NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
446088 |
2kl2   |
16380 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kl2
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 2857
_Distance_constraint_stats_list.Viol_count 4680
_Distance_constraint_stats_list.Viol_total 8083.901
_Distance_constraint_stats_list.Viol_max 0.994
_Distance_constraint_stats_list.Viol_rms 0.0392
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0071
_Distance_constraint_stats_list.Viol_average_violations_only 0.0864
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ALA 2.534 0.118 9 0 "[ . 1 . 2]"
1 3 HIS 5.977 0.588 17 2 "[ . - 1 . + 2]"
1 4 ILE 6.817 0.420 13 0 "[ . 1 . 2]"
1 5 PHE 9.895 0.782 9 6 "[ . +1 * ** *- 2]"
1 6 VAL 3.618 0.165 3 0 "[ . 1 . 2]"
1 7 TYR 0.254 0.090 15 0 "[ . 1 . 2]"
1 8 GLY 0.578 0.090 15 0 "[ . 1 . 2]"
1 9 THR 6.301 0.793 8 2 "[ . + 1 . -2]"
1 10 LEU 3.653 0.316 19 0 "[ . 1 . 2]"
1 11 LYS 4.495 0.810 20 1 "[ . 1 . +]"
1 12 ARG 7.478 0.810 20 2 "[ . 1 . * +]"
1 13 GLY 6.488 0.982 15 2 "[ . 1 - + 2]"
1 14 GLN 11.573 0.982 15 5 "[ . * 1 - *+ *2]"
1 15 PRO 6.415 0.336 7 0 "[ . 1 . 2]"
1 16 ASN 6.854 0.420 15 0 "[ . 1 . 2]"
1 17 HIS 1.998 0.516 2 1 "[ + . 1 . 2]"
1 18 LYS 2.213 0.516 2 1 "[ + . 1 . 2]"
1 19 VAL 1.485 0.114 11 0 "[ . 1 . 2]"
1 20 MET 3.867 0.520 20 1 "[ . 1 . +]"
1 21 LEU 7.950 0.965 20 2 "[ . - 1 . +]"
1 22 ASP 2.023 0.515 7 1 "[ . + 1 . 2]"
1 23 HIS 2.942 0.090 9 0 "[ . 1 . 2]"
1 24 SER 2.759 0.097 6 0 "[ . 1 . 2]"
1 25 HIS 1.532 0.108 20 0 "[ . 1 . 2]"
1 26 GLY 0.630 0.081 2 0 "[ . 1 . 2]"
1 27 LEU 0.700 0.072 10 0 "[ . 1 . 2]"
1 28 ALA 3.791 0.112 6 0 "[ . 1 . 2]"
1 29 ALA 1.804 0.093 3 0 "[ . 1 . 2]"
1 30 PHE 5.450 0.980 14 1 "[ . 1 +. 2]"
1 31 ARG 3.525 0.093 3 0 "[ . 1 . 2]"
1 32 GLY 6.435 0.815 17 4 "[ .* 1- .*+ 2]"
1 33 ARG 23.694 0.853 17 6 "[ .* ** .*+ -2]"
1 34 GLY 0.882 0.086 14 0 "[ . 1 . 2]"
1 35 CYS 0.354 0.270 3 0 "[ . 1 . 2]"
1 36 THR 5.961 0.565 10 2 "[ - . + . 2]"
1 37 VAL 3.832 0.135 3 0 "[ . 1 . 2]"
1 38 GLU 4.160 0.135 3 0 "[ . 1 . 2]"
1 39 SER 2.177 0.103 4 0 "[ . 1 . 2]"
1 40 PHE 9.653 0.233 20 0 "[ . 1 . 2]"
1 41 PRO 4.764 0.233 20 0 "[ . 1 . 2]"
1 42 LEU 3.223 0.325 14 0 "[ . 1 . 2]"
1 43 VAL 4.435 0.314 7 0 "[ . 1 . 2]"
1 44 ILE 7.910 0.913 11 1 "[ . 1+ . 2]"
1 45 ALA 2.722 0.099 13 0 "[ . 1 . 2]"
1 46 GLY 3.502 0.094 19 0 "[ . 1 . 2]"
1 47 GLU 2.770 0.094 12 0 "[ . 1 . 2]"
1 48 HIS 4.225 0.106 18 0 "[ . 1 . 2]"
1 49 ASN 5.367 0.556 12 1 "[ . 1 + . 2]"
1 50 ILE 7.900 0.133 20 0 "[ . 1 . 2]"
1 51 PRO 1.553 0.913 11 1 "[ . 1+ . 2]"
1 52 TRP 6.668 0.094 19 0 "[ . 1 . 2]"
1 53 LEU 6.292 0.167 5 0 "[ . 1 . 2]"
1 54 LEU 4.588 0.119 17 0 "[ . 1 . 2]"
1 55 TYR 7.898 0.111 9 0 "[ . 1 . 2]"
1 56 LEU 5.624 0.669 17 3 "[ *. 1 - . + 2]"
1 57 PRO 2.389 0.103 4 0 "[ . 1 . 2]"
1 58 GLY 0.775 0.087 4 0 "[ . 1 . 2]"
1 59 LYS 13.100 0.984 20 5 "[ *.* 1 - . * +]"
1 60 GLY 2.663 0.252 16 0 "[ . 1 . 2]"
1 61 HIS 4.413 0.861 3 3 "[ + . - * . 2]"
1 62 CYS 9.353 0.861 3 3 "[ + . * * . 2]"
1 63 VAL 4.516 0.325 14 0 "[ . 1 . 2]"
1 64 THR 6.999 0.417 11 0 "[ . 1 . 2]"
1 65 GLY 1.488 0.123 9 0 "[ . 1 . 2]"
1 66 GLU 6.835 0.980 14 1 "[ . 1 +. 2]"
1 67 ILE 5.362 0.207 17 0 "[ . 1 . 2]"
1 68 TYR 5.814 0.120 17 0 "[ . 1 . 2]"
1 69 GLU 5.143 0.938 8 2 "[ . + 1 . - 2]"
1 70 VAL 3.955 0.938 8 2 "[ . + 1 . - 2]"
1 71 ASP 2.574 0.085 10 0 "[ . 1 . 2]"
1 72 GLU 2.602 0.097 1 0 "[ . 1 . 2]"
1 73 GLN 4.527 0.774 11 1 "[ . 1+ . 2]"
1 74 MET 11.908 0.124 6 0 "[ . 1 . 2]"
1 75 LEU 5.705 0.194 10 0 "[ . 1 . 2]"
1 76 ARG 3.340 0.201 9 0 "[ . 1 . 2]"
1 77 PHE 7.861 0.114 11 0 "[ . 1 . 2]"
1 78 LEU 2.151 0.097 11 0 "[ . 1 . 2]"
1 79 ASP 4.464 0.496 3 0 "[ . 1 . 2]"
1 80 ASP 3.626 0.093 12 0 "[ . 1 . 2]"
1 81 PHE 3.094 0.790 7 3 "[ *- + 1 . 2]"
1 82 GLU 6.935 0.790 7 4 "[ **-+ 1 . 2]"
1 83 ASP 9.196 0.741 18 4 "[ . - * . +*2]"
1 84 CYS 8.308 0.496 3 0 "[ . 1 . 2]"
1 85 PRO 3.888 0.457 4 0 "[ . 1 . 2]"
1 86 SER 0.063 0.045 6 0 "[ . 1 . 2]"
1 87 MET 8.585 0.741 18 4 "[ . * - . +*2]"
1 88 TYR 10.162 0.587 18 3 "[ .* - . + 2]"
1 89 GLN 8.815 0.498 4 0 "[ . 1 . 2]"
1 90 ARG 7.704 0.417 7 0 "[ . 1 . 2]"
1 91 THR 5.384 0.114 15 0 "[ . 1 . 2]"
1 92 ALA 4.564 0.105 4 0 "[ . 1 . 2]"
1 93 LEU 12.774 0.782 9 3 "[ . +1 - * 2]"
1 94 GLN 3.066 0.108 10 0 "[ . 1 . 2]"
1 95 VAL 4.268 0.508 18 1 "[ . 1 . + 2]"
1 96 GLN 5.395 0.390 1 0 "[ . 1 . 2]"
1 97 VAL 2.313 0.366 15 0 "[ . 1 . 2]"
1 98 LEU 1.873 0.780 17 2 "[ . 1 .-+ 2]"
1 99 GLU 5.257 0.410 3 0 "[ . 1 . 2]"
1 100 TRP 9.456 0.110 3 0 "[ . 1 . 2]"
1 101 GLU 5.444 0.097 15 0 "[ . 1 . 2]"
1 102 GLY 1.739 0.428 20 0 "[ . 1 . 2]"
1 103 ASP 7.841 0.994 20 2 "[ .* 1 . +]"
1 104 GLY 5.196 0.994 20 2 "[ .* 1 . +]"
1 105 ASP 2.684 0.134 3 0 "[ . 1 . 2]"
1 106 PRO 5.568 0.835 5 5 "[ * + 1* *. -2]"
1 107 GLY 0.988 0.084 17 0 "[ . 1 . 2]"
1 108 ASP 2.309 0.129 7 0 "[ . 1 . 2]"
1 109 SER 1.791 0.390 1 0 "[ . 1 . 2]"
1 110 VAL 6.317 0.835 5 5 "[ * + 1* *. -2]"
1 111 GLN 2.751 0.091 4 0 "[ . 1 . 2]"
1 112 CYS 13.721 0.749 14 5 "[ . 1 * +* *- 2]"
1 113 PHE 7.751 0.324 14 0 "[ . 1 . 2]"
1 114 VAL 2.379 0.118 6 0 "[ . 1 . 2]"
1 115 TYR 2.308 0.199 20 0 "[ . 1 . 2]"
1 116 THR 2.847 0.118 17 0 "[ . 1 . 2]"
1 117 THR 3.860 0.117 11 0 "[ . 1 . 2]"
1 118 ALA 4.539 0.112 14 0 "[ . 1 . 2]"
1 119 THR 3.391 0.116 5 0 "[ . 1 . 2]"
1 120 TYR 4.477 0.116 5 0 "[ . 1 . 2]"
1 122 PRO 5.368 0.669 11 1 "[ . 1+ . 2]"
1 123 GLU 9.471 0.669 11 1 "[ . 1+ . 2]"
1 124 TRP 9.864 0.718 7 1 "[ . + 1 . 2]"
1 125 LEU 2.866 0.102 4 0 "[ . 1 . 2]"
1 126 PHE 2.678 0.875 7 1 "[ . + 1 . 2]"
1 127 LEU 9.155 0.875 7 1 "[ . + 1 . 2]"
1 128 PRO 5.411 0.460 5 0 "[ . 1 . 2]"
1 129 TYR 6.645 0.149 12 0 "[ . 1 . 2]"
1 130 HIS 5.483 0.106 7 0 "[ . 1 . 2]"
1 131 GLU 3.529 0.095 9 0 "[ . 1 . 2]"
1 132 SER 10.124 0.417 11 0 "[ . 1 . 2]"
1 133 TYR 3.156 0.315 11 0 "[ . 1 . 2]"
1 134 ASP 1.208 0.616 14 1 "[ . 1 +. 2]"
1 135 SER 2.814 0.185 11 0 "[ . 1 . 2]"
1 136 GLU 2.314 0.383 9 0 "[ . 1 . 2]"
1 137 GLY 0.781 0.094 12 0 "[ . 1 . 2]"
1 138 PRO 0.401 0.092 20 0 "[ . 1 . 2]"
1 139 HIS 4.539 0.599 20 1 "[ . 1 . +]"
1 140 GLY 1.168 0.105 20 0 "[ . 1 . 2]"
1 141 LEU 4.744 0.599 20 2 "[ . 1 - . +]"
1 142 ARG 9.108 0.889 5 3 "[ * + 1 - . 2]"
1 143 TYR 12.352 0.336 7 0 "[ . 1 . 2]"
1 144 ASN 3.068 0.089 12 0 "[ . 1 . 2]"
1 145 PRO 4.388 0.092 18 0 "[ . 1 . 2]"
1 146 ARG 3.398 0.108 4 0 "[ . 1 . 2]"
1 147 GLU 6.412 0.789 14 3 "[ . -1 +.* 2]"
1 148 ASN 4.885 0.792 13 4 "[ . -1 +*.* 2]"
1 149 ARG 2.453 0.792 13 1 "[ . 1 + . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ALA HA 1 3 HIS H . . 3.130 2.374 2.181 2.905 . 0 0 "[ . 1 . 2]" 1
2 1 2 ALA HA 1 70 VAL MG2 . . 5.500 4.683 4.260 5.181 . 0 0 "[ . 1 . 2]" 1
3 1 2 ALA HA 1 113 PHE QD . . 5.340 4.746 2.736 5.412 0.072 13 0 "[ . 1 . 2]" 1
4 1 2 ALA HA 1 113 PHE QE . . 5.360 3.887 2.405 4.909 . 0 0 "[ . 1 . 2]" 1
5 1 2 ALA MB 1 3 HIS H . . 3.560 2.916 1.983 3.642 0.082 16 0 "[ . 1 . 2]" 1
6 1 2 ALA MB 1 3 HIS HA . . 5.050 4.261 3.824 4.691 . 0 0 "[ . 1 . 2]" 1
7 1 2 ALA MB 1 4 ILE HA . . 5.500 5.335 4.840 5.600 0.100 13 0 "[ . 1 . 2]" 1
8 1 2 ALA MB 1 4 ILE MG . . 4.710 3.233 2.667 4.206 . 0 0 "[ . 1 . 2]" 1
9 1 2 ALA MB 1 70 VAL H . . 5.110 4.096 3.419 4.992 . 0 0 "[ . 1 . 2]" 1
10 1 2 ALA MB 1 70 VAL MG2 . . 3.430 2.659 2.083 3.400 . 0 0 "[ . 1 . 2]" 1
11 1 2 ALA MB 1 71 ASP HA . . 5.500 4.300 3.622 4.882 . 0 0 "[ . 1 . 2]" 1
12 1 2 ALA MB 1 72 GLU H . . 5.500 5.190 4.396 5.597 0.097 1 0 "[ . 1 . 2]" 1
13 1 2 ALA MB 1 72 GLU HA . . 4.940 4.567 3.441 4.998 0.058 9 0 "[ . 1 . 2]" 1
14 1 2 ALA MB 1 72 GLU QG . . 5.320 4.381 3.261 5.123 . 0 0 "[ . 1 . 2]" 1
15 1 2 ALA MB 1 75 LEU H . . 5.500 5.217 4.469 5.604 0.104 19 0 "[ . 1 . 2]" 1
16 1 2 ALA MB 1 75 LEU QD . . 3.450 2.376 1.951 3.098 . 0 0 "[ . 1 . 2]" 1
17 1 2 ALA MB 1 113 PHE QD . . 3.270 2.945 2.236 3.388 0.118 9 0 "[ . 1 . 2]" 1
18 1 2 ALA MB 1 113 PHE QE . . 3.180 2.739 2.201 3.259 0.079 2 0 "[ . 1 . 2]" 1
19 1 3 HIS H 1 3 HIS HB2 . . 3.580 2.558 2.303 3.673 0.093 9 0 "[ . 1 . 2]" 1
20 1 3 HIS H 1 4 ILE H . . 5.490 4.434 3.642 4.654 . 0 0 "[ . 1 . 2]" 1
21 1 3 HIS H 1 4 ILE MG . . 4.440 4.174 3.556 4.541 0.101 16 0 "[ . 1 . 2]" 1
22 1 3 HIS H 1 69 GLU HA . . 5.500 4.887 4.099 5.560 0.060 19 0 "[ . 1 . 2]" 1
23 1 3 HIS H 1 70 VAL MG2 . . 5.500 4.451 3.000 5.222 . 0 0 "[ . 1 . 2]" 1
24 1 3 HIS H 1 113 PHE QD . . 5.500 4.287 3.198 5.340 . 0 0 "[ . 1 . 2]" 1
25 1 3 HIS H 1 113 PHE QE . . 5.490 4.228 2.968 5.544 0.054 3 0 "[ . 1 . 2]" 1
26 1 3 HIS HA 1 3 HIS HD2 . . 3.650 2.708 2.332 3.450 . 0 0 "[ . 1 . 2]" 1
27 1 3 HIS HA 1 4 ILE H . . 2.970 2.224 2.102 2.332 . 0 0 "[ . 1 . 2]" 1
28 1 3 HIS HA 1 4 ILE HA . . 5.260 4.469 4.376 4.560 . 0 0 "[ . 1 . 2]" 1
29 1 3 HIS HA 1 4 ILE HG13 . . 5.070 5.113 4.748 5.490 0.420 13 0 "[ . 1 . 2]" 1
30 1 3 HIS HA 1 4 ILE MG . . 4.400 3.772 3.581 4.040 . 0 0 "[ . 1 . 2]" 1
31 1 3 HIS HA 1 67 ILE MG . . 5.100 4.036 3.452 4.836 . 0 0 "[ . 1 . 2]" 1
32 1 3 HIS HA 1 69 GLU HA . . 3.570 2.541 2.103 3.072 . 0 0 "[ . 1 . 2]" 1
33 1 3 HIS HA 1 69 GLU HB2 . . 5.290 4.586 3.764 5.358 0.068 3 0 "[ . 1 . 2]" 1
34 1 3 HIS HA 1 69 GLU HG2 . . 5.500 5.099 3.816 5.568 0.068 10 0 "[ . 1 . 2]" 1
35 1 3 HIS HA 1 69 GLU HG3 . . 5.000 4.782 3.883 5.588 0.588 17 2 "[ . - 1 . + 2]" 1
36 1 3 HIS HA 1 70 VAL H . . 4.140 3.210 2.631 3.651 . 0 0 "[ . 1 . 2]" 1
37 1 3 HIS HA 1 70 VAL MG2 . . 4.720 3.375 2.589 4.069 . 0 0 "[ . 1 . 2]" 1
38 1 3 HIS HB2 1 4 ILE H . . 4.390 4.178 3.811 4.448 0.058 15 0 "[ . 1 . 2]" 1
39 1 3 HIS HB2 1 110 VAL QG . . 5.500 3.968 3.331 4.720 . 0 0 "[ . 1 . 2]" 1
40 1 3 HIS HB3 1 3 HIS HD2 . . 3.780 2.873 2.570 3.040 . 0 0 "[ . 1 . 2]" 1
41 1 3 HIS HB3 1 4 ILE H . . 3.740 3.204 2.750 3.558 . 0 0 "[ . 1 . 2]" 1
42 1 3 HIS HB3 1 67 ILE MG . . 3.760 2.870 2.117 3.851 0.091 3 0 "[ . 1 . 2]" 1
43 1 3 HIS HB3 1 110 VAL QG . . 5.300 3.916 3.199 4.676 . 0 0 "[ . 1 . 2]" 1
44 1 3 HIS HD2 1 4 ILE H . . 4.630 4.137 3.726 4.701 0.071 9 0 "[ . 1 . 2]" 1
45 1 3 HIS HD2 1 31 ARG HB2 . . 4.840 3.804 2.869 4.411 . 0 0 "[ . 1 . 2]" 1
46 1 3 HIS HD2 1 31 ARG QG . . 3.760 2.855 2.079 3.717 . 0 0 "[ . 1 . 2]" 1
47 1 3 HIS HD2 1 67 ILE MG . . 3.370 3.239 2.405 3.500 0.130 15 0 "[ . 1 . 2]" 1
48 1 3 HIS HD2 1 69 GLU H . . 5.120 3.797 3.387 4.151 . 0 0 "[ . 1 . 2]" 1
49 1 3 HIS HD2 1 69 GLU HA . . 3.570 2.319 2.051 2.534 . 0 0 "[ . 1 . 2]" 1
50 1 3 HIS HD2 1 69 GLU HB2 . . 3.500 2.626 2.030 3.397 . 0 0 "[ . 1 . 2]" 1
51 1 3 HIS HD2 1 69 GLU HB3 . . 5.000 4.128 3.653 4.713 . 0 0 "[ . 1 . 2]" 1
52 1 3 HIS HD2 1 69 GLU HG2 . . 5.260 4.393 3.348 5.060 . 0 0 "[ . 1 . 2]" 1
53 1 3 HIS HD2 1 70 VAL H . . 4.500 4.311 3.765 4.575 0.075 8 0 "[ . 1 . 2]" 1
54 1 4 ILE H 1 4 ILE HB . . 4.130 3.860 3.762 3.949 . 0 0 "[ . 1 . 2]" 1
55 1 4 ILE H 1 4 ILE MD . . 4.900 4.085 3.688 4.233 . 0 0 "[ . 1 . 2]" 1
56 1 4 ILE H 1 4 ILE HG12 . . 4.160 2.534 2.092 2.778 . 0 0 "[ . 1 . 2]" 1
57 1 4 ILE H 1 4 ILE HG13 . . 3.900 3.037 2.793 3.421 . 0 0 "[ . 1 . 2]" 1
58 1 4 ILE H 1 4 ILE MG . . 3.610 3.000 2.760 3.171 . 0 0 "[ . 1 . 2]" 1
59 1 4 ILE H 1 5 PHE H . . 5.500 4.410 4.313 4.502 . 0 0 "[ . 1 . 2]" 1
60 1 4 ILE H 1 67 ILE MG . . 4.450 3.596 3.153 4.404 . 0 0 "[ . 1 . 2]" 1
61 1 4 ILE H 1 68 TYR H . . 3.870 3.376 2.872 3.820 . 0 0 "[ . 1 . 2]" 1
62 1 4 ILE H 1 68 TYR HB2 . . 4.990 4.188 3.413 4.735 . 0 0 "[ . 1 . 2]" 1
63 1 4 ILE H 1 69 GLU HA . . 4.470 3.794 3.288 4.333 . 0 0 "[ . 1 . 2]" 1
64 1 4 ILE H 1 70 VAL H . . 5.290 4.218 3.246 4.766 . 0 0 "[ . 1 . 2]" 1
65 1 4 ILE H 1 70 VAL MG1 . . 4.780 3.711 3.374 4.060 . 0 0 "[ . 1 . 2]" 1
66 1 4 ILE H 1 70 VAL MG2 . . 4.720 3.312 2.607 3.793 . 0 0 "[ . 1 . 2]" 1
67 1 4 ILE H 1 113 PHE H . . 5.380 4.742 4.546 5.096 . 0 0 "[ . 1 . 2]" 1
68 1 4 ILE HA 1 4 ILE MD . . 4.590 4.153 4.113 4.210 . 0 0 "[ . 1 . 2]" 1
69 1 4 ILE HA 1 4 ILE MG . . 3.410 2.301 2.238 2.375 . 0 0 "[ . 1 . 2]" 1
70 1 4 ILE HA 1 5 PHE H . . 3.240 2.497 2.260 2.684 . 0 0 "[ . 1 . 2]" 1
71 1 4 ILE HA 1 75 LEU QD . . 5.500 4.766 4.330 5.040 . 0 0 "[ . 1 . 2]" 1
72 1 4 ILE HA 1 112 CYS HA . . 4.460 3.669 2.829 4.276 . 0 0 "[ . 1 . 2]" 1
73 1 4 ILE HA 1 112 CYS HB2 . . 4.610 3.277 2.106 4.608 . 0 0 "[ . 1 . 2]" 1
74 1 4 ILE HA 1 112 CYS HB3 . . 4.140 2.972 2.178 4.138 . 0 0 "[ . 1 . 2]" 1
75 1 4 ILE HA 1 113 PHE H . . 2.900 2.143 1.975 2.416 . 0 0 "[ . 1 . 2]" 1
76 1 4 ILE HA 1 113 PHE HB2 . . 5.050 3.402 2.635 3.915 . 0 0 "[ . 1 . 2]" 1
77 1 4 ILE HA 1 113 PHE QD . . 4.660 4.077 3.155 4.732 0.072 18 0 "[ . 1 . 2]" 1
78 1 4 ILE HB 1 4 ILE MD . . 3.480 2.333 2.261 2.530 . 0 0 "[ . 1 . 2]" 1
79 1 4 ILE HB 1 5 PHE H . . 3.440 2.248 1.934 2.686 . 0 0 "[ . 1 . 2]" 1
80 1 4 ILE HB 1 113 PHE H . . 5.260 3.896 3.067 4.572 . 0 0 "[ . 1 . 2]" 1
81 1 4 ILE HB 1 113 PHE HB3 . . 5.290 4.889 4.562 5.354 0.064 18 0 "[ . 1 . 2]" 1
82 1 4 ILE MD 1 4 ILE MG . . 3.000 2.157 1.981 2.232 . 0 0 "[ . 1 . 2]" 1
83 1 4 ILE MD 1 5 PHE H . . 4.650 3.803 3.263 4.412 . 0 0 "[ . 1 . 2]" 1
84 1 4 ILE MD 1 6 VAL H . . 5.280 5.294 4.866 5.382 0.102 9 0 "[ . 1 . 2]" 1
85 1 4 ILE MD 1 6 VAL HA . . 5.500 4.358 3.698 4.736 . 0 0 "[ . 1 . 2]" 1
86 1 4 ILE MD 1 68 TYR H . . 5.010 4.666 4.252 5.080 0.070 7 0 "[ . 1 . 2]" 1
87 1 4 ILE MD 1 68 TYR HB2 . . 3.960 3.293 2.917 3.841 . 0 0 "[ . 1 . 2]" 1
88 1 4 ILE MD 1 68 TYR HB3 . . 4.900 4.272 3.761 4.946 0.046 18 0 "[ . 1 . 2]" 1
89 1 4 ILE MD 1 68 TYR QD . . 4.720 4.200 3.494 4.827 0.107 12 0 "[ . 1 . 2]" 1
90 1 4 ILE MD 1 75 LEU HA . . 5.500 4.087 3.699 4.752 . 0 0 "[ . 1 . 2]" 1
91 1 4 ILE MD 1 113 PHE QD . . 5.500 5.414 4.971 5.629 0.129 9 0 "[ . 1 . 2]" 1
92 1 4 ILE MD 1 114 VAL HA . . 5.360 5.070 4.887 5.452 0.092 11 0 "[ . 1 . 2]" 1
93 1 4 ILE HG12 1 5 PHE H . . 4.880 4.551 4.162 4.869 . 0 0 "[ . 1 . 2]" 1
94 1 4 ILE HG12 1 68 TYR H . . 4.590 4.093 3.524 4.590 0.000 3 0 "[ . 1 . 2]" 1
95 1 4 ILE HG12 1 68 TYR HB2 . . 4.190 3.257 2.561 3.909 . 0 0 "[ . 1 . 2]" 1
96 1 4 ILE HG12 1 68 TYR HB3 . . 5.210 4.278 3.688 5.010 . 0 0 "[ . 1 . 2]" 1
97 1 4 ILE HG12 1 70 VAL MG1 . . 4.710 2.266 2.129 2.586 . 0 0 "[ . 1 . 2]" 1
98 1 4 ILE HG13 1 4 ILE MG . . 3.420 3.246 3.206 3.279 . 0 0 "[ . 1 . 2]" 1
99 1 4 ILE HG13 1 5 PHE H . . 4.090 3.416 3.042 3.849 . 0 0 "[ . 1 . 2]" 1
100 1 4 ILE HG13 1 5 PHE HA . . 4.900 3.928 3.664 4.154 . 0 0 "[ . 1 . 2]" 1
101 1 4 ILE HG13 1 68 TYR H . . 4.800 3.335 2.973 3.862 . 0 0 "[ . 1 . 2]" 1
102 1 4 ILE HG13 1 68 TYR HB2 . . 4.070 2.872 2.304 3.549 . 0 0 "[ . 1 . 2]" 1
103 1 4 ILE HG13 1 70 VAL MG1 . . 3.780 3.259 3.024 3.764 . 0 0 "[ . 1 . 2]" 1
104 1 4 ILE HG13 1 70 VAL MG2 . . 4.570 3.822 3.518 4.340 . 0 0 "[ . 1 . 2]" 1
105 1 4 ILE MG 1 5 PHE H . . 4.970 3.694 3.563 3.854 . 0 0 "[ . 1 . 2]" 1
106 1 4 ILE MG 1 75 LEU HA . . 5.200 4.315 4.002 4.704 . 0 0 "[ . 1 . 2]" 1
107 1 4 ILE MG 1 75 LEU QD . . 3.530 2.224 1.991 2.919 . 0 0 "[ . 1 . 2]" 1
108 1 4 ILE MG 1 113 PHE H . . 3.700 2.826 2.303 3.631 . 0 0 "[ . 1 . 2]" 1
109 1 4 ILE MG 1 113 PHE HB2 . . 3.540 2.065 2.014 2.124 . 0 0 "[ . 1 . 2]" 1
110 1 4 ILE MG 1 113 PHE HB3 . . 3.460 3.514 3.336 3.562 0.102 10 0 "[ . 1 . 2]" 1
111 1 4 ILE MG 1 113 PHE QD . . 4.060 2.502 2.123 3.000 . 0 0 "[ . 1 . 2]" 1
112 1 4 ILE MG 1 113 PHE QE . . 5.500 4.431 3.970 4.951 . 0 0 "[ . 1 . 2]" 1
113 1 5 PHE H 1 5 PHE HB2 . . 3.560 3.021 2.609 3.325 . 0 0 "[ . 1 . 2]" 1
114 1 5 PHE H 1 5 PHE QD . . 4.750 4.267 4.147 4.369 . 0 0 "[ . 1 . 2]" 1
115 1 5 PHE H 1 6 VAL H . . 5.120 4.377 4.256 4.520 . 0 0 "[ . 1 . 2]" 1
116 1 5 PHE H 1 95 VAL QG . . 5.500 4.596 4.353 5.014 . 0 0 "[ . 1 . 2]" 1
117 1 5 PHE H 1 112 CYS HB2 . . 4.700 3.781 2.489 4.746 0.046 13 0 "[ . 1 . 2]" 1
118 1 5 PHE H 1 112 CYS HB3 . . 4.030 3.762 2.776 4.779 0.749 14 5 "[ . 1 - +* ** 2]" 1
119 1 5 PHE H 1 113 PHE HA . . 5.500 5.381 5.007 5.584 0.084 5 0 "[ . 1 . 2]" 1
120 1 5 PHE H 1 114 VAL HA . . 4.510 3.765 3.151 4.332 . 0 0 "[ . 1 . 2]" 1
121 1 5 PHE H 1 114 VAL QG . . 5.390 3.049 2.604 3.544 . 0 0 "[ . 1 . 2]" 1
122 1 5 PHE HA 1 5 PHE QD . . 3.620 2.582 2.209 2.935 . 0 0 "[ . 1 . 2]" 1
123 1 5 PHE HA 1 6 VAL H . . 3.090 2.298 2.139 2.699 . 0 0 "[ . 1 . 2]" 1
124 1 5 PHE HA 1 6 VAL QG . . 4.530 3.637 3.164 4.052 . 0 0 "[ . 1 . 2]" 1
125 1 5 PHE HA 1 66 GLU H . . 5.500 4.517 3.979 5.054 . 0 0 "[ . 1 . 2]" 1
126 1 5 PHE HA 1 67 ILE HA . . 3.740 2.673 2.306 3.100 . 0 0 "[ . 1 . 2]" 1
127 1 5 PHE HA 1 67 ILE HG12 . . 5.130 3.723 2.800 4.731 . 0 0 "[ . 1 . 2]" 1
128 1 5 PHE HA 1 67 ILE HG13 . . 5.500 4.600 3.968 5.369 . 0 0 "[ . 1 . 2]" 1
129 1 5 PHE HA 1 67 ILE MG . . 4.690 3.970 3.709 4.444 . 0 0 "[ . 1 . 2]" 1
130 1 5 PHE HA 1 68 TYR H . . 4.250 3.427 3.041 3.858 . 0 0 "[ . 1 . 2]" 1
131 1 5 PHE HA 1 95 VAL QG . . 5.260 4.035 3.719 4.554 . 0 0 "[ . 1 . 2]" 1
132 1 5 PHE HB2 1 6 VAL H . . 4.410 4.129 3.729 4.362 . 0 0 "[ . 1 . 2]" 1
133 1 5 PHE HB2 1 67 ILE MG . . 5.500 4.399 3.392 5.557 0.057 3 0 "[ . 1 . 2]" 1
134 1 5 PHE HB2 1 93 LEU QD . . 3.980 3.745 3.156 4.762 0.782 9 1 "[ . +1 . 2]" 1
135 1 5 PHE HB2 1 95 VAL QG . . 3.480 2.434 2.079 3.219 . 0 0 "[ . 1 . 2]" 1
136 1 5 PHE HB2 1 112 CYS HB2 . . 3.940 3.123 2.514 4.013 0.073 18 0 "[ . 1 . 2]" 1
137 1 5 PHE HB2 1 112 CYS HB3 . . 3.950 3.271 2.525 3.922 . 0 0 "[ . 1 . 2]" 1
138 1 5 PHE HB2 1 114 VAL QG . . 4.610 3.250 2.374 3.782 . 0 0 "[ . 1 . 2]" 1
139 1 5 PHE HB3 1 112 CYS HB2 . . 5.230 3.770 2.814 5.055 . 0 0 "[ . 1 . 2]" 1
140 1 5 PHE QD 1 6 VAL H . . 4.400 3.282 2.715 3.642 . 0 0 "[ . 1 . 2]" 1
141 1 5 PHE QD 1 34 GLY H . . 5.200 4.825 4.551 5.190 . 0 0 "[ . 1 . 2]" 1
142 1 5 PHE QD 1 34 GLY HA3 . . 4.940 3.960 3.440 4.436 . 0 0 "[ . 1 . 2]" 1
143 1 5 PHE QD 1 36 THR H . . 5.500 5.377 4.839 5.589 0.089 5 0 "[ . 1 . 2]" 1
144 1 5 PHE QD 1 63 VAL QG . . 5.490 4.507 3.962 4.934 . 0 0 "[ . 1 . 2]" 1
145 1 5 PHE QD 1 67 ILE HA . . 4.150 3.184 2.636 3.770 . 0 0 "[ . 1 . 2]" 1
146 1 5 PHE QD 1 67 ILE HB . . 5.270 4.926 4.432 5.346 0.076 11 0 "[ . 1 . 2]" 1
147 1 5 PHE QD 1 67 ILE MD . . 4.490 3.743 2.585 4.272 . 0 0 "[ . 1 . 2]" 1
148 1 5 PHE QD 1 67 ILE HG12 . . 3.660 2.471 2.078 3.094 . 0 0 "[ . 1 . 2]" 1
149 1 5 PHE QD 1 67 ILE HG13 . . 4.370 2.988 2.265 3.596 . 0 0 "[ . 1 . 2]" 1
150 1 5 PHE QD 1 67 ILE MG . . 5.500 4.077 3.282 4.503 . 0 0 "[ . 1 . 2]" 1
151 1 5 PHE QD 1 95 VAL QG . . 3.340 2.422 2.211 2.696 . 0 0 "[ . 1 . 2]" 1
152 1 5 PHE QD 1 112 CYS HB2 . . 4.860 4.792 4.272 5.480 0.620 18 1 "[ . 1 . + 2]" 1
153 1 5 PHE QD 1 114 VAL QG . . 2.840 2.381 2.047 2.945 0.105 18 0 "[ . 1 . 2]" 1
154 1 5 PHE QE 1 35 CYS HA . . 4.040 3.288 2.875 3.553 . 0 0 "[ . 1 . 2]" 1
155 1 5 PHE QE 1 36 THR H . . 4.510 3.667 3.064 3.968 . 0 0 "[ . 1 . 2]" 1
156 1 5 PHE QE 1 36 THR MG . . 5.050 2.375 2.065 3.527 . 0 0 "[ . 1 . 2]" 1
157 1 5 PHE QE 1 63 VAL QG . . 4.460 3.037 2.324 3.481 . 0 0 "[ . 1 . 2]" 1
158 1 5 PHE QE 1 64 THR HA . . 4.590 4.217 3.742 4.517 . 0 0 "[ . 1 . 2]" 1
159 1 5 PHE QE 1 65 GLY H . . 4.160 3.302 2.414 3.747 . 0 0 "[ . 1 . 2]" 1
160 1 5 PHE QE 1 65 GLY HA2 . . 5.420 4.286 3.882 4.617 . 0 0 "[ . 1 . 2]" 1
161 1 5 PHE QE 1 65 GLY HA3 . . 4.590 3.001 2.585 3.369 . 0 0 "[ . 1 . 2]" 1
162 1 5 PHE HZ 1 34 GLY HA3 . . 4.800 4.721 4.269 4.886 0.086 14 0 "[ . 1 . 2]" 1
163 1 5 PHE HZ 1 35 CYS H . . 5.160 4.422 4.088 4.649 . 0 0 "[ . 1 . 2]" 1
164 1 5 PHE HZ 1 35 CYS HA . . 4.540 2.246 2.047 2.556 . 0 0 "[ . 1 . 2]" 1
165 1 5 PHE HZ 1 36 THR H . . 4.980 3.291 2.894 3.595 . 0 0 "[ . 1 . 2]" 1
166 1 5 PHE HZ 1 36 THR MG . . 3.660 3.462 2.929 3.754 0.094 10 0 "[ . 1 . 2]" 1
167 1 5 PHE HZ 1 63 VAL HB . . 5.410 4.872 4.261 5.501 0.091 14 0 "[ . 1 . 2]" 1
168 1 5 PHE HZ 1 63 VAL QG . . 4.480 4.049 3.188 4.463 . 0 0 "[ . 1 . 2]" 1
169 1 5 PHE HZ 1 64 THR HA . . 4.420 3.068 2.791 3.409 . 0 0 "[ . 1 . 2]" 1
170 1 5 PHE HZ 1 64 THR HB . . 5.080 4.958 4.614 5.152 0.072 3 0 "[ . 1 . 2]" 1
171 1 5 PHE HZ 1 65 GLY H . . 3.720 2.756 2.466 3.109 . 0 0 "[ . 1 . 2]" 1
172 1 5 PHE HZ 1 65 GLY HA3 . . 4.710 2.704 2.428 3.134 . 0 0 "[ . 1 . 2]" 1
173 1 5 PHE HZ 1 95 VAL QG . . 4.160 3.537 3.211 3.773 . 0 0 "[ . 1 . 2]" 1
174 1 6 VAL H 1 6 VAL HB . . 4.180 3.271 2.533 3.762 . 0 0 "[ . 1 . 2]" 1
175 1 6 VAL H 1 6 VAL QG . . 3.390 2.104 1.831 2.575 . 0 0 "[ . 1 . 2]" 1
176 1 6 VAL H 1 65 GLY HA3 . . 5.500 4.104 3.254 5.151 . 0 0 "[ . 1 . 2]" 1
177 1 6 VAL H 1 66 GLU H . . 4.090 3.024 2.650 3.675 . 0 0 "[ . 1 . 2]" 1
178 1 6 VAL H 1 66 GLU HB3 . . 5.500 5.089 4.253 5.575 0.075 17 0 "[ . 1 . 2]" 1
179 1 6 VAL H 1 67 ILE HA . . 4.410 3.950 3.493 4.486 0.076 11 0 "[ . 1 . 2]" 1
180 1 6 VAL H 1 68 TYR QD . . 4.850 3.883 3.190 4.708 . 0 0 "[ . 1 . 2]" 1
181 1 6 VAL HA 1 7 TYR H . . 3.510 2.289 2.045 2.694 . 0 0 "[ . 1 . 2]" 1
182 1 6 VAL HA 1 10 LEU QD . . 5.500 4.049 2.937 5.056 . 0 0 "[ . 1 . 2]" 1
183 1 6 VAL HA 1 68 TYR QD . . 4.770 4.723 3.870 4.876 0.106 4 0 "[ . 1 . 2]" 1
184 1 6 VAL HB 1 7 TYR H . . 5.230 3.550 2.084 4.400 . 0 0 "[ . 1 . 2]" 1
185 1 6 VAL HB 1 10 LEU H . . 5.490 3.899 2.506 5.572 0.082 15 0 "[ . 1 . 2]" 1
186 1 6 VAL HB 1 10 LEU HB2 . . 4.620 3.591 2.635 4.064 . 0 0 "[ . 1 . 2]" 1
187 1 6 VAL HB 1 10 LEU HB3 . . 5.430 5.108 4.026 5.519 0.089 15 0 "[ . 1 . 2]" 1
188 1 6 VAL HB 1 10 LEU QD . . 4.950 3.871 2.749 4.678 . 0 0 "[ . 1 . 2]" 1
189 1 6 VAL HB 1 66 GLU H . . 4.620 4.367 3.944 4.679 0.059 2 0 "[ . 1 . 2]" 1
190 1 6 VAL HB 1 68 TYR QD . . 5.400 3.640 2.275 5.307 . 0 0 "[ . 1 . 2]" 1
191 1 6 VAL HB 1 68 TYR QE . . 5.350 3.580 2.305 4.981 . 0 0 "[ . 1 . 2]" 1
192 1 6 VAL QG 1 7 TYR H . . 4.300 2.899 1.764 3.733 . 0 0 "[ . 1 . 2]" 1
193 1 6 VAL QG 1 10 LEU H . . 5.010 2.684 1.917 3.861 . 0 0 "[ . 1 . 2]" 1
194 1 6 VAL QG 1 10 LEU HB3 . . 3.690 3.271 2.511 3.588 . 0 0 "[ . 1 . 2]" 1
195 1 6 VAL QG 1 10 LEU QD . . 5.190 2.406 1.983 3.206 . 0 0 "[ . 1 . 2]" 1
196 1 6 VAL QG 1 10 LEU HG . . 5.190 3.928 2.936 4.875 . 0 0 "[ . 1 . 2]" 1
197 1 6 VAL QG 1 11 LYS HA . . 4.070 3.255 2.164 3.805 . 0 0 "[ . 1 . 2]" 1
198 1 6 VAL QG 1 11 LYS HB3 . . 3.490 3.132 1.926 3.655 0.165 3 0 "[ . 1 . 2]" 1
199 1 6 VAL QG 1 11 LYS QG . . 4.110 2.672 2.044 3.606 . 0 0 "[ . 1 . 2]" 1
200 1 6 VAL QG 1 12 ARG H . . 5.500 4.762 4.090 5.202 . 0 0 "[ . 1 . 2]" 1
201 1 6 VAL QG 1 66 GLU H . . 4.180 1.905 1.605 2.306 . 0 0 "[ . 1 . 2]" 1
202 1 6 VAL QG 1 66 GLU HA . . 5.380 3.946 3.702 4.371 . 0 0 "[ . 1 . 2]" 1
203 1 6 VAL QG 1 67 ILE HA . . 5.050 4.141 3.497 4.596 . 0 0 "[ . 1 . 2]" 1
204 1 6 VAL QG 1 68 TYR QD . . 3.530 2.530 1.971 3.171 . 0 0 "[ . 1 . 2]" 1
205 1 6 VAL QG 1 68 TYR QE . . 2.950 2.064 1.804 2.570 . 0 0 "[ . 1 . 2]" 1
206 1 7 TYR H 1 8 GLY HA2 . . 5.340 5.004 4.316 5.412 0.072 11 0 "[ . 1 . 2]" 1
207 1 7 TYR H 1 8 GLY HA3 . . 5.500 5.112 3.896 5.590 0.090 15 0 "[ . 1 . 2]" 1
208 1 8 GLY HA2 1 9 THR MG . . 5.500 5.034 4.076 5.449 . 0 0 "[ . 1 . 2]" 1
209 1 8 GLY HA2 1 133 TYR QB . . 4.820 3.660 2.462 4.774 . 0 0 "[ . 1 . 2]" 1
210 1 8 GLY HA2 1 133 TYR QD . . 4.690 3.994 2.306 4.770 0.080 5 0 "[ . 1 . 2]" 1
211 1 8 GLY HA3 1 9 THR MG . . 5.500 4.087 3.435 4.887 . 0 0 "[ . 1 . 2]" 1
212 1 8 GLY HA3 1 133 TYR QB . . 4.870 2.592 1.911 3.375 . 0 0 "[ . 1 . 2]" 1
213 1 8 GLY HA3 1 133 TYR QD . . 4.100 2.823 2.255 3.604 . 0 0 "[ . 1 . 2]" 1
214 1 9 THR H 1 9 THR MG . . 3.780 2.673 1.954 3.311 . 0 0 "[ . 1 . 2]" 1
215 1 9 THR H 1 10 LEU HG . . 5.500 5.303 4.620 5.592 0.092 1 0 "[ . 1 . 2]" 1
216 1 9 THR HA 1 14 GLN H . . 4.820 4.474 3.723 4.912 0.092 14 0 "[ . 1 . 2]" 1
217 1 9 THR HA 1 14 GLN HB2 . . 4.410 2.581 2.078 3.751 . 0 0 "[ . 1 . 2]" 1
218 1 9 THR HA 1 14 GLN HB3 . . 3.670 2.856 2.172 4.463 0.793 8 2 "[ . + 1 . -2]" 1
219 1 9 THR HA 1 14 GLN HG2 . . 5.260 2.210 1.931 2.802 . 0 0 "[ . 1 . 2]" 1
220 1 9 THR HA 1 14 GLN HG3 . . 5.490 3.372 1.992 4.047 . 0 0 "[ . 1 . 2]" 1
221 1 9 THR HA 1 15 PRO HD2 . . 4.640 4.556 4.027 4.728 0.088 4 0 "[ . 1 . 2]" 1
222 1 9 THR HB 1 16 ASN HB2 . . 4.350 2.643 2.125 3.189 . 0 0 "[ . 1 . 2]" 1
223 1 9 THR HB 1 16 ASN HB3 . . 4.280 3.721 2.699 4.351 0.071 2 0 "[ . 1 . 2]" 1
224 1 9 THR HB 1 16 ASN HD21 . . 4.710 2.635 1.714 3.364 . 0 0 "[ . 1 . 2]" 1
225 1 9 THR HB 1 16 ASN HD22 . . 5.060 3.841 3.144 4.736 . 0 0 "[ . 1 . 2]" 1
226 1 9 THR MG 1 15 PRO HD2 . . 5.170 4.047 3.597 4.350 . 0 0 "[ . 1 . 2]" 1
227 1 9 THR MG 1 15 PRO HD3 . . 5.500 5.529 5.183 5.602 0.102 6 0 "[ . 1 . 2]" 1
228 1 9 THR MG 1 15 PRO HG2 . . 5.500 4.815 3.830 5.579 0.079 2 0 "[ . 1 . 2]" 1
229 1 9 THR MG 1 16 ASN H . . 4.830 4.488 3.792 4.935 0.105 8 0 "[ . 1 . 2]" 1
230 1 9 THR MG 1 16 ASN HD21 . . 4.730 2.269 1.808 3.055 . 0 0 "[ . 1 . 2]" 1
231 1 9 THR MG 1 16 ASN HD22 . . 4.350 2.551 2.180 3.093 . 0 0 "[ . 1 . 2]" 1
232 1 9 THR MG 1 143 TYR HB2 . . 4.540 4.333 3.533 4.636 0.096 1 0 "[ . 1 . 2]" 1
233 1 9 THR MG 1 143 TYR HB3 . . 5.460 4.812 4.100 5.377 . 0 0 "[ . 1 . 2]" 1
234 1 9 THR MG 1 143 TYR QD . . 4.480 4.359 3.285 4.600 0.120 12 0 "[ . 1 . 2]" 1
235 1 10 LEU H 1 10 LEU QD . . 4.390 2.526 1.873 3.218 . 0 0 "[ . 1 . 2]" 1
236 1 10 LEU H 1 10 LEU HG . . 4.010 3.548 2.516 4.086 0.076 16 0 "[ . 1 . 2]" 1
237 1 10 LEU H 1 11 LYS H . . 3.840 2.885 2.171 3.568 . 0 0 "[ . 1 . 2]" 1
238 1 10 LEU HA 1 10 LEU QD . . 3.490 2.896 2.231 3.216 . 0 0 "[ . 1 . 2]" 1
239 1 10 LEU HA 1 10 LEU HG . . 4.180 2.971 2.481 4.008 . 0 0 "[ . 1 . 2]" 1
240 1 10 LEU HA 1 16 ASN H . . 5.500 5.331 4.921 5.581 0.081 2 0 "[ . 1 . 2]" 1
241 1 10 LEU HA 1 16 ASN HB2 . . 5.180 4.440 3.930 5.169 . 0 0 "[ . 1 . 2]" 1
242 1 10 LEU HA 1 17 HIS H . . 5.270 3.983 3.386 4.520 . 0 0 "[ . 1 . 2]" 1
243 1 10 LEU HA 1 17 HIS HA . . 3.430 2.487 2.100 3.100 . 0 0 "[ . 1 . 2]" 1
244 1 10 LEU HA 1 17 HIS HB2 . . 4.860 2.829 2.229 3.537 . 0 0 "[ . 1 . 2]" 1
245 1 10 LEU HA 1 17 HIS HD2 . . 4.790 4.620 3.104 4.872 0.082 14 0 "[ . 1 . 2]" 1
246 1 10 LEU HA 1 20 MET ME . . 4.870 4.343 3.809 4.781 . 0 0 "[ . 1 . 2]" 1
247 1 10 LEU HA 1 20 MET QG . . 4.900 4.280 3.682 4.819 . 0 0 "[ . 1 . 2]" 1
248 1 10 LEU HB3 1 17 HIS HA . . 4.930 3.043 2.275 4.080 . 0 0 "[ . 1 . 2]" 1
249 1 10 LEU HB3 1 20 MET ME . . 5.500 2.364 1.954 2.877 . 0 0 "[ . 1 . 2]" 1
250 1 10 LEU HB3 1 20 MET QG . . 4.040 2.810 2.321 3.746 . 0 0 "[ . 1 . 2]" 1
251 1 10 LEU QD 1 16 ASN H . . 5.500 4.746 4.091 5.131 . 0 0 "[ . 1 . 2]" 1
252 1 10 LEU QD 1 16 ASN HA . . 5.000 4.381 3.838 4.788 . 0 0 "[ . 1 . 2]" 1
253 1 10 LEU QD 1 16 ASN HB2 . . 3.710 3.010 2.277 3.681 . 0 0 "[ . 1 . 2]" 1
254 1 10 LEU QD 1 16 ASN HB3 . . 4.560 3.306 2.546 4.189 . 0 0 "[ . 1 . 2]" 1
255 1 10 LEU QD 1 16 ASN HD21 . . 5.500 4.234 3.488 5.245 . 0 0 "[ . 1 . 2]" 1
256 1 10 LEU QD 1 17 HIS H . . 4.720 4.051 3.265 4.663 . 0 0 "[ . 1 . 2]" 1
257 1 10 LEU QD 1 17 HIS HA . . 4.000 2.232 1.929 2.794 . 0 0 "[ . 1 . 2]" 1
258 1 10 LEU QD 1 17 HIS HD2 . . 4.330 4.134 3.007 4.404 0.074 2 0 "[ . 1 . 2]" 1
259 1 10 LEU QD 1 18 LYS H . . 5.170 4.593 4.238 5.124 . 0 0 "[ . 1 . 2]" 1
260 1 10 LEU QD 1 19 VAL H . . 4.310 3.479 3.257 3.995 . 0 0 "[ . 1 . 2]" 1
261 1 10 LEU QD 1 19 VAL HA . . 5.460 4.928 4.709 5.147 . 0 0 "[ . 1 . 2]" 1
262 1 10 LEU QD 1 19 VAL HB . . 4.080 4.083 3.843 4.124 0.044 6 0 "[ . 1 . 2]" 1
263 1 10 LEU QD 1 19 VAL QG . . 3.240 1.874 1.793 2.084 . 0 0 "[ . 1 . 2]" 1
264 1 10 LEU QD 1 20 MET H . . 5.290 2.843 2.459 3.684 . 0 0 "[ . 1 . 2]" 1
265 1 10 LEU QD 1 20 MET HA . . 5.480 4.210 3.808 5.269 . 0 0 "[ . 1 . 2]" 1
266 1 10 LEU QD 1 20 MET ME . . 3.610 2.497 2.014 3.428 . 0 0 "[ . 1 . 2]" 1
267 1 10 LEU QD 1 20 MET QG . . 3.640 2.257 1.870 3.005 . 0 0 "[ . 1 . 2]" 1
268 1 10 LEU QD 1 81 PHE QD . . 5.060 4.289 3.226 4.757 . 0 0 "[ . 1 . 2]" 1
269 1 10 LEU HG 1 16 ASN HB3 . . 5.220 4.366 3.406 5.536 0.316 19 0 "[ . 1 . 2]" 1
270 1 11 LYS H 1 11 LYS HB3 . . 3.410 2.925 2.396 3.487 0.077 11 0 "[ . 1 . 2]" 1
271 1 11 LYS H 1 11 LYS QG . . 4.810 4.068 2.303 4.497 . 0 0 "[ . 1 . 2]" 1
272 1 11 LYS H 1 12 ARG H . . 4.550 2.661 2.111 3.023 . 0 0 "[ . 1 . 2]" 1
273 1 11 LYS H 1 12 ARG HB2 . . 5.100 4.793 3.991 5.910 0.810 20 1 "[ . 1 . +]" 1
274 1 11 LYS H 1 14 GLN H . . 5.110 4.033 3.331 5.007 . 0 0 "[ . 1 . 2]" 1
275 1 11 LYS HA 1 11 LYS QG . . 4.020 2.549 2.150 3.422 . 0 0 "[ . 1 . 2]" 1
276 1 11 LYS HA 1 12 ARG HA . . 4.930 4.584 4.374 4.738 . 0 0 "[ . 1 . 2]" 1
277 1 11 LYS HB2 1 12 ARG H . . 4.650 3.760 2.845 4.532 . 0 0 "[ . 1 . 2]" 1
278 1 11 LYS HB2 1 65 GLY HA2 . . 4.810 4.274 3.618 4.933 0.123 9 0 "[ . 1 . 2]" 1
279 1 11 LYS HB2 1 66 GLU H . . 5.500 4.279 3.691 4.939 . 0 0 "[ . 1 . 2]" 1
280 1 11 LYS HB3 1 12 ARG H . . 5.000 2.599 2.027 4.568 . 0 0 "[ . 1 . 2]" 1
281 1 11 LYS HB3 1 66 GLU H . . 5.350 5.233 3.978 5.574 0.224 6 0 "[ . 1 . 2]" 1
282 1 11 LYS QG 1 65 GLY HA2 . . 5.450 3.136 2.225 4.350 . 0 0 "[ . 1 . 2]" 1
283 1 11 LYS QG 1 66 GLU H . . 5.500 3.607 2.276 5.060 . 0 0 "[ . 1 . 2]" 1
284 1 11 LYS QG 1 66 GLU HB3 . . 5.450 3.971 2.552 5.305 . 0 0 "[ . 1 . 2]" 1
285 1 12 ARG H 1 12 ARG HB2 . . 3.080 2.523 2.170 3.762 0.682 20 1 "[ . 1 . +]" 1
286 1 12 ARG H 1 12 ARG HB3 . . 3.860 3.273 2.375 3.852 . 0 0 "[ . 1 . 2]" 1
287 1 12 ARG H 1 12 ARG HD2 . . 4.940 4.502 2.778 5.054 0.114 10 0 "[ . 1 . 2]" 1
288 1 12 ARG H 1 12 ARG HD3 . . 5.310 4.441 2.451 5.193 . 0 0 "[ . 1 . 2]" 1
289 1 12 ARG H 1 12 ARG HG3 . . 4.280 4.042 2.793 5.076 0.796 17 1 "[ . 1 . + 2]" 1
290 1 12 ARG H 1 13 GLY H . . 5.360 3.165 2.811 3.749 . 0 0 "[ . 1 . 2]" 1
291 1 12 ARG H 1 14 GLN H . . 5.500 4.139 3.113 5.253 . 0 0 "[ . 1 . 2]" 1
292 1 12 ARG HA 1 12 ARG HD2 . . 5.500 3.001 2.208 4.706 . 0 0 "[ . 1 . 2]" 1
293 1 12 ARG HA 1 12 ARG HG3 . . 4.140 3.240 2.282 3.934 . 0 0 "[ . 1 . 2]" 1
294 1 12 ARG HA 1 13 GLY H . . 3.560 3.582 3.511 3.635 0.075 8 0 "[ . 1 . 2]" 1
