NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
488530 |
2rqr   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rqr
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 1980
_Distance_constraint_stats_list.Viol_count 807
_Distance_constraint_stats_list.Viol_total 273.288
_Distance_constraint_stats_list.Viol_max 0.288
_Distance_constraint_stats_list.Viol_rms 0.0052
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0169
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 LEU 0.036 0.029 3 0 "[ . 1 . 2]"
1 10 LEU 1.686 0.264 18 0 "[ . 1 . 2]"
1 11 ASP 3.052 0.234 20 0 "[ . 1 . 2]"
1 12 LEU 2.598 0.288 14 0 "[ . 1 . 2]"
1 13 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ILE 0.391 0.127 9 0 "[ . 1 . 2]"
1 16 GLN 0.048 0.039 6 0 "[ . 1 . 2]"
1 17 ILE 0.041 0.015 9 0 "[ . 1 . 2]"
1 18 PRO 0.003 0.003 6 0 "[ . 1 . 2]"
1 19 ASP 0.007 0.007 3 0 "[ . 1 . 2]"
1 20 ALA 0.009 0.007 2 0 "[ . 1 . 2]"
1 21 PRO 0.008 0.007 2 0 "[ . 1 . 2]"
1 22 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 PRO 0.062 0.053 7 0 "[ . 1 . 2]"
1 24 ILE 0.234 0.141 7 0 "[ . 1 . 2]"
1 25 PRO 0.280 0.141 7 0 "[ . 1 . 2]"
1 26 LYS 0.632 0.094 16 0 "[ . 1 . 2]"
1 27 GLU 0.263 0.055 19 0 "[ . 1 . 2]"
1 28 PRO 0.005 0.004 17 0 "[ . 1 . 2]"
1 29 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ASN 0.010 0.006 16 0 "[ . 1 . 2]"
1 31 TYR 0.253 0.069 18 0 "[ . 1 . 2]"
1 32 ASP 0.136 0.069 18 0 "[ . 1 . 2]"
1 33 PHE 0.119 0.022 15 0 "[ . 1 . 2]"
1 34 SER 0.086 0.022 15 0 "[ . 1 . 2]"
1 35 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 GLY 0.013 0.013 19 0 "[ . 1 . 2]"
1 40 ILE 0.423 0.140 5 0 "[ . 1 . 2]"
1 41 GLU 0.350 0.140 5 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ARG 0.285 0.124 8 0 "[ . 1 . 2]"
1 56 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LYS 0.081 0.027 12 0 "[ . 1 . 2]"
1 59 GLU 0.016 0.006 10 0 "[ . 1 . 2]"
1 60 ARG 0.038 0.008 5 0 "[ . 1 . 2]"
1 61 HIS 0.224 0.033 17 0 "[ . 1 . 2]"
1 62 GLY 0.040 0.010 17 0 "[ . 1 . 2]"
1 63 VAL 0.396 0.021 14 0 "[ . 1 . 2]"
1 64 ALA 0.078 0.010 18 0 "[ . 1 . 2]"
1 65 ILE 0.063 0.012 6 0 "[ . 1 . 2]"
1 66 TYR 0.005 0.002 17 0 "[ . 1 . 2]"
1 67 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 PHE 0.043 0.014 17 0 "[ . 1 . 2]"
1 69 GLN 0.015 0.005 15 0 "[ . 1 . 2]"
1 70 GLY 0.027 0.010 5 0 "[ . 1 . 2]"
1 71 SER 0.125 0.024 13 0 "[ . 1 . 2]"
1 72 GLY 0.039 0.014 14 0 "[ . 1 . 2]"
1 73 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 PRO 0.123 0.022 14 0 "[ . 1 . 2]"
1 75 GLN 0.243 0.024 13 0 "[ . 1 . 2]"
1 76 LEU 0.115 0.015 17 0 "[ . 1 . 2]"
1 77 SER 0.013 0.005 15 0 "[ . 1 . 2]"
1 78 LEU 0.059 0.020 17 0 "[ . 1 . 2]"
1 79 GLN 0.064 0.026 18 0 "[ . 1 . 2]"
1 80 ILE 0.136 0.026 18 0 "[ . 1 . 2]"
1 81 GLY 0.019 0.009 19 0 "[ . 1 . 2]"
1 82 ASP 0.415 0.067 18 0 "[ . 1 . 2]"
1 83 VAL 0.596 0.071 17 0 "[ . 1 . 2]"
1 84 VAL 0.592 0.071 17 0 "[ . 1 . 2]"
1 85 ARG 0.240 0.067 9 0 "[ . 1 . 2]"
1 86 ILE 0.132 0.015 13 0 "[ . 1 . 2]"
1 87 GLN 0.077 0.009 6 0 "[ . 1 . 2]"
1 88 GLU 0.311 0.030 11 0 "[ . 1 . 2]"
1 89 THR 0.074 0.026 11 0 "[ . 1 . 2]"
1 90 CYS 0.006 0.006 18 0 "[ . 1 . 2]"
1 91 GLY 0.001 0.001 14 0 "[ . 1 . 2]"
1 92 ASP 0.028 0.009 2 0 "[ . 1 . 2]"
1 93 TRP 0.190 0.035 13 0 "[ . 1 . 2]"
1 94 TYR 0.241 0.032 17 0 "[ . 1 . 2]"
1 95 ARG 0.542 0.055 13 0 "[ . 1 . 2]"
1 96 GLY 0.197 0.055 13 0 "[ . 1 . 2]"
1 97 TYR 0.751 0.051 17 0 "[ . 1 . 2]"
1 98 LEU 0.319 0.153 15 0 "[ . 1 . 2]"
1 99 ILE 0.577 0.067 9 0 "[ . 1 . 2]"
1 100 LYS 0.545 0.165 20 0 "[ . 1 . 2]"
1 101 HIS 0.063 0.049 16 0 "[ . 1 . 2]"
1 102 LYS 0.545 0.110 16 0 "[ . 1 . 2]"
1 103 MET 0.923 0.119 16 0 "[ . 1 . 2]"
1 104 LEU 0.494 0.118 16 0 "[ . 1 . 2]"
1 105 GLN 0.092 0.044 16 0 "[ . 1 . 2]"
1 106 GLY 0.080 0.022 17 0 "[ . 1 . 2]"
1 107 ILE 0.342 0.036 15 0 "[ . 1 . 2]"
1 108 PHE 0.150 0.049 13 0 "[ . 1 . 2]"
1 109 PRO 0.017 0.005 13 0 "[ . 1 . 2]"
1 110 LYS 0.065 0.022 17 0 "[ . 1 . 2]"
1 111 SER 0.009 0.009 17 0 "[ . 1 . 2]"
1 112 PHE 0.032 0.013 13 0 "[ . 1 . 2]"
1 113 ILE 0.039 0.018 17 0 "[ . 1 . 2]"
1 114 HIS 0.052 0.007 5 0 "[ . 1 . 2]"
1 115 ILE 0.093 0.014 4 0 "[ . 1 . 2]"
1 116 LYS 0.361 0.060 4 0 "[ . 1 . 2]"
1 117 GLU 0.228 0.043 1 0 "[ . 1 . 2]"
1 118 VAL 0.146 0.043 1 0 "[ . 1 . 2]"
1 119 THR 0.181 0.103 11 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 7 GLY QA 1 8 ARG QG . . 4.310 3.782 3.373 4.261 . 0 0 "[ . 1 . 2]" 1
2 1 8 ARG H 1 8 ARG QB . . 3.650 2.704 2.233 3.334 . 0 0 "[ . 1 . 2]" 1
3 1 8 ARG H 1 8 ARG QG . . 3.620 2.865 1.976 3.534 . 0 0 "[ . 1 . 2]" 1
4 1 8 ARG HA 1 8 ARG QG . . 3.520 2.812 2.261 3.422 . 0 0 "[ . 1 . 2]" 1
5 1 8 ARG HA 1 9 LEU H . . 3.170 2.497 2.140 3.146 . 0 0 "[ . 1 . 2]" 1
6 1 8 ARG QB 1 8 ARG QD . . 3.290 2.231 2.113 2.544 . 0 0 "[ . 1 . 2]" 1
7 1 8 ARG QB 1 8 ARG QG . . 2.340 2.063 2.011 2.087 . 0 0 "[ . 1 . 2]" 1
8 1 8 ARG QB 1 9 LEU H . . 4.280 3.262 1.912 4.044 . 0 0 "[ . 1 . 2]" 1
9 1 8 ARG QG 1 9 LEU H . . 4.960 3.965 3.242 4.560 . 0 0 "[ . 1 . 2]" 1
10 1 9 LEU H 1 9 LEU QB . . 3.110 2.532 2.119 3.139 0.029 3 0 "[ . 1 . 2]" 1
11 1 9 LEU H 1 9 LEU QD . . 4.520 3.321 2.062 4.004 . 0 0 "[ . 1 . 2]" 1
12 1 9 LEU H 1 10 LEU H . . 4.130 3.540 2.319 4.135 0.005 3 0 "[ . 1 . 2]" 1
13 1 9 LEU QB 1 10 LEU H . . 4.180 3.414 2.100 4.011 . 0 0 "[ . 1 . 2]" 1
14 1 10 LEU H 1 10 LEU HB2 . . 3.830 2.700 2.153 3.832 0.002 15 0 "[ . 1 . 2]" 1
15 1 10 LEU H 1 10 LEU HB3 . . 3.830 3.208 2.146 3.631 . 0 0 "[ . 1 . 2]" 1
16 1 10 LEU H 1 10 LEU MD1 . . 4.840 3.460 1.876 4.837 . 0 0 "[ . 1 . 2]" 1
17 1 10 LEU H 1 10 LEU QD . . 4.210 2.813 1.725 4.096 . 0 0 "[ . 1 . 2]" 1
18 1 10 LEU H 1 10 LEU MD2 . . 4.840 3.427 2.013 4.568 . 0 0 "[ . 1 . 2]" 1
19 1 10 LEU HA 1 10 LEU MD1 . . 3.850 2.651 1.927 4.112 0.262 12 0 "[ . 1 . 2]" 1
20 1 10 LEU HA 1 10 LEU QD . . 3.000 2.430 1.894 3.173 0.173 19 0 "[ . 1 . 2]" 1
21 1 10 LEU HA 1 10 LEU MD2 . . 3.850 3.323 2.057 4.114 0.264 18 0 "[ . 1 . 2]" 1
22 1 10 LEU HA 1 11 ASP H . . 3.190 2.480 2.142 3.424 0.234 20 0 "[ . 1 . 2]" 1
23 1 10 LEU QB 1 10 LEU QD . . 2.560 1.941 1.794 2.052 . 0 0 "[ . 1 . 2]" 1
24 1 10 LEU QB 1 11 ASP H . . 3.810 2.896 2.043 3.816 0.006 11 0 "[ . 1 . 2]" 1
25 1 10 LEU HB2 1 11 ASP H . . 4.650 3.629 2.066 4.521 . 0 0 "[ . 1 . 2]" 1
26 1 10 LEU HB3 1 11 ASP H . . 4.650 3.343 2.152 4.306 . 0 0 "[ . 1 . 2]" 1
27 1 10 LEU QD 1 11 ASP H . . 4.150 3.121 1.708 4.147 . 0 0 "[ . 1 . 2]" 1
28 1 10 LEU MD1 1 11 ASP H . . 4.810 3.584 2.124 4.695 . 0 0 "[ . 1 . 2]" 1
29 1 10 LEU MD2 1 11 ASP H . . 4.810 4.033 1.709 4.878 0.068 20 0 "[ . 1 . 2]" 1
30 1 11 ASP H 1 11 ASP QB . . 3.390 2.992 2.157 3.437 0.047 5 0 "[ . 1 . 2]" 1
31 1 11 ASP H 1 12 LEU H . . 3.700 3.344 2.094 3.764 0.064 17 0 "[ . 1 . 2]" 1
32 1 11 ASP HA 1 12 LEU H . . 3.330 2.577 2.144 3.554 0.224 15 0 "[ . 1 . 2]" 1
33 1 11 ASP HA 1 13 GLU H . . 4.680 4.145 3.374 4.678 . 0 0 "[ . 1 . 2]" 1
34 1 11 ASP QB 1 12 LEU H . . 3.520 3.302 1.898 3.500 . 0 0 "[ . 1 . 2]" 1
35 1 11 ASP HB2 1 12 LEU H . . 4.050 3.758 2.531 4.142 0.092 8 0 "[ . 1 . 2]" 1
36 1 11 ASP HB3 1 12 LEU H . . 4.050 3.817 1.907 4.130 0.080 18 0 "[ . 1 . 2]" 1
37 1 12 LEU H 1 12 LEU HB2 . . 3.650 2.529 2.183 3.523 . 0 0 "[ . 1 . 2]" 1
38 1 12 LEU H 1 12 LEU QB . . 2.860 2.359 2.105 2.861 0.001 14 0 "[ . 1 . 2]" 1
39 1 12 LEU H 1 12 LEU HB3 . . 3.650 3.304 2.124 3.656 0.006 7 0 "[ . 1 . 2]" 1
40 1 12 LEU H 1 12 LEU QD . . 4.050 3.096 1.867 3.963 . 0 0 "[ . 1 . 2]" 1
41 1 12 LEU H 1 13 GLU H . . 3.540 3.052 2.381 3.504 . 0 0 "[ . 1 . 2]" 1
42 1 12 LEU HA 1 12 LEU QD . . 2.870 2.424 1.895 3.158 0.288 14 0 "[ . 1 . 2]" 1
43 1 12 LEU QB 1 13 GLU H . . 4.150 3.401 1.999 4.003 . 0 0 "[ . 1 . 2]" 1
44 1 12 LEU QD 1 13 GLU H . . 4.880 3.770 2.822 4.520 . 0 0 "[ . 1 . 2]" 1
45 1 13 GLU H 1 13 GLU QB . . 3.090 2.421 2.168 2.984 . 0 0 "[ . 1 . 2]" 1
46 1 13 GLU H 1 13 GLU QG . . 4.250 3.083 1.923 4.203 . 0 0 "[ . 1 . 2]" 1
47 1 13 GLU HA 1 13 GLU QG . . 3.620 2.500 2.165 3.339 . 0 0 "[ . 1 . 2]" 1
48 1 13 GLU HA 1 14 ASN H . . 3.240 2.424 2.144 2.831 . 0 0 "[ . 1 . 2]" 1
49 1 13 GLU QB 1 14 ASN H . . 4.220 3.396 1.913 4.047 . 0 0 "[ . 1 . 2]" 1
50 1 13 GLU QG 1 14 ASN H . . 4.680 4.013 2.268 4.663 . 0 0 "[ . 1 . 2]" 1
51 1 14 ASN H 1 14 ASN HB2 . . 4.140 2.928 2.345 4.011 . 0 0 "[ . 1 . 2]" 1
52 1 14 ASN H 1 14 ASN QB . . 3.500 2.675 2.261 3.322 . 0 0 "[ . 1 . 2]" 1
53 1 14 ASN H 1 14 ASN HB3 . . 4.140 3.399 2.527 4.093 . 0 0 "[ . 1 . 2]" 1
54 1 14 ASN H 1 14 ASN QD . . 4.930 4.068 2.644 4.724 . 0 0 "[ . 1 . 2]" 1
55 1 14 ASN H 1 15 ILE H . . 3.910 2.885 1.987 3.905 . 0 0 "[ . 1 . 2]" 1
56 1 14 ASN QB 1 15 ILE MD . . 4.820 3.729 1.976 4.776 . 0 0 "[ . 1 . 2]" 1
57 1 14 ASN HB2 1 15 ILE H . . 4.470 3.573 2.363 4.464 . 0 0 "[ . 1 . 2]" 1
58 1 14 ASN HB3 1 15 ILE H . . 4.470 3.699 2.177 4.465 . 0 0 "[ . 1 . 2]" 1
59 1 15 ILE H 1 15 ILE HB . . 3.150 2.544 2.311 2.824 . 0 0 "[ . 1 . 2]" 1
60 1 15 ILE H 1 15 ILE MD . . 3.900 2.599 1.832 3.919 0.019 19 0 "[ . 1 . 2]" 1
61 1 15 ILE H 1 15 ILE HG12 . . 4.070 3.466 2.132 4.088 0.018 2 0 "[ . 1 . 2]" 1
62 1 15 ILE H 1 15 ILE QG . . 3.360 2.711 1.995 3.258 . 0 0 "[ . 1 . 2]" 1
63 1 15 ILE H 1 15 ILE HG13 . . 4.070 3.149 2.014 4.018 . 0 0 "[ . 1 . 2]" 1
64 1 15 ILE H 1 15 ILE MG . . 4.040 3.779 3.689 3.895 . 0 0 "[ . 1 . 2]" 1
65 1 15 ILE H 1 16 GLN H . . 4.680 4.569 4.496 4.631 . 0 0 "[ . 1 . 2]" 1
66 1 15 ILE HA 1 15 ILE MD . . 3.680 3.101 1.981 3.807 0.127 9 0 "[ . 1 . 2]" 1
67 1 15 ILE HA 1 15 ILE HG12 . . 4.010 3.234 2.336 3.621 . 0 0 "[ . 1 . 2]" 1
68 1 15 ILE HA 1 15 ILE QG . . 3.450 2.486 2.167 3.100 . 0 0 "[ . 1 . 2]" 1
69 1 15 ILE HA 1 15 ILE HG13 . . 4.010 2.808 2.189 3.890 . 0 0 "[ . 1 . 2]" 1
70 1 15 ILE HA 1 15 ILE MG . . 3.260 2.357 2.081 2.503 . 0 0 "[ . 1 . 2]" 1
71 1 15 ILE HA 1 16 GLN H . . 2.740 2.235 2.170 2.513 . 0 0 "[ . 1 . 2]" 1
72 1 15 ILE HA 1 16 GLN QB . . 4.720 4.387 4.228 4.559 . 0 0 "[ . 1 . 2]" 1
73 1 15 ILE HA 1 16 GLN QG . . 4.990 3.816 3.431 4.544 . 0 0 "[ . 1 . 2]" 1
74 1 15 ILE HB 1 15 ILE MD . . 3.430 2.492 2.092 3.231 . 0 0 "[ . 1 . 2]" 1
75 1 15 ILE HB 1 16 GLN H . . 4.100 3.933 3.034 4.101 0.001 6 0 "[ . 1 . 2]" 1
76 1 15 ILE MD 1 16 GLN H . . 4.970 4.554 3.449 4.969 . 0 0 "[ . 1 . 2]" 1
77 1 15 ILE HG12 1 15 ILE MG . . 3.380 2.409 1.990 3.202 . 0 0 "[ . 1 . 2]" 1
78 1 15 ILE HG12 1 16 GLN H . . 5.250 4.755 3.924 5.146 . 0 0 "[ . 1 . 2]" 1
79 1 15 ILE HG13 1 15 ILE MG . . 3.380 2.680 2.263 3.187 . 0 0 "[ . 1 . 2]" 1
80 1 15 ILE HG13 1 16 GLN H . . 5.250 4.566 3.884 5.229 . 0 0 "[ . 1 . 2]" 1
81 1 15 ILE MG 1 16 GLN H . . 3.630 2.064 1.795 2.424 . 0 0 "[ . 1 . 2]" 1
82 1 15 ILE MG 1 16 GLN HA . . 4.590 3.722 3.354 4.111 . 0 0 "[ . 1 . 2]" 1
83 1 15 ILE MG 1 16 GLN QB . . 4.920 3.881 3.251 4.356 . 0 0 "[ . 1 . 2]" 1
84 1 15 ILE MG 1 16 GLN QG . . 4.430 3.991 2.459 4.439 0.009 9 0 "[ . 1 . 2]" 1
85 1 15 ILE MG 1 17 ILE H . . 4.150 2.822 1.868 3.878 . 0 0 "[ . 1 . 2]" 1
86 1 15 ILE MG 1 17 ILE HB . . 4.530 3.570 1.963 4.494 . 0 0 "[ . 1 . 2]" 1
87 1 15 ILE MG 1 17 ILE QG . . 3.680 2.033 1.812 2.372 . 0 0 "[ . 1 . 2]" 1
88 1 16 GLN H 1 16 GLN QB . . 3.140 2.601 2.257 3.179 0.039 6 0 "[ . 1 . 2]" 1
89 1 16 GLN H 1 16 GLN QG . . 3.820 2.589 1.892 3.101 . 0 0 "[ . 1 . 2]" 1
90 1 16 GLN HA 1 16 GLN QG . . 3.700 2.777 2.229 3.473 . 0 0 "[ . 1 . 2]" 1
91 1 16 GLN HA 1 17 ILE H . . 3.130 2.511 2.158 2.852 . 0 0 "[ . 1 . 2]" 1
92 1 16 GLN QB 1 17 ILE H . . 4.450 3.833 3.533 4.042 . 0 0 "[ . 1 . 2]" 1
93 1 16 GLN QG 1 17 ILE H . . 4.920 4.464 3.960 4.768 . 0 0 "[ . 1 . 2]" 1
94 1 17 ILE H 1 17 ILE HB . . 3.140 2.549 2.488 2.620 . 0 0 "[ . 1 . 2]" 1
95 1 17 ILE H 1 17 ILE MD . . 4.290 3.763 3.373 4.021 . 0 0 "[ . 1 . 2]" 1
96 1 17 ILE H 1 17 ILE HG12 . . 3.870 3.758 3.358 3.885 0.015 9 0 "[ . 1 . 2]" 1
97 1 17 ILE H 1 17 ILE QG . . 3.260 2.482 1.950 2.699 . 0 0 "[ . 1 . 2]" 1
98 1 17 ILE H 1 17 ILE HG13 . . 3.870 2.520 1.962 2.753 . 0 0 "[ . 1 . 2]" 1
99 1 17 ILE H 1 17 ILE MG . . 3.890 3.800 3.763 3.842 . 0 0 "[ . 1 . 2]" 1
100 1 17 ILE H 1 18 PRO HD2 . . 4.900 4.830 4.764 4.842 . 0 0 "[ . 1 . 2]" 1
101 1 17 ILE H 1 18 PRO HD3 . . 4.960 4.872 4.824 4.918 . 0 0 "[ . 1 . 2]" 1
102 1 17 ILE HA 1 17 ILE MD . . 3.960 3.841 3.786 3.870 . 0 0 "[ . 1 . 2]" 1
103 1 17 ILE HA 1 17 ILE HG12 . . 4.070 2.563 2.469 2.661 . 0 0 "[ . 1 . 2]" 1
104 1 17 ILE HA 1 17 ILE QG . . 3.550 2.416 2.373 2.444 . 0 0 "[ . 1 . 2]" 1
105 1 17 ILE HA 1 17 ILE HG13 . . 4.070 2.967 2.827 3.088 . 0 0 "[ . 1 . 2]" 1
106 1 17 ILE HA 1 17 ILE MG . . 3.160 2.457 2.407 2.468 . 0 0 "[ . 1 . 2]" 1
107 1 17 ILE HA 1 18 PRO HD2 . . 3.160 2.168 2.140 2.178 . 0 0 "[ . 1 . 2]" 1
108 1 17 ILE HA 1 18 PRO HD3 . . 2.860 2.253 2.252 2.254 . 0 0 "[ . 1 . 2]" 1
109 1 17 ILE HA 1 18 PRO QG . . 4.280 3.867 3.852 3.872 . 0 0 "[ . 1 . 2]" 1
110 1 17 ILE HA 1 65 ILE MD . . 5.440 4.732 4.051 5.269 . 0 0 "[ . 1 . 2]" 1
111 1 17 ILE HB 1 17 ILE MD . . 3.570 2.367 2.234 2.452 . 0 0 "[ . 1 . 2]" 1
112 1 17 ILE HB 1 18 PRO HD2 . . 4.040 3.944 3.928 3.999 . 0 0 "[ . 1 . 2]" 1
113 1 17 ILE HB 1 18 PRO HD3 . . 5.020 4.882 4.872 4.911 . 0 0 "[ . 1 . 2]" 1
114 1 17 ILE MD 1 17 ILE MG . . 3.060 2.127 1.985 2.255 . 0 0 "[ . 1 . 2]" 1
115 1 17 ILE MD 1 18 PRO HD2 . . 4.730 4.309 4.131 4.419 . 0 0 "[ . 1 . 2]" 1
116 1 17 ILE MD 1 18 PRO HD3 . . 5.500 5.398 5.274 5.468 . 0 0 "[ . 1 . 2]" 1
117 1 17 ILE MD 1 65 ILE HB . . 3.780 3.386 2.658 3.779 . 0 0 "[ . 1 . 2]" 1
118 1 17 ILE QG 1 65 ILE MD . . 4.410 3.293 2.792 3.740 . 0 0 "[ . 1 . 2]" 1
119 1 17 ILE HG12 1 17 ILE MG . . 3.330 2.270 2.186 2.353 . 0 0 "[ . 1 . 2]" 1
120 1 17 ILE HG13 1 17 ILE MG . . 3.330 3.194 3.178 3.201 . 0 0 "[ . 1 . 2]" 1
121 1 17 ILE MG 1 18 PRO HD2 . . 3.500 1.826 1.812 1.876 . 0 0 "[ . 1 . 2]" 1
122 1 17 ILE MG 1 18 PRO HD3 . . 3.810 3.158 3.141 3.199 . 0 0 "[ . 1 . 2]" 1
123 1 17 ILE MG 1 18 PRO QG . . 4.020 2.865 2.845 2.940 . 0 0 "[ . 1 . 2]" 1
124 1 17 ILE MG 1 19 ASP H . . 4.880 4.829 4.687 4.887 0.007 3 0 "[ . 1 . 2]" 1
125 1 17 ILE MG 1 65 ILE HB . . 4.180 3.980 3.536 4.185 0.005 10 0 "[ . 1 . 2]" 1
126 1 17 ILE MG 1 66 TYR QD . . 4.800 4.489 3.530 4.802 0.002 17 0 "[ . 1 . 2]" 1
127 1 17 ILE MG 1 66 TYR QE . . 4.100 2.908 2.090 3.376 . 0 0 "[ . 1 . 2]" 1
128 1 18 PRO HA 1 19 ASP H . . 2.940 2.422 2.173 2.708 . 0 0 "[ . 1 . 2]" 1
129 1 18 PRO HB2 1 19 ASP H . . 3.870 2.592 1.929 3.367 . 0 0 "[ . 1 . 2]" 1
130 1 18 PRO HB2 1 19 ASP QB . . 4.970 4.362 3.871 4.967 . 0 0 "[ . 1 . 2]" 1
131 1 18 PRO HB2 1 20 ALA H . . 3.830 2.622 2.320 2.792 . 0 0 "[ . 1 . 2]" 1
132 1 18 PRO HB3 1 19 ASP H . . 4.010 3.456 3.155 3.890 . 0 0 "[ . 1 . 2]" 1
133 1 18 PRO HB3 1 20 ALA H . . 4.430 4.297 4.087 4.414 . 0 0 "[ . 1 . 2]" 1
134 1 18 PRO HD3 1 65 ILE MD . . 5.500 5.192 4.086 5.503 0.003 6 0 "[ . 1 . 2]" 1
135 1 18 PRO QG 1 19 ASP H . . 4.890 4.130 3.623 4.592 . 0 0 "[ . 1 . 2]" 1
136 1 18 PRO QG 1 66 TYR QE . . 4.310 3.391 2.994 3.801 . 0 0 "[ . 1 . 2]" 1
137 1 19 ASP H 1 19 ASP HB2 . . 3.820 2.760 2.203 3.610 . 0 0 "[ . 1 . 2]" 1
138 1 19 ASP H 1 19 ASP QB . . 3.230 2.360 2.145 2.777 . 0 0 "[ . 1 . 2]" 1
139 1 19 ASP H 1 19 ASP HB3 . . 3.820 2.930 2.355 3.601 . 0 0 "[ . 1 . 2]" 1
140 1 19 ASP H 1 20 ALA H . . 3.510 2.567 2.235 2.887 . 0 0 "[ . 1 . 2]" 1
141 1 19 ASP H 1 20 ALA MB . . 4.900 4.520 4.129 4.786 . 0 0 "[ . 1 . 2]" 1
142 1 19 ASP HA 1 20 ALA MB . . 5.010 4.710 4.393 4.861 . 0 0 "[ . 1 . 2]" 1
143 1 19 ASP QB 1 20 ALA H . . 3.520 2.859 2.504 3.411 . 0 0 "[ . 1 . 2]" 1
144 1 19 ASP QB 1 20 ALA MB . . 4.370 3.436 3.181 3.856 . 0 0 "[ . 1 . 2]" 1
145 1 19 ASP HB2 1 20 ALA H . . 4.240 3.460 2.601 4.043 . 0 0 "[ . 1 . 2]" 1
146 1 19 ASP HB3 1 20 ALA H . . 4.240 3.315 2.538 4.061 . 0 0 "[ . 1 . 2]" 1
147 1 20 ALA H 1 20 ALA MB . . 2.940 2.502 2.284 2.772 . 0 0 "[ . 1 . 2]" 1
148 1 20 ALA H 1 21 PRO HA . . 5.500 5.166 4.871 5.375 . 0 0 "[ . 1 . 2]" 1
149 1 20 ALA H 1 21 PRO QD . . 4.610 4.342 4.253 4.371 . 0 0 "[ . 1 . 2]" 1
150 1 20 ALA HA 1 21 PRO HD2 . . 2.940 2.397 2.306 2.625 . 0 0 "[ . 1 . 2]" 1
151 1 20 ALA HA 1 21 PRO HD3 . . 2.940 2.301 2.269 2.414 . 0 0 "[ . 1 . 2]" 1
152 1 20 ALA HA 1 21 PRO QG . . 4.260 4.001 3.944 4.152 . 0 0 "[ . 1 . 2]" 1
153 1 20 ALA HA 1 66 TYR QE . . 4.930 4.272 3.555 4.931 0.001 12 0 "[ . 1 . 2]" 1
154 1 20 ALA MB 1 21 PRO QB . . 5.000 4.518 4.330 4.617 . 0 0 "[ . 1 . 2]" 1
155 1 20 ALA MB 1 21 PRO HD2 . . 3.360 2.102 1.925 2.321 . 0 0 "[ . 1 . 2]" 1
156 1 20 ALA MB 1 21 PRO QD . . 2.870 2.077 1.903 2.282 . 0 0 "[ . 1 . 2]" 1
157 1 20 ALA MB 1 21 PRO HD3 . . 3.360 3.256 2.981 3.367 0.007 2 0 "[ . 1 . 2]" 1
158 1 20 ALA MB 1 21 PRO QG . . 3.790 3.572 3.351 3.725 . 0 0 "[ . 1 . 2]" 1
159 1 21 PRO HA 1 66 TYR QD . . 4.890 4.040 3.524 4.627 . 0 0 "[ . 1 . 2]" 1
160 1 21 PRO HA 1 66 TYR QE . . 4.580 3.344 2.917 3.809 . 0 0 "[ . 1 . 2]" 1
161 1 21 PRO QB 1 22 PRO QD . . 3.800 2.903 2.432 3.303 . 0 0 "[ . 1 . 2]" 1
162 1 21 PRO QB 1 66 TYR HB3 . . 4.470 3.122 2.499 3.842 . 0 0 "[ . 1 . 2]" 1
163 1 21 PRO QB 1 66 TYR QD . . 4.330 2.912 2.452 3.340 . 0 0 "[ . 1 . 2]" 1
164 1 21 PRO QB 1 66 TYR QE . . 4.290 3.302 2.570 3.749 . 0 0 "[ . 1 . 2]" 1
165 1 21 PRO QB 1 112 PHE QE . . 4.130 3.900 3.563 4.124 . 0 0 "[ . 1 . 2]" 1
166 1 21 PRO HB2 1 66 TYR QD . . 5.140 4.202 3.693 4.718 . 0 0 "[ . 1 . 2]" 1
167 1 21 PRO HB2 1 66 TYR QE . . 5.160 4.678 4.030 5.132 . 0 0 "[ . 1 . 2]" 1
168 1 21 PRO HB2 1 112 PHE QE . . 4.810 4.215 3.798 4.602 . 0 0 "[ . 1 . 2]" 1
169 1 21 PRO HB3 1 66 TYR QD . . 5.140 2.973 2.477 3.431 . 0 0 "[ . 1 . 2]" 1
170 1 21 PRO HB3 1 66 TYR QE . . 5.160 3.379 2.593 3.881 . 0 0 "[ . 1 . 2]" 1
171 1 21 PRO HB3 1 112 PHE QE . . 4.810 4.617 4.314 4.806 . 0 0 "[ . 1 . 2]" 1
172 1 21 PRO QD 1 66 TYR QD . . 5.190 3.889 3.131 4.374 . 0 0 "[ . 1 . 2]" 1
173 1 21 PRO QD 1 66 TYR QE . . 4.920 3.215 2.263 4.072 . 0 0 "[ . 1 . 2]" 1
174 1 21 PRO QG 1 66 TYR QD . . 4.340 3.716 2.705 4.263 . 0 0 "[ . 1 . 2]" 1
175 1 21 PRO QG 1 66 TYR QE . . 5.040 4.175 3.066 4.973 . 0 0 "[ . 1 . 2]" 1
176 1 22 PRO HA 1 23 PRO HD2 . . 3.180 2.491 2.329 2.571 . 0 0 "[ . 1 . 2]" 1
177 1 22 PRO HA 1 23 PRO HD3 . . 3.180 2.348 2.283 2.387 . 0 0 "[ . 1 . 2]" 1
178 1 22 PRO HA 1 23 PRO QG . . 4.190 4.065 3.962 4.118 . 0 0 "[ . 1 . 2]" 1
179 1 22 PRO QB 1 23 PRO QD . . 3.100 2.076 1.929 2.366 . 0 0 "[ . 1 . 2]" 1
180 1 22 PRO HB2 1 23 PRO HD2 . . 4.150 2.176 1.997 2.540 . 0 0 "[ . 1 . 2]" 1
181 1 22 PRO HB2 1 23 PRO HD3 . . 4.150 3.596 3.447 3.894 . 0 0 "[ . 1 . 2]" 1
182 1 22 PRO HB3 1 23 PRO HD2 . . 4.150 2.775 2.687 2.967 . 0 0 "[ . 1 . 2]" 1
183 1 22 PRO HB3 1 23 PRO HD3 . . 4.150 3.829 3.727 4.038 . 0 0 "[ . 1 . 2]" 1
184 1 23 PRO HA 1 24 ILE H . . 2.940 2.189 2.153 2.544 . 0 0 "[ . 1 . 2]" 1
185 1 23 PRO HA 1 24 ILE MD . . 5.250 4.849 2.695 5.206 . 0 0 "[ . 1 . 2]" 1
186 1 23 PRO HA 1 24 ILE HG13 . . 4.120 3.895 3.781 4.173 0.053 7 0 "[ . 1 . 2]" 1
187 1 23 PRO HA 1 24 ILE MG . . 5.500 5.475 5.448 5.498 . 0 0 "[ . 1 . 2]" 1
188 1 23 PRO QB 1 24 ILE H . . 3.680 3.471 2.236 3.659 . 0 0 "[ . 1 . 2]" 1
189 1 23 PRO HB2 1 24 ILE H . . 4.300 3.732 2.275 3.959 . 0 0 "[ . 1 . 2]" 1
190 1 23 PRO HB3 1 24 ILE H . . 4.300 4.150 3.293 4.306 0.006 5 0 "[ . 1 . 2]" 1
191 1 23 PRO QG 1 24 ILE H . . 5.500 4.691 3.920 4.754 . 0 0 "[ . 1 . 2]" 1
192 1 24 ILE H 1 24 ILE HB . . 3.530 2.635 2.500 2.710 . 0 0 "[ . 1 . 2]" 1
193 1 24 ILE H 1 24 ILE MD . . 3.930 3.338 1.902 3.627 . 0 0 "[ . 1 . 2]" 1
194 1 24 ILE H 1 24 ILE HG12 . . 4.160 3.389 3.215 4.176 0.016 7 0 "[ . 1 . 2]" 1
195 1 24 ILE H 1 24 ILE HG13 . . 3.690 2.041 1.894 3.389 . 0 0 "[ . 1 . 2]" 1
196 1 24 ILE H 1 24 ILE MG . . 4.040 3.778 3.762 3.839 . 0 0 "[ . 1 . 2]" 1
197 1 24 ILE HA 1 24 ILE MD . . 4.070 3.830 3.336 3.878 . 0 0 "[ . 1 . 2]" 1
198 1 24 ILE HA 1 24 ILE HG12 . . 4.100 2.660 2.467 3.568 . 0 0 "[ . 1 . 2]" 1
199 1 24 ILE HA 1 24 ILE HG13 . . 3.980 2.858 2.395 3.014 . 0 0 "[ . 1 . 2]" 1
200 1 24 ILE HA 1 24 ILE MG . . 3.410 2.460 2.419 2.475 . 0 0 "[ . 1 . 2]" 1
201 1 24 ILE HA 1 25 PRO HD2 . . 3.390 2.158 2.072 2.179 . 0 0 "[ . 1 . 2]" 1
202 1 24 ILE HA 1 25 PRO HD3 . . 3.230 2.254 2.252 2.267 . 0 0 "[ . 1 . 2]" 1
203 1 24 ILE HA 1 112 PHE QE . . 4.300 3.214 2.757 3.623 . 0 0 "[ . 1 . 2]" 1
204 1 24 ILE HB 1 24 ILE MD . . 3.110 2.320 2.179 2.464 . 0 0 "[ . 1 . 2]" 1
205 1 24 ILE HB 1 68 PHE QE . . 5.480 4.724 4.258 5.358 . 0 0 "[ . 1 . 2]" 1
