NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
589603 |
2n1m   |
25567 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n1m
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 1616
_Distance_constraint_stats_list.Viol_count 4005
_Distance_constraint_stats_list.Viol_total 14207.127
_Distance_constraint_stats_list.Viol_max 1.794
_Distance_constraint_stats_list.Viol_rms 0.1128
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0220
_Distance_constraint_stats_list.Viol_average_violations_only 0.1774
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 MET 1.325 0.100 4 0 "[ . 1 . 2]"
1 3 ALA 7.258 1.212 18 3 "[ *. 1 . + -]"
1 4 LYS 27.824 1.495 18 13 "[* -** ***1 * *** +*2]"
1 5 LYS 14.467 1.212 18 11 "[****. * * *- . +**]"
1 6 THR 5.218 0.656 2 3 "[ + . 1 - . *2]"
1 7 LEU 2.352 0.217 14 0 "[ . 1 . 2]"
1 8 ILE 6.533 0.326 6 0 "[ . 1 . 2]"
1 9 LEU 1.882 0.102 12 0 "[ . 1 . 2]"
1 10 TYR 10.175 1.024 5 6 "[ * +* 1 * . -* 2]"
1 11 TYR 8.798 0.852 18 2 "[ * . 1 . + 2]"
1 15 GLY 0.348 0.080 6 0 "[ . 1 . 2]"
1 17 THR 4.542 0.124 20 0 "[ . 1 . 2]"
1 18 LYS 4.553 1.103 2 2 "[-+ . 1 . 2]"
1 19 LYS 12.481 1.389 18 8 "[ * 1*-* .* +**]"
1 20 MET 28.681 1.389 18 15 "[* ** ********-*+ *]"
1 21 ALA 6.224 1.024 5 5 "[ * +- 1 * . * 2]"
1 22 GLU 8.089 1.103 2 3 "[*+- . 1 . 2]"
1 23 LYS 19.495 1.174 1 11 "[+ ** ***** *- *]"
1 24 ILE 6.048 0.751 8 2 "[ - + 1 . 2]"
1 25 ASN 1.633 0.124 11 0 "[ . 1 . 2]"
1 26 SER 1.320 0.098 6 0 "[ . 1 . 2]"
1 27 GLU 6.069 0.599 3 3 "[- + . 1 * . 2]"
1 28 ILE 29.141 0.801 8 20 [*****-*+************]
1 29 LYS 22.190 1.131 4 20 [***+***********-****]
1 30 ASP 2.219 0.692 4 2 "[ +. 1 .- 2]"
1 31 SER 8.941 1.131 4 2 "[ +. 1 .- 2]"
1 32 GLU 6.550 0.312 5 0 "[ . 1 . 2]"
1 33 LEU 4.409 0.148 7 0 "[ . 1 . 2]"
1 34 LYS 5.745 1.149 19 2 "[ - . 1 . +2]"
1 35 GLU 0.320 0.078 12 0 "[ . 1 . 2]"
1 36 VAL 11.485 0.634 9 7 "[ **** +1 -. *2]"
1 37 LYS 6.894 0.634 9 7 "[ **** +1 -. *2]"
1 38 VAL 3.759 0.127 16 0 "[ . 1 . 2]"
1 39 SER 10.471 0.946 15 3 "[* - 1 + 2]"
1 40 GLU 0.161 0.062 9 0 "[ . 1 . 2]"
1 41 GLY 0.161 0.062 9 0 "[ . 1 . 2]"
1 48 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 LYS 1.349 0.088 10 0 "[ . 1 . 2]"
1 50 THR 3.156 0.107 20 0 "[ . 1 . 2]"
1 54 ALA 0.683 0.099 2 0 "[ . 1 . 2]"
1 55 LEU 2.804 0.098 8 0 "[ . 1 . 2]"
1 58 ILE 5.162 0.223 17 0 "[ . 1 . 2]"
1 59 GLN 2.533 0.317 9 0 "[ . 1 . 2]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ASN 2.431 0.106 17 0 "[ . 1 . 2]"
1 64 PHE 3.091 0.102 1 0 "[ . 1 . 2]"
1 65 PRO 3.267 0.463 14 0 "[ . 1 . 2]"
1 66 GLU 11.094 0.717 4 5 "[ *+. *1 *- 2]"
1 67 ILE 25.744 1.074 20 20 [***************-***+]
1 68 GLN 26.498 1.064 13 20 [****-*******+*******]
1 69 LEU 35.368 1.570 8 18 "[****-**+***** *** **]"
1 70 ASP 24.367 1.570 8 18 "[**-****+***** *** **]"
1 71 ASN 2.460 0.138 16 0 "[ . 1 . 2]"
1 72 ILE 21.727 1.149 19 14 "[* **-***** ** * +*]"
1 73 ASP 0.973 0.094 7 0 "[ . 1 . 2]"
1 74 TYR 19.919 1.330 4 7 "[* +. **1 -*. *2]"
1 75 ASN 5.217 0.484 6 0 "[ . 1 . 2]"
1 76 ASN 4.054 0.545 1 6 "[+* . *1* . -* 2]"
1 77 TYR 14.087 0.970 7 6 "[* * . + * * . -]"
1 78 ASP 4.195 1.495 18 4 "[ - . * 1 . +*2]"
1 79 LEU 8.641 1.249 14 7 "[* * . ** 1 +. *-2]"
1 80 ILE 13.871 0.498 6 0 "[ . 1 . 2]"
1 81 LEU 1.720 0.091 2 0 "[ . 1 . 2]"
1 82 ILE 16.451 1.292 13 10 "[ *** ** + - * **]"
1 83 GLY 4.904 0.559 17 1 "[ . 1 . + 2]"
1 84 SER 7.004 1.264 18 4 "[ . *1- * . + 2]"
1 85 PRO 0.515 0.090 16 0 "[ . 1 . 2]"
1 86 VAL 14.043 0.831 11 11 "[* **-* *+***.* 2]"
1 87 TRP 5.340 0.116 3 0 "[ . 1 . 2]"
1 88 SER 3.571 0.095 8 0 "[ . 1 . 2]"
1 89 GLY 2.223 0.106 16 0 "[ . 1 . 2]"
1 90 TYR 6.731 1.474 17 1 "[ . 1 . + 2]"
1 91 PRO 1.576 0.241 6 0 "[ . 1 . 2]"
1 92 ALA 31.311 1.102 13 20 [************+**-****]
1 93 THR 2.019 0.102 1 0 "[ . 1 . 2]"
1 94 PRO 38.572 1.403 16 20 [***************+****]
1 95 ILE 50.655 1.403 16 20 [***************+**-*]
1 96 LYS 26.701 1.179 3 19 "[**+************** -*]"
1 97 THR 37.353 1.794 15 20 [**************+****-]
1 98 LEU 41.613 1.545 3 20 [**+****************-]
1 99 LEU 91.757 1.794 15 20 [***********-**+*****]
1 100 ASP 4.034 0.989 12 3 "[ . * 1 + . - 2]"
1 101 GLN 11.232 0.367 6 0 "[ . 1 . 2]"
