NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
569156 |
2mcy   |
19458 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mcy
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 2238
_Distance_constraint_stats_list.Viol_count 5031
_Distance_constraint_stats_list.Viol_total 16406.830
_Distance_constraint_stats_list.Viol_max 1.097
_Distance_constraint_stats_list.Viol_rms 0.0709
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0183
_Distance_constraint_stats_list.Viol_average_violations_only 0.1631
_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 5 LYS 26.287 0.893 18 6 "[ * . * *1 *. + -]"
1 6 SER 24.747 0.848 7 8 "[* *-+ 1*** . *2]"
1 7 CYS 16.727 0.661 6 7 "[ * *.+ -*1 ** 2]"
1 8 ARG 22.804 0.513 19 1 "[ . 1 . +2]"
1 9 ASN 17.977 0.639 15 1 "[ . 1 + 2]"
1 10 PRO 9.818 0.617 15 1 "[ . 1 + 2]"
1 11 PRO 0.801 0.305 8 0 "[ . 1 . 2]"
1 12 ASP 2.681 0.535 3 1 "[ + . 1 . 2]"
1 13 PRO 8.203 0.718 5 4 "[ - + ** 1 . 2]"
1 14 VAL 4.277 0.436 7 0 "[ . 1 . 2]"
1 15 ASN 3.946 0.436 7 0 "[ . 1 . 2]"
1 16 GLY 0.045 0.045 9 0 "[ . 1 . 2]"
1 17 MET 0.033 0.016 1 0 "[ . 1 . 2]"
1 18 VAL 0.033 0.016 1 0 "[ . 1 . 2]"
1 20 VAL 7.920 0.557 15 2 "[ . - 1 + 2]"
1 21 ILE 8.876 0.507 19 1 "[ . 1 . +2]"
1 22 LYS 12.146 0.716 11 2 "[ . 1+ - 2]"
1 23 GLY 0.630 0.191 9 0 "[ . 1 . 2]"
1 24 ILE 44.734 0.708 12 9 "[ ** * *1-+ *.* *2]"
1 25 GLN 18.442 0.661 6 5 "[ * *.+ - 1 .* 2]"
1 26 PHE 17.686 1.097 1 12 "[+ * *-* *1*** .* * *]"
1 27 GLY 3.975 0.748 9 1 "[ . +1 . 2]"
1 28 SER 16.703 0.708 12 8 "[ ** * 1-+**.* 2]"
1 29 GLN 19.915 0.905 14 3 "[ . 1 -+* 2]"
1 30 ILE 20.665 0.617 15 3 "[ . 1 + * -2]"
1 31 LYS 15.700 0.735 4 2 "[- +. 1 . 2]"
1 32 TYR 6.762 0.594 6 2 "[ - .+ 1 . 2]"
1 33 SER 4.013 0.594 6 1 "[ .+ 1 . 2]"
1 34 CYS 1.023 0.248 15 0 "[ . 1 . 2]"
1 35 THR 2.498 0.451 20 0 "[ . 1 . 2]"
1 36 LYS 3.324 0.388 13 0 "[ . 1 . 2]"
1 37 GLY 0.909 0.234 6 0 "[ . 1 . 2]"
1 38 TYR 6.562 0.451 20 0 "[ . 1 . 2]"
1 39 ARG 26.563 0.781 8 6 "[ * - + * * *. 2]"
1 40 LEU 22.725 0.781 8 6 "[ * * + * * -. 2]"
1 41 ILE 16.706 0.563 12 4 "[* . 1*+ -. 2]"
1 42 GLY 27.073 0.947 5 4 "[* + 1* -. 2]"
1 43 SER 22.371 0.500 9 0 "[ . 1 . 2]"
1 44 SER 18.630 0.947 5 4 "[* + 1 ** 2]"
1 45 SER 16.933 0.735 4 4 "[* +. - 1 . * 2]"
1 46 ALA 19.115 0.397 6 0 "[ . 1 . 2]"
1 47 THR 12.712 0.905 14 1 "[ . 1 +. 2]"
1 48 CYS 18.653 0.748 9 2 "[ . +1 - 2]"
1 49 ILE 17.504 0.525 10 1 "[ . + . 2]"
1 50 ILE 24.018 1.097 1 3 "[+ . * . -]"
1 51 SER 11.212 0.562 17 1 "[ . 1 . + 2]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASP 0.198 0.106 15 0 "[ . 1 . 2]"
1 54 THR 20.220 0.580 14 5 "[ * 1 +- * *]"
1 55 VAL 30.257 0.634 7 2 "[- . + 1 . 2]"
1 56 ILE 15.057 0.517 15 1 "[ . 1 + 2]"
1 57 TRP 21.341 0.513 19 1 "[ . 1 . +2]"
1 58 ASP 7.570 0.845 17 3 "[ *. 1 . +- 2]"
1 59 THR 18.933 0.621 7 2 "[ - . + 1 . 2]"
1 60 GLU 8.423 0.845 17 5 "[ *. 1 *. +*-2]"
1 61 THR 20.074 0.727 1 7 "[+* * *- * * 2]"
1 62 PRO 16.156 0.530 10 1 "[ . + . 2]"
1 63 ILE 6.168 0.323 3 0 "[ . 1 . 2]"
1 64 CYS 8.093 0.573 2 2 "[ + . 1 -. 2]"
1 65 ASP 3.011 0.309 3 0 "[ . 1 . 2]"
1 66 ARG 8.434 0.635 12 1 "[ . 1 + . 2]"
1 67 ILE 11.750 0.406 17 0 "[ . 1 . 2]"
1 68 PRO 8.099 0.650 17 1 "[ . 1 . + 2]"
1 69 CYS 7.318 0.481 13 0 "[ . 1 . 2]"
1 70 GLY 6.639 0.464 16 0 "[ . 1 . 2]"
1 71 LEU 16.946 0.729 9 2 "[ .- +1 . 2]"
1 72 PRO 4.230 0.403 16 0 "[ . 1 . 2]"
1 73 PRO 6.417 0.736 17 1 "[ . 1 . + 2]"
1 74 THR 14.376 0.629 6 2 "[ -.+ 1 . 2]"
1 75 ILE 27.945 0.617 18 4 "[ *.- 1 * . + 2]"
1 76 THR 21.740 0.591 1 1 "[+ . 1 . 2]"
1 77 ASN 11.783 0.675 1 2 "[+ . 1 .- 2]"
1 78 GLY 3.554 0.425 20 0 "[ . 1 . 2]"
1 79 ASP 14.677 0.629 6 4 "[ -.+ 1 * . * 2]"
1 80 PHE 27.909 0.846 17 5 "[ . *1* ** + 2]"
1 81 ILE 27.351 0.670 1 9 "[+ .* * ** -*. * *2]"
1 82 SER 18.349 0.670 1 9 "[+ .* * * - . ****]"
1 83 THR 7.595 0.630 18 1 "[ . 1 . + 2]"
1 84 ASN 0.815 0.399 4 0 "[ . 1 . 2]"
1 85 ARG 16.311 0.630 14 5 "[ - *1* +. * 2]"
1 86 GLU 10.989 0.678 15 3 "[ - 1 + * 2]"
1 87 ASN 7.224 0.356 19 0 "[ . 1 . 2]"
1 88 PHE 3.406 0.803 10 1 "[ . + . 2]"
1 89 HIS 8.130 0.650 17 2 "[ . 1 - . + 2]"
1 90 TYR 9.184 0.471 2 0 "[ . 1 . 2]"
1 91 GLY 3.547 0.771 14 1 "[ . 1 +. 2]"
1 92 SER 11.138 0.803 10 2 "[ . + -. 2]"
1 93 VAL 4.601 0.298 10 0 "[ . 1 . 2]"
1 94 VAL 12.299 0.846 17 1 "[ . 1 . + 2]"
1 95 THR 16.838 0.657 20 6 "[* .* * 1 . * -+]"
1 96 TYR 7.040 0.340 20 0 "[ . 1 . 2]"
1 97 ARG 22.496 0.644 11 5 "[ .* * 1+ *. -2]"
1 98 CYS 12.497 0.551 6 1 "[ .+ 1 . 2]"
1 99 ASN 13.118 0.724 15 5 "[* .** 1 +- 2]"
1 100 PRO 6.143 0.685 17 2 "[ . 1 . + -]"
1 101 GLY 5.849 0.838 9 2 "[ . +1 . - 2]"
1 104 GLY 0.480 0.135 15 0 "[ . 1 . 2]"
1 105 ARG 7.471 0.825 17 2 "[ -. 1 . + 2]"
1 106 LYS 15.416 0.913 5 9 "[* *+ **1* *-. *2]"
1 107 VAL 20.427 0.913 5 8 "[* *+* *1 -. * *]"
1 108 PHE 21.680 0.724 15 9 "[ .**-*1* * + * *2]"
1 109 GLU 4.118 0.636 8 1 "[ . + 1 . 2]"
1 110 LEU 29.345 0.662 15 4 "[* . - 1 +* 2]"
1 111 VAL 20.969 0.699 17 5 "[ -* * *1 . + 2]"
1 112 GLY 4.360 0.468 14 0 "[ . 1 . 2]"
1 113 GLU 4.006 0.500 19 0 "[ . 1 . 2]"
1 114 PRO 10.192 0.415 18 0 "[ . 1 . 2]"
1 115 SER 12.363 0.501 17 1 "[ . 1 . + 2]"
1 116 ILE 12.391 0.501 17 1 "[ . 1 . + 2]"
1 117 TYR 9.785 0.580 19 2 "[ -. 1 . +2]"
1 118 CYS 11.144 0.771 14 1 "[ . 1 +. 2]"
1 119 THR 14.819 0.580 19 4 "[ ** 1* . +2]"
1 120 SER 18.602 0.536 5 3 "[ + 1* . -2]"
1 125 VAL 1.292 0.284 13 0 "[ . 1 . 2]"
1 126 GLY 9.901 0.453 6 0 "[ . 1 . 2]"
1 127 ILE 16.139 0.567 18 3 "[ . -1 . + *]"
1 128 TRP 16.666 0.567 18 3 "[ . -1 . + *]"
1 129 SER 7.239 0.366 19 0 "[ . 1 . 2]"
1 130 GLY 1.070 0.137 3 0 "[ . 1 . 2]"
1 131 PRO 1.621 0.575 17 1 "[ . 1 . + 2]"
1 132 ALA 10.637 0.736 17 2 "[* . 1 . + 2]"
1 133 PRO 12.117 0.625 15 1 "[ . 1 + 2]"
1 134 GLN 38.385 0.699 17 8 "[-* * 1 * ***+ 2]"
1 135 CYS 6.381 0.571 8 1 "[ . + 1 . 2]"
1 136 ILE 17.714 0.641 3 6 "[- + * *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 5 LYS H 1 5 LYS QB 2.720 . 3.640 2.435 2.125 3.074 . 0 0 "[ . 1 . 2]" 1
2 1 5 LYS HA 1 5 LYS HD2 3.410 . 5.020 4.461 4.207 4.707 . 0 0 "[ . 1 . 2]" 1
3 1 5 LYS HA 1 5 LYS QD 3.090 . 4.380 3.984 3.867 4.167 . 0 0 "[ . 1 . 2]" 1
4 1 5 LYS HA 1 5 LYS HD3 3.410 . 5.020 4.520 4.201 4.832 . 0 0 "[ . 1 . 2]" 1
5 1 5 LYS HA 1 5 LYS HE2 3.650 . 5.500 5.049 4.149 5.921 0.421 8 0 "[ . 1 . 2]" 1
6 1 5 LYS HA 1 5 LYS QE 3.315 . 4.830 4.517 3.894 4.873 0.043 5 0 "[ . 1 . 2]" 1
7 1 5 LYS HA 1 5 LYS HE3 3.650 . 5.500 5.224 4.397 5.965 0.465 15 0 "[ . 1 . 2]" 1
8 1 5 LYS HA 1 5 LYS HG2 3.015 . 4.230 2.762 2.404 3.136 . 0 0 "[ . 1 . 2]" 1
9 1 5 LYS HA 1 5 LYS QG 2.710 . 3.620 2.373 2.179 2.502 . 0 0 "[ . 1 . 2]" 1
10 1 5 LYS HA 1 5 LYS HG3 3.015 . 4.230 2.712 2.304 3.122 . 0 0 "[ . 1 . 2]" 1
11 1 5 LYS HA 1 6 SER H 2.380 . 2.960 2.225 1.949 3.161 0.201 18 0 "[ . 1 . 2]" 1
12 1 5 LYS HA 1 6 SER QB 3.570 . 5.340 4.421 3.926 5.123 . 0 0 "[ . 1 . 2]" 1
13 1 5 LYS HA 1 26 PHE H 3.650 . 5.500 5.706 4.693 6.393 0.893 18 4 "[ * . -1 . + *]" 1
14 1 5 LYS HA 1 55 VAL MG1 3.650 . 5.500 4.458 3.310 5.525 0.025 12 0 "[ . 1 . 2]" 1
15 1 5 LYS HA 1 55 VAL QG 3.110 . 4.420 3.712 3.263 3.999 . 0 0 "[ . 1 . 2]" 1
16 1 5 LYS HA 1 55 VAL MG2 3.650 . 5.500 4.501 3.537 5.552 0.052 5 0 "[ . 1 . 2]" 1
17 1 5 LYS QB 1 5 LYS QE 2.900 . 4.000 3.295 1.993 3.623 . 0 0 "[ . 1 . 2]" 1
18 1 5 LYS QB 1 6 SER H 2.905 . 4.010 3.386 2.581 3.905 . 0 0 "[ . 1 . 2]" 1
19 1 5 LYS QB 1 55 VAL QG 2.435 . 3.070 1.957 1.713 2.545 0.087 10 0 "[ . 1 . 2]" 1
20 1 5 LYS HB2 1 55 VAL MG1 3.410 . 5.020 4.050 2.475 5.445 0.425 19 0 "[ . 1 . 2]" 1
21 1 5 LYS HB2 1 55 VAL MG2 3.410 . 5.020 3.303 1.744 4.969 0.056 10 0 "[ . 1 . 2]" 1
22 1 5 LYS HB3 1 55 VAL MG1 3.410 . 5.020 3.022 1.813 4.247 . 0 0 "[ . 1 . 2]" 1
23 1 5 LYS HB3 1 55 VAL MG2 3.410 . 5.020 2.624 1.734 3.692 0.066 12 0 "[ . 1 . 2]" 1
24 1 5 LYS QD 1 54 THR MG 3.165 . 4.530 4.668 3.546 5.110 0.580 14 1 "[ . 1 +. 2]" 1
25 1 5 LYS QD 1 55 VAL H 2.840 . 3.880 2.873 1.960 3.417 . 0 0 "[ . 1 . 2]" 1
26 1 5 LYS QD 1 55 VAL QG 2.680 . 3.560 2.292 1.743 2.896 0.057 19 0 "[ . 1 . 2]" 1
27 1 5 LYS HD2 1 55 VAL H 3.170 . 4.540 4.203 3.159 4.968 0.428 9 0 "[ . 1 . 2]" 1
28 1 5 LYS HD2 1 55 VAL MG1 3.450 . 5.100 4.480 2.978 5.435 0.335 14 0 "[ . 1 . 2]" 1
29 1 5 LYS HD2 1 55 VAL MG2 3.450 . 5.100 3.592 2.081 5.479 0.379 16 0 "[ . 1 . 2]" 1
30 1 5 LYS HD3 1 55 VAL H 3.170 . 4.540 3.023 1.971 4.840 0.300 7 0 "[ . 1 . 2]" 1
31 1 5 LYS HD3 1 55 VAL MG1 3.450 . 5.100 3.833 2.079 5.024 . 0 0 "[ . 1 . 2]" 1
32 1 5 LYS HD3 1 55 VAL MG2 3.450 . 5.100 3.175 1.762 5.734 0.634 7 1 "[ . + 1 . 2]" 1
33 1 5 LYS QE 1 5 LYS QG 2.450 . 3.100 2.171 1.989 2.319 . 0 0 "[ . 1 . 2]" 1
34 1 5 LYS QE 1 55 VAL QG 2.930 . 4.060 3.522 2.323 4.357 0.297 17 0 "[ . 1 . 2]" 1
35 1 5 LYS HE2 1 50 ILE MD 3.650 . 5.500 4.836 2.413 5.954 0.454 6 0 "[ . 1 . 2]" 1
36 1 5 LYS HE2 1 55 VAL H 3.650 . 5.500 4.286 1.974 5.779 0.279 15 0 "[ . 1 . 2]" 1
37 1 5 LYS HE2 1 55 VAL MG1 4.125 . 6.450 5.163 2.354 6.911 0.461 10 0 "[ . 1 . 2]" 1
38 1 5 LYS HE2 1 55 VAL MG2 4.125 . 6.450 4.747 2.673 6.405 . 0 0 "[ . 1 . 2]" 1
39 1 5 LYS HE3 1 50 ILE MD 3.650 . 5.500 4.570 2.546 6.013 0.513 20 1 "[ . 1 . +]" 1
40 1 5 LYS HE3 1 55 VAL H 3.650 . 5.500 4.718 2.969 5.862 0.362 2 0 "[ . 1 . 2]" 1
41 1 5 LYS HE3 1 55 VAL MG1 4.125 . 6.450 5.424 3.442 6.881 0.431 18 0 "[ . 1 . 2]" 1
42 1 5 LYS HE3 1 55 VAL MG2 4.125 . 6.450 4.798 3.548 6.360 . 0 0 "[ . 1 . 2]" 1
43 1 5 LYS QG 1 6 SER H 3.240 . 4.680 3.517 2.822 4.536 . 0 0 "[ . 1 . 2]" 1
44 1 5 LYS QG 1 55 VAL QG 2.905 . 4.010 2.660 1.742 3.505 0.058 14 0 "[ . 1 . 2]" 1
45 1 5 LYS HG2 1 6 SER H 3.650 . 5.500 3.790 2.968 5.298 . 0 0 "[ . 1 . 2]" 1
46 1 5 LYS HG3 1 6 SER H 3.650 . 5.500 4.247 3.201 5.067 . 0 0 "[ . 1 . 2]" 1
47 1 6 SER H 1 6 SER QB 2.710 . 3.620 2.661 2.066 3.168 . 0 0 "[ . 1 . 2]" 1
48 1 6 SER H 1 55 VAL QG 3.195 . 4.590 3.587 2.411 4.202 . 0 0 "[ . 1 . 2]" 1
49 1 6 SER HA 1 7 CYS H 2.370 . 2.940 2.349 2.173 2.509 . 0 0 "[ . 1 . 2]" 1
50 1 6 SER HA 1 7 CYS HA 3.120 . 4.440 4.287 4.128 4.432 . 0 0 "[ . 1 . 2]" 1
51 1 6 SER HA 1 7 CYS QB 3.335 . 4.870 4.348 4.035 4.940 0.070 6 0 "[ . 1 . 2]" 1
52 1 6 SER HA 1 24 ILE MD 2.810 . 3.820 4.150 3.850 4.519 0.699 19 1 "[ . 1 . +2]" 1
53 1 6 SER HA 1 25 GLN HA 2.290 . 2.780 1.868 1.702 2.251 0.098 7 0 "[ . 1 . 2]" 1
54 1 6 SER HA 1 25 GLN HB2 3.415 . 5.030 4.218 3.601 4.709 . 0 0 "[ . 1 . 2]" 1
55 1 6 SER HA 1 25 GLN HB3 3.280 . 4.760 4.070 3.047 4.919 0.159 19 0 "[ . 1 . 2]" 1
56 1 6 SER HA 1 25 GLN QE 2.985 . 4.170 3.800 2.667 4.457 0.287 15 0 "[ . 1 . 2]" 1
57 1 6 SER HA 1 25 GLN HG2 3.325 . 4.850 3.741 1.915 5.059 0.209 19 0 "[ . 1 . 2]" 1
58 1 6 SER HA 1 25 GLN QG 2.935 . 4.070 3.090 1.900 4.180 0.110 2 0 "[ . 1 . 2]" 1
59 1 6 SER HA 1 25 GLN HG3 3.325 . 4.850 3.682 2.543 4.900 0.050 8 0 "[ . 1 . 2]" 1
60 1 6 SER HA 1 26 PHE H 2.665 . 3.530 3.144 2.552 3.745 0.215 7 0 "[ . 1 . 2]" 1
61 1 6 SER HA 1 55 VAL MG1 3.085 . 4.370 3.334 2.798 3.799 . 0 0 "[ . 1 . 2]" 1
62 1 6 SER HA 1 55 VAL QG 2.780 . 3.760 3.174 2.687 3.556 . 0 0 "[ . 1 . 2]" 1
63 1 6 SER HA 1 55 VAL MG2 3.085 . 4.370 4.096 3.469 4.671 0.301 1 0 "[ . 1 . 2]" 1
64 1 6 SER QB 1 7 CYS H 2.665 . 3.530 2.654 2.358 3.369 . 0 0 "[ . 1 . 2]" 1
65 1 6 SER QB 1 7 CYS HA 3.570 . 5.340 4.585 4.342 4.980 . 0 0 "[ . 1 . 2]" 1
66 1 6 SER QB 1 24 ILE H 3.490 . 5.180 4.767 3.757 5.454 0.274 12 0 "[ . 1 . 2]" 1
67 1 6 SER QB 1 24 ILE QG 2.720 . 3.640 2.257 1.749 3.056 0.051 9 0 "[ . 1 . 2]" 1
68 1 6 SER QB 1 25 GLN HA 2.730 . 3.660 2.839 2.188 3.438 . 0 0 "[ . 1 . 2]" 1
69 1 6 SER QB 1 25 GLN QG 2.910 . 4.020 3.128 1.882 4.203 0.183 10 0 "[ . 1 . 2]" 1
70 1 6 SER QB 1 26 PHE H 3.060 . 4.320 4.585 3.472 5.168 0.848 7 7 "[* *-+ 1*** . 2]" 1
71 1 6 SER HB2 1 7 CYS H 2.955 . 4.110 3.005 2.389 3.796 . 0 0 "[ . 1 . 2]" 1
72 1 6 SER HB2 1 24 ILE MD 2.590 . 3.380 2.556 2.092 3.599 0.219 19 0 "[ . 1 . 2]" 1
73 1 6 SER HB2 1 24 ILE HG12 3.355 . 4.910 4.161 3.368 5.136 0.226 16 0 "[ . 1 . 2]" 1
74 1 6 SER HB2 1 24 ILE HG13 3.355 . 4.910 2.810 1.770 3.974 0.030 9 0 "[ . 1 . 2]" 1
75 1 6 SER HB2 1 25 GLN HA 2.985 . 4.170 3.421 2.208 4.409 0.239 13 0 "[ . 1 . 2]" 1
76 1 6 SER HB2 1 25 GLN HG2 3.600 . 5.400 4.582 2.218 5.759 0.359 18 0 "[ . 1 . 2]" 1
77 1 6 SER HB2 1 25 GLN HG3 3.600 . 5.400 4.629 2.739 5.627 0.227 2 0 "[ . 1 . 2]" 1
78 1 6 SER HB3 1 7 CYS H 2.955 . 4.110 3.512 2.582 4.136 0.026 7 0 "[ . 1 . 2]" 1
79 1 6 SER HB3 1 24 ILE MD 2.590 . 3.380 3.093 2.010 3.679 0.299 15 0 "[ . 1 . 2]" 1
80 1 6 SER HB3 1 24 ILE HG12 3.355 . 4.910 4.412 3.276 5.107 0.197 19 0 "[ . 1 . 2]" 1
81 1 6 SER HB3 1 24 ILE HG13 3.355 . 4.910 3.104 1.823 4.026 . 0 0 "[ . 1 . 2]" 1
82 1 6 SER HB3 1 25 GLN HA 2.985 . 4.170 3.255 2.371 4.569 0.399 7 0 "[ . 1 . 2]" 1
83 1 6 SER HB3 1 25 GLN HG2 3.600 . 5.400 3.967 1.934 5.812 0.412 19 0 "[ . 1 . 2]" 1
84 1 6 SER HB3 1 25 GLN HG3 3.600 . 5.400 3.975 2.776 5.054 . 0 0 "[ . 1 . 2]" 1
85 1 7 CYS H 1 7 CYS QB 2.390 . 2.980 2.289 2.064 3.123 0.143 6 0 "[ . 1 . 2]" 1
86 1 7 CYS H 1 8 ARG H 3.195 . 4.590 4.462 4.302 4.573 . 0 0 "[ . 1 . 2]" 1
87 1 7 CYS H 1 8 ARG HA 3.650 . 5.500 5.575 5.337 5.750 0.250 8 0 "[ . 1 . 2]" 1
88 1 7 CYS H 1 9 ASN H 3.140 . 4.480 4.582 4.099 5.119 0.639 15 1 "[ . 1 + 2]" 1
89 1 7 CYS H 1 24 ILE H 3.650 . 5.500 5.242 4.937 5.509 0.009 2 0 "[ . 1 . 2]" 1
90 1 7 CYS H 1 24 ILE HA 3.585 . 5.370 4.329 3.846 4.668 . 0 0 "[ . 1 . 2]" 1
91 1 7 CYS H 1 24 ILE HB 2.965 . 4.130 3.196 2.506 3.625 . 0 0 "[ . 1 . 2]" 1
92 1 7 CYS H 1 24 ILE QG 3.520 . 5.240 2.960 2.483 3.649 . 0 0 "[ . 1 . 2]" 1
93 1 7 CYS H 1 25 GLN H 3.570 . 5.340 4.422 4.196 4.627 . 0 0 "[ . 1 . 2]" 1
94 1 7 CYS H 1 25 GLN HA 2.590 . 3.380 2.695 2.253 3.423 0.043 16 0 "[ . 1 . 2]" 1
95 1 7 CYS H 1 25 GLN HB2 3.350 . 4.900 5.186 4.541 5.561 0.661 6 5 "[ * *.+ - 1 .* 2]" 1
96 1 7 CYS HA 1 8 ARG H 2.340 . 2.880 2.584 2.410 2.853 . 0 0 "[ . 1 . 2]" 1
97 1 7 CYS HA 1 8 ARG QB 3.545 . 5.290 4.591 4.160 4.888 . 0 0 "[ . 1 . 2]" 1
98 1 7 CYS HA 1 55 VAL HB 3.335 . 4.870 4.050 2.229 5.169 0.299 3 0 "[ . 1 . 2]" 1
99 1 7 CYS HA 1 55 VAL QG 2.575 . 3.350 2.165 1.787 3.161 0.013 6 0 "[ . 1 . 2]" 1
100 1 7 CYS HA 1 56 ILE MG 3.455 . 5.110 4.967 4.313 5.345 0.235 14 0 "[ . 1 . 2]" 1
101 1 7 CYS QB 1 8 ARG H 2.445 . 3.090 2.037 1.773 2.403 0.027 7 0 "[ . 1 . 2]" 1
102 1 7 CYS QB 1 24 ILE MG 3.045 . 4.290 4.094 3.335 4.950 0.660 9 1 "[ . +1 . 2]" 1
103 1 7 CYS QB 1 25 GLN HA 3.530 . 5.260 4.268 3.620 5.510 0.250 9 0 "[ . 1 . 2]" 1
104 1 7 CYS QB 1 30 ILE MG 3.545 . 5.290 4.967 4.312 5.569 0.279 9 0 "[ . 1 . 2]" 1
105 1 7 CYS QB 1 55 VAL QG 3.075 . 4.350 3.203 2.022 3.720 . 0 0 "[ . 1 . 2]" 1
106 1 7 CYS QB 1 56 ILE HA 3.330 . 4.860 4.073 2.830 4.780 . 0 0 "[ . 1 . 2]" 1
107 1 7 CYS QB 1 57 TRP HE1 2.685 . 3.570 2.926 2.535 3.389 . 0 0 "[ . 1 . 2]" 1
108 1 7 CYS QB 1 57 TRP HH2 3.520 . 5.240 3.581 3.074 4.624 . 0 0 "[ . 1 . 2]" 1
109 1 7 CYS QB 1 57 TRP HZ2 2.995 . 4.190 2.783 2.336 3.594 . 0 0 "[ . 1 . 2]" 1
110 1 8 ARG H 1 8 ARG HB2 2.585 . 3.370 2.409 2.281 2.596 . 0 0 "[ . 1 . 2]" 1
111 1 8 ARG H 1 8 ARG QB 2.365 . 2.930 2.329 2.163 2.539 . 0 0 "[ . 1 . 2]" 1
112 1 8 ARG H 1 8 ARG HB3 2.585 . 3.370 3.340 2.424 3.617 0.247 5 0 "[ . 1 . 2]" 1
113 1 8 ARG H 1 8 ARG HD2 3.620 . 5.440 4.528 3.703 5.823 0.383 1 0 "[ . 1 . 2]" 1
114 1 8 ARG H 1 8 ARG QD 3.240 . 4.680 3.887 3.270 4.577 . 0 0 "[ . 1 . 2]" 1
115 1 8 ARG H 1 8 ARG HD3 3.620 . 5.440 4.462 3.368 5.827 0.387 8 0 "[ . 1 . 2]" 1
116 1 8 ARG H 1 8 ARG QG 3.160 . 4.520 2.676 2.095 3.920 . 0 0 "[ . 1 . 2]" 1
117 1 8 ARG H 1 9 ASN H 2.930 . 4.060 2.594 2.460 2.737 . 0 0 "[ . 1 . 2]" 1
118 1 8 ARG H 1 9 ASN HA 3.360 . 4.920 4.912 4.673 5.189 0.269 15 0 "[ . 1 . 2]" 1
119 1 8 ARG H 1 55 VAL QG 3.260 . 4.720 4.086 3.610 5.043 0.323 18 0 "[ . 1 . 2]" 1
120 1 8 ARG H 1 57 TRP HD1 3.220 . 4.640 3.984 3.432 4.432 . 0 0 "[ . 1 . 2]" 1
121 1 8 ARG H 1 57 TRP HE1 2.870 . 3.940 3.039 2.733 3.297 . 0 0 "[ . 1 . 2]" 1
122 1 8 ARG H 1 57 TRP HZ2 3.450 . 5.100 4.327 4.046 4.625 . 0 0 "[ . 1 . 2]" 1
123 1 8 ARG HA 1 8 ARG HD2 3.615 . 5.430 3.539 1.883 4.737 . 0 0 "[ . 1 . 2]" 1
124 1 8 ARG HA 1 8 ARG QD 3.280 . 4.760 2.880 1.861 4.251 . 0 0 "[ . 1 . 2]" 1
125 1 8 ARG HA 1 8 ARG HD3 3.615 . 5.430 3.418 1.875 4.881 . 0 0 "[ . 1 . 2]" 1
126 1 8 ARG HA 1 8 ARG HG2 2.905 . 4.010 2.873 2.453 3.137 . 0 0 "[ . 1 . 2]" 1
127 1 8 ARG HA 1 8 ARG QG 2.585 . 3.370 2.649 2.342 2.970 . 0 0 "[ . 1 . 2]" 1
128 1 8 ARG HA 1 8 ARG HG3 2.905 . 4.010 3.314 2.472 3.769 . 0 0 "[ . 1 . 2]" 1
129 1 8 ARG HA 1 9 ASN H 2.505 . 3.210 3.335 3.088 3.477 0.267 7 0 "[ . 1 . 2]" 1
130 1 8 ARG HA 1 9 ASN QB 3.165 . 4.530 4.031 3.737 4.260 . 0 0 "[ . 1 . 2]" 1
131 1 8 ARG HA 1 57 TRP HZ2 3.650 . 5.500 5.768 5.599 5.983 0.483 20 0 "[ . 1 . 2]" 1
132 1 8 ARG QB 1 8 ARG QD 2.560 . 3.320 2.321 2.080 2.677 . 0 0 "[ . 1 . 2]" 1
133 1 8 ARG QB 1 9 ASN QB 3.490 . 5.180 3.904 3.144 4.395 . 0 0 "[ . 1 . 2]" 1
134 1 8 ARG QB 1 57 TRP HE1 3.290 . 4.780 2.606 2.013 3.134 . 0 0 "[ . 1 . 2]" 1
135 1 8 ARG HB2 1 9 ASN H 3.520 . 5.240 3.300 2.583 4.191 . 0 0 "[ . 1 . 2]" 1
136 1 8 ARG HB2 1 57 TRP HD1 3.650 . 5.500 3.561 2.640 4.149 . 0 0 "[ . 1 . 2]" 1
137 1 8 ARG HB2 1 57 TRP HE1 3.650 . 5.500 2.955 2.086 3.988 . 0 0 "[ . 1 . 2]" 1
138 1 8 ARG HB3 1 9 ASN H 3.520 . 5.240 3.724 3.075 4.382 . 0 0 "[ . 1 . 2]" 1
139 1 8 ARG HB3 1 57 TRP HD1 3.650 . 5.500 4.656 2.936 5.810 0.310 4 0 "[ . 1 . 2]" 1
140 1 8 ARG HB3 1 57 TRP HE1 3.650 . 5.500 3.785 2.023 4.593 . 0 0 "[ . 1 . 2]" 1
141 1 8 ARG QD 1 9 ASN QB 3.415 . 5.030 5.199 4.630 5.492 0.462 7 0 "[ . 1 . 2]" 1
142 1 8 ARG QG 1 57 TRP HD1 3.280 . 4.760 4.310 3.402 4.953 0.193 4 0 "[ . 1 . 2]" 1
143 1 8 ARG HG2 1 57 TRP HD1 3.650 . 5.500 5.036 3.651 6.013 0.513 19 1 "[ . 1 . +2]" 1
144 1 8 ARG HG3 1 57 TRP HD1 3.650 . 5.500 4.833 3.614 5.819 0.319 12 0 "[ . 1 . 2]" 1
145 1 9 ASN HA 1 9 ASN QD 2.935 . 4.070 3.317 1.791 3.918 0.009 19 0 "[ . 1 . 2]" 1
146 1 9 ASN HA 1 10 PRO HD2 2.440 . 3.080 2.307 1.966 2.804 . 0 0 "[ . 1 . 2]" 1
147 1 9 ASN HA 1 10 PRO HD3 2.655 . 3.510 2.275 1.959 2.652 . 0 0 "[ . 1 . 2]" 1
148 1 9 ASN HA 1 10 PRO HG2 3.235 . 4.670 4.398 4.121 4.648 . 0 0 "[ . 1 . 2]" 1
149 1 9 ASN HA 1 10 PRO HG3 3.235 . 4.670 4.378 4.089 4.557 . 0 0 "[ . 1 . 2]" 1
150 1 9 ASN HA 1 20 VAL QG 3.240 . 4.680 4.533 3.857 4.946 0.266 1 0 "[ . 1 . 2]" 1
151 1 9 ASN HA 1 24 ILE MD 2.720 . 3.640 3.276 2.819 3.671 0.031 4 0 "[ . 1 . 2]" 1
152 1 9 ASN HA 1 24 ILE MG 2.890 . 3.980 2.512 1.872 3.126 . 0 0 "[ . 1 . 2]" 1
153 1 9 ASN HA 1 30 ILE MG 3.220 . 4.640 4.542 3.962 5.078 0.438 8 0 "[ . 1 . 2]" 1
154 1 9 ASN HA 1 57 TRP HZ2 3.320 . 4.840 2.452 1.849 3.649 . 0 0 "[ . 1 . 2]" 1
155 1 9 ASN QB 1 10 PRO HD2 2.995 . 4.190 2.923 2.115 3.572 . 0 0 "[ . 1 . 2]" 1
156 1 9 ASN QB 1 10 PRO HD3 3.125 . 4.450 3.877 3.155 4.485 0.035 13 0 "[ . 1 . 2]" 1
157 1 9 ASN QB 1 10 PRO QG 3.250 . 4.700 4.395 3.516 4.982 0.282 4 0 "[ . 1 . 2]" 1
158 1 9 ASN QB 1 24 ILE HB 3.315 . 4.830 4.476 3.999 5.057 0.227 15 0 "[ . 1 . 2]" 1
159 1 9 ASN QB 1 24 ILE MD 3.240 . 4.680 3.372 2.698 4.323 . 0 0 "[ . 1 . 2]" 1
160 1 9 ASN QB 1 24 ILE MG 3.315 . 4.830 3.451 2.452 4.216 . 0 0 "[ . 1 . 2]" 1
161 1 9 ASN HB2 1 24 ILE HB 3.650 . 5.500 4.804 4.151 5.772 0.272 16 0 "[ . 1 . 2]" 1
162 1 9 ASN HB2 1 24 ILE MD 3.650 . 5.500 3.565 2.773 4.728 . 0 0 "[ . 1 . 2]" 1
163 1 9 ASN HB3 1 24 ILE HB 3.650 . 5.500 5.475 4.835 5.988 0.488 15 0 "[ . 1 . 2]" 1
164 1 9 ASN HB3 1 24 ILE MD 3.650 . 5.500 4.407 3.461 5.230 . 0 0 "[ . 1 . 2]" 1
165 1 9 ASN QD 1 10 PRO QG 3.055 . 4.310 3.618 2.794 4.524 0.214 1 0 "[ . 1 . 2]" 1
166 1 9 ASN QD 1 24 ILE MD 3.570 . 5.340 3.980 2.271 5.767 0.427 15 0 "[ . 1 . 2]" 1
167 1 10 PRO HD2 1 20 VAL QG 2.825 . 3.850 3.469 2.188 4.050 0.200 5 0 "[ . 1 . 2]" 1
168 1 10 PRO HD2 1 24 ILE MG 2.785 . 3.770 2.689 2.289 3.387 . 0 0 "[ . 1 . 2]" 1
169 1 10 PRO HD2 1 30 ILE MD 3.295 . 4.790 4.613 4.085 5.013 0.223 8 0 "[ . 1 . 2]" 1
170 1 10 PRO HD2 1 30 ILE MG 2.910 . 4.020 3.951 3.535 4.350 0.330 15 0 "[ . 1 . 2]" 1
171 1 10 PRO HD2 1 57 TRP HZ2 3.420 . 5.040 3.788 3.316 4.801 . 0 0 "[ . 1 . 2]" 1
172 1 10 PRO HD3 1 20 VAL QG 2.740 . 3.680 3.236 2.423 3.742 0.062 4 0 "[ . 1 . 2]" 1
173 1 10 PRO HD3 1 24 ILE MD 3.295 . 4.790 4.359 3.454 4.949 0.159 18 0 "[ . 1 . 2]" 1
174 1 10 PRO HD3 1 24 ILE MG 2.790 . 3.780 2.110 1.632 2.563 0.168 15 0 "[ . 1 . 2]" 1
175 1 10 PRO HD3 1 30 ILE MD 3.265 . 4.730 3.483 2.741 4.195 . 0 0 "[ . 1 . 2]" 1
176 1 10 PRO HD3 1 30 ILE MG 2.440 . 3.080 2.739 2.213 3.407 0.327 8 0 "[ . 1 . 2]" 1
177 1 10 PRO HD3 1 57 TRP HE1 3.180 . 4.560 4.670 4.313 5.039 0.479 15 0 "[ . 1 . 2]" 1
178 1 10 PRO HD3 1 57 TRP HZ2 3.265 . 4.730 2.481 2.164 3.592 . 0 0 "[ . 1 . 2]" 1
179 1 10 PRO QG 1 20 VAL QG 2.640 . 3.480 2.456 1.772 3.458 0.028 15 0 "[ . 1 . 2]" 1
180 1 10 PRO QG 1 57 TRP HZ2 3.555 . 5.310 4.101 3.312 5.127 . 0 0 "[ . 1 . 2]" 1
181 1 10 PRO HG2 1 24 ILE MG 2.920 . 4.040 3.820 3.010 4.204 0.164 11 0 "[ . 1 . 2]" 1
182 1 10 PRO HG2 1 30 ILE MD 3.150 . 4.500 4.091 3.211 4.739 0.239 15 0 "[ . 1 . 2]" 1
183 1 10 PRO HG2 1 30 ILE MG 2.690 . 3.580 3.506 2.103 4.197 0.617 15 1 "[ . 1 + 2]" 1
184 1 10 PRO HG3 1 24 ILE MG 2.920 . 4.040 3.369 2.440 4.061 0.021 11 0 "[ . 1 . 2]" 1
185 1 10 PRO HG3 1 30 ILE MD 3.150 . 4.500 3.014 1.921 4.794 0.294 15 0 "[ . 1 . 2]" 1
186 1 10 PRO HG3 1 30 ILE MG 2.690 . 3.580 2.264 1.729 3.447 0.071 8 0 "[ . 1 . 2]" 1
187 1 11 PRO QB 1 12 ASP H 2.595 . 3.390 2.873 2.020 3.695 0.305 8 0 "[ . 1 . 2]" 1
188 1 11 PRO QB 1 13 PRO QD 3.065 . 4.330 3.000 1.776 4.476 0.146 12 0 "[ . 1 . 2]" 1
189 1 11 PRO QB 1 61 THR MG 3.000 . 4.200 3.277 1.762 4.286 0.086 11 0 "[ . 1 . 2]" 1
190 1 11 PRO HB2 1 12 ASP H 3.000 . 4.200 3.066 2.038 4.135 . 0 0 "[ . 1 . 2]" 1
191 1 11 PRO HB3 1 12 ASP H 3.000 . 4.200 3.816 3.143 4.251 0.051 17 0 "[ . 1 . 2]" 1
192 1 11 PRO QD 1 61 THR MG 3.100 . 4.400 2.991 1.789 4.107 0.011 7 0 "[ . 1 . 2]" 1
193 1 12 ASP H 1 12 ASP QB 2.700 . 3.600 2.861 2.218 3.449 . 0 0 "[ . 1 . 2]" 1
194 1 12 ASP H 1 13 PRO QD 3.135 . 4.470 2.785 1.749 4.041 0.051 5 0 "[ . 1 . 2]" 1
195 1 12 ASP H 1 61 THR MG 3.650 . 5.500 4.538 2.984 5.918 0.418 10 0 "[ . 1 . 2]" 1
196 1 12 ASP HA 1 13 PRO HD2 2.770 . 3.740 2.426 1.790 3.774 0.034 3 0 "[ . 1 . 2]" 1
197 1 12 ASP HA 1 13 PRO QD 2.375 . 2.950 2.230 1.757 3.485 0.535 3 1 "[ + . 1 . 2]" 1
198 1 12 ASP HA 1 13 PRO HD3 2.770 . 3.740 2.813 2.032 4.096 0.356 3 0 "[ . 1 . 2]" 1
199 1 12 ASP QB 1 13 PRO QD 3.210 . 4.620 3.558 2.439 3.916 . 0 0 "[ . 1 . 2]" 1
200 1 13 PRO HA 1 14 VAL H 2.260 . 2.720 2.263 2.165 2.746 0.026 2 0 "[ . 1 . 2]" 1
201 1 13 PRO QB 1 14 VAL H 2.915 . 4.030 2.912 2.047 3.178 . 0 0 "[ . 1 . 2]" 1
202 1 13 PRO QD 1 32 TYR QD 3.210 . 4.620 3.838 3.025 4.875 0.255 3 0 "[ . 1 . 2]" 1
203 1 13 PRO QD 1 32 TYR QE 3.155 . 4.510 3.045 2.274 4.114 . 0 0 "[ . 1 . 2]" 1
204 1 13 PRO QD 1 61 THR MG 2.985 . 4.170 3.653 2.113 4.385 0.215 2 0 "[ . 1 . 2]" 1
205 1 13 PRO HD2 1 32 TYR QD 3.650 . 5.500 4.215 3.079 5.734 0.234 10 0 "[ . 1 . 2]" 1
206 1 13 PRO HD2 1 32 TYR QE 3.470 . 5.140 3.377 2.299 4.782 . 0 0 "[ . 1 . 2]" 1
207 1 13 PRO HD2 1 61 THR MG 3.300 . 4.800 4.642 3.230 5.518 0.718 5 3 "[ + -* 1 . 2]" 1
208 1 13 PRO HD3 1 32 TYR QD 3.650 . 5.500 4.714 3.292 6.021 0.521 3 1 "[ + . 1 . 2]" 1
209 1 13 PRO HD3 1 32 TYR QE 3.470 . 5.140 3.942 2.399 4.993 . 0 0 "[ . 1 . 2]" 1
210 1 13 PRO HD3 1 61 THR MG 3.300 . 4.800 3.860 2.139 4.806 0.006 2 0 "[ . 1 . 2]" 1
211 1 13 PRO QG 1 14 VAL H 3.370 . 4.940 4.545 3.651 4.824 . 0 0 "[ . 1 . 2]" 1
212 1 13 PRO QG 1 32 TYR QD 2.990 . 4.180 3.561 2.817 4.235 0.055 8 0 "[ . 1 . 2]" 1
213 1 13 PRO HG2 1 32 TYR QD 3.320 . 4.840 3.996 3.170 4.889 0.049 10 0 "[ . 1 . 2]" 1
214 1 13 PRO HG2 1 32 TYR QE 3.345 . 4.890 2.921 1.982 4.054 . 0 0 "[ . 1 . 2]" 1
215 1 13 PRO HG3 1 32 TYR QD 3.320 . 4.840 4.404 2.845 5.094 0.254 9 0 "[ . 1 . 2]" 1
216 1 13 PRO HG3 1 32 TYR QE 3.345 . 4.890 3.407 1.831 4.733 . 0 0 "[ . 1 . 2]" 1
217 1 14 VAL H 1 14 VAL HB 2.725 . 3.650 2.748 2.423 3.853 0.203 10 0 "[ . 1 . 2]" 1
218 1 14 VAL H 1 14 VAL QG 2.400 . 3.000 2.207 1.788 2.831 0.012 13 0 "[ . 1 . 2]" 1
219 1 14 VAL H 1 15 ASN H 3.320 . 4.840 4.031 2.506 4.634 . 0 0 "[ . 1 . 2]" 1
220 1 14 VAL HA 1 14 VAL QG 2.360 . 2.920 2.179 2.058 2.359 . 0 0 "[ . 1 . 2]" 1
221 1 14 VAL HA 1 15 ASN H 2.380 . 2.960 2.474 2.066 3.396 0.436 7 0 "[ . 1 . 2]" 1
222 1 14 VAL HA 1 15 ASN HA 3.390 . 4.980 4.452 4.250 4.835 . 0 0 "[ . 1 . 2]" 1
223 1 14 VAL HA 1 16 GLY H 3.055 . 4.310 3.559 3.131 4.355 0.045 9 0 "[ . 1 . 2]" 1
