NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397988 |
1t3v   |
6198 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1t3v
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 1915
_Distance_constraint_stats_list.Viol_count 5876
_Distance_constraint_stats_list.Viol_total 39814.906
_Distance_constraint_stats_list.Viol_max 3.495
_Distance_constraint_stats_list.Viol_rms 0.2016
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0430
_Distance_constraint_stats_list.Viol_average_violations_only 0.3080
_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 1 MET 7.854 0.533 19 3 "[ . 1 - . +* ]"
1 2 ILE 60.920 1.369 5 22 [****+**********-******]
1 3 ILE 20.230 0.699 1 5 "[+ . * - . ** ]"
1 4 ALA 57.742 1.447 12 22 [-**********+**********]
1 5 ILE 31.072 0.922 17 22 [***********-****+*****]
1 6 PRO 11.009 0.194 16 0 "[ . 1 . 2 ]"
1 7 VAL 23.258 0.648 17 22 [****************+***-*]
1 8 SER 41.517 1.126 12 19 "[* *********+ ***** *-*]"
1 9 GLU 4.473 0.321 4 0 "[ . 1 . 2 ]"
1 10 ASN 5.171 0.179 8 0 "[ . 1 . 2 ]"
1 11 ARG 9.594 0.693 4 1 "[ +. 1 . 2 ]"
1 12 GLY 0.555 0.107 20 0 "[ . 1 . 2 ]"
1 13 LYS 23.867 1.524 9 16 "[** ** *+******** -* ]"
1 14 ASP 18.084 0.741 15 4 "[ *.* 1 +* 2 ]"
1 15 SER 36.615 0.873 17 22 [****************+***-*]
1 16 PRO 5.160 0.356 19 0 "[ . 1 . 2 ]"
1 17 ILE 33.327 0.748 17 17 "[* **.***** ***-*+ ***]"
1 18 SER 25.883 1.142 12 12 "[ **** *1*+ *-* * 2 *]"
1 19 GLU 10.942 0.965 5 5 "[ * + 1 . -* *]"
1 20 HIS 21.101 1.187 2 17 "[*+* * *****-* **** * *]"
1 21 PHE 78.367 1.359 5 22 [**-*+*****************]
1 22 GLY 0.471 0.111 11 0 "[ . 1 . 2 ]"
1 23 ARG 20.799 1.187 2 15 "[*+*-* **** ** * ***]"
1 24 ALA 20.788 1.142 12 8 "[ ** *1*+ ** * 2 ]"
1 25 PRO 0.668 0.100 12 0 "[ . 1 . 2 ]"
1 26 TYR 26.155 1.041 12 10 "[* -** * +* ** * 2 ]"
1 27 PHE 18.512 0.512 20 1 "[ . 1 . + ]"
1 28 ALA 19.099 0.582 18 13 "[ *******-1 * .* + 2**]"
1 29 PHE 367.002 3.235 13 22 [********-***+*********]
1 30 VAL 111.602 3.495 10 22 [*********+***-********]
1 31 LYS 114.314 3.495 10 22 [*********+*****-******]
1 32 VAL 27.107 0.852 4 9 "[ * +* * 1** *.- * 2 ]"
1 33 LYS 24.154 1.372 8 17 "[****.**+ * ** ***-*2**]"
1 34 ASN 1.976 0.167 21 0 "[ . 1 . 2 ]"
1 35 ASN 36.778 1.686 15 22 [**************+**-****]
1 36 ALA 6.178 0.156 8 0 "[ . 1 . 2 ]"
1 37 ILE 14.440 0.852 4 9 "[ * +* * 1** *.- * 2 ]"
1 38 ALA 6.913 0.914 15 1 "[ . 1 + 2 ]"
1 39 ASP 12.751 0.804 19 3 "[ -.* 1 . +2 ]"
1 40 ILE 10.107 1.144 1 6 "[+ .* * *. -* ]"
1 41 SER 72.329 1.883 16 22 [**************-+******]
1 42 VAL 12.109 0.722 11 8 "[* . *+ **-* 2* ]"
1 43 GLU 2.418 0.138 19 0 "[ . 1 . 2 ]"
1 44 GLU 15.916 0.729 13 3 "[ . -1 + .* 2 ]"
1 45 ASN 14.423 0.677 13 9 "[ * ** -1 + .** 2**]"
1 46 PRO 28.975 0.797 6 14 "[* * *+* **** .*- *2**]"
1 47 LEU 35.466 2.409 5 22 [****+***********-*****]
1 48 ALA 7.422 0.563 1 2 "[+ . - . 2 ]"
1 49 GLN 5.731 0.380 16 0 "[ . 1 . 2 ]"
1 50 ASP 2.774 0.674 21 1 "[ . 1 . 2+ ]"
1 51 HIS 2.279 0.239 19 0 "[ . 1 . 2 ]"
1 52 VAL 0.262 0.152 13 0 "[ . 1 . 2 ]"
1 55 ALA 12.968 2.409 5 10 "[* *+* * * .-** * ]"
1 56 VAL 83.469 1.359 5 22 [***-+*****************]
1 57 PRO 12.555 0.751 15 10 "[**- ** ** * + 2 *]"
1 58 ASN 3.298 0.169 8 0 "[ . 1 . 2 ]"
1 59 PHE 62.154 1.624 2 22 [*+***-****************]
1 60 VAL 56.845 1.387 2 22 [*+*-******************]
1 61 LYS 73.279 2.786 18 22 [*******-*********+****]
1 62 GLU 13.169 0.539 13 2 "[ . 1- + . 2 ]"
1 63 LYS 25.102 0.816 13 3 "[ * 1- + . 2 ]"
1 64 GLY 10.822 0.433 15 0 "[ . 1 . 2 ]"
1 65 ALA 15.494 0.486 16 0 "[ . 1 . 2 ]"
1 66 GLU 8.641 0.360 2 0 "[ . 1 . 2 ]"
1 67 LEU 25.128 0.968 19 22 [*************-****+***]
1 68 VAL 124.113 3.116 6 22 [*****+**-*************]
1 69 ILE 61.403 1.447 12 22 [-**********+**********]
1 70 VAL 21.718 0.859 16 8 "[ -*. * 1 .+* ***]"
1 71 ARG 21.228 0.991 11 14 "[* * * **+* ****-* *]"
1 72 GLY 4.150 0.277 14 0 "[ . 1 . 2 ]"
1 73 ILE 45.196 1.645 7 22 [******+**********-****]
1 74 GLY 4.582 0.576 7 2 "[ - . + 1 . 2 ]"
1 75 ARG 49.189 2.698 17 22 [****-***********+*****]
1 76 ARG 50.562 2.698 17 22 [**-*************+*****]
1 77 ALA 21.341 1.645 7 14 "[ ***.*+* 1 **** - ***]"
1 78 ILE 92.562 1.644 11 22 [**********+******-****]
1 79 ALA 4.332 0.164 18 0 "[ . 1 . 2 ]"
1 80 ALA 138.209 3.235 13 22 [****-*******+*********]
1 81 PHE 18.032 1.120 16 16 "[* *-******** *+ *** ]"
1 82 GLU 22.421 0.699 19 9 "[** *.* -* *. *+2 ]"
1 83 ALA 31.777 0.974 6 20 "[*****+**-** **.*******]"
1 84 MET 67.165 2.786 18 20 "[* **-************+** *]"
1 85 GLY 28.003 1.556 10 22 [*********+******-*****]
1 86 VAL 91.254 2.024 13 22 [************+***-*****]
1 87 LYS 17.509 0.415 12 0 "[ . 1 . 2 ]"
1 88 VAL 18.609 1.209 10 7 "[* . + * ** -*2 ]"
1 89 ILE 15.603 0.559 18 2 "[ . 1 . +-2 ]"
1 90 LYS 17.022 0.732 15 4 "[ . 1 + *-* ]"
1 91 GLY 3.887 0.769 17 1 "[ . 1 . + 2 ]"
1 92 ALA 15.693 0.759 15 5 "[ . 1* +*- * ]"
1 93 SER 17.107 0.748 17 17 "[* **.***** ***-*+ ***]"
1 94 GLY 3.227 0.149 16 0 "[ . 1 . 2 ]"
1 95 THR 37.645 1.401 19 22 [*****************-+***]
1 96 VAL 61.952 0.922 17 22 [***********-****+*****]
1 97 GLU 16.460 1.524 9 12 "[ * *- *+1*** *** * ]"
1 98 GLU 15.726 0.575 5 6 "[ * + ** 1 - . * 2 ]"
1 99 VAL 66.094 1.401 19 22 [****************-*+***]
1 100 VAL 17.135 0.835 18 4 "[ -*. 1 . + 2 *]"
1 101 ASN 12.647 0.599 6 9 "[ -**+ *1 . ****]"
1 102 GLN 23.562 0.599 6 13 "[ -**+ **1 * . ******]"
1 103 TYR 33.804 0.870 12 13 "[ * ****- 1 +*** *** ]"
1 104 LEU 42.436 1.686 15 20 "[*******-******+ * ****]"
1 105 SER 12.328 0.406 12 0 "[ . 1 . 2 ]"
1 106 GLY 10.066 0.537 2 1 "[ + . 1 . 2 ]"
1 107 GLN 16.291 0.537 2 1 "[ + . 1 . 2 ]"
1 108 LEU 45.977 1.622 12 18 "[******** **+* * *-** *]"
1 109 LYS 38.223 1.622 12 15 "[***-.** ***+* * ** 2 *]"
1 110 ASP 6.370 0.467 13 0 "[ . 1 . 2 ]"
1 111 SER 4.785 0.246 2 0 "[ . 1 . 2 ]"
1 112 ASP 11.085 0.353 19 0 "[ . 1 . 2 ]"
1 113 TYR 20.506 1.644 11 11 "[* . * **+* *- *** ]"
1 114 GLU 9.325 0.809 2 3 "[ + . 1 . -2* ]"
1 115 VAL 3.939 0.809 2 3 "[ + . 1 . -2* ]"
1 116 HIS 0.000 0.000 . 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 1 MET HA 1 1 MET HG3 . . 3.850 3.150 2.144 4.070 0.220 6 0 "[ . 1 . 2 ]" 1
2 1 1 MET HA 1 2 ILE H . . 2.840 2.266 2.094 2.465 . 0 0 "[ . 1 . 2 ]" 1
3 1 1 MET HA 1 2 ILE HB . . 4.830 4.760 4.613 4.940 0.110 6 0 "[ . 1 . 2 ]" 1
4 1 1 MET HA 1 2 ILE QG . . 4.910 3.443 3.050 3.697 . 0 0 "[ . 1 . 2 ]" 1
5 1 1 MET HB2 1 32 VAL QG . . 3.850 3.767 3.203 4.174 0.324 13 0 "[ . 1 . 2 ]" 1
6 1 1 MET HB3 1 2 ILE H . . 4.530 4.123 3.854 4.289 . 0 0 "[ . 1 . 2 ]" 1
7 1 1 MET HB3 1 32 VAL QG . . 4.000 2.931 1.957 4.033 0.033 6 0 "[ . 1 . 2 ]" 1
8 1 1 MET HG2 1 2 ILE H . . 4.110 3.797 2.840 4.252 0.142 9 0 "[ . 1 . 2 ]" 1
9 1 1 MET HG2 1 3 ILE MD . . 5.180 3.089 2.368 3.861 . 0 0 "[ . 1 . 2 ]" 1
10 1 1 MET HG2 1 3 ILE HG12 . . 4.400 4.198 3.248 4.933 0.533 19 3 "[ . 1 - . +* ]" 1
11 1 1 MET HG2 1 32 VAL QG . . 4.750 2.200 1.934 3.014 . 0 0 "[ . 1 . 2 ]" 1
12 1 1 MET HG3 1 2 ILE H . . 4.090 3.004 2.212 4.164 0.074 21 0 "[ . 1 . 2 ]" 1
13 1 1 MET HG3 1 3 ILE H . . 5.500 5.067 4.450 5.571 0.071 8 0 "[ . 1 . 2 ]" 1
14 1 1 MET HG3 1 3 ILE MD . . 4.260 3.459 2.448 4.379 0.119 16 0 "[ . 1 . 2 ]" 1
15 1 1 MET HG3 1 3 ILE HG12 . . 4.800 3.863 2.819 4.916 0.116 5 0 "[ . 1 . 2 ]" 1
16 1 1 MET HG3 1 32 VAL QG . . 4.170 3.175 2.324 4.116 . 0 0 "[ . 1 . 2 ]" 1
17 1 2 ILE H 1 2 ILE HB . . 3.700 2.828 2.573 3.066 . 0 0 "[ . 1 . 2 ]" 1
18 1 2 ILE H 1 2 ILE QG . . 4.110 2.720 2.436 2.997 . 0 0 "[ . 1 . 2 ]" 1
19 1 2 ILE H 1 66 GLU H . . 4.580 2.896 2.599 3.217 . 0 0 "[ . 1 . 2 ]" 1
20 1 2 ILE H 1 66 GLU QB . . 4.680 2.081 1.795 2.835 . 0 0 "[ . 1 . 2 ]" 1
21 1 2 ILE H 1 66 GLU QG . . 4.470 3.997 3.708 4.403 . 0 0 "[ . 1 . 2 ]" 1
22 1 2 ILE H 1 67 LEU H . . 4.600 3.240 3.014 3.610 . 0 0 "[ . 1 . 2 ]" 1
23 1 2 ILE HA 1 2 ILE MD . . 3.640 3.910 3.827 3.946 0.306 5 0 "[ . 1 . 2 ]" 1
24 1 2 ILE HA 1 2 ILE QG . . 3.490 2.615 2.525 2.770 . 0 0 "[ . 1 . 2 ]" 1
25 1 2 ILE HA 1 2 ILE MG . . 3.100 2.390 2.329 2.454 . 0 0 "[ . 1 . 2 ]" 1
26 1 2 ILE HA 1 3 ILE H . . 2.980 2.283 2.125 2.377 . 0 0 "[ . 1 . 2 ]" 1
27 1 2 ILE HA 1 3 ILE HB . . 4.770 4.186 3.899 4.456 . 0 0 "[ . 1 . 2 ]" 1
28 1 2 ILE HA 1 31 LYS H . . 5.500 4.758 4.600 4.882 . 0 0 "[ . 1 . 2 ]" 1
29 1 2 ILE HA 1 31 LYS HA . . 2.820 2.117 2.008 2.292 . 0 0 "[ . 1 . 2 ]" 1
30 1 2 ILE HA 1 31 LYS HG2 . . 4.780 3.337 2.790 3.806 . 0 0 "[ . 1 . 2 ]" 1
31 1 2 ILE HA 1 32 VAL H . . 4.250 4.124 3.753 4.337 0.087 16 0 "[ . 1 . 2 ]" 1
32 1 2 ILE HA 1 32 VAL QG . . 3.800 3.873 3.343 4.415 0.615 2 1 "[ + . 1 . 2 ]" 1
33 1 2 ILE HB 1 2 ILE MD . . 3.570 2.503 2.407 2.600 . 0 0 "[ . 1 . 2 ]" 1
34 1 2 ILE HB 1 3 ILE H . . 5.290 3.757 3.576 3.932 . 0 0 "[ . 1 . 2 ]" 1
35 1 2 ILE HB 1 29 PHE QD . . 4.700 3.485 3.098 3.752 . 0 0 "[ . 1 . 2 ]" 1
36 1 2 ILE HB 1 65 ALA H . . 4.880 4.549 4.155 4.779 . 0 0 "[ . 1 . 2 ]" 1
37 1 2 ILE HB 1 65 ALA HA . . 2.470 2.031 1.943 2.140 . 0 0 "[ . 1 . 2 ]" 1
38 1 2 ILE HB 1 65 ALA MB . . 4.250 3.020 2.345 3.537 . 0 0 "[ . 1 . 2 ]" 1
39 1 2 ILE HB 1 66 GLU H . . 3.980 3.123 2.912 3.331 . 0 0 "[ . 1 . 2 ]" 1
40 1 2 ILE HB 1 66 GLU QG . . 5.180 5.226 4.763 5.540 0.360 2 0 "[ . 1 . 2 ]" 1
41 1 2 ILE HB 1 67 LEU H . . 5.500 4.154 3.940 4.430 . 0 0 "[ . 1 . 2 ]" 1
42 1 2 ILE MD 1 31 LYS HA . . 3.620 4.471 3.844 4.989 1.369 5 20 "[** *+**********-***** ]" 1
43 1 2 ILE MD 1 31 LYS QE . . 3.740 2.259 1.923 2.821 . 0 0 "[ . 1 . 2 ]" 1
44 1 2 ILE MD 1 31 LYS HG2 . . 4.390 3.198 2.590 3.476 . 0 0 "[ . 1 . 2 ]" 1
45 1 2 ILE MD 1 64 GLY H . . 5.500 4.579 4.233 4.909 . 0 0 "[ . 1 . 2 ]" 1
46 1 2 ILE MD 1 64 GLY HA2 . . 4.290 4.215 3.788 4.723 0.433 15 0 "[ . 1 . 2 ]" 1
47 1 2 ILE MD 1 65 ALA H . . 4.800 3.834 3.438 4.240 . 0 0 "[ . 1 . 2 ]" 1
48 1 2 ILE MD 1 66 GLU QB . . 5.290 5.031 4.784 5.242 . 0 0 "[ . 1 . 2 ]" 1
49 1 2 ILE QG 1 3 ILE H . . 4.670 4.373 4.265 4.526 . 0 0 "[ . 1 . 2 ]" 1
50 1 2 ILE QG 1 31 LYS HA . . 3.790 3.206 2.621 3.812 0.022 7 0 "[ . 1 . 2 ]" 1
51 1 2 ILE QG 1 66 GLU H . . 5.500 4.215 3.757 4.511 . 0 0 "[ . 1 . 2 ]" 1
52 1 2 ILE QG 1 66 GLU QB . . 4.980 3.875 3.552 4.380 . 0 0 "[ . 1 . 2 ]" 1
53 1 2 ILE MG 1 3 ILE H . . 3.450 2.231 2.093 2.420 . 0 0 "[ . 1 . 2 ]" 1
54 1 2 ILE MG 1 29 PHE HB2 . . 4.720 3.573 3.434 3.738 . 0 0 "[ . 1 . 2 ]" 1
55 1 2 ILE MG 1 29 PHE HB3 . . 3.790 2.204 2.055 2.362 . 0 0 "[ . 1 . 2 ]" 1
56 1 2 ILE MG 1 29 PHE QD . . 3.080 2.072 2.003 2.174 . 0 0 "[ . 1 . 2 ]" 1
57 1 2 ILE MG 1 29 PHE HZ . . 5.140 4.957 4.718 5.245 0.105 3 0 "[ . 1 . 2 ]" 1
58 1 2 ILE MG 1 30 VAL H . . 3.960 3.495 2.523 3.824 . 0 0 "[ . 1 . 2 ]" 1
59 1 2 ILE MG 1 30 VAL HA . . 4.350 4.179 3.781 4.426 0.076 12 0 "[ . 1 . 2 ]" 1
60 1 2 ILE MG 1 65 ALA HA . . 3.000 3.424 3.230 3.486 0.486 16 0 "[ . 1 . 2 ]" 1
61 1 2 ILE MG 1 66 GLU H . . 4.880 4.469 4.271 4.615 . 0 0 "[ . 1 . 2 ]" 1
62 1 2 ILE MG 1 67 LEU H . . 4.180 4.950 4.791 5.148 0.968 19 22 [*************-****+***] 1
63 1 3 ILE H 1 3 ILE HB . . 3.600 2.428 2.211 2.640 . 0 0 "[ . 1 . 2 ]" 1
64 1 3 ILE H 1 3 ILE MD . . 4.050 3.360 2.734 3.687 . 0 0 "[ . 1 . 2 ]" 1
65 1 3 ILE H 1 3 ILE HG12 . . 4.090 4.251 4.099 4.395 0.305 7 0 "[ . 1 . 2 ]" 1
66 1 3 ILE H 1 3 ILE HG13 . . 4.810 2.995 2.812 3.275 . 0 0 "[ . 1 . 2 ]" 1
67 1 3 ILE H 1 3 ILE MG . . 4.540 3.744 3.600 3.832 . 0 0 "[ . 1 . 2 ]" 1
68 1 3 ILE H 1 4 ALA H . . 5.320 4.034 3.928 4.206 . 0 0 "[ . 1 . 2 ]" 1
69 1 3 ILE H 1 4 ALA HA . . 5.500 4.619 4.472 4.733 . 0 0 "[ . 1 . 2 ]" 1
70 1 3 ILE H 1 29 PHE HB3 . . 5.500 4.472 4.253 4.663 . 0 0 "[ . 1 . 2 ]" 1
71 1 3 ILE H 1 29 PHE QD . . 5.500 3.009 2.844 3.120 . 0 0 "[ . 1 . 2 ]" 1
72 1 3 ILE H 1 30 VAL H . . 4.080 3.083 2.436 3.396 . 0 0 "[ . 1 . 2 ]" 1
73 1 3 ILE H 1 30 VAL HA . . 5.500 4.648 4.561 4.753 . 0 0 "[ . 1 . 2 ]" 1
74 1 3 ILE H 1 30 VAL HB . . 4.110 3.754 3.523 4.062 . 0 0 "[ . 1 . 2 ]" 1
75 1 3 ILE H 1 31 LYS HA . . 4.310 3.417 3.139 3.602 . 0 0 "[ . 1 . 2 ]" 1
76 1 3 ILE H 1 65 ALA HA . . 5.500 5.532 5.014 5.844 0.344 13 0 "[ . 1 . 2 ]" 1
77 1 3 ILE H 1 66 GLU H . . 5.500 5.260 5.035 5.486 . 0 0 "[ . 1 . 2 ]" 1
78 1 3 ILE H 1 67 LEU H . . 5.500 4.884 4.782 4.999 . 0 0 "[ . 1 . 2 ]" 1
79 1 3 ILE HA 1 3 ILE MD . . 4.530 3.878 3.760 3.940 . 0 0 "[ . 1 . 2 ]" 1
80 1 3 ILE HA 1 3 ILE HG12 . . 3.800 2.923 2.642 3.416 . 0 0 "[ . 1 . 2 ]" 1
81 1 3 ILE HA 1 3 ILE HG13 . . 3.450 2.642 2.525 2.769 . 0 0 "[ . 1 . 2 ]" 1
82 1 3 ILE HA 1 3 ILE MG . . 3.200 2.445 2.316 2.661 . 0 0 "[ . 1 . 2 ]" 1
83 1 3 ILE HA 1 4 ALA H . . 3.020 2.179 2.111 2.254 . 0 0 "[ . 1 . 2 ]" 1
84 1 3 ILE HA 1 4 ALA HA . . 4.710 4.501 4.455 4.527 . 0 0 "[ . 1 . 2 ]" 1
85 1 3 ILE HA 1 4 ALA MB . . 4.490 4.173 4.013 4.324 . 0 0 "[ . 1 . 2 ]" 1
86 1 3 ILE HA 1 30 VAL H . . 5.500 4.834 4.541 5.050 . 0 0 "[ . 1 . 2 ]" 1
87 1 3 ILE HA 1 66 GLU H . . 5.440 4.497 4.057 4.788 . 0 0 "[ . 1 . 2 ]" 1
88 1 3 ILE HA 1 67 LEU QB . . 4.080 2.453 2.118 2.893 . 0 0 "[ . 1 . 2 ]" 1
89 1 3 ILE HA 1 68 VAL HA . . 4.300 3.459 3.207 3.662 . 0 0 "[ . 1 . 2 ]" 1
90 1 3 ILE HB 1 3 ILE MD . . 3.100 2.230 2.153 2.277 . 0 0 "[ . 1 . 2 ]" 1
91 1 3 ILE HB 1 4 ALA H . . 4.700 4.433 4.347 4.506 . 0 0 "[ . 1 . 2 ]" 1
92 1 3 ILE HB 1 30 VAL H . . 4.340 3.257 3.080 3.435 . 0 0 "[ . 1 . 2 ]" 1
93 1 3 ILE HB 1 30 VAL HB . . 3.400 2.510 2.134 2.754 . 0 0 "[ . 1 . 2 ]" 1
94 1 3 ILE MD 1 30 VAL H . . 4.980 4.668 4.053 4.892 . 0 0 "[ . 1 . 2 ]" 1
95 1 3 ILE MD 1 30 VAL HB . . 3.430 3.261 2.994 3.336 . 0 0 "[ . 1 . 2 ]" 1
96 1 3 ILE MD 1 67 LEU QD . . 3.850 3.288 2.840 3.701 . 0 0 "[ . 1 . 2 ]" 1
97 1 3 ILE MD 1 100 VAL HA . . 4.310 4.053 3.342 4.806 0.496 12 0 "[ . 1 . 2 ]" 1
98 1 3 ILE MD 1 103 TYR QD . . 3.670 3.209 2.455 3.878 0.208 10 0 "[ . 1 . 2 ]" 1
99 1 3 ILE MD 1 103 TYR QE . . 3.710 3.089 2.316 3.889 0.179 12 0 "[ . 1 . 2 ]" 1
100 1 3 ILE MD 1 104 LEU QD . . 3.050 2.883 2.293 3.749 0.699 1 2 "[+ . - . 2 ]" 1
101 1 3 ILE HG12 1 4 ALA H . . 5.340 4.964 4.676 5.488 0.148 7 0 "[ . 1 . 2 ]" 1
102 1 3 ILE HG12 1 67 LEU H . . 5.500 4.851 4.485 5.379 . 0 0 "[ . 1 . 2 ]" 1
103 1 3 ILE HG12 1 67 LEU QD . . 4.290 2.130 2.029 2.423 . 0 0 "[ . 1 . 2 ]" 1
104 1 3 ILE HG13 1 4 ALA H . . 4.680 4.785 4.755 4.806 0.126 20 0 "[ . 1 . 2 ]" 1
105 1 3 ILE HG13 1 67 LEU QB . . 3.990 2.639 2.347 3.125 . 0 0 "[ . 1 . 2 ]" 1
106 1 3 ILE HG13 1 67 LEU QD . . 4.750 3.320 2.971 3.601 . 0 0 "[ . 1 . 2 ]" 1
107 1 3 ILE MG 1 4 ALA H . . 3.140 3.254 3.148 3.277 0.137 12 0 "[ . 1 . 2 ]" 1
108 1 3 ILE MG 1 4 ALA HA . . 4.490 4.146 3.861 4.352 . 0 0 "[ . 1 . 2 ]" 1
109 1 3 ILE MG 1 67 LEU QD . . 3.990 2.334 2.006 3.125 . 0 0 "[ . 1 . 2 ]" 1
110 1 3 ILE MG 1 68 VAL HA . . 3.590 3.510 3.186 3.802 0.212 20 0 "[ . 1 . 2 ]" 1
111 1 3 ILE MG 1 69 ILE H . . 3.830 3.487 3.096 3.833 0.003 11 0 "[ . 1 . 2 ]" 1
112 1 3 ILE MG 1 69 ILE MD . . 3.490 2.057 1.841 2.582 . 0 0 "[ . 1 . 2 ]" 1
113 1 4 ALA H 1 4 ALA MB . . 3.310 2.277 2.115 2.430 . 0 0 "[ . 1 . 2 ]" 1
114 1 4 ALA H 1 29 PHE QD . . 5.290 3.118 2.958 3.242 . 0 0 "[ . 1 . 2 ]" 1
115 1 4 ALA H 1 30 VAL H . . 5.500 4.890 4.686 5.127 . 0 0 "[ . 1 . 2 ]" 1
116 1 4 ALA H 1 66 GLU H . . 5.500 4.917 4.792 5.216 . 0 0 "[ . 1 . 2 ]" 1
117 1 4 ALA H 1 67 LEU H . . 4.770 4.088 3.913 4.248 . 0 0 "[ . 1 . 2 ]" 1
118 1 4 ALA H 1 68 VAL HA . . 3.500 2.175 2.061 2.343 . 0 0 "[ . 1 . 2 ]" 1
119 1 4 ALA H 1 68 VAL HB . . 4.870 4.960 4.884 5.013 0.143 9 0 "[ . 1 . 2 ]" 1
120 1 4 ALA H 1 68 VAL QG . . 4.980 2.956 2.715 3.144 . 0 0 "[ . 1 . 2 ]" 1
121 1 4 ALA H 1 69 ILE H . . 4.490 3.854 3.687 4.040 . 0 0 "[ . 1 . 2 ]" 1
122 1 4 ALA H 1 69 ILE HA . . 5.300 6.413 6.188 6.655 1.355 19 22 [-*****************+***] 1
123 1 4 ALA H 1 69 ILE HB . . 4.540 5.635 5.283 5.987 1.447 12 22 [-**********+**********] 1
124 1 4 ALA HA 1 5 ILE H . . 3.020 2.207 2.133 2.295 . 0 0 "[ . 1 . 2 ]" 1
125 1 4 ALA HA 1 5 ILE HG13 . . 5.000 3.872 3.331 4.142 . 0 0 "[ . 1 . 2 ]" 1
126 1 4 ALA HA 1 28 ALA H . . 5.110 4.646 4.067 4.967 . 0 0 "[ . 1 . 2 ]" 1
127 1 4 ALA HA 1 29 PHE H . . 5.500 4.270 4.023 4.515 . 0 0 "[ . 1 . 2 ]" 1
128 1 4 ALA HA 1 29 PHE HA . . 3.550 2.128 1.993 2.230 . 0 0 "[ . 1 . 2 ]" 1
129 1 4 ALA HA 1 29 PHE QD . . 3.630 2.834 2.544 3.208 . 0 0 "[ . 1 . 2 ]" 1
130 1 4 ALA HA 1 30 VAL H . . 4.270 3.520 3.301 3.777 . 0 0 "[ . 1 . 2 ]" 1
131 1 4 ALA HA 1 30 VAL QG . . 5.170 4.431 4.060 4.909 . 0 0 "[ . 1 . 2 ]" 1
132 1 4 ALA MB 1 5 ILE H . . 3.530 2.882 2.635 3.173 . 0 0 "[ . 1 . 2 ]" 1
133 1 4 ALA MB 1 5 ILE HA . . 4.880 3.754 3.584 3.997 . 0 0 "[ . 1 . 2 ]" 1
134 1 4 ALA MB 1 27 PHE QD . . 4.480 3.779 3.132 4.346 . 0 0 "[ . 1 . 2 ]" 1
135 1 4 ALA MB 1 29 PHE HA . . 4.350 3.456 3.071 3.710 . 0 0 "[ . 1 . 2 ]" 1
136 1 4 ALA MB 1 29 PHE HB3 . . 5.380 4.779 4.428 5.036 . 0 0 "[ . 1 . 2 ]" 1
137 1 4 ALA MB 1 29 PHE QD . . 2.900 2.997 2.856 3.070 0.170 5 0 "[ . 1 . 2 ]" 1
138 1 4 ALA MB 1 68 VAL HA . . 3.310 2.749 2.395 3.180 . 0 0 "[ . 1 . 2 ]" 1
139 1 4 ALA MB 1 68 VAL QG . . 3.440 1.857 1.801 1.924 . 0 0 "[ . 1 . 2 ]" 1
140 1 5 ILE H 1 5 ILE HB . . 3.550 2.813 2.656 3.015 . 0 0 "[ . 1 . 2 ]" 1
141 1 5 ILE H 1 5 ILE MD . . 4.990 4.248 3.840 4.529 . 0 0 "[ . 1 . 2 ]" 1
142 1 5 ILE H 1 5 ILE HG12 . . 4.560 4.214 3.845 4.451 . 0 0 "[ . 1 . 2 ]" 1
143 1 5 ILE H 1 5 ILE HG13 . . 3.950 3.191 2.813 3.448 . 0 0 "[ . 1 . 2 ]" 1
144 1 5 ILE H 1 6 PRO HD3 . . 5.500 4.202 3.977 4.460 . 0 0 "[ . 1 . 2 ]" 1
145 1 5 ILE H 1 27 PHE HA . . 4.820 3.877 3.745 3.969 . 0 0 "[ . 1 . 2 ]" 1
146 1 5 ILE H 1 27 PHE QB . . 5.280 3.966 3.888 4.058 . 0 0 "[ . 1 . 2 ]" 1
147 1 5 ILE H 1 27 PHE QD . . 4.840 4.331 3.911 4.905 0.065 21 0 "[ . 1 . 2 ]" 1
148 1 5 ILE H 1 28 ALA H . . 3.940 2.961 2.440 3.184 . 0 0 "[ . 1 . 2 ]" 1
149 1 5 ILE H 1 28 ALA MB . . 3.970 3.264 2.982 3.620 . 0 0 "[ . 1 . 2 ]" 1
150 1 5 ILE H 1 29 PHE HA . . 4.370 3.608 3.461 3.786 . 0 0 "[ . 1 . 2 ]" 1
151 1 5 ILE H 1 29 PHE HB2 . . 5.220 5.581 5.346 5.771 0.551 19 3 "[ . 1 - . +* ]" 1
152 1 5 ILE H 1 29 PHE QD . . 5.220 4.801 4.604 5.107 . 0 0 "[ . 1 . 2 ]" 1
153 1 5 ILE H 1 30 VAL H . . 5.370 4.503 4.195 5.223 . 0 0 "[ . 1 . 2 ]" 1
154 1 5 ILE H 1 68 VAL QG . . 5.500 4.419 4.098 4.627 . 0 0 "[ . 1 . 2 ]" 1
155 1 5 ILE H 1 69 ILE H . . 5.500 4.893 4.801 5.013 . 0 0 "[ . 1 . 2 ]" 1
156 1 5 ILE HA 1 5 ILE MD . . 4.350 3.861 3.777 3.997 . 0 0 "[ . 1 . 2 ]" 1
157 1 5 ILE HA 1 5 ILE HG12 . . 3.630 2.546 2.364 2.839 . 0 0 "[ . 1 . 2 ]" 1
158 1 5 ILE HA 1 5 ILE HG13 . . 3.610 2.982 2.654 3.279 . 0 0 "[ . 1 . 2 ]" 1
159 1 5 ILE HA 1 5 ILE MG . . 3.200 2.392 2.257 2.459 . 0 0 "[ . 1 . 2 ]" 1
160 1 5 ILE HA 1 6 PRO HD2 . . 3.380 2.215 2.072 2.504 . 0 0 "[ . 1 . 2 ]" 1
161 1 5 ILE HA 1 6 PRO HD3 . . 3.490 2.424 2.115 2.621 . 0 0 "[ . 1 . 2 ]" 1
162 1 5 ILE HA 1 6 PRO HG2 . . 5.130 4.406 4.244 4.593 . 0 0 "[ . 1 . 2 ]" 1
163 1 5 ILE HA 1 6 PRO HG3 . . 5.150 4.534 4.401 4.638 . 0 0 "[ . 1 . 2 ]" 1
164 1 5 ILE HA 1 69 ILE H . . 4.000 3.313 3.144 3.558 . 0 0 "[ . 1 . 2 ]" 1
165 1 5 ILE HA 1 69 ILE HB . . 4.050 3.864 3.630 4.119 0.069 18 0 "[ . 1 . 2 ]" 1
166 1 5 ILE HA 1 70 VAL HA . . 4.330 4.148 3.965 4.479 0.149 4 0 "[ . 1 . 2 ]" 1
167 1 5 ILE HA 1 70 VAL MG1 . . 4.090 3.606 3.393 3.787 . 0 0 "[ . 1 . 2 ]" 1
168 1 5 ILE HB 1 5 ILE MD . . 3.180 2.451 2.310 2.588 . 0 0 "[ . 1 . 2 ]" 1
169 1 5 ILE HB 1 28 ALA H . . 4.250 3.610 3.428 3.723 . 0 0 "[ . 1 . 2 ]" 1
170 1 5 ILE HB 1 28 ALA MB . . 3.510 2.280 2.094 2.518 . 0 0 "[ . 1 . 2 ]" 1
171 1 5 ILE HB 1 96 VAL HA . . 4.130 4.202 3.874 4.488 0.358 15 0 "[ . 1 . 2 ]" 1
172 1 5 ILE MD 1 28 ALA H . . 5.500 5.370 4.879 5.570 0.070 17 0 "[ . 1 . 2 ]" 1
173 1 5 ILE MD 1 96 VAL HA . . 3.270 2.295 2.017 2.529 . 0 0 "[ . 1 . 2 ]" 1
174 1 5 ILE MD 1 96 VAL HB . . 3.390 4.195 4.007 4.312 0.922 17 22 [****************+-****] 1
175 1 5 ILE MD 1 99 VAL H . . 5.500 4.199 3.863 4.637 . 0 0 "[ . 1 . 2 ]" 1
176 1 5 ILE MD 1 100 VAL H . . 4.770 3.371 3.007 4.045 . 0 0 "[ . 1 . 2 ]" 1
177 1 5 ILE MD 1 100 VAL MG2 . . 2.790 2.017 1.904 2.230 . 0 0 "[ . 1 . 2 ]" 1
178 1 5 ILE HG12 1 5 ILE MG . . 3.050 2.340 2.197 2.433 . 0 0 "[ . 1 . 2 ]" 1
179 1 5 ILE HG12 1 69 ILE H . . 4.290 3.440 3.139 3.762 . 0 0 "[ . 1 . 2 ]" 1
180 1 5 ILE HG12 1 69 ILE HB . . 3.670 2.224 2.053 2.819 . 0 0 "[ . 1 . 2 ]" 1
