NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
477818 |
2l25   |
17124 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l25
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 1771
_Distance_constraint_stats_list.Viol_count 4114
_Distance_constraint_stats_list.Viol_total 7635.213
_Distance_constraint_stats_list.Viol_max 0.987
_Distance_constraint_stats_list.Viol_rms 0.0488
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0108
_Distance_constraint_stats_list.Viol_average_violations_only 0.0928
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 MET 1.052 0.680 7 1 "[ . + 1 . 2]"
1 3 SER 2.652 0.921 18 2 "[ . - 1 . + 2]"
1 4 GLN 2.225 0.410 15 0 "[ . 1 . 2]"
1 5 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 LEU 2.380 0.108 18 0 "[ . 1 . 2]"
1 7 ILE 7.205 0.908 11 1 "[ . 1+ . 2]"
1 8 ARG 6.325 0.931 6 5 "[ *+ * 1* . -2]"
1 9 ALA 3.657 0.931 6 3 "[ .+ - 1* . 2]"
1 10 ALA 1.932 0.095 2 0 "[ . 1 . 2]"
1 11 PHE 1.624 0.101 3 0 "[ . 1 . 2]"
1 12 GLU 9.385 0.987 16 5 "[- . 1* .+* *]"
1 13 LYS 19.921 0.987 16 14 "[- **.* ** ***+****]"
1 14 ARG 15.638 0.850 18 11 "[ * . *- *****+**]"
1 15 LEU 1.404 0.067 20 0 "[ . 1 . 2]"
1 16 SER 4.559 0.669 18 2 "[ - . 1 . + 2]"
1 17 ASP 2.610 0.088 8 0 "[ . 1 . 2]"
1 18 TRP 9.474 0.669 18 2 "[ - . 1 . + 2]"
1 19 ALA 4.076 0.472 18 0 "[ . 1 . 2]"
1 20 LYS 3.541 0.626 15 1 "[ . 1 + 2]"
1 21 ALA 2.501 0.626 15 1 "[ . 1 + 2]"
1 22 ARG 11.811 0.932 12 2 "[ . 1 + - 2]"
1 23 THR 4.726 0.595 15 1 "[ . 1 + 2]"
1 24 PRO 3.355 0.109 16 0 "[ . 1 . 2]"
1 25 ALA 10.476 0.377 18 0 "[ . 1 . 2]"
1 26 LEU 5.872 0.932 12 1 "[ . 1 + . 2]"
1 27 PRO 1.281 0.076 14 0 "[ . 1 . 2]"
1 28 VAL 1.615 0.086 1 0 "[ . 1 . 2]"
1 29 ALA 7.034 0.710 13 5 "[ .** 1* + - 2]"
1 30 TRP 12.876 0.961 20 3 "[ . 1* . - +]"
1 31 GLN 7.670 0.445 10 0 "[ . 1 . 2]"
1 32 ASN 3.726 0.284 3 0 "[ . 1 . 2]"
1 33 THR 4.271 0.128 15 0 "[ . 1 . 2]"
1 34 LYS 6.514 0.711 16 4 "[ * .* 1 - .+ 2]"
1 35 PHE 5.226 0.384 12 0 "[ . 1 . 2]"
1 36 THR 3.126 0.384 12 0 "[ . 1 . 2]"
1 37 PRO 0.337 0.079 1 0 "[ . 1 . 2]"
1 38 PRO 3.149 0.100 8 0 "[ . 1 . 2]"
1 39 ALA 5.670 0.138 8 0 "[ . 1 . 2]"
1 40 ALA 2.874 0.132 8 0 "[ . 1 . 2]"
1 41 GLY 3.117 0.094 13 0 "[ . 1 . 2]"
1 42 VAL 5.237 0.104 12 0 "[ . 1 . 2]"
1 43 TYR 6.096 0.224 9 0 "[ . 1 . 2]"
1 44 LEU 1.845 0.080 8 0 "[ . 1 . 2]"
1 45 ARG 7.953 0.710 13 5 "[ .** 1* + - 2]"
1 46 ALA 2.526 0.205 11 0 "[ . 1 . 2]"
1 47 TYR 5.752 0.181 5 0 "[ . 1 . 2]"
1 48 VAL 3.078 0.445 10 0 "[ . 1 . 2]"
1 49 MET 6.685 0.834 2 3 "[ +* . 1 . - 2]"
1 50 PRO 0.356 0.206 5 0 "[ . 1 . 2]"
1 51 ALA 3.550 0.116 13 0 "[ . 1 . 2]"
1 52 ALA 1.428 0.096 6 0 "[ . 1 . 2]"
1 53 THR 1.559 0.091 17 0 "[ . 1 . 2]"
1 54 ILE 6.586 0.798 17 2 "[ . - 1 . + 2]"
1 55 SER 9.541 0.798 17 2 "[ . - 1 . + 2]"
1 56 ARG 4.605 0.575 17 1 "[ . 1 . + 2]"
1 57 ASP 1.283 0.111 6 0 "[ . 1 . 2]"
1 58 ALA 1.037 0.111 6 0 "[ . 1 . 2]"
1 59 ALA 1.477 0.086 4 0 "[ . 1 . 2]"
1 60 GLY 1.686 0.244 16 0 "[ . 1 . 2]"
1 61 ASP 3.067 0.244 16 0 "[ . 1 . 2]"
1 62 HIS 2.600 0.099 20 0 "[ . 1 . 2]"
1 63 ARG 6.083 0.811 1 4 "[+ . 1* . *- 2]"
1 64 GLN 4.077 0.811 1 3 "[+ . 1* . - 2]"
1 65 TYR 6.063 0.908 11 1 "[ . 1+ . 2]"
1 66 ARG 4.708 0.761 5 1 "[ + 1 . 2]"
1 67 GLY 1.936 0.103 9 0 "[ . 1 . 2]"
1 68 VAL 1.408 0.107 14 0 "[ . 1 . 2]"
1 69 PHE 2.148 0.118 9 0 "[ . 1 . 2]"
1 70 GLN 18.319 0.883 14 6 "[ ** . 1 * +* * 2]"
1 71 VAL 1.918 0.267 9 0 "[ . 1 . 2]"
1 72 ASN 4.697 0.475 13 0 "[ . 1 . 2]"
1 73 VAL 1.163 0.095 13 0 "[ . 1 . 2]"
1 74 VAL 2.907 0.106 10 0 "[ . 1 . 2]"
1 75 MET 10.075 0.813 17 7 "[ * . **1 -.*+ *]"
1 76 PRO 1.426 0.217 5 0 "[ . 1 . 2]"
1 77 ILE 14.572 0.436 19 0 "[ . 1 . 2]"
1 78 GLY 6.770 0.436 19 0 "[ . 1 . 2]"
1 79 ASP 2.086 0.135 7 0 "[ . 1 . 2]"
1 80 GLY 0.856 0.098 15 0 "[ . 1 . 2]"
1 81 SER 4.668 0.672 13 3 "[ . - 1 + . * 2]"
1 82 ARG 0.704 0.205 3 0 "[ . 1 . 2]"
1 83 SER 6.811 0.813 17 6 "[ * . * 1 *-. + *]"
1 84 ALA 3.006 0.306 6 0 "[ . 1 . 2]"
1 85 GLU 4.380 0.625 2 1 "[ + . 1 . 2]"
1 86 GLN 8.086 0.337 6 0 "[ . 1 . 2]"
1 87 VAL 5.271 0.178 9 0 "[ . 1 . 2]"
1 88 ALA 3.168 0.625 2 1 "[ + . 1 . 2]"
1 89 ALA 3.783 0.087 6 0 "[ . 1 . 2]"
1 90 GLU 5.627 0.095 2 0 "[ . 1 . 2]"
1 91 LEU 6.253 0.098 20 0 "[ . 1 . 2]"
1 92 ASP 1.773 0.098 15 0 "[ . 1 . 2]"
1 93 ALA 2.122 0.085 13 0 "[ . 1 . 2]"
1 94 LEU 3.910 0.452 12 0 "[ . 1 . 2]"
1 95 PHE 2.272 0.130 8 0 "[ . 1 . 2]"
1 96 PRO 3.007 0.452 12 0 "[ . 1 . 2]"
1 97 VAL 11.617 0.152 1 0 "[ . 1 . 2]"
1 98 ASN 6.344 0.684 8 1 "[ . + 1 . 2]"
1 99 LEU 5.398 0.684 8 1 "[ . + 1 . 2]"
1 100 VAL 0.273 0.082 10 0 "[ . 1 . 2]"
1 101 MET 9.310 0.685 1 2 "[+ . 1 - 2]"
1 102 GLN 4.831 0.447 17 0 "[ . 1 . 2]"
1 103 SER 2.713 0.447 17 0 "[ . 1 . 2]"
1 104 GLY 0.427 0.078 14 0 "[ . 1 . 2]"
1 105 GLY 1.460 0.096 12 0 "[ . 1 . 2]"
1 106 LEU 7.881 0.921 18 2 "[ . - 1 . + 2]"
1 107 ALA 1.975 0.272 10 0 "[ . 1 . 2]"
1 108 VAL 3.979 0.713 20 1 "[ . 1 . +]"
1 109 ARG 3.975 0.834 1 2 "[+ . -1 . 2]"
1 110 VAL 8.153 0.258 13 0 "[ . 1 . 2]"
1 111 ARG 11.843 0.826 9 2 "[ . +1- . 2]"
1 112 THR 11.361 0.697 11 1 "[ . 1+ . 2]"
1 113 PRO 2.032 0.103 8 0 "[ . 1 . 2]"
1 114 ILE 4.225 0.100 4 0 "[ . 1 . 2]"
1 115 SER 1.713 0.096 15 0 "[ . 1 . 2]"
1 116 ASN 5.323 0.120 8 0 "[ . 1 . 2]"
1 117 GLY 2.889 0.622 13 2 "[ . - 1 + . 2]"
1 118 GLN 3.170 0.224 7 0 "[ . 1 . 2]"
1 119 PRO 2.440 0.224 7 0 "[ . 1 . 2]"
1 120 THR 3.352 0.138 17 0 "[ . 1 . 2]"
1 121 THR 4.027 0.138 17 0 "[ . 1 . 2]"
1 122 GLY 9.495 0.687 4 6 "[ -+.* 1 ** * 2]"
1 123 ASP 12.435 0.687 4 6 "[ -+.* 1 ** * 2]"
1 124 ALA 5.024 0.314 19 0 "[ . 1 . 2]"
1 125 ASP 7.857 0.664 16 4 "[ - . * 1 .+ *2]"
1 126 HIS 12.252 0.712 16 5 "[ - . **1 .+ *2]"
1 127 THR 4.775 0.117 4 0 "[ . 1 . 2]"
1 128 VAL 7.824 0.398 2 0 "[ . 1 . 2]"
1 129 PRO 10.857 0.813 12 4 "[ . - 1 +**. 2]"
1 130 ILE 6.829 0.123 18 0 "[ . 1 . 2]"
1 131 SER 3.913 0.222 14 0 "[ . 1 . 2]"
1 132 LEU 4.624 0.152 14 0 "[ . 1 . 2]"
1 133 GLY 2.388 0.108 13 0 "[ . 1 . 2]"
1 134 TYR 9.344 0.834 1 3 "[+ . *1 - 2]"
1 135 ASP 5.652 0.944 13 4 "[ * * 1 + - 2]"
1 136 VAL 5.953 0.944 13 3 "[ . * 1 + - 2]"
1 137 GLN 4.217 0.713 20 1 "[ . 1 . +]"
1 138 PHE 2.784 0.514 8 1 "[ . + 1 . 2]"
1 139 TYR 1.936 0.127 10 0 "[ . 1 . 2]"
1 140 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 GLU 0.069 0.069 2 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 MET HA 1 2 MET HG2 . . 4.040 3.149 2.310 3.809 . 0 0 "[ . 1 . 2]" 1
2 1 2 MET HB2 1 3 SER H . . 4.460 3.639 2.335 4.657 0.197 3 0 "[ . 1 . 2]" 1
3 1 2 MET HG2 1 3 SER H . . 5.360 4.670 2.648 6.040 0.680 7 1 "[ . + 1 . 2]" 1
4 1 3 SER H 1 4 GLN H . . 4.540 3.870 2.906 4.249 . 0 0 "[ . 1 . 2]" 1
5 1 3 SER H 1 6 LEU QB . . 4.580 4.429 4.044 4.537 . 0 0 "[ . 1 . 2]" 1
6 1 3 SER HA 1 6 LEU H . . 4.820 3.876 3.635 4.148 . 0 0 "[ . 1 . 2]" 1
7 1 3 SER HA 1 6 LEU QB . . 5.070 3.487 3.059 4.041 . 0 0 "[ . 1 . 2]" 1
8 1 3 SER HA 1 6 LEU QD . . 4.260 2.172 1.986 2.723 . 0 0 "[ . 1 . 2]" 1
9 1 3 SER HA 1 7 ILE H . . 5.190 4.294 3.857 4.842 . 0 0 "[ . 1 . 2]" 1
10 1 3 SER HA 1 106 LEU QD . . 4.220 3.550 2.189 4.343 0.123 10 0 "[ . 1 . 2]" 1
11 1 3 SER HB2 1 106 LEU QD . . 4.800 4.381 3.415 5.721 0.921 18 1 "[ . 1 . + 2]" 1
12 1 4 GLN H 1 4 GLN QB . . 3.520 2.177 1.951 2.662 . 0 0 "[ . 1 . 2]" 1
13 1 4 GLN H 1 4 GLN QG . . 4.010 3.587 2.625 4.054 0.044 2 0 "[ . 1 . 2]" 1
14 1 4 GLN H 1 5 ASP H . . 3.820 2.822 2.358 3.095 . 0 0 "[ . 1 . 2]" 1
15 1 4 GLN H 1 7 ILE MD . . 5.500 3.957 3.192 5.236 . 0 0 "[ . 1 . 2]" 1
16 1 4 GLN HA 1 4 GLN QG . . 3.780 2.620 2.053 3.524 . 0 0 "[ . 1 . 2]" 1
17 1 4 GLN HA 1 7 ILE H . . 4.210 3.391 2.804 3.838 . 0 0 "[ . 1 . 2]" 1
18 1 4 GLN HA 1 7 ILE HB . . 3.270 2.468 2.038 3.325 0.055 1 0 "[ . 1 . 2]" 1
19 1 4 GLN HA 1 7 ILE MD . . 3.660 2.675 2.012 3.762 0.102 19 0 "[ . 1 . 2]" 1
20 1 4 GLN HA 1 7 ILE QG . . 4.570 3.297 2.068 4.195 . 0 0 "[ . 1 . 2]" 1
21 1 4 GLN HA 1 7 ILE MG . . 4.380 3.712 3.143 4.255 . 0 0 "[ . 1 . 2]" 1
22 1 4 GLN QB 1 4 GLN HE22 . . 4.960 3.938 3.290 4.544 . 0 0 "[ . 1 . 2]" 1
23 1 4 GLN QB 1 5 ASP H . . 3.990 2.813 2.340 3.609 . 0 0 "[ . 1 . 2]" 1
24 1 4 GLN HE21 1 7 ILE HB . . 5.370 3.684 2.406 5.398 0.028 12 0 "[ . 1 . 2]" 1
25 1 4 GLN HE21 1 7 ILE MD . . 5.220 4.740 2.719 5.630 0.410 15 0 "[ . 1 . 2]" 1
26 1 4 GLN HE21 1 7 ILE MG . . 5.500 3.965 2.364 5.552 0.052 15 0 "[ . 1 . 2]" 1
27 1 4 GLN HE21 1 8 ARG H . . 5.370 3.867 2.588 5.539 0.169 15 0 "[ . 1 . 2]" 1
28 1 4 GLN HE22 1 4 GLN QG . . 3.500 3.411 3.272 3.601 0.101 10 0 "[ . 1 . 2]" 1
29 1 4 GLN HE22 1 7 ILE MG . . 5.500 4.339 2.351 5.590 0.090 3 0 "[ . 1 . 2]" 1
30 1 4 GLN HE22 1 8 ARG H . . 5.460 4.478 3.549 5.472 0.012 18 0 "[ . 1 . 2]" 1
31 1 4 GLN QG 1 5 ASP H . . 5.100 4.107 2.265 4.732 . 0 0 "[ . 1 . 2]" 1
32 1 4 GLN QG 1 7 ILE MD . . 5.040 4.110 3.079 4.968 . 0 0 "[ . 1 . 2]" 1
33 1 5 ASP H 1 5 ASP QB . . 3.290 2.249 2.035 2.622 . 0 0 "[ . 1 . 2]" 1
34 1 5 ASP H 1 6 LEU H . . 3.900 2.812 2.538 3.054 . 0 0 "[ . 1 . 2]" 1
35 1 5 ASP QB 1 6 LEU H . . 4.010 2.460 2.014 3.101 . 0 0 "[ . 1 . 2]" 1
36 1 5 ASP QB 1 6 LEU QD . . 5.040 3.080 1.968 4.261 . 0 0 "[ . 1 . 2]" 1
37 1 5 ASP QB 1 6 LEU HG . . 5.390 4.063 2.336 5.284 . 0 0 "[ . 1 . 2]" 1
38 1 6 LEU H 1 6 LEU QB . . 3.730 2.416 1.983 2.600 . 0 0 "[ . 1 . 2]" 1
39 1 6 LEU H 1 6 LEU QD . . 4.090 2.554 1.776 3.220 . 0 0 "[ . 1 . 2]" 1
40 1 6 LEU H 1 6 LEU HG . . 3.730 2.945 1.827 3.819 0.089 5 0 "[ . 1 . 2]" 1
41 1 6 LEU H 1 7 ILE H . . 4.050 2.557 2.319 2.793 . 0 0 "[ . 1 . 2]" 1
42 1 6 LEU H 1 7 ILE QG . . 5.120 4.328 3.683 4.959 . 0 0 "[ . 1 . 2]" 1
43 1 6 LEU HA 1 6 LEU QD . . 2.890 2.409 2.089 2.943 0.053 6 0 "[ . 1 . 2]" 1
44 1 6 LEU HA 1 6 LEU HG . . 3.970 3.439 2.854 3.746 . 0 0 "[ . 1 . 2]" 1
45 1 6 LEU HA 1 9 ALA MB . . 2.690 2.436 2.071 2.794 0.104 18 0 "[ . 1 . 2]" 1
46 1 6 LEU QB 1 7 ILE H . . 4.650 2.640 2.061 3.506 . 0 0 "[ . 1 . 2]" 1
47 1 6 LEU QB 1 103 SER QB . . 5.210 2.757 1.910 4.298 . 0 0 "[ . 1 . 2]" 1
48 1 6 LEU QB 1 104 GLY HA2 . . 5.160 4.635 4.081 5.080 . 0 0 "[ . 1 . 2]" 1
49 1 6 LEU QD 1 7 ILE H . . 5.500 3.438 2.625 4.047 . 0 0 "[ . 1 . 2]" 1
50 1 6 LEU QD 1 7 ILE MD . . 3.980 3.944 3.445 4.052 0.072 4 0 "[ . 1 . 2]" 1
51 1 6 LEU QD 1 7 ILE QG . . 5.330 3.907 2.424 4.862 . 0 0 "[ . 1 . 2]" 1
52 1 6 LEU QD 1 9 ALA MB . . 4.140 3.520 2.920 4.070 . 0 0 "[ . 1 . 2]" 1
53 1 6 LEU QD 1 103 SER QB . . 5.380 3.426 1.862 4.230 . 0 0 "[ . 1 . 2]" 1
54 1 6 LEU QD 1 104 GLY H . . 4.680 3.049 2.228 4.480 . 0 0 "[ . 1 . 2]" 1
55 1 6 LEU QD 1 104 GLY HA2 . . 4.430 3.773 3.342 4.200 . 0 0 "[ . 1 . 2]" 1
56 1 6 LEU QD 1 104 GLY HA3 . . 3.710 2.557 2.087 2.939 . 0 0 "[ . 1 . 2]" 1
57 1 6 LEU QD 1 105 GLY H . . 4.450 2.856 2.079 3.858 . 0 0 "[ . 1 . 2]" 1
58 1 6 LEU QD 1 106 LEU H . . 4.650 3.951 2.745 4.451 . 0 0 "[ . 1 . 2]" 1
59 1 6 LEU QD 1 106 LEU QD . . 3.640 3.462 2.422 3.748 0.108 18 0 "[ . 1 . 2]" 1
60 1 7 ILE H 1 7 ILE HB . . 3.490 2.487 2.254 2.816 . 0 0 "[ . 1 . 2]" 1
61 1 7 ILE H 1 7 ILE MD . . 4.060 2.993 2.087 3.672 . 0 0 "[ . 1 . 2]" 1
62 1 7 ILE H 1 7 ILE QG . . 3.860 2.269 1.848 2.736 . 0 0 "[ . 1 . 2]" 1
63 1 7 ILE H 1 7 ILE MG . . 4.010 3.782 3.697 3.859 . 0 0 "[ . 1 . 2]" 1
64 1 7 ILE H 1 8 ARG H . . 3.540 2.994 2.691 3.387 . 0 0 "[ . 1 . 2]" 1
65 1 7 ILE H 1 105 GLY HA3 . . 4.840 4.908 4.819 4.936 0.096 12 0 "[ . 1 . 2]" 1
66 1 7 ILE H 1 106 LEU QD . . 4.540 4.145 3.614 4.589 0.049 15 0 "[ . 1 . 2]" 1
67 1 7 ILE HA 1 7 ILE MD . . 4.190 3.364 2.108 3.889 . 0 0 "[ . 1 . 2]" 1
68 1 7 ILE HA 1 7 ILE QG . . 3.680 2.496 2.229 3.032 . 0 0 "[ . 1 . 2]" 1
69 1 7 ILE HA 1 7 ILE MG . . 3.070 2.527 2.316 2.692 . 0 0 "[ . 1 . 2]" 1
70 1 7 ILE HA 1 9 ALA H . . 5.420 4.543 3.894 4.838 . 0 0 "[ . 1 . 2]" 1
71 1 7 ILE HA 1 10 ALA H . . 4.300 3.661 3.363 3.983 . 0 0 "[ . 1 . 2]" 1
72 1 7 ILE HA 1 106 LEU QD . . 4.060 4.047 3.615 4.196 0.136 20 0 "[ . 1 . 2]" 1
73 1 7 ILE HB 1 7 ILE MD . . 3.430 2.542 2.196 3.254 . 0 0 "[ . 1 . 2]" 1
74 1 7 ILE HB 1 8 ARG H . . 3.660 2.579 2.093 2.983 . 0 0 "[ . 1 . 2]" 1
75 1 7 ILE HB 1 65 TYR QE . . 4.990 4.616 3.696 5.073 0.083 19 0 "[ . 1 . 2]" 1
76 1 7 ILE MD 1 7 ILE MG . . 3.190 2.295 2.008 2.951 . 0 0 "[ . 1 . 2]" 1
77 1 7 ILE MD 1 8 ARG H . . 5.500 4.497 4.116 4.990 . 0 0 "[ . 1 . 2]" 1
78 1 7 ILE MD 1 65 TYR HB2 . . 5.410 4.821 3.843 6.318 0.908 11 1 "[ . 1+ . 2]" 1
79 1 7 ILE MD 1 65 TYR QD . . 4.990 3.083 2.199 4.539 . 0 0 "[ . 1 . 2]" 1
80 1 7 ILE MD 1 108 VAL QG . . 4.780 3.957 2.595 4.525 . 0 0 "[ . 1 . 2]" 1
81 1 7 ILE QG 1 7 ILE MG . . 3.320 2.227 2.088 2.632 . 0 0 "[ . 1 . 2]" 1
82 1 7 ILE QG 1 65 TYR QD . . 5.160 4.170 2.503 5.025 . 0 0 "[ . 1 . 2]" 1
83 1 7 ILE QG 1 105 GLY H . . 5.290 5.082 4.599 5.197 . 0 0 "[ . 1 . 2]" 1
84 1 7 ILE QG 1 106 LEU QD . . 3.540 2.431 1.991 3.341 . 0 0 "[ . 1 . 2]" 1
85 1 7 ILE MG 1 8 ARG H . . 4.220 3.212 2.830 3.692 . 0 0 "[ . 1 . 2]" 1
86 1 7 ILE MG 1 8 ARG HA . . 4.420 3.445 3.149 3.901 . 0 0 "[ . 1 . 2]" 1
87 1 7 ILE MG 1 10 ALA H . . 4.920 4.766 4.513 5.013 0.093 9 0 "[ . 1 . 2]" 1
88 1 7 ILE MG 1 11 PHE H . . 5.380 4.928 4.341 5.356 . 0 0 "[ . 1 . 2]" 1
89 1 7 ILE MG 1 11 PHE QD . . 3.890 3.637 3.029 3.991 0.101 3 0 "[ . 1 . 2]" 1
90 1 7 ILE MG 1 11 PHE QE . . 3.780 2.774 2.109 3.838 0.058 14 0 "[ . 1 . 2]" 1
91 1 7 ILE MG 1 65 TYR QD . . 4.550 3.591 2.797 4.267 . 0 0 "[ . 1 . 2]" 1
92 1 7 ILE MG 1 65 TYR QE . . 4.940 4.274 3.093 4.995 0.055 5 0 "[ . 1 . 2]" 1
93 1 7 ILE MG 1 108 VAL HA . . 5.500 4.900 4.269 5.590 0.090 3 0 "[ . 1 . 2]" 1
94 1 7 ILE MG 1 108 VAL QG . . 3.820 2.589 2.049 3.335 . 0 0 "[ . 1 . 2]" 1
95 1 8 ARG H 1 8 ARG HB2 . . 3.520 2.617 2.067 3.569 0.049 6 0 "[ . 1 . 2]" 1
96 1 8 ARG H 1 8 ARG HB3 . . 3.480 2.868 2.066 3.583 0.103 3 0 "[ . 1 . 2]" 1
97 1 8 ARG H 1 8 ARG QD . . 4.960 4.422 3.854 4.964 0.004 15 0 "[ . 1 . 2]" 1
98 1 8 ARG HA 1 8 ARG QD . . 4.180 3.694 2.168 4.258 0.078 11 0 "[ . 1 . 2]" 1
99 1 8 ARG HA 1 8 ARG HG2 . . 3.570 3.010 2.270 4.253 0.683 5 2 "[ + 1 . -2]" 1
100 1 8 ARG HA 1 10 ALA H . . 5.440 4.163 3.770 4.698 . 0 0 "[ . 1 . 2]" 1
101 1 8 ARG HA 1 11 PHE QD . . 4.310 3.541 2.542 4.357 0.047 5 0 "[ . 1 . 2]" 1
102 1 8 ARG HA 1 48 VAL QG . . 4.530 3.937 3.332 4.344 . 0 0 "[ . 1 . 2]" 1
103 1 8 ARG HB3 1 9 ALA MB . . 4.660 4.454 3.733 5.591 0.931 6 3 "[ .+ - 1* . 2]" 1
104 1 8 ARG QD 1 9 ALA H . . 5.250 4.524 3.544 5.347 0.097 1 0 "[ . 1 . 2]" 1
105 1 8 ARG QD 1 48 VAL QG . . 5.500 3.660 2.365 4.754 . 0 0 "[ . 1 . 2]" 1
106 1 9 ALA H 1 9 ALA MB . . 3.020 2.197 2.068 2.265 . 0 0 "[ . 1 . 2]" 1
107 1 9 ALA H 1 10 ALA H . . 3.680 2.859 2.253 3.037 . 0 0 "[ . 1 . 2]" 1
108 1 9 ALA H 1 10 ALA MB . . 5.200 4.543 3.881 4.762 . 0 0 "[ . 1 . 2]" 1
109 1 9 ALA H 1 11 PHE H . . 5.280 4.359 3.949 4.615 . 0 0 "[ . 1 . 2]" 1
110 1 9 ALA HA 1 12 GLU H . . 3.950 3.497 3.174 3.914 . 0 0 "[ . 1 . 2]" 1
111 1 9 ALA MB 1 10 ALA H . . 3.640 2.822 2.392 3.105 . 0 0 "[ . 1 . 2]" 1
112 1 9 ALA MB 1 10 ALA MB . . 4.100 3.921 3.527 4.176 0.076 1 0 "[ . 1 . 2]" 1
113 1 9 ALA MB 1 11 PHE H . . 5.500 4.580 4.362 4.815 . 0 0 "[ . 1 . 2]" 1
114 1 9 ALA MB 1 12 GLU H . . 4.970 4.731 4.517 4.989 0.019 20 0 "[ . 1 . 2]" 1
115 1 9 ALA MB 1 103 SER QB . . 4.900 3.865 2.670 4.493 . 0 0 "[ . 1 . 2]" 1
116 1 10 ALA H 1 10 ALA MB . . 3.110 2.236 2.117 2.337 . 0 0 "[ . 1 . 2]" 1
117 1 10 ALA H 1 11 PHE H . . 3.620 2.636 2.304 2.874 . 0 0 "[ . 1 . 2]" 1
118 1 10 ALA H 1 12 GLU H . . 4.690 4.356 3.932 4.750 0.060 13 0 "[ . 1 . 2]" 1
119 1 10 ALA H 1 103 SER QB . . 5.280 3.432 2.772 3.960 . 0 0 "[ . 1 . 2]" 1
120 1 10 ALA HA 1 13 LYS H . . 3.450 3.375 2.885 3.525 0.075 16 0 "[ . 1 . 2]" 1
121 1 10 ALA HA 1 13 LYS HB2 . . 3.650 2.992 2.148 3.677 0.027 10 0 "[ . 1 . 2]" 1
122 1 10 ALA HA 1 103 SER QB . . 4.270 3.765 2.901 4.251 . 0 0 "[ . 1 . 2]" 1
123 1 10 ALA MB 1 11 PHE H . . 3.400 2.749 2.323 3.094 . 0 0 "[ . 1 . 2]" 1
124 1 10 ALA MB 1 11 PHE QD . . 4.700 2.669 2.242 3.336 . 0 0 "[ . 1 . 2]" 1
125 1 10 ALA MB 1 12 GLU H . . 5.390 4.725 4.552 4.953 . 0 0 "[ . 1 . 2]" 1
126 1 10 ALA MB 1 101 MET H . . 5.290 5.062 4.338 5.369 0.079 6 0 "[ . 1 . 2]" 1
127 1 10 ALA MB 1 101 MET HA . . 4.750 4.162 2.665 4.831 0.081 14 0 "[ . 1 . 2]" 1
128 1 10 ALA MB 1 101 MET HB2 . . 3.630 2.805 2.146 3.640 0.010 18 0 "[ . 1 . 2]" 1
129 1 10 ALA MB 1 101 MET HB3 . . 3.670 2.844 2.075 3.765 0.095 2 0 "[ . 1 . 2]" 1
130 1 10 ALA MB 1 101 MET QG . . 5.220 3.276 2.096 3.943 . 0 0 "[ . 1 . 2]" 1
131 1 10 ALA MB 1 103 SER HA . . 4.890 3.524 2.192 4.460 . 0 0 "[ . 1 . 2]" 1
132 1 10 ALA MB 1 103 SER QB . . 3.370 2.142 1.937 2.455 . 0 0 "[ . 1 . 2]" 1
133 1 10 ALA MB 1 108 VAL QG . . 3.560 2.778 2.071 3.409 . 0 0 "[ . 1 . 2]" 1
134 1 11 PHE H 1 11 PHE HB2 . . 3.920 2.352 2.165 2.546 . 0 0 "[ . 1 . 2]" 1
135 1 11 PHE H 1 11 PHE HB3 . . 3.840 3.558 3.445 3.626 . 0 0 "[ . 1 . 2]" 1
136 1 11 PHE H 1 11 PHE QD . . 3.910 2.287 1.883 2.593 . 0 0 "[ . 1 . 2]" 1
137 1 11 PHE H 1 12 GLU H . . 3.530 2.632 2.388 2.904 . 0 0 "[ . 1 . 2]" 1
138 1 11 PHE HA 1 11 PHE QD . . 3.300 3.021 2.674 3.267 . 0 0 "[ . 1 . 2]" 1
139 1 11 PHE HA 1 11 PHE QE . . 5.340 4.697 4.372 4.998 . 0 0 "[ . 1 . 2]" 1
140 1 11 PHE HA 1 14 ARG H . . 4.600 3.704 3.312 4.127 . 0 0 "[ . 1 . 2]" 1
141 1 11 PHE HA 1 14 ARG QB . . 4.100 3.351 2.792 4.121 0.021 1 0 "[ . 1 . 2]" 1
142 1 11 PHE HA 1 15 LEU H . . 4.700 3.983 3.636 4.264 . 0 0 "[ . 1 . 2]" 1
143 1 11 PHE HA 1 101 MET ME . . 4.190 3.621 2.889 4.270 0.080 19 0 "[ . 1 . 2]" 1
144 1 11 PHE HB2 1 12 GLU H . . 4.630 2.669 2.302 2.985 . 0 0 "[ . 1 . 2]" 1
145 1 11 PHE HB2 1 48 VAL QG . . 4.820 3.903 3.327 4.418 . 0 0 "[ . 1 . 2]" 1
146 1 11 PHE HB3 1 12 GLU H . . 4.470 3.413 3.159 3.664 . 0 0 "[ . 1 . 2]" 1
147 1 11 PHE HB3 1 48 VAL QG . . 4.840 3.870 3.021 4.652 . 0 0 "[ . 1 . 2]" 1
148 1 11 PHE QD 1 12 GLU H . . 5.110 4.421 3.982 4.682 . 0 0 "[ . 1 . 2]" 1
149 1 11 PHE QD 1 48 VAL QG . . 3.770 2.908 2.093 3.703 . 0 0 "[ . 1 . 2]" 1
150 1 11 PHE QD 1 101 MET ME . . 3.800 3.152 2.542 3.664 . 0 0 "[ . 1 . 2]" 1
151 1 11 PHE QD 1 108 VAL QG . . 3.460 3.229 2.807 3.421 . 0 0 "[ . 1 . 2]" 1
152 1 11 PHE QE 1 48 VAL QG . . 4.540 3.019 2.014 4.263 . 0 0 "[ . 1 . 2]" 1
153 1 11 PHE QE 1 69 PHE HA . . 5.180 4.765 4.121 5.264 0.084 13 0 "[ . 1 . 2]" 1
154 1 11 PHE QE 1 69 PHE HB2 . . 5.020 2.847 2.107 5.109 0.089 20 0 "[ . 1 . 2]" 1
155 1 11 PHE QE 1 69 PHE HB3 . . 4.580 3.759 2.787 4.659 0.079 13 0 "[ . 1 . 2]" 1
156 1 11 PHE QE 1 101 MET ME . . 3.180 2.790 2.068 3.263 0.083 2 0 "[ . 1 . 2]" 1
157 1 11 PHE QE 1 108 VAL QG . . 3.380 2.131 1.900 2.444 . 0 0 "[ . 1 . 2]" 1
158 1 12 GLU H 1 12 GLU QB . . 3.520 2.350 2.037 2.739 . 0 0 "[ . 1 . 2]" 1
159 1 12 GLU H 1 12 GLU HG2 . . 4.650 3.502 1.809 4.468 . 0 0 "[ . 1 . 2]" 1