224 1 14 VAL HB 1 15 ASN H 3.135 . 4.470 3.854 2.593 4.155 . 0 0 "[ . 1 . 2]" 1
225 1 14 VAL MG1 1 15 ASN HA 3.650 . 5.500 4.021 3.161 5.648 0.148 10 0 "[ . 1 . 2]" 1
226 1 14 VAL MG2 1 15 ASN HA 3.650 . 5.500 5.131 3.185 5.711 0.211 14 0 "[ . 1 . 2]" 1
227 1 15 ASN H 1 16 GLY H 2.680 . 3.560 2.629 2.083 2.885 . 0 0 "[ . 1 . 2]" 1
228 1 15 ASN QB 1 15 ASN QD 2.430 . 3.060 2.173 2.075 2.670 . 0 0 "[ . 1 . 2]" 1
229 1 17 MET H 1 17 MET QB 2.755 . 3.710 2.535 2.330 3.185 . 0 0 "[ . 1 . 2]" 1
230 1 17 MET HA 1 17 MET QG 2.760 . 3.720 2.579 2.344 3.017 . 0 0 "[ . 1 . 2]" 1
231 1 17 MET HA 1 18 VAL H 2.685 . 3.570 2.302 2.120 3.526 . 0 0 "[ . 1 . 2]" 1
232 1 17 MET QB 1 18 VAL H 2.970 . 4.140 3.144 1.784 4.080 0.016 1 0 "[ . 1 . 2]" 1
233 1 17 MET QG 1 18 VAL H 3.165 . 4.530 3.512 1.960 4.546 0.016 11 0 "[ . 1 . 2]" 1
234 1 20 VAL H 1 20 VAL HB 2.705 . 3.610 2.942 2.542 3.696 0.086 8 0 "[ . 1 . 2]" 1
235 1 20 VAL H 1 20 VAL QG 2.810 . 3.820 2.428 1.920 3.167 . 0 0 "[ . 1 . 2]" 1
236 1 20 VAL HA 1 20 VAL MG1 2.615 . 3.430 2.959 2.252 3.242 . 0 0 "[ . 1 . 2]" 1
237 1 20 VAL HA 1 20 VAL QG 2.400 . 3.000 2.241 2.025 2.481 . 0 0 "[ . 1 . 2]" 1
238 1 20 VAL HA 1 20 VAL MG2 2.615 . 3.430 2.382 2.116 3.186 . 0 0 "[ . 1 . 2]" 1
239 1 20 VAL HA 1 21 ILE H 2.515 . 3.230 2.370 2.091 3.485 0.255 11 0 "[ . 1 . 2]" 1
240 1 20 VAL HA 1 22 LYS H 3.395 . 4.990 4.334 3.307 5.547 0.557 15 1 "[ . 1 + 2]" 1
241 1 20 VAL HA 1 30 ILE HA 3.650 . 5.500 5.059 3.455 5.991 0.491 5 0 "[ . 1 . 2]" 1
242 1 20 VAL HB 1 21 ILE H 3.320 . 4.840 4.272 3.883 4.607 . 0 0 "[ . 1 . 2]" 1
243 1 20 VAL HB 1 23 GLY QA 3.650 . 5.500 4.619 3.571 5.560 0.060 13 0 "[ . 1 . 2]" 1
244 1 20 VAL HB 1 24 ILE MG 2.995 . 4.190 3.834 2.460 4.405 0.215 1 0 "[ . 1 . 2]" 1
245 1 20 VAL HB 1 30 ILE MG 2.810 . 3.820 2.545 1.832 3.711 . 0 0 "[ . 1 . 2]" 1
246 1 20 VAL QG 1 21 ILE H 2.910 . 4.020 2.738 2.063 3.634 . 0 0 "[ . 1 . 2]" 1
247 1 20 VAL QG 1 22 LYS H 3.235 . 4.670 3.360 1.806 4.516 . 0 0 "[ . 1 . 2]" 1
248 1 20 VAL QG 1 22 LYS HA 3.455 . 5.110 4.042 2.957 5.373 0.263 8 0 "[ . 1 . 2]" 1
249 1 20 VAL QG 1 24 ILE H 3.070 . 4.340 3.340 2.707 4.558 0.218 8 0 "[ . 1 . 2]" 1
250 1 20 VAL QG 1 25 GLN H 3.620 . 5.440 4.716 4.287 5.976 0.536 8 1 "[ . + 1 . 2]" 1
251 1 20 VAL QG 1 30 ILE HA 3.070 . 4.340 3.175 2.200 4.605 0.265 10 0 "[ . 1 . 2]" 1
252 1 20 VAL QG 1 30 ILE HB 3.480 . 5.160 3.471 2.433 4.155 . 0 0 "[ . 1 . 2]" 1
253 1 20 VAL QG 1 30 ILE MD 3.200 . 4.600 4.037 3.702 4.384 . 0 0 "[ . 1 . 2]" 1
254 1 20 VAL QG 1 30 ILE MG 2.165 . 2.530 2.018 1.751 2.631 0.101 10 0 "[ . 1 . 2]" 1
255 1 20 VAL QG 1 31 LYS H 3.620 . 5.440 4.195 2.943 5.199 . 0 0 "[ . 1 . 2]" 1
256 1 20 VAL QG 1 57 TRP HH2 3.300 . 4.800 3.804 3.050 4.785 . 0 0 "[ . 1 . 2]" 1
257 1 20 VAL QG 1 57 TRP HZ2 3.490 . 5.180 4.699 3.971 5.049 . 0 0 "[ . 1 . 2]" 1
258 1 20 VAL MG1 1 21 ILE H 3.300 . 4.800 3.383 2.073 4.224 . 0 0 "[ . 1 . 2]" 1
259 1 20 VAL MG1 1 30 ILE MD 3.650 . 5.500 4.625 3.845 5.122 . 0 0 "[ . 1 . 2]" 1
260 1 20 VAL MG1 1 30 ILE MG 2.425 . 3.050 2.623 1.858 3.490 0.440 10 0 "[ . 1 . 2]" 1
261 1 20 VAL MG2 1 21 ILE H 3.300 . 4.800 3.328 2.388 4.158 . 0 0 "[ . 1 . 2]" 1
262 1 20 VAL MG2 1 30 ILE MD 3.650 . 5.500 4.561 4.025 5.517 0.017 1 0 "[ . 1 . 2]" 1
263 1 20 VAL MG2 1 30 ILE MG 2.425 . 3.050 2.289 1.770 3.229 0.179 8 0 "[ . 1 . 2]" 1
264 1 21 ILE H 1 21 ILE HB 2.795 . 3.790 2.712 2.387 3.123 . 0 0 "[ . 1 . 2]" 1
265 1 21 ILE H 1 21 ILE HG12 3.470 . 5.140 3.837 2.332 4.918 . 0 0 "[ . 1 . 2]" 1
266 1 21 ILE H 1 21 ILE HG13 3.470 . 5.140 3.926 2.161 4.695 . 0 0 "[ . 1 . 2]" 1
267 1 21 ILE H 1 22 LYS H 2.930 . 4.060 2.857 2.228 4.153 0.093 16 0 "[ . 1 . 2]" 1
268 1 21 ILE H 1 22 LYS QG 3.650 . 5.500 5.018 4.210 5.706 0.206 11 0 "[ . 1 . 2]" 1
269 1 21 ILE H 1 30 ILE MG 3.650 . 5.500 5.664 5.141 6.007 0.507 19 1 "[ . 1 . +2]" 1
270 1 21 ILE HA 1 21 ILE MD 2.725 . 3.650 2.916 1.945 3.851 0.201 12 0 "[ . 1 . 2]" 1
271 1 21 ILE HA 1 21 ILE HG12 2.845 . 3.890 3.133 2.493 3.793 . 0 0 "[ . 1 . 2]" 1
272 1 21 ILE HA 1 21 ILE QG 2.575 . 3.350 2.640 2.314 2.989 . 0 0 "[ . 1 . 2]" 1
273 1 21 ILE HA 1 21 ILE HG13 2.845 . 3.890 3.031 2.378 3.769 . 0 0 "[ . 1 . 2]" 1
274 1 21 ILE HA 1 21 ILE MG 2.625 . 3.450 2.859 2.402 3.265 . 0 0 "[ . 1 . 2]" 1
275 1 21 ILE HB 1 21 ILE MD 2.490 . 3.180 2.629 2.331 3.245 0.065 17 0 "[ . 1 . 2]" 1
276 1 21 ILE HB 1 21 ILE QG 2.225 . 2.650 2.326 2.170 2.410 . 0 0 "[ . 1 . 2]" 1
277 1 21 ILE HB 1 22 LYS H 3.135 . 4.470 3.264 1.887 4.359 . 0 0 "[ . 1 . 2]" 1
278 1 21 ILE MD 1 22 LYS H 3.565 . 5.330 4.309 3.641 4.703 . 0 0 "[ . 1 . 2]" 1
279 1 21 ILE MD 1 22 LYS QE 3.170 . 4.540 4.195 3.268 4.960 0.420 1 0 "[ . 1 . 2]" 1
280 1 21 ILE MD 1 22 LYS QG 3.185 . 4.570 4.097 3.224 4.682 0.112 20 0 "[ . 1 . 2]" 1
281 1 21 ILE QG 1 21 ILE MG 2.195 . 2.590 2.261 2.073 2.340 . 0 0 "[ . 1 . 2]" 1
282 1 21 ILE HG12 1 21 ILE MG 2.620 . 3.440 2.590 2.223 3.220 . 0 0 "[ . 1 . 2]" 1
283 1 21 ILE HG13 1 21 ILE MG 2.620 . 3.440 2.812 2.327 3.232 . 0 0 "[ . 1 . 2]" 1
284 1 21 ILE MG 1 22 LYS HA 3.130 . 4.460 3.878 2.937 4.437 . 0 0 "[ . 1 . 2]" 1
285 1 21 ILE MG 1 22 LYS HD2 3.650 . 5.500 4.281 2.784 5.438 . 0 0 "[ . 1 . 2]" 1
286 1 21 ILE MG 1 22 LYS QD 3.275 . 4.750 3.568 2.601 4.434 . 0 0 "[ . 1 . 2]" 1
287 1 21 ILE MG 1 22 LYS HD3 3.650 . 5.500 4.110 2.629 4.985 . 0 0 "[ . 1 . 2]" 1
288 1 21 ILE MG 1 22 LYS HE2 3.650 . 5.500 3.905 2.285 5.410 . 0 0 "[ . 1 . 2]" 1
289 1 21 ILE MG 1 22 LYS HE3 3.650 . 5.500 4.168 2.642 5.804 0.304 7 0 "[ . 1 . 2]" 1
290 1 21 ILE MG 1 22 LYS QG 2.580 . 3.360 2.285 1.764 3.077 0.036 1 0 "[ . 1 . 2]" 1
291 1 22 LYS H 1 23 GLY H 3.080 . 4.360 2.570 1.609 4.439 0.191 9 0 "[ . 1 . 2]" 1
292 1 22 LYS H 1 24 ILE MG 3.310 . 4.820 4.875 4.008 5.243 0.423 18 0 "[ . 1 . 2]" 1
293 1 22 LYS HA 1 22 LYS HD2 3.650 . 5.500 3.770 2.869 5.564 0.064 16 0 "[ . 1 . 2]" 1
294 1 22 LYS HA 1 22 LYS QD 3.300 . 4.800 2.873 1.845 4.500 . 0 0 "[ . 1 . 2]" 1
295 1 22 LYS HA 1 22 LYS HD3 3.650 . 5.500 3.023 1.868 4.753 . 0 0 "[ . 1 . 2]" 1
296 1 22 LYS HA 1 22 LYS HE2 3.435 . 5.070 4.522 4.045 5.029 . 0 0 "[ . 1 . 2]" 1
297 1 22 LYS HA 1 22 LYS QE 3.085 . 4.370 4.206 3.806 4.632 0.262 11 0 "[ . 1 . 2]" 1
298 1 22 LYS HA 1 22 LYS HE3 3.435 . 5.070 5.023 4.635 5.786 0.716 11 1 "[ . 1+ . 2]" 1
299 1 22 LYS HA 1 22 LYS QG 2.855 . 3.910 2.804 2.176 3.353 . 0 0 "[ . 1 . 2]" 1
300 1 22 LYS HA 1 23 GLY QA 3.115 . 4.430 4.256 3.875 4.460 0.030 2 0 "[ . 1 . 2]" 1
301 1 22 LYS HA 1 24 ILE H 2.985 . 4.170 3.580 2.965 4.428 0.258 1 0 "[ . 1 . 2]" 1
302 1 22 LYS HA 1 24 ILE MG 3.060 . 4.320 4.089 2.588 4.505 0.185 10 0 "[ . 1 . 2]" 1
303 1 22 LYS QB 1 22 LYS QE 3.250 . 4.700 3.435 2.026 3.655 . 0 0 "[ . 1 . 2]" 1
304 1 22 LYS HB2 1 23 GLY QA 3.650 . 5.500 4.245 3.678 4.730 . 0 0 "[ . 1 . 2]" 1
305 1 22 LYS HB3 1 23 GLY QA 3.650 . 5.500 4.436 3.871 5.345 . 0 0 "[ . 1 . 2]" 1
306 1 22 LYS QD 1 22 LYS QG 2.080 . 2.360 2.081 1.995 2.111 . 0 0 "[ . 1 . 2]" 1
307 1 22 LYS HD2 1 22 LYS QG 2.285 . 2.770 2.333 2.165 2.379 . 0 0 "[ . 1 . 2]" 1
308 1 22 LYS HD3 1 22 LYS QG 2.285 . 2.770 2.341 2.295 2.401 . 0 0 "[ . 1 . 2]" 1
309 1 23 GLY QA 1 24 ILE MG 3.040 . 4.280 3.820 3.642 4.284 0.004 9 0 "[ . 1 . 2]" 1
310 1 24 ILE H 1 24 ILE HB 2.825 . 3.850 3.740 3.644 3.863 0.013 10 0 "[ . 1 . 2]" 1
311 1 24 ILE H 1 24 ILE MD 2.900 . 4.000 3.802 3.683 4.023 0.023 10 0 "[ . 1 . 2]" 1
312 1 24 ILE H 1 24 ILE HG12 2.765 . 3.730 2.194 2.005 2.542 . 0 0 "[ . 1 . 2]" 1
313 1 24 ILE H 1 24 ILE HG13 2.765 . 3.730 2.877 2.500 3.044 . 0 0 "[ . 1 . 2]" 1
314 1 24 ILE H 1 24 ILE MG 2.700 . 3.600 2.520 2.200 2.939 . 0 0 "[ . 1 . 2]" 1
315 1 24 ILE H 1 25 GLN H 2.650 . 3.500 2.140 1.889 2.537 . 0 0 "[ . 1 . 2]" 1
316 1 24 ILE H 1 25 GLN HB2 3.125 . 4.450 3.939 3.130 4.558 0.108 12 0 "[ . 1 . 2]" 1
317 1 24 ILE H 1 28 SER HB2 2.530 . 3.260 3.726 3.446 3.968 0.708 12 7 "[ ** * 1-+ *.* 2]" 1
318 1 24 ILE H 1 57 TRP HH2 3.430 . 5.060 4.850 4.216 5.238 0.178 9 0 "[ . 1 . 2]" 1
319 1 24 ILE HA 1 24 ILE MD 2.965 . 4.130 4.156 4.085 4.198 0.068 16 0 "[ . 1 . 2]" 1
320 1 24 ILE HA 1 24 ILE MG 2.475 . 3.150 2.372 2.253 2.446 . 0 0 "[ . 1 . 2]" 1
321 1 24 ILE HA 1 25 GLN HA 3.380 . 4.960 4.704 4.470 4.821 . 0 0 "[ . 1 . 2]" 1
322 1 24 ILE HA 1 28 SER HB2 2.645 . 3.490 3.489 2.279 3.825 0.335 16 0 "[ . 1 . 2]" 1
323 1 24 ILE HA 1 29 GLN H 3.650 . 5.500 5.611 4.968 5.880 0.380 17 0 "[ . 1 . 2]" 1
324 1 24 ILE HA 1 30 ILE MG 2.950 . 4.100 3.234 2.671 3.719 . 0 0 "[ . 1 . 2]" 1
325 1 24 ILE HA 1 57 TRP HH2 2.845 . 3.890 2.093 1.723 2.538 0.077 17 0 "[ . 1 . 2]" 1
326 1 24 ILE HA 1 57 TRP HZ2 3.230 . 4.660 3.634 2.778 4.203 . 0 0 "[ . 1 . 2]" 1
327 1 24 ILE HB 1 24 ILE MD 2.680 . 3.560 2.347 2.268 2.423 . 0 0 "[ . 1 . 2]" 1
328 1 24 ILE HB 1 57 TRP HH2 3.410 . 5.020 3.342 2.897 3.740 . 0 0 "[ . 1 . 2]" 1
329 1 24 ILE HB 1 57 TRP HZ2 3.005 . 4.210 2.976 2.459 3.465 . 0 0 "[ . 1 . 2]" 1
330 1 24 ILE MD 1 25 GLN HA 3.060 . 4.320 4.289 3.957 4.679 0.359 7 0 "[ . 1 . 2]" 1
331 1 24 ILE MD 1 55 VAL QG 3.365 . 4.930 5.151 4.894 5.415 0.485 18 0 "[ . 1 . 2]" 1
332 1 24 ILE MD 1 57 TRP HH2 3.510 . 5.220 5.064 4.781 5.382 0.162 10 0 "[ . 1 . 2]" 1
333 1 24 ILE MD 1 57 TRP HZ2 3.335 . 4.870 4.397 3.964 4.931 0.061 10 0 "[ . 1 . 2]" 1
334 1 24 ILE QG 1 25 GLN H 3.090 . 4.380 2.859 2.572 3.148 . 0 0 "[ . 1 . 2]" 1
335 1 24 ILE MG 1 30 ILE MD 3.330 . 4.860 4.264 3.608 4.911 0.051 13 0 "[ . 1 . 2]" 1
336 1 24 ILE MG 1 30 ILE MG 2.390 . 2.980 2.843 2.303 3.396 0.416 13 0 "[ . 1 . 2]" 1
337 1 24 ILE MG 1 57 TRP HH2 2.970 . 4.140 2.771 2.081 3.485 . 0 0 "[ . 1 . 2]" 1
338 1 24 ILE MG 1 57 TRP HZ2 2.850 . 3.900 3.038 2.305 3.643 . 0 0 "[ . 1 . 2]" 1
339 1 25 GLN H 1 25 GLN HB2 2.580 . 3.360 2.373 1.976 2.664 . 0 0 "[ . 1 . 2]" 1
340 1 25 GLN H 1 25 GLN HB3 2.700 . 3.600 3.075 2.414 3.652 0.052 6 0 "[ . 1 . 2]" 1
341 1 25 GLN H 1 25 GLN HG2 3.310 . 4.820 3.919 2.343 4.604 . 0 0 "[ . 1 . 2]" 1
342 1 25 GLN H 1 25 GLN QG 2.960 . 4.120 3.200 2.292 4.044 . 0 0 "[ . 1 . 2]" 1
343 1 25 GLN H 1 25 GLN HG3 3.310 . 4.820 3.635 2.320 4.521 . 0 0 "[ . 1 . 2]" 1
344 1 25 GLN H 1 28 SER HB2 2.830 . 3.860 2.552 2.099 3.528 . 0 0 "[ . 1 . 2]" 1
345 1 25 GLN HA 1 25 GLN QE 3.060 . 4.320 4.001 3.289 4.598 0.278 12 0 "[ . 1 . 2]" 1
346 1 25 GLN HA 1 25 GLN HG2 2.900 . 4.000 3.092 2.391 3.843 . 0 0 "[ . 1 . 2]" 1
347 1 25 GLN HA 1 25 GLN QG 2.585 . 3.370 2.610 2.122 3.067 . 0 0 "[ . 1 . 2]" 1
348 1 25 GLN HA 1 25 GLN HG3 2.900 . 4.000 2.980 2.198 3.814 . 0 0 "[ . 1 . 2]" 1
349 1 25 GLN HA 1 26 PHE H 2.445 . 3.090 2.542 2.189 2.719 . 0 0 "[ . 1 . 2]" 1
350 1 25 GLN HA 1 55 VAL QG 3.425 . 5.050 3.864 3.148 4.434 . 0 0 "[ . 1 . 2]" 1
351 1 25 GLN HB2 1 25 GLN QG 2.195 . 2.590 2.319 2.151 2.436 . 0 0 "[ . 1 . 2]" 1
352 1 25 GLN HB2 1 26 PHE H 2.955 . 4.110 3.581 2.988 4.337 0.227 16 0 "[ . 1 . 2]" 1
353 1 25 GLN HB3 1 25 GLN QG 2.210 . 2.620 2.266 2.146 2.358 . 0 0 "[ . 1 . 2]" 1
354 1 25 GLN HB3 1 26 PHE H 2.600 . 3.400 2.708 1.673 4.013 0.613 16 1 "[ . 1 .+ 2]" 1
355 1 25 GLN QG 1 26 PHE H 3.065 . 4.330 2.865 1.684 4.056 0.116 18 0 "[ . 1 . 2]" 1
356 1 26 PHE H 1 26 PHE HB2 2.550 . 3.300 2.646 2.479 2.980 . 0 0 "[ . 1 . 2]" 1
357 1 26 PHE H 1 26 PHE HB3 2.550 . 3.300 2.548 2.332 3.637 0.337 1 0 "[ . 1 . 2]" 1
358 1 26 PHE H 1 27 GLY H 3.645 . 5.490 4.199 2.782 4.602 . 0 0 "[ . 1 . 2]" 1
359 1 26 PHE HA 1 26 PHE QD 3.075 . 4.350 2.714 2.562 3.179 . 0 0 "[ . 1 . 2]" 1
360 1 26 PHE HA 1 27 GLY H 2.660 . 3.520 2.415 2.083 3.523 0.003 8 0 "[ . 1 . 2]" 1
361 1 26 PHE HA 1 48 CYS H 3.650 . 5.500 4.598 3.750 5.804 0.304 15 0 "[ . 1 . 2]" 1
362 1 26 PHE HA 1 48 CYS QB 2.960 . 4.120 2.285 1.619 3.332 0.181 9 0 "[ . 1 . 2]" 1
363 1 26 PHE HA 1 50 ILE QG 3.570 . 5.340 4.702 3.752 5.616 0.276 6 0 "[ . 1 . 2]" 1
364 1 26 PHE HA 1 55 VAL QG 3.065 . 4.330 2.956 2.372 3.589 . 0 0 "[ . 1 . 2]" 1
365 1 26 PHE QB 1 27 GLY H 3.030 . 4.260 3.475 2.332 3.795 . 0 0 "[ . 1 . 2]" 1
366 1 26 PHE QB 1 50 ILE MD 2.975 . 4.150 3.088 2.309 5.247 1.097 1 1 "[+ . 1 . 2]" 1
367 1 26 PHE QB 1 55 VAL QG 2.690 . 3.580 2.567 1.862 4.107 0.527 1 1 "[+ . 1 . 2]" 1
368 1 26 PHE HB2 1 55 VAL MG1 3.650 . 5.500 3.688 2.313 5.003 . 0 0 "[ . 1 . 2]" 1
369 1 26 PHE HB2 1 55 VAL MG2 3.650 . 5.500 2.771 1.956 5.436 . 0 0 "[ . 1 . 2]" 1
370 1 26 PHE HB3 1 55 VAL MG1 3.650 . 5.500 4.904 3.517 5.769 0.269 4 0 "[ . 1 . 2]" 1
371 1 26 PHE HB3 1 55 VAL MG2 3.650 . 5.500 4.112 3.215 5.483 . 0 0 "[ . 1 . 2]" 1
372 1 26 PHE QD 1 27 GLY H 2.940 . 4.080 3.322 2.955 3.967 . 0 0 "[ . 1 . 2]" 1
373 1 26 PHE QD 1 47 THR MG 3.625 . 5.450 5.008 4.507 5.516 0.066 2 0 "[ . 1 . 2]" 1
374 1 26 PHE QD 1 49 ILE HA 3.060 . 4.320 2.643 1.881 3.237 . 0 0 "[ . 1 . 2]" 1
375 1 26 PHE QD 1 50 ILE H 3.365 . 4.930 3.625 2.458 4.503 . 0 0 "[ . 1 . 2]" 1
376 1 26 PHE QD 1 50 ILE MD 3.405 . 5.010 3.169 2.590 3.999 . 0 0 "[ . 1 . 2]" 1
377 1 26 PHE QD 1 50 ILE QG 3.340 . 4.880 2.513 1.983 3.627 . 0 0 "[ . 1 . 2]" 1
378 1 26 PHE QD 1 55 VAL QG 3.045 . 4.290 2.740 1.865 3.427 . 0 0 "[ . 1 . 2]" 1
379 1 26 PHE QE 1 49 ILE HA 2.925 . 4.050 2.510 1.878 3.726 . 0 0 "[ . 1 . 2]" 1
380 1 26 PHE QE 1 50 ILE H 2.945 . 4.090 2.758 1.961 3.882 . 0 0 "[ . 1 . 2]" 1
381 1 26 PHE QE 1 50 ILE HB 3.455 . 5.110 3.932 3.176 4.861 . 0 0 "[ . 1 . 2]" 1
382 1 26 PHE QE 1 50 ILE QG 3.190 . 4.580 2.784 2.053 3.603 . 0 0 "[ . 1 . 2]" 1
383 1 26 PHE QE 1 50 ILE MG 3.555 . 5.310 4.981 4.236 5.373 0.063 11 0 "[ . 1 . 2]" 1
384 1 27 GLY H 1 28 SER H 2.615 . 3.430 2.539 2.298 2.819 . 0 0 "[ . 1 . 2]" 1
385 1 27 GLY H 1 47 THR MG 3.210 . 4.620 3.717 2.777 5.046 0.426 7 0 "[ . 1 . 2]" 1
386 1 27 GLY H 1 48 CYS H 3.610 . 5.420 4.210 3.268 5.698 0.278 9 0 "[ . 1 . 2]" 1
387 1 27 GLY H 1 48 CYS QB 2.785 . 3.770 2.991 1.969 4.518 0.748 9 1 "[ . +1 . 2]" 1
388 1 27 GLY HA2 1 47 THR MG 2.730 . 3.660 2.942 2.336 3.640 . 0 0 "[ . 1 . 2]" 1
389 1 27 GLY HA2 1 48 CYS H 3.650 . 5.500 4.807 4.075 5.647 0.147 15 0 "[ . 1 . 2]" 1
390 1 27 GLY HA3 1 47 THR MG 3.365 . 4.930 4.329 3.704 5.035 0.105 13 0 "[ . 1 . 2]" 1
391 1 28 SER H 1 28 SER HB2 2.485 . 3.170 2.774 2.447 3.553 0.383 6 0 "[ . 1 . 2]" 1
392 1 28 SER H 1 28 SER HB3 2.705 . 3.610 3.404 2.337 3.800 0.190 3 0 "[ . 1 . 2]" 1
393 1 28 SER H 1 48 CYS QB 2.855 . 3.910 2.940 1.853 4.006 0.096 9 0 "[ . 1 . 2]" 1
394 1 28 SER HA 1 28 SER HB3 2.295 . 2.790 2.497 2.319 2.982 0.192 10 0 "[ . 1 . 2]" 1
395 1 28 SER HA 1 29 GLN H 2.245 . 2.690 2.331 2.039 2.670 . 0 0 "[ . 1 . 2]" 1
396 1 28 SER HB2 1 29 GLN H 3.330 . 4.860 3.570 2.386 3.881 . 0 0 "[ . 1 . 2]" 1
397 1 28 SER HB3 1 29 GLN H 2.590 . 3.380 2.861 2.025 3.911 0.531 13 1 "[ . 1 + . 2]" 1
398 1 29 GLN H 1 29 GLN HB2 2.740 . 3.680 2.666 2.482 3.163 . 0 0 "[ . 1 . 2]" 1
399 1 29 GLN H 1 29 GLN QB 2.450 . 3.100 2.611 2.445 3.011 . 0 0 "[ . 1 . 2]" 1
400 1 29 GLN H 1 29 GLN HB3 2.740 . 3.680 3.766 3.678 3.856 0.176 11 0 "[ . 1 . 2]" 1
401 1 29 GLN H 1 29 GLN QG 3.090 . 4.380 3.072 2.286 3.315 . 0 0 "[ . 1 . 2]" 1
402 1 29 GLN H 1 30 ILE H 3.260 . 4.720 4.322 3.996 4.472 . 0 0 "[ . 1 . 2]" 1
403 1 29 GLN H 1 47 THR HA 3.460 . 5.120 4.972 4.557 5.365 0.245 5 0 "[ . 1 . 2]" 1
404 1 29 GLN HA 1 30 ILE H 2.350 . 2.900 2.184 2.017 2.329 . 0 0 "[ . 1 . 2]" 1
405 1 29 GLN HA 1 30 ILE MG 3.460 . 5.120 3.720 3.379 4.103 . 0 0 "[ . 1 . 2]" 1
406 1 29 GLN HA 1 46 ALA H 3.105 . 4.410 3.898 3.353 4.522 0.112 18 0 "[ . 1 . 2]" 1
407 1 29 GLN HA 1 47 THR HA 2.740 . 3.680 2.908 2.461 3.240 . 0 0 "[ . 1 . 2]" 1
408 1 29 GLN HA 1 47 THR MG 3.130 . 4.460 4.347 3.783 4.864 0.404 15 0 "[ . 1 . 2]" 1
409 1 29 GLN HA 1 48 CYS H 2.960 . 4.120 4.001 3.259 4.866 0.746 15 1 "[ . 1 + 2]" 1
410 1 29 GLN HA 1 57 TRP HZ3 3.530 . 5.260 3.323 2.502 3.911 . 0 0 "[ . 1 . 2]" 1
411 1 29 GLN QB 1 30 ILE H 2.640 . 3.480 2.765 2.414 3.193 . 0 0 "[ . 1 . 2]" 1
412 1 29 GLN QB 1 30 ILE HA 3.090 . 4.380 4.033 3.891 4.261 . 0 0 "[ . 1 . 2]" 1
413 1 29 GLN QB 1 30 ILE MG 3.490 . 5.180 4.526 4.315 4.850 . 0 0 "[ . 1 . 2]" 1
414 1 29 GLN QB 1 31 LYS QD 2.710 . 3.620 3.490 2.608 3.945 0.325 17 0 "[ . 1 . 2]" 1
415 1 29 GLN QB 1 31 LYS QE 3.145 . 4.490 3.139 2.259 4.663 0.173 10 0 "[ . 1 . 2]" 1
416 1 29 GLN QB 1 45 SER HA 3.175 . 4.550 4.048 3.553 4.617 0.067 2 0 "[ . 1 . 2]" 1
417 1 29 GLN QB 1 45 SER QB 2.805 . 3.810 2.415 1.829 2.904 . 0 0 "[ . 1 . 2]" 1
418 1 29 GLN QB 1 46 ALA MB 3.435 . 5.070 4.939 4.240 5.282 0.212 12 0 "[ . 1 . 2]" 1
419 1 29 GLN HB2 1 30 ILE H 2.935 . 4.070 3.898 2.977 4.217 0.147 10 0 "[ . 1 . 2]" 1
420 1 29 GLN HB2 1 31 LYS QE 3.500 . 5.200 3.538 2.545 5.340 0.140 10 0 "[ . 1 . 2]" 1
421 1 29 GLN HB2 1 47 THR HA 3.460 . 5.120 5.093 4.422 5.307 0.187 6 0 "[ . 1 . 2]" 1
422 1 29 GLN HB3 1 30 ILE H 2.935 . 4.070 2.835 2.445 3.306 . 0 0 "[ . 1 . 2]" 1
423 1 29 GLN HB3 1 31 LYS QE 3.500 . 5.200 3.595 2.526 5.141 . 0 0 "[ . 1 . 2]" 1
424 1 29 GLN HB3 1 47 THR HA 3.460 . 5.120 4.505 2.958 4.948 . 0 0 "[ . 1 . 2]" 1
425 1 29 GLN QG 1 30 ILE H 3.260 . 4.720 3.887 3.550 4.685 . 0 0 "[ . 1 . 2]" 1
426 1 29 GLN QG 1 31 LYS QD 3.490 . 5.180 5.286 4.336 5.571 0.391 19 0 "[ . 1 . 2]" 1
427 1 29 GLN QG 1 45 SER QB 2.745 . 3.690 3.512 3.138 3.849 0.159 1 0 "[ . 1 . 2]" 1
428 1 29 GLN QG 1 47 THR HA 3.215 . 4.630 2.736 1.804 3.733 . 0 0 "[ . 1 . 2]" 1
429 1 29 GLN QG 1 47 THR MG 2.885 . 3.970 3.032 2.368 3.766 . 0 0 "[ . 1 . 2]" 1
430 1 29 GLN HG2 1 30 ILE H 3.650 . 5.500 4.098 3.689 5.152 . 0 0 "[ . 1 . 2]" 1
431 1 29 GLN HG2 1 47 THR HA 3.550 . 5.300 2.843 1.839 3.929 . 0 0 "[ . 1 . 2]" 1
432 1 29 GLN HG2 1 47 THR HB 3.650 . 5.500 4.537 4.000 6.155 0.655 14 1 "[ . 1 +. 2]" 1
433 1 29 GLN HG2 1 47 THR MG 3.165 . 4.530 3.439 2.403 3.971 . 0 0 "[ . 1 . 2]" 1
434 1 29 GLN HG3 1 30 ILE H 3.650 . 5.500 4.868 4.623 5.382 . 0 0 "[ . 1 . 2]" 1
435 1 29 GLN HG3 1 47 THR HA 3.550 . 5.300 3.612 2.608 4.662 . 0 0 "[ . 1 . 2]" 1
436 1 29 GLN HG3 1 47 THR HB 3.650 . 5.500 5.431 4.927 6.405 0.905 14 1 "[ . 1 +. 2]" 1
437 1 29 GLN HG3 1 47 THR MG 3.165 . 4.530 3.429 3.104 4.676 0.146 14 0 "[ . 1 . 2]" 1
438 1 30 ILE H 1 30 ILE HB 2.950 . 4.100 3.741 3.653 3.788 . 0 0 "[ . 1 . 2]" 1
439 1 30 ILE H 1 30 ILE QG 2.500 . 3.200 2.148 1.908 2.601 . 0 0 "[ . 1 . 2]" 1
440 1 30 ILE H 1 30 ILE MG 2.840 . 3.880 2.856 2.610 2.978 . 0 0 "[ . 1 . 2]" 1
441 1 30 ILE H 1 31 LYS HA 3.420 . 5.040 4.777 4.583 5.133 0.093 15 0 "[ . 1 . 2]" 1
442 1 30 ILE H 1 45 SER QB 3.275 . 4.750 3.722 3.064 4.313 . 0 0 "[ . 1 . 2]" 1
443 1 30 ILE H 1 46 ALA H 2.700 . 3.600 2.600 2.121 3.163 . 0 0 "[ . 1 . 2]" 1
444 1 30 ILE H 1 46 ALA HA 3.650 . 5.500 4.884 4.530 5.356 . 0 0 "[ . 1 . 2]" 1
445 1 30 ILE H 1 46 ALA MB 3.125 . 4.450 3.522 3.220 3.975 . 0 0 "[ . 1 . 2]" 1
446 1 30 ILE H 1 47 THR HA 3.420 . 5.040 4.515 3.750 5.059 0.019 15 0 "[ . 1 . 2]" 1
447 1 30 ILE H 1 57 TRP HZ3 3.075 . 4.350 3.538 3.075 4.336 . 0 0 "[ . 1 . 2]" 1
448 1 30 ILE HA 1 30 ILE MD 3.425 . 5.050 4.160 3.640 4.256 . 0 0 "[ . 1 . 2]" 1
449 1 30 ILE HA 1 30 ILE MG 2.625 . 3.450 2.383 2.282 2.497 . 0 0 "[ . 1 . 2]" 1
450 1 30 ILE HA 1 31 LYS H 2.395 . 2.990 2.280 2.069 3.285 0.295 3 0 "[ . 1 . 2]" 1
451 1 30 ILE HA 1 31 LYS HA 3.320 . 4.840 4.415 4.314 5.182 0.342 3 0 "[ . 1 . 2]" 1
452 1 30 ILE HA 1 31 LYS QG 3.510 . 5.220 4.201 3.281 5.259 0.039 14 0 "[ . 1 . 2]" 1
453 1 30 ILE HA 1 46 ALA H 3.650 . 5.500 4.939 4.565 5.544 0.044 3 0 "[ . 1 . 2]" 1
454 1 30 ILE HB 1 30 ILE MD 2.780 . 3.760 2.502 2.371 3.210 . 0 0 "[ . 1 . 2]" 1
455 1 30 ILE HB 1 31 LYS H 3.265 . 4.730 3.087 2.632 4.113 . 0 0 "[ . 1 . 2]" 1
456 1 30 ILE HB 1 46 ALA H 3.650 . 5.500 4.924 4.536 5.588 0.088 3 0 "[ . 1 . 2]" 1
457 1 30 ILE MD 1 30 ILE MG 2.610 . 3.420 1.955 1.799 2.124 0.001 16 0 "[ . 1 . 2]" 1
458 1 30 ILE MD 1 46 ALA MB 2.735 . 3.670 2.574 1.818 3.031 . 0 0 "[ . 1 . 2]" 1
459 1 30 ILE MD 1 57 TRP HE3 3.350 . 4.900 3.842 3.241 4.676 . 0 0 "[ . 1 . 2]" 1
460 1 30 ILE MD 1 57 TRP HH2 3.510 . 5.220 3.233 2.749 3.738 . 0 0 "[ . 1 . 2]" 1
461 1 30 ILE MD 1 57 TRP HZ2 3.590 . 5.380 3.536 2.833 4.022 . 0 0 "[ . 1 . 2]" 1
462 1 30 ILE MD 1 57 TRP HZ3 3.295 . 4.790 3.514 2.460 4.314 . 0 0 "[ . 1 . 2]" 1
463 1 30 ILE QG 1 31 LYS H 3.300 . 4.800 3.894 2.809 4.220 . 0 0 "[ . 1 . 2]" 1
464 1 30 ILE QG 1 31 LYS HA 3.335 . 4.870 3.994 3.449 4.411 . 0 0 "[ . 1 . 2]" 1
465 1 30 ILE QG 1 45 SER H 3.650 . 5.500 5.685 5.504 6.008 0.508 17 1 "[ . 1 . + 2]" 1
466 1 30 ILE QG 1 46 ALA H 2.625 . 3.450 2.509 2.225 2.778 . 0 0 "[ . 1 . 2]" 1
467 1 30 ILE QG 1 46 ALA MB 2.440 . 3.080 2.447 1.950 3.320 0.240 8 0 "[ . 1 . 2]" 1
468 1 30 ILE MG 1 31 LYS H 3.005 . 4.210 3.912 3.733 4.228 0.018 3 0 "[ . 1 . 2]" 1
469 1 30 ILE MG 1 45 SER HA 3.650 . 5.500 5.497 5.299 5.750 0.250 17 0 "[ . 1 . 2]" 1
470 1 30 ILE MG 1 46 ALA MB 3.280 . 4.760 4.138 3.767 4.499 . 0 0 "[ . 1 . 2]" 1
471 1 30 ILE MG 1 57 TRP HH2 2.740 . 3.680 2.273 1.943 3.122 . 0 0 "[ . 1 . 2]" 1
472 1 30 ILE MG 1 57 TRP HZ2 3.110 . 4.420 3.523 2.901 4.277 . 0 0 "[ . 1 . 2]" 1
473 1 31 LYS H 1 31 LYS QB 2.625 . 3.450 2.515 2.165 3.236 . 0 0 "[ . 1 . 2]" 1
474 1 31 LYS H 1 31 LYS QE 3.035 . 4.270 4.395 3.723 4.669 0.399 17 0 "[ . 1 . 2]" 1
475 1 31 LYS HA 1 31 LYS HD2 3.380 . 4.960 3.406 2.732 4.809 . 0 0 "[ . 1 . 2]" 1
476 1 31 LYS HA 1 31 LYS QD 2.985 . 4.170 3.022 2.047 4.187 0.017 10 0 "[ . 1 . 2]" 1
477 1 31 LYS HA 1 31 LYS HD3 3.380 . 4.960 3.739 2.083 4.671 . 0 0 "[ . 1 . 2]" 1
478 1 31 LYS HA 1 31 LYS QG 2.860 . 3.920 2.565 2.291 3.250 . 0 0 "[ . 1 . 2]" 1
479 1 31 LYS HA 1 32 TYR H 2.335 . 2.870 2.220 2.115 2.311 . 0 0 "[ . 1 . 2]" 1
480 1 31 LYS HA 1 45 SER HA 2.520 . 3.240 2.688 2.022 3.155 . 0 0 "[ . 1 . 2]" 1
481 1 31 LYS HA 1 45 SER HB2 3.155 . 4.510 4.422 3.740 4.928 0.418 10 0 "[ . 1 . 2]" 1
482 1 31 LYS HA 1 45 SER QB 2.820 . 3.840 3.335 2.439 3.979 0.139 10 0 "[ . 1 . 2]" 1
483 1 31 LYS HA 1 45 SER HB3 3.155 . 4.510 3.465 2.472 4.200 . 0 0 "[ . 1 . 2]" 1
484 1 31 LYS QB 1 32 TYR H 2.770 . 3.740 2.996 2.619 3.687 . 0 0 "[ . 1 . 2]" 1
485 1 31 LYS QB 1 32 TYR HA 3.265 . 4.730 4.075 3.858 4.432 . 0 0 "[ . 1 . 2]" 1
486 1 31 LYS HB2 1 32 TYR HA 3.650 . 5.500 4.764 4.414 5.077 . 0 0 "[ . 1 . 2]" 1
487 1 31 LYS HB3 1 32 TYR HA 3.650 . 5.500 4.474 4.046 5.744 0.244 10 0 "[ . 1 . 2]" 1
488 1 31 LYS QD 1 31 LYS QG 2.110 . 2.420 2.077 1.961 2.105 . 0 0 "[ . 1 . 2]" 1
489 1 31 LYS QD 1 45 SER HA 3.125 . 4.450 4.106 3.043 4.750 0.300 5 0 "[ . 1 . 2]" 1
490 1 31 LYS QD 1 45 SER QB 2.905 . 4.010 3.118 1.750 4.122 0.112 6 0 "[ . 1 . 2]" 1
491 1 31 LYS HD2 1 31 LYS QG 2.320 . 2.840 2.342 2.285 2.384 . 0 0 "[ . 1 . 2]" 1
492 1 31 LYS HD3 1 31 LYS QG 2.320 . 2.840 2.327 2.106 2.429 . 0 0 "[ . 1 . 2]" 1
493 1 31 LYS QE 1 31 LYS QG 2.480 . 3.160 2.158 2.049 2.312 . 0 0 "[ . 1 . 2]" 1
494 1 31 LYS QG 1 32 TYR H 3.300 . 4.800 4.130 3.557 4.881 0.081 3 0 "[ . 1 . 2]" 1
495 1 31 LYS QG 1 45 SER HA 3.580 . 5.360 3.934 2.490 5.159 . 0 0 "[ . 1 . 2]" 1
496 1 31 LYS QG 1 45 SER HB2 3.230 . 4.660 4.167 3.407 5.395 0.735 4 2 "[- +. 1 . 2]" 1
497 1 31 LYS QG 1 45 SER QB 2.910 . 4.020 3.042 2.288 4.095 0.075 4 0 "[ . 1 . 2]" 1
498 1 31 LYS QG 1 45 SER HB3 3.230 . 4.660 3.147 2.312 4.243 . 0 0 "[ . 1 . 2]" 1
499 1 32 TYR H 1 32 TYR QD 3.150 . 4.500 4.179 3.493 4.396 . 0 0 "[ . 1 . 2]" 1
500 1 32 TYR H 1 40 LEU QD 3.300 . 4.800 4.177 3.632 4.941 0.141 13 0 "[ . 1 . 2]" 1
501 1 32 TYR H 1 44 SER HA 3.225 . 4.650 3.821 3.213 4.455 . 0 0 "[ . 1 . 2]" 1
502 1 32 TYR H 1 45 SER HA 3.100 . 4.400 3.892 3.236 4.317 . 0 0 "[ . 1 . 2]" 1
503 1 32 TYR HA 1 32 TYR QD 2.860 . 3.920 2.588 1.931 3.020 . 0 0 "[ . 1 . 2]" 1
504 1 32 TYR HA 1 32 TYR QE 3.430 . 5.060 4.500 4.017 4.698 . 0 0 "[ . 1 . 2]" 1
505 1 32 TYR HA 1 40 LEU QD 3.620 . 5.440 4.551 3.994 5.189 . 0 0 "[ . 1 . 2]" 1
506 1 32 TYR QB 1 33 SER H 2.980 . 4.160 3.416 2.481 3.926 . 0 0 "[ . 1 . 2]" 1
507 1 32 TYR QB 1 40 LEU QD 2.885 . 3.970 2.780 1.827 3.741 . 0 0 "[ . 1 . 2]" 1
508 1 32 TYR QB 1 44 SER HA 2.915 . 4.030 3.307 2.480 3.980 . 0 0 "[ . 1 . 2]" 1
509 1 32 TYR HB2 1 33 SER H 3.305 . 4.810 4.102 3.846 4.476 . 0 0 "[ . 1 . 2]" 1
510 1 32 TYR HB3 1 33 SER H 3.305 . 4.810 3.751 2.511 4.345 . 0 0 "[ . 1 . 2]" 1
511 1 32 TYR QD 1 33 SER H 3.065 . 4.330 2.929 2.242 3.680 . 0 0 "[ . 1 . 2]" 1
512 1 32 TYR QD 1 40 LEU MD1 3.330 . 4.860 2.530 1.770 4.413 0.030 16 0 "[ . 1 . 2]" 1
513 1 32 TYR QD 1 40 LEU QD 2.945 . 4.090 2.384 1.740 4.123 0.060 16 0 "[ . 1 . 2]" 1
514 1 32 TYR QD 1 40 LEU MD2 3.330 . 4.860 3.856 1.809 4.960 0.100 20 0 "[ . 1 . 2]" 1
515 1 32 TYR QD 1 44 SER HA 3.225 . 4.650 4.234 3.144 4.821 0.171 17 0 "[ . 1 . 2]" 1