206 1 24 ILE HB 1 93 TRP HZ2 . . 5.500 5.102 4.447 5.503 0.003 15 0 "[ . 1 . 2]" 1
207 1 24 ILE MD 1 25 PRO HD2 . . 4.600 4.420 4.298 4.741 0.141 7 0 "[ . 1 . 2]" 1
208 1 24 ILE MD 1 25 PRO HD3 . . 5.500 5.446 5.226 5.503 0.003 4 0 "[ . 1 . 2]" 1
209 1 24 ILE MD 1 68 PHE QD . . 4.760 2.710 2.024 3.719 . 0 0 "[ . 1 . 2]" 1
210 1 24 ILE MD 1 68 PHE QE . . 3.410 2.248 1.930 3.414 0.004 7 0 "[ . 1 . 2]" 1
211 1 24 ILE MD 1 68 PHE HZ . . 4.750 4.021 3.437 4.736 . 0 0 "[ . 1 . 2]" 1
212 1 24 ILE HG12 1 109 PRO QG . . 5.350 3.008 2.459 3.713 . 0 0 "[ . 1 . 2]" 1
213 1 24 ILE HG12 1 112 PHE QE . . 4.190 2.657 2.052 3.753 . 0 0 "[ . 1 . 2]" 1
214 1 24 ILE HG13 1 68 PHE QE . . 5.500 4.716 3.467 5.276 . 0 0 "[ . 1 . 2]" 1
215 1 24 ILE HG13 1 112 PHE QE . . 4.240 3.279 2.343 4.165 . 0 0 "[ . 1 . 2]" 1
216 1 24 ILE MG 1 25 PRO HD2 . . 3.580 1.846 1.796 1.993 . 0 0 "[ . 1 . 2]" 1
217 1 24 ILE MG 1 25 PRO HD3 . . 3.830 3.180 3.133 3.311 . 0 0 "[ . 1 . 2]" 1
218 1 24 ILE MG 1 68 PHE QD . . 4.780 4.156 3.716 4.520 . 0 0 "[ . 1 . 2]" 1
219 1 24 ILE MG 1 68 PHE QE . . 3.780 2.865 2.333 3.373 . 0 0 "[ . 1 . 2]" 1
220 1 24 ILE MG 1 68 PHE HZ . . 4.720 4.230 3.754 4.725 0.005 4 0 "[ . 1 . 2]" 1
221 1 24 ILE MG 1 93 TRP HH2 . . 3.970 2.591 1.974 3.252 . 0 0 "[ . 1 . 2]" 1
222 1 24 ILE MG 1 93 TRP HZ2 . . 3.970 2.592 2.015 3.037 . 0 0 "[ . 1 . 2]" 1
223 1 24 ILE MG 1 109 PRO HD3 . . 4.770 3.698 3.312 4.039 . 0 0 "[ . 1 . 2]" 1
224 1 24 ILE MG 1 109 PRO HG2 . . 4.580 4.218 3.677 4.559 . 0 0 "[ . 1 . 2]" 1
225 1 24 ILE MG 1 109 PRO QG . . 3.890 2.731 2.238 3.000 . 0 0 "[ . 1 . 2]" 1
226 1 24 ILE MG 1 109 PRO HG3 . . 4.580 2.766 2.258 3.043 . 0 0 "[ . 1 . 2]" 1
227 1 24 ILE MG 1 112 PHE QE . . 5.080 3.861 3.419 4.413 . 0 0 "[ . 1 . 2]" 1
228 1 25 PRO HA 1 26 LYS H . . 2.860 2.437 2.153 2.609 . 0 0 "[ . 1 . 2]" 1
229 1 25 PRO HA 1 26 LYS QB . . 4.430 4.220 4.024 4.422 . 0 0 "[ . 1 . 2]" 1
230 1 25 PRO QB 1 26 LYS H . . 3.470 2.563 2.105 3.476 0.006 10 0 "[ . 1 . 2]" 1
231 1 25 PRO QB 1 92 ASP QB . . 3.940 2.985 2.161 3.785 . 0 0 "[ . 1 . 2]" 1
232 1 25 PRO QB 1 93 TRP HE1 . . 3.810 2.753 2.118 3.254 . 0 0 "[ . 1 . 2]" 1
233 1 25 PRO QB 1 93 TRP HZ2 . . 4.830 3.981 3.389 4.217 . 0 0 "[ . 1 . 2]" 1
234 1 25 PRO HB2 1 26 LYS H . . 4.350 2.658 2.133 3.735 . 0 0 "[ . 1 . 2]" 1
235 1 25 PRO HB2 1 93 TRP HE1 . . 4.580 2.786 2.128 3.329 . 0 0 "[ . 1 . 2]" 1
236 1 25 PRO HB2 1 93 TRP HZ2 . . 5.500 4.112 3.470 4.402 . 0 0 "[ . 1 . 2]" 1
237 1 25 PRO HB3 1 26 LYS H . . 4.350 3.512 3.232 4.140 . 0 0 "[ . 1 . 2]" 1
238 1 25 PRO HB3 1 93 TRP HE1 . . 4.580 4.354 3.825 4.586 0.006 18 0 "[ . 1 . 2]" 1
239 1 25 PRO HB3 1 93 TRP HZ2 . . 5.500 5.330 4.750 5.522 0.022 10 0 "[ . 1 . 2]" 1
240 1 25 PRO HD2 1 26 LYS H . . 5.500 5.482 5.398 5.517 0.017 11 0 "[ . 1 . 2]" 1
241 1 25 PRO HD2 1 93 TRP HZ2 . . 5.030 3.746 3.222 4.324 . 0 0 "[ . 1 . 2]" 1
242 1 25 PRO HD2 1 109 PRO HB2 . . 4.940 3.430 2.823 3.890 . 0 0 "[ . 1 . 2]" 1
243 1 25 PRO HD2 1 109 PRO HB3 . . 4.310 2.584 2.037 3.100 . 0 0 "[ . 1 . 2]" 1
244 1 25 PRO HD2 1 109 PRO QG . . 4.910 3.802 3.316 4.296 . 0 0 "[ . 1 . 2]" 1
245 1 25 PRO HD3 1 109 PRO HB3 . . 4.560 3.832 3.176 4.449 . 0 0 "[ . 1 . 2]" 1
246 1 25 PRO QG 1 92 ASP QB . . 3.740 2.750 1.959 3.306 . 0 0 "[ . 1 . 2]" 1
247 1 25 PRO QG 1 93 TRP HE1 . . 4.210 2.487 2.033 2.937 . 0 0 "[ . 1 . 2]" 1
248 1 25 PRO QG 1 93 TRP HZ2 . . 4.430 2.856 2.176 3.186 . 0 0 "[ . 1 . 2]" 1
249 1 25 PRO HG2 1 93 TRP HE1 . . 5.020 2.525 2.054 2.995 . 0 0 "[ . 1 . 2]" 1
250 1 25 PRO HG3 1 93 TRP HE1 . . 5.020 3.781 3.252 4.395 . 0 0 "[ . 1 . 2]" 1
251 1 26 LYS H 1 26 LYS QB . . 2.920 2.268 2.107 2.543 . 0 0 "[ . 1 . 2]" 1
252 1 26 LYS H 1 26 LYS QD . . 4.310 3.624 1.806 4.404 0.094 16 0 "[ . 1 . 2]" 1
253 1 26 LYS H 1 26 LYS QE . . 5.500 4.544 2.992 5.588 0.088 11 0 "[ . 1 . 2]" 1
254 1 26 LYS H 1 26 LYS QG . . 4.040 3.600 2.115 4.077 0.037 13 0 "[ . 1 . 2]" 1
255 1 26 LYS H 1 27 GLU H . . 4.860 4.498 4.255 4.627 . 0 0 "[ . 1 . 2]" 1
256 1 26 LYS HA 1 26 LYS QD . . 3.940 2.970 1.998 3.974 0.034 14 0 "[ . 1 . 2]" 1
257 1 26 LYS HA 1 26 LYS QG . . 3.470 2.643 2.129 3.432 . 0 0 "[ . 1 . 2]" 1
258 1 26 LYS HA 1 27 GLU H . . 3.010 2.178 2.141 2.239 . 0 0 "[ . 1 . 2]" 1
259 1 26 LYS QB 1 26 LYS QE . . 4.470 2.969 2.075 3.840 . 0 0 "[ . 1 . 2]" 1
260 1 26 LYS QB 1 27 GLU H . . 3.860 3.489 2.886 3.893 0.033 11 0 "[ . 1 . 2]" 1
261 1 26 LYS QD 1 26 LYS QG . . 2.400 2.050 2.024 2.091 . 0 0 "[ . 1 . 2]" 1
262 1 26 LYS QD 1 27 GLU H . . 4.770 3.726 2.347 4.807 0.037 10 0 "[ . 1 . 2]" 1
263 1 26 LYS QE 1 26 LYS QG . . 3.410 2.271 2.056 2.554 . 0 0 "[ . 1 . 2]" 1
264 1 26 LYS QG 1 27 GLU H . . 4.280 3.358 2.478 4.289 0.009 12 0 "[ . 1 . 2]" 1
265 1 27 GLU H 1 27 GLU HB2 . . 3.940 2.697 2.171 3.602 . 0 0 "[ . 1 . 2]" 1
266 1 27 GLU H 1 27 GLU QB . . 3.430 2.429 2.119 2.912 . 0 0 "[ . 1 . 2]" 1
267 1 27 GLU H 1 27 GLU HB3 . . 3.940 3.312 2.410 3.623 . 0 0 "[ . 1 . 2]" 1
268 1 27 GLU H 1 27 GLU HG2 . . 4.330 3.489 2.193 4.385 0.055 19 0 "[ . 1 . 2]" 1
269 1 27 GLU H 1 27 GLU QG . . 3.760 2.564 1.886 3.766 0.006 19 0 "[ . 1 . 2]" 1
270 1 27 GLU H 1 27 GLU HG3 . . 4.330 2.768 1.899 4.332 0.002 18 0 "[ . 1 . 2]" 1
271 1 27 GLU HA 1 28 PRO QD . . 3.600 1.991 1.883 2.069 . 0 0 "[ . 1 . 2]" 1
272 1 27 GLU HA 1 93 TRP HE1 . . 3.980 3.194 2.576 3.784 . 0 0 "[ . 1 . 2]" 1
273 1 27 GLU HA 1 93 TRP HZ2 . . 3.980 2.996 2.419 3.533 . 0 0 "[ . 1 . 2]" 1
274 1 27 GLU HA 1 107 ILE MD . . 5.160 4.497 4.023 5.056 . 0 0 "[ . 1 . 2]" 1
275 1 27 GLU HB2 1 28 PRO QD . . 4.060 3.452 2.021 4.064 0.004 17 0 "[ . 1 . 2]" 1
276 1 27 GLU HB2 1 93 TRP HZ2 . . 5.500 4.893 3.943 5.523 0.023 12 0 "[ . 1 . 2]" 1
277 1 27 GLU HB3 1 28 PRO QD . . 4.060 2.779 2.183 3.803 . 0 0 "[ . 1 . 2]" 1
278 1 27 GLU HB3 1 93 TRP HZ2 . . 5.500 4.675 2.622 5.496 . 0 0 "[ . 1 . 2]" 1
279 1 27 GLU QG 1 28 PRO QD . . 4.300 3.163 2.002 4.159 . 0 0 "[ . 1 . 2]" 1
280 1 27 GLU QG 1 75 GLN HE21 . . 4.600 3.757 2.363 4.599 . 0 0 "[ . 1 . 2]" 1
281 1 27 GLU QG 1 75 GLN HE22 . . 5.010 4.097 2.451 4.788 . 0 0 "[ . 1 . 2]" 1
282 1 27 GLU QG 1 93 TRP HZ2 . . 4.500 3.519 2.471 4.511 0.011 10 0 "[ . 1 . 2]" 1
283 1 27 GLU HG2 1 28 PRO QD . . 4.880 3.477 2.022 4.808 . 0 0 "[ . 1 . 2]" 1
284 1 27 GLU HG2 1 93 TRP HZ2 . . 5.130 4.251 3.036 5.133 0.003 7 0 "[ . 1 . 2]" 1
285 1 27 GLU HG3 1 28 PRO QD . . 4.880 3.977 2.842 4.655 . 0 0 "[ . 1 . 2]" 1
286 1 27 GLU HG3 1 93 TRP HZ2 . . 5.130 3.934 2.580 5.135 0.005 8 0 "[ . 1 . 2]" 1
287 1 28 PRO HB2 1 29 SER HA . . 4.880 4.672 4.220 4.877 . 0 0 "[ . 1 . 2]" 1
288 1 28 PRO HB3 1 31 TYR QD . . 5.500 5.125 4.335 5.501 0.001 14 0 "[ . 1 . 2]" 1
289 1 28 PRO QD 1 93 TRP HE1 . . 4.580 2.989 2.321 3.453 . 0 0 "[ . 1 . 2]" 1
290 1 28 PRO QD 1 93 TRP HZ2 . . 5.360 3.935 3.143 4.576 . 0 0 "[ . 1 . 2]" 1
291 1 28 PRO QD 1 107 ILE MD . . 3.830 2.905 2.419 3.442 . 0 0 "[ . 1 . 2]" 1
292 1 28 PRO QG 1 93 TRP QB . . 4.400 2.818 1.990 3.882 . 0 0 "[ . 1 . 2]" 1
293 1 28 PRO QG 1 93 TRP HD1 . . 4.420 3.747 2.809 4.361 . 0 0 "[ . 1 . 2]" 1
294 1 28 PRO HG2 1 31 TYR QD . . 4.940 3.434 2.429 4.108 . 0 0 "[ . 1 . 2]" 1
295 1 28 PRO HG2 1 107 ILE MD . . 3.910 3.013 2.077 3.735 . 0 0 "[ . 1 . 2]" 1
296 1 28 PRO HG3 1 31 TYR QD . . 4.940 4.353 3.399 4.940 . 14 0 "[ . 1 . 2]" 1
297 1 28 PRO HG3 1 107 ILE MD . . 3.910 3.212 2.041 3.900 . 0 0 "[ . 1 . 2]" 1
298 1 30 ASN HA 1 31 TYR H . . 3.330 2.433 2.151 3.307 . 0 0 "[ . 1 . 2]" 1
299 1 30 ASN HA 1 31 TYR QD . . 4.550 4.332 3.968 4.556 0.006 16 0 "[ . 1 . 2]" 1
300 1 31 TYR H 1 31 TYR HB2 . . 3.650 2.652 2.301 2.898 . 0 0 "[ . 1 . 2]" 1
301 1 31 TYR H 1 31 TYR QB . . 3.110 2.583 2.275 2.775 . 0 0 "[ . 1 . 2]" 1
302 1 31 TYR H 1 31 TYR HB3 . . 3.650 3.606 3.546 3.676 0.026 16 0 "[ . 1 . 2]" 1
303 1 31 TYR H 1 31 TYR QD . . 4.160 2.782 2.000 3.237 . 0 0 "[ . 1 . 2]" 1
304 1 31 TYR HA 1 31 TYR QD . . 3.540 2.648 2.223 3.079 . 0 0 "[ . 1 . 2]" 1
305 1 31 TYR HA 1 31 TYR QE . . 4.810 4.610 4.297 4.805 . 0 0 "[ . 1 . 2]" 1
306 1 31 TYR HA 1 32 ASP H . . 3.270 2.321 2.138 2.851 . 0 0 "[ . 1 . 2]" 1
307 1 31 TYR HA 1 33 PHE QD . . 5.500 4.518 2.286 5.501 0.001 8 0 "[ . 1 . 2]" 1
308 1 31 TYR HA 1 33 PHE QE . . 5.500 4.636 2.354 5.478 . 0 0 "[ . 1 . 2]" 1
309 1 31 TYR HB2 1 32 ASP H . . 4.270 3.886 3.547 4.273 0.003 18 0 "[ . 1 . 2]" 1
310 1 31 TYR HB3 1 32 ASP H . . 4.270 3.060 2.234 4.339 0.069 18 0 "[ . 1 . 2]" 1
311 1 31 TYR QD 1 32 ASP H . . 4.820 4.097 3.180 4.751 . 0 0 "[ . 1 . 2]" 1
312 1 31 TYR QD 1 33 PHE QE . . 4.420 3.342 2.022 4.404 . 0 0 "[ . 1 . 2]" 1
313 1 31 TYR QD 1 107 ILE MD . . 4.850 3.724 2.833 4.431 . 0 0 "[ . 1 . 2]" 1
314 1 31 TYR QD 1 107 ILE MG . . 4.910 4.212 2.450 4.913 0.003 6 0 "[ . 1 . 2]" 1
315 1 31 TYR QE 1 107 ILE MD . . 4.520 2.999 2.123 3.927 . 0 0 "[ . 1 . 2]" 1
316 1 31 TYR QE 1 107 ILE MG . . 4.740 4.133 1.868 4.744 0.004 4 0 "[ . 1 . 2]" 1
317 1 32 ASP H 1 32 ASP HB2 . . 3.840 2.737 2.273 3.587 . 0 0 "[ . 1 . 2]" 1
318 1 32 ASP H 1 32 ASP QB . . 3.330 2.379 2.183 3.002 . 0 0 "[ . 1 . 2]" 1
319 1 32 ASP H 1 32 ASP HB3 . . 3.840 3.022 2.238 3.711 . 0 0 "[ . 1 . 2]" 1
320 1 32 ASP QB 1 33 PHE H . . 4.170 3.014 2.245 4.042 . 0 0 "[ . 1 . 2]" 1
321 1 32 ASP QB 1 33 PHE QD . . 5.340 4.306 2.923 5.350 0.010 11 0 "[ . 1 . 2]" 1
322 1 33 PHE H 1 33 PHE HB2 . . 3.860 3.320 2.216 3.857 . 0 0 "[ . 1 . 2]" 1
323 1 33 PHE H 1 33 PHE QB . . 3.190 2.556 2.168 2.936 . 0 0 "[ . 1 . 2]" 1
324 1 33 PHE H 1 33 PHE HB3 . . 3.860 2.909 2.189 3.606 . 0 0 "[ . 1 . 2]" 1
325 1 33 PHE H 1 33 PHE QD . . 3.820 2.542 1.901 3.777 . 0 0 "[ . 1 . 2]" 1
326 1 33 PHE H 1 34 SER H . . 4.660 3.682 2.204 4.645 . 0 0 "[ . 1 . 2]" 1
327 1 33 PHE HA 1 33 PHE QD . . 3.790 3.387 2.105 3.714 . 0 0 "[ . 1 . 2]" 1
328 1 33 PHE HB2 1 34 SER H . . 4.540 3.584 2.315 4.562 0.022 15 0 "[ . 1 . 2]" 1
329 1 33 PHE HB3 1 34 SER H . . 4.540 3.768 1.931 4.556 0.016 3 0 "[ . 1 . 2]" 1
330 1 33 PHE QD 1 34 SER HA . . 5.500 4.507 2.684 5.499 . 0 0 "[ . 1 . 2]" 1
331 1 33 PHE QE 1 74 PRO HB3 . . 5.300 4.451 2.930 5.296 . 0 0 "[ . 1 . 2]" 1
332 1 33 PHE QE 1 88 GLU QG . . 5.500 4.902 3.035 5.500 0.000 2 0 "[ . 1 . 2]" 1
333 1 33 PHE QE 1 95 ARG QB . . 5.260 4.384 3.401 5.221 . 0 0 "[ . 1 . 2]" 1
334 1 33 PHE QE 1 107 ILE MD . . 5.020 4.573 3.465 4.965 . 0 0 "[ . 1 . 2]" 1
335 1 33 PHE QE 1 107 ILE MG . . 4.100 3.663 2.973 4.098 . 0 0 "[ . 1 . 2]" 1
336 1 33 PHE HZ 1 95 ARG QD . . 4.300 3.386 2.512 4.305 0.005 7 0 "[ . 1 . 2]" 1
337 1 33 PHE HZ 1 95 ARG HG2 . . 5.500 3.987 2.913 5.200 . 0 0 "[ . 1 . 2]" 1
338 1 33 PHE HZ 1 95 ARG QG . . 4.740 3.325 1.985 4.695 . 0 0 "[ . 1 . 2]" 1
339 1 33 PHE HZ 1 95 ARG HG3 . . 5.500 3.808 2.004 5.506 0.006 11 0 "[ . 1 . 2]" 1
340 1 33 PHE HZ 1 107 ILE MD . . 5.240 4.767 3.558 5.245 0.005 18 0 "[ . 1 . 2]" 1
341 1 33 PHE HZ 1 107 ILE MG . . 4.190 3.312 2.686 3.897 . 0 0 "[ . 1 . 2]" 1
342 1 34 SER H 1 34 SER QB . . 3.800 2.668 2.179 3.273 . 0 0 "[ . 1 . 2]" 1
343 1 34 SER H 1 35 GLY H . . 4.300 3.684 2.315 4.291 . 0 0 "[ . 1 . 2]" 1
344 1 34 SER QB 1 35 GLY H . . 4.080 3.536 2.138 4.048 . 0 0 "[ . 1 . 2]" 1
345 1 35 GLY H 1 36 PRO QD . . 4.440 4.171 3.892 4.368 . 0 0 "[ . 1 . 2]" 1
346 1 35 GLY HA2 1 36 PRO QD . . 3.020 2.268 2.009 2.668 . 0 0 "[ . 1 . 2]" 1
347 1 35 GLY HA2 1 36 PRO QG . . 4.580 4.178 3.913 4.572 . 0 0 "[ . 1 . 2]" 1
348 1 35 GLY HA3 1 36 PRO QD . . 3.020 2.361 1.944 2.706 . 0 0 "[ . 1 . 2]" 1
349 1 35 GLY HA3 1 36 PRO QG . . 4.580 4.173 3.846 4.452 . 0 0 "[ . 1 . 2]" 1
350 1 38 SER QB 1 39 GLY H . . 4.510 3.155 2.393 4.044 . 0 0 "[ . 1 . 2]" 1
351 1 39 GLY QA 1 40 ILE H . . 3.110 2.369 2.110 2.878 . 0 0 "[ . 1 . 2]" 1
352 1 39 GLY QA 1 40 ILE QG . . 4.620 3.872 3.436 4.633 0.013 19 0 "[ . 1 . 2]" 1
353 1 39 GLY QA 1 40 ILE MG . . 4.260 3.457 3.136 4.178 . 0 0 "[ . 1 . 2]" 1
354 1 40 ILE H 1 40 ILE HB . . 3.960 3.769 3.553 3.950 . 0 0 "[ . 1 . 2]" 1
355 1 40 ILE H 1 40 ILE MD . . 4.560 3.539 1.736 4.187 . 0 0 "[ . 1 . 2]" 1
356 1 40 ILE H 1 40 ILE HG12 . . 3.870 2.961 2.116 3.741 . 0 0 "[ . 1 . 2]" 1
357 1 40 ILE H 1 40 ILE HG13 . . 3.870 2.548 1.944 3.904 0.034 19 0 "[ . 1 . 2]" 1
358 1 40 ILE H 1 40 ILE MG . . 3.950 2.773 1.880 3.181 . 0 0 "[ . 1 . 2]" 1
359 1 40 ILE H 1 41 GLU H . . 4.400 3.794 2.453 4.540 0.140 5 0 "[ . 1 . 2]" 1
360 1 40 ILE HA 1 40 ILE MD . . 4.200 3.892 3.445 4.165 . 0 0 "[ . 1 . 2]" 1
361 1 40 ILE HA 1 40 ILE HG12 . . 4.240 3.965 3.654 4.240 0.000 15 0 "[ . 1 . 2]" 1
362 1 40 ILE HA 1 40 ILE QG . . 3.540 3.352 3.263 3.482 . 0 0 "[ . 1 . 2]" 1
363 1 40 ILE HA 1 40 ILE HG13 . . 4.240 3.654 3.562 4.256 0.016 5 0 "[ . 1 . 2]" 1
364 1 40 ILE HA 1 40 ILE MG . . 3.180 2.321 2.180 2.440 . 0 0 "[ . 1 . 2]" 1
365 1 40 ILE HA 1 41 GLU H . . 3.340 2.656 2.151 3.340 . 0 0 "[ . 1 . 2]" 1
366 1 40 ILE HB 1 41 GLU H . . 4.490 3.145 1.970 4.481 . 0 0 "[ . 1 . 2]" 1
367 1 40 ILE MD 1 41 GLU HA . . 5.180 4.193 2.626 5.180 0.000 12 0 "[ . 1 . 2]" 1
368 1 40 ILE MD 1 41 GLU QB . . 5.340 4.612 2.691 5.351 0.011 19 0 "[ . 1 . 2]" 1
369 1 40 ILE QG 1 40 ILE MG . . 3.220 2.096 1.946 2.270 . 0 0 "[ . 1 . 2]" 1
370 1 40 ILE HG12 1 40 ILE MG . . 3.670 2.234 1.995 3.186 . 0 0 "[ . 1 . 2]" 1
371 1 40 ILE HG13 1 40 ILE MG . . 3.670 2.896 2.271 3.181 . 0 0 "[ . 1 . 2]" 1
372 1 40 ILE MG 1 41 GLU H . . 4.260 3.865 3.474 4.286 0.026 18 0 "[ . 1 . 2]" 1
373 1 41 GLU H 1 41 GLU HB2 . . 3.830 2.914 2.204 3.746 . 0 0 "[ . 1 . 2]" 1
374 1 41 GLU H 1 41 GLU HB3 . . 3.830 2.959 2.385 3.686 . 0 0 "[ . 1 . 2]" 1
375 1 41 GLU HA 1 41 GLU QG . . 3.670 2.730 2.172 3.449 . 0 0 "[ . 1 . 2]" 1
376 1 41 GLU HA 1 42 GLY H . . 3.560 2.663 2.146 3.557 . 0 0 "[ . 1 . 2]" 1
377 1 42 GLY H 1 43 ARG H . . 4.860 3.789 2.258 4.626 . 0 0 "[ . 1 . 2]" 1
378 1 43 ARG H 1 43 ARG QD . . 4.790 3.859 1.868 4.785 . 0 0 "[ . 1 . 2]" 1
379 1 43 ARG H 1 43 ARG QG . . 4.100 3.267 2.020 4.141 0.041 6 0 "[ . 1 . 2]" 1
380 1 43 ARG HA 1 43 ARG QD . . 3.770 3.089 2.015 3.894 0.124 8 0 "[ . 1 . 2]" 1
381 1 43 ARG HA 1 43 ARG QG . . 3.620 2.517 2.136 3.422 . 0 0 "[ . 1 . 2]" 1
382 1 43 ARG QB 1 43 ARG QD . . 3.120 2.267 2.014 2.680 . 0 0 "[ . 1 . 2]" 1
383 1 43 ARG HB2 1 43 ARG QD . . 3.840 2.631 2.045 3.493 . 0 0 "[ . 1 . 2]" 1
384 1 43 ARG HB3 1 43 ARG QD . . 3.840 2.927 2.101 3.493 . 0 0 "[ . 1 . 2]" 1
385 1 56 GLY QA 1 57 ASP H . . 3.440 2.329 2.117 2.726 . 0 0 "[ . 1 . 2]" 1
386 1 57 ASP H 1 57 ASP HB2 . . 4.070 2.856 2.191 4.062 . 0 0 "[ . 1 . 2]" 1
387 1 57 ASP H 1 57 ASP QB . . 3.530 2.608 2.170 3.293 . 0 0 "[ . 1 . 2]" 1
388 1 57 ASP H 1 57 ASP HB3 . . 4.070 3.308 2.521 3.987 . 0 0 "[ . 1 . 2]" 1
389 1 57 ASP QB 1 58 LYS H . . 4.010 3.344 2.112 4.009 . 0 0 "[ . 1 . 2]" 1
390 1 57 ASP HB2 1 58 LYS H . . 4.870 3.919 2.311 4.662 . 0 0 "[ . 1 . 2]" 1
391 1 57 ASP HB3 1 58 LYS H . . 4.870 3.824 2.132 4.666 . 0 0 "[ . 1 . 2]" 1
392 1 58 LYS H 1 58 LYS HB2 . . 3.870 2.705 2.254 3.811 . 0 0 "[ . 1 . 2]" 1
393 1 58 LYS H 1 58 LYS QB . . 3.110 2.506 2.229 3.089 . 0 0 "[ . 1 . 2]" 1
394 1 58 LYS H 1 58 LYS HB3 . . 3.870 3.281 2.464 3.819 . 0 0 "[ . 1 . 2]" 1
395 1 58 LYS H 1 58 LYS QG . . 4.260 3.519 2.289 4.127 . 0 0 "[ . 1 . 2]" 1
396 1 58 LYS H 1 59 GLU H . . 4.360 3.419 2.672 4.227 . 0 0 "[ . 1 . 2]" 1
397 1 58 LYS H 1 59 GLU QG . . 4.970 4.393 3.510 4.968 . 0 0 "[ . 1 . 2]" 1
398 1 58 LYS HA 1 58 LYS QD . . 3.950 3.428 1.994 3.977 0.027 12 0 "[ . 1 . 2]" 1
399 1 58 LYS HA 1 58 LYS QE . . 4.890 4.234 3.247 4.889 . 0 0 "[ . 1 . 2]" 1
400 1 58 LYS HA 1 58 LYS QG . . 3.470 2.443 2.123 3.448 . 0 0 "[ . 1 . 2]" 1
401 1 58 LYS HA 1 59 GLU H . . 2.890 2.518 2.180 2.859 . 0 0 "[ . 1 . 2]" 1
402 1 58 LYS QE 1 58 LYS QG . . 3.420 2.228 2.084 2.586 . 0 0 "[ . 1 . 2]" 1
403 1 58 LYS QG 1 59 GLU H . . 4.620 4.253 3.716 4.580 . 0 0 "[ . 1 . 2]" 1
404 1 59 GLU H 1 59 GLU HB2 . . 3.660 2.424 2.323 2.617 . 0 0 "[ . 1 . 2]" 1
405 1 59 GLU H 1 59 GLU QB . . 3.050 2.388 2.296 2.557 . 0 0 "[ . 1 . 2]" 1
406 1 59 GLU H 1 59 GLU HB3 . . 3.660 3.598 3.564 3.663 0.003 13 0 "[ . 1 . 2]" 1
407 1 59 GLU H 1 59 GLU QG . . 3.340 2.827 1.998 3.314 . 0 0 "[ . 1 . 2]" 1
408 1 59 GLU H 1 60 ARG H . . 4.660 4.586 4.465 4.647 . 0 0 "[ . 1 . 2]" 1
409 1 59 GLU HA 1 59 GLU HG2 . . 3.790 3.168 2.598 3.725 . 0 0 "[ . 1 . 2]" 1
410 1 59 GLU HA 1 59 GLU QG . . 3.290 2.493 2.236 3.032 . 0 0 "[ . 1 . 2]" 1
411 1 59 GLU HA 1 59 GLU HG3 . . 3.790 2.730 2.262 3.601 . 0 0 "[ . 1 . 2]" 1
412 1 59 GLU HA 1 60 ARG H . . 2.880 2.401 2.254 2.609 . 0 0 "[ . 1 . 2]" 1
413 1 59 GLU QB 1 60 ARG H . . 3.330 2.428 1.981 2.781 . 0 0 "[ . 1 . 2]" 1
414 1 59 GLU QB 1 85 ARG QD . . 3.630 2.913 2.402 3.296 . 0 0 "[ . 1 . 2]" 1
415 1 59 GLU QB 1 86 ILE H . . 4.770 3.611 3.276 4.142 . 0 0 "[ . 1 . 2]" 1
416 1 59 GLU QB 1 87 GLN HA . . 5.020 3.974 3.494 4.508 . 0 0 "[ . 1 . 2]" 1
417 1 59 GLU HB2 1 60 ARG H . . 4.020 3.708 3.330 4.014 . 0 0 "[ . 1 . 2]" 1
418 1 59 GLU HB2 1 85 ARG HD2 . . 5.150 3.417 2.726 4.505 . 0 0 "[ . 1 . 2]" 1
419 1 59 GLU HB2 1 85 ARG HD3 . . 5.150 4.631 4.003 5.156 0.006 10 0 "[ . 1 . 2]" 1
420 1 59 GLU HB3 1 60 ARG H . . 4.020 2.463 1.995 2.836 . 0 0 "[ . 1 . 2]" 1
421 1 59 GLU HB3 1 85 ARG HD2 . . 5.150 3.421 2.589 3.910 . 0 0 "[ . 1 . 2]" 1
422 1 59 GLU HB3 1 85 ARG HD3 . . 5.150 4.573 4.014 5.077 . 0 0 "[ . 1 . 2]" 1
423 1 59 GLU QG 1 60 ARG H . . 3.950 3.769 3.514 3.941 . 0 0 "[ . 1 . 2]" 1
424 1 59 GLU QG 1 87 GLN HA . . 3.710 2.742 2.158 3.714 0.004 10 0 "[ . 1 . 2]" 1
425 1 59 GLU HG2 1 60 ARG H . . 4.730 4.316 3.710 4.730 . 0 0 "[ . 1 . 2]" 1
426 1 59 GLU HG3 1 60 ARG H . . 4.730 4.278 3.932 4.708 . 0 0 "[ . 1 . 2]" 1
427 1 60 ARG H 1 60 ARG HB2 . . 3.460 2.540 2.224 2.882 . 0 0 "[ . 1 . 2]" 1
428 1 60 ARG H 1 60 ARG HB3 . . 4.110 2.886 2.717 3.481 . 0 0 "[ . 1 . 2]" 1
429 1 60 ARG H 1 60 ARG QD . . 5.040 4.678 4.298 4.999 . 0 0 "[ . 1 . 2]" 1
430 1 60 ARG H 1 60 ARG QG . . 4.460 4.004 3.218 4.157 . 0 0 "[ . 1 . 2]" 1
431 1 60 ARG H 1 61 HIS H . . 4.690 4.526 4.360 4.590 . 0 0 "[ . 1 . 2]" 1
432 1 60 ARG H 1 86 ILE H . . 4.070 3.609 2.961 4.059 . 0 0 "[ . 1 . 2]" 1
433 1 60 ARG H 1 86 ILE HB . . 3.920 2.569 2.117 2.988 . 0 0 "[ . 1 . 2]" 1
434 1 60 ARG H 1 86 ILE MD . . 4.790 4.089 3.813 4.347 . 0 0 "[ . 1 . 2]" 1
435 1 60 ARG H 1 86 ILE MG . . 4.320 3.464 3.216 3.852 . 0 0 "[ . 1 . 2]" 1
436 1 60 ARG HA 1 60 ARG HD2 . . 4.830 4.386 3.492 4.563 . 0 0 "[ . 1 . 2]" 1
437 1 60 ARG HA 1 60 ARG QD . . 4.190 4.002 3.278 4.115 . 0 0 "[ . 1 . 2]" 1
438 1 60 ARG HA 1 60 ARG HD3 . . 4.830 4.630 3.972 4.712 . 0 0 "[ . 1 . 2]" 1
439 1 60 ARG HA 1 60 ARG HG2 . . 3.770 3.000 2.601 3.626 . 0 0 "[ . 1 . 2]" 1
440 1 60 ARG HA 1 60 ARG QG . . 3.290 2.233 2.146 2.380 . 0 0 "[ . 1 . 2]" 1
441 1 60 ARG HA 1 60 ARG HG3 . . 3.770 2.318 2.183 2.541 . 0 0 "[ . 1 . 2]" 1
442 1 60 ARG HA 1 61 HIS H . . 2.930 2.254 2.191 2.368 . 0 0 "[ . 1 . 2]" 1
443 1 60 ARG HA 1 61 HIS HB2 . . 5.310 4.153 4.062 4.194 . 0 0 "[ . 1 . 2]" 1
444 1 60 ARG HB2 1 60 ARG QD . . 3.280 2.530 2.133 2.848 . 0 0 "[ . 1 . 2]" 1
445 1 60 ARG HB2 1 61 HIS H . . 4.300 4.192 3.960 4.300 0.000 10 0 "[ . 1 . 2]" 1
446 1 60 ARG HB2 1 86 ILE H . . 5.500 5.130 4.351 5.500 0.000 14 0 "[ . 1 . 2]" 1
447 1 60 ARG HB2 1 86 ILE HB . . 3.810 3.088 2.209 3.429 . 0 0 "[ . 1 . 2]" 1
448 1 60 ARG HB2 1 86 ILE MD . . 3.730 3.403 2.668 3.638 . 0 0 "[ . 1 . 2]" 1
449 1 60 ARG HB2 1 86 ILE MG . . 3.840 3.231 2.605 3.532 . 0 0 "[ . 1 . 2]" 1
450 1 60 ARG HB2 1 115 ILE MD . . 4.530 4.191 3.692 4.430 . 0 0 "[ . 1 . 2]" 1
451 1 60 ARG HB2 1 115 ILE MG . . 4.810 4.489 4.248 4.678 . 0 0 "[ . 1 . 2]" 1
452 1 60 ARG HB3 1 60 ARG QD . . 3.500 2.541 2.240 3.276 . 0 0 "[ . 1 . 2]" 1
453 1 60 ARG HB3 1 61 HIS H . . 3.790 3.566 2.611 3.780 . 0 0 "[ . 1 . 2]" 1
454 1 60 ARG HB3 1 61 HIS HA . . 5.040 4.600 4.248 4.719 . 0 0 "[ . 1 . 2]" 1
455 1 60 ARG HB3 1 86 ILE H . . 4.930 4.071 3.766 4.706 . 0 0 "[ . 1 . 2]" 1
456 1 60 ARG HB3 1 86 ILE HB . . 3.800 2.186 2.000 3.127 . 0 0 "[ . 1 . 2]" 1
457 1 60 ARG HB3 1 86 ILE MD . . 3.800 2.071 1.921 2.285 . 0 0 "[ . 1 . 2]" 1
458 1 60 ARG HB3 1 86 ILE MG . . 4.650 2.968 2.649 3.743 . 0 0 "[ . 1 . 2]" 1
459 1 60 ARG HB3 1 113 ILE MG . . 5.500 5.311 5.085 5.500 . 0 0 "[ . 1 . 2]" 1
460 1 60 ARG HB3 1 115 ILE MD . . 3.540 3.169 2.634 3.434 . 0 0 "[ . 1 . 2]" 1
461 1 60 ARG HB3 1 115 ILE MG . . 4.050 3.927 3.134 4.056 0.006 16 0 "[ . 1 . 2]" 1