160 1 12 GLU H 1 12 GLU HG3 . . 4.290 3.308 2.102 4.515 0.225 4 0 "[ . 1 . 2]" 1
161 1 12 GLU H 1 13 LYS H . . 3.920 2.698 2.555 2.886 . 0 0 "[ . 1 . 2]" 1
162 1 12 GLU H 1 30 TRP HZ2 . . 5.010 4.491 3.791 5.028 0.018 2 0 "[ . 1 . 2]" 1
163 1 12 GLU HA 1 12 GLU HG2 . . 3.900 2.966 2.006 3.831 . 0 0 "[ . 1 . 2]" 1
164 1 12 GLU HA 1 12 GLU HG3 . . 3.770 3.043 2.372 3.860 0.090 11 0 "[ . 1 . 2]" 1
165 1 12 GLU HA 1 15 LEU H . . 4.600 3.509 2.985 4.074 . 0 0 "[ . 1 . 2]" 1
166 1 12 GLU HA 1 15 LEU HB2 . . 4.920 4.169 3.304 4.980 0.060 20 0 "[ . 1 . 2]" 1
167 1 12 GLU HA 1 15 LEU HB3 . . 4.930 3.164 2.576 3.606 . 0 0 "[ . 1 . 2]" 1
168 1 12 GLU HA 1 15 LEU QD . . 5.410 4.202 3.743 4.765 . 0 0 "[ . 1 . 2]" 1
169 1 12 GLU HA 1 30 TRP HE1 . . 4.930 4.297 3.197 4.824 . 0 0 "[ . 1 . 2]" 1
170 1 12 GLU HA 1 30 TRP HH2 . . 4.030 3.176 2.433 4.090 0.060 15 0 "[ . 1 . 2]" 1
171 1 12 GLU HA 1 30 TRP HZ2 . . 3.580 2.230 2.017 2.466 . 0 0 "[ . 1 . 2]" 1
172 1 12 GLU QB 1 13 LYS H . . 4.290 3.067 2.542 3.831 . 0 0 "[ . 1 . 2]" 1
173 1 12 GLU QB 1 13 LYS HA . . 4.630 4.190 3.710 4.526 . 0 0 "[ . 1 . 2]" 1
174 1 12 GLU HG2 1 30 TRP HZ2 . . 5.500 3.667 2.418 4.678 . 0 0 "[ . 1 . 2]" 1
175 1 12 GLU HG3 1 13 LYS H . . 4.740 4.291 2.575 5.727 0.987 16 2 "[- . 1 .+ 2]" 1
176 1 12 GLU HG3 1 30 TRP HE1 . . 5.220 4.360 2.307 6.181 0.961 20 2 "[ . 1 . - +]" 1
177 1 12 GLU HG3 1 30 TRP HZ2 . . 4.600 3.892 2.413 5.431 0.831 20 3 "[ . 1- . * +]" 1
178 1 13 LYS H 1 13 LYS HB2 . . 3.090 2.387 2.092 2.682 . 0 0 "[ . 1 . 2]" 1
179 1 13 LYS H 1 13 LYS HB3 . . 3.740 2.876 2.329 3.620 . 0 0 "[ . 1 . 2]" 1
180 1 13 LYS H 1 13 LYS HD2 . . 5.380 4.614 3.141 5.331 . 0 0 "[ . 1 . 2]" 1
181 1 13 LYS H 1 13 LYS HG2 . . 4.560 4.115 2.563 4.630 0.070 16 0 "[ . 1 . 2]" 1
182 1 13 LYS H 1 13 LYS HG3 . . 4.820 4.147 2.565 4.497 . 0 0 "[ . 1 . 2]" 1
183 1 13 LYS H 1 14 ARG H . . 3.680 2.569 2.359 2.869 . 0 0 "[ . 1 . 2]" 1
184 1 13 LYS H 1 14 ARG HA . . 5.090 5.173 5.133 5.184 0.094 4 0 "[ . 1 . 2]" 1
185 1 13 LYS H 1 15 LEU H . . 5.160 4.376 4.065 4.808 . 0 0 "[ . 1 . 2]" 1
186 1 13 LYS HA 1 13 LYS HD2 . . 3.950 3.746 2.228 4.546 0.596 4 2 "[ +. 1 - . 2]" 1
187 1 13 LYS HA 1 13 LYS HG2 . . 3.810 3.030 2.113 3.625 . 0 0 "[ . 1 . 2]" 1
188 1 13 LYS HA 1 13 LYS HG3 . . 3.840 2.756 2.041 3.803 . 0 0 "[ . 1 . 2]" 1
189 1 13 LYS HB2 1 13 LYS HD3 . . 3.430 3.232 2.420 4.041 0.611 6 2 "[ .+ 1 - . 2]" 1
190 1 13 LYS HB2 1 14 ARG H . . 3.580 3.809 2.666 4.430 0.850 18 7 "[ * . - ** +**]" 1
191 1 13 LYS HG2 1 14 ARG H . . 5.290 4.716 3.886 5.351 0.061 8 0 "[ . 1 . 2]" 1
192 1 13 LYS HG3 1 14 ARG H . . 4.800 4.996 4.733 5.374 0.574 13 4 "[ . 1- +*. * 2]" 1
193 1 14 ARG H 1 14 ARG QB . . 3.090 2.446 2.257 2.633 . 0 0 "[ . 1 . 2]" 1
194 1 14 ARG H 1 14 ARG HG2 . . 4.870 4.563 3.556 4.939 0.069 9 0 "[ . 1 . 2]" 1
195 1 14 ARG H 1 14 ARG HG3 . . 4.860 4.500 3.323 4.800 . 0 0 "[ . 1 . 2]" 1
196 1 14 ARG H 1 15 LEU H . . 3.490 2.498 2.174 3.057 . 0 0 "[ . 1 . 2]" 1
197 1 14 ARG HA 1 14 ARG QD . . 4.900 2.958 2.046 4.267 . 0 0 "[ . 1 . 2]" 1
198 1 14 ARG HA 1 14 ARG HG2 . . 3.520 3.357 2.315 3.899 0.379 2 0 "[ . 1 . 2]" 1
199 1 14 ARG HA 1 14 ARG HG3 . . 4.140 2.846 2.233 3.628 . 0 0 "[ . 1 . 2]" 1
200 1 14 ARG HA 1 17 ASP H . . 4.660 4.091 3.578 4.519 . 0 0 "[ . 1 . 2]" 1
201 1 14 ARG HA 1 17 ASP HB2 . . 3.990 3.421 2.795 4.062 0.072 10 0 "[ . 1 . 2]" 1
202 1 14 ARG HA 1 17 ASP HB3 . . 4.690 3.691 2.515 4.766 0.076 4 0 "[ . 1 . 2]" 1
203 1 14 ARG HA 1 18 TRP H . . 5.040 4.417 3.939 5.104 0.064 5 0 "[ . 1 . 2]" 1
204 1 14 ARG QB 1 15 LEU H . . 3.750 2.513 2.262 3.184 . 0 0 "[ . 1 . 2]" 1
205 1 14 ARG QD 1 94 LEU QD . . 4.920 2.595 1.864 3.601 . 0 0 "[ . 1 . 2]" 1
206 1 14 ARG QD 1 94 LEU HG . . 5.350 3.968 2.341 5.231 . 0 0 "[ . 1 . 2]" 1
207 1 14 ARG HG2 1 94 LEU QD . . 4.480 3.065 2.050 3.952 . 0 0 "[ . 1 . 2]" 1
208 1 14 ARG HG3 1 94 LEU QD . . 3.830 2.610 2.091 3.792 . 0 0 "[ . 1 . 2]" 1
209 1 15 LEU H 1 15 LEU HB2 . . 3.530 2.364 2.088 2.710 . 0 0 "[ . 1 . 2]" 1
210 1 15 LEU H 1 15 LEU HB3 . . 3.400 2.691 2.392 3.017 . 0 0 "[ . 1 . 2]" 1
211 1 15 LEU H 1 15 LEU QD . . 4.310 3.763 3.603 3.863 . 0 0 "[ . 1 . 2]" 1
212 1 15 LEU H 1 15 LEU HG . . 4.450 4.323 4.015 4.517 0.067 20 0 "[ . 1 . 2]" 1
213 1 15 LEU H 1 30 TRP HZ2 . . 4.890 4.361 3.391 4.788 . 0 0 "[ . 1 . 2]" 1
214 1 15 LEU H 1 94 LEU QD . . 4.760 4.246 3.775 4.745 . 0 0 "[ . 1 . 2]" 1
215 1 15 LEU HA 1 15 LEU QD . . 3.180 2.272 2.071 2.614 . 0 0 "[ . 1 . 2]" 1
216 1 15 LEU HA 1 15 LEU HG . . 3.930 2.896 2.397 3.446 . 0 0 "[ . 1 . 2]" 1
217 1 15 LEU HA 1 18 TRP H . . 4.300 3.645 3.297 4.040 . 0 0 "[ . 1 . 2]" 1
218 1 15 LEU HA 1 18 TRP HB2 . . 4.450 4.190 3.521 4.508 0.058 4 0 "[ . 1 . 2]" 1
219 1 15 LEU HA 1 18 TRP HB3 . . 3.920 2.930 2.471 3.302 . 0 0 "[ . 1 . 2]" 1
220 1 15 LEU HA 1 18 TRP HE3 . . 4.080 3.679 3.238 4.133 0.053 11 0 "[ . 1 . 2]" 1
221 1 15 LEU HA 1 19 ALA MB . . 5.480 4.558 4.375 5.060 . 0 0 "[ . 1 . 2]" 1
222 1 15 LEU HA 1 91 LEU QD . . 5.270 4.335 3.763 4.927 . 0 0 "[ . 1 . 2]" 1
223 1 15 LEU HA 1 94 LEU QD . . 3.790 2.876 2.265 3.363 . 0 0 "[ . 1 . 2]" 1
224 1 15 LEU HB2 1 16 SER H . . 4.330 3.804 3.482 4.123 . 0 0 "[ . 1 . 2]" 1
225 1 15 LEU HB2 1 94 LEU QD . . 5.400 4.389 3.652 5.068 . 0 0 "[ . 1 . 2]" 1
226 1 15 LEU HB3 1 16 SER H . . 3.910 2.606 2.417 2.874 . 0 0 "[ . 1 . 2]" 1
227 1 15 LEU HB3 1 30 TRP HE1 . . 5.500 5.099 3.743 5.566 0.066 20 0 "[ . 1 . 2]" 1
228 1 15 LEU HB3 1 30 TRP HH2 . . 3.830 2.714 2.357 3.474 . 0 0 "[ . 1 . 2]" 1
229 1 15 LEU HB3 1 30 TRP HZ2 . . 4.040 2.521 2.028 3.027 . 0 0 "[ . 1 . 2]" 1
230 1 15 LEU QD 1 18 TRP HB2 . . 5.500 4.748 3.943 5.286 . 0 0 "[ . 1 . 2]" 1
231 1 15 LEU QD 1 18 TRP HB3 . . 4.630 3.387 2.608 3.883 . 0 0 "[ . 1 . 2]" 1
232 1 15 LEU QD 1 18 TRP HE3 . . 3.630 2.369 2.148 2.729 . 0 0 "[ . 1 . 2]" 1
233 1 15 LEU QD 1 18 TRP HZ3 . . 3.630 2.977 2.629 3.397 . 0 0 "[ . 1 . 2]" 1
234 1 15 LEU QD 1 19 ALA MB . . 4.360 2.942 2.452 3.714 . 0 0 "[ . 1 . 2]" 1
235 1 15 LEU QD 1 30 TRP HE1 . . 5.370 4.524 3.720 5.057 . 0 0 "[ . 1 . 2]" 1
236 1 15 LEU QD 1 30 TRP HE3 . . 4.520 4.436 3.905 4.574 0.054 6 0 "[ . 1 . 2]" 1
237 1 15 LEU QD 1 30 TRP HH2 . . 3.590 2.427 2.097 2.815 . 0 0 "[ . 1 . 2]" 1
238 1 15 LEU QD 1 30 TRP HZ2 . . 3.500 2.966 2.467 3.473 . 0 0 "[ . 1 . 2]" 1
239 1 15 LEU QD 1 30 TRP HZ3 . . 3.710 3.329 2.648 3.759 0.049 18 0 "[ . 1 . 2]" 1
240 1 15 LEU QD 1 46 ALA HA . . 5.380 4.150 3.558 4.715 . 0 0 "[ . 1 . 2]" 1
241 1 15 LEU QD 1 46 ALA MB . . 3.700 2.430 1.982 2.927 . 0 0 "[ . 1 . 2]" 1
242 1 15 LEU QD 1 91 LEU QD . . 3.340 2.608 2.072 3.180 . 0 0 "[ . 1 . 2]" 1
243 1 15 LEU QD 1 94 LEU QD . . 4.030 3.399 2.243 3.977 . 0 0 "[ . 1 . 2]" 1
244 1 15 LEU HG 1 18 TRP HE3 . . 5.100 4.104 3.529 4.771 . 0 0 "[ . 1 . 2]" 1
245 1 15 LEU HG 1 19 ALA MB . . 5.500 4.164 3.156 5.279 . 0 0 "[ . 1 . 2]" 1
246 1 16 SER H 1 16 SER HB2 . . 3.440 2.284 2.085 2.505 . 0 0 "[ . 1 . 2]" 1
247 1 16 SER H 1 16 SER HB3 . . 3.400 2.884 2.479 3.515 0.115 18 0 "[ . 1 . 2]" 1
248 1 16 SER H 1 17 ASP H . . 3.630 2.587 2.394 2.734 . 0 0 "[ . 1 . 2]" 1
249 1 16 SER H 1 18 TRP H . . 4.790 4.078 3.869 4.302 . 0 0 "[ . 1 . 2]" 1
250 1 16 SER HA 1 17 ASP H . . 3.510 3.550 3.373 3.586 0.076 6 0 "[ . 1 . 2]" 1
251 1 16 SER HA 1 19 ALA MB . . 3.540 2.587 2.125 3.007 . 0 0 "[ . 1 . 2]" 1
252 1 16 SER HA 1 20 LYS H . . 4.390 3.938 3.481 4.453 0.063 10 0 "[ . 1 . 2]" 1
253 1 16 SER HB2 1 17 ASP H . . 3.810 3.454 2.611 3.898 0.088 8 0 "[ . 1 . 2]" 1
254 1 16 SER HB2 1 19 ALA MB . . 5.070 4.903 4.420 5.542 0.472 18 0 "[ . 1 . 2]" 1
255 1 16 SER HB3 1 17 ASP H . . 3.950 2.818 2.317 3.825 . 0 0 "[ . 1 . 2]" 1
256 1 16 SER HB3 1 18 TRP H . . 4.990 5.047 4.735 5.659 0.669 18 2 "[ - . 1 . + 2]" 1
257 1 17 ASP H 1 17 ASP HB2 . . 3.440 2.233 2.011 2.491 . 0 0 "[ . 1 . 2]" 1
258 1 17 ASP H 1 17 ASP HB3 . . 3.580 3.134 2.577 3.647 0.067 8 0 "[ . 1 . 2]" 1
259 1 17 ASP H 1 18 TRP H . . 3.690 2.732 2.129 2.984 . 0 0 "[ . 1 . 2]" 1
260 1 17 ASP HA 1 20 LYS H . . 4.060 3.948 3.660 4.141 0.081 8 0 "[ . 1 . 2]" 1
261 1 17 ASP HA 1 20 LYS QE . . 3.690 2.693 2.028 3.762 0.072 20 0 "[ . 1 . 2]" 1
262 1 17 ASP HA 1 20 LYS HG2 . . 3.680 2.864 2.334 3.684 0.004 16 0 "[ . 1 . 2]" 1
263 1 17 ASP HA 1 20 LYS HG3 . . 4.270 2.871 2.235 4.338 0.068 19 0 "[ . 1 . 2]" 1
264 1 17 ASP HB2 1 18 TRP H . . 3.860 3.521 2.829 3.926 0.066 1 0 "[ . 1 . 2]" 1
265 1 17 ASP HB3 1 18 TRP H . . 3.970 3.250 2.393 4.037 0.067 9 0 "[ . 1 . 2]" 1
266 1 18 TRP H 1 18 TRP HB2 . . 3.510 2.921 2.701 3.225 . 0 0 "[ . 1 . 2]" 1
267 1 18 TRP H 1 18 TRP HB3 . . 3.330 2.316 2.197 2.538 . 0 0 "[ . 1 . 2]" 1
268 1 18 TRP H 1 18 TRP HE3 . . 5.090 4.167 3.947 4.497 . 0 0 "[ . 1 . 2]" 1
269 1 18 TRP H 1 19 ALA H . . 3.430 2.482 2.004 2.745 . 0 0 "[ . 1 . 2]" 1
270 1 18 TRP H 1 19 ALA MB . . 4.500 4.187 3.646 4.560 0.060 16 0 "[ . 1 . 2]" 1
271 1 18 TRP H 1 21 ALA MB . . 5.500 4.592 4.266 4.933 . 0 0 "[ . 1 . 2]" 1
272 1 18 TRP H 1 94 LEU QD . . 4.930 3.699 3.093 4.043 . 0 0 "[ . 1 . 2]" 1
273 1 18 TRP HA 1 18 TRP HD1 . . 3.660 3.287 3.091 3.514 . 0 0 "[ . 1 . 2]" 1
274 1 18 TRP HA 1 21 ALA H . . 4.270 3.440 3.189 3.725 . 0 0 "[ . 1 . 2]" 1
275 1 18 TRP HA 1 21 ALA MB . . 2.650 2.505 2.128 2.742 0.092 17 0 "[ . 1 . 2]" 1
276 1 18 TRP HA 1 94 LEU QD . . 5.010 3.731 3.509 3.871 . 0 0 "[ . 1 . 2]" 1
277 1 18 TRP HB2 1 18 TRP HD1 . . 3.550 2.706 2.617 2.812 . 0 0 "[ . 1 . 2]" 1
278 1 18 TRP HB2 1 18 TRP HE3 . . 4.120 4.136 4.073 4.173 0.053 10 0 "[ . 1 . 2]" 1
279 1 18 TRP HB2 1 19 ALA H . . 4.150 3.972 3.851 4.115 . 0 0 "[ . 1 . 2]" 1
280 1 18 TRP HB2 1 19 ALA MB . . 5.460 5.360 5.225 5.460 0.000 1 0 "[ . 1 . 2]" 1
281 1 18 TRP HB2 1 21 ALA MB . . 5.370 4.544 4.126 4.894 . 0 0 "[ . 1 . 2]" 1
282 1 18 TRP HB2 1 94 LEU QD . . 3.900 2.133 1.942 2.385 . 0 0 "[ . 1 . 2]" 1
283 1 18 TRP HB3 1 18 TRP HE3 . . 3.860 2.608 2.529 2.671 . 0 0 "[ . 1 . 2]" 1
284 1 18 TRP HB3 1 19 ALA H . . 3.750 2.625 2.457 2.798 . 0 0 "[ . 1 . 2]" 1
285 1 18 TRP HB3 1 19 ALA HA . . 4.820 4.413 4.190 4.690 . 0 0 "[ . 1 . 2]" 1
286 1 18 TRP HB3 1 19 ALA MB . . 4.750 4.043 3.861 4.228 . 0 0 "[ . 1 . 2]" 1
287 1 18 TRP HB3 1 94 LEU QD . . 3.940 2.572 2.092 3.066 . 0 0 "[ . 1 . 2]" 1
288 1 18 TRP HD1 1 90 GLU HB3 . . 5.180 4.715 4.295 5.209 0.029 8 0 "[ . 1 . 2]" 1
289 1 18 TRP HD1 1 94 LEU QD . . 3.920 2.725 2.056 3.485 . 0 0 "[ . 1 . 2]" 1
290 1 18 TRP HE1 1 22 ARG QG . . 5.400 3.561 2.670 4.872 . 0 0 "[ . 1 . 2]" 1
291 1 18 TRP HE1 1 90 GLU HA . . 4.900 4.066 3.716 4.549 . 0 0 "[ . 1 . 2]" 1
292 1 18 TRP HE1 1 90 GLU HB2 . . 4.700 3.811 3.523 4.369 . 0 0 "[ . 1 . 2]" 1
293 1 18 TRP HE1 1 90 GLU HB3 . . 3.820 2.245 1.933 2.688 . 0 0 "[ . 1 . 2]" 1
294 1 18 TRP HE1 1 90 GLU HG2 . . 5.400 4.555 3.930 5.411 0.011 1 0 "[ . 1 . 2]" 1
295 1 18 TRP HE1 1 91 LEU H . . 4.720 4.771 4.457 4.807 0.087 17 0 "[ . 1 . 2]" 1
296 1 18 TRP HE1 1 91 LEU QD . . 5.500 4.239 3.725 5.236 . 0 0 "[ . 1 . 2]" 1
297 1 18 TRP HE1 1 94 LEU QD . . 5.500 3.991 3.199 4.839 . 0 0 "[ . 1 . 2]" 1
298 1 18 TRP HE3 1 19 ALA H . . 3.710 2.543 2.355 2.696 . 0 0 "[ . 1 . 2]" 1
299 1 18 TRP HE3 1 19 ALA HA . . 4.320 2.942 2.589 3.692 . 0 0 "[ . 1 . 2]" 1
300 1 18 TRP HE3 1 19 ALA MB . . 3.690 2.397 2.210 2.702 . 0 0 "[ . 1 . 2]" 1
301 1 18 TRP HE3 1 20 LYS H . . 5.430 5.131 4.908 5.224 . 0 0 "[ . 1 . 2]" 1
302 1 18 TRP HE3 1 44 LEU QD . . 5.120 4.076 3.582 4.518 . 0 0 "[ . 1 . 2]" 1
303 1 18 TRP HE3 1 91 LEU QD . . 4.630 3.485 2.929 4.337 . 0 0 "[ . 1 . 2]" 1
304 1 18 TRP HE3 1 94 LEU QD . . 4.600 3.884 3.141 4.538 . 0 0 "[ . 1 . 2]" 1
305 1 18 TRP HH2 1 22 ARG HD2 . . 4.770 3.625 2.720 5.127 0.357 18 0 "[ . 1 . 2]" 1
306 1 18 TRP HH2 1 26 LEU QD . . 3.570 3.027 2.124 3.674 0.104 17 0 "[ . 1 . 2]" 1
307 1 18 TRP HH2 1 26 LEU HG . . 5.270 4.676 3.484 5.330 0.060 18 0 "[ . 1 . 2]" 1
308 1 18 TRP HH2 1 87 VAL HA . . 4.670 4.272 3.524 4.690 0.020 6 0 "[ . 1 . 2]" 1
309 1 18 TRP HH2 1 87 VAL QG . . 3.760 2.517 2.160 3.018 . 0 0 "[ . 1 . 2]" 1
310 1 18 TRP HH2 1 91 LEU HA . . 5.250 5.305 5.113 5.335 0.085 9 0 "[ . 1 . 2]" 1
311 1 18 TRP HH2 1 91 LEU QD . . 5.500 2.552 2.117 3.679 . 0 0 "[ . 1 . 2]" 1
312 1 18 TRP HH2 1 91 LEU HG . . 4.910 3.692 2.831 4.860 . 0 0 "[ . 1 . 2]" 1
313 1 18 TRP HZ2 1 22 ARG HD2 . . 5.270 3.321 2.484 5.322 0.052 20 0 "[ . 1 . 2]" 1
314 1 18 TRP HZ2 1 22 ARG HD3 . . 4.720 4.509 3.849 4.800 0.080 8 0 "[ . 1 . 2]" 1
315 1 18 TRP HZ2 1 22 ARG QG . . 5.190 3.607 2.642 4.858 . 0 0 "[ . 1 . 2]" 1
316 1 18 TRP HZ2 1 44 LEU QD . . 5.340 4.824 4.068 5.235 . 0 0 "[ . 1 . 2]" 1
317 1 18 TRP HZ2 1 87 VAL QG . . 4.370 3.352 2.928 3.745 . 0 0 "[ . 1 . 2]" 1
318 1 18 TRP HZ2 1 90 GLU HB2 . . 4.420 2.495 2.233 3.151 . 0 0 "[ . 1 . 2]" 1
319 1 18 TRP HZ2 1 90 GLU HB3 . . 4.230 2.422 2.135 2.756 . 0 0 "[ . 1 . 2]" 1
320 1 18 TRP HZ2 1 90 GLU HG2 . . 4.900 4.728 4.388 4.960 0.060 8 0 "[ . 1 . 2]" 1
321 1 18 TRP HZ2 1 90 GLU HG3 . . 5.030 4.093 3.645 4.477 . 0 0 "[ . 1 . 2]" 1
322 1 18 TRP HZ2 1 91 LEU H . . 3.750 3.753 3.378 3.825 0.075 12 0 "[ . 1 . 2]" 1
323 1 18 TRP HZ2 1 91 LEU HA . . 4.600 4.412 4.013 4.660 0.060 7 0 "[ . 1 . 2]" 1
324 1 18 TRP HZ2 1 91 LEU QD . . 4.550 3.130 2.331 4.150 . 0 0 "[ . 1 . 2]" 1
325 1 18 TRP HZ2 1 91 LEU HG . . 5.420 3.965 2.665 5.488 0.068 9 0 "[ . 1 . 2]" 1
326 1 18 TRP HZ3 1 19 ALA H . . 4.940 4.617 4.333 4.818 . 0 0 "[ . 1 . 2]" 1
327 1 18 TRP HZ3 1 19 ALA MB . . 4.060 2.902 2.346 3.400 . 0 0 "[ . 1 . 2]" 1
328 1 18 TRP HZ3 1 26 LEU HB2 . . 4.050 3.793 3.147 4.156 0.106 17 0 "[ . 1 . 2]" 1
329 1 18 TRP HZ3 1 44 LEU QD . . 3.360 2.336 2.104 2.696 . 0 0 "[ . 1 . 2]" 1
330 1 18 TRP HZ3 1 44 LEU HG . . 5.500 4.953 4.342 5.570 0.070 14 0 "[ . 1 . 2]" 1
331 1 19 ALA H 1 19 ALA MB . . 3.050 2.241 2.185 2.330 . 0 0 "[ . 1 . 2]" 1
332 1 19 ALA H 1 20 LYS H . . 3.590 2.872 2.727 2.992 . 0 0 "[ . 1 . 2]" 1
333 1 19 ALA H 1 21 ALA H . . 4.910 4.084 3.961 4.294 . 0 0 "[ . 1 . 2]" 1
334 1 19 ALA H 1 21 ALA MB . . 5.430 4.853 4.616 5.088 . 0 0 "[ . 1 . 2]" 1
335 1 19 ALA HA 1 22 ARG H . . 4.160 3.602 3.340 3.822 . 0 0 "[ . 1 . 2]" 1
336 1 19 ALA HA 1 22 ARG HB2 . . 5.000 3.057 2.326 4.583 . 0 0 "[ . 1 . 2]" 1
337 1 19 ALA HA 1 22 ARG HB3 . . 4.480 4.076 3.039 4.568 0.088 12 0 "[ . 1 . 2]" 1
338 1 19 ALA HA 1 22 ARG HD2 . . 5.080 4.167 2.360 5.138 0.058 3 0 "[ . 1 . 2]" 1
339 1 19 ALA HA 1 22 ARG HD3 . . 4.830 4.702 2.862 5.171 0.341 18 0 "[ . 1 . 2]" 1
340 1 19 ALA HA 1 22 ARG QG . . 4.630 4.103 1.935 4.720 0.090 16 0 "[ . 1 . 2]" 1
341 1 19 ALA HA 1 25 ALA HA . . 5.170 4.324 3.692 4.637 . 0 0 "[ . 1 . 2]" 1
342 1 19 ALA HA 1 26 LEU H . . 4.380 3.490 3.003 3.973 . 0 0 "[ . 1 . 2]" 1
343 1 19 ALA HA 1 26 LEU QD . . 4.960 3.858 2.826 4.845 . 0 0 "[ . 1 . 2]" 1
344 1 19 ALA HA 1 28 VAL QG . . 5.500 4.455 4.075 5.148 . 0 0 "[ . 1 . 2]" 1
345 1 19 ALA MB 1 20 LYS H . . 3.570 2.687 2.420 3.037 . 0 0 "[ . 1 . 2]" 1
346 1 19 ALA MB 1 20 LYS HA . . 4.790 4.016 3.821 4.189 . 0 0 "[ . 1 . 2]" 1
347 1 19 ALA MB 1 25 ALA MB . . 4.740 4.683 4.105 4.883 0.143 17 0 "[ . 1 . 2]" 1
348 1 19 ALA MB 1 26 LEU H . . 3.980 2.991 2.532 3.292 . 0 0 "[ . 1 . 2]" 1
349 1 19 ALA MB 1 26 LEU HB2 . . 4.380 2.675 2.282 3.042 . 0 0 "[ . 1 . 2]" 1
350 1 19 ALA MB 1 26 LEU HB3 . . 4.280 3.885 3.301 4.254 . 0 0 "[ . 1 . 2]" 1
351 1 19 ALA MB 1 26 LEU QD . . 3.980 3.706 2.975 3.978 . 0 0 "[ . 1 . 2]" 1
352 1 19 ALA MB 1 28 VAL HB . . 4.590 4.076 2.411 4.660 0.070 17 0 "[ . 1 . 2]" 1
353 1 19 ALA MB 1 28 VAL QG . . 3.540 2.188 1.942 2.787 . 0 0 "[ . 1 . 2]" 1
354 1 20 LYS H 1 20 LYS HB3 . . 3.490 2.604 2.289 2.831 . 0 0 "[ . 1 . 2]" 1
355 1 20 LYS H 1 20 LYS QD . . 4.430 3.905 3.572 4.220 . 0 0 "[ . 1 . 2]" 1
356 1 20 LYS H 1 20 LYS HG2 . . 3.430 3.026 2.088 3.481 0.051 16 0 "[ . 1 . 2]" 1
357 1 20 LYS H 1 20 LYS HG3 . . 4.140 2.429 1.912 3.798 . 0 0 "[ . 1 . 2]" 1
358 1 20 LYS H 1 21 ALA H . . 3.290 2.560 2.238 2.755 . 0 0 "[ . 1 . 2]" 1
359 1 20 LYS H 1 21 ALA MB . . 4.530 4.222 3.999 4.429 . 0 0 "[ . 1 . 2]" 1
360 1 20 LYS H 1 22 ARG H . . 4.590 4.104 3.825 4.313 . 0 0 "[ . 1 . 2]" 1
361 1 20 LYS HA 1 20 LYS QD . . 4.290 4.001 3.756 4.376 0.086 17 0 "[ . 1 . 2]" 1
362 1 20 LYS HA 1 20 LYS HG3 . . 4.230 3.707 3.612 3.796 . 0 0 "[ . 1 . 2]" 1
363 1 20 LYS HA 1 22 ARG H . . 4.710 4.076 3.737 4.455 . 0 0 "[ . 1 . 2]" 1
364 1 20 LYS HA 1 25 ALA MB . . 3.360 2.700 2.279 3.453 0.093 17 0 "[ . 1 . 2]" 1
365 1 20 LYS HA 1 26 LEU H . . 4.460 4.191 3.553 4.546 0.086 17 0 "[ . 1 . 2]" 1
366 1 20 LYS HB2 1 20 LYS QD . . 3.040 2.365 2.192 2.693 . 0 0 "[ . 1 . 2]" 1
367 1 20 LYS HB2 1 20 LYS QE . . 4.130 3.642 2.416 4.208 0.078 4 0 "[ . 1 . 2]" 1
368 1 20 LYS HB3 1 21 ALA H . . 4.210 4.170 3.884 4.286 0.076 15 0 "[ . 1 . 2]" 1
369 1 20 LYS QD 1 20 LYS HG3 . . 2.590 2.280 2.111 2.467 . 0 0 "[ . 1 . 2]" 1
370 1 20 LYS HG2 1 21 ALA H . . 4.210 3.935 2.407 4.836 0.626 15 1 "[ . 1 + 2]" 1
371 1 20 LYS HG3 1 21 ALA H . . 5.150 2.645 2.253 3.267 . 0 0 "[ . 1 . 2]" 1
372 1 21 ALA H 1 21 ALA MB . . 2.920 2.275 2.182 2.426 . 0 0 "[ . 1 . 2]" 1
373 1 21 ALA H 1 22 ARG H . . 3.110 2.410 2.154 2.595 . 0 0 "[ . 1 . 2]" 1
374 1 21 ALA H 1 22 ARG HA . . 5.050 4.962 4.572 5.124 0.074 16 0 "[ . 1 . 2]" 1
375 1 21 ALA HA 1 22 ARG HA . . 5.090 4.818 4.669 4.973 . 0 0 "[ . 1 . 2]" 1
376 1 21 ALA MB 1 22 ARG H . . 3.600 3.001 2.564 3.378 . 0 0 "[ . 1 . 2]" 1
377 1 22 ARG H 1 22 ARG HB2 . . 3.730 2.259 2.034 3.424 . 0 0 "[ . 1 . 2]" 1
378 1 22 ARG H 1 22 ARG HB3 . . 3.330 3.006 2.626 3.416 0.086 12 0 "[ . 1 . 2]" 1
379 1 22 ARG H 1 22 ARG QG . . 3.640 3.468 1.825 3.735 0.095 18 0 "[ . 1 . 2]" 1
380 1 22 ARG H 1 25 ALA HA . . 4.400 3.827 3.154 4.373 . 0 0 "[ . 1 . 2]" 1
381 1 22 ARG H 1 25 ALA MB . . 4.550 4.364 3.647 4.642 0.092 8 0 "[ . 1 . 2]" 1
382 1 22 ARG HA 1 22 ARG HD2 . . 4.870 4.638 4.216 5.117 0.247 15 0 "[ . 1 . 2]" 1
383 1 22 ARG HA 1 22 ARG HD3 . . 5.020 4.472 4.252 5.109 0.089 12 0 "[ . 1 . 2]" 1
384 1 22 ARG HA 1 22 ARG QG . . 3.120 2.321 2.084 3.190 0.070 15 0 "[ . 1 . 2]" 1
385 1 22 ARG HA 1 23 THR H . . 2.830 2.359 2.162 2.688 . 0 0 "[ . 1 . 2]" 1
386 1 22 ARG HB2 1 23 THR H . . 4.320 3.952 2.490 4.276 . 0 0 "[ . 1 . 2]" 1
387 1 22 ARG HB2 1 25 ALA HA . . 4.390 3.697 2.483 4.364 . 0 0 "[ . 1 . 2]" 1
388 1 22 ARG HB3 1 22 ARG HD3 . . 3.310 2.536 2.084 3.745 0.435 12 0 "[ . 1 . 2]" 1
389 1 22 ARG HB3 1 23 THR H . . 3.140 3.193 2.803 3.735 0.595 15 1 "[ . 1 + 2]" 1
390 1 22 ARG HB3 1 25 ALA HA . . 4.250 3.020 2.106 4.497 0.247 15 0 "[ . 1 . 2]" 1
391 1 22 ARG HB3 1 26 LEU H . . 5.250 3.936 3.243 6.182 0.932 12 1 "[ . 1 + . 2]" 1
392 1 22 ARG HB3 1 26 LEU QD . . 5.500 3.732 2.623 4.922 . 0 0 "[ . 1 . 2]" 1