1 102 MET 14.849 1.330 4 7 "[* +. **1 -*. *2]"
1 103 LYS 12.835 0.989 12 8 "[ *.*** * + *. - 2]"
1 104 ASN 6.617 0.429 18 0 "[ . 1 . 2]"
1 105 TYR 2.079 0.108 9 0 "[ . 1 . 2]"
1 106 ARG 7.767 0.592 10 4 "[ . * + * . - 2]"
1 107 GLY 0.218 0.074 19 0 "[ . 1 . 2]"
1 108 GLU 9.652 1.035 9 2 "[- . +1 . 2]"
1 109 VAL 2.734 0.119 20 0 "[ . 1 . 2]"
1 110 ALA 1.210 0.112 16 0 "[ . 1 . 2]"
1 111 SER 14.673 1.292 13 10 "[ *** ** + - * **]"
1 112 PHE 1.912 0.123 19 0 "[ . 1 . 2]"
1 113 PHE 10.644 1.010 18 8 "[***-. ** 1 . *+ 2]"
1 114 THR 2.102 0.123 19 0 "[ . 1 . 2]"
1 115 SER 20.154 1.010 18 16 "[***-**** *****.**+ 2]"
1 116 ALA 0.957 0.180 11 0 "[ . 1 . 2]"
1 117 GLY 0.768 0.111 11 0 "[ . 1 . 2]"
1 118 THR 0.695 0.111 11 0 "[ . 1 . 2]"
1 119 ASN 4.629 0.104 9 0 "[ . 1 . 2]"
1 120 HIS 1.571 0.098 2 0 "[ . 1 . 2]"
1 121 LYS 3.077 1.139 6 2 "[ -+ 1 . 2]"
1 122 ALA 6.370 1.139 6 2 "[ -+ 1 . 2]"
1 123 TYR 8.930 1.264 18 4 "[ . *1- * . + 2]"
1 124 VAL 5.602 0.152 4 0 "[ . 1 . 2]"
1 125 SER 3.715 0.103 15 0 "[ . 1 . 2]"
1 126 HIS 4.552 1.474 17 1 "[ . 1 . + 2]"
1 127 PHE 4.403 0.137 2 0 "[ . 1 . 2]"
1 128 ASN 3.386 0.152 4 0 "[ . 1 . 2]"
1 129 GLU 5.826 0.316 3 0 "[ . 1 . 2]"
1 130 TRP 6.535 0.316 3 0 "[ . 1 . 2]"
1 131 ALA 3.040 0.099 17 0 "[ . 1 . 2]"
1 132 ASP 7.200 0.456 12 0 "[ . 1 . 2]"
1 133 GLY 7.706 0.456 12 0 "[ . 1 . 2]"
1 134 LEU 4.200 0.419 8 0 "[ . 1 . 2]"
1 135 ASN 4.598 0.633 1 1 "[+ . 1 . 2]"
1 136 VAL 2.257 0.086 4 0 "[ . 1 . 2]"
1 137 ILE 9.621 1.035 9 1 "[ . +1 . 2]"
1 138 GLY 1.653 0.099 13 0 "[ . 1 . 2]"
1 139 VAL 2.728 0.115 16 0 "[ . 1 . 2]"
1 140 ALA 11.065 0.766 13 7 "[- *.* 1 +*.** 2]"
1 141 ARG 2.204 0.165 5 0 "[ . 1 . 2]"
1 142 ASP 2.752 0.110 12 0 "[ . 1 . 2]"
1 143 ASP 4.204 0.751 8 2 "[ - + 1 . 2]"
1 144 SER 1.406 0.285 15 0 "[ . 1 . 2]"
1 145 GLU 15.508 0.766 13 7 "[- *.* 1 +*.** 2]"
1 146 VAL 2.614 0.097 2 0 "[ . 1 . 2]"
1 147 ASP 1.215 0.089 1 0 "[ . 1 . 2]"
1 148 LYS 17.472 1.422 2 9 "[ + ** * 1** *- *2]"
1 149 TRP 39.169 1.422 2 9 "[ + ** * 1** *- *2]"
1 150 SER 10.888 0.521 11 2 "[ . 1+- . 2]"
1 151 LYS 8.758 0.772 9 5 "[- *. *+1 * 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 MET HA 1 3 ALA H . . 2.630 2.295 2.080 2.706 0.076 3 0 "[ . 1 . 2]" 1
2 1 2 MET HA 1 3 ALA MB . . 4.610 4.263 3.999 4.651 0.041 20 0 "[ . 1 . 2]" 1
3 1 2 MET ME 1 3 ALA H . . 4.530 4.418 3.325 4.630 0.100 4 0 "[ . 1 . 2]" 1
4 1 3 ALA H 1 3 ALA MB . . 3.030 2.856 2.709 3.032 0.002 10 0 "[ . 1 . 2]" 1
5 1 3 ALA H 1 4 LYS H . . 3.650 3.655 3.431 3.736 0.086 20 0 "[ . 1 . 2]" 1
6 1 3 ALA HA 1 4 LYS H . . 2.550 2.182 2.089 2.289 . 0 0 "[ . 1 . 2]" 1
7 1 3 ALA HA 1 4 LYS HG3 . . 5.190 4.348 3.845 4.776 . 0 0 "[ . 1 . 2]" 1
8 1 3 ALA MB 1 4 LYS H . . 3.310 3.361 3.143 3.435 0.125 19 0 "[ . 1 . 2]" 1
9 1 3 ALA MB 1 4 LYS HA . . 4.370 4.274 3.840 4.459 0.089 9 0 "[ . 1 . 2]" 1
10 1 3 ALA MB 1 5 LYS HA . . 5.400 4.908 4.204 5.232 . 0 0 "[ . 1 . 2]" 1
11 1 3 ALA MB 1 5 LYS HG3 . . 3.500 3.488 2.821 4.712 1.212 18 3 "[ *. 1 . + -]" 1
12 1 4 LYS H 1 4 LYS HB3 . . 3.160 3.514 3.049 3.804 0.644 5 8 "[ -*+ * *1 * * *2]" 1
13 1 4 LYS H 1 4 LYS HD3 . . 4.780 4.891 4.421 5.129 0.349 11 0 "[ . 1 . 2]" 1
14 1 4 LYS H 1 4 LYS HG3 . . 3.830 2.588 2.248 2.923 . 0 0 "[ . 1 . 2]" 1
15 1 4 LYS H 1 5 LYS H . . 4.470 4.140 3.747 4.515 0.045 14 0 "[ . 1 . 2]" 1
16 1 4 LYS H 1 78 ASP HB3 . . 5.500 5.227 4.964 5.558 0.058 16 0 "[ . 1 . 2]" 1
17 1 4 LYS HA 1 4 LYS HD3 . . 4.300 4.464 3.753 5.384 1.084 18 3 "[ . - 1 .* + 2]" 1
18 1 4 LYS HA 1 4 LYS HG3 . . 4.050 3.426 3.074 3.717 . 0 0 "[ . 1 . 2]" 1
19 1 4 LYS HA 1 5 LYS H . . 2.780 2.258 2.059 2.425 . 0 0 "[ . 1 . 2]" 1
20 1 4 LYS HA 1 78 ASP HB3 . . 4.120 2.537 2.073 3.168 . 0 0 "[ . 1 . 2]" 1
21 1 4 LYS HA 1 79 LEU H . . 5.500 5.310 4.903 5.554 0.054 14 0 "[ . 1 . 2]" 1
22 1 4 LYS HB3 1 5 LYS H . . 4.510 3.927 2.988 4.558 0.048 11 0 "[ . 1 . 2]" 1
23 1 4 LYS HD3 1 78 ASP HB3 . . 4.790 4.500 3.323 6.285 1.495 18 4 "[ - . * 1 . +*2]" 1
24 1 4 LYS HD3 1 79 LEU QD . . 4.780 4.614 2.349 6.029 1.249 14 7 "[* * . ** 1 +. *-2]" 1
25 1 5 LYS H 1 5 LYS HD3 . . 4.940 4.289 2.458 5.076 0.136 3 0 "[ . 1 . 2]" 1
26 1 5 LYS H 1 5 LYS HG3 . . 4.180 2.968 2.332 4.086 . 0 0 "[ . 1 . 2]" 1