181 1 5 ILE HG13 1 28 ALA H . . 5.500 5.455 5.063 5.573 0.073 13 0 "[ . 1 . 2 ]" 1
182 1 5 ILE HG13 1 69 ILE H . . 4.800 3.826 3.235 4.338 . 0 0 "[ . 1 . 2 ]" 1
183 1 5 ILE HG13 1 69 ILE MD . . 5.120 3.790 3.164 5.230 0.110 18 0 "[ . 1 . 2 ]" 1
184 1 5 ILE MG 1 6 PRO HD2 . . 3.530 2.627 2.253 2.915 . 0 0 "[ . 1 . 2 ]" 1
185 1 5 ILE MG 1 6 PRO HD3 . . 3.800 3.802 3.352 3.974 0.174 21 0 "[ . 1 . 2 ]" 1
186 1 5 ILE MG 1 17 ILE MD . . 3.360 2.165 1.897 2.355 . 0 0 "[ . 1 . 2 ]" 1
187 1 5 ILE MG 1 17 ILE HG13 . . 3.720 2.259 2.114 2.511 . 0 0 "[ . 1 . 2 ]" 1
188 1 5 ILE MG 1 18 SER H . . 4.880 3.868 3.682 4.163 . 0 0 "[ . 1 . 2 ]" 1
189 1 5 ILE MG 1 28 ALA H . . 5.260 4.255 4.072 4.474 . 0 0 "[ . 1 . 2 ]" 1
190 1 5 ILE MG 1 96 VAL HA . . 3.530 2.813 2.509 3.166 . 0 0 "[ . 1 . 2 ]" 1
191 1 6 PRO HA 1 7 VAL H . . 3.100 2.248 2.171 2.293 . 0 0 "[ . 1 . 2 ]" 1
192 1 6 PRO HA 1 7 VAL QG . . 4.250 3.420 3.155 3.635 . 0 0 "[ . 1 . 2 ]" 1
193 1 6 PRO HA 1 18 SER H . . 4.910 4.875 4.748 5.024 0.114 11 0 "[ . 1 . 2 ]" 1
194 1 6 PRO HA 1 24 ALA MB . . 4.260 2.887 2.658 3.202 . 0 0 "[ . 1 . 2 ]" 1
195 1 6 PRO HA 1 27 PHE HA . . 3.400 2.583 2.373 2.775 . 0 0 "[ . 1 . 2 ]" 1
196 1 6 PRO HA 1 27 PHE QD . . 3.480 2.220 2.026 2.506 . 0 0 "[ . 1 . 2 ]" 1
197 1 6 PRO HA 1 27 PHE QE . . 4.120 3.562 3.331 3.817 . 0 0 "[ . 1 . 2 ]" 1
198 1 6 PRO HA 1 28 ALA H . . 3.920 3.641 3.391 3.826 . 0 0 "[ . 1 . 2 ]" 1
199 1 6 PRO HB2 1 7 VAL H . . 4.660 3.765 3.578 3.980 . 0 0 "[ . 1 . 2 ]" 1
200 1 6 PRO HB2 1 18 SER H . . 5.500 3.823 3.590 4.276 . 0 0 "[ . 1 . 2 ]" 1
201 1 6 PRO HB2 1 18 SER QB . . 2.950 2.507 2.055 2.820 . 0 0 "[ . 1 . 2 ]" 1
202 1 6 PRO HB2 1 21 PHE QD . . 4.290 4.315 4.084 4.425 0.135 21 0 "[ . 1 . 2 ]" 1
203 1 6 PRO HB2 1 24 ALA H . . 5.500 5.017 4.698 5.487 . 0 0 "[ . 1 . 2 ]" 1
204 1 6 PRO HB2 1 24 ALA MB . . 3.270 2.148 2.011 2.527 . 0 0 "[ . 1 . 2 ]" 1
205 1 6 PRO HB2 1 27 PHE QE . . 4.850 3.718 3.509 3.928 . 0 0 "[ . 1 . 2 ]" 1
206 1 6 PRO HB3 1 7 VAL H . . 4.580 4.238 4.107 4.376 . 0 0 "[ . 1 . 2 ]" 1
207 1 6 PRO HB3 1 21 PHE QD . . 4.190 2.891 2.658 3.233 . 0 0 "[ . 1 . 2 ]" 1
208 1 6 PRO HB3 1 21 PHE QE . . 4.260 4.350 3.949 4.454 0.194 16 0 "[ . 1 . 2 ]" 1
209 1 6 PRO HB3 1 24 ALA MB . . 3.470 2.403 2.221 2.663 . 0 0 "[ . 1 . 2 ]" 1
210 1 6 PRO HB3 1 27 PHE HA . . 4.510 4.400 4.155 4.630 0.120 2 0 "[ . 1 . 2 ]" 1
211 1 6 PRO HB3 1 27 PHE QD . . 4.590 2.757 2.463 3.104 . 0 0 "[ . 1 . 2 ]" 1
212 1 6 PRO HB3 1 27 PHE QE . . 3.660 2.177 2.006 2.267 . 0 0 "[ . 1 . 2 ]" 1
213 1 6 PRO HD2 1 17 ILE MD . . 4.560 3.047 2.590 3.144 . 0 0 "[ . 1 . 2 ]" 1
214 1 6 PRO HD2 1 18 SER H . . 5.500 4.490 4.035 4.719 . 0 0 "[ . 1 . 2 ]" 1
215 1 6 PRO HD2 1 70 VAL HA . . 3.640 2.692 2.454 3.036 . 0 0 "[ . 1 . 2 ]" 1
216 1 6 PRO HD2 1 70 VAL MG1 . . 3.800 2.878 2.656 3.214 . 0 0 "[ . 1 . 2 ]" 1
217 1 6 PRO HD3 1 27 PHE QD . . 4.320 4.004 3.551 4.497 0.177 17 0 "[ . 1 . 2 ]" 1
218 1 6 PRO HD3 1 68 VAL QG . . 3.980 3.206 2.925 3.626 . 0 0 "[ . 1 . 2 ]" 1
219 1 6 PRO HD3 1 69 ILE H . . 4.810 4.190 3.825 4.621 . 0 0 "[ . 1 . 2 ]" 1
220 1 6 PRO HD3 1 70 VAL H . . 5.500 5.418 5.056 5.584 0.084 21 0 "[ . 1 . 2 ]" 1
221 1 6 PRO HD3 1 70 VAL MG1 . . 3.020 2.153 2.048 2.298 . 0 0 "[ . 1 . 2 ]" 1
222 1 6 PRO HD3 1 71 ARG H . . 5.500 5.245 4.695 5.547 0.047 21 0 "[ . 1 . 2 ]" 1
223 1 6 PRO HG2 1 17 ILE MD . . 5.400 3.866 3.389 4.351 . 0 0 "[ . 1 . 2 ]" 1
224 1 6 PRO HG2 1 17 ILE HG12 . . 4.910 3.668 3.335 4.068 . 0 0 "[ . 1 . 2 ]" 1
225 1 6 PRO HG2 1 18 SER H . . 5.090 3.492 3.236 3.847 . 0 0 "[ . 1 . 2 ]" 1
226 1 6 PRO HG2 1 18 SER QB . . 4.320 3.216 2.477 3.665 . 0 0 "[ . 1 . 2 ]" 1
227 1 6 PRO HG2 1 21 PHE QD . . 4.280 4.336 4.027 4.460 0.180 16 0 "[ . 1 . 2 ]" 1
228 1 6 PRO HG2 1 70 VAL MG1 . . 4.770 3.452 3.129 3.670 . 0 0 "[ . 1 . 2 ]" 1
229 1 6 PRO HG2 1 71 ARG H . . 5.500 3.651 3.299 4.158 . 0 0 "[ . 1 . 2 ]" 1
230 1 6 PRO HG3 1 18 SER H . . 5.500 5.207 4.945 5.555 0.055 18 0 "[ . 1 . 2 ]" 1
231 1 6 PRO HG3 1 21 PHE HA . . 4.660 2.921 2.527 3.497 . 0 0 "[ . 1 . 2 ]" 1
232 1 6 PRO HG3 1 21 PHE QD . . 4.330 2.640 2.268 2.800 . 0 0 "[ . 1 . 2 ]" 1
233 1 6 PRO HG3 1 24 ALA MB . . 4.240 3.882 3.731 4.048 . 0 0 "[ . 1 . 2 ]" 1
234 1 6 PRO HG3 1 27 PHE QE . . 3.840 3.909 3.517 4.011 0.171 17 0 "[ . 1 . 2 ]" 1
235 1 6 PRO HG3 1 70 VAL MG1 . . 4.400 2.421 2.156 2.703 . 0 0 "[ . 1 . 2 ]" 1
236 1 6 PRO HG3 1 71 ARG H . . 5.500 4.053 3.787 4.570 . 0 0 "[ . 1 . 2 ]" 1
237 1 7 VAL H 1 7 VAL QG . . 3.230 2.062 1.903 2.163 . 0 0 "[ . 1 . 2 ]" 1
238 1 7 VAL H 1 9 GLU H . . 5.410 5.174 4.876 5.511 0.101 16 0 "[ . 1 . 2 ]" 1
239 1 7 VAL H 1 17 ILE HA . . 5.230 4.856 4.682 5.028 . 0 0 "[ . 1 . 2 ]" 1
240 1 7 VAL H 1 18 SER H . . 4.890 4.334 4.155 4.639 . 0 0 "[ . 1 . 2 ]" 1
241 1 7 VAL H 1 18 SER QB . . 4.700 3.693 3.338 4.164 . 0 0 "[ . 1 . 2 ]" 1
242 1 7 VAL H 1 24 ALA MB . . 3.630 3.266 2.818 3.960 0.330 15 0 "[ . 1 . 2 ]" 1
243 1 7 VAL H 1 25 PRO HD2 . . 5.400 4.435 3.970 5.007 . 0 0 "[ . 1 . 2 ]" 1
244 1 7 VAL H 1 26 TYR H . . 4.100 3.433 3.210 3.835 . 0 0 "[ . 1 . 2 ]" 1
245 1 7 VAL H 1 26 TYR HA . . 5.500 5.050 4.782 5.505 0.005 18 0 "[ . 1 . 2 ]" 1
246 1 7 VAL H 1 26 TYR HB2 . . 5.360 3.299 3.025 3.637 . 0 0 "[ . 1 . 2 ]" 1
247 1 7 VAL H 1 26 TYR HB3 . . 5.500 4.496 3.896 5.013 . 0 0 "[ . 1 . 2 ]" 1
248 1 7 VAL H 1 26 TYR QD . . 5.500 4.661 4.299 4.897 . 0 0 "[ . 1 . 2 ]" 1
249 1 7 VAL H 1 27 PHE H . . 5.500 4.845 4.418 5.245 . 0 0 "[ . 1 . 2 ]" 1
250 1 7 VAL H 1 27 PHE HA . . 3.680 3.382 2.971 3.680 . 0 0 "[ . 1 . 2 ]" 1
251 1 7 VAL H 1 27 PHE QD . . 5.500 4.093 3.605 4.441 . 0 0 "[ . 1 . 2 ]" 1
252 1 7 VAL H 1 28 ALA H . . 4.620 3.762 3.348 4.086 . 0 0 "[ . 1 . 2 ]" 1
253 1 7 VAL HA 1 7 VAL HB . . 2.740 2.494 2.450 2.592 . 0 0 "[ . 1 . 2 ]" 1
254 1 7 VAL HA 1 7 VAL QG . . 2.840 2.223 2.123 2.331 . 0 0 "[ . 1 . 2 ]" 1
255 1 7 VAL HA 1 8 SER H . . 3.140 2.280 2.185 2.418 . 0 0 "[ . 1 . 2 ]" 1
256 1 7 VAL HA 1 9 GLU H . . 4.200 4.120 3.965 4.454 0.254 16 0 "[ . 1 . 2 ]" 1
257 1 7 VAL HA 1 17 ILE H . . 5.170 4.623 4.499 4.923 . 0 0 "[ . 1 . 2 ]" 1
258 1 7 VAL HA 1 17 ILE HA . . 3.350 2.322 2.077 2.506 . 0 0 "[ . 1 . 2 ]" 1
259 1 7 VAL HA 1 17 ILE HB . . 4.970 4.801 4.617 4.966 . 0 0 "[ . 1 . 2 ]" 1
260 1 7 VAL HA 1 17 ILE HG12 . . 4.620 4.814 4.535 5.268 0.648 17 1 "[ . 1 . + 2 ]" 1
261 1 7 VAL HA 1 18 SER H . . 3.050 2.313 2.027 2.615 . 0 0 "[ . 1 . 2 ]" 1
262 1 7 VAL HA 1 18 SER QB . . 3.750 2.831 2.572 3.172 . 0 0 "[ . 1 . 2 ]" 1
263 1 7 VAL HB 1 8 SER H . . 3.430 2.597 2.299 2.919 . 0 0 "[ . 1 . 2 ]" 1
264 1 7 VAL HB 1 9 GLU H . . 3.430 2.592 2.337 2.824 . 0 0 "[ . 1 . 2 ]" 1
265 1 7 VAL HB 1 15 SER HA . . 4.320 3.676 3.378 3.872 . 0 0 "[ . 1 . 2 ]" 1
266 1 7 VAL HB 1 15 SER QB . . 3.920 2.428 2.126 2.994 . 0 0 "[ . 1 . 2 ]" 1
267 1 7 VAL HB 1 18 SER H . . 5.110 4.756 4.471 5.049 . 0 0 "[ . 1 . 2 ]" 1
268 1 7 VAL QG 1 8 SER H . . 3.480 3.250 3.109 3.380 . 0 0 "[ . 1 . 2 ]" 1
269 1 7 VAL QG 1 9 GLU H . . 3.810 2.978 2.774 3.247 . 0 0 "[ . 1 . 2 ]" 1
270 1 7 VAL QG 1 10 ASN H . . 5.050 4.554 4.050 5.043 . 0 0 "[ . 1 . 2 ]" 1
271 1 7 VAL QG 1 15 SER H . . 4.970 4.220 4.055 4.396 . 0 0 "[ . 1 . 2 ]" 1
272 1 7 VAL QG 1 15 SER HA . . 2.870 3.437 3.370 3.494 0.624 18 22 [*****************+**-*] 1
273 1 7 VAL QG 1 15 SER QB . . 3.090 1.791 1.746 1.849 . 0 0 "[ . 1 . 2 ]" 1
274 1 7 VAL QG 1 16 PRO HG2 . . 5.500 4.529 4.281 4.923 . 0 0 "[ . 1 . 2 ]" 1
275 1 7 VAL QG 1 17 ILE H . . 4.550 3.625 3.408 3.785 . 0 0 "[ . 1 . 2 ]" 1
276 1 7 VAL QG 1 17 ILE HA . . 2.850 2.253 2.033 2.507 . 0 0 "[ . 1 . 2 ]" 1
277 1 7 VAL QG 1 17 ILE HB . . 4.400 3.679 3.505 3.863 . 0 0 "[ . 1 . 2 ]" 1
278 1 7 VAL QG 1 18 SER QB . . 4.830 4.002 3.827 4.239 . 0 0 "[ . 1 . 2 ]" 1
279 1 7 VAL QG 1 24 ALA MB . . 4.720 4.267 3.995 4.655 . 0 0 "[ . 1 . 2 ]" 1
280 1 7 VAL QG 1 26 TYR H . . 3.900 3.706 3.282 3.969 0.069 15 0 "[ . 1 . 2 ]" 1
281 1 7 VAL QG 1 26 TYR HA . . 4.150 4.269 4.075 4.516 0.366 18 0 "[ . 1 . 2 ]" 1
282 1 7 VAL QG 1 26 TYR HB2 . . 2.920 1.996 1.889 2.074 . 0 0 "[ . 1 . 2 ]" 1
283 1 7 VAL QG 1 26 TYR HB3 . . 3.030 2.865 2.259 3.178 0.148 8 0 "[ . 1 . 2 ]" 1
284 1 7 VAL QG 1 26 TYR QD . . 3.110 3.053 2.506 3.282 0.172 4 0 "[ . 1 . 2 ]" 1
285 1 7 VAL QG 1 27 PHE HA . . 3.620 3.401 3.228 3.600 . 0 0 "[ . 1 . 2 ]" 1
286 1 7 VAL QG 1 28 ALA MB . . 3.150 2.302 2.120 2.617 . 0 0 "[ . 1 . 2 ]" 1
287 1 7 VAL QG 1 96 VAL H . . 4.860 3.699 3.479 3.969 . 0 0 "[ . 1 . 2 ]" 1
288 1 7 VAL QG 1 96 VAL MG2 . . 3.160 1.909 1.842 1.999 . 0 0 "[ . 1 . 2 ]" 1
289 1 8 SER H 1 8 SER QB . . 3.770 2.420 2.091 2.823 . 0 0 "[ . 1 . 2 ]" 1
290 1 8 SER H 1 9 GLU H . . 3.280 2.571 2.412 2.870 . 0 0 "[ . 1 . 2 ]" 1
291 1 8 SER H 1 9 GLU HB2 . . 5.500 4.820 4.603 5.317 . 0 0 "[ . 1 . 2 ]" 1
292 1 8 SER H 1 15 SER HA . . 4.670 5.263 4.947 5.543 0.873 17 16 "[* ******** ***+* *- ]" 1
293 1 8 SER H 1 16 PRO HB2 . . 4.860 4.294 3.918 4.653 . 0 0 "[ . 1 . 2 ]" 1
294 1 8 SER H 1 16 PRO HG2 . . 4.380 3.101 2.753 3.815 . 0 0 "[ . 1 . 2 ]" 1
295 1 8 SER H 1 17 ILE HA . . 4.530 3.774 3.531 3.992 . 0 0 "[ . 1 . 2 ]" 1
296 1 8 SER H 1 18 SER QB . . 4.660 3.348 2.948 3.670 . 0 0 "[ . 1 . 2 ]" 1
297 1 8 SER H 1 24 ALA MB . . 5.500 5.781 5.342 6.626 1.126 12 5 "[ - 1*+ ** 2 ]" 1
298 1 8 SER H 1 26 TYR H . . 5.500 5.993 5.686 6.541 1.041 12 9 "[* -** * + ** * 2 ]" 1
299 1 8 SER H 1 26 TYR QD . . 5.500 5.099 4.549 5.444 . 0 0 "[ . 1 . 2 ]" 1
300 1 8 SER HA 1 18 SER QB . . 3.890 3.261 2.700 3.789 . 0 0 "[ . 1 . 2 ]" 1
301 1 8 SER HA 1 24 ALA HA . . 4.870 4.797 4.358 5.408 0.538 12 1 "[ . 1 + . 2 ]" 1
302 1 8 SER HA 1 25 PRO HD2 . . 3.650 2.827 2.383 3.496 . 0 0 "[ . 1 . 2 ]" 1
303 1 8 SER HA 1 25 PRO HG2 . . 3.340 2.711 2.316 3.156 . 0 0 "[ . 1 . 2 ]" 1
304 1 8 SER HA 1 25 PRO HG3 . . 3.610 2.833 2.505 3.396 . 0 0 "[ . 1 . 2 ]" 1
305 1 8 SER QB 1 9 GLU H . . 4.610 3.111 2.821 3.891 . 0 0 "[ . 1 . 2 ]" 1
306 1 8 SER QB 1 9 GLU QG . . 3.220 2.773 2.344 3.541 0.321 4 0 "[ . 1 . 2 ]" 1
307 1 8 SER QB 1 18 SER QB . . 3.770 4.143 3.240 4.745 0.975 4 7 "[ *+** 1 *- 2 *]" 1
308 1 9 GLU H 1 9 GLU HB2 . . 3.930 2.789 2.531 2.966 . 0 0 "[ . 1 . 2 ]" 1
309 1 9 GLU H 1 9 GLU HB3 . . 3.860 3.823 3.688 3.935 0.075 13 0 "[ . 1 . 2 ]" 1
310 1 9 GLU H 1 9 GLU QG . . 4.300 3.348 2.990 3.839 . 0 0 "[ . 1 . 2 ]" 1
311 1 9 GLU H 1 10 ASN H . . 4.940 4.296 4.229 4.374 . 0 0 "[ . 1 . 2 ]" 1
312 1 9 GLU H 1 11 ARG H . . 5.500 4.689 3.866 5.346 . 0 0 "[ . 1 . 2 ]" 1
313 1 9 GLU H 1 11 ARG HG3 . . 5.500 4.380 3.980 4.889 . 0 0 "[ . 1 . 2 ]" 1
314 1 9 GLU H 1 15 SER HA . . 3.990 4.094 3.930 4.193 0.203 19 0 "[ . 1 . 2 ]" 1
315 1 9 GLU H 1 16 PRO QD . . 3.670 2.837 2.335 3.286 . 0 0 "[ . 1 . 2 ]" 1
316 1 9 GLU H 1 16 PRO HG2 . . 4.210 3.371 2.716 3.919 . 0 0 "[ . 1 . 2 ]" 1
317 1 9 GLU H 1 26 TYR QD . . 4.550 3.700 3.370 4.072 . 0 0 "[ . 1 . 2 ]" 1
318 1 9 GLU H 1 26 TYR QE . . 5.280 4.740 4.193 5.093 . 0 0 "[ . 1 . 2 ]" 1
319 1 9 GLU HA 1 9 GLU QG . . 3.850 2.568 2.149 3.018 . 0 0 "[ . 1 . 2 ]" 1
320 1 9 GLU HA 1 10 ASN H . . 2.790 2.366 2.236 2.543 . 0 0 "[ . 1 . 2 ]" 1
321 1 9 GLU HA 1 26 TYR QD . . 3.310 2.978 2.383 3.457 0.147 8 0 "[ . 1 . 2 ]" 1
322 1 9 GLU HA 1 26 TYR QE . . 3.050 2.396 2.200 2.582 . 0 0 "[ . 1 . 2 ]" 1
323 1 9 GLU HB2 1 10 ASN H . . 3.880 3.751 3.237 3.980 0.100 2 0 "[ . 1 . 2 ]" 1
324 1 9 GLU HB2 1 11 ARG HD2 . . 4.990 3.687 3.093 4.526 . 0 0 "[ . 1 . 2 ]" 1
325 1 9 GLU HB2 1 11 ARG HG3 . . 3.660 2.470 2.263 2.702 . 0 0 "[ . 1 . 2 ]" 1
326 1 9 GLU HB2 1 16 PRO QD . . 4.660 2.586 2.098 3.414 . 0 0 "[ . 1 . 2 ]" 1
327 1 9 GLU HB3 1 9 GLU QG . . 2.680 2.381 2.216 2.557 . 0 0 "[ . 1 . 2 ]" 1
328 1 9 GLU HB3 1 10 ASN H . . 3.780 2.545 2.099 2.945 . 0 0 "[ . 1 . 2 ]" 1
329 1 9 GLU HB3 1 16 PRO QD . . 5.140 4.000 3.534 4.882 . 0 0 "[ . 1 . 2 ]" 1
330 1 9 GLU QG 1 10 ASN H . . 4.820 3.991 3.603 4.358 . 0 0 "[ . 1 . 2 ]" 1
331 1 9 GLU QG 1 11 ARG HG3 . . 4.900 4.208 3.867 4.536 . 0 0 "[ . 1 . 2 ]" 1
332 1 9 GLU QG 1 16 PRO QD . . 4.760 4.036 3.281 4.753 . 0 0 "[ . 1 . 2 ]" 1
333 1 10 ASN H 1 10 ASN HB2 . . 3.530 3.026 2.470 3.634 0.104 17 0 "[ . 1 . 2 ]" 1
334 1 10 ASN H 1 10 ASN HB3 . . 3.290 2.609 2.228 3.077 . 0 0 "[ . 1 . 2 ]" 1
335 1 10 ASN H 1 11 ARG H . . 4.770 3.875 3.252 4.330 . 0 0 "[ . 1 . 2 ]" 1
336 1 10 ASN H 1 11 ARG HA . . 4.920 4.984 4.653 5.035 0.115 16 0 "[ . 1 . 2 ]" 1
337 1 10 ASN H 1 11 ARG HG2 . . 5.500 4.159 3.538 4.616 . 0 0 "[ . 1 . 2 ]" 1
338 1 10 ASN H 1 11 ARG HG3 . . 5.500 3.836 3.300 4.468 . 0 0 "[ . 1 . 2 ]" 1
339 1 10 ASN H 1 26 TYR QD . . 4.790 4.061 3.640 4.868 0.078 19 0 "[ . 1 . 2 ]" 1
340 1 10 ASN H 1 26 TYR QE . . 4.140 3.442 3.108 4.182 0.042 19 0 "[ . 1 . 2 ]" 1
341 1 10 ASN HA 1 10 ASN HB2 . . 2.950 2.472 2.330 2.567 . 0 0 "[ . 1 . 2 ]" 1
342 1 10 ASN HA 1 11 ARG H . . 3.040 2.354 2.122 2.792 . 0 0 "[ . 1 . 2 ]" 1
343 1 10 ASN HA 1 11 ARG HG2 . . 4.950 5.004 4.568 5.097 0.147 7 0 "[ . 1 . 2 ]" 1
344 1 10 ASN HA 1 12 GLY H . . 3.890 3.584 3.275 3.890 0.000 21 0 "[ . 1 . 2 ]" 1
345 1 10 ASN HA 1 42 VAL QG . . 3.100 2.502 2.254 2.894 . 0 0 "[ . 1 . 2 ]" 1
346 1 10 ASN HB2 1 11 ARG H . . 5.400 4.494 3.982 4.674 . 0 0 "[ . 1 . 2 ]" 1
347 1 10 ASN HB2 1 26 TYR QD . . 4.230 3.388 2.703 4.396 0.166 13 0 "[ . 1 . 2 ]" 1
348 1 10 ASN HB2 1 26 TYR QE . . 3.910 3.328 2.668 4.089 0.179 8 0 "[ . 1 . 2 ]" 1
349 1 10 ASN HB2 1 42 VAL QG . . 4.620 3.107 2.378 4.023 . 0 0 "[ . 1 . 2 ]" 1
350 1 10 ASN HB3 1 11 ARG H . . 5.220 4.528 4.383 4.679 . 0 0 "[ . 1 . 2 ]" 1
351 1 10 ASN HB3 1 12 GLY H . . 5.500 5.009 4.576 5.473 . 0 0 "[ . 1 . 2 ]" 1
352 1 10 ASN HB3 1 42 VAL QG . . 5.080 3.898 2.867 4.956 . 0 0 "[ . 1 . 2 ]" 1
353 1 11 ARG H 1 11 ARG HB2 . . 4.080 2.754 2.549 2.961 . 0 0 "[ . 1 . 2 ]" 1
354 1 11 ARG H 1 11 ARG HG2 . . 5.070 3.609 2.710 4.045 . 0 0 "[ . 1 . 2 ]" 1
355 1 11 ARG H 1 11 ARG HG3 . . 4.590 2.934 2.397 3.302 . 0 0 "[ . 1 . 2 ]" 1
356 1 11 ARG H 1 12 GLY H . . 3.370 2.781 2.248 3.395 0.025 4 0 "[ . 1 . 2 ]" 1
357 1 11 ARG H 1 12 GLY QA . . 4.800 4.281 3.923 4.907 0.107 20 0 "[ . 1 . 2 ]" 1
358 1 11 ARG H 1 14 ASP H . . 5.500 5.510 4.803 6.193 0.693 4 1 "[ +. 1 . 2 ]" 1
359 1 11 ARG H 1 15 SER H . . 4.390 3.784 3.261 4.454 0.064 4 0 "[ . 1 . 2 ]" 1
360 1 11 ARG H 1 15 SER HA . . 4.020 2.794 2.413 3.389 . 0 0 "[ . 1 . 2 ]" 1
361 1 11 ARG H 1 15 SER QB . . 4.590 3.079 2.778 3.848 . 0 0 "[ . 1 . 2 ]" 1
362 1 11 ARG H 1 42 VAL QG . . 4.810 3.406 2.667 4.220 . 0 0 "[ . 1 . 2 ]" 1
363 1 11 ARG HA 1 11 ARG HB3 . . 2.890 2.412 2.328 2.461 . 0 0 "[ . 1 . 2 ]" 1
364 1 11 ARG HA 1 11 ARG HG2 . . 3.470 2.560 2.396 2.827 . 0 0 "[ . 1 . 2 ]" 1
365 1 11 ARG HA 1 11 ARG HG3 . . 3.790 3.429 3.304 3.720 . 0 0 "[ . 1 . 2 ]" 1
366 1 11 ARG HA 1 12 GLY H . . 3.540 2.844 2.668 2.933 . 0 0 "[ . 1 . 2 ]" 1
367 1 11 ARG HA 1 15 SER H . . 5.500 4.861 4.707 5.104 . 0 0 "[ . 1 . 2 ]" 1
368 1 11 ARG HB2 1 11 ARG HD2 . . 3.630 2.719 2.467 3.106 . 0 0 "[ . 1 . 2 ]" 1
369 1 11 ARG HB2 1 11 ARG HD3 . . 4.240 3.162 2.761 3.591 . 0 0 "[ . 1 . 2 ]" 1
370 1 11 ARG HB2 1 12 GLY H . . 4.980 4.299 4.153 4.425 . 0 0 "[ . 1 . 2 ]" 1
371 1 11 ARG HB2 1 14 ASP H . . 4.560 4.143 3.618 4.523 . 0 0 "[ . 1 . 2 ]" 1
372 1 11 ARG HB2 1 14 ASP HB2 . . 3.680 2.945 2.388 3.763 0.083 3 0 "[ . 1 . 2 ]" 1
373 1 11 ARG HB2 1 15 SER H . . 3.880 2.941 2.677 3.390 . 0 0 "[ . 1 . 2 ]" 1
374 1 11 ARG HB2 1 15 SER HA . . 2.920 2.280 2.108 2.554 . 0 0 "[ . 1 . 2 ]" 1
375 1 11 ARG HB2 1 16 PRO QD . . 3.440 2.985 2.488 3.470 0.030 17 0 "[ . 1 . 2 ]" 1
376 1 11 ARG HB3 1 11 ARG HD2 . . 3.750 2.930 2.553 3.174 . 0 0 "[ . 1 . 2 ]" 1
377 1 11 ARG HB3 1 11 ARG HD3 . . 3.660 2.338 2.154 2.490 . 0 0 "[ . 1 . 2 ]" 1
378 1 11 ARG HB3 1 12 GLY H . . 4.970 4.534 4.452 4.587 . 0 0 "[ . 1 . 2 ]" 1
379 1 11 ARG HB3 1 14 ASP H . . 4.460 4.205 3.827 4.421 . 0 0 "[ . 1 . 2 ]" 1
380 1 11 ARG HB3 1 14 ASP HB2 . . 3.770 2.578 2.119 3.300 . 0 0 "[ . 1 . 2 ]" 1
381 1 11 ARG HB3 1 14 ASP HB3 . . 4.390 3.900 2.587 4.532 0.142 3 0 "[ . 1 . 2 ]" 1
382 1 11 ARG HB3 1 15 SER H . . 4.070 4.072 3.844 4.161 0.091 20 0 "[ . 1 . 2 ]" 1
383 1 11 ARG HB3 1 15 SER HA . . 4.670 4.006 3.836 4.277 . 0 0 "[ . 1 . 2 ]" 1
384 1 11 ARG HD2 1 14 ASP HB2 . . 5.150 3.917 2.845 5.107 . 0 0 "[ . 1 . 2 ]" 1
385 1 11 ARG HD2 1 16 PRO QD . . 4.060 2.595 2.025 3.512 . 0 0 "[ . 1 . 2 ]" 1
386 1 11 ARG HG2 1 12 GLY H . . 5.500 5.034 4.753 5.326 . 0 0 "[ . 1 . 2 ]" 1
387 1 11 ARG HG2 1 15 SER HA . . 4.990 4.558 4.070 5.005 0.015 19 0 "[ . 1 . 2 ]" 1
388 1 11 ARG HG3 1 12 GLY H . . 5.500 5.183 4.971 5.483 . 0 0 "[ . 1 . 2 ]" 1
389 1 11 ARG HG3 1 15 SER H . . 5.500 5.037 4.512 5.703 0.203 19 0 "[ . 1 . 2 ]" 1
390 1 11 ARG HG3 1 15 SER HA . . 4.970 3.152 2.652 3.815 . 0 0 "[ . 1 . 2 ]" 1
391 1 11 ARG HG3 1 16 PRO QD . . 5.120 2.901 2.479 3.230 . 0 0 "[ . 1 . 2 ]" 1
392 1 12 GLY H 1 15 SER QB . . 4.960 4.498 3.841 4.966 0.006 19 0 "[ . 1 . 2 ]" 1
393 1 12 GLY H 1 40 ILE MG . . 5.500 5.098 4.666 5.594 0.094 19 0 "[ . 1 . 2 ]" 1
394 1 12 GLY H 1 42 VAL HB . . 5.030 4.405 3.423 5.123 0.093 2 0 "[ . 1 . 2 ]" 1
395 1 12 GLY H 1 42 VAL QG . . 3.930 2.828 1.997 3.374 . 0 0 "[ . 1 . 2 ]" 1
396 1 12 GLY QA 1 13 LYS QG . . 4.520 3.524 2.855 4.451 . 0 0 "[ . 1 . 2 ]" 1
397 1 12 GLY QA 1 14 ASP H . . 5.160 3.807 3.176 4.231 . 0 0 "[ . 1 . 2 ]" 1
398 1 12 GLY QA 1 15 SER H . . 5.240 4.137 3.624 4.473 . 0 0 "[ . 1 . 2 ]" 1
399 1 12 GLY QA 1 40 ILE MD . . 4.320 4.124 3.748 4.293 . 0 0 "[ . 1 . 2 ]" 1
400 1 12 GLY QA 1 40 ILE MG . . 4.150 3.160 2.610 3.634 . 0 0 "[ . 1 . 2 ]" 1
401 1 12 GLY QA 1 42 VAL HB . . 5.020 3.600 2.364 4.654 . 0 0 "[ . 1 . 2 ]" 1
402 1 12 GLY QA 1 42 VAL QG . . 3.360 2.444 1.962 3.026 . 0 0 "[ . 1 . 2 ]" 1
403 1 13 LYS HA 1 13 LYS QB . . 2.610 2.264 2.093 2.433 . 0 0 "[ . 1 . 2 ]" 1
404 1 13 LYS HA 1 13 LYS HD3 . . 5.050 4.762 3.917 5.522 0.472 20 0 "[ . 1 . 2 ]" 1
405 1 13 LYS HA 1 15 SER H . . 4.870 3.680 3.305 4.125 . 0 0 "[ . 1 . 2 ]" 1
406 1 13 LYS HA 1 40 ILE MD . . 3.360 3.203 2.225 3.503 0.143 10 0 "[ . 1 . 2 ]" 1
407 1 13 LYS HA 1 96 VAL MG1 . . 4.140 2.875 2.217 3.547 . 0 0 "[ . 1 . 2 ]" 1
408 1 13 LYS HA 1 97 GLU H . . 4.110 3.373 3.051 3.946 . 0 0 "[ . 1 . 2 ]" 1
409 1 13 LYS HA 1 97 GLU QG . . 3.520 4.122 3.611 5.044 1.524 9 12 "[ * *- *+1*** *** * ]" 1
410 1 13 LYS QB 1 13 LYS HD2 . . 3.430 2.648 2.318 3.365 . 0 0 "[ . 1 . 2 ]" 1
411 1 13 LYS QB 1 14 ASP H . . 4.500 2.890 2.071 3.793 . 0 0 "[ . 1 . 2 ]" 1
412 1 13 LYS QB 1 40 ILE MD . . 3.960 3.557 2.102 4.854 0.894 6 3 "[ .+ 1 *. -2 ]" 1
413 1 13 LYS QB 1 97 GLU H . . 4.450 3.510 2.703 4.099 . 0 0 "[ . 1 . 2 ]" 1
414 1 13 LYS HD2 1 13 LYS QG . . 2.400 2.324 2.053 2.448 0.048 12 0 "[ . 1 . 2 ]" 1
415 1 13 LYS HD2 1 14 ASP H . . 5.500 5.071 4.572 5.527 0.027 21 0 "[ . 1 . 2 ]" 1
416 1 13 LYS QE 1 40 ILE MD . . 4.910 4.857 3.703 6.054 1.144 1 4 "[+ .* * . - ]" 1
417 1 13 LYS QG 1 14 ASP H . . 3.840 3.317 2.040 3.974 0.134 3 0 "[ . 1 . 2 ]" 1
418 1 13 LYS QG 1 97 GLU H . . 5.500 4.796 3.457 5.573 0.073 20 0 "[ . 1 . 2 ]" 1
419 1 14 ASP H 1 14 ASP HB2 . . 3.360 2.878 2.104 3.476 0.116 21 0 "[ . 1 . 2 ]" 1
420 1 14 ASP H 1 14 ASP HB3 . . 3.680 3.460 3.008 3.719 0.039 2 0 "[ . 1 . 2 ]" 1
421 1 14 ASP H 1 15 SER H . . 3.420 2.650 2.328 3.021 . 0 0 "[ . 1 . 2 ]" 1
422 1 14 ASP H 1 15 SER QB . . 5.500 4.806 4.196 5.169 . 0 0 "[ . 1 . 2 ]" 1
423 1 14 ASP H 1 95 THR HB . . 5.500 5.061 4.594 5.568 0.068 13 0 "[ . 1 . 2 ]" 1
424 1 14 ASP H 1 95 THR MG . . 5.500 5.099 4.505 5.543 0.043 16 0 "[ . 1 . 2 ]" 1
425 1 14 ASP H 1 96 VAL H . . 5.500 5.568 5.072 6.047 0.547 15 1 "[ . 1 + 2 ]" 1
426 1 14 ASP HA 1 14 ASP HB3 . . 3.050 2.378 2.210 2.841 . 0 0 "[ . 1 . 2 ]" 1
427 1 14 ASP HA 1 95 THR HB . . 3.400 2.840 2.227 3.510 0.110 15 0 "[ . 1 . 2 ]" 1
428 1 14 ASP HA 1 95 THR MG . . 3.670 2.737 2.192 3.263 . 0 0 "[ . 1 . 2 ]" 1
429 1 14 ASP HA 1 96 VAL H . . 4.180 4.402 3.833 4.921 0.741 15 3 "[ .* 1 +- 2 ]" 1
430 1 14 ASP HA 1 97 GLU QG . . 4.540 3.578 3.220 4.095 . 0 0 "[ . 1 . 2 ]" 1
431 1 14 ASP HB2 1 15 SER H . . 4.700 3.566 3.089 4.126 . 0 0 "[ . 1 . 2 ]" 1
432 1 14 ASP HB2 1 95 THR MG . . 4.650 4.432 3.582 4.808 0.158 4 0 "[ . 1 . 2 ]" 1