295 1 12 ARG HA 1 13 GLY HA2 . . 4.670 4.740 4.469 4.961 0.291 14 0 "[ . 1 . 2]" 1
296 1 12 ARG HB2 1 13 GLY H . . 4.660 2.799 1.831 3.853 . 0 0 "[ . 1 . 2]" 1
297 1 12 ARG HB3 1 12 ARG HD2 . . 4.230 3.091 2.144 4.123 . 0 0 "[ . 1 . 2]" 1
298 1 12 ARG HB3 1 12 ARG HD3 . . 4.150 3.404 2.342 3.851 . 0 0 "[ . 1 . 2]" 1
299 1 12 ARG HB3 1 13 GLY H . . 4.520 2.499 1.975 3.768 . 0 0 "[ . 1 . 2]" 1
300 1 12 ARG HG3 1 13 GLY H . . 5.310 4.029 1.653 5.089 . 0 0 "[ . 1 . 2]" 1
301 1 13 GLY H 1 14 GLN H . . 3.590 2.173 1.734 3.142 . 0 0 "[ . 1 . 2]" 1
302 1 13 GLY H 1 14 GLN HA . . 4.040 4.094 3.930 4.137 0.097 8 0 "[ . 1 . 2]" 1
303 1 13 GLY HA2 1 14 GLN HE21 . . 5.420 5.491 4.831 6.402 0.982 15 2 "[ . 1 - + 2]" 1
304 1 14 GLN H 1 14 GLN HB2 . . 3.550 2.341 1.990 3.699 0.149 19 0 "[ . 1 . 2]" 1
305 1 14 GLN H 1 14 GLN HB3 . . 3.660 3.365 3.135 3.617 . 0 0 "[ . 1 . 2]" 1
306 1 14 GLN H 1 14 GLN HG2 . . 4.570 3.902 2.337 4.645 0.075 11 0 "[ . 1 . 2]" 1
307 1 14 GLN H 1 14 GLN HG3 . . 4.970 4.064 3.705 4.765 . 0 0 "[ . 1 . 2]" 1
308 1 14 GLN HA 1 14 GLN HE21 . . 5.500 3.785 2.351 5.198 . 0 0 "[ . 1 . 2]" 1
309 1 14 GLN HA 1 15 PRO HD2 . . 3.960 2.733 2.066 3.387 . 0 0 "[ . 1 . 2]" 1
310 1 14 GLN HA 1 15 PRO HG3 . . 4.720 4.598 4.448 4.789 0.069 15 0 "[ . 1 . 2]" 1
311 1 14 GLN HA 1 16 ASN H . . 5.500 4.191 3.994 4.608 . 0 0 "[ . 1 . 2]" 1
312 1 14 GLN HA 1 16 ASN HD21 . . 5.500 4.888 4.538 5.352 . 0 0 "[ . 1 . 2]" 1
313 1 14 GLN HA 1 16 ASN HD22 . . 5.160 5.236 4.789 5.580 0.420 15 0 "[ . 1 . 2]" 1
314 1 14 GLN HA 1 135 SER H . . 5.430 4.832 4.093 5.511 0.081 11 0 "[ . 1 . 2]" 1
315 1 14 GLN HB2 1 15 PRO HD2 . . 5.240 3.555 2.078 3.943 . 0 0 "[ . 1 . 2]" 1
316 1 14 GLN HB2 1 15 PRO HD3 . . 5.490 4.460 2.557 5.176 . 0 0 "[ . 1 . 2]" 1
317 1 14 GLN HB2 1 16 ASN HD22 . . 5.500 4.599 2.854 5.562 0.062 16 0 "[ . 1 . 2]" 1
318 1 14 GLN HB3 1 15 PRO HD2 . . 5.180 2.417 2.015 3.712 . 0 0 "[ . 1 . 2]" 1
319 1 14 GLN HB3 1 15 PRO HD3 . . 5.430 3.571 2.758 4.137 . 0 0 "[ . 1 . 2]" 1
320 1 14 GLN HE21 1 134 ASP HA . . 4.250 3.780 2.634 4.336 0.086 7 0 "[ . 1 . 2]" 1
321 1 14 GLN HE21 1 135 SER H . . 4.910 3.687 1.944 4.989 0.079 3 0 "[ . 1 . 2]" 1
322 1 14 GLN HE22 1 134 ASP HA . . 3.630 2.902 2.007 4.246 0.616 14 1 "[ . 1 +. 2]" 1
323 1 14 GLN HE22 1 135 SER H . . 4.210 3.070 2.238 4.243 0.033 19 0 "[ . 1 . 2]" 1
324 1 14 GLN HG2 1 16 ASN HB2 . . 5.280 5.197 3.741 5.375 0.095 3 0 "[ . 1 . 2]" 1
325 1 14 GLN HG2 1 16 ASN HD22 . . 5.500 4.138 3.119 5.785 0.285 15 0 "[ . 1 . 2]" 1
326 1 14 GLN HG3 1 15 PRO HD2 . . 4.040 2.678 2.010 4.062 0.022 8 0 "[ . 1 . 2]" 1
327 1 14 GLN HG3 1 16 ASN H . . 5.060 4.752 4.076 5.130 0.070 15 0 "[ . 1 . 2]" 1
328 1 15 PRO HA 1 17 HIS H . . 5.190 4.037 3.672 4.324 . 0 0 "[ . 1 . 2]" 1
329 1 15 PRO HB2 1 16 ASN HD22 . . 4.920 4.740 3.777 4.997 0.077 8 0 "[ . 1 . 2]" 1
330 1 15 PRO HB2 1 143 TYR QD . . 4.070 4.122 3.976 4.173 0.103 6 0 "[ . 1 . 2]" 1
331 1 15 PRO HB2 1 143 TYR QE . . 4.460 4.421 3.576 4.558 0.098 20 0 "[ . 1 . 2]" 1
332 1 15 PRO HD2 1 16 ASN H . . 4.560 3.109 2.569 4.105 . 0 0 "[ . 1 . 2]" 1
333 1 15 PRO HD3 1 16 ASN H . . 5.330 4.100 3.842 4.673 . 0 0 "[ . 1 . 2]" 1
334 1 15 PRO HG2 1 16 ASN HD22 . . 5.500 2.794 2.059 3.891 . 0 0 "[ . 1 . 2]" 1
335 1 15 PRO HG2 1 143 TYR HB2 . . 4.990 5.042 4.576 5.326 0.336 7 0 "[ . 1 . 2]" 1
336 1 15 PRO HG2 1 143 TYR HB3 . . 4.830 3.800 2.935 4.325 . 0 0 "[ . 1 . 2]" 1
337 1 15 PRO HG2 1 143 TYR QD . . 3.840 2.262 2.012 2.978 . 0 0 "[ . 1 . 2]" 1
338 1 15 PRO HG3 1 143 TYR QD . . 4.810 2.703 2.028 4.012 . 0 0 "[ . 1 . 2]" 1
339 1 16 ASN H 1 16 ASN HB2 . . 4.070 2.744 2.412 3.623 . 0 0 "[ . 1 . 2]" 1
340 1 16 ASN H 1 16 ASN HB3 . . 3.680 3.646 3.480 3.917 0.237 19 0 "[ . 1 . 2]" 1
341 1 16 ASN H 1 16 ASN HD21 . . 3.300 2.665 2.272 3.351 0.051 4 0 "[ . 1 . 2]" 1
342 1 16 ASN H 1 16 ASN HD22 . . 5.000 3.368 2.834 3.950 . 0 0 "[ . 1 . 2]" 1
343 1 16 ASN H 1 17 HIS H . . 3.070 2.370 1.692 2.877 . 0 0 "[ . 1 . 2]" 1
344 1 16 ASN HA 1 16 ASN HD22 . . 5.100 4.722 4.301 5.050 . 0 0 "[ . 1 . 2]" 1
345 1 16 ASN HA 1 17 HIS HA . . 5.410 4.864 4.576 4.979 . 0 0 "[ . 1 . 2]" 1
346 1 16 ASN HA 1 18 LYS H . . 4.280 4.136 3.860 4.340 0.060 18 0 "[ . 1 . 2]" 1
347 1 16 ASN HA 1 18 LYS QD . . 5.310 4.438 2.488 5.161 . 0 0 "[ . 1 . 2]" 1
348 1 16 ASN HA 1 18 LYS QE . . 5.100 4.065 3.161 4.946 . 0 0 "[ . 1 . 2]" 1
349 1 16 ASN HA 1 18 LYS QG . . 4.110 3.609 3.010 4.234 0.124 10 0 "[ . 1 . 2]" 1
350 1 16 ASN HA 1 19 VAL H . . 4.700 3.941 3.597 4.254 . 0 0 "[ . 1 . 2]" 1
351 1 16 ASN HA 1 19 VAL QG . . 4.780 2.987 2.521 3.755 . 0 0 "[ . 1 . 2]" 1
352 1 16 ASN HB2 1 19 VAL H . . 5.500 5.238 4.819 5.581 0.081 2 0 "[ . 1 . 2]" 1
353 1 16 ASN HB2 1 19 VAL QG . . 4.170 3.759 3.332 4.007 . 0 0 "[ . 1 . 2]" 1
354 1 16 ASN HB3 1 17 HIS H . . 4.920 4.365 4.097 4.759 . 0 0 "[ . 1 . 2]" 1
355 1 16 ASN HD21 1 143 TYR QD . . 5.500 4.470 3.462 5.137 . 0 0 "[ . 1 . 2]" 1
356 1 17 HIS H 1 17 HIS HB2 . . 3.270 2.332 2.145 3.462 0.192 2 0 "[ . 1 . 2]" 1
357 1 17 HIS H 1 17 HIS HB3 . . 3.370 2.681 2.376 2.834 . 0 0 "[ . 1 . 2]" 1
358 1 17 HIS H 1 17 HIS HD2 . . 5.240 5.069 4.449 5.195 . 0 0 "[ . 1 . 2]" 1
359 1 17 HIS H 1 18 LYS H . . 3.640 2.873 2.472 3.080 . 0 0 "[ . 1 . 2]" 1
360 1 17 HIS H 1 18 LYS QG . . 5.500 4.374 3.881 5.414 . 0 0 "[ . 1 . 2]" 1
361 1 17 HIS H 1 19 VAL H . . 5.490 4.539 4.288 4.689 . 0 0 "[ . 1 . 2]" 1
362 1 17 HIS HA 1 17 HIS HD2 . . 5.220 3.328 2.449 3.974 . 0 0 "[ . 1 . 2]" 1
363 1 17 HIS HA 1 19 VAL H . . 4.360 3.881 3.569 4.191 . 0 0 "[ . 1 . 2]" 1
364 1 17 HIS HA 1 19 VAL QG . . 3.510 3.459 3.190 3.578 0.068 10 0 "[ . 1 . 2]" 1
365 1 17 HIS HA 1 20 MET QB . . 5.030 4.763 4.478 4.917 . 0 0 "[ . 1 . 2]" 1
366 1 17 HIS HA 1 20 MET ME . . 5.060 4.562 4.114 5.021 . 0 0 "[ . 1 . 2]" 1
367 1 17 HIS HA 1 20 MET QG . . 5.060 3.234 2.806 3.667 . 0 0 "[ . 1 . 2]" 1
368 1 17 HIS HB2 1 18 LYS H . . 4.150 3.887 3.692 4.121 . 0 0 "[ . 1 . 2]" 1
369 1 17 HIS HB3 1 17 HIS HD2 . . 3.740 3.223 2.973 3.759 0.019 8 0 "[ . 1 . 2]" 1
370 1 17 HIS HB3 1 18 LYS H . . 3.750 2.823 2.466 3.779 0.029 2 0 "[ . 1 . 2]" 1
371 1 17 HIS HB3 1 18 LYS HA . . 4.950 4.308 4.024 5.466 0.516 2 1 "[ + . 1 . 2]" 1
372 1 17 HIS HD2 1 18 LYS H . . 4.850 4.238 3.336 4.675 . 0 0 "[ . 1 . 2]" 1
373 1 17 HIS HD2 1 18 LYS HA . . 4.930 3.739 2.807 4.602 . 0 0 "[ . 1 . 2]" 1
374 1 17 HIS HD2 1 20 MET QG . . 4.320 2.748 2.145 3.794 . 0 0 "[ . 1 . 2]" 1
375 1 17 HIS HD2 1 21 LEU MD1 . . 3.200 2.748 1.864 3.276 0.076 13 0 "[ . 1 . 2]" 1
376 1 17 HIS HD2 1 21 LEU MD2 . . 4.280 2.728 2.319 3.697 . 0 0 "[ . 1 . 2]" 1
377 1 18 LYS H 1 18 LYS HB3 . . 3.030 2.422 2.239 2.645 . 0 0 "[ . 1 . 2]" 1
378 1 18 LYS H 1 18 LYS QD . . 4.250 3.637 2.056 4.054 . 0 0 "[ . 1 . 2]" 1
379 1 18 LYS H 1 18 LYS QG . . 3.380 2.457 2.147 3.252 . 0 0 "[ . 1 . 2]" 1
380 1 18 LYS H 1 19 VAL H . . 3.600 3.054 2.832 3.148 . 0 0 "[ . 1 . 2]" 1
381 1 18 LYS H 1 19 VAL QG . . 5.500 3.927 3.702 4.405 . 0 0 "[ . 1 . 2]" 1
382 1 18 LYS H 1 20 MET H . . 5.320 4.721 4.499 4.908 . 0 0 "[ . 1 . 2]" 1
383 1 18 LYS H 1 21 LEU MD1 . . 4.870 3.886 3.202 4.241 . 0 0 "[ . 1 . 2]" 1
384 1 18 LYS HA 1 18 LYS HB3 . . 2.790 2.435 2.355 2.565 . 0 0 "[ . 1 . 2]" 1
385 1 18 LYS HA 1 18 LYS QD . . 4.760 3.819 3.685 4.262 . 0 0 "[ . 1 . 2]" 1
386 1 18 LYS HA 1 18 LYS QG . . 4.010 3.505 3.347 3.569 . 0 0 "[ . 1 . 2]" 1
387 1 18 LYS HA 1 19 VAL QG . . 5.360 4.460 4.285 4.750 . 0 0 "[ . 1 . 2]" 1
388 1 18 LYS HA 1 20 MET H . . 4.670 3.970 3.528 4.282 . 0 0 "[ . 1 . 2]" 1
389 1 18 LYS HA 1 20 MET QG . . 5.500 4.423 3.787 5.161 . 0 0 "[ . 1 . 2]" 1
390 1 18 LYS HA 1 21 LEU H . . 3.890 3.338 2.981 3.659 . 0 0 "[ . 1 . 2]" 1
391 1 18 LYS HA 1 21 LEU HA . . 5.250 5.100 4.819 5.314 0.064 8 0 "[ . 1 . 2]" 1
392 1 18 LYS HA 1 21 LEU HB2 . . 3.560 2.727 2.216 2.946 . 0 0 "[ . 1 . 2]" 1
393 1 18 LYS HA 1 21 LEU HB3 . . 4.130 4.101 3.820 4.209 0.079 10 0 "[ . 1 . 2]" 1
394 1 18 LYS HA 1 21 LEU MD1 . . 3.220 2.093 1.878 2.191 . 0 0 "[ . 1 . 2]" 1
395 1 18 LYS HA 1 21 LEU MD2 . . 4.430 3.788 2.151 4.375 . 0 0 "[ . 1 . 2]" 1
396 1 18 LYS HA 1 21 LEU HG . . 3.700 2.534 2.107 3.801 0.101 7 0 "[ . 1 . 2]" 1
397 1 18 LYS HB3 1 18 LYS QE . . 4.550 4.180 3.461 4.398 . 0 0 "[ . 1 . 2]" 1
398 1 18 LYS HB3 1 21 LEU MD1 . . 3.880 3.357 2.907 3.738 . 0 0 "[ . 1 . 2]" 1
399 1 18 LYS QD 1 19 VAL H . . 4.850 3.058 2.610 4.296 . 0 0 "[ . 1 . 2]" 1
400 1 18 LYS QD 1 19 VAL QG . . 3.970 2.731 2.205 3.788 . 0 0 "[ . 1 . 2]" 1
401 1 18 LYS QD 1 21 LEU MD1 . . 5.500 4.832 4.613 5.121 . 0 0 "[ . 1 . 2]" 1
402 1 18 LYS QE 1 19 VAL H . . 5.430 4.223 3.259 4.906 . 0 0 "[ . 1 . 2]" 1
403 1 18 LYS QG 1 19 VAL H . . 3.930 2.848 2.281 3.512 . 0 0 "[ . 1 . 2]" 1
404 1 18 LYS QG 1 19 VAL HA . . 4.990 4.219 3.148 4.923 . 0 0 "[ . 1 . 2]" 1
405 1 18 LYS QG 1 19 VAL QG . . 4.890 3.053 2.183 4.485 . 0 0 "[ . 1 . 2]" 1
406 1 19 VAL H 1 19 VAL HB . . 3.620 3.518 2.096 3.649 0.029 7 0 "[ . 1 . 2]" 1
407 1 19 VAL H 1 19 VAL QG . . 3.110 1.957 1.743 2.473 . 0 0 "[ . 1 . 2]" 1
408 1 19 VAL H 1 21 LEU H . . 4.820 4.112 3.985 4.281 . 0 0 "[ . 1 . 2]" 1
409 1 19 VAL HA 1 19 VAL QG . . 3.240 2.276 2.082 2.328 . 0 0 "[ . 1 . 2]" 1
410 1 19 VAL HA 1 21 LEU H . . 4.660 3.754 3.473 3.959 . 0 0 "[ . 1 . 2]" 1
411 1 19 VAL HA 1 22 ASP H . . 4.540 4.170 3.519 4.612 0.072 7 0 "[ . 1 . 2]" 1
412 1 19 VAL HA 1 22 ASP QB . . 4.370 3.699 2.939 4.329 . 0 0 "[ . 1 . 2]" 1
413 1 19 VAL HB 1 20 MET H . . 4.240 3.967 3.699 4.300 0.060 20 0 "[ . 1 . 2]" 1
414 1 19 VAL HB 1 77 PHE QE . . 3.470 2.521 2.065 3.584 0.114 11 0 "[ . 1 . 2]" 1
415 1 19 VAL QG 1 20 MET H . . 4.390 2.355 2.040 2.775 . 0 0 "[ . 1 . 2]" 1
416 1 19 VAL QG 1 20 MET HA . . 4.750 3.613 3.260 4.011 . 0 0 "[ . 1 . 2]" 1
417 1 19 VAL QG 1 20 MET QG . . 4.190 3.360 2.185 3.836 . 0 0 "[ . 1 . 2]" 1
418 1 19 VAL QG 1 77 PHE QE . . 3.740 2.453 1.865 2.888 . 0 0 "[ . 1 . 2]" 1
419 1 20 MET H 1 20 MET QB . . 3.550 2.673 2.529 2.931 . 0 0 "[ . 1 . 2]" 1
420 1 20 MET H 1 20 MET ME . . 4.450 4.364 3.998 4.550 0.100 16 0 "[ . 1 . 2]" 1
421 1 20 MET H 1 20 MET QG . . 3.720 2.345 1.762 2.588 . 0 0 "[ . 1 . 2]" 1
422 1 20 MET H 1 21 LEU H . . 3.280 2.554 2.093 2.839 . 0 0 "[ . 1 . 2]" 1
423 1 20 MET H 1 21 LEU HA . . 5.130 5.029 4.573 5.190 0.060 2 0 "[ . 1 . 2]" 1
424 1 20 MET H 1 21 LEU MD1 . . 5.500 4.614 2.254 5.199 . 0 0 "[ . 1 . 2]" 1
425 1 20 MET H 1 21 LEU MD2 . . 4.980 4.426 3.816 5.049 0.069 19 0 "[ . 1 . 2]" 1
426 1 20 MET H 1 21 LEU HG . . 4.800 3.715 3.170 4.896 0.096 20 0 "[ . 1 . 2]" 1
427 1 20 MET H 1 22 ASP H . . 4.720 4.365 3.988 4.762 0.042 3 0 "[ . 1 . 2]" 1
428 1 20 MET H 1 28 ALA MB . . 5.500 5.111 4.835 5.444 . 0 0 "[ . 1 . 2]" 1
429 1 20 MET H 1 74 MET ME . . 4.550 4.353 3.760 4.649 0.099 20 0 "[ . 1 . 2]" 1
430 1 20 MET HA 1 20 MET ME . . 4.660 4.211 3.957 4.377 . 0 0 "[ . 1 . 2]" 1
431 1 20 MET HA 1 20 MET QG . . 3.800 3.353 3.004 3.414 . 0 0 "[ . 1 . 2]" 1
432 1 20 MET HA 1 22 ASP H . . 4.920 3.561 3.012 4.417 . 0 0 "[ . 1 . 2]" 1
433 1 20 MET HA 1 28 ALA MB . . 4.100 3.497 3.027 3.957 . 0 0 "[ . 1 . 2]" 1
434 1 20 MET HA 1 74 MET ME . . 3.000 2.099 1.804 2.437 . 0 0 "[ . 1 . 2]" 1
435 1 20 MET QB 1 20 MET ME . . 3.130 2.142 1.960 2.368 . 0 0 "[ . 1 . 2]" 1
436 1 20 MET QB 1 21 LEU H . . 5.340 3.899 3.404 4.085 . 0 0 "[ . 1 . 2]" 1
437 1 20 MET QB 1 74 MET ME . . 3.570 2.794 2.542 3.236 . 0 0 "[ . 1 . 2]" 1
438 1 20 MET ME 1 20 MET QG . . 3.430 2.492 2.202 2.761 . 0 0 "[ . 1 . 2]" 1
439 1 20 MET ME 1 28 ALA H . . 5.490 5.463 5.219 5.586 0.096 15 0 "[ . 1 . 2]" 1
440 1 20 MET ME 1 28 ALA HA . . 4.710 4.371 4.042 4.635 . 0 0 "[ . 1 . 2]" 1
441 1 20 MET ME 1 28 ALA MB . . 2.920 2.203 1.990 2.376 . 0 0 "[ . 1 . 2]" 1
442 1 20 MET ME 1 68 TYR HB2 . . 3.700 3.442 2.478 3.794 0.094 4 0 "[ . 1 . 2]" 1
443 1 20 MET ME 1 68 TYR HB3 . . 4.050 3.363 2.815 3.632 . 0 0 "[ . 1 . 2]" 1
444 1 20 MET ME 1 68 TYR QD . . 3.400 2.861 2.688 2.987 . 0 0 "[ . 1 . 2]" 1
445 1 20 MET ME 1 68 TYR QE . . 3.800 3.094 2.829 3.503 . 0 0 "[ . 1 . 2]" 1
446 1 20 MET ME 1 74 MET ME . . 4.220 4.064 3.656 4.344 0.124 6 0 "[ . 1 . 2]" 1
447 1 20 MET QG 1 21 LEU H . . 5.220 3.238 2.679 4.063 . 0 0 "[ . 1 . 2]" 1
448 1 20 MET QG 1 21 LEU MD2 . . 3.800 2.769 2.082 4.320 0.520 20 1 "[ . 1 . +]" 1
449 1 20 MET QG 1 28 ALA MB . . 4.580 3.605 3.286 3.877 . 0 0 "[ . 1 . 2]" 1
450 1 21 LEU H 1 21 LEU HB2 . . 3.310 2.551 2.330 2.709 . 0 0 "[ . 1 . 2]" 1
451 1 21 LEU H 1 21 LEU HB3 . . 4.110 3.657 3.489 3.782 . 0 0 "[ . 1 . 2]" 1
452 1 21 LEU H 1 21 LEU MD1 . . 3.880 3.678 1.949 3.974 0.094 15 0 "[ . 1 . 2]" 1
453 1 21 LEU H 1 21 LEU MD2 . . 3.880 3.476 3.069 3.980 0.100 7 0 "[ . 1 . 2]" 1
454 1 21 LEU H 1 21 LEU HG . . 3.640 2.675 2.313 3.708 0.068 7 0 "[ . 1 . 2]" 1
455 1 21 LEU H 1 22 ASP H . . 3.310 2.371 2.041 2.681 . 0 0 "[ . 1 . 2]" 1
456 1 21 LEU H 1 22 ASP HA . . 5.130 4.922 4.725 5.160 0.030 4 0 "[ . 1 . 2]" 1
457 1 21 LEU H 1 22 ASP QB . . 5.150 4.056 3.360 4.508 . 0 0 "[ . 1 . 2]" 1
458 1 21 LEU HA 1 21 LEU MD1 . . 4.110 3.795 2.917 3.964 . 0 0 "[ . 1 . 2]" 1
459 1 21 LEU HA 1 21 LEU MD2 . . 2.830 2.397 2.101 3.795 0.965 20 2 "[ . - 1 . +]" 1
460 1 21 LEU HA 1 21 LEU HG . . 3.920 3.210 2.349 3.463 . 0 0 "[ . 1 . 2]" 1
461 1 21 LEU HA 1 28 ALA MB . . 5.200 5.005 4.449 5.312 0.112 1 0 "[ . 1 . 2]" 1
462 1 21 LEU HB2 1 22 ASP H . . 4.480 3.602 2.594 4.142 . 0 0 "[ . 1 . 2]" 1
463 1 21 LEU HB3 1 21 LEU MD1 . . 2.530 2.461 2.286 3.204 0.674 20 2 "[ . - 1 . +]" 1
464 1 21 LEU HB3 1 21 LEU MD2 . . 3.080 2.447 2.287 2.544 . 0 0 "[ . 1 . 2]" 1
465 1 21 LEU MD2 1 22 ASP H . . 5.090 4.733 4.423 5.605 0.515 7 1 "[ . + 1 . 2]" 1
466 1 22 ASP H 1 22 ASP QB . . 3.150 2.511 2.293 2.702 . 0 0 "[ . 1 . 2]" 1
467 1 22 ASP H 1 23 HIS H . . 4.870 3.732 2.051 4.098 . 0 0 "[ . 1 . 2]" 1
468 1 22 ASP HA 1 23 HIS H . . 2.960 2.283 2.058 3.043 0.083 2 0 "[ . 1 . 2]" 1
469 1 22 ASP HA 1 23 HIS HA . . 4.930 4.529 4.338 5.010 0.080 8 0 "[ . 1 . 2]" 1
470 1 22 ASP HA 1 23 HIS HB2 . . 4.700 4.562 4.374 4.768 0.068 20 0 "[ . 1 . 2]" 1
471 1 22 ASP HA 1 23 HIS HB3 . . 4.530 4.527 4.347 4.606 0.076 10 0 "[ . 1 . 2]" 1
472 1 22 ASP HA 1 24 SER H . . 4.190 3.624 3.148 4.277 0.087 2 0 "[ . 1 . 2]" 1
473 1 22 ASP QB 1 23 HIS H . . 4.390 3.766 3.516 4.011 . 0 0 "[ . 1 . 2]" 1
474 1 22 ASP QB 1 24 SER H . . 4.630 3.358 2.934 4.274 . 0 0 "[ . 1 . 2]" 1
475 1 22 ASP QB 1 24 SER HB2 . . 5.290 3.756 2.467 4.992 . 0 0 "[ . 1 . 2]" 1
476 1 22 ASP QB 1 25 HIS H . . 4.850 3.122 2.581 4.211 . 0 0 "[ . 1 . 2]" 1
477 1 22 ASP QB 1 25 HIS HD2 . . 4.790 4.234 2.613 4.715 . 0 0 "[ . 1 . 2]" 1
478 1 23 HIS H 1 23 HIS HB3 . . 3.480 2.595 2.397 3.466 . 0 0 "[ . 1 . 2]" 1
479 1 23 HIS H 1 23 HIS HD2 . . 4.870 4.713 4.184 4.940 0.070 1 0 "[ . 1 . 2]" 1
480 1 23 HIS HA 1 23 HIS HD2 . . 3.430 2.564 2.367 2.735 . 0 0 "[ . 1 . 2]" 1
481 1 23 HIS HA 1 25 HIS H . . 4.080 3.800 3.532 4.138 0.058 4 0 "[ . 1 . 2]" 1
482 1 23 HIS HA 1 26 GLY H . . 3.800 2.987 2.528 3.311 . 0 0 "[ . 1 . 2]" 1
483 1 23 HIS HA 1 27 LEU QD . . 4.510 4.406 4.195 4.528 0.018 17 0 "[ . 1 . 2]" 1
484 1 23 HIS HB2 1 24 SER H . . 4.510 4.231 3.952 4.537 0.027 8 0 "[ . 1 . 2]" 1
485 1 23 HIS HB2 1 26 GLY H . . 5.500 5.323 4.973 5.581 0.081 2 0 "[ . 1 . 2]" 1
486 1 23 HIS HB2 1 27 LEU QD . . 4.420 4.324 4.044 4.444 0.024 19 0 "[ . 1 . 2]" 1
487 1 23 HIS HB3 1 24 SER H . . 4.370 3.252 2.867 4.191 . 0 0 "[ . 1 . 2]" 1
488 1 23 HIS HB3 1 27 LEU QD . . 5.500 5.331 5.116 5.471 . 0 0 "[ . 1 . 2]" 1
489 1 23 HIS HD2 1 24 SER H . . 5.500 5.551 5.383 5.590 0.090 9 0 "[ . 1 . 2]" 1
490 1 23 HIS HD2 1 27 LEU HA . . 4.270 2.163 1.893 2.699 . 0 0 "[ . 1 . 2]" 1
491 1 23 HIS HD2 1 27 LEU QD . . 4.200 2.503 2.246 2.799 . 0 0 "[ . 1 . 2]" 1
492 1 24 SER H 1 24 SER HB2 . . 3.120 2.417 2.141 2.734 . 0 0 "[ . 1 . 2]" 1
493 1 24 SER H 1 25 HIS H . . 3.140 2.625 2.066 2.827 . 0 0 "[ . 1 . 2]" 1
494 1 24 SER H 1 25 HIS HB2 . . 5.270 4.880 4.156 5.262 . 0 0 "[ . 1 . 2]" 1
495 1 24 SER H 1 26 GLY H . . 4.050 3.866 3.479 4.114 0.064 9 0 "[ . 1 . 2]" 1
496 1 24 SER HA 1 24 SER HB2 . . 2.840 2.828 2.547 2.937 0.097 6 0 "[ . 1 . 2]" 1
497 1 24 SER HA 1 26 GLY H . . 4.630 4.041 3.548 4.560 . 0 0 "[ . 1 . 2]" 1
498 1 24 SER HB2 1 25 HIS H . . 4.040 3.405 2.858 4.088 0.048 4 0 "[ . 1 . 2]" 1
499 1 25 HIS H 1 25 HIS HB2 . . 3.460 2.468 2.365 2.580 . 0 0 "[ . 1 . 2]" 1
500 1 25 HIS H 1 25 HIS HB3 . . 3.940 3.612 3.522 3.671 . 0 0 "[ . 1 . 2]" 1
501 1 25 HIS H 1 25 HIS HD2 . . 4.340 3.486 2.380 4.021 . 0 0 "[ . 1 . 2]" 1
502 1 25 HIS H 1 26 GLY H . . 3.060 2.362 2.155 2.566 . 0 0 "[ . 1 . 2]" 1
503 1 25 HIS H 1 74 MET ME . . 4.570 4.413 3.968 4.669 0.099 7 0 "[ . 1 . 2]" 1
504 1 25 HIS HA 1 25 HIS HD2 . . 3.390 2.587 2.235 3.469 0.079 15 0 "[ . 1 . 2]" 1
505 1 25 HIS HB2 1 26 GLY H . . 4.100 3.109 2.524 3.802 . 0 0 "[ . 1 . 2]" 1
506 1 25 HIS HB2 1 74 MET ME . . 3.380 3.037 2.259 3.446 0.066 10 0 "[ . 1 . 2]" 1
507 1 25 HIS HB2 1 77 PHE HB2 . . 5.370 5.104 4.553 5.442 0.072 3 0 "[ . 1 . 2]" 1
508 1 25 HIS HB3 1 26 GLY H . . 4.380 4.025 3.573 4.401 0.021 20 0 "[ . 1 . 2]" 1
509 1 25 HIS HB3 1 74 MET ME . . 3.580 3.442 2.864 3.688 0.108 20 0 "[ . 1 . 2]" 1
510 1 25 HIS HB3 1 77 PHE HB2 . . 4.470 3.588 3.038 4.001 . 0 0 "[ . 1 . 2]" 1
511 1 25 HIS HB3 1 77 PHE HB3 . . 5.170 3.692 3.286 4.366 . 0 0 "[ . 1 . 2]" 1
512 1 25 HIS HB3 1 77 PHE QD . . 4.180 3.166 2.813 3.822 . 0 0 "[ . 1 . 2]" 1
513 1 26 GLY H 1 27 LEU H . . 4.980 4.338 4.223 4.410 . 0 0 "[ . 1 . 2]" 1
514 1 26 GLY H 1 73 GLN HB3 . . 4.960 4.738 4.223 5.027 0.067 8 0 "[ . 1 . 2]" 1
515 1 26 GLY H 1 74 MET ME . . 3.890 3.300 2.772 3.789 . 0 0 "[ . 1 . 2]" 1
516 1 26 GLY QA 1 27 LEU H . . 3.200 2.255 2.194 2.316 . 0 0 "[ . 1 . 2]" 1
517 1 26 GLY QA 1 27 LEU QB . . 4.770 3.722 3.618 3.998 . 0 0 "[ . 1 . 2]" 1
518 1 26 GLY QA 1 73 GLN H . . 5.240 4.189 3.827 4.498 . 0 0 "[ . 1 . 2]" 1
519 1 26 GLY QA 1 73 GLN HB3 . . 3.620 2.303 2.101 2.643 . 0 0 "[ . 1 . 2]" 1
520 1 26 GLY QA 1 73 GLN HG3 . . 4.260 2.824 2.367 3.575 . 0 0 "[ . 1 . 2]" 1
521 1 26 GLY QA 1 74 MET H . . 4.050 2.726 2.406 3.048 . 0 0 "[ . 1 . 2]" 1
522 1 26 GLY QA 1 74 MET HA . . 5.160 2.550 2.240 3.010 . 0 0 "[ . 1 . 2]" 1
523 1 26 GLY QA 1 74 MET HB2 . . 4.590 2.317 2.130 2.665 . 0 0 "[ . 1 . 2]" 1
524 1 26 GLY QA 1 74 MET HB3 . . 4.680 3.546 3.379 3.938 . 0 0 "[ . 1 . 2]" 1
525 1 26 GLY QA 1 74 MET ME . . 3.720 2.567 2.252 3.001 . 0 0 "[ . 1 . 2]" 1
526 1 26 GLY QA 1 74 MET HG2 . . 5.360 4.578 4.323 4.869 . 0 0 "[ . 1 . 2]" 1
527 1 27 LEU H 1 27 LEU QB . . 3.030 2.180 2.117 2.245 . 0 0 "[ . 1 . 2]" 1
528 1 27 LEU H 1 27 LEU QD . . 4.470 3.682 3.366 3.779 . 0 0 "[ . 1 . 2]" 1
529 1 27 LEU H 1 28 ALA H . . 4.740 4.579 4.424 4.650 . 0 0 "[ . 1 . 2]" 1
530 1 27 LEU H 1 28 ALA MB . . 5.500 5.178 4.979 5.329 . 0 0 "[ . 1 . 2]" 1
531 1 27 LEU H 1 70 VAL HA . . 5.500 4.762 4.580 5.065 . 0 0 "[ . 1 . 2]" 1
532 1 27 LEU H 1 71 ASP H . . 4.070 3.182 2.960 3.390 . 0 0 "[ . 1 . 2]" 1
533 1 27 LEU H 1 71 ASP QB . . 5.500 3.160 2.123 3.691 . 0 0 "[ . 1 . 2]" 1
534 1 27 LEU H 1 74 MET HA . . 5.500 4.493 4.162 4.838 . 0 0 "[ . 1 . 2]" 1
535 1 27 LEU H 1 74 MET HB2 . . 4.100 2.733 2.491 3.105 . 0 0 "[ . 1 . 2]" 1
536 1 27 LEU H 1 74 MET HB3 . . 3.610 3.545 3.311 3.682 0.072 10 0 "[ . 1 . 2]" 1
537 1 27 LEU H 1 74 MET ME . . 4.070 3.659 3.327 4.139 0.069 12 0 "[ . 1 . 2]" 1
538 1 27 LEU HA 1 27 LEU QD . . 3.320 2.097 2.011 2.147 . 0 0 "[ . 1 . 2]" 1
539 1 27 LEU HA 1 27 LEU HG . . 4.160 3.330 2.957 3.789 . 0 0 "[ . 1 . 2]" 1
540 1 27 LEU HA 1 28 ALA H . . 2.650 2.201 2.089 2.291 . 0 0 "[ . 1 . 2]" 1
541 1 27 LEU HA 1 28 ALA HA . . 5.130 4.442 4.319 4.513 . 0 0 "[ . 1 . 2]" 1
542 1 27 LEU HA 1 28 ALA MB . . 4.510 4.143 3.967 4.262 . 0 0 "[ . 1 . 2]" 1
543 1 27 LEU HA 1 71 ASP H . . 5.240 4.788 4.591 4.990 . 0 0 "[ . 1 . 2]" 1
544 1 27 LEU HA 1 74 MET ME . . 5.270 3.893 3.449 4.579 . 0 0 "[ . 1 . 2]" 1
545 1 27 LEU QB 1 27 LEU QD . . 2.770 1.983 1.884 2.076 . 0 0 "[ . 1 . 2]" 1
546 1 27 LEU QB 1 28 ALA H . . 4.010 3.657 2.792 3.755 . 0 0 "[ . 1 . 2]" 1
547 1 27 LEU QB 1 28 ALA HA . . 4.920 4.221 3.619 4.399 . 0 0 "[ . 1 . 2]" 1
548 1 27 LEU QB 1 70 VAL HA . . 4.430 3.250 2.664 3.896 . 0 0 "[ . 1 . 2]" 1
549 1 27 LEU QB 1 71 ASP H . . 3.630 2.364 2.079 2.545 . 0 0 "[ . 1 . 2]" 1
550 1 27 LEU QB 1 71 ASP HA . . 5.230 4.092 3.735 4.327 . 0 0 "[ . 1 . 2]" 1
551 1 27 LEU QB 1 71 ASP QB . . 3.680 2.174 2.028 2.391 . 0 0 "[ . 1 . 2]" 1
552 1 27 LEU QB 1 72 GLU H . . 5.500 5.142 4.905 5.366 . 0 0 "[ . 1 . 2]" 1
553 1 27 LEU QB 1 74 MET ME . . 5.500 4.496 4.161 5.001 . 0 0 "[ . 1 . 2]" 1
554 1 27 LEU QD 1 28 ALA H . . 4.110 2.274 1.994 2.891 . 0 0 "[ . 1 . 2]" 1
555 1 27 LEU QD 1 28 ALA HA . . 5.250 3.506 2.593 4.529 . 0 0 "[ . 1 . 2]" 1
556 1 27 LEU QD 1 29 ALA H . . 5.180 3.766 2.415 4.686 . 0 0 "[ . 1 . 2]" 1
557 1 27 LEU QD 1 29 ALA HA . . 5.500 4.321 3.536 5.263 . 0 0 "[ . 1 . 2]" 1
558 1 27 LEU QD 1 29 ALA MB . . 4.630 2.847 2.130 3.665 . 0 0 "[ . 1 . 2]" 1
559 1 27 LEU QD 1 70 VAL HA . . 4.950 3.234 2.323 4.045 . 0 0 "[ . 1 . 2]" 1
560 1 27 LEU QD 1 71 ASP H . . 4.970 3.472 2.956 3.792 . 0 0 "[ . 1 . 2]" 1
561 1 27 LEU QD 1 71 ASP QB . . 4.470 2.932 2.120 3.613 . 0 0 "[ . 1 . 2]" 1
562 1 28 ALA H 1 28 ALA MB . . 3.330 2.687 2.560 2.838 . 0 0 "[ . 1 . 2]" 1
563 1 28 ALA H 1 29 ALA H . . 4.570 4.103 3.712 4.359 . 0 0 "[ . 1 . 2]" 1
564 1 28 ALA H 1 29 ALA HA . . 5.500 4.719 4.466 5.118 . 0 0 "[ . 1 . 2]" 1
565 1 28 ALA H 1 29 ALA MB . . 5.250 4.300 3.841 4.678 . 0 0 "[ . 1 . 2]" 1
566 1 28 ALA H 1 70 VAL HA . . 5.140 4.565 4.139 4.873 . 0 0 "[ . 1 . 2]" 1
567 1 28 ALA H 1 70 VAL MG1 . . 5.200 4.532 4.332 4.779 . 0 0 "[ . 1 . 2]" 1
568 1 28 ALA H 1 74 MET ME . . 4.840 3.891 3.287 4.614 . 0 0 "[ . 1 . 2]" 1
569 1 28 ALA HA 1 29 ALA H . . 2.960 2.252 2.128 2.329 . 0 0 "[ . 1 . 2]" 1
570 1 28 ALA HA 1 29 ALA MB . . 4.360 4.048 3.900 4.223 . 0 0 "[ . 1 . 2]" 1
571 1 28 ALA HA 1 68 TYR HB2 . . 5.080 4.773 4.095 5.170 0.090 9 0 "[ . 1 . 2]" 1
572 1 28 ALA HA 1 68 TYR HB3 . . 4.910 3.327 2.777 3.873 . 0 0 "[ . 1 . 2]" 1
573 1 28 ALA HA 1 68 TYR QD . . 5.500 4.237 3.513 4.975 . 0 0 "[ . 1 . 2]" 1
574 1 28 ALA HA 1 69 GLU H . . 4.920 4.715 4.470 5.001 0.081 9 0 "[ . 1 . 2]" 1
575 1 28 ALA HA 1 70 VAL HA . . 3.410 2.614 2.146 2.942 . 0 0 "[ . 1 . 2]" 1
576 1 28 ALA HA 1 70 VAL HB . . 5.210 4.049 3.599 4.673 . 0 0 "[ . 1 . 2]" 1
577 1 28 ALA HA 1 70 VAL MG1 . . 3.380 2.220 2.055 2.577 . 0 0 "[ . 1 . 2]" 1
578 1 28 ALA HA 1 70 VAL MG2 . . 5.500 4.746 4.574 5.061 . 0 0 "[ . 1 . 2]" 1
579 1 28 ALA HA 1 71 ASP H . . 4.910 4.464 3.874 4.892 . 0 0 "[ . 1 . 2]" 1
580 1 28 ALA HA 1 74 MET ME . . 4.730 4.234 3.786 4.806 0.076 5 0 "[ . 1 . 2]" 1
581 1 28 ALA HA 1 74 MET HG2 . . 5.370 3.974 3.497 5.076 . 0 0 "[ . 1 . 2]" 1
582 1 28 ALA MB 1 29 ALA H . . 3.620 3.101 2.569 3.591 . 0 0 "[ . 1 . 2]" 1
583 1 28 ALA MB 1 29 ALA HA . . 4.880 4.083 3.710 4.423 . 0 0 "[ . 1 . 2]" 1
584 1 28 ALA MB 1 68 TYR HB3 . . 5.220 2.747 2.359 3.214 . 0 0 "[ . 1 . 2]" 1
585 1 28 ALA MB 1 68 TYR QD . . 3.330 2.956 2.233 3.442 0.112 6 0 "[ . 1 . 2]" 1
586 1 28 ALA MB 1 68 TYR QE . . 5.100 4.204 3.298 4.782 . 0 0 "[ . 1 . 2]" 1
587 1 28 ALA MB 1 70 VAL HA . . 4.170 3.945 3.616 4.256 0.086 1 0 "[ . 1 . 2]" 1
588 1 28 ALA MB 1 70 VAL HB . . 5.500 4.232 3.685 5.109 . 0 0 "[ . 1 . 2]" 1
589 1 28 ALA MB 1 70 VAL MG1 . . 3.330 2.467 2.124 3.039 . 0 0 "[ . 1 . 2]" 1
590 1 28 ALA MB 1 71 ASP H . . 5.300 5.041 4.717 5.293 . 0 0 "[ . 1 . 2]" 1
591 1 28 ALA MB 1 74 MET HB2 . . 4.080 4.110 3.916 4.184 0.104 9 0 "[ . 1 . 2]" 1
592 1 28 ALA MB 1 74 MET ME . . 3.140 2.532 2.238 3.033 . 0 0 "[ . 1 . 2]" 1
593 1 28 ALA MB 1 74 MET HG2 . . 3.660 2.938 2.463 3.748 0.088 8 0 "[ . 1 . 2]" 1
594 1 29 ALA H 1 29 ALA MB . . 3.130 2.557 2.346 2.748 . 0 0 "[ . 1 . 2]" 1
595 1 29 ALA H 1 30 PHE H . . 4.370 4.339 4.245 4.441 0.071 18 0 "[ . 1 . 2]" 1
596 1 29 ALA H 1 68 TYR HA . . 4.830 3.774 3.490 4.189 . 0 0 "[ . 1 . 2]" 1
597 1 29 ALA H 1 68 TYR HB2 . . 4.750 4.764 4.572 4.826 0.076 20 0 "[ . 1 . 2]" 1
598 1 29 ALA H 1 68 TYR HB3 . . 4.190 3.069 2.847 3.205 . 0 0 "[ . 1 . 2]" 1
599 1 29 ALA H 1 68 TYR QD . . 4.500 3.240 2.387 3.953 . 0 0 "[ . 1 . 2]" 1
600 1 29 ALA H 1 69 GLU HB3 . . 4.540 3.360 2.863 4.461 . 0 0 "[ . 1 . 2]" 1
601 1 29 ALA H 1 70 VAL HA . . 4.180 3.847 3.605 4.252 0.072 9 0 "[ . 1 . 2]" 1
602 1 29 ALA H 1 70 VAL MG1 . . 4.020 3.545 3.278 3.846 . 0 0 "[ . 1 . 2]" 1
603 1 29 ALA HA 1 30 PHE H . . 2.910 2.224 2.113 2.341 . 0 0 "[ . 1 . 2]" 1
604 1 29 ALA HA 1 30 PHE HA . . 5.000 4.414 4.320 4.510 . 0 0 "[ . 1 . 2]" 1
605 1 29 ALA HA 1 30 PHE HB2 . . 5.080 4.477 4.058 4.813 . 0 0 "[ . 1 . 2]" 1
606 1 29 ALA HA 1 30 PHE HB3 . . 5.430 4.537 4.331 4.877 . 0 0 "[ . 1 . 2]" 1
607 1 29 ALA MB 1 30 PHE H . . 3.680 2.859 2.512 3.149 . 0 0 "[ . 1 . 2]" 1
608 1 29 ALA MB 1 30 PHE HA . . 5.180 4.520 4.425 4.641 . 0 0 "[ . 1 . 2]" 1
609 1 29 ALA MB 1 30 PHE HB2 . . 5.270 5.054 4.618 5.338 0.068 7 0 "[ . 1 . 2]" 1
610 1 29 ALA MB 1 30 PHE HB3 . . 4.840 4.549 4.074 4.915 0.075 18 0 "[ . 1 . 2]" 1
611 1 29 ALA MB 1 31 ARG HE . . 5.500 4.334 3.135 5.593 0.093 3 0 "[ . 1 . 2]" 1
612 1 29 ALA MB 1 68 TYR HA . . 4.870 4.629 4.445 4.802 . 0 0 "[ . 1 . 2]" 1
613 1 29 ALA MB 1 69 GLU H . . 3.850 3.486 3.149 3.937 0.087 9 0 "[ . 1 . 2]" 1
614 1 29 ALA MB 1 69 GLU HB3 . . 3.560 2.419 2.048 3.332 . 0 0 "[ . 1 . 2]" 1
615 1 29 ALA MB 1 69 GLU HG2 . . 4.930 4.141 3.453 4.958 0.028 9 0 "[ . 1 . 2]" 1
616 1 30 PHE H 1 30 PHE HB2 . . 3.370 2.602 2.213 2.848 . 0 0 "[ . 1 . 2]" 1
617 1 30 PHE H 1 30 PHE HB3 . . 3.300 2.349 2.162 2.661 . 0 0 "[ . 1 . 2]" 1
618 1 30 PHE H 1 30 PHE QD . . 4.510 4.151 4.040 4.238 . 0 0 "[ . 1 . 2]" 1
619 1 30 PHE H 1 31 ARG H . . 4.940 4.311 3.897 4.598 . 0 0 "[ . 1 . 2]" 1
620 1 30 PHE H 1 68 TYR QD . . 4.440 3.756 3.332 4.201 . 0 0 "[ . 1 . 2]" 1
621 1 30 PHE H 1 68 TYR QE . . 4.650 4.015 3.319 4.650 . 0 0 "[ . 1 . 2]" 1
622 1 30 PHE HA 1 30 PHE QD . . 3.890 2.762 2.421 3.148 . 0 0 "[ . 1 . 2]" 1
623 1 30 PHE HA 1 31 ARG H . . 3.200 2.214 2.132 2.357 . 0 0 "[ . 1 . 2]" 1
624 1 30 PHE HA 1 31 ARG HB2 . . 5.080 4.597 4.397 4.832 . 0 0 "[ . 1 . 2]" 1
625 1 30 PHE HA 1 32 GLY H . . 4.520 4.042 3.660 4.424 . 0 0 "[ . 1 . 2]" 1
626 1 30 PHE HA 1 68 TYR HA . . 3.890 3.070 2.734 3.361 . 0 0 "[ . 1 . 2]" 1
627 1 30 PHE HA 1 68 TYR QD . . 3.840 2.914 2.294 3.683 . 0 0 "[ . 1 . 2]" 1
628 1 30 PHE HA 1 68 TYR QE . . 4.120 3.203 2.757 3.797 . 0 0 "[ . 1 . 2]" 1
629 1 30 PHE HA 1 69 GLU H . . 4.740 4.190 3.989 4.430 . 0 0 "[ . 1 . 2]" 1
630 1 30 PHE HB2 1 31 ARG H . . 4.970 4.478 4.272 4.675 . 0 0 "[ . 1 . 2]" 1
631 1 30 PHE HB2 1 68 TYR QE . . 3.740 2.879 2.344 3.805 0.065 14 0 "[ . 1 . 2]" 1
632 1 30 PHE HB3 1 31 ARG H . . 5.500 4.488 4.347 4.573 . 0 0 "[ . 1 . 2]" 1
633 1 30 PHE QD 1 31 ARG H . . 4.510 3.777 3.121 4.257 . 0 0 "[ . 1 . 2]" 1
634 1 30 PHE QD 1 32 GLY H . . 4.740 3.132 1.998 3.809 . 0 0 "[ . 1 . 2]" 1
635 1 30 PHE QD 1 67 ILE H . . 5.500 4.139 3.433 5.000 . 0 0 "[ . 1 . 2]" 1
636 1 30 PHE QD 1 101 GLU HB3 . . 5.200 4.760 4.074 5.292 0.092 10 0 "[ . 1 . 2]" 1
637 1 30 PHE QD 1 101 GLU QG . . 4.330 3.237 2.066 4.250 . 0 0 "[ . 1 . 2]" 1
638 1 30 PHE QE 1 32 GLY H . . 4.610 3.653 3.094 4.308 . 0 0 "[ . 1 . 2]" 1
639 1 30 PHE QE 1 32 GLY HA2 . . 4.050 3.554 2.697 4.141 0.091 2 0 "[ . 1 . 2]" 1
640 1 30 PHE QE 1 33 ARG H . . 4.800 4.584 3.698 4.887 0.087 10 0 "[ . 1 . 2]" 1
641 1 30 PHE QE 1 33 ARG HA . . 4.570 3.738 3.282 4.287 . 0 0 "[ . 1 . 2]" 1
642 1 30 PHE QE 1 33 ARG HD2 . . 4.750 3.847 2.978 5.041 0.291 18 0 "[ . 1 . 2]" 1
643 1 30 PHE QE 1 33 ARG HG2 . . 4.730 3.723 2.325 4.818 0.088 8 0 "[ . 1 . 2]" 1
644 1 30 PHE QE 1 66 GLU HA . . 4.640 4.390 3.773 4.731 0.091 17 0 "[ . 1 . 2]" 1
645 1 30 PHE QE 1 66 GLU HB3 . . 4.390 3.920 2.456 5.370 0.980 14 1 "[ . 1 +. 2]" 1
646 1 30 PHE QE 1 67 ILE H . . 4.820 4.139 3.549 4.905 0.085 2 0 "[ . 1 . 2]" 1
647 1 30 PHE QE 1 101 GLU QG . . 4.170 3.053 2.154 3.968 . 0 0 "[ . 1 . 2]" 1
648 1 31 ARG H 1 31 ARG HB2 . . 4.010 2.811 2.261 3.180 . 0 0 "[ . 1 . 2]" 1
649 1 31 ARG H 1 31 ARG HD3 . . 4.740 4.618 4.034 4.807 0.067 15 0 "[ . 1 . 2]" 1
650 1 31 ARG H 1 67 ILE H . . 5.500 4.232 3.717 5.105 . 0 0 "[ . 1 . 2]" 1
651 1 31 ARG H 1 67 ILE MG . . 5.120 3.720 2.935 4.489 . 0 0 "[ . 1 . 2]" 1
652 1 31 ARG H 1 68 TYR HA . . 3.840 2.633 2.209 2.962 . 0 0 "[ . 1 . 2]" 1
653 1 31 ARG H 1 68 TYR QD . . 4.480 4.115 3.393 4.549 0.069 17 0 "[ . 1 . 2]" 1
654 1 31 ARG H 1 69 GLU H . . 4.590 3.207 2.594 3.701 . 0 0 "[ . 1 . 2]" 1
655 1 31 ARG HA 1 31 ARG HD2 . . 3.650 3.435 2.797 3.728 0.078 17 0 "[ . 1 . 2]" 1
656 1 31 ARG HA 1 31 ARG HD3 . . 3.460 2.197 2.031 2.874 . 0 0 "[ . 1 . 2]" 1
657 1 31 ARG HA 1 31 ARG HE . . 5.500 4.442 3.846 5.011 . 0 0 "[ . 1 . 2]" 1
658 1 31 ARG HA 1 101 GLU H . . 4.300 3.314 2.486 3.899 . 0 0 "[ . 1 . 2]" 1
659 1 31 ARG HA 1 101 GLU HB2 . . 4.320 2.627 2.186 2.860 . 0 0 "[ . 1 . 2]" 1
660 1 31 ARG HA 1 101 GLU HB3 . . 4.320 4.165 3.488 4.394 0.074 13 0 "[ . 1 . 2]" 1
661 1 31 ARG HA 1 101 GLU QG . . 4.350 3.934 2.930 4.274 . 0 0 "[ . 1 . 2]" 1
662 1 31 ARG HB2 1 31 ARG HE . . 5.500 3.360 2.540 4.660 . 0 0 "[ . 1 . 2]" 1
663 1 31 ARG HB2 1 32 GLY H . . 4.990 4.583 4.435 4.659 . 0 0 "[ . 1 . 2]" 1
664 1 31 ARG HB2 1 67 ILE MG . . 4.650 3.723 2.196 4.719 0.069 14 0 "[ . 1 . 2]" 1
665 1 31 ARG HB3 1 32 GLY H . . 5.500 4.397 4.250 4.503 . 0 0 "[ . 1 . 2]" 1
666 1 31 ARG HB3 1 67 ILE HB . . 5.380 4.046 3.129 4.637 . 0 0 "[ . 1 . 2]" 1
667 1 31 ARG HB3 1 67 ILE MG . . 4.250 2.786 2.043 4.316 0.066 16 0 "[ . 1 . 2]" 1