27 1 5 LYS H 1 6 THR H . . 4.470 4.411 4.216 4.551 0.081 3 0 "[ . 1 . 2]" 1
28 1 5 LYS H 1 77 TYR HA . . 4.520 3.409 2.776 4.001 . 0 0 "[ . 1 . 2]" 1
29 1 5 LYS H 1 78 ASP H . . 4.160 2.674 2.036 3.188 . 0 0 "[ . 1 . 2]" 1
30 1 5 LYS H 1 78 ASP HB3 . . 3.600 3.085 2.083 3.654 0.054 16 0 "[ . 1 . 2]" 1
31 1 5 LYS H 1 79 LEU H . . 4.930 4.381 3.261 4.991 0.061 3 0 "[ . 1 . 2]" 1
32 1 5 LYS HA 1 5 LYS HG3 . . 4.040 3.203 2.116 4.011 . 0 0 "[ . 1 . 2]" 1
33 1 5 LYS HA 1 6 THR H . . 2.750 2.365 2.258 2.543 . 0 0 "[ . 1 . 2]" 1
34 1 5 LYS HA 1 6 THR HA . . 5.020 4.470 4.381 4.602 . 0 0 "[ . 1 . 2]" 1
35 1 5 LYS HA 1 6 THR HB . . 4.460 4.385 3.989 4.532 0.072 20 0 "[ . 1 . 2]" 1
36 1 5 LYS HA 1 30 ASP HB3 . . 5.220 2.682 2.111 3.322 . 0 0 "[ . 1 . 2]" 1
37 1 5 LYS HA 1 78 ASP H . . 4.590 4.447 4.137 4.658 0.068 20 0 "[ . 1 . 2]" 1
38 1 5 LYS HA 1 79 LEU H . . 5.440 5.374 5.032 5.513 0.073 4 0 "[ . 1 . 2]" 1
39 1 5 LYS HB3 1 6 THR H . . 4.020 2.137 1.995 2.775 . 0 0 "[ . 1 . 2]" 1
40 1 5 LYS HD3 1 6 THR H . . 4.920 4.670 3.974 5.576 0.656 2 3 "[ + . 1 - . *2]" 1
41 1 5 LYS HD3 1 77 TYR HA . . 4.580 4.159 2.035 5.550 0.970 7 6 "[* * . + * * . -]" 1
42 1 5 LYS HG3 1 6 THR H . . 4.530 4.461 3.686 4.626 0.096 4 0 "[ . 1 . 2]" 1
43 1 5 LYS HG3 1 77 TYR HA . . 5.280 3.745 2.326 5.073 . 0 0 "[ . 1 . 2]" 1
44 1 5 LYS HG3 1 77 TYR QD . . 4.550 4.282 3.376 4.648 0.098 19 0 "[ . 1 . 2]" 1
45 1 5 LYS HG3 1 78 ASP H . . 5.300 4.645 3.612 5.361 0.061 17 0 "[ . 1 . 2]" 1
46 1 6 THR H 1 6 THR HB . . 3.310 2.853 2.730 2.999 . 0 0 "[ . 1 . 2]" 1
47 1 6 THR H 1 6 THR MG . . 4.720 3.993 3.919 4.067 . 0 0 "[ . 1 . 2]" 1
48 1 6 THR H 1 31 SER HA . . 4.020 2.646 2.186 2.998 . 0 0 "[ . 1 . 2]" 1
49 1 6 THR H 1 32 GLU H . . 5.400 4.062 3.552 4.740 . 0 0 "[ . 1 . 2]" 1
50 1 6 THR H 1 77 TYR QD . . 5.500 2.904 2.367 3.444 . 0 0 "[ . 1 . 2]" 1
51 1 6 THR HA 1 6 THR MG . . 3.300 2.424 2.288 2.542 . 0 0 "[ . 1 . 2]" 1
52 1 6 THR HA 1 7 LEU H . . 2.890 2.315 2.229 2.396 . 0 0 "[ . 1 . 2]" 1
53 1 6 THR HA 1 77 TYR HB3 . . 5.040 3.242 2.829 3.716 . 0 0 "[ . 1 . 2]" 1
54 1 6 THR HA 1 78 ASP H . . 4.850 3.869 3.329 4.321 . 0 0 "[ . 1 . 2]" 1
55 1 6 THR HA 1 79 LEU H . . 3.790 2.784 2.480 3.105 . 0 0 "[ . 1 . 2]" 1
56 1 6 THR HA 1 79 LEU HA . . 4.530 4.534 4.385 4.609 0.079 6 0 "[ . 1 . 2]" 1
57 1 6 THR HA 1 79 LEU HB3 . . 5.310 2.595 2.133 3.340 . 0 0 "[ . 1 . 2]" 1
58 1 6 THR HA 1 79 LEU QD . . 5.450 4.026 3.738 4.431 . 0 0 "[ . 1 . 2]" 1
59 1 6 THR HA 1 80 ILE HA . . 4.480 4.213 3.850 4.425 . 0 0 "[ . 1 . 2]" 1
60 1 6 THR HA 1 81 LEU H . . 5.500 5.372 4.875 5.565 0.065 16 0 "[ . 1 . 2]" 1
61 1 6 THR HB 1 7 LEU H . . 5.500 4.050 3.813 4.534 . 0 0 "[ . 1 . 2]" 1
62 1 6 THR HB 1 28 ILE HB . . 4.470 4.027 3.499 4.521 0.051 6 0 "[ . 1 . 2]" 1
63 1 6 THR HB 1 28 ILE MG . . 3.150 2.458 2.064 2.867 . 0 0 "[ . 1 . 2]" 1
64 1 6 THR HB 1 31 SER H . . 5.080 4.352 3.891 4.993 . 0 0 "[ . 1 . 2]" 1
65 1 6 THR HB 1 32 GLU H . . 4.650 3.852 3.273 4.364 . 0 0 "[ . 1 . 2]" 1
66 1 6 THR MG 1 7 LEU H . . 3.350 2.458 2.063 3.403 0.053 15 0 "[ . 1 . 2]" 1
67 1 6 THR MG 1 25 ASN HA . . 5.250 5.017 4.600 5.339 0.089 10 0 "[ . 1 . 2]" 1
68 1 6 THR MG 1 32 GLU H . . 4.810 3.946 3.530 4.431 . 0 0 "[ . 1 . 2]" 1
69 1 6 THR MG 1 79 LEU H . . 5.010 4.295 3.946 4.522 . 0 0 "[ . 1 . 2]" 1
70 1 6 THR MG 1 80 ILE HA . . 4.340 3.612 3.135 4.113 . 0 0 "[ . 1 . 2]" 1
71 1 6 THR MG 1 81 LEU H . . 3.990 3.641 3.139 4.062 0.072 15 0 "[ . 1 . 2]" 1
72 1 7 LEU H 1 7 LEU HB3 . . 3.810 2.906 2.483 3.313 . 0 0 "[ . 1 . 2]" 1
73 1 7 LEU H 1 7 LEU QD . . 4.750 3.985 3.817 4.066 . 0 0 "[ . 1 . 2]" 1
74 1 7 LEU H 1 7 LEU HG . . 5.390 4.572 4.323 5.010 . 0 0 "[ . 1 . 2]" 1
75 1 7 LEU H 1 8 ILE H . . 4.750 4.351 4.162 4.642 . 0 0 "[ . 1 . 2]" 1
76 1 7 LEU H 1 77 TYR HB3 . . 5.240 3.708 3.153 4.332 . 0 0 "[ . 1 . 2]" 1
77 1 7 LEU H 1 77 TYR QD . . 5.000 4.220 3.352 4.995 . 0 0 "[ . 1 . 2]" 1
78 1 7 LEU H 1 79 LEU H . . 4.550 4.175 3.946 4.469 . 0 0 "[ . 1 . 2]" 1
79 1 7 LEU H 1 80 ILE HA . . 3.830 2.611 2.337 2.806 . 0 0 "[ . 1 . 2]" 1
80 1 7 LEU H 1 80 ILE HG13 . . 4.520 4.374 3.982 4.737 0.217 14 0 "[ . 1 . 2]" 1
81 1 7 LEU H 1 81 LEU H . . 4.330 3.541 3.133 3.922 . 0 0 "[ . 1 . 2]" 1