516 1 32 TYR QD 1 61 THR MG 3.165 . 4.530 3.400 2.084 4.266 . 0 0 "[ . 1 . 2]" 1
517 1 32 TYR QE 1 33 SER H 3.045 . 4.290 4.300 3.668 4.884 0.594 6 1 "[ .+ 1 . 2]" 1
518 1 32 TYR QE 1 61 THR MG 3.335 . 4.870 4.001 1.641 5.088 0.218 7 0 "[ . 1 . 2]" 1
519 1 33 SER H 1 34 CYS H 3.450 . 5.100 4.482 4.261 4.671 . 0 0 "[ . 1 . 2]" 1
520 1 33 SER HA 1 34 CYS H 2.630 . 3.460 2.344 2.242 2.468 . 0 0 "[ . 1 . 2]" 1
521 1 33 SER HA 1 34 CYS HA 3.275 . 4.750 4.416 4.324 4.513 . 0 0 "[ . 1 . 2]" 1
522 1 33 SER HA 1 40 LEU QD 2.715 . 3.630 3.100 2.319 4.052 0.422 17 0 "[ . 1 . 2]" 1
523 1 33 SER QB 1 34 CYS H 2.625 . 3.450 2.792 2.389 3.548 0.098 4 0 "[ . 1 . 2]" 1
524 1 34 CYS H 1 34 CYS QB 2.585 . 3.370 2.597 2.447 2.810 . 0 0 "[ . 1 . 2]" 1
525 1 34 CYS H 1 40 LEU QD 3.180 . 4.560 3.471 2.666 4.303 . 0 0 "[ . 1 . 2]" 1
526 1 34 CYS HA 1 35 THR H 2.470 . 3.140 2.394 2.142 2.629 . 0 0 "[ . 1 . 2]" 1
527 1 34 CYS HA 1 38 TYR HB2 3.500 . 5.200 4.587 4.112 5.186 . 0 0 "[ . 1 . 2]" 1
528 1 34 CYS HA 1 40 LEU QD 3.345 . 4.890 4.131 3.597 5.069 0.179 15 0 "[ . 1 . 2]" 1
529 1 34 CYS QB 1 35 THR H 2.780 . 3.760 2.364 1.784 2.809 0.016 19 0 "[ . 1 . 2]" 1
530 1 34 CYS QB 1 38 TYR H 3.065 . 4.330 3.980 3.710 4.353 0.023 19 0 "[ . 1 . 2]" 1
531 1 34 CYS QB 1 38 TYR HA 3.415 . 5.030 4.519 4.154 4.974 . 0 0 "[ . 1 . 2]" 1
532 1 34 CYS QB 1 38 TYR HB2 2.710 . 3.620 2.465 2.149 2.984 . 0 0 "[ . 1 . 2]" 1
533 1 34 CYS QB 1 38 TYR HB3 2.915 . 4.030 3.070 2.521 3.756 . 0 0 "[ . 1 . 2]" 1
534 1 34 CYS QB 1 40 LEU QD 2.720 . 3.640 3.064 2.693 3.697 0.057 5 0 "[ . 1 . 2]" 1
535 1 34 CYS QB 1 67 ILE MD 3.570 . 5.340 4.885 4.453 5.588 0.248 15 0 "[ . 1 . 2]" 1
536 1 35 THR H 1 35 THR HB 2.580 . 3.360 3.028 2.480 3.558 0.198 7 0 "[ . 1 . 2]" 1
537 1 35 THR H 1 35 THR MG 2.840 . 3.880 3.099 1.797 3.758 0.003 20 0 "[ . 1 . 2]" 1
538 1 35 THR H 1 36 LYS H 3.485 . 5.170 4.590 4.505 4.664 . 0 0 "[ . 1 . 2]" 1
539 1 35 THR H 1 38 TYR H 3.650 . 5.500 4.876 4.703 5.273 . 0 0 "[ . 1 . 2]" 1
540 1 35 THR H 1 38 TYR HB2 2.930 . 4.060 3.124 2.778 3.523 . 0 0 "[ . 1 . 2]" 1
541 1 35 THR H 1 38 TYR QD 3.170 . 4.540 3.908 3.391 4.566 0.026 5 0 "[ . 1 . 2]" 1
542 1 35 THR HA 1 35 THR MG 2.330 . 2.860 2.358 2.173 3.168 0.308 20 0 "[ . 1 . 2]" 1
543 1 35 THR HA 1 36 LYS H 2.295 . 2.790 2.485 2.312 2.623 . 0 0 "[ . 1 . 2]" 1
544 1 35 THR HA 1 36 LYS HB2 3.650 . 5.500 4.572 4.386 4.696 . 0 0 "[ . 1 . 2]" 1
545 1 35 THR HA 1 36 LYS QB 3.315 . 4.830 4.230 4.091 4.337 . 0 0 "[ . 1 . 2]" 1
546 1 35 THR HA 1 36 LYS HB3 3.650 . 5.500 4.998 4.563 5.157 . 0 0 "[ . 1 . 2]" 1
547 1 35 THR HB 1 36 LYS H 2.985 . 4.170 2.998 2.234 3.871 . 0 0 "[ . 1 . 2]" 1
548 1 35 THR HB 1 38 TYR QD 2.770 . 3.740 2.949 2.172 4.191 0.451 20 0 "[ . 1 . 2]" 1
549 1 35 THR MG 1 36 LYS H 2.705 . 3.610 2.691 1.716 3.590 0.084 15 0 "[ . 1 . 2]" 1
550 1 36 LYS H 1 36 LYS HB2 2.520 . 3.240 2.462 2.333 2.684 . 0 0 "[ . 1 . 2]" 1
551 1 36 LYS H 1 36 LYS QB 2.295 . 2.790 2.210 1.996 2.289 . 0 0 "[ . 1 . 2]" 1
552 1 36 LYS H 1 36 LYS HB3 2.520 . 3.240 2.523 2.058 2.624 . 0 0 "[ . 1 . 2]" 1
553 1 36 LYS HA 1 36 LYS QD 2.815 . 3.830 3.722 2.099 4.013 0.183 16 0 "[ . 1 . 2]" 1
554 1 36 LYS HA 1 36 LYS HE2 3.650 . 5.500 5.232 4.664 5.463 . 0 0 "[ . 1 . 2]" 1
555 1 36 LYS HA 1 36 LYS QE 3.265 . 4.730 4.571 4.092 4.819 0.089 15 0 "[ . 1 . 2]" 1
556 1 36 LYS HA 1 36 LYS HE3 3.650 . 5.500 5.100 4.428 5.888 0.388 13 0 "[ . 1 . 2]" 1
557 1 36 LYS HA 1 36 LYS QG 2.635 . 3.470 2.506 2.334 2.930 . 0 0 "[ . 1 . 2]" 1
558 1 36 LYS HA 1 38 TYR H 2.875 . 3.950 3.306 3.102 3.543 . 0 0 "[ . 1 . 2]" 1
559 1 36 LYS QB 1 36 LYS QE 2.915 . 4.030 3.546 3.501 3.636 . 0 0 "[ . 1 . 2]" 1
560 1 36 LYS QD 1 36 LYS QG 2.230 . 2.660 2.087 2.072 2.100 . 0 0 "[ . 1 . 2]" 1
561 1 36 LYS QD 1 37 GLY H 3.325 . 4.850 4.303 2.290 4.881 0.031 5 0 "[ . 1 . 2]" 1
562 1 36 LYS QD 1 90 TYR QE 3.630 . 5.460 4.651 2.943 5.636 0.176 6 0 "[ . 1 . 2]" 1
563 1 36 LYS QE 1 36 LYS QG 2.640 . 3.480 2.142 2.084 2.226 . 0 0 "[ . 1 . 2]" 1
564 1 36 LYS QE 1 90 TYR QE 3.150 . 4.500 3.483 2.103 4.598 0.098 6 0 "[ . 1 . 2]" 1
565 1 36 LYS HE2 1 36 LYS QG 2.960 . 4.120 2.402 2.269 2.465 . 0 0 "[ . 1 . 2]" 1
566 1 36 LYS HE3 1 36 LYS QG 2.960 . 4.120 2.433 2.332 3.218 . 0 0 "[ . 1 . 2]" 1
567 1 36 LYS QG 1 37 GLY H 3.090 . 4.380 2.749 2.579 3.042 . 0 0 "[ . 1 . 2]" 1
568 1 36 LYS QG 1 37 GLY HA2 3.220 . 4.640 3.824 3.555 4.582 . 0 0 "[ . 1 . 2]" 1
569 1 36 LYS QG 1 37 GLY QA 2.935 . 4.070 3.379 3.182 4.135 0.065 2 0 "[ . 1 . 2]" 1
570 1 36 LYS QG 1 37 GLY HA3 3.220 . 4.640 3.770 3.499 4.706 0.066 2 0 "[ . 1 . 2]" 1
571 1 36 LYS QG 1 90 TYR QE 3.235 . 4.670 3.720 3.312 4.585 . 0 0 "[ . 1 . 2]" 1
572 1 37 GLY H 1 38 TYR H 2.535 . 3.270 2.463 2.313 2.610 . 0 0 "[ . 1 . 2]" 1
573 1 37 GLY QA 1 38 TYR QD 3.285 . 4.770 3.793 3.496 4.135 . 0 0 "[ . 1 . 2]" 1
574 1 37 GLY QA 1 66 ARG HA 3.570 . 5.340 4.573 4.165 4.817 . 0 0 "[ . 1 . 2]" 1
575 1 37 GLY QA 1 67 ILE H 3.160 . 4.520 3.965 3.640 4.267 . 0 0 "[ . 1 . 2]" 1
576 1 37 GLY QA 1 67 ILE HB 3.205 . 4.610 4.040 3.550 4.361 . 0 0 "[ . 1 . 2]" 1
577 1 37 GLY QA 1 67 ILE MD 2.850 . 3.900 2.746 2.411 3.108 . 0 0 "[ . 1 . 2]" 1
578 1 37 GLY QA 1 90 TYR QD 2.900 . 4.000 2.940 2.681 3.315 . 0 0 "[ . 1 . 2]" 1
579 1 37 GLY HA2 1 67 ILE MD 3.205 . 4.610 2.788 2.438 3.169 . 0 0 "[ . 1 . 2]" 1
580 1 37 GLY HA2 1 90 TYR HB3 3.185 . 4.570 3.822 2.740 4.585 0.015 6 0 "[ . 1 . 2]" 1
581 1 37 GLY HA2 1 90 TYR QD 3.190 . 4.580 3.148 2.855 3.532 . 0 0 "[ . 1 . 2]" 1
582 1 37 GLY HA3 1 67 ILE MD 3.205 . 4.610 4.133 3.792 4.492 . 0 0 "[ . 1 . 2]" 1
583 1 37 GLY HA3 1 90 TYR HB3 3.185 . 4.570 4.334 3.562 4.804 0.234 6 0 "[ . 1 . 2]" 1
584 1 37 GLY HA3 1 90 TYR QD 3.190 . 4.580 3.563 3.179 4.189 . 0 0 "[ . 1 . 2]" 1
585 1 38 TYR H 1 38 TYR HB2 2.730 . 3.660 2.624 2.564 2.673 . 0 0 "[ . 1 . 2]" 1
586 1 38 TYR H 1 38 TYR HB3 2.840 . 3.880 3.757 3.718 3.798 . 0 0 "[ . 1 . 2]" 1
587 1 38 TYR H 1 38 TYR QD 2.545 . 3.290 2.863 2.667 3.140 . 0 0 "[ . 1 . 2]" 1
588 1 38 TYR H 1 66 ARG HA 3.555 . 5.310 4.872 4.459 5.249 . 0 0 "[ . 1 . 2]" 1
589 1 38 TYR H 1 67 ILE MD 3.155 . 4.510 3.249 2.621 3.583 . 0 0 "[ . 1 . 2]" 1
590 1 38 TYR H 1 67 ILE QG 3.035 . 4.270 3.445 3.211 3.718 . 0 0 "[ . 1 . 2]" 1
591 1 38 TYR HA 1 38 TYR QD 3.080 . 4.360 2.909 2.640 3.088 . 0 0 "[ . 1 . 2]" 1
592 1 38 TYR HA 1 39 ARG H 2.465 . 3.130 2.254 2.204 2.306 . 0 0 "[ . 1 . 2]" 1
593 1 38 TYR HA 1 39 ARG HB3 3.450 . 5.100 4.600 4.344 4.799 . 0 0 "[ . 1 . 2]" 1
594 1 38 TYR HA 1 39 ARG QG 3.075 . 4.350 4.175 3.918 4.364 0.014 2 0 "[ . 1 . 2]" 1
595 1 38 TYR HA 1 65 ASP H 3.485 . 5.170 4.354 3.802 5.260 0.090 12 0 "[ . 1 . 2]" 1
596 1 38 TYR HA 1 66 ARG HA 2.750 . 3.700 2.406 2.071 2.768 . 0 0 "[ . 1 . 2]" 1
597 1 38 TYR HA 1 66 ARG QG 3.105 . 4.410 4.262 3.864 4.808 0.398 17 0 "[ . 1 . 2]" 1
598 1 38 TYR HA 1 67 ILE H 2.655 . 3.510 2.641 2.308 3.051 . 0 0 "[ . 1 . 2]" 1
599 1 38 TYR HA 1 67 ILE HB 3.260 . 4.720 4.663 4.281 4.942 0.222 5 0 "[ . 1 . 2]" 1
600 1 38 TYR HA 1 67 ILE MD 2.850 . 3.900 3.693 3.208 3.959 0.059 10 0 "[ . 1 . 2]" 1
601 1 38 TYR HA 1 67 ILE HG12 3.310 . 4.820 3.365 3.043 3.692 . 0 0 "[ . 1 . 2]" 1
602 1 38 TYR HA 1 67 ILE QG 2.910 . 4.020 2.388 1.987 2.614 . 0 0 "[ . 1 . 2]" 1
603 1 38 TYR HA 1 67 ILE HG13 3.310 . 4.820 2.450 2.008 2.724 . 0 0 "[ . 1 . 2]" 1
604 1 38 TYR HA 1 67 ILE MG 3.440 . 5.080 4.996 4.755 5.191 0.111 8 0 "[ . 1 . 2]" 1
605 1 38 TYR HB2 1 39 ARG H 2.870 . 3.940 3.996 3.874 4.071 0.131 9 0 "[ . 1 . 2]" 1
606 1 38 TYR HB2 1 66 ARG HA 3.650 . 5.500 4.917 4.624 5.254 . 0 0 "[ . 1 . 2]" 1
607 1 38 TYR HB3 1 39 ARG H 2.850 . 3.900 2.925 2.762 3.036 . 0 0 "[ . 1 . 2]" 1
608 1 38 TYR HB3 1 39 ARG HA 3.305 . 4.810 4.443 4.292 4.654 . 0 0 "[ . 1 . 2]" 1
609 1 38 TYR HB3 1 64 CYS HA 3.320 . 4.840 3.872 3.526 4.128 . 0 0 "[ . 1 . 2]" 1
610 1 38 TYR HB3 1 65 ASP H 3.155 . 4.510 3.509 2.974 4.295 . 0 0 "[ . 1 . 2]" 1
611 1 38 TYR HB3 1 66 ARG HA 3.475 . 5.150 4.027 3.731 4.347 . 0 0 "[ . 1 . 2]" 1
612 1 38 TYR HB3 1 67 ILE MD 3.650 . 5.500 5.263 4.775 5.544 0.044 4 0 "[ . 1 . 2]" 1
613 1 38 TYR QD 1 39 ARG H 3.150 . 4.500 3.958 3.675 4.084 . 0 0 "[ . 1 . 2]" 1
614 1 38 TYR QD 1 64 CYS HA 3.555 . 5.310 5.035 4.624 5.440 0.130 14 0 "[ . 1 . 2]" 1
615 1 38 TYR QD 1 64 CYS QB 3.060 . 4.320 3.767 3.301 4.444 0.124 12 0 "[ . 1 . 2]" 1
616 1 38 TYR QD 1 65 ASP H 3.005 . 4.210 3.915 3.412 4.393 0.183 12 0 "[ . 1 . 2]" 1
617 1 38 TYR QD 1 65 ASP HA 3.035 . 4.270 2.713 2.151 3.280 . 0 0 "[ . 1 . 2]" 1
618 1 38 TYR QD 1 66 ARG H 2.840 . 3.880 3.123 2.792 3.519 . 0 0 "[ . 1 . 2]" 1
619 1 38 TYR QD 1 66 ARG HA 3.020 . 4.240 2.711 2.174 3.135 . 0 0 "[ . 1 . 2]" 1
620 1 38 TYR QD 1 67 ILE H 3.185 . 4.570 4.446 3.870 4.812 0.242 6 0 "[ . 1 . 2]" 1
621 1 38 TYR QE 1 65 ASP HA 3.310 . 4.820 3.937 3.215 4.558 . 0 0 "[ . 1 . 2]" 1
622 1 38 TYR QE 1 66 ARG H 2.960 . 4.120 3.682 3.351 4.072 . 0 0 "[ . 1 . 2]" 1
623 1 38 TYR QE 1 66 ARG HA 3.315 . 4.830 3.725 3.228 4.215 . 0 0 "[ . 1 . 2]" 1
624 1 38 TYR QE 1 66 ARG HB2 3.640 . 5.480 4.085 2.462 5.225 . 0 0 "[ . 1 . 2]" 1
625 1 38 TYR QE 1 66 ARG QB 3.270 . 4.740 3.761 2.445 4.771 0.031 17 0 "[ . 1 . 2]" 1
626 1 38 TYR QE 1 66 ARG HB3 3.640 . 5.480 4.686 4.016 5.514 0.034 17 0 "[ . 1 . 2]" 1
627 1 38 TYR QE 1 66 ARG QD 2.900 . 4.000 3.748 2.677 4.347 0.347 16 0 "[ . 1 . 2]" 1
628 1 38 TYR QE 1 66 ARG QG 2.920 . 4.040 2.691 2.061 4.143 0.103 3 0 "[ . 1 . 2]" 1
629 1 39 ARG H 1 39 ARG QG 2.515 . 3.230 2.551 2.377 2.700 . 0 0 "[ . 1 . 2]" 1
630 1 39 ARG H 1 40 LEU H 3.100 . 4.400 4.405 4.365 4.490 0.090 13 0 "[ . 1 . 2]" 1
631 1 39 ARG H 1 64 CYS HA 3.050 . 4.300 3.966 3.759 4.231 . 0 0 "[ . 1 . 2]" 1
632 1 39 ARG H 1 64 CYS QB 3.285 . 4.770 4.251 3.807 4.841 0.071 18 0 "[ . 1 . 2]" 1
633 1 39 ARG H 1 65 ASP H 2.800 . 3.800 2.939 2.522 3.819 0.019 8 0 "[ . 1 . 2]" 1
634 1 39 ARG H 1 66 ARG HA 3.100 . 4.400 3.823 3.567 4.104 . 0 0 "[ . 1 . 2]" 1
635 1 39 ARG H 1 67 ILE H 3.035 . 4.270 3.696 3.374 4.037 . 0 0 "[ . 1 . 2]" 1
636 1 39 ARG H 1 67 ILE MD 3.315 . 4.830 3.988 3.581 4.172 . 0 0 "[ . 1 . 2]" 1
637 1 39 ARG H 1 67 ILE HG12 3.025 . 4.250 2.849 2.451 3.139 . 0 0 "[ . 1 . 2]" 1
638 1 39 ARG H 1 67 ILE QG 2.675 . 3.550 2.655 2.349 2.850 . 0 0 "[ . 1 . 2]" 1
639 1 39 ARG H 1 67 ILE HG13 3.025 . 4.250 3.217 2.778 3.688 . 0 0 "[ . 1 . 2]" 1
640 1 39 ARG HA 1 39 ARG HD2 3.495 . 5.190 4.794 3.927 5.442 0.252 20 0 "[ . 1 . 2]" 1
641 1 39 ARG HA 1 39 ARG HD3 3.120 . 4.440 4.575 4.153 4.717 0.277 2 0 "[ . 1 . 2]" 1
642 1 39 ARG HA 1 40 LEU H 2.305 . 2.810 2.410 2.312 2.538 . 0 0 "[ . 1 . 2]" 1
643 1 39 ARG HA 1 40 LEU QD 3.400 . 5.000 2.848 2.497 4.231 . 0 0 "[ . 1 . 2]" 1
644 1 39 ARG HA 1 64 CYS HA 3.325 . 4.850 4.526 4.180 4.829 . 0 0 "[ . 1 . 2]" 1
645 1 39 ARG HA 1 65 ASP H 3.650 . 5.500 4.803 4.387 5.518 0.018 8 0 "[ . 1 . 2]" 1
646 1 39 ARG HA 1 67 ILE MD 3.175 . 4.550 3.852 3.437 4.172 . 0 0 "[ . 1 . 2]" 1
647 1 39 ARG HA 1 67 ILE QG 3.085 . 4.370 3.527 3.185 3.750 . 0 0 "[ . 1 . 2]" 1
648 1 39 ARG HA 1 67 ILE MG 3.650 . 5.500 5.068 4.604 5.498 . 0 0 "[ . 1 . 2]" 1
649 1 39 ARG HB2 1 39 ARG HD2 2.585 . 3.370 2.890 2.210 3.556 0.186 18 0 "[ . 1 . 2]" 1
650 1 39 ARG HB2 1 39 ARG HD3 2.460 . 3.120 2.425 2.231 2.806 . 0 0 "[ . 1 . 2]" 1
651 1 39 ARG HB2 1 39 ARG QG 2.210 . 2.620 2.438 2.365 2.540 . 0 0 "[ . 1 . 2]" 1
652 1 39 ARG HB2 1 40 LEU H 2.715 . 3.630 2.095 1.711 2.403 0.089 14 0 "[ . 1 . 2]" 1
653 1 39 ARG HB2 1 40 LEU MD1 3.650 . 5.500 5.072 4.291 5.466 . 0 0 "[ . 1 . 2]" 1
654 1 39 ARG HB2 1 40 LEU QD 3.105 . 4.410 3.518 3.082 4.108 . 0 0 "[ . 1 . 2]" 1
655 1 39 ARG HB2 1 40 LEU MD2 3.650 . 5.500 3.637 3.109 5.246 . 0 0 "[ . 1 . 2]" 1
656 1 39 ARG HB2 1 67 ILE HA 3.650 . 5.500 4.887 4.546 5.331 . 0 0 "[ . 1 . 2]" 1
657 1 39 ARG HB2 1 67 ILE MD 3.070 . 4.340 4.099 3.708 4.460 0.120 18 0 "[ . 1 . 2]" 1
658 1 39 ARG HB2 1 67 ILE MG 3.250 . 4.700 4.109 3.683 4.697 . 0 0 "[ . 1 . 2]" 1
659 1 39 ARG HB3 1 40 LEU H 2.930 . 4.060 3.565 3.298 3.821 . 0 0 "[ . 1 . 2]" 1
660 1 39 ARG HB3 1 67 ILE MD 2.675 . 3.550 2.721 2.343 3.095 . 0 0 "[ . 1 . 2]" 1
661 1 39 ARG HB3 1 67 ILE QG 2.755 . 3.710 1.971 1.769 2.209 0.031 17 0 "[ . 1 . 2]" 1
662 1 39 ARG HD2 1 40 LEU QD 3.620 . 5.440 5.015 4.310 5.803 0.363 18 0 "[ . 1 . 2]" 1
663 1 39 ARG HD2 1 41 ILE HA 3.025 . 4.250 3.678 3.102 4.245 . 0 0 "[ . 1 . 2]" 1
664 1 39 ARG HD2 1 41 ILE MD 3.060 . 4.320 3.445 2.758 4.124 . 0 0 "[ . 1 . 2]" 1
665 1 39 ARG HD2 1 67 ILE MD 3.650 . 5.500 5.348 5.050 5.662 0.162 17 0 "[ . 1 . 2]" 1
666 1 39 ARG HD2 1 67 ILE QG 3.190 . 4.580 4.446 4.149 4.735 0.155 13 0 "[ . 1 . 2]" 1
667 1 39 ARG HD2 1 67 ILE MG 3.650 . 5.500 3.947 3.293 4.662 . 0 0 "[ . 1 . 2]" 1
668 1 39 ARG HD2 1 68 PRO HD2 3.260 . 4.720 3.721 2.343 4.562 . 0 0 "[ . 1 . 2]" 1
669 1 39 ARG HD2 1 68 PRO QD 2.955 . 4.110 3.521 2.290 4.193 0.083 14 0 "[ . 1 . 2]" 1
670 1 39 ARG HD2 1 68 PRO HD3 3.260 . 4.720 4.469 3.220 5.134 0.414 14 0 "[ . 1 . 2]" 1
671 1 39 ARG HD3 1 40 LEU HB2 3.345 . 4.890 5.055 4.149 5.671 0.781 8 6 "[ * - + * * *. 2]" 1
672 1 39 ARG HD3 1 40 LEU QD 3.620 . 5.440 5.056 4.318 5.996 0.556 5 1 "[ + 1 . 2]" 1
673 1 39 ARG HD3 1 41 ILE HA 3.280 . 4.760 4.569 3.873 5.323 0.563 12 1 "[ . 1 + . 2]" 1
674 1 39 ARG HD3 1 41 ILE MD 3.070 . 4.340 4.315 3.706 4.569 0.229 2 0 "[ . 1 . 2]" 1
675 1 39 ARG HD3 1 67 ILE HA 3.410 . 5.020 4.342 3.249 5.196 0.176 19 0 "[ . 1 . 2]" 1
676 1 39 ARG HD3 1 67 ILE MD 3.600 . 5.400 4.708 3.743 5.342 . 0 0 "[ . 1 . 2]" 1
677 1 39 ARG HD3 1 67 ILE QG 3.220 . 4.640 4.088 3.097 4.658 0.018 13 0 "[ . 1 . 2]" 1
678 1 39 ARG HD3 1 67 ILE MG 3.155 . 4.510 3.393 1.970 4.449 . 0 0 "[ . 1 . 2]" 1
679 1 39 ARG HD3 1 68 PRO QD 3.270 . 4.740 3.881 2.829 4.832 0.092 20 0 "[ . 1 . 2]" 1
680 1 39 ARG HD3 1 126 GLY QA 3.605 . 5.410 3.669 2.729 5.016 . 0 0 "[ . 1 . 2]" 1
681 1 39 ARG QG 1 40 LEU H 3.230 . 4.660 3.279 2.799 4.012 . 0 0 "[ . 1 . 2]" 1
682 1 39 ARG QG 1 40 LEU HA 3.400 . 5.000 4.014 3.559 5.121 0.121 11 0 "[ . 1 . 2]" 1
683 1 39 ARG QG 1 41 ILE MD 2.645 . 3.490 2.862 2.364 3.927 0.437 3 0 "[ . 1 . 2]" 1
684 1 39 ARG QG 1 64 CYS HA 3.650 . 5.500 4.573 4.258 5.421 . 0 0 "[ . 1 . 2]" 1
685 1 39 ARG QG 1 65 ASP H 3.050 . 4.300 3.736 3.304 4.326 0.026 8 0 "[ . 1 . 2]" 1
686 1 39 ARG QG 1 65 ASP HB3 3.245 . 4.690 4.242 3.207 4.800 0.110 11 0 "[ . 1 . 2]" 1
687 1 39 ARG QG 1 67 ILE HA 3.050 . 4.300 2.117 1.825 2.472 . 0 0 "[ . 1 . 2]" 1
688 1 39 ARG QG 1 67 ILE MD 3.050 . 4.300 3.680 3.039 4.099 . 0 0 "[ . 1 . 2]" 1
689 1 39 ARG QG 1 67 ILE QG 2.460 . 3.120 2.286 1.913 2.719 . 0 0 "[ . 1 . 2]" 1
690 1 39 ARG QG 1 67 ILE MG 2.640 . 3.480 2.596 1.749 3.317 0.051 11 0 "[ . 1 . 2]" 1
691 1 39 ARG QG 1 126 GLY QA 3.035 . 4.270 4.178 2.995 4.562 0.292 16 0 "[ . 1 . 2]" 1
692 1 40 LEU H 1 40 LEU HB2 2.475 . 3.150 2.292 1.980 2.459 . 0 0 "[ . 1 . 2]" 1
693 1 40 LEU H 1 40 LEU HB3 2.720 . 3.640 3.530 3.309 3.625 . 0 0 "[ . 1 . 2]" 1
694 1 40 LEU H 1 40 LEU MD1 2.910 . 4.020 3.385 3.062 3.636 . 0 0 "[ . 1 . 2]" 1
695 1 40 LEU H 1 40 LEU MD2 2.910 . 4.020 2.067 1.766 3.676 0.034 17 0 "[ . 1 . 2]" 1
696 1 40 LEU H 1 40 LEU HG 3.065 . 4.330 3.896 2.429 4.089 . 0 0 "[ . 1 . 2]" 1
697 1 40 LEU HA 1 40 LEU MD1 2.785 . 3.770 2.149 1.975 3.773 0.003 5 0 "[ . 1 . 2]" 1
698 1 40 LEU HA 1 40 LEU QD 2.535 . 3.270 2.044 1.947 2.243 . 0 0 "[ . 1 . 2]" 1
699 1 40 LEU HA 1 40 LEU MD2 2.785 . 3.770 3.056 2.260 3.310 . 0 0 "[ . 1 . 2]" 1
700 1 40 LEU HA 1 40 LEU HG 2.780 . 3.760 3.682 2.795 3.828 0.068 2 0 "[ . 1 . 2]" 1
701 1 40 LEU HA 1 42 GLY H 2.940 . 4.080 3.693 3.477 3.966 . 0 0 "[ . 1 . 2]" 1
702 1 40 LEU HA 1 62 PRO HB2 2.795 . 3.790 2.889 2.387 3.113 . 0 0 "[ . 1 . 2]" 1
703 1 40 LEU HA 1 64 CYS HA 2.730 . 3.660 2.737 2.437 2.956 . 0 0 "[ . 1 . 2]" 1
704 1 40 LEU HB2 1 40 LEU MD1 2.870 . 3.940 3.138 2.188 3.227 . 0 0 "[ . 1 . 2]" 1
705 1 40 LEU HB2 1 40 LEU QD 2.425 . 3.050 2.226 2.087 2.351 . 0 0 "[ . 1 . 2]" 1
706 1 40 LEU HB2 1 40 LEU MD2 2.870 . 3.940 2.320 2.116 3.115 . 0 0 "[ . 1 . 2]" 1
707 1 40 LEU HB2 1 41 ILE H 3.060 . 4.320 4.166 4.099 4.243 . 0 0 "[ . 1 . 2]" 1
708 1 40 LEU HB2 1 42 GLY H 2.995 . 4.190 3.919 3.291 4.422 0.232 5 0 "[ . 1 . 2]" 1
709 1 40 LEU HB2 1 64 CYS HA 3.650 . 5.500 5.523 5.291 5.731 0.231 1 0 "[ . 1 . 2]" 1
710 1 40 LEU HB3 1 40 LEU MD1 2.630 . 3.460 2.467 2.317 2.583 . 0 0 "[ . 1 . 2]" 1
711 1 40 LEU HB3 1 40 LEU MD2 2.630 . 3.460 3.129 2.065 3.238 . 0 0 "[ . 1 . 2]" 1
712 1 40 LEU HB3 1 41 ILE H 2.710 . 3.620 3.296 3.136 3.470 . 0 0 "[ . 1 . 2]" 1
713 1 40 LEU HB3 1 64 CYS HA 3.650 . 5.500 5.163 4.846 5.461 . 0 0 "[ . 1 . 2]" 1
714 1 40 LEU QD 1 41 ILE H 2.945 . 4.090 3.489 3.252 3.699 . 0 0 "[ . 1 . 2]" 1
715 1 40 LEU QD 1 41 ILE HA 3.620 . 5.440 5.200 5.103 5.268 . 0 0 "[ . 1 . 2]" 1
716 1 40 LEU QD 1 42 GLY H 3.235 . 4.670 3.993 3.703 4.313 . 0 0 "[ . 1 . 2]" 1
717 1 40 LEU QD 1 43 SER H 3.490 . 5.180 5.091 3.432 5.421 0.241 15 0 "[ . 1 . 2]" 1
718 1 40 LEU QD 1 44 SER H 3.015 . 4.230 3.963 3.460 4.298 0.068 14 0 "[ . 1 . 2]" 1
719 1 40 LEU QD 1 44 SER HA 2.575 . 3.350 2.888 1.945 3.242 . 0 0 "[ . 1 . 2]" 1
720 1 40 LEU QD 1 44 SER QB 2.455 . 3.110 2.293 1.961 2.708 . 0 0 "[ . 1 . 2]" 1
721 1 40 LEU QD 1 61 THR MG 3.620 . 5.440 3.894 3.343 4.443 . 0 0 "[ . 1 . 2]" 1
722 1 40 LEU QD 1 62 PRO HA 3.485 . 5.170 4.405 4.063 4.910 . 0 0 "[ . 1 . 2]" 1
723 1 40 LEU QD 1 62 PRO HB2 2.830 . 3.860 2.293 1.770 3.077 0.030 10 0 "[ . 1 . 2]" 1
724 1 40 LEU QD 1 62 PRO HG2 2.570 . 3.340 2.149 1.775 2.787 0.025 2 0 "[ . 1 . 2]" 1
725 1 40 LEU QD 1 63 ILE HA 3.125 . 4.450 4.028 3.399 4.502 0.052 2 0 "[ . 1 . 2]" 1
726 1 40 LEU QD 1 64 CYS HA 3.165 . 4.530 2.875 2.522 3.869 . 0 0 "[ . 1 . 2]" 1
727 1 40 LEU QD 1 64 CYS QB 3.540 . 5.280 3.513 2.510 4.552 . 0 0 "[ . 1 . 2]" 1
728 1 40 LEU MD1 1 41 ILE H 3.380 . 4.960 3.654 3.307 5.132 0.172 5 0 "[ . 1 . 2]" 1
729 1 40 LEU MD1 1 44 SER H 3.640 . 5.480 4.817 3.648 5.155 . 0 0 "[ . 1 . 2]" 1
730 1 40 LEU MD1 1 44 SER HA 2.810 . 3.820 3.102 2.104 3.488 . 0 0 "[ . 1 . 2]" 1
731 1 40 LEU MD1 1 44 SER HB2 2.985 . 4.170 4.100 2.906 4.544 0.374 17 0 "[ . 1 . 2]" 1
732 1 40 LEU MD1 1 44 SER HB3 2.985 . 4.170 3.729 2.536 4.315 0.145 8 0 "[ . 1 . 2]" 1
733 1 40 LEU MD1 1 62 PRO HB2 3.295 . 4.790 2.408 1.772 4.215 0.028 10 0 "[ . 1 . 2]" 1
734 1 40 LEU MD1 1 64 CYS HA 3.530 . 5.260 3.015 2.543 5.719 0.459 5 0 "[ . 1 . 2]" 1
735 1 40 LEU MD2 1 41 ILE H 3.380 . 4.960 4.765 3.705 4.989 0.029 8 0 "[ . 1 . 2]" 1
736 1 40 LEU MD2 1 44 SER H 3.640 . 5.480 4.262 3.650 4.665 . 0 0 "[ . 1 . 2]" 1
737 1 40 LEU MD2 1 44 SER HA 2.810 . 3.820 3.549 2.290 3.902 0.082 1 0 "[ . 1 . 2]" 1
738 1 40 LEU MD2 1 44 SER HB2 2.985 . 4.170 3.273 2.040 4.680 0.510 5 1 "[ + 1 . 2]" 1
739 1 40 LEU MD2 1 44 SER HB3 2.985 . 4.170 2.529 2.006 3.708 . 0 0 "[ . 1 . 2]" 1
740 1 40 LEU MD2 1 62 PRO HB2 3.295 . 4.790 4.419 2.092 5.070 0.280 12 0 "[ . 1 . 2]" 1
741 1 40 LEU MD2 1 64 CYS HA 3.530 . 5.260 4.189 3.931 4.420 . 0 0 "[ . 1 . 2]" 1
742 1 40 LEU HG 1 44 SER HA 3.000 . 4.200 2.267 1.902 4.371 0.171 5 0 "[ . 1 . 2]" 1
743 1 40 LEU HG 1 64 CYS HA 3.650 . 5.500 5.701 4.536 6.073 0.573 2 2 "[ + . 1 -. 2]" 1
744 1 41 ILE H 1 41 ILE HB 2.550 . 3.300 2.498 2.358 2.606 . 0 0 "[ . 1 . 2]" 1
745 1 41 ILE H 1 41 ILE MD 2.640 . 3.480 3.273 3.089 3.481 0.001 1 0 "[ . 1 . 2]" 1
746 1 41 ILE H 1 41 ILE HG12 2.710 . 3.620 2.202 2.019 2.403 . 0 0 "[ . 1 . 2]" 1
747 1 41 ILE H 1 41 ILE HG13 3.195 . 4.590 3.649 3.510 3.773 . 0 0 "[ . 1 . 2]" 1
748 1 41 ILE H 1 42 GLY H 3.650 . 5.500 2.604 2.495 2.753 . 0 0 "[ . 1 . 2]" 1
749 1 41 ILE H 1 62 PRO HA 3.075 . 4.350 4.230 3.903 4.543 0.193 19 0 "[ . 1 . 2]" 1
750 1 41 ILE H 1 62 PRO HB2 2.975 . 4.150 2.805 2.347 3.350 . 0 0 "[ . 1 . 2]" 1
751 1 41 ILE H 1 63 ILE H 2.970 . 4.140 3.195 2.727 3.463 . 0 0 "[ . 1 . 2]" 1
752 1 41 ILE H 1 64 CYS HA 3.215 . 4.630 3.717 3.395 4.077 . 0 0 "[ . 1 . 2]" 1
753 1 41 ILE HA 1 41 ILE MD 2.480 . 3.160 2.022 1.829 2.193 . 0 0 "[ . 1 . 2]" 1
754 1 41 ILE HA 1 41 ILE HG12 2.705 . 3.610 2.999 2.800 3.144 . 0 0 "[ . 1 . 2]" 1
755 1 41 ILE HA 1 41 ILE HG13 2.910 . 4.020 3.706 3.582 3.790 . 0 0 "[ . 1 . 2]" 1
756 1 41 ILE HA 1 41 ILE MG 2.295 . 2.790 2.448 2.324 2.553 . 0 0 "[ . 1 . 2]" 1
757 1 41 ILE HA 1 42 GLY H 2.375 . 2.950 3.356 3.051 3.471 0.521 11 3 "[* . 1+ -. 2]" 1
758 1 41 ILE HB 1 42 GLY H 3.160 . 4.520 3.138 2.754 3.923 . 0 0 "[ . 1 . 2]" 1
759 1 41 ILE HB 1 63 ILE H 2.630 . 3.460 2.843 2.526 3.243 . 0 0 "[ . 1 . 2]" 1
760 1 41 ILE HB 1 63 ILE HB 2.885 . 3.970 3.858 3.505 4.140 0.170 12 0 "[ . 1 . 2]" 1
761 1 41 ILE HB 1 65 ASP HB2 3.650 . 5.500 5.150 4.448 5.560 0.060 3 0 "[ . 1 . 2]" 1
762 1 41 ILE HB 1 65 ASP HB3 3.650 . 5.500 5.250 4.748 5.679 0.179 3 0 "[ . 1 . 2]" 1
763 1 41 ILE MD 1 42 GLY H 3.445 . 5.090 4.633 4.442 4.747 . 0 0 "[ . 1 . 2]" 1
764 1 41 ILE MD 1 64 CYS HA 3.630 . 5.460 4.756 4.370 5.218 . 0 0 "[ . 1 . 2]" 1
765 1 41 ILE MD 1 65 ASP H 2.955 . 4.110 3.600 3.232 4.121 0.011 2 0 "[ . 1 . 2]" 1
766 1 41 ILE MD 1 65 ASP HA 3.445 . 5.090 4.671 4.318 5.074 . 0 0 "[ . 1 . 2]" 1
767 1 41 ILE MD 1 65 ASP HB2 2.820 . 3.840 3.117 2.335 3.603 . 0 0 "[ . 1 . 2]" 1
768 1 41 ILE MD 1 65 ASP HB3 2.640 . 3.480 2.037 1.834 2.439 . 0 0 "[ . 1 . 2]" 1
769 1 41 ILE HG12 1 41 ILE MG 2.580 . 3.360 3.204 3.181 3.229 . 0 0 "[ . 1 . 2]" 1
770 1 41 ILE HG12 1 42 GLY H 3.285 . 4.770 4.414 4.173 4.645 . 0 0 "[ . 1 . 2]" 1
771 1 41 ILE HG12 1 63 ILE H 2.965 . 4.130 3.822 3.131 4.193 0.063 16 0 "[ . 1 . 2]" 1
772 1 41 ILE HG12 1 65 ASP HB3 3.540 . 5.280 3.009 2.491 3.449 . 0 0 "[ . 1 . 2]" 1
773 1 41 ILE HG13 1 64 CYS HA 3.650 . 5.500 5.488 5.157 5.767 0.267 9 0 "[ . 1 . 2]" 1
774 1 41 ILE HG13 1 65 ASP H 3.300 . 4.800 4.581 3.520 5.109 0.309 3 0 "[ . 1 . 2]" 1
775 1 41 ILE HG13 1 65 ASP HB2 3.230 . 4.660 3.180 2.586 3.478 . 0 0 "[ . 1 . 2]" 1
776 1 41 ILE HG13 1 65 ASP HB3 3.395 . 4.990 3.228 2.557 3.910 . 0 0 "[ . 1 . 2]" 1
777 1 41 ILE MG 1 42 GLY H 3.235 . 4.670 3.716 3.320 4.198 . 0 0 "[ . 1 . 2]" 1
778 1 41 ILE MG 1 42 GLY QA 3.050 . 4.300 3.419 2.963 3.904 . 0 0 "[ . 1 . 2]" 1
779 1 42 GLY H 1 43 SER H 2.720 . 3.640 3.507 1.990 3.836 0.196 7 0 "[ . 1 . 2]" 1
780 1 42 GLY H 1 43 SER HA 3.190 . 4.580 4.754 4.528 4.930 0.350 17 0 "[ . 1 . 2]" 1
781 1 42 GLY H 1 44 SER H 3.435 . 5.070 5.475 5.261 6.017 0.947 5 2 "[ + 1 -. 2]" 1
782 1 42 GLY H 1 62 PRO HA 3.335 . 4.870 3.455 2.837 4.221 . 0 0 "[ . 1 . 2]" 1
783 1 42 GLY H 1 62 PRO HG3 2.850 . 3.900 3.323 2.709 3.955 0.055 11 0 "[ . 1 . 2]" 1
784 1 42 GLY QA 1 43 SER H 2.300 . 2.800 2.118 2.041 2.548 . 0 0 "[ . 1 . 2]" 1
785 1 42 GLY QA 1 62 PRO HA 2.530 . 3.260 3.422 3.170 3.634 0.374 5 0 "[ . 1 . 2]" 1
786 1 42 GLY QA 1 62 PRO HB2 3.150 . 4.500 3.898 3.376 4.712 0.212 1 0 "[ . 1 . 2]" 1
787 1 42 GLY QA 1 62 PRO HB3 3.330 . 4.860 2.389 1.988 3.156 . 0 0 "[ . 1 . 2]" 1
788 1 42 GLY QA 1 63 ILE H 3.245 . 4.690 4.744 4.509 5.013 0.323 3 0 "[ . 1 . 2]" 1
789 1 43 SER H 1 43 SER HB2 2.410 . 3.020 2.718 2.318 3.239 0.219 5 0 "[ . 1 . 2]" 1
790 1 43 SER H 1 59 THR MG 2.890 . 3.980 2.508 1.707 3.811 0.093 14 0 "[ . 1 . 2]" 1
791 1 43 SER H 1 62 PRO HB2 2.955 . 4.110 4.297 3.245 4.610 0.500 9 0 "[ . 1 . 2]" 1
792 1 43 SER H 1 62 PRO HB3 2.925 . 4.050 2.872 2.240 3.567 . 0 0 "[ . 1 . 2]" 1
793 1 43 SER HA 1 44 SER H 2.235 . 2.670 2.152 2.066 2.413 . 0 0 "[ . 1 . 2]" 1
794 1 43 SER HA 1 45 SER H 2.770 . 3.740 3.783 3.528 3.949 0.209 10 0 "[ . 1 . 2]" 1
795 1 43 SER HA 1 59 THR MG 3.145 . 4.490 4.137 3.716 4.573 0.083 5 0 "[ . 1 . 2]" 1
796 1 43 SER HB2 1 46 ALA HA 3.545 . 5.290 4.629 3.341 5.446 0.156 15 0 "[ . 1 . 2]" 1
797 1 43 SER HB2 1 46 ALA MB 3.550 . 5.300 4.945 4.054 5.648 0.348 8 0 "[ . 1 . 2]" 1
798 1 43 SER HB2 1 59 THR HB 3.120 . 4.440 4.106 2.854 4.923 0.483 2 0 "[ . 1 . 2]" 1
799 1 43 SER HB2 1 59 THR MG 2.540 . 3.280 2.372 1.736 3.385 0.105 4 0 "[ . 1 . 2]" 1
800 1 43 SER HB3 1 45 SER H 2.645 . 3.490 3.313 2.636 3.834 0.344 8 0 "[ . 1 . 2]" 1
801 1 43 SER HB3 1 46 ALA H 3.650 . 5.500 5.360 4.833 5.623 0.123 10 0 "[ . 1 . 2]" 1
802 1 43 SER HB3 1 46 ALA MB 3.355 . 4.910 4.443 3.637 5.047 0.137 19 0 "[ . 1 . 2]" 1
803 1 43 SER HB3 1 59 THR HB 3.095 . 4.390 4.109 3.284 4.884 0.494 6 0 "[ . 1 . 2]" 1
804 1 43 SER HB3 1 59 THR MG 2.535 . 3.270 2.651 1.804 3.654 0.384 18 0 "[ . 1 . 2]" 1
805 1 44 SER H 1 45 SER H 2.440 . 3.080 2.641 2.124 2.779 . 0 0 "[ . 1 . 2]" 1
806 1 44 SER HA 1 44 SER HB2 2.245 . 2.690 2.572 2.403 2.976 0.286 5 0 "[ . 1 . 2]" 1
807 1 44 SER HA 1 44 SER HB3 2.245 . 2.690 2.455 2.287 3.020 0.330 8 0 "[ . 1 . 2]" 1
