NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
653789 |
7d2o   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_7d2o
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 2833
_Distance_constraint_stats_list.Viol_count 15234
_Distance_constraint_stats_list.Viol_total 235894.734
_Distance_constraint_stats_list.Viol_max 10.614
_Distance_constraint_stats_list.Viol_rms 0.7192
_Distance_constraint_stats_list.Viol_average_all_restraints 0.2307
_Distance_constraint_stats_list.Viol_average_violations_only 0.8150
_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 10 ASP 49.085 2.388 2 15 "[*+****** **** - **]"
1 11 PHE 266.452 3.207 17 19 [**************-*+**]
1 12 ASN 264.718 4.388 4 19 [***+*****-*********]
1 13 ILE 340.137 3.753 1 19 [+*************-****]
1 14 VAL 356.898 6.065 4 19 [***+*****-*********]
1 15 ALA 401.018 6.916 18 19 [*************-***+*]
1 16 VAL 251.488 4.388 4 19 [***+**********-****]
1 17 ALA 397.945 10.614 19 19 [*-****************+]
1 18 SER 274.907 5.890 14 19 [****-********+*****]
1 19 ASN 171.532 6.166 13 19 [*******-****+******]
1 20 PHE 607.075 6.054 17 19 [*****-**********+**]
1 21 ALA 153.740 6.288 8 19 [***-***+***********]
1 22 THR 645.710 10.187 13 19 [************+****-*]
1 23 THR 282.094 9.816 19 19 [*****-************+]
1 24 ASP 60.886 2.630 11 19 [******-***+********]
1 25 LEU 363.327 6.379 19 19 [**-***************+]
1 26 ASP 169.004 4.895 11 19 [**********+**-*****]
1 27 ALA 56.572 3.615 11 18 "[**-*** ***+********]"
1 28 ASP 22.487 1.535 2 11 "[*+ *. **-* **. * *]"
1 29 ARG 245.854 6.474 10 19 [*********+***-*****]
1 30 GLY 25.600 1.721 12 13 "[-**** ** 1 +* * ***]"
1 31 LYS 155.292 6.803 7 19 [******+***********-]
1 32 LEU 773.065 10.103 16 19 [****-**********+***]
1 33 PRO 1219.996 8.284 11 19 [****-*****+********]
1 34 GLY 103.418 5.114 6 19 [**-**+*************]
1 35 LYS 167.348 5.685 1 18 "[+**-*********** ***]"
1 36 LYS 165.493 4.500 14 19 [***-*********+*****]
1 37 LEU 166.926 3.615 6 19 [*****+****-********]
1 38 PRO 73.886 3.852 13 18 "[*****- *****+******]"
1 39 LEU 31.817 1.112 8 13 "[****** +** * ** - ]"
1 40 GLU 45.502 2.030 7 17 "[****-*+**1 ********]"
1 41 VAL 230.523 4.213 3 19 [**+***-************]
1 42 LEU 199.425 2.576 14 19 [***-*********+*****]
1 43 LYS 51.950 2.030 7 16 "[* ****+ ***** *-***]"
1 44 GLU 21.648 2.026 19 8 "[ *.* * * - *. * +]"
1 45 MET 675.524 8.284 11 19 [*********-+********]
1 46 GLU 233.072 4.183 7 19 [******+*-**********]
1 47 ALA 103.349 4.330 7 19 [*****-+************]
1 48 ASN 119.014 2.644 18 19 [**************-**+*]
1 49 ALA 95.200 3.237 11 19 [****-*****+********]
1 50 ARG 180.789 4.330 7 19 [******+**-*********]
1 51 LYS 123.408 3.635 11 19 [*********-+********]
1 52 ALA 164.974 4.444 11 19 [**********+**-*****]
1 53 GLY 0.473 0.134 2 0 "[ . 1 . ]"
1 54 CYS 15.654 1.442 6 8 "[ *-.+ **1* **. ]"
1 55 THR 20.408 1.602 9 11 "[ * *. * +1** ** -**]"
1 56 ARG 113.778 3.207 17 19 [**-*************+**]
1 57 GLY 15.367 1.331 11 10 "[ ***. * *1+* -* * ]"
1 58 CYS 32.904 2.128 6 17 "[* ***+***** ****-**]"
1 59 LEU 164.249 2.793 6 19 [*****+********-****]
1 60 ILE 201.752 2.148 15 19 [**-***********+****]
1 61 CYS 29.763 1.123 17 13 "[ ****** * * ** +*-]"
1 62 LEU 148.132 2.131 12 19 [***-*******+*******]
1 63 SER 92.430 2.281 14 19 [**********-**+*****]
1 64 HIS 53.285 2.181 6 17 "[ ****+** -*********]"
1 65 ILE 263.843 3.445 12 19 [**********-+*******]
1 66 LYS 316.908 4.416 6 19 [*****+*****-*******]
1 67 CYS 41.665 1.605 7 17 "[***** +*** *****-**]"
1 68 THR 282.605 5.680 12 19 [*********-*+*******]
1 69 PRO 137.800 4.337 12 19 [***********+*****-*]
1 70 LYS 526.355 10.341 10 19 [*********+*********]
1 71 MET 183.232 2.119 14 19 [******-******+*****]
1 72 LYS 110.734 2.119 14 18 "[****-****** *+*****]"
1 73 LYS 49.627 1.082 6 10 "[ * *+ **1* **- *]"
1 74 PHE 99.121 3.218 6 18 "[*****+***-* *******]"
1 75 ILE 107.924 1.629 14 19 [*********-***+*****]
1 76 PRO 20.361 1.576 15 10 "[ * .****1 *-*+ * ]"
1 77 GLY 23.923 1.218 6 10 "[*-* *+** 1 ** *]"
1 78 ARG 121.225 5.091 17 19 [********-*******+**]
1 79 CYS 17.567 1.576 15 8 "[ .**-*1 * *+ * ]"
1 80 HIS 152.420 6.166 13 19 [******-*****+******]
1 81 THR 440.737 10.103 16 19 [********-******+***]
1 82 TYR 701.454 5.354 6 19 [*****+*****-*******]
1 83 GLU 439.473 5.685 1 19 [+**********-*******]
1 95 GLU 426.297 10.341 10 19 [*********+********-]
1 96 ALA 92.686 4.821 1 14 "[+* **** **** ** *-]"
1 97 ILE 413.626 5.680 12 19 [***********+*****-*]
1 98 VAL 171.773 3.221 4 19 [***+***************]
1 99 ASP 141.871 4.416 6 18 "[*****+**-** *******]"
1 100 ILE 385.257 4.225 2 19 [*+*********-*******]
1 101 PRO 7.013 0.673 6 2 "[ .+ 1 .- ]"
1 102 ALA 66.200 2.031 19 19 [***************-**+]
1 103 ILE 232.924 2.404 19 19 [************-*****+]
1 104 PRO 62.096 3.334 11 16 "[-*********+** . ***]"
1 105 ARG 34.377 1.573 16 19 [***************+***]
1 106 PHE 238.242 3.531 19 19 [*************-****+]
1 107 LYS 248.147 3.334 11 19 [******-***+********]
1 108 ASP 33.303 2.456 2 14 "[*+ ** - *** ******]"
1 109 LEU 56.893 1.238 10 16 "[*** **** +*-***** *]"
1 110 GLU 53.619 2.276 16 18 [********-*****.+***]
1 111 PRO 34.338 1.699 10 12 "[* **** * + *.****]"
1 112 MET 163.663 6.054 17 19 [********-*******+**]
1 113 GLU 86.616 1.751 10 19 [*-*******+*********]
1 114 GLN 240.347 2.345 5 19 [****+********-*****]
1 115 PHE 403.063 5.402 12 19 [**********-+*******]
1 116 ILE 81.415 1.888 15 19 [**************+***-]
1 117 ALA 100.580 1.991 10 19 [*******-*+*********]
1 118 GLN 272.611 3.121 10 19 [*****-***+*********]
1 119 VAL 139.655 3.107 12 19 [***********+*-*****]
1 120 ASP 18.921 1.309 10 7 "[ ** + -* **]"
1 121 LEU 78.788 2.031 19 19 [************-*****+]
1 122 CYS 45.316 2.128 6 17 "[****-+***** * *****]"
1 123 VAL 28.325 1.309 10 9 "[ * .*- +* ** **]"
1 124 ASP 28.014 1.331 11 14 "[-****** *1+* *** * ]"
1 125 CYS 27.719 0.982 2 12 "[*+ *.*- 1** *** **]"
1 126 THR 14.251 1.602 9 9 "[ * *. +1** ** - *]"
1 127 THR 70.736 2.145 3 18 "[*-+************ ***]"
1 128 GLY 30.291 1.307 13 12 "[ **** * 1* +-** **]"
1 129 CYS 26.123 1.062 13 14 "[****- * ***+ ** **]"
1 130 LEU 143.065 2.868 18 19 [****-************+*]
1 131 LYS 35.495 0.968 19 12 "[*- . ****** .***+]"
1 132 GLY 15.736 1.310 19 4 "[-* . * 1 . +]"
1 133 LEU 219.546 4.237 18 19 [*************-***+*]
1 134 ALA 66.547 4.279 13 16 "[ ******* ***+** *-*]"
1 135 ASN 27.325 1.680 8 17 "[*******+*1* ****-**]"
1 136 VAL 847.461 10.187 13 19 [***-********+******]
1 137 GLN 21.587 3.366 7 13 "[ *-***+* * ** .*** ]"
1 138 CYS 112.458 7.376 10 19 [**-******+*********]
1 139 SER 54.061 2.206 7 18 "[******+*** ****-***]"
1 140 ASP 49.663 4.458 2 15 "[*+*-* ** ******* * ]"
1 141 LEU 142.492 3.972 13 18 "[******-*****+**** *]"
1 142 LEU 360.756 6.944 7 19 [******+**********-*]
1 143 LYS 114.116 4.276 10 18 "[ *-******+*********]"
1 144 LYS 14.125 1.496 19 6 "[-** * * . +]"
1 145 TRP 234.614 5.432 3 19 [-*+****************]
1 146 LEU 894.131 8.235 4 19 [***+*************-*]
1 147 PRO 173.122 6.284 15 19 [*-************+****]
1 148 GLN 88.535 6.375 1 16 "[+**** **** *******]"
1 149 ARG 556.925 10.614 19 19 [*******-**********+]
1 150 CYS 155.292 2.882 15 19 [*******-******+****]
1 151 ALA 144.854 6.284 15 19 [***-**********+****]
1 152 THR 47.528 1.899 11 17 "[-***** ***+**** ***]"
1 153 PHE 32.290 1.899 11 14 "[ ******+***** -*]"
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 41 VAL QG 1 145 TRP HE1 . . 3.890 2.882 2.166 3.970 0.080 18 0 "[ . 1 . ]" 1
2 1 145 TRP HA 1 145 TRP HE1 . . 5.270 5.276 5.033 5.467 0.197 4 0 "[ . 1 . ]" 1
3 1 141 LEU HA 1 145 TRP HE1 . . 4.960 5.128 4.776 5.516 0.556 13 3 "[ . * + . - ]" 1
4 1 40 GLU QG 1 145 TRP HE1 . . 4.970 3.388 2.416 4.338 . 0 0 "[ . 1 . ]" 1
5 1 144 LYS QB 1 145 TRP HE1 . . 4.180 4.147 3.554 4.706 0.526 1 3 "[+ * - . ]" 1
6 1 144 LYS QD 1 145 TRP HE1 . . 3.790 2.985 2.438 3.554 . 0 0 "[ . 1 . ]" 1
7 1 66 LYS H 1 67 CYS H . . 4.670 4.578 4.481 4.600 . 0 0 "[ . 1 . ]" 1
8 1 66 LYS H 1 118 GLN QE . . 4.050 3.878 3.172 4.410 0.360 13 0 "[ . 1 . ]" 1
9 1 65 ILE QG 1 66 LYS H . . 4.400 3.660 2.425 3.991 . 0 0 "[ . 1 . ]" 1
10 1 65 ILE HA 1 66 LYS H . . 3.260 2.203 2.145 2.223 . 0 0 "[ . 1 . ]" 1
11 1 66 LYS H 1 66 LYS QE . . 4.810 4.655 3.894 5.458 0.648 16 2 "[ -. 1 .+ ]" 1
12 1 66 LYS H 1 118 GLN QB . . 5.190 3.879 3.078 4.616 . 0 0 "[ . 1 . ]" 1
13 1 65 ILE HB 1 66 LYS H . . 4.150 4.141 4.054 4.295 0.145 19 0 "[ . 1 . ]" 1
14 1 66 LYS H 1 66 LYS QB . . 3.460 2.404 2.110 2.810 . 0 0 "[ . 1 . ]" 1
15 1 66 LYS H 1 66 LYS QD . . 3.520 3.146 1.894 4.171 0.651 17 2 "[ . 1- . + ]" 1
16 1 66 LYS H 1 100 ILE MD . . 4.440 4.246 3.402 4.932 0.492 6 0 "[ . 1 . ]" 1
17 1 95 GLU HA 1 96 ALA H . . 2.620 2.570 2.400 2.691 0.071 9 0 "[ . 1 . ]" 1
18 1 95 GLU QG 1 96 ALA H . . 3.600 3.527 2.914 3.855 0.255 14 0 "[ . 1 . ]" 1
19 1 96 ALA H 1 97 ILE MD . . 4.280 4.220 3.288 6.068 1.788 2 1 "[ + . 1 . ]" 1
20 1 150 CYS HB3 1 151 ALA H . . 4.920 2.931 2.200 3.861 . 0 0 "[ . 1 . ]" 1
21 1 151 ALA H 1 151 ALA MB . . 2.960 2.780 2.130 2.933 . 0 0 "[ . 1 . ]" 1
22 1 39 LEU H 1 41 VAL H . . 4.750 4.503 4.239 4.663 . 0 0 "[ . 1 . ]" 1
23 1 38 PRO HA 1 39 LEU H . . 2.910 2.261 2.227 2.285 . 0 0 "[ . 1 . ]" 1
24 1 38 PRO QB 1 39 LEU H . . 3.660 2.880 2.817 2.980 . 0 0 "[ . 1 . ]" 1
25 1 39 LEU H 1 39 LEU QB . . 2.890 2.542 2.243 2.655 . 0 0 "[ . 1 . ]" 1
26 1 39 LEU H 1 39 LEU HG . . 2.860 2.261 2.060 2.781 . 0 0 "[ . 1 . ]" 1
27 1 36 LYS HA 1 37 LEU H . . 2.970 2.223 2.140 2.434 . 0 0 "[ . 1 . ]" 1
28 1 15 ALA H 1 16 VAL HB . . 4.630 5.153 4.485 6.448 1.818 14 6 "[ **. -*1 +. *]" 1
29 1 37 LEU H 1 37 LEU QB . . 3.180 2.352 2.102 2.561 . 0 0 "[ . 1 . ]" 1
30 1 37 LEU H 1 37 LEU HG . . 4.300 4.383 3.622 4.728 0.428 14 0 "[ . 1 . ]" 1
31 1 13 ILE MG 1 15 ALA H . . 4.650 4.390 4.268 4.553 . 0 0 "[ . 1 . ]" 1
32 1 14 VAL QG 1 15 ALA H . . 3.650 2.529 1.854 3.309 . 0 0 "[ . 1 . ]" 1
33 1 97 ILE HA 1 98 VAL H . . 2.540 2.294 2.141 3.572 1.032 17 1 "[ . 1 . + ]" 1
34 1 13 ILE HA 1 15 ALA H . . 4.890 4.302 4.069 4.639 . 0 0 "[ . 1 . ]" 1
35 1 98 VAL H 1 99 ASP QB . . 4.680 4.572 3.704 5.661 0.981 6 1 "[ .+ 1 . ]" 1
36 1 98 VAL H 1 98 VAL HB . . 3.060 2.965 2.553 3.661 0.601 4 2 "[ +. - . ]" 1
37 1 97 ILE HB 1 98 VAL H . . 3.570 3.915 2.125 4.447 0.877 18 9 "[ * .* **1*** .- + ]" 1
38 1 12 ASN QB 1 15 ALA H . . 4.340 3.002 2.504 4.214 . 0 0 "[ . 1 . ]" 1
39 1 100 ILE H 1 107 LYS H . . 4.460 4.564 4.149 5.178 0.718 5 3 "[ - + 1 .* ]" 1
40 1 48 ASN H 1 49 ALA H . . 3.260 2.592 2.408 2.781 . 0 0 "[ . 1 . ]" 1
41 1 99 ASP H 1 100 ILE H . . 4.350 4.383 4.303 4.466 0.116 11 0 "[ . 1 . ]" 1
42 1 99 ASP HA 1 100 ILE H . . 3.020 2.213 2.178 2.307 . 0 0 "[ . 1 . ]" 1
43 1 47 ALA HA 1 49 ALA H . . 4.400 4.421 3.989 4.746 0.346 2 0 "[ . 1 . ]" 1
44 1 46 GLU HA 1 49 ALA H . . 4.090 3.277 3.134 3.623 . 0 0 "[ . 1 . ]" 1
45 1 100 ILE H 1 107 LYS HA . . 4.700 5.271 4.702 5.827 1.127 16 11 "[ **** * *1*-* .+* ]" 1
46 1 100 ILE H 1 101 PRO QD . . 4.290 4.252 4.191 4.308 0.018 6 0 "[ . 1 . ]" 1
47 1 100 ILE H 1 106 PHE QB . . 3.950 3.864 3.084 5.092 1.142 3 4 "[ + *- 1 .* ]" 1
48 1 48 ASN QB 1 49 ALA H . . 3.510 2.599 2.381 2.804 . 0 0 "[ . 1 . ]" 1
49 1 99 ASP QB 1 100 ILE H . . 3.830 3.162 2.737 3.596 . 0 0 "[ . 1 . ]" 1
50 1 49 ALA H 1 54 CYS QB . . 5.500 5.275 4.553 6.260 0.760 4 1 "[ +. 1 . ]" 1
51 1 46 GLU QB 1 49 ALA H . . 4.790 4.751 4.477 5.130 0.340 8 0 "[ . 1 . ]" 1
52 1 49 ALA H 1 50 ARG QB . . 4.390 4.440 4.281 4.825 0.435 1 0 "[ . 1 . ]" 1
53 1 49 ALA H 1 51 LYS QB . . 5.370 4.792 4.639 4.966 . 0 0 "[ . 1 . ]" 1
54 1 100 ILE H 1 103 ILE HB . . 4.650 4.536 4.155 5.630 0.980 19 1 "[ . 1 . +]" 1
55 1 47 ALA MB 1 49 ALA H . . 4.530 4.583 4.412 4.782 0.252 16 0 "[ . 1 . ]" 1
56 1 100 ILE H 1 103 ILE QG . . 4.810 5.380 4.139 5.821 1.011 13 14 "[** *.-** ***+** ** ]" 1
57 1 100 ILE H 1 100 ILE HB . . 3.500 2.653 2.505 2.914 . 0 0 "[ . 1 . ]" 1
58 1 100 ILE H 1 100 ILE MD . . 4.180 3.605 3.008 3.983 . 0 0 "[ . 1 . ]" 1
59 1 26 ASP H 1 27 ALA H . . 3.200 2.760 2.712 2.841 . 0 0 "[ . 1 . ]" 1
60 1 26 ASP QB 1 27 ALA H . . 3.330 3.113 2.512 3.459 0.129 16 0 "[ . 1 . ]" 1
61 1 117 ALA HA 1 119 VAL H . . 4.820 4.743 4.477 4.957 0.137 9 0 "[ . 1 . ]" 1
62 1 119 VAL H 1 120 ASP HB2 . . 4.860 4.818 4.492 5.162 0.302 2 0 "[ . 1 . ]" 1
63 1 118 GLN H 1 119 VAL H . . 3.420 2.745 2.628 2.861 . 0 0 "[ . 1 . ]" 1
64 1 116 ILE HA 1 119 VAL H . . 3.930 3.535 3.338 3.740 . 0 0 "[ . 1 . ]" 1
65 1 82 TYR QB 1 83 GLU H . . 3.670 3.067 1.871 3.490 . 0 0 "[ . 1 . ]" 1
66 1 119 VAL H 1 119 VAL HB . . 3.310 2.693 2.435 3.614 0.304 15 0 "[ . 1 . ]" 1
67 1 83 GLU H 1 83 GLU QB . . 2.870 2.748 2.102 3.286 0.416 12 0 "[ . 1 . ]" 1
68 1 117 ALA MB 1 119 VAL H . . 4.610 4.542 4.441 4.717 0.107 15 0 "[ . 1 . ]" 1
69 1 15 ALA MB 1 83 GLU H . . 4.880 5.105 3.577 5.672 0.792 8 7 "[-* ** + 1 * . * ]" 1
70 1 81 THR MG 1 83 GLU H . . 4.510 3.594 1.945 5.384 0.874 16 3 "[ . * 1 - .+ ]" 1
71 1 65 ILE MG 1 119 VAL H . . 4.230 4.226 3.680 5.914 1.684 17 2 "[ . 1- . + ]" 1
72 1 46 GLU QG 1 47 ALA H . . 3.090 2.421 2.008 3.928 0.838 10 1 "[ . + . ]" 1
73 1 25 LEU H 1 25 LEU QB . . 2.950 2.287 2.024 2.536 . 0 0 "[ . 1 . ]" 1
74 1 55 THR H 1 56 ARG H . . 4.770 4.521 4.444 4.588 . 0 0 "[ . 1 . ]" 1
75 1 55 THR HA 1 56 ARG H . . 3.190 2.416 2.204 2.551 . 0 0 "[ . 1 . ]" 1
76 1 18 SER HA 1 21 ALA H . . 5.090 3.393 3.088 3.691 . 0 0 "[ . 1 . ]" 1
77 1 56 ARG H 1 57 GLY QA . . 5.100 4.539 4.484 4.665 . 0 0 "[ . 1 . ]" 1
78 1 30 GLY QA 1 32 LEU H . . 4.210 4.262 3.271 5.432 1.222 15 4 "[- . 1 + **]" 1
79 1 56 ARG H 1 56 ARG QD . . 4.480 4.239 3.902 4.488 0.008 17 0 "[ . 1 . ]" 1
80 1 25 LEU H 1 28 ASP QB . . 5.480 5.380 4.530 6.320 0.840 1 2 "[+ . - . ]" 1
81 1 45 MET QB 1 47 ALA H . . 4.840 4.536 4.439 4.816 . 0 0 "[ . 1 . ]" 1
82 1 24 ASP QB 1 25 LEU H . . 4.020 3.715 2.627 4.032 0.012 15 0 "[ . 1 . ]" 1
83 1 31 LYS QB 1 32 LEU H . . 4.040 3.423 2.260 4.039 . 0 0 "[ . 1 . ]" 1
84 1 56 ARG H 1 56 ARG QB . . 3.110 2.164 2.049 2.580 . 0 0 "[ . 1 . ]" 1
85 1 32 LEU H 1 32 LEU QB . . 3.190 2.778 2.112 3.420 0.230 7 0 "[ . 1 . ]" 1
86 1 152 THR MG 1 153 PHE H . . 4.030 3.420 1.976 3.996 . 0 0 "[ . 1 . ]" 1
87 1 32 LEU H 1 32 LEU QD . . 3.550 2.755 1.894 3.511 . 0 0 "[ . 1 . ]" 1
88 1 25 LEU H 1 25 LEU QD . . 3.530 2.519 1.802 3.679 0.149 10 0 "[ . 1 . ]" 1
89 1 153 PHE H 1 153 PHE QD . . 3.450 3.358 2.412 3.969 0.519 8 1 "[ . + 1 . ]" 1
90 1 135 ASN HA 1 137 GLN H . . 4.540 3.520 3.142 4.071 . 0 0 "[ . 1 . ]" 1
91 1 152 THR HA 1 153 PHE H . . 2.950 2.924 2.521 3.541 0.591 12 3 "[ . * +- . ]" 1
92 1 20 PHE QB 1 21 ALA H . . 5.090 2.836 2.791 2.933 . 0 0 "[ . 1 . ]" 1
93 1 153 PHE H 1 153 PHE HB3 . . 3.440 3.581 2.173 4.060 0.620 18 5 "[ *- *1 . +*]" 1
94 1 98 VAL HA 1 99 ASP H . . 2.680 2.199 2.145 2.317 . 0 0 "[ . 1 . ]" 1
95 1 99 ASP H 1 99 ASP QB . . 3.160 2.693 2.366 3.093 . 0 0 "[ . 1 . ]" 1
96 1 98 VAL HB 1 99 ASP H . . 4.290 4.315 3.941 4.543 0.253 17 0 "[ . 1 . ]" 1
97 1 65 ILE H 1 66 LYS H . . 4.660 4.593 4.481 4.621 . 0 0 "[ . 1 . ]" 1
98 1 63 SER HA 1 65 ILE H . . 4.530 3.491 3.353 3.570 . 0 0 "[ . 1 . ]" 1
99 1 62 LEU HA 1 65 ILE H . . 4.250 4.041 3.926 4.365 0.115 19 0 "[ . 1 . ]" 1
100 1 51 LYS H 1 51 LYS HA . . 2.920 2.812 2.780 2.849 . 0 0 "[ . 1 . ]" 1
101 1 65 ILE H 1 65 ILE HB . . 3.060 2.349 2.148 2.425 . 0 0 "[ . 1 . ]" 1
102 1 51 LYS H 1 51 LYS QG . . 4.080 4.011 3.928 4.058 . 0 0 "[ . 1 . ]" 1
103 1 65 ILE H 1 65 ILE QG . . 3.560 2.621 2.333 4.011 0.451 11 0 "[ . 1 . ]" 1
104 1 65 ILE H 1 65 ILE MG . . 3.400 3.627 2.786 3.749 0.349 13 0 "[ . 1 . ]" 1
105 1 65 ILE H 1 65 ILE MD . . 3.470 3.710 3.336 4.110 0.640 17 1 "[ . 1 . + ]" 1
106 1 70 LYS H 1 71 MET H . . 3.810 2.462 2.376 2.655 . 0 0 "[ . 1 . ]" 1
107 1 68 THR HG1 1 71 MET H . . 3.980 2.578 2.146 2.876 . 0 0 "[ . 1 . ]" 1
108 1 69 PRO QD 1 71 MET H . . 4.320 4.181 4.006 4.440 0.120 5 0 "[ . 1 . ]" 1
109 1 71 MET H 1 71 MET QG . . 3.650 2.978 2.151 3.961 0.311 1 0 "[ . 1 . ]" 1
110 1 71 MET H 1 71 MET ME . . 3.970 4.702 3.743 5.311 1.341 1 15 "[+***.** ** -****** ]" 1
111 1 68 THR MG 1 71 MET H . . 4.220 3.963 3.648 4.238 0.018 6 0 "[ . 1 . ]" 1
112 1 70 LYS QG 1 71 MET H . . 4.660 4.238 3.592 4.572 . 0 0 "[ . 1 . ]" 1
113 1 71 MET H 1 72 LYS QG . . 4.180 3.979 3.541 4.781 0.601 6 1 "[ .+ 1 . ]" 1
114 1 71 MET H 1 75 ILE MD . . 5.160 5.488 5.148 5.947 0.787 7 3 "[* . + - . ]" 1
115 1 23 THR H 1 24 ASP H . . 4.560 4.505 4.334 4.647 0.087 5 0 "[ . 1 . ]" 1
116 1 23 THR HA 1 24 ASP H . . 2.890 2.527 2.144 2.726 . 0 0 "[ . 1 . ]" 1
117 1 23 THR HB 1 24 ASP H . . 3.370 3.564 2.803 4.001 0.631 18 3 "[ . - * . + ]" 1
118 1 71 MET H 1 72 LYS HA . . 5.420 5.225 5.048 5.365 . 0 0 "[ . 1 . ]" 1
119 1 24 ASP H 1 24 ASP QB . . 3.230 2.610 2.288 3.214 . 0 0 "[ . 1 . ]" 1
120 1 82 TYR H 1 83 GLU QG . . 5.020 4.372 2.920 5.617 0.597 4 1 "[ +. 1 . ]" 1
121 1 24 ASP H 1 25 LEU QB . . 4.390 4.415 3.633 5.232 0.842 11 1 "[ . 1+ . ]" 1
122 1 23 THR MG 1 24 ASP H . . 3.510 2.576 1.934 3.351 . 0 0 "[ . 1 . ]" 1
123 1 13 ILE H 1 14 VAL H . . 4.280 2.170 2.058 2.362 . 0 0 "[ . 1 . ]" 1
124 1 81 THR H 1 82 TYR H . . 3.670 3.917 2.588 4.648 0.978 11 11 "[****. * *+ * ** - ]" 1
125 1 44 GLU H 1 45 MET H . . 3.430 2.641 2.473 2.875 . 0 0 "[ . 1 . ]" 1
126 1 82 TYR H 1 82 TYR QD . . 3.290 2.697 1.910 3.571 0.281 6 0 "[ . 1 . ]" 1
127 1 82 TYR H 1 82 TYR QE . . 5.110 4.182 3.702 4.778 . 0 0 "[ . 1 . ]" 1
128 1 48 ASN HA 1 51 LYS H . . 3.800 3.644 3.484 3.799 . 0 0 "[ . 1 . ]" 1
129 1 81 THR HB 1 82 TYR H . . 3.440 2.952 1.906 4.105 0.665 8 4 "[ . + 1 - . * *]" 1
130 1 82 TYR H 1 82 TYR QB . . 3.550 2.979 2.337 3.441 . 0 0 "[ . 1 . ]" 1
131 1 51 LYS H 1 51 LYS QE . . 4.800 4.221 3.757 4.684 . 0 0 "[ . 1 . ]" 1
132 1 48 ASN QB 1 51 LYS H . . 5.140 4.931 4.780 5.198 0.058 13 0 "[ . 1 . ]" 1
133 1 44 GLU H 1 45 MET QB . . 4.860 4.408 4.222 4.938 0.078 10 0 "[ . 1 . ]" 1
134 1 44 GLU H 1 44 GLU QB . . 2.800 2.147 2.046 2.270 . 0 0 "[ . 1 . ]" 1
135 1 51 LYS H 1 51 LYS QB . . 2.730 2.234 2.150 2.258 . 0 0 "[ . 1 . ]" 1
136 1 43 LYS QB 1 44 GLU H . . 3.490 3.456 2.702 3.536 0.046 5 0 "[ . 1 . ]" 1
137 1 43 LYS QG 1 44 GLU H . . 3.540 2.226 1.934 3.789 0.249 19 0 "[ . 1 . ]" 1
138 1 15 ALA MB 1 82 TYR H . . 4.330 3.564 2.212 4.674 0.344 6 0 "[ . 1 . ]" 1
139 1 13 ILE QG 1 14 VAL H . . 4.810 4.400 3.783 4.672 . 0 0 "[ . 1 . ]" 1
140 1 14 VAL H 1 15 ALA MB . . 4.480 4.366 4.161 4.659 0.179 1 0 "[ . 1 . ]" 1
141 1 81 THR MG 1 82 TYR H . . 3.810 2.292 1.868 3.566 . 0 0 "[ . 1 . ]" 1
142 1 13 ILE MG 1 14 VAL H . . 3.540 2.222 1.990 2.386 . 0 0 "[ . 1 . ]" 1
143 1 43 LYS H 1 44 GLU H . . 3.430 2.680 2.480 2.766 . 0 0 "[ . 1 . ]" 1
144 1 42 LEU H 1 44 GLU H . . 4.550 4.003 3.901 4.138 . 0 0 "[ . 1 . ]" 1
145 1 61 CYS H 1 62 LEU H . . 3.650 2.696 2.600 2.869 . 0 0 "[ . 1 . ]" 1
146 1 60 ILE H 1 61 CYS H . . 3.680 2.684 2.556 2.833 . 0 0 "[ . 1 . ]" 1
147 1 61 CYS H 1 62 LEU HG . . 4.850 3.968 3.763 4.344 . 0 0 "[ . 1 . ]" 1
148 1 57 GLY QA 1 61 CYS H . . 4.540 3.872 3.601 4.132 . 0 0 "[ . 1 . ]" 1
149 1 59 LEU HA 1 61 CYS H . . 4.370 4.225 4.121 4.547 0.177 5 0 "[ . 1 . ]" 1
150 1 60 ILE HB 1 61 CYS H . . 3.560 2.804 2.434 2.969 . 0 0 "[ . 1 . ]" 1
151 1 60 ILE MG 1 61 CYS H . . 3.590 3.280 2.923 3.561 . 0 0 "[ . 1 . ]" 1
152 1 140 ASP H 1 141 LEU H . . 3.810 2.815 2.690 2.870 . 0 0 "[ . 1 . ]" 1
153 1 139 SER H 1 140 ASP H . . 4.580 4.568 4.523 4.616 0.036 1 0 "[ . 1 . ]" 1
154 1 139 SER HA 1 140 ASP H . . 3.280 2.460 2.401 2.483 . 0 0 "[ . 1 . ]" 1
155 1 139 SER HB2 1 140 ASP H . . 3.910 3.620 2.852 4.009 0.099 3 0 "[ . 1 . ]" 1
156 1 140 ASP H 1 140 ASP QB . . 3.160 2.188 2.055 2.512 . 0 0 "[ . 1 . ]" 1
157 1 133 LEU H 1 133 LEU HG . . 3.020 3.012 1.976 4.383 1.363 13 4 "[ -. * 1 *+ . ]" 1
158 1 140 ASP H 1 141 LEU QB . . 4.980 4.531 4.464 4.586 . 0 0 "[ . 1 . ]" 1
159 1 69 PRO QD 1 97 ILE H . . 4.160 4.868 2.240 7.458 3.298 12 9 "[* . * *1*+**.*- ]" 1
160 1 109 LEU H 1 110 GLU H . . 4.810 4.576 4.537 4.633 . 0 0 "[ . 1 . ]" 1
161 1 128 GLY H 1 129 CYS H . . 3.660 2.702 2.554 2.794 . 0 0 "[ . 1 . ]" 1
162 1 126 THR HG1 1 129 CYS H . . 3.700 2.764 2.566 2.900 . 0 0 "[ . 1 . ]" 1
163 1 129 CYS H 1 129 CYS QB . . 3.520 2.244 2.192 2.415 . 0 0 "[ . 1 . ]" 1
164 1 108 ASP HB2 1 109 LEU H . . 4.510 4.300 3.849 4.462 . 0 0 "[ . 1 . ]" 1
165 1 129 CYS H 1 130 LEU QB . . 4.730 4.575 4.116 4.873 0.143 16 0 "[ . 1 . ]" 1
166 1 52 ALA MB 1 129 CYS H . . 4.110 4.334 3.284 5.172 1.062 13 8 "[* * * * + .* *-]" 1
167 1 129 CYS H 1 130 LEU HG . . 4.110 4.412 3.797 5.035 0.925 2 7 "[ +**- 1* * *]" 1
168 1 126 THR MG 1 129 CYS H . . 4.250 4.120 4.091 4.163 . 0 0 "[ . 1 . ]" 1
169 1 127 THR H 1 129 CYS H . . 4.850 4.173 3.949 4.370 . 0 0 "[ . 1 . ]" 1
170 1 133 LEU H 1 134 ALA H . . 3.960 2.659 2.546 2.688 . 0 0 "[ . 1 . ]" 1
171 1 108 ASP HB3 1 109 LEU H . . 4.510 3.736 3.131 4.103 . 0 0 "[ . 1 . ]" 1
172 1 109 LEU H 1 109 LEU QB . . 3.270 2.243 2.110 2.498 . 0 0 "[ . 1 . ]" 1
173 1 97 ILE H 1 97 ILE HB . . 2.580 2.965 2.652 3.695 1.115 15 4 "[ - . * + * ]" 1
174 1 10 ASP H 1 11 PHE H . . 3.300 2.489 2.184 2.874 . 0 0 "[ . 1 . ]" 1
175 1 121 LEU H 1 122 CYS H . . 3.200 2.798 2.620 2.948 . 0 0 "[ . 1 . ]" 1
176 1 10 ASP H 1 11 PHE QD . . 4.380 2.660 2.244 3.643 . 0 0 "[ . 1 . ]" 1
177 1 118 GLN HA 1 122 CYS H . . 4.510 4.503 4.317 4.669 0.159 2 0 "[ . 1 . ]" 1
178 1 122 CYS H 1 122 CYS QB . . 3.340 2.215 2.061 2.594 . 0 0 "[ . 1 . ]" 1
179 1 10 ASP H 1 10 ASP QB . . 2.830 2.581 2.246 2.786 . 0 0 "[ . 1 . ]" 1
180 1 121 LEU QB 1 122 CYS H . . 3.410 2.496 2.320 2.662 . 0 0 "[ . 1 . ]" 1
181 1 121 LEU QD 1 122 CYS H . . 4.000 3.986 3.262 4.148 0.148 15 0 "[ . 1 . ]" 1
182 1 29 ARG H 1 30 GLY H . . 2.870 2.545 2.385 2.583 . 0 0 "[ . 1 . ]" 1
183 1 95 GLU H 1 95 GLU QG . . 3.120 2.880 2.129 3.499 0.379 6 0 "[ . 1 . ]" 1
184 1 95 GLU H 1 95 GLU QB . . 3.080 2.626 2.112 3.269 0.189 4 0 "[ . 1 . ]" 1
185 1 29 ARG H 1 29 ARG QB . . 2.600 2.093 2.048 2.253 . 0 0 "[ . 1 . ]" 1
186 1 27 ALA MB 1 29 ARG H . . 4.570 4.415 4.243 4.549 . 0 0 "[ . 1 . ]" 1
187 1 95 GLU H 1 96 ALA MB . . 5.400 5.645 4.684 5.899 0.499 8 0 "[ . 1 . ]" 1
188 1 61 CYS HB2 1 62 LEU H . . 3.970 3.645 3.407 3.828 . 0 0 "[ . 1 . ]" 1
189 1 140 ASP QB 1 141 LEU H . . 3.540 2.588 2.434 3.279 . 0 0 "[ . 1 . ]" 1
190 1 141 LEU H 1 141 LEU QD . . 3.630 3.482 2.824 3.772 0.142 7 0 "[ . 1 . ]" 1
191 1 60 ILE MG 1 62 LEU H . . 4.920 5.003 4.728 5.312 0.392 14 0 "[ . 1 . ]" 1
192 1 46 GLU H 1 47 ALA H . . 3.790 2.630 2.517 2.899 . 0 0 "[ . 1 . ]" 1
193 1 59 LEU HA 1 62 LEU H . . 4.230 3.508 3.339 3.728 . 0 0 "[ . 1 . ]" 1
194 1 46 GLU H 1 46 GLU QG . . 3.010 2.610 1.917 3.962 0.952 9 3 "[ -. +1* . ]" 1
195 1 46 GLU H 1 46 GLU QB . . 3.070 2.351 2.116 2.644 . 0 0 "[ . 1 . ]" 1
196 1 62 LEU H 1 62 LEU HG . . 3.430 1.960 1.920 2.013 . 0 0 "[ . 1 . ]" 1
197 1 62 LEU H 1 62 LEU QB . . 3.530 2.678 2.592 2.762 . 0 0 "[ . 1 . ]" 1
198 1 141 LEU H 1 141 LEU QB . . 3.310 2.110 2.022 2.228 . 0 0 "[ . 1 . ]" 1
199 1 46 GLU H 1 47 ALA MB . . 4.480 4.236 4.063 4.438 . 0 0 "[ . 1 . ]" 1
200 1 62 LEU H 1 62 LEU QD . . 3.280 2.559 2.194 2.933 . 0 0 "[ . 1 . ]" 1
201 1 13 ILE MD 1 46 GLU H . . 4.370 3.682 2.802 4.347 . 0 0 "[ . 1 . ]" 1
202 1 116 ILE H 1 117 ALA H . . 3.920 2.633 2.535 2.786 . 0 0 "[ . 1 . ]" 1
203 1 102 ALA H 1 103 ILE H . . 3.220 2.367 2.210 2.562 . 0 0 "[ . 1 . ]" 1
204 1 103 ILE H 1 106 PHE QD . . 5.050 5.587 5.015 6.093 1.043 13 11 "[ * *. * *1**+-* ** ]" 1
205 1 101 PRO HA 1 103 ILE H . . 3.870 3.892 3.786 3.997 0.127 3 0 "[ . 1 . ]" 1
206 1 102 ALA HA 1 103 ILE H . . 3.560 3.307 3.241 3.441 . 0 0 "[ . 1 . ]" 1
207 1 103 ILE H 1 104 PRO HD3 . . 3.800 3.475 3.043 4.210 0.410 19 0 "[ . 1 . ]" 1
208 1 103 ILE H 1 103 ILE HB . . 3.170 3.148 3.038 3.559 0.389 19 0 "[ . 1 . ]" 1
209 1 103 ILE H 1 103 ILE QG . . 3.130 2.559 2.158 2.748 . 0 0 "[ . 1 . ]" 1
210 1 100 ILE HB 1 103 ILE H . . 3.630 2.770 2.272 3.192 . 0 0 "[ . 1 . ]" 1
211 1 103 ILE H 1 103 ILE MD . . 3.970 4.121 3.848 4.214 0.244 7 0 "[ . 1 . ]" 1
212 1 100 ILE MG 1 103 ILE H . . 3.260 2.139 1.906 2.874 . 0 0 "[ . 1 . ]" 1
213 1 100 ILE MD 1 103 ILE H . . 4.750 4.804 4.218 5.058 0.308 9 0 "[ . 1 . ]" 1
214 1 50 ARG H 1 52 ALA H . . 4.840 4.164 3.995 4.288 . 0 0 "[ . 1 . ]" 1
215 1 115 PHE QD 1 116 ILE H . . 3.970 3.288 3.056 3.543 . 0 0 "[ . 1 . ]" 1
216 1 113 GLU HA 1 116 ILE H . . 4.000 3.523 3.381 3.666 . 0 0 "[ . 1 . ]" 1
217 1 115 PHE QB 1 116 ILE H . . 3.950 2.473 2.321 2.729 . 0 0 "[ . 1 . ]" 1
218 1 112 MET QG 1 116 ILE H . . 5.500 4.982 4.550 6.038 0.538 17 1 "[ . 1 . + ]" 1
219 1 46 GLU QB 1 50 ARG H . . 4.480 4.612 4.072 5.258 0.778 4 4 "[ +. *1* - ]" 1
220 1 109 LEU QB 1 110 GLU H . . 3.810 2.766 2.264 3.177 . 0 0 "[ . 1 . ]" 1
221 1 116 ILE H 1 116 ILE QG . . 3.380 3.266 2.313 3.495 0.115 3 0 "[ . 1 . ]" 1
222 1 49 ALA H 1 50 ARG H . . 3.500 2.675 2.514 2.873 . 0 0 "[ . 1 . ]" 1
223 1 11 PHE H 1 12 ASN H . . 4.710 4.385 4.374 4.413 . 0 0 "[ . 1 . ]" 1
224 1 44 GLU H 1 46 GLU H . . 4.130 4.126 3.927 4.250 0.120 18 0 "[ . 1 . ]" 1
225 1 11 PHE QE 1 12 ASN H . . 4.720 4.827 4.496 5.189 0.469 12 0 "[ . 1 . ]" 1
226 1 11 PHE QD 1 12 ASN H . . 4.030 2.716 2.406 3.297 . 0 0 "[ . 1 . ]" 1
227 1 11 PHE HA 1 12 ASN H . . 2.550 2.460 2.403 2.469 . 0 0 "[ . 1 . ]" 1
228 1 109 LEU HA 1 110 GLU H . . 3.180 2.351 2.263 2.457 . 0 0 "[ . 1 . ]" 1
229 1 47 ALA HA 1 50 ARG H . . 3.850 3.659 3.351 4.005 0.155 1 0 "[ . 1 . ]" 1
230 1 12 ASN H 1 12 ASN QB . . 3.150 2.574 2.262 3.043 . 0 0 "[ . 1 . ]" 1
231 1 11 PHE HB2 1 12 ASN H . . 2.620 2.449 2.399 2.557 . 0 0 "[ . 1 . ]" 1
232 1 110 GLU H 1 110 GLU QG . . 3.280 2.152 1.806 2.747 . 0 0 "[ . 1 . ]" 1
233 1 112 MET ME 1 116 ILE H . . 3.710 3.669 3.469 3.930 0.220 7 0 "[ . 1 . ]" 1
234 1 110 GLU H 1 114 GLN QG . . 5.120 4.788 4.046 7.297 2.177 10 2 "[ . + . -]" 1
235 1 42 LEU QD 1 46 GLU H . . 4.020 3.965 2.811 5.108 1.088 19 4 "[ . 1 * . *-+]" 1
236 1 51 LYS QE 1 52 ALA H . . 5.410 4.909 2.589 5.476 0.066 1 0 "[ . 1 . ]" 1
237 1 26 ASP H 1 27 ALA MB . . 4.880 4.401 4.337 4.516 . 0 0 "[ . 1 . ]" 1
238 1 51 LYS H 1 52 ALA H . . 3.280 2.634 2.503 2.734 . 0 0 "[ . 1 . ]" 1
239 1 26 ASP H 1 26 ASP QB . . 3.010 2.319 2.079 2.679 . 0 0 "[ . 1 . ]" 1
240 1 51 LYS QB 1 52 ALA H . . 3.200 2.740 2.660 2.967 . 0 0 "[ . 1 . ]" 1
241 1 25 LEU QB 1 26 ASP H . . 3.510 3.236 2.615 3.698 0.188 9 0 "[ . 1 . ]" 1
242 1 57 GLY QA 1 60 ILE H . . 4.290 3.645 3.498 3.838 . 0 0 "[ . 1 . ]" 1
243 1 60 ILE H 1 60 ILE HB . . 3.070 2.387 2.231 2.577 . 0 0 "[ . 1 . ]" 1
244 1 60 ILE H 1 60 ILE QG . . 3.540 2.580 1.996 3.525 . 0 0 "[ . 1 . ]" 1
245 1 59 LEU HB3 1 60 ILE H . . 4.020 3.686 3.434 3.868 . 0 0 "[ . 1 . ]" 1
246 1 31 LYS H 1 31 LYS QG . . 5.140 3.390 2.109 4.343 . 0 0 "[ . 1 . ]" 1
247 1 60 ILE H 1 60 ILE MD . . 3.200 3.080 2.097 3.727 0.527 13 1 "[ . 1 + . ]" 1
248 1 59 LEU HB2 1 60 ILE H . . 4.100 2.584 2.412 2.800 . 0 0 "[ . 1 . ]" 1
249 1 112 MET H 1 115 PHE H . . 5.030 5.085 4.989 5.162 0.132 6 0 "[ . 1 . ]" 1
250 1 115 PHE H 1 116 ILE H . . 3.700 2.790 2.660 2.900 . 0 0 "[ . 1 . ]" 1
251 1 114 GLN H 1 115 PHE H . . 3.750 2.824 2.738 2.878 . 0 0 "[ . 1 . ]" 1
252 1 38 PRO HA 1 41 VAL H . . 4.960 4.843 4.535 4.988 0.028 7 0 "[ . 1 . ]" 1
253 1 142 LEU HA 1 146 LEU H . . 4.610 3.591 3.011 4.068 . 0 0 "[ . 1 . ]" 1
254 1 114 GLN HA 1 117 ALA H . . 4.210 3.535 3.394 3.737 . 0 0 "[ . 1 . ]" 1
255 1 115 PHE H 1 115 PHE QB . . 3.640 2.235 2.208 2.250 . 0 0 "[ . 1 . ]" 1
256 1 40 GLU QG 1 41 VAL H . . 3.950 1.909 1.853 2.041 . 0 0 "[ . 1 . ]" 1
257 1 40 GLU HB2 1 41 VAL H . . 3.850 3.609 3.429 3.834 . 0 0 "[ . 1 . ]" 1
258 1 146 LEU H 1 146 LEU QB . . 3.420 2.567 2.314 2.799 . 0 0 "[ . 1 . ]" 1
259 1 38 PRO QG 1 41 VAL H . . 5.040 2.694 2.423 2.913 . 0 0 "[ . 1 . ]" 1
260 1 16 VAL QG 1 17 ALA H . . 3.050 2.622 1.944 3.072 0.022 18 0 "[ . 1 . ]" 1
261 1 146 LEU H 1 146 LEU QD . . 3.590 2.406 2.111 3.045 . 0 0 "[ . 1 . ]" 1
262 1 41 VAL H 1 41 VAL QG . . 2.990 2.198 1.877 2.617 . 0 0 "[ . 1 . ]" 1
263 1 41 VAL H 1 141 LEU QD . . 3.400 3.714 2.848 4.168 0.768 13 7 "[ *** - 1 *+ . * ]" 1
264 1 115 PHE H 1 117 ALA H . . 4.820 4.038 3.938 4.152 . 0 0 "[ . 1 . ]" 1
265 1 41 VAL H 1 43 LYS H . . 4.560 4.263 4.076 4.472 . 0 0 "[ . 1 . ]" 1
266 1 41 VAL H 1 44 GLU H . . 5.010 4.821 4.558 5.071 0.061 4 0 "[ . 1 . ]" 1
267 1 113 GLU H 1 114 GLN H . . 3.460 2.599 2.545 2.698 . 0 0 "[ . 1 . ]" 1
268 1 114 GLN H 1 114 GLN QE . . 5.170 5.089 4.576 5.435 0.265 7 0 "[ . 1 . ]" 1
269 1 112 MET HA 1 115 PHE H . . 4.120 3.775 3.504 3.936 . 0 0 "[ . 1 . ]" 1
270 1 114 GLN QB 1 115 PHE H . . 4.210 2.483 2.433 2.562 . 0 0 "[ . 1 . ]" 1
271 1 116 ILE HB 1 117 ALA H . . 3.320 2.864 2.659 2.954 . 0 0 "[ . 1 . ]" 1
272 1 117 ALA H 1 117 ALA MB . . 2.850 2.088 2.024 2.242 . 0 0 "[ . 1 . ]" 1
273 1 114 GLN H 1 114 GLN QG . . 4.120 2.827 2.528 3.918 . 0 0 "[ . 1 . ]" 1
274 1 115 PHE H 1 116 ILE MD . . 4.510 3.931 3.804 4.521 0.011 6 0 "[ . 1 . ]" 1
275 1 112 MET H 1 114 GLN H . . 4.650 3.996 3.900 4.152 . 0 0 "[ . 1 . ]" 1
276 1 119 VAL H 1 120 ASP H . . 3.490 2.760 2.657 2.811 . 0 0 "[ . 1 . ]" 1
277 1 52 ALA H 1 54 CYS H . . 4.200 4.344 4.082 4.708 0.508 14 1 "[ . 1 +. ]" 1
278 1 120 ASP H 1 120 ASP HB2 . . 3.320 2.269 2.084 2.619 . 0 0 "[ . 1 . ]" 1
279 1 54 CYS H 1 54 CYS QB . . 3.410 2.514 2.401 2.906 . 0 0 "[ . 1 . ]" 1
280 1 119 VAL HB 1 120 ASP H . . 3.390 2.837 2.602 3.786 0.396 15 0 "[ . 1 . ]" 1
281 1 119 VAL QG 1 120 ASP H . . 3.470 3.153 2.084 3.367 . 0 0 "[ . 1 . ]" 1
282 1 67 CYS H 1 68 THR H . . 4.430 4.430 4.292 4.520 0.090 10 0 "[ . 1 . ]" 1
283 1 123 VAL H 1 125 CYS H . . 4.360 4.846 4.372 5.342 0.982 2 5 "[ + .*- 1 * *]" 1
284 1 122 CYS HA 1 123 VAL H . . 2.980 2.367 2.176 3.537 0.557 11 1 "[ . 1+ . ]" 1
285 1 139 SER HB2 1 142 LEU H . . 4.060 3.164 2.109 3.927 . 0 0 "[ . 1 . ]" 1
286 1 122 CYS QB 1 123 VAL H . . 4.080 3.797 2.696 4.002 . 0 0 "[ . 1 . ]" 1
287 1 45 MET H 1 45 MET QB . . 3.530 2.178 2.063 2.551 . 0 0 "[ . 1 . ]" 1
288 1 123 VAL H 1 123 VAL HB . . 3.730 3.672 3.614 3.957 0.227 11 0 "[ . 1 . ]" 1
289 1 45 MET H 1 45 MET QG . . 2.750 2.908 1.942 3.445 0.695 8 2 "[ . + 1 . -]" 1
290 1 130 LEU QB 1 131 LYS H . . 3.010 2.437 2.338 2.575 . 0 0 "[ . 1 . ]" 1
291 1 142 LEU H 1 142 LEU QD . . 2.830 2.333 1.852 3.348 0.518 4 1 "[ +. 1 . ]" 1
292 1 34 GLY H 1 35 LYS H . . 4.210 2.663 1.898 4.028 . 0 0 "[ . 1 . ]" 1
293 1 45 MET H 1 46 GLU H . . 3.480 2.676 2.490 2.847 . 0 0 "[ . 1 . ]" 1
294 1 48 ASN H 1 48 ASN QD . . 4.200 2.973 2.085 3.713 . 0 0 "[ . 1 . ]" 1
295 1 66 LYS HA 1 67 CYS H . . 2.950 2.254 2.159 2.303 . 0 0 "[ . 1 . ]" 1
296 1 17 ALA HA 1 19 ASN H . . 4.730 4.302 4.006 4.555 . 0 0 "[ . 1 . ]" 1
297 1 16 VAL HA 1 19 ASN H . . 4.400 3.540 3.186 3.861 . 0 0 "[ . 1 . ]" 1
298 1 67 CYS H 1 67 CYS QB . . 3.250 2.871 2.469 3.130 . 0 0 "[ . 1 . ]" 1
299 1 58 CYS HB2 1 59 LEU H . . 4.510 3.470 1.936 3.749 . 0 0 "[ . 1 . ]" 1
300 1 67 CYS H 1 71 MET ME . . 4.780 5.453 4.675 5.682 0.902 16 15 "[***-. **** * **+***]" 1
301 1 35 LYS H 1 35 LYS QB . . 3.470 2.919 2.564 3.398 . 0 0 "[ . 1 . ]" 1
302 1 66 LYS QB 1 67 CYS H . . 3.440 2.892 2.634 3.422 . 0 0 "[ . 1 . ]" 1
303 1 66 LYS QD 1 67 CYS H . . 4.080 4.401 3.630 5.313 1.233 10 6 "[ ** + -*. *]" 1
304 1 48 ASN H 1 49 ALA MB . . 4.260 4.235 4.088 4.461 0.201 8 0 "[ . 1 . ]" 1
305 1 13 ILE MG 1 45 MET H . . 4.370 3.750 3.392 4.118 . 0 0 "[ . 1 . ]" 1
306 1 65 ILE MG 1 67 CYS H . . 4.570 4.428 4.091 4.580 0.010 19 0 "[ . 1 . ]" 1
307 1 140 ASP H 1 142 LEU H . . 4.880 4.204 4.031 4.371 . 0 0 "[ . 1 . ]" 1
308 1 141 LEU H 1 142 LEU H . . 3.620 2.582 2.488 2.700 . 0 0 "[ . 1 . ]" 1
309 1 142 LEU H 1 143 LYS H . . 3.980 2.665 2.466 2.758 . 0 0 "[ . 1 . ]" 1
310 1 123 VAL H 1 124 ASP HA . . 4.880 4.900 4.617 5.460 0.580 11 1 "[ . 1+ . ]" 1
311 1 139 SER HB3 1 142 LEU H . . 4.060 3.109 2.272 4.206 0.146 15 0 "[ . 1 . ]" 1
312 1 58 CYS HA 1 124 ASP H . . 4.730 4.656 3.747 5.145 0.415 16 0 "[ . 1 . ]" 1
313 1 48 ASN H 1 48 ASN QB . . 3.110 2.534 2.370 2.724 . 0 0 "[ . 1 . ]" 1
314 1 46 GLU QB 1 48 ASN H . . 4.550 4.967 4.455 5.236 0.686 5 5 "[ + -* 1 * . * ]" 1
315 1 46 GLU QG 1 48 ASN H . . 4.700 4.600 4.400 5.445 0.745 10 1 "[ . + . ]" 1
316 1 48 ASN H 1 50 ARG QB . . 5.390 5.101 4.645 5.901 0.511 15 1 "[ . 1 + ]" 1
317 1 48 ASN H 1 51 LYS QB . . 4.790 4.833 4.489 5.246 0.456 7 0 "[ . 1 . ]" 1
318 1 131 LYS H 1 131 LYS QB . . 2.850 2.517 2.322 2.628 . 0 0 "[ . 1 . ]" 1
319 1 142 LEU H 1 142 LEU QB . . 3.090 2.181 2.022 2.421 . 0 0 "[ . 1 . ]" 1
320 1 131 LYS H 1 131 LYS QG . . 3.150 2.132 1.925 2.485 . 0 0 "[ . 1 . ]" 1
321 1 141 LEU QB 1 142 LEU H . . 3.620 2.561 2.318 2.799 . 0 0 "[ . 1 . ]" 1
322 1 130 LEU QD 1 131 LYS H . . 4.020 3.940 3.576 4.066 0.046 11 0 "[ . 1 . ]" 1
323 1 110 GLU H 1 113 GLU H . . 4.820 4.692 4.549 4.835 0.015 19 0 "[ . 1 . ]" 1
324 1 123 VAL H 1 124 ASP H . . 3.370 2.964 2.734 3.627 0.257 2 0 "[ . 1 . ]" 1
325 1 122 CYS HA 1 124 ASP H . . 4.050 3.536 3.319 4.242 0.192 11 0 "[ . 1 . ]" 1
326 1 124 ASP H 1 125 CYS HA . . 4.770 4.777 4.631 4.946 0.176 9 0 "[ . 1 . ]" 1
327 1 124 ASP H 1 124 ASP QB . . 2.940 2.392 2.165 2.554 . 0 0 "[ . 1 . ]" 1
328 1 59 LEU H 1 60 ILE QG . . 4.830 4.901 4.315 5.940 1.110 17 4 "[ . * * .-+ ]" 1
329 1 112 MET H 1 113 GLU H . . 3.650 2.688 2.600 2.785 . 0 0 "[ . 1 . ]" 1
330 1 59 LEU H 1 60 ILE H . . 3.930 2.823 2.744 2.891 . 0 0 "[ . 1 . ]" 1