82 1 7 LEU H 1 81 LEU QD . . 4.590 4.162 3.302 4.600 0.010 3 0 "[ . 1 . 2]" 1
83 1 7 LEU HA 1 7 LEU QD . . 3.090 2.128 1.983 2.305 . 0 0 "[ . 1 . 2]" 1
84 1 7 LEU HA 1 7 LEU HG . . 3.700 2.957 2.645 3.750 0.050 13 0 "[ . 1 . 2]" 1
85 1 7 LEU HA 1 8 ILE H . . 3.070 2.235 2.152 2.336 . 0 0 "[ . 1 . 2]" 1
86 1 7 LEU HA 1 8 ILE HB . . 4.620 4.512 4.033 4.699 0.079 11 0 "[ . 1 . 2]" 1
87 1 7 LEU HA 1 32 GLU H . . 3.730 2.774 2.479 3.259 . 0 0 "[ . 1 . 2]" 1
88 1 7 LEU HB3 1 8 ILE H . . 4.570 3.795 3.181 4.381 . 0 0 "[ . 1 . 2]" 1
89 1 7 LEU HB3 1 77 TYR QD . . 5.390 4.336 3.429 4.971 . 0 0 "[ . 1 . 2]" 1
90 1 7 LEU HB3 1 80 ILE HA . . 4.560 3.200 2.632 3.607 . 0 0 "[ . 1 . 2]" 1
91 1 7 LEU HB3 1 81 LEU H . . 4.860 4.028 3.375 4.553 . 0 0 "[ . 1 . 2]" 1
92 1 7 LEU QD 1 8 ILE H . . 3.170 2.242 1.785 2.942 . 0 0 "[ . 1 . 2]" 1
93 1 7 LEU QD 1 9 LEU HA . . 4.840 4.032 3.347 4.463 . 0 0 "[ . 1 . 2]" 1
94 1 7 LEU QD 1 9 LEU QD . . 3.210 2.066 1.749 2.395 . 0 0 "[ . 1 . 2]" 1
95 1 7 LEU QD 1 9 LEU HG . . 3.850 2.901 2.054 3.866 0.016 15 0 "[ . 1 . 2]" 1
96 1 7 LEU QD 1 32 GLU H . . 4.340 3.592 3.012 4.129 . 0 0 "[ . 1 . 2]" 1
97 1 7 LEU QD 1 32 GLU HB3 . . 3.710 2.433 2.125 2.813 . 0 0 "[ . 1 . 2]" 1
98 1 7 LEU QD 1 32 GLU HG3 . . 4.570 4.477 4.087 4.717 0.147 13 0 "[ . 1 . 2]" 1
99 1 7 LEU QD 1 33 LEU H . . 4.270 3.588 3.012 4.311 0.041 18 0 "[ . 1 . 2]" 1
100 1 7 LEU QD 1 33 LEU HA . . 4.370 3.019 2.270 4.231 . 0 0 "[ . 1 . 2]" 1
101 1 7 LEU QD 1 34 LYS H . . 3.990 3.295 2.765 3.982 . 0 0 "[ . 1 . 2]" 1
102 1 7 LEU QD 1 34 LYS HB3 . . 3.810 3.345 2.057 3.722 . 0 0 "[ . 1 . 2]" 1
103 1 7 LEU QD 1 34 LYS HD3 . . 5.500 2.924 2.089 4.241 . 0 0 "[ . 1 . 2]" 1
104 1 7 LEU QD 1 34 LYS HG3 . . 4.220 3.610 2.067 4.285 0.065 14 0 "[ . 1 . 2]" 1
105 1 7 LEU QD 1 74 TYR HA . . 4.940 3.761 3.148 4.259 . 0 0 "[ . 1 . 2]" 1
106 1 7 LEU QD 1 74 TYR QD . . 3.990 3.044 2.140 3.870 . 0 0 "[ . 1 . 2]" 1
107 1 7 LEU QD 1 80 ILE HA . . 5.070 4.412 3.895 4.792 . 0 0 "[ . 1 . 2]" 1
108 1 7 LEU HG 1 8 ILE H . . 4.360 3.359 2.400 4.393 0.033 13 0 "[ . 1 . 2]" 1
109 1 8 ILE H 1 8 ILE HB . . 3.300 2.578 2.321 2.839 . 0 0 "[ . 1 . 2]" 1
110 1 8 ILE H 1 8 ILE MD . . 3.650 3.232 2.220 3.728 0.078 5 0 "[ . 1 . 2]" 1
111 1 8 ILE H 1 8 ILE HG13 . . 4.380 3.194 2.599 3.777 . 0 0 "[ . 1 . 2]" 1
112 1 8 ILE H 1 32 GLU H . . 4.350 3.933 3.390 4.412 0.062 5 0 "[ . 1 . 2]" 1
113 1 8 ILE H 1 32 GLU HB3 . . 4.860 4.539 4.087 4.927 0.067 11 0 "[ . 1 . 2]" 1
114 1 8 ILE H 1 33 LEU HA . . 3.820 2.660 2.010 3.514 . 0 0 "[ . 1 . 2]" 1
115 1 8 ILE H 1 34 LYS H . . 4.170 3.829 3.440 4.225 0.055 17 0 "[ . 1 . 2]" 1
116 1 8 ILE H 1 80 ILE HA . . 5.500 5.474 5.288 5.582 0.082 19 0 "[ . 1 . 2]" 1
117 1 8 ILE HA 1 8 ILE MG . . 3.350 2.425 2.187 2.629 . 0 0 "[ . 1 . 2]" 1
118 1 8 ILE HA 1 9 LEU H . . 2.860 2.220 2.140 2.276 . 0 0 "[ . 1 . 2]" 1
119 1 8 ILE HA 1 81 LEU H . . 3.930 3.002 2.685 3.235 . 0 0 "[ . 1 . 2]" 1
120 1 8 ILE HA 1 81 LEU HB3 . . 4.330 3.669 2.989 4.273 . 0 0 "[ . 1 . 2]" 1
121 1 8 ILE HB 1 8 ILE MD . . 3.220 2.257 2.124 2.372 . 0 0 "[ . 1 . 2]" 1
122 1 8 ILE HB 1 33 LEU HA . . 3.350 2.569 2.134 3.185 . 0 0 "[ . 1 . 2]" 1
123 1 8 ILE HB 1 34 LYS H . . 4.240 3.923 3.604 4.298 0.058 17 0 "[ . 1 . 2]" 1
124 1 8 ILE MD 1 24 ILE MG . . 3.650 2.281 2.131 2.616 . 0 0 "[ . 1 . 2]" 1
125 1 8 ILE MD 1 25 ASN H . . 3.790 2.904 2.459 3.531 . 0 0 "[ . 1 . 2]" 1
126 1 8 ILE MD 1 25 ASN HA . . 3.240 2.321 2.081 2.638 . 0 0 "[ . 1 . 2]" 1
127 1 8 ILE MD 1 25 ASN HB3 . . 4.000 3.775 3.404 4.124 0.124 11 0 "[ . 1 . 2]" 1
128 1 8 ILE MD 1 25 ASN QD . . 3.940 2.890 2.048 3.607 . 0 0 "[ . 1 . 2]" 1
129 1 8 ILE MD 1 26 SER H . . 5.010 4.773 4.447 5.108 0.098 6 0 "[ . 1 . 2]" 1
130 1 8 ILE MD 1 31 SER HB3 . . 3.820 3.465 2.639 4.146 0.326 6 0 "[ . 1 . 2]" 1
131 1 8 ILE MD 1 32 GLU H . . 4.890 3.526 2.821 4.358 . 0 0 "[ . 1 . 2]" 1
132 1 8 ILE MD 1 33 LEU HA . . 3.450 3.526 3.440 3.570 0.120 2 0 "[ . 1 . 2]" 1
133 1 8 ILE MG 1 9 LEU H . . 3.360 3.220 2.588 3.462 0.102 12 0 "[ . 1 . 2]" 1
134 1 8 ILE MG 1 9 LEU HA . . 4.900 3.981 3.432 4.295 . 0 0 "[ . 1 . 2]" 1
135 1 8 ILE MG 1 10 TYR H . . 5.500 4.118 3.232 4.752 . 0 0 "[ . 1 . 2]" 1