433 1 14 ASP HB3 1 15 SER H . . 4.860 4.330 3.734 4.657 . 0 0 "[ . 1 . 2 ]" 1
434 1 14 ASP HB3 1 95 THR MG . . 3.800 3.662 3.223 3.979 0.179 10 0 "[ . 1 . 2 ]" 1
435 1 15 SER H 1 15 SER QB . . 3.470 2.519 1.876 2.645 . 0 0 "[ . 1 . 2 ]" 1
436 1 15 SER H 1 95 THR HB . . 5.340 4.375 3.886 5.213 . 0 0 "[ . 1 . 2 ]" 1
437 1 15 SER H 1 95 THR MG . . 5.500 4.530 3.850 4.846 . 0 0 "[ . 1 . 2 ]" 1
438 1 15 SER H 1 96 VAL MG2 . . 4.450 3.977 3.547 4.314 . 0 0 "[ . 1 . 2 ]" 1
439 1 15 SER HA 1 16 PRO QD . . 3.090 2.052 2.000 2.119 . 0 0 "[ . 1 . 2 ]" 1
440 1 15 SER HA 1 16 PRO HG3 . . 4.610 4.577 4.450 4.698 0.088 4 0 "[ . 1 . 2 ]" 1
441 1 15 SER HA 1 96 VAL H . . 5.500 4.905 4.655 5.239 . 0 0 "[ . 1 . 2 ]" 1
442 1 15 SER HA 1 96 VAL MG2 . . 4.060 4.381 4.174 4.548 0.488 13 0 "[ . 1 . 2 ]" 1
443 1 15 SER QB 1 96 VAL H . . 5.270 3.282 2.629 3.908 . 0 0 "[ . 1 . 2 ]" 1
444 1 15 SER QB 1 96 VAL MG2 . . 3.100 2.055 1.934 2.403 . 0 0 "[ . 1 . 2 ]" 1
445 1 15 SER QB 1 97 GLU H . . 5.500 4.984 4.386 5.424 . 0 0 "[ . 1 . 2 ]" 1
446 1 16 PRO HA 1 17 ILE H . . 2.930 2.244 2.158 2.327 . 0 0 "[ . 1 . 2 ]" 1
447 1 16 PRO HA 1 17 ILE HB . . 4.540 4.442 4.288 4.577 0.037 11 0 "[ . 1 . 2 ]" 1
448 1 16 PRO HA 1 17 ILE MG . . 4.490 3.983 3.797 4.214 . 0 0 "[ . 1 . 2 ]" 1
449 1 16 PRO HA 1 95 THR HA . . 3.150 2.296 2.056 2.436 . 0 0 "[ . 1 . 2 ]" 1
450 1 16 PRO HA 1 95 THR MG . . 3.390 2.654 2.261 3.425 0.035 3 0 "[ . 1 . 2 ]" 1
451 1 16 PRO HA 1 96 VAL H . . 4.200 4.059 3.770 4.300 0.100 3 0 "[ . 1 . 2 ]" 1
452 1 16 PRO HB2 1 17 ILE H . . 4.040 3.533 3.388 3.704 . 0 0 "[ . 1 . 2 ]" 1
453 1 16 PRO HB2 1 95 THR HA . . 4.790 4.955 4.691 5.146 0.356 19 0 "[ . 1 . 2 ]" 1
454 1 16 PRO HB3 1 17 ILE H . . 4.140 4.069 3.926 4.160 0.020 11 0 "[ . 1 . 2 ]" 1
455 1 16 PRO HB3 1 95 THR HA . . 4.310 4.292 4.038 4.400 0.090 17 0 "[ . 1 . 2 ]" 1
456 1 16 PRO HB3 1 95 THR MG . . 5.410 3.217 2.770 3.946 . 0 0 "[ . 1 . 2 ]" 1
457 1 16 PRO HG2 1 17 ILE H . . 5.500 4.956 4.722 5.351 . 0 0 "[ . 1 . 2 ]" 1
458 1 17 ILE H 1 17 ILE HB . . 3.120 2.357 2.221 2.478 . 0 0 "[ . 1 . 2 ]" 1
459 1 17 ILE H 1 17 ILE HG13 . . 4.220 4.315 4.227 4.367 0.147 3 0 "[ . 1 . 2 ]" 1
460 1 17 ILE H 1 17 ILE MG . . 3.340 2.182 2.041 2.361 . 0 0 "[ . 1 . 2 ]" 1
461 1 17 ILE H 1 18 SER H . . 4.470 4.616 4.559 4.682 0.212 18 0 "[ . 1 . 2 ]" 1
462 1 17 ILE H 1 94 GLY H . . 5.340 3.865 3.598 4.041 . 0 0 "[ . 1 . 2 ]" 1
463 1 17 ILE H 1 94 GLY HA2 . . 5.030 4.728 4.395 4.956 . 0 0 "[ . 1 . 2 ]" 1
464 1 17 ILE H 1 95 THR HA . . 3.660 2.962 2.732 3.271 . 0 0 "[ . 1 . 2 ]" 1
465 1 17 ILE H 1 95 THR MG . . 4.650 4.207 3.846 4.710 0.060 3 0 "[ . 1 . 2 ]" 1
466 1 17 ILE H 1 96 VAL HA . . 5.500 5.468 5.264 5.577 0.077 10 0 "[ . 1 . 2 ]" 1
467 1 17 ILE HA 1 17 ILE HB . . 2.890 2.499 2.446 2.569 . 0 0 "[ . 1 . 2 ]" 1
468 1 17 ILE HA 1 17 ILE MD . . 4.690 3.648 3.454 3.754 . 0 0 "[ . 1 . 2 ]" 1
469 1 17 ILE HA 1 17 ILE HG12 . . 4.050 3.160 3.064 3.296 . 0 0 "[ . 1 . 2 ]" 1
470 1 17 ILE HA 1 17 ILE HG13 . . 2.910 2.300 2.162 2.408 . 0 0 "[ . 1 . 2 ]" 1
471 1 17 ILE HA 1 18 SER H . . 2.990 2.199 2.111 2.303 . 0 0 "[ . 1 . 2 ]" 1
472 1 17 ILE HB 1 17 ILE MD . . 3.270 2.295 2.133 2.374 . 0 0 "[ . 1 . 2 ]" 1
473 1 17 ILE HB 1 18 SER H . . 4.180 4.172 4.069 4.280 0.100 4 0 "[ . 1 . 2 ]" 1
474 1 17 ILE HB 1 93 SER H . . 5.500 5.570 5.519 5.591 0.091 15 0 "[ . 1 . 2 ]" 1
475 1 17 ILE HB 1 93 SER HA . . 3.810 4.384 4.121 4.558 0.748 17 17 "[* **.***** ***-*+ ***]" 1
476 1 17 ILE HB 1 94 GLY H . . 4.280 4.003 3.477 4.404 0.124 13 0 "[ . 1 . 2 ]" 1
477 1 17 ILE MD 1 17 ILE MG . . 3.440 2.182 2.111 2.398 . 0 0 "[ . 1 . 2 ]" 1
478 1 17 ILE MD 1 18 SER H . . 4.430 4.180 3.803 4.409 . 0 0 "[ . 1 . 2 ]" 1
479 1 17 ILE MD 1 70 VAL HA . . 3.450 2.667 2.322 3.553 0.103 4 0 "[ . 1 . 2 ]" 1
480 1 17 ILE MD 1 71 ARG QD . . 5.250 3.349 2.875 4.426 . 0 0 "[ . 1 . 2 ]" 1
481 1 17 ILE MD 1 92 ALA H . . 4.560 4.007 3.630 4.711 0.151 18 0 "[ . 1 . 2 ]" 1
482 1 17 ILE MD 1 93 SER H . . 4.810 3.780 3.570 4.217 . 0 0 "[ . 1 . 2 ]" 1
483 1 17 ILE MD 1 93 SER HA . . 3.930 3.247 2.780 3.589 . 0 0 "[ . 1 . 2 ]" 1
484 1 17 ILE MD 1 94 GLY H . . 5.200 4.282 3.863 4.543 . 0 0 "[ . 1 . 2 ]" 1
485 1 17 ILE HG12 1 18 SER H . . 4.150 2.892 2.398 3.346 . 0 0 "[ . 1 . 2 ]" 1
486 1 17 ILE HG12 1 19 GLU H . . 5.500 5.527 5.146 5.782 0.282 4 0 "[ . 1 . 2 ]" 1
487 1 17 ILE HG13 1 18 SER H . . 4.070 2.706 2.432 2.945 . 0 0 "[ . 1 . 2 ]" 1
488 1 17 ILE MG 1 18 SER H . . 5.290 3.795 3.622 3.987 . 0 0 "[ . 1 . 2 ]" 1
489 1 17 ILE MG 1 19 GLU H . . 5.500 5.477 5.277 5.587 0.087 13 0 "[ . 1 . 2 ]" 1
490 1 17 ILE MG 1 71 ARG H . . 5.500 5.231 4.856 5.567 0.067 15 0 "[ . 1 . 2 ]" 1
491 1 17 ILE MG 1 71 ARG HB2 . . 5.310 3.718 3.092 4.833 . 0 0 "[ . 1 . 2 ]" 1
492 1 17 ILE MG 1 71 ARG QD . . 3.990 2.373 1.934 2.885 . 0 0 "[ . 1 . 2 ]" 1
493 1 17 ILE MG 1 93 SER H . . 4.190 3.795 3.542 3.932 . 0 0 "[ . 1 . 2 ]" 1
494 1 17 ILE MG 1 93 SER HA . . 3.040 2.035 1.923 2.176 . 0 0 "[ . 1 . 2 ]" 1
495 1 17 ILE MG 1 93 SER QB . . 4.370 3.483 3.196 3.806 . 0 0 "[ . 1 . 2 ]" 1
496 1 17 ILE MG 1 94 GLY H . . 2.920 2.077 1.835 2.218 . 0 0 "[ . 1 . 2 ]" 1
497 1 17 ILE MG 1 94 GLY HA2 . . 3.770 3.833 3.532 3.919 0.149 16 0 "[ . 1 . 2 ]" 1
498 1 17 ILE MG 1 95 THR H . . 5.160 4.882 4.743 4.988 . 0 0 "[ . 1 . 2 ]" 1
499 1 17 ILE MG 1 95 THR HA . . 4.180 4.319 4.240 4.345 0.165 13 0 "[ . 1 . 2 ]" 1
500 1 18 SER H 1 18 SER QB . . 3.390 2.240 2.090 2.386 . 0 0 "[ . 1 . 2 ]" 1
501 1 18 SER H 1 19 GLU H . . 5.030 4.490 4.144 4.615 . 0 0 "[ . 1 . 2 ]" 1
502 1 18 SER H 1 19 GLU HA . . 5.500 5.264 5.026 5.478 . 0 0 "[ . 1 . 2 ]" 1
503 1 18 SER H 1 24 ALA MB . . 4.420 4.848 4.352 5.562 1.142 12 7 "[ * -1*+ ** * 2 ]" 1
504 1 18 SER HA 1 19 GLU H . . 3.090 2.532 2.318 2.837 . 0 0 "[ . 1 . 2 ]" 1
505 1 18 SER HA 1 19 GLU HA . . 4.360 4.370 4.244 4.526 0.166 18 0 "[ . 1 . 2 ]" 1
506 1 18 SER HA 1 19 GLU QB . . 4.560 4.570 4.089 4.927 0.367 8 0 "[ . 1 . 2 ]" 1
507 1 18 SER HA 1 20 HIS H . . 4.980 4.451 3.958 4.809 . 0 0 "[ . 1 . 2 ]" 1
508 1 18 SER QB 1 19 GLU H . . 4.430 2.891 2.386 3.227 . 0 0 "[ . 1 . 2 ]" 1
509 1 18 SER QB 1 20 HIS H . . 4.790 3.101 2.630 3.631 . 0 0 "[ . 1 . 2 ]" 1
510 1 18 SER QB 1 24 ALA MB . . 3.510 3.063 2.581 3.837 0.327 12 0 "[ . 1 . 2 ]" 1
511 1 19 GLU H 1 19 GLU QB . . 3.580 2.506 2.191 3.090 . 0 0 "[ . 1 . 2 ]" 1
512 1 19 GLU H 1 19 GLU QG . . 3.720 3.051 2.285 3.869 0.149 17 0 "[ . 1 . 2 ]" 1
513 1 19 GLU H 1 20 HIS H . . 4.170 2.292 1.940 2.850 . 0 0 "[ . 1 . 2 ]" 1
514 1 19 GLU H 1 20 HIS HA . . 5.500 5.046 4.695 5.462 . 0 0 "[ . 1 . 2 ]" 1
515 1 19 GLU H 1 71 ARG QD . . 5.500 4.954 4.580 5.319 . 0 0 "[ . 1 . 2 ]" 1
516 1 19 GLU HA 1 19 GLU QG . . 3.470 2.480 2.165 3.152 . 0 0 "[ . 1 . 2 ]" 1
517 1 19 GLU HA 1 71 ARG H . . 5.400 4.381 3.500 5.234 . 0 0 "[ . 1 . 2 ]" 1
518 1 19 GLU HA 1 71 ARG HB2 . . 3.210 3.100 2.098 4.175 0.965 5 5 "[ * + 1 . -* *]" 1
519 1 19 GLU HA 1 71 ARG HB3 . . 3.370 2.605 1.990 3.523 0.153 13 0 "[ . 1 . 2 ]" 1
520 1 19 GLU HA 1 71 ARG QD . . 3.510 2.868 2.121 3.355 . 0 0 "[ . 1 . 2 ]" 1
521 1 19 GLU HA 1 71 ARG QG . . 3.830 3.267 2.370 3.652 . 0 0 "[ . 1 . 2 ]" 1
522 1 19 GLU QB 1 20 HIS H . . 3.920 2.769 2.359 3.461 . 0 0 "[ . 1 . 2 ]" 1
523 1 19 GLU QB 1 71 ARG QD . . 5.010 4.105 2.864 4.634 . 0 0 "[ . 1 . 2 ]" 1
524 1 19 GLU QB 1 72 GLY H . . 5.500 4.050 3.212 4.547 . 0 0 "[ . 1 . 2 ]" 1
525 1 20 HIS H 1 20 HIS QB . . 3.850 2.605 2.272 2.863 . 0 0 "[ . 1 . 2 ]" 1
526 1 20 HIS H 1 24 ALA MB . . 5.500 4.609 4.225 5.446 . 0 0 "[ . 1 . 2 ]" 1
527 1 20 HIS H 1 71 ARG QD . . 5.500 5.958 5.044 6.491 0.991 11 10 "[* . **+- **** * ]" 1
528 1 20 HIS QB 1 23 ARG QB . . 3.960 4.154 2.259 5.147 1.187 2 9 "[ +* * ** 1 ** . - *]" 1
529 1 20 HIS QB 1 23 ARG HG2 . . 4.770 3.483 2.119 4.589 . 0 0 "[ . 1 . 2 ]" 1
530 1 20 HIS QB 1 24 ALA H . . 5.500 4.801 3.922 5.267 . 0 0 "[ . 1 . 2 ]" 1
531 1 21 PHE HA 1 21 PHE QD . . 3.800 2.939 2.738 3.155 . 0 0 "[ . 1 . 2 ]" 1
532 1 21 PHE HA 1 24 ALA H . . 5.160 3.945 3.456 4.650 . 0 0 "[ . 1 . 2 ]" 1
533 1 21 PHE HA 1 24 ALA MB . . 4.290 2.458 2.169 2.643 . 0 0 "[ . 1 . 2 ]" 1
534 1 21 PHE QB 1 22 GLY H . . 4.830 2.523 2.270 2.767 . 0 0 "[ . 1 . 2 ]" 1
535 1 21 PHE QB 1 70 VAL HB . . 4.100 3.224 2.877 3.766 . 0 0 "[ . 1 . 2 ]" 1
536 1 21 PHE QB 1 70 VAL MG1 . . 5.170 2.716 2.245 3.221 . 0 0 "[ . 1 . 2 ]" 1
537 1 21 PHE QB 1 73 ILE HA . . 3.800 2.530 2.102 2.856 . 0 0 "[ . 1 . 2 ]" 1
538 1 21 PHE QB 1 73 ILE HB . . 4.690 2.837 2.539 3.095 . 0 0 "[ . 1 . 2 ]" 1
539 1 21 PHE QB 1 73 ILE MD . . 4.050 2.374 2.063 2.552 . 0 0 "[ . 1 . 2 ]" 1
540 1 21 PHE QB 1 73 ILE HG13 . . 4.830 2.144 2.013 2.248 . 0 0 "[ . 1 . 2 ]" 1
541 1 21 PHE QB 1 74 GLY H . . 4.470 4.012 3.246 4.430 . 0 0 "[ . 1 . 2 ]" 1
542 1 21 PHE QD 1 22 GLY HA2 . . 4.350 2.949 2.638 3.525 . 0 0 "[ . 1 . 2 ]" 1
543 1 21 PHE QD 1 27 PHE QE . . 4.280 2.710 2.295 3.035 . 0 0 "[ . 1 . 2 ]" 1
544 1 21 PHE QD 1 27 PHE HZ . . 4.330 3.817 3.616 4.089 . 0 0 "[ . 1 . 2 ]" 1
545 1 21 PHE QD 1 56 VAL QG . . 4.160 3.403 2.904 3.722 . 0 0 "[ . 1 . 2 ]" 1
546 1 21 PHE QD 1 70 VAL HB . . 4.350 4.331 3.725 5.086 0.736 21 1 "[ . 1 . 2+ ]" 1
547 1 21 PHE QD 1 70 VAL MG1 . . 3.310 2.640 2.225 3.131 . 0 0 "[ . 1 . 2 ]" 1
548 1 21 PHE QD 1 70 VAL MG2 . . 4.210 4.631 4.230 5.011 0.801 21 7 "[ -*. * 1 . * *+*]" 1
549 1 21 PHE QD 1 73 ILE HB . . 4.390 4.574 4.068 4.901 0.511 15 1 "[ . 1 + 2 ]" 1
550 1 21 PHE QD 1 73 ILE MD . . 4.170 2.983 2.711 3.210 . 0 0 "[ . 1 . 2 ]" 1
551 1 21 PHE QD 1 73 ILE HG13 . . 5.310 3.231 2.515 3.646 . 0 0 "[ . 1 . 2 ]" 1
552 1 21 PHE QD 1 77 ALA MB . . 3.910 2.198 2.116 2.435 . 0 0 "[ . 1 . 2 ]" 1
553 1 21 PHE QE 1 22 GLY H . . 5.500 5.242 4.700 5.566 0.066 2 0 "[ . 1 . 2 ]" 1
554 1 21 PHE QE 1 27 PHE HZ . . 3.920 3.346 2.988 3.756 . 0 0 "[ . 1 . 2 ]" 1
555 1 21 PHE QE 1 56 VAL H . . 5.500 6.370 5.982 6.859 1.359 5 21 [****+********-*****2**] 1
556 1 21 PHE QE 1 56 VAL HB . . 3.610 4.612 4.279 4.955 1.345 10 22 [*******-*+************] 1
557 1 21 PHE QE 1 56 VAL QG . . 3.470 2.448 2.178 2.695 . 0 0 "[ . 1 . 2 ]" 1
558 1 21 PHE QE 1 57 PRO HA . . 4.700 3.639 3.335 3.976 . 0 0 "[ . 1 . 2 ]" 1
559 1 21 PHE QE 1 57 PRO QD . . 3.570 3.987 3.588 4.321 0.751 15 10 "[**- ** ** * + 2 *]" 1
560 1 21 PHE QE 1 57 PRO HG3 . . 5.060 3.696 2.404 5.009 . 0 0 "[ . 1 . 2 ]" 1
561 1 21 PHE QE 1 60 VAL QG . . 3.900 2.873 2.409 3.166 . 0 0 "[ . 1 . 2 ]" 1
562 1 21 PHE QE 1 68 VAL QG . . 3.660 3.052 2.283 3.703 0.043 17 0 "[ . 1 . 2 ]" 1
563 1 21 PHE QE 1 73 ILE MD . . 4.260 3.830 3.492 4.188 . 0 0 "[ . 1 . 2 ]" 1
564 1 21 PHE QE 1 77 ALA MB . . 3.700 2.560 2.063 3.051 . 0 0 "[ . 1 . 2 ]" 1
565 1 21 PHE QE 1 80 ALA MB . . 3.830 4.016 3.815 4.056 0.226 8 0 "[ . 1 . 2 ]" 1
566 1 21 PHE HZ 1 56 VAL QG . . 3.580 3.241 2.688 3.726 0.146 19 0 "[ . 1 . 2 ]" 1
567 1 21 PHE HZ 1 57 PRO HA . . 3.520 3.270 2.496 3.676 0.156 5 0 "[ . 1 . 2 ]" 1
568 1 21 PHE HZ 1 60 VAL QG . . 3.690 2.077 1.964 2.439 . 0 0 "[ . 1 . 2 ]" 1
569 1 21 PHE HZ 1 80 ALA MB . . 4.590 4.454 3.839 4.724 0.134 17 0 "[ . 1 . 2 ]" 1
570 1 22 GLY H 1 23 ARG H . . 4.380 2.976 2.822 3.253 . 0 0 "[ . 1 . 2 ]" 1
571 1 22 GLY H 1 24 ALA H . . 5.500 4.727 4.420 5.317 . 0 0 "[ . 1 . 2 ]" 1
572 1 22 GLY HA2 1 24 ALA H . . 4.800 4.207 3.909 4.588 . 0 0 "[ . 1 . 2 ]" 1
573 1 22 GLY HA2 1 56 VAL QG . . 4.350 2.430 2.049 3.272 . 0 0 "[ . 1 . 2 ]" 1
574 1 22 GLY HA3 1 24 ALA H . . 5.170 4.977 4.760 5.281 0.111 11 0 "[ . 1 . 2 ]" 1
575 1 22 GLY HA3 1 56 VAL QG . . 5.260 3.741 3.409 4.593 . 0 0 "[ . 1 . 2 ]" 1
576 1 23 ARG H 1 24 ALA H . . 3.670 2.463 2.004 3.272 . 0 0 "[ . 1 . 2 ]" 1
577 1 23 ARG HA 1 23 ARG QD . . 4.340 3.715 2.067 4.230 . 0 0 "[ . 1 . 2 ]" 1
578 1 23 ARG HA 1 23 ARG HG3 . . 3.500 3.776 2.290 4.268 0.768 13 9 "[* * . ** *+ * 2-*]" 1
579 1 23 ARG QB 1 24 ALA H . . 5.250 4.041 3.807 4.143 . 0 0 "[ . 1 . 2 ]" 1
580 1 23 ARG QD 1 24 ALA H . . 5.500 5.004 4.054 5.616 0.116 19 0 "[ . 1 . 2 ]" 1
581 1 23 ARG HG3 1 24 ALA H . . 5.500 4.936 3.962 6.054 0.554 4 1 "[ +. 1 . 2 ]" 1
582 1 24 ALA H 1 24 ALA MB . . 3.040 2.241 1.986 2.411 . 0 0 "[ . 1 . 2 ]" 1
583 1 24 ALA H 1 25 PRO HD2 . . 5.420 4.943 4.847 5.028 . 0 0 "[ . 1 . 2 ]" 1
584 1 24 ALA HA 1 25 PRO HD2 . . 3.190 2.278 2.163 2.488 . 0 0 "[ . 1 . 2 ]" 1
585 1 24 ALA HA 1 25 PRO HD3 . . 3.130 2.506 2.162 2.743 . 0 0 "[ . 1 . 2 ]" 1
586 1 24 ALA MB 1 25 PRO HD2 . . 4.320 2.914 2.542 3.412 . 0 0 "[ . 1 . 2 ]" 1
587 1 24 ALA MB 1 25 PRO HD3 . . 4.720 3.860 3.436 4.193 . 0 0 "[ . 1 . 2 ]" 1
588 1 24 ALA MB 1 26 TYR H . . 3.480 2.796 2.574 3.018 . 0 0 "[ . 1 . 2 ]" 1
589 1 24 ALA MB 1 27 PHE QE . . 3.750 2.504 2.153 3.078 . 0 0 "[ . 1 . 2 ]" 1
590 1 24 ALA MB 1 27 PHE HZ . . 4.840 3.379 2.686 3.872 . 0 0 "[ . 1 . 2 ]" 1
591 1 25 PRO HA 1 45 ASN QB . . 4.370 2.933 2.589 3.191 . 0 0 "[ . 1 . 2 ]" 1
592 1 25 PRO HB2 1 26 TYR H . . 4.200 3.742 3.654 3.858 . 0 0 "[ . 1 . 2 ]" 1
593 1 25 PRO HB2 1 26 TYR QD . . 3.420 2.832 2.662 2.958 . 0 0 "[ . 1 . 2 ]" 1
594 1 25 PRO HB2 1 26 TYR QE . . 3.540 2.686 2.437 3.067 . 0 0 "[ . 1 . 2 ]" 1
595 1 25 PRO HB3 1 26 TYR H . . 4.690 4.432 4.309 4.498 . 0 0 "[ . 1 . 2 ]" 1
596 1 25 PRO HB3 1 26 TYR QD . . 4.750 4.291 4.240 4.321 . 0 0 "[ . 1 . 2 ]" 1
597 1 25 PRO HD2 1 26 TYR H . . 4.640 2.919 2.611 3.244 . 0 0 "[ . 1 . 2 ]" 1
598 1 25 PRO HD3 1 26 TYR H . . 4.570 4.060 3.842 4.246 . 0 0 "[ . 1 . 2 ]" 1
599 1 25 PRO HG2 1 26 TYR H . . 4.040 2.894 2.607 3.171 . 0 0 "[ . 1 . 2 ]" 1
600 1 25 PRO HG2 1 26 TYR QD . . 3.250 2.147 2.051 2.545 . 0 0 "[ . 1 . 2 ]" 1
601 1 25 PRO HG3 1 26 TYR H . . 4.390 4.356 4.106 4.490 0.100 12 0 "[ . 1 . 2 ]" 1
602 1 25 PRO HG3 1 26 TYR QD . . 4.100 3.676 3.234 4.050 . 0 0 "[ . 1 . 2 ]" 1
603 1 25 PRO HG3 1 26 TYR QE . . 5.110 3.923 3.258 4.374 . 0 0 "[ . 1 . 2 ]" 1
604 1 26 TYR H 1 26 TYR HB2 . . 3.710 2.784 2.532 3.059 . 0 0 "[ . 1 . 2 ]" 1
605 1 26 TYR H 1 26 TYR HB3 . . 3.980 3.853 3.688 3.955 . 0 0 "[ . 1 . 2 ]" 1
606 1 26 TYR H 1 26 TYR QD . . 3.760 3.145 2.768 3.638 . 0 0 "[ . 1 . 2 ]" 1
607 1 26 TYR H 1 26 TYR QE . . 5.310 5.061 4.706 5.426 0.116 5 0 "[ . 1 . 2 ]" 1
608 1 26 TYR H 1 27 PHE H . . 4.510 4.356 4.264 4.457 . 0 0 "[ . 1 . 2 ]" 1
609 1 26 TYR H 1 27 PHE HA . . 5.500 4.745 4.652 4.859 . 0 0 "[ . 1 . 2 ]" 1
610 1 26 TYR H 1 45 ASN H . . 5.500 4.679 4.316 5.460 . 0 0 "[ . 1 . 2 ]" 1
611 1 26 TYR HA 1 26 TYR QD . . 3.210 3.046 2.701 3.357 0.147 8 0 "[ . 1 . 2 ]" 1
612 1 26 TYR HA 1 27 PHE H . . 3.140 2.363 2.246 2.565 . 0 0 "[ . 1 . 2 ]" 1
613 1 26 TYR HA 1 44 GLU HA . . 3.260 2.610 2.238 2.899 . 0 0 "[ . 1 . 2 ]" 1
614 1 26 TYR HA 1 45 ASN H . . 3.260 2.705 2.254 3.324 0.064 2 0 "[ . 1 . 2 ]" 1
615 1 26 TYR HA 1 45 ASN QB . . 4.090 3.060 2.673 3.568 . 0 0 "[ . 1 . 2 ]" 1
616 1 26 TYR HB2 1 27 PHE H . . 4.130 3.674 3.193 4.181 0.051 5 0 "[ . 1 . 2 ]" 1
617 1 26 TYR HB2 1 42 VAL QG . . 4.300 3.691 3.079 4.393 0.093 7 0 "[ . 1 . 2 ]" 1
618 1 26 TYR HB3 1 27 PHE H . . 3.720 2.670 2.415 3.204 . 0 0 "[ . 1 . 2 ]" 1
619 1 26 TYR HB3 1 42 VAL QG . . 3.300 2.885 2.256 3.415 0.115 19 0 "[ . 1 . 2 ]" 1
620 1 26 TYR HB3 1 44 GLU HA . . 3.910 3.577 2.861 4.078 0.168 5 0 "[ . 1 . 2 ]" 1
621 1 26 TYR HB3 1 45 ASN H . . 5.500 4.839 4.182 5.476 . 0 0 "[ . 1 . 2 ]" 1
622 1 26 TYR QD 1 27 PHE H . . 4.480 4.043 3.769 4.298 . 0 0 "[ . 1 . 2 ]" 1
623 1 26 TYR QD 1 42 VAL QG . . 4.410 3.432 3.076 3.813 . 0 0 "[ . 1 . 2 ]" 1
624 1 26 TYR QD 1 44 GLU H . . 4.430 3.917 3.532 4.390 . 0 0 "[ . 1 . 2 ]" 1
625 1 26 TYR QD 1 44 GLU HA . . 2.770 2.164 2.005 2.470 . 0 0 "[ . 1 . 2 ]" 1
626 1 26 TYR QD 1 44 GLU HB2 . . 5.030 4.656 4.313 4.950 . 0 0 "[ . 1 . 2 ]" 1
627 1 26 TYR QD 1 44 GLU HG2 . . 4.920 3.204 2.237 4.246 . 0 0 "[ . 1 . 2 ]" 1
628 1 26 TYR QD 1 44 GLU HG3 . . 3.630 3.220 2.231 4.359 0.729 13 1 "[ . 1 + . 2 ]" 1
629 1 26 TYR QD 1 45 ASN H . . 4.520 4.027 3.681 4.282 . 0 0 "[ . 1 . 2 ]" 1
630 1 26 TYR QE 1 44 GLU H . . 5.140 4.942 4.350 5.272 0.132 2 0 "[ . 1 . 2 ]" 1
631 1 26 TYR QE 1 44 GLU HA . . 3.510 3.520 3.089 3.680 0.170 8 0 "[ . 1 . 2 ]" 1
632 1 26 TYR QE 1 44 GLU HB3 . . 4.550 3.908 2.729 4.692 0.142 21 0 "[ . 1 . 2 ]" 1
633 1 26 TYR QE 1 44 GLU HG2 . . 3.470 2.464 2.039 3.532 0.062 1 0 "[ . 1 . 2 ]" 1
634 1 26 TYR QE 1 44 GLU HG3 . . 3.400 3.011 2.143 3.647 0.247 9 0 "[ . 1 . 2 ]" 1
635 1 26 TYR QE 1 45 ASN H . . 5.500 4.899 4.526 5.264 . 0 0 "[ . 1 . 2 ]" 1
636 1 27 PHE H 1 27 PHE QB . . 3.380 2.667 2.541 2.773 . 0 0 "[ . 1 . 2 ]" 1
637 1 27 PHE H 1 27 PHE QD . . 4.630 3.899 3.705 4.108 . 0 0 "[ . 1 . 2 ]" 1
638 1 27 PHE H 1 28 ALA MB . . 5.500 4.966 4.735 5.277 . 0 0 "[ . 1 . 2 ]" 1
639 1 27 PHE H 1 42 VAL QG . . 4.320 4.015 3.282 4.384 0.064 20 0 "[ . 1 . 2 ]" 1
640 1 27 PHE H 1 43 GLU HB2 . . 5.240 4.002 3.074 4.809 . 0 0 "[ . 1 . 2 ]" 1
641 1 27 PHE H 1 44 GLU H . . 5.500 5.103 4.818 5.541 0.041 16 0 "[ . 1 . 2 ]" 1
642 1 27 PHE H 1 44 GLU HA . . 3.970 3.877 3.368 4.097 0.127 16 0 "[ . 1 . 2 ]" 1
643 1 27 PHE H 1 45 ASN H . . 4.630 4.551 4.321 4.684 0.054 20 0 "[ . 1 . 2 ]" 1
644 1 27 PHE H 1 45 ASN HA . . 5.500 4.748 4.378 5.031 . 0 0 "[ . 1 . 2 ]" 1
645 1 27 PHE HA 1 27 PHE QD . . 3.410 2.179 2.071 2.370 . 0 0 "[ . 1 . 2 ]" 1
646 1 27 PHE HA 1 28 ALA H . . 2.960 2.172 2.125 2.262 . 0 0 "[ . 1 . 2 ]" 1
647 1 27 PHE HA 1 28 ALA MB . . 4.140 4.051 3.961 4.148 0.008 20 0 "[ . 1 . 2 ]" 1
648 1 27 PHE HA 1 29 PHE H . . 5.040 5.027 4.785 5.431 0.391 20 0 "[ . 1 . 2 ]" 1
649 1 27 PHE QB 1 28 ALA H . . 4.070 3.527 3.252 3.718 . 0 0 "[ . 1 . 2 ]" 1
650 1 27 PHE QB 1 28 ALA MB . . 4.410 4.745 4.617 4.900 0.490 5 0 "[ . 1 . 2 ]" 1
651 1 27 PHE QB 1 29 PHE H . . 3.790 3.899 3.506 4.302 0.512 20 1 "[ . 1 . + ]" 1
652 1 27 PHE QB 1 29 PHE QD . . 3.570 3.442 3.400 3.488 . 0 0 "[ . 1 . 2 ]" 1
653 1 27 PHE QB 1 59 PHE QE . . 4.240 3.120 2.804 3.568 . 0 0 "[ . 1 . 2 ]" 1
654 1 27 PHE QB 1 59 PHE HZ . . 4.360 4.364 4.185 4.406 0.046 16 0 "[ . 1 . 2 ]" 1
655 1 27 PHE QD 1 28 ALA H . . 4.810 3.943 3.793 4.129 . 0 0 "[ . 1 . 2 ]" 1
656 1 27 PHE QD 1 45 ASN HA . . 4.390 3.673 3.076 4.178 . 0 0 "[ . 1 . 2 ]" 1
657 1 27 PHE QD 1 45 ASN QB . . 5.000 4.168 2.997 4.767 . 0 0 "[ . 1 . 2 ]" 1
658 1 27 PHE QD 1 59 PHE QE . . 3.700 2.106 2.031 2.222 . 0 0 "[ . 1 . 2 ]" 1
659 1 27 PHE QD 1 60 VAL QG . . 4.570 2.360 2.032 2.749 . 0 0 "[ . 1 . 2 ]" 1
660 1 27 PHE QE 1 56 VAL QG . . 3.510 2.429 2.140 2.869 . 0 0 "[ . 1 . 2 ]" 1
661 1 27 PHE QE 1 59 PHE QD . . 3.000 2.925 2.510 3.133 0.133 19 0 "[ . 1 . 2 ]" 1
662 1 27 PHE QE 1 60 VAL QG . . 3.870 2.526 2.081 2.921 . 0 0 "[ . 1 . 2 ]" 1
663 1 27 PHE HZ 1 56 VAL QG . . 3.260 2.285 1.956 2.717 . 0 0 "[ . 1 . 2 ]" 1
664 1 27 PHE HZ 1 60 VAL QG . . 3.640 3.598 3.257 3.780 0.140 17 0 "[ . 1 . 2 ]" 1
665 1 28 ALA H 1 28 ALA MB . . 3.100 2.234 2.135 2.304 . 0 0 "[ . 1 . 2 ]" 1
666 1 28 ALA H 1 29 PHE QD . . 5.500 6.000 5.830 6.082 0.582 18 13 "[ *******-1 * .* + 2**]" 1
667 1 28 ALA H 1 42 VAL HA . . 5.000 4.376 4.045 4.756 . 0 0 "[ . 1 . 2 ]" 1
668 1 28 ALA HA 1 29 PHE H . . 2.880 2.266 2.147 2.393 . 0 0 "[ . 1 . 2 ]" 1
669 1 28 ALA HA 1 42 VAL QG . . 3.650 2.792 1.944 3.503 . 0 0 "[ . 1 . 2 ]" 1
670 1 28 ALA MB 1 29 PHE H . . 4.120 3.624 3.486 3.705 . 0 0 "[ . 1 . 2 ]" 1
671 1 28 ALA MB 1 30 VAL H . . 5.500 4.194 3.877 5.072 . 0 0 "[ . 1 . 2 ]" 1
672 1 28 ALA MB 1 30 VAL QG . . 3.050 2.657 2.366 2.852 . 0 0 "[ . 1 . 2 ]" 1
673 1 28 ALA MB 1 41 SER H . . 5.500 4.491 3.891 4.963 . 0 0 "[ . 1 . 2 ]" 1
674 1 29 PHE H 1 29 PHE HB2 . . 3.580 2.198 2.079 2.323 . 0 0 "[ . 1 . 2 ]" 1
675 1 29 PHE H 1 29 PHE HB3 . . 3.940 3.405 3.346 3.511 . 0 0 "[ . 1 . 2 ]" 1
676 1 29 PHE H 1 29 PHE QD . . 3.770 3.855 3.801 3.881 0.111 18 0 "[ . 1 . 2 ]" 1
677 1 29 PHE H 1 30 VAL H . . 4.980 4.152 4.023 4.545 . 0 0 "[ . 1 . 2 ]" 1
678 1 29 PHE H 1 30 VAL QG . . 4.520 4.319 4.094 4.456 . 0 0 "[ . 1 . 2 ]" 1
679 1 29 PHE H 1 41 SER QB . . 4.240 3.083 2.579 3.459 . 0 0 "[ . 1 . 2 ]" 1
680 1 29 PHE H 1 42 VAL H . . 5.500 4.925 4.619 5.201 . 0 0 "[ . 1 . 2 ]" 1
681 1 29 PHE H 1 42 VAL QG . . 5.500 4.351 3.410 4.976 . 0 0 "[ . 1 . 2 ]" 1
682 1 29 PHE H 1 63 LYS QE . . 5.500 5.664 5.261 6.316 0.816 13 1 "[ . 1 + . 2 ]" 1
