3.520 2.602 2.412 2.854 . 0 0 "[ . 1 . 2]" 1
361 1 81 PHE QD 1 103 VAL MG2 3.700 . 3.890 2.147 1.918 2.539 . 0 0 "[ . 1 . 2]" 1
362 1 81 PHE QE 1 103 VAL MG2 4.040 . 4.240 3.297 3.146 3.542 . 0 0 "[ . 1 . 2]" 1
363 1 81 PHE QE 1 103 VAL MG1 3.370 . 3.540 2.713 2.395 2.953 . 0 0 "[ . 1 . 2]" 1
364 1 79 ARG HB3 1 81 PHE QE 4.160 . 4.370 2.438 1.941 2.973 . 0 0 "[ . 1 . 2]" 1
365 1 52 PHE QD 1 53 ALA MB 5.010 . 5.260 5.146 4.938 5.265 0.005 2 0 "[ . 1 . 2]" 1
366 1 46 TYR QD 1 54 ALA MB 4.450 . 4.670 4.270 3.947 4.661 . 0 0 "[ . 1 . 2]" 1
367 1 81 PHE QE 1 100 ALA MB 4.280 . 4.490 3.346 2.886 3.883 . 0 0 "[ . 1 . 2]" 1
368 1 81 PHE QD 1 99 ALA MB 5.320 . 5.590 5.357 5.166 5.570 . 0 0 "[ . 1 . 2]" 1
369 1 63 GLY QA 1 64 PRO HA 4.220 . 4.430 4.093 4.025 4.230 . 0 0 "[ . 1 . 2]" 1
370 1 79 ARG HA 1 79 ARG HD3 4.540 . 4.770 3.405 1.864 4.755 . 0 0 "[ . 1 . 2]" 1
371 1 79 ARG HA 1 79 ARG HD2 4.540 . 4.770 3.822 1.847 4.679 . 0 0 "[ . 1 . 2]" 1
372 1 48 ARG HD2 1 49 SER H 5.160 . 5.420 4.943 4.664 5.194 . 0 0 "[ . 1 . 2]" 1
373 1 45 GLU HA 1 48 ARG HD2 4.420 . 4.640 3.500 2.394 3.951 . 0 0 "[ . 1 . 2]" 1
374 1 33 ARG H 1 33 ARG QD 4.220 . 4.430 3.877 3.592 4.140 . 0 0 "[ . 1 . 2]" 1
375 1 30 GLU QB 1 33 ARG QD 4.060 . 4.260 3.182 2.185 3.989 . 0 0 "[ . 1 . 2]" 1
376 1 48 ARG H 1 48 ARG HD2 4.630 . 4.860 4.654 3.876 4.929 0.069 18 0 "[ . 1 . 2]" 1
377 1 48 ARG HB3 1 48 ARG HD2 3.490 . 3.660 2.874 2.399 3.066 . 0 0 "[ . 1 . 2]" 1
378 1 48 ARG HA 1 48 ARG HD2 4.680 . 4.910 4.719 4.433 4.831 . 0 0 "[ . 1 . 2]" 1
379 1 30 GLU HA 1 33 ARG QD 4.010 . 4.210 2.445 2.093 2.750 . 0 0 "[ . 1 . 2]" 1
380 1 33 ARG HA 1 33 ARG QD 4.470 . 4.690 4.343 4.212 4.551 . 0 0 "[ . 1 . 2]" 1
381 1 33 ARG QB 1 33 ARG QD 2.890 . 3.030 2.181 2.119 2.317 . 0 0 "[ . 1 . 2]" 1
382 1 70 PHE QB 1 72 TYR QD 5.110 . 5.370 2.466 2.190 2.911 . 0 0 "[ . 1 . 2]" 1
383 1 70 PHE QB 1 86 ALA MB 4.710 . 4.950 3.600 2.711 4.308 . 0 0 "[ . 1 . 2]" 1
384 1 70 PHE QB 1 89 LYS QG 5.500 . 5.780 4.210 3.337 5.461 . 0 0 "[ . 1 . 2]" 1
385 1 35 LEU MD1 1 102 ARG HD3 5.960 . 6.260 3.517 2.272 4.816 . 0 0 "[ . 1 . 2]" 1
386 1 35 LEU MD2 1 102 ARG HD3 5.960 . 6.260 3.271 2.085 4.932 . 0 0 "[ . 1 . 2]" 1
387 1 52 PHE HB3 1 53 ALA MB 4.440 . 4.660 4.342 4.154 4.449 . 0 0 "[ . 1 . 2]" 1
388 1 52 PHE HB2 1 76 VAL MG2 5.200 . 5.460 4.891 4.688 5.172 . 0 0 "[ . 1 . 2]" 1
389 1 98 ASP HB2 1 99 ALA MB 5.050 . 5.300 5.149 5.007 5.220 . 0 0 "[ . 1 . 2]" 1
390 1 57 LYS HE2 1 57 LYS HG2 3.650 . 3.830 2.879 2.311 3.173 . 0 0 "[ . 1 . 2]" 1
391 1 57 LYS HE3 1 57 LYS HG2 3.650 . 3.830 2.785 2.401 3.615 . 0 0 "[ . 1 . 2]" 1
392 1 97 ALA H 1 98 ASP HB2 5.150 . 5.410 4.997 4.753 5.164 . 0 0 "[ . 1 . 2]" 1
393 1 90 LYS QE 1 90 LYS HG3 2.920 . 3.070 2.472 2.340 2.931 . 0 0 "[ . 1 . 2]" 1
394 1 90 LYS QE 1 90 LYS HG2 2.920 . 3.070 2.517 2.354 2.969 . 0 0 "[ . 1 . 2]" 1
395 1 43 LEU HB2 1 44 LEU H 4.130 . 4.340 3.754 3.706 3.802 . 0 0 "[ . 1 . 2]" 1
396 1 104 LEU HB2 1 105 ILE H 4.560 . 4.790 2.307 2.161 2.392 . 0 0 "[ . 1 . 2]" 1
397 1 43 LEU HB3 1 97 ALA MB 4.230 . 4.440 2.752 2.570 3.009 . 0 0 "[ . 1 . 2]" 1
398 1 104 LEU HB3 1 105 ILE H 4.560 . 4.790 3.580 3.488 3.688 . 0 0 "[ . 1 . 2]" 1
399 1 31 LEU HB2 1 31 LEU HG 2.940 . 3.090 2.525 2.457 2.569 . 0 0 "[ . 1 . 2]" 1
400 1 31 LEU HB2 1 105 ILE HG13 4.580 . 4.810 3.119 2.824 3.446 . 0 0 "[ . 1 . 2]" 1
401 1 101 LEU H 1 101 LEU HB3 3.660 . 3.840 3.603 3.593 3.618 . 0 0 "[ . 1 . 2]" 1
402 1 35 LEU QB 1 101 LEU HB2 5.170 . 5.430 4.922 4.675 5.096 . 0 0 "[ . 1 . 2]" 1
403 1 32 VAL HA 1 35 LEU QB 3.670 . 3.850 2.901 2.687 3.041 . 0 0 "[ . 1 . 2]" 1
404 1 31 LEU HB3 1 105 ILE HG13 4.400 . 4.620 3.086 2.822 3.256 . 0 0 "[ . 1 . 2]" 1
405 1 101 LEU HB2 1 101 LEU MD1 3.340 . 3.510 2.382 2.363 2.412 . 0 0 "[ . 1 . 2]" 1
406 1 100 ALA MB 1 101 LEU HB2 5.020 . 5.270 4.657 4.567 4.798 . 0 0 "[ . 1 . 2]" 1
407 1 98 ASP HA 1 101 LEU HB2 4.590 . 4.820 3.395 3.211 3.637 . 0 0 "[ . 1 . 2]" 1
408 1 93 LYS HB2 1 93 LYS QE 3.760 . 3.950 2.913 2.637 3.791 . 0 0 "[ . 1 . 2]" 1
409 1 56 PHE QD 1 93 LYS QE 4.360 . 4.580 3.607 2.608 4.569 . 0 0 "[ . 1 . 2]" 1
410 1 90 LYS HA 1 93 LYS QE 5.050 . 5.300 4.698 4.033 5.345 0.045 17 0 "[ . 1 . 2]" 1
411 1 69 LYS QB 1 69 LYS QE 3.240 . 3.400 2.151 1.791 3.159 0.009 9 0 "[ . 1 . 2]" 1
412 1 43 LEU H 1 44 LEU HB2 4.860 . 5.100 4.767 4.706 4.887 . 0 0 "[ . 1 . 2]" 1
413 1 41 GLY H 1 44 LEU HB2 5.500 . 5.780 5.247 5.105 5.501 . 0 0 "[ . 1 . 2]" 1
414 1 44 LEU HB2 1 45 GLU H 3.910 . 4.110 2.667 2.550 2.875 . 0 0 "[ . 1 . 2]" 1
415 1 44 LEU H 1 44 LEU HB3 3.720 . 3.910 3.584 3.576 3.590 . 0 0 "[ . 1 . 2]" 1
416 1 41 GLY QA 1 44 LEU HB3 4.680 . 4.910 4.285 4.058 4.566 . 0 0 "[ . 1 . 2]" 1
417 1 55 GLU HA 1 56 PHE HB2 4.850 . 5.090 4.517 4.415 4.584 . 0 0 "[ . 1 . 2]" 1
418 1 56 PHE HB3 1 93 LYS HB3 5.030 . 5.280 4.109 3.606 4.619 . 0 0 "[ . 1 . 2]" 1
419 1 56 PHE HB2 1 93 LYS HB3 4.920 . 5.170 4.500 4.067 5.010 . 0 0 "[ . 1 . 2]" 1
420 1 108 ASN HB2 1 111 ALA MB 5.140 . 5.400 4.578 3.904 5.475 0.075 5 0 "[ . 1 . 2]" 1
421 1 108 ASN HB3 1 109 GLU QB 4.750 . 4.990 4.585 4.141 5.031 0.041 6 0 "[ . 1 . 2]" 1
422 1 28 ILE MD 1 108 ASN HB3 3.670 . 3.850 2.956 2.210 3.816 . 0 0 "[ . 1 . 2]" 1
423 1 108 ASN HB3 1 111 ALA MB 5.160 . 5.420 4.848 3.984 5.558 0.138 14 0 "[ . 1 . 2]" 1
424 1 28 ILE MD 1 108 ASN HB2 3.640 . 3.820 2.745 2.408 3.317 . 0 0 "[ . 1 . 2]" 1
425 1 74 ALA MB 1 81 PHE QB 5.130 . 5.390 4.877 4.732 4.953 . 0 0 "[ . 1 . 2]" 1
426 1 33 ARG HA 1 36 ASN QB 4.710 . 4.950 2.942 2.678 3.545 . 0 0 "[ . 1 . 2]" 1
427 1 35 LEU HA 1 36 ASN QB 5.320 . 5.590 5.271 5.112 5.513 . 0 0 "[ . 1 . 2]" 1
428 1 35 LEU QB 1 36 ASN QB 4.400 . 4.620 4.045 3.667 4.568 . 0 0 "[ . 1 . 2]" 1
429 1 34 TYR HB3 1 101 LEU HB3 5.500 . 5.780 5.754 5.573 5.835 0.055 7 0 "[ . 1 . 2]" 1
430 1 28 ILE MG 1 105 ILE HB 4.010 . 4.210 3.846 3.707 3.983 . 0 0 "[ . 1 . 2]" 1
431 1 34 TYR HB3 1 39 PRO HA 4.360 . 4.580 2.608 2.355 2.889 . 0 0 "[ . 1 . 2]" 1
432 1 34 TYR HB2 1 42 GLY H 5.170 . 5.430 4.287 4.117 4.559 . 0 0 "[ . 1 . 2]" 1
433 1 104 LEU H 1 105 ILE HB 4.770 . 5.010 4.835 4.625 4.967 . 0 0 "[ . 1 . 2]" 1
434 1 27 LYS HA 1 28 ILE HB 5.110 . 5.370 4.815 4.433 5.285 . 0 0 "[ . 1 . 2]" 1
435 1 46 TYR HB2 1 47 ALA MB 5.420 . 5.690 5.324 5.280 5.371 . 0 0 "[ . 1 . 2]" 1
436 1 37 THR MG 1 38 ASN QB 4.660 . 4.890 2.618 2.438 2.787 . 0 0 "[ . 1 . 2]" 1
437 1 43 LEU HA 1 46 TYR HB2 4.310 . 4.530 3.762 3.510 4.153 . 0 0 "[ . 1 . 2]" 1
438 1 37 THR HB 1 38 ASN QB 4.340 . 4.560 3.580 3.396 3.677 . 0 0 "[ . 1 . 2]" 1
439 1 30 GLU HA 1 30 GLU HG2 3.660 . 3.840 2.938 2.350 3.740 . 0 0 "[ . 1 . 2]" 1
440 1 30 GLU H 1 30 GLU HG3 4.890 . 5.130 3.249 2.184 3.791 . 0 0 "[ . 1 . 2]" 1
441 1 95 GLU HA 1 95 GLU QG 3.310 . 3.480 2.895 2.723 3.015 . 0 0 "[ . 1 . 2]" 1
442 1 54 ALA HA 1 55 GLU HG2 5.500 . 5.780 4.965 3.718 5.515 . 0 0 "[ . 1 . 2]" 1
443 1 91 GLN HA 1 95 GLU QG 4.580 . 4.810 3.477 2.965 3.940 . 0 0 "[ . 1 . 2]" 1
444 1 107 GLU H 1 107 GLU QG 4.130 . 4.340 3.306 2.086 4.055 . 0 0 "[ . 1 . 2]" 1
445 1 104 LEU HA 1 107 GLU QG 4.240 . 4.450 3.845 2.543 4.494 0.044 19 0 "[ . 1 . 2]" 1
446 1 105 ILE MG 1 109 GLU QG 4.370 . 4.590 3.330 2.112 4.574 . 0 0 "[ . 1 . 2]" 1
447 1 55 GLU H 1 55 GLU HG3 4.430 . 4.650 3.235 2.885 4.627 . 0 0 "[ . 1 . 2]" 1
448 1 54 ALA HA 1 55 GLU HG3 5.500 . 5.780 4.343 3.881 5.675 . 0 0 "[ . 1 . 2]" 1
449 1 111 ALA MB 1 112 GLU QG 5.290 . 5.550 4.594 3.359 5.608 0.058 16 0 "[ . 1 . 2]" 1
450 1 45 GLU HG2 1 46 TYR HA 5.200 . 5.460 4.855 4.611 5.307 . 0 0 "[ . 1 . 2]" 1
451 1 45 GLU HG2 1 46 TYR H 4.100 . 4.300 3.664 2.822 4.209 . 0 0 "[ . 1 . 2]" 1
452 1 34 TYR QE 1 45 GLU HG3 4.390 . 4.610 3.979 3.533 4.356 . 0 0 "[ . 1 . 2]" 1
453 1 45 GLU HG3 1 46 TYR H 4.100 . 4.300 2.881 2.035 3.328 . 0 0 "[ . 1 . 2]" 1
454 1 45 GLU H 1 45 GLU HG3 3.930 . 4.130 3.694 2.387 4.187 0.057 12 0 "[ . 1 . 2]" 1
455 1 45 GLU HG3 1 46 TYR HA 5.200 . 5.460 3.417 3.148 3.982 . 0 0 "[ . 1 . 2]" 1
456 1 84 VAL HB 1 95 GLU QG 5.500 . 5.780 4.143 3.734 4.604 . 0 0 "[ . 1 . 2]" 1
457 1 84 VAL HB 1 96 ALA MB 5.500 . 5.780 4.681 4.450 5.103 . 0 0 "[ . 1 . 2]" 1
458 1 76 VAL HB 1 79 ARG HB3 5.230 . 5.490 4.085 3.082 5.095 . 0 0 "[ . 1 . 2]" 1
459 1 75 LYS HA 1 76 VAL HB 4.900 . 5.150 4.725 4.653 4.804 . 0 0 "[ . 1 . 2]" 1
460 1 47 ALA MB 1 76 VAL HB 5.380 . 5.650 4.929 4.641 5.218 . 0 0 "[ . 1 . 2]" 1
461 1 76 VAL HB 1 104 LEU MD1 5.500 . 5.780 5.525 5.167 5.797 0.017 15 0 "[ . 1 . 2]" 1
462 1 40 VAL HA 1 44 LEU MD1 5.360 . 5.630 4.453 4.276 4.580 . 0 0 "[ . 1 . 2]" 1
463 1 40 VAL HA 1 44 LEU H 4.570 . 4.800 4.178 3.982 4.401 . 0 0 "[ . 1 . 2]" 1
464 1 55 GLU HB2 1 75 LYS HB3 4.840 . 5.080 2.239 1.776 4.468 0.024 11 0 "[ . 1 . 2]" 1
465 1 55 GLU HB3 1 75 LYS HB3 4.840 . 5.080 3.498 3.063 4.529 . 0 0 "[ . 1 . 2]" 1
466 1 73 GLN H 1 73 GLN QG 4.720 . 4.960 4.107 4.024 4.148 . 0 0 "[ . 1 . 2]" 1
467 1 90 LYS HA 1 91 GLN QG 5.500 . 5.780 5.333 5.124 5.676 . 0 0 "[ . 1 . 2]" 1
468 1 91 GLN QG 1 95 GLU H 5.500 . 5.780 5.472 5.094 5.839 0.059 6 0 "[ . 1 . 2]" 1
469 1 40 VAL MG2 1 94 GLN QG 4.340 . 4.560 2.223 2.014 2.469 . 0 0 "[ . 1 . 2]" 1
470 1 91 GLN HA 1 91 GLN QG 3.260 . 3.420 2.483 2.266 2.870 . 0 0 "[ . 1 . 2]" 1
471 1 86 ALA MB 1 91 GLN QG 3.600 . 3.780 3.697 3.334 3.866 0.086 15 0 "[ . 1 . 2]" 1
472 1 94 GLN QG 1 95 GLU H 4.340 . 4.560 4.092 3.967 4.179 . 0 0 "[ . 1 . 2]" 1
473 1 94 GLN QG 1 98 ASP H 5.500 . 5.780 5.647 5.491 5.749 . 0 0 "[ . 1 . 2]" 1
474 1 94 GLN HA 1 94 GLN QG 3.570 . 3.750 2.398 2.337 2.448 . 0 0 "[ . 1 . 2]" 1
475 1 40 VAL MG1 1 94 GLN QG 4.340 . 4.560 4.317 4.137 4.576 0.016 17 0 "[ . 1 . 2]" 1
476 1 94 GLN H 1 94 GLN QG 3.280 . 3.440 2.302 2.142 2.448 . 0 0 "[ . 1 . 2]" 1
477 1 38 ASN HA 1 94 GLN QG 5.380 . 5.650 5.304 4.873 5.667 0.017 18 0 "[ . 1 . 2]" 1
478 1 90 LYS QB 1 91 GLN HA 4.530 . 4.760 4.250 4.056 4.483 . 0 0 "[ . 1 . 2]" 1
479 1 91 GLN HA 1 94 GLN QG 4.920 . 5.170 3.603 2.966 4.143 . 0 0 "[ . 1 . 2]" 1
480 1 94 GLN QG 1 97 ALA MB 4.320 . 4.540 4.365 4.094 4.564 0.024 9 0 "[ . 1 . 2]" 1
481 1 93 LYS HB3 1 94 GLN QG 4.740 . 4.980 4.197 3.852 4.542 . 0 0 "[ . 1 . 2]" 1
482 1 89 LYS QE 1 90 LYS QB 4.890 . 5.130 4.492 3.254 5.221 0.091 9 0 "[ . 1 . 2]" 1
483 1 57 LYS H 1 57 LYS HB2 3.920 . 4.120 3.796 3.712 3.870 . 0 0 "[ . 1 . 2]" 1
484 1 72 TYR QD 1 73 GLN QB 5.500 . 5.780 5.310 5.105 5.626 . 0 0 "[ . 1 . 2]" 1
485 1 59 VAL MG1 1 73 GLN QB 4.150 . 4.360 3.931 3.646 4.214 . 0 0 "[ . 1 . 2]" 1
486 1 61 GLN H 1 61 GLN QG 4.660 . 4.890 3.107 1.987 4.128 . 0 0 "[ . 1 . 2]" 1
487 1 61 GLN QG 1 70 PHE HZ 5.500 . 5.780 5.137 4.092 5.852 0.072 15 0 "[ . 1 . 2]" 1
488 1 73 GLN QB 1 73 GLN HE22 4.460 . 4.680 3.887 3.563 4.058 . 0 0 "[ . 1 . 2]" 1
489 1 61 GLN QG 1 62 SER H 4.850 . 5.090 3.898 2.748 4.589 . 0 0 "[ . 1 . 2]" 1
490 1 58 LEU MD1 1 61 GLN QG 4.770 . 5.010 3.680 2.303 4.230 . 0 0 "[ . 1 . 2]" 1
491 1 58 LEU MD2 1 61 GLN QG 4.770 . 5.010 3.137 1.899 4.299 . 0 0 "[ . 1 . 2]" 1
492 1 59 VAL HB 1 71 VAL HB 4.710 . 4.950 2.745 2.075 3.633 . 0 0 "[ . 1 . 2]" 1
493 1 59 VAL H 1 71 VAL HB 5.470 . 5.740 3.665 3.426 4.053 . 0 0 "[ . 1 . 2]" 1
494 1 59 VAL H 1 59 VAL HB 4.040 . 4.240 2.541 2.493 2.596 . 0 0 "[ . 1 . 2]" 1
495 1 76 VAL HB 1 79 ARG HB2 5.230 . 5.490 3.755 3.020 4.768 . 0 0 "[ . 1 . 2]" 1
496 1 64 PRO HA 1 65 PRO HB3 4.970 . 5.220 5.107 4.936 5.333 0.113 9 0 "[ . 1 . 2]" 1
497 1 32 VAL HB 1 33 ARG H 3.800 . 3.990 2.686 2.600 2.820 . 0 0 "[ . 1 . 2]" 1
498 1 65 PRO HB2 1 68 PRO HD3 5.330 . 5.600 5.587 5.367 5.685 0.085 10 0 "[ . 1 . 2]" 1
499 1 61 GLN QB 1 71 VAL H 5.170 . 5.430 3.970 3.203 4.855 . 0 0 "[ . 1 . 2]" 1
500 1 113 ARG HB2 1 113 ARG QG 2.580 . 2.710 2.259 2.142 2.517 . 0 0 "[ . 1 . 2]" 1
501 1 58 LEU MD1 1 61 GLN QB 3.660 . 3.840 2.914 2.376 3.923 0.083 1 0 "[ . 1 . 2]" 1
502 1 113 ARG HB3 1 113 ARG QG 2.580 . 2.710 2.337 2.148 2.467 . 0 0 "[ . 1 . 2]" 1
503 1 105 ILE HA 1 105 ILE MD 4.170 . 4.380 3.851 3.838 3.869 . 0 0 "[ . 1 . 2]" 1
504 1 102 ARG H 1 103 VAL HB 5.040 . 5.290 4.971 4.868 5.057 . 0 0 "[ . 1 . 2]" 1
505 1 81 PHE QE 1 103 VAL HB 4.300 . 4.510 2.285 2.110 2.520 . 0 0 "[ . 1 . 2]" 1
506 1 93 LYS H 1 93 LYS HB3 3.660 . 3.840 3.592 3.582 3.608 . 0 0 "[ . 1 . 2]" 1
507 1 93 LYS HB3 1 94 GLN HA 4.740 . 4.980 4.361 4.254 4.485 . 0 0 "[ . 1 . 2]" 1
508 1 90 LYS HA 1 93 LYS HB2 5.150 . 5.410 3.215 2.615 3.812 . 0 0 "[ . 1 . 2]" 1
509 1 93 LYS HB2 1 94 GLN HA 5.500 . 5.780 4.230 4.114 4.335 . 0 0 "[ . 1 . 2]" 1
510 1 39 PRO HB2 1 98 ASP HB2 4.730 . 4.970 3.118 2.826 3.366 . 0 0 "[ . 1 . 2]" 1
511 1 40 VAL HB 1 41 GLY QA 4.040 . 4.240 3.806 3.757 3.864 . 0 0 "[ . 1 . 2]" 1
512 1 39 PRO HB3 1 98 ASP HB2 4.600 . 4.830 2.830 2.470 3.265 . 0 0 "[ . 1 . 2]" 1
513 1 39 PRO HB3 1 97 ALA H 5.500 . 5.780 5.800 5.747 5.833 0.053 2 0 "[ . 1 . 2]" 1
514 1 40 VAL HB 1 97 ALA MB 4.190 . 4.400 4.191 4.090 4.270 . 0 0 "[ . 1 . 2]" 1
515 1 64 PRO HB2 1 67 GLU HB3 5.060 . 5.310 5.224 4.339 5.366 0.056 16 0 "[ . 1 . 2]" 1
516 1 64 PRO HD2 1 67 GLU HB2 4.440 . 4.660 3.395 2.662 4.447 . 0 0 "[ . 1 . 2]" 1
517 1 64 PRO HB2 1 67 GLU HB2 4.070 . 4.270 3.795 3.543 4.280 0.010 12 0 "[ . 1 . 2]" 1
518 1 111 ALA MB 1 112 GLU QB 4.450 . 4.670 4.233 3.565 4.678 0.008 1 0 "[ . 1 . 2]" 1
519 1 64 PRO HD3 1 67 GLU HB2 5.500 . 5.780 4.479 3.947 5.546 . 0 0 "[ . 1 . 2]" 1
520 1 66 HIS HD2 1 67 GLU HB3 4.470 . 4.690 4.624 4.087 4.723 0.033 8 0 "[ . 1 . 2]" 1
521 1 64 PRO HD2 1 67 GLU HB3 4.730 . 4.970 3.427 2.393 4.258 . 0 0 "[ . 1 . 2]" 1
522 1 64 PRO HG2 1 67 GLU HB3 3.140 . 3.300 3.039 2.057 3.198 . 0 0 "[ . 1 . 2]" 1
523 1 50 HIS HB2 1 51 GLY HA3 5.130 . 5.390 5.114 4.908 5.280 . 0 0 "[ . 1 . 2]" 1
524 1 50 HIS HB3 1 51 GLY HA3 4.970 . 5.220 4.802 4.575 4.942 . 0 0 "[ . 1 . 2]" 1
525 1 47 ALA HA 1 50 HIS HB2 4.910 . 5.160 3.018 2.898 3.121 . 0 0 "[ . 1 . 2]" 1
526 1 105 ILE HA 1 109 GLU QB 5.360 . 5.630 4.918 4.210 5.652 0.022 17 0 "[ . 1 . 2]" 1
527 1 105 ILE MG 1 109 GLU QB 4.000 . 4.200 3.494 2.578 4.303 0.103 9 0 "[ . 1 . 2]" 1
528 1 30 GLU QB 1 33 ARG QB 5.030 . 5.280 4.518 3.492 5.320 0.040 14 0 "[ . 1 . 2]" 1
529 1 104 LEU HA 1 107 GLU QB 4.430 . 4.650 2.788 2.536 3.055 . 0 0 "[ . 1 . 2]" 1
530 1 103 VAL MG1 1 107 GLU QB 4.450 . 4.670 3.389 2.694 4.247 . 0 0 "[ . 1 . 2]" 1
531 1 45 GLU HA 1 48 ARG HB3 3.480 . 3.650 3.353 1.827 3.689 0.039 15 0 "[ . 1 . 2]" 1
532 1 48 ARG HB3 1 48 ARG HD3 3.720 . 3.910 2.722 2.344 3.695 . 0 0 "[ . 1 . 2]" 1
533 1 47 ALA MB 1 48 ARG HB3 4.280 . 4.490 3.814 3.691 4.278 . 0 0 "[ . 1 . 2]" 1
534 1 48 ARG HB2 1 49 SER H 4.380 . 4.600 3.995 3.906 4.078 . 0 0 "[ . 1 . 2]" 1
535 1 45 GLU HA 1 48 ARG HB2 4.420 . 4.640 4.424 3.394 4.666 0.026 15 0 "[ . 1 . 2]" 1
536 1 48 ARG HB2 1 48 ARG HD2 3.640 . 3.820 2.605 2.418 3.067 . 0 0 "[ . 1 . 2]" 1
537 1 48 ARG HB2 1 48 ARG HD3 3.700 . 3.890 3.240 3.040 3.773 . 0 0 "[ . 1 . 2]" 1
538 1 105 ILE HA 1 105 ILE HG13 3.820 . 4.010 2.850 2.817 2.914 . 0 0 "[ . 1 . 2]" 1
539 1 31 LEU HG 1 105 ILE HG13 3.770 . 3.960 3.722 3.528 3.862 . 0 0 "[ . 1 . 2]" 1
540 1 105 ILE H 1 105 ILE HG12 4.010 . 4.210 3.479 3.396 3.559 . 0 0 "[ . 1 . 2]" 1
541 1 105 ILE HG12 1 105 ILE MG 3.470 . 3.640 2.322 2.290 2.352 . 0 0 "[ . 1 . 2]" 1
542 1 30 GLU QB 1 32 VAL H 4.980 . 5.230 4.576 4.389 4.743 . 0 0 "[ . 1 . 2]" 1
543 1 30 GLU QB 1 31 LEU MD1 4.310 . 4.530 3.642 3.081 4.538 0.008 2 0 "[ . 1 . 2]" 1
544 1 106 GLY H 1 107 GLU QB 4.570 . 4.800 4.516 4.352 4.762 . 0 0 "[ . 1 . 2]" 1
545 1 48 ARG H 1 49 SER HB2 5.020 . 5.270 5.035 4.392 5.273 0.003 18 0 "[ . 1 . 2]" 1
546 1 48 ARG H 1 49 SER HB3 5.380 . 5.650 4.978 4.702 5.832 0.182 2 0 "[ . 1 . 2]" 1
547 1 85 CYS HB3 1 86 ALA H 4.410 . 4.630 4.192 3.615 4.413 . 0 0 "[ . 1 . 2]" 1
548 1 85 CYS H 1 85 CYS HB3 4.060 . 4.260 3.302 3.000 3.801 . 0 0 "[ . 1 . 2]" 1
549 1 30 GLU QB 1 33 ARG HG2 5.080 . 5.330 3.763 3.249 4.205 . 0 0 "[ . 1 . 2]" 1
550 1 102 ARG QB 1 103 VAL HB 5.100 . 5.360 4.913 4.719 5.140 . 0 0 "[ . 1 . 2]" 1
551 1 89 LYS QD 1 93 LYS H 5.070 . 5.320 4.667 3.751 5.471 0.151 4 0 "[ . 1 . 2]" 1
552 1 89 LYS HA 1 89 LYS QD 4.340 . 4.560 3.691 3.269 4.225 . 0 0 "[ . 1 . 2]" 1
553 1 85 CYS HB2 1 86 ALA H 4.410 . 4.630 3.564 2.885 4.296 . 0 0 "[ . 1 . 2]" 1
554 1 72 TYR QE 1 89 LYS QD 4.770 . 5.010 3.958 3.222 4.847 . 0 0 "[ . 1 . 2]" 1
555 1 28 ILE HA 1 28 ILE MD 2.620 . 2.750 1.944 1.809 2.066 . 0 0 "[ . 1 . 2]" 1
556 1 32 VAL MG2 1 33 ARG QB 5.410 . 5.680 5.156 4.957 5.424 . 0 0 "[ . 1 . 2]" 1
557 1 33 ARG QB 1 34 TYR HB2 5.500 . 5.780 5.457 5.145 5.621 . 0 0 "[ . 1 . 2]" 1
558 1 93 LYS HA 1 93 LYS QD 4.260 . 4.470 4.237 4.199 4.268 . 0 0 "[ . 1 . 2]" 1
559 1 56 PHE HB3 1 93 LYS QD 4.990 . 5.240 4.389 3.687 5.045 . 0 0 "[ . 1 . 2]" 1
560 1 28 ILE HA 1 31 LEU H 4.360 . 4.580 3.221 3.008 3.440 . 0 0 "[ . 1 . 2]" 1
561 1 28 ILE HA 1 31 LEU HB2 3.640 . 3.820 3.213 2.574 3.741 . 0 0 "[ . 1 . 2]" 1
562 1 28 ILE HA 1 31 LEU HG 4.060 . 4.260 4.003 3.322 4.295 0.035 13 0 "[ . 1 . 2]" 1
563 1 32 VAL HA 1 33 ARG QB 5.490 . 5.760 5.361 5.187 5.499 . 0 0 "[ . 1 . 2]" 1
564 1 32 VAL MG1 1 33 ARG QB 5.410 . 5.680 4.385 4.205 4.656 . 0 0 "[ . 1 . 2]" 1
565 1 56 PHE QD 1 93 LYS QD 5.120 . 5.380 4.996 4.371 5.372 . 0 0 "[ . 1 . 2]" 1
566 1 90 LYS HA 1 93 LYS QD 4.200 . 4.410 2.862 2.240 3.715 . 0 0 "[ . 1 . 2]" 1
567 1 93 LYS HB2 1 93 LYS QD 3.310 . 3.480 2.435 2.334 2.542 . 0 0 "[ . 1 . 2]" 1
568 1 27 LYS HA 1 27 LYS QD 3.770 . 3.960 3.136 1.829 4.168 0.208 17 0 "[ . 1 . 2]" 1
569 1 57 LYS QD 1 58 LEU H 4.830 . 5.070 4.464 3.662 4.977 . 0 0 "[ . 1 . 2]" 1
570 1 95 GLU H 1 95 GLU HB3 3.750 . 3.940 3.592 3.567 3.612 . 0 0 "[ . 1 . 2]" 1
571 1 45 GLU HB2 1 46 TYR H 4.360 . 4.580 3.949 3.784 4.046 . 0 0 "[ . 1 . 2]" 1
572 1 57 LYS QD 1 75 LYS HB2 4.890 . 5.130 4.348 3.742 4.941 . 0 0 "[ . 1 . 2]" 1
573 1 46 TYR HA 1 49 SER H 5.130 . 5.390 3.872 3.753 4.043 . 0 0 "[ . 1 . 2]" 1
574 1 46 TYR HA 1 47 ALA MB 5.270 . 5.530 5.028 5.017 5.037 . 0 0 "[ . 1 . 2]" 1
575 1 39 PRO HG2 1 98 ASP H 4.640 . 4.870 3.960 3.710 4.173 . 0 0 "[ . 1 . 2]" 1
576 1 39 PRO HG2 1 40 VAL H 3.960 . 4.160 2.392 2.282 2.503 . 0 0 "[ . 1 . 2]" 1
577 1 39 PRO HG2 1 97 ALA MB 4.040 . 4.240 3.093 2.831 3.334 . 0 0 "[ . 1 . 2]" 1
578 1 39 PRO HG3 1 40 VAL H 3.960 . 4.160 3.932 3.847 4.019 . 0 0 "[ . 1 . 2]" 1
579 1 38 ASN HA 1 39 PRO HG3 4.500 . 4.730 4.371 4.334 4.397 . 0 0 "[ . 1 . 2]" 1
580 1 39 PRO HG3 1 97 ALA MB 4.040 . 4.240 4.043 3.854 4.255 0.015 5 0 "[ . 1 . 2]" 1
581 1 28 ILE H 1 28 ILE HG13 4.950 . 5.200 3.707 3.506 4.252 . 0 0 "[ . 1 . 2]" 1
582 1 28 ILE HG13 1 105 ILE HA 5.270 . 5.530 3.768 3.160 4.120 . 0 0 "[ . 1 . 2]" 1
583 1 28 ILE HA 1 28 ILE HG13 3.710 . 3.900 3.690 3.613 3.754 . 0 0 "[ . 1 . 2]" 1
584 1 28 ILE HG13 1 108 ASN HB3 4.930 . 5.180 2.280 1.793 3.013 0.007 16 0 "[ . 1 . 2]" 1
585 1 28 ILE HG13 1 108 ASN HB2 4.990 . 5.240 3.058 2.420 3.789 . 0 0 "[ . 1 . 2]" 1
586 1 28 ILE HA 1 28 ILE HG12 3.710 . 3.900 3.062 2.985 3.162 . 0 0 "[ . 1 . 2]" 1
587 1 28 ILE HG12 1 105 ILE HA 5.270 . 5.530 5.115 4.641 5.470 . 0 0 "[ . 1 . 2]" 1
588 1 28 ILE HG12 1 108 ASN HB2 4.990 . 5.240 4.285 3.739 4.974 . 0 0 "[ . 1 . 2]" 1
589 1 64 PRO HA 1 65 PRO HD2 3.540 . 3.720 2.547 2.336 3.147 . 0 0 "[ . 1 . 2]" 1
590 1 48 ARG H 1 49 SER HA 5.320 . 5.590 5.275 5.075 5.419 . 0 0 "[ . 1 . 2]" 1
591 1 64 PRO HA 1 65 PRO HG3 4.700 . 4.940 4.534 3.836 4.729 . 0 0 "[ . 1 . 2]" 1
592 1 64 PRO HA 1 65 PRO HG2 4.700 . 4.940 4.578 4.490 4.688 . 0 0 "[ . 1 . 2]" 1
593 1 44 LEU HG 1 45 GLU H 4.840 . 5.080 4.377 4.287 4.552 . 0 0 "[ . 1 . 2]" 1
594 1 40 VAL HA 1 44 LEU HG 4.950 . 5.200 3.981 3.715 4.089 . 0 0 "[ . 1 . 2]" 1