136 1 8 ILE MG 1 10 TYR QD . . 3.550 2.625 2.119 3.188 . 0 0 "[ . 1 . 2]" 1
137 1 8 ILE MG 1 10 TYR QE . . 4.140 3.967 3.214 4.253 0.113 13 0 "[ . 1 . 2]" 1
138 1 8 ILE MG 1 24 ILE MD . . 4.850 3.465 2.732 4.226 . 0 0 "[ . 1 . 2]" 1
139 1 8 ILE MG 1 24 ILE MG . . 5.020 3.578 3.152 4.242 . 0 0 "[ . 1 . 2]" 1
140 1 8 ILE MG 1 25 ASN H . . 5.500 4.360 3.719 5.282 . 0 0 "[ . 1 . 2]" 1
141 1 8 ILE MG 1 33 LEU HA . . 4.390 3.868 3.254 4.458 0.068 11 0 "[ . 1 . 2]" 1
142 1 9 LEU H 1 9 LEU HB3 . . 4.130 3.565 3.413 3.717 . 0 0 "[ . 1 . 2]" 1
143 1 9 LEU H 1 9 LEU QD . . 3.950 3.247 2.292 3.660 . 0 0 "[ . 1 . 2]" 1
144 1 9 LEU H 1 9 LEU HG . . 4.110 3.551 2.907 4.182 0.072 4 0 "[ . 1 . 2]" 1
145 1 9 LEU H 1 10 TYR H . . 5.170 4.362 4.047 4.570 . 0 0 "[ . 1 . 2]" 1
146 1 9 LEU H 1 36 VAL QG . . 5.310 5.049 4.740 5.294 . 0 0 "[ . 1 . 2]" 1
147 1 9 LEU H 1 80 ILE MG . . 4.760 3.993 3.315 4.593 . 0 0 "[ . 1 . 2]" 1
148 1 9 LEU H 1 82 ILE HA . . 3.900 3.187 2.706 3.617 . 0 0 "[ . 1 . 2]" 1
149 1 9 LEU H 1 82 ILE MG . . 5.500 4.557 3.716 5.462 . 0 0 "[ . 1 . 2]" 1
150 1 9 LEU HA 1 9 LEU QD . . 3.120 2.072 1.956 2.284 . 0 0 "[ . 1 . 2]" 1
151 1 9 LEU HA 1 9 LEU HG . . 4.050 3.138 2.299 3.839 . 0 0 "[ . 1 . 2]" 1
152 1 9 LEU HA 1 10 TYR H . . 3.040 2.218 2.125 2.313 . 0 0 "[ . 1 . 2]" 1
153 1 9 LEU HA 1 34 LYS H . . 3.880 3.295 2.948 3.858 . 0 0 "[ . 1 . 2]" 1
154 1 9 LEU HA 1 34 LYS HB3 . . 4.870 4.116 3.402 4.948 0.078 20 0 "[ . 1 . 2]" 1
155 1 9 LEU HA 1 35 GLU HA . . 4.920 4.186 3.280 4.845 . 0 0 "[ . 1 . 2]" 1
156 1 9 LEU HA 1 36 VAL H . . 5.100 4.917 4.399 5.173 0.073 12 0 "[ . 1 . 2]" 1
157 1 9 LEU HA 1 36 VAL QG . . 4.390 3.382 2.982 4.109 . 0 0 "[ . 1 . 2]" 1
158 1 9 LEU HB3 1 10 TYR H . . 4.300 3.494 2.598 3.985 . 0 0 "[ . 1 . 2]" 1
159 1 9 LEU HB3 1 82 ILE HA . . 4.680 4.333 3.725 4.734 0.054 16 0 "[ . 1 . 2]" 1
160 1 9 LEU QD 1 10 TYR H . . 4.220 3.334 2.980 3.558 . 0 0 "[ . 1 . 2]" 1
161 1 9 LEU QD 1 34 LYS H . . 4.090 3.341 2.708 3.919 . 0 0 "[ . 1 . 2]" 1
162 1 9 LEU QD 1 34 LYS HA . . 4.840 4.081 3.781 4.637 . 0 0 "[ . 1 . 2]" 1
163 1 9 LEU QD 1 34 LYS HB3 . . 3.660 2.302 2.016 3.529 . 0 0 "[ . 1 . 2]" 1
164 1 9 LEU QD 1 34 LYS HG3 . . 4.820 3.786 1.899 4.794 . 0 0 "[ . 1 . 2]" 1
165 1 9 LEU QD 1 35 GLU H . . 4.900 3.806 3.079 4.674 . 0 0 "[ . 1 . 2]" 1
166 1 9 LEU QD 1 36 VAL HA . . 3.800 3.670 2.811 3.888 0.088 19 0 "[ . 1 . 2]" 1
167 1 9 LEU HG 1 80 ILE MG . . 4.850 4.047 3.350 4.933 0.083 7 0 "[ . 1 . 2]" 1
168 1 10 TYR H 1 11 TYR H . . 5.500 4.279 3.762 4.557 . 0 0 "[ . 1 . 2]" 1
169 1 10 TYR H 1 34 LYS H . . 5.100 4.284 3.733 5.107 0.007 11 0 "[ . 1 . 2]" 1
170 1 10 TYR H 1 35 GLU HA . . 3.750 3.165 2.199 3.827 0.077 11 0 "[ . 1 . 2]" 1
171 1 10 TYR H 1 36 VAL H . . 4.140 3.740 3.267 4.219 0.079 17 0 "[ . 1 . 2]" 1
172 1 10 TYR H 1 36 VAL HB . . 5.180 4.675 3.980 5.237 0.057 16 0 "[ . 1 . 2]" 1
173 1 10 TYR H 1 36 VAL QG . . 3.830 2.967 2.431 3.850 0.020 20 0 "[ . 1 . 2]" 1
174 1 10 TYR HA 1 11 TYR H . . 3.170 2.245 2.119 2.460 . 0 0 "[ . 1 . 2]" 1
175 1 10 TYR HA 1 11 TYR HB3 . . 5.040 4.539 3.674 5.662 0.622 2 2 "[ + . 1 . - 2]" 1
176 1 10 TYR HA 1 17 THR MG . . 4.960 4.146 3.555 4.714 . 0 0 "[ . 1 . 2]" 1
177 1 10 TYR HA 1 21 ALA MB . . 5.330 5.003 4.218 5.421 0.091 5 0 "[ . 1 . 2]" 1
178 1 10 TYR HA 1 82 ILE HA . . 4.540 4.393 3.945 4.591 0.051 8 0 "[ . 1 . 2]" 1
179 1 10 TYR HA 1 82 ILE MG . . 4.740 4.365 3.733 4.796 0.056 19 0 "[ . 1 . 2]" 1
180 1 10 TYR HA 1 83 GLY H . . 3.510 2.794 2.395 3.244 . 0 0 "[ . 1 . 2]" 1
181 1 10 TYR HA 1 83 GLY HA3 . . 4.520 3.821 2.737 4.572 0.052 10 0 "[ . 1 . 2]" 1
182 1 10 TYR HB3 1 17 THR MG . . 4.620 3.987 3.090 4.681 0.061 14 0 "[ . 1 . 2]" 1
183 1 10 TYR HB3 1 21 ALA HA . . 4.990 4.978 4.070 6.014 1.024 5 4 "[ +- 1 * . * 2]" 1
184 1 10 TYR HB3 1 21 ALA MB . . 4.170 3.038 2.297 3.910 . 0 0 "[ . 1 . 2]" 1
185 1 10 TYR HB3 1 83 GLY H . . 4.770 4.246 3.417 5.329 0.559 17 1 "[ . 1 . + 2]" 1
186 1 10 TYR HB3 1 83 GLY HA3 . . 5.390 4.321 3.233 5.605 0.215 17 0 "[ . 1 . 2]" 1
187 1 10 TYR QD 1 17 THR MG . . 5.210 3.843 2.228 4.988 . 0 0 "[ . 1 . 2]" 1
188 1 10 TYR QD 1 21 ALA MB . . 3.020 2.487 2.067 2.915 . 0 0 "[ . 1 . 2]" 1
189 1 10 TYR QD 1 83 GLY H . . 5.500 5.062 3.389 5.592 0.092 10 0 "[ . 1 . 2]" 1