331 1 124 ASP H 1 125 CYS H . . 3.130 2.289 2.067 2.511 . 0 0 "[ . 1 . ]" 1
332 1 67 CYS HA 1 68 THR H . . 3.430 2.247 2.141 2.379 . 0 0 "[ . 1 . ]" 1
333 1 122 CYS HA 1 125 CYS H . . 5.500 5.611 5.420 6.404 0.904 11 2 "[ - . 1+ . ]" 1
334 1 125 CYS H 1 125 CYS HB3 . . 3.340 3.201 2.729 3.685 0.345 17 0 "[ . 1 . ]" 1
335 1 112 MET QG 1 113 GLU H . . 4.260 4.030 3.727 4.498 0.238 13 0 "[ . 1 . ]" 1
336 1 125 CYS H 1 125 CYS HB2 . . 3.340 2.777 2.254 3.686 0.346 13 0 "[ . 1 . ]" 1
337 1 68 THR H 1 71 MET ME . . 3.710 3.104 2.098 3.569 . 0 0 "[ . 1 . ]" 1
338 1 112 MET HB3 1 113 GLU H . . 3.350 2.569 2.461 2.837 . 0 0 "[ . 1 . ]" 1
339 1 59 LEU H 1 59 LEU HG . . 3.480 2.140 1.931 2.636 . 0 0 "[ . 1 . ]" 1
340 1 125 CYS H 1 130 LEU QD . . 4.310 4.249 3.594 4.742 0.432 19 0 "[ . 1 . ]" 1
341 1 59 LEU H 1 59 LEU QD . . 3.320 2.781 1.983 3.159 . 0 0 "[ . 1 . ]" 1
342 1 105 ARG QB 1 106 PHE H . . 4.110 3.043 2.833 3.226 . 0 0 "[ . 1 . ]" 1
343 1 105 ARG H 1 106 PHE H . . 3.470 2.525 2.333 2.685 . 0 0 "[ . 1 . ]" 1
344 1 106 PHE H 1 108 ASP H . . 4.150 4.150 3.937 4.311 0.161 17 0 "[ . 1 . ]" 1
345 1 106 PHE H 1 106 PHE QD . . 3.670 3.902 3.326 4.177 0.507 9 3 "[ -. * +1 . ]" 1
346 1 104 PRO HA 1 106 PHE H . . 3.960 3.994 3.763 4.164 0.204 14 0 "[ . 1 . ]" 1
347 1 105 ARG HA 1 106 PHE H . . 3.570 3.421 3.350 3.478 . 0 0 "[ . 1 . ]" 1
348 1 106 PHE H 1 106 PHE QB . . 2.900 2.164 2.050 2.256 . 0 0 "[ . 1 . ]" 1
349 1 28 ASP H 1 28 ASP QB . . 3.370 2.198 2.077 2.603 . 0 0 "[ . 1 . ]" 1
350 1 103 ILE HB 1 106 PHE H . . 3.680 3.354 2.383 3.627 . 0 0 "[ . 1 . ]" 1
351 1 25 LEU QB 1 28 ASP H . . 4.570 4.605 4.270 5.117 0.547 10 1 "[ . + . ]" 1
352 1 103 ILE MG 1 106 PHE H . . 3.570 2.201 1.870 3.694 0.124 19 0 "[ . 1 . ]" 1
353 1 70 LYS H 1 72 LYS H . . 4.580 4.181 3.699 4.593 0.013 14 0 "[ . 1 . ]" 1
354 1 71 MET H 1 72 LYS H . . 3.720 2.627 2.448 2.803 . 0 0 "[ . 1 . ]" 1
355 1 72 LYS H 1 72 LYS QE . . 4.430 4.462 3.700 5.123 0.693 10 3 "[ - . * + . ]" 1
356 1 71 MET ME 1 72 LYS H . . 5.020 4.814 4.323 5.134 0.114 14 0 "[ . 1 . ]" 1
357 1 72 LYS H 1 72 LYS QB . . 3.280 2.525 2.150 2.732 . 0 0 "[ . 1 . ]" 1
358 1 72 LYS H 1 72 LYS QG . . 3.290 2.184 1.866 2.943 . 0 0 "[ . 1 . ]" 1
359 1 72 LYS H 1 75 ILE MD . . 5.240 5.100 4.736 5.525 0.285 17 0 "[ . 1 . ]" 1
360 1 42 LEU H 1 43 LYS H . . 3.580 2.809 2.632 2.937 . 0 0 "[ . 1 . ]" 1
361 1 134 ALA H 1 135 ASN QD . . 5.040 3.880 3.536 4.659 . 0 0 "[ . 1 . ]" 1
362 1 131 LYS HA 1 134 ALA H . . 4.590 3.473 3.246 3.677 . 0 0 "[ . 1 . ]" 1
363 1 41 VAL HA 1 43 LYS H . . 5.040 4.582 4.166 4.784 . 0 0 "[ . 1 . ]" 1
364 1 40 GLU QG 1 43 LYS H . . 5.460 5.395 5.176 5.516 0.056 4 0 "[ . 1 . ]" 1
365 1 42 LEU QB 1 43 LYS H . . 3.050 2.382 2.228 2.744 . 0 0 "[ . 1 . ]" 1
366 1 43 LYS H 1 43 LYS QB . . 2.930 2.452 2.310 2.636 . 0 0 "[ . 1 . ]" 1
367 1 43 LYS H 1 43 LYS QG . . 3.040 2.247 2.066 2.464 . 0 0 "[ . 1 . ]" 1
368 1 133 LEU QB 1 134 ALA H . . 4.780 2.772 2.599 2.950 . 0 0 "[ . 1 . ]" 1
369 1 42 LEU QD 1 43 LYS H . . 3.700 3.338 2.305 4.079 0.379 15 0 "[ . 1 . ]" 1
370 1 62 LEU H 1 64 HIS H . . 4.300 3.920 3.808 4.072 . 0 0 "[ . 1 . ]" 1
371 1 63 SER H 1 64 HIS H . . 3.460 2.415 2.375 2.483 . 0 0 "[ . 1 . ]" 1
372 1 64 HIS H 1 65 ILE H . . 3.350 2.669 2.658 2.682 . 0 0 "[ . 1 . ]" 1
373 1 61 CYS HA 1 64 HIS H . . 3.980 3.514 3.351 3.625 . 0 0 "[ . 1 . ]" 1
374 1 64 HIS H 1 64 HIS HB2 . . 3.450 2.340 2.234 2.391 . 0 0 "[ . 1 . ]" 1
375 1 64 HIS H 1 64 HIS HB3 . . 3.510 3.592 3.500 3.620 0.110 11 0 "[ . 1 . ]" 1
376 1 64 HIS H 1 65 ILE QG . . 4.490 3.870 3.472 5.960 1.470 11 2 "[ . 1+ . - ]" 1
377 1 107 LYS H 1 108 ASP H . . 3.370 2.612 2.481 2.708 . 0 0 "[ . 1 . ]" 1
378 1 130 LEU H 1 131 LYS H . . 3.690 2.757 2.615 2.855 . 0 0 "[ . 1 . ]" 1
379 1 108 ASP H 1 109 LEU H . . 3.080 2.320 1.936 2.548 . 0 0 "[ . 1 . ]" 1
380 1 108 ASP H 1 114 GLN QE . . 4.750 4.288 3.573 4.920 0.170 19 0 "[ . 1 . ]" 1
381 1 121 LEU H 1 122 CYS HA . . 5.500 5.379 5.250 5.483 . 0 0 "[ . 1 . ]" 1
382 1 105 ARG HA 1 108 ASP H . . 4.540 3.235 3.117 3.568 . 0 0 "[ . 1 . ]" 1
383 1 127 THR HA 1 130 LEU H . . 4.060 3.545 3.337 3.793 . 0 0 "[ . 1 . ]" 1
384 1 108 ASP H 1 108 ASP HB3 . . 3.420 2.780 2.387 3.319 . 0 0 "[ . 1 . ]" 1
385 1 108 ASP H 1 108 ASP HB2 . . 3.420 2.730 2.389 3.306 . 0 0 "[ . 1 . ]" 1
386 1 107 LYS QD 1 108 ASP H . . 3.570 3.140 2.004 4.272 0.702 1 4 "[+- . 1 *.* ]" 1
387 1 130 LEU H 1 130 LEU QB . . 3.350 2.430 2.095 2.693 . 0 0 "[ . 1 . ]" 1
388 1 130 LEU H 1 130 LEU HG . . 3.290 2.349 1.908 3.111 . 0 0 "[ . 1 . ]" 1
389 1 130 LEU H 1 130 LEU QD . . 3.330 2.969 2.368 3.461 0.131 2 0 "[ . 1 . ]" 1
390 1 120 ASP H 1 121 LEU H . . 3.610 2.568 2.468 2.774 . 0 0 "[ . 1 . ]" 1
391 1 118 GLN HA 1 121 LEU H . . 4.120 3.326 3.202 3.640 . 0 0 "[ . 1 . ]" 1
392 1 119 VAL HA 1 121 LEU H . . 4.450 4.426 4.141 4.586 0.136 9 0 "[ . 1 . ]" 1
393 1 120 ASP HB2 1 121 LEU H . . 4.020 3.584 3.236 4.043 0.023 2 0 "[ . 1 . ]" 1
394 1 120 ASP HB3 1 121 LEU H . . 4.060 2.740 2.580 3.003 . 0 0 "[ . 1 . ]" 1
395 1 121 LEU H 1 121 LEU QB . . 2.890 2.366 2.036 2.550 . 0 0 "[ . 1 . ]" 1
396 1 121 LEU H 1 121 LEU HG . . 3.400 2.662 2.009 4.531 1.131 15 2 "[- . 1 + ]" 1
397 1 139 SER H 1 143 LYS H . . 4.960 4.234 3.685 4.847 . 0 0 "[ . 1 . ]" 1
398 1 127 THR H 1 130 LEU HG . . 5.210 4.928 4.249 5.502 0.292 3 0 "[ . 1 . ]" 1
399 1 127 THR H 1 130 LEU QD . . 4.600 4.121 3.202 4.671 0.071 5 0 "[ . 1 . ]" 1
400 1 127 THR H 1 128 GLY H . . 3.560 2.810 2.682 2.892 . 0 0 "[ . 1 . ]" 1
401 1 126 THR H 1 127 THR H . . 4.630 4.589 4.571 4.606 . 0 0 "[ . 1 . ]" 1
402 1 126 THR HG1 1 127 THR H . . 4.710 4.586 4.414 4.667 . 0 0 "[ . 1 . ]" 1
403 1 126 THR HA 1 127 THR H . . 2.900 2.323 2.292 2.432 . 0 0 "[ . 1 . ]" 1
404 1 127 THR H 1 127 THR HB . . 3.370 3.477 3.166 3.606 0.236 9 0 "[ . 1 . ]" 1
405 1 101 PRO QD 1 102 ALA H . . 3.500 2.609 2.601 2.639 . 0 0 "[ . 1 . ]" 1
406 1 145 TRP H 1 145 TRP QB . . 3.730 2.336 2.211 2.464 . 0 0 "[ . 1 . ]" 1
407 1 101 PRO QB 1 102 ALA H . . 3.920 3.234 3.012 3.380 . 0 0 "[ . 1 . ]" 1
408 1 101 PRO HG2 1 102 ALA H . . 3.330 2.419 2.118 2.651 . 0 0 "[ . 1 . ]" 1
409 1 139 SER H 1 142 LEU QB . . 4.130 2.068 1.860 2.637 . 0 0 "[ . 1 . ]" 1
410 1 102 ALA H 1 102 ALA MB . . 2.660 2.178 2.041 2.311 . 0 0 "[ . 1 . ]" 1
411 1 127 THR H 1 127 THR MG . . 3.160 2.907 2.341 3.496 0.336 6 0 "[ . 1 . ]" 1
412 1 102 ALA H 1 103 ILE QG . . 4.400 3.392 3.045 3.618 . 0 0 "[ . 1 . ]" 1
413 1 102 ALA H 1 121 LEU QD . . 3.770 3.434 3.059 3.850 0.080 8 0 "[ . 1 . ]" 1
414 1 100 ILE MG 1 102 ALA H . . 3.040 1.904 1.845 2.093 . 0 0 "[ . 1 . ]" 1
415 1 145 TRP H 1 146 LEU H . . 3.610 2.399 2.266 2.530 . 0 0 "[ . 1 . ]" 1
416 1 134 ALA H 1 135 ASN H . . 3.350 2.318 2.233 2.530 . 0 0 "[ . 1 . ]" 1
417 1 135 ASN H 1 135 ASN QD . . 4.610 2.598 2.287 3.333 . 0 0 "[ . 1 . ]" 1
418 1 68 THR HG1 1 70 LYS H . . 4.420 3.477 2.974 3.996 . 0 0 "[ . 1 . ]" 1
419 1 68 THR HB 1 70 LYS H . . 3.990 3.081 2.580 3.365 . 0 0 "[ . 1 . ]" 1
420 1 142 LEU HA 1 145 TRP H . . 4.230 3.479 3.082 3.753 . 0 0 "[ . 1 . ]" 1
421 1 132 GLY QA 1 135 ASN H . . 3.790 3.090 2.912 3.376 . 0 0 "[ . 1 . ]" 1
422 1 70 LYS H 1 70 LYS QE . . 4.680 4.208 3.042 5.189 0.509 2 1 "[ + . 1 . ]" 1
423 1 135 ASN H 1 135 ASN QB . . 3.040 2.316 2.160 2.897 . 0 0 "[ . 1 . ]" 1
424 1 144 LYS QB 1 145 TRP H . . 3.680 2.555 2.439 2.774 . 0 0 "[ . 1 . ]" 1
425 1 134 ALA MB 1 135 ASN H . . 3.230 2.834 2.557 2.970 . 0 0 "[ . 1 . ]" 1
426 1 145 TRP H 1 146 LEU QD . . 3.950 3.617 3.254 4.212 0.262 1 0 "[ . 1 . ]" 1
427 1 69 PRO QB 1 70 LYS H . . 3.340 3.254 3.142 3.326 . 0 0 "[ . 1 . ]" 1
428 1 75 ILE HB 1 78 ARG H . . 4.430 4.342 4.204 4.654 0.224 17 0 "[ . 1 . ]" 1
429 1 70 LYS H 1 70 LYS QG . . 3.990 3.509 2.397 3.997 0.007 19 0 "[ . 1 . ]" 1
430 1 78 ARG H 1 79 CYS H . . 3.580 2.577 1.894 2.966 . 0 0 "[ . 1 . ]" 1
431 1 78 ARG H 1 78 ARG QB . . 3.410 2.259 2.070 2.649 . 0 0 "[ . 1 . ]" 1
432 1 78 ARG H 1 78 ARG QG . . 3.930 3.037 2.381 3.821 . 0 0 "[ . 1 . ]" 1
433 1 143 LYS H 1 144 LYS H . . 3.890 2.537 2.474 2.698 . 0 0 "[ . 1 . ]" 1
434 1 144 LYS H 1 145 TRP H . . 3.580 2.591 2.425 2.736 . 0 0 "[ . 1 . ]" 1
435 1 141 LEU HA 1 144 LYS H . . 4.410 3.383 3.215 3.622 . 0 0 "[ . 1 . ]" 1
436 1 144 LYS H 1 145 TRP QB . . 4.830 4.585 4.331 4.846 0.016 7 0 "[ . 1 . ]" 1
437 1 144 LYS H 1 144 LYS QB . . 3.210 2.245 2.210 2.273 . 0 0 "[ . 1 . ]" 1
438 1 144 LYS H 1 144 LYS HG2 . . 4.570 4.419 4.398 4.467 . 0 0 "[ . 1 . ]" 1
439 1 144 LYS H 1 146 LEU H . . 4.830 3.921 3.781 3.994 . 0 0 "[ . 1 . ]" 1
440 1 17 ALA HA 1 20 PHE H . . 4.610 3.506 3.158 3.883 . 0 0 "[ . 1 . ]" 1
441 1 18 SER HA 1 20 PHE H . . 5.310 4.138 3.829 4.564 . 0 0 "[ . 1 . ]" 1
442 1 20 PHE H 1 20 PHE QB . . 3.610 2.352 2.094 2.568 . 0 0 "[ . 1 . ]" 1
443 1 16 VAL H 1 17 ALA H . . 3.560 2.802 2.537 2.965 . 0 0 "[ . 1 . ]" 1
444 1 39 LEU H 1 40 GLU H . . 3.580 2.763 2.694 2.854 . 0 0 "[ . 1 . ]" 1
445 1 15 ALA H 1 16 VAL H . . 3.420 2.615 2.470 2.871 . 0 0 "[ . 1 . ]" 1
446 1 40 GLU H 1 41 VAL H . . 3.560 2.858 2.713 2.935 . 0 0 "[ . 1 . ]" 1
447 1 20 PHE H 1 115 PHE QE . . 5.500 5.639 4.250 8.847 3.347 12 4 "[- . 1 + . * *]" 1
448 1 38 PRO HA 1 40 GLU H . . 4.320 4.074 3.982 4.257 . 0 0 "[ . 1 . ]" 1
449 1 13 ILE HA 1 16 VAL H . . 4.000 3.434 3.069 3.780 . 0 0 "[ . 1 . ]" 1
450 1 40 GLU H 1 41 VAL HA . . 5.500 5.434 5.328 5.481 . 0 0 "[ . 1 . ]" 1
451 1 40 GLU H 1 40 GLU QG . . 3.430 2.167 2.090 2.403 . 0 0 "[ . 1 . ]" 1
452 1 16 VAL H 1 16 VAL HB . . 3.320 2.819 2.285 3.619 0.299 14 0 "[ . 1 . ]" 1
453 1 40 GLU H 1 40 GLU HB3 . . 3.070 2.555 2.435 2.655 . 0 0 "[ . 1 . ]" 1
454 1 39 LEU HG 1 40 GLU H . . 3.060 2.139 2.002 2.275 . 0 0 "[ . 1 . ]" 1
455 1 20 PHE H 1 21 ALA MB . . 4.560 4.188 3.973 4.606 0.046 11 0 "[ . 1 . ]" 1
456 1 15 ALA MB 1 16 VAL H . . 3.240 2.503 2.302 2.836 . 0 0 "[ . 1 . ]" 1
457 1 14 VAL QG 1 16 VAL H . . 4.280 4.329 3.794 4.865 0.585 19 3 "[ * . - 1 . +]" 1
458 1 39 LEU MD1 1 40 GLU H . . 4.040 2.947 2.404 3.135 . 0 0 "[ . 1 . ]" 1
459 1 40 GLU H 1 41 VAL QG . . 4.440 4.166 3.804 4.475 0.035 2 0 "[ . 1 . ]" 1
460 1 50 ARG HA 1 55 THR H . . 5.110 5.514 4.927 6.149 1.039 7 5 "[ - *. + 1 *. * ]" 1
461 1 16 VAL H 1 63 SER HA . . 4.810 5.193 4.384 6.185 1.375 12 8 "[*- . * * + * * *]" 1
462 1 104 PRO HD2 1 105 ARG H . . 3.180 2.713 2.647 2.845 . 0 0 "[ . 1 . ]" 1
463 1 104 PRO HD3 1 105 ARG H . . 4.470 3.861 3.835 3.913 . 0 0 "[ . 1 . ]" 1
464 1 105 ARG H 1 105 ARG QG . . 3.890 3.905 3.545 4.077 0.187 12 0 "[ . 1 . ]" 1
465 1 105 ARG H 1 105 ARG QB . . 3.470 2.158 2.065 2.296 . 0 0 "[ . 1 . ]" 1
466 1 103 ILE MG 1 105 ARG H . . 4.460 3.276 2.719 4.224 . 0 0 "[ . 1 . ]" 1
467 1 54 CYS HA 1 55 THR H . . 3.160 2.288 2.219 2.395 . 0 0 "[ . 1 . ]" 1
468 1 55 THR H 1 58 CYS HB3 . . 4.020 2.886 2.229 4.048 0.028 4 0 "[ . 1 . ]" 1
469 1 55 THR H 1 58 CYS HB2 . . 4.020 3.271 2.585 4.089 0.069 12 0 "[ . 1 . ]" 1
470 1 54 CYS QB 1 55 THR H . . 4.060 3.246 2.515 3.578 . 0 0 "[ . 1 . ]" 1
471 1 150 CYS H 1 150 CYS HB3 . . 4.070 3.423 2.627 3.909 . 0 0 "[ . 1 . ]" 1
472 1 150 CYS H 1 150 CYS HB2 . . 4.070 2.725 2.323 3.722 . 0 0 "[ . 1 . ]" 1
473 1 149 ARG QG 1 150 CYS H . . 4.340 3.982 1.888 4.586 0.246 11 0 "[ . 1 . ]" 1
474 1 80 HIS H 1 81 THR H . . 4.780 2.706 2.589 2.973 . 0 0 "[ . 1 . ]" 1
475 1 81 THR H 1 81 THR HB . . 4.160 3.457 2.501 4.062 . 0 0 "[ . 1 . ]" 1
476 1 15 ALA MB 1 81 THR H . . 4.780 4.285 3.329 5.134 0.354 16 0 "[ . 1 . ]" 1
477 1 81 THR H 1 81 THR MG . . 3.520 3.196 1.964 3.926 0.406 4 0 "[ . 1 . ]" 1
478 1 107 LYS H 1 109 LEU H . . 3.900 3.914 3.732 4.085 0.185 19 0 "[ . 1 . ]" 1
479 1 107 LYS H 1 114 GLN QE . . 4.930 4.240 3.694 4.709 . 0 0 "[ . 1 . ]" 1
480 1 71 MET HA 1 75 ILE H . . 4.440 3.734 2.964 4.345 . 0 0 "[ . 1 . ]" 1
481 1 75 ILE H 1 76 PRO HD3 . . 4.520 3.417 3.037 3.782 . 0 0 "[ . 1 . ]" 1
482 1 106 PHE QB 1 107 LYS H . . 3.480 2.828 2.422 3.247 . 0 0 "[ . 1 . ]" 1
483 1 75 ILE H 1 76 PRO HD2 . . 4.520 4.110 3.835 4.357 . 0 0 "[ . 1 . ]" 1
484 1 74 PHE HB2 1 75 ILE H . . 4.700 2.500 2.361 2.641 . 0 0 "[ . 1 . ]" 1
485 1 10 ASP QB 1 11 PHE H . . 3.890 3.766 2.568 3.919 0.029 7 0 "[ . 1 . ]" 1
486 1 99 ASP QB 1 107 LYS H . . 5.500 5.824 4.773 6.660 1.160 16 9 "[- *** * 1 **.+* ]" 1
487 1 107 LYS H 1 108 ASP HB2 . . 5.400 4.964 4.649 5.358 . 0 0 "[ . 1 . ]" 1
488 1 75 ILE H 1 75 ILE QG . . 4.050 1.958 1.873 2.078 . 0 0 "[ . 1 . ]" 1
489 1 107 LYS H 1 107 LYS QB . . 3.050 2.344 2.113 2.617 . 0 0 "[ . 1 . ]" 1
490 1 103 ILE MG 1 107 LYS H . . 4.740 4.515 4.224 5.936 1.196 19 1 "[ . 1 . +]" 1
491 1 75 ILE H 1 75 ILE MG . . 3.810 3.089 3.049 3.137 . 0 0 "[ . 1 . ]" 1
492 1 107 LYS H 1 109 LEU QD . . 4.330 4.634 4.101 5.019 0.689 12 2 "[ . 1 +- . ]" 1
493 1 73 LYS H 1 75 ILE H . . 4.900 4.187 4.013 4.329 . 0 0 "[ . 1 . ]" 1
494 1 70 LYS H 1 73 LYS H . . 4.870 4.969 4.664 5.249 0.379 5 0 "[ . 1 . ]" 1
495 1 72 LYS H 1 73 LYS H . . 3.650 2.689 2.494 2.779 . 0 0 "[ . 1 . ]" 1
496 1 22 THR H 1 23 THR H . . 3.650 2.156 1.890 2.525 . 0 0 "[ . 1 . ]" 1
497 1 99 ASP HA 1 107 LYS H . . 5.360 5.053 4.710 5.533 0.173 5 0 "[ . 1 . ]" 1
498 1 21 ALA HA 1 23 THR H . . 4.170 3.819 3.556 4.251 0.081 14 0 "[ . 1 . ]" 1
499 1 22 THR HA 1 23 THR H . . 3.570 3.462 3.163 3.486 . 0 0 "[ . 1 . ]" 1
500 1 23 THR H 1 23 THR HB . . 3.850 2.776 2.358 3.132 . 0 0 "[ . 1 . ]" 1
501 1 105 ARG HA 1 107 LYS H . . 4.520 3.872 3.599 4.215 . 0 0 "[ . 1 . ]" 1
502 1 72 LYS QE 1 73 LYS H . . 5.240 4.616 2.520 6.167 0.927 15 2 "[ . - 1 + ]" 1
503 1 73 LYS H 1 74 PHE HB2 . . 5.060 4.835 4.444 5.168 0.108 11 0 "[ . 1 . ]" 1
504 1 107 LYS H 1 108 ASP HB3 . . 5.400 5.207 4.504 5.870 0.470 17 0 "[ . 1 . ]" 1
505 1 72 LYS QB 1 73 LYS H . . 3.530 3.154 2.686 3.532 0.002 7 0 "[ . 1 . ]" 1
506 1 73 LYS H 1 73 LYS HB3 . . 3.190 2.442 2.225 2.669 . 0 0 "[ . 1 . ]" 1
507 1 21 ALA MB 1 23 THR H . . 3.660 3.220 2.291 3.895 0.235 11 0 "[ . 1 . ]" 1
508 1 73 LYS H 1 73 LYS HB2 . . 3.200 2.627 2.382 3.016 . 0 0 "[ . 1 . ]" 1
509 1 22 THR MG 1 23 THR H . . 3.430 2.191 1.980 3.204 . 0 0 "[ . 1 . ]" 1
510 1 73 LYS H 1 73 LYS HG3 . . 4.690 4.480 4.349 4.552 . 0 0 "[ . 1 . ]" 1
511 1 73 LYS H 1 73 LYS HG2 . . 4.420 4.388 4.086 4.566 0.146 9 0 "[ . 1 . ]" 1
512 1 79 CYS H 1 80 HIS H . . 5.180 4.439 4.336 4.511 . 0 0 "[ . 1 . ]" 1
513 1 74 PHE H 1 75 ILE H . . 3.630 2.476 2.265 2.786 . 0 0 "[ . 1 . ]" 1
514 1 73 LYS H 1 74 PHE H . . 3.500 2.710 2.524 2.864 . 0 0 "[ . 1 . ]" 1
515 1 76 PRO HA 1 79 CYS H . . 5.190 4.876 4.159 5.592 0.402 11 0 "[ . 1 . ]" 1
516 1 74 PHE H 1 74 PHE HB3 . . 3.930 3.594 3.555 3.653 . 0 0 "[ . 1 . ]" 1
517 1 74 PHE H 1 74 PHE HB2 . . 3.740 2.360 2.295 2.503 . 0 0 "[ . 1 . ]" 1
518 1 74 PHE H 1 75 ILE QG . . 4.500 3.793 3.589 4.146 . 0 0 "[ . 1 . ]" 1
519 1 74 PHE H 1 111 PRO QB . . 4.920 3.851 3.477 4.141 . 0 0 "[ . 1 . ]" 1
520 1 72 LYS QB 1 74 PHE H . . 4.820 5.038 4.670 5.369 0.549 9 1 "[ . +1 . ]" 1
521 1 73 LYS HB2 1 74 PHE H . . 3.900 3.894 3.637 4.087 0.187 7 0 "[ . 1 . ]" 1
522 1 73 LYS HG3 1 74 PHE H . . 4.390 4.509 4.024 4.969 0.579 2 2 "[ + . 1 .- ]" 1
523 1 62 LEU H 1 63 SER H . . 3.760 2.532 2.467 2.685 . 0 0 "[ . 1 . ]" 1
524 1 110 GLU HA 1 112 MET H . . 5.290 4.512 4.405 4.602 . 0 0 "[ . 1 . ]" 1
525 1 126 THR H 1 129 CYS HA . . 5.460 5.440 5.157 6.093 0.633 2 1 "[ + . 1 . ]" 1
526 1 63 SER H 1 63 SER HB3 . . 3.620 2.637 2.180 3.620 . 0 0 "[ . 1 . ]" 1
527 1 63 SER H 1 63 SER HB2 . . 3.620 2.989 2.137 3.623 0.003 1 0 "[ . 1 . ]" 1
528 1 59 LEU HA 1 63 SER H . . 4.540 4.068 3.862 4.368 . 0 0 "[ . 1 . ]" 1
529 1 63 SER H 1 64 HIS HB2 . . 5.230 4.484 4.273 4.597 . 0 0 "[ . 1 . ]" 1
530 1 60 ILE HA 1 63 SER H . . 4.470 3.454 3.314 3.580 . 0 0 "[ . 1 . ]" 1
531 1 62 LEU HG 1 63 SER H . . 4.520 3.491 2.220 4.149 . 0 0 "[ . 1 . ]" 1
532 1 62 LEU QB 1 63 SER H . . 4.020 2.937 2.683 3.516 . 0 0 "[ . 1 . ]" 1
533 1 16 VAL QG 1 63 SER H . . 3.550 3.108 2.614 3.841 0.291 12 0 "[ . 1 . ]" 1
534 1 62 LEU QD 1 63 SER H . . 4.060 3.762 2.894 4.066 0.006 1 0 "[ . 1 . ]" 1
535 1 60 ILE MG 1 63 SER H . . 4.690 4.572 4.365 4.727 0.037 2 0 "[ . 1 . ]" 1
536 1 126 THR H 1 126 THR HG1 . . 4.830 3.102 2.512 3.582 . 0 0 "[ . 1 . ]" 1
537 1 125 CYS HA 1 126 THR H . . 3.140 2.249 2.226 2.454 . 0 0 "[ . 1 . ]" 1
538 1 111 PRO QD 1 112 MET H . . 4.670 2.643 2.608 2.678 . 0 0 "[ . 1 . ]" 1
539 1 126 THR H 1 129 CYS QB . . 3.080 2.549 2.162 3.989 0.909 2 1 "[ + . 1 . ]" 1
540 1 112 MET H 1 112 MET QG . . 4.150 3.916 3.436 4.064 . 0 0 "[ . 1 . ]" 1
541 1 111 PRO QB 1 112 MET H . . 3.300 2.979 2.873 3.104 . 0 0 "[ . 1 . ]" 1
542 1 112 MET H 1 112 MET HB3 . . 3.550 2.856 2.660 3.244 . 0 0 "[ . 1 . ]" 1
543 1 126 THR H 1 126 THR MG . . 3.430 2.211 2.066 2.308 . 0 0 "[ . 1 . ]" 1
544 1 75 ILE MD 1 112 MET H . . 4.120 4.100 3.121 4.636 0.516 3 1 "[ + . 1 . ]" 1
545 1 126 THR H 1 130 LEU QD . . 4.600 4.177 3.733 4.730 0.130 19 0 "[ . 1 . ]" 1
546 1 126 THR H 1 129 CYS H . . 4.380 3.942 3.714 4.232 . 0 0 "[ . 1 . ]" 1
547 1 135 ASN HA 1 135 ASN QD . . 4.300 3.154 2.154 4.000 . 0 0 "[ . 1 . ]" 1
548 1 132 GLY QA 1 135 ASN QD . . 4.650 3.658 2.108 4.271 . 0 0 "[ . 1 . ]" 1
549 1 135 ASN QB 1 135 ASN QD . . 2.880 2.310 2.064 2.568 . 0 0 "[ . 1 . ]" 1
550 1 131 LYS QB 1 135 ASN QD . . 4.660 2.935 2.185 3.774 . 0 0 "[ . 1 . ]" 1
551 1 134 ALA MB 1 135 ASN QD . . 3.420 2.903 2.498 3.956 0.536 17 1 "[ . 1 . + ]" 1
552 1 12 ASN QD 1 16 VAL HB . . 4.590 6.322 3.775 8.978 4.388 4 10 "[ *+. -**1 * *** *]" 1
553 1 117 ALA MB 1 118 GLN H . . 3.500 2.432 2.281 2.525 . 0 0 "[ . 1 . ]" 1
554 1 12 ASN QD 1 15 ALA MB . . 3.730 2.630 1.721 4.061 0.331 16 0 "[ . 1 . ]" 1
555 1 12 ASN QD 1 14 VAL QG . . 4.520 3.783 1.945 5.286 0.766 12 3 "[ - . 1 + . *]" 1
556 1 117 ALA H 1 118 GLN H . . 3.550 2.857 2.637 2.929 . 0 0 "[ . 1 . ]" 1
557 1 118 GLN H 1 118 GLN QG . . 3.290 2.095 1.783 2.520 . 0 0 "[ . 1 . ]" 1
558 1 118 GLN H 1 118 GLN QB . . 3.440 2.558 2.302 2.663 . 0 0 "[ . 1 . ]" 1
559 1 65 ILE MG 1 118 GLN H . . 4.530 4.696 4.247 6.678 2.148 17 3 "[ . - 1* . + ]" 1
560 1 100 ILE MD 1 118 GLN H . . 4.810 4.669 3.720 5.304 0.494 10 0 "[ . 1 . ]" 1
561 1 17 ALA H 1 18 SER H . . 3.710 2.688 2.537 2.871 . 0 0 "[ . 1 . ]" 1
562 1 18 SER H 1 19 ASN H . . 3.650 2.616 2.447 2.766 . 0 0 "[ . 1 . ]" 1
563 1 15 ALA HA 1 18 SER H . . 4.300 3.559 3.261 3.820 . 0 0 "[ . 1 . ]" 1
564 1 18 SER H 1 18 SER QB . . 3.480 2.251 2.079 2.908 . 0 0 "[ . 1 . ]" 1
565 1 17 ALA MB 1 18 SER H . . 3.470 2.652 2.443 2.792 . 0 0 "[ . 1 . ]" 1
566 1 13 ILE MD 1 18 SER H . . 4.950 5.430 4.505 7.036 2.086 14 8 "[ * -. * 1 +* ***]" 1
567 1 21 ALA HA 1 22 THR H . . 3.510 2.219 2.141 2.455 . 0 0 "[ . 1 . ]" 1
568 1 45 MET QG 1 48 ASN QD . . 4.060 3.389 2.513 3.943 . 0 0 "[ . 1 . ]" 1
569 1 48 ASN QD 1 136 VAL HB . . 4.820 3.237 1.938 4.564 . 0 0 "[ . 1 . ]" 1
570 1 152 THR H 1 153 PHE HB3 . . 5.400 5.235 3.624 5.718 0.318 9 0 "[ . 1 . ]" 1
571 1 152 THR H 1 153 PHE HB2 . . 5.400 4.254 3.297 5.365 . 0 0 "[ . 1 . ]" 1
572 1 152 THR H 1 152 THR MG . . 3.370 2.438 2.046 2.700 . 0 0 "[ . 1 . ]" 1
573 1 118 GLN QB 1 118 GLN QE . . 3.860 3.004 1.801 3.561 . 0 0 "[ . 1 . ]" 1
574 1 131 LYS QB 1 132 GLY H . . 3.300 3.381 2.693 3.612 0.312 12 0 "[ . 1 . ]" 1
575 1 128 GLY H 1 130 LEU HG . . 5.210 5.570 4.630 6.250 1.040 3 9 "[ *+** * 1* -* *]" 1
576 1 131 LYS QG 1 132 GLY H . . 3.290 2.505 1.996 4.111 0.821 19 3 "[- . * 1 . +]" 1
577 1 126 THR HG1 1 128 GLY H . . 4.130 3.937 3.588 4.250 0.120 17 0 "[ . 1 . ]" 1
578 1 126 THR HB 1 128 GLY H . . 3.490 3.223 3.056 3.300 . 0 0 "[ . 1 . ]" 1
579 1 127 THR HB 1 128 GLY H . . 3.510 3.100 2.772 3.467 . 0 0 "[ . 1 . ]" 1
580 1 128 GLY H 1 130 LEU QB . . 5.180 5.204 4.430 5.679 0.499 7 0 "[ . 1 . ]" 1
581 1 127 THR MG 1 128 GLY H . . 4.110 4.101 3.985 4.194 0.084 12 0 "[ . 1 . ]" 1
582 1 77 GLY H 1 78 ARG H . . 3.780 2.572 2.305 2.667 . 0 0 "[ . 1 . ]" 1
583 1 77 GLY H 1 79 CYS H . . 5.060 3.574 3.340 3.802 . 0 0 "[ . 1 . ]" 1
584 1 77 GLY H 1 78 ARG QG . . 5.010 5.169 4.499 5.793 0.783 1 3 "[+- . 1 *. ]" 1
585 1 76 PRO HD2 1 77 GLY H . . 5.500 5.637 5.588 5.652 0.152 3 0 "[ . 1 . ]" 1
586 1 30 GLY H 1 31 LYS H . . 3.590 3.009 2.331 4.069 0.479 12 0 "[ . 1 . ]" 1
587 1 29 ARG HA 1 30 GLY H . . 3.470 3.447 3.423 3.465 . 0 0 "[ . 1 . ]" 1
588 1 27 ALA MB 1 30 GLY H . . 4.790 4.584 4.263 4.749 . 0 0 "[ . 1 . ]" 1
589 1 56 ARG H 1 57 GLY H . . 3.790 2.704 2.637 2.844 . 0 0 "[ . 1 . ]" 1
590 1 57 GLY H 1 59 LEU H . . 4.930 5.026 4.768 5.233 0.303 8 0 "[ . 1 . ]" 1
591 1 55 THR HB 1 57 GLY H . . 3.890 2.801 2.517 3.177 . 0 0 "[ . 1 . ]" 1
592 1 57 GLY H 1 58 CYS HA . . 5.500 5.329 5.183 5.403 . 0 0 "[ . 1 . ]" 1
593 1 56 ARG QB 1 57 GLY H . . 3.370 2.558 2.346 3.403 0.033 11 0 "[ . 1 . ]" 1
594 1 56 ARG QD 1 57 GLY H . . 4.900 4.463 2.978 4.900 0.000 7 0 "[ . 1 . ]" 1
595 1 51 LYS H 1 53 GLY H . . 4.300 3.941 3.773 4.100 . 0 0 "[ . 1 . ]" 1
596 1 53 GLY H 1 54 CYS H . . 3.120 2.414 2.188 2.662 . 0 0 "[ . 1 . ]" 1
597 1 52 ALA H 1 53 GLY H . . 3.270 2.468 2.337 2.525 . 0 0 "[ . 1 . ]" 1
598 1 53 GLY H 1 54 CYS HA . . 5.010 4.813 4.737 4.994 . 0 0 "[ . 1 . ]" 1
599 1 51 LYS HA 1 53 GLY H . . 3.960 3.852 3.651 4.039 0.079 15 0 "[ . 1 . ]" 1
600 1 50 ARG QB 1 53 GLY H . . 4.990 4.723 4.431 5.104 0.114 2 0 "[ . 1 . ]" 1
601 1 51 LYS QB 1 53 GLY H . . 4.570 4.533 4.469 4.639 0.069 2 0 "[ . 1 . ]" 1
602 1 52 ALA MB 1 53 GLY H . . 3.500 3.062 3.027 3.102 . 0 0 "[ . 1 . ]" 1
603 1 49 ALA MB 1 53 GLY H . . 5.410 5.145 4.780 5.544 0.134 2 0 "[ . 1 . ]" 1
604 1 50 ARG QG 1 53 GLY H . . 5.200 4.649 3.950 5.208 0.008 13 0 "[ . 1 . ]" 1
605 1 53 GLY H 1 54 CYS QB . . 4.690 3.769 3.630 4.135 . 0 0 "[ . 1 . ]" 1
606 1 16 VAL HB 1 18 SER H . . 4.840 5.057 4.710 5.531 0.691 8 6 "[ **. +-1 *. *]" 1
607 1 21 ALA H 1 22 THR H . . 4.670 4.497 3.859 4.645 . 0 0 "[ . 1 . ]" 1
608 1 25 LEU QD 1 27 ALA H . . 4.210 4.708 3.817 5.047 0.837 8 14 "[ *-** + ** *******]" 1
609 1 31 LYS H 1 32 LEU H . . 3.570 2.696 1.890 3.814 0.244 18 0 "[ . 1 . ]" 1
610 1 34 GLY H 1 37 LEU QD . . 3.750 4.097 1.946 5.271 1.521 17 11 "[* -*.***** * .*+ ]" 1
611 1 120 ASP H 1 122 CYS H . . 4.340 4.276 4.106 4.479 0.139 4 0 "[ . 1 . ]" 1
612 1 122 CYS H 1 123 VAL H . . 4.080 3.989 2.839 4.314 0.234 10 0 "[ . 1 . ]" 1
613 1 120 ASP HB3 1 122 CYS H . . 5.230 5.169 4.958 5.424 0.194 6 0 "[ . 1 . ]" 1
614 1 98 VAL H 1 99 ASP H . . 3.490 3.962 3.386 4.547 1.057 6 9 "[**- .+ * * * **]" 1
615 1 106 PHE HA 1 109 LEU H . . 4.560 3.249 2.928 3.464 . 0 0 "[ . 1 . ]" 1
616 1 42 LEU H 1 42 LEU QB . . 3.310 2.198 2.041 2.602 . 0 0 "[ . 1 . ]" 1
617 1 48 ASN QD 1 49 ALA H . . 4.340 4.153 3.631 4.784 0.444 10 0 "[ . 1 . ]" 1
618 1 46 GLU HA 1 50 ARG H . . 4.500 4.113 3.580 4.773 0.273 15 0 "[ . 1 . ]" 1
619 1 55 THR HB 1 56 ARG H . . 3.420 2.641 2.218 3.213 . 0 0 "[ . 1 . ]" 1
620 1 58 CYS HB3 1 59 LEU H . . 4.000 2.261 2.063 3.296 . 0 0 "[ . 1 . ]" 1
621 1 59 LEU QD 1 60 ILE H . . 4.120 3.791 3.081 4.117 . 0 0 "[ . 1 . ]" 1
622 1 16 VAL HB 1 17 ALA H . . 3.600 2.797 2.299 3.760 0.160 14 0 "[ . 1 . ]" 1
623 1 11 PHE QD 1 60 ILE H . . 4.610 4.559 4.209 4.899 0.289 15 0 "[ . 1 . ]" 1
624 1 11 PHE QE 1 60 ILE H . . 5.060 4.958 4.249 5.532 0.472 14 0 "[ . 1 . ]" 1
625 1 15 ALA H 1 17 ALA H . . 4.710 4.236 3.959 4.523 . 0 0 "[ . 1 . ]" 1
626 1 58 CYS H 1 60 ILE H . . 5.040 4.007 3.874 4.184 . 0 0 "[ . 1 . ]" 1
627 1 60 ILE H 1 62 LEU H . . 4.600 4.376 4.174 4.561 . 0 0 "[ . 1 . ]" 1
628 1 59 LEU H 1 61 CYS H . . 4.450 4.224 4.106 4.453 0.003 5 0 "[ . 1 . ]" 1
629 1 61 CYS H 1 62 LEU QB . . 5.340 4.987 4.857 5.173 . 0 0 "[ . 1 . ]" 1
630 1 60 ILE H 1 63 SER H . . 4.940 4.662 4.590 4.836 . 0 0 "[ . 1 . ]" 1
631 1 61 CYS H 1 63 SER H . . 4.700 3.882 3.724 4.004 . 0 0 "[ . 1 . ]" 1
632 1 63 SER H 1 65 ILE H . . 4.920 4.125 3.996 4.331 . 0 0 "[ . 1 . ]" 1
633 1 64 HIS HB3 1 65 ILE H . . 4.510 4.337 4.236 4.375 . 0 0 "[ . 1 . ]" 1
634 1 68 THR H 1 70 LYS H . . 5.050 5.148 4.955 5.349 0.299 12 0 "[ . 1 . ]" 1
635 1 68 THR H 1 98 VAL H . . 5.500 7.098 4.884 8.721 3.221 4 17 "[***+* ********-*** ]" 1
636 1 68 THR H 1 68 THR HG1 . . 4.520 3.370 2.711 3.808 . 0 0 "[ . 1 . ]" 1
637 1 68 THR H 1 71 MET HA . . 5.500 5.671 5.349 6.308 0.808 5 3 "[ + * 1 . -]" 1
638 1 69 PRO QD 1 70 LYS H . . 4.560 2.608 2.601 2.619 . 0 0 "[ . 1 . ]" 1
639 1 68 THR H 1 71 MET H . . 4.430 4.089 3.839 4.366 . 0 0 "[ . 1 . ]" 1
640 1 71 MET H 1 73 LYS H . . 4.730 3.988 3.811 4.211 . 0 0 "[ . 1 . ]" 1
641 1 69 PRO HA 1 71 MET H . . 5.040 4.337 4.105 4.740 . 0 0 "[ . 1 . ]" 1
642 1 69 PRO HA 1 72 LYS H . . 4.360 3.749 3.394 3.999 . 0 0 "[ . 1 . ]" 1
643 1 72 LYS H 1 73 LYS HA . . 5.480 5.272 5.084 5.359 . 0 0 "[ . 1 . ]" 1
644 1 72 LYS H 1 75 ILE QG . . 4.650 4.236 3.926 4.483 . 0 0 "[ . 1 . ]" 1
645 1 68 THR H 1 72 LYS H . . 4.560 4.555 3.771 5.109 0.549 14 1 "[ . 1 +. ]" 1
646 1 73 LYS HG2 1 74 PHE H . . 4.970 3.521 2.769 3.940 . 0 0 "[ . 1 . ]" 1
647 1 81 THR H 1 82 TYR QD . . 4.980 5.501 3.822 6.383 1.403 3 11 "[**+*. * ** * ** - ]" 1
648 1 68 THR H 1 118 GLN QE . . 4.390 4.104 3.238 4.748 0.358 6 0 "[ . 1 . ]" 1
649 1 98 VAL HA 1 118 GLN QE . . 5.500 6.688 5.283 8.621 3.121 10 14 "[****. * *+* -***** ]" 1
650 1 101 PRO HG3 1 102 ALA H . . 3.860 3.918 3.695 4.092 0.232 5 0 "[ . 1 . ]" 1
651 1 103 ILE H 1 106 PHE QB . . 4.660 4.362 3.769 4.622 . 0 0 "[ . 1 . ]" 1
652 1 101 PRO QB 1 103 ILE H . . 5.040 4.675 4.523 4.786 . 0 0 "[ . 1 . ]" 1
653 1 105 ARG H 1 109 LEU QD . . 4.700 4.290 4.003 4.803 0.103 16 0 "[ . 1 . ]" 1
654 1 106 PHE H 1 107 LYS H . . 3.630 2.817 2.722 2.934 . 0 0 "[ . 1 . ]" 1
655 1 106 PHE QD 1 107 LYS H . . 3.920 2.617 2.261 3.265 . 0 0 "[ . 1 . ]" 1
656 1 106 PHE HA 1 108 ASP H . . 4.550 4.020 3.532 4.219 . 0 0 "[ . 1 . ]" 1
657 1 108 ASP H 1 109 LEU HA . . 4.870 4.668 4.577 4.797 . 0 0 "[ . 1 . ]" 1
658 1 105 ARG QG 1 108 ASP H . . 4.170 3.926 3.640 4.356 0.186 14 0 "[ . 1 . ]" 1
659 1 114 GLN H 1 116 ILE H . . 4.530 4.294 4.052 4.437 . 0 0 "[ . 1 . ]" 1
660 1 113 GLU H 1 115 PHE H . . 4.780 4.473 4.385 4.530 . 0 0 "[ . 1 . ]" 1
661 1 106 PHE QE 1 118 GLN H . . 4.670 3.667 2.845 3.986 . 0 0 "[ . 1 . ]" 1
662 1 116 ILE HA 1 118 GLN H . . 4.680 4.576 4.408 4.759 0.079 17 0 "[ . 1 . ]" 1
663 1 118 GLN H 1 119 VAL HA . . 5.380 5.326 5.227 5.430 0.050 8 0 "[ . 1 . ]" 1
664 1 116 ILE MG 1 118 GLN H . . 4.950 4.935 4.789 5.017 0.067 6 0 "[ . 1 . ]" 1
665 1 103 ILE MD 1 118 GLN H . . 3.860 3.833 3.439 4.032 0.172 6 0 "[ . 1 . ]" 1
666 1 118 GLN QG 1 119 VAL H . . 4.030 3.724 1.906 4.190 0.160 1 0 "[ . 1 . ]" 1
667 1 118 GLN QB 1 119 VAL H . . 3.790 2.483 2.268 3.211 . 0 0 "[ . 1 . ]" 1
668 1 122 CYS H 1 123 VAL QG . . 4.170 4.143 3.634 4.370 0.200 6 0 "[ . 1 . ]" 1
669 1 126 THR H 1 128 GLY H . . 5.370 5.411 5.198 5.514 0.144 10 0 "[ . 1 . ]" 1
670 1 125 CYS H 1 126 THR H . . 4.620 4.531 4.469 4.563 . 0 0 "[ . 1 . ]" 1
671 1 131 LYS H 1 132 GLY H . . 3.280 2.491 2.465 2.532 . 0 0 "[ . 1 . ]" 1
672 1 130 LEU H 1 132 GLY H . . 4.370 3.922 3.807 4.040 . 0 0 "[ . 1 . ]" 1
673 1 132 GLY H 1 134 ALA H . . 4.850 4.212 4.072 4.344 . 0 0 "[ . 1 . ]" 1
674 1 133 LEU H 1 135 ASN H . . 4.810 3.975 3.824 4.162 . 0 0 "[ . 1 . ]" 1
675 1 143 LYS QB 1 144 LYS H . . 3.660 2.893 2.695 3.477 . 0 0 "[ . 1 . ]" 1
676 1 143 LYS H 1 146 LEU H . . 4.480 4.529 4.398 4.737 0.257 3 0 "[ . 1 . ]" 1
677 1 146 LEU H 1 147 PRO QD . . 4.330 3.195 3.026 3.461 . 0 0 "[ . 1 . ]" 1
678 1 145 TRP QB 1 146 LEU H . . 4.630 2.638 2.482 2.785 . 0 0 "[ . 1 . ]" 1
679 1 146 LEU H 1 147 PRO QB . . 5.500 5.140 4.979 5.378 . 0 0 "[ . 1 . ]" 1
680 1 150 CYS HB2 1 151 ALA H . . 4.920 3.816 2.757 4.214 . 0 0 "[ . 1 . ]" 1
681 1 56 ARG H 1 58 CYS H . . 4.850 4.047 3.930 4.417 . 0 0 "[ . 1 . ]" 1
682 1 57 GLY H 1 58 CYS H . . 3.750 2.765 2.595 2.835 . 0 0 "[ . 1 . ]" 1
683 1 58 CYS H 1 59 LEU H . . 3.600 3.022 2.857 3.155 . 0 0 "[ . 1 . ]" 1
684 1 55 THR HB 1 58 CYS H . . 4.460 2.822 2.406 3.114 . 0 0 "[ . 1 . ]" 1
685 1 56 ARG QD 1 58 CYS H . . 5.500 5.690 5.215 6.714 1.214 16 4 "[ - . * 1 *.+ ]" 1
686 1 58 CYS H 1 58 CYS HB3 . . 3.710 2.507 2.335 3.592 . 0 0 "[ . 1 . ]" 1
687 1 58 CYS H 1 58 CYS HB2 . . 3.710 2.679 2.566 2.740 . 0 0 "[ . 1 . ]" 1
688 1 58 CYS H 1 59 LEU HG . . 5.430 4.900 4.556 5.360 . 0 0 "[ . 1 . ]" 1
689 1 55 THR MG 1 58 CYS H . . 4.650 4.359 3.946 4.592 . 0 0 "[ . 1 . ]" 1
690 1 12 ASN QD 1 82 TYR QD . . 3.790 3.857 2.009 5.010 1.220 5 4 "[ + - * * ]" 1
691 1 135 ASN HA 1 136 VAL H . . 3.500 3.145 3.081 3.516 0.016 13 0 "[ . 1 . ]" 1
692 1 135 ASN QB 1 136 VAL H . . 4.260 3.542 2.751 3.962 . 0 0 "[ . 1 . ]" 1
693 1 136 VAL H 1 136 VAL HB . . 3.700 3.161 2.450 3.723 0.023 2 0 "[ . 1 . ]" 1
694 1 25 LEU HA 1 27 ALA H . . 4.160 3.943 3.535 4.302 0.142 6 0 "[ . 1 . ]" 1
695 1 25 LEU QB 1 27 ALA H . . 5.000 4.842 4.548 5.248 0.248 7 0 "[ . 1 . ]" 1
696 1 28 ASP HA 1 30 GLY H . . 4.760 3.846 3.618 4.136 . 0 0 "[ . 1 . ]" 1
697 1 29 ARG QB 1 29 ARG HE . . 3.480 2.976 1.940 4.205 0.725 12 1 "[ . 1 + . ]" 1
698 1 25 LEU QD 1 29 ARG HE . . 4.090 2.639 2.027 3.330 . 0 0 "[ . 1 . ]" 1
699 1 26 ASP HA 1 29 ARG HE . . 4.870 3.840 2.080 5.224 0.354 6 0 "[ . 1 . ]" 1
700 1 50 ARG QB 1 50 ARG HE . . 3.930 2.409 1.929 3.535 . 0 0 "[ . 1 . ]" 1
701 1 47 ALA MB 1 50 ARG HE . . 4.050 4.152 3.241 6.860 2.810 7 2 "[ . + 1 . - ]" 1
702 1 47 ALA HA 1 50 ARG HE . . 4.880 3.058 1.950 6.462 1.582 7 1 "[ . + 1 . ]" 1
703 1 50 ARG HA 1 50 ARG HE . . 5.270 4.950 4.330 5.579 0.309 15 0 "[ . 1 . ]" 1
704 1 47 ALA H 1 50 ARG HE . . 4.830 5.130 4.102 9.160 4.330 7 5 "[ * + *1* . - ]" 1
705 1 50 ARG HE 1 51 LYS H . . 4.830 5.033 4.092 5.546 0.716 16 5 "[ * . * 1 .+ *-]" 1
706 1 11 PHE QD 1 56 ARG HE . . 3.780 3.798 2.586 4.525 0.745 17 2 "[ . 1 -. + ]" 1
707 1 56 ARG HE 1 60 ILE MD . . 4.270 3.945 1.936 5.072 0.802 3 2 "[ +-. 1 . ]" 1
708 1 11 PHE QE 1 56 ARG HE . . 3.820 2.827 1.947 4.865 1.045 17 1 "[ . 1 . + ]" 1
709 1 98 VAL QG 1 118 GLN QE . . 3.490 3.380 1.970 4.660 1.170 11 5 "[- * . *+ * ]" 1
710 1 115 PHE HA 1 118 GLN QE . . 4.810 3.311 2.021 4.104 . 0 0 "[ . 1 . ]" 1
711 1 117 ALA MB 1 118 GLN QE . . 4.970 4.484 3.824 5.038 0.068 19 0 "[ . 1 . ]" 1
712 1 78 ARG HE 1 115 PHE QE . . 5.270 4.036 2.929 5.492 0.222 10 0 "[ . 1 . ]" 1
713 1 78 ARG HA 1 78 ARG HE . . 5.110 4.839 4.411 5.414 0.304 4 0 "[ . 1 . ]" 1
714 1 75 ILE HB 1 78 ARG HE . . 5.500 4.297 2.009 5.461 . 0 0 "[ . 1 . ]" 1
715 1 78 ARG QB 1 78 ARG HE . . 4.740 3.773 2.636 4.322 . 0 0 "[ . 1 . ]" 1
716 1 52 ALA H 1 132 GLY QA . . 4.750 4.719 4.066 5.317 0.567 2 1 "[ + . 1 . ]" 1
717 1 49 ALA HA 1 52 ALA H . . 3.790 3.499 3.261 3.779 . 0 0 "[ . 1 . ]" 1
718 1 48 ASN HA 1 52 ALA H . . 4.740 4.679 4.265 5.178 0.438 8 0 "[ . 1 . ]" 1
719 1 38 PRO QB 1 41 VAL H . . 4.080 3.393 3.117 3.529 . 0 0 "[ . 1 . ]" 1
720 1 37 LEU QB 1 41 VAL H . . 4.950 4.636 4.403 4.828 . 0 0 "[ . 1 . ]" 1
721 1 61 CYS HB3 1 62 LEU H . . 3.880 2.483 2.290 2.782 . 0 0 "[ . 1 . ]" 1
722 1 45 MET H 1 48 ASN QD . . 4.680 4.273 3.951 4.644 . 0 0 "[ . 1 . ]" 1
723 1 47 ALA H 1 48 ASN QD . . 5.340 4.588 3.725 5.517 0.177 10 0 "[ . 1 . ]" 1
724 1 45 MET HA 1 48 ASN QD . . 4.230 2.134 1.899 2.705 . 0 0 "[ . 1 . ]" 1
725 1 48 ASN QD 1 136 VAL HA . . 5.080 4.153 2.841 6.217 1.137 13 2 "[ . - 1 + . ]" 1
726 1 47 ALA MB 1 48 ASN QD . . 5.280 4.075 3.541 4.534 . 0 0 "[ . 1 . ]" 1
727 1 12 ASN H 1 12 ASN QD . . 4.920 4.070 2.863 4.851 . 0 0 "[ . 1 . ]" 1
728 1 106 PHE QE 1 114 GLN QE . . 4.940 3.500 2.678 4.366 . 0 0 "[ . 1 . ]" 1
729 1 109 LEU H 1 114 GLN QE . . 4.870 3.340 2.466 4.064 . 0 0 "[ . 1 . ]" 1
730 1 106 PHE HZ 1 114 GLN QE . . 5.120 4.057 3.091 4.915 . 0 0 "[ . 1 . ]" 1
731 1 69 PRO QD 1 114 GLN QE . . 5.240 5.039 4.414 5.941 0.701 10 1 "[ . + . ]" 1
732 1 109 LEU QB 1 114 GLN QE . . 4.820 3.749 3.004 4.290 . 0 0 "[ . 1 . ]" 1
733 1 105 ARG HA 1 105 ARG HE . . 4.980 4.238 2.226 4.961 . 0 0 "[ . 1 . ]" 1
734 1 105 ARG QB 1 105 ARG HE . . 3.790 3.432 2.599 3.962 0.172 11 0 "[ . 1 . ]" 1
735 1 22 THR HB 1 136 VAL H . . 4.660 11.317 4.206 14.847 10.187 13 17 "[-**** **** *+******]" 1
736 1 149 ARG HA 1 149 ARG HE . . 4.660 4.879 2.471 5.842 1.182 17 8 "[ * . *- 1** .*+* ]" 1
737 1 149 ARG HE 1 149 ARG QG . . 3.790 2.647 2.114 3.267 . 0 0 "[ . 1 . ]" 1
738 1 40 GLU H 1 43 LYS QG . . 4.760 4.455 4.053 5.049 0.289 4 0 "[ . 1 . ]" 1
739 1 38 PRO QG 1 40 GLU H . . 4.630 3.695 3.636 3.755 . 0 0 "[ . 1 . ]" 1
740 1 141 LEU H 1 144 LYS H . . 5.160 4.941 4.623 5.201 0.041 13 0 "[ . 1 . ]" 1
741 1 140 ASP HA 1 143 LYS H . . 3.590 3.752 3.511 3.918 0.328 4 0 "[ . 1 . ]" 1
742 1 143 LYS H 1 143 LYS QB . . 3.550 2.198 2.092 2.260 . 0 0 "[ . 1 . ]" 1
743 1 39 LEU H 1 42 LEU QB . . 4.590 4.462 4.120 5.103 0.513 17 1 "[ . 1 . + ]" 1
744 1 38 PRO QG 1 39 LEU H . . 4.750 4.412 4.370 4.479 . 0 0 "[ . 1 . ]" 1
745 1 55 THR H 1 55 THR MG . . 3.570 3.483 3.131 3.841 0.271 11 0 "[ . 1 . ]" 1
746 1 41 VAL HA 1 44 GLU H . . 3.930 3.429 3.250 3.534 . 0 0 "[ . 1 . ]" 1
747 1 128 GLY QA 1 131 LYS QB . . 4.300 3.841 3.026 4.436 0.136 2 0 "[ . 1 . ]" 1
748 1 75 ILE MD 1 115 PHE QB . . 3.400 2.657 2.221 3.113 . 0 0 "[ . 1 . ]" 1
749 1 71 MET QG 1 75 ILE MD . . 3.460 2.746 1.939 3.949 0.489 7 0 "[ . 1 . ]" 1
750 1 103 ILE MD 1 120 ASP HB3 . . 4.110 4.413 3.516 5.017 0.907 19 4 "[ * * - +]" 1
751 1 57 GLY QA 1 60 ILE HB . . 4.250 2.429 2.166 2.762 . 0 0 "[ . 1 . ]" 1
752 1 57 GLY QA 1 60 ILE MD . . 3.500 2.545 1.944 4.056 0.556 12 1 "[ . 1 + . ]" 1