393 1 22 ARG HD2 1 26 LEU QD . . 4.050 2.640 1.944 3.926 . 0 0 "[ . 1 . 2]" 1
394 1 22 ARG HD2 1 26 LEU HG . . 4.460 4.137 3.213 4.559 0.099 20 0 "[ . 1 . 2]" 1
395 1 22 ARG HD3 1 25 ALA H . . 3.890 3.812 2.492 4.267 0.377 18 0 "[ . 1 . 2]" 1
396 1 22 ARG HD3 1 25 ALA HA . . 4.860 4.334 2.524 5.143 0.283 18 0 "[ . 1 . 2]" 1
397 1 22 ARG HD3 1 26 LEU QD . . 4.720 2.599 2.033 3.625 . 0 0 "[ . 1 . 2]" 1
398 1 22 ARG HD3 1 26 LEU HG . . 5.190 3.808 2.264 5.026 . 0 0 "[ . 1 . 2]" 1
399 1 22 ARG QG 1 23 THR H . . 3.880 2.370 1.825 3.987 0.107 12 0 "[ . 1 . 2]" 1
400 1 22 ARG QG 1 23 THR HA . . 5.460 4.788 4.371 5.559 0.099 11 0 "[ . 1 . 2]" 1
401 1 22 ARG QG 1 23 THR HB . . 5.500 4.003 2.998 5.607 0.107 12 0 "[ . 1 . 2]" 1
402 1 23 THR H 1 23 THR HB . . 2.770 2.394 2.107 2.830 0.060 1 0 "[ . 1 . 2]" 1
403 1 23 THR H 1 23 THR MG . . 3.980 3.604 1.726 3.771 . 0 0 "[ . 1 . 2]" 1
404 1 23 THR H 1 24 PRO HG2 . . 5.390 4.722 4.328 5.229 . 0 0 "[ . 1 . 2]" 1
405 1 23 THR HA 1 23 THR MG . . 3.120 2.501 2.277 3.189 0.069 1 0 "[ . 1 . 2]" 1
406 1 23 THR MG 1 24 PRO HB2 . . 5.370 5.011 4.603 5.425 0.055 4 0 "[ . 1 . 2]" 1
407 1 23 THR MG 1 24 PRO HB3 . . 5.330 3.906 3.320 4.734 . 0 0 "[ . 1 . 2]" 1
408 1 23 THR MG 1 24 PRO HD2 . . 5.080 3.422 2.140 3.731 . 0 0 "[ . 1 . 2]" 1
409 1 23 THR MG 1 24 PRO HD3 . . 5.000 2.436 2.077 2.957 . 0 0 "[ . 1 . 2]" 1
410 1 23 THR MG 1 25 ALA H . . 4.250 4.364 4.347 4.373 0.123 4 0 "[ . 1 . 2]" 1
411 1 24 PRO HB2 1 25 ALA H . . 3.610 3.683 3.604 3.696 0.086 17 0 "[ . 1 . 2]" 1
412 1 24 PRO HB3 1 25 ALA H . . 4.430 4.299 4.119 4.409 . 0 0 "[ . 1 . 2]" 1
413 1 24 PRO HB3 1 25 ALA MB . . 5.500 5.589 5.561 5.609 0.109 16 0 "[ . 1 . 2]" 1
414 1 25 ALA H 1 25 ALA MB . . 2.870 2.741 2.560 2.949 0.079 14 0 "[ . 1 . 2]" 1
415 1 25 ALA H 1 26 LEU H . . 4.630 3.891 3.492 4.545 . 0 0 "[ . 1 . 2]" 1
416 1 25 ALA HA 1 26 LEU H . . 2.860 2.200 2.017 2.466 . 0 0 "[ . 1 . 2]" 1
417 1 25 ALA HA 1 26 LEU QD . . 5.500 3.750 2.999 4.578 . 0 0 "[ . 1 . 2]" 1
418 1 25 ALA MB 1 26 LEU H . . 3.350 3.283 2.449 3.458 0.108 20 0 "[ . 1 . 2]" 1
419 1 25 ALA MB 1 26 LEU HA . . 5.110 4.388 3.933 4.572 . 0 0 "[ . 1 . 2]" 1
420 1 26 LEU H 1 26 LEU HB2 . . 3.970 2.553 2.344 2.725 . 0 0 "[ . 1 . 2]" 1
421 1 26 LEU H 1 26 LEU HB3 . . 3.700 3.704 3.597 3.772 0.072 12 0 "[ . 1 . 2]" 1
422 1 26 LEU H 1 26 LEU QD . . 4.030 2.862 2.112 3.740 . 0 0 "[ . 1 . 2]" 1
423 1 26 LEU H 1 26 LEU HG . . 4.180 3.542 2.357 4.261 0.081 17 0 "[ . 1 . 2]" 1
424 1 26 LEU HA 1 26 LEU QD . . 3.150 2.127 2.038 2.252 . 0 0 "[ . 1 . 2]" 1
425 1 26 LEU HA 1 27 PRO HD2 . . 3.170 2.375 2.117 2.730 . 0 0 "[ . 1 . 2]" 1
426 1 26 LEU HA 1 27 PRO HG3 . . 4.610 4.586 4.488 4.668 0.058 14 0 "[ . 1 . 2]" 1
427 1 26 LEU HB2 1 27 PRO HD2 . . 4.240 3.918 3.670 4.256 0.016 9 0 "[ . 1 . 2]" 1
428 1 26 LEU HB3 1 27 PRO HD2 . . 4.420 2.413 2.122 2.885 . 0 0 "[ . 1 . 2]" 1
429 1 26 LEU QD 1 27 PRO HD2 . . 3.730 2.687 2.137 3.151 . 0 0 "[ . 1 . 2]" 1
430 1 26 LEU QD 1 42 VAL HA . . 5.330 4.845 4.270 5.314 . 0 0 "[ . 1 . 2]" 1
431 1 26 LEU QD 1 42 VAL HB . . 3.770 3.392 2.504 3.837 0.067 13 0 "[ . 1 . 2]" 1
432 1 26 LEU QD 1 87 VAL HA . . 5.430 4.977 4.040 5.365 . 0 0 "[ . 1 . 2]" 1
433 1 26 LEU QD 1 87 VAL QG . . 3.290 2.834 2.285 3.184 . 0 0 "[ . 1 . 2]" 1
434 1 27 PRO HA 1 28 VAL H . . 2.810 2.406 2.286 2.728 . 0 0 "[ . 1 . 2]" 1
435 1 27 PRO HB2 1 28 VAL H . . 4.150 2.827 2.437 3.158 . 0 0 "[ . 1 . 2]" 1
436 1 27 PRO HB3 1 28 VAL H . . 3.800 3.713 3.476 3.869 0.069 9 0 "[ . 1 . 2]" 1
437 1 27 PRO HD2 1 43 TYR HB2 . . 4.860 4.537 4.128 4.905 0.045 9 0 "[ . 1 . 2]" 1
438 1 27 PRO HD2 1 43 TYR HB3 . . 4.730 4.334 3.778 4.806 0.076 14 0 "[ . 1 . 2]" 1
439 1 27 PRO HG2 1 43 TYR HB2 . . 4.570 2.758 2.290 3.444 . 0 0 "[ . 1 . 2]" 1
440 1 27 PRO HG3 1 38 PRO HA . . 3.310 3.006 2.090 3.383 0.073 8 0 "[ . 1 . 2]" 1
441 1 27 PRO HG3 1 43 TYR HB3 . . 4.830 3.170 2.463 3.952 . 0 0 "[ . 1 . 2]" 1
442 1 28 VAL H 1 28 VAL HB . . 3.360 2.804 2.537 3.311 . 0 0 "[ . 1 . 2]" 1
443 1 28 VAL H 1 28 VAL QG . . 3.420 2.700 2.101 3.016 . 0 0 "[ . 1 . 2]" 1
444 1 28 VAL H 1 29 ALA H . . 5.040 3.929 3.451 4.386 . 0 0 "[ . 1 . 2]" 1
445 1 28 VAL H 1 29 ALA HA . . 4.520 4.550 4.430 4.602 0.082 4 0 "[ . 1 . 2]" 1
446 1 28 VAL HA 1 28 VAL QG . . 3.280 2.184 2.115 2.339 . 0 0 "[ . 1 . 2]" 1
447 1 28 VAL HA 1 29 ALA H . . 3.120 2.255 2.106 2.583 . 0 0 "[ . 1 . 2]" 1
448 1 28 VAL HA 1 29 ALA MB . . 4.480 4.131 3.964 4.317 . 0 0 "[ . 1 . 2]" 1
449 1 28 VAL HA 1 44 LEU HB2 . . 4.170 3.134 2.293 3.892 . 0 0 "[ . 1 . 2]" 1
450 1 28 VAL HA 1 44 LEU HB3 . . 4.520 3.666 2.448 4.574 0.054 7 0 "[ . 1 . 2]" 1
451 1 28 VAL HA 1 44 LEU QD . . 4.900 3.724 2.976 4.654 . 0 0 "[ . 1 . 2]" 1
452 1 28 VAL HA 1 46 ALA MB . . 5.100 4.108 3.337 5.061 . 0 0 "[ . 1 . 2]" 1
453 1 28 VAL HB 1 29 ALA H . . 4.710 4.434 3.727 4.601 . 0 0 "[ . 1 . 2]" 1
454 1 28 VAL HB 1 30 TRP HE1 . . 4.480 3.795 2.586 4.566 0.086 1 0 "[ . 1 . 2]" 1
455 1 28 VAL QG 1 29 ALA H . . 3.990 3.232 2.054 3.757 . 0 0 "[ . 1 . 2]" 1
456 1 28 VAL QG 1 29 ALA HA . . 5.500 4.143 3.395 4.418 . 0 0 "[ . 1 . 2]" 1
457 1 28 VAL QG 1 30 TRP HD1 . . 5.280 3.586 2.925 4.322 . 0 0 "[ . 1 . 2]" 1
458 1 28 VAL QG 1 30 TRP HE1 . . 4.500 2.714 2.001 3.346 . 0 0 "[ . 1 . 2]" 1
459 1 28 VAL QG 1 30 TRP HH2 . . 5.290 3.983 3.409 4.697 . 0 0 "[ . 1 . 2]" 1
460 1 28 VAL QG 1 30 TRP HZ2 . . 5.300 2.802 2.468 3.412 . 0 0 "[ . 1 . 2]" 1
461 1 28 VAL QG 1 44 LEU HB2 . . 4.720 3.608 2.881 4.207 . 0 0 "[ . 1 . 2]" 1
462 1 28 VAL QG 1 46 ALA H . . 5.410 4.282 3.512 5.229 . 0 0 "[ . 1 . 2]" 1
463 1 29 ALA H 1 29 ALA MB . . 3.390 2.347 2.176 2.797 . 0 0 "[ . 1 . 2]" 1
464 1 29 ALA H 1 44 LEU HB3 . . 5.270 4.193 3.163 5.275 0.005 7 0 "[ . 1 . 2]" 1
465 1 29 ALA H 1 45 ARG HA . . 3.990 3.654 3.010 4.062 0.072 7 0 "[ . 1 . 2]" 1
466 1 29 ALA H 1 46 ALA H . . 4.580 3.604 2.938 4.628 0.048 19 0 "[ . 1 . 2]" 1
467 1 29 ALA HA 1 30 TRP H . . 2.920 2.267 2.185 2.419 . 0 0 "[ . 1 . 2]" 1
468 1 29 ALA HA 1 30 TRP HD1 . . 5.110 4.382 3.927 5.070 . 0 0 "[ . 1 . 2]" 1
469 1 29 ALA HA 1 35 PHE HB2 . . 4.410 3.558 2.622 4.412 0.002 20 0 "[ . 1 . 2]" 1
470 1 29 ALA HA 1 35 PHE HB3 . . 5.110 3.424 2.315 4.904 . 0 0 "[ . 1 . 2]" 1
471 1 29 ALA HA 1 35 PHE QD . . 4.530 3.865 2.287 4.620 0.090 2 0 "[ . 1 . 2]" 1
472 1 29 ALA MB 1 30 TRP H . . 3.770 3.452 2.557 3.691 . 0 0 "[ . 1 . 2]" 1
473 1 29 ALA MB 1 33 THR HB . . 5.130 4.658 3.426 5.221 0.091 11 0 "[ . 1 . 2]" 1
474 1 29 ALA MB 1 33 THR MG . . 4.890 3.916 2.447 5.018 0.128 15 0 "[ . 1 . 2]" 1
475 1 29 ALA MB 1 35 PHE HB2 . . 3.890 2.670 2.222 4.211 0.321 12 0 "[ . 1 . 2]" 1
476 1 29 ALA MB 1 35 PHE HB3 . . 4.180 2.861 2.072 3.938 . 0 0 "[ . 1 . 2]" 1
477 1 29 ALA MB 1 35 PHE QD . . 3.870 3.041 2.398 3.974 0.104 7 0 "[ . 1 . 2]" 1
478 1 29 ALA MB 1 45 ARG HA . . 3.710 2.437 2.091 2.969 . 0 0 "[ . 1 . 2]" 1
479 1 29 ALA MB 1 45 ARG HB2 . . 4.830 4.660 3.963 5.540 0.710 13 1 "[ . 1 + . 2]" 1
480 1 29 ALA MB 1 45 ARG HB3 . . 5.500 4.599 3.936 5.501 0.001 15 0 "[ . 1 . 2]" 1
481 1 29 ALA MB 1 45 ARG HG2 . . 3.840 3.482 2.186 4.471 0.631 11 4 "[ .** 1+ - 2]" 1
482 1 29 ALA MB 1 45 ARG HG3 . . 4.380 3.329 2.317 4.473 0.093 13 0 "[ . 1 . 2]" 1
483 1 29 ALA MB 1 46 ALA H . . 4.350 3.330 2.871 4.085 . 0 0 "[ . 1 . 2]" 1
484 1 30 TRP H 1 30 TRP HB2 . . 3.590 2.492 2.381 2.683 . 0 0 "[ . 1 . 2]" 1
485 1 30 TRP H 1 30 TRP HB3 . . 3.910 3.600 3.513 3.764 . 0 0 "[ . 1 . 2]" 1
486 1 30 TRP H 1 30 TRP HD1 . . 3.810 2.844 2.486 3.879 0.069 4 0 "[ . 1 . 2]" 1
487 1 30 TRP H 1 30 TRP HE3 . . 5.110 5.020 4.648 5.187 0.077 19 0 "[ . 1 . 2]" 1
488 1 30 TRP H 1 31 GLN H . . 4.880 4.399 2.525 4.634 . 0 0 "[ . 1 . 2]" 1
489 1 30 TRP H 1 33 THR MG . . 5.500 2.828 1.776 3.675 . 0 0 "[ . 1 . 2]" 1
490 1 30 TRP HA 1 30 TRP HE3 . . 3.980 2.762 2.356 3.051 . 0 0 "[ . 1 . 2]" 1
491 1 30 TRP HA 1 30 TRP HZ3 . . 4.960 4.925 4.557 5.041 0.081 15 0 "[ . 1 . 2]" 1
492 1 30 TRP HA 1 31 GLN H . . 3.240 2.513 2.169 2.945 . 0 0 "[ . 1 . 2]" 1
493 1 30 TRP HA 1 31 GLN HA . . 5.000 4.454 4.095 4.917 . 0 0 "[ . 1 . 2]" 1
494 1 30 TRP HA 1 31 GLN QB . . 4.930 4.621 4.005 4.901 . 0 0 "[ . 1 . 2]" 1
495 1 30 TRP HA 1 46 ALA H . . 4.090 3.749 3.162 4.165 0.075 12 0 "[ . 1 . 2]" 1
496 1 30 TRP HA 1 46 ALA MB . . 4.440 2.700 2.096 3.652 . 0 0 "[ . 1 . 2]" 1
497 1 30 TRP HB2 1 30 TRP HD1 . . 3.750 2.633 2.511 2.760 . 0 0 "[ . 1 . 2]" 1
498 1 30 TRP HB2 1 31 GLN H . . 4.740 3.588 3.009 4.509 . 0 0 "[ . 1 . 2]" 1
499 1 30 TRP HB2 1 31 GLN QG . . 5.360 5.292 4.246 5.457 0.097 4 0 "[ . 1 . 2]" 1
500 1 30 TRP HB2 1 33 THR HB . . 4.790 2.529 1.976 3.117 . 0 0 "[ . 1 . 2]" 1
501 1 30 TRP HB2 1 33 THR MG . . 4.280 3.082 2.438 3.521 . 0 0 "[ . 1 . 2]" 1
502 1 30 TRP HB3 1 30 TRP HE3 . . 4.030 2.735 2.505 3.009 . 0 0 "[ . 1 . 2]" 1
503 1 30 TRP HB3 1 31 GLN H . . 4.490 2.650 1.886 4.420 . 0 0 "[ . 1 . 2]" 1
504 1 30 TRP HB3 1 31 GLN QG . . 5.220 4.164 2.888 4.986 . 0 0 "[ . 1 . 2]" 1
505 1 30 TRP HB3 1 33 THR HB . . 4.880 4.046 3.617 4.573 . 0 0 "[ . 1 . 2]" 1
506 1 30 TRP HB3 1 33 THR MG . . 4.610 4.471 3.931 4.710 0.100 3 0 "[ . 1 . 2]" 1
507 1 30 TRP HD1 1 33 THR HB . . 4.200 3.851 2.394 4.275 0.075 4 0 "[ . 1 . 2]" 1
508 1 30 TRP HD1 1 33 THR MG . . 5.000 3.019 2.115 4.203 . 0 0 "[ . 1 . 2]" 1
509 1 30 TRP HE1 1 46 ALA MB . . 5.500 5.232 4.466 5.582 0.082 20 0 "[ . 1 . 2]" 1
510 1 30 TRP HE3 1 31 GLN H . . 5.000 3.691 3.193 5.068 0.068 4 0 "[ . 1 . 2]" 1
511 1 30 TRP HE3 1 31 GLN QB . . 5.220 5.147 4.616 5.321 0.101 15 0 "[ . 1 . 2]" 1
512 1 30 TRP HE3 1 31 GLN QG . . 5.090 4.395 3.523 5.142 0.052 8 0 "[ . 1 . 2]" 1
513 1 30 TRP HE3 1 48 VAL HB . . 5.100 4.687 3.642 5.195 0.095 15 0 "[ . 1 . 2]" 1
514 1 30 TRP HE3 1 48 VAL QG . . 5.390 2.705 2.014 3.834 . 0 0 "[ . 1 . 2]" 1
515 1 30 TRP HH2 1 46 ALA MB . . 4.150 4.115 3.742 4.257 0.107 2 0 "[ . 1 . 2]" 1
516 1 30 TRP HZ3 1 48 VAL QG . . 3.600 2.635 2.123 3.544 . 0 0 "[ . 1 . 2]" 1
517 1 31 GLN H 1 31 GLN QB . . 3.910 2.604 2.275 3.358 . 0 0 "[ . 1 . 2]" 1
518 1 31 GLN H 1 31 GLN HE21 . . 5.270 5.129 3.762 5.363 0.093 4 0 "[ . 1 . 2]" 1
519 1 31 GLN H 1 31 GLN QG . . 4.200 2.420 2.095 2.978 . 0 0 "[ . 1 . 2]" 1
520 1 31 GLN HA 1 31 GLN HE21 . . 4.930 4.645 3.231 5.003 0.073 9 0 "[ . 1 . 2]" 1
521 1 31 GLN HA 1 31 GLN QG . . 3.970 2.460 2.209 3.383 . 0 0 "[ . 1 . 2]" 1
522 1 31 GLN HA 1 33 THR H . . 5.240 4.205 3.508 5.222 . 0 0 "[ . 1 . 2]" 1
523 1 31 GLN HA 1 47 TYR QD . . 4.550 3.774 2.751 4.662 0.112 10 0 "[ . 1 . 2]" 1
524 1 31 GLN HA 1 47 TYR QE . . 5.180 4.103 2.280 5.277 0.097 10 0 "[ . 1 . 2]" 1
525 1 31 GLN QB 1 31 GLN HE22 . . 4.720 3.808 3.263 4.158 . 0 0 "[ . 1 . 2]" 1
526 1 31 GLN QB 1 32 ASN H . . 3.610 2.582 1.912 3.233 . 0 0 "[ . 1 . 2]" 1
527 1 31 GLN QB 1 32 ASN HA . . 4.530 4.292 3.661 4.615 0.085 4 0 "[ . 1 . 2]" 1
528 1 31 GLN QB 1 33 THR H . . 4.430 4.239 3.436 4.540 0.110 14 0 "[ . 1 . 2]" 1
529 1 31 GLN QB 1 47 TYR QD . . 4.840 4.381 2.687 4.903 0.063 18 0 "[ . 1 . 2]" 1
530 1 31 GLN HE21 1 47 TYR QD . . 4.070 3.491 2.422 4.158 0.088 3 0 "[ . 1 . 2]" 1
531 1 31 GLN HE21 1 47 TYR QE . . 4.270 2.942 2.283 4.348 0.078 1 0 "[ . 1 . 2]" 1
532 1 31 GLN HE21 1 48 VAL H . . 5.330 3.682 2.380 5.029 . 0 0 "[ . 1 . 2]" 1
533 1 31 GLN HE22 1 47 TYR QD . . 5.120 4.410 3.461 5.193 0.073 17 0 "[ . 1 . 2]" 1
534 1 31 GLN HE22 1 47 TYR QE . . 4.250 3.650 3.096 4.340 0.090 17 0 "[ . 1 . 2]" 1
535 1 31 GLN HE22 1 48 VAL H . . 4.840 4.281 2.640 5.285 0.445 10 0 "[ . 1 . 2]" 1
536 1 31 GLN QG 1 32 ASN H . . 4.480 4.082 3.738 4.514 0.034 10 0 "[ . 1 . 2]" 1
537 1 31 GLN QG 1 32 ASN HD21 . . 5.420 4.720 3.150 5.512 0.092 11 0 "[ . 1 . 2]" 1
538 1 31 GLN QG 1 32 ASN HD22 . . 5.500 5.072 4.168 5.578 0.078 7 0 "[ . 1 . 2]" 1
539 1 31 GLN QG 1 47 TYR HB2 . . 4.400 4.254 3.748 4.507 0.107 9 0 "[ . 1 . 2]" 1
540 1 31 GLN QG 1 47 TYR QE . . 4.840 3.093 2.220 4.633 . 0 0 "[ . 1 . 2]" 1
541 1 32 ASN H 1 32 ASN HB2 . . 4.110 3.180 2.540 3.816 . 0 0 "[ . 1 . 2]" 1
542 1 32 ASN H 1 32 ASN HD21 . . 5.260 3.494 2.070 4.336 . 0 0 "[ . 1 . 2]" 1
543 1 32 ASN H 1 33 THR H . . 3.460 2.783 1.885 3.308 . 0 0 "[ . 1 . 2]" 1
544 1 32 ASN HA 1 32 ASN HD21 . . 3.970 3.616 2.072 4.060 0.090 16 0 "[ . 1 . 2]" 1
545 1 32 ASN HA 1 32 ASN HD22 . . 4.360 4.219 3.597 4.441 0.081 6 0 "[ . 1 . 2]" 1
546 1 32 ASN HA 1 33 THR H . . 3.390 3.121 2.526 3.466 0.076 4 0 "[ . 1 . 2]" 1
547 1 32 ASN HB2 1 32 ASN HD21 . . 3.430 2.553 2.094 3.714 0.284 3 0 "[ . 1 . 2]" 1
548 1 32 ASN HB2 1 32 ASN HD22 . . 3.900 3.673 3.496 4.153 0.253 3 0 "[ . 1 . 2]" 1
549 1 32 ASN HB2 1 33 THR H . . 4.320 3.880 2.720 4.387 0.067 14 0 "[ . 1 . 2]" 1
550 1 33 THR H 1 33 THR HB . . 3.500 2.444 2.259 2.800 . 0 0 "[ . 1 . 2]" 1
551 1 33 THR H 1 33 THR MG . . 3.860 3.218 2.247 3.930 0.070 19 0 "[ . 1 . 2]" 1
552 1 33 THR H 1 34 LYS H . . 4.670 4.542 4.377 4.627 . 0 0 "[ . 1 . 2]" 1
553 1 33 THR HA 1 33 THR MG . . 3.270 2.768 2.345 3.276 0.006 11 0 "[ . 1 . 2]" 1
554 1 33 THR HA 1 34 LYS H . . 2.930 2.418 2.101 2.679 . 0 0 "[ . 1 . 2]" 1
555 1 33 THR HB 1 34 LYS H . . 3.860 3.786 3.315 3.942 0.082 13 0 "[ . 1 . 2]" 1
556 1 33 THR MG 1 34 LYS H . . 3.790 2.449 1.880 3.136 . 0 0 "[ . 1 . 2]" 1
557 1 33 THR MG 1 34 LYS QB . . 4.260 4.003 3.257 4.386 0.126 14 0 "[ . 1 . 2]" 1
558 1 33 THR MG 1 35 PHE QD . . 5.060 3.608 2.127 5.144 0.084 17 0 "[ . 1 . 2]" 1
559 1 34 LYS H 1 34 LYS QB . . 3.040 2.520 2.039 3.129 0.089 3 0 "[ . 1 . 2]" 1
560 1 34 LYS H 1 34 LYS QD . . 5.170 3.671 2.085 5.062 . 0 0 "[ . 1 . 2]" 1
561 1 34 LYS H 1 34 LYS HG2 . . 4.580 3.624 1.917 4.813 0.233 1 0 "[ . 1 . 2]" 1
562 1 34 LYS H 1 34 LYS HG3 . . 4.740 3.728 1.756 4.673 . 0 0 "[ . 1 . 2]" 1
563 1 34 LYS HA 1 34 LYS HG2 . . 4.040 3.396 2.270 4.090 0.050 14 0 "[ . 1 . 2]" 1
564 1 34 LYS HA 1 34 LYS HG3 . . 3.400 3.141 2.280 4.111 0.711 16 4 "[ * .* 1 - .+ 2]" 1
565 1 34 LYS HA 1 35 PHE H . . 2.730 2.306 2.192 2.575 . 0 0 "[ . 1 . 2]" 1
566 1 34 LYS QB 1 35 PHE H . . 3.790 3.309 2.595 3.897 0.107 14 0 "[ . 1 . 2]" 1
567 1 34 LYS QD 1 34 LYS HG2 . . 2.600 2.265 2.122 2.541 . 0 0 "[ . 1 . 2]" 1
568 1 34 LYS QE 1 35 PHE QD . . 5.500 5.192 3.727 5.618 0.118 13 0 "[ . 1 . 2]" 1
569 1 34 LYS HG3 1 35 PHE H . . 5.180 4.422 2.705 5.236 0.056 7 0 "[ . 1 . 2]" 1
570 1 35 PHE H 1 35 PHE HB2 . . 3.790 3.515 2.656 3.879 0.089 11 0 "[ . 1 . 2]" 1
571 1 35 PHE H 1 35 PHE HB3 . . 3.550 3.258 2.561 3.725 0.175 18 0 "[ . 1 . 2]" 1
572 1 35 PHE H 1 35 PHE QD . . 4.510 3.130 2.089 4.488 . 0 0 "[ . 1 . 2]" 1
573 1 35 PHE H 1 36 THR H . . 5.000 3.954 1.993 4.628 . 0 0 "[ . 1 . 2]" 1
574 1 35 PHE HA 1 35 PHE QD . . 4.440 3.428 2.187 3.812 . 0 0 "[ . 1 . 2]" 1
575 1 35 PHE HA 1 36 THR H . . 2.920 2.473 2.154 3.002 0.082 19 0 "[ . 1 . 2]" 1
576 1 35 PHE HB2 1 36 THR H . . 4.350 3.281 2.065 4.734 0.384 12 0 "[ . 1 . 2]" 1
577 1 35 PHE HB3 1 36 THR H . . 4.980 3.872 3.364 4.593 . 0 0 "[ . 1 . 2]" 1
578 1 35 PHE QD 1 36 THR H . . 4.210 3.429 2.761 4.301 0.091 7 0 "[ . 1 . 2]" 1
579 1 36 THR H 1 36 THR HB . . 3.280 3.148 2.638 3.362 0.082 1 0 "[ . 1 . 2]" 1
580 1 36 THR H 1 36 THR MG . . 4.190 3.721 2.407 4.083 . 0 0 "[ . 1 . 2]" 1
581 1 36 THR HA 1 36 THR MG . . 3.150 3.085 2.345 3.244 0.094 1 0 "[ . 1 . 2]" 1
582 1 36 THR MG 1 37 PRO HD3 . . 3.520 3.326 2.817 3.599 0.079 1 0 "[ . 1 . 2]" 1
583 1 38 PRO HA 1 39 ALA H . . 2.750 2.591 2.405 2.754 0.004 9 0 "[ . 1 . 2]" 1
584 1 38 PRO HB2 1 39 ALA H . . 4.090 2.204 1.871 2.398 . 0 0 "[ . 1 . 2]" 1
585 1 38 PRO HB2 1 39 ALA HA . . 4.250 4.336 4.321 4.350 0.100 8 0 "[ . 1 . 2]" 1
586 1 38 PRO HG2 1 39 ALA HA . . 5.260 5.030 4.590 5.327 0.067 19 0 "[ . 1 . 2]" 1
587 1 38 PRO HG2 1 40 ALA H . . 4.450 3.468 2.907 4.188 . 0 0 "[ . 1 . 2]" 1
588 1 38 PRO HG2 1 40 ALA HA . . 4.810 4.060 3.370 4.882 0.072 13 0 "[ . 1 . 2]" 1
589 1 38 PRO HG2 1 41 GLY H . . 5.070 2.370 1.801 3.179 . 0 0 "[ . 1 . 2]" 1
590 1 38 PRO HG2 1 41 GLY HA2 . . 4.430 3.235 2.381 4.497 0.067 11 0 "[ . 1 . 2]" 1
591 1 38 PRO HG2 1 43 TYR QD . . 4.710 4.610 3.953 4.799 0.089 17 0 "[ . 1 . 2]" 1
592 1 39 ALA H 1 39 ALA MB . . 2.940 2.280 2.010 2.432 . 0 0 "[ . 1 . 2]" 1
593 1 39 ALA H 1 40 ALA H . . 3.420 3.352 2.441 3.510 0.090 16 0 "[ . 1 . 2]" 1
594 1 39 ALA H 1 41 GLY H . . 5.410 3.819 3.185 4.665 . 0 0 "[ . 1 . 2]" 1
595 1 39 ALA H 1 42 VAL HB . . 4.260 4.059 3.763 4.348 0.088 8 0 "[ . 1 . 2]" 1
596 1 39 ALA HA 1 40 ALA H . . 3.230 2.417 2.201 3.314 0.084 12 0 "[ . 1 . 2]" 1
597 1 39 ALA HA 1 40 ALA MB . . 3.890 3.823 3.452 4.022 0.132 8 0 "[ . 1 . 2]" 1
598 1 39 ALA MB 1 43 TYR QD . . 5.240 5.233 4.773 5.378 0.138 8 0 "[ . 1 . 2]" 1
599 1 40 ALA H 1 40 ALA MB . . 3.100 2.859 2.642 3.067 . 0 0 "[ . 1 . 2]" 1
600 1 40 ALA HA 1 41 GLY H . . 2.950 2.715 2.341 3.025 0.075 20 0 "[ . 1 . 2]" 1
601 1 40 ALA MB 1 41 GLY H . . 3.700 3.682 3.502 3.750 0.050 17 0 "[ . 1 . 2]" 1
602 1 41 GLY QA 1 42 VAL H . . 2.920 2.929 2.750 2.965 0.045 15 0 "[ . 1 . 2]" 1
603 1 41 GLY HA2 1 42 VAL H . . 3.260 3.338 3.307 3.354 0.094 13 0 "[ . 1 . 2]" 1
604 1 41 GLY HA2 1 42 VAL MG2 . . 5.330 4.668 4.358 4.907 . 0 0 "[ . 1 . 2]" 1
605 1 41 GLY HA3 1 42 VAL H . . 3.280 3.246 2.920 3.348 0.068 12 0 "[ . 1 . 2]" 1
606 1 41 GLY HA3 1 42 VAL MG2 . . 4.060 3.837 3.370 4.136 0.076 18 0 "[ . 1 . 2]" 1
607 1 42 VAL H 1 42 VAL HB . . 3.080 2.547 2.392 2.749 . 0 0 "[ . 1 . 2]" 1
608 1 42 VAL H 1 42 VAL MG1 . . 4.090 3.821 3.765 3.918 . 0 0 "[ . 1 . 2]" 1
609 1 42 VAL H 1 42 VAL MG2 . . 3.240 2.487 2.239 2.764 . 0 0 "[ . 1 . 2]" 1
610 1 42 VAL H 1 43 TYR H . . 4.950 4.515 4.400 4.699 . 0 0 "[ . 1 . 2]" 1
611 1 42 VAL HA 1 42 VAL MG1 . . 3.590 2.413 2.283 2.536 . 0 0 "[ . 1 . 2]" 1
612 1 42 VAL HA 1 42 VAL MG2 . . 3.400 2.515 2.407 2.660 . 0 0 "[ . 1 . 2]" 1
613 1 42 VAL HA 1 43 TYR H . . 3.200 2.229 2.134 2.277 . 0 0 "[ . 1 . 2]" 1
614 1 42 VAL HA 1 43 TYR QD . . 3.320 3.398 3.337 3.424 0.104 12 0 "[ . 1 . 2]" 1
615 1 42 VAL HA 1 76 PRO HD3 . . 3.550 3.265 2.797 3.614 0.064 4 0 "[ . 1 . 2]" 1
616 1 42 VAL HB 1 43 TYR H . . 4.280 4.155 3.811 4.328 0.048 12 0 "[ . 1 . 2]" 1
617 1 42 VAL HB 1 75 MET HA . . 4.970 4.884 4.589 5.049 0.079 16 0 "[ . 1 . 2]" 1
618 1 42 VAL MG1 1 43 TYR H . . 3.780 2.677 2.345 3.098 . 0 0 "[ . 1 . 2]" 1
619 1 42 VAL MG1 1 75 MET QB . . 4.580 2.930 2.215 3.763 . 0 0 "[ . 1 . 2]" 1
620 1 42 VAL MG1 1 75 MET QG . . 5.460 3.793 2.015 5.534 0.074 5 0 "[ . 1 . 2]" 1
621 1 42 VAL MG1 1 76 PRO HD3 . . 5.070 4.233 3.545 4.624 . 0 0 "[ . 1 . 2]" 1
622 1 42 VAL MG2 1 43 TYR H . . 4.570 4.154 3.899 4.355 . 0 0 "[ . 1 . 2]" 1
623 1 42 VAL MG2 1 75 MET HA . . 3.620 2.444 2.120 2.991 . 0 0 "[ . 1 . 2]" 1
624 1 42 VAL MG2 1 75 MET QB . . 3.840 2.552 2.154 3.044 . 0 0 "[ . 1 . 2]" 1