462 1 60 ARG QD 1 86 ILE MD . . 4.250 2.831 2.236 4.051 . 0 0 "[ . 1 . 2]" 1
463 1 60 ARG QD 1 86 ILE MG . . 4.270 3.504 3.052 4.273 0.003 13 0 "[ . 1 . 2]" 1
464 1 60 ARG QD 1 115 ILE MD . . 3.570 2.341 1.868 3.305 . 0 0 "[ . 1 . 2]" 1
465 1 60 ARG HD2 1 61 HIS H . . 5.430 5.019 4.657 5.355 . 0 0 "[ . 1 . 2]" 1
466 1 60 ARG HD2 1 86 ILE MD . . 5.060 3.007 2.260 4.594 . 0 0 "[ . 1 . 2]" 1
467 1 60 ARG HD2 1 115 ILE MD . . 4.140 2.689 1.992 4.083 . 0 0 "[ . 1 . 2]" 1
468 1 60 ARG HD2 1 115 ILE MG . . 3.820 3.121 2.717 3.802 . 0 0 "[ . 1 . 2]" 1
469 1 60 ARG HD3 1 61 HIS H . . 5.430 4.879 4.517 5.438 0.008 5 0 "[ . 1 . 2]" 1
470 1 60 ARG HD3 1 86 ILE MD . . 5.060 3.876 3.080 4.636 . 0 0 "[ . 1 . 2]" 1
471 1 60 ARG HD3 1 115 ILE MD . . 4.140 2.766 1.992 3.891 . 0 0 "[ . 1 . 2]" 1
472 1 60 ARG HD3 1 115 ILE MG . . 3.820 2.078 1.781 3.125 . 0 0 "[ . 1 . 2]" 1
473 1 60 ARG QG 1 61 HIS H . . 3.620 2.495 2.168 3.239 . 0 0 "[ . 1 . 2]" 1
474 1 60 ARG QG 1 86 ILE MD . . 3.810 3.010 2.580 3.817 0.007 5 0 "[ . 1 . 2]" 1
475 1 60 ARG QG 1 86 ILE MG . . 4.960 4.343 3.753 4.826 . 0 0 "[ . 1 . 2]" 1
476 1 60 ARG QG 1 115 ILE HA . . 5.340 4.001 3.703 5.348 0.008 5 0 "[ . 1 . 2]" 1
477 1 60 ARG QG 1 115 ILE MD . . 3.620 2.539 1.929 3.621 0.001 5 0 "[ . 1 . 2]" 1
478 1 60 ARG QG 1 115 ILE MG . . 2.970 2.123 1.937 2.908 . 0 0 "[ . 1 . 2]" 1
479 1 61 HIS H 1 61 HIS HB2 . . 3.430 2.517 2.398 2.714 . 0 0 "[ . 1 . 2]" 1
480 1 61 HIS H 1 61 HIS HB3 . . 3.880 2.885 2.846 2.976 . 0 0 "[ . 1 . 2]" 1
481 1 61 HIS H 1 61 HIS HD2 . . 5.080 4.829 4.723 4.919 . 0 0 "[ . 1 . 2]" 1
482 1 61 HIS H 1 62 GLY H . . 4.710 4.384 4.250 4.487 . 0 0 "[ . 1 . 2]" 1
483 1 61 HIS H 1 115 ILE MD . . 4.720 4.248 3.827 4.722 0.002 9 0 "[ . 1 . 2]" 1
484 1 61 HIS H 1 115 ILE MG . . 4.180 3.811 3.563 4.181 0.001 9 0 "[ . 1 . 2]" 1
485 1 61 HIS H 1 116 LYS H . . 4.830 4.650 4.331 4.822 . 0 0 "[ . 1 . 2]" 1
486 1 61 HIS HA 1 61 HIS HD2 . . 4.310 2.589 2.283 2.802 . 0 0 "[ . 1 . 2]" 1
487 1 61 HIS HA 1 62 GLY H . . 3.310 2.145 2.143 2.155 . 0 0 "[ . 1 . 2]" 1
488 1 61 HIS HA 1 85 ARG HA . . 4.100 3.944 3.621 4.100 0.000 3 0 "[ . 1 . 2]" 1
489 1 61 HIS HA 1 85 ARG QD . . 4.260 4.023 3.171 4.262 0.002 15 0 "[ . 1 . 2]" 1
490 1 61 HIS HA 1 86 ILE H . . 4.080 3.907 3.733 4.049 . 0 0 "[ . 1 . 2]" 1
491 1 61 HIS HA 1 86 ILE MD . . 4.200 3.911 3.503 4.186 . 0 0 "[ . 1 . 2]" 1
492 1 61 HIS HB2 1 62 GLY H . . 4.700 4.483 4.413 4.516 . 0 0 "[ . 1 . 2]" 1
493 1 61 HIS HB2 1 83 VAL QG . . 4.930 4.566 4.423 4.700 . 0 0 "[ . 1 . 2]" 1
494 1 61 HIS HB3 1 62 GLY H . . 4.190 4.020 3.930 4.065 . 0 0 "[ . 1 . 2]" 1
495 1 61 HIS HB3 1 83 VAL MG1 . . 5.500 4.406 4.244 4.542 . 0 0 "[ . 1 . 2]" 1
496 1 61 HIS HB3 1 83 VAL QG . . 4.310 4.236 4.103 4.332 0.022 16 0 "[ . 1 . 2]" 1
497 1 61 HIS HB3 1 83 VAL MG2 . . 5.500 5.497 5.447 5.533 0.033 17 0 "[ . 1 . 2]" 1
498 1 61 HIS HB3 1 116 LYS H . . 4.630 3.689 3.077 4.083 . 0 0 "[ . 1 . 2]" 1
499 1 61 HIS HB3 1 116 LYS HB2 . . 4.840 2.861 2.033 3.301 . 0 0 "[ . 1 . 2]" 1
500 1 61 HIS HB3 1 116 LYS QB . . 4.070 2.828 2.025 3.248 . 0 0 "[ . 1 . 2]" 1
501 1 61 HIS HB3 1 116 LYS HB3 . . 4.840 4.480 3.479 4.846 0.006 15 0 "[ . 1 . 2]" 1
502 1 61 HIS HB3 1 116 LYS QD . . 5.430 4.102 2.954 5.235 . 0 0 "[ . 1 . 2]" 1
503 1 61 HIS HB3 1 116 LYS QG . . 4.980 4.122 2.863 4.984 0.004 9 0 "[ . 1 . 2]" 1
504 1 61 HIS HD2 1 62 GLY H . . 4.840 3.987 3.531 4.390 . 0 0 "[ . 1 . 2]" 1
505 1 61 HIS HD2 1 83 VAL MG1 . . 5.350 2.944 2.695 3.284 . 0 0 "[ . 1 . 2]" 1
506 1 61 HIS HD2 1 83 VAL QG . . 3.820 2.924 2.682 3.253 . 0 0 "[ . 1 . 2]" 1
507 1 61 HIS HD2 1 83 VAL MG2 . . 5.350 5.003 4.829 5.258 . 0 0 "[ . 1 . 2]" 1
508 1 61 HIS HD2 1 85 ARG QD . . 4.020 3.036 2.186 3.417 . 0 0 "[ . 1 . 2]" 1
509 1 61 HIS HD2 1 86 ILE H . . 5.330 5.208 4.504 5.335 0.005 4 0 "[ . 1 . 2]" 1
510 1 61 HIS HD2 1 99 ILE MD . . 3.500 3.065 2.713 3.393 . 0 0 "[ . 1 . 2]" 1
511 1 61 HIS HE1 1 83 VAL HB . . 4.650 4.462 4.245 4.643 . 0 0 "[ . 1 . 2]" 1
512 1 61 HIS HE1 1 83 VAL MG1 . . 4.960 2.767 2.450 3.015 . 0 0 "[ . 1 . 2]" 1
513 1 61 HIS HE1 1 83 VAL QG . . 4.210 2.479 2.248 2.706 . 0 0 "[ . 1 . 2]" 1
514 1 61 HIS HE1 1 83 VAL MG2 . . 4.960 2.819 2.425 3.259 . 0 0 "[ . 1 . 2]" 1
515 1 61 HIS HE1 1 99 ILE MD . . 4.670 4.585 4.309 4.679 0.009 9 0 "[ . 1 . 2]" 1
516 1 62 GLY H 1 63 VAL H . . 4.810 4.481 4.453 4.497 . 0 0 "[ . 1 . 2]" 1
517 1 62 GLY H 1 83 VAL QG . . 4.270 2.888 2.450 3.411 . 0 0 "[ . 1 . 2]" 1
518 1 62 GLY H 1 84 VAL H . . 4.070 3.425 3.188 3.897 . 0 0 "[ . 1 . 2]" 1
519 1 62 GLY H 1 84 VAL MG2 . . 3.840 3.655 3.389 3.848 0.008 17 0 "[ . 1 . 2]" 1
520 1 62 GLY H 1 85 ARG HA . . 4.600 4.409 4.004 4.583 . 0 0 "[ . 1 . 2]" 1
521 1 62 GLY H 1 86 ILE MD . . 4.550 3.340 3.084 3.597 . 0 0 "[ . 1 . 2]" 1
522 1 62 GLY H 1 113 ILE MG . . 4.550 4.076 3.891 4.231 . 0 0 "[ . 1 . 2]" 1
523 1 62 GLY HA2 1 63 VAL H . . 3.280 2.414 2.317 2.470 . 0 0 "[ . 1 . 2]" 1
524 1 62 GLY HA2 1 63 VAL HB . . 4.650 4.265 4.227 4.301 . 0 0 "[ . 1 . 2]" 1
525 1 62 GLY HA2 1 63 VAL MG2 . . 4.090 3.769 3.679 3.936 . 0 0 "[ . 1 . 2]" 1
526 1 62 GLY HA2 1 86 ILE MD . . 3.930 3.673 3.480 3.859 . 0 0 "[ . 1 . 2]" 1
527 1 62 GLY HA2 1 113 ILE MG . . 3.290 3.028 2.832 3.250 . 0 0 "[ . 1 . 2]" 1
528 1 62 GLY HA2 1 115 ILE HA . . 3.640 2.411 2.189 2.585 . 0 0 "[ . 1 . 2]" 1
529 1 62 GLY HA2 1 115 ILE MD . . 4.000 3.053 2.758 3.321 . 0 0 "[ . 1 . 2]" 1
530 1 62 GLY HA2 1 115 ILE MG . . 4.260 4.143 3.798 4.262 0.002 5 0 "[ . 1 . 2]" 1
531 1 62 GLY HA2 1 116 LYS H . . 3.650 2.748 2.553 2.871 . 0 0 "[ . 1 . 2]" 1
532 1 62 GLY HA2 1 116 LYS QG . . 4.380 3.307 2.578 3.662 . 0 0 "[ . 1 . 2]" 1
533 1 62 GLY HA3 1 63 VAL H . . 3.400 2.725 2.660 2.846 . 0 0 "[ . 1 . 2]" 1
534 1 62 GLY HA3 1 63 VAL HB . . 5.340 5.159 5.093 5.271 . 0 0 "[ . 1 . 2]" 1
535 1 62 GLY HA3 1 63 VAL MG2 . . 4.770 4.419 4.363 4.546 . 0 0 "[ . 1 . 2]" 1
536 1 62 GLY HA3 1 84 VAL MG2 . . 3.850 3.480 3.349 3.696 . 0 0 "[ . 1 . 2]" 1
537 1 62 GLY HA3 1 86 ILE MD . . 3.780 2.713 2.520 2.826 . 0 0 "[ . 1 . 2]" 1
538 1 62 GLY HA3 1 113 ILE MD . . 4.580 4.026 3.795 4.160 . 0 0 "[ . 1 . 2]" 1
539 1 62 GLY HA3 1 113 ILE MG . . 3.350 2.175 1.992 2.305 . 0 0 "[ . 1 . 2]" 1
540 1 62 GLY HA3 1 115 ILE HA . . 3.800 3.484 3.207 3.653 . 0 0 "[ . 1 . 2]" 1
541 1 62 GLY HA3 1 115 ILE MD . . 3.950 2.935 2.550 3.220 . 0 0 "[ . 1 . 2]" 1
542 1 62 GLY HA3 1 115 ILE MG . . 4.960 4.831 4.520 4.967 0.007 18 0 "[ . 1 . 2]" 1
543 1 62 GLY HA3 1 116 LYS H . . 4.500 4.397 4.131 4.510 0.010 17 0 "[ . 1 . 2]" 1
544 1 62 GLY HA3 1 116 LYS QG . . 5.260 4.881 4.091 5.254 . 0 0 "[ . 1 . 2]" 1
545 1 63 VAL H 1 63 VAL HB . . 3.670 2.737 2.702 2.762 . 0 0 "[ . 1 . 2]" 1
546 1 63 VAL H 1 63 VAL MG1 . . 3.770 3.773 3.742 3.791 0.021 14 0 "[ . 1 . 2]" 1
547 1 63 VAL H 1 63 VAL MG2 . . 3.520 3.296 3.244 3.374 . 0 0 "[ . 1 . 2]" 1
548 1 63 VAL H 1 64 ALA MB . . 5.500 5.337 5.301 5.387 . 0 0 "[ . 1 . 2]" 1
549 1 63 VAL H 1 84 VAL MG2 . . 4.740 4.680 4.494 4.752 0.012 9 0 "[ . 1 . 2]" 1
550 1 63 VAL H 1 86 ILE MD . . 4.930 4.877 4.761 4.936 0.006 16 0 "[ . 1 . 2]" 1
551 1 63 VAL H 1 113 ILE MD . . 4.240 3.860 3.665 4.001 . 0 0 "[ . 1 . 2]" 1
552 1 63 VAL H 1 113 ILE MG . . 3.450 2.413 2.078 2.620 . 0 0 "[ . 1 . 2]" 1
553 1 63 VAL H 1 114 HIS H . . 3.710 2.152 1.881 2.343 . 0 0 "[ . 1 . 2]" 1
554 1 63 VAL H 1 114 HIS HB2 . . 4.660 4.258 3.821 4.450 . 0 0 "[ . 1 . 2]" 1
555 1 63 VAL H 1 114 HIS HB3 . . 4.220 3.020 2.698 3.195 . 0 0 "[ . 1 . 2]" 1
556 1 63 VAL H 1 115 ILE H . . 5.210 4.597 4.425 4.650 . 0 0 "[ . 1 . 2]" 1
557 1 63 VAL H 1 115 ILE HA . . 4.390 4.040 3.758 4.222 . 0 0 "[ . 1 . 2]" 1
558 1 63 VAL H 1 115 ILE MD . . 4.650 4.259 3.823 4.603 . 0 0 "[ . 1 . 2]" 1
559 1 63 VAL H 1 116 LYS H . . 4.600 4.490 4.145 4.608 0.008 5 0 "[ . 1 . 2]" 1
560 1 63 VAL H 1 116 LYS QD . . 5.500 4.567 4.128 5.022 . 0 0 "[ . 1 . 2]" 1
561 1 63 VAL H 1 116 LYS QG . . 4.700 3.910 3.671 4.241 . 0 0 "[ . 1 . 2]" 1
562 1 63 VAL HA 1 63 VAL MG1 . . 3.340 2.528 2.499 2.577 . 0 0 "[ . 1 . 2]" 1
563 1 63 VAL HA 1 63 VAL MG2 . . 3.230 2.251 2.107 2.300 . 0 0 "[ . 1 . 2]" 1
564 1 63 VAL HA 1 64 ALA H . . 2.940 2.158 2.150 2.177 . 0 0 "[ . 1 . 2]" 1
565 1 63 VAL HA 1 64 ALA MB . . 4.130 3.996 3.973 4.009 . 0 0 "[ . 1 . 2]" 1
566 1 63 VAL HA 1 83 VAL MG1 . . 4.210 3.893 3.646 4.222 0.012 17 0 "[ . 1 . 2]" 1
567 1 63 VAL HA 1 83 VAL QG . . 3.550 2.985 2.866 3.111 . 0 0 "[ . 1 . 2]" 1
568 1 63 VAL HA 1 83 VAL MG2 . . 4.210 3.102 2.990 3.240 . 0 0 "[ . 1 . 2]" 1
569 1 63 VAL HA 1 84 VAL H . . 3.860 3.741 3.347 3.866 0.006 7 0 "[ . 1 . 2]" 1
570 1 63 VAL HA 1 84 VAL MG2 . . 4.470 4.238 4.017 4.475 0.005 17 0 "[ . 1 . 2]" 1
571 1 63 VAL HA 1 113 ILE MD . . 4.840 4.133 3.979 4.264 . 0 0 "[ . 1 . 2]" 1
572 1 63 VAL HA 1 113 ILE MG . . 4.850 4.146 3.916 4.415 . 0 0 "[ . 1 . 2]" 1
573 1 63 VAL HB 1 64 ALA H . . 4.310 4.292 4.243 4.320 0.010 18 0 "[ . 1 . 2]" 1
574 1 63 VAL HB 1 65 ILE MG . . 4.290 4.047 3.906 4.171 . 0 0 "[ . 1 . 2]" 1
575 1 63 VAL HB 1 83 VAL QG . . 4.420 4.025 3.840 4.381 . 0 0 "[ . 1 . 2]" 1
576 1 63 VAL HB 1 113 ILE MG . . 5.180 4.776 4.529 4.969 . 0 0 "[ . 1 . 2]" 1
577 1 63 VAL HB 1 114 HIS H . . 4.900 3.755 3.583 3.894 . 0 0 "[ . 1 . 2]" 1
578 1 63 VAL HB 1 114 HIS HB2 . . 4.550 4.195 3.850 4.376 . 0 0 "[ . 1 . 2]" 1
579 1 63 VAL HB 1 114 HIS HB3 . . 4.280 2.570 2.355 2.686 . 0 0 "[ . 1 . 2]" 1
580 1 63 VAL HB 1 116 LYS QD . . 4.490 3.122 2.361 4.101 . 0 0 "[ . 1 . 2]" 1
581 1 63 VAL HB 1 116 LYS QE . . 4.800 4.247 2.664 4.810 0.010 18 0 "[ . 1 . 2]" 1
582 1 63 VAL HB 1 116 LYS QG . . 4.800 3.333 3.044 3.547 . 0 0 "[ . 1 . 2]" 1
583 1 63 VAL MG1 1 64 ALA H . . 3.270 2.504 2.274 2.678 . 0 0 "[ . 1 . 2]" 1
584 1 63 VAL MG1 1 64 ALA HA . . 4.050 3.917 3.858 3.976 . 0 0 "[ . 1 . 2]" 1
585 1 63 VAL MG1 1 64 ALA MB . . 3.590 3.524 3.382 3.598 0.008 17 0 "[ . 1 . 2]" 1
586 1 63 VAL MG1 1 65 ILE HA . . 4.390 3.738 3.607 3.839 . 0 0 "[ . 1 . 2]" 1
587 1 63 VAL MG1 1 65 ILE MG . . 3.030 2.830 2.645 2.988 . 0 0 "[ . 1 . 2]" 1
588 1 63 VAL MG1 1 81 GLY H . . 3.760 2.988 2.844 3.156 . 0 0 "[ . 1 . 2]" 1
589 1 63 VAL MG1 1 81 GLY HA2 . . 3.480 2.705 2.564 2.869 . 0 0 "[ . 1 . 2]" 1
590 1 63 VAL MG1 1 81 GLY HA3 . . 4.320 4.115 3.975 4.291 . 0 0 "[ . 1 . 2]" 1
591 1 63 VAL MG1 1 82 ASP H . . 4.100 3.121 2.984 3.292 . 0 0 "[ . 1 . 2]" 1
592 1 63 VAL MG1 1 113 ILE MD . . 4.970 4.889 4.732 4.974 0.004 5 0 "[ . 1 . 2]" 1
593 1 63 VAL MG1 1 114 HIS H . . 4.100 4.022 3.907 4.105 0.005 15 0 "[ . 1 . 2]" 1
594 1 63 VAL MG1 1 114 HIS HB2 . . 4.160 4.113 3.843 4.165 0.005 12 0 "[ . 1 . 2]" 1
595 1 63 VAL MG1 1 114 HIS HB3 . . 3.410 3.269 3.114 3.353 . 0 0 "[ . 1 . 2]" 1
596 1 63 VAL MG1 1 114 HIS HD2 . . 4.350 4.247 3.968 4.357 0.007 5 0 "[ . 1 . 2]" 1
597 1 63 VAL MG1 1 116 LYS QG . . 4.620 4.439 4.232 4.620 . 13 0 "[ . 1 . 2]" 1
598 1 63 VAL MG2 1 64 ALA H . . 3.870 3.763 3.685 3.824 . 0 0 "[ . 1 . 2]" 1
599 1 63 VAL MG2 1 65 ILE MG . . 5.000 4.950 4.855 5.006 0.006 18 0 "[ . 1 . 2]" 1
600 1 63 VAL MG2 1 81 GLY HA2 . . 4.380 4.293 4.153 4.384 0.004 18 0 "[ . 1 . 2]" 1
601 1 63 VAL MG2 1 82 ASP H . . 4.720 4.678 4.498 4.730 0.010 5 0 "[ . 1 . 2]" 1
602 1 63 VAL MG2 1 83 VAL H . . 4.660 4.275 4.026 4.620 . 0 0 "[ . 1 . 2]" 1
603 1 63 VAL MG2 1 83 VAL QG . . 2.920 1.739 1.636 1.943 . 0 0 "[ . 1 . 2]" 1
604 1 63 VAL MG2 1 114 HIS HB3 . . 4.430 4.168 3.953 4.286 . 0 0 "[ . 1 . 2]" 1
605 1 63 VAL MG2 1 114 HIS HD2 . . 5.030 4.364 4.122 4.569 . 0 0 "[ . 1 . 2]" 1
606 1 63 VAL MG2 1 116 LYS QD . . 3.630 1.968 1.764 2.438 . 0 0 "[ . 1 . 2]" 1
607 1 63 VAL MG2 1 116 LYS QE . . 3.250 2.775 1.969 3.256 0.006 9 0 "[ . 1 . 2]" 1
608 1 63 VAL MG2 1 116 LYS QG . . 3.740 2.947 2.317 3.437 . 0 0 "[ . 1 . 2]" 1
609 1 64 ALA H 1 64 ALA MB . . 3.090 2.207 2.128 2.245 . 0 0 "[ . 1 . 2]" 1
610 1 64 ALA H 1 65 ILE H . . 4.970 4.544 4.488 4.590 . 0 0 "[ . 1 . 2]" 1
611 1 64 ALA H 1 78 LEU MD1 . . 5.500 4.643 4.291 5.024 . 0 0 "[ . 1 . 2]" 1
612 1 64 ALA H 1 80 ILE HA . . 4.900 4.733 4.582 4.902 0.002 18 0 "[ . 1 . 2]" 1
613 1 64 ALA H 1 81 GLY H . . 4.310 3.837 3.495 4.012 . 0 0 "[ . 1 . 2]" 1
614 1 64 ALA H 1 82 ASP H . . 4.300 2.896 2.627 3.088 . 0 0 "[ . 1 . 2]" 1
615 1 64 ALA H 1 82 ASP HB2 . . 5.190 4.003 3.476 5.148 . 0 0 "[ . 1 . 2]" 1
616 1 64 ALA H 1 82 ASP QB . . 4.330 3.761 3.382 4.326 . 0 0 "[ . 1 . 2]" 1
617 1 64 ALA H 1 82 ASP HB3 . . 5.190 4.775 4.562 5.057 . 0 0 "[ . 1 . 2]" 1
618 1 64 ALA H 1 83 VAL QG . . 4.430 4.121 3.997 4.265 . 0 0 "[ . 1 . 2]" 1
619 1 64 ALA H 1 84 VAL MG1 . . 4.720 4.527 4.200 4.699 . 0 0 "[ . 1 . 2]" 1
620 1 64 ALA H 1 84 VAL MG2 . . 4.800 4.583 4.292 4.769 . 0 0 "[ . 1 . 2]" 1
621 1 64 ALA H 1 113 ILE MD . . 4.140 3.667 3.463 3.847 . 0 0 "[ . 1 . 2]" 1
622 1 64 ALA H 1 113 ILE MG . . 5.500 4.646 4.351 4.991 . 0 0 "[ . 1 . 2]" 1
623 1 64 ALA HA 1 65 ILE H . . 3.350 2.157 2.141 2.185 . 0 0 "[ . 1 . 2]" 1
624 1 64 ALA HA 1 65 ILE MD . . 5.250 5.066 4.733 5.146 . 0 0 "[ . 1 . 2]" 1
625 1 64 ALA HA 1 65 ILE HG12 . . 4.360 3.713 3.603 3.841 . 0 0 "[ . 1 . 2]" 1
626 1 64 ALA HA 1 65 ILE MG . . 4.180 3.890 3.738 4.109 . 0 0 "[ . 1 . 2]" 1
627 1 64 ALA HA 1 66 TYR H . . 3.810 3.646 3.532 3.787 . 0 0 "[ . 1 . 2]" 1
628 1 64 ALA HA 1 78 LEU MD1 . . 4.300 3.816 3.574 4.105 . 0 0 "[ . 1 . 2]" 1
629 1 64 ALA HA 1 82 ASP H . . 5.110 4.801 4.485 4.959 . 0 0 "[ . 1 . 2]" 1
630 1 64 ALA HA 1 113 ILE MD . . 3.100 2.751 2.603 2.874 . 0 0 "[ . 1 . 2]" 1
631 1 64 ALA MB 1 65 ILE H . . 3.900 3.084 2.941 3.219 . 0 0 "[ . 1 . 2]" 1
632 1 64 ALA MB 1 65 ILE HA . . 4.620 4.185 4.094 4.276 . 0 0 "[ . 1 . 2]" 1
633 1 64 ALA MB 1 66 TYR H . . 3.790 3.315 3.070 3.659 . 0 0 "[ . 1 . 2]" 1
634 1 64 ALA MB 1 66 TYR HA . . 5.500 5.108 4.971 5.264 . 0 0 "[ . 1 . 2]" 1
635 1 64 ALA MB 1 78 LEU HB2 . . 4.060 3.727 3.589 3.963 . 0 0 "[ . 1 . 2]" 1
636 1 64 ALA MB 1 78 LEU QB . . 3.260 2.440 2.288 2.585 . 0 0 "[ . 1 . 2]" 1
637 1 64 ALA MB 1 78 LEU HB3 . . 4.060 2.474 2.315 2.622 . 0 0 "[ . 1 . 2]" 1
638 1 64 ALA MB 1 78 LEU MD1 . . 3.190 2.681 2.470 2.926 . 0 0 "[ . 1 . 2]" 1
639 1 64 ALA MB 1 78 LEU MD2 . . 3.200 2.850 2.605 3.055 . 0 0 "[ . 1 . 2]" 1
640 1 64 ALA MB 1 79 GLN H . . 4.220 3.222 3.078 3.426 . 0 0 "[ . 1 . 2]" 1
641 1 64 ALA MB 1 80 ILE H . . 4.700 3.818 3.665 3.956 . 0 0 "[ . 1 . 2]" 1
642 1 64 ALA MB 1 80 ILE HA . . 3.470 2.527 2.375 2.644 . 0 0 "[ . 1 . 2]" 1
643 1 64 ALA MB 1 80 ILE QG . . 4.050 3.697 3.509 3.817 . 0 0 "[ . 1 . 2]" 1
644 1 64 ALA MB 1 80 ILE MG . . 4.150 4.021 3.843 4.153 0.003 16 0 "[ . 1 . 2]" 1
645 1 64 ALA MB 1 81 GLY H . . 3.570 2.909 2.610 3.205 . 0 0 "[ . 1 . 2]" 1
646 1 64 ALA MB 1 81 GLY HA3 . . 5.500 4.961 4.674 5.188 . 0 0 "[ . 1 . 2]" 1
647 1 64 ALA MB 1 82 ASP H . . 3.270 2.242 1.888 2.441 . 0 0 "[ . 1 . 2]" 1
648 1 64 ALA MB 1 82 ASP HA . . 4.690 4.471 4.217 4.634 . 0 0 "[ . 1 . 2]" 1
649 1 64 ALA MB 1 82 ASP QB . . 3.380 2.697 2.296 3.384 0.004 18 0 "[ . 1 . 2]" 1
650 1 64 ALA MB 1 84 VAL MG1 . . 4.310 3.902 3.683 4.221 . 0 0 "[ . 1 . 2]" 1
651 1 64 ALA MB 1 84 VAL MG2 . . 4.730 4.362 4.129 4.638 . 0 0 "[ . 1 . 2]" 1
652 1 64 ALA MB 1 112 PHE HB3 . . 4.290 3.952 3.750 4.290 . 0 0 "[ . 1 . 2]" 1
653 1 64 ALA MB 1 113 ILE MD . . 3.240 2.899 2.742 3.118 . 0 0 "[ . 1 . 2]" 1
654 1 65 ILE H 1 65 ILE MD . . 3.700 3.663 3.574 3.712 0.012 6 0 "[ . 1 . 2]" 1
655 1 65 ILE H 1 65 ILE HG12 . . 3.370 1.992 1.909 2.201 . 0 0 "[ . 1 . 2]" 1
656 1 65 ILE H 1 65 ILE HG13 . . 3.820 2.771 2.361 3.184 . 0 0 "[ . 1 . 2]" 1
657 1 65 ILE H 1 65 ILE MG . . 3.780 2.874 2.603 3.039 . 0 0 "[ . 1 . 2]" 1
658 1 65 ILE H 1 66 TYR H . . 3.240 2.030 1.900 2.170 . 0 0 "[ . 1 . 2]" 1
659 1 65 ILE H 1 113 ILE MD . . 4.290 4.199 4.091 4.287 . 0 0 "[ . 1 . 2]" 1
660 1 65 ILE H 1 114 HIS H . . 4.750 4.307 3.948 4.730 . 0 0 "[ . 1 . 2]" 1
661 1 65 ILE HA 1 65 ILE MD . . 4.330 4.171 4.153 4.182 . 0 0 "[ . 1 . 2]" 1
662 1 65 ILE HA 1 65 ILE MG . . 3.020 2.278 2.203 2.367 . 0 0 "[ . 1 . 2]" 1
663 1 65 ILE HA 1 80 ILE HA . . 4.380 3.626 3.378 3.764 . 0 0 "[ . 1 . 2]" 1
664 1 65 ILE HA 1 80 ILE MD . . 4.590 4.416 4.115 4.600 0.010 9 0 "[ . 1 . 2]" 1
665 1 65 ILE HA 1 80 ILE QG . . 4.390 3.575 3.202 3.823 . 0 0 "[ . 1 . 2]" 1
666 1 65 ILE HA 1 80 ILE MG . . 3.470 2.684 2.309 3.030 . 0 0 "[ . 1 . 2]" 1
667 1 65 ILE HA 1 81 GLY H . . 4.740 3.651 3.467 3.858 . 0 0 "[ . 1 . 2]" 1
668 1 65 ILE HB 1 65 ILE MD . . 3.100 2.356 2.211 2.569 . 0 0 "[ . 1 . 2]" 1
669 1 65 ILE HB 1 66 TYR H . . 4.640 3.918 3.673 4.110 . 0 0 "[ . 1 . 2]" 1
670 1 65 ILE HB 1 66 TYR QD . . 4.670 4.164 3.790 4.403 . 0 0 "[ . 1 . 2]" 1
671 1 65 ILE HB 1 66 TYR QE . . 4.510 4.242 3.821 4.499 . 0 0 "[ . 1 . 2]" 1
672 1 65 ILE MD 1 66 TYR H . . 4.340 4.119 3.831 4.327 . 0 0 "[ . 1 . 2]" 1
673 1 65 ILE MD 1 66 TYR HA . . 5.500 5.285 5.036 5.459 . 0 0 "[ . 1 . 2]" 1
674 1 65 ILE MD 1 66 TYR HB2 . . 4.550 4.379 4.123 4.551 0.001 13 0 "[ . 1 . 2]" 1
675 1 65 ILE MD 1 66 TYR QD . . 3.800 2.777 2.399 3.087 . 0 0 "[ . 1 . 2]" 1
676 1 65 ILE MD 1 66 TYR QE . . 3.470 2.461 1.970 2.812 . 0 0 "[ . 1 . 2]" 1
677 1 65 ILE MD 1 111 SER HA . . 4.730 4.460 4.130 4.739 0.009 17 0 "[ . 1 . 2]" 1
678 1 65 ILE MD 1 111 SER QB . . 5.340 4.671 4.321 5.192 . 0 0 "[ . 1 . 2]" 1
679 1 65 ILE MD 1 113 ILE H . . 4.940 4.539 4.192 4.787 . 0 0 "[ . 1 . 2]" 1
680 1 65 ILE MD 1 113 ILE HA . . 4.980 4.737 4.292 4.905 . 0 0 "[ . 1 . 2]" 1
681 1 65 ILE MD 1 114 HIS H . . 4.660 4.485 3.927 4.662 0.002 11 0 "[ . 1 . 2]" 1
682 1 65 ILE MD 1 114 HIS HA . . 4.340 3.982 3.628 4.223 . 0 0 "[ . 1 . 2]" 1
683 1 65 ILE MD 1 114 HIS HB2 . . 3.640 3.004 2.508 3.238 . 0 0 "[ . 1 . 2]" 1
684 1 65 ILE MD 1 114 HIS HB3 . . 4.700 4.519 4.008 4.688 . 0 0 "[ . 1 . 2]" 1
685 1 65 ILE HG12 1 66 TYR H . . 3.630 3.052 2.477 3.600 . 0 0 "[ . 1 . 2]" 1
686 1 65 ILE HG12 1 66 TYR HB2 . . 5.180 4.415 3.904 4.931 . 0 0 "[ . 1 . 2]" 1
687 1 65 ILE HG12 1 66 TYR QD . . 4.800 3.724 3.269 4.339 . 0 0 "[ . 1 . 2]" 1
688 1 65 ILE HG12 1 66 TYR QE . . 5.000 4.690 4.323 5.000 . 6 0 "[ . 1 . 2]" 1
689 1 65 ILE HG12 1 112 PHE HA . . 4.960 2.925 2.526 3.360 . 0 0 "[ . 1 . 2]" 1
690 1 65 ILE HG12 1 114 HIS H . . 4.930 4.194 3.584 4.847 . 0 0 "[ . 1 . 2]" 1
691 1 65 ILE HG12 1 114 HIS HB2 . . 4.810 3.664 3.013 4.277 . 0 0 "[ . 1 . 2]" 1
692 1 65 ILE HG13 1 66 TYR H . . 3.930 2.572 2.114 2.968 . 0 0 "[ . 1 . 2]" 1
693 1 65 ILE HG13 1 66 TYR QD . . 3.890 2.420 1.996 2.903 . 0 0 "[ . 1 . 2]" 1
694 1 65 ILE HG13 1 66 TYR QE . . 4.600 3.466 3.183 3.867 . 0 0 "[ . 1 . 2]" 1
695 1 65 ILE MG 1 66 TYR H . . 4.450 4.115 3.963 4.245 . 0 0 "[ . 1 . 2]" 1
696 1 65 ILE MG 1 114 HIS H . . 3.760 3.506 3.153 3.741 . 0 0 "[ . 1 . 2]" 1
697 1 65 ILE MG 1 114 HIS HA . . 4.340 3.940 3.780 4.222 . 0 0 "[ . 1 . 2]" 1
698 1 65 ILE MG 1 114 HIS HB2 . . 3.300 1.968 1.814 2.096 . 0 0 "[ . 1 . 2]" 1
699 1 65 ILE MG 1 114 HIS HB3 . . 3.380 2.876 2.531 3.092 . 0 0 "[ . 1 . 2]" 1
700 1 65 ILE MG 1 114 HIS HD2 . . 4.420 4.213 3.987 4.409 . 0 0 "[ . 1 . 2]" 1
701 1 66 TYR H 1 66 TYR HB2 . . 3.930 2.625 2.466 2.821 . 0 0 "[ . 1 . 2]" 1
702 1 66 TYR H 1 66 TYR QD . . 4.150 3.574 3.273 3.775 . 0 0 "[ . 1 . 2]" 1
703 1 66 TYR H 1 67 ASN H . . 4.690 4.376 4.288 4.462 . 0 0 "[ . 1 . 2]" 1
704 1 66 TYR H 1 80 ILE HA . . 4.780 4.106 3.839 4.490 . 0 0 "[ . 1 . 2]" 1
705 1 66 TYR H 1 80 ILE MD . . 4.600 4.483 4.316 4.600 0.000 10 0 "[ . 1 . 2]" 1
706 1 66 TYR H 1 80 ILE QG . . 4.020 3.292 3.107 3.560 . 0 0 "[ . 1 . 2]" 1
707 1 66 TYR H 1 80 ILE MG . . 4.760 4.415 4.204 4.551 . 0 0 "[ . 1 . 2]" 1
708 1 66 TYR H 1 112 PHE HA . . 4.620 3.601 3.108 4.034 . 0 0 "[ . 1 . 2]" 1
709 1 66 TYR H 1 112 PHE HB3 . . 4.760 3.469 3.223 3.712 . 0 0 "[ . 1 . 2]" 1
710 1 66 TYR HA 1 66 TYR QD . . 3.730 2.343 2.146 2.658 . 0 0 "[ . 1 . 2]" 1
711 1 66 TYR HA 1 66 TYR QE . . 4.710 4.405 4.323 4.479 . 0 0 "[ . 1 . 2]" 1
712 1 66 TYR HA 1 67 ASN H . . 3.300 2.186 2.148 2.241 . 0 0 "[ . 1 . 2]" 1
713 1 66 TYR HA 1 67 ASN QB . . 4.930 4.392 4.195 4.628 . 0 0 "[ . 1 . 2]" 1
714 1 66 TYR HA 1 80 ILE MD . . 3.460 2.404 2.217 2.582 . 0 0 "[ . 1 . 2]" 1
715 1 66 TYR HA 1 80 ILE HG12 . . 4.200 2.440 2.227 2.788 . 0 0 "[ . 1 . 2]" 1
716 1 66 TYR HA 1 80 ILE QG . . 3.630 2.389 2.164 2.726 . 0 0 "[ . 1 . 2]" 1
717 1 66 TYR HA 1 80 ILE HG13 . . 4.200 3.430 2.941 3.842 . 0 0 "[ . 1 . 2]" 1