753 1 75 ILE MD 1 115 PHE H . . 3.990 3.724 3.203 4.119 0.129 14 0 "[ . 1 . ]" 1
754 1 75 ILE MD 1 115 PHE QD . . 3.940 3.883 3.382 4.409 0.469 8 0 "[ . 1 . ]" 1
755 1 103 ILE MD 1 121 LEU H . . 4.870 4.070 3.796 4.827 . 0 0 "[ . 1 . ]" 1
756 1 75 ILE MD 1 115 PHE HA . . 4.720 4.607 3.995 5.215 0.495 8 0 "[ . 1 . ]" 1
757 1 103 ILE MD 1 121 LEU HA . . 5.130 4.647 4.020 5.651 0.521 19 1 "[ . 1 . +]" 1
758 1 75 ILE MD 1 78 ARG QG . . 3.700 2.622 1.942 3.681 . 0 0 "[ . 1 . ]" 1
759 1 103 ILE MD 1 117 ALA H . . 4.590 4.678 4.414 4.910 0.320 10 0 "[ . 1 . ]" 1
760 1 103 ILE MD 1 120 ASP H . . 5.290 5.073 4.628 5.694 0.404 19 0 "[ . 1 . ]" 1
761 1 103 ILE MD 1 117 ALA HA . . 3.910 3.319 3.048 3.670 . 0 0 "[ . 1 . ]" 1
762 1 103 ILE MD 1 118 GLN HA . . 3.460 3.266 2.708 3.725 0.265 19 0 "[ . 1 . ]" 1
763 1 103 ILE HB 1 103 ILE MD . . 2.910 2.419 2.336 2.471 . 0 0 "[ . 1 . ]" 1
764 1 103 ILE MD 1 121 LEU HG . . 3.360 2.480 1.975 3.690 0.330 1 0 "[ . 1 . ]" 1
765 1 13 ILE MD 1 17 ALA H . . 4.480 3.498 2.552 4.923 0.443 14 0 "[ . 1 . ]" 1
766 1 11 PHE HZ 1 13 ILE MD . . 3.410 4.293 2.421 5.182 1.772 16 15 "[*********-*** .+ *]" 1
767 1 13 ILE MD 1 46 GLU HA . . 3.330 2.463 1.917 3.247 . 0 0 "[ . 1 . ]" 1
768 1 62 LEU H 1 65 ILE MD . . 4.510 4.618 4.358 5.624 1.114 17 1 "[ . 1 . + ]" 1
769 1 65 ILE MD 1 66 LYS H . . 4.350 4.693 3.348 5.028 0.678 14 4 "[ . * - +. *]" 1
770 1 65 ILE MD 1 119 VAL H . . 4.050 3.139 2.633 3.572 . 0 0 "[ . 1 . ]" 1
771 1 65 ILE MD 1 115 PHE QE . . 3.260 3.356 2.252 5.076 1.816 11 3 "[ . * 1+ - . ]" 1
772 1 62 LEU HA 1 65 ILE MD . . 3.490 2.174 1.946 3.101 . 0 0 "[ . 1 . ]" 1
773 1 65 ILE HA 1 65 ILE MD . . 3.740 3.674 1.957 3.805 0.065 10 0 "[ . 1 . ]" 1
774 1 65 ILE MD 1 119 VAL HA . . 3.440 2.469 1.885 3.026 . 0 0 "[ . 1 . ]" 1
775 1 65 ILE MD 1 71 MET ME . . 5.140 5.383 4.446 6.393 1.253 11 1 "[ . 1+ . ]" 1
776 1 13 ILE MD 1 46 GLU QB . . 3.350 3.247 2.205 4.514 1.164 10 1 "[ . + . ]" 1
777 1 65 ILE MD 1 119 VAL HB . . 3.840 4.172 3.285 4.771 0.931 7 5 "[ . +- 1 ***. ]" 1
778 1 13 ILE HB 1 13 ILE MD . . 2.970 2.968 2.000 3.230 0.260 12 0 "[ . 1 . ]" 1
779 1 65 ILE MD 1 115 PHE HZ . . 4.740 4.528 3.594 5.472 0.732 11 2 "[ . - 1+ . ]" 1
780 1 57 GLY H 1 60 ILE MD . . 3.860 3.705 3.348 4.585 0.725 12 2 "[ . 1 + . - ]" 1
781 1 10 ASP H 1 60 ILE MD . . 3.890 4.335 3.684 5.500 1.610 12 6 "[* * .* 1 + - *]" 1
782 1 11 PHE QD 1 60 ILE MD . . 3.480 3.263 2.071 3.978 0.498 6 0 "[ . 1 . ]" 1
783 1 60 ILE HA 1 60 ILE MD . . 3.760 3.568 2.279 3.883 0.123 5 0 "[ . 1 . ]" 1
784 1 10 ASP QB 1 60 ILE MD . . 3.860 3.823 3.066 4.224 0.364 11 0 "[ . 1 . ]" 1
785 1 60 ILE HB 1 60 ILE MD . . 2.890 2.223 2.049 2.469 . 0 0 "[ . 1 . ]" 1
786 1 97 ILE HA 1 97 ILE MD . . 2.840 3.393 2.129 3.707 0.867 6 15 "[* **+* **** ****-*]" 1
787 1 97 ILE HB 1 97 ILE MD . . 2.800 2.152 2.031 2.311 . 0 0 "[ . 1 . ]" 1
788 1 100 ILE MD 1 118 GLN QE . . 4.180 3.230 2.252 4.496 0.316 10 0 "[ . 1 . ]" 1
789 1 100 ILE MD 1 102 ALA H . . 4.550 4.583 4.134 5.281 0.731 6 1 "[ .+ 1 . ]" 1
790 1 100 ILE MD 1 101 PRO QD . . 3.740 3.106 2.680 4.413 0.673 6 2 "[ .+ 1 .- ]" 1
791 1 100 ILE MD 1 102 ALA MB . . 4.040 4.724 4.013 5.358 1.318 5 16 "[** *+****1*****-** ]" 1
792 1 100 ILE MD 1 103 ILE QG . . 3.860 3.991 2.635 4.342 0.482 7 0 "[ . 1 . ]" 1
793 1 100 ILE MD 1 106 PHE QE . . 3.610 3.443 2.663 3.767 0.157 19 0 "[ . 1 . ]" 1
794 1 100 ILE MD 1 106 PHE HZ . . 3.660 3.601 2.560 4.116 0.456 13 0 "[ . 1 . ]" 1
795 1 100 ILE HA 1 100 ILE MD . . 3.450 2.401 2.024 3.883 0.433 16 0 "[ . 1 . ]" 1
796 1 100 ILE MD 1 106 PHE QB . . 4.230 4.315 3.410 5.000 0.770 5 3 "[ + * . -]" 1
797 1 100 ILE MD 1 118 GLN QG . . 3.070 2.533 1.786 4.708 1.638 17 2 "[ - . 1 . + ]" 1
798 1 100 ILE MD 1 118 GLN QB . . 4.340 3.485 2.517 3.874 . 0 0 "[ . 1 . ]" 1
799 1 100 ILE MD 1 103 ILE HB . . 3.670 4.295 2.560 6.074 2.404 19 16 "[** ** -******** **+]" 1
800 1 66 LYS QB 1 100 ILE MD . . 3.490 3.506 2.415 4.654 1.164 13 5 "[ * . - +*. *]" 1
801 1 100 ILE MD 1 117 ALA MB . . 3.350 4.318 3.053 5.049 1.699 10 17 "[-**** ***+***** ***]" 1
802 1 100 ILE HB 1 100 ILE MD . . 3.060 3.086 2.122 3.226 0.166 9 0 "[ . 1 . ]" 1
803 1 100 ILE MD 1 121 LEU QD . . 2.800 2.644 1.879 3.347 0.547 5 1 "[ + 1 . ]" 1
804 1 100 ILE MD 1 103 ILE MD . . 3.040 3.356 1.865 3.840 0.800 10 8 "[ * -. ** +* *. * ]" 1
805 1 98 VAL HA 1 99 ASP QB . . 5.000 4.278 3.920 4.645 . 0 0 "[ . 1 . ]" 1
806 1 99 ASP QB 1 100 ILE HA . . 5.320 4.396 4.240 4.673 . 0 0 "[ . 1 . ]" 1
807 1 97 ILE MG 1 99 ASP QB . . 4.400 3.700 2.327 5.808 1.408 5 2 "[ -+ 1 . ]" 1
808 1 116 ILE H 1 116 ILE MD . . 3.780 2.102 1.906 2.897 . 0 0 "[ . 1 . ]" 1
809 1 116 ILE MD 1 117 ALA H . . 4.000 4.113 3.993 4.264 0.264 15 0 "[ . 1 . ]" 1
810 1 115 PHE QE 1 116 ILE MD . . 3.990 3.715 3.401 4.779 0.789 6 1 "[ .+ 1 . ]" 1
811 1 115 PHE QD 1 116 ILE MD . . 3.290 2.151 1.918 3.471 0.181 6 0 "[ . 1 . ]" 1
812 1 113 GLU HA 1 116 ILE MD . . 3.710 3.054 1.970 3.313 . 0 0 "[ . 1 . ]" 1
813 1 116 ILE HA 1 116 ILE MD . . 3.190 2.966 2.725 3.825 0.635 6 1 "[ .+ 1 . ]" 1
814 1 112 MET QG 1 116 ILE MD . . 3.350 2.729 2.011 3.980 0.630 13 3 "[ . 1 + . * -]" 1
815 1 25 LEU QD 1 29 ARG QD . . 3.500 3.005 1.816 4.038 0.538 3 1 "[ + . 1 . ]" 1
816 1 105 ARG H 1 105 ARG QD . . 4.380 4.074 3.377 4.462 0.082 19 0 "[ . 1 . ]" 1
817 1 29 ARG H 1 29 ARG QD . . 4.490 3.729 2.465 4.592 0.102 17 0 "[ . 1 . ]" 1
818 1 47 ALA HA 1 50 ARG QD . . 3.570 3.740 2.194 4.636 1.066 11 9 "[ **** **+- *. ]" 1
819 1 105 ARG HA 1 105 ARG QD . . 3.370 3.447 2.429 4.027 0.657 19 7 "[* . * * **. -+]" 1
820 1 105 ARG QB 1 105 ARG QD . . 2.400 2.067 1.981 2.186 . 0 0 "[ . 1 . ]" 1
821 1 56 ARG QD 1 60 ILE MD . . 3.720 2.306 1.827 3.430 . 0 0 "[ . 1 . ]" 1
822 1 50 ARG H 1 50 ARG QD . . 4.230 4.084 2.701 4.745 0.515 11 1 "[ . 1+ . ]" 1
823 1 50 ARG QD 1 51 LYS H . . 4.410 4.387 2.928 5.404 0.994 14 6 "[ **. -** +. ]" 1
824 1 50 ARG HA 1 50 ARG QD . . 3.940 4.006 3.442 4.548 0.608 1 2 "[+ . 1 . - ]" 1
825 1 50 ARG QB 1 50 ARG QD . . 2.770 2.284 1.930 2.438 . 0 0 "[ . 1 . ]" 1
826 1 29 ARG QB 1 29 ARG QD . . 2.990 2.229 1.938 2.908 . 0 0 "[ . 1 . ]" 1
827 1 45 MET ME 1 133 LEU QB . . 3.940 5.199 3.695 7.988 4.048 18 12 "[** ** * -* ***.* + ]" 1
828 1 17 ALA MB 1 133 LEU QB . . 3.640 3.195 2.281 5.404 1.764 13 2 "[ . 1 + . - ]" 1
829 1 51 LYS HA 1 51 LYS QE . . 3.500 2.566 1.999 3.660 0.160 13 0 "[ . 1 . ]" 1
830 1 144 LYS QE 1 145 TRP HE1 . . 4.390 2.973 2.038 4.098 . 0 0 "[ . 1 . ]" 1
831 1 73 LYS QE 1 74 PHE QE . . 3.850 3.041 1.924 3.959 0.109 11 0 "[ . 1 . ]" 1
832 1 144 LYS QE 1 144 LYS HG3 . . 3.690 2.680 2.138 3.376 . 0 0 "[ . 1 . ]" 1
833 1 73 LYS QE 1 73 LYS HG3 . . 3.560 2.746 2.298 3.346 . 0 0 "[ . 1 . ]" 1
834 1 144 LYS QE 1 144 LYS HG2 . . 3.690 2.769 2.011 3.461 . 0 0 "[ . 1 . ]" 1
835 1 73 LYS QE 1 73 LYS HG2 . . 3.570 2.495 2.164 3.403 . 0 0 "[ . 1 . ]" 1
836 1 121 LEU QB 1 121 LEU QD . . 2.490 1.892 1.786 1.952 . 0 0 "[ . 1 . ]" 1
837 1 39 LEU QB 1 40 GLU H . . 3.880 3.436 3.344 3.507 . 0 0 "[ . 1 . ]" 1
838 1 20 PHE HZ 1 62 LEU QB . . 4.440 3.327 1.948 5.136 0.696 1 2 "[+ . 1 - . ]" 1
839 1 10 ASP QB 1 11 PHE QD . . 4.140 4.078 2.440 4.625 0.485 7 0 "[ . 1 . ]" 1
840 1 32 LEU QB 1 33 PRO QD . . 3.280 1.986 1.907 2.200 . 0 0 "[ . 1 . ]" 1
841 1 37 LEU QB 1 41 VAL HB . . 4.780 3.422 2.517 4.861 0.081 18 0 "[ . 1 . ]" 1
842 1 10 ASP QB 1 56 ARG HE . . 5.370 5.696 2.897 7.758 2.388 2 8 "[ +-** ** * * . ]" 1
843 1 59 LEU HA 1 62 LEU QB . . 4.720 3.494 3.033 4.341 . 0 0 "[ . 1 . ]" 1
844 1 58 CYS HA 1 124 ASP QB . . 3.900 2.863 2.054 3.772 . 0 0 "[ . 1 . ]" 1
845 1 123 VAL QG 1 124 ASP QB . . 4.240 4.261 3.790 4.652 0.412 15 0 "[ . 1 . ]" 1
846 1 11 PHE HB2 1 60 ILE HA . . 4.600 2.862 2.089 3.703 . 0 0 "[ . 1 . ]" 1
847 1 23 THR MG 1 26 ASP QB . . 4.770 5.129 2.820 6.363 1.593 11 14 "[-***. * *1+***.****]" 1
848 1 13 ILE MG 1 42 LEU QB . . 4.180 3.514 2.315 4.266 0.086 2 0 "[ . 1 . ]" 1
849 1 125 CYS HB3 1 130 LEU QD . . 4.070 2.700 1.919 3.745 . 0 0 "[ . 1 . ]" 1
850 1 143 LYS HA 1 150 CYS HB3 . . 4.360 3.931 2.686 5.273 0.913 8 1 "[ . + 1 . ]" 1
851 1 140 ASP QB 1 143 LYS QB . . 4.750 4.672 4.280 5.220 0.470 14 0 "[ . 1 . ]" 1
852 1 132 GLY QA 1 135 ASN QB . . 4.140 2.507 2.088 4.132 . 0 0 "[ . 1 . ]" 1
853 1 103 ILE HB 1 106 PHE QB . . 3.770 1.924 1.847 2.102 . 0 0 "[ . 1 . ]" 1
854 1 140 ASP QB 1 141 LEU QB . . 4.680 3.805 3.621 4.484 . 0 0 "[ . 1 . ]" 1
855 1 103 ILE MD 1 106 PHE QB . . 3.750 2.815 1.925 3.210 . 0 0 "[ . 1 . ]" 1
856 1 120 ASP H 1 120 ASP HB3 . . 3.770 2.891 2.458 3.236 . 0 0 "[ . 1 . ]" 1
857 1 153 PHE H 1 153 PHE HB2 . . 3.440 2.717 2.071 3.179 . 0 0 "[ . 1 . ]" 1
858 1 14 VAL QG 1 82 TYR QB . . 4.550 4.112 2.306 5.631 1.081 19 5 "[* . *-1 * +]" 1
859 1 65 ILE MG 1 115 PHE QB . . 5.500 4.926 4.227 5.617 0.117 17 0 "[ . 1 . ]" 1
860 1 15 ALA MB 1 82 TYR QB . . 4.660 3.805 1.954 5.162 0.502 14 1 "[ . 1 +. ]" 1
861 1 11 PHE QE 1 13 ILE HB . . 4.310 2.442 1.970 3.983 . 0 0 "[ . 1 . ]" 1
862 1 75 ILE HB 1 78 ARG HA . . 5.080 5.256 4.654 5.931 0.851 5 4 "[ * + 1 .- * ]" 1
863 1 68 THR MG 1 97 ILE HB . . 3.040 7.176 3.600 8.720 5.680 12 19 [*****-*****+*******] 1
864 1 81 THR HB 1 82 TYR QD . . 4.770 3.891 2.317 5.114 0.344 11 0 "[ . 1 . ]" 1
865 1 69 PRO QD 1 97 ILE HB . . 4.400 6.053 2.495 8.737 4.337 12 13 "[* * . ***1*+**-*** ]" 1
866 1 75 ILE HB 1 78 ARG QG . . 3.170 2.362 1.893 2.901 . 0 0 "[ . 1 . ]" 1
867 1 15 ALA MB 1 81 THR HB . . 4.150 3.898 1.950 4.775 0.625 10 3 "[ -. + * . ]" 1
868 1 23 THR HB 1 25 LEU H . . 4.580 4.451 3.657 5.443 0.863 11 1 "[ . 1+ . ]" 1
869 1 23 THR HB 1 26 ASP H . . 5.280 6.266 2.975 7.836 2.556 11 14 "[****. * *1+****-* *]" 1
870 1 100 ILE HB 1 102 ALA MB . . 5.100 4.648 4.080 4.974 . 0 0 "[ . 1 . ]" 1
871 1 100 ILE HB 1 103 ILE QG . . 4.760 2.937 1.888 3.446 . 0 0 "[ . 1 . ]" 1
872 1 19 ASN QB 1 115 PHE QE . . 4.820 3.261 1.987 5.927 1.107 12 2 "[ . 1 + . - ]" 1
873 1 116 ILE H 1 116 ILE HB . . 3.610 2.306 2.235 2.490 . 0 0 "[ . 1 . ]" 1
874 1 45 MET HA 1 48 ASN QB . . 4.140 3.678 2.835 4.131 . 0 0 "[ . 1 . ]" 1
875 1 113 GLU HA 1 116 ILE HB . . 3.870 2.653 2.393 2.988 . 0 0 "[ . 1 . ]" 1
876 1 116 ILE HB 1 116 ILE MD . . 3.540 2.290 2.002 2.361 . 0 0 "[ . 1 . ]" 1
877 1 151 ALA MB 1 152 THR HB . . 4.620 4.407 3.635 4.732 0.112 17 0 "[ . 1 . ]" 1
878 1 152 THR H 1 152 THR HB . . 3.430 3.450 3.132 3.701 0.271 12 0 "[ . 1 . ]" 1
879 1 22 THR H 1 22 THR HB . . 3.940 2.853 2.713 3.272 . 0 0 "[ . 1 . ]" 1
880 1 22 THR HB 1 23 THR H . . 4.120 4.065 3.983 4.461 0.341 8 0 "[ . 1 . ]" 1
881 1 21 ALA HA 1 22 THR HB . . 4.630 4.523 4.331 4.818 0.188 11 0 "[ . 1 . ]" 1
882 1 21 ALA MB 1 22 THR HB . . 4.980 5.138 4.742 5.370 0.390 12 0 "[ . 1 . ]" 1
883 1 46 GLU HA 1 46 GLU QG . . 3.520 3.186 2.444 3.452 . 0 0 "[ . 1 . ]" 1
884 1 11 PHE QE 1 46 GLU QG . . 4.610 4.646 4.101 5.310 0.700 16 1 "[ . 1 .+ ]" 1
885 1 11 PHE HZ 1 46 GLU QG . . 4.150 4.136 3.164 4.968 0.818 16 1 "[ . 1 .+ ]" 1
886 1 45 MET HA 1 46 GLU QG . . 5.500 5.471 5.044 6.400 0.900 9 3 "[ -. +1* . ]" 1
887 1 46 GLU QG 1 47 ALA HA . . 4.110 3.436 2.952 5.728 1.618 10 1 "[ . + . ]" 1
888 1 43 LYS HA 1 46 GLU QG . . 3.360 2.326 1.921 3.975 0.615 11 1 "[ . 1+ . ]" 1
889 1 13 ILE MG 1 46 GLU QG . . 3.600 3.481 1.934 4.264 0.664 2 1 "[ + . 1 . ]" 1
890 1 13 ILE MD 1 46 GLU QG . . 4.430 4.433 3.163 5.024 0.594 2 3 "[-+ . 1 * . ]" 1
891 1 103 ILE MD 1 118 GLN QG . . 3.940 3.612 3.222 4.632 0.692 3 2 "[ + . 1 . - ]" 1
892 1 127 THR HB 1 130 LEU QB . . 4.650 4.825 4.221 5.564 0.914 7 2 "[ - + 1 . ]" 1
893 1 127 THR HB 1 131 LYS QB . . 5.190 5.120 4.524 5.480 0.290 1 0 "[ . 1 . ]" 1
894 1 38 PRO QB 1 40 GLU QG . . 3.960 1.963 1.911 2.159 . 0 0 "[ . 1 . ]" 1
895 1 39 LEU HG 1 40 GLU QG . . 4.640 4.050 3.638 4.401 . 0 0 "[ . 1 . ]" 1
896 1 95 GLU QG 1 96 ALA MB . . 4.710 4.916 4.239 5.244 0.534 19 1 "[ . 1 . +]" 1
897 1 83 GLU H 1 83 GLU QG . . 3.300 2.676 1.901 4.055 0.755 16 1 "[ . 1 .+ ]" 1
898 1 36 LYS H 1 83 GLU QG . . 4.290 4.333 2.679 8.435 4.145 14 5 "[* .* 1 +.- *]" 1
899 1 83 GLU HA 1 83 GLU QG . . 2.950 3.001 2.056 3.438 0.488 13 0 "[ . 1 . ]" 1
900 1 70 LYS QE 1 95 GLU QG . . 4.120 10.398 2.403 14.461 10.341 10 18 "[**-** ***+*********]" 1
901 1 68 THR HB 1 97 ILE MG . . 4.770 6.147 1.933 8.510 3.740 13 15 "[-**** ***1**+*.*** ]" 1
902 1 36 LYS QB 1 83 GLU QG . . 3.980 3.977 1.956 8.480 4.500 14 4 "[ * . 1 +.-* ]" 1
903 1 109 LEU QB 1 114 GLN QG . . 4.540 2.879 2.062 5.143 0.603 10 1 "[ . + . ]" 1
904 1 68 THR MG 1 114 GLN QG . . 4.710 3.560 2.590 4.073 . 0 0 "[ . 1 . ]" 1
905 1 119 VAL HA 1 120 ASP HA . . 4.630 4.756 4.724 4.836 0.206 8 0 "[ . 1 . ]" 1
906 1 65 ILE QG 1 119 VAL HA . . 4.420 3.857 3.168 4.495 0.075 14 0 "[ . 1 . ]" 1
907 1 66 LYS QB 1 66 LYS QE . . 4.330 3.072 2.057 3.738 . 0 0 "[ . 1 . ]" 1
908 1 66 LYS QB 1 66 LYS QD . . 3.400 2.173 1.934 2.436 . 0 0 "[ . 1 . ]" 1
909 1 71 MET QG 1 111 PRO HA . . 4.110 3.512 1.899 4.794 0.684 19 4 "[ . * * . - +]" 1
910 1 75 ILE MD 1 111 PRO HA . . 4.560 3.919 3.387 4.305 . 0 0 "[ . 1 . ]" 1
911 1 14 VAL HA 1 17 ALA H . . 4.820 3.919 3.395 4.325 . 0 0 "[ . 1 . ]" 1
912 1 15 ALA MB 1 16 VAL HA . . 4.410 3.745 3.636 3.853 . 0 0 "[ . 1 . ]" 1
913 1 69 PRO HA 1 72 LYS QE . . 4.820 3.406 2.098 4.887 0.067 6 0 "[ . 1 . ]" 1
914 1 69 PRO HA 1 72 LYS QB . . 3.670 3.596 2.332 4.387 0.717 2 4 "[*+ . *1 . - ]" 1
915 1 13 ILE MG 1 14 VAL HA . . 4.350 2.950 2.830 3.163 . 0 0 "[ . 1 . ]" 1
916 1 14 VAL HA 1 17 ALA MB . . 3.580 3.104 2.203 3.656 0.076 11 0 "[ . 1 . ]" 1
917 1 69 PRO HA 1 72 LYS QG . . 4.280 2.571 1.886 4.266 . 0 0 "[ . 1 . ]" 1
918 1 13 ILE MD 1 14 VAL HA . . 3.580 3.964 2.920 5.662 2.082 18 7 "[ * * - 1 ** *+ ]" 1
919 1 148 GLN HA 1 148 GLN HG3 . . 3.840 3.015 2.101 3.751 . 0 0 "[ . 1 . ]" 1
920 1 41 VAL HA 1 44 GLU HA . . 5.500 5.322 4.913 5.537 0.037 19 0 "[ . 1 . ]" 1
921 1 41 VAL HA 1 45 MET H . . 4.480 4.220 3.683 4.490 0.010 13 0 "[ . 1 . ]" 1
922 1 42 LEU HA 1 45 MET QG . . 4.190 4.135 3.361 5.332 1.142 9 2 "[ . +1 - ]" 1
923 1 14 VAL HA 1 45 MET QG . . 4.670 3.919 2.769 4.949 0.279 5 0 "[ . 1 . ]" 1
924 1 41 VAL HA 1 141 LEU QD . . 3.160 2.955 2.006 3.460 0.300 4 0 "[ . 1 . ]" 1
925 1 36 LYS QB 1 37 LEU H . . 4.110 3.777 3.280 4.047 . 0 0 "[ . 1 . ]" 1
926 1 13 ILE MG 1 45 MET QG . . 3.670 3.577 2.794 4.051 0.381 3 0 "[ . 1 . ]" 1
927 1 11 PHE HB3 1 60 ILE HA . . 4.610 3.183 2.269 3.656 . 0 0 "[ . 1 . ]" 1
928 1 68 THR H 1 98 VAL HB . . 5.000 5.011 4.097 6.763 1.763 10 2 "[ . + . - ]" 1
929 1 73 LYS HB3 1 74 PHE H . . 4.390 2.570 2.282 2.831 . 0 0 "[ . 1 . ]" 1
930 1 42 LEU HA 1 45 MET QB . . 4.630 2.908 2.491 3.756 . 0 0 "[ . 1 . ]" 1
931 1 72 LYS QB 1 76 PRO HA . . 3.860 3.306 2.552 4.152 0.292 6 0 "[ . 1 . ]" 1
932 1 17 ALA MB 1 45 MET QB . . 4.610 3.812 3.053 4.656 0.046 8 0 "[ . 1 . ]" 1
933 1 13 ILE MG 1 45 MET QB . . 4.610 2.011 1.817 2.372 . 0 0 "[ . 1 . ]" 1
934 1 13 ILE MD 1 45 MET QB . . 3.680 2.748 1.860 4.297 0.617 14 1 "[ . 1 +. ]" 1
935 1 139 SER HB3 1 140 ASP H . . 3.910 2.732 2.263 4.010 0.100 12 0 "[ . 1 . ]" 1
936 1 31 LYS H 1 31 LYS QB . . 3.760 2.776 2.364 3.370 . 0 0 "[ . 1 . ]" 1
937 1 71 MET H 1 71 MET QB . . 3.660 2.225 2.054 2.581 . 0 0 "[ . 1 . ]" 1
938 1 68 THR MG 1 98 VAL HB . . 3.550 2.906 1.957 4.435 0.885 18 2 "[ . - . + ]" 1
939 1 45 MET QB 1 142 LEU QD . . 3.430 3.076 2.576 3.454 0.024 4 0 "[ . 1 . ]" 1
940 1 143 LYS H 1 144 LYS QB . . 4.400 4.303 4.233 4.461 0.061 3 0 "[ . 1 . ]" 1
941 1 13 ILE QG 1 16 VAL HB . . 4.010 3.998 2.659 5.918 1.908 4 6 "[ *+. -*1 *. *]" 1
942 1 101 PRO HA 1 102 ALA MB . . 5.050 4.979 4.916 5.021 . 0 0 "[ . 1 . ]" 1
943 1 100 ILE MG 1 101 PRO HA . . 4.740 4.277 3.922 4.617 . 0 0 "[ . 1 . ]" 1
944 1 38 PRO QB 1 40 GLU H . . 4.220 2.461 2.400 2.595 . 0 0 "[ . 1 . ]" 1
945 1 51 LYS HA 1 51 LYS QB . . 2.780 2.373 2.304 2.482 . 0 0 "[ . 1 . ]" 1
946 1 51 LYS QB 1 51 LYS QE . . 3.910 2.511 1.988 3.261 . 0 0 "[ . 1 . ]" 1
947 1 48 ASN QB 1 136 VAL HB . . 4.240 2.934 1.914 4.589 0.349 9 0 "[ . 1 . ]" 1
948 1 48 ASN QB 1 51 LYS QB . . 4.380 4.245 3.952 4.474 0.094 16 0 "[ . 1 . ]" 1
949 1 33 PRO QB 1 35 LYS H . . 4.610 3.913 2.443 4.892 0.282 13 0 "[ . 1 . ]" 1
950 1 48 ASN HA 1 51 LYS QB . . 3.380 2.816 2.484 3.104 . 0 0 "[ . 1 . ]" 1
951 1 51 LYS QB 1 52 ALA HA . . 4.210 4.166 3.930 4.312 0.102 7 0 "[ . 1 . ]" 1
952 1 123 VAL HA 1 125 CYS H . . 4.430 3.199 3.015 3.521 . 0 0 "[ . 1 . ]" 1
953 1 123 VAL HA 1 123 VAL HB . . 2.910 2.503 2.436 2.561 . 0 0 "[ . 1 . ]" 1
954 1 65 ILE HA 1 65 ILE QG . . 3.630 2.304 2.076 2.442 . 0 0 "[ . 1 . ]" 1
955 1 104 PRO HA 1 105 ARG QB . . 5.380 5.215 5.170 5.239 . 0 0 "[ . 1 . ]" 1
956 1 33 PRO QB 1 145 TRP HE3 . . 4.090 3.861 1.962 6.831 2.741 13 8 "[*** - 1 *+ * *]" 1
957 1 100 ILE H 1 107 LYS QB . . 4.550 4.013 3.489 4.583 0.033 7 0 "[ . 1 . ]" 1
958 1 107 LYS QD 1 109 LEU H . . 5.240 4.954 3.963 6.222 0.982 1 5 "[+- . 1 *** ]" 1
959 1 104 PRO HA 1 107 LYS QB . . 4.120 4.502 3.878 5.160 1.040 7 8 "[ * *. + *1* * . - *]" 1
960 1 33 PRO QB 1 145 TRP QB . . 4.590 4.006 2.903 7.449 2.859 3 1 "[ + . 1 . ]" 1
961 1 116 ILE HA 1 119 VAL HB . . 3.640 2.804 2.213 4.538 0.898 15 2 "[ - . 1 + ]" 1
962 1 14 VAL HB 1 45 MET ME . . 4.170 4.162 2.928 5.647 1.477 15 5 "[ - . 1* *+ *]" 1
963 1 65 ILE HA 1 66 LYS QD . . 4.420 4.172 3.067 5.365 0.945 17 6 "[* **. -1* . + ]" 1
964 1 145 TRP QB 1 146 LEU QD . . 3.450 1.954 1.805 2.307 . 0 0 "[ . 1 . ]" 1
965 1 41 VAL QG 1 145 TRP QB . . 3.800 2.886 2.120 3.632 . 0 0 "[ . 1 . ]" 1
966 1 33 PRO QB 1 34 GLY H . . 4.550 3.682 2.796 3.984 . 0 0 "[ . 1 . ]" 1
967 1 33 PRO HA 1 35 LYS H . . 4.680 3.802 3.378 4.703 0.023 17 0 "[ . 1 . ]" 1
968 1 100 ILE HB 1 107 LYS QB . . 5.000 5.668 5.056 6.490 1.490 9 12 "[ **** *-+1* * .** *]" 1
969 1 106 PHE HA 1 106 PHE QD . . 4.040 3.242 3.057 3.516 . 0 0 "[ . 1 . ]" 1
970 1 112 MET HB2 1 113 GLU H . . 4.470 3.545 3.153 3.752 . 0 0 "[ . 1 . ]" 1
971 1 106 PHE HA 1 109 LEU QB . . 3.820 2.012 1.893 2.563 . 0 0 "[ . 1 . ]" 1
972 1 106 PHE HA 1 117 ALA MB . . 5.500 4.163 3.737 4.642 . 0 0 "[ . 1 . ]" 1
973 1 112 MET H 1 112 MET HB2 . . 3.790 2.265 2.065 2.399 . 0 0 "[ . 1 . ]" 1
974 1 22 THR HA 1 22 THR MG . . 3.290 3.197 3.185 3.207 . 0 0 "[ . 1 . ]" 1
975 1 95 GLU QB 1 96 ALA H . . 3.220 2.113 1.936 2.597 . 0 0 "[ . 1 . ]" 1
976 1 95 GLU QB 1 95 GLU QG . . 2.470 2.059 2.012 2.086 . 0 0 "[ . 1 . ]" 1
977 1 68 THR MG 1 98 VAL HA . . 4.760 4.835 3.957 5.376 0.616 18 1 "[ . 1 . + ]" 1
978 1 98 VAL HA 1 98 VAL QG . . 2.740 2.131 2.039 2.327 . 0 0 "[ . 1 . ]" 1
979 1 110 GLU H 1 113 GLU QB . . 4.560 3.367 3.147 3.558 . 0 0 "[ . 1 . ]" 1
980 1 70 LYS QE 1 95 GLU QB . . 4.530 9.672 2.937 12.877 8.347 10 18 "[***** **-+*********]" 1
981 1 151 ALA MB 1 152 THR HA . . 4.050 3.898 3.620 4.247 0.197 16 0 "[ . 1 . ]" 1
982 1 70 LYS QG 1 95 GLU QB . . 5.500 9.935 5.501 13.169 7.669 7 17 "[** ** +*********-**]" 1
983 1 115 PHE HA 1 118 GLN QG . . 2.740 3.625 2.183 4.733 1.993 1 12 "[+* *. * *-****** ]" 1
984 1 152 THR HA 1 152 THR MG . . 3.190 3.197 3.190 3.208 0.018 6 0 "[ . 1 . ]" 1
985 1 50 ARG H 1 50 ARG QB . . 2.850 2.205 2.054 2.427 . 0 0 "[ . 1 . ]" 1
986 1 50 ARG QB 1 51 LYS H . . 3.510 2.881 2.475 3.529 0.019 15 0 "[ . 1 . ]" 1
987 1 13 ILE QG 1 46 GLU QB . . 4.000 2.719 1.959 3.559 . 0 0 "[ . 1 . ]" 1
988 1 41 VAL HA 1 44 GLU QB . . 4.390 2.554 2.102 2.773 . 0 0 "[ . 1 . ]" 1
989 1 65 ILE QG 1 118 GLN QG . . 4.770 4.279 2.876 4.864 0.094 10 0 "[ . 1 . ]" 1
990 1 62 LEU H 1 65 ILE QG . . 5.020 4.570 4.136 6.630 1.610 11 2 "[ . 1+ . - ]" 1
991 1 144 LYS H 1 144 LYS QD . . 4.530 4.248 3.817 4.508 . 0 0 "[ . 1 . ]" 1
992 1 65 ILE QG 1 118 GLN QB . . 4.520 2.656 2.113 3.271 . 0 0 "[ . 1 . ]" 1
993 1 13 ILE HB 1 46 GLU QB . . 2.550 2.780 2.292 4.513 1.963 10 4 "[ . *+- . * ]" 1
994 1 144 LYS QB 1 144 LYS QD . . 2.400 2.081 1.938 2.270 . 0 0 "[ . 1 . ]" 1
995 1 13 ILE HA 1 13 ILE QG . . 3.320 2.251 2.098 2.501 . 0 0 "[ . 1 . ]" 1
996 1 13 ILE HA 1 13 ILE MG . . 3.330 3.147 2.988 3.202 . 0 0 "[ . 1 . ]" 1
997 1 13 ILE HA 1 13 ILE MD . . 2.760 2.797 2.199 3.286 0.526 9 2 "[ - . +1 . ]" 1
998 1 144 LYS QD 1 145 TRP H . . 4.280 3.432 2.908 4.350 0.070 19 0 "[ . 1 . ]" 1
999 1 144 LYS HA 1 144 LYS QD . . 4.150 3.910 3.555 4.133 . 0 0 "[ . 1 . ]" 1
1000 1 13 ILE HA 1 16 VAL HB . . 3.530 3.169 1.970 5.023 1.493 14 6 "[ **. -*1 +. *]" 1
1001 1 23 THR HA 1 23 THR MG . . 3.140 2.855 1.964 3.206 0.066 1 0 "[ . 1 . ]" 1
1002 1 66 LYS QD 1 100 ILE MD . . 3.350 4.389 2.361 5.521 2.171 3 13 "[**+ .****1-* ** **]" 1
1003 1 73 LYS QD 1 74 PHE QD . . 4.810 3.711 2.807 4.342 . 0 0 "[ . 1 . ]" 1
1004 1 73 LYS HA 1 73 LYS QD . . 4.440 3.964 3.649 4.127 . 0 0 "[ . 1 . ]" 1
1005 1 74 PHE HA 1 75 ILE QG . . 5.390 4.922 4.860 4.974 . 0 0 "[ . 1 . ]" 1
1006 1 74 PHE HA 1 111 PRO QB . . 5.240 5.129 4.677 5.428 0.188 15 0 "[ . 1 . ]" 1
1007 1 60 ILE MG 1 61 CYS HA . . 3.990 3.287 2.971 3.549 . 0 0 "[ . 1 . ]" 1
1008 1 74 PHE HA 1 74 PHE QD . . 3.640 3.099 3.015 3.127 . 0 0 "[ . 1 . ]" 1
1009 1 74 PHE HA 1 74 PHE QE . . 4.670 4.629 4.562 4.731 0.061 11 0 "[ . 1 . ]" 1
1010 1 81 THR HA 1 82 TYR QD . . 4.720 4.086 3.424 4.834 0.114 12 0 "[ . 1 . ]" 1
1011 1 116 ILE HA 1 116 ILE QG . . 3.540 2.184 2.136 2.385 . 0 0 "[ . 1 . ]" 1
1012 1 45 MET QB 1 142 LEU HG . . 4.400 4.799 3.757 6.075 1.675 4 9 "[ *-+* ** * . * *]" 1
1013 1 97 ILE HA 1 98 VAL HB . . 4.690 4.715 4.512 5.643 0.953 17 1 "[ . 1 . + ]" 1
1014 1 15 ALA MB 1 81 THR HA . . 4.130 3.419 2.159 5.442 1.312 8 4 "[ . + 1 * *. -]" 1
1015 1 81 THR HA 1 81 THR MG . . 3.360 2.451 1.943 3.201 . 0 0 "[ . 1 . ]" 1
1016 1 116 ILE QG 1 116 ILE MG . . 2.910 2.034 1.946 2.145 . 0 0 "[ . 1 . ]" 1
1017 1 74 PHE HA 1 75 ILE MG . . 5.250 4.585 4.393 4.740 . 0 0 "[ . 1 . ]" 1
1018 1 40 GLU H 1 40 GLU HB2 . . 3.820 3.594 3.587 3.600 . 0 0 "[ . 1 . ]" 1
1019 1 68 THR MG 1 97 ILE HA . . 4.300 5.825 1.969 7.288 2.988 12 15 "[* *** ***1*+**-*** ]" 1
1020 1 56 ARG HA 1 59 LEU H . . 4.570 3.985 3.680 4.215 . 0 0 "[ . 1 . ]" 1
1021 1 142 LEU H 1 142 LEU HG . . 3.770 3.929 2.406 4.476 0.706 4 4 "[ +. ** 1 . - ]" 1
1022 1 56 ARG HA 1 60 ILE QG . . 3.800 4.217 3.567 5.105 1.305 16 7 "[ . *-* * .+** ]" 1
1023 1 13 ILE QG 1 46 GLU HA . . 4.030 2.351 1.971 3.224 . 0 0 "[ . 1 . ]" 1
1024 1 40 GLU HA 1 44 GLU H . . 4.730 4.771 4.307 5.336 0.606 4 2 "[ +.- 1 . ]" 1
1025 1 13 ILE HB 1 46 GLU HA . . 4.270 3.976 3.310 4.658 0.388 10 0 "[ . 1 . ]" 1
1026 1 40 GLU HA 1 43 LYS H . . 4.180 4.141 3.712 4.382 0.202 3 0 "[ . 1 . ]" 1
1027 1 106 PHE QD 1 114 GLN HA . . 4.040 2.283 1.893 3.352 . 0 0 "[ . 1 . ]" 1
1028 1 114 GLN HA 1 118 GLN H . . 4.560 4.338 4.173 4.501 . 0 0 "[ . 1 . ]" 1
1029 1 105 ARG QB 1 106 PHE HA . . 3.890 3.937 3.826 4.048 0.158 12 0 "[ . 1 . ]" 1
1030 1 40 GLU HA 1 40 GLU QG . . 3.410 3.338 3.327 3.342 . 0 0 "[ . 1 . ]" 1
1031 1 114 GLN HA 1 117 ALA MB . . 3.300 2.460 2.070 2.778 . 0 0 "[ . 1 . ]" 1
1032 1 40 GLU HA 1 43 LYS QG . . 4.040 2.598 2.164 3.033 . 0 0 "[ . 1 . ]" 1
1033 1 103 ILE MG 1 114 GLN HA . . 4.900 4.932 4.572 6.361 1.461 19 1 "[ . 1 . +]" 1
1034 1 40 GLU HA 1 141 LEU QD . . 3.780 3.987 3.029 4.962 1.182 17 4 "[ *. 1 -* . + ]" 1
1035 1 50 ARG HA 1 50 ARG QG . . 3.790 2.546 2.036 3.344 . 0 0 "[ . 1 . ]" 1
1036 1 47 ALA HA 1 50 ARG QG . . 4.320 4.225 1.900 5.127 0.807 7 6 "[ ** * + - * . ]" 1
1037 1 50 ARG QG 1 51 LYS HA . . 4.180 4.284 2.963 5.546 1.366 13 7 "[ -*. * *+*. *]" 1
1038 1 72 LYS HA 1 76 PRO HA . . 4.060 2.878 2.171 3.966 . 0 0 "[ . 1 . ]" 1
1039 1 138 CYS QB 1 143 LYS HA . . 3.940 4.067 3.056 5.663 1.723 12 6 "[ ** . -* + * ]" 1
1040 1 72 LYS HA 1 72 LYS QE . . 4.820 4.588 2.964 5.489 0.669 7 2 "[ . + 1 . - ]" 1
1041 1 143 LYS HA 1 151 ALA MB . . 4.030 5.317 2.720 8.130 4.100 15 14 "[ ** * ****** +***-]" 1
1042 1 50 ARG H 1 50 ARG QG . . 3.610 3.401 2.272 4.026 0.416 9 0 "[ . 1 . ]" 1
1043 1 44 GLU HA 1 47 ALA H . . 4.230 3.651 3.353 4.061 . 0 0 "[ . 1 . ]" 1
1044 1 70 LYS HA 1 73 LYS H . . 3.940 3.601 3.425 4.020 0.080 6 0 "[ . 1 . ]" 1
1045 1 32 LEU HA 1 33 PRO QG . . 4.600 4.052 4.000 4.098 . 0 0 "[ . 1 . ]" 1
1046 1 118 GLN HA 1 118 GLN QG . . 3.110 2.595 2.354 3.327 0.217 17 0 "[ . 1 . ]" 1
1047 1 143 LYS HA 1 150 CYS HB2 . . 4.360 3.565 2.354 4.836 0.476 12 0 "[ . 1 . ]" 1
1048 1 71 MET HA 1 111 PRO QB . . 3.670 1.998 1.872 2.545 . 0 0 "[ . 1 . ]" 1
1049 1 69 PRO QB 1 70 LYS HA . . 4.090 4.021 3.988 4.053 . 0 0 "[ . 1 . ]" 1
1050 1 70 LYS HA 1 70 LYS QG . . 3.790 2.293 2.009 3.021 . 0 0 "[ . 1 . ]" 1
1051 1 118 GLN HA 1 121 LEU QD . . 3.350 2.234 1.866 2.956 . 0 0 "[ . 1 . ]" 1
1052 1 44 GLU HA 1 46 GLU H . . 4.760 4.700 4.382 4.912 0.152 8 0 "[ . 1 . ]" 1
1053 1 33 PRO QG 1 145 TRP HA . . 4.010 5.701 2.117 9.048 5.038 2 11 "[*+* * ** ** * - *]" 1
1054 1 50 ARG HA 1 54 CYS H . . 4.160 2.269 1.951 2.758 . 0 0 "[ . 1 . ]" 1
1055 1 50 ARG HA 1 53 GLY H . . 4.750 3.348 3.129 3.673 . 0 0 "[ . 1 . ]" 1
1056 1 20 PHE HA 1 115 PHE HZ . . 4.380 4.687 3.161 8.692 4.312 17 6 "[* .- * * . + *]" 1
1057 1 55 THR HA 1 56 ARG HA . . 4.690 4.307 4.296 4.327 . 0 0 "[ . 1 . ]" 1
1058 1 50 ARG HA 1 54 CYS QB . . 4.530 2.654 1.986 3.874 . 0 0 "[ . 1 . ]" 1
1059 1 126 THR HA 1 126 THR MG . . 3.360 2.450 2.405 2.510 . 0 0 "[ . 1 . ]" 1
1060 1 55 THR HA 1 57 GLY H . . 4.720 4.585 4.281 4.781 0.061 8 0 "[ . 1 . ]" 1
1061 1 45 MET HA 1 45 MET QG . . 2.910 2.232 2.016 2.591 . 0 0 "[ . 1 . ]" 1
1062 1 100 ILE MG 1 103 ILE QG . . 2.950 1.929 1.867 2.321 . 0 0 "[ . 1 . ]" 1
1063 1 106 PHE QD 1 107 LYS HA . . 4.370 2.930 2.621 3.312 . 0 0 "[ . 1 . ]" 1
1064 1 107 LYS HA 1 114 GLN QE . . 3.780 2.582 1.887 3.503 . 0 0 "[ . 1 . ]" 1
1065 1 100 ILE HA 1 101 PRO HG2 . . 4.220 4.237 4.191 4.309 0.089 6 0 "[ . 1 . ]" 1
1066 1 42 LEU HA 1 45 MET H . . 4.530 3.523 3.267 3.939 . 0 0 "[ . 1 . ]" 1
1067 1 145 TRP HA 1 145 TRP HE3 . . 3.520 3.489 2.968 4.182 0.662 9 1 "[ . +1 . ]" 1
1068 1 33 PRO QD 1 145 TRP HA . . 3.720 5.935 2.917 8.425 4.705 1 14 "[+** ** ** **-*** *]" 1
1069 1 145 TRP HA 1 146 LEU QD . . 3.930 3.596 3.412 3.882 . 0 0 "[ . 1 . ]" 1
1070 1 42 LEU HA 1 46 GLU H . . 5.020 3.918 3.604 4.381 . 0 0 "[ . 1 . ]" 1
1071 1 129 CYS HA 1 132 GLY H . . 4.310 3.372 3.149 3.631 . 0 0 "[ . 1 . ]" 1
1072 1 13 ILE MG 1 42 LEU HA . . 3.730 2.693 2.038 3.319 . 0 0 "[ . 1 . ]" 1
1073 1 146 LEU HA 1 146 LEU QD . . 3.390 2.040 1.905 2.395 . 0 0 "[ . 1 . ]" 1
1074 1 142 LEU HA 1 146 LEU QD . . 3.480 2.978 2.281 3.851 0.371 17 0 "[ . 1 . ]" 1
1075 1 54 CYS QB 1 59 LEU HG . . 4.570 3.895 3.201 4.375 . 0 0 "[ . 1 . ]" 1
1076 1 33 PRO QB 1 146 LEU QD . . 4.250 3.118 1.875 7.115 2.865 3 1 "[ + . 1 . ]" 1
1077 1 72 LYS HA 1 72 LYS QG . . 3.640 2.908 2.063 3.434 . 0 0 "[ . 1 . ]" 1
1078 1 72 LYS QE 1 72 LYS QG . . 3.370 2.119 1.948 2.325 . 0 0 "[ . 1 . ]" 1
1079 1 140 ASP HA 1 151 ALA MB . . 4.300 6.122 3.096 8.758 4.458 2 14 "[*+*-* ** *** *** * ]" 1
1080 1 133 LEU H 1 133 LEU MD1 . . 4.090 3.324 2.577 4.159 0.069 7 0 "[ . 1 . ]" 1
1081 1 100 ILE HA 1 100 ILE QG . . 3.500 2.854 2.367 3.183 . 0 0 "[ . 1 . ]" 1
1082 1 140 ASP HA 1 143 LYS QB . . 2.850 2.999 2.784 3.466 0.616 14 3 "[ . * 1 -+. ]" 1
1083 1 16 VAL QG 1 133 LEU MD1 . . 3.730 3.118 2.150 4.085 0.355 13 0 "[ . 1 . ]" 1
1084 1 82 TYR HA 1 82 TYR QD . . 3.600 3.683 3.498 3.740 0.140 8 0 "[ . 1 . ]" 1
1085 1 152 THR HA 1 153 PHE HA . . 5.420 4.722 4.369 5.343 . 0 0 "[ . 1 . ]" 1
1086 1 82 TYR HA 1 83 GLU HA . . 4.760 4.638 4.528 4.797 0.037 8 0 "[ . 1 . ]" 1
1087 1 118 GLN HA 1 121 LEU HG . . 4.590 3.215 2.368 5.180 0.590 15 1 "[ . 1 + ]" 1
1088 1 73 LYS HA 1 73 LYS QE . . 4.690 4.727 4.420 5.056 0.366 12 0 "[ . 1 . ]" 1
1089 1 144 LYS HA 1 144 LYS QE . . 5.420 4.696 4.313 5.245 . 0 0 "[ . 1 . ]" 1
1090 1 148 GLN HA 1 148 GLN HG2 . . 3.840 2.938 2.139 3.859 0.019 18 0 "[ . 1 . ]" 1
1091 1 41 VAL HB 1 141 LEU HA . . 4.780 7.235 4.924 8.752 3.972 13 16 "[-**** ******+ *** *]" 1
1092 1 100 ILE HA 1 101 PRO HG3 . . 4.410 4.323 4.314 4.347 . 0 0 "[ . 1 . ]" 1
1093 1 39 LEU HA 1 42 LEU QB . . 3.010 2.127 1.893 2.537 . 0 0 "[ . 1 . ]" 1
1094 1 15 ALA MB 1 82 TYR HA . . 4.350 4.926 3.404 6.488 2.138 19 9 "[**- . **1 * *. * +]" 1
1095 1 144 LYS HA 1 144 LYS HG3 . . 4.020 3.237 2.713 3.576 . 0 0 "[ . 1 . ]" 1
1096 1 144 LYS HA 1 144 LYS HG2 . . 4.020 2.584 2.410 2.998 . 0 0 "[ . 1 . ]" 1
1097 1 130 LEU HA 1 130 LEU HG . . 3.980 3.035 2.645 3.516 . 0 0 "[ . 1 . ]" 1
1098 1 103 ILE HA 1 103 ILE QG . . 3.810 2.706 2.578 3.139 . 0 0 "[ . 1 . ]" 1
1099 1 152 THR MG 1 153 PHE HA . . 4.330 4.188 3.273 4.875 0.545 5 3 "[ + 1 *. - ]" 1
1100 1 103 ILE HA 1 103 ILE MD . . 4.000 3.942 3.882 4.112 0.112 19 0 "[ . 1 . ]" 1
1101 1 59 LEU HA 1 59 LEU QD . . 2.920 2.583 2.129 3.122 0.202 8 0 "[ . 1 . ]" 1
1102 1 36 LYS QG 1 37 LEU H . . 3.360 2.990 1.930 4.533 1.173 19 2 "[ - . 1 . +]" 1
1103 1 103 ILE HA 1 104 PRO HD3 . . 3.580 2.667 2.380 2.860 . 0 0 "[ . 1 . ]" 1
1104 1 37 LEU QB 1 37 LEU QD . . 2.740 1.969 1.798 2.045 . 0 0 "[ . 1 . ]" 1
1105 1 103 ILE HA 1 103 ILE MG . . 3.330 2.228 2.149 2.280 . 0 0 "[ . 1 . ]" 1
1106 1 103 ILE H 1 121 LEU QD . . 3.850 3.858 3.511 4.217 0.367 8 0 "[ . 1 . ]" 1
1107 1 138 CYS HA 1 142 LEU QD . . 3.750 3.721 2.104 5.023 1.273 12 4 "[ * . - 1*+ . ]" 1
1108 1 142 LEU HA 1 142 LEU QD . . 2.750 2.116 1.898 2.878 0.128 17 0 "[ . 1 . ]" 1
1109 1 32 LEU QD 1 33 PRO QD . . 3.200 2.586 1.830 3.303 0.103 10 0 "[ . 1 . ]" 1
1110 1 130 LEU HA 1 130 LEU QD . . 2.960 2.169 1.928 2.699 . 0 0 "[ . 1 . ]" 1
1111 1 125 CYS HB2 1 130 LEU QD . . 4.070 2.735 1.941 3.720 . 0 0 "[ . 1 . ]" 1
1112 1 45 MET QG 1 142 LEU QD . . 3.290 1.806 1.666 2.186 . 0 0 "[ . 1 . ]" 1
1113 1 51 LYS HA 1 51 LYS QG . . 3.590 2.648 2.312 3.097 . 0 0 "[ . 1 . ]" 1
1114 1 29 ARG HA 1 29 ARG QD . . 4.220 3.356 2.046 4.042 . 0 0 "[ . 1 . ]" 1
1115 1 51 LYS QE 1 51 LYS QG . . 3.360 2.187 1.980 2.310 . 0 0 "[ . 1 . ]" 1
1116 1 109 LEU QB 1 109 LEU QD . . 2.780 1.934 1.878 1.965 . 0 0 "[ . 1 . ]" 1
1117 1 102 ALA MB 1 121 LEU QD . . 2.680 1.964 1.697 2.358 . 0 0 "[ . 1 . ]" 1
1118 1 109 LEU QD 1 110 GLU H . . 3.270 3.247 2.491 3.685 0.415 5 0 "[ . 1 . ]" 1
1119 1 25 LEU QD 1 26 ASP H . . 3.350 3.261 1.796 4.013 0.663 1 5 "[+ . 1 * -* * ]" 1
1120 1 109 LEU H 1 109 LEU QD . . 3.130 3.121 2.354 3.652 0.522 11 1 "[ . 1+ . ]" 1
1121 1 25 LEU HA 1 25 LEU QD . . 2.930 2.860 1.856 3.473 0.543 2 5 "[ + *. 1 * . - *]" 1
1122 1 109 LEU HA 1 109 LEU QD . . 2.830 2.092 1.904 2.366 . 0 0 "[ . 1 . ]" 1
1123 1 106 PHE HA 1 109 LEU QD . . 3.060 2.304 1.942 2.707 . 0 0 "[ . 1 . ]" 1
1124 1 42 LEU QB 1 42 LEU QD . . 2.520 1.908 1.729 2.050 . 0 0 "[ . 1 . ]" 1
1125 1 25 LEU QB 1 25 LEU QD . . 2.350 1.869 1.719 2.068 . 0 0 "[ . 1 . ]" 1
1126 1 141 LEU QB 1 141 LEU QD . . 2.570 1.942 1.745 2.061 . 0 0 "[ . 1 . ]" 1
1127 1 13 ILE MG 1 42 LEU QD . . 2.740 2.089 1.684 2.876 0.136 19 0 "[ . 1 . ]" 1
1128 1 62 LEU HA 1 62 LEU QD . . 2.990 2.559 2.057 3.450 0.460 12 0 "[ . 1 . ]" 1
1129 1 62 LEU HA 1 62 LEU HG . . 4.150 3.451 3.053 3.624 . 0 0 "[ . 1 . ]" 1
1130 1 141 LEU QD 1 145 TRP HE1 . . 3.190 2.073 1.865 2.438 . 0 0 "[ . 1 . ]" 1
1131 1 141 LEU QD 1 142 LEU H . . 3.940 3.740 3.358 4.060 0.120 5 0 "[ . 1 . ]" 1
1132 1 43 LYS HA 1 43 LYS QG . . 3.460 3.303 2.554 3.412 . 0 0 "[ . 1 . ]" 1
1133 1 40 GLU QG 1 141 LEU QD . . 3.130 2.416 1.908 3.055 . 0 0 "[ . 1 . ]" 1
1134 1 42 LEU QD 1 46 GLU QB . . 3.290 3.316 2.092 4.804 1.514 13 6 "[ . 1* + * *-*]" 1
1135 1 43 LYS QG 1 46 GLU QG . . 4.760 4.770 3.755 6.408 1.648 11 3 "[ -. *1+ . ]" 1
1136 1 133 LEU HA 1 135 ASN H . . 4.690 4.367 4.187 4.601 . 0 0 "[ . 1 . ]" 1
1137 1 112 MET HA 1 115 PHE QB . . 3.850 3.312 3.029 3.533 . 0 0 "[ . 1 . ]" 1
1138 1 112 MET HA 1 112 MET QG . . 3.960 2.620 2.079 2.806 . 0 0 "[ . 1 . ]" 1
1139 1 112 MET HA 1 112 MET ME . . 3.610 2.200 1.941 2.715 . 0 0 "[ . 1 . ]" 1
1140 1 75 ILE MD 1 112 MET HA . . 3.670 2.806 1.942 3.334 . 0 0 "[ . 1 . ]" 1
1141 1 105 ARG HA 1 105 ARG QG . . 3.560 2.271 2.165 2.544 . 0 0 "[ . 1 . ]" 1
1142 1 133 LEU HA 1 133 LEU HG . . 4.020 2.755 2.138 3.697 . 0 0 "[ . 1 . ]" 1
1143 1 13 ILE MD 1 133 LEU HA . . 4.200 4.356 3.475 5.798 1.598 13 4 "[ . * 1 *+ . - ]" 1
1144 1 133 LEU HA 1 133 LEU MD2 . . 4.190 2.661 1.980 3.880 . 0 0 "[ . 1 . ]" 1
1145 1 133 LEU HA 1 133 LEU MD1 . . 4.190 3.510 2.047 3.964 . 0 0 "[ . 1 . ]" 1
1146 1 39 LEU HA 1 39 LEU MD2 . . 3.830 3.862 3.722 4.108 0.278 4 0 "[ . 1 . ]" 1
1147 1 139 SER HA 1 140 ASP QB . . 4.560 4.381 4.230 4.756 0.196 17 0 "[ . 1 . ]" 1
1148 1 39 LEU H 1 39 LEU MD2 . . 3.480 2.586 2.318 3.236 . 0 0 "[ . 1 . ]" 1
1149 1 144 LYS H 1 144 LYS HG3 . . 4.570 4.583 4.385 4.688 0.118 5 0 "[ . 1 . ]" 1
1150 1 39 LEU QB 1 39 LEU MD2 . . 2.550 2.013 1.917 2.084 . 0 0 "[ . 1 . ]" 1
1151 1 45 MET H 1 142 LEU QD . . 3.600 2.987 2.379 3.932 0.332 9 0 "[ . 1 . ]" 1
1152 1 33 PRO QB 1 37 LEU QD . . 3.480 2.342 1.832 4.131 0.651 3 1 "[ + . 1 . ]" 1
1153 1 95 GLU HA 1 95 GLU QG . . 2.780 2.350 2.069 2.512 . 0 0 "[ . 1 . ]" 1
1154 1 35 LYS HA 1 35 LYS QB . . 2.720 2.338 2.153 2.540 . 0 0 "[ . 1 . ]" 1
1155 1 141 LEU HA 1 141 LEU QD . . 2.950 2.165 1.907 2.905 . 0 0 "[ . 1 . ]" 1
1156 1 95 GLU HA 1 95 GLU QB . . 2.550 2.423 2.326 2.526 . 0 0 "[ . 1 . ]" 1
1157 1 40 GLU HB2 1 141 LEU QD . . 3.260 2.523 1.904 3.435 0.175 17 0 "[ . 1 . ]" 1
1158 1 23 THR MG 1 25 LEU HA . . 4.020 3.791 2.996 5.061 1.041 8 5 "[ *-*+ * . ]" 1
1159 1 39 LEU H 1 39 LEU MD1 . . 3.810 3.800 3.687 4.058 0.248 4 0 "[ . 1 . ]" 1
1160 1 39 LEU MD1 1 40 GLU HA . . 2.780 2.976 2.499 3.241 0.461 8 0 "[ . 1 . ]" 1