595 1 102 ARG HA 1 106 GLY HA3 5.360 . 5.630 5.236 5.008 5.434 . 0 0 "[ . 1 . 2]" 1
596 1 44 LEU H 1 44 LEU HG 3.280 . 3.440 2.283 2.206 2.412 . 0 0 "[ . 1 . 2]" 1
597 1 43 LEU H 1 44 LEU HG 5.100 . 5.360 4.400 4.294 4.534 . 0 0 "[ . 1 . 2]" 1
598 1 41 GLY H 1 44 LEU HG 5.500 . 5.780 5.051 4.899 5.241 . 0 0 "[ . 1 . 2]" 1
599 1 44 LEU HG 1 56 PHE HZ 4.850 . 5.090 3.825 3.705 3.965 . 0 0 "[ . 1 . 2]" 1
600 1 58 LEU HA 1 58 LEU HG 4.180 . 4.390 2.766 2.446 3.195 . 0 0 "[ . 1 . 2]" 1
601 1 41 GLY QA 1 44 LEU HG 4.320 . 4.540 3.599 3.330 3.916 . 0 0 "[ . 1 . 2]" 1
602 1 58 LEU HG 1 59 VAL H 4.690 . 4.920 3.553 3.101 3.924 . 0 0 "[ . 1 . 2]" 1
603 1 58 LEU H 1 58 LEU HG 4.630 . 4.860 4.444 4.374 4.538 . 0 0 "[ . 1 . 2]" 1
604 1 79 ARG H 1 79 ARG HG2 4.850 . 5.090 3.793 2.582 4.793 . 0 0 "[ . 1 . 2]" 1
605 1 101 LEU HG 1 102 ARG H 5.500 . 5.780 4.217 4.003 4.325 . 0 0 "[ . 1 . 2]" 1
606 1 39 PRO HA 1 101 LEU HG 5.500 . 5.780 3.941 3.786 4.127 . 0 0 "[ . 1 . 2]" 1
607 1 43 LEU HA 1 101 LEU HG 5.500 . 5.780 4.289 4.126 4.518 . 0 0 "[ . 1 . 2]" 1
608 1 101 LEU HA 1 101 LEU HG 3.900 . 4.100 3.245 3.183 3.377 . 0 0 "[ . 1 . 2]" 1
609 1 100 ALA MB 1 101 LEU HG 3.470 . 3.640 3.388 3.264 3.563 . 0 0 "[ . 1 . 2]" 1
610 1 92 GLY QA 1 93 LYS HA 4.170 . 4.380 4.031 3.977 4.065 . 0 0 "[ . 1 . 2]" 1
611 1 48 ARG HG2 1 49 SER H 4.150 . 4.360 2.411 2.241 3.067 . 0 0 "[ . 1 . 2]" 1
612 1 113 ARG HA 1 113 ARG QG 3.700 . 3.890 3.128 2.436 3.469 . 0 0 "[ . 1 . 2]" 1
613 1 67 GLU HA 1 68 PRO HG2 5.500 . 5.780 4.383 4.138 4.844 . 0 0 "[ . 1 . 2]" 1
614 1 33 ARG HG2 1 34 TYR HA 4.970 . 5.220 3.927 3.002 4.806 . 0 0 "[ . 1 . 2]" 1
615 1 30 GLU HA 1 33 ARG HG3 4.920 . 5.170 4.415 3.557 4.824 . 0 0 "[ . 1 . 2]" 1
616 1 33 ARG HA 1 33 ARG HG3 3.640 . 3.820 3.586 3.304 3.771 . 0 0 "[ . 1 . 2]" 1
617 1 33 ARG HG3 1 34 TYR HA 4.840 . 5.080 3.469 3.279 3.934 . 0 0 "[ . 1 . 2]" 1
618 1 68 PRO HG3 1 70 PHE HZ 5.190 . 5.450 4.229 3.077 5.478 0.028 12 0 "[ . 1 . 2]" 1
619 1 64 PRO HG2 1 67 GLU HA 5.500 . 5.780 4.168 3.996 4.349 . 0 0 "[ . 1 . 2]" 1
620 1 33 ARG HA 1 33 ARG HG2 3.850 . 4.040 3.757 3.534 3.828 . 0 0 "[ . 1 . 2]" 1
621 1 64 PRO HG3 1 67 GLU H 4.380 . 4.600 4.202 3.896 4.443 . 0 0 "[ . 1 . 2]" 1
622 1 33 ARG H 1 33 ARG HG3 4.310 . 4.530 3.969 3.390 4.462 . 0 0 "[ . 1 . 2]" 1
623 1 33 ARG HG3 1 34 TYR QD 4.550 . 4.780 4.001 3.664 4.773 . 0 0 "[ . 1 . 2]" 1
624 1 94 GLN HA 1 95 GLU HA 4.910 . 5.160 4.782 4.714 4.846 . 0 0 "[ . 1 . 2]" 1
625 1 35 LEU HG 1 105 ILE MD 4.240 . 4.450 3.009 2.840 3.242 . 0 0 "[ . 1 . 2]" 1
626 1 43 LEU HG 1 44 LEU H 5.060 . 5.310 5.006 4.917 5.051 . 0 0 "[ . 1 . 2]" 1
627 1 43 LEU HG 1 97 ALA HA 4.650 . 4.880 2.420 2.166 2.667 . 0 0 "[ . 1 . 2]" 1
628 1 43 LEU HG 1 76 VAL MG2 4.360 . 4.580 3.720 3.494 3.979 . 0 0 "[ . 1 . 2]" 1
629 1 43 LEU H 1 43 LEU HG 4.660 . 4.890 4.546 4.527 4.558 . 0 0 "[ . 1 . 2]" 1
630 1 43 LEU H 1 43 LEU MD2 4.340 . 4.560 3.963 3.915 3.994 . 0 0 "[ . 1 . 2]" 1
631 1 43 LEU HA 1 43 LEU MD2 4.110 . 4.320 1.914 1.880 1.950 . 0 0 "[ . 1 . 2]" 1
632 1 43 LEU HB2 1 43 LEU MD2 3.280 . 3.440 2.554 2.536 2.571 . 0 0 "[ . 1 . 2]" 1
633 1 43 LEU MD2 1 76 VAL MG2 3.080 . 3.230 2.220 2.031 2.500 . 0 0 "[ . 1 . 2]" 1
634 1 48 ARG HA 1 48 ARG HG2 4.100 . 4.300 3.759 3.278 3.835 . 0 0 "[ . 1 . 2]" 1
635 1 48 ARG HA 1 48 ARG HG3 4.100 . 4.300 3.621 2.793 3.740 . 0 0 "[ . 1 . 2]" 1
636 1 103 VAL HB 1 104 LEU HG 4.930 . 5.180 3.110 2.973 3.206 . 0 0 "[ . 1 . 2]" 1
637 1 46 TYR QD 1 104 LEU HG 5.500 . 5.780 5.306 5.237 5.411 . 0 0 "[ . 1 . 2]" 1
638 1 81 PHE HZ 1 104 LEU HG 5.500 . 5.780 4.177 3.818 4.623 . 0 0 "[ . 1 . 2]" 1
639 1 104 LEU HA 1 104 LEU HG 3.910 . 4.110 3.245 3.203 3.291 . 0 0 "[ . 1 . 2]" 1
640 1 104 LEU HG 1 105 ILE H 5.110 . 5.370 3.895 3.791 3.979 . 0 0 "[ . 1 . 2]" 1
641 1 81 PHE QE 1 104 LEU HG 5.240 . 5.500 3.067 2.775 3.381 . 0 0 "[ . 1 . 2]" 1
642 1 103 VAL MG1 1 104 LEU HG 5.220 . 5.480 4.096 3.933 4.279 . 0 0 "[ . 1 . 2]" 1
643 1 31 LEU HG 1 105 ILE H 4.650 . 4.880 4.829 4.609 4.904 0.024 1 0 "[ . 1 . 2]" 1
644 1 31 LEU H 1 31 LEU HG 4.120 . 4.330 3.971 3.888 4.101 . 0 0 "[ . 1 . 2]" 1
645 1 31 LEU HG 1 32 VAL H 5.350 . 5.620 5.230 5.143 5.359 . 0 0 "[ . 1 . 2]" 1
646 1 31 LEU HA 1 31 LEU HG 3.920 . 4.120 3.690 3.656 3.728 . 0 0 "[ . 1 . 2]" 1
647 1 43 LEU H 1 101 LEU MD1 3.670 . 3.850 3.054 2.902 3.247 . 0 0 "[ . 1 . 2]" 1
648 1 39 PRO HA 1 101 LEU MD1 4.000 . 4.200 2.059 1.946 2.146 . 0 0 "[ . 1 . 2]" 1
649 1 34 TYR HB3 1 101 LEU MD1 4.800 . 5.040 2.697 2.599 2.823 . 0 0 "[ . 1 . 2]" 1
650 1 34 TYR HB2 1 101 LEU MD1 4.160 . 4.370 2.387 2.283 2.560 . 0 0 "[ . 1 . 2]" 1
651 1 31 LEU HG 1 101 LEU HA 4.460 . 4.680 4.075 3.544 4.551 . 0 0 "[ . 1 . 2]" 1
652 1 31 LEU HG 1 46 TYR QD 4.090 . 4.290 3.816 3.663 4.057 . 0 0 "[ . 1 . 2]" 1
653 1 44 LEU HB2 1 45 GLU HA 4.820 . 5.060 4.306 4.219 4.446 . 0 0 "[ . 1 . 2]" 1
654 1 95 GLU HA 1 96 ALA MB 5.240 . 5.500 5.026 4.998 5.049 . 0 0 "[ . 1 . 2]" 1
655 1 95 GLU HA 1 98 ASP H 4.670 . 4.900 3.507 3.223 3.719 . 0 0 "[ . 1 . 2]" 1
656 1 72 TYR HB3 1 93 LYS HG2 5.500 . 5.780 4.758 3.774 5.601 . 0 0 "[ . 1 . 2]" 1
657 1 90 LYS HA 1 93 LYS HG2 5.330 . 5.600 4.971 4.373 5.637 0.037 17 0 "[ . 1 . 2]" 1
658 1 93 LYS HA 1 93 LYS HG3 3.840 . 4.030 3.082 2.984 3.189 . 0 0 "[ . 1 . 2]" 1
659 1 35 LEU MD1 1 102 ARG H 4.420 . 4.640 3.996 3.448 4.546 . 0 0 "[ . 1 . 2]" 1
660 1 35 LEU H 1 35 LEU MD1 3.660 . 3.840 3.639 3.554 3.721 . 0 0 "[ . 1 . 2]" 1
661 1 35 LEU MD1 1 98 ASP HA 4.900 . 5.150 4.891 4.516 5.176 0.026 9 0 "[ . 1 . 2]" 1
662 1 35 LEU HA 1 35 LEU MD1 3.900 . 4.100 3.849 3.817 3.877 . 0 0 "[ . 1 . 2]" 1
663 1 34 TYR HB2 1 35 LEU MD1 5.220 . 5.480 5.406 5.275 5.496 0.016 3 0 "[ . 1 . 2]" 1
664 1 44 LEU MD2 1 45 GLU H 5.060 . 5.310 4.697 4.673 4.743 . 0 0 "[ . 1 . 2]" 1
665 1 44 LEU MD2 1 56 PHE QE 3.630 . 3.810 2.017 1.890 2.208 . 0 0 "[ . 1 . 2]" 1
666 1 44 LEU HA 1 44 LEU MD2 3.990 . 4.190 2.032 1.961 2.089 . 0 0 "[ . 1 . 2]" 1
667 1 44 LEU HB3 1 44 LEU MD2 3.190 . 3.350 2.346 2.317 2.372 . 0 0 "[ . 1 . 2]" 1
668 1 27 LYS HA 1 27 LYS HG3 3.590 . 3.770 2.940 2.397 3.731 . 0 0 "[ . 1 . 2]" 1
669 1 44 LEU MD2 1 56 PHE HZ 4.500 . 4.730 3.883 3.767 4.057 . 0 0 "[ . 1 . 2]" 1
670 1 40 VAL HA 1 44 LEU MD2 5.360 . 5.630 4.983 4.775 5.123 . 0 0 "[ . 1 . 2]" 1
671 1 35 LEU MD2 1 102 ARG H 4.420 . 4.640 3.178 2.930 3.421 . 0 0 "[ . 1 . 2]" 1
672 1 35 LEU MD2 1 98 ASP HA 4.900 . 5.150 2.477 2.098 2.684 . 0 0 "[ . 1 . 2]" 1
673 1 35 LEU MD2 1 102 ARG HD2 5.960 . 6.260 3.206 2.476 4.422 . 0 0 "[ . 1 . 2]" 1
674 1 34 TYR HB2 1 35 LEU MD2 5.220 . 5.480 4.431 4.214 4.681 . 0 0 "[ . 1 . 2]" 1
675 1 30 GLU HA 1 33 ARG HG2 4.810 . 5.050 3.020 1.989 3.989 . 0 0 "[ . 1 . 2]" 1
676 1 90 LYS HA 1 90 LYS HG3 3.940 . 4.140 3.046 2.449 3.784 . 0 0 "[ . 1 . 2]" 1
677 1 90 LYS HA 1 90 LYS HG2 3.940 . 4.140 3.438 2.945 3.815 . 0 0 "[ . 1 . 2]" 1
678 1 100 ALA MB 1 101 LEU HA 5.400 . 5.670 3.821 3.779 3.869 . 0 0 "[ . 1 . 2]" 1
679 1 43 LEU HA 1 101 LEU HA 4.970 . 5.220 4.997 4.780 5.224 0.004 5 0 "[ . 1 . 2]" 1
680 1 57 LYS H 1 57 LYS HG3 4.210 . 4.420 2.802 1.998 3.368 . 0 0 "[ . 1 . 2]" 1
681 1 57 LYS HG3 1 80 TRP HZ3 4.390 . 4.610 3.522 2.782 4.007 . 0 0 "[ . 1 . 2]" 1
682 1 57 LYS HA 1 57 LYS HG3 4.200 . 4.410 3.681 3.592 3.836 . 0 0 "[ . 1 . 2]" 1
683 1 57 LYS HG2 1 73 GLN H 5.260 . 5.520 4.415 4.090 5.236 . 0 0 "[ . 1 . 2]" 1
684 1 57 LYS HG2 1 75 LYS HB2 4.790 . 5.030 3.651 3.182 3.866 . 0 0 "[ . 1 . 2]" 1
685 1 57 LYS HG2 1 75 LYS QD 5.480 . 5.750 4.333 3.104 4.906 . 0 0 "[ . 1 . 2]" 1
686 1 104 LEU HA 1 104 LEU MD2 4.110 . 4.320 2.168 2.119 2.240 . 0 0 "[ . 1 . 2]" 1
687 1 57 LYS HG3 1 75 LYS HB2 5.010 . 5.260 5.041 3.584 5.314 0.054 3 0 "[ . 1 . 2]" 1
688 1 104 LEU HA 1 107 GLU HA 5.500 . 5.780 5.568 5.284 5.804 0.024 12 0 "[ . 1 . 2]" 1
689 1 43 LEU HA 1 43 LEU HG 3.780 . 3.970 3.670 3.656 3.685 . 0 0 "[ . 1 . 2]" 1
690 1 106 GLY HA3 1 107 GLU HA 4.630 . 4.860 4.359 4.303 4.405 . 0 0 "[ . 1 . 2]" 1
691 1 109 GLU HA 1 109 GLU QG 3.330 . 3.500 2.598 2.367 3.007 . 0 0 "[ . 1 . 2]" 1
692 1 43 LEU HA 1 47 ALA H 5.100 . 5.360 4.227 4.008 4.484 . 0 0 "[ . 1 . 2]" 1
693 1 58 LEU MD2 1 70 PHE QD 3.650 . 3.830 2.691 1.912 3.455 . 0 0 "[ . 1 . 2]" 1
694 1 58 LEU HA 1 58 LEU MD2 3.990 . 4.190 3.367 2.494 3.921 . 0 0 "[ . 1 . 2]" 1
695 1 58 LEU MD2 1 61 GLN QB 3.660 . 3.840 2.241 1.764 3.652 0.036 8 0 "[ . 1 . 2]" 1
696 1 104 LEU MD2 1 105 ILE H 4.520 . 4.750 4.500 4.448 4.545 . 0 0 "[ . 1 . 2]" 1
697 1 76 VAL HB 1 104 LEU MD2 5.500 . 5.780 4.691 4.149 5.121 . 0 0 "[ . 1 . 2]" 1
698 1 104 LEU HB3 1 104 LEU MD2 3.250 . 3.410 2.359 2.326 2.375 . 0 0 "[ . 1 . 2]" 1
699 1 103 VAL H 1 104 LEU MD2 5.390 . 5.660 4.889 4.747 5.005 . 0 0 "[ . 1 . 2]" 1
700 1 104 LEU HB2 1 104 LEU MD2 3.250 . 3.410 3.199 3.193 3.202 . 0 0 "[ . 1 . 2]" 1
701 1 113 ARG HA 1 113 ARG QD 4.600 . 4.830 3.425 1.904 4.553 . 0 0 "[ . 1 . 2]" 1
702 1 70 PHE QD 1 86 ALA MB 4.980 . 5.230 4.120 3.602 4.663 . 0 0 "[ . 1 . 2]" 1
703 1 86 ALA MB 1 91 GLN HA 4.440 . 4.660 4.099 3.973 4.290 . 0 0 "[ . 1 . 2]" 1
704 1 86 ALA MB 1 95 GLU QG 3.080 . 3.230 2.652 1.900 3.231 0.001 10 0 "[ . 1 . 2]" 1
705 1 86 ALA MB 1 95 GLU H 4.570 . 4.800 4.400 4.062 4.780 . 0 0 "[ . 1 . 2]" 1
706 1 86 ALA MB 1 92 GLY QA 3.130 . 3.290 2.245 1.977 2.458 . 0 0 "[ . 1 . 2]" 1
707 1 86 ALA MB 1 91 GLN QB 3.100 . 3.260 2.028 1.838 2.268 . 0 0 "[ . 1 . 2]" 1
708 1 103 VAL HB 1 104 LEU MD2 4.860 . 5.100 3.237 3.163 3.296 . 0 0 "[ . 1 . 2]" 1
709 1 31 LEU HA 1 34 TYR HB2 4.880 . 5.120 2.784 2.443 3.094 . 0 0 "[ . 1 . 2]" 1
710 1 31 LEU HA 1 46 TYR HB2 5.170 . 5.430 5.340 5.092 5.471 0.041 7 0 "[ . 1 . 2]" 1
711 1 43 LEU H 1 101 LEU MD2 3.670 . 3.850 2.713 2.548 2.904 . 0 0 "[ . 1 . 2]" 1
712 1 101 LEU HA 1 101 LEU MD2 4.040 . 4.240 2.057 1.996 2.170 . 0 0 "[ . 1 . 2]" 1
713 1 42 GLY HA3 1 101 LEU MD2 4.270 . 4.480 3.107 2.664 3.336 . 0 0 "[ . 1 . 2]" 1
714 1 42 GLY HA2 1 101 LEU MD2 5.050 . 5.300 4.118 3.693 4.282 . 0 0 "[ . 1 . 2]" 1
715 1 101 LEU HB2 1 101 LEU MD2 3.340 . 3.510 3.193 3.190 3.199 . 0 0 "[ . 1 . 2]" 1
716 1 58 LEU HG 1 72 TYR HA 4.970 . 5.220 4.652 3.916 5.296 0.076 5 0 "[ . 1 . 2]" 1
717 1 50 HIS HA 1 52 PHE H 4.680 . 4.910 4.669 4.543 4.934 0.024 11 0 "[ . 1 . 2]" 1
718 1 43 LEU H 1 43 LEU MD1 4.340 . 4.560 4.244 4.222 4.275 . 0 0 "[ . 1 . 2]" 1
719 1 43 LEU HB3 1 43 LEU MD1 3.300 . 3.470 2.245 2.230 2.265 . 0 0 "[ . 1 . 2]" 1
720 1 43 LEU MD1 1 54 ALA MB 3.530 . 3.710 1.941 1.891 2.019 . 0 0 "[ . 1 . 2]" 1
721 1 61 GLN QB 1 70 PHE HA 4.470 . 4.690 3.124 2.254 3.987 . 0 0 "[ . 1 . 2]" 1
722 1 27 LYS HA 1 30 GLU QB 5.500 . 5.780 5.004 3.555 5.750 . 0 0 "[ . 1 . 2]" 1
723 1 102 ARG QB 1 103 VAL MG2 5.010 . 5.260 3.269 2.980 3.595 . 0 0 "[ . 1 . 2]" 1
724 1 100 ALA MB 1 103 VAL MG2 4.990 . 5.240 3.817 3.599 4.003 . 0 0 "[ . 1 . 2]" 1
725 1 103 VAL MG2 1 104 LEU H 4.470 . 4.690 3.664 3.611 3.732 . 0 0 "[ . 1 . 2]" 1
726 1 100 ALA H 1 103 VAL MG2 4.810 . 5.050 4.198 4.007 4.384 . 0 0 "[ . 1 . 2]" 1
727 1 100 ALA HA 1 103 VAL MG2 4.520 . 4.750 2.495 2.274 2.706 . 0 0 "[ . 1 . 2]" 1
728 1 27 LYS HA 1 28 ILE MD 4.980 . 5.230 4.578 3.802 5.261 0.031 8 0 "[ . 1 . 2]" 1
729 1 86 ALA H 1 87 HIS HA 5.400 . 5.670 4.941 4.583 5.299 . 0 0 "[ . 1 . 2]" 1
730 1 44 LEU MD1 1 45 GLU H 5.060 . 5.310 4.528 4.442 4.727 . 0 0 "[ . 1 . 2]" 1
731 1 44 LEU MD1 1 56 PHE HZ 4.500 . 4.730 4.753 4.739 4.772 0.042 5 0 "[ . 1 . 2]" 1
732 1 41 GLY QA 1 44 LEU MD1 5.060 . 5.310 2.483 2.159 2.873 . 0 0 "[ . 1 . 2]" 1
733 1 44 LEU HB3 1 44 LEU MD1 3.190 . 3.350 2.409 2.388 2.443 . 0 0 "[ . 1 . 2]" 1
734 1 40 VAL MG1 1 97 ALA H 5.500 . 5.780 5.184 4.939 5.396 . 0 0 "[ . 1 . 2]" 1
735 1 40 VAL MG1 1 56 PHE HZ 4.040 . 4.240 3.059 2.815 3.289 . 0 0 "[ . 1 . 2]" 1
736 1 40 VAL HA 1 40 VAL MG1 2.880 . 3.020 2.368 2.340 2.392 . 0 0 "[ . 1 . 2]" 1
737 1 40 VAL MG1 1 93 LYS HA 5.100 . 5.360 5.063 4.703 5.369 0.009 18 0 "[ . 1 . 2]" 1
738 1 40 VAL MG1 1 97 ALA MB 3.310 . 3.480 3.164 2.997 3.298 . 0 0 "[ . 1 . 2]" 1
739 1 31 LEU MD1 1 46 TYR QE 4.860 . 5.100 4.996 4.597 5.160 0.060 6 0 "[ . 1 . 2]" 1
740 1 31 LEU MD1 1 32 VAL H 4.750 . 4.990 4.594 4.485 4.687 . 0 0 "[ . 1 . 2]" 1
741 1 31 LEU MD1 1 34 TYR QD 3.170 . 3.330 2.660 2.392 2.937 . 0 0 "[ . 1 . 2]" 1
742 1 31 LEU HA 1 31 LEU MD1 2.750 . 2.890 1.924 1.854 1.972 . 0 0 "[ . 1 . 2]" 1
743 1 31 LEU MD1 1 101 LEU HA 4.240 . 4.450 3.975 3.466 4.134 . 0 0 "[ . 1 . 2]" 1
744 1 31 LEU MD1 1 46 TYR HB3 4.070 . 4.270 3.126 2.582 3.411 . 0 0 "[ . 1 . 2]" 1
745 1 31 LEU MD1 1 46 TYR HB2 3.530 . 3.710 1.859 1.773 2.061 0.027 13 0 "[ . 1 . 2]" 1
746 1 31 LEU HB3 1 31 LEU MD1 3.100 . 3.260 2.489 2.383 2.570 . 0 0 "[ . 1 . 2]" 1
747 1 47 ALA HA 1 52 PHE H 4.650 . 4.880 3.059 2.819 3.206 . 0 0 "[ . 1 . 2]" 1
748 1 47 ALA HA 1 54 ALA MB 4.850 . 5.090 4.375 4.110 4.700 . 0 0 "[ . 1 . 2]" 1
749 1 47 ALA HA 1 76 VAL MG1 3.840 . 4.030 3.300 2.958 3.637 . 0 0 "[ . 1 . 2]" 1
750 1 31 LEU MD1 1 105 ILE H 5.500 . 5.780 5.759 5.277 5.858 0.078 14 0 "[ . 1 . 2]" 1
751 1 104 LEU MD1 1 105 ILE H 4.520 . 4.750 4.156 4.028 4.238 . 0 0 "[ . 1 . 2]" 1
752 1 104 LEU H 1 104 LEU MD1 3.730 . 3.920 3.483 3.427 3.525 . 0 0 "[ . 1 . 2]" 1
753 1 81 PHE HZ 1 104 LEU MD1 4.480 . 4.700 3.901 3.388 4.367 . 0 0 "[ . 1 . 2]" 1
754 1 104 LEU HA 1 104 LEU MD1 4.110 . 4.320 3.904 3.880 3.940 . 0 0 "[ . 1 . 2]" 1
755 1 103 VAL HB 1 104 LEU MD1 4.860 . 5.100 4.589 4.470 4.686 . 0 0 "[ . 1 . 2]" 1
756 1 104 LEU HB2 1 104 LEU MD1 3.250 . 3.410 2.315 2.279 2.336 . 0 0 "[ . 1 . 2]" 1
757 1 103 VAL MG1 1 104 LEU MD1 4.930 . 5.180 5.026 4.891 5.187 0.007 4 0 "[ . 1 . 2]" 1
758 1 104 LEU HB3 1 104 LEU MD1 3.250 . 3.410 2.395 2.374 2.434 . 0 0 "[ . 1 . 2]" 1
759 1 100 ALA MB 1 104 LEU MD1 4.770 . 5.010 3.342 3.092 3.518 . 0 0 "[ . 1 . 2]" 1
760 1 32 VAL H 1 32 VAL MG1 3.940 . 4.140 3.771 3.757 3.778 . 0 0 "[ . 1 . 2]" 1
761 1 32 VAL MG1 1 33 ARG H 3.920 . 4.120 3.566 3.460 3.749 . 0 0 "[ . 1 . 2]" 1
762 1 32 VAL HA 1 32 VAL MG1 3.310 . 3.480 2.388 2.334 2.439 . 0 0 "[ . 1 . 2]" 1
763 1 59 VAL H 1 59 VAL MG2 4.220 . 4.430 2.186 2.030 2.336 . 0 0 "[ . 1 . 2]" 1
764 1 59 VAL MG2 1 73 GLN QB 4.150 . 4.360 2.063 1.869 2.291 . 0 0 "[ . 1 . 2]" 1
765 1 47 ALA H 1 76 VAL MG1 4.760 . 5.000 4.311 4.031 4.583 . 0 0 "[ . 1 . 2]" 1
766 1 52 PHE H 1 76 VAL MG1 5.150 . 5.410 4.677 4.474 5.012 . 0 0 "[ . 1 . 2]" 1
767 1 52 PHE QD 1 76 VAL MG1 3.390 . 3.560 3.075 2.551 3.505 . 0 0 "[ . 1 . 2]" 1
768 1 46 TYR QD 1 76 VAL MG1 3.320 . 3.490 2.894 2.479 3.210 . 0 0 "[ . 1 . 2]" 1
769 1 76 VAL HA 1 76 VAL MG1 3.150 . 3.310 2.389 2.341 2.441 . 0 0 "[ . 1 . 2]" 1
770 1 52 PHE HB3 1 76 VAL MG1 3.470 . 3.640 2.284 2.112 2.647 . 0 0 "[ . 1 . 2]" 1
771 1 52 PHE HB2 1 76 VAL MG1 3.390 . 3.560 2.649 2.418 2.969 . 0 0 "[ . 1 . 2]" 1
772 1 35 LEU HA 1 36 ASN HA 4.670 . 4.900 4.684 4.639 4.772 . 0 0 "[ . 1 . 2]" 1
773 1 96 ALA HA 1 99 ALA H 4.660 . 4.890 3.803 3.658 3.940 . 0 0 "[ . 1 . 2]" 1
774 1 97 ALA HA 1 100 ALA MB 3.110 . 3.270 2.373 2.207 2.574 . 0 0 "[ . 1 . 2]" 1
775 1 103 VAL MG1 1 104 LEU H 3.630 . 3.810 3.342 3.215 3.510 . 0 0 "[ . 1 . 2]" 1
776 1 81 PHE HZ 1 103 VAL MG1 4.070 . 4.270 4.136 3.874 4.287 0.017 19 0 "[ . 1 . 2]" 1
777 1 103 VAL MG1 1 104 LEU HA 3.790 . 3.980 3.412 3.295 3.583 . 0 0 "[ . 1 . 2]" 1
778 1 103 VAL HA 1 103 VAL MG1 3.040 . 3.190 2.382 2.348 2.423 . 0 0 "[ . 1 . 2]" 1
779 1 103 VAL MG1 1 107 GLU QG 4.310 . 4.530 3.393 2.150 4.555 0.025 9 0 "[ . 1 . 2]" 1
780 1 100 ALA MB 1 103 VAL MG1 5.240 . 5.500 4.830 4.599 4.968 . 0 0 "[ . 1 . 2]" 1
781 1 75 LYS HA 1 76 VAL MG2 4.410 . 4.630 3.785 3.667 3.876 . 0 0 "[ . 1 . 2]" 1
782 1 99 ALA HA 1 101 LEU H 5.010 . 5.260 4.429 4.221 4.596 . 0 0 "[ . 1 . 2]" 1
783 1 99 ALA HA 1 102 ARG H 4.210 . 4.420 3.359 3.098 3.592 . 0 0 "[ . 1 . 2]" 1
784 1 99 ALA HA 1 102 ARG QG 4.430 . 4.650 2.901 1.849 4.492 . 0 0 "[ . 1 . 2]" 1
785 1 103 VAL MG1 1 104 LEU MD2 4.930 . 5.180 3.062 2.855 3.255 . 0 0 "[ . 1 . 2]" 1
786 1 71 VAL H 1 71 VAL MG2 4.450 . 4.670 2.247 2.056 2.520 . 0 0 "[ . 1 . 2]" 1
787 1 100 ALA HA 1 103 VAL MG1 4.690 . 4.920 4.195 4.063 4.343 . 0 0 "[ . 1 . 2]" 1
788 1 59 VAL H 1 59 VAL MG1 4.220 . 4.430 3.786 3.766 3.811 . 0 0 "[ . 1 . 2]" 1
789 1 59 VAL MG1 1 60 ASP H 4.460 . 4.680 3.386 3.265 3.515 . 0 0 "[ . 1 . 2]" 1
790 1 60 ASP H 1 71 VAL MG2 5.010 . 5.260 3.575 3.331 4.032 . 0 0 "[ . 1 . 2]" 1
791 1 108 ASN HA 1 111 ALA MB 3.830 . 4.020 2.501 1.787 3.488 0.013 6 0 "[ . 1 . 2]" 1
792 1 67 GLU HA 1 68 PRO HD2 3.420 . 3.590 2.255 2.027 2.751 . 0 0 "[ . 1 . 2]" 1
793 1 55 GLU HA 1 56 PHE QD 4.340 . 4.560 3.538 3.109 3.830 . 0 0 "[ . 1 . 2]" 1
794 1 84 VAL H 1 84 VAL MG2 3.630 . 3.810 2.098 2.017 2.242 . 0 0 "[ . 1 . 2]" 1
795 1 67 GLU HA 1 68 PRO HD3 3.660 . 3.840 2.932 2.589 3.166 . 0 0 "[ . 1 . 2]" 1
796 1 31 LEU MD2 1 34 TYR QD 4.790 . 5.030 4.059 3.667 4.301 . 0 0 "[ . 1 . 2]" 1
797 1 31 LEU MD2 1 46 TYR HB2 4.560 . 4.790 3.341 2.321 3.728 . 0 0 "[ . 1 . 2]" 1
798 1 55 GLU H 1 76 VAL MG2 3.350 . 3.520 3.575 3.310 3.621 0.101 13 0 "[ . 1 . 2]" 1
799 1 54 ALA H 1 76 VAL MG2 4.860 . 5.100 4.911 4.570 5.136 0.036 16 0 "[ . 1 . 2]" 1
800 1 84 VAL MG2 1 96 ALA HA 4.110 . 4.320 2.534 2.326 2.734 . 0 0 "[ . 1 . 2]" 1
801 1 46 TYR QE 1 76 VAL MG2 3.970 . 4.170 3.575 3.131 3.935 . 0 0 "[ . 1 . 2]" 1
802 1 54 ALA HA 1 76 VAL MG2 3.330 . 3.500 2.656 2.295 2.849 . 0 0 "[ . 1 . 2]" 1
803 1 76 VAL HA 1 76 VAL MG2 3.450 . 3.620 2.366 2.297 2.449 . 0 0 "[ . 1 . 2]" 1
804 1 43 LEU MD1 1 76 VAL MG2 3.080 . 3.230 2.068 1.909 2.336 . 0 0 "[ . 1 . 2]" 1
805 1 52 PHE HA 1 53 ALA HA 4.640 . 4.870 4.440 4.395 4.514 . 0 0 "[ . 1 . 2]" 1
806 1 52 PHE HA 1 76 VAL MG1 4.570 . 4.800 4.362 4.193 4.739 . 0 0 "[ . 1 . 2]" 1
807 1 32 VAL H 1 32 VAL MG2 3.940 . 4.140 2.036 1.894 2.259 . 0 0 "[ . 1 . 2]" 1
808 1 31 LEU HA 1 31 LEU MD2 4.110 . 4.320 3.011 2.620 3.223 . 0 0 "[ . 1 . 2]" 1
809 1 28 ILE HA 1 31 LEU MD2 2.930 . 3.080 1.814 1.733 2.260 0.067 4 0 "[ . 1 . 2]" 1
810 1 31 LEU HB3 1 31 LEU MD2 3.280 . 3.440 3.187 3.169 3.207 . 0 0 "[ . 1 . 2]" 1
811 1 71 VAL MG1 1 72 TYR H 4.300 . 4.510 3.150 2.931 3.326 . 0 0 "[ . 1 . 2]" 1
812 1 71 VAL MG1 1 85 CYS HA 4.810 . 5.050 3.688 3.353 3.984 . 0 0 "[ . 1 . 2]" 1
813 1 71 VAL MG1 1 86 ALA H 5.500 . 5.780 5.361 4.819 5.617 . 0 0 "[ . 1 . 2]" 1
814 1 71 VAL HA 1 71 VAL MG1 3.340 . 3.510 2.350 2.306 2.409 . 0 0 "[ . 1 . 2]" 1
815 1 40 VAL HA 1 40 VAL MG2 2.880 . 3.020 2.423 2.397 2.453 . 0 0 "[ . 1 . 2]" 1
816 1 54 ALA MB 1 55 GLU H 3.160 . 3.320 3.203 2.984 3.360 0.040 1 0 "[ . 1 . 2]" 1
817 1 44 LEU HA 1 54 ALA MB 3.290 . 3.450 2.313 2.022 2.509 . 0 0 "[ . 1 . 2]" 1
818 1 44 LEU HG 1 54 ALA MB 4.050 . 4.250 3.812 3.667 4.017 . 0 0 "[ . 1 . 2]" 1
819 1 47 ALA MB 1 54 ALA MB 2.680 . 2.810 1.975 1.795 2.222 0.005 10 0 "[ . 1 . 2]" 1
820 1 43 LEU HB3 1 54 ALA MB 4.310 . 4.530 4.012 3.832 4.226 . 0 0 "[ . 1 . 2]" 1
821 1 54 ALA MB 1 76 VAL MG2 3.060 . 3.210 2.777 2.262 3.207 . 0 0 "[ . 1 . 2]" 1
822 1 43 LEU MD2 1 54 ALA MB 3.530 . 3.710 3.682 3.548 3.756 0.046 1 0 "[ . 1 . 2]" 1
823 1 55 GLU H 1 74 ALA MB 4.840 . 5.080 4.350 4.000 4.699 . 0 0 "[ . 1 . 2]" 1
824 1 57 LYS H 1 74 ALA MB 5.500 . 5.780 5.095 4.739 5.427 . 0 0 "[ . 1 . 2]" 1
825 1 74 ALA MB 1 96 ALA H 5.500 . 5.780 5.350 5.176 5.583 . 0 0 "[ . 1 . 2]" 1
826 1 56 PHE QE 1 74 ALA MB 3.500 . 3.680 2.920 2.683 3.223 . 0 0 "[ . 1 . 2]" 1
827 1 56 PHE HA 1 74 ALA MB 4.420 . 4.640 3.938 3.614 4.363 . 0 0 "[ . 1 . 2]" 1
828 1 73 GLN HA 1 74 ALA MB 4.680 . 4.910 3.960 3.938 3.984 . 0 0 "[ . 1 . 2]" 1
829 1 74 ALA MB 1 97 ALA HA 3.940 . 4.140 3.700 3.469 3.883 . 0 0 "[ . 1 . 2]" 1