718 1 66 TYR HA 1 80 ILE MG . . 4.860 3.940 3.741 4.265 . 0 0 "[ . 1 . 2]" 1
719 1 66 TYR HB2 1 67 ASN H . . 4.330 4.144 3.995 4.323 . 0 0 "[ . 1 . 2]" 1
720 1 66 TYR HB2 1 80 ILE MD . . 5.390 5.043 4.919 5.235 . 0 0 "[ . 1 . 2]" 1
721 1 66 TYR HB2 1 112 PHE HA . . 4.720 3.232 2.830 3.557 . 0 0 "[ . 1 . 2]" 1
722 1 66 TYR HB2 1 112 PHE QD . . 4.050 2.457 2.121 2.922 . 0 0 "[ . 1 . 2]" 1
723 1 66 TYR HB2 1 112 PHE QE . . 4.370 3.100 2.866 3.484 . 0 0 "[ . 1 . 2]" 1
724 1 66 TYR HB3 1 67 ASN H . . 3.670 3.105 2.883 3.343 . 0 0 "[ . 1 . 2]" 1
725 1 66 TYR HB3 1 112 PHE QD . . 4.120 3.368 3.052 3.691 . 0 0 "[ . 1 . 2]" 1
726 1 66 TYR HB3 1 112 PHE QE . . 4.110 2.834 2.364 3.224 . 0 0 "[ . 1 . 2]" 1
727 1 66 TYR QD 1 67 ASN H . . 4.180 3.644 3.362 3.935 . 0 0 "[ . 1 . 2]" 1
728 1 66 TYR QD 1 80 ILE MD . . 4.590 3.376 3.102 3.852 . 0 0 "[ . 1 . 2]" 1
729 1 66 TYR QD 1 112 PHE HA . . 3.440 2.637 2.342 2.852 . 0 0 "[ . 1 . 2]" 1
730 1 66 TYR QD 1 112 PHE HB3 . . 4.860 4.431 4.124 4.673 . 0 0 "[ . 1 . 2]" 1
731 1 66 TYR QD 1 112 PHE QD . . 4.750 3.770 3.294 4.074 . 0 0 "[ . 1 . 2]" 1
732 1 66 TYR QD 1 112 PHE QE . . 4.640 4.128 3.799 4.466 . 0 0 "[ . 1 . 2]" 1
733 1 66 TYR QE 1 112 PHE HA . . 5.300 4.437 3.923 4.780 . 0 0 "[ . 1 . 2]" 1
734 1 67 ASN H 1 67 ASN QB . . 3.310 2.439 2.181 2.748 . 0 0 "[ . 1 . 2]" 1
735 1 67 ASN H 1 67 ASN HD21 . . 4.750 3.303 1.843 4.278 . 0 0 "[ . 1 . 2]" 1
736 1 67 ASN H 1 67 ASN QD . . 4.080 3.107 1.831 3.980 . 0 0 "[ . 1 . 2]" 1
737 1 67 ASN H 1 67 ASN HD22 . . 4.750 3.916 2.953 4.736 . 0 0 "[ . 1 . 2]" 1
738 1 67 ASN H 1 68 PHE H . . 4.620 4.363 4.274 4.454 . 0 0 "[ . 1 . 2]" 1
739 1 67 ASN H 1 80 ILE H . . 4.720 4.306 3.909 4.521 . 0 0 "[ . 1 . 2]" 1
740 1 67 ASN H 1 80 ILE MD . . 3.910 2.355 1.907 2.729 . 0 0 "[ . 1 . 2]" 1
741 1 67 ASN H 1 80 ILE HG12 . . 4.320 2.959 2.436 3.427 . 0 0 "[ . 1 . 2]" 1
742 1 67 ASN H 1 80 ILE QG . . 3.760 2.469 2.022 2.731 . 0 0 "[ . 1 . 2]" 1
743 1 67 ASN H 1 80 ILE HG13 . . 4.320 2.655 2.161 2.869 . 0 0 "[ . 1 . 2]" 1
744 1 67 ASN H 1 80 ILE MG . . 5.460 4.643 4.219 5.066 . 0 0 "[ . 1 . 2]" 1
745 1 67 ASN H 1 112 PHE QE . . 5.190 4.669 4.247 5.080 . 0 0 "[ . 1 . 2]" 1
746 1 67 ASN QB 1 67 ASN HD22 . . 3.520 3.284 3.214 3.424 . 0 0 "[ . 1 . 2]" 1
747 1 67 ASN QB 1 68 PHE H . . 3.770 3.550 3.387 3.688 . 0 0 "[ . 1 . 2]" 1
748 1 67 ASN QB 1 79 GLN HA . . 4.460 3.857 3.124 4.304 . 0 0 "[ . 1 . 2]" 1
749 1 67 ASN QB 1 79 GLN QG . . 4.620 4.157 3.635 4.573 . 0 0 "[ . 1 . 2]" 1
750 1 67 ASN QB 1 80 ILE H . . 5.150 3.662 2.498 4.305 . 0 0 "[ . 1 . 2]" 1
751 1 67 ASN QB 1 80 ILE MD . . 4.310 2.916 2.474 3.780 . 0 0 "[ . 1 . 2]" 1
752 1 67 ASN QB 1 80 ILE QG . . 4.720 2.943 2.009 3.659 . 0 0 "[ . 1 . 2]" 1
753 1 67 ASN QD 1 80 ILE HB . . 5.250 4.008 2.823 5.148 . 0 0 "[ . 1 . 2]" 1
754 1 67 ASN QD 1 80 ILE MD . . 3.630 2.431 1.825 3.444 . 0 0 "[ . 1 . 2]" 1
755 1 67 ASN QD 1 80 ILE QG . . 4.590 3.027 2.230 3.621 . 0 0 "[ . 1 . 2]" 1
756 1 67 ASN HD21 1 80 ILE MD . . 4.300 2.776 1.835 4.242 . 0 0 "[ . 1 . 2]" 1
757 1 67 ASN HD22 1 80 ILE MD . . 4.300 3.045 1.873 3.772 . 0 0 "[ . 1 . 2]" 1
758 1 68 PHE H 1 68 PHE HB2 . . 3.960 2.879 2.784 2.980 . 0 0 "[ . 1 . 2]" 1
759 1 68 PHE H 1 68 PHE QD . . 5.010 4.188 4.141 4.268 . 0 0 "[ . 1 . 2]" 1
760 1 68 PHE H 1 78 LEU H . . 3.820 3.556 3.368 3.806 . 0 0 "[ . 1 . 2]" 1
761 1 68 PHE H 1 78 LEU HB2 . . 4.220 3.315 3.100 3.466 . 0 0 "[ . 1 . 2]" 1
762 1 68 PHE H 1 78 LEU QB . . 3.610 3.125 2.960 3.246 . 0 0 "[ . 1 . 2]" 1
763 1 68 PHE H 1 78 LEU HB3 . . 4.220 3.831 3.608 3.932 . 0 0 "[ . 1 . 2]" 1
764 1 68 PHE H 1 78 LEU MD1 . . 5.040 4.769 4.570 4.965 . 0 0 "[ . 1 . 2]" 1
765 1 68 PHE H 1 78 LEU MD2 . . 5.500 5.459 5.307 5.499 . 0 0 "[ . 1 . 2]" 1
766 1 68 PHE H 1 80 ILE H . . 4.900 4.547 4.388 4.763 . 0 0 "[ . 1 . 2]" 1
767 1 68 PHE H 1 112 PHE QD . . 4.060 3.773 3.483 4.045 . 0 0 "[ . 1 . 2]" 1
768 1 68 PHE HA 1 68 PHE QD . . 4.050 2.852 2.379 3.153 . 0 0 "[ . 1 . 2]" 1
769 1 68 PHE HA 1 69 GLN H . . 3.130 2.206 2.141 2.345 . 0 0 "[ . 1 . 2]" 1
770 1 68 PHE HA 1 69 GLN QB . . 4.350 4.147 3.895 4.351 0.001 1 0 "[ . 1 . 2]" 1
771 1 68 PHE HA 1 112 PHE QD . . 4.710 3.837 3.472 4.212 . 0 0 "[ . 1 . 2]" 1
772 1 68 PHE HA 1 112 PHE QE . . 4.670 3.028 2.517 3.438 . 0 0 "[ . 1 . 2]" 1
773 1 68 PHE HB2 1 69 GLN H . . 4.380 4.077 3.804 4.267 . 0 0 "[ . 1 . 2]" 1
774 1 68 PHE HB2 1 78 LEU H . . 4.790 4.535 4.225 4.759 . 0 0 "[ . 1 . 2]" 1
775 1 68 PHE HB2 1 78 LEU HB2 . . 4.640 3.334 3.172 3.444 . 0 0 "[ . 1 . 2]" 1
776 1 68 PHE HB2 1 78 LEU QB . . 3.930 3.256 3.102 3.351 . 0 0 "[ . 1 . 2]" 1
777 1 68 PHE HB2 1 78 LEU HB3 . . 4.640 4.564 4.378 4.640 0.000 16 0 "[ . 1 . 2]" 1
778 1 68 PHE HB2 1 78 LEU MD1 . . 4.200 3.959 3.731 4.191 . 0 0 "[ . 1 . 2]" 1
779 1 68 PHE HB2 1 78 LEU HG . . 5.500 5.406 4.994 5.514 0.014 17 0 "[ . 1 . 2]" 1
780 1 68 PHE HB2 1 109 PRO HD2 . . 4.520 4.101 3.736 4.339 . 0 0 "[ . 1 . 2]" 1
781 1 68 PHE HB2 1 112 PHE QD . . 4.060 2.378 2.058 2.665 . 0 0 "[ . 1 . 2]" 1
782 1 68 PHE HB2 1 112 PHE QE . . 4.550 3.207 2.860 3.481 . 0 0 "[ . 1 . 2]" 1
783 1 68 PHE HB3 1 69 GLN H . . 4.600 4.070 3.780 4.303 . 0 0 "[ . 1 . 2]" 1
784 1 68 PHE HB3 1 78 LEU H . . 3.950 2.813 2.479 3.045 . 0 0 "[ . 1 . 2]" 1
785 1 68 PHE HB3 1 78 LEU HB2 . . 4.350 2.034 1.994 2.138 . 0 0 "[ . 1 . 2]" 1
786 1 68 PHE HB3 1 78 LEU QB . . 3.800 2.023 1.982 2.125 . 0 0 "[ . 1 . 2]" 1
787 1 68 PHE HB3 1 78 LEU HB3 . . 4.350 3.557 3.433 3.735 . 0 0 "[ . 1 . 2]" 1
788 1 68 PHE HB3 1 78 LEU MD1 . . 4.370 3.486 3.263 3.726 . 0 0 "[ . 1 . 2]" 1
789 1 68 PHE HB3 1 78 LEU HG . . 4.470 4.080 3.791 4.185 . 0 0 "[ . 1 . 2]" 1
790 1 68 PHE HB3 1 112 PHE QD . . 4.450 3.825 3.527 4.166 . 0 0 "[ . 1 . 2]" 1
791 1 68 PHE HB3 1 112 PHE QE . . 5.100 4.762 4.384 5.067 . 0 0 "[ . 1 . 2]" 1
792 1 68 PHE QD 1 69 GLN H . . 3.970 3.250 2.916 3.622 . 0 0 "[ . 1 . 2]" 1
793 1 68 PHE QD 1 77 SER HA . . 4.290 2.109 1.988 2.451 . 0 0 "[ . 1 . 2]" 1
794 1 68 PHE QD 1 77 SER QB . . 5.340 3.845 3.525 4.355 . 0 0 "[ . 1 . 2]" 1
795 1 68 PHE QD 1 78 LEU H . . 3.910 2.815 2.459 3.132 . 0 0 "[ . 1 . 2]" 1
796 1 68 PHE QD 1 78 LEU MD1 . . 4.570 4.098 3.509 4.476 . 0 0 "[ . 1 . 2]" 1
797 1 68 PHE QD 1 78 LEU MD2 . . 5.420 5.207 4.804 5.425 0.005 12 0 "[ . 1 . 2]" 1
798 1 68 PHE QD 1 78 LEU HG . . 4.470 4.109 3.449 4.453 . 0 0 "[ . 1 . 2]" 1
799 1 68 PHE QD 1 108 PHE QB . . 5.340 3.902 3.262 4.230 . 0 0 "[ . 1 . 2]" 1
800 1 68 PHE QD 1 109 PRO HD2 . . 4.900 3.580 2.947 4.089 . 0 0 "[ . 1 . 2]" 1
801 1 68 PHE QD 1 109 PRO QG . . 4.620 2.789 2.037 3.653 . 0 0 "[ . 1 . 2]" 1
802 1 68 PHE QE 1 70 GLY HA2 . . 4.490 3.476 2.840 4.050 . 0 0 "[ . 1 . 2]" 1
803 1 68 PHE QE 1 70 GLY HA3 . . 4.490 2.843 2.402 3.626 . 0 0 "[ . 1 . 2]" 1
804 1 68 PHE QE 1 71 SER H . . 5.270 4.820 4.503 5.271 0.001 15 0 "[ . 1 . 2]" 1
805 1 68 PHE QE 1 75 GLN HA . . 5.060 4.620 4.119 4.919 . 0 0 "[ . 1 . 2]" 1
806 1 68 PHE QE 1 75 GLN QB . . 4.400 3.322 2.905 3.627 . 0 0 "[ . 1 . 2]" 1
807 1 68 PHE QE 1 76 LEU H . . 4.310 3.622 3.017 4.151 . 0 0 "[ . 1 . 2]" 1
808 1 68 PHE QE 1 76 LEU HA . . 5.500 4.812 4.493 4.996 . 0 0 "[ . 1 . 2]" 1
809 1 68 PHE QE 1 93 TRP HZ3 . . 4.790 3.703 3.101 4.311 . 0 0 "[ . 1 . 2]" 1
810 1 68 PHE QE 1 108 PHE HA . . 4.870 4.125 3.512 4.536 . 0 0 "[ . 1 . 2]" 1
811 1 68 PHE QE 1 109 PRO HD2 . . 4.750 3.827 3.291 4.427 . 0 0 "[ . 1 . 2]" 1
812 1 68 PHE QE 1 109 PRO HD3 . . 4.690 3.060 2.115 3.979 . 0 0 "[ . 1 . 2]" 1
813 1 68 PHE QE 1 109 PRO QG . . 4.400 2.906 2.242 3.832 . 0 0 "[ . 1 . 2]" 1
814 1 68 PHE HZ 1 70 GLY QA . . 4.470 3.506 3.207 3.656 . 0 0 "[ . 1 . 2]" 1
815 1 68 PHE HZ 1 71 SER H . . 5.500 5.436 5.099 5.500 . 20 0 "[ . 1 . 2]" 1
816 1 68 PHE HZ 1 75 GLN QB . . 4.930 3.715 3.185 4.025 . 0 0 "[ . 1 . 2]" 1
817 1 68 PHE HZ 1 93 TRP HH2 . . 4.000 3.536 3.120 3.839 . 0 0 "[ . 1 . 2]" 1
818 1 68 PHE HZ 1 93 TRP HZ3 . . 4.580 3.238 2.475 4.242 . 0 0 "[ . 1 . 2]" 1
819 1 68 PHE HZ 1 109 PRO HD3 . . 5.340 3.659 3.094 4.199 . 0 0 "[ . 1 . 2]" 1
820 1 69 GLN H 1 69 GLN QB . . 3.240 2.712 2.400 3.101 . 0 0 "[ . 1 . 2]" 1
821 1 69 GLN H 1 69 GLN HG2 . . 5.030 3.814 1.984 4.920 . 0 0 "[ . 1 . 2]" 1
822 1 69 GLN H 1 69 GLN QG . . 4.330 3.235 1.968 4.166 . 0 0 "[ . 1 . 2]" 1
823 1 69 GLN H 1 69 GLN HG3 . . 5.030 3.856 2.411 4.730 . 0 0 "[ . 1 . 2]" 1
824 1 69 GLN H 1 70 GLY H . . 4.430 4.158 3.941 4.407 . 0 0 "[ . 1 . 2]" 1
825 1 69 GLN HA 1 69 GLN QG . . 3.670 2.791 2.296 3.509 . 0 0 "[ . 1 . 2]" 1
826 1 69 GLN HA 1 70 GLY H . . 3.120 2.155 2.142 2.218 . 0 0 "[ . 1 . 2]" 1
827 1 69 GLN HA 1 70 GLY HA2 . . 4.610 4.402 4.392 4.422 . 0 0 "[ . 1 . 2]" 1
828 1 69 GLN HA 1 70 GLY HA3 . . 4.610 4.394 4.326 4.425 . 0 0 "[ . 1 . 2]" 1
829 1 69 GLN HA 1 77 SER HA . . 4.340 3.618 3.440 3.838 . 0 0 "[ . 1 . 2]" 1
830 1 69 GLN HA 1 77 SER QB . . 4.110 3.244 2.696 3.861 . 0 0 "[ . 1 . 2]" 1
831 1 69 GLN HA 1 78 LEU H . . 4.830 3.892 3.712 4.145 . 0 0 "[ . 1 . 2]" 1
832 1 69 GLN QB 1 70 GLY H . . 3.990 3.612 2.956 3.932 . 0 0 "[ . 1 . 2]" 1
833 1 69 GLN QB 1 70 GLY QA . . 4.460 4.285 4.005 4.465 0.005 2 0 "[ . 1 . 2]" 1
834 1 69 GLN QB 1 77 SER HA . . 5.500 5.428 5.157 5.505 0.005 15 0 "[ . 1 . 2]" 1
835 1 69 GLN QG 1 70 GLY H . . 4.390 3.726 2.831 4.307 . 0 0 "[ . 1 . 2]" 1
836 1 69 GLN HG2 1 70 GLY H . . 5.010 4.392 2.968 5.011 0.001 10 0 "[ . 1 . 2]" 1
837 1 69 GLN HG3 1 70 GLY H . . 5.010 4.136 3.115 4.848 . 0 0 "[ . 1 . 2]" 1
838 1 70 GLY H 1 77 SER HA . . 4.080 3.064 2.560 3.442 . 0 0 "[ . 1 . 2]" 1
839 1 70 GLY H 1 77 SER HB2 . . 4.450 3.616 2.718 4.344 . 0 0 "[ . 1 . 2]" 1
840 1 70 GLY H 1 77 SER QB . . 3.760 2.902 2.047 3.761 0.001 20 0 "[ . 1 . 2]" 1
841 1 70 GLY H 1 77 SER HB3 . . 4.450 3.143 2.116 4.444 . 0 0 "[ . 1 . 2]" 1
842 1 70 GLY H 1 78 LEU H . . 4.770 4.562 4.008 4.774 0.004 10 0 "[ . 1 . 2]" 1
843 1 70 GLY QA 1 71 SER H . . 2.950 2.238 2.155 2.283 . 0 0 "[ . 1 . 2]" 1
844 1 70 GLY QA 1 72 GLY H . . 3.990 3.768 3.573 3.914 . 0 0 "[ . 1 . 2]" 1
845 1 70 GLY HA2 1 71 SER H . . 3.420 2.732 2.390 3.016 . 0 0 "[ . 1 . 2]" 1
846 1 70 GLY HA2 1 75 GLN QB . . 4.200 3.860 3.321 4.210 0.010 5 0 "[ . 1 . 2]" 1
847 1 70 GLY HA3 1 71 SER H . . 3.420 2.421 2.207 2.751 . 0 0 "[ . 1 . 2]" 1
848 1 70 GLY HA3 1 75 GLN QB . . 4.200 3.034 2.812 3.407 . 0 0 "[ . 1 . 2]" 1
849 1 71 SER H 1 71 SER HB2 . . 3.740 2.761 2.442 3.282 . 0 0 "[ . 1 . 2]" 1
850 1 71 SER H 1 71 SER HB3 . . 3.740 3.215 2.483 3.751 0.011 8 0 "[ . 1 . 2]" 1
851 1 71 SER H 1 72 GLY H . . 3.400 2.032 1.949 2.113 . 0 0 "[ . 1 . 2]" 1
852 1 71 SER H 1 75 GLN H . . 5.500 5.473 5.380 5.524 0.024 13 0 "[ . 1 . 2]" 1
853 1 71 SER H 1 75 GLN QB . . 3.720 2.903 2.682 3.008 . 0 0 "[ . 1 . 2]" 1
854 1 71 SER H 1 75 GLN HE22 . . 5.500 4.787 2.793 5.491 . 0 0 "[ . 1 . 2]" 1
855 1 71 SER H 1 75 GLN HG2 . . 5.500 4.991 4.691 5.231 . 0 0 "[ . 1 . 2]" 1
856 1 71 SER H 1 75 GLN QG . . 4.720 4.579 4.364 4.724 0.004 15 0 "[ . 1 . 2]" 1
857 1 71 SER H 1 75 GLN HG3 . . 5.500 5.341 5.140 5.507 0.007 19 0 "[ . 1 . 2]" 1
858 1 71 SER QB 1 75 GLN HE22 . . 4.970 4.259 2.655 4.958 . 0 0 "[ . 1 . 2]" 1
859 1 71 SER HB2 1 72 GLY H . . 4.600 3.207 2.517 4.119 . 0 0 "[ . 1 . 2]" 1
860 1 71 SER HB3 1 72 GLY H . . 4.600 3.076 2.424 3.699 . 0 0 "[ . 1 . 2]" 1
861 1 72 GLY H 1 75 GLN H . . 4.540 4.305 4.180 4.394 . 0 0 "[ . 1 . 2]" 1
862 1 72 GLY H 1 75 GLN QB . . 3.790 2.603 2.309 2.776 . 0 0 "[ . 1 . 2]" 1
863 1 72 GLY H 1 75 GLN HG2 . . 5.500 5.320 5.021 5.514 0.014 14 0 "[ . 1 . 2]" 1
864 1 72 GLY H 1 75 GLN HG3 . . 5.500 5.022 4.625 5.382 . 0 0 "[ . 1 . 2]" 1
865 1 72 GLY QA 1 73 ALA MB . . 4.340 3.772 3.742 3.790 . 0 0 "[ . 1 . 2]" 1
866 1 73 ALA H 1 73 ALA MB . . 3.440 2.200 2.075 2.254 . 0 0 "[ . 1 . 2]" 1
867 1 73 ALA HA 1 74 PRO HB3 . . 4.600 4.467 4.433 4.502 . 0 0 "[ . 1 . 2]" 1
868 1 73 ALA HA 1 75 GLN H . . 3.280 2.390 2.323 2.532 . 0 0 "[ . 1 . 2]" 1
869 1 73 ALA MB 1 74 PRO HB2 . . 4.880 4.444 4.378 4.516 . 0 0 "[ . 1 . 2]" 1
870 1 73 ALA MB 1 74 PRO HB3 . . 4.140 3.741 3.659 3.818 . 0 0 "[ . 1 . 2]" 1
871 1 73 ALA MB 1 74 PRO QD . . 4.360 3.616 3.563 3.686 . 0 0 "[ . 1 . 2]" 1
872 1 73 ALA MB 1 75 GLN H . . 4.270 3.805 3.756 3.908 . 0 0 "[ . 1 . 2]" 1
873 1 74 PRO HB2 1 107 ILE H . . 4.550 4.023 3.823 4.120 . 0 0 "[ . 1 . 2]" 1
874 1 74 PRO HB2 1 107 ILE MD . . 4.250 2.753 2.395 2.955 . 0 0 "[ . 1 . 2]" 1
875 1 74 PRO HB2 1 107 ILE MG . . 4.220 3.048 2.633 3.228 . 0 0 "[ . 1 . 2]" 1
876 1 74 PRO HB3 1 107 ILE H . . 5.500 5.403 5.168 5.501 0.001 9 0 "[ . 1 . 2]" 1
877 1 74 PRO HB3 1 107 ILE MD . . 4.480 4.104 3.625 4.299 . 0 0 "[ . 1 . 2]" 1
878 1 74 PRO HB3 1 107 ILE QG . . 5.340 4.043 3.751 4.300 . 0 0 "[ . 1 . 2]" 1
879 1 74 PRO HB3 1 107 ILE MG . . 4.240 4.205 4.014 4.258 0.018 17 0 "[ . 1 . 2]" 1
880 1 74 PRO QD 1 75 GLN H . . 4.110 2.847 2.786 2.872 . 0 0 "[ . 1 . 2]" 1
881 1 74 PRO QD 1 75 GLN QG . . 4.770 3.644 3.075 4.128 . 0 0 "[ . 1 . 2]" 1
882 1 74 PRO QD 1 107 ILE MD . . 4.880 4.398 4.114 4.660 . 0 0 "[ . 1 . 2]" 1
883 1 74 PRO QG 1 75 GLN H . . 3.620 3.114 3.003 3.155 . 0 0 "[ . 1 . 2]" 1
884 1 74 PRO HG2 1 75 GLN H . . 4.500 3.176 3.057 3.221 . 0 0 "[ . 1 . 2]" 1
885 1 74 PRO HG2 1 107 ILE MD . . 4.380 2.780 2.519 3.068 . 0 0 "[ . 1 . 2]" 1
886 1 74 PRO HG3 1 75 GLN H . . 4.500 4.487 4.397 4.522 0.022 14 0 "[ . 1 . 2]" 1
887 1 74 PRO HG3 1 107 ILE MD . . 4.380 3.696 3.350 3.975 . 0 0 "[ . 1 . 2]" 1
888 1 75 GLN H 1 75 GLN QB . . 3.300 2.305 2.160 2.558 . 0 0 "[ . 1 . 2]" 1
889 1 75 GLN H 1 75 GLN HE21 . . 4.660 4.114 3.293 4.659 . 0 0 "[ . 1 . 2]" 1
890 1 75 GLN H 1 75 GLN QG . . 3.450 2.563 1.989 2.930 . 0 0 "[ . 1 . 2]" 1
891 1 75 GLN H 1 76 LEU H . . 4.640 4.569 4.498 4.621 . 0 0 "[ . 1 . 2]" 1
892 1 75 GLN H 1 107 ILE MD . . 4.660 4.429 4.075 4.662 0.002 16 0 "[ . 1 . 2]" 1
893 1 75 GLN H 1 107 ILE QG . . 4.850 3.946 3.519 4.210 . 0 0 "[ . 1 . 2]" 1
894 1 75 GLN HA 1 76 LEU H . . 3.410 2.181 2.142 2.254 . 0 0 "[ . 1 . 2]" 1
895 1 75 GLN HA 1 107 ILE H . . 3.860 2.860 2.313 3.267 . 0 0 "[ . 1 . 2]" 1
896 1 75 GLN HA 1 107 ILE HG12 . . 4.410 2.952 2.332 3.328 . 0 0 "[ . 1 . 2]" 1
897 1 75 GLN HA 1 107 ILE HG13 . . 4.410 2.536 2.000 2.922 . 0 0 "[ . 1 . 2]" 1
898 1 75 GLN HA 1 107 ILE MG . . 5.070 4.698 4.176 5.066 . 0 0 "[ . 1 . 2]" 1
899 1 75 GLN QB 1 76 LEU H . . 4.000 3.087 2.805 3.365 . 0 0 "[ . 1 . 2]" 1
900 1 75 GLN HE21 1 107 ILE MD . . 5.500 4.794 3.956 5.502 0.002 2 0 "[ . 1 . 2]" 1
901 1 75 GLN QG 1 76 LEU H . . 4.300 3.873 3.610 4.245 . 0 0 "[ . 1 . 2]" 1
902 1 75 GLN QG 1 107 ILE H . . 5.340 4.750 4.312 5.158 . 0 0 "[ . 1 . 2]" 1
903 1 75 GLN QG 1 107 ILE MD . . 3.700 3.213 2.721 3.694 . 0 0 "[ . 1 . 2]" 1
904 1 75 GLN QG 1 107 ILE QG . . 4.180 3.239 2.748 3.667 . 0 0 "[ . 1 . 2]" 1
905 1 75 GLN HG2 1 76 LEU H . . 4.910 4.133 3.783 4.674 . 0 0 "[ . 1 . 2]" 1
906 1 75 GLN HG3 1 76 LEU H . . 4.910 4.705 4.366 4.879 . 0 0 "[ . 1 . 2]" 1
907 1 76 LEU H 1 76 LEU HB2 . . 3.870 3.236 3.014 3.386 . 0 0 "[ . 1 . 2]" 1
908 1 76 LEU H 1 76 LEU HB3 . . 3.780 2.510 2.378 2.617 . 0 0 "[ . 1 . 2]" 1
909 1 76 LEU H 1 76 LEU MD1 . . 4.570 4.506 4.405 4.572 0.002 6 0 "[ . 1 . 2]" 1
910 1 76 LEU H 1 76 LEU MD2 . . 4.460 4.253 4.107 4.398 . 0 0 "[ . 1 . 2]" 1
911 1 76 LEU H 1 76 LEU HG . . 4.410 4.283 4.206 4.413 0.003 16 0 "[ . 1 . 2]" 1
912 1 76 LEU H 1 107 ILE H . . 4.040 2.732 2.211 3.116 . 0 0 "[ . 1 . 2]" 1
913 1 76 LEU H 1 107 ILE HG12 . . 4.600 4.176 3.755 4.527 . 0 0 "[ . 1 . 2]" 1
914 1 76 LEU H 1 107 ILE QG . . 4.040 3.351 3.089 3.550 . 0 0 "[ . 1 . 2]" 1
915 1 76 LEU H 1 107 ILE HG13 . . 4.600 3.534 3.286 3.805 . 0 0 "[ . 1 . 2]" 1
916 1 76 LEU H 1 108 PHE QD . . 4.500 3.955 3.676 4.320 . 0 0 "[ . 1 . 2]" 1
917 1 76 LEU HB2 1 76 LEU MD1 . . 2.770 2.122 2.022 2.255 . 0 0 "[ . 1 . 2]" 1
918 1 76 LEU HB2 1 76 LEU MD2 . . 3.190 2.575 2.485 2.654 . 0 0 "[ . 1 . 2]" 1
919 1 76 LEU HB2 1 77 SER H . . 4.200 3.930 3.825 4.044 . 0 0 "[ . 1 . 2]" 1
920 1 76 LEU HB2 1 105 GLN H . . 5.360 4.625 4.284 5.079 . 0 0 "[ . 1 . 2]" 1
921 1 76 LEU HB2 1 106 GLY H . . 4.270 3.408 3.144 3.625 . 0 0 "[ . 1 . 2]" 1
922 1 76 LEU HB2 1 106 GLY HA3 . . 4.650 2.024 1.997 2.073 . 0 0 "[ . 1 . 2]" 1
923 1 76 LEU HB2 1 107 ILE H . . 4.530 3.223 2.636 3.441 . 0 0 "[ . 1 . 2]" 1
924 1 76 LEU HB2 1 108 PHE QD . . 4.580 4.096 3.520 4.371 . 0 0 "[ . 1 . 2]" 1
925 1 76 LEU HB3 1 76 LEU MD1 . . 3.640 3.141 3.107 3.165 . 0 0 "[ . 1 . 2]" 1
926 1 76 LEU HB3 1 76 LEU MD2 . . 3.140 2.122 1.991 2.247 . 0 0 "[ . 1 . 2]" 1
927 1 76 LEU HB3 1 77 SER H . . 4.270 4.131 4.006 4.185 . 0 0 "[ . 1 . 2]" 1
928 1 76 LEU HB3 1 78 LEU MD2 . . 5.500 4.992 4.679 5.383 . 0 0 "[ . 1 . 2]" 1
929 1 76 LEU HB3 1 106 GLY HA3 . . 4.660 2.952 2.711 3.452 . 0 0 "[ . 1 . 2]" 1
930 1 76 LEU HB3 1 107 ILE H . . 4.220 2.908 2.738 2.995 . 0 0 "[ . 1 . 2]" 1
931 1 76 LEU HB3 1 107 ILE QG . . 5.340 4.473 4.201 4.608 . 0 0 "[ . 1 . 2]" 1
932 1 76 LEU HB3 1 108 PHE QD . . 3.940 2.457 2.011 2.672 . 0 0 "[ . 1 . 2]" 1
933 1 76 LEU HB3 1 108 PHE QE . . 4.750 3.812 3.609 4.083 . 0 0 "[ . 1 . 2]" 1
934 1 76 LEU MD1 1 77 SER H . . 3.950 2.484 2.156 2.844 . 0 0 "[ . 1 . 2]" 1
935 1 76 LEU MD1 1 78 LEU MD2 . . 4.370 4.167 3.725 4.371 0.001 10 0 "[ . 1 . 2]" 1
936 1 76 LEU MD1 1 78 LEU HG . . 5.070 4.718 4.518 4.934 . 0 0 "[ . 1 . 2]" 1
937 1 76 LEU MD1 1 84 VAL MG1 . . 4.830 4.776 4.647 4.841 0.011 17 0 "[ . 1 . 2]" 1
938 1 76 LEU MD1 1 97 TYR HA . . 4.080 3.671 3.176 3.904 . 0 0 "[ . 1 . 2]" 1
939 1 76 LEU MD1 1 97 TYR HB2 . . 4.960 4.430 4.006 4.759 . 0 0 "[ . 1 . 2]" 1
940 1 76 LEU MD1 1 98 LEU H . . 4.320 3.543 3.253 3.857 . 0 0 "[ . 1 . 2]" 1
941 1 76 LEU MD1 1 104 LEU H . . 4.650 4.305 4.035 4.596 . 0 0 "[ . 1 . 2]" 1
942 1 76 LEU MD1 1 104 LEU HA . . 3.690 3.417 3.004 3.696 0.006 9 0 "[ . 1 . 2]" 1
943 1 76 LEU MD1 1 104 LEU QB . . 2.870 1.920 1.762 2.105 . 0 0 "[ . 1 . 2]" 1
944 1 76 LEU MD1 1 105 GLN H . . 3.650 3.018 2.773 3.402 . 0 0 "[ . 1 . 2]" 1
945 1 76 LEU MD1 1 105 GLN HA . . 3.910 2.849 2.330 3.211 . 0 0 "[ . 1 . 2]" 1
946 1 76 LEU MD1 1 105 GLN HB2 . . 4.900 4.708 4.234 4.902 0.002 5 0 "[ . 1 . 2]" 1
947 1 76 LEU MD1 1 105 GLN HB3 . . 5.500 4.763 4.191 5.045 . 0 0 "[ . 1 . 2]" 1
948 1 76 LEU MD1 1 105 GLN QG . . 4.570 4.250 3.879 4.513 . 0 0 "[ . 1 . 2]" 1
949 1 76 LEU MD1 1 106 GLY H . . 4.160 3.607 3.020 3.949 . 0 0 "[ . 1 . 2]" 1
950 1 76 LEU MD1 1 106 GLY HA3 . . 3.900 3.532 3.050 3.715 . 0 0 "[ . 1 . 2]" 1
951 1 76 LEU MD1 1 107 ILE H . . 5.140 4.879 4.354 5.070 . 0 0 "[ . 1 . 2]" 1
952 1 76 LEU MD1 1 108 PHE QD . . 4.780 4.589 4.254 4.781 0.001 2 0 "[ . 1 . 2]" 1
953 1 76 LEU MD1 1 108 PHE QE . . 4.830 4.641 4.313 4.835 0.005 13 0 "[ . 1 . 2]" 1
954 1 76 LEU MD2 1 77 SER H . . 4.270 4.194 3.954 4.274 0.004 17 0 "[ . 1 . 2]" 1
955 1 76 LEU MD2 1 78 LEU HA . . 5.440 4.608 4.375 4.846 . 0 0 "[ . 1 . 2]" 1
956 1 76 LEU MD2 1 78 LEU MD2 . . 3.100 2.698 2.494 3.048 . 0 0 "[ . 1 . 2]" 1
957 1 76 LEU MD2 1 84 VAL MG1 . . 3.390 3.114 2.933 3.365 . 0 0 "[ . 1 . 2]" 1
958 1 76 LEU MD2 1 96 GLY H . . 4.890 4.249 3.910 4.644 . 0 0 "[ . 1 . 2]" 1
959 1 76 LEU MD2 1 97 TYR H . . 4.830 4.408 4.148 4.703 . 0 0 "[ . 1 . 2]" 1
960 1 76 LEU MD2 1 97 TYR HA . . 3.570 2.398 2.108 2.687 . 0 0 "[ . 1 . 2]" 1
961 1 76 LEU MD2 1 97 TYR HB2 . . 4.850 4.066 3.730 4.394 . 0 0 "[ . 1 . 2]" 1
962 1 76 LEU MD2 1 98 LEU H . . 3.630 3.024 2.631 3.473 . 0 0 "[ . 1 . 2]" 1
963 1 76 LEU MD2 1 104 LEU QB . . 4.010 3.702 3.189 4.015 0.005 11 0 "[ . 1 . 2]" 1
964 1 76 LEU MD2 1 105 GLN H . . 4.870 4.580 4.212 4.810 . 0 0 "[ . 1 . 2]" 1
965 1 76 LEU MD2 1 105 GLN HA . . 3.920 2.886 2.569 3.085 . 0 0 "[ . 1 . 2]" 1
966 1 76 LEU MD2 1 105 GLN QG . . 5.020 4.650 4.427 4.753 . 0 0 "[ . 1 . 2]" 1
967 1 76 LEU MD2 1 106 GLY H . . 3.650 2.758 2.424 3.010 . 0 0 "[ . 1 . 2]" 1
968 1 76 LEU MD2 1 106 GLY HA2 . . 4.570 4.472 4.292 4.573 0.003 14 0 "[ . 1 . 2]" 1
969 1 76 LEU MD2 1 106 GLY HA3 . . 3.900 3.542 3.332 3.630 . 0 0 "[ . 1 . 2]" 1
970 1 76 LEU MD2 1 107 ILE H . . 4.840 4.082 3.730 4.260 . 0 0 "[ . 1 . 2]" 1
971 1 76 LEU MD2 1 108 PHE QD . . 3.540 2.281 1.980 2.693 . 0 0 "[ . 1 . 2]" 1
972 1 76 LEU MD2 1 108 PHE QE . . 3.860 2.151 1.923 2.376 . 0 0 "[ . 1 . 2]" 1
973 1 76 LEU MD2 1 108 PHE HZ . . 4.350 4.079 3.804 4.233 . 0 0 "[ . 1 . 2]" 1