625 1 42 VAL MG2 1 76 PRO HD2 . . 3.960 2.192 2.035 2.373 . 0 0 "[ . 1 . 2]" 1
626 1 42 VAL MG2 1 76 PRO HD3 . . 3.650 2.368 2.080 2.908 . 0 0 "[ . 1 . 2]" 1
627 1 43 TYR H 1 43 TYR HB3 . . 4.180 3.604 3.517 3.699 . 0 0 "[ . 1 . 2]" 1
628 1 43 TYR H 1 43 TYR QD . . 4.120 3.048 2.705 3.317 . 0 0 "[ . 1 . 2]" 1
629 1 43 TYR H 1 43 TYR QE . . 5.120 4.586 4.349 4.818 . 0 0 "[ . 1 . 2]" 1
630 1 43 TYR H 1 74 VAL H . . 4.120 3.507 3.061 4.165 0.045 4 0 "[ . 1 . 2]" 1
631 1 43 TYR H 1 74 VAL QG . . 4.280 2.866 2.325 4.015 . 0 0 "[ . 1 . 2]" 1
632 1 43 TYR HA 1 43 TYR QD . . 3.960 3.759 3.714 3.783 . 0 0 "[ . 1 . 2]" 1
633 1 43 TYR HA 1 44 LEU H . . 3.210 2.552 2.324 2.778 . 0 0 "[ . 1 . 2]" 1
634 1 43 TYR HA 1 44 LEU HA . . 4.870 4.516 4.392 4.598 . 0 0 "[ . 1 . 2]" 1
635 1 43 TYR HA 1 44 LEU HB2 . . 5.280 4.201 3.340 4.760 . 0 0 "[ . 1 . 2]" 1
636 1 43 TYR HA 1 44 LEU QD . . 5.090 3.943 3.188 4.422 . 0 0 "[ . 1 . 2]" 1
637 1 43 TYR HB2 1 44 LEU H . . 4.140 2.219 1.950 2.465 . 0 0 "[ . 1 . 2]" 1
638 1 43 TYR QD 1 44 LEU H . . 3.560 3.238 2.799 3.640 0.080 8 0 "[ . 1 . 2]" 1
639 1 43 TYR QD 1 44 LEU HA . . 4.720 4.289 3.722 4.786 0.066 1 0 "[ . 1 . 2]" 1
640 1 43 TYR QD 1 74 VAL QG . . 3.830 2.943 2.634 3.651 . 0 0 "[ . 1 . 2]" 1
641 1 43 TYR QE 1 45 ARG HB2 . . 5.370 4.152 2.622 5.195 . 0 0 "[ . 1 . 2]" 1
642 1 43 TYR QE 1 45 ARG QD . . 4.880 2.634 1.945 3.691 . 0 0 "[ . 1 . 2]" 1
643 1 43 TYR QE 1 45 ARG HG2 . . 4.880 4.354 2.821 5.104 0.224 9 0 "[ . 1 . 2]" 1
644 1 43 TYR QE 1 45 ARG HG3 . . 5.020 3.221 2.205 4.958 . 0 0 "[ . 1 . 2]" 1
645 1 43 TYR QE 1 74 VAL HB . . 4.660 4.283 3.211 4.753 0.093 17 0 "[ . 1 . 2]" 1
646 1 43 TYR QE 1 74 VAL QG . . 3.390 2.491 2.216 2.618 . 0 0 "[ . 1 . 2]" 1
647 1 44 LEU H 1 44 LEU HB2 . . 3.880 2.571 2.351 2.876 . 0 0 "[ . 1 . 2]" 1
648 1 44 LEU H 1 44 LEU QD . . 4.550 3.515 2.954 3.976 . 0 0 "[ . 1 . 2]" 1
649 1 44 LEU HA 1 44 LEU QD . . 3.260 2.176 2.059 2.396 . 0 0 "[ . 1 . 2]" 1
650 1 44 LEU HA 1 45 ARG H . . 3.070 2.209 2.088 2.395 . 0 0 "[ . 1 . 2]" 1
651 1 44 LEU HA 1 71 VAL QG . . 4.410 3.541 2.738 4.437 0.027 13 0 "[ . 1 . 2]" 1
652 1 44 LEU HA 1 73 VAL HA . . 3.890 2.977 2.173 3.585 . 0 0 "[ . 1 . 2]" 1
653 1 44 LEU HA 1 73 VAL QG . . 5.160 4.120 3.525 4.834 . 0 0 "[ . 1 . 2]" 1
654 1 44 LEU HA 1 74 VAL H . . 4.330 3.582 3.006 4.091 . 0 0 "[ . 1 . 2]" 1
655 1 44 LEU HA 1 74 VAL QG . . 4.620 3.675 3.201 4.439 . 0 0 "[ . 1 . 2]" 1
656 1 44 LEU HB2 1 45 ARG H . . 4.530 4.306 3.737 4.608 0.078 16 0 "[ . 1 . 2]" 1
657 1 44 LEU HB2 1 71 VAL QG . . 5.020 4.124 3.438 5.014 . 0 0 "[ . 1 . 2]" 1
658 1 44 LEU HB3 1 45 ARG H . . 4.320 3.433 2.420 4.307 . 0 0 "[ . 1 . 2]" 1
659 1 44 LEU HB3 1 71 VAL QG . . 4.220 2.907 2.102 4.231 0.011 13 0 "[ . 1 . 2]" 1
660 1 44 LEU QD 1 71 VAL QG . . 3.250 2.266 1.928 3.059 . 0 0 "[ . 1 . 2]" 1
661 1 44 LEU QD 1 73 VAL HA . . 3.270 2.149 2.047 2.638 . 0 0 "[ . 1 . 2]" 1
662 1 44 LEU QD 1 74 VAL H . . 3.580 3.484 2.896 3.655 0.075 6 0 "[ . 1 . 2]" 1
663 1 44 LEU HG 1 71 VAL QG . . 4.340 3.413 2.063 4.380 0.040 11 0 "[ . 1 . 2]" 1
664 1 45 ARG H 1 45 ARG HB2 . . 4.080 2.453 2.091 2.812 . 0 0 "[ . 1 . 2]" 1
665 1 45 ARG H 1 45 ARG HB3 . . 4.050 3.352 2.517 3.749 . 0 0 "[ . 1 . 2]" 1
666 1 45 ARG H 1 45 ARG HG2 . . 5.440 4.480 4.012 4.936 . 0 0 "[ . 1 . 2]" 1
667 1 45 ARG H 1 45 ARG HG3 . . 4.960 3.816 2.810 4.678 . 0 0 "[ . 1 . 2]" 1
668 1 45 ARG H 1 46 ALA H . . 4.930 4.095 3.385 4.583 . 0 0 "[ . 1 . 2]" 1
669 1 45 ARG H 1 71 VAL HA . . 4.720 4.216 3.628 4.796 0.076 8 0 "[ . 1 . 2]" 1
670 1 45 ARG H 1 71 VAL QG . . 4.440 3.332 2.571 4.115 . 0 0 "[ . 1 . 2]" 1
671 1 45 ARG H 1 72 ASN H . . 3.920 3.019 2.422 3.748 . 0 0 "[ . 1 . 2]" 1
672 1 45 ARG H 1 72 ASN HB2 . . 4.380 3.838 3.327 4.448 0.068 13 0 "[ . 1 . 2]" 1
673 1 45 ARG H 1 72 ASN HB3 . . 4.510 4.271 3.555 4.583 0.073 20 0 "[ . 1 . 2]" 1
674 1 45 ARG H 1 73 VAL HA . . 4.780 4.235 3.122 4.846 0.066 8 0 "[ . 1 . 2]" 1
675 1 45 ARG H 1 74 VAL QG . . 5.060 3.914 3.281 4.672 . 0 0 "[ . 1 . 2]" 1
676 1 45 ARG HA 1 45 ARG HG2 . . 4.080 2.692 2.273 3.496 . 0 0 "[ . 1 . 2]" 1
677 1 45 ARG HA 1 46 ALA H . . 3.110 2.224 2.059 2.533 . 0 0 "[ . 1 . 2]" 1
678 1 45 ARG HA 1 46 ALA MB . . 4.770 4.009 3.810 4.364 . 0 0 "[ . 1 . 2]" 1
679 1 45 ARG HB2 1 45 ARG QD . . 2.930 2.463 2.288 2.685 . 0 0 "[ . 1 . 2]" 1
680 1 45 ARG HB2 1 46 ALA H . . 4.700 4.592 4.269 4.735 0.035 20 0 "[ . 1 . 2]" 1
681 1 45 ARG HB2 1 71 VAL HA . . 5.290 5.059 4.404 5.557 0.267 9 0 "[ . 1 . 2]" 1
682 1 45 ARG HB2 1 72 ASN HB2 . . 4.150 3.001 2.124 4.202 0.052 20 0 "[ . 1 . 2]" 1
683 1 45 ARG HB2 1 72 ASN HB3 . . 4.640 3.702 2.307 4.632 . 0 0 "[ . 1 . 2]" 1
684 1 45 ARG HB2 1 74 VAL QG . . 4.510 3.873 2.951 4.550 0.040 5 0 "[ . 1 . 2]" 1
685 1 45 ARG HB3 1 46 ALA H . . 4.880 3.953 3.191 4.481 . 0 0 "[ . 1 . 2]" 1
686 1 45 ARG HB3 1 72 ASN H . . 4.830 3.838 2.538 4.533 . 0 0 "[ . 1 . 2]" 1
687 1 45 ARG HB3 1 72 ASN HB2 . . 4.100 3.392 2.189 4.150 0.050 13 0 "[ . 1 . 2]" 1
688 1 45 ARG HB3 1 72 ASN HB3 . . 5.220 4.588 3.040 5.295 0.075 5 0 "[ . 1 . 2]" 1
689 1 45 ARG QD 1 74 VAL QG . . 4.730 3.602 2.063 4.625 . 0 0 "[ . 1 . 2]" 1
690 1 45 ARG HG2 1 46 ALA H . . 4.990 4.335 3.883 5.195 0.205 11 0 "[ . 1 . 2]" 1
691 1 45 ARG HG3 1 46 ALA H . . 5.270 4.648 3.771 5.124 . 0 0 "[ . 1 . 2]" 1
692 1 46 ALA H 1 47 TYR H . . 5.310 4.192 3.507 4.689 . 0 0 "[ . 1 . 2]" 1
693 1 46 ALA HA 1 47 TYR H . . 2.920 2.325 2.137 2.702 . 0 0 "[ . 1 . 2]" 1
694 1 46 ALA HA 1 71 VAL HA . . 3.300 2.616 2.200 3.241 . 0 0 "[ . 1 . 2]" 1
695 1 46 ALA HA 1 71 VAL HB . . 4.820 3.945 2.664 4.911 0.091 16 0 "[ . 1 . 2]" 1
696 1 46 ALA HA 1 71 VAL QG . . 4.600 2.762 2.111 3.960 . 0 0 "[ . 1 . 2]" 1
697 1 46 ALA HA 1 72 ASN H . . 4.410 4.164 3.613 4.487 0.077 7 0 "[ . 1 . 2]" 1
698 1 46 ALA MB 1 47 TYR H . . 4.170 3.420 2.627 3.813 . 0 0 "[ . 1 . 2]" 1
699 1 46 ALA MB 1 71 VAL HA . . 4.860 4.013 3.475 4.784 . 0 0 "[ . 1 . 2]" 1
700 1 47 TYR H 1 47 TYR HB3 . . 4.070 2.827 2.472 3.126 . 0 0 "[ . 1 . 2]" 1
701 1 47 TYR H 1 47 TYR QD . . 4.260 4.310 4.139 4.361 0.101 8 0 "[ . 1 . 2]" 1
702 1 47 TYR H 1 70 GLN H . . 4.830 3.219 2.614 4.765 . 0 0 "[ . 1 . 2]" 1
703 1 47 TYR HA 1 47 TYR QD . . 3.520 2.808 2.052 3.075 . 0 0 "[ . 1 . 2]" 1
704 1 47 TYR HA 1 48 VAL H . . 3.090 2.179 2.041 2.418 . 0 0 "[ . 1 . 2]" 1
705 1 47 TYR HB2 1 48 VAL H . . 4.530 4.447 4.094 4.605 0.075 15 0 "[ . 1 . 2]" 1
706 1 47 TYR HB2 1 49 MET ME . . 3.990 3.892 3.535 4.088 0.098 18 0 "[ . 1 . 2]" 1
707 1 47 TYR HB2 1 70 GLN H . . 5.050 4.904 4.386 5.132 0.082 9 0 "[ . 1 . 2]" 1
708 1 47 TYR HB2 1 70 GLN QB . . 4.690 3.678 3.095 4.348 . 0 0 "[ . 1 . 2]" 1
709 1 47 TYR HB3 1 48 VAL H . . 4.240 4.154 3.458 4.322 0.082 15 0 "[ . 1 . 2]" 1
710 1 47 TYR HB3 1 49 MET ME . . 4.220 2.528 2.159 2.889 . 0 0 "[ . 1 . 2]" 1
711 1 47 TYR HB3 1 70 GLN H . . 4.890 3.636 2.965 4.066 . 0 0 "[ . 1 . 2]" 1
712 1 47 TYR HB3 1 70 GLN QB . . 4.980 2.425 2.141 3.007 . 0 0 "[ . 1 . 2]" 1
713 1 47 TYR QD 1 48 VAL H . . 5.070 3.164 1.774 4.310 . 0 0 "[ . 1 . 2]" 1
714 1 47 TYR QD 1 49 MET HB2 . . 5.450 4.221 3.315 5.244 . 0 0 "[ . 1 . 2]" 1
715 1 47 TYR QD 1 49 MET ME . . 4.180 2.428 2.029 3.463 . 0 0 "[ . 1 . 2]" 1
716 1 47 TYR QD 1 49 MET HG3 . . 4.120 2.704 1.998 4.301 0.181 5 0 "[ . 1 . 2]" 1
717 1 47 TYR QD 1 70 GLN QB . . 4.160 3.904 3.562 4.100 . 0 0 "[ . 1 . 2]" 1
718 1 47 TYR QE 1 49 MET HG3 . . 5.500 3.042 2.067 5.020 . 0 0 "[ . 1 . 2]" 1
719 1 47 TYR QE 1 50 PRO QD . . 4.170 3.912 3.528 4.118 . 0 0 "[ . 1 . 2]" 1
720 1 48 VAL H 1 48 VAL HB . . 3.460 2.736 2.197 3.544 0.084 15 0 "[ . 1 . 2]" 1
721 1 48 VAL H 1 48 VAL QG . . 3.710 2.274 1.724 2.821 . 0 0 "[ . 1 . 2]" 1
722 1 48 VAL H 1 49 MET ME . . 5.420 4.881 4.291 5.499 0.079 6 0 "[ . 1 . 2]" 1
723 1 48 VAL HA 1 49 MET H . . 3.050 2.229 2.054 2.361 . 0 0 "[ . 1 . 2]" 1
724 1 48 VAL HA 1 49 MET HA . . 5.230 4.516 4.407 4.625 . 0 0 "[ . 1 . 2]" 1
725 1 48 VAL HA 1 49 MET ME . . 4.830 4.352 3.703 4.905 0.075 8 0 "[ . 1 . 2]" 1
726 1 48 VAL HA 1 69 PHE HA . . 3.600 2.429 1.969 2.891 . 0 0 "[ . 1 . 2]" 1
727 1 48 VAL HA 1 69 PHE QD . . 3.840 2.580 2.097 3.175 . 0 0 "[ . 1 . 2]" 1
728 1 48 VAL HA 1 70 GLN H . . 4.670 3.647 2.868 4.216 . 0 0 "[ . 1 . 2]" 1
729 1 48 VAL HB 1 49 MET H . . 4.430 4.216 2.824 4.510 0.080 9 0 "[ . 1 . 2]" 1
730 1 48 VAL HB 1 69 PHE QD . . 4.980 4.180 2.000 4.987 0.007 8 0 "[ . 1 . 2]" 1
731 1 48 VAL QG 1 49 MET H . . 3.910 3.008 2.279 3.663 . 0 0 "[ . 1 . 2]" 1
732 1 48 VAL QG 1 49 MET HA . . 5.500 4.055 3.582 4.557 . 0 0 "[ . 1 . 2]" 1
733 1 48 VAL QG 1 50 PRO QD . . 5.340 3.108 1.997 4.969 . 0 0 "[ . 1 . 2]" 1
734 1 48 VAL QG 1 69 PHE HA . . 4.530 3.380 2.403 3.959 . 0 0 "[ . 1 . 2]" 1
735 1 48 VAL QG 1 69 PHE QD . . 3.340 2.329 2.031 3.087 . 0 0 "[ . 1 . 2]" 1
736 1 49 MET H 1 49 MET HB2 . . 3.940 2.540 2.124 3.748 . 0 0 "[ . 1 . 2]" 1
737 1 49 MET H 1 49 MET HB3 . . 4.010 3.529 3.040 3.824 . 0 0 "[ . 1 . 2]" 1
738 1 49 MET H 1 49 MET ME . . 4.530 3.633 2.850 4.471 . 0 0 "[ . 1 . 2]" 1
739 1 49 MET H 1 49 MET HG3 . . 4.210 3.429 2.599 4.272 0.062 6 0 "[ . 1 . 2]" 1
740 1 49 MET H 1 50 PRO QD . . 5.240 3.790 2.988 4.473 . 0 0 "[ . 1 . 2]" 1
741 1 49 MET H 1 68 VAL H . . 4.830 3.277 2.708 3.937 . 0 0 "[ . 1 . 2]" 1
742 1 49 MET H 1 69 PHE H . . 4.960 4.939 4.738 5.039 0.079 16 0 "[ . 1 . 2]" 1
743 1 49 MET H 1 69 PHE HA . . 4.440 3.177 2.741 3.491 . 0 0 "[ . 1 . 2]" 1
744 1 49 MET H 1 69 PHE QD . . 4.870 4.272 2.143 4.966 0.096 8 0 "[ . 1 . 2]" 1
745 1 49 MET H 1 70 GLN H . . 5.200 4.487 3.364 5.106 . 0 0 "[ . 1 . 2]" 1
746 1 49 MET HA 1 49 MET ME . . 4.590 4.211 3.553 4.672 0.082 12 0 "[ . 1 . 2]" 1
747 1 49 MET HA 1 49 MET HG2 . . 3.930 2.704 2.364 3.633 . 0 0 "[ . 1 . 2]" 1
748 1 49 MET HA 1 50 PRO QD . . 3.000 2.054 1.930 2.179 . 0 0 "[ . 1 . 2]" 1
749 1 49 MET HB2 1 49 MET ME . . 3.770 2.693 2.153 4.112 0.342 5 0 "[ . 1 . 2]" 1
750 1 49 MET HB2 1 68 VAL QG . . 4.680 2.443 2.012 4.271 . 0 0 "[ . 1 . 2]" 1
751 1 49 MET ME 1 68 VAL H . . 5.060 4.881 4.031 5.159 0.099 2 0 "[ . 1 . 2]" 1
752 1 49 MET ME 1 70 GLN H . . 4.360 3.434 2.531 4.431 0.071 18 0 "[ . 1 . 2]" 1
753 1 49 MET ME 1 70 GLN QB . . 2.820 2.108 1.881 2.638 . 0 0 "[ . 1 . 2]" 1
754 1 49 MET ME 1 70 GLN HE21 . . 4.110 4.199 3.483 4.944 0.834 2 3 "[ +* . 1 . - 2]" 1
755 1 49 MET HG2 1 50 PRO QD . . 4.450 3.771 2.260 4.656 0.206 5 0 "[ . 1 . 2]" 1
756 1 49 MET HG2 1 68 VAL QG . . 4.770 3.912 2.618 4.753 . 0 0 "[ . 1 . 2]" 1
757 1 49 MET HG3 1 50 PRO QD . . 5.370 3.968 2.003 4.614 . 0 0 "[ . 1 . 2]" 1
758 1 50 PRO HA 1 51 ALA H . . 3.090 2.417 2.230 2.663 . 0 0 "[ . 1 . 2]" 1
759 1 50 PRO HA 1 51 ALA MB . . 4.210 4.130 3.924 4.260 0.050 9 0 "[ . 1 . 2]" 1
760 1 50 PRO HA 1 67 GLY HA2 . . 4.590 3.607 2.847 4.547 . 0 0 "[ . 1 . 2]" 1
761 1 50 PRO HA 1 67 GLY HA3 . . 3.950 2.996 2.232 3.965 0.015 5 0 "[ . 1 . 2]" 1
762 1 50 PRO HB2 1 51 ALA H . . 3.920 2.725 2.228 3.608 . 0 0 "[ . 1 . 2]" 1
763 1 50 PRO HG2 1 51 ALA H . . 5.360 4.407 3.847 5.044 . 0 0 "[ . 1 . 2]" 1
764 1 51 ALA H 1 51 ALA MB . . 3.170 2.229 2.107 2.328 . 0 0 "[ . 1 . 2]" 1
765 1 51 ALA H 1 67 GLY HA2 . . 3.990 3.664 2.677 4.063 0.073 20 0 "[ . 1 . 2]" 1
766 1 51 ALA H 1 67 GLY HA3 . . 4.170 3.815 3.015 4.241 0.071 11 0 "[ . 1 . 2]" 1
767 1 51 ALA HA 1 52 ALA H . . 3.000 2.422 2.148 3.083 0.083 3 0 "[ . 1 . 2]" 1
768 1 51 ALA MB 1 52 ALA H . . 3.560 3.111 2.081 3.656 0.096 6 0 "[ . 1 . 2]" 1
769 1 51 ALA MB 1 65 TYR HA . . 4.330 2.975 2.152 3.854 . 0 0 "[ . 1 . 2]" 1
770 1 51 ALA MB 1 65 TYR HB3 . . 4.640 4.509 3.944 4.737 0.097 8 0 "[ . 1 . 2]" 1
771 1 51 ALA MB 1 65 TYR QD . . 4.930 4.082 2.457 4.999 0.069 12 0 "[ . 1 . 2]" 1
772 1 51 ALA MB 1 66 ARG H . . 4.160 2.281 1.739 2.898 . 0 0 "[ . 1 . 2]" 1
773 1 51 ALA MB 1 66 ARG QB . . 4.830 2.730 2.049 4.396 . 0 0 "[ . 1 . 2]" 1
774 1 51 ALA MB 1 66 ARG QD . . 4.140 3.907 2.105 4.256 0.116 13 0 "[ . 1 . 2]" 1
775 1 51 ALA MB 1 66 ARG QG . . 4.280 3.762 2.410 4.198 . 0 0 "[ . 1 . 2]" 1
776 1 51 ALA MB 1 67 GLY H . . 5.400 4.250 3.634 4.869 . 0 0 "[ . 1 . 2]" 1
777 1 51 ALA MB 1 67 GLY HA2 . . 3.870 3.556 2.676 3.973 0.103 9 0 "[ . 1 . 2]" 1
778 1 51 ALA MB 1 67 GLY HA3 . . 4.410 4.252 3.839 4.499 0.089 7 0 "[ . 1 . 2]" 1
779 1 52 ALA H 1 52 ALA MB . . 3.150 2.654 2.167 2.995 . 0 0 "[ . 1 . 2]" 1
780 1 52 ALA H 1 53 THR H . . 3.900 3.099 1.832 3.991 0.091 17 0 "[ . 1 . 2]" 1
781 1 52 ALA HA 1 53 THR H . . 2.930 2.557 2.111 3.018 0.088 2 0 "[ . 1 . 2]" 1
782 1 52 ALA MB 1 53 THR H . . 3.740 3.582 2.840 3.793 0.053 18 0 "[ . 1 . 2]" 1
783 1 53 THR H 1 53 THR HB . . 3.610 3.165 2.430 3.681 0.071 10 0 "[ . 1 . 2]" 1
784 1 53 THR H 1 53 THR MG . . 3.350 2.587 1.874 3.440 0.090 13 0 "[ . 1 . 2]" 1
785 1 53 THR HA 1 53 THR MG . . 3.320 2.709 2.126 3.297 . 0 0 "[ . 1 . 2]" 1
786 1 53 THR HA 1 54 ILE H . . 2.660 2.490 2.142 2.738 0.078 5 0 "[ . 1 . 2]" 1
787 1 54 ILE H 1 54 ILE HB . . 3.380 2.757 2.423 3.222 . 0 0 "[ . 1 . 2]" 1
788 1 54 ILE H 1 54 ILE MD . . 5.250 3.790 1.726 4.496 . 0 0 "[ . 1 . 2]" 1
789 1 54 ILE H 1 54 ILE HG12 . . 3.750 3.524 2.015 3.831 0.081 8 0 "[ . 1 . 2]" 1
790 1 54 ILE H 1 54 ILE HG13 . . 3.550 2.688 1.937 3.861 0.311 3 0 "[ . 1 . 2]" 1
791 1 54 ILE HA 1 54 ILE MD . . 4.170 3.809 2.468 4.020 . 0 0 "[ . 1 . 2]" 1
792 1 54 ILE HA 1 54 ILE HG13 . . 3.700 3.202 2.475 3.889 0.189 16 0 "[ . 1 . 2]" 1
793 1 54 ILE HA 1 54 ILE MG . . 2.610 2.385 2.195 2.765 0.155 3 0 "[ . 1 . 2]" 1
794 1 54 ILE HA 1 55 SER H . . 2.920 2.299 2.022 3.010 0.090 7 0 "[ . 1 . 2]" 1
795 1 54 ILE HB 1 55 SER H . . 3.880 3.840 2.858 3.969 0.089 15 0 "[ . 1 . 2]" 1
796 1 54 ILE HG12 1 55 SER H . . 4.480 4.574 4.129 5.278 0.798 17 2 "[ . - 1 . + 2]" 1
797 1 54 ILE HG13 1 55 SER H . . 5.500 4.870 2.958 5.239 . 0 0 "[ . 1 . 2]" 1
798 1 54 ILE MG 1 55 SER HB2 . . 4.820 4.022 2.326 4.909 0.089 1 0 "[ . 1 . 2]" 1
799 1 54 ILE MG 1 55 SER HB3 . . 4.810 4.535 3.750 4.928 0.118 3 0 "[ . 1 . 2]" 1
800 1 55 SER H 1 55 SER HB2 . . 3.630 2.963 2.252 3.667 0.037 3 0 "[ . 1 . 2]" 1
801 1 55 SER H 1 55 SER HB3 . . 3.360 3.315 2.794 3.718 0.358 10 0 "[ . 1 . 2]" 1
802 1 55 SER HA 1 55 SER HB3 . . 2.940 2.892 2.288 3.052 0.112 4 0 "[ . 1 . 2]" 1
803 1 55 SER HA 1 56 ARG H . . 2.960 2.727 2.178 3.045 0.085 17 0 "[ . 1 . 2]" 1
804 1 55 SER HB2 1 56 ARG H . . 4.070 3.712 3.073 4.149 0.079 16 0 "[ . 1 . 2]" 1
805 1 55 SER HB3 1 56 ARG H . . 3.910 3.130 1.923 4.127 0.217 20 0 "[ . 1 . 2]" 1
806 1 56 ARG H 1 56 ARG HB2 . . 3.540 3.120 2.171 4.115 0.575 17 1 "[ . 1 . + 2]" 1
807 1 56 ARG H 1 56 ARG HB3 . . 4.170 3.387 2.596 4.109 . 0 0 "[ . 1 . 2]" 1
808 1 56 ARG H 1 57 ASP H . . 3.600 2.693 1.849 3.661 0.061 3 0 "[ . 1 . 2]" 1
809 1 56 ARG HA 1 56 ARG HB3 . . 2.940 2.673 2.327 3.049 0.109 16 0 "[ . 1 . 2]" 1
810 1 56 ARG HA 1 56 ARG QD . . 4.210 3.726 2.235 4.303 0.093 13 0 "[ . 1 . 2]" 1
811 1 56 ARG HA 1 56 ARG QG . . 3.580 2.678 2.153 3.455 . 0 0 "[ . 1 . 2]" 1
812 1 56 ARG HA 1 57 ASP H . . 3.010 2.819 2.060 3.110 0.100 20 0 "[ . 1 . 2]" 1
813 1 56 ARG HB2 1 56 ARG QD . . 3.440 2.788 2.245 3.526 0.086 1 0 "[ . 1 . 2]" 1
814 1 56 ARG HB2 1 56 ARG QG . . 2.640 2.320 2.104 2.510 . 0 0 "[ . 1 . 2]" 1
815 1 56 ARG HB3 1 56 ARG QD . . 3.780 2.577 2.107 3.418 . 0 0 "[ . 1 . 2]" 1
816 1 56 ARG QG 1 57 ASP H . . 4.790 4.242 2.795 4.646 . 0 0 "[ . 1 . 2]" 1
817 1 57 ASP H 1 57 ASP QB . . 3.350 2.655 2.033 3.258 . 0 0 "[ . 1 . 2]" 1
818 1 57 ASP HA 1 58 ALA H . . 2.970 2.465 2.167 2.731 . 0 0 "[ . 1 . 2]" 1
819 1 57 ASP HA 1 58 ALA MB . . 4.290 3.989 3.571 4.401 0.111 6 0 "[ . 1 . 2]" 1
820 1 57 ASP HA 1 59 ALA H . . 5.020 4.282 2.920 5.090 0.070 17 0 "[ . 1 . 2]" 1
821 1 57 ASP QB 1 58 ALA H . . 3.390 2.605 1.998 3.295 . 0 0 "[ . 1 . 2]" 1
822 1 57 ASP QB 1 58 ALA MB . . 5.130 3.977 2.901 4.737 . 0 0 "[ . 1 . 2]" 1
823 1 57 ASP QB 1 59 ALA H . . 4.600 3.522 2.407 4.511 . 0 0 "[ . 1 . 2]" 1
824 1 58 ALA H 1 58 ALA MB . . 3.440 2.650 2.184 2.920 . 0 0 "[ . 1 . 2]" 1
825 1 58 ALA HA 1 59 ALA H . . 2.960 2.813 2.340 3.046 0.086 4 0 "[ . 1 . 2]" 1
826 1 59 ALA H 1 59 ALA HA . . 2.900 2.733 2.209 2.972 0.072 10 0 "[ . 1 . 2]" 1
827 1 59 ALA H 1 59 ALA MB . . 3.070 2.583 2.151 3.097 0.027 20 0 "[ . 1 . 2]" 1
828 1 59 ALA HA 1 60 GLY H . . 3.270 2.812 2.282 3.350 0.080 4 0 "[ . 1 . 2]" 1
829 1 59 ALA MB 1 60 GLY H . . 4.100 2.627 1.852 3.759 . 0 0 "[ . 1 . 2]" 1
830 1 59 ALA MB 1 60 GLY HA3 . . 5.240 4.345 4.126 4.584 . 0 0 "[ . 1 . 2]" 1
831 1 59 ALA MB 1 61 ASP QB . . 4.830 3.566 2.311 4.630 . 0 0 "[ . 1 . 2]" 1
832 1 60 GLY H 1 61 ASP HA . . 5.320 4.972 4.221 5.378 0.058 6 0 "[ . 1 . 2]" 1
833 1 60 GLY H 1 61 ASP QB . . 5.500 3.986 3.081 5.037 . 0 0 "[ . 1 . 2]" 1
834 1 60 GLY HA2 1 61 ASP H . . 3.320 3.046 2.398 3.564 0.244 16 0 "[ . 1 . 2]" 1
835 1 60 GLY HA2 1 61 ASP QB . . 4.980 4.456 3.820 4.859 . 0 0 "[ . 1 . 2]" 1
836 1 60 GLY HA3 1 61 ASP QB . . 4.950 4.461 4.172 4.827 . 0 0 "[ . 1 . 2]" 1
837 1 61 ASP H 1 61 ASP QB . . 3.170 2.731 2.419 3.093 . 0 0 "[ . 1 . 2]" 1
838 1 61 ASP H 1 62 HIS H . . 3.950 3.295 1.904 4.037 0.087 18 0 "[ . 1 . 2]" 1
839 1 61 ASP H 1 62 HIS HA . . 4.880 4.766 4.142 4.976 0.096 12 0 "[ . 1 . 2]" 1
840 1 61 ASP HA 1 61 ASP QB . . 2.570 2.278 2.136 2.471 . 0 0 "[ . 1 . 2]" 1
841 1 61 ASP HA 1 62 HIS H . . 3.410 2.748 2.084 3.493 0.083 8 0 "[ . 1 . 2]" 1
842 1 61 ASP QB 1 62 HIS H . . 4.420 3.302 2.025 3.965 . 0 0 "[ . 1 . 2]" 1
843 1 62 HIS HA 1 63 ARG H . . 3.300 2.826 2.118 3.399 0.099 20 0 "[ . 1 . 2]" 1
844 1 62 HIS QB 1 63 ARG H . . 4.690 2.886 2.191 3.782 . 0 0 "[ . 1 . 2]" 1
845 1 62 HIS QB 1 63 ARG QB . . 3.540 3.199 2.387 3.467 . 0 0 "[ . 1 . 2]" 1
846 1 62 HIS HD2 1 63 ARG H . . 5.230 3.770 2.025 5.295 0.065 17 0 "[ . 1 . 2]" 1
847 1 62 HIS HD2 1 63 ARG HA . . 5.010 4.685 4.093 5.085 0.075 3 0 "[ . 1 . 2]" 1
848 1 63 ARG H 1 63 ARG QB . . 3.460 2.864 2.090 3.320 . 0 0 "[ . 1 . 2]" 1
849 1 63 ARG H 1 63 ARG HG3 . . 4.450 4.273 2.636 5.146 0.696 17 1 "[ . 1 . + 2]" 1
850 1 63 ARG HA 1 64 GLN H . . 2.930 2.599 1.983 3.012 0.082 4 0 "[ . 1 . 2]" 1
851 1 63 ARG HA 1 64 GLN QG . . 5.110 4.457 2.965 5.196 0.086 14 0 "[ . 1 . 2]" 1
852 1 63 ARG QB 1 64 GLN H . . 4.110 3.042 2.005 3.853 . 0 0 "[ . 1 . 2]" 1
853 1 63 ARG HG3 1 64 GLN HA . . 5.500 5.278 3.943 6.311 0.811 1 3 "[+ . 1* . - 2]" 1
854 1 64 GLN H 1 64 GLN QB . . 3.700 2.762 2.166 3.336 . 0 0 "[ . 1 . 2]" 1
855 1 64 GLN H 1 64 GLN QG . . 4.750 3.410 2.372 4.133 . 0 0 "[ . 1 . 2]" 1
856 1 64 GLN H 1 65 TYR H . . 4.500 3.688 1.944 4.584 0.084 6 0 "[ . 1 . 2]" 1
857 1 64 GLN HA 1 64 GLN HE21 . . 5.150 4.619 3.124 5.228 0.078 19 0 "[ . 1 . 2]" 1
858 1 64 GLN HA 1 64 GLN QG . . 3.500 2.669 2.135 3.473 . 0 0 "[ . 1 . 2]" 1