830 1 74 ALA MB 1 100 ALA HA 4.970 . 5.220 4.745 4.420 5.100 . 0 0 "[ . 1 . 2]" 1
831 1 74 ALA MB 1 93 LYS HA 5.100 . 5.360 5.282 5.082 5.417 0.057 2 0 "[ . 1 . 2]" 1
832 1 74 ALA MB 1 76 VAL MG2 3.770 . 3.960 2.731 2.545 3.105 . 0 0 "[ . 1 . 2]" 1
833 1 74 ALA MB 1 81 PHE H 4.160 . 4.370 3.419 3.255 3.532 . 0 0 "[ . 1 . 2]" 1
834 1 52 PHE HA 1 53 ALA MB 3.920 . 4.120 3.998 3.946 4.039 . 0 0 "[ . 1 . 2]" 1
835 1 53 ALA MB 1 54 ALA MB 4.720 . 4.960 4.477 4.302 4.600 . 0 0 "[ . 1 . 2]" 1
836 1 52 PHE HB2 1 53 ALA MB 5.420 . 5.690 5.153 4.973 5.287 . 0 0 "[ . 1 . 2]" 1
837 1 53 ALA MB 1 76 VAL MG1 4.820 . 5.060 4.850 4.635 5.039 . 0 0 "[ . 1 . 2]" 1
838 1 73 GLN HE21 1 83 ALA MB 4.810 . 5.050 2.384 1.764 3.352 0.036 16 0 "[ . 1 . 2]" 1
839 1 73 GLN HE22 1 83 ALA MB 4.030 . 4.230 3.187 2.524 3.913 . 0 0 "[ . 1 . 2]" 1
840 1 111 ALA MB 1 113 ARG H 4.340 . 4.560 3.931 2.171 4.691 0.131 18 0 "[ . 1 . 2]" 1
841 1 73 GLN QG 1 83 ALA MB 3.780 . 3.970 2.808 2.251 3.437 . 0 0 "[ . 1 . 2]" 1
842 1 47 ALA MB 1 53 ALA MB 4.430 . 4.650 4.157 3.849 4.382 . 0 0 "[ . 1 . 2]" 1
843 1 47 ALA MB 1 48 ARG H 2.930 . 3.080 2.410 2.319 2.561 . 0 0 "[ . 1 . 2]" 1
844 1 47 ALA MB 1 48 ARG HA 4.010 . 4.210 3.723 3.676 3.761 . 0 0 "[ . 1 . 2]" 1
845 1 46 TYR HB3 1 47 ALA MB 4.370 . 4.590 4.034 3.965 4.124 . 0 0 "[ . 1 . 2]" 1
846 1 47 ALA MB 1 52 PHE HB2 3.650 . 3.830 2.343 2.165 2.543 . 0 0 "[ . 1 . 2]" 1
847 1 47 ALA MB 1 76 VAL MG1 2.640 . 2.770 2.326 2.024 2.588 . 0 0 "[ . 1 . 2]" 1
848 1 47 ALA MB 1 76 VAL MG2 3.660 . 3.840 3.322 3.068 3.544 . 0 0 "[ . 1 . 2]" 1
849 1 43 LEU MD1 1 47 ALA MB 4.240 . 4.450 3.178 2.894 3.478 . 0 0 "[ . 1 . 2]" 1
850 1 43 LEU MD2 1 47 ALA MB 4.240 . 4.450 3.806 3.539 4.057 . 0 0 "[ . 1 . 2]" 1
851 1 83 ALA HA 1 84 VAL MG1 4.090 . 4.290 3.838 3.719 3.985 . 0 0 "[ . 1 . 2]" 1
852 1 84 VAL MG1 1 99 ALA MB 4.000 . 4.200 2.644 2.398 3.156 . 0 0 "[ . 1 . 2]" 1
853 1 43 LEU HG 1 100 ALA MB 3.800 . 3.990 2.565 2.275 2.828 . 0 0 "[ . 1 . 2]" 1
854 1 74 ALA MB 1 100 ALA MB 3.310 . 3.480 2.803 2.576 3.014 . 0 0 "[ . 1 . 2]" 1
855 1 100 ALA MB 1 104 LEU MD2 4.770 . 5.010 3.805 3.573 4.032 . 0 0 "[ . 1 . 2]" 1
856 1 43 LEU HB2 1 100 ALA MB 4.430 . 4.650 3.455 3.292 3.649 . 0 0 "[ . 1 . 2]" 1
857 1 97 ALA MB 1 98 ASP H 3.280 . 3.440 2.510 2.438 2.571 . 0 0 "[ . 1 . 2]" 1
858 1 56 PHE QE 1 97 ALA MB 3.220 . 3.380 2.297 1.974 2.580 . 0 0 "[ . 1 . 2]" 1
859 1 39 PRO HB3 1 97 ALA MB 3.710 . 3.900 3.626 3.511 3.725 . 0 0 "[ . 1 . 2]" 1
860 1 97 ALA MB 1 100 ALA MB 4.310 . 4.530 3.658 3.523 3.816 . 0 0 "[ . 1 . 2]" 1
861 1 95 GLU H 1 97 ALA MB 5.170 . 5.430 4.994 4.847 5.185 . 0 0 "[ . 1 . 2]" 1
862 1 97 ALA MB 1 100 ALA H 4.960 . 5.210 4.549 4.484 4.607 . 0 0 "[ . 1 . 2]" 1
863 1 40 VAL HA 1 97 ALA MB 3.040 . 3.190 2.019 1.928 2.108 . 0 0 "[ . 1 . 2]" 1
864 1 97 ALA MB 1 98 ASP HB3 5.050 . 5.300 4.680 4.560 4.804 . 0 0 "[ . 1 . 2]" 1
865 1 97 ALA MB 1 98 ASP HB2 4.280 . 4.490 4.124 4.013 4.236 . 0 0 "[ . 1 . 2]" 1
866 1 39 PRO HB2 1 97 ALA MB 3.520 . 3.700 2.124 2.014 2.219 . 0 0 "[ . 1 . 2]" 1
867 1 43 LEU HB2 1 97 ALA MB 3.690 . 3.870 2.275 1.976 2.535 . 0 0 "[ . 1 . 2]" 1
868 1 99 ALA MB 1 102 ARG H 4.850 . 5.090 4.539 4.361 4.704 . 0 0 "[ . 1 . 2]" 1
869 1 98 ASP HB3 1 99 ALA MB 4.260 . 4.470 3.730 3.574 3.824 . 0 0 "[ . 1 . 2]" 1
870 1 99 ALA MB 1 100 ALA HA 5.000 . 5.250 3.869 3.807 3.938 . 0 0 "[ . 1 . 2]" 1
871 1 99 ALA MB 1 100 ALA MB 4.020 . 4.220 3.858 3.782 3.951 . 0 0 "[ . 1 . 2]" 1
872 1 28 ILE MG 1 105 ILE H 4.380 . 4.600 3.940 3.567 4.185 . 0 0 "[ . 1 . 2]" 1
873 1 28 ILE MG 1 32 VAL H 4.150 . 4.360 3.968 3.583 4.374 0.014 6 0 "[ . 1 . 2]" 1
874 1 28 ILE HA 1 28 ILE MG 2.940 . 3.090 2.431 2.367 2.520 . 0 0 "[ . 1 . 2]" 1
875 1 28 ILE MG 1 108 ASN HB3 4.080 . 4.280 2.974 2.216 3.459 . 0 0 "[ . 1 . 2]" 1
876 1 28 ILE MG 1 108 ASN HB2 4.050 . 4.250 3.978 3.231 4.303 0.053 3 0 "[ . 1 . 2]" 1
877 1 28 ILE HG13 1 28 ILE MG 3.350 . 3.520 2.329 2.296 2.354 . 0 0 "[ . 1 . 2]" 1
878 1 28 ILE HG12 1 28 ILE MG 3.350 . 3.520 3.197 3.189 3.202 . 0 0 "[ . 1 . 2]" 1
879 1 82 PRO HA 1 99 ALA MB 4.780 . 5.020 5.019 4.932 5.060 0.040 5 0 "[ . 1 . 2]" 1
880 1 28 ILE MG 1 105 ILE MD 4.440 . 4.660 3.210 2.948 3.435 . 0 0 "[ . 1 . 2]" 1
881 1 74 ALA HA 1 96 ALA MB 5.150 . 5.410 3.886 3.590 4.176 . 0 0 "[ . 1 . 2]" 1
882 1 96 ALA MB 1 97 ALA H 3.340 . 3.510 2.369 2.249 2.487 . 0 0 "[ . 1 . 2]" 1
883 1 56 PHE QD 1 96 ALA MB 3.410 . 3.580 2.560 2.236 2.821 . 0 0 "[ . 1 . 2]" 1
884 1 93 LYS HA 1 96 ALA MB 3.390 . 3.560 2.818 2.541 3.046 . 0 0 "[ . 1 . 2]" 1
885 1 95 GLU HB2 1 96 ALA MB 4.040 . 4.240 4.075 3.834 4.271 0.031 18 0 "[ . 1 . 2]" 1
886 1 96 ALA MB 1 99 ALA MB 4.610 . 4.840 4.311 4.057 4.490 . 0 0 "[ . 1 . 2]" 1
887 1 74 ALA MB 1 96 ALA MB 3.320 . 3.490 2.318 2.114 2.576 . 0 0 "[ . 1 . 2]" 1
888 1 93 LYS HB2 1 96 ALA MB 5.500 . 5.780 5.225 4.953 5.421 . 0 0 "[ . 1 . 2]" 1
889 1 96 ALA MB 1 100 ALA MB 4.300 . 4.510 3.889 3.801 3.981 . 0 0 "[ . 1 . 2]" 1
890 1 56 PHE QD 1 74 ALA HA 5.080 . 5.330 3.653 3.381 3.951 . 0 0 "[ . 1 . 2]" 1
891 1 95 GLU H 1 96 ALA MB 4.550 . 4.780 4.357 4.222 4.451 . 0 0 "[ . 1 . 2]" 1
892 1 72 TYR HA 1 96 ALA MB 5.240 . 5.500 4.848 4.585 5.186 . 0 0 "[ . 1 . 2]" 1
893 1 72 TYR HB3 1 96 ALA MB 3.370 . 3.540 2.782 2.349 3.323 . 0 0 "[ . 1 . 2]" 1
894 1 83 ALA HA 1 84 VAL MG2 4.090 . 4.290 3.766 3.586 3.860 . 0 0 "[ . 1 . 2]" 1
895 1 102 ARG HA 1 105 ILE MG 4.300 . 4.510 3.964 3.494 4.284 . 0 0 "[ . 1 . 2]" 1
896 1 28 ILE HB 1 105 ILE MG 4.770 . 5.010 4.135 3.665 4.331 . 0 0 "[ . 1 . 2]" 1
897 1 31 LEU HB2 1 105 ILE MG 5.140 . 5.400 4.484 4.314 4.672 . 0 0 "[ . 1 . 2]" 1
898 1 105 ILE MG 1 106 GLY H 3.340 . 3.510 3.232 3.035 3.428 . 0 0 "[ . 1 . 2]" 1
899 1 105 ILE MG 1 109 GLU HA 5.370 . 5.640 4.939 3.916 5.443 . 0 0 "[ . 1 . 2]" 1
900 1 105 ILE HA 1 105 ILE MG 2.840 . 2.980 2.447 2.404 2.483 . 0 0 "[ . 1 . 2]" 1
901 1 105 ILE HG13 1 105 ILE MG 3.200 . 3.360 3.199 3.191 3.207 . 0 0 "[ . 1 . 2]" 1
902 1 39 PRO HD2 1 40 VAL H 4.290 . 4.500 2.932 2.851 3.059 . 0 0 "[ . 1 . 2]" 1
903 1 38 ASN QB 1 39 PRO HD2 4.930 . 5.180 3.811 3.744 3.892 . 0 0 "[ . 1 . 2]" 1
904 1 64 PRO HA 1 65 PRO HD3 3.540 . 3.720 2.441 1.855 2.647 . 0 0 "[ . 1 . 2]" 1
905 1 64 PRO HB3 1 65 PRO HD3 4.110 . 4.320 3.901 3.242 4.118 . 0 0 "[ . 1 . 2]" 1
906 1 67 GLU HB3 1 68 PRO HD2 4.780 . 5.020 4.573 4.290 4.953 . 0 0 "[ . 1 . 2]" 1
907 1 68 PRO HD2 1 70 PHE QE 5.170 . 5.430 4.804 4.048 5.478 0.048 10 0 "[ . 1 . 2]" 1
908 1 66 HIS HA 1 68 PRO HD3 4.950 . 5.200 3.741 3.458 4.027 . 0 0 "[ . 1 . 2]" 1
909 1 64 PRO HD3 1 67 GLU HB3 4.950 . 5.200 4.891 3.818 5.277 0.077 7 0 "[ . 1 . 2]" 1
910 1 101 LEU H 1 105 ILE MD 4.910 . 5.160 5.240 5.172 5.265 0.105 20 0 "[ . 1 . 2]" 1
911 1 31 LEU HA 1 105 ILE MD 4.040 . 4.240 4.176 4.019 4.292 0.052 9 0 "[ . 1 . 2]" 1
912 1 102 ARG HA 1 105 ILE MD 3.310 . 3.480 2.672 2.182 3.076 . 0 0 "[ . 1 . 2]" 1
913 1 32 VAL HA 1 105 ILE MD 2.870 . 3.010 2.546 2.391 2.696 . 0 0 "[ . 1 . 2]" 1
914 1 32 VAL HB 1 105 ILE MD 3.880 . 4.070 4.133 4.090 4.177 0.107 12 0 "[ . 1 . 2]" 1
915 1 101 LEU HB3 1 105 ILE MD 3.290 . 3.450 2.752 2.648 2.908 . 0 0 "[ . 1 . 2]" 1
916 1 105 ILE HB 1 105 ILE MD 2.800 . 2.940 2.383 2.363 2.405 . 0 0 "[ . 1 . 2]" 1
917 1 31 LEU HB3 1 105 ILE MD 3.480 . 3.650 2.499 2.080 2.647 . 0 0 "[ . 1 . 2]" 1
918 1 101 LEU HB2 1 105 ILE MD 3.400 . 3.570 3.455 3.245 3.556 . 0 0 "[ . 1 . 2]" 1
919 1 105 ILE MD 1 105 ILE MG 2.400 . 2.520 2.020 1.962 2.065 . 0 0 "[ . 1 . 2]" 1
920 1 91 GLN QB 1 92 GLY QA 5.500 . 5.780 3.602 3.445 3.711 . 0 0 "[ . 1 . 2]" 1
921 1 92 GLY QA 1 95 GLU HB2 5.500 . 5.780 2.902 2.604 3.274 . 0 0 "[ . 1 . 2]" 1
922 1 40 VAL H 1 41 GLY QA 4.870 . 5.110 4.570 4.507 4.630 . 0 0 "[ . 1 . 2]" 1
923 1 41 GLY QA 1 44 LEU HB2 3.910 . 4.110 2.757 2.549 3.045 . 0 0 "[ . 1 . 2]" 1
924 1 41 GLY QA 1 44 LEU MD2 5.060 . 5.310 4.697 4.473 4.933 . 0 0 "[ . 1 . 2]" 1
925 1 29 GLY HA2 1 31 LEU H 5.300 . 5.570 4.295 4.117 4.515 . 0 0 "[ . 1 . 2]" 1
926 1 42 GLY HA3 1 44 LEU H 5.300 . 5.570 4.690 4.645 4.792 . 0 0 "[ . 1 . 2]" 1
927 1 105 ILE MG 1 106 GLY HA2 4.610 . 4.840 3.282 3.127 3.413 . 0 0 "[ . 1 . 2]" 1
928 1 106 GLY HA3 1 109 GLU QB 4.130 . 4.340 4.019 3.494 4.376 0.036 5 0 "[ . 1 . 2]" 1
929 1 28 ILE MG 1 29 GLY HA2 4.920 . 5.170 3.660 3.438 3.974 . 0 0 "[ . 1 . 2]" 1
930 1 52 PHE HB3 1 77 GLY HA2 5.110 . 5.370 3.445 2.838 3.807 . 0 0 "[ . 1 . 2]" 1
931 1 34 TYR QD 1 42 GLY HA3 4.500 . 4.730 2.991 2.628 3.305 . 0 0 "[ . 1 . 2]" 1
932 1 28 ILE MD 1 105 ILE H 4.870 . 5.110 4.402 3.886 5.121 0.011 20 0 "[ . 1 . 2]" 1
933 1 28 ILE MD 1 46 TYR QD 4.380 . 4.600 4.285 3.518 4.621 0.021 13 0 "[ . 1 . 2]" 1
934 1 28 ILE MD 1 46 TYR QE 4.720 . 4.960 4.248 3.360 4.661 . 0 0 "[ . 1 . 2]" 1
935 1 28 ILE MD 1 105 ILE HA 3.800 . 3.990 2.864 2.273 4.003 0.013 19 0 "[ . 1 . 2]" 1
936 1 28 ILE HB 1 28 ILE MD 3.260 . 3.420 3.236 3.232 3.240 . 0 0 "[ . 1 . 2]" 1
937 1 48 ARG HA 1 51 GLY HA2 4.810 . 5.050 4.421 4.145 4.673 . 0 0 "[ . 1 . 2]" 1
938 1 72 TYR H 1 84 VAL H 4.310 . 4.530 3.398 3.103 3.622 . 0 0 "[ . 1 . 2]" 1
939 1 72 TYR H 1 72 TYR QD 4.160 . 4.370 3.304 2.746 3.562 . 0 0 "[ . 1 . 2]" 1
940 1 72 TYR H 1 85 CYS HA 4.490 . 4.710 3.201 2.947 3.569 . 0 0 "[ . 1 . 2]" 1
941 1 71 VAL HA 1 72 TYR H 3.110 . 3.270 2.147 2.115 2.187 . 0 0 "[ . 1 . 2]" 1
942 1 72 TYR H 1 72 TYR HB2 3.910 . 4.110 2.330 2.265 2.402 . 0 0 "[ . 1 . 2]" 1
943 1 72 TYR H 1 86 ALA MB 5.060 . 5.310 4.975 4.085 5.338 0.028 8 0 "[ . 1 . 2]" 1
944 1 71 VAL MG2 1 72 TYR H 4.300 . 4.510 4.234 4.167 4.313 . 0 0 "[ . 1 . 2]" 1
945 1 72 TYR H 1 86 ALA H 4.970 . 5.220 4.125 3.530 4.697 . 0 0 "[ . 1 . 2]" 1
946 1 71 VAL H 1 72 TYR H 5.080 . 5.330 4.250 4.159 4.354 . 0 0 "[ . 1 . 2]" 1
947 1 72 TYR H 1 85 CYS H 5.490 . 5.760 4.884 4.764 5.064 . 0 0 "[ . 1 . 2]" 1
948 1 72 TYR H 1 72 TYR HB3 3.880 . 4.070 3.480 3.391 3.570 . 0 0 "[ . 1 . 2]" 1
949 1 72 TYR H 1 96 ALA MB 5.060 . 5.310 4.659 4.282 4.904 . 0 0 "[ . 1 . 2]" 1
950 1 112 GLU H 1 113 ARG H 4.570 . 4.800 3.389 2.089 4.435 . 0 0 "[ . 1 . 2]" 1
951 1 112 GLU HA 1 113 ARG H 3.000 . 3.150 2.555 2.101 3.293 0.143 6 0 "[ . 1 . 2]" 1
952 1 113 ARG H 1 113 ARG QD 4.840 . 5.080 3.762 1.741 4.918 0.059 1 0 "[ . 1 . 2]" 1
953 1 112 GLU QB 1 113 ARG H 4.250 . 4.460 3.740 3.252 4.024 . 0 0 "[ . 1 . 2]" 1
954 1 113 ARG H 1 113 ARG QG 3.610 . 3.790 2.531 1.920 3.651 . 0 0 "[ . 1 . 2]" 1
955 1 72 TYR H 1 73 GLN HA 5.500 . 5.780 5.061 4.976 5.149 . 0 0 "[ . 1 . 2]" 1
956 1 72 TYR H 1 84 VAL HA 5.500 . 5.780 4.954 4.764 5.075 . 0 0 "[ . 1 . 2]" 1
957 1 71 VAL HB 1 72 TYR H 4.760 . 5.000 4.324 4.229 4.393 . 0 0 "[ . 1 . 2]" 1
958 1 113 ARG H 1 113 ARG HB2 3.930 . 4.130 3.183 2.386 3.928 . 0 0 "[ . 1 . 2]" 1
959 1 113 ARG H 1 113 ARG HB3 3.930 . 4.130 3.397 2.537 3.835 . 0 0 "[ . 1 . 2]" 1
960 1 57 LYS H 1 73 GLN H 3.960 . 4.160 3.303 3.069 3.475 . 0 0 "[ . 1 . 2]" 1
961 1 57 LYS H 1 75 LYS H 4.570 . 4.800 4.109 3.671 4.780 . 0 0 "[ . 1 . 2]" 1
962 1 56 PHE QD 1 57 LYS H 4.690 . 4.920 4.486 4.188 4.699 . 0 0 "[ . 1 . 2]" 1
963 1 57 LYS H 1 72 TYR HA 5.120 . 5.380 4.772 4.562 5.095 . 0 0 "[ . 1 . 2]" 1
964 1 56 PHE HA 1 57 LYS H 2.920 . 3.070 2.185 2.155 2.221 . 0 0 "[ . 1 . 2]" 1
965 1 56 PHE HB2 1 57 LYS H 4.440 . 4.660 4.397 4.208 4.485 . 0 0 "[ . 1 . 2]" 1
966 1 56 PHE HB3 1 57 LYS H 3.900 . 4.100 3.661 3.239 3.875 . 0 0 "[ . 1 . 2]" 1
967 1 57 LYS H 1 57 LYS HB3 3.340 . 3.510 3.115 2.996 3.376 . 0 0 "[ . 1 . 2]" 1
968 1 57 LYS H 1 72 TYR QD 4.460 . 4.680 3.475 3.106 3.719 . 0 0 "[ . 1 . 2]" 1
969 1 57 LYS H 1 74 ALA HA 4.390 . 4.610 3.776 3.457 4.114 . 0 0 "[ . 1 . 2]" 1
970 1 57 LYS H 1 57 LYS QD 4.850 . 5.090 4.267 3.638 4.428 . 0 0 "[ . 1 . 2]" 1
971 1 57 LYS H 1 96 ALA MB 5.500 . 5.780 5.460 5.009 5.721 . 0 0 "[ . 1 . 2]" 1
972 1 57 LYS H 1 57 LYS HG2 3.960 . 4.160 2.577 2.243 3.395 . 0 0 "[ . 1 . 2]" 1
973 1 111 ALA H 1 112 GLU HA 5.330 . 5.600 4.999 4.097 5.762 0.162 4 0 "[ . 1 . 2]" 1
974 1 70 PHE H 1 86 ALA H 3.790 . 3.980 3.105 2.753 3.614 . 0 0 "[ . 1 . 2]" 1
975 1 85 CYS H 1 86 ALA H 4.660 . 4.890 4.168 3.910 4.416 . 0 0 "[ . 1 . 2]" 1
976 1 85 CYS HA 1 86 ALA H 3.010 . 3.160 2.157 2.118 2.245 . 0 0 "[ . 1 . 2]" 1
977 1 86 ALA H 1 91 GLN QB 5.260 . 5.520 5.118 4.831 5.432 . 0 0 "[ . 1 . 2]" 1
978 1 86 ALA H 1 86 ALA MB 3.370 . 3.540 2.487 2.310 2.743 . 0 0 "[ . 1 . 2]" 1
979 1 69 LYS QG 1 86 ALA H 4.480 . 4.700 3.530 2.684 4.507 . 0 0 "[ . 1 . 2]" 1
980 1 71 VAL MG2 1 86 ALA H 5.500 . 5.780 4.655 4.242 4.901 . 0 0 "[ . 1 . 2]" 1
981 1 71 VAL HA 1 86 ALA H 3.970 . 4.170 3.749 3.184 4.073 . 0 0 "[ . 1 . 2]" 1
982 1 69 LYS HA 1 86 ALA H 5.500 . 5.780 4.359 3.560 4.989 . 0 0 "[ . 1 . 2]" 1
983 1 96 ALA H 1 97 ALA HA 5.470 . 5.740 5.328 5.272 5.386 . 0 0 "[ . 1 . 2]" 1
984 1 94 GLN HA 1 96 ALA H 4.620 . 4.850 4.447 4.328 4.560 . 0 0 "[ . 1 . 2]" 1
985 1 92 GLY QA 1 96 ALA H 4.580 . 4.810 3.773 3.642 3.952 . 0 0 "[ . 1 . 2]" 1
986 1 93 LYS HB2 1 96 ALA H 5.500 . 5.780 5.656 5.537 5.779 . 0 0 "[ . 1 . 2]" 1
987 1 54 ALA H 1 55 GLU H 4.580 . 4.810 4.367 4.096 4.517 . 0 0 "[ . 1 . 2]" 1
988 1 93 LYS HA 1 96 ALA H 4.010 . 4.210 3.770 3.582 3.952 . 0 0 "[ . 1 . 2]" 1
989 1 95 GLU QG 1 96 ALA H 4.190 . 4.400 4.109 3.911 4.273 . 0 0 "[ . 1 . 2]" 1
990 1 95 GLU HB3 1 96 ALA H 3.800 . 3.990 3.596 3.405 3.772 . 0 0 "[ . 1 . 2]" 1
991 1 95 GLU HB2 1 96 ALA H 3.550 . 3.730 2.649 2.431 2.794 . 0 0 "[ . 1 . 2]" 1
992 1 96 ALA H 1 96 ALA MB 2.870 . 3.010 2.243 2.233 2.249 . 0 0 "[ . 1 . 2]" 1
993 1 54 ALA H 1 54 ALA MB 2.960 . 3.110 2.338 2.262 2.534 . 0 0 "[ . 1 . 2]" 1
994 1 75 LYS H 1 76 VAL H 4.510 . 4.740 4.235 4.100 4.352 . 0 0 "[ . 1 . 2]" 1
995 1 76 VAL H 1 80 TRP QB 5.500 . 5.780 5.310 5.145 5.529 . 0 0 "[ . 1 . 2]" 1
996 1 76 VAL H 1 76 VAL HB 3.600 . 3.780 2.637 2.564 2.778 . 0 0 "[ . 1 . 2]" 1
997 1 76 VAL H 1 79 ARG HB2 4.660 . 4.890 4.133 3.369 4.983 0.093 20 0 "[ . 1 . 2]" 1
998 1 76 VAL H 1 79 ARG HB3 4.660 . 4.890 4.244 3.345 4.922 0.032 4 0 "[ . 1 . 2]" 1
999 1 75 LYS HB2 1 76 VAL H 4.650 . 4.880 4.428 4.322 4.520 . 0 0 "[ . 1 . 2]" 1
1000 1 75 LYS HG2 1 76 VAL H 4.050 . 4.250 3.562 2.818 3.820 . 0 0 "[ . 1 . 2]" 1
1001 1 76 VAL H 1 79 ARG H 4.070 . 4.270 3.605 3.088 3.997 . 0 0 "[ . 1 . 2]" 1
1002 1 76 VAL H 1 81 PHE QD 4.320 . 4.540 4.065 3.566 4.531 . 0 0 "[ . 1 . 2]" 1
1003 1 75 LYS HA 1 76 VAL H 2.990 . 3.140 2.170 2.137 2.207 . 0 0 "[ . 1 . 2]" 1
1004 1 75 LYS HB3 1 76 VAL H 4.460 . 4.680 4.394 4.113 4.459 . 0 0 "[ . 1 . 2]" 1
1005 1 76 VAL H 1 76 VAL MG2 3.590 . 3.770 2.637 2.446 2.882 . 0 0 "[ . 1 . 2]" 1
1006 1 75 LYS HG3 1 76 VAL H 4.050 . 4.250 3.853 3.455 4.168 . 0 0 "[ . 1 . 2]" 1
1007 1 53 ALA HA 1 54 ALA H 2.550 . 2.680 2.170 2.137 2.294 . 0 0 "[ . 1 . 2]" 1
1008 1 53 ALA MB 1 54 ALA H 3.600 . 3.780 3.151 2.734 3.412 . 0 0 "[ . 1 . 2]" 1
1009 1 43 LEU H 1 44 LEU H 3.290 . 3.450 2.627 2.589 2.686 . 0 0 "[ . 1 . 2]" 1
1010 1 42 GLY H 1 43 LEU H 3.360 . 3.530 2.629 2.496 2.722 . 0 0 "[ . 1 . 2]" 1
1011 1 41 GLY H 1 43 LEU H 4.380 . 4.600 4.302 4.212 4.385 . 0 0 "[ . 1 . 2]" 1
1012 1 41 GLY QA 1 43 LEU H 4.080 . 4.280 4.179 4.114 4.267 . 0 0 "[ . 1 . 2]" 1
1013 1 40 VAL HA 1 43 LEU H 3.960 . 4.160 3.577 3.446 3.796 . 0 0 "[ . 1 . 2]" 1
1014 1 42 GLY HA3 1 43 LEU H 3.560 . 3.740 2.791 2.758 2.846 . 0 0 "[ . 1 . 2]" 1
1015 1 43 LEU H 1 43 LEU HB2 3.000 . 3.150 2.362 2.314 2.388 . 0 0 "[ . 1 . 2]" 1
1016 1 43 LEU H 1 101 LEU HG 4.920 . 5.170 4.184 4.015 4.362 . 0 0 "[ . 1 . 2]" 1
1017 1 43 LEU H 1 97 ALA MB 3.570 . 3.750 3.271 3.027 3.551 . 0 0 "[ . 1 . 2]" 1
1018 1 43 LEU H 1 43 LEU HB3 3.170 . 3.330 2.624 2.587 2.671 . 0 0 "[ . 1 . 2]" 1
1019 1 80 TRP H 1 80 TRP HE3 5.380 . 5.650 5.523 5.253 5.668 0.018 1 0 "[ . 1 . 2]" 1
1020 1 79 ARG HA 1 80 TRP H 2.980 . 3.130 2.169 2.115 2.258 . 0 0 "[ . 1 . 2]" 1
1021 1 80 TRP H 1 80 TRP QB 3.440 . 3.610 2.536 2.469 2.646 . 0 0 "[ . 1 . 2]" 1
1022 1 79 ARG HB2 1 80 TRP H 4.530 . 4.760 4.199 3.781 4.514 . 0 0 "[ . 1 . 2]" 1
1023 1 79 ARG HB3 1 80 TRP H 4.530 . 4.760 3.347 2.689 4.170 . 0 0 "[ . 1 . 2]" 1
1024 1 66 HIS HE1 1 67 GLU H 5.270 . 5.530 4.980 4.339 5.380 . 0 0 "[ . 1 . 2]" 1
1025 1 66 HIS HD2 1 67 GLU H 4.670 . 4.900 4.139 3.685 4.583 . 0 0 "[ . 1 . 2]" 1
1026 1 64 PRO HA 1 67 GLU H 4.950 . 5.200 4.559 4.486 4.662 . 0 0 "[ . 1 . 2]" 1
1027 1 66 HIS H 1 67 GLU H 3.980 . 4.180 2.385 2.319 2.466 . 0 0 "[ . 1 . 2]" 1
1028 1 65 PRO HA 1 67 GLU H 4.340 . 4.560 4.078 3.864 4.311 . 0 0 "[ . 1 . 2]" 1
1029 1 64 PRO HD2 1 67 GLU H 4.610 . 4.840 4.160 4.010 4.310 . 0 0 "[ . 1 . 2]" 1
1030 1 67 GLU H 1 68 PRO HD2 3.750 . 3.940 3.867 3.628 4.015 0.075 20 0 "[ . 1 . 2]" 1
1031 1 67 GLU H 1 68 PRO HD3 3.230 . 3.390 2.926 2.470 3.315 . 0 0 "[ . 1 . 2]" 1
1032 1 66 HIS HB3 1 67 GLU H 4.420 . 4.640 4.252 4.045 4.384 . 0 0 "[ . 1 . 2]" 1
1033 1 64 PRO HB2 1 67 GLU H 4.970 . 5.220 3.027 2.689 3.351 . 0 0 "[ . 1 . 2]" 1
1034 1 64 PRO HG2 1 67 GLU H 3.450 . 3.620 2.535 2.289 2.716 . 0 0 "[ . 1 . 2]" 1
1035 1 67 GLU H 1 67 GLU HB2 3.620 . 3.800 2.713 2.586 2.882 . 0 0 "[ . 1 . 2]" 1
1036 1 67 GLU H 1 67 GLU HB3 3.850 . 4.040 3.694 3.238 3.778 . 0 0 "[ . 1 . 2]" 1
1037 1 53 ALA H 1 76 VAL MG1 4.210 . 4.420 3.807 3.467 4.208 . 0 0 "[ . 1 . 2]" 1
1038 1 53 ALA H 1 77 GLY H 4.590 . 4.820 2.518 2.156 2.718 . 0 0 "[ . 1 . 2]" 1
1039 1 52 PHE HA 1 53 ALA H 2.790 . 2.930 2.433 2.323 2.617 . 0 0 "[ . 1 . 2]" 1
1040 1 47 ALA HA 1 53 ALA H 5.470 . 5.740 5.331 4.956 5.659 . 0 0 "[ . 1 . 2]" 1
1041 1 52 PHE HB3 1 53 ALA H 3.310 . 3.480 2.342 1.956 2.597 . 0 0 "[ . 1 . 2]" 1
1042 1 52 PHE HB2 1 53 ALA H 3.670 . 3.850 3.551 3.193 3.780 . 0 0 "[ . 1 . 2]" 1
1043 1 47 ALA MB 1 53 ALA H 4.220 . 4.430 3.604 3.177 3.894 . 0 0 "[ . 1 . 2]" 1
1044 1 53 ALA H 1 53 ALA MB 2.780 . 2.920 2.427 2.355 2.522 . 0 0 "[ . 1 . 2]" 1
1045 1 53 ALA H 1 76 VAL MG2 5.210 . 5.470 5.458 5.212 5.579 0.109 4 0 "[ . 1 . 2]" 1
1046 1 46 TYR H 1 49 SER H 4.800 . 5.040 4.824 4.751 4.902 . 0 0 "[ . 1 . 2]" 1
1047 1 46 TYR H 1 46 TYR QD 3.810 . 4.000 4.063 4.020 4.094 0.094 15 0 "[ . 1 . 2]" 1
1048 1 43 LEU HA 1 46 TYR H 3.730 . 3.920 3.528 3.421 3.688 . 0 0 "[ . 1 . 2]" 1
1049 1 46 TYR H 1 46 TYR HB3 3.000 . 3.150 2.275 2.240 2.312 . 0 0 "[ . 1 . 2]" 1
1050 1 46 TYR H 1 46 TYR HB2 3.160 . 3.320 2.799 2.714 2.878 . 0 0 "[ . 1 . 2]" 1
1051 1 42 GLY HA3 1 46 TYR H 5.110 . 5.370 4.733 4.662 4.851 . 0 0 "[ . 1 . 2]" 1
1052 1 42 GLY HA2 1 46 TYR H 4.540 . 4.770 3.842 3.727 3.963 . 0 0 "[ . 1 . 2]" 1
1053 1 45 GLU HB3 1 46 TYR H 4.360 . 4.580 3.151 2.360 4.197 . 0 0 "[ . 1 . 2]" 1
1054 1 46 TYR H 1 47 ALA MB 4.420 . 4.640 4.456 4.401 4.519 . 0 0 "[ . 1 . 2]" 1
1055 1 43 LEU HB3 1 46 TYR H 5.500 . 5.780 5.597 5.492 5.696 . 0 0 "[ . 1 . 2]" 1
1056 1 31 LEU MD1 1 46 TYR H 3.790 . 3.980 3.432 3.028 3.744 . 0 0 "[ . 1 . 2]" 1
1057 1 43 LEU MD1 1 46 TYR H 5.500 . 5.780 4.979 4.889 5.120 . 0 0 "[ . 1 . 2]" 1
1058 1 43 LEU MD2 1 46 TYR H 5.500 . 5.780 4.449 4.335 4.609 . 0 0 "[ . 1 . 2]" 1
1059 1 46 TYR H 1 47 ALA HA 5.430 . 5.700 5.365 5.320 5.428 . 0 0 "[ . 1 . 2]" 1
1060 1 46 TYR H 1 47 ALA H 3.250 . 3.410 2.790 2.732 2.874 . 0 0 "[ . 1 . 2]" 1
1061 1 47 ALA H 1 49 SER H 4.500 . 4.730 4.107 3.994 4.362 . 0 0 "[ . 1 . 2]" 1
1062 1 47 ALA H 1 52 PHE QD 5.470 . 5.740 5.384 5.105 5.528 . 0 0 "[ . 1 . 2]" 1
1063 1 46 TYR QD 1 47 ALA H 3.200 . 3.360 2.756 2.660 2.805 . 0 0 "[ . 1 . 2]" 1
1064 1 46 TYR QE 1 47 ALA H 4.530 . 4.760 4.788 4.656 4.830 0.070 2 0 "[ . 1 . 2]" 1
1065 1 45 GLU HA 1 47 ALA H 4.480 . 4.700 4.370 4.042 4.627 . 0 0 "[ . 1 . 2]" 1
1066 1 44 LEU HA 1 47 ALA H 3.810 . 4.000 3.686 3.498 3.866 . 0 0 "[ . 1 . 2]" 1