190 1 11 TYR H 1 11 TYR HB3 . . 3.590 2.541 2.179 3.470 . 0 0 "[ . 1 . 2]" 1
191 1 11 TYR H 1 17 THR MG . . 4.240 3.957 2.686 4.364 0.124 20 0 "[ . 1 . 2]" 1
192 1 11 TYR H 1 36 VAL HB . . 5.130 4.406 3.691 5.220 0.090 20 0 "[ . 1 . 2]" 1
193 1 11 TYR H 1 36 VAL QG . . 5.050 3.597 2.272 4.568 . 0 0 "[ . 1 . 2]" 1
194 1 11 TYR H 1 83 GLY H . . 4.720 4.136 3.471 4.792 0.072 6 0 "[ . 1 . 2]" 1
195 1 11 TYR H 1 95 ILE MD . . 4.220 3.960 3.214 4.313 0.093 4 0 "[ . 1 . 2]" 1
196 1 11 TYR HA 1 36 VAL HB . . 4.240 3.127 1.983 4.362 0.122 17 0 "[ . 1 . 2]" 1
197 1 11 TYR HB3 1 36 VAL HB . . 4.160 3.945 2.849 4.650 0.490 15 0 "[ . 1 . 2]" 1
198 1 11 TYR HB3 1 36 VAL QG . . 4.240 3.345 1.891 4.057 . 0 0 "[ . 1 . 2]" 1
199 1 11 TYR HB3 1 95 ILE MD . . 3.700 3.472 2.753 4.552 0.852 18 2 "[ - . 1 . + 2]" 1
200 1 11 TYR QD 1 38 VAL H . . 5.500 4.837 4.069 5.579 0.079 11 0 "[ . 1 . 2]" 1
201 1 11 TYR QD 1 38 VAL HA . . 5.170 5.200 4.520 5.272 0.102 16 0 "[ . 1 . 2]" 1
202 1 11 TYR QD 1 38 VAL MG1 . . 4.630 3.244 2.221 3.991 . 0 0 "[ . 1 . 2]" 1
203 1 15 GLY HA2 1 18 LYS HB3 . . 4.320 3.080 2.236 4.132 . 0 0 "[ . 1 . 2]" 1
204 1 15 GLY HA3 1 18 LYS HB3 . . 4.620 4.267 3.076 4.700 0.080 6 0 "[ . 1 . 2]" 1
205 1 17 THR HA 1 17 THR MG . . 3.310 2.293 2.124 2.513 . 0 0 "[ . 1 . 2]" 1
206 1 17 THR HB 1 20 MET HB3 . . 5.260 4.795 4.025 5.345 0.085 6 0 "[ . 1 . 2]" 1
207 1 17 THR HB 1 21 ALA H . . 5.500 4.784 3.568 5.575 0.075 11 0 "[ . 1 . 2]" 1
208 1 17 THR MG 1 18 LYS HA . . 5.500 5.483 5.141 5.603 0.103 16 0 "[ . 1 . 2]" 1
209 1 17 THR MG 1 20 MET H . . 5.370 5.100 4.438 5.484 0.114 19 0 "[ . 1 . 2]" 1
210 1 17 THR MG 1 83 GLY H . . 5.170 4.864 4.131 5.283 0.113 5 0 "[ . 1 . 2]" 1
211 1 17 THR MG 1 83 GLY HA2 . . 5.120 4.430 3.486 5.234 0.114 17 0 "[ . 1 . 2]" 1
212 1 17 THR MG 1 83 GLY HA3 . . 4.050 3.433 2.607 4.152 0.102 13 0 "[ . 1 . 2]" 1
213 1 17 THR MG 1 84 SER H . . 4.330 3.760 2.924 4.419 0.089 6 0 "[ . 1 . 2]" 1
214 1 17 THR MG 1 84 SER HA . . 3.700 3.341 2.649 3.811 0.111 17 0 "[ . 1 . 2]" 1
215 1 17 THR MG 1 85 PRO HD3 . . 5.500 3.587 2.919 4.409 . 0 0 "[ . 1 . 2]" 1
216 1 18 LYS HA 1 18 LYS HG3 . . 3.650 2.659 2.250 3.711 0.061 2 0 "[ . 1 . 2]" 1
217 1 18 LYS HA 1 21 ALA H . . 4.330 3.746 3.299 4.387 0.057 19 0 "[ . 1 . 2]" 1
218 1 18 LYS HA 1 21 ALA MB . . 3.740 2.768 2.210 3.673 . 0 0 "[ . 1 . 2]" 1
219 1 18 LYS HA 1 22 GLU H . . 4.620 3.952 3.588 4.446 . 0 0 "[ . 1 . 2]" 1
220 1 18 LYS HG3 1 19 LYS HA . . 5.250 4.775 3.499 5.478 0.228 2 0 "[ . 1 . 2]" 1
221 1 18 LYS HG3 1 22 GLU H . . 5.080 4.699 4.052 6.183 1.103 2 2 "[-+ . 1 . 2]" 1
222 1 18 LYS HG3 1 22 GLU HG3 . . 5.500 3.281 2.223 4.645 . 0 0 "[ . 1 . 2]" 1
223 1 19 LYS H 1 19 LYS HD3 . . 5.420 4.921 4.305 5.809 0.389 5 0 "[ . 1 . 2]" 1
224 1 19 LYS H 1 19 LYS HG3 . . 3.850 3.204 2.315 4.930 1.080 20 2 "[ . 1 . -+]" 1
225 1 19 LYS H 1 21 ALA H . . 5.480 4.263 3.966 4.520 . 0 0 "[ . 1 . 2]" 1
226 1 19 LYS HA 1 19 LYS HG3 . . 3.810 3.507 2.784 3.787 . 0 0 "[ . 1 . 2]" 1
227 1 19 LYS HA 1 21 ALA H . . 5.500 4.022 3.465 4.622 . 0 0 "[ . 1 . 2]" 1
228 1 19 LYS HA 1 22 GLU H . . 3.930 3.852 3.525 4.013 0.083 6 0 "[ . 1 . 2]" 1
229 1 19 LYS HA 1 23 LYS H . . 4.570 4.212 3.515 4.644 0.074 12 0 "[ . 1 . 2]" 1
230 1 19 LYS HD3 1 20 MET ME . . 5.330 4.988 2.218 6.719 1.389 18 6 "[ * 1*-* .* + 2]" 1
231 1 20 MET H 1 20 MET HB3 . . 3.520 3.269 2.739 3.601 0.081 5 0 "[ . 1 . 2]" 1
232 1 20 MET H 1 21 ALA H . . 3.370 2.710 1.798 3.253 . 0 0 "[ . 1 . 2]" 1
233 1 20 MET H 1 21 ALA MB . . 4.580 4.199 3.422 4.660 0.080 20 0 "[ . 1 . 2]" 1
234 1 20 MET H 1 22 GLU H . . 5.020 4.413 3.794 5.080 0.060 11 0 "[ . 1 . 2]" 1
235 1 20 MET H 1 114 THR MG . . 4.520 4.204 3.194 4.635 0.115 12 0 "[ . 1 . 2]" 1
236 1 20 MET HA 1 20 MET ME . . 3.250 2.125 1.879 2.516 . 0 0 "[ . 1 . 2]" 1
237 1 20 MET HA 1 22 GLU H . . 5.180 4.703 4.210 5.011 . 0 0 "[ . 1 . 2]" 1
238 1 20 MET HA 1 23 LYS H . . 4.080 3.866 3.520 4.152 0.072 11 0 "[ . 1 . 2]" 1
239 1 20 MET HA 1 23 LYS HB3 . . 3.820 4.368 3.830 4.994 1.174 1 11 "[+ ** ***** *- *]" 1
240 1 20 MET HA 1 24 ILE H . . 4.990 4.285 3.413 5.056 0.066 1 0 "[ . 1 . 2]" 1
241 1 20 MET HB3 1 20 MET ME . . 3.400 3.351 2.160 4.105 0.705 11 7 "[ . *1+ *- ** *]" 1