808 1 44 SER HA 1 45 SER HA 3.245 . 4.690 4.449 4.300 4.585 . 0 0 "[ . 1 . 2]" 1
809 1 44 SER HA 1 61 THR MG 3.040 . 4.280 4.590 4.211 5.007 0.727 1 3 "[+ * 1 - 2]" 1
810 1 44 SER HA 1 62 PRO HG2 3.175 . 4.550 2.697 2.079 3.262 . 0 0 "[ . 1 . 2]" 1
811 1 44 SER QB 1 45 SER H 2.970 . 4.140 3.398 2.513 3.708 . 0 0 "[ . 1 . 2]" 1
812 1 45 SER H 1 45 SER QB 2.515 . 3.230 2.759 2.462 3.240 0.010 5 0 "[ . 1 . 2]" 1
813 1 45 SER H 1 46 ALA H 3.230 . 4.660 4.286 4.001 4.504 . 0 0 "[ . 1 . 2]" 1
814 1 45 SER H 1 46 ALA HA 3.455 . 5.110 4.801 4.516 5.237 0.127 6 0 "[ . 1 . 2]" 1
815 1 45 SER HA 1 46 ALA H 2.285 . 2.770 2.189 2.026 2.372 . 0 0 "[ . 1 . 2]" 1
816 1 45 SER HA 1 46 ALA MB 3.360 . 4.920 3.955 3.788 4.122 . 0 0 "[ . 1 . 2]" 1
817 1 45 SER HA 1 61 THR MG 3.650 . 5.500 5.350 3.945 6.006 0.506 8 1 "[ . + 1 . 2]" 1
818 1 45 SER QB 1 46 ALA H 2.760 . 3.720 3.063 2.463 3.630 . 0 0 "[ . 1 . 2]" 1
819 1 45 SER QB 1 46 ALA MB 3.570 . 5.340 4.585 4.374 4.795 . 0 0 "[ . 1 . 2]" 1
820 1 45 SER QB 1 47 THR H 3.570 . 5.340 5.399 4.917 5.614 0.274 4 0 "[ . 1 . 2]" 1
821 1 46 ALA H 1 46 ALA MB 2.630 . 3.460 2.424 2.262 2.627 . 0 0 "[ . 1 . 2]" 1
822 1 46 ALA H 1 47 THR H 3.215 . 4.630 4.409 4.244 4.562 . 0 0 "[ . 1 . 2]" 1
823 1 46 ALA H 1 47 THR HA 3.475 . 5.150 4.914 4.603 5.297 0.147 13 0 "[ . 1 . 2]" 1
824 1 46 ALA HA 1 47 THR H 2.285 . 2.770 2.146 2.061 2.210 . 0 0 "[ . 1 . 2]" 1
825 1 46 ALA HA 1 47 THR HA 3.470 . 5.140 4.303 4.257 4.368 . 0 0 "[ . 1 . 2]" 1
826 1 46 ALA HA 1 47 THR HB 3.650 . 5.500 4.541 4.384 4.764 . 0 0 "[ . 1 . 2]" 1
827 1 46 ALA HA 1 47 THR MG 3.650 . 5.500 5.368 5.314 5.468 . 0 0 "[ . 1 . 2]" 1
828 1 46 ALA HA 1 48 CYS H 3.650 . 5.500 5.710 3.948 5.897 0.397 6 0 "[ . 1 . 2]" 1
829 1 46 ALA HA 1 59 THR HB 3.295 . 4.790 3.512 2.370 4.958 0.168 3 0 "[ . 1 . 2]" 1
830 1 46 ALA HA 1 59 THR MG 3.080 . 4.360 3.640 2.465 4.450 0.090 11 0 "[ . 1 . 2]" 1
831 1 46 ALA MB 1 47 THR H 2.655 . 3.510 2.725 2.605 3.088 . 0 0 "[ . 1 . 2]" 1
832 1 46 ALA MB 1 47 THR HA 3.420 . 5.040 4.042 3.926 4.498 . 0 0 "[ . 1 . 2]" 1
833 1 46 ALA MB 1 47 THR HB 3.650 . 5.500 4.873 4.750 5.011 . 0 0 "[ . 1 . 2]" 1
834 1 46 ALA MB 1 48 CYS H 3.085 . 4.370 4.530 3.021 4.750 0.380 6 0 "[ . 1 . 2]" 1
835 1 46 ALA MB 1 57 TRP HA 3.100 . 4.400 3.842 3.363 4.222 . 0 0 "[ . 1 . 2]" 1
836 1 46 ALA MB 1 57 TRP HB2 3.240 . 4.680 4.119 3.343 4.553 . 0 0 "[ . 1 . 2]" 1
837 1 46 ALA MB 1 57 TRP HB3 2.945 . 4.090 2.678 1.972 3.098 . 0 0 "[ . 1 . 2]" 1
838 1 46 ALA MB 1 57 TRP HD1 3.650 . 5.500 5.436 5.024 5.653 0.153 7 0 "[ . 1 . 2]" 1
839 1 46 ALA MB 1 57 TRP HE3 2.690 . 3.580 2.331 1.990 2.643 . 0 0 "[ . 1 . 2]" 1
840 1 46 ALA MB 1 57 TRP HZ3 3.075 . 4.350 3.338 2.784 3.877 . 0 0 "[ . 1 . 2]" 1
841 1 46 ALA MB 1 58 ASP H 2.810 . 3.820 3.645 3.189 4.121 0.301 13 0 "[ . 1 . 2]" 1
842 1 46 ALA MB 1 58 ASP QB 3.530 . 5.260 4.368 3.277 5.170 . 0 0 "[ . 1 . 2]" 1
843 1 46 ALA MB 1 59 THR H 2.725 . 3.650 2.841 2.310 3.194 . 0 0 "[ . 1 . 2]" 1
844 1 46 ALA MB 1 59 THR HA 3.190 . 4.580 4.549 4.239 4.943 0.363 19 0 "[ . 1 . 2]" 1
845 1 46 ALA MB 1 59 THR HB 2.935 . 4.070 2.594 1.853 3.941 . 0 0 "[ . 1 . 2]" 1
846 1 46 ALA MB 1 59 THR MG 2.640 . 3.480 3.229 2.638 3.794 0.314 16 0 "[ . 1 . 2]" 1
847 1 46 ALA MB 1 61 THR HB 3.650 . 5.500 5.071 4.458 5.676 0.176 8 0 "[ . 1 . 2]" 1
848 1 46 ALA MB 1 61 THR MG 3.015 . 4.230 3.890 3.020 4.308 0.078 1 0 "[ . 1 . 2]" 1
849 1 47 THR H 1 47 THR HB 2.580 . 3.360 2.600 2.482 2.699 . 0 0 "[ . 1 . 2]" 1
850 1 47 THR H 1 47 THR MG 3.105 . 4.410 3.821 3.745 3.888 . 0 0 "[ . 1 . 2]" 1
851 1 47 THR H 1 48 CYS H 3.250 . 4.700 4.150 2.600 4.364 . 0 0 "[ . 1 . 2]" 1
852 1 47 THR H 1 57 TRP HE3 3.355 . 4.910 4.032 3.470 4.604 . 0 0 "[ . 1 . 2]" 1
853 1 47 THR H 1 59 THR H 3.650 . 5.500 3.719 2.809 4.980 . 0 0 "[ . 1 . 2]" 1
854 1 47 THR H 1 59 THR MG 3.650 . 5.500 4.714 2.870 5.722 0.222 15 0 "[ . 1 . 2]" 1
855 1 47 THR HA 1 47 THR MG 2.710 . 3.620 2.375 2.304 2.454 . 0 0 "[ . 1 . 2]" 1
856 1 47 THR HA 1 48 CYS H 2.350 . 2.900 2.150 2.005 3.345 0.445 15 0 "[ . 1 . 2]" 1
857 1 47 THR HA 1 57 TRP HE3 3.645 . 5.490 4.138 3.447 5.405 . 0 0 "[ . 1 . 2]" 1
858 1 47 THR HA 1 57 TRP HZ3 3.250 . 4.700 3.854 3.228 4.368 . 0 0 "[ . 1 . 2]" 1
859 1 47 THR HB 1 48 CYS H 3.170 . 4.540 4.059 2.713 4.200 . 0 0 "[ . 1 . 2]" 1
860 1 47 THR HB 1 49 ILE MG 2.505 . 3.210 3.340 3.156 3.597 0.387 5 0 "[ . 1 . 2]" 1
861 1 47 THR MG 1 48 CYS H 2.595 . 3.390 2.759 2.566 3.455 0.065 15 0 "[ . 1 . 2]" 1
862 1 47 THR MG 1 48 CYS HA 3.305 . 4.810 4.145 3.987 4.575 . 0 0 "[ . 1 . 2]" 1
863 1 47 THR MG 1 49 ILE HA 3.170 . 4.540 4.234 4.045 4.502 . 0 0 "[ . 1 . 2]" 1
864 1 47 THR MG 1 58 ASP QB 3.470 . 5.140 4.445 3.250 5.184 0.044 15 0 "[ . 1 . 2]" 1
865 1 48 CYS H 1 49 ILE MG 3.465 . 5.130 4.399 3.446 4.700 . 0 0 "[ . 1 . 2]" 1
866 1 48 CYS H 1 57 TRP HA 3.455 . 5.110 4.631 4.096 5.204 0.094 14 0 "[ . 1 . 2]" 1
867 1 48 CYS H 1 57 TRP HE3 3.115 . 4.430 3.624 2.956 4.193 . 0 0 "[ . 1 . 2]" 1
868 1 48 CYS H 1 57 TRP HZ3 2.650 . 3.500 3.383 2.805 3.756 0.256 14 0 "[ . 1 . 2]" 1
869 1 48 CYS HA 1 49 ILE H 2.380 . 2.960 2.158 2.081 2.252 . 0 0 "[ . 1 . 2]" 1
870 1 48 CYS HA 1 49 ILE MG 2.960 . 4.120 3.700 3.439 3.865 . 0 0 "[ . 1 . 2]" 1
871 1 48 CYS HA 1 57 TRP HA 2.670 . 3.540 2.385 2.030 2.775 . 0 0 "[ . 1 . 2]" 1
872 1 48 CYS HA 1 57 TRP HB3 3.335 . 4.870 4.534 4.100 4.890 0.020 19 0 "[ . 1 . 2]" 1
873 1 48 CYS HA 1 57 TRP HE3 3.020 . 4.240 3.258 2.748 3.714 . 0 0 "[ . 1 . 2]" 1
874 1 48 CYS HA 1 57 TRP HZ3 3.320 . 4.840 4.428 3.777 4.912 0.072 12 0 "[ . 1 . 2]" 1
875 1 48 CYS HA 1 58 ASP H 2.810 . 3.820 3.242 2.788 3.597 . 0 0 "[ . 1 . 2]" 1
876 1 48 CYS HA 1 58 ASP QB 3.205 . 4.610 4.548 3.973 4.943 0.333 17 0 "[ . 1 . 2]" 1
877 1 49 ILE H 1 49 ILE HG12 2.695 . 3.590 3.215 2.618 3.723 0.133 7 0 "[ . 1 . 2]" 1
878 1 49 ILE H 1 49 ILE HG13 2.695 . 3.590 2.343 2.090 2.880 . 0 0 "[ . 1 . 2]" 1
879 1 49 ILE H 1 49 ILE MG 2.595 . 3.390 2.914 2.817 3.077 . 0 0 "[ . 1 . 2]" 1
880 1 49 ILE H 1 55 VAL MG1 3.650 . 5.500 4.254 2.707 5.522 0.022 16 0 "[ . 1 . 2]" 1
881 1 49 ILE H 1 55 VAL MG2 3.650 . 5.500 4.144 3.106 5.450 . 0 0 "[ . 1 . 2]" 1
882 1 49 ILE H 1 56 ILE H 3.025 . 4.250 3.477 3.052 4.021 . 0 0 "[ . 1 . 2]" 1
883 1 49 ILE H 1 57 TRP HA 2.645 . 3.490 3.283 2.926 3.543 0.053 12 0 "[ . 1 . 2]" 1
884 1 49 ILE H 1 58 ASP H 3.065 . 4.330 3.556 3.200 3.802 . 0 0 "[ . 1 . 2]" 1
885 1 49 ILE HA 1 49 ILE MD 2.900 . 4.000 3.883 3.685 4.069 0.069 4 0 "[ . 1 . 2]" 1
886 1 49 ILE HA 1 49 ILE QG 2.685 . 3.570 3.336 3.277 3.425 . 0 0 "[ . 1 . 2]" 1
887 1 49 ILE HA 1 49 ILE MG 2.470 . 3.140 2.387 2.271 2.455 . 0 0 "[ . 1 . 2]" 1
888 1 49 ILE HA 1 50 ILE H 2.560 . 3.320 2.451 2.367 2.553 . 0 0 "[ . 1 . 2]" 1
889 1 49 ILE HA 1 50 ILE QG 2.915 . 4.030 3.449 3.271 3.682 . 0 0 "[ . 1 . 2]" 1
890 1 49 ILE HB 1 49 ILE MD 2.615 . 3.430 2.209 2.135 2.287 . 0 0 "[ . 1 . 2]" 1
891 1 49 ILE HB 1 50 ILE H 2.365 . 2.930 2.300 2.014 2.480 . 0 0 "[ . 1 . 2]" 1
892 1 49 ILE MD 1 50 ILE H 2.525 . 3.250 3.116 2.840 3.507 0.257 5 0 "[ . 1 . 2]" 1
893 1 49 ILE MD 1 50 ILE HB 3.105 . 4.410 4.621 4.291 4.935 0.525 10 1 "[ . + . 2]" 1
894 1 49 ILE MD 1 51 SER HA 2.835 . 3.870 3.381 2.638 4.020 0.150 8 0 "[ . 1 . 2]" 1
895 1 49 ILE MD 1 51 SER HB2 3.220 . 4.640 3.847 2.770 4.731 0.091 19 0 "[ . 1 . 2]" 1
896 1 49 ILE MD 1 51 SER QB 2.810 . 3.820 3.247 2.300 3.969 0.149 15 0 "[ . 1 . 2]" 1
897 1 49 ILE MD 1 51 SER HB3 3.220 . 4.640 3.956 2.321 5.053 0.413 4 0 "[ . 1 . 2]" 1
898 1 49 ILE MD 1 57 TRP HA 3.650 . 5.500 5.439 5.040 5.722 0.222 10 0 "[ . 1 . 2]" 1
899 1 49 ILE MD 1 58 ASP HA 2.980 . 4.160 3.473 2.872 4.230 0.070 7 0 "[ . 1 . 2]" 1
900 1 49 ILE MD 1 58 ASP QB 2.875 . 3.950 3.477 2.502 4.293 0.343 16 0 "[ . 1 . 2]" 1
901 1 49 ILE QG 1 50 ILE H 2.780 . 3.760 3.684 3.228 3.974 0.214 13 0 "[ . 1 . 2]" 1
902 1 49 ILE QG 1 51 SER H 3.570 . 5.340 4.504 3.495 5.283 . 0 0 "[ . 1 . 2]" 1
903 1 49 ILE QG 1 58 ASP H 3.350 . 4.900 3.212 2.883 3.641 . 0 0 "[ . 1 . 2]" 1
904 1 49 ILE QG 1 58 ASP HA 2.955 . 4.110 2.905 2.078 3.519 . 0 0 "[ . 1 . 2]" 1
905 1 49 ILE HG12 1 50 ILE H 3.180 . 4.560 4.686 4.474 4.794 0.234 15 0 "[ . 1 . 2]" 1
906 1 49 ILE HG12 1 58 ASP QB 3.185 . 4.570 2.336 1.778 3.467 0.022 18 0 "[ . 1 . 2]" 1
907 1 49 ILE HG13 1 50 ILE H 3.180 . 4.560 3.866 3.311 4.290 . 0 0 "[ . 1 . 2]" 1
908 1 49 ILE HG13 1 58 ASP QB 3.185 . 4.570 3.598 2.095 4.828 0.258 16 0 "[ . 1 . 2]" 1
909 1 49 ILE MG 1 57 TRP HA 3.440 . 5.080 4.640 4.320 4.915 . 0 0 "[ . 1 . 2]" 1
910 1 49 ILE MG 1 58 ASP H 2.930 . 4.060 3.487 3.006 3.830 . 0 0 "[ . 1 . 2]" 1
911 1 49 ILE MG 1 58 ASP HA 3.195 . 4.590 4.138 3.315 4.960 0.370 2 0 "[ . 1 . 2]" 1
912 1 49 ILE MG 1 58 ASP QB 2.740 . 3.680 2.414 1.730 3.684 0.070 6 0 "[ . 1 . 2]" 1
913 1 49 ILE MG 1 59 THR H 3.650 . 5.500 5.216 4.678 5.852 0.352 1 0 "[ . 1 . 2]" 1
914 1 50 ILE H 1 50 ILE HB 2.450 . 3.100 2.531 2.436 2.591 . 0 0 "[ . 1 . 2]" 1
915 1 50 ILE H 1 50 ILE MD 3.130 . 4.460 3.764 3.468 4.040 . 0 0 "[ . 1 . 2]" 1
916 1 50 ILE H 1 50 ILE QG 2.665 . 3.530 2.592 2.263 2.879 . 0 0 "[ . 1 . 2]" 1
917 1 50 ILE H 1 50 ILE MG 3.130 . 4.460 3.807 3.759 3.856 . 0 0 "[ . 1 . 2]" 1
918 1 50 ILE HA 1 50 ILE MD 2.750 . 3.700 3.209 1.998 3.866 0.166 2 0 "[ . 1 . 2]" 1
919 1 50 ILE HA 1 50 ILE HG12 2.730 . 3.660 2.737 2.426 3.170 . 0 0 "[ . 1 . 2]" 1
920 1 50 ILE HA 1 50 ILE QG 2.500 . 3.200 2.594 2.352 3.010 . 0 0 "[ . 1 . 2]" 1
921 1 50 ILE HA 1 50 ILE HG13 2.730 . 3.660 3.237 2.844 3.846 0.186 12 0 "[ . 1 . 2]" 1
922 1 50 ILE HA 1 50 ILE MG 2.340 . 2.880 2.410 2.252 2.543 . 0 0 "[ . 1 . 2]" 1
923 1 50 ILE HA 1 51 SER H 2.305 . 2.810 2.151 2.057 2.254 . 0 0 "[ . 1 . 2]" 1
924 1 50 ILE HA 1 55 VAL H 3.425 . 5.050 4.690 4.502 4.970 . 0 0 "[ . 1 . 2]" 1
925 1 50 ILE HA 1 55 VAL HA 2.600 . 3.400 2.172 1.815 2.534 . 0 0 "[ . 1 . 2]" 1
926 1 50 ILE HA 1 55 VAL QG 2.630 . 3.460 2.803 2.137 3.376 . 0 0 "[ . 1 . 2]" 1
927 1 50 ILE HA 1 56 ILE H 2.840 . 3.880 3.141 2.733 3.904 0.024 12 0 "[ . 1 . 2]" 1
928 1 50 ILE HB 1 50 ILE MD 2.550 . 3.300 2.696 2.336 3.246 . 0 0 "[ . 1 . 2]" 1
929 1 50 ILE HB 1 51 SER H 3.075 . 4.350 4.246 4.142 4.374 0.024 2 0 "[ . 1 . 2]" 1
930 1 50 ILE HB 1 55 VAL HA 3.650 . 5.500 4.951 4.517 5.455 . 0 0 "[ . 1 . 2]" 1
931 1 50 ILE HB 1 55 VAL QG 3.220 . 4.640 4.242 3.808 4.815 0.175 16 0 "[ . 1 . 2]" 1
932 1 50 ILE MD 1 50 ILE MG 2.235 . 2.670 1.984 1.826 2.090 . 0 0 "[ . 1 . 2]" 1
933 1 50 ILE MD 1 51 SER H 3.650 . 5.500 4.728 3.750 5.400 . 0 0 "[ . 1 . 2]" 1
934 1 50 ILE MD 1 54 THR HA 3.650 . 5.500 4.961 3.775 5.944 0.444 13 0 "[ . 1 . 2]" 1
935 1 50 ILE MD 1 55 VAL HA 3.390 . 4.980 3.783 2.259 4.948 . 0 0 "[ . 1 . 2]" 1
936 1 50 ILE MD 1 55 VAL HB 3.275 . 4.750 3.847 1.867 5.160 0.410 19 0 "[ . 1 . 2]" 1
937 1 50 ILE MD 1 55 VAL QG 2.380 . 2.960 2.415 1.615 3.139 0.185 20 0 "[ . 1 . 2]" 1
938 1 50 ILE QG 1 51 SER H 3.570 . 5.340 4.355 3.978 4.800 . 0 0 "[ . 1 . 2]" 1
939 1 50 ILE QG 1 55 VAL HA 3.185 . 4.570 3.379 2.246 4.858 0.288 12 0 "[ . 1 . 2]" 1
940 1 50 ILE QG 1 55 VAL QG 2.615 . 3.430 2.289 1.598 3.291 0.202 15 0 "[ . 1 . 2]" 1
941 1 50 ILE MG 1 51 SER H 2.535 . 3.270 2.862 2.627 3.043 . 0 0 "[ . 1 . 2]" 1
942 1 50 ILE MG 1 51 SER HA 3.240 . 4.680 3.761 3.222 4.150 . 0 0 "[ . 1 . 2]" 1
943 1 50 ILE MG 1 54 THR H 2.935 . 4.070 3.243 2.357 4.467 0.397 12 0 "[ . 1 . 2]" 1
944 1 50 ILE MG 1 55 VAL H 3.115 . 4.430 4.400 3.999 4.884 0.454 13 0 "[ . 1 . 2]" 1
945 1 50 ILE MG 1 55 VAL HA 2.830 . 3.860 3.418 2.957 3.969 0.109 20 0 "[ . 1 . 2]" 1
946 1 50 ILE MG 1 55 VAL QG 2.750 . 3.700 3.330 2.505 3.941 0.241 16 0 "[ . 1 . 2]" 1
947 1 51 SER H 1 51 SER HB2 2.680 . 3.560 3.134 2.399 3.847 0.287 14 0 "[ . 1 . 2]" 1
948 1 51 SER H 1 51 SER QB 2.455 . 3.110 2.499 2.202 3.113 0.003 11 0 "[ . 1 . 2]" 1
949 1 51 SER H 1 51 SER HB3 2.680 . 3.560 2.735 2.314 3.603 0.043 15 0 "[ . 1 . 2]" 1
950 1 51 SER H 1 54 THR H 2.760 . 3.720 3.656 2.919 3.919 0.199 17 0 "[ . 1 . 2]" 1
951 1 51 SER H 1 54 THR MG 3.160 . 4.520 3.821 3.167 4.651 0.131 5 0 "[ . 1 . 2]" 1
952 1 51 SER H 1 55 VAL HA 2.720 . 3.640 3.108 2.543 3.803 0.163 10 0 "[ . 1 . 2]" 1
953 1 51 SER H 1 55 VAL QG 3.320 . 4.840 4.212 3.404 4.731 . 0 0 "[ . 1 . 2]" 1
954 1 51 SER H 1 56 ILE H 3.030 . 4.260 3.439 2.845 3.958 . 0 0 "[ . 1 . 2]" 1
955 1 51 SER H 1 56 ILE MD 2.715 . 3.630 3.470 2.225 3.875 0.245 13 0 "[ . 1 . 2]" 1
956 1 51 SER H 1 56 ILE QG 3.385 . 4.970 3.145 2.291 4.962 . 0 0 "[ . 1 . 2]" 1
957 1 51 SER HA 1 54 THR H 3.525 . 5.250 5.252 4.390 5.812 0.562 17 1 "[ . 1 . + 2]" 1
958 1 51 SER HA 1 56 ILE MD 3.210 . 4.620 3.985 2.629 4.959 0.339 11 0 "[ . 1 . 2]" 1
959 1 51 SER QB 1 54 THR MG 3.325 . 4.850 3.709 2.342 5.042 0.192 14 0 "[ . 1 . 2]" 1
960 1 51 SER QB 1 56 ILE MD 2.505 . 3.210 2.330 1.773 3.432 0.222 7 0 "[ . 1 . 2]" 1
961 1 51 SER QB 1 56 ILE QG 3.215 . 4.630 2.858 1.796 4.759 0.129 15 0 "[ . 1 . 2]" 1
962 1 51 SER HB2 1 56 ILE MD 2.830 . 3.860 2.798 1.858 3.956 0.096 9 0 "[ . 1 . 2]" 1
963 1 51 SER HB3 1 56 ILE MD 2.830 . 3.860 2.886 1.813 3.973 0.113 7 0 "[ . 1 . 2]" 1
964 1 52 GLY QA 1 54 THR H 3.090 . 4.380 3.709 3.229 4.355 . 0 0 "[ . 1 . 2]" 1
965 1 53 ASP H 1 53 ASP QB 2.985 . 4.170 2.514 2.276 3.323 . 0 0 "[ . 1 . 2]" 1
966 1 53 ASP H 1 54 THR H 3.150 . 4.500 2.635 2.350 2.854 . 0 0 "[ . 1 . 2]" 1
967 1 53 ASP QB 1 54 THR H 2.845 . 3.890 3.494 2.505 3.996 0.106 15 0 "[ . 1 . 2]" 1
968 1 54 THR H 1 54 THR HB 2.755 . 3.710 3.171 2.508 3.482 . 0 0 "[ . 1 . 2]" 1
969 1 54 THR H 1 54 THR MG 2.505 . 3.210 2.697 2.325 3.778 0.568 5 2 "[ + 1 . -]" 1
970 1 54 THR H 1 56 ILE H 3.650 . 5.500 5.821 5.570 6.017 0.517 15 1 "[ . 1 + 2]" 1
971 1 54 THR HA 1 54 THR MG 2.635 . 3.470 3.104 2.337 3.233 . 0 0 "[ . 1 . 2]" 1
972 1 54 THR HB 1 55 VAL H 2.800 . 3.800 3.819 3.529 4.108 0.308 5 0 "[ . 1 . 2]" 1
973 1 54 THR HB 1 56 ILE MG 3.270 . 4.740 4.537 3.321 4.903 0.163 7 0 "[ . 1 . 2]" 1
974 1 54 THR MG 1 55 VAL H 2.635 . 3.470 2.894 1.833 3.444 . 0 0 "[ . 1 . 2]" 1
975 1 54 THR MG 1 55 VAL HB 3.560 . 5.320 4.758 4.137 5.195 . 0 0 "[ . 1 . 2]" 1
976 1 54 THR MG 1 55 VAL QG 3.265 . 4.730 3.960 2.869 4.355 . 0 0 "[ . 1 . 2]" 1
977 1 54 THR MG 1 56 ILE H 3.245 . 4.690 3.976 3.578 4.255 . 0 0 "[ . 1 . 2]" 1
978 1 54 THR MG 1 56 ILE HA 3.310 . 4.820 4.360 3.781 4.925 0.105 15 0 "[ . 1 . 2]" 1
979 1 54 THR MG 1 56 ILE HB 3.650 . 5.500 4.690 4.363 5.105 . 0 0 "[ . 1 . 2]" 1
980 1 54 THR MG 1 56 ILE MG 2.285 . 2.770 2.106 1.837 2.413 . 0 0 "[ . 1 . 2]" 1
981 1 55 VAL H 1 55 VAL HB 2.725 . 3.650 2.588 2.287 2.942 . 0 0 "[ . 1 . 2]" 1
982 1 55 VAL H 1 55 VAL MG1 3.390 . 4.980 2.956 1.950 3.813 . 0 0 "[ . 1 . 2]" 1
983 1 55 VAL H 1 55 VAL QG 2.705 . 3.610 2.354 1.943 2.961 . 0 0 "[ . 1 . 2]" 1
984 1 55 VAL H 1 55 VAL MG2 3.390 . 4.980 3.196 1.949 3.890 . 0 0 "[ . 1 . 2]" 1
985 1 55 VAL H 1 56 ILE H 3.545 . 5.290 4.306 4.223 4.414 . 0 0 "[ . 1 . 2]" 1
986 1 55 VAL H 1 56 ILE MG 3.270 . 4.740 4.015 3.748 4.423 . 0 0 "[ . 1 . 2]" 1
987 1 55 VAL HA 1 55 VAL MG1 2.930 . 4.060 2.828 2.359 3.234 . 0 0 "[ . 1 . 2]" 1
988 1 55 VAL HA 1 55 VAL MG2 2.930 . 4.060 2.330 2.049 2.484 . 0 0 "[ . 1 . 2]" 1
989 1 55 VAL HA 1 56 ILE H 2.270 . 2.740 2.061 1.985 2.165 . 0 0 "[ . 1 . 2]" 1
990 1 55 VAL HA 1 56 ILE HA 3.345 . 4.890 4.387 4.334 4.484 . 0 0 "[ . 1 . 2]" 1
991 1 55 VAL HA 1 56 ILE MD 3.225 . 4.650 4.443 2.941 5.146 0.496 2 0 "[ . 1 . 2]" 1
992 1 55 VAL HA 1 56 ILE MG 3.015 . 4.230 3.875 3.458 4.248 0.018 9 0 "[ . 1 . 2]" 1
993 1 55 VAL HB 1 56 ILE H 3.455 . 5.110 4.252 3.997 4.348 . 0 0 "[ . 1 . 2]" 1
994 1 55 VAL QG 1 56 ILE H 2.885 . 3.970 2.733 2.515 2.911 . 0 0 "[ . 1 . 2]" 1
995 1 55 VAL QG 1 56 ILE HA 3.505 . 5.210 3.461 3.216 3.626 . 0 0 "[ . 1 . 2]" 1
996 1 55 VAL MG1 1 56 ILE H 3.200 . 4.600 3.294 2.615 4.015 . 0 0 "[ . 1 . 2]" 1
997 1 55 VAL MG2 1 56 ILE H 3.200 . 4.600 3.365 2.622 4.139 . 0 0 "[ . 1 . 2]" 1
998 1 56 ILE H 1 56 ILE MD 2.780 . 3.760 3.087 1.780 3.901 0.141 1 0 "[ . 1 . 2]" 1
999 1 56 ILE H 1 56 ILE QG 3.310 . 4.820 2.297 2.011 3.319 . 0 0 "[ . 1 . 2]" 1
1000 1 56 ILE H 1 56 ILE MG 2.625 . 3.450 3.088 2.701 3.368 . 0 0 "[ . 1 . 2]" 1
1001 1 56 ILE HA 1 56 ILE MD 3.335 . 4.870 3.872 3.569 4.208 . 0 0 "[ . 1 . 2]" 1
1002 1 56 ILE HA 1 56 ILE QG 2.695 . 3.590 3.364 3.249 3.523 . 0 0 "[ . 1 . 2]" 1
1003 1 56 ILE HA 1 56 ILE MG 2.375 . 2.950 2.293 2.181 2.479 . 0 0 "[ . 1 . 2]" 1
1004 1 56 ILE HA 1 57 TRP H 2.430 . 3.060 2.438 2.343 2.562 . 0 0 "[ . 1 . 2]" 1
1005 1 56 ILE HA 1 57 TRP HA 3.510 . 5.220 4.323 4.222 4.430 . 0 0 "[ . 1 . 2]" 1
1006 1 56 ILE HA 1 57 TRP HD1 3.475 . 5.150 4.303 3.933 4.755 . 0 0 "[ . 1 . 2]" 1
1007 1 56 ILE HB 1 56 ILE MD 2.650 . 3.500 2.495 2.236 3.246 . 0 0 "[ . 1 . 2]" 1
1008 1 56 ILE HB 1 57 TRP H 2.655 . 3.510 2.380 2.219 2.675 . 0 0 "[ . 1 . 2]" 1
1009 1 56 ILE HB 1 57 TRP HD1 3.650 . 5.500 4.731 4.277 5.352 . 0 0 "[ . 1 . 2]" 1
1010 1 56 ILE MD 1 57 TRP H 3.150 . 4.500 3.909 3.344 4.524 0.024 12 0 "[ . 1 . 2]" 1
1011 1 56 ILE MD 1 57 TRP HA 3.650 . 5.500 4.751 3.693 5.744 0.244 11 0 "[ . 1 . 2]" 1
1012 1 56 ILE QG 1 56 ILE MG 2.450 . 3.100 2.222 2.039 2.445 . 0 0 "[ . 1 . 2]" 1
1013 1 56 ILE MG 1 57 TRP H 2.925 . 4.050 3.531 3.253 3.922 . 0 0 "[ . 1 . 2]" 1
1014 1 56 ILE MG 1 57 TRP HD1 3.650 . 5.500 4.933 4.377 5.647 0.147 15 0 "[ . 1 . 2]" 1
1015 1 57 TRP H 1 57 TRP HB2 2.525 . 3.250 2.449 2.329 2.622 . 0 0 "[ . 1 . 2]" 1
1016 1 57 TRP H 1 57 TRP HB3 2.770 . 3.740 3.587 3.492 3.645 . 0 0 "[ . 1 . 2]" 1
1017 1 57 TRP H 1 57 TRP HD1 2.935 . 4.070 2.826 2.519 3.141 . 0 0 "[ . 1 . 2]" 1
1018 1 57 TRP H 1 58 ASP H 3.290 . 4.780 4.538 4.419 4.630 . 0 0 "[ . 1 . 2]" 1
1019 1 57 TRP HA 1 57 TRP HE3 2.965 . 4.130 2.800 2.530 3.045 . 0 0 "[ . 1 . 2]" 1
1020 1 57 TRP HA 1 57 TRP HZ3 3.650 . 5.500 4.965 4.704 5.227 . 0 0 "[ . 1 . 2]" 1
1021 1 57 TRP HA 1 58 ASP H 2.410 . 3.020 2.227 2.138 2.310 . 0 0 "[ . 1 . 2]" 1
1022 1 57 TRP HA 1 58 ASP HA 3.130 . 4.460 4.412 4.309 4.517 0.057 17 0 "[ . 1 . 2]" 1
1023 1 57 TRP HA 1 59 THR H 2.885 . 3.970 4.017 3.740 4.152 0.182 12 0 "[ . 1 . 2]" 1
1024 1 57 TRP HB2 1 59 THR H 2.975 . 4.150 4.220 3.878 4.457 0.307 13 0 "[ . 1 . 2]" 1
1025 1 57 TRP HB3 1 58 ASP H 2.870 . 3.940 3.277 3.084 3.469 . 0 0 "[ . 1 . 2]" 1
1026 1 57 TRP HB3 1 59 THR H 2.740 . 3.680 3.176 2.656 3.642 . 0 0 "[ . 1 . 2]" 1
1027 1 57 TRP HE3 1 58 ASP H 2.960 . 4.120 3.815 3.405 4.340 0.220 2 0 "[ . 1 . 2]" 1
1028 1 58 ASP H 1 58 ASP QB 2.710 . 3.620 2.338 2.185 2.666 . 0 0 "[ . 1 . 2]" 1
1029 1 58 ASP H 1 59 THR H 2.530 . 3.260 2.579 2.277 2.772 . 0 0 "[ . 1 . 2]" 1
1030 1 58 ASP H 1 59 THR HA 3.580 . 5.360 5.187 4.862 5.357 . 0 0 "[ . 1 . 2]" 1
1031 1 58 ASP H 1 60 GLU H 3.540 . 5.280 4.318 3.712 6.125 0.845 17 3 "[ *. 1 . +- 2]" 1
1032 1 58 ASP HA 1 60 GLU H 3.650 . 5.500 4.528 3.881 5.690 0.190 4 0 "[ . 1 . 2]" 1
1033 1 58 ASP QB 1 59 THR H 3.085 . 4.370 2.812 2.176 3.538 . 0 0 "[ . 1 . 2]" 1
1034 1 59 THR H 1 59 THR HB 2.595 . 3.390 2.866 2.465 3.641 0.251 3 0 "[ . 1 . 2]" 1
1035 1 59 THR H 1 59 THR MG 3.250 . 4.700 3.452 2.178 3.832 . 0 0 "[ . 1 . 2]" 1
1036 1 59 THR H 1 60 GLU H 3.145 . 4.490 2.710 2.086 4.124 . 0 0 "[ . 1 . 2]" 1
1037 1 59 THR H 1 60 GLU HA 3.440 . 5.080 4.680 4.311 5.054 . 0 0 "[ . 1 . 2]" 1
1038 1 59 THR HA 1 59 THR MG 2.525 . 3.250 2.332 2.140 2.503 . 0 0 "[ . 1 . 2]" 1
1039 1 59 THR HA 1 60 GLU H 2.640 . 3.480 3.205 1.988 3.538 0.058 15 0 "[ . 1 . 2]" 1
1040 1 59 THR HA 1 61 THR H 3.115 . 4.430 4.176 3.574 5.051 0.621 7 2 "[ - . + 1 . 2]" 1
1041 1 59 THR HB 1 60 GLU H 2.765 . 3.730 3.449 2.755 4.128 0.398 19 0 "[ . 1 . 2]" 1
1042 1 59 THR MG 1 60 GLU H 2.870 . 3.940 3.697 2.745 4.231 0.291 7 0 "[ . 1 . 2]" 1
1043 1 60 GLU H 1 60 GLU QB 2.675 . 3.550 3.143 2.231 3.508 . 0 0 "[ . 1 . 2]" 1
1044 1 60 GLU H 1 60 GLU QG 2.705 . 3.610 3.186 2.228 4.113 0.503 14 2 "[ . 1 +. -2]" 1
1045 1 60 GLU H 1 61 THR H 2.290 . 2.780 2.547 2.227 2.954 0.174 7 0 "[ . 1 . 2]" 1
1046 1 60 GLU HA 1 61 THR H 2.500 . 3.200 2.984 2.379 3.407 0.207 17 0 "[ . 1 . 2]" 1
1047 1 60 GLU QB 1 61 THR H 2.980 . 4.160 3.630 2.622 4.039 . 0 0 "[ . 1 . 2]" 1
1048 1 60 GLU QG 1 61 THR H 3.110 . 4.420 4.181 2.223 4.510 0.090 10 0 "[ . 1 . 2]" 1
1049 1 61 THR H 1 61 THR MG 2.885 . 3.970 3.935 3.719 4.117 0.147 17 0 "[ . 1 . 2]" 1
1050 1 61 THR H 1 62 PRO QD 3.120 . 4.440 3.408 3.010 3.974 . 0 0 "[ . 1 . 2]" 1
1051 1 61 THR HA 1 61 THR MG 2.365 . 2.930 2.295 2.173 2.465 . 0 0 "[ . 1 . 2]" 1
1052 1 61 THR HA 1 62 PRO HD2 2.730 . 3.660 2.133 1.865 2.539 . 0 0 "[ . 1 . 2]" 1
1053 1 61 THR HA 1 62 PRO QD 2.500 . 3.200 1.849 1.780 2.020 0.020 9 0 "[ . 1 . 2]" 1
1054 1 61 THR HA 1 62 PRO HD3 2.730 . 3.660 2.083 1.818 2.296 . 0 0 "[ . 1 . 2]" 1
1055 1 61 THR HA 1 62 PRO HG2 3.165 . 4.530 4.195 3.978 4.425 . 0 0 "[ . 1 . 2]" 1
1056 1 61 THR HA 1 62 PRO HG3 3.095 . 4.390 4.186 3.987 4.375 . 0 0 "[ . 1 . 2]" 1
1057 1 61 THR HB 1 62 PRO HD2 3.360 . 4.920 4.152 4.005 4.394 . 0 0 "[ . 1 . 2]" 1
1058 1 61 THR HB 1 62 PRO QD 2.950 . 4.100 3.917 3.752 4.114 0.014 16 0 "[ . 1 . 2]" 1
1059 1 61 THR HB 1 62 PRO HD3 3.360 . 4.920 4.820 4.492 4.973 0.053 8 0 "[ . 1 . 2]" 1
1060 1 61 THR MG 1 62 PRO HD2 2.875 . 3.950 2.016 1.781 2.494 0.019 5 0 "[ . 1 . 2]" 1
1061 1 61 THR MG 1 62 PRO QD 2.525 . 3.250 1.997 1.766 2.458 0.034 5 0 "[ . 1 . 2]" 1
1062 1 61 THR MG 1 62 PRO HD3 2.875 . 3.950 3.267 2.897 3.712 . 0 0 "[ . 1 . 2]" 1
1063 1 61 THR MG 1 62 PRO HG2 2.635 . 3.470 3.525 3.178 4.000 0.530 10 1 "[ . + . 2]" 1
1064 1 62 PRO HA 1 63 ILE H 2.525 . 3.250 2.198 2.147 2.297 . 0 0 "[ . 1 . 2]" 1
1065 1 62 PRO HA 1 63 ILE QG 2.905 . 4.010 3.571 3.349 3.900 . 0 0 "[ . 1 . 2]" 1
1066 1 62 PRO HB2 1 63 ILE H 2.575 . 3.350 2.963 2.692 3.433 0.083 5 0 "[ . 1 . 2]" 1
1067 1 62 PRO HB3 1 63 ILE H 2.535 . 3.270 3.397 3.155 3.574 0.304 8 0 "[ . 1 . 2]" 1
1068 1 63 ILE H 1 63 ILE HB 2.565 . 3.330 2.537 2.457 2.629 . 0 0 "[ . 1 . 2]" 1
1069 1 63 ILE H 1 63 ILE MD 3.250 . 4.700 3.728 3.445 3.980 . 0 0 "[ . 1 . 2]" 1
1070 1 63 ILE H 1 63 ILE QG 3.105 . 4.410 2.629 2.446 2.876 . 0 0 "[ . 1 . 2]" 1
1071 1 63 ILE H 1 63 ILE MG 3.075 . 4.350 3.804 3.759 3.837 . 0 0 "[ . 1 . 2]" 1
1072 1 63 ILE HA 1 63 ILE QG 2.710 . 3.620 2.606 2.407 3.006 . 0 0 "[ . 1 . 2]" 1
1073 1 63 ILE HA 1 64 CYS H 2.325 . 2.850 2.207 2.154 2.257 . 0 0 "[ . 1 . 2]" 1
1074 1 63 ILE HA 1 64 CYS HA 3.200 . 4.600 4.359 4.266 4.431 . 0 0 "[ . 1 . 2]" 1
1075 1 63 ILE HB 1 63 ILE MD 2.710 . 3.620 2.631 2.322 3.263 . 0 0 "[ . 1 . 2]" 1
1076 1 63 ILE HB 1 64 CYS H 3.145 . 4.490 4.176 4.131 4.239 . 0 0 "[ . 1 . 2]" 1
1077 1 63 ILE HB 1 65 ASP HB2 3.295 . 4.790 4.058 3.484 4.808 0.018 19 0 "[ . 1 . 2]" 1
1078 1 63 ILE QG 1 63 ILE MG 2.420 . 3.040 2.304 2.240 2.351 . 0 0 "[ . 1 . 2]" 1
1079 1 63 ILE MG 1 64 CYS H 2.725 . 3.650 2.646 2.539 2.844 . 0 0 "[ . 1 . 2]" 1
1080 1 63 ILE MG 1 64 CYS HA 3.185 . 4.570 4.033 3.886 4.165 . 0 0 "[ . 1 . 2]" 1
1081 1 63 ILE MG 1 65 ASP H 3.205 . 4.610 4.196 3.057 4.697 0.087 2 0 "[ . 1 . 2]" 1
1082 1 63 ILE MG 1 65 ASP HA 3.095 . 4.390 3.954 3.409 4.414 0.024 2 0 "[ . 1 . 2]" 1
1083 1 63 ILE MG 1 65 ASP HB2 2.630 . 3.460 3.238 2.609 3.574 0.114 19 0 "[ . 1 . 2]" 1
1084 1 64 CYS H 1 64 CYS HB2 2.830 . 3.860 2.468 2.339 2.597 . 0 0 "[ . 1 . 2]" 1
1085 1 64 CYS H 1 64 CYS QB 2.555 . 3.310 2.415 2.283 2.547 . 0 0 "[ . 1 . 2]" 1
1086 1 64 CYS H 1 64 CYS HB3 2.830 . 3.860 3.502 2.776 3.673 . 0 0 "[ . 1 . 2]" 1
1087 1 64 CYS HA 1 65 ASP H 2.310 . 2.820 2.147 1.998 2.418 . 0 0 "[ . 1 . 2]" 1
1088 1 64 CYS HA 1 65 ASP HA 3.130 . 4.460 4.424 4.322 4.499 0.039 8 0 "[ . 1 . 2]" 1
1089 1 64 CYS QB 1 65 ASP H 2.855 . 3.910 3.324 2.935 3.951 0.041 12 0 "[ . 1 . 2]" 1
1090 1 64 CYS HB2 1 65 ASP H 3.210 . 4.620 4.237 3.985 4.542 . 0 0 "[ . 1 . 2]" 1
1091 1 64 CYS HB3 1 65 ASP H 3.210 . 4.620 3.490 3.016 4.342 . 0 0 "[ . 1 . 2]" 1
1092 1 65 ASP H 1 65 ASP HB2 2.635 . 3.470 3.047 2.622 3.316 . 0 0 "[ . 1 . 2]" 1
1093 1 65 ASP H 1 66 ARG H 3.370 . 4.940 4.388 4.286 4.510 . 0 0 "[ . 1 . 2]" 1
1094 1 65 ASP HA 1 66 ARG H 2.295 . 2.790 2.511 2.377 2.642 . 0 0 "[ . 1 . 2]" 1
1095 1 65 ASP HB2 1 66 ARG H 2.940 . 4.080 3.834 3.713 4.032 . 0 0 "[ . 1 . 2]" 1
1096 1 65 ASP HB3 1 66 ARG H 3.365 . 4.930 3.334 2.927 3.780 . 0 0 "[ . 1 . 2]" 1
1097 1 66 ARG H 1 66 ARG QB 2.345 . 2.890 2.322 2.119 2.474 . 0 0 "[ . 1 . 2]" 1
1098 1 66 ARG H 1 66 ARG QD 3.525 . 5.250 4.058 3.539 4.629 . 0 0 "[ . 1 . 2]" 1
1099 1 66 ARG H 1 67 ILE H 3.570 . 5.340 4.536 4.393 4.626 . 0 0 "[ . 1 . 2]" 1