1067 1 46 TYR HB3 1 47 ALA H 3.290 . 3.450 2.628 2.523 2.760 . 0 0 "[ . 1 . 2]" 1
1068 1 46 TYR HB2 1 47 ALA H 4.210 . 4.420 3.971 3.899 4.054 . 0 0 "[ . 1 . 2]" 1
1069 1 47 ALA H 1 48 ARG HB3 4.520 . 4.750 4.773 4.354 4.848 0.098 19 0 "[ . 1 . 2]" 1
1070 1 47 ALA H 1 47 ALA MB 2.720 . 2.860 2.233 2.228 2.241 . 0 0 "[ . 1 . 2]" 1
1071 1 47 ALA H 1 54 ALA MB 4.180 . 4.390 3.686 3.472 4.003 . 0 0 "[ . 1 . 2]" 1
1072 1 31 LEU MD1 1 47 ALA H 5.130 . 5.390 5.145 4.817 5.415 0.025 7 0 "[ . 1 . 2]" 1
1073 1 75 LYS H 1 75 LYS HG3 4.980 . 5.230 4.621 4.588 4.712 . 0 0 "[ . 1 . 2]" 1
1074 1 55 GLU H 1 75 LYS H 3.520 . 3.700 3.072 2.730 3.288 . 0 0 "[ . 1 . 2]" 1
1075 1 56 PHE QD 1 75 LYS H 5.170 . 5.430 5.059 4.768 5.351 . 0 0 "[ . 1 . 2]" 1
1076 1 74 ALA HA 1 75 LYS H 2.960 . 3.110 2.115 2.084 2.231 . 0 0 "[ . 1 . 2]" 1
1077 1 56 PHE HA 1 75 LYS H 3.650 . 3.830 3.413 3.222 3.651 . 0 0 "[ . 1 . 2]" 1
1078 1 75 LYS H 1 80 TRP HA 4.610 . 4.840 4.788 4.569 4.891 0.051 7 0 "[ . 1 . 2]" 1
1079 1 74 ALA MB 1 75 LYS H 3.470 . 3.640 3.209 2.716 3.343 . 0 0 "[ . 1 . 2]" 1
1080 1 75 LYS H 1 75 LYS HG2 4.980 . 5.230 4.369 4.305 4.479 . 0 0 "[ . 1 . 2]" 1
1081 1 95 GLU H 1 97 ALA H 4.690 . 4.920 4.290 4.148 4.513 . 0 0 "[ . 1 . 2]" 1
1082 1 96 ALA H 1 97 ALA H 3.310 . 3.480 2.741 2.667 2.821 . 0 0 "[ . 1 . 2]" 1
1083 1 56 PHE QE 1 97 ALA H 3.850 . 4.040 2.646 2.329 2.936 . 0 0 "[ . 1 . 2]" 1
1084 1 94 GLN HA 1 97 ALA H 3.930 . 4.130 3.556 3.390 3.693 . 0 0 "[ . 1 . 2]" 1
1085 1 40 VAL HA 1 97 ALA H 5.080 . 5.330 4.706 4.453 4.870 . 0 0 "[ . 1 . 2]" 1
1086 1 93 LYS HA 1 97 ALA H 4.890 . 5.130 4.101 3.949 4.232 . 0 0 "[ . 1 . 2]" 1
1087 1 94 GLN QB 1 97 ALA H 5.500 . 5.780 4.956 4.860 5.078 . 0 0 "[ . 1 . 2]" 1
1088 1 97 ALA H 1 97 ALA MB 2.880 . 3.020 2.226 2.221 2.234 . 0 0 "[ . 1 . 2]" 1
1089 1 40 VAL MG2 1 97 ALA H 5.500 . 5.780 3.897 3.748 4.065 . 0 0 "[ . 1 . 2]" 1
1090 1 97 ALA H 1 100 ALA MB 4.680 . 4.910 4.394 4.298 4.511 . 0 0 "[ . 1 . 2]" 1
1091 1 28 ILE H 1 28 ILE MD 4.530 . 4.760 3.260 2.816 3.785 . 0 0 "[ . 1 . 2]" 1
1092 1 28 ILE H 1 28 ILE HG12 4.950 . 5.200 2.267 1.952 2.971 . 0 0 "[ . 1 . 2]" 1
1093 1 28 ILE H 1 28 ILE HB 4.170 . 4.380 2.489 2.352 2.631 . 0 0 "[ . 1 . 2]" 1
1094 1 71 VAL H 1 72 TYR QE 5.500 . 5.780 5.528 5.043 5.813 0.033 3 0 "[ . 1 . 2]" 1
1095 1 70 PHE QD 1 71 VAL H 4.790 . 5.030 4.324 4.103 4.503 . 0 0 "[ . 1 . 2]" 1
1096 1 71 VAL H 1 72 TYR QD 4.920 . 5.170 4.463 4.085 4.777 . 0 0 "[ . 1 . 2]" 1
1097 1 70 PHE HA 1 71 VAL H 3.110 . 3.270 2.140 2.109 2.227 . 0 0 "[ . 1 . 2]" 1
1098 1 60 ASP HA 1 71 VAL H 5.200 . 5.460 4.830 4.543 5.019 . 0 0 "[ . 1 . 2]" 1
1099 1 70 PHE QB 1 71 VAL H 3.970 . 4.170 3.286 2.866 3.528 . 0 0 "[ . 1 . 2]" 1
1100 1 71 VAL H 1 71 VAL HB 3.780 . 3.970 2.593 2.508 2.648 . 0 0 "[ . 1 . 2]" 1
1101 1 71 VAL H 1 71 VAL MG1 4.450 . 4.670 3.809 3.789 3.848 . 0 0 "[ . 1 . 2]" 1
1102 1 45 GLU H 1 48 ARG H 4.910 . 5.160 4.738 4.617 4.924 . 0 0 "[ . 1 . 2]" 1
1103 1 44 LEU H 1 45 GLU H 2.990 . 3.140 2.653 2.556 2.738 . 0 0 "[ . 1 . 2]" 1
1104 1 45 GLU H 1 46 TYR H 3.210 . 3.370 2.566 2.352 2.673 . 0 0 "[ . 1 . 2]" 1
1105 1 43 LEU H 1 45 GLU H 4.180 . 4.390 4.044 3.858 4.259 . 0 0 "[ . 1 . 2]" 1
1106 1 34 TYR QE 1 45 GLU H 5.500 . 5.780 5.532 5.194 5.826 0.046 18 0 "[ . 1 . 2]" 1
1107 1 45 GLU H 1 45 GLU HA 2.910 . 3.060 2.831 2.789 2.895 . 0 0 "[ . 1 . 2]" 1
1108 1 41 GLY QA 1 45 GLU H 3.950 . 4.150 3.914 3.777 4.063 . 0 0 "[ . 1 . 2]" 1
1109 1 45 GLU H 1 46 TYR HB3 4.600 . 4.830 4.458 4.211 4.560 . 0 0 "[ . 1 . 2]" 1
1110 1 42 GLY HA3 1 45 GLU H 5.120 . 5.380 4.544 4.303 4.747 . 0 0 "[ . 1 . 2]" 1
1111 1 42 GLY HA2 1 45 GLU H 3.870 . 4.060 3.365 3.144 3.556 . 0 0 "[ . 1 . 2]" 1
1112 1 45 GLU H 1 45 GLU HG2 3.930 . 4.130 3.580 1.874 4.335 0.205 4 0 "[ . 1 . 2]" 1
1113 1 44 LEU HB3 1 45 GLU H 3.940 . 4.140 3.673 3.551 3.851 . 0 0 "[ . 1 . 2]" 1
1114 1 43 LEU HB3 1 45 GLU H 5.210 . 5.470 5.004 4.870 5.168 . 0 0 "[ . 1 . 2]" 1
1115 1 45 GLU H 1 54 ALA MB 5.000 . 5.250 5.141 4.818 5.278 0.028 1 0 "[ . 1 . 2]" 1
1116 1 31 LEU MD1 1 45 GLU H 5.100 . 5.360 4.967 4.634 5.294 . 0 0 "[ . 1 . 2]" 1
1117 1 45 GLU H 1 47 ALA H 4.420 . 4.640 4.156 3.981 4.319 . 0 0 "[ . 1 . 2]" 1
1118 1 55 GLU H 1 74 ALA HA 4.320 . 4.540 4.474 4.263 4.585 0.045 3 0 "[ . 1 . 2]" 1
1119 1 55 GLU H 1 56 PHE QD 4.900 . 5.150 4.982 4.743 5.154 0.004 9 0 "[ . 1 . 2]" 1
1120 1 55 GLU H 1 55 GLU HG2 4.430 . 4.650 3.793 2.346 4.285 . 0 0 "[ . 1 . 2]" 1
1121 1 55 GLU H 1 55 GLU HB2 4.070 . 4.270 2.831 2.517 3.920 . 0 0 "[ . 1 . 2]" 1
1122 1 55 GLU H 1 55 GLU HB3 4.070 . 4.270 3.713 3.353 3.848 . 0 0 "[ . 1 . 2]" 1
1123 1 55 GLU H 1 75 LYS HB3 3.590 . 3.770 3.165 2.888 3.431 . 0 0 "[ . 1 . 2]" 1
1124 1 54 ALA HA 1 55 GLU H 2.630 . 2.760 2.136 2.116 2.163 . 0 0 "[ . 1 . 2]" 1
1125 1 53 ALA MB 1 55 GLU H 5.490 . 5.760 4.842 4.478 5.185 . 0 0 "[ . 1 . 2]" 1
1126 1 61 GLN H 1 62 SER H 4.510 . 4.740 3.992 3.701 4.369 . 0 0 "[ . 1 . 2]" 1
1127 1 60 ASP HA 1 61 GLN H 2.770 . 2.910 2.304 2.192 2.660 . 0 0 "[ . 1 . 2]" 1
1128 1 61 GLN H 1 61 GLN QB 3.390 . 3.560 2.870 2.475 3.218 . 0 0 "[ . 1 . 2]" 1
1129 1 104 LEU H 1 104 LEU HB3 3.670 . 3.850 3.563 3.553 3.575 . 0 0 "[ . 1 . 2]" 1
1130 1 61 GLN H 1 71 VAL HB 5.480 . 5.750 5.174 4.733 5.502 . 0 0 "[ . 1 . 2]" 1
1131 1 100 ALA MB 1 103 VAL H 4.700 . 4.940 4.491 4.401 4.622 . 0 0 "[ . 1 . 2]" 1
1132 1 103 VAL H 1 105 ILE H 4.860 . 5.100 4.238 4.001 4.370 . 0 0 "[ . 1 . 2]" 1
1133 1 102 ARG H 1 103 VAL H 3.600 . 3.780 2.705 2.648 2.769 . 0 0 "[ . 1 . 2]" 1
1134 1 103 VAL H 1 104 LEU H 3.460 . 3.630 2.700 2.588 2.772 . 0 0 "[ . 1 . 2]" 1
1135 1 81 PHE QE 1 103 VAL H 4.960 . 5.210 4.610 4.346 4.977 . 0 0 "[ . 1 . 2]" 1
1136 1 103 VAL H 1 104 LEU HA 5.500 . 5.780 5.308 5.240 5.367 . 0 0 "[ . 1 . 2]" 1
1137 1 103 VAL H 1 104 LEU HG 4.290 . 4.500 4.019 3.864 4.110 . 0 0 "[ . 1 . 2]" 1
1138 1 103 VAL H 1 104 LEU MD1 5.390 . 5.660 5.126 4.947 5.219 . 0 0 "[ . 1 . 2]" 1
1139 1 97 ALA H 1 98 ASP H 3.300 . 3.470 2.651 2.598 2.705 . 0 0 "[ . 1 . 2]" 1
1140 1 98 ASP H 1 98 ASP HB3 3.130 . 3.290 2.539 2.422 2.675 . 0 0 "[ . 1 . 2]" 1
1141 1 98 ASP H 1 98 ASP HB2 3.100 . 3.260 2.502 2.345 2.624 . 0 0 "[ . 1 . 2]" 1
1142 1 39 PRO HB2 1 98 ASP H 3.850 . 4.040 2.664 2.526 2.832 . 0 0 "[ . 1 . 2]" 1
1143 1 39 PRO HB3 1 98 ASP H 4.070 . 4.270 3.622 3.510 3.791 . 0 0 "[ . 1 . 2]" 1
1144 1 98 ASP H 1 99 ALA MB 4.650 . 4.880 4.476 4.390 4.561 . 0 0 "[ . 1 . 2]" 1
1145 1 98 ASP H 1 100 ALA MB 4.760 . 5.000 4.572 4.499 4.653 . 0 0 "[ . 1 . 2]" 1
1146 1 94 GLN HA 1 98 ASP H 4.770 . 5.010 3.851 3.677 4.002 . 0 0 "[ . 1 . 2]" 1
1147 1 25 VAL H 1 25 VAL HB 3.630 . 3.810 3.100 2.500 3.660 . 0 0 "[ . 1 . 2]" 1
1148 1 81 PHE QE 1 104 LEU H 4.890 . 5.130 3.624 3.444 3.800 . 0 0 "[ . 1 . 2]" 1
1149 1 101 LEU HA 1 104 LEU H 3.720 . 3.910 3.290 3.177 3.425 . 0 0 "[ . 1 . 2]" 1
1150 1 103 VAL HB 1 104 LEU H 3.470 . 3.640 2.367 2.217 2.498 . 0 0 "[ . 1 . 2]" 1
1151 1 104 LEU H 1 104 LEU HB2 3.670 . 3.850 2.666 2.631 2.727 . 0 0 "[ . 1 . 2]" 1
1152 1 104 LEU H 1 104 LEU HG 3.840 . 4.030 1.899 1.819 1.972 . 0 0 "[ . 1 . 2]" 1
1153 1 104 LEU H 1 104 LEU MD2 3.730 . 3.920 2.902 2.784 3.016 . 0 0 "[ . 1 . 2]" 1
1154 1 100 ALA HA 1 103 VAL H 3.830 . 4.020 3.365 3.261 3.490 . 0 0 "[ . 1 . 2]" 1
1155 1 103 VAL H 1 103 VAL HB 3.140 . 3.300 2.600 2.533 2.646 . 0 0 "[ . 1 . 2]" 1
1156 1 102 ARG QB 1 103 VAL H 3.810 . 4.000 2.619 2.385 2.908 . 0 0 "[ . 1 . 2]" 1
1157 1 103 VAL H 1 103 VAL MG1 3.880 . 4.070 3.778 3.760 3.792 . 0 0 "[ . 1 . 2]" 1
1158 1 103 VAL H 1 103 VAL MG2 3.290 . 3.450 2.019 1.881 2.196 . 0 0 "[ . 1 . 2]" 1
1159 1 39 PRO HG3 1 98 ASP H 4.640 . 4.870 3.931 3.686 4.173 . 0 0 "[ . 1 . 2]" 1
1160 1 95 GLU H 1 98 ASP H 4.960 . 5.210 4.636 4.497 4.730 . 0 0 "[ . 1 . 2]" 1
1161 1 35 LEU H 1 39 PRO HA 5.410 . 5.680 4.527 4.230 4.769 . 0 0 "[ . 1 . 2]" 1
1162 1 35 LEU H 1 105 ILE MD 4.400 . 4.620 4.472 4.294 4.633 0.013 8 0 "[ . 1 . 2]" 1
1163 1 34 TYR H 1 35 LEU H 3.130 . 3.290 2.487 2.407 2.551 . 0 0 "[ . 1 . 2]" 1
1164 1 33 ARG H 1 35 LEU H 4.470 . 4.690 4.080 4.010 4.171 . 0 0 "[ . 1 . 2]" 1
1165 1 33 ARG HA 1 35 LEU H 4.610 . 4.840 4.222 4.121 4.341 . 0 0 "[ . 1 . 2]" 1
1166 1 32 VAL HA 1 35 LEU H 3.620 . 3.800 3.201 3.054 3.324 . 0 0 "[ . 1 . 2]" 1
1167 1 34 TYR HB3 1 35 LEU H 3.950 . 4.150 3.727 3.607 3.828 . 0 0 "[ . 1 . 2]" 1
1168 1 34 TYR HB2 1 35 LEU H 3.700 . 3.890 2.940 2.828 3.050 . 0 0 "[ . 1 . 2]" 1
1169 1 35 LEU H 1 35 LEU QB 2.960 . 3.110 2.432 2.341 2.502 . 0 0 "[ . 1 . 2]" 1
1170 1 35 LEU H 1 35 LEU HG 3.150 . 3.310 2.329 2.139 2.557 . 0 0 "[ . 1 . 2]" 1
1171 1 35 LEU H 1 35 LEU MD2 3.660 . 3.840 3.338 3.194 3.537 . 0 0 "[ . 1 . 2]" 1
1172 1 35 LEU H 1 36 ASN H 4.430 . 4.650 2.610 2.507 2.713 . 0 0 "[ . 1 . 2]" 1
1173 1 34 TYR QD 1 35 LEU H 4.520 . 4.750 4.505 4.399 4.603 . 0 0 "[ . 1 . 2]" 1
1174 1 35 LEU H 1 36 ASN HA 5.440 . 5.710 5.258 5.172 5.327 . 0 0 "[ . 1 . 2]" 1
1175 1 108 ASN HB2 1 109 GLU H 4.800 . 5.040 3.975 3.774 4.265 . 0 0 "[ . 1 . 2]" 1
1176 1 70 PHE H 1 71 VAL H 4.900 . 5.150 4.360 4.238 4.522 . 0 0 "[ . 1 . 2]" 1
1177 1 69 LYS H 1 70 PHE H 4.710 . 4.950 4.322 4.104 4.493 . 0 0 "[ . 1 . 2]" 1
1178 1 70 PHE H 1 70 PHE QD 3.570 . 3.750 2.549 2.146 2.889 . 0 0 "[ . 1 . 2]" 1
1179 1 70 PHE H 1 87 HIS HA 3.930 . 4.130 3.285 2.654 3.870 . 0 0 "[ . 1 . 2]" 1
1180 1 69 LYS HA 1 70 PHE H 3.040 . 3.190 2.108 2.062 2.175 . 0 0 "[ . 1 . 2]" 1
1181 1 69 LYS QB 1 70 PHE H 3.660 . 3.840 3.790 3.462 3.885 0.045 19 0 "[ . 1 . 2]" 1
1182 1 69 LYS QG 1 70 PHE H 3.890 . 4.080 3.098 2.535 4.102 0.022 8 0 "[ . 1 . 2]" 1
1183 1 55 GLU H 1 56 PHE H 4.390 . 4.610 4.343 4.190 4.441 . 0 0 "[ . 1 . 2]" 1
1184 1 56 PHE H 1 56 PHE QD 3.520 . 3.700 2.734 2.198 3.080 . 0 0 "[ . 1 . 2]" 1
1185 1 55 GLU HA 1 56 PHE H 2.680 . 2.810 2.201 2.104 2.422 . 0 0 "[ . 1 . 2]" 1
1186 1 56 PHE H 1 56 PHE HB2 3.350 . 3.520 2.551 2.432 2.703 . 0 0 "[ . 1 . 2]" 1
1187 1 56 PHE H 1 56 PHE HB3 3.860 . 4.050 3.721 3.639 3.812 . 0 0 "[ . 1 . 2]" 1
1188 1 55 GLU HB2 1 56 PHE H 4.160 . 4.370 3.900 2.660 4.393 0.023 1 0 "[ . 1 . 2]" 1
1189 1 55 GLU HB3 1 56 PHE H 4.160 . 4.370 3.191 2.312 4.038 . 0 0 "[ . 1 . 2]" 1
1190 1 56 PHE H 1 57 LYS H 4.530 . 4.760 4.190 4.027 4.424 . 0 0 "[ . 1 . 2]" 1
1191 1 93 LYS H 1 95 GLU H 4.960 . 5.210 4.277 4.129 4.409 . 0 0 "[ . 1 . 2]" 1
1192 1 93 LYS H 1 96 ALA H 4.880 . 5.120 4.755 4.632 4.835 . 0 0 "[ . 1 . 2]" 1
1193 1 92 GLY H 1 93 LYS H 3.430 . 3.600 2.818 2.718 2.938 . 0 0 "[ . 1 . 2]" 1
1194 1 72 TYR QD 1 93 LYS H 4.840 . 5.080 4.326 3.846 4.619 . 0 0 "[ . 1 . 2]" 1
1195 1 72 TYR QE 1 93 LYS H 5.170 . 5.430 4.681 4.191 5.161 . 0 0 "[ . 1 . 2]" 1
1196 1 91 GLN HA 1 93 LYS H 4.560 . 4.790 4.458 4.255 4.768 . 0 0 "[ . 1 . 2]" 1
1197 1 90 LYS HA 1 93 LYS H 3.970 . 4.170 3.559 3.158 3.936 . 0 0 "[ . 1 . 2]" 1
1198 1 89 LYS HA 1 93 LYS H 4.780 . 5.020 4.393 4.041 4.611 . 0 0 "[ . 1 . 2]" 1
1199 1 92 GLY QA 1 93 LYS H 3.350 . 3.520 2.655 2.624 2.695 . 0 0 "[ . 1 . 2]" 1
1200 1 93 LYS H 1 93 LYS QE 5.470 . 5.740 4.702 4.561 5.059 . 0 0 "[ . 1 . 2]" 1
1201 1 93 LYS H 1 95 GLU QG 5.500 . 5.780 5.430 4.932 5.767 . 0 0 "[ . 1 . 2]" 1
1202 1 90 LYS QB 1 93 LYS H 5.500 . 5.780 5.107 4.722 5.460 . 0 0 "[ . 1 . 2]" 1
1203 1 93 LYS H 1 94 GLN QG 5.500 . 5.780 4.374 4.169 4.625 . 0 0 "[ . 1 . 2]" 1
1204 1 93 LYS H 1 94 GLN QB 4.570 . 4.800 4.674 4.543 4.808 0.008 5 0 "[ . 1 . 2]" 1
1205 1 91 GLN QB 1 93 LYS H 4.930 . 5.180 4.789 4.653 4.884 . 0 0 "[ . 1 . 2]" 1
1206 1 93 LYS H 1 96 ALA MB 4.650 . 4.880 4.695 4.556 4.870 . 0 0 "[ . 1 . 2]" 1
1207 1 86 ALA MB 1 93 LYS H 4.460 . 4.680 4.659 4.437 4.758 0.078 10 0 "[ . 1 . 2]" 1
1208 1 93 LYS H 1 93 LYS QD 4.170 . 4.380 3.725 3.522 3.895 . 0 0 "[ . 1 . 2]" 1
1209 1 89 LYS QG 1 93 LYS H 4.530 . 4.760 4.520 3.818 4.826 0.066 12 0 "[ . 1 . 2]" 1
1210 1 93 LYS H 1 93 LYS HB2 3.310 . 3.480 2.509 2.434 2.562 . 0 0 "[ . 1 . 2]" 1
1211 1 93 LYS H 1 93 LYS HG2 3.620 . 3.800 3.392 3.263 3.554 . 0 0 "[ . 1 . 2]" 1
1212 1 93 LYS H 1 93 LYS HG3 3.620 . 3.800 2.174 2.028 2.398 . 0 0 "[ . 1 . 2]" 1
1213 1 30 GLU H 1 30 GLU HG2 4.890 . 5.130 2.838 2.050 3.839 . 0 0 "[ . 1 . 2]" 1
1214 1 30 GLU H 1 30 GLU QB 3.670 . 3.850 2.425 2.288 2.606 . 0 0 "[ . 1 . 2]" 1
1215 1 105 ILE H 1 107 GLU H 4.750 . 4.990 4.140 3.995 4.360 . 0 0 "[ . 1 . 2]" 1
1216 1 106 GLY HA3 1 107 GLU H 3.250 . 3.410 2.857 2.721 3.001 . 0 0 "[ . 1 . 2]" 1
1217 1 103 VAL HA 1 107 GLU H 4.190 . 4.400 3.962 3.669 4.414 0.014 2 0 "[ . 1 . 2]" 1
1218 1 105 ILE HA 1 107 GLU H 4.820 . 5.060 4.434 4.029 4.676 . 0 0 "[ . 1 . 2]" 1
1219 1 107 GLU H 1 107 GLU QB 2.930 . 3.080 2.284 2.192 2.490 . 0 0 "[ . 1 . 2]" 1
1220 1 105 ILE HB 1 107 GLU H 5.210 . 5.470 4.928 4.714 5.160 . 0 0 "[ . 1 . 2]" 1
1221 1 103 VAL MG1 1 107 GLU H 4.870 . 5.110 4.073 3.860 4.527 . 0 0 "[ . 1 . 2]" 1
1222 1 105 ILE MG 1 107 GLU H 5.100 . 5.360 4.907 4.735 5.131 . 0 0 "[ . 1 . 2]" 1
1223 1 62 SER H 1 63 GLY H 4.490 . 4.710 4.119 3.492 4.417 . 0 0 "[ . 1 . 2]" 1
1224 1 62 SER H 1 70 PHE QD 5.500 . 5.780 5.519 4.727 5.826 0.046 5 0 "[ . 1 . 2]" 1
1225 1 61 GLN HA 1 62 SER H 2.990 . 3.140 2.164 2.088 2.280 . 0 0 "[ . 1 . 2]" 1
1226 1 61 GLN QB 1 62 SER H 3.980 . 4.180 3.636 2.598 4.003 . 0 0 "[ . 1 . 2]" 1
1227 1 62 SER H 1 69 LYS QB 4.020 . 4.220 3.322 2.936 3.929 . 0 0 "[ . 1 . 2]" 1
1228 1 79 ARG H 1 80 TRP H 4.850 . 5.090 4.441 4.307 4.530 . 0 0 "[ . 1 . 2]" 1
1229 1 76 VAL HB 1 79 ARG H 4.960 . 5.210 4.279 3.999 4.630 . 0 0 "[ . 1 . 2]" 1
1230 1 79 ARG H 1 79 ARG HG3 4.850 . 5.090 3.803 2.647 4.817 . 0 0 "[ . 1 . 2]" 1
1231 1 76 VAL MG1 1 79 ARG H 5.280 . 5.540 4.526 4.358 4.687 . 0 0 "[ . 1 . 2]" 1
1232 1 76 VAL H 1 77 GLY H 4.830 . 5.070 4.058 3.940 4.135 . 0 0 "[ . 1 . 2]" 1
1233 1 76 VAL MG2 1 77 GLY H 4.430 . 4.650 4.177 4.086 4.243 . 0 0 "[ . 1 . 2]" 1
1234 1 52 PHE QD 1 77 GLY H 4.670 . 4.900 4.103 3.866 4.285 . 0 0 "[ . 1 . 2]" 1
1235 1 54 ALA HA 1 77 GLY H 5.110 . 5.370 3.768 3.230 4.473 . 0 0 "[ . 1 . 2]" 1
1236 1 76 VAL HA 1 77 GLY H 3.430 . 3.600 2.150 2.113 2.204 . 0 0 "[ . 1 . 2]" 1
1237 1 52 PHE HB3 1 77 GLY H 4.330 . 4.550 3.109 2.520 3.317 . 0 0 "[ . 1 . 2]" 1
1238 1 52 PHE HB2 1 77 GLY H 4.700 . 4.940 4.674 4.131 4.958 0.018 6 0 "[ . 1 . 2]" 1
1239 1 76 VAL MG1 1 77 GLY H 3.910 . 4.110 3.248 3.125 3.460 . 0 0 "[ . 1 . 2]" 1
1240 1 76 VAL HB 1 77 GLY H 4.920 . 5.170 4.408 4.345 4.462 . 0 0 "[ . 1 . 2]" 1
1241 1 85 CYS H 1 86 ALA MB 5.190 . 5.450 4.530 4.303 4.891 . 0 0 "[ . 1 . 2]" 1
1242 1 84 VAL HA 1 85 CYS H 2.840 . 2.980 2.336 2.129 2.499 . 0 0 "[ . 1 . 2]" 1
1243 1 85 CYS H 1 85 CYS HB2 4.060 . 4.260 3.687 2.713 3.817 . 0 0 "[ . 1 . 2]" 1
1244 1 84 VAL HB 1 85 CYS H 3.090 . 3.240 2.547 2.140 3.177 . 0 0 "[ . 1 . 2]" 1
1245 1 71 VAL HA 1 85 CYS H 5.030 . 5.280 4.575 4.220 4.913 . 0 0 "[ . 1 . 2]" 1
1246 1 62 SER H 1 69 LYS H 4.450 . 4.670 3.904 3.168 4.604 . 0 0 "[ . 1 . 2]" 1
1247 1 61 GLN HA 1 69 LYS H 5.500 . 5.780 4.986 4.282 5.504 . 0 0 "[ . 1 . 2]" 1
1248 1 69 LYS H 1 70 PHE HA 5.500 . 5.780 5.055 4.665 5.234 . 0 0 "[ . 1 . 2]" 1
1249 1 62 SER HA 1 69 LYS H 5.080 . 5.330 4.930 4.409 5.359 0.029 20 0 "[ . 1 . 2]" 1
1250 1 68 PRO HA 1 69 LYS H 3.020 . 3.170 2.204 2.147 2.330 . 0 0 "[ . 1 . 2]" 1
1251 1 101 LEU HB2 1 105 ILE H 5.500 . 5.780 5.360 5.199 5.509 . 0 0 "[ . 1 . 2]" 1
1252 1 103 VAL MG1 1 105 ILE H 5.500 . 5.780 5.147 5.037 5.310 . 0 0 "[ . 1 . 2]" 1
1253 1 48 ARG H 1 51 GLY H 4.830 . 5.070 4.854 4.692 5.001 . 0 0 "[ . 1 . 2]" 1
1254 1 69 LYS H 1 69 LYS QE 5.340 . 5.610 4.408 2.880 5.474 . 0 0 "[ . 1 . 2]" 1
1255 1 69 LYS H 1 69 LYS QB 3.190 . 3.350 2.351 2.179 2.565 . 0 0 "[ . 1 . 2]" 1
1256 1 69 LYS H 1 69 LYS QG 4.870 . 5.110 3.959 2.672 4.096 . 0 0 "[ . 1 . 2]" 1
1257 1 31 LEU HA 1 33 ARG H 4.760 . 5.000 4.259 4.085 4.466 . 0 0 "[ . 1 . 2]" 1
1258 1 104 LEU H 1 105 ILE H 3.530 . 3.710 2.754 2.588 2.840 . 0 0 "[ . 1 . 2]" 1
1259 1 102 ARG HA 1 105 ILE H 3.810 . 4.000 3.608 3.188 3.817 . 0 0 "[ . 1 . 2]" 1
1260 1 103 VAL HB 1 105 ILE H 5.500 . 5.780 4.994 4.901 5.124 . 0 0 "[ . 1 . 2]" 1
1261 1 105 ILE H 1 105 ILE HB 3.040 . 3.190 2.485 2.419 2.552 . 0 0 "[ . 1 . 2]" 1
1262 1 105 ILE H 1 105 ILE HG13 3.110 . 3.270 2.095 1.987 2.187 . 0 0 "[ . 1 . 2]" 1
1263 1 105 ILE H 1 105 ILE MG 3.810 . 4.000 3.751 3.738 3.760 . 0 0 "[ . 1 . 2]" 1
1264 1 105 ILE H 1 105 ILE MD 3.400 . 3.570 3.402 3.330 3.467 . 0 0 "[ . 1 . 2]" 1
1265 1 47 ALA H 1 48 ARG H 3.270 . 3.430 2.676 2.647 2.708 . 0 0 "[ . 1 . 2]" 1
1266 1 46 TYR H 1 48 ARG H 4.450 . 4.670 4.305 4.081 4.478 . 0 0 "[ . 1 . 2]" 1
1267 1 46 TYR QD 1 48 ARG H 4.880 . 5.120 5.131 5.080 5.184 0.064 16 0 "[ . 1 . 2]" 1
1268 1 45 GLU HA 1 48 ARG H 3.520 . 3.700 3.412 2.912 3.666 . 0 0 "[ . 1 . 2]" 1
1269 1 47 ALA HA 1 48 ARG H 3.560 . 3.740 3.548 3.533 3.561 . 0 0 "[ . 1 . 2]" 1
1270 1 48 ARG H 1 48 ARG HD3 4.810 . 5.050 4.171 3.774 4.831 . 0 0 "[ . 1 . 2]" 1
1271 1 48 ARG H 1 48 ARG HB3 2.750 . 2.890 2.292 2.024 2.413 . 0 0 "[ . 1 . 2]" 1
1272 1 48 ARG H 1 48 ARG HB2 3.520 . 3.700 3.481 2.609 3.589 . 0 0 "[ . 1 . 2]" 1
1273 1 48 ARG H 1 54 ALA MB 4.510 . 4.740 4.336 4.056 4.603 . 0 0 "[ . 1 . 2]" 1
1274 1 32 VAL H 1 33 ARG H 3.080 . 3.230 2.620 2.523 2.731 . 0 0 "[ . 1 . 2]" 1
1275 1 30 GLU HA 1 33 ARG H 3.830 . 4.020 3.213 2.768 3.614 . 0 0 "[ . 1 . 2]" 1
1276 1 33 ARG H 1 34 TYR HB2 4.850 . 5.090 4.686 4.595 4.768 . 0 0 "[ . 1 . 2]" 1
1277 1 33 ARG H 1 33 ARG QB 2.740 . 2.880 2.252 2.010 2.542 . 0 0 "[ . 1 . 2]" 1
1278 1 33 ARG H 1 33 ARG HG2 3.340 . 3.510 2.855 2.164 3.585 0.075 8 0 "[ . 1 . 2]" 1
1279 1 32 VAL MG2 1 33 ARG H 3.920 . 4.120 3.807 3.713 3.943 . 0 0 "[ . 1 . 2]" 1
1280 1 44 LEU H 1 45 GLU HA 5.320 . 5.590 5.246 5.165 5.308 . 0 0 "[ . 1 . 2]" 1
1281 1 41 GLY QA 1 44 LEU H 3.750 . 3.940 3.525 3.390 3.635 . 0 0 "[ . 1 . 2]" 1
1282 1 42 GLY HA2 1 44 LEU H 5.000 . 5.250 4.432 4.300 4.553 . 0 0 "[ . 1 . 2]" 1
1283 1 44 LEU H 1 44 LEU HB2 2.700 . 2.840 2.467 2.407 2.506 . 0 0 "[ . 1 . 2]" 1
1284 1 43 LEU HB3 1 44 LEU H 3.840 . 4.030 2.583 2.512 2.639 . 0 0 "[ . 1 . 2]" 1
1285 1 44 LEU H 1 54 ALA MB 4.470 . 4.690 4.139 3.966 4.289 . 0 0 "[ . 1 . 2]" 1
1286 1 44 LEU H 1 56 PHE HZ 5.020 . 5.270 4.413 4.079 4.768 . 0 0 "[ . 1 . 2]" 1
1287 1 38 ASN HA 1 40 VAL H 4.130 . 4.340 3.757 3.642 3.844 . 0 0 "[ . 1 . 2]" 1
1288 1 39 PRO HD3 1 40 VAL H 4.290 . 4.500 3.995 3.950 4.062 . 0 0 "[ . 1 . 2]" 1
1289 1 40 VAL H 1 40 VAL HB 2.770 . 2.910 2.611 2.554 2.654 . 0 0 "[ . 1 . 2]" 1
1290 1 40 VAL H 1 97 ALA MB 3.310 . 3.480 3.141 3.060 3.215 . 0 0 "[ . 1 . 2]" 1
1291 1 40 VAL H 1 94 GLN HA 3.740 . 3.930 3.884 3.616 3.963 0.033 16 0 "[ . 1 . 2]" 1
1292 1 38 ASN QB 1 40 VAL H 4.810 . 5.050 4.294 4.099 4.480 . 0 0 "[ . 1 . 2]" 1
1293 1 39 PRO HB2 1 40 VAL H 3.340 . 3.510 3.150 3.073 3.257 . 0 0 "[ . 1 . 2]" 1
1294 1 39 PRO HB3 1 40 VAL H 4.000 . 4.200 4.102 4.054 4.164 . 0 0 "[ . 1 . 2]" 1
1295 1 40 VAL H 1 40 VAL MG2 3.810 . 4.000 1.963 1.892 2.042 . 0 0 "[ . 1 . 2]" 1
1296 1 40 VAL H 1 40 VAL MG1 3.810 . 4.000 3.770 3.762 3.774 . 0 0 "[ . 1 . 2]" 1
1297 1 30 GLU QB 1 31 LEU H 3.500 . 3.680 2.646 2.292 3.052 . 0 0 "[ . 1 . 2]" 1
1298 1 31 LEU H 1 31 LEU MD1 3.640 . 3.820 3.276 2.960 3.708 . 0 0 "[ . 1 . 2]" 1
1299 1 98 ASP HB3 1 100 ALA H 4.890 . 5.130 4.704 4.594 4.807 . 0 0 "[ . 1 . 2]" 1
1300 1 43 LEU HB2 1 100 ALA H 5.350 . 5.620 5.582 5.375 5.663 0.043 8 0 "[ . 1 . 2]" 1
1301 1 100 ALA H 1 101 LEU HG 5.020 . 5.270 4.406 4.066 4.571 . 0 0 "[ . 1 . 2]" 1
1302 1 31 LEU H 1 32 VAL HA 5.500 . 5.780 5.202 5.120 5.287 . 0 0 "[ . 1 . 2]" 1
1303 1 31 LEU H 1 33 ARG H 5.170 . 5.430 4.110 3.832 4.294 . 0 0 "[ . 1 . 2]" 1