242 1 20 MET HB3 1 21 ALA H . . 4.710 3.851 2.689 4.476 . 0 0 "[ . 1 . 2]" 1
243 1 20 MET HB3 1 114 THR MG . . 3.800 2.840 1.995 3.563 . 0 0 "[ . 1 . 2]" 1
244 1 20 MET ME 1 21 ALA H . . 5.500 4.803 4.201 5.246 . 0 0 "[ . 1 . 2]" 1
245 1 20 MET ME 1 23 LYS H . . 4.970 4.752 3.929 5.086 0.116 5 0 "[ . 1 . 2]" 1
246 1 20 MET ME 1 24 ILE MD . . 4.810 3.655 2.575 4.744 . 0 0 "[ . 1 . 2]" 1
247 1 20 MET ME 1 114 THR MG . . 4.530 3.874 2.686 4.640 0.110 15 0 "[ . 1 . 2]" 1
248 1 20 MET ME 1 142 ASP HA . . 3.660 3.480 2.625 3.747 0.087 15 0 "[ . 1 . 2]" 1
249 1 20 MET ME 1 143 ASP H . . 3.790 3.261 2.516 3.886 0.096 5 0 "[ . 1 . 2]" 1
250 1 21 ALA H 1 21 ALA MB . . 3.200 2.400 2.163 2.758 . 0 0 "[ . 1 . 2]" 1
251 1 21 ALA H 1 22 GLU H . . 3.530 2.289 1.854 2.858 . 0 0 "[ . 1 . 2]" 1
252 1 21 ALA H 1 22 GLU HG3 . . 5.460 5.012 3.776 6.266 0.806 3 1 "[ + . 1 . 2]" 1
253 1 21 ALA H 1 23 LYS H . . 4.960 3.519 2.581 4.228 . 0 0 "[ . 1 . 2]" 1
254 1 21 ALA HA 1 23 LYS H . . 5.230 4.435 4.170 4.790 . 0 0 "[ . 1 . 2]" 1
255 1 21 ALA HA 1 24 ILE H . . 4.410 3.995 3.260 4.374 . 0 0 "[ . 1 . 2]" 1
256 1 21 ALA HA 1 24 ILE HB . . 3.510 3.383 2.927 3.585 0.075 7 0 "[ . 1 . 2]" 1
257 1 21 ALA HA 1 24 ILE MD . . 4.030 3.264 2.286 4.120 0.090 14 0 "[ . 1 . 2]" 1
258 1 21 ALA HA 1 24 ILE MG . . 4.910 4.613 4.325 4.895 . 0 0 "[ . 1 . 2]" 1
259 1 21 ALA HA 1 25 ASN H . . 5.160 4.339 3.884 4.912 . 0 0 "[ . 1 . 2]" 1
260 1 21 ALA MB 1 22 GLU H . . 3.620 2.393 2.004 2.778 . 0 0 "[ . 1 . 2]" 1
261 1 21 ALA MB 1 22 GLU HG3 . . 4.690 4.236 3.113 4.767 0.077 3 0 "[ . 1 . 2]" 1
262 1 21 ALA MB 1 23 LYS H . . 5.500 4.431 4.206 4.588 . 0 0 "[ . 1 . 2]" 1
263 1 22 GLU H 1 22 GLU HB3 . . 3.620 3.557 3.480 3.659 0.039 18 0 "[ . 1 . 2]" 1
264 1 22 GLU H 1 22 GLU HG3 . . 3.480 3.167 2.288 3.676 0.196 3 0 "[ . 1 . 2]" 1
265 1 22 GLU H 1 23 LYS H . . 3.550 2.702 2.453 2.858 . 0 0 "[ . 1 . 2]" 1
266 1 22 GLU H 1 23 LYS HA . . 5.300 5.336 5.110 5.374 0.074 7 0 "[ . 1 . 2]" 1
267 1 22 GLU H 1 24 ILE H . . 5.470 4.682 4.335 4.946 . 0 0 "[ . 1 . 2]" 1
268 1 22 GLU H 1 33 LEU QD . . 4.540 3.812 2.808 4.550 0.010 13 0 "[ . 1 . 2]" 1
269 1 22 GLU HA 1 22 GLU HG3 . . 3.750 3.693 3.226 3.829 0.079 5 0 "[ . 1 . 2]" 1
270 1 22 GLU HA 1 25 ASN H . . 4.020 3.630 3.329 3.957 . 0 0 "[ . 1 . 2]" 1
271 1 22 GLU HA 1 25 ASN HB3 . . 3.420 2.807 2.353 3.257 . 0 0 "[ . 1 . 2]" 1
272 1 22 GLU HA 1 26 SER H . . 4.700 4.554 3.932 4.778 0.078 3 0 "[ . 1 . 2]" 1
273 1 22 GLU HA 1 33 LEU QD . . 3.340 2.462 2.063 2.950 . 0 0 "[ . 1 . 2]" 1
274 1 22 GLU HB3 1 23 LYS H . . 4.250 3.752 3.520 4.164 . 0 0 "[ . 1 . 2]" 1
275 1 22 GLU HG3 1 23 LYS H . . 4.810 4.825 4.402 4.940 0.130 3 0 "[ . 1 . 2]" 1
276 1 22 GLU HG3 1 33 LEU QD . . 4.220 4.060 3.299 4.276 0.056 13 0 "[ . 1 . 2]" 1
277 1 23 LYS H 1 23 LYS HB3 . . 3.160 3.410 3.149 3.479 0.319 15 0 "[ . 1 . 2]" 1
278 1 23 LYS H 1 23 LYS HD3 . . 5.210 4.716 3.833 5.284 0.074 19 0 "[ . 1 . 2]" 1
279 1 23 LYS H 1 23 LYS HG3 . . 4.960 4.021 3.453 4.380 . 0 0 "[ . 1 . 2]" 1
280 1 23 LYS H 1 24 ILE H . . 3.640 2.883 2.668 3.042 . 0 0 "[ . 1 . 2]" 1
281 1 23 LYS H 1 24 ILE HB . . 5.100 4.868 4.484 5.120 0.020 16 0 "[ . 1 . 2]" 1
282 1 23 LYS H 1 25 ASN H . . 4.470 4.172 3.967 4.323 . 0 0 "[ . 1 . 2]" 1
283 1 23 LYS H 1 25 ASN HB3 . . 5.500 5.117 4.881 5.560 0.060 1 0 "[ . 1 . 2]" 1
284 1 23 LYS HA 1 23 LYS HD3 . . 4.820 4.104 2.937 4.562 . 0 0 "[ . 1 . 2]" 1
285 1 23 LYS HA 1 23 LYS HG3 . . 3.920 2.384 2.110 3.857 . 0 0 "[ . 1 . 2]" 1
286 1 23 LYS HA 1 26 SER H . . 4.160 3.758 3.552 3.943 . 0 0 "[ . 1 . 2]" 1
287 1 23 LYS HB3 1 24 ILE H . . 3.810 2.667 2.302 3.022 . 0 0 "[ . 1 . 2]" 1
288 1 23 LYS HB3 1 24 ILE MD . . 5.500 4.631 3.394 5.245 . 0 0 "[ . 1 . 2]" 1
289 1 23 LYS HG3 1 24 ILE H . . 5.210 4.693 4.397 4.967 . 0 0 "[ . 1 . 2]" 1
290 1 24 ILE H 1 24 ILE HB . . 3.300 2.465 2.227 2.643 . 0 0 "[ . 1 . 2]" 1
291 1 24 ILE H 1 24 ILE MD . . 4.080 3.303 1.678 3.644 . 0 0 "[ . 1 . 2]" 1
292 1 24 ILE H 1 24 ILE HG13 . . 3.740 2.058 1.784 2.542 . 0 0 "[ . 1 . 2]" 1
293 1 24 ILE H 1 24 ILE MG . . 4.030 3.741 3.661 3.825 . 0 0 "[ . 1 . 2]" 1
294 1 24 ILE H 1 25 ASN H . . 3.700 2.912 2.710 3.102 . 0 0 "[ . 1 . 2]" 1