1100 1 66 ARG HA 1 66 ARG QD 3.095 . 4.390 3.860 2.061 4.286 . 0 0 "[ . 1 . 2]" 1
1101 1 66 ARG HA 1 66 ARG QG 2.695 . 3.590 2.470 2.254 2.851 . 0 0 "[ . 1 . 2]" 1
1102 1 66 ARG HA 1 67 ILE H 2.455 . 3.110 2.152 2.016 2.268 . 0 0 "[ . 1 . 2]" 1
1103 1 66 ARG HA 1 90 TYR HB2 3.495 . 5.190 5.008 3.970 5.548 0.358 9 0 "[ . 1 . 2]" 1
1104 1 66 ARG HA 1 90 TYR HB3 3.545 . 5.290 4.975 3.887 5.506 0.216 3 0 "[ . 1 . 2]" 1
1105 1 66 ARG QB 1 66 ARG QD 2.640 . 3.480 2.221 2.073 2.637 . 0 0 "[ . 1 . 2]" 1
1106 1 66 ARG QB 1 89 HIS QB 2.940 . 4.080 3.618 2.145 4.525 0.445 16 0 "[ . 1 . 2]" 1
1107 1 66 ARG HB2 1 66 ARG QD 2.895 . 3.990 2.583 2.301 3.485 . 0 0 "[ . 1 . 2]" 1
1108 1 66 ARG HB2 1 89 HIS HD2 3.650 . 5.500 3.787 2.295 5.828 0.328 14 0 "[ . 1 . 2]" 1
1109 1 66 ARG HB3 1 66 ARG QD 2.895 . 3.990 2.511 2.244 3.003 . 0 0 "[ . 1 . 2]" 1
1110 1 66 ARG HB3 1 89 HIS HD2 3.650 . 5.500 3.251 2.210 5.448 . 0 0 "[ . 1 . 2]" 1
1111 1 66 ARG QD 1 89 HIS HD2 3.375 . 4.950 3.791 2.592 4.888 . 0 0 "[ . 1 . 2]" 1
1112 1 66 ARG HG2 1 89 HIS HD2 3.650 . 5.500 4.473 2.182 5.925 0.425 1 0 "[ . 1 . 2]" 1
1113 1 66 ARG HG3 1 89 HIS HD2 3.650 . 5.500 4.851 3.492 6.135 0.635 12 1 "[ . 1 + . 2]" 1
1114 1 67 ILE H 1 67 ILE HB 2.485 . 3.170 2.633 2.481 2.809 . 0 0 "[ . 1 . 2]" 1
1115 1 67 ILE H 1 67 ILE MD 2.975 . 4.150 3.538 3.300 3.745 . 0 0 "[ . 1 . 2]" 1
1116 1 67 ILE H 1 67 ILE HG12 2.690 . 3.580 3.130 2.870 3.406 . 0 0 "[ . 1 . 2]" 1
1117 1 67 ILE H 1 67 ILE HG13 2.690 . 3.580 1.942 1.752 2.191 0.048 14 0 "[ . 1 . 2]" 1
1118 1 67 ILE H 1 67 ILE MG 2.815 . 3.830 3.774 3.726 3.875 0.045 13 0 "[ . 1 . 2]" 1
1119 1 67 ILE H 1 68 PRO QD 3.575 . 5.350 4.006 3.876 4.212 . 0 0 "[ . 1 . 2]" 1
1120 1 67 ILE H 1 90 TYR H 3.145 . 4.490 4.177 3.710 4.667 0.177 3 0 "[ . 1 . 2]" 1
1121 1 67 ILE H 1 90 TYR HB2 3.325 . 4.850 3.221 2.315 3.897 . 0 0 "[ . 1 . 2]" 1
1122 1 67 ILE H 1 90 TYR HB3 3.110 . 4.420 3.806 3.030 4.434 0.014 14 0 "[ . 1 . 2]" 1
1123 1 67 ILE HA 1 67 ILE MD 3.295 . 4.790 3.819 3.751 3.899 . 0 0 "[ . 1 . 2]" 1
1124 1 67 ILE HA 1 67 ILE MG 2.760 . 3.720 2.364 2.228 2.525 . 0 0 "[ . 1 . 2]" 1
1125 1 67 ILE HA 1 68 PRO QB 3.350 . 4.900 4.610 4.410 4.785 . 0 0 "[ . 1 . 2]" 1
1126 1 67 ILE HA 1 68 PRO HD2 2.465 . 3.130 2.433 2.091 2.606 . 0 0 "[ . 1 . 2]" 1
1127 1 67 ILE HA 1 68 PRO QD 2.205 . 2.610 1.976 1.838 2.137 . 0 0 "[ . 1 . 2]" 1
1128 1 67 ILE HA 1 68 PRO HD3 2.465 . 3.130 2.121 1.895 2.599 . 0 0 "[ . 1 . 2]" 1
1129 1 67 ILE HA 1 68 PRO QG 3.455 . 5.110 3.878 3.733 4.064 . 0 0 "[ . 1 . 2]" 1
1130 1 67 ILE HB 1 67 ILE MD 2.865 . 3.930 2.441 2.275 2.535 . 0 0 "[ . 1 . 2]" 1
1131 1 67 ILE HB 1 69 CYS QB 3.570 . 5.340 4.679 3.435 5.636 0.296 2 0 "[ . 1 . 2]" 1
1132 1 67 ILE HB 1 90 TYR H 2.915 . 4.030 3.607 2.845 4.224 0.194 3 0 "[ . 1 . 2]" 1
1133 1 67 ILE HB 1 90 TYR HA 3.120 . 4.440 3.712 3.304 4.151 . 0 0 "[ . 1 . 2]" 1
1134 1 67 ILE HB 1 90 TYR HB2 2.765 . 3.730 1.913 1.690 2.400 0.110 16 0 "[ . 1 . 2]" 1
1135 1 67 ILE HB 1 90 TYR HB3 3.020 . 4.240 3.478 3.106 4.115 . 0 0 "[ . 1 . 2]" 1
1136 1 67 ILE HB 1 90 TYR QD 3.320 . 4.840 2.861 2.180 3.829 . 0 0 "[ . 1 . 2]" 1
1137 1 67 ILE HB 1 120 SER QB 3.570 . 5.340 4.755 3.735 5.722 0.382 5 0 "[ . 1 . 2]" 1
1138 1 67 ILE MD 1 67 ILE MG 2.290 . 2.780 1.908 1.723 2.127 0.077 12 0 "[ . 1 . 2]" 1
1139 1 67 ILE MD 1 90 TYR HB2 2.900 . 4.000 3.288 2.486 3.900 . 0 0 "[ . 1 . 2]" 1
1140 1 67 ILE MD 1 90 TYR HB3 3.650 . 5.500 4.374 3.425 5.083 . 0 0 "[ . 1 . 2]" 1
1141 1 67 ILE MD 1 90 TYR QD 3.070 . 4.340 2.643 2.088 3.724 . 0 0 "[ . 1 . 2]" 1
1142 1 67 ILE MD 1 120 SER HB2 2.920 . 4.040 2.963 1.958 4.417 0.377 17 0 "[ . 1 . 2]" 1
1143 1 67 ILE MD 1 120 SER HB3 2.920 . 4.040 2.691 1.920 3.733 . 0 0 "[ . 1 . 2]" 1
1144 1 67 ILE MD 1 126 GLY QA 2.680 . 3.560 2.722 1.761 3.664 0.104 4 0 "[ . 1 . 2]" 1
1145 1 67 ILE QG 1 90 TYR HB2 3.105 . 4.410 3.477 3.035 3.907 . 0 0 "[ . 1 . 2]" 1
1146 1 67 ILE QG 1 90 TYR HB3 3.570 . 5.340 4.423 4.015 5.028 . 0 0 "[ . 1 . 2]" 1
1147 1 67 ILE MG 1 68 PRO HA 3.200 . 4.600 4.296 3.928 4.578 . 0 0 "[ . 1 . 2]" 1
1148 1 67 ILE MG 1 68 PRO QD 2.540 . 3.280 2.842 2.146 3.161 . 0 0 "[ . 1 . 2]" 1
1149 1 67 ILE MG 1 68 PRO QG 3.355 . 4.910 4.396 3.650 4.643 . 0 0 "[ . 1 . 2]" 1
1150 1 67 ILE MG 1 69 CYS H 3.345 . 4.890 2.884 1.721 4.413 0.079 16 0 "[ . 1 . 2]" 1
1151 1 67 ILE MG 1 69 CYS HA 2.740 . 3.680 3.100 2.147 3.921 0.241 13 0 "[ . 1 . 2]" 1
1152 1 67 ILE MG 1 90 TYR H 3.400 . 5.000 4.346 3.861 4.982 . 0 0 "[ . 1 . 2]" 1
1153 1 67 ILE MG 1 90 TYR HA 3.335 . 4.870 4.076 3.662 4.571 . 0 0 "[ . 1 . 2]" 1
1154 1 67 ILE MG 1 90 TYR HB2 2.995 . 4.190 3.389 2.969 3.943 . 0 0 "[ . 1 . 2]" 1
1155 1 67 ILE MG 1 90 TYR HB3 3.650 . 5.500 4.807 4.399 5.330 . 0 0 "[ . 1 . 2]" 1
1156 1 67 ILE MG 1 90 TYR QD 3.135 . 4.470 3.193 2.527 4.085 . 0 0 "[ . 1 . 2]" 1
1157 1 67 ILE MG 1 120 SER HB2 3.095 . 4.390 3.950 2.851 4.614 0.224 12 0 "[ . 1 . 2]" 1
1158 1 67 ILE MG 1 120 SER QB 2.660 . 3.520 3.190 2.415 3.926 0.406 17 0 "[ . 1 . 2]" 1
1159 1 67 ILE MG 1 120 SER HB3 3.095 . 4.390 3.483 2.608 4.386 . 0 0 "[ . 1 . 2]" 1
1160 1 67 ILE MG 1 126 GLY H 3.310 . 4.820 4.246 3.186 5.172 0.352 11 0 "[ . 1 . 2]" 1
1161 1 67 ILE MG 1 126 GLY QA 2.705 . 3.610 2.402 1.631 3.091 0.169 5 0 "[ . 1 . 2]" 1
1162 1 67 ILE MG 1 127 ILE H 3.090 . 4.380 4.188 3.849 4.549 0.169 10 0 "[ . 1 . 2]" 1
1163 1 68 PRO HA 1 89 HIS HA 2.595 . 3.390 2.381 1.794 3.150 0.006 9 0 "[ . 1 . 2]" 1
1164 1 68 PRO HA 1 89 HIS HB2 3.255 . 4.710 4.060 2.416 4.873 0.163 10 0 "[ . 1 . 2]" 1
1165 1 68 PRO HA 1 89 HIS QB 2.970 . 4.140 3.508 2.169 4.144 0.004 13 0 "[ . 1 . 2]" 1
1166 1 68 PRO HA 1 89 HIS HB3 3.255 . 4.710 4.184 2.314 5.020 0.310 11 0 "[ . 1 . 2]" 1
1167 1 68 PRO HA 1 89 HIS HD2 3.650 . 5.500 4.078 2.361 6.150 0.650 17 1 "[ . 1 . + 2]" 1
1168 1 68 PRO HA 1 90 TYR H 3.020 . 4.240 4.054 2.764 4.517 0.277 14 0 "[ . 1 . 2]" 1
1169 1 68 PRO QB 1 69 CYS H 2.710 . 3.620 3.057 2.569 3.806 0.186 10 0 "[ . 1 . 2]" 1
1170 1 68 PRO QB 1 70 GLY H 3.150 . 4.500 3.388 2.235 4.914 0.414 20 0 "[ . 1 . 2]" 1
1171 1 68 PRO QB 1 89 HIS HA 3.125 . 4.450 4.087 3.210 4.518 0.068 8 0 "[ . 1 . 2]" 1
1172 1 68 PRO HB2 1 89 HIS HA 3.425 . 5.050 4.908 3.910 5.213 0.163 11 0 "[ . 1 . 2]" 1
1173 1 68 PRO HB3 1 89 HIS HA 3.425 . 5.050 4.395 3.412 5.014 . 0 0 "[ . 1 . 2]" 1
1174 1 68 PRO QD 1 69 CYS H 3.345 . 4.890 3.469 2.400 4.923 0.033 9 0 "[ . 1 . 2]" 1
1175 1 69 CYS H 1 70 GLY H 3.115 . 4.430 3.078 2.069 4.342 . 0 0 "[ . 1 . 2]" 1
1176 1 69 CYS HA 1 70 GLY H 2.445 . 3.090 2.778 2.031 3.440 0.350 5 0 "[ . 1 . 2]" 1
1177 1 69 CYS QB 1 70 GLY H 3.085 . 4.370 3.463 2.513 3.941 . 0 0 "[ . 1 . 2]" 1
1178 1 69 CYS QB 1 128 TRP HE1 2.885 . 3.970 3.496 2.274 4.237 0.267 5 0 "[ . 1 . 2]" 1
1179 1 69 CYS QB 1 128 TRP HZ2 2.990 . 4.180 3.210 2.578 4.661 0.481 13 0 "[ . 1 . 2]" 1
1180 1 69 CYS HB2 1 70 GLY H 3.425 . 5.050 4.062 2.578 4.600 . 0 0 "[ . 1 . 2]" 1
1181 1 69 CYS HB2 1 128 TRP HZ2 3.425 . 5.050 4.436 3.127 5.410 0.360 10 0 "[ . 1 . 2]" 1
1182 1 69 CYS HB3 1 70 GLY H 3.425 . 5.050 3.869 2.823 4.565 . 0 0 "[ . 1 . 2]" 1
1183 1 69 CYS HB3 1 128 TRP HZ2 3.425 . 5.050 3.356 2.654 5.247 0.197 13 0 "[ . 1 . 2]" 1
1184 1 70 GLY H 1 71 LEU H 3.230 . 4.660 4.172 2.453 4.639 . 0 0 "[ . 1 . 2]" 1
1185 1 70 GLY H 1 128 TRP HE1 3.325 . 4.850 4.644 3.116 5.189 0.339 1 0 "[ . 1 . 2]" 1
1186 1 70 GLY QA 1 71 LEU H 2.355 . 2.910 2.284 2.062 2.870 . 0 0 "[ . 1 . 2]" 1
1187 1 70 GLY QA 1 71 LEU QD 3.110 . 4.420 3.798 2.902 4.884 0.464 16 0 "[ . 1 . 2]" 1
1188 1 70 GLY HA2 1 71 LEU H 2.590 . 3.380 2.552 2.109 3.468 0.088 16 0 "[ . 1 . 2]" 1
1189 1 70 GLY HA3 1 71 LEU H 2.590 . 3.380 2.763 2.226 3.473 0.093 14 0 "[ . 1 . 2]" 1
1190 1 71 LEU H 1 71 LEU HB2 2.360 . 2.920 2.566 2.113 3.080 0.160 1 0 "[ . 1 . 2]" 1
1191 1 71 LEU H 1 71 LEU HB3 2.755 . 3.710 3.498 2.323 3.935 0.225 1 0 "[ . 1 . 2]" 1
1192 1 71 LEU H 1 71 LEU MD1 3.015 . 4.230 3.688 1.894 4.424 0.194 14 0 "[ . 1 . 2]" 1
1193 1 71 LEU H 1 71 LEU QD 2.660 . 3.520 2.834 1.891 4.007 0.487 14 0 "[ . 1 . 2]" 1
1194 1 71 LEU H 1 71 LEU MD2 3.015 . 4.230 3.362 2.006 4.749 0.519 6 1 "[ .+ 1 . 2]" 1
1195 1 71 LEU H 1 72 PRO QD 3.340 . 4.880 3.829 2.285 4.347 . 0 0 "[ . 1 . 2]" 1
1196 1 71 LEU HA 1 71 LEU MD1 2.840 . 3.880 2.576 1.879 3.752 . 0 0 "[ . 1 . 2]" 1
1197 1 71 LEU HA 1 71 LEU QD 2.540 . 3.280 2.160 1.820 2.992 . 0 0 "[ . 1 . 2]" 1
1198 1 71 LEU HA 1 71 LEU MD2 2.840 . 3.880 2.728 1.828 3.841 . 0 0 "[ . 1 . 2]" 1
1199 1 71 LEU HA 1 71 LEU HG 2.860 . 3.920 3.168 2.207 3.854 . 0 0 "[ . 1 . 2]" 1
1200 1 71 LEU HA 1 72 PRO HD2 2.880 . 3.960 2.371 1.920 2.783 . 0 0 "[ . 1 . 2]" 1
1201 1 71 LEU HA 1 72 PRO QD 2.625 . 3.450 1.931 1.746 2.074 0.054 16 0 "[ . 1 . 2]" 1
1202 1 71 LEU HA 1 72 PRO HD3 2.880 . 3.960 2.122 1.771 2.582 0.029 16 0 "[ . 1 . 2]" 1
1203 1 71 LEU HA 1 128 TRP HZ2 3.615 . 5.430 4.518 3.360 5.474 0.044 17 0 "[ . 1 . 2]" 1
1204 1 71 LEU HB2 1 71 LEU MD1 2.590 . 3.380 2.750 1.993 3.228 . 0 0 "[ . 1 . 2]" 1
1205 1 71 LEU HB2 1 71 LEU QD 2.325 . 2.850 2.244 1.972 2.473 . 0 0 "[ . 1 . 2]" 1
1206 1 71 LEU HB2 1 71 LEU MD2 2.590 . 3.380 2.600 2.253 3.212 . 0 0 "[ . 1 . 2]" 1
1207 1 71 LEU HB3 1 71 LEU MD1 2.840 . 3.880 2.598 2.219 3.197 . 0 0 "[ . 1 . 2]" 1
1208 1 71 LEU HB3 1 71 LEU MD2 2.840 . 3.880 2.766 2.185 3.213 . 0 0 "[ . 1 . 2]" 1
1209 1 71 LEU HB3 1 72 PRO QD 3.390 . 4.980 3.442 2.387 4.366 . 0 0 "[ . 1 . 2]" 1
1210 1 71 LEU QD 1 72 PRO QD 2.580 . 3.360 2.419 1.741 3.137 0.059 5 0 "[ . 1 . 2]" 1
1211 1 71 LEU QD 1 72 PRO QG 3.540 . 5.280 3.831 2.620 4.484 . 0 0 "[ . 1 . 2]" 1
1212 1 71 LEU QD 1 80 PHE HZ 3.225 . 4.650 4.268 2.551 5.379 0.729 9 1 "[ . +1 . 2]" 1
1213 1 71 LEU QD 1 85 ARG QB 3.505 . 5.210 4.688 3.365 5.692 0.482 4 0 "[ . 1 . 2]" 1
1214 1 71 LEU QD 1 85 ARG QG 3.000 . 4.200 3.616 2.339 4.660 0.460 6 0 "[ . 1 . 2]" 1
1215 1 71 LEU QD 1 86 GLU HA 2.775 . 3.750 3.137 1.706 4.223 0.473 10 0 "[ . 1 . 2]" 1
1216 1 71 LEU QD 1 86 GLU HB2 2.665 . 3.530 3.087 1.848 3.768 0.238 19 0 "[ . 1 . 2]" 1
1217 1 71 LEU QD 1 86 GLU QG 3.120 . 4.440 2.746 1.676 4.393 0.124 19 0 "[ . 1 . 2]" 1
1218 1 71 LEU MD1 1 72 PRO HD2 3.150 . 4.500 3.111 1.812 4.669 0.169 16 0 "[ . 1 . 2]" 1
1219 1 71 LEU MD1 1 72 PRO HD3 3.150 . 4.500 3.788 2.267 4.903 0.403 16 0 "[ . 1 . 2]" 1
1220 1 71 LEU MD1 1 86 GLU HA 3.440 . 5.080 3.664 1.712 5.007 0.088 5 0 "[ . 1 . 2]" 1
1221 1 71 LEU MD1 1 86 GLU HB2 3.015 . 4.230 3.663 1.851 4.658 0.428 13 0 "[ . 1 . 2]" 1
1222 1 71 LEU MD1 1 86 GLU HB3 2.850 . 3.900 2.931 1.775 4.121 0.221 13 0 "[ . 1 . 2]" 1
1223 1 71 LEU MD2 1 72 PRO HD2 3.150 . 4.500 3.460 1.785 4.513 0.015 14 0 "[ . 1 . 2]" 1
1224 1 71 LEU MD2 1 72 PRO HD3 3.150 . 4.500 3.956 2.640 4.765 0.265 5 0 "[ . 1 . 2]" 1
1225 1 71 LEU MD2 1 86 GLU HA 3.440 . 5.080 3.798 1.837 5.511 0.431 9 0 "[ . 1 . 2]" 1
1226 1 71 LEU MD2 1 86 GLU HB2 3.015 . 4.230 3.671 2.222 4.576 0.346 5 0 "[ . 1 . 2]" 1
1227 1 71 LEU MD2 1 86 GLU HB3 2.850 . 3.900 2.965 1.771 3.982 0.082 18 0 "[ . 1 . 2]" 1
1228 1 72 PRO HA 1 73 PRO QD 2.705 . 3.610 2.102 1.900 2.335 . 0 0 "[ . 1 . 2]" 1
1229 1 72 PRO HA 1 73 PRO QG 3.070 . 4.340 3.987 3.772 4.224 . 0 0 "[ . 1 . 2]" 1
1230 1 72 PRO HA 1 94 VAL QG 3.320 . 4.840 4.413 3.985 4.904 0.064 10 0 "[ . 1 . 2]" 1
1231 1 72 PRO HA 1 116 ILE MD 3.245 . 4.690 4.327 3.631 4.728 0.038 18 0 "[ . 1 . 2]" 1
1232 1 72 PRO HA 1 128 TRP HD1 3.545 . 5.290 4.132 3.133 5.089 . 0 0 "[ . 1 . 2]" 1
1233 1 72 PRO HA 1 128 TRP HE1 2.795 . 3.790 2.828 2.333 3.528 . 0 0 "[ . 1 . 2]" 1
1234 1 72 PRO QB 1 73 PRO QD 2.865 . 3.930 2.345 1.815 2.833 . 0 0 "[ . 1 . 2]" 1
1235 1 72 PRO QB 1 94 VAL HB 3.520 . 5.240 4.603 3.448 5.379 0.139 10 0 "[ . 1 . 2]" 1
1236 1 72 PRO QB 1 94 VAL QG 2.840 . 3.880 2.487 2.167 2.871 . 0 0 "[ . 1 . 2]" 1
1237 1 72 PRO QB 1 116 ILE MD 2.815 . 3.830 3.090 2.245 3.569 . 0 0 "[ . 1 . 2]" 1
1238 1 72 PRO HB2 1 73 PRO QD 3.180 . 4.560 2.728 1.846 3.336 . 0 0 "[ . 1 . 2]" 1
1239 1 72 PRO HB2 1 94 VAL QG 3.140 . 4.480 2.896 2.535 3.249 . 0 0 "[ . 1 . 2]" 1
1240 1 72 PRO HB2 1 116 ILE MD 3.205 . 4.610 3.688 2.525 4.613 0.003 1 0 "[ . 1 . 2]" 1
1241 1 72 PRO HB3 1 73 PRO QD 3.180 . 4.560 2.749 2.297 3.215 . 0 0 "[ . 1 . 2]" 1
1242 1 72 PRO HB3 1 94 VAL QG 3.140 . 4.480 2.742 2.235 3.220 . 0 0 "[ . 1 . 2]" 1
1243 1 72 PRO HB3 1 116 ILE MD 3.205 . 4.610 3.452 2.318 4.100 . 0 0 "[ . 1 . 2]" 1
1244 1 72 PRO QD 1 73 PRO QD 3.345 . 4.890 4.632 4.513 4.745 . 0 0 "[ . 1 . 2]" 1
1245 1 72 PRO QD 1 80 PHE QE 3.250 . 4.700 3.591 2.679 4.540 . 0 0 "[ . 1 . 2]" 1
1246 1 72 PRO QD 1 86 GLU HA 3.165 . 4.530 2.969 2.308 4.286 . 0 0 "[ . 1 . 2]" 1
1247 1 72 PRO QD 1 94 VAL QG 3.235 . 4.670 3.693 3.228 4.105 . 0 0 "[ . 1 . 2]" 1
1248 1 72 PRO QD 1 128 TRP HZ2 3.400 . 5.000 3.204 2.460 4.350 . 0 0 "[ . 1 . 2]" 1
1249 1 72 PRO HD2 1 80 PHE QE 3.650 . 5.500 3.718 2.707 4.833 . 0 0 "[ . 1 . 2]" 1
1250 1 72 PRO HD2 1 80 PHE HZ 3.650 . 5.500 3.930 2.555 5.279 . 0 0 "[ . 1 . 2]" 1
1251 1 72 PRO HD3 1 80 PHE QE 3.650 . 5.500 4.846 3.694 5.595 0.095 14 0 "[ . 1 . 2]" 1
1252 1 72 PRO HD3 1 80 PHE HZ 3.650 . 5.500 4.721 3.675 5.732 0.232 14 0 "[ . 1 . 2]" 1
1253 1 72 PRO QG 1 73 PRO QD 3.060 . 4.320 4.016 3.616 4.401 0.081 2 0 "[ . 1 . 2]" 1
1254 1 72 PRO QG 1 80 PHE HZ 3.575 . 5.350 3.402 2.262 4.575 . 0 0 "[ . 1 . 2]" 1
1255 1 72 PRO QG 1 94 VAL QG 2.215 . 2.630 2.263 1.914 2.769 0.139 14 0 "[ . 1 . 2]" 1
1256 1 72 PRO QG 1 128 TRP HZ2 3.575 . 5.350 3.198 2.024 4.637 . 0 0 "[ . 1 . 2]" 1
1257 1 72 PRO HG2 1 73 PRO QD 3.355 . 4.910 4.540 3.872 4.986 0.076 11 0 "[ . 1 . 2]" 1
1258 1 72 PRO HG2 1 80 PHE QD 3.650 . 5.500 4.094 3.266 4.959 . 0 0 "[ . 1 . 2]" 1
1259 1 72 PRO HG2 1 80 PHE QE 3.485 . 5.170 3.130 2.432 4.114 . 0 0 "[ . 1 . 2]" 1
1260 1 72 PRO HG3 1 73 PRO QD 3.355 . 4.910 4.529 4.167 5.043 0.133 2 0 "[ . 1 . 2]" 1
1261 1 72 PRO HG3 1 80 PHE QD 3.650 . 5.500 5.095 4.150 5.562 0.062 12 0 "[ . 1 . 2]" 1
1262 1 72 PRO HG3 1 80 PHE QE 3.485 . 5.170 4.246 3.690 5.176 0.006 5 0 "[ . 1 . 2]" 1
1263 1 73 PRO HA 1 74 THR H 2.140 . 2.480 2.202 2.127 2.320 . 0 0 "[ . 1 . 2]" 1
1264 1 73 PRO HA 1 132 ALA MB 3.055 . 4.310 4.309 4.065 4.696 0.386 17 0 "[ . 1 . 2]" 1
1265 1 73 PRO QB 1 74 THR H 2.800 . 3.800 3.098 2.834 3.437 . 0 0 "[ . 1 . 2]" 1
1266 1 73 PRO QB 1 116 ILE MD 3.130 . 4.460 4.186 3.656 4.534 0.074 6 0 "[ . 1 . 2]" 1
1267 1 73 PRO QB 1 132 ALA H 2.860 . 3.920 2.577 1.994 4.306 0.386 17 0 "[ . 1 . 2]" 1
1268 1 73 PRO QB 1 132 ALA MB 2.415 . 3.030 2.086 1.788 2.433 0.012 11 0 "[ . 1 . 2]" 1
1269 1 73 PRO HB2 1 74 THR H 3.100 . 4.400 3.422 2.930 3.756 . 0 0 "[ . 1 . 2]" 1
1270 1 73 PRO HB2 1 116 ILE MD 3.480 . 5.160 4.468 3.809 4.920 . 0 0 "[ . 1 . 2]" 1
1271 1 73 PRO HB2 1 132 ALA MB 2.755 . 3.710 2.103 1.800 2.459 0.000 19 0 "[ . 1 . 2]" 1
1272 1 73 PRO HB3 1 74 THR H 3.100 . 4.400 3.621 3.272 4.037 . 0 0 "[ . 1 . 2]" 1
1273 1 73 PRO HB3 1 116 ILE MD 3.480 . 5.160 5.113 4.713 5.382 0.222 6 0 "[ . 1 . 2]" 1
1274 1 73 PRO HB3 1 132 ALA MB 2.755 . 3.710 3.505 3.056 3.860 0.150 14 0 "[ . 1 . 2]" 1
1275 1 73 PRO QD 1 94 VAL QG 3.175 . 4.550 3.885 3.411 4.420 . 0 0 "[ . 1 . 2]" 1
1276 1 73 PRO QD 1 116 ILE MD 2.695 . 3.590 2.582 2.198 2.996 . 0 0 "[ . 1 . 2]" 1
1277 1 73 PRO QD 1 128 TRP HE1 3.185 . 4.570 3.534 2.486 4.226 . 0 0 "[ . 1 . 2]" 1
1278 1 73 PRO QD 1 132 ALA MB 2.890 . 3.980 3.702 2.981 4.029 0.049 7 0 "[ . 1 . 2]" 1
1279 1 73 PRO QG 1 74 THR H 3.285 . 4.770 4.622 4.264 4.806 0.036 4 0 "[ . 1 . 2]" 1
1280 1 73 PRO QG 1 116 ILE MD 2.890 . 3.980 2.850 2.536 3.262 . 0 0 "[ . 1 . 2]" 1
1281 1 73 PRO QG 1 131 PRO HA 2.760 . 3.720 2.521 1.910 3.158 . 0 0 "[ . 1 . 2]" 1
1282 1 73 PRO QG 1 132 ALA H 2.695 . 3.590 2.206 1.637 4.001 0.411 17 0 "[ . 1 . 2]" 1
1283 1 73 PRO QG 1 132 ALA HA 2.620 . 3.440 3.400 3.037 4.176 0.736 17 1 "[ . 1 . + 2]" 1
1284 1 73 PRO QG 1 132 ALA MB 2.485 . 3.170 2.523 2.063 3.169 . 0 0 "[ . 1 . 2]" 1
1285 1 74 THR H 1 74 THR MG 2.750 . 3.700 3.130 2.033 3.782 0.082 10 0 "[ . 1 . 2]" 1
1286 1 74 THR H 1 75 ILE H 3.300 . 4.800 4.498 4.408 4.562 . 0 0 "[ . 1 . 2]" 1
1287 1 74 THR H 1 132 ALA MB 3.275 . 4.750 4.232 3.523 4.760 0.010 17 0 "[ . 1 . 2]" 1
1288 1 74 THR HA 1 74 THR HB 2.400 . 3.000 2.775 2.438 3.052 0.052 6 0 "[ . 1 . 2]" 1
1289 1 74 THR HA 1 74 THR MG 2.555 . 3.310 2.283 2.162 3.205 . 0 0 "[ . 1 . 2]" 1
1290 1 74 THR HA 1 75 ILE H 2.205 . 2.610 2.291 2.047 2.464 . 0 0 "[ . 1 . 2]" 1
1291 1 74 THR HA 1 75 ILE MD 3.650 . 5.500 5.250 4.968 5.502 0.002 15 0 "[ . 1 . 2]" 1
1292 1 74 THR HA 1 75 ILE MG 3.050 . 4.300 3.910 3.670 4.199 . 0 0 "[ . 1 . 2]" 1
1293 1 74 THR HA 1 79 ASP HA 3.250 . 4.700 4.699 3.140 5.329 0.629 6 2 "[ -.+ 1 . 2]" 1
1294 1 74 THR HA 1 80 PHE QD 3.370 . 4.940 4.092 2.742 4.642 . 0 0 "[ . 1 . 2]" 1
1295 1 74 THR HA 1 80 PHE QE 3.150 . 4.500 4.555 3.828 4.912 0.412 5 0 "[ . 1 . 2]" 1
1296 1 74 THR HA 1 96 TYR QE 3.270 . 4.740 3.580 2.638 3.997 . 0 0 "[ . 1 . 2]" 1
1297 1 74 THR HB 1 75 ILE H 2.795 . 3.790 3.101 2.112 3.999 0.209 10 0 "[ . 1 . 2]" 1
1298 1 74 THR HB 1 75 ILE MG 3.355 . 4.910 4.522 3.665 5.112 0.202 7 0 "[ . 1 . 2]" 1
1299 1 74 THR MG 1 75 ILE H 2.575 . 3.350 2.843 1.775 3.501 0.151 7 0 "[ . 1 . 2]" 1
1300 1 74 THR MG 1 75 ILE HA 3.335 . 4.870 4.702 4.075 5.356 0.486 14 0 "[ . 1 . 2]" 1
1301 1 74 THR MG 1 80 PHE QD 3.435 . 5.070 4.733 4.113 5.361 0.291 18 0 "[ . 1 . 2]" 1
1302 1 74 THR MG 1 80 PHE QE 3.420 . 5.040 4.620 3.870 5.262 0.222 5 0 "[ . 1 . 2]" 1
1303 1 75 ILE H 1 75 ILE HB 2.850 . 3.900 2.697 2.431 2.942 . 0 0 "[ . 1 . 2]" 1
1304 1 75 ILE H 1 75 ILE MD 3.105 . 4.410 4.124 3.939 4.257 . 0 0 "[ . 1 . 2]" 1
1305 1 75 ILE H 1 75 ILE MG 2.460 . 3.120 2.116 1.891 2.341 . 0 0 "[ . 1 . 2]" 1
1306 1 75 ILE H 1 76 THR H 3.295 . 4.790 4.449 4.302 4.566 . 0 0 "[ . 1 . 2]" 1
1307 1 75 ILE H 1 78 GLY H 3.650 . 5.500 4.701 3.454 5.925 0.425 20 0 "[ . 1 . 2]" 1
1308 1 75 ILE HA 1 75 ILE MD 2.820 . 3.840 2.010 1.889 2.262 . 0 0 "[ . 1 . 2]" 1
1309 1 75 ILE HA 1 75 ILE HG12 2.805 . 3.810 3.695 3.628 3.781 . 0 0 "[ . 1 . 2]" 1
1310 1 75 ILE HA 1 75 ILE HG13 2.700 . 3.600 2.941 2.857 3.017 . 0 0 "[ . 1 . 2]" 1
1311 1 75 ILE HA 1 75 ILE MG 2.515 . 3.230 3.147 3.093 3.206 . 0 0 "[ . 1 . 2]" 1
1312 1 75 ILE HA 1 76 THR H 2.325 . 2.850 2.204 2.114 2.289 . 0 0 "[ . 1 . 2]" 1
1313 1 75 ILE HA 1 76 THR HB 3.185 . 4.570 4.542 4.286 4.730 0.160 12 0 "[ . 1 . 2]" 1
1314 1 75 ILE HA 1 77 ASN H 3.100 . 4.400 4.342 4.171 4.471 0.071 11 0 "[ . 1 . 2]" 1
1315 1 75 ILE HA 1 132 ALA MB 2.415 . 3.030 2.690 2.340 3.084 0.054 19 0 "[ . 1 . 2]" 1
1316 1 75 ILE HB 1 75 ILE MD 2.755 . 3.710 2.353 2.203 2.466 . 0 0 "[ . 1 . 2]" 1
1317 1 75 ILE HB 1 76 THR H 2.985 . 4.170 3.931 3.743 4.105 . 0 0 "[ . 1 . 2]" 1
1318 1 75 ILE HB 1 79 ASP H 3.420 . 5.040 4.986 4.163 5.657 0.617 18 1 "[ . 1 . + 2]" 1
1319 1 75 ILE HB 1 96 TYR HA 3.650 . 5.500 4.730 3.974 5.301 . 0 0 "[ . 1 . 2]" 1
1320 1 75 ILE HB 1 96 TYR QD 3.360 . 4.920 2.033 1.706 2.513 0.094 2 0 "[ . 1 . 2]" 1
1321 1 75 ILE HB 1 96 TYR QE 3.315 . 4.830 2.601 2.266 3.361 . 0 0 "[ . 1 . 2]" 1
1322 1 75 ILE HB 1 132 ALA MB 2.985 . 4.170 3.477 3.060 3.994 . 0 0 "[ . 1 . 2]" 1
1323 1 75 ILE MD 1 75 ILE MG 2.570 . 3.340 3.189 3.146 3.234 . 0 0 "[ . 1 . 2]" 1
1324 1 75 ILE MD 1 76 THR H 3.195 . 4.590 2.158 1.902 2.558 . 0 0 "[ . 1 . 2]" 1
1325 1 75 ILE MD 1 76 THR HA 3.510 . 5.220 4.593 4.331 4.914 . 0 0 "[ . 1 . 2]" 1
1326 1 75 ILE MD 1 78 GLY H 3.620 . 5.440 4.733 3.858 5.613 0.173 14 0 "[ . 1 . 2]" 1
1327 1 75 ILE MD 1 79 ASP HA 3.650 . 5.500 5.592 4.835 6.110 0.610 12 2 "[ -. 1 + . 2]" 1
1328 1 75 ILE MD 1 94 VAL QG 3.650 . 5.500 5.450 5.136 5.676 0.176 7 0 "[ . 1 . 2]" 1
1329 1 75 ILE MD 1 96 TYR H 3.650 . 5.500 5.118 4.826 5.582 0.082 8 0 "[ . 1 . 2]" 1
1330 1 75 ILE MD 1 96 TYR HA 3.360 . 4.920 4.295 3.869 4.692 . 0 0 "[ . 1 . 2]" 1
1331 1 75 ILE MD 1 96 TYR HB2 2.830 . 3.860 3.160 2.822 3.666 . 0 0 "[ . 1 . 2]" 1
1332 1 75 ILE MD 1 96 TYR HB3 2.940 . 4.080 2.380 1.925 2.790 . 0 0 "[ . 1 . 2]" 1
1333 1 75 ILE MD 1 96 TYR QD 2.785 . 3.770 2.635 2.105 3.034 . 0 0 "[ . 1 . 2]" 1
1334 1 75 ILE MD 1 96 TYR QE 3.310 . 4.820 3.614 3.104 4.095 . 0 0 "[ . 1 . 2]" 1
1335 1 75 ILE MD 1 97 ARG H 3.565 . 5.330 4.500 3.667 5.206 . 0 0 "[ . 1 . 2]" 1
1336 1 75 ILE MD 1 98 CYS HA 3.630 . 5.460 5.065 4.173 5.542 0.082 19 0 "[ . 1 . 2]" 1
1337 1 75 ILE MD 1 132 ALA HA 3.260 . 4.720 3.893 3.307 4.365 . 0 0 "[ . 1 . 2]" 1
1338 1 75 ILE MD 1 132 ALA MB 2.280 . 2.760 2.229 1.860 2.789 0.029 13 0 "[ . 1 . 2]" 1
1339 1 75 ILE MD 1 133 PRO HA 3.650 . 5.500 4.637 4.377 4.810 . 0 0 "[ . 1 . 2]" 1
1340 1 75 ILE MD 1 133 PRO QB 3.570 . 5.340 4.032 3.583 4.368 . 0 0 "[ . 1 . 2]" 1
1341 1 75 ILE MD 1 133 PRO HD2 3.105 . 4.410 3.360 2.757 3.977 . 0 0 "[ . 1 . 2]" 1
1342 1 75 ILE MD 1 133 PRO HD3 3.395 . 4.990 4.594 4.150 5.056 0.066 19 0 "[ . 1 . 2]" 1
1343 1 75 ILE MD 1 134 GLN H 3.280 . 4.760 4.581 4.239 4.840 0.080 5 0 "[ . 1 . 2]" 1
1344 1 75 ILE MD 1 134 GLN HA 3.140 . 4.480 2.802 2.183 3.353 . 0 0 "[ . 1 . 2]" 1
1345 1 75 ILE MD 1 134 GLN QB 2.940 . 4.080 3.764 2.172 4.262 0.182 6 0 "[ . 1 . 2]" 1
1346 1 75 ILE MD 1 135 CYS H 3.505 . 5.210 4.066 3.386 4.845 . 0 0 "[ . 1 . 2]" 1
1347 1 75 ILE HG12 1 76 THR H 3.065 . 4.330 3.718 3.413 4.056 . 0 0 "[ . 1 . 2]" 1
1348 1 75 ILE HG12 1 96 TYR HA 3.550 . 5.300 4.330 3.852 4.741 . 0 0 "[ . 1 . 2]" 1
1349 1 75 ILE HG12 1 96 TYR HB3 3.040 . 4.280 2.693 2.385 3.049 . 0 0 "[ . 1 . 2]" 1
1350 1 75 ILE HG12 1 96 TYR QD 3.215 . 4.630 2.797 2.405 3.586 . 0 0 "[ . 1 . 2]" 1
1351 1 75 ILE HG12 1 97 ARG H 3.650 . 5.500 3.829 3.198 4.435 . 0 0 "[ . 1 . 2]" 1
1352 1 75 ILE HG12 1 98 CYS HA 3.520 . 5.240 4.698 3.324 5.254 0.014 19 0 "[ . 1 . 2]" 1
1353 1 75 ILE HG13 1 75 ILE MG 2.580 . 3.360 2.360 2.247 2.499 . 0 0 "[ . 1 . 2]" 1
1354 1 75 ILE HG13 1 76 THR H 2.750 . 3.700 2.135 1.737 2.473 0.063 12 0 "[ . 1 . 2]" 1
1355 1 75 ILE HG13 1 77 ASN H 3.015 . 4.230 2.017 1.739 2.298 0.061 14 0 "[ . 1 . 2]" 1
1356 1 75 ILE HG13 1 77 ASN HB2 3.455 . 5.110 3.614 2.808 4.365 . 0 0 "[ . 1 . 2]" 1
1357 1 75 ILE HG13 1 77 ASN HB3 3.455 . 5.110 5.127 4.497 5.321 0.211 17 0 "[ . 1 . 2]" 1
1358 1 75 ILE HG13 1 78 GLY H 3.005 . 4.210 3.407 2.351 4.444 0.234 14 0 "[ . 1 . 2]" 1
1359 1 75 ILE MG 1 76 THR H 2.860 . 3.920 3.376 3.101 3.575 . 0 0 "[ . 1 . 2]" 1
1360 1 75 ILE MG 1 76 THR HA 3.055 . 4.310 4.308 4.075 4.456 0.146 3 0 "[ . 1 . 2]" 1
1361 1 75 ILE MG 1 76 THR HB 3.650 . 5.500 4.540 4.037 5.348 . 0 0 "[ . 1 . 2]" 1
1362 1 75 ILE MG 1 77 ASN HA 3.190 . 4.580 4.213 2.959 4.652 0.072 3 0 "[ . 1 . 2]" 1
1363 1 75 ILE MG 1 77 ASN QB 2.850 . 3.900 3.504 2.193 4.307 0.407 5 0 "[ . 1 . 2]" 1
1364 1 75 ILE MG 1 78 GLY H 2.765 . 3.730 1.845 1.564 2.773 0.236 11 0 "[ . 1 . 2]" 1
1365 1 75 ILE MG 1 78 GLY QA 2.735 . 3.670 2.992 2.745 3.327 . 0 0 "[ . 1 . 2]" 1
1366 1 75 ILE MG 1 79 ASP H 2.760 . 3.720 2.547 1.754 3.221 0.046 14 0 "[ . 1 . 2]" 1
1367 1 75 ILE MG 1 79 ASP HA 2.985 . 4.170 2.262 1.856 2.783 . 0 0 "[ . 1 . 2]" 1
1368 1 75 ILE MG 1 80 PHE QD 3.140 . 4.480 4.137 3.493 4.583 0.103 5 0 "[ . 1 . 2]" 1
1369 1 75 ILE MG 1 96 TYR HA 3.285 . 4.770 4.598 4.314 5.014 0.244 20 0 "[ . 1 . 2]" 1
1370 1 75 ILE MG 1 96 TYR HB3 2.995 . 4.190 4.077 3.669 4.409 0.219 20 0 "[ . 1 . 2]" 1
1371 1 75 ILE MG 1 96 TYR QD 2.760 . 3.720 2.880 2.288 3.244 . 0 0 "[ . 1 . 2]" 1
1372 1 75 ILE MG 1 96 TYR QE 3.120 . 4.440 3.580 3.070 4.201 . 0 0 "[ . 1 . 2]" 1
1373 1 75 ILE MG 1 97 ARG H 3.345 . 4.890 4.235 3.653 4.880 . 0 0 "[ . 1 . 2]" 1
1374 1 75 ILE MG 1 98 CYS HA 3.455 . 5.110 5.160 3.959 5.661 0.551 6 1 "[ .+ 1 . 2]" 1
1375 1 76 THR H 1 76 THR HB 2.460 . 3.120 2.368 2.209 2.534 . 0 0 "[ . 1 . 2]" 1
1376 1 76 THR H 1 76 THR MG 2.905 . 4.010 3.564 2.031 3.714 . 0 0 "[ . 1 . 2]" 1
1377 1 76 THR HA 1 76 THR HB 2.175 . 2.550 2.947 2.439 3.001 0.451 14 0 "[ . 1 . 2]" 1
1378 1 76 THR HA 1 76 THR MG 2.540 . 3.280 2.476 2.292 3.212 . 0 0 "[ . 1 . 2]" 1
1379 1 76 THR HA 1 77 ASN H 2.630 . 3.460 3.564 3.457 3.646 0.186 5 0 "[ . 1 . 2]" 1
1380 1 76 THR HB 1 77 ASN H 3.215 . 4.630 2.526 2.325 4.029 . 0 0 "[ . 1 . 2]" 1
1381 1 76 THR HB 1 132 ALA MB 3.650 . 5.500 5.632 5.307 6.091 0.591 1 1 "[+ . 1 . 2]" 1
1382 1 76 THR MG 1 77 ASN H 2.900 . 4.000 3.296 2.266 3.621 . 0 0 "[ . 1 . 2]" 1
1383 1 76 THR MG 1 77 ASN HA 3.270 . 4.740 3.517 3.159 4.175 . 0 0 "[ . 1 . 2]" 1
1384 1 76 THR MG 1 77 ASN HB2 3.650 . 5.500 4.450 3.360 5.391 . 0 0 "[ . 1 . 2]" 1
1385 1 76 THR MG 1 77 ASN HB3 3.650 . 5.500 4.943 4.254 5.534 0.034 12 0 "[ . 1 . 2]" 1