1161 1 39 LEU QB 1 39 LEU MD1 . . 2.560 2.042 1.976 2.111 . 0 0 "[ . 1 . ]" 1
1162 1 14 VAL QG 1 15 ALA MB . . 2.990 3.224 2.591 4.029 1.039 3 8 "[- + . ** 1 * ** *]" 1
1163 1 14 VAL H 1 14 VAL QG . . 2.950 2.053 1.835 2.515 . 0 0 "[ . 1 . ]" 1
1164 1 14 VAL HA 1 14 VAL QG . . 2.880 2.209 2.071 2.387 . 0 0 "[ . 1 . ]" 1
1165 1 13 ILE MG 1 14 VAL QG . . 2.940 2.783 2.079 3.466 0.526 5 2 "[ +- 1 . ]" 1
1166 1 31 LYS HA 1 31 LYS QG . . 3.680 2.580 2.023 3.354 . 0 0 "[ . 1 . ]" 1
1167 1 14 VAL QG 1 42 LEU HA . . 4.160 3.283 2.339 4.281 0.121 18 0 "[ . 1 . ]" 1
1168 1 121 LEU HA 1 121 LEU HG . . 3.870 3.004 2.665 3.576 . 0 0 "[ . 1 . ]" 1
1169 1 41 VAL HA 1 41 VAL QG . . 2.930 2.188 2.065 2.447 . 0 0 "[ . 1 . ]" 1
1170 1 40 GLU QG 1 41 VAL QG . . 3.430 2.080 1.849 2.545 . 0 0 "[ . 1 . ]" 1
1171 1 41 VAL QG 1 141 LEU QB . . 3.100 3.031 1.948 3.853 0.753 12 3 "[ . -* 1 + . ]" 1
1172 1 17 ALA HA 1 133 LEU QB . . 4.300 3.166 2.042 5.345 1.045 13 1 "[ . 1 + . ]" 1
1173 1 119 VAL H 1 119 VAL QG . . 2.880 2.058 1.826 2.230 . 0 0 "[ . 1 . ]" 1
1174 1 20 PHE HZ 1 119 VAL QG . . 3.170 3.749 2.021 6.212 3.042 12 7 "[ * . ** 1 +* . * -]" 1
1175 1 116 ILE HA 1 119 VAL QG . . 3.270 2.538 1.823 3.004 . 0 0 "[ . 1 . ]" 1
1176 1 119 VAL HA 1 119 VAL QG . . 2.860 2.126 2.071 2.350 . 0 0 "[ . 1 . ]" 1
1177 1 17 ALA HA 1 133 LEU MD2 . . 4.750 2.949 1.903 4.662 . 0 0 "[ . 1 . ]" 1
1178 1 17 ALA HA 1 133 LEU MD1 . . 4.750 3.778 2.439 5.071 0.321 15 0 "[ . 1 . ]" 1
1179 1 15 ALA HA 1 19 ASN H . . 5.300 4.257 3.667 4.596 . 0 0 "[ . 1 . ]" 1
1180 1 110 GLU HA 1 111 PRO QD . . 3.270 2.194 2.159 2.227 . 0 0 "[ . 1 . ]" 1
1181 1 47 ALA HA 1 50 ARG QB . . 3.360 2.962 2.316 3.839 0.479 1 0 "[ . 1 . ]" 1
1182 1 26 ASP HA 1 27 ALA MB . . 5.070 5.000 4.966 5.033 . 0 0 "[ . 1 . ]" 1
1183 1 14 VAL QG 1 15 ALA HA . . 3.580 3.243 2.986 3.725 0.145 3 0 "[ . 1 . ]" 1
1184 1 16 VAL H 1 16 VAL QG . . 2.970 2.098 1.779 2.543 . 0 0 "[ . 1 . ]" 1
1185 1 27 ALA HA 1 28 ASP HA . . 4.820 4.742 4.695 4.853 0.033 14 0 "[ . 1 . ]" 1
1186 1 16 VAL HA 1 16 VAL QG . . 3.260 2.154 2.038 2.279 . 0 0 "[ . 1 . ]" 1
1187 1 16 VAL QG 1 62 LEU QB . . 3.130 2.355 1.765 3.567 0.437 7 0 "[ . 1 . ]" 1
1188 1 13 ILE QG 1 16 VAL QG . . 3.130 3.232 2.560 3.966 0.836 2 6 "[ + * * -** ]" 1
1189 1 27 ALA MB 1 28 ASP HA . . 4.070 3.820 3.760 3.878 . 0 0 "[ . 1 . ]" 1
1190 1 16 VAL QG 1 133 LEU MD2 . . 3.730 2.661 2.087 3.763 0.033 12 0 "[ . 1 . ]" 1
1191 1 68 THR MG 1 98 VAL H . . 4.330 4.519 2.028 5.955 1.625 4 8 "[ +* - 1*** .** ]" 1
1192 1 68 THR H 1 68 THR MG . . 3.510 2.179 1.912 2.790 . 0 0 "[ . 1 . ]" 1
1193 1 11 PHE QE 1 16 VAL QG . . 4.110 3.521 2.956 4.581 0.471 5 0 "[ . 1 . ]" 1
1194 1 68 THR MG 1 114 GLN QE . . 3.850 2.470 1.846 3.047 . 0 0 "[ . 1 . ]" 1
1195 1 68 THR HG1 1 68 THR MG . . 3.430 2.090 2.002 2.397 . 0 0 "[ . 1 . ]" 1
1196 1 67 CYS HA 1 68 THR MG . . 4.460 3.296 3.075 3.473 . 0 0 "[ . 1 . ]" 1
1197 1 117 ALA HA 1 120 ASP HB2 . . 3.750 3.342 2.514 3.895 0.145 1 0 "[ . 1 . ]" 1
1198 1 117 ALA HA 1 120 ASP HB3 . . 3.910 3.530 2.658 4.095 0.185 6 0 "[ . 1 . ]" 1
1199 1 68 THR MG 1 69 PRO QD . . 4.460 3.317 2.843 3.492 . 0 0 "[ . 1 . ]" 1
1200 1 70 LYS QG 1 95 GLU QG . . 5.380 10.744 4.671 14.636 9.256 15 17 "[** ** ********+*-**]" 1
1201 1 68 THR MG 1 98 VAL QG . . 2.900 2.194 1.709 3.105 0.205 2 0 "[ . 1 . ]" 1
1202 1 123 VAL QG 1 124 ASP HA . . 3.950 3.801 3.691 3.956 0.006 2 0 "[ . 1 . ]" 1
1203 1 116 ILE MG 1 117 ALA HA . . 3.970 3.171 2.956 3.393 . 0 0 "[ . 1 . ]" 1
1204 1 68 THR MG 1 97 ILE MG . . 3.040 5.542 1.781 7.095 4.055 13 18 "[***** ******+*****-]" 1
1205 1 68 THR MG 1 100 ILE MD . . 4.590 4.762 4.228 5.169 0.579 19 2 "[ . - . +]" 1
1206 1 126 THR MG 1 127 THR H . . 3.980 3.952 3.820 4.028 0.048 16 0 "[ . 1 . ]" 1
1207 1 126 THR MG 1 128 GLY H . . 4.770 4.588 4.465 4.649 . 0 0 "[ . 1 . ]" 1
1208 1 11 PHE QE 1 59 LEU QD . . 3.670 2.199 1.887 2.677 . 0 0 "[ . 1 . ]" 1
1209 1 11 PHE HZ 1 59 LEU QD . . 3.690 2.103 1.823 2.787 . 0 0 "[ . 1 . ]" 1
1210 1 10 ASP HA 1 11 PHE QD . . 4.970 4.826 4.360 5.098 0.128 10 0 "[ . 1 . ]" 1
1211 1 126 THR HG1 1 126 THR MG . . 3.460 2.123 1.985 2.301 . 0 0 "[ . 1 . ]" 1
1212 1 125 CYS HA 1 126 THR MG . . 4.310 3.422 3.329 3.493 . 0 0 "[ . 1 . ]" 1
1213 1 55 THR MG 1 56 ARG H . . 3.740 2.734 1.958 3.533 . 0 0 "[ . 1 . ]" 1
1214 1 55 THR MG 1 57 GLY H . . 4.270 3.797 2.832 4.266 . 0 0 "[ . 1 . ]" 1
1215 1 10 ASP HA 1 11 PHE H . . 3.240 2.877 2.510 3.556 0.316 12 0 "[ . 1 . ]" 1
1216 1 108 ASP HA 1 114 GLN QE . . 4.440 4.578 3.761 5.416 0.976 19 9 "[ *- * *** * *+]" 1
1217 1 55 THR HA 1 55 THR MG . . 3.450 2.086 1.975 2.175 . 0 0 "[ . 1 . ]" 1
1218 1 66 LYS HA 1 66 LYS QD . . 3.380 2.886 2.057 3.741 0.361 13 0 "[ . 1 . ]" 1
1219 1 10 ASP HA 1 10 ASP QB . . 2.580 2.519 2.409 2.536 . 0 0 "[ . 1 . ]" 1
1220 1 65 ILE MG 1 66 LYS HA . . 3.820 3.726 3.612 3.818 . 0 0 "[ . 1 . ]" 1
1221 1 133 LEU H 1 133 LEU MD2 . . 4.090 3.787 1.909 4.363 0.273 4 0 "[ . 1 . ]" 1
1222 1 107 LYS QD 1 108 ASP HA . . 3.600 3.917 2.827 6.056 2.456 2 6 "[*+ . -1 *** ]" 1
1223 1 127 THR HA 1 127 THR MG . . 3.030 2.083 1.950 2.228 . 0 0 "[ . 1 . ]" 1
1224 1 127 THR MG 1 130 LEU QB . . 3.780 4.032 3.475 4.267 0.487 9 0 "[ . 1 . ]" 1
1225 1 127 THR MG 1 130 LEU HG . . 3.570 4.709 3.606 5.403 1.833 3 17 "[**+** ********* *-*]" 1
1226 1 20 PHE QE 1 119 VAL QG . . 3.210 2.965 1.843 4.581 1.371 12 3 "[ . 1 +* . - ]" 1
1227 1 151 ALA HA 1 152 THR H . . 3.480 2.863 2.325 3.571 0.091 16 0 "[ . 1 . ]" 1
1228 1 143 LYS QB 1 151 ALA HA . . 3.710 4.541 1.972 7.986 4.276 10 10 "[ * *.* * +** * *- ]" 1
1229 1 22 THR H 1 22 THR MG . . 3.100 1.998 1.920 2.144 . 0 0 "[ . 1 . ]" 1
1230 1 15 ALA H 1 81 THR MG . . 4.540 4.320 3.865 6.833 2.293 11 1 "[ . 1+ . ]" 1
1231 1 26 ASP QB 1 27 ALA HA . . 4.360 4.194 3.833 4.587 0.227 2 0 "[ . 1 . ]" 1
1232 1 123 VAL QG 1 124 ASP H . . 3.580 3.452 3.351 3.665 0.085 2 0 "[ . 1 . ]" 1
1233 1 123 VAL H 1 123 VAL QG . . 2.750 1.998 1.863 2.423 . 0 0 "[ . 1 . ]" 1
1234 1 41 VAL QG 1 145 TRP HD1 . . 3.230 2.694 2.169 3.524 0.294 9 0 "[ . 1 . ]" 1
1235 1 122 CYS HA 1 123 VAL QG . . 3.660 3.584 3.374 3.745 0.085 12 0 "[ . 1 . ]" 1
1236 1 121 LEU HA 1 123 VAL QG . . 3.430 3.366 2.746 3.608 0.178 9 0 "[ . 1 . ]" 1
1237 1 123 VAL HA 1 123 VAL QG . . 2.680 2.216 2.114 2.332 . 0 0 "[ . 1 . ]" 1
1238 1 41 VAL QG 1 43 LYS H . . 4.460 4.594 4.280 4.888 0.428 8 0 "[ . 1 . ]" 1
1239 1 23 THR H 1 23 THR MG . . 3.540 2.732 2.075 3.977 0.437 6 0 "[ . 1 . ]" 1
1240 1 48 ASN QB 1 136 VAL QG . . 3.310 2.133 1.834 3.525 0.215 11 0 "[ . 1 . ]" 1
1241 1 14 VAL QG 1 45 MET QG . . 4.190 3.390 2.199 4.905 0.715 5 2 "[ + - . ]" 1
1242 1 136 VAL H 1 136 VAL QG . . 3.050 1.979 1.805 2.361 . 0 0 "[ . 1 . ]" 1
1243 1 26 ASP HA 1 27 ALA HA . . 5.100 4.786 4.716 4.869 . 0 0 "[ . 1 . ]" 1
1244 1 102 ALA HA 1 103 ILE HA . . 4.720 4.465 4.446 4.506 . 0 0 "[ . 1 . ]" 1
1245 1 136 VAL HA 1 136 VAL QG . . 2.900 2.218 2.049 2.299 . 0 0 "[ . 1 . ]" 1
1246 1 11 PHE HA 1 11 PHE HB2 . . 2.780 2.351 2.308 2.381 . 0 0 "[ . 1 . ]" 1
1247 1 100 ILE MG 1 102 ALA HA . . 4.500 4.046 3.861 4.476 . 0 0 "[ . 1 . ]" 1
1248 1 101 PRO HG2 1 102 ALA HA . . 4.570 4.423 4.246 4.535 . 0 0 "[ . 1 . ]" 1
1249 1 51 LYS QG 1 52 ALA HA . . 4.050 3.926 3.477 4.524 0.474 18 0 "[ . 1 . ]" 1
1250 1 51 LYS H 1 52 ALA HA . . 5.180 5.254 5.099 5.343 0.163 5 0 "[ . 1 . ]" 1
1251 1 96 ALA HA 1 97 ILE H . . 2.400 2.309 2.149 2.632 0.232 15 0 "[ . 1 . ]" 1
1252 1 96 ALA HA 1 97 ILE HB . . 4.410 4.683 4.362 5.048 0.638 6 2 "[ .+ 1 - ]" 1
1253 1 96 ALA HA 1 97 ILE MD . . 3.900 3.000 2.445 5.519 1.619 2 1 "[ + . 1 . ]" 1
1254 1 21 ALA MB 1 22 THR H . . 3.620 2.956 2.298 3.394 . 0 0 "[ . 1 . ]" 1
1255 1 21 ALA H 1 21 ALA MB . . 3.120 2.239 2.027 2.911 . 0 0 "[ . 1 . ]" 1
1256 1 21 ALA MB 1 22 THR HA . . 4.270 4.211 4.011 4.317 0.047 12 0 "[ . 1 . ]" 1
1257 1 18 SER HA 1 21 ALA MB . . 3.610 2.989 2.282 4.886 1.276 11 2 "[ .- 1+ . ]" 1
1258 1 21 ALA MB 1 22 THR MG . . 3.690 4.128 3.342 4.551 0.861 19 9 "[ ** ** 1** * -+]" 1
1259 1 13 ILE H 1 13 ILE MG . . 3.820 2.362 1.932 3.007 . 0 0 "[ . 1 . ]" 1
1260 1 13 ILE MG 1 46 GLU H . . 4.250 2.306 2.014 2.582 . 0 0 "[ . 1 . ]" 1
1261 1 13 ILE MG 1 47 ALA H . . 5.080 4.529 4.277 5.128 0.048 10 0 "[ . 1 . ]" 1
1262 1 11 PHE QD 1 13 ILE MG . . 4.820 5.020 4.604 5.805 0.985 2 5 "[ + *. * * - . ]" 1
1263 1 12 ASN QD 1 13 ILE MG . . 5.120 5.462 3.738 6.844 1.724 12 6 "[ * * *- + . *]" 1
1264 1 13 ILE MG 1 46 GLU HA . . 3.740 2.993 2.444 3.776 0.036 17 0 "[ . 1 . ]" 1
1265 1 13 ILE MG 1 46 GLU QB . . 3.400 2.260 1.927 3.831 0.431 10 0 "[ . 1 . ]" 1
1266 1 13 ILE QG 1 13 ILE MG . . 3.190 2.363 2.000 2.518 . 0 0 "[ . 1 . ]" 1
1267 1 134 ALA H 1 134 ALA MB . . 2.920 2.207 2.104 2.301 . 0 0 "[ . 1 . ]" 1
1268 1 121 LEU HA 1 122 CYS HA . . 4.880 4.759 4.672 4.888 0.008 11 0 "[ . 1 . ]" 1
1269 1 131 LYS HA 1 134 ALA MB . . 3.090 3.068 2.548 3.498 0.408 18 0 "[ . 1 . ]" 1
1270 1 122 CYS HA 1 123 VAL HA . . 4.620 4.509 4.417 5.340 0.720 11 1 "[ . 1+ . ]" 1
1271 1 20 PHE QB 1 134 ALA MB . . 3.520 3.633 2.381 4.311 0.791 18 5 "[ - * 1 ** . + ]" 1
1272 1 134 ALA MB 1 135 ASN QB . . 4.200 4.162 3.760 4.558 0.358 7 0 "[ . 1 . ]" 1
1273 1 96 ALA H 1 96 ALA MB . . 2.400 2.245 2.047 2.801 0.401 18 0 "[ . 1 . ]" 1
1274 1 102 ALA MB 1 103 ILE H . . 3.330 3.247 3.016 3.348 0.018 13 0 "[ . 1 . ]" 1
1275 1 95 GLU QB 1 96 ALA MB . . 3.520 3.769 3.402 4.271 0.751 18 2 "[ .- 1 . + ]" 1
1276 1 151 ALA MB 1 152 THR H . . 2.670 2.116 1.897 2.563 . 0 0 "[ . 1 . ]" 1
1277 1 103 ILE HA 1 104 PRO HD2 . . 3.580 1.954 1.924 2.041 . 0 0 "[ . 1 . ]" 1
1278 1 103 ILE MG 1 104 PRO HD3 . . 4.090 4.295 3.940 4.510 0.420 5 0 "[ . 1 . ]" 1
1279 1 75 ILE MG 1 112 MET H . . 4.400 4.329 3.512 4.688 0.288 4 0 "[ . 1 . ]" 1
1280 1 75 ILE MG 1 112 MET HA . . 4.470 3.513 3.052 3.908 . 0 0 "[ . 1 . ]" 1
1281 1 71 MET HA 1 75 ILE MG . . 4.430 4.989 4.456 5.455 1.025 7 13 "[* **.*+ *** -**** ]" 1
1282 1 75 ILE MG 1 115 PHE QB . . 4.860 4.611 3.972 5.352 0.492 8 0 "[ . 1 . ]" 1
1283 1 74 PHE HB3 1 75 ILE MG . . 4.130 3.307 2.986 3.525 . 0 0 "[ . 1 . ]" 1
1284 1 75 ILE MG 1 112 MET QG . . 4.250 4.069 2.474 4.735 0.485 4 0 "[ . 1 . ]" 1
1285 1 75 ILE QG 1 75 ILE MG . . 3.050 2.256 2.118 2.359 . 0 0 "[ . 1 . ]" 1
1286 1 151 ALA MB 1 152 THR MG . . 3.450 3.464 2.226 4.249 0.799 2 3 "[-+* . 1 . ]" 1
1287 1 27 ALA MB 1 28 ASP H . . 3.000 2.631 2.370 2.789 . 0 0 "[ . 1 . ]" 1
1288 1 27 ALA H 1 27 ALA MB . . 2.700 2.180 2.028 2.255 . 0 0 "[ . 1 . ]" 1
1289 1 75 ILE MG 1 76 PRO HD3 . . 4.800 4.453 4.406 4.534 . 0 0 "[ . 1 . ]" 1
1290 1 75 ILE MG 1 76 PRO HD2 . . 4.800 3.827 3.643 3.996 . 0 0 "[ . 1 . ]" 1
1291 1 71 MET ME 1 75 ILE MG . . 4.720 4.879 4.410 5.728 1.008 8 3 "[ * + 1 . -]" 1
1292 1 123 VAL QG 1 125 CYS H . . 4.950 4.386 4.226 4.638 . 0 0 "[ . 1 . ]" 1
1293 1 52 ALA MB 1 129 CYS HA . . 3.190 2.716 1.881 3.588 0.398 5 0 "[ . 1 . ]" 1
1294 1 117 ALA MB 1 118 GLN QG . . 3.270 3.083 2.822 3.667 0.397 17 0 "[ . 1 . ]" 1
1295 1 27 ALA MB 1 28 ASP QB . . 3.940 3.868 3.586 4.393 0.453 3 0 "[ . 1 . ]" 1
1296 1 117 ALA MB 1 118 GLN QB . . 4.230 4.222 3.834 4.371 0.141 8 0 "[ . 1 . ]" 1
1297 1 103 ILE HB 1 117 ALA MB . . 3.900 3.893 3.674 4.328 0.428 19 0 "[ . 1 . ]" 1
1298 1 103 ILE MG 1 117 ALA MB . . 2.840 2.657 2.400 3.358 0.518 19 1 "[ . 1 . +]" 1
1299 1 103 ILE MD 1 117 ALA MB . . 2.820 1.911 1.738 2.133 . 0 0 "[ . 1 . ]" 1
1300 1 32 LEU HA 1 33 PRO QD . . 2.670 2.136 2.089 2.180 . 0 0 "[ . 1 . ]" 1
1301 1 100 ILE HA 1 101 PRO QD . . 3.270 1.911 1.883 1.955 . 0 0 "[ . 1 . ]" 1
1302 1 99 ASP QB 1 101 PRO QD . . 4.740 4.626 4.221 5.186 0.446 6 0 "[ . 1 . ]" 1
1303 1 100 ILE HB 1 101 PRO QD . . 5.040 3.892 3.612 4.072 . 0 0 "[ . 1 . ]" 1
1304 1 52 ALA MB 1 132 GLY H . . 3.450 3.630 3.208 4.016 0.566 19 1 "[ . 1 . +]" 1
1305 1 32 LEU H 1 33 PRO QD . . 4.430 4.255 4.054 4.374 . 0 0 "[ . 1 . ]" 1
1306 1 52 ALA H 1 52 ALA MB . . 2.770 2.168 2.058 2.260 . 0 0 "[ . 1 . ]" 1
1307 1 49 ALA HA 1 52 ALA MB . . 3.030 2.953 2.510 3.367 0.337 6 0 "[ . 1 . ]" 1
1308 1 52 ALA MB 1 132 GLY QA . . 3.030 2.414 1.852 2.855 . 0 0 "[ . 1 . ]" 1
1309 1 38 PRO QD 1 40 GLU QG . . 4.020 3.715 3.629 3.924 . 0 0 "[ . 1 . ]" 1
1310 1 76 PRO HD3 1 77 GLY H . . 5.500 5.589 5.565 5.599 0.099 13 0 "[ . 1 . ]" 1
1311 1 17 ALA H 1 17 ALA MB . . 3.070 2.129 2.026 2.245 . 0 0 "[ . 1 . ]" 1
1312 1 15 ALA H 1 15 ALA MB . . 3.010 2.166 2.037 2.263 . 0 0 "[ . 1 . ]" 1
1313 1 17 ALA MB 1 134 ALA HA . . 4.700 4.857 3.962 6.090 1.390 13 6 "[ .** - *+ . * ]" 1
1314 1 16 VAL HB 1 17 ALA MB . . 3.920 4.157 3.735 4.885 0.965 14 6 "[ -*. **1 +. *]" 1
1315 1 13 ILE MD 1 17 ALA MB . . 2.990 2.699 1.783 4.224 1.234 15 3 "[ . 1 *+ - ]" 1
1316 1 12 ASN QB 1 15 ALA MB . . 3.380 2.635 2.008 3.713 0.333 6 0 "[ . 1 . ]" 1
1317 1 47 ALA MB 1 48 ASN H . . 3.040 2.713 2.560 2.846 . 0 0 "[ . 1 . ]" 1
1318 1 97 ILE MG 1 98 VAL H . . 3.170 2.586 1.863 3.575 0.405 2 0 "[ . 1 . ]" 1
1319 1 47 ALA H 1 47 ALA MB . . 2.670 2.144 2.025 2.241 . 0 0 "[ . 1 . ]" 1
1320 1 97 ILE H 1 97 ILE MG . . 3.210 3.852 2.662 4.015 0.805 18 18 "[* ***-***********+*]" 1
1321 1 44 GLU H 1 47 ALA MB . . 4.620 4.474 4.188 4.929 0.309 9 0 "[ . 1 . ]" 1
1322 1 47 ALA MB 1 48 ASN HA . . 4.030 3.813 3.715 3.878 . 0 0 "[ . 1 . ]" 1
1323 1 69 PRO QD 1 97 ILE HA . . 5.000 4.350 1.842 6.382 1.382 13 5 "[ *. * 1 *+ . - ]" 1
1324 1 44 GLU HA 1 47 ALA MB . . 2.950 2.588 2.086 3.281 0.331 9 0 "[ . 1 . ]" 1
1325 1 46 GLU HA 1 47 ALA MB . . 4.970 4.983 4.951 5.028 0.058 10 0 "[ . 1 . ]" 1
1326 1 47 ALA MB 1 50 ARG QD . . 4.860 4.566 3.288 5.443 0.583 4 3 "[ +. 1* -. ]" 1
1327 1 47 ALA MB 1 48 ASN QB . . 4.460 4.446 4.316 4.539 0.079 16 0 "[ . 1 . ]" 1
1328 1 46 GLU QG 1 47 ALA MB . . 3.550 3.485 3.019 5.162 1.612 10 3 "[ . *+- . ]" 1
1329 1 69 PRO QD 1 72 LYS QG . . 4.760 4.827 4.387 6.034 1.274 14 3 "[ . - 1 +* ]" 1
1330 1 103 ILE MG 1 117 ALA H . . 5.500 5.665 5.503 6.577 1.077 19 1 "[ . 1 . +]" 1
1331 1 49 ALA H 1 49 ALA MB . . 2.960 2.150 2.041 2.243 . 0 0 "[ . 1 . ]" 1
1332 1 103 ILE H 1 103 ILE MG . . 3.790 3.983 3.665 4.012 0.222 10 0 "[ . 1 . ]" 1
1333 1 103 ILE MG 1 106 PHE QD . . 3.230 3.400 2.973 4.197 0.967 19 1 "[ . 1 . +]" 1
1334 1 103 ILE MG 1 104 PRO HA . . 4.760 4.829 4.614 5.449 0.689 19 1 "[ . 1 . +]" 1
1335 1 103 ILE MG 1 117 ALA HA . . 4.400 4.594 4.344 5.052 0.652 19 2 "[ . 1 - . +]" 1
1336 1 97 ILE HA 1 97 ILE MG . . 2.670 2.322 2.089 3.198 0.528 2 1 "[ + . 1 . ]" 1
1337 1 103 ILE MG 1 104 PRO HD2 . . 3.450 3.230 2.805 3.554 0.104 5 0 "[ . 1 . ]" 1
1338 1 103 ILE MG 1 106 PHE HA . . 3.480 3.168 2.780 4.399 0.919 19 1 "[ . 1 . +]" 1
1339 1 46 GLU HA 1 49 ALA MB . . 3.370 2.718 2.407 3.076 . 0 0 "[ . 1 . ]" 1
1340 1 103 ILE MG 1 106 PHE QB . . 3.130 1.968 1.810 3.217 0.087 19 0 "[ . 1 . ]" 1
1341 1 46 GLU QB 1 49 ALA MB . . 3.860 3.880 3.592 4.445 0.585 9 1 "[ . +1 . ]" 1
1342 1 103 ILE MD 1 103 ILE MG . . 2.760 1.952 1.893 2.140 . 0 0 "[ . 1 . ]" 1
1343 1 49 ALA MB 1 59 LEU QD . . 2.790 2.501 1.702 3.067 0.277 10 0 "[ . 1 . ]" 1
1344 1 49 ALA MB 1 50 ARG H . . 3.220 2.480 2.326 2.808 . 0 0 "[ . 1 . ]" 1
1345 1 116 ILE MG 1 119 VAL H . . 4.630 4.668 4.465 4.964 0.334 15 0 "[ . 1 . ]" 1
1346 1 49 ALA MB 1 52 ALA H . . 4.340 4.524 4.348 4.717 0.377 5 0 "[ . 1 . ]" 1
1347 1 48 ASN HA 1 49 ALA MB . . 5.010 5.014 4.981 5.036 0.026 8 0 "[ . 1 . ]" 1
1348 1 49 ALA MB 1 50 ARG HA . . 4.090 3.733 3.624 3.877 . 0 0 "[ . 1 . ]" 1
1349 1 116 ILE HA 1 116 ILE MG . . 3.070 2.542 2.383 2.616 . 0 0 "[ . 1 . ]" 1
1350 1 48 ASN QB 1 49 ALA MB . . 4.110 3.769 3.586 3.876 . 0 0 "[ . 1 . ]" 1
1351 1 49 ALA MB 1 54 CYS QB . . 3.590 2.725 1.980 3.421 . 0 0 "[ . 1 . ]" 1
1352 1 116 ILE MG 1 119 VAL HB . . 3.490 3.751 3.210 5.378 1.888 15 3 "[ * . 1 + - ]" 1
1353 1 49 ALA MB 1 50 ARG QB . . 3.940 3.867 3.662 4.078 0.138 13 0 "[ . 1 . ]" 1
1354 1 17 ALA H 1 45 MET ME . . 4.180 3.732 3.441 4.339 0.159 18 0 "[ . 1 . ]" 1
1355 1 14 VAL H 1 45 MET ME . . 3.620 4.131 3.494 5.077 1.457 11 10 "[ **. *-+** ** *]" 1
1356 1 100 ILE H 1 100 ILE MG . . 3.970 3.833 3.774 3.863 . 0 0 "[ . 1 . ]" 1
1357 1 100 ILE HA 1 100 ILE MG . . 3.120 2.284 2.070 2.492 . 0 0 "[ . 1 . ]" 1
1358 1 45 MET HA 1 45 MET ME . . 3.300 3.812 2.446 4.683 1.383 4 12 "[** +*-** * * .*** ]" 1
1359 1 42 LEU HA 1 45 MET ME . . 4.180 4.898 3.838 5.900 1.720 9 14 "[* * .- *+******** *]" 1
1360 1 45 MET ME 1 46 GLU HA . . 4.410 5.200 4.034 6.733 2.323 18 12 "[*- ** ** * ** .**+ ]" 1
1361 1 100 ILE MG 1 101 PRO QD . . 3.280 1.949 1.830 2.178 . 0 0 "[ . 1 . ]" 1
1362 1 14 VAL HA 1 45 MET ME . . 2.930 2.177 1.877 3.502 0.572 11 1 "[ . 1+ . ]" 1
1363 1 100 ILE MG 1 118 GLN QG . . 4.420 4.079 3.367 6.099 1.679 3 2 "[ + . 1 . - ]" 1
1364 1 45 MET ME 1 48 ASN QB . . 4.390 5.219 3.176 7.034 2.644 18 13 "[** ****- * ** .**+ ]" 1
1365 1 45 MET QB 1 45 MET ME . . 2.860 2.291 1.924 3.021 0.161 18 0 "[ . 1 . ]" 1
1366 1 100 ILE MG 1 103 ILE HB . . 3.420 3.008 2.350 4.062 0.642 19 1 "[ . 1 . +]" 1
1367 1 100 ILE MG 1 121 LEU HG . . 3.950 3.878 2.515 4.238 0.288 15 0 "[ . 1 . ]" 1
1368 1 17 ALA MB 1 45 MET ME . . 2.540 1.957 1.768 2.808 0.268 18 0 "[ . 1 . ]" 1
1369 1 100 ILE MG 1 102 ALA MB . . 2.900 2.583 2.280 2.794 . 0 0 "[ . 1 . ]" 1
1370 1 13 ILE MG 1 45 MET ME . . 3.080 2.843 1.761 3.664 0.584 4 1 "[ +. 1 . ]" 1
1371 1 13 ILE MD 1 45 MET ME . . 2.400 2.995 1.776 5.523 3.123 18 11 "[ - ** * * * ****+ ]" 1
1372 1 100 ILE MD 1 100 ILE MG . . 2.550 2.005 1.853 2.511 . 0 0 "[ . 1 . ]" 1
1373 1 71 MET ME 1 112 MET H . . 5.500 5.659 5.256 6.242 0.742 1 2 "[+ - 1 . ]" 1
1374 1 71 MET ME 1 116 ILE H . . 4.540 4.724 4.399 5.103 0.563 10 2 "[ - + . ]" 1
1375 1 71 MET ME 1 118 GLN QE . . 3.220 2.799 2.437 3.726 0.506 6 1 "[ .+ 1 . ]" 1
1376 1 71 MET ME 1 115 PHE H . . 3.780 2.765 2.448 3.166 . 0 0 "[ . 1 . ]" 1
1377 1 112 MET ME 1 115 PHE QE . . 3.710 3.826 3.504 4.410 0.700 10 2 "[ . +- . ]" 1
1378 1 71 MET ME 1 115 PHE QD . . 3.080 2.948 2.253 3.297 0.217 5 0 "[ . 1 . ]" 1
1379 1 112 MET ME 1 115 PHE QD . . 3.140 2.510 2.186 3.155 0.015 11 0 "[ . 1 . ]" 1
1380 1 67 CYS HA 1 71 MET ME . . 3.490 3.040 2.032 3.349 . 0 0 "[ . 1 . ]" 1
1381 1 71 MET ME 1 112 MET HA . . 4.420 4.667 4.185 5.413 0.993 5 5 "[* + * . - *]" 1
1382 1 71 MET ME 1 115 PHE HA . . 3.250 2.462 1.948 2.987 . 0 0 "[ . 1 . ]" 1
1383 1 71 MET ME 1 115 PHE QB . . 2.950 2.060 1.877 2.560 . 0 0 "[ . 1 . ]" 1
1384 1 112 MET ME 1 115 PHE QB . . 3.680 2.579 2.340 2.875 . 0 0 "[ . 1 . ]" 1
1385 1 112 MET ME 1 116 ILE HA . . 4.890 4.940 4.676 5.163 0.273 9 0 "[ . 1 . ]" 1
1386 1 112 MET ME 1 112 MET QG . . 2.780 2.110 2.008 2.232 . 0 0 "[ . 1 . ]" 1
1387 1 71 MET ME 1 111 PRO QB . . 4.160 4.197 3.859 4.862 0.702 1 1 "[+ . 1 . ]" 1
1388 1 68 THR MG 1 71 MET ME . . 3.670 3.358 2.035 4.320 0.650 7 2 "[ .-+ 1 . ]" 1
1389 1 71 MET ME 1 78 ARG QG . . 4.460 4.631 2.569 5.512 1.052 5 10 "[ ***+ ** *- **. ]" 1
1390 1 71 MET ME 1 114 GLN QG . . 4.460 4.136 1.870 5.026 0.566 11 2 "[ . 1+ - . ]" 1
1391 1 78 ARG QG 1 112 MET ME . . 3.980 4.235 3.323 4.997 1.017 16 6 "[ **- 1* * .+ ]" 1
1392 1 71 MET ME 1 75 ILE MD . . 3.160 2.345 1.880 3.287 0.127 8 0 "[ . 1 . ]" 1
1393 1 112 MET H 1 112 MET ME . . 4.510 4.557 4.276 4.953 0.443 6 0 "[ . 1 . ]" 1
1394 1 78 ARG HE 1 112 MET ME . . 3.750 3.296 1.910 4.354 0.604 18 1 "[ . 1 . + ]" 1
1395 1 65 ILE MG 1 118 GLN QE . . 3.580 2.975 2.063 3.570 . 0 0 "[ . 1 . ]" 1
1396 1 65 ILE MG 1 66 LYS H . . 3.380 2.394 2.187 3.180 . 0 0 "[ . 1 . ]" 1
1397 1 65 ILE HA 1 65 ILE MG . . 3.290 2.555 2.443 3.125 . 0 0 "[ . 1 . ]" 1
1398 1 65 ILE MG 1 71 MET ME . . 3.880 3.988 3.722 4.296 0.416 8 0 "[ . 1 . ]" 1
1399 1 11 PHE QD 1 59 LEU QD . . 3.950 3.607 3.105 4.265 0.315 11 0 "[ . 1 . ]" 1
1400 1 20 PHE QD 1 119 VAL QG . . 4.260 4.044 3.280 5.431 1.171 17 2 "[ . 1 - . + ]" 1
1401 1 115 PHE QB 1 116 ILE MD . . 4.440 2.624 2.297 3.942 . 0 0 "[ . 1 . ]" 1
1402 1 112 MET HB2 1 116 ILE MD . . 4.680 4.734 4.367 4.921 0.241 19 0 "[ . 1 . ]" 1
1403 1 13 ILE H 1 13 ILE MD . . 4.960 4.296 4.150 4.448 . 0 0 "[ . 1 . ]" 1
1404 1 13 ILE MD 1 45 MET H . . 4.860 5.251 4.363 6.483 1.623 14 9 "[ * * * 1 * +**-* ]" 1
1405 1 13 ILE MD 1 47 ALA H . . 5.160 5.123 4.524 5.868 0.708 10 1 "[ . + . ]" 1
1406 1 13 ILE MD 1 49 ALA H . . 4.360 4.163 3.579 4.686 0.326 6 0 "[ . 1 . ]" 1
1407 1 13 ILE MD 1 16 VAL H . . 4.720 4.755 3.805 5.527 0.807 17 3 "[ . 1 -* + ]" 1
1408 1 13 ILE MD 1 14 VAL H . . 4.690 4.119 3.506 5.036 0.346 18 0 "[ . 1 . ]" 1
1409 1 13 ILE MD 1 133 LEU HG . . 4.680 3.958 2.842 5.314 0.634 13 1 "[ . 1 + . ]" 1
1410 1 13 ILE MD 1 13 ILE MG . . 3.010 2.084 1.798 3.159 0.149 14 0 "[ . 1 . ]" 1
1411 1 59 LEU H 1 60 ILE MD . . 4.960 4.829 4.079 5.592 0.632 13 1 "[ . 1 + . ]" 1
1412 1 63 SER HA 1 65 ILE MD . . 4.710 4.732 4.374 5.523 0.813 11 2 "[ . 1+ . - ]" 1
1413 1 11 PHE HB3 1 60 ILE MD . . 4.930 3.438 2.130 4.478 . 0 0 "[ . 1 . ]" 1
1414 1 65 ILE MD 1 118 GLN QB . . 4.200 2.545 2.001 2.996 . 0 0 "[ . 1 . ]" 1
1415 1 63 SER H 1 65 ILE MD . . 5.250 4.816 4.452 5.719 0.469 17 0 "[ . 1 . ]" 1
1416 1 65 ILE MD 1 115 PHE HA . . 4.320 4.661 4.034 5.421 1.101 11 6 "[ - . * 1+ **. *]" 1
1417 1 65 ILE MD 1 115 PHE QB . . 5.340 5.474 4.821 6.309 0.969 11 2 "[ . - 1+ . ]" 1
1418 1 65 ILE MD 1 118 GLN QG . . 4.750 4.074 1.924 4.790 0.040 16 0 "[ . 1 . ]" 1
1419 1 103 ILE MD 1 114 GLN HA . . 4.380 4.771 4.404 5.157 0.777 10 5 "[* * .* + -. ]" 1
1420 1 100 ILE MD 1 117 ALA H . . 5.500 6.730 5.482 7.491 1.991 10 17 "[**-** ***+***** ***]" 1
1421 1 99 ASP H 1 100 ILE MD . . 4.920 4.700 3.709 5.834 0.914 16 3 "[ * .- 1 .+ ]" 1
1422 1 100 ILE MD 1 118 GLN HA . . 4.430 3.508 2.654 4.201 . 0 0 "[ . 1 . ]" 1
1423 1 100 ILE MG 1 106 PHE HZ . . 5.500 5.853 5.471 6.238 0.738 13 6 "[ * *. * *1 + . - ]" 1
1424 1 100 ILE MG 1 103 ILE HA . . 5.060 4.230 3.873 4.945 . 0 0 "[ . 1 . ]" 1
1425 1 100 ILE MG 1 103 ILE MD . . 2.730 2.310 2.075 2.922 0.192 3 0 "[ . 1 . ]" 1
1426 1 100 ILE MG 1 106 PHE QE . . 4.780 4.917 4.532 5.085 0.305 2 0 "[ . 1 . ]" 1
1427 1 65 ILE MG 1 115 PHE HA . . 4.110 3.919 3.205 5.247 1.137 17 1 "[ . 1 . + ]" 1
1428 1 65 ILE MG 1 118 GLN QB . . 3.730 2.369 1.871 4.259 0.529 17 1 "[ . 1 . + ]" 1
1429 1 60 ILE MG 1 64 HIS H . . 4.730 3.936 3.702 4.254 . 0 0 "[ . 1 . ]" 1
1430 1 11 PHE QD 1 60 ILE MG . . 4.640 4.818 4.102 5.422 0.782 10 4 "[* . + - . * ]" 1
1431 1 60 ILE MG 1 64 HIS HB2 . . 4.210 3.310 3.092 3.845 . 0 0 "[ . 1 . ]" 1
1432 1 60 ILE HA 1 60 ILE MG . . 3.390 2.481 2.320 2.675 . 0 0 "[ . 1 . ]" 1
1433 1 56 ARG QD 1 60 ILE MG . . 5.070 5.100 3.586 6.452 1.382 16 3 "[ . - 1 *.+ ]" 1
1434 1 10 ASP QB 1 60 ILE MG . . 4.650 4.671 3.414 5.172 0.522 13 1 "[ . 1 + . ]" 1
1435 1 60 ILE QG 1 60 ILE MG . . 2.810 2.157 2.045 2.349 . 0 0 "[ . 1 . ]" 1
1436 1 121 LEU H 1 123 VAL QG . . 4.890 4.705 4.112 5.197 0.307 10 0 "[ . 1 . ]" 1
1437 1 121 LEU QB 1 123 VAL QG . . 4.680 4.304 3.880 4.517 . 0 0 "[ . 1 . ]" 1
1438 1 74 PHE H 1 75 ILE MG . . 4.950 4.890 4.664 5.119 0.169 19 0 "[ . 1 . ]" 1
1439 1 75 ILE MG 1 78 ARG H . . 5.500 5.647 5.521 5.905 0.405 17 0 "[ . 1 . ]" 1
1440 1 74 PHE QD 1 75 ILE MG . . 4.940 4.735 4.464 4.833 . 0 0 "[ . 1 . ]" 1
1441 1 75 ILE MG 1 115 PHE QD . . 5.380 5.441 4.760 6.297 0.917 8 2 "[ . + - . ]" 1
1442 1 75 ILE MG 1 78 ARG HE . . 4.250 4.189 2.265 5.550 1.300 18 5 "[ * . - * .* + ]" 1
1443 1 26 ASP HA 1 29 ARG H . . 3.930 3.421 3.117 3.845 . 0 0 "[ . 1 . ]" 1
1444 1 23 THR HB 1 26 ASP HA . . 5.500 8.708 5.115 10.395 4.895 11 16 "[****. * *-+********]" 1
1445 1 26 ASP HA 1 29 ARG QD . . 4.790 3.731 1.985 4.823 0.033 2 0 "[ . 1 . ]" 1
1446 1 26 ASP HA 1 29 ARG QB . . 3.980 2.574 1.979 3.287 . 0 0 "[ . 1 . ]" 1
1447 1 25 LEU QB 1 26 ASP HA . . 4.320 4.250 3.745 4.720 0.400 3 0 "[ . 1 . ]" 1
1448 1 20 PHE QB 1 21 ALA MB . . 4.200 4.058 3.781 4.197 . 0 0 "[ . 1 . ]" 1
1449 1 150 CYS HA 1 151 ALA MB . . 5.290 3.995 3.683 4.260 . 0 0 "[ . 1 . ]" 1
1450 1 151 ALA MB 1 153 PHE HA . . 5.070 4.762 3.872 5.507 0.437 7 0 "[ . 1 . ]" 1
1451 1 150 CYS HB3 1 151 ALA MB . . 5.140 4.193 3.308 4.766 . 0 0 "[ . 1 . ]" 1
1452 1 150 CYS HB2 1 151 ALA MB . . 5.140 4.718 3.379 5.483 0.343 2 0 "[ . 1 . ]" 1
1453 1 102 ALA MB 1 103 ILE HA . . 4.370 4.273 4.150 4.304 . 0 0 "[ . 1 . ]" 1
1454 1 35 LYS HA 1 82 TYR QB . . 5.230 3.888 2.205 6.353 1.123 1 1 "[+ . 1 . ]" 1
1455 1 12 ASN QB 1 16 VAL HB . . 5.500 5.672 4.636 6.477 0.977 19 6 "[ *. **1 -*. +]" 1
1456 1 36 LYS H 1 82 TYR QB . . 5.500 3.150 2.181 4.403 . 0 0 "[ . 1 . ]" 1
1457 1 12 ASN QD 1 82 TYR QB . . 5.340 5.440 3.930 6.748 1.408 17 5 "[ ** 1 *-+ ]" 1
1458 1 15 ALA HA 1 82 TYR QB . . 5.360 4.731 2.766 6.406 1.046 9 4 "[* . +1 . * -]" 1
1459 1 81 THR H 1 82 TYR HA . . 5.250 5.414 5.114 5.694 0.444 11 0 "[ . 1 . ]" 1
1460 1 116 ILE H 1 116 ILE MG . . 3.730 3.684 3.630 3.759 0.029 6 0 "[ . 1 . ]" 1
1461 1 116 ILE MG 1 117 ALA H . . 3.370 3.179 2.863 3.399 0.029 6 0 "[ . 1 . ]" 1
1462 1 115 PHE QD 1 116 ILE MG . . 5.220 5.036 4.665 5.258 0.038 18 0 "[ . 1 . ]" 1
1463 1 113 GLU HA 1 116 ILE MG . . 3.820 3.830 3.526 4.202 0.382 4 0 "[ . 1 . ]" 1
1464 1 116 ILE MG 1 120 ASP HB2 . . 4.210 3.049 2.386 3.629 . 0 0 "[ . 1 . ]" 1
1465 1 123 VAL HA 1 124 ASP HA . . 5.120 4.536 4.452 4.617 . 0 0 "[ . 1 . ]" 1
1466 1 123 VAL HB 1 124 ASP HA . . 4.770 4.720 4.659 4.808 0.038 11 0 "[ . 1 . ]" 1
1467 1 29 ARG HA 1 31 LYS H . . 4.650 4.671 3.615 5.472 0.822 6 5 "[ * .+ 1 * .* - ]" 1
1468 1 142 LEU HA 1 144 LYS H . . 5.340 4.149 3.908 4.415 . 0 0 "[ . 1 . ]" 1
1469 1 29 ARG HA 1 30 GLY QA . . 4.980 4.342 4.190 4.506 . 0 0 "[ . 1 . ]" 1
1470 1 100 ILE H 1 104 PRO HA . . 5.080 4.607 3.835 5.803 0.723 19 1 "[ . 1 . +]" 1
1471 1 104 PRO HA 1 105 ARG HA . . 5.500 4.737 4.673 4.787 . 0 0 "[ . 1 . ]" 1
1472 1 99 ASP QB 1 101 PRO HA . . 5.180 5.201 4.968 5.596 0.416 3 0 "[ . 1 . ]" 1
1473 1 99 ASP QB 1 104 PRO HA . . 5.500 5.298 4.625 6.721 1.221 19 2 "[ . 1 - . +]" 1
1474 1 136 VAL QG 1 137 GLN H . . 3.660 2.240 1.912 3.151 . 0 0 "[ . 1 . ]" 1
1475 1 48 ASN QD 1 136 VAL QG . . 3.400 2.545 1.847 3.289 . 0 0 "[ . 1 . ]" 1
1476 1 71 MET ME 1 114 GLN H . . 4.780 4.554 4.064 5.134 0.354 13 0 "[ . 1 . ]" 1
1477 1 68 THR HG1 1 71 MET ME . . 5.140 4.197 2.813 4.831 . 0 0 "[ . 1 . ]" 1
1478 1 71 MET HA 1 71 MET ME . . 4.220 4.311 3.832 4.861 0.641 6 3 "[* -+ 1 . ]" 1
1479 1 71 MET ME 1 118 GLN QG . . 3.610 4.411 3.521 5.627 2.017 11 12 "[** *. * **+**-** ]" 1
1480 1 114 GLN QB 1 116 ILE H . . 5.500 4.716 4.537 4.892 . 0 0 "[ . 1 . ]" 1
1481 1 113 GLU H 1 114 GLN QB . . 5.500 4.391 4.252 4.589 . 0 0 "[ . 1 . ]" 1
1482 1 111 PRO HA 1 114 GLN QB . . 5.500 2.563 2.312 2.956 . 0 0 "[ . 1 . ]" 1
1483 1 71 MET ME 1 114 GLN QB . . 5.500 2.670 2.158 3.298 . 0 0 "[ . 1 . ]" 1
1484 1 111 PRO QB 1 114 GLN QB . . 4.700 4.132 3.946 4.376 . 0 0 "[ . 1 . ]" 1
1485 1 109 LEU QB 1 114 GLN QB . . 4.010 4.289 3.125 4.915 0.905 5 6 "[* * +* 1 - .* ]" 1
1486 1 114 GLN QB 1 118 GLN QG . . 4.010 4.403 3.747 5.007 0.997 19 8 "[* * . - *** .* +]" 1
1487 1 68 THR MG 1 114 GLN QB . . 5.500 3.341 2.739 4.588 . 0 0 "[ . 1 . ]" 1
1488 1 113 GLU QB 1 114 GLN H . . 5.320 2.739 2.623 2.845 . 0 0 "[ . 1 . ]" 1
1489 1 109 LEU H 1 113 GLU QB . . 5.500 5.721 5.516 6.255 0.755 7 3 "[ . + 1 . * -]" 1
1490 1 109 LEU HA 1 113 GLU QB . . 5.120 4.683 4.346 4.916 . 0 0 "[ . 1 . ]" 1
1491 1 72 LYS HA 1 76 PRO QB . . 5.500 4.299 3.593 5.361 . 0 0 "[ . 1 . ]" 1
1492 1 112 MET HB3 1 113 GLU QB . . 4.010 4.011 3.761 4.601 0.591 16 1 "[ . 1 .+ ]" 1
1493 1 109 LEU QB 1 113 GLU QB . . 4.760 2.761 2.478 3.618 . 0 0 "[ . 1 . ]" 1
1494 1 127 THR HA 1 131 LYS H . . 4.590 4.304 4.116 4.461 . 0 0 "[ . 1 . ]" 1
1495 1 127 THR HA 1 129 CYS H . . 5.340 4.298 4.047 4.542 . 0 0 "[ . 1 . ]" 1
1496 1 126 THR HA 1 127 THR HA . . 5.500 4.301 4.296 4.306 . 0 0 "[ . 1 . ]" 1
1497 1 127 THR HA 1 130 LEU HA . . 5.400 5.556 4.931 5.962 0.562 7 1 "[ . + 1 . ]" 1
1498 1 127 THR HA 1 130 LEU QB . . 3.820 2.968 2.041 3.496 . 0 0 "[ . 1 . ]" 1
1499 1 127 THR HA 1 130 LEU HG . . 4.220 3.383 2.174 4.193 . 0 0 "[ . 1 . ]" 1
1500 1 127 THR HA 1 130 LEU QD . . 3.480 2.427 1.890 3.094 . 0 0 "[ . 1 . ]" 1
1501 1 111 PRO HA 1 114 GLN H . . 5.180 3.592 3.460 3.684 . 0 0 "[ . 1 . ]" 1
1502 1 71 MET H 1 111 PRO HA . . 5.500 4.856 4.059 5.471 . 0 0 "[ . 1 . ]" 1
1503 1 111 PRO HA 1 115 PHE H . . 5.130 4.410 4.204 4.664 . 0 0 "[ . 1 . ]" 1
1504 1 111 PRO HA 1 113 GLU H . . 5.500 4.635 4.482 4.766 . 0 0 "[ . 1 . ]" 1
1505 1 68 THR HG1 1 111 PRO HA . . 5.500 4.429 3.826 5.254 . 0 0 "[ . 1 . ]" 1
1506 1 74 PHE HB2 1 111 PRO HA . . 5.040 5.012 4.454 5.379 0.339 15 0 "[ . 1 . ]" 1
1507 1 71 MET ME 1 111 PRO HA . . 4.820 3.952 3.424 4.798 . 0 0 "[ . 1 . ]" 1
1508 1 111 PRO HA 1 114 GLN QG . . 5.500 3.544 2.759 3.889 . 0 0 "[ . 1 . ]" 1
1509 1 75 ILE MG 1 111 PRO HA . . 5.500 5.428 4.525 5.616 0.116 13 0 "[ . 1 . ]" 1
1510 1 126 THR HB 1 127 THR H . . 3.960 2.650 2.384 2.751 . 0 0 "[ . 1 . ]" 1
1511 1 126 THR HB 1 129 CYS H . . 4.590 3.780 3.622 3.948 . 0 0 "[ . 1 . ]" 1
1512 1 126 THR HB 1 128 GLY QA . . 4.720 4.571 4.376 4.755 0.035 11 0 "[ . 1 . ]" 1
1513 1 11 PHE QE 1 59 LEU HB2 . . 5.500 3.168 2.665 3.577 . 0 0 "[ . 1 . ]" 1
1514 1 11 PHE QE 1 59 LEU HB3 . . 5.500 2.395 1.980 2.818 . 0 0 "[ . 1 . ]" 1
1515 1 18 SER H 1 45 MET ME . . 5.030 4.000 3.126 4.634 . 0 0 "[ . 1 . ]" 1
1516 1 16 VAL H 1 45 MET ME . . 5.080 5.357 4.983 5.532 0.452 4 0 "[ . 1 . ]" 1
1517 1 45 MET ME 1 133 LEU HA . . 4.020 5.276 3.487 8.257 4.237 18 12 "[** **-* * ** .**+ ]" 1
1518 1 45 MET ME 1 45 MET QG . . 2.950 2.299 2.045 2.525 . 0 0 "[ . 1 . ]" 1
1519 1 112 MET ME 1 115 PHE H . . 4.400 4.115 3.779 4.472 0.072 6 0 "[ . 1 . ]" 1
1520 1 20 PHE QE 1 112 MET ME . . 5.500 7.951 5.498 11.322 5.822 12 17 "[***** **-* +*******]" 1
1521 1 112 MET ME 1 113 GLU HA . . 4.950 4.725 4.467 4.986 0.036 16 0 "[ . 1 . ]" 1
1522 1 112 MET ME 1 116 ILE MD . . 2.780 2.007 1.790 2.321 . 0 0 "[ . 1 . ]" 1
1523 1 33 PRO QB 1 37 LEU QB . . 5.100 4.705 3.606 5.961 0.861 4 2 "[ +. 1- . ]" 1
1524 1 37 LEU QB 1 38 PRO QG . . 5.310 4.194 4.073 4.404 . 0 0 "[ . 1 . ]" 1
1525 1 147 PRO QD 1 148 GLN H . . 5.500 3.748 2.603 4.908 . 0 0 "[ . 1 . ]" 1
1526 1 69 PRO QD 1 97 ILE MG . . 4.610 5.019 1.930 7.186 2.576 13 10 "[ -* . * *1**+*.** ]" 1
1527 1 68 THR HG1 1 71 MET QG . . 4.760 3.111 1.979 4.694 . 0 0 "[ . 1 . ]" 1
1528 1 71 MET QG 1 75 ILE QG . . 4.530 3.014 1.913 4.148 . 0 0 "[ . 1 . ]" 1
1529 1 71 MET QG 1 111 PRO QB . . 4.650 3.394 2.235 4.611 . 0 0 "[ . 1 . ]" 1
1530 1 68 THR MG 1 71 MET QG . . 4.670 3.500 2.223 4.439 . 0 0 "[ . 1 . ]" 1
1531 1 16 VAL H 1 81 THR MG . . 4.870 5.100 4.455 7.771 2.901 11 4 "[ * . 1+ * . - ]" 1
1532 1 15 ALA HA 1 81 THR MG . . 4.560 4.402 1.965 7.336 2.776 11 3 "[ .* 1+ . - ]" 1
1533 1 14 VAL QG 1 81 THR MG . . 3.660 4.215 2.301 5.610 1.950 11 11 "[****. - 1+* ** **]" 1
1534 1 22 THR MG 1 136 VAL QG . . 3.450 7.551 1.986 10.486 7.036 13 17 "[***** **** *+***-**]" 1
1535 1 22 THR MG 1 136 VAL HB . . 4.920 11.048 4.418 15.025 10.105 13 18 "[*****-**** *+******]" 1
1536 1 23 THR MG 1 25 LEU H . . 3.980 2.244 1.892 3.142 . 0 0 "[ . 1 . ]" 1
1537 1 23 THR MG 1 26 ASP H . . 4.310 3.903 2.427 4.977 0.667 11 1 "[ . 1+ . ]" 1
1538 1 23 THR MG 1 24 ASP HA . . 4.330 3.877 3.289 4.464 0.134 5 0 "[ . 1 . ]" 1
1539 1 23 THR MG 1 25 LEU QB . . 3.530 2.564 1.953 4.194 0.664 8 1 "[ . + 1 . ]" 1
1540 1 73 LYS HB2 1 74 PHE QD . . 4.350 4.146 3.938 4.501 0.151 6 0 "[ . 1 . ]" 1
1541 1 41 VAL H 1 41 VAL HB . . 3.220 2.816 2.318 3.649 0.429 7 0 "[ . 1 . ]" 1
1542 1 103 ILE MD 1 104 PRO HD2 . . 5.400 5.469 5.287 5.699 0.299 5 0 "[ . 1 . ]" 1
1543 1 100 ILE MG 1 104 PRO HD3 . . 5.240 5.239 4.991 5.722 0.482 19 0 "[ . 1 . ]" 1
1544 1 103 ILE H 1 104 PRO HD2 . . 4.930 4.174 3.872 4.617 . 0 0 "[ . 1 . ]" 1
1545 1 102 ALA H 1 104 PRO HD3 . . 5.500 5.291 4.684 6.110 0.610 19 1 "[ . 1 . +]" 1
1546 1 104 PRO HD3 1 106 PHE H . . 5.500 5.151 5.052 5.227 . 0 0 "[ . 1 . ]" 1
1547 1 134 ALA HA 1 136 VAL H . . 4.660 3.640 3.432 4.285 . 0 0 "[ . 1 . ]" 1
1548 1 20 PHE QB 1 134 ALA HA . . 4.170 4.440 2.938 5.596 1.426 12 6 "[ * * * 1 +* . - ]" 1
1549 1 37 LEU HA 1 37 LEU QD . . 3.350 2.022 1.876 2.732 . 0 0 "[ . 1 . ]" 1
1550 1 33 PRO QB 1 37 LEU HA . . 4.000 4.772 3.841 6.227 2.227 13 12 "[** ** ***+ *-* *]" 1
1551 1 106 PHE QD 1 107 LYS QG . . 4.840 4.475 4.005 4.886 0.046 13 0 "[ . 1 . ]" 1
1552 1 36 LYS QG 1 82 TYR QD . . 3.720 4.430 2.963 5.692 1.972 4 12 "[ * +*****1 *-*** ]" 1
1553 1 37 LEU HA 1 38 PRO QG . . 4.300 3.842 3.824 3.879 . 0 0 "[ . 1 . ]" 1
1554 1 115 PHE HA 1 115 PHE QE . . 4.670 4.645 4.544 4.767 0.097 6 0 "[ . 1 . ]" 1
1555 1 38 PRO HA 1 39 LEU HA . . 5.210 4.317 4.311 4.325 . 0 0 "[ . 1 . ]" 1
1556 1 114 GLN HA 1 115 PHE HA . . 5.500 4.797 4.769 4.833 . 0 0 "[ . 1 . ]" 1
1557 1 38 PRO HA 1 39 LEU MD2 . . 4.110 4.160 3.833 4.930 0.820 14 2 "[ -. 1 +. ]" 1
1558 1 37 LEU QB 1 38 PRO QD . . 4.690 2.862 2.710 3.094 . 0 0 "[ . 1 . ]" 1
1559 1 38 PRO HA 1 39 LEU HG . . 4.630 4.244 4.061 4.791 0.161 14 0 "[ . 1 . ]" 1
1560 1 39 LEU HA 1 39 LEU HG . . 3.920 3.625 3.602 3.686 . 0 0 "[ . 1 . ]" 1
1561 1 39 LEU HG 1 40 GLU HA . . 4.530 4.059 3.487 4.220 . 0 0 "[ . 1 . ]" 1
1562 1 39 LEU HG 1 40 GLU HB3 . . 3.960 3.888 3.665 4.086 0.126 1 0 "[ . 1 . ]" 1
1563 1 38 PRO QG 1 39 LEU HG . . 5.500 5.181 5.005 5.494 . 0 0 "[ . 1 . ]" 1
1564 1 141 LEU HA 1 145 TRP H . . 5.410 4.581 4.128 5.039 . 0 0 "[ . 1 . ]" 1