683 1 29 PHE HA 1 29 PHE QD . . 3.140 2.328 2.125 2.461 . 0 0 "[ . 1 . 2 ]" 1
684 1 29 PHE HA 1 30 VAL H . . 2.990 2.200 2.142 2.301 . 0 0 "[ . 1 . 2 ]" 1
685 1 29 PHE HA 1 30 VAL HA . . 4.580 4.506 4.478 4.550 . 0 0 "[ . 1 . 2 ]" 1
686 1 29 PHE HA 1 30 VAL QG . . 4.090 3.708 3.280 3.970 . 0 0 "[ . 1 . 2 ]" 1
687 1 29 PHE HB2 1 30 VAL H . . 4.830 4.619 4.321 4.701 . 0 0 "[ . 1 . 2 ]" 1
688 1 29 PHE HB2 1 41 SER QB . . 3.900 2.663 2.247 2.997 . 0 0 "[ . 1 . 2 ]" 1
689 1 29 PHE HB2 1 63 LYS HB3 . . 4.350 4.601 3.981 5.072 0.722 13 3 "[ * 1- + . 2 ]" 1
690 1 29 PHE HB3 1 30 VAL H . . 4.360 3.981 3.226 4.168 . 0 0 "[ . 1 . 2 ]" 1
691 1 29 PHE HB3 1 41 SER QB . . 4.490 2.962 2.647 3.341 . 0 0 "[ . 1 . 2 ]" 1
692 1 29 PHE QD 1 30 VAL H . . 4.610 3.631 2.887 3.924 . 0 0 "[ . 1 . 2 ]" 1
693 1 29 PHE QD 1 60 VAL HB . . 4.020 4.536 4.437 4.681 0.661 5 9 "[* -+** ** . * 2* ]" 1
694 1 29 PHE QD 1 60 VAL QG . . 2.970 3.112 3.063 3.143 0.173 5 0 "[ . 1 . 2 ]" 1
695 1 29 PHE QD 1 63 LYS HB2 . . 3.480 3.431 3.129 3.631 0.151 14 0 "[ . 1 . 2 ]" 1
696 1 29 PHE QD 1 63 LYS QE . . 3.410 3.264 2.423 3.522 0.112 13 0 "[ . 1 . 2 ]" 1
697 1 29 PHE QD 1 63 LYS QG . . 4.210 3.125 2.744 4.223 0.013 14 0 "[ . 1 . 2 ]" 1
698 1 29 PHE QD 1 65 ALA MB . . 3.260 3.431 3.134 3.475 0.215 12 0 "[ . 1 . 2 ]" 1
699 1 29 PHE QD 1 86 VAL QG . . 3.750 5.517 5.341 5.774 2.024 13 22 [************+-********] 1
700 1 29 PHE QE 1 60 VAL H . . 5.220 4.815 4.660 5.099 . 0 0 "[ . 1 . 2 ]" 1
701 1 29 PHE QE 1 60 VAL HB . . 3.110 2.253 2.134 2.406 . 0 0 "[ . 1 . 2 ]" 1
702 1 29 PHE QE 1 60 VAL QG . . 3.370 2.056 2.009 2.129 . 0 0 "[ . 1 . 2 ]" 1
703 1 29 PHE QE 1 68 VAL HB . . 3.750 5.890 5.568 6.072 2.322 17 22 [**-*************+*****] 1
704 1 29 PHE QE 1 68 VAL QG . . 3.770 2.976 2.573 3.127 . 0 0 "[ . 1 . 2 ]" 1
705 1 29 PHE QE 1 80 ALA MB . . 4.260 6.995 6.565 7.495 3.235 13 22 [***********-+*********] 1
706 1 29 PHE QE 1 86 VAL QG . . 3.080 3.952 3.786 4.151 1.071 13 22 [************+***-*****] 1
707 1 29 PHE HZ 1 60 VAL HB . . 4.180 2.509 2.254 2.801 . 0 0 "[ . 1 . 2 ]" 1
708 1 29 PHE HZ 1 60 VAL QG . . 4.230 3.237 3.073 3.369 . 0 0 "[ . 1 . 2 ]" 1
709 1 29 PHE HZ 1 68 VAL HB . . 3.940 6.715 6.233 7.056 3.116 6 22 [*****+*************-**] 1
710 1 29 PHE HZ 1 68 VAL QG . . 3.140 3.464 3.081 3.725 0.585 6 4 "[ .+ -1 * * 2 ]" 1
711 1 29 PHE HZ 1 80 ALA MB . . 4.250 6.699 6.187 7.254 3.004 11 22 [********-*+***********] 1
712 1 29 PHE HZ 1 86 VAL QG . . 3.000 4.005 3.895 4.080 1.080 4 22 [***+*********-********] 1
713 1 30 VAL H 1 30 VAL HB . . 3.460 2.582 2.339 2.779 . 0 0 "[ . 1 . 2 ]" 1
714 1 30 VAL H 1 30 VAL QG . . 3.350 2.241 2.003 2.902 . 0 0 "[ . 1 . 2 ]" 1
715 1 30 VAL H 1 31 LYS H . . 5.100 4.597 4.336 4.687 . 0 0 "[ . 1 . 2 ]" 1
716 1 30 VAL H 1 41 SER H . . 5.500 4.635 4.322 4.808 . 0 0 "[ . 1 . 2 ]" 1
717 1 30 VAL HA 1 30 VAL QG . . 3.060 2.162 2.106 2.221 . 0 0 "[ . 1 . 2 ]" 1
718 1 30 VAL HA 1 31 LYS H . . 3.030 2.407 2.229 2.573 . 0 0 "[ . 1 . 2 ]" 1
719 1 30 VAL HA 1 31 LYS QE . . 2.870 5.887 4.467 6.365 3.495 10 22 [*-*******+************] 1
720 1 30 VAL HA 1 31 LYS HG3 . . 4.350 3.709 3.268 4.228 . 0 0 "[ . 1 . 2 ]" 1
721 1 30 VAL HA 1 41 SER H . . 2.990 3.035 2.727 3.115 0.125 4 0 "[ . 1 . 2 ]" 1
722 1 30 VAL HA 1 41 SER QB . . 3.630 4.367 3.660 4.708 1.078 19 16 "[* ******* **-** *+* ]" 1
723 1 30 VAL HB 1 31 LYS H . . 5.070 3.742 3.484 4.031 . 0 0 "[ . 1 . 2 ]" 1
724 1 30 VAL QG 1 31 LYS H . . 3.500 2.227 2.004 2.512 . 0 0 "[ . 1 . 2 ]" 1
725 1 30 VAL QG 1 37 ILE HA . . 3.850 3.171 2.919 3.641 . 0 0 "[ . 1 . 2 ]" 1
726 1 30 VAL QG 1 39 ASP QB . . 4.340 4.674 4.430 5.144 0.804 19 3 "[ -.* 1 . +2 ]" 1
727 1 30 VAL QG 1 40 ILE HA . . 3.660 2.723 2.056 3.138 . 0 0 "[ . 1 . 2 ]" 1
728 1 30 VAL QG 1 41 SER H . . 4.390 3.544 2.781 3.872 . 0 0 "[ . 1 . 2 ]" 1
729 1 30 VAL QG 1 41 SER QB . . 3.890 4.793 4.175 5.075 1.185 4 21 "[***+****** *********-*]" 1
730 1 31 LYS H 1 31 LYS QB . . 3.440 2.483 2.317 2.649 . 0 0 "[ . 1 . 2 ]" 1
731 1 31 LYS H 1 31 LYS QD . . 5.500 4.382 4.121 4.618 . 0 0 "[ . 1 . 2 ]" 1
732 1 31 LYS H 1 31 LYS HG2 . . 5.350 3.529 3.234 3.813 . 0 0 "[ . 1 . 2 ]" 1
733 1 31 LYS H 1 31 LYS HG3 . . 5.500 2.809 2.505 3.105 . 0 0 "[ . 1 . 2 ]" 1
734 1 31 LYS H 1 37 ILE HA . . 5.500 4.603 4.259 5.240 . 0 0 "[ . 1 . 2 ]" 1
735 1 31 LYS H 1 37 ILE MG . . 5.230 3.389 2.993 3.903 . 0 0 "[ . 1 . 2 ]" 1
736 1 31 LYS H 1 38 ALA MB . . 5.500 3.896 3.530 4.339 . 0 0 "[ . 1 . 2 ]" 1
737 1 31 LYS H 1 39 ASP H . . 3.760 2.945 2.714 3.201 . 0 0 "[ . 1 . 2 ]" 1
738 1 31 LYS H 1 39 ASP QB . . 4.640 3.827 3.468 4.271 . 0 0 "[ . 1 . 2 ]" 1
739 1 31 LYS H 1 40 ILE H . . 5.500 5.018 4.857 5.368 . 0 0 "[ . 1 . 2 ]" 1
740 1 31 LYS H 1 41 SER H . . 5.500 4.941 4.508 5.228 . 0 0 "[ . 1 . 2 ]" 1
741 1 31 LYS HA 1 31 LYS QD . . 4.320 3.992 3.483 4.215 . 0 0 "[ . 1 . 2 ]" 1
742 1 31 LYS HA 1 31 LYS QE . . 4.750 3.708 2.991 4.583 . 0 0 "[ . 1 . 2 ]" 1
743 1 31 LYS HA 1 31 LYS HG2 . . 3.920 2.333 2.188 2.453 . 0 0 "[ . 1 . 2 ]" 1
744 1 31 LYS HA 1 31 LYS HG3 . . 4.110 3.276 3.147 3.510 . 0 0 "[ . 1 . 2 ]" 1
745 1 31 LYS HA 1 32 VAL H . . 2.870 2.729 2.606 2.818 . 0 0 "[ . 1 . 2 ]" 1
746 1 31 LYS HA 1 32 VAL QG . . 3.630 3.655 3.317 3.793 0.163 1 0 "[ . 1 . 2 ]" 1
747 1 31 LYS HA 1 39 ASP H . . 5.270 4.970 4.754 5.198 . 0 0 "[ . 1 . 2 ]" 1
748 1 31 LYS QB 1 31 LYS QD . . 3.030 2.305 2.102 2.526 . 0 0 "[ . 1 . 2 ]" 1
749 1 31 LYS QB 1 32 VAL H . . 4.220 2.070 1.903 2.268 . 0 0 "[ . 1 . 2 ]" 1
750 1 31 LYS QB 1 38 ALA MB . . 2.650 2.084 1.927 2.395 . 0 0 "[ . 1 . 2 ]" 1
751 1 31 LYS QB 1 39 ASP H . . 3.470 2.433 2.199 2.824 . 0 0 "[ . 1 . 2 ]" 1
752 1 31 LYS QB 1 39 ASP QB . . 3.520 2.603 2.250 3.199 . 0 0 "[ . 1 . 2 ]" 1
753 1 31 LYS QD 1 32 VAL H . . 4.810 4.376 3.766 4.840 0.030 10 0 "[ . 1 . 2 ]" 1
754 1 31 LYS QD 1 39 ASP H . . 4.330 4.421 4.171 4.485 0.155 19 0 "[ . 1 . 2 ]" 1
755 1 31 LYS QD 1 39 ASP QB . . 3.800 2.465 2.021 3.404 . 0 0 "[ . 1 . 2 ]" 1
756 1 31 LYS QE 1 31 LYS HG2 . . 3.810 2.286 2.088 2.538 . 0 0 "[ . 1 . 2 ]" 1
757 1 31 LYS QE 1 31 LYS HG3 . . 3.890 3.046 2.184 3.402 . 0 0 "[ . 1 . 2 ]" 1
758 1 31 LYS QE 1 41 SER QB . . 4.420 5.159 2.265 6.303 1.883 16 16 "[* * **** * ***+ **-**]" 1
759 1 31 LYS HG2 1 32 VAL H . . 4.960 4.214 4.062 4.505 . 0 0 "[ . 1 . 2 ]" 1
760 1 31 LYS HG2 1 39 ASP QB . . 5.100 4.087 3.595 4.789 . 0 0 "[ . 1 . 2 ]" 1
761 1 31 LYS HG3 1 32 VAL H . . 4.630 4.819 4.691 4.967 0.337 12 0 "[ . 1 . 2 ]" 1
762 1 31 LYS HG3 1 39 ASP QB . . 5.050 2.649 2.164 3.264 . 0 0 "[ . 1 . 2 ]" 1
763 1 32 VAL H 1 32 VAL HB . . 3.400 3.261 2.900 3.522 0.122 4 0 "[ . 1 . 2 ]" 1
764 1 32 VAL H 1 32 VAL QG . . 3.300 2.776 2.407 3.121 . 0 0 "[ . 1 . 2 ]" 1
765 1 32 VAL H 1 33 LYS H . . 4.960 4.130 3.936 4.212 . 0 0 "[ . 1 . 2 ]" 1
766 1 32 VAL H 1 39 ASP H . . 5.500 4.845 4.509 5.070 . 0 0 "[ . 1 . 2 ]" 1
767 1 32 VAL HA 1 32 VAL QG . . 2.700 2.328 2.221 2.494 . 0 0 "[ . 1 . 2 ]" 1
768 1 32 VAL HA 1 33 LYS H . . 2.860 2.189 2.110 2.262 . 0 0 "[ . 1 . 2 ]" 1
769 1 32 VAL HA 1 33 LYS HB3 . . 4.550 4.504 4.304 4.962 0.412 20 0 "[ . 1 . 2 ]" 1
770 1 32 VAL HA 1 36 ALA H . . 4.240 4.263 3.830 4.345 0.105 17 0 "[ . 1 . 2 ]" 1
771 1 32 VAL HA 1 37 ILE H . . 5.500 4.770 4.188 4.948 . 0 0 "[ . 1 . 2 ]" 1
772 1 32 VAL HA 1 37 ILE HA . . 3.380 3.038 2.709 3.314 . 0 0 "[ . 1 . 2 ]" 1
773 1 32 VAL HA 1 38 ALA H . . 3.950 3.796 3.774 3.809 . 0 0 "[ . 1 . 2 ]" 1
774 1 32 VAL HA 1 38 ALA MB . . 3.980 2.895 2.666 3.108 . 0 0 "[ . 1 . 2 ]" 1
775 1 32 VAL HB 1 33 LYS H . . 4.480 4.019 3.613 4.292 . 0 0 "[ . 1 . 2 ]" 1
776 1 32 VAL HB 1 36 ALA H . . 5.500 5.388 4.640 5.569 0.069 21 0 "[ . 1 . 2 ]" 1
777 1 32 VAL QG 1 33 LYS H . . 3.090 2.467 2.150 2.928 . 0 0 "[ . 1 . 2 ]" 1
778 1 32 VAL QG 1 34 ASN QB . . 5.310 4.672 4.045 5.192 . 0 0 "[ . 1 . 2 ]" 1
779 1 32 VAL QG 1 35 ASN H . . 4.280 3.026 2.183 3.904 . 0 0 "[ . 1 . 2 ]" 1
780 1 32 VAL QG 1 35 ASN HA . . 3.350 2.574 2.143 2.998 . 0 0 "[ . 1 . 2 ]" 1
781 1 32 VAL QG 1 35 ASN QB . . 4.730 4.091 3.727 4.418 . 0 0 "[ . 1 . 2 ]" 1
782 1 32 VAL QG 1 36 ALA H . . 3.440 2.722 2.136 2.939 . 0 0 "[ . 1 . 2 ]" 1
783 1 32 VAL QG 1 37 ILE HA . . 3.130 3.533 3.194 3.982 0.852 4 9 "[ * +* * 1** *.- * 2 ]" 1
784 1 32 VAL QG 1 38 ALA H . . 4.500 4.563 4.418 4.676 0.176 4 0 "[ . 1 . 2 ]" 1
785 1 33 LYS H 1 33 LYS HB2 . . 3.810 3.188 2.630 3.569 . 0 0 "[ . 1 . 2 ]" 1
786 1 33 LYS H 1 33 LYS HB3 . . 3.740 2.637 2.459 2.901 . 0 0 "[ . 1 . 2 ]" 1
787 1 33 LYS H 1 33 LYS QE . . 4.720 4.403 3.329 4.857 0.137 14 0 "[ . 1 . 2 ]" 1
788 1 33 LYS H 1 35 ASN HA . . 5.500 4.939 4.502 5.425 . 0 0 "[ . 1 . 2 ]" 1
789 1 33 LYS H 1 36 ALA H . . 3.370 2.785 2.518 3.070 . 0 0 "[ . 1 . 2 ]" 1
790 1 33 LYS H 1 37 ILE HA . . 4.330 4.237 3.895 4.414 0.084 7 0 "[ . 1 . 2 ]" 1
791 1 33 LYS H 1 38 ALA H . . 4.380 3.261 2.670 3.675 . 0 0 "[ . 1 . 2 ]" 1
792 1 33 LYS H 1 38 ALA MB . . 4.040 2.731 2.518 3.069 . 0 0 "[ . 1 . 2 ]" 1
793 1 33 LYS H 1 39 ASP H . . 5.390 5.370 4.872 5.502 0.112 18 0 "[ . 1 . 2 ]" 1
794 1 33 LYS HA 1 33 LYS QG . . 3.740 2.783 2.200 3.209 . 0 0 "[ . 1 . 2 ]" 1
795 1 33 LYS HB3 1 33 LYS QE . . 4.440 3.192 2.019 3.940 . 0 0 "[ . 1 . 2 ]" 1
796 1 33 LYS HB3 1 34 ASN QB . . 5.500 4.366 3.736 4.805 . 0 0 "[ . 1 . 2 ]" 1
797 1 33 LYS HB3 1 36 ALA H . . 5.500 3.850 2.531 4.343 . 0 0 "[ . 1 . 2 ]" 1
798 1 33 LYS HB3 1 36 ALA MB . . 3.710 3.195 2.293 3.866 0.156 8 0 "[ . 1 . 2 ]" 1
799 1 33 LYS HB3 1 38 ALA HA . . 3.400 3.118 2.416 4.314 0.914 15 1 "[ . 1 + 2 ]" 1
800 1 33 LYS HD2 1 33 LYS QE . . 2.740 2.370 2.178 2.505 . 0 0 "[ . 1 . 2 ]" 1
801 1 33 LYS HD2 1 33 LYS QG . . 2.790 2.312 2.106 2.541 . 0 0 "[ . 1 . 2 ]" 1
802 1 33 LYS QE 1 33 LYS QG . . 3.070 2.259 2.053 2.528 . 0 0 "[ . 1 . 2 ]" 1
803 1 33 LYS QE 1 34 ASN HA . . 4.210 4.131 3.381 4.377 0.167 21 0 "[ . 1 . 2 ]" 1
804 1 33 LYS QE 1 34 ASN QB . . 3.290 2.589 1.918 3.353 0.063 15 0 "[ . 1 . 2 ]" 1
805 1 33 LYS QE 1 35 ASN H . . 4.190 4.778 3.067 5.562 1.372 8 17 "[****.**+ * ** ***-*2**]" 1
806 1 33 LYS QG 1 34 ASN QB . . 4.290 2.972 2.511 3.511 . 0 0 "[ . 1 . 2 ]" 1
807 1 34 ASN HA 1 35 ASN H . . 3.610 3.110 2.398 3.636 0.026 15 0 "[ . 1 . 2 ]" 1
808 1 34 ASN QB 1 35 ASN H . . 4.360 3.090 2.004 3.975 . 0 0 "[ . 1 . 2 ]" 1
809 1 34 ASN QB 1 36 ALA H . . 5.500 3.896 3.516 4.526 . 0 0 "[ . 1 . 2 ]" 1
810 1 35 ASN H 1 36 ALA H . . 3.710 2.463 1.625 3.086 . 0 0 "[ . 1 . 2 ]" 1
811 1 35 ASN H 1 36 ALA MB . . 5.430 4.063 3.212 4.906 . 0 0 "[ . 1 . 2 ]" 1
812 1 35 ASN HA 1 35 ASN QB . . 2.800 2.456 2.122 2.582 . 0 0 "[ . 1 . 2 ]" 1
813 1 35 ASN HA 1 36 ALA H . . 3.480 3.118 2.585 3.280 . 0 0 "[ . 1 . 2 ]" 1
814 1 35 ASN HA 1 36 ALA HA . . 4.450 4.493 4.121 4.589 0.139 4 0 "[ . 1 . 2 ]" 1
815 1 35 ASN HA 1 104 LEU QD . . 3.710 3.199 2.471 3.822 0.112 15 0 "[ . 1 . 2 ]" 1
816 1 35 ASN QB 1 36 ALA H . . 4.780 3.751 3.621 4.036 . 0 0 "[ . 1 . 2 ]" 1
817 1 35 ASN QB 1 104 LEU QB . . 4.170 5.020 4.214 5.856 1.686 15 18 "[***** * *-****+ * ****]" 1
818 1 35 ASN QB 1 104 LEU QD . . 4.360 3.790 2.990 4.248 . 0 0 "[ . 1 . 2 ]" 1
819 1 36 ALA H 1 36 ALA MB . . 3.040 2.446 2.304 2.661 . 0 0 "[ . 1 . 2 ]" 1
820 1 36 ALA H 1 37 ILE H . . 5.200 4.437 4.319 4.514 . 0 0 "[ . 1 . 2 ]" 1
821 1 36 ALA H 1 37 ILE HA . . 5.500 5.147 4.930 5.294 . 0 0 "[ . 1 . 2 ]" 1
822 1 36 ALA H 1 38 ALA H . . 5.320 4.449 4.138 4.883 . 0 0 "[ . 1 . 2 ]" 1
823 1 36 ALA H 1 104 LEU QD . . 4.460 4.111 3.634 4.504 0.044 20 0 "[ . 1 . 2 ]" 1
824 1 36 ALA HA 1 37 ILE H . . 3.040 2.633 2.425 2.979 . 0 0 "[ . 1 . 2 ]" 1
825 1 36 ALA HA 1 37 ILE HB . . 4.720 4.651 4.523 4.821 0.101 15 0 "[ . 1 . 2 ]" 1
826 1 36 ALA HA 1 104 LEU QD . . 3.180 3.135 2.703 3.332 0.152 14 0 "[ . 1 . 2 ]" 1
827 1 36 ALA MB 1 37 ILE H . . 3.060 2.362 2.061 2.625 . 0 0 "[ . 1 . 2 ]" 1
828 1 36 ALA MB 1 37 ILE HB . . 4.840 3.908 3.724 4.286 . 0 0 "[ . 1 . 2 ]" 1
829 1 36 ALA MB 1 38 ALA H . . 3.680 2.943 2.594 3.188 . 0 0 "[ . 1 . 2 ]" 1
830 1 37 ILE H 1 37 ILE HB . . 3.030 2.096 1.954 2.272 . 0 0 "[ . 1 . 2 ]" 1
831 1 37 ILE H 1 37 ILE MD . . 3.990 2.331 2.040 2.834 . 0 0 "[ . 1 . 2 ]" 1
832 1 37 ILE H 1 37 ILE QG . . 3.890 3.493 3.316 3.864 . 0 0 "[ . 1 . 2 ]" 1
833 1 37 ILE H 1 37 ILE MG . . 3.790 3.579 3.328 3.742 . 0 0 "[ . 1 . 2 ]" 1
834 1 37 ILE H 1 38 ALA H . . 4.790 2.849 2.163 3.015 . 0 0 "[ . 1 . 2 ]" 1
835 1 37 ILE H 1 39 ASP H . . 5.500 5.561 5.372 5.589 0.089 9 0 "[ . 1 . 2 ]" 1
836 1 37 ILE HA 1 37 ILE QG . . 3.180 2.358 2.213 2.516 . 0 0 "[ . 1 . 2 ]" 1
837 1 37 ILE HA 1 37 ILE MG . . 3.260 2.858 2.714 3.070 . 0 0 "[ . 1 . 2 ]" 1
838 1 37 ILE HA 1 38 ALA H . . 3.450 3.422 3.352 3.487 0.037 4 0 "[ . 1 . 2 ]" 1
839 1 37 ILE HA 1 38 ALA MB . . 4.100 4.236 4.216 4.254 0.154 4 0 "[ . 1 . 2 ]" 1
840 1 37 ILE HA 1 39 ASP H . . 4.290 4.174 4.059 4.277 . 0 0 "[ . 1 . 2 ]" 1
841 1 37 ILE HB 1 37 ILE MD . . 3.580 2.422 2.287 2.560 . 0 0 "[ . 1 . 2 ]" 1
842 1 37 ILE HB 1 38 ALA H . . 4.380 3.415 3.180 3.599 . 0 0 "[ . 1 . 2 ]" 1
843 1 37 ILE MD 1 38 ALA H . . 5.360 4.470 4.350 4.678 . 0 0 "[ . 1 . 2 ]" 1
844 1 37 ILE QG 1 38 ALA H . . 4.970 4.827 4.756 4.923 . 0 0 "[ . 1 . 2 ]" 1
845 1 37 ILE QG 1 39 ASP H . . 5.060 4.836 4.445 5.096 0.036 19 0 "[ . 1 . 2 ]" 1
846 1 37 ILE MG 1 38 ALA H . . 3.520 3.369 3.032 3.582 0.062 15 0 "[ . 1 . 2 ]" 1
847 1 37 ILE MG 1 38 ALA MB . . 4.590 3.884 3.804 4.008 . 0 0 "[ . 1 . 2 ]" 1
848 1 37 ILE MG 1 39 ASP H . . 3.310 2.565 2.344 2.772 . 0 0 "[ . 1 . 2 ]" 1
849 1 37 ILE MG 1 39 ASP HA . . 3.960 3.316 2.664 3.663 . 0 0 "[ . 1 . 2 ]" 1
850 1 37 ILE MG 1 40 ILE QG . . 3.490 2.542 2.146 3.238 . 0 0 "[ . 1 . 2 ]" 1
851 1 38 ALA H 1 38 ALA MB . . 2.990 2.928 2.779 3.047 0.057 20 0 "[ . 1 . 2 ]" 1
852 1 38 ALA H 1 39 ASP H . . 3.810 3.786 3.663 3.881 0.071 4 0 "[ . 1 . 2 ]" 1
853 1 38 ALA MB 1 39 ASP H . . 3.100 2.343 2.149 2.510 . 0 0 "[ . 1 . 2 ]" 1
854 1 38 ALA MB 1 39 ASP QB . . 3.760 2.726 2.380 3.334 . 0 0 "[ . 1 . 2 ]" 1
855 1 39 ASP H 1 39 ASP QB . . 3.810 2.781 2.586 3.039 . 0 0 "[ . 1 . 2 ]" 1
856 1 39 ASP H 1 40 ILE H . . 4.480 4.355 4.263 4.475 . 0 0 "[ . 1 . 2 ]" 1
857 1 39 ASP QB 1 40 ILE H . . 3.950 3.085 2.671 3.573 . 0 0 "[ . 1 . 2 ]" 1
858 1 39 ASP QB 1 41 SER H . . 5.500 5.281 5.020 5.397 . 0 0 "[ . 1 . 2 ]" 1
859 1 40 ILE H 1 40 ILE HB . . 3.380 2.479 2.303 2.869 . 0 0 "[ . 1 . 2 ]" 1
860 1 40 ILE H 1 40 ILE MD . . 4.530 4.358 3.725 4.666 0.136 5 0 "[ . 1 . 2 ]" 1
861 1 40 ILE H 1 40 ILE QG . . 4.300 3.071 2.447 3.358 . 0 0 "[ . 1 . 2 ]" 1
862 1 40 ILE H 1 40 ILE MG . . 4.210 3.735 3.433 3.955 . 0 0 "[ . 1 . 2 ]" 1
863 1 40 ILE H 1 41 SER H . . 4.490 4.364 4.162 4.589 0.099 20 0 "[ . 1 . 2 ]" 1
864 1 40 ILE H 1 41 SER HA . . 5.060 4.987 4.838 5.151 0.091 11 0 "[ . 1 . 2 ]" 1
865 1 40 ILE HA 1 40 ILE QG . . 3.620 2.652 2.216 2.989 . 0 0 "[ . 1 . 2 ]" 1
866 1 40 ILE HA 1 40 ILE MG . . 3.060 2.608 2.421 2.789 . 0 0 "[ . 1 . 2 ]" 1
867 1 40 ILE HA 1 41 SER H . . 2.930 2.269 2.110 2.424 . 0 0 "[ . 1 . 2 ]" 1
868 1 40 ILE HB 1 41 SER H . . 4.470 4.276 3.978 4.602 0.132 7 0 "[ . 1 . 2 ]" 1
869 1 40 ILE MD 1 40 ILE MG . . 3.050 2.064 1.967 2.259 . 0 0 "[ . 1 . 2 ]" 1
870 1 40 ILE QG 1 41 SER H . . 4.760 4.512 3.847 4.806 0.046 2 0 "[ . 1 . 2 ]" 1
871 1 40 ILE MG 1 41 SER H . . 3.350 2.731 2.298 3.335 . 0 0 "[ . 1 . 2 ]" 1
872 1 40 ILE MG 1 41 SER HA . . 3.570 3.392 2.811 3.688 0.118 2 0 "[ . 1 . 2 ]" 1
873 1 40 ILE MG 1 41 SER QB . . 5.260 4.328 3.972 4.666 . 0 0 "[ . 1 . 2 ]" 1
874 1 40 ILE MG 1 42 VAL H . . 5.180 2.875 2.227 3.791 . 0 0 "[ . 1 . 2 ]" 1
875 1 41 SER H 1 41 SER QB . . 3.380 2.519 2.298 3.038 . 0 0 "[ . 1 . 2 ]" 1
876 1 41 SER H 1 42 VAL H . . 4.830 3.764 3.217 4.330 . 0 0 "[ . 1 . 2 ]" 1
877 1 41 SER H 1 42 VAL QG . . 5.500 4.166 3.117 4.916 . 0 0 "[ . 1 . 2 ]" 1
878 1 41 SER HA 1 42 VAL H . . 2.770 2.333 2.197 2.492 . 0 0 "[ . 1 . 2 ]" 1
879 1 41 SER HA 1 42 VAL HB . . 4.500 4.925 4.409 5.222 0.722 11 8 "[* . *+ **-* 2* ]" 1
880 1 41 SER HA 1 42 VAL QG . . 4.150 3.900 3.555 4.152 0.002 10 0 "[ . 1 . 2 ]" 1
881 1 41 SER HA 1 43 GLU H . . 4.710 4.709 4.348 4.822 0.112 3 0 "[ . 1 . 2 ]" 1
882 1 41 SER QB 1 42 VAL H . . 3.870 3.780 2.687 4.078 0.208 2 0 "[ . 1 . 2 ]" 1
883 1 42 VAL H 1 42 VAL HB . . 3.480 2.882 2.501 3.232 . 0 0 "[ . 1 . 2 ]" 1
884 1 42 VAL H 1 42 VAL QG . . 3.290 2.278 1.933 2.926 . 0 0 "[ . 1 . 2 ]" 1
885 1 42 VAL H 1 43 GLU H . . 4.660 3.761 3.057 4.076 . 0 0 "[ . 1 . 2 ]" 1
886 1 42 VAL HA 1 42 VAL QG . . 2.590 2.236 2.123 2.360 . 0 0 "[ . 1 . 2 ]" 1
887 1 42 VAL HA 1 43 GLU H . . 2.870 2.209 2.024 2.410 . 0 0 "[ . 1 . 2 ]" 1
888 1 42 VAL HA 1 43 GLU QG . . 4.310 4.014 3.921 4.157 . 0 0 "[ . 1 . 2 ]" 1
889 1 42 VAL HB 1 43 GLU H . . 4.520 4.463 4.281 4.599 0.079 8 0 "[ . 1 . 2 ]" 1
890 1 42 VAL QG 1 43 GLU H . . 3.980 3.467 3.170 3.711 . 0 0 "[ . 1 . 2 ]" 1
891 1 42 VAL QG 1 44 GLU H . . 5.500 5.074 4.626 5.439 . 0 0 "[ . 1 . 2 ]" 1
892 1 42 VAL QG 1 44 GLU HA . . 4.920 4.851 4.564 5.010 0.090 17 0 "[ . 1 . 2 ]" 1
893 1 43 GLU H 1 43 GLU HB2 . . 3.630 2.517 2.252 2.733 . 0 0 "[ . 1 . 2 ]" 1
894 1 43 GLU H 1 43 GLU HB3 . . 4.050 3.642 3.503 3.761 . 0 0 "[ . 1 . 2 ]" 1
895 1 43 GLU H 1 43 GLU QG . . 3.670 2.439 2.097 2.812 . 0 0 "[ . 1 . 2 ]" 1
896 1 43 GLU H 1 44 GLU H . . 4.880 4.574 4.475 4.687 . 0 0 "[ . 1 . 2 ]" 1
897 1 43 GLU H 1 44 GLU HA . . 5.500 5.370 4.969 5.530 0.030 6 0 "[ . 1 . 2 ]" 1
898 1 43 GLU HA 1 43 GLU QG . . 3.060 2.870 2.257 3.198 0.138 19 0 "[ . 1 . 2 ]" 1
899 1 43 GLU HA 1 44 GLU H . . 2.710 2.322 2.141 2.581 . 0 0 "[ . 1 . 2 ]" 1
900 1 43 GLU HA 1 44 GLU HG3 . . 4.800 4.086 3.132 4.933 0.133 1 0 "[ . 1 . 2 ]" 1
901 1 43 GLU HB2 1 44 GLU H . . 4.280 3.849 3.351 4.387 0.107 12 0 "[ . 1 . 2 ]" 1
902 1 43 GLU HB2 1 59 PHE QE . . 4.450 3.850 3.407 4.225 . 0 0 "[ . 1 . 2 ]" 1
903 1 43 GLU HB3 1 44 GLU H . . 3.710 2.914 2.499 3.666 . 0 0 "[ . 1 . 2 ]" 1
904 1 44 GLU H 1 44 GLU HB2 . . 3.280 2.463 2.195 2.835 . 0 0 "[ . 1 . 2 ]" 1
905 1 44 GLU H 1 44 GLU HB3 . . 3.550 3.557 3.460 3.641 0.091 16 0 "[ . 1 . 2 ]" 1
906 1 44 GLU H 1 44 GLU HG2 . . 3.630 3.496 2.727 3.762 0.132 1 0 "[ . 1 . 2 ]" 1
907 1 44 GLU H 1 44 GLU HG3 . . 3.880 2.509 2.120 3.128 . 0 0 "[ . 1 . 2 ]" 1
908 1 44 GLU H 1 45 ASN H . . 4.740 4.620 4.487 4.735 . 0 0 "[ . 1 . 2 ]" 1
909 1 44 GLU HA 1 44 GLU HG3 . . 3.920 2.926 2.323 3.684 . 0 0 "[ . 1 . 2 ]" 1
910 1 44 GLU HA 1 45 ASN H . . 2.900 2.339 2.154 2.526 . 0 0 "[ . 1 . 2 ]" 1
911 1 44 GLU HB2 1 45 ASN H . . 3.880 3.791 3.262 4.008 0.128 4 0 "[ . 1 . 2 ]" 1
912 1 44 GLU HB3 1 45 ASN H . . 3.790 2.752 2.169 3.222 . 0 0 "[ . 1 . 2 ]" 1
913 1 44 GLU HG3 1 45 ASN H . . 4.720 4.793 4.020 5.397 0.677 13 3 "[ . -1 + .* 2 ]" 1
914 1 45 ASN H 1 45 ASN QB . . 3.530 2.292 2.191 2.522 . 0 0 "[ . 1 . 2 ]" 1
915 1 45 ASN H 1 46 PRO HA . . 5.500 5.149 4.638 5.568 0.068 12 0 "[ . 1 . 2 ]" 1
916 1 45 ASN HA 1 46 PRO QD . . 3.040 2.073 1.998 2.158 . 0 0 "[ . 1 . 2 ]" 1
917 1 45 ASN HA 1 47 LEU H . . 4.670 3.734 3.501 4.324 . 0 0 "[ . 1 . 2 ]" 1
918 1 45 ASN HA 1 59 PHE QE . . 4.110 3.572 3.088 4.292 0.182 12 0 "[ . 1 . 2 ]" 1
919 1 45 ASN QB 1 46 PRO QD . . 3.200 3.572 2.459 3.814 0.614 3 7 "[ + ** -1 . * 2**]" 1
920 1 45 ASN QB 1 47 LEU H . . 5.500 3.358 2.791 4.086 . 0 0 "[ . 1 . 2 ]" 1
921 1 45 ASN QB 1 48 ALA H . . 5.000 3.171 2.530 3.674 . 0 0 "[ . 1 . 2 ]" 1
922 1 45 ASN QB 1 48 ALA MB . . 3.470 2.156 2.026 2.644 . 0 0 "[ . 1 . 2 ]" 1
923 1 46 PRO HB2 1 48 ALA H . . 5.500 5.701 5.418 6.063 0.563 1 2 "[+ . - . 2 ]" 1
924 1 46 PRO QD 1 47 LEU H . . 4.070 2.878 2.464 3.220 . 0 0 "[ . 1 . 2 ]" 1
925 1 46 PRO QD 1 48 ALA H . . 5.500 4.926 4.419 5.165 . 0 0 "[ . 1 . 2 ]" 1
926 1 46 PRO QD 1 59 PHE QB . . 4.890 3.596 3.213 4.204 . 0 0 "[ . 1 . 2 ]" 1
927 1 46 PRO QD 1 59 PHE QD . . 4.530 2.952 2.454 3.541 . 0 0 "[ . 1 . 2 ]" 1
928 1 46 PRO QD 1 59 PHE QE . . 4.060 3.055 2.740 3.637 . 0 0 "[ . 1 . 2 ]" 1
929 1 46 PRO HG2 1 47 LEU QD . . 5.200 2.404 2.009 4.935 . 0 0 "[ . 1 . 2 ]" 1
930 1 46 PRO HG2 1 59 PHE QD . . 4.430 3.743 3.385 4.449 0.019 6 0 "[ . 1 . 2 ]" 1
931 1 46 PRO HG2 1 59 PHE QE . . 4.500 4.797 4.390 5.297 0.797 6 6 "[* .+ *** . -2 ]" 1