859 1 64 GLN HA 1 65 TYR H . . 2.970 2.574 2.052 3.056 0.086 11 0 "[ . 1 . 2]" 1
860 1 64 GLN QB 1 65 TYR H . . 4.300 2.977 1.987 3.899 . 0 0 "[ . 1 . 2]" 1
861 1 64 GLN QB 1 65 TYR HA . . 4.890 4.382 3.566 4.735 . 0 0 "[ . 1 . 2]" 1
862 1 64 GLN QG 1 65 TYR H . . 4.930 3.875 1.874 4.888 . 0 0 "[ . 1 . 2]" 1
863 1 65 TYR H 1 65 TYR HB2 . . 4.200 2.396 2.007 2.862 . 0 0 "[ . 1 . 2]" 1
864 1 65 TYR H 1 65 TYR HB3 . . 3.950 3.491 2.888 3.836 . 0 0 "[ . 1 . 2]" 1
865 1 65 TYR H 1 65 TYR QD . . 3.630 3.327 2.442 3.719 0.089 6 0 "[ . 1 . 2]" 1
866 1 65 TYR H 1 66 ARG H . . 4.530 4.105 1.891 4.607 0.077 19 0 "[ . 1 . 2]" 1
867 1 65 TYR H 1 136 VAL HB . . 4.090 3.930 3.231 4.167 0.077 11 0 "[ . 1 . 2]" 1
868 1 65 TYR HA 1 65 TYR QD . . 3.420 2.462 2.004 3.073 . 0 0 "[ . 1 . 2]" 1
869 1 65 TYR HA 1 66 ARG H . . 3.290 2.412 2.109 3.361 0.071 9 0 "[ . 1 . 2]" 1
870 1 65 TYR HB2 1 66 ARG H . . 4.300 4.070 3.237 4.630 0.330 10 0 "[ . 1 . 2]" 1
871 1 65 TYR HB2 1 136 VAL HB . . 4.000 2.631 2.170 3.734 . 0 0 "[ . 1 . 2]" 1
872 1 65 TYR HB2 1 136 VAL QG . . 4.410 2.694 1.941 3.769 . 0 0 "[ . 1 . 2]" 1
873 1 65 TYR HB3 1 66 ARG H . . 4.790 3.249 2.295 4.432 . 0 0 "[ . 1 . 2]" 1
874 1 65 TYR HB3 1 136 VAL HB . . 3.730 3.066 2.123 4.087 0.357 20 0 "[ . 1 . 2]" 1
875 1 65 TYR HB3 1 136 VAL QG . . 4.080 2.719 1.986 3.774 . 0 0 "[ . 1 . 2]" 1
876 1 65 TYR QD 1 66 ARG H . . 4.000 3.840 3.185 4.103 0.103 1 0 "[ . 1 . 2]" 1
877 1 65 TYR QD 1 136 VAL HB . . 4.490 3.716 2.292 4.528 0.038 4 0 "[ . 1 . 2]" 1
878 1 65 TYR QD 1 136 VAL QG . . 4.060 2.373 2.014 2.922 . 0 0 "[ . 1 . 2]" 1
879 1 65 TYR QE 1 136 VAL QG . . 4.280 3.829 3.079 4.180 . 0 0 "[ . 1 . 2]" 1
880 1 66 ARG H 1 66 ARG QD . . 5.340 4.474 3.530 5.109 . 0 0 "[ . 1 . 2]" 1
881 1 66 ARG H 1 66 ARG QG . . 4.450 3.525 1.824 4.268 . 0 0 "[ . 1 . 2]" 1
882 1 66 ARG H 1 67 GLY H . . 4.910 4.197 2.640 4.741 . 0 0 "[ . 1 . 2]" 1
883 1 66 ARG HA 1 66 ARG QD . . 4.780 3.859 2.752 4.515 . 0 0 "[ . 1 . 2]" 1
884 1 66 ARG HA 1 67 GLY H . . 3.350 2.464 2.042 2.913 . 0 0 "[ . 1 . 2]" 1
885 1 66 ARG HA 1 135 ASP HA . . 3.510 2.101 1.930 2.361 . 0 0 "[ . 1 . 2]" 1
886 1 66 ARG HA 1 135 ASP HB3 . . 4.760 3.841 2.325 5.035 0.275 7 0 "[ . 1 . 2]" 1
887 1 66 ARG QB 1 66 ARG QD . . 3.200 2.209 2.010 2.693 . 0 0 "[ . 1 . 2]" 1
888 1 66 ARG QB 1 67 GLY H . . 4.060 2.968 2.043 3.760 . 0 0 "[ . 1 . 2]" 1
889 1 66 ARG QB 1 135 ASP HA . . 4.750 3.622 2.248 4.421 . 0 0 "[ . 1 . 2]" 1
890 1 66 ARG QB 1 135 ASP HB2 . . 5.340 4.276 2.144 6.101 0.761 5 1 "[ + 1 . 2]" 1
891 1 66 ARG QG 1 67 GLY H . . 4.750 3.373 1.989 4.465 . 0 0 "[ . 1 . 2]" 1
892 1 66 ARG QG 1 135 ASP HA . . 4.560 3.045 1.944 4.246 . 0 0 "[ . 1 . 2]" 1
893 1 66 ARG QG 1 135 ASP HB2 . . 4.180 3.387 2.171 4.255 0.075 13 0 "[ . 1 . 2]" 1
894 1 66 ARG QG 1 135 ASP HB3 . . 4.270 3.255 2.130 4.186 . 0 0 "[ . 1 . 2]" 1
895 1 67 GLY H 1 134 TYR H . . 4.050 3.673 2.801 4.121 0.071 11 0 "[ . 1 . 2]" 1
896 1 67 GLY H 1 135 ASP HA . . 4.390 3.674 3.322 4.336 . 0 0 "[ . 1 . 2]" 1
897 1 67 GLY HA2 1 68 VAL QG . . 4.970 3.686 3.205 4.035 . 0 0 "[ . 1 . 2]" 1
898 1 67 GLY HA3 1 68 VAL HB . . 5.500 5.157 4.909 5.386 . 0 0 "[ . 1 . 2]" 1
899 1 67 GLY HA3 1 68 VAL QG . . 5.130 4.237 4.071 4.350 . 0 0 "[ . 1 . 2]" 1
900 1 68 VAL H 1 68 VAL HB . . 3.460 3.189 2.542 3.517 0.057 10 0 "[ . 1 . 2]" 1
901 1 68 VAL HA 1 69 PHE H . . 3.010 2.303 2.137 2.457 . 0 0 "[ . 1 . 2]" 1
902 1 68 VAL HA 1 132 LEU QD . . 4.420 3.903 3.249 4.318 . 0 0 "[ . 1 . 2]" 1
903 1 68 VAL HA 1 133 GLY HA2 . . 4.010 2.155 1.935 2.500 . 0 0 "[ . 1 . 2]" 1
904 1 68 VAL HA 1 134 TYR H . . 4.040 3.134 2.629 3.635 . 0 0 "[ . 1 . 2]" 1
905 1 68 VAL HB 1 69 PHE H . . 4.400 3.957 3.546 4.203 . 0 0 "[ . 1 . 2]" 1
906 1 68 VAL HB 1 133 GLY HA2 . . 4.590 3.625 2.713 4.658 0.068 14 0 "[ . 1 . 2]" 1
907 1 68 VAL QG 1 69 PHE H . . 3.200 2.308 1.988 2.729 . 0 0 "[ . 1 . 2]" 1
908 1 68 VAL QG 1 69 PHE HA . . 4.600 3.585 3.309 3.815 . 0 0 "[ . 1 . 2]" 1
909 1 68 VAL QG 1 70 GLN H . . 5.240 3.988 3.549 4.351 . 0 0 "[ . 1 . 2]" 1
910 1 68 VAL QG 1 70 GLN HA . . 3.980 3.908 3.478 4.056 0.076 5 0 "[ . 1 . 2]" 1
911 1 68 VAL QG 1 70 GLN HE21 . . 5.500 4.673 3.673 5.461 . 0 0 "[ . 1 . 2]" 1
912 1 68 VAL QG 1 70 GLN HE22 . . 5.500 5.007 4.187 5.428 . 0 0 "[ . 1 . 2]" 1
913 1 68 VAL QG 1 131 SER HB2 . . 3.730 2.602 2.164 3.837 0.107 14 0 "[ . 1 . 2]" 1
914 1 68 VAL QG 1 131 SER HB3 . . 3.790 3.420 2.677 3.785 . 0 0 "[ . 1 . 2]" 1
915 1 68 VAL QG 1 133 GLY HA2 . . 3.190 2.850 2.178 3.227 0.037 9 0 "[ . 1 . 2]" 1
916 1 68 VAL QG 1 133 GLY HA3 . . 3.980 3.536 2.601 3.956 . 0 0 "[ . 1 . 2]" 1
917 1 68 VAL QG 1 134 TYR H . . 5.320 4.346 3.651 4.742 . 0 0 "[ . 1 . 2]" 1
918 1 69 PHE H 1 69 PHE HB3 . . 3.960 2.729 2.360 3.870 . 0 0 "[ . 1 . 2]" 1
919 1 69 PHE H 1 69 PHE QD . . 4.760 4.179 3.368 4.408 . 0 0 "[ . 1 . 2]" 1
920 1 69 PHE H 1 70 GLN H . . 4.810 4.255 3.941 4.505 . 0 0 "[ . 1 . 2]" 1
921 1 69 PHE H 1 132 LEU QD . . 4.760 2.824 2.408 3.493 . 0 0 "[ . 1 . 2]" 1
922 1 69 PHE H 1 133 GLY HA2 . . 4.760 3.617 3.288 4.117 . 0 0 "[ . 1 . 2]" 1
923 1 69 PHE HA 1 69 PHE QD . . 3.430 2.414 1.996 3.020 . 0 0 "[ . 1 . 2]" 1
924 1 69 PHE HA 1 70 GLN H . . 3.080 2.202 2.028 2.387 . 0 0 "[ . 1 . 2]" 1
925 1 69 PHE HB2 1 70 GLN H . . 4.820 4.171 3.745 4.494 . 0 0 "[ . 1 . 2]" 1
926 1 69 PHE HB3 1 70 GLN H . . 4.910 4.099 3.182 4.489 . 0 0 "[ . 1 . 2]" 1
927 1 69 PHE HB3 1 132 LEU QD . . 4.240 2.237 1.947 3.832 . 0 0 "[ . 1 . 2]" 1
928 1 69 PHE QD 1 70 GLN H . . 3.850 3.097 2.330 3.968 0.118 9 0 "[ . 1 . 2]" 1
929 1 69 PHE QD 1 71 VAL QG . . 4.660 3.560 2.707 4.691 0.031 20 0 "[ . 1 . 2]" 1
930 1 69 PHE QD 1 132 LEU QD . . 3.240 2.267 1.969 2.901 . 0 0 "[ . 1 . 2]" 1
931 1 69 PHE QD 1 132 LEU HG . . 4.320 3.721 2.432 4.418 0.098 7 0 "[ . 1 . 2]" 1
932 1 70 GLN HA 1 70 GLN HE22 . . 4.800 4.617 3.219 5.683 0.883 14 5 "[ * . 1 * +- * 2]" 1
933 1 70 GLN HA 1 70 GLN HG2 . . 4.000 3.191 2.245 3.899 . 0 0 "[ . 1 . 2]" 1
934 1 70 GLN HA 1 71 VAL H . . 3.350 2.266 2.146 2.350 . 0 0 "[ . 1 . 2]" 1
935 1 70 GLN HA 1 71 VAL QG . . 3.950 3.654 3.212 3.926 . 0 0 "[ . 1 . 2]" 1
936 1 70 GLN HA 1 131 SER HA . . 3.420 2.751 2.141 3.483 0.063 9 0 "[ . 1 . 2]" 1
937 1 70 GLN HA 1 131 SER HB2 . . 3.690 3.321 2.146 3.765 0.075 2 0 "[ . 1 . 2]" 1
938 1 70 GLN HA 1 131 SER HB3 . . 3.550 2.273 1.975 3.772 0.222 14 0 "[ . 1 . 2]" 1
939 1 70 GLN HA 1 132 LEU H . . 4.710 4.150 3.681 4.738 0.028 9 0 "[ . 1 . 2]" 1
940 1 70 GLN QB 1 71 VAL H . . 4.870 3.653 2.712 4.060 . 0 0 "[ . 1 . 2]" 1
941 1 70 GLN QB 1 131 SER HB2 . . 5.260 4.164 2.948 4.843 . 0 0 "[ . 1 . 2]" 1
942 1 70 GLN QB 1 131 SER HB3 . . 5.210 3.382 2.245 4.198 . 0 0 "[ . 1 . 2]" 1
943 1 70 GLN HE21 1 72 ASN HD22 . . 5.420 4.753 2.973 5.895 0.475 13 0 "[ . 1 . 2]" 1
944 1 70 GLN HE21 1 129 PRO HA . . 5.440 4.793 3.757 5.500 0.060 7 0 "[ . 1 . 2]" 1
945 1 70 GLN HE22 1 72 ASN HD22 . . 5.270 4.702 3.433 5.478 0.208 3 0 "[ . 1 . 2]" 1
946 1 70 GLN HE22 1 129 PRO HA . . 5.070 4.742 3.288 5.519 0.449 15 0 "[ . 1 . 2]" 1
947 1 70 GLN HE22 1 129 PRO HB2 . . 5.060 4.890 3.484 5.873 0.813 12 2 "[ . 1 + -. 2]" 1
948 1 71 VAL H 1 71 VAL HB . . 3.650 3.075 2.487 3.580 . 0 0 "[ . 1 . 2]" 1
949 1 71 VAL H 1 71 VAL QG . . 4.050 2.588 2.128 3.020 . 0 0 "[ . 1 . 2]" 1
950 1 71 VAL H 1 130 ILE HB . . 3.980 3.622 3.134 4.045 0.065 9 0 "[ . 1 . 2]" 1
951 1 71 VAL H 1 131 SER HA . . 4.350 3.492 3.144 4.103 . 0 0 "[ . 1 . 2]" 1
952 1 71 VAL H 1 131 SER HB3 . . 4.920 3.691 3.218 4.994 0.074 14 0 "[ . 1 . 2]" 1
953 1 71 VAL HA 1 72 ASN H . . 3.040 2.233 2.093 2.449 . 0 0 "[ . 1 . 2]" 1
954 1 71 VAL HA 1 72 ASN HB2 . . 4.670 4.289 3.767 4.486 . 0 0 "[ . 1 . 2]" 1
955 1 71 VAL QG 1 72 ASN H . . 3.750 2.722 2.017 3.445 . 0 0 "[ . 1 . 2]" 1
956 1 71 VAL QG 1 72 ASN HA . . 5.310 3.791 3.425 4.247 . 0 0 "[ . 1 . 2]" 1
957 1 71 VAL QG 1 72 ASN HB3 . . 5.500 5.032 4.664 5.350 . 0 0 "[ . 1 . 2]" 1
958 1 71 VAL QG 1 73 VAL HA . . 4.880 3.917 3.267 4.828 . 0 0 "[ . 1 . 2]" 1
959 1 71 VAL QG 1 130 ILE HB . . 4.570 3.050 2.000 4.134 . 0 0 "[ . 1 . 2]" 1
960 1 72 ASN H 1 72 ASN HB2 . . 3.810 2.481 2.132 2.839 . 0 0 "[ . 1 . 2]" 1
961 1 72 ASN H 1 72 ASN HB3 . . 4.160 3.505 3.112 3.642 . 0 0 "[ . 1 . 2]" 1
962 1 72 ASN H 1 72 ASN HD21 . . 5.500 4.153 3.048 4.841 . 0 0 "[ . 1 . 2]" 1
963 1 72 ASN H 1 72 ASN HD22 . . 5.340 5.261 4.512 5.579 0.239 1 0 "[ . 1 . 2]" 1
964 1 72 ASN H 1 74 VAL QG . . 5.440 5.220 4.852 5.427 . 0 0 "[ . 1 . 2]" 1
965 1 72 ASN H 1 127 THR MG . . 5.440 4.940 4.395 5.528 0.088 20 0 "[ . 1 . 2]" 1
966 1 72 ASN HA 1 72 ASN HD22 . . 5.490 3.975 3.340 4.594 . 0 0 "[ . 1 . 2]" 1
967 1 72 ASN HA 1 73 VAL H . . 3.010 2.174 2.041 2.319 . 0 0 "[ . 1 . 2]" 1
968 1 72 ASN HA 1 73 VAL HB . . 4.900 4.756 4.242 4.995 0.095 13 0 "[ . 1 . 2]" 1
969 1 72 ASN HA 1 127 THR MG . . 4.090 3.203 2.430 4.193 0.103 13 0 "[ . 1 . 2]" 1
970 1 72 ASN HB2 1 73 VAL H . . 4.970 4.513 4.003 4.706 . 0 0 "[ . 1 . 2]" 1
971 1 72 ASN HB2 1 74 VAL QG . . 4.770 4.446 3.476 4.767 . 0 0 "[ . 1 . 2]" 1
972 1 72 ASN HB2 1 127 THR MG . . 3.880 3.591 3.374 3.965 0.085 1 0 "[ . 1 . 2]" 1
973 1 72 ASN HB3 1 73 VAL H . . 4.420 3.726 2.895 4.261 . 0 0 "[ . 1 . 2]" 1
974 1 72 ASN HB3 1 74 VAL QG . . 3.970 3.515 2.556 3.954 . 0 0 "[ . 1 . 2]" 1
975 1 72 ASN HB3 1 127 THR HB . . 4.890 4.532 3.989 4.962 0.072 16 0 "[ . 1 . 2]" 1
976 1 72 ASN HB3 1 127 THR MG . . 3.120 2.279 2.065 2.689 . 0 0 "[ . 1 . 2]" 1
977 1 72 ASN HD21 1 127 THR MG . . 4.630 3.732 2.524 4.674 0.044 7 0 "[ . 1 . 2]" 1
978 1 72 ASN HD22 1 127 THR MG . . 4.350 3.744 2.914 4.448 0.098 7 0 "[ . 1 . 2]" 1
979 1 73 VAL H 1 73 VAL HB . . 3.520 2.807 2.429 3.610 0.090 13 0 "[ . 1 . 2]" 1
980 1 73 VAL H 1 73 VAL QG . . 3.340 2.090 1.789 2.731 . 0 0 "[ . 1 . 2]" 1
981 1 73 VAL H 1 74 VAL HA . . 5.420 5.050 4.262 5.476 0.056 12 0 "[ . 1 . 2]" 1
982 1 73 VAL H 1 127 THR MG . . 3.660 3.309 2.306 3.743 0.083 1 0 "[ . 1 . 2]" 1
983 1 73 VAL HA 1 73 VAL QG . . 3.120 2.333 2.138 2.544 . 0 0 "[ . 1 . 2]" 1
984 1 73 VAL HA 1 74 VAL H . . 2.960 2.218 2.075 2.470 . 0 0 "[ . 1 . 2]" 1
985 1 73 VAL HA 1 74 VAL QG . . 4.340 3.581 3.277 3.817 . 0 0 "[ . 1 . 2]" 1
986 1 73 VAL QG 1 74 VAL H . . 4.060 3.196 2.476 3.815 . 0 0 "[ . 1 . 2]" 1
987 1 73 VAL QG 1 75 MET QB . . 4.110 3.628 2.768 4.037 . 0 0 "[ . 1 . 2]" 1
988 1 73 VAL QG 1 84 ALA H . . 4.680 4.249 3.732 4.596 . 0 0 "[ . 1 . 2]" 1
989 1 73 VAL QG 1 84 ALA HA . . 3.620 2.533 1.996 3.078 . 0 0 "[ . 1 . 2]" 1
990 1 74 VAL H 1 74 VAL HB . . 3.420 2.887 2.549 3.320 . 0 0 "[ . 1 . 2]" 1
991 1 74 VAL H 1 74 VAL QG . . 3.300 2.100 1.801 2.808 . 0 0 "[ . 1 . 2]" 1
992 1 74 VAL H 1 127 THR MG . . 3.990 3.735 3.003 4.096 0.106 10 0 "[ . 1 . 2]" 1
993 1 74 VAL HA 1 75 MET H . . 2.970 2.261 2.146 2.384 . 0 0 "[ . 1 . 2]" 1
994 1 74 VAL HA 1 75 MET QB . . 5.170 4.526 4.057 4.844 . 0 0 "[ . 1 . 2]" 1
995 1 74 VAL HA 1 75 MET QG . . 5.260 4.105 3.583 4.935 . 0 0 "[ . 1 . 2]" 1
996 1 74 VAL HA 1 125 ASP HB3 . . 5.360 4.776 3.560 5.443 0.083 19 0 "[ . 1 . 2]" 1
997 1 74 VAL HA 1 126 HIS H . . 5.310 4.312 3.757 5.375 0.065 4 0 "[ . 1 . 2]" 1
998 1 74 VAL HA 1 127 THR HA . . 3.530 3.076 2.461 3.604 0.074 13 0 "[ . 1 . 2]" 1
999 1 74 VAL HA 1 127 THR MG . . 4.330 2.719 2.306 3.386 . 0 0 "[ . 1 . 2]" 1
1000 1 74 VAL QG 1 75 MET H . . 3.620 2.596 2.222 2.791 . 0 0 "[ . 1 . 2]" 1
1001 1 74 VAL QG 1 76 PRO HD3 . . 5.500 4.371 3.814 4.855 . 0 0 "[ . 1 . 2]" 1
1002 1 74 VAL QG 1 125 ASP HA . . 5.190 4.029 3.716 4.532 . 0 0 "[ . 1 . 2]" 1
1003 1 74 VAL QG 1 125 ASP HB2 . . 3.410 2.523 2.108 3.255 . 0 0 "[ . 1 . 2]" 1
1004 1 74 VAL QG 1 125 ASP HB3 . . 3.820 2.545 2.008 3.332 . 0 0 "[ . 1 . 2]" 1
1005 1 74 VAL QG 1 126 HIS H . . 4.520 3.625 2.923 4.472 . 0 0 "[ . 1 . 2]" 1
1006 1 74 VAL QG 1 127 THR HA . . 4.720 4.048 3.381 4.584 . 0 0 "[ . 1 . 2]" 1
1007 1 74 VAL QG 1 127 THR MG . . 3.500 2.700 1.928 3.275 . 0 0 "[ . 1 . 2]" 1
1008 1 75 MET H 1 75 MET ME . . 3.890 2.594 2.099 3.489 . 0 0 "[ . 1 . 2]" 1
1009 1 75 MET H 1 75 MET QG . . 4.100 2.867 2.202 3.347 . 0 0 "[ . 1 . 2]" 1
1010 1 75 MET H 1 126 HIS H . . 4.670 2.959 2.457 4.757 0.087 4 0 "[ . 1 . 2]" 1
1011 1 75 MET H 1 126 HIS HB2 . . 5.000 4.655 3.901 5.712 0.712 16 3 "[ . -*1 .+ 2]" 1
1012 1 75 MET H 1 127 THR MG . . 5.120 4.515 3.970 5.192 0.072 14 0 "[ . 1 . 2]" 1
1013 1 75 MET HA 1 75 MET ME . . 4.650 4.199 3.826 4.742 0.092 15 0 "[ . 1 . 2]" 1
1014 1 75 MET HA 1 75 MET QG . . 3.320 3.200 2.544 3.413 0.093 8 0 "[ . 1 . 2]" 1
1015 1 75 MET HA 1 76 PRO HD2 . . 3.610 2.587 2.354 2.739 . 0 0 "[ . 1 . 2]" 1
1016 1 75 MET HA 1 76 PRO HD3 . . 3.190 2.350 2.241 2.456 . 0 0 "[ . 1 . 2]" 1
1017 1 75 MET QB 1 83 SER HB3 . . 4.890 3.967 3.038 5.703 0.813 17 1 "[ . 1 . + 2]" 1
1018 1 75 MET QB 1 84 ALA MB . . 5.500 4.989 4.376 5.296 . 0 0 "[ . 1 . 2]" 1
1019 1 75 MET ME 1 76 PRO HD2 . . 5.500 5.434 5.131 5.605 0.105 14 0 "[ . 1 . 2]" 1
1020 1 75 MET ME 1 83 SER HB2 . . 4.970 4.559 3.183 5.682 0.712 3 3 "[ + . 1 -. *]" 1
1021 1 75 MET ME 1 84 ALA H . . 3.820 3.162 2.382 3.768 . 0 0 "[ . 1 . 2]" 1
1022 1 75 MET ME 1 84 ALA HA . . 4.530 3.210 2.280 4.548 0.018 12 0 "[ . 1 . 2]" 1
1023 1 75 MET ME 1 84 ALA MB . . 3.460 2.172 1.946 2.853 . 0 0 "[ . 1 . 2]" 1
1024 1 75 MET ME 1 126 HIS HB2 . . 4.790 2.855 2.000 4.848 0.058 9 0 "[ . 1 . 2]" 1
1025 1 75 MET ME 1 126 HIS HD2 . . 3.700 3.678 3.055 3.806 0.106 17 0 "[ . 1 . 2]" 1
1026 1 75 MET ME 1 127 THR HA . . 3.990 3.225 2.708 4.107 0.117 4 0 "[ . 1 . 2]" 1
1027 1 75 MET ME 1 128 VAL H . . 3.820 3.508 2.938 3.918 0.098 17 0 "[ . 1 . 2]" 1
1028 1 75 MET ME 1 128 VAL QG . . 2.990 2.775 2.260 2.990 . 0 0 "[ . 1 . 2]" 1
1029 1 75 MET QG 1 76 PRO HD2 . . 4.480 3.840 3.209 4.454 . 0 0 "[ . 1 . 2]" 1
1030 1 76 PRO HA 1 77 ILE H . . 2.970 2.369 2.191 2.565 . 0 0 "[ . 1 . 2]" 1
1031 1 76 PRO HA 1 77 ILE HG13 . . 5.150 3.673 3.178 5.239 0.089 3 0 "[ . 1 . 2]" 1
1032 1 76 PRO HA 1 125 ASP HB2 . . 5.170 4.440 3.591 5.083 . 0 0 "[ . 1 . 2]" 1
1033 1 76 PRO HA 1 125 ASP HB3 . . 4.610 3.238 2.292 4.025 . 0 0 "[ . 1 . 2]" 1
1034 1 76 PRO HB2 1 77 ILE H . . 4.270 2.852 2.397 3.346 . 0 0 "[ . 1 . 2]" 1
1035 1 76 PRO HB3 1 77 ILE H . . 3.820 3.709 3.416 4.037 0.217 5 0 "[ . 1 . 2]" 1
1036 1 77 ILE H 1 77 ILE HB . . 3.060 2.625 2.247 2.954 . 0 0 "[ . 1 . 2]" 1
1037 1 77 ILE H 1 77 ILE MD . . 4.310 3.668 1.970 4.148 . 0 0 "[ . 1 . 2]" 1
1038 1 77 ILE H 1 77 ILE HG12 . . 3.840 3.570 3.269 3.890 0.050 2 0 "[ . 1 . 2]" 1
1039 1 77 ILE H 1 77 ILE HG13 . . 3.650 2.597 2.226 3.744 0.094 5 0 "[ . 1 . 2]" 1
1040 1 77 ILE H 1 78 GLY H . . 4.190 3.768 3.395 4.096 . 0 0 "[ . 1 . 2]" 1
1041 1 77 ILE H 1 125 ASP HA . . 3.650 3.240 2.598 3.714 0.064 6 0 "[ . 1 . 2]" 1
1042 1 77 ILE H 1 126 HIS H . . 5.340 5.102 4.164 5.407 0.067 18 0 "[ . 1 . 2]" 1
1043 1 77 ILE HA 1 77 ILE MD . . 3.800 3.705 2.241 3.896 0.096 16 0 "[ . 1 . 2]" 1
1044 1 77 ILE HA 1 77 ILE HG12 . . 3.960 2.677 2.436 3.729 . 0 0 "[ . 1 . 2]" 1
1045 1 77 ILE HA 1 77 ILE HG13 . . 3.920 3.099 2.760 3.369 . 0 0 "[ . 1 . 2]" 1
1046 1 77 ILE HA 1 77 ILE MG . . 3.190 2.305 2.216 2.401 . 0 0 "[ . 1 . 2]" 1
1047 1 77 ILE HA 1 78 GLY H . . 2.940 2.337 2.130 2.615 . 0 0 "[ . 1 . 2]" 1
1048 1 77 ILE HA 1 125 ASP HA . . 4.970 4.814 4.408 5.047 0.077 3 0 "[ . 1 . 2]" 1
1049 1 77 ILE HA 1 126 HIS HD2 . . 4.220 4.010 3.361 4.313 0.093 3 0 "[ . 1 . 2]" 1
1050 1 77 ILE HB 1 78 GLY H . . 4.460 4.502 4.368 4.531 0.071 7 0 "[ . 1 . 2]" 1
1051 1 77 ILE HB 1 124 ALA HA . . 4.510 3.240 2.659 3.805 . 0 0 "[ . 1 . 2]" 1
1052 1 77 ILE HB 1 125 ASP H . . 5.040 4.961 4.646 5.122 0.082 5 0 "[ . 1 . 2]" 1
1053 1 77 ILE HB 1 125 ASP HA . . 4.810 4.572 4.255 4.840 0.030 19 0 "[ . 1 . 2]" 1
1054 1 77 ILE MD 1 122 GLY H . . 5.280 3.550 2.786 5.211 . 0 0 "[ . 1 . 2]" 1
1055 1 77 ILE MD 1 124 ALA HA . . 3.810 2.804 2.189 3.932 0.122 5 0 "[ . 1 . 2]" 1
1056 1 77 ILE MD 1 125 ASP H . . 4.180 3.059 2.510 3.823 . 0 0 "[ . 1 . 2]" 1
1057 1 77 ILE MD 1 125 ASP HA . . 5.470 3.323 1.729 3.883 . 0 0 "[ . 1 . 2]" 1
1058 1 77 ILE MD 1 125 ASP HB3 . . 5.500 4.907 2.788 5.418 . 0 0 "[ . 1 . 2]" 1
1059 1 77 ILE MD 1 126 HIS HB3 . . 4.990 4.109 2.117 5.093 0.103 20 0 "[ . 1 . 2]" 1
1060 1 77 ILE MD 1 126 HIS HD2 . . 3.580 3.235 1.982 3.683 0.103 9 0 "[ . 1 . 2]" 1
1061 1 77 ILE HG12 1 77 ILE MG . . 2.860 2.410 2.286 2.625 . 0 0 "[ . 1 . 2]" 1
1062 1 77 ILE HG12 1 124 ALA HA . . 4.960 4.752 2.512 5.047 0.087 17 0 "[ . 1 . 2]" 1
1063 1 77 ILE HG12 1 126 HIS H . . 5.500 3.978 3.065 4.654 . 0 0 "[ . 1 . 2]" 1
1064 1 77 ILE HG13 1 78 GLY H . . 5.180 5.086 4.833 5.252 0.072 16 0 "[ . 1 . 2]" 1
1065 1 77 ILE HG13 1 81 SER HB3 . . 5.050 4.566 3.307 5.350 0.300 17 0 "[ . 1 . 2]" 1
1066 1 77 ILE HG13 1 124 ALA HA . . 5.040 3.658 3.417 4.160 . 0 0 "[ . 1 . 2]" 1
1067 1 77 ILE HG13 1 125 ASP HA . . 4.140 2.543 2.169 3.850 . 0 0 "[ . 1 . 2]" 1
1068 1 77 ILE HG13 1 125 ASP HB3 . . 5.500 4.740 4.386 5.601 0.101 5 0 "[ . 1 . 2]" 1
1069 1 77 ILE HG13 1 126 HIS H . . 5.500 3.697 2.898 4.506 . 0 0 "[ . 1 . 2]" 1
1070 1 77 ILE HG13 1 126 HIS HD2 . . 5.500 3.443 2.628 4.141 . 0 0 "[ . 1 . 2]" 1
1071 1 77 ILE MG 1 78 GLY H . . 4.080 3.683 3.181 4.098 0.018 4 0 "[ . 1 . 2]" 1
1072 1 77 ILE MG 1 78 GLY HA2 . . 5.010 4.192 3.563 4.723 . 0 0 "[ . 1 . 2]" 1
1073 1 77 ILE MG 1 78 GLY HA3 . . 4.690 4.894 4.033 5.126 0.436 19 0 "[ . 1 . 2]" 1
1074 1 77 ILE MG 1 81 SER H . . 4.950 4.328 2.571 5.052 0.102 20 0 "[ . 1 . 2]" 1
1075 1 77 ILE MG 1 81 SER HB2 . . 4.850 3.619 2.730 4.934 0.084 3 0 "[ . 1 . 2]" 1
1076 1 77 ILE MG 1 81 SER HB3 . . 5.500 3.177 2.163 4.252 . 0 0 "[ . 1 . 2]" 1
1077 1 77 ILE MG 1 82 ARG QD . . 5.500 5.135 4.459 5.399 . 0 0 "[ . 1 . 2]" 1
1078 1 77 ILE MG 1 124 ALA HA . . 4.520 4.378 3.495 4.625 0.105 4 0 "[ . 1 . 2]" 1
1079 1 77 ILE MG 1 126 HIS HD2 . . 5.190 3.951 2.693 4.440 . 0 0 "[ . 1 . 2]" 1
1080 1 78 GLY H 1 79 ASP H . . 3.450 2.925 1.976 3.527 0.077 11 0 "[ . 1 . 2]" 1
1081 1 79 ASP H 1 79 ASP HB2 . . 3.150 2.938 2.084 3.285 0.135 7 0 "[ . 1 . 2]" 1
1082 1 79 ASP H 1 79 ASP HB3 . . 3.420 2.927 2.273 3.516 0.096 6 0 "[ . 1 . 2]" 1
1083 1 79 ASP H 1 80 GLY H . . 3.830 3.283 1.897 3.928 0.098 15 0 "[ . 1 . 2]" 1
1084 1 79 ASP HA 1 80 GLY H . . 3.110 2.521 2.055 3.197 0.087 14 0 "[ . 1 . 2]" 1
1085 1 79 ASP HB2 1 80 GLY H . . 5.260 4.389 4.010 4.639 . 0 0 "[ . 1 . 2]" 1
1086 1 79 ASP HB3 1 80 GLY H . . 4.690 4.153 3.347 4.517 . 0 0 "[ . 1 . 2]" 1
1087 1 81 SER H 1 81 SER HB2 . . 3.630 3.206 2.221 3.723 0.093 12 0 "[ . 1 . 2]" 1
1088 1 81 SER H 1 81 SER HB3 . . 3.280 2.912 2.371 3.722 0.442 13 0 "[ . 1 . 2]" 1
1089 1 81 SER H 1 82 ARG QD . . 3.780 3.396 2.795 3.768 . 0 0 "[ . 1 . 2]" 1
1090 1 81 SER HA 1 83 SER H . . 4.840 3.448 3.133 3.946 . 0 0 "[ . 1 . 2]" 1