1565 1 140 ASP QB 1 141 LEU HA . . 4.660 3.940 3.773 4.293 . 0 0 "[ . 1 . ]" 1
1566 1 141 LEU HA 1 144 LYS QB . . 3.750 2.944 2.393 3.360 . 0 0 "[ . 1 . ]" 1
1567 1 143 LYS HA 1 146 LEU H . . 4.650 3.576 3.224 3.935 . 0 0 "[ . 1 . ]" 1
1568 1 143 LYS HA 1 150 CYS H . . 4.930 4.716 3.300 5.594 0.664 13 5 "[ *. - 1 *+ * ]" 1
1569 1 68 THR MG 1 99 ASP HA . . 4.960 4.803 4.253 5.472 0.512 2 1 "[ + . 1 . ]" 1
1570 1 99 ASP HA 1 107 LYS HA . . 4.460 4.638 4.048 5.310 0.850 3 5 "[ + * - 1 * .* ]" 1
1571 1 106 PHE QE 1 118 GLN QG . . 3.510 2.655 1.910 3.723 0.213 3 0 "[ . 1 . ]" 1
1572 1 99 ASP QB 1 107 LYS QB . . 5.010 3.986 2.789 4.978 . 0 0 "[ . 1 . ]" 1
1573 1 69 PRO HA 1 73 LYS H . . 4.800 4.728 4.255 5.089 0.289 11 0 "[ . 1 . ]" 1
1574 1 36 LYS QB 1 82 TYR QB . . 5.290 5.260 4.518 5.732 0.442 9 0 "[ . 1 . ]" 1
1575 1 103 ILE H 1 104 PRO HA . . 5.000 4.458 4.334 4.752 . 0 0 "[ . 1 . ]" 1
1576 1 18 SER HA 1 22 THR MG . . 4.900 7.615 4.090 8.554 3.654 15 17 "[***** **** ***+**-*]" 1
1577 1 56 ARG HA 1 60 ILE H . . 4.330 4.159 3.765 4.450 0.120 16 0 "[ . 1 . ]" 1
1578 1 11 PHE QE 1 56 ARG HA . . 4.890 4.180 3.165 5.028 0.138 12 0 "[ . 1 . ]" 1
1579 1 56 ARG HA 1 56 ARG QD . . 4.670 2.494 1.974 4.142 . 0 0 "[ . 1 . ]" 1
1580 1 56 ARG HA 1 60 ILE MD . . 3.720 3.276 2.736 3.870 0.150 13 0 "[ . 1 . ]" 1
1581 1 60 ILE MG 1 64 HIS HE1 . . 2.790 2.714 2.573 2.972 0.182 17 0 "[ . 1 . ]" 1
1582 1 82 TYR QD 1 83 GLU H . . 3.270 2.655 2.077 3.186 . 0 0 "[ . 1 . ]" 1
1583 1 36 LYS H 1 82 TYR QD . . 3.760 2.608 1.887 4.218 0.458 14 0 "[ . 1 . ]" 1
1584 1 15 ALA H 1 82 TYR QD . . 3.720 4.170 2.804 5.456 1.736 8 9 "[* *. +*1 * -** *]" 1
1585 1 82 TYR QD 1 83 GLU HA . . 3.800 3.684 2.933 4.391 0.591 4 3 "[ +. 1 - .* ]" 1
1586 1 82 TYR QD 1 83 GLU QG . . 4.070 2.866 2.075 4.219 0.149 16 0 "[ . 1 . ]" 1
1587 1 36 LYS QB 1 82 TYR QD . . 4.430 4.191 3.547 5.203 0.773 12 3 "[ -. 1 + *. ]" 1
1588 1 15 ALA MB 1 82 TYR QD . . 3.440 2.602 1.897 3.536 0.096 9 0 "[ . 1 . ]" 1
1589 1 14 VAL QG 1 82 TYR QD . . 3.420 3.189 2.153 4.644 1.224 19 3 "[ . * 1 - +]" 1
1590 1 15 ALA HA 1 82 TYR QD . . 3.960 3.827 2.818 4.918 0.958 17 3 "[ . -1 * . + ]" 1
1591 1 74 PHE H 1 74 PHE QD . . 3.280 2.138 1.940 2.473 . 0 0 "[ . 1 . ]" 1
1592 1 17 ALA HA 1 20 PHE QD . . 3.920 2.797 2.059 4.165 0.245 16 0 "[ . 1 . ]" 1
1593 1 17 ALA MB 1 20 PHE QD . . 3.660 4.095 3.421 5.230 1.570 16 7 "[* *- * * *+ ]" 1
1594 1 11 PHE H 1 11 PHE QD . . 3.740 2.863 2.048 3.087 . 0 0 "[ . 1 . ]" 1
1595 1 70 LYS HA 1 74 PHE QD . . 3.640 4.340 3.506 5.081 1.441 11 16 "[******* *-+ ****** ]" 1
1596 1 11 PHE QD 1 59 LEU HB2 . . 4.520 3.713 3.328 4.267 . 0 0 "[ . 1 . ]" 1
1597 1 11 PHE QD 1 60 ILE HA . . 4.290 3.799 3.276 4.160 . 0 0 "[ . 1 . ]" 1
1598 1 11 PHE QD 1 13 ILE HB . . 3.790 4.048 3.690 5.083 1.293 2 5 "[ + *. * * - . ]" 1
1599 1 11 PHE QD 1 60 ILE QG . . 3.640 3.024 2.452 3.722 0.082 10 0 "[ . 1 . ]" 1
1600 1 153 PHE HA 1 153 PHE QD . . 3.350 2.585 2.143 3.157 . 0 0 "[ . 1 . ]" 1
1601 1 106 PHE QE 1 118 GLN QE . . 3.870 2.453 2.039 3.261 . 0 0 "[ . 1 . ]" 1
1602 1 99 ASP HA 1 106 PHE QE . . 4.020 3.126 2.083 4.272 0.252 17 0 "[ . 1 . ]" 1
1603 1 106 PHE QE 1 114 GLN HA . . 3.540 2.805 2.256 3.618 0.078 10 0 "[ . 1 . ]" 1
1604 1 106 PHE QE 1 107 LYS HA . . 3.630 3.564 3.339 4.098 0.468 17 0 "[ . 1 . ]" 1
1605 1 103 ILE HB 1 106 PHE QD . . 3.640 3.561 3.157 3.853 0.213 19 0 "[ . 1 . ]" 1
1606 1 103 ILE MD 1 106 PHE QE . . 3.760 4.431 3.448 4.716 0.956 8 16 "[*** -**+ ********* ]" 1
1607 1 103 ILE MD 1 106 PHE QD . . 3.360 3.182 1.951 3.485 0.125 6 0 "[ . 1 . ]" 1
1608 1 115 PHE H 1 115 PHE QD . . 4.220 4.166 4.121 4.182 . 0 0 "[ . 1 . ]" 1
1609 1 99 ASP HA 1 106 PHE QD . . 4.130 3.457 2.833 4.306 0.176 3 0 "[ . 1 . ]" 1
1610 1 115 PHE HA 1 115 PHE QD . . 3.770 2.603 2.351 2.946 . 0 0 "[ . 1 . ]" 1
1611 1 115 PHE QD 1 116 ILE HA . . 4.190 3.641 3.037 4.071 . 0 0 "[ . 1 . ]" 1
1612 1 115 PHE QD 1 116 ILE QG . . 3.660 3.282 2.212 3.696 0.036 19 0 "[ . 1 . ]" 1
1613 1 73 LYS QD 1 74 PHE QE . . 3.670 3.074 2.077 3.930 0.260 5 0 "[ . 1 . ]" 1
1614 1 11 PHE QE 1 13 ILE MD . . 3.230 3.505 1.915 4.364 1.134 13 8 "[- * .* **1* + . *]" 1
1615 1 65 ILE MG 1 115 PHE QD . . 3.490 3.396 2.643 4.015 0.525 17 2 "[ . - 1 . + ]" 1
1616 1 20 PHE QE 1 133 LEU QB . . 4.210 3.501 2.720 4.461 0.251 16 0 "[ . 1 . ]" 1
1617 1 11 PHE HZ 1 46 GLU QB . . 3.750 2.893 2.149 4.371 0.621 10 1 "[ . + . ]" 1
1618 1 11 PHE HZ 1 13 ILE HB . . 3.640 3.307 2.835 4.021 0.381 2 0 "[ . 1 . ]" 1
1619 1 11 PHE HZ 1 13 ILE MG . . 4.020 4.451 3.950 4.988 0.968 7 8 "[ * * + * **-.* ]" 1
1620 1 11 PHE HZ 1 59 LEU HA . . 5.130 5.874 4.799 6.802 1.672 2 11 "[*+* * * *1 * *.** -]" 1
1621 1 20 PHE QE 1 115 PHE QE . . 3.390 4.618 2.373 8.102 4.712 12 11 "[** *. *- * +**. * *]" 1
1622 1 73 LYS QE 1 74 PHE HZ . . 4.070 4.163 3.337 4.792 0.722 2 1 "[ + . 1 . ]" 1
1623 1 73 LYS QD 1 74 PHE HZ . . 4.760 4.705 3.430 5.064 0.304 8 0 "[ . 1 . ]" 1
1624 1 106 PHE HZ 1 118 GLN QE . . 4.230 2.388 1.914 3.984 . 0 0 "[ . 1 . ]" 1
1625 1 106 PHE HZ 1 118 GLN QG . . 3.950 3.801 2.709 5.114 1.164 3 2 "[ + . 1 . - ]" 1
1626 1 68 THR MG 1 106 PHE HZ . . 3.350 2.464 2.022 3.347 . 0 0 "[ . 1 . ]" 1
1627 1 144 LYS H 1 145 TRP HD1 . . 4.450 4.070 3.685 4.500 0.050 18 0 "[ . 1 . ]" 1
1628 1 141 LEU HA 1 145 TRP HD1 . . 4.240 3.952 3.572 4.513 0.273 17 0 "[ . 1 . ]" 1
1629 1 144 LYS QB 1 145 TRP HD1 . . 3.470 2.757 2.251 3.396 . 0 0 "[ . 1 . ]" 1
1630 1 141 LEU QB 1 145 TRP HD1 . . 3.750 4.033 3.239 4.550 0.800 7 6 "[ * . +- 1 * .** ]" 1
1631 1 144 LYS QD 1 145 TRP HD1 . . 3.910 2.798 2.110 3.472 . 0 0 "[ . 1 . ]" 1
1632 1 145 TRP QB 1 145 TRP HE3 . . 3.750 2.481 2.375 2.642 . 0 0 "[ . 1 . ]" 1
1633 1 63 SER H 1 64 HIS HD2 . . 4.550 4.610 4.191 4.956 0.406 2 0 "[ . 1 . ]" 1
1634 1 64 HIS H 1 64 HIS HD2 . . 3.540 3.203 2.887 3.624 0.084 19 0 "[ . 1 . ]" 1
1635 1 64 HIS HA 1 64 HIS HD2 . . 3.870 2.521 2.324 2.764 . 0 0 "[ . 1 . ]" 1
1636 1 64 HIS HB2 1 64 HIS HD2 . . 3.830 3.576 3.472 3.661 . 0 0 "[ . 1 . ]" 1
1637 1 60 ILE MG 1 64 HIS HD2 . . 3.150 3.389 3.104 3.739 0.589 16 2 "[ . - .+ ]" 1
1638 1 35 LYS HA 1 82 TYR QE . . 4.000 6.007 4.006 7.488 3.488 12 17 "[***-* *****+*** ***]" 1
1639 1 81 THR HB 1 82 TYR QE . . 4.000 4.639 3.057 5.895 1.895 12 14 "[** *. **-**+* *** *]" 1
1640 1 82 TYR QE 1 83 GLU QG . . 4.280 2.640 1.921 4.582 0.302 16 0 "[ . 1 . ]" 1
1641 1 82 TYR QE 1 83 GLU QB . . 3.650 3.196 2.654 3.631 . 0 0 "[ . 1 . ]" 1
1642 1 36 LYS QB 1 82 TYR QE . . 3.920 4.496 3.698 6.272 2.352 14 7 "[ * *. -*1 * +.* ]" 1
1643 1 15 ALA MB 1 82 TYR QE . . 3.590 2.806 2.216 3.891 0.301 7 0 "[ . 1 . ]" 1
1644 1 14 VAL QG 1 82 TYR QE . . 3.190 2.573 2.000 3.870 0.680 19 1 "[ . 1 . +]" 1
1645 1 144 LYS QE 1 145 TRP HZ2 . . 4.110 3.993 2.729 4.588 0.478 9 0 "[ . 1 . ]" 1
1646 1 11 PHE QD 1 13 ILE H . . 4.450 4.034 3.585 4.941 0.491 2 0 "[ . 1 . ]" 1
1647 1 11 PHE QD 1 13 ILE HA . . 4.150 3.503 3.222 4.097 . 0 0 "[ . 1 . ]" 1
1648 1 11 PHE QD 1 13 ILE QG . . 4.520 4.397 3.602 5.235 0.715 18 4 "[ . 1 *- *+ ]" 1
1649 1 11 PHE QD 1 59 LEU HB3 . . 4.250 3.093 2.152 4.017 . 0 0 "[ . 1 . ]" 1
1650 1 11 PHE HZ 1 13 ILE HA . . 4.640 4.873 4.146 5.530 0.890 5 4 "[ + 1 * .*- ]" 1
1651 1 11 PHE HZ 1 46 GLU HA . . 4.800 4.490 3.924 5.437 0.637 16 1 "[ . 1 .+ ]" 1
1652 1 11 PHE HZ 1 13 ILE QG . . 3.890 3.459 2.428 4.728 0.838 18 4 "[ . 1 -* *+ ]" 1
1653 1 115 PHE QE 1 116 ILE H . . 5.340 5.242 5.053 5.420 0.080 11 0 "[ . 1 . ]" 1
1654 1 20 PHE QD 1 115 PHE QE . . 4.040 4.428 2.573 8.015 3.975 12 8 "[* . * - +**. * *]" 1
1655 1 20 PHE HA 1 115 PHE QE . . 3.770 4.470 2.532 8.795 5.025 17 9 "[* .-* * ***. + *]" 1
1656 1 11 PHE QE 1 13 ILE HA . . 4.720 2.708 2.154 3.462 . 0 0 "[ . 1 . ]" 1
1657 1 115 PHE QE 1 116 ILE HA . . 4.410 4.495 4.179 4.786 0.376 9 0 "[ . 1 . ]" 1
1658 1 11 PHE QE 1 16 VAL HB . . 4.300 5.007 3.608 6.737 2.437 14 8 "[ **- **1 +.* *]" 1
1659 1 11 PHE QE 1 60 ILE QG . . 4.380 4.213 3.147 5.110 0.730 10 3 "[ . + * . - ]" 1
1660 1 11 PHE QE 1 13 ILE QG . . 3.850 2.582 1.934 3.634 . 0 0 "[ . 1 . ]" 1
1661 1 11 PHE QE 1 13 ILE MG . . 4.350 3.924 3.645 4.713 0.363 2 0 "[ . 1 . ]" 1
1662 1 20 PHE HA 1 20 PHE QD . . 3.830 2.277 1.947 3.021 . 0 0 "[ . 1 . ]" 1
1663 1 73 LYS HB3 1 74 PHE QD . . 4.350 2.431 2.196 2.771 . 0 0 "[ . 1 . ]" 1
1664 1 20 PHE QD 1 133 LEU QB . . 3.460 2.699 2.034 4.126 0.666 13 1 "[ . 1 + . ]" 1
1665 1 20 PHE QD 1 133 LEU MD2 . . 4.470 3.454 2.787 4.740 0.270 1 0 "[ . 1 . ]" 1
1666 1 20 PHE QD 1 133 LEU MD1 . . 4.470 3.106 1.945 4.673 0.203 13 0 "[ . 1 . ]" 1
1667 1 74 PHE QD 1 75 ILE H . . 4.680 4.095 3.832 4.265 . 0 0 "[ . 1 . ]" 1
1668 1 73 LYS HA 1 74 PHE QD . . 4.850 4.741 4.505 5.012 0.162 6 0 "[ . 1 . ]" 1
1669 1 74 PHE H 1 74 PHE QE . . 4.520 4.430 4.192 4.765 0.245 14 0 "[ . 1 . ]" 1
1670 1 70 LYS HA 1 74 PHE QE . . 4.320 4.615 4.038 5.018 0.698 11 3 "[ * 1+ .- ]" 1
1671 1 70 LYS QG 1 74 PHE QE . . 4.250 3.938 2.692 5.352 1.102 3 7 "[ +-.* * *.* * ]" 1
1672 1 106 PHE QE 1 107 LYS H . . 4.430 4.700 4.096 5.421 0.991 17 6 "[ *. * *1- . +* ]" 1
1673 1 106 PHE QE 1 117 ALA H . . 4.600 4.745 4.377 5.413 0.813 10 1 "[ . + . ]" 1
1674 1 106 PHE QE 1 115 PHE HA . . 3.770 4.095 3.771 4.523 0.753 5 5 "[ -+* * .* ]" 1
1675 1 106 PHE QE 1 114 GLN QB . . 4.510 2.471 2.057 4.211 . 0 0 "[ . 1 . ]" 1
1676 1 106 PHE QE 1 117 ALA MB . . 3.670 3.268 2.510 3.639 . 0 0 "[ . 1 . ]" 1
1677 1 68 THR MG 1 106 PHE QE . . 3.180 2.690 1.895 3.833 0.653 6 1 "[ .+ 1 . ]" 1
1678 1 100 ILE HB 1 106 PHE QE . . 4.240 4.684 3.563 5.368 1.128 7 8 "[ * *. + *1* * . *- ]" 1
1679 1 106 PHE HZ 1 114 GLN QB . . 4.940 3.465 2.634 5.122 0.182 10 0 "[ . 1 . ]" 1
1680 1 106 PHE HZ 1 117 ALA MB . . 4.870 5.206 4.718 5.665 0.795 13 8 "[ - . * * *+** * ]" 1
1681 1 20 PHE QE 1 133 LEU MD2 . . 4.560 3.317 1.973 5.339 0.779 1 2 "[+ . 1 .- ]" 1
1682 1 20 PHE QE 1 65 ILE MD . . 3.810 4.631 3.007 6.511 2.701 17 11 "[** -. * *****. + *]" 1
1683 1 20 PHE QE 1 62 LEU QB . . 4.680 3.445 2.108 4.520 . 0 0 "[ . 1 . ]" 1
1684 1 17 ALA MB 1 20 PHE QE . . 4.660 4.994 4.148 6.519 1.859 1 8 "[+ *- * **** ]" 1
1685 1 20 PHE QE 1 133 LEU MD1 . . 4.560 2.576 1.880 4.651 0.091 13 0 "[ . 1 . ]" 1
1686 1 20 PHE QE 1 115 PHE QD . . 4.370 6.379 3.554 9.772 5.402 12 16 "[***** ** * +*****-*]" 1
1687 1 65 ILE MD 1 115 PHE QD . . 3.680 3.956 3.109 5.464 1.784 11 4 "[ . * 1+ *-. ]" 1
1688 1 115 PHE QD 1 118 GLN QB . . 4.640 4.550 3.917 5.213 0.573 17 2 "[ . 1- . + ]" 1
1689 1 65 ILE HB 1 115 PHE QD . . 5.260 5.232 4.307 6.111 0.851 17 2 "[ . 1- . + ]" 1
1690 1 115 PHE QD 1 116 ILE HB . . 4.550 4.677 4.432 4.875 0.325 18 0 "[ . 1 . ]" 1
1691 1 78 ARG QG 1 115 PHE QD . . 4.720 4.816 3.826 5.514 0.794 4 6 "[ *+- ** * . ]" 1
1692 1 152 THR H 1 153 PHE QD . . 4.290 4.344 2.270 6.189 1.899 11 6 "[ * 1+ ** *-]" 1
1693 1 115 PHE QE 1 116 ILE QG . . 3.820 4.059 3.393 4.438 0.618 11 2 "[ . - 1+ . ]" 1
1694 1 65 ILE MG 1 115 PHE QE . . 3.230 3.735 2.550 4.574 1.344 7 11 "[****. + *1 **** - ]" 1
1695 1 82 TYR QD 1 83 GLU QB . . 3.580 2.679 1.990 3.888 0.308 14 0 "[ . 1 . ]" 1
1696 1 81 THR MG 1 82 TYR QD . . 4.480 2.618 1.899 3.930 . 0 0 "[ . 1 . ]" 1
1697 1 82 TYR QE 1 83 GLU H . . 4.270 3.921 3.582 4.629 0.359 16 0 "[ . 1 . ]" 1
1698 1 12 ASN QD 1 82 TYR QE . . 3.890 2.809 1.910 4.385 0.495 5 0 "[ . 1 . ]" 1
1699 1 15 ALA H 1 82 TYR QE . . 3.730 3.315 2.100 4.436 0.706 16 2 "[ . 1 - .+ ]" 1
1700 1 60 ILE HB 1 64 HIS HE1 . . 5.400 5.528 5.384 5.748 0.348 17 0 "[ . 1 . ]" 1
1701 1 145 TRP HD1 1 146 LEU H . . 5.000 4.553 4.171 4.908 . 0 0 "[ . 1 . ]" 1
1702 1 145 TRP HA 1 145 TRP HD1 . . 4.460 3.887 3.359 4.188 . 0 0 "[ . 1 . ]" 1
1703 1 142 LEU HA 1 145 TRP HD1 . . 4.400 3.829 3.027 4.517 0.117 2 0 "[ . 1 . ]" 1
1704 1 80 HIS H 1 80 HIS HD2 . . 4.940 4.066 2.613 4.755 . 0 0 "[ . 1 . ]" 1
1705 1 144 LYS QD 1 145 TRP HZ2 . . 4.290 4.602 3.920 5.786 1.496 19 5 "[-** . * . +]" 1
1706 1 11 PHE HB2 1 16 VAL QG . . 5.080 4.452 4.023 4.820 . 0 0 "[ . 1 . ]" 1
1707 1 11 PHE QD 1 16 VAL QG . . 3.640 3.234 2.545 3.740 0.100 5 0 "[ . 1 . ]" 1
1708 1 11 PHE QD 1 59 LEU QB . . 3.960 2.927 2.129 3.679 . 0 0 "[ . 1 . ]" 1
1709 1 11 PHE QD 1 63 SER QB . . 4.090 2.889 2.359 3.522 . 0 0 "[ . 1 . ]" 1
1710 1 11 PHE HZ 1 59 LEU QB . . 4.300 3.158 2.304 3.919 . 0 0 "[ . 1 . ]" 1
1711 1 12 ASN H 1 16 VAL QG . . 4.150 3.965 3.554 4.272 0.122 13 0 "[ . 1 . ]" 1
1712 1 12 ASN QB 1 16 VAL QG . . 4.640 3.670 3.079 4.332 . 0 0 "[ . 1 . ]" 1
1713 1 12 ASN QB 1 63 SER QB . . 4.610 3.902 2.600 5.156 0.546 15 1 "[ . 1 + ]" 1
1714 1 12 ASN QD 1 42 LEU QD . . 4.120 3.990 1.962 6.025 1.905 5 5 "[ + * *-. * ]" 1
1715 1 13 ILE H 1 42 LEU QD . . 4.830 2.040 1.733 2.885 . 0 0 "[ . 1 . ]" 1
1716 1 13 ILE HA 1 16 VAL QG . . 3.030 2.517 1.858 3.267 0.237 5 0 "[ . 1 . ]" 1
1717 1 13 ILE HB 1 42 LEU QD . . 3.690 3.033 1.947 4.548 0.858 13 1 "[ . 1 + . ]" 1
1718 1 13 ILE MG 1 59 LEU QD . . 4.570 3.937 3.322 4.589 0.019 14 0 "[ . 1 . ]" 1
1719 1 13 ILE QG 1 59 LEU QD . . 2.900 2.289 1.667 3.625 0.725 14 3 "[ . 1 +* - ]" 1
1720 1 13 ILE QG 1 133 LEU QD . . 3.720 3.079 2.020 4.037 0.317 4 0 "[ . 1 . ]" 1
1721 1 13 ILE MD 1 59 LEU QD . . 2.810 2.467 1.611 3.595 0.785 6 2 "[ - .+ 1 . ]" 1
1722 1 13 ILE MD 1 133 LEU QD . . 2.830 2.165 1.818 2.757 . 0 0 "[ . 1 . ]" 1
1723 1 14 VAL H 1 42 LEU QD . . 3.510 2.413 1.835 3.252 . 0 0 "[ . 1 . ]" 1
1724 1 14 VAL HA 1 42 LEU QD . . 4.460 4.181 3.357 5.084 0.624 3 2 "[ + . 1 -. ]" 1
1725 1 15 ALA H 1 16 VAL QG . . 4.070 3.886 3.348 4.397 0.327 2 0 "[ . 1 . ]" 1
1726 1 15 ALA HA 1 18 SER QB . . 5.100 2.712 2.145 3.696 . 0 0 "[ . 1 . ]" 1
1727 1 15 ALA MB 1 16 VAL QG . . 3.380 3.125 2.829 3.407 0.027 12 0 "[ . 1 . ]" 1
1728 1 15 ALA MB 1 18 SER QB . . 4.380 4.033 3.641 4.538 0.158 12 0 "[ . 1 . ]" 1
1729 1 16 VAL HA 1 19 ASN QD . . 4.280 2.843 2.064 4.366 0.086 11 0 "[ . 1 . ]" 1
1730 1 16 VAL HB 1 133 LEU QD . . 3.900 3.629 2.965 4.451 0.551 12 1 "[ . 1 + . ]" 1
1731 1 16 VAL QG 1 17 ALA HA . . 3.980 3.195 2.866 3.426 . 0 0 "[ . 1 . ]" 1
1732 1 16 VAL QG 1 17 ALA MB . . 3.130 3.365 2.758 3.896 0.766 13 4 "[ . 1 + ** - ]" 1
1733 1 16 VAL QG 1 18 SER H . . 5.340 4.339 3.963 4.628 . 0 0 "[ . 1 . ]" 1
1734 1 16 VAL QG 1 19 ASN QD . . 3.820 3.587 1.911 4.880 1.060 11 5 "[* *. -1+* . ]" 1
1735 1 16 VAL QG 1 20 PHE QD . . 3.600 3.459 2.557 4.160 0.560 4 1 "[ +. 1 . ]" 1
1736 1 16 VAL QG 1 20 PHE QE . . 3.240 2.624 1.920 3.591 0.351 14 0 "[ . 1 . ]" 1
1737 1 16 VAL QG 1 20 PHE HZ . . 3.620 3.374 2.185 5.045 1.425 1 4 "[+ *. 1 *. -]" 1
1738 1 16 VAL QG 1 62 LEU H . . 4.710 4.184 3.688 4.823 0.113 12 0 "[ . 1 . ]" 1
1739 1 16 VAL QG 1 62 LEU QD . . 2.690 2.277 1.575 3.520 0.830 9 2 "[ . -+1 . ]" 1
1740 1 16 VAL QG 1 63 SER HA . . 3.280 2.439 1.919 3.406 0.126 7 0 "[ . 1 . ]" 1
1741 1 16 VAL QG 1 63 SER QB . . 3.410 2.362 1.903 3.609 0.199 17 0 "[ . 1 . ]" 1
1742 1 16 VAL QG 1 64 HIS H . . 4.880 4.613 4.161 5.424 0.544 7 1 "[ . + 1 . ]" 1
1743 1 16 VAL QG 1 133 LEU QD . . 2.580 2.452 2.005 3.293 0.713 12 1 "[ . 1 + . ]" 1
1744 1 17 ALA H 1 133 LEU QD . . 4.120 3.551 2.914 4.369 0.249 18 0 "[ . 1 . ]" 1
1745 1 17 ALA HA 1 133 LEU QD . . 3.830 2.668 1.901 3.675 . 0 0 "[ . 1 . ]" 1
1746 1 17 ALA MB 1 18 SER QB . . 4.070 3.981 3.639 4.372 0.302 12 0 "[ . 1 . ]" 1
1747 1 17 ALA MB 1 20 PHE QB . . 4.330 4.074 3.467 4.531 0.201 2 0 "[ . 1 . ]" 1
1748 1 17 ALA MB 1 133 LEU QD . . 2.940 2.353 1.794 3.411 0.471 8 0 "[ . 1 . ]" 1
1749 1 17 ALA MB 1 136 VAL QG . . 2.970 3.235 1.838 5.146 2.176 13 4 "[ - . * 1 *+ . ]" 1
1750 1 18 SER H 1 19 ASN QD . . 5.120 4.857 3.694 5.359 0.239 19 0 "[ . 1 . ]" 1
1751 1 18 SER H 1 133 LEU QD . . 5.200 5.074 4.544 5.987 0.787 8 2 "[ . + 1 . - ]" 1
1752 1 18 SER QB 1 19 ASN H . . 4.200 2.806 2.521 3.445 . 0 0 "[ . 1 . ]" 1
1753 1 18 SER QB 1 21 ALA MB . . 4.630 4.355 3.705 5.807 1.177 11 1 "[ . 1+ . ]" 1
1754 1 18 SER QB 1 45 MET ME . . 4.270 4.603 3.537 5.981 1.711 15 7 "[ . *-1** *+ *]" 1
1755 1 19 ASN H 1 19 ASN QB . . 3.440 2.354 2.048 2.648 . 0 0 "[ . 1 . ]" 1
1756 1 19 ASN H 1 19 ASN QD . . 3.860 3.154 1.888 3.677 . 0 0 "[ . 1 . ]" 1
1757 1 19 ASN QB 1 20 PHE QD . . 4.110 3.455 2.499 4.609 0.499 19 0 "[ . 1 . ]" 1
1758 1 19 ASN QB 1 119 VAL QG . . 4.690 4.458 3.539 5.540 0.850 19 2 "[ . - 1 . +]" 1
1759 1 19 ASN QD 1 20 PHE H . . 4.930 4.424 2.596 5.111 0.181 2 0 "[ . 1 . ]" 1
1760 1 19 ASN QD 1 115 PHE QE . . 4.140 3.933 2.681 5.925 1.785 9 6 "[ *. +1-** . * ]" 1
1761 1 19 ASN QD 1 119 VAL QG . . 4.970 5.150 3.468 6.992 2.022 9 7 "[- *. *+1** .* ]" 1
1762 1 20 PHE QB 1 133 LEU QD . . 4.310 3.671 2.943 4.444 0.134 2 0 "[ . 1 . ]" 1
1763 1 20 PHE QD 1 62 LEU QD . . 4.360 4.105 3.184 4.662 0.302 14 0 "[ . 1 . ]" 1
1764 1 20 PHE QD 1 133 LEU QD . . 3.520 2.718 1.911 3.473 . 0 0 "[ . 1 . ]" 1
1765 1 20 PHE QE 1 62 LEU QD . . 3.290 2.542 1.920 3.224 . 0 0 "[ . 1 . ]" 1
1766 1 20 PHE QE 1 133 LEU QD . . 3.580 2.320 1.800 3.363 . 0 0 "[ . 1 . ]" 1
1767 1 20 PHE HZ 1 62 LEU QD . . 3.650 2.217 1.823 3.790 0.140 14 0 "[ . 1 . ]" 1
1768 1 20 PHE HZ 1 133 LEU QD . . 4.220 3.561 2.681 4.615 0.395 9 0 "[ . 1 . ]" 1
1769 1 22 THR HB 1 136 VAL QG . . 5.160 9.184 2.847 12.053 6.893 2 17 "[*+*** **** *****-**]" 1
1770 1 23 THR HB 1 25 LEU QD . . 4.100 4.388 3.447 6.160 2.060 10 6 "[ * -* +* . * ]" 1
1771 1 23 THR MG 1 25 LEU QD . . 3.050 2.343 1.734 3.947 0.897 6 2 "[ .+ - . ]" 1
1772 1 24 ASP H 1 25 LEU QD . . 4.780 4.067 2.288 5.184 0.404 3 0 "[ . 1 . ]" 1
1773 1 25 LEU QD 1 26 ASP HA . . 4.670 3.627 2.138 4.737 0.067 16 0 "[ . 1 . ]" 1
1774 1 25 LEU QD 1 28 ASP HA . . 5.400 5.916 4.608 6.935 1.535 2 9 "[ + *. * -* **. * *]" 1
1775 1 25 LEU QD 1 29 ARG HA . . 4.740 5.038 3.647 6.556 1.816 14 5 "[ *. * 1 *+. -]" 1
1776 1 26 ASP QB 1 29 ARG QB . . 4.220 4.160 3.611 4.597 0.377 14 0 "[ . 1 . ]" 1
1777 1 29 ARG H 1 32 LEU QD . . 4.900 4.160 3.287 5.090 0.190 10 0 "[ . 1 . ]" 1
1778 1 29 ARG HA 1 32 LEU QD . . 3.390 4.139 2.035 6.236 2.846 10 14 "[ * ***** + ***** -*]" 1
1779 1 29 ARG QB 1 30 GLY H . . 3.260 3.029 2.967 3.100 . 0 0 "[ . 1 . ]" 1
1780 1 29 ARG QB 1 30 GLY QA . . 4.560 3.933 3.674 4.087 . 0 0 "[ . 1 . ]" 1
1781 1 29 ARG QB 1 32 LEU QD . . 3.450 2.766 1.763 5.206 1.756 10 1 "[ . + . ]" 1
1782 1 29 ARG QD 1 32 LEU QD . . 3.560 3.234 1.870 7.032 3.472 10 2 "[ - + . ]" 1
1783 1 29 ARG HE 1 32 LEU QD . . 4.440 4.335 3.379 7.536 3.096 10 2 "[ . - + . ]" 1
1784 1 30 GLY H 1 32 LEU QD . . 5.370 4.146 3.324 4.908 . 0 0 "[ . 1 . ]" 1
1785 1 30 GLY QA 1 32 LEU QD . . 4.540 4.176 2.594 5.367 0.827 3 2 "[ + . 1 . -]" 1
1786 1 31 LYS H 1 32 LEU QD . . 4.850 3.226 2.025 4.616 . 0 0 "[ . 1 . ]" 1
1787 1 31 LYS HA 1 32 LEU QD . . 4.610 4.135 2.863 5.482 0.872 3 1 "[ + . 1 . ]" 1
1788 1 32 LEU HA 1 32 LEU QD . . 3.560 2.466 1.912 3.361 . 0 0 "[ . 1 . ]" 1
1789 1 32 LEU QD 1 146 LEU HA . . 4.000 5.295 2.210 7.225 3.225 9 13 "[*** * -+**** * * *]" 1
1790 1 32 LEU QD 1 147 PRO QD . . 3.650 5.314 1.958 7.882 4.232 9 12 "[*** - +**** * * *]" 1
1791 1 33 PRO QG 1 37 LEU QD . . 3.350 3.025 1.807 4.378 1.028 13 2 "[ . 1 + - ]" 1
1792 1 33 PRO QD 1 146 LEU HA . . 4.620 4.787 3.299 8.834 4.214 3 7 "[**+ . -1 * * *]" 1
1793 1 33 PRO QD 1 146 LEU QD . . 3.480 2.877 1.849 5.068 1.588 3 3 "[ +*. - 1 . ]" 1
1794 1 37 LEU H 1 37 LEU QD . . 3.070 2.884 2.360 3.787 0.717 6 1 "[ .+ 1 . ]" 1
1795 1 37 LEU HA 1 38 PRO QD . . 3.540 1.943 1.925 1.978 . 0 0 "[ . 1 . ]" 1
1796 1 37 LEU HA 1 41 VAL QG . . 4.240 3.781 3.345 4.401 0.161 3 0 "[ . 1 . ]" 1
1797 1 37 LEU QB 1 41 VAL QG . . 5.160 2.764 1.949 3.568 . 0 0 "[ . 1 . ]" 1
1798 1 37 LEU HG 1 38 PRO QD . . 4.400 4.095 3.023 4.300 . 0 0 "[ . 1 . ]" 1
1799 1 37 LEU QD 1 38 PRO QD . . 3.330 1.898 1.840 2.061 . 0 0 "[ . 1 . ]" 1
1800 1 37 LEU QD 1 41 VAL HB . . 3.400 2.627 1.887 3.787 0.387 18 0 "[ . 1 . ]" 1
1801 1 37 LEU QD 1 41 VAL QG . . 3.030 1.854 1.661 2.170 . 0 0 "[ . 1 . ]" 1
1802 1 37 LEU QD 1 42 LEU H . . 5.090 4.442 3.569 5.017 . 0 0 "[ . 1 . ]" 1
1803 1 37 LEU QD 1 145 TRP HA . . 4.330 4.743 3.686 6.512 2.182 3 7 "[ *+ . *1 * -* *]" 1
1804 1 37 LEU QD 1 145 TRP QB . . 3.590 2.751 1.859 4.597 1.007 3 1 "[ + . 1 . ]" 1
1805 1 37 LEU QD 1 145 TRP HD1 . . 3.920 4.469 3.555 5.566 1.646 3 10 "[ *+-* * *1 * .* **]" 1
1806 1 37 LEU QD 1 145 TRP HE3 . . 3.080 2.938 2.150 4.225 1.145 3 1 "[ + . 1 . ]" 1
1807 1 37 LEU QD 1 145 TRP HE1 . . 5.340 4.762 3.748 5.476 0.136 18 0 "[ . 1 . ]" 1
1808 1 37 LEU QD 1 145 TRP HZ3 . . 3.560 3.603 2.680 4.235 0.675 18 2 "[- . 1 . + ]" 1
1809 1 37 LEU QD 1 145 TRP HH2 . . 5.000 4.521 3.681 5.369 0.369 18 0 "[ . 1 . ]" 1
1810 1 37 LEU QD 1 146 LEU H . . 5.440 5.171 4.000 7.307 1.867 3 3 "[ + . *1 .- ]" 1
1811 1 38 PRO HA 1 41 VAL QG . . 4.850 4.715 4.112 5.077 0.227 2 0 "[ . 1 . ]" 1
1812 1 38 PRO QB 1 41 VAL QG . . 4.280 3.584 3.372 3.878 . 0 0 "[ . 1 . ]" 1
1813 1 38 PRO QB 1 141 LEU QD . . 4.840 4.759 4.252 5.492 0.652 3 1 "[ + . 1 . ]" 1
1814 1 38 PRO QG 1 41 VAL QG . . 3.220 2.010 1.870 2.315 . 0 0 "[ . 1 . ]" 1
1815 1 39 LEU HA 1 42 LEU QD . . 3.040 3.023 2.210 3.959 0.919 8 5 "[** .- +*1 . ]" 1
1816 1 40 GLU H 1 141 LEU QD . . 5.030 4.899 4.324 5.355 0.325 13 0 "[ . 1 . ]" 1
1817 1 40 GLU HA 1 41 VAL QG . . 4.720 4.564 4.325 4.803 0.083 2 0 "[ . 1 . ]" 1
1818 1 41 VAL HA 1 142 LEU QD . . 3.260 3.124 2.593 3.630 0.370 9 0 "[ . 1 . ]" 1
1819 1 41 VAL HB 1 141 LEU QD . . 4.150 4.009 2.808 4.914 0.764 5 1 "[ + 1 . ]" 1
1820 1 41 VAL HB 1 142 LEU QD . . 3.920 3.587 1.813 4.709 0.789 13 2 "[ . - + . ]" 1
1821 1 41 VAL QG 1 42 LEU H . . 3.260 2.854 1.932 3.348 0.088 15 0 "[ . 1 . ]" 1
1822 1 41 VAL QG 1 45 MET H . . 3.890 3.863 3.373 4.624 0.734 4 1 "[ +. 1 . ]" 1
1823 1 41 VAL QG 1 45 MET QB . . 3.730 3.736 2.940 4.664 0.934 4 2 "[ +. - . ]" 1
1824 1 41 VAL QG 1 45 MET QG . . 3.140 3.114 2.507 3.956 0.816 4 4 "[* +. *1 -. ]" 1
1825 1 41 VAL QG 1 141 LEU QD . . 2.840 2.051 1.711 3.203 0.363 18 0 "[ . 1 . ]" 1
1826 1 41 VAL QG 1 142 LEU H . . 4.760 4.075 3.439 4.583 . 0 0 "[ . 1 . ]" 1
1827 1 41 VAL QG 1 142 LEU HG . . 4.180 3.901 1.867 5.037 0.857 7 2 "[ . + 1 -. ]" 1
1828 1 41 VAL QG 1 142 LEU QD . . 2.980 2.018 1.637 2.680 . 0 0 "[ . 1 . ]" 1
1829 1 41 VAL QG 1 145 TRP H . . 4.290 4.130 3.371 4.832 0.542 3 1 "[ + . 1 . ]" 1
1830 1 41 VAL QG 1 145 TRP HE3 . . 4.480 4.297 3.689 5.272 0.792 14 1 "[ . 1 +. ]" 1
1831 1 41 VAL QG 1 146 LEU QD . . 3.080 3.144 1.944 4.397 1.317 14 6 "[- * .* *1 +.* ]" 1
1832 1 42 LEU H 1 42 LEU QD . . 3.260 3.260 2.050 3.717 0.457 3 0 "[ . 1 . ]" 1
1833 1 42 LEU H 1 44 GLU QB . . 4.980 4.746 4.512 5.021 0.041 19 0 "[ . 1 . ]" 1
1834 1 42 LEU HA 1 42 LEU QD . . 2.790 2.303 1.932 3.071 0.281 7 0 "[ . 1 . ]" 1
1835 1 42 LEU QD 1 44 GLU H . . 5.140 4.715 3.977 5.194 0.054 18 0 "[ . 1 . ]" 1
1836 1 42 LEU QD 1 45 MET H . . 4.500 4.589 3.936 5.162 0.662 3 4 "[ +*. - 1 * . ]" 1
1837 1 42 LEU QD 1 45 MET QB . . 4.830 3.699 2.823 4.339 . 0 0 "[ . 1 . ]" 1
1838 1 42 LEU QD 1 45 MET QG . . 4.280 4.714 3.561 5.664 1.384 3 9 "[ *+** * *1 * * -]" 1
1839 1 43 LYS H 1 44 GLU QB . . 4.620 4.417 4.203 4.615 . 0 0 "[ . 1 . ]" 1
1840 1 43 LYS QG 1 44 GLU QB . . 4.460 3.290 2.914 5.091 0.631 19 1 "[ . 1 . +]" 1
1841 1 44 GLU H 1 141 LEU QD . . 4.420 4.745 3.672 5.839 1.419 17 7 "[ *.* * * - *. + ]" 1
1842 1 44 GLU QB 1 45 MET H . . 2.990 2.517 2.270 2.821 . 0 0 "[ . 1 . ]" 1
1843 1 44 GLU QB 1 48 ASN QD . . 4.760 4.017 3.380 4.643 . 0 0 "[ . 1 . ]" 1
1844 1 44 GLU QB 1 142 LEU QD . . 3.130 2.323 1.842 3.267 0.137 9 0 "[ . 1 . ]" 1
1845 1 45 MET HA 1 136 VAL QG . . 3.240 3.519 2.377 5.192 1.952 13 5 "[ * . * 1 + .* - ]" 1
1846 1 45 MET ME 1 133 LEU QD . . 3.820 3.815 2.960 6.257 2.437 18 3 "[ *. - 1 . + ]" 1
1847 1 45 MET ME 1 136 VAL QG . . 2.400 3.183 1.839 6.139 3.739 7 10 "[ * ***+ * ** .- * ]" 1
1848 1 46 GLU H 1 142 LEU QD . . 4.600 4.872 4.330 5.615 1.015 9 3 "[ - . +1 . *]" 1
1849 1 46 GLU QB 1 59 LEU QD . . 4.790 3.126 2.429 3.982 . 0 0 "[ . 1 . ]" 1
1850 1 49 ALA H 1 59 LEU QD . . 5.250 4.680 3.642 5.390 0.140 10 0 "[ . 1 . ]" 1
1851 1 49 ALA H 1 133 LEU QD . . 4.520 4.492 3.236 5.445 0.925 10 3 "[ *- + . ]" 1
1852 1 49 ALA H 1 136 VAL QG . . 4.340 3.670 2.739 5.550 1.210 11 2 "[ . 1+- . ]" 1
1853 1 49 ALA HA 1 59 LEU QD . . 4.660 4.738 3.662 5.415 0.755 17 3 "[ - . * . + ]" 1
1854 1 49 ALA HA 1 133 LEU QD . . 4.160 3.918 2.568 4.692 0.532 10 1 "[ . + . ]" 1
1855 1 49 ALA MB 1 133 LEU QD . . 2.950 2.423 1.709 3.102 0.152 10 0 "[ . 1 . ]" 1
1856 1 50 ARG H 1 59 LEU QD . . 4.650 4.226 3.460 4.876 0.226 7 0 "[ . 1 . ]" 1
1857 1 52 ALA H 1 53 GLY QA . . 4.980 4.447 4.348 4.495 . 0 0 "[ . 1 . ]" 1
1858 1 54 CYS H 1 59 LEU QD . . 5.440 5.154 4.652 5.540 0.100 9 0 "[ . 1 . ]" 1
1859 1 54 CYS QB 1 59 LEU QD . . 4.030 2.925 2.285 3.471 . 0 0 "[ . 1 . ]" 1
1860 1 55 THR H 1 59 LEU QD . . 4.660 4.198 3.458 4.953 0.293 11 0 "[ . 1 . ]" 1
1861 1 55 THR HA 1 56 ARG QB . . 4.650 4.344 4.086 4.601 . 0 0 "[ . 1 . ]" 1
1862 1 56 ARG H 1 59 LEU QD . . 5.440 4.677 3.577 5.467 0.027 13 0 "[ . 1 . ]" 1
1863 1 56 ARG HA 1 59 LEU QB . . 4.270 3.631 3.090 4.189 . 0 0 "[ . 1 . ]" 1
1864 1 56 ARG HA 1 59 LEU QD . . 3.230 2.931 1.919 3.890 0.660 13 2 "[ . -1 + . ]" 1
1865 1 56 ARG QB 1 60 ILE MG . . 5.340 5.166 4.759 5.553 0.213 13 0 "[ . 1 . ]" 1
1866 1 57 GLY H 1 58 CYS QB . . 4.880 4.539 4.329 4.928 0.048 15 0 "[ . 1 . ]" 1
1867 1 58 CYS H 1 59 LEU QD . . 5.290 4.580 3.563 5.132 . 0 0 "[ . 1 . ]" 1
1868 1 58 CYS H 1 124 ASP QB . . 4.430 4.213 3.500 4.746 0.316 16 0 "[ . 1 . ]" 1
1869 1 58 CYS QB 1 59 LEU H . . 3.730 2.119 1.917 2.272 . 0 0 "[ . 1 . ]" 1
1870 1 58 CYS QB 1 59 LEU QD . . 4.520 3.563 2.831 4.045 . 0 0 "[ . 1 . ]" 1
1871 1 58 CYS QB 1 124 ASP QB . . 5.180 3.586 1.982 4.634 . 0 0 "[ . 1 . ]" 1
1872 1 59 LEU H 1 59 LEU QB . . 3.610 2.548 2.288 2.670 . 0 0 "[ . 1 . ]" 1
1873 1 59 LEU H 1 62 LEU QD . . 4.990 4.019 3.242 4.668 . 0 0 "[ . 1 . ]" 1
1874 1 59 LEU HA 1 62 LEU QD . . 4.250 2.475 1.848 3.037 . 0 0 "[ . 1 . ]" 1
1875 1 59 LEU QB 1 60 ILE H . . 3.760 2.534 2.383 2.693 . 0 0 "[ . 1 . ]" 1
1876 1 59 LEU QB 1 60 ILE MG . . 5.340 5.134 5.064 5.222 . 0 0 "[ . 1 . ]" 1
1877 1 59 LEU QB 1 60 ILE MD . . 5.180 3.960 2.548 4.756 . 0 0 "[ . 1 . ]" 1
1878 1 59 LEU QD 1 62 LEU H . . 4.930 5.228 4.881 5.471 0.541 19 4 "[ . -* 1 * . +]" 1
1879 1 59 LEU QD 1 62 LEU HG . . 4.260 4.430 3.716 5.381 1.121 3 5 "[- + * * 1 . *]" 1
1880 1 61 CYS H 1 61 CYS QB . . 3.150 2.203 2.086 2.262 . 0 0 "[ . 1 . ]" 1
1881 1 61 CYS H 1 62 LEU QD . . 4.440 4.104 3.646 4.595 0.155 5 0 "[ . 1 . ]" 1
1882 1 61 CYS HA 1 62 LEU QD . . 4.430 4.744 4.350 5.218 0.788 5 6 "[ ** + * 1 * -. ]" 1
1883 1 61 CYS QB 1 63 SER H . . 5.030 4.501 4.358 4.671 . 0 0 "[ . 1 . ]" 1
1884 1 62 LEU HA 1 119 VAL QG . . 4.770 3.969 3.359 4.651 . 0 0 "[ . 1 . ]" 1
1885 1 62 LEU HG 1 133 LEU QD . . 5.260 4.985 3.812 7.391 2.131 12 2 "[ . - 1 + . ]" 1
1886 1 62 LEU QD 1 122 CYS HA . . 4.590 4.938 4.002 5.463 0.873 6 8 "[ * *-+* 1 ** * ]" 1
1887 1 62 LEU QD 1 122 CYS QB . . 3.260 2.583 1.834 3.097 . 0 0 "[ . 1 . ]" 1
1888 1 62 LEU QD 1 124 ASP QB . . 4.460 4.656 3.903 5.375 0.915 16 6 "[* ** 1 - .+ * ]" 1
1889 1 62 LEU QD 1 125 CYS H . . 4.180 4.578 3.460 5.065 0.885 16 8 "[** *. * 1 * -.+ * ]" 1
1890 1 62 LEU QD 1 133 LEU QD . . 3.160 2.795 1.831 4.693 1.533 12 2 "[ . - 1 + . ]" 1
1891 1 63 SER H 1 63 SER QB . . 3.140 2.299 2.107 2.524 . 0 0 "[ . 1 . ]" 1
1892 1 63 SER QB 1 64 HIS H . . 3.830 3.231 2.814 3.595 . 0 0 "[ . 1 . ]" 1
1893 1 63 SER QB 1 64 HIS HD2 . . 3.840 3.149 2.472 3.843 0.003 10 0 "[ . 1 . ]" 1
1894 1 65 ILE MG 1 119 VAL QG . . 3.660 3.401 3.046 4.239 0.579 17 1 "[ . 1 . + ]" 1
1895 1 65 ILE QG 1 119 VAL QG . . 3.750 3.616 1.965 4.400 0.650 7 3 "[ . + 1 -*. ]" 1
1896 1 65 ILE MD 1 119 VAL QG . . 2.880 2.066 1.714 2.649 . 0 0 "[ . 1 . ]" 1
1897 1 66 LYS QB 1 98 VAL QG . . 3.130 1.902 1.638 2.470 . 0 0 "[ . 1 . ]" 1
1898 1 66 LYS QD 1 98 VAL QG . . 3.330 3.321 2.682 3.804 0.474 16 0 "[ . 1 . ]" 1
1899 1 66 LYS QE 1 98 VAL QG . . 3.940 3.189 1.999 3.980 0.040 19 0 "[ . 1 . ]" 1
1900 1 67 CYS H 1 98 VAL QG . . 4.140 2.853 2.188 3.682 . 0 0 "[ . 1 . ]" 1
1901 1 67 CYS QB 1 68 THR H . . 4.270 2.866 2.489 3.524 . 0 0 "[ . 1 . ]" 1
1902 1 67 CYS QB 1 68 THR MG . . 4.340 4.331 4.061 4.690 0.350 8 0 "[ . 1 . ]" 1
1903 1 67 CYS QB 1 71 MET QG . . 4.710 4.010 2.310 5.163 0.453 2 0 "[ . 1 . ]" 1
1904 1 67 CYS QB 1 71 MET ME . . 3.560 3.386 2.520 4.477 0.917 12 3 "[ . * 1 + . - ]" 1
1905 1 67 CYS QB 1 72 LYS H . . 5.010 4.671 4.199 5.440 0.430 8 0 "[ . 1 . ]" 1
1906 1 67 CYS QB 1 72 LYS HA . . 5.220 5.206 4.004 5.766 0.546 17 1 "[ . 1 . + ]" 1
1907 1 67 CYS QB 1 72 LYS QG . . 3.610 3.998 2.424 5.215 1.605 7 9 "[* -*. + ** .*** ]" 1
1908 1 68 THR H 1 71 MET QG . . 4.270 3.206 1.912 4.047 . 0 0 "[ . 1 . ]" 1
1909 1 69 PRO QD 1 98 VAL QG . . 3.950 3.158 2.362 4.145 0.195 6 0 "[ . 1 . ]" 1
1910 1 70 LYS HA 1 73 LYS QB . . 3.580 2.938 2.575 3.652 0.072 5 0 "[ . 1 . ]" 1
1911 1 71 MET ME 1 71 MET QG . . 3.290 2.303 2.058 2.641 . 0 0 "[ . 1 . ]" 1
1912 1 71 MET QG 1 72 LYS H . . 5.000 3.024 1.872 4.406 . 0 0 "[ . 1 . ]" 1
1913 1 71 MET QG 1 72 LYS QG . . 5.010 4.084 2.508 5.464 0.454 9 0 "[ . 1 . ]" 1
1914 1 71 MET ME 1 119 VAL QG . . 5.040 5.099 4.703 5.428 0.388 8 0 "[ . 1 . ]" 1
1915 1 72 LYS H 1 72 LYS QD . . 4.110 3.916 2.988 4.551 0.441 6 0 "[ . 1 . ]" 1
1916 1 72 LYS H 1 73 LYS QB . . 4.680 4.427 4.226 4.517 . 0 0 "[ . 1 . ]" 1
1917 1 73 LYS H 1 73 LYS QG . . 4.050 3.944 3.810 3.976 . 0 0 "[ . 1 . ]" 1
1918 1 73 LYS HA 1 73 LYS QG . . 2.940 2.511 2.305 2.700 . 0 0 "[ . 1 . ]" 1
1919 1 73 LYS QB 1 74 PHE H . . 3.490 2.535 2.259 2.782 . 0 0 "[ . 1 . ]" 1
1920 1 73 LYS QB 1 74 PHE QD . . 3.590 2.414 2.185 2.747 . 0 0 "[ . 1 . ]" 1
1921 1 73 LYS QB 1 74 PHE QE . . 4.170 3.465 3.036 3.939 . 0 0 "[ . 1 . ]" 1
1922 1 73 LYS QG 1 74 PHE H . . 4.110 3.398 2.723 3.784 . 0 0 "[ . 1 . ]" 1
1923 1 73 LYS QG 1 74 PHE HA . . 4.670 3.516 2.982 3.849 . 0 0 "[ . 1 . ]" 1
1924 1 73 LYS QG 1 74 PHE QD . . 3.900 3.119 2.400 3.691 . 0 0 "[ . 1 . ]" 1
1925 1 73 LYS QG 1 74 PHE QE . . 4.020 3.569 3.040 4.105 0.085 6 0 "[ . 1 . ]" 1
1926 1 73 LYS QG 1 74 PHE HZ . . 4.860 4.976 4.436 5.353 0.493 6 0 "[ . 1 . ]" 1
1927 1 74 PHE HA 1 111 PRO QG . . 5.350 4.752 4.407 5.496 0.146 7 0 "[ . 1 . ]" 1
1928 1 74 PHE HB3 1 111 PRO QG . . 4.340 2.847 2.071 3.637 . 0 0 "[ . 1 . ]" 1
1929 1 74 PHE QD 1 111 PRO QG . . 3.350 2.886 2.435 3.465 0.115 7 0 "[ . 1 . ]" 1
1930 1 74 PHE QD 1 111 PRO QD . . 4.700 4.072 3.532 4.877 0.177 7 0 "[ . 1 . ]" 1
1931 1 75 ILE MG 1 76 PRO QD . . 4.120 3.616 3.481 3.742 . 0 0 "[ . 1 . ]" 1
1932 1 75 ILE MG 1 111 PRO QG . . 4.400 3.670 2.855 4.166 . 0 0 "[ . 1 . ]" 1
1933 1 76 PRO QB 1 77 GLY QA . . 5.340 3.698 3.622 3.825 . 0 0 "[ . 1 . ]" 1
1934 1 77 GLY H 1 78 ARG QB . . 4.600 4.437 4.132 4.980 0.380 3 0 "[ . 1 . ]" 1
1935 1 77 GLY H 1 79 CYS QB . . 4.900 4.850 4.058 6.058 1.158 8 3 "[ . -+ 1 * ]" 1
1936 1 78 ARG H 1 79 CYS QB . . 4.550 4.296 3.856 5.089 0.539 8 1 "[ . + 1 . ]" 1
1937 1 78 ARG HA 1 78 ARG QD . . 4.090 2.500 1.974 3.615 . 0 0 "[ . 1 . ]" 1
1938 1 78 ARG QD 1 115 PHE QE . . 3.480 3.551 3.224 4.149 0.669 10 1 "[ . + . ]" 1
1939 1 78 ARG QD 1 115 PHE HZ . . 4.050 4.077 3.277 4.545 0.495 10 0 "[ . 1 . ]" 1
1940 1 80 HIS QB 1 80 HIS HE1 . . 4.610 4.400 4.344 4.538 . 0 0 "[ . 1 . ]" 1
1941 1 80 HIS QB 1 81 THR H . . 4.360 3.837 3.746 3.916 . 0 0 "[ . 1 . ]" 1
1942 1 81 THR MG 1 83 GLU QB . . 4.100 4.556 3.060 6.150 2.050 18 9 "[*** * * 1 -*. *+ ]" 1
1943 1 82 TYR QB 1 83 GLU QB . . 4.330 4.178 3.680 4.836 0.506 14 1 "[ . 1 +. ]" 1
1944 1 83 GLU HA 1 83 GLU QB . . 2.630 2.298 2.148 2.538 . 0 0 "[ . 1 . ]" 1
1945 1 83 GLU QB 1 83 GLU QG . . 2.260 2.029 1.989 2.086 . 0 0 "[ . 1 . ]" 1
1946 1 98 VAL H 1 98 VAL QG . . 3.880 2.697 1.916 3.066 . 0 0 "[ . 1 . ]" 1
1947 1 98 VAL QG 1 99 ASP H . . 3.100 2.833 2.142 3.349 0.249 17 0 "[ . 1 . ]" 1
1948 1 98 VAL QG 1 99 ASP HA . . 4.020 3.543 3.290 3.770 . 0 0 "[ . 1 . ]" 1
1949 1 98 VAL QG 1 99 ASP QB . . 4.550 4.333 3.898 4.675 0.125 11 0 "[ . 1 . ]" 1
1950 1 98 VAL QG 1 100 ILE QG . . 3.390 3.551 2.859 4.064 0.674 7 3 "[- . + 1 * . ]" 1
1951 1 98 VAL QG 1 100 ILE MD . . 2.810 3.182 2.406 3.999 1.189 16 5 "[* *-. 1 * .+ ]" 1
1952 1 98 VAL QG 1 106 PHE QE . . 3.450 2.813 1.935 3.652 0.202 6 0 "[ . 1 . ]" 1
1953 1 98 VAL QG 1 106 PHE HZ . . 3.720 3.054 2.403 3.717 . 0 0 "[ . 1 . ]" 1
1954 1 98 VAL QG 1 118 GLN QB . . 5.040 5.472 4.694 6.184 1.144 7 9 "[* *. + 1 *-*** * ]" 1
1955 1 98 VAL QG 1 118 GLN QG . . 4.700 4.696 3.983 6.343 1.643 3 2 "[ + . 1 . - ]" 1
1956 1 99 ASP HA 1 100 ILE QG . . 4.600 3.406 3.232 3.838 . 0 0 "[ . 1 . ]" 1
1957 1 99 ASP HA 1 107 LYS QG . . 5.230 5.235 4.850 5.777 0.547 13 1 "[ . 1 + . ]" 1
1958 1 100 ILE H 1 100 ILE QG . . 3.530 2.369 1.988 2.906 . 0 0 "[ . 1 . ]" 1
1959 1 100 ILE HA 1 121 LEU QD . . 4.960 4.418 3.825 4.786 . 0 0 "[ . 1 . ]" 1
1960 1 100 ILE HB 1 121 LEU QD . . 3.630 3.788 3.389 3.969 0.339 8 0 "[ . 1 . ]" 1
1961 1 100 ILE MG 1 121 LEU QD . . 2.740 1.823 1.663 1.951 . 0 0 "[ . 1 . ]" 1
1962 1 100 ILE QG 1 106 PHE HZ . . 4.720 3.590 3.004 4.030 . 0 0 "[ . 1 . ]" 1
1963 1 101 PRO QD 1 121 LEU QD . . 4.880 3.790 3.274 4.101 . 0 0 "[ . 1 . ]" 1
1964 1 102 ALA HA 1 121 LEU QD . . 4.060 4.185 3.787 4.619 0.559 5 3 "[* + 1 .- ]" 1
1965 1 103 ILE HA 1 121 LEU QD . . 5.250 4.575 3.957 4.885 . 0 0 "[ . 1 . ]" 1
1966 1 103 ILE QG 1 121 LEU QD . . 3.150 2.099 1.713 2.520 . 0 0 "[ . 1 . ]" 1