932 1 46 PRO HG3 1 47 LEU H . . 4.090 4.447 3.590 4.850 0.760 21 6 "[ . * *1 .*- *2+ ]" 1
933 1 46 PRO HG3 1 59 PHE QE . . 4.510 3.953 3.542 4.707 0.197 9 0 "[ . 1 . 2 ]" 1
934 1 47 LEU H 1 47 LEU HB2 . . 3.590 2.655 2.413 3.220 . 0 0 "[ . 1 . 2 ]" 1
935 1 47 LEU H 1 47 LEU HB3 . . 3.970 3.729 2.628 3.911 . 0 0 "[ . 1 . 2 ]" 1
936 1 47 LEU H 1 47 LEU QD . . 4.550 3.034 2.354 3.800 . 0 0 "[ . 1 . 2 ]" 1
937 1 47 LEU H 1 47 LEU HG . . 3.830 3.990 2.928 4.977 1.147 2 11 "[ +- . ** 1* *** *2**]" 1
938 1 47 LEU H 1 48 ALA H . . 3.450 2.709 2.458 2.925 . 0 0 "[ . 1 . 2 ]" 1
939 1 47 LEU H 1 48 ALA HA . . 5.500 4.192 3.853 4.601 . 0 0 "[ . 1 . 2 ]" 1
940 1 47 LEU H 1 48 ALA MB . . 4.090 4.032 3.753 4.235 0.145 11 0 "[ . 1 . 2 ]" 1
941 1 47 LEU H 1 49 GLN H . . 5.500 5.062 4.823 5.423 . 0 0 "[ . 1 . 2 ]" 1
942 1 47 LEU H 1 56 VAL QG . . 4.570 3.282 2.397 3.725 . 0 0 "[ . 1 . 2 ]" 1
943 1 47 LEU HA 1 47 LEU HB3 . . 3.020 2.496 2.249 3.000 . 0 0 "[ . 1 . 2 ]" 1
944 1 47 LEU HA 1 47 LEU QD . . 2.910 2.393 2.195 2.932 0.022 12 0 "[ . 1 . 2 ]" 1
945 1 47 LEU HA 1 47 LEU HG . . 3.800 3.300 2.400 3.905 0.105 21 0 "[ . 1 . 2 ]" 1
946 1 47 LEU HA 1 49 GLN H . . 4.620 3.607 3.218 4.161 . 0 0 "[ . 1 . 2 ]" 1
947 1 47 LEU HA 1 50 ASP HB2 . . 3.660 3.451 2.335 3.834 0.174 19 0 "[ . 1 . 2 ]" 1
948 1 47 LEU HA 1 50 ASP HB3 . . 4.430 2.814 2.157 3.606 . 0 0 "[ . 1 . 2 ]" 1
949 1 47 LEU HB2 1 48 ALA H . . 4.800 4.254 4.028 4.548 . 0 0 "[ . 1 . 2 ]" 1
950 1 47 LEU HB2 1 49 GLN H . . 5.500 5.540 5.203 5.588 0.088 11 0 "[ . 1 . 2 ]" 1
951 1 47 LEU HB2 1 56 VAL QG . . 3.750 2.110 1.935 3.752 0.002 2 0 "[ . 1 . 2 ]" 1
952 1 47 LEU HB3 1 48 ALA H . . 5.030 4.498 4.430 4.556 . 0 0 "[ . 1 . 2 ]" 1
953 1 47 LEU HB3 1 50 ASP H . . 5.500 3.999 3.442 5.102 . 0 0 "[ . 1 . 2 ]" 1
954 1 47 LEU HB3 1 50 ASP HB3 . . 4.470 3.910 2.274 5.144 0.674 21 1 "[ . 1 . 2+ ]" 1
955 1 47 LEU QD 1 48 ALA H . . 5.500 4.368 3.740 4.646 . 0 0 "[ . 1 . 2 ]" 1
956 1 47 LEU QD 1 50 ASP HB2 . . 4.680 3.895 2.939 4.714 0.034 20 0 "[ . 1 . 2 ]" 1
957 1 47 LEU QD 1 50 ASP HB3 . . 5.080 2.732 2.017 3.673 . 0 0 "[ . 1 . 2 ]" 1
958 1 47 LEU QD 1 55 ALA H . . 5.140 3.893 2.549 4.863 . 0 0 "[ . 1 . 2 ]" 1
959 1 47 LEU QD 1 55 ALA MB . . 3.340 2.251 1.918 3.245 . 0 0 "[ . 1 . 2 ]" 1
960 1 47 LEU QD 1 56 VAL H . . 5.410 3.199 1.822 3.920 . 0 0 "[ . 1 . 2 ]" 1
961 1 47 LEU QD 1 56 VAL HA . . 3.130 2.513 2.217 3.167 0.037 4 0 "[ . 1 . 2 ]" 1
962 1 47 LEU QD 1 56 VAL QG . . 4.070 2.916 1.950 3.280 . 0 0 "[ . 1 . 2 ]" 1
963 1 47 LEU QD 1 59 PHE QB . . 3.470 3.034 2.449 5.094 1.624 2 2 "[ + -. 1 . 2 ]" 1
964 1 47 LEU HG 1 55 ALA MB . . 3.490 3.165 2.000 5.899 2.409 5 10 "[* *+* * * .-** * ]" 1
965 1 47 LEU HG 1 56 VAL HA . . 4.540 3.982 3.198 4.731 0.191 16 0 "[ . 1 . 2 ]" 1
966 1 48 ALA H 1 48 ALA MB . . 3.050 2.207 2.020 2.277 . 0 0 "[ . 1 . 2 ]" 1
967 1 48 ALA H 1 49 GLN H . . 3.880 2.701 2.494 2.994 . 0 0 "[ . 1 . 2 ]" 1
968 1 48 ALA H 1 49 GLN HA . . 5.220 5.299 5.114 5.340 0.120 3 0 "[ . 1 . 2 ]" 1
969 1 48 ALA H 1 49 GLN QB . . 5.500 4.974 4.498 5.284 . 0 0 "[ . 1 . 2 ]" 1
970 1 48 ALA H 1 50 ASP H . . 5.500 4.155 3.433 5.181 . 0 0 "[ . 1 . 2 ]" 1
971 1 48 ALA HA 1 50 ASP H . . 5.500 4.870 4.319 5.370 . 0 0 "[ . 1 . 2 ]" 1
972 1 48 ALA HA 1 56 VAL QG . . 3.920 3.400 2.198 3.990 0.070 2 0 "[ . 1 . 2 ]" 1
973 1 48 ALA MB 1 49 GLN H . . 3.990 2.599 2.276 2.888 . 0 0 "[ . 1 . 2 ]" 1
974 1 48 ALA MB 1 49 GLN HA . . 4.330 4.222 4.043 4.392 0.062 6 0 "[ . 1 . 2 ]" 1
975 1 48 ALA MB 1 49 GLN QG . . 5.330 3.722 2.324 5.071 . 0 0 "[ . 1 . 2 ]" 1
976 1 48 ALA MB 1 50 ASP H . . 5.500 4.512 3.895 5.265 . 0 0 "[ . 1 . 2 ]" 1
977 1 49 GLN H 1 49 GLN QB . . 3.530 2.887 2.527 3.218 . 0 0 "[ . 1 . 2 ]" 1
978 1 49 GLN H 1 49 GLN QG . . 4.170 3.408 2.114 4.255 0.085 18 0 "[ . 1 . 2 ]" 1
979 1 49 GLN H 1 50 ASP H . . 3.960 2.328 1.845 3.242 . 0 0 "[ . 1 . 2 ]" 1
980 1 49 GLN H 1 50 ASP HB2 . . 5.500 3.614 2.856 4.338 . 0 0 "[ . 1 . 2 ]" 1
981 1 49 GLN H 1 50 ASP HB3 . . 5.500 4.174 3.175 4.836 . 0 0 "[ . 1 . 2 ]" 1
982 1 49 GLN H 1 52 VAL QG . . 5.390 4.574 3.594 5.542 0.152 13 0 "[ . 1 . 2 ]" 1
983 1 49 GLN HA 1 49 GLN QG . . 3.150 2.718 2.148 3.530 0.380 16 0 "[ . 1 . 2 ]" 1
984 1 49 GLN QB 1 50 ASP H . . 4.620 3.911 3.402 4.105 . 0 0 "[ . 1 . 2 ]" 1
985 1 49 GLN QB 1 52 VAL QG . . 5.010 4.120 2.833 4.822 . 0 0 "[ . 1 . 2 ]" 1
986 1 49 GLN QG 1 50 ASP H . . 5.230 4.170 2.910 4.955 . 0 0 "[ . 1 . 2 ]" 1
987 1 50 ASP H 1 50 ASP HB2 . . 3.680 2.844 2.275 3.483 . 0 0 "[ . 1 . 2 ]" 1
988 1 50 ASP H 1 50 ASP HB3 . . 3.680 2.742 2.325 3.178 . 0 0 "[ . 1 . 2 ]" 1
989 1 50 ASP H 1 52 VAL QG . . 5.500 3.450 1.850 4.782 . 0 0 "[ . 1 . 2 ]" 1
990 1 51 HIS HA 1 51 HIS HB2 . . 2.800 2.831 2.541 3.039 0.239 19 0 "[ . 1 . 2 ]" 1
991 1 51 HIS HA 1 51 HIS HB3 . . 3.000 2.767 2.304 3.020 0.020 7 0 "[ . 1 . 2 ]" 1
992 1 51 HIS HB3 1 52 VAL H . . 4.510 3.745 2.993 4.439 . 0 0 "[ . 1 . 2 ]" 1
993 1 52 VAL H 1 52 VAL HB . . 4.180 3.543 2.183 3.960 . 0 0 "[ . 1 . 2 ]" 1
994 1 52 VAL HA 1 52 VAL QG . . 2.880 2.150 2.098 2.306 . 0 0 "[ . 1 . 2 ]" 1
995 1 55 ALA H 1 55 ALA MB . . 3.330 2.439 2.166 3.125 . 0 0 "[ . 1 . 2 ]" 1
996 1 55 ALA H 1 56 VAL HB . . 5.500 4.438 3.646 5.250 . 0 0 "[ . 1 . 2 ]" 1
997 1 55 ALA H 1 56 VAL QG . . 5.500 4.339 3.746 5.037 . 0 0 "[ . 1 . 2 ]" 1
998 1 55 ALA H 1 57 PRO QD . . 5.500 3.354 2.128 4.386 . 0 0 "[ . 1 . 2 ]" 1
999 1 55 ALA HA 1 57 PRO QD . . 4.750 2.967 2.400 3.301 . 0 0 "[ . 1 . 2 ]" 1
1000 1 55 ALA HA 1 58 ASN HB2 . . 4.130 2.558 2.232 4.121 . 0 0 "[ . 1 . 2 ]" 1
1001 1 55 ALA MB 1 56 VAL H . . 4.940 3.151 2.908 3.584 . 0 0 "[ . 1 . 2 ]" 1
1002 1 55 ALA MB 1 56 VAL HA . . 4.030 4.170 3.816 4.582 0.552 5 1 "[ + 1 . 2 ]" 1
1003 1 55 ALA MB 1 56 VAL HB . . 5.130 5.014 4.814 5.263 0.133 5 0 "[ . 1 . 2 ]" 1
1004 1 55 ALA MB 1 56 VAL QG . . 4.630 4.182 3.948 4.546 . 0 0 "[ . 1 . 2 ]" 1
1005 1 55 ALA MB 1 57 PRO QD . . 4.530 3.969 3.622 4.099 . 0 0 "[ . 1 . 2 ]" 1
1006 1 55 ALA MB 1 58 ASN H . . 4.530 3.993 3.282 4.193 . 0 0 "[ . 1 . 2 ]" 1
1007 1 55 ALA MB 1 58 ASN HB2 . . 4.150 3.682 2.888 3.938 . 0 0 "[ . 1 . 2 ]" 1
1008 1 55 ALA MB 1 58 ASN HB3 . . 3.870 3.027 2.389 3.268 . 0 0 "[ . 1 . 2 ]" 1
1009 1 56 VAL H 1 56 VAL HB . . 3.630 2.247 2.161 2.427 . 0 0 "[ . 1 . 2 ]" 1
1010 1 56 VAL H 1 56 VAL QG . . 3.390 2.569 2.178 3.040 . 0 0 "[ . 1 . 2 ]" 1
1011 1 56 VAL H 1 57 PRO QD . . 3.790 2.503 2.273 2.840 . 0 0 "[ . 1 . 2 ]" 1
1012 1 56 VAL H 1 57 PRO HG2 . . 5.500 4.938 4.647 5.269 . 0 0 "[ . 1 . 2 ]" 1
1013 1 56 VAL H 1 57 PRO HG3 . . 5.450 5.010 4.753 5.461 0.011 5 0 "[ . 1 . 2 ]" 1
1014 1 56 VAL H 1 58 ASN H . . 5.500 4.105 3.860 4.470 . 0 0 "[ . 1 . 2 ]" 1
1015 1 56 VAL HA 1 56 VAL QG . . 3.030 2.173 2.082 2.226 . 0 0 "[ . 1 . 2 ]" 1
1016 1 56 VAL HA 1 59 PHE H . . 4.270 3.918 3.640 4.147 . 0 0 "[ . 1 . 2 ]" 1
1017 1 56 VAL HA 1 59 PHE QB . . 3.020 3.252 3.078 3.438 0.418 11 0 "[ . 1 . 2 ]" 1
1018 1 56 VAL HA 1 59 PHE QD . . 3.580 4.096 3.647 4.856 1.276 17 11 "[ *- .** 1** . +*** *]" 1
1019 1 56 VAL HA 1 60 VAL H . . 4.170 4.728 4.568 4.817 0.647 19 15 "[***-.** ** **.** +2**]" 1
1020 1 56 VAL HB 1 57 PRO QD . . 2.920 2.132 1.968 2.272 . 0 0 "[ . 1 . 2 ]" 1
1021 1 56 VAL QG 1 57 PRO QD . . 3.090 2.485 2.350 2.592 . 0 0 "[ . 1 . 2 ]" 1
1022 1 56 VAL QG 1 59 PHE H . . 5.500 4.679 4.383 4.812 . 0 0 "[ . 1 . 2 ]" 1
1023 1 56 VAL QG 1 59 PHE QD . . 3.590 3.934 3.535 4.117 0.527 11 2 "[ .- 1+ . 2 ]" 1
1024 1 56 VAL QG 1 60 VAL H . . 5.500 4.359 4.058 4.631 . 0 0 "[ . 1 . 2 ]" 1
1025 1 57 PRO HA 1 60 VAL H . . 4.450 3.263 3.129 3.466 . 0 0 "[ . 1 . 2 ]" 1
1026 1 57 PRO HA 1 60 VAL HB . . 4.520 4.528 4.522 4.536 0.016 13 0 "[ . 1 . 2 ]" 1
1027 1 57 PRO HA 1 60 VAL QG . . 3.500 1.895 1.857 1.950 . 0 0 "[ . 1 . 2 ]" 1
1028 1 57 PRO HA 1 80 ALA MB . . 4.030 3.564 3.334 3.879 . 0 0 "[ . 1 . 2 ]" 1
1029 1 57 PRO HB2 1 58 ASN H . . 3.920 3.463 3.016 3.758 . 0 0 "[ . 1 . 2 ]" 1
1030 1 57 PRO HB3 1 80 ALA H . . 4.510 4.609 4.578 4.626 0.116 18 0 "[ . 1 . 2 ]" 1
1031 1 57 PRO HB3 1 80 ALA MB . . 4.060 2.123 2.007 2.252 . 0 0 "[ . 1 . 2 ]" 1
1032 1 57 PRO QD 1 58 ASN H . . 4.620 2.254 1.925 2.663 . 0 0 "[ . 1 . 2 ]" 1
1033 1 57 PRO QD 1 59 PHE H . . 5.500 4.267 4.037 4.548 . 0 0 "[ . 1 . 2 ]" 1
1034 1 57 PRO QD 1 60 VAL QG . . 5.460 4.291 4.238 4.351 . 0 0 "[ . 1 . 2 ]" 1
1035 1 57 PRO HG2 1 58 ASN H . . 5.090 3.335 2.610 3.958 . 0 0 "[ . 1 . 2 ]" 1
1036 1 58 ASN H 1 58 ASN HB2 . . 3.170 2.451 2.192 2.652 . 0 0 "[ . 1 . 2 ]" 1
1037 1 58 ASN H 1 58 ASN HB3 . . 3.320 2.693 2.450 2.871 . 0 0 "[ . 1 . 2 ]" 1
1038 1 58 ASN H 1 59 PHE H . . 4.250 2.555 2.361 2.813 . 0 0 "[ . 1 . 2 ]" 1
1039 1 58 ASN HA 1 58 ASN HB3 . . 2.880 3.030 2.999 3.049 0.169 8 0 "[ . 1 . 2 ]" 1
1040 1 58 ASN HB3 1 59 PHE H . . 4.030 2.768 2.440 3.170 . 0 0 "[ . 1 . 2 ]" 1
1041 1 59 PHE H 1 59 PHE QB . . 3.090 2.133 2.067 2.180 . 0 0 "[ . 1 . 2 ]" 1
1042 1 59 PHE H 1 59 PHE QD . . 4.990 4.074 3.958 4.149 . 0 0 "[ . 1 . 2 ]" 1
1043 1 59 PHE H 1 60 VAL HB . . 5.330 6.505 6.283 6.717 1.387 2 22 [*+*-******************] 1
1044 1 59 PHE H 1 60 VAL QG . . 5.180 3.894 3.728 4.092 . 0 0 "[ . 1 . 2 ]" 1
1045 1 59 PHE HA 1 59 PHE QD . . 3.420 2.648 2.439 2.839 . 0 0 "[ . 1 . 2 ]" 1
1046 1 59 PHE HA 1 61 LYS H . . 5.500 4.440 3.873 4.859 . 0 0 "[ . 1 . 2 ]" 1
1047 1 59 PHE HA 1 62 GLU H . . 4.600 3.704 3.451 4.002 . 0 0 "[ . 1 . 2 ]" 1
1048 1 59 PHE HA 1 62 GLU HB3 . . 3.760 3.641 3.115 3.804 0.044 19 0 "[ . 1 . 2 ]" 1
1049 1 59 PHE HA 1 62 GLU HG2 . . 4.310 3.024 2.402 3.694 . 0 0 "[ . 1 . 2 ]" 1
1050 1 59 PHE HA 1 63 LYS H . . 5.440 5.288 4.751 5.553 0.113 3 0 "[ . 1 . 2 ]" 1
1051 1 59 PHE QB 1 60 VAL H . . 3.770 2.498 2.245 2.716 . 0 0 "[ . 1 . 2 ]" 1
1052 1 59 PHE QB 1 60 VAL QG . . 3.820 3.296 3.141 3.473 . 0 0 "[ . 1 . 2 ]" 1
1053 1 59 PHE QB 1 61 LYS H . . 5.500 4.729 4.531 4.993 . 0 0 "[ . 1 . 2 ]" 1
1054 1 59 PHE QD 1 60 VAL H . . 4.170 2.780 2.532 2.969 . 0 0 "[ . 1 . 2 ]" 1
1055 1 59 PHE QD 1 60 VAL QG . . 3.300 2.214 2.043 2.455 . 0 0 "[ . 1 . 2 ]" 1
1056 1 59 PHE QE 1 60 VAL QG . . 4.470 2.654 2.330 2.846 . 0 0 "[ . 1 . 2 ]" 1
1057 1 59 PHE QE 1 63 LYS QE . . 4.250 2.928 2.277 3.396 . 0 0 "[ . 1 . 2 ]" 1
1058 1 59 PHE QE 1 63 LYS QG . . 4.300 3.278 2.783 4.033 . 0 0 "[ . 1 . 2 ]" 1
1059 1 59 PHE HZ 1 63 LYS QD . . 3.590 3.609 3.374 3.662 0.072 13 0 "[ . 1 . 2 ]" 1
1060 1 59 PHE HZ 1 63 LYS QE . . 3.940 2.589 2.102 3.264 . 0 0 "[ . 1 . 2 ]" 1
1061 1 60 VAL H 1 60 VAL HB . . 3.470 3.616 3.574 3.659 0.189 8 0 "[ . 1 . 2 ]" 1
1062 1 60 VAL H 1 60 VAL QG . . 3.130 1.919 1.804 2.061 . 0 0 "[ . 1 . 2 ]" 1
1063 1 60 VAL H 1 61 LYS H . . 3.970 2.935 2.819 3.101 . 0 0 "[ . 1 . 2 ]" 1
1064 1 60 VAL H 1 62 GLU H . . 5.500 4.351 4.162 4.495 . 0 0 "[ . 1 . 2 ]" 1
1065 1 60 VAL HA 1 60 VAL QG . . 2.970 2.201 2.097 2.316 . 0 0 "[ . 1 . 2 ]" 1
1066 1 60 VAL HA 1 63 LYS H . . 3.420 3.028 2.868 3.208 . 0 0 "[ . 1 . 2 ]" 1
1067 1 60 VAL HA 1 63 LYS HB2 . . 3.510 2.784 2.424 3.060 . 0 0 "[ . 1 . 2 ]" 1
1068 1 60 VAL HA 1 63 LYS QG . . 4.910 2.216 1.952 4.050 . 0 0 "[ . 1 . 2 ]" 1
1069 1 60 VAL HB 1 61 LYS H . . 4.020 3.812 3.494 4.105 0.085 13 0 "[ . 1 . 2 ]" 1
1070 1 60 VAL QG 1 61 LYS H . . 4.570 2.554 2.213 3.037 . 0 0 "[ . 1 . 2 ]" 1
1071 1 60 VAL QG 1 61 LYS QB . . 4.670 3.788 3.374 4.164 . 0 0 "[ . 1 . 2 ]" 1
1072 1 60 VAL QG 1 62 GLU H . . 5.500 4.388 4.257 4.594 . 0 0 "[ . 1 . 2 ]" 1
1073 1 61 LYS H 1 61 LYS QB . . 3.630 2.283 2.195 2.429 . 0 0 "[ . 1 . 2 ]" 1
1074 1 61 LYS H 1 62 GLU H . . 3.720 2.730 2.202 3.018 . 0 0 "[ . 1 . 2 ]" 1
1075 1 61 LYS H 1 63 LYS H . . 4.850 4.001 3.455 4.237 . 0 0 "[ . 1 . 2 ]" 1
1076 1 61 LYS HA 1 61 LYS QD . . 3.560 3.951 2.640 4.239 0.679 10 10 "[* * . -*+ *** *2 *]" 1
1077 1 61 LYS HA 1 61 LYS QE . . 4.430 4.264 3.368 4.601 0.171 7 0 "[ . 1 . 2 ]" 1
1078 1 61 LYS HA 1 61 LYS QG . . 3.980 2.366 2.091 2.521 . 0 0 "[ . 1 . 2 ]" 1
1079 1 61 LYS HA 1 63 LYS H . . 3.610 3.704 3.293 3.750 0.140 14 0 "[ . 1 . 2 ]" 1
1080 1 61 LYS HA 1 86 VAL QG . . 5.020 4.282 4.002 4.563 . 0 0 "[ . 1 . 2 ]" 1
1081 1 61 LYS QB 1 62 GLU H . . 4.240 3.119 2.609 3.366 . 0 0 "[ . 1 . 2 ]" 1
1082 1 61 LYS QB 1 84 MET H . . 5.500 6.340 5.783 6.643 1.143 16 19 "[* ********* *-*+**** *]" 1
1083 1 61 LYS QE 1 61 LYS QG . . 3.360 2.297 2.024 2.552 . 0 0 "[ . 1 . 2 ]" 1
1084 1 61 LYS QE 1 84 MET QB . . 3.600 4.314 2.494 6.386 2.786 18 9 "[ *-** 1** .* + * ]" 1
1085 1 61 LYS QG 1 62 GLU H . . 4.990 4.551 4.265 4.850 . 0 0 "[ . 1 . 2 ]" 1
1086 1 61 LYS QG 1 84 MET H . . 5.500 4.716 4.317 5.113 . 0 0 "[ . 1 . 2 ]" 1
1087 1 61 LYS QG 1 85 GLY H . . 5.500 6.502 6.134 7.056 1.556 10 22 [*********+******-*****] 1
1088 1 61 LYS QG 1 86 VAL QG . . 4.920 4.056 3.220 4.374 . 0 0 "[ . 1 . 2 ]" 1
1089 1 62 GLU H 1 62 GLU HB3 . . 3.200 2.413 2.080 2.649 . 0 0 "[ . 1 . 2 ]" 1
1090 1 62 GLU H 1 62 GLU HG2 . . 3.590 3.296 2.789 3.714 0.124 14 0 "[ . 1 . 2 ]" 1
1091 1 62 GLU H 1 62 GLU HG3 . . 3.550 3.224 2.748 4.089 0.539 13 2 "[ . 1- + . 2 ]" 1
1092 1 62 GLU H 1 63 LYS H . . 3.670 2.432 2.169 2.724 . 0 0 "[ . 1 . 2 ]" 1
1093 1 62 GLU H 1 63 LYS HA . . 5.500 4.993 4.811 5.237 . 0 0 "[ . 1 . 2 ]" 1
1094 1 62 GLU H 1 64 GLY H . . 4.970 4.794 4.604 4.995 0.025 11 0 "[ . 1 . 2 ]" 1
1095 1 62 GLU HA 1 62 GLU HB2 . . 3.010 2.228 2.144 2.303 . 0 0 "[ . 1 . 2 ]" 1
1096 1 62 GLU HA 1 62 GLU HG3 . . 3.710 3.666 3.456 3.766 0.056 18 0 "[ . 1 . 2 ]" 1
1097 1 62 GLU HA 1 63 LYS H . . 3.630 3.475 3.391 3.685 0.055 14 0 "[ . 1 . 2 ]" 1
1098 1 62 GLU HA 1 64 GLY H . . 4.270 3.578 3.281 3.819 . 0 0 "[ . 1 . 2 ]" 1
1099 1 62 GLU HB2 1 63 LYS H . . 4.300 4.445 4.242 4.588 0.288 11 0 "[ . 1 . 2 ]" 1
1100 1 62 GLU HB2 1 63 LYS QG . . 5.200 5.023 4.730 5.387 0.187 17 0 "[ . 1 . 2 ]" 1
1101 1 62 GLU HB3 1 62 GLU HG3 . . 2.710 2.871 2.640 3.058 0.348 8 0 "[ . 1 . 2 ]" 1
1102 1 62 GLU HB3 1 63 LYS H . . 4.210 4.075 3.748 4.238 0.028 20 0 "[ . 1 . 2 ]" 1
1103 1 62 GLU HB3 1 64 GLY H . . 5.500 5.637 5.492 5.862 0.362 11 0 "[ . 1 . 2 ]" 1
1104 1 62 GLU HG2 1 63 LYS H . . 4.350 4.069 2.797 4.472 0.122 12 0 "[ . 1 . 2 ]" 1
1105 1 62 GLU HG3 1 63 LYS H . . 4.250 3.044 2.679 3.934 . 0 0 "[ . 1 . 2 ]" 1
1106 1 62 GLU HG3 1 63 LYS QD . . 4.110 2.553 2.156 2.998 . 0 0 "[ . 1 . 2 ]" 1
1107 1 63 LYS H 1 63 LYS HB2 . . 3.320 2.496 2.253 2.619 . 0 0 "[ . 1 . 2 ]" 1
1108 1 63 LYS H 1 63 LYS HB3 . . 3.630 3.623 3.491 3.662 0.032 18 0 "[ . 1 . 2 ]" 1
1109 1 63 LYS H 1 63 LYS QD . . 4.200 3.527 2.260 3.726 . 0 0 "[ . 1 . 2 ]" 1
1110 1 63 LYS H 1 63 LYS QG . . 3.640 2.320 2.147 3.103 . 0 0 "[ . 1 . 2 ]" 1
1111 1 63 LYS H 1 64 GLY H . . 3.390 3.109 3.046 3.127 . 0 0 "[ . 1 . 2 ]" 1
1112 1 63 LYS H 1 64 GLY HA3 . . 5.250 5.519 5.416 5.591 0.341 14 0 "[ . 1 . 2 ]" 1
1113 1 63 LYS HA 1 63 LYS QD . . 3.240 2.229 2.073 3.278 0.038 14 0 "[ . 1 . 2 ]" 1
1114 1 63 LYS HA 1 63 LYS QG . . 3.540 2.984 1.977 3.094 . 0 0 "[ . 1 . 2 ]" 1
1115 1 63 LYS HA 1 65 ALA H . . 5.500 4.712 4.328 4.990 . 0 0 "[ . 1 . 2 ]" 1
1116 1 63 LYS HB2 1 64 GLY H . . 4.630 4.160 4.102 4.242 . 0 0 "[ . 1 . 2 ]" 1
1117 1 63 LYS HB3 1 63 LYS QE . . 4.970 2.352 2.120 3.045 . 0 0 "[ . 1 . 2 ]" 1
1118 1 63 LYS HB3 1 64 GLY H . . 4.650 4.470 4.360 4.524 . 0 0 "[ . 1 . 2 ]" 1
1119 1 63 LYS QG 1 64 GLY H . . 5.500 4.663 4.472 4.723 . 0 0 "[ . 1 . 2 ]" 1
1120 1 64 GLY H 1 65 ALA MB . . 4.950 4.620 4.495 4.798 . 0 0 "[ . 1 . 2 ]" 1
1121 1 64 GLY HA3 1 65 ALA MB . . 5.140 4.834 4.615 5.062 . 0 0 "[ . 1 . 2 ]" 1
1122 1 65 ALA H 1 65 ALA MB . . 2.900 2.149 2.107 2.208 . 0 0 "[ . 1 . 2 ]" 1
1123 1 65 ALA H 1 66 GLU H . . 4.880 4.636 4.583 4.756 . 0 0 "[ . 1 . 2 ]" 1
1124 1 65 ALA H 1 86 VAL QG . . 5.500 3.998 3.649 4.682 . 0 0 "[ . 1 . 2 ]" 1
1125 1 65 ALA HA 1 66 GLU H . . 3.170 2.488 2.202 2.637 . 0 0 "[ . 1 . 2 ]" 1
1126 1 65 ALA HA 1 67 LEU H . . 4.420 4.140 3.668 4.519 0.099 10 0 "[ . 1 . 2 ]" 1
1127 1 65 ALA MB 1 66 GLU H . . 3.630 2.292 2.136 2.580 . 0 0 "[ . 1 . 2 ]" 1
1128 1 65 ALA MB 1 67 LEU H . . 3.780 3.283 3.020 3.658 . 0 0 "[ . 1 . 2 ]" 1
1129 1 65 ALA MB 1 86 VAL QG . . 3.770 2.447 2.141 3.308 . 0 0 "[ . 1 . 2 ]" 1
1130 1 66 GLU H 1 66 GLU QB . . 3.720 2.624 2.401 2.735 . 0 0 "[ . 1 . 2 ]" 1
1131 1 66 GLU H 1 66 GLU QG . . 4.070 3.678 3.431 3.874 . 0 0 "[ . 1 . 2 ]" 1
1132 1 66 GLU H 1 67 LEU H . . 3.140 1.812 1.666 2.103 . 0 0 "[ . 1 . 2 ]" 1
1133 1 66 GLU H 1 67 LEU HA . . 4.290 4.397 4.302 4.433 0.143 13 0 "[ . 1 . 2 ]" 1
1134 1 66 GLU H 1 86 VAL QG . . 5.500 3.155 2.956 3.596 . 0 0 "[ . 1 . 2 ]" 1
1135 1 66 GLU HA 1 66 GLU QG . . 3.170 2.208 2.116 2.306 . 0 0 "[ . 1 . 2 ]" 1
1136 1 66 GLU HA 1 86 VAL HA . . 4.210 3.087 2.825 3.421 . 0 0 "[ . 1 . 2 ]" 1
1137 1 66 GLU HA 1 86 VAL QG . . 3.300 2.034 1.892 2.353 . 0 0 "[ . 1 . 2 ]" 1
1138 1 66 GLU HA 1 87 LYS H . . 4.830 4.152 3.798 4.349 . 0 0 "[ . 1 . 2 ]" 1
1139 1 66 GLU QB 1 67 LEU H . . 4.270 2.909 2.569 3.164 . 0 0 "[ . 1 . 2 ]" 1
1140 1 66 GLU QB 1 67 LEU QB . . 3.450 3.337 2.961 3.662 0.212 16 0 "[ . 1 . 2 ]" 1
1141 1 66 GLU QB 1 87 LYS H . . 5.500 4.678 4.360 5.230 . 0 0 "[ . 1 . 2 ]" 1
1142 1 66 GLU QG 1 67 LEU H . . 4.780 4.534 4.396 4.637 . 0 0 "[ . 1 . 2 ]" 1
1143 1 66 GLU QG 1 87 LYS H . . 5.110 5.254 5.032 5.287 0.177 9 0 "[ . 1 . 2 ]" 1
1144 1 67 LEU H 1 67 LEU QB . . 3.630 2.531 2.440 2.670 . 0 0 "[ . 1 . 2 ]" 1
1145 1 67 LEU H 1 67 LEU QD . . 4.670 3.935 3.815 4.057 . 0 0 "[ . 1 . 2 ]" 1
1146 1 67 LEU H 1 68 VAL H . . 4.920 4.401 4.322 4.465 . 0 0 "[ . 1 . 2 ]" 1
1147 1 67 LEU H 1 68 VAL HA . . 5.500 4.901 4.750 5.090 . 0 0 "[ . 1 . 2 ]" 1
1148 1 67 LEU H 1 86 VAL QG . . 4.260 3.292 3.118 3.739 . 0 0 "[ . 1 . 2 ]" 1
1149 1 67 LEU H 1 87 LYS H . . 5.500 5.148 4.913 5.466 . 0 0 "[ . 1 . 2 ]" 1
1150 1 67 LEU HA 1 67 LEU QD . . 2.950 2.211 2.105 2.456 . 0 0 "[ . 1 . 2 ]" 1
1151 1 67 LEU HA 1 68 VAL H . . 2.930 2.339 2.289 2.423 . 0 0 "[ . 1 . 2 ]" 1
1152 1 67 LEU HA 1 86 VAL HA . . 4.610 4.358 4.031 4.573 . 0 0 "[ . 1 . 2 ]" 1
1153 1 67 LEU HA 1 86 VAL QG . . 3.300 2.977 2.739 3.250 . 0 0 "[ . 1 . 2 ]" 1
1154 1 67 LEU HA 1 87 LYS H . . 3.750 3.209 2.912 3.456 . 0 0 "[ . 1 . 2 ]" 1
1155 1 67 LEU HA 1 87 LYS QB . . 3.540 3.013 2.554 3.422 . 0 0 "[ . 1 . 2 ]" 1
1156 1 67 LEU QB 1 68 VAL H . . 4.440 3.455 3.087 3.593 . 0 0 "[ . 1 . 2 ]" 1
1157 1 67 LEU QB 1 103 TYR QE . . 4.130 4.295 4.042 4.350 0.220 1 0 "[ . 1 . 2 ]" 1
1158 1 67 LEU QD 1 68 VAL H . . 3.120 2.285 1.697 3.015 . 0 0 "[ . 1 . 2 ]" 1
1159 1 67 LEU QD 1 69 ILE HA . . 5.080 4.130 3.602 4.717 . 0 0 "[ . 1 . 2 ]" 1
1160 1 67 LEU QD 1 69 ILE MD . . 3.260 2.410 1.975 2.875 . 0 0 "[ . 1 . 2 ]" 1
1161 1 67 LEU QD 1 69 ILE HG12 . . 5.500 2.876 2.433 3.322 . 0 0 "[ . 1 . 2 ]" 1
1162 1 67 LEU QD 1 69 ILE MG . . 5.500 4.214 3.929 4.586 . 0 0 "[ . 1 . 2 ]" 1
1163 1 67 LEU QD 1 87 LYS H . . 4.370 3.673 3.318 4.098 . 0 0 "[ . 1 . 2 ]" 1
1164 1 67 LEU QD 1 87 LYS QD . . 3.560 2.889 1.981 3.671 0.111 9 0 "[ . 1 . 2 ]" 1
1165 1 67 LEU QD 1 87 LYS QE . . 4.290 3.032 2.003 3.852 . 0 0 "[ . 1 . 2 ]" 1
1166 1 67 LEU QD 1 87 LYS HG2 . . 4.550 2.681 2.001 3.953 . 0 0 "[ . 1 . 2 ]" 1
1167 1 67 LEU QD 1 87 LYS HG3 . . 4.410 3.716 2.668 4.375 . 0 0 "[ . 1 . 2 ]" 1
1168 1 67 LEU QD 1 88 VAL HA . . 4.140 3.625 2.939 4.186 0.046 14 0 "[ . 1 . 2 ]" 1
1169 1 67 LEU QD 1 89 ILE MD . . 2.910 1.991 1.830 2.176 . 0 0 "[ . 1 . 2 ]" 1
1170 1 67 LEU QD 1 89 ILE HG12 . . 4.220 3.828 3.453 4.098 . 0 0 "[ . 1 . 2 ]" 1
1171 1 67 LEU QD 1 89 ILE HG13 . . 4.510 2.714 2.201 3.272 . 0 0 "[ . 1 . 2 ]" 1
1172 1 67 LEU QD 1 103 TYR QD . . 3.990 3.072 2.883 3.335 . 0 0 "[ . 1 . 2 ]" 1
1173 1 67 LEU QD 1 103 TYR QE . . 3.460 2.585 2.239 2.960 . 0 0 "[ . 1 . 2 ]" 1
1174 1 67 LEU HG 1 68 VAL H . . 4.060 2.955 1.886 4.188 0.128 18 0 "[ . 1 . 2 ]" 1
1175 1 68 VAL H 1 68 VAL HB . . 3.380 2.951 2.841 3.046 . 0 0 "[ . 1 . 2 ]" 1
1176 1 68 VAL H 1 68 VAL QG . . 3.490 2.707 2.616 2.868 . 0 0 "[ . 1 . 2 ]" 1
1177 1 68 VAL H 1 69 ILE H . . 5.250 4.278 4.113 4.413 . 0 0 "[ . 1 . 2 ]" 1
1178 1 68 VAL H 1 87 LYS H . . 4.780 4.905 4.655 5.195 0.415 12 0 "[ . 1 . 2 ]" 1
1179 1 68 VAL H 1 87 LYS HA . . 5.500 5.409 5.130 5.577 0.077 14 0 "[ . 1 . 2 ]" 1
1180 1 68 VAL H 1 87 LYS QB . . 4.750 4.163 3.811 4.584 . 0 0 "[ . 1 . 2 ]" 1