1304 1 29 GLY HA3 1 31 LEU H 5.300 . 5.570 4.783 4.590 4.971 . 0 0 "[ . 1 . 2]" 1
1305 1 31 LEU H 1 31 LEU HB3 3.750 . 3.940 3.596 3.554 3.614 . 0 0 "[ . 1 . 2]" 1
1306 1 31 LEU H 1 31 LEU MD2 4.190 . 4.400 1.884 1.759 2.187 0.041 13 0 "[ . 1 . 2]" 1
1307 1 31 LEU H 1 105 ILE MD 4.900 . 5.150 4.399 4.161 4.621 . 0 0 "[ . 1 . 2]" 1
1308 1 74 ALA MB 1 100 ALA H 5.030 . 5.280 4.738 4.437 4.970 . 0 0 "[ . 1 . 2]" 1
1309 1 100 ALA H 1 102 ARG H 4.670 . 4.900 4.080 3.918 4.328 . 0 0 "[ . 1 . 2]" 1
1310 1 96 ALA HA 1 100 ALA H 4.810 . 5.050 4.025 3.917 4.127 . 0 0 "[ . 1 . 2]" 1
1311 1 98 ASP HA 1 100 ALA H 5.180 . 5.440 4.411 4.297 4.486 . 0 0 "[ . 1 . 2]" 1
1312 1 97 ALA HA 1 100 ALA H 3.900 . 4.100 3.447 3.319 3.565 . 0 0 "[ . 1 . 2]" 1
1313 1 99 ALA MB 1 100 ALA H 3.260 . 3.420 2.673 2.558 2.815 . 0 0 "[ . 1 . 2]" 1
1314 1 100 ALA H 1 100 ALA MB 2.920 . 3.070 2.243 2.233 2.258 . 0 0 "[ . 1 . 2]" 1
1315 1 98 ASP H 1 99 ALA H 3.280 . 3.440 2.824 2.751 2.913 . 0 0 "[ . 1 . 2]" 1
1316 1 99 ALA H 1 100 ALA H 3.420 . 3.590 2.632 2.564 2.708 . 0 0 "[ . 1 . 2]" 1
1317 1 98 ASP HB3 1 99 ALA H 3.290 . 3.450 2.295 2.163 2.407 . 0 0 "[ . 1 . 2]" 1
1318 1 98 ASP HB2 1 99 ALA H 3.670 . 3.850 3.701 3.542 3.797 . 0 0 "[ . 1 . 2]" 1
1319 1 99 ALA H 1 99 ALA MB 2.810 . 2.950 2.238 2.224 2.249 . 0 0 "[ . 1 . 2]" 1
1320 1 99 ALA H 1 100 ALA MB 4.410 . 4.630 4.316 4.264 4.384 . 0 0 "[ . 1 . 2]" 1
1321 1 97 ALA H 1 99 ALA H 4.720 . 4.960 4.376 4.225 4.490 . 0 0 "[ . 1 . 2]" 1
1322 1 108 ASN H 1 108 ASN HB2 4.050 . 4.250 2.544 2.315 2.874 . 0 0 "[ . 1 . 2]" 1
1323 1 105 ILE HA 1 108 ASN H 5.440 . 5.710 3.652 3.346 3.899 . 0 0 "[ . 1 . 2]" 1
1324 1 108 ASN H 1 108 ASN HB3 3.830 . 4.020 2.634 2.293 2.953 . 0 0 "[ . 1 . 2]" 1
1325 1 52 PHE H 1 53 ALA H 4.590 . 4.820 4.537 4.437 4.599 . 0 0 "[ . 1 . 2]" 1
1326 1 51 GLY H 1 52 PHE H 2.800 . 2.940 2.303 1.961 2.484 . 0 0 "[ . 1 . 2]" 1
1327 1 50 HIS H 1 52 PHE H 3.470 . 3.640 3.465 3.220 3.640 . 0 0 "[ . 1 . 2]" 1
1328 1 52 PHE H 1 52 PHE QD 3.530 . 3.710 2.710 2.372 3.186 . 0 0 "[ . 1 . 2]" 1
1329 1 46 TYR QE 1 52 PHE H 5.500 . 5.780 5.811 5.690 5.865 0.085 2 0 "[ . 1 . 2]" 1
1330 1 51 GLY HA3 1 52 PHE H 3.430 . 3.600 3.344 3.225 3.427 . 0 0 "[ . 1 . 2]" 1
1331 1 51 GLY HA2 1 52 PHE H 3.410 . 3.580 3.195 3.038 3.316 . 0 0 "[ . 1 . 2]" 1
1332 1 52 PHE H 1 52 PHE HB3 3.650 . 3.830 3.651 3.613 3.686 . 0 0 "[ . 1 . 2]" 1
1333 1 50 HIS HB2 1 52 PHE H 4.080 . 4.280 3.278 3.108 3.382 . 0 0 "[ . 1 . 2]" 1
1334 1 52 PHE H 1 52 PHE HB2 2.980 . 3.130 2.466 2.400 2.516 . 0 0 "[ . 1 . 2]" 1
1335 1 50 HIS HB3 1 52 PHE H 3.820 . 4.010 4.036 3.828 4.090 0.080 12 0 "[ . 1 . 2]" 1
1336 1 47 ALA MB 1 52 PHE H 3.510 . 3.690 3.498 3.344 3.688 . 0 0 "[ . 1 . 2]" 1
1337 1 88 SER H 1 91 GLN H 5.100 . 5.360 4.318 4.023 4.666 . 0 0 "[ . 1 . 2]" 1
1338 1 91 GLN H 1 92 GLY QA 4.990 . 5.240 4.499 4.347 4.704 . 0 0 "[ . 1 . 2]" 1
1339 1 95 GLU H 1 96 ALA H 3.350 . 3.520 2.686 2.538 2.779 . 0 0 "[ . 1 . 2]" 1
1340 1 94 GLN H 1 95 GLU H 3.400 . 3.570 2.686 2.575 2.798 . 0 0 "[ . 1 . 2]" 1
1341 1 91 GLN HA 1 95 GLU H 3.820 . 4.010 3.670 3.513 3.926 . 0 0 "[ . 1 . 2]" 1
1342 1 92 GLY QA 1 95 GLU H 4.150 . 4.360 3.638 3.460 3.860 . 0 0 "[ . 1 . 2]" 1
1343 1 95 GLU H 1 95 GLU QG 2.980 . 3.130 2.301 2.091 2.587 . 0 0 "[ . 1 . 2]" 1
1344 1 94 GLN QB 1 95 GLU H 2.950 . 3.100 2.482 2.389 2.692 . 0 0 "[ . 1 . 2]" 1
1345 1 95 GLU H 1 95 GLU HB2 3.170 . 3.330 2.453 2.331 2.585 . 0 0 "[ . 1 . 2]" 1
1346 1 93 LYS HB2 1 95 GLU H 5.500 . 5.780 5.089 4.913 5.244 . 0 0 "[ . 1 . 2]" 1
1347 1 91 GLN H 1 91 GLN QG 4.410 . 4.630 2.404 2.232 2.841 . 0 0 "[ . 1 . 2]" 1
1348 1 91 GLN H 1 91 GLN QB 3.430 . 3.600 2.381 2.210 2.481 . 0 0 "[ . 1 . 2]" 1
1349 1 33 ARG H 1 34 TYR H 3.210 . 3.370 2.580 2.510 2.651 . 0 0 "[ . 1 . 2]" 1
1350 1 34 TYR H 1 34 TYR QE 4.980 . 5.230 4.704 4.590 4.794 . 0 0 "[ . 1 . 2]" 1
1351 1 33 ARG HA 1 34 TYR H 3.560 . 3.740 3.477 3.437 3.516 . 0 0 "[ . 1 . 2]" 1
1352 1 34 TYR H 1 39 PRO HA 5.500 . 5.780 5.591 5.388 5.788 0.008 6 0 "[ . 1 . 2]" 1
1353 1 32 VAL HA 1 34 TYR H 4.000 . 4.200 4.029 3.911 4.188 . 0 0 "[ . 1 . 2]" 1
1354 1 34 TYR H 1 34 TYR HB3 3.580 . 3.760 3.586 3.571 3.599 . 0 0 "[ . 1 . 2]" 1
1355 1 34 TYR H 1 34 TYR HB2 3.060 . 3.210 2.345 2.320 2.375 . 0 0 "[ . 1 . 2]" 1
1356 1 33 ARG QB 1 34 TYR H 3.510 . 3.690 3.483 3.148 3.648 . 0 0 "[ . 1 . 2]" 1
1357 1 33 ARG HG2 1 34 TYR H 3.710 . 3.900 2.552 2.386 2.936 . 0 0 "[ . 1 . 2]" 1
1358 1 33 ARG HG3 1 34 TYR H 4.030 . 4.230 3.287 2.789 3.940 . 0 0 "[ . 1 . 2]" 1
1359 1 34 TYR H 1 105 ILE MD 5.200 . 5.460 5.120 4.919 5.284 . 0 0 "[ . 1 . 2]" 1
1360 1 34 TYR H 1 35 LEU HA 5.360 . 5.630 5.119 5.056 5.175 . 0 0 "[ . 1 . 2]" 1
1361 1 31 LEU H 1 32 VAL H 3.210 . 3.370 2.567 2.489 2.678 . 0 0 "[ . 1 . 2]" 1
1362 1 30 GLU HA 1 32 VAL H 4.720 . 4.960 4.105 3.797 4.372 . 0 0 "[ . 1 . 2]" 1
1363 1 32 VAL H 1 33 ARG HA 5.380 . 5.650 5.232 5.149 5.321 . 0 0 "[ . 1 . 2]" 1
1364 1 32 VAL H 1 32 VAL HB 2.700 . 2.840 2.565 2.462 2.651 . 0 0 "[ . 1 . 2]" 1
1365 1 31 LEU HB2 1 32 VAL H 3.480 . 3.650 2.828 2.712 2.985 . 0 0 "[ . 1 . 2]" 1
1366 1 32 VAL H 1 33 ARG QB 4.480 . 4.700 4.548 4.143 4.770 0.070 7 0 "[ . 1 . 2]" 1
1367 1 31 LEU HB3 1 32 VAL H 3.600 . 3.780 3.683 3.490 3.825 0.045 13 0 "[ . 1 . 2]" 1
1368 1 32 VAL H 1 105 ILE MD 3.810 . 4.000 3.108 2.997 3.361 . 0 0 "[ . 1 . 2]" 1
1369 1 48 ARG H 1 50 HIS H 3.990 . 4.190 4.049 3.944 4.163 . 0 0 "[ . 1 . 2]" 1
1370 1 49 SER H 1 50 HIS H 3.030 . 3.180 2.483 2.398 2.581 . 0 0 "[ . 1 . 2]" 1
1371 1 50 HIS H 1 52 PHE QD 4.580 . 4.810 4.012 3.754 4.301 . 0 0 "[ . 1 . 2]" 1
1372 1 49 SER HA 1 50 HIS H 3.530 . 3.710 3.484 3.368 3.521 . 0 0 "[ . 1 . 2]" 1
1373 1 49 SER HB2 1 50 HIS H 4.160 . 4.370 4.011 2.765 4.319 . 0 0 "[ . 1 . 2]" 1
1374 1 49 SER HB3 1 50 HIS H 3.540 . 3.720 3.002 2.767 3.694 . 0 0 "[ . 1 . 2]" 1
1375 1 50 HIS H 1 50 HIS HB2 3.070 . 3.220 2.404 2.328 2.503 . 0 0 "[ . 1 . 2]" 1
1376 1 50 HIS H 1 52 PHE HB2 4.920 . 5.170 4.788 4.554 5.006 . 0 0 "[ . 1 . 2]" 1
1377 1 50 HIS H 1 50 HIS HB3 3.700 . 3.890 3.638 3.590 3.702 . 0 0 "[ . 1 . 2]" 1
1378 1 47 ALA MB 1 50 HIS H 4.660 . 4.890 4.529 4.451 4.619 . 0 0 "[ . 1 . 2]" 1
1379 1 39 PRO HB2 1 101 LEU H 5.290 . 5.550 5.261 4.981 5.508 . 0 0 "[ . 1 . 2]" 1
1380 1 100 ALA H 1 101 LEU H 3.350 . 3.520 2.733 2.632 2.852 . 0 0 "[ . 1 . 2]" 1
1381 1 98 ASP HA 1 101 LEU H 3.920 . 4.120 3.722 3.575 3.887 . 0 0 "[ . 1 . 2]" 1
1382 1 97 ALA HA 1 101 LEU H 4.370 . 4.590 4.026 3.776 4.250 . 0 0 "[ . 1 . 2]" 1
1383 1 101 LEU H 1 101 LEU HG 3.110 . 3.270 2.208 2.051 2.309 . 0 0 "[ . 1 . 2]" 1
1384 1 43 LEU HG 1 101 LEU H 5.500 . 5.780 4.855 4.514 5.347 . 0 0 "[ . 1 . 2]" 1
1385 1 97 ALA MB 1 101 LEU H 5.500 . 5.780 4.538 4.316 4.719 . 0 0 "[ . 1 . 2]" 1
1386 1 101 LEU H 1 104 LEU HG 5.500 . 5.780 4.456 4.267 4.697 . 0 0 "[ . 1 . 2]" 1
1387 1 99 ALA MB 1 101 LEU H 5.050 . 5.300 4.673 4.545 4.745 . 0 0 "[ . 1 . 2]" 1
1388 1 101 LEU H 1 101 LEU HB2 3.360 . 3.530 2.574 2.524 2.709 . 0 0 "[ . 1 . 2]" 1
1389 1 101 LEU H 1 101 LEU MD1 3.720 . 3.910 3.698 3.652 3.761 . 0 0 "[ . 1 . 2]" 1
1390 1 101 LEU H 1 101 LEU MD2 3.720 . 3.910 3.007 2.782 3.112 . 0 0 "[ . 1 . 2]" 1
1391 1 100 ALA MB 1 101 LEU H 3.030 . 3.180 2.479 2.377 2.685 . 0 0 "[ . 1 . 2]" 1
1392 1 94 GLN H 1 96 ALA H 4.280 . 4.490 4.092 3.977 4.195 . 0 0 "[ . 1 . 2]" 1
1393 1 91 GLN HA 1 94 GLN H 3.700 . 3.890 3.403 3.090 3.799 . 0 0 "[ . 1 . 2]" 1
1394 1 92 GLY QA 1 94 GLN H 4.530 . 4.760 4.138 3.989 4.244 . 0 0 "[ . 1 . 2]" 1
1395 1 94 GLN H 1 95 GLU QG 4.580 . 4.810 4.424 4.084 4.776 . 0 0 "[ . 1 . 2]" 1
1396 1 94 GLN H 1 94 GLN QB 2.890 . 3.030 2.395 2.322 2.467 . 0 0 "[ . 1 . 2]" 1
1397 1 94 GLN H 1 96 ALA MB 5.060 . 5.310 4.759 4.612 4.874 . 0 0 "[ . 1 . 2]" 1
1398 1 94 GLN H 1 97 ALA MB 4.950 . 5.200 4.829 4.651 5.092 . 0 0 "[ . 1 . 2]" 1
1399 1 93 LYS HB3 1 94 GLN H 3.620 . 3.800 3.603 3.489 3.751 . 0 0 "[ . 1 . 2]" 1
1400 1 93 LYS HB2 1 94 GLN H 3.410 . 3.580 2.533 2.405 2.692 . 0 0 "[ . 1 . 2]" 1
1401 1 37 THR HB 1 38 ASN H 4.020 . 4.220 1.913 1.793 2.192 0.007 1 0 "[ . 1 . 2]" 1
1402 1 38 ASN H 1 39 PRO HD3 4.740 . 4.980 3.997 3.720 4.156 . 0 0 "[ . 1 . 2]" 1
1403 1 38 ASN H 1 38 ASN QB 3.640 . 3.820 2.706 2.603 2.826 . 0 0 "[ . 1 . 2]" 1
1404 1 37 THR MG 1 38 ASN H 4.300 . 4.510 2.899 2.726 3.194 . 0 0 "[ . 1 . 2]" 1
1405 1 37 THR H 1 38 ASN H 4.540 . 4.770 2.814 2.587 3.010 . 0 0 "[ . 1 . 2]" 1
1406 1 34 TYR QD 1 38 ASN H 4.480 . 4.700 2.875 2.365 3.348 . 0 0 "[ . 1 . 2]" 1
1407 1 34 TYR HA 1 38 ASN H 3.990 . 4.190 2.335 2.050 2.725 . 0 0 "[ . 1 . 2]" 1
1408 1 38 ASN H 1 39 PRO HD2 4.740 . 4.980 4.381 4.247 4.507 . 0 0 "[ . 1 . 2]" 1
1409 1 81 PHE H 1 100 ALA MB 5.500 . 5.780 5.178 5.019 5.506 . 0 0 "[ . 1 . 2]" 1
1410 1 73 GLN QG 1 81 PHE H 4.430 . 4.650 3.295 3.220 3.378 . 0 0 "[ . 1 . 2]" 1
1411 1 92 GLY H 1 94 GLN H 4.970 . 5.220 4.217 4.039 4.372 . 0 0 "[ . 1 . 2]" 1
1412 1 94 GLN H 1 95 GLU HA 5.500 . 5.780 5.286 5.204 5.364 . 0 0 "[ . 1 . 2]" 1
1413 1 73 GLN QB 1 81 PHE H 5.050 . 5.300 5.348 5.313 5.395 0.095 3 0 "[ . 1 . 2]" 1
1414 1 80 TRP HA 1 81 PHE H 3.460 . 3.630 2.195 2.162 2.224 . 0 0 "[ . 1 . 2]" 1
1415 1 81 PHE H 1 81 PHE QD 3.840 . 4.030 2.924 2.669 3.157 . 0 0 "[ . 1 . 2]" 1
1416 1 75 LYS HA 1 81 PHE H 4.180 . 4.390 3.357 3.115 3.552 . 0 0 "[ . 1 . 2]" 1
1417 1 100 ALA MB 1 102 ARG H 4.720 . 4.960 4.458 4.355 4.664 . 0 0 "[ . 1 . 2]" 1
1418 1 101 LEU H 1 102 ARG H 3.470 . 3.640 2.643 2.545 2.742 . 0 0 "[ . 1 . 2]" 1
1419 1 102 ARG H 1 104 LEU H 4.910 . 5.160 4.265 4.100 4.417 . 0 0 "[ . 1 . 2]" 1
1420 1 98 ASP HA 1 102 ARG H 5.150 . 5.410 4.492 4.243 4.826 . 0 0 "[ . 1 . 2]" 1
1421 1 102 ARG H 1 102 ARG HD2 4.100 . 4.300 3.683 2.792 4.351 0.051 3 0 "[ . 1 . 2]" 1
1422 1 102 ARG H 1 102 ARG HD3 4.100 . 4.300 3.649 1.981 4.516 0.216 13 0 "[ . 1 . 2]" 1
1423 1 102 ARG H 1 102 ARG QB 3.060 . 3.210 2.475 2.238 2.742 . 0 0 "[ . 1 . 2]" 1
1424 1 102 ARG H 1 102 ARG QG 3.420 . 3.590 2.229 1.845 3.473 . 0 0 "[ . 1 . 2]" 1
1425 1 101 LEU HB2 1 102 ARG H 3.860 . 4.050 2.625 2.504 2.790 . 0 0 "[ . 1 . 2]" 1
1426 1 101 LEU MD1 1 102 ARG H 5.350 . 5.620 4.570 4.479 4.702 . 0 0 "[ . 1 . 2]" 1
1427 1 102 ARG H 1 105 ILE MD 4.620 . 4.850 3.957 3.595 4.160 . 0 0 "[ . 1 . 2]" 1
1428 1 101 LEU MD2 1 102 ARG H 5.350 . 5.620 4.547 4.465 4.590 . 0 0 "[ . 1 . 2]" 1
1429 1 73 GLN H 1 74 ALA H 4.480 . 4.700 4.308 4.231 4.366 . 0 0 "[ . 1 . 2]" 1
1430 1 72 TYR QD 1 73 GLN H 3.710 . 3.900 3.359 3.047 3.810 . 0 0 "[ . 1 . 2]" 1
1431 1 72 TYR HA 1 73 GLN H 2.950 . 3.100 2.192 2.154 2.235 . 0 0 "[ . 1 . 2]" 1
1432 1 57 LYS HA 1 73 GLN H 5.230 . 5.490 5.124 4.842 5.279 . 0 0 "[ . 1 . 2]" 1
1433 1 72 TYR HB2 1 73 GLN H 4.250 . 4.460 4.252 4.186 4.357 . 0 0 "[ . 1 . 2]" 1
1434 1 72 TYR HB3 1 73 GLN H 3.560 . 3.740 3.111 2.986 3.308 . 0 0 "[ . 1 . 2]" 1
1435 1 73 GLN H 1 73 GLN QB 3.300 . 3.470 2.581 2.497 2.630 . 0 0 "[ . 1 . 2]" 1
1436 1 73 GLN H 1 96 ALA MB 4.410 . 4.630 4.421 4.148 4.637 0.007 10 0 "[ . 1 . 2]" 1
1437 1 57 LYS HG3 1 73 GLN H 5.260 . 5.520 3.476 2.957 4.361 . 0 0 "[ . 1 . 2]" 1
1438 1 58 LEU HA 1 73 GLN H 4.480 . 4.700 3.892 3.684 4.117 . 0 0 "[ . 1 . 2]" 1
1439 1 49 SER H 1 50 HIS HA 5.200 . 5.460 5.118 5.051 5.211 . 0 0 "[ . 1 . 2]" 1
1440 1 45 GLU HA 1 49 SER H 4.290 . 4.500 3.876 3.646 4.095 . 0 0 "[ . 1 . 2]" 1
1441 1 48 ARG HD3 1 49 SER H 4.780 . 5.020 4.635 4.043 4.840 . 0 0 "[ . 1 . 2]" 1
1442 1 49 SER H 1 50 HIS HB2 4.860 . 5.100 4.602 4.498 4.736 . 0 0 "[ . 1 . 2]" 1
1443 1 48 ARG HG3 1 49 SER H 4.150 . 4.360 2.874 2.547 4.331 . 0 0 "[ . 1 . 2]" 1
1444 1 47 ALA MB 1 49 SER H 4.650 . 4.880 4.412 4.333 4.639 . 0 0 "[ . 1 . 2]" 1
1445 1 48 ARG H 1 49 SER H 2.990 . 3.140 2.657 2.425 2.868 . 0 0 "[ . 1 . 2]" 1
1446 1 49 SER H 1 51 GLY H 3.870 . 4.060 3.944 3.855 4.071 0.011 9 0 "[ . 1 . 2]" 1
1447 1 46 TYR QD 1 49 SER H 5.500 . 5.780 5.635 5.518 5.725 . 0 0 "[ . 1 . 2]" 1
1448 1 49 SER H 1 49 SER HB2 2.870 . 3.010 2.598 2.273 2.759 . 0 0 "[ . 1 . 2]" 1
1449 1 49 SER H 1 49 SER HB3 3.030 . 3.180 2.539 2.320 3.461 0.281 2 0 "[ . 1 . 2]" 1
1450 1 48 ARG HB3 1 49 SER H 3.510 . 3.690 3.687 2.521 3.836 0.146 13 0 "[ . 1 . 2]" 1
1451 1 71 VAL HA 1 84 VAL H 5.500 . 5.780 4.568 4.246 4.856 . 0 0 "[ . 1 . 2]" 1
1452 1 83 ALA HA 1 84 VAL H 3.060 . 3.210 2.164 2.135 2.189 . 0 0 "[ . 1 . 2]" 1
1453 1 73 GLN HA 1 84 VAL H 3.980 . 4.180 3.427 3.224 3.561 . 0 0 "[ . 1 . 2]" 1
1454 1 73 GLN QG 1 84 VAL H 4.720 . 4.960 4.737 4.477 5.000 0.040 16 0 "[ . 1 . 2]" 1
1455 1 84 VAL H 1 84 VAL HB 4.160 . 4.370 3.786 3.739 3.863 . 0 0 "[ . 1 . 2]" 1
1456 1 73 GLN QB 1 84 VAL H 5.040 . 5.290 4.326 4.072 4.555 . 0 0 "[ . 1 . 2]" 1
1457 1 84 VAL H 1 96 ALA MB 4.450 . 4.670 3.763 3.436 4.060 . 0 0 "[ . 1 . 2]" 1
1458 1 83 ALA MB 1 84 VAL H 3.630 . 3.810 3.375 3.051 3.484 . 0 0 "[ . 1 . 2]" 1
1459 1 84 VAL H 1 84 VAL MG1 3.630 . 3.810 2.821 2.643 3.073 . 0 0 "[ . 1 . 2]" 1
1460 1 60 ASP H 1 71 VAL HA 5.340 . 5.610 4.658 4.429 4.928 . 0 0 "[ . 1 . 2]" 1
1461 1 59 VAL MG2 1 60 ASP H 4.460 . 4.680 3.702 3.621 3.775 . 0 0 "[ . 1 . 2]" 1
1462 1 59 VAL H 1 60 ASP H 3.540 . 3.720 2.468 2.282 2.673 . 0 0 "[ . 1 . 2]" 1
1463 1 60 ASP H 1 60 ASP HB3 4.070 . 4.270 2.932 2.672 3.293 . 0 0 "[ . 1 . 2]" 1
1464 1 60 ASP H 1 60 ASP HB2 4.070 . 4.270 3.360 3.194 3.504 . 0 0 "[ . 1 . 2]" 1
1465 1 59 VAL HB 1 60 ASP H 3.610 . 3.790 2.437 2.272 2.597 . 0 0 "[ . 1 . 2]" 1
1466 1 60 ASP H 1 71 VAL MG1 5.010 . 5.260 3.494 3.278 3.728 . 0 0 "[ . 1 . 2]" 1
1467 1 60 ASP H 1 71 VAL H 3.860 . 4.050 3.203 2.866 3.651 . 0 0 "[ . 1 . 2]" 1
1468 1 60 ASP H 1 61 GLN H 4.410 . 4.630 4.331 4.265 4.412 . 0 0 "[ . 1 . 2]" 1
1469 1 60 ASP H 1 72 TYR HA 4.900 . 5.150 4.658 4.542 4.735 . 0 0 "[ . 1 . 2]" 1
1470 1 60 ASP H 1 70 PHE HA 5.340 . 5.610 4.965 4.531 5.452 . 0 0 "[ . 1 . 2]" 1
1471 1 58 LEU HA 1 60 ASP H 4.100 . 4.300 4.016 3.873 4.178 . 0 0 "[ . 1 . 2]" 1
1472 1 60 ASP H 1 71 VAL HB 4.530 . 4.760 2.139 1.912 2.446 . 0 0 "[ . 1 . 2]" 1
1473 1 58 LEU HG 1 60 ASP H 4.380 . 4.600 3.686 2.873 4.627 0.027 1 0 "[ . 1 . 2]" 1
1474 1 94 GLN HE22 1 94 GLN QG 3.550 . 3.730 3.387 3.214 3.490 . 0 0 "[ . 1 . 2]" 1
1475 1 61 GLN HE21 1 70 PHE QE 4.860 . 5.100 3.228 2.667 4.754 . 0 0 "[ . 1 . 2]" 1
1476 1 61 GLN HE22 1 70 PHE QE 4.860 . 5.100 3.217 2.211 4.422 . 0 0 "[ . 1 . 2]" 1
1477 1 61 GLN QB 1 61 GLN HE22 4.240 . 4.450 3.362 3.092 4.046 . 0 0 "[ . 1 . 2]" 1
1478 1 86 ALA H 1 88 SER H 4.780 . 5.020 4.506 4.211 4.813 . 0 0 "[ . 1 . 2]" 1
1479 1 70 PHE H 1 88 SER H 5.020 . 5.270 4.134 3.670 4.558 . 0 0 "[ . 1 . 2]" 1
1480 1 88 SER H 1 88 SER HB2 3.940 . 4.140 3.139 2.708 3.965 . 0 0 "[ . 1 . 2]" 1
1481 1 88 SER H 1 91 GLN QG 4.230 . 4.440 4.150 3.516 4.470 0.030 19 0 "[ . 1 . 2]" 1
1482 1 36 ASN QB 1 37 THR H 4.720 . 4.960 2.712 2.324 3.211 . 0 0 "[ . 1 . 2]" 1
1483 1 37 THR H 1 37 THR MG 4.300 . 4.510 3.827 3.772 3.906 . 0 0 "[ . 1 . 2]" 1
1484 1 69 LYS HA 1 88 SER H 5.460 . 5.730 4.720 3.857 5.259 . 0 0 "[ . 1 . 2]" 1
1485 1 70 PHE QD 1 88 SER H 4.310 . 4.530 3.178 2.741 3.826 . 0 0 "[ . 1 . 2]" 1
1486 1 88 SER H 1 88 SER HB3 3.940 . 4.140 3.394 2.748 3.942 . 0 0 "[ . 1 . 2]" 1
1487 1 88 SER H 1 92 GLY QA 5.190 . 5.450 4.678 4.495 4.943 . 0 0 "[ . 1 . 2]" 1
1488 1 88 SER H 1 91 GLN QB 3.190 . 3.350 2.752 2.282 3.121 . 0 0 "[ . 1 . 2]" 1
1489 1 86 ALA MB 1 88 SER H 2.980 . 3.130 2.449 2.334 2.573 . 0 0 "[ . 1 . 2]" 1
1490 1 73 GLN HE21 1 83 ALA H 5.190 . 5.450 4.187 3.528 4.899 . 0 0 "[ . 1 . 2]" 1
1491 1 73 GLN HE21 1 80 TRP QB 5.000 . 5.250 3.099 2.578 3.973 . 0 0 "[ . 1 . 2]" 1
1492 1 40 VAL HA 1 42 GLY H 4.880 . 5.120 4.292 4.067 4.633 . 0 0 "[ . 1 . 2]" 1
1493 1 42 GLY H 1 101 LEU MD2 4.350 . 4.570 4.381 4.189 4.562 . 0 0 "[ . 1 . 2]" 1
1494 1 42 GLY H 1 44 LEU H 4.800 . 5.040 4.069 3.976 4.200 . 0 0 "[ . 1 . 2]" 1
1495 1 41 GLY H 1 42 GLY H 3.100 . 3.260 2.641 2.585 2.692 . 0 0 "[ . 1 . 2]" 1
1496 1 34 TYR QE 1 42 GLY H 4.280 . 4.490 4.428 4.282 4.527 0.037 12 0 "[ . 1 . 2]" 1
1497 1 34 TYR HA 1 42 GLY H 5.220 . 5.480 5.034 4.835 5.175 . 0 0 "[ . 1 . 2]" 1
1498 1 39 PRO HA 1 42 GLY H 3.700 . 3.890 3.527 3.393 3.710 . 0 0 "[ . 1 . 2]" 1
1499 1 41 GLY QA 1 42 GLY H 3.190 . 3.350 2.755 2.653 2.823 . 0 0 "[ . 1 . 2]" 1
1500 1 34 TYR HB3 1 42 GLY H 3.700 . 3.890 2.992 2.750 3.162 . 0 0 "[ . 1 . 2]" 1
1501 1 42 GLY H 1 42 GLY HA3 2.930 . 3.080 2.299 2.293 2.312 . 0 0 "[ . 1 . 2]" 1
1502 1 42 GLY H 1 97 ALA MB 4.610 . 4.840 4.543 4.306 4.830 . 0 0 "[ . 1 . 2]" 1
1503 1 42 GLY H 1 101 LEU MD1 4.350 . 4.570 3.511 3.276 3.695 . 0 0 "[ . 1 . 2]" 1
1504 1 73 GLN HE22 1 80 TRP QB 4.930 . 5.180 2.901 2.421 3.464 . 0 0 "[ . 1 . 2]" 1
1505 1 42 GLY H 1 43 LEU HB3 5.070 . 5.320 4.948 4.839 5.056 . 0 0 "[ . 1 . 2]" 1
1506 1 28 ILE HB 1 29 GLY H 4.850 . 5.090 2.937 2.504 3.246 . 0 0 "[ . 1 . 2]" 1
1507 1 28 ILE MG 1 29 GLY H 5.020 . 5.270 3.655 3.381 3.962 . 0 0 "[ . 1 . 2]" 1
1508 1 29 GLY H 1 31 LEU MD2 5.500 . 5.780 4.410 4.307 4.607 . 0 0 "[ . 1 . 2]" 1
1509 1 88 SER H 1 92 GLY H 4.140 . 4.350 3.931 3.683 4.217 . 0 0 "[ . 1 . 2]" 1
1510 1 72 TYR QE 1 92 GLY H 5.500 . 5.780 5.038 4.513 5.616 . 0 0 "[ . 1 . 2]" 1
1511 1 89 LYS HA 1 92 GLY H 4.170 . 4.380 3.395 3.235 3.563 . 0 0 "[ . 1 . 2]" 1
1512 1 91 GLN QB 1 92 GLY H 3.370 . 3.540 2.576 2.283 2.779 . 0 0 "[ . 1 . 2]" 1
1513 1 89 LYS QG 1 92 GLY H 4.890 . 5.130 4.885 4.587 5.101 . 0 0 "[ . 1 . 2]" 1
1514 1 91 GLN QG 1 92 GLY H 4.530 . 4.760 4.145 4.009 4.392 . 0 0 "[ . 1 . 2]" 1
1515 1 58 LEU HA 1 59 VAL H 3.440 . 3.610 2.148 2.127 2.175 . 0 0 "[ . 1 . 2]" 1
1516 1 59 VAL H 1 71 VAL H 4.710 . 4.950 4.538 4.248 4.843 . 0 0 "[ . 1 . 2]" 1
1517 1 59 VAL H 1 72 TYR HA 3.950 . 4.150 2.809 2.643 2.958 . 0 0 "[ . 1 . 2]" 1
1518 1 72 TYR QD 1 92 GLY H 4.950 . 5.200 4.567 4.118 4.980 . 0 0 "[ . 1 . 2]" 1
1519 1 90 LYS HA 1 92 GLY H 4.650 . 4.880 4.361 4.115 4.572 . 0 0 "[ . 1 . 2]" 1
1520 1 92 GLY H 1 95 GLU H 5.160 . 5.420 4.702 4.607 4.822 . 0 0 "[ . 1 . 2]" 1
1521 1 91 GLN H 1 92 GLY H 3.840 . 4.030 2.641 2.461 2.910 . 0 0 "[ . 1 . 2]" 1
1522 1 86 ALA MB 1 92 GLY H 3.310 . 3.480 2.650 2.458 2.828 . 0 0 "[ . 1 . 2]" 1
1523 1 50 HIS H 1 51 GLY H 2.810 . 2.950 2.286 2.063 2.411 . 0 0 "[ . 1 . 2]" 1
1524 1 51 GLY H 1 52 PHE QD 4.580 . 4.810 4.129 3.571 4.771 . 0 0 "[ . 1 . 2]" 1
1525 1 51 GLY H 1 52 PHE HA 5.210 . 5.470 4.980 4.726 5.142 . 0 0 "[ . 1 . 2]" 1
1526 1 50 HIS HA 1 51 GLY H 3.500 . 3.680 3.340 3.236 3.492 . 0 0 "[ . 1 . 2]" 1
1527 1 48 ARG HA 1 51 GLY H 3.580 . 3.760 3.689 3.453 3.828 0.068 18 0 "[ . 1 . 2]" 1
1528 1 51 GLY H 1 51 GLY HA3 2.950 . 3.100 2.929 2.882 2.953 . 0 0 "[ . 1 . 2]" 1
1529 1 51 GLY H 1 51 GLY HA2 2.700 . 2.840 2.375 2.318 2.438 . 0 0 "[ . 1 . 2]" 1
1530 1 50 HIS HB2 1 51 GLY H 3.810 . 4.000 3.440 2.953 3.699 . 0 0 "[ . 1 . 2]" 1
1531 1 51 GLY H 1 52 PHE HB2 4.700 . 4.940 4.559 4.161 4.814 . 0 0 "[ . 1 . 2]" 1
1532 1 50 HIS HB3 1 51 GLY H 4.150 . 4.360 4.093 3.709 4.245 . 0 0 "[ . 1 . 2]" 1
1533 1 47 ALA MB 1 51 GLY H 4.630 . 4.860 4.720 4.406 4.884 0.024 15 0 "[ . 1 . 2]" 1
1534 1 105 ILE H 1 106 GLY H 3.220 . 3.380 2.782 2.679 2.884 . 0 0 "[ . 1 . 2]" 1
1535 1 106 GLY H 1 107 GLU H 3.210 . 3.370 2.692 2.596 2.811 . 0 0 "[ . 1 . 2]" 1
1536 1 106 GLY H 1 107 GLU HA 5.480 . 5.750 5.291 5.197 5.382 . 0 0 "[ . 1 . 2]" 1
1537 1 106 GLY H 1 106 GLY HA3 2.640 . 2.770 2.294 2.289 2.301 . 0 0 "[ . 1 . 2]" 1
1538 1 102 ARG HA 1 106 GLY H 3.710 . 3.900 3.654 3.382 3.854 . 0 0 "[ . 1 . 2]" 1
1539 1 106 GLY H 1 109 GLU QB 5.230 . 5.490 4.714 4.184 5.249 . 0 0 "[ . 1 . 2]" 1
1540 1 105 ILE HB 1 106 GLY H 3.060 . 3.210 2.476 2.334 2.631 . 0 0 "[ . 1 . 2]" 1