974 1 76 LEU HG 1 77 SER H . . 4.370 2.613 2.270 2.762 . 0 0 "[ . 1 . 2]" 1
975 1 76 LEU HG 1 78 LEU MD2 . . 4.070 3.619 3.177 3.886 . 0 0 "[ . 1 . 2]" 1
976 1 76 LEU HG 1 106 GLY H . . 5.500 5.333 4.989 5.502 0.002 4 0 "[ . 1 . 2]" 1
977 1 76 LEU HG 1 106 GLY HA3 . . 4.960 4.927 4.850 4.975 0.015 17 0 "[ . 1 . 2]" 1
978 1 76 LEU HG 1 107 ILE H . . 5.500 5.461 5.268 5.510 0.010 9 0 "[ . 1 . 2]" 1
979 1 76 LEU HG 1 108 PHE QD . . 4.720 3.744 3.383 4.032 . 0 0 "[ . 1 . 2]" 1
980 1 77 SER H 1 77 SER HB2 . . 3.820 3.280 2.187 3.636 . 0 0 "[ . 1 . 2]" 1
981 1 77 SER H 1 77 SER QB . . 3.140 2.489 2.166 2.703 . 0 0 "[ . 1 . 2]" 1
982 1 77 SER H 1 77 SER HB3 . . 3.820 2.817 2.468 3.554 . 0 0 "[ . 1 . 2]" 1
983 1 77 SER H 1 78 LEU H . . 4.670 4.604 4.586 4.619 . 0 0 "[ . 1 . 2]" 1
984 1 77 SER HA 1 78 LEU H . . 3.190 2.375 2.284 2.438 . 0 0 "[ . 1 . 2]" 1
985 1 77 SER HA 1 78 LEU MD1 . . 5.340 5.045 4.797 5.275 . 0 0 "[ . 1 . 2]" 1
986 1 77 SER QB 1 78 LEU H . . 3.480 2.545 2.325 3.203 . 0 0 "[ . 1 . 2]" 1
987 1 77 SER HB2 1 78 LEU H . . 4.040 2.877 2.352 4.040 0.000 4 0 "[ . 1 . 2]" 1
988 1 77 SER HB3 1 78 LEU H . . 4.040 3.567 2.470 3.990 . 0 0 "[ . 1 . 2]" 1
989 1 78 LEU H 1 78 LEU QB . . 3.620 2.682 2.590 2.747 . 0 0 "[ . 1 . 2]" 1
990 1 78 LEU H 1 78 LEU MD1 . . 4.630 4.469 4.376 4.602 . 0 0 "[ . 1 . 2]" 1
991 1 78 LEU H 1 78 LEU MD2 . . 4.370 4.206 3.975 4.298 . 0 0 "[ . 1 . 2]" 1
992 1 78 LEU H 1 78 LEU HG . . 4.030 3.750 3.615 3.920 . 0 0 "[ . 1 . 2]" 1
993 1 78 LEU HA 1 78 LEU MD1 . . 4.560 3.817 3.787 3.851 . 0 0 "[ . 1 . 2]" 1
994 1 78 LEU HA 1 78 LEU MD2 . . 3.110 2.006 1.933 2.116 . 0 0 "[ . 1 . 2]" 1
995 1 78 LEU HA 1 79 GLN H . . 2.980 2.315 2.264 2.345 . 0 0 "[ . 1 . 2]" 1
996 1 78 LEU HA 1 79 GLN HB2 . . 4.820 4.209 4.174 4.262 . 0 0 "[ . 1 . 2]" 1
997 1 78 LEU HA 1 79 GLN QG . . 4.400 4.117 4.003 4.204 . 0 0 "[ . 1 . 2]" 1
998 1 78 LEU HA 1 84 VAL MG1 . . 4.780 4.540 4.381 4.745 . 0 0 "[ . 1 . 2]" 1
999 1 78 LEU HA 1 98 LEU MD1 . . 4.300 3.707 3.234 4.300 . 0 0 "[ . 1 . 2]" 1
1000 1 78 LEU HA 1 98 LEU MD2 . . 5.500 4.079 3.514 4.725 . 0 0 "[ . 1 . 2]" 1
1001 1 78 LEU QB 1 78 LEU MD2 . . 3.060 2.283 2.223 2.339 . 0 0 "[ . 1 . 2]" 1
1002 1 78 LEU QB 1 79 GLN H . . 3.640 2.641 2.559 2.776 . 0 0 "[ . 1 . 2]" 1
1003 1 78 LEU HB2 1 78 LEU MD1 . . 3.550 2.284 2.223 2.392 . 0 0 "[ . 1 . 2]" 1
1004 1 78 LEU HB2 1 78 LEU MD2 . . 3.510 3.183 3.175 3.194 . 0 0 "[ . 1 . 2]" 1
1005 1 78 LEU HB3 1 78 LEU MD1 . . 3.550 2.385 2.266 2.485 . 0 0 "[ . 1 . 2]" 1
1006 1 78 LEU HB3 1 78 LEU MD2 . . 3.510 2.340 2.269 2.405 . 0 0 "[ . 1 . 2]" 1
1007 1 78 LEU MD1 1 79 GLN H . . 4.740 4.440 4.311 4.604 . 0 0 "[ . 1 . 2]" 1
1008 1 78 LEU MD1 1 84 VAL HB . . 5.230 4.816 4.534 5.072 . 0 0 "[ . 1 . 2]" 1
1009 1 78 LEU MD1 1 84 VAL MG1 . . 3.640 2.939 2.649 3.203 . 0 0 "[ . 1 . 2]" 1
1010 1 78 LEU MD1 1 84 VAL MG2 . . 3.410 3.064 2.689 3.303 . 0 0 "[ . 1 . 2]" 1
1011 1 78 LEU MD1 1 108 PHE HA . . 4.510 4.286 3.954 4.512 0.002 2 0 "[ . 1 . 2]" 1
1012 1 78 LEU MD1 1 108 PHE HB2 . . 3.980 2.401 1.993 2.630 . 0 0 "[ . 1 . 2]" 1
1013 1 78 LEU MD1 1 108 PHE QB . . 3.400 2.154 1.836 2.339 . 0 0 "[ . 1 . 2]" 1
1014 1 78 LEU MD1 1 108 PHE HB3 . . 3.980 2.452 1.999 2.734 . 0 0 "[ . 1 . 2]" 1
1015 1 78 LEU MD1 1 108 PHE QD . . 3.930 2.724 2.597 2.818 . 0 0 "[ . 1 . 2]" 1
1016 1 78 LEU MD1 1 108 PHE QE . . 4.550 3.470 3.293 3.675 . 0 0 "[ . 1 . 2]" 1
1017 1 78 LEU MD1 1 112 PHE HB2 . . 4.290 3.818 3.491 4.125 . 0 0 "[ . 1 . 2]" 1
1018 1 78 LEU MD1 1 112 PHE HB3 . . 4.270 3.578 3.308 3.927 . 0 0 "[ . 1 . 2]" 1
1019 1 78 LEU MD1 1 112 PHE QD . . 4.780 4.423 4.117 4.645 . 0 0 "[ . 1 . 2]" 1
1020 1 78 LEU MD1 1 113 ILE MD . . 2.900 1.854 1.724 1.988 . 0 0 "[ . 1 . 2]" 1
1021 1 78 LEU MD1 1 113 ILE HG12 . . 4.350 3.434 3.199 3.696 . 0 0 "[ . 1 . 2]" 1
1022 1 78 LEU MD2 1 79 GLN H . . 3.670 2.683 2.354 3.025 . 0 0 "[ . 1 . 2]" 1
1023 1 78 LEU MD2 1 82 ASP H . . 5.280 4.974 4.725 5.270 . 0 0 "[ . 1 . 2]" 1
1024 1 78 LEU MD2 1 82 ASP HB2 . . 4.130 3.283 2.881 4.071 . 0 0 "[ . 1 . 2]" 1
1025 1 78 LEU MD2 1 82 ASP QB . . 3.530 3.046 2.741 3.550 0.020 17 0 "[ . 1 . 2]" 1
1026 1 78 LEU MD2 1 82 ASP HB3 . . 4.130 3.627 3.292 4.070 . 0 0 "[ . 1 . 2]" 1
1027 1 78 LEU MD2 1 84 VAL HB . . 4.230 3.974 3.736 4.208 . 0 0 "[ . 1 . 2]" 1
1028 1 78 LEU MD2 1 84 VAL MG1 . . 2.910 1.827 1.714 2.002 . 0 0 "[ . 1 . 2]" 1
1029 1 78 LEU MD2 1 84 VAL MG2 . . 3.580 3.044 2.647 3.365 . 0 0 "[ . 1 . 2]" 1
1030 1 78 LEU MD2 1 98 LEU HA . . 4.550 3.988 3.773 4.281 . 0 0 "[ . 1 . 2]" 1
1031 1 78 LEU MD2 1 98 LEU HB2 . . 4.200 3.826 3.437 4.197 . 0 0 "[ . 1 . 2]" 1
1032 1 78 LEU MD2 1 98 LEU MD1 . . 3.080 2.382 1.992 3.006 . 0 0 "[ . 1 . 2]" 1
1033 1 78 LEU MD2 1 108 PHE QB . . 4.610 4.149 3.715 4.364 . 0 0 "[ . 1 . 2]" 1
1034 1 78 LEU MD2 1 108 PHE QD . . 4.610 3.923 3.650 4.118 . 0 0 "[ . 1 . 2]" 1
1035 1 78 LEU MD2 1 108 PHE QE . . 4.940 3.896 3.632 4.103 . 0 0 "[ . 1 . 2]" 1
1036 1 78 LEU HG 1 84 VAL MG1 . . 4.720 3.919 3.599 4.175 . 0 0 "[ . 1 . 2]" 1
1037 1 79 GLN H 1 79 GLN HB2 . . 3.270 2.543 2.524 2.564 . 0 0 "[ . 1 . 2]" 1
1038 1 79 GLN H 1 79 GLN HB3 . . 3.820 3.660 3.628 3.699 . 0 0 "[ . 1 . 2]" 1
1039 1 79 GLN H 1 79 GLN QG . . 3.510 3.443 3.355 3.495 . 0 0 "[ . 1 . 2]" 1
1040 1 79 GLN H 1 80 ILE H . . 4.490 4.366 4.337 4.428 . 0 0 "[ . 1 . 2]" 1
1041 1 79 GLN H 1 82 ASP H . . 4.640 4.567 4.494 4.638 . 0 0 "[ . 1 . 2]" 1
1042 1 79 GLN H 1 82 ASP HB2 . . 4.600 2.963 2.655 4.163 . 0 0 "[ . 1 . 2]" 1
1043 1 79 GLN H 1 82 ASP QB . . 3.730 2.716 2.597 3.049 . 0 0 "[ . 1 . 2]" 1
1044 1 79 GLN H 1 82 ASP HB3 . . 4.600 3.644 2.909 3.919 . 0 0 "[ . 1 . 2]" 1
1045 1 79 GLN H 1 98 LEU MD1 . . 4.350 3.822 3.327 4.269 . 0 0 "[ . 1 . 2]" 1
1046 1 79 GLN HA 1 79 GLN QG . . 3.320 2.297 2.229 2.347 . 0 0 "[ . 1 . 2]" 1
1047 1 79 GLN HA 1 80 ILE H . . 3.050 2.184 2.167 2.252 . 0 0 "[ . 1 . 2]" 1
1048 1 79 GLN HA 1 80 ILE HA . . 4.840 4.326 4.307 4.335 . 0 0 "[ . 1 . 2]" 1
1049 1 79 GLN HA 1 80 ILE HB . . 4.820 4.739 4.653 4.815 . 0 0 "[ . 1 . 2]" 1
1050 1 79 GLN HA 1 80 ILE MD . . 5.230 5.069 4.976 5.118 . 0 0 "[ . 1 . 2]" 1
1051 1 79 GLN HA 1 80 ILE QG . . 4.110 3.677 3.595 3.779 . 0 0 "[ . 1 . 2]" 1
1052 1 79 GLN HB2 1 80 ILE H . . 4.290 4.273 4.136 4.316 0.026 18 0 "[ . 1 . 2]" 1
1053 1 79 GLN HB2 1 82 ASP H . . 5.350 5.182 4.979 5.326 . 0 0 "[ . 1 . 2]" 1
1054 1 79 GLN HB3 1 80 ILE H . . 3.710 3.164 2.911 3.238 . 0 0 "[ . 1 . 2]" 1
1055 1 79 GLN QG 1 80 ILE H . . 3.930 3.655 3.479 3.799 . 0 0 "[ . 1 . 2]" 1
1056 1 79 GLN QG 1 80 ILE HB . . 5.500 5.443 5.268 5.505 0.005 17 0 "[ . 1 . 2]" 1
1057 1 79 GLN QG 1 80 ILE QG . . 5.340 4.905 4.687 5.185 . 0 0 "[ . 1 . 2]" 1
1058 1 80 ILE H 1 80 ILE HB . . 3.290 2.621 2.525 2.681 . 0 0 "[ . 1 . 2]" 1
1059 1 80 ILE H 1 80 ILE MD . . 3.520 3.499 3.420 3.524 0.004 9 0 "[ . 1 . 2]" 1
1060 1 80 ILE H 1 80 ILE HG12 . . 3.610 3.243 3.096 3.451 . 0 0 "[ . 1 . 2]" 1
1061 1 80 ILE H 1 80 ILE QG . . 2.860 1.948 1.882 2.085 . 0 0 "[ . 1 . 2]" 1
1062 1 80 ILE H 1 80 ILE HG13 . . 3.610 1.963 1.899 2.103 . 0 0 "[ . 1 . 2]" 1
1063 1 80 ILE H 1 80 ILE MG . . 3.780 3.767 3.761 3.772 . 0 0 "[ . 1 . 2]" 1
1064 1 80 ILE H 1 81 GLY H . . 4.660 4.562 4.507 4.605 . 0 0 "[ . 1 . 2]" 1
1065 1 80 ILE HA 1 80 ILE MD . . 3.890 3.838 3.825 3.859 . 0 0 "[ . 1 . 2]" 1
1066 1 80 ILE HA 1 80 ILE HG12 . . 3.880 2.553 2.521 2.605 . 0 0 "[ . 1 . 2]" 1
1067 1 80 ILE HA 1 80 ILE QG . . 3.340 2.416 2.390 2.445 . 0 0 "[ . 1 . 2]" 1
1068 1 80 ILE HA 1 80 ILE HG13 . . 3.880 2.990 2.809 3.087 . 0 0 "[ . 1 . 2]" 1
1069 1 80 ILE HA 1 80 ILE MG . . 3.060 2.380 2.255 2.470 . 0 0 "[ . 1 . 2]" 1
1070 1 80 ILE HA 1 81 GLY H . . 3.060 2.165 2.145 2.194 . 0 0 "[ . 1 . 2]" 1
1071 1 80 ILE HA 1 81 GLY HA2 . . 4.630 4.416 4.391 4.437 . 0 0 "[ . 1 . 2]" 1
1072 1 80 ILE HA 1 81 GLY HA3 . . 4.440 4.421 4.396 4.449 0.009 19 0 "[ . 1 . 2]" 1
1073 1 80 ILE HA 1 82 ASP H . . 4.060 3.447 3.335 3.601 . 0 0 "[ . 1 . 2]" 1
1074 1 80 ILE HB 1 80 ILE MD . . 2.970 2.384 2.221 2.485 . 0 0 "[ . 1 . 2]" 1
1075 1 80 ILE HB 1 81 GLY H . . 4.420 4.146 4.002 4.268 . 0 0 "[ . 1 . 2]" 1
1076 1 80 ILE HB 1 81 GLY HA3 . . 4.780 4.671 4.560 4.745 . 0 0 "[ . 1 . 2]" 1
1077 1 80 ILE MD 1 80 ILE MG . . 2.470 2.054 1.947 2.244 . 0 0 "[ . 1 . 2]" 1
1078 1 80 ILE MD 1 81 GLY H . . 5.200 5.064 4.926 5.193 . 0 0 "[ . 1 . 2]" 1
1079 1 80 ILE QG 1 80 ILE MG . . 3.000 2.261 2.209 2.363 . 0 0 "[ . 1 . 2]" 1
1080 1 80 ILE QG 1 81 GLY H . . 4.170 4.104 4.013 4.170 . 0 0 "[ . 1 . 2]" 1
1081 1 80 ILE HG12 1 80 ILE MG . . 3.710 2.313 2.253 2.434 . 0 0 "[ . 1 . 2]" 1
1082 1 80 ILE HG13 1 80 ILE MG . . 3.710 3.190 3.179 3.200 . 0 0 "[ . 1 . 2]" 1
1083 1 80 ILE MG 1 81 GLY H . . 3.290 2.367 2.220 2.573 . 0 0 "[ . 1 . 2]" 1
1084 1 80 ILE MG 1 81 GLY HA2 . . 3.880 3.467 3.333 3.637 . 0 0 "[ . 1 . 2]" 1
1085 1 80 ILE MG 1 81 GLY HA3 . . 3.580 3.341 3.129 3.483 . 0 0 "[ . 1 . 2]" 1
1086 1 80 ILE MG 1 82 ASP H . . 4.400 4.327 4.222 4.410 0.010 17 0 "[ . 1 . 2]" 1
1087 1 81 GLY H 1 82 ASP H . . 3.680 2.341 2.176 2.475 . 0 0 "[ . 1 . 2]" 1
1088 1 81 GLY H 1 82 ASP QB . . 4.790 4.502 4.309 4.636 . 0 0 "[ . 1 . 2]" 1
1089 1 82 ASP H 1 82 ASP HB2 . . 3.750 2.761 2.450 3.748 . 0 0 "[ . 1 . 2]" 1
1090 1 82 ASP H 1 82 ASP QB . . 3.120 2.515 2.415 2.721 . 0 0 "[ . 1 . 2]" 1
1091 1 82 ASP H 1 82 ASP HB3 . . 3.750 3.506 2.602 3.735 . 0 0 "[ . 1 . 2]" 1
1092 1 82 ASP H 1 83 VAL H . . 4.610 4.467 4.417 4.518 . 0 0 "[ . 1 . 2]" 1
1093 1 82 ASP H 1 83 VAL QG . . 4.890 4.512 4.419 4.619 . 0 0 "[ . 1 . 2]" 1
1094 1 82 ASP HA 1 83 VAL H . . 2.850 2.194 2.159 2.267 . 0 0 "[ . 1 . 2]" 1
1095 1 82 ASP HA 1 83 VAL HB . . 4.910 4.596 4.542 4.670 . 0 0 "[ . 1 . 2]" 1
1096 1 82 ASP HA 1 83 VAL QG . . 3.680 3.553 3.415 3.673 . 0 0 "[ . 1 . 2]" 1
1097 1 82 ASP HA 1 98 LEU MD1 . . 4.440 4.050 3.649 4.387 . 0 0 "[ . 1 . 2]" 1
1098 1 82 ASP QB 1 83 VAL H . . 3.570 3.003 2.828 3.128 . 0 0 "[ . 1 . 2]" 1
1099 1 82 ASP QB 1 84 VAL MG1 . . 3.970 3.461 3.327 3.731 . 0 0 "[ . 1 . 2]" 1
1100 1 82 ASP QB 1 98 LEU MD1 . . 3.050 2.119 1.942 2.368 . 0 0 "[ . 1 . 2]" 1
1101 1 82 ASP QB 1 98 LEU MD2 . . 4.000 3.515 3.231 3.863 . 0 0 "[ . 1 . 2]" 1
1102 1 82 ASP HB2 1 83 VAL H . . 4.160 3.907 2.965 4.162 0.002 19 0 "[ . 1 . 2]" 1
1103 1 82 ASP HB2 1 84 VAL MG1 . . 4.580 4.029 3.534 4.348 . 0 0 "[ . 1 . 2]" 1
1104 1 82 ASP HB2 1 98 LEU MD1 . . 3.590 2.983 1.991 3.483 . 0 0 "[ . 1 . 2]" 1
1105 1 82 ASP HB3 1 83 VAL H . . 4.160 3.317 2.886 4.227 0.067 18 0 "[ . 1 . 2]" 1
1106 1 82 ASP HB3 1 84 VAL MG1 . . 4.580 3.887 3.555 4.640 0.060 10 0 "[ . 1 . 2]" 1
1107 1 82 ASP HB3 1 98 LEU MD1 . . 3.590 2.405 1.962 3.548 . 0 0 "[ . 1 . 2]" 1
1108 1 83 VAL H 1 83 VAL HB . . 3.440 2.536 2.465 2.611 . 0 0 "[ . 1 . 2]" 1
1109 1 83 VAL H 1 83 VAL MG1 . . 3.980 3.803 3.772 3.838 . 0 0 "[ . 1 . 2]" 1
1110 1 83 VAL H 1 83 VAL QG . . 3.020 2.599 2.376 2.753 . 0 0 "[ . 1 . 2]" 1
1111 1 83 VAL H 1 83 VAL MG2 . . 3.980 2.647 2.400 2.823 . 0 0 "[ . 1 . 2]" 1
1112 1 83 VAL H 1 84 VAL H . . 4.670 4.457 4.240 4.557 . 0 0 "[ . 1 . 2]" 1
1113 1 83 VAL HB 1 84 VAL H . . 4.470 4.102 3.880 4.400 . 0 0 "[ . 1 . 2]" 1
1114 1 83 VAL HB 1 84 VAL HA . . 5.340 4.766 4.624 4.947 . 0 0 "[ . 1 . 2]" 1
1115 1 83 VAL HB 1 99 ILE MD . . 3.420 2.606 2.031 3.049 . 0 0 "[ . 1 . 2]" 1
1116 1 83 VAL QG 1 84 VAL H . . 3.180 2.253 1.876 2.894 . 0 0 "[ . 1 . 2]" 1
1117 1 83 VAL QG 1 84 VAL HA . . 4.580 3.495 3.281 3.653 . 0 0 "[ . 1 . 2]" 1
1118 1 83 VAL QG 1 84 VAL MG2 . . 4.190 3.653 3.471 3.954 . 0 0 "[ . 1 . 2]" 1
1119 1 83 VAL QG 1 85 ARG H . . 4.650 4.316 4.060 4.475 . 0 0 "[ . 1 . 2]" 1
1120 1 83 VAL QG 1 99 ILE MD . . 2.890 1.809 1.697 1.936 . 0 0 "[ . 1 . 2]" 1
1121 1 83 VAL QG 1 99 ILE QG . . 3.650 3.308 2.795 3.458 . 0 0 "[ . 1 . 2]" 1
1122 1 83 VAL QG 1 116 LYS QD . . 3.790 3.455 3.002 3.802 0.012 13 0 "[ . 1 . 2]" 1
1123 1 83 VAL QG 1 116 LYS QE . . 4.700 3.908 2.848 4.702 0.002 11 0 "[ . 1 . 2]" 1
1124 1 83 VAL MG1 1 84 VAL H . . 4.030 2.270 1.880 2.958 . 0 0 "[ . 1 . 2]" 1
1125 1 83 VAL MG1 1 99 ILE MD . . 4.000 1.813 1.699 1.942 . 0 0 "[ . 1 . 2]" 1
1126 1 83 VAL MG1 1 116 LYS QD . . 4.820 4.296 3.704 4.834 0.014 18 0 "[ . 1 . 2]" 1
1127 1 83 VAL MG2 1 84 VAL H . . 4.030 3.973 3.802 4.101 0.071 17 0 "[ . 1 . 2]" 1
1128 1 83 VAL MG2 1 99 ILE MD . . 4.000 3.727 3.433 3.974 . 0 0 "[ . 1 . 2]" 1
1129 1 83 VAL MG2 1 116 LYS QD . . 4.820 3.648 3.173 3.986 . 0 0 "[ . 1 . 2]" 1
1130 1 84 VAL H 1 84 VAL MG1 . . 3.840 2.919 2.518 3.181 . 0 0 "[ . 1 . 2]" 1
1131 1 84 VAL H 1 84 VAL MG2 . . 3.240 2.051 1.940 2.301 . 0 0 "[ . 1 . 2]" 1
1132 1 84 VAL H 1 85 ARG H . . 4.600 4.417 4.325 4.517 . 0 0 "[ . 1 . 2]" 1
1133 1 84 VAL HA 1 84 VAL MG1 . . 3.240 2.311 2.178 2.478 . 0 0 "[ . 1 . 2]" 1
1134 1 84 VAL HA 1 85 ARG H . . 3.100 2.207 2.161 2.237 . 0 0 "[ . 1 . 2]" 1
1135 1 84 VAL HA 1 85 ARG QB . . 4.760 4.100 4.013 4.322 . 0 0 "[ . 1 . 2]" 1
1136 1 84 VAL HA 1 98 LEU HA . . 3.830 2.911 2.517 3.224 . 0 0 "[ . 1 . 2]" 1
1137 1 84 VAL HA 1 98 LEU MD1 . . 4.300 3.458 3.018 3.691 . 0 0 "[ . 1 . 2]" 1
1138 1 84 VAL HA 1 99 ILE H . . 3.750 2.373 2.066 2.663 . 0 0 "[ . 1 . 2]" 1
1139 1 84 VAL HA 1 99 ILE HB . . 5.500 4.053 3.792 4.496 . 0 0 "[ . 1 . 2]" 1
1140 1 84 VAL HA 1 99 ILE MD . . 4.750 2.952 2.693 3.174 . 0 0 "[ . 1 . 2]" 1
1141 1 84 VAL HA 1 99 ILE MG . . 4.830 4.808 4.723 4.856 0.026 17 0 "[ . 1 . 2]" 1
1142 1 84 VAL HB 1 85 ARG H . . 3.370 2.964 2.840 3.182 . 0 0 "[ . 1 . 2]" 1
1143 1 84 VAL HB 1 85 ARG QB . . 5.500 4.675 4.606 4.804 . 0 0 "[ . 1 . 2]" 1
1144 1 84 VAL HB 1 97 TYR H . . 4.240 3.152 2.824 3.347 . 0 0 "[ . 1 . 2]" 1
1145 1 84 VAL HB 1 98 LEU H . . 5.110 4.837 4.308 5.104 . 0 0 "[ . 1 . 2]" 1
1146 1 84 VAL HB 1 98 LEU HA . . 4.470 3.594 2.929 3.930 . 0 0 "[ . 1 . 2]" 1
1147 1 84 VAL HB 1 98 LEU MD1 . . 4.400 4.127 3.793 4.402 0.002 16 0 "[ . 1 . 2]" 1
1148 1 84 VAL HB 1 108 PHE QE . . 4.310 3.666 3.358 3.953 . 0 0 "[ . 1 . 2]" 1
1149 1 84 VAL HB 1 108 PHE HZ . . 3.940 2.884 2.539 3.242 . 0 0 "[ . 1 . 2]" 1
1150 1 84 VAL HB 1 113 ILE MD . . 5.390 4.652 4.449 4.881 . 0 0 "[ . 1 . 2]" 1
1151 1 84 VAL MG1 1 85 ARG H . . 3.980 3.866 3.742 3.990 0.010 9 0 "[ . 1 . 2]" 1
1152 1 84 VAL MG1 1 97 TYR H . . 4.670 4.247 3.896 4.662 . 0 0 "[ . 1 . 2]" 1
1153 1 84 VAL MG1 1 98 LEU HA . . 3.440 2.106 1.969 2.319 . 0 0 "[ . 1 . 2]" 1
1154 1 84 VAL MG1 1 98 LEU HB2 . . 4.330 3.484 2.838 3.743 . 0 0 "[ . 1 . 2]" 1
1155 1 84 VAL MG1 1 98 LEU HB3 . . 4.660 4.436 4.086 4.662 0.002 13 0 "[ . 1 . 2]" 1
1156 1 84 VAL MG1 1 98 LEU MD1 . . 3.210 1.977 1.677 2.262 . 0 0 "[ . 1 . 2]" 1
1157 1 84 VAL MG1 1 98 LEU HG . . 4.380 4.030 3.696 4.393 0.013 17 0 "[ . 1 . 2]" 1
1158 1 84 VAL MG1 1 99 ILE H . . 4.150 3.179 2.889 3.428 . 0 0 "[ . 1 . 2]" 1
1159 1 84 VAL MG1 1 108 PHE QD . . 5.100 4.387 4.083 4.671 . 0 0 "[ . 1 . 2]" 1
1160 1 84 VAL MG1 1 108 PHE QE . . 3.870 3.477 3.012 3.822 . 0 0 "[ . 1 . 2]" 1
1161 1 84 VAL MG1 1 108 PHE HZ . . 4.050 3.593 3.268 3.963 . 0 0 "[ . 1 . 2]" 1
1162 1 84 VAL MG1 1 113 ILE MD . . 3.520 3.216 3.003 3.520 0.000 20 0 "[ . 1 . 2]" 1
1163 1 84 VAL MG2 1 85 ARG H . . 3.960 3.825 3.647 3.971 0.011 14 0 "[ . 1 . 2]" 1
1164 1 84 VAL MG2 1 85 ARG HA . . 4.990 4.313 4.150 4.461 . 0 0 "[ . 1 . 2]" 1
1165 1 84 VAL MG2 1 86 ILE HG13 . . 3.320 2.803 2.458 3.098 . 0 0 "[ . 1 . 2]" 1
1166 1 84 VAL MG2 1 94 TYR HB2 . . 5.410 4.656 4.326 4.909 . 0 0 "[ . 1 . 2]" 1
1167 1 84 VAL MG2 1 97 TYR H . . 4.690 4.292 4.046 4.523 . 0 0 "[ . 1 . 2]" 1
1168 1 84 VAL MG2 1 98 LEU HA . . 5.430 4.615 4.262 4.802 . 0 0 "[ . 1 . 2]" 1
1169 1 84 VAL MG2 1 108 PHE QD . . 4.260 3.857 3.640 4.028 . 0 0 "[ . 1 . 2]" 1
1170 1 84 VAL MG2 1 108 PHE QE . . 3.330 2.512 2.221 2.762 . 0 0 "[ . 1 . 2]" 1
1171 1 84 VAL MG2 1 108 PHE HZ . . 3.480 2.200 1.959 2.579 . 0 0 "[ . 1 . 2]" 1
1172 1 84 VAL MG2 1 113 ILE HB . . 5.500 4.958 4.710 5.215 . 0 0 "[ . 1 . 2]" 1
1173 1 84 VAL MG2 1 113 ILE MD . . 2.950 2.288 2.114 2.502 . 0 0 "[ . 1 . 2]" 1
1174 1 84 VAL MG2 1 113 ILE HG12 . . 4.670 4.470 4.287 4.665 . 0 0 "[ . 1 . 2]" 1
1175 1 84 VAL MG2 1 113 ILE HG13 . . 3.990 3.353 3.130 3.604 . 0 0 "[ . 1 . 2]" 1
1176 1 84 VAL MG2 1 113 ILE MG . . 3.320 2.804 2.563 3.072 . 0 0 "[ . 1 . 2]" 1
1177 1 85 ARG H 1 85 ARG QB . . 3.320 2.233 2.159 2.280 . 0 0 "[ . 1 . 2]" 1
1178 1 85 ARG H 1 85 ARG QD . . 4.570 3.936 3.543 4.323 . 0 0 "[ . 1 . 2]" 1
1179 1 85 ARG H 1 85 ARG QG . . 4.570 3.640 2.705 4.091 . 0 0 "[ . 1 . 2]" 1
1180 1 85 ARG H 1 97 TYR H . . 3.650 3.271 2.967 3.478 . 0 0 "[ . 1 . 2]" 1
1181 1 85 ARG H 1 97 TYR QD . . 4.380 3.887 3.706 4.275 . 0 0 "[ . 1 . 2]" 1
1182 1 85 ARG H 1 97 TYR QE . . 4.790 4.143 3.892 4.401 . 0 0 "[ . 1 . 2]" 1
1183 1 85 ARG H 1 99 ILE H . . 4.190 3.432 3.160 3.776 . 0 0 "[ . 1 . 2]" 1
1184 1 85 ARG H 1 99 ILE HA . . 4.730 4.316 4.179 4.563 . 0 0 "[ . 1 . 2]" 1
1185 1 85 ARG H 1 99 ILE MD . . 4.070 3.013 2.642 3.202 . 0 0 "[ . 1 . 2]" 1
1186 1 85 ARG H 1 99 ILE HG12 . . 4.150 2.795 2.376 3.045 . 0 0 "[ . 1 . 2]" 1
1187 1 85 ARG H 1 99 ILE HG13 . . 4.150 2.364 2.112 3.255 . 0 0 "[ . 1 . 2]" 1
1188 1 85 ARG H 1 99 ILE MG . . 4.710 4.626 4.415 4.715 0.005 6 0 "[ . 1 . 2]" 1
1189 1 85 ARG H 1 108 PHE HZ . . 5.500 5.262 4.955 5.471 . 0 0 "[ . 1 . 2]" 1
1190 1 85 ARG HA 1 85 ARG HD2 . . 3.860 2.654 2.012 3.594 . 0 0 "[ . 1 . 2]" 1
1191 1 85 ARG HA 1 85 ARG HD3 . . 3.860 2.633 2.085 3.533 . 0 0 "[ . 1 . 2]" 1
1192 1 85 ARG HA 1 86 ILE H . . 3.270 2.172 2.141 2.212 . 0 0 "[ . 1 . 2]" 1
1193 1 85 ARG HA 1 86 ILE MD . . 5.260 4.947 4.705 5.230 . 0 0 "[ . 1 . 2]" 1
1194 1 85 ARG HA 1 86 ILE HG13 . . 4.890 3.981 3.831 4.123 . 0 0 "[ . 1 . 2]" 1
1195 1 85 ARG HA 1 99 ILE MD . . 4.450 3.021 2.888 3.219 . 0 0 "[ . 1 . 2]" 1
1196 1 85 ARG HA 1 99 ILE QG . . 5.300 3.664 3.406 3.958 . 0 0 "[ . 1 . 2]" 1
1197 1 85 ARG QB 1 85 ARG HD2 . . 3.740 2.917 2.317 3.457 . 0 0 "[ . 1 . 2]" 1
1198 1 85 ARG QB 1 85 ARG HD3 . . 3.740 2.717 2.249 3.431 . 0 0 "[ . 1 . 2]" 1
1199 1 85 ARG QB 1 86 ILE H . . 3.970 3.797 3.474 3.945 . 0 0 "[ . 1 . 2]" 1
1200 1 85 ARG QB 1 97 TYR H . . 3.980 3.570 3.381 3.746 . 0 0 "[ . 1 . 2]" 1
1201 1 85 ARG QB 1 97 TYR QD . . 4.460 3.852 3.716 4.123 . 0 0 "[ . 1 . 2]" 1
1202 1 85 ARG QB 1 97 TYR QE . . 3.910 3.122 2.880 3.432 . 0 0 "[ . 1 . 2]" 1
1203 1 85 ARG QB 1 99 ILE QG . . 3.930 2.366 1.957 3.183 . 0 0 "[ . 1 . 2]" 1
1204 1 85 ARG QB 1 99 ILE MG . . 4.290 3.988 3.723 4.303 0.013 14 0 "[ . 1 . 2]" 1
1205 1 85 ARG QD 1 86 ILE H . . 4.190 3.652 3.236 4.053 . 0 0 "[ . 1 . 2]" 1
1206 1 85 ARG QD 1 99 ILE MD . . 3.970 2.558 2.138 3.181 . 0 0 "[ . 1 . 2]" 1
1207 1 85 ARG QD 1 99 ILE MG . . 4.030 3.979 3.706 4.097 0.067 9 0 "[ . 1 . 2]" 1
1208 1 85 ARG QG 1 86 ILE H . . 4.980 3.813 2.869 4.758 . 0 0 "[ . 1 . 2]" 1
1209 1 85 ARG QG 1 97 TYR H . . 5.500 5.267 5.096 5.452 . 0 0 "[ . 1 . 2]" 1
1210 1 85 ARG QG 1 97 TYR QE . . 4.140 3.879 3.403 4.146 0.006 18 0 "[ . 1 . 2]" 1
1211 1 86 ILE H 1 86 ILE HB . . 3.450 2.484 2.416 2.536 . 0 0 "[ . 1 . 2]" 1
1212 1 86 ILE H 1 86 ILE MD . . 3.700 3.414 3.172 3.592 . 0 0 "[ . 1 . 2]" 1
1213 1 86 ILE H 1 86 ILE HG12 . . 4.230 3.666 3.519 3.929 . 0 0 "[ . 1 . 2]" 1
1214 1 86 ILE H 1 86 ILE HG13 . . 3.920 2.277 2.136 2.533 . 0 0 "[ . 1 . 2]" 1
1215 1 86 ILE H 1 86 ILE MG . . 3.990 3.763 3.748 3.775 . 0 0 "[ . 1 . 2]" 1
1216 1 86 ILE H 1 87 GLN H . . 4.950 4.475 4.405 4.564 . 0 0 "[ . 1 . 2]" 1
1217 1 86 ILE HA 1 86 ILE MD . . 4.050 3.863 3.828 3.892 . 0 0 "[ . 1 . 2]" 1
1218 1 86 ILE HA 1 86 ILE HG12 . . 3.840 2.656 2.528 2.773 . 0 0 "[ . 1 . 2]" 1
1219 1 86 ILE HA 1 86 ILE HG13 . . 3.950 2.822 2.614 2.917 . 0 0 "[ . 1 . 2]" 1
1220 1 86 ILE HA 1 86 ILE MG . . 3.340 2.394 2.322 2.465 . 0 0 "[ . 1 . 2]" 1
1221 1 86 ILE HA 1 87 GLN H . . 3.310 2.146 2.139 2.165 . 0 0 "[ . 1 . 2]" 1
1222 1 86 ILE HA 1 87 GLN QG . . 4.090 3.733 3.505 3.968 . 0 0 "[ . 1 . 2]" 1
1223 1 86 ILE HA 1 88 GLU H . . 3.890 3.845 3.724 3.903 0.013 18 0 "[ . 1 . 2]" 1
1224 1 86 ILE HA 1 96 GLY HA2 . . 4.290 3.990 3.652 4.297 0.007 3 0 "[ . 1 . 2]" 1
1225 1 86 ILE HA 1 96 GLY QA . . 3.760 2.841 2.587 2.988 . 0 0 "[ . 1 . 2]" 1
1226 1 86 ILE HA 1 96 GLY HA3 . . 4.290 2.909 2.646 3.062 . 0 0 "[ . 1 . 2]" 1
1227 1 86 ILE HA 1 97 TYR H . . 4.730 4.551 4.315 4.744 0.014 9 0 "[ . 1 . 2]" 1
1228 1 86 ILE HA 1 108 PHE HZ . . 4.470 3.997 3.466 4.219 . 0 0 "[ . 1 . 2]" 1