668 1 31 ARG HB3 1 100 TRP HH2 . . 5.220 4.330 3.022 5.277 0.057 15 0 "[ . 1 . 2]" 1
669 1 31 ARG HB3 1 101 GLU H . . 5.470 5.031 3.399 5.558 0.088 14 0 "[ . 1 . 2]" 1
670 1 31 ARG HD2 1 100 TRP HE1 . . 4.570 4.020 3.036 4.623 0.053 3 0 "[ . 1 . 2]" 1
671 1 31 ARG HD2 1 100 TRP HH2 . . 4.820 4.372 3.409 4.887 0.067 6 0 "[ . 1 . 2]" 1
672 1 31 ARG HD2 1 100 TRP HZ2 . . 3.670 3.448 2.604 3.739 0.069 18 0 "[ . 1 . 2]" 1
673 1 31 ARG HD2 1 101 GLU H . . 5.340 4.124 3.423 4.580 . 0 0 "[ . 1 . 2]" 1
674 1 31 ARG HD2 1 102 GLY QA . . 4.750 3.795 1.965 4.681 . 0 0 "[ . 1 . 2]" 1
675 1 31 ARG HD3 1 69 GLU H . . 5.500 5.344 4.466 5.586 0.086 9 0 "[ . 1 . 2]" 1
676 1 31 ARG HD3 1 102 GLY QA . . 5.500 4.084 2.784 5.363 . 0 0 "[ . 1 . 2]" 1
677 1 31 ARG HE 1 69 GLU H . . 5.500 4.831 4.325 5.578 0.078 16 0 "[ . 1 . 2]" 1
678 1 31 ARG HE 1 69 GLU HB2 . . 5.330 2.778 2.045 4.299 . 0 0 "[ . 1 . 2]" 1
679 1 31 ARG HE 1 69 GLU HB3 . . 5.190 3.472 2.600 4.273 . 0 0 "[ . 1 . 2]" 1
680 1 31 ARG HE 1 69 GLU HG2 . . 5.500 4.337 2.359 5.096 . 0 0 "[ . 1 . 2]" 1
681 1 31 ARG QG 1 69 GLU H . . 4.470 3.746 2.705 4.313 . 0 0 "[ . 1 . 2]" 1
682 1 31 ARG QG 1 69 GLU HG3 . . 4.710 4.155 3.403 4.767 0.057 17 0 "[ . 1 . 2]" 1
683 1 31 ARG QG 1 100 TRP HH2 . . 4.620 3.076 2.564 4.000 . 0 0 "[ . 1 . 2]" 1
684 1 31 ARG QG 1 100 TRP HZ2 . . 4.240 3.524 2.763 4.207 . 0 0 "[ . 1 . 2]" 1
685 1 32 GLY H 1 33 ARG H . . 5.120 4.473 3.459 4.637 . 0 0 "[ . 1 . 2]" 1
686 1 32 GLY H 1 67 ILE H . . 5.500 4.768 3.743 5.132 . 0 0 "[ . 1 . 2]" 1
687 1 32 GLY H 1 67 ILE HB . . 4.750 4.454 4.011 4.743 . 0 0 "[ . 1 . 2]" 1
688 1 32 GLY H 1 67 ILE MD . . 5.500 5.422 4.505 5.613 0.113 17 0 "[ . 1 . 2]" 1
689 1 32 GLY H 1 67 ILE MG . . 5.390 5.047 4.560 5.474 0.084 20 0 "[ . 1 . 2]" 1
690 1 32 GLY H 1 100 TRP HA . . 5.170 4.512 4.070 4.896 . 0 0 "[ . 1 . 2]" 1
691 1 32 GLY H 1 101 GLU H . . 3.810 3.525 3.003 3.886 0.076 2 0 "[ . 1 . 2]" 1
692 1 32 GLY H 1 101 GLU QG . . 5.500 2.865 2.131 3.387 . 0 0 "[ . 1 . 2]" 1
693 1 32 GLY HA2 1 33 ARG H . . 3.430 2.653 2.092 2.956 . 0 0 "[ . 1 . 2]" 1
694 1 32 GLY HA2 1 67 ILE MD . . 5.500 4.861 3.869 5.319 . 0 0 "[ . 1 . 2]" 1
695 1 32 GLY HA2 1 100 TRP H . . 5.210 4.531 4.067 5.233 0.023 5 0 "[ . 1 . 2]" 1
696 1 32 GLY HA2 1 100 TRP HA . . 4.050 3.401 2.555 4.078 0.028 5 0 "[ . 1 . 2]" 1
697 1 32 GLY HA2 1 100 TRP HE3 . . 5.500 5.189 4.261 5.578 0.078 7 0 "[ . 1 . 2]" 1
698 1 32 GLY HA2 1 101 GLU H . . 4.530 3.425 2.887 3.956 . 0 0 "[ . 1 . 2]" 1
699 1 32 GLY HA2 1 101 GLU HB2 . . 4.940 3.938 3.642 4.947 0.007 2 0 "[ . 1 . 2]" 1
700 1 32 GLY HA2 1 101 GLU QG . . 4.500 2.529 2.168 3.384 . 0 0 "[ . 1 . 2]" 1
701 1 32 GLY HA3 1 33 ARG H . . 3.490 2.418 2.217 3.261 . 0 0 "[ . 1 . 2]" 1
702 1 32 GLY HA3 1 33 ARG HG2 . . 5.500 5.315 4.190 6.315 0.815 17 4 "[ .* 1- .*+ 2]" 1
703 1 32 GLY HA3 1 67 ILE HB . . 5.240 3.676 3.242 4.383 . 0 0 "[ . 1 . 2]" 1
704 1 32 GLY HA3 1 67 ILE MD . . 5.170 3.571 2.436 4.111 . 0 0 "[ . 1 . 2]" 1
705 1 32 GLY HA3 1 100 TRP HA . . 3.850 2.323 2.129 2.583 . 0 0 "[ . 1 . 2]" 1
706 1 32 GLY HA3 1 101 GLU H . . 4.480 3.005 2.705 3.595 . 0 0 "[ . 1 . 2]" 1
707 1 33 ARG H 1 33 ARG QB . . 3.570 2.795 2.434 3.237 . 0 0 "[ . 1 . 2]" 1
708 1 33 ARG H 1 33 ARG HD2 . . 5.250 4.910 3.364 5.908 0.658 17 1 "[ . 1 . + 2]" 1
709 1 33 ARG H 1 33 ARG HG2 . . 3.810 3.490 2.368 4.663 0.853 17 5 "[ . ** .*+ -2]" 1
710 1 33 ARG H 1 67 ILE MD . . 5.240 3.484 3.056 4.788 . 0 0 "[ . 1 . 2]" 1
711 1 33 ARG H 1 97 VAL QG . . 4.900 3.721 3.330 4.766 . 0 0 "[ . 1 . 2]" 1
712 1 33 ARG H 1 98 LEU H . . 5.500 4.042 3.494 4.867 . 0 0 "[ . 1 . 2]" 1
713 1 33 ARG H 1 98 LEU QB . . 5.300 4.050 3.744 4.556 . 0 0 "[ . 1 . 2]" 1
714 1 33 ARG H 1 99 GLU H . . 3.670 2.609 2.428 3.363 . 0 0 "[ . 1 . 2]" 1
715 1 33 ARG H 1 99 GLU QB . . 3.890 2.446 2.228 2.685 . 0 0 "[ . 1 . 2]" 1
716 1 33 ARG H 1 99 GLU HG2 . . 4.980 4.506 3.863 5.390 0.410 3 0 "[ . 1 . 2]" 1
717 1 33 ARG H 1 100 TRP H . . 4.830 4.656 4.438 4.900 0.070 2 0 "[ . 1 . 2]" 1
718 1 33 ARG H 1 100 TRP HA . . 4.770 3.874 3.645 4.363 . 0 0 "[ . 1 . 2]" 1
719 1 33 ARG H 1 101 GLU H . . 5.040 5.100 4.930 5.128 0.088 15 0 "[ . 1 . 2]" 1
720 1 33 ARG HA 1 33 ARG HD2 . . 4.430 4.586 4.175 4.832 0.402 19 0 "[ . 1 . 2]" 1
721 1 33 ARG HA 1 34 GLY H . . 2.930 2.560 2.416 2.706 . 0 0 "[ . 1 . 2]" 1
722 1 33 ARG HA 1 34 GLY HA3 . . 5.130 4.289 4.112 4.429 . 0 0 "[ . 1 . 2]" 1
723 1 33 ARG HA 1 67 ILE MD . . 5.500 3.843 3.192 4.649 . 0 0 "[ . 1 . 2]" 1
724 1 33 ARG QB 1 33 ARG HD2 . . 2.950 2.717 2.123 3.373 0.423 10 0 "[ . 1 . 2]" 1
725 1 33 ARG QB 1 33 ARG HE . . 4.960 2.939 2.091 4.169 . 0 0 "[ . 1 . 2]" 1
726 1 33 ARG QB 1 34 GLY H . . 3.900 2.513 2.340 2.773 . 0 0 "[ . 1 . 2]" 1
727 1 33 ARG QB 1 98 LEU QB . . 4.970 2.867 2.029 3.808 . 0 0 "[ . 1 . 2]" 1
728 1 33 ARG QB 1 98 LEU QD . . 5.230 3.636 2.605 4.813 . 0 0 "[ . 1 . 2]" 1
729 1 33 ARG QB 1 99 GLU H . . 5.030 3.791 2.926 4.634 . 0 0 "[ . 1 . 2]" 1
730 1 33 ARG HD2 1 98 LEU QB . . 5.130 4.635 3.289 5.910 0.780 17 2 "[ . 1 .-+ 2]" 1
731 1 33 ARG HD2 1 99 GLU QB . . 4.830 3.794 2.285 5.182 0.352 17 0 "[ . 1 . 2]" 1
732 1 33 ARG HE 1 98 LEU QD . . 5.500 3.691 2.615 4.906 . 0 0 "[ . 1 . 2]" 1
733 1 33 ARG HE 1 99 GLU QB . . 5.440 3.708 1.781 5.107 . 0 0 "[ . 1 . 2]" 1
734 1 33 ARG HG2 1 34 GLY H . . 4.960 4.090 3.134 4.515 . 0 0 "[ . 1 . 2]" 1
735 1 34 GLY H 1 35 CYS H . . 4.950 4.378 4.325 4.435 . 0 0 "[ . 1 . 2]" 1
736 1 34 GLY H 1 67 ILE HG13 . . 5.380 3.614 3.147 4.236 . 0 0 "[ . 1 . 2]" 1
737 1 34 GLY H 1 95 VAL QG . . 5.330 4.511 4.226 4.746 . 0 0 "[ . 1 . 2]" 1
738 1 34 GLY H 1 98 LEU QB . . 4.620 3.306 2.919 3.596 . 0 0 "[ . 1 . 2]" 1
739 1 34 GLY H 1 98 LEU QD . . 4.790 3.653 2.937 4.268 . 0 0 "[ . 1 . 2]" 1
740 1 34 GLY HA2 1 35 CYS H . . 3.310 2.436 2.378 2.535 . 0 0 "[ . 1 . 2]" 1
741 1 34 GLY HA2 1 35 CYS QB . . 5.500 4.215 3.887 4.736 . 0 0 "[ . 1 . 2]" 1
742 1 34 GLY HA2 1 65 GLY H . . 5.250 5.053 4.718 5.326 0.076 6 0 "[ . 1 . 2]" 1
743 1 34 GLY HA2 1 67 ILE MD . . 4.720 3.679 3.322 4.321 . 0 0 "[ . 1 . 2]" 1
744 1 34 GLY HA2 1 95 VAL QG . . 3.810 3.632 3.289 3.836 0.026 12 0 "[ . 1 . 2]" 1
745 1 34 GLY HA2 1 97 VAL HA . . 3.940 3.305 2.833 3.724 . 0 0 "[ . 1 . 2]" 1
746 1 34 GLY HA2 1 98 LEU H . . 3.760 2.139 1.855 2.536 . 0 0 "[ . 1 . 2]" 1
747 1 34 GLY HA2 1 98 LEU QB . . 3.750 2.218 2.061 2.364 . 0 0 "[ . 1 . 2]" 1
748 1 34 GLY HA2 1 98 LEU QD . . 4.400 2.353 2.089 2.859 . 0 0 "[ . 1 . 2]" 1
749 1 34 GLY HA2 1 99 GLU H . . 4.320 4.220 4.052 4.388 0.068 11 0 "[ . 1 . 2]" 1
750 1 34 GLY HA3 1 35 CYS H . . 3.330 2.552 2.459 2.627 . 0 0 "[ . 1 . 2]" 1
751 1 34 GLY HA3 1 67 ILE MD . . 3.790 2.668 2.160 3.308 . 0 0 "[ . 1 . 2]" 1
752 1 34 GLY HA3 1 95 VAL QG . . 3.460 2.551 2.252 2.725 . 0 0 "[ . 1 . 2]" 1
753 1 34 GLY HA3 1 97 VAL QG . . 5.500 4.491 4.073 4.741 . 0 0 "[ . 1 . 2]" 1
754 1 34 GLY HA3 1 98 LEU QB . . 4.190 3.744 3.591 3.985 . 0 0 "[ . 1 . 2]" 1
755 1 34 GLY HA3 1 98 LEU QD . . 4.670 3.684 3.398 4.238 . 0 0 "[ . 1 . 2]" 1
756 1 35 CYS H 1 64 THR HA . . 5.430 4.934 4.577 5.243 . 0 0 "[ . 1 . 2]" 1
757 1 35 CYS H 1 95 VAL HA . . 4.730 4.302 3.935 4.760 0.030 12 0 "[ . 1 . 2]" 1
758 1 35 CYS H 1 95 VAL QG . . 3.330 2.595 2.237 2.901 . 0 0 "[ . 1 . 2]" 1
759 1 35 CYS H 1 96 GLN H . . 3.790 2.781 2.468 3.061 . 0 0 "[ . 1 . 2]" 1
760 1 35 CYS H 1 96 GLN HB3 . . 4.000 2.829 2.482 3.213 . 0 0 "[ . 1 . 2]" 1
761 1 35 CYS H 1 96 GLN HG2 . . 5.480 4.113 3.651 4.638 . 0 0 "[ . 1 . 2]" 1
762 1 35 CYS H 1 98 LEU QB . . 4.320 4.266 4.017 4.305 . 0 0 "[ . 1 . 2]" 1
763 1 35 CYS H 1 98 LEU QD . . 4.350 2.854 2.522 3.254 . 0 0 "[ . 1 . 2]" 1
764 1 35 CYS HA 1 36 THR H . . 3.070 2.416 2.284 2.561 . 0 0 "[ . 1 . 2]" 1
765 1 35 CYS HA 1 36 THR HA . . 5.360 4.466 4.382 4.531 . 0 0 "[ . 1 . 2]" 1
766 1 35 CYS HA 1 36 THR MG . . 4.540 3.976 3.712 4.381 . 0 0 "[ . 1 . 2]" 1
767 1 35 CYS HA 1 64 THR H . . 5.080 4.842 4.614 5.040 . 0 0 "[ . 1 . 2]" 1
768 1 35 CYS HA 1 64 THR HA . . 3.200 2.305 2.087 2.544 . 0 0 "[ . 1 . 2]" 1
769 1 35 CYS HA 1 64 THR HB . . 4.760 4.331 3.732 4.814 0.054 1 0 "[ . 1 . 2]" 1
770 1 35 CYS HA 1 64 THR MG . . 4.850 3.883 3.390 4.177 . 0 0 "[ . 1 . 2]" 1
771 1 35 CYS HA 1 65 GLY H . . 3.960 3.052 2.821 3.402 . 0 0 "[ . 1 . 2]" 1
772 1 35 CYS HA 1 95 VAL QG . . 4.720 3.524 3.269 3.877 . 0 0 "[ . 1 . 2]" 1
773 1 35 CYS HA 1 98 LEU QD . . 5.470 3.984 3.689 4.310 . 0 0 "[ . 1 . 2]" 1
774 1 35 CYS QB 1 36 THR H . . 3.430 2.813 2.579 3.150 . 0 0 "[ . 1 . 2]" 1
775 1 35 CYS QB 1 36 THR MG . . 5.290 4.729 4.345 5.058 . 0 0 "[ . 1 . 2]" 1
776 1 35 CYS QB 1 62 CYS HB3 . . 4.330 3.319 2.523 4.600 0.270 3 0 "[ . 1 . 2]" 1
777 1 35 CYS QB 1 64 THR H . . 5.240 4.389 3.709 4.975 . 0 0 "[ . 1 . 2]" 1
778 1 35 CYS QB 1 64 THR HA . . 3.510 2.559 1.865 3.158 . 0 0 "[ . 1 . 2]" 1
779 1 35 CYS QB 1 64 THR HB . . 4.670 3.684 3.083 4.513 . 0 0 "[ . 1 . 2]" 1
780 1 35 CYS QB 1 64 THR MG . . 3.150 2.512 2.001 3.137 . 0 0 "[ . 1 . 2]" 1
781 1 35 CYS QB 1 65 GLY H . . 4.740 3.843 3.396 4.514 . 0 0 "[ . 1 . 2]" 1
782 1 35 CYS QB 1 95 VAL QG . . 5.500 4.322 3.906 4.615 . 0 0 "[ . 1 . 2]" 1
783 1 35 CYS QB 1 96 GLN H . . 5.120 4.509 3.819 4.787 . 0 0 "[ . 1 . 2]" 1
784 1 35 CYS QB 1 96 GLN HB3 . . 4.620 3.803 2.723 4.275 . 0 0 "[ . 1 . 2]" 1
785 1 35 CYS QB 1 98 LEU QD . . 3.890 2.584 1.956 3.163 . 0 0 "[ . 1 . 2]" 1
786 1 36 THR H 1 36 THR MG . . 3.130 2.563 2.102 3.070 . 0 0 "[ . 1 . 2]" 1
787 1 36 THR H 1 37 VAL H . . 5.050 4.292 4.049 4.497 . 0 0 "[ . 1 . 2]" 1
788 1 36 THR H 1 37 VAL QG . . 5.500 4.759 4.587 5.011 . 0 0 "[ . 1 . 2]" 1
789 1 36 THR H 1 62 CYS HA . . 4.760 4.246 3.464 4.814 0.054 3 0 "[ . 1 . 2]" 1
790 1 36 THR H 1 62 CYS HB2 . . 5.260 5.119 3.842 5.349 0.089 6 0 "[ . 1 . 2]" 1
791 1 36 THR H 1 62 CYS HB3 . . 4.730 4.071 3.723 5.295 0.565 10 2 "[ - . + . 2]" 1
792 1 36 THR H 1 63 VAL H . . 3.780 3.235 2.817 3.825 0.045 12 0 "[ . 1 . 2]" 1
793 1 36 THR H 1 63 VAL HB . . 4.640 3.864 3.135 4.738 0.098 14 0 "[ . 1 . 2]" 1
794 1 36 THR H 1 63 VAL QG . . 4.990 4.052 3.168 4.501 . 0 0 "[ . 1 . 2]" 1
795 1 36 THR H 1 64 THR H . . 5.500 4.840 4.495 5.162 . 0 0 "[ . 1 . 2]" 1
796 1 36 THR H 1 64 THR HA . . 4.180 3.582 2.975 3.904 . 0 0 "[ . 1 . 2]" 1
797 1 36 THR H 1 64 THR MG . . 5.020 4.588 4.163 5.068 0.048 10 0 "[ . 1 . 2]" 1
798 1 36 THR H 1 95 VAL HA . . 5.500 4.875 4.540 5.210 . 0 0 "[ . 1 . 2]" 1
799 1 36 THR H 1 95 VAL QG . . 5.500 3.772 3.245 4.135 . 0 0 "[ . 1 . 2]" 1
800 1 36 THR HA 1 36 THR MG . . 3.260 2.368 2.223 2.612 . 0 0 "[ . 1 . 2]" 1
801 1 36 THR HA 1 37 VAL H . . 3.070 2.241 2.082 2.373 . 0 0 "[ . 1 . 2]" 1
802 1 36 THR HA 1 37 VAL QG . . 4.040 3.463 3.313 3.702 . 0 0 "[ . 1 . 2]" 1
803 1 36 THR HA 1 38 GLU H . . 4.520 3.549 3.198 4.021 . 0 0 "[ . 1 . 2]" 1
804 1 36 THR HA 1 40 PHE QE . . 5.320 4.416 4.020 4.799 . 0 0 "[ . 1 . 2]" 1
805 1 36 THR HA 1 95 VAL HA . . 3.330 2.470 2.130 2.910 . 0 0 "[ . 1 . 2]" 1
806 1 36 THR HA 1 95 VAL QG . . 4.060 2.767 2.492 3.059 . 0 0 "[ . 1 . 2]" 1
807 1 36 THR HA 1 96 GLN H . . 4.100 3.568 3.095 3.935 . 0 0 "[ . 1 . 2]" 1
808 1 36 THR HB 1 37 VAL H . . 4.300 3.846 3.499 4.210 . 0 0 "[ . 1 . 2]" 1
809 1 36 THR HB 1 37 VAL QG . . 5.260 4.706 4.485 4.967 . 0 0 "[ . 1 . 2]" 1
810 1 36 THR HB 1 38 GLU H . . 3.860 3.545 3.060 3.932 0.072 3 0 "[ . 1 . 2]" 1
811 1 36 THR HB 1 40 PHE QE . . 3.640 2.750 2.209 3.365 . 0 0 "[ . 1 . 2]" 1
812 1 36 THR HB 1 62 CYS HA . . 4.360 4.347 4.104 4.443 0.083 7 0 "[ . 1 . 2]" 1
813 1 36 THR HB 1 93 LEU QD . . 5.500 3.420 2.597 4.203 . 0 0 "[ . 1 . 2]" 1
814 1 36 THR HB 1 95 VAL QG . . 5.500 4.101 3.831 4.497 . 0 0 "[ . 1 . 2]" 1
815 1 36 THR MG 1 37 VAL H . . 4.480 4.215 3.886 4.533 0.053 14 0 "[ . 1 . 2]" 1
816 1 36 THR MG 1 38 GLU H . . 5.500 4.669 4.283 5.189 . 0 0 "[ . 1 . 2]" 1
817 1 36 THR MG 1 40 PHE HB2 . . 5.500 4.121 2.946 4.938 . 0 0 "[ . 1 . 2]" 1
818 1 36 THR MG 1 40 PHE QD . . 3.500 2.841 2.288 3.295 . 0 0 "[ . 1 . 2]" 1
819 1 36 THR MG 1 40 PHE QE . . 3.910 3.060 2.464 3.988 0.078 4 0 "[ . 1 . 2]" 1
820 1 36 THR MG 1 62 CYS HA . . 5.240 4.780 4.056 5.219 . 0 0 "[ . 1 . 2]" 1
821 1 36 THR MG 1 63 VAL H . . 3.960 3.604 2.819 4.064 0.104 16 0 "[ . 1 . 2]" 1
822 1 36 THR MG 1 63 VAL HB . . 3.570 2.894 2.251 3.707 0.137 20 0 "[ . 1 . 2]" 1
823 1 36 THR MG 1 63 VAL QG . . 3.860 3.153 1.767 3.687 . 0 0 "[ . 1 . 2]" 1
824 1 36 THR MG 1 93 LEU QD . . 3.570 2.285 1.889 2.891 . 0 0 "[ . 1 . 2]" 1
825 1 36 THR MG 1 93 LEU HG . . 3.630 3.344 2.251 3.745 0.115 14 0 "[ . 1 . 2]" 1
826 1 36 THR MG 1 95 VAL HA . . 4.730 3.751 3.020 4.452 . 0 0 "[ . 1 . 2]" 1
827 1 36 THR MG 1 95 VAL QG . . 3.880 2.404 2.051 2.856 . 0 0 "[ . 1 . 2]" 1
828 1 36 THR MG 1 96 GLN H . . 5.450 5.005 4.418 5.480 0.030 20 0 "[ . 1 . 2]" 1
829 1 37 VAL H 1 37 VAL HB . . 3.630 3.366 2.567 3.646 0.016 10 0 "[ . 1 . 2]" 1
830 1 37 VAL H 1 37 VAL QG . . 3.230 1.863 1.768 2.156 . 0 0 "[ . 1 . 2]" 1
831 1 37 VAL H 1 38 GLU H . . 3.450 2.510 2.333 2.759 . 0 0 "[ . 1 . 2]" 1
832 1 37 VAL H 1 95 VAL HA . . 3.810 2.768 2.167 3.237 . 0 0 "[ . 1 . 2]" 1
833 1 37 VAL H 1 95 VAL QG . . 4.740 3.867 3.576 4.210 . 0 0 "[ . 1 . 2]" 1
834 1 37 VAL H 1 96 GLN H . . 4.410 3.009 2.546 3.595 . 0 0 "[ . 1 . 2]" 1
835 1 37 VAL H 1 96 GLN HB2 . . 4.780 4.123 3.445 4.840 0.060 2 0 "[ . 1 . 2]" 1
836 1 37 VAL HA 1 37 VAL QG . . 3.000 2.123 2.084 2.166 . 0 0 "[ . 1 . 2]" 1
837 1 37 VAL HA 1 96 GLN H . . 5.150 4.958 4.504 5.226 0.076 10 0 "[ . 1 . 2]" 1
838 1 37 VAL HA 1 96 GLN HB2 . . 4.700 4.620 4.176 4.779 0.079 10 0 "[ . 1 . 2]" 1
839 1 37 VAL HB 1 38 GLU H . . 3.610 3.363 2.453 3.695 0.085 6 0 "[ . 1 . 2]" 1
840 1 37 VAL HB 1 38 GLU HA . . 4.810 4.519 4.109 4.736 . 0 0 "[ . 1 . 2]" 1
841 1 37 VAL QG 1 38 GLU H . . 4.020 2.577 1.793 3.309 . 0 0 "[ . 1 . 2]" 1
842 1 37 VAL QG 1 38 GLU HA . . 4.930 4.089 3.575 4.380 . 0 0 "[ . 1 . 2]" 1
843 1 37 VAL QG 1 38 GLU HB3 . . 5.330 5.040 4.417 5.465 0.135 3 0 "[ . 1 . 2]" 1
844 1 37 VAL QG 1 38 GLU QG . . 4.470 4.140 3.754 4.385 . 0 0 "[ . 1 . 2]" 1
845 1 37 VAL QG 1 39 SER H . . 5.500 5.161 4.311 5.447 . 0 0 "[ . 1 . 2]" 1
846 1 37 VAL QG 1 94 GLN HE21 . . 5.130 4.613 4.270 4.992 . 0 0 "[ . 1 . 2]" 1
847 1 37 VAL QG 1 94 GLN HE22 . . 5.500 5.528 5.260 5.608 0.108 10 0 "[ . 1 . 2]" 1
848 1 37 VAL QG 1 94 GLN HG3 . . 3.400 2.911 2.428 3.253 . 0 0 "[ . 1 . 2]" 1
849 1 37 VAL QG 1 95 VAL H . . 4.910 4.090 3.615 4.597 . 0 0 "[ . 1 . 2]" 1
850 1 37 VAL QG 1 95 VAL HA . . 3.710 2.875 2.310 3.532 . 0 0 "[ . 1 . 2]" 1
851 1 37 VAL QG 1 95 VAL QG . . 4.350 3.751 3.421 4.096 . 0 0 "[ . 1 . 2]" 1
852 1 37 VAL QG 1 96 GLN H . . 3.580 2.466 2.014 2.847 . 0 0 "[ . 1 . 2]" 1
853 1 37 VAL QG 1 96 GLN HA . . 4.060 3.115 2.921 3.464 . 0 0 "[ . 1 . 2]" 1
854 1 37 VAL QG 1 96 GLN HB2 . . 2.670 1.934 1.861 2.081 . 0 0 "[ . 1 . 2]" 1
855 1 37 VAL QG 1 96 GLN HB3 . . 4.090 2.475 2.197 3.273 . 0 0 "[ . 1 . 2]" 1
856 1 37 VAL QG 1 96 GLN QE . . 5.300 3.659 1.935 4.513 . 0 0 "[ . 1 . 2]" 1
857 1 37 VAL QG 1 96 GLN HG3 . . 4.080 3.595 3.213 4.016 . 0 0 "[ . 1 . 2]" 1
858 1 37 VAL QG 1 109 SER HA . . 5.490 4.290 3.947 4.966 . 0 0 "[ . 1 . 2]" 1
859 1 37 VAL QG 1 109 SER QB . . 4.040 2.984 2.356 3.621 . 0 0 "[ . 1 . 2]" 1
860 1 37 VAL QG 1 110 VAL H . . 5.500 4.751 4.362 5.329 . 0 0 "[ . 1 . 2]" 1
861 1 38 GLU H 1 38 GLU HB2 . . 3.100 2.160 2.006 2.532 . 0 0 "[ . 1 . 2]" 1
862 1 38 GLU H 1 38 GLU HB3 . . 3.730 3.331 2.806 3.588 . 0 0 "[ . 1 . 2]" 1
863 1 38 GLU H 1 38 GLU QG . . 4.030 3.348 2.454 3.813 . 0 0 "[ . 1 . 2]" 1
864 1 38 GLU H 1 39 SER H . . 4.690 4.319 3.102 4.526 . 0 0 "[ . 1 . 2]" 1
865 1 38 GLU H 1 40 PHE QD . . 5.110 4.995 4.626 5.200 0.090 18 0 "[ . 1 . 2]" 1
866 1 38 GLU H 1 40 PHE QE . . 4.650 4.244 3.773 4.696 0.046 15 0 "[ . 1 . 2]" 1
867 1 38 GLU HA 1 38 GLU QG . . 3.660 2.306 1.988 3.205 . 0 0 "[ . 1 . 2]" 1
868 1 38 GLU HA 1 39 SER H . . 2.900 2.177 2.086 2.598 . 0 0 "[ . 1 . 2]" 1
869 1 38 GLU HA 1 39 SER QB . . 5.100 4.510 4.151 4.664 . 0 0 "[ . 1 . 2]" 1
870 1 38 GLU HB2 1 39 SER H . . 4.550 4.538 4.217 4.619 0.069 15 0 "[ . 1 . 2]" 1
871 1 38 GLU HB2 1 40 PHE QE . . 3.520 3.044 2.347 3.624 0.104 4 0 "[ . 1 . 2]" 1
872 1 38 GLU HB2 1 58 GLY H . . 5.340 4.940 3.625 5.419 0.079 1 0 "[ . 1 . 2]" 1
873 1 38 GLU HB3 1 39 SER H . . 3.860 3.780 3.239 3.940 0.080 1 0 "[ . 1 . 2]" 1
874 1 38 GLU HB3 1 40 PHE HZ . . 3.930 3.662 3.086 4.012 0.082 2 0 "[ . 1 . 2]" 1
875 1 38 GLU HB3 1 58 GLY H . . 5.140 3.402 2.152 4.239 . 0 0 "[ . 1 . 2]" 1
876 1 38 GLU QG 1 40 PHE QE . . 5.340 4.148 3.615 4.513 . 0 0 "[ . 1 . 2]" 1
877 1 38 GLU QG 1 40 PHE HZ . . 4.990 4.292 3.539 4.811 . 0 0 "[ . 1 . 2]" 1
878 1 38 GLU QG 1 57 PRO HA . . 4.540 3.284 2.613 3.748 . 0 0 "[ . 1 . 2]" 1
879 1 38 GLU QG 1 57 PRO HB3 . . 4.590 2.645 2.328 2.993 . 0 0 "[ . 1 . 2]" 1
880 1 38 GLU QG 1 58 GLY H . . 4.360 3.448 2.916 4.074 . 0 0 "[ . 1 . 2]" 1
881 1 38 GLU QG 1 58 GLY HA3 . . 5.500 4.624 3.753 5.332 . 0 0 "[ . 1 . 2]" 1
882 1 39 SER H 1 39 SER QB . . 3.460 2.658 2.143 2.982 . 0 0 "[ . 1 . 2]" 1
883 1 39 SER H 1 40 PHE H . . 4.890 4.661 4.512 4.773 . 0 0 "[ . 1 . 2]" 1
884 1 39 SER H 1 57 PRO HA . . 4.790 4.718 4.287 4.893 0.103 4 0 "[ . 1 . 2]" 1
885 1 39 SER H 1 58 GLY H . . 4.310 3.115 2.837 3.660 . 0 0 "[ . 1 . 2]" 1
886 1 39 SER H 1 58 GLY HA2 . . 4.430 3.039 2.406 3.715 . 0 0 "[ . 1 . 2]" 1
887 1 39 SER H 1 58 GLY HA3 . . 4.970 4.650 4.015 5.057 0.087 4 0 "[ . 1 . 2]" 1
888 1 39 SER H 1 59 LYS H . . 5.120 4.838 4.277 5.158 0.038 15 0 "[ . 1 . 2]" 1
889 1 39 SER HA 1 40 PHE H . . 2.900 2.350 2.248 2.496 . 0 0 "[ . 1 . 2]" 1
890 1 39 SER HA 1 40 PHE HB2 . . 4.740 4.486 4.193 4.774 0.034 5 0 "[ . 1 . 2]" 1
891 1 39 SER HA 1 40 PHE QD . . 4.780 4.299 3.548 4.611 . 0 0 "[ . 1 . 2]" 1
892 1 39 SER HA 1 61 HIS H . . 4.900 4.015 3.509 4.456 . 0 0 "[ . 1 . 2]" 1
893 1 39 SER HA 1 62 CYS H . . 4.660 3.934 3.409 4.440 . 0 0 "[ . 1 . 2]" 1
894 1 39 SER HA 1 62 CYS HA . . 3.360 2.677 2.014 3.132 . 0 0 "[ . 1 . 2]" 1
895 1 39 SER HA 1 63 VAL H . . 4.510 4.218 3.765 4.586 0.076 10 0 "[ . 1 . 2]" 1
896 1 39 SER HA 1 63 VAL QG . . 5.500 4.405 3.969 5.174 . 0 0 "[ . 1 . 2]" 1
897 1 39 SER QB 1 40 PHE H . . 3.620 3.085 2.740 3.364 . 0 0 "[ . 1 . 2]" 1
898 1 39 SER QB 1 40 PHE HA . . 5.140 4.090 3.837 4.696 . 0 0 "[ . 1 . 2]" 1
899 1 39 SER QB 1 58 GLY H . . 4.370 3.128 2.727 3.892 . 0 0 "[ . 1 . 2]" 1
900 1 39 SER QB 1 58 GLY HA2 . . 4.250 2.785 2.110 3.279 . 0 0 "[ . 1 . 2]" 1
901 1 39 SER QB 1 58 GLY HA3 . . 4.670 4.186 3.733 4.584 . 0 0 "[ . 1 . 2]" 1
902 1 39 SER QB 1 59 LYS H . . 4.480 3.048 2.529 4.176 . 0 0 "[ . 1 . 2]" 1
903 1 39 SER QB 1 59 LYS HA . . 4.740 3.711 3.356 4.372 . 0 0 "[ . 1 . 2]" 1
904 1 39 SER QB 1 61 HIS H . . 4.590 3.285 2.150 3.821 . 0 0 "[ . 1 . 2]" 1
905 1 39 SER QB 1 61 HIS HA . . 4.220 2.599 2.201 2.928 . 0 0 "[ . 1 . 2]" 1
906 1 39 SER QB 1 62 CYS H . . 4.670 4.108 3.722 4.456 . 0 0 "[ . 1 . 2]" 1
907 1 39 SER QB 1 62 CYS HA . . 5.150 4.300 3.639 4.764 . 0 0 "[ . 1 . 2]" 1
908 1 40 PHE H 1 40 PHE HB2 . . 3.840 2.686 2.523 2.958 . 0 0 "[ . 1 . 2]" 1
909 1 40 PHE H 1 40 PHE QD . . 4.240 3.678 3.271 4.096 . 0 0 "[ . 1 . 2]" 1
910 1 40 PHE H 1 41 PRO HA . . 5.440 4.873 4.624 5.146 . 0 0 "[ . 1 . 2]" 1
911 1 40 PHE H 1 41 PRO HD2 . . 5.260 4.868 4.717 5.299 0.039 10 0 "[ . 1 . 2]" 1
912 1 40 PHE H 1 53 LEU QD . . 5.440 4.186 3.660 4.899 . 0 0 "[ . 1 . 2]" 1
913 1 40 PHE H 1 60 GLY HA3 . . 4.820 3.833 2.848 4.648 . 0 0 "[ . 1 . 2]" 1
914 1 40 PHE H 1 61 HIS H . . 3.700 2.782 2.154 3.590 . 0 0 "[ . 1 . 2]" 1
915 1 40 PHE H 1 61 HIS HA . . 4.890 4.263 3.898 4.945 0.055 13 0 "[ . 1 . 2]" 1
916 1 40 PHE H 1 62 CYS H . . 5.500 4.895 4.527 5.363 . 0 0 "[ . 1 . 2]" 1
917 1 40 PHE H 1 62 CYS HA . . 3.980 3.751 3.185 4.052 0.072 20 0 "[ . 1 . 2]" 1
918 1 40 PHE H 1 63 VAL QG . . 4.480 3.312 2.824 4.219 . 0 0 "[ . 1 . 2]" 1
919 1 40 PHE HA 1 40 PHE QD . . 4.030 2.686 2.354 3.094 . 0 0 "[ . 1 . 2]" 1
920 1 40 PHE HA 1 41 PRO HD2 . . 3.570 2.358 2.187 3.210 . 0 0 "[ . 1 . 2]" 1
921 1 40 PHE HA 1 41 PRO HD3 . . 3.230 2.274 1.890 2.547 . 0 0 "[ . 1 . 2]" 1
922 1 40 PHE HA 1 41 PRO HG2 . . 4.320 4.409 4.325 4.553 0.233 20 0 "[ . 1 . 2]" 1
923 1 40 PHE HA 1 41 PRO HG3 . . 4.920 4.381 3.839 4.615 . 0 0 "[ . 1 . 2]" 1
924 1 40 PHE HA 1 56 LEU H . . 4.930 3.796 3.522 4.005 . 0 0 "[ . 1 . 2]" 1
925 1 40 PHE HA 1 56 LEU HB2 . . 5.030 5.053 4.887 5.111 0.081 13 0 "[ . 1 . 2]" 1
926 1 40 PHE HA 1 56 LEU HB3 . . 4.890 3.958 3.698 4.155 . 0 0 "[ . 1 . 2]" 1
927 1 40 PHE HA 1 57 PRO HA . . 4.440 3.671 3.383 4.071 . 0 0 "[ . 1 . 2]" 1
928 1 40 PHE HA 1 58 GLY H . . 4.910 3.916 3.546 4.239 . 0 0 "[ . 1 . 2]" 1
929 1 40 PHE HA 1 59 LYS H . . 4.280 3.296 3.105 3.499 . 0 0 "[ . 1 . 2]" 1
930 1 40 PHE HA 1 59 LYS QB . . 5.120 4.010 3.506 4.702 . 0 0 "[ . 1 . 2]" 1
931 1 40 PHE HB2 1 41 PRO HD2 . . 5.060 3.993 3.773 4.360 . 0 0 "[ . 1 . 2]" 1
932 1 40 PHE HB2 1 41 PRO HD3 . . 5.030 4.832 4.336 5.021 . 0 0 "[ . 1 . 2]" 1
933 1 40 PHE HB2 1 53 LEU QD . . 3.460 2.252 1.927 2.658 . 0 0 "[ . 1 . 2]" 1
934 1 40 PHE HB2 1 53 LEU HG . . 4.200 4.013 3.277 4.299 0.099 13 0 "[ . 1 . 2]" 1
935 1 40 PHE HB2 1 56 LEU H . . 5.310 5.344 5.135 5.400 0.090 18 0 "[ . 1 . 2]" 1
936 1 40 PHE HB2 1 63 VAL QG . . 4.420 2.786 2.098 3.650 . 0 0 "[ . 1 . 2]" 1
937 1 40 PHE HB3 1 41 PRO HD2 . . 4.600 2.477 2.230 2.802 . 0 0 "[ . 1 . 2]" 1
938 1 40 PHE HB3 1 41 PRO HD3 . . 4.740 3.728 3.143 3.972 . 0 0 "[ . 1 . 2]" 1
939 1 40 PHE HB3 1 53 LEU QD . . 3.640 2.093 1.871 2.652 . 0 0 "[ . 1 . 2]" 1
940 1 40 PHE HB3 1 53 LEU HG . . 4.150 3.444 2.328 4.235 0.085 13 0 "[ . 1 . 2]" 1
941 1 40 PHE HB3 1 56 LEU H . . 5.050 3.869 3.664 4.009 . 0 0 "[ . 1 . 2]" 1
942 1 40 PHE HB3 1 63 VAL QG . . 4.620 3.888 3.283 4.561 . 0 0 "[ . 1 . 2]" 1
943 1 40 PHE QD 1 41 PRO HD2 . . 3.760 2.506 2.232 3.058 . 0 0 "[ . 1 . 2]" 1
944 1 40 PHE QD 1 41 PRO HD3 . . 4.130 3.606 2.530 4.199 0.069 5 0 "[ . 1 . 2]" 1
945 1 40 PHE QD 1 53 LEU QD . . 3.950 2.875 2.539 3.437 . 0 0 "[ . 1 . 2]" 1
946 1 40 PHE QD 1 53 LEU HG . . 5.080 4.424 3.132 5.179 0.099 4 0 "[ . 1 . 2]" 1
947 1 40 PHE QD 1 56 LEU H . . 3.020 1.882 1.715 2.124 . 0 0 "[ . 1 . 2]" 1
948 1 40 PHE QD 1 57 PRO HD3 . . 4.490 3.977 3.600 4.511 0.021 4 0 "[ . 1 . 2]" 1
949 1 40 PHE QD 1 62 CYS HA . . 5.320 4.778 4.255 5.391 0.071 13 0 "[ . 1 . 2]" 1
950 1 40 PHE QD 1 63 VAL H . . 5.500 4.325 3.496 5.101 . 0 0 "[ . 1 . 2]" 1
951 1 40 PHE QD 1 63 VAL QG . . 4.980 3.622 2.813 4.403 . 0 0 "[ . 1 . 2]" 1
952 1 40 PHE QD 1 93 LEU QD . . 5.020 3.818 3.306 4.620 . 0 0 "[ . 1 . 2]" 1
953 1 40 PHE QE 1 53 LEU QD . . 4.500 3.817 3.479 4.235 . 0 0 "[ . 1 . 2]" 1
954 1 40 PHE QE 1 55 TYR HA . . 4.000 3.121 2.544 3.971 . 0 0 "[ . 1 . 2]" 1
955 1 40 PHE QE 1 56 LEU H . . 4.280 3.057 2.481 3.497 . 0 0 "[ . 1 . 2]" 1
956 1 40 PHE QE 1 57 PRO HA . . 4.230 3.227 2.686 3.744 . 0 0 "[ . 1 . 2]" 1
957 1 40 PHE QE 1 57 PRO HD2 . . 4.240 4.080 3.876 4.332 0.092 4 0 "[ . 1 . 2]" 1
958 1 40 PHE QE 1 57 PRO HD3 . . 3.860 2.461 2.262 2.769 . 0 0 "[ . 1 . 2]" 1
959 1 40 PHE QE 1 57 PRO HG3 . . 4.460 3.981 3.332 4.452 . 0 0 "[ . 1 . 2]" 1
960 1 40 PHE QE 1 58 GLY H . . 5.500 4.944 4.463 5.365 . 0 0 "[ . 1 . 2]" 1
961 1 40 PHE QE 1 93 LEU QD . . 3.820 2.344 1.959 3.225 . 0 0 "[ . 1 . 2]" 1
962 1 40 PHE QE 1 93 LEU HG . . 3.570 3.378 2.301 3.664 0.094 14 0 "[ . 1 . 2]" 1
963 1 40 PHE HZ 1 57 PRO HA . . 4.920 4.037 3.369 4.698 . 0 0 "[ . 1 . 2]" 1
964 1 40 PHE HZ 1 93 LEU HA . . 4.400 3.989 3.171 4.471 0.071 12 0 "[ . 1 . 2]" 1
965 1 40 PHE HZ 1 93 LEU HB2 . . 3.960 2.369 2.047 2.607 . 0 0 "[ . 1 . 2]" 1
966 1 40 PHE HZ 1 93 LEU QD . . 3.360 3.084 2.434 3.400 0.040 1 0 "[ . 1 . 2]" 1
967 1 40 PHE HZ 1 93 LEU HG . . 3.980 3.885 3.168 4.071 0.091 9 0 "[ . 1 . 2]" 1
968 1 40 PHE HZ 1 94 GLN H . . 5.500 3.848 2.817 4.484 . 0 0 "[ . 1 . 2]" 1
969 1 41 PRO HA 1 42 LEU H . . 3.290 2.304 2.097 2.651 . 0 0 "[ . 1 . 2]" 1
970 1 41 PRO HA 1 43 VAL QG . . 5.500 3.694 3.021 4.256 . 0 0 "[ . 1 . 2]" 1
971 1 41 PRO HA 1 54 LEU QD . . 5.500 4.773 4.165 5.354 . 0 0 "[ . 1 . 2]" 1
972 1 41 PRO HA 1 60 GLY H . . 5.410 4.966 4.170 5.485 0.075 17 0 "[ . 1 . 2]" 1
973 1 41 PRO HA 1 60 GLY HA2 . . 4.610 3.647 2.507 4.375 . 0 0 "[ . 1 . 2]" 1
974 1 41 PRO HA 1 60 GLY HA3 . . 4.210 2.579 1.901 3.345 . 0 0 "[ . 1 . 2]" 1
975 1 41 PRO HA 1 61 HIS H . . 4.310 3.925 3.579 4.394 0.084 7 0 "[ . 1 . 2]" 1
976 1 41 PRO HA 1 129 TYR HB2 . . 5.290 4.782 3.932 5.357 0.067 13 0 "[ . 1 . 2]" 1
977 1 41 PRO HA 1 129 TYR HB3 . . 4.410 3.444 2.658 4.048 . 0 0 "[ . 1 . 2]" 1
978 1 41 PRO HA 1 129 TYR QD . . 5.370 3.231 2.745 4.161 . 0 0 "[ . 1 . 2]" 1
979 1 41 PRO HA 1 130 HIS H . . 5.500 4.842 4.396 5.535 0.035 10 0 "[ . 1 . 2]" 1
980 1 41 PRO HB2 1 42 LEU HA . . 4.600 4.647 4.313 4.689 0.089 7 0 "[ . 1 . 2]" 1
981 1 41 PRO HB2 1 54 LEU H . . 4.810 4.050 3.352 4.893 0.083 10 0 "[ . 1 . 2]" 1
982 1 41 PRO HB2 1 54 LEU HB2 . . 4.440 3.077 2.046 3.542 . 0 0 "[ . 1 . 2]" 1
983 1 41 PRO HB2 1 54 LEU HB3 . . 4.890 4.464 3.528 4.975 0.085 9 0 "[ . 1 . 2]" 1
984 1 41 PRO HB2 1 54 LEU QD . . 3.610 2.619 2.007 3.118 . 0 0 "[ . 1 . 2]" 1
985 1 41 PRO HB3 1 42 LEU H . . 4.620 4.441 4.070 4.643 0.023 8 0 "[ . 1 . 2]" 1
986 1 41 PRO HB3 1 54 LEU QD . . 4.580 3.706 2.815 4.371 . 0 0 "[ . 1 . 2]" 1
987 1 41 PRO HB3 1 60 GLY HA3 . . 5.300 3.881 2.779 4.594 . 0 0 "[ . 1 . 2]" 1
988 1 41 PRO HB3 1 129 TYR QD . . 5.000 3.956 3.472 5.068 0.068 9 0 "[ . 1 . 2]" 1
989 1 41 PRO HB3 1 129 TYR QE . . 5.000 3.129 2.068 4.620 . 0 0 "[ . 1 . 2]" 1
990 1 41 PRO HD2 1 53 LEU QD . . 5.500 3.525 2.567 4.403 . 0 0 "[ . 1 . 2]" 1
991 1 41 PRO HD2 1 54 LEU H . . 4.920 4.435 3.867 4.999 0.079 13 0 "[ . 1 . 2]" 1
992 1 41 PRO HD2 1 54 LEU HB2 . . 4.530 3.834 2.617 4.144 . 0 0 "[ . 1 . 2]" 1
993 1 41 PRO HD2 1 54 LEU QD . . 5.480 4.723 4.068 5.090 . 0 0 "[ . 1 . 2]" 1
994 1 41 PRO HD2 1 56 LEU H . . 4.270 2.571 2.272 3.114 . 0 0 "[ . 1 . 2]" 1
995 1 41 PRO HD2 1 56 LEU HB2 . . 4.200 3.523 3.035 3.832 . 0 0 "[ . 1 . 2]" 1
996 1 41 PRO HD2 1 56 LEU HB3 . . 4.090 3.138 2.747 3.902 . 0 0 "[ . 1 . 2]" 1
997 1 41 PRO HD2 1 59 LYS QB . . 5.420 4.268 3.652 5.334 . 0 0 "[ . 1 . 2]" 1
998 1 41 PRO HD3 1 42 LEU H . . 5.500 5.288 5.069 5.503 0.003 9 0 "[ . 1 . 2]" 1
999 1 41 PRO HD3 1 56 LEU H . . 4.910 3.582 2.430 3.987 . 0 0 "[ . 1 . 2]" 1
1000 1 41 PRO HD3 1 56 LEU HB2 . . 4.420 3.444 3.178 3.695 . 0 0 "[ . 1 . 2]" 1
1001 1 41 PRO HD3 1 56 LEU HB3 . . 4.220 2.344 2.095 2.721 . 0 0 "[ . 1 . 2]" 1
1002 1 41 PRO HD3 1 56 LEU QD . . 5.150 3.821 3.081 4.204 . 0 0 "[ . 1 . 2]" 1
1003 1 41 PRO HD3 1 59 LYS H . . 5.110 3.523 2.936 4.032 . 0 0 "[ . 1 . 2]" 1
1004 1 41 PRO HD3 1 59 LYS QB . . 4.410 2.747 2.148 3.734 . 0 0 "[ . 1 . 2]" 1
1005 1 41 PRO HG2 1 54 LEU QD . . 4.650 3.131 2.484 3.590 . 0 0 "[ . 1 . 2]" 1
1006 1 41 PRO HG3 1 43 VAL QG . . 5.500 4.798 4.297 5.230 . 0 0 "[ . 1 . 2]" 1
1007 1 41 PRO HG3 1 54 LEU QD . . 5.500 3.508 2.868 4.580 . 0 0 "[ . 1 . 2]" 1
1008 1 42 LEU H 1 42 LEU HB2 . . 3.930 2.664 2.317 3.183 . 0 0 "[ . 1 . 2]" 1
1009 1 42 LEU H 1 42 LEU HB3 . . 3.840 2.568 2.149 3.024 . 0 0 "[ . 1 . 2]" 1
1010 1 42 LEU H 1 42 LEU QD . . 5.060 3.835 3.749 3.922 . 0 0 "[ . 1 . 2]" 1
1011 1 42 LEU H 1 43 VAL H . . 5.130 4.317 3.963 4.554 . 0 0 "[ . 1 . 2]" 1
1012 1 42 LEU H 1 43 VAL QG . . 5.500 3.764 2.984 4.313 . 0 0 "[ . 1 . 2]" 1
1013 1 42 LEU H 1 53 LEU QD . . 5.500 3.657 3.062 4.324 . 0 0 "[ . 1 . 2]" 1
1014 1 42 LEU H 1 129 TYR HA . . 4.890 3.801 3.319 4.700 . 0 0 "[ . 1 . 2]" 1
1015 1 42 LEU H 1 129 TYR HB2 . . 5.440 4.828 4.101 5.414 . 0 0 "[ . 1 . 2]" 1
1016 1 42 LEU H 1 129 TYR HB3 . . 4.690 3.117 2.359 3.693 . 0 0 "[ . 1 . 2]" 1
1017 1 42 LEU H 1 129 TYR QD . . 5.280 3.655 2.860 5.107 . 0 0 "[ . 1 . 2]" 1
1018 1 42 LEU H 1 130 HIS H . . 4.370 3.241 2.738 3.927 . 0 0 "[ . 1 . 2]" 1
1019 1 42 LEU HA 1 42 LEU QD . . 3.290 2.187 1.968 2.689 . 0 0 "[ . 1 . 2]" 1
1020 1 42 LEU HA 1 43 VAL H . . 2.950 2.272 2.096 2.511 . 0 0 "[ . 1 . 2]" 1
1021 1 42 LEU HA 1 52 TRP H . . 5.110 4.614 4.187 5.069 . 0 0 "[ . 1 . 2]" 1
1022 1 42 LEU HA 1 53 LEU HA . . 3.640 2.681 1.913 3.252 . 0 0 "[ . 1 . 2]" 1
1023 1 42 LEU HA 1 53 LEU HB2 . . 4.920 4.403 3.719 4.995 0.075 13 0 "[ . 1 . 2]" 1
1024 1 42 LEU HA 1 53 LEU QD . . 3.870 2.637 2.095 3.320 . 0 0 "[ . 1 . 2]" 1
1025 1 42 LEU HA 1 53 LEU HG . . 5.330 4.313 3.425 5.132 . 0 0 "[ . 1 . 2]" 1
1026 1 42 LEU HA 1 54 LEU H . . 4.250 3.940 3.334 4.346 0.096 10 0 "[ . 1 . 2]" 1
1027 1 42 LEU HB2 1 43 VAL H . . 5.020 4.597 4.309 4.872 . 0 0 "[ . 1 . 2]" 1
1028 1 42 LEU HB2 1 53 LEU HA . . 5.500 4.356 3.205 5.148 . 0 0 "[ . 1 . 2]" 1
1029 1 42 LEU HB2 1 53 LEU QD . . 4.670 2.740 2.137 3.511 . 0 0 "[ . 1 . 2]" 1
1030 1 42 LEU HB2 1 130 HIS H . . 5.310 4.071 3.558 4.799 . 0 0 "[ . 1 . 2]" 1
1031 1 42 LEU HB3 1 43 VAL H . . 5.080 4.422 4.083 4.858 . 0 0 "[ . 1 . 2]" 1
1032 1 42 LEU HB3 1 53 LEU QD . . 4.480 4.007 3.560 4.647 0.167 5 0 "[ . 1 . 2]" 1
1033 1 42 LEU HB3 1 63 VAL QG . . 4.060 3.280 2.614 4.385 0.325 14 0 "[ . 1 . 2]" 1
1034 1 42 LEU HB3 1 129 TYR HA . . 5.180 4.214 3.751 4.906 . 0 0 "[ . 1 . 2]" 1
1035 1 42 LEU HB3 1 130 HIS H . . 4.030 2.580 2.088 3.384 . 0 0 "[ . 1 . 2]" 1
1036 1 42 LEU QD 1 43 VAL H . . 3.400 2.823 2.167 3.439 0.039 18 0 "[ . 1 . 2]" 1
1037 1 42 LEU QD 1 51 PRO HA . . 4.430 3.823 3.080 4.357 . 0 0 "[ . 1 . 2]" 1
1038 1 42 LEU QD 1 51 PRO HB2 . . 4.680 2.262 1.968 2.986 . 0 0 "[ . 1 . 2]" 1
1039 1 42 LEU QD 1 52 TRP H . . 3.820 3.390 2.743 3.886 0.066 9 0 "[ . 1 . 2]" 1