1541 1 105 ILE HG13 1 106 GLY H 4.490 . 4.710 4.254 4.172 4.320 . 0 0 "[ . 1 . 2]" 1
1542 1 28 ILE MG 1 106 GLY H 5.080 . 5.330 4.837 4.711 4.989 . 0 0 "[ . 1 . 2]" 1
1543 1 105 ILE MD 1 106 GLY H 4.590 . 4.820 4.413 4.284 4.529 . 0 0 "[ . 1 . 2]" 1
1544 1 57 LYS H 1 58 LEU H 4.710 . 4.950 4.450 4.323 4.495 . 0 0 "[ . 1 . 2]" 1
1545 1 58 LEU H 1 59 VAL H 4.850 . 5.090 4.368 4.198 4.502 . 0 0 "[ . 1 . 2]" 1
1546 1 57 LYS HA 1 58 LEU H 3.040 . 3.190 2.220 2.146 2.297 . 0 0 "[ . 1 . 2]" 1
1547 1 58 LEU H 1 58 LEU HB2 3.510 . 3.690 2.567 2.405 2.783 . 0 0 "[ . 1 . 2]" 1
1548 1 58 LEU H 1 58 LEU HB3 3.510 . 3.690 2.545 2.413 2.832 . 0 0 "[ . 1 . 2]" 1
1549 1 58 LEU H 1 72 TYR QE 4.780 . 5.020 3.861 3.371 4.444 . 0 0 "[ . 1 . 2]" 1
1550 1 57 LYS HB3 1 58 LEU H 4.220 . 4.430 3.931 3.823 4.077 . 0 0 "[ . 1 . 2]" 1
1551 1 57 LYS HG3 1 58 LEU H 4.820 . 5.060 4.105 3.809 4.612 . 0 0 "[ . 1 . 2]" 1
1552 1 58 LEU H 1 58 LEU MD1 4.620 . 4.850 4.220 4.114 4.312 . 0 0 "[ . 1 . 2]" 1
1553 1 58 LEU H 1 58 LEU MD2 4.620 . 4.850 4.236 4.171 4.337 . 0 0 "[ . 1 . 2]" 1
1554 1 34 TYR QE 1 41 GLY H 5.240 . 5.500 5.526 5.398 5.596 0.096 18 0 "[ . 1 . 2]" 1
1555 1 39 PRO HA 1 41 GLY H 4.440 . 4.660 4.623 4.452 4.688 0.028 14 0 "[ . 1 . 2]" 1
1556 1 40 VAL H 1 41 GLY H 3.050 . 3.200 2.723 2.644 2.801 . 0 0 "[ . 1 . 2]" 1
1557 1 38 ASN HA 1 41 GLY H 4.780 . 5.020 4.530 4.368 4.735 . 0 0 "[ . 1 . 2]" 1
1558 1 41 GLY H 1 41 GLY QA 2.590 . 2.720 2.198 2.192 2.202 . 0 0 "[ . 1 . 2]" 1
1559 1 38 ASN QB 1 41 GLY H 3.980 . 4.180 3.337 3.103 3.593 . 0 0 "[ . 1 . 2]" 1
1560 1 41 GLY H 1 42 GLY HA3 4.890 . 5.130 4.934 4.883 4.994 . 0 0 "[ . 1 . 2]" 1
1561 1 41 GLY H 1 42 GLY HA2 5.340 . 5.610 5.254 5.207 5.296 . 0 0 "[ . 1 . 2]" 1
1562 1 39 PRO HB2 1 41 GLY H 5.220 . 5.480 5.429 5.303 5.497 0.017 12 0 "[ . 1 . 2]" 1
1563 1 40 VAL HB 1 41 GLY H 2.890 . 3.030 2.465 2.401 2.619 . 0 0 "[ . 1 . 2]" 1
1564 1 41 GLY H 1 97 ALA MB 4.420 . 4.640 4.572 4.514 4.645 0.005 1 0 "[ . 1 . 2]" 1
1565 1 40 VAL MG2 1 41 GLY H 3.830 . 4.020 3.698 3.647 3.765 . 0 0 "[ . 1 . 2]" 1
1566 1 40 VAL MG1 1 41 GLY H 3.830 . 4.020 3.436 3.373 3.579 . 0 0 "[ . 1 . 2]" 1
1567 1 41 GLY H 1 44 LEU H 4.930 . 5.180 4.871 4.807 4.967 . 0 0 "[ . 1 . 2]" 1
1568 1 74 ALA H 1 100 ALA MB 5.490 . 5.760 4.817 4.635 5.132 . 0 0 "[ . 1 . 2]" 1
1569 1 73 GLN HE21 1 74 ALA H 5.480 . 5.750 4.954 4.662 5.215 . 0 0 "[ . 1 . 2]" 1
1570 1 74 ALA H 1 75 LYS H 4.410 . 4.630 4.375 4.283 4.526 . 0 0 "[ . 1 . 2]" 1
1571 1 56 PHE QD 1 74 ALA H 5.400 . 5.670 5.009 4.585 5.377 . 0 0 "[ . 1 . 2]" 1
1572 1 73 GLN HA 1 74 ALA H 3.190 . 3.350 2.168 2.141 2.199 . 0 0 "[ . 1 . 2]" 1
1573 1 74 ALA H 1 80 TRP QB 4.960 . 5.210 5.199 5.102 5.244 0.034 12 0 "[ . 1 . 2]" 1
1574 1 73 GLN QG 1 74 ALA H 4.080 . 4.280 2.651 2.507 2.852 . 0 0 "[ . 1 . 2]" 1
1575 1 73 GLN QB 1 74 ALA H 3.840 . 4.030 3.666 3.611 3.740 . 0 0 "[ . 1 . 2]" 1
1576 1 74 ALA H 1 96 ALA MB 3.700 . 3.890 3.133 2.972 3.350 . 0 0 "[ . 1 . 2]" 1
1577 1 74 ALA H 1 83 ALA MB 5.380 . 5.650 4.982 4.633 5.396 . 0 0 "[ . 1 . 2]" 1
1578 1 74 ALA H 1 74 ALA MB 3.300 . 3.470 2.307 2.284 2.331 . 0 0 "[ . 1 . 2]" 1
1579 1 34 TYR QD 1 42 GLY H 3.500 . 3.680 3.321 3.008 3.639 . 0 0 "[ . 1 . 2]" 1
1580 1 34 TYR H 1 34 TYR QD 2.980 . 3.130 2.901 2.630 3.140 0.010 14 0 "[ . 1 . 2]" 1
1581 1 34 TYR HA 1 34 TYR QD 2.790 . 2.930 2.482 2.195 2.749 . 0 0 "[ . 1 . 2]" 1
1582 1 34 TYR QD 1 38 ASN QB 3.240 . 3.400 3.120 2.728 3.414 0.014 8 0 "[ . 1 . 2]" 1
1583 1 31 LEU HB2 1 34 TYR QD 4.840 . 5.080 4.912 4.695 5.012 . 0 0 "[ . 1 . 2]" 1
1584 1 33 ARG HG2 1 34 TYR QD 3.770 . 3.960 3.281 2.889 3.902 . 0 0 "[ . 1 . 2]" 1
1585 1 34 TYR QD 1 101 LEU MD2 4.860 . 5.100 4.380 4.066 4.947 . 0 0 "[ . 1 . 2]" 1
1586 1 33 ARG H 1 34 TYR QD 4.350 . 4.570 4.410 4.062 4.623 0.053 18 0 "[ . 1 . 2]" 1
1587 1 34 TYR QD 1 37 THR MG 4.460 . 4.680 4.081 3.680 4.644 . 0 0 "[ . 1 . 2]" 1
1588 1 50 HIS HB2 1 52 PHE QE 4.310 . 4.530 3.280 3.052 3.471 . 0 0 "[ . 1 . 2]" 1
1589 1 52 PHE H 1 52 PHE QE 4.830 . 5.070 4.619 4.416 4.864 . 0 0 "[ . 1 . 2]" 1
1590 1 47 ALA MB 1 52 PHE QE 5.500 . 5.780 5.651 5.442 5.735 . 0 0 "[ . 1 . 2]" 1
1591 1 50 HIS HB3 1 52 PHE QE 3.910 . 4.110 2.364 2.204 2.664 . 0 0 "[ . 1 . 2]" 1
1592 1 58 LEU HB3 1 72 TYR QD 5.500 . 5.780 5.468 5.301 5.649 . 0 0 "[ . 1 . 2]" 1
1593 1 72 TYR QD 1 93 LYS HB3 5.500 . 5.780 5.262 4.802 5.800 0.020 17 0 "[ . 1 . 2]" 1
1594 1 52 PHE QE 1 76 VAL MG1 4.500 . 4.730 4.191 3.877 4.555 . 0 0 "[ . 1 . 2]" 1
1595 1 61 GLN QB 1 70 PHE QE 4.270 . 4.480 3.471 2.725 4.035 . 0 0 "[ . 1 . 2]" 1
1596 1 61 GLN QG 1 70 PHE QE 4.620 . 4.850 3.569 2.663 4.265 . 0 0 "[ . 1 . 2]" 1
1597 1 58 LEU MD2 1 70 PHE QE 5.280 . 5.540 4.019 3.008 5.020 . 0 0 "[ . 1 . 2]" 1
1598 1 52 PHE QD 1 53 ALA H 3.600 . 3.780 3.598 3.388 3.800 0.020 2 0 "[ . 1 . 2]" 1
1599 1 56 PHE HZ 1 97 ALA MB 3.250 . 3.410 2.136 1.959 2.434 . 0 0 "[ . 1 . 2]" 1
1600 1 76 VAL MG1 1 81 PHE HZ 4.730 . 4.970 3.727 3.247 4.243 . 0 0 "[ . 1 . 2]" 1
1601 1 81 PHE HZ 1 104 LEU MD2 4.480 . 4.700 2.001 1.788 2.306 0.012 9 0 "[ . 1 . 2]" 1
1602 1 57 LYS QD 1 80 TRP HH2 4.380 . 4.600 3.411 2.125 4.179 . 0 0 "[ . 1 . 2]" 1
1603 1 57 LYS HB3 1 80 TRP HH2 5.500 . 5.780 5.550 4.588 5.827 0.047 1 0 "[ . 1 . 2]" 1
1604 1 50 HIS H 1 50 HIS HD2 4.140 . 4.350 2.861 2.680 3.087 . 0 0 "[ . 1 . 2]" 1
1605 1 50 HIS HA 1 50 HIS HD2 3.590 . 3.770 2.969 2.725 3.219 . 0 0 "[ . 1 . 2]" 1
1606 1 49 SER HA 1 50 HIS HD2 4.140 . 4.350 4.258 4.040 4.420 0.070 15 0 "[ . 1 . 2]" 1
1607 1 46 TYR QD 1 50 HIS HD2 4.420 . 4.640 4.447 3.854 4.672 0.032 6 0 "[ . 1 . 2]" 1
1608 1 50 HIS HB2 1 50 HIS HD2 3.410 . 3.580 3.351 3.242 3.468 . 0 0 "[ . 1 . 2]" 1
1609 1 86 ALA MB 1 87 HIS HD2 4.110 . 4.320 3.900 3.312 4.378 0.058 16 0 "[ . 1 . 2]" 1
1610 1 87 HIS HD2 1 91 GLN QB 4.400 . 4.620 4.355 3.779 4.739 0.119 17 0 "[ . 1 . 2]" 1
1611 1 57 LYS HB3 1 80 TRP HZ3 4.330 . 4.550 4.376 3.388 4.686 0.136 11 0 "[ . 1 . 2]" 1
1612 1 75 LYS HB2 1 80 TRP HE3 5.030 . 5.280 2.914 2.688 3.192 . 0 0 "[ . 1 . 2]" 1
1613 1 66 HIS HB3 1 66 HIS HD2 3.910 . 4.110 3.847 3.785 3.887 . 0 0 "[ . 1 . 2]" 1
1614 1 66 HIS HD2 1 67 GLU HB2 3.720 . 3.910 3.279 2.489 3.725 . 0 0 "[ . 1 . 2]" 1
1615 1 66 HIS HB2 1 66 HIS HD2 3.220 . 3.380 2.735 2.688 2.780 . 0 0 "[ . 1 . 2]" 1
1616 1 72 TYR QE 1 93 LYS HG3 5.130 . 5.390 3.658 3.393 3.905 . 0 0 "[ . 1 . 2]" 1
1617 1 72 TYR QE 1 89 LYS HA 3.330 . 3.500 2.833 2.446 3.117 . 0 0 "[ . 1 . 2]" 1
1618 1 34 TYR QE 1 45 GLU HG2 4.390 . 4.610 3.035 2.083 4.224 . 0 0 "[ . 1 . 2]" 1
1619 1 33 ARG HG2 1 34 TYR QE 4.420 . 4.640 3.866 3.527 4.411 . 0 0 "[ . 1 . 2]" 1
1620 1 46 TYR HA 1 46 TYR QE 5.170 . 5.430 4.906 4.854 4.968 . 0 0 "[ . 1 . 2]" 1
1621 1 34 TYR QE 1 41 GLY QA 4.350 . 4.570 3.900 3.491 4.253 . 0 0 "[ . 1 . 2]" 1
1622 1 46 TYR QE 1 76 VAL HB 4.220 . 4.430 4.038 3.450 4.375 . 0 0 "[ . 1 . 2]" 1
1623 1 46 TYR QE 1 76 VAL MG1 2.810 . 2.950 1.868 1.737 2.079 0.063 19 0 "[ . 1 . 2]" 1
1624 1 66 HIS HB3 1 66 HIS HE1 4.850 . 5.090 4.740 4.719 4.780 . 0 0 "[ . 1 . 2]" 1
1625 1 64 PRO HB2 1 66 HIS HE1 3.220 . 3.380 2.683 2.508 2.829 . 0 0 "[ . 1 . 2]" 1
1626 1 64 PRO HB3 1 66 HIS HE1 2.950 . 3.100 3.049 2.789 3.142 0.042 19 0 "[ . 1 . 2]" 1
1627 1 64 PRO HG3 1 66 HIS HE1 3.630 . 3.810 3.468 3.002 3.822 0.012 1 0 "[ . 1 . 2]" 1
1628 1 46 TYR QD 1 50 HIS HE1 3.330 . 3.500 3.548 3.511 3.582 0.082 19 0 "[ . 1 . 2]" 1
1629 1 28 ILE MD 1 50 HIS HE1 3.850 . 4.040 3.925 2.771 4.133 0.093 10 0 "[ . 1 . 2]" 1
1630 1 46 TYR QE 1 50 HIS HE1 3.090 . 3.240 2.755 2.450 3.040 . 0 0 "[ . 1 . 2]" 1
1631 1 75 LYS QD 1 80 TRP HZ2 4.570 . 4.800 3.328 3.081 3.737 . 0 0 "[ . 1 . 2]" 1
1632 1 75 LYS HG2 1 80 TRP HZ2 5.500 . 5.780 5.358 4.922 5.713 . 0 0 "[ . 1 . 2]" 1
1633 1 75 LYS HE3 1 80 TRP HZ2 3.810 . 4.000 3.126 2.300 3.967 . 0 0 "[ . 1 . 2]" 1
1634 1 75 LYS HE2 1 80 TRP HZ2 3.810 . 4.000 3.474 2.578 4.086 0.086 8 0 "[ . 1 . 2]" 1
1635 1 57 LYS QD 1 80 TRP HZ2 5.440 . 5.710 5.359 4.413 5.761 0.051 12 0 "[ . 1 . 2]" 1
1636 1 30 GLU QB 1 34 TYR QD 4.000 . 4.200 3.643 3.383 3.898 . 0 0 "[ . 1 . 2]" 1
1637 1 50 HIS HB2 1 52 PHE QD 3.370 . 3.540 2.102 1.949 2.298 . 0 0 "[ . 1 . 2]" 1
1638 1 75 LYS HE2 1 80 TRP HH2 4.580 . 4.810 4.304 3.719 4.846 0.036 18 0 "[ . 1 . 2]" 1
1639 1 34 TYR QE 1 42 GLY HA2 4.010 . 4.210 3.340 3.073 3.529 . 0 0 "[ . 1 . 2]" 1
1640 1 30 GLU QB 1 34 TYR QE 3.790 . 3.980 2.739 2.301 3.134 . 0 0 "[ . 1 . 2]" 1
1641 1 34 TYR QE 1 46 TYR H 5.500 . 5.780 5.614 5.259 5.813 0.033 19 0 "[ . 1 . 2]" 1
1642 1 75 LYS HB3 1 80 TRP HZ3 4.560 . 4.790 4.231 3.889 4.572 . 0 0 "[ . 1 . 2]" 1
1643 1 75 LYS HB2 1 80 TRP HZ3 4.960 . 5.210 2.890 2.500 3.114 . 0 0 "[ . 1 . 2]" 1
1644 1 75 LYS QD 1 80 TRP HZ3 5.190 . 5.450 3.119 2.923 3.472 . 0 0 "[ . 1 . 2]" 1
1645 1 80 TRP QB 1 80 TRP HE3 3.700 . 3.890 2.469 2.414 2.581 . 0 0 "[ . 1 . 2]" 1
1646 1 81 PHE QD 1 100 ALA MB 4.450 . 4.670 3.691 3.351 4.140 . 0 0 "[ . 1 . 2]" 1
1647 1 50 HIS HB3 1 52 PHE QD 3.340 . 3.510 2.632 2.460 3.045 . 0 0 "[ . 1 . 2]" 1
1648 1 76 VAL HB 1 81 PHE QD 4.210 . 4.420 4.090 3.635 4.439 0.019 6 0 "[ . 1 . 2]" 1
1649 1 50 HIS HB3 1 52 PHE HZ 4.510 . 4.740 4.603 3.941 4.757 0.017 7 0 "[ . 1 . 2]" 1
1650 1 70 PHE HA 1 70 PHE QE 4.770 . 5.010 4.668 4.583 4.746 . 0 0 "[ . 1 . 2]" 1
1651 1 50 HIS HB3 1 50 HIS HD2 3.950 . 4.150 3.926 3.881 3.966 . 0 0 "[ . 1 . 2]" 1
1652 1 76 VAL HB 1 81 PHE HZ 4.260 . 4.470 3.729 3.035 4.306 . 0 0 "[ . 1 . 2]" 1
1653 1 56 PHE QE 1 93 LYS HA 3.590 . 3.770 3.737 3.173 3.822 0.052 7 0 "[ . 1 . 2]" 1
1654 1 87 HIS HA 1 87 HIS HD2 4.350 . 4.570 4.207 3.732 4.586 0.016 8 0 "[ . 1 . 2]" 1
1655 1 79 ARG HA 1 80 TRP HD1 4.200 . 4.410 3.333 3.091 3.815 . 0 0 "[ . 1 . 2]" 1
1656 1 80 TRP H 1 80 TRP HD1 3.960 . 4.160 2.550 2.310 2.788 . 0 0 "[ . 1 . 2]" 1
1657 1 46 TYR HA 1 46 TYR QD 3.250 . 3.410 2.996 2.908 3.067 . 0 0 "[ . 1 . 2]" 1
1658 1 31 LEU HA 1 34 TYR QD 2.740 . 2.880 1.978 1.818 2.090 . 0 0 "[ . 1 . 2]" 1
1659 1 34 TYR QD 1 42 GLY HA2 3.690 . 3.870 3.202 3.069 3.346 . 0 0 "[ . 1 . 2]" 1
1660 1 81 PHE HA 1 81 PHE QD 4.070 . 4.270 3.734 3.720 3.748 . 0 0 "[ . 1 . 2]" 1
1661 1 81 PHE QD 1 100 ALA HA 3.930 . 4.130 3.040 2.586 3.658 . 0 0 "[ . 1 . 2]" 1
1662 1 76 VAL MG2 1 81 PHE QD 4.590 . 4.820 4.238 3.861 4.663 . 0 0 "[ . 1 . 2]" 1
1663 1 47 ALA HA 1 52 PHE QD 3.590 . 3.770 2.786 2.479 2.883 . 0 0 "[ . 1 . 2]" 1
1664 1 40 VAL MG2 1 56 PHE HZ 4.040 . 4.240 3.926 3.523 4.114 . 0 0 "[ . 1 . 2]" 1
1665 1 81 PHE HZ 1 100 ALA HA 5.500 . 5.780 5.458 5.151 5.747 . 0 0 "[ . 1 . 2]" 1
1666 1 56 PHE HZ 1 97 ALA HA 4.210 . 4.420 3.428 3.037 3.858 . 0 0 "[ . 1 . 2]" 1
1667 1 46 TYR QE 1 81 PHE HZ 5.160 . 5.420 3.880 3.398 4.278 . 0 0 "[ . 1 . 2]" 1
1668 1 43 LEU H 1 56 PHE HZ 5.270 . 5.530 4.694 4.316 5.151 . 0 0 "[ . 1 . 2]" 1
1669 1 56 PHE HZ 1 97 ALA H 4.700 . 4.940 4.286 4.043 4.693 . 0 0 "[ . 1 . 2]" 1
1670 1 80 TRP H 1 80 TRP HE1 4.800 . 5.040 4.854 4.613 5.075 0.035 12 0 "[ . 1 . 2]" 1
1671 1 80 TRP QB 1 80 TRP HE1 4.500 . 4.730 4.457 4.430 4.478 . 0 0 "[ . 1 . 2]" 1
1672 1 25 VAL QG 1 27 LYS HA 4.120 . 4.330 3.695 2.902 4.409 0.079 9 0 "[ . 1 . 2]" 1
1673 1 25 VAL QG 1 27 LYS QB 3.850 . 4.040 3.055 1.927 4.080 0.040 11 0 "[ . 1 . 2]" 1
1674 1 25 VAL QG 1 27 LYS QD 3.750 . 3.940 3.243 2.375 3.942 0.002 12 0 "[ . 1 . 2]" 1
1675 1 25 VAL QG 1 28 ILE H 5.440 . 5.710 5.075 3.230 5.551 . 0 0 "[ . 1 . 2]" 1
1676 1 27 LYS HA 1 27 LYS QG 3.120 . 3.280 2.572 2.274 2.986 . 0 0 "[ . 1 . 2]" 1
1677 1 27 LYS HA 1 28 ILE QG 5.030 . 5.280 4.053 3.531 4.883 . 0 0 "[ . 1 . 2]" 1
1678 1 27 LYS HA 1 30 GLU QG 5.190 . 5.450 4.367 3.127 5.435 . 0 0 "[ . 1 . 2]" 1
1679 1 27 LYS QB 1 27 LYS QG 2.340 . 2.460 2.046 1.989 2.087 . 0 0 "[ . 1 . 2]" 1
1680 1 27 LYS QB 1 27 LYS QD 2.620 . 2.750 2.257 2.109 2.513 . 0 0 "[ . 1 . 2]" 1
1681 1 27 LYS QB 1 28 ILE HA 5.310 . 5.580 4.523 4.121 4.909 . 0 0 "[ . 1 . 2]" 1
1682 1 27 LYS QB 1 30 GLU QG 4.080 . 4.280 2.881 1.914 4.331 0.051 6 0 "[ . 1 . 2]" 1
1683 1 27 LYS QD 1 27 LYS QG 2.350 . 2.470 2.065 1.994 2.092 . 0 0 "[ . 1 . 2]" 1
1684 1 27 LYS QG 1 30 GLU QG 5.180 . 5.440 3.115 1.924 4.991 . 0 0 "[ . 1 . 2]" 1
1685 1 28 ILE H 1 28 ILE QG 4.340 . 4.560 2.246 1.943 2.917 . 0 0 "[ . 1 . 2]" 1
1686 1 28 ILE HA 1 28 ILE QG 3.250 . 3.410 2.921 2.851 2.990 . 0 0 "[ . 1 . 2]" 1
1687 1 28 ILE HA 1 32 VAL QG 4.920 . 5.170 4.441 4.150 4.787 . 0 0 "[ . 1 . 2]" 1
1688 1 28 ILE QG 1 28 ILE MG 2.730 . 2.870 2.275 2.248 2.297 . 0 0 "[ . 1 . 2]" 1
1689 1 28 ILE MG 1 29 GLY QA 4.160 . 4.370 3.541 3.323 3.832 . 0 0 "[ . 1 . 2]" 1
1690 1 28 ILE MG 1 104 LEU QD 5.440 . 5.710 4.959 4.147 5.308 . 0 0 "[ . 1 . 2]" 1
1691 1 28 ILE QG 1 105 ILE HA 4.480 . 4.700 3.675 3.111 4.006 . 0 0 "[ . 1 . 2]" 1
1692 1 28 ILE QG 1 108 ASN HB2 4.370 . 4.590 2.990 2.392 3.678 . 0 0 "[ . 1 . 2]" 1
1693 1 28 ILE QG 1 108 ASN HB3 4.120 . 4.330 2.264 1.786 2.982 0.014 16 0 "[ . 1 . 2]" 1
1694 1 28 ILE MD 1 108 ASN QD 4.750 . 4.990 3.527 2.906 4.182 . 0 0 "[ . 1 . 2]" 1
1695 1 29 GLY QA 1 30 GLU QG 4.800 . 5.040 4.172 3.906 5.034 . 0 0 "[ . 1 . 2]" 1
1696 1 29 GLY QA 1 31 LEU H 4.620 . 4.850 4.002 3.839 4.192 . 0 0 "[ . 1 . 2]" 1
1697 1 29 GLY QA 1 32 VAL HB 5.030 . 5.280 2.863 2.541 3.205 . 0 0 "[ . 1 . 2]" 1
1698 1 29 GLY QA 1 32 VAL QG 4.080 . 4.280 2.410 2.016 2.794 . 0 0 "[ . 1 . 2]" 1
1699 1 29 GLY QA 1 33 ARG H 5.100 . 5.360 4.239 3.940 4.515 . 0 0 "[ . 1 . 2]" 1
1700 1 30 GLU H 1 30 GLU QG 4.040 . 4.240 2.400 2.037 3.381 . 0 0 "[ . 1 . 2]" 1
1701 1 30 GLU HA 1 30 GLU QG 3.070 . 3.220 2.705 2.265 3.157 . 0 0 "[ . 1 . 2]" 1
1702 1 30 GLU HA 1 32 VAL QG 5.410 . 5.680 4.908 4.666 5.117 . 0 0 "[ . 1 . 2]" 1
1703 1 30 GLU QG 1 31 LEU H 4.740 . 4.980 4.118 3.828 4.558 . 0 0 "[ . 1 . 2]" 1
1704 1 30 GLU QG 1 31 LEU MD2 4.610 . 4.840 4.134 3.633 4.825 . 0 0 "[ . 1 . 2]" 1
1705 1 30 GLU QG 1 33 ARG QB 5.340 . 5.610 4.883 3.518 5.716 0.106 13 0 "[ . 1 . 2]" 1
1706 1 30 GLU QG 1 33 ARG HG2 5.340 . 5.610 4.986 4.049 5.660 0.050 18 0 "[ . 1 . 2]" 1
1707 1 31 LEU H 1 32 VAL QG 4.390 . 4.610 3.799 3.677 3.926 . 0 0 "[ . 1 . 2]" 1
1708 1 31 LEU HA 1 101 LEU QD 4.180 . 4.390 2.968 2.740 3.266 . 0 0 "[ . 1 . 2]" 1
1709 1 31 LEU HB2 1 32 VAL QG 3.620 . 3.800 3.370 3.295 3.488 . 0 0 "[ . 1 . 2]" 1
1710 1 31 LEU HB3 1 32 VAL QG 4.310 . 4.530 4.161 3.931 4.300 . 0 0 "[ . 1 . 2]" 1
1711 1 31 LEU HB3 1 101 LEU QD 4.440 . 4.660 2.538 2.276 3.203 . 0 0 "[ . 1 . 2]" 1
1712 1 31 LEU HG 1 104 LEU QB 4.110 . 4.320 3.216 2.957 3.531 . 0 0 "[ . 1 . 2]" 1
1713 1 31 LEU HG 1 104 LEU QD 3.810 . 4.000 2.990 2.488 3.592 . 0 0 "[ . 1 . 2]" 1
1714 1 31 LEU MD1 1 45 GLU QG 4.050 . 4.250 3.511 3.106 3.974 . 0 0 "[ . 1 . 2]" 1
1715 1 31 LEU MD1 1 101 LEU QD 2.960 . 3.110 1.742 1.723 1.763 0.077 6 0 "[ . 1 . 2]" 1
1716 1 31 LEU MD1 1 104 LEU QB 4.720 . 4.960 4.147 3.728 4.349 . 0 0 "[ . 1 . 2]" 1
1717 1 31 LEU MD1 1 104 LEU QD 2.950 . 3.100 3.069 2.733 3.152 0.052 4 0 "[ . 1 . 2]" 1
1718 1 32 VAL H 1 32 VAL QG 2.720 . 2.860 2.027 1.889 2.242 . 0 0 "[ . 1 . 2]" 1
1719 1 32 VAL H 1 35 LEU QD 5.130 . 5.390 4.376 4.159 4.625 . 0 0 "[ . 1 . 2]" 1
1720 1 32 VAL HA 1 32 VAL QG 2.610 . 2.740 2.139 2.132 2.145 . 0 0 "[ . 1 . 2]" 1
1721 1 32 VAL HA 1 35 LEU QD 3.570 . 3.750 2.174 1.904 2.496 . 0 0 "[ . 1 . 2]" 1
1722 1 32 VAL QG 1 33 ARG H 3.170 . 3.330 3.269 3.214 3.354 0.024 1 0 "[ . 1 . 2]" 1
1723 1 32 VAL QG 1 33 ARG HA 5.400 . 5.670 3.510 3.380 3.741 . 0 0 "[ . 1 . 2]" 1
1724 1 32 VAL QG 1 33 ARG QB 4.220 . 4.430 4.151 4.030 4.286 . 0 0 "[ . 1 . 2]" 1
1725 1 32 VAL QG 1 35 LEU H 5.290 . 5.550 4.108 4.003 4.198 . 0 0 "[ . 1 . 2]" 1
1726 1 32 VAL QG 1 35 LEU HG 4.700 . 4.940 3.816 3.509 4.259 . 0 0 "[ . 1 . 2]" 1
1727 1 32 VAL QG 1 35 LEU QD 3.200 . 3.360 2.442 2.076 2.912 . 0 0 "[ . 1 . 2]" 1
1728 1 32 VAL QG 1 105 ILE MG 2.570 . 2.700 2.519 2.290 2.715 0.015 7 0 "[ . 1 . 2]" 1
1729 1 32 VAL QG 1 105 ILE HG13 3.980 . 4.180 3.975 3.879 4.077 . 0 0 "[ . 1 . 2]" 1
1730 1 32 VAL QG 1 105 ILE MD 2.670 . 2.800 1.803 1.749 1.858 0.051 8 0 "[ . 1 . 2]" 1
1731 1 33 ARG H 1 35 LEU QD 5.440 . 5.710 5.020 4.782 5.319 . 0 0 "[ . 1 . 2]" 1
1732 1 34 TYR HB2 1 101 LEU QD 3.190 . 3.350 2.370 2.268 2.543 . 0 0 "[ . 1 . 2]" 1
1733 1 34 TYR HB3 1 101 LEU QD 3.860 . 4.050 2.675 2.579 2.800 . 0 0 "[ . 1 . 2]" 1
1734 1 34 TYR QD 1 45 GLU QG 5.010 . 5.260 4.172 3.750 4.652 . 0 0 "[ . 1 . 2]" 1
1735 1 34 TYR QD 1 101 LEU QD 3.710 . 3.900 3.469 3.343 3.727 . 0 0 "[ . 1 . 2]" 1
1736 1 34 TYR QE 1 45 GLU QB 4.360 . 4.580 3.965 3.266 4.787 0.207 18 0 "[ . 1 . 2]" 1
1737 1 34 TYR QE 1 45 GLU QG 3.590 . 3.770 2.863 2.072 3.418 . 0 0 "[ . 1 . 2]" 1
1738 1 34 TYR QE 1 101 LEU QD 4.960 . 5.210 4.857 4.746 5.079 . 0 0 "[ . 1 . 2]" 1
1739 1 35 LEU H 1 101 LEU QD 4.000 . 4.200 3.268 3.050 3.429 . 0 0 "[ . 1 . 2]" 1
1740 1 35 LEU HA 1 35 LEU QD 3.150 . 3.310 1.987 1.909 2.060 . 0 0 "[ . 1 . 2]" 1
1741 1 35 LEU HA 1 101 LEU QD 3.230 . 3.390 3.199 2.922 3.396 0.006 16 0 "[ . 1 . 2]" 1
1742 1 35 LEU QD 1 36 ASN H 4.980 . 5.230 4.152 4.054 4.254 . 0 0 "[ . 1 . 2]" 1
1743 1 35 LEU QD 1 36 ASN QB 5.440 . 5.710 5.110 4.800 5.510 . 0 0 "[ . 1 . 2]" 1
1744 1 35 LEU QD 1 39 PRO HB2 4.250 . 4.460 4.025 3.694 4.330 . 0 0 "[ . 1 . 2]" 1
1745 1 35 LEU QD 1 98 ASP HA 3.480 . 3.650 2.470 2.095 2.675 . 0 0 "[ . 1 . 2]" 1
1746 1 35 LEU QD 1 98 ASP HB2 4.760 . 5.000 3.810 3.512 4.182 . 0 0 "[ . 1 . 2]" 1
1747 1 35 LEU QD 1 98 ASP HB3 5.420 . 5.690 4.293 4.001 4.535 . 0 0 "[ . 1 . 2]" 1
1748 1 35 LEU QD 1 101 LEU H 3.990 . 4.190 3.703 3.522 3.877 . 0 0 "[ . 1 . 2]" 1
1749 1 35 LEU QD 1 101 LEU HB2 3.420 . 3.590 1.798 1.750 1.911 0.050 2 0 "[ . 1 . 2]" 1
1750 1 35 LEU QD 1 101 LEU QD 4.060 . 4.260 2.006 1.869 2.130 . 0 0 "[ . 1 . 2]" 1
1751 1 35 LEU QD 1 102 ARG H 3.630 . 3.810 3.057 2.816 3.296 . 0 0 "[ . 1 . 2]" 1
1752 1 35 LEU QD 1 102 ARG HA 4.380 . 4.600 3.161 2.893 3.457 . 0 0 "[ . 1 . 2]" 1
1753 1 35 LEU QD 1 102 ARG QB 5.070 . 5.320 3.772 3.467 4.120 . 0 0 "[ . 1 . 2]" 1
1754 1 35 LEU QD 1 102 ARG QD 3.540 . 3.720 2.520 1.831 3.720 0.000 13 0 "[ . 1 . 2]" 1
1755 1 35 LEU MD1 1 102 ARG HD2 5.960 . 6.260 3.265 2.193 4.990 . 0 0 "[ . 1 . 2]" 1
1756 1 38 ASN H 1 39 PRO QD 4.010 . 4.210 3.704 3.496 3.837 . 0 0 "[ . 1 . 2]" 1
1757 1 38 ASN HA 1 39 PRO QG 3.880 . 4.070 3.730 3.697 3.757 . 0 0 "[ . 1 . 2]" 1
1758 1 38 ASN HA 1 40 VAL QG 4.810 . 5.050 4.517 4.380 4.668 . 0 0 "[ . 1 . 2]" 1
1759 1 38 ASN QB 1 39 PRO QD 4.260 . 4.470 3.625 3.573 3.685 . 0 0 "[ . 1 . 2]" 1
1760 1 38 ASN QD 1 40 VAL HA 5.340 . 5.610 5.103 4.736 5.726 0.116 4 0 "[ . 1 . 2]" 1
1761 1 38 ASN QD 1 40 VAL QG 3.490 . 3.660 3.324 3.039 3.638 . 0 0 "[ . 1 . 2]" 1
1762 1 38 ASN QD 1 41 GLY H 4.000 . 4.200 2.542 2.194 3.628 . 0 0 "[ . 1 . 2]" 1
1763 1 38 ASN QD 1 41 GLY QA 4.240 . 4.450 2.866 2.276 4.542 0.092 11 0 "[ . 1 . 2]" 1
1764 1 39 PRO HA 1 101 LEU QD 2.810 . 2.950 2.054 1.942 2.140 . 0 0 "[ . 1 . 2]" 1
1765 1 39 PRO HB2 1 40 VAL QG 4.770 . 5.010 3.600 3.518 3.699 . 0 0 "[ . 1 . 2]" 1
1766 1 39 PRO HB2 1 101 LEU QD 3.270 . 3.430 3.334 3.175 3.459 0.029 2 0 "[ . 1 . 2]" 1
1767 1 39 PRO HB3 1 101 LEU QD 2.910 . 3.060 2.812 2.605 3.009 . 0 0 "[ . 1 . 2]" 1
1768 1 39 PRO QG 1 40 VAL H 3.430 . 3.600 2.373 2.266 2.479 . 0 0 "[ . 1 . 2]" 1
1769 1 39 PRO QG 1 40 VAL HA 5.350 . 5.620 4.247 4.197 4.364 . 0 0 "[ . 1 . 2]" 1
1770 1 39 PRO QG 1 40 VAL QG 3.700 . 3.890 2.519 2.429 2.614 . 0 0 "[ . 1 . 2]" 1
1771 1 39 PRO QG 1 94 GLN HA 2.990 . 3.140 2.749 2.565 2.963 . 0 0 "[ . 1 . 2]" 1
1772 1 39 PRO QG 1 97 ALA H 5.020 . 5.270 4.811 4.566 5.022 . 0 0 "[ . 1 . 2]" 1