1181 1 68 VAL H 1 87 LYS HG2 . . 5.500 4.750 4.272 5.506 0.006 17 0 "[ . 1 . 2 ]" 1
1182 1 68 VAL H 1 88 VAL HA . . 3.840 2.895 2.557 3.493 . 0 0 "[ . 1 . 2 ]" 1
1183 1 68 VAL H 1 89 ILE MD . . 5.500 4.519 3.756 5.043 . 0 0 "[ . 1 . 2 ]" 1
1184 1 68 VAL HA 1 68 VAL QG . . 3.280 2.196 2.103 2.290 . 0 0 "[ . 1 . 2 ]" 1
1185 1 68 VAL HA 1 69 ILE H . . 2.930 2.306 2.230 2.389 . 0 0 "[ . 1 . 2 ]" 1
1186 1 68 VAL HA 1 69 ILE HB . . 4.850 4.614 4.418 4.791 . 0 0 "[ . 1 . 2 ]" 1
1187 1 68 VAL HA 1 70 VAL MG1 . . 5.280 4.164 3.808 4.399 . 0 0 "[ . 1 . 2 ]" 1
1188 1 68 VAL HB 1 69 ILE H . . 4.250 3.897 3.668 4.340 0.090 4 0 "[ . 1 . 2 ]" 1
1189 1 68 VAL HB 1 88 VAL HA . . 4.220 2.511 2.175 3.156 . 0 0 "[ . 1 . 2 ]" 1
1190 1 68 VAL QG 1 69 ILE H . . 3.400 2.451 2.201 2.996 . 0 0 "[ . 1 . 2 ]" 1
1191 1 68 VAL QG 1 70 VAL H . . 4.180 4.211 3.967 4.258 0.078 20 0 "[ . 1 . 2 ]" 1
1192 1 68 VAL QG 1 70 VAL MG1 . . 2.920 1.979 1.922 2.087 . 0 0 "[ . 1 . 2 ]" 1
1193 1 68 VAL QG 1 81 PHE QB . . 4.940 3.301 3.068 3.813 . 0 0 "[ . 1 . 2 ]" 1
1194 1 68 VAL QG 1 88 VAL H . . 5.500 4.882 4.465 5.562 0.062 16 0 "[ . 1 . 2 ]" 1
1195 1 68 VAL QG 1 88 VAL HA . . 3.870 3.228 2.826 3.767 . 0 0 "[ . 1 . 2 ]" 1
1196 1 68 VAL QG 1 88 VAL QG . . 3.110 2.590 2.221 3.056 . 0 0 "[ . 1 . 2 ]" 1
1197 1 68 VAL QG 1 89 ILE H . . 5.500 4.211 4.003 4.662 . 0 0 "[ . 1 . 2 ]" 1
1198 1 69 ILE H 1 69 ILE HB . . 3.610 2.666 2.478 2.867 . 0 0 "[ . 1 . 2 ]" 1
1199 1 69 ILE H 1 69 ILE MD . . 4.440 4.045 3.112 4.379 . 0 0 "[ . 1 . 2 ]" 1
1200 1 69 ILE H 1 69 ILE HG12 . . 4.330 4.147 3.783 4.427 0.097 19 0 "[ . 1 . 2 ]" 1
1201 1 69 ILE H 1 69 ILE MG . . 4.170 3.849 3.773 3.965 . 0 0 "[ . 1 . 2 ]" 1
1202 1 69 ILE H 1 70 VAL H . . 4.480 4.094 4.018 4.302 . 0 0 "[ . 1 . 2 ]" 1
1203 1 69 ILE H 1 70 VAL MG1 . . 4.560 3.242 2.974 3.679 . 0 0 "[ . 1 . 2 ]" 1
1204 1 69 ILE H 1 70 VAL MG2 . . 5.360 4.776 4.063 5.171 . 0 0 "[ . 1 . 2 ]" 1
1205 1 69 ILE H 1 89 ILE HB . . 5.440 4.975 4.703 5.405 . 0 0 "[ . 1 . 2 ]" 1
1206 1 69 ILE HA 1 69 ILE MD . . 3.830 3.919 3.774 3.974 0.144 17 0 "[ . 1 . 2 ]" 1
1207 1 69 ILE HA 1 69 ILE HG12 . . 3.820 2.677 2.490 3.122 . 0 0 "[ . 1 . 2 ]" 1
1208 1 69 ILE HA 1 69 ILE HG13 . . 4.250 3.021 2.571 3.279 . 0 0 "[ . 1 . 2 ]" 1
1209 1 69 ILE HA 1 69 ILE MG . . 3.330 2.332 2.224 2.450 . 0 0 "[ . 1 . 2 ]" 1
1210 1 69 ILE HA 1 70 VAL H . . 3.140 2.171 2.101 2.338 . 0 0 "[ . 1 . 2 ]" 1
1211 1 69 ILE HA 1 89 ILE HB . . 3.280 2.620 2.315 3.094 . 0 0 "[ . 1 . 2 ]" 1
1212 1 69 ILE HB 1 69 ILE MD . . 3.330 2.340 2.107 2.579 . 0 0 "[ . 1 . 2 ]" 1
1213 1 69 ILE HB 1 70 VAL H . . 4.590 4.399 4.275 4.634 0.044 4 0 "[ . 1 . 2 ]" 1
1214 1 69 ILE MD 1 69 ILE MG . . 2.930 2.081 2.022 2.564 . 0 0 "[ . 1 . 2 ]" 1
1215 1 69 ILE MD 1 100 VAL H . . 5.500 4.395 4.052 4.666 . 0 0 "[ . 1 . 2 ]" 1
1216 1 69 ILE MD 1 100 VAL HA . . 3.910 2.907 2.444 3.243 . 0 0 "[ . 1 . 2 ]" 1
1217 1 69 ILE MD 1 100 VAL MG2 . . 3.650 3.139 2.505 3.803 0.153 18 0 "[ . 1 . 2 ]" 1
1218 1 69 ILE MD 1 103 TYR H . . 4.580 3.748 3.466 4.563 . 0 0 "[ . 1 . 2 ]" 1
1219 1 69 ILE MD 1 103 TYR HA . . 5.100 4.321 4.142 5.091 . 0 0 "[ . 1 . 2 ]" 1
1220 1 69 ILE MD 1 103 TYR HB2 . . 3.650 2.378 2.165 3.198 . 0 0 "[ . 1 . 2 ]" 1
1221 1 69 ILE MD 1 103 TYR HB3 . . 4.230 2.543 2.253 3.114 . 0 0 "[ . 1 . 2 ]" 1
1222 1 69 ILE MD 1 103 TYR QD . . 4.100 2.957 2.685 3.280 . 0 0 "[ . 1 . 2 ]" 1
1223 1 69 ILE MD 1 104 LEU H . . 5.120 4.724 4.430 5.284 0.164 19 0 "[ . 1 . 2 ]" 1
1224 1 69 ILE MD 1 108 LEU QD . . 3.290 2.489 2.131 3.431 0.141 19 0 "[ . 1 . 2 ]" 1
1225 1 69 ILE HG12 1 70 VAL H . . 4.750 4.705 4.531 4.893 0.143 19 0 "[ . 1 . 2 ]" 1
1226 1 69 ILE HG12 1 89 ILE MD . . 4.020 2.813 2.323 3.526 . 0 0 "[ . 1 . 2 ]" 1
1227 1 69 ILE HG13 1 89 ILE HB . . 4.830 3.447 2.462 4.108 . 0 0 "[ . 1 . 2 ]" 1
1228 1 69 ILE HG13 1 89 ILE MD . . 4.960 3.673 2.986 4.659 . 0 0 "[ . 1 . 2 ]" 1
1229 1 69 ILE MG 1 70 VAL H . . 3.560 3.018 2.876 3.459 . 0 0 "[ . 1 . 2 ]" 1
1230 1 69 ILE MG 1 89 ILE HB . . 4.050 3.326 2.881 3.690 . 0 0 "[ . 1 . 2 ]" 1
1231 1 69 ILE MG 1 92 ALA MB . . 3.130 2.012 1.866 2.472 . 0 0 "[ . 1 . 2 ]" 1
1232 1 69 ILE MG 1 99 VAL H . . 5.500 5.596 5.536 5.612 0.112 3 0 "[ . 1 . 2 ]" 1
1233 1 69 ILE MG 1 99 VAL HB . . 3.950 4.118 4.068 4.142 0.192 1 0 "[ . 1 . 2 ]" 1
1234 1 69 ILE MG 1 99 VAL MG1 . . 3.290 1.786 1.768 1.801 . 0 0 "[ . 1 . 2 ]" 1
1235 1 69 ILE MG 1 99 VAL MG2 . . 3.090 3.252 3.071 3.282 0.192 17 0 "[ . 1 . 2 ]" 1
1236 1 69 ILE MG 1 108 LEU QD . . 4.160 2.060 1.878 2.760 . 0 0 "[ . 1 . 2 ]" 1
1237 1 70 VAL H 1 70 VAL MG1 . . 3.670 2.884 2.691 3.345 . 0 0 "[ . 1 . 2 ]" 1
1238 1 70 VAL H 1 70 VAL MG2 . . 3.210 2.166 1.978 2.318 . 0 0 "[ . 1 . 2 ]" 1
1239 1 70 VAL H 1 71 ARG H . . 5.500 4.479 4.388 4.568 . 0 0 "[ . 1 . 2 ]" 1
1240 1 70 VAL H 1 89 ILE HA . . 5.500 5.081 4.932 5.216 . 0 0 "[ . 1 . 2 ]" 1
1241 1 70 VAL H 1 89 ILE HB . . 4.880 4.205 3.821 4.694 . 0 0 "[ . 1 . 2 ]" 1
1242 1 70 VAL H 1 90 LYS HA . . 4.080 2.757 2.417 3.003 . 0 0 "[ . 1 . 2 ]" 1
1243 1 70 VAL H 1 90 LYS HB2 . . 5.500 5.521 4.252 5.855 0.355 19 0 "[ . 1 . 2 ]" 1
1244 1 70 VAL H 1 92 ALA MB . . 5.500 3.804 3.316 4.403 . 0 0 "[ . 1 . 2 ]" 1
1245 1 70 VAL HA 1 70 VAL HB . . 2.750 2.451 2.377 2.611 . 0 0 "[ . 1 . 2 ]" 1
1246 1 70 VAL HA 1 70 VAL MG1 . . 3.050 2.393 2.191 2.502 . 0 0 "[ . 1 . 2 ]" 1
1247 1 70 VAL HA 1 70 VAL MG2 . . 3.560 3.258 3.223 3.287 . 0 0 "[ . 1 . 2 ]" 1
1248 1 70 VAL HA 1 91 GLY H . . 5.500 5.558 4.974 6.269 0.769 17 1 "[ . 1 . + 2 ]" 1
1249 1 70 VAL HA 1 92 ALA H . . 5.500 5.026 4.741 5.546 0.046 17 0 "[ . 1 . 2 ]" 1
1250 1 70 VAL HB 1 71 ARG H . . 3.480 2.435 2.149 3.148 . 0 0 "[ . 1 . 2 ]" 1
1251 1 70 VAL HB 1 72 GLY H . . 5.000 4.416 3.771 4.994 . 0 0 "[ . 1 . 2 ]" 1
1252 1 70 VAL HB 1 73 ILE HB . . 4.920 2.700 2.297 3.018 . 0 0 "[ . 1 . 2 ]" 1
1253 1 70 VAL MG1 1 71 ARG H . . 4.480 3.768 3.565 3.962 . 0 0 "[ . 1 . 2 ]" 1
1254 1 70 VAL MG1 1 73 ILE H . . 5.500 4.769 4.317 5.167 . 0 0 "[ . 1 . 2 ]" 1
1255 1 70 VAL MG1 1 73 ILE HB . . 4.460 3.140 2.796 3.465 . 0 0 "[ . 1 . 2 ]" 1
1256 1 70 VAL MG1 1 73 ILE MD . . 3.460 2.162 2.017 2.356 . 0 0 "[ . 1 . 2 ]" 1
1257 1 70 VAL MG2 1 71 ARG H . . 4.500 3.331 2.850 4.255 . 0 0 "[ . 1 . 2 ]" 1
1258 1 70 VAL MG2 1 71 ARG HB2 . . 5.280 5.250 4.850 6.139 0.859 16 1 "[ . 1 .+ 2 ]" 1
1259 1 70 VAL MG2 1 72 GLY H . . 5.500 4.530 3.426 5.175 . 0 0 "[ . 1 . 2 ]" 1
1260 1 70 VAL MG2 1 73 ILE H . . 5.500 3.504 2.441 4.821 . 0 0 "[ . 1 . 2 ]" 1
1261 1 70 VAL MG2 1 73 ILE HB . . 3.230 2.243 2.041 2.868 . 0 0 "[ . 1 . 2 ]" 1
1262 1 70 VAL MG2 1 73 ILE MD . . 4.100 2.223 2.010 2.440 . 0 0 "[ . 1 . 2 ]" 1
1263 1 70 VAL MG2 1 90 LYS HA . . 3.150 2.326 2.029 2.708 . 0 0 "[ . 1 . 2 ]" 1
1264 1 70 VAL MG2 1 90 LYS HB3 . . 4.020 3.279 1.955 3.811 . 0 0 "[ . 1 . 2 ]" 1
1265 1 70 VAL MG2 1 90 LYS QG . . 3.770 2.194 1.893 3.816 0.046 15 0 "[ . 1 . 2 ]" 1
1266 1 70 VAL MG2 1 91 GLY H . . 4.540 3.647 3.125 4.186 . 0 0 "[ . 1 . 2 ]" 1
1267 1 71 ARG H 1 71 ARG HB3 . . 4.120 2.961 2.423 3.812 . 0 0 "[ . 1 . 2 ]" 1
1268 1 71 ARG H 1 72 GLY H . . 4.180 2.964 2.275 3.357 . 0 0 "[ . 1 . 2 ]" 1
1269 1 71 ARG H 1 92 ALA H . . 5.210 4.878 4.299 5.276 0.066 17 0 "[ . 1 . 2 ]" 1
1270 1 71 ARG H 1 92 ALA MB . . 5.500 4.750 3.480 5.518 0.018 17 0 "[ . 1 . 2 ]" 1
1271 1 71 ARG HA 1 71 ARG QG . . 3.920 2.271 2.044 2.514 . 0 0 "[ . 1 . 2 ]" 1
1272 1 71 ARG HA 1 91 GLY H . . 3.790 2.551 2.135 3.347 . 0 0 "[ . 1 . 2 ]" 1
1273 1 71 ARG HA 1 91 GLY QA . . 4.090 3.193 2.701 3.766 . 0 0 "[ . 1 . 2 ]" 1
1274 1 71 ARG HA 1 92 ALA H . . 3.260 2.776 2.406 3.349 0.089 4 0 "[ . 1 . 2 ]" 1
1275 1 71 ARG HA 1 92 ALA MB . . 4.560 3.860 2.824 4.518 . 0 0 "[ . 1 . 2 ]" 1
1276 1 71 ARG HB2 1 71 ARG QD . . 3.910 2.309 2.095 2.762 . 0 0 "[ . 1 . 2 ]" 1
1277 1 71 ARG HB2 1 72 GLY H . . 3.590 3.153 1.834 3.794 0.204 18 0 "[ . 1 . 2 ]" 1
1278 1 71 ARG HB2 1 92 ALA H . . 5.500 4.736 3.968 5.572 0.072 13 0 "[ . 1 . 2 ]" 1
1279 1 71 ARG HB3 1 71 ARG QD . . 3.640 2.803 2.560 3.128 . 0 0 "[ . 1 . 2 ]" 1
1280 1 71 ARG HB3 1 72 GLY H . . 4.020 2.279 1.984 2.804 . 0 0 "[ . 1 . 2 ]" 1
1281 1 71 ARG HB3 1 92 ALA H . . 5.500 5.325 4.800 5.573 0.073 3 0 "[ . 1 . 2 ]" 1
1282 1 71 ARG QD 1 72 GLY H . . 5.500 4.447 3.951 4.892 . 0 0 "[ . 1 . 2 ]" 1
1283 1 71 ARG QD 1 92 ALA H . . 5.500 4.904 4.364 5.303 . 0 0 "[ . 1 . 2 ]" 1
1284 1 71 ARG QD 1 93 SER H . . 5.500 4.829 4.390 5.074 . 0 0 "[ . 1 . 2 ]" 1
1285 1 71 ARG QD 1 93 SER HA . . 4.120 2.703 2.375 2.949 . 0 0 "[ . 1 . 2 ]" 1
1286 1 71 ARG QD 1 93 SER QB . . 4.700 3.273 2.754 3.822 . 0 0 "[ . 1 . 2 ]" 1
1287 1 71 ARG QD 1 94 GLY H . . 5.000 4.289 3.900 4.717 . 0 0 "[ . 1 . 2 ]" 1
1288 1 71 ARG QG 1 72 GLY H . . 4.240 3.364 2.458 3.894 . 0 0 "[ . 1 . 2 ]" 1
1289 1 71 ARG QG 1 91 GLY H . . 5.220 4.039 3.658 4.850 . 0 0 "[ . 1 . 2 ]" 1
1290 1 71 ARG QG 1 91 GLY QA . . 5.070 3.564 2.687 4.638 . 0 0 "[ . 1 . 2 ]" 1
1291 1 71 ARG QG 1 93 SER QB . . 5.120 4.111 3.466 4.907 . 0 0 "[ . 1 . 2 ]" 1
1292 1 72 GLY H 1 91 GLY H . . 5.500 5.187 4.739 5.560 0.060 20 0 "[ . 1 . 2 ]" 1
1293 1 72 GLY HA2 1 73 ILE H . . 3.280 3.140 2.415 3.557 0.277 14 0 "[ . 1 . 2 ]" 1
1294 1 73 ILE H 1 73 ILE MD . . 5.500 4.378 4.186 4.720 . 0 0 "[ . 1 . 2 ]" 1
1295 1 73 ILE H 1 73 ILE HG12 . . 5.500 4.830 4.442 5.081 . 0 0 "[ . 1 . 2 ]" 1
1296 1 73 ILE H 1 73 ILE HG13 . . 5.500 4.372 4.136 4.620 . 0 0 "[ . 1 . 2 ]" 1
1297 1 73 ILE H 1 73 ILE MG . . 3.910 2.775 1.822 3.581 . 0 0 "[ . 1 . 2 ]" 1
1298 1 73 ILE H 1 74 GLY H . . 5.500 4.661 4.329 4.786 . 0 0 "[ . 1 . 2 ]" 1
1299 1 73 ILE HA 1 73 ILE HB . . 2.900 2.420 2.267 2.530 . 0 0 "[ . 1 . 2 ]" 1
1300 1 73 ILE HA 1 73 ILE MD . . 3.720 3.570 3.370 3.695 . 0 0 "[ . 1 . 2 ]" 1
1301 1 73 ILE HA 1 73 ILE MG . . 3.720 3.303 3.267 3.346 . 0 0 "[ . 1 . 2 ]" 1
1302 1 73 ILE HA 1 77 ALA MB . . 3.760 4.300 4.077 5.405 1.645 7 10 "[ ** .*+* 1 * * - * *]" 1
1303 1 73 ILE HB 1 73 ILE MD . . 3.290 2.267 2.191 2.321 . 0 0 "[ . 1 . 2 ]" 1
1304 1 73 ILE HB 1 74 GLY H . . 5.500 3.686 3.478 3.988 . 0 0 "[ . 1 . 2 ]" 1
1305 1 73 ILE MD 1 73 ILE MG . . 3.610 2.183 2.098 2.325 . 0 0 "[ . 1 . 2 ]" 1
1306 1 73 ILE MD 1 74 GLY H . . 5.010 3.520 3.400 3.792 . 0 0 "[ . 1 . 2 ]" 1
1307 1 73 ILE MD 1 77 ALA H . . 5.500 4.393 4.152 4.650 . 0 0 "[ . 1 . 2 ]" 1
1308 1 73 ILE MD 1 77 ALA MB . . 3.440 2.118 1.956 2.776 . 0 0 "[ . 1 . 2 ]" 1
1309 1 73 ILE MD 1 78 ILE H . . 4.350 3.724 3.412 4.210 . 0 0 "[ . 1 . 2 ]" 1
1310 1 73 ILE MD 1 78 ILE HA . . 3.770 3.711 3.331 3.966 0.196 21 0 "[ . 1 . 2 ]" 1
1311 1 73 ILE MD 1 78 ILE QG . . 4.900 3.828 3.390 4.288 . 0 0 "[ . 1 . 2 ]" 1
1312 1 73 ILE HG12 1 74 GLY H . . 5.070 1.882 1.654 2.369 . 0 0 "[ . 1 . 2 ]" 1
1313 1 73 ILE HG12 1 77 ALA H . . 5.500 3.945 3.673 4.319 . 0 0 "[ . 1 . 2 ]" 1
1314 1 73 ILE HG12 1 78 ILE H . . 4.580 3.416 3.053 4.175 . 0 0 "[ . 1 . 2 ]" 1
1315 1 73 ILE HG13 1 74 GLY H . . 4.640 2.356 1.939 2.946 . 0 0 "[ . 1 . 2 ]" 1
1316 1 73 ILE MG 1 74 GLY H . . 5.500 2.555 1.852 3.485 . 0 0 "[ . 1 . 2 ]" 1
1317 1 73 ILE MG 1 78 ILE H . . 5.170 4.468 4.074 5.077 . 0 0 "[ . 1 . 2 ]" 1
1318 1 73 ILE MG 1 78 ILE HA . . 3.750 4.823 4.773 4.843 1.093 7 22 [******+-**************] 1
1319 1 73 ILE MG 1 78 ILE QG . . 4.400 3.332 2.940 3.667 . 0 0 "[ . 1 . 2 ]" 1
1320 1 73 ILE MG 1 90 LYS HE3 . . 4.790 4.295 3.595 4.897 0.107 6 0 "[ . 1 . 2 ]" 1
1321 1 73 ILE MG 1 90 LYS QG . . 3.790 2.327 1.935 4.522 0.732 15 1 "[ . 1 + 2 ]" 1
1322 1 73 ILE MG 1 91 GLY H . . 5.500 4.807 4.138 5.423 . 0 0 "[ . 1 . 2 ]" 1
1323 1 74 GLY H 1 77 ALA H . . 5.500 3.940 3.630 4.758 . 0 0 "[ . 1 . 2 ]" 1
1324 1 74 GLY H 1 77 ALA MB . . 4.850 3.081 2.536 4.646 . 0 0 "[ . 1 . 2 ]" 1
1325 1 74 GLY H 1 78 ILE H . . 5.500 4.187 3.673 4.957 . 0 0 "[ . 1 . 2 ]" 1
1326 1 74 GLY QA 1 75 ARG H . . 3.610 2.263 2.144 2.413 . 0 0 "[ . 1 . 2 ]" 1
1327 1 74 GLY QA 1 77 ALA H . . 5.500 4.020 3.650 4.284 . 0 0 "[ . 1 . 2 ]" 1
1328 1 74 GLY QA 1 78 ILE H . . 4.600 4.807 4.569 5.176 0.576 7 2 "[ - . + 1 . 2 ]" 1
1329 1 75 ARG H 1 75 ARG QG . . 4.770 3.865 3.089 4.208 . 0 0 "[ . 1 . 2 ]" 1
1330 1 75 ARG H 1 77 ALA H . . 5.500 4.419 3.725 4.666 . 0 0 "[ . 1 . 2 ]" 1
1331 1 75 ARG HA 1 75 ARG QD . . 4.080 2.322 2.097 2.822 . 0 0 "[ . 1 . 2 ]" 1
1332 1 75 ARG HA 1 75 ARG QG . . 4.010 2.832 2.356 3.230 . 0 0 "[ . 1 . 2 ]" 1
1333 1 75 ARG HA 1 78 ILE H . . 4.170 3.119 2.924 3.354 . 0 0 "[ . 1 . 2 ]" 1
1334 1 75 ARG HA 1 78 ILE HB . . 2.750 2.451 2.092 2.879 0.129 7 0 "[ . 1 . 2 ]" 1
1335 1 75 ARG HA 1 78 ILE MD . . 3.480 3.550 2.431 4.433 0.953 16 6 "[ *- * 1 *.+ 2* ]" 1
1336 1 75 ARG HA 1 78 ILE QG . . 4.860 2.741 2.051 3.557 . 0 0 "[ . 1 . 2 ]" 1
1337 1 75 ARG HA 1 79 ALA H . . 4.410 4.075 3.808 4.504 0.094 7 0 "[ . 1 . 2 ]" 1
1338 1 75 ARG QD 1 76 ARG QG . . 4.330 6.110 4.938 7.028 2.698 17 22 [*****-**********+*****] 1
1339 1 75 ARG QD 1 78 ILE MD . . 4.440 4.380 3.851 4.615 0.175 12 0 "[ . 1 . 2 ]" 1
1340 1 75 ARG QD 1 79 ALA HA . . 4.600 4.541 4.096 4.764 0.164 18 0 "[ . 1 . 2 ]" 1
1341 1 75 ARG QD 1 79 ALA MB . . 4.640 3.398 2.814 3.864 . 0 0 "[ . 1 . 2 ]" 1
1342 1 76 ARG HA 1 76 ARG QD . . 4.010 3.704 2.220 4.166 0.156 21 0 "[ . 1 . 2 ]" 1
1343 1 76 ARG HA 1 76 ARG QG . . 3.770 2.949 2.210 3.352 . 0 0 "[ . 1 . 2 ]" 1
1344 1 76 ARG HA 1 79 ALA MB . . 3.050 2.838 2.565 3.173 0.123 15 0 "[ . 1 . 2 ]" 1
1345 1 76 ARG QB 1 77 ALA H . . 4.270 3.275 2.577 3.867 . 0 0 "[ . 1 . 2 ]" 1
1346 1 76 ARG QB 1 77 ALA HA . . 3.990 4.421 4.155 4.725 0.735 7 8 "[ -*. +* 1 * *. 2**]" 1
1347 1 77 ALA H 1 77 ALA MB . . 3.160 2.277 2.190 2.468 . 0 0 "[ . 1 . 2 ]" 1
1348 1 77 ALA H 1 78 ILE HA . . 5.500 4.994 4.623 5.209 . 0 0 "[ . 1 . 2 ]" 1
1349 1 77 ALA H 1 78 ILE MD . . 5.500 4.403 3.339 5.369 . 0 0 "[ . 1 . 2 ]" 1
1350 1 77 ALA H 1 79 ALA MB . . 5.500 4.585 4.057 4.931 . 0 0 "[ . 1 . 2 ]" 1
1351 1 77 ALA HA 1 80 ALA H . . 3.780 3.123 2.668 3.365 . 0 0 "[ . 1 . 2 ]" 1
1352 1 77 ALA HA 1 80 ALA MB . . 4.310 2.819 2.537 3.078 . 0 0 "[ . 1 . 2 ]" 1
1353 1 77 ALA MB 1 78 ILE H . . 4.020 2.834 2.613 3.399 . 0 0 "[ . 1 . 2 ]" 1
1354 1 77 ALA MB 1 78 ILE HA . . 4.620 4.128 3.964 4.356 . 0 0 "[ . 1 . 2 ]" 1
1355 1 78 ILE H 1 78 ILE HB . . 3.050 2.360 2.055 2.665 . 0 0 "[ . 1 . 2 ]" 1
1356 1 78 ILE H 1 78 ILE MD . . 3.930 2.778 1.879 3.729 . 0 0 "[ . 1 . 2 ]" 1
1357 1 78 ILE H 1 78 ILE QG . . 3.520 2.684 2.033 3.366 . 0 0 "[ . 1 . 2 ]" 1
1358 1 78 ILE H 1 78 ILE MG . . 4.630 3.720 3.578 3.831 . 0 0 "[ . 1 . 2 ]" 1
1359 1 78 ILE H 1 79 ALA MB . . 5.190 4.380 3.936 4.678 . 0 0 "[ . 1 . 2 ]" 1
1360 1 78 ILE H 1 88 VAL QG . . 4.780 4.475 3.961 4.807 0.027 6 0 "[ . 1 . 2 ]" 1
1361 1 78 ILE HA 1 78 ILE QG . . 3.390 2.761 2.307 3.072 . 0 0 "[ . 1 . 2 ]" 1
1362 1 78 ILE HA 1 78 ILE MG . . 3.040 2.577 2.284 2.857 . 0 0 "[ . 1 . 2 ]" 1
1363 1 78 ILE HA 1 80 ALA H . . 4.990 3.917 3.708 4.156 . 0 0 "[ . 1 . 2 ]" 1
1364 1 78 ILE HA 1 80 ALA MB . . 3.980 4.700 4.460 4.957 0.977 13 21 "[****-*** ***+*********]" 1
1365 1 78 ILE HA 1 81 PHE H . . 3.990 3.781 3.443 3.971 . 0 0 "[ . 1 . 2 ]" 1
1366 1 78 ILE HA 1 81 PHE QB . . 3.890 3.079 2.549 3.280 . 0 0 "[ . 1 . 2 ]" 1
1367 1 78 ILE HA 1 82 GLU H . . 4.550 4.155 3.959 4.389 . 0 0 "[ . 1 . 2 ]" 1
1368 1 78 ILE HA 1 88 VAL QG . . 3.230 2.643 2.216 2.940 . 0 0 "[ . 1 . 2 ]" 1
1369 1 78 ILE HB 1 78 ILE MD . . 3.330 2.955 2.425 3.297 . 0 0 "[ . 1 . 2 ]" 1
1370 1 78 ILE HB 1 79 ALA H . . 3.190 2.651 2.308 2.940 . 0 0 "[ . 1 . 2 ]" 1
1371 1 78 ILE MD 1 79 ALA H . . 4.710 4.562 4.112 4.847 0.137 16 0 "[ . 1 . 2 ]" 1
1372 1 78 ILE MD 1 90 LYS HE2 . . 4.270 3.846 2.952 4.444 0.174 12 0 "[ . 1 . 2 ]" 1
1373 1 78 ILE MD 1 90 LYS HE3 . . 4.420 4.022 2.979 4.581 0.161 19 0 "[ . 1 . 2 ]" 1
1374 1 78 ILE MD 1 113 TYR QB . . 5.060 5.425 3.769 6.704 1.644 11 11 "[* . * **+* *- *** ]" 1
1375 1 78 ILE QG 1 79 ALA H . . 5.500 4.218 3.733 4.625 . 0 0 "[ . 1 . 2 ]" 1
1376 1 78 ILE QG 1 113 TYR QD . . 4.780 3.999 3.438 4.320 . 0 0 "[ . 1 . 2 ]" 1
1377 1 78 ILE MG 1 79 ALA H . . 4.190 3.192 2.656 3.616 . 0 0 "[ . 1 . 2 ]" 1
1378 1 78 ILE MG 1 79 ALA HA . . 3.900 3.391 3.021 3.717 . 0 0 "[ . 1 . 2 ]" 1
1379 1 78 ILE MG 1 79 ALA MB . . 5.000 3.871 3.213 4.300 . 0 0 "[ . 1 . 2 ]" 1
1380 1 78 ILE MG 1 80 ALA H . . 5.500 4.706 4.540 4.970 . 0 0 "[ . 1 . 2 ]" 1
1381 1 78 ILE MG 1 82 GLU H . . 5.110 3.870 3.658 4.053 . 0 0 "[ . 1 . 2 ]" 1
1382 1 78 ILE MG 1 82 GLU HB2 . . 5.490 3.951 3.162 4.446 . 0 0 "[ . 1 . 2 ]" 1
1383 1 78 ILE MG 1 82 GLU HG3 . . 3.720 2.345 2.168 2.538 . 0 0 "[ . 1 . 2 ]" 1
1384 1 78 ILE MG 1 83 ALA H . . 5.500 6.200 5.884 6.474 0.974 6 20 "[*****+*-*** **.*******]" 1
1385 1 78 ILE MG 1 88 VAL H . . 5.500 5.729 5.015 6.709 1.209 10 7 "[* . + * ** -*2 ]" 1
1386 1 78 ILE MG 1 113 TYR QD . . 4.510 3.841 2.705 4.705 0.195 9 0 "[ . 1 . 2 ]" 1
1387 1 79 ALA H 1 79 ALA MB . . 2.610 2.195 2.123 2.257 . 0 0 "[ . 1 . 2 ]" 1
1388 1 79 ALA H 1 82 GLU H . . 5.500 4.797 4.729 4.890 . 0 0 "[ . 1 . 2 ]" 1
1389 1 79 ALA HA 1 81 PHE H . . 5.150 4.883 4.620 5.231 0.081 21 0 "[ . 1 . 2 ]" 1
1390 1 79 ALA HA 1 82 GLU H . . 3.680 3.398 3.117 3.737 0.057 21 0 "[ . 1 . 2 ]" 1
1391 1 79 ALA HA 1 82 GLU HB2 . . 3.240 2.170 2.068 2.351 . 0 0 "[ . 1 . 2 ]" 1
1392 1 79 ALA HA 1 82 GLU HB3 . . 3.550 3.623 3.244 3.682 0.132 16 0 "[ . 1 . 2 ]" 1
1393 1 79 ALA HA 1 82 GLU HG3 . . 4.330 2.917 2.242 4.120 . 0 0 "[ . 1 . 2 ]" 1
1394 1 79 ALA MB 1 80 ALA H . . 3.700 3.159 2.818 3.478 . 0 0 "[ . 1 . 2 ]" 1
1395 1 79 ALA MB 1 81 PHE H . . 5.500 5.131 4.988 5.322 . 0 0 "[ . 1 . 2 ]" 1
1396 1 79 ALA MB 1 82 GLU HG3 . . 5.500 4.397 3.699 5.414 . 0 0 "[ . 1 . 2 ]" 1
1397 1 80 ALA H 1 80 ALA MB . . 2.810 2.236 2.166 2.330 . 0 0 "[ . 1 . 2 ]" 1
1398 1 80 ALA H 1 81 PHE H . . 3.440 2.559 2.340 2.819 . 0 0 "[ . 1 . 2 ]" 1
1399 1 80 ALA H 1 81 PHE HA . . 5.500 5.086 4.891 5.314 . 0 0 "[ . 1 . 2 ]" 1
1400 1 80 ALA H 1 81 PHE QB . . 5.340 4.090 3.489 4.560 . 0 0 "[ . 1 . 2 ]" 1
1401 1 80 ALA H 1 82 GLU H . . 4.670 3.669 3.452 3.921 . 0 0 "[ . 1 . 2 ]" 1
1402 1 80 ALA HA 1 83 ALA MB . . 3.480 3.071 2.303 3.368 . 0 0 "[ . 1 . 2 ]" 1
1403 1 80 ALA MB 1 81 PHE H . . 3.200 2.218 2.021 2.627 . 0 0 "[ . 1 . 2 ]" 1
1404 1 80 ALA MB 1 82 GLU H . . 4.750 4.352 4.242 4.525 . 0 0 "[ . 1 . 2 ]" 1
1405 1 80 ALA MB 1 83 ALA H . . 5.500 4.407 4.133 4.530 . 0 0 "[ . 1 . 2 ]" 1
1406 1 80 ALA MB 1 84 MET H . . 5.500 5.549 5.338 5.615 0.115 11 0 "[ . 1 . 2 ]" 1
1407 1 81 PHE H 1 81 PHE QB . . 3.370 2.186 1.907 2.490 . 0 0 "[ . 1 . 2 ]" 1
1408 1 81 PHE H 1 82 GLU H . . 3.550 2.810 2.665 3.057 . 0 0 "[ . 1 . 2 ]" 1
1409 1 81 PHE H 1 82 GLU HB2 . . 5.500 4.799 4.230 5.199 . 0 0 "[ . 1 . 2 ]" 1
1410 1 81 PHE H 1 82 GLU HG3 . . 5.500 5.087 4.435 5.701 0.201 21 0 "[ . 1 . 2 ]" 1
1411 1 81 PHE H 1 86 VAL HB . . 4.430 4.555 4.538 4.569 0.139 21 0 "[ . 1 . 2 ]" 1
1412 1 81 PHE H 1 86 VAL QG . . 5.500 4.411 4.074 4.600 . 0 0 "[ . 1 . 2 ]" 1
1413 1 81 PHE H 1 88 VAL QG . . 5.020 4.125 3.742 4.570 . 0 0 "[ . 1 . 2 ]" 1
1414 1 81 PHE HA 1 83 ALA H . . 5.500 3.802 3.574 4.055 . 0 0 "[ . 1 . 2 ]" 1
1415 1 81 PHE HA 1 84 MET H . . 4.260 3.568 3.396 3.788 . 0 0 "[ . 1 . 2 ]" 1
1416 1 81 PHE HA 1 84 MET QB . . 3.960 4.620 4.144 5.080 1.120 16 16 "[* *-******** *+ *** ]" 1
1417 1 81 PHE HA 1 84 MET HG2 . . 4.050 3.275 2.451 4.173 0.123 19 0 "[ . 1 . 2 ]" 1
1418 1 81 PHE HA 1 84 MET HG3 . . 4.240 2.634 2.092 3.597 . 0 0 "[ . 1 . 2 ]" 1
1419 1 81 PHE HA 1 85 GLY H . . 5.360 4.776 4.266 5.160 . 0 0 "[ . 1 . 2 ]" 1
1420 1 81 PHE HA 1 86 VAL H . . 4.560 3.240 2.680 3.606 . 0 0 "[ . 1 . 2 ]" 1
1421 1 81 PHE HA 1 86 VAL HB . . 2.840 2.103 1.899 2.268 . 0 0 "[ . 1 . 2 ]" 1
1422 1 81 PHE HA 1 86 VAL QG . . 4.810 2.907 2.589 3.118 . 0 0 "[ . 1 . 2 ]" 1
1423 1 81 PHE QB 1 82 GLU H . . 3.830 2.577 2.403 2.754 . 0 0 "[ . 1 . 2 ]" 1
1424 1 81 PHE QB 1 83 ALA H . . 5.500 4.582 4.433 4.738 . 0 0 "[ . 1 . 2 ]" 1
1425 1 81 PHE QB 1 84 MET H . . 5.500 4.817 4.674 5.043 . 0 0 "[ . 1 . 2 ]" 1
1426 1 81 PHE QB 1 86 VAL H . . 4.470 3.502 3.064 3.975 . 0 0 "[ . 1 . 2 ]" 1
1427 1 81 PHE QB 1 86 VAL HB . . 3.520 2.578 2.141 3.652 0.132 9 0 "[ . 1 . 2 ]" 1
1428 1 81 PHE QB 1 86 VAL QG . . 3.870 2.379 2.115 2.949 . 0 0 "[ . 1 . 2 ]" 1