1040 1 42 LEU QD 1 53 LEU HA . . 3.820 3.137 2.161 3.826 0.006 18 0 "[ . 1 . 2]" 1
1041 1 42 LEU QD 1 53 LEU HB2 . . 5.500 3.282 2.494 5.172 . 0 0 "[ . 1 . 2]" 1
1042 1 42 LEU QD 1 53 LEU QD . . 3.220 2.747 1.990 3.109 . 0 0 "[ . 1 . 2]" 1
1043 1 42 LEU QD 1 53 LEU HG . . 5.380 3.835 2.088 5.202 . 0 0 "[ . 1 . 2]" 1
1044 1 42 LEU QD 1 54 LEU H . . 5.320 4.708 4.030 5.269 . 0 0 "[ . 1 . 2]" 1
1045 1 42 LEU QD 1 63 VAL HA . . 4.840 3.977 3.484 4.702 . 0 0 "[ . 1 . 2]" 1
1046 1 42 LEU QD 1 63 VAL HB . . 5.500 4.149 3.127 4.549 . 0 0 "[ . 1 . 2]" 1
1047 1 42 LEU QD 1 63 VAL QG . . 3.200 2.046 1.847 2.357 . 0 0 "[ . 1 . 2]" 1
1048 1 42 LEU QD 1 130 HIS H . . 4.710 3.632 3.247 4.364 . 0 0 "[ . 1 . 2]" 1
1049 1 42 LEU QD 1 130 HIS HB2 . . 3.250 2.399 2.031 2.929 . 0 0 "[ . 1 . 2]" 1
1050 1 42 LEU QD 1 130 HIS HB3 . . 3.820 3.265 2.827 3.782 . 0 0 "[ . 1 . 2]" 1
1051 1 42 LEU QD 1 130 HIS HD2 . . 4.860 3.962 2.925 4.484 . 0 0 "[ . 1 . 2]" 1
1052 1 42 LEU QD 1 131 GLU H . . 5.500 4.217 3.401 4.920 . 0 0 "[ . 1 . 2]" 1
1053 1 42 LEU QD 1 131 GLU HA . . 5.500 3.981 3.020 4.788 . 0 0 "[ . 1 . 2]" 1
1054 1 42 LEU QD 1 132 SER H . . 4.380 3.358 2.936 4.098 . 0 0 "[ . 1 . 2]" 1
1055 1 42 LEU QD 1 132 SER HA . . 3.390 3.298 3.021 3.445 0.055 20 0 "[ . 1 . 2]" 1
1056 1 42 LEU QD 1 133 TYR H . . 4.180 3.669 3.061 4.189 0.009 20 0 "[ . 1 . 2]" 1
1057 1 42 LEU QD 1 133 TYR HA . . 5.340 3.662 3.213 3.976 . 0 0 "[ . 1 . 2]" 1
1058 1 42 LEU QD 1 133 TYR QB . . 4.390 2.475 2.006 3.256 . 0 0 "[ . 1 . 2]" 1
1059 1 42 LEU QD 1 133 TYR QD . . 4.960 3.352 1.936 4.051 . 0 0 "[ . 1 . 2]" 1
1060 1 42 LEU QD 1 134 ASP H . . 5.500 5.268 4.751 5.448 . 0 0 "[ . 1 . 2]" 1
1061 1 43 VAL H 1 43 VAL QG . . 3.200 2.158 1.952 2.407 . 0 0 "[ . 1 . 2]" 1
1062 1 43 VAL H 1 44 ILE H . . 4.600 4.423 4.183 4.567 . 0 0 "[ . 1 . 2]" 1
1063 1 43 VAL H 1 51 PRO HA . . 4.710 4.601 4.331 4.793 0.083 12 0 "[ . 1 . 2]" 1
1064 1 43 VAL H 1 52 TRP H . . 3.900 3.217 2.908 3.666 . 0 0 "[ . 1 . 2]" 1
1065 1 43 VAL H 1 52 TRP HB2 . . 4.500 4.066 3.586 4.564 0.064 9 0 "[ . 1 . 2]" 1
1066 1 43 VAL H 1 53 LEU HA . . 4.410 3.796 3.472 4.258 . 0 0 "[ . 1 . 2]" 1
1067 1 43 VAL H 1 53 LEU QD . . 5.420 4.381 3.873 4.945 . 0 0 "[ . 1 . 2]" 1
1068 1 43 VAL H 1 54 LEU H . . 5.500 4.314 3.499 4.895 . 0 0 "[ . 1 . 2]" 1
1069 1 43 VAL H 1 54 LEU QD . . 4.750 3.601 2.705 4.406 . 0 0 "[ . 1 . 2]" 1
1070 1 43 VAL H 1 130 HIS HD2 . . 5.500 5.053 4.704 5.484 . 0 0 "[ . 1 . 2]" 1
1071 1 43 VAL HA 1 44 ILE H . . 3.190 2.266 2.108 2.539 . 0 0 "[ . 1 . 2]" 1
1072 1 43 VAL HA 1 44 ILE HG13 . . 5.150 3.715 3.241 4.631 . 0 0 "[ . 1 . 2]" 1
1073 1 43 VAL HA 1 127 LEU QD . . 5.260 4.161 3.856 4.677 . 0 0 "[ . 1 . 2]" 1
1074 1 43 VAL HA 1 129 TYR HA . . 4.750 3.370 2.691 3.789 . 0 0 "[ . 1 . 2]" 1
1075 1 43 VAL HA 1 129 TYR QD . . 5.420 3.797 2.985 4.747 . 0 0 "[ . 1 . 2]" 1
1076 1 43 VAL HA 1 130 HIS H . . 4.580 4.558 4.219 4.658 0.078 2 0 "[ . 1 . 2]" 1
1077 1 43 VAL HA 1 130 HIS HD2 . . 3.120 2.905 2.347 3.199 0.079 20 0 "[ . 1 . 2]" 1
1078 1 43 VAL HB 1 44 ILE H . . 3.590 3.089 2.463 3.685 0.095 18 0 "[ . 1 . 2]" 1
1079 1 43 VAL HB 1 45 ALA MB . . 4.420 3.899 3.266 4.360 . 0 0 "[ . 1 . 2]" 1
1080 1 43 VAL HB 1 54 LEU QD . . 5.500 3.976 2.307 4.944 . 0 0 "[ . 1 . 2]" 1
1081 1 43 VAL HB 1 127 LEU HB3 . . 4.490 3.234 2.437 4.804 0.314 7 0 "[ . 1 . 2]" 1
1082 1 43 VAL HB 1 127 LEU QD . . 3.550 2.733 2.057 3.642 0.092 18 0 "[ . 1 . 2]" 1
1083 1 43 VAL QG 1 44 ILE H . . 4.230 3.239 2.080 3.576 . 0 0 "[ . 1 . 2]" 1
1084 1 43 VAL QG 1 45 ALA H . . 5.010 4.086 3.401 4.777 . 0 0 "[ . 1 . 2]" 1
1085 1 43 VAL QG 1 45 ALA MB . . 3.600 3.008 2.505 3.610 0.010 11 0 "[ . 1 . 2]" 1
1086 1 43 VAL QG 1 52 TRP H . . 4.130 3.260 2.711 3.988 . 0 0 "[ . 1 . 2]" 1
1087 1 43 VAL QG 1 52 TRP HB2 . . 4.020 2.937 2.317 3.725 . 0 0 "[ . 1 . 2]" 1
1088 1 43 VAL QG 1 52 TRP HD1 . . 3.630 3.545 2.999 3.711 0.081 10 0 "[ . 1 . 2]" 1
1089 1 43 VAL QG 1 54 LEU QD . . 3.270 2.046 1.697 2.613 . 0 0 "[ . 1 . 2]" 1
1090 1 43 VAL QG 1 124 TRP HA . . 4.440 3.392 2.897 3.715 . 0 0 "[ . 1 . 2]" 1
1091 1 43 VAL QG 1 124 TRP HB2 . . 4.100 3.679 3.304 3.946 . 0 0 "[ . 1 . 2]" 1
1092 1 43 VAL QG 1 124 TRP HB3 . . 3.540 2.326 2.106 2.539 . 0 0 "[ . 1 . 2]" 1
1093 1 43 VAL QG 1 124 TRP HE3 . . 3.580 3.588 3.331 3.663 0.083 13 0 "[ . 1 . 2]" 1
1094 1 43 VAL QG 1 124 TRP HZ3 . . 5.500 4.984 4.626 5.309 . 0 0 "[ . 1 . 2]" 1
1095 1 43 VAL QG 1 127 LEU H . . 4.400 3.611 3.097 4.238 . 0 0 "[ . 1 . 2]" 1
1096 1 43 VAL QG 1 127 LEU HB2 . . 3.640 2.250 2.037 2.450 . 0 0 "[ . 1 . 2]" 1
1097 1 43 VAL QG 1 127 LEU HB3 . . 3.930 2.916 1.862 3.661 . 0 0 "[ . 1 . 2]" 1
1098 1 43 VAL QG 1 129 TYR HA . . 4.140 2.879 2.167 3.230 . 0 0 "[ . 1 . 2]" 1
1099 1 43 VAL QG 1 129 TYR HB2 . . 4.900 4.831 4.472 4.927 0.027 8 0 "[ . 1 . 2]" 1
1100 1 43 VAL QG 1 129 TYR HB3 . . 5.360 4.232 3.869 4.535 . 0 0 "[ . 1 . 2]" 1
1101 1 43 VAL QG 1 129 TYR QD . . 2.830 2.047 1.931 2.178 . 0 0 "[ . 1 . 2]" 1
1102 1 43 VAL QG 1 129 TYR QE . . 3.050 2.352 2.022 3.086 0.036 11 0 "[ . 1 . 2]" 1
1103 1 43 VAL QG 1 130 HIS H . . 4.910 4.412 3.832 4.684 . 0 0 "[ . 1 . 2]" 1
1104 1 43 VAL QG 1 130 HIS HD2 . . 5.410 3.995 3.130 4.424 . 0 0 "[ . 1 . 2]" 1
1105 1 44 ILE H 1 44 ILE HB . . 3.620 2.654 2.506 3.022 . 0 0 "[ . 1 . 2]" 1
1106 1 44 ILE H 1 44 ILE MD . . 4.810 3.783 2.501 4.491 . 0 0 "[ . 1 . 2]" 1
1107 1 44 ILE H 1 44 ILE HG12 . . 4.880 3.723 3.147 4.288 . 0 0 "[ . 1 . 2]" 1
1108 1 44 ILE H 1 44 ILE HG13 . . 4.430 2.705 2.202 3.690 . 0 0 "[ . 1 . 2]" 1
1109 1 44 ILE H 1 44 ILE MG . . 4.770 3.874 3.786 4.048 . 0 0 "[ . 1 . 2]" 1
1110 1 44 ILE H 1 45 ALA H . . 5.500 4.231 3.617 4.546 . 0 0 "[ . 1 . 2]" 1
1111 1 44 ILE H 1 45 ALA MB . . 5.500 4.495 3.922 4.930 . 0 0 "[ . 1 . 2]" 1
1112 1 44 ILE H 1 127 LEU QD . . 4.970 3.377 2.672 4.126 . 0 0 "[ . 1 . 2]" 1
1113 1 44 ILE H 1 129 TYR HA . . 5.500 5.238 4.876 5.568 0.068 14 0 "[ . 1 . 2]" 1
1114 1 44 ILE H 1 130 HIS HD2 . . 3.880 3.688 2.997 3.962 0.082 18 0 "[ . 1 . 2]" 1
1115 1 44 ILE H 1 141 LEU QD . . 5.500 4.564 3.581 5.196 . 0 0 "[ . 1 . 2]" 1
1116 1 44 ILE HA 1 44 ILE MD . . 4.510 3.801 3.038 3.941 . 0 0 "[ . 1 . 2]" 1
1117 1 44 ILE HA 1 44 ILE HG12 . . 4.180 2.694 2.460 3.530 . 0 0 "[ . 1 . 2]" 1
1118 1 44 ILE HA 1 44 ILE MG . . 3.450 2.337 2.213 2.473 . 0 0 "[ . 1 . 2]" 1
1119 1 44 ILE HA 1 45 ALA H . . 3.010 2.197 2.071 2.285 . 0 0 "[ . 1 . 2]" 1
1120 1 44 ILE HA 1 45 ALA MB . . 4.630 4.032 3.786 4.212 . 0 0 "[ . 1 . 2]" 1
1121 1 44 ILE HA 1 50 ILE H . . 5.310 4.654 4.095 5.118 . 0 0 "[ . 1 . 2]" 1
1122 1 44 ILE HA 1 51 PRO HA . . 3.490 2.044 1.894 2.226 . 0 0 "[ . 1 . 2]" 1
1123 1 44 ILE HA 1 51 PRO HB2 . . 5.390 4.170 3.416 4.856 . 0 0 "[ . 1 . 2]" 1
1124 1 44 ILE HA 1 52 TRP H . . 4.170 3.471 3.005 3.923 . 0 0 "[ . 1 . 2]" 1
1125 1 44 ILE HA 1 52 TRP HD1 . . 4.630 4.015 3.168 4.569 . 0 0 "[ . 1 . 2]" 1
1126 1 44 ILE HB 1 44 ILE MD . . 3.540 2.483 2.208 3.124 . 0 0 "[ . 1 . 2]" 1
1127 1 44 ILE HB 1 45 ALA H . . 5.170 4.372 4.105 4.529 . 0 0 "[ . 1 . 2]" 1
1128 1 44 ILE HB 1 141 LEU QD . . 3.860 2.650 2.069 3.281 . 0 0 "[ . 1 . 2]" 1
1129 1 44 ILE MD 1 44 ILE MG . . 3.420 2.214 1.959 3.260 . 0 0 "[ . 1 . 2]" 1
1130 1 44 ILE MD 1 51 PRO HA . . 5.500 4.595 3.539 5.288 . 0 0 "[ . 1 . 2]" 1
1131 1 44 ILE MD 1 130 HIS HD2 . . 4.380 3.685 2.796 4.481 0.101 14 0 "[ . 1 . 2]" 1
1132 1 44 ILE MD 1 133 TYR HA . . 5.470 4.340 3.410 5.215 . 0 0 "[ . 1 . 2]" 1
1133 1 44 ILE MD 1 133 TYR QD . . 3.760 3.297 2.527 3.896 0.136 5 0 "[ . 1 . 2]" 1
1134 1 44 ILE MD 1 134 ASP H . . 5.500 4.995 4.011 5.587 0.087 1 0 "[ . 1 . 2]" 1
1135 1 44 ILE MD 1 139 HIS HB2 . . 5.000 4.116 2.627 5.054 0.054 11 0 "[ . 1 . 2]" 1
1136 1 44 ILE MD 1 139 HIS HD2 . . 5.040 4.658 3.515 5.131 0.091 19 0 "[ . 1 . 2]" 1
1137 1 44 ILE MD 1 141 LEU HB2 . . 4.230 4.029 3.413 4.324 0.094 3 0 "[ . 1 . 2]" 1
1138 1 44 ILE MD 1 141 LEU HB3 . . 5.500 5.099 4.679 5.414 . 0 0 "[ . 1 . 2]" 1
1139 1 44 ILE MD 1 141 LEU QD . . 3.920 1.979 1.860 2.138 . 0 0 "[ . 1 . 2]" 1
1140 1 44 ILE HG12 1 51 PRO HA . . 4.610 3.375 2.321 4.402 . 0 0 "[ . 1 . 2]" 1
1141 1 44 ILE HG12 1 51 PRO HB2 . . 4.050 3.767 2.934 4.963 0.913 11 1 "[ . 1+ . 2]" 1
1142 1 44 ILE HG12 1 133 TYR QD . . 4.880 4.262 3.215 5.195 0.315 11 0 "[ . 1 . 2]" 1
1143 1 44 ILE HG13 1 51 PRO HA . . 5.060 4.187 2.132 5.115 0.055 15 0 "[ . 1 . 2]" 1
1144 1 44 ILE MG 1 45 ALA H . . 3.760 3.059 2.527 3.722 . 0 0 "[ . 1 . 2]" 1
1145 1 44 ILE MG 1 45 ALA HA . . 4.740 3.927 3.527 4.392 . 0 0 "[ . 1 . 2]" 1
1146 1 44 ILE MG 1 45 ALA MB . . 5.500 4.447 4.182 4.765 . 0 0 "[ . 1 . 2]" 1
1147 1 44 ILE MG 1 46 GLY H . . 5.440 5.307 4.909 5.534 0.094 19 0 "[ . 1 . 2]" 1
1148 1 44 ILE MG 1 49 ASN H . . 4.410 4.332 3.968 4.518 0.108 17 0 "[ . 1 . 2]" 1
1149 1 44 ILE MG 1 49 ASN HA . . 3.520 2.544 2.147 2.773 . 0 0 "[ . 1 . 2]" 1
1150 1 44 ILE MG 1 49 ASN HB2 . . 4.230 4.026 3.476 4.325 0.095 10 0 "[ . 1 . 2]" 1
1151 1 44 ILE MG 1 49 ASN HB3 . . 3.690 2.729 2.126 3.189 . 0 0 "[ . 1 . 2]" 1
1152 1 44 ILE MG 1 50 ILE H . . 4.570 3.390 2.823 3.852 . 0 0 "[ . 1 . 2]" 1
1153 1 44 ILE MG 1 50 ILE HA . . 4.850 4.376 3.929 4.914 0.064 20 0 "[ . 1 . 2]" 1
1154 1 44 ILE MG 1 50 ILE MG . . 5.500 5.232 4.751 5.633 0.133 20 0 "[ . 1 . 2]" 1
1155 1 44 ILE MG 1 51 PRO HA . . 4.770 3.274 2.684 3.690 . 0 0 "[ . 1 . 2]" 1
1156 1 44 ILE MG 1 52 TRP H . . 5.500 5.032 4.436 5.494 . 0 0 "[ . 1 . 2]" 1
1157 1 44 ILE MG 1 52 TRP HD1 . . 5.500 5.180 4.574 5.593 0.093 7 0 "[ . 1 . 2]" 1
1158 1 44 ILE MG 1 141 LEU HA . . 5.500 4.918 4.267 5.517 0.017 3 0 "[ . 1 . 2]" 1
1159 1 44 ILE MG 1 141 LEU HB2 . . 3.650 2.917 2.175 3.654 0.004 3 0 "[ . 1 . 2]" 1
1160 1 44 ILE MG 1 141 LEU HB3 . . 4.400 4.231 3.271 4.513 0.113 14 0 "[ . 1 . 2]" 1
1161 1 44 ILE MG 1 141 LEU QD . . 3.250 2.138 1.933 2.448 . 0 0 "[ . 1 . 2]" 1
1162 1 44 ILE MG 1 141 LEU HG . . 4.860 4.243 2.306 4.842 . 0 0 "[ . 1 . 2]" 1
1163 1 45 ALA H 1 45 ALA MB . . 3.580 2.546 2.304 2.699 . 0 0 "[ . 1 . 2]" 1
1164 1 45 ALA H 1 49 ASN HA . . 4.860 4.521 3.991 4.916 0.056 2 0 "[ . 1 . 2]" 1
1165 1 45 ALA H 1 50 ILE H . . 4.150 3.680 2.976 4.236 0.086 20 0 "[ . 1 . 2]" 1
1166 1 45 ALA H 1 51 PRO HA . . 4.170 2.961 2.162 3.798 . 0 0 "[ . 1 . 2]" 1
1167 1 45 ALA H 1 52 TRP H . . 4.860 3.899 3.356 4.537 . 0 0 "[ . 1 . 2]" 1
1168 1 45 ALA H 1 52 TRP HB2 . . 5.500 5.078 4.002 5.559 0.059 16 0 "[ . 1 . 2]" 1
1169 1 45 ALA H 1 52 TRP HD1 . . 3.610 2.793 2.249 3.199 . 0 0 "[ . 1 . 2]" 1
1170 1 45 ALA H 1 127 LEU QD . . 5.400 4.238 3.458 4.832 . 0 0 "[ . 1 . 2]" 1
1171 1 45 ALA HA 1 46 GLY H . . 2.930 2.425 2.189 2.749 . 0 0 "[ . 1 . 2]" 1
1172 1 45 ALA HA 1 124 TRP HE1 . . 4.670 4.725 4.551 4.750 0.080 18 0 "[ . 1 . 2]" 1
1173 1 45 ALA HA 1 127 LEU QD . . 3.990 3.018 2.289 3.437 . 0 0 "[ . 1 . 2]" 1
1174 1 45 ALA MB 1 46 GLY H . . 3.310 2.283 1.943 3.129 . 0 0 "[ . 1 . 2]" 1
1175 1 45 ALA MB 1 46 GLY HA2 . . 4.920 3.829 3.561 4.367 . 0 0 "[ . 1 . 2]" 1
1176 1 45 ALA MB 1 52 TRP H . . 5.440 4.427 4.064 5.063 . 0 0 "[ . 1 . 2]" 1
1177 1 45 ALA MB 1 52 TRP HB2 . . 5.150 4.163 3.667 4.564 . 0 0 "[ . 1 . 2]" 1
1178 1 45 ALA MB 1 52 TRP HD1 . . 3.090 2.367 2.176 2.716 . 0 0 "[ . 1 . 2]" 1
1179 1 45 ALA MB 1 52 TRP HE1 . . 3.720 2.832 2.454 3.779 0.059 15 0 "[ . 1 . 2]" 1
1180 1 45 ALA MB 1 54 LEU QD . . 5.500 4.282 3.780 4.609 . 0 0 "[ . 1 . 2]" 1
1181 1 45 ALA MB 1 124 TRP HB2 . . 5.370 4.698 3.835 5.165 . 0 0 "[ . 1 . 2]" 1
1182 1 45 ALA MB 1 124 TRP HB3 . . 4.640 3.736 2.644 4.285 . 0 0 "[ . 1 . 2]" 1
1183 1 45 ALA MB 1 124 TRP HD1 . . 3.940 3.430 2.640 3.997 0.057 12 0 "[ . 1 . 2]" 1
1184 1 45 ALA MB 1 124 TRP HE1 . . 4.210 2.651 2.369 2.885 . 0 0 "[ . 1 . 2]" 1
1185 1 45 ALA MB 1 124 TRP HE3 . . 4.240 3.889 3.463 4.301 0.061 1 0 "[ . 1 . 2]" 1
1186 1 45 ALA MB 1 124 TRP HH2 . . 4.250 3.863 3.200 4.349 0.099 13 0 "[ . 1 . 2]" 1
1187 1 45 ALA MB 1 124 TRP HZ2 . . 3.620 3.059 2.481 3.642 0.022 20 0 "[ . 1 . 2]" 1
1188 1 45 ALA MB 1 124 TRP HZ3 . . 4.500 4.189 3.496 4.584 0.084 2 0 "[ . 1 . 2]" 1
1189 1 45 ALA MB 1 127 LEU QD . . 3.240 2.379 1.952 2.790 . 0 0 "[ . 1 . 2]" 1
1190 1 45 ALA MB 1 127 LEU HG . . 5.500 4.227 2.364 5.106 . 0 0 "[ . 1 . 2]" 1
1191 1 46 GLY H 1 47 GLU H . . 4.710 4.368 4.082 4.626 . 0 0 "[ . 1 . 2]" 1
1192 1 46 GLY H 1 124 TRP HE1 . . 4.610 3.916 3.437 4.584 . 0 0 "[ . 1 . 2]" 1
1193 1 46 GLY H 1 124 TRP HZ2 . . 4.610 4.067 3.351 4.637 0.027 20 0 "[ . 1 . 2]" 1
1194 1 46 GLY H 1 127 LEU QD . . 4.830 4.346 3.845 4.749 . 0 0 "[ . 1 . 2]" 1
1195 1 46 GLY HA2 1 47 GLU H . . 3.240 2.447 2.210 2.846 . 0 0 "[ . 1 . 2]" 1
1196 1 46 GLY HA2 1 124 TRP HE1 . . 5.110 4.938 3.972 5.198 0.088 4 0 "[ . 1 . 2]" 1
1197 1 46 GLY HA2 1 124 TRP HZ2 . . 3.970 4.016 3.764 4.054 0.084 18 0 "[ . 1 . 2]" 1
1198 1 46 GLY HA3 1 47 GLU H . . 3.410 2.742 2.358 3.046 . 0 0 "[ . 1 . 2]" 1
1199 1 46 GLY HA3 1 47 GLU HA . . 4.700 4.688 4.572 4.774 0.074 15 0 "[ . 1 . 2]" 1
1200 1 46 GLY HA3 1 48 HIS H . . 4.820 3.460 3.139 3.906 . 0 0 "[ . 1 . 2]" 1
1201 1 46 GLY HA3 1 52 TRP HE1 . . 5.090 3.561 3.204 4.159 . 0 0 "[ . 1 . 2]" 1
1202 1 46 GLY HA3 1 52 TRP HZ2 . . 4.850 4.760 4.211 4.932 0.082 12 0 "[ . 1 . 2]" 1
1203 1 46 GLY HA3 1 124 TRP HZ2 . . 4.960 4.384 3.874 4.759 . 0 0 "[ . 1 . 2]" 1
1204 1 47 GLU H 1 47 GLU HB2 . . 3.290 2.266 2.052 2.556 . 0 0 "[ . 1 . 2]" 1
1205 1 47 GLU H 1 47 GLU HB3 . . 3.580 2.802 2.445 3.527 . 0 0 "[ . 1 . 2]" 1
1206 1 47 GLU H 1 48 HIS H . . 3.780 2.699 2.271 2.985 . 0 0 "[ . 1 . 2]" 1
1207 1 47 GLU H 1 49 ASN H . . 5.120 4.369 4.034 4.947 . 0 0 "[ . 1 . 2]" 1
1208 1 47 GLU HA 1 47 GLU HB2 . . 2.950 2.682 2.531 3.024 0.074 17 0 "[ . 1 . 2]" 1
1209 1 47 GLU HA 1 48 HIS HA . . 4.450 4.527 4.460 4.544 0.094 12 0 "[ . 1 . 2]" 1
1210 1 47 GLU HA 1 49 ASN H . . 4.320 3.764 3.499 4.140 . 0 0 "[ . 1 . 2]" 1
1211 1 47 GLU HB2 1 48 HIS H . . 4.290 4.029 3.089 4.302 0.012 13 0 "[ . 1 . 2]" 1
1212 1 47 GLU HB3 1 48 HIS H . . 4.470 3.443 3.117 4.007 . 0 0 "[ . 1 . 2]" 1
1213 1 47 GLU HB3 1 48 HIS HA . . 4.630 4.471 3.646 4.709 0.079 7 0 "[ . 1 . 2]" 1
1214 1 47 GLU HB3 1 48 HIS HD2 . . 5.380 3.341 2.366 4.522 . 0 0 "[ . 1 . 2]" 1
1215 1 48 HIS H 1 48 HIS QB . . 3.570 2.389 2.203 2.719 . 0 0 "[ . 1 . 2]" 1
1216 1 48 HIS H 1 48 HIS HD2 . . 4.140 3.625 3.150 4.193 0.053 19 0 "[ . 1 . 2]" 1
1217 1 48 HIS H 1 49 ASN H . . 3.170 2.401 2.200 2.650 . 0 0 "[ . 1 . 2]" 1
1218 1 48 HIS H 1 49 ASN HA . . 4.470 4.413 4.115 4.549 0.079 10 0 "[ . 1 . 2]" 1
1219 1 48 HIS H 1 50 ILE H . . 4.100 3.911 3.532 4.164 0.064 20 0 "[ . 1 . 2]" 1
1220 1 48 HIS H 1 50 ILE MD . . 4.900 3.330 2.302 3.725 . 0 0 "[ . 1 . 2]" 1
1221 1 48 HIS H 1 50 ILE HG12 . . 5.320 4.941 3.992 5.378 0.058 3 0 "[ . 1 . 2]" 1
1222 1 48 HIS HA 1 49 ASN HA . . 5.010 5.016 4.871 5.081 0.071 15 0 "[ . 1 . 2]" 1
1223 1 48 HIS HA 1 50 ILE HG13 . . 5.320 4.436 4.137 4.684 . 0 0 "[ . 1 . 2]" 1
1224 1 48 HIS HA 1 144 ASN H . . 4.290 4.075 3.744 4.372 0.082 12 0 "[ . 1 . 2]" 1
1225 1 48 HIS HA 1 144 ASN QB . . 3.930 2.953 2.170 3.533 . 0 0 "[ . 1 . 2]" 1
1226 1 48 HIS HA 1 144 ASN HD21 . . 4.980 4.329 2.321 5.055 0.075 4 0 "[ . 1 . 2]" 1
1227 1 48 HIS QB 1 48 HIS HD2 . . 3.610 2.625 2.534 3.265 . 0 0 "[ . 1 . 2]" 1
1228 1 48 HIS QB 1 49 ASN H . . 4.710 3.677 3.512 3.895 . 0 0 "[ . 1 . 2]" 1
1229 1 48 HIS QB 1 50 ILE H . . 5.170 4.444 3.997 4.734 . 0 0 "[ . 1 . 2]" 1
1230 1 48 HIS QB 1 50 ILE HB . . 4.870 4.428 3.942 4.736 . 0 0 "[ . 1 . 2]" 1
1231 1 48 HIS QB 1 50 ILE MD . . 3.570 2.200 2.027 2.468 . 0 0 "[ . 1 . 2]" 1
1232 1 48 HIS QB 1 50 ILE HG12 . . 4.410 3.277 2.789 3.806 . 0 0 "[ . 1 . 2]" 1
1233 1 48 HIS QB 1 50 ILE HG13 . . 4.720 2.459 1.980 2.763 . 0 0 "[ . 1 . 2]" 1
1234 1 48 HIS QB 1 50 ILE MG . . 5.500 4.574 4.243 4.804 . 0 0 "[ . 1 . 2]" 1
1235 1 48 HIS QB 1 144 ASN QB . . 5.320 3.563 2.686 4.297 . 0 0 "[ . 1 . 2]" 1
1236 1 48 HIS HD2 1 50 ILE MD . . 4.520 3.840 2.531 4.626 0.106 18 0 "[ . 1 . 2]" 1
1237 1 49 ASN H 1 49 ASN HA . . 2.940 2.226 2.169 2.302 . 0 0 "[ . 1 . 2]" 1
1238 1 49 ASN H 1 50 ILE H . . 3.650 2.948 2.730 3.122 . 0 0 "[ . 1 . 2]" 1
1239 1 49 ASN H 1 50 ILE HB . . 5.190 4.828 4.672 5.128 . 0 0 "[ . 1 . 2]" 1
1240 1 49 ASN H 1 50 ILE MD . . 5.190 4.561 3.436 4.901 . 0 0 "[ . 1 . 2]" 1
1241 1 49 ASN HA 1 50 ILE H . . 3.490 2.382 2.253 2.492 . 0 0 "[ . 1 . 2]" 1
1242 1 49 ASN HA 1 50 ILE HB . . 5.320 4.910 4.606 5.104 . 0 0 "[ . 1 . 2]" 1
1243 1 49 ASN HA 1 141 LEU QD . . 5.500 4.454 3.179 5.114 . 0 0 "[ . 1 . 2]" 1
1244 1 49 ASN HB2 1 143 TYR HA . . 3.860 2.434 2.054 3.072 . 0 0 "[ . 1 . 2]" 1
1245 1 49 ASN HB3 1 50 ILE H . . 5.460 4.306 4.130 4.465 . 0 0 "[ . 1 . 2]" 1
1246 1 49 ASN HB3 1 141 LEU QD . . 4.540 3.770 3.197 4.291 . 0 0 "[ . 1 . 2]" 1
1247 1 49 ASN HB3 1 142 ARG HA . . 3.820 3.603 2.693 3.899 0.079 10 0 "[ . 1 . 2]" 1
1248 1 49 ASN HB3 1 143 TYR HA . . 4.710 3.633 3.316 4.297 . 0 0 "[ . 1 . 2]" 1
1249 1 49 ASN HB3 1 144 ASN H . . 5.500 5.090 4.205 5.571 0.071 5 0 "[ . 1 . 2]" 1
1250 1 49 ASN HD21 1 141 LEU HA . . 4.530 3.056 2.429 3.662 . 0 0 "[ . 1 . 2]" 1
1251 1 49 ASN HD21 1 141 LEU HB3 . . 4.590 3.502 2.208 4.639 0.049 3 0 "[ . 1 . 2]" 1
1252 1 49 ASN HD21 1 142 ARG H . . 4.670 3.705 2.483 4.748 0.078 19 0 "[ . 1 . 2]" 1
1253 1 49 ASN HD21 1 142 ARG HA . . 5.500 4.775 3.718 5.569 0.069 11 0 "[ . 1 . 2]" 1
1254 1 49 ASN HD22 1 141 LEU HA . . 4.390 2.842 2.481 3.358 . 0 0 "[ . 1 . 2]" 1
1255 1 49 ASN HD22 1 141 LEU HB2 . . 5.350 3.140 2.711 3.926 . 0 0 "[ . 1 . 2]" 1
1256 1 49 ASN HD22 1 141 LEU HB3 . . 4.300 3.151 2.515 4.222 . 0 0 "[ . 1 . 2]" 1
1257 1 49 ASN HD22 1 141 LEU QD . . 5.500 4.156 3.687 4.985 . 0 0 "[ . 1 . 2]" 1
1258 1 49 ASN HD22 1 141 LEU HG . . 5.500 5.414 4.962 6.056 0.556 12 1 "[ . 1 + . 2]" 1
1259 1 49 ASN HD22 1 142 ARG H . . 4.580 4.114 3.283 4.658 0.078 4 0 "[ . 1 . 2]" 1
1260 1 50 ILE H 1 50 ILE HB . . 3.290 2.551 2.400 2.717 . 0 0 "[ . 1 . 2]" 1
1261 1 50 ILE H 1 50 ILE MD . . 3.860 3.841 2.906 3.966 0.106 9 0 "[ . 1 . 2]" 1
1262 1 50 ILE H 1 50 ILE HG12 . . 4.140 3.951 3.686 4.196 0.056 7 0 "[ . 1 . 2]" 1
1263 1 50 ILE H 1 50 ILE HG13 . . 4.560 2.784 2.501 3.009 . 0 0 "[ . 1 . 2]" 1
1264 1 50 ILE H 1 50 ILE MG . . 4.020 3.805 3.732 3.870 . 0 0 "[ . 1 . 2]" 1
1265 1 50 ILE HA 1 50 ILE MD . . 4.180 3.872 3.783 3.960 . 0 0 "[ . 1 . 2]" 1
1266 1 50 ILE HA 1 50 ILE HG12 . . 4.190 2.588 2.368 3.146 . 0 0 "[ . 1 . 2]" 1
1267 1 50 ILE HA 1 50 ILE HG13 . . 4.090 2.952 2.747 3.144 . 0 0 "[ . 1 . 2]" 1
1268 1 50 ILE HA 1 50 ILE MG . . 3.680 2.383 2.281 2.496 . 0 0 "[ . 1 . 2]" 1
1269 1 50 ILE HA 1 143 TYR QD . . 3.480 3.217 2.646 3.564 0.084 1 0 "[ . 1 . 2]" 1
1270 1 50 ILE HA 1 143 TYR QE . . 4.900 4.091 3.823 4.529 . 0 0 "[ . 1 . 2]" 1
1271 1 50 ILE HB 1 50 ILE MD . . 3.350 2.380 2.212 2.495 . 0 0 "[ . 1 . 2]" 1
1272 1 50 ILE HB 1 52 TRP HE1 . . 3.630 2.791 2.372 3.459 . 0 0 "[ . 1 . 2]" 1
1273 1 50 ILE HB 1 52 TRP HZ2 . . 3.710 3.636 3.074 3.792 0.082 6 0 "[ . 1 . 2]" 1
1274 1 50 ILE MD 1 50 ILE MG . . 3.300 2.110 2.040 2.558 . 0 0 "[ . 1 . 2]" 1
1275 1 50 ILE MD 1 52 TRP HE1 . . 4.760 4.148 3.306 4.626 . 0 0 "[ . 1 . 2]" 1
1276 1 50 ILE MD 1 52 TRP HH2 . . 4.950 4.649 3.761 5.031 0.081 17 0 "[ . 1 . 2]" 1
1277 1 50 ILE MD 1 52 TRP HZ2 . . 3.960 3.401 2.490 3.902 . 0 0 "[ . 1 . 2]" 1
1278 1 50 ILE MD 1 87 MET ME . . 3.590 3.351 2.571 3.694 0.104 9 0 "[ . 1 . 2]" 1
1279 1 50 ILE MD 1 143 TYR QD . . 4.570 4.324 3.741 4.675 0.105 6 0 "[ . 1 . 2]" 1
1280 1 50 ILE MD 1 143 TYR QE . . 4.120 3.042 2.480 3.676 . 0 0 "[ . 1 . 2]" 1
1281 1 50 ILE HG12 1 143 TYR QD . . 3.300 3.058 2.403 3.348 0.048 20 0 "[ . 1 . 2]" 1
1282 1 50 ILE HG12 1 143 TYR QE . . 3.300 2.232 2.109 2.453 . 0 0 "[ . 1 . 2]" 1
1283 1 50 ILE HG12 1 144 ASN H . . 5.500 5.206 4.661 5.577 0.077 5 0 "[ . 1 . 2]" 1
1284 1 50 ILE HG13 1 143 TYR QD . . 4.210 3.411 2.781 4.004 . 0 0 "[ . 1 . 2]" 1
1285 1 50 ILE HG13 1 143 TYR QE . . 3.250 3.186 2.553 3.346 0.096 5 0 "[ . 1 . 2]" 1
1286 1 50 ILE MG 1 52 TRP H . . 5.500 4.844 4.356 5.316 . 0 0 "[ . 1 . 2]" 1
1287 1 50 ILE MG 1 52 TRP HA . . 5.400 4.250 3.897 4.517 . 0 0 "[ . 1 . 2]" 1
1288 1 50 ILE MG 1 52 TRP HE1 . . 4.330 3.187 2.768 4.094 . 0 0 "[ . 1 . 2]" 1
1289 1 50 ILE MG 1 52 TRP HH2 . . 4.420 3.870 3.036 4.247 . 0 0 "[ . 1 . 2]" 1
1290 1 50 ILE MG 1 52 TRP HZ2 . . 3.720 2.955 2.580 3.642 . 0 0 "[ . 1 . 2]" 1
1291 1 50 ILE MG 1 87 MET ME . . 4.080 3.004 2.205 3.503 . 0 0 "[ . 1 . 2]" 1
1292 1 50 ILE MG 1 88 TYR QE . . 4.130 3.307 2.942 3.847 . 0 0 "[ . 1 . 2]" 1
1293 1 50 ILE MG 1 143 TYR QD . . 4.350 4.299 3.595 4.465 0.115 11 0 "[ . 1 . 2]" 1
1294 1 50 ILE MG 1 143 TYR QE . . 3.820 3.854 3.572 3.941 0.121 19 0 "[ . 1 . 2]" 1
1295 1 51 PRO HA 1 52 TRP H . . 3.110 2.211 2.070 2.361 . 0 0 "[ . 1 . 2]" 1
1296 1 51 PRO HA 1 52 TRP HD1 . . 4.330 3.452 2.887 4.204 . 0 0 "[ . 1 . 2]" 1
1297 1 51 PRO HB2 1 52 TRP H . . 4.190 3.335 2.757 4.063 . 0 0 "[ . 1 . 2]" 1
1298 1 51 PRO HB2 1 133 TYR QB . . 5.380 4.268 3.356 5.228 . 0 0 "[ . 1 . 2]" 1
1299 1 52 TRP H 1 52 TRP HB2 . . 3.670 2.657 2.411 2.877 . 0 0 "[ . 1 . 2]" 1
1300 1 52 TRP H 1 52 TRP HD1 . . 3.510 2.825 2.526 3.189 . 0 0 "[ . 1 . 2]" 1
1301 1 52 TRP H 1 53 LEU H . . 4.580 4.384 4.105 4.596 0.016 19 0 "[ . 1 . 2]" 1
1302 1 52 TRP H 1 53 LEU HA . . 4.970 4.781 4.498 5.035 0.065 19 0 "[ . 1 . 2]" 1
1303 1 52 TRP H 1 54 LEU QD . . 5.500 4.148 3.804 5.004 . 0 0 "[ . 1 . 2]" 1
1304 1 52 TRP HA 1 53 LEU H . . 3.200 2.327 2.146 2.748 . 0 0 "[ . 1 . 2]" 1
1305 1 52 TRP HA 1 88 TYR QE . . 3.860 2.343 2.034 2.729 . 0 0 "[ . 1 . 2]" 1
1306 1 52 TRP HA 1 117 THR MG . . 5.500 3.756 3.075 4.379 . 0 0 "[ . 1 . 2]" 1
1307 1 52 TRP HB2 1 52 TRP HD1 . . 3.430 2.707 2.539 2.867 . 0 0 "[ . 1 . 2]" 1
1308 1 52 TRP HB2 1 53 LEU H . . 4.410 3.956 3.094 4.454 0.044 18 0 "[ . 1 . 2]" 1
1309 1 52 TRP HB2 1 54 LEU QD . . 3.340 2.381 2.069 2.952 . 0 0 "[ . 1 . 2]" 1
1310 1 52 TRP HB2 1 117 THR MG . . 3.430 3.462 3.089 3.523 0.093 17 0 "[ . 1 . 2]" 1
1311 1 52 TRP HB2 1 124 TRP HZ3 . . 4.240 3.739 3.347 4.236 . 0 0 "[ . 1 . 2]" 1
1312 1 52 TRP HE1 1 124 TRP HH2 . . 5.270 3.262 2.878 3.654 . 0 0 "[ . 1 . 2]" 1
1313 1 52 TRP HE1 1 124 TRP HZ3 . . 5.500 4.186 3.879 4.575 . 0 0 "[ . 1 . 2]" 1
1314 1 52 TRP HE3 1 53 LEU H . . 4.680 4.210 3.542 4.752 0.072 10 0 "[ . 1 . 2]" 1
1315 1 52 TRP HE3 1 54 LEU QD . . 4.690 4.220 3.689 4.507 . 0 0 "[ . 1 . 2]" 1
1316 1 52 TRP HE3 1 88 TYR QD . . 4.020 3.433 3.022 3.821 . 0 0 "[ . 1 . 2]" 1
1317 1 52 TRP HE3 1 88 TYR QE . . 3.420 2.896 2.545 3.399 . 0 0 "[ . 1 . 2]" 1
1318 1 52 TRP HE3 1 117 THR HB . . 4.360 3.006 2.697 3.497 . 0 0 "[ . 1 . 2]" 1
1319 1 52 TRP HE3 1 117 THR MG . . 3.470 2.276 2.076 2.440 . 0 0 "[ . 1 . 2]" 1
1320 1 52 TRP HH2 1 87 MET HA . . 4.710 3.304 2.604 3.951 . 0 0 "[ . 1 . 2]" 1
1321 1 52 TRP HH2 1 87 MET QB . . 3.960 2.336 2.192 2.460 . 0 0 "[ . 1 . 2]" 1
1322 1 52 TRP HH2 1 87 MET ME . . 3.890 2.626 2.127 3.627 . 0 0 "[ . 1 . 2]" 1
1323 1 52 TRP HH2 1 87 MET QG . . 3.640 2.646 2.100 3.242 . 0 0 "[ . 1 . 2]" 1
1324 1 52 TRP HZ2 1 87 MET QB . . 4.680 4.599 4.485 4.642 . 0 0 "[ . 1 . 2]" 1
1325 1 52 TRP HZ2 1 87 MET ME . . 4.530 3.779 3.157 4.614 0.084 15 0 "[ . 1 . 2]" 1
1326 1 52 TRP HZ2 1 124 TRP HH2 . . 3.740 3.254 2.876 3.502 . 0 0 "[ . 1 . 2]" 1
1327 1 52 TRP HZ2 1 124 TRP HZ3 . . 4.750 4.708 4.376 4.828 0.078 9 0 "[ . 1 . 2]" 1
1328 1 52 TRP HZ3 1 87 MET HA . . 4.340 3.310 2.848 3.640 . 0 0 "[ . 1 . 2]" 1
1329 1 52 TRP HZ3 1 87 MET QB . . 4.350 2.348 2.062 2.700 . 0 0 "[ . 1 . 2]" 1
1330 1 52 TRP HZ3 1 87 MET ME . . 4.980 3.551 3.137 4.279 . 0 0 "[ . 1 . 2]" 1
1331 1 52 TRP HZ3 1 87 MET QG . . 4.430 4.025 3.588 4.296 . 0 0 "[ . 1 . 2]" 1
1332 1 52 TRP HZ3 1 88 TYR QE . . 3.820 3.635 3.344 3.904 0.084 16 0 "[ . 1 . 2]" 1
1333 1 52 TRP HZ3 1 117 THR MG . . 3.950 3.881 3.485 4.044 0.094 19 0 "[ . 1 . 2]" 1
1334 1 53 LEU H 1 53 LEU HB2 . . 3.810 2.672 2.175 3.324 . 0 0 "[ . 1 . 2]" 1
1335 1 53 LEU H 1 53 LEU HB3 . . 3.830 2.765 2.250 3.348 . 0 0 "[ . 1 . 2]" 1
1336 1 53 LEU H 1 53 LEU HG . . 5.500 4.418 3.400 4.760 . 0 0 "[ . 1 . 2]" 1
1337 1 53 LEU H 1 54 LEU H . . 5.030 3.804 2.106 4.366 . 0 0 "[ . 1 . 2]" 1
1338 1 53 LEU H 1 54 LEU QD . . 5.500 3.735 2.942 4.233 . 0 0 "[ . 1 . 2]" 1
1339 1 53 LEU H 1 88 TYR QE . . 4.320 2.690 2.418 3.127 . 0 0 "[ . 1 . 2]" 1
1340 1 53 LEU H 1 116 THR HA . . 4.850 3.680 3.100 4.175 . 0 0 "[ . 1 . 2]" 1
1341 1 53 LEU H 1 116 THR HB . . 5.480 5.389 4.446 5.569 0.089 17 0 "[ . 1 . 2]" 1
1342 1 53 LEU H 1 117 THR H . . 5.020 4.498 3.874 5.082 0.062 4 0 "[ . 1 . 2]" 1
1343 1 53 LEU H 1 117 THR MG . . 5.500 3.234 2.162 4.058 . 0 0 "[ . 1 . 2]" 1
1344 1 53 LEU HA 1 53 LEU QD . . 3.260 2.138 1.977 2.328 . 0 0 "[ . 1 . 2]" 1
1345 1 53 LEU HA 1 53 LEU HG . . 3.990 2.844 2.406 3.507 . 0 0 "[ . 1 . 2]" 1
1346 1 53 LEU HA 1 54 LEU H . . 3.110 2.281 1.989 3.030 . 0 0 "[ . 1 . 2]" 1
1347 1 53 LEU HA 1 54 LEU HB2 . . 4.780 4.658 4.124 4.876 0.096 11 0 "[ . 1 . 2]" 1
1348 1 53 LEU HA 1 54 LEU QD . . 5.500 3.584 2.648 4.504 . 0 0 "[ . 1 . 2]" 1
1349 1 53 LEU HA 1 88 TYR QE . . 5.500 5.470 5.016 5.615 0.115 13 0 "[ . 1 . 2]" 1
1350 1 53 LEU HB3 1 54 LEU H . . 4.980 4.179 2.652 4.584 . 0 0 "[ . 1 . 2]" 1
1351 1 53 LEU HB3 1 116 THR HA . . 3.790 2.787 2.213 3.650 . 0 0 "[ . 1 . 2]" 1
1352 1 53 LEU HB3 1 116 THR HB . . 5.090 4.086 3.058 5.119 0.029 17 0 "[ . 1 . 2]" 1
1353 1 53 LEU HB3 1 116 THR MG . . 4.010 2.748 2.084 3.738 . 0 0 "[ . 1 . 2]" 1
1354 1 53 LEU HB3 1 117 THR H . . 5.440 4.444 3.798 5.084 . 0 0 "[ . 1 . 2]" 1
1355 1 53 LEU QD 1 55 TYR HA . . 5.490 3.850 3.220 4.390 . 0 0 "[ . 1 . 2]" 1
1356 1 53 LEU QD 1 55 TYR QD . . 4.340 4.117 3.789 4.372 0.032 12 0 "[ . 1 . 2]" 1
1357 1 53 LEU QD 1 56 LEU H . . 5.500 4.189 3.584 5.005 . 0 0 "[ . 1 . 2]" 1
1358 1 53 LEU QD 1 63 VAL HB . . 4.300 3.675 2.921 4.115 . 0 0 "[ . 1 . 2]" 1
1359 1 53 LEU QD 1 63 VAL QG . . 3.410 2.359 1.931 2.931 . 0 0 "[ . 1 . 2]" 1
1360 1 53 LEU QD 1 114 VAL HB . . 5.410 3.866 2.971 4.315 . 0 0 "[ . 1 . 2]" 1
1361 1 53 LEU QD 1 114 VAL QG . . 3.640 2.212 1.884 3.478 . 0 0 "[ . 1 . 2]" 1
1362 1 53 LEU QD 1 116 THR HA . . 4.280 3.577 3.104 4.219 . 0 0 "[ . 1 . 2]" 1
1363 1 53 LEU QD 1 116 THR HB . . 4.360 3.847 3.140 4.360 . 15 0 "[ . 1 . 2]" 1
1364 1 53 LEU QD 1 116 THR MG . . 3.080 2.116 1.886 2.592 . 0 0 "[ . 1 . 2]" 1
1365 1 53 LEU QD 1 117 THR H . . 5.370 4.750 4.281 5.202 . 0 0 "[ . 1 . 2]" 1
1366 1 53 LEU QD 1 117 THR MG . . 5.500 4.864 4.444 5.218 . 0 0 "[ . 1 . 2]" 1
1367 1 53 LEU HG 1 54 LEU H . . 4.510 4.192 3.021 4.628 0.118 10 0 "[ . 1 . 2]" 1
1368 1 54 LEU H 1 54 LEU HB2 . . 3.700 2.678 2.022 3.568 . 0 0 "[ . 1 . 2]" 1
1369 1 54 LEU H 1 54 LEU QD . . 3.920 2.344 1.856 3.096 . 0 0 "[ . 1 . 2]" 1
1370 1 54 LEU H 1 54 LEU HG . . 3.570 3.008 2.057 3.689 0.119 17 0 "[ . 1 . 2]" 1
1371 1 54 LEU H 1 117 THR MG . . 5.500 3.858 2.934 4.496 . 0 0 "[ . 1 . 2]" 1
1372 1 54 LEU HA 1 54 LEU QD . . 3.320 2.397 2.061 2.554 . 0 0 "[ . 1 . 2]" 1
1373 1 54 LEU HA 1 54 LEU HG . . 4.180 3.207 2.195 3.646 . 0 0 "[ . 1 . 2]" 1
1374 1 54 LEU HA 1 55 TYR H . . 3.130 2.305 2.151 2.903 . 0 0 "[ . 1 . 2]" 1
1375 1 54 LEU HA 1 117 THR H . . 3.720 2.819 2.324 3.573 . 0 0 "[ . 1 . 2]" 1
1376 1 54 LEU HA 1 117 THR MG . . 3.550 2.405 2.120 2.972 . 0 0 "[ . 1 . 2]" 1
1377 1 54 LEU HA 1 120 TYR QD . . 4.320 3.461 3.005 4.350 0.030 14 0 "[ . 1 . 2]" 1
1378 1 54 LEU HB2 1 54 LEU QD . . 3.230 2.237 2.053 2.368 . 0 0 "[ . 1 . 2]" 1
1379 1 54 LEU HB2 1 55 TYR H . . 4.940 3.975 2.910 4.679 . 0 0 "[ . 1 . 2]" 1
1380 1 54 LEU HB2 1 56 LEU H . . 5.230 4.484 3.911 5.288 0.058 13 0 "[ . 1 . 2]" 1
1381 1 54 LEU HB3 1 54 LEU QD . . 3.030 2.278 2.073 2.656 . 0 0 "[ . 1 . 2]" 1
1382 1 54 LEU HB3 1 55 TYR H . . 4.030 3.227 2.135 4.112 0.082 13 0 "[ . 1 . 2]" 1
1383 1 54 LEU HB3 1 117 THR MG . . 4.720 3.930 3.015 4.656 . 0 0 "[ . 1 . 2]" 1
1384 1 54 LEU HB3 1 120 TYR QD . . 5.380 3.338 2.639 4.340 . 0 0 "[ . 1 . 2]" 1
1385 1 54 LEU QD 1 55 TYR H . . 4.310 4.013 3.549 4.180 . 0 0 "[ . 1 . 2]" 1
1386 1 54 LEU QD 1 56 LEU HB3 . . 5.500 5.196 4.685 5.520 0.020 12 0 "[ . 1 . 2]" 1
1387 1 54 LEU QD 1 56 LEU QD . . 4.810 4.278 3.617 4.654 . 0 0 "[ . 1 . 2]" 1
1388 1 54 LEU QD 1 116 THR HA . . 5.500 5.215 4.484 5.498 . 0 0 "[ . 1 . 2]" 1
1389 1 54 LEU QD 1 117 THR H . . 4.800 4.011 3.398 4.467 . 0 0 "[ . 1 . 2]" 1
1390 1 54 LEU QD 1 117 THR MG . . 3.250 2.093 1.876 2.351 . 0 0 "[ . 1 . 2]" 1
1391 1 54 LEU QD 1 120 TYR H . . 5.120 4.097 3.648 4.708 . 0 0 "[ . 1 . 2]" 1
1392 1 54 LEU QD 1 120 TYR HA . . 5.030 3.904 3.429 4.747 . 0 0 "[ . 1 . 2]" 1
1393 1 54 LEU QD 1 120 TYR HB2 . . 4.260 2.549 2.129 3.021 . 0 0 "[ . 1 . 2]" 1
1394 1 54 LEU QD 1 120 TYR HB3 . . 3.620 2.241 1.984 3.198 . 0 0 "[ . 1 . 2]" 1
1395 1 54 LEU QD 1 120 TYR QD . . 3.330 2.689 2.401 3.253 . 0 0 "[ . 1 . 2]" 1
1396 1 54 LEU QD 1 124 TRP HB2 . . 4.370 2.974 2.301 3.740 . 0 0 "[ . 1 . 2]" 1
1397 1 54 LEU QD 1 124 TRP HB3 . . 4.180 2.614 2.249 3.269 . 0 0 "[ . 1 . 2]" 1
1398 1 54 LEU QD 1 124 TRP HE3 . . 3.250 2.324 2.072 2.671 . 0 0 "[ . 1 . 2]" 1
1399 1 54 LEU QD 1 124 TRP HZ3 . . 3.930 3.523 2.827 3.920 . 0 0 "[ . 1 . 2]" 1
1400 1 54 LEU QD 1 125 LEU H . . 5.140 4.340 3.583 4.955 . 0 0 "[ . 1 . 2]" 1
1401 1 54 LEU QD 1 125 LEU HA . . 4.030 3.451 2.851 4.066 0.036 10 0 "[ . 1 . 2]" 1
1402 1 54 LEU QD 1 125 LEU HB3 . . 5.500 5.069 4.472 5.476 . 0 0 "[ . 1 . 2]" 1
1403 1 54 LEU QD 1 125 LEU QD . . 3.300 2.456 1.969 2.735 . 0 0 "[ . 1 . 2]" 1
1404 1 54 LEU QD 1 125 LEU HG . . 5.300 4.289 3.133 5.297 . 0 0 "[ . 1 . 2]" 1