1967 1 105 ARG QG 1 109 LEU QD . . 2.720 2.090 1.845 2.660 . 0 0 "[ . 1 . ]" 1
1968 1 105 ARG QD 1 109 LEU QD . . 3.730 3.028 1.855 3.820 0.090 17 0 "[ . 1 . ]" 1
1969 1 105 ARG HE 1 109 LEU QD . . 4.540 3.777 2.206 4.829 0.289 12 0 "[ . 1 . ]" 1
1970 1 106 PHE H 1 109 LEU QD . . 3.920 3.488 3.091 3.869 . 0 0 "[ . 1 . ]" 1
1971 1 106 PHE QB 1 109 LEU QD . . 4.390 3.270 2.714 3.733 . 0 0 "[ . 1 . ]" 1
1972 1 106 PHE QD 1 109 LEU QD . . 3.970 3.960 3.504 4.256 0.286 10 0 "[ . 1 . ]" 1
1973 1 107 LYS H 1 107 LYS QG . . 3.090 2.633 2.002 3.674 0.584 10 4 "[ * . + *- . ]" 1
1974 1 107 LYS H 1 108 ASP QB . . 4.660 4.486 4.282 4.618 . 0 0 "[ . 1 . ]" 1
1975 1 107 LYS HA 1 107 LYS QG . . 3.540 3.352 3.196 3.432 . 0 0 "[ . 1 . ]" 1
1976 1 107 LYS QG 1 108 ASP H . . 3.420 2.323 1.918 3.543 0.123 12 0 "[ . 1 . ]" 1
1977 1 107 LYS QG 1 108 ASP HA . . 3.660 3.790 3.349 4.190 0.530 17 2 "[ . - 1 . + ]" 1
1978 1 108 ASP H 1 109 LEU QD . . 3.740 3.870 3.291 4.465 0.725 11 1 "[ . 1+ . ]" 1
1979 1 108 ASP QB 1 109 LEU H . . 3.850 3.508 3.055 3.699 . 0 0 "[ . 1 . ]" 1
1980 1 109 LEU HA 1 110 GLU QG . . 4.140 3.925 3.506 4.424 0.284 1 0 "[ . 1 . ]" 1
1981 1 109 LEU QD 1 110 GLU QG . . 3.680 3.851 2.891 4.780 1.100 3 7 "[* + ** - 1 .** ]" 1
1982 1 109 LEU QD 1 113 GLU H . . 5.440 5.131 4.591 5.552 0.112 3 0 "[ . 1 . ]" 1
1983 1 109 LEU QD 1 113 GLU QB . . 3.860 2.742 2.114 3.067 . 0 0 "[ . 1 . ]" 1
1984 1 109 LEU QD 1 114 GLN QG . . 4.380 3.953 3.230 5.618 1.238 10 2 "[ . + . -]" 1
1985 1 110 GLU H 1 110 GLU QB . . 3.310 2.614 2.243 2.846 . 0 0 "[ . 1 . ]" 1
1986 1 110 GLU H 1 111 PRO QD . . 4.480 4.315 4.305 4.338 . 0 0 "[ . 1 . ]" 1
1987 1 110 GLU HA 1 110 GLU QG . . 3.610 2.871 2.228 3.272 . 0 0 "[ . 1 . ]" 1
1988 1 110 GLU QB 1 111 PRO QD . . 3.510 1.804 1.661 1.891 . 0 0 "[ . 1 . ]" 1
1989 1 110 GLU QB 1 113 GLU H . . 4.010 2.776 2.306 3.011 . 0 0 "[ . 1 . ]" 1
1990 1 110 GLU QG 1 111 PRO QD . . 4.260 3.532 3.026 3.812 . 0 0 "[ . 1 . ]" 1
1991 1 110 GLU QG 1 113 GLU QB . . 3.900 2.722 1.849 4.049 0.149 16 0 "[ . 1 . ]" 1
1992 1 111 PRO QG 1 112 MET H . . 4.230 2.072 1.957 2.216 . 0 0 "[ . 1 . ]" 1
1993 1 112 MET QG 1 116 ILE QG . . 5.340 4.557 3.618 5.818 0.478 13 0 "[ . 1 . ]" 1
1994 1 112 MET ME 1 116 ILE QG . . 3.410 3.646 2.786 4.010 0.600 13 1 "[ . 1 + . ]" 1
1995 1 113 GLU H 1 113 GLU QG . . 3.140 3.603 2.425 4.064 0.924 13 13 "[****** **-*+*. *]" 1
1996 1 113 GLU HA 1 116 ILE QG . . 4.660 4.285 3.928 4.626 . 0 0 "[ . 1 . ]" 1
1997 1 113 GLU QG 1 116 ILE MG . . 4.970 4.090 3.367 5.294 0.324 18 0 "[ . 1 . ]" 1
1998 1 113 GLU QG 1 116 ILE MD . . 4.360 4.576 3.821 5.230 0.870 13 4 "[ * *. 1 -+ . ]" 1
1999 1 115 PHE HA 1 119 VAL QG . . 4.690 3.912 3.631 4.149 . 0 0 "[ . 1 . ]" 1
2000 1 115 PHE QB 1 119 VAL QG . . 4.730 4.159 3.822 4.421 . 0 0 "[ . 1 . ]" 1
2001 1 115 PHE QD 1 119 VAL QG . . 3.670 3.213 2.622 3.511 . 0 0 "[ . 1 . ]" 1
2002 1 115 PHE QE 1 119 VAL QG . . 3.120 2.866 2.538 3.186 0.066 8 0 "[ . 1 . ]" 1
2003 1 115 PHE HZ 1 119 VAL QG . . 4.400 3.090 2.808 3.588 . 0 0 "[ . 1 . ]" 1
2004 1 116 ILE H 1 119 VAL QG . . 4.860 4.198 3.754 4.566 . 0 0 "[ . 1 . ]" 1
2005 1 116 ILE MG 1 119 VAL QG . . 4.460 3.693 2.815 4.167 . 0 0 "[ . 1 . ]" 1
2006 1 117 ALA MB 1 119 VAL QG . . 5.340 5.058 4.429 5.275 . 0 0 "[ . 1 . ]" 1
2007 1 118 GLN H 1 119 VAL QG . . 3.730 4.039 3.480 4.251 0.521 3 2 "[ + . 1 . - ]" 1
2008 1 118 GLN H 1 121 LEU QD . . 4.030 4.130 3.560 4.842 0.812 15 2 "[ - . 1 + ]" 1
2009 1 118 GLN QB 1 121 LEU QD . . 3.900 3.590 3.162 4.289 0.389 15 0 "[ . 1 . ]" 1
2010 1 118 GLN QG 1 121 LEU QD . . 4.900 3.417 3.025 4.998 0.098 3 0 "[ . 1 . ]" 1
2011 1 119 VAL QG 1 120 ASP HA . . 4.090 3.465 3.186 3.818 . 0 0 "[ . 1 . ]" 1
2012 1 119 VAL QG 1 120 ASP HB2 . . 4.810 4.175 2.823 4.657 . 0 0 "[ . 1 . ]" 1
2013 1 119 VAL QG 1 121 LEU H . . 5.140 4.587 3.991 4.723 . 0 0 "[ . 1 . ]" 1
2014 1 119 VAL QG 1 133 LEU QD . . 4.590 5.272 4.091 7.697 3.107 12 8 "[ * . ** 1 +*-. * *]" 1
2015 1 120 ASP H 1 121 LEU QD . . 4.730 4.570 3.316 4.971 0.241 15 0 "[ . 1 . ]" 1
2016 1 120 ASP HB2 1 121 LEU QD . . 5.440 4.900 3.252 5.464 0.024 15 0 "[ . 1 . ]" 1
2017 1 120 ASP HB3 1 121 LEU QD . . 4.610 3.735 2.211 4.309 . 0 0 "[ . 1 . ]" 1
2018 1 121 LEU H 1 121 LEU QD . . 3.200 3.012 1.838 3.299 0.099 15 0 "[ . 1 . ]" 1
2019 1 121 LEU H 1 122 CYS QB . . 4.840 4.610 4.379 4.880 0.040 12 0 "[ . 1 . ]" 1
2020 1 121 LEU HA 1 121 LEU QD . . 2.610 2.112 1.918 2.460 . 0 0 "[ . 1 . ]" 1
2021 1 123 VAL H 1 124 ASP QB . . 4.710 4.424 3.943 4.900 0.190 15 0 "[ . 1 . ]" 1
2022 1 123 VAL HA 1 125 CYS QB . . 5.160 4.642 3.916 5.484 0.324 16 0 "[ . 1 . ]" 1
2023 1 124 ASP H 1 125 CYS QB . . 4.240 4.021 3.604 4.524 0.284 17 0 "[ . 1 . ]" 1
2024 1 124 ASP QB 1 125 CYS H . . 3.930 3.431 2.899 3.536 . 0 0 "[ . 1 . ]" 1
2025 1 125 CYS QB 1 126 THR H . . 3.470 2.999 2.810 3.509 0.039 8 0 "[ . 1 . ]" 1
2026 1 125 CYS QB 1 130 LEU HG . . 4.610 2.900 2.142 4.101 . 0 0 "[ . 1 . ]" 1
2027 1 125 CYS QB 1 130 LEU QD . . 3.320 2.286 1.892 3.081 . 0 0 "[ . 1 . ]" 1
2028 1 126 THR MG 1 129 CYS QB . . 4.350 3.342 3.036 3.899 . 0 0 "[ . 1 . ]" 1
2029 1 127 THR HB 1 130 LEU QD . . 4.840 4.573 3.994 5.348 0.508 5 1 "[ + 1 . ]" 1
2030 1 127 THR MG 1 130 LEU QD . . 3.570 3.030 2.530 3.573 0.003 5 0 "[ . 1 . ]" 1
2031 1 128 GLY H 1 129 CYS QB . . 5.030 4.474 4.300 4.904 . 0 0 "[ . 1 . ]" 1
2032 1 128 GLY H 1 130 LEU QD . . 4.860 5.044 4.454 5.601 0.741 5 1 "[ + 1 . ]" 1
2033 1 128 GLY H 1 131 LYS QG . . 4.830 4.458 4.166 5.345 0.515 19 1 "[ . 1 . +]" 1
2034 1 128 GLY QA 1 131 LYS QG . . 4.130 2.352 1.965 3.828 . 0 0 "[ . 1 . ]" 1
2035 1 129 CYS QB 1 130 LEU H . . 3.630 2.654 2.316 3.558 . 0 0 "[ . 1 . ]" 1
2036 1 129 CYS QB 1 130 LEU QD . . 4.940 3.713 2.753 5.101 0.161 2 0 "[ . 1 . ]" 1
2037 1 129 CYS QB 1 132 GLY H . . 5.340 4.886 4.677 4.992 . 0 0 "[ . 1 . ]" 1
2038 1 130 LEU H 1 133 LEU QD . . 5.440 4.459 3.702 5.442 0.002 13 0 "[ . 1 . ]" 1
2039 1 130 LEU HA 1 133 LEU QD . . 3.980 2.682 1.936 3.732 . 0 0 "[ . 1 . ]" 1
2040 1 130 LEU QD 1 132 GLY H . . 5.440 5.284 5.054 5.444 0.004 3 0 "[ . 1 . ]" 1
2041 1 130 LEU QD 1 133 LEU QD . . 4.260 3.284 2.617 4.735 0.475 7 0 "[ . 1 . ]" 1
2042 1 131 LYS HA 1 131 LYS QG . . 3.320 3.212 2.392 3.425 0.105 13 0 "[ . 1 . ]" 1
2043 1 131 LYS QG 1 135 ASN QD . . 4.560 4.015 2.652 5.010 0.450 18 0 "[ . 1 . ]" 1
2044 1 133 LEU H 1 133 LEU QD . . 3.590 2.973 1.903 3.702 0.112 13 0 "[ . 1 . ]" 1
2045 1 133 LEU H 1 136 VAL QG . . 4.310 4.325 3.689 5.435 1.125 11 6 "[* . * 1+* * -]" 1
2046 1 133 LEU HA 1 133 LEU QD . . 2.930 2.453 1.970 2.934 0.004 15 0 "[ . 1 . ]" 1
2047 1 133 LEU QB 1 133 LEU QD . . 2.810 1.836 1.727 2.028 . 0 0 "[ . 1 . ]" 1
2048 1 133 LEU QD 1 134 ALA H . . 4.790 4.050 3.779 4.227 . 0 0 "[ . 1 . ]" 1
2049 1 133 LEU QD 1 134 ALA MB . . 5.020 4.586 4.098 4.767 . 0 0 "[ . 1 . ]" 1
2050 1 134 ALA H 1 136 VAL QG . . 4.910 3.983 3.588 4.551 . 0 0 "[ . 1 . ]" 1
2051 1 134 ALA HA 1 136 VAL QG . . 4.040 3.416 3.022 4.117 0.077 9 0 "[ . 1 . ]" 1
2052 1 135 ASN H 1 136 VAL QG . . 4.890 3.648 3.131 4.265 . 0 0 "[ . 1 . ]" 1
2053 1 136 VAL QG 1 138 CYS HA . . 5.100 4.192 3.118 6.349 1.249 2 1 "[ + . 1 . ]" 1
2054 1 136 VAL QG 1 138 CYS QB . . 4.560 4.987 4.232 5.880 1.320 13 10 "[-**** * 1 +*. **]" 1
2055 1 136 VAL QG 1 139 SER H . . 4.280 4.765 3.352 6.083 1.803 7 11 "[ **** + * **.-** ]" 1
2056 1 136 VAL QG 1 139 SER QB . . 4.480 4.944 3.456 6.686 2.206 7 8 "[ ** + * *-. ** ]" 1
2057 1 138 CYS QB 1 142 LEU QD . . 4.460 4.299 2.216 6.050 1.590 12 4 "[ -* . * 1 + . ]" 1
2058 1 138 CYS QB 1 143 LYS H . . 4.840 4.432 3.188 6.087 1.247 12 4 "[ *- . * + . ]" 1
2059 1 139 SER H 1 142 LEU QD . . 4.510 2.863 1.907 4.233 . 0 0 "[ . 1 . ]" 1
2060 1 139 SER QB 1 140 ASP H . . 3.210 2.607 2.243 3.025 . 0 0 "[ . 1 . ]" 1
2061 1 139 SER QB 1 140 ASP QB . . 4.560 3.961 3.600 4.536 . 0 0 "[ . 1 . ]" 1
2062 1 139 SER QB 1 141 LEU H . . 3.570 2.733 2.467 3.854 0.284 12 0 "[ . 1 . ]" 1
2063 1 139 SER QB 1 142 LEU H . . 3.550 2.523 2.098 3.095 . 0 0 "[ . 1 . ]" 1
2064 1 139 SER QB 1 142 LEU QD . . 3.620 2.350 1.840 3.540 . 0 0 "[ . 1 . ]" 1
2065 1 140 ASP QB 1 141 LEU QD . . 4.650 4.238 3.173 5.052 0.402 13 0 "[ . 1 . ]" 1
2066 1 141 LEU QD 1 144 LYS H . . 4.260 3.921 3.664 4.160 . 0 0 "[ . 1 . ]" 1
2067 1 141 LEU QD 1 144 LYS HA . . 5.280 5.215 4.950 5.486 0.206 10 0 "[ . 1 . ]" 1
2068 1 141 LEU QD 1 144 LYS QB . . 2.980 2.691 2.449 2.917 . 0 0 "[ . 1 . ]" 1
2069 1 141 LEU QD 1 144 LYS QD . . 3.640 2.827 2.185 3.363 . 0 0 "[ . 1 . ]" 1
2070 1 141 LEU QD 1 144 LYS QE . . 4.300 3.252 1.970 4.268 . 0 0 "[ . 1 . ]" 1
2071 1 141 LEU QD 1 145 TRP HA . . 5.370 5.103 4.879 5.374 0.004 6 0 "[ . 1 . ]" 1
2072 1 141 LEU QD 1 145 TRP HD1 . . 2.970 2.016 1.898 2.220 . 0 0 "[ . 1 . ]" 1
2073 1 141 LEU QD 1 145 TRP HZ2 . . 4.010 4.160 3.743 4.596 0.586 10 1 "[ . + . ]" 1
2074 1 141 LEU QD 1 146 LEU H . . 5.410 5.365 4.941 5.758 0.348 14 0 "[ . 1 . ]" 1
2075 1 142 LEU QB 1 146 LEU QD . . 3.350 3.226 2.313 4.163 0.813 8 2 "[ . -+ 1 . ]" 1
2076 1 142 LEU QD 1 143 LYS H . . 4.650 3.933 3.703 4.321 . 0 0 "[ . 1 . ]" 1
2077 1 142 LEU QD 1 143 LYS QB . . 5.330 4.998 4.714 5.352 0.022 5 0 "[ . 1 . ]" 1
2078 1 142 LEU QD 1 145 TRP H . . 4.750 4.546 4.151 5.278 0.528 10 1 "[ . + . ]" 1
2079 1 142 LEU QD 1 145 TRP HD1 . . 4.440 4.450 3.706 5.265 0.825 10 1 "[ . + . ]" 1
2080 1 142 LEU QD 1 146 LEU H . . 3.850 4.156 3.068 4.892 1.042 13 7 "[* .- * +*.** ]" 1
2081 1 143 LYS HA 1 146 LEU QD . . 4.570 4.554 4.070 5.217 0.647 10 2 "[ - + . ]" 1
2082 1 143 LYS HA 1 147 PRO QD . . 4.570 4.812 4.057 5.285 0.715 6 7 "[ -* *+ * *.* ]" 1
2083 1 144 LYS H 1 144 LYS QG . . 4.130 4.004 3.939 4.062 . 0 0 "[ . 1 . ]" 1
2084 1 144 LYS HA 1 144 LYS QG . . 3.380 2.463 2.343 2.556 . 0 0 "[ . 1 . ]" 1
2085 1 144 LYS QG 1 145 TRP H . . 4.730 3.884 3.579 4.077 . 0 0 "[ . 1 . ]" 1
2086 1 144 LYS QG 1 145 TRP HD1 . . 5.230 4.364 3.646 4.868 . 0 0 "[ . 1 . ]" 1
2087 1 144 LYS QG 1 145 TRP HE1 . . 5.180 4.943 4.413 5.350 0.170 3 0 "[ . 1 . ]" 1
2088 1 145 TRP HA 1 147 PRO QD . . 4.750 3.443 3.274 3.730 . 0 0 "[ . 1 . ]" 1
2089 1 145 TRP QB 1 146 LEU QB . . 5.330 3.985 3.709 4.255 . 0 0 "[ . 1 . ]" 1
2090 1 145 TRP QB 1 147 PRO QD . . 5.330 4.265 4.165 4.427 . 0 0 "[ . 1 . ]" 1
2091 1 145 TRP HD1 1 146 LEU QD . . 5.390 4.416 3.960 5.141 . 0 0 "[ . 1 . ]" 1
2092 1 146 LEU QB 1 146 LEU QD . . 2.280 1.950 1.923 1.994 . 0 0 "[ . 1 . ]" 1
2093 1 146 LEU QB 1 147 PRO QD . . 4.040 3.720 3.639 3.764 . 0 0 "[ . 1 . ]" 1
2094 1 146 LEU QD 1 147 PRO QD . . 3.730 3.266 3.125 3.543 . 0 0 "[ . 1 . ]" 1
2095 1 148 GLN QB 1 148 GLN QG . . 2.310 2.025 1.963 2.085 . 0 0 "[ . 1 . ]" 1
2096 1 148 GLN QB 1 148 GLN QE . . 4.040 3.004 1.941 3.742 . 0 0 "[ . 1 . ]" 1
2097 1 148 GLN QE 1 148 GLN QG . . 2.880 2.235 2.068 2.541 . 0 0 "[ . 1 . ]" 1
2098 1 150 CYS H 1 150 CYS QB . . 3.540 2.566 2.284 3.087 . 0 0 "[ . 1 . ]" 1
2099 1 150 CYS QB 1 151 ALA MB . . 4.520 3.862 3.102 4.301 . 0 0 "[ . 1 . ]" 1
2100 1 152 THR H 1 153 PHE QB . . 4.570 4.010 3.243 4.843 0.273 11 0 "[ . 1 . ]" 1
2101 1 153 PHE H 1 153 PHE QB . . 2.840 2.603 2.051 3.070 0.230 18 0 "[ . 1 . ]" 1
2102 1 45 MET HA 1 49 ALA H . . 4.630 4.970 4.283 5.642 1.012 15 7 "[ -* *1 *+* *]" 1
2103 1 49 ALA H 1 52 ALA MB . . 5.420 5.045 4.544 5.422 0.002 8 0 "[ . 1 . ]" 1
2104 1 100 ILE H 1 103 ILE MG . . 5.410 5.591 5.264 6.502 1.092 19 2 "[ - . 1 . +]" 1
2105 1 26 ASP HA 1 27 ALA H . . 3.540 3.510 3.464 3.552 0.012 7 0 "[ . 1 . ]" 1
2106 1 56 ARG H 1 56 ARG HE . . 5.500 5.791 4.446 6.624 1.124 12 7 "[ . -1 + *****]" 1
2107 1 24 ASP HA 1 25 LEU H . . 3.180 2.912 2.477 3.526 0.346 8 0 "[ . 1 . ]" 1
2108 1 97 ILE MG 1 99 ASP H . . 3.180 4.001 2.893 5.167 1.987 6 12 "[*****+ *-* * **]" 1
2109 1 12 ASN QD 1 82 TYR H . . 5.280 4.886 2.861 6.420 1.140 5 2 "[ + 1 . - ]" 1
2110 1 81 THR HA 1 82 TYR H . . 3.100 3.030 2.353 3.561 0.461 6 0 "[ . 1 . ]" 1
2111 1 96 ALA MB 1 97 ILE H . . 2.930 2.757 1.937 3.667 0.737 6 1 "[ .+ 1 . ]" 1
2112 1 119 VAL HA 1 122 CYS H . . 3.930 3.743 3.365 4.015 0.085 4 0 "[ . 1 . ]" 1
2113 1 10 ASP H 1 60 ILE QG . . 4.490 4.544 3.958 6.034 1.544 12 1 "[ . 1 + . ]" 1
2114 1 119 VAL QG 1 122 CYS H . . 5.300 4.508 4.150 4.751 . 0 0 "[ . 1 . ]" 1
2115 1 101 PRO QD 1 103 ILE H . . 4.590 4.051 3.961 4.295 . 0 0 "[ . 1 . ]" 1
2116 1 25 LEU HA 1 26 ASP H . . 3.450 3.477 3.393 3.544 0.094 15 0 "[ . 1 . ]" 1
2117 1 39 LEU HA 1 41 VAL H . . 4.510 4.139 3.922 4.297 . 0 0 "[ . 1 . ]" 1
2118 1 29 ARG QB 1 31 LYS H . . 3.360 3.568 2.465 5.263 1.903 9 6 "[* * . +1*- . * ]" 1
2119 1 115 PHE H 1 116 ILE HB . . 4.700 4.778 4.635 4.956 0.256 4 0 "[ . 1 . ]" 1
2120 1 75 ILE MD 1 114 GLN H . . 5.050 5.058 4.350 5.546 0.496 14 0 "[ . 1 . ]" 1
2121 1 52 ALA MB 1 54 CYS H . . 4.130 4.406 4.050 4.701 0.571 9 1 "[ . +1 . ]" 1
2122 1 45 MET HA 1 48 ASN H . . 3.960 3.705 3.407 3.888 . 0 0 "[ . 1 . ]" 1
2123 1 59 LEU H 1 60 ILE HB . . 4.830 4.895 4.715 5.055 0.225 5 0 "[ . 1 . ]" 1
2124 1 59 LEU H 1 59 LEU HB2 . . 3.930 2.610 2.316 2.758 . 0 0 "[ . 1 . ]" 1
2125 1 71 MET QB 1 72 LYS H . . 3.470 2.905 2.288 3.523 0.053 5 0 "[ . 1 . ]" 1
2126 1 147 PRO QB 1 150 CYS H . . 3.990 5.065 3.276 6.633 2.643 15 15 "[*** **- ** **+****]" 1
2127 1 80 HIS HA 1 81 THR H . . 3.220 2.808 2.572 2.962 . 0 0 "[ . 1 . ]" 1
2128 1 72 LYS QD 1 73 LYS H . . 5.340 4.542 2.977 5.445 0.105 12 0 "[ . 1 . ]" 1
2129 1 125 CYS HB3 1 126 THR H . . 4.280 3.385 2.888 4.064 . 0 0 "[ . 1 . ]" 1
2130 1 125 CYS HB2 1 126 THR H . . 4.280 3.793 2.866 4.268 . 0 0 "[ . 1 . ]" 1
2131 1 150 CYS HA 1 152 THR H . . 4.690 5.955 4.316 6.541 1.851 2 15 "[*+**** **-* ** ***]" 1
2132 1 72 LYS QB 1 77 GLY H . . 3.950 4.169 3.454 5.168 1.218 6 5 "[ - *+ * 1 . *]" 1
2133 1 27 ALA HA 1 30 GLY H . . 3.720 3.637 3.300 3.934 0.214 1 0 "[ . 1 . ]" 1
2134 1 57 GLY H 1 60 ILE HB . . 4.790 4.739 4.460 5.047 0.257 11 0 "[ . 1 . ]" 1
2135 1 37 LEU H 1 82 TYR QB . . 4.840 5.142 3.958 6.244 1.404 8 5 "[ .* +*1 *- ]" 1
2136 1 42 LEU H 1 45 MET QG . . 5.500 5.657 4.980 6.791 1.291 9 4 "[ . +1* * -]" 1
2137 1 72 LYS H 1 76 PRO HA . . 5.500 5.541 4.951 6.493 0.993 3 2 "[ + .- 1 . ]" 1
2138 1 110 GLU H 1 114 GLN H . . 4.950 4.998 4.492 5.378 0.428 5 0 "[ . 1 . ]" 1
2139 1 65 ILE QG 1 119 VAL H . . 4.020 4.504 3.155 5.262 1.242 13 9 "[* **. ***1 -+*. ]" 1
2140 1 41 VAL HB 1 146 LEU H . . 5.500 7.573 4.916 9.713 4.213 3 16 "[-*+ ** ********** *]" 1
2141 1 100 ILE H 1 102 ALA H . . 5.380 5.549 5.266 5.785 0.405 6 0 "[ . 1 . ]" 1
2142 1 100 ILE H 1 106 PHE H . . 5.420 5.557 5.164 6.042 0.622 3 3 "[ + * 1 .- ]" 1
2143 1 50 ARG HE 1 51 LYS HA . . 5.180 6.225 4.191 7.090 1.910 19 15 "[* **.* * *-*******+]" 1
2144 1 46 GLU QB 1 56 ARG HE . . 5.310 6.027 4.111 8.044 2.734 11 9 "[ . *1+- ******]" 1
2145 1 39 LEU MD1 1 41 VAL H . . 5.500 5.023 4.567 5.244 . 0 0 "[ . 1 . ]" 1
2146 1 114 GLN QE 1 117 ALA MB . . 4.870 5.530 4.606 6.092 1.222 13 10 "[*** .- * 1 *+*.** ]" 1
2147 1 11 PHE QD 1 13 ILE MD . . 4.430 5.073 3.696 5.811 1.381 13 13 "[* **-*******+ . *]" 1
2148 1 13 ILE MD 1 16 VAL HB . . 3.850 3.938 1.972 5.843 1.993 3 5 "[ + . **1 -. *]" 1
2149 1 13 ILE MD 1 49 ALA MB . . 3.170 2.793 2.017 3.729 0.559 6 1 "[ .+ 1 . ]" 1
2150 1 58 CYS H 1 60 ILE MD . . 5.440 4.658 4.320 5.313 . 0 0 "[ . 1 . ]" 1
2151 1 116 ILE MD 1 119 VAL H . . 5.500 5.668 5.482 6.402 0.902 6 3 "[ .+ 1 *- ]" 1
2152 1 66 LYS QE 1 99 ASP QB . . 4.710 6.320 4.012 9.126 4.416 6 15 "[*****+***** *- **]" 1
2153 1 71 MET ME 1 116 ILE MD . . 5.300 5.142 4.816 5.766 0.466 6 0 "[ . 1 . ]" 1
2154 1 116 ILE MD 1 119 VAL QG . . 4.110 4.004 3.616 4.843 0.733 6 1 "[ .+ 1 . ]" 1
2155 1 10 ASP H 1 56 ARG QD . . 5.070 4.546 3.490 6.970 1.900 12 1 "[ . 1 + . ]" 1
2156 1 45 MET ME 1 146 LEU QB . . 4.410 6.382 3.488 9.199 4.789 9 13 "[*** ** +1* ****- *]" 1
2157 1 70 LYS HA 1 70 LYS QE . . 3.160 2.943 2.069 4.618 1.458 4 2 "[- +. 1 . ]" 1
2158 1 38 PRO QB 1 39 LEU QB . . 5.490 4.691 4.556 4.766 . 0 0 "[ . 1 . ]" 1
2159 1 74 PHE HB3 1 111 PRO QB . . 4.750 3.538 2.986 3.985 . 0 0 "[ . 1 . ]" 1
2160 1 71 MET ME 1 75 ILE HB . . 4.950 5.257 4.740 6.250 1.300 8 5 "[ * + 1 - *. *]" 1
2161 1 22 THR H 1 23 THR HB . . 4.790 4.669 4.052 5.627 0.837 8 1 "[ . + 1 . ]" 1
2162 1 127 THR HB 1 131 LYS QG . . 4.600 4.443 3.739 5.201 0.601 9 2 "[ - . +1 . ]" 1
2163 1 40 GLU QG 1 43 LYS QG . . 5.340 4.780 4.497 5.023 . 0 0 "[ . 1 . ]" 1
2164 1 82 TYR QB 1 83 GLU QG . . 4.380 4.399 3.609 5.112 0.732 16 1 "[ . 1 .+ ]" 1
2165 1 81 THR MG 1 83 GLU QG . . 4.150 4.116 2.870 5.798 1.648 6 6 "[ *.+ * 1 *- *]" 1
2166 1 41 VAL HA 1 146 LEU QD . . 5.440 5.932 4.537 7.171 1.731 14 10 "[*** .* *1* +-* *]" 1
2167 1 41 VAL HA 1 45 MET QG . . 5.080 4.888 4.109 5.559 0.479 15 0 "[ . 1 . ]" 1
2168 1 143 LYS QB 1 147 PRO QB . . 4.660 5.265 3.737 6.006 1.346 16 12 "[ ** ** ** -**+** ]" 1
2169 1 49 ALA MB 1 136 VAL HB . . 4.510 5.287 3.807 6.703 2.193 9 12 "[ ***-* +1****** ]" 1
2170 1 116 ILE HA 1 120 ASP H . . 4.930 4.086 3.672 4.478 . 0 0 "[ . 1 . ]" 1
2171 1 36 LYS H 1 83 GLU QB . . 4.150 3.936 2.348 7.833 3.683 14 4 "[ .* -1 +. *]" 1
2172 1 43 LYS HA 1 46 GLU QB . . 3.490 3.431 2.018 4.136 0.646 6 2 "[ .+- 1 . ]" 1
2173 1 73 LYS HG3 1 74 PHE HA . . 4.790 4.843 4.229 5.607 0.817 16 2 "[ - . 1 .+ ]" 1
2174 1 56 ARG HA 1 59 LEU HB3 . . 5.500 5.381 4.797 5.939 0.439 19 0 "[ . 1 . ]" 1
2175 1 70 LYS HA 1 73 LYS HB3 . . 3.810 3.213 2.706 3.865 0.055 6 0 "[ . 1 . ]" 1
2176 1 33 PRO QB 1 38 PRO QG . . 4.970 6.329 4.576 7.498 2.528 13 16 "[** *** *-***+**** *]" 1
2177 1 68 THR MG 1 107 LYS HA . . 3.900 3.803 2.913 4.594 0.694 19 1 "[ . 1 . +]" 1
2178 1 59 LEU HG 1 62 LEU QD . . 3.620 3.998 3.047 5.097 1.477 6 7 "[ .+ **- * . **]" 1
2179 1 45 MET ME 1 146 LEU QD . . 2.390 4.683 2.370 7.415 5.025 9 15 "[*** ** *+1*-***** *]" 1
2180 1 59 LEU HA 1 59 LEU HG . . 4.210 2.840 2.602 3.217 . 0 0 "[ . 1 . ]" 1
2181 1 73 LYS HA 1 73 LYS HG2 . . 4.010 3.262 2.725 3.476 . 0 0 "[ . 1 . ]" 1
2182 1 12 ASN QD 1 82 TYR HA . . 5.500 6.720 5.055 8.251 2.751 17 16 "[***** *-*** ***+**]" 1
2183 1 39 LEU HA 1 39 LEU MD1 . . 3.640 3.849 3.421 3.983 0.343 10 0 "[ . 1 . ]" 1
2184 1 73 LYS HA 1 73 LYS HG3 . . 3.030 2.633 2.355 2.905 . 0 0 "[ . 1 . ]" 1
2185 1 142 LEU HA 1 142 LEU HG . . 3.590 3.382 2.182 3.704 0.114 1 0 "[ . 1 . ]" 1
2186 1 133 LEU HA 1 136 VAL H . . 5.130 3.997 3.468 4.305 . 0 0 "[ . 1 . ]" 1
2187 1 39 LEU MD1 1 43 LYS QG . . 3.470 3.778 2.801 4.290 0.820 10 7 "[* - ** + * * ]" 1
2188 1 46 GLU QB 1 47 ALA HA . . 4.330 4.440 3.812 4.672 0.342 15 0 "[ . 1 . ]" 1
2189 1 17 ALA HA 1 133 LEU HG . . 5.360 4.911 2.123 6.519 1.159 18 2 "[ . - 1 . + ]" 1
2190 1 24 ASP HA 1 25 LEU HA . . 4.800 4.743 4.585 4.888 0.088 5 0 "[ . 1 . ]" 1
2191 1 105 ARG QG 1 108 ASP HA . . 5.320 5.357 5.035 5.851 0.531 14 1 "[ . 1 +. ]" 1
2192 1 19 ASN HA 1 78 ARG HA . . 4.710 5.430 3.320 9.801 5.091 17 8 "[* * . * ** .-+ *]" 1
2193 1 127 THR MG 1 131 LYS QB . . 5.140 5.239 4.373 6.108 0.968 19 3 "[- . * 1 . +]" 1
2194 1 27 ALA HA 1 28 ASP H . . 3.540 3.527 3.500 3.560 0.020 17 0 "[ . 1 . ]" 1
2195 1 120 ASP HA 1 123 VAL QG . . 3.950 4.083 2.713 5.259 1.309 10 5 "[ .- + ** * ]" 1
2196 1 41 VAL QG 1 146 LEU H . . 4.260 4.810 3.710 5.826 1.566 3 10 "[**+ .* *1 **-* *]" 1
2197 1 49 ALA HA 1 136 VAL QG . . 3.190 3.950 2.287 6.427 3.237 11 9 "[ *-* **1+* * *]" 1
2198 1 21 ALA MB 1 23 THR MG . . 3.450 3.771 2.186 5.937 2.487 6 6 "[ *+ ** .- * ]" 1
2199 1 13 ILE MG 1 17 ALA MB . . 3.800 3.657 2.989 4.236 0.436 11 0 "[ . 1 . ]" 1
2200 1 147 PRO QB 1 151 ALA MB . . 3.720 5.183 2.504 10.004 6.284 15 10 "[ *- .* ** ** + * *]" 1
2201 1 72 LYS HA 1 75 ILE MG . . 5.500 5.506 5.070 6.202 0.702 8 3 "[ - + 1 . *]" 1
2202 1 75 ILE MG 1 112 MET ME . . 3.540 3.042 2.410 3.701 0.161 8 0 "[ . 1 . ]" 1
2203 1 32 LEU QB 1 147 PRO QD . . 4.440 6.300 2.601 9.038 4.598 19 13 "[*** * **-** *** +]" 1
2204 1 103 ILE MG 1 118 GLN H . . 5.340 5.653 5.281 6.520 1.180 19 3 "[ .* 1 - . +]" 1
2205 1 103 ILE MG 1 105 ARG HA . . 5.190 4.942 4.518 5.863 0.673 19 2 "[ . 1 .- +]" 1
2206 1 71 MET ME 1 117 ALA H . . 5.190 5.630 5.314 6.144 0.954 13 5 "[ * ** + . - ]" 1
2207 1 112 MET ME 1 115 PHE HA . . 5.120 5.191 4.950 5.558 0.438 19 0 "[ . 1 . ]" 1
2208 1 45 MET QG 1 146 LEU QD . . 5.140 4.455 3.112 6.434 1.294 9 2 "[ . +1 . -]" 1
2209 1 45 MET H 1 146 LEU QD . . 5.440 6.810 5.390 8.484 3.044 9 12 "[*** .* +1* ****- *]" 1
2210 1 20 PHE HZ 1 130 LEU QD . . 3.820 3.730 2.176 5.447 1.627 18 5 "[ .* **1- . + ]" 1
2211 1 60 ILE MD 1 61 CYS H . . 4.320 4.455 4.163 4.807 0.487 13 0 "[ . 1 . ]" 1
2212 1 64 HIS H 1 65 ILE MD . . 5.200 4.927 4.507 5.681 0.481 17 0 "[ . 1 . ]" 1
2213 1 65 ILE MD 1 100 ILE MD . . 5.500 5.732 5.318 6.483 0.983 18 6 "[ *** - .* + ]" 1
2214 1 66 LYS H 1 100 ILE MG . . 5.500 6.510 5.507 7.273 1.773 6 16 "[** **+ ****-**** **]" 1
2215 1 100 ILE MG 1 118 GLN H . . 5.200 5.507 5.196 5.983 0.783 3 4 "[ + .* - .* ]" 1
2216 1 66 LYS QB 1 100 ILE MG . . 4.810 5.825 4.603 7.089 2.279 13 15 "[** *-* *****+** **]" 1
2217 1 59 LEU HB2 1 60 ILE MG . . 5.500 5.517 5.368 5.742 0.242 2 0 "[ . 1 . ]" 1
2218 1 26 ASP HA 1 28 ASP H . . 4.500 4.341 4.064 4.615 0.115 17 0 "[ . 1 . ]" 1
2219 1 12 ASN QB 1 63 SER HA . . 5.340 5.113 3.899 6.145 0.805 10 2 "[ . +- . ]" 1
2220 1 82 TYR QB 1 83 GLU HA . . 5.160 4.265 3.941 4.565 . 0 0 "[ . 1 . ]" 1
2221 1 14 VAL HA 1 82 TYR QB . . 5.500 7.531 5.227 9.359 3.859 9 17 "[****** *+*** ****-*]" 1
2222 1 36 LYS H 1 82 TYR HA . . 5.410 5.282 4.540 7.179 1.769 6 2 "[- .+ 1 . ]" 1
2223 1 28 ASP HA 1 29 ARG QB . . 5.230 5.204 5.141 5.270 0.040 12 0 "[ . 1 . ]" 1
2224 1 52 ALA H 1 136 VAL QG . . 4.470 5.852 3.225 7.964 3.494 11 16 "[* **** ***+* ****-*]" 1
2225 1 52 ALA MB 1 136 VAL QG . . 3.450 4.729 2.120 6.456 3.006 11 16 "[* **** ***+* ****-*]" 1
2226 1 110 GLU H 1 114 GLN QB . . 5.500 5.863 4.889 6.382 0.882 5 8 "[* *+* -1 * .* * ]" 1
2227 1 71 MET HA 1 111 PRO HA . . 3.090 3.217 2.667 3.633 0.543 5 1 "[ + 1 . ]" 1
2228 1 59 LEU HB2 1 60 ILE MD . . 5.330 4.097 2.642 5.001 . 0 0 "[ . 1 . ]" 1
2229 1 19 ASN H 1 45 MET ME . . 5.500 6.113 5.542 6.646 1.146 15 11 "[ *- . **1****+ **]" 1
2230 1 36 LYS HA 1 37 LEU QB . . 5.500 4.178 3.940 4.436 . 0 0 "[ . 1 . ]" 1
2231 1 70 LYS HA 1 73 LYS HB2 . . 4.340 3.510 2.854 4.570 0.230 5 0 "[ . 1 . ]" 1
2232 1 41 VAL HB 1 146 LEU QD . . 4.000 4.987 2.653 6.617 2.617 3 14 "[**+ ** *-* ***** *]" 1
2233 1 100 ILE MG 1 104 PRO HD2 . . 5.500 5.645 5.333 6.127 0.627 5 2 "[ - + 1 . ]" 1
2234 1 104 PRO HD2 1 106 PHE H . . 5.500 4.147 3.961 4.327 . 0 0 "[ . 1 . ]" 1
2235 1 147 PRO QB 1 148 GLN HA . . 4.150 4.220 3.858 4.594 0.444 8 0 "[ . 1 . ]" 1
2236 1 143 LYS HA 1 151 ALA H . . 5.500 5.986 4.300 7.899 2.399 12 8 "[ * *. * 1*+ * *- ]" 1
2237 1 59 LEU HG 1 62 LEU HG . . 5.370 5.253 4.761 6.042 0.672 5 2 "[ +- 1 . ]" 1
2238 1 66 LYS QB 1 99 ASP QB . . 5.500 6.617 5.516 7.447 1.947 2 17 "[*+**** *-** *******]" 1
2239 1 56 ARG HA 1 59 LEU HB2 . . 4.450 3.693 3.128 4.282 . 0 0 "[ . 1 . ]" 1
2240 1 37 LEU QB 1 82 TYR QD . . 4.430 4.274 2.980 5.699 1.269 6 2 "[ -+ 1 . ]" 1
2241 1 74 PHE QD 1 111 PRO QB . . 3.390 3.452 2.722 3.785 0.395 2 0 "[ . 1 . ]" 1
2242 1 11 PHE QD 1 12 ASN QB . . 5.340 4.324 3.903 4.713 . 0 0 "[ . 1 . ]" 1
2243 1 66 LYS QB 1 106 PHE QE . . 4.560 4.982 3.928 5.956 1.396 13 8 "[ * ** * +*- *]" 1
2244 1 106 PHE QD 1 118 GLN H . . 4.490 4.100 3.689 4.525 0.035 5 0 "[ . 1 . ]" 1
2245 1 11 PHE HZ 1 56 ARG HE . . 3.960 4.676 2.343 7.167 3.207 17 9 "[ .* *1*- ** +**]" 1
2246 1 11 PHE HZ 1 56 ARG HA . . 4.590 4.957 3.320 5.788 1.198 6 9 "[* -+ * * ** ** ]" 1
2247 1 63 SER HA 1 64 HIS HD2 . . 4.750 4.656 4.390 5.140 0.390 19 0 "[ . 1 . ]" 1
2248 1 64 HIS HB3 1 64 HIS HD2 . . 3.870 3.808 3.744 3.873 0.003 17 0 "[ . 1 . ]" 1
2249 1 37 LEU QB 1 82 TYR QE . . 3.920 3.217 1.967 4.504 0.584 5 3 "[ +* 1 . - ]" 1
2250 1 36 LYS QG 1 82 TYR QE . . 3.920 3.767 2.211 5.643 1.723 14 6 "[ * *. 1 * +.* -]" 1
2251 1 11 PHE HZ 1 59 LEU HB3 . . 4.510 3.624 2.416 4.388 . 0 0 "[ . 1 . ]" 1
2252 1 20 PHE QD 1 130 LEU QD . . 4.000 4.467 3.656 6.051 2.051 18 10 "[ **.*-**1* ** + ]" 1
2253 1 16 VAL HA 1 20 PHE QD . . 4.420 4.762 3.467 5.847 1.427 6 10 "[ ** .+* 1** -. ***]" 1
2254 1 73 LYS HG3 1 74 PHE QD . . 4.280 4.581 4.091 4.998 0.718 11 4 "[ .* *1+ .- ]" 1
2255 1 73 LYS HG2 1 74 PHE QD . . 4.280 3.178 2.417 3.839 . 0 0 "[ . 1 . ]" 1
2256 1 73 LYS HG3 1 74 PHE QE . . 4.880 5.018 4.666 5.632 0.752 6 2 "[ .+ 1 . -]" 1
2257 1 73 LYS HG2 1 74 PHE QE . . 4.280 3.662 3.080 4.255 . 0 0 "[ . 1 . ]" 1
2258 1 20 PHE QE 1 133 LEU H . . 5.470 5.683 4.604 7.151 1.681 9 6 "[ .- +1* .*** ]" 1
2259 1 20 PHE QE 1 130 LEU QD . . 3.450 3.419 1.932 5.255 1.805 18 6 "[ - .* **1* . + ]" 1
2260 1 20 PHE QE 1 59 LEU HG . . 5.500 6.723 5.088 8.293 2.793 6 13 "[* **+ *** -*** **]" 1
2261 1 151 ALA MB 1 153 PHE QD . . 4.190 4.194 2.650 5.211 1.021 14 3 "[ - 1* +. ]" 1
2262 1 35 LYS QB 1 82 TYR QD . . 4.090 5.075 2.576 6.535 2.445 11 14 "[*-* * ***+**** * *]" 1
2263 1 73 LYS HG2 1 74 PHE HZ . . 5.270 5.144 4.540 5.629 0.359 2 0 "[ . 1 . ]" 1
2264 1 63 SER HB3 1 64 HIS HD2 . . 4.390 3.603 2.499 4.752 0.362 2 0 "[ . 1 . ]" 1
2265 1 63 SER HB2 1 64 HIS HD2 . . 4.390 3.976 2.678 4.779 0.389 19 0 "[ . 1 . ]" 1
2266 1 60 ILE HA 1 64 HIS HE1 . . 5.230 5.402 5.173 5.841 0.611 5 3 "[ +* 1 . -]" 1
2267 1 60 ILE QG 1 64 HIS HE1 . . 4.140 4.334 3.649 5.391 1.251 5 6 "[ **+*- 1 . *]" 1
2268 1 16 VAL HB 1 20 PHE HZ . . 5.410 5.324 2.424 8.655 3.245 1 6 "[+ .- ** * .* ]" 1
2269 1 10 ASP QB 1 64 HIS HE1 . . 4.440 5.133 4.209 6.621 2.181 6 12 "[ **.+** **** - **]" 1
2270 1 11 PHE QD 1 42 LEU QD . . 4.370 4.347 3.610 5.370 1.000 13 2 "[ . - 1 + . ]" 1
2271 1 13 ILE QG 1 46 GLU QG . . 4.580 4.104 1.943 5.019 0.439 1 0 "[ . 1 . ]" 1
2272 1 14 VAL QG 1 45 MET H . . 4.720 5.073 4.024 6.295 1.575 18 8 "[ *** ** * .- + ]" 1
2273 1 14 VAL QG 1 45 MET ME . . 2.400 2.891 1.888 4.320 1.920 11 11 "[ * ** **+ *** - *]" 1
2274 1 15 ALA HA 1 16 VAL QG . . 5.440 4.712 4.407 5.006 . 0 0 "[ . 1 . ]" 1
2275 1 16 VAL HB 1 59 LEU QD . . 4.730 4.019 3.041 5.211 0.481 14 0 "[ . 1 . ]" 1
2276 1 16 VAL QG 1 59 LEU QD . . 2.630 2.701 1.777 3.812 1.182 15 4 "[ -* 1 *+ ]" 1
2277 1 17 ALA H 1 19 ASN QD . . 5.340 5.309 4.471 6.463 1.123 12 1 "[ . 1 + . ]" 1
2278 1 19 ASN QB 1 78 ARG HA . . 4.650 5.294 4.052 8.206 3.556 12 8 "[** . *-+**. * ]" 1
2279 1 24 ASP HA 1 25 LEU QD . . 3.930 4.408 3.289 5.977 2.047 10 7 "[- ** * + * . * ]" 1
2280 1 31 LYS QB 1 32 LEU QD . . 4.610 4.117 3.031 5.168 0.558 19 1 "[ . 1 . +]" 1
2281 1 32 LEU QD 1 33 PRO QG . . 3.830 3.760 3.136 4.441 0.611 8 2 "[ - + 1 . ]" 1
2282 1 33 PRO QG 1 38 PRO QD . . 4.210 5.831 2.426 8.062 3.852 13 16 "[** *** * ***+****-*]" 1
2283 1 34 GLY QA 1 35 LYS H . . 2.650 2.720 2.307 2.869 0.219 6 0 "[ . 1 . ]" 1
2284 1 37 LEU QD 1 38 PRO QB . . 4.860 4.478 4.208 4.687 . 0 0 "[ . 1 . ]" 1
2285 1 39 LEU HA 1 41 VAL QG . . 5.160 4.821 3.720 5.337 0.177 16 0 "[ . 1 . ]" 1
2286 1 41 VAL H 1 142 LEU QD . . 5.440 5.071 4.401 5.683 0.243 13 0 "[ . 1 . ]" 1
2287 1 41 VAL QG 1 44 GLU H . . 5.300 4.228 4.062 4.488 . 0 0 "[ . 1 . ]" 1
2288 1 41 VAL QG 1 44 GLU QB . . 3.740 3.374 2.941 4.021 0.281 7 0 "[ . 1 . ]" 1
2289 1 42 LEU QD 1 43 LYS HA . . 3.630 3.614 2.251 5.184 1.554 19 5 "[ . 1- * * * +]" 1
2290 1 42 LEU QD 1 46 GLU QG . . 3.760 3.729 1.744 5.757 1.997 11 6 "[ -. 1+ * * * *]" 1
2291 1 42 LEU QD 1 47 ALA H . . 5.440 5.564 4.342 6.784 1.344 19 7 "[ . 1* * *-**+]" 1
2292 1 43 LYS H 1 46 GLU QG . . 4.380 4.526 3.826 6.350 1.970 11 3 "[ -. *1+ . ]" 1
2293 1 44 GLU QB 1 141 LEU QD . . 3.420 3.406 2.400 4.439 1.019 17 4 "[ *.* 1 -. + ]" 1
2294 1 45 MET H 1 141 LEU QD . . 5.440 5.747 4.987 6.696 1.256 4 6 "[ +.* *- *. * ]" 1
2295 1 46 GLU QG 1 49 ALA MB . . 4.110 4.602 3.248 5.300 1.190 16 13 "[*** .*** 1 **-.+***]" 1
2296 1 48 ASN QB 1 142 LEU QD . . 5.280 5.298 4.398 6.549 1.269 9 4 "[* . +1 - *]" 1
2297 1 48 ASN QD 1 139 SER QB . . 4.930 3.232 1.933 4.686 . 0 0 "[ . 1 . ]" 1
2298 1 48 ASN QD 1 142 LEU QD . . 3.400 3.375 2.571 4.756 1.356 9 3 "[- . +1 . *]" 1
2299 1 49 ALA MB 1 136 VAL QG . . 3.350 3.612 2.235 5.609 2.259 11 7 "[ .* -*1+** * ]" 1
2300 1 51 LYS H 1 136 VAL QG . . 4.360 6.025 4.156 7.995 3.635 11 16 "[* **** ***+* ****-*]" 1
2301 1 52 ALA HA 1 136 VAL QG . . 4.420 7.041 3.557 8.864 4.444 11 17 "[*-**** ***+* ******]" 1
2302 1 52 ALA MB 1 135 ASN QB . . 5.340 4.757 3.662 6.150 0.810 19 1 "[ . 1 . +]" 1
2303 1 59 LEU QD 1 62 LEU QD . . 2.720 3.071 2.051 3.995 1.275 19 5 "[- **. * 1 . +]" 1
2304 1 60 ILE MG 1 61 CYS QB . . 4.940 4.037 3.597 4.389 . 0 0 "[ . 1 . ]" 1
2305 1 60 ILE MG 1 64 HIS QB . . 4.130 3.194 2.998 3.678 . 0 0 "[ . 1 . ]" 1
2306 1 62 LEU QB 1 65 ILE QG . . 4.570 3.866 3.476 5.340 0.770 17 1 "[ . 1 . + ]" 1
2307 1 62 LEU QB 1 119 VAL HA . . 4.800 4.500 3.122 5.484 0.684 8 1 "[ . + 1 . ]" 1
2308 1 62 LEU HG 1 63 SER QB . . 4.440 4.938 3.475 6.236 1.796 5 14 "[* *-+* **** * .****]" 1
2309 1 62 LEU QD 1 63 SER QB . . 4.170 4.445 2.914 5.317 1.147 5 14 "[* -*+* **** * .****]" 1
2310 1 64 HIS H 1 64 HIS QB . . 3.180 2.311 2.210 2.359 . 0 0 "[ . 1 . ]" 1
2311 1 64 HIS QB 1 65 ILE H . . 4.410 3.661 3.653 3.674 . 0 0 "[ . 1 . ]" 1
2312 1 65 ILE MG 1 118 GLN QG . . 4.730 3.135 2.150 4.966 0.236 11 0 "[ . 1 . ]" 1
2313 1 66 LYS H 1 118 GLN QG . . 4.250 4.269 3.172 5.132 0.882 3 5 "[ + . * - . * *]" 1
2314 1 66 LYS HA 1 98 VAL QG . . 4.350 3.586 3.158 4.129 . 0 0 "[ . 1 . ]" 1
2315 1 68 THR H 1 98 VAL QG . . 3.710 3.613 3.142 4.453 0.743 2 2 "[ + .- 1 . ]" 1
2316 1 68 THR HB 1 98 VAL QG . . 4.630 3.607 2.139 4.908 0.278 6 0 "[ . 1 . ]" 1
2317 1 70 LYS H 1 72 LYS QG . . 4.410 4.559 3.917 5.907 1.497 14 4 "[ .- * 1 +* ]" 1
2318 1 72 LYS QG 1 73 LYS H . . 3.350 3.078 2.053 4.432 1.082 6 6 "[ *+ * 1 *- *]" 1
2319 1 72 LYS QG 1 76 PRO QB . . 5.340 5.352 4.526 5.892 0.552 3 2 "[ + . 1 - . ]" 1
2320 1 73 LYS H 1 73 LYS QB . . 3.010 2.228 2.170 2.247 . 0 0 "[ . 1 . ]" 1
2321 1 98 VAL QG 1 107 LYS QB . . 4.960 5.084 3.977 5.883 0.923 19 3 "[ .* 1 - +]" 1
2322 1 106 PHE QD 1 118 GLN QG . . 4.120 3.685 2.954 4.907 0.787 3 1 "[ + . 1 . ]" 1
2323 1 108 ASP H 1 108 ASP QB . . 2.950 2.399 2.292 2.453 . 0 0 "[ . 1 . ]" 1
2324 1 109 LEU QD 1 114 GLN H . . 4.450 4.552 3.761 5.122 0.672 16 3 "[ - * 1 .+ ]" 1
2325 1 109 LEU QD 1 114 GLN HA . . 3.830 3.973 3.016 4.764 0.934 16 4 "[* *- 1 .+ ]" 1
2326 1 109 LEU QD 1 114 GLN QE . . 4.770 4.766 4.306 5.135 0.365 18 0 "[ . 1 . ]" 1
2327 1 109 LEU QD 1 117 ALA H . . 5.160 5.253 4.351 5.994 0.834 16 3 "[- * 1 .+ ]" 1
2328 1 118 GLN H 1 118 GLN QE . . 4.970 3.889 2.423 4.501 . 0 0 "[ . 1 . ]" 1
2329 1 118 GLN QG 1 119 VAL QG . . 3.670 4.336 2.175 4.925 1.255 1 17 "[+* **-********** **]" 1
2330 1 131 LYS QB 1 135 ASN QB . . 4.380 4.324 3.809 5.070 0.690 7 4 "[ - . + 1 . * *]" 1
2331 1 132 GLY H 1 135 ASN QB . . 4.930 4.694 4.292 6.240 1.310 19 1 "[ . 1 . +]" 1
2332 1 133 LEU HA 1 136 VAL QG . . 4.180 2.489 1.915 3.714 . 0 0 "[ . 1 . ]" 1
2333 1 133 LEU QD 1 136 VAL HB . . 4.940 4.970 3.661 6.415 1.475 4 5 "[ *+* - . * ]" 1
2334 1 133 LEU QD 1 136 VAL QG . . 3.260 3.325 2.641 4.358 1.098 11 4 "[ -. * 1+ * ]" 1
2335 1 134 ALA H 1 135 ASN QB . . 4.900 4.275 4.048 5.021 0.121 19 0 "[ . 1 . ]" 1
2336 1 134 ALA HA 1 135 ASN QB . . 5.340 5.377 5.298 5.571 0.231 7 0 "[ . 1 . ]" 1
2337 1 135 ASN QB 1 136 VAL HA . . 5.340 4.216 3.844 4.632 . 0 0 "[ . 1 . ]" 1
2338 1 139 SER QB 1 142 LEU QB . . 2.440 2.675 1.963 3.411 0.971 9 7 "[** * +1 *- *]" 1
2339 1 139 SER QB 1 143 LYS H . . 5.070 4.220 3.688 4.723 . 0 0 "[ . 1 . ]" 1
2340 1 141 LEU H 1 142 LEU QD . . 4.170 3.991 3.261 5.207 1.037 4 2 "[ +. - 1 . ]" 1
2341 1 141 LEU QB 1 142 LEU QD . . 3.310 2.871 2.318 3.980 0.670 4 1 "[ +. 1 . ]" 1
2342 1 142 LEU QD 1 143 LYS HA . . 5.360 4.864 3.969 5.181 . 0 0 "[ . 1 . ]" 1
2343 1 142 LEU QD 1 146 LEU QB . . 3.240 3.389 1.908 4.145 0.905 3 9 "[**+ .* 1 **** -]" 1
2344 1 143 LYS H 1 150 CYS QB . . 4.840 4.774 3.894 5.738 0.898 8 4 "[ -. + 1** . ]" 1
2345 1 143 LYS HA 1 150 CYS QB . . 3.830 3.178 2.235 4.412 0.582 8 1 "[ . + 1 . ]" 1
2346 1 147 PRO QB 1 150 CYS QB . . 5.340 5.469 3.886 6.703 1.363 2 7 "[ + - *1 **** ]" 1
2347 1 150 CYS QB 1 151 ALA H . . 4.060 2.780 2.177 3.490 . 0 0 "[ . 1 . ]" 1
2348 1 36 LYS H 1 83 GLU H . . 3.620 4.426 2.160 7.513 3.893 14 11 "[* *** *** *+. - *]" 1
2349 1 24 ASP H 1 27 ALA MB . . 5.500 5.475 5.152 5.991 0.491 1 0 "[ . 1 . ]" 1
2350 1 80 HIS HA 1 82 TYR H . . 3.950 5.380 3.340 6.750 2.800 10 14 "[******* +* *-** * ]" 1
2351 1 140 ASP H 1 142 LEU QB . . 5.000 4.831 4.561 4.989 . 0 0 "[ . 1 . ]" 1
2352 1 46 GLU QG 1 50 ARG H . . 4.480 4.761 3.577 5.750 1.270 10 8 "[ * .** + * .-* *]" 1
2353 1 12 ASN H 1 15 ALA MB . . 4.820 5.034 4.437 5.958 1.138 6 5 "[* .+ 1-* . * ]" 1
2354 1 41 VAL H 1 42 LEU QB . . 4.280 4.159 4.037 4.576 0.296 17 0 "[ . 1 . ]" 1
2355 1 115 PHE H 1 118 GLN QG . . 4.700 5.189 4.272 6.187 1.487 1 10 "[+* *. * *1** -** ]" 1
2356 1 75 ILE MD 1 113 GLU H . . 5.020 5.392 4.604 5.858 0.838 14 9 "[*-*** 1* *+* ]" 1
2357 1 43 LYS H 1 46 GLU QB . . 5.170 5.153 4.182 6.047 0.877 6 2 "[ .+ 1 .- ]" 1
2358 1 102 ALA H 1 121 LEU QB . . 5.500 5.940 5.185 6.460 0.960 1 9 "[+ * ** ** .* *-]" 1
2359 1 69 PRO QB 1 73 LYS H . . 5.400 5.442 5.214 5.674 0.274 11 0 "[ . 1 . ]" 1
2360 1 100 ILE QG 1 118 GLN H . . 5.120 5.072 4.441 6.132 1.012 3 3 "[ + .- 1 .* ]" 1
2361 1 52 ALA MB 1 128 GLY H . . 5.500 5.641 4.707 6.807 1.307 13 5 "[ * . * 1 + .- *]" 1