1429 1 81 PHE QB 1 88 VAL H . . 5.500 4.789 3.947 5.131 . 0 0 "[ . 1 . 2 ]" 1
1430 1 81 PHE QB 1 88 VAL QG . . 3.460 2.381 1.981 2.878 . 0 0 "[ . 1 . 2 ]" 1
1431 1 82 GLU H 1 82 GLU HB2 . . 3.310 2.362 2.109 2.514 . 0 0 "[ . 1 . 2 ]" 1
1432 1 82 GLU H 1 82 GLU HB3 . . 3.460 3.543 3.433 3.571 0.111 6 0 "[ . 1 . 2 ]" 1
1433 1 82 GLU H 1 82 GLU HG2 . . 3.690 3.041 2.399 3.673 . 0 0 "[ . 1 . 2 ]" 1
1434 1 82 GLU H 1 82 GLU HG3 . . 3.380 2.732 2.191 3.334 . 0 0 "[ . 1 . 2 ]" 1
1435 1 82 GLU H 1 83 ALA H . . 3.350 2.957 2.825 3.060 . 0 0 "[ . 1 . 2 ]" 1
1436 1 82 GLU H 1 83 ALA MB . . 5.500 4.611 4.445 4.734 . 0 0 "[ . 1 . 2 ]" 1
1437 1 82 GLU H 1 84 MET H . . 4.890 4.293 4.215 4.500 . 0 0 "[ . 1 . 2 ]" 1
1438 1 82 GLU H 1 85 GLY H . . 5.500 4.927 4.467 5.326 . 0 0 "[ . 1 . 2 ]" 1
1439 1 82 GLU H 1 86 VAL H . . 5.130 4.686 4.488 4.890 . 0 0 "[ . 1 . 2 ]" 1
1440 1 82 GLU H 1 86 VAL HB . . 5.470 4.983 4.740 5.338 . 0 0 "[ . 1 . 2 ]" 1
1441 1 82 GLU H 1 86 VAL QG . . 5.500 5.127 4.976 5.271 . 0 0 "[ . 1 . 2 ]" 1
1442 1 82 GLU H 1 88 VAL QG . . 5.180 4.298 3.945 4.573 . 0 0 "[ . 1 . 2 ]" 1
1443 1 82 GLU HA 1 82 GLU HB3 . . 3.040 2.593 2.518 2.713 . 0 0 "[ . 1 . 2 ]" 1
1444 1 82 GLU HA 1 82 GLU HG2 . . 3.220 2.423 2.175 2.699 . 0 0 "[ . 1 . 2 ]" 1
1445 1 82 GLU HA 1 82 GLU HG3 . . 3.820 3.402 2.972 3.768 . 0 0 "[ . 1 . 2 ]" 1
1446 1 82 GLU HA 1 83 ALA H . . 3.450 3.544 3.394 3.632 0.182 8 0 "[ . 1 . 2 ]" 1
1447 1 82 GLU HA 1 84 MET H . . 4.100 3.717 3.490 4.099 . 0 0 "[ . 1 . 2 ]" 1
1448 1 82 GLU HA 1 85 GLY H . . 3.440 3.067 2.722 3.550 0.110 17 0 "[ . 1 . 2 ]" 1
1449 1 82 GLU HA 1 86 VAL H . . 3.920 3.850 3.345 4.063 0.143 16 0 "[ . 1 . 2 ]" 1
1450 1 82 GLU HB2 1 83 ALA H . . 3.520 3.290 2.955 3.563 0.043 2 0 "[ . 1 . 2 ]" 1
1451 1 82 GLU HB3 1 83 ALA H . . 3.570 3.972 3.493 4.269 0.699 19 9 "[** *.* -* *. *+2 ]" 1
1452 1 82 GLU HB3 1 83 ALA HA . . 4.420 4.393 4.036 4.558 0.138 19 0 "[ . 1 . 2 ]" 1
1453 1 82 GLU HB3 1 85 GLY H . . 5.500 5.024 4.531 5.328 . 0 0 "[ . 1 . 2 ]" 1
1454 1 82 GLU HG2 1 88 VAL QG . . 4.400 4.488 4.059 4.601 0.201 19 0 "[ . 1 . 2 ]" 1
1455 1 82 GLU HG3 1 83 ALA H . . 5.040 5.050 4.827 5.182 0.142 21 0 "[ . 1 . 2 ]" 1
1456 1 82 GLU HG3 1 88 VAL QG . . 5.200 4.557 3.632 5.382 0.182 13 0 "[ . 1 . 2 ]" 1
1457 1 83 ALA H 1 83 ALA MB . . 2.610 2.259 2.189 2.367 . 0 0 "[ . 1 . 2 ]" 1
1458 1 83 ALA H 1 84 MET H . . 3.370 2.398 2.137 2.618 . 0 0 "[ . 1 . 2 ]" 1
1459 1 83 ALA H 1 84 MET HA . . 5.500 5.121 4.860 5.290 . 0 0 "[ . 1 . 2 ]" 1
1460 1 83 ALA H 1 84 MET HG2 . . 4.870 3.516 3.103 4.047 . 0 0 "[ . 1 . 2 ]" 1
1461 1 83 ALA H 1 84 MET HG3 . . 5.500 4.208 3.721 5.250 . 0 0 "[ . 1 . 2 ]" 1
1462 1 83 ALA H 1 86 VAL HB . . 5.500 5.212 4.835 5.548 0.048 3 0 "[ . 1 . 2 ]" 1
1463 1 83 ALA HA 1 85 GLY H . . 4.310 4.284 3.996 4.428 0.118 10 0 "[ . 1 . 2 ]" 1
1464 1 83 ALA MB 1 84 MET H . . 3.270 3.000 2.554 3.199 . 0 0 "[ . 1 . 2 ]" 1
1465 1 83 ALA MB 1 84 MET HA . . 4.990 4.164 3.924 4.315 . 0 0 "[ . 1 . 2 ]" 1
1466 1 83 ALA MB 1 84 MET QB . . 4.040 3.801 3.371 4.177 0.137 20 0 "[ . 1 . 2 ]" 1
1467 1 83 ALA MB 1 84 MET HG2 . . 4.720 2.844 2.349 3.198 . 0 0 "[ . 1 . 2 ]" 1
1468 1 83 ALA MB 1 84 MET HG3 . . 4.560 4.195 3.805 4.573 0.013 17 0 "[ . 1 . 2 ]" 1
1469 1 83 ALA MB 1 85 GLY H . . 5.230 4.607 4.375 4.753 . 0 0 "[ . 1 . 2 ]" 1
1470 1 83 ALA MB 1 86 VAL H . . 5.500 5.555 5.391 5.606 0.106 15 0 "[ . 1 . 2 ]" 1
1471 1 83 ALA MB 1 86 VAL QG . . 5.350 5.133 4.821 5.366 0.016 17 0 "[ . 1 . 2 ]" 1
1472 1 84 MET H 1 84 MET QB . . 3.330 3.180 3.045 3.329 . 0 0 "[ . 1 . 2 ]" 1
1473 1 84 MET H 1 84 MET HG2 . . 3.690 2.373 1.969 2.769 . 0 0 "[ . 1 . 2 ]" 1
1474 1 84 MET H 1 84 MET HG3 . . 3.700 2.579 2.349 3.562 . 0 0 "[ . 1 . 2 ]" 1
1475 1 84 MET H 1 85 GLY H . . 3.020 2.184 1.997 2.466 . 0 0 "[ . 1 . 2 ]" 1
1476 1 84 MET H 1 85 GLY HA3 . . 4.710 4.833 4.712 5.145 0.435 12 0 "[ . 1 . 2 ]" 1
1477 1 84 MET H 1 86 VAL H . . 4.410 3.133 3.018 3.481 . 0 0 "[ . 1 . 2 ]" 1
1478 1 84 MET H 1 86 VAL HB . . 4.510 4.056 3.778 4.268 . 0 0 "[ . 1 . 2 ]" 1
1479 1 84 MET H 1 86 VAL QG . . 5.430 3.937 3.664 4.137 . 0 0 "[ . 1 . 2 ]" 1
1480 1 84 MET HA 1 84 MET QB . . 2.790 2.126 2.089 2.156 . 0 0 "[ . 1 . 2 ]" 1
1481 1 84 MET HA 1 84 MET HG2 . . 3.560 3.633 3.556 3.668 0.108 5 0 "[ . 1 . 2 ]" 1
1482 1 84 MET HA 1 84 MET HG3 . . 3.660 3.826 3.713 4.225 0.565 13 1 "[ . 1 + . 2 ]" 1
1483 1 84 MET HA 1 85 GLY HA3 . . 4.500 4.530 4.400 4.616 0.116 8 0 "[ . 1 . 2 ]" 1
1484 1 84 MET QB 1 85 GLY H . . 4.170 3.966 3.622 4.049 . 0 0 "[ . 1 . 2 ]" 1
1485 1 84 MET QB 1 86 VAL H . . 4.170 3.875 3.648 4.087 . 0 0 "[ . 1 . 2 ]" 1
1486 1 84 MET QB 1 86 VAL HB . . 3.950 4.046 3.612 4.105 0.155 20 0 "[ . 1 . 2 ]" 1
1487 1 84 MET QB 1 86 VAL QG . . 3.980 2.294 2.043 2.522 . 0 0 "[ . 1 . 2 ]" 1
1488 1 84 MET HG2 1 86 VAL HB . . 3.910 3.842 3.311 4.040 0.130 4 0 "[ . 1 . 2 ]" 1
1489 1 84 MET HG2 1 86 VAL QG . . 4.950 3.433 2.745 3.620 . 0 0 "[ . 1 . 2 ]" 1
1490 1 84 MET HG3 1 85 GLY H . . 4.890 3.841 3.337 4.973 0.083 13 0 "[ . 1 . 2 ]" 1
1491 1 84 MET HG3 1 86 VAL H . . 5.500 2.830 2.477 4.253 . 0 0 "[ . 1 . 2 ]" 1
1492 1 84 MET HG3 1 86 VAL HB . . 3.280 2.354 2.077 3.435 0.155 13 0 "[ . 1 . 2 ]" 1
1493 1 84 MET HG3 1 86 VAL QG . . 4.790 2.198 2.038 2.585 . 0 0 "[ . 1 . 2 ]" 1
1494 1 85 GLY H 1 86 VAL H . . 3.340 2.645 2.128 2.857 . 0 0 "[ . 1 . 2 ]" 1
1495 1 85 GLY H 1 86 VAL HB . . 4.790 4.595 4.031 4.814 0.024 14 0 "[ . 1 . 2 ]" 1
1496 1 85 GLY H 1 86 VAL QG . . 5.210 4.181 3.705 4.388 . 0 0 "[ . 1 . 2 ]" 1
1497 1 85 GLY HA2 1 86 VAL H . . 3.600 2.954 2.791 3.134 . 0 0 "[ . 1 . 2 ]" 1
1498 1 85 GLY HA2 1 87 LYS H . . 5.500 5.526 5.233 5.579 0.079 18 0 "[ . 1 . 2 ]" 1
1499 1 86 VAL H 1 86 VAL HB . . 3.210 2.261 2.187 2.350 . 0 0 "[ . 1 . 2 ]" 1
1500 1 86 VAL H 1 86 VAL QG . . 3.460 2.647 2.465 2.871 . 0 0 "[ . 1 . 2 ]" 1
1501 1 86 VAL H 1 87 LYS H . . 4.850 4.436 4.315 4.497 . 0 0 "[ . 1 . 2 ]" 1
1502 1 86 VAL H 1 87 LYS HA . . 5.330 5.164 4.757 5.424 0.094 21 0 "[ . 1 . 2 ]" 1
1503 1 86 VAL HA 1 86 VAL QG . . 2.700 2.061 2.010 2.106 . 0 0 "[ . 1 . 2 ]" 1
1504 1 86 VAL HA 1 87 LYS H . . 2.850 2.139 2.061 2.209 . 0 0 "[ . 1 . 2 ]" 1
1505 1 86 VAL HA 1 87 LYS QB . . 3.980 4.042 3.921 4.119 0.139 18 0 "[ . 1 . 2 ]" 1
1506 1 86 VAL QG 1 87 LYS H . . 3.440 3.030 2.800 3.288 . 0 0 "[ . 1 . 2 ]" 1
1507 1 86 VAL QG 1 87 LYS HA . . 4.560 4.290 4.098 4.523 . 0 0 "[ . 1 . 2 ]" 1
1508 1 87 LYS H 1 87 LYS QB . . 3.150 2.223 2.085 2.319 . 0 0 "[ . 1 . 2 ]" 1
1509 1 87 LYS H 1 87 LYS HG2 . . 4.420 4.439 4.287 4.506 0.086 10 0 "[ . 1 . 2 ]" 1
1510 1 87 LYS H 1 87 LYS HG3 . . 4.310 4.424 4.202 4.453 0.143 11 0 "[ . 1 . 2 ]" 1
1511 1 87 LYS H 1 88 VAL H . . 4.820 4.669 4.582 4.729 . 0 0 "[ . 1 . 2 ]" 1
1512 1 87 LYS HA 1 87 LYS QD . . 3.890 3.803 2.812 4.049 0.159 7 0 "[ . 1 . 2 ]" 1
1513 1 87 LYS HA 1 87 LYS HG2 . . 3.870 3.134 2.448 3.805 . 0 0 "[ . 1 . 2 ]" 1
1514 1 87 LYS HA 1 87 LYS HG3 . . 4.030 2.553 2.312 2.855 . 0 0 "[ . 1 . 2 ]" 1
1515 1 87 LYS HA 1 88 VAL H . . 2.810 2.271 2.167 2.349 . 0 0 "[ . 1 . 2 ]" 1
1516 1 87 LYS HA 1 88 VAL QG . . 3.810 3.285 3.089 3.582 . 0 0 "[ . 1 . 2 ]" 1
1517 1 87 LYS QB 1 88 VAL H . . 3.720 3.639 3.540 3.762 0.042 6 0 "[ . 1 . 2 ]" 1
1518 1 87 LYS QD 1 87 LYS HG2 . . 2.610 2.260 2.068 2.513 . 0 0 "[ . 1 . 2 ]" 1
1519 1 87 LYS QD 1 88 VAL H . . 4.160 4.027 3.513 4.310 0.150 2 0 "[ . 1 . 2 ]" 1
1520 1 87 LYS QD 1 89 ILE H . . 5.500 5.151 4.330 5.875 0.375 18 0 "[ . 1 . 2 ]" 1
1521 1 87 LYS QD 1 89 ILE MD . . 3.760 3.274 2.329 3.929 0.169 18 0 "[ . 1 . 2 ]" 1
1522 1 87 LYS QE 1 87 LYS HG2 . . 3.810 2.802 2.090 3.496 . 0 0 "[ . 1 . 2 ]" 1
1523 1 87 LYS QE 1 89 ILE MD . . 4.290 3.468 2.005 4.206 . 0 0 "[ . 1 . 2 ]" 1
1524 1 87 LYS HG2 1 88 VAL H . . 4.090 2.880 2.138 4.179 0.089 1 0 "[ . 1 . 2 ]" 1
1525 1 87 LYS HG3 1 88 VAL H . . 4.510 2.769 2.156 3.676 . 0 0 "[ . 1 . 2 ]" 1
1526 1 88 VAL H 1 88 VAL HB . . 3.210 3.006 2.655 3.308 0.098 12 0 "[ . 1 . 2 ]" 1
1527 1 88 VAL H 1 88 VAL QG . . 3.250 2.428 2.019 2.848 . 0 0 "[ . 1 . 2 ]" 1
1528 1 88 VAL H 1 89 ILE H . . 4.690 4.022 3.738 4.271 . 0 0 "[ . 1 . 2 ]" 1
1529 1 88 VAL H 1 89 ILE MD . . 5.500 5.534 5.264 5.601 0.101 8 0 "[ . 1 . 2 ]" 1
1530 1 88 VAL HA 1 88 VAL QG . . 2.680 2.249 2.089 2.449 . 0 0 "[ . 1 . 2 ]" 1
1531 1 88 VAL HA 1 89 ILE H . . 2.750 2.149 2.047 2.268 . 0 0 "[ . 1 . 2 ]" 1
1532 1 88 VAL HA 1 89 ILE HA . . 4.620 4.486 4.426 4.533 . 0 0 "[ . 1 . 2 ]" 1
1533 1 88 VAL HA 1 89 ILE HG13 . . 4.600 4.300 4.001 4.557 . 0 0 "[ . 1 . 2 ]" 1
1534 1 88 VAL HB 1 89 ILE H . . 4.470 4.340 4.022 4.492 0.022 13 0 "[ . 1 . 2 ]" 1
1535 1 88 VAL QG 1 89 ILE H . . 3.310 3.155 2.620 3.447 0.137 12 0 "[ . 1 . 2 ]" 1
1536 1 88 VAL QG 1 89 ILE HA . . 4.010 4.090 3.777 4.221 0.211 16 0 "[ . 1 . 2 ]" 1
1537 1 88 VAL QG 1 90 LYS H . . 5.010 4.489 3.517 5.002 . 0 0 "[ . 1 . 2 ]" 1
1538 1 88 VAL QG 1 90 LYS HB2 . . 4.720 4.613 4.040 5.205 0.485 17 0 "[ . 1 . 2 ]" 1
1539 1 88 VAL QG 1 90 LYS HE2 . . 4.840 3.544 2.044 4.778 . 0 0 "[ . 1 . 2 ]" 1
1540 1 88 VAL QG 1 90 LYS QG . . 3.240 2.578 2.005 3.415 0.175 15 0 "[ . 1 . 2 ]" 1
1541 1 89 ILE H 1 89 ILE HB . . 3.460 2.221 2.109 2.353 . 0 0 "[ . 1 . 2 ]" 1
1542 1 89 ILE H 1 89 ILE MD . . 4.770 3.658 3.168 4.182 . 0 0 "[ . 1 . 2 ]" 1
1543 1 89 ILE H 1 89 ILE HG12 . . 4.220 3.999 3.667 4.224 0.004 7 0 "[ . 1 . 2 ]" 1
1544 1 89 ILE H 1 89 ILE HG13 . . 4.500 2.819 2.470 3.260 . 0 0 "[ . 1 . 2 ]" 1
1545 1 89 ILE H 1 89 ILE MG . . 4.600 3.646 3.597 3.736 . 0 0 "[ . 1 . 2 ]" 1
1546 1 89 ILE HA 1 89 ILE MD . . 3.670 3.781 3.705 3.904 0.234 17 0 "[ . 1 . 2 ]" 1
1547 1 89 ILE HA 1 89 ILE HG12 . . 4.010 2.478 2.279 2.854 . 0 0 "[ . 1 . 2 ]" 1
1548 1 89 ILE HA 1 89 ILE HG13 . . 3.290 2.680 2.507 3.011 . 0 0 "[ . 1 . 2 ]" 1
1549 1 89 ILE HA 1 89 ILE MG . . 3.180 2.646 2.478 2.793 . 0 0 "[ . 1 . 2 ]" 1
1550 1 89 ILE HA 1 90 LYS H . . 2.980 2.253 2.086 2.389 . 0 0 "[ . 1 . 2 ]" 1
1551 1 89 ILE HA 1 90 LYS QD . . 4.930 4.181 2.625 5.489 0.559 18 2 "[ . 1 . +-2 ]" 1
1552 1 89 ILE HA 1 110 ASP H . . 5.500 4.434 3.776 5.372 . 0 0 "[ . 1 . 2 ]" 1
1553 1 89 ILE HA 1 111 SER H . . 5.480 4.818 4.048 5.565 0.085 20 0 "[ . 1 . 2 ]" 1
1554 1 89 ILE HB 1 110 ASP QB . . 5.470 4.565 4.128 5.018 . 0 0 "[ . 1 . 2 ]" 1
1555 1 89 ILE MD 1 103 TYR QD . . 3.780 2.248 2.043 2.763 . 0 0 "[ . 1 . 2 ]" 1
1556 1 89 ILE MD 1 103 TYR QE . . 3.680 2.409 2.137 2.730 . 0 0 "[ . 1 . 2 ]" 1
1557 1 89 ILE MD 1 109 LYS HA . . 4.680 3.580 2.412 4.820 0.140 4 0 "[ . 1 . 2 ]" 1
1558 1 89 ILE MD 1 110 ASP QB . . 4.670 3.579 2.706 4.734 0.064 20 0 "[ . 1 . 2 ]" 1
1559 1 89 ILE MG 1 90 LYS H . . 3.820 2.733 2.228 3.703 . 0 0 "[ . 1 . 2 ]" 1
1560 1 89 ILE MG 1 90 LYS HA . . 4.970 3.777 3.450 4.465 . 0 0 "[ . 1 . 2 ]" 1
1561 1 89 ILE MG 1 90 LYS HB3 . . 5.500 5.333 4.840 5.902 0.402 16 0 "[ . 1 . 2 ]" 1
1562 1 89 ILE MG 1 91 GLY H . . 5.500 4.978 4.558 5.434 . 0 0 "[ . 1 . 2 ]" 1
1563 1 89 ILE MG 1 92 ALA H . . 5.290 4.213 3.833 4.729 . 0 0 "[ . 1 . 2 ]" 1
1564 1 89 ILE MG 1 108 LEU HG . . 3.870 2.807 2.041 4.041 0.171 18 0 "[ . 1 . 2 ]" 1
1565 1 89 ILE MG 1 109 LYS H . . 4.270 2.754 2.353 3.225 . 0 0 "[ . 1 . 2 ]" 1
1566 1 89 ILE MG 1 109 LYS HA . . 4.750 3.633 2.783 4.604 . 0 0 "[ . 1 . 2 ]" 1
1567 1 89 ILE MG 1 110 ASP H . . 4.820 4.348 3.729 4.931 0.111 2 0 "[ . 1 . 2 ]" 1
1568 1 89 ILE MG 1 110 ASP HA . . 3.650 3.584 2.951 3.808 0.158 15 0 "[ . 1 . 2 ]" 1
1569 1 89 ILE MG 1 111 SER H . . 5.210 4.876 4.027 5.331 0.121 16 0 "[ . 1 . 2 ]" 1
1570 1 90 LYS H 1 90 LYS HB2 . . 4.080 2.649 2.138 3.896 . 0 0 "[ . 1 . 2 ]" 1
1571 1 90 LYS H 1 90 LYS HB3 . . 4.100 3.668 3.322 3.903 . 0 0 "[ . 1 . 2 ]" 1
1572 1 90 LYS H 1 90 LYS QD . . 4.380 3.558 2.387 4.279 . 0 0 "[ . 1 . 2 ]" 1
1573 1 90 LYS H 1 90 LYS QG . . 3.600 3.272 2.235 3.731 0.131 20 0 "[ . 1 . 2 ]" 1
1574 1 90 LYS H 1 111 SER H . . 5.100 4.466 3.398 5.227 0.127 20 0 "[ . 1 . 2 ]" 1
1575 1 90 LYS HA 1 90 LYS QG . . 3.540 2.492 2.232 3.357 . 0 0 "[ . 1 . 2 ]" 1
1576 1 90 LYS HA 1 91 GLY H . . 3.430 2.425 2.009 2.721 . 0 0 "[ . 1 . 2 ]" 1
1577 1 90 LYS HA 1 92 ALA H . . 4.270 3.472 3.089 3.916 . 0 0 "[ . 1 . 2 ]" 1
1578 1 90 LYS HB2 1 90 LYS HE2 . . 4.460 3.149 1.953 4.597 0.137 13 0 "[ . 1 . 2 ]" 1
1579 1 90 LYS HB2 1 90 LYS HE3 . . 3.910 2.983 2.021 4.126 0.216 8 0 "[ . 1 . 2 ]" 1
1580 1 90 LYS HB2 1 90 LYS QG . . 2.500 2.524 2.308 2.586 0.086 6 0 "[ . 1 . 2 ]" 1
1581 1 90 LYS HB2 1 91 GLY H . . 3.980 3.555 2.284 4.159 0.179 18 0 "[ . 1 . 2 ]" 1
1582 1 90 LYS HB2 1 91 GLY QA . . 4.710 4.193 3.677 4.609 . 0 0 "[ . 1 . 2 ]" 1
1583 1 90 LYS HB2 1 92 ALA H . . 5.500 5.514 4.683 6.087 0.587 20 1 "[ . 1 . + ]" 1
1584 1 90 LYS HB3 1 90 LYS HE2 . . 4.920 4.077 2.494 5.129 0.209 3 0 "[ . 1 . 2 ]" 1
1585 1 90 LYS HB3 1 91 GLY H . . 4.030 2.604 1.971 3.916 . 0 0 "[ . 1 . 2 ]" 1
1586 1 90 LYS HE3 1 90 LYS QG . . 3.440 2.704 2.002 3.375 . 0 0 "[ . 1 . 2 ]" 1
1587 1 90 LYS QG 1 91 GLY H . . 4.500 3.806 3.538 4.281 . 0 0 "[ . 1 . 2 ]" 1
1588 1 90 LYS QG 1 92 ALA H . . 5.500 5.454 5.173 5.598 0.098 20 0 "[ . 1 . 2 ]" 1
1589 1 91 GLY H 1 92 ALA H . . 3.590 2.608 1.897 3.028 . 0 0 "[ . 1 . 2 ]" 1
1590 1 91 GLY H 1 92 ALA HA . . 5.500 5.246 4.605 5.559 0.059 17 0 "[ . 1 . 2 ]" 1
1591 1 91 GLY H 1 92 ALA MB . . 5.500 4.297 3.598 4.794 . 0 0 "[ . 1 . 2 ]" 1
1592 1 91 GLY QA 1 92 ALA HA . . 4.490 4.134 3.999 4.206 . 0 0 "[ . 1 . 2 ]" 1
1593 1 92 ALA H 1 92 ALA MB . . 3.280 2.228 2.095 2.475 . 0 0 "[ . 1 . 2 ]" 1
1594 1 92 ALA H 1 93 SER H . . 4.860 4.631 4.481 4.717 . 0 0 "[ . 1 . 2 ]" 1
1595 1 92 ALA H 1 93 SER HA . . 5.450 5.416 5.082 5.554 0.104 7 0 "[ . 1 . 2 ]" 1
1596 1 92 ALA H 1 108 LEU QD . . 5.500 3.820 3.124 4.559 . 0 0 "[ . 1 . 2 ]" 1
1597 1 92 ALA HA 1 93 SER H . . 2.730 2.566 2.395 2.808 0.078 17 0 "[ . 1 . 2 ]" 1
1598 1 92 ALA HA 1 99 VAL MG2 . . 4.560 4.232 3.790 4.680 0.120 15 0 "[ . 1 . 2 ]" 1
1599 1 92 ALA HA 1 108 LEU QD . . 3.440 2.411 2.113 2.944 . 0 0 "[ . 1 . 2 ]" 1
1600 1 92 ALA MB 1 93 SER H . . 3.220 2.341 1.964 2.618 . 0 0 "[ . 1 . 2 ]" 1
1601 1 92 ALA MB 1 93 SER QB . . 4.420 4.466 4.183 4.578 0.158 9 0 "[ . 1 . 2 ]" 1
1602 1 92 ALA MB 1 99 VAL HB . . 4.230 4.574 4.153 4.989 0.759 15 4 "[ . 1* +*- 2 ]" 1
1603 1 92 ALA MB 1 99 VAL MG1 . . 3.730 2.423 2.161 2.753 . 0 0 "[ . 1 . 2 ]" 1
1604 1 92 ALA MB 1 99 VAL MG2 . . 3.510 2.354 2.099 2.699 . 0 0 "[ . 1 . 2 ]" 1
1605 1 92 ALA MB 1 108 LEU QD . . 3.020 2.065 1.845 2.596 . 0 0 "[ . 1 . 2 ]" 1
1606 1 93 SER H 1 93 SER QB . . 3.520 3.265 2.812 3.464 . 0 0 "[ . 1 . 2 ]" 1
1607 1 93 SER H 1 99 VAL HA . . 5.410 4.638 4.263 5.000 . 0 0 "[ . 1 . 2 ]" 1
1608 1 93 SER H 1 99 VAL MG2 . . 4.030 2.754 2.380 3.644 . 0 0 "[ . 1 . 2 ]" 1
1609 1 93 SER H 1 108 LEU QD . . 4.620 3.526 3.021 3.780 . 0 0 "[ . 1 . 2 ]" 1
1610 1 93 SER HA 1 94 GLY H . . 2.880 2.367 2.202 2.552 . 0 0 "[ . 1 . 2 ]" 1
1611 1 93 SER QB 1 94 GLY H . . 3.260 2.889 2.536 3.386 0.126 2 0 "[ . 1 . 2 ]" 1
1612 1 94 GLY H 1 95 THR H . . 4.790 4.534 4.297 4.696 . 0 0 "[ . 1 . 2 ]" 1
1613 1 94 GLY H 1 95 THR HA . . 5.500 5.092 4.897 5.315 . 0 0 "[ . 1 . 2 ]" 1
1614 1 94 GLY H 1 99 VAL MG2 . . 4.730 3.784 3.275 4.458 . 0 0 "[ . 1 . 2 ]" 1
1615 1 94 GLY HA2 1 95 THR H . . 3.380 2.852 2.587 3.268 . 0 0 "[ . 1 . 2 ]" 1
1616 1 94 GLY HA2 1 95 THR MG . . 4.000 3.898 3.530 4.128 0.128 15 0 "[ . 1 . 2 ]" 1
1617 1 94 GLY HA3 1 95 THR H . . 3.010 2.411 2.233 2.627 . 0 0 "[ . 1 . 2 ]" 1
1618 1 94 GLY HA3 1 99 VAL H . . 5.470 4.239 3.738 5.229 . 0 0 "[ . 1 . 2 ]" 1
1619 1 95 THR H 1 95 THR HB . . 3.800 3.577 3.406 3.681 . 0 0 "[ . 1 . 2 ]" 1
1620 1 95 THR H 1 95 THR MG . . 3.210 2.697 2.328 3.204 . 0 0 "[ . 1 . 2 ]" 1
1621 1 95 THR H 1 98 GLU H . . 4.470 3.815 3.343 4.383 . 0 0 "[ . 1 . 2 ]" 1
1622 1 95 THR H 1 99 VAL H . . 4.770 3.863 3.457 4.391 . 0 0 "[ . 1 . 2 ]" 1
1623 1 95 THR H 1 99 VAL HB . . 4.330 5.376 5.010 5.731 1.401 19 22 [*****************-+***] 1
1624 1 95 THR H 1 99 VAL MG2 . . 5.500 3.572 3.236 3.850 . 0 0 "[ . 1 . 2 ]" 1
1625 1 95 THR HA 1 95 THR MG . . 2.770 2.309 2.159 2.538 . 0 0 "[ . 1 . 2 ]" 1
1626 1 95 THR HA 1 96 VAL H . . 3.120 2.474 2.329 2.647 . 0 0 "[ . 1 . 2 ]" 1
1627 1 95 THR HA 1 96 VAL HB . . 4.690 4.729 4.529 4.831 0.141 17 0 "[ . 1 . 2 ]" 1
1628 1 95 THR HA 1 96 VAL MG2 . . 4.130 3.927 3.702 4.101 . 0 0 "[ . 1 . 2 ]" 1
1629 1 95 THR HA 1 97 GLU H . . 4.990 4.697 4.448 4.898 . 0 0 "[ . 1 . 2 ]" 1
1630 1 95 THR HA 1 98 GLU H . . 5.500 4.737 4.488 4.874 . 0 0 "[ . 1 . 2 ]" 1
1631 1 95 THR HA 1 99 VAL H . . 5.500 4.946 4.868 5.041 . 0 0 "[ . 1 . 2 ]" 1
1632 1 95 THR HB 1 96 VAL H . . 3.360 2.466 2.202 2.936 . 0 0 "[ . 1 . 2 ]" 1
1633 1 95 THR HB 1 96 VAL HB . . 5.280 4.084 3.815 4.492 . 0 0 "[ . 1 . 2 ]" 1
1634 1 95 THR HB 1 97 GLU H . . 4.230 3.128 2.615 3.403 . 0 0 "[ . 1 . 2 ]" 1
1635 1 95 THR HB 1 98 GLU H . . 5.050 3.749 3.183 4.060 . 0 0 "[ . 1 . 2 ]" 1
1636 1 95 THR MG 1 96 VAL H . . 4.460 3.575 3.089 3.828 . 0 0 "[ . 1 . 2 ]" 1
1637 1 95 THR MG 1 97 GLU H . . 5.500 4.630 4.143 4.848 . 0 0 "[ . 1 . 2 ]" 1
1638 1 95 THR MG 1 97 GLU QG . . 4.390 3.894 3.252 4.235 . 0 0 "[ . 1 . 2 ]" 1
1639 1 95 THR MG 1 98 GLU H . . 4.710 4.640 4.124 5.004 0.294 10 0 "[ . 1 . 2 ]" 1
1640 1 95 THR MG 1 99 VAL H . . 5.490 5.537 5.278 5.613 0.123 10 0 "[ . 1 . 2 ]" 1
1641 1 96 VAL H 1 96 VAL HB . . 3.430 2.269 2.174 2.455 . 0 0 "[ . 1 . 2 ]" 1
1642 1 96 VAL H 1 96 VAL MG1 . . 4.660 3.716 3.660 3.802 . 0 0 "[ . 1 . 2 ]" 1
1643 1 96 VAL H 1 96 VAL MG2 . . 3.050 2.380 2.064 2.641 . 0 0 "[ . 1 . 2 ]" 1
1644 1 96 VAL H 1 97 GLU H . . 3.950 2.853 2.663 3.012 . 0 0 "[ . 1 . 2 ]" 1
1645 1 96 VAL H 1 97 GLU QB . . 5.110 5.145 5.027 5.220 0.110 18 0 "[ . 1 . 2 ]" 1
1646 1 96 VAL H 1 97 GLU QG . . 5.500 4.154 3.776 4.464 . 0 0 "[ . 1 . 2 ]" 1
1647 1 96 VAL HA 1 96 VAL HB . . 3.000 3.029 3.005 3.048 0.048 15 0 "[ . 1 . 2 ]" 1
1648 1 96 VAL HA 1 96 VAL MG1 . . 2.950 2.671 2.503 2.746 . 0 0 "[ . 1 . 2 ]" 1
1649 1 96 VAL HA 1 96 VAL MG2 . . 2.750 2.242 2.178 2.415 . 0 0 "[ . 1 . 2 ]" 1
1650 1 96 VAL HA 1 98 GLU H . . 5.460 4.120 3.760 4.343 . 0 0 "[ . 1 . 2 ]" 1
1651 1 96 VAL HA 1 99 VAL H . . 4.290 3.613 3.321 3.831 . 0 0 "[ . 1 . 2 ]" 1
1652 1 96 VAL HA 1 99 VAL HB . . 3.040 2.667 2.206 2.989 . 0 0 "[ . 1 . 2 ]" 1
1653 1 96 VAL HA 1 99 VAL MG1 . . 3.440 3.840 3.489 4.155 0.715 18 3 "[ - . 1 . + 2 *]" 1
1654 1 96 VAL HA 1 99 VAL MG2 . . 3.820 3.559 2.728 3.957 0.137 18 0 "[ . 1 . 2 ]" 1
1655 1 96 VAL HA 1 100 VAL H . . 4.520 3.927 3.531 4.434 . 0 0 "[ . 1 . 2 ]" 1
1656 1 96 VAL HA 1 100 VAL MG2 . . 4.090 3.540 3.177 3.881 . 0 0 "[ . 1 . 2 ]" 1
1657 1 96 VAL HB 1 98 GLU H . . 5.500 4.946 4.802 5.096 . 0 0 "[ . 1 . 2 ]" 1
1658 1 96 VAL MG1 1 97 GLU H . . 3.730 2.941 2.720 3.285 . 0 0 "[ . 1 . 2 ]" 1
1659 1 96 VAL MG1 1 97 GLU HA . . 3.820 3.075 2.924 3.322 . 0 0 "[ . 1 . 2 ]" 1
1660 1 96 VAL MG1 1 98 GLU H . . 4.550 4.639 4.438 4.714 0.164 17 0 "[ . 1 . 2 ]" 1
1661 1 96 VAL MG2 1 97 GLU H . . 4.510 3.994 3.826 4.016 . 0 0 "[ . 1 . 2 ]" 1
1662 1 96 VAL MG2 1 98 GLU H . . 4.870 5.301 5.111 5.445 0.575 5 6 "[ * + ** 1 - . * 2 ]" 1
1663 1 97 GLU H 1 97 GLU QB . . 3.170 2.577 2.409 2.837 . 0 0 "[ . 1 . 2 ]" 1
1664 1 97 GLU H 1 97 GLU QG . . 3.390 2.216 1.933 2.461 . 0 0 "[ . 1 . 2 ]" 1
1665 1 97 GLU H 1 98 GLU H . . 3.600 2.770 2.643 2.906 . 0 0 "[ . 1 . 2 ]" 1
1666 1 97 GLU H 1 99 VAL H . . 5.180 4.560 4.426 4.670 . 0 0 "[ . 1 . 2 ]" 1
1667 1 97 GLU HA 1 97 GLU QB . . 2.790 2.133 2.079 2.193 . 0 0 "[ . 1 . 2 ]" 1
1668 1 97 GLU HA 1 97 GLU QG . . 3.620 3.363 3.316 3.388 . 0 0 "[ . 1 . 2 ]" 1
1669 1 97 GLU HA 1 99 VAL H . . 5.500 4.909 4.669 5.094 . 0 0 "[ . 1 . 2 ]" 1
1670 1 97 GLU HA 1 100 VAL H . . 4.350 3.803 3.417 4.110 . 0 0 "[ . 1 . 2 ]" 1
1671 1 97 GLU HA 1 100 VAL HB . . 3.030 2.900 2.300 3.152 0.122 1 0 "[ . 1 . 2 ]" 1
1672 1 97 GLU HA 1 101 ASN H . . 4.810 4.226 3.880 4.570 . 0 0 "[ . 1 . 2 ]" 1
1673 1 97 GLU QB 1 98 GLU H . . 3.620 3.640 3.444 3.739 0.119 3 0 "[ . 1 . 2 ]" 1
1674 1 97 GLU QG 1 98 GLU H . . 3.600 2.476 2.155 2.828 . 0 0 "[ . 1 . 2 ]" 1
1675 1 98 GLU H 1 99 VAL H . . 3.420 2.519 2.248 2.852 . 0 0 "[ . 1 . 2 ]" 1