1229 1 86 ILE HB 1 86 ILE MD . . 3.200 2.337 2.244 2.402 . 0 0 "[ . 1 . 2]" 1
1230 1 86 ILE HB 1 87 GLN H . . 4.900 4.274 4.136 4.368 . 0 0 "[ . 1 . 2]" 1
1231 1 86 ILE HB 1 88 GLU H . . 5.500 5.429 5.195 5.504 0.004 3 0 "[ . 1 . 2]" 1
1232 1 86 ILE HB 1 115 ILE MD . . 4.350 4.271 4.050 4.352 0.002 11 0 "[ . 1 . 2]" 1
1233 1 86 ILE MD 1 86 ILE MG . . 2.780 2.143 1.953 2.367 . 0 0 "[ . 1 . 2]" 1
1234 1 86 ILE MD 1 87 GLN H . . 5.320 5.264 5.088 5.329 0.009 3 0 "[ . 1 . 2]" 1
1235 1 86 ILE MD 1 94 TYR HB2 . . 4.890 4.518 4.030 4.782 . 0 0 "[ . 1 . 2]" 1
1236 1 86 ILE MD 1 94 TYR HB3 . . 4.210 3.799 3.421 4.114 . 0 0 "[ . 1 . 2]" 1
1237 1 86 ILE MD 1 94 TYR QD . . 3.860 3.427 3.170 3.720 . 0 0 "[ . 1 . 2]" 1
1238 1 86 ILE MD 1 94 TYR QE . . 3.790 3.406 3.005 3.781 . 0 0 "[ . 1 . 2]" 1
1239 1 86 ILE MD 1 108 PHE QE . . 3.970 3.810 3.525 3.964 . 0 0 "[ . 1 . 2]" 1
1240 1 86 ILE MD 1 113 ILE HB . . 4.440 4.023 3.572 4.331 . 0 0 "[ . 1 . 2]" 1
1241 1 86 ILE MD 1 113 ILE HG12 . . 5.500 5.290 5.102 5.502 0.002 6 0 "[ . 1 . 2]" 1
1242 1 86 ILE MD 1 113 ILE HG13 . . 4.480 3.988 3.763 4.230 . 0 0 "[ . 1 . 2]" 1
1243 1 86 ILE MD 1 113 ILE MG . . 3.000 2.235 1.956 2.496 . 0 0 "[ . 1 . 2]" 1
1244 1 86 ILE MD 1 115 ILE HA . . 4.410 3.867 3.706 4.061 . 0 0 "[ . 1 . 2]" 1
1245 1 86 ILE MD 1 115 ILE MD . . 2.870 1.931 1.749 2.051 . 0 0 "[ . 1 . 2]" 1
1246 1 86 ILE MD 1 115 ILE HG12 . . 4.320 4.054 3.838 4.207 . 0 0 "[ . 1 . 2]" 1
1247 1 86 ILE MD 1 115 ILE HG13 . . 4.810 3.991 3.657 4.205 . 0 0 "[ . 1 . 2]" 1
1248 1 86 ILE MD 1 115 ILE MG . . 3.840 3.596 3.410 3.759 . 0 0 "[ . 1 . 2]" 1
1249 1 86 ILE HG12 1 94 TYR HB2 . . 5.500 4.143 3.594 4.421 . 0 0 "[ . 1 . 2]" 1
1250 1 86 ILE HG12 1 94 TYR HB3 . . 4.400 2.869 2.275 3.091 . 0 0 "[ . 1 . 2]" 1
1251 1 86 ILE HG12 1 108 PHE QE . . 4.330 3.217 2.937 3.405 . 0 0 "[ . 1 . 2]" 1
1252 1 86 ILE HG12 1 108 PHE HZ . . 4.450 3.796 3.507 4.008 . 0 0 "[ . 1 . 2]" 1
1253 1 86 ILE HG13 1 86 ILE MG . . 3.680 3.177 3.146 3.201 . 0 0 "[ . 1 . 2]" 1
1254 1 86 ILE HG13 1 87 GLN H . . 5.120 4.904 4.692 5.008 . 0 0 "[ . 1 . 2]" 1
1255 1 86 ILE HG13 1 108 PHE QE . . 4.680 4.147 3.762 4.329 . 0 0 "[ . 1 . 2]" 1
1256 1 86 ILE HG13 1 108 PHE HZ . . 4.550 4.288 3.816 4.546 . 0 0 "[ . 1 . 2]" 1
1257 1 86 ILE HG13 1 113 ILE MG . . 4.760 3.814 3.571 3.996 . 0 0 "[ . 1 . 2]" 1
1258 1 86 ILE HG13 1 115 ILE MD . . 4.340 4.114 3.904 4.272 . 0 0 "[ . 1 . 2]" 1
1259 1 86 ILE MG 1 87 GLN H . . 3.680 2.663 2.219 2.960 . 0 0 "[ . 1 . 2]" 1
1260 1 86 ILE MG 1 87 GLN HA . . 4.200 3.747 3.607 3.945 . 0 0 "[ . 1 . 2]" 1
1261 1 86 ILE MG 1 87 GLN QG . . 5.340 4.479 4.269 4.649 . 0 0 "[ . 1 . 2]" 1
1262 1 86 ILE MG 1 88 GLU H . . 3.390 2.902 2.522 3.138 . 0 0 "[ . 1 . 2]" 1
1263 1 86 ILE MG 1 89 THR H . . 5.500 4.655 4.369 4.843 . 0 0 "[ . 1 . 2]" 1
1264 1 86 ILE MG 1 89 THR MG . . 4.380 4.048 3.894 4.381 0.001 20 0 "[ . 1 . 2]" 1
1265 1 86 ILE MG 1 94 TYR HA . . 4.260 3.905 3.736 4.114 . 0 0 "[ . 1 . 2]" 1
1266 1 86 ILE MG 1 94 TYR HB2 . . 5.500 4.461 4.265 4.636 . 0 0 "[ . 1 . 2]" 1
1267 1 86 ILE MG 1 94 TYR HB3 . . 3.560 3.010 2.810 3.246 . 0 0 "[ . 1 . 2]" 1
1268 1 86 ILE MG 1 94 TYR QD . . 3.400 2.666 2.241 3.090 . 0 0 "[ . 1 . 2]" 1
1269 1 86 ILE MG 1 94 TYR QE . . 3.850 3.478 3.010 3.865 0.015 13 0 "[ . 1 . 2]" 1
1270 1 86 ILE MG 1 95 ARG H . . 3.410 2.948 2.622 3.256 . 0 0 "[ . 1 . 2]" 1
1271 1 86 ILE MG 1 115 ILE MD . . 3.850 3.702 3.488 3.814 . 0 0 "[ . 1 . 2]" 1
1272 1 87 GLN H 1 87 GLN HB2 . . 3.840 2.599 2.472 2.695 . 0 0 "[ . 1 . 2]" 1
1273 1 87 GLN H 1 87 GLN HB3 . . 3.770 3.714 3.653 3.770 0.000 19 0 "[ . 1 . 2]" 1
1274 1 87 GLN H 1 87 GLN HG2 . . 4.390 3.228 2.417 3.627 . 0 0 "[ . 1 . 2]" 1
1275 1 87 GLN H 1 87 GLN QG . . 3.800 2.597 2.381 2.915 . 0 0 "[ . 1 . 2]" 1
1276 1 87 GLN H 1 87 GLN HG3 . . 4.390 2.955 2.496 3.826 . 0 0 "[ . 1 . 2]" 1
1277 1 87 GLN H 1 88 GLU H . . 3.240 2.106 1.921 2.265 . 0 0 "[ . 1 . 2]" 1
1278 1 87 GLN H 1 95 ARG H . . 5.330 4.018 3.837 4.222 . 0 0 "[ . 1 . 2]" 1
1279 1 87 GLN H 1 96 GLY HA2 . . 4.240 3.266 3.060 3.462 . 0 0 "[ . 1 . 2]" 1
1280 1 87 GLN H 1 96 GLY HA3 . . 4.240 3.219 2.902 3.457 . 0 0 "[ . 1 . 2]" 1
1281 1 87 GLN H 1 97 TYR H . . 5.330 5.093 4.767 5.339 0.009 6 0 "[ . 1 . 2]" 1
1282 1 87 GLN HA 1 87 GLN QE . . 5.340 4.573 3.959 5.002 . 0 0 "[ . 1 . 2]" 1
1283 1 87 GLN HA 1 87 GLN HG2 . . 4.160 2.588 2.383 2.937 . 0 0 "[ . 1 . 2]" 1
1284 1 87 GLN HA 1 87 GLN QG . . 3.600 2.522 2.338 2.853 . 0 0 "[ . 1 . 2]" 1
1285 1 87 GLN HA 1 87 GLN HG3 . . 4.160 3.500 3.176 3.872 . 0 0 "[ . 1 . 2]" 1
1286 1 87 GLN HB2 1 88 GLU H . . 3.610 2.641 2.545 2.816 . 0 0 "[ . 1 . 2]" 1
1287 1 87 GLN HB2 1 96 GLY H . . 5.500 5.258 4.471 5.506 0.006 14 0 "[ . 1 . 2]" 1
1288 1 87 GLN QE 1 87 GLN QG . . 3.060 2.137 2.067 2.238 . 0 0 "[ . 1 . 2]" 1
1289 1 87 GLN QE 1 96 GLY QA . . 5.180 3.895 2.209 4.800 . 0 0 "[ . 1 . 2]" 1
1290 1 87 GLN QE 1 97 TYR QD . . 4.470 3.536 2.444 4.449 . 0 0 "[ . 1 . 2]" 1
1291 1 87 GLN QE 1 97 TYR QE . . 3.940 2.556 1.793 3.119 . 0 0 "[ . 1 . 2]" 1
1292 1 87 GLN HE22 1 87 GLN HG2 . . 4.090 3.726 3.437 4.061 . 0 0 "[ . 1 . 2]" 1
1293 1 87 GLN HE22 1 87 GLN HG3 . . 4.090 3.616 3.438 4.073 . 0 0 "[ . 1 . 2]" 1
1294 1 87 GLN QG 1 88 GLU H . . 4.390 3.916 3.827 4.087 . 0 0 "[ . 1 . 2]" 1
1295 1 87 GLN QG 1 96 GLY H . . 5.340 5.101 4.750 5.345 0.005 3 0 "[ . 1 . 2]" 1
1296 1 87 GLN QG 1 96 GLY QA . . 3.720 2.556 2.252 2.836 . 0 0 "[ . 1 . 2]" 1
1297 1 87 GLN QG 1 97 TYR H . . 4.390 4.177 3.919 4.394 0.004 10 0 "[ . 1 . 2]" 1
1298 1 87 GLN QG 1 97 TYR QD . . 4.730 4.158 3.842 4.433 . 0 0 "[ . 1 . 2]" 1
1299 1 87 GLN QG 1 97 TYR QE . . 4.130 3.919 3.496 4.135 0.005 13 0 "[ . 1 . 2]" 1
1300 1 87 GLN HG2 1 88 GLU H . . 5.140 4.630 4.102 4.935 . 0 0 "[ . 1 . 2]" 1
1301 1 87 GLN HG2 1 96 GLY HA2 . . 5.160 4.044 3.123 4.522 . 0 0 "[ . 1 . 2]" 1
1302 1 87 GLN HG2 1 96 GLY HA3 . . 5.160 4.666 3.857 5.156 . 0 0 "[ . 1 . 2]" 1
1303 1 87 GLN HG2 1 97 TYR QE . . 4.860 4.681 4.308 4.865 0.005 11 0 "[ . 1 . 2]" 1
1304 1 87 GLN HG3 1 88 GLU H . . 5.140 4.295 4.042 4.773 . 0 0 "[ . 1 . 2]" 1
1305 1 87 GLN HG3 1 96 GLY HA2 . . 5.160 2.738 2.327 3.291 . 0 0 "[ . 1 . 2]" 1
1306 1 87 GLN HG3 1 96 GLY HA3 . . 5.160 3.692 3.142 4.672 . 0 0 "[ . 1 . 2]" 1
1307 1 87 GLN HG3 1 97 TYR QE . . 4.860 4.220 3.639 4.568 . 0 0 "[ . 1 . 2]" 1
1308 1 88 GLU H 1 88 GLU QB . . 3.320 2.654 2.469 2.752 . 0 0 "[ . 1 . 2]" 1
1309 1 88 GLU H 1 88 GLU QG . . 4.440 3.947 3.116 4.345 . 0 0 "[ . 1 . 2]" 1
1310 1 88 GLU H 1 89 THR H . . 4.570 4.414 4.342 4.464 . 0 0 "[ . 1 . 2]" 1
1311 1 88 GLU H 1 94 TYR HA . . 5.500 5.418 5.135 5.528 0.028 10 0 "[ . 1 . 2]" 1
1312 1 88 GLU H 1 94 TYR HB3 . . 5.410 5.273 4.684 5.414 0.004 9 0 "[ . 1 . 2]" 1
1313 1 88 GLU H 1 94 TYR QD . . 5.500 5.301 5.047 5.494 . 0 0 "[ . 1 . 2]" 1
1314 1 88 GLU H 1 95 ARG H . . 3.680 3.333 3.019 3.432 . 0 0 "[ . 1 . 2]" 1
1315 1 88 GLU H 1 95 ARG QB . . 3.890 2.415 1.995 3.059 . 0 0 "[ . 1 . 2]" 1
1316 1 88 GLU H 1 95 ARG QG . . 5.130 4.119 2.799 4.806 . 0 0 "[ . 1 . 2]" 1
1317 1 88 GLU HA 1 89 THR H . . 3.120 2.390 2.242 2.520 . 0 0 "[ . 1 . 2]" 1
1318 1 88 GLU QB 1 89 THR H . . 3.500 2.932 2.172 3.469 . 0 0 "[ . 1 . 2]" 1
1319 1 88 GLU QB 1 95 ARG H . . 4.610 4.168 3.868 4.577 . 0 0 "[ . 1 . 2]" 1
1320 1 88 GLU QB 1 95 ARG QB . . 3.340 1.990 1.866 2.291 . 0 0 "[ . 1 . 2]" 1
1321 1 88 GLU QB 1 95 ARG HE . . 5.090 4.317 1.729 5.120 0.030 11 0 "[ . 1 . 2]" 1
1322 1 88 GLU HB2 1 89 THR H . . 4.330 3.868 3.389 4.201 . 0 0 "[ . 1 . 2]" 1
1323 1 88 GLU HB2 1 95 ARG HB2 . . 4.400 3.883 2.550 4.416 0.016 20 0 "[ . 1 . 2]" 1
1324 1 88 GLU HB2 1 95 ARG HB3 . . 4.400 2.857 1.993 3.459 . 0 0 "[ . 1 . 2]" 1
1325 1 88 GLU HB3 1 89 THR H . . 4.330 3.088 2.198 3.855 . 0 0 "[ . 1 . 2]" 1
1326 1 88 GLU HB3 1 95 ARG HB2 . . 4.400 3.052 2.437 4.368 . 0 0 "[ . 1 . 2]" 1
1327 1 88 GLU HB3 1 95 ARG HB3 . . 4.400 2.491 1.985 4.092 . 0 0 "[ . 1 . 2]" 1
1328 1 88 GLU QG 1 89 THR H . . 3.900 2.678 1.775 3.926 0.026 11 0 "[ . 1 . 2]" 1
1329 1 88 GLU QG 1 95 ARG QB . . 4.290 3.552 2.975 4.025 . 0 0 "[ . 1 . 2]" 1
1330 1 88 GLU QG 1 95 ARG HD2 . . 5.500 4.899 3.925 5.522 0.022 3 0 "[ . 1 . 2]" 1
1331 1 88 GLU QG 1 95 ARG HD3 . . 5.500 4.920 3.318 5.513 0.013 7 0 "[ . 1 . 2]" 1
1332 1 89 THR H 1 89 THR HB . . 3.400 2.831 2.697 2.947 . 0 0 "[ . 1 . 2]" 1
1333 1 89 THR H 1 89 THR MG . . 3.980 3.926 3.876 3.978 . 0 0 "[ . 1 . 2]" 1
1334 1 89 THR H 1 90 CYS H . . 4.470 4.130 3.988 4.301 . 0 0 "[ . 1 . 2]" 1
1335 1 89 THR H 1 95 ARG H . . 5.100 4.981 4.766 5.106 0.006 11 0 "[ . 1 . 2]" 1
1336 1 89 THR HB 1 90 CYS H . . 4.370 4.257 3.996 4.364 . 0 0 "[ . 1 . 2]" 1
1337 1 89 THR HB 1 94 TYR QD . . 4.640 4.162 3.742 4.531 . 0 0 "[ . 1 . 2]" 1
1338 1 89 THR MG 1 90 CYS H . . 3.480 2.781 2.256 3.178 . 0 0 "[ . 1 . 2]" 1
1339 1 89 THR MG 1 90 CYS HA . . 4.140 3.740 3.502 4.061 . 0 0 "[ . 1 . 2]" 1
1340 1 89 THR MG 1 91 GLY H . . 4.490 4.225 3.433 4.491 0.001 14 0 "[ . 1 . 2]" 1
1341 1 89 THR MG 1 94 TYR H . . 5.490 4.713 4.385 5.274 . 0 0 "[ . 1 . 2]" 1
1342 1 89 THR MG 1 94 TYR HA . . 4.290 2.955 2.562 3.438 . 0 0 "[ . 1 . 2]" 1
1343 1 89 THR MG 1 94 TYR QD . . 3.640 2.356 1.992 2.929 . 0 0 "[ . 1 . 2]" 1
1344 1 89 THR MG 1 94 TYR QE . . 3.560 2.295 1.838 2.893 . 0 0 "[ . 1 . 2]" 1
1345 1 89 THR MG 1 110 LYS QE . . 3.500 2.701 1.738 3.522 0.022 17 0 "[ . 1 . 2]" 1
1346 1 89 THR MG 1 110 LYS QG . . 4.410 3.274 2.862 4.074 . 0 0 "[ . 1 . 2]" 1
1347 1 90 CYS H 1 90 CYS HB2 . . 4.160 2.831 2.365 3.705 . 0 0 "[ . 1 . 2]" 1
1348 1 90 CYS H 1 90 CYS QB . . 3.420 2.556 2.332 2.931 . 0 0 "[ . 1 . 2]" 1
1349 1 90 CYS H 1 90 CYS HB3 . . 4.160 3.273 2.514 3.817 . 0 0 "[ . 1 . 2]" 1
1350 1 90 CYS H 1 93 TRP H . . 4.300 3.725 3.321 4.112 . 0 0 "[ . 1 . 2]" 1
1351 1 90 CYS H 1 93 TRP QB . . 4.240 3.931 3.616 4.225 . 0 0 "[ . 1 . 2]" 1
1352 1 90 CYS H 1 94 TYR HA . . 4.070 3.217 2.831 3.509 . 0 0 "[ . 1 . 2]" 1
1353 1 90 CYS H 1 94 TYR QD . . 4.650 4.456 3.819 4.650 0.000 7 0 "[ . 1 . 2]" 1
1354 1 90 CYS H 1 95 ARG H . . 4.770 4.523 4.139 4.763 . 0 0 "[ . 1 . 2]" 1
1355 1 90 CYS H 1 95 ARG QB . . 5.340 3.983 3.585 4.259 . 0 0 "[ . 1 . 2]" 1
1356 1 90 CYS HA 1 91 GLY H . . 3.460 2.171 2.143 2.212 . 0 0 "[ . 1 . 2]" 1
1357 1 90 CYS HA 1 91 GLY HA2 . . 4.950 4.384 4.372 4.420 . 0 0 "[ . 1 . 2]" 1
1358 1 90 CYS HA 1 91 GLY QA . . 4.320 3.925 3.895 3.954 . 0 0 "[ . 1 . 2]" 1
1359 1 90 CYS HA 1 91 GLY HA3 . . 4.950 4.430 4.328 4.497 . 0 0 "[ . 1 . 2]" 1
1360 1 90 CYS QB 1 93 TRP QB . . 3.900 3.465 2.776 3.906 0.006 18 0 "[ . 1 . 2]" 1
1361 1 90 CYS HB2 1 91 GLY H . . 5.440 4.167 3.380 4.593 . 0 0 "[ . 1 . 2]" 1
1362 1 90 CYS HB3 1 91 GLY H . . 5.440 3.705 2.998 4.391 . 0 0 "[ . 1 . 2]" 1
1363 1 91 GLY QA 1 92 ASP H . . 3.110 2.119 2.107 2.178 . 0 0 "[ . 1 . 2]" 1
1364 1 91 GLY QA 1 92 ASP HA . . 4.650 3.938 3.929 3.975 . 0 0 "[ . 1 . 2]" 1
1365 1 91 GLY QA 1 93 TRP H . . 4.300 3.632 3.264 4.072 . 0 0 "[ . 1 . 2]" 1
1366 1 91 GLY HA2 1 92 ASP HA . . 5.320 4.447 4.380 4.533 . 0 0 "[ . 1 . 2]" 1
1367 1 91 GLY HA3 1 92 ASP HA . . 5.320 4.395 4.379 4.446 . 0 0 "[ . 1 . 2]" 1
1368 1 92 ASP H 1 92 ASP HB2 . . 4.020 2.520 2.256 3.500 . 0 0 "[ . 1 . 2]" 1
1369 1 92 ASP H 1 92 ASP QB . . 3.450 2.414 2.231 2.903 . 0 0 "[ . 1 . 2]" 1
1370 1 92 ASP H 1 92 ASP HB3 . . 4.020 3.389 2.756 3.818 . 0 0 "[ . 1 . 2]" 1
1371 1 92 ASP H 1 93 TRP H . . 3.360 2.991 2.644 3.234 . 0 0 "[ . 1 . 2]" 1
1372 1 92 ASP H 1 93 TRP HD1 . . 4.050 2.572 2.326 3.079 . 0 0 "[ . 1 . 2]" 1
1373 1 92 ASP HA 1 110 LYS HD2 . . 4.140 2.927 2.002 4.147 0.007 2 0 "[ . 1 . 2]" 1
1374 1 92 ASP HA 1 110 LYS QD . . 3.610 2.133 1.836 2.739 . 0 0 "[ . 1 . 2]" 1
1375 1 92 ASP HA 1 110 LYS HD3 . . 4.140 2.231 1.994 2.780 . 0 0 "[ . 1 . 2]" 1
1376 1 92 ASP HA 1 110 LYS QE . . 4.060 3.491 2.000 4.009 . 0 0 "[ . 1 . 2]" 1
1377 1 92 ASP QB 1 93 TRP H . . 3.900 3.864 3.749 3.909 0.009 2 0 "[ . 1 . 2]" 1
1378 1 92 ASP QB 1 93 TRP HD1 . . 3.720 2.736 2.549 3.087 . 0 0 "[ . 1 . 2]" 1
1379 1 92 ASP QB 1 93 TRP HE1 . . 4.240 3.321 2.943 3.651 . 0 0 "[ . 1 . 2]" 1
1380 1 92 ASP QB 1 110 LYS QD . . 4.640 3.739 3.202 4.604 . 0 0 "[ . 1 . 2]" 1
1381 1 92 ASP HB2 1 93 TRP HD1 . . 4.350 3.114 2.663 3.880 . 0 0 "[ . 1 . 2]" 1
1382 1 92 ASP HB2 1 93 TRP HE1 . . 4.970 3.845 3.110 4.968 . 0 0 "[ . 1 . 2]" 1
1383 1 92 ASP HB3 1 93 TRP HD1 . . 4.350 3.504 2.589 4.333 . 0 0 "[ . 1 . 2]" 1
1384 1 92 ASP HB3 1 93 TRP HE1 . . 4.970 4.070 2.981 4.961 . 0 0 "[ . 1 . 2]" 1
1385 1 93 TRP H 1 93 TRP QB . . 3.250 2.779 2.625 2.886 . 0 0 "[ . 1 . 2]" 1
1386 1 93 TRP H 1 93 TRP HD1 . . 3.530 3.168 2.514 3.508 . 0 0 "[ . 1 . 2]" 1
1387 1 93 TRP H 1 94 TYR H . . 4.560 4.295 4.177 4.461 . 0 0 "[ . 1 . 2]" 1
1388 1 93 TRP H 1 94 TYR HA . . 4.950 4.646 4.547 4.871 . 0 0 "[ . 1 . 2]" 1
1389 1 93 TRP H 1 109 PRO HA . . 5.370 5.184 4.727 5.374 0.004 13 0 "[ . 1 . 2]" 1
1390 1 93 TRP H 1 110 LYS QG . . 4.690 3.201 2.765 3.749 . 0 0 "[ . 1 . 2]" 1
1391 1 93 TRP HA 1 94 TYR H . . 3.260 2.218 2.170 2.322 . 0 0 "[ . 1 . 2]" 1
1392 1 93 TRP HA 1 107 ILE MD . . 5.500 5.351 5.169 5.503 0.003 14 0 "[ . 1 . 2]" 1
1393 1 93 TRP HA 1 108 PHE H . . 4.550 4.333 4.038 4.585 0.035 13 0 "[ . 1 . 2]" 1
1394 1 93 TRP HA 1 109 PRO HA . . 3.500 2.621 2.353 2.716 . 0 0 "[ . 1 . 2]" 1
1395 1 93 TRP HA 1 109 PRO HB3 . . 5.460 4.842 4.590 4.956 . 0 0 "[ . 1 . 2]" 1
1396 1 93 TRP HA 1 110 LYS H . . 3.960 2.550 2.093 2.889 . 0 0 "[ . 1 . 2]" 1
1397 1 93 TRP HA 1 110 LYS QB . . 5.340 4.237 3.599 4.585 . 0 0 "[ . 1 . 2]" 1
1398 1 93 TRP HA 1 110 LYS HG2 . . 5.040 3.528 2.459 4.042 . 0 0 "[ . 1 . 2]" 1
1399 1 93 TRP HA 1 110 LYS QG . . 4.190 2.357 2.114 3.141 . 0 0 "[ . 1 . 2]" 1
1400 1 93 TRP HA 1 110 LYS HG3 . . 5.040 2.600 2.124 4.792 . 0 0 "[ . 1 . 2]" 1
1401 1 93 TRP QB 1 93 TRP HE3 . . 3.830 2.409 2.376 2.452 . 0 0 "[ . 1 . 2]" 1
1402 1 93 TRP QB 1 94 TYR H . . 3.510 2.904 2.595 3.090 . 0 0 "[ . 1 . 2]" 1
1403 1 93 TRP QB 1 107 ILE HA . . 4.780 4.721 4.541 4.788 0.008 11 0 "[ . 1 . 2]" 1
1404 1 93 TRP QB 1 107 ILE HB . . 3.830 2.784 2.602 2.938 . 0 0 "[ . 1 . 2]" 1
1405 1 93 TRP QB 1 107 ILE MD . . 4.130 3.018 2.752 3.233 . 0 0 "[ . 1 . 2]" 1
1406 1 93 TRP QB 1 107 ILE MG . . 4.220 3.645 3.384 3.909 . 0 0 "[ . 1 . 2]" 1
1407 1 93 TRP QB 1 108 PHE H . . 4.040 3.295 2.947 3.565 . 0 0 "[ . 1 . 2]" 1
1408 1 93 TRP QB 1 109 PRO HA . . 4.330 3.915 3.517 4.170 . 0 0 "[ . 1 . 2]" 1
1409 1 93 TRP QB 1 110 LYS H . . 4.880 4.586 4.173 4.881 0.001 6 0 "[ . 1 . 2]" 1
1410 1 93 TRP QB 1 110 LYS QG . . 5.140 4.132 3.882 4.759 . 0 0 "[ . 1 . 2]" 1
1411 1 93 TRP HE3 1 107 ILE HB . . 4.000 2.952 2.475 3.368 . 0 0 "[ . 1 . 2]" 1
1412 1 93 TRP HE3 1 107 ILE MD . . 3.870 3.044 2.487 3.388 . 0 0 "[ . 1 . 2]" 1
1413 1 93 TRP HZ3 1 107 ILE MD . . 4.890 3.991 3.219 4.377 . 0 0 "[ . 1 . 2]" 1
1414 1 93 TRP HZ3 1 108 PHE HA . . 4.450 2.647 1.998 3.199 . 0 0 "[ . 1 . 2]" 1
1415 1 93 TRP HZ3 1 109 PRO HD3 . . 4.560 2.469 1.999 3.553 . 0 0 "[ . 1 . 2]" 1
1416 1 94 TYR H 1 94 TYR HB2 . . 3.730 2.323 2.292 2.360 . 0 0 "[ . 1 . 2]" 1
1417 1 94 TYR H 1 94 TYR HB3 . . 3.920 3.583 3.555 3.607 . 0 0 "[ . 1 . 2]" 1
1418 1 94 TYR H 1 94 TYR QD . . 3.920 3.442 3.213 3.571 . 0 0 "[ . 1 . 2]" 1
1419 1 94 TYR H 1 95 ARG H . . 4.680 4.549 4.467 4.576 . 0 0 "[ . 1 . 2]" 1
1420 1 94 TYR H 1 107 ILE HA . . 5.080 4.869 4.580 5.092 0.012 13 0 "[ . 1 . 2]" 1
1421 1 94 TYR H 1 107 ILE HB . . 4.460 4.241 3.839 4.464 0.004 12 0 "[ . 1 . 2]" 1
1422 1 94 TYR H 1 108 PHE H . . 3.850 2.940 2.657 3.180 . 0 0 "[ . 1 . 2]" 1
1423 1 94 TYR H 1 108 PHE QD . . 4.280 3.684 3.296 3.987 . 0 0 "[ . 1 . 2]" 1
1424 1 94 TYR H 1 109 PRO HA . . 4.040 3.854 3.681 3.986 . 0 0 "[ . 1 . 2]" 1
1425 1 94 TYR H 1 110 LYS H . . 4.180 3.699 3.138 4.066 . 0 0 "[ . 1 . 2]" 1
1426 1 94 TYR H 1 110 LYS HA . . 5.000 4.126 3.810 4.556 . 0 0 "[ . 1 . 2]" 1
1427 1 94 TYR H 1 110 LYS QD . . 5.340 4.356 4.026 5.011 . 0 0 "[ . 1 . 2]" 1
1428 1 94 TYR H 1 110 LYS QG . . 4.560 2.970 2.674 4.289 . 0 0 "[ . 1 . 2]" 1
1429 1 94 TYR HA 1 94 TYR QD . . 3.530 2.170 1.983 2.397 . 0 0 "[ . 1 . 2]" 1
1430 1 94 TYR HA 1 94 TYR QE . . 4.570 4.271 4.203 4.370 . 0 0 "[ . 1 . 2]" 1
1431 1 94 TYR HA 1 95 ARG H . . 3.210 2.419 2.215 2.614 . 0 0 "[ . 1 . 2]" 1
1432 1 94 TYR HA 1 95 ARG QB . . 5.270 3.897 3.822 4.040 . 0 0 "[ . 1 . 2]" 1
1433 1 94 TYR HB2 1 95 ARG H . . 4.200 3.759 3.430 4.153 . 0 0 "[ . 1 . 2]" 1
1434 1 94 TYR HB2 1 108 PHE H . . 4.480 3.660 3.266 3.919 . 0 0 "[ . 1 . 2]" 1
1435 1 94 TYR HB2 1 108 PHE QD . . 4.510 2.589 2.339 2.911 . 0 0 "[ . 1 . 2]" 1
1436 1 94 TYR HB2 1 108 PHE QE . . 4.310 2.521 2.205 2.863 . 0 0 "[ . 1 . 2]" 1
1437 1 94 TYR HB2 1 108 PHE HZ . . 5.100 4.221 3.958 4.458 . 0 0 "[ . 1 . 2]" 1
1438 1 94 TYR HB3 1 95 ARG H . . 3.780 2.419 1.993 2.994 . 0 0 "[ . 1 . 2]" 1
1439 1 94 TYR HB3 1 108 PHE QE . . 4.210 2.755 2.299 3.228 . 0 0 "[ . 1 . 2]" 1
1440 1 94 TYR HB3 1 108 PHE HZ . . 5.500 3.793 3.416 4.089 . 0 0 "[ . 1 . 2]" 1
1441 1 94 TYR QD 1 95 ARG H . . 3.880 3.187 3.016 3.355 . 0 0 "[ . 1 . 2]" 1
1442 1 94 TYR QD 1 108 PHE QD . . 3.640 2.969 2.616 3.184 . 0 0 "[ . 1 . 2]" 1
1443 1 94 TYR QD 1 108 PHE QE . . 3.790 3.188 2.678 3.555 . 0 0 "[ . 1 . 2]" 1
1444 1 94 TYR QD 1 110 LYS H . . 4.890 4.228 4.049 4.401 . 0 0 "[ . 1 . 2]" 1
1445 1 94 TYR QD 1 110 LYS HA . . 3.590 2.106 1.997 2.218 . 0 0 "[ . 1 . 2]" 1
1446 1 94 TYR QD 1 110 LYS HB2 . . 5.240 4.622 3.590 4.763 . 0 0 "[ . 1 . 2]" 1
1447 1 94 TYR QD 1 110 LYS QB . . 4.590 3.538 2.878 3.787 . 0 0 "[ . 1 . 2]" 1
1448 1 94 TYR QD 1 110 LYS HB3 . . 5.240 3.677 3.030 3.988 . 0 0 "[ . 1 . 2]" 1
1449 1 94 TYR QD 1 110 LYS QE . . 5.030 4.104 3.261 5.027 . 0 0 "[ . 1 . 2]" 1
1450 1 94 TYR QD 1 110 LYS QG . . 4.690 2.982 2.712 4.496 . 0 0 "[ . 1 . 2]" 1
1451 1 94 TYR QD 1 113 ILE H . . 4.810 3.988 3.704 4.264 . 0 0 "[ . 1 . 2]" 1
1452 1 94 TYR QD 1 113 ILE HB . . 4.330 2.358 2.000 2.754 . 0 0 "[ . 1 . 2]" 1
1453 1 94 TYR QD 1 113 ILE MD . . 4.160 3.883 3.762 4.049 . 0 0 "[ . 1 . 2]" 1
1454 1 94 TYR QD 1 113 ILE HG12 . . 4.120 2.818 2.592 3.062 . 0 0 "[ . 1 . 2]" 1
1455 1 94 TYR QD 1 113 ILE HG13 . . 4.090 2.300 2.113 2.527 . 0 0 "[ . 1 . 2]" 1
1456 1 94 TYR QD 1 113 ILE MG . . 4.010 3.150 2.922 3.458 . 0 0 "[ . 1 . 2]" 1
1457 1 94 TYR QD 1 115 ILE MD . . 4.590 4.007 3.762 4.207 . 0 0 "[ . 1 . 2]" 1
1458 1 94 TYR QE 1 95 ARG H . . 5.500 5.447 5.281 5.532 0.032 17 0 "[ . 1 . 2]" 1
1459 1 94 TYR QE 1 110 LYS HA . . 3.380 2.347 1.993 2.613 . 0 0 "[ . 1 . 2]" 1
1460 1 94 TYR QE 1 110 LYS HB2 . . 4.820 3.857 2.420 4.409 . 0 0 "[ . 1 . 2]" 1
1461 1 94 TYR QE 1 110 LYS HB3 . . 4.820 2.435 2.018 3.029 . 0 0 "[ . 1 . 2]" 1
1462 1 94 TYR QE 1 110 LYS HD2 . . 4.890 4.078 2.737 4.745 . 0 0 "[ . 1 . 2]" 1
1463 1 94 TYR QE 1 110 LYS QD . . 4.310 3.798 2.687 4.240 . 0 0 "[ . 1 . 2]" 1
1464 1 94 TYR QE 1 110 LYS HD3 . . 4.890 4.675 3.915 4.908 0.018 7 0 "[ . 1 . 2]" 1
1465 1 94 TYR QE 1 110 LYS QE . . 4.180 3.057 2.396 4.176 . 0 0 "[ . 1 . 2]" 1
1466 1 94 TYR QE 1 110 LYS HG2 . . 5.000 3.166 2.766 4.758 . 0 0 "[ . 1 . 2]" 1
1467 1 94 TYR QE 1 110 LYS QG . . 4.300 3.060 2.700 4.140 . 0 0 "[ . 1 . 2]" 1
1468 1 94 TYR QE 1 110 LYS HG3 . . 5.000 4.220 3.774 4.870 . 0 0 "[ . 1 . 2]" 1
1469 1 94 TYR QE 1 112 PHE H . . 5.180 5.130 4.898 5.193 0.013 13 0 "[ . 1 . 2]" 1
1470 1 94 TYR QE 1 113 ILE H . . 4.160 3.878 3.680 4.117 . 0 0 "[ . 1 . 2]" 1
1471 1 94 TYR QE 1 113 ILE HB . . 3.360 2.181 1.997 2.508 . 0 0 "[ . 1 . 2]" 1
1472 1 94 TYR QE 1 113 ILE HG12 . . 4.420 4.162 3.858 4.427 0.007 13 0 "[ . 1 . 2]" 1
1473 1 94 TYR QE 1 113 ILE HG13 . . 4.240 3.996 3.693 4.232 . 0 0 "[ . 1 . 2]" 1
1474 1 94 TYR QE 1 113 ILE MG . . 3.460 3.041 2.808 3.255 . 0 0 "[ . 1 . 2]" 1
1475 1 94 TYR QE 1 115 ILE H . . 5.150 4.875 4.497 5.157 0.007 13 0 "[ . 1 . 2]" 1
1476 1 94 TYR QE 1 115 ILE MD . . 3.720 3.042 2.692 3.398 . 0 0 "[ . 1 . 2]" 1
1477 1 94 TYR QE 1 115 ILE HG12 . . 5.030 3.590 3.076 3.997 . 0 0 "[ . 1 . 2]" 1
1478 1 94 TYR QE 1 115 ILE HG13 . . 4.650 4.047 3.585 4.444 . 0 0 "[ . 1 . 2]" 1
1479 1 95 ARG H 1 95 ARG HB2 . . 3.770 2.952 2.472 3.527 . 0 0 "[ . 1 . 2]" 1
1480 1 95 ARG H 1 95 ARG HB3 . . 3.770 2.935 2.688 3.560 . 0 0 "[ . 1 . 2]" 1
1481 1 95 ARG H 1 95 ARG QD . . 5.040 4.601 4.349 4.870 . 0 0 "[ . 1 . 2]" 1