1405 1 54 LEU HG 1 55 TYR H . . 5.460 4.912 3.738 5.525 0.065 7 0 "[ . 1 . 2]" 1
1406 1 54 LEU HG 1 120 TYR QD . . 5.500 3.998 2.158 5.256 . 0 0 "[ . 1 . 2]" 1
1407 1 55 TYR H 1 55 TYR HB2 . . 3.490 2.559 2.379 3.181 . 0 0 "[ . 1 . 2]" 1
1408 1 55 TYR H 1 55 TYR HB3 . . 3.530 2.620 2.537 2.802 . 0 0 "[ . 1 . 2]" 1
1409 1 55 TYR H 1 55 TYR QD . . 4.890 4.238 4.154 4.407 . 0 0 "[ . 1 . 2]" 1
1410 1 55 TYR H 1 56 LEU H . . 4.710 4.119 3.851 4.332 . 0 0 "[ . 1 . 2]" 1
1411 1 55 TYR H 1 116 THR HB . . 4.420 3.266 2.883 4.142 . 0 0 "[ . 1 . 2]" 1
1412 1 55 TYR H 1 116 THR MG . . 5.500 4.355 3.565 5.248 . 0 0 "[ . 1 . 2]" 1
1413 1 55 TYR H 1 117 THR H . . 4.180 3.079 2.403 3.651 . 0 0 "[ . 1 . 2]" 1
1414 1 55 TYR H 1 117 THR MG . . 4.220 3.806 3.018 4.330 0.110 9 0 "[ . 1 . 2]" 1
1415 1 55 TYR H 1 118 ALA HA . . 4.320 3.501 3.175 3.892 . 0 0 "[ . 1 . 2]" 1
1416 1 55 TYR H 1 118 ALA MB . . 4.590 4.397 3.991 4.657 0.067 5 0 "[ . 1 . 2]" 1
1417 1 55 TYR H 1 120 TYR QD . . 4.230 3.899 3.573 4.292 0.062 14 0 "[ . 1 . 2]" 1
1418 1 55 TYR HA 1 55 TYR QD . . 2.950 2.361 2.092 3.014 0.064 9 0 "[ . 1 . 2]" 1
1419 1 55 TYR HA 1 56 LEU H . . 3.100 2.290 2.227 2.366 . 0 0 "[ . 1 . 2]" 1
1420 1 55 TYR HA 1 116 THR MG . . 5.280 3.182 2.623 3.606 . 0 0 "[ . 1 . 2]" 1
1421 1 55 TYR HB2 1 56 LEU H . . 5.160 4.629 4.549 4.711 . 0 0 "[ . 1 . 2]" 1
1422 1 55 TYR HB2 1 91 THR MG . . 5.500 3.871 3.565 4.157 . 0 0 "[ . 1 . 2]" 1
1423 1 55 TYR HB2 1 116 THR HB . . 3.930 2.350 1.971 2.532 . 0 0 "[ . 1 . 2]" 1
1424 1 55 TYR HB2 1 116 THR MG . . 4.520 3.149 2.319 3.520 . 0 0 "[ . 1 . 2]" 1
1425 1 55 TYR HB2 1 117 THR H . . 4.680 3.579 2.865 4.060 . 0 0 "[ . 1 . 2]" 1
1426 1 55 TYR HB2 1 118 ALA HA . . 4.360 4.392 4.289 4.436 0.076 3 0 "[ . 1 . 2]" 1
1427 1 55 TYR HB2 1 118 ALA MB . . 4.130 4.031 3.675 4.206 0.076 5 0 "[ . 1 . 2]" 1
1428 1 55 TYR HB3 1 116 THR HB . . 4.370 3.984 3.576 4.186 . 0 0 "[ . 1 . 2]" 1
1429 1 55 TYR HB3 1 116 THR MG . . 5.260 4.555 3.788 4.928 . 0 0 "[ . 1 . 2]" 1
1430 1 55 TYR HB3 1 117 THR H . . 4.910 4.699 3.998 4.979 0.069 9 0 "[ . 1 . 2]" 1
1431 1 55 TYR HB3 1 118 ALA H . . 5.500 5.359 4.930 5.569 0.069 11 0 "[ . 1 . 2]" 1
1432 1 55 TYR HB3 1 118 ALA HA . . 4.050 3.606 3.337 3.910 . 0 0 "[ . 1 . 2]" 1
1433 1 55 TYR HB3 1 118 ALA MB . . 3.610 3.434 3.012 3.678 0.068 18 0 "[ . 1 . 2]" 1
1434 1 55 TYR QD 1 56 LEU H . . 4.130 4.032 3.479 4.219 0.089 9 0 "[ . 1 . 2]" 1
1435 1 55 TYR QD 1 57 PRO HD2 . . 4.970 4.601 3.260 5.057 0.087 12 0 "[ . 1 . 2]" 1
1436 1 55 TYR QD 1 57 PRO HD3 . . 4.020 3.766 2.820 4.105 0.085 8 0 "[ . 1 . 2]" 1
1437 1 55 TYR QD 1 91 THR HB . . 5.370 3.777 2.429 4.478 . 0 0 "[ . 1 . 2]" 1
1438 1 55 TYR QD 1 91 THR MG . . 3.200 3.082 2.602 3.299 0.099 11 0 "[ . 1 . 2]" 1
1439 1 55 TYR QD 1 116 THR HB . . 3.530 3.429 3.233 3.638 0.108 15 0 "[ . 1 . 2]" 1
1440 1 55 TYR QD 1 116 THR MG . . 3.070 2.253 2.000 2.954 . 0 0 "[ . 1 . 2]" 1
1441 1 55 TYR QD 1 117 THR H . . 5.500 5.270 4.821 5.587 0.087 12 0 "[ . 1 . 2]" 1
1442 1 55 TYR QD 1 118 ALA MB . . 4.250 4.092 3.109 4.361 0.111 9 0 "[ . 1 . 2]" 1
1443 1 55 TYR QE 1 57 PRO HD2 . . 5.500 4.660 3.412 5.568 0.068 11 0 "[ . 1 . 2]" 1
1444 1 55 TYR QE 1 57 PRO HG3 . . 4.880 4.049 2.561 4.974 0.094 1 0 "[ . 1 . 2]" 1
1445 1 55 TYR QE 1 91 THR HB . . 4.050 3.844 3.269 4.132 0.082 14 0 "[ . 1 . 2]" 1
1446 1 55 TYR QE 1 91 THR MG . . 2.730 2.635 2.363 2.831 0.101 7 0 "[ . 1 . 2]" 1
1447 1 55 TYR QE 1 92 ALA H . . 4.860 4.760 4.367 4.952 0.092 13 0 "[ . 1 . 2]" 1
1448 1 55 TYR QE 1 116 THR MG . . 5.250 3.758 3.244 4.578 . 0 0 "[ . 1 . 2]" 1
1449 1 56 LEU H 1 56 LEU HB2 . . 3.920 2.947 2.733 3.144 . 0 0 "[ . 1 . 2]" 1
1450 1 56 LEU H 1 56 LEU HB3 . . 3.670 3.258 2.880 3.512 . 0 0 "[ . 1 . 2]" 1
1451 1 56 LEU H 1 56 LEU QD . . 5.070 3.954 3.772 4.163 . 0 0 "[ . 1 . 2]" 1
1452 1 56 LEU H 1 57 PRO HD2 . . 4.820 4.227 3.939 4.348 . 0 0 "[ . 1 . 2]" 1
1453 1 56 LEU H 1 57 PRO HD3 . . 4.710 3.538 3.218 3.855 . 0 0 "[ . 1 . 2]" 1
1454 1 56 LEU HA 1 56 LEU QD . . 3.260 2.282 1.918 2.853 . 0 0 "[ . 1 . 2]" 1
1455 1 56 LEU HA 1 57 PRO HD2 . . 3.120 2.076 1.978 2.151 . 0 0 "[ . 1 . 2]" 1
1456 1 56 LEU HA 1 57 PRO HD3 . . 3.310 2.805 2.613 3.038 . 0 0 "[ . 1 . 2]" 1
1457 1 56 LEU HA 1 57 PRO HG2 . . 5.190 4.250 4.133 4.373 . 0 0 "[ . 1 . 2]" 1
1458 1 56 LEU HA 1 57 PRO HG3 . . 4.780 4.656 4.540 4.767 . 0 0 "[ . 1 . 2]" 1
1459 1 56 LEU HB2 1 56 LEU QD . . 2.680 2.223 2.088 2.585 . 0 0 "[ . 1 . 2]" 1
1460 1 56 LEU HB2 1 59 LYS H . . 5.360 5.497 5.172 6.029 0.669 17 3 "[ *. 1 - . + 2]" 1
1461 1 56 LEU HB2 1 125 LEU QD . . 5.500 4.431 3.537 4.986 . 0 0 "[ . 1 . 2]" 1
1462 1 56 LEU HB3 1 56 LEU QD . . 3.070 2.313 1.978 2.647 . 0 0 "[ . 1 . 2]" 1
1463 1 56 LEU HB3 1 57 PRO HD2 . . 5.350 4.653 4.365 4.856 . 0 0 "[ . 1 . 2]" 1
1464 1 56 LEU QD 1 57 PRO HA . . 5.290 4.595 4.129 5.139 . 0 0 "[ . 1 . 2]" 1
1465 1 56 LEU QD 1 57 PRO HD2 . . 4.410 2.986 2.037 3.950 . 0 0 "[ . 1 . 2]" 1
1466 1 56 LEU QD 1 57 PRO HD3 . . 5.350 4.102 3.458 4.820 . 0 0 "[ . 1 . 2]" 1
1467 1 56 LEU QD 1 59 LYS H . . 4.510 3.511 2.998 4.171 . 0 0 "[ . 1 . 2]" 1
1468 1 56 LEU QD 1 59 LYS HE2 . . 4.790 2.923 1.804 4.685 . 0 0 "[ . 1 . 2]" 1
1469 1 56 LEU QD 1 59 LYS HE3 . . 4.660 3.402 2.185 4.032 . 0 0 "[ . 1 . 2]" 1
1470 1 56 LEU QD 1 59 LYS HG2 . . 4.690 2.931 2.106 3.875 . 0 0 "[ . 1 . 2]" 1
1471 1 56 LEU QD 1 125 LEU QD . . 3.240 3.115 2.541 3.292 0.052 13 0 "[ . 1 . 2]" 1
1472 1 57 PRO HA 1 58 GLY H . . 2.930 2.161 1.986 2.315 . 0 0 "[ . 1 . 2]" 1
1473 1 57 PRO HA 1 58 GLY HA2 . . 4.920 4.394 4.174 4.516 . 0 0 "[ . 1 . 2]" 1
1474 1 57 PRO HA 1 58 GLY HA3 . . 4.960 4.490 4.439 4.547 . 0 0 "[ . 1 . 2]" 1
1475 1 57 PRO HA 1 59 LYS H . . 3.660 3.652 3.494 3.741 0.081 17 0 "[ . 1 . 2]" 1
1476 1 57 PRO HB2 1 58 GLY H . . 4.460 3.547 3.184 3.882 . 0 0 "[ . 1 . 2]" 1
1477 1 57 PRO HB3 1 58 GLY H . . 4.590 3.979 3.623 4.230 . 0 0 "[ . 1 . 2]" 1
1478 1 58 GLY H 1 59 LYS H . . 3.150 2.588 2.128 2.968 . 0 0 "[ . 1 . 2]" 1
1479 1 58 GLY HA2 1 59 LYS QB . . 5.180 4.957 4.600 5.254 0.074 15 0 "[ . 1 . 2]" 1
1480 1 58 GLY HA3 1 59 LYS HA . . 5.170 4.676 4.596 4.777 . 0 0 "[ . 1 . 2]" 1
1481 1 58 GLY HA3 1 59 LYS QB . . 5.340 4.593 3.975 5.125 . 0 0 "[ . 1 . 2]" 1
1482 1 59 LYS H 1 59 LYS HB2 . . 3.180 2.838 2.263 3.361 0.181 4 0 "[ . 1 . 2]" 1
1483 1 59 LYS H 1 59 LYS QB . . 3.720 2.384 2.157 2.608 . 0 0 "[ . 1 . 2]" 1
1484 1 59 LYS H 1 59 LYS HD3 . . 5.070 4.682 2.828 6.054 0.984 20 4 "[ .* 1 * . - +]" 1
1485 1 59 LYS H 1 59 LYS HG3 . . 4.250 4.383 4.109 4.895 0.645 20 2 "[ . 1 - . +]" 1
1486 1 59 LYS H 1 60 GLY H . . 4.600 4.386 4.072 4.608 0.008 13 0 "[ . 1 . 2]" 1
1487 1 59 LYS HA 1 59 LYS HD2 . . 3.860 3.320 2.266 3.932 0.072 8 0 "[ . 1 . 2]" 1
1488 1 59 LYS HA 1 59 LYS HD3 . . 3.790 2.975 2.317 3.941 0.151 17 0 "[ . 1 . 2]" 1
1489 1 59 LYS HA 1 59 LYS HE2 . . 5.220 4.413 2.307 5.276 0.056 8 0 "[ . 1 . 2]" 1
1490 1 59 LYS HA 1 59 LYS HE3 . . 5.200 4.644 2.297 5.181 . 0 0 "[ . 1 . 2]" 1
1491 1 59 LYS HA 1 59 LYS HG2 . . 4.060 3.569 2.211 4.019 . 0 0 "[ . 1 . 2]" 1
1492 1 59 LYS HA 1 59 LYS HG3 . . 3.820 2.959 2.273 3.546 . 0 0 "[ . 1 . 2]" 1
1493 1 59 LYS HA 1 60 GLY H . . 2.980 2.354 2.125 2.521 . 0 0 "[ . 1 . 2]" 1
1494 1 59 LYS HA 1 60 GLY HA2 . . 5.090 4.557 4.397 4.684 . 0 0 "[ . 1 . 2]" 1
1495 1 59 LYS QB 1 59 LYS HE3 . . 5.100 3.366 2.342 4.376 . 0 0 "[ . 1 . 2]" 1
1496 1 59 LYS QB 1 60 GLY H . . 4.040 3.493 2.461 3.965 . 0 0 "[ . 1 . 2]" 1
1497 1 59 LYS QB 1 60 GLY HA3 . . 5.090 4.360 3.336 4.629 . 0 0 "[ . 1 . 2]" 1
1498 1 59 LYS QB 1 129 TYR QE . . 5.500 4.644 3.522 5.609 0.109 13 0 "[ . 1 . 2]" 1
1499 1 59 LYS HD2 1 60 GLY H . . 5.280 3.831 2.172 5.081 . 0 0 "[ . 1 . 2]" 1
1500 1 59 LYS HD3 1 60 GLY H . . 5.100 3.973 2.056 5.352 0.252 16 0 "[ . 1 . 2]" 1
1501 1 59 LYS HE2 1 59 LYS HG2 . . 4.080 2.939 2.341 3.748 . 0 0 "[ . 1 . 2]" 1
1502 1 59 LYS HE2 1 59 LYS HG3 . . 4.040 3.412 2.187 4.072 0.032 8 0 "[ . 1 . 2]" 1
1503 1 59 LYS HE3 1 59 LYS HG2 . . 4.140 2.763 2.042 3.928 . 0 0 "[ . 1 . 2]" 1
1504 1 59 LYS HE3 1 59 LYS HG3 . . 4.030 3.250 2.409 3.903 . 0 0 "[ . 1 . 2]" 1
1505 1 59 LYS HG2 1 60 GLY H . . 4.970 4.358 3.788 4.915 . 0 0 "[ . 1 . 2]" 1
1506 1 59 LYS HG2 1 129 TYR QE . . 5.410 4.686 3.122 5.559 0.149 12 0 "[ . 1 . 2]" 1
1507 1 59 LYS HG3 1 60 GLY H . . 5.190 3.336 2.288 5.050 . 0 0 "[ . 1 . 2]" 1
1508 1 59 LYS HG3 1 129 TYR QE . . 5.500 4.039 2.548 5.486 . 0 0 "[ . 1 . 2]" 1
1509 1 60 GLY H 1 61 HIS H . . 4.630 4.483 2.876 4.674 0.044 2 0 "[ . 1 . 2]" 1
1510 1 60 GLY H 1 129 TYR QD . . 3.920 3.775 3.030 4.011 0.091 13 0 "[ . 1 . 2]" 1
1511 1 60 GLY H 1 129 TYR QE . . 3.940 3.585 3.044 4.009 0.069 8 0 "[ . 1 . 2]" 1
1512 1 60 GLY HA2 1 61 HIS H . . 3.380 3.191 2.864 3.403 0.023 12 0 "[ . 1 . 2]" 1
1513 1 60 GLY HA2 1 129 TYR QD . . 3.330 2.263 2.063 2.637 . 0 0 "[ . 1 . 2]" 1
1514 1 60 GLY HA2 1 129 TYR QE . . 4.020 3.370 2.658 4.097 0.077 5 0 "[ . 1 . 2]" 1
1515 1 60 GLY HA3 1 61 HIS H . . 3.180 2.291 2.171 2.756 . 0 0 "[ . 1 . 2]" 1
1516 1 60 GLY HA3 1 129 TYR QD . . 3.770 3.517 2.699 3.833 0.063 9 0 "[ . 1 . 2]" 1
1517 1 60 GLY HA3 1 129 TYR QE . . 5.220 4.265 3.741 4.912 . 0 0 "[ . 1 . 2]" 1
1518 1 61 HIS H 1 61 HIS HB2 . . 3.800 2.872 2.516 3.856 0.056 7 0 "[ . 1 . 2]" 1
1519 1 61 HIS H 1 61 HIS HD2 . . 4.370 3.888 2.887 4.450 0.080 2 0 "[ . 1 . 2]" 1
1520 1 61 HIS H 1 62 CYS H . . 4.820 4.426 4.264 4.502 . 0 0 "[ . 1 . 2]" 1
1521 1 61 HIS H 1 63 VAL QG . . 5.220 4.144 3.438 5.242 0.022 7 0 "[ . 1 . 2]" 1
1522 1 61 HIS H 1 129 TYR HB3 . . 5.130 3.848 3.100 5.222 0.092 7 0 "[ . 1 . 2]" 1
1523 1 61 HIS HA 1 62 CYS H . . 3.010 2.497 2.315 2.655 . 0 0 "[ . 1 . 2]" 1
1524 1 61 HIS HA 1 62 CYS HB2 . . 5.200 5.052 4.650 6.061 0.861 3 3 "[ + . - * . 2]" 1
1525 1 61 HIS HB2 1 61 HIS HD2 . . 3.700 2.684 2.499 3.707 0.007 9 0 "[ . 1 . 2]" 1
1526 1 61 HIS HB2 1 62 CYS H . . 3.680 3.318 2.086 3.747 0.067 12 0 "[ . 1 . 2]" 1
1527 1 61 HIS HB2 1 63 VAL QG . . 4.560 4.154 3.219 4.542 . 0 0 "[ . 1 . 2]" 1
1528 1 61 HIS HB2 1 131 GLU HA . . 3.770 2.790 2.235 3.491 . 0 0 "[ . 1 . 2]" 1
1529 1 61 HIS HB2 1 131 GLU QG . . 4.400 2.686 1.893 3.559 . 0 0 "[ . 1 . 2]" 1
1530 1 61 HIS HB3 1 62 CYS H . . 3.170 2.366 2.055 3.251 0.081 9 0 "[ . 1 . 2]" 1
1531 1 61 HIS HB3 1 63 VAL QG . . 5.500 4.985 3.818 5.430 . 0 0 "[ . 1 . 2]" 1
1532 1 61 HIS HB3 1 131 GLU HA . . 4.130 3.463 2.206 4.065 . 0 0 "[ . 1 . 2]" 1
1533 1 61 HIS HB3 1 131 GLU HB2 . . 5.040 3.824 2.346 4.882 . 0 0 "[ . 1 . 2]" 1
1534 1 61 HIS HB3 1 131 GLU HB3 . . 5.160 4.672 3.805 5.255 0.095 9 0 "[ . 1 . 2]" 1
1535 1 61 HIS HB3 1 131 GLU QG . . 4.120 2.145 1.953 2.399 . 0 0 "[ . 1 . 2]" 1
1536 1 61 HIS HD2 1 129 TYR HA . . 4.730 4.514 3.992 4.797 0.067 5 0 "[ . 1 . 2]" 1
1537 1 61 HIS HD2 1 129 TYR HB2 . . 3.860 2.644 2.257 3.098 . 0 0 "[ . 1 . 2]" 1
1538 1 61 HIS HD2 1 129 TYR HB3 . . 3.600 2.726 2.216 3.155 . 0 0 "[ . 1 . 2]" 1
1539 1 61 HIS HD2 1 131 GLU HA . . 4.590 4.422 3.856 4.672 0.082 1 0 "[ . 1 . 2]" 1
1540 1 62 CYS H 1 62 CYS HB2 . . 3.260 2.670 2.398 3.659 0.399 3 0 "[ . 1 . 2]" 1
1541 1 62 CYS H 1 62 CYS HB3 . . 3.840 3.503 2.820 3.681 . 0 0 "[ . 1 . 2]" 1
1542 1 62 CYS H 1 63 VAL H . . 4.900 4.390 3.882 4.650 . 0 0 "[ . 1 . 2]" 1
1543 1 62 CYS H 1 63 VAL QG . . 5.500 4.719 4.272 5.020 . 0 0 "[ . 1 . 2]" 1
1544 1 62 CYS H 1 131 GLU QG . . 4.410 2.789 2.400 3.094 . 0 0 "[ . 1 . 2]" 1
1545 1 62 CYS HA 1 63 VAL H . . 3.080 2.200 2.118 2.417 . 0 0 "[ . 1 . 2]" 1
1546 1 62 CYS HA 1 63 VAL HB . . 4.600 4.607 4.308 4.687 0.087 16 0 "[ . 1 . 2]" 1
1547 1 62 CYS HA 1 63 VAL QG . . 4.930 3.541 3.147 3.871 . 0 0 "[ . 1 . 2]" 1
1548 1 62 CYS HA 1 131 GLU QG . . 4.770 4.497 3.788 4.690 . 0 0 "[ . 1 . 2]" 1
1549 1 62 CYS HB2 1 63 VAL H . . 4.530 4.081 2.307 4.529 . 0 0 "[ . 1 . 2]" 1
1550 1 62 CYS HB2 1 63 VAL HA . . 5.240 4.923 3.863 5.309 0.069 19 0 "[ . 1 . 2]" 1
1551 1 62 CYS HB2 1 131 GLU QG . . 4.750 3.556 2.873 4.096 . 0 0 "[ . 1 . 2]" 1
1552 1 62 CYS HB3 1 63 VAL H . . 4.280 3.664 2.362 4.113 . 0 0 "[ . 1 . 2]" 1
1553 1 62 CYS HB3 1 63 VAL HA . . 5.160 5.157 4.489 5.336 0.176 10 0 "[ . 1 . 2]" 1
1554 1 62 CYS HB3 1 64 THR MG . . 5.470 4.248 3.461 5.364 . 0 0 "[ . 1 . 2]" 1
1555 1 63 VAL H 1 63 VAL HB . . 3.290 2.549 2.235 2.876 . 0 0 "[ . 1 . 2]" 1
1556 1 63 VAL H 1 63 VAL QG . . 3.490 2.272 1.906 2.926 . 0 0 "[ . 1 . 2]" 1
1557 1 63 VAL H 1 64 THR H . . 5.500 4.332 3.986 4.695 . 0 0 "[ . 1 . 2]" 1
1558 1 63 VAL H 1 64 THR MG . . 5.500 4.907 4.367 5.218 . 0 0 "[ . 1 . 2]" 1
1559 1 63 VAL HA 1 63 VAL QG . . 3.220 2.160 2.099 2.369 . 0 0 "[ . 1 . 2]" 1
1560 1 63 VAL HA 1 64 THR H . . 2.920 2.191 2.091 2.286 . 0 0 "[ . 1 . 2]" 1
1561 1 63 VAL HA 1 64 THR HA . . 4.920 4.440 4.314 4.544 . 0 0 "[ . 1 . 2]" 1
1562 1 63 VAL HA 1 64 THR MG . . 4.260 3.774 3.400 4.143 . 0 0 "[ . 1 . 2]" 1
1563 1 63 VAL HA 1 131 GLU HA . . 3.730 3.253 2.619 3.644 . 0 0 "[ . 1 . 2]" 1
1564 1 63 VAL HA 1 131 GLU QG . . 4.690 3.731 2.129 4.396 . 0 0 "[ . 1 . 2]" 1
1565 1 63 VAL HB 1 64 THR H . . 4.410 4.387 3.931 4.485 0.075 2 0 "[ . 1 . 2]" 1
1566 1 63 VAL QG 1 64 THR H . . 3.620 3.071 2.424 3.493 . 0 0 "[ . 1 . 2]" 1
1567 1 63 VAL QG 1 64 THR HA . . 5.030 4.246 3.966 4.545 . 0 0 "[ . 1 . 2]" 1
1568 1 63 VAL QG 1 131 GLU HA . . 3.830 3.251 2.580 3.702 . 0 0 "[ . 1 . 2]" 1
1569 1 63 VAL QG 1 132 SER HA . . 3.510 2.675 2.134 3.168 . 0 0 "[ . 1 . 2]" 1
1570 1 63 VAL QG 1 133 TYR H . . 5.500 3.851 3.039 4.858 . 0 0 "[ . 1 . 2]" 1
1571 1 64 THR H 1 64 THR HB . . 3.870 3.650 3.557 3.752 . 0 0 "[ . 1 . 2]" 1
1572 1 64 THR H 1 64 THR MG . . 3.380 2.272 1.974 2.601 . 0 0 "[ . 1 . 2]" 1
1573 1 64 THR H 1 131 GLU HA . . 5.010 4.517 3.879 5.084 0.074 12 0 "[ . 1 . 2]" 1
1574 1 64 THR H 1 131 GLU QG . . 5.090 4.202 3.294 4.928 . 0 0 "[ . 1 . 2]" 1
1575 1 64 THR H 1 132 SER HA . . 3.970 3.521 3.118 4.044 0.074 14 0 "[ . 1 . 2]" 1
1576 1 64 THR H 1 132 SER HB2 . . 4.800 4.291 3.001 5.063 0.263 5 0 "[ . 1 . 2]" 1
1577 1 64 THR H 1 132 SER HB3 . . 4.980 4.032 2.836 5.045 0.065 12 0 "[ . 1 . 2]" 1
1578 1 64 THR HA 1 64 THR MG . . 3.330 2.418 2.188 2.567 . 0 0 "[ . 1 . 2]" 1
1579 1 64 THR HA 1 65 GLY H . . 3.040 2.390 2.249 2.585 . 0 0 "[ . 1 . 2]" 1
1580 1 64 THR HA 1 98 LEU QD . . 5.500 4.461 3.578 5.255 . 0 0 "[ . 1 . 2]" 1
1581 1 64 THR HB 1 65 GLY H . . 3.330 2.831 2.594 3.091 . 0 0 "[ . 1 . 2]" 1
1582 1 64 THR HB 1 98 LEU QD . . 4.900 4.271 3.068 4.910 0.010 8 0 "[ . 1 . 2]" 1
1583 1 64 THR MG 1 65 GLY H . . 4.400 3.982 3.633 4.166 . 0 0 "[ . 1 . 2]" 1
1584 1 64 THR MG 1 131 GLU HA . . 5.500 4.986 4.228 5.584 0.084 18 0 "[ . 1 . 2]" 1
1585 1 64 THR MG 1 131 GLU QG . . 4.150 3.697 2.718 4.119 . 0 0 "[ . 1 . 2]" 1
1586 1 64 THR MG 1 132 SER HB2 . . 4.770 4.611 3.038 5.187 0.417 11 0 "[ . 1 . 2]" 1
1587 1 64 THR MG 1 132 SER HB3 . . 5.080 4.307 3.685 5.071 . 0 0 "[ . 1 . 2]" 1
1588 1 65 GLY H 1 66 GLU HA . . 4.580 4.615 4.409 4.661 0.081 18 0 "[ . 1 . 2]" 1
1589 1 65 GLY H 1 98 LEU QD . . 5.500 4.320 3.076 5.207 . 0 0 "[ . 1 . 2]" 1
1590 1 65 GLY HA2 1 66 GLU HB2 . . 5.260 4.340 3.852 5.337 0.077 11 0 "[ . 1 . 2]" 1
1591 1 66 GLU H 1 68 TYR QE . . 5.100 4.254 3.516 5.163 0.063 1 0 "[ . 1 . 2]" 1
1592 1 66 GLU HA 1 67 ILE H . . 3.190 2.535 2.354 2.742 . 0 0 "[ . 1 . 2]" 1
1593 1 66 GLU HA 1 67 ILE MD . . 5.390 4.700 4.478 5.176 . 0 0 "[ . 1 . 2]" 1
1594 1 66 GLU HA 1 67 ILE HG12 . . 5.210 4.876 4.522 5.255 0.045 10 0 "[ . 1 . 2]" 1
1595 1 66 GLU HA 1 67 ILE HG13 . . 4.910 3.424 3.151 3.912 . 0 0 "[ . 1 . 2]" 1
1596 1 66 GLU HB3 1 68 TYR QE . . 4.040 2.968 2.218 4.160 0.120 17 0 "[ . 1 . 2]" 1
1597 1 67 ILE H 1 67 ILE HB . . 3.430 2.516 2.382 2.654 . 0 0 "[ . 1 . 2]" 1
1598 1 67 ILE H 1 67 ILE MD . . 4.640 3.930 3.556 4.227 . 0 0 "[ . 1 . 2]" 1
1599 1 67 ILE H 1 67 ILE HG12 . . 3.980 4.000 3.687 4.187 0.207 17 0 "[ . 1 . 2]" 1
1600 1 67 ILE H 1 67 ILE HG13 . . 4.510 2.859 2.376 3.105 . 0 0 "[ . 1 . 2]" 1
1601 1 67 ILE H 1 67 ILE MG . . 4.360 3.795 3.711 3.871 . 0 0 "[ . 1 . 2]" 1
1602 1 67 ILE H 1 68 TYR H . . 5.050 4.284 3.931 4.473 . 0 0 "[ . 1 . 2]" 1
1603 1 67 ILE HA 1 67 ILE MD . . 4.790 3.874 3.668 4.095 . 0 0 "[ . 1 . 2]" 1
1604 1 67 ILE HA 1 67 ILE HG12 . . 4.080 2.564 2.187 3.089 . 0 0 "[ . 1 . 2]" 1
1605 1 67 ILE HA 1 67 ILE HG13 . . 3.950 2.983 2.773 3.330 . 0 0 "[ . 1 . 2]" 1
1606 1 67 ILE HA 1 67 ILE MG . . 3.430 2.436 2.257 2.622 . 0 0 "[ . 1 . 2]" 1
1607 1 67 ILE HA 1 68 TYR H . . 3.080 2.174 2.060 2.291 . 0 0 "[ . 1 . 2]" 1
1608 1 67 ILE HA 1 68 TYR QD . . 4.490 4.028 3.296 4.589 0.099 1 0 "[ . 1 . 2]" 1
1609 1 67 ILE HA 1 110 VAL QG . . 5.500 5.318 5.006 5.425 . 0 0 "[ . 1 . 2]" 1
1610 1 67 ILE HB 1 68 TYR H . . 4.790 4.303 3.996 4.545 . 0 0 "[ . 1 . 2]" 1
1611 1 67 ILE MD 1 68 TYR H . . 5.490 5.257 4.963 5.583 0.093 2 0 "[ . 1 . 2]" 1
1612 1 67 ILE MD 1 95 VAL HB . . 4.880 4.252 3.546 5.001 0.121 6 0 "[ . 1 . 2]" 1
1613 1 67 ILE MD 1 95 VAL QG . . 3.530 2.659 2.210 3.569 0.039 4 0 "[ . 1 . 2]" 1
1614 1 67 ILE MD 1 97 VAL HA . . 4.350 2.592 2.242 3.531 . 0 0 "[ . 1 . 2]" 1
1615 1 67 ILE MD 1 97 VAL QG . . 3.970 2.440 1.986 3.199 . 0 0 "[ . 1 . 2]" 1
1616 1 67 ILE MD 1 98 LEU H . . 4.790 3.605 3.264 4.274 . 0 0 "[ . 1 . 2]" 1
1617 1 67 ILE MD 1 99 GLU H . . 5.500 4.032 3.771 4.797 . 0 0 "[ . 1 . 2]" 1
1618 1 67 ILE MD 1 100 TRP HB2 . . 5.190 4.940 4.307 5.289 0.099 6 0 "[ . 1 . 2]" 1
1619 1 67 ILE MD 1 100 TRP HE3 . . 4.360 3.089 2.452 3.587 . 0 0 "[ . 1 . 2]" 1
1620 1 67 ILE MD 1 100 TRP HZ3 . . 3.720 2.761 2.172 3.387 . 0 0 "[ . 1 . 2]" 1
1621 1 67 ILE MD 1 110 VAL QG . . 3.540 2.326 2.120 2.780 . 0 0 "[ . 1 . 2]" 1
1622 1 67 ILE HG12 1 68 TYR H . . 5.240 4.477 3.928 5.092 . 0 0 "[ . 1 . 2]" 1
1623 1 67 ILE HG12 1 95 VAL QG . . 4.370 2.883 2.274 3.603 . 0 0 "[ . 1 . 2]" 1
1624 1 67 ILE HG13 1 68 TYR H . . 5.310 5.053 4.831 5.311 0.001 16 0 "[ . 1 . 2]" 1
1625 1 67 ILE HG13 1 95 VAL QG . . 4.900 3.502 2.780 4.150 . 0 0 "[ . 1 . 2]" 1
1626 1 67 ILE MG 1 68 TYR H . . 3.470 2.842 2.451 3.426 . 0 0 "[ . 1 . 2]" 1
1627 1 67 ILE MG 1 68 TYR HA . . 5.430 3.741 3.324 4.273 . 0 0 "[ . 1 . 2]" 1
1628 1 67 ILE MG 1 68 TYR QD . . 5.500 4.978 4.485 5.369 . 0 0 "[ . 1 . 2]" 1
1629 1 67 ILE MG 1 100 TRP HH2 . . 4.070 3.650 3.055 4.178 0.108 14 0 "[ . 1 . 2]" 1
1630 1 67 ILE MG 1 100 TRP HZ3 . . 3.540 2.307 2.086 2.973 . 0 0 "[ . 1 . 2]" 1
1631 1 67 ILE MG 1 110 VAL QG . . 4.090 3.085 2.704 3.376 . 0 0 "[ . 1 . 2]" 1
1632 1 68 TYR H 1 68 TYR HB2 . . 3.900 2.646 2.381 2.848 . 0 0 "[ . 1 . 2]" 1
1633 1 68 TYR H 1 68 TYR QD . . 3.360 3.101 2.691 3.428 0.068 6 0 "[ . 1 . 2]" 1
1634 1 68 TYR H 1 68 TYR QE . . 4.920 4.981 4.754 5.018 0.098 4 0 "[ . 1 . 2]" 1
1635 1 68 TYR HA 1 68 TYR QD . . 3.770 2.720 2.295 3.042 . 0 0 "[ . 1 . 2]" 1
1636 1 68 TYR HA 1 69 GLU H . . 3.090 2.089 2.003 2.212 . 0 0 "[ . 1 . 2]" 1
1637 1 68 TYR HA 1 69 GLU HB3 . . 5.230 4.388 4.143 4.743 . 0 0 "[ . 1 . 2]" 1
1638 1 68 TYR HB3 1 69 GLU H . . 3.910 3.332 3.131 3.744 . 0 0 "[ . 1 . 2]" 1
1639 1 68 TYR HB3 1 70 VAL MG1 . . 3.770 2.561 2.214 2.924 . 0 0 "[ . 1 . 2]" 1
1640 1 68 TYR QD 1 69 GLU H . . 4.590 3.938 3.678 4.181 . 0 0 "[ . 1 . 2]" 1
1641 1 68 TYR QD 1 70 VAL MG1 . . 5.170 4.025 3.680 4.370 . 0 0 "[ . 1 . 2]" 1
1642 1 69 GLU H 1 69 GLU HB3 . . 3.430 2.353 2.176 2.627 . 0 0 "[ . 1 . 2]" 1
1643 1 69 GLU H 1 69 GLU HG2 . . 4.930 4.389 4.268 4.639 . 0 0 "[ . 1 . 2]" 1
1644 1 69 GLU H 1 69 GLU HG3 . . 4.980 4.530 4.187 4.690 . 0 0 "[ . 1 . 2]" 1
1645 1 69 GLU H 1 70 VAL H . . 5.500 4.447 4.020 4.566 . 0 0 "[ . 1 . 2]" 1
1646 1 69 GLU H 1 70 VAL MG1 . . 5.250 4.109 3.800 4.385 . 0 0 "[ . 1 . 2]" 1
1647 1 69 GLU HA 1 69 GLU HG2 . . 3.970 3.028 2.388 3.542 . 0 0 "[ . 1 . 2]" 1
1648 1 69 GLU HA 1 69 GLU HG3 . . 3.450 2.879 2.371 3.616 0.166 17 0 "[ . 1 . 2]" 1
1649 1 69 GLU HA 1 70 VAL H . . 3.030 2.249 2.105 2.411 . 0 0 "[ . 1 . 2]" 1
1650 1 69 GLU HA 1 70 VAL HA . . 4.950 4.482 4.421 4.576 . 0 0 "[ . 1 . 2]" 1
1651 1 69 GLU HA 1 70 VAL MG1 . . 5.060 3.845 3.594 4.262 . 0 0 "[ . 1 . 2]" 1
1652 1 69 GLU HA 1 70 VAL MG2 . . 4.700 3.766 3.276 4.293 . 0 0 "[ . 1 . 2]" 1
1653 1 69 GLU HB2 1 70 VAL H . . 5.210 4.342 4.058 4.680 . 0 0 "[ . 1 . 2]" 1
1654 1 69 GLU HB3 1 70 VAL H . . 4.630 4.270 3.863 4.560 . 0 0 "[ . 1 . 2]" 1
1655 1 69 GLU HG2 1 70 VAL H . . 4.360 3.286 2.321 4.770 0.410 8 0 "[ . 1 . 2]" 1
1656 1 69 GLU HG2 1 70 VAL HA . . 5.390 4.289 3.542 6.328 0.938 8 2 "[ . + 1 . - 2]" 1
1657 1 70 VAL H 1 70 VAL MG1 . . 3.950 3.035 2.457 3.276 . 0 0 "[ . 1 . 2]" 1
1658 1 70 VAL H 1 70 VAL MG2 . . 3.260 2.323 2.003 2.531 . 0 0 "[ . 1 . 2]" 1
1659 1 70 VAL H 1 71 ASP H . . 5.070 4.427 4.334 4.676 . 0 0 "[ . 1 . 2]" 1
1660 1 70 VAL HA 1 70 VAL MG1 . . 3.250 2.370 2.222 2.488 . 0 0 "[ . 1 . 2]" 1
1661 1 70 VAL HA 1 71 ASP H . . 3.080 2.406 2.224 2.547 . 0 0 "[ . 1 . 2]" 1
1662 1 70 VAL HA 1 74 MET H . . 5.500 5.515 5.243 5.584 0.084 11 0 "[ . 1 . 2]" 1
1663 1 70 VAL HA 1 74 MET HB3 . . 5.150 3.847 3.498 4.108 . 0 0 "[ . 1 . 2]" 1
1664 1 70 VAL HA 1 74 MET ME . . 5.350 4.959 4.630 5.428 0.078 5 0 "[ . 1 . 2]" 1
1665 1 70 VAL HA 1 74 MET HG2 . . 5.480 3.907 3.468 4.805 . 0 0 "[ . 1 . 2]" 1
1666 1 70 VAL HB 1 71 ASP H . . 3.270 2.504 2.214 2.987 . 0 0 "[ . 1 . 2]" 1
1667 1 70 VAL HB 1 74 MET H . . 4.890 4.246 3.976 4.516 . 0 0 "[ . 1 . 2]" 1
1668 1 70 VAL HB 1 74 MET HG2 . . 4.070 2.481 2.207 3.218 . 0 0 "[ . 1 . 2]" 1
1669 1 70 VAL HB 1 75 LEU H . . 4.810 3.635 3.094 4.244 . 0 0 "[ . 1 . 2]" 1
1670 1 70 VAL MG1 1 71 ASP H . . 4.050 3.747 3.542 3.862 . 0 0 "[ . 1 . 2]" 1
1671 1 70 VAL MG1 1 74 MET H . . 5.500 5.368 4.906 5.540 0.040 3 0 "[ . 1 . 2]" 1
1672 1 70 VAL MG1 1 74 MET HB3 . . 5.500 3.460 2.927 3.663 . 0 0 "[ . 1 . 2]" 1
1673 1 70 VAL MG1 1 74 MET ME . . 4.360 3.740 3.350 4.134 . 0 0 "[ . 1 . 2]" 1
1674 1 70 VAL MG1 1 74 MET HG2 . . 3.520 2.228 2.101 2.594 . 0 0 "[ . 1 . 2]" 1
1675 1 70 VAL MG1 1 75 LEU H . . 5.500 4.772 4.223 5.302 . 0 0 "[ . 1 . 2]" 1
1676 1 70 VAL MG2 1 71 ASP H . . 4.230 3.499 3.008 3.987 . 0 0 "[ . 1 . 2]" 1
1677 1 70 VAL MG2 1 71 ASP HA . . 4.990 3.965 3.483 4.313 . 0 0 "[ . 1 . 2]" 1
1678 1 70 VAL MG2 1 74 MET H . . 5.500 4.876 4.417 5.417 . 0 0 "[ . 1 . 2]" 1
1679 1 70 VAL MG2 1 74 MET HG2 . . 4.830 3.612 2.709 4.207 . 0 0 "[ . 1 . 2]" 1
1680 1 70 VAL MG2 1 75 LEU H . . 4.270 3.533 3.061 4.338 0.068 2 0 "[ . 1 . 2]" 1
1681 1 71 ASP H 1 71 ASP QB . . 3.920 2.635 2.336 2.827 . 0 0 "[ . 1 . 2]" 1
1682 1 71 ASP H 1 74 MET HB2 . . 4.510 3.375 3.116 3.729 . 0 0 "[ . 1 . 2]" 1
1683 1 71 ASP H 1 74 MET HB3 . . 4.110 2.534 2.349 2.844 . 0 0 "[ . 1 . 2]" 1
1684 1 71 ASP H 1 74 MET ME . . 5.090 4.717 4.414 5.157 0.067 1 0 "[ . 1 . 2]" 1
1685 1 71 ASP H 1 74 MET HG2 . . 4.810 4.016 3.677 4.720 . 0 0 "[ . 1 . 2]" 1
1686 1 71 ASP H 1 75 LEU H . . 4.060 4.115 4.034 4.142 0.082 7 0 "[ . 1 . 2]" 1
1687 1 71 ASP HA 1 72 GLU H . . 3.150 2.454 2.329 2.578 . 0 0 "[ . 1 . 2]" 1
1688 1 71 ASP HA 1 72 GLU HA . . 4.580 4.223 3.965 4.400 . 0 0 "[ . 1 . 2]" 1
1689 1 71 ASP HA 1 72 GLU HB2 . . 4.650 4.457 4.185 4.721 0.071 11 0 "[ . 1 . 2]" 1
1690 1 71 ASP HA 1 73 GLN H . . 4.860 4.531 4.107 4.905 0.045 4 0 "[ . 1 . 2]" 1
1691 1 71 ASP HA 1 74 MET H . . 4.760 4.811 4.604 4.845 0.085 10 0 "[ . 1 . 2]" 1
1692 1 71 ASP HA 1 75 LEU H . . 5.500 5.046 4.864 5.193 . 0 0 "[ . 1 . 2]" 1
1693 1 71 ASP QB 1 72 GLU H . . 3.080 2.103 2.043 2.241 . 0 0 "[ . 1 . 2]" 1
1694 1 71 ASP QB 1 72 GLU HA . . 5.140 4.489 4.224 4.682 . 0 0 "[ . 1 . 2]" 1
1695 1 71 ASP QB 1 72 GLU HB2 . . 4.820 3.651 3.491 3.934 . 0 0 "[ . 1 . 2]" 1
1696 1 71 ASP QB 1 72 GLU QG . . 5.360 4.821 4.339 4.948 . 0 0 "[ . 1 . 2]" 1
1697 1 71 ASP QB 1 73 GLN H . . 3.960 3.029 2.060 3.443 . 0 0 "[ . 1 . 2]" 1
1698 1 72 GLU H 1 72 GLU HB2 . . 2.990 2.071 1.907 2.228 . 0 0 "[ . 1 . 2]" 1
1699 1 72 GLU H 1 72 GLU QG . . 3.350 3.178 2.736 3.300 . 0 0 "[ . 1 . 2]" 1
1700 1 72 GLU H 1 73 GLN H . . 3.440 2.835 2.619 3.203 . 0 0 "[ . 1 . 2]" 1
1701 1 72 GLU H 1 74 MET H . . 4.450 4.370 4.134 4.518 0.068 14 0 "[ . 1 . 2]" 1
1702 1 72 GLU HA 1 72 GLU HB2 . . 2.870 2.921 2.857 2.959 0.089 3 0 "[ . 1 . 2]" 1
1703 1 72 GLU HA 1 72 GLU QG . . 3.290 2.135 2.017 2.249 . 0 0 "[ . 1 . 2]" 1
1704 1 72 GLU HA 1 75 LEU H . . 3.770 3.493 3.262 3.783 0.013 14 0 "[ . 1 . 2]" 1
1705 1 72 GLU HA 1 75 LEU HB2 . . 3.500 3.173 2.732 3.571 0.071 2 0 "[ . 1 . 2]" 1
1706 1 72 GLU HA 1 75 LEU HB3 . . 3.450 3.231 2.576 3.540 0.090 15 0 "[ . 1 . 2]" 1
1707 1 72 GLU HA 1 75 LEU QD . . 4.160 3.847 3.300 4.157 . 0 0 "[ . 1 . 2]" 1
1708 1 72 GLU HA 1 76 ARG H . . 4.270 3.924 3.692 4.210 . 0 0 "[ . 1 . 2]" 1
1709 1 72 GLU HB2 1 72 GLU QG . . 2.670 2.306 2.126 2.514 . 0 0 "[ . 1 . 2]" 1
1710 1 72 GLU HB2 1 73 GLN H . . 3.370 3.206 2.831 3.466 0.096 15 0 "[ . 1 . 2]" 1
1711 1 72 GLU HB2 1 76 ARG HE . . 5.500 4.820 4.106 5.402 . 0 0 "[ . 1 . 2]" 1
1712 1 72 GLU QG 1 75 LEU QD . . 5.030 4.109 3.276 4.654 . 0 0 "[ . 1 . 2]" 1
1713 1 72 GLU QG 1 76 ARG HE . . 5.340 3.445 1.818 4.502 . 0 0 "[ . 1 . 2]" 1
1714 1 72 GLU QG 1 76 ARG QG . . 4.980 3.956 3.151 4.648 . 0 0 "[ . 1 . 2]" 1
1715 1 73 GLN H 1 73 GLN HB3 . . 2.830 2.674 2.439 3.604 0.774 11 1 "[ . 1+ . 2]" 1
1716 1 73 GLN H 1 74 MET H . . 3.390 2.726 2.380 2.952 . 0 0 "[ . 1 . 2]" 1
1717 1 73 GLN H 1 74 MET HA . . 5.500 5.358 5.067 5.548 0.048 12 0 "[ . 1 . 2]" 1
1718 1 73 GLN H 1 76 ARG H . . 4.900 4.706 4.523 4.868 . 0 0 "[ . 1 . 2]" 1
1719 1 73 GLN HA 1 73 GLN HB3 . . 2.950 2.993 2.442 3.029 0.079 14 0 "[ . 1 . 2]" 1
1720 1 73 GLN HA 1 73 GLN HG3 . . 3.290 3.147 2.801 3.393 0.103 11 0 "[ . 1 . 2]" 1
1721 1 73 GLN HA 1 76 ARG H . . 3.930 3.515 2.973 3.792 . 0 0 "[ . 1 . 2]" 1
1722 1 73 GLN HA 1 76 ARG HB2 . . 3.440 2.572 2.145 3.007 . 0 0 "[ . 1 . 2]" 1
1723 1 73 GLN HA 1 76 ARG QD . . 4.640 3.349 2.263 4.523 . 0 0 "[ . 1 . 2]" 1
1724 1 73 GLN HA 1 76 ARG QG . . 4.620 3.771 3.172 4.214 . 0 0 "[ . 1 . 2]" 1
1725 1 73 GLN HB3 1 74 MET H . . 3.560 2.873 2.646 3.580 0.020 11 0 "[ . 1 . 2]" 1
1726 1 73 GLN HE21 1 73 GLN HG3 . . 3.540 2.751 2.181 3.617 0.077 20 0 "[ . 1 . 2]" 1
1727 1 73 GLN HE22 1 76 ARG HB3 . . 4.000 3.996 3.614 4.201 0.201 9 0 "[ . 1 . 2]" 1
1728 1 74 MET H 1 74 MET HB2 . . 3.410 2.679 2.401 2.865 . 0 0 "[ . 1 . 2]" 1
1729 1 74 MET H 1 74 MET HB3 . . 3.150 2.321 2.236 2.419 . 0 0 "[ . 1 . 2]" 1
1730 1 74 MET H 1 74 MET ME . . 4.290 4.166 3.815 4.379 0.089 16 0 "[ . 1 . 2]" 1
1731 1 74 MET H 1 74 MET HG2 . . 4.920 4.543 4.441 4.637 . 0 0 "[ . 1 . 2]" 1
1732 1 74 MET H 1 75 LEU H . . 3.690 2.600 2.370 2.827 . 0 0 "[ . 1 . 2]" 1
1733 1 74 MET H 1 75 LEU HB2 . . 5.090 4.595 4.311 4.982 . 0 0 "[ . 1 . 2]" 1
1734 1 74 MET H 1 76 ARG H . . 5.010 3.970 3.707 4.307 . 0 0 "[ . 1 . 2]" 1
1735 1 74 MET HA 1 77 PHE H . . 4.200 3.326 3.107 3.528 . 0 0 "[ . 1 . 2]" 1
1736 1 74 MET HA 1 77 PHE HB2 . . 3.600 3.624 3.445 3.675 0.075 20 0 "[ . 1 . 2]" 1
1737 1 74 MET HA 1 77 PHE HB3 . . 4.600 2.494 2.308 2.747 . 0 0 "[ . 1 . 2]" 1
1738 1 74 MET HA 1 77 PHE QD . . 3.720 3.733 3.404 3.820 0.100 7 0 "[ . 1 . 2]" 1
1739 1 74 MET HA 1 78 LEU H . . 4.220 3.829 3.555 4.121 . 0 0 "[ . 1 . 2]" 1
1740 1 74 MET HB2 1 74 MET ME . . 3.230 2.113 2.035 2.166 . 0 0 "[ . 1 . 2]" 1
1741 1 74 MET HB2 1 75 LEU H . . 3.860 3.891 3.794 3.936 0.076 12 0 "[ . 1 . 2]" 1
1742 1 74 MET HB3 1 74 MET ME . . 3.340 3.428 3.358 3.447 0.107 12 0 "[ . 1 . 2]" 1
1743 1 74 MET HB3 1 75 LEU H . . 4.500 2.522 2.402 2.636 . 0 0 "[ . 1 . 2]" 1
1744 1 74 MET ME 1 74 MET HG2 . . 3.390 2.585 2.347 3.396 0.006 8 0 "[ . 1 . 2]" 1
1745 1 74 MET ME 1 75 LEU H . . 5.120 5.092 4.943 5.227 0.107 9 0 "[ . 1 . 2]" 1
1746 1 74 MET ME 1 77 PHE HB3 . . 5.410 3.943 3.298 4.421 . 0 0 "[ . 1 . 2]" 1
1747 1 74 MET ME 1 77 PHE QD . . 3.930 3.658 3.099 4.036 0.106 7 0 "[ . 1 . 2]" 1
1748 1 74 MET ME 1 77 PHE QE . . 5.270 4.516 3.865 5.004 . 0 0 "[ . 1 . 2]" 1
1749 1 74 MET ME 1 78 LEU H . . 5.330 5.123 4.728 5.409 0.079 11 0 "[ . 1 . 2]" 1
1750 1 74 MET ME 1 78 LEU QD . . 3.720 3.482 3.308 3.652 . 0 0 "[ . 1 . 2]" 1
1751 1 74 MET HG2 1 75 LEU HA . . 5.340 5.054 3.743 5.360 0.020 11 0 "[ . 1 . 2]" 1
1752 1 74 MET HG2 1 78 LEU QD . . 4.110 3.481 2.522 3.956 . 0 0 "[ . 1 . 2]" 1
1753 1 75 LEU H 1 75 LEU HB2 . . 3.380 2.180 2.063 2.402 . 0 0 "[ . 1 . 2]" 1
1754 1 75 LEU H 1 75 LEU HB3 . . 3.210 3.071 2.816 3.291 0.081 17 0 "[ . 1 . 2]" 1
1755 1 75 LEU H 1 75 LEU QD . . 4.270 3.667 3.257 3.830 . 0 0 "[ . 1 . 2]" 1
1756 1 75 LEU H 1 76 ARG H . . 3.580 2.778 2.632 2.885 . 0 0 "[ . 1 . 2]" 1
1757 1 75 LEU HA 1 75 LEU QD . . 3.300 2.119 1.997 2.301 . 0 0 "[ . 1 . 2]" 1
1758 1 75 LEU HA 1 75 LEU HG . . 3.920 2.680 2.334 3.122 . 0 0 "[ . 1 . 2]" 1
1759 1 75 LEU HA 1 78 LEU H . . 4.110 3.653 3.385 3.847 . 0 0 "[ . 1 . 2]" 1
1760 1 75 LEU HA 1 78 LEU HB2 . . 3.770 2.884 2.511 3.233 . 0 0 "[ . 1 . 2]" 1
1761 1 75 LEU HA 1 78 LEU HB3 . . 4.850 4.324 3.627 4.905 0.055 1 0 "[ . 1 . 2]" 1
1762 1 75 LEU HA 1 78 LEU QD . . 3.960 2.912 2.439 3.871 . 0 0 "[ . 1 . 2]" 1
1763 1 75 LEU HA 1 79 ASP H . . 4.590 4.314 4.014 4.629 0.039 1 0 "[ . 1 . 2]" 1
1764 1 75 LEU HB2 1 76 ARG H . . 3.610 3.665 3.492 3.804 0.194 10 0 "[ . 1 . 2]" 1
1765 1 75 LEU HB3 1 76 ARG H . . 3.730 3.010 2.625 3.552 . 0 0 "[ . 1 . 2]" 1
1766 1 75 LEU QD 1 76 ARG H . . 5.010 4.179 3.992 4.432 . 0 0 "[ . 1 . 2]" 1
1767 1 75 LEU QD 1 78 LEU H . . 5.500 4.725 4.230 5.123 . 0 0 "[ . 1 . 2]" 1
1768 1 75 LEU QD 1 78 LEU HB2 . . 4.110 3.397 2.667 4.062 . 0 0 "[ . 1 . 2]" 1
1769 1 75 LEU QD 1 78 LEU QD . . 3.410 3.078 2.555 3.427 0.017 20 0 "[ . 1 . 2]" 1
1770 1 75 LEU QD 1 79 ASP H . . 5.500 4.472 3.668 5.265 . 0 0 "[ . 1 . 2]" 1