1676 1 98 GLU H 1 99 VAL HA . . 5.300 5.120 4.903 5.340 0.040 3 0 "[ . 1 . 2 ]" 1
1677 1 98 GLU H 1 99 VAL HB . . 4.850 4.267 3.917 4.665 . 0 0 "[ . 1 . 2 ]" 1
1678 1 98 GLU H 1 99 VAL MG2 . . 5.390 4.213 3.870 4.614 . 0 0 "[ . 1 . 2 ]" 1
1679 1 98 GLU H 1 100 VAL H . . 4.800 3.801 3.494 4.129 . 0 0 "[ . 1 . 2 ]" 1
1680 1 98 GLU H 1 101 ASN H . . 4.460 4.539 4.404 4.574 0.114 6 0 "[ . 1 . 2 ]" 1
1681 1 99 VAL H 1 99 VAL HB . . 3.210 2.265 2.152 2.532 . 0 0 "[ . 1 . 2 ]" 1
1682 1 99 VAL H 1 99 VAL MG1 . . 3.580 3.644 3.602 3.727 0.147 1 0 "[ . 1 . 2 ]" 1
1683 1 99 VAL H 1 99 VAL MG2 . . 3.390 2.242 2.071 2.401 . 0 0 "[ . 1 . 2 ]" 1
1684 1 99 VAL H 1 100 VAL H . . 3.510 2.819 2.684 2.945 . 0 0 "[ . 1 . 2 ]" 1
1685 1 99 VAL H 1 100 VAL HA . . 5.500 5.438 5.347 5.519 0.019 19 0 "[ . 1 . 2 ]" 1
1686 1 99 VAL H 1 100 VAL HB . . 4.660 4.907 4.500 5.256 0.596 3 2 "[ + . 1 . 2 *]" 1
1687 1 99 VAL H 1 100 VAL MG2 . . 4.390 4.474 4.317 4.520 0.130 8 0 "[ . 1 . 2 ]" 1
1688 1 99 VAL H 1 101 ASN H . . 4.820 4.301 4.151 4.439 . 0 0 "[ . 1 . 2 ]" 1
1689 1 99 VAL H 1 102 GLN H . . 5.500 4.700 4.598 4.840 . 0 0 "[ . 1 . 2 ]" 1
1690 1 99 VAL HA 1 99 VAL HB . . 2.840 3.059 3.037 3.084 0.244 1 0 "[ . 1 . 2 ]" 1
1691 1 99 VAL HA 1 99 VAL MG1 . . 3.120 2.554 2.450 2.640 . 0 0 "[ . 1 . 2 ]" 1
1692 1 99 VAL HA 1 99 VAL MG2 . . 2.820 2.353 2.237 2.481 . 0 0 "[ . 1 . 2 ]" 1
1693 1 99 VAL HA 1 100 VAL MG2 . . 5.240 5.091 4.879 5.247 0.007 12 0 "[ . 1 . 2 ]" 1
1694 1 99 VAL HA 1 101 ASN H . . 4.950 4.535 4.312 4.736 . 0 0 "[ . 1 . 2 ]" 1
1695 1 99 VAL HA 1 102 GLN H . . 3.560 3.432 3.181 3.751 0.191 16 0 "[ . 1 . 2 ]" 1
1696 1 99 VAL HA 1 102 GLN HB2 . . 3.220 2.751 2.587 3.023 . 0 0 "[ . 1 . 2 ]" 1
1697 1 99 VAL HA 1 102 GLN HB3 . . 4.430 4.329 4.204 4.562 0.132 19 0 "[ . 1 . 2 ]" 1
1698 1 99 VAL HA 1 102 GLN QG . . 4.280 2.791 2.493 2.950 . 0 0 "[ . 1 . 2 ]" 1
1699 1 99 VAL HA 1 103 TYR H . . 4.920 4.181 3.900 4.569 . 0 0 "[ . 1 . 2 ]" 1
1700 1 99 VAL HB 1 100 VAL H . . 3.760 2.723 2.393 3.137 . 0 0 "[ . 1 . 2 ]" 1
1701 1 99 VAL MG1 1 100 VAL H . . 3.540 3.277 3.077 3.675 0.135 18 0 "[ . 1 . 2 ]" 1
1702 1 99 VAL MG2 1 102 GLN HB2 . . 5.230 4.392 4.003 4.793 . 0 0 "[ . 1 . 2 ]" 1
1703 1 100 VAL H 1 100 VAL HB . . 3.150 2.369 2.206 2.647 . 0 0 "[ . 1 . 2 ]" 1
1704 1 100 VAL H 1 100 VAL MG1 . . 3.830 3.756 3.662 3.850 0.020 3 0 "[ . 1 . 2 ]" 1
1705 1 100 VAL H 1 100 VAL MG2 . . 2.910 2.385 2.243 2.751 . 0 0 "[ . 1 . 2 ]" 1
1706 1 100 VAL H 1 101 ASN HA . . 5.500 5.281 4.975 5.450 . 0 0 "[ . 1 . 2 ]" 1
1707 1 100 VAL H 1 101 ASN QB . . 4.870 4.421 4.007 4.598 . 0 0 "[ . 1 . 2 ]" 1
1708 1 100 VAL H 1 102 GLN HB2 . . 5.280 5.262 4.845 5.396 0.116 19 0 "[ . 1 . 2 ]" 1
1709 1 100 VAL H 1 102 GLN QG . . 5.370 5.046 4.752 5.301 . 0 0 "[ . 1 . 2 ]" 1
1710 1 100 VAL HA 1 100 VAL MG1 . . 3.150 2.533 2.325 2.706 . 0 0 "[ . 1 . 2 ]" 1
1711 1 100 VAL HA 1 100 VAL MG2 . . 2.920 2.330 2.231 2.436 . 0 0 "[ . 1 . 2 ]" 1
1712 1 100 VAL HA 1 102 GLN H . . 4.920 4.557 4.358 4.852 . 0 0 "[ . 1 . 2 ]" 1
1713 1 100 VAL HA 1 103 TYR H . . 3.940 3.616 3.241 3.976 0.036 12 0 "[ . 1 . 2 ]" 1
1714 1 100 VAL HA 1 103 TYR HB2 . . 4.140 4.296 3.742 4.975 0.835 18 2 "[ -. 1 . + 2 ]" 1
1715 1 100 VAL HA 1 103 TYR QD . . 4.110 3.729 3.448 4.000 . 0 0 "[ . 1 . 2 ]" 1
1716 1 100 VAL HA 1 104 LEU H . . 4.210 4.026 3.806 4.263 0.053 8 0 "[ . 1 . 2 ]" 1
1717 1 100 VAL HB 1 101 ASN H . . 3.570 2.718 2.509 3.030 . 0 0 "[ . 1 . 2 ]" 1
1718 1 100 VAL HB 1 102 GLN H . . 5.240 5.191 5.015 5.346 0.106 10 0 "[ . 1 . 2 ]" 1
1719 1 100 VAL MG1 1 101 ASN H . . 4.360 3.329 2.878 3.710 . 0 0 "[ . 1 . 2 ]" 1
1720 1 100 VAL MG1 1 101 ASN HA . . 4.040 3.468 3.105 3.737 . 0 0 "[ . 1 . 2 ]" 1
1721 1 101 ASN H 1 101 ASN QB . . 3.190 2.250 2.125 2.336 . 0 0 "[ . 1 . 2 ]" 1
1722 1 101 ASN H 1 102 GLN HB2 . . 5.270 5.032 4.860 5.276 0.006 4 0 "[ . 1 . 2 ]" 1
1723 1 101 ASN H 1 103 TYR HB3 . . 5.500 5.350 5.099 5.826 0.326 18 0 "[ . 1 . 2 ]" 1
1724 1 101 ASN H 1 104 LEU H . . 5.500 4.798 4.718 4.935 . 0 0 "[ . 1 . 2 ]" 1
1725 1 101 ASN HA 1 104 LEU H . . 4.100 3.399 3.225 3.677 . 0 0 "[ . 1 . 2 ]" 1
1726 1 101 ASN HA 1 104 LEU QB . . 3.220 2.497 2.253 2.718 . 0 0 "[ . 1 . 2 ]" 1
1727 1 101 ASN HA 1 104 LEU QD . . 3.390 3.127 2.745 3.498 0.108 9 0 "[ . 1 . 2 ]" 1
1728 1 101 ASN HA 1 104 LEU HG . . 5.040 4.672 3.835 5.184 0.144 12 0 "[ . 1 . 2 ]" 1
1729 1 101 ASN QB 1 102 GLN H . . 3.830 2.645 2.398 2.898 . 0 0 "[ . 1 . 2 ]" 1
1730 1 101 ASN QB 1 102 GLN HA . . 3.820 4.184 3.657 4.419 0.599 6 9 "[ -**+ *1 . ****]" 1
1731 1 102 GLN H 1 102 GLN HB2 . . 3.250 2.625 2.492 2.784 . 0 0 "[ . 1 . 2 ]" 1
1732 1 102 GLN H 1 102 GLN HB3 . . 3.680 3.644 3.583 3.695 0.015 18 0 "[ . 1 . 2 ]" 1
1733 1 102 GLN H 1 102 GLN QG . . 3.340 2.300 2.098 2.503 . 0 0 "[ . 1 . 2 ]" 1
1734 1 102 GLN H 1 103 TYR HA . . 5.500 5.467 5.388 5.537 0.037 17 0 "[ . 1 . 2 ]" 1
1735 1 102 GLN H 1 104 LEU H . . 4.950 4.380 4.285 4.509 . 0 0 "[ . 1 . 2 ]" 1
1736 1 102 GLN H 1 105 SER H . . 5.500 4.744 4.636 4.855 . 0 0 "[ . 1 . 2 ]" 1
1737 1 102 GLN H 1 108 LEU QD . . 4.940 4.012 3.808 4.139 . 0 0 "[ . 1 . 2 ]" 1
1738 1 102 GLN HA 1 102 GLN HB3 . . 3.040 2.470 2.408 2.532 . 0 0 "[ . 1 . 2 ]" 1
1739 1 102 GLN HA 1 102 GLN QG . . 2.900 2.471 2.355 2.636 . 0 0 "[ . 1 . 2 ]" 1
1740 1 102 GLN HA 1 104 LEU H . . 5.500 4.810 4.673 4.938 . 0 0 "[ . 1 . 2 ]" 1
1741 1 102 GLN HA 1 105 SER H . . 4.680 3.682 3.450 3.861 . 0 0 "[ . 1 . 2 ]" 1
1742 1 102 GLN HA 1 107 GLN HB2 . . 3.580 3.317 2.758 3.832 0.252 19 0 "[ . 1 . 2 ]" 1
1743 1 102 GLN HA 1 107 GLN HG3 . . 4.280 3.490 2.571 4.084 . 0 0 "[ . 1 . 2 ]" 1
1744 1 102 GLN HA 1 108 LEU QD . . 4.950 4.150 3.860 4.558 . 0 0 "[ . 1 . 2 ]" 1
1745 1 102 GLN HB2 1 103 TYR H . . 3.850 2.637 2.341 2.939 . 0 0 "[ . 1 . 2 ]" 1
1746 1 102 GLN HB2 1 108 LEU HA . . 4.980 5.366 4.823 5.572 0.592 19 8 "[ ** * 1 * . *-+* ]" 1
1747 1 102 GLN HB2 1 108 LEU HB2 . . 4.180 3.647 2.976 4.475 0.295 3 0 "[ . 1 . 2 ]" 1
1748 1 102 GLN HB2 1 108 LEU QD . . 4.000 2.172 1.963 2.439 . 0 0 "[ . 1 . 2 ]" 1
1749 1 102 GLN HB2 1 108 LEU HG . . 4.900 4.324 2.725 5.017 0.117 21 0 "[ . 1 . 2 ]" 1
1750 1 102 GLN HB3 1 103 TYR H . . 4.260 3.645 3.438 3.904 . 0 0 "[ . 1 . 2 ]" 1
1751 1 102 GLN HB3 1 107 GLN H . . 4.970 4.356 3.988 4.656 . 0 0 "[ . 1 . 2 ]" 1
1752 1 102 GLN HB3 1 108 LEU H . . 4.550 3.668 3.239 4.203 . 0 0 "[ . 1 . 2 ]" 1
1753 1 102 GLN HB3 1 108 LEU HA . . 4.790 4.593 4.008 5.101 0.311 19 0 "[ . 1 . 2 ]" 1
1754 1 102 GLN HB3 1 108 LEU HB2 . . 3.980 3.518 2.852 4.504 0.524 3 2 "[ + . 1 . 2 *]" 1
1755 1 102 GLN HB3 1 108 LEU QD . . 4.200 2.459 2.127 3.290 . 0 0 "[ . 1 . 2 ]" 1
1756 1 102 GLN QG 1 103 TYR H . . 4.740 4.096 3.935 4.271 . 0 0 "[ . 1 . 2 ]" 1
1757 1 102 GLN QG 1 108 LEU QD . . 4.650 3.489 3.207 4.053 . 0 0 "[ . 1 . 2 ]" 1
1758 1 103 TYR H 1 103 TYR HB2 . . 3.420 2.746 2.507 2.956 . 0 0 "[ . 1 . 2 ]" 1
1759 1 103 TYR H 1 103 TYR HB3 . . 3.370 2.256 2.138 2.401 . 0 0 "[ . 1 . 2 ]" 1
1760 1 103 TYR H 1 103 TYR QD . . 4.280 4.088 3.942 4.181 . 0 0 "[ . 1 . 2 ]" 1
1761 1 103 TYR H 1 104 LEU H . . 3.730 2.741 2.575 2.979 . 0 0 "[ . 1 . 2 ]" 1
1762 1 103 TYR H 1 104 LEU HA . . 5.500 5.326 5.153 5.492 . 0 0 "[ . 1 . 2 ]" 1
1763 1 103 TYR H 1 104 LEU QD . . 5.500 4.439 3.750 5.157 . 0 0 "[ . 1 . 2 ]" 1
1764 1 103 TYR H 1 105 SER H . . 4.730 3.910 3.708 4.053 . 0 0 "[ . 1 . 2 ]" 1
1765 1 103 TYR H 1 108 LEU HB2 . . 4.230 3.512 3.215 3.998 . 0 0 "[ . 1 . 2 ]" 1
1766 1 103 TYR H 1 108 LEU QD . . 4.470 2.667 2.469 2.809 . 0 0 "[ . 1 . 2 ]" 1
1767 1 103 TYR H 1 108 LEU HG . . 5.470 5.113 4.348 5.582 0.112 19 0 "[ . 1 . 2 ]" 1
1768 1 103 TYR HA 1 103 TYR QD . . 2.870 2.595 2.310 2.833 . 0 0 "[ . 1 . 2 ]" 1
1769 1 103 TYR HA 1 106 GLY H . . 4.340 3.306 2.980 3.514 . 0 0 "[ . 1 . 2 ]" 1
1770 1 103 TYR HA 1 108 LEU H . . 4.030 2.675 2.379 2.916 . 0 0 "[ . 1 . 2 ]" 1
1771 1 103 TYR HA 1 108 LEU HB2 . . 3.390 2.213 1.962 2.536 . 0 0 "[ . 1 . 2 ]" 1
1772 1 103 TYR HA 1 108 LEU HB3 . . 3.520 3.039 2.331 3.619 0.099 3 0 "[ . 1 . 2 ]" 1
1773 1 103 TYR HA 1 108 LEU QD . . 3.150 3.182 2.776 3.448 0.298 19 0 "[ . 1 . 2 ]" 1
1774 1 103 TYR HA 1 108 LEU HG . . 4.960 4.618 4.126 5.132 0.172 19 0 "[ . 1 . 2 ]" 1
1775 1 103 TYR HB2 1 104 LEU H . . 4.150 4.022 3.859 4.241 0.091 8 0 "[ . 1 . 2 ]" 1
1776 1 103 TYR HB2 1 105 SER H . . 5.500 5.584 5.575 5.591 0.091 18 0 "[ . 1 . 2 ]" 1
1777 1 103 TYR HB2 1 106 GLY H . . 5.500 5.429 5.176 5.579 0.079 10 0 "[ . 1 . 2 ]" 1
1778 1 103 TYR HB2 1 108 LEU H . . 4.460 4.406 3.929 4.643 0.183 21 0 "[ . 1 . 2 ]" 1
1779 1 103 TYR HB2 1 108 LEU HB2 . . 3.610 2.776 2.232 3.312 . 0 0 "[ . 1 . 2 ]" 1
1780 1 103 TYR HB2 1 108 LEU HB3 . . 4.570 2.905 2.636 3.099 . 0 0 "[ . 1 . 2 ]" 1
1781 1 103 TYR HB2 1 108 LEU QD . . 3.880 2.328 2.158 2.634 . 0 0 "[ . 1 . 2 ]" 1
1782 1 103 TYR HB3 1 104 LEU H . . 3.780 2.713 2.464 3.027 . 0 0 "[ . 1 . 2 ]" 1
1783 1 103 TYR HB3 1 105 SER H . . 5.470 4.883 4.741 5.029 . 0 0 "[ . 1 . 2 ]" 1
1784 1 103 TYR HB3 1 106 GLY H . . 5.500 5.397 5.240 5.557 0.057 15 0 "[ . 1 . 2 ]" 1
1785 1 103 TYR HB3 1 108 LEU H . . 5.500 5.452 5.155 5.571 0.071 21 0 "[ . 1 . 2 ]" 1
1786 1 103 TYR HB3 1 108 LEU QD . . 5.320 3.281 2.900 3.550 . 0 0 "[ . 1 . 2 ]" 1
1787 1 103 TYR QD 1 104 LEU H . . 4.130 3.207 3.002 3.422 . 0 0 "[ . 1 . 2 ]" 1
1788 1 103 TYR QD 1 104 LEU HA . . 3.630 3.739 3.542 3.805 0.175 4 0 "[ . 1 . 2 ]" 1
1789 1 103 TYR QD 1 104 LEU QD . . 2.880 2.290 1.970 2.837 . 0 0 "[ . 1 . 2 ]" 1
1790 1 103 TYR QD 1 104 LEU HG . . 3.230 3.402 2.386 4.100 0.870 12 12 "[ * ****- 1 +*** ** ]" 1
1791 1 103 TYR QD 1 105 SER H . . 5.500 5.252 5.150 5.405 . 0 0 "[ . 1 . 2 ]" 1
1792 1 103 TYR QD 1 106 GLY H . . 5.500 4.764 4.557 5.083 . 0 0 "[ . 1 . 2 ]" 1
1793 1 103 TYR QD 1 108 LEU H . . 5.270 4.321 3.628 4.846 . 0 0 "[ . 1 . 2 ]" 1
1794 1 103 TYR QD 1 108 LEU HB2 . . 4.120 3.478 2.699 4.300 0.180 10 0 "[ . 1 . 2 ]" 1
1795 1 103 TYR QD 1 108 LEU HB3 . . 3.680 2.932 2.463 3.481 . 0 0 "[ . 1 . 2 ]" 1
1796 1 103 TYR QD 1 108 LEU QD . . 3.940 3.752 3.332 3.956 0.016 4 0 "[ . 1 . 2 ]" 1
1797 1 103 TYR QD 1 109 LYS H . . 5.500 5.473 4.853 5.594 0.094 15 0 "[ . 1 . 2 ]" 1
1798 1 103 TYR QE 1 104 LEU H . . 5.500 5.003 4.853 5.153 . 0 0 "[ . 1 . 2 ]" 1
1799 1 103 TYR QE 1 104 LEU HA . . 4.060 4.213 4.065 4.244 0.184 12 0 "[ . 1 . 2 ]" 1
1800 1 103 TYR QE 1 104 LEU QD . . 4.130 2.934 2.431 3.230 . 0 0 "[ . 1 . 2 ]" 1
1801 1 104 LEU H 1 104 LEU QB . . 3.510 2.310 2.133 2.424 . 0 0 "[ . 1 . 2 ]" 1
1802 1 104 LEU H 1 104 LEU QD . . 3.830 2.630 2.077 3.266 . 0 0 "[ . 1 . 2 ]" 1
1803 1 104 LEU H 1 104 LEU HG . . 3.410 3.146 2.476 3.638 0.228 7 0 "[ . 1 . 2 ]" 1
1804 1 104 LEU H 1 105 SER H . . 3.520 2.646 2.507 2.808 . 0 0 "[ . 1 . 2 ]" 1
1805 1 104 LEU H 1 105 SER HA . . 5.500 5.325 5.212 5.403 . 0 0 "[ . 1 . 2 ]" 1
1806 1 104 LEU H 1 106 GLY H . . 5.140 4.058 3.939 4.256 . 0 0 "[ . 1 . 2 ]" 1
1807 1 104 LEU H 1 107 GLN H . . 5.500 5.539 5.354 5.588 0.088 7 0 "[ . 1 . 2 ]" 1
1808 1 104 LEU H 1 108 LEU QD . . 5.430 4.808 4.608 5.026 . 0 0 "[ . 1 . 2 ]" 1
1809 1 104 LEU HA 1 104 LEU QD . . 2.920 2.429 2.046 2.828 . 0 0 "[ . 1 . 2 ]" 1
1810 1 104 LEU HA 1 104 LEU HG . . 3.760 2.621 2.129 3.264 . 0 0 "[ . 1 . 2 ]" 1
1811 1 104 LEU HA 1 105 SER HA . . 4.910 4.764 4.670 4.824 . 0 0 "[ . 1 . 2 ]" 1
1812 1 104 LEU HA 1 106 GLY H . . 4.380 3.764 3.469 4.457 0.077 12 0 "[ . 1 . 2 ]" 1
1813 1 104 LEU QB 1 105 SER H . . 3.830 2.887 2.670 3.072 . 0 0 "[ . 1 . 2 ]" 1
1814 1 104 LEU QB 1 106 GLY H . . 5.500 4.564 4.451 4.806 . 0 0 "[ . 1 . 2 ]" 1
1815 1 104 LEU QD 1 105 SER H . . 5.050 4.171 3.946 4.376 . 0 0 "[ . 1 . 2 ]" 1
1816 1 104 LEU QD 1 106 GLY H . . 5.500 5.040 4.806 5.314 . 0 0 "[ . 1 . 2 ]" 1
1817 1 105 SER H 1 105 SER HB2 . . 3.510 2.362 2.205 2.558 . 0 0 "[ . 1 . 2 ]" 1
1818 1 105 SER H 1 105 SER HB3 . . 3.450 3.512 2.790 3.624 0.174 6 0 "[ . 1 . 2 ]" 1
1819 1 105 SER H 1 106 GLY H . . 3.390 2.586 2.311 2.727 . 0 0 "[ . 1 . 2 ]" 1
1820 1 105 SER H 1 106 GLY HA2 . . 4.660 4.840 4.498 4.997 0.337 20 0 "[ . 1 . 2 ]" 1
1821 1 105 SER H 1 107 GLN H . . 3.970 3.885 3.727 4.072 0.102 12 0 "[ . 1 . 2 ]" 1
1822 1 105 SER H 1 107 GLN HB2 . . 5.500 5.305 4.972 5.568 0.068 16 0 "[ . 1 . 2 ]" 1
1823 1 105 SER H 1 108 LEU QD . . 5.500 5.474 5.108 5.695 0.195 16 0 "[ . 1 . 2 ]" 1
1824 1 105 SER HA 1 105 SER HB2 . . 2.960 3.008 2.623 3.050 0.090 15 0 "[ . 1 . 2 ]" 1
1825 1 105 SER HA 1 107 GLN H . . 4.910 4.700 4.433 5.316 0.406 12 0 "[ . 1 . 2 ]" 1
1826 1 105 SER HB2 1 107 GLN H . . 4.900 3.308 2.589 4.673 . 0 0 "[ . 1 . 2 ]" 1
1827 1 105 SER HB3 1 106 GLY H . . 4.320 4.116 3.507 4.433 0.113 2 0 "[ . 1 . 2 ]" 1
1828 1 106 GLY H 1 107 GLN H . . 3.510 2.580 2.047 2.821 . 0 0 "[ . 1 . 2 ]" 1
1829 1 106 GLY H 1 107 GLN HB2 . . 5.300 4.871 4.210 5.224 . 0 0 "[ . 1 . 2 ]" 1
1830 1 106 GLY H 1 107 GLN HG3 . . 5.500 5.372 4.120 6.037 0.537 2 1 "[ + . 1 . 2 ]" 1
1831 1 106 GLY HA2 1 108 LEU H . . 5.020 4.030 3.461 4.372 . 0 0 "[ . 1 . 2 ]" 1
1832 1 106 GLY HA3 1 108 LEU H . . 5.330 4.984 4.610 5.403 0.073 15 0 "[ . 1 . 2 ]" 1
1833 1 107 GLN H 1 107 GLN HB2 . . 3.330 2.507 2.377 2.706 . 0 0 "[ . 1 . 2 ]" 1
1834 1 107 GLN H 1 107 GLN HB3 . . 3.750 3.622 3.585 3.676 . 0 0 "[ . 1 . 2 ]" 1
1835 1 107 GLN H 1 107 GLN HG3 . . 3.490 3.297 2.292 3.691 0.201 14 0 "[ . 1 . 2 ]" 1
1836 1 107 GLN H 1 108 LEU H . . 3.110 2.384 2.203 2.632 . 0 0 "[ . 1 . 2 ]" 1
1837 1 107 GLN H 1 108 LEU HB2 . . 4.880 4.132 3.935 4.374 . 0 0 "[ . 1 . 2 ]" 1
1838 1 107 GLN H 1 108 LEU QD . . 5.500 4.661 4.202 5.070 . 0 0 "[ . 1 . 2 ]" 1
1839 1 107 GLN HA 1 107 GLN HB3 . . 2.620 2.468 2.371 2.538 . 0 0 "[ . 1 . 2 ]" 1
1840 1 107 GLN HA 1 107 GLN HG3 . . 3.490 3.727 3.259 3.965 0.475 4 0 "[ . 1 . 2 ]" 1
1841 1 107 GLN HA 1 108 LEU H . . 3.510 3.499 3.406 3.561 0.051 18 0 "[ . 1 . 2 ]" 1
1842 1 107 GLN HB2 1 107 GLN HG2 . . 2.910 2.671 2.435 3.036 0.126 19 0 "[ . 1 . 2 ]" 1
1843 1 107 GLN HB3 1 108 LEU H . . 4.050 3.685 3.350 3.986 . 0 0 "[ . 1 . 2 ]" 1
1844 1 107 GLN HG3 1 108 LEU H . . 5.020 4.637 4.221 5.214 0.194 14 0 "[ . 1 . 2 ]" 1
1845 1 108 LEU H 1 108 LEU HB2 . . 3.430 2.083 1.999 2.263 . 0 0 "[ . 1 . 2 ]" 1
1846 1 108 LEU H 1 108 LEU HB3 . . 3.340 3.198 2.773 3.425 0.085 8 0 "[ . 1 . 2 ]" 1
1847 1 108 LEU H 1 108 LEU QD . . 4.380 3.241 2.856 3.659 . 0 0 "[ . 1 . 2 ]" 1
1848 1 108 LEU H 1 108 LEU HG . . 4.180 4.157 2.938 4.647 0.467 14 0 "[ . 1 . 2 ]" 1
1849 1 108 LEU H 1 109 LYS H . . 4.420 4.650 4.525 4.740 0.320 13 0 "[ . 1 . 2 ]" 1
1850 1 108 LEU H 1 109 LYS QD . . 5.460 5.320 4.681 5.595 0.135 1 0 "[ . 1 . 2 ]" 1
1851 1 108 LEU HA 1 108 LEU HB3 . . 2.970 2.900 2.746 3.030 0.060 21 0 "[ . 1 . 2 ]" 1
1852 1 108 LEU HA 1 108 LEU QD . . 2.910 2.052 1.975 2.107 . 0 0 "[ . 1 . 2 ]" 1
1853 1 108 LEU HA 1 109 LYS H . . 2.780 2.320 2.110 2.570 . 0 0 "[ . 1 . 2 ]" 1
1854 1 108 LEU HB3 1 109 LYS H . . 4.180 3.242 2.648 3.789 . 0 0 "[ . 1 . 2 ]" 1
1855 1 108 LEU QD 1 109 LYS H . . 5.500 2.901 2.116 3.653 . 0 0 "[ . 1 . 2 ]" 1
1856 1 108 LEU QD 1 109 LYS QE . . 5.500 5.922 3.907 7.122 1.622 12 12 "[*- *.** **+* * ** 2 ]" 1
1857 1 108 LEU HG 1 109 LYS H . . 4.430 3.575 1.982 4.529 0.099 5 0 "[ . 1 . 2 ]" 1
1858 1 109 LYS H 1 109 LYS HB2 . . 3.690 3.260 2.450 3.992 0.302 20 0 "[ . 1 . 2 ]" 1
1859 1 109 LYS H 1 109 LYS HB3 . . 3.400 3.217 2.762 3.485 0.085 8 0 "[ . 1 . 2 ]" 1
1860 1 109 LYS H 1 109 LYS QD . . 4.940 3.711 2.160 5.029 0.089 1 0 "[ . 1 . 2 ]" 1
1861 1 109 LYS H 1 109 LYS QE . . 5.500 4.960 3.176 5.602 0.102 12 0 "[ . 1 . 2 ]" 1
1862 1 109 LYS H 1 109 LYS QG . . 3.660 3.867 2.691 4.463 0.803 9 14 "[***-.** +** * * ** 2 *]" 1
1863 1 109 LYS HA 1 109 LYS QD . . 3.990 2.887 1.986 4.067 0.077 8 0 "[ . 1 . 2 ]" 1
1864 1 109 LYS HA 1 109 LYS QG . . 3.430 2.833 2.077 3.533 0.103 20 0 "[ . 1 . 2 ]" 1
1865 1 109 LYS HA 1 110 ASP H . . 2.820 2.419 2.174 2.683 . 0 0 "[ . 1 . 2 ]" 1
1866 1 109 LYS HB2 1 110 ASP H . . 3.810 3.475 2.250 4.277 0.467 13 0 "[ . 1 . 2 ]" 1
1867 1 109 LYS HB2 1 111 SER H . . 5.500 4.286 2.408 5.576 0.076 2 0 "[ . 1 . 2 ]" 1
1868 1 109 LYS HB3 1 109 LYS QE . . 4.750 3.756 2.114 4.476 . 0 0 "[ . 1 . 2 ]" 1
1869 1 109 LYS HB3 1 110 ASP H . . 4.180 3.364 2.637 3.830 . 0 0 "[ . 1 . 2 ]" 1
1870 1 109 LYS HB3 1 111 SER H . . 5.500 3.616 2.489 5.582 0.082 5 0 "[ . 1 . 2 ]" 1
1871 1 109 LYS QD 1 109 LYS QG . . 2.400 2.077 2.011 2.138 . 0 0 "[ . 1 . 2 ]" 1
1872 1 109 LYS QD 1 110 ASP H . . 5.500 3.999 2.681 5.185 . 0 0 "[ . 1 . 2 ]" 1
1873 1 109 LYS QE 1 109 LYS QG . . 2.870 2.168 1.962 2.386 . 0 0 "[ . 1 . 2 ]" 1
1874 1 109 LYS QE 1 110 ASP H . . 5.500 4.145 2.358 5.584 0.084 14 0 "[ . 1 . 2 ]" 1
1875 1 109 LYS QG 1 110 ASP H . . 4.620 2.484 1.712 3.622 . 0 0 "[ . 1 . 2 ]" 1
1876 1 109 LYS QG 1 111 SER H . . 5.070 3.073 1.870 4.078 . 0 0 "[ . 1 . 2 ]" 1
1877 1 110 ASP H 1 110 ASP QB . . 3.390 2.797 2.229 3.152 . 0 0 "[ . 1 . 2 ]" 1
1878 1 110 ASP H 1 111 SER H . . 4.730 2.831 2.004 3.992 . 0 0 "[ . 1 . 2 ]" 1
1879 1 110 ASP H 1 111 SER QB . . 4.860 4.637 3.951 4.811 . 0 0 "[ . 1 . 2 ]" 1
1880 1 110 ASP HA 1 111 SER H . . 2.930 2.801 2.143 3.062 0.132 17 0 "[ . 1 . 2 ]" 1
1881 1 111 SER H 1 111 SER QB . . 3.710 2.604 2.146 3.113 . 0 0 "[ . 1 . 2 ]" 1
1882 1 111 SER H 1 112 ASP H . . 4.520 4.063 2.512 4.766 0.246 2 0 "[ . 1 . 2 ]" 1
1883 1 111 SER HA 1 112 ASP H . . 3.120 2.753 2.270 3.224 0.104 18 0 "[ . 1 . 2 ]" 1
1884 1 111 SER QB 1 112 ASP H . . 4.960 3.020 1.858 4.101 . 0 0 "[ . 1 . 2 ]" 1
1885 1 111 SER QB 1 113 TYR H . . 5.460 5.255 4.833 5.410 . 0 0 "[ . 1 . 2 ]" 1
1886 1 112 ASP H 1 112 ASP HA . . 2.720 2.841 2.169 3.026 0.306 18 0 "[ . 1 . 2 ]" 1
1887 1 112 ASP H 1 112 ASP HB2 . . 3.890 3.172 2.318 3.840 . 0 0 "[ . 1 . 2 ]" 1
1888 1 112 ASP H 1 112 ASP HB3 . . 3.550 3.275 2.543 3.903 0.353 19 0 "[ . 1 . 2 ]" 1
1889 1 112 ASP H 1 113 TYR H . . 4.150 3.712 2.707 4.265 0.115 20 0 "[ . 1 . 2 ]" 1
1890 1 112 ASP H 1 113 TYR QD . . 5.500 5.367 4.489 5.605 0.105 2 0 "[ . 1 . 2 ]" 1
1891 1 112 ASP HA 1 113 TYR H . . 2.690 2.229 1.985 2.745 0.055 21 0 "[ . 1 . 2 ]" 1
1892 1 112 ASP HB2 1 113 TYR H . . 4.460 4.278 3.292 4.713 0.253 17 0 "[ . 1 . 2 ]" 1
1893 1 112 ASP HB3 1 113 TYR H . . 4.750 4.136 2.406 4.569 . 0 0 "[ . 1 . 2 ]" 1
1894 1 113 TYR H 1 113 TYR QB . . 3.370 2.565 1.921 2.967 . 0 0 "[ . 1 . 2 ]" 1
1895 1 113 TYR H 1 113 TYR QD . . 4.500 4.228 2.651 4.533 0.033 14 0 "[ . 1 . 2 ]" 1
1896 1 113 TYR HA 1 113 TYR QD . . 3.620 2.711 2.027 3.227 . 0 0 "[ . 1 . 2 ]" 1
1897 1 113 TYR HA 1 114 GLU H . . 2.920 2.480 2.131 3.057 0.137 7 0 "[ . 1 . 2 ]" 1
1898 1 113 TYR QB 1 114 GLU H . . 4.040 3.375 2.584 4.104 0.064 6 0 "[ . 1 . 2 ]" 1
1899 1 113 TYR QD 1 114 GLU H . . 4.840 3.038 1.854 4.925 0.085 10 0 "[ . 1 . 2 ]" 1
1900 1 113 TYR QD 1 114 GLU HA . . 4.530 4.400 2.619 4.726 0.196 7 0 "[ . 1 . 2 ]" 1
1901 1 113 TYR QD 1 114 GLU QG . . 3.310 3.216 2.234 3.509 0.199 7 0 "[ . 1 . 2 ]" 1
1902 1 114 GLU H 1 114 GLU HB2 . . 3.970 3.319 2.381 3.958 . 0 0 "[ . 1 . 2 ]" 1
1903 1 114 GLU H 1 114 GLU HB3 . . 3.580 3.308 2.562 3.965 0.385 5 0 "[ . 1 . 2 ]" 1
1904 1 114 GLU H 1 114 GLU QG . . 4.780 2.576 1.852 4.116 . 0 0 "[ . 1 . 2 ]" 1
1905 1 114 GLU HA 1 115 VAL H . . 2.710 2.385 2.114 2.816 0.106 17 0 "[ . 1 . 2 ]" 1
1906 1 114 GLU HA 1 115 VAL QG . . 4.240 3.526 3.070 4.232 . 0 0 "[ . 1 . 2 ]" 1
1907 1 114 GLU HB2 1 114 GLU QG . . 2.470 2.379 2.142 2.575 0.105 21 0 "[ . 1 . 2 ]" 1
1908 1 114 GLU HB2 1 115 VAL H . . 4.880 3.556 2.317 4.638 . 0 0 "[ . 1 . 2 ]" 1
1909 1 114 GLU HB3 1 115 VAL H . . 4.540 3.861 2.099 4.504 . 0 0 "[ . 1 . 2 ]" 1
1910 1 114 GLU QG 1 115 VAL H . . 5.260 4.046 2.457 5.030 . 0 0 "[ . 1 . 2 ]" 1
1911 1 114 GLU QG 1 115 VAL QG . . 4.760 4.617 2.679 5.569 0.809 2 3 "[ + . 1 . -2* ]" 1
1912 1 115 VAL H 1 115 VAL HB . . 3.460 3.240 2.323 3.574 0.114 6 0 "[ . 1 . 2 ]" 1
1913 1 115 VAL H 1 115 VAL QG . . 3.850 2.245 1.817 3.023 . 0 0 "[ . 1 . 2 ]" 1
1914 1 115 VAL HA 1 115 VAL QG . . 3.060 2.196 2.092 2.329 . 0 0 "[ . 1 . 2 ]" 1
1915 1 115 VAL QG 1 116 HIS H . . 4.510 3.134 1.980 3.759 . 0 0 "[ . 1 . 2 ]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, May 18, 2024 5:42:47 AM GMT (wattos1)