2362 1 128 GLY H 1 131 LYS QB . . 5.500 5.828 5.402 6.124 0.624 2 2 "[ + . 1 . - ]" 1
2363 1 28 ASP H 1 32 LEU QD . . 5.500 5.296 4.355 6.617 1.117 9 3 "[- . +1* . ]" 1
2364 1 11 PHE HZ 1 60 ILE H . . 5.500 5.836 4.615 6.724 1.224 14 7 "[*** . * 1 * +. - ]" 1
2365 1 102 ALA H 1 121 LEU HG . . 4.790 6.215 3.773 6.821 2.031 19 18 "[******* ******-***+]" 1
2366 1 25 LEU QB 1 29 ARG HE . . 3.930 3.787 2.191 6.054 2.124 6 7 "[ * .+* -** . * ]" 1
2367 1 46 GLU QB 1 50 ARG HE . . 4.550 4.883 2.932 8.733 4.183 7 5 "[ * + *1- * ]" 1
2368 1 46 GLU QG 1 50 ARG HE . . 4.840 4.120 2.359 8.993 4.153 7 1 "[ . + 1 . ]" 1
2369 1 139 SER HB2 1 141 LEU H . . 5.180 3.844 2.700 4.565 . 0 0 "[ . 1 . ]" 1
2370 1 57 GLY QA 1 60 ILE MG . . 4.370 3.430 3.069 3.782 . 0 0 "[ . 1 . ]" 1
2371 1 11 PHE QE 1 60 ILE MD . . 3.600 4.125 3.166 5.039 1.439 14 12 "[******* 1 -+* **]" 1
2372 1 13 ILE MD 1 45 MET QG . . 3.390 4.425 3.172 5.905 2.515 14 13 "[** ** * -* * +**** ]" 1
2373 1 100 ILE MD 1 121 LEU HG . . 4.620 4.872 3.869 5.700 1.080 15 6 "[-* ** *1 + ]" 1
2374 1 50 ARG QD 1 51 LYS HA . . 3.530 4.982 2.616 6.678 3.148 12 14 "[* **.** **+**.-***]" 1
2375 1 37 LEU QB 1 83 GLU QG . . 4.390 5.649 3.914 8.005 3.615 6 13 "[ ** *+* * ****-**]" 1
2376 1 74 PHE HB3 1 75 ILE MD . . 5.110 4.996 4.522 5.367 0.257 11 0 "[ . 1 . ]" 1
2377 1 15 ALA MB 1 83 GLU QG . . 4.710 5.526 2.209 7.200 2.490 6 15 "[**- *+* *** * *****]" 1
2378 1 40 GLU QG 1 43 LYS QE . . 4.800 5.100 4.262 6.830 2.030 7 6 "[ *.*+ *1 * - ]" 1
2379 1 36 LYS QG 1 83 GLU QG . . 4.180 3.573 1.955 8.463 4.283 14 3 "[ * .- 1 +. ]" 1
2380 1 69 PRO HA 1 96 ALA MB . . 5.050 6.069 3.189 9.359 4.309 4 10 "[* +*** * * - **]" 1
2381 1 60 ILE HA 1 64 HIS H . . 4.900 4.018 3.770 4.419 . 0 0 "[ . 1 . ]" 1
2382 1 60 ILE HA 1 60 ILE QG . . 3.780 2.323 2.088 2.455 . 0 0 "[ . 1 . ]" 1
2383 1 139 SER HB3 1 141 LEU H . . 5.180 3.030 2.487 4.510 . 0 0 "[ . 1 . ]" 1
2384 1 71 MET H 1 111 PRO QB . . 4.280 4.269 3.807 5.035 0.755 1 2 "[+ . - . ]" 1
2385 1 33 PRO QB 1 145 TRP HA . . 3.360 5.585 3.394 8.792 5.432 3 18 "[**+**** ********-**]" 1
2386 1 37 LEU HG 1 145 TRP QB . . 4.260 4.958 4.030 7.150 2.890 3 10 "[ *+ ** *1 * ** -*]" 1
2387 1 33 PRO HA 1 34 GLY H . . 3.240 2.481 2.156 3.577 0.337 11 0 "[ . 1 . ]" 1
2388 1 114 GLN QB 1 118 GLN QB . . 5.500 5.644 5.091 6.388 0.888 19 2 "[ . - . +]" 1
2389 1 46 GLU HA 1 50 ARG QB . . 4.960 5.008 4.281 5.969 1.009 15 4 "[ .* 1 - + *]" 1
2390 1 71 MET HA 1 74 PHE H . . 4.720 3.532 3.244 3.786 . 0 0 "[ . 1 . ]" 1
2391 1 71 MET HA 1 75 ILE QG . . 4.060 3.190 2.467 3.796 . 0 0 "[ . 1 . ]" 1
2392 1 43 LYS QG 1 44 GLU HA . . 3.610 3.495 3.106 5.636 2.026 19 1 "[ . 1 . +]" 1
2393 1 42 LEU HA 1 46 GLU QB . . 4.450 4.611 4.023 5.582 1.132 6 4 "[ .+ * .* - ]" 1
2394 1 14 VAL H 1 146 LEU QD . . 5.280 7.252 4.841 9.317 4.037 3 16 "[**+**** *1*-**** **]" 1
2395 1 82 TYR HA 1 82 TYR QE . . 5.500 5.615 5.558 5.655 0.155 8 0 "[ . 1 . ]" 1
2396 1 36 LYS QG 1 83 GLU HA . . 5.100 5.094 3.016 7.601 2.501 6 5 "[ -+* * *. ]" 1
2397 1 13 ILE HA 1 42 LEU QD . . 4.850 4.158 3.696 5.044 0.194 13 0 "[ . 1 . ]" 1
2398 1 36 LYS H 1 83 GLU HA . . 3.110 4.272 2.618 7.156 4.046 14 11 "[* *** ** *+* -*]" 1
2399 1 21 ALA MB 1 134 ALA HA . . 3.600 5.226 2.876 7.879 4.279 13 15 "[ *-***** ***+** **]" 1
2400 1 52 ALA MB 1 128 GLY QA . . 4.250 3.664 2.896 4.815 0.565 13 1 "[ . 1 + . ]" 1
2401 1 15 ALA MB 1 80 HIS HA . . 5.320 6.376 4.756 7.322 2.002 16 17 "[******- ***** *+***]" 1
2402 1 15 ALA MB 1 63 SER HA . . 4.720 4.844 3.784 5.676 0.956 6 4 "[ .+ 1 * - * ]" 1
2403 1 47 ALA MB 1 50 ARG QB . . 4.400 4.287 3.798 5.044 0.644 1 1 "[+ . 1 . ]" 1
2404 1 47 ALA MB 1 51 LYS QB . . 3.760 4.262 3.755 5.023 1.263 7 9 "[*- *.*+ * *. * *]" 1
2405 1 20 PHE QE 1 65 ILE MG . . 5.500 6.749 5.504 8.945 3.445 12 12 "[**-*.** * +**. * *]" 1
2406 1 14 VAL HB 1 146 LEU QD . . 4.950 5.674 2.730 8.008 3.058 2 10 "[ +* .*- *1 **** *]" 1
2407 1 11 PHE QE 1 42 LEU QD . . 3.990 4.105 3.207 5.570 1.580 13 4 "[ . * 1* + . -]" 1
2408 1 11 PHE HZ 1 42 LEU QD . . 4.360 4.636 3.433 6.580 2.220 13 8 "[ -. * 1* + * ***]" 1
2409 1 13 ILE QG 1 42 LEU QD . . 4.140 4.098 3.264 5.238 1.098 13 2 "[ . 1 + . -]" 1
2410 1 24 ASP H 1 26 ASP HA . . 5.500 7.445 5.524 8.130 2.630 11 18 "[*****-* **+********]" 1
2411 1 26 ASP HA 1 29 ARG HA . . 5.500 5.340 4.791 6.029 0.529 14 1 "[ . 1 +. ]" 1
2412 1 33 PRO QG 1 82 TYR QB . . 5.450 6.118 3.051 9.469 4.019 6 11 "[ * **+* 1 **-* **]" 1
2413 1 127 THR HA 1 129 CYS QB . . 5.210 5.079 4.840 6.175 0.965 2 1 "[ + . 1 . ]" 1
2414 1 29 ARG HA 1 29 ARG HE . . 5.320 4.635 3.013 5.508 0.188 6 0 "[ . 1 . ]" 1
2415 1 13 ILE QG 1 59 LEU HB3 . . 5.460 3.777 2.541 5.454 . 0 0 "[ . 1 . ]" 1
2416 1 11 PHE HZ 1 59 LEU HB2 . . 4.560 3.528 2.400 4.410 . 0 0 "[ . 1 . ]" 1
2417 1 69 PRO QD 1 97 ILE MD . . 4.530 5.511 2.892 8.168 3.638 12 11 "[* * . *-*1*+**.** ]" 1
2418 1 69 PRO QD 1 96 ALA MB . . 5.500 4.054 1.942 6.726 1.226 1 1 "[+ . 1 . ]" 1
2419 1 23 THR MG 1 29 ARG QD . . 5.440 6.702 4.922 8.472 3.032 3 15 "[**+**** *1* **-** *]" 1
2420 1 70 LYS QG 1 74 PHE QD . . 4.230 4.474 2.756 5.876 1.646 3 8 "[ +*.*- * *.* * ]" 1
2421 1 15 ALA HA 1 82 TYR QE . . 3.470 4.366 1.988 6.041 2.571 13 12 "[* -*** ***+ .*** ]" 1
2422 1 33 PRO QG 1 82 TYR QE . . 4.500 6.758 4.161 9.605 5.105 18 14 "[ ****** ** **-* +*]" 1
2423 1 70 LYS QE 1 74 PHE QD . . 4.300 5.060 2.969 7.518 3.218 6 10 "[* *.+***1* * *- ]" 1
2424 1 115 PHE QD 1 118 GLN QG . . 4.210 5.131 3.361 6.321 2.111 11 14 "[** **-* **+***** ]" 1
2425 1 33 PRO QG 1 82 TYR QD . . 4.080 6.333 3.541 9.434 5.354 6 15 "[ ****+* -** **** **]" 1
2426 1 37 LEU HG 1 82 TYR QE . . 4.450 4.914 3.474 6.304 1.854 18 9 "[ * *** *- * . +*]" 1
2427 1 60 ILE QG 1 64 HIS HD2 . . 4.360 4.797 3.998 5.417 1.057 5 9 "[ *-*+** 1* *. *]" 1
2428 1 12 ASN QB 1 83 GLU QB . . 4.760 6.191 3.766 8.318 3.558 7 14 "[******+ ** * **-* ]" 1
2429 1 12 ASN QD 1 83 GLU H . . 5.060 5.612 3.255 7.390 2.330 5 11 "[ * *+* **-* .*** ]" 1
2430 1 12 ASN QD 1 83 GLU QB . . 4.330 5.547 1.974 8.676 4.346 5 12 "[** -+** ** * .*** ]" 1
2431 1 12 ASN QD 1 83 GLU QG . . 5.060 4.981 1.868 7.924 2.864 6 9 "[ * *+ ** * .*-* ]" 1
2432 1 13 ILE HA 1 133 LEU QD . . 5.300 4.294 3.286 5.378 0.078 13 0 "[ . 1 . ]" 1
2433 1 14 VAL QG 1 18 SER QB . . 4.560 3.603 2.997 4.891 0.331 12 0 "[ . 1 . ]" 1
2434 1 14 VAL QG 1 33 PRO QG . . 2.720 4.111 1.971 6.426 3.706 4 13 "[* *+*** *1* **.*-* ]" 1
2435 1 14 VAL QG 1 33 PRO QD . . 5.180 5.247 3.495 7.812 2.632 4 7 "[ +.** 1- *.* * ]" 1
2436 1 15 ALA MB 1 83 GLU QB . . 4.720 5.885 3.725 7.009 2.289 11 12 "[*** *** *+ * - ** ]" 1
2437 1 18 SER QB 1 82 TYR QE . . 4.900 6.146 4.076 7.956 3.056 13 15 "[** *** -***+*.****]" 1
2438 1 19 ASN QD 1 80 HIS H . . 5.290 6.875 3.316 11.456 6.166 13 15 "[*-**** ****+ .****]" 1
2439 1 19 ASN QD 1 81 THR H . . 4.850 5.875 3.889 10.155 5.305 13 11 "[* **.* -**+ . ***]" 1
2440 1 19 ASN QD 1 81 THR MG . . 4.110 5.458 3.256 8.253 4.143 13 16 "[******* -** +** ***]" 1
2441 1 27 ALA H 1 32 LEU QD . . 4.700 5.052 3.090 7.710 3.010 9 5 "[* - . +1* . * ]" 1
2442 1 27 ALA HA 1 32 LEU QD . . 3.810 5.005 2.204 7.425 3.615 11 12 "[*** .- *1+** .****]" 1
2443 1 34 GLY QA 1 36 LYS H . . 4.010 4.449 3.468 6.076 2.066 16 7 "[ -**.** 1 .+ * ]" 1
2444 1 34 GLY QA 1 82 TYR QD . . 3.890 4.731 2.832 6.799 2.909 7 9 "[* **.*+ 1* -.* * ]" 1
2445 1 34 GLY QA 1 83 GLU H . . 4.530 6.310 3.232 9.644 5.114 6 16 "[*****+* *** **-* **]" 1
2446 1 37 LEU QD 1 40 GLU QG . . 5.440 4.392 3.980 4.981 . 0 0 "[ . 1 . ]" 1
2447 1 37 LEU QD 1 82 TYR QD . . 3.700 3.655 2.808 5.827 2.127 6 4 "[ *+ - . *]" 1
2448 1 37 LEU QD 1 82 TYR QE . . 3.480 3.679 2.324 5.248 1.768 6 7 "[ *+- ** . **]" 1
2449 1 45 MET ME 1 48 ASN QD . . 4.340 4.458 2.232 5.768 1.428 4 7 "[ * +* * * . -* ]" 1
2450 1 46 GLU QG 1 59 LEU QD . . 4.290 4.161 2.328 5.299 1.009 7 4 "[-* . + 1 * . ]" 1
2451 1 50 ARG H 1 133 LEU QD . . 4.940 5.459 4.514 6.172 1.232 11 10 "[ *** *+ *-** * ]" 1
2452 1 61 CYS QB 1 62 LEU H . . 3.590 2.439 2.258 2.664 . 0 0 "[ . 1 . ]" 1
2453 1 64 HIS QB 1 64 HIS HD2 . . 3.490 3.277 3.238 3.297 . 0 0 "[ . 1 . ]" 1
2454 1 68 THR H 1 72 LYS QD . . 5.190 5.917 4.538 6.935 1.745 1 12 "[+**** * ** - .*** ]" 1
2455 1 76 PRO QD 1 77 GLY H . . 4.960 5.000 4.968 5.011 0.051 13 0 "[ . 1 . ]" 1
2456 1 78 ARG QB 1 115 PHE QB . . 5.180 4.330 3.857 5.233 0.053 1 0 "[ . 1 . ]" 1
2457 1 78 ARG QD 1 112 MET ME . . 3.650 4.215 3.035 5.283 1.633 16 10 "[* * * -1 ***+ **]" 1
2458 1 78 ARG QD 1 116 ILE MD . . 5.340 5.704 4.781 7.011 1.671 16 6 "[- ** 1 * *+ ]" 1
2459 1 109 LEU QD 1 113 GLU QG . . 4.550 2.824 1.953 4.099 . 0 0 "[ . 1 . ]" 1
2460 1 139 SER HA 1 139 SER QB . . 2.630 2.419 2.168 2.541 . 0 0 "[ . 1 . ]" 1
2461 1 142 LEU QD 1 145 TRP QB . . 3.590 3.564 2.802 4.346 0.756 10 2 "[ . + - . ]" 1
2462 1 148 GLN HA 1 148 GLN QE . . 5.340 4.014 2.322 5.511 0.171 18 0 "[ . 1 . ]" 1
2463 1 46 GLU QG 1 49 ALA H . . 5.090 5.019 4.308 5.393 0.303 3 0 "[ . 1 . ]" 1
2464 1 46 GLU QB 1 47 ALA H . . 3.150 3.303 2.337 3.500 0.350 1 0 "[ . 1 . ]" 1
2465 1 31 LYS HA 1 32 LEU H . . 3.180 2.897 2.143 3.570 0.390 1 0 "[ . 1 . ]" 1
2466 1 61 CYS H 1 61 CYS HB3 . . 3.250 2.716 2.399 3.069 . 0 0 "[ . 1 . ]" 1
2467 1 129 CYS H 1 131 LYS QB . . 5.500 5.866 5.394 6.126 0.626 2 6 "[ + . **- .* * ]" 1
2468 1 138 CYS HA 1 142 LEU H . . 5.500 5.493 4.979 6.332 0.832 12 1 "[ . 1 + . ]" 1
2469 1 59 LEU H 1 59 LEU HB3 . . 3.930 3.578 3.555 3.588 . 0 0 "[ . 1 . ]" 1
2470 1 107 LYS QB 1 108 ASP H . . 3.560 3.519 3.430 3.637 0.077 12 0 "[ . 1 . ]" 1
2471 1 70 LYS H 1 96 ALA MB . . 5.500 7.045 4.787 10.321 4.821 1 14 "[+- **** **** ** **]" 1
2472 1 61 CYS HB3 1 63 SER H . . 4.860 4.774 4.575 5.009 0.149 16 0 "[ . 1 . ]" 1
2473 1 78 ARG QB 1 79 CYS H . . 5.200 3.186 2.722 3.818 . 0 0 "[ . 1 . ]" 1
2474 1 58 CYS H 1 59 LEU HB2 . . 5.350 5.067 4.678 5.350 . 0 0 "[ . 1 . ]" 1
2475 1 45 MET ME 1 136 VAL H . . 4.710 6.303 4.578 9.730 5.020 7 14 "[-*****+* * ** .*** ]" 1
2476 1 20 PHE HZ 1 65 ILE MD . . 4.110 5.191 3.357 7.176 3.066 12 12 "[** *. ** *-+**. * *]" 1
2477 1 65 ILE HB 1 65 ILE MD . . 3.370 2.377 2.231 2.510 . 0 0 "[ . 1 . ]" 1
2478 1 100 ILE MD 1 106 PHE QD . . 4.020 3.924 3.070 4.428 0.408 10 0 "[ . 1 . ]" 1
2479 1 144 LYS QE 1 145 TRP HD1 . . 4.720 3.795 2.454 4.968 0.248 17 0 "[ . 1 . ]" 1
2480 1 127 THR HB 1 130 LEU HG . . 4.710 5.955 4.734 6.855 2.145 3 17 "[**+********* ** *-*]" 1
2481 1 17 ALA MB 1 136 VAL HB . . 4.240 5.055 3.177 7.822 3.582 13 14 "[ ******- * *+*.*** ]" 1
2482 1 145 TRP QB 1 145 TRP HZ3 . . 5.500 4.737 4.639 4.859 . 0 0 "[ . 1 . ]" 1
2483 1 22 THR MG 1 23 THR HA . . 3.620 3.480 3.040 4.108 0.488 11 0 "[ . 1 . ]" 1
2484 1 106 PHE HZ 1 114 GLN HA . . 5.000 4.870 4.418 5.696 0.696 10 1 "[ . + . ]" 1
2485 1 17 ALA MB 1 133 LEU MD1 . . 4.430 3.871 1.798 5.336 0.906 18 1 "[ . 1 . + ]" 1
2486 1 68 THR MG 1 72 LYS H . . 5.500 5.341 4.762 5.752 0.252 14 0 "[ . 1 . ]" 1
2487 1 17 ALA MB 1 133 LEU MD2 . . 4.430 2.637 1.851 4.204 . 0 0 "[ . 1 . ]" 1
2488 1 46 GLU QB 1 47 ALA MB . . 3.760 4.559 3.764 4.737 0.977 1 15 "[+** **** 1 ****-***]" 1
2489 1 71 MET ME 1 78 ARG QB . . 3.360 3.869 2.681 4.873 1.513 1 9 "[+* * -* * * *. *]" 1
2490 1 129 CYS H 1 130 LEU QD . . 4.930 4.506 3.906 5.000 0.070 19 0 "[ . 1 . ]" 1
2491 1 60 ILE MG 1 61 CYS HB3 . . 4.790 5.130 4.669 5.474 0.684 6 6 "[ *-*+ 1 * *]" 1
2492 1 116 ILE MG 1 120 ASP H . . 3.910 3.744 3.344 3.999 0.089 17 0 "[ . 1 . ]" 1
2493 1 20 PHE HZ 1 62 LEU HA . . 5.500 5.557 3.723 7.473 1.973 12 7 "[** . * - +**. ]" 1
2494 1 59 LEU HB3 1 60 ILE MD . . 5.330 5.274 3.193 5.955 0.625 13 5 "[ **.- 1 + . *]" 1
2495 1 45 MET ME 1 137 GLN H . . 5.500 6.520 4.561 8.866 3.366 7 13 "[ *-***+* * ** .*** ]" 1
2496 1 55 THR MG 1 56 ARG HA . . 5.500 5.027 4.326 5.530 0.030 12 0 "[ . 1 . ]" 1
2497 1 20 PHE QE 1 63 SER H . . 5.500 6.684 5.528 7.781 2.281 14 16 "[****-** ****+* ***]" 1
2498 1 20 PHE QE 1 119 VAL HA . . 5.200 5.647 4.372 7.087 1.887 13 8 "[ *.* * - *+ . * *]" 1
2499 1 13 ILE HA 1 59 LEU QD . . 4.950 3.411 2.887 4.841 . 0 0 "[ . 1 . ]" 1
2500 1 13 ILE HB 1 59 LEU QD . . 4.610 3.421 2.535 4.388 . 0 0 "[ . 1 . ]" 1
2501 1 13 ILE MD 1 48 ASN QB . . 5.340 4.828 3.702 5.519 0.179 7 0 "[ . 1 . ]" 1
2502 1 14 VAL QG 1 17 ALA MB . . 4.340 3.890 3.140 4.390 0.050 6 0 "[ . 1 . ]" 1
2503 1 14 VAL QG 1 18 SER H . . 5.440 4.189 3.771 4.850 . 0 0 "[ . 1 . ]" 1
2504 1 15 ALA H 1 42 LEU QD . . 4.530 4.196 3.583 5.164 0.634 14 1 "[ . 1 +. ]" 1
2505 1 16 VAL H 1 59 LEU QD . . 5.440 5.547 4.854 6.920 1.480 6 4 "[ .+ - 1 ** ]" 1
2506 1 16 VAL H 1 133 LEU QD . . 4.660 5.237 4.471 5.789 1.129 13 12 "[* .*****-*+ . ***]" 1
2507 1 17 ALA H 1 136 VAL QG . . 5.440 5.909 4.579 7.773 2.333 13 7 "[ - .*** * *+ . ]" 1
2508 1 19 ASN QB 1 78 ARG QD . . 4.640 3.510 1.941 7.402 2.762 12 2 "[ . 1 + . - ]" 1
2509 1 20 PHE QB 1 134 ALA H . . 4.900 4.933 3.011 6.017 1.117 13 4 "[ * - 1 + . * ]" 1
2510 1 20 PHE QE 1 59 LEU QD . . 4.400 4.579 3.180 5.712 1.312 15 10 "[* **.* *- *+* *]" 1
2511 1 20 PHE HZ 1 59 LEU QD . . 4.740 5.365 3.321 6.618 1.878 14 13 "[* **** -*1* +** **]" 1
2512 1 21 ALA MB 1 25 LEU QD . . 3.510 4.300 1.815 8.058 4.548 6 10 "[ -*+** * *** * ]" 1
2513 1 22 THR HA 1 25 LEU QD . . 4.270 6.595 3.701 9.596 5.326 6 16 "[** **+** *-***** **]" 1
2514 1 22 THR HB 1 25 LEU QD . . 5.440 7.275 5.128 9.967 4.527 6 12 "[* -*+** * * *** * ]" 1
2515 1 22 THR MG 1 25 LEU QD . . 3.870 5.144 3.095 7.158 3.288 10 15 "[* *-*****+ * ***** ]" 1
2516 1 37 LEU QD 1 82 TYR QB . . 5.440 4.077 3.120 6.312 0.872 6 1 "[ .+ 1 . ]" 1
2517 1 41 VAL QG 1 46 GLU H . . 5.440 5.561 5.081 6.046 0.606 4 1 "[ +. 1 . ]" 1
2518 1 45 MET QG 1 136 VAL QG . . 3.770 3.614 2.219 5.780 2.010 13 3 "[ . * 1 + .- ]" 1
2519 1 48 ASN H 1 133 LEU QD . . 5.440 6.109 4.784 6.973 1.533 10 11 "[*****- * +* * * ]" 1
2520 1 59 LEU QD 1 133 LEU QD . . 3.180 2.374 1.766 3.072 . 0 0 "[ . 1 . ]" 1
2521 1 71 MET QG 1 75 ILE H . . 4.950 4.554 3.564 5.421 0.471 3 0 "[ . 1 . ]" 1
2522 1 75 ILE H 1 76 PRO QD . . 4.150 3.257 2.927 3.564 . 0 0 "[ . 1 . ]" 1
2523 1 96 ALA HA 1 98 VAL QG . . 4.800 5.111 4.265 6.361 1.561 5 5 "[* *+ 1 .- *]" 1
2524 1 97 ILE H 1 98 VAL QG . . 3.070 3.852 2.877 4.940 1.870 6 12 "[* **+* ** - ** **]" 1
2525 1 110 GLU H 1 113 GLU QG . . 5.340 4.700 3.698 5.212 . 0 0 "[ . 1 . ]" 1
2526 1 112 MET H 1 112 MET QB . . 3.010 2.167 2.043 2.233 . 0 0 "[ . 1 . ]" 1
2527 1 112 MET QB 1 113 GLU H . . 3.260 2.501 2.424 2.643 . 0 0 "[ . 1 . ]" 1
2528 1 112 MET QB 1 116 ILE MD . . 4.570 3.721 2.998 3.939 . 0 0 "[ . 1 . ]" 1
2529 1 116 ILE MG 1 120 ASP QB . . 4.130 2.991 2.356 3.553 . 0 0 "[ . 1 . ]" 1
2530 1 117 ALA HA 1 120 ASP QB . . 3.410 2.987 2.474 3.278 . 0 0 "[ . 1 . ]" 1
2531 1 119 VAL H 1 120 ASP QB . . 5.030 4.498 4.320 4.595 . 0 0 "[ . 1 . ]" 1
2532 1 119 VAL QG 1 120 ASP QB . . 4.730 3.981 2.765 4.408 . 0 0 "[ . 1 . ]" 1
2533 1 120 ASP H 1 120 ASP QB . . 3.110 2.169 2.056 2.262 . 0 0 "[ . 1 . ]" 1
2534 1 120 ASP QB 1 121 LEU QD . . 4.620 3.620 2.176 4.052 . 0 0 "[ . 1 . ]" 1
2535 1 120 ASP QB 1 122 CYS H . . 5.090 4.816 4.623 5.014 . 0 0 "[ . 1 . ]" 1
2536 1 121 LEU QD 1 123 VAL H . . 5.440 5.362 5.108 5.598 0.158 19 0 "[ . 1 . ]" 1
2537 1 123 VAL HA 1 124 ASP QB . . 5.160 4.929 4.563 5.110 . 0 0 "[ . 1 . ]" 1
2538 1 125 CYS H 1 125 CYS QB . . 3.060 2.484 2.228 2.970 . 0 0 "[ . 1 . ]" 1
2539 1 131 LYS QG 1 132 GLY QA . . 4.330 3.421 2.855 5.275 0.945 19 3 "[- . * 1 . +]" 1
2540 1 132 GLY H 1 133 LEU QD . . 5.440 4.613 3.661 5.540 0.100 13 0 "[ . 1 . ]" 1
2541 1 80 HIS H 1 115 PHE QE . . 5.500 8.045 5.406 9.914 4.414 18 18 [-********1*******+*] 1
2542 1 114 GLN QG 1 116 ILE H . . 5.120 5.859 4.965 6.086 0.966 13 17 "[**-******1**+***** ]" 1
2543 1 139 SER H 1 141 LEU H . . 5.500 5.170 4.740 5.482 . 0 0 "[ . 1 . ]" 1
2544 1 107 LYS H 1 107 LYS QD . . 3.510 3.465 2.155 4.133 0.623 19 9 "[ ***-**1* . *+]" 1
2545 1 111 PRO HG2 1 112 MET H . . 4.340 2.083 1.966 2.231 . 0 0 "[ . 1 . ]" 1
2546 1 69 PRO QD 1 98 VAL H . . 5.500 4.300 2.752 5.822 0.322 17 0 "[ . 1 . ]" 1
2547 1 11 PHE QE 1 17 ALA H . . 5.500 6.183 5.398 6.702 1.202 16 14 "[ **** ***1**-*.+ **]" 1
2548 1 30 GLY H 1 32 LEU QB . . 5.010 5.533 4.309 6.731 1.721 12 10 "[** ** *- 1 + * * *]" 1
2549 1 11 PHE H 1 60 ILE MD . . 5.000 5.277 4.042 6.016 1.016 15 5 "[ * -* 1 + *]" 1
2550 1 47 ALA H 1 50 ARG QD . . 5.500 5.772 4.602 6.908 1.408 5 9 "[ * *+-* *1* ** ]" 1
2551 1 41 VAL H 1 141 LEU QB . . 4.280 5.295 4.201 6.700 2.420 12 13 "[* *** ** - +* *** *]" 1
2552 1 74 PHE HB3 1 111 PRO HG3 . . 4.350 3.032 2.096 3.949 . 0 0 "[ . 1 . ]" 1
2553 1 13 ILE HB 1 46 GLU QG . . 4.210 4.388 2.442 5.177 0.967 8 6 "[*- * + 1 * * ]" 1
2554 1 45 MET H 1 46 GLU QG . . 4.980 4.462 3.661 6.072 1.092 9 3 "[ -. +1* . ]" 1
2555 1 110 GLU QG 1 114 GLN H . . 3.840 4.689 3.453 6.116 2.276 16 9 "[* * **-* 1* .+* ]" 1
2556 1 75 ILE MD 1 114 GLN QG . . 4.610 5.626 3.668 6.239 1.629 14 17 "[**-******1***+**** ]" 1
2557 1 114 GLN QG 1 118 GLN QB . . 5.060 6.394 4.647 6.922 1.862 5 17 "[****+****1******-* ]" 1
2558 1 114 GLN QG 1 118 GLN QG . . 4.600 4.907 3.123 5.842 1.242 3 7 "[* +*. *1- .** ]" 1
2559 1 13 ILE QG 1 45 MET QB . . 4.510 3.585 1.941 4.247 . 0 0 "[ . 1 . ]" 1
2560 1 106 PHE H 1 107 LYS QD . . 4.060 5.347 3.779 6.248 2.188 5 14 "[* *+****1* *-****]" 1
2561 1 141 LEU QB 1 145 TRP QB . . 5.000 5.252 4.410 5.937 0.937 17 6 "[ .*** 1 * .-+ ]" 1
2562 1 97 ILE MG 1 107 LYS QB . . 5.290 5.680 3.465 7.377 2.087 4 9 "[ **+* - *1* * .* ]" 1
2563 1 16 VAL QG 1 63 SER HB3 . . 3.880 3.004 1.966 4.095 0.215 19 0 "[ . 1 . ]" 1
2564 1 29 ARG QB 1 31 LYS QG . . 5.170 5.379 1.974 7.185 2.015 9 10 "[*** .* +1* .**-*]" 1
2565 1 114 GLN QG 1 115 PHE HA . . 3.390 5.389 3.164 5.735 2.345 5 17 "[****+****1******-* ]" 1
2566 1 11 PHE QE 1 46 GLU QB . . 5.300 3.672 3.118 4.930 . 0 0 "[ . 1 . ]" 1
2567 1 74 PHE HA 1 111 PRO HG3 . . 5.500 5.007 4.566 5.879 0.379 7 0 "[ . 1 . ]" 1
2568 1 56 ARG HA 1 60 ILE HB . . 4.750 5.180 4.524 5.663 0.913 5 10 "[ *- +** 1* *** *]" 1
2569 1 42 LEU HA 1 46 GLU QG . . 5.340 5.043 3.943 6.590 1.250 4 3 "[ +. -1* . ]" 1
2570 1 146 LEU QD 1 149 ARG QD . . 4.120 6.886 1.917 9.895 5.775 8 12 "[ **.**+*1*** * - *]" 1
2571 1 49 ALA MB 1 133 LEU MD1 . . 4.440 3.390 2.044 4.162 . 0 0 "[ . 1 . ]" 1
2572 1 61 CYS HB3 1 62 LEU HA . . 4.910 4.116 3.895 4.392 . 0 0 "[ . 1 . ]" 1
2573 1 16 VAL QG 1 19 ASN HD21 . . 5.280 3.815 1.962 5.321 0.041 11 0 "[ . 1 . ]" 1
2574 1 16 VAL QG 1 63 SER HB2 . . 3.880 2.715 1.922 4.029 0.149 17 0 "[ . 1 . ]" 1
2575 1 11 PHE HB3 1 16 VAL QG . . 5.500 5.708 5.252 5.997 0.497 4 0 "[ . 1 . ]" 1
2576 1 75 ILE MG 1 111 PRO QB . . 3.520 3.213 2.267 3.464 . 0 0 "[ . 1 . ]" 1
2577 1 147 PRO QD 1 149 ARG H . . 5.350 5.833 4.151 7.778 2.428 13 11 "[ **.**-*1* + * * *]" 1
2578 1 17 ALA MB 1 149 ARG QD . . 5.500 10.775 4.416 16.114 10.614 19 17 "[****-****1******* +]" 1
2579 1 49 ALA MB 1 133 LEU MD2 . . 4.440 2.689 1.832 4.317 . 0 0 "[ . 1 . ]" 1
2580 1 71 MET ME 1 115 PHE QE . . 4.640 4.820 4.128 5.227 0.587 5 2 "[ + - 1 . ]" 1
2581 1 16 VAL QG 1 19 ASN HD22 . . 5.310 4.414 2.627 5.675 0.365 11 0 "[ . 1 . ]" 1
2582 1 60 ILE MD 1 63 SER H . . 5.500 6.216 4.930 6.565 1.065 6 16 "[*****+***1* ***- **]" 1
2583 1 59 LEU HG 1 60 ILE MD . . 5.090 5.937 4.755 6.790 1.700 13 15 "[*********1* +** -*]" 1
2584 1 75 ILE MG 1 113 GLU H . . 5.500 6.169 5.573 6.532 1.032 4 14 "[** +*-* *1* **** **]" 1
2585 1 75 ILE MG 1 111 PRO HG2 . . 4.490 3.862 2.986 4.403 . 0 0 "[ . 1 . ]" 1
2586 1 14 VAL QG 1 33 PRO QB . . 4.180 4.277 2.020 6.480 2.300 3 10 "[* +*.** *1* *.- * ]" 1
2587 1 111 PRO HG2 1 114 GLN QB . . 5.500 5.725 5.430 5.986 0.486 16 0 "[ . 1 . ]" 1
2588 1 74 PHE QD 1 111 PRO HG3 . . 3.390 2.977 2.468 3.630 0.240 7 0 "[ . 1 . ]" 1
2589 1 11 PHE QD 1 16 VAL HB . . 5.470 5.258 4.366 6.482 1.012 14 5 "[ *. -*1 +. *]" 1
2590 1 114 GLN QG 1 115 PHE QD . . 5.500 6.862 4.687 7.143 1.643 6 17 "[*****+-**1******** ]" 1
2591 1 11 PHE HB3 1 63 SER QB . . 4.730 4.095 3.185 4.790 0.060 2 0 "[ . 1 . ]" 1
2592 1 12 ASN QB 1 82 TYR QE . . 3.450 3.019 1.946 4.488 1.038 1 3 "[+ .- * 1 . ]" 1
2593 1 12 ASN QD 1 16 VAL QG . . 4.380 4.100 1.975 5.781 1.401 15 8 "[ **. *1 - *+* *]" 1
2594 1 19 ASN QB 1 65 ILE MD . . 5.340 5.220 3.928 6.876 1.536 17 3 "[ . 1* . + -]" 1
2595 1 33 PRO QB 1 146 LEU QB . . 4.970 5.847 4.133 10.818 5.848 3 11 "[ -+*.****1* *.* * ]" 1
2596 1 37 LEU QD 1 40 GLU H . . 5.440 5.998 5.502 6.459 1.019 13 13 "[* *-****1 +*** **]" 1
2597 1 38 PRO QD 1 39 LEU H . . 4.960 5.003 4.998 5.007 0.047 17 0 "[ . 1 . ]" 1
2598 1 41 VAL H 1 42 LEU QD . . 4.100 4.861 3.340 5.320 1.220 2 14 "[*+*****-** * *.* * ]" 1
2599 1 42 LEU QB 1 43 LYS HA . . 4.260 3.945 3.682 4.296 0.036 10 0 "[ . 1 . ]" 1
2600 1 42 LEU QB 1 46 GLU QG . . 4.560 4.771 3.642 6.386 1.826 4 5 "[ - +* *1* . ]" 1
2601 1 48 ASN QB 1 136 VAL H . . 5.150 4.795 4.165 5.605 0.455 1 0 "[ . 1 . ]" 1
2602 1 57 GLY H 1 124 ASP QB . . 5.340 5.758 5.186 6.671 1.331 11 8 "[ ***. * *1+ -* ]" 1
2603 1 70 LYS H 1 71 MET QG . . 5.320 4.823 3.882 6.069 0.749 1 1 "[+ . 1 . ]" 1
2604 1 75 ILE MG 1 111 PRO QD . . 5.350 5.345 4.517 5.788 0.438 7 0 "[ . 1 . ]" 1
2605 1 129 CYS H 1 131 LYS QG . . 5.190 4.430 4.008 5.737 0.547 19 1 "[ . 1 . +]" 1
2606 1 130 LEU H 1 131 LYS QG . . 4.730 4.074 3.805 4.437 . 0 0 "[ . 1 . ]" 1
2607 1 146 LEU QD 1 149 ARG H . . 5.440 6.157 4.270 8.406 2.966 13 12 "[ -*.****1**+ * * *]" 1
2608 1 146 LEU QD 1 149 ARG HA . . 5.440 7.617 5.172 9.115 3.675 4 14 "[ -*+.****1*** * ***]" 1
2609 1 146 LEU QD 1 149 ARG QB . . 5.380 6.322 2.737 8.453 3.073 12 12 "[ **.****1*+- * * *]" 1
2610 1 146 LEU QD 1 149 ARG HE . . 3.930 7.882 2.273 12.165 8.235 4 13 "[ -*+.****1*** * * *]" 1
2611 1 146 LEU QD 1 150 CYS H . . 5.100 6.495 4.056 7.982 2.882 15 13 "[ **.****1*** + *-*]" 1
2612 1 148 GLN QG 1 149 ARG QG . . 4.670 4.928 2.309 7.009 2.339 16 10 "[***** *- *+ *]" 1
2613 1 148 GLN QG 1 150 CYS H . . 5.340 5.672 4.492 6.947 1.607 15 5 "[-* * 1 +* ]" 1
2614 1 17 ALA HA 1 21 ALA H . . 5.060 4.702 3.932 5.473 0.413 13 0 "[ . 1 . ]" 1
2615 1 65 ILE MD 1 118 GLN H . . 4.500 4.756 4.459 5.124 0.624 12 1 "[ . 1 + . ]" 1
2616 1 143 LYS H 1 145 TRP QB . . 5.500 5.373 5.008 5.792 0.292 7 0 "[ . 1 . ]" 1
2617 1 16 VAL HA 1 20 PHE QB . . 5.500 5.845 5.148 6.900 1.400 6 7 "[ - .+ 1*** . ** ]" 1
2618 1 110 GLU HB2 1 111 PRO QD . . 4.480 2.508 1.824 3.422 . 0 0 "[ . 1 . ]" 1
2619 1 13 ILE QG 1 62 LEU QD . . 5.310 5.173 4.381 6.065 0.755 17 1 "[ . 1 . + ]" 1
2620 1 68 THR MG 1 70 LYS H . . 4.900 4.329 4.205 4.443 . 0 0 "[ . 1 . ]" 1
2621 1 110 GLU HB3 1 111 PRO QD . . 4.480 2.207 1.672 2.687 . 0 0 "[ . 1 . ]" 1
2622 1 13 ILE MD 1 62 LEU QD . . 4.070 4.927 3.469 6.147 2.077 9 11 "[* *-.* *+** * . * *]" 1
2623 1 21 ALA MB 1 26 ASP QB . . 4.770 5.586 3.929 7.038 2.268 18 13 "[- **.****** *.**+ ]" 1
2624 1 100 ILE H 1 101 PRO HA . . 5.390 5.260 5.194 5.368 . 0 0 "[ . 1 . ]" 1
2625 1 104 PRO HA 1 107 LYS QD . . 3.060 4.836 2.411 6.394 3.334 11 15 "[- ********+** . ***]" 1
2626 1 45 MET ME 1 139 SER H . . 5.500 6.354 4.657 7.600 2.100 4 13 "[ **+**** * * *. **-]" 1
2627 1 99 ASP QB 1 107 LYS QD . . 5.500 5.389 2.773 6.776 1.276 7 6 "[ ** + -1 * . * ]" 1
2628 1 11 PHE QD 1 15 ALA MB . . 5.500 5.910 5.254 6.790 1.290 12 8 "[** **- 1*+ . * ]" 1
2629 1 78 ARG QG 1 115 PHE QE . . 5.500 5.123 4.158 5.662 0.162 10 0 "[ . 1 . ]" 1
2630 1 12 ASN H 1 42 LEU QD . . 4.750 4.631 4.099 5.279 0.529 5 1 "[ + 1 . ]" 1
2631 1 14 VAL QG 1 45 MET QB . . 3.630 3.477 2.528 4.833 1.203 10 5 "[ *- + * . * ]" 1
2632 1 16 VAL QG 1 20 PHE QB . . 4.010 4.584 3.501 5.216 1.206 6 12 "[ **.+-**1* **. ***]" 1
2633 1 20 PHE HA 1 119 VAL QG . . 5.120 5.060 3.891 7.025 1.905 17 4 "[ .- 1 * . + *]" 1
2634 1 33 PRO QB 1 142 LEU QD . . 3.710 5.372 2.293 7.667 3.957 3 15 "[* +**-****** *.*** ]" 1
2635 1 33 PRO QG 1 142 LEU QD . . 3.260 4.685 1.871 6.620 3.360 4 14 "[* *+**** *** *.-** ]" 1
2636 1 40 GLU H 1 42 LEU QD . . 5.250 5.411 4.327 6.027 0.777 9 5 "[*- .* *+1 . ]" 1
2637 1 56 ARG QB 1 60 ILE MD . . 3.230 2.456 1.910 3.571 0.341 12 0 "[ . 1 . ]" 1
2638 1 62 LEU QB 1 122 CYS QB . . 4.750 4.413 2.597 5.529 0.779 6 4 "[ *.+ 1 .* - ]" 1
2639 1 107 LYS QG 1 114 GLN QE . . 5.330 4.862 4.114 5.361 0.031 19 0 "[ . 1 . ]" 1
2640 1 112 MET H 1 113 GLU QG . . 4.650 5.905 4.529 6.401 1.751 10 15 "[******-**+****. *]" 1
2641 1 117 ALA H 1 118 GLN QE . . 5.340 5.620 4.175 6.374 1.034 19 9 "[ * ** - 1 ***. *+]" 1
2642 1 28 ASP HA 1 29 ARG H . . 3.480 3.490 3.447 3.513 0.033 15 0 "[ . 1 . ]" 1
2643 1 30 GLY H 1 31 LYS QG . . 5.500 5.355 4.035 6.831 1.331 19 4 "[ * - 1 * . +]" 1
2644 1 21 ALA HA 1 25 LEU QB . . 5.060 7.477 4.148 11.348 6.288 8 12 "[ - ****+ * **** * ]" 1
2645 1 40 GLU QG 1 141 LEU QB . . 4.560 4.648 3.891 5.704 1.144 12 5 "[ * . - 1 +* * ]" 1
2646 1 139 SER HB3 1 142 LEU QD . . 6.610 3.072 1.972 4.904 . 0 0 "[ . 1 . ]" 1
2647 1 104 PRO HA 1 105 ARG H . . 3.520 3.549 3.507 3.575 0.055 5 0 "[ . 1 . ]" 1
2648 1 14 VAL HB 1 42 LEU H . . 5.140 6.057 4.424 7.716 2.576 14 11 "[*** . *-*1 * +* * *]" 1
2649 1 80 HIS HA 1 81 THR HB . . 5.170 5.006 4.387 5.540 0.370 18 0 "[ . 1 . ]" 1
2650 1 81 THR MG 1 83 GLU HA . . 3.970 5.728 3.634 7.013 3.043 18 18 "[********-* ******+*]" 1
2651 1 120 ASP HA 1 122 CYS H . . 4.750 4.377 4.071 4.626 . 0 0 "[ . 1 . ]" 1
2652 1 80 HIS HA 1 81 THR MG . . 3.750 4.712 3.452 5.592 1.842 14 12 "[**-**** * *+** ]" 1
2653 1 121 LEU HG 1 123 VAL QG . . 5.500 5.523 4.169 5.974 0.474 8 0 "[ . 1 . ]" 1
2654 1 151 ALA MB 1 153 PHE H . . 3.160 2.907 2.447 3.894 0.734 16 2 "[ . - 1 .+ ]" 1
2655 1 45 MET H 1 45 MET ME . . 4.500 4.778 4.414 5.304 0.804 8 3 "[* . + 1 .- ]" 1
2656 1 20 PHE HA 1 112 MET ME . . 5.330 6.820 4.055 11.384 6.054 17 13 "[*-**. **** ***. + *]" 1
2657 1 61 CYS HA 1 65 ILE MD . . 5.350 5.810 4.804 6.473 1.123 17 10 "[ * *** * * * +*-]" 1
2658 1 115 PHE QB 1 116 ILE MG . . 5.500 5.318 5.180 5.437 . 0 0 "[ . 1 . ]" 1
2659 1 29 ARG HA 1 32 LEU H . . 5.080 6.170 2.966 7.936 2.856 15 13 "[ - ***** * **+* **]" 1
2660 1 23 THR MG 1 149 ARG HE . . 5.060 8.416 4.258 14.876 9.816 19 16 "[****** *** **-** *+]" 1
2661 1 23 THR MG 1 149 ARG QD . . 4.870 7.718 4.139 14.346 9.476 19 15 "[****** *** **-* *+]" 1
2662 1 139 SER HB2 1 142 LEU QD . . 6.610 2.565 1.901 4.292 . 0 0 "[ . 1 . ]" 1
2663 1 12 ASN QB 1 81 THR HB . . 5.340 5.286 4.095 7.701 2.361 8 3 "[ - . + 1 * . ]" 1
2664 1 18 SER H 1 142 LEU QD . . 5.440 6.890 5.446 7.873 2.433 19 18 "[******-*** *******+]" 1
2665 1 18 SER HA 1 136 VAL QG . . 4.180 6.264 4.258 8.950 4.770 13 17 "[ ********* *+***-**]" 1
2666 1 18 SER QB 1 142 LEU QD . . 5.150 6.358 4.391 6.952 1.802 14 17 "[-******* * **+*****]" 1
2667 1 20 PHE HZ 1 65 ILE QG . . 5.340 6.843 4.986 8.718 3.378 13 12 "[** *.-** * *+*. * *]" 1
2668 1 22 THR H 1 136 VAL QG . . 4.480 7.949 4.498 11.066 6.586 13 18 "[*****-**** *+******]" 1
2669 1 25 LEU QB 1 148 GLN QG . . 4.670 6.990 2.860 11.045 6.375 1 14 "[+**** -*** * *** *]" 1
2670 1 29 ARG HA 1 33 PRO QD . . 5.350 7.818 4.723 10.711 5.361 10 14 "[ * ***** + -**** **]" 1
2671 1 29 ARG HA 1 146 LEU QD . . 5.430 8.042 3.933 11.904 6.474 10 16 "[** ***** + *****-**]" 1
2672 1 32 LEU H 1 146 LEU QD . . 4.290 5.447 2.834 7.482 3.192 4 14 "[* +**** * * *-****]" 1
2673 1 38 PRO QB 1 42 LEU QD . . 5.440 5.683 4.432 6.552 1.112 2 7 "[*+ *- ** *. ]" 1
2674 1 41 VAL QG 1 42 LEU QD . . 4.330 3.696 2.692 4.735 0.405 3 0 "[ . 1 . ]" 1
2675 1 65 ILE QG 1 115 PHE QD . . 4.920 5.549 4.348 6.231 1.311 7 14 "[***-* +*** **** *]" 1
2676 1 65 ILE QG 1 115 PHE QE . . 4.940 5.201 4.178 6.023 1.083 7 6 "[ . + -1 **** ]" 1
2677 1 66 LYS HA 1 118 GLN QE . . 5.340 4.845 4.138 5.274 . 0 0 "[ . 1 . ]" 1
2678 1 66 LYS QB 1 118 GLN QG . . 4.910 4.627 3.188 5.893 0.983 3 5 "[ + . * **. - ]" 1
2679 1 130 LEU QB 1 133 LEU QD . . 5.190 4.246 3.707 5.070 . 0 0 "[ . 1 . ]" 1
2680 1 148 GLN HA 1 148 GLN QG . . 3.510 2.469 2.071 3.312 . 0 0 "[ . 1 . ]" 1
2681 1 14 VAL H 1 17 ALA MB . . 4.480 4.799 4.280 5.364 0.884 11 2 "[ . - 1+ . ]" 1
2682 1 13 ILE HB 1 46 GLU H . . 4.230 4.404 4.051 4.803 0.573 11 3 "[ *. -1+ . ]" 1
2683 1 39 LEU MD2 1 40 GLU H . . 4.710 3.821 3.716 3.921 . 0 0 "[ . 1 . ]" 1
2684 1 149 ARG QD 1 150 CYS H . . 4.510 4.981 2.693 6.035 1.525 6 11 "[ **.+** -*** . * *]" 1
2685 1 103 ILE HB 1 105 ARG H . . 3.830 4.895 3.744 5.403 1.573 16 18 "[*-*************+** ]" 1
2686 1 13 ILE MD 1 54 CYS QB . . 5.500 5.546 4.466 6.942 1.442 6 6 "[ *-.+ * 1* * . ]" 1
2687 1 117 ALA MB 1 120 ASP HB3 . . 5.280 4.722 4.128 5.163 . 0 0 "[ . 1 . ]" 1
2688 1 11 PHE QD 1 59 LEU HG . . 5.500 5.659 5.066 6.302 0.802 11 4 "[ .* 1+ * - ]" 1
2689 1 11 PHE QE 1 59 LEU HG . . 5.040 4.432 4.055 4.731 . 0 0 "[ . 1 . ]" 1
2690 1 14 VAL H 1 16 VAL QG . . 4.720 4.546 3.786 5.095 0.375 5 0 "[ . 1 . ]" 1
2691 1 25 LEU QD 1 149 ARG H . . 5.440 7.257 3.204 11.819 6.379 19 12 "[ ** * ***** *-* +]" 1
2692 1 41 VAL QG 1 42 LEU HA . . 3.400 3.368 2.915 3.728 0.328 3 0 "[ . 1 . ]" 1
2693 1 42 LEU HA 1 44 GLU QB . . 5.330 4.908 4.730 5.187 . 0 0 "[ . 1 . ]" 1
2694 1 45 MET QB 1 136 VAL QG . . 4.410 3.895 3.061 5.730 1.320 13 2 "[ . - 1 + . ]" 1
2695 1 55 THR H 1 58 CYS QB . . 3.680 2.636 2.129 3.048 . 0 0 "[ . 1 . ]" 1
2696 1 112 MET QB 1 113 GLU QB . . 4.360 3.876 3.626 4.276 . 0 0 "[ . 1 . ]" 1
2697 1 116 ILE HB 1 119 VAL QG . . 5.440 4.881 4.110 5.220 . 0 0 "[ . 1 . ]" 1
2698 1 146 LEU QB 1 150 CYS H . . 4.620 5.540 2.666 7.329 2.709 12 12 "[ **.***-1*+* * * *]" 1
2699 1 82 TYR HA 1 83 GLU H . . 2.890 3.358 2.695 3.563 0.673 2 15 "[*+- *** *** *** ***]" 1
2700 1 39 LEU QB 1 41 VAL H . . 5.500 5.044 4.863 5.190 . 0 0 "[ . 1 . ]" 1
2701 1 62 LEU QB 1 65 ILE H . . 5.500 5.005 4.928 5.171 . 0 0 "[ . 1 . ]" 1
2702 1 15 ALA H 1 16 VAL HA . . 5.500 5.219 5.079 5.435 . 0 0 "[ . 1 . ]" 1
2703 1 148 GLN HA 1 149 ARG QG . . 4.260 4.944 3.322 6.458 2.198 16 11 "[****- *** *.+ * ]" 1
2704 1 100 ILE QG 1 103 ILE HB . . 4.430 3.338 2.787 5.139 0.709 19 1 "[ . 1 . +]" 1
2705 1 70 LYS QG 1 72 LYS H . . 5.500 5.821 5.167 6.253 0.753 1 6 "[+ *. *1 *.* - ]" 1
2706 1 58 CYS HA 1 122 CYS HA . . 5.270 6.553 3.984 7.398 2.128 6 16 "[* ***+***** * **-**]" 1
2707 1 15 ALA MB 1 33 PRO QB . . 5.280 7.739 5.295 9.997 4.717 7 18 "[******+**** **-****]" 1
2708 1 13 ILE MD 1 20 PHE QD . . 5.480 5.660 4.540 6.531 1.051 15 5 "[* . 1 -*+* ]" 1
2709 1 11 PHE H 1 11 PHE QE . . 4.770 4.543 4.034 4.750 . 0 0 "[ . 1 . ]" 1
2710 1 13 ILE MD 1 20 PHE HZ . . 4.950 6.894 4.936 8.703 3.753 1 18 "[+-********* *******]" 1
2711 1 20 PHE QB 1 130 LEU QD . . 5.130 5.297 3.916 6.580 1.450 18 7 "[ *.* 1* **- + ]" 1
2712 1 48 ASN QD 1 133 LEU HA . . 4.550 5.907 4.606 6.681 2.131 10 17 "[*****-***+ *******]" 1
2713 1 48 ASN QD 1 133 LEU QD . . 4.900 5.583 3.780 6.723 1.823 10 11 "[***** * + * **-]" 1
2714 1 71 MET QG 1 72 LYS QE . . 5.340 6.198 4.707 7.459 2.119 14 10 "[ *-*. *** *+* * ]" 1
2715 1 103 ILE MD 1 120 ASP QB . . 5.250 4.179 3.273 4.597 . 0 0 "[ . 1 . ]" 1
2716 1 32 LEU H 1 146 LEU HA . . 5.390 7.307 4.770 8.834 3.444 7 17 "[* ****+***** ***-**]" 1
2717 1 60 ILE H 1 60 ILE MG . . 4.140 3.715 3.627 3.765 . 0 0 "[ . 1 . ]" 1
2718 1 57 GLY H 1 60 ILE QG . . 5.500 5.218 4.792 5.645 0.145 16 0 "[ . 1 . ]" 1
2719 1 18 SER H 1 33 PRO QG . . 5.500 8.350 4.894 11.390 5.890 14 14 "[* **-****1* +.****]" 1
2720 1 66 LYS QE 1 100 ILE MD . . 3.530 4.480 1.930 6.973 3.443 6 14 "[*****+-**1 * ** **]" 1
2721 1 31 LYS QB 1 146 LEU QB . . 4.150 7.422 2.699 10.953 6.803 7 15 "[* -***+* *** ***** ]" 1
2722 1 20 PHE QD 1 130 LEU QB . . 5.010 5.247 3.456 7.181 2.171 18 8 "[ ** .* *-1* *. + ]" 1
2723 1 15 ALA H 1 82 TYR QB . . 5.500 5.716 3.523 7.311 1.811 9 8 "[* - . *+1 ** * *]" 1
2724 1 14 VAL HA 1 33 PRO QG . . 4.450 7.147 3.851 10.515 6.065 4 14 "[* *+*****1*- *.*** ]" 1
2725 1 15 ALA MB 1 16 VAL HB . . 5.350 4.791 4.349 5.232 . 0 0 "[ . 1 . ]" 1
2726 1 33 PRO QD 1 146 LEU QB . . 4.800 4.740 2.965 8.350 3.550 3 4 "[ +*. * 1 . - ]" 1
2727 1 17 ALA MB 1 33 PRO QB . . 4.450 8.629 4.036 11.719 7.269 11 17 "[* ********+* *-****]" 1
2728 1 17 ALA MB 1 33 PRO QG . . 3.430 7.621 3.399 10.087 6.657 11 17 "[* ********+* *****-]" 1
2729 1 66 LYS QE 1 100 ILE MG . . 4.520 6.102 3.846 8.745 4.225 2 14 "[*+-******1 * ** **]" 1
2730 1 33 PRO QD 1 45 MET ME . . 4.670 7.356 4.167 10.465 5.795 11 16 "[* ********+ *****-]" 1
2731 1 33 PRO QB 1 45 MET ME . . 3.340 7.264 2.700 11.624 8.284 11 17 "[* **-*****+* ******]" 1
2732 1 11 PHE HZ 1 60 ILE QG . . 4.940 5.429 4.011 6.602 1.662 10 9 "[*** . * + * *. *- ]" 1
2733 1 66 LYS QE 1 106 PHE HZ . . 5.190 7.108 5.124 8.721 3.531 19 15 "[-********1** ** *+]" 1
2734 1 66 LYS QD 1 106 PHE HZ . . 4.870 6.709 4.906 7.552 2.682 3 18 "[**+******-** ******]" 1
2735 1 20 PHE QE 1 130 LEU HG . . 5.500 5.983 3.855 8.368 2.868 18 9 "[ *- .* **1* *. *+ ]" 1
2736 1 11 PHE QE 1 56 ARG QB . . 4.760 4.968 2.410 5.989 1.229 6 7 "[*- .+ * * *. * ]" 1
2737 1 13 ILE MG 1 41 VAL QG . . 5.000 4.488 3.922 4.886 . 0 0 "[ . 1 . ]" 1
2738 1 13 ILE MD 1 48 ASN QD . . 4.980 5.048 3.973 6.230 1.250 10 7 "[ * ** + *. *- ]" 1
2739 1 14 VAL QG 1 34 GLY QA . . 4.230 5.041 2.513 7.735 3.505 1 11 "[+ **. ***-** .** ]" 1
2740 1 14 VAL QG 1 83 GLU H . . 5.440 5.871 4.495 7.133 1.693 19 8 "[* * .* **1 - * +]" 1
2741 1 16 VAL QG 1 59 LEU H . . 5.340 5.288 4.657 6.268 0.928 15 2 "[ .- 1 + ]" 1
2742 1 25 LEU QD 1 29 ARG QB . . 3.560 3.692 2.247 4.955 1.395 14 7 "[* - * * 1 * +. * ]" 1