1771 1 75 LEU QD 1 90 ARG HD3 . . 4.000 3.505 3.242 3.829 . 0 0 "[ . 1 . 2]" 1
1772 1 75 LEU QD 1 90 ARG HE . . 5.420 3.986 3.105 4.805 . 0 0 "[ . 1 . 2]" 1
1773 1 75 LEU QD 1 113 PHE HB2 . . 5.390 3.096 2.689 3.592 . 0 0 "[ . 1 . 2]" 1
1774 1 75 LEU QD 1 113 PHE HB3 . . 4.090 3.541 3.219 3.799 . 0 0 "[ . 1 . 2]" 1
1775 1 75 LEU QD 1 113 PHE QD . . 3.800 2.782 2.082 3.282 . 0 0 "[ . 1 . 2]" 1
1776 1 75 LEU QD 1 113 PHE QE . . 4.280 3.595 2.265 4.229 . 0 0 "[ . 1 . 2]" 1
1777 1 75 LEU HG 1 76 ARG H . . 5.500 4.943 4.202 5.491 . 0 0 "[ . 1 . 2]" 1
1778 1 75 LEU HG 1 113 PHE QD . . 5.390 4.975 3.582 5.472 0.082 20 0 "[ . 1 . 2]" 1
1779 1 76 ARG H 1 76 ARG HB2 . . 3.070 2.330 2.188 2.463 . 0 0 "[ . 1 . 2]" 1
1780 1 76 ARG H 1 76 ARG QD . . 5.460 3.891 2.233 4.576 . 0 0 "[ . 1 . 2]" 1
1781 1 76 ARG H 1 76 ARG QG . . 3.690 2.744 2.469 3.145 . 0 0 "[ . 1 . 2]" 1
1782 1 76 ARG H 1 77 PHE H . . 3.100 2.620 2.532 2.736 . 0 0 "[ . 1 . 2]" 1
1783 1 76 ARG H 1 77 PHE HA . . 5.210 5.247 5.176 5.294 0.084 19 0 "[ . 1 . 2]" 1
1784 1 76 ARG H 1 77 PHE HB2 . . 5.380 5.146 4.969 5.280 . 0 0 "[ . 1 . 2]" 1
1785 1 76 ARG H 1 78 LEU H . . 4.950 4.248 3.894 4.508 . 0 0 "[ . 1 . 2]" 1
1786 1 76 ARG H 1 79 ASP H . . 5.500 4.716 4.442 5.018 . 0 0 "[ . 1 . 2]" 1
1787 1 76 ARG HA 1 76 ARG QD . . 4.340 3.702 2.032 4.012 . 0 0 "[ . 1 . 2]" 1
1788 1 76 ARG HA 1 76 ARG QG . . 3.680 2.362 2.109 3.016 . 0 0 "[ . 1 . 2]" 1
1789 1 76 ARG HA 1 78 LEU H . . 5.260 4.697 4.540 4.898 . 0 0 "[ . 1 . 2]" 1
1790 1 76 ARG HA 1 79 ASP H . . 3.960 3.423 3.074 3.935 . 0 0 "[ . 1 . 2]" 1
1791 1 76 ARG HA 1 79 ASP HB2 . . 4.220 2.835 2.292 3.386 . 0 0 "[ . 1 . 2]" 1
1792 1 76 ARG HA 1 79 ASP HB3 . . 3.770 2.913 2.154 3.815 0.045 5 0 "[ . 1 . 2]" 1
1793 1 76 ARG HA 1 80 ASP H . . 5.240 4.966 4.337 5.310 0.070 6 0 "[ . 1 . 2]" 1
1794 1 76 ARG HB2 1 76 ARG HE . . 5.320 4.174 2.991 4.779 . 0 0 "[ . 1 . 2]" 1
1795 1 76 ARG HB2 1 77 PHE H . . 3.550 2.711 2.418 2.886 . 0 0 "[ . 1 . 2]" 1
1796 1 76 ARG HB3 1 76 ARG QD . . 3.620 2.419 2.208 3.156 . 0 0 "[ . 1 . 2]" 1
1797 1 76 ARG HB3 1 77 PHE HA . . 5.140 4.231 3.968 4.434 . 0 0 "[ . 1 . 2]" 1
1798 1 76 ARG HB3 1 77 PHE HB2 . . 5.470 5.094 4.668 5.269 . 0 0 "[ . 1 . 2]" 1
1799 1 76 ARG QG 1 77 PHE H . . 4.770 4.320 4.172 4.413 . 0 0 "[ . 1 . 2]" 1
1800 1 77 PHE H 1 77 PHE HB2 . . 3.140 2.653 2.503 2.814 . 0 0 "[ . 1 . 2]" 1
1801 1 77 PHE H 1 77 PHE HB3 . . 3.740 2.325 2.229 2.379 . 0 0 "[ . 1 . 2]" 1
1802 1 77 PHE H 1 77 PHE QD . . 4.080 4.118 4.037 4.159 0.079 11 0 "[ . 1 . 2]" 1
1803 1 77 PHE H 1 78 LEU H . . 3.490 2.798 2.620 2.948 . 0 0 "[ . 1 . 2]" 1
1804 1 77 PHE H 1 78 LEU HB2 . . 5.090 4.769 4.387 5.131 0.041 6 0 "[ . 1 . 2]" 1
1805 1 77 PHE HA 1 77 PHE QD . . 3.240 2.740 2.285 3.016 . 0 0 "[ . 1 . 2]" 1
1806 1 77 PHE HA 1 80 ASP H . . 4.370 3.700 3.495 4.016 . 0 0 "[ . 1 . 2]" 1
1807 1 77 PHE HA 1 80 ASP HB2 . . 3.980 3.991 3.793 4.056 0.076 19 0 "[ . 1 . 2]" 1
1808 1 77 PHE HA 1 80 ASP HB3 . . 4.000 3.132 2.751 3.485 . 0 0 "[ . 1 . 2]" 1
1809 1 77 PHE HA 1 81 PHE H . . 5.470 4.431 3.949 5.249 . 0 0 "[ . 1 . 2]" 1
1810 1 77 PHE HB2 1 78 LEU H . . 4.150 3.916 3.675 4.027 . 0 0 "[ . 1 . 2]" 1
1811 1 77 PHE HB3 1 78 LEU H . . 3.650 2.526 2.213 2.682 . 0 0 "[ . 1 . 2]" 1
1812 1 77 PHE HB3 1 78 LEU QD . . 5.500 3.610 2.763 4.208 . 0 0 "[ . 1 . 2]" 1
1813 1 77 PHE QD 1 78 LEU H . . 3.680 2.980 2.776 3.225 . 0 0 "[ . 1 . 2]" 1
1814 1 77 PHE QD 1 78 LEU HA . . 3.850 3.474 3.056 3.947 0.097 11 0 "[ . 1 . 2]" 1
1815 1 77 PHE QD 1 78 LEU QD . . 3.100 2.283 1.991 2.651 . 0 0 "[ . 1 . 2]" 1
1816 1 77 PHE QD 1 80 ASP HB3 . . 4.280 4.178 3.523 4.373 0.093 12 0 "[ . 1 . 2]" 1
1817 1 77 PHE QD 1 81 PHE H . . 5.230 4.764 4.154 5.317 0.087 6 0 "[ . 1 . 2]" 1
1818 1 77 PHE QE 1 78 LEU H . . 4.910 4.971 4.857 5.001 0.091 11 0 "[ . 1 . 2]" 1
1819 1 77 PHE QE 1 78 LEU HA . . 5.360 4.159 3.818 4.547 . 0 0 "[ . 1 . 2]" 1
1820 1 77 PHE QE 1 78 LEU QD . . 3.060 2.731 2.405 3.039 . 0 0 "[ . 1 . 2]" 1
1821 1 78 LEU H 1 78 LEU HB2 . . 3.530 2.350 2.041 2.609 . 0 0 "[ . 1 . 2]" 1
1822 1 78 LEU H 1 78 LEU HB3 . . 3.940 3.534 3.203 3.648 . 0 0 "[ . 1 . 2]" 1
1823 1 78 LEU H 1 78 LEU QD . . 3.940 2.767 2.182 3.188 . 0 0 "[ . 1 . 2]" 1
1824 1 78 LEU H 1 79 ASP H . . 3.540 2.796 2.605 2.997 . 0 0 "[ . 1 . 2]" 1
1825 1 78 LEU H 1 79 ASP HB2 . . 5.130 4.779 4.348 5.166 0.036 20 0 "[ . 1 . 2]" 1
1826 1 78 LEU H 1 80 ASP H . . 5.310 4.263 4.051 4.430 . 0 0 "[ . 1 . 2]" 1
1827 1 78 LEU HA 1 78 LEU QD . . 3.100 2.167 2.046 2.286 . 0 0 "[ . 1 . 2]" 1
1828 1 78 LEU HA 1 80 ASP H . . 4.710 3.766 3.377 4.435 . 0 0 "[ . 1 . 2]" 1
1829 1 78 LEU HA 1 81 PHE H . . 4.270 3.130 2.835 3.420 . 0 0 "[ . 1 . 2]" 1
1830 1 78 LEU HA 1 81 PHE HB2 . . 3.790 3.305 2.435 3.872 0.082 6 0 "[ . 1 . 2]" 1
1831 1 78 LEU HA 1 81 PHE HB3 . . 3.430 2.310 2.077 2.536 . 0 0 "[ . 1 . 2]" 1
1832 1 78 LEU HA 1 82 GLU H . . 4.800 3.693 3.198 4.195 . 0 0 "[ . 1 . 2]" 1
1833 1 78 LEU HB2 1 79 ASP H . . 3.870 3.006 2.663 3.756 . 0 0 "[ . 1 . 2]" 1
1834 1 78 LEU HB2 1 115 TYR QE . . 4.040 3.287 2.310 4.037 . 0 0 "[ . 1 . 2]" 1
1835 1 78 LEU HB3 1 79 ASP H . . 4.280 3.602 3.059 4.079 . 0 0 "[ . 1 . 2]" 1
1836 1 78 LEU HB3 1 79 ASP HB2 . . 5.430 5.065 4.543 5.460 0.030 5 0 "[ . 1 . 2]" 1
1837 1 78 LEU HB3 1 115 TYR QE . . 4.000 2.534 2.107 3.021 . 0 0 "[ . 1 . 2]" 1
1838 1 78 LEU QD 1 79 ASP H . . 5.170 4.181 3.922 4.447 . 0 0 "[ . 1 . 2]" 1
1839 1 78 LEU QD 1 81 PHE H . . 4.970 4.549 4.269 4.857 . 0 0 "[ . 1 . 2]" 1
1840 1 78 LEU QD 1 81 PHE HB2 . . 4.550 3.829 3.419 4.405 . 0 0 "[ . 1 . 2]" 1
1841 1 78 LEU QD 1 81 PHE HB3 . . 4.020 3.233 2.742 3.727 . 0 0 "[ . 1 . 2]" 1
1842 1 78 LEU QD 1 115 TYR QD . . 5.500 3.681 2.997 4.379 . 0 0 "[ . 1 . 2]" 1
1843 1 78 LEU QD 1 115 TYR QE . . 3.530 2.617 2.157 3.336 . 0 0 "[ . 1 . 2]" 1
1844 1 78 LEU HG 1 79 ASP H . . 5.500 4.908 4.287 5.415 . 0 0 "[ . 1 . 2]" 1
1845 1 79 ASP H 1 79 ASP HB2 . . 3.600 2.254 1.967 2.622 . 0 0 "[ . 1 . 2]" 1
1846 1 79 ASP H 1 79 ASP HB3 . . 3.380 2.767 2.258 3.304 . 0 0 "[ . 1 . 2]" 1
1847 1 79 ASP H 1 80 ASP H . . 3.490 2.691 2.375 2.955 . 0 0 "[ . 1 . 2]" 1
1848 1 79 ASP H 1 80 ASP HB2 . . 5.240 4.972 4.506 5.285 0.045 5 0 "[ . 1 . 2]" 1
1849 1 79 ASP H 1 115 TYR QE . . 5.130 4.470 3.587 5.066 . 0 0 "[ . 1 . 2]" 1
1850 1 79 ASP HA 1 81 PHE H . . 5.500 4.548 3.852 4.976 . 0 0 "[ . 1 . 2]" 1
1851 1 79 ASP HA 1 82 GLU H . . 5.000 4.238 3.793 4.701 . 0 0 "[ . 1 . 2]" 1
1852 1 79 ASP HA 1 82 GLU HG2 . . 5.210 4.655 3.331 5.535 0.325 19 0 "[ . 1 . 2]" 1
1853 1 79 ASP HA 1 84 CYS HB2 . . 4.510 4.297 2.740 5.006 0.496 3 0 "[ . 1 . 2]" 1
1854 1 79 ASP HA 1 84 CYS HB3 . . 4.970 4.314 2.257 4.867 . 0 0 "[ . 1 . 2]" 1
1855 1 79 ASP HA 1 115 TYR QE . . 3.760 2.989 2.326 3.536 . 0 0 "[ . 1 . 2]" 1
1856 1 79 ASP HB2 1 80 ASP H . . 4.160 3.968 3.416 4.235 0.075 17 0 "[ . 1 . 2]" 1
1857 1 79 ASP HB2 1 115 TYR QE . . 4.460 4.315 3.427 4.549 0.089 5 0 "[ . 1 . 2]" 1
1858 1 79 ASP HB3 1 80 ASP H . . 3.760 3.254 2.295 3.805 0.045 1 0 "[ . 1 . 2]" 1
1859 1 80 ASP H 1 80 ASP HB2 . . 3.180 2.852 2.382 3.151 . 0 0 "[ . 1 . 2]" 1
1860 1 80 ASP H 1 80 ASP HB3 . . 3.020 2.515 2.232 2.835 . 0 0 "[ . 1 . 2]" 1
1861 1 80 ASP H 1 81 PHE H . . 3.380 2.179 1.843 2.589 . 0 0 "[ . 1 . 2]" 1
1862 1 80 ASP H 1 81 PHE HA . . 5.100 4.807 4.481 5.150 0.050 16 0 "[ . 1 . 2]" 1
1863 1 80 ASP H 1 81 PHE HB2 . . 5.400 4.469 3.706 5.323 . 0 0 "[ . 1 . 2]" 1
1864 1 80 ASP HA 1 82 GLU H . . 4.760 4.555 4.069 4.828 0.068 16 0 "[ . 1 . 2]" 1
1865 1 80 ASP HA 1 83 ASP H . . 4.100 3.841 3.531 4.136 0.036 2 0 "[ . 1 . 2]" 1
1866 1 80 ASP HA 1 83 ASP HA . . 4.170 3.818 3.317 4.244 0.074 11 0 "[ . 1 . 2]" 1
1867 1 80 ASP HA 1 84 CYS H . . 4.430 4.337 3.885 4.508 0.078 17 0 "[ . 1 . 2]" 1
1868 1 81 PHE H 1 81 PHE HB2 . . 3.460 2.607 2.340 3.547 0.087 6 0 "[ . 1 . 2]" 1
1869 1 81 PHE H 1 81 PHE HB3 . . 3.290 2.425 2.287 2.646 . 0 0 "[ . 1 . 2]" 1
1870 1 81 PHE H 1 81 PHE QD . . 4.750 4.162 3.433 4.265 . 0 0 "[ . 1 . 2]" 1
1871 1 81 PHE H 1 82 GLU H . . 3.900 2.627 1.921 2.971 . 0 0 "[ . 1 . 2]" 1
1872 1 81 PHE H 1 82 GLU HB2 . . 5.490 5.335 4.069 6.280 0.790 7 3 "[ *- + 1 . 2]" 1
1873 1 81 PHE H 1 83 ASP H . . 4.910 3.948 3.237 4.302 . 0 0 "[ . 1 . 2]" 1
1874 1 81 PHE HA 1 81 PHE QD . . 3.740 2.552 2.243 3.443 . 0 0 "[ . 1 . 2]" 1
1875 1 81 PHE HA 1 82 GLU HA . . 5.430 4.693 4.611 4.793 . 0 0 "[ . 1 . 2]" 1
1876 1 81 PHE HA 1 83 ASP H . . 4.940 3.763 3.474 4.134 . 0 0 "[ . 1 . 2]" 1
1877 1 81 PHE HB2 1 82 GLU H . . 4.380 3.972 3.657 4.251 . 0 0 "[ . 1 . 2]" 1
1878 1 81 PHE HB3 1 82 GLU H . . 3.940 2.735 2.514 3.277 . 0 0 "[ . 1 . 2]" 1
1879 1 81 PHE QD 1 82 GLU H . . 4.750 3.894 3.240 4.245 . 0 0 "[ . 1 . 2]" 1
1880 1 81 PHE QD 1 82 GLU HA . . 5.400 4.204 3.195 4.941 . 0 0 "[ . 1 . 2]" 1
1881 1 82 GLU H 1 82 GLU HG2 . . 3.950 2.314 1.960 2.768 . 0 0 "[ . 1 . 2]" 1
1882 1 82 GLU H 1 83 ASP H . . 3.550 2.662 2.472 2.835 . 0 0 "[ . 1 . 2]" 1
1883 1 82 GLU H 1 83 ASP HA . . 5.170 4.720 4.476 4.941 . 0 0 "[ . 1 . 2]" 1
1884 1 82 GLU H 1 84 CYS H . . 4.590 3.804 3.450 4.135 . 0 0 "[ . 1 . 2]" 1
1885 1 82 GLU HA 1 83 ASP HB3 . . 5.360 5.075 4.338 5.811 0.451 18 0 "[ . 1 . 2]" 1
1886 1 82 GLU HA 1 87 MET ME . . 4.940 3.329 2.690 4.040 . 0 0 "[ . 1 . 2]" 1
1887 1 82 GLU HA 1 88 TYR QD . . 4.280 3.814 3.193 4.248 . 0 0 "[ . 1 . 2]" 1
1888 1 82 GLU HA 1 88 TYR QE . . 4.560 4.161 3.831 4.403 . 0 0 "[ . 1 . 2]" 1
1889 1 82 GLU HB2 1 83 ASP H . . 4.870 3.946 3.479 4.497 . 0 0 "[ . 1 . 2]" 1
1890 1 82 GLU HB2 1 88 TYR H . . 5.230 4.615 3.583 5.330 0.100 6 0 "[ . 1 . 2]" 1
1891 1 82 GLU HB2 1 88 TYR HB2 . . 4.610 3.384 2.431 4.135 . 0 0 "[ . 1 . 2]" 1
1892 1 82 GLU HB2 1 88 TYR HB3 . . 5.080 4.757 3.799 5.382 0.302 6 0 "[ . 1 . 2]" 1
1893 1 82 GLU HB2 1 88 TYR QD . . 3.510 3.227 2.133 4.032 0.522 6 1 "[ .+ 1 . 2]" 1
1894 1 82 GLU HG2 1 83 ASP H . . 5.070 4.557 3.847 5.095 0.025 6 0 "[ . 1 . 2]" 1
1895 1 82 GLU HG2 1 88 TYR QD . . 5.280 5.125 4.505 5.399 0.119 19 0 "[ . 1 . 2]" 1
1896 1 83 ASP H 1 83 ASP HA . . 2.920 2.229 2.145 2.323 . 0 0 "[ . 1 . 2]" 1
1897 1 83 ASP H 1 83 ASP HB2 . . 4.070 3.166 2.858 3.640 . 0 0 "[ . 1 . 2]" 1
1898 1 83 ASP H 1 83 ASP HB3 . . 4.200 3.871 3.566 4.129 . 0 0 "[ . 1 . 2]" 1
1899 1 83 ASP H 1 84 CYS H . . 3.570 2.878 2.656 3.061 . 0 0 "[ . 1 . 2]" 1
1900 1 83 ASP H 1 87 MET ME . . 5.500 4.590 3.944 5.269 . 0 0 "[ . 1 . 2]" 1
1901 1 83 ASP HA 1 84 CYS H . . 3.100 2.937 2.716 3.166 0.066 17 0 "[ . 1 . 2]" 1
1902 1 83 ASP HA 1 84 CYS HA . . 5.230 4.693 4.594 4.820 . 0 0 "[ . 1 . 2]" 1
1903 1 83 ASP HB2 1 84 CYS H . . 5.090 4.482 4.177 4.737 . 0 0 "[ . 1 . 2]" 1
1904 1 83 ASP HB2 1 86 SER QB . . 5.360 4.545 3.924 5.003 . 0 0 "[ . 1 . 2]" 1
1905 1 83 ASP HB2 1 87 MET H . . 4.670 4.331 3.371 4.708 0.038 6 0 "[ . 1 . 2]" 1
1906 1 83 ASP HB2 1 87 MET ME . . 3.720 3.114 2.070 3.820 0.100 16 0 "[ . 1 . 2]" 1
1907 1 83 ASP HB2 1 87 MET QG . . 4.790 3.167 2.151 3.617 . 0 0 "[ . 1 . 2]" 1
1908 1 83 ASP HB3 1 84 CYS H . . 4.850 4.206 3.707 4.533 . 0 0 "[ . 1 . 2]" 1
1909 1 83 ASP HB3 1 86 SER QB . . 5.070 3.316 2.965 3.721 . 0 0 "[ . 1 . 2]" 1
1910 1 83 ASP HB3 1 87 MET H . . 4.240 3.057 2.612 3.766 . 0 0 "[ . 1 . 2]" 1
1911 1 83 ASP HB3 1 87 MET HA . . 5.140 4.845 4.415 5.801 0.661 10 2 "[ . + . - 2]" 1
1912 1 83 ASP HB3 1 87 MET QB . . 3.210 2.734 2.166 3.951 0.741 18 4 "[ . * - . +*2]" 1
1913 1 83 ASP HB3 1 87 MET ME . . 4.560 3.424 2.320 3.792 . 0 0 "[ . 1 . 2]" 1
1914 1 83 ASP HB3 1 87 MET QG . . 3.840 2.325 1.997 2.758 . 0 0 "[ . 1 . 2]" 1
1915 1 83 ASP HB3 1 88 TYR H . . 4.990 4.528 3.848 5.577 0.587 18 2 "[ . - . + 2]" 1
1916 1 84 CYS H 1 84 CYS HB2 . . 3.480 3.360 2.311 3.739 0.259 2 0 "[ . 1 . 2]" 1
1917 1 84 CYS H 1 84 CYS HB3 . . 3.800 2.854 2.252 3.606 . 0 0 "[ . 1 . 2]" 1
1918 1 84 CYS H 1 85 PRO HA . . 4.930 4.907 4.795 4.999 0.069 17 0 "[ . 1 . 2]" 1
1919 1 84 CYS H 1 87 MET H . . 4.380 4.410 4.287 4.467 0.087 5 0 "[ . 1 . 2]" 1
1920 1 84 CYS H 1 88 TYR H . . 5.370 4.087 3.694 4.484 . 0 0 "[ . 1 . 2]" 1
1921 1 84 CYS H 1 115 TYR QE . . 5.490 4.820 3.852 5.587 0.097 6 0 "[ . 1 . 2]" 1
1922 1 84 CYS HA 1 85 PRO HA . . 3.080 2.529 2.324 2.743 . 0 0 "[ . 1 . 2]" 1
1923 1 84 CYS HA 1 85 PRO HB2 . . 4.770 4.799 4.713 4.887 0.117 4 0 "[ . 1 . 2]" 1
1924 1 84 CYS HA 1 85 PRO HB3 . . 5.410 4.654 4.457 4.809 . 0 0 "[ . 1 . 2]" 1
1925 1 84 CYS HA 1 86 SER H . . 3.500 2.722 2.467 2.880 . 0 0 "[ . 1 . 2]" 1
1926 1 84 CYS HA 1 86 SER QB . . 5.310 3.967 3.428 4.362 . 0 0 "[ . 1 . 2]" 1
1927 1 84 CYS HA 1 87 MET H . . 4.220 2.817 2.587 3.060 . 0 0 "[ . 1 . 2]" 1
1928 1 84 CYS HA 1 87 MET QB . . 4.620 3.812 3.482 4.120 . 0 0 "[ . 1 . 2]" 1
1929 1 84 CYS HA 1 88 TYR H . . 3.960 2.711 2.409 3.036 . 0 0 "[ . 1 . 2]" 1
1930 1 84 CYS HA 1 88 TYR QD . . 5.050 4.855 4.391 5.133 0.083 4 0 "[ . 1 . 2]" 1
1931 1 84 CYS HA 1 89 GLN HA . . 4.820 4.266 3.866 4.754 . 0 0 "[ . 1 . 2]" 1
1932 1 84 CYS HB2 1 85 PRO HA . . 4.060 2.524 2.044 3.770 . 0 0 "[ . 1 . 2]" 1
1933 1 84 CYS HB2 1 88 TYR H . . 4.710 4.257 3.330 4.801 0.091 12 0 "[ . 1 . 2]" 1
1934 1 84 CYS HB2 1 90 ARG H . . 5.270 4.362 3.348 5.323 0.053 10 0 "[ . 1 . 2]" 1
1935 1 84 CYS HB3 1 85 PRO HA . . 3.690 3.303 2.203 4.031 0.341 7 0 "[ . 1 . 2]" 1
1936 1 84 CYS HB3 1 89 GLN HA . . 4.570 3.562 2.452 4.789 0.219 7 0 "[ . 1 . 2]" 1
1937 1 84 CYS HB3 1 90 ARG H . . 5.500 4.556 3.719 5.467 . 0 0 "[ . 1 . 2]" 1
1938 1 84 CYS HB3 1 115 TYR QE . . 5.500 3.269 2.531 4.505 . 0 0 "[ . 1 . 2]" 1
1939 1 85 PRO HA 1 86 SER HA . . 5.180 4.927 4.840 5.029 . 0 0 "[ . 1 . 2]" 1
1940 1 85 PRO HA 1 87 MET H . . 5.500 4.801 4.595 5.060 . 0 0 "[ . 1 . 2]" 1
1941 1 85 PRO HA 1 88 TYR H . . 4.780 4.532 4.133 4.851 0.071 5 0 "[ . 1 . 2]" 1
1942 1 85 PRO HA 1 89 GLN HA . . 4.210 2.795 2.376 3.180 . 0 0 "[ . 1 . 2]" 1
1943 1 85 PRO HA 1 89 GLN HE21 . . 5.500 3.847 2.959 5.151 . 0 0 "[ . 1 . 2]" 1
1944 1 85 PRO HA 1 89 GLN HG2 . . 4.840 4.433 3.592 5.062 0.222 14 0 "[ . 1 . 2]" 1
1945 1 85 PRO HA 1 89 GLN HG3 . . 4.980 3.054 2.408 5.058 0.078 4 0 "[ . 1 . 2]" 1
1946 1 85 PRO HA 1 90 ARG H . . 5.500 4.847 4.083 5.578 0.078 17 0 "[ . 1 . 2]" 1
1947 1 85 PRO HB2 1 86 SER H . . 4.550 4.101 3.967 4.260 . 0 0 "[ . 1 . 2]" 1
1948 1 85 PRO HB3 1 89 GLN HG2 . . 5.180 4.495 3.103 5.637 0.457 4 0 "[ . 1 . 2]" 1
1949 1 85 PRO HD2 1 86 SER H . . 3.990 3.019 2.849 3.235 . 0 0 "[ . 1 . 2]" 1
1950 1 85 PRO HD3 1 86 SER H . . 4.450 4.120 3.995 4.224 . 0 0 "[ . 1 . 2]" 1
1951 1 85 PRO HG2 1 86 SER H . . 4.620 3.278 3.092 3.505 . 0 0 "[ . 1 . 2]" 1
1952 1 85 PRO HG2 1 86 SER HA . . 5.090 4.188 3.876 4.454 . 0 0 "[ . 1 . 2]" 1
1953 1 85 PRO HG3 1 86 SER H . . 5.430 4.652 4.491 4.822 . 0 0 "[ . 1 . 2]" 1
1954 1 86 SER H 1 86 SER QB . . 3.400 2.367 1.999 2.886 . 0 0 "[ . 1 . 2]" 1
1955 1 86 SER H 1 87 MET H . . 3.410 2.987 2.856 3.278 . 0 0 "[ . 1 . 2]" 1
1956 1 86 SER HA 1 89 GLN HE21 . . 5.500 4.703 4.067 5.545 0.045 6 0 "[ . 1 . 2]" 1
1957 1 86 SER QB 1 87 MET H . . 3.400 2.201 2.088 2.438 . 0 0 "[ . 1 . 2]" 1
1958 1 86 SER QB 1 87 MET HA . . 4.840 3.862 3.499 4.086 . 0 0 "[ . 1 . 2]" 1
1959 1 86 SER QB 1 87 MET QB . . 4.710 3.878 3.769 4.097 . 0 0 "[ . 1 . 2]" 1
1960 1 86 SER QB 1 87 MET QG . . 5.230 2.965 2.701 3.394 . 0 0 "[ . 1 . 2]" 1
1961 1 86 SER QB 1 88 TYR H . . 5.100 4.724 4.331 4.956 . 0 0 "[ . 1 . 2]" 1
1962 1 87 MET H 1 87 MET QB . . 3.190 2.323 2.190 2.475 . 0 0 "[ . 1 . 2]" 1
1963 1 87 MET H 1 87 MET ME . . 5.390 4.454 4.208 4.690 . 0 0 "[ . 1 . 2]" 1
1964 1 87 MET H 1 87 MET QG . . 4.290 2.663 2.404 2.994 . 0 0 "[ . 1 . 2]" 1
1965 1 87 MET H 1 88 TYR H . . 3.220 2.777 2.545 2.986 . 0 0 "[ . 1 . 2]" 1
1966 1 87 MET H 1 88 TYR QD . . 5.000 4.792 4.302 5.085 0.085 3 0 "[ . 1 . 2]" 1
1967 1 87 MET HA 1 87 MET ME . . 4.380 4.178 4.022 4.373 . 0 0 "[ . 1 . 2]" 1
1968 1 87 MET HA 1 87 MET QG . . 3.670 2.323 2.120 2.470 . 0 0 "[ . 1 . 2]" 1
1969 1 87 MET QB 1 87 MET ME . . 2.950 2.049 1.935 2.150 . 0 0 "[ . 1 . 2]" 1
1970 1 87 MET QB 1 88 TYR H . . 3.340 2.208 2.036 2.621 . 0 0 "[ . 1 . 2]" 1
1971 1 87 MET QB 1 88 TYR QD . . 3.300 2.603 2.302 2.942 . 0 0 "[ . 1 . 2]" 1
1972 1 87 MET QB 1 88 TYR QE . . 5.190 3.401 3.128 3.619 . 0 0 "[ . 1 . 2]" 1
1973 1 87 MET ME 1 88 TYR HA . . 5.500 5.503 5.329 5.603 0.103 12 0 "[ . 1 . 2]" 1
1974 1 87 MET ME 1 88 TYR QD . . 4.910 2.672 2.343 2.996 . 0 0 "[ . 1 . 2]" 1
1975 1 87 MET ME 1 88 TYR QE . . 3.800 2.260 2.073 2.453 . 0 0 "[ . 1 . 2]" 1
1976 1 87 MET QG 1 88 TYR H . . 5.000 4.079 3.966 4.205 . 0 0 "[ . 1 . 2]" 1
1977 1 87 MET QG 1 88 TYR QE . . 5.500 5.051 4.864 5.201 . 0 0 "[ . 1 . 2]" 1
1978 1 88 TYR H 1 88 TYR HB2 . . 3.820 2.449 2.294 2.722 . 0 0 "[ . 1 . 2]" 1
1979 1 88 TYR H 1 88 TYR HB3 . . 4.100 3.657 3.550 3.828 . 0 0 "[ . 1 . 2]" 1
1980 1 88 TYR H 1 88 TYR QD . . 3.570 2.730 2.406 3.089 . 0 0 "[ . 1 . 2]" 1
1981 1 88 TYR H 1 89 GLN H . . 5.020 4.509 4.390 4.557 . 0 0 "[ . 1 . 2]" 1
1982 1 88 TYR HA 1 88 TYR QD . . 3.550 2.915 2.494 3.228 . 0 0 "[ . 1 . 2]" 1
1983 1 88 TYR HA 1 89 GLN H . . 3.200 2.550 2.368 2.686 . 0 0 "[ . 1 . 2]" 1
1984 1 88 TYR HA 1 89 GLN HE21 . . 5.500 3.624 2.802 4.407 . 0 0 "[ . 1 . 2]" 1
1985 1 88 TYR HA 1 89 GLN HE22 . . 5.500 4.024 3.353 5.583 0.083 4 0 "[ . 1 . 2]" 1
1986 1 88 TYR HA 1 117 THR HA . . 3.990 3.300 2.469 3.669 . 0 0 "[ . 1 . 2]" 1
1987 1 88 TYR HA 1 117 THR HB . . 3.740 2.499 2.055 2.791 . 0 0 "[ . 1 . 2]" 1
1988 1 88 TYR HA 1 117 THR MG . . 3.990 3.957 3.662 4.107 0.117 11 0 "[ . 1 . 2]" 1
1989 1 88 TYR HB2 1 89 GLN H . . 4.180 3.539 3.339 3.664 . 0 0 "[ . 1 . 2]" 1
1990 1 88 TYR HB3 1 89 GLN H . . 3.620 2.336 2.088 2.520 . 0 0 "[ . 1 . 2]" 1
1991 1 88 TYR HB3 1 115 TYR HB2 . . 4.360 4.192 3.894 4.559 0.199 20 0 "[ . 1 . 2]" 1
1992 1 88 TYR HB3 1 115 TYR HB3 . . 4.480 2.497 2.177 2.877 . 0 0 "[ . 1 . 2]" 1
1993 1 88 TYR HB3 1 115 TYR QD . . 4.220 2.803 2.140 3.676 . 0 0 "[ . 1 . 2]" 1
1994 1 88 TYR HB3 1 116 THR H . . 4.880 3.600 2.902 4.384 . 0 0 "[ . 1 . 2]" 1
1995 1 88 TYR QD 1 89 GLN H . . 3.940 3.687 3.481 3.993 0.053 12 0 "[ . 1 . 2]" 1
1996 1 88 TYR QD 1 115 TYR HB2 . . 4.940 4.333 3.605 4.694 . 0 0 "[ . 1 . 2]" 1
1997 1 88 TYR QD 1 115 TYR HB3 . . 4.820 3.206 2.597 3.764 . 0 0 "[ . 1 . 2]" 1
1998 1 88 TYR QD 1 116 THR H . . 4.490 4.011 3.574 4.574 0.084 17 0 "[ . 1 . 2]" 1
1999 1 88 TYR QD 1 116 THR HA . . 4.200 3.191 2.170 3.624 . 0 0 "[ . 1 . 2]" 1
2000 1 88 TYR QD 1 117 THR HB . . 3.880 3.380 2.652 3.946 0.066 4 0 "[ . 1 . 2]" 1
2001 1 88 TYR QD 1 117 THR MG . . 4.560 3.351 2.710 4.089 . 0 0 "[ . 1 . 2]" 1
2002 1 88 TYR QE 1 116 THR HA . . 4.750 4.300 3.383 4.827 0.077 19 0 "[ . 1 . 2]" 1
2003 1 88 TYR QE 1 117 THR MG . . 4.180 3.519 2.865 4.255 0.075 11 0 "[ . 1 . 2]" 1
2004 1 89 GLN H 1 89 GLN HB3 . . 4.030 3.776 3.605 3.923 . 0 0 "[ . 1 . 2]" 1
2005 1 89 GLN H 1 89 GLN HE22 . . 5.500 4.707 4.226 5.998 0.498 4 0 "[ . 1 . 2]" 1
2006 1 89 GLN H 1 89 GLN QG . . 4.620 3.695 2.428 4.108 . 0 0 "[ . 1 . 2]" 1
2007 1 89 GLN H 1 89 GLN HG3 . . 5.060 3.968 3.130 4.516 . 0 0 "[ . 1 . 2]" 1
2008 1 89 GLN H 1 90 ARG H . . 4.980 3.530 1.705 4.396 . 0 0 "[ . 1 . 2]" 1
2009 1 89 GLN H 1 115 TYR QD . . 4.720 3.739 3.087 4.730 0.010 2 0 "[ . 1 . 2]" 1
2010 1 89 GLN H 1 116 THR H . . 4.030 3.114 2.535 3.997 . 0 0 "[ . 1 . 2]" 1
2011 1 89 GLN H 1 116 THR HA . . 4.800 4.655 4.086 4.876 0.076 20 0 "[ . 1 . 2]" 1
2012 1 89 GLN H 1 116 THR MG . . 5.490 5.274 4.767 5.595 0.105 3 0 "[ . 1 . 2]" 1
2013 1 89 GLN H 1 117 THR HA . . 4.210 3.223 2.844 3.809 . 0 0 "[ . 1 . 2]" 1
2014 1 89 GLN H 1 117 THR HB . . 4.660 4.035 3.570 4.718 0.058 12 0 "[ . 1 . 2]" 1
2015 1 89 GLN H 1 117 THR MG . . 5.490 4.986 4.689 5.267 . 0 0 "[ . 1 . 2]" 1
2016 1 89 GLN HA 1 89 GLN HG2 . . 4.130 3.441 2.851 3.743 . 0 0 "[ . 1 . 2]" 1
2017 1 89 GLN HA 1 89 GLN HG3 . . 3.730 2.533 2.148 4.209 0.479 14 0 "[ . 1 . 2]" 1
2018 1 89 GLN HA 1 90 ARG H . . 3.200 2.578 2.126 3.276 0.076 20 0 "[ . 1 . 2]" 1
2019 1 89 GLN HA 1 90 ARG HB2 . . 4.960 4.666 4.341 4.996 0.036 20 0 "[ . 1 . 2]" 1
2020 1 89 GLN HA 1 90 ARG HB3 . . 4.930 4.576 4.341 4.919 . 0 0 "[ . 1 . 2]" 1
2021 1 89 GLN HB2 1 90 ARG H . . 3.940 3.739 2.775 4.357 0.417 7 0 "[ . 1 . 2]" 1
2022 1 89 GLN HB3 1 90 ARG H . . 4.290 3.345 2.307 4.022 . 0 0 "[ . 1 . 2]" 1
2023 1 89 GLN HE21 1 117 THR HA . . 4.830 4.133 3.297 4.727 . 0 0 "[ . 1 . 2]" 1
2024 1 89 GLN HE21 1 118 ALA H . . 5.200 4.513 3.986 4.792 . 0 0 "[ . 1 . 2]" 1
2025 1 89 GLN HE21 1 118 ALA MB . . 5.500 5.436 4.980 5.603 0.103 7 0 "[ . 1 . 2]" 1
2026 1 89 GLN HE21 1 119 THR H . . 5.170 5.115 4.476 5.249 0.079 2 0 "[ . 1 . 2]" 1
2027 1 89 GLN HE21 1 119 THR MG . . 4.360 3.647 3.118 4.456 0.096 10 0 "[ . 1 . 2]" 1
2028 1 89 GLN HE22 1 117 THR HA . . 4.960 3.592 2.534 4.508 . 0 0 "[ . 1 . 2]" 1
2029 1 89 GLN HE22 1 118 ALA H . . 4.550 3.433 2.531 4.452 . 0 0 "[ . 1 . 2]" 1
2030 1 89 GLN HE22 1 118 ALA MB . . 5.230 4.588 3.934 5.293 0.063 10 0 "[ . 1 . 2]" 1
2031 1 89 GLN HE22 1 119 THR H . . 5.140 3.638 2.867 4.502 . 0 0 "[ . 1 . 2]" 1
2032 1 89 GLN HE22 1 119 THR MG . . 3.950 2.466 1.777 3.138 . 0 0 "[ . 1 . 2]" 1
2033 1 89 GLN QG 1 90 ARG H . . 4.900 4.202 3.546 4.636 . 0 0 "[ . 1 . 2]" 1
2034 1 89 GLN HG2 1 90 ARG H . . 5.410 5.000 4.318 5.491 0.081 20 0 "[ . 1 . 2]" 1
2035 1 89 GLN HG2 1 118 ALA H . . 5.500 4.828 3.494 5.576 0.076 7 0 "[ . 1 . 2]" 1
2036 1 89 GLN HG2 1 118 ALA MB . . 5.500 4.644 3.911 5.524 0.024 7 0 "[ . 1 . 2]" 1
2037 1 89 GLN HG3 1 90 ARG H . . 5.310 4.537 3.744 5.003 . 0 0 "[ . 1 . 2]" 1
2038 1 89 GLN HG3 1 119 THR MG . . 5.500 4.877 4.107 5.556 0.056 10 0 "[ . 1 . 2]" 1
2039 1 90 ARG H 1 90 ARG HB2 . . 3.650 2.868 2.491 3.208 . 0 0 "[ . 1 . 2]" 1
2040 1 90 ARG H 1 90 ARG HB3 . . 3.450 2.759 2.252 3.673 0.223 6 0 "[ . 1 . 2]" 1
2041 1 90 ARG H 1 90 ARG HE . . 5.500 4.759 3.833 5.567 0.067 17 0 "[ . 1 . 2]" 1
2042 1 90 ARG H 1 90 ARG HG2 . . 5.140 4.566 4.465 4.730 . 0 0 "[ . 1 . 2]" 1
2043 1 90 ARG H 1 90 ARG HG3 . . 5.110 4.842 4.600 5.197 0.087 20 0 "[ . 1 . 2]" 1
2044 1 90 ARG H 1 91 THR H . . 5.020 4.456 3.979 4.681 . 0 0 "[ . 1 . 2]" 1
2045 1 90 ARG H 1 115 TYR QD . . 5.450 3.557 2.649 4.818 . 0 0 "[ . 1 . 2]" 1
2046 1 90 ARG H 1 115 TYR QE . . 5.450 3.986 2.790 5.149 . 0 0 "[ . 1 . 2]" 1
2047 1 90 ARG HA 1 90 ARG HD3 . . 5.090 4.732 4.581 4.944 . 0 0 "[ . 1 . 2]" 1
2048 1 90 ARG HA 1 90 ARG HG2 . . 3.970 2.522 2.360 2.706 . 0 0 "[ . 1 . 2]" 1
2049 1 90 ARG HA 1 91 THR H . . 2.910 2.221 2.121 2.340 . 0 0 "[ . 1 . 2]" 1
2050 1 90 ARG HA 1 115 TYR HA . . 3.860 2.251 1.968 2.857 . 0 0 "[ . 1 . 2]" 1
2051 1 90 ARG HA 1 115 TYR QD . . 4.770 3.221 2.428 3.883 . 0 0 "[ . 1 . 2]" 1
2052 1 90 ARG HA 1 116 THR H . . 4.140 3.126 2.101 4.023 . 0 0 "[ . 1 . 2]" 1
2053 1 90 ARG HB2 1 90 ARG HE . . 4.790 3.199 2.785 3.414 . 0 0 "[ . 1 . 2]" 1
2054 1 90 ARG HB2 1 91 THR H . . 5.110 4.210 3.900 4.448 . 0 0 "[ . 1 . 2]" 1
2055 1 90 ARG HB2 1 115 TYR QD . . 4.630 3.235 2.101 4.024 . 0 0 "[ . 1 . 2]" 1
2056 1 90 ARG HB2 1 115 TYR QE . . 4.020 2.659 2.229 3.098 . 0 0 "[ . 1 . 2]" 1
2057 1 90 ARG HB3 1 90 ARG HE . . 5.030 2.081 1.767 2.847 . 0 0 "[ . 1 . 2]" 1
2058 1 90 ARG HB3 1 115 TYR QD . . 5.500 4.563 3.703 5.217 . 0 0 "[ . 1 . 2]" 1
2059 1 90 ARG HB3 1 115 TYR QE . . 4.790 3.932 3.692 4.281 . 0 0 "[ . 1 . 2]" 1
2060 1 90 ARG HD2 1 91 THR H . . 5.230 3.433 2.880 4.063 . 0 0 "[ . 1 . 2]" 1
2061 1 90 ARG HD2 1 92 ALA H . . 4.610 4.674 4.601 4.696 0.086 4 0 "[ . 1 . 2]" 1
2062 1 90 ARG HD2 1 92 ALA MB . . 5.500 4.606 4.150 5.227 . 0 0 "[ . 1 . 2]" 1
2063 1 90 ARG HD2 1 113 PHE QD . . 5.490 3.009 2.445 4.852 . 0 0 "[ . 1 . 2]" 1
2064 1 90 ARG HD3 1 91 THR HA . . 5.480 4.847 4.541 5.156 . 0 0 "[ . 1 . 2]" 1
2065 1 90 ARG HD3 1 113 PHE HB2 . . 4.940 3.836 3.457 5.014 0.074 9 0 "[ . 1 . 2]" 1
2066 1 90 ARG HD3 1 113 PHE QD . . 4.670 2.728 2.171 4.004 . 0 0 "[ . 1 . 2]" 1
2067 1 90 ARG HE 1 115 TYR QE . . 5.500 4.988 4.421 5.555 0.055 14 0 "[ . 1 . 2]" 1
2068 1 90 ARG HG2 1 91 THR H . . 4.390 2.703 2.252 3.039 . 0 0 "[ . 1 . 2]" 1
2069 1 90 ARG HG2 1 113 PHE HA . . 5.280 4.215 3.828 4.369 . 0 0 "[ . 1 . 2]" 1
2070 1 90 ARG HG2 1 113 PHE HB2 . . 4.620 4.015 3.643 4.355 . 0 0 "[ . 1 . 2]" 1
2071 1 90 ARG HG2 1 113 PHE HB3 . . 4.450 2.472 2.213 2.718 . 0 0 "[ . 1 . 2]" 1
2072 1 90 ARG HG2 1 113 PHE QD . . 4.940 3.778 3.453 4.187 . 0 0 "[ . 1 . 2]" 1
2073 1 90 ARG HG2 1 114 VAL H . . 4.910 3.439 2.943 4.051 . 0 0 "[ . 1 . 2]" 1
2074 1 90 ARG HG3 1 91 THR H . . 5.150 4.357 3.906 4.678 . 0 0 "[ . 1 . 2]" 1
2075 1 90 ARG HG3 1 113 PHE HA . . 5.440 5.403 4.892 5.519 0.079 5 0 "[ . 1 . 2]" 1
2076 1 90 ARG HG3 1 113 PHE HB2 . . 5.150 4.246 3.845 4.530 . 0 0 "[ . 1 . 2]" 1
2077 1 90 ARG HG3 1 113 PHE HB3 . . 3.990 3.147 2.757 3.458 . 0 0 "[ . 1 . 2]" 1
2078 1 90 ARG HG3 1 113 PHE QD . . 4.330 4.377 4.163 4.424 0.094 1 0 "[ . 1 . 2]" 1
2079 1 91 THR H 1 91 THR HB . . 3.750 2.745 2.575 3.021 . 0 0 "[ . 1 . 2]" 1
2080 1 91 THR H 1 91 THR MG . . 4.600 3.932 3.785 4.071 . 0 0 "[ . 1 . 2]" 1
2081 1 91 THR H 1 92 ALA H . . 5.470 4.380 4.241 4.480 . 0 0 "[ . 1 . 2]" 1
2082 1 91 THR H 1 113 PHE HA . . 4.740 4.362 3.995 4.776 0.036 12 0 "[ . 1 . 2]" 1
2083 1 91 THR H 1 114 VAL H . . 3.630 2.890 2.695 3.087 . 0 0 "[ . 1 . 2]" 1
2084 1 91 THR H 1 114 VAL QG . . 5.450 4.243 3.067 4.799 . 0 0 "[ . 1 . 2]" 1
2085 1 91 THR H 1 115 TYR HA . . 4.480 3.386 2.655 3.942 . 0 0 "[ . 1 . 2]" 1
2086 1 91 THR H 1 115 TYR QD . . 5.500 5.004 4.375 5.583 0.083 3 0 "[ . 1 . 2]" 1
2087 1 91 THR H 1 116 THR H . . 4.450 3.619 3.004 4.150 . 0 0 "[ . 1 . 2]" 1
2088 1 91 THR H 1 116 THR MG . . 5.330 3.793 3.012 5.105 . 0 0 "[ . 1 . 2]" 1
2089 1 91 THR HA 1 91 THR MG . . 3.140 2.392 2.211 2.543 . 0 0 "[ . 1 . 2]" 1
2090 1 91 THR HA 1 92 ALA H . . 2.830 2.417 2.158 2.604 . 0 0 "[ . 1 . 2]" 1
2091 1 91 THR HA 1 92 ALA MB . . 4.140 4.008 3.868 4.153 0.013 15 0 "[ . 1 . 2]" 1
2092 1 91 THR HA 1 113 PHE QD . . 4.510 4.287 3.579 4.604 0.094 9 0 "[ . 1 . 2]" 1
2093 1 91 THR HB 1 92 ALA HA . . 5.110 4.728 4.401 5.038 . 0 0 "[ . 1 . 2]" 1
2094 1 91 THR HB 1 92 ALA MB . . 5.090 5.044 4.801 5.188 0.098 11 0 "[ . 1 . 2]" 1
2095 1 91 THR HB 1 93 LEU H . . 5.500 5.555 5.378 5.594 0.094 15 0 "[ . 1 . 2]" 1
2096 1 91 THR HB 1 93 LEU HB3 . . 4.680 4.350 3.894 4.740 0.060 14 0 "[ . 1 . 2]" 1
2097 1 91 THR HB 1 114 VAL H . . 5.050 4.141 3.807 4.582 . 0 0 "[ . 1 . 2]" 1
2098 1 91 THR HB 1 114 VAL HB . . 4.660 4.358 3.560 4.748 0.088 15 0 "[ . 1 . 2]" 1
2099 1 91 THR HB 1 116 THR MG . . 3.930 2.822 2.099 4.008 0.078 12 0 "[ . 1 . 2]" 1
2100 1 91 THR MG 1 92 ALA H . . 3.510 2.075 1.848 2.321 . 0 0 "[ . 1 . 2]" 1
2101 1 91 THR MG 1 92 ALA HA . . 5.120 4.089 3.866 4.299 . 0 0 "[ . 1 . 2]" 1
2102 1 91 THR MG 1 92 ALA MB . . 3.710 3.562 3.237 3.815 0.105 4 0 "[ . 1 . 2]" 1
2103 1 91 THR MG 1 93 LEU HB3 . . 3.960 3.856 3.276 4.074 0.114 15 0 "[ . 1 . 2]" 1
2104 1 91 THR MG 1 113 PHE QD . . 5.410 5.215 4.707 5.501 0.091 5 0 "[ . 1 . 2]" 1
2105 1 91 THR MG 1 114 VAL H . . 5.500 5.037 4.810 5.285 . 0 0 "[ . 1 . 2]" 1
2106 1 92 ALA H 1 92 ALA MB . . 2.990 2.341 2.123 2.478 . 0 0 "[ . 1 . 2]" 1
2107 1 92 ALA H 1 93 LEU H . . 5.300 4.429 4.272 4.589 . 0 0 "[ . 1 . 2]" 1
2108 1 92 ALA H 1 113 PHE QD . . 4.910 4.042 3.515 4.307 . 0 0 "[ . 1 . 2]" 1
2109 1 92 ALA H 1 113 PHE QE . . 5.160 4.855 3.807 5.243 0.083 18 0 "[ . 1 . 2]" 1
2110 1 92 ALA HA 1 93 LEU H . . 2.860 2.164 1.995 2.326 . 0 0 "[ . 1 . 2]" 1
2111 1 92 ALA HA 1 93 LEU QD . . 5.450 3.024 2.417 3.309 . 0 0 "[ . 1 . 2]" 1
2112 1 92 ALA HA 1 111 GLN HE21 . . 3.350 3.314 2.909 3.441 0.091 4 0 "[ . 1 . 2]" 1
2113 1 92 ALA HA 1 111 GLN QG . . 5.190 3.904 3.156 4.591 . 0 0 "[ . 1 . 2]" 1
2114 1 92 ALA HA 1 112 CYS H . . 5.500 4.625 4.126 5.010 . 0 0 "[ . 1 . 2]" 1
2115 1 92 ALA HA 1 113 PHE QD . . 4.220 2.905 2.157 3.462 . 0 0 "[ . 1 . 2]" 1
2116 1 92 ALA MB 1 93 LEU H . . 3.430 2.986 2.679 3.243 . 0 0 "[ . 1 . 2]" 1
2117 1 92 ALA MB 1 93 LEU HB3 . . 5.230 4.853 4.698 5.034 . 0 0 "[ . 1 . 2]" 1
2118 1 92 ALA MB 1 111 GLN QB . . 5.260 4.332 3.924 4.992 . 0 0 "[ . 1 . 2]" 1
2119 1 92 ALA MB 1 111 GLN HE22 . . 5.500 2.930 2.455 3.930 . 0 0 "[ . 1 . 2]" 1
2120 1 92 ALA MB 1 111 GLN QG . . 3.400 2.547 2.095 3.196 . 0 0 "[ . 1 . 2]" 1
2121 1 92 ALA MB 1 112 CYS H . . 4.960 4.587 3.744 5.058 0.098 11 0 "[ . 1 . 2]" 1
2122 1 92 ALA MB 1 113 PHE QD . . 3.470 2.758 2.290 3.572 0.102 5 0 "[ . 1 . 2]" 1
2123 1 92 ALA MB 1 113 PHE QE . . 3.490 2.492 2.229 3.574 0.084 5 0 "[ . 1 . 2]" 1
2124 1 93 LEU H 1 93 LEU HB2 . . 4.120 3.904 3.776 3.989 . 0 0 "[ . 1 . 2]" 1
2125 1 93 LEU H 1 93 LEU HB3 . . 3.440 3.117 2.837 3.385 . 0 0 "[ . 1 . 2]" 1
2126 1 93 LEU H 1 93 LEU QD . . 4.120 1.956 1.661 2.128 . 0 0 "[ . 1 . 2]" 1
2127 1 93 LEU H 1 93 LEU HG . . 4.180 3.930 3.291 4.235 0.055 15 0 "[ . 1 . 2]" 1
2128 1 93 LEU H 1 94 GLN H . . 4.940 4.379 4.274 4.473 . 0 0 "[ . 1 . 2]" 1
2129 1 93 LEU H 1 95 VAL QG . . 5.500 4.481 3.983 4.978 . 0 0 "[ . 1 . 2]" 1
2130 1 93 LEU H 1 111 GLN HA . . 5.390 4.183 3.214 4.803 . 0 0 "[ . 1 . 2]" 1
2131 1 93 LEU H 1 111 GLN QG . . 4.240 3.206 2.596 3.834 . 0 0 "[ . 1 . 2]" 1
2132 1 93 LEU H 1 112 CYS H . . 3.970 3.294 2.983 3.921 . 0 0 "[ . 1 . 2]" 1
2133 1 93 LEU H 1 112 CYS HB2 . . 5.500 5.084 4.077 6.226 0.726 18 2 "[ . 1 - + 2]" 1
2134 1 93 LEU H 1 113 PHE QD . . 5.300 4.850 4.108 5.341 0.041 5 0 "[ . 1 . 2]" 1
2135 1 93 LEU HA 1 93 LEU QD . . 3.920 3.242 3.129 3.340 . 0 0 "[ . 1 . 2]" 1
2136 1 93 LEU HA 1 94 GLN H . . 3.030 2.644 2.485 2.907 . 0 0 "[ . 1 . 2]" 1
2137 1 93 LEU HA 1 94 GLN HA . . 4.990 4.445 4.084 4.641 . 0 0 "[ . 1 . 2]" 1