1091 1 81 SER HB2 1 83 SER H . . 4.890 4.908 3.973 5.562 0.672 13 3 "[ . - 1 + . * 2]" 1
1092 1 82 ARG H 1 82 ARG HB2 . . 3.640 2.945 2.184 3.845 0.205 3 0 "[ . 1 . 2]" 1
1093 1 82 ARG H 1 82 ARG HB3 . . 4.110 3.700 2.815 4.041 . 0 0 "[ . 1 . 2]" 1
1094 1 82 ARG H 1 82 ARG QD . . 5.440 2.730 2.093 3.433 . 0 0 "[ . 1 . 2]" 1
1095 1 82 ARG H 1 83 SER H . . 3.570 2.695 2.217 3.626 0.056 7 0 "[ . 1 . 2]" 1
1096 1 82 ARG HA 1 82 ARG QD . . 4.160 2.913 2.093 3.835 . 0 0 "[ . 1 . 2]" 1
1097 1 82 ARG HA 1 82 ARG HG2 . . 3.950 3.620 3.425 3.787 . 0 0 "[ . 1 . 2]" 1
1098 1 82 ARG HB2 1 82 ARG QD . . 3.720 2.727 2.144 3.487 . 0 0 "[ . 1 . 2]" 1
1099 1 82 ARG HB3 1 82 ARG QD . . 3.600 3.069 2.156 3.406 . 0 0 "[ . 1 . 2]" 1
1100 1 83 SER H 1 83 SER HB2 . . 3.440 2.347 2.013 3.192 . 0 0 "[ . 1 . 2]" 1
1101 1 83 SER H 1 83 SER HB3 . . 3.670 3.219 2.458 3.634 . 0 0 "[ . 1 . 2]" 1
1102 1 83 SER HA 1 85 GLU H . . 4.830 3.955 3.445 4.426 . 0 0 "[ . 1 . 2]" 1
1103 1 83 SER HA 1 86 GLN H . . 4.060 3.395 2.988 3.872 . 0 0 "[ . 1 . 2]" 1
1104 1 83 SER HA 1 86 GLN HB2 . . 3.510 2.825 2.477 3.795 0.285 9 0 "[ . 1 . 2]" 1
1105 1 83 SER HA 1 87 VAL QG . . 5.160 4.193 3.394 4.744 . 0 0 "[ . 1 . 2]" 1
1106 1 83 SER HB2 1 84 ALA MB . . 5.500 5.077 4.417 5.806 0.306 6 0 "[ . 1 . 2]" 1
1107 1 84 ALA H 1 84 ALA MB . . 2.870 2.206 2.127 2.297 . 0 0 "[ . 1 . 2]" 1
1108 1 84 ALA H 1 86 GLN H . . 4.990 4.601 4.220 4.910 . 0 0 "[ . 1 . 2]" 1
1109 1 84 ALA H 1 128 VAL QG . . 4.710 4.189 3.907 4.391 . 0 0 "[ . 1 . 2]" 1
1110 1 84 ALA HA 1 87 VAL H . . 4.490 3.762 3.418 3.976 . 0 0 "[ . 1 . 2]" 1
1111 1 84 ALA HA 1 87 VAL HB . . 3.420 2.915 2.404 3.227 . 0 0 "[ . 1 . 2]" 1
1112 1 84 ALA HA 1 87 VAL QG . . 3.930 3.440 2.668 3.717 . 0 0 "[ . 1 . 2]" 1
1113 1 84 ALA MB 1 85 GLU H . . 3.950 2.601 2.303 3.013 . 0 0 "[ . 1 . 2]" 1
1114 1 84 ALA MB 1 85 GLU HB2 . . 5.260 4.546 4.371 4.832 . 0 0 "[ . 1 . 2]" 1
1115 1 84 ALA MB 1 85 GLU HB3 . . 5.450 5.192 4.925 5.355 . 0 0 "[ . 1 . 2]" 1
1116 1 84 ALA MB 1 85 GLU HG2 . . 4.840 3.879 3.309 4.941 0.101 2 0 "[ . 1 . 2]" 1
1117 1 84 ALA MB 1 85 GLU HG3 . . 4.910 3.378 2.861 4.366 . 0 0 "[ . 1 . 2]" 1
1118 1 84 ALA MB 1 128 VAL HB . . 3.620 3.723 3.697 3.742 0.122 14 0 "[ . 1 . 2]" 1
1119 1 84 ALA MB 1 128 VAL QG . . 3.130 1.797 1.742 1.835 . 0 0 "[ . 1 . 2]" 1
1120 1 85 GLU H 1 85 GLU HB2 . . 3.300 2.400 2.238 2.581 . 0 0 "[ . 1 . 2]" 1
1121 1 85 GLU H 1 85 GLU HB3 . . 3.480 3.534 3.469 3.556 0.076 17 0 "[ . 1 . 2]" 1
1122 1 85 GLU H 1 85 GLU HG2 . . 3.710 3.203 2.617 3.811 0.101 2 0 "[ . 1 . 2]" 1
1123 1 85 GLU H 1 85 GLU HG3 . . 3.760 2.382 1.932 3.243 . 0 0 "[ . 1 . 2]" 1
1124 1 85 GLU H 1 86 GLN H . . 3.460 2.696 2.466 2.888 . 0 0 "[ . 1 . 2]" 1
1125 1 85 GLU HA 1 85 GLU HG2 . . 3.470 2.441 2.194 3.406 . 0 0 "[ . 1 . 2]" 1
1126 1 85 GLU HA 1 85 GLU HG3 . . 3.410 3.163 2.327 3.499 0.089 8 0 "[ . 1 . 2]" 1
1127 1 85 GLU HA 1 88 ALA H . . 4.120 3.522 3.202 3.822 . 0 0 "[ . 1 . 2]" 1
1128 1 85 GLU HA 1 88 ALA MB . . 3.550 2.728 2.338 3.273 . 0 0 "[ . 1 . 2]" 1
1129 1 85 GLU HA 1 89 ALA H . . 4.600 4.283 3.895 4.673 0.073 3 0 "[ . 1 . 2]" 1
1130 1 85 GLU HB3 1 86 GLN H . . 3.860 3.453 3.000 3.945 0.085 9 0 "[ . 1 . 2]" 1
1131 1 85 GLU HG2 1 86 GLN H . . 4.730 4.795 4.593 4.864 0.134 12 0 "[ . 1 . 2]" 1
1132 1 85 GLU HG2 1 88 ALA MB . . 4.990 4.530 3.927 5.615 0.625 2 1 "[ + . 1 . 2]" 1
1133 1 85 GLU HG2 1 128 VAL QG . . 5.500 4.515 3.419 5.898 0.398 2 0 "[ . 1 . 2]" 1
1134 1 85 GLU HG3 1 86 GLN H . . 4.770 4.329 4.060 4.713 . 0 0 "[ . 1 . 2]" 1
1135 1 86 GLN H 1 86 GLN HB2 . . 3.000 2.064 1.825 2.782 . 0 0 "[ . 1 . 2]" 1
1136 1 86 GLN H 1 86 GLN HB3 . . 3.400 3.131 1.942 3.482 0.082 8 0 "[ . 1 . 2]" 1
1137 1 86 GLN H 1 86 GLN HE21 . . 5.340 5.206 4.624 5.422 0.082 9 0 "[ . 1 . 2]" 1
1138 1 86 GLN H 1 86 GLN HG2 . . 3.760 3.466 2.346 3.869 0.109 4 0 "[ . 1 . 2]" 1
1139 1 86 GLN H 1 86 GLN HG3 . . 3.840 3.815 3.476 3.935 0.095 5 0 "[ . 1 . 2]" 1
1140 1 86 GLN H 1 87 VAL H . . 3.610 2.884 2.453 3.001 . 0 0 "[ . 1 . 2]" 1
1141 1 86 GLN H 1 87 VAL QG . . 4.540 4.334 4.104 4.500 . 0 0 "[ . 1 . 2]" 1
1142 1 86 GLN H 1 88 ALA H . . 4.980 4.299 3.882 4.704 . 0 0 "[ . 1 . 2]" 1
1143 1 86 GLN H 1 88 ALA MB . . 5.450 4.955 4.714 5.500 0.050 18 0 "[ . 1 . 2]" 1
1144 1 86 GLN HA 1 86 GLN HG2 . . 3.650 2.399 2.072 3.769 0.119 9 0 "[ . 1 . 2]" 1
1145 1 86 GLN HA 1 86 GLN HG3 . . 3.670 3.461 2.673 3.708 0.038 8 0 "[ . 1 . 2]" 1
1146 1 86 GLN HA 1 89 ALA H . . 3.840 3.747 3.490 3.924 0.084 9 0 "[ . 1 . 2]" 1
1147 1 86 GLN HA 1 89 ALA MB . . 3.510 2.997 2.695 3.445 . 0 0 "[ . 1 . 2]" 1
1148 1 86 GLN HB2 1 87 VAL H . . 3.600 3.058 2.474 3.778 0.178 9 0 "[ . 1 . 2]" 1
1149 1 86 GLN HB2 1 87 VAL QG . . 4.900 3.798 3.042 4.646 . 0 0 "[ . 1 . 2]" 1
1150 1 86 GLN HB3 1 87 VAL H . . 3.700 2.694 2.217 3.337 . 0 0 "[ . 1 . 2]" 1
1151 1 86 GLN HE21 1 90 GLU HG3 . . 5.440 3.575 2.206 5.493 0.053 16 0 "[ . 1 . 2]" 1
1152 1 86 GLN HE22 1 86 GLN HG2 . . 3.850 3.882 3.555 4.187 0.337 6 0 "[ . 1 . 2]" 1
1153 1 86 GLN HE22 1 90 GLU HG2 . . 5.500 4.269 2.927 5.571 0.071 6 0 "[ . 1 . 2]" 1
1154 1 86 GLN HE22 1 90 GLU HG3 . . 4.850 3.725 2.641 4.909 0.059 9 0 "[ . 1 . 2]" 1
1155 1 86 GLN HG2 1 87 VAL H . . 5.120 4.697 2.810 5.037 . 0 0 "[ . 1 . 2]" 1
1156 1 86 GLN HG2 1 87 VAL QG . . 5.500 5.183 2.636 5.437 . 0 0 "[ . 1 . 2]" 1
1157 1 86 GLN HG3 1 87 VAL H . . 5.030 4.821 2.909 5.114 0.084 2 0 "[ . 1 . 2]" 1
1158 1 86 GLN HG3 1 87 VAL QG . . 5.500 4.927 3.225 5.406 . 0 0 "[ . 1 . 2]" 1
1159 1 87 VAL H 1 87 VAL HB . . 3.110 2.328 2.220 2.621 . 0 0 "[ . 1 . 2]" 1
1160 1 87 VAL H 1 87 VAL QG . . 3.040 2.217 2.018 2.323 . 0 0 "[ . 1 . 2]" 1
1161 1 87 VAL H 1 89 ALA H . . 5.240 4.154 3.954 4.388 . 0 0 "[ . 1 . 2]" 1
1162 1 87 VAL H 1 90 GLU HB2 . . 5.190 5.138 4.655 5.266 0.076 20 0 "[ . 1 . 2]" 1
1163 1 87 VAL HA 1 87 VAL QG . . 3.050 2.167 2.038 2.238 . 0 0 "[ . 1 . 2]" 1
1164 1 87 VAL HA 1 88 ALA MB . . 5.500 5.051 5.001 5.103 . 0 0 "[ . 1 . 2]" 1
1165 1 87 VAL HA 1 89 ALA H . . 4.060 4.118 3.963 4.141 0.081 4 0 "[ . 1 . 2]" 1
1166 1 87 VAL HA 1 89 ALA MB . . 4.930 4.854 4.423 5.008 0.078 12 0 "[ . 1 . 2]" 1
1167 1 87 VAL HA 1 90 GLU HB2 . . 3.540 2.521 2.096 2.742 . 0 0 "[ . 1 . 2]" 1
1168 1 87 VAL HA 1 90 GLU HG2 . . 4.560 4.593 3.869 4.655 0.095 2 0 "[ . 1 . 2]" 1
1169 1 87 VAL HA 1 90 GLU HG3 . . 4.630 3.152 2.990 3.636 . 0 0 "[ . 1 . 2]" 1
1170 1 87 VAL HA 1 91 LEU H . . 4.840 3.685 3.473 3.966 . 0 0 "[ . 1 . 2]" 1
1171 1 87 VAL HA 1 91 LEU QD . . 3.720 3.543 3.125 3.774 0.054 14 0 "[ . 1 . 2]" 1
1172 1 87 VAL HB 1 88 ALA H . . 3.660 2.806 2.511 3.068 . 0 0 "[ . 1 . 2]" 1
1173 1 87 VAL HB 1 88 ALA HA . . 5.180 4.600 4.151 4.751 . 0 0 "[ . 1 . 2]" 1
1174 1 87 VAL QG 1 88 ALA H . . 3.640 3.236 3.047 3.436 . 0 0 "[ . 1 . 2]" 1
1175 1 87 VAL QG 1 91 LEU H . . 5.130 3.746 3.509 4.084 . 0 0 "[ . 1 . 2]" 1
1176 1 87 VAL QG 1 91 LEU QD . . 3.560 1.930 1.847 2.008 . 0 0 "[ . 1 . 2]" 1
1177 1 87 VAL QG 1 130 ILE MD . . 3.300 3.209 2.630 3.392 0.092 11 0 "[ . 1 . 2]" 1
1178 1 88 ALA H 1 88 ALA MB . . 2.870 2.233 2.186 2.281 . 0 0 "[ . 1 . 2]" 1
1179 1 88 ALA H 1 89 ALA H . . 3.630 2.728 2.589 2.845 . 0 0 "[ . 1 . 2]" 1
1180 1 88 ALA H 1 91 LEU QD . . 5.080 4.314 3.601 4.899 . 0 0 "[ . 1 . 2]" 1
1181 1 88 ALA H 1 130 ILE MD . . 3.930 3.778 3.338 4.019 0.089 11 0 "[ . 1 . 2]" 1
1182 1 88 ALA HA 1 91 LEU H . . 4.010 3.845 3.440 4.078 0.068 8 0 "[ . 1 . 2]" 1
1183 1 88 ALA HA 1 91 LEU HB2 . . 3.760 2.828 2.571 3.360 . 0 0 "[ . 1 . 2]" 1
1184 1 88 ALA HA 1 91 LEU QD . . 4.310 3.203 2.265 4.115 . 0 0 "[ . 1 . 2]" 1
1185 1 88 ALA HA 1 92 ASP H . . 4.780 4.015 3.407 4.361 . 0 0 "[ . 1 . 2]" 1
1186 1 88 ALA HA 1 130 ILE MD . . 3.390 2.539 1.973 2.963 . 0 0 "[ . 1 . 2]" 1
1187 1 88 ALA HA 1 130 ILE MG . . 4.090 3.710 3.331 4.046 . 0 0 "[ . 1 . 2]" 1
1188 1 88 ALA MB 1 89 ALA HA . . 4.330 3.955 3.751 4.096 . 0 0 "[ . 1 . 2]" 1
1189 1 88 ALA MB 1 116 ASN HA . . 5.500 4.907 4.254 5.515 0.015 5 0 "[ . 1 . 2]" 1
1190 1 88 ALA MB 1 116 ASN QB . . 5.160 3.614 2.627 4.589 . 0 0 "[ . 1 . 2]" 1
1191 1 88 ALA MB 1 116 ASN HD21 . . 4.970 3.721 2.844 4.346 . 0 0 "[ . 1 . 2]" 1
1192 1 88 ALA MB 1 116 ASN HD22 . . 4.650 3.585 2.090 4.740 0.090 6 0 "[ . 1 . 2]" 1
1193 1 88 ALA MB 1 130 ILE MD . . 3.410 2.297 2.127 2.706 . 0 0 "[ . 1 . 2]" 1
1194 1 88 ALA MB 1 130 ILE MG . . 3.570 3.640 3.435 3.693 0.123 18 0 "[ . 1 . 2]" 1
1195 1 89 ALA H 1 89 ALA MB . . 2.890 2.227 2.150 2.283 . 0 0 "[ . 1 . 2]" 1
1196 1 89 ALA H 1 90 GLU H . . 3.530 2.511 2.326 2.714 . 0 0 "[ . 1 . 2]" 1
1197 1 89 ALA H 1 90 GLU HG2 . . 5.450 5.295 4.661 5.534 0.084 5 0 "[ . 1 . 2]" 1
1198 1 89 ALA H 1 91 LEU H . . 4.770 4.227 3.867 4.530 . 0 0 "[ . 1 . 2]" 1
1199 1 89 ALA H 1 130 ILE MD . . 5.500 5.292 4.873 5.571 0.071 8 0 "[ . 1 . 2]" 1
1200 1 89 ALA HA 1 92 ASP H . . 3.850 3.486 2.985 3.910 0.060 15 0 "[ . 1 . 2]" 1
1201 1 89 ALA HA 1 92 ASP QB . . 3.240 2.573 2.151 3.191 . 0 0 "[ . 1 . 2]" 1
1202 1 89 ALA HA 1 93 ALA H . . 4.610 4.102 3.785 4.451 . 0 0 "[ . 1 . 2]" 1
1203 1 89 ALA MB 1 90 GLU H . . 3.450 2.639 2.334 2.860 . 0 0 "[ . 1 . 2]" 1
1204 1 89 ALA MB 1 90 GLU HA . . 3.950 3.941 3.822 4.033 0.083 15 0 "[ . 1 . 2]" 1
1205 1 89 ALA MB 1 90 GLU HB3 . . 5.500 5.383 5.232 5.542 0.042 10 0 "[ . 1 . 2]" 1
1206 1 89 ALA MB 1 90 GLU HG2 . . 4.500 3.904 3.395 4.323 . 0 0 "[ . 1 . 2]" 1
1207 1 89 ALA MB 1 90 GLU HG3 . . 4.930 3.982 3.401 4.661 . 0 0 "[ . 1 . 2]" 1
1208 1 89 ALA MB 1 91 LEU H . . 4.910 4.746 4.391 4.997 0.087 6 0 "[ . 1 . 2]" 1
1209 1 89 ALA MB 1 93 ALA H . . 4.980 4.696 4.400 5.049 0.069 15 0 "[ . 1 . 2]" 1
1210 1 90 GLU H 1 90 GLU HB2 . . 3.990 2.396 2.097 2.502 . 0 0 "[ . 1 . 2]" 1
1211 1 90 GLU H 1 90 GLU HG2 . . 3.390 3.093 2.598 3.446 0.056 6 0 "[ . 1 . 2]" 1
1212 1 90 GLU H 1 90 GLU HG3 . . 3.600 2.788 2.396 3.460 . 0 0 "[ . 1 . 2]" 1
1213 1 90 GLU H 1 91 LEU H . . 3.450 2.696 2.519 2.906 . 0 0 "[ . 1 . 2]" 1
1214 1 90 GLU HA 1 90 GLU HG2 . . 3.010 2.339 2.183 2.514 . 0 0 "[ . 1 . 2]" 1
1215 1 90 GLU HA 1 90 GLU HG3 . . 3.540 3.419 3.137 3.623 0.083 16 0 "[ . 1 . 2]" 1
1216 1 90 GLU HA 1 93 ALA H . . 3.810 3.709 3.371 3.890 0.080 16 0 "[ . 1 . 2]" 1
1217 1 90 GLU HB2 1 91 LEU H . . 4.340 2.425 2.233 2.680 . 0 0 "[ . 1 . 2]" 1
1218 1 90 GLU HB2 1 91 LEU QD . . 5.460 3.574 2.647 4.296 . 0 0 "[ . 1 . 2]" 1
1219 1 90 GLU HB3 1 91 LEU H . . 4.920 3.279 2.910 3.618 . 0 0 "[ . 1 . 2]" 1
1220 1 90 GLU HB3 1 91 LEU HA . . 4.370 4.276 4.023 4.455 0.085 17 0 "[ . 1 . 2]" 1
1221 1 90 GLU HG2 1 91 LEU H . . 4.710 4.702 4.512 4.799 0.089 20 0 "[ . 1 . 2]" 1
1222 1 90 GLU HG3 1 91 LEU H . . 4.910 4.418 4.179 4.730 . 0 0 "[ . 1 . 2]" 1
1223 1 91 LEU H 1 91 LEU HB2 . . 3.700 2.317 2.179 2.421 . 0 0 "[ . 1 . 2]" 1
1224 1 91 LEU H 1 91 LEU HB3 . . 4.170 3.553 3.465 3.606 . 0 0 "[ . 1 . 2]" 1
1225 1 91 LEU H 1 91 LEU QD . . 3.980 2.718 2.009 3.226 . 0 0 "[ . 1 . 2]" 1
1226 1 91 LEU H 1 91 LEU HG . . 3.760 3.062 2.315 3.858 0.098 20 0 "[ . 1 . 2]" 1
1227 1 91 LEU H 1 92 ASP H . . 3.620 2.868 2.567 3.131 . 0 0 "[ . 1 . 2]" 1
1228 1 91 LEU H 1 93 ALA H . . 4.880 4.453 4.107 4.728 . 0 0 "[ . 1 . 2]" 1
1229 1 91 LEU HA 1 91 LEU QD . . 3.090 2.136 1.945 2.380 . 0 0 "[ . 1 . 2]" 1
1230 1 91 LEU HA 1 91 LEU HG . . 4.200 3.078 2.497 3.781 . 0 0 "[ . 1 . 2]" 1
1231 1 91 LEU HA 1 93 ALA H . . 5.110 4.586 4.227 4.974 . 0 0 "[ . 1 . 2]" 1
1232 1 91 LEU HA 1 94 LEU H . . 3.850 3.441 3.123 3.744 . 0 0 "[ . 1 . 2]" 1
1233 1 91 LEU HA 1 94 LEU HB2 . . 3.900 3.405 2.562 3.949 0.049 17 0 "[ . 1 . 2]" 1
1234 1 91 LEU HA 1 94 LEU HB3 . . 3.460 2.682 2.250 3.015 . 0 0 "[ . 1 . 2]" 1
1235 1 91 LEU HA 1 94 LEU QD . . 4.330 3.495 2.652 4.179 . 0 0 "[ . 1 . 2]" 1
1236 1 91 LEU HA 1 94 LEU HG . . 5.230 4.792 4.074 5.291 0.061 1 0 "[ . 1 . 2]" 1
1237 1 91 LEU HA 1 95 PHE H . . 4.660 4.278 3.852 4.652 . 0 0 "[ . 1 . 2]" 1
1238 1 91 LEU HA 1 95 PHE QD . . 4.360 3.269 2.758 4.121 . 0 0 "[ . 1 . 2]" 1
1239 1 91 LEU HB2 1 92 ASP H . . 4.400 2.778 2.377 3.139 . 0 0 "[ . 1 . 2]" 1
1240 1 91 LEU HB2 1 95 PHE QD . . 5.380 4.919 4.265 5.469 0.089 6 0 "[ . 1 . 2]" 1
1241 1 91 LEU HB3 1 92 ASP H . . 4.680 3.458 2.864 3.832 . 0 0 "[ . 1 . 2]" 1
1242 1 91 LEU HB3 1 95 PHE QD . . 4.810 3.407 2.639 4.085 . 0 0 "[ . 1 . 2]" 1
1243 1 91 LEU HB3 1 114 ILE MD . . 4.870 3.812 2.963 4.259 . 0 0 "[ . 1 . 2]" 1
1244 1 91 LEU QD 1 92 ASP H . . 5.130 4.088 3.866 4.348 . 0 0 "[ . 1 . 2]" 1
1245 1 91 LEU QD 1 95 PHE QD . . 3.360 2.893 2.441 3.416 0.056 6 0 "[ . 1 . 2]" 1
1246 1 91 LEU QD 1 114 ILE MD . . 5.220 4.328 3.708 4.710 . 0 0 "[ . 1 . 2]" 1
1247 1 92 ASP H 1 92 ASP QB . . 3.020 2.225 2.143 2.447 . 0 0 "[ . 1 . 2]" 1
1248 1 92 ASP H 1 93 ALA H . . 3.630 2.786 2.543 3.064 . 0 0 "[ . 1 . 2]" 1
1249 1 92 ASP H 1 94 LEU H . . 4.700 3.993 3.648 4.295 . 0 0 "[ . 1 . 2]" 1
1250 1 92 ASP H 1 114 ILE MD . . 4.540 4.513 3.798 4.638 0.098 15 0 "[ . 1 . 2]" 1
1251 1 92 ASP H 1 114 ILE HG13 . . 5.370 4.513 4.042 4.944 . 0 0 "[ . 1 . 2]" 1
1252 1 92 ASP HA 1 94 LEU H . . 4.960 4.067 3.593 4.530 . 0 0 "[ . 1 . 2]" 1
1253 1 92 ASP HA 1 95 PHE H . . 4.120 3.265 2.985 3.620 . 0 0 "[ . 1 . 2]" 1
1254 1 92 ASP HA 1 114 ILE MD . . 4.200 2.781 2.189 3.344 . 0 0 "[ . 1 . 2]" 1
1255 1 92 ASP HA 1 114 ILE MG . . 3.860 3.231 2.522 3.933 0.073 15 0 "[ . 1 . 2]" 1
1256 1 92 ASP QB 1 93 ALA H . . 3.380 2.612 2.323 3.071 . 0 0 "[ . 1 . 2]" 1
1257 1 92 ASP QB 1 93 ALA MB . . 4.180 3.945 3.536 4.239 0.059 15 0 "[ . 1 . 2]" 1
1258 1 92 ASP QB 1 114 ILE HB . . 4.040 3.717 3.032 4.124 0.084 2 0 "[ . 1 . 2]" 1
1259 1 92 ASP QB 1 114 ILE MD . . 4.210 3.837 3.268 4.214 0.004 7 0 "[ . 1 . 2]" 1
1260 1 92 ASP QB 1 114 ILE HG12 . . 4.910 4.415 3.459 4.986 0.076 1 0 "[ . 1 . 2]" 1
1261 1 92 ASP QB 1 114 ILE HG13 . . 4.270 2.967 2.379 3.605 . 0 0 "[ . 1 . 2]" 1
1262 1 92 ASP QB 1 114 ILE MG . . 3.890 2.581 2.095 3.578 . 0 0 "[ . 1 . 2]" 1
1263 1 93 ALA H 1 93 ALA MB . . 2.900 2.213 2.149 2.273 . 0 0 "[ . 1 . 2]" 1
1264 1 93 ALA H 1 94 LEU H . . 3.550 2.666 2.471 2.776 . 0 0 "[ . 1 . 2]" 1
1265 1 93 ALA H 1 94 LEU HA . . 5.260 5.300 5.140 5.336 0.076 1 0 "[ . 1 . 2]" 1
1266 1 93 ALA HA 1 95 PHE H . . 4.760 4.287 3.740 4.618 . 0 0 "[ . 1 . 2]" 1
1267 1 93 ALA MB 1 94 LEU H . . 3.090 2.859 2.444 3.175 0.085 13 0 "[ . 1 . 2]" 1
1268 1 93 ALA MB 1 95 PHE H . . 4.700 4.608 4.435 4.780 0.080 8 0 "[ . 1 . 2]" 1
1269 1 94 LEU H 1 94 LEU HB2 . . 3.470 2.572 2.353 2.883 . 0 0 "[ . 1 . 2]" 1
1270 1 94 LEU H 1 94 LEU HB3 . . 3.220 2.537 2.315 2.709 . 0 0 "[ . 1 . 2]" 1
1271 1 94 LEU H 1 94 LEU QD . . 4.360 3.762 3.657 3.872 . 0 0 "[ . 1 . 2]" 1
1272 1 94 LEU H 1 94 LEU HG . . 5.270 4.520 4.377 4.777 . 0 0 "[ . 1 . 2]" 1
1273 1 94 LEU H 1 95 PHE H . . 3.580 2.432 1.994 2.786 . 0 0 "[ . 1 . 2]" 1
1274 1 94 LEU HA 1 94 LEU QD . . 3.090 2.141 2.045 2.294 . 0 0 "[ . 1 . 2]" 1
1275 1 94 LEU HA 1 96 PRO HD2 . . 4.640 4.589 3.959 5.092 0.452 12 0 "[ . 1 . 2]" 1
1276 1 94 LEU HB2 1 95 PHE H . . 4.470 4.026 3.611 4.298 . 0 0 "[ . 1 . 2]" 1
1277 1 94 LEU HB2 1 95 PHE QD . . 4.740 4.327 3.868 4.824 0.084 17 0 "[ . 1 . 2]" 1
1278 1 94 LEU HB3 1 95 PHE H . . 3.980 2.938 2.711 3.372 . 0 0 "[ . 1 . 2]" 1
1279 1 94 LEU HB3 1 95 PHE QD . . 4.330 2.654 2.143 3.230 . 0 0 "[ . 1 . 2]" 1
1280 1 94 LEU QD 1 95 PHE H . . 5.500 3.963 3.592 4.431 . 0 0 "[ . 1 . 2]" 1
1281 1 94 LEU QD 1 95 PHE QD . . 3.530 2.829 2.286 3.306 . 0 0 "[ . 1 . 2]" 1
1282 1 94 LEU QD 1 95 PHE QE . . 4.380 2.320 2.000 2.719 . 0 0 "[ . 1 . 2]" 1
1283 1 94 LEU HG 1 95 PHE QD . . 4.790 3.875 2.528 4.875 0.085 18 0 "[ . 1 . 2]" 1
1284 1 95 PHE H 1 95 PHE QD . . 4.090 3.160 2.813 3.469 . 0 0 "[ . 1 . 2]" 1
1285 1 95 PHE H 1 96 PRO HD2 . . 4.860 4.032 3.668 4.379 . 0 0 "[ . 1 . 2]" 1
1286 1 95 PHE H 1 114 ILE HG13 . . 5.470 4.587 3.931 5.340 . 0 0 "[ . 1 . 2]" 1
1287 1 95 PHE HA 1 95 PHE QD . . 3.990 2.896 2.363 3.230 . 0 0 "[ . 1 . 2]" 1
1288 1 95 PHE HA 1 96 PRO HD2 . . 3.950 2.252 2.071 2.541 . 0 0 "[ . 1 . 2]" 1
1289 1 95 PHE HA 1 96 PRO HD3 . . 3.720 3.133 2.809 3.480 . 0 0 "[ . 1 . 2]" 1
1290 1 95 PHE HA 1 96 PRO HG2 . . 4.990 4.344 4.090 4.624 . 0 0 "[ . 1 . 2]" 1
1291 1 95 PHE HA 1 99 LEU QD . . 3.490 2.053 1.866 2.531 . 0 0 "[ . 1 . 2]" 1
1292 1 95 PHE HB2 1 114 ILE MD . . 4.460 2.258 2.091 2.780 . 0 0 "[ . 1 . 2]" 1
1293 1 95 PHE HB2 1 132 LEU QD . . 3.770 3.632 2.884 3.807 0.037 12 0 "[ . 1 . 2]" 1
1294 1 95 PHE HB3 1 114 ILE MD . . 4.910 2.636 2.240 3.218 . 0 0 "[ . 1 . 2]" 1
1295 1 95 PHE HB3 1 132 LEU QD . . 3.720 3.178 2.557 3.674 . 0 0 "[ . 1 . 2]" 1
1296 1 95 PHE QD 1 99 LEU HB2 . . 4.990 4.578 3.648 5.080 0.090 18 0 "[ . 1 . 2]" 1
1297 1 95 PHE QD 1 99 LEU QD . . 5.500 1.998 1.697 2.351 . 0 0 "[ . 1 . 2]" 1
1298 1 95 PHE QD 1 99 LEU HG . . 3.140 3.018 2.108 3.270 0.130 8 0 "[ . 1 . 2]" 1
1299 1 95 PHE QD 1 114 ILE MD . . 4.240 3.669 3.296 4.130 . 0 0 "[ . 1 . 2]" 1
1300 1 95 PHE QD 1 132 LEU QD . . 3.960 3.410 2.672 3.939 . 0 0 "[ . 1 . 2]" 1
1301 1 96 PRO HB3 1 98 ASN H . . 4.890 4.619 4.298 4.952 0.062 9 0 "[ . 1 . 2]" 1
1302 1 96 PRO HD2 1 97 VAL H . . 5.500 5.523 5.420 5.652 0.152 1 0 "[ . 1 . 2]" 1
1303 1 96 PRO HD2 1 99 LEU QD . . 5.010 2.640 2.049 3.475 . 0 0 "[ . 1 . 2]" 1
1304 1 97 VAL H 1 97 VAL HB . . 2.920 2.176 1.939 2.366 . 0 0 "[ . 1 . 2]" 1
1305 1 97 VAL H 1 97 VAL MG1 . . 3.390 2.366 2.114 3.510 0.120 8 0 "[ . 1 . 2]" 1
1306 1 97 VAL H 1 98 ASN H . . 4.960 3.051 2.717 3.210 . 0 0 "[ . 1 . 2]" 1
1307 1 97 VAL H 1 99 LEU H . . 4.980 4.801 4.338 5.055 0.075 9 0 "[ . 1 . 2]" 1
1308 1 97 VAL H 1 110 VAL MG1 . . 4.800 3.986 3.667 4.241 . 0 0 "[ . 1 . 2]" 1
1309 1 97 VAL HA 1 97 VAL MG1 . . 3.230 3.219 2.701 3.269 0.039 4 0 "[ . 1 . 2]" 1
1310 1 97 VAL HA 1 97 VAL MG2 . . 3.190 2.262 2.122 2.348 . 0 0 "[ . 1 . 2]" 1
1311 1 97 VAL HA 1 98 ASN H . . 3.190 3.148 2.949 3.279 0.089 8 0 "[ . 1 . 2]" 1
1312 1 97 VAL HA 1 98 ASN HA . . 4.550 4.576 4.391 4.627 0.077 5 0 "[ . 1 . 2]" 1
1313 1 97 VAL HA 1 110 VAL H . . 5.080 5.071 4.759 5.168 0.088 4 0 "[ . 1 . 2]" 1
1314 1 97 VAL HA 1 110 VAL MG1 . . 3.230 2.009 1.923 2.152 . 0 0 "[ . 1 . 2]" 1
1315 1 97 VAL HA 1 111 ARG H . . 4.980 4.905 4.283 5.058 0.078 3 0 "[ . 1 . 2]" 1
1316 1 97 VAL HA 1 113 PRO HA . . 3.860 3.151 2.874 3.410 . 0 0 "[ . 1 . 2]" 1
1317 1 97 VAL HB 1 98 ASN H . . 4.330 4.303 3.459 4.410 0.080 20 0 "[ . 1 . 2]" 1
1318 1 97 VAL HB 1 110 VAL MG1 . . 4.650 4.079 3.963 4.365 . 0 0 "[ . 1 . 2]" 1
1319 1 97 VAL HB 1 113 PRO HA . . 3.710 2.985 2.535 3.813 0.103 8 0 "[ . 1 . 2]" 1
1320 1 97 VAL MG1 1 98 ASN H . . 3.410 3.265 2.836 3.512 0.102 8 0 "[ . 1 . 2]" 1
1321 1 97 VAL MG1 1 98 ASN HA . . 4.100 3.885 3.528 4.183 0.083 9 0 "[ . 1 . 2]" 1