2743 1 48 ASN QD 1 139 SER HA . . 5.340 4.713 3.325 7.307 1.967 12 3 "[ *. - 1 + . ]" 1
2744 1 65 ILE HB 1 119 VAL QG . . 4.710 4.573 3.615 5.226 0.516 7 1 "[ . + 1 . ]" 1
2745 1 66 LYS QE 1 118 GLN QE . . 5.120 6.143 4.423 7.484 2.364 15 16 "[*********-** +* **]" 1
2746 1 76 PRO HA 1 79 CYS QB . . 5.290 5.505 4.435 6.866 1.576 15 8 "[ .***-1 * *+ * ]" 1
2747 1 130 LEU HA 1 133 LEU QB . . 4.490 3.526 3.064 4.013 . 0 0 "[ . 1 . ]" 1
2748 1 138 CYS QB 1 151 ALA H . . 5.130 4.956 3.084 5.979 0.849 7 3 "[ - + 1 *. ]" 1
2749 1 35 LYS QB 1 83 GLU H . . 3.110 6.369 1.988 8.795 5.685 1 17 "[+** *-********* ***]" 1
2750 1 114 GLN H 1 116 ILE MD . . 5.390 4.880 4.625 5.057 . 0 0 "[ . 1 . ]" 1
2751 1 100 ILE HB 1 102 ALA H . . 4.130 3.917 3.187 4.368 0.238 6 0 "[ . 1 . ]" 1
2752 1 15 ALA MB 1 36 LYS H . . 5.460 7.043 5.410 9.403 3.943 14 17 "[*** *********+* *-*]" 1
2753 1 77 GLY QA 1 79 CYS QB . . 5.210 5.206 4.612 5.981 0.771 7 3 "[ . +- 1 * ]" 1
2754 1 35 LYS QB 1 82 TYR QB . . 3.850 4.598 1.851 6.400 2.550 1 13 "[+ * * -****** * * *]" 1
2755 1 106 PHE H 1 107 LYS QB . . 4.780 4.831 4.474 5.181 0.401 9 0 "[ . 1 . ]" 1
2756 1 100 ILE H 1 107 LYS QD . . 4.670 6.010 3.255 7.194 2.524 7 14 "[ ****+****-* . ***]" 1
2757 1 51 LYS QB 1 52 ALA MB . . 4.130 3.827 3.674 4.077 . 0 0 "[ . 1 . ]" 1
2758 1 35 LYS QB 1 82 TYR QE . . 5.460 6.418 3.745 7.588 2.128 11 15 "[*** * ***+**** *-*]" 1
2759 1 45 MET ME 1 142 LEU QD . . 2.570 3.314 2.278 4.352 1.782 19 11 "[***-** *1* ** +]" 1
2760 1 76 PRO QG 1 77 GLY H . . 4.990 4.486 4.351 4.671 . 0 0 "[ . 1 . ]" 1
2761 1 109 LEU QB 1 113 GLU QG . . 4.280 3.967 3.160 5.361 1.081 7 2 "[ . + 1 . - ]" 1
2762 1 110 GLU QB 1 113 GLU QG . . 3.870 4.425 2.696 5.439 1.569 10 9 "[ * *- *+ ***. *]" 1
2763 1 125 CYS QB 1 129 CYS QB . . 4.270 3.494 2.996 4.767 0.497 2 0 "[ . 1 . ]" 1
2764 1 146 LEU QD 1 150 CYS QB . . 5.050 5.676 3.624 7.215 2.165 8 11 "[ -** *+ 1** ** ** ]" 1
2765 1 98 VAL H 1 98 VAL HA . . 2.540 2.813 2.277 2.949 0.409 19 0 "[ . 1 . ]" 1
2766 1 31 LYS QG 1 32 LEU H . . 4.830 4.120 3.539 4.577 . 0 0 "[ . 1 . ]" 1
2767 1 12 ASN H 1 60 ILE MD . . 5.500 6.476 4.817 7.648 2.148 15 16 "[*********1* -*+* **]" 1
2768 1 65 ILE QG 1 118 GLN QE . . 5.000 4.951 3.013 5.693 0.693 13 2 "[ .- 1 + . ]" 1
2769 1 75 ILE MD 1 112 MET ME . . 3.770 2.777 2.333 3.364 . 0 0 "[ . 1 . ]" 1
2770 1 119 VAL HA 1 121 LEU QB . . 5.500 4.929 4.793 5.069 . 0 0 "[ . 1 . ]" 1
2771 1 49 ALA MB 1 51 LYS QB . . 5.500 5.314 5.194 5.499 . 0 0 "[ . 1 . ]" 1
2772 1 15 ALA MB 1 32 LEU QD . . 3.960 7.322 3.163 10.472 6.512 18 17 "[ *******-******* +*]" 1
2773 1 15 ALA HA 1 32 LEU QD . . 4.080 7.426 3.241 10.996 6.916 18 17 "[ **********-**** +*]" 1
2774 1 24 ASP HA 1 26 ASP H . . 3.760 3.391 2.989 4.039 0.279 10 0 "[ . 1 . ]" 1
2775 1 13 ILE HA 1 45 MET ME . . 4.770 4.942 4.328 5.895 1.125 4 5 "[ +. - 1 * .* * ]" 1
2776 1 17 ALA HA 1 45 MET ME . . 4.540 4.375 3.791 5.465 0.925 18 1 "[ . 1 . + ]" 1
2777 1 63 SER HA 1 65 ILE MG . . 5.500 5.639 4.418 5.879 0.379 12 0 "[ . 1 . ]" 1
2778 1 33 PRO QD 1 82 TYR QB . . 5.500 6.985 3.586 10.634 5.134 4 12 "[ * +*** 1- **** **]" 1
2779 1 134 ALA MB 1 136 VAL QG . . 5.020 4.282 4.010 4.745 . 0 0 "[ . 1 . ]" 1
2780 1 33 PRO QG 1 81 THR MG . . 5.500 8.222 4.686 12.291 6.791 18 15 "[ ****** -** **** +*]" 1
2781 1 97 ILE MG 1 99 ASP HA . . 4.490 5.087 4.138 6.484 1.994 5 9 "[ ***+ **- * .* ]" 1
2782 1 97 ILE HB 1 99 ASP QB . . 5.500 5.776 3.784 7.363 1.863 5 8 "[ ***+ * ** - . ]" 1
2783 1 78 ARG QB 1 115 PHE QE . . 4.980 4.625 3.780 5.830 0.850 1 1 "[+ . 1 . ]" 1
2784 1 12 ASN QD 1 17 ALA H . . 5.340 6.466 4.859 8.068 2.728 12 11 "[ *** -**1 + *** *]" 1
2785 1 13 ILE HB 1 133 LEU QD . . 4.750 5.067 4.192 5.839 1.089 4 6 "[ +. * ** * . - ]" 1
2786 1 18 SER QB 1 32 LEU QD . . 5.080 5.359 2.367 8.249 3.169 18 7 "[ *.** 1- *.* + ]" 1
2787 1 32 LEU QD 1 81 THR HA . . 5.230 9.306 3.807 14.322 9.092 16 15 "[ ****** **-***+ **]" 1
2788 1 32 LEU QD 1 81 THR HB . . 4.900 9.866 3.844 15.003 10.103 16 16 "[******* **-***+ **]" 1
2789 1 32 LEU QD 1 82 TYR QB . . 5.180 6.454 2.502 9.984 4.804 6 11 "[ * **+* 1 **-* **]" 1
2790 1 32 LEU QD 1 82 TYR QD . . 5.110 7.015 2.590 10.410 5.300 6 14 "[ * **+* -****** **]" 1
2791 1 52 ALA MB 1 135 ASN QD . . 4.890 5.892 4.758 6.570 1.680 8 15 "[**-****+*1* **** * ]" 1
2792 1 71 MET QG 1 78 ARG QB . . 5.340 4.663 2.840 6.060 0.720 11 2 "[ . -+ . ]" 1
2793 1 118 GLN QG 1 119 VAL HA . . 5.340 5.486 3.468 5.783 0.443 11 0 "[ . 1 . ]" 1
2794 1 55 THR H 1 126 THR MG . . 3.660 4.095 2.850 5.262 1.602 9 9 "[ * *. +1** ** - *]" 1
2795 1 50 ARG QB 1 51 LYS HA . . 5.000 4.121 3.746 4.674 . 0 0 "[ . 1 . ]" 1
2796 1 54 CYS HA 1 126 THR MG . . 4.400 3.586 3.000 3.980 . 0 0 "[ . 1 . ]" 1
2797 1 47 ALA MB 1 51 LYS QE . . 5.500 5.482 3.634 6.863 1.363 17 6 "[ . ***1 - * + ]" 1
2798 1 106 PHE QD 1 109 LEU QB . . 4.520 4.116 3.807 4.342 . 0 0 "[ . 1 . ]" 1
2799 1 61 CYS HA 1 64 HIS HD2 . . 5.460 5.654 5.333 5.919 0.459 2 0 "[ . 1 . ]" 1
2800 1 119 VAL QG 1 122 CYS QB . . 4.450 3.832 3.252 4.479 0.029 15 0 "[ . 1 . ]" 1
2801 1 127 THR H 1 130 LEU H . . 5.340 4.871 4.578 5.005 . 0 0 "[ . 1 . ]" 1
2802 1 103 ILE QG 1 107 LYS H . . 5.340 6.584 5.155 7.019 1.679 7 18 "[******+*******-*** ]" 1
2803 1 103 ILE MD 1 107 LYS H . . 5.500 6.140 5.304 6.519 1.019 7 16 "[* ****+******-.*** ]" 1
2804 1 72 LYS H 1 73 LYS HB3 . . 4.790 4.862 4.566 5.161 0.371 9 0 "[ . 1 . ]" 1
2805 1 18 SER H 1 19 ASN HD21 . . 5.500 5.265 3.766 6.015 0.515 18 1 "[ . 1 . + ]" 1
2806 1 19 ASN H 1 19 ASN HD21 . . 4.130 3.343 1.894 3.973 . 0 0 "[ . 1 . ]" 1
2807 1 19 ASN HD21 1 20 PHE H . . 4.550 4.612 2.631 5.359 0.809 2 4 "[ + . - 1 * *. ]" 1
2808 1 103 ILE MD 1 106 PHE H . . 4.410 4.758 3.976 5.195 0.785 16 6 "[ * *** -1 .+ ]" 1
2809 1 39 LEU QB 1 42 LEU H . . 5.340 4.582 4.278 4.833 . 0 0 "[ . 1 . ]" 1
2810 1 103 ILE QG 1 106 PHE QB . . 5.040 3.643 2.266 3.920 . 0 0 "[ . 1 . ]" 1
2811 1 103 ILE MD 1 114 GLN QG . . 5.500 5.350 4.985 5.687 0.187 10 0 "[ . 1 . ]" 1
2812 1 16 VAL HA 1 19 ASN HD22 . . 5.120 3.874 2.150 5.292 0.172 12 0 "[ . 1 . ]" 1
2813 1 70 LYS QG 1 111 PRO QB . . 5.210 5.026 3.028 6.909 1.699 10 7 "[ **.* + -.* * ]" 1
2814 1 38 PRO QG 1 40 GLU HA . . 5.500 5.274 5.234 5.328 . 0 0 "[ . 1 . ]" 1
2815 1 140 ASP HA 1 143 LYS HA . . 5.500 5.707 5.501 6.093 0.593 18 1 "[ . 1 . + ]" 1
2816 1 109 LEU QB 1 117 ALA MB . . 5.120 4.395 4.163 4.699 . 0 0 "[ . 1 . ]" 1
2817 1 33 PRO QD 1 142 LEU HG . . 4.030 8.115 3.689 10.974 6.944 7 16 "[* ****+*-*** ***** ]" 1
2818 1 102 ALA HA 1 103 ILE MG . . 5.330 5.589 4.857 5.754 0.424 13 0 "[ . 1 . ]" 1
2819 1 75 ILE QG 1 115 PHE QB . . 5.500 4.484 4.100 4.764 . 0 0 "[ . 1 . ]" 1
2820 1 33 PRO QD 1 142 LEU HA . . 5.500 7.220 4.703 9.009 3.509 12 15 "[* ****** **+ *-*** ]" 1
2821 1 103 ILE QG 1 106 PHE QD . . 3.680 4.710 3.344 4.964 1.284 18 18 "[***************-*+ ]" 1
2822 1 11 PHE H 1 42 LEU QD . . 4.170 4.372 3.447 5.379 1.209 11 6 "[ -* * *+ * . ]" 1
2823 1 13 ILE QG 1 59 LEU QB . . 5.180 3.654 2.487 5.181 0.001 17 0 "[ . 1 . ]" 1
2824 1 31 LYS QB 1 146 LEU QD . . 3.340 5.854 1.877 8.659 5.319 7 15 "[* ***+* ***-***** ]" 1
2825 1 32 LEU QD 1 138 CYS HA . . 4.930 8.808 3.843 12.306 7.376 10 17 "[* *******+**-***** ]" 1
2826 1 33 PRO QD 1 142 LEU QD . . 4.160 5.467 2.179 7.526 3.366 4 14 "[- *+**** *** *.*** ]" 1
2827 1 34 GLY QA 1 37 LEU QD . . 4.150 3.868 2.841 5.105 0.955 1 3 "[+ * . 1 . - ]" 1
2828 1 39 LEU QB 1 42 LEU QD . . 3.690 3.674 2.684 4.802 1.112 8 4 "[* .- +*1 . ]" 1
2829 1 41 VAL HA 1 42 LEU QD . . 5.440 5.421 4.360 6.042 0.602 12 4 "[ * . * 1 + . - ]" 1
2830 1 62 LEU QD 1 124 ASP H . . 4.390 4.644 3.987 5.322 0.932 16 6 "[- *.** 1 .+ * ]" 1
2831 1 103 ILE MG 1 121 LEU QD . . 3.350 3.749 3.301 3.918 0.568 8 6 "[ .* +*1**- . ]" 1
2832 1 111 PRO QG 1 114 GLN QB . . 5.350 5.294 5.009 5.554 0.204 16 0 "[ . 1 . ]" 1
2833 1 130 LEU QD 1 134 ALA MB . . 5.440 5.740 5.209 6.472 1.032 7 5 "[ *. + * * . - ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 39
_Distance_constraint_stats_list.Viol_count 638
_Distance_constraint_stats_list.Viol_total 31231.477
_Distance_constraint_stats_list.Viol_max 8.279
_Distance_constraint_stats_list.Viol_rms 2.1048
_Distance_constraint_stats_list.Viol_average_all_restraints 2.2183
_Distance_constraint_stats_list.Viol_average_violations_only 2.5764
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 54 CYS 316.156 8.279 6 19 [*****+*********-***]
1 58 CYS 786.013 6.845 19 19 [***************-**+]
1 61 CYS 516.142 7.120 15 19 [**-***********+****]
1 67 CYS 1.076 0.135 15 0 "[ . 1 . ]"
1 79 CYS 1.076 0.135 15 0 "[ . 1 . ]"
1 122 CYS 530.347 7.251 15 19 [**************+-***]
1 125 CYS 878.295 8.279 6 19 [****-+*************]
1 129 CYS 257.513 4.950 2 19 [*+******-**********]
1 138 CYS 0.453 0.074 8 0 "[ . 1 . ]"
1 150 CYS 0.453 0.074 8 0 "[ . 1 . ]"
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 58 CYS CB 1 122 CYS SG . . 3.000 7.710 6.310 8.705 5.705 19 19 [********-*********+] 2
2 1 61 CYS CB 1 122 CYS SG . . 3.000 3.034 2.886 3.136 0.136 2 0 "[ . 1 . ]" 2
3 1 122 CYS SG 1 125 CYS CB . . 3.000 7.440 5.249 9.040 6.040 2 19 [*+***-*************] 2
4 1 122 CYS SG 1 125 CYS SG . . 2.000 7.379 5.177 9.251 7.251 15 19 [*****-********+****] 2
5 1 122 CYS CB 1 125 CYS SG . . 3.000 6.410 4.650 8.189 5.189 19 19 [***************-**+] 2
6 1 125 CYS SG 1 129 CYS CB . . 3.000 5.157 3.083 6.528 3.528 13 17 "[*******-** *+*.****]" 2
7 1 125 CYS SG 1 129 CYS SG . . 2.000 4.592 2.260 6.642 4.642 13 18 [**********-*+*.****] 2
8 1 54 CYS CB 1 125 CYS SG . . 3.000 6.694 3.798 9.101 6.101 13 19 [************+*-****] 2
9 1 58 CYS CB 1 125 CYS SG . . 3.000 4.112 3.024 5.980 2.980 13 11 "[ *.***-1* +*.* **]" 2
10 1 61 CYS CB 1 125 CYS SG . . 3.000 6.858 4.733 8.151 5.151 15 19 [**-***********+****] 2
11 1 125 CYS CB 1 129 CYS SG . . 3.000 4.784 3.796 5.510 2.510 10 19 [*********+****-****] 2
12 1 54 CYS CB 1 129 CYS SG . . 3.000 3.078 2.934 3.598 0.598 6 1 "[ .+ 1 . ]" 2
13 1 58 CYS CB 1 129 CYS SG . . 3.000 4.903 3.541 6.883 3.883 2 19 [*+**-**************] 2
14 1 138 CYS SG 1 150 CYS CB . . 3.000 2.989 2.907 3.021 0.021 15 0 "[ . 1 . ]" 2
15 1 138 CYS SG 1 150 CYS SG . . 2.000 1.999 1.959 2.038 0.038 14 0 "[ . 1 . ]" 2
16 1 138 CYS CB 1 150 CYS SG . . 3.000 3.003 2.942 3.074 0.074 8 0 "[ . 1 . ]" 2
17 1 54 CYS SG 1 125 CYS CB . . 3.000 5.787 3.876 8.579 5.579 6 19 [*-***+*************] 2
18 1 54 CYS SG 1 125 CYS SG . . 2.000 5.493 2.554 10.279 8.279 6 19 [*****+********-****] 2
19 1 54 CYS SG 1 129 CYS CB . . 3.000 3.598 2.996 4.940 1.940 6 12 "[** *.+* -* **** * ]" 2
20 1 54 CYS SG 1 129 CYS SG . . 2.000 2.378 1.983 4.512 2.512 6 4 "[ * *.+ 1- . ]" 2
21 1 54 CYS SG 1 58 CYS CB . . 3.000 4.285 3.307 5.734 2.734 4 16 "[***+*** ** ****-* *]" 2
22 1 54 CYS SG 1 58 CYS SG . . 2.000 4.032 2.862 6.098 4.098 4 19 [***+***-***********] 2
23 1 58 CYS SG 1 122 CYS CB . . 3.000 7.200 4.953 8.554 5.554 19 19 [***********-******+] 2
24 1 58 CYS SG 1 122 CYS SG . . 2.000 7.676 6.431 8.845 6.845 19 19 [***********-******+] 2
25 1 58 CYS SG 1 125 CYS CB . . 3.000 3.143 2.887 4.232 1.232 4 2 "[ +. 1 - ]" 2
26 1 58 CYS SG 1 125 CYS SG . . 2.000 3.048 1.994 6.013 4.013 4 8 "[ +-* 1* * ** * ]" 2
27 1 58 CYS SG 1 129 CYS CB . . 3.000 5.034 3.492 7.950 4.950 2 18 [*+**.************-*] 2
28 1 58 CYS SG 1 129 CYS SG . . 2.000 4.015 2.479 6.252 4.252 2 18 [*+**.************-*] 2
29 1 54 CYS CB 1 58 CYS SG . . 3.000 5.280 4.417 6.731 3.731 12 19 [**********-+*******] 2
30 1 58 CYS SG 1 61 CYS CB . . 3.000 6.262 5.910 6.878 3.878 4 19 [*-*+***************] 2
31 1 58 CYS SG 1 61 CYS SG . . 2.000 7.491 6.870 8.031 6.031 4 19 [***+*******-*******] 2
32 1 61 CYS SG 1 122 CYS CB . . 3.000 3.042 2.982 3.132 0.132 2 0 "[ . 1 . ]" 2
33 1 61 CYS SG 1 122 CYS SG . . 2.000 1.956 1.867 2.019 0.019 18 0 "[ . 1 . ]" 2
34 1 61 CYS SG 1 125 CYS CB . . 3.000 7.661 6.606 9.492 6.492 12 19 [*******-***+*******] 2
35 1 61 CYS SG 1 125 CYS SG . . 2.000 7.641 5.697 9.120 7.120 15 19 [**-***********+****] 2
36 1 58 CYS CB 1 61 CYS SG . . 3.000 7.153 6.718 7.419 4.419 5 19 [****+******-*******] 2
37 1 67 CYS SG 1 79 CYS CB . . 3.000 3.032 2.983 3.098 0.098 13 0 "[ . 1 . ]" 2
38 1 67 CYS SG 1 79 CYS SG . . 2.000 1.980 1.905 2.135 0.135 15 0 "[ . 1 . ]" 2
39 1 67 CYS CB 1 79 CYS SG . . 3.000 3.001 2.938 3.048 0.048 4 0 "[ . 1 . ]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 3
_Distance_constraint_stats_list.Viol_count 13
_Distance_constraint_stats_list.Viol_total 16.923
_Distance_constraint_stats_list.Viol_max 0.156
_Distance_constraint_stats_list.Viol_rms 0.0387
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0156
_Distance_constraint_stats_list.Viol_average_violations_only 0.0685
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 61 CYS 0.477 0.156 6 0 "[ . 1 . ]"
1 67 CYS 0.034 0.034 8 0 "[ . 1 . ]"
1 79 CYS 0.034 0.034 8 0 "[ . 1 . ]"
1 122 CYS 0.477 0.156 6 0 "[ . 1 . ]"
1 138 CYS 0.380 0.154 13 0 "[ . 1 . ]"
1 150 CYS 0.380 0.154 13 0 "[ . 1 . ]"
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 61 CYS CB 1 122 CYS CB . . 4.000 3.928 3.630 4.156 0.156 6 0 "[ . 1 . ]" 3
2 1 67 CYS CB 1 79 CYS CB . . 4.000 3.576 3.159 4.034 0.034 8 0 "[ . 1 . ]" 3
3 1 138 CYS CB 1 150 CYS CB . . 4.000 3.755 3.188 4.154 0.154 13 0 "[ . 1 . ]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 69
_Distance_constraint_stats_list.Viol_count 755
_Distance_constraint_stats_list.Viol_total 27703.154
_Distance_constraint_stats_list.Viol_max 8.170
_Distance_constraint_stats_list.Viol_rms 1.6400
_Distance_constraint_stats_list.Viol_average_all_restraints 1.1122
_Distance_constraint_stats_list.Viol_average_violations_only 1.9312
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 11 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 12 ASN 53.990 2.884 9 18 "[* ******+********-*]"
1 13 ILE 37.287 2.748 9 17 "[* ******+****-* ***]"
1 14 VAL 72.185 5.214 4 17 "[* *+**-***** ******]"
1 16 VAL 10.444 1.318 3 10 "[ +*.* **1* *. -**]"
1 17 ALA 11.582 1.159 11 11 "[ * .* **1+ *-* ***]"
1 18 SER 22.563 2.966 13 14 "[ * ** ** **-+*** **]"
1 20 PHE 36.066 2.179 12 18 "[ **********+****-**]"
1 21 ALA 49.375 3.461 13 16 "[ *-***** ***+*** **]"
1 22 THR 108.088 7.171 13 18 "[ ***********+**-***]"
1 23 THR 24.024 3.363 6 13 "[ * **+** ** **.* *-]"
1 28 ASP 141.797 7.233 10 17 "[** *****-+ ********]"
1 32 LEU 378.104 7.187 12 19 [***********+*******]
1 33 PRO 130.187 5.214 4 19 [***+-**************]
1 35 LYS 44.355 5.754 19 14 "[*- ** ******** * +]"
1 36 LYS 8.695 3.273 14 5 "[ *.* -1 +. *]"
1 37 LEU 25.159 2.697 4 13 "[ +-*** ******* * ]"
1 38 PRO 61.666 4.799 15 18 "[** ***-*******+****]"
1 40 GLU 20.447 2.069 16 15 "[*** ** -*** ***+* *]"
1 42 LEU 14.505 1.472 3 14 "[ +*. *-********* *]"
1 45 MET 71.820 2.884 9 19 [********+**-*******]
1 49 ALA 1.199 0.587 11 1 "[ . 1+ . ]"
1 54 CYS 14.898 1.539 15 13 "[** *. * *-****+ * *]"
1 55 THR 29.489 3.005 9 17 "[**-*.***+******** *]"
1 56 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 58 CYS 2.287 0.591 2 2 "[ + . 1 - . ]"
1 60 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 61 CYS 0.000 0.000 . 0 "[ . 1 . ]"
1 62 LEU 9.750 1.444 12 7 "[ * . * 1-+ *. * *]"
1 65 ILE 9.686 1.367 17 7 "[ ** 1* .-+**]"
1 66 LYS 14.287 1.301 7 15 "[****. +**** **** -*]"
1 68 THR 56.331 5.506 7 17 "[* **- +************]"
1 71 MET 16.790 1.301 7 15 "[****. +**** **** -*]"
1 73 LYS 3.806 0.904 11 2 "[ - . 1+ . ]"
1 74 PHE 6.309 0.904 11 4 "[ -* . * 1+ . ]"
1 75 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 81 THR 29.216 2.714 12 13 "[* **. -****+ *** *]"
1 82 TYR 73.279 5.962 4 19 [***+*******-*******]
1 83 GLU 53.049 5.754 19 15 "[** *** *-****** * +]"
1 96 ALA 28.090 1.795 15 18 "[* *-**********+****]"
1 97 ILE 84.131 5.506 7 18 "[* **-*+************]"
1 100 ILE 0.289 0.289 6 0 "[ . 1 . ]"
1 101 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 107 LYS 2.347 0.336 3 0 "[ . 1 . ]"
1 108 ASP 2.347 0.336 3 0 "[ . 1 . ]"
1 111 PRO 0.000 0.000 . 0 "[ . 1 . ]"
1 113 GLU 0.000 0.000 . 0 "[ . 1 . ]"
1 116 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 117 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 118 GLN 4.634 0.960 6 4 "[ *+ 1 .- * ]"
1 119 VAL 0.363 0.363 17 0 "[ . 1 . ]"
1 120 ASP 0.000 0.000 . 0 "[ . 1 . ]"
1 125 CYS 0.000 0.000 . 0 "[ . 1 . ]"
1 126 THR 46.674 3.005 9 17 "[****.***+**-***** *]"
1 130 LEU 4.335 1.444 12 4 "[ * . * 1 + -. ]"
1 133 LEU 16.269 2.966 13 12 "[ * ** ** *- +*** * ]"
1 134 ALA 80.107 3.520 18 16 "[ *-***** ******* +*]"
1 135 ASN 78.954 7.171 13 18 "[ ***********+***-**]"
1 136 VAL 62.000 3.792 1 16 "[+** .**-*1*********]"
1 137 GLN 21.271 2.135 6 14 "[* * .+***1**-*** **]"
1 142 LEU 83.271 3.792 1 16 "[+** .**-*1*********]"
1 145 TRP 326.755 7.187 12 18 "[** ***-****+*******]"
1 146 LEU 296.907 8.170 4 19 [***+******-********]
1 148 GLN 58.357 3.519 2 15 "[*+ *** ***-***** *]"
1 149 ARG 76.306 8.170 4 14 "[ -*+.******** * * *]"
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 60 ILE QG 1 61 CYS H . . 4.780 4.294 3.997 4.637 . 0 0 "[ . 1 . ]" 4
2 1 11 PHE HB3 1 12 ASN H . . 4.230 3.857 3.822 3.931 . 0 0 "[ . 1 . ]" 4
3 1 56 ARG HA 1 58 CYS H . . 4.430 4.161 3.963 4.403 . 0 0 "[ . 1 . ]" 4
4 1 62 LEU HG 1 65 ILE MD . . 4.580 4.836 4.400 5.947 1.367 17 3 "[ . 1- . + *]" 4
5 1 66 LYS H 1 71 MET ME . . 5.500 6.252 5.560 6.801 1.301 7 15 "[****. +**** **** -*]" 4
6 1 81 THR HB 1 82 TYR QB . . 5.500 4.873 3.933 5.893 0.393 11 0 "[ . 1 . ]" 4
7 1 55 THR H 1 126 THR HB . . 5.500 7.052 5.501 8.505 3.005 9 17 "[**-*.***+******** *]" 4
8 1 54 CYS HA 1 126 THR HB . . 5.080 5.847 4.842 6.619 1.539 15 13 "[** *. * *-****+ * *]" 4
9 1 73 LYS QE 1 74 PHE QD . . 4.210 3.915 2.138 5.114 0.904 11 2 "[ - . 1+ . ]" 4
10 1 58 CYS QB 1 126 THR MG . . 4.970 4.364 3.322 5.561 0.591 2 2 "[ + . 1 - . ]" 4
11 1 73 LYS H 1 74 PHE QB . . 5.340 4.682 4.325 4.973 . 0 0 "[ . 1 . ]" 4
12 1 74 PHE H 1 74 PHE QB . . 3.410 2.330 2.269 2.462 . 0 0 "[ . 1 . ]" 4
13 1 74 PHE QB 1 75 ILE MG . . 4.050 3.053 2.862 3.134 . 0 0 "[ . 1 . ]" 4
14 1 74 PHE QB 1 111 PRO HA . . 5.200 4.813 4.304 5.156 . 0 0 "[ . 1 . ]" 4
15 1 74 PHE QB 1 111 PRO QB . . 4.740 2.461 2.050 2.724 . 0 0 "[ . 1 . ]" 4
16 1 74 PHE QB 1 111 PRO QG . . 4.400 2.342 1.968 2.993 . 0 0 "[ . 1 . ]" 4
17 1 136 VAL HB 1 142 LEU QD . . 3.670 5.444 3.157 7.462 3.792 1 16 "[+** .****1******-**]" 4
18 1 137 GLN H 1 142 LEU QD . . 5.440 6.496 4.881 7.575 2.135 6 14 "[* * .+***1**-*** **]" 4
19 1 146 LEU QB 1 149 ARG HE . . 4.170 7.964 2.631 12.340 8.170 4 14 "[ -*+.******** * * *]" 4
20 1 136 VAL QG 1 142 LEU HG . . 5.500 4.858 2.937 8.028 2.528 13 2 "[ . 1 + . - ]" 4
21 1 40 GLU QG 1 146 LEU QD . . 5.500 6.547 5.134 7.569 2.069 16 15 "[*** ** -*** ***+* *]" 4
22 1 35 LYS QB 1 83 GLU HA . . 3.460 5.742 2.784 9.214 5.754 19 14 "[*- ** ******** * +]" 4
23 1 45 MET ME 1 82 TYR QE . . 5.500 6.626 5.353 7.936 2.436 11 16 "[* * ** ***+-*******]" 4
24 1 136 VAL HA 1 142 LEU QD . . 5.440 6.624 4.946 8.158 2.718 7 15 "[* * .*+-*1*********]" 4
25 1 113 GLU H 1 116 ILE H . . 5.500 5.031 4.926 5.116 . 0 0 "[ . 1 . ]" 4
26 1 65 ILE MD 1 118 GLN QE . . 4.730 4.730 3.659 5.690 0.960 6 4 "[ *+ 1 .- * ]" 4
27 1 32 LEU QB 1 145 TRP HZ3 . . 5.500 9.076 4.482 11.803 6.303 12 18 "[** ***-****+*******]" 4
28 1 100 ILE MG 1 101 PRO HG3 . . 4.590 4.212 4.012 4.428 . 0 0 "[ . 1 . ]" 4
29 1 21 ALA H 1 23 THR MG . . 5.500 6.754 5.352 8.863 3.363 6 13 "[ * **+** ** **.* *-]" 4
30 1 33 PRO QD 1 38 PRO QD . . 3.980 7.200 3.496 8.779 4.799 15 18 "[** ***-*******+****]" 4
31 1 28 ASP H 1 146 LEU QD . . 5.440 8.600 4.297 11.228 5.788 5 17 "[** *+***** *****-**]" 4
32 1 28 ASP QB 1 146 LEU QD . . 3.840 7.974 2.388 11.073 7.233 10 16 "[** *****-+ ***** **]" 4
33 1 32 LEU QD 1 145 TRP HE3 . . 3.110 7.312 2.879 9.484 6.374 12 18 "[** -*******+*******]" 4
34 1 32 LEU QD 1 145 TRP HZ3 . . 3.840 8.503 3.459 10.976 7.136 12 18 "[** *****-**+*******]" 4
35 1 32 LEU QD 1 145 TRP HH2 . . 5.440 10.072 4.695 12.627 7.187 12 18 "[** *****-**+*******]" 4
36 1 33 PRO QD 1 37 LEU HG . . 5.000 5.865 2.461 7.697 2.697 4 13 "[ +**** *-***** * ]" 4
37 1 33 PRO QD 1 37 LEU QD . . 4.000 4.147 2.378 4.787 0.787 15 5 "[ *- 1 ** + ]" 4
38 1 62 LEU HG 1 130 LEU QD . . 5.440 5.290 4.148 6.884 1.444 12 4 "[ * . * 1 + -. ]" 4
39 1 68 THR MG 1 100 ILE QG . . 5.340 4.695 4.272 5.629 0.289 6 0 "[ . 1 . ]" 4
40 1 146 LEU QB 1 148 GLN QG . . 4.670 4.840 2.779 7.373 2.703 13 10 "[** ** ***- + .* ]" 4
41 1 146 LEU QD 1 148 GLN QG . . 4.450 5.328 3.326 7.543 3.093 13 13 "[** ** *****+*-* ]" 4
42 1 146 LEU QD 1 148 GLN QE . . 4.530 5.658 2.702 8.049 3.519 2 13 "[*+ *** -****** *]" 4
43 1 18 SER H 1 133 LEU QB . . 5.500 6.284 5.377 8.466 2.966 13 11 "[ * ** ** * +*-* * ]" 4
44 1 13 ILE HA 1 17 ALA H . . 4.040 3.793 3.246 4.195 0.155 8 0 "[ . 1 . ]" 4
45 1 22 THR H 1 135 ASN H . . 5.500 9.655 5.546 12.671 7.171 13 18 "[ ***********+***-**]" 4
46 1 20 PHE HA 1 134 ALA MB . . 4.490 5.807 3.887 6.669 2.179 12 16 "[ *-***** **+**** **]" 4
47 1 22 THR H 1 134 ALA MB . . 4.160 5.447 2.155 7.680 3.520 18 15 "[ ******* *****.- +*]" 4
48 1 18 SER HA 1 45 MET ME . . 4.720 4.954 4.082 5.821 1.101 2 8 "[ + . * 1*-*** *]" 4
49 1 21 ALA H 1 134 ALA HA . . 4.810 5.986 3.048 8.271 3.461 13 15 "[ *-***** ***+** **]" 4
50 1 32 LEU QB 1 82 TYR QD . . 5.050 7.698 4.456 11.012 5.962 4 15 "[ **+*** **-**** **]" 4
51 1 36 LYS QG 1 83 GLU QB . . 3.920 3.812 2.061 7.193 3.273 14 5 "[ *.* -1 +. *]" 4
52 1 71 MET QG 1 74 PHE HB2 . . 5.340 5.119 4.119 6.028 0.688 7 2 "[ - . + 1 . ]" 4
53 1 117 ALA MB 1 120 ASP QB . . 5.070 4.211 3.779 4.452 . 0 0 "[ . 1 . ]" 4
54 1 12 ASN QD 1 13 ILE HB . . 5.080 6.385 4.167 7.828 2.748 9 17 "[* ******+****** *-*]" 4
55 1 68 THR HB 1 97 ILE MD . . 4.670 7.570 3.721 10.176 5.506 7 17 "[* **- +************]" 4
56 1 14 VAL HB 1 33 PRO QB . . 4.500 6.732 3.782 9.714 5.214 4 13 "[* *+-****1* *.*** ]" 4
57 1 13 ILE MG 1 17 ALA HA . . 5.500 6.065 5.292 6.659 1.159 11 11 "[ * .* **1+ *-* ***]" 4
58 1 107 LYS QB 1 108 ASP HA . . 4.500 4.606 4.369 4.836 0.336 3 0 "[ . 1 . ]" 4
59 1 96 ALA HA 1 97 ILE MG . . 3.900 5.365 3.643 5.695 1.795 15 18 "[* *-**********+****]" 4
60 1 12 ASN QD 1 45 MET ME . . 5.500 6.944 4.652 8.384 2.884 9 15 "[ *** *+*******-**]" 4
61 1 14 VAL QG 1 81 THR HA . . 5.440 6.138 4.767 8.154 2.714 12 10 "[* **. *-1 + *** *]" 4
62 1 14 VAL QG 1 81 THR HB . . 5.440 6.022 4.183 7.541 2.101 12 11 "[* **. -* **+ ** *]" 4
63 1 16 VAL QG 1 20 PHE HA . . 5.330 5.804 4.845 6.648 1.318 3 10 "[ +*.* **1* *. -**]" 4
64 1 42 LEU QD 1 45 MET ME . . 3.850 4.596 3.643 5.322 1.472 3 14 "[ +*. *-********* *]" 4
65 1 49 ALA MB 1 133 LEU QB . . 4.530 4.246 3.392 5.117 0.587 11 1 "[ . 1+ . ]" 4
66 1 55 THR MG 1 58 CYS QB . . 5.340 4.392 3.909 5.199 . 0 0 "[ . 1 . ]" 4
67 1 62 LEU QB 1 119 VAL QG . . 3.870 3.450 2.682 4.233 0.363 17 0 "[ . 1 . ]" 4
68 1 125 CYS QB 1 126 THR MG . . 5.340 4.504 4.344 4.794 . 0 0 "[ . 1 . ]" 4
69 1 133 LEU QB 1 136 VAL QG . . 4.910 3.704 3.256 4.244 . 0 0 "[ . 1 . ]" 4
stop_
save_
save_distance_constraint_statistics_5
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 5
_Distance_constraint_stats_list.Constraint_count 88
_Distance_constraint_stats_list.Viol_count 1661
_Distance_constraint_stats_list.Viol_total 16011.914
_Distance_constraint_stats_list.Viol_max 0.964
_Distance_constraint_stats_list.Viol_rms 0.2304
_Distance_constraint_stats_list.Viol_average_all_restraints 0.5040
_Distance_constraint_stats_list.Viol_average_violations_only 0.5074
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 15 ALA 36.868 0.781 17 15 "[* **.* *** *****+**]"
1 19 ASN 36.868 0.781 17 15 "[* **.* *** *****+**]"
1 38 PRO 26.076 0.601 18 8 "[* **.** * *. + ]"
1 41 VAL 26.076 0.601 18 8 "[* **.** * *. + ]"
1 42 LEU 27.530 0.816 6 8 "[ * *+* * *.* * ]"
1 43 LYS 28.863 0.594 16 7 "[ ** .- * 1 *+* ]"
1 46 GLU 27.530 0.816 6 8 "[ * *+* * *.* * ]"
1 47 ALA 28.863 0.594 16 7 "[ ** .- * 1 *+* ]"
1 53 GLY 9.858 0.560 7 17 "[****. +-***********]"
1 56 ARG 39.398 0.786 19 17 "[** **-***** ******+]"
1 57 GLY 28.038 0.662 11 8 "[-* *. 1+* *** ]"
1 58 CYS 50.261 0.903 15 19 [**-***********+****]
1 59 LEU 24.003 0.691 6 3 "[ *.+ 1* . ]"
1 60 ILE 39.398 0.786 19 17 "[** **-***** ******+]"
1 61 CYS 28.038 0.662 11 8 "[-* *. 1+* *** ]"
1 62 LEU 50.261 0.903 15 19 [**-***********+****]
1 63 SER 24.003 0.691 6 3 "[ *.+ 1* . ]"
1 68 THR 18.363 0.712 6 18 [*-***+***1*********]
1 71 MET 25.903 0.712 6 10 "[ -***+* *1* *. *]"
1 75 ILE 17.103 0.623 7 2 "[ - . + 1 . ]"
1 100 ILE 30.607 0.789 6 19 [*****+********-****]
1 103 ILE 30.607 0.789 6 19 [*****+********-****]
1 105 ARG 33.505 0.918 7 18 "[****-*+**** *******]"
1 109 LEU 33.505 0.918 7 18 "[****-*+**** *******]"
1 111 PRO 58.728 0.942 6 19 [*****+************-]
1 112 MET 59.314 0.927 7 19 [******+********-***]
1 113 GLU 16.623 0.453 8 0 "[ . 1 . ]"
1 114 GLN 62.689 0.924 1 19 [+***************-**]
1 115 PHE 108.757 0.942 6 19 [*****+*****-*******]
1 116 ILE 91.585 0.927 7 19 [******+********-***]
1 117 ALA 61.827 0.964 8 19 [*******+******-****]
1 118 GLN 110.686 0.957 6 19 [*****+*-***********]
1 119 VAL 50.030 0.877 8 19 [*******+***-*******]
1 120 ASP 32.271 0.744 13 13 "[ * **** ** +**-** ]"
1 121 LEU 45.204 0.964 8 19 [*******+******-****]
1 122 CYS 57.560 0.957 6 19 [*****+******-******]
1 126 THR 59.207 0.875 16 19 [*******-*******+***]
1 127 THR 50.058 0.837 18 19 [**************-**+*]
1 129 CYS 10.798 0.658 9 19 [****-***+**********]
1 130 LEU 38.551 0.875 16 14 "[ ******* ** -+***]"
1 131 LYS 50.058 0.837 18 19 [**************-**+*]
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 53 GLY O 1 126 THR HG1 . . 1.700 2.219 2.154 2.260 0.560 7 17 "[****. +-***********]" 5
2 1 126 THR OG1 1 129 CYS H . . 1.700 2.268 2.213 2.358 0.658 9 19 [****-***+**********] 5
3 1 68 THR HG1 1 114 GLN OE1 . . 1.700 2.203 1.846 2.334 0.634 11 15 "[****. ***1+*****-* ]" 5
4 1 68 THR OG1 1 71 MET H . . 1.700 2.163 1.919 2.412 0.712 6 9 "[ - **+* *1* *. *]" 5
5 1 15 ALA O 1 19 ASN H . . 1.700 2.114 1.789 2.252 0.552 14 10 "[ **.* *** *+- * ]" 5
6 1 15 ALA C 1 19 ASN H . . 2.600 3.209 2.901 3.381 0.781 17 15 "[* **.* *** *****+-*]" 5
7 1 15 ALA O 1 19 ASN N . . 2.600 2.985 2.732 3.151 0.551 8 4 "[ . + 1 ** - ]" 5
8 1 15 ALA C 1 19 ASN N . . 3.600 4.132 3.805 4.319 0.719 8 13 "[* **.* +** ****-* ]" 5
9 1 38 PRO O 1 41 VAL H . . 1.700 2.148 1.943 2.301 0.601 18 8 "[- **.** * *. + ]" 5
10 1 38 PRO C 1 41 VAL H . . 2.600 2.960 2.698 3.112 0.512 7 2 "[ . + 1 . - ]" 5
11 1 38 PRO O 1 41 VAL N . . 2.600 2.932 2.712 3.067 0.467 1 0 "[ . 1 . ]" 5
12 1 38 PRO C 1 41 VAL N . . 3.600 3.832 3.587 3.949 0.349 7 0 "[ . 1 . ]" 5
13 1 42 LEU O 1 46 GLU H . . 1.700 1.912 1.760 2.224 0.524 10 2 "[ .- + . ]" 5
14 1 42 LEU C 1 46 GLU H . . 2.600 3.096 2.927 3.416 0.816 6 8 "[ * *+* * -.* * ]" 5
15 1 42 LEU O 1 46 GLU N . . 2.600 2.873 2.722 3.190 0.590 10 2 "[ .- + . ]" 5
16 1 42 LEU C 1 46 GLU N . . 3.600 4.067 3.904 4.385 0.785 6 7 "[ - *+* * .* * ]" 5
17 1 43 LYS O 1 47 ALA H . . 1.700 2.119 1.881 2.233 0.533 16 7 "[ ** .- * 1 *+* ]" 5
18 1 43 LYS C 1 47 ALA H . . 2.600 3.029 2.879 3.194 0.594 16 3 "[ .- * 1 .+ ]" 5
19 1 43 LYS O 1 47 ALA N . . 2.600 2.930 2.741 3.109 0.509 16 1 "[ . 1 .+ ]" 5
20 1 43 LYS C 1 47 ALA N . . 3.600 3.941 3.811 4.143 0.543 16 1 "[ . 1 .+ ]" 5
21 1 56 ARG O 1 60 ILE H . . 1.700 2.084 1.870 2.224 0.524 19 4 "[ .- 1 * .* +]" 5
22 1 56 ARG C 1 60 ILE H . . 2.600 3.256 3.078 3.386 0.786 19 17 "[** -******* ******+]" 5
23 1 56 ARG O 1 60 ILE N . . 2.600 3.022 2.826 3.175 0.575 19 5 "[ ** -1 .* +]" 5
24 1 56 ARG C 1 60 ILE N . . 3.600 4.212 4.044 4.343 0.743 16 17 "[** ******-* ***+***]" 5
25 1 57 GLY O 1 61 CYS H . . 1.700 2.071 1.805 2.249 0.549 2 6 "[-+ *. 1 * ** ]" 5
26 1 57 GLY C 1 61 CYS H . . 2.600 3.073 2.931 3.262 0.662 11 6 "[-* . 1+ *** ]" 5
27 1 57 GLY O 1 61 CYS N . . 2.600 2.874 2.724 3.073 0.473 11 0 "[ . 1 . ]" 5
28 1 57 GLY C 1 61 CYS N . . 3.600 3.958 3.828 4.193 0.593 11 1 "[ . 1+ . ]" 5
29 1 58 CYS O 1 62 LEU H . . 1.700 2.230 1.977 2.311 0.611 15 16 "[* -***** ** **+****]" 5
30 1 58 CYS C 1 62 LEU H . . 2.600 3.400 3.200 3.503 0.903 15 19 [***********-**+****] 5
31 1 58 CYS O 1 62 LEU N . . 2.600 3.162 2.938 3.247 0.647 15 17 "[* ******-** **+****]" 5
32 1 58 CYS C 1 62 LEU N . . 3.600 4.354 4.162 4.453 0.853 15 19 [***********-**+****] 5
33 1 59 LEU O 1 63 SER H . . 1.700 1.937 1.801 2.207 0.507 6 1 "[ .+ 1 . ]" 5
34 1 59 LEU C 1 63 SER H . . 2.600 3.046 2.963 3.291 0.691 6 3 "[ *.+ 1- . ]" 5
35 1 59 LEU O 1 63 SER N . . 2.600 2.805 2.711 3.091 0.491 6 0 "[ . 1 . ]" 5
36 1 59 LEU C 1 63 SER N . . 3.600 3.974 3.902 4.233 0.633 6 2 "[ -.+ 1 . ]" 5
37 1 71 MET O 1 75 ILE H . . 1.700 1.800 1.684 2.108 0.408 7 0 "[ . 1 . ]" 5
38 1 71 MET C 1 75 ILE H . . 2.600 2.976 2.858 3.223 0.623 7 2 "[ - . + 1 . ]" 5
39 1 71 MET O 1 75 ILE N . . 2.600 2.717 2.575 3.070 0.470 7 0 "[ . 1 . ]" 5
40 1 71 MET C 1 75 ILE N . . 3.600 3.906 3.761 4.192 0.592 7 2 "[ - . + 1 . ]" 5
41 1 100 ILE O 1 103 ILE H . . 1.700 2.402 2.341 2.489 0.789 6 19 [*****+********-****] 5
42 1 100 ILE C 1 103 ILE H . . 2.600 2.741 2.704 2.894 0.294 19 0 "[ . 1 . ]" 5
43 1 100 ILE O 1 103 ILE N . . 2.600 3.262 3.220 3.314 0.714 6 19 [*****+********-****] 5
44 1 100 ILE C 1 103 ILE N . . 3.600 3.706 3.676 3.856 0.256 19 0 "[ . 1 . ]" 5
45 1 105 ARG O 1 109 LEU H . . 1.700 2.310 1.907 2.435 0.735 7 16 "[****- +**** *** ***]" 5
46 1 105 ARG C 1 109 LEU H . . 2.600 3.387 3.018 3.518 0.918 7 18 "[*****-+**** *******]" 5
47 1 105 ARG O 1 109 LEU N . . 2.600 2.685 2.526 3.024 0.424 3 0 "[ . 1 . ]" 5
48 1 105 ARG C 1 109 LEU N . . 3.600 3.870 3.735 4.162 0.562 3 2 "[ + - 1 . ]" 5
49 1 111 PRO O 1 115 PHE H . . 1.700 2.365 2.244 2.423 0.723 11 19 [**********+*******-] 5
50 1 111 PRO C 1 115 PHE H . . 2.600 3.475 3.377 3.542 0.942 6 19 [*****+************-] 5
51 1 111 PRO O 1 115 PHE N . . 2.600 3.319 3.201 3.391 0.791 11 19 [**********+*******-] 5
52 1 111 PRO C 1 115 PHE N . . 3.600 4.432 4.328 4.500 0.900 11 19 [**********+*******-] 5
53 1 112 MET O 1 116 ILE H . . 1.700 2.364 2.218 2.436 0.736 7 19 [******+********-***] 5
54 1 112 MET C 1 116 ILE H . . 2.600 3.475 3.393 3.527 0.927 7 19 [******+********-***] 5
55 1 112 MET O 1 116 ILE N . . 2.600 3.332 3.188 3.403 0.803 7 19 [******+********-***] 5
56 1 112 MET C 1 116 ILE N . . 3.600 4.451 4.371 4.507 0.907 7 19 [******+********-***] 5
57 1 113 GLU O 1 117 ALA H . . 1.700 1.842 1.772 1.936 0.236 1 0 "[ . 1 . ]" 5
58 1 113 GLU C 1 117 ALA H . . 2.600 2.950 2.866 3.053 0.453 8 0 "[ . 1 . ]" 5
59 1 113 GLU O 1 117 ALA N . . 2.600 2.707 2.643 2.808 0.208 8 0 "[ . 1 . ]" 5
60 1 113 GLU C 1 117 ALA N . . 3.600 3.875 3.800 3.997 0.397 8 0 "[ . 1 . ]" 5
61 1 114 GLN O 1 118 GLN H . . 1.700 2.266 2.056 2.373 0.673 19 16 "[******* **-***.* *+]" 5
62 1 114 GLN C 1 118 GLN H . . 2.600 3.429 3.204 3.524 0.924 1 19 [+*************-****] 5
63 1 114 GLN O 1 118 GLN N . . 2.600 3.219 2.987 3.323 0.723 19 18 [*******-******.***+] 5
64 1 114 GLN C 1 118 GLN N . . 3.600 4.381 4.154 4.464 0.864 1 19 [+*************-****] 5
65 1 115 PHE O 1 119 VAL H . . 1.700 2.231 1.974 2.345 0.645 8 13 "[ *****+*1 -**.* **]" 5
66 1 115 PHE C 1 119 VAL H . . 2.600 3.366 3.155 3.477 0.877 8 19 [*******+*-*********] 5
67 1 115 PHE O 1 119 VAL N . . 2.600 3.197 2.945 3.303 0.703 8 16 "[*******+*1-***.* **]" 5
68 1 115 PHE C 1 119 VAL N . . 3.600 4.339 4.131 4.453 0.853 8 19 [*******+*-*********] 5
69 1 116 ILE O 1 120 ASP H . . 1.700 2.058 1.812 2.243 0.543 8 4 "[ . + 1 * * - ]" 5
70 1 116 ILE C 1 120 ASP H . . 2.600 3.147 2.937 3.344 0.744 13 13 "[ * **** ** +**-** ]" 5
71 1 116 ILE O 1 120 ASP N . . 2.600 2.925 2.699 3.093 0.493 13 0 "[ . 1 . ]" 5
72 1 116 ILE C 1 120 ASP N . . 3.600 4.068 3.860 4.264 0.664 13 8 "[ * .*** 1* +*- ]" 5
73 1 117 ALA O 1 121 LEU H . . 1.700 2.231 2.114 2.399 0.699 8 16 "[-**** *+**** *.****]" 5
74 1 117 ALA C 1 121 LEU H . . 2.600 3.300 3.102 3.564 0.964 8 19 [*******+******-****] 5
75 1 117 ALA O 1 121 LEU N . . 2.600 3.111 2.920 3.302 0.702 8 11 "[ *** *+*** .* -*]" 5
76 1 117 ALA C 1 121 LEU N . . 3.600 4.237 4.005 4.494 0.894 8 18 [-******+******.****] 5
77 1 118 GLN O 1 122 CYS H . . 1.700 2.324 2.255 2.379 0.679 2 19 [*+**********-******] 5
78 1 118 GLN C 1 122 CYS H . . 2.600 3.502 3.433 3.557 0.957 6 19 [*****+******-******] 5
79 1 118 GLN O 1 122 CYS N . . 2.600 3.255 3.175 3.317 0.717 6 19 [*****+*****-*******] 5
80 1 118 GLN C 1 122 CYS N . . 3.600 4.448 4.374 4.507 0.907 6 19 [*****+*****-*******] 5
81 1 126 THR O 1 130 LEU H . . 1.700 2.084 1.790 2.368 0.668 16 6 "[ .* - ** .+ * ]" 5
82 1 126 THR C 1 130 LEU H . . 2.600 3.244 3.000 3.475 0.875 16 14 "[ ******* ** -+***]" 5
83 1 126 THR O 1 130 LEU N . . 2.600 3.006 2.744 3.234 0.634 16 6 "[ .* 1 ** .+*- ]" 5
84 1 126 THR C 1 130 LEU N . . 3.600 4.194 3.908 4.395 0.795 16 14 "[ ******* ** -+***]" 5
85 1 127 THR O 1 131 LYS H . . 1.700 2.224 2.107 2.272 0.572 2 18 "[*+****** *****-****]" 5
86 1 127 THR C 1 131 LYS H . . 2.600 3.377 3.278 3.437 0.837 18 19 [********-********+*] 5
87 1 127 THR O 1 131 LYS N . . 2.600 3.185 3.061 3.224 0.624 18 18 "[******** ********+-]" 5
88 1 127 THR C 1 131 LYS N . . 3.600 4.348 4.246 4.407 0.807 18 19 [********-********+*] 5
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