1386 1 76 THR MG 1 77 ASN HD21 3.100 . 4.400 3.930 2.181 4.796 0.396 2 0 "[ . 1 . 2]" 1
1387 1 76 THR MG 1 77 ASN QD 2.755 . 3.710 3.316 2.081 3.901 0.191 19 0 "[ . 1 . 2]" 1
1388 1 76 THR MG 1 77 ASN HD22 3.100 . 4.400 3.639 2.629 4.284 . 0 0 "[ . 1 . 2]" 1
1389 1 76 THR MG 1 134 GLN HA 3.135 . 4.470 4.577 3.646 4.918 0.448 19 0 "[ . 1 . 2]" 1
1390 1 76 THR MG 1 134 GLN QB 2.720 . 3.640 3.506 2.951 4.087 0.447 18 0 "[ . 1 . 2]" 1
1391 1 77 ASN H 1 78 GLY H 2.900 . 4.000 2.709 2.248 4.152 0.152 14 0 "[ . 1 . 2]" 1
1392 1 77 ASN HA 1 77 ASN QD 3.310 . 4.820 3.127 1.648 4.003 0.152 11 0 "[ . 1 . 2]" 1
1393 1 77 ASN HA 1 78 GLY H 2.625 . 3.450 3.307 2.173 3.561 0.111 20 0 "[ . 1 . 2]" 1
1394 1 77 ASN HA 1 99 ASN QB 3.525 . 5.250 4.589 3.163 5.925 0.675 1 2 "[+ . 1 .- 2]" 1
1395 1 77 ASN HA 1 99 ASN QD 2.895 . 3.990 3.691 2.719 4.278 0.288 2 0 "[ . 1 . 2]" 1
1396 1 77 ASN QB 1 77 ASN QD 2.410 . 3.020 2.283 2.020 2.728 . 0 0 "[ . 1 . 2]" 1
1397 1 78 GLY H 1 79 ASP H 3.140 . 4.480 3.535 2.224 4.378 . 0 0 "[ . 1 . 2]" 1
1398 1 78 GLY QA 1 79 ASP H 2.340 . 2.880 2.307 2.069 2.909 0.029 14 0 "[ . 1 . 2]" 1
1399 1 78 GLY QA 1 79 ASP QB 3.205 . 4.610 3.867 3.428 4.231 . 0 0 "[ . 1 . 2]" 1
1400 1 79 ASP H 1 79 ASP HB2 2.925 . 4.050 3.409 2.659 3.992 . 0 0 "[ . 1 . 2]" 1
1401 1 79 ASP H 1 79 ASP HB3 2.925 . 4.050 3.204 2.535 4.069 0.019 4 0 "[ . 1 . 2]" 1
1402 1 79 ASP H 1 96 TYR QD 3.595 . 5.390 5.378 4.792 5.730 0.340 20 0 "[ . 1 . 2]" 1
1403 1 79 ASP HA 1 80 PHE H 2.415 . 3.030 2.790 2.450 3.406 0.376 7 0 "[ . 1 . 2]" 1
1404 1 79 ASP HA 1 80 PHE QD 3.415 . 5.030 3.539 2.848 3.932 . 0 0 "[ . 1 . 2]" 1
1405 1 79 ASP QB 1 80 PHE H 2.425 . 3.050 2.204 1.613 3.029 0.187 1 0 "[ . 1 . 2]" 1
1406 1 79 ASP HB2 1 80 PHE H 2.690 . 3.580 2.713 1.808 3.745 0.165 17 0 "[ . 1 . 2]" 1
1407 1 79 ASP HB3 1 80 PHE H 2.690 . 3.580 2.876 1.630 3.514 0.170 1 0 "[ . 1 . 2]" 1
1408 1 80 PHE H 1 80 PHE HB2 2.925 . 4.050 3.793 3.564 4.009 . 0 0 "[ . 1 . 2]" 1
1409 1 80 PHE H 1 80 PHE QB 2.675 . 3.550 3.063 2.624 3.375 . 0 0 "[ . 1 . 2]" 1
1410 1 80 PHE H 1 80 PHE HB3 2.925 . 4.050 3.240 2.701 3.632 . 0 0 "[ . 1 . 2]" 1
1411 1 80 PHE H 1 80 PHE QD 2.665 . 3.530 2.934 2.191 3.470 . 0 0 "[ . 1 . 2]" 1
1412 1 80 PHE HA 1 80 PHE QD 3.400 . 5.000 3.706 3.644 3.782 . 0 0 "[ . 1 . 2]" 1
1413 1 80 PHE HA 1 81 ILE H 2.415 . 3.030 2.348 2.157 2.514 . 0 0 "[ . 1 . 2]" 1
1414 1 80 PHE HA 1 94 VAL HB 3.440 . 5.080 5.101 4.599 5.926 0.846 17 1 "[ . 1 . + 2]" 1
1415 1 80 PHE HA 1 94 VAL QG 3.400 . 5.000 4.952 3.502 5.309 0.309 10 0 "[ . 1 . 2]" 1
1416 1 80 PHE HA 1 95 THR H 3.495 . 5.190 5.006 4.343 5.405 0.215 11 0 "[ . 1 . 2]" 1
1417 1 80 PHE HA 1 96 TYR HA 2.675 . 3.550 2.601 2.141 2.873 . 0 0 "[ . 1 . 2]" 1
1418 1 80 PHE HA 1 97 ARG H 2.650 . 3.500 3.354 2.937 3.753 0.253 16 0 "[ . 1 . 2]" 1
1419 1 80 PHE QB 1 81 ILE H 2.465 . 3.130 2.273 2.000 2.518 . 0 0 "[ . 1 . 2]" 1
1420 1 80 PHE QB 1 94 VAL HB 2.775 . 3.750 2.622 2.142 3.671 . 0 0 "[ . 1 . 2]" 1
1421 1 80 PHE QB 1 94 VAL QG 2.645 . 3.490 3.007 1.728 3.330 0.072 17 0 "[ . 1 . 2]" 1
1422 1 80 PHE QB 1 95 THR H 3.215 . 4.630 3.153 2.510 3.977 . 0 0 "[ . 1 . 2]" 1
1423 1 80 PHE QB 1 95 THR HA 3.565 . 5.330 4.593 3.908 5.237 . 0 0 "[ . 1 . 2]" 1
1424 1 80 PHE QB 1 96 TYR QD 3.355 . 4.910 2.666 2.168 3.142 . 0 0 "[ . 1 . 2]" 1
1425 1 80 PHE QB 1 97 ARG H 3.570 . 5.340 4.512 4.011 4.966 . 0 0 "[ . 1 . 2]" 1
1426 1 80 PHE HB2 1 81 ILE H 2.720 . 3.640 2.300 2.016 2.568 . 0 0 "[ . 1 . 2]" 1
1427 1 80 PHE HB2 1 94 VAL HB 3.120 . 4.440 2.697 2.183 3.822 . 0 0 "[ . 1 . 2]" 1
1428 1 80 PHE HB2 1 94 VAL QG 2.895 . 3.990 3.263 1.746 3.684 0.054 17 0 "[ . 1 . 2]" 1
1429 1 80 PHE HB2 1 96 TYR HA 3.150 . 4.500 3.499 2.911 3.999 . 0 0 "[ . 1 . 2]" 1
1430 1 80 PHE HB3 1 81 ILE H 2.720 . 3.640 3.572 3.333 3.789 0.149 19 0 "[ . 1 . 2]" 1
1431 1 80 PHE HB3 1 94 VAL HB 3.120 . 4.440 3.644 3.096 4.747 0.307 17 0 "[ . 1 . 2]" 1
1432 1 80 PHE HB3 1 94 VAL QG 2.895 . 3.990 3.560 2.770 3.936 . 0 0 "[ . 1 . 2]" 1
1433 1 80 PHE HB3 1 96 TYR HA 3.150 . 4.500 3.375 2.737 4.083 . 0 0 "[ . 1 . 2]" 1
1434 1 80 PHE QD 1 81 ILE H 2.860 . 3.920 3.427 3.167 3.843 . 0 0 "[ . 1 . 2]" 1
1435 1 80 PHE QD 1 81 ILE HA 3.320 . 4.840 4.397 3.541 4.947 0.107 5 0 "[ . 1 . 2]" 1
1436 1 80 PHE QD 1 81 ILE MG 3.080 . 4.360 4.434 3.765 4.860 0.500 17 1 "[ . 1 . + 2]" 1
1437 1 80 PHE QD 1 82 SER HB2 3.165 . 4.530 2.889 1.925 3.590 . 0 0 "[ . 1 . 2]" 1
1438 1 80 PHE QD 1 82 SER HB3 3.075 . 4.350 2.488 1.897 3.580 . 0 0 "[ . 1 . 2]" 1
1439 1 80 PHE QD 1 94 VAL HB 3.170 . 4.540 3.071 2.342 4.544 0.004 17 0 "[ . 1 . 2]" 1
1440 1 80 PHE QD 1 94 VAL QG 2.865 . 3.930 2.894 1.971 3.341 . 0 0 "[ . 1 . 2]" 1
1441 1 80 PHE QD 1 96 TYR HA 3.500 . 5.200 5.051 4.615 5.354 0.154 17 0 "[ . 1 . 2]" 1
1442 1 80 PHE QE 1 82 SER HB2 3.020 . 4.240 3.557 2.064 4.391 0.151 5 0 "[ . 1 . 2]" 1
1443 1 80 PHE QE 1 82 SER HB3 2.815 . 3.830 2.439 1.895 2.954 . 0 0 "[ . 1 . 2]" 1
1444 1 80 PHE QE 1 85 ARG HA 2.840 . 3.880 2.922 1.921 3.681 . 0 0 "[ . 1 . 2]" 1
1445 1 80 PHE QE 1 85 ARG QB 3.570 . 5.340 4.503 3.911 5.065 . 0 0 "[ . 1 . 2]" 1
1446 1 80 PHE QE 1 85 ARG QD 3.570 . 5.340 5.200 4.398 5.970 0.630 14 2 "[ . 1- +. 2]" 1
1447 1 80 PHE QE 1 86 GLU HA 3.380 . 4.960 4.178 2.843 5.030 0.070 13 0 "[ . 1 . 2]" 1
1448 1 80 PHE QE 1 94 VAL HB 3.650 . 5.500 4.302 3.642 5.818 0.318 17 0 "[ . 1 . 2]" 1
1449 1 80 PHE QE 1 94 VAL QG 2.810 . 3.820 2.949 2.450 3.701 . 0 0 "[ . 1 . 2]" 1
1450 1 80 PHE HZ 1 82 SER HB3 3.390 . 4.980 4.789 4.327 5.252 0.272 15 0 "[ . 1 . 2]" 1
1451 1 80 PHE HZ 1 85 ARG HA 2.690 . 3.580 2.775 1.761 3.667 0.087 17 0 "[ . 1 . 2]" 1
1452 1 80 PHE HZ 1 85 ARG QB 3.490 . 5.180 4.262 3.132 4.824 . 0 0 "[ . 1 . 2]" 1
1453 1 80 PHE HZ 1 85 ARG QD 3.570 . 5.340 5.131 4.372 5.894 0.554 9 1 "[ . +1 . 2]" 1
1454 1 80 PHE HZ 1 85 ARG HG2 3.650 . 5.500 3.809 2.811 5.543 0.043 11 0 "[ . 1 . 2]" 1
1455 1 80 PHE HZ 1 85 ARG HG3 3.650 . 5.500 3.625 2.535 4.683 . 0 0 "[ . 1 . 2]" 1
1456 1 80 PHE HZ 1 86 GLU HA 3.460 . 5.120 3.332 2.062 4.321 . 0 0 "[ . 1 . 2]" 1
1457 1 80 PHE HZ 1 86 GLU HB3 3.650 . 5.500 5.144 3.522 6.178 0.678 15 1 "[ . 1 + 2]" 1
1458 1 80 PHE HZ 1 86 GLU QG 3.650 . 5.500 4.480 2.415 5.639 0.139 17 0 "[ . 1 . 2]" 1
1459 1 80 PHE HZ 1 94 VAL QG 3.145 . 4.490 3.749 2.966 4.497 0.007 7 0 "[ . 1 . 2]" 1
1460 1 81 ILE H 1 81 ILE HB 2.605 . 3.410 2.458 2.262 2.820 . 0 0 "[ . 1 . 2]" 1
1461 1 81 ILE H 1 81 ILE MD 3.075 . 4.350 4.001 3.416 4.546 0.196 20 0 "[ . 1 . 2]" 1
1462 1 81 ILE H 1 81 ILE HG12 3.425 . 5.050 3.979 2.246 4.642 . 0 0 "[ . 1 . 2]" 1
1463 1 81 ILE H 1 81 ILE QG 3.005 . 4.210 3.252 2.212 4.056 . 0 0 "[ . 1 . 2]" 1
1464 1 81 ILE H 1 81 ILE HG13 3.425 . 5.050 3.692 2.234 4.522 . 0 0 "[ . 1 . 2]" 1
1465 1 81 ILE H 1 81 ILE MG 2.895 . 3.990 2.911 2.133 3.790 . 0 0 "[ . 1 . 2]" 1
1466 1 81 ILE H 1 94 VAL HA 3.435 . 5.070 5.174 4.793 5.487 0.417 13 0 "[ . 1 . 2]" 1
1467 1 81 ILE H 1 94 VAL HB 3.570 . 5.340 4.369 3.990 5.231 . 0 0 "[ . 1 . 2]" 1
1468 1 81 ILE H 1 95 THR H 2.700 . 3.600 3.254 2.709 3.642 0.042 11 0 "[ . 1 . 2]" 1
1469 1 81 ILE H 1 95 THR HB 3.015 . 4.230 3.756 3.213 4.270 0.040 11 0 "[ . 1 . 2]" 1
1470 1 81 ILE H 1 96 TYR H 3.550 . 5.300 4.828 4.536 5.232 . 0 0 "[ . 1 . 2]" 1
1471 1 81 ILE H 1 96 TYR HA 2.940 . 4.080 3.249 2.855 3.686 . 0 0 "[ . 1 . 2]" 1
1472 1 81 ILE HA 1 81 ILE HG12 2.800 . 3.800 2.875 2.399 3.698 . 0 0 "[ . 1 . 2]" 1
1473 1 81 ILE HA 1 81 ILE QG 2.565 . 3.330 2.391 2.153 2.965 . 0 0 "[ . 1 . 2]" 1
1474 1 81 ILE HA 1 81 ILE HG13 2.800 . 3.800 2.698 2.204 3.732 . 0 0 "[ . 1 . 2]" 1
1475 1 81 ILE HA 1 81 ILE MG 2.515 . 3.230 2.878 2.407 3.216 . 0 0 "[ . 1 . 2]" 1
1476 1 81 ILE HA 1 95 THR HB 3.650 . 5.500 5.204 4.678 5.570 0.070 11 0 "[ . 1 . 2]" 1
1477 1 81 ILE HB 1 81 ILE MD 2.630 . 3.460 2.504 2.249 3.246 . 0 0 "[ . 1 . 2]" 1
1478 1 81 ILE HB 1 82 SER H 2.990 . 4.180 3.740 2.672 4.342 0.162 7 0 "[ . 1 . 2]" 1
1479 1 81 ILE HB 1 95 THR H 3.250 . 4.700 3.883 2.702 4.920 0.220 7 0 "[ . 1 . 2]" 1
1480 1 81 ILE HB 1 95 THR HB 2.905 . 4.010 2.899 1.886 4.179 0.169 19 0 "[ . 1 . 2]" 1
1481 1 81 ILE HB 1 95 THR MG 3.005 . 4.210 3.723 2.960 4.557 0.347 20 0 "[ . 1 . 2]" 1
1482 1 81 ILE MD 1 95 THR HB 3.245 . 4.690 3.441 1.800 4.988 0.298 18 0 "[ . 1 . 2]" 1
1483 1 81 ILE MD 1 97 ARG HD2 3.195 . 4.590 3.360 2.010 4.451 . 0 0 "[ . 1 . 2]" 1
1484 1 81 ILE MD 1 97 ARG QD 2.860 . 3.920 2.489 1.840 3.426 . 0 0 "[ . 1 . 2]" 1
1485 1 81 ILE MD 1 97 ARG HD3 3.195 . 4.590 2.743 1.862 4.065 . 0 0 "[ . 1 . 2]" 1
1486 1 81 ILE QG 1 81 ILE MG 2.545 . 3.290 2.245 2.089 2.513 . 0 0 "[ . 1 . 2]" 1
1487 1 81 ILE QG 1 82 SER HA 3.425 . 5.050 4.773 3.675 5.720 0.670 1 6 "[+ .* * * - . * 2]" 1
1488 1 81 ILE QG 1 95 THR HB 3.250 . 4.700 3.971 2.319 4.651 . 0 0 "[ . 1 . 2]" 1
1489 1 81 ILE HG12 1 97 ARG HD2 3.650 . 5.500 4.745 2.146 5.942 0.442 14 0 "[ . 1 . 2]" 1
1490 1 81 ILE HG12 1 97 ARG HD3 3.650 . 5.500 3.956 1.942 6.144 0.644 11 2 "[ . 1+ . -2]" 1
1491 1 81 ILE HG13 1 97 ARG HD2 3.650 . 5.500 4.237 2.750 5.513 0.013 10 0 "[ . 1 . 2]" 1
1492 1 81 ILE HG13 1 97 ARG HD3 3.650 . 5.500 3.408 2.278 5.597 0.097 18 0 "[ . 1 . 2]" 1
1493 1 81 ILE MG 1 82 SER H 2.860 . 3.920 2.924 2.406 3.737 . 0 0 "[ . 1 . 2]" 1
1494 1 81 ILE MG 1 82 SER HA 2.645 . 3.490 3.052 2.609 3.697 0.207 19 0 "[ . 1 . 2]" 1
1495 1 81 ILE MG 1 95 THR HA 3.470 . 5.140 4.597 3.727 5.782 0.642 6 1 "[ .+ 1 . 2]" 1
1496 1 81 ILE MG 1 97 ARG HD2 3.455 . 5.110 4.920 2.724 5.723 0.613 14 3 "[ .* - 1 +. 2]" 1
1497 1 81 ILE MG 1 97 ARG QD 3.065 . 4.330 3.898 2.659 4.587 0.257 15 0 "[ . 1 . 2]" 1
1498 1 81 ILE MG 1 97 ARG HD3 3.455 . 5.110 4.272 3.721 5.332 0.222 2 0 "[ . 1 . 2]" 1
1499 1 82 SER H 1 83 THR HA 3.650 . 5.500 5.356 4.526 5.702 0.202 7 0 "[ . 1 . 2]" 1
1500 1 82 SER H 1 95 THR H 2.955 . 4.110 3.581 2.823 4.767 0.657 20 5 "[* . * 1 . - *+]" 1
1501 1 82 SER HA 1 83 THR HA 3.170 . 4.540 4.257 4.138 4.490 . 0 0 "[ . 1 . 2]" 1
1502 1 82 SER HA 1 83 THR HB 3.650 . 5.500 5.401 4.420 6.130 0.630 18 1 "[ . 1 . + 2]" 1
1503 1 82 SER HA 1 83 THR MG 3.490 . 5.180 4.193 3.429 5.501 0.321 2 0 "[ . 1 . 2]" 1
1504 1 82 SER HA 1 94 VAL QG 3.435 . 5.070 4.468 3.449 5.012 . 0 0 "[ . 1 . 2]" 1
1505 1 82 SER HA 1 95 THR H 3.505 . 5.210 4.605 3.447 5.412 0.202 2 0 "[ . 1 . 2]" 1
1506 1 82 SER HB2 1 94 VAL HA 2.375 . 2.950 2.753 2.075 3.326 0.376 15 0 "[ . 1 . 2]" 1
1507 1 82 SER HB2 1 94 VAL HB 3.650 . 5.500 3.529 2.253 4.341 . 0 0 "[ . 1 . 2]" 1
1508 1 82 SER HB2 1 94 VAL QG 2.830 . 3.860 2.415 1.917 3.033 . 0 0 "[ . 1 . 2]" 1
1509 1 82 SER HB2 1 95 THR H 2.825 . 3.850 3.545 2.978 4.350 0.500 19 1 "[ . 1 . +2]" 1
1510 1 82 SER HB3 1 94 VAL HA 3.010 . 4.220 3.951 2.891 4.379 0.159 17 0 "[ . 1 . 2]" 1
1511 1 82 SER HB3 1 94 VAL QG 3.020 . 4.240 2.706 2.107 3.374 . 0 0 "[ . 1 . 2]" 1
1512 1 83 THR HA 1 83 THR HB 2.240 . 2.680 2.661 2.471 3.013 0.333 7 0 "[ . 1 . 2]" 1
1513 1 83 THR HA 1 83 THR MG 2.550 . 3.300 2.307 2.163 2.440 . 0 0 "[ . 1 . 2]" 1
1514 1 84 ASN HA 1 85 ARG HA 3.200 . 4.600 4.415 4.208 4.999 0.399 4 0 "[ . 1 . 2]" 1
1515 1 84 ASN HA 1 85 ARG QB 3.245 . 4.690 4.180 3.924 4.420 . 0 0 "[ . 1 . 2]" 1
1516 1 85 ARG HA 1 85 ARG HD2 3.100 . 4.400 4.380 4.178 4.704 0.304 12 0 "[ . 1 . 2]" 1
1517 1 85 ARG HA 1 85 ARG QD 2.790 . 3.780 3.933 3.866 4.081 0.301 11 0 "[ . 1 . 2]" 1
1518 1 85 ARG HA 1 85 ARG HD3 3.100 . 4.400 4.503 4.178 4.679 0.279 11 0 "[ . 1 . 2]" 1
1519 1 85 ARG HA 1 85 ARG QG 2.675 . 3.550 2.422 2.279 3.293 . 0 0 "[ . 1 . 2]" 1
1520 1 85 ARG QB 1 85 ARG QD 2.555 . 3.310 2.144 1.988 2.343 . 0 0 "[ . 1 . 2]" 1
1521 1 85 ARG QG 1 86 GLU QG 2.650 . 3.500 2.867 1.767 4.068 0.568 18 2 "[ - 1 . + 2]" 1
1522 1 86 GLU H 1 87 ASN H 3.145 . 4.490 4.133 3.295 4.519 0.029 15 0 "[ . 1 . 2]" 1
1523 1 86 GLU H 1 87 ASN HA 3.375 . 4.950 4.864 4.370 5.251 0.301 14 0 "[ . 1 . 2]" 1
1524 1 86 GLU HA 1 86 GLU QG 2.635 . 3.470 2.799 2.298 3.440 . 0 0 "[ . 1 . 2]" 1
1525 1 86 GLU HB3 1 86 GLU QG 2.295 . 2.790 2.322 2.141 2.404 . 0 0 "[ . 1 . 2]" 1
1526 1 87 ASN H 1 87 ASN QB 2.670 . 3.540 2.364 2.170 2.691 . 0 0 "[ . 1 . 2]" 1
1527 1 87 ASN H 1 87 ASN QD 3.105 . 4.410 3.864 2.606 4.643 0.233 18 0 "[ . 1 . 2]" 1
1528 1 87 ASN HA 1 87 ASN HD21 2.935 . 4.070 3.012 1.736 4.253 0.183 4 0 "[ . 1 . 2]" 1
1529 1 87 ASN HA 1 87 ASN QD 2.675 . 3.550 2.839 1.731 3.851 0.301 4 0 "[ . 1 . 2]" 1
1530 1 87 ASN HA 1 87 ASN HD22 2.935 . 4.070 3.875 3.295 4.426 0.356 19 0 "[ . 1 . 2]" 1
1531 1 87 ASN HA 1 88 PHE H 2.320 . 2.840 2.242 2.066 2.677 . 0 0 "[ . 1 . 2]" 1
1532 1 87 ASN HA 1 88 PHE QD 3.275 . 4.750 3.805 3.123 4.479 . 0 0 "[ . 1 . 2]" 1
1533 1 87 ASN HA 1 92 SER QB 3.260 . 4.720 4.190 2.831 4.935 0.215 16 0 "[ . 1 . 2]" 1
1534 1 87 ASN QB 1 88 PHE H 2.690 . 3.580 3.010 1.777 3.810 0.230 5 0 "[ . 1 . 2]" 1
1535 1 87 ASN QB 1 92 SER QB 2.965 . 4.130 2.868 1.742 4.244 0.114 1 0 "[ . 1 . 2]" 1
1536 1 87 ASN HB2 1 88 PHE H 3.055 . 4.310 3.952 3.171 4.446 0.136 14 0 "[ . 1 . 2]" 1
1537 1 87 ASN HB3 1 88 PHE H 3.055 . 4.310 3.183 1.785 4.296 0.015 3 0 "[ . 1 . 2]" 1
1538 1 88 PHE H 1 88 PHE QB 2.520 . 3.240 2.469 2.304 3.139 . 0 0 "[ . 1 . 2]" 1
1539 1 88 PHE H 1 92 SER QB 2.925 . 4.050 3.750 2.911 4.853 0.803 10 1 "[ . + . 2]" 1
1540 1 88 PHE HA 1 88 PHE QD 2.750 . 3.700 2.842 1.925 3.752 0.052 17 0 "[ . 1 . 2]" 1
1541 1 89 HIS HA 1 90 TYR H 2.505 . 3.210 2.587 2.214 3.400 0.190 3 0 "[ . 1 . 2]" 1
1542 1 90 TYR H 1 90 TYR HB2 2.540 . 3.280 2.474 2.187 2.681 . 0 0 "[ . 1 . 2]" 1
1543 1 90 TYR H 1 90 TYR HB3 2.380 . 2.960 2.486 2.365 2.572 . 0 0 "[ . 1 . 2]" 1
1544 1 90 TYR H 1 90 TYR QD 3.025 . 4.250 4.159 4.024 4.218 . 0 0 "[ . 1 . 2]" 1
1545 1 90 TYR H 1 91 GLY H 3.205 . 4.610 4.474 2.714 4.626 0.016 13 0 "[ . 1 . 2]" 1
1546 1 90 TYR H 1 92 SER H 3.650 . 5.500 4.999 4.416 5.618 0.118 8 0 "[ . 1 . 2]" 1
1547 1 90 TYR H 1 118 CYS QB 3.570 . 5.340 4.753 3.620 5.799 0.459 3 0 "[ . 1 . 2]" 1
1548 1 90 TYR HA 1 90 TYR QD 2.970 . 4.140 2.794 2.453 2.992 . 0 0 "[ . 1 . 2]" 1
1549 1 90 TYR HA 1 91 GLY H 2.375 . 2.950 2.227 2.073 3.188 0.238 14 0 "[ . 1 . 2]" 1
1550 1 90 TYR HA 1 91 GLY HA2 3.465 . 5.130 4.448 4.352 4.553 . 0 0 "[ . 1 . 2]" 1
1551 1 90 TYR HA 1 91 GLY QA 3.100 . 4.400 3.960 3.887 4.237 . 0 0 "[ . 1 . 2]" 1
1552 1 90 TYR HA 1 91 GLY HA3 3.465 . 5.130 4.448 4.359 5.111 . 0 0 "[ . 1 . 2]" 1
1553 1 90 TYR HA 1 92 SER H 2.810 . 3.820 3.297 2.702 3.895 0.075 14 0 "[ . 1 . 2]" 1
1554 1 90 TYR HA 1 118 CYS HB2 3.185 . 4.570 3.082 1.871 4.604 0.034 3 0 "[ . 1 . 2]" 1
1555 1 90 TYR HA 1 118 CYS QB 2.835 . 3.870 2.380 1.534 3.350 0.266 14 0 "[ . 1 . 2]" 1
1556 1 90 TYR HA 1 118 CYS HB3 3.185 . 4.570 2.544 1.630 3.440 0.170 14 0 "[ . 1 . 2]" 1
1557 1 90 TYR HB2 1 91 GLY H 3.070 . 4.340 4.091 3.976 4.297 . 0 0 "[ . 1 . 2]" 1
1558 1 90 TYR HB3 1 91 GLY H 3.130 . 4.460 3.990 3.123 4.178 . 0 0 "[ . 1 . 2]" 1
1559 1 90 TYR HB3 1 91 GLY QA 3.440 . 5.080 4.387 3.750 4.608 . 0 0 "[ . 1 . 2]" 1
1560 1 90 TYR QD 1 91 GLY H 2.820 . 3.840 3.336 2.872 3.934 0.094 14 0 "[ . 1 . 2]" 1
1561 1 90 TYR QD 1 92 SER H 3.585 . 5.370 5.037 4.656 5.453 0.083 13 0 "[ . 1 . 2]" 1
1562 1 90 TYR QD 1 118 CYS HA 3.650 . 5.500 4.721 4.090 5.595 0.095 3 0 "[ . 1 . 2]" 1
1563 1 90 TYR QD 1 118 CYS QB 3.285 . 4.770 2.751 2.242 3.910 . 0 0 "[ . 1 . 2]" 1
1564 1 90 TYR QE 1 119 THR H 3.350 . 4.900 4.209 3.475 4.845 . 0 0 "[ . 1 . 2]" 1
1565 1 90 TYR QE 1 119 THR HA 2.675 . 3.550 2.763 2.066 3.577 0.027 5 0 "[ . 1 . 2]" 1
1566 1 90 TYR QE 1 120 SER H 2.545 . 3.290 2.914 1.861 3.761 0.471 2 0 "[ . 1 . 2]" 1
1567 1 90 TYR QE 1 120 SER QB 2.990 . 4.180 3.325 2.216 4.272 0.092 10 0 "[ . 1 . 2]" 1
1568 1 91 GLY H 1 92 SER H 2.510 . 3.220 2.351 2.177 2.527 . 0 0 "[ . 1 . 2]" 1
1569 1 91 GLY H 1 92 SER QB 3.180 . 4.560 4.371 3.859 4.803 0.243 12 0 "[ . 1 . 2]" 1
1570 1 91 GLY H 1 118 CYS H 3.020 . 4.240 3.762 2.965 5.011 0.771 14 1 "[ . 1 +. 2]" 1
1571 1 91 GLY H 1 118 CYS HB2 2.945 . 4.090 2.891 1.650 4.388 0.298 8 0 "[ . 1 . 2]" 1
1572 1 91 GLY H 1 118 CYS QB 2.665 . 3.530 2.206 1.638 3.529 0.162 13 0 "[ . 1 . 2]" 1
1573 1 91 GLY H 1 118 CYS HB3 2.945 . 4.090 2.711 2.009 4.616 0.526 14 1 "[ . 1 +. 2]" 1
1574 1 92 SER H 1 92 SER HB2 2.675 . 3.550 2.807 2.310 3.598 0.048 2 0 "[ . 1 . 2]" 1
1575 1 92 SER H 1 92 SER QB 2.370 . 2.940 2.461 2.221 2.846 . 0 0 "[ . 1 . 2]" 1
1576 1 92 SER H 1 92 SER HB3 2.675 . 3.550 3.095 2.391 3.719 0.169 11 0 "[ . 1 . 2]" 1
1577 1 92 SER H 1 93 VAL H 3.230 . 4.660 4.563 4.421 4.675 0.015 13 0 "[ . 1 . 2]" 1
1578 1 92 SER H 1 93 VAL QG 3.620 . 5.440 5.091 4.765 5.278 . 0 0 "[ . 1 . 2]" 1
1579 1 92 SER H 1 117 TYR HB2 3.285 . 4.770 4.738 3.780 5.050 0.280 9 0 "[ . 1 . 2]" 1
1580 1 92 SER H 1 118 CYS H 2.800 . 3.800 3.672 3.208 3.927 0.127 6 0 "[ . 1 . 2]" 1
1581 1 92 SER H 1 118 CYS HB2 2.935 . 4.070 3.309 2.517 4.180 0.110 6 0 "[ . 1 . 2]" 1
1582 1 92 SER H 1 118 CYS HB3 2.935 . 4.070 3.858 2.628 4.652 0.582 14 1 "[ . 1 +. 2]" 1
1583 1 92 SER HA 1 93 VAL H 2.275 . 2.750 2.284 2.125 2.436 . 0 0 "[ . 1 . 2]" 1
1584 1 92 SER HA 1 93 VAL QG 2.870 . 3.940 3.323 3.152 3.506 . 0 0 "[ . 1 . 2]" 1
1585 1 92 SER QB 1 93 VAL H 2.660 . 3.520 2.967 2.554 3.609 0.089 7 0 "[ . 1 . 2]" 1
1586 1 92 SER QB 1 94 VAL QG 3.540 . 5.280 3.911 3.337 4.709 . 0 0 "[ . 1 . 2]" 1
1587 1 92 SER QB 1 118 CYS H 3.225 . 4.650 4.296 3.409 4.927 0.277 2 0 "[ . 1 . 2]" 1
1588 1 92 SER HB2 1 93 VAL H 2.915 . 4.030 3.673 2.598 4.108 0.078 19 0 "[ . 1 . 2]" 1
1589 1 92 SER HB3 1 93 VAL H 2.915 . 4.030 3.394 2.667 4.096 0.066 20 0 "[ . 1 . 2]" 1
1590 1 93 VAL H 1 93 VAL HB 2.685 . 3.570 3.352 3.265 3.431 . 0 0 "[ . 1 . 2]" 1
1591 1 93 VAL H 1 93 VAL QG 2.535 . 3.270 2.191 2.030 2.320 . 0 0 "[ . 1 . 2]" 1
1592 1 93 VAL H 1 94 VAL H 3.555 . 5.310 4.337 4.251 4.507 . 0 0 "[ . 1 . 2]" 1
1593 1 93 VAL H 1 128 TRP HZ3 3.490 . 5.180 4.454 3.975 5.037 . 0 0 "[ . 1 . 2]" 1
1594 1 93 VAL HA 1 93 VAL MG1 2.640 . 3.480 3.204 3.175 3.233 . 0 0 "[ . 1 . 2]" 1
1595 1 93 VAL HA 1 93 VAL QG 2.380 . 2.960 2.404 2.369 2.442 . 0 0 "[ . 1 . 2]" 1
1596 1 93 VAL HA 1 93 VAL MG2 2.640 . 3.480 2.484 2.443 2.536 . 0 0 "[ . 1 . 2]" 1
1597 1 93 VAL HA 1 94 VAL H 2.325 . 2.850 2.213 2.129 2.295 . 0 0 "[ . 1 . 2]" 1
1598 1 93 VAL HA 1 94 VAL QG 3.080 . 4.360 3.328 3.156 3.632 . 0 0 "[ . 1 . 2]" 1
1599 1 93 VAL HA 1 116 ILE H 3.295 . 4.790 4.669 4.172 4.922 0.132 11 0 "[ . 1 . 2]" 1
1600 1 93 VAL HA 1 117 TYR HA 2.810 . 3.820 2.289 2.063 2.572 . 0 0 "[ . 1 . 2]" 1
1601 1 93 VAL HA 1 117 TYR HB2 3.145 . 4.490 3.472 2.928 3.857 . 0 0 "[ . 1 . 2]" 1
1602 1 93 VAL HA 1 117 TYR HB3 2.895 . 3.990 2.765 2.273 3.212 . 0 0 "[ . 1 . 2]" 1
1603 1 93 VAL HA 1 118 CYS H 2.980 . 4.160 3.874 3.615 4.242 0.082 4 0 "[ . 1 . 2]" 1
1604 1 93 VAL HA 1 128 TRP HZ3 3.405 . 5.010 2.411 1.995 2.824 . 0 0 "[ . 1 . 2]" 1
1605 1 93 VAL HB 1 94 VAL H 2.935 . 4.070 4.019 3.913 4.080 0.010 13 0 "[ . 1 . 2]" 1
1606 1 93 VAL QG 1 94 VAL H 2.440 . 3.080 2.412 2.209 2.485 . 0 0 "[ . 1 . 2]" 1
1607 1 93 VAL QG 1 94 VAL HA 2.745 . 3.690 3.265 3.111 3.405 . 0 0 "[ . 1 . 2]" 1
1608 1 93 VAL QG 1 94 VAL HB 3.620 . 5.440 4.846 4.493 4.925 . 0 0 "[ . 1 . 2]" 1
1609 1 93 VAL QG 1 95 THR H 3.235 . 4.670 4.252 3.763 4.471 . 0 0 "[ . 1 . 2]" 1
1610 1 93 VAL QG 1 95 THR HA 3.165 . 4.530 4.271 3.866 4.609 0.079 3 0 "[ . 1 . 2]" 1
1611 1 93 VAL QG 1 115 SER H 3.620 . 5.440 5.370 4.772 5.686 0.246 19 0 "[ . 1 . 2]" 1
1612 1 93 VAL QG 1 115 SER HA 2.940 . 4.080 3.651 3.300 3.961 . 0 0 "[ . 1 . 2]" 1
1613 1 93 VAL QG 1 115 SER QB 2.395 . 2.990 2.744 1.973 3.288 0.298 10 0 "[ . 1 . 2]" 1
1614 1 93 VAL QG 1 116 ILE H 2.665 . 3.530 3.124 2.694 3.493 . 0 0 "[ . 1 . 2]" 1
1615 1 93 VAL QG 1 116 ILE HA 3.080 . 4.360 3.889 3.616 4.156 . 0 0 "[ . 1 . 2]" 1
1616 1 93 VAL QG 1 117 TYR HA 2.845 . 3.890 3.363 3.210 3.604 . 0 0 "[ . 1 . 2]" 1
1617 1 93 VAL QG 1 117 TYR HB2 2.725 . 3.650 3.610 3.339 3.833 0.183 17 0 "[ . 1 . 2]" 1
1618 1 93 VAL QG 1 117 TYR HB3 2.530 . 3.260 2.360 2.100 2.624 . 0 0 "[ . 1 . 2]" 1
1619 1 93 VAL QG 1 117 TYR QD 2.955 . 4.110 3.036 2.631 3.258 . 0 0 "[ . 1 . 2]" 1
1620 1 93 VAL QG 1 118 CYS H 3.510 . 5.220 4.745 4.516 5.050 . 0 0 "[ . 1 . 2]" 1
1621 1 93 VAL QG 1 128 TRP HE3 3.605 . 5.410 4.849 4.517 5.046 . 0 0 "[ . 1 . 2]" 1
1622 1 93 VAL QG 1 128 TRP HZ3 2.985 . 4.170 3.961 3.574 4.351 0.181 14 0 "[ . 1 . 2]" 1
1623 1 93 VAL MG1 1 94 VAL HA 3.120 . 4.440 4.070 3.958 4.268 . 0 0 "[ . 1 . 2]" 1
1624 1 93 VAL MG1 1 117 TYR HA 3.330 . 4.860 4.770 4.584 4.946 0.086 5 0 "[ . 1 . 2]" 1
1625 1 93 VAL MG1 1 117 TYR HB2 3.160 . 4.520 4.367 4.007 4.538 0.018 17 0 "[ . 1 . 2]" 1
1626 1 93 VAL MG1 1 117 TYR HB3 2.760 . 3.720 3.727 3.542 3.859 0.139 10 0 "[ . 1 . 2]" 1
1627 1 93 VAL MG1 1 117 TYR QD 3.405 . 5.010 4.786 3.760 5.047 0.037 11 0 "[ . 1 . 2]" 1
1628 1 93 VAL MG1 1 128 TRP HZ3 3.585 . 5.370 5.079 4.726 5.433 0.063 8 0 "[ . 1 . 2]" 1
1629 1 93 VAL MG2 1 94 VAL HA 3.120 . 4.440 3.440 3.237 3.578 . 0 0 "[ . 1 . 2]" 1
1630 1 93 VAL MG2 1 117 TYR HA 3.330 . 4.860 3.439 3.261 3.710 . 0 0 "[ . 1 . 2]" 1
1631 1 93 VAL MG2 1 117 TYR HB2 3.160 . 4.520 3.851 3.574 4.132 . 0 0 "[ . 1 . 2]" 1
1632 1 93 VAL MG2 1 117 TYR HB3 2.760 . 3.720 2.387 2.114 2.672 . 0 0 "[ . 1 . 2]" 1
1633 1 93 VAL MG2 1 117 TYR QD 3.405 . 5.010 3.072 2.687 3.305 . 0 0 "[ . 1 . 2]" 1
1634 1 93 VAL MG2 1 128 TRP HZ3 3.585 . 5.370 4.139 3.673 4.588 . 0 0 "[ . 1 . 2]" 1
1635 1 94 VAL H 1 94 VAL HB 3.000 . 4.200 3.811 2.854 3.914 . 0 0 "[ . 1 . 2]" 1
1636 1 94 VAL H 1 94 VAL QG 2.720 . 3.640 2.199 2.073 2.686 . 0 0 "[ . 1 . 2]" 1
1637 1 94 VAL H 1 95 THR H 3.565 . 5.330 4.415 4.309 4.493 . 0 0 "[ . 1 . 2]" 1
1638 1 94 VAL H 1 96 TYR QE 3.650 . 5.500 5.167 4.707 5.530 0.030 13 0 "[ . 1 . 2]" 1
1639 1 94 VAL H 1 116 ILE H 2.910 . 4.020 3.103 2.647 3.418 . 0 0 "[ . 1 . 2]" 1
1640 1 94 VAL H 1 116 ILE HA 3.520 . 5.240 4.941 4.699 5.200 . 0 0 "[ . 1 . 2]" 1
1641 1 94 VAL H 1 116 ILE HG13 2.640 . 3.480 3.202 2.575 3.383 . 0 0 "[ . 1 . 2]" 1
1642 1 94 VAL H 1 117 TYR HA 2.895 . 3.990 3.554 3.352 3.922 . 0 0 "[ . 1 . 2]" 1
1643 1 94 VAL H 1 117 TYR HB2 3.650 . 5.500 5.341 4.896 5.678 0.178 4 0 "[ . 1 . 2]" 1
1644 1 94 VAL H 1 117 TYR HB3 3.200 . 4.600 4.200 3.712 4.493 . 0 0 "[ . 1 . 2]" 1
1645 1 94 VAL H 1 117 TYR QD 3.650 . 5.500 5.360 5.062 5.562 0.062 14 0 "[ . 1 . 2]" 1
1646 1 94 VAL H 1 128 TRP HH2 3.650 . 5.500 4.544 3.826 5.333 . 0 0 "[ . 1 . 2]" 1
1647 1 94 VAL H 1 128 TRP HZ3 3.095 . 4.390 2.911 2.351 3.725 . 0 0 "[ . 1 . 2]" 1
1648 1 94 VAL HA 1 94 VAL QG 2.640 . 3.480 2.295 2.169 2.360 . 0 0 "[ . 1 . 2]" 1
1649 1 94 VAL HA 1 95 THR H 2.295 . 2.790 2.289 2.123 2.434 . 0 0 "[ . 1 . 2]" 1
1650 1 94 VAL HB 1 95 THR H 2.800 . 3.800 2.734 2.396 3.915 0.115 17 0 "[ . 1 . 2]" 1
1651 1 94 VAL HB 1 95 THR HA 3.650 . 5.500 4.499 4.312 4.713 . 0 0 "[ . 1 . 2]" 1
1652 1 94 VAL HB 1 96 TYR QD 3.465 . 5.130 4.891 4.359 5.169 0.039 8 0 "[ . 1 . 2]" 1
1653 1 94 VAL HB 1 116 ILE MD 3.495 . 5.190 4.983 2.583 5.297 0.107 20 0 "[ . 1 . 2]" 1
1654 1 94 VAL QG 1 95 THR H 2.880 . 3.960 3.226 2.418 3.492 . 0 0 "[ . 1 . 2]" 1
1655 1 94 VAL QG 1 95 THR HA 3.425 . 5.050 3.726 3.500 4.016 . 0 0 "[ . 1 . 2]" 1
1656 1 94 VAL QG 1 96 TYR QD 3.155 . 4.510 3.493 3.009 3.753 . 0 0 "[ . 1 . 2]" 1
1657 1 94 VAL QG 1 96 TYR QE 2.785 . 3.770 2.504 1.864 3.257 . 0 0 "[ . 1 . 2]" 1
1658 1 94 VAL QG 1 116 ILE H 3.090 . 4.380 3.194 2.935 4.060 . 0 0 "[ . 1 . 2]" 1
1659 1 94 VAL QG 1 116 ILE MD 2.790 . 3.780 2.683 2.399 2.896 . 0 0 "[ . 1 . 2]" 1
1660 1 94 VAL QG 1 116 ILE HG12 3.415 . 5.030 2.574 2.366 3.398 . 0 0 "[ . 1 . 2]" 1
1661 1 94 VAL QG 1 116 ILE HG13 2.740 . 3.680 2.380 2.111 3.114 . 0 0 "[ . 1 . 2]" 1
1662 1 94 VAL QG 1 116 ILE MG 3.020 . 4.240 4.073 3.904 4.456 0.216 17 0 "[ . 1 . 2]" 1
1663 1 94 VAL QG 1 117 TYR HA 3.380 . 4.960 4.035 3.714 4.538 . 0 0 "[ . 1 . 2]" 1
1664 1 94 VAL QG 1 128 TRP HE3 3.320 . 4.840 3.707 3.165 4.407 . 0 0 "[ . 1 . 2]" 1
1665 1 94 VAL QG 1 128 TRP HZ2 3.600 . 5.400 4.047 3.345 5.034 . 0 0 "[ . 1 . 2]" 1
1666 1 94 VAL QG 1 128 TRP HZ3 2.975 . 4.150 2.664 2.021 3.443 . 0 0 "[ . 1 . 2]" 1
1667 1 94 VAL QG 1 132 ALA MB 3.325 . 4.850 4.697 4.251 4.978 0.128 17 0 "[ . 1 . 2]" 1
1668 1 95 THR H 1 95 THR HB 2.575 . 3.350 2.679 2.542 2.832 . 0 0 "[ . 1 . 2]" 1
1669 1 95 THR H 1 95 THR MG 3.090 . 4.380 3.865 3.792 3.933 . 0 0 "[ . 1 . 2]" 1
1670 1 95 THR HA 1 95 THR MG 2.615 . 3.430 2.398 2.306 2.451 . 0 0 "[ . 1 . 2]" 1
1671 1 95 THR HA 1 96 TYR H 2.330 . 2.860 2.179 2.096 2.250 . 0 0 "[ . 1 . 2]" 1
1672 1 95 THR HA 1 96 TYR QD 3.620 . 5.440 3.753 3.296 4.108 . 0 0 "[ . 1 . 2]" 1