2138 1 93 LEU HB2 1 94 GLN H . . 3.670 2.272 1.844 2.401 . 0 0 "[ . 1 . 2]" 1
2139 1 93 LEU HB2 1 95 VAL QG . . 5.220 4.542 4.370 4.869 . 0 0 "[ . 1 . 2]" 1
2140 1 93 LEU HB3 1 93 LEU HG . . 2.770 2.492 2.234 2.871 0.101 5 0 "[ . 1 . 2]" 1
2141 1 93 LEU HB3 1 94 GLN H . . 3.710 3.709 3.340 3.793 0.083 4 0 "[ . 1 . 2]" 1
2142 1 93 LEU HB3 1 95 VAL QG . . 5.140 4.990 4.801 5.143 0.003 5 0 "[ . 1 . 2]" 1
2143 1 93 LEU HB3 1 114 VAL HB . . 4.870 3.877 2.856 4.423 . 0 0 "[ . 1 . 2]" 1
2144 1 93 LEU HB3 1 114 VAL QG . . 4.290 3.808 2.020 4.229 . 0 0 "[ . 1 . 2]" 1
2145 1 93 LEU QD 1 94 GLN H . . 4.150 2.662 2.199 3.394 . 0 0 "[ . 1 . 2]" 1
2146 1 93 LEU QD 1 94 GLN HA . . 5.100 3.460 2.930 4.676 . 0 0 "[ . 1 . 2]" 1
2147 1 93 LEU QD 1 95 VAL QG . . 4.660 2.014 1.714 3.162 . 0 0 "[ . 1 . 2]" 1
2148 1 93 LEU QD 1 112 CYS H . . 3.820 2.668 2.147 3.801 . 0 0 "[ . 1 . 2]" 1
2149 1 93 LEU QD 1 112 CYS HB2 . . 4.110 3.160 1.977 4.240 0.130 12 0 "[ . 1 . 2]" 1
2150 1 93 LEU QD 1 112 CYS HB3 . . 4.320 3.689 2.861 4.308 . 0 0 "[ . 1 . 2]" 1
2151 1 93 LEU QD 1 113 PHE H . . 5.500 4.086 3.601 4.564 . 0 0 "[ . 1 . 2]" 1
2152 1 93 LEU QD 1 113 PHE HA . . 4.680 3.106 2.616 3.748 . 0 0 "[ . 1 . 2]" 1
2153 1 93 LEU QD 1 114 VAL HB . . 5.500 2.336 1.747 3.863 . 0 0 "[ . 1 . 2]" 1
2154 1 93 LEU HG 1 94 GLN H . . 4.480 3.815 2.505 4.456 . 0 0 "[ . 1 . 2]" 1
2155 1 93 LEU HG 1 95 VAL QG . . 3.670 3.457 2.716 3.752 0.082 10 0 "[ . 1 . 2]" 1
2156 1 93 LEU HG 1 114 VAL HB . . 3.280 3.261 2.644 3.398 0.118 6 0 "[ . 1 . 2]" 1
2157 1 93 LEU HG 1 114 VAL QG . . 3.030 2.648 1.848 3.049 0.019 19 0 "[ . 1 . 2]" 1
2158 1 94 GLN H 1 94 GLN HB2 . . 3.070 2.822 2.479 3.105 0.035 6 0 "[ . 1 . 2]" 1
2159 1 94 GLN H 1 95 VAL QG . . 5.500 4.097 3.821 4.387 . 0 0 "[ . 1 . 2]" 1
2160 1 94 GLN HA 1 94 GLN HE21 . . 4.650 2.587 1.861 3.339 . 0 0 "[ . 1 . 2]" 1
2161 1 94 GLN HA 1 94 GLN HG3 . . 3.420 2.930 2.685 3.068 . 0 0 "[ . 1 . 2]" 1
2162 1 94 GLN HA 1 95 VAL H . . 2.900 2.213 2.148 2.297 . 0 0 "[ . 1 . 2]" 1
2163 1 94 GLN HA 1 95 VAL HA . . 4.880 4.504 4.450 4.560 . 0 0 "[ . 1 . 2]" 1
2164 1 94 GLN HA 1 95 VAL QG . . 4.620 3.555 3.054 3.777 . 0 0 "[ . 1 . 2]" 1
2165 1 94 GLN HA 1 110 VAL H . . 5.180 4.507 3.717 5.165 . 0 0 "[ . 1 . 2]" 1
2166 1 94 GLN HA 1 111 GLN H . . 5.220 5.077 4.651 5.276 0.056 11 0 "[ . 1 . 2]" 1
2167 1 94 GLN HA 1 111 GLN HA . . 3.280 2.861 2.249 3.311 0.031 15 0 "[ . 1 . 2]" 1
2168 1 94 GLN HA 1 111 GLN QG . . 4.560 4.246 3.616 4.512 . 0 0 "[ . 1 . 2]" 1
2169 1 94 GLN HA 1 112 CYS H . . 4.130 3.873 3.300 4.211 0.081 15 0 "[ . 1 . 2]" 1
2170 1 94 GLN HB2 1 94 GLN HE21 . . 3.990 3.732 3.145 4.074 0.084 18 0 "[ . 1 . 2]" 1
2171 1 94 GLN HB2 1 95 VAL H . . 4.620 4.374 4.152 4.539 . 0 0 "[ . 1 . 2]" 1
2172 1 94 GLN HE21 1 94 GLN HG3 . . 3.480 2.481 2.183 2.871 . 0 0 "[ . 1 . 2]" 1
2173 1 94 GLN HE21 1 95 VAL H . . 5.500 2.678 2.233 3.309 . 0 0 "[ . 1 . 2]" 1
2174 1 94 GLN HE21 1 109 SER QB . . 4.480 2.549 1.970 3.119 . 0 0 "[ . 1 . 2]" 1
2175 1 94 GLN HE21 1 110 VAL H . . 5.500 3.018 2.396 3.698 . 0 0 "[ . 1 . 2]" 1
2176 1 94 GLN HE21 1 111 GLN H . . 5.500 4.307 4.059 4.677 . 0 0 "[ . 1 . 2]" 1
2177 1 94 GLN HE22 1 109 SER QB . . 5.380 3.253 2.740 4.157 . 0 0 "[ . 1 . 2]" 1
2178 1 94 GLN HE22 1 110 VAL HA . . 4.590 3.740 2.936 4.224 . 0 0 "[ . 1 . 2]" 1
2179 1 94 GLN HE22 1 111 GLN H . . 4.990 4.277 3.257 5.045 0.055 16 0 "[ . 1 . 2]" 1
2180 1 94 GLN HE22 1 111 GLN HA . . 5.500 4.246 3.269 5.004 . 0 0 "[ . 1 . 2]" 1
2181 1 94 GLN HG3 1 95 VAL H . . 3.780 2.972 2.403 3.441 . 0 0 "[ . 1 . 2]" 1
2182 1 94 GLN HG3 1 109 SER HA . . 5.130 4.806 4.362 5.195 0.065 4 0 "[ . 1 . 2]" 1
2183 1 94 GLN HG3 1 109 SER QB . . 3.550 2.656 2.071 3.270 . 0 0 "[ . 1 . 2]" 1
2184 1 94 GLN HG3 1 110 VAL H . . 4.670 4.205 3.459 4.725 0.055 7 0 "[ . 1 . 2]" 1
2185 1 95 VAL H 1 95 VAL HB . . 3.240 2.664 2.346 3.127 . 0 0 "[ . 1 . 2]" 1
2186 1 95 VAL H 1 95 VAL QG . . 3.620 2.687 2.163 2.992 . 0 0 "[ . 1 . 2]" 1
2187 1 95 VAL H 1 96 GLN H . . 5.490 4.404 4.242 4.569 . 0 0 "[ . 1 . 2]" 1
2188 1 95 VAL H 1 109 SER HA . . 5.070 4.568 3.937 5.045 . 0 0 "[ . 1 . 2]" 1
2189 1 95 VAL H 1 109 SER QB . . 4.870 3.592 2.633 4.542 . 0 0 "[ . 1 . 2]" 1
2190 1 95 VAL H 1 110 VAL H . . 3.950 2.829 1.853 3.375 . 0 0 "[ . 1 . 2]" 1
2191 1 95 VAL H 1 110 VAL QG . . 4.520 3.304 3.026 3.742 . 0 0 "[ . 1 . 2]" 1
2192 1 95 VAL H 1 111 GLN H . . 4.980 4.986 4.748 5.071 0.091 19 0 "[ . 1 . 2]" 1
2193 1 95 VAL H 1 111 GLN HA . . 4.190 3.654 2.982 4.253 0.063 6 0 "[ . 1 . 2]" 1
2194 1 95 VAL HA 1 96 GLN H . . 3.020 2.247 1.957 2.378 . 0 0 "[ . 1 . 2]" 1
2195 1 95 VAL HB 1 96 GLN H . . 4.580 4.089 3.646 4.327 . 0 0 "[ . 1 . 2]" 1
2196 1 95 VAL HB 1 110 VAL H . . 4.090 3.829 3.494 4.211 0.121 6 0 "[ . 1 . 2]" 1
2197 1 95 VAL HB 1 110 VAL QG . . 4.040 2.728 2.197 4.087 0.047 18 0 "[ . 1 . 2]" 1
2198 1 95 VAL QG 1 96 GLN H . . 3.470 2.606 2.182 2.921 . 0 0 "[ . 1 . 2]" 1
2199 1 95 VAL QG 1 96 GLN HA . . 4.850 4.072 3.866 4.263 . 0 0 "[ . 1 . 2]" 1
2200 1 95 VAL QG 1 96 GLN HB2 . . 5.500 4.763 4.524 5.082 . 0 0 "[ . 1 . 2]" 1
2201 1 95 VAL QG 1 96 GLN HB3 . . 5.110 4.045 3.768 4.297 . 0 0 "[ . 1 . 2]" 1
2202 1 95 VAL QG 1 97 VAL H . . 5.500 4.540 4.100 4.771 . 0 0 "[ . 1 . 2]" 1
2203 1 95 VAL QG 1 97 VAL HA . . 5.060 3.873 3.276 4.429 . 0 0 "[ . 1 . 2]" 1
2204 1 95 VAL QG 1 110 VAL H . . 5.500 3.700 2.157 4.230 . 0 0 "[ . 1 . 2]" 1
2205 1 95 VAL QG 1 110 VAL QG . . 4.200 2.621 1.819 3.124 . 0 0 "[ . 1 . 2]" 1
2206 1 95 VAL QG 1 112 CYS H . . 3.990 3.208 2.655 4.006 0.016 19 0 "[ . 1 . 2]" 1
2207 1 95 VAL QG 1 112 CYS HB2 . . 3.620 2.974 2.007 4.128 0.508 18 1 "[ . 1 . + 2]" 1
2208 1 95 VAL QG 1 112 CYS HB3 . . 4.190 3.401 2.430 4.059 . 0 0 "[ . 1 . 2]" 1
2209 1 96 GLN H 1 96 GLN HB2 . . 3.420 2.857 2.550 3.228 . 0 0 "[ . 1 . 2]" 1
2210 1 96 GLN H 1 96 GLN HB3 . . 3.420 2.370 2.166 2.648 . 0 0 "[ . 1 . 2]" 1
2211 1 96 GLN H 1 96 GLN HG2 . . 4.580 4.268 3.982 4.566 . 0 0 "[ . 1 . 2]" 1
2212 1 96 GLN H 1 97 VAL H . . 4.940 4.474 4.240 4.651 . 0 0 "[ . 1 . 2]" 1
2213 1 96 GLN H 1 97 VAL QG . . 5.420 5.150 4.899 5.271 . 0 0 "[ . 1 . 2]" 1
2214 1 96 GLN H 1 109 SER HA . . 5.360 4.605 4.034 4.873 . 0 0 "[ . 1 . 2]" 1
2215 1 96 GLN HA 1 96 GLN QE . . 5.500 4.539 4.052 4.911 . 0 0 "[ . 1 . 2]" 1
2216 1 96 GLN HA 1 96 GLN HG2 . . 3.820 3.257 2.937 3.640 . 0 0 "[ . 1 . 2]" 1
2217 1 96 GLN HA 1 96 GLN HG3 . . 3.650 2.596 2.274 2.872 . 0 0 "[ . 1 . 2]" 1
2218 1 96 GLN HA 1 97 VAL H . . 2.970 2.194 1.991 2.292 . 0 0 "[ . 1 . 2]" 1
2219 1 96 GLN HA 1 97 VAL HA . . 4.760 4.457 4.327 4.543 . 0 0 "[ . 1 . 2]" 1
2220 1 96 GLN HA 1 97 VAL QG . . 4.550 3.505 3.339 3.663 . 0 0 "[ . 1 . 2]" 1
2221 1 96 GLN HA 1 108 ASP QB . . 5.500 4.758 3.950 5.266 . 0 0 "[ . 1 . 2]" 1
2222 1 96 GLN HA 1 109 SER HA . . 3.240 2.238 2.056 2.488 . 0 0 "[ . 1 . 2]" 1
2223 1 96 GLN HA 1 109 SER QB . . 3.880 2.661 2.121 3.329 . 0 0 "[ . 1 . 2]" 1
2224 1 96 GLN HA 1 110 VAL H . . 4.540 3.765 3.450 4.264 . 0 0 "[ . 1 . 2]" 1
2225 1 96 GLN HB2 1 96 GLN HG2 . . 2.900 3.016 2.922 3.067 0.167 17 0 "[ . 1 . 2]" 1
2226 1 96 GLN HB2 1 97 VAL H . . 5.110 4.040 3.833 4.265 . 0 0 "[ . 1 . 2]" 1
2227 1 96 GLN HB2 1 109 SER HA . . 5.180 4.512 4.199 4.881 . 0 0 "[ . 1 . 2]" 1
2228 1 96 GLN HB2 1 109 SER QB . . 4.570 3.830 3.408 4.454 . 0 0 "[ . 1 . 2]" 1
2229 1 96 GLN HB3 1 97 VAL H . . 4.780 4.147 3.893 4.373 . 0 0 "[ . 1 . 2]" 1
2230 1 96 GLN QE 1 97 VAL H . . 5.500 4.535 3.836 5.252 . 0 0 "[ . 1 . 2]" 1
2231 1 96 GLN QE 1 98 LEU HA . . 5.500 4.368 3.187 5.158 . 0 0 "[ . 1 . 2]" 1
2232 1 96 GLN QE 1 98 LEU QD . . 4.320 3.433 2.481 3.871 . 0 0 "[ . 1 . 2]" 1
2233 1 96 GLN QE 1 108 ASP QB . . 5.260 3.984 3.531 4.743 . 0 0 "[ . 1 . 2]" 1
2234 1 96 GLN HG2 1 97 VAL H . . 3.970 2.994 2.731 3.540 . 0 0 "[ . 1 . 2]" 1
2235 1 96 GLN HG2 1 98 LEU H . . 5.400 3.710 2.993 4.330 . 0 0 "[ . 1 . 2]" 1
2236 1 96 GLN HG2 1 98 LEU HA . . 5.500 3.364 2.970 3.756 . 0 0 "[ . 1 . 2]" 1
2237 1 96 GLN HG2 1 98 LEU QD . . 3.860 2.356 2.049 2.995 . 0 0 "[ . 1 . 2]" 1
2238 1 96 GLN HG2 1 109 SER HA . . 5.330 5.028 4.628 5.327 . 0 0 "[ . 1 . 2]" 1
2239 1 96 GLN HG2 1 109 SER QB . . 5.490 5.339 4.904 5.880 0.390 1 0 "[ . 1 . 2]" 1
2240 1 96 GLN HG3 1 97 VAL H . . 3.930 2.720 2.126 3.150 . 0 0 "[ . 1 . 2]" 1
2241 1 96 GLN HG3 1 97 VAL HA . . 5.120 4.958 4.355 5.486 0.366 15 0 "[ . 1 . 2]" 1
2242 1 96 GLN HG3 1 98 LEU QD . . 4.420 3.749 3.359 4.426 0.006 9 0 "[ . 1 . 2]" 1
2243 1 96 GLN HG3 1 109 SER HA . . 5.100 4.187 3.747 4.514 . 0 0 "[ . 1 . 2]" 1
2244 1 97 VAL H 1 97 VAL HB . . 3.240 2.545 2.241 2.874 . 0 0 "[ . 1 . 2]" 1
2245 1 97 VAL H 1 97 VAL QG . . 3.220 2.118 1.753 2.448 . 0 0 "[ . 1 . 2]" 1
2246 1 97 VAL H 1 98 LEU H . . 5.500 4.132 3.717 4.448 . 0 0 "[ . 1 . 2]" 1
2247 1 97 VAL H 1 109 SER HA . . 3.450 2.544 2.225 2.881 . 0 0 "[ . 1 . 2]" 1
2248 1 97 VAL H 1 109 SER QB . . 4.780 3.921 3.383 4.314 . 0 0 "[ . 1 . 2]" 1
2249 1 97 VAL H 1 110 VAL H . . 4.690 4.308 3.329 4.737 0.047 6 0 "[ . 1 . 2]" 1
2250 1 97 VAL H 1 110 VAL QG . . 5.290 4.069 3.319 4.865 . 0 0 "[ . 1 . 2]" 1
2251 1 97 VAL HA 1 97 VAL QG . . 3.230 2.222 2.063 2.367 . 0 0 "[ . 1 . 2]" 1
2252 1 97 VAL HA 1 98 LEU H . . 3.060 2.156 2.011 2.277 . 0 0 "[ . 1 . 2]" 1
2253 1 97 VAL HA 1 98 LEU HA . . 4.980 4.501 4.406 4.581 . 0 0 "[ . 1 . 2]" 1
2254 1 97 VAL HA 1 98 LEU QB . . 4.320 4.115 3.846 4.245 . 0 0 "[ . 1 . 2]" 1
2255 1 97 VAL HA 1 98 LEU QD . . 4.800 4.229 3.883 4.620 . 0 0 "[ . 1 . 2]" 1
2256 1 97 VAL HA 1 99 GLU H . . 3.940 3.340 3.113 3.758 . 0 0 "[ . 1 . 2]" 1
2257 1 97 VAL HB 1 98 LEU H . . 5.450 4.419 4.130 4.586 . 0 0 "[ . 1 . 2]" 1
2258 1 97 VAL HB 1 108 ASP HA . . 3.800 3.350 2.352 3.929 0.129 7 0 "[ . 1 . 2]" 1
2259 1 97 VAL HB 1 109 SER HA . . 4.500 3.795 2.925 4.222 . 0 0 "[ . 1 . 2]" 1
2260 1 97 VAL QG 1 98 LEU H . . 4.380 3.273 2.758 3.558 . 0 0 "[ . 1 . 2]" 1
2261 1 97 VAL QG 1 99 GLU H . . 3.550 2.735 2.296 3.068 . 0 0 "[ . 1 . 2]" 1
2262 1 97 VAL QG 1 99 GLU HA . . 4.290 3.537 2.907 4.095 . 0 0 "[ . 1 . 2]" 1
2263 1 97 VAL QG 1 100 TRP H . . 4.600 3.669 3.185 4.061 . 0 0 "[ . 1 . 2]" 1
2264 1 97 VAL QG 1 100 TRP HA . . 4.000 3.167 2.871 3.466 . 0 0 "[ . 1 . 2]" 1
2265 1 97 VAL QG 1 100 TRP HB2 . . 3.460 2.137 1.912 2.447 . 0 0 "[ . 1 . 2]" 1
2266 1 97 VAL QG 1 100 TRP HB3 . . 3.830 3.430 3.025 3.800 . 0 0 "[ . 1 . 2]" 1
2267 1 97 VAL QG 1 100 TRP HD1 . . 5.500 4.886 4.528 5.211 . 0 0 "[ . 1 . 2]" 1
2268 1 97 VAL QG 1 100 TRP HE3 . . 3.410 2.243 1.988 2.969 . 0 0 "[ . 1 . 2]" 1
2269 1 97 VAL QG 1 100 TRP HZ3 . . 4.870 3.483 2.927 4.156 . 0 0 "[ . 1 . 2]" 1
2270 1 97 VAL QG 1 101 GLU H . . 5.450 4.844 4.453 5.155 . 0 0 "[ . 1 . 2]" 1
2271 1 97 VAL QG 1 106 PRO HD2 . . 4.540 3.217 2.583 3.746 . 0 0 "[ . 1 . 2]" 1
2272 1 97 VAL QG 1 106 PRO HD3 . . 5.500 4.255 3.558 4.869 . 0 0 "[ . 1 . 2]" 1
2273 1 97 VAL QG 1 106 PRO HG2 . . 3.770 2.708 2.199 3.569 . 0 0 "[ . 1 . 2]" 1
2274 1 97 VAL QG 1 106 PRO HG3 . . 5.300 3.553 2.761 4.390 . 0 0 "[ . 1 . 2]" 1
2275 1 97 VAL QG 1 107 GLY H . . 5.390 3.630 2.853 4.247 . 0 0 "[ . 1 . 2]" 1
2276 1 97 VAL QG 1 108 ASP H . . 5.500 4.157 3.061 4.800 . 0 0 "[ . 1 . 2]" 1
2277 1 97 VAL QG 1 108 ASP HA . . 3.750 2.596 1.768 3.660 . 0 0 "[ . 1 . 2]" 1
2278 1 97 VAL QG 1 109 SER H . . 4.770 3.258 2.678 3.870 . 0 0 "[ . 1 . 2]" 1
2279 1 97 VAL QG 1 109 SER HA . . 3.350 2.494 2.063 2.860 . 0 0 "[ . 1 . 2]" 1
2280 1 97 VAL QG 1 109 SER QB . . 4.720 4.003 3.631 4.219 . 0 0 "[ . 1 . 2]" 1
2281 1 97 VAL QG 1 110 VAL H . . 3.740 3.482 2.809 3.803 0.063 6 0 "[ . 1 . 2]" 1
2282 1 97 VAL QG 1 110 VAL HB . . 4.450 3.499 2.140 4.387 . 0 0 "[ . 1 . 2]" 1
2283 1 98 LEU H 1 98 LEU QB . . 3.550 2.170 2.089 2.286 . 0 0 "[ . 1 . 2]" 1
2284 1 98 LEU H 1 98 LEU QD . . 3.990 2.942 2.455 3.350 . 0 0 "[ . 1 . 2]" 1
2285 1 98 LEU H 1 99 GLU H . . 3.000 2.386 2.036 2.859 . 0 0 "[ . 1 . 2]" 1
2286 1 98 LEU HA 1 98 LEU QD . . 2.730 2.330 1.932 2.723 . 0 0 "[ . 1 . 2]" 1
2287 1 98 LEU QB 1 98 LEU QD . . 2.700 1.968 1.872 2.108 . 0 0 "[ . 1 . 2]" 1
2288 1 98 LEU QB 1 99 GLU H . . 3.660 2.997 2.660 3.230 . 0 0 "[ . 1 . 2]" 1
2289 1 98 LEU QD 1 99 GLU H . . 4.870 4.217 4.034 4.436 . 0 0 "[ . 1 . 2]" 1
2290 1 99 GLU H 1 99 GLU QB . . 3.920 2.793 2.698 2.921 . 0 0 "[ . 1 . 2]" 1
2291 1 99 GLU H 1 99 GLU HG2 . . 4.700 4.798 4.539 5.052 0.352 10 0 "[ . 1 . 2]" 1
2292 1 99 GLU H 1 99 GLU HG3 . . 4.980 4.587 3.761 4.867 . 0 0 "[ . 1 . 2]" 1
2293 1 99 GLU H 1 100 TRP H . . 4.610 4.161 3.934 4.284 . 0 0 "[ . 1 . 2]" 1
2294 1 99 GLU HA 1 99 GLU HG2 . . 3.810 3.226 2.517 3.736 . 0 0 "[ . 1 . 2]" 1
2295 1 99 GLU HA 1 99 GLU HG3 . . 3.880 2.457 2.264 2.690 . 0 0 "[ . 1 . 2]" 1
2296 1 99 GLU HA 1 100 TRP H . . 2.720 2.351 2.169 2.519 . 0 0 "[ . 1 . 2]" 1
2297 1 99 GLU HA 1 100 TRP HA . . 5.020 4.557 4.447 4.633 . 0 0 "[ . 1 . 2]" 1
2298 1 99 GLU HA 1 100 TRP HB3 . . 4.640 4.678 4.506 4.722 0.082 9 0 "[ . 1 . 2]" 1
2299 1 99 GLU QB 1 100 TRP H . . 4.140 3.360 2.721 3.712 . 0 0 "[ . 1 . 2]" 1
2300 1 99 GLU HG2 1 100 TRP H . . 4.320 3.119 1.935 4.323 0.003 16 0 "[ . 1 . 2]" 1
2301 1 99 GLU HG3 1 100 TRP H . . 4.250 3.030 2.004 4.360 0.110 3 0 "[ . 1 . 2]" 1
2302 1 100 TRP H 1 100 TRP HB2 . . 3.650 3.156 2.914 3.373 . 0 0 "[ . 1 . 2]" 1
2303 1 100 TRP H 1 100 TRP HB3 . . 3.550 2.796 2.648 2.927 . 0 0 "[ . 1 . 2]" 1
2304 1 100 TRP H 1 100 TRP HD1 . . 5.500 5.144 4.962 5.274 . 0 0 "[ . 1 . 2]" 1
2305 1 100 TRP H 1 100 TRP HE3 . . 5.500 5.091 4.803 5.342 . 0 0 "[ . 1 . 2]" 1
2306 1 100 TRP H 1 101 GLU H . . 4.900 4.217 3.927 4.478 . 0 0 "[ . 1 . 2]" 1
2307 1 100 TRP HA 1 100 TRP HD1 . . 5.040 4.414 4.212 4.604 . 0 0 "[ . 1 . 2]" 1
2308 1 100 TRP HA 1 100 TRP HE3 . . 3.820 2.638 2.337 2.850 . 0 0 "[ . 1 . 2]" 1
2309 1 100 TRP HA 1 100 TRP HZ3 . . 4.900 4.794 4.578 4.980 0.080 10 0 "[ . 1 . 2]" 1
2310 1 100 TRP HA 1 101 GLU H . . 2.980 2.200 2.127 2.270 . 0 0 "[ . 1 . 2]" 1
2311 1 100 TRP HA 1 101 GLU HA . . 4.790 4.463 4.419 4.496 . 0 0 "[ . 1 . 2]" 1
2312 1 100 TRP HA 1 101 GLU HB2 . . 4.960 4.579 4.342 4.714 . 0 0 "[ . 1 . 2]" 1
2313 1 100 TRP HA 1 101 GLU QG . . 4.730 3.986 3.659 4.296 . 0 0 "[ . 1 . 2]" 1
2314 1 100 TRP HB2 1 100 TRP HD1 . . 3.840 3.742 3.645 3.816 . 0 0 "[ . 1 . 2]" 1
2315 1 100 TRP HB2 1 100 TRP HE3 . . 3.920 2.816 2.680 3.108 . 0 0 "[ . 1 . 2]" 1
2316 1 100 TRP HB2 1 101 GLU H . . 4.740 4.337 4.146 4.485 . 0 0 "[ . 1 . 2]" 1
2317 1 100 TRP HB3 1 100 TRP HD1 . . 3.310 2.663 2.556 2.759 . 0 0 "[ . 1 . 2]" 1
2318 1 100 TRP HB3 1 100 TRP HE1 . . 4.930 4.803 4.663 4.853 . 0 0 "[ . 1 . 2]" 1
2319 1 100 TRP HB3 1 101 GLU H . . 4.580 4.189 3.964 4.444 . 0 0 "[ . 1 . 2]" 1
2320 1 100 TRP HD1 1 101 GLU H . . 4.880 4.473 3.802 4.849 . 0 0 "[ . 1 . 2]" 1
2321 1 100 TRP HD1 1 101 GLU HA . . 4.720 4.743 4.138 4.817 0.097 15 0 "[ . 1 . 2]" 1
2322 1 100 TRP HD1 1 102 GLY H . . 4.020 3.743 2.978 4.119 0.099 3 0 "[ . 1 . 2]" 1
2323 1 100 TRP HD1 1 102 GLY QA . . 5.370 4.553 4.235 5.226 . 0 0 "[ . 1 . 2]" 1
2324 1 100 TRP HD1 1 103 ASP H . . 5.500 5.494 5.174 5.593 0.093 3 0 "[ . 1 . 2]" 1
2325 1 100 TRP HD1 1 105 ASP H . . 4.560 4.628 4.452 4.650 0.090 11 0 "[ . 1 . 2]" 1
2326 1 100 TRP HD1 1 105 ASP HA . . 4.220 3.390 2.924 3.834 . 0 0 "[ . 1 . 2]" 1
2327 1 100 TRP HD1 1 105 ASP HB2 . . 3.940 2.957 2.493 3.523 . 0 0 "[ . 1 . 2]" 1
2328 1 100 TRP HD1 1 105 ASP HB3 . . 4.780 4.645 4.191 4.879 0.099 3 0 "[ . 1 . 2]" 1
2329 1 100 TRP HD1 1 106 PRO HD2 . . 5.330 4.772 3.756 5.335 0.005 20 0 "[ . 1 . 2]" 1
2330 1 100 TRP HE1 1 101 GLU H . . 5.500 5.154 4.483 5.557 0.057 12 0 "[ . 1 . 2]" 1
2331 1 100 TRP HE1 1 102 GLY H . . 5.500 4.767 3.698 5.420 . 0 0 "[ . 1 . 2]" 1
2332 1 100 TRP HE1 1 103 ASP H . . 4.910 4.531 3.903 4.960 0.050 11 0 "[ . 1 . 2]" 1
2333 1 100 TRP HE1 1 104 GLY H . . 5.330 3.881 2.804 4.413 . 0 0 "[ . 1 . 2]" 1
2334 1 100 TRP HE1 1 104 GLY HA2 . . 5.490 4.405 3.144 4.671 . 0 0 "[ . 1 . 2]" 1
2335 1 100 TRP HE1 1 104 GLY HA3 . . 4.240 3.565 3.212 3.949 . 0 0 "[ . 1 . 2]" 1
2336 1 100 TRP HE1 1 105 ASP H . . 4.580 3.849 3.310 4.072 . 0 0 "[ . 1 . 2]" 1
2337 1 100 TRP HE1 1 105 ASP HA . . 4.390 3.306 2.928 3.682 . 0 0 "[ . 1 . 2]" 1
2338 1 100 TRP HE1 1 106 PRO HD3 . . 4.560 4.295 2.885 4.629 0.069 13 0 "[ . 1 . 2]" 1
2339 1 100 TRP HE3 1 101 GLU H . . 4.760 4.142 3.694 4.525 . 0 0 "[ . 1 . 2]" 1
2340 1 100 TRP HE3 1 106 PRO HD3 . . 5.500 5.061 4.198 5.580 0.080 13 0 "[ . 1 . 2]" 1
2341 1 100 TRP HE3 1 106 PRO HG3 . . 5.500 4.971 4.200 5.572 0.072 7 0 "[ . 1 . 2]" 1
2342 1 100 TRP HZ2 1 104 GLY HA2 . . 5.380 5.039 4.171 5.461 0.081 2 0 "[ . 1 . 2]" 1
2343 1 100 TRP HZ2 1 104 GLY HA3 . . 4.340 3.649 2.640 4.444 0.104 3 0 "[ . 1 . 2]" 1
2344 1 100 TRP HZ2 1 105 ASP HA . . 4.710 4.599 4.249 4.791 0.081 18 0 "[ . 1 . 2]" 1
2345 1 100 TRP HZ2 1 106 PRO HD3 . . 4.310 3.788 2.390 4.359 0.049 18 0 "[ . 1 . 2]" 1
2346 1 100 TRP HZ3 1 106 PRO HG3 . . 4.830 4.375 3.579 4.901 0.071 15 0 "[ . 1 . 2]" 1
2347 1 100 TRP HZ3 1 110 VAL HB . . 5.200 4.702 3.880 5.287 0.087 10 0 "[ . 1 . 2]" 1
2348 1 100 TRP HZ3 1 110 VAL QG . . 3.890 2.983 2.330 3.398 . 0 0 "[ . 1 . 2]" 1
2349 1 101 GLU H 1 101 GLU HB2 . . 3.700 2.536 2.339 2.717 . 0 0 "[ . 1 . 2]" 1
2350 1 101 GLU H 1 101 GLU HB3 . . 3.670 3.696 3.593 3.754 0.084 3 0 "[ . 1 . 2]" 1
2351 1 101 GLU H 1 101 GLU QG . . 3.560 2.893 2.551 3.141 . 0 0 "[ . 1 . 2]" 1
2352 1 101 GLU H 1 102 GLY H . . 4.210 4.064 3.362 4.293 0.083 4 0 "[ . 1 . 2]" 1
2353 1 101 GLU HA 1 101 GLU QG . . 3.380 2.846 2.279 3.140 . 0 0 "[ . 1 . 2]" 1
2354 1 101 GLU HA 1 102 GLY H . . 2.890 2.223 2.046 2.508 . 0 0 "[ . 1 . 2]" 1
2355 1 101 GLU HA 1 102 GLY QA . . 4.680 3.857 3.673 3.921 . 0 0 "[ . 1 . 2]" 1
2356 1 101 GLU HB2 1 101 GLU QG . . 2.630 2.180 2.142 2.259 . 0 0 "[ . 1 . 2]" 1
2357 1 101 GLU HB2 1 102 GLY H . . 4.530 4.500 4.327 4.601 0.071 8 0 "[ . 1 . 2]" 1
2358 1 101 GLU HB3 1 102 GLY H . . 4.350 3.885 3.385 4.383 0.033 11 0 "[ . 1 . 2]" 1
2359 1 102 GLY H 1 103 ASP H . . 4.710 4.404 3.632 4.578 . 0 0 "[ . 1 . 2]" 1
2360 1 102 GLY QA 1 103 ASP H . . 2.770 2.196 1.650 2.327 . 0 0 "[ . 1 . 2]" 1
2361 1 102 GLY QA 1 103 ASP HA . . 4.310 3.957 3.837 4.103 . 0 0 "[ . 1 . 2]" 1
2362 1 102 GLY QA 1 103 ASP HB2 . . 4.470 4.183 3.842 4.898 0.428 20 0 "[ . 1 . 2]" 1
2363 1 103 ASP H 1 103 ASP HB2 . . 2.990 2.449 2.044 3.279 0.289 20 0 "[ . 1 . 2]" 1
2364 1 103 ASP H 1 103 ASP HB3 . . 3.220 2.631 2.056 3.029 . 0 0 "[ . 1 . 2]" 1
2365 1 103 ASP H 1 104 GLY H . . 4.850 4.561 3.842 4.658 . 0 0 "[ . 1 . 2]" 1
2366 1 103 ASP HA 1 103 ASP HB3 . . 2.970 2.997 2.810 3.035 0.065 5 0 "[ . 1 . 2]" 1
2367 1 103 ASP HA 1 104 GLY H . . 2.960 2.395 1.951 2.628 . 0 0 "[ . 1 . 2]" 1
2368 1 103 ASP HA 1 104 GLY HA2 . . 4.820 4.474 2.405 4.779 . 0 0 "[ . 1 . 2]" 1
2369 1 103 ASP HA 1 104 GLY HA3 . . 4.770 4.471 2.972 4.669 . 0 0 "[ . 1 . 2]" 1
2370 1 103 ASP HA 1 105 ASP H . . 4.520 4.200 3.872 4.640 0.120 3 0 "[ . 1 . 2]" 1
2371 1 103 ASP HB3 1 104 GLY H . . 3.430 3.435 2.722 4.424 0.994 20 2 "[ .- 1 . +]" 1
2372 1 103 ASP HB3 1 104 GLY HA2 . . 5.050 4.830 4.312 5.543 0.493 6 0 "[ . 1 . 2]" 1
2373 1 103 ASP HB3 1 104 GLY HA3 . . 4.420 4.350 3.927 5.125 0.705 20 1 "[ . 1 . +]" 1
2374 1 104 GLY H 1 105 ASP H . . 3.410 2.540 2.134 3.156 . 0 0 "[ . 1 . 2]" 1
2375 1 104 GLY H 1 105 ASP HB2 . . 5.380 4.339 3.552 5.429 0.049 3 0 "[ . 1 . 2]" 1
2376 1 104 GLY H 1 105 ASP HB3 . . 5.500 4.264 3.618 5.323 . 0 0 "[ . 1 . 2]" 1
2377 1 104 GLY HA2 1 105 ASP H . . 3.370 2.575 2.222 3.130 . 0 0 "[ . 1 . 2]" 1
2378 1 104 GLY HA2 1 105 ASP HB2 . . 5.310 5.085 4.619 5.377 0.067 10 0 "[ . 1 . 2]" 1
2379 1 104 GLY HA2 1 105 ASP HB3 . . 5.360 4.706 4.418 5.018 . 0 0 "[ . 1 . 2]" 1
2380 1 105 ASP H 1 105 ASP HB2 . . 2.970 2.735 2.385 3.104 0.134 3 0 "[ . 1 . 2]" 1
2381 1 105 ASP H 1 105 ASP HB3 . . 2.960 2.219 2.036 2.602 . 0 0 "[ . 1 . 2]" 1
2382 1 105 ASP H 1 106 PRO HD3 . . 5.070 4.271 3.217 4.500 . 0 0 "[ . 1 . 2]" 1
2383 1 105 ASP HA 1 106 PRO HA . . 4.700 4.606 4.497 4.689 . 0 0 "[ . 1 . 2]" 1
2384 1 105 ASP HA 1 106 PRO HD2 . . 3.110 2.167 2.025 2.400 . 0 0 "[ . 1 . 2]" 1
2385 1 105 ASP HA 1 106 PRO HD3 . . 3.200 2.568 2.200 2.984 . 0 0 "[ . 1 . 2]" 1
2386 1 105 ASP HA 1 106 PRO HG2 . . 4.780 4.355 4.190 4.541 . 0 0 "[ . 1 . 2]" 1
2387 1 105 ASP HA 1 106 PRO HG3 . . 4.840 4.526 4.348 4.884 0.044 3 0 "[ . 1 . 2]" 1
2388 1 105 ASP HB2 1 106 PRO HD3 . . 5.360 4.856 4.501 5.163 . 0 0 "[ . 1 . 2]" 1
2389 1 105 ASP HB3 1 106 PRO HD3 . . 5.500 5.141 4.949 5.353 . 0 0 "[ . 1 . 2]" 1
2390 1 106 PRO HA 1 110 VAL QG . . 4.890 4.733 4.325 4.903 0.013 10 0 "[ . 1 . 2]" 1
2391 1 106 PRO HB2 1 110 VAL QG . . 4.130 2.864 2.171 3.508 . 0 0 "[ . 1 . 2]" 1
2392 1 106 PRO HB3 1 110 VAL HB . . 4.290 4.435 3.711 5.125 0.835 5 5 "[ * + 1* *. -2]" 1
2393 1 106 PRO HB3 1 110 VAL QG . . 4.430 3.090 2.356 3.694 . 0 0 "[ . 1 . 2]" 1
2394 1 106 PRO HD2 1 107 GLY H . . 3.830 2.832 2.072 3.332 . 0 0 "[ . 1 . 2]" 1
2395 1 106 PRO HD3 1 107 GLY H . . 4.520 4.027 3.568 4.349 . 0 0 "[ . 1 . 2]" 1
2396 1 106 PRO HG2 1 107 GLY H . . 4.170 2.883 1.996 3.946 . 0 0 "[ . 1 . 2]" 1
2397 1 106 PRO HG2 1 110 VAL HB . . 4.720 3.517 2.407 4.788 0.068 11 0 "[ . 1 . 2]" 1
2398 1 106 PRO HG3 1 107 GLY H . . 4.810 4.320 3.578 4.817 0.007 19 0 "[ . 1 . 2]" 1
2399 1 106 PRO HG3 1 110 VAL QG . . 4.090 2.161 1.967 3.104 . 0 0 "[ . 1 . 2]" 1
2400 1 107 GLY H 1 108 ASP H . . 4.350 4.331 3.715 4.429 0.079 5 0 "[ . 1 . 2]" 1
2401 1 107 GLY HA2 1 108 ASP H . . 3.270 2.707 2.283 3.345 0.075 17 0 "[ . 1 . 2]" 1
2402 1 107 GLY HA2 1 108 ASP HA . . 4.800 4.313 4.060 4.851 0.051 17 0 "[ . 1 . 2]" 1
2403 1 107 GLY HA2 1 109 SER H . . 4.850 4.546 4.242 4.934 0.084 17 0 "[ . 1 . 2]" 1
2404 1 107 GLY HA3 1 108 ASP H . . 2.990 2.482 2.129 2.740 . 0 0 "[ . 1 . 2]" 1
2405 1 107 GLY HA3 1 109 SER H . . 4.220 3.565 3.083 3.967 . 0 0 "[ . 1 . 2]" 1
2406 1 108 ASP H 1 108 ASP QB . . 2.940 2.411 2.016 2.916 . 0 0 "[ . 1 . 2]" 1
2407 1 108 ASP H 1 109 SER H . . 3.170 2.858 1.772 3.203 0.033 14 0 "[ . 1 . 2]" 1
2408 1 108 ASP H 1 109 SER HA . . 5.500 5.309 4.384 5.567 0.067 6 0 "[ . 1 . 2]" 1
2409 1 108 ASP QB 1 109 SER H . . 3.470 3.319 2.998 3.424 . 0 0 "[ . 1 . 2]" 1
2410 1 108 ASP QB 1 109 SER HA . . 4.770 4.479 4.193 4.644 . 0 0 "[ . 1 . 2]" 1
2411 1 108 ASP QB 1 109 SER QB . . 4.650 4.034 3.409 4.413 . 0 0 "[ . 1 . 2]" 1
2412 1 109 SER H 1 109 SER QB . . 3.820 3.195 2.763 3.427 . 0 0 "[ . 1 . 2]" 1
2413 1 109 SER H 1 110 VAL H . . 4.540 4.367 4.124 4.611 0.071 18 0 "[ . 1 . 2]" 1
2414 1 109 SER H 1 110 VAL QG . . 5.500 4.420 3.460 5.065 . 0 0 "[ . 1 . 2]" 1
2415 1 109 SER HA 1 110 VAL H . . 2.980 2.335 2.049 2.763 . 0 0 "[ . 1 . 2]" 1
2416 1 109 SER HA 1 110 VAL HA . . 4.990 4.446 4.330 4.520 . 0 0 "[ . 1 . 2]" 1
2417 1 109 SER HA 1 110 VAL HB . . 5.500 4.757 3.934 5.561 0.061 2 0 "[ . 1 . 2]" 1
2418 1 109 SER HA 1 110 VAL QG . . 4.250 3.391 2.688 3.946 . 0 0 "[ . 1 . 2]" 1
2419 1 109 SER QB 1 110 VAL H . . 3.470 2.684 2.421 3.294 . 0 0 "[ . 1 . 2]" 1
2420 1 109 SER QB 1 110 VAL HA . . 4.850 4.310 4.046 4.538 . 0 0 "[ . 1 . 2]" 1
2421 1 109 SER QB 1 110 VAL QG . . 5.470 4.092 3.784 4.505 . 0 0 "[ . 1 . 2]" 1
2422 1 110 VAL H 1 110 VAL HB . . 3.980 3.398 2.690 3.927 . 0 0 "[ . 1 . 2]" 1
2423 1 110 VAL H 1 110 VAL QG . . 3.290 2.271 2.003 2.527 . 0 0 "[ . 1 . 2]" 1
2424 1 110 VAL H 1 111 GLN H . . 4.830 4.422 4.304 4.518 . 0 0 "[ . 1 . 2]" 1
2425 1 110 VAL HA 1 110 VAL QG . . 3.150 2.274 2.133 2.354 . 0 0 "[ . 1 . 2]" 1
2426 1 110 VAL HA 1 111 GLN H . . 2.730 2.321 2.150 2.554 . 0 0 "[ . 1 . 2]" 1
2427 1 110 VAL HA 1 111 GLN QB . . 4.480 4.111 3.882 4.345 . 0 0 "[ . 1 . 2]" 1
2428 1 110 VAL HB 1 111 GLN H . . 4.050 3.354 2.304 4.134 0.084 3 0 "[ . 1 . 2]" 1
2429 1 110 VAL QG 1 111 GLN H . . 3.750 2.601 1.806 3.348 . 0 0 "[ . 1 . 2]" 1
2430 1 110 VAL QG 1 112 CYS H . . 5.500 3.597 2.616 4.363 . 0 0 "[ . 1 . 2]" 1
2431 1 110 VAL QG 1 112 CYS HB3 . . 5.500 3.645 2.259 4.458 . 0 0 "[ . 1 . 2]" 1
2432 1 111 GLN H 1 111 GLN QB . . 3.260 2.377 2.224 2.542 . 0 0 "[ . 1 . 2]" 1
2433 1 111 GLN H 1 111 GLN HB3 . . 3.030 2.543 2.341 2.733 . 0 0 "[ . 1 . 2]" 1
2434 1 111 GLN H 1 112 CYS H . . 5.120 4.239 3.677 4.638 . 0 0 "[ . 1 . 2]" 1
2435 1 111 GLN HA 1 111 GLN QG . . 3.570 2.375 2.155 2.599 . 0 0 "[ . 1 . 2]" 1
2436 1 111 GLN HA 1 112 CYS H . . 2.910 2.199 2.093 2.402 . 0 0 "[ . 1 . 2]" 1
2437 1 111 GLN QB 1 111 GLN HE22 . . 4.680 3.907 3.692 4.149 . 0 0 "[ . 1 . 2]" 1
2438 1 111 GLN QB 1 112 CYS H . . 3.920 3.853 3.454 4.004 0.084 18 0 "[ . 1 . 2]" 1
2439 1 111 GLN QG 1 112 CYS H . . 3.740 3.005 1.914 3.812 0.072 15 0 "[ . 1 . 2]" 1
2440 1 112 CYS H 1 112 CYS HB2 . . 3.620 3.139 2.295 3.995 0.375 12 0 "[ . 1 . 2]" 1
2441 1 112 CYS HA 1 113 PHE H . . 3.150 2.521 2.372 2.754 . 0 0 "[ . 1 . 2]" 1
2442 1 112 CYS HB2 1 113 PHE H . . 4.450 3.048 2.182 3.884 . 0 0 "[ . 1 . 2]" 1
2443 1 112 CYS HB2 1 114 VAL QG . . 5.010 3.591 3.049 4.492 . 0 0 "[ . 1 . 2]" 1
2444 1 112 CYS HB3 1 113 PHE H . . 3.580 2.930 2.161 3.904 0.324 14 0 "[ . 1 . 2]" 1
2445 1 113 PHE H 1 113 PHE HB2 . . 3.620 2.596 2.406 2.826 . 0 0 "[ . 1 . 2]" 1
2446 1 113 PHE H 1 113 PHE QD . . 3.680 3.161 2.809 3.564 . 0 0 "[ . 1 . 2]" 1
2447 1 113 PHE H 1 114 VAL H . . 4.880 4.478 4.293 4.550 . 0 0 "[ . 1 . 2]" 1
2448 1 113 PHE HA 1 113 PHE QD . . 3.000 2.486 2.197 2.803 . 0 0 "[ . 1 . 2]" 1
2449 1 113 PHE HA 1 114 VAL H . . 3.010 2.230 2.129 2.300 . 0 0 "[ . 1 . 2]" 1
2450 1 113 PHE HA 1 114 VAL HB . . 5.000 4.426 4.104 5.087 0.087 18 0 "[ . 1 . 2]" 1
2451 1 113 PHE HA 1 114 VAL QG . . 4.580 3.774 2.400 4.077 . 0 0 "[ . 1 . 2]" 1
2452 1 113 PHE HB2 1 114 VAL H . . 4.460 3.891 3.511 4.046 . 0 0 "[ . 1 . 2]" 1
2453 1 113 PHE HB3 1 114 VAL H . . 4.000 2.873 2.390 3.127 . 0 0 "[ . 1 . 2]" 1
2454 1 113 PHE QD 1 114 VAL H . . 4.170 3.845 3.521 4.174 0.004 9 0 "[ . 1 . 2]" 1
2455 1 114 VAL H 1 114 VAL HB . . 3.640 2.869 2.663 3.706 0.066 14 0 "[ . 1 . 2]" 1
2456 1 114 VAL H 1 114 VAL QG . . 3.890 3.042 2.221 3.211 . 0 0 "[ . 1 . 2]" 1
2457 1 114 VAL H 1 115 TYR H . . 5.440 4.237 3.976 4.370 . 0 0 "[ . 1 . 2]" 1
2458 1 114 VAL HA 1 115 TYR H . . 3.480 2.284 2.151 2.502 . 0 0 "[ . 1 . 2]" 1
2459 1 114 VAL HB 1 115 TYR H . . 5.090 4.161 3.734 4.531 . 0 0 "[ . 1 . 2]" 1
2460 1 114 VAL HB 1 116 THR MG . . 3.730 3.133 2.354 3.813 0.083 15 0 "[ . 1 . 2]" 1
2461 1 114 VAL QG 1 115 TYR H . . 3.810 2.535 2.200 3.601 . 0 0 "[ . 1 . 2]" 1
2462 1 115 TYR H 1 115 TYR HB3 . . 4.120 3.578 3.479 3.653 . 0 0 "[ . 1 . 2]" 1
2463 1 115 TYR H 1 115 TYR QD . . 3.800 2.981 2.221 3.487 . 0 0 "[ . 1 . 2]" 1
2464 1 115 TYR H 1 115 TYR QE . . 5.500 4.959 4.465 5.452 . 0 0 "[ . 1 . 2]" 1
2465 1 115 TYR H 1 116 THR H . . 5.260 4.354 3.940 4.628 . 0 0 "[ . 1 . 2]" 1
2466 1 115 TYR H 1 116 THR MG . . 5.500 4.202 3.906 4.928 . 0 0 "[ . 1 . 2]" 1
2467 1 115 TYR HA 1 115 TYR QD . . 3.610 2.643 2.176 3.223 . 0 0 "[ . 1 . 2]" 1
2468 1 115 TYR HA 1 116 THR H . . 3.040 2.184 2.119 2.275 . 0 0 "[ . 1 . 2]" 1
2469 1 115 TYR HA 1 116 THR MG . . 5.100 3.878 3.438 4.566 . 0 0 "[ . 1 . 2]" 1
2470 1 115 TYR HB2 1 116 THR H . . 4.540 4.451 4.091 4.658 0.118 17 0 "[ . 1 . 2]" 1
2471 1 115 TYR HB3 1 116 THR H . . 5.380 3.607 3.010 4.177 . 0 0 "[ . 1 . 2]" 1
2472 1 115 TYR QD 1 116 THR H . . 4.920 3.946 3.367 4.613 . 0 0 "[ . 1 . 2]" 1
2473 1 116 THR H 1 116 THR MG . . 3.780 2.870 2.323 3.612 . 0 0 "[ . 1 . 2]" 1
2474 1 116 THR HA 1 116 THR MG . . 3.370 2.371 2.186 2.559 . 0 0 "[ . 1 . 2]" 1
2475 1 116 THR HA 1 117 THR H . . 3.290 2.640 2.298 2.922 . 0 0 "[ . 1 . 2]" 1
2476 1 116 THR HA 1 117 THR MG . . 4.830 3.626 3.151 4.178 . 0 0 "[ . 1 . 2]" 1
2477 1 116 THR HB 1 117 THR H . . 3.220 2.228 1.859 2.876 . 0 0 "[ . 1 . 2]" 1
2478 1 116 THR HB 1 117 THR MG . . 4.980 4.193 3.675 4.616 . 0 0 "[ . 1 . 2]" 1
2479 1 116 THR MG 1 117 THR H . . 4.170 3.658 3.200 3.877 . 0 0 "[ . 1 . 2]" 1
2480 1 117 THR H 1 117 THR HB . . 4.170 3.486 3.066 3.653 . 0 0 "[ . 1 . 2]" 1
2481 1 117 THR H 1 117 THR MG . . 3.390 2.400 2.000 2.806 . 0 0 "[ . 1 . 2]" 1
2482 1 117 THR HA 1 118 ALA H . . 2.950 2.204 2.133 2.287 . 0 0 "[ . 1 . 2]" 1
2483 1 117 THR HA 1 118 ALA HA . . 4.950 4.475 4.421 4.515 . 0 0 "[ . 1 . 2]" 1
2484 1 117 THR HA 1 118 ALA MB . . 4.130 3.961 3.864 4.071 . 0 0 "[ . 1 . 2]" 1
2485 1 117 THR HA 1 119 THR H . . 3.890 3.567 3.324 3.949 0.059 13 0 "[ . 1 . 2]" 1
2486 1 117 THR HA 1 119 THR MG . . 5.290 4.293 3.662 4.925 . 0 0 "[ . 1 . 2]" 1
2487 1 117 THR HB 1 118 ALA H . . 4.440 3.967 3.784 4.391 . 0 0 "[ . 1 . 2]" 1
2488 1 117 THR HB 1 119 THR H . . 4.620 4.190 3.852 4.689 0.069 13 0 "[ . 1 . 2]" 1
2489 1 117 THR MG 1 118 ALA H . . 4.810 4.078 3.688 4.401 . 0 0 "[ . 1 . 2]" 1
2490 1 117 THR MG 1 120 TYR H . . 4.530 4.066 3.028 4.618 0.088 20 0 "[ . 1 . 2]" 1
2491 1 117 THR MG 1 120 TYR HA . . 4.540 3.962 3.031 4.457 . 0 0 "[ . 1 . 2]" 1
2492 1 117 THR MG 1 120 TYR HB2 . . 4.700 4.174 3.661 4.783 0.083 14 0 "[ . 1 . 2]" 1
2493 1 117 THR MG 1 120 TYR HB3 . . 3.810 2.812 2.265 3.558 . 0 0 "[ . 1 . 2]" 1
2494 1 117 THR MG 1 124 TRP HE3 . . 4.350 3.891 3.474 4.310 . 0 0 "[ . 1 . 2]" 1
2495 1 117 THR MG 1 124 TRP HZ3 . . 3.850 3.136 2.714 3.794 . 0 0 "[ . 1 . 2]" 1
2496 1 118 ALA H 1 118 ALA MB . . 3.100 2.362 2.284 2.471 . 0 0 "[ . 1 . 2]" 1
2497 1 118 ALA H 1 119 THR H . . 3.100 2.128 1.964 2.449 . 0 0 "[ . 1 . 2]" 1
2498 1 118 ALA H 1 119 THR HA . . 5.430 4.661 4.476 4.925 . 0 0 "[ . 1 . 2]" 1
2499 1 118 ALA H 1 119 THR MG . . 4.440 3.070 2.646 3.370 . 0 0 "[ . 1 . 2]" 1
2500 1 118 ALA H 1 120 TYR H . . 5.040 4.638 4.194 5.082 0.042 6 0 "[ . 1 . 2]" 1