1482 1 95 ARG H 1 96 GLY H . . 4.590 4.191 3.948 4.481 . 0 0 "[ . 1 . 2]" 1
1483 1 95 ARG H 1 107 ILE MG . . 4.820 4.523 4.179 4.827 0.007 17 0 "[ . 1 . 2]" 1
1484 1 95 ARG H 1 108 PHE QE . . 4.950 4.695 4.385 4.944 . 0 0 "[ . 1 . 2]" 1
1485 1 95 ARG H 1 108 PHE HZ . . 5.500 4.904 4.493 5.284 . 0 0 "[ . 1 . 2]" 1
1486 1 95 ARG HA 1 95 ARG QD . . 4.500 3.078 2.099 4.094 . 0 0 "[ . 1 . 2]" 1
1487 1 95 ARG HA 1 95 ARG HG2 . . 4.130 2.720 2.136 3.933 . 0 0 "[ . 1 . 2]" 1
1488 1 95 ARG HA 1 95 ARG HG3 . . 4.130 3.223 2.666 3.593 . 0 0 "[ . 1 . 2]" 1
1489 1 95 ARG HA 1 96 GLY H . . 3.140 2.172 2.144 2.384 . 0 0 "[ . 1 . 2]" 1
1490 1 95 ARG HA 1 107 ILE HA . . 3.570 2.728 2.487 3.095 . 0 0 "[ . 1 . 2]" 1
1491 1 95 ARG HA 1 107 ILE HB . . 4.790 4.056 3.834 4.554 . 0 0 "[ . 1 . 2]" 1
1492 1 95 ARG HA 1 107 ILE MG . . 3.480 2.389 1.969 2.836 . 0 0 "[ . 1 . 2]" 1
1493 1 95 ARG HA 1 108 PHE QE . . 4.810 4.454 3.930 4.814 0.004 15 0 "[ . 1 . 2]" 1
1494 1 95 ARG QB 1 95 ARG QD . . 3.260 2.244 2.043 2.699 . 0 0 "[ . 1 . 2]" 1
1495 1 95 ARG QB 1 95 ARG HE . . 4.880 3.558 1.890 4.325 . 0 0 "[ . 1 . 2]" 1
1496 1 95 ARG QB 1 96 GLY H . . 4.090 3.714 2.568 3.907 . 0 0 "[ . 1 . 2]" 1
1497 1 95 ARG QB 1 107 ILE HA . . 5.340 4.594 3.996 4.901 . 0 0 "[ . 1 . 2]" 1
1498 1 95 ARG QB 1 107 ILE MG . . 3.540 3.010 2.292 3.563 0.023 13 0 "[ . 1 . 2]" 1
1499 1 95 ARG QD 1 96 GLY H . . 4.320 3.364 2.403 4.343 0.023 13 0 "[ . 1 . 2]" 1
1500 1 95 ARG HD2 1 96 GLY H . . 5.140 4.166 2.970 5.195 0.055 13 0 "[ . 1 . 2]" 1
1501 1 95 ARG HD2 1 107 ILE MG . . 4.430 3.646 1.886 4.466 0.036 15 0 "[ . 1 . 2]" 1
1502 1 95 ARG HD3 1 96 GLY H . . 5.140 4.042 2.424 5.149 0.009 6 0 "[ . 1 . 2]" 1
1503 1 95 ARG HD3 1 107 ILE MG . . 4.430 3.709 2.475 4.432 0.002 4 0 "[ . 1 . 2]" 1
1504 1 95 ARG HE 1 95 ARG QG . . 3.580 2.532 2.187 3.088 . 0 0 "[ . 1 . 2]" 1
1505 1 95 ARG QG 1 96 GLY H . . 3.470 3.148 2.123 3.474 0.004 3 0 "[ . 1 . 2]" 1
1506 1 95 ARG QG 1 107 ILE HA . . 5.340 4.107 3.169 5.216 . 0 0 "[ . 1 . 2]" 1
1507 1 95 ARG QG 1 107 ILE MG . . 3.670 2.492 1.732 3.671 0.001 12 0 "[ . 1 . 2]" 1
1508 1 95 ARG HG2 1 107 ILE MG . . 4.310 2.800 1.766 4.328 0.018 6 0 "[ . 1 . 2]" 1
1509 1 95 ARG HG3 1 107 ILE MG . . 4.310 3.207 2.023 4.264 . 0 0 "[ . 1 . 2]" 1
1510 1 96 GLY H 1 97 TYR H . . 4.700 4.245 4.110 4.416 . 0 0 "[ . 1 . 2]" 1
1511 1 96 GLY H 1 106 GLY H . . 4.010 3.724 3.445 3.964 . 0 0 "[ . 1 . 2]" 1
1512 1 96 GLY H 1 107 ILE HA . . 4.030 3.361 3.069 3.827 . 0 0 "[ . 1 . 2]" 1
1513 1 96 GLY H 1 107 ILE MG . . 4.110 3.649 3.277 4.051 . 0 0 "[ . 1 . 2]" 1
1514 1 96 GLY H 1 108 PHE H . . 5.500 5.167 4.873 5.549 0.049 13 0 "[ . 1 . 2]" 1
1515 1 96 GLY H 1 108 PHE QE . . 3.780 3.365 2.899 3.798 0.018 12 0 "[ . 1 . 2]" 1
1516 1 96 GLY H 1 108 PHE HZ . . 4.410 3.875 3.388 4.334 . 0 0 "[ . 1 . 2]" 1
1517 1 96 GLY QA 1 97 TYR QD . . 4.360 3.710 3.486 3.774 . 0 0 "[ . 1 . 2]" 1
1518 1 96 GLY QA 1 108 PHE QE . . 4.450 3.730 3.396 3.984 . 0 0 "[ . 1 . 2]" 1
1519 1 96 GLY QA 1 108 PHE HZ . . 4.180 3.105 2.770 3.365 . 0 0 "[ . 1 . 2]" 1
1520 1 96 GLY HA2 1 97 TYR H . . 3.430 2.945 2.835 3.051 . 0 0 "[ . 1 . 2]" 1
1521 1 96 GLY HA3 1 97 TYR H . . 3.430 2.249 2.189 2.324 . 0 0 "[ . 1 . 2]" 1
1522 1 97 TYR H 1 97 TYR QD . . 3.620 3.408 3.338 3.467 . 0 0 "[ . 1 . 2]" 1
1523 1 97 TYR H 1 97 TYR QE . . 4.900 4.571 4.496 4.657 . 0 0 "[ . 1 . 2]" 1
1524 1 97 TYR H 1 98 LEU H . . 4.970 4.376 4.360 4.392 . 0 0 "[ . 1 . 2]" 1
1525 1 97 TYR H 1 99 ILE QG . . 5.340 4.788 4.605 5.054 . 0 0 "[ . 1 . 2]" 1
1526 1 97 TYR H 1 105 GLN QG . . 5.500 5.301 5.156 5.507 0.007 16 0 "[ . 1 . 2]" 1
1527 1 97 TYR H 1 108 PHE QE . . 4.250 4.121 3.853 4.257 0.007 7 0 "[ . 1 . 2]" 1
1528 1 97 TYR H 1 108 PHE HZ . . 4.930 3.952 3.734 4.136 . 0 0 "[ . 1 . 2]" 1
1529 1 97 TYR HA 1 97 TYR QD . . 3.840 3.684 3.667 3.716 . 0 0 "[ . 1 . 2]" 1
1530 1 97 TYR HA 1 98 LEU H . . 3.550 2.444 2.360 2.577 . 0 0 "[ . 1 . 2]" 1
1531 1 97 TYR HA 1 98 LEU HB2 . . 5.420 4.360 4.299 4.482 . 0 0 "[ . 1 . 2]" 1
1532 1 97 TYR HA 1 105 GLN HA . . 4.020 2.551 2.321 2.723 . 0 0 "[ . 1 . 2]" 1
1533 1 97 TYR HA 1 105 GLN HB2 . . 5.500 5.301 5.080 5.509 0.009 17 0 "[ . 1 . 2]" 1
1534 1 97 TYR HA 1 105 GLN HB3 . . 4.660 4.025 3.763 4.331 . 0 0 "[ . 1 . 2]" 1
1535 1 97 TYR HA 1 105 GLN QG . . 4.560 3.830 3.568 4.198 . 0 0 "[ . 1 . 2]" 1
1536 1 97 TYR HA 1 106 GLY H . . 4.500 3.293 2.922 3.540 . 0 0 "[ . 1 . 2]" 1
1537 1 97 TYR HA 1 108 PHE QE . . 4.480 3.494 3.231 3.765 . 0 0 "[ . 1 . 2]" 1
1538 1 97 TYR HB2 1 98 LEU H . . 4.580 2.357 2.108 2.541 . 0 0 "[ . 1 . 2]" 1
1539 1 97 TYR HB2 1 102 LYS HA . . 4.230 3.302 2.911 3.527 . 0 0 "[ . 1 . 2]" 1
1540 1 97 TYR HB2 1 104 LEU H . . 4.700 4.220 3.965 4.496 . 0 0 "[ . 1 . 2]" 1
1541 1 97 TYR HB2 1 105 GLN HA . . 4.140 2.900 2.669 3.170 . 0 0 "[ . 1 . 2]" 1
1542 1 97 TYR HB2 1 105 GLN HB3 . . 4.410 3.734 3.409 4.147 . 0 0 "[ . 1 . 2]" 1
1543 1 97 TYR HB2 1 105 GLN QE . . 4.840 4.074 3.148 4.840 . 0 0 "[ . 1 . 2]" 1
1544 1 97 TYR HB2 1 105 GLN QG . . 3.860 2.234 1.986 2.664 . 0 0 "[ . 1 . 2]" 1
1545 1 97 TYR HB2 1 106 GLY H . . 5.500 4.674 4.435 4.985 . 0 0 "[ . 1 . 2]" 1
1546 1 97 TYR HB3 1 98 LEU H . . 3.810 3.725 3.568 3.822 0.012 9 0 "[ . 1 . 2]" 1
1547 1 97 TYR HB3 1 102 LYS HA . . 4.950 4.819 4.510 4.969 0.019 9 0 "[ . 1 . 2]" 1
1548 1 97 TYR HB3 1 105 GLN HA . . 4.300 2.607 2.227 2.849 . 0 0 "[ . 1 . 2]" 1
1549 1 97 TYR HB3 1 105 GLN QG . . 4.590 2.142 1.991 2.591 . 0 0 "[ . 1 . 2]" 1
1550 1 97 TYR QD 1 98 LEU H . . 4.200 3.093 2.709 3.301 . 0 0 "[ . 1 . 2]" 1
1551 1 97 TYR QD 1 98 LEU HB3 . . 4.670 4.323 4.033 4.524 . 0 0 "[ . 1 . 2]" 1
1552 1 97 TYR QD 1 99 ILE H . . 4.800 3.616 3.464 3.776 . 0 0 "[ . 1 . 2]" 1
1553 1 97 TYR QD 1 99 ILE HA . . 3.490 3.074 3.014 3.304 . 0 0 "[ . 1 . 2]" 1
1554 1 97 TYR QD 1 99 ILE MD . . 5.300 5.282 5.194 5.351 0.051 17 0 "[ . 1 . 2]" 1
1555 1 97 TYR QD 1 99 ILE QG . . 4.580 3.742 3.645 3.850 . 0 0 "[ . 1 . 2]" 1
1556 1 97 TYR QD 1 99 ILE MG . . 4.800 4.783 4.679 4.849 0.049 20 0 "[ . 1 . 2]" 1
1557 1 97 TYR QD 1 102 LYS HA . . 3.560 3.246 2.764 3.482 . 0 0 "[ . 1 . 2]" 1
1558 1 97 TYR QD 1 102 LYS QB . . 4.660 4.377 3.856 4.601 . 0 0 "[ . 1 . 2]" 1
1559 1 97 TYR QD 1 102 LYS HD2 . . 5.500 4.691 2.803 5.511 0.011 16 0 "[ . 1 . 2]" 1
1560 1 97 TYR QD 1 102 LYS QD . . 4.830 3.856 2.621 4.464 . 0 0 "[ . 1 . 2]" 1
1561 1 97 TYR QD 1 102 LYS HD3 . . 5.500 4.315 2.666 5.504 0.004 11 0 "[ . 1 . 2]" 1
1562 1 97 TYR QD 1 102 LYS QE . . 5.210 4.605 3.203 5.247 0.037 17 0 "[ . 1 . 2]" 1
1563 1 97 TYR QD 1 102 LYS QG . . 4.480 3.049 2.507 4.482 0.002 15 0 "[ . 1 . 2]" 1
1564 1 97 TYR QD 1 104 LEU H . . 5.500 5.450 5.248 5.544 0.044 17 0 "[ . 1 . 2]" 1
1565 1 97 TYR QD 1 105 GLN HA . . 4.820 4.495 4.143 4.699 . 0 0 "[ . 1 . 2]" 1
1566 1 97 TYR QD 1 105 GLN HB3 . . 5.200 3.650 2.930 4.260 . 0 0 "[ . 1 . 2]" 1
1567 1 97 TYR QD 1 105 GLN QG . . 3.960 3.180 2.666 3.543 . 0 0 "[ . 1 . 2]" 1
1568 1 97 TYR QD 1 106 GLY H . . 5.450 5.237 4.773 5.472 0.022 17 0 "[ . 1 . 2]" 1
1569 1 97 TYR QE 1 99 ILE H . . 4.980 4.430 4.120 4.623 . 0 0 "[ . 1 . 2]" 1
1570 1 97 TYR QE 1 99 ILE HA . . 3.490 2.438 2.058 2.572 . 0 0 "[ . 1 . 2]" 1
1571 1 97 TYR QE 1 99 ILE HB . . 5.230 5.166 4.886 5.249 0.019 9 0 "[ . 1 . 2]" 1
1572 1 97 TYR QE 1 99 ILE MD . . 4.750 4.702 4.491 4.757 0.007 10 0 "[ . 1 . 2]" 1
1573 1 97 TYR QE 1 99 ILE QG . . 3.770 3.175 3.079 3.402 . 0 0 "[ . 1 . 2]" 1
1574 1 97 TYR QE 1 99 ILE MG . . 3.660 3.560 3.382 3.664 0.004 15 0 "[ . 1 . 2]" 1
1575 1 97 TYR QE 1 102 LYS HA . . 4.500 4.347 4.109 4.503 0.003 5 0 "[ . 1 . 2]" 1
1576 1 97 TYR QE 1 102 LYS QB . . 4.790 4.398 3.996 4.664 . 0 0 "[ . 1 . 2]" 1
1577 1 97 TYR QE 1 102 LYS HD2 . . 5.090 3.820 2.415 4.681 . 0 0 "[ . 1 . 2]" 1
1578 1 97 TYR QE 1 102 LYS QD . . 4.370 2.923 2.063 3.855 . 0 0 "[ . 1 . 2]" 1
1579 1 97 TYR QE 1 102 LYS HD3 . . 5.090 3.288 2.107 4.941 . 0 0 "[ . 1 . 2]" 1
1580 1 97 TYR QE 1 102 LYS QE . . 4.800 3.236 2.002 4.628 . 0 0 "[ . 1 . 2]" 1
1581 1 97 TYR QE 1 102 LYS HG2 . . 4.860 2.989 2.382 4.457 . 0 0 "[ . 1 . 2]" 1
1582 1 97 TYR QE 1 102 LYS QG . . 4.120 2.735 2.259 4.103 . 0 0 "[ . 1 . 2]" 1
1583 1 97 TYR QE 1 102 LYS HG3 . . 4.860 3.480 2.344 4.797 . 0 0 "[ . 1 . 2]" 1
1584 1 98 LEU H 1 98 LEU HB2 . . 3.720 2.334 2.225 2.617 . 0 0 "[ . 1 . 2]" 1
1585 1 98 LEU H 1 98 LEU MD1 . . 4.230 3.810 3.622 4.129 . 0 0 "[ . 1 . 2]" 1
1586 1 98 LEU H 1 98 LEU HG . . 4.740 4.582 4.495 4.644 . 0 0 "[ . 1 . 2]" 1
1587 1 98 LEU H 1 101 HIS H . . 5.500 4.954 4.756 5.222 . 0 0 "[ . 1 . 2]" 1
1588 1 98 LEU H 1 102 LYS HA . . 4.890 3.981 3.023 4.294 . 0 0 "[ . 1 . 2]" 1
1589 1 98 LEU H 1 104 LEU H . . 5.500 4.168 3.927 4.416 . 0 0 "[ . 1 . 2]" 1
1590 1 98 LEU HA 1 98 LEU MD1 . . 3.410 2.004 1.937 2.149 . 0 0 "[ . 1 . 2]" 1
1591 1 98 LEU HA 1 98 LEU MD2 . . 4.050 3.797 3.715 3.856 . 0 0 "[ . 1 . 2]" 1
1592 1 98 LEU HA 1 98 LEU HG . . 3.790 2.984 2.826 3.270 . 0 0 "[ . 1 . 2]" 1
1593 1 98 LEU HA 1 99 ILE H . . 3.240 2.143 2.139 2.157 . 0 0 "[ . 1 . 2]" 1
1594 1 98 LEU HA 1 99 ILE HB . . 5.020 4.700 4.626 4.962 . 0 0 "[ . 1 . 2]" 1
1595 1 98 LEU HA 1 99 ILE QG . . 5.340 3.612 3.414 3.705 . 0 0 "[ . 1 . 2]" 1
1596 1 98 LEU HA 1 100 LYS H . . 4.770 4.089 3.849 4.335 . 0 0 "[ . 1 . 2]" 1
1597 1 98 LEU HB2 1 98 LEU MD1 . . 3.310 2.369 2.275 2.513 . 0 0 "[ . 1 . 2]" 1
1598 1 98 LEU HB2 1 98 LEU MD2 . . 3.530 2.272 2.089 2.350 . 0 0 "[ . 1 . 2]" 1
1599 1 98 LEU HB2 1 99 ILE H . . 4.900 4.469 4.240 4.530 . 0 0 "[ . 1 . 2]" 1
1600 1 98 LEU HB2 1 101 HIS H . . 4.840 4.296 3.836 4.633 . 0 0 "[ . 1 . 2]" 1
1601 1 98 LEU HB3 1 98 LEU MD1 . . 3.210 3.188 3.172 3.196 . 0 0 "[ . 1 . 2]" 1
1602 1 98 LEU HB3 1 98 LEU MD2 . . 3.390 2.368 2.275 2.545 . 0 0 "[ . 1 . 2]" 1
1603 1 98 LEU HB3 1 99 ILE H . . 4.840 4.137 4.028 4.280 . 0 0 "[ . 1 . 2]" 1
1604 1 98 LEU HB3 1 100 LYS H . . 5.010 4.428 3.889 4.873 . 0 0 "[ . 1 . 2]" 1
1605 1 98 LEU HB3 1 100 LYS QG . . 4.360 3.482 3.097 3.802 . 0 0 "[ . 1 . 2]" 1
1606 1 98 LEU HB3 1 101 HIS H . . 4.340 2.719 2.171 3.182 . 0 0 "[ . 1 . 2]" 1
1607 1 98 LEU MD1 1 99 ILE H . . 3.350 2.910 2.323 3.341 . 0 0 "[ . 1 . 2]" 1
1608 1 98 LEU MD1 1 100 LYS H . . 3.880 3.508 2.526 3.891 0.011 4 0 "[ . 1 . 2]" 1
1609 1 98 LEU MD1 1 100 LYS QE . . 4.480 3.564 2.131 4.468 . 0 0 "[ . 1 . 2]" 1
1610 1 98 LEU MD1 1 100 LYS QG . . 3.810 2.664 1.892 3.484 . 0 0 "[ . 1 . 2]" 1
1611 1 98 LEU MD1 1 101 HIS H . . 5.070 4.051 3.527 4.465 . 0 0 "[ . 1 . 2]" 1
1612 1 98 LEU MD1 1 101 HIS HD2 . . 5.010 4.666 4.072 5.023 0.013 15 0 "[ . 1 . 2]" 1
1613 1 98 LEU MD2 1 99 ILE H . . 5.050 4.826 4.485 4.916 . 0 0 "[ . 1 . 2]" 1
1614 1 98 LEU MD2 1 100 LYS H . . 4.560 4.298 4.028 4.520 . 0 0 "[ . 1 . 2]" 1
1615 1 98 LEU MD2 1 100 LYS QE . . 4.140 3.275 1.849 3.983 . 0 0 "[ . 1 . 2]" 1
1616 1 98 LEU MD2 1 101 HIS H . . 4.820 3.364 2.875 3.832 . 0 0 "[ . 1 . 2]" 1
1617 1 98 LEU MD2 1 101 HIS HA . . 5.500 4.671 4.216 4.965 . 0 0 "[ . 1 . 2]" 1
1618 1 98 LEU MD2 1 101 HIS HB2 . . 4.390 2.256 1.823 2.630 . 0 0 "[ . 1 . 2]" 1
1619 1 98 LEU MD2 1 101 HIS QB . . 3.690 2.236 1.810 2.602 . 0 0 "[ . 1 . 2]" 1
1620 1 98 LEU MD2 1 101 HIS HB3 . . 4.390 3.665 3.070 4.110 . 0 0 "[ . 1 . 2]" 1
1621 1 98 LEU HG 1 99 ILE H . . 4.250 3.507 3.072 3.789 . 0 0 "[ . 1 . 2]" 1
1622 1 98 LEU HG 1 99 ILE HA . . 5.420 5.136 4.577 5.405 . 0 0 "[ . 1 . 2]" 1
1623 1 98 LEU HG 1 100 LYS H . . 3.430 2.885 2.683 3.054 . 0 0 "[ . 1 . 2]" 1
1624 1 98 LEU HG 1 100 LYS HA . . 5.040 4.874 4.552 5.098 0.058 15 0 "[ . 1 . 2]" 1
1625 1 98 LEU HG 1 100 LYS HG2 . . 3.270 2.005 1.899 2.099 . 0 0 "[ . 1 . 2]" 1
1626 1 98 LEU HG 1 100 LYS HG3 . . 3.270 2.180 1.987 3.423 0.153 15 0 "[ . 1 . 2]" 1
1627 1 98 LEU HG 1 101 HIS H . . 4.180 2.552 1.906 3.036 . 0 0 "[ . 1 . 2]" 1
1628 1 98 LEU HG 1 101 HIS QB . . 4.210 3.338 2.697 3.731 . 0 0 "[ . 1 . 2]" 1
1629 1 98 LEU HG 1 101 HIS HD2 . . 4.300 3.871 3.505 4.268 . 0 0 "[ . 1 . 2]" 1
1630 1 99 ILE H 1 99 ILE HB . . 3.410 2.649 2.576 2.814 . 0 0 "[ . 1 . 2]" 1
1631 1 99 ILE H 1 99 ILE MD . . 3.900 3.405 3.242 3.605 . 0 0 "[ . 1 . 2]" 1
1632 1 99 ILE H 1 99 ILE HG12 . . 3.890 3.219 2.616 3.419 . 0 0 "[ . 1 . 2]" 1
1633 1 99 ILE H 1 99 ILE QG . . 3.350 1.895 1.848 1.986 . 0 0 "[ . 1 . 2]" 1
1634 1 99 ILE H 1 99 ILE HG13 . . 3.890 1.910 1.862 1.999 . 0 0 "[ . 1 . 2]" 1
1635 1 99 ILE H 1 99 ILE MG . . 3.880 3.760 3.739 3.765 . 0 0 "[ . 1 . 2]" 1
1636 1 99 ILE H 1 100 LYS H . . 4.280 2.821 2.701 2.947 . 0 0 "[ . 1 . 2]" 1
1637 1 99 ILE HA 1 99 ILE MD . . 3.910 3.871 3.783 3.909 . 0 0 "[ . 1 . 2]" 1
1638 1 99 ILE HA 1 99 ILE HG12 . . 4.150 2.662 2.573 2.758 . 0 0 "[ . 1 . 2]" 1
1639 1 99 ILE HA 1 99 ILE QG . . 3.640 2.487 2.449 2.590 . 0 0 "[ . 1 . 2]" 1
1640 1 99 ILE HA 1 99 ILE HG13 . . 4.150 3.020 2.850 3.479 . 0 0 "[ . 1 . 2]" 1
1641 1 99 ILE HA 1 99 ILE MG . . 3.160 2.259 2.207 2.297 . 0 0 "[ . 1 . 2]" 1
1642 1 99 ILE HA 1 101 HIS H . . 4.870 3.952 3.598 4.339 . 0 0 "[ . 1 . 2]" 1
1643 1 99 ILE HA 1 102 LYS QB . . 5.500 5.205 4.871 5.502 0.002 13 0 "[ . 1 . 2]" 1
1644 1 99 ILE HA 1 102 LYS QD . . 5.340 4.125 2.276 5.141 . 0 0 "[ . 1 . 2]" 1
1645 1 99 ILE HA 1 102 LYS QE . . 5.370 4.153 2.732 5.312 . 0 0 "[ . 1 . 2]" 1
1646 1 99 ILE HB 1 99 ILE MD . . 3.330 2.330 2.163 2.547 . 0 0 "[ . 1 . 2]" 1
1647 1 99 ILE HB 1 100 LYS H . . 3.620 2.362 2.249 2.611 . 0 0 "[ . 1 . 2]" 1
1648 1 99 ILE MD 1 99 ILE MG . . 2.790 2.044 1.873 2.293 . 0 0 "[ . 1 . 2]" 1
1649 1 99 ILE QG 1 99 ILE MG . . 2.830 2.285 2.216 2.383 . 0 0 "[ . 1 . 2]" 1
1650 1 99 ILE HG12 1 99 ILE MG . . 3.390 2.342 2.262 2.462 . 0 0 "[ . 1 . 2]" 1
1651 1 99 ILE HG13 1 99 ILE MG . . 3.390 3.184 3.171 3.196 . 0 0 "[ . 1 . 2]" 1
1652 1 99 ILE MG 1 100 LYS H . . 3.640 3.396 3.203 3.611 . 0 0 "[ . 1 . 2]" 1
1653 1 99 ILE MG 1 100 LYS HA . . 4.240 3.598 3.387 4.019 . 0 0 "[ . 1 . 2]" 1
1654 1 100 LYS H 1 100 LYS HB2 . . 3.840 3.582 3.565 3.605 . 0 0 "[ . 1 . 2]" 1
1655 1 100 LYS H 1 100 LYS HB3 . . 3.840 2.648 2.341 2.769 . 0 0 "[ . 1 . 2]" 1
1656 1 100 LYS H 1 100 LYS HG2 . . 4.000 2.061 1.880 2.621 . 0 0 "[ . 1 . 2]" 1
1657 1 100 LYS H 1 100 LYS QG . . 3.430 2.027 1.865 2.587 . 0 0 "[ . 1 . 2]" 1
1658 1 100 LYS H 1 100 LYS HG3 . . 4.000 3.076 2.737 3.977 . 0 0 "[ . 1 . 2]" 1
1659 1 100 LYS H 1 101 HIS H . . 3.950 2.688 2.401 2.785 . 0 0 "[ . 1 . 2]" 1
1660 1 100 LYS HA 1 100 LYS QE . . 5.180 4.613 4.005 5.260 0.080 8 0 "[ . 1 . 2]" 1
1661 1 100 LYS HA 1 100 LYS HG2 . . 4.040 3.721 3.610 3.968 . 0 0 "[ . 1 . 2]" 1
1662 1 100 LYS HA 1 100 LYS HG3 . . 4.040 3.782 3.582 4.205 0.165 20 0 "[ . 1 . 2]" 1
1663 1 100 LYS QB 1 100 LYS QE . . 3.730 2.419 1.838 3.477 . 0 0 "[ . 1 . 2]" 1
1664 1 100 LYS QE 1 100 LYS QG . . 3.060 2.279 2.027 2.705 . 0 0 "[ . 1 . 2]" 1
1665 1 100 LYS QG 1 101 HIS H . . 4.190 2.384 1.883 2.725 . 0 0 "[ . 1 . 2]" 1
1666 1 100 LYS QG 1 101 HIS QB . . 4.310 2.954 2.445 3.286 . 0 0 "[ . 1 . 2]" 1
1667 1 100 LYS HG2 1 101 HIS H . . 4.770 3.063 1.898 3.616 . 0 0 "[ . 1 . 2]" 1
1668 1 100 LYS HG3 1 101 HIS H . . 4.770 2.626 2.138 3.784 . 0 0 "[ . 1 . 2]" 1
1669 1 101 HIS H 1 102 LYS H . . 4.410 3.738 3.209 3.927 . 0 0 "[ . 1 . 2]" 1
1670 1 101 HIS H 1 102 LYS HA . . 5.500 4.422 4.279 4.570 . 0 0 "[ . 1 . 2]" 1
1671 1 101 HIS H 1 104 LEU QD . . 5.440 4.243 3.917 4.773 . 0 0 "[ . 1 . 2]" 1
1672 1 101 HIS HA 1 102 LYS H . . 3.120 2.213 2.154 2.477 . 0 0 "[ . 1 . 2]" 1
1673 1 101 HIS HA 1 103 MET H . . 4.330 3.420 3.063 3.881 . 0 0 "[ . 1 . 2]" 1
1674 1 101 HIS QB 1 102 LYS H . . 3.900 3.645 3.508 3.901 0.001 20 0 "[ . 1 . 2]" 1
1675 1 101 HIS QB 1 103 MET H . . 4.840 2.883 2.583 3.591 . 0 0 "[ . 1 . 2]" 1
1676 1 101 HIS QB 1 104 LEU H . . 4.340 3.771 3.348 4.147 . 0 0 "[ . 1 . 2]" 1
1677 1 101 HIS QB 1 104 LEU QB . . 5.340 4.397 3.573 5.389 0.049 16 0 "[ . 1 . 2]" 1
1678 1 101 HIS QB 1 104 LEU QD . . 3.400 2.104 1.741 3.366 . 0 0 "[ . 1 . 2]" 1
1679 1 101 HIS QB 1 104 LEU HG . . 4.390 3.844 2.196 4.390 0.000 5 0 "[ . 1 . 2]" 1
1680 1 101 HIS HB2 1 102 LYS H . . 4.650 4.455 4.283 4.547 . 0 0 "[ . 1 . 2]" 1
1681 1 101 HIS HB2 1 104 LEU H . . 5.100 4.482 3.986 4.880 . 0 0 "[ . 1 . 2]" 1
1682 1 101 HIS HB3 1 102 LYS H . . 4.650 3.875 3.724 4.296 . 0 0 "[ . 1 . 2]" 1
1683 1 101 HIS HB3 1 104 LEU H . . 5.100 4.089 3.513 4.852 . 0 0 "[ . 1 . 2]" 1
1684 1 101 HIS HD2 1 104 LEU QD . . 4.560 3.980 3.358 4.534 . 0 0 "[ . 1 . 2]" 1
1685 1 102 LYS H 1 102 LYS QB . . 3.190 2.327 2.180 2.575 . 0 0 "[ . 1 . 2]" 1
1686 1 102 LYS H 1 102 LYS HG2 . . 3.960 3.487 2.051 3.982 0.022 17 0 "[ . 1 . 2]" 1
1687 1 102 LYS H 1 102 LYS HG3 . . 3.960 3.005 2.364 3.712 . 0 0 "[ . 1 . 2]" 1
1688 1 102 LYS H 1 103 MET H . . 3.890 2.840 2.518 3.231 . 0 0 "[ . 1 . 2]" 1
1689 1 102 LYS HA 1 102 LYS QD . . 4.600 3.520 2.445 4.138 . 0 0 "[ . 1 . 2]" 1
1690 1 102 LYS HA 1 102 LYS QE . . 5.500 4.501 3.376 5.042 . 0 0 "[ . 1 . 2]" 1
1691 1 102 LYS HA 1 102 LYS HG2 . . 4.180 2.592 2.180 3.646 . 0 0 "[ . 1 . 2]" 1
1692 1 102 LYS HA 1 102 LYS HG3 . . 4.180 3.118 2.350 3.884 . 0 0 "[ . 1 . 2]" 1
1693 1 102 LYS HA 1 104 LEU H . . 4.410 3.321 3.112 3.622 . 0 0 "[ . 1 . 2]" 1
1694 1 102 LYS QB 1 102 LYS QE . . 4.330 2.982 1.982 3.745 . 0 0 "[ . 1 . 2]" 1
1695 1 102 LYS QB 1 103 MET H . . 3.760 3.538 2.773 3.870 0.110 16 0 "[ . 1 . 2]" 1
1696 1 102 LYS QB 1 105 GLN QG . . 4.750 4.248 3.723 4.612 . 0 0 "[ . 1 . 2]" 1
1697 1 102 LYS QE 1 102 LYS QG . . 3.290 2.259 2.032 2.620 . 0 0 "[ . 1 . 2]" 1
1698 1 102 LYS QG 1 103 MET H . . 4.600 4.505 4.204 4.609 0.009 5 0 "[ . 1 . 2]" 1
1699 1 102 LYS HG2 1 103 MET H . . 5.360 5.018 4.395 5.373 0.013 20 0 "[ . 1 . 2]" 1
1700 1 102 LYS HG3 1 103 MET H . . 5.360 5.153 4.694 5.365 0.005 7 0 "[ . 1 . 2]" 1
1701 1 103 MET H 1 103 MET HB2 . . 3.640 2.675 2.200 3.712 0.072 17 0 "[ . 1 . 2]" 1
1702 1 103 MET H 1 103 MET QB . . 3.110 2.387 2.178 2.830 . 0 0 "[ . 1 . 2]" 1
1703 1 103 MET H 1 103 MET HB3 . . 3.640 3.347 2.489 3.661 0.021 18 0 "[ . 1 . 2]" 1
1704 1 103 MET H 1 103 MET ME . . 4.410 3.721 2.635 4.443 0.033 17 0 "[ . 1 . 2]" 1
1705 1 103 MET H 1 103 MET HG2 . . 4.130 3.305 1.947 4.114 . 0 0 "[ . 1 . 2]" 1
1706 1 103 MET H 1 103 MET QG . . 3.620 2.814 1.937 3.563 . 0 0 "[ . 1 . 2]" 1
1707 1 103 MET H 1 103 MET HG3 . . 4.130 3.442 2.461 4.136 0.006 9 0 "[ . 1 . 2]" 1
1708 1 103 MET H 1 104 LEU H . . 3.390 2.390 2.019 2.861 . 0 0 "[ . 1 . 2]" 1
1709 1 103 MET H 1 104 LEU HA . . 5.440 5.049 4.764 5.445 0.005 20 0 "[ . 1 . 2]" 1
1710 1 103 MET H 1 104 LEU QD . . 3.800 2.767 2.251 3.780 . 0 0 "[ . 1 . 2]" 1
1711 1 103 MET H 1 104 LEU HG . . 4.630 4.246 3.244 4.636 0.006 1 0 "[ . 1 . 2]" 1
1712 1 103 MET HA 1 103 MET ME . . 4.590 3.756 1.822 4.628 0.038 16 0 "[ . 1 . 2]" 1
1713 1 103 MET HA 1 103 MET HG2 . . 4.000 3.076 2.233 3.896 . 0 0 "[ . 1 . 2]" 1
1714 1 103 MET HA 1 103 MET QG . . 3.420 2.676 2.191 3.338 . 0 0 "[ . 1 . 2]" 1
1715 1 103 MET HA 1 103 MET HG3 . . 4.000 3.240 2.411 4.119 0.119 16 0 "[ . 1 . 2]" 1
1716 1 103 MET HA 1 104 LEU H . . 3.440 3.354 3.216 3.462 0.022 16 0 "[ . 1 . 2]" 1
1717 1 103 MET HA 1 105 GLN QG . . 4.880 4.557 4.028 4.877 . 0 0 "[ . 1 . 2]" 1
1718 1 103 MET QB 1 104 LEU HA . . 4.630 4.354 4.042 4.748 0.118 16 0 "[ . 1 . 2]" 1
1719 1 103 MET QB 1 104 LEU QD . . 4.420 2.599 2.053 4.291 . 0 0 "[ . 1 . 2]" 1
1720 1 103 MET HB2 1 104 LEU H . . 4.230 3.595 3.113 4.225 . 0 0 "[ . 1 . 2]" 1
1721 1 103 MET HB3 1 104 LEU H . . 4.230 4.062 3.640 4.249 0.019 1 0 "[ . 1 . 2]" 1
1722 1 103 MET ME 1 103 MET QG . . 3.540 2.330 1.988 2.604 . 0 0 "[ . 1 . 2]" 1
1723 1 103 MET ME 1 104 LEU QD . . 4.460 3.722 2.252 4.425 . 0 0 "[ . 1 . 2]" 1
1724 1 103 MET QG 1 104 LEU H . . 5.080 4.071 2.467 4.835 . 0 0 "[ . 1 . 2]" 1
1725 1 103 MET QG 1 104 LEU QD . . 4.510 3.446 1.711 4.095 . 0 0 "[ . 1 . 2]" 1
1726 1 104 LEU H 1 104 LEU QB . . 3.200 2.967 2.698 3.210 0.010 14 0 "[ . 1 . 2]" 1
1727 1 104 LEU H 1 104 LEU QD . . 3.860 2.203 1.925 2.533 . 0 0 "[ . 1 . 2]" 1
1728 1 104 LEU H 1 104 LEU HG . . 3.660 2.785 1.961 3.497 . 0 0 "[ . 1 . 2]" 1
1729 1 104 LEU H 1 105 GLN H . . 4.330 4.237 4.044 4.374 0.044 16 0 "[ . 1 . 2]" 1
1730 1 104 LEU H 1 105 GLN QG . . 4.510 3.614 3.343 3.797 . 0 0 "[ . 1 . 2]" 1
1731 1 104 LEU HA 1 104 LEU QD . . 3.720 3.191 2.102 3.402 . 0 0 "[ . 1 . 2]" 1
1732 1 104 LEU HA 1 104 LEU HG . . 3.900 3.266 2.632 3.715 . 0 0 "[ . 1 . 2]" 1