1773 1 39 PRO QG 1 97 ALA MB 3.540 . 3.720 3.000 2.764 3.220 . 0 0 "[ . 1 . 2]" 1
1774 1 39 PRO QG 1 98 ASP HB2 4.040 . 4.240 2.509 2.267 2.967 . 0 0 "[ . 1 . 2]" 1
1775 1 39 PRO QG 1 98 ASP HB3 4.740 . 4.980 4.081 3.860 4.565 . 0 0 "[ . 1 . 2]" 1
1776 1 39 PRO QG 1 101 LEU QD 4.440 . 4.660 4.251 4.129 4.367 . 0 0 "[ . 1 . 2]" 1
1777 1 39 PRO QD 1 40 VAL H 3.630 . 3.810 2.862 2.789 2.974 . 0 0 "[ . 1 . 2]" 1
1778 1 39 PRO QD 1 40 VAL QG 4.310 . 4.530 3.454 3.375 3.632 . 0 0 "[ . 1 . 2]" 1
1779 1 39 PRO QD 1 41 GLY H 5.350 . 5.620 4.577 4.459 4.744 . 0 0 "[ . 1 . 2]" 1
1780 1 39 PRO QD 1 94 GLN QG 4.410 . 4.630 3.888 3.586 4.238 . 0 0 "[ . 1 . 2]" 1
1781 1 39 PRO QD 1 98 ASP HB2 4.680 . 4.910 4.286 4.053 4.785 . 0 0 "[ . 1 . 2]" 1
1782 1 39 PRO QD 1 101 LEU QD 4.560 . 4.790 4.332 4.190 4.456 . 0 0 "[ . 1 . 2]" 1
1783 1 40 VAL H 1 40 VAL QG 2.710 . 2.850 1.956 1.887 2.033 . 0 0 "[ . 1 . 2]" 1
1784 1 40 VAL HA 1 43 LEU QD 4.240 . 4.450 4.356 4.149 4.467 0.017 11 0 "[ . 1 . 2]" 1
1785 1 40 VAL HA 1 44 LEU QD 4.070 . 4.270 4.157 4.009 4.256 . 0 0 "[ . 1 . 2]" 1
1786 1 40 VAL QG 1 41 GLY QA 3.840 . 4.030 3.333 3.295 3.407 . 0 0 "[ . 1 . 2]" 1
1787 1 40 VAL QG 1 42 GLY H 5.440 . 5.710 4.515 4.369 4.756 . 0 0 "[ . 1 . 2]" 1
1788 1 40 VAL QG 1 43 LEU H 5.160 . 5.420 4.461 4.379 4.619 . 0 0 "[ . 1 . 2]" 1
1789 1 40 VAL QG 1 44 LEU H 4.560 . 4.790 4.073 3.951 4.309 . 0 0 "[ . 1 . 2]" 1
1790 1 40 VAL QG 1 44 LEU HB2 4.650 . 4.880 4.259 3.988 4.480 . 0 0 "[ . 1 . 2]" 1
1791 1 40 VAL QG 1 44 LEU HG 3.300 . 3.470 2.834 2.617 3.033 . 0 0 "[ . 1 . 2]" 1
1792 1 40 VAL QG 1 56 PHE QE 3.310 . 3.480 2.814 2.629 3.033 . 0 0 "[ . 1 . 2]" 1
1793 1 40 VAL QG 1 56 PHE HZ 3.170 . 3.330 2.956 2.708 3.153 . 0 0 "[ . 1 . 2]" 1
1794 1 40 VAL QG 1 93 LYS HA 4.320 . 4.540 4.128 3.889 4.389 . 0 0 "[ . 1 . 2]" 1
1795 1 40 VAL QG 1 93 LYS HB3 4.150 . 4.360 2.883 2.647 3.226 . 0 0 "[ . 1 . 2]" 1
1796 1 40 VAL QG 1 93 LYS QD 4.050 . 4.250 4.068 3.838 4.295 0.045 20 0 "[ . 1 . 2]" 1
1797 1 40 VAL QG 1 93 LYS QE 3.980 . 4.180 2.923 2.493 3.725 . 0 0 "[ . 1 . 2]" 1
1798 1 40 VAL QG 1 94 GLN H 5.100 . 5.360 3.576 3.346 3.801 . 0 0 "[ . 1 . 2]" 1
1799 1 40 VAL QG 1 94 GLN HA 2.760 . 2.900 2.133 1.975 2.273 . 0 0 "[ . 1 . 2]" 1
1800 1 40 VAL QG 1 94 GLN QG 3.010 . 3.160 2.216 2.009 2.459 . 0 0 "[ . 1 . 2]" 1
1801 1 40 VAL QG 1 94 GLN QE 4.610 . 4.840 4.442 3.819 4.817 . 0 0 "[ . 1 . 2]" 1
1802 1 40 VAL QG 1 95 GLU H 5.260 . 5.520 4.859 4.663 4.963 . 0 0 "[ . 1 . 2]" 1
1803 1 40 VAL QG 1 96 ALA H 5.440 . 5.710 5.134 4.963 5.272 . 0 0 "[ . 1 . 2]" 1
1804 1 40 VAL QG 1 96 ALA MB 5.440 . 5.710 4.513 4.331 4.677 . 0 0 "[ . 1 . 2]" 1
1805 1 40 VAL QG 1 97 ALA H 4.100 . 4.300 3.790 3.663 3.943 . 0 0 "[ . 1 . 2]" 1
1806 1 40 VAL QG 1 97 ALA MB 2.610 . 2.740 2.365 2.233 2.457 . 0 0 "[ . 1 . 2]" 1
1807 1 40 VAL QG 1 98 ASP H 4.740 . 4.980 4.458 4.361 4.628 . 0 0 "[ . 1 . 2]" 1
1808 1 41 GLY H 1 44 LEU QD 4.820 . 5.060 4.237 3.978 4.512 . 0 0 "[ . 1 . 2]" 1
1809 1 41 GLY QA 1 44 LEU QD 3.750 . 3.940 2.474 2.154 2.854 . 0 0 "[ . 1 . 2]" 1
1810 1 41 GLY QA 1 45 GLU QB 5.340 . 5.610 4.197 3.924 4.737 . 0 0 "[ . 1 . 2]" 1
1811 1 42 GLY H 1 101 LEU QD 3.790 . 3.980 3.375 3.166 3.516 . 0 0 "[ . 1 . 2]" 1
1812 1 42 GLY HA2 1 45 GLU QB 3.730 . 3.920 2.893 2.034 4.015 0.095 18 0 "[ . 1 . 2]" 1
1813 1 42 GLY HA2 1 101 LEU QD 4.210 . 4.420 3.657 3.315 3.866 . 0 0 "[ . 1 . 2]" 1
1814 1 42 GLY HA3 1 45 GLU QB 5.340 . 5.610 4.428 3.539 5.544 . 0 0 "[ . 1 . 2]" 1
1815 1 42 GLY HA3 1 101 LEU QD 3.540 . 3.720 2.479 2.122 2.736 . 0 0 "[ . 1 . 2]" 1
1816 1 43 LEU H 1 101 LEU QD 3.220 . 3.380 2.536 2.408 2.668 . 0 0 "[ . 1 . 2]" 1
1817 1 43 LEU HA 1 43 LEU QD 2.650 . 2.780 1.899 1.865 1.935 . 0 0 "[ . 1 . 2]" 1
1818 1 43 LEU HA 1 101 LEU QD 3.500 . 3.680 2.169 1.973 2.478 . 0 0 "[ . 1 . 2]" 1
1819 1 43 LEU HA 1 104 LEU QD 4.180 . 4.390 3.471 3.194 3.691 . 0 0 "[ . 1 . 2]" 1
1820 1 43 LEU HB2 1 101 LEU QD 3.450 . 3.620 2.544 2.408 2.954 . 0 0 "[ . 1 . 2]" 1
1821 1 43 LEU HB2 1 104 LEU QD 5.440 . 5.710 4.584 4.287 4.891 . 0 0 "[ . 1 . 2]" 1
1822 1 43 LEU HB3 1 101 LEU QD 4.340 . 4.560 3.697 3.557 4.025 . 0 0 "[ . 1 . 2]" 1
1823 1 43 LEU HG 1 101 LEU QD 4.780 . 5.020 3.813 3.626 4.325 . 0 0 "[ . 1 . 2]" 1
1824 1 43 LEU QD 1 44 LEU H 3.770 . 3.960 3.314 3.209 3.374 . 0 0 "[ . 1 . 2]" 1
1825 1 43 LEU QD 1 44 LEU HA 5.020 . 5.270 3.051 2.900 3.174 . 0 0 "[ . 1 . 2]" 1
1826 1 43 LEU QD 1 44 LEU HG 4.480 . 4.700 3.617 3.385 3.759 . 0 0 "[ . 1 . 2]" 1
1827 1 43 LEU QD 1 44 LEU QD 3.210 . 3.370 2.882 2.521 3.053 . 0 0 "[ . 1 . 2]" 1
1828 1 43 LEU QD 1 46 TYR H 4.730 . 4.970 4.153 4.072 4.270 . 0 0 "[ . 1 . 2]" 1
1829 1 43 LEU QD 1 46 TYR HB2 4.630 . 4.860 4.047 3.846 4.368 . 0 0 "[ . 1 . 2]" 1
1830 1 43 LEU QD 1 46 TYR HB3 3.840 . 4.030 2.890 2.733 3.138 . 0 0 "[ . 1 . 2]" 1
1831 1 43 LEU QD 1 46 TYR QD 3.050 . 3.200 2.637 2.386 2.813 . 0 0 "[ . 1 . 2]" 1
1832 1 43 LEU QD 1 46 TYR QE 3.940 . 4.140 3.754 3.517 3.940 . 0 0 "[ . 1 . 2]" 1
1833 1 43 LEU QD 1 47 ALA H 4.060 . 4.260 3.577 3.370 3.768 . 0 0 "[ . 1 . 2]" 1
1834 1 43 LEU QD 1 47 ALA HA 5.440 . 5.710 4.701 4.473 4.953 . 0 0 "[ . 1 . 2]" 1
1835 1 43 LEU QD 1 47 ALA MB 3.600 . 3.780 3.025 2.771 3.283 . 0 0 "[ . 1 . 2]" 1
1836 1 43 LEU QD 1 54 ALA H 5.440 . 5.710 4.684 4.511 4.949 . 0 0 "[ . 1 . 2]" 1
1837 1 43 LEU QD 1 54 ALA HA 4.530 . 4.760 3.343 2.999 3.679 . 0 0 "[ . 1 . 2]" 1
1838 1 43 LEU QD 1 54 ALA MB 2.920 . 3.070 1.934 1.886 2.010 . 0 0 "[ . 1 . 2]" 1
1839 1 43 LEU QD 1 55 GLU H 4.400 . 4.620 3.987 3.567 4.345 . 0 0 "[ . 1 . 2]" 1
1840 1 43 LEU QD 1 56 PHE HA 5.440 . 5.710 5.405 5.207 5.666 . 0 0 "[ . 1 . 2]" 1
1841 1 43 LEU QD 1 56 PHE QD 4.400 . 4.620 4.156 4.002 4.337 . 0 0 "[ . 1 . 2]" 1
1842 1 43 LEU QD 1 56 PHE QE 3.300 . 3.470 2.833 2.594 2.993 . 0 0 "[ . 1 . 2]" 1
1843 1 43 LEU QD 1 56 PHE HZ 3.280 . 3.440 2.423 2.288 2.595 . 0 0 "[ . 1 . 2]" 1
1844 1 43 LEU QD 1 74 ALA HA 4.400 . 4.620 4.454 4.260 4.644 0.024 18 0 "[ . 1 . 2]" 1
1845 1 43 LEU QD 1 74 ALA MB 3.120 . 3.280 2.685 2.538 2.817 . 0 0 "[ . 1 . 2]" 1
1846 1 43 LEU QD 1 75 LYS H 4.920 . 5.170 4.726 4.217 5.076 . 0 0 "[ . 1 . 2]" 1
1847 1 43 LEU QD 1 76 VAL HA 5.420 . 5.690 4.086 3.859 4.306 . 0 0 "[ . 1 . 2]" 1
1848 1 43 LEU QD 1 76 VAL HB 4.600 . 4.830 4.020 3.740 4.272 . 0 0 "[ . 1 . 2]" 1
1849 1 43 LEU QD 1 76 VAL MG1 3.370 . 3.540 3.080 2.880 3.318 . 0 0 "[ . 1 . 2]" 1
1850 1 43 LEU QD 1 76 VAL MG2 2.550 . 2.680 1.896 1.753 2.104 0.047 8 0 "[ . 1 . 2]" 1
1851 1 43 LEU QD 1 97 ALA HA 4.390 . 4.610 3.302 3.124 3.444 . 0 0 "[ . 1 . 2]" 1
1852 1 43 LEU QD 1 97 ALA MB 3.850 . 4.040 3.359 3.210 3.524 . 0 0 "[ . 1 . 2]" 1
1853 1 43 LEU QD 1 100 ALA H 5.150 . 5.410 4.535 4.417 4.662 . 0 0 "[ . 1 . 2]" 1
1854 1 43 LEU QD 1 101 LEU H 4.170 . 4.380 3.656 3.508 3.994 . 0 0 "[ . 1 . 2]" 1
1855 1 43 LEU QD 1 101 LEU HA 4.170 . 4.380 3.622 3.415 4.166 . 0 0 "[ . 1 . 2]" 1
1856 1 43 LEU QD 1 101 LEU HG 4.010 . 4.210 3.481 3.243 3.882 . 0 0 "[ . 1 . 2]" 1
1857 1 43 LEU QD 1 101 LEU QD 3.510 . 3.690 2.167 1.930 2.725 . 0 0 "[ . 1 . 2]" 1
1858 1 43 LEU QD 1 104 LEU QD 2.900 . 3.040 2.289 2.044 2.637 . 0 0 "[ . 1 . 2]" 1
1859 1 44 LEU H 1 44 LEU QD 3.410 . 3.580 3.085 3.036 3.156 . 0 0 "[ . 1 . 2]" 1
1860 1 44 LEU H 1 101 LEU QD 4.820 . 5.060 4.332 4.167 4.451 . 0 0 "[ . 1 . 2]" 1
1861 1 44 LEU HA 1 44 LEU QD 2.810 . 2.950 2.025 1.956 2.080 . 0 0 "[ . 1 . 2]" 1
1862 1 44 LEU HB2 1 44 LEU QD 2.950 . 3.100 2.256 2.238 2.278 . 0 0 "[ . 1 . 2]" 1
1863 1 44 LEU HB3 1 44 LEU QD 2.620 . 2.750 2.117 2.113 2.121 . 0 0 "[ . 1 . 2]" 1
1864 1 44 LEU QD 1 45 GLU H 4.190 . 4.400 4.104 4.052 4.218 . 0 0 "[ . 1 . 2]" 1
1865 1 44 LEU QD 1 54 ALA H 4.320 . 4.540 3.910 3.686 4.131 . 0 0 "[ . 1 . 2]" 1
1866 1 44 LEU QD 1 54 ALA MB 2.570 . 2.700 1.859 1.775 1.995 0.025 9 0 "[ . 1 . 2]" 1
1867 1 44 LEU QD 1 56 PHE H 5.180 . 5.440 4.715 4.132 5.257 . 0 0 "[ . 1 . 2]" 1
1868 1 44 LEU QD 1 56 PHE QE 3.130 . 3.290 1.999 1.879 2.176 . 0 0 "[ . 1 . 2]" 1
1869 1 44 LEU QD 1 56 PHE HZ 3.960 . 4.160 3.717 3.633 3.844 . 0 0 "[ . 1 . 2]" 1
1870 1 45 GLU H 1 45 GLU QB 2.600 . 2.730 2.258 2.004 2.728 . 0 0 "[ . 1 . 2]" 1
1871 1 45 GLU H 1 45 GLU QG 3.300 . 3.470 3.145 1.860 3.783 0.313 12 0 "[ . 1 . 2]" 1
1872 1 45 GLU HA 1 45 GLU QG 3.480 . 3.650 3.154 2.886 3.476 . 0 0 "[ . 1 . 2]" 1
1873 1 45 GLU HA 1 48 ARG QG 3.860 . 4.050 2.108 1.770 3.894 0.030 20 0 "[ . 1 . 2]" 1
1874 1 45 GLU QB 1 46 TYR H 3.670 . 3.850 2.945 2.337 3.613 . 0 0 "[ . 1 . 2]" 1
1875 1 45 GLU QB 1 48 ARG HD3 3.650 . 3.830 3.619 2.577 3.890 0.060 9 0 "[ . 1 . 2]" 1
1876 1 45 GLU QG 1 46 TYR HA 4.460 . 4.680 3.350 3.108 3.874 . 0 0 "[ . 1 . 2]" 1
1877 1 45 GLU QG 1 46 TYR HB3 4.780 . 5.020 4.529 3.945 4.986 . 0 0 "[ . 1 . 2]" 1
1878 1 46 TYR H 1 101 LEU QD 4.630 . 4.860 4.221 3.957 4.472 . 0 0 "[ . 1 . 2]" 1
1879 1 46 TYR H 1 104 LEU QD 5.440 . 5.710 4.923 4.658 5.159 . 0 0 "[ . 1 . 2]" 1
1880 1 46 TYR HB2 1 101 LEU QD 5.180 . 5.440 3.532 3.384 3.655 . 0 0 "[ . 1 . 2]" 1
1881 1 46 TYR HB2 1 104 LEU QD 4.830 . 5.070 3.164 2.951 3.347 . 0 0 "[ . 1 . 2]" 1
1882 1 46 TYR HB3 1 101 LEU QD 4.580 . 4.810 3.513 3.351 3.685 . 0 0 "[ . 1 . 2]" 1
1883 1 46 TYR HB3 1 104 LEU QD 4.900 . 5.150 3.251 3.012 3.465 . 0 0 "[ . 1 . 2]" 1
1884 1 46 TYR QD 1 101 LEU QD 4.750 . 4.990 4.184 4.051 4.327 . 0 0 "[ . 1 . 2]" 1
1885 1 46 TYR QD 1 104 LEU QD 3.590 . 3.770 2.690 2.594 2.790 . 0 0 "[ . 1 . 2]" 1
1886 1 46 TYR QE 1 104 LEU QD 3.240 . 3.400 2.617 2.503 2.723 . 0 0 "[ . 1 . 2]" 1
1887 1 47 ALA H 1 101 LEU QD 5.440 . 5.710 5.339 5.107 5.635 . 0 0 "[ . 1 . 2]" 1
1888 1 48 ARG H 1 48 ARG QG 3.380 . 3.550 2.601 2.337 3.851 0.301 9 0 "[ . 1 . 2]" 1
1889 1 48 ARG HA 1 48 ARG QG 3.250 . 3.410 3.280 2.646 3.347 . 0 0 "[ . 1 . 2]" 1
1890 1 48 ARG HD2 1 48 ARG QG 2.630 . 2.760 2.359 2.326 2.388 . 0 0 "[ . 1 . 2]" 1
1891 1 48 ARG HD3 1 48 ARG QG 2.640 . 2.770 2.300 2.167 2.362 . 0 0 "[ . 1 . 2]" 1
1892 1 48 ARG QG 1 49 SER HA 3.340 . 3.510 3.138 2.871 3.299 . 0 0 "[ . 1 . 2]" 1
1893 1 52 PHE HA 1 77 GLY QA 4.790 . 5.030 3.266 2.723 3.669 . 0 0 "[ . 1 . 2]" 1
1894 1 52 PHE QD 1 77 GLY QA 3.710 . 3.900 2.002 1.761 2.230 0.039 15 0 "[ . 1 . 2]" 1
1895 1 52 PHE QE 1 77 GLY QA 3.580 . 3.760 3.707 3.324 3.801 0.041 5 0 "[ . 1 . 2]" 1
1896 1 53 ALA H 1 77 GLY QA 4.450 . 4.670 2.403 1.997 3.105 . 0 0 "[ . 1 . 2]" 1
1897 1 53 ALA MB 1 55 GLU QG 4.290 . 4.500 3.314 2.823 4.376 . 0 0 "[ . 1 . 2]" 1
1898 1 54 ALA HA 1 55 GLU QG 4.780 . 5.020 3.903 3.629 4.248 . 0 0 "[ . 1 . 2]" 1
1899 1 54 ALA MB 1 55 GLU QB 4.940 . 5.190 4.875 4.617 4.986 . 0 0 "[ . 1 . 2]" 1
1900 1 55 GLU H 1 55 GLU QB 3.260 . 3.420 2.681 2.478 3.192 . 0 0 "[ . 1 . 2]" 1
1901 1 55 GLU HA 1 55 GLU QG 3.420 . 3.590 2.582 2.313 3.350 . 0 0 "[ . 1 . 2]" 1
1902 1 55 GLU QB 1 56 PHE H 3.370 . 3.540 2.944 2.287 3.445 . 0 0 "[ . 1 . 2]" 1
1903 1 55 GLU QB 1 75 LYS H 5.010 . 5.260 3.486 2.982 4.684 . 0 0 "[ . 1 . 2]" 1
1904 1 55 GLU QB 1 75 LYS HB3 4.050 . 4.250 2.169 1.770 3.985 0.030 11 0 "[ . 1 . 2]" 1
1905 1 55 GLU QG 1 56 PHE H 3.840 . 4.030 4.020 3.744 4.137 0.107 9 0 "[ . 1 . 2]" 1
1906 1 55 GLU QG 1 56 PHE QD 5.320 . 5.590 5.497 5.210 5.607 0.017 8 0 "[ . 1 . 2]" 1
1907 1 55 GLU QG 1 75 LYS HB3 4.540 . 4.770 3.473 1.801 3.913 . 0 0 "[ . 1 . 2]" 1
1908 1 56 PHE HB3 1 93 LYS QG 4.530 . 4.760 2.721 2.120 3.425 . 0 0 "[ . 1 . 2]" 1
1909 1 56 PHE QD 1 93 LYS QG 4.470 . 4.690 3.596 3.239 3.945 . 0 0 "[ . 1 . 2]" 1
1910 1 56 PHE QE 1 93 LYS QG 5.290 . 5.550 4.946 4.434 5.218 . 0 0 "[ . 1 . 2]" 1
1911 1 57 LYS H 1 57 LYS QE 5.260 . 5.520 4.370 3.733 4.768 . 0 0 "[ . 1 . 2]" 1
1912 1 57 LYS H 1 59 VAL QG 4.860 . 5.100 4.563 4.305 4.821 . 0 0 "[ . 1 . 2]" 1
1913 1 57 LYS HA 1 57 LYS QE 5.290 . 5.550 4.301 4.028 4.844 . 0 0 "[ . 1 . 2]" 1
1914 1 57 LYS HA 1 58 LEU QB 4.720 . 4.960 4.020 3.930 4.107 . 0 0 "[ . 1 . 2]" 1
1915 1 57 LYS HG2 1 59 VAL QG 4.610 . 4.840 4.025 3.567 4.656 . 0 0 "[ . 1 . 2]" 1
1916 1 57 LYS QE 1 57 LYS HG3 3.500 . 3.680 3.330 3.297 3.442 . 0 0 "[ . 1 . 2]" 1
1917 1 57 LYS HG3 1 59 VAL QG 3.940 . 4.140 2.894 2.392 3.902 . 0 0 "[ . 1 . 2]" 1
1918 1 57 LYS QD 1 59 VAL QG 4.010 . 4.210 2.887 1.949 4.014 . 0 0 "[ . 1 . 2]" 1
1919 1 57 LYS QE 1 75 LYS QD 4.050 . 4.250 3.146 2.487 3.986 . 0 0 "[ . 1 . 2]" 1
1920 1 57 LYS QE 1 80 TRP HE3 4.490 . 4.710 4.360 3.913 4.730 0.020 11 0 "[ . 1 . 2]" 1
1921 1 57 LYS QE 1 80 TRP HZ3 4.460 . 4.680 2.199 1.762 2.871 0.038 12 0 "[ . 1 . 2]" 1
1922 1 57 LYS QE 1 80 TRP HZ2 5.180 . 5.440 4.777 4.367 5.100 . 0 0 "[ . 1 . 2]" 1
1923 1 57 LYS QE 1 80 TRP HH2 4.100 . 4.300 2.576 2.107 3.188 . 0 0 "[ . 1 . 2]" 1
1924 1 58 LEU H 1 58 LEU QB 3.080 . 3.230 2.263 2.217 2.317 . 0 0 "[ . 1 . 2]" 1
1925 1 58 LEU H 1 58 LEU QD 3.870 . 4.060 3.765 3.722 3.817 . 0 0 "[ . 1 . 2]" 1
1926 1 58 LEU HA 1 58 LEU QD 3.100 . 3.260 2.495 2.022 2.921 . 0 0 "[ . 1 . 2]" 1
1927 1 58 LEU HA 1 59 VAL QG 4.400 . 4.620 3.565 3.492 3.659 . 0 0 "[ . 1 . 2]" 1
1928 1 58 LEU QB 1 72 TYR HA 4.810 . 5.050 4.556 4.315 4.800 . 0 0 "[ . 1 . 2]" 1
1929 1 58 LEU QB 1 72 TYR QD 4.820 . 5.060 4.131 3.889 4.398 . 0 0 "[ . 1 . 2]" 1
1930 1 58 LEU QB 1 72 TYR QE 3.960 . 4.160 3.184 2.780 3.535 . 0 0 "[ . 1 . 2]" 1
1931 1 58 LEU QD 1 59 VAL H 3.410 . 3.580 2.742 2.202 3.148 . 0 0 "[ . 1 . 2]" 1
1932 1 58 LEU QD 1 59 VAL HB 5.220 . 5.480 4.232 3.735 4.401 . 0 0 "[ . 1 . 2]" 1
1933 1 58 LEU QD 1 60 ASP H 3.200 . 3.360 2.619 2.157 2.926 . 0 0 "[ . 1 . 2]" 1
1934 1 58 LEU QD 1 60 ASP QB 5.130 . 5.390 4.175 3.978 4.443 . 0 0 "[ . 1 . 2]" 1
1935 1 58 LEU QD 1 61 GLN H 4.680 . 4.910 3.620 3.071 4.263 . 0 0 "[ . 1 . 2]" 1
1936 1 58 LEU QD 1 61 GLN QG 4.180 . 4.390 2.924 1.815 3.778 . 0 0 "[ . 1 . 2]" 1
1937 1 58 LEU QD 1 61 GLN QE 3.980 . 4.180 3.199 1.769 4.232 0.052 20 0 "[ . 1 . 2]" 1
1938 1 58 LEU QD 1 70 PHE HA 3.800 . 3.990 2.940 2.141 3.588 . 0 0 "[ . 1 . 2]" 1
1939 1 58 LEU QD 1 70 PHE QB 4.080 . 4.280 2.379 1.787 3.099 0.013 14 0 "[ . 1 . 2]" 1
1940 1 58 LEU QD 1 70 PHE QD 3.090 . 3.240 1.959 1.775 2.379 0.025 13 0 "[ . 1 . 2]" 1
1941 1 58 LEU QD 1 70 PHE QE 4.300 . 4.510 3.192 2.776 3.793 . 0 0 "[ . 1 . 2]" 1
1942 1 58 LEU QD 1 71 VAL H 3.450 . 3.620 2.880 2.285 3.565 . 0 0 "[ . 1 . 2]" 1
1943 1 58 LEU QD 1 72 TYR HA 4.330 . 4.550 3.806 2.976 4.589 0.039 9 0 "[ . 1 . 2]" 1
1944 1 58 LEU QD 1 72 TYR QD 4.190 . 4.400 3.304 2.522 3.999 . 0 0 "[ . 1 . 2]" 1
1945 1 58 LEU QD 1 72 TYR QE 3.500 . 3.680 2.434 1.928 2.736 . 0 0 "[ . 1 . 2]" 1
1946 1 59 VAL H 1 59 VAL QG 3.300 . 3.470 2.173 2.022 2.316 . 0 0 "[ . 1 . 2]" 1
1947 1 59 VAL H 1 71 VAL QG 5.120 . 5.380 3.694 3.584 3.834 . 0 0 "[ . 1 . 2]" 1
1948 1 59 VAL HA 1 59 VAL QG 3.000 . 3.150 2.134 2.130 2.140 . 0 0 "[ . 1 . 2]" 1
1949 1 59 VAL HB 1 71 VAL QG 4.150 . 4.360 2.537 2.264 3.040 . 0 0 "[ . 1 . 2]" 1
1950 1 59 VAL QG 1 60 ASP H 3.890 . 4.080 3.135 3.045 3.228 . 0 0 "[ . 1 . 2]" 1
1951 1 59 VAL QG 1 71 VAL HA 5.440 . 5.710 4.954 4.520 5.484 . 0 0 "[ . 1 . 2]" 1
1952 1 59 VAL QG 1 71 VAL HB 5.170 . 5.430 3.550 3.040 4.190 . 0 0 "[ . 1 . 2]" 1
1953 1 59 VAL QG 1 72 TYR H 4.870 . 5.110 4.672 4.289 5.106 . 0 0 "[ . 1 . 2]" 1
1954 1 59 VAL QG 1 72 TYR HA 3.800 . 3.990 3.117 2.812 3.360 . 0 0 "[ . 1 . 2]" 1
1955 1 59 VAL QG 1 72 TYR QD 5.440 . 5.710 4.884 4.726 5.097 . 0 0 "[ . 1 . 2]" 1
1956 1 59 VAL QG 1 73 GLN H 3.670 . 3.850 2.774 2.525 3.031 . 0 0 "[ . 1 . 2]" 1
1957 1 59 VAL QG 1 73 GLN HA 4.410 . 4.630 4.042 3.834 4.260 . 0 0 "[ . 1 . 2]" 1
1958 1 59 VAL QG 1 73 GLN QB 3.120 . 3.280 2.056 1.864 2.281 . 0 0 "[ . 1 . 2]" 1
1959 1 59 VAL QG 1 73 GLN QG 3.870 . 4.060 3.657 3.432 3.897 . 0 0 "[ . 1 . 2]" 1
1960 1 59 VAL QG 1 80 TRP HE3 4.630 . 4.860 4.247 3.801 4.835 . 0 0 "[ . 1 . 2]" 1
1961 1 59 VAL QG 1 83 ALA HA 4.950 . 5.200 4.419 3.980 4.749 . 0 0 "[ . 1 . 2]" 1
1962 1 59 VAL QG 1 84 VAL H 5.410 . 5.680 5.169 4.844 5.486 . 0 0 "[ . 1 . 2]" 1
1963 1 60 ASP H 1 60 ASP QB 3.450 . 3.620 2.755 2.544 2.919 . 0 0 "[ . 1 . 2]" 1
1964 1 60 ASP H 1 71 VAL QG 3.470 . 3.640 3.136 2.991 3.298 . 0 0 "[ . 1 . 2]" 1
1965 1 60 ASP HA 1 71 VAL QG 4.440 . 4.660 4.351 4.144 4.633 . 0 0 "[ . 1 . 2]" 1
1966 1 60 ASP QB 1 61 GLN H 3.980 . 4.180 3.440 2.652 3.570 . 0 0 "[ . 1 . 2]" 1
1967 1 60 ASP QB 1 71 VAL HB 4.530 . 4.760 2.563 1.870 3.211 . 0 0 "[ . 1 . 2]" 1
1968 1 60 ASP QB 1 71 VAL QG 3.140 . 3.300 2.410 1.899 2.982 . 0 0 "[ . 1 . 2]" 1
1969 1 61 GLN H 1 71 VAL QG 4.170 . 4.380 4.412 4.136 4.483 0.103 4 0 "[ . 1 . 2]" 1
1970 1 61 GLN HA 1 71 VAL QG 4.440 . 4.660 3.360 2.804 4.083 . 0 0 "[ . 1 . 2]" 1
1971 1 61 GLN QB 1 61 GLN QE 3.730 . 3.920 2.139 1.732 3.434 0.068 16 0 "[ . 1 . 2]" 1
1972 1 61 GLN QE 1 70 PHE QE 4.160 . 4.370 2.778 2.131 3.942 . 0 0 "[ . 1 . 2]" 1
1973 1 61 GLN QE 1 70 PHE HZ 4.640 . 4.870 4.321 3.564 4.895 0.025 8 0 "[ . 1 . 2]" 1
1974 1 62 SER H 1 71 VAL QG 5.110 . 5.370 3.511 2.679 4.382 . 0 0 "[ . 1 . 2]" 1
1975 1 64 PRO HB2 1 65 PRO QD 3.640 . 3.820 2.301 2.145 2.568 . 0 0 "[ . 1 . 2]" 1
1976 1 64 PRO HB3 1 65 PRO QD 3.420 . 3.590 2.780 2.642 3.097 . 0 0 "[ . 1 . 2]" 1
1977 1 64 PRO HD3 1 65 PRO QD 5.060 . 5.310 5.009 4.905 5.210 . 0 0 "[ . 1 . 2]" 1
1978 1 66 HIS HB2 1 67 GLU QG 4.790 . 5.030 3.805 3.470 5.028 . 0 0 "[ . 1 . 2]" 1
1979 1 66 HIS HD2 1 67 GLU QG 3.320 . 3.490 2.302 1.777 3.502 0.023 9 0 "[ . 1 . 2]" 1
1980 1 67 GLU H 1 67 GLU QG 4.750 . 4.990 3.609 3.208 4.203 . 0 0 "[ . 1 . 2]" 1
1981 1 67 GLU H 1 68 PRO QG 5.080 . 5.330 4.660 3.660 5.064 . 0 0 "[ . 1 . 2]" 1
1982 1 67 GLU HA 1 67 GLU QG 3.590 . 3.770 2.543 2.207 2.769 . 0 0 "[ . 1 . 2]" 1
1983 1 68 PRO QB 1 70 PHE QE 3.670 . 3.850 2.680 1.912 3.192 . 0 0 "[ . 1 . 2]" 1
1984 1 68 PRO QB 1 70 PHE HZ 4.630 . 4.860 2.911 2.366 3.358 . 0 0 "[ . 1 . 2]" 1
1985 1 68 PRO QG 1 70 PHE QE 4.460 . 4.680 2.854 2.146 4.418 . 0 0 "[ . 1 . 2]" 1
1986 1 68 PRO QG 1 70 PHE HZ 4.530 . 4.760 3.651 2.473 4.795 0.035 12 0 "[ . 1 . 2]" 1
1987 1 69 LYS HA 1 87 HIS QB 5.340 . 5.610 3.912 2.971 5.162 . 0 0 "[ . 1 . 2]" 1
1988 1 69 LYS QG 1 85 CYS QB 4.810 . 5.050 2.170 1.779 4.187 0.021 7 0 "[ . 1 . 2]" 1
1989 1 69 LYS QD 1 85 CYS QB 4.910 . 5.160 2.393 1.791 4.692 0.009 12 0 "[ . 1 . 2]" 1
1990 1 70 PHE H 1 85 CYS QB 5.340 . 5.610 4.411 4.037 4.821 . 0 0 "[ . 1 . 2]" 1
1991 1 70 PHE HA 1 71 VAL QG 4.880 . 5.120 3.538 3.429 3.658 . 0 0 "[ . 1 . 2]" 1
1992 1 70 PHE QD 1 88 SER QB 5.340 . 5.610 4.618 4.265 4.953 . 0 0 "[ . 1 . 2]" 1
1993 1 71 VAL H 1 71 VAL QG 3.330 . 3.500 2.231 2.047 2.488 . 0 0 "[ . 1 . 2]" 1
1994 1 71 VAL HA 1 84 VAL QG 4.950 . 5.200 4.177 3.856 4.509 . 0 0 "[ . 1 . 2]" 1
1995 1 71 VAL QG 1 72 TYR H 3.340 . 3.510 3.068 2.877 3.217 . 0 0 "[ . 1 . 2]" 1
1996 1 71 VAL QG 1 72 TYR HA 4.640 . 4.870 3.879 3.752 4.028 . 0 0 "[ . 1 . 2]" 1
1997 1 71 VAL QG 1 73 GLN H 5.310 . 5.580 4.610 4.406 4.797 . 0 0 "[ . 1 . 2]" 1
1998 1 71 VAL QG 1 83 ALA HA 4.660 . 4.890 3.890 3.597 4.207 . 0 0 "[ . 1 . 2]" 1
1999 1 71 VAL QG 1 84 VAL H 4.040 . 4.240 3.698 3.373 3.990 . 0 0 "[ . 1 . 2]" 1
2000 1 71 VAL QG 1 84 VAL HA 4.440 . 4.660 4.251 3.841 4.663 0.003 13 0 "[ . 1 . 2]" 1
2001 1 71 VAL QG 1 85 CYS H 4.890 . 5.130 4.262 3.744 4.801 . 0 0 "[ . 1 . 2]" 1
2002 1 71 VAL QG 1 85 CYS HA 3.980 . 4.180 3.068 2.679 3.474 . 0 0 "[ . 1 . 2]" 1
2003 1 71 VAL QG 1 85 CYS QB 3.700 . 3.890 2.170 1.791 3.042 0.009 12 0 "[ . 1 . 2]" 1
2004 1 72 TYR H 1 84 VAL QG 3.850 . 4.040 2.940 2.679 3.437 . 0 0 "[ . 1 . 2]" 1
2005 1 72 TYR HB2 1 84 VAL QG 4.000 . 4.200 2.804 2.439 3.485 . 0 0 "[ . 1 . 2]" 1
2006 1 72 TYR HB3 1 93 LYS QG 4.840 . 5.080 4.386 3.606 5.024 . 0 0 "[ . 1 . 2]" 1
2007 1 72 TYR QD 1 84 VAL QG 5.440 . 5.710 4.268 3.946 4.851 . 0 0 "[ . 1 . 2]" 1