2501 1 118 ALA H 1 120 TYR QD . . 5.500 4.294 3.604 4.981 . 0 0 "[ . 1 . 2]" 1
2502 1 118 ALA HA 1 119 THR HA . . 5.070 4.695 4.561 4.798 . 0 0 "[ . 1 . 2]" 1
2503 1 118 ALA HA 1 119 THR MG . . 5.500 4.731 4.289 5.101 . 0 0 "[ . 1 . 2]" 1
2504 1 118 ALA HA 1 120 TYR H . . 4.580 3.969 3.679 4.523 . 0 0 "[ . 1 . 2]" 1
2505 1 118 ALA HA 1 120 TYR QD . . 3.790 3.013 2.660 3.349 . 0 0 "[ . 1 . 2]" 1
2506 1 118 ALA MB 1 119 THR H . . 3.840 3.278 2.814 3.465 . 0 0 "[ . 1 . 2]" 1
2507 1 118 ALA MB 1 119 THR HA . . 4.570 4.067 3.743 4.297 . 0 0 "[ . 1 . 2]" 1
2508 1 118 ALA MB 1 119 THR HB . . 5.360 4.528 3.419 5.450 0.090 4 0 "[ . 1 . 2]" 1
2509 1 118 ALA MB 1 119 THR MG . . 3.990 3.296 2.645 4.102 0.112 14 0 "[ . 1 . 2]" 1
2510 1 119 THR H 1 119 THR HB . . 3.930 3.243 2.620 3.643 . 0 0 "[ . 1 . 2]" 1
2511 1 119 THR H 1 119 THR MG . . 3.720 2.367 1.914 3.010 . 0 0 "[ . 1 . 2]" 1
2512 1 119 THR H 1 120 TYR H . . 3.430 2.898 2.516 3.344 . 0 0 "[ . 1 . 2]" 1
2513 1 119 THR H 1 120 TYR HA . . 5.380 4.538 4.217 4.854 . 0 0 "[ . 1 . 2]" 1
2514 1 119 THR H 1 120 TYR QD . . 4.410 3.496 3.112 4.042 . 0 0 "[ . 1 . 2]" 1
2515 1 119 THR HA 1 119 THR HB . . 2.850 2.485 2.288 2.696 . 0 0 "[ . 1 . 2]" 1
2516 1 119 THR HA 1 119 THR MG . . 3.270 2.772 2.143 3.284 0.014 20 0 "[ . 1 . 2]" 1
2517 1 119 THR HA 1 120 TYR H . . 3.140 2.839 2.295 3.205 0.065 4 0 "[ . 1 . 2]" 1
2518 1 119 THR HA 1 120 TYR HA . . 5.220 4.721 4.507 4.877 . 0 0 "[ . 1 . 2]" 1
2519 1 119 THR HA 1 120 TYR QD . . 4.630 4.570 4.222 4.723 0.093 10 0 "[ . 1 . 2]" 1
2520 1 119 THR HB 1 120 TYR H . . 5.370 4.486 4.196 4.620 . 0 0 "[ . 1 . 2]" 1
2521 1 119 THR MG 1 120 TYR H . . 4.710 4.182 3.643 4.396 . 0 0 "[ . 1 . 2]" 1
2522 1 119 THR MG 1 120 TYR HA . . 5.500 4.941 3.779 5.616 0.116 5 0 "[ . 1 . 2]" 1
2523 1 120 TYR H 1 120 TYR HB3 . . 3.650 2.743 2.427 3.179 . 0 0 "[ . 1 . 2]" 1
2524 1 120 TYR H 1 120 TYR QD . . 2.980 2.286 2.004 2.784 . 0 0 "[ . 1 . 2]" 1
2525 1 120 TYR HA 1 120 TYR HB3 . . 2.990 2.337 2.175 2.472 . 0 0 "[ . 1 . 2]" 1
2526 1 120 TYR HA 1 120 TYR QD . . 3.720 3.736 3.573 3.789 0.069 14 0 "[ . 1 . 2]" 1
2527 1 120 TYR HA 1 124 TRP HE3 . . 4.500 3.633 2.782 4.360 . 0 0 "[ . 1 . 2]" 1
2528 1 120 TYR HA 1 124 TRP HZ3 . . 4.030 3.675 2.723 4.094 0.064 15 0 "[ . 1 . 2]" 1
2529 1 120 TYR HB2 1 124 TRP HB2 . . 5.440 2.836 2.296 3.291 . 0 0 "[ . 1 . 2]" 1
2530 1 120 TYR HB2 1 124 TRP HE3 . . 3.240 2.682 2.258 3.117 . 0 0 "[ . 1 . 2]" 1
2531 1 120 TYR HB3 1 124 TRP HB2 . . 5.240 4.404 3.687 4.960 . 0 0 "[ . 1 . 2]" 1
2532 1 120 TYR HB3 1 124 TRP HB3 . . 5.480 4.983 4.303 5.521 0.041 9 0 "[ . 1 . 2]" 1
2533 1 120 TYR HB3 1 124 TRP HZ3 . . 4.630 3.858 2.988 4.696 0.066 9 0 "[ . 1 . 2]" 1
2534 1 120 TYR QD 1 124 TRP HB2 . . 4.020 3.549 3.110 3.829 . 0 0 "[ . 1 . 2]" 1
2535 1 120 TYR QD 1 124 TRP HB3 . . 4.930 4.839 4.428 5.018 0.088 8 0 "[ . 1 . 2]" 1
2536 1 120 TYR QD 1 125 LEU H . . 4.650 4.591 4.190 4.735 0.085 10 0 "[ . 1 . 2]" 1
2537 1 120 TYR QD 1 125 LEU QD . . 4.400 2.641 2.028 3.557 . 0 0 "[ . 1 . 2]" 1
2538 1 122 PRO HA 1 123 GLU HG2 . . 5.190 5.269 5.094 5.859 0.669 11 1 "[ . 1+ . 2]" 1
2539 1 122 PRO HA 1 124 TRP H . . 4.260 3.951 3.591 4.321 0.061 6 0 "[ . 1 . 2]" 1
2540 1 122 PRO HA 1 125 LEU H . . 4.600 3.740 3.145 4.375 . 0 0 "[ . 1 . 2]" 1
2541 1 122 PRO HA 1 125 LEU HB2 . . 5.290 3.886 2.759 4.541 . 0 0 "[ . 1 . 2]" 1
2542 1 122 PRO HA 1 125 LEU QD . . 3.500 2.392 2.006 3.556 0.056 3 0 "[ . 1 . 2]" 1
2543 1 122 PRO HA 1 125 LEU HG . . 4.540 3.910 2.925 4.601 0.061 14 0 "[ . 1 . 2]" 1
2544 1 122 PRO HB2 1 123 GLU H . . 3.560 3.389 2.611 3.583 0.023 1 0 "[ . 1 . 2]" 1
2545 1 122 PRO HB2 1 123 GLU HA . . 5.380 4.251 3.881 4.482 . 0 0 "[ . 1 . 2]" 1
2546 1 122 PRO HB3 1 123 GLU H . . 4.210 4.223 3.931 4.297 0.087 4 0 "[ . 1 . 2]" 1
2547 1 122 PRO HB3 1 125 LEU QD . . 4.730 3.855 3.188 4.760 0.030 3 0 "[ . 1 . 2]" 1
2548 1 122 PRO HD2 1 123 GLU H . . 3.800 2.905 2.648 3.169 . 0 0 "[ . 1 . 2]" 1
2549 1 122 PRO HG2 1 123 GLU H . . 4.370 2.561 2.161 3.100 . 0 0 "[ . 1 . 2]" 1
2550 1 122 PRO HG3 1 123 GLU H . . 3.980 4.088 3.760 4.345 0.365 3 0 "[ . 1 . 2]" 1
2551 1 123 GLU H 1 123 GLU HB2 . . 3.550 3.578 3.511 3.610 0.060 4 0 "[ . 1 . 2]" 1
2552 1 123 GLU H 1 123 GLU HG2 . . 3.850 2.293 1.932 2.458 . 0 0 "[ . 1 . 2]" 1
2553 1 123 GLU H 1 123 GLU HG3 . . 3.660 3.530 2.441 3.693 0.033 19 0 "[ . 1 . 2]" 1
2554 1 123 GLU H 1 124 TRP H . . 3.410 2.884 2.734 3.128 . 0 0 "[ . 1 . 2]" 1
2555 1 123 GLU H 1 124 TRP HB2 . . 5.500 5.072 4.877 5.399 . 0 0 "[ . 1 . 2]" 1
2556 1 123 GLU H 1 124 TRP HD1 . . 4.650 4.639 4.379 4.725 0.075 12 0 "[ . 1 . 2]" 1
2557 1 123 GLU H 1 125 LEU H . . 4.860 4.382 4.126 4.689 . 0 0 "[ . 1 . 2]" 1
2558 1 123 GLU HA 1 123 GLU HB2 . . 2.870 2.561 2.452 2.685 . 0 0 "[ . 1 . 2]" 1
2559 1 123 GLU HA 1 124 TRP HA . . 4.630 4.679 4.541 4.717 0.087 13 0 "[ . 1 . 2]" 1
2560 1 123 GLU HA 1 125 LEU H . . 3.810 3.749 3.302 3.883 0.073 9 0 "[ . 1 . 2]" 1
2561 1 123 GLU HA 1 125 LEU HB2 . . 5.140 4.798 4.004 5.190 0.050 17 0 "[ . 1 . 2]" 1
2562 1 123 GLU HA 1 126 PHE QB . . 4.960 3.750 3.174 4.784 . 0 0 "[ . 1 . 2]" 1
2563 1 123 GLU HA 1 126 PHE QD . . 3.440 2.315 2.015 3.024 . 0 0 "[ . 1 . 2]" 1
2564 1 123 GLU HA 1 126 PHE QE . . 3.510 2.656 2.063 3.448 . 0 0 "[ . 1 . 2]" 1
2565 1 123 GLU HB2 1 123 GLU HG2 . . 2.870 2.775 2.636 2.976 0.106 11 0 "[ . 1 . 2]" 1
2566 1 123 GLU HB2 1 123 GLU HG3 . . 2.920 2.297 2.243 2.830 . 0 0 "[ . 1 . 2]" 1
2567 1 123 GLU HB2 1 124 TRP H . . 4.290 3.791 3.334 4.350 0.060 9 0 "[ . 1 . 2]" 1
2568 1 123 GLU HB2 1 124 TRP HD1 . . 3.760 3.242 2.612 3.802 0.042 9 0 "[ . 1 . 2]" 1
2569 1 123 GLU HB2 1 124 TRP HE1 . . 5.500 4.907 4.104 5.575 0.075 12 0 "[ . 1 . 2]" 1
2570 1 123 GLU HB2 1 126 PHE QD . . 4.720 3.819 3.041 4.650 . 0 0 "[ . 1 . 2]" 1
2571 1 123 GLU HB2 1 126 PHE QE . . 4.820 4.707 3.384 4.912 0.092 18 0 "[ . 1 . 2]" 1
2572 1 123 GLU HG2 1 124 TRP H . . 4.390 2.574 1.930 3.615 . 0 0 "[ . 1 . 2]" 1
2573 1 123 GLU HG2 1 124 TRP HD1 . . 3.950 2.809 2.367 3.551 . 0 0 "[ . 1 . 2]" 1
2574 1 123 GLU HG2 1 124 TRP HE1 . . 5.500 3.893 3.495 4.754 . 0 0 "[ . 1 . 2]" 1
2575 1 123 GLU HG3 1 124 TRP H . . 4.390 3.880 2.149 4.411 0.021 3 0 "[ . 1 . 2]" 1
2576 1 123 GLU HG3 1 124 TRP HD1 . . 3.300 2.871 2.038 3.278 . 0 0 "[ . 1 . 2]" 1
2577 1 123 GLU HG3 1 124 TRP HE1 . . 5.120 3.435 2.749 4.153 . 0 0 "[ . 1 . 2]" 1
2578 1 124 TRP H 1 124 TRP HB2 . . 3.270 2.394 2.280 2.513 . 0 0 "[ . 1 . 2]" 1
2579 1 124 TRP H 1 124 TRP HB3 . . 3.580 3.544 3.393 3.636 0.056 9 0 "[ . 1 . 2]" 1
2580 1 124 TRP H 1 124 TRP HD1 . . 3.440 2.890 2.373 3.379 . 0 0 "[ . 1 . 2]" 1
2581 1 124 TRP H 1 124 TRP HE1 . . 5.500 4.920 4.437 5.529 0.029 17 0 "[ . 1 . 2]" 1
2582 1 124 TRP H 1 125 LEU H . . 3.280 2.646 2.002 2.864 . 0 0 "[ . 1 . 2]" 1
2583 1 124 TRP H 1 125 LEU HB2 . . 5.090 4.814 3.984 5.138 0.048 20 0 "[ . 1 . 2]" 1
2584 1 124 TRP H 1 125 LEU QD . . 4.960 3.969 3.141 4.693 . 0 0 "[ . 1 . 2]" 1
2585 1 124 TRP H 1 126 PHE H . . 5.060 4.245 3.724 4.563 . 0 0 "[ . 1 . 2]" 1
2586 1 124 TRP H 1 127 LEU HG . . 5.070 4.772 4.556 5.169 0.099 19 0 "[ . 1 . 2]" 1
2587 1 124 TRP HA 1 124 TRP HD1 . . 2.940 2.452 2.305 2.569 . 0 0 "[ . 1 . 2]" 1
2588 1 124 TRP HA 1 127 LEU H . . 4.140 3.307 2.761 3.738 . 0 0 "[ . 1 . 2]" 1
2589 1 124 TRP HA 1 127 LEU HB2 . . 3.900 3.399 2.513 4.618 0.718 7 1 "[ . + 1 . 2]" 1
2590 1 124 TRP HA 1 127 LEU QD . . 3.220 2.188 1.845 2.518 . 0 0 "[ . 1 . 2]" 1
2591 1 124 TRP HA 1 127 LEU HG . . 3.500 2.251 1.937 2.523 . 0 0 "[ . 1 . 2]" 1
2592 1 124 TRP HB2 1 124 TRP HE3 . . 3.670 2.998 2.895 3.070 . 0 0 "[ . 1 . 2]" 1
2593 1 124 TRP HB2 1 125 LEU H . . 4.330 3.441 3.167 3.887 . 0 0 "[ . 1 . 2]" 1
2594 1 124 TRP HB2 1 125 LEU QD . . 5.350 3.734 2.744 4.687 . 0 0 "[ . 1 . 2]" 1
2595 1 124 TRP HB2 1 127 LEU QD . . 4.430 4.126 3.544 4.386 . 0 0 "[ . 1 . 2]" 1
2596 1 124 TRP HB3 1 124 TRP HE3 . . 3.680 2.838 2.555 3.024 . 0 0 "[ . 1 . 2]" 1
2597 1 124 TRP HB3 1 125 LEU H . . 4.710 4.191 4.011 4.507 . 0 0 "[ . 1 . 2]" 1
2598 1 124 TRP HB3 1 125 LEU QD . . 5.500 4.375 3.618 5.056 . 0 0 "[ . 1 . 2]" 1
2599 1 124 TRP HB3 1 127 LEU QD . . 4.030 3.109 2.357 3.739 . 0 0 "[ . 1 . 2]" 1
2600 1 124 TRP HD1 1 127 LEU QD . . 3.450 2.701 2.331 3.015 . 0 0 "[ . 1 . 2]" 1
2601 1 124 TRP HD1 1 127 LEU HG . . 4.630 3.647 2.921 4.260 . 0 0 "[ . 1 . 2]" 1
2602 1 124 TRP HE1 1 127 LEU QD . . 5.190 3.785 2.953 4.640 . 0 0 "[ . 1 . 2]" 1
2603 1 125 LEU H 1 125 LEU HB2 . . 3.130 2.377 2.227 2.454 . 0 0 "[ . 1 . 2]" 1
2604 1 125 LEU H 1 125 LEU HB3 . . 3.570 3.594 3.517 3.637 0.067 7 0 "[ . 1 . 2]" 1
2605 1 125 LEU H 1 125 LEU QD . . 3.880 2.708 1.967 3.520 . 0 0 "[ . 1 . 2]" 1
2606 1 125 LEU H 1 126 PHE QD . . 4.780 4.318 3.232 4.727 . 0 0 "[ . 1 . 2]" 1
2607 1 125 LEU H 1 127 LEU H . . 4.940 4.080 3.829 4.392 . 0 0 "[ . 1 . 2]" 1
2608 1 125 LEU HA 1 125 LEU QD . . 2.980 2.120 2.030 2.330 . 0 0 "[ . 1 . 2]" 1
2609 1 125 LEU HA 1 125 LEU HG . . 3.790 3.372 2.772 3.786 . 0 0 "[ . 1 . 2]" 1
2610 1 125 LEU HA 1 127 LEU H . . 4.600 4.031 3.568 4.473 . 0 0 "[ . 1 . 2]" 1
2611 1 125 LEU HB2 1 125 LEU QD . . 3.010 2.272 2.162 2.382 . 0 0 "[ . 1 . 2]" 1
2612 1 125 LEU HB2 1 126 PHE H . . 4.190 3.273 2.924 3.728 . 0 0 "[ . 1 . 2]" 1
2613 1 125 LEU HB2 1 126 PHE QD . . 5.500 3.902 2.654 4.505 . 0 0 "[ . 1 . 2]" 1
2614 1 125 LEU HB2 1 126 PHE QE . . 4.830 4.036 2.574 4.932 0.102 4 0 "[ . 1 . 2]" 1
2615 1 125 LEU HB3 1 125 LEU QD . . 3.130 2.231 2.059 2.436 . 0 0 "[ . 1 . 2]" 1
2616 1 125 LEU HB3 1 126 PHE H . . 4.590 4.002 3.543 4.382 . 0 0 "[ . 1 . 2]" 1
2617 1 125 LEU HB3 1 126 PHE QD . . 5.190 4.297 3.020 5.193 0.003 2 0 "[ . 1 . 2]" 1
2618 1 125 LEU QD 1 126 PHE H . . 5.190 4.172 3.873 4.548 . 0 0 "[ . 1 . 2]" 1
2619 1 125 LEU HG 1 126 PHE H . . 5.500 5.178 4.555 5.569 0.069 1 0 "[ . 1 . 2]" 1
2620 1 126 PHE H 1 126 PHE QB . . 3.350 2.553 2.351 2.933 . 0 0 "[ . 1 . 2]" 1
2621 1 126 PHE H 1 127 LEU H . . 3.160 2.321 2.107 2.711 . 0 0 "[ . 1 . 2]" 1
2622 1 126 PHE H 1 127 LEU HB2 . . 4.970 4.511 3.942 5.845 0.875 7 1 "[ . + 1 . 2]" 1
2623 1 126 PHE H 1 127 LEU QD . . 5.500 3.867 2.392 4.766 . 0 0 "[ . 1 . 2]" 1
2624 1 126 PHE H 1 127 LEU HG . . 4.570 3.966 3.327 4.652 0.082 13 0 "[ . 1 . 2]" 1
2625 1 126 PHE HA 1 126 PHE QD . . 3.560 2.521 2.239 3.667 0.107 4 0 "[ . 1 . 2]" 1
2626 1 126 PHE QB 1 127 LEU H . . 4.630 3.143 2.667 3.805 . 0 0 "[ . 1 . 2]" 1
2627 1 126 PHE QB 1 127 LEU QD . . 5.500 3.593 2.689 4.391 . 0 0 "[ . 1 . 2]" 1
2628 1 127 LEU H 1 127 LEU HB2 . . 3.230 2.423 2.069 3.645 0.415 7 0 "[ . 1 . 2]" 1
2629 1 127 LEU H 1 127 LEU HB3 . . 3.690 3.512 2.950 3.626 . 0 0 "[ . 1 . 2]" 1
2630 1 127 LEU H 1 127 LEU QD . . 3.990 2.816 1.923 3.478 . 0 0 "[ . 1 . 2]" 1
2631 1 127 LEU H 1 127 LEU HG . . 3.360 2.579 1.957 3.436 0.076 13 0 "[ . 1 . 2]" 1
2632 1 127 LEU H 1 128 PRO HD2 . . 5.500 4.915 4.754 5.323 . 0 0 "[ . 1 . 2]" 1
2633 1 127 LEU HA 1 127 LEU QD . . 2.900 2.170 2.035 2.966 0.066 7 0 "[ . 1 . 2]" 1
2634 1 127 LEU HA 1 127 LEU HG . . 4.040 3.292 2.968 3.862 . 0 0 "[ . 1 . 2]" 1
2635 1 127 LEU HA 1 128 PRO HB3 . . 5.200 4.917 4.762 5.068 . 0 0 "[ . 1 . 2]" 1
2636 1 127 LEU HA 1 128 PRO HD2 . . 3.290 2.502 2.312 3.241 . 0 0 "[ . 1 . 2]" 1
2637 1 127 LEU HA 1 128 PRO HD3 . . 3.590 2.455 2.011 2.690 . 0 0 "[ . 1 . 2]" 1
2638 1 127 LEU HA 1 128 PRO HG2 . . 4.830 4.620 4.512 4.751 . 0 0 "[ . 1 . 2]" 1
2639 1 127 LEU HA 1 128 PRO HG3 . . 4.660 4.623 4.014 4.728 0.068 20 0 "[ . 1 . 2]" 1
2640 1 127 LEU HB2 1 128 PRO HD2 . . 5.020 3.747 2.137 4.097 . 0 0 "[ . 1 . 2]" 1
2641 1 127 LEU HB2 1 128 PRO HD3 . . 4.610 4.744 2.508 5.070 0.460 5 0 "[ . 1 . 2]" 1
2642 1 127 LEU HB2 1 129 TYR QD . . 5.500 4.732 4.004 5.571 0.071 10 0 "[ . 1 . 2]" 1
2643 1 127 LEU HB3 1 128 PRO HD2 . . 4.550 2.381 2.117 3.369 . 0 0 "[ . 1 . 2]" 1
2644 1 127 LEU HB3 1 128 PRO HD3 . . 4.320 3.689 2.824 4.066 . 0 0 "[ . 1 . 2]" 1
2645 1 127 LEU QD 1 128 PRO HD2 . . 3.740 2.671 2.092 3.290 . 0 0 "[ . 1 . 2]" 1
2646 1 127 LEU QD 1 128 PRO HD3 . . 3.770 3.414 3.067 3.729 . 0 0 "[ . 1 . 2]" 1
2647 1 127 LEU QD 1 128 PRO HG2 . . 5.500 4.308 3.687 4.919 . 0 0 "[ . 1 . 2]" 1
2648 1 127 LEU QD 1 128 PRO HG3 . . 5.320 4.609 4.083 5.152 . 0 0 "[ . 1 . 2]" 1
2649 1 128 PRO HA 1 129 TYR H . . 2.610 2.270 2.173 2.471 . 0 0 "[ . 1 . 2]" 1
2650 1 128 PRO HA 1 129 TYR HA . . 4.710 4.430 4.325 4.505 . 0 0 "[ . 1 . 2]" 1
2651 1 128 PRO HA 1 129 TYR HB2 . . 4.780 4.606 4.406 4.846 0.066 9 0 "[ . 1 . 2]" 1
2652 1 128 PRO HA 1 129 TYR QD . . 5.090 4.208 3.523 4.672 . 0 0 "[ . 1 . 2]" 1
2653 1 128 PRO HB2 1 129 TYR H . . 3.730 3.044 2.674 3.339 . 0 0 "[ . 1 . 2]" 1
2654 1 128 PRO HB3 1 129 TYR H . . 4.200 3.757 3.595 3.902 . 0 0 "[ . 1 . 2]" 1
2655 1 128 PRO HG2 1 129 TYR H . . 5.380 4.651 4.296 5.011 . 0 0 "[ . 1 . 2]" 1
2656 1 128 PRO HG3 1 129 TYR H . . 5.500 5.398 5.148 5.566 0.066 20 0 "[ . 1 . 2]" 1
2657 1 129 TYR H 1 129 TYR HB2 . . 3.350 2.475 2.289 2.722 . 0 0 "[ . 1 . 2]" 1
2658 1 129 TYR H 1 129 TYR HB3 . . 3.770 3.640 3.551 3.730 . 0 0 "[ . 1 . 2]" 1
2659 1 129 TYR H 1 129 TYR QD . . 3.960 3.282 2.913 3.508 . 0 0 "[ . 1 . 2]" 1
2660 1 129 TYR H 1 129 TYR QE . . 4.830 4.767 4.522 4.924 0.094 1 0 "[ . 1 . 2]" 1
2661 1 129 TYR H 1 130 HIS H . . 4.780 4.531 4.406 4.620 . 0 0 "[ . 1 . 2]" 1
2662 1 129 TYR HA 1 129 TYR QD . . 2.930 2.197 2.090 2.400 . 0 0 "[ . 1 . 2]" 1
2663 1 129 TYR HA 1 129 TYR QE . . 4.500 4.473 4.328 4.594 0.094 9 0 "[ . 1 . 2]" 1
2664 1 129 TYR HA 1 130 HIS H . . 3.060 2.369 2.205 2.583 . 0 0 "[ . 1 . 2]" 1
2665 1 129 TYR HA 1 130 HIS HB2 . . 5.300 4.440 4.260 4.765 . 0 0 "[ . 1 . 2]" 1
2666 1 129 TYR HA 1 130 HIS HD2 . . 3.940 2.999 2.681 3.517 . 0 0 "[ . 1 . 2]" 1
2667 1 129 TYR HB2 1 130 HIS H . . 4.620 3.579 3.098 3.883 . 0 0 "[ . 1 . 2]" 1
2668 1 129 TYR HB2 1 130 HIS HA . . 4.850 4.660 4.455 4.865 0.015 3 0 "[ . 1 . 2]" 1
2669 1 129 TYR HB3 1 130 HIS H . . 4.130 2.491 2.080 2.808 . 0 0 "[ . 1 . 2]" 1
2670 1 129 TYR HB3 1 130 HIS HA . . 4.510 4.545 4.354 4.594 0.084 9 0 "[ . 1 . 2]" 1
2671 1 129 TYR QD 1 130 HIS H . . 4.090 3.974 3.611 4.196 0.106 7 0 "[ . 1 . 2]" 1
2672 1 129 TYR QD 1 130 HIS HD2 . . 4.700 4.719 4.492 4.795 0.095 14 0 "[ . 1 . 2]" 1
2673 1 130 HIS H 1 130 HIS HB2 . . 3.500 2.727 2.542 2.922 . 0 0 "[ . 1 . 2]" 1
2674 1 130 HIS H 1 130 HIS HB3 . . 4.020 3.825 3.718 3.910 . 0 0 "[ . 1 . 2]" 1
2675 1 130 HIS H 1 130 HIS HD2 . . 3.490 3.129 2.805 3.374 . 0 0 "[ . 1 . 2]" 1
2676 1 130 HIS HA 1 131 GLU H . . 3.010 2.380 2.152 2.591 . 0 0 "[ . 1 . 2]" 1
2677 1 130 HIS HA 1 131 GLU HB2 . . 4.070 4.008 3.692 4.146 0.076 11 0 "[ . 1 . 2]" 1
2678 1 130 HIS HB2 1 130 HIS HD2 . . 3.830 2.834 2.594 3.208 . 0 0 "[ . 1 . 2]" 1
2679 1 130 HIS HB2 1 131 GLU H . . 4.410 3.731 3.244 4.456 0.046 9 0 "[ . 1 . 2]" 1
2680 1 130 HIS HB2 1 132 SER H . . 3.820 3.715 3.185 3.897 0.077 12 0 "[ . 1 . 2]" 1
2681 1 130 HIS HB3 1 131 GLU H . . 4.300 2.656 2.145 3.771 . 0 0 "[ . 1 . 2]" 1
2682 1 130 HIS HB3 1 132 SER H . . 3.410 2.733 2.266 3.236 . 0 0 "[ . 1 . 2]" 1
2683 1 131 GLU H 1 131 GLU HB2 . . 3.810 2.389 2.019 2.904 . 0 0 "[ . 1 . 2]" 1
2684 1 131 GLU H 1 131 GLU HB3 . . 3.730 2.987 2.510 3.502 . 0 0 "[ . 1 . 2]" 1
2685 1 131 GLU H 1 132 SER H . . 3.080 2.186 1.687 2.943 . 0 0 "[ . 1 . 2]" 1
2686 1 131 GLU HA 1 131 GLU QG . . 3.600 2.270 2.106 2.460 . 0 0 "[ . 1 . 2]" 1
2687 1 131 GLU HB2 1 132 SER H . . 3.870 3.813 3.344 3.960 0.090 20 0 "[ . 1 . 2]" 1
2688 1 131 GLU HB3 1 132 SER H . . 3.900 3.474 2.997 3.977 0.077 4 0 "[ . 1 . 2]" 1
2689 1 131 GLU HB3 1 132 SER HA . . 4.960 4.937 4.772 5.033 0.073 17 0 "[ . 1 . 2]" 1
2690 1 131 GLU QG 1 132 SER H . . 5.190 4.518 4.230 4.696 . 0 0 "[ . 1 . 2]" 1
2691 1 132 SER H 1 132 SER HB2 . . 3.860 3.725 2.969 4.034 0.174 1 0 "[ . 1 . 2]" 1
2692 1 132 SER H 1 132 SER HB3 . . 3.960 3.429 2.839 3.953 . 0 0 "[ . 1 . 2]" 1
2693 1 132 SER H 1 133 TYR H . . 4.980 4.273 4.063 4.420 . 0 0 "[ . 1 . 2]" 1
2694 1 132 SER HA 1 132 SER HB2 . . 3.010 2.560 2.300 3.049 0.039 6 0 "[ . 1 . 2]" 1
2695 1 132 SER HA 1 132 SER HB3 . . 3.020 2.634 2.249 3.056 0.036 8 0 "[ . 1 . 2]" 1
2696 1 132 SER HA 1 133 TYR H . . 3.210 2.410 2.152 2.744 . 0 0 "[ . 1 . 2]" 1
2697 1 132 SER HA 1 133 TYR QB . . 4.420 4.079 3.806 4.357 . 0 0 "[ . 1 . 2]" 1
2698 1 132 SER HB2 1 133 TYR H . . 4.310 3.084 2.112 4.363 0.053 12 0 "[ . 1 . 2]" 1
2699 1 132 SER HB3 1 133 TYR H . . 3.860 3.636 2.338 4.158 0.298 10 0 "[ . 1 . 2]" 1
2700 1 133 TYR H 1 133 TYR QB . . 3.710 2.544 2.199 3.298 . 0 0 "[ . 1 . 2]" 1
2701 1 133 TYR H 1 133 TYR QD . . 4.830 4.112 2.157 4.459 . 0 0 "[ . 1 . 2]" 1
2702 1 133 TYR H 1 134 ASP H . . 4.920 4.157 2.798 4.563 . 0 0 "[ . 1 . 2]" 1
2703 1 133 TYR HA 1 133 TYR QD . . 3.980 2.464 2.044 3.765 . 0 0 "[ . 1 . 2]" 1
2704 1 133 TYR HA 1 134 ASP H . . 2.970 2.275 2.057 2.850 . 0 0 "[ . 1 . 2]" 1
2705 1 133 TYR HA 1 134 ASP HA . . 5.320 4.500 4.263 4.901 . 0 0 "[ . 1 . 2]" 1
2706 1 133 TYR HA 1 134 ASP QB . . 5.060 4.263 3.761 4.709 . 0 0 "[ . 1 . 2]" 1
2707 1 133 TYR QB 1 134 ASP H . . 4.630 3.536 2.140 4.084 . 0 0 "[ . 1 . 2]" 1
2708 1 133 TYR QD 1 134 ASP H . . 4.310 3.110 2.180 4.386 0.076 15 0 "[ . 1 . 2]" 1
2709 1 133 TYR QD 1 134 ASP HA . . 5.470 4.329 2.810 5.408 . 0 0 "[ . 1 . 2]" 1
2710 1 133 TYR QD 1 135 SER H . . 5.440 5.303 4.444 5.545 0.105 11 0 "[ . 1 . 2]" 1
2711 1 134 ASP H 1 134 ASP QB . . 3.850 2.880 2.278 3.303 . 0 0 "[ . 1 . 2]" 1
2712 1 134 ASP H 1 135 SER H . . 5.160 4.147 3.537 4.387 . 0 0 "[ . 1 . 2]" 1
2713 1 134 ASP HA 1 135 SER H . . 3.030 2.264 2.083 2.534 . 0 0 "[ . 1 . 2]" 1
2714 1 134 ASP HA 1 136 GLU H . . 5.050 3.714 2.983 4.081 . 0 0 "[ . 1 . 2]" 1
2715 1 134 ASP QB 1 135 SER H . . 4.650 3.279 2.392 3.972 . 0 0 "[ . 1 . 2]" 1
2716 1 134 ASP QB 1 136 GLU H . . 3.500 2.789 1.982 3.480 . 0 0 "[ . 1 . 2]" 1
2717 1 134 ASP QB 1 137 GLY QA . . 4.810 3.250 2.064 3.887 . 0 0 "[ . 1 . 2]" 1
2718 1 135 SER H 1 135 SER QB . . 3.740 2.322 2.018 2.819 . 0 0 "[ . 1 . 2]" 1
2719 1 135 SER H 1 136 GLU H . . 3.800 2.553 1.943 3.046 . 0 0 "[ . 1 . 2]" 1
2720 1 135 SER H 1 136 GLU HA . . 5.350 5.183 4.626 5.440 0.090 11 0 "[ . 1 . 2]" 1
2721 1 135 SER H 1 136 GLU QB . . 5.500 4.515 3.545 5.212 . 0 0 "[ . 1 . 2]" 1
2722 1 135 SER H 1 137 GLY H . . 5.380 4.783 3.976 5.454 0.074 20 0 "[ . 1 . 2]" 1
2723 1 135 SER HA 1 136 GLU HA . . 5.300 4.699 4.450 4.896 . 0 0 "[ . 1 . 2]" 1
2724 1 135 SER HA 1 137 GLY H . . 5.390 4.089 3.369 5.081 . 0 0 "[ . 1 . 2]" 1
2725 1 135 SER HA 1 143 TYR H . . 4.350 4.263 3.506 4.441 0.091 4 0 "[ . 1 . 2]" 1
2726 1 135 SER QB 1 136 GLU H . . 4.470 3.206 2.697 3.905 . 0 0 "[ . 1 . 2]" 1
2727 1 135 SER QB 1 136 GLU HA . . 5.100 4.363 3.742 4.707 . 0 0 "[ . 1 . 2]" 1
2728 1 135 SER QB 1 136 GLU HG3 . . 5.140 3.730 2.721 5.325 0.185 11 0 "[ . 1 . 2]" 1
2729 1 135 SER QB 1 143 TYR H . . 5.330 4.607 3.268 5.193 . 0 0 "[ . 1 . 2]" 1
2730 1 136 GLU H 1 136 GLU QB . . 3.460 2.551 2.197 3.196 . 0 0 "[ . 1 . 2]" 1
2731 1 136 GLU H 1 136 GLU HG2 . . 4.250 3.483 1.945 4.294 0.044 13 0 "[ . 1 . 2]" 1
2732 1 136 GLU H 1 136 GLU HG3 . . 3.960 3.109 2.329 4.343 0.383 9 0 "[ . 1 . 2]" 1
2733 1 136 GLU H 1 137 GLY H . . 3.380 2.961 2.005 3.474 0.094 12 0 "[ . 1 . 2]" 1
2734 1 136 GLU H 1 137 GLY QA . . 5.430 4.196 3.540 4.728 . 0 0 "[ . 1 . 2]" 1
2735 1 136 GLU HA 1 136 GLU HG2 . . 3.930 2.798 2.198 3.833 . 0 0 "[ . 1 . 2]" 1
2736 1 136 GLU HA 1 136 GLU HG3 . . 3.790 3.319 2.591 3.798 0.008 20 0 "[ . 1 . 2]" 1
2737 1 136 GLU QB 1 137 GLY H . . 4.890 3.729 3.169 4.071 . 0 0 "[ . 1 . 2]" 1
2738 1 137 GLY H 1 138 PRO QD . . 5.010 4.369 4.123 4.475 . 0 0 "[ . 1 . 2]" 1
2739 1 137 GLY QA 1 138 PRO QD . . 3.610 2.076 2.025 2.133 . 0 0 "[ . 1 . 2]" 1
2740 1 137 GLY QA 1 138 PRO HG2 . . 4.680 4.130 3.633 4.285 . 0 0 "[ . 1 . 2]" 1
2741 1 137 GLY QA 1 139 HIS H . . 5.370 3.272 2.755 5.175 . 0 0 "[ . 1 . 2]" 1
2742 1 137 GLY QA 1 139 HIS HD2 . . 5.500 3.375 2.463 5.172 . 0 0 "[ . 1 . 2]" 1
2743 1 138 PRO HA 1 140 GLY H . . 4.600 4.162 3.285 4.692 0.092 20 0 "[ . 1 . 2]" 1
2744 1 138 PRO QD 1 139 HIS H . . 4.970 3.009 2.552 4.746 . 0 0 "[ . 1 . 2]" 1
2745 1 138 PRO HD2 1 139 HIS HD2 . . 4.490 3.755 2.442 4.533 0.043 1 0 "[ . 1 . 2]" 1
2746 1 138 PRO HG2 1 139 HIS H . . 5.040 3.095 2.482 4.070 . 0 0 "[ . 1 . 2]" 1
2747 1 138 PRO HG3 1 139 HIS H . . 5.170 4.483 3.983 4.990 . 0 0 "[ . 1 . 2]" 1
2748 1 139 HIS H 1 139 HIS HD2 . . 3.510 2.939 2.250 3.567 0.057 13 0 "[ . 1 . 2]" 1
2749 1 139 HIS H 1 140 GLY H . . 3.750 3.290 2.767 3.839 0.089 16 0 "[ . 1 . 2]" 1
2750 1 139 HIS HA 1 139 HIS HD2 . . 4.570 4.459 3.511 4.654 0.084 2 0 "[ . 1 . 2]" 1
2751 1 139 HIS HA 1 141 LEU QD . . 5.500 3.553 2.557 4.171 . 0 0 "[ . 1 . 2]" 1
2752 1 139 HIS HA 1 141 LEU HG . . 5.460 4.319 3.090 5.355 . 0 0 "[ . 1 . 2]" 1
2753 1 139 HIS HA 1 142 ARG HE . . 5.470 5.325 4.432 5.563 0.093 11 0 "[ . 1 . 2]" 1
2754 1 139 HIS HB2 1 139 HIS HD2 . . 3.300 2.756 2.430 3.838 0.538 20 1 "[ . 1 . +]" 1
2755 1 139 HIS HB2 1 140 GLY H . . 4.810 3.538 2.020 4.490 . 0 0 "[ . 1 . 2]" 1
2756 1 139 HIS HB2 1 141 LEU QD . . 4.000 2.736 2.014 3.822 . 0 0 "[ . 1 . 2]" 1
2757 1 139 HIS HB2 1 141 LEU HG . . 4.260 3.582 2.184 4.859 0.599 20 1 "[ . 1 . +]" 1
2758 1 139 HIS HB2 1 142 ARG HE . . 4.780 3.588 2.336 4.829 0.049 9 0 "[ . 1 . 2]" 1
2759 1 140 GLY H 1 141 LEU QD . . 5.500 3.920 2.680 4.713 . 0 0 "[ . 1 . 2]" 1
2760 1 140 GLY H 1 141 LEU HG . . 5.500 4.653 3.718 5.605 0.105 20 0 "[ . 1 . 2]" 1
2761 1 140 GLY HA2 1 142 ARG H . . 5.500 4.721 3.932 5.577 0.077 3 0 "[ . 1 . 2]" 1
2762 1 141 LEU HA 1 141 LEU HB3 . . 2.840 2.285 2.146 2.444 . 0 0 "[ . 1 . 2]" 1
2763 1 141 LEU HA 1 141 LEU QD . . 4.210 3.435 3.104 3.512 . 0 0 "[ . 1 . 2]" 1
2764 1 141 LEU HA 1 141 LEU HG . . 3.930 3.701 3.626 4.033 0.103 20 0 "[ . 1 . 2]" 1
2765 1 141 LEU HA 1 142 ARG H . . 2.990 2.354 2.086 2.671 . 0 0 "[ . 1 . 2]" 1
2766 1 141 LEU HA 1 142 ARG QG . . 5.450 4.508 3.755 5.205 . 0 0 "[ . 1 . 2]" 1
2767 1 141 LEU HB2 1 142 ARG H . . 5.360 4.076 3.493 4.427 . 0 0 "[ . 1 . 2]" 1
2768 1 141 LEU HB2 1 142 ARG HA . . 4.640 4.654 4.496 4.716 0.076 20 0 "[ . 1 . 2]" 1
2769 1 141 LEU HB3 1 142 ARG H . . 4.950 4.461 3.910 4.794 . 0 0 "[ . 1 . 2]" 1
2770 1 141 LEU QD 1 142 ARG HA . . 4.430 4.223 3.817 4.404 . 0 0 "[ . 1 . 2]" 1
2771 1 142 ARG H 1 142 ARG HB2 . . 2.950 2.722 2.296 3.019 0.069 3 0 "[ . 1 . 2]" 1
2772 1 142 ARG H 1 142 ARG HD2 . . 4.530 3.788 2.054 5.419 0.889 5 2 "[ + 1 - . 2]" 1
2773 1 142 ARG H 1 142 ARG QG . . 3.690 3.010 2.278 3.654 . 0 0 "[ . 1 . 2]" 1
2774 1 142 ARG H 1 143 TYR H . . 4.870 4.377 1.858 4.673 . 0 0 "[ . 1 . 2]" 1
2775 1 142 ARG HA 1 142 ARG HD2 . . 3.580 3.504 2.618 4.369 0.789 2 1 "[ + . 1 . 2]" 1
2776 1 142 ARG HA 1 142 ARG QG . . 3.580 2.787 2.023 3.376 . 0 0 "[ . 1 . 2]" 1
2777 1 142 ARG HA 1 143 TYR H . . 3.140 2.533 2.246 3.238 0.098 4 0 "[ . 1 . 2]" 1
2778 1 142 ARG HA 1 143 TYR HA . . 4.310 4.213 3.938 4.356 0.046 3 0 "[ . 1 . 2]" 1
2779 1 142 ARG HB2 1 143 TYR H . . 3.830 3.435 2.633 3.882 0.052 19 0 "[ . 1 . 2]" 1
2780 1 142 ARG HD2 1 142 ARG QG . . 2.710 2.304 2.081 2.465 . 0 0 "[ . 1 . 2]" 1
2781 1 142 ARG HD2 1 143 TYR H . . 5.500 5.191 3.893 5.644 0.144 4 0 "[ . 1 . 2]" 1
2782 1 143 TYR H 1 143 TYR HB2 . . 3.600 2.579 2.418 3.413 . 0 0 "[ . 1 . 2]" 1
2783 1 143 TYR H 1 143 TYR HB3 . . 3.540 2.622 2.428 3.330 . 0 0 "[ . 1 . 2]" 1
2784 1 143 TYR H 1 143 TYR QD . . 4.420 4.255 4.155 4.511 0.091 4 0 "[ . 1 . 2]" 1
2785 1 143 TYR H 1 144 ASN H . . 5.040 4.605 4.165 4.761 . 0 0 "[ . 1 . 2]" 1
2786 1 143 TYR HA 1 143 TYR QD . . 3.320 2.288 2.049 2.466 . 0 0 "[ . 1 . 2]" 1
2787 1 143 TYR HA 1 143 TYR QE . . 5.500 4.429 4.235 4.604 . 0 0 "[ . 1 . 2]" 1
2788 1 143 TYR HA 1 144 ASN H . . 3.020 2.224 2.096 2.431 . 0 0 "[ . 1 . 2]" 1
2789 1 143 TYR HA 1 144 ASN HA . . 4.600 4.468 4.407 4.519 . 0 0 "[ . 1 . 2]" 1
2790 1 143 TYR HA 1 144 ASN QB . . 5.310 4.094 3.769 4.351 . 0 0 "[ . 1 . 2]" 1
2791 1 143 TYR HB2 1 144 ASN H . . 4.500 4.154 3.931 4.455 . 0 0 "[ . 1 . 2]" 1
2792 1 143 TYR QD 1 144 ASN H . . 3.560 2.787 2.397 3.291 . 0 0 "[ . 1 . 2]" 1
2793 1 143 TYR QD 1 144 ASN QB . . 5.390 4.702 4.317 5.152 . 0 0 "[ . 1 . 2]" 1
2794 1 143 TYR QD 1 145 PRO QD . . 5.500 2.529 2.189 2.848 . 0 0 "[ . 1 . 2]" 1
2795 1 143 TYR QD 1 145 PRO HG2 . . 4.660 4.659 4.275 4.746 0.086 3 0 "[ . 1 . 2]" 1
2796 1 143 TYR QE 1 144 ASN H . . 4.590 3.896 3.341 4.589 . 0 0 "[ . 1 . 2]" 1
2797 1 143 TYR QE 1 145 PRO HA . . 3.980 3.532 2.307 4.072 0.092 18 0 "[ . 1 . 2]" 1
2798 1 143 TYR QE 1 145 PRO HB2 . . 3.960 3.891 3.686 4.050 0.090 16 0 "[ . 1 . 2]" 1
2799 1 143 TYR QE 1 145 PRO HB3 . . 3.870 2.374 2.044 2.713 . 0 0 "[ . 1 . 2]" 1
2800 1 143 TYR QE 1 145 PRO QD . . 5.500 3.442 2.990 3.852 . 0 0 "[ . 1 . 2]" 1
2801 1 143 TYR QE 1 145 PRO HG2 . . 5.090 4.757 4.240 5.174 0.084 6 0 "[ . 1 . 2]" 1
2802 1 144 ASN H 1 144 ASN QB . . 3.800 2.457 2.244 2.631 . 0 0 "[ . 1 . 2]" 1
2803 1 144 ASN H 1 145 PRO HA . . 5.500 4.681 4.418 4.943 . 0 0 "[ . 1 . 2]" 1
2804 1 144 ASN H 1 145 PRO HB3 . . 5.340 5.350 5.036 5.420 0.080 10 0 "[ . 1 . 2]" 1
2805 1 144 ASN H 1 145 PRO QD . . 4.670 3.293 3.072 3.470 . 0 0 "[ . 1 . 2]" 1
2806 1 144 ASN HA 1 145 PRO QD . . 3.130 2.107 2.003 2.229 . 0 0 "[ . 1 . 2]" 1
2807 1 144 ASN HA 1 145 PRO HG2 . . 4.180 4.245 4.117 4.269 0.089 12 0 "[ . 1 . 2]" 1
2808 1 144 ASN HA 1 146 ARG H . . 5.130 3.563 2.857 4.097 . 0 0 "[ . 1 . 2]" 1
2809 1 144 ASN HA 1 147 GLU QG . . 5.170 3.038 1.994 5.111 . 0 0 "[ . 1 . 2]" 1
2810 1 144 ASN QB 1 145 PRO QD . . 5.030 3.856 3.803 3.963 . 0 0 "[ . 1 . 2]" 1
2811 1 145 PRO HB2 1 146 ARG H . . 4.120 3.444 2.899 4.199 0.079 13 0 "[ . 1 . 2]" 1
2812 1 145 PRO QD 1 146 ARG H . . 4.910 2.714 2.494 3.045 . 0 0 "[ . 1 . 2]" 1
2813 1 145 PRO QD 1 147 GLU QG . . 4.300 3.138 2.049 4.117 . 0 0 "[ . 1 . 2]" 1
2814 1 145 PRO HG2 1 146 ARG H . . 3.750 2.333 1.780 3.729 . 0 0 "[ . 1 . 2]" 1
2815 1 145 PRO HG2 1 146 ARG HA . . 5.030 4.678 4.332 4.949 . 0 0 "[ . 1 . 2]" 1
2816 1 146 ARG H 1 146 ARG HB2 . . 3.220 3.069 2.704 3.298 0.078 1 0 "[ . 1 . 2]" 1
2817 1 146 ARG H 1 146 ARG HB3 . . 3.640 3.093 2.695 3.708 0.068 13 0 "[ . 1 . 2]" 1
2818 1 146 ARG H 1 146 ARG QD . . 4.660 4.642 4.177 4.761 0.101 13 0 "[ . 1 . 2]" 1
2819 1 146 ARG H 1 147 GLU H . . 3.690 2.173 1.770 2.957 . 0 0 "[ . 1 . 2]" 1
2820 1 146 ARG H 1 149 ARG H . . 5.480 5.094 4.088 5.563 0.083 2 0 "[ . 1 . 2]" 1
2821 1 146 ARG HA 1 146 ARG QG . . 3.560 2.325 2.039 3.017 . 0 0 "[ . 1 . 2]" 1
2822 1 146 ARG HA 1 147 GLU H . . 3.060 2.970 2.292 3.155 0.095 17 0 "[ . 1 . 2]" 1
2823 1 146 ARG HA 1 147 GLU HA . . 4.850 4.766 4.470 4.953 0.103 15 0 "[ . 1 . 2]" 1
2824 1 146 ARG HA 1 148 ASN H . . 4.930 3.942 3.100 5.004 0.074 2 0 "[ . 1 . 2]" 1
2825 1 146 ARG HA 1 149 ARG H . . 5.500 3.439 2.598 5.226 . 0 0 "[ . 1 . 2]" 1
2826 1 146 ARG HA 1 149 ARG QD . . 3.710 3.162 2.089 3.756 0.046 15 0 "[ . 1 . 2]" 1
2827 1 146 ARG HB2 1 146 ARG QD . . 3.280 2.366 1.999 3.014 . 0 0 "[ . 1 . 2]" 1
2828 1 146 ARG HB3 1 146 ARG QD . . 3.360 2.655 2.093 3.376 0.016 15 0 "[ . 1 . 2]" 1
2829 1 146 ARG HB3 1 147 GLU H . . 4.260 3.985 3.494 4.368 0.108 4 0 "[ . 1 . 2]" 1
2830 1 146 ARG HE 1 149 ARG QD . . 4.600 3.570 2.600 4.561 . 0 0 "[ . 1 . 2]" 1
2831 1 146 ARG QG 1 147 GLU H . . 5.060 4.400 3.904 4.620 . 0 0 "[ . 1 . 2]" 1
2832 1 146 ARG QG 1 149 ARG H . . 3.680 3.286 2.265 3.689 0.009 5 0 "[ . 1 . 2]" 1
2833 1 146 ARG QG 1 149 ARG HA . . 4.010 3.563 2.478 4.019 0.009 11 0 "[ . 1 . 2]" 1
2834 1 146 ARG QG 1 149 ARG QD . . 3.180 2.490 1.866 3.162 . 0 0 "[ . 1 . 2]" 1
2835 1 147 GLU H 1 147 GLU HB2 . . 3.460 2.926 2.220 3.558 0.098 13 0 "[ . 1 . 2]" 1
2836 1 147 GLU H 1 147 GLU HB3 . . 3.540 3.323 2.385 3.627 0.087 4 0 "[ . 1 . 2]" 1
2837 1 147 GLU H 1 147 GLU QG . . 3.840 2.310 1.799 3.633 . 0 0 "[ . 1 . 2]" 1
2838 1 147 GLU H 1 148 ASN QB . . 5.500 4.988 4.324 5.385 . 0 0 "[ . 1 . 2]" 1
2839 1 147 GLU HA 1 147 GLU QG . . 3.380 2.805 2.223 3.316 . 0 0 "[ . 1 . 2]" 1
2840 1 147 GLU HA 1 148 ASN H . . 3.450 3.314 2.124 3.533 0.083 13 0 "[ . 1 . 2]" 1
2841 1 147 GLU HA 1 149 ARG H . . 4.710 4.352 3.700 4.799 0.089 18 0 "[ . 1 . 2]" 1
2842 1 147 GLU HB2 1 148 ASN H . . 4.120 3.126 2.163 4.660 0.540 16 1 "[ . 1 .+ 2]" 1
2843 1 147 GLU HB2 1 148 ASN QB . . 5.240 4.160 3.468 5.247 0.007 16 0 "[ . 1 . 2]" 1
2844 1 147 GLU HB3 1 147 GLU QG . . 2.670 2.357 2.131 2.544 . 0 0 "[ . 1 . 2]" 1
2845 1 147 GLU QG 1 148 ASN H . . 4.630 3.759 1.745 4.463 . 0 0 "[ . 1 . 2]" 1
2846 1 147 GLU QG 1 148 ASN HD22 . . 5.500 5.074 3.948 6.289 0.789 14 3 "[ . -1 +.* 2]" 1
2847 1 148 ASN H 1 148 ASN QB . . 3.470 2.836 2.221 3.333 . 0 0 "[ . 1 . 2]" 1
2848 1 148 ASN H 1 149 ARG H . . 3.510 2.363 1.612 3.333 . 0 0 "[ . 1 . 2]" 1
2849 1 148 ASN H 1 149 ARG HB2 . . 5.500 4.806 3.602 6.292 0.792 13 1 "[ . 1 + . 2]" 1
2850 1 148 ASN HA 1 149 ARG H . . 3.330 3.070 2.488 3.412 0.082 1 0 "[ . 1 . 2]" 1
2851 1 148 ASN QB 1 149 ARG H . . 4.650 3.830 2.506 4.148 . 0 0 "[ . 1 . 2]" 1
2852 1 149 ARG H 1 149 ARG HB2 . . 3.480 3.049 2.234 3.936 0.456 13 0 "[ . 1 . 2]" 1
2853 1 149 ARG H 1 149 ARG HB3 . . 4.060 3.512 2.348 4.096 0.036 1 0 "[ . 1 . 2]" 1
2854 1 149 ARG H 1 149 ARG QD . . 5.030 3.540 2.688 4.551 . 0 0 "[ . 1 . 2]" 1
2855 1 149 ARG HA 1 149 ARG QD . . 4.010 2.706 1.988 3.882 . 0 0 "[ . 1 . 2]" 1
2856 1 149 ARG HB2 1 149 ARG QD . . 3.370 2.603 2.137 3.354 . 0 0 "[ . 1 . 2]" 1
2857 1 149 ARG HB3 1 149 ARG QD . . 3.490 3.009 2.199 3.385 . 0 0 "[ . 1 . 2]" 1
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