1673 1 95 THR HA 1 114 PRO HB3 3.650 . 5.500 5.219 4.791 5.736 0.236 1 0 "[ . 1 . 2]" 1
1674 1 95 THR HA 1 115 SER H 3.240 . 4.680 4.346 3.912 4.683 0.003 19 0 "[ . 1 . 2]" 1
1675 1 95 THR HA 1 115 SER HA 2.580 . 3.360 2.085 1.838 2.406 . 0 0 "[ . 1 . 2]" 1
1676 1 95 THR HA 1 115 SER QB 2.900 . 4.000 3.459 2.802 3.768 . 0 0 "[ . 1 . 2]" 1
1677 1 95 THR HA 1 116 ILE H 2.840 . 3.880 3.399 3.099 3.601 . 0 0 "[ . 1 . 2]" 1
1678 1 95 THR HA 1 116 ILE HG13 3.650 . 5.500 5.587 5.332 5.694 0.194 8 0 "[ . 1 . 2]" 1
1679 1 95 THR HB 1 96 TYR H 3.090 . 4.380 4.147 4.049 4.249 . 0 0 "[ . 1 . 2]" 1
1680 1 95 THR HB 1 115 SER HA 3.430 . 5.060 4.699 4.436 4.949 . 0 0 "[ . 1 . 2]" 1
1681 1 95 THR MG 1 96 TYR H 2.635 . 3.470 2.597 2.413 2.802 . 0 0 "[ . 1 . 2]" 1
1682 1 95 THR MG 1 96 TYR HA 3.200 . 4.600 3.932 3.743 4.034 . 0 0 "[ . 1 . 2]" 1
1683 1 95 THR MG 1 97 ARG HA 3.130 . 4.460 4.470 4.253 4.743 0.283 15 0 "[ . 1 . 2]" 1
1684 1 95 THR MG 1 114 PRO HB2 2.865 . 3.930 2.236 1.814 2.618 . 0 0 "[ . 1 . 2]" 1
1685 1 95 THR MG 1 114 PRO HB3 2.910 . 4.020 3.630 3.190 4.040 0.020 2 0 "[ . 1 . 2]" 1
1686 1 95 THR MG 1 115 SER H 3.160 . 4.520 3.643 3.276 4.202 . 0 0 "[ . 1 . 2]" 1
1687 1 95 THR MG 1 115 SER HA 2.990 . 4.180 3.095 2.734 3.496 . 0 0 "[ . 1 . 2]" 1
1688 1 95 THR MG 1 115 SER QB 2.395 . 2.990 3.014 2.240 3.465 0.475 19 0 "[ . 1 . 2]" 1
1689 1 96 TYR H 1 96 TYR HB2 2.595 . 3.390 2.469 2.399 2.526 . 0 0 "[ . 1 . 2]" 1
1690 1 96 TYR H 1 96 TYR HB3 2.820 . 3.840 3.660 3.597 3.697 . 0 0 "[ . 1 . 2]" 1
1691 1 96 TYR H 1 96 TYR QD 2.610 . 3.420 2.711 2.316 2.925 . 0 0 "[ . 1 . 2]" 1
1692 1 96 TYR H 1 96 TYR QE 3.435 . 5.070 4.661 4.360 4.820 . 0 0 "[ . 1 . 2]" 1
1693 1 96 TYR H 1 97 ARG H 3.335 . 4.870 4.493 4.376 4.578 . 0 0 "[ . 1 . 2]" 1
1694 1 96 TYR H 1 97 ARG HA 3.625 . 5.450 5.146 4.947 5.379 . 0 0 "[ . 1 . 2]" 1
1695 1 96 TYR H 1 110 LEU MD1 3.545 . 5.290 4.290 3.875 5.099 . 0 0 "[ . 1 . 2]" 1
1696 1 96 TYR H 1 110 LEU QD 3.125 . 4.450 3.944 3.711 4.463 0.013 2 0 "[ . 1 . 2]" 1
1697 1 96 TYR H 1 110 LEU MD2 3.545 . 5.290 4.710 4.077 5.243 . 0 0 "[ . 1 . 2]" 1
1698 1 96 TYR H 1 114 PRO HA 2.890 . 3.980 3.436 3.161 3.686 . 0 0 "[ . 1 . 2]" 1
1699 1 96 TYR H 1 114 PRO HB3 3.020 . 4.240 3.674 3.097 4.243 0.003 1 0 "[ . 1 . 2]" 1
1700 1 96 TYR H 1 115 SER HA 2.865 . 3.930 3.440 2.975 3.913 . 0 0 "[ . 1 . 2]" 1
1701 1 96 TYR H 1 116 ILE H 3.415 . 5.030 4.662 4.245 5.086 0.056 15 0 "[ . 1 . 2]" 1
1702 1 96 TYR HA 1 96 TYR QD 3.130 . 4.460 2.768 2.536 3.060 . 0 0 "[ . 1 . 2]" 1
1703 1 96 TYR HA 1 97 ARG H 2.275 . 2.750 2.177 2.049 2.260 . 0 0 "[ . 1 . 2]" 1
1704 1 96 TYR HA 1 97 ARG QB 3.285 . 4.770 4.246 3.996 4.615 . 0 0 "[ . 1 . 2]" 1
1705 1 96 TYR HA 1 97 ARG QG 3.570 . 5.340 3.606 3.094 3.931 . 0 0 "[ . 1 . 2]" 1
1706 1 96 TYR HB2 1 97 ARG H 3.105 . 4.410 3.995 3.762 4.152 . 0 0 "[ . 1 . 2]" 1
1707 1 96 TYR HB2 1 97 ARG HA 3.505 . 5.210 4.780 4.494 5.034 . 0 0 "[ . 1 . 2]" 1
1708 1 96 TYR HB2 1 110 LEU MD1 2.870 . 3.940 2.930 2.429 3.556 . 0 0 "[ . 1 . 2]" 1
1709 1 96 TYR HB2 1 110 LEU QD 2.620 . 3.440 2.837 2.387 3.364 . 0 0 "[ . 1 . 2]" 1
1710 1 96 TYR HB2 1 110 LEU MD2 2.870 . 3.940 3.881 3.404 4.266 0.326 6 0 "[ . 1 . 2]" 1
1711 1 96 TYR HB2 1 114 PRO HA 3.190 . 4.580 3.127 2.811 3.441 . 0 0 "[ . 1 . 2]" 1
1712 1 96 TYR HB2 1 132 ALA HA 3.650 . 5.500 5.114 4.668 5.499 . 0 0 "[ . 1 . 2]" 1
1713 1 96 TYR HB3 1 97 ARG H 2.865 . 3.930 2.893 2.506 3.152 . 0 0 "[ . 1 . 2]" 1
1714 1 96 TYR HB3 1 110 LEU QD 2.820 . 3.840 3.235 2.584 3.851 0.011 9 0 "[ . 1 . 2]" 1
1715 1 96 TYR HB3 1 114 PRO HA 3.435 . 5.070 4.774 4.496 5.151 0.081 15 0 "[ . 1 . 2]" 1
1716 1 96 TYR QD 1 97 ARG H 3.095 . 4.390 3.722 3.236 4.156 . 0 0 "[ . 1 . 2]" 1
1717 1 96 TYR QD 1 110 LEU QD 3.375 . 4.950 4.161 3.806 4.549 . 0 0 "[ . 1 . 2]" 1
1718 1 96 TYR QD 1 116 ILE H 3.650 . 5.500 4.160 3.571 4.516 . 0 0 "[ . 1 . 2]" 1
1719 1 96 TYR QD 1 116 ILE HG12 3.295 . 4.790 3.166 2.570 3.416 . 0 0 "[ . 1 . 2]" 1
1720 1 96 TYR QD 1 116 ILE MG 2.880 . 3.960 3.458 2.917 3.805 . 0 0 "[ . 1 . 2]" 1
1721 1 96 TYR QD 1 132 ALA HA 3.360 . 4.920 3.740 3.267 4.517 . 0 0 "[ . 1 . 2]" 1
1722 1 96 TYR QD 1 132 ALA MB 2.800 . 3.800 3.619 3.296 3.993 0.193 13 0 "[ . 1 . 2]" 1
1723 1 96 TYR QE 1 116 ILE MD 2.725 . 3.650 1.935 1.786 2.139 0.014 17 0 "[ . 1 . 2]" 1
1724 1 96 TYR QE 1 116 ILE HG12 3.230 . 4.660 2.142 1.866 2.716 . 0 0 "[ . 1 . 2]" 1
1725 1 96 TYR QE 1 116 ILE HG13 3.265 . 4.730 3.248 2.861 3.581 . 0 0 "[ . 1 . 2]" 1
1726 1 96 TYR QE 1 116 ILE MG 2.805 . 3.810 3.351 2.511 3.844 0.034 5 0 "[ . 1 . 2]" 1
1727 1 96 TYR QE 1 132 ALA HA 3.505 . 5.210 3.144 2.814 3.927 . 0 0 "[ . 1 . 2]" 1
1728 1 96 TYR QE 1 132 ALA MB 2.725 . 3.650 3.130 2.751 3.665 0.015 6 0 "[ . 1 . 2]" 1
1729 1 97 ARG H 1 97 ARG QB 2.705 . 3.610 2.817 2.429 3.267 . 0 0 "[ . 1 . 2]" 1
1730 1 97 ARG H 1 97 ARG HD2 3.375 . 4.950 4.982 4.512 5.283 0.333 17 0 "[ . 1 . 2]" 1
1731 1 97 ARG H 1 97 ARG QD 3.015 . 4.230 4.246 3.954 4.564 0.334 4 0 "[ . 1 . 2]" 1
1732 1 97 ARG H 1 97 ARG HD3 3.375 . 4.950 4.650 4.136 5.197 0.247 4 0 "[ . 1 . 2]" 1
1733 1 97 ARG H 1 97 ARG HG2 3.015 . 4.230 2.976 2.308 4.113 . 0 0 "[ . 1 . 2]" 1
1734 1 97 ARG H 1 97 ARG QG 2.690 . 3.580 2.532 2.258 2.984 . 0 0 "[ . 1 . 2]" 1
1735 1 97 ARG H 1 97 ARG HG3 3.015 . 4.230 3.171 2.422 4.182 . 0 0 "[ . 1 . 2]" 1
1736 1 97 ARG H 1 110 LEU QD 3.520 . 5.240 4.047 3.269 4.705 . 0 0 "[ . 1 . 2]" 1
1737 1 97 ARG H 1 114 PRO HB3 3.650 . 5.500 5.602 5.354 5.915 0.415 18 0 "[ . 1 . 2]" 1
1738 1 97 ARG HA 1 97 ARG HD2 3.650 . 5.500 4.526 3.019 5.448 . 0 0 "[ . 1 . 2]" 1
1739 1 97 ARG HA 1 97 ARG QD 3.215 . 4.630 4.038 2.033 4.586 . 0 0 "[ . 1 . 2]" 1
1740 1 97 ARG HA 1 97 ARG HD3 3.650 . 5.500 4.652 2.067 5.572 0.072 12 0 "[ . 1 . 2]" 1
1741 1 97 ARG HA 1 97 ARG HG2 2.975 . 4.150 3.278 2.490 3.833 . 0 0 "[ . 1 . 2]" 1
1742 1 97 ARG HA 1 97 ARG HG3 2.975 . 4.150 3.550 2.935 3.872 . 0 0 "[ . 1 . 2]" 1
1743 1 97 ARG HA 1 98 CYS H 2.285 . 2.770 2.247 2.128 2.349 . 0 0 "[ . 1 . 2]" 1
1744 1 97 ARG HA 1 98 CYS HA 3.150 . 4.500 4.349 4.266 4.514 0.014 6 0 "[ . 1 . 2]" 1
1745 1 97 ARG HA 1 98 CYS HB2 3.625 . 5.450 4.496 4.343 4.638 . 0 0 "[ . 1 . 2]" 1
1746 1 97 ARG HA 1 110 LEU QD 2.620 . 3.440 2.819 1.821 3.516 0.076 9 0 "[ . 1 . 2]" 1
1747 1 97 ARG QB 1 97 ARG HD2 2.850 . 3.900 2.509 2.286 3.333 . 0 0 "[ . 1 . 2]" 1
1748 1 97 ARG QB 1 97 ARG QD 2.610 . 3.420 2.248 2.057 2.457 . 0 0 "[ . 1 . 2]" 1
1749 1 97 ARG QB 1 97 ARG HD3 2.850 . 3.900 2.795 2.309 3.308 . 0 0 "[ . 1 . 2]" 1
1750 1 97 ARG QB 1 97 ARG HG2 2.280 . 2.760 2.354 2.288 2.407 . 0 0 "[ . 1 . 2]" 1
1751 1 97 ARG QB 1 97 ARG HG3 2.280 . 2.760 2.310 2.124 2.357 . 0 0 "[ . 1 . 2]" 1
1752 1 97 ARG QB 1 98 CYS H 2.530 . 3.260 2.749 2.449 2.994 . 0 0 "[ . 1 . 2]" 1
1753 1 97 ARG QB 1 98 CYS HB2 3.225 . 4.650 4.813 4.493 4.957 0.307 7 0 "[ . 1 . 2]" 1
1754 1 97 ARG QG 1 98 CYS H 3.000 . 4.200 3.937 3.612 4.461 0.261 11 0 "[ . 1 . 2]" 1
1755 1 97 ARG HG2 1 98 CYS H 3.315 . 4.830 4.641 3.965 5.042 0.212 19 0 "[ . 1 . 2]" 1
1756 1 97 ARG HG3 1 98 CYS H 3.315 . 4.830 4.415 3.748 5.117 0.287 6 0 "[ . 1 . 2]" 1
1757 1 98 CYS H 1 98 CYS HB2 2.480 . 3.160 2.402 2.190 2.555 . 0 0 "[ . 1 . 2]" 1
1758 1 98 CYS H 1 98 CYS HB3 2.795 . 3.790 3.621 3.488 3.740 . 0 0 "[ . 1 . 2]" 1
1759 1 98 CYS H 1 110 LEU QD 2.745 . 3.690 3.198 2.303 3.820 0.130 15 0 "[ . 1 . 2]" 1
1760 1 98 CYS HA 1 99 ASN H 2.405 . 3.010 2.304 2.007 3.305 0.295 18 0 "[ . 1 . 2]" 1
1761 1 98 CYS HA 1 99 ASN HA 3.480 . 5.160 4.301 4.069 5.074 . 0 0 "[ . 1 . 2]" 1
1762 1 98 CYS HA 1 110 LEU QD 3.590 . 5.380 3.962 3.557 4.376 . 0 0 "[ . 1 . 2]" 1
1763 1 98 CYS HB2 1 99 ASN H 2.890 . 3.980 3.944 3.089 4.153 0.173 11 0 "[ . 1 . 2]" 1
1764 1 98 CYS HB2 1 108 PHE QD 3.220 . 4.640 4.171 2.211 4.854 0.214 9 0 "[ . 1 . 2]" 1
1765 1 98 CYS HB2 1 109 GLU HA 3.650 . 5.500 4.808 4.108 5.983 0.483 8 0 "[ . 1 . 2]" 1
1766 1 98 CYS HB2 1 110 LEU H 3.565 . 5.330 4.943 4.040 5.375 0.045 7 0 "[ . 1 . 2]" 1
1767 1 98 CYS HB2 1 110 LEU QD 3.140 . 4.480 3.772 3.275 4.276 . 0 0 "[ . 1 . 2]" 1
1768 1 98 CYS HB3 1 99 ASN H 2.665 . 3.530 2.953 2.494 3.836 0.306 18 0 "[ . 1 . 2]" 1
1769 1 98 CYS HB3 1 108 PHE QD 3.125 . 4.450 3.161 1.978 3.746 . 0 0 "[ . 1 . 2]" 1
1770 1 98 CYS HB3 1 110 LEU QD 3.425 . 5.050 4.367 4.040 4.668 . 0 0 "[ . 1 . 2]" 1
1771 1 99 ASN H 1 99 ASN HB2 2.855 . 3.910 2.830 2.063 3.721 . 0 0 "[ . 1 . 2]" 1
1772 1 99 ASN H 1 99 ASN QB 2.455 . 3.110 2.434 2.027 3.271 0.161 18 0 "[ . 1 . 2]" 1
1773 1 99 ASN H 1 99 ASN HB3 2.855 . 3.910 3.139 2.069 4.099 0.189 18 0 "[ . 1 . 2]" 1
1774 1 99 ASN H 1 99 ASN HD21 3.395 . 4.990 3.679 2.029 4.736 . 0 0 "[ . 1 . 2]" 1
1775 1 99 ASN H 1 99 ASN QD 3.025 . 4.250 3.469 2.021 4.314 0.064 18 0 "[ . 1 . 2]" 1
1776 1 99 ASN H 1 99 ASN HD22 3.395 . 4.990 4.459 3.316 5.381 0.391 7 0 "[ . 1 . 2]" 1
1777 1 99 ASN H 1 108 PHE QB 3.095 . 4.390 3.979 2.972 5.092 0.702 6 1 "[ .+ 1 . 2]" 1
1778 1 99 ASN H 1 108 PHE QD 2.955 . 4.110 3.579 2.340 4.496 0.386 18 0 "[ . 1 . 2]" 1
1779 1 99 ASN HA 1 100 PRO HA 3.125 . 4.450 4.441 4.365 4.511 0.061 8 0 "[ . 1 . 2]" 1
1780 1 99 ASN HA 1 100 PRO QB 3.360 . 4.920 4.596 4.450 4.737 . 0 0 "[ . 1 . 2]" 1
1781 1 99 ASN HA 1 100 PRO HD2 2.595 . 3.390 2.488 2.175 2.833 . 0 0 "[ . 1 . 2]" 1
1782 1 99 ASN HA 1 100 PRO HD3 2.595 . 3.390 2.036 1.765 2.497 0.035 9 0 "[ . 1 . 2]" 1
1783 1 99 ASN HA 1 100 PRO QG 2.970 . 4.140 3.819 3.560 4.117 . 0 0 "[ . 1 . 2]" 1
1784 1 99 ASN QB 1 100 PRO QD 2.635 . 3.470 2.749 1.830 3.555 0.085 13 0 "[ . 1 . 2]" 1
1785 1 99 ASN QB 1 108 PHE QD 3.005 . 4.210 3.975 2.507 4.934 0.724 15 2 "[ . - 1 + 2]" 1
1786 1 99 ASN HB2 1 100 PRO HD2 3.260 . 4.720 3.687 1.849 4.910 0.190 6 0 "[ . 1 . 2]" 1
1787 1 99 ASN HB2 1 100 PRO HD3 3.260 . 4.720 4.228 2.934 4.808 0.088 2 0 "[ . 1 . 2]" 1
1788 1 99 ASN HB3 1 100 PRO HD2 3.260 . 4.720 3.404 1.911 4.456 . 0 0 "[ . 1 . 2]" 1
1789 1 99 ASN HB3 1 100 PRO HD3 3.260 . 4.720 4.067 3.282 4.937 0.217 7 0 "[ . 1 . 2]" 1
1790 1 100 PRO HA 1 101 GLY H 2.655 . 3.510 2.368 2.149 3.356 . 0 0 "[ . 1 . 2]" 1
1791 1 100 PRO HA 1 106 LYS HA 2.745 . 3.690 2.805 1.864 3.697 0.007 8 0 "[ . 1 . 2]" 1
1792 1 100 PRO HA 1 106 LYS QG 3.570 . 5.340 4.447 3.118 5.500 0.160 12 0 "[ . 1 . 2]" 1
1793 1 100 PRO HA 1 107 VAL H 3.030 . 4.260 3.120 2.630 3.572 . 0 0 "[ . 1 . 2]" 1
1794 1 100 PRO HA 1 107 VAL MG1 3.215 . 4.630 4.231 3.011 5.169 0.539 20 1 "[ . 1 . +]" 1
1795 1 100 PRO HA 1 107 VAL QG 2.780 . 3.760 3.020 2.274 3.717 . 0 0 "[ . 1 . 2]" 1
1796 1 100 PRO HA 1 107 VAL MG2 3.215 . 4.630 3.150 2.353 4.012 . 0 0 "[ . 1 . 2]" 1
1797 1 100 PRO HA 1 108 PHE H 3.305 . 4.810 4.751 4.039 5.495 0.685 17 1 "[ . 1 . + 2]" 1
1798 1 100 PRO QB 1 101 GLY H 2.575 . 3.350 2.965 2.748 3.196 . 0 0 "[ . 1 . 2]" 1
1799 1 100 PRO QB 1 104 GLY QA 2.655 . 3.510 2.928 1.895 3.645 0.135 15 0 "[ . 1 . 2]" 1
1800 1 100 PRO QB 1 107 VAL QG 3.540 . 5.280 4.036 3.500 4.437 . 0 0 "[ . 1 . 2]" 1
1801 1 100 PRO HB2 1 101 GLY H 2.865 . 3.930 3.270 2.832 3.698 . 0 0 "[ . 1 . 2]" 1
1802 1 100 PRO HB3 1 101 GLY H 2.865 . 3.930 3.555 3.233 4.265 0.335 9 0 "[ . 1 . 2]" 1
1803 1 100 PRO QD 1 101 GLY H 3.380 . 4.960 4.745 2.692 5.013 0.053 14 0 "[ . 1 . 2]" 1
1804 1 100 PRO QG 1 104 GLY QA 3.570 . 5.340 3.735 2.515 4.963 . 0 0 "[ . 1 . 2]" 1
1805 1 101 GLY H 1 105 ARG H 3.430 . 5.060 3.919 2.562 5.030 . 0 0 "[ . 1 . 2]" 1
1806 1 101 GLY H 1 105 ARG QB 3.650 . 5.500 4.088 2.825 6.325 0.825 17 1 "[ . 1 . + 2]" 1
1807 1 101 GLY H 1 107 VAL HA 3.650 . 5.500 5.270 4.538 6.338 0.838 9 2 "[ . +1 . - 2]" 1
1808 1 101 GLY H 1 107 VAL HB 3.650 . 5.500 5.023 4.008 5.805 0.305 19 0 "[ . 1 . 2]" 1
1809 1 101 GLY QA 1 105 ARG QD 3.570 . 5.340 4.869 3.846 5.535 0.195 14 0 "[ . 1 . 2]" 1
1810 1 101 GLY QA 1 105 ARG QG 3.525 . 5.250 4.712 2.835 5.464 0.214 4 0 "[ . 1 . 2]" 1
1811 1 101 GLY QA 1 107 VAL HB 3.140 . 4.480 4.240 3.655 4.657 0.177 1 0 "[ . 1 . 2]" 1
1812 1 101 GLY QA 1 107 VAL QG 2.435 . 3.070 2.019 1.534 2.338 0.266 19 0 "[ . 1 . 2]" 1
1813 1 105 ARG H 1 105 ARG QG 3.370 . 4.940 3.356 2.284 4.104 . 0 0 "[ . 1 . 2]" 1
1814 1 105 ARG HA 1 105 ARG QB 2.385 . 2.970 2.317 2.119 2.413 . 0 0 "[ . 1 . 2]" 1
1815 1 105 ARG HA 1 105 ARG QD 3.075 . 4.350 4.193 3.951 4.500 0.150 14 0 "[ . 1 . 2]" 1
1816 1 105 ARG HA 1 105 ARG QG 2.615 . 3.430 2.635 2.324 3.381 . 0 0 "[ . 1 . 2]" 1
1817 1 105 ARG HA 1 107 VAL QG 3.460 . 5.120 4.715 3.852 5.494 0.374 19 0 "[ . 1 . 2]" 1
1818 1 105 ARG QB 1 105 ARG QD 2.550 . 3.300 2.235 2.057 2.363 . 0 0 "[ . 1 . 2]" 1
1819 1 105 ARG QB 1 105 ARG QG 2.100 . 2.400 2.081 2.031 2.118 . 0 0 "[ . 1 . 2]" 1
1820 1 105 ARG QB 1 107 VAL QG 2.970 . 4.140 3.160 1.911 4.138 . 0 0 "[ . 1 . 2]" 1
1821 1 105 ARG QD 1 105 ARG QG 2.350 . 2.900 2.034 1.978 2.096 . 0 0 "[ . 1 . 2]" 1
1822 1 105 ARG QD 1 107 VAL MG1 3.590 . 5.380 3.337 2.330 5.403 0.023 13 0 "[ . 1 . 2]" 1
1823 1 105 ARG QD 1 107 VAL QG 3.040 . 4.280 3.191 2.321 4.313 0.033 20 0 "[ . 1 . 2]" 1
1824 1 105 ARG QD 1 107 VAL MG2 3.590 . 5.380 5.024 3.766 5.614 0.234 19 0 "[ . 1 . 2]" 1
1825 1 105 ARG QG 1 107 VAL MG1 3.260 . 4.720 3.267 2.294 4.862 0.142 20 0 "[ . 1 . 2]" 1
1826 1 105 ARG QG 1 107 VAL QG 2.780 . 3.760 3.070 2.284 3.869 0.109 20 0 "[ . 1 . 2]" 1
1827 1 105 ARG QG 1 107 VAL MG2 3.260 . 4.720 4.596 2.597 5.279 0.559 4 1 "[ +. 1 . 2]" 1
1828 1 106 LYS H 1 106 LYS QB 2.710 . 3.620 2.349 2.080 3.061 . 0 0 "[ . 1 . 2]" 1
1829 1 106 LYS HA 1 106 LYS QD 3.190 . 4.580 3.617 1.952 4.182 . 0 0 "[ . 1 . 2]" 1
1830 1 106 LYS HA 1 106 LYS HG2 2.920 . 4.040 3.065 2.335 3.815 . 0 0 "[ . 1 . 2]" 1
1831 1 106 LYS HA 1 106 LYS QG 2.615 . 3.430 2.512 2.235 2.934 . 0 0 "[ . 1 . 2]" 1
1832 1 106 LYS HA 1 106 LYS HG3 2.920 . 4.040 2.784 2.388 3.922 . 0 0 "[ . 1 . 2]" 1
1833 1 106 LYS HA 1 107 VAL H 2.290 . 2.780 2.118 1.867 2.287 . 0 0 "[ . 1 . 2]" 1
1834 1 106 LYS HA 1 107 VAL MG1 3.520 . 5.240 4.000 3.631 5.399 0.159 20 0 "[ . 1 . 2]" 1
1835 1 106 LYS HA 1 107 VAL QG 3.145 . 4.490 3.314 2.994 3.522 . 0 0 "[ . 1 . 2]" 1
1836 1 106 LYS HA 1 107 VAL MG2 3.520 . 5.240 3.598 3.181 4.031 . 0 0 "[ . 1 . 2]" 1
1837 1 106 LYS HA 1 108 PHE H 2.760 . 3.720 3.312 2.870 3.772 0.052 6 0 "[ . 1 . 2]" 1
1838 1 106 LYS QB 1 106 LYS QD 2.095 . 2.390 2.166 2.053 2.333 . 0 0 "[ . 1 . 2]" 1
1839 1 106 LYS QB 1 106 LYS QE 2.970 . 4.140 3.410 1.990 3.630 . 0 0 "[ . 1 . 2]" 1
1840 1 106 LYS QB 1 107 VAL H 2.870 . 3.940 3.686 2.848 3.971 0.031 16 0 "[ . 1 . 2]" 1
1841 1 106 LYS QB 1 108 PHE H 2.705 . 3.610 3.781 2.467 4.317 0.707 13 5 "[ . -*1* + . *2]" 1
1842 1 106 LYS QD 1 106 LYS QE 2.265 . 2.730 2.064 2.008 2.115 . 0 0 "[ . 1 . 2]" 1
1843 1 106 LYS QD 1 106 LYS HG2 2.385 . 2.970 2.342 2.167 2.390 . 0 0 "[ . 1 . 2]" 1
1844 1 106 LYS QD 1 106 LYS HG3 2.385 . 2.970 2.352 2.312 2.388 . 0 0 "[ . 1 . 2]" 1
1845 1 106 LYS QD 1 108 PHE H 3.650 . 5.500 4.323 2.945 5.208 . 0 0 "[ . 1 . 2]" 1
1846 1 106 LYS QE 1 106 LYS HG2 2.760 . 3.720 2.548 2.267 3.295 . 0 0 "[ . 1 . 2]" 1
1847 1 106 LYS QE 1 106 LYS HG3 2.760 . 3.720 2.486 2.296 2.901 . 0 0 "[ . 1 . 2]" 1
1848 1 106 LYS QE 1 107 VAL QG 3.620 . 5.440 5.624 4.862 6.353 0.913 5 3 "[- *+ 1 . 2]" 1
1849 1 106 LYS QG 1 107 VAL H 3.020 . 4.240 3.434 2.738 4.339 0.099 14 0 "[ . 1 . 2]" 1
1850 1 106 LYS QG 1 107 VAL HA 3.500 . 5.200 4.572 3.788 5.714 0.514 14 1 "[ . 1 +. 2]" 1
1851 1 106 LYS QG 1 107 VAL QG 3.180 . 4.560 4.244 3.947 4.862 0.302 14 0 "[ . 1 . 2]" 1
1852 1 106 LYS QG 1 108 PHE H 3.055 . 4.310 2.884 2.140 4.398 0.088 14 0 "[ . 1 . 2]" 1
1853 1 106 LYS HG2 1 107 VAL H 3.320 . 4.840 3.925 3.126 5.120 0.280 19 0 "[ . 1 . 2]" 1
1854 1 106 LYS HG2 1 108 PHE H 3.475 . 5.150 3.272 2.170 5.162 0.012 14 0 "[ . 1 . 2]" 1
1855 1 106 LYS HG3 1 107 VAL H 3.320 . 4.840 3.992 3.026 5.021 0.181 14 0 "[ . 1 . 2]" 1
1856 1 106 LYS HG3 1 108 PHE H 3.475 . 5.150 3.671 2.595 5.365 0.215 4 0 "[ . 1 . 2]" 1
1857 1 107 VAL H 1 108 PHE H 2.350 . 2.900 2.169 1.866 2.496 . 0 0 "[ . 1 . 2]" 1
1858 1 107 VAL H 1 108 PHE QB 3.145 . 4.490 4.100 3.620 5.163 0.673 6 1 "[ .+ 1 . 2]" 1
1859 1 107 VAL H 1 108 PHE QD 3.380 . 4.960 3.679 2.289 4.901 . 0 0 "[ . 1 . 2]" 1
1860 1 107 VAL HA 1 107 VAL QG 2.405 . 3.010 2.229 2.032 2.329 . 0 0 "[ . 1 . 2]" 1
1861 1 107 VAL HA 1 108 PHE H 2.500 . 3.200 3.219 3.041 3.424 0.224 20 0 "[ . 1 . 2]" 1
1862 1 107 VAL HA 1 108 PHE QD 3.530 . 5.260 5.148 4.741 5.506 0.246 16 0 "[ . 1 . 2]" 1
1863 1 107 VAL QG 1 108 PHE HA 3.035 . 4.270 3.742 3.252 4.182 . 0 0 "[ . 1 . 2]" 1
1864 1 107 VAL QG 1 108 PHE QB 3.110 . 4.420 3.457 2.443 4.485 0.065 8 0 "[ . 1 . 2]" 1
1865 1 107 VAL QG 1 108 PHE QD 3.085 . 4.370 2.635 2.032 3.522 . 0 0 "[ . 1 . 2]" 1
1866 1 107 VAL MG1 1 108 PHE HA 3.650 . 5.500 5.315 3.755 5.581 0.081 12 0 "[ . 1 . 2]" 1
1867 1 107 VAL MG1 1 108 PHE QD 3.650 . 5.500 4.688 3.182 5.560 0.060 8 0 "[ . 1 . 2]" 1
1868 1 107 VAL MG2 1 108 PHE HA 3.650 . 5.500 3.979 3.277 5.540 0.040 13 0 "[ . 1 . 2]" 1
1869 1 107 VAL MG2 1 108 PHE QD 3.650 . 5.500 2.727 2.035 4.435 . 0 0 "[ . 1 . 2]" 1
1870 1 108 PHE H 1 108 PHE HB2 2.795 . 3.790 2.880 2.393 3.841 0.051 15 0 "[ . 1 . 2]" 1
1871 1 108 PHE H 1 108 PHE QB 2.375 . 2.950 2.693 2.361 3.223 0.273 6 0 "[ . 1 . 2]" 1
1872 1 108 PHE H 1 108 PHE HB3 2.795 . 3.790 3.663 3.140 3.916 0.126 13 0 "[ . 1 . 2]" 1
1873 1 108 PHE H 1 108 PHE QD 2.835 . 3.870 3.296 2.762 3.659 . 0 0 "[ . 1 . 2]" 1
1874 1 108 PHE H 1 109 GLU H 3.220 . 4.640 4.306 2.579 4.532 . 0 0 "[ . 1 . 2]" 1
1875 1 108 PHE H 1 109 GLU HA 3.495 . 5.190 4.934 4.366 5.263 0.073 9 0 "[ . 1 . 2]" 1
1876 1 108 PHE HA 1 108 PHE QD 2.795 . 3.790 2.781 2.178 3.752 . 0 0 "[ . 1 . 2]" 1
1877 1 108 PHE HA 1 109 GLU H 2.265 . 2.730 2.270 2.114 3.366 0.636 8 1 "[ . + 1 . 2]" 1
1878 1 108 PHE HA 1 135 CYS QB 3.270 . 4.740 4.002 2.963 4.950 0.210 6 0 "[ . 1 . 2]" 1
1879 1 108 PHE QB 1 109 GLU H 2.500 . 3.200 2.650 2.144 3.326 0.126 16 0 "[ . 1 . 2]" 1
1880 1 108 PHE QB 1 135 CYS HA 3.100 . 4.400 3.959 3.280 4.596 0.196 6 0 "[ . 1 . 2]" 1
1881 1 108 PHE QB 1 135 CYS QB 2.660 . 3.520 2.149 1.698 3.964 0.444 8 0 "[ . 1 . 2]" 1
1882 1 108 PHE QD 1 109 GLU H 2.845 . 3.890 3.622 3.016 3.980 0.090 6 0 "[ . 1 . 2]" 1
1883 1 109 GLU H 1 109 GLU HB2 2.895 . 3.990 2.618 2.257 3.177 . 0 0 "[ . 1 . 2]" 1
1884 1 109 GLU H 1 109 GLU QB 2.465 . 3.130 2.451 2.209 3.033 . 0 0 "[ . 1 . 2]" 1
1885 1 109 GLU H 1 109 GLU HB3 2.895 . 3.990 3.381 2.387 3.843 . 0 0 "[ . 1 . 2]" 1
1886 1 109 GLU H 1 109 GLU QG 2.985 . 4.170 3.067 2.243 4.088 . 0 0 "[ . 1 . 2]" 1
1887 1 109 GLU H 1 110 LEU H 3.290 . 4.780 4.390 3.503 4.573 . 0 0 "[ . 1 . 2]" 1
1888 1 109 GLU H 1 135 CYS HA 3.160 . 4.520 4.340 3.690 5.091 0.571 8 1 "[ . + 1 . 2]" 1
1889 1 109 GLU HA 1 110 LEU H 2.200 . 2.600 2.304 2.126 2.542 . 0 0 "[ . 1 . 2]" 1
1890 1 109 GLU QB 1 110 LEU H 2.905 . 4.010 3.095 2.396 3.862 . 0 0 "[ . 1 . 2]" 1
1891 1 109 GLU QG 1 110 LEU H 2.985 . 4.170 3.705 2.349 4.692 0.522 8 1 "[ . + 1 . 2]" 1
1892 1 110 LEU H 1 110 LEU HB2 2.440 . 3.080 2.842 2.539 3.098 0.018 1 0 "[ . 1 . 2]" 1
1893 1 110 LEU H 1 110 LEU QB 2.230 . 2.660 2.450 2.234 2.694 0.034 1 0 "[ . 1 . 2]" 1
1894 1 110 LEU H 1 110 LEU HB3 2.440 . 3.080 2.682 2.462 2.961 . 0 0 "[ . 1 . 2]" 1
1895 1 110 LEU H 1 110 LEU QD 2.970 . 4.140 3.858 3.749 4.032 . 0 0 "[ . 1 . 2]" 1
1896 1 110 LEU H 1 110 LEU HG 3.140 . 4.480 4.576 4.435 4.722 0.242 1 0 "[ . 1 . 2]" 1
1897 1 110 LEU H 1 111 VAL H 3.445 . 5.090 4.487 4.372 4.625 . 0 0 "[ . 1 . 2]" 1
1898 1 110 LEU H 1 112 GLY H 3.650 . 5.500 5.394 4.658 5.968 0.468 14 0 "[ . 1 . 2]" 1
1899 1 110 LEU HA 1 110 LEU MD1 2.810 . 3.820 3.200 2.162 3.646 . 0 0 "[ . 1 . 2]" 1
1900 1 110 LEU HA 1 110 LEU QD 2.500 . 3.200 2.814 2.151 3.057 . 0 0 "[ . 1 . 2]" 1
1901 1 110 LEU HA 1 110 LEU MD2 2.810 . 3.820 3.441 3.133 3.878 0.058 15 0 "[ . 1 . 2]" 1
1902 1 110 LEU HA 1 110 LEU HG 2.715 . 3.630 2.527 2.353 3.077 . 0 0 "[ . 1 . 2]" 1
1903 1 110 LEU HA 1 111 VAL H 2.370 . 2.940 2.353 2.212 2.502 . 0 0 "[ . 1 . 2]" 1
1904 1 110 LEU HA 1 111 VAL QG 3.215 . 4.630 3.719 3.380 4.314 . 0 0 "[ . 1 . 2]" 1
1905 1 110 LEU HA 1 134 GLN H 3.345 . 4.890 4.959 3.819 5.306 0.416 13 0 "[ . 1 . 2]" 1
1906 1 110 LEU HA 1 135 CYS HA 2.690 . 3.580 2.072 1.722 2.370 0.078 15 0 "[ . 1 . 2]" 1
1907 1 110 LEU HA 1 136 ILE H 2.515 . 3.230 2.967 2.664 3.354 0.124 15 0 "[ . 1 . 2]" 1
1908 1 110 LEU HA 1 136 ILE QG 3.570 . 5.340 5.060 3.940 5.567 0.227 15 0 "[ . 1 . 2]" 1
1909 1 110 LEU QB 1 110 LEU QD 2.170 . 2.540 1.892 1.848 1.940 . 0 0 "[ . 1 . 2]" 1
1910 1 110 LEU QB 1 111 VAL H 2.820 . 3.840 3.345 3.171 3.588 . 0 0 "[ . 1 . 2]" 1
1911 1 110 LEU QB 1 111 VAL QG 3.250 . 4.700 4.356 3.794 4.612 . 0 0 "[ . 1 . 2]" 1
1912 1 110 LEU QD 1 111 VAL H 2.690 . 3.580 2.141 1.708 2.727 0.092 1 0 "[ . 1 . 2]" 1
1913 1 110 LEU QD 1 111 VAL HA 3.015 . 4.230 3.938 3.606 4.488 0.258 3 0 "[ . 1 . 2]" 1
1914 1 110 LEU QD 1 111 VAL QG 2.540 . 3.280 2.862 1.827 3.384 0.104 4 0 "[ . 1 . 2]" 1
1915 1 110 LEU QD 1 112 GLY H 2.750 . 3.700 2.368 1.652 4.160 0.460 20 0 "[ . 1 . 2]" 1
1916 1 110 LEU QD 1 112 GLY QA 3.080 . 4.360 3.323 2.814 4.002 . 0 0 "[ . 1 . 2]" 1
1917 1 110 LEU QD 1 113 GLU H 3.100 . 4.400 3.063 2.667 4.075 . 0 0 "[ . 1 . 2]" 1
1918 1 110 LEU QD 1 113 GLU HA 3.310 . 4.820 4.207 3.627 4.896 0.076 20 0 "[ . 1 . 2]" 1
1919 1 110 LEU QD 1 114 PRO HA 2.500 . 3.200 2.266 1.967 2.822 . 0 0 "[ . 1 . 2]" 1
1920 1 110 LEU QD 1 114 PRO HB2 2.615 . 3.430 3.079 2.971 3.174 . 0 0 "[ . 1 . 2]" 1
1921 1 110 LEU QD 1 114 PRO HB3 2.520 . 3.240 1.851 1.709 1.987 0.091 15 0 "[ . 1 . 2]" 1
1922 1 110 LEU QD 1 114 PRO QD 2.870 . 3.940 2.445 1.961 2.901 . 0 0 "[ . 1 . 2]" 1
1923 1 110 LEU QD 1 114 PRO QG 2.555 . 3.310 2.699 2.106 3.164 . 0 0 "[ . 1 . 2]" 1
1924 1 110 LEU QD 1 115 SER H 3.295 . 4.790 4.493 4.183 4.744 . 0 0 "[ . 1 . 2]" 1
1925 1 110 LEU QD 1 133 PRO HA 3.385 . 4.970 4.297 4.063 4.692 . 0 0 "[ . 1 . 2]" 1
1926 1 110 LEU QD 1 133 PRO QB 2.335 . 2.870 2.132 1.896 2.568 . 0 0 "[ . 1 . 2]" 1
1927 1 110 LEU QD 1 133 PRO HD3 3.210 . 4.620 4.821 4.437 5.245 0.625 15 1 "[ . 1 + 2]" 1
1928 1 110 LEU QD 1 134 GLN H 2.895 . 3.990 3.873 3.351 4.277 0.287 4 0 "[ . 1 . 2]" 1
1929 1 110 LEU QD 1 134 GLN HA 3.030 . 4.260 3.906 2.837 4.787 0.527 1 1 "[+ . 1 . 2]" 1
1930 1 110 LEU QD 1 135 CYS H 3.455 . 5.110 4.389 3.438 5.063 . 0 0 "[ . 1 . 2]" 1
1931 1 110 LEU QD 1 135 CYS HA 3.075 . 4.350 3.544 2.618 4.038 . 0 0 "[ . 1 . 2]" 1
1932 1 110 LEU MD1 1 114 PRO HA 2.780 . 3.760 3.094 2.623 3.648 . 0 0 "[ . 1 . 2]" 1
1933 1 110 LEU MD1 1 114 PRO HB2 2.905 . 4.010 3.601 3.115 4.242 0.232 15 0 "[ . 1 . 2]" 1
1934 1 110 LEU MD1 1 114 PRO HB3 2.775 . 3.750 2.394 1.843 2.918 . 0 0 "[ . 1 . 2]" 1
1935 1 110 LEU MD1 1 114 PRO QG 2.840 . 3.880 3.757 3.246 4.238 0.358 9 0 "[ . 1 . 2]" 1
1936 1 110 LEU MD2 1 114 PRO HA 2.780 . 3.760 2.350 2.032 3.197 . 0 0 "[ . 1 . 2]" 1
1937 1 110 LEU MD2 1 114 PRO HB2 2.905 . 4.010 3.481 3.101 3.925 . 0 0 "[ . 1 . 2]" 1
1938 1 110 LEU MD2 1 114 PRO HB3 2.775 . 3.750 2.074 1.722 2.563 0.078 15 0 "[ . 1 . 2]" 1
1939 1 110 LEU MD2 1 114 PRO QG 2.840 . 3.880 2.836 2.111 3.454 . 0 0 "[ . 1 . 2]" 1
1940 1 110 LEU HG 1 111 VAL H 2.815 . 3.830 2.201 1.604 2.853 0.196 9 0 "[ . 1 . 2]" 1
1941 1 110 LEU HG 1 111 VAL QG 2.795 . 3.790 3.256 2.094 3.902 0.112 10 0 "[ . 1 . 2]" 1
1942 1 110 LEU HG 1 114 PRO HA 3.245 . 4.690 4.496 4.042 4.822 0.132 13 0 "[ . 1 . 2]" 1
1943 1 110 LEU HG 1 114 PRO HB3 3.330 . 4.860 4.237 3.554 4.539 . 0 0 "[ . 1 . 2]" 1
1944 1 110 LEU HG 1 133 PRO QB 2.890 . 3.980 3.114 2.667 3.805 . 0 0 "[ . 1 . 2]" 1
1945 1 110 LEU HG 1 134 GLN HA 3.250 . 4.700 4.488 2.762 5.362 0.662 15 2 "[ . 1 +- 2]" 1
1946 1 110 LEU HG 1 135 CYS HA 3.440 . 5.080 3.699 3.253 4.617 . 0 0 "[ . 1 . 2]" 1
1947 1 111 VAL H 1 111 VAL HB 2.535 . 3.270 2.563 2.144 3.594 0.324 2 0 "[ . 1 . 2]" 1
1948 1 111 VAL H 1 111 VAL QG 2.455 . 3.110 2.100 1.799 2.568 0.001 17 0 "[ . 1 . 2]" 1
1949 1 111 VAL H 1 112 GLY H 3.195 . 4.590 3.168 2.675 4.529 . 0 0 "[ . 1 . 2]" 1
1950 1 111 VAL H 1 114 PRO HB3 3.650 . 5.500 5.685 5.540 5.861 0.361 1 0 "[ . 1 . 2]" 1
1951 1 111 VAL H 1 133 PRO QB 2.705 . 3.610 3.351 3.015 3.810 0.200 9 0 "[ . 1 . 2]" 1
1952 1 111 VAL H 1 134 GLN H 2.705 . 3.610 3.548 2.544 3.857 0.247 18 0 "[ . 1 . 2]" 1
1953 1 111 VAL H 1 134 GLN HG3 3.650 . 5.500 5.128 4.615 5.924 0.424 8 0 "[ . 1 . 2]" 1
1954 1 111 VAL H 1 135 CYS HA 3.040 . 4.280 3.811 3.395 4.224 . 0 0 "[ . 1 . 2]" 1
1955 1 111 VAL H 1 136 ILE H 2.695 . 3.590 3.516 2.891 3.805 0.215 8 0 "[ . 1 . 2]" 1