1322 1 97 VAL MG1 1 98 ASN HD21 . . 4.000 3.309 2.153 4.084 0.084 4 0 "[ . 1 . 2]" 1
1323 1 97 VAL MG1 1 98 ASN HD22 . . 3.990 3.055 2.548 3.577 . 0 0 "[ . 1 . 2]" 1
1324 1 97 VAL MG1 1 113 PRO HB3 . . 4.820 4.218 3.659 4.795 . 0 0 "[ . 1 . 2]" 1
1325 1 97 VAL MG2 1 98 ASN HD21 . . 5.500 5.055 3.769 5.599 0.099 11 0 "[ . 1 . 2]" 1
1326 1 97 VAL MG2 1 98 ASN HD22 . . 5.100 5.099 4.431 5.200 0.100 2 0 "[ . 1 . 2]" 1
1327 1 97 VAL MG2 1 110 VAL MG1 . . 3.110 2.895 2.660 3.125 0.015 10 0 "[ . 1 . 2]" 1
1328 1 97 VAL MG2 1 112 THR H . . 4.210 4.158 3.869 4.310 0.100 14 0 "[ . 1 . 2]" 1
1329 1 97 VAL MG2 1 112 THR HA . . 3.920 3.252 2.780 3.577 . 0 0 "[ . 1 . 2]" 1
1330 1 97 VAL MG2 1 112 THR HB . . 4.710 4.746 4.419 4.814 0.104 18 0 "[ . 1 . 2]" 1
1331 1 97 VAL MG2 1 113 PRO HA . . 3.180 2.515 1.851 2.706 . 0 0 "[ . 1 . 2]" 1
1332 1 97 VAL MG2 1 113 PRO HB2 . . 4.730 4.110 3.384 4.439 . 0 0 "[ . 1 . 2]" 1
1333 1 97 VAL MG2 1 113 PRO HB3 . . 3.480 2.736 2.089 3.162 . 0 0 "[ . 1 . 2]" 1
1334 1 97 VAL MG2 1 113 PRO HD2 . . 4.120 3.935 3.574 4.183 0.063 18 0 "[ . 1 . 2]" 1
1335 1 97 VAL MG2 1 113 PRO HD3 . . 4.290 2.727 2.268 2.982 . 0 0 "[ . 1 . 2]" 1
1336 1 97 VAL MG2 1 113 PRO HG3 . . 3.990 3.913 3.545 4.085 0.095 18 0 "[ . 1 . 2]" 1
1337 1 97 VAL MG2 1 114 ILE H . . 4.650 4.617 3.842 4.750 0.100 4 0 "[ . 1 . 2]" 1
1338 1 98 ASN H 1 99 LEU H . . 3.790 2.152 1.952 2.357 . 0 0 "[ . 1 . 2]" 1
1339 1 98 ASN H 1 110 VAL MG1 . . 3.820 3.092 2.427 3.755 . 0 0 "[ . 1 . 2]" 1
1340 1 98 ASN HA 1 99 LEU HB2 . . 4.690 4.715 4.523 5.374 0.684 8 1 "[ . + 1 . 2]" 1
1341 1 98 ASN HA 1 109 ARG QB . . 5.100 4.395 3.441 4.933 . 0 0 "[ . 1 . 2]" 1
1342 1 98 ASN HA 1 109 ARG QD . . 4.510 3.971 3.025 4.436 . 0 0 "[ . 1 . 2]" 1
1343 1 98 ASN HA 1 110 VAL H . . 5.500 4.270 3.663 5.107 . 0 0 "[ . 1 . 2]" 1
1344 1 98 ASN QB 1 99 LEU H . . 3.850 2.594 2.226 3.661 . 0 0 "[ . 1 . 2]" 1
1345 1 98 ASN QB 1 99 LEU HA . . 5.500 4.068 3.786 4.459 . 0 0 "[ . 1 . 2]" 1
1346 1 98 ASN QB 1 100 VAL H . . 5.080 3.256 2.607 4.645 . 0 0 "[ . 1 . 2]" 1
1347 1 98 ASN QB 1 100 VAL QG . . 4.250 2.568 1.982 3.632 . 0 0 "[ . 1 . 2]" 1
1348 1 99 LEU H 1 99 LEU HB2 . . 3.310 2.742 2.325 3.101 . 0 0 "[ . 1 . 2]" 1
1349 1 99 LEU H 1 99 LEU HB3 . . 3.880 3.670 2.369 3.969 0.089 10 0 "[ . 1 . 2]" 1
1350 1 99 LEU H 1 99 LEU QD . . 4.160 3.040 2.201 3.657 . 0 0 "[ . 1 . 2]" 1
1351 1 99 LEU H 1 110 VAL H . . 4.420 4.427 4.078 4.513 0.093 4 0 "[ . 1 . 2]" 1
1352 1 99 LEU H 1 110 VAL MG1 . . 4.000 3.267 2.718 3.504 . 0 0 "[ . 1 . 2]" 1
1353 1 99 LEU HA 1 99 LEU QD . . 3.130 2.125 1.917 2.648 . 0 0 "[ . 1 . 2]" 1
1354 1 99 LEU HA 1 99 LEU HG . . 4.120 3.001 2.313 3.686 . 0 0 "[ . 1 . 2]" 1
1355 1 99 LEU HA 1 100 VAL H . . 2.920 2.565 2.252 2.971 0.051 14 0 "[ . 1 . 2]" 1
1356 1 99 LEU HA 1 110 VAL HB . . 5.060 4.675 4.417 5.144 0.084 8 0 "[ . 1 . 2]" 1
1357 1 99 LEU HB2 1 100 VAL H . . 5.140 4.608 4.463 4.762 . 0 0 "[ . 1 . 2]" 1
1358 1 99 LEU HB2 1 110 VAL H . . 5.350 2.773 1.976 4.905 . 0 0 "[ . 1 . 2]" 1
1359 1 99 LEU HB2 1 110 VAL HB . . 4.490 2.235 2.023 3.244 . 0 0 "[ . 1 . 2]" 1
1360 1 99 LEU HB3 1 100 VAL H . . 5.000 4.348 4.161 4.491 . 0 0 "[ . 1 . 2]" 1
1361 1 99 LEU HB3 1 101 MET ME . . 4.590 3.156 2.183 4.105 . 0 0 "[ . 1 . 2]" 1
1362 1 99 LEU QD 1 101 MET ME . . 3.960 2.059 1.850 2.647 . 0 0 "[ . 1 . 2]" 1
1363 1 99 LEU HG 1 101 MET QG . . 4.130 3.692 2.542 4.111 . 0 0 "[ . 1 . 2]" 1
1364 1 99 LEU HG 1 110 VAL HB . . 3.790 3.407 2.457 3.884 0.094 18 0 "[ . 1 . 2]" 1
1365 1 100 VAL H 1 100 VAL HB . . 3.390 2.780 2.278 3.472 0.082 10 0 "[ . 1 . 2]" 1
1366 1 100 VAL H 1 100 VAL QG . . 3.370 2.042 1.701 2.611 . 0 0 "[ . 1 . 2]" 1
1367 1 100 VAL H 1 101 MET H . . 5.220 4.072 3.301 4.566 . 0 0 "[ . 1 . 2]" 1
1368 1 100 VAL HA 1 100 VAL QG . . 3.310 2.221 2.068 2.403 . 0 0 "[ . 1 . 2]" 1
1369 1 100 VAL HA 1 101 MET H . . 3.240 2.293 2.110 2.731 . 0 0 "[ . 1 . 2]" 1
1370 1 100 VAL HB 1 101 MET H . . 4.990 4.443 4.147 4.610 . 0 0 "[ . 1 . 2]" 1
1371 1 100 VAL QG 1 101 MET H . . 3.610 3.319 2.564 3.554 . 0 0 "[ . 1 . 2]" 1
1372 1 100 VAL QG 1 101 MET HA . . 4.990 3.848 3.398 4.278 . 0 0 "[ . 1 . 2]" 1
1373 1 101 MET H 1 101 MET HB2 . . 4.070 3.080 1.995 3.938 . 0 0 "[ . 1 . 2]" 1
1374 1 101 MET H 1 101 MET ME . . 3.760 3.753 3.494 3.870 0.110 4 0 "[ . 1 . 2]" 1
1375 1 101 MET H 1 101 MET QG . . 4.480 2.428 2.050 3.577 . 0 0 "[ . 1 . 2]" 1
1376 1 101 MET H 1 102 GLN H . . 4.950 4.127 3.612 4.663 . 0 0 "[ . 1 . 2]" 1
1377 1 101 MET H 1 107 ALA MB . . 4.750 3.979 2.950 4.836 0.086 10 0 "[ . 1 . 2]" 1
1378 1 101 MET H 1 108 VAL H . . 4.270 3.431 2.316 4.299 0.029 4 0 "[ . 1 . 2]" 1
1379 1 101 MET H 1 108 VAL QG . . 4.060 3.369 2.370 4.045 . 0 0 "[ . 1 . 2]" 1
1380 1 101 MET H 1 109 ARG HA . . 4.970 4.463 3.867 5.042 0.072 12 0 "[ . 1 . 2]" 1
1381 1 101 MET HA 1 101 MET ME . . 4.890 4.775 4.321 5.022 0.132 2 0 "[ . 1 . 2]" 1
1382 1 101 MET HA 1 101 MET QG . . 3.820 2.770 2.071 3.360 . 0 0 "[ . 1 . 2]" 1
1383 1 101 MET HA 1 102 GLN H . . 3.010 2.330 2.151 2.596 . 0 0 "[ . 1 . 2]" 1
1384 1 101 MET HB2 1 101 MET ME . . 4.460 3.238 2.147 4.180 . 0 0 "[ . 1 . 2]" 1
1385 1 101 MET HB2 1 102 GLN H . . 5.150 3.801 2.400 4.655 . 0 0 "[ . 1 . 2]" 1
1386 1 101 MET HB2 1 108 VAL H . . 5.040 4.029 2.827 5.127 0.087 14 0 "[ . 1 . 2]" 1
1387 1 101 MET HB2 1 108 VAL QG . . 5.500 2.756 2.043 4.082 . 0 0 "[ . 1 . 2]" 1
1388 1 101 MET HB3 1 101 MET ME . . 4.720 3.591 2.493 4.145 . 0 0 "[ . 1 . 2]" 1
1389 1 101 MET ME 1 101 MET QG . . 3.510 2.112 1.901 2.638 . 0 0 "[ . 1 . 2]" 1
1390 1 101 MET ME 1 108 VAL H . . 4.330 4.303 3.809 4.441 0.111 20 0 "[ . 1 . 2]" 1
1391 1 101 MET ME 1 108 VAL HB . . 4.150 3.597 2.145 4.247 0.097 14 0 "[ . 1 . 2]" 1
1392 1 101 MET ME 1 108 VAL QG . . 3.360 1.880 1.740 2.196 . 0 0 "[ . 1 . 2]" 1
1393 1 101 MET ME 1 110 VAL H . . 4.730 4.683 3.729 4.832 0.102 15 0 "[ . 1 . 2]" 1
1394 1 101 MET ME 1 110 VAL HA . . 4.990 4.704 4.035 5.087 0.097 1 0 "[ . 1 . 2]" 1
1395 1 101 MET ME 1 134 TYR HB2 . . 4.690 4.694 3.919 5.375 0.685 1 2 "[+ . 1 - 2]" 1
1396 1 101 MET QG 1 102 GLN H . . 5.180 4.285 3.709 4.651 . 0 0 "[ . 1 . 2]" 1
1397 1 101 MET QG 1 108 VAL HB . . 5.090 4.543 2.060 5.026 . 0 0 "[ . 1 . 2]" 1
1398 1 102 GLN H 1 102 GLN HB2 . . 3.620 3.168 2.209 3.716 0.096 14 0 "[ . 1 . 2]" 1
1399 1 102 GLN H 1 102 GLN HB3 . . 3.400 3.245 2.605 3.696 0.296 5 0 "[ . 1 . 2]" 1
1400 1 102 GLN H 1 102 GLN HG2 . . 4.110 2.980 2.052 4.448 0.338 5 0 "[ . 1 . 2]" 1
1401 1 102 GLN H 1 107 ALA MB . . 5.500 4.661 3.729 5.583 0.083 12 0 "[ . 1 . 2]" 1
1402 1 102 GLN H 1 108 VAL QG . . 5.310 4.976 3.947 5.315 0.005 3 0 "[ . 1 . 2]" 1
1403 1 102 GLN HA 1 103 SER H . . 3.210 2.277 2.072 2.689 . 0 0 "[ . 1 . 2]" 1
1404 1 102 GLN HB2 1 107 ALA MB . . 5.500 4.474 3.128 5.772 0.272 10 0 "[ . 1 . 2]" 1
1405 1 102 GLN HG2 1 103 SER H . . 5.170 4.748 3.460 5.617 0.447 17 0 "[ . 1 . 2]" 1
1406 1 103 SER H 1 106 LEU H . . 4.100 3.673 2.890 4.160 0.060 1 0 "[ . 1 . 2]" 1
1407 1 103 SER H 1 106 LEU QD . . 4.900 4.766 3.903 5.026 0.126 3 0 "[ . 1 . 2]" 1
1408 1 103 SER HA 1 104 GLY H . . 2.880 2.608 2.313 2.957 0.077 13 0 "[ . 1 . 2]" 1
1409 1 103 SER HA 1 104 GLY HA3 . . 4.840 4.612 4.278 4.882 0.042 2 0 "[ . 1 . 2]" 1
1410 1 103 SER QB 1 104 GLY H . . 4.830 2.763 2.312 4.058 . 0 0 "[ . 1 . 2]" 1
1411 1 103 SER QB 1 106 LEU QD . . 4.240 3.966 3.287 4.259 0.019 8 0 "[ . 1 . 2]" 1
1412 1 104 GLY H 1 105 GLY H . . 4.180 3.053 2.442 3.868 . 0 0 "[ . 1 . 2]" 1
1413 1 104 GLY H 1 106 LEU H . . 5.200 4.954 4.509 5.278 0.078 14 0 "[ . 1 . 2]" 1
1414 1 105 GLY H 1 106 LEU H . . 3.870 2.466 1.979 3.007 . 0 0 "[ . 1 . 2]" 1
1415 1 105 GLY HA3 1 106 LEU HG . . 5.260 3.949 2.638 5.330 0.070 15 0 "[ . 1 . 2]" 1
1416 1 106 LEU H 1 106 LEU HB2 . . 3.860 3.667 2.561 4.051 0.191 11 0 "[ . 1 . 2]" 1
1417 1 106 LEU H 1 106 LEU HB3 . . 4.120 3.712 3.199 3.982 . 0 0 "[ . 1 . 2]" 1
1418 1 106 LEU H 1 106 LEU QD . . 3.890 2.160 1.767 2.472 . 0 0 "[ . 1 . 2]" 1
1419 1 106 LEU H 1 106 LEU HG . . 3.680 3.512 3.091 3.778 0.098 14 0 "[ . 1 . 2]" 1
1420 1 106 LEU H 1 107 ALA H . . 5.460 4.115 2.915 4.343 . 0 0 "[ . 1 . 2]" 1
1421 1 106 LEU HB2 1 107 ALA H . . 4.040 2.302 1.858 2.777 . 0 0 "[ . 1 . 2]" 1
1422 1 106 LEU HB2 1 138 PHE QD . . 5.460 4.805 3.458 5.549 0.089 20 0 "[ . 1 . 2]" 1
1423 1 106 LEU HB3 1 107 ALA H . . 4.060 3.190 1.875 3.736 . 0 0 "[ . 1 . 2]" 1
1424 1 106 LEU HB3 1 138 PHE QD . . 4.950 4.632 3.167 5.464 0.514 8 1 "[ . + 1 . 2]" 1
1425 1 106 LEU QD 1 107 ALA H . . 4.220 3.357 1.955 3.917 . 0 0 "[ . 1 . 2]" 1
1426 1 106 LEU QD 1 138 PHE H . . 5.280 4.571 3.835 5.187 . 0 0 "[ . 1 . 2]" 1
1427 1 106 LEU QD 1 138 PHE QB . . 4.930 3.634 2.331 4.471 . 0 0 "[ . 1 . 2]" 1
1428 1 106 LEU QD 1 138 PHE QD . . 3.890 2.879 2.215 3.930 0.040 17 0 "[ . 1 . 2]" 1
1429 1 107 ALA H 1 107 ALA MB . . 3.330 2.373 2.193 2.860 . 0 0 "[ . 1 . 2]" 1
1430 1 107 ALA HA 1 108 VAL HB . . 4.870 4.641 4.213 4.941 0.071 7 0 "[ . 1 . 2]" 1
1431 1 107 ALA MB 1 108 VAL H . . 3.630 2.824 2.052 3.699 0.069 13 0 "[ . 1 . 2]" 1
1432 1 107 ALA MB 1 137 GLN HE21 . . 5.500 2.752 1.944 4.175 . 0 0 "[ . 1 . 2]" 1
1433 1 107 ALA MB 1 137 GLN HE22 . . 5.380 3.531 2.241 5.469 0.089 9 0 "[ . 1 . 2]" 1
1434 1 107 ALA MB 1 137 GLN QG . . 3.830 3.133 2.071 3.949 0.119 20 0 "[ . 1 . 2]" 1
1435 1 107 ALA MB 1 139 TYR QB . . 5.470 4.288 2.095 5.343 . 0 0 "[ . 1 . 2]" 1
1436 1 107 ALA MB 1 139 TYR QD . . 5.290 3.314 2.139 4.036 . 0 0 "[ . 1 . 2]" 1
1437 1 107 ALA MB 1 139 TYR QE . . 3.970 3.167 2.015 4.097 0.127 10 0 "[ . 1 . 2]" 1
1438 1 108 VAL H 1 108 VAL HB . . 3.520 2.991 2.223 3.595 0.075 6 0 "[ . 1 . 2]" 1
1439 1 108 VAL H 1 108 VAL QG . . 3.490 2.182 1.756 2.650 . 0 0 "[ . 1 . 2]" 1
1440 1 108 VAL H 1 137 GLN HE21 . . 4.980 4.596 3.290 5.693 0.713 20 1 "[ . 1 . +]" 1
1441 1 108 VAL HA 1 109 ARG H . . 3.130 2.478 2.128 2.658 . 0 0 "[ . 1 . 2]" 1
1442 1 108 VAL HA 1 136 VAL HA . . 3.650 2.510 1.984 3.687 0.037 2 0 "[ . 1 . 2]" 1
1443 1 108 VAL HA 1 136 VAL QG . . 4.340 2.988 2.043 3.820 . 0 0 "[ . 1 . 2]" 1
1444 1 108 VAL QG 1 109 ARG H . . 3.780 2.177 1.930 2.743 . 0 0 "[ . 1 . 2]" 1
1445 1 108 VAL QG 1 134 TYR HA . . 5.400 4.626 4.065 5.012 . 0 0 "[ . 1 . 2]" 1
1446 1 108 VAL QG 1 134 TYR HB2 . . 3.850 2.961 2.336 3.902 0.052 1 0 "[ . 1 . 2]" 1
1447 1 108 VAL QG 1 134 TYR HB3 . . 4.250 3.754 2.594 4.277 0.027 19 0 "[ . 1 . 2]" 1
1448 1 108 VAL QG 1 134 TYR QD . . 3.850 2.732 2.065 3.760 . 0 0 "[ . 1 . 2]" 1
1449 1 108 VAL QG 1 135 ASP H . . 4.570 3.562 2.818 4.276 . 0 0 "[ . 1 . 2]" 1
1450 1 108 VAL QG 1 136 VAL HA . . 5.010 2.834 2.033 4.170 . 0 0 "[ . 1 . 2]" 1
1451 1 108 VAL QG 1 136 VAL QG . . 4.350 2.594 2.014 3.262 . 0 0 "[ . 1 . 2]" 1
1452 1 109 ARG H 1 109 ARG HG3 . . 4.800 4.126 3.126 5.117 0.317 15 0 "[ . 1 . 2]" 1
1453 1 109 ARG H 1 110 VAL H . . 5.360 4.266 3.957 4.455 . 0 0 "[ . 1 . 2]" 1
1454 1 109 ARG H 1 134 TYR HA . . 5.270 5.028 4.124 5.347 0.077 19 0 "[ . 1 . 2]" 1
1455 1 109 ARG H 1 134 TYR HB2 . . 4.750 3.955 3.400 5.584 0.834 1 2 "[+ . -1 . 2]" 1
1456 1 109 ARG H 1 134 TYR HB3 . . 5.500 5.069 3.752 5.562 0.062 4 0 "[ . 1 . 2]" 1
1457 1 109 ARG H 1 135 ASP H . . 4.030 3.390 2.419 4.098 0.068 7 0 "[ . 1 . 2]" 1
1458 1 109 ARG H 1 136 VAL HA . . 4.380 3.282 2.072 4.119 . 0 0 "[ . 1 . 2]" 1
1459 1 109 ARG H 1 136 VAL QG . . 5.080 4.162 3.395 4.705 . 0 0 "[ . 1 . 2]" 1
1460 1 109 ARG H 1 137 GLN H . . 5.360 4.764 3.894 5.423 0.063 2 0 "[ . 1 . 2]" 1
1461 1 109 ARG HA 1 109 ARG HG2 . . 4.120 2.953 2.299 3.821 . 0 0 "[ . 1 . 2]" 1
1462 1 109 ARG HA 1 109 ARG HG3 . . 4.250 2.950 2.381 3.889 . 0 0 "[ . 1 . 2]" 1
1463 1 109 ARG HA 1 110 VAL H . . 3.150 2.317 2.164 2.755 . 0 0 "[ . 1 . 2]" 1
1464 1 109 ARG HA 1 110 VAL HB . . 4.590 4.362 4.024 4.646 0.056 10 0 "[ . 1 . 2]" 1
1465 1 109 ARG HA 1 110 VAL MG1 . . 4.350 3.952 3.759 4.277 . 0 0 "[ . 1 . 2]" 1
1466 1 109 ARG QB 1 110 VAL H . . 4.820 2.991 1.857 3.857 . 0 0 "[ . 1 . 2]" 1
1467 1 109 ARG QB 1 135 ASP H . . 4.890 4.221 3.733 4.712 . 0 0 "[ . 1 . 2]" 1
1468 1 109 ARG HG2 1 110 VAL H . . 4.420 3.626 2.170 4.633 0.213 4 0 "[ . 1 . 2]" 1
1469 1 109 ARG HG3 1 110 VAL H . . 4.540 3.923 2.353 4.628 0.088 2 0 "[ . 1 . 2]" 1
1470 1 110 VAL H 1 110 VAL HB . . 3.570 2.494 2.291 2.795 . 0 0 "[ . 1 . 2]" 1
1471 1 110 VAL H 1 110 VAL MG1 . . 3.270 2.019 1.872 2.138 . 0 0 "[ . 1 . 2]" 1
1472 1 110 VAL H 1 111 ARG H . . 4.930 2.638 2.152 2.923 . 0 0 "[ . 1 . 2]" 1
1473 1 110 VAL HA 1 110 VAL MG1 . . 3.130 3.222 3.204 3.232 0.102 17 0 "[ . 1 . 2]" 1
1474 1 110 VAL HA 1 111 ARG H . . 3.500 3.491 3.440 3.564 0.064 8 0 "[ . 1 . 2]" 1
1475 1 110 VAL HA 1 111 ARG HA . . 5.290 5.286 5.208 5.355 0.065 1 0 "[ . 1 . 2]" 1
1476 1 110 VAL HA 1 111 ARG HB2 . . 4.570 4.401 3.975 4.828 0.258 13 0 "[ . 1 . 2]" 1
1477 1 110 VAL HA 1 112 THR H . . 4.260 4.169 3.972 4.326 0.066 6 0 "[ . 1 . 2]" 1
1478 1 110 VAL HA 1 132 LEU QD . . 4.550 3.552 3.003 4.264 . 0 0 "[ . 1 . 2]" 1
1479 1 110 VAL HA 1 134 TYR HA . . 3.760 2.764 2.172 3.682 . 0 0 "[ . 1 . 2]" 1
1480 1 110 VAL HA 1 134 TYR HB2 . . 4.480 3.082 2.482 4.431 . 0 0 "[ . 1 . 2]" 1
1481 1 110 VAL HA 1 134 TYR HB3 . . 4.440 2.598 2.107 4.018 . 0 0 "[ . 1 . 2]" 1
1482 1 110 VAL HA 1 135 ASP H . . 4.850 4.037 3.576 4.786 . 0 0 "[ . 1 . 2]" 1
1483 1 110 VAL MG1 1 111 ARG H . . 3.750 2.461 2.073 2.711 . 0 0 "[ . 1 . 2]" 1
1484 1 110 VAL MG1 1 111 ARG HA . . 4.240 3.859 3.481 4.167 . 0 0 "[ . 1 . 2]" 1
1485 1 110 VAL MG1 1 112 THR H . . 3.680 3.123 2.543 3.612 . 0 0 "[ . 1 . 2]" 1
1486 1 111 ARG H 1 111 ARG HB2 . . 3.780 3.272 2.982 3.701 . 0 0 "[ . 1 . 2]" 1
1487 1 111 ARG H 1 111 ARG HG2 . . 4.960 4.365 3.133 5.046 0.086 14 0 "[ . 1 . 2]" 1
1488 1 111 ARG H 1 111 ARG HG3 . . 4.780 4.526 3.251 5.033 0.253 3 0 "[ . 1 . 2]" 1
1489 1 111 ARG H 1 112 THR H . . 3.590 3.550 3.341 3.677 0.087 9 0 "[ . 1 . 2]" 1
1490 1 111 ARG HA 1 111 ARG HD2 . . 4.270 3.468 2.115 4.361 0.091 13 0 "[ . 1 . 2]" 1
1491 1 111 ARG HA 1 111 ARG HD3 . . 3.950 3.411 2.153 4.314 0.364 19 0 "[ . 1 . 2]" 1
1492 1 111 ARG HA 1 112 THR MG . . 4.570 4.423 4.094 4.668 0.098 20 0 "[ . 1 . 2]" 1
1493 1 111 ARG HB2 1 112 THR H . . 3.700 3.467 2.610 4.045 0.345 11 0 "[ . 1 . 2]" 1
1494 1 111 ARG HB2 1 112 THR MG . . 4.030 3.949 2.828 4.727 0.697 11 1 "[ . 1+ . 2]" 1
1495 1 111 ARG HB2 1 134 TYR HA . . 4.390 2.983 2.282 4.046 . 0 0 "[ . 1 . 2]" 1
1496 1 111 ARG HD3 1 112 THR MG . . 5.500 4.802 2.782 5.837 0.337 17 0 "[ . 1 . 2]" 1
1497 1 111 ARG HG2 1 112 THR H . . 5.500 4.683 3.645 5.553 0.053 5 0 "[ . 1 . 2]" 1
1498 1 111 ARG HG3 1 112 THR H . . 5.250 4.928 4.224 5.522 0.272 18 0 "[ . 1 . 2]" 1
1499 1 111 ARG HG3 1 134 TYR HA . . 5.430 5.145 4.295 6.256 0.826 9 1 "[ . +1 . 2]" 1
1500 1 112 THR H 1 112 THR MG . . 3.760 2.727 2.394 3.171 . 0 0 "[ . 1 . 2]" 1
1501 1 112 THR H 1 113 PRO HD2 . . 5.300 4.882 4.779 4.970 . 0 0 "[ . 1 . 2]" 1
1502 1 112 THR H 1 113 PRO HD3 . . 5.500 5.151 5.034 5.298 . 0 0 "[ . 1 . 2]" 1
1503 1 112 THR H 1 133 GLY H . . 4.240 3.961 3.388 4.319 0.079 9 0 "[ . 1 . 2]" 1
1504 1 112 THR H 1 134 TYR HA . . 4.630 4.106 3.667 4.688 0.058 1 0 "[ . 1 . 2]" 1
1505 1 112 THR HA 1 112 THR MG . . 3.190 2.327 2.190 2.445 . 0 0 "[ . 1 . 2]" 1
1506 1 112 THR HA 1 113 PRO HD2 . . 3.030 2.503 2.331 2.617 . 0 0 "[ . 1 . 2]" 1
1507 1 112 THR HA 1 113 PRO HD3 . . 3.320 2.514 2.381 2.702 . 0 0 "[ . 1 . 2]" 1
1508 1 112 THR HA 1 113 PRO HG3 . . 4.670 4.688 4.631 4.734 0.064 11 0 "[ . 1 . 2]" 1
1509 1 112 THR HB 1 113 PRO HD2 . . 3.600 2.162 2.028 2.328 . 0 0 "[ . 1 . 2]" 1
1510 1 112 THR HB 1 113 PRO HD3 . . 3.580 3.595 3.442 3.656 0.076 20 0 "[ . 1 . 2]" 1
1511 1 112 THR MG 1 113 PRO HD2 . . 3.550 3.228 3.002 3.446 . 0 0 "[ . 1 . 2]" 1
1512 1 112 THR MG 1 113 PRO HD3 . . 4.590 4.019 3.677 4.334 . 0 0 "[ . 1 . 2]" 1
1513 1 112 THR MG 1 133 GLY H . . 4.130 3.590 2.519 4.238 0.108 13 0 "[ . 1 . 2]" 1
1514 1 112 THR MG 1 133 GLY HA3 . . 4.610 3.892 2.952 4.668 0.058 6 0 "[ . 1 . 2]" 1
1515 1 113 PRO HA 1 114 ILE H . . 3.000 2.469 2.334 2.708 . 0 0 "[ . 1 . 2]" 1
1516 1 113 PRO HA 1 114 ILE HB . . 5.030 4.731 4.492 5.040 0.010 15 0 "[ . 1 . 2]" 1
1517 1 113 PRO HB2 1 114 ILE H . . 3.810 2.503 2.061 2.943 . 0 0 "[ . 1 . 2]" 1
1518 1 113 PRO HB3 1 114 ILE H . . 3.990 3.516 3.393 3.706 . 0 0 "[ . 1 . 2]" 1
1519 1 113 PRO HG3 1 114 ILE H . . 5.390 5.001 4.574 5.353 . 0 0 "[ . 1 . 2]" 1
1520 1 114 ILE H 1 114 ILE HB . . 3.130 2.286 2.047 2.541 . 0 0 "[ . 1 . 2]" 1
1521 1 114 ILE H 1 114 ILE MD . . 5.180 3.506 2.943 3.872 . 0 0 "[ . 1 . 2]" 1
1522 1 114 ILE H 1 114 ILE HG12 . . 4.110 2.271 2.029 2.503 . 0 0 "[ . 1 . 2]" 1
1523 1 114 ILE H 1 114 ILE HG13 . . 4.030 3.500 3.287 3.675 . 0 0 "[ . 1 . 2]" 1
1524 1 114 ILE H 1 114 ILE MG . . 4.180 3.705 3.562 3.806 . 0 0 "[ . 1 . 2]" 1
1525 1 114 ILE HA 1 114 ILE MD . . 3.400 2.181 2.049 2.425 . 0 0 "[ . 1 . 2]" 1
1526 1 114 ILE HA 1 114 ILE MG . . 3.050 2.600 2.393 2.720 . 0 0 "[ . 1 . 2]" 1
1527 1 114 ILE HA 1 115 SER H . . 2.830 2.302 2.195 2.418 . 0 0 "[ . 1 . 2]" 1
1528 1 114 ILE HA 1 131 SER H . . 5.300 5.009 4.501 5.364 0.064 18 0 "[ . 1 . 2]" 1
1529 1 114 ILE HA 1 132 LEU HB2 . . 4.500 4.253 3.895 4.548 0.048 20 0 "[ . 1 . 2]" 1
1530 1 114 ILE HA 1 132 LEU HB3 . . 4.120 2.780 2.362 3.233 . 0 0 "[ . 1 . 2]" 1
1531 1 114 ILE HA 1 132 LEU QD . . 5.370 3.101 2.745 3.552 . 0 0 "[ . 1 . 2]" 1
1532 1 114 ILE HB 1 115 SER H . . 4.430 4.131 3.763 4.500 0.070 4 0 "[ . 1 . 2]" 1
1533 1 114 ILE MD 1 114 ILE MG . . 2.780 2.119 2.040 2.220 . 0 0 "[ . 1 . 2]" 1
1534 1 114 ILE MD 1 115 SER H . . 3.720 3.557 3.098 3.816 0.096 15 0 "[ . 1 . 2]" 1
1535 1 114 ILE MD 1 131 SER HA . . 5.500 5.181 4.595 5.593 0.093 17 0 "[ . 1 . 2]" 1
1536 1 114 ILE MD 1 132 LEU HA . . 5.320 4.974 4.416 5.414 0.094 20 0 "[ . 1 . 2]" 1
1537 1 114 ILE MD 1 132 LEU HB2 . . 5.030 4.152 3.445 4.742 . 0 0 "[ . 1 . 2]" 1
1538 1 114 ILE MD 1 132 LEU HB3 . . 3.490 3.058 2.345 3.557 0.067 4 0 "[ . 1 . 2]" 1
1539 1 114 ILE MD 1 132 LEU QD . . 2.740 2.012 1.916 2.243 . 0 0 "[ . 1 . 2]" 1
1540 1 114 ILE MG 1 115 SER H . . 3.400 2.523 2.088 3.147 . 0 0 "[ . 1 . 2]" 1
1541 1 114 ILE MG 1 115 SER HA . . 3.760 3.465 3.037 3.856 0.096 6 0 "[ . 1 . 2]" 1
1542 1 114 ILE MG 1 115 SER QB . . 4.890 4.183 4.045 4.426 . 0 0 "[ . 1 . 2]" 1
1543 1 115 SER H 1 115 SER QB . . 3.030 2.603 2.014 2.996 . 0 0 "[ . 1 . 2]" 1
1544 1 115 SER H 1 130 ILE MG . . 4.340 3.641 3.082 4.127 . 0 0 "[ . 1 . 2]" 1
1545 1 115 SER H 1 131 SER H . . 3.690 3.312 2.957 3.768 0.078 12 0 "[ . 1 . 2]" 1
1546 1 115 SER H 1 132 LEU QD . . 3.980 3.978 3.608 4.034 0.054 5 0 "[ . 1 . 2]" 1
1547 1 115 SER HA 1 116 ASN H . . 2.890 2.366 2.205 2.627 . 0 0 "[ . 1 . 2]" 1