2008 1 72 TYR QD 1 93 LYS QG 4.620 . 4.850 3.279 2.880 3.694 . 0 0 "[ . 1 . 2]" 1
2009 1 72 TYR QE 1 89 LYS QB 3.970 . 4.170 3.768 3.573 4.010 . 0 0 "[ . 1 . 2]" 1
2010 1 72 TYR QE 1 93 LYS QG 4.430 . 4.650 2.979 2.658 3.498 . 0 0 "[ . 1 . 2]" 1
2011 1 75 LYS H 1 75 LYS QG 4.190 . 4.400 3.993 3.954 4.085 . 0 0 "[ . 1 . 2]" 1
2012 1 75 LYS QE 1 75 LYS QG 3.250 . 3.410 2.264 2.136 2.354 . 0 0 "[ . 1 . 2]" 1
2013 1 75 LYS QG 1 76 VAL H 3.440 . 3.610 3.270 2.719 3.499 . 0 0 "[ . 1 . 2]" 1
2014 1 75 LYS QG 1 76 VAL HA 5.340 . 5.610 3.905 3.698 4.141 . 0 0 "[ . 1 . 2]" 1
2015 1 75 LYS QG 1 80 TRP HA 4.190 . 4.400 3.762 3.326 3.983 . 0 0 "[ . 1 . 2]" 1
2016 1 75 LYS QG 1 80 TRP HE3 5.340 . 5.610 3.932 3.525 4.137 . 0 0 "[ . 1 . 2]" 1
2017 1 75 LYS QG 1 80 TRP HZ3 4.550 . 4.780 4.129 3.749 4.473 . 0 0 "[ . 1 . 2]" 1
2018 1 75 LYS QE 1 80 TRP HE1 4.640 . 4.870 3.919 3.376 4.410 . 0 0 "[ . 1 . 2]" 1
2019 1 75 LYS QE 1 80 TRP HZ3 4.430 . 4.650 4.663 4.331 4.723 0.073 11 0 "[ . 1 . 2]" 1
2020 1 76 VAL H 1 77 GLY QA 5.340 . 5.610 4.869 4.725 4.970 . 0 0 "[ . 1 . 2]" 1
2021 1 76 VAL H 1 79 ARG QB 4.020 . 4.220 3.562 3.267 4.081 . 0 0 "[ . 1 . 2]" 1
2022 1 76 VAL HA 1 77 GLY QA 4.410 . 4.630 3.888 3.860 3.908 . 0 0 "[ . 1 . 2]" 1
2023 1 76 VAL HB 1 79 ARG QB 4.450 . 4.670 3.237 2.970 3.938 . 0 0 "[ . 1 . 2]" 1
2024 1 76 VAL HB 1 104 LEU QD 4.770 . 5.010 4.445 4.013 4.790 . 0 0 "[ . 1 . 2]" 1
2025 1 76 VAL MG1 1 104 LEU QD 4.680 . 4.910 3.461 3.023 3.806 . 0 0 "[ . 1 . 2]" 1
2026 1 76 VAL MG2 1 104 LEU QD 4.640 . 4.870 3.520 3.011 4.029 . 0 0 "[ . 1 . 2]" 1
2027 1 79 ARG H 1 79 ARG QG 4.100 . 4.300 3.234 2.549 4.136 . 0 0 "[ . 1 . 2]" 1
2028 1 79 ARG QB 1 79 ARG QD 3.330 . 3.500 2.268 2.102 2.408 . 0 0 "[ . 1 . 2]" 1
2029 1 79 ARG QB 1 80 TRP H 3.720 . 3.910 3.201 2.635 3.789 . 0 0 "[ . 1 . 2]" 1
2030 1 79 ARG QB 1 81 PHE QD 3.550 . 3.730 2.255 1.893 2.773 . 0 0 "[ . 1 . 2]" 1
2031 1 79 ARG QB 1 81 PHE QE 3.630 . 3.810 2.127 1.849 2.556 . 0 0 "[ . 1 . 2]" 1
2032 1 79 ARG QG 1 80 TRP H 4.170 . 4.380 3.878 2.944 4.446 0.066 7 0 "[ . 1 . 2]" 1
2033 1 79 ARG QD 1 80 TRP H 4.840 . 5.080 3.833 2.210 5.096 0.016 14 0 "[ . 1 . 2]" 1
2034 1 79 ARG QD 1 81 PHE QD 3.830 . 4.020 3.304 1.785 4.050 0.030 12 0 "[ . 1 . 2]" 1
2035 1 79 ARG QD 1 81 PHE QE 5.070 . 5.320 3.303 2.191 4.835 . 0 0 "[ . 1 . 2]" 1
2036 1 81 PHE QD 1 104 LEU QD 4.620 . 4.850 4.120 4.008 4.215 . 0 0 "[ . 1 . 2]" 1
2037 1 81 PHE QE 1 104 LEU QD 3.130 . 3.290 2.329 2.168 2.463 . 0 0 "[ . 1 . 2]" 1
2038 1 81 PHE HZ 1 104 LEU QD 2.970 . 3.120 1.995 1.782 2.298 0.018 9 0 "[ . 1 . 2]" 1
2039 1 82 PRO QB 1 99 ALA HA 5.340 . 5.610 5.270 5.139 5.474 . 0 0 "[ . 1 . 2]" 1
2040 1 82 PRO QB 1 99 ALA MB 5.090 . 5.340 2.921 2.843 2.984 . 0 0 "[ . 1 . 2]" 1
2041 1 82 PRO QD 1 99 ALA MB 5.300 . 5.570 3.305 3.139 3.443 . 0 0 "[ . 1 . 2]" 1
2042 1 83 ALA HA 1 84 VAL QG 3.570 . 3.750 3.385 3.258 3.452 . 0 0 "[ . 1 . 2]" 1
2043 1 84 VAL H 1 84 VAL QG 2.980 . 3.130 2.044 1.966 2.190 . 0 0 "[ . 1 . 2]" 1
2044 1 84 VAL HA 1 84 VAL QG 2.860 . 3.000 2.295 2.262 2.319 . 0 0 "[ . 1 . 2]" 1
2045 1 84 VAL HA 1 85 CYS QB 5.030 . 5.280 4.373 4.259 4.546 . 0 0 "[ . 1 . 2]" 1
2046 1 84 VAL QG 1 85 CYS H 3.700 . 3.890 3.198 2.949 3.488 . 0 0 "[ . 1 . 2]" 1
2047 1 84 VAL QG 1 85 CYS HA 4.260 . 4.470 3.673 3.447 4.035 . 0 0 "[ . 1 . 2]" 1
2048 1 84 VAL QG 1 86 ALA H 5.040 . 5.290 4.023 3.641 4.720 . 0 0 "[ . 1 . 2]" 1
2049 1 84 VAL QG 1 86 ALA MB 4.060 . 4.260 3.504 3.015 3.921 . 0 0 "[ . 1 . 2]" 1
2050 1 84 VAL QG 1 92 GLY QA 4.500 . 4.730 2.738 2.446 3.057 . 0 0 "[ . 1 . 2]" 1
2051 1 84 VAL QG 1 95 GLU H 4.800 . 5.040 3.836 3.676 4.070 . 0 0 "[ . 1 . 2]" 1
2052 1 84 VAL QG 1 95 GLU HB2 3.280 . 3.440 2.226 1.957 2.654 . 0 0 "[ . 1 . 2]" 1
2053 1 84 VAL QG 1 95 GLU HB3 3.370 . 3.540 2.482 2.234 2.865 . 0 0 "[ . 1 . 2]" 1
2054 1 84 VAL QG 1 95 GLU QG 3.800 . 3.990 3.543 3.351 3.814 . 0 0 "[ . 1 . 2]" 1
2055 1 84 VAL QG 1 96 ALA H 3.520 . 3.700 2.408 2.216 2.738 . 0 0 "[ . 1 . 2]" 1
2056 1 84 VAL QG 1 96 ALA HA 2.960 . 3.110 2.231 2.077 2.477 . 0 0 "[ . 1 . 2]" 1
2057 1 84 VAL QG 1 96 ALA MB 2.910 . 3.060 2.116 1.971 2.411 . 0 0 "[ . 1 . 2]" 1
2058 1 84 VAL QG 1 97 ALA H 5.440 . 5.710 4.295 4.098 4.628 . 0 0 "[ . 1 . 2]" 1
2059 1 84 VAL QG 1 99 ALA HA 5.440 . 5.710 4.950 4.684 5.397 . 0 0 "[ . 1 . 2]" 1
2060 1 84 VAL QG 1 99 ALA MB 3.060 . 3.210 2.612 2.379 3.051 . 0 0 "[ . 1 . 2]" 1
2061 1 85 CYS H 1 85 CYS QB 3.260 . 3.420 3.056 2.658 3.205 . 0 0 "[ . 1 . 2]" 1
2062 1 86 ALA MB 1 87 HIS QB 4.710 . 4.950 4.454 3.993 4.748 . 0 0 "[ . 1 . 2]" 1
2063 1 87 HIS QB 1 87 HIS HD2 3.310 . 3.480 2.996 2.728 3.303 . 0 0 "[ . 1 . 2]" 1
2064 1 87 HIS QB 1 88 SER H 4.210 . 4.420 3.761 3.107 4.023 . 0 0 "[ . 1 . 2]" 1
2065 1 88 SER H 1 88 SER QB 3.400 . 3.570 2.788 2.619 3.280 . 0 0 "[ . 1 . 2]" 1
2066 1 88 SER QB 1 90 LYS QB 4.610 . 4.840 4.060 3.185 4.911 0.071 19 0 "[ . 1 . 2]" 1
2067 1 88 SER QB 1 91 GLN H 4.880 . 5.120 2.622 2.284 3.713 . 0 0 "[ . 1 . 2]" 1
2068 1 90 LYS HA 1 90 LYS QG 3.450 . 3.620 2.831 2.373 3.358 . 0 0 "[ . 1 . 2]" 1
2069 1 90 LYS HA 1 93 LYS QG 4.600 . 4.830 3.405 2.819 3.958 . 0 0 "[ . 1 . 2]" 1
2070 1 90 LYS QG 1 91 GLN H 4.830 . 5.070 3.202 2.140 3.883 . 0 0 "[ . 1 . 2]" 1
2071 1 90 LYS QG 1 91 GLN HA 4.730 . 4.970 3.678 3.225 4.186 . 0 0 "[ . 1 . 2]" 1
2072 1 91 GLN HA 1 94 GLN QE 4.510 . 4.740 2.701 1.795 3.856 0.005 14 0 "[ . 1 . 2]" 1
2073 1 91 GLN QG 1 94 GLN QE 4.900 . 5.150 3.523 2.437 4.387 . 0 0 "[ . 1 . 2]" 1
2074 1 93 LYS H 1 93 LYS QG 3.050 . 3.200 2.150 2.011 2.363 . 0 0 "[ . 1 . 2]" 1
2075 1 93 LYS HA 1 93 LYS QG 3.320 . 3.490 2.454 2.377 2.526 . 0 0 "[ . 1 . 2]" 1
2076 1 93 LYS HB2 1 94 GLN QE 5.340 . 5.610 5.125 4.298 5.730 0.120 3 0 "[ . 1 . 2]" 1
2077 1 93 LYS QG 1 94 GLN H 4.770 . 5.010 4.003 3.902 4.094 . 0 0 "[ . 1 . 2]" 1
2078 1 97 ALA MB 1 101 LEU QD 5.030 . 5.280 3.311 3.117 3.434 . 0 0 "[ . 1 . 2]" 1
2079 1 98 ASP H 1 101 LEU QD 4.480 . 4.700 4.619 4.471 4.731 0.031 3 0 "[ . 1 . 2]" 1
2080 1 98 ASP HA 1 101 LEU QD 4.860 . 5.100 2.968 2.655 3.151 . 0 0 "[ . 1 . 2]" 1
2081 1 99 ALA HA 1 102 ARG QD 4.020 . 4.220 2.941 1.776 4.139 0.024 10 0 "[ . 1 . 2]" 1
2082 1 99 ALA MB 1 102 ARG QD 5.340 . 5.610 4.229 3.082 5.232 . 0 0 "[ . 1 . 2]" 1
2083 1 100 ALA HA 1 104 LEU QD 4.410 . 4.630 4.168 4.004 4.333 . 0 0 "[ . 1 . 2]" 1
2084 1 100 ALA MB 1 104 LEU QD 3.650 . 3.830 3.136 2.953 3.285 . 0 0 "[ . 1 . 2]" 1
2085 1 101 LEU H 1 101 LEU QD 3.240 . 3.400 2.881 2.701 2.960 . 0 0 "[ . 1 . 2]" 1
2086 1 101 LEU H 1 104 LEU QD 4.430 . 4.650 4.046 3.883 4.249 . 0 0 "[ . 1 . 2]" 1
2087 1 101 LEU HA 1 101 LEU QD 2.940 . 3.090 2.049 1.989 2.160 . 0 0 "[ . 1 . 2]" 1
2088 1 101 LEU HA 1 104 LEU QB 4.250 . 4.460 2.783 2.550 3.026 . 0 0 "[ . 1 . 2]" 1
2089 1 101 LEU HA 1 104 LEU QD 3.170 . 3.330 2.129 2.022 2.282 . 0 0 "[ . 1 . 2]" 1
2090 1 101 LEU HB2 1 104 LEU QD 5.330 . 5.600 4.615 4.494 4.767 . 0 0 "[ . 1 . 2]" 1
2091 1 101 LEU HB3 1 104 LEU QD 4.350 . 4.570 3.822 3.660 4.070 . 0 0 "[ . 1 . 2]" 1
2092 1 101 LEU HG 1 104 LEU QD 4.620 . 4.850 4.161 3.947 4.360 . 0 0 "[ . 1 . 2]" 1
2093 1 101 LEU QD 1 102 ARG H 4.310 . 4.530 4.060 4.015 4.109 . 0 0 "[ . 1 . 2]" 1
2094 1 101 LEU QD 1 104 LEU QD 3.430 . 3.600 2.116 1.879 2.343 . 0 0 "[ . 1 . 2]" 1
2095 1 101 LEU QD 1 105 ILE H 5.440 . 5.710 4.812 4.672 4.974 . 0 0 "[ . 1 . 2]" 1
2096 1 102 ARG H 1 102 ARG QD 3.590 . 3.770 3.096 1.964 3.634 . 0 0 "[ . 1 . 2]" 1
2097 1 102 ARG QD 1 103 VAL H 5.130 . 5.390 4.675 4.180 4.981 . 0 0 "[ . 1 . 2]" 1
2098 1 103 VAL H 1 104 LEU QD 4.400 . 4.620 4.451 4.357 4.511 . 0 0 "[ . 1 . 2]" 1
2099 1 103 VAL HB 1 104 LEU QB 5.340 . 5.610 4.568 4.458 4.649 . 0 0 "[ . 1 . 2]" 1
2100 1 103 VAL HB 1 104 LEU QD 3.980 . 4.180 3.174 3.115 3.230 . 0 0 "[ . 1 . 2]" 1
2101 1 103 VAL MG1 1 104 LEU QD 3.390 . 3.560 3.036 2.837 3.223 . 0 0 "[ . 1 . 2]" 1
2102 1 103 VAL MG2 1 104 LEU QD 3.920 . 4.120 4.206 4.171 4.252 0.132 3 0 "[ . 1 . 2]" 1
2103 1 104 LEU H 1 104 LEU QD 3.150 . 3.310 2.765 2.675 2.847 . 0 0 "[ . 1 . 2]" 1
2104 1 104 LEU HA 1 104 LEU QD 2.760 . 2.900 2.158 2.110 2.228 . 0 0 "[ . 1 . 2]" 1
2105 1 104 LEU QB 1 104 LEU QD 2.480 . 2.600 1.944 1.932 1.949 . 0 0 "[ . 1 . 2]" 1
2106 1 104 LEU QB 1 105 ILE H 3.950 . 4.150 2.281 2.141 2.363 . 0 0 "[ . 1 . 2]" 1
2107 1 104 LEU QB 1 107 GLU H 5.340 . 5.610 4.894 4.739 5.035 . 0 0 "[ . 1 . 2]" 1
2108 1 104 LEU QD 1 105 ILE H 3.840 . 4.030 3.835 3.743 3.886 . 0 0 "[ . 1 . 2]" 1
2109 1 104 LEU QD 1 105 ILE MD 4.860 . 5.100 4.704 4.560 4.789 . 0 0 "[ . 1 . 2]" 1
2110 1 104 LEU QD 1 107 GLU H 5.170 . 5.430 5.013 4.899 5.104 . 0 0 "[ . 1 . 2]" 1
2111 1 104 LEU QD 1 107 GLU QB 4.180 . 4.390 3.948 3.694 4.169 . 0 0 "[ . 1 . 2]" 1
2112 1 104 LEU QD 1 107 GLU QG 4.870 . 5.110 4.295 3.233 4.973 . 0 0 "[ . 1 . 2]" 1
2113 1 113 ARG H 1 113 ARG QB 3.140 . 3.300 2.749 2.353 3.238 . 0 0 "[ . 1 . 2]" 1
2114 1 113 ARG QB 1 113 ARG QG 2.210 . 2.320 2.034 1.974 2.087 . 0 0 "[ . 1 . 2]" 1
2115 1 113 ARG QB 1 113 ARG QD 3.190 . 3.350 2.385 2.092 2.906 . 0 0 "[ . 1 . 2]" 1
2116 1 60 ASP O 1 71 VAL N 2.900 2.400 3.600 2.696 2.610 2.815 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 97
_Distance_constraint_stats_list.Viol_count 94
_Distance_constraint_stats_list.Viol_total 38.564
_Distance_constraint_stats_list.Viol_max 0.078
_Distance_constraint_stats_list.Viol_rms 0.0055
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0010
_Distance_constraint_stats_list.Viol_average_violations_only 0.0205
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 28 ILE 0.090 0.047 19 0 "[ . 1 . 2]"
1 29 GLY 0.108 0.058 6 0 "[ . 1 . 2]"
1 30 GLU 0.165 0.052 16 0 "[ . 1 . 2]"
1 31 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 VAL 0.570 0.078 18 0 "[ . 1 . 2]"
1 33 ARG 0.134 0.058 6 0 "[ . 1 . 2]"
1 34 TYR 0.339 0.052 16 0 "[ . 1 . 2]"
1 35 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 ASN 0.480 0.078 18 0 "[ . 1 . 2]"
1 37 THR 0.026 0.021 13 0 "[ . 1 . 2]"
1 38 ASN 0.214 0.032 14 0 "[ . 1 . 2]"
1 39 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLY 0.040 0.016 7 0 "[ . 1 . 2]"
1 43 LEU 0.002 0.002 14 0 "[ . 1 . 2]"
1 44 LEU 0.016 0.016 19 0 "[ . 1 . 2]"
1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 TYR 0.017 0.017 13 0 "[ . 1 . 2]"
1 47 ALA 0.002 0.002 14 0 "[ . 1 . 2]"
1 48 ARG 0.016 0.016 19 0 "[ . 1 . 2]"
1 49 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 HIS 0.017 0.017 13 0 "[ . 1 . 2]"
1 51 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 LYS 0.157 0.040 8 0 "[ . 1 . 2]"
1 59 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ASP 0.413 0.054 3 0 "[ . 1 . 2]"
1 70 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 VAL 0.413 0.054 3 0 "[ . 1 . 2]"
1 72 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 GLN 0.157 0.040 8 0 "[ . 1 . 2]"
1 74 ALA 0.055 0.019 9 0 "[ . 1 . 2]"
1 75 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 PRO 0.055 0.019 9 0 "[ . 1 . 2]"
1 84 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LYS 0.028 0.014 20 0 "[ . 1 . 2]"
1 90 LYS 0.059 0.031 7 0 "[ . 1 . 2]"
1 91 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LYS 0.028 0.014 20 0 "[ . 1 . 2]"
1 94 GLN 0.059 0.031 7 0 "[ . 1 . 2]"
1 95 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 ASP 0.054 0.054 9 0 "[ . 1 . 2]"
1 99 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ARG 0.054 0.054 9 0 "[ . 1 . 2]"
1 103 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 LEU 0.045 0.042 2 0 "[ . 1 . 2]"
1 105 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 ASN 0.045 0.042 2 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 60 ASP O 1 71 VAL H 1.900 . 2.500 1.753 1.666 1.877 . 0 0 "[ . 1 . 2]" 2
2 1 60 ASP N 1 71 VAL O 2.900 2.400 3.600 3.451 3.298 3.511 . 0 0 "[ . 1 . 2]" 2
3 1 60 ASP H 1 71 VAL O 1.900 . 2.500 2.506 2.351 2.554 0.054 3 0 "[ . 1 . 2]" 2
4 1 59 VAL N 1 71 VAL O 2.900 2.400 3.600 2.768 2.653 3.055 . 0 0 "[ . 1 . 2]" 2
5 1 59 VAL H 1 71 VAL O 1.900 . 2.500 1.874 1.721 2.141 . 0 0 "[ . 1 . 2]" 2
6 1 57 LYS O 1 73 GLN N 2.900 2.400 3.600 3.180 2.890 3.394 . 0 0 "[ . 1 . 2]" 2
7 1 57 LYS O 1 73 GLN H 1.900 . 2.500 2.212 1.922 2.417 . 0 0 "[ . 1 . 2]" 2
8 1 57 LYS N 1 73 GLN O 2.900 2.400 3.600 3.359 2.995 3.503 . 0 0 "[ . 1 . 2]" 2
9 1 57 LYS H 1 73 GLN O 1.900 . 2.500 2.393 2.012 2.540 0.040 8 0 "[ . 1 . 2]" 2
10 1 55 GLU O 1 75 LYS N 2.900 2.400 3.600 2.744 2.659 2.864 . 0 0 "[ . 1 . 2]" 2
11 1 55 GLU O 1 75 LYS H 1.900 . 2.500 1.796 1.721 1.920 . 0 0 "[ . 1 . 2]" 2
12 1 55 GLU N 1 75 LYS O 2.900 2.400 3.600 2.776 2.648 2.914 . 0 0 "[ . 1 . 2]" 2
13 1 55 GLU H 1 75 LYS O 1.900 . 2.500 1.875 1.721 2.053 . 0 0 "[ . 1 . 2]" 2
14 1 70 PHE O 1 86 ALA N 2.900 2.400 3.600 2.950 2.785 3.199 . 0 0 "[ . 1 . 2]" 2
15 1 70 PHE O 1 86 ALA H 1.900 . 2.500 2.026 1.827 2.321 . 0 0 "[ . 1 . 2]" 2
16 1 70 PHE N 1 86 ALA O 2.900 2.400 3.600 2.727 2.649 2.990 . 0 0 "[ . 1 . 2]" 2
17 1 70 PHE H 1 86 ALA O 1.900 . 2.500 1.784 1.672 2.019 . 0 0 "[ . 1 . 2]" 2
18 1 72 TYR O 1 84 VAL N 2.900 2.400 3.600 2.864 2.779 3.045 . 0 0 "[ . 1 . 2]" 2
19 1 72 TYR O 1 84 VAL H 1.900 . 2.500 1.913 1.810 2.088 . 0 0 "[ . 1 . 2]" 2
20 1 72 TYR N 1 84 VAL O 2.900 2.400 3.600 2.800 2.687 2.955 . 0 0 "[ . 1 . 2]" 2
21 1 72 TYR H 1 84 VAL O 1.900 . 2.500 1.947 1.766 2.162 . 0 0 "[ . 1 . 2]" 2
22 1 74 ALA N 1 82 PRO O 2.900 2.400 3.600 3.199 2.972 3.390 . 0 0 "[ . 1 . 2]" 2
23 1 74 ALA H 1 82 PRO O 1.900 . 2.500 2.302 2.030 2.519 0.019 9 0 "[ . 1 . 2]" 2
24 1 74 ALA O 1 81 PHE N 2.900 2.400 3.600 2.772 2.666 2.837 . 0 0 "[ . 1 . 2]" 2
25 1 74 ALA O 1 81 PHE H 1.900 . 2.500 1.836 1.726 1.916 . 0 0 "[ . 1 . 2]" 2
26 1 76 VAL N 1 79 ARG O 2.900 2.400 3.600 2.816 2.665 3.001 . 0 0 "[ . 1 . 2]" 2
27 1 76 VAL H 1 79 ARG O 1.900 . 2.500 1.918 1.700 2.171 . 0 0 "[ . 1 . 2]" 2
28 1 76 VAL O 1 79 ARG N 2.900 2.400 3.600 3.097 2.975 3.337 . 0 0 "[ . 1 . 2]" 2
29 1 76 VAL O 1 79 ARG H 1.900 . 2.500 2.180 2.024 2.489 . 0 0 "[ . 1 . 2]" 2
30 1 28 ILE O 1 32 VAL N 2.900 2.400 3.600 3.251 3.038 3.429 . 0 0 "[ . 1 . 2]" 2
31 1 28 ILE O 1 32 VAL H 1.900 . 2.500 2.366 2.097 2.547 0.047 19 0 "[ . 1 . 2]" 2
32 1 29 GLY O 1 33 ARG N 2.900 2.400 3.600 3.182 2.891 3.424 . 0 0 "[ . 1 . 2]" 2
33 1 29 GLY O 1 33 ARG H 1.900 . 2.500 2.329 1.975 2.558 0.058 6 0 "[ . 1 . 2]" 2
34 1 30 GLU O 1 34 TYR N 2.900 2.400 3.600 3.232 2.960 3.379 . 0 0 "[ . 1 . 2]" 2
35 1 30 GLU O 1 34 TYR H 1.900 . 2.500 2.413 2.109 2.552 0.052 16 0 "[ . 1 . 2]" 2
36 1 31 LEU O 1 35 LEU N 2.900 2.400 3.600 3.173 2.967 3.375 . 0 0 "[ . 1 . 2]" 2
37 1 31 LEU O 1 35 LEU H 1.900 . 2.500 2.333 2.096 2.499 . 0 0 "[ . 1 . 2]" 2
38 1 32 VAL O 1 36 ASN N 2.900 2.400 3.600 3.346 3.216 3.446 . 0 0 "[ . 1 . 2]" 2
39 1 32 VAL O 1 36 ASN H 1.900 . 2.500 2.521 2.459 2.578 0.078 18 0 "[ . 1 . 2]" 2
40 1 33 ARG O 1 37 THR N 2.900 2.400 3.600 2.944 2.757 3.264 . 0 0 "[ . 1 . 2]" 2
41 1 33 ARG O 1 37 THR H 1.900 . 2.500 2.152 1.850 2.521 0.021 13 0 "[ . 1 . 2]" 2
42 1 34 TYR O 1 38 ASN N 2.900 2.400 3.600 2.801 2.744 2.887 . 0 0 "[ . 1 . 2]" 2
43 1 34 TYR O 1 38 ASN H 1.900 . 2.500 2.470 2.311 2.532 0.032 14 0 "[ . 1 . 2]" 2
44 1 38 ASN O 1 42 GLY N 2.900 2.400 3.600 3.267 3.121 3.441 . 0 0 "[ . 1 . 2]" 2
45 1 38 ASN O 1 42 GLY H 1.900 . 2.500 2.382 2.228 2.516 0.016 7 0 "[ . 1 . 2]" 2
46 1 39 PRO O 1 43 LEU N 2.900 2.400 3.600 2.918 2.794 3.035 . 0 0 "[ . 1 . 2]" 2
47 1 39 PRO O 1 43 LEU H 1.900 . 2.500 1.977 1.875 2.095 . 0 0 "[ . 1 . 2]" 2
48 1 40 VAL O 1 44 LEU N 2.900 2.400 3.600 3.052 2.947 3.303 . 0 0 "[ . 1 . 2]" 2
49 1 40 VAL O 1 44 LEU H 1.900 . 2.500 2.101 1.995 2.390 . 0 0 "[ . 1 . 2]" 2
50 1 41 GLY O 1 45 GLU N 2.900 2.400 3.600 2.933 2.763 3.231 . 0 0 "[ . 1 . 2]" 2
51 1 41 GLY O 1 45 GLU H 1.900 . 2.500 2.071 1.900 2.329 . 0 0 "[ . 1 . 2]" 2
52 1 42 GLY O 1 46 TYR N 2.900 2.400 3.600 2.790 2.737 2.860 . 0 0 "[ . 1 . 2]" 2
53 1 42 GLY O 1 46 TYR H 1.900 . 2.500 1.848 1.790 1.961 . 0 0 "[ . 1 . 2]" 2
54 1 43 LEU O 1 47 ALA N 2.900 2.400 3.600 3.186 2.994 3.408 . 0 0 "[ . 1 . 2]" 2
55 1 43 LEU O 1 47 ALA H 1.900 . 2.500 2.247 2.033 2.502 0.002 14 0 "[ . 1 . 2]" 2
56 1 44 LEU O 1 48 ARG N 2.900 2.400 3.600 3.014 2.808 3.480 . 0 0 "[ . 1 . 2]" 2
57 1 44 LEU O 1 48 ARG H 1.900 . 2.500 2.065 1.846 2.516 0.016 19 0 "[ . 1 . 2]" 2
58 1 45 GLU O 1 49 SER N 2.900 2.400 3.600 2.921 2.763 3.099 . 0 0 "[ . 1 . 2]" 2
59 1 45 GLU O 1 49 SER H 1.900 . 2.500 2.016 1.797 2.189 . 0 0 "[ . 1 . 2]" 2
60 1 46 TYR O 1 50 HIS N 2.900 2.400 3.600 3.012 2.941 3.110 . 0 0 "[ . 1 . 2]" 2
61 1 46 TYR O 1 50 HIS H 1.900 . 2.500 2.252 2.140 2.517 0.017 13 0 "[ . 1 . 2]" 2
62 1 47 ALA O 1 51 GLY N 2.900 2.400 3.600 2.791 2.687 2.884 . 0 0 "[ . 1 . 2]" 2
63 1 47 ALA O 1 51 GLY H 1.900 . 2.500 2.105 1.802 2.305 . 0 0 "[ . 1 . 2]" 2
64 1 88 SER O 1 92 GLY N 2.900 2.400 3.600 2.895 2.764 3.143 . 0 0 "[ . 1 . 2]" 2
65 1 88 SER O 1 92 GLY H 1.900 . 2.500 1.993 1.838 2.282 . 0 0 "[ . 1 . 2]" 2
66 1 89 LYS O 1 93 LYS N 2.900 2.400 3.600 3.196 2.849 3.445 . 0 0 "[ . 1 . 2]" 2
67 1 89 LYS O 1 93 LYS H 1.900 . 2.500 2.254 1.873 2.514 0.014 20 0 "[ . 1 . 2]" 2
68 1 90 LYS O 1 94 GLN N 2.900 2.400 3.600 3.124 2.744 3.480 . 0 0 "[ . 1 . 2]" 2
69 1 90 LYS O 1 94 GLN H 1.900 . 2.500 2.185 1.802 2.531 0.031 7 0 "[ . 1 . 2]" 2
70 1 91 GLN O 1 95 GLU N 2.900 2.400 3.600 2.691 2.626 2.782 . 0 0 "[ . 1 . 2]" 2
71 1 91 GLN O 1 95 GLU H 1.900 . 2.500 1.718 1.643 1.805 . 0 0 "[ . 1 . 2]" 2
72 1 92 GLY O 1 96 ALA N 2.900 2.400 3.600 2.992 2.828 3.159 . 0 0 "[ . 1 . 2]" 2
73 1 92 GLY O 1 96 ALA H 1.900 . 2.500 2.077 1.886 2.309 . 0 0 "[ . 1 . 2]" 2
74 1 93 LYS O 1 97 ALA N 2.900 2.400 3.600 3.000 2.851 3.256 . 0 0 "[ . 1 . 2]" 2
75 1 93 LYS O 1 97 ALA H 1.900 . 2.500 2.048 1.915 2.319 . 0 0 "[ . 1 . 2]" 2
76 1 94 GLN O 1 98 ASP N 2.900 2.400 3.600 2.747 2.647 2.847 . 0 0 "[ . 1 . 2]" 2
77 1 94 GLN O 1 98 ASP H 1.900 . 2.500 1.805 1.709 1.885 . 0 0 "[ . 1 . 2]" 2
78 1 95 GLU O 1 99 ALA N 2.900 2.400 3.600 2.908 2.785 3.130 . 0 0 "[ . 1 . 2]" 2
79 1 95 GLU O 1 99 ALA H 1.900 . 2.500 1.939 1.808 2.165 . 0 0 "[ . 1 . 2]" 2
80 1 96 ALA O 1 100 ALA N 2.900 2.400 3.600 2.808 2.692 2.904 . 0 0 "[ . 1 . 2]" 2
81 1 96 ALA O 1 100 ALA H 1.900 . 2.500 1.928 1.798 2.022 . 0 0 "[ . 1 . 2]" 2
82 1 97 ALA O 1 101 LEU N 2.900 2.400 3.600 2.936 2.805 3.061 . 0 0 "[ . 1 . 2]" 2
83 1 97 ALA O 1 101 LEU H 1.900 . 2.500 2.003 1.843 2.151 . 0 0 "[ . 1 . 2]" 2
84 1 98 ASP O 1 102 ARG N 2.900 2.400 3.600 3.166 2.972 3.497 . 0 0 "[ . 1 . 2]" 2
85 1 98 ASP O 1 102 ARG H 1.900 . 2.500 2.235 2.054 2.554 0.054 9 0 "[ . 1 . 2]" 2
86 1 99 ALA O 1 103 VAL N 2.900 2.400 3.600 2.994 2.823 3.258 . 0 0 "[ . 1 . 2]" 2
87 1 99 ALA O 1 103 VAL H 1.900 . 2.500 2.112 1.933 2.380 . 0 0 "[ . 1 . 2]" 2
88 1 100 ALA O 1 104 LEU N 2.900 2.400 3.600 3.002 2.856 3.166 . 0 0 "[ . 1 . 2]" 2
89 1 100 ALA O 1 104 LEU H 1.900 . 2.500 2.046 1.881 2.237 . 0 0 "[ . 1 . 2]" 2
90 1 101 LEU O 1 105 ILE N 2.900 2.400 3.600 2.748 2.675 2.810 . 0 0 "[ . 1 . 2]" 2
91 1 101 LEU O 1 105 ILE H 1.900 . 2.500 1.769 1.691 1.830 . 0 0 "[ . 1 . 2]" 2
92 1 102 ARG O 1 106 GLY N 2.900 2.400 3.600 2.832 2.696 3.053 . 0 0 "[ . 1 . 2]" 2
93 1 102 ARG O 1 106 GLY H 1.900 . 2.500 1.914 1.777 2.110 . 0 0 "[ . 1 . 2]" 2
94 1 103 VAL O 1 107 GLU N 2.900 2.400 3.600 2.791 2.662 3.077 . 0 0 "[ . 1 . 2]" 2
95 1 103 VAL O 1 107 GLU H 1.900 . 2.500 1.899 1.730 2.325 . 0 0 "[ . 1 . 2]" 2
96 1 104 LEU O 1 108 ASN N 2.900 2.400 3.600 3.059 2.818 3.374 . 0 0 "[ . 1 . 2]" 2
97 1 104 LEU O 1 108 ASN H 1.900 . 2.500 2.162 1.864 2.542 0.042 2 0 "[ . 1 . 2]" 2
stop_
save_
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