1733 1 104 LEU HA 1 105 GLN H . . 2.860 2.155 2.140 2.189 . 0 0 "[ . 1 . 2]" 1
1734 1 104 LEU HA 1 105 GLN HA . . 5.170 4.401 4.388 4.431 . 0 0 "[ . 1 . 2]" 1
1735 1 104 LEU HA 1 105 GLN HB2 . . 5.120 4.802 4.704 4.934 . 0 0 "[ . 1 . 2]" 1
1736 1 104 LEU HA 1 105 GLN QG . . 4.330 3.536 3.214 4.287 . 0 0 "[ . 1 . 2]" 1
1737 1 104 LEU QB 1 105 GLN H . . 3.780 3.251 2.972 3.585 . 0 0 "[ . 1 . 2]" 1
1738 1 104 LEU QD 1 105 GLN QG . . 5.440 4.638 4.018 5.014 . 0 0 "[ . 1 . 2]" 1
1739 1 104 LEU HG 1 105 GLN H . . 5.500 4.818 4.535 5.497 . 0 0 "[ . 1 . 2]" 1
1740 1 105 GLN H 1 105 GLN HB2 . . 3.790 2.881 2.670 3.055 . 0 0 "[ . 1 . 2]" 1
1741 1 105 GLN H 1 105 GLN HB3 . . 4.070 3.867 3.762 3.953 . 0 0 "[ . 1 . 2]" 1
1742 1 105 GLN H 1 105 GLN QG . . 3.590 2.712 2.472 3.238 . 0 0 "[ . 1 . 2]" 1
1743 1 105 GLN H 1 106 GLY H . . 4.740 4.419 4.294 4.503 . 0 0 "[ . 1 . 2]" 1
1744 1 105 GLN HA 1 105 GLN QG . . 3.630 2.608 2.468 2.745 . 0 0 "[ . 1 . 2]" 1
1745 1 105 GLN HA 1 106 GLY H . . 3.090 2.272 2.184 2.378 . 0 0 "[ . 1 . 2]" 1
1746 1 105 GLN HB2 1 106 GLY H . . 3.920 3.697 3.442 3.893 . 0 0 "[ . 1 . 2]" 1
1747 1 105 GLN HB3 1 105 GLN QE . . 4.520 3.526 2.232 4.227 . 0 0 "[ . 1 . 2]" 1
1748 1 105 GLN HB3 1 106 GLY H . . 4.130 2.849 2.575 3.170 . 0 0 "[ . 1 . 2]" 1
1749 1 105 GLN QG 1 106 GLY H . . 4.380 4.225 4.109 4.371 . 0 0 "[ . 1 . 2]" 1
1750 1 106 GLY H 1 107 ILE H . . 4.590 4.239 4.185 4.308 . 0 0 "[ . 1 . 2]" 1
1751 1 106 GLY H 1 108 PHE QE . . 4.620 4.040 3.794 4.334 . 0 0 "[ . 1 . 2]" 1
1752 1 106 GLY HA2 1 107 ILE MG . . 4.500 3.521 3.271 3.742 . 0 0 "[ . 1 . 2]" 1
1753 1 106 GLY HA3 1 107 ILE MD . . 5.500 5.464 5.385 5.516 0.016 17 0 "[ . 1 . 2]" 1
1754 1 106 GLY HA3 1 107 ILE MG . . 4.390 4.154 3.848 4.374 . 0 0 "[ . 1 . 2]" 1
1755 1 106 GLY HA3 1 108 PHE QE . . 5.500 5.313 5.156 5.502 0.002 15 0 "[ . 1 . 2]" 1
1756 1 107 ILE H 1 107 ILE MD . . 4.220 3.902 3.862 3.984 . 0 0 "[ . 1 . 2]" 1
1757 1 107 ILE H 1 107 ILE HG12 . . 3.950 2.337 2.236 2.472 . 0 0 "[ . 1 . 2]" 1
1758 1 107 ILE H 1 107 ILE QG . . 3.400 2.209 2.161 2.306 . 0 0 "[ . 1 . 2]" 1
1759 1 107 ILE H 1 107 ILE HG13 . . 3.950 2.748 2.487 2.945 . 0 0 "[ . 1 . 2]" 1
1760 1 107 ILE H 1 107 ILE MG . . 3.740 3.078 2.876 3.280 . 0 0 "[ . 1 . 2]" 1
1761 1 107 ILE H 1 108 PHE H . . 4.670 4.457 4.439 4.472 . 0 0 "[ . 1 . 2]" 1
1762 1 107 ILE HA 1 107 ILE MD . . 4.440 4.174 4.158 4.180 . 0 0 "[ . 1 . 2]" 1
1763 1 107 ILE HA 1 107 ILE MG . . 3.300 2.251 2.102 2.419 . 0 0 "[ . 1 . 2]" 1
1764 1 107 ILE HA 1 108 PHE H . . 3.160 2.401 2.311 2.457 . 0 0 "[ . 1 . 2]" 1
1765 1 107 ILE HA 1 108 PHE QD . . 4.420 3.363 3.148 3.632 . 0 0 "[ . 1 . 2]" 1
1766 1 107 ILE HB 1 107 ILE MD . . 3.230 2.330 2.205 2.434 . 0 0 "[ . 1 . 2]" 1
1767 1 107 ILE HB 1 108 PHE H . . 3.570 2.383 2.252 2.604 . 0 0 "[ . 1 . 2]" 1
1768 1 107 ILE HB 1 108 PHE HA . . 5.190 4.175 4.056 4.310 . 0 0 "[ . 1 . 2]" 1
1769 1 107 ILE MD 1 107 ILE MG . . 2.970 2.107 1.931 2.336 . 0 0 "[ . 1 . 2]" 1
1770 1 107 ILE MD 1 108 PHE H . . 4.470 4.180 4.043 4.378 . 0 0 "[ . 1 . 2]" 1
1771 1 107 ILE MD 1 108 PHE HA . . 4.880 4.708 4.505 4.841 . 0 0 "[ . 1 . 2]" 1
1772 1 107 ILE QG 1 108 PHE H . . 4.710 3.683 3.524 3.864 . 0 0 "[ . 1 . 2]" 1
1773 1 107 ILE QG 1 108 PHE HA . . 5.340 3.790 3.586 4.015 . 0 0 "[ . 1 . 2]" 1
1774 1 107 ILE MG 1 108 PHE H . . 3.750 3.568 3.418 3.716 . 0 0 "[ . 1 . 2]" 1
1775 1 108 PHE H 1 108 PHE QD . . 4.880 3.270 3.131 3.335 . 0 0 "[ . 1 . 2]" 1
1776 1 108 PHE H 1 109 PRO HD2 . . 5.070 4.792 4.789 4.796 . 0 0 "[ . 1 . 2]" 1
1777 1 108 PHE HA 1 108 PHE QD . . 4.480 3.609 3.572 3.662 . 0 0 "[ . 1 . 2]" 1
1778 1 108 PHE HA 1 109 PRO HD3 . . 3.840 2.348 2.335 2.355 . 0 0 "[ . 1 . 2]" 1
1779 1 108 PHE QB 1 109 PRO HD2 . . 3.760 1.965 1.945 2.014 . 0 0 "[ . 1 . 2]" 1
1780 1 108 PHE QB 1 109 PRO HD3 . . 3.900 3.201 3.185 3.240 . 0 0 "[ . 1 . 2]" 1
1781 1 108 PHE QB 1 113 ILE MD . . 4.270 3.383 3.238 3.617 . 0 0 "[ . 1 . 2]" 1
1782 1 108 PHE HB2 1 109 PRO HD2 . . 4.400 2.015 1.982 2.069 . 0 0 "[ . 1 . 2]" 1
1783 1 108 PHE HB2 1 109 PRO HD3 . . 4.540 3.459 3.433 3.505 . 0 0 "[ . 1 . 2]" 1
1784 1 108 PHE HB2 1 113 ILE MD . . 5.070 3.519 3.358 3.771 . 0 0 "[ . 1 . 2]" 1
1785 1 108 PHE HB3 1 109 PRO HD2 . . 4.400 2.731 2.707 2.819 . 0 0 "[ . 1 . 2]" 1
1786 1 108 PHE HB3 1 109 PRO HD3 . . 4.540 3.776 3.751 3.852 . 0 0 "[ . 1 . 2]" 1
1787 1 108 PHE HB3 1 113 ILE MD . . 5.070 4.386 4.249 4.652 . 0 0 "[ . 1 . 2]" 1
1788 1 108 PHE QD 1 113 ILE H . . 4.960 4.648 4.492 4.870 . 0 0 "[ . 1 . 2]" 1
1789 1 108 PHE QD 1 113 ILE HB . . 4.680 4.072 3.922 4.396 . 0 0 "[ . 1 . 2]" 1
1790 1 108 PHE QD 1 113 ILE MD . . 3.400 2.686 2.402 2.981 . 0 0 "[ . 1 . 2]" 1
1791 1 108 PHE QD 1 113 ILE HG12 . . 3.870 2.291 2.159 2.693 . 0 0 "[ . 1 . 2]" 1
1792 1 108 PHE QD 1 113 ILE HG13 . . 3.880 2.102 1.997 2.441 . 0 0 "[ . 1 . 2]" 1
1793 1 108 PHE QE 1 113 ILE HB . . 5.110 4.251 4.111 4.474 . 0 0 "[ . 1 . 2]" 1
1794 1 108 PHE QE 1 113 ILE MD . . 3.760 2.759 2.489 3.023 . 0 0 "[ . 1 . 2]" 1
1795 1 108 PHE QE 1 113 ILE HG12 . . 4.170 3.595 3.484 3.798 . 0 0 "[ . 1 . 2]" 1
1796 1 108 PHE QE 1 113 ILE HG13 . . 4.030 2.027 1.995 2.220 . 0 0 "[ . 1 . 2]" 1
1797 1 108 PHE QE 1 113 ILE MG . . 3.750 3.188 2.992 3.477 . 0 0 "[ . 1 . 2]" 1
1798 1 108 PHE HZ 1 113 ILE MD . . 4.160 4.005 3.879 4.178 0.018 17 0 "[ . 1 . 2]" 1
1799 1 109 PRO HA 1 110 LYS H . . 3.190 2.160 2.150 2.193 . 0 0 "[ . 1 . 2]" 1
1800 1 109 PRO HA 1 110 LYS HA . . 4.780 4.379 4.354 4.433 . 0 0 "[ . 1 . 2]" 1
1801 1 109 PRO HA 1 110 LYS QG . . 4.860 3.607 3.424 4.021 . 0 0 "[ . 1 . 2]" 1
1802 1 109 PRO HA 1 111 SER H . . 4.530 3.747 3.573 3.921 . 0 0 "[ . 1 . 2]" 1
1803 1 109 PRO HB2 1 110 LYS H . . 4.260 3.512 3.262 3.808 . 0 0 "[ . 1 . 2]" 1
1804 1 109 PRO HB2 1 111 SER H . . 4.160 2.815 2.547 3.146 . 0 0 "[ . 1 . 2]" 1
1805 1 109 PRO HB2 1 112 PHE H . . 3.980 3.118 3.019 3.166 . 0 0 "[ . 1 . 2]" 1
1806 1 109 PRO HB2 1 112 PHE HB2 . . 5.260 3.539 3.294 3.670 . 0 0 "[ . 1 . 2]" 1
1807 1 109 PRO HB2 1 112 PHE QD . . 3.920 2.396 2.092 2.769 . 0 0 "[ . 1 . 2]" 1
1808 1 109 PRO HB2 1 112 PHE QE . . 4.340 3.639 3.168 4.172 . 0 0 "[ . 1 . 2]" 1
1809 1 109 PRO HB3 1 110 LYS H . . 4.570 3.987 3.823 4.193 . 0 0 "[ . 1 . 2]" 1
1810 1 109 PRO HB3 1 112 PHE H . . 4.820 4.791 4.705 4.825 0.005 13 0 "[ . 1 . 2]" 1
1811 1 109 PRO HB3 1 112 PHE QD . . 4.210 3.901 3.627 4.205 . 0 0 "[ . 1 . 2]" 1
1812 1 109 PRO HD2 1 112 PHE HB2 . . 4.950 3.415 3.341 3.649 . 0 0 "[ . 1 . 2]" 1
1813 1 109 PRO HD2 1 112 PHE HB3 . . 5.000 4.511 4.388 4.695 . 0 0 "[ . 1 . 2]" 1
1814 1 109 PRO HD2 1 112 PHE QD . . 4.730 4.429 4.296 4.712 . 0 0 "[ . 1 . 2]" 1
1815 1 109 PRO QG 1 112 PHE HB2 . . 4.240 2.026 1.989 2.102 . 0 0 "[ . 1 . 2]" 1
1816 1 109 PRO QG 1 112 PHE QD . . 4.070 2.490 2.207 2.895 . 0 0 "[ . 1 . 2]" 1
1817 1 109 PRO QG 1 112 PHE QE . . 4.180 3.334 3.161 3.703 . 0 0 "[ . 1 . 2]" 1
1818 1 110 LYS H 1 110 LYS HB2 . . 4.110 2.691 2.405 3.587 . 0 0 "[ . 1 . 2]" 1
1819 1 110 LYS H 1 110 LYS QB . . 3.450 2.574 2.370 2.789 . 0 0 "[ . 1 . 2]" 1
1820 1 110 LYS H 1 110 LYS HB3 . . 4.110 3.530 2.636 3.605 . 0 0 "[ . 1 . 2]" 1
1821 1 110 LYS H 1 110 LYS HD2 . . 4.960 4.155 3.903 4.508 . 0 0 "[ . 1 . 2]" 1
1822 1 110 LYS H 1 110 LYS HD3 . . 4.960 3.761 3.233 4.337 . 0 0 "[ . 1 . 2]" 1
1823 1 110 LYS H 1 110 LYS QE . . 5.070 4.581 4.109 5.062 . 0 0 "[ . 1 . 2]" 1
1824 1 110 LYS H 1 110 LYS HG2 . . 4.000 3.137 1.994 3.692 . 0 0 "[ . 1 . 2]" 1
1825 1 110 LYS H 1 110 LYS QG . . 3.370 1.991 1.886 2.322 . 0 0 "[ . 1 . 2]" 1
1826 1 110 LYS H 1 110 LYS HG3 . . 4.000 2.100 1.906 3.077 . 0 0 "[ . 1 . 2]" 1
1827 1 110 LYS H 1 111 SER H . . 3.760 2.646 2.484 2.765 . 0 0 "[ . 1 . 2]" 1
1828 1 110 LYS H 1 112 PHE H . . 5.020 4.110 4.029 4.186 . 0 0 "[ . 1 . 2]" 1
1829 1 110 LYS HA 1 110 LYS QE . . 4.810 4.346 4.093 4.807 . 0 0 "[ . 1 . 2]" 1
1830 1 110 LYS HA 1 110 LYS HG2 . . 4.110 2.829 2.630 3.717 . 0 0 "[ . 1 . 2]" 1
1831 1 110 LYS HA 1 110 LYS HG3 . . 4.110 3.125 2.805 3.766 . 0 0 "[ . 1 . 2]" 1
1832 1 110 LYS HA 1 112 PHE H . . 4.590 3.466 3.421 3.572 . 0 0 "[ . 1 . 2]" 1
1833 1 110 LYS HA 1 113 ILE H . . 4.320 3.011 2.919 3.118 . 0 0 "[ . 1 . 2]" 1
1834 1 110 LYS HA 1 113 ILE HB . . 4.370 2.678 2.473 2.795 . 0 0 "[ . 1 . 2]" 1
1835 1 110 LYS HA 1 113 ILE HG12 . . 4.640 3.168 2.930 3.362 . 0 0 "[ . 1 . 2]" 1
1836 1 110 LYS HA 1 113 ILE HG13 . . 4.670 3.734 3.312 3.872 . 0 0 "[ . 1 . 2]" 1
1837 1 110 LYS HA 1 113 ILE MG . . 4.740 4.171 3.969 4.273 . 0 0 "[ . 1 . 2]" 1
1838 1 110 LYS QB 1 111 SER H . . 3.670 2.861 2.621 3.431 . 0 0 "[ . 1 . 2]" 1
1839 1 110 LYS QB 1 111 SER HA . . 4.620 3.912 3.788 4.241 . 0 0 "[ . 1 . 2]" 1
1840 1 110 LYS HB2 1 110 LYS HD2 . . 4.140 3.458 2.797 3.593 . 0 0 "[ . 1 . 2]" 1
1841 1 110 LYS HB2 1 110 LYS HD3 . . 4.140 2.646 2.154 3.909 . 0 0 "[ . 1 . 2]" 1
1842 1 110 LYS HB2 1 110 LYS QE . . 3.810 2.884 2.087 3.721 . 0 0 "[ . 1 . 2]" 1
1843 1 110 LYS HB2 1 111 SER H . . 4.430 2.939 2.674 3.699 . 0 0 "[ . 1 . 2]" 1
1844 1 110 LYS HB3 1 110 LYS HD2 . . 4.140 3.487 2.281 3.912 . 0 0 "[ . 1 . 2]" 1
1845 1 110 LYS HB3 1 110 LYS HD3 . . 4.140 3.223 2.909 3.622 . 0 0 "[ . 1 . 2]" 1
1846 1 110 LYS HB3 1 110 LYS QE . . 3.810 2.550 2.061 3.229 . 0 0 "[ . 1 . 2]" 1
1847 1 110 LYS HB3 1 111 SER H . . 4.430 3.980 3.712 4.121 . 0 0 "[ . 1 . 2]" 1
1848 1 110 LYS QE 1 110 LYS HG2 . . 3.760 2.575 2.086 3.396 . 0 0 "[ . 1 . 2]" 1
1849 1 110 LYS QE 1 110 LYS HG3 . . 3.760 3.079 2.180 3.489 . 0 0 "[ . 1 . 2]" 1
1850 1 110 LYS QG 1 111 SER H . . 4.540 3.882 2.160 4.316 . 0 0 "[ . 1 . 2]" 1
1851 1 110 LYS HG2 1 111 SER H . . 5.390 4.895 2.905 5.263 . 0 0 "[ . 1 . 2]" 1
1852 1 110 LYS HG3 1 111 SER H . . 5.390 4.076 2.228 4.585 . 0 0 "[ . 1 . 2]" 1
1853 1 111 SER H 1 111 SER HB2 . . 3.810 2.988 2.211 3.601 . 0 0 "[ . 1 . 2]" 1
1854 1 111 SER H 1 111 SER QB . . 3.320 2.396 2.175 2.594 . 0 0 "[ . 1 . 2]" 1
1855 1 111 SER H 1 111 SER HB3 . . 3.810 2.915 2.358 3.599 . 0 0 "[ . 1 . 2]" 1
1856 1 111 SER H 1 112 PHE H . . 3.780 2.633 2.538 2.714 . 0 0 "[ . 1 . 2]" 1
1857 1 111 SER H 1 112 PHE HB2 . . 5.020 4.632 4.518 4.745 . 0 0 "[ . 1 . 2]" 1
1858 1 111 SER H 1 112 PHE QD . . 4.520 3.568 3.026 3.995 . 0 0 "[ . 1 . 2]" 1
1859 1 111 SER H 1 113 ILE H . . 4.750 4.069 3.985 4.164 . 0 0 "[ . 1 . 2]" 1
1860 1 111 SER HA 1 113 ILE H . . 4.290 4.102 3.946 4.238 . 0 0 "[ . 1 . 2]" 1
1861 1 111 SER QB 1 112 PHE QD . . 4.780 2.945 2.302 3.654 . 0 0 "[ . 1 . 2]" 1
1862 1 112 PHE H 1 112 PHE HB2 . . 3.480 2.370 2.289 2.498 . 0 0 "[ . 1 . 2]" 1
1863 1 112 PHE H 1 112 PHE HB3 . . 3.690 3.609 3.545 3.694 0.004 13 0 "[ . 1 . 2]" 1
1864 1 112 PHE H 1 112 PHE QD . . 3.570 2.504 2.258 2.700 . 0 0 "[ . 1 . 2]" 1
1865 1 112 PHE H 1 113 ILE H . . 3.300 2.074 1.994 2.162 . 0 0 "[ . 1 . 2]" 1
1866 1 112 PHE H 1 113 ILE MD . . 4.730 4.542 4.366 4.701 . 0 0 "[ . 1 . 2]" 1
1867 1 112 PHE H 1 113 ILE HG12 . . 4.270 3.652 3.541 3.864 . 0 0 "[ . 1 . 2]" 1
1868 1 112 PHE HB2 1 113 ILE H . . 4.200 3.222 3.066 3.362 . 0 0 "[ . 1 . 2]" 1
1869 1 112 PHE HB2 1 113 ILE MD . . 4.480 3.601 3.406 3.800 . 0 0 "[ . 1 . 2]" 1
1870 1 112 PHE HB2 1 113 ILE HG12 . . 5.360 3.418 3.289 3.485 . 0 0 "[ . 1 . 2]" 1
1871 1 112 PHE HB3 1 113 ILE H . . 4.520 3.898 3.729 4.095 . 0 0 "[ . 1 . 2]" 1
1872 1 112 PHE HB3 1 113 ILE MD . . 4.520 3.420 3.147 3.666 . 0 0 "[ . 1 . 2]" 1
1873 1 112 PHE HB3 1 113 ILE HG12 . . 5.290 4.166 3.995 4.431 . 0 0 "[ . 1 . 2]" 1
1874 1 112 PHE QD 1 113 ILE H . . 4.660 4.334 4.159 4.474 . 0 0 "[ . 1 . 2]" 1
1875 1 113 ILE H 1 113 ILE HB . . 3.290 2.537 2.459 2.576 . 0 0 "[ . 1 . 2]" 1
1876 1 113 ILE H 1 113 ILE MD . . 3.960 3.453 3.259 3.583 . 0 0 "[ . 1 . 2]" 1
1877 1 113 ILE H 1 113 ILE HG12 . . 3.700 2.528 2.375 2.619 . 0 0 "[ . 1 . 2]" 1
1878 1 113 ILE H 1 113 ILE HG13 . . 3.990 3.926 3.834 3.992 0.002 13 0 "[ . 1 . 2]" 1
1879 1 113 ILE H 1 113 ILE MG . . 3.930 3.802 3.768 3.819 . 0 0 "[ . 1 . 2]" 1
1880 1 113 ILE H 1 114 HIS H . . 4.600 4.474 4.418 4.519 . 0 0 "[ . 1 . 2]" 1
1881 1 113 ILE HB 1 113 ILE MD . . 3.720 3.218 3.216 3.220 . 0 0 "[ . 1 . 2]" 1
1882 1 113 ILE HB 1 114 HIS H . . 4.630 4.141 4.046 4.252 . 0 0 "[ . 1 . 2]" 1
1883 1 113 ILE HB 1 115 ILE MD . . 4.570 3.645 3.380 3.871 . 0 0 "[ . 1 . 2]" 1
1884 1 113 ILE MD 1 113 ILE MG . . 2.970 2.012 1.899 2.139 . 0 0 "[ . 1 . 2]" 1
1885 1 113 ILE MD 1 114 HIS H . . 3.870 3.476 3.315 3.652 . 0 0 "[ . 1 . 2]" 1
1886 1 113 ILE HG12 1 113 ILE MG . . 3.620 3.186 3.179 3.196 . 0 0 "[ . 1 . 2]" 1
1887 1 113 ILE HG13 1 113 ILE MG . . 3.310 2.340 2.238 2.429 . 0 0 "[ . 1 . 2]" 1
1888 1 113 ILE MG 1 114 HIS H . . 3.370 2.326 2.086 2.534 . 0 0 "[ . 1 . 2]" 1
1889 1 113 ILE MG 1 114 HIS HB2 . . 4.930 4.716 4.567 4.824 . 0 0 "[ . 1 . 2]" 1
1890 1 113 ILE MG 1 114 HIS HB3 . . 4.550 4.304 4.207 4.418 . 0 0 "[ . 1 . 2]" 1
1891 1 113 ILE MG 1 115 ILE H . . 4.430 3.691 3.443 4.074 . 0 0 "[ . 1 . 2]" 1
1892 1 113 ILE MG 1 115 ILE HA . . 3.980 3.619 3.533 3.761 . 0 0 "[ . 1 . 2]" 1
1893 1 113 ILE MG 1 115 ILE HB . . 5.500 5.156 4.888 5.448 . 0 0 "[ . 1 . 2]" 1
1894 1 113 ILE MG 1 115 ILE MD . . 3.190 2.176 1.886 2.569 . 0 0 "[ . 1 . 2]" 1
1895 1 113 ILE MG 1 115 ILE HG12 . . 3.980 3.479 3.069 3.929 . 0 0 "[ . 1 . 2]" 1
1896 1 113 ILE MG 1 116 LYS H . . 5.110 4.949 4.840 5.115 0.005 16 0 "[ . 1 . 2]" 1
1897 1 114 HIS H 1 114 HIS HB2 . . 3.730 2.844 2.737 3.028 . 0 0 "[ . 1 . 2]" 1
1898 1 114 HIS H 1 114 HIS HB3 . . 3.600 2.568 2.498 2.650 . 0 0 "[ . 1 . 2]" 1
1899 1 114 HIS H 1 114 HIS HD2 . . 5.350 5.173 5.079 5.286 . 0 0 "[ . 1 . 2]" 1
1900 1 114 HIS HA 1 114 HIS HD2 . . 4.710 4.627 4.497 4.709 . 0 0 "[ . 1 . 2]" 1
1901 1 114 HIS HA 1 115 ILE H . . 2.990 2.180 2.142 2.211 . 0 0 "[ . 1 . 2]" 1
1902 1 114 HIS HA 1 115 ILE HB . . 4.940 4.648 4.592 4.717 . 0 0 "[ . 1 . 2]" 1
1903 1 114 HIS HA 1 115 ILE MD . . 4.830 4.513 4.135 4.828 . 0 0 "[ . 1 . 2]" 1
1904 1 114 HIS HA 1 115 ILE HG12 . . 4.610 3.955 3.777 4.183 . 0 0 "[ . 1 . 2]" 1
1905 1 114 HIS HB2 1 115 ILE H . . 4.650 4.487 4.398 4.558 . 0 0 "[ . 1 . 2]" 1
1906 1 114 HIS HB3 1 115 ILE H . . 4.550 4.401 4.299 4.454 . 0 0 "[ . 1 . 2]" 1
1907 1 114 HIS HB3 1 116 LYS QG . . 5.430 3.942 3.280 4.638 . 0 0 "[ . 1 . 2]" 1
1908 1 114 HIS HD2 1 115 ILE H . . 5.500 5.387 5.171 5.507 0.007 5 0 "[ . 1 . 2]" 1
1909 1 114 HIS HD2 1 116 LYS HA . . 4.810 4.106 3.701 4.339 . 0 0 "[ . 1 . 2]" 1
1910 1 114 HIS HD2 1 116 LYS QD . . 4.870 3.819 2.901 4.873 0.003 4 0 "[ . 1 . 2]" 1
1911 1 114 HIS HD2 1 116 LYS QE . . 5.460 4.375 3.065 5.261 . 0 0 "[ . 1 . 2]" 1
1912 1 114 HIS HD2 1 116 LYS QG . . 4.260 2.940 2.028 4.172 . 0 0 "[ . 1 . 2]" 1
1913 1 115 ILE H 1 115 ILE HB . . 3.260 2.553 2.476 2.620 . 0 0 "[ . 1 . 2]" 1
1914 1 115 ILE H 1 115 ILE MD . . 3.910 3.158 2.886 3.385 . 0 0 "[ . 1 . 2]" 1
1915 1 115 ILE H 1 115 ILE HG12 . . 3.680 2.117 1.941 2.344 . 0 0 "[ . 1 . 2]" 1
1916 1 115 ILE H 1 115 ILE HG13 . . 3.820 3.600 3.438 3.795 . 0 0 "[ . 1 . 2]" 1
1917 1 115 ILE H 1 115 ILE MG . . 3.770 3.766 3.760 3.769 . 0 0 "[ . 1 . 2]" 1
1918 1 115 ILE HA 1 115 ILE MD . . 3.190 2.035 1.962 2.193 . 0 0 "[ . 1 . 2]" 1
1919 1 115 ILE HA 1 115 ILE HG12 . . 4.040 3.101 2.985 3.233 . 0 0 "[ . 1 . 2]" 1
1920 1 115 ILE HA 1 115 ILE HG13 . . 4.090 3.719 3.611 3.797 . 0 0 "[ . 1 . 2]" 1
1921 1 115 ILE HA 1 115 ILE MG . . 3.190 2.399 2.237 2.457 . 0 0 "[ . 1 . 2]" 1
1922 1 115 ILE HA 1 116 LYS H . . 2.900 2.154 2.138 2.184 . 0 0 "[ . 1 . 2]" 1
1923 1 115 ILE HA 1 116 LYS QD . . 5.500 5.306 4.845 5.514 0.014 4 0 "[ . 1 . 2]" 1
1924 1 115 ILE HB 1 115 ILE MD . . 3.610 3.218 3.210 3.230 . 0 0 "[ . 1 . 2]" 1
1925 1 115 ILE HB 1 116 LYS H . . 4.570 4.335 4.180 4.409 . 0 0 "[ . 1 . 2]" 1
1926 1 115 ILE MD 1 115 ILE MG . . 2.740 1.971 1.877 2.176 . 0 0 "[ . 1 . 2]" 1
1927 1 115 ILE MD 1 116 LYS H . . 3.920 3.697 3.504 3.872 . 0 0 "[ . 1 . 2]" 1
1928 1 115 ILE HG12 1 115 ILE MG . . 3.310 3.191 3.166 3.202 . 0 0 "[ . 1 . 2]" 1
1929 1 115 ILE HG12 1 116 LYS H . . 5.400 5.158 5.064 5.288 . 0 0 "[ . 1 . 2]" 1
1930 1 115 ILE HG13 1 115 ILE MG . . 3.220 2.377 2.209 2.509 . 0 0 "[ . 1 . 2]" 1
1931 1 115 ILE MG 1 116 LYS H . . 3.330 2.922 2.422 3.243 . 0 0 "[ . 1 . 2]" 1
1932 1 115 ILE MG 1 116 LYS HA . . 4.800 4.042 3.901 4.351 . 0 0 "[ . 1 . 2]" 1
1933 1 115 ILE MG 1 116 LYS QB . . 5.050 4.268 3.916 4.633 . 0 0 "[ . 1 . 2]" 1
1934 1 115 ILE MG 1 117 GLU HA . . 5.030 3.846 2.624 4.661 . 0 0 "[ . 1 . 2]" 1
1935 1 115 ILE MG 1 117 GLU HB2 . . 5.500 3.845 1.884 5.392 . 0 0 "[ . 1 . 2]" 1
1936 1 115 ILE MG 1 117 GLU HB3 . . 5.500 4.258 2.775 5.464 . 0 0 "[ . 1 . 2]" 1
1937 1 115 ILE MG 1 117 GLU HG2 . . 5.500 3.839 2.285 5.424 . 0 0 "[ . 1 . 2]" 1
1938 1 115 ILE MG 1 117 GLU HG3 . . 5.500 3.754 1.959 5.136 . 0 0 "[ . 1 . 2]" 1
1939 1 116 LYS H 1 116 LYS HB2 . . 3.680 2.523 2.214 2.805 . 0 0 "[ . 1 . 2]" 1
1940 1 116 LYS H 1 116 LYS QB . . 3.180 2.476 2.192 2.716 . 0 0 "[ . 1 . 2]" 1
1941 1 116 LYS H 1 116 LYS HB3 . . 3.680 3.616 3.510 3.677 . 0 0 "[ . 1 . 2]" 1
1942 1 116 LYS H 1 116 LYS QD . . 4.260 3.769 3.350 4.176 . 0 0 "[ . 1 . 2]" 1
1943 1 116 LYS H 1 116 LYS QG . . 3.640 2.289 1.891 2.923 . 0 0 "[ . 1 . 2]" 1
1944 1 116 LYS H 1 117 GLU H . . 4.640 4.070 2.637 4.629 . 0 0 "[ . 1 . 2]" 1
1945 1 116 LYS HA 1 116 LYS QD . . 4.300 3.812 2.421 4.300 0.000 10 0 "[ . 1 . 2]" 1
1946 1 116 LYS HA 1 116 LYS QE . . 4.470 4.252 3.719 4.530 0.060 4 0 "[ . 1 . 2]" 1
1947 1 116 LYS HA 1 116 LYS QG . . 3.430 2.553 2.310 2.772 . 0 0 "[ . 1 . 2]" 1
1948 1 116 LYS HA 1 117 GLU H . . 3.110 2.346 2.141 3.133 0.023 15 0 "[ . 1 . 2]" 1
1949 1 116 LYS HA 1 118 VAL QG . . 5.130 4.050 3.157 4.965 . 0 0 "[ . 1 . 2]" 1
1950 1 116 LYS QB 1 116 LYS QE . . 3.660 2.527 1.968 3.601 . 0 0 "[ . 1 . 2]" 1
1951 1 116 LYS QB 1 117 GLU H . . 3.860 3.492 2.672 3.888 0.028 18 0 "[ . 1 . 2]" 1
1952 1 116 LYS QB 1 118 VAL QG . . 4.300 2.910 1.958 3.753 . 0 0 "[ . 1 . 2]" 1
1953 1 116 LYS HB2 1 116 LYS QE . . 4.210 3.269 1.982 4.112 . 0 0 "[ . 1 . 2]" 1
1954 1 116 LYS HB3 1 116 LYS QE . . 4.210 2.776 2.078 3.979 . 0 0 "[ . 1 . 2]" 1
1955 1 116 LYS QE 1 118 VAL QG . . 4.450 3.917 3.351 4.441 . 0 0 "[ . 1 . 2]" 1
1956 1 116 LYS QG 1 117 GLU H . . 4.570 4.386 4.043 4.588 0.018 18 0 "[ . 1 . 2]" 1
1957 1 117 GLU H 1 117 GLU QB . . 3.260 2.562 2.213 3.176 . 0 0 "[ . 1 . 2]" 1
1958 1 117 GLU H 1 117 GLU QG . . 4.780 3.249 1.877 4.354 . 0 0 "[ . 1 . 2]" 1
1959 1 117 GLU H 1 118 VAL H . . 4.060 3.515 2.778 4.013 . 0 0 "[ . 1 . 2]" 1
1960 1 117 GLU HA 1 117 GLU QG . . 3.590 2.579 2.228 3.339 . 0 0 "[ . 1 . 2]" 1
1961 1 117 GLU HA 1 118 VAL H . . 2.690 2.464 2.162 2.720 0.030 1 0 "[ . 1 . 2]" 1
1962 1 117 GLU HA 1 118 VAL QG . . 5.410 3.789 3.385 4.263 . 0 0 "[ . 1 . 2]" 1
1963 1 117 GLU HA 1 119 THR H . . 4.640 3.520 2.936 4.360 . 0 0 "[ . 1 . 2]" 1
1964 1 117 GLU QB 1 118 VAL QG . . 4.850 4.417 4.137 4.821 . 0 0 "[ . 1 . 2]" 1
1965 1 117 GLU QG 1 118 VAL H . . 4.460 4.273 3.342 4.503 0.043 1 0 "[ . 1 . 2]" 1
1966 1 118 VAL H 1 118 VAL HB . . 3.660 3.263 2.486 3.682 0.022 8 0 "[ . 1 . 2]" 1
1967 1 118 VAL H 1 118 VAL MG1 . . 4.360 2.902 1.902 3.859 . 0 0 "[ . 1 . 2]" 1
1968 1 118 VAL H 1 118 VAL QG . . 3.250 2.052 1.815 2.736 . 0 0 "[ . 1 . 2]" 1
1969 1 118 VAL H 1 118 VAL MG2 . . 4.360 2.199 1.873 3.818 . 0 0 "[ . 1 . 2]" 1
1970 1 118 VAL H 1 119 THR H . . 3.860 2.436 2.202 2.726 . 0 0 "[ . 1 . 2]" 1
1971 1 118 VAL HA 1 118 VAL MG1 . . 3.410 2.332 2.164 3.203 . 0 0 "[ . 1 . 2]" 1
1972 1 118 VAL HA 1 118 VAL MG2 . . 3.410 2.902 2.270 3.203 . 0 0 "[ . 1 . 2]" 1
1973 1 118 VAL HB 1 119 THR H . . 4.200 3.486 2.185 4.200 . 0 0 "[ . 1 . 2]" 1
1974 1 118 VAL QG 1 119 THR H . . 3.540 2.539 1.933 3.180 . 0 0 "[ . 1 . 2]" 1
1975 1 118 VAL QG 1 119 THR HA . . 4.670 3.575 2.988 3.982 . 0 0 "[ . 1 . 2]" 1
1976 1 118 VAL MG1 1 119 THR H . . 4.260 3.741 1.942 4.265 0.005 6 0 "[ . 1 . 2]" 1
1977 1 118 VAL MG2 1 119 THR H . . 4.260 2.844 2.017 3.838 . 0 0 "[ . 1 . 2]" 1
1978 1 119 THR H 1 119 THR HB . . 3.510 3.056 2.546 3.613 0.103 11 0 "[ . 1 . 2]" 1
1979 1 119 THR H 1 119 THR MG . . 4.080 3.105 1.925 3.932 . 0 0 "[ . 1 . 2]" 1
1980 1 119 THR HA 1 119 THR MG . . 3.620 2.483 2.005 3.207 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Sunday, July 7, 2024 3:14:09 PM GMT (wattos1)