1548 1 115 SER QB 1 116 ASN H . . 3.110 2.892 2.238 3.122 0.012 4 0 "[ . 1 . 2]" 1
1549 1 115 SER QB 1 116 ASN QB . . 4.980 4.603 4.105 4.810 . 0 0 "[ . 1 . 2]" 1
1550 1 116 ASN H 1 116 ASN QB . . 3.140 2.645 2.157 3.213 0.073 10 0 "[ . 1 . 2]" 1
1551 1 116 ASN H 1 116 ASN HD21 . . 4.690 4.722 4.366 4.781 0.091 17 0 "[ . 1 . 2]" 1
1552 1 116 ASN H 1 116 ASN HD22 . . 5.500 5.469 4.588 5.602 0.102 13 0 "[ . 1 . 2]" 1
1553 1 116 ASN H 1 117 GLY H . . 4.510 4.221 3.836 4.425 . 0 0 "[ . 1 . 2]" 1
1554 1 116 ASN H 1 130 ILE MG . . 5.500 4.993 4.707 5.377 . 0 0 "[ . 1 . 2]" 1
1555 1 116 ASN HA 1 117 GLY H . . 2.880 2.453 2.233 2.732 . 0 0 "[ . 1 . 2]" 1
1556 1 116 ASN HA 1 117 GLY HA2 . . 4.650 4.598 4.509 4.712 0.062 8 0 "[ . 1 . 2]" 1
1557 1 116 ASN HA 1 129 PRO QG . . 4.630 3.991 3.485 4.316 . 0 0 "[ . 1 . 2]" 1
1558 1 116 ASN HA 1 130 ILE MD . . 4.490 4.399 3.868 4.594 0.104 9 0 "[ . 1 . 2]" 1
1559 1 116 ASN HA 1 130 ILE HG12 . . 4.150 3.119 2.288 3.842 . 0 0 "[ . 1 . 2]" 1
1560 1 116 ASN HA 1 130 ILE MG . . 3.820 3.434 2.811 3.898 0.078 20 0 "[ . 1 . 2]" 1
1561 1 116 ASN QB 1 117 GLY H . . 3.720 3.168 2.120 3.818 0.098 4 0 "[ . 1 . 2]" 1
1562 1 116 ASN QB 1 117 GLY HA2 . . 5.130 4.321 3.588 4.726 . 0 0 "[ . 1 . 2]" 1
1563 1 116 ASN QB 1 130 ILE MD . . 5.110 4.223 2.819 5.033 . 0 0 "[ . 1 . 2]" 1
1564 1 116 ASN QB 1 130 ILE MG . . 3.930 3.723 2.507 4.050 0.120 8 0 "[ . 1 . 2]" 1
1565 1 116 ASN HD21 1 128 VAL QG . . 4.440 3.751 3.104 4.349 . 0 0 "[ . 1 . 2]" 1
1566 1 116 ASN HD22 1 128 VAL QG . . 5.050 3.859 2.481 4.881 . 0 0 "[ . 1 . 2]" 1
1567 1 117 GLY H 1 118 GLN H . . 4.410 4.382 4.294 4.494 0.084 4 0 "[ . 1 . 2]" 1
1568 1 117 GLY H 1 129 PRO HB3 . . 5.360 5.373 4.889 5.982 0.622 13 2 "[ . - 1 + . 2]" 1
1569 1 117 GLY H 1 129 PRO HD3 . . 4.970 4.639 4.099 5.022 0.052 13 0 "[ . 1 . 2]" 1
1570 1 117 GLY H 1 129 PRO QG . . 4.400 2.541 2.068 3.008 . 0 0 "[ . 1 . 2]" 1
1571 1 117 GLY HA2 1 118 GLN H . . 3.130 2.606 2.406 2.754 . 0 0 "[ . 1 . 2]" 1
1572 1 117 GLY HA2 1 129 PRO QG . . 3.860 3.741 3.547 3.938 0.078 11 0 "[ . 1 . 2]" 1
1573 1 117 GLY HA3 1 118 GLN H . . 3.160 2.597 2.481 2.691 . 0 0 "[ . 1 . 2]" 1
1574 1 117 GLY HA3 1 128 VAL QG . . 5.470 5.163 4.798 5.391 . 0 0 "[ . 1 . 2]" 1
1575 1 117 GLY HA3 1 129 PRO QG . . 4.040 2.293 2.115 2.606 . 0 0 "[ . 1 . 2]" 1
1576 1 118 GLN H 1 118 GLN HB2 . . 3.200 2.058 2.005 2.132 . 0 0 "[ . 1 . 2]" 1
1577 1 118 GLN H 1 118 GLN HB3 . . 3.250 3.324 3.294 3.335 0.085 8 0 "[ . 1 . 2]" 1
1578 1 118 GLN H 1 118 GLN QG . . 3.840 3.275 2.838 3.899 0.059 9 0 "[ . 1 . 2]" 1
1579 1 118 GLN H 1 119 PRO HD3 . . 5.160 4.961 4.732 5.115 . 0 0 "[ . 1 . 2]" 1
1580 1 118 GLN H 1 129 PRO QG . . 4.680 3.855 3.542 4.224 . 0 0 "[ . 1 . 2]" 1
1581 1 118 GLN HA 1 118 GLN HE21 . . 5.500 4.115 2.317 5.012 . 0 0 "[ . 1 . 2]" 1
1582 1 118 GLN HA 1 118 GLN QG . . 3.480 2.244 2.026 2.409 . 0 0 "[ . 1 . 2]" 1
1583 1 118 GLN HA 1 119 PRO HD2 . . 3.010 2.555 2.356 2.876 . 0 0 "[ . 1 . 2]" 1
1584 1 118 GLN HA 1 119 PRO HD3 . . 2.940 2.258 2.034 2.372 . 0 0 "[ . 1 . 2]" 1
1585 1 118 GLN HB2 1 119 PRO HD3 . . 4.830 4.870 4.635 5.054 0.224 7 0 "[ . 1 . 2]" 1
1586 1 118 GLN HB3 1 119 PRO HD2 . . 4.100 2.780 2.477 3.162 . 0 0 "[ . 1 . 2]" 1
1587 1 118 GLN HB3 1 119 PRO HD3 . . 4.370 3.925 3.663 4.162 . 0 0 "[ . 1 . 2]" 1
1588 1 118 GLN HE21 1 119 PRO HD2 . . 5.500 4.171 2.843 5.483 . 0 0 "[ . 1 . 2]" 1
1589 1 118 GLN QG 1 119 PRO HD2 . . 3.630 2.714 2.210 3.753 0.123 12 0 "[ . 1 . 2]" 1
1590 1 118 GLN QG 1 119 PRO HD3 . . 4.320 3.463 3.158 3.721 . 0 0 "[ . 1 . 2]" 1
1591 1 119 PRO HA 1 120 THR H . . 3.070 2.352 2.193 2.548 . 0 0 "[ . 1 . 2]" 1
1592 1 119 PRO HA 1 128 VAL HA . . 3.840 2.074 1.956 2.254 . 0 0 "[ . 1 . 2]" 1
1593 1 119 PRO HA 1 128 VAL QG . . 3.620 2.768 2.450 3.047 . 0 0 "[ . 1 . 2]" 1
1594 1 119 PRO HA 1 129 PRO HD3 . . 4.210 2.615 2.198 3.279 . 0 0 "[ . 1 . 2]" 1
1595 1 119 PRO HB2 1 120 THR H . . 3.910 2.834 2.301 3.388 . 0 0 "[ . 1 . 2]" 1
1596 1 119 PRO HB3 1 120 THR H . . 3.810 3.468 2.725 3.792 . 0 0 "[ . 1 . 2]" 1
1597 1 119 PRO HB3 1 128 VAL H . . 4.100 3.980 3.418 4.176 0.076 12 0 "[ . 1 . 2]" 1
1598 1 119 PRO HB3 1 128 VAL HA . . 4.380 2.933 2.564 3.592 . 0 0 "[ . 1 . 2]" 1
1599 1 119 PRO HB3 1 128 VAL QG . . 3.760 2.120 2.008 2.463 . 0 0 "[ . 1 . 2]" 1
1600 1 119 PRO HB3 1 129 PRO HD3 . . 5.500 4.614 4.185 5.369 . 0 0 "[ . 1 . 2]" 1
1601 1 119 PRO HG2 1 120 THR H . . 5.150 4.662 4.038 5.202 0.052 17 0 "[ . 1 . 2]" 1
1602 1 119 PRO HG2 1 128 VAL QG . . 4.180 3.973 3.390 4.200 0.020 3 0 "[ . 1 . 2]" 1
1603 1 119 PRO HG3 1 128 VAL HA . . 5.070 4.866 3.755 5.147 0.077 18 0 "[ . 1 . 2]" 1
1604 1 119 PRO HG3 1 128 VAL QG . . 4.370 2.929 2.070 3.237 . 0 0 "[ . 1 . 2]" 1
1605 1 120 THR H 1 120 THR HB . . 4.070 2.865 2.502 3.664 . 0 0 "[ . 1 . 2]" 1
1606 1 120 THR H 1 120 THR MG . . 4.240 2.617 1.881 3.986 . 0 0 "[ . 1 . 2]" 1
1607 1 120 THR H 1 127 THR HB . . 4.240 4.059 3.296 4.330 0.090 17 0 "[ . 1 . 2]" 1
1608 1 120 THR H 1 128 VAL HA . . 4.750 3.702 3.348 4.257 . 0 0 "[ . 1 . 2]" 1
1609 1 120 THR H 1 128 VAL QG . . 4.730 4.380 4.143 4.671 . 0 0 "[ . 1 . 2]" 1
1610 1 120 THR H 1 129 PRO HD3 . . 5.080 3.803 3.184 4.599 . 0 0 "[ . 1 . 2]" 1
1611 1 120 THR HA 1 120 THR MG . . 3.120 2.889 2.278 3.225 0.105 11 0 "[ . 1 . 2]" 1
1612 1 120 THR HA 1 121 THR H . . 3.010 2.775 2.194 3.096 0.086 18 0 "[ . 1 . 2]" 1
1613 1 120 THR MG 1 121 THR H . . 3.390 3.208 2.303 3.528 0.138 17 0 "[ . 1 . 2]" 1
1614 1 120 THR MG 1 127 THR HB . . 5.140 3.701 2.027 5.215 0.075 15 0 "[ . 1 . 2]" 1
1615 1 121 THR H 1 121 THR MG . . 4.760 3.638 2.265 4.167 . 0 0 "[ . 1 . 2]" 1
1616 1 121 THR HA 1 121 THR MG . . 3.030 2.440 2.160 3.157 0.127 14 0 "[ . 1 . 2]" 1
1617 1 121 THR HA 1 122 GLY H . . 2.950 2.454 2.094 2.875 . 0 0 "[ . 1 . 2]" 1
1618 1 121 THR HA 1 126 HIS HA . . 3.420 2.259 1.972 2.976 . 0 0 "[ . 1 . 2]" 1
1619 1 121 THR HA 1 126 HIS HB2 . . 4.770 4.147 2.241 4.861 0.091 6 0 "[ . 1 . 2]" 1
1620 1 121 THR HA 1 126 HIS HB3 . . 4.240 3.440 2.867 4.342 0.102 19 0 "[ . 1 . 2]" 1
1621 1 121 THR MG 1 122 GLY H . . 3.510 2.331 1.669 3.614 0.104 19 0 "[ . 1 . 2]" 1
1622 1 121 THR MG 1 122 GLY HA2 . . 4.720 4.106 3.866 4.449 . 0 0 "[ . 1 . 2]" 1
1623 1 121 THR MG 1 122 GLY HA3 . . 5.220 4.304 3.926 5.073 . 0 0 "[ . 1 . 2]" 1
1624 1 121 THR MG 1 123 ASP H . . 5.420 5.145 4.229 5.513 0.093 3 0 "[ . 1 . 2]" 1
1625 1 121 THR MG 1 125 ASP H . . 5.360 4.236 3.443 5.443 0.083 19 0 "[ . 1 . 2]" 1
1626 1 121 THR MG 1 126 HIS HA . . 4.310 3.551 2.578 4.378 0.068 16 0 "[ . 1 . 2]" 1
1627 1 121 THR MG 1 126 HIS HB2 . . 4.940 4.449 2.686 5.051 0.111 3 0 "[ . 1 . 2]" 1
1628 1 121 THR MG 1 126 HIS HB3 . . 4.460 3.954 2.580 4.544 0.084 12 0 "[ . 1 . 2]" 1
1629 1 121 THR MG 1 126 HIS HD2 . . 5.440 4.740 3.631 5.545 0.105 19 0 "[ . 1 . 2]" 1
1630 1 122 GLY H 1 123 ASP H . . 4.220 3.978 2.346 4.266 0.046 16 0 "[ . 1 . 2]" 1
1631 1 122 GLY H 1 125 ASP H . . 4.250 3.339 2.687 3.917 . 0 0 "[ . 1 . 2]" 1
1632 1 122 GLY H 1 125 ASP HB2 . . 5.440 5.000 4.215 5.518 0.078 7 0 "[ . 1 . 2]" 1
1633 1 122 GLY H 1 126 HIS HA . . 4.010 3.330 2.278 4.080 0.070 11 0 "[ . 1 . 2]" 1
1634 1 122 GLY HA2 1 123 ASP H . . 3.510 2.825 2.512 3.459 . 0 0 "[ . 1 . 2]" 1
1635 1 122 GLY HA2 1 123 ASP HB2 . . 4.720 4.657 4.098 4.990 0.270 5 0 "[ . 1 . 2]" 1
1636 1 122 GLY HA2 1 123 ASP HB3 . . 4.960 5.310 4.797 5.647 0.687 4 6 "[ -+.* 1 ** * 2]" 1
1637 1 122 GLY HA3 1 123 ASP H . . 3.060 2.341 2.122 2.510 . 0 0 "[ . 1 . 2]" 1
1638 1 122 GLY HA3 1 123 ASP HA . . 4.600 4.574 4.269 4.696 0.096 7 0 "[ . 1 . 2]" 1
1639 1 122 GLY HA3 1 123 ASP HB2 . . 5.130 4.520 3.271 4.796 . 0 0 "[ . 1 . 2]" 1
1640 1 122 GLY HA3 1 125 ASP H . . 4.580 3.464 3.018 4.616 0.036 14 0 "[ . 1 . 2]" 1
1641 1 123 ASP H 1 123 ASP HA . . 2.940 2.818 2.626 2.984 0.044 13 0 "[ . 1 . 2]" 1
1642 1 123 ASP H 1 123 ASP HB2 . . 3.160 2.385 2.090 3.180 0.020 19 0 "[ . 1 . 2]" 1
1643 1 123 ASP H 1 124 ALA H . . 3.600 2.737 1.923 3.190 . 0 0 "[ . 1 . 2]" 1
1644 1 123 ASP H 1 125 ASP H . . 4.410 3.533 2.793 4.118 . 0 0 "[ . 1 . 2]" 1
1645 1 123 ASP HA 1 123 ASP HB3 . . 2.960 3.023 2.987 3.049 0.089 14 0 "[ . 1 . 2]" 1
1646 1 123 ASP HB2 1 124 ALA H . . 3.660 3.647 3.314 3.974 0.314 19 0 "[ . 1 . 2]" 1
1647 1 123 ASP HB2 1 124 ALA MB . . 4.730 4.773 4.572 4.820 0.090 1 0 "[ . 1 . 2]" 1
1648 1 123 ASP HB3 1 124 ALA H . . 3.890 2.391 2.203 2.730 . 0 0 "[ . 1 . 2]" 1
1649 1 123 ASP HB3 1 124 ALA MB . . 4.490 3.449 3.319 3.616 . 0 0 "[ . 1 . 2]" 1
1650 1 124 ALA H 1 124 ALA MB . . 3.200 2.664 2.504 2.841 . 0 0 "[ . 1 . 2]" 1
1651 1 124 ALA H 1 125 ASP H . . 2.910 2.047 1.831 2.290 . 0 0 "[ . 1 . 2]" 1
1652 1 124 ALA H 1 125 ASP HB2 . . 5.060 4.463 3.159 5.149 0.089 19 0 "[ . 1 . 2]" 1
1653 1 124 ALA H 1 125 ASP HB3 . . 5.220 4.774 3.766 5.294 0.074 12 0 "[ . 1 . 2]" 1
1654 1 124 ALA MB 1 125 ASP H . . 3.680 3.633 3.334 3.777 0.097 5 0 "[ . 1 . 2]" 1
1655 1 124 ALA MB 1 125 ASP HA . . 5.420 4.378 4.259 4.488 . 0 0 "[ . 1 . 2]" 1
1656 1 125 ASP H 1 125 ASP HB2 . . 3.570 3.315 2.640 3.671 0.101 5 0 "[ . 1 . 2]" 1
1657 1 125 ASP H 1 125 ASP HB3 . . 4.200 3.758 3.225 3.997 . 0 0 "[ . 1 . 2]" 1
1658 1 125 ASP H 1 126 HIS H . . 4.330 4.135 1.676 4.375 0.045 2 0 "[ . 1 . 2]" 1
1659 1 125 ASP HA 1 125 ASP HB3 . . 2.910 2.307 2.021 2.512 . 0 0 "[ . 1 . 2]" 1
1660 1 125 ASP HA 1 126 HIS H . . 3.220 2.377 2.065 3.142 . 0 0 "[ . 1 . 2]" 1
1661 1 125 ASP HA 1 126 HIS HB2 . . 4.980 5.037 4.314 5.644 0.664 16 4 "[ - . * 1 .+ *2]" 1
1662 1 125 ASP HB2 1 126 HIS H . . 3.530 3.065 2.300 3.613 0.083 12 0 "[ . 1 . 2]" 1
1663 1 125 ASP HB2 1 126 HIS HA . . 5.130 4.259 3.994 4.620 . 0 0 "[ . 1 . 2]" 1
1664 1 125 ASP HB3 1 126 HIS H . . 3.620 3.207 2.343 3.717 0.097 4 0 "[ . 1 . 2]" 1
1665 1 125 ASP HB3 1 126 HIS HA . . 5.500 5.152 4.114 5.559 0.059 15 0 "[ . 1 . 2]" 1
1666 1 126 HIS H 1 126 HIS HB2 . . 3.970 3.111 2.383 4.001 0.031 16 0 "[ . 1 . 2]" 1
1667 1 126 HIS H 1 126 HIS HB3 . . 4.050 3.642 2.922 4.132 0.082 4 0 "[ . 1 . 2]" 1
1668 1 126 HIS H 1 126 HIS HD2 . . 4.450 3.216 2.394 4.384 . 0 0 "[ . 1 . 2]" 1
1669 1 126 HIS H 1 127 THR H . . 4.680 4.436 4.296 4.616 . 0 0 "[ . 1 . 2]" 1
1670 1 126 HIS HA 1 127 THR H . . 3.030 2.324 2.136 2.649 . 0 0 "[ . 1 . 2]" 1
1671 1 126 HIS HB2 1 127 THR H . . 4.540 3.490 2.879 4.293 . 0 0 "[ . 1 . 2]" 1
1672 1 126 HIS HB3 1 127 THR H . . 4.590 3.000 2.115 4.262 . 0 0 "[ . 1 . 2]" 1
1673 1 127 THR H 1 127 THR HB . . 3.560 3.187 2.725 3.629 0.069 4 0 "[ . 1 . 2]" 1
1674 1 127 THR HA 1 127 THR MG . . 3.430 2.253 2.137 2.450 . 0 0 "[ . 1 . 2]" 1
1675 1 127 THR HA 1 128 VAL H . . 2.960 2.115 2.066 2.194 . 0 0 "[ . 1 . 2]" 1
1676 1 127 THR HA 1 128 VAL HB . . 5.500 5.585 5.571 5.594 0.094 17 0 "[ . 1 . 2]" 1
1677 1 127 THR HB 1 128 VAL H . . 4.990 3.908 3.164 4.425 . 0 0 "[ . 1 . 2]" 1
1678 1 127 THR MG 1 128 VAL H . . 3.560 3.183 2.689 3.650 0.090 18 0 "[ . 1 . 2]" 1
1679 1 128 VAL H 1 128 VAL HB . . 3.600 3.532 3.451 3.628 0.028 20 0 "[ . 1 . 2]" 1
1680 1 128 VAL H 1 128 VAL QG . . 3.520 1.954 1.813 2.193 . 0 0 "[ . 1 . 2]" 1
1681 1 128 VAL H 1 129 PRO HD2 . . 5.310 4.920 4.846 5.004 . 0 0 "[ . 1 . 2]" 1
1682 1 128 VAL HA 1 128 VAL QG . . 3.240 2.183 2.112 2.247 . 0 0 "[ . 1 . 2]" 1
1683 1 128 VAL HA 1 129 PRO HD2 . . 3.720 2.272 2.190 2.430 . 0 0 "[ . 1 . 2]" 1
1684 1 128 VAL HA 1 129 PRO HD3 . . 3.320 2.244 2.105 2.379 . 0 0 "[ . 1 . 2]" 1
1685 1 128 VAL HA 1 129 PRO QG . . 3.830 3.924 3.910 3.930 0.100 18 0 "[ . 1 . 2]" 1
1686 1 128 VAL QG 1 129 PRO HD2 . . 4.090 2.828 2.494 3.198 . 0 0 "[ . 1 . 2]" 1
1687 1 128 VAL QG 1 129 PRO HD3 . . 3.890 3.611 3.308 3.799 . 0 0 "[ . 1 . 2]" 1
1688 1 128 VAL QG 1 129 PRO QG . . 5.130 4.184 3.943 4.429 . 0 0 "[ . 1 . 2]" 1
1689 1 129 PRO HA 1 130 ILE H . . 2.940 2.251 2.175 2.320 . 0 0 "[ . 1 . 2]" 1
1690 1 129 PRO HB2 1 130 ILE H . . 4.340 3.751 3.384 4.176 . 0 0 "[ . 1 . 2]" 1
1691 1 129 PRO HB3 1 130 ILE H . . 4.470 4.236 4.043 4.470 . 0 0 "[ . 1 . 2]" 1
1692 1 130 ILE H 1 130 ILE HB . . 3.480 2.942 2.638 3.273 . 0 0 "[ . 1 . 2]" 1
1693 1 130 ILE H 1 130 ILE MD . . 5.170 4.326 4.079 4.462 . 0 0 "[ . 1 . 2]" 1
1694 1 130 ILE H 1 130 ILE HG12 . . 4.200 3.809 3.362 4.258 0.058 1 0 "[ . 1 . 2]" 1
1695 1 130 ILE H 1 130 ILE HG13 . . 4.050 2.964 2.561 3.305 . 0 0 "[ . 1 . 2]" 1
1696 1 130 ILE H 1 130 ILE MG . . 4.680 3.974 3.816 4.040 . 0 0 "[ . 1 . 2]" 1
1697 1 130 ILE HA 1 130 ILE MD . . 4.320 3.911 3.836 4.009 . 0 0 "[ . 1 . 2]" 1
1698 1 130 ILE HA 1 130 ILE HG12 . . 3.760 2.702 2.502 3.024 . 0 0 "[ . 1 . 2]" 1
1699 1 130 ILE HA 1 130 ILE HG13 . . 3.850 3.337 2.953 3.671 . 0 0 "[ . 1 . 2]" 1
1700 1 130 ILE HA 1 130 ILE MG . . 3.380 2.337 2.185 2.463 . 0 0 "[ . 1 . 2]" 1
1701 1 130 ILE HA 1 131 SER H . . 3.040 2.195 2.100 2.260 . 0 0 "[ . 1 . 2]" 1
1702 1 130 ILE HB 1 130 ILE MD . . 3.630 2.533 2.377 2.687 . 0 0 "[ . 1 . 2]" 1
1703 1 130 ILE HB 1 131 SER H . . 4.210 4.004 3.643 4.290 0.080 20 0 "[ . 1 . 2]" 1
1704 1 130 ILE HG12 1 130 ILE MG . . 3.250 2.476 2.346 2.687 . 0 0 "[ . 1 . 2]" 1
1705 1 130 ILE HG13 1 131 SER H . . 5.170 5.231 5.037 5.257 0.087 9 0 "[ . 1 . 2]" 1
1706 1 130 ILE MG 1 131 SER H . . 3.600 2.576 2.240 2.963 . 0 0 "[ . 1 . 2]" 1
1707 1 130 ILE MG 1 131 SER HA . . 4.950 3.591 3.215 4.105 . 0 0 "[ . 1 . 2]" 1
1708 1 131 SER HA 1 132 LEU H . . 3.080 2.442 2.325 2.664 . 0 0 "[ . 1 . 2]" 1
1709 1 131 SER HA 1 132 LEU QD . . 4.620 3.311 2.442 4.141 . 0 0 "[ . 1 . 2]" 1
1710 1 131 SER HB2 1 132 LEU H . . 3.510 2.506 2.133 3.662 0.152 14 0 "[ . 1 . 2]" 1
1711 1 131 SER HB3 1 132 LEU H . . 3.580 3.481 2.551 3.663 0.083 1 0 "[ . 1 . 2]" 1
1712 1 132 LEU H 1 132 LEU QD . . 3.650 2.608 1.893 3.332 . 0 0 "[ . 1 . 2]" 1
1713 1 132 LEU H 1 132 LEU HG . . 4.070 3.369 2.424 4.165 0.095 1 0 "[ . 1 . 2]" 1
1714 1 132 LEU HA 1 132 LEU QD . . 4.280 3.360 3.209 3.506 . 0 0 "[ . 1 . 2]" 1
1715 1 132 LEU HA 1 133 GLY H . . 3.090 2.451 2.288 2.611 . 0 0 "[ . 1 . 2]" 1
1716 1 132 LEU HA 1 133 GLY HA2 . . 4.930 4.460 4.350 4.545 . 0 0 "[ . 1 . 2]" 1
1717 1 132 LEU HB2 1 133 GLY H . . 3.860 2.553 2.275 2.833 . 0 0 "[ . 1 . 2]" 1
1718 1 132 LEU HB2 1 134 TYR QD . . 5.170 5.008 3.318 5.267 0.097 12 0 "[ . 1 . 2]" 1
1719 1 132 LEU HB3 1 133 GLY H . . 4.050 3.717 3.483 3.814 . 0 0 "[ . 1 . 2]" 1
1720 1 132 LEU QD 1 133 GLY H . . 4.360 3.504 3.192 3.787 . 0 0 "[ . 1 . 2]" 1
1721 1 132 LEU QD 1 134 TYR H . . 5.400 3.618 2.925 4.786 . 0 0 "[ . 1 . 2]" 1
1722 1 132 LEU QD 1 134 TYR HA . . 4.480 4.266 3.807 4.520 0.040 7 0 "[ . 1 . 2]" 1
1723 1 132 LEU QD 1 134 TYR HB2 . . 4.510 4.294 3.553 4.633 0.123 13 0 "[ . 1 . 2]" 1
1724 1 132 LEU QD 1 134 TYR HB3 . . 4.580 3.120 2.516 4.598 0.018 1 0 "[ . 1 . 2]" 1
1725 1 132 LEU QD 1 134 TYR QD . . 4.080 2.604 2.085 3.049 . 0 0 "[ . 1 . 2]" 1
1726 1 132 LEU QD 1 134 TYR QE . . 4.680 3.866 2.221 4.520 . 0 0 "[ . 1 . 2]" 1
1727 1 133 GLY HA3 1 134 TYR H . . 3.300 3.249 2.744 3.391 0.091 11 0 "[ . 1 . 2]" 1
1728 1 134 TYR H 1 135 ASP H . . 5.120 4.536 4.259 4.750 . 0 0 "[ . 1 . 2]" 1
1729 1 134 TYR HA 1 135 ASP H . . 3.360 2.436 2.168 2.723 . 0 0 "[ . 1 . 2]" 1
1730 1 134 TYR HA 1 135 ASP HA . . 5.240 4.534 4.392 4.768 . 0 0 "[ . 1 . 2]" 1
1731 1 134 TYR HB2 1 135 ASP H . . 3.870 2.571 2.045 4.094 0.224 1 0 "[ . 1 . 2]" 1
1732 1 134 TYR HB3 1 135 ASP H . . 4.200 3.634 2.378 4.039 . 0 0 "[ . 1 . 2]" 1
1733 1 134 TYR QD 1 135 ASP H . . 5.240 3.260 2.398 3.927 . 0 0 "[ . 1 . 2]" 1
1734 1 135 ASP HA 1 136 VAL H . . 3.410 2.882 2.172 3.500 0.090 19 0 "[ . 1 . 2]" 1
1735 1 135 ASP HA 1 136 VAL HB . . 4.810 4.374 3.626 4.853 0.043 18 0 "[ . 1 . 2]" 1
1736 1 135 ASP HA 1 136 VAL QG . . 4.620 3.690 2.811 4.356 . 0 0 "[ . 1 . 2]" 1
1737 1 135 ASP HB2 1 136 VAL H . . 3.700 2.767 2.051 3.945 0.245 13 0 "[ . 1 . 2]" 1
1738 1 135 ASP HB2 1 136 VAL HB . . 5.300 4.928 3.330 6.244 0.944 13 3 "[ . * 1 + - 2]" 1
1739 1 135 ASP HB3 1 136 VAL H . . 3.950 3.679 2.009 4.004 0.054 14 0 "[ . 1 . 2]" 1
1740 1 136 VAL H 1 136 VAL HB . . 3.800 2.889 2.266 3.819 0.019 4 0 "[ . 1 . 2]" 1
1741 1 136 VAL H 1 136 VAL QG . . 3.760 2.788 2.351 3.427 . 0 0 "[ . 1 . 2]" 1
1742 1 136 VAL H 1 137 GLN H . . 4.500 4.398 4.081 4.586 0.086 15 0 "[ . 1 . 2]" 1
1743 1 136 VAL HA 1 137 GLN H . . 3.110 2.387 2.104 2.818 . 0 0 "[ . 1 . 2]" 1
1744 1 136 VAL HA 1 137 GLN QG . . 5.310 4.478 3.651 5.433 0.123 19 0 "[ . 1 . 2]" 1
1745 1 136 VAL HB 1 137 GLN H . . 4.140 3.902 3.020 4.215 0.075 17 0 "[ . 1 . 2]" 1
1746 1 136 VAL QG 1 137 GLN H . . 3.580 2.162 1.693 2.822 . 0 0 "[ . 1 . 2]" 1
1747 1 136 VAL QG 1 137 GLN QG . . 4.470 4.107 3.502 4.496 0.026 4 0 "[ . 1 . 2]" 1
1748 1 136 VAL QG 1 138 PHE QE . . 4.400 3.541 2.167 4.440 0.040 1 0 "[ . 1 . 2]" 1
1749 1 137 GLN H 1 137 GLN QB . . 3.840 2.905 2.219 3.352 . 0 0 "[ . 1 . 2]" 1
1750 1 137 GLN H 1 137 GLN QG . . 3.540 2.954 2.331 3.646 0.106 12 0 "[ . 1 . 2]" 1
1751 1 137 GLN HA 1 137 GLN QG . . 3.560 3.011 2.011 3.558 . 0 0 "[ . 1 . 2]" 1
1752 1 137 GLN HA 1 138 PHE H . . 3.110 2.418 2.030 2.764 . 0 0 "[ . 1 . 2]" 1
1753 1 137 GLN QB 1 137 GLN QG . . 2.450 2.065 1.997 2.119 . 0 0 "[ . 1 . 2]" 1
1754 1 137 GLN QB 1 138 PHE H . . 4.200 2.651 2.078 3.729 . 0 0 "[ . 1 . 2]" 1
1755 1 137 GLN QB 1 138 PHE QD . . 4.990 4.680 4.276 4.799 . 0 0 "[ . 1 . 2]" 1
1756 1 137 GLN QG 1 138 PHE H . . 3.980 3.201 2.085 3.909 . 0 0 "[ . 1 . 2]" 1
1757 1 137 GLN QG 1 138 PHE QB . . 5.200 4.772 4.035 5.090 . 0 0 "[ . 1 . 2]" 1
1758 1 137 GLN QG 1 139 TYR QD . . 4.330 3.181 2.071 4.428 0.098 13 0 "[ . 1 . 2]" 1
1759 1 137 GLN QG 1 139 TYR QE . . 4.270 4.001 2.558 4.363 0.093 6 0 "[ . 1 . 2]" 1
1760 1 138 PHE H 1 138 PHE QB . . 3.830 2.658 2.118 3.313 . 0 0 "[ . 1 . 2]" 1
1761 1 138 PHE H 1 138 PHE QD . . 3.940 3.040 2.321 4.036 0.096 16 0 "[ . 1 . 2]" 1
1762 1 138 PHE H 1 139 TYR H . . 4.310 3.447 1.951 4.368 0.058 18 0 "[ . 1 . 2]" 1
1763 1 138 PHE HA 1 138 PHE QD . . 3.620 3.002 2.057 3.716 0.096 12 0 "[ . 1 . 2]" 1
1764 1 138 PHE HA 1 139 TYR H . . 3.310 2.603 2.127 3.382 0.072 10 0 "[ . 1 . 2]" 1
1765 1 138 PHE QB 1 139 TYR H . . 4.110 3.245 2.407 3.822 . 0 0 "[ . 1 . 2]" 1
1766 1 138 PHE QD 1 139 TYR H . . 4.630 4.371 3.450 4.715 0.085 4 0 "[ . 1 . 2]" 1
1767 1 139 TYR H 1 139 TYR QB . . 3.610 2.771 2.127 3.307 . 0 0 "[ . 1 . 2]" 1
1768 1 139 TYR H 1 139 TYR QD . . 3.790 3.249 2.444 3.887 0.097 10 0 "[ . 1 . 2]" 1
1769 1 140 PRO HA 1 141 GLU H . . 2.750 2.340 2.090 2.712 . 0 0 "[ . 1 . 2]" 1
1770 1 141 GLU H 1 141 GLU QG . . 3.840 2.983 2.028 3.909 0.069 2 0 "[ . 1 . 2]" 1
1771 1 141 GLU HA 1 141 GLU QG . . 3.600 2.690 2.198 3.576 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Wednesday, June 12, 2024 9:00:16 AM GMT (wattos1)