1956 1 111 VAL HA 1 111 VAL QG 2.380 . 2.960 2.206 2.115 2.463 . 0 0 "[ . 1 . 2]" 1
1957 1 111 VAL HA 1 113 GLU H 3.530 . 5.260 4.870 4.221 5.257 . 0 0 "[ . 1 . 2]" 1
1958 1 111 VAL HA 1 134 GLN H 3.535 . 5.270 5.133 4.542 5.547 0.277 20 0 "[ . 1 . 2]" 1
1959 1 111 VAL HA 1 136 ILE HB 3.005 . 4.210 3.709 2.448 4.610 0.400 19 0 "[ . 1 . 2]" 1
1960 1 111 VAL HB 1 112 GLY H 2.940 . 4.080 3.424 2.536 4.094 0.014 17 0 "[ . 1 . 2]" 1
1961 1 111 VAL HB 1 113 GLU H 3.210 . 4.620 3.841 2.660 5.017 0.397 3 0 "[ . 1 . 2]" 1
1962 1 111 VAL HB 1 134 GLN H 2.725 . 3.650 3.341 1.940 4.349 0.699 17 2 "[ - . 1 . + 2]" 1
1963 1 111 VAL QG 1 112 GLY H 2.600 . 3.400 2.657 2.099 3.153 . 0 0 "[ . 1 . 2]" 1
1964 1 111 VAL QG 1 112 GLY HA2 3.215 . 4.630 4.165 3.872 4.361 . 0 0 "[ . 1 . 2]" 1
1965 1 111 VAL QG 1 112 GLY QA 2.890 . 3.980 3.309 3.120 3.692 . 0 0 "[ . 1 . 2]" 1
1966 1 111 VAL QG 1 112 GLY HA3 3.215 . 4.630 3.487 3.273 4.014 . 0 0 "[ . 1 . 2]" 1
1967 1 111 VAL QG 1 133 PRO HA 2.870 . 3.940 2.892 2.366 3.521 . 0 0 "[ . 1 . 2]" 1
1968 1 111 VAL QG 1 134 GLN H 2.860 . 3.920 2.197 1.797 3.013 0.003 17 0 "[ . 1 . 2]" 1
1969 1 111 VAL QG 1 134 GLN HA 3.125 . 4.450 4.209 3.678 4.680 0.230 13 0 "[ . 1 . 2]" 1
1970 1 111 VAL QG 1 134 GLN HG2 3.405 . 5.010 3.260 2.336 5.279 0.269 3 0 "[ . 1 . 2]" 1
1971 1 111 VAL QG 1 134 GLN HG3 3.515 . 5.230 3.373 2.637 4.460 . 0 0 "[ . 1 . 2]" 1
1972 1 111 VAL QG 1 135 CYS H 3.490 . 5.180 4.887 4.316 5.418 0.238 13 0 "[ . 1 . 2]" 1
1973 1 111 VAL QG 1 135 CYS HA 3.210 . 4.620 4.410 3.950 4.870 0.250 15 0 "[ . 1 . 2]" 1
1974 1 111 VAL QG 1 136 ILE H 2.545 . 3.290 3.306 2.695 3.931 0.641 3 3 "[ + - *1 . 2]" 1
1975 1 111 VAL QG 1 136 ILE HB 2.555 . 3.310 2.878 2.139 3.394 0.084 20 0 "[ . 1 . 2]" 1
1976 1 112 GLY H 1 113 GLU H 2.820 . 3.840 2.425 1.820 3.485 . 0 0 "[ . 1 . 2]" 1
1977 1 112 GLY QA 1 113 GLU H 2.390 . 2.980 2.860 2.806 2.958 . 0 0 "[ . 1 . 2]" 1
1978 1 113 GLU H 1 113 GLU HB2 2.460 . 3.120 3.017 2.776 3.620 0.500 19 0 "[ . 1 . 2]" 1
1979 1 113 GLU H 1 113 GLU QB 2.235 . 2.670 2.582 2.388 2.795 0.125 19 0 "[ . 1 . 2]" 1
1980 1 113 GLU H 1 113 GLU HB3 2.460 . 3.120 2.832 2.605 3.217 0.097 3 0 "[ . 1 . 2]" 1
1981 1 113 GLU H 1 113 GLU HG2 3.605 . 5.410 4.591 2.631 5.062 . 0 0 "[ . 1 . 2]" 1
1982 1 113 GLU H 1 113 GLU QG 3.195 . 4.590 4.087 2.581 4.320 . 0 0 "[ . 1 . 2]" 1
1983 1 113 GLU H 1 113 GLU HG3 3.605 . 5.410 4.646 3.731 5.016 . 0 0 "[ . 1 . 2]" 1
1984 1 113 GLU H 1 114 PRO QD 3.100 . 4.400 3.167 2.428 3.712 . 0 0 "[ . 1 . 2]" 1
1985 1 113 GLU H 1 115 SER H 3.650 . 5.500 5.253 4.937 5.480 . 0 0 "[ . 1 . 2]" 1
1986 1 113 GLU H 1 133 PRO HB2 3.245 . 4.690 4.415 3.980 4.815 0.125 19 0 "[ . 1 . 2]" 1
1987 1 113 GLU H 1 133 PRO QB 2.930 . 4.060 3.590 3.079 3.960 . 0 0 "[ . 1 . 2]" 1
1988 1 113 GLU H 1 133 PRO HB3 3.245 . 4.690 3.823 3.164 4.425 . 0 0 "[ . 1 . 2]" 1
1989 1 113 GLU HA 1 115 SER H 2.915 . 4.030 3.412 3.197 3.611 . 0 0 "[ . 1 . 2]" 1
1990 1 113 GLU QG 1 115 SER H 2.820 . 3.840 3.469 2.681 4.244 0.404 19 0 "[ . 1 . 2]" 1
1991 1 114 PRO HA 1 133 PRO HB2 3.330 . 4.860 3.113 2.333 4.076 . 0 0 "[ . 1 . 2]" 1
1992 1 114 PRO HA 1 133 PRO QB 2.980 . 4.160 2.975 2.297 3.814 . 0 0 "[ . 1 . 2]" 1
1993 1 114 PRO HA 1 133 PRO HB3 3.330 . 4.860 3.886 3.328 4.589 . 0 0 "[ . 1 . 2]" 1
1994 1 114 PRO HA 1 133 PRO HD3 3.485 . 5.170 4.497 4.109 5.018 . 0 0 "[ . 1 . 2]" 1
1995 1 114 PRO HB2 1 115 SER H 2.970 . 4.140 3.623 3.406 3.827 . 0 0 "[ . 1 . 2]" 1
1996 1 114 PRO QD 1 115 SER H 2.545 . 3.290 2.690 2.404 2.858 . 0 0 "[ . 1 . 2]" 1
1997 1 114 PRO HD2 1 115 SER H 2.895 . 3.990 2.739 2.434 2.924 . 0 0 "[ . 1 . 2]" 1
1998 1 114 PRO HD3 1 115 SER H 2.895 . 3.990 3.938 3.721 4.082 0.092 3 0 "[ . 1 . 2]" 1
1999 1 114 PRO QG 1 115 SER H 2.470 . 3.140 2.941 2.551 3.179 0.039 9 0 "[ . 1 . 2]" 1
2000 1 114 PRO QG 1 115 SER QB 3.055 . 4.310 3.828 3.237 4.216 . 0 0 "[ . 1 . 2]" 1
2001 1 115 SER H 1 115 SER QB 2.405 . 3.010 2.651 2.176 2.943 . 0 0 "[ . 1 . 2]" 1
2002 1 115 SER H 1 116 ILE H 3.165 . 4.530 4.342 4.274 4.486 . 0 0 "[ . 1 . 2]" 1
2003 1 115 SER H 1 116 ILE HG12 3.650 . 5.500 5.710 5.546 6.001 0.501 17 1 "[ . 1 . + 2]" 1
2004 1 115 SER H 1 116 ILE MG 3.435 . 5.070 4.095 3.865 4.610 . 0 0 "[ . 1 . 2]" 1
2005 1 115 SER HA 1 116 ILE H 2.285 . 2.770 2.102 2.014 2.179 . 0 0 "[ . 1 . 2]" 1
2006 1 115 SER HA 1 116 ILE HA 3.435 . 5.070 4.348 4.269 4.419 . 0 0 "[ . 1 . 2]" 1
2007 1 115 SER HA 1 116 ILE MD 3.650 . 5.500 5.292 5.059 5.451 . 0 0 "[ . 1 . 2]" 1
2008 1 115 SER HA 1 116 ILE HG12 3.650 . 5.500 3.899 3.633 4.077 . 0 0 "[ . 1 . 2]" 1
2009 1 115 SER HA 1 116 ILE MG 3.400 . 5.000 3.793 3.592 3.955 . 0 0 "[ . 1 . 2]" 1
2010 1 115 SER QB 1 116 ILE H 2.530 . 3.260 3.283 2.708 3.636 0.376 15 0 "[ . 1 . 2]" 1
2011 1 115 SER QB 1 116 ILE HA 3.335 . 4.870 4.212 4.009 4.378 . 0 0 "[ . 1 . 2]" 1
2012 1 115 SER QB 1 116 ILE MG 3.275 . 4.750 4.554 4.389 4.711 . 0 0 "[ . 1 . 2]" 1
2013 1 116 ILE H 1 116 ILE HB 3.005 . 4.210 3.817 3.791 3.848 . 0 0 "[ . 1 . 2]" 1
2014 1 116 ILE H 1 116 ILE MD 2.990 . 4.180 3.941 3.891 3.995 . 0 0 "[ . 1 . 2]" 1
2015 1 116 ILE H 1 116 ILE HG12 2.815 . 3.830 2.327 2.272 2.416 . 0 0 "[ . 1 . 2]" 1
2016 1 116 ILE H 1 116 ILE HG13 2.730 . 3.660 2.887 2.785 2.933 . 0 0 "[ . 1 . 2]" 1
2017 1 116 ILE H 1 116 ILE MG 2.815 . 3.830 2.940 2.852 3.040 . 0 0 "[ . 1 . 2]" 1
2018 1 116 ILE H 1 117 TYR H 3.220 . 4.640 4.399 4.310 4.478 . 0 0 "[ . 1 . 2]" 1
2019 1 116 ILE H 1 128 TRP HE3 3.650 . 5.500 5.007 4.646 5.343 . 0 0 "[ . 1 . 2]" 1
2020 1 116 ILE HA 1 116 ILE MD 2.995 . 4.190 4.187 4.166 4.218 0.028 6 0 "[ . 1 . 2]" 1
2021 1 116 ILE HA 1 116 ILE MG 2.445 . 3.090 2.365 2.304 2.413 . 0 0 "[ . 1 . 2]" 1
2022 1 116 ILE HA 1 117 TYR H 2.390 . 2.980 2.285 2.172 2.364 . 0 0 "[ . 1 . 2]" 1
2023 1 116 ILE HA 1 117 TYR QD 2.925 . 4.050 3.146 2.606 3.977 . 0 0 "[ . 1 . 2]" 1
2024 1 116 ILE HA 1 129 SER H 3.155 . 4.510 4.176 3.659 4.502 . 0 0 "[ . 1 . 2]" 1
2025 1 116 ILE HA 1 129 SER HB2 3.435 . 5.070 3.459 2.261 4.468 . 0 0 "[ . 1 . 2]" 1
2026 1 116 ILE HA 1 129 SER QB 3.100 . 4.400 3.038 2.242 3.826 . 0 0 "[ . 1 . 2]" 1
2027 1 116 ILE HA 1 129 SER HB3 3.435 . 5.070 3.726 2.693 4.160 . 0 0 "[ . 1 . 2]" 1
2028 1 116 ILE HA 1 130 GLY H 3.465 . 5.130 4.657 4.034 5.200 0.070 1 0 "[ . 1 . 2]" 1
2029 1 116 ILE HB 1 116 ILE MD 2.845 . 3.890 2.373 2.322 2.434 . 0 0 "[ . 1 . 2]" 1
2030 1 116 ILE HB 1 117 TYR H 2.555 . 3.310 2.549 2.373 2.735 . 0 0 "[ . 1 . 2]" 1
2031 1 116 ILE HB 1 128 TRP HA 3.495 . 5.190 4.748 4.375 5.083 . 0 0 "[ . 1 . 2]" 1
2032 1 116 ILE HB 1 128 TRP HB2 3.320 . 4.840 4.315 3.463 4.743 . 0 0 "[ . 1 . 2]" 1
2033 1 116 ILE HB 1 128 TRP HB3 3.350 . 4.900 2.829 2.222 3.169 . 0 0 "[ . 1 . 2]" 1
2034 1 116 ILE HB 1 128 TRP HE3 3.275 . 4.750 3.024 2.754 3.385 . 0 0 "[ . 1 . 2]" 1
2035 1 116 ILE HB 1 129 SER H 2.800 . 3.800 2.861 2.542 3.163 . 0 0 "[ . 1 . 2]" 1
2036 1 116 ILE HB 1 129 SER QB 3.570 . 5.340 3.028 2.025 4.144 . 0 0 "[ . 1 . 2]" 1
2037 1 116 ILE HB 1 130 GLY H 2.695 . 3.590 2.876 2.404 3.342 . 0 0 "[ . 1 . 2]" 1
2038 1 116 ILE MD 1 116 ILE MG 2.270 . 2.740 2.015 1.879 2.153 . 0 0 "[ . 1 . 2]" 1
2039 1 116 ILE MD 1 128 TRP HA 3.255 . 4.710 4.683 4.359 4.887 0.177 11 0 "[ . 1 . 2]" 1
2040 1 116 ILE MD 1 128 TRP HB2 2.725 . 3.650 3.193 2.655 3.622 . 0 0 "[ . 1 . 2]" 1
2041 1 116 ILE MD 1 128 TRP HB3 2.835 . 3.870 2.467 2.109 2.693 . 0 0 "[ . 1 . 2]" 1
2042 1 116 ILE MD 1 128 TRP HE3 2.860 . 3.920 3.012 2.733 3.378 . 0 0 "[ . 1 . 2]" 1
2043 1 116 ILE MD 1 128 TRP HZ3 3.240 . 4.680 4.227 3.734 4.685 0.005 6 0 "[ . 1 . 2]" 1
2044 1 116 ILE MD 1 129 SER H 3.095 . 4.390 3.970 3.542 4.393 0.003 4 0 "[ . 1 . 2]" 1
2045 1 116 ILE MD 1 130 GLY H 2.915 . 4.030 3.363 2.985 3.842 . 0 0 "[ . 1 . 2]" 1
2046 1 116 ILE MD 1 130 GLY QA 3.355 . 4.910 4.399 4.159 4.787 . 0 0 "[ . 1 . 2]" 1
2047 1 116 ILE MD 1 131 PRO HA 3.175 . 4.550 3.985 3.385 4.378 . 0 0 "[ . 1 . 2]" 1
2048 1 116 ILE MD 1 132 ALA HA 3.040 . 4.280 2.663 2.129 3.148 . 0 0 "[ . 1 . 2]" 1
2049 1 116 ILE MD 1 133 PRO HD3 3.520 . 5.240 2.949 2.311 3.463 . 0 0 "[ . 1 . 2]" 1
2050 1 116 ILE HG12 1 128 TRP HE3 3.650 . 5.500 4.333 4.058 4.610 . 0 0 "[ . 1 . 2]" 1
2051 1 116 ILE HG12 1 132 ALA HA 3.155 . 4.510 4.391 3.818 4.722 0.212 13 0 "[ . 1 . 2]" 1
2052 1 116 ILE HG13 1 116 ILE MG 2.615 . 3.430 3.205 3.176 3.235 . 0 0 "[ . 1 . 2]" 1
2053 1 116 ILE HG13 1 128 TRP HE3 3.140 . 4.480 2.653 2.360 2.952 . 0 0 "[ . 1 . 2]" 1
2054 1 116 ILE MG 1 117 TYR H 2.795 . 3.790 3.693 3.609 3.783 . 0 0 "[ . 1 . 2]" 1
2055 1 116 ILE MG 1 128 TRP HB2 3.650 . 5.500 4.837 4.025 5.287 . 0 0 "[ . 1 . 2]" 1
2056 1 116 ILE MG 1 128 TRP HB3 3.090 . 4.380 4.019 3.606 4.388 0.008 15 0 "[ . 1 . 2]" 1
2057 1 116 ILE MG 1 128 TRP HE3 3.630 . 5.460 4.499 4.258 4.814 . 0 0 "[ . 1 . 2]" 1
2058 1 116 ILE MG 1 129 SER H 3.180 . 4.560 4.057 3.659 4.329 . 0 0 "[ . 1 . 2]" 1
2059 1 116 ILE MG 1 129 SER QB 2.875 . 3.950 2.975 2.014 3.975 0.025 6 0 "[ . 1 . 2]" 1
2060 1 116 ILE MG 1 130 GLY H 2.570 . 3.340 2.962 2.414 3.433 0.093 1 0 "[ . 1 . 2]" 1
2061 1 116 ILE MG 1 130 GLY QA 2.935 . 4.070 3.450 2.898 4.068 . 0 0 "[ . 1 . 2]" 1
2062 1 116 ILE MG 1 131 PRO QD 3.340 . 4.880 4.861 4.611 5.087 0.207 1 0 "[ . 1 . 2]" 1
2063 1 116 ILE MG 1 132 ALA HA 2.940 . 4.080 3.479 2.753 3.886 . 0 0 "[ . 1 . 2]" 1
2064 1 116 ILE MG 1 133 PRO HD3 2.800 . 3.800 2.439 2.027 2.878 . 0 0 "[ . 1 . 2]" 1
2065 1 117 TYR H 1 117 TYR HB3 2.980 . 4.160 3.417 3.348 3.545 . 0 0 "[ . 1 . 2]" 1
2066 1 117 TYR H 1 117 TYR QD 2.810 . 3.820 2.873 2.350 3.223 . 0 0 "[ . 1 . 2]" 1
2067 1 117 TYR H 1 117 TYR QE 3.355 . 4.910 4.301 4.111 4.431 . 0 0 "[ . 1 . 2]" 1
2068 1 117 TYR H 1 118 CYS H 3.170 . 4.540 4.353 4.273 4.396 . 0 0 "[ . 1 . 2]" 1
2069 1 117 TYR H 1 119 THR MG 3.315 . 4.830 3.802 3.013 4.859 0.029 10 0 "[ . 1 . 2]" 1
2070 1 117 TYR H 1 128 TRP HE3 3.010 . 4.220 3.099 2.829 3.366 . 0 0 "[ . 1 . 2]" 1
2071 1 117 TYR H 1 128 TRP HZ3 3.650 . 5.500 4.530 4.090 4.866 . 0 0 "[ . 1 . 2]" 1
2072 1 117 TYR H 1 129 SER H 2.745 . 3.690 2.584 2.164 2.827 . 0 0 "[ . 1 . 2]" 1
2073 1 117 TYR H 1 129 SER HB2 2.975 . 4.150 3.187 2.341 4.105 . 0 0 "[ . 1 . 2]" 1
2074 1 117 TYR H 1 129 SER QB 2.615 . 3.430 2.609 2.066 2.953 . 0 0 "[ . 1 . 2]" 1
2075 1 117 TYR H 1 129 SER HB3 2.975 . 4.150 3.190 2.299 3.965 . 0 0 "[ . 1 . 2]" 1
2076 1 117 TYR H 1 130 GLY H 3.470 . 5.140 4.333 3.810 4.754 . 0 0 "[ . 1 . 2]" 1
2077 1 117 TYR HA 1 117 TYR QD 3.640 . 5.480 3.740 3.614 3.786 . 0 0 "[ . 1 . 2]" 1
2078 1 117 TYR HA 1 118 CYS H 2.415 . 3.030 2.331 2.244 2.442 . 0 0 "[ . 1 . 2]" 1
2079 1 117 TYR HA 1 128 TRP HZ3 3.225 . 4.650 2.210 1.915 2.614 . 0 0 "[ . 1 . 2]" 1
2080 1 117 TYR HB2 1 118 CYS H 2.730 . 3.660 2.492 2.381 2.626 . 0 0 "[ . 1 . 2]" 1
2081 1 117 TYR HB2 1 119 THR H 3.650 . 5.500 5.367 4.753 5.696 0.196 20 0 "[ . 1 . 2]" 1
2082 1 117 TYR HB2 1 119 THR HB 3.650 . 5.500 5.300 4.575 6.080 0.580 19 2 "[ -. 1 . +2]" 1
2083 1 117 TYR HB3 1 118 CYS H 2.925 . 4.050 3.738 3.592 3.929 . 0 0 "[ . 1 . 2]" 1
2084 1 117 TYR QD 1 118 CYS H 3.185 . 4.570 3.642 3.304 3.944 . 0 0 "[ . 1 . 2]" 1
2085 1 117 TYR QD 1 119 THR H 3.535 . 5.270 4.225 3.288 4.873 . 0 0 "[ . 1 . 2]" 1
2086 1 117 TYR QD 1 119 THR HB 2.840 . 3.880 3.139 2.261 4.024 0.144 4 0 "[ . 1 . 2]" 1
2087 1 117 TYR QD 1 119 THR MG 3.055 . 4.310 3.306 2.302 4.370 0.060 10 0 "[ . 1 . 2]" 1
2088 1 117 TYR QE 1 119 THR HB 2.720 . 3.640 2.463 1.954 3.192 . 0 0 "[ . 1 . 2]" 1
2089 1 117 TYR QE 1 119 THR MG 2.940 . 4.080 3.149 2.442 3.960 . 0 0 "[ . 1 . 2]" 1
2090 1 117 TYR QE 1 129 SER H 3.650 . 5.500 5.542 5.108 5.866 0.366 19 0 "[ . 1 . 2]" 1
2091 1 118 CYS H 1 118 CYS HB2 2.625 . 3.450 2.278 1.987 2.574 . 0 0 "[ . 1 . 2]" 1
2092 1 118 CYS H 1 118 CYS HB3 2.625 . 3.450 3.076 2.492 3.532 0.082 13 0 "[ . 1 . 2]" 1
2093 1 118 CYS H 1 119 THR H 3.300 . 4.800 4.304 4.048 4.436 . 0 0 "[ . 1 . 2]" 1
2094 1 118 CYS H 1 119 THR MG 3.650 . 5.500 4.779 3.766 5.729 0.229 10 0 "[ . 1 . 2]" 1
2095 1 118 CYS H 1 128 TRP HA 3.200 . 4.600 4.320 4.010 4.607 0.007 10 0 "[ . 1 . 2]" 1
2096 1 118 CYS H 1 128 TRP HE3 3.170 . 4.540 3.557 3.193 3.979 . 0 0 "[ . 1 . 2]" 1
2097 1 118 CYS H 1 128 TRP HZ3 2.840 . 3.880 3.428 2.919 4.037 0.157 11 0 "[ . 1 . 2]" 1
2098 1 118 CYS HA 1 119 THR H 2.305 . 2.810 2.182 1.982 2.405 . 0 0 "[ . 1 . 2]" 1
2099 1 118 CYS HA 1 119 THR MG 3.515 . 5.230 3.637 3.162 4.043 . 0 0 "[ . 1 . 2]" 1
2100 1 118 CYS HA 1 120 SER H 2.985 . 4.170 3.815 3.052 4.512 0.342 20 0 "[ . 1 . 2]" 1
2101 1 118 CYS HA 1 128 TRP HA 2.570 . 3.340 2.030 1.737 2.386 0.063 1 0 "[ . 1 . 2]" 1
2102 1 118 CYS HA 1 128 TRP HB2 3.385 . 4.970 4.886 4.658 5.170 0.200 5 0 "[ . 1 . 2]" 1
2103 1 118 CYS HA 1 128 TRP HE3 3.260 . 4.720 3.803 3.293 4.132 . 0 0 "[ . 1 . 2]" 1
2104 1 118 CYS HA 1 128 TRP HZ3 3.650 . 5.500 5.075 4.553 5.430 . 0 0 "[ . 1 . 2]" 1
2105 1 118 CYS HA 1 129 SER H 2.850 . 3.900 3.799 3.378 4.099 0.199 11 0 "[ . 1 . 2]" 1
2106 1 119 THR H 1 119 THR MG 2.535 . 3.270 2.112 1.732 2.529 0.068 2 0 "[ . 1 . 2]" 1
2107 1 119 THR H 1 120 SER H 3.335 . 4.870 2.452 1.830 3.437 . 0 0 "[ . 1 . 2]" 1
2108 1 119 THR H 1 120 SER QB 3.390 . 4.980 4.360 3.476 5.023 0.043 6 0 "[ . 1 . 2]" 1
2109 1 119 THR H 1 127 ILE H 3.340 . 4.880 4.811 4.303 5.316 0.436 19 0 "[ . 1 . 2]" 1
2110 1 119 THR H 1 127 ILE MD 3.260 . 4.720 4.440 3.126 5.201 0.481 13 0 "[ . 1 . 2]" 1
2111 1 119 THR H 1 128 TRP HA 2.820 . 3.840 2.660 2.215 3.017 . 0 0 "[ . 1 . 2]" 1
2112 1 119 THR H 1 128 TRP HE3 3.650 . 5.500 5.182 4.732 5.596 0.096 18 0 "[ . 1 . 2]" 1
2113 1 119 THR H 1 129 SER H 2.865 . 3.930 3.659 3.107 4.078 0.148 18 0 "[ . 1 . 2]" 1
2114 1 119 THR H 1 129 SER HA 3.570 . 5.340 4.134 3.698 4.622 . 0 0 "[ . 1 . 2]" 1
2115 1 119 THR H 1 129 SER QB 3.570 . 5.340 4.746 4.059 5.540 0.200 16 0 "[ . 1 . 2]" 1
2116 1 119 THR HA 1 119 THR MG 2.730 . 3.660 3.025 2.561 3.232 . 0 0 "[ . 1 . 2]" 1
2117 1 119 THR HA 1 120 SER H 2.680 . 3.560 2.942 2.059 3.485 . 0 0 "[ . 1 . 2]" 1
2118 1 119 THR HA 1 120 SER QB 3.570 . 5.340 4.645 4.187 5.154 . 0 0 "[ . 1 . 2]" 1
2119 1 119 THR HB 1 120 SER H 3.240 . 4.680 4.385 4.082 4.666 . 0 0 "[ . 1 . 2]" 1
2120 1 119 THR HB 1 129 SER QB 3.570 . 5.340 4.381 2.477 5.706 0.366 2 0 "[ . 1 . 2]" 1
2121 1 119 THR MG 1 120 SER H 2.790 . 3.780 3.411 2.150 4.069 0.289 3 0 "[ . 1 . 2]" 1
2122 1 119 THR MG 1 120 SER HA 3.050 . 4.300 4.177 3.329 4.836 0.536 5 3 "[ + 1* . -2]" 1
2123 1 119 THR MG 1 128 TRP H 3.650 . 5.500 5.141 4.451 5.570 0.070 13 0 "[ . 1 . 2]" 1
2124 1 119 THR MG 1 128 TRP HA 2.710 . 3.620 3.407 3.000 3.674 0.054 3 0 "[ . 1 . 2]" 1
2125 1 119 THR MG 1 129 SER H 2.685 . 3.570 2.875 2.516 3.235 . 0 0 "[ . 1 . 2]" 1
2126 1 119 THR MG 1 129 SER HA 2.475 . 3.150 2.156 1.656 2.724 0.144 14 0 "[ . 1 . 2]" 1
2127 1 119 THR MG 1 129 SER QB 2.535 . 3.270 2.714 1.722 3.437 0.167 18 0 "[ . 1 . 2]" 1
2128 1 120 SER H 1 120 SER HB2 2.930 . 4.060 3.231 2.187 4.037 . 0 0 "[ . 1 . 2]" 1
2129 1 120 SER H 1 120 SER QB 2.540 . 3.280 2.557 2.060 3.201 . 0 0 "[ . 1 . 2]" 1
2130 1 120 SER H 1 120 SER HB3 2.930 . 4.060 2.900 2.349 3.917 . 0 0 "[ . 1 . 2]" 1
2131 1 120 SER H 1 127 ILE MD 3.290 . 4.780 4.436 3.220 5.217 0.437 9 0 "[ . 1 . 2]" 1
2132 1 120 SER H 1 128 TRP HA 3.355 . 4.910 4.491 3.418 5.352 0.442 9 0 "[ . 1 . 2]" 1
2133 1 120 SER HA 1 126 GLY H 3.440 . 5.080 4.122 2.688 5.356 0.276 17 0 "[ . 1 . 2]" 1
2134 1 120 SER HA 1 127 ILE H 3.040 . 4.280 2.471 1.663 3.841 0.137 19 0 "[ . 1 . 2]" 1
2135 1 120 SER HA 1 127 ILE MD 2.950 . 4.100 3.256 1.944 4.346 0.246 7 0 "[ . 1 . 2]" 1
2136 1 120 SER HA 1 127 ILE HG12 3.200 . 4.600 3.572 1.829 4.805 0.205 14 0 "[ . 1 . 2]" 1
2137 1 120 SER HA 1 127 ILE HG13 3.200 . 4.600 2.766 1.938 3.472 . 0 0 "[ . 1 . 2]" 1
2138 1 120 SER HA 1 127 ILE MG 3.470 . 5.140 4.529 3.649 5.113 . 0 0 "[ . 1 . 2]" 1
2139 1 120 SER QB 1 126 GLY QA 2.335 . 2.870 2.508 1.776 3.245 0.375 17 0 "[ . 1 . 2]" 1
2140 1 120 SER QB 1 127 ILE H 3.345 . 4.890 2.382 1.532 3.269 0.268 5 0 "[ . 1 . 2]" 1
2141 1 120 SER HB2 1 126 GLY QA 2.650 . 3.500 3.008 1.949 3.953 0.453 6 0 "[ . 1 . 2]" 1
2142 1 120 SER HB3 1 126 GLY QA 2.650 . 3.500 2.849 1.838 3.731 0.231 4 0 "[ . 1 . 2]" 1
2143 1 125 VAL HA 1 125 VAL QG 2.405 . 3.010 2.216 2.115 2.417 . 0 0 "[ . 1 . 2]" 1
2144 1 125 VAL HB 1 126 GLY H 2.945 . 4.090 3.606 2.398 4.374 0.284 13 0 "[ . 1 . 2]" 1
2145 1 125 VAL QG 1 126 GLY H 2.640 . 3.480 2.912 2.200 3.482 0.002 9 0 "[ . 1 . 2]" 1
2146 1 126 GLY H 1 126 GLY QA 2.335 . 2.870 2.320 2.132 2.511 . 0 0 "[ . 1 . 2]" 1
2147 1 126 GLY QA 1 127 ILE HB 3.600 . 5.400 5.489 5.360 5.596 0.196 6 0 "[ . 1 . 2]" 1
2148 1 126 GLY QA 1 127 ILE QG 3.040 . 4.280 4.077 3.616 4.463 0.183 17 0 "[ . 1 . 2]" 1
2149 1 127 ILE H 1 127 ILE HG12 3.000 . 4.200 3.074 2.361 3.881 . 0 0 "[ . 1 . 2]" 1
2150 1 127 ILE H 1 127 ILE QG 2.655 . 3.510 2.202 1.941 2.385 . 0 0 "[ . 1 . 2]" 1
2151 1 127 ILE H 1 127 ILE HG13 3.000 . 4.200 2.392 1.949 2.980 . 0 0 "[ . 1 . 2]" 1
2152 1 127 ILE H 1 127 ILE MG 2.880 . 3.960 3.048 2.813 3.353 . 0 0 "[ . 1 . 2]" 1
2153 1 127 ILE H 1 128 TRP H 3.160 . 4.520 4.393 4.215 4.490 . 0 0 "[ . 1 . 2]" 1
2154 1 127 ILE HA 1 127 ILE MD 2.815 . 3.830 3.902 3.585 4.100 0.270 5 0 "[ . 1 . 2]" 1
2155 1 127 ILE HA 1 127 ILE MG 2.355 . 2.910 2.288 2.115 2.388 . 0 0 "[ . 1 . 2]" 1
2156 1 127 ILE HA 1 128 TRP H 2.285 . 2.770 2.343 2.186 2.690 . 0 0 "[ . 1 . 2]" 1
2157 1 127 ILE HA 1 128 TRP HD1 3.395 . 4.990 3.546 2.986 4.202 . 0 0 "[ . 1 . 2]" 1
2158 1 127 ILE HB 1 127 ILE MD 2.480 . 3.160 2.271 2.131 2.420 . 0 0 "[ . 1 . 2]" 1
2159 1 127 ILE HB 1 128 TRP H 2.555 . 3.310 2.187 1.635 2.392 0.165 13 0 "[ . 1 . 2]" 1
2160 1 127 ILE MD 1 128 TRP H 3.085 . 4.370 3.461 2.412 4.054 . 0 0 "[ . 1 . 2]" 1
2161 1 127 ILE MD 1 128 TRP HA 2.995 . 4.190 4.296 3.544 4.757 0.567 18 3 "[ . -1 . + *]" 1
2162 1 127 ILE MD 1 128 TRP HB2 3.650 . 5.500 4.537 2.949 5.269 . 0 0 "[ . 1 . 2]" 1
2163 1 127 ILE MD 1 129 SER H 3.430 . 5.060 4.813 4.008 5.204 0.144 5 0 "[ . 1 . 2]" 1
2164 1 127 ILE MD 1 129 SER HA 3.080 . 4.360 3.909 2.927 4.294 . 0 0 "[ . 1 . 2]" 1
2165 1 127 ILE QG 1 128 TRP H 3.085 . 4.370 3.731 2.807 4.264 . 0 0 "[ . 1 . 2]" 1
2166 1 127 ILE MG 1 128 TRP H 2.850 . 3.900 3.406 3.149 3.579 . 0 0 "[ . 1 . 2]" 1
2167 1 127 ILE MG 1 128 TRP HD1 3.445 . 5.090 4.527 3.586 5.253 0.163 2 0 "[ . 1 . 2]" 1
2168 1 128 TRP H 1 128 TRP HB2 2.430 . 3.060 2.347 2.245 2.501 . 0 0 "[ . 1 . 2]" 1
2169 1 128 TRP H 1 128 TRP HB3 2.745 . 3.690 3.556 3.447 3.680 . 0 0 "[ . 1 . 2]" 1
2170 1 128 TRP H 1 128 TRP HD1 2.780 . 3.760 2.521 2.111 3.029 . 0 0 "[ . 1 . 2]" 1
2171 1 128 TRP H 1 128 TRP HE1 3.650 . 5.500 4.862 4.374 5.398 . 0 0 "[ . 1 . 2]" 1
2172 1 128 TRP H 1 130 GLY QA 3.650 . 5.500 5.373 4.905 5.610 0.110 12 0 "[ . 1 . 2]" 1
2173 1 128 TRP HA 1 128 TRP HE3 3.015 . 4.230 3.401 3.062 3.786 . 0 0 "[ . 1 . 2]" 1
2174 1 128 TRP HA 1 129 SER H 2.445 . 3.090 2.526 2.366 2.735 . 0 0 "[ . 1 . 2]" 1
2175 1 128 TRP HA 1 130 GLY H 3.140 . 4.480 4.390 4.089 4.617 0.137 3 0 "[ . 1 . 2]" 1
2176 1 128 TRP HB2 1 130 GLY H 2.875 . 3.950 3.268 2.836 3.621 . 0 0 "[ . 1 . 2]" 1
2177 1 128 TRP HB3 1 129 SER H 2.775 . 3.750 2.280 1.997 2.633 . 0 0 "[ . 1 . 2]" 1
2178 1 128 TRP HB3 1 130 GLY H 2.755 . 3.710 2.825 2.433 3.098 . 0 0 "[ . 1 . 2]" 1
2179 1 128 TRP HE3 1 129 SER H 2.825 . 3.850 3.231 2.962 3.394 . 0 0 "[ . 1 . 2]" 1
2180 1 128 TRP HZ3 1 129 SER H 3.650 . 5.500 5.530 5.268 5.734 0.234 1 0 "[ . 1 . 2]" 1
2181 1 129 SER H 1 129 SER HB2 2.700 . 3.600 2.973 2.433 3.615 0.015 1 0 "[ . 1 . 2]" 1
2182 1 129 SER H 1 129 SER QB 2.405 . 3.010 2.485 2.229 2.580 . 0 0 "[ . 1 . 2]" 1
2183 1 129 SER H 1 129 SER HB3 2.700 . 3.600 3.026 2.536 3.613 0.013 13 0 "[ . 1 . 2]" 1
2184 1 129 SER H 1 130 GLY H 2.665 . 3.530 2.677 2.525 2.790 . 0 0 "[ . 1 . 2]" 1
2185 1 129 SER QB 1 130 GLY H 2.945 . 4.090 2.928 2.370 3.608 . 0 0 "[ . 1 . 2]" 1
2186 1 130 GLY H 1 131 PRO HD2 3.505 . 5.210 5.037 4.707 5.155 . 0 0 "[ . 1 . 2]" 1
2187 1 130 GLY H 1 131 PRO HD3 3.505 . 5.210 4.620 4.310 4.966 . 0 0 "[ . 1 . 2]" 1
2188 1 130 GLY QA 1 131 PRO QD 2.435 . 3.070 2.000 1.911 2.106 . 0 0 "[ . 1 . 2]" 1
2189 1 131 PRO HA 1 132 ALA H 2.305 . 2.810 2.304 2.158 3.385 0.575 17 1 "[ . 1 . + 2]" 1
2190 1 131 PRO HA 1 132 ALA HA 3.360 . 4.920 4.319 4.193 4.582 . 0 0 "[ . 1 . 2]" 1
2191 1 131 PRO QB 1 132 ALA H 2.495 . 3.190 2.987 2.205 3.087 . 0 0 "[ . 1 . 2]" 1
2192 1 131 PRO HB2 1 132 ALA H 2.835 . 3.870 3.411 2.224 3.580 . 0 0 "[ . 1 . 2]" 1
2193 1 131 PRO HB3 1 132 ALA H 2.835 . 3.870 3.385 3.232 3.854 . 0 0 "[ . 1 . 2]" 1
2194 1 132 ALA H 1 132 ALA MB 2.345 . 2.890 2.281 2.204 2.918 0.028 17 0 "[ . 1 . 2]" 1
2195 1 132 ALA HA 1 133 PRO HD2 2.360 . 2.920 2.370 1.912 2.742 . 0 0 "[ . 1 . 2]" 1
2196 1 132 ALA HA 1 133 PRO HD3 2.735 . 3.670 2.132 1.897 2.494 . 0 0 "[ . 1 . 2]" 1
2197 1 132 ALA MB 1 133 PRO HA 3.610 . 5.420 4.580 4.435 4.646 . 0 0 "[ . 1 . 2]" 1
2198 1 132 ALA MB 1 133 PRO HD2 2.605 . 3.410 3.180 2.710 3.543 0.133 8 0 "[ . 1 . 2]" 1
2199 1 132 ALA MB 1 133 PRO HD3 2.925 . 4.050 3.701 3.414 3.977 . 0 0 "[ . 1 . 2]" 1
2200 1 133 PRO HA 1 134 GLN H 2.285 . 2.770 2.273 2.138 2.410 . 0 0 "[ . 1 . 2]" 1
2201 1 133 PRO HA 1 134 GLN HG2 3.085 . 4.370 3.713 3.257 4.553 0.183 8 0 "[ . 1 . 2]" 1
2202 1 133 PRO QB 1 134 GLN H 2.285 . 2.770 2.854 2.613 2.990 0.220 19 0 "[ . 1 . 2]" 1
2203 1 133 PRO HB2 1 134 GLN H 2.505 . 3.210 3.200 2.691 3.407 0.197 19 0 "[ . 1 . 2]" 1
2204 1 133 PRO HB3 1 134 GLN H 2.505 . 3.210 3.301 3.099 3.627 0.417 1 0 "[ . 1 . 2]" 1
2205 1 134 GLN H 1 134 GLN QB 2.605 . 3.410 2.970 2.465 3.190 . 0 0 "[ . 1 . 2]" 1
2206 1 134 GLN H 1 134 GLN HG2 2.940 . 4.080 2.404 1.949 3.810 . 0 0 "[ . 1 . 2]" 1
2207 1 134 GLN H 1 134 GLN HG3 3.020 . 4.240 3.025 2.674 3.251 . 0 0 "[ . 1 . 2]" 1
2208 1 134 GLN H 1 135 CYS H 3.245 . 4.690 4.367 4.218 4.459 . 0 0 "[ . 1 . 2]" 1
2209 1 134 GLN H 1 136 ILE H 3.650 . 5.500 4.295 3.834 4.578 . 0 0 "[ . 1 . 2]" 1
2210 1 134 GLN H 1 136 ILE HB 3.325 . 4.850 5.070 4.624 5.475 0.625 5 3 "[ + 1 * -. 2]" 1
2211 1 134 GLN H 1 136 ILE QG 3.030 . 4.260 3.972 3.048 4.500 0.240 1 0 "[ . 1 . 2]" 1
2212 1 134 GLN HA 1 134 GLN HG2 2.925 . 4.050 3.572 2.449 3.755 . 0 0 "[ . 1 . 2]" 1
2213 1 134 GLN HA 1 135 CYS H 2.260 . 2.720 2.277 2.116 2.728 0.008 13 0 "[ . 1 . 2]" 1
2214 1 134 GLN HA 1 136 ILE H 3.650 . 5.500 4.602 4.311 4.895 . 0 0 "[ . 1 . 2]" 1
2215 1 134 GLN QB 1 135 CYS H 2.810 . 3.820 2.307 1.760 2.801 0.040 8 0 "[ . 1 . 2]" 1
2216 1 134 GLN QE 1 136 ILE H 3.275 . 4.750 4.849 4.138 5.116 0.366 12 0 "[ . 1 . 2]" 1
2217 1 134 GLN QE 1 136 ILE HA 3.425 . 5.050 4.809 3.903 5.559 0.509 1 1 "[+ . 1 . 2]" 1
2218 1 134 GLN QE 1 136 ILE MD 3.055 . 4.310 2.538 1.739 3.690 0.061 5 0 "[ . 1 . 2]" 1
2219 1 134 GLN QE 1 136 ILE MG 3.570 . 5.340 3.992 2.980 4.811 . 0 0 "[ . 1 . 2]" 1
2220 1 134 GLN HE21 1 136 ILE MD 3.395 . 4.990 2.720 1.759 4.331 0.041 5 0 "[ . 1 . 2]" 1
2221 1 134 GLN HE22 1 136 ILE MD 3.395 . 4.990 3.346 2.723 4.013 . 0 0 "[ . 1 . 2]" 1
2222 1 134 GLN HG3 1 135 CYS H 2.935 . 4.070 3.819 2.789 4.406 0.336 3 0 "[ . 1 . 2]" 1
2223 1 134 GLN HG3 1 136 ILE H 3.335 . 4.870 3.489 2.614 5.125 0.255 3 0 "[ . 1 . 2]" 1
2224 1 134 GLN HG3 1 136 ILE HG12 3.125 . 4.450 2.375 1.703 4.741 0.291 3 0 "[ . 1 . 2]" 1
2225 1 134 GLN HG3 1 136 ILE HG13 3.125 . 4.450 2.754 1.688 3.802 0.112 10 0 "[ . 1 . 2]" 1
2226 1 135 CYS H 1 135 CYS QB 2.505 . 3.210 2.342 2.271 2.497 . 0 0 "[ . 1 . 2]" 1
2227 1 135 CYS H 1 136 ILE MD 3.650 . 5.500 4.808 4.258 5.628 0.128 17 0 "[ . 1 . 2]" 1
2228 1 135 CYS HA 1 136 ILE H 2.250 . 2.700 2.418 2.288 2.763 0.063 15 0 "[ . 1 . 2]" 1
2229 1 135 CYS HA 1 136 ILE HA 3.210 . 4.620 4.528 4.385 4.766 0.146 8 0 "[ . 1 . 2]" 1
2230 1 135 CYS HA 1 136 ILE HB 3.540 . 5.280 4.762 4.357 5.223 . 0 0 "[ . 1 . 2]" 1
2231 1 135 CYS QB 1 136 ILE HA 3.385 . 4.970 4.602 4.371 4.834 . 0 0 "[ . 1 . 2]" 1
2232 1 136 ILE H 1 136 ILE HB 2.605 . 3.410 2.443 2.265 2.637 . 0 0 "[ . 1 . 2]" 1
2233 1 136 ILE H 1 136 ILE QG 2.675 . 3.550 2.492 2.088 2.894 . 0 0 "[ . 1 . 2]" 1
2234 1 136 ILE HA 1 136 ILE HG12 2.915 . 4.030 2.869 2.529 3.073 . 0 0 "[ . 1 . 2]" 1
2235 1 136 ILE HA 1 136 ILE HG13 2.915 . 4.030 3.452 2.604 3.750 . 0 0 "[ . 1 . 2]" 1
2236 1 136 ILE HA 1 136 ILE MG 2.315 . 2.830 2.495 2.419 2.628 . 0 0 "[ . 1 . 2]" 1
2237 1 136 ILE HB 1 136 ILE MD 2.775 . 3.750 2.977 2.303 3.273 . 0 0 "[ . 1 . 2]" 1
2238 1 136 ILE QG 1 136 ILE MG 2.335 . 2.870 2.303 2.176 2.392 . 0 0 "[ . 1 . 2]" 1
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