295 1 24 ILE H 1 26 SER H . . 4.720 4.382 4.189 4.578 . 0 0 "[ . 1 . 2]" 1
296 1 24 ILE HA 1 24 ILE MD . . 4.470 3.859 3.523 4.007 . 0 0 "[ . 1 . 2]" 1
297 1 24 ILE HA 1 24 ILE HG13 . . 3.850 2.913 2.359 3.380 . 0 0 "[ . 1 . 2]" 1
298 1 24 ILE HA 1 24 ILE MG . . 3.450 2.500 2.408 2.654 . 0 0 "[ . 1 . 2]" 1
299 1 24 ILE HA 1 25 ASN HA . . 5.400 4.872 4.787 4.961 . 0 0 "[ . 1 . 2]" 1
300 1 24 ILE HA 1 26 SER H . . 5.210 4.173 3.930 4.510 . 0 0 "[ . 1 . 2]" 1
301 1 24 ILE HA 1 27 GLU H . . 3.920 3.209 2.838 3.427 . 0 0 "[ . 1 . 2]" 1
302 1 24 ILE HA 1 27 GLU HB3 . . 4.260 4.067 3.114 4.357 0.097 3 0 "[ . 1 . 2]" 1
303 1 24 ILE HA 1 27 GLU HG3 . . 4.590 2.710 1.927 3.635 . 0 0 "[ . 1 . 2]" 1
304 1 24 ILE HA 1 28 ILE H . . 5.500 4.787 4.183 5.314 . 0 0 "[ . 1 . 2]" 1
305 1 24 ILE HA 1 143 ASP HB3 . . 4.910 4.954 4.478 5.661 0.751 8 2 "[ - + 1 . 2]" 1
306 1 24 ILE HA 1 146 VAL MG1 . . 4.990 3.478 2.725 4.406 . 0 0 "[ . 1 . 2]" 1
307 1 24 ILE HA 1 146 VAL MG2 . . 5.010 3.809 2.925 4.653 . 0 0 "[ . 1 . 2]" 1
308 1 24 ILE HB 1 25 ASN H . . 3.820 2.753 2.568 2.905 . 0 0 "[ . 1 . 2]" 1
309 1 24 ILE HB 1 25 ASN HB3 . . 5.130 5.136 4.924 5.206 0.076 2 0 "[ . 1 . 2]" 1
310 1 24 ILE MD 1 24 ILE MG . . 3.240 2.147 2.044 3.056 . 0 0 "[ . 1 . 2]" 1
311 1 24 ILE MD 1 25 ASN H . . 5.500 4.644 3.843 5.036 . 0 0 "[ . 1 . 2]" 1
312 1 24 ILE MD 1 28 ILE MD . . 5.500 4.283 3.958 5.057 . 0 0 "[ . 1 . 2]" 1
313 1 24 ILE MD 1 81 LEU HB3 . . 5.500 4.371 3.281 5.036 . 0 0 "[ . 1 . 2]" 1
314 1 24 ILE MD 1 81 LEU QD . . 4.710 3.388 2.717 4.143 . 0 0 "[ . 1 . 2]" 1
315 1 24 ILE MD 1 112 PHE HB3 . . 4.510 4.051 2.925 4.611 0.101 12 0 "[ . 1 . 2]" 1
316 1 24 ILE MD 1 112 PHE QD . . 4.220 3.154 2.399 4.111 . 0 0 "[ . 1 . 2]" 1
317 1 24 ILE MD 1 112 PHE QE . . 4.000 3.020 2.054 4.098 0.098 7 0 "[ . 1 . 2]" 1
318 1 24 ILE MD 1 142 ASP HA . . 4.910 4.730 3.993 5.020 0.110 12 0 "[ . 1 . 2]" 1
319 1 24 ILE MD 1 143 ASP H . . 5.500 4.593 4.018 5.057 . 0 0 "[ . 1 . 2]" 1
320 1 24 ILE MD 1 143 ASP HA . . 3.730 3.129 2.465 3.809 0.079 19 0 "[ . 1 . 2]" 1
321 1 24 ILE MD 1 143 ASP HB3 . . 4.570 2.528 2.080 3.574 . 0 0 "[ . 1 . 2]" 1
322 1 24 ILE MD 1 146 VAL MG1 . . 4.400 3.889 3.240 4.492 0.092 19 0 "[ . 1 . 2]" 1
323 1 24 ILE MD 1 146 VAL MG2 . . 3.480 2.623 2.145 3.279 . 0 0 "[ . 1 . 2]" 1
324 1 24 ILE HG13 1 143 ASP HA . . 5.440 4.748 3.856 5.467 0.027 1 0 "[ . 1 . 2]" 1
325 1 24 ILE HG13 1 143 ASP HB3 . . 4.420 3.080 2.516 3.596 . 0 0 "[ . 1 . 2]" 1
326 1 24 ILE HG13 1 146 VAL MG2 . . 4.960 3.669 2.172 4.451 . 0 0 "[ . 1 . 2]" 1
327 1 24 ILE MG 1 25 ASN H . . 4.200 3.502 3.215 3.725 . 0 0 "[ . 1 . 2]" 1
328 1 24 ILE MG 1 25 ASN HA . . 4.280 3.605 3.304 3.849 . 0 0 "[ . 1 . 2]" 1
329 1 24 ILE MG 1 27 GLU H . . 4.850 4.255 4.034 4.525 . 0 0 "[ . 1 . 2]" 1
330 1 24 ILE MG 1 28 ILE H . . 5.320 4.594 4.033 5.153 . 0 0 "[ . 1 . 2]" 1
331 1 24 ILE MG 1 81 LEU QD . . 3.890 2.696 2.007 3.602 . 0 0 "[ . 1 . 2]" 1
332 1 24 ILE MG 1 112 PHE QE . . 5.390 4.520 3.751 5.360 . 0 0 "[ . 1 . 2]" 1
333 1 24 ILE MG 1 146 VAL HA . . 5.500 4.550 4.062 5.273 . 0 0 "[ . 1 . 2]" 1
334 1 24 ILE MG 1 146 VAL MG1 . . 3.930 2.289 2.021 2.713 . 0 0 "[ . 1 . 2]" 1
335 1 24 ILE MG 1 146 VAL MG2 . . 3.700 2.575 2.075 3.205 . 0 0 "[ . 1 . 2]" 1
336 1 25 ASN H 1 25 ASN HB3 . . 3.270 2.457 2.342 2.593 . 0 0 "[ . 1 . 2]" 1
337 1 25 ASN H 1 25 ASN QD . . 5.500 4.423 4.346 4.521 . 0 0 "[ . 1 . 2]" 1
338 1 25 ASN H 1 26 SER H . . 3.470 2.818 2.654 2.966 . 0 0 "[ . 1 . 2]" 1
339 1 25 ASN H 1 27 GLU H . . 5.250 4.133 3.997 4.284 . 0 0 "[ . 1 . 2]" 1
340 1 25 ASN HA 1 25 ASN QD . . 3.360 2.224 2.018 2.410 . 0 0 "[ . 1 . 2]" 1
341 1 25 ASN HA 1 28 ILE H . . 4.780 4.090 3.810 4.428 . 0 0 "[ . 1 . 2]" 1
342 1 25 ASN HB3 1 26 SER H . . 3.610 2.755 2.389 3.124 . 0 0 "[ . 1 . 2]" 1
343 1 25 ASN HB3 1 33 LEU QD . . 3.690 2.836 2.464 3.239 . 0 0 "[ . 1 . 2]" 1
344 1 25 ASN QD 1 26 SER H . . 5.500 4.613 4.134 4.823 . 0 0 "[ . 1 . 2]" 1
345 1 25 ASN QD 1 28 ILE HB . . 5.270 4.506 4.164 4.794 . 0 0 "[ . 1 . 2]" 1
346 1 25 ASN QD 1 31 SER H . . 4.580 3.941 3.298 4.236 . 0 0 "[ . 1 . 2]" 1
347 1 25 ASN QD 1 31 SER HB3 . . 5.060 2.922 1.715 3.792 . 0 0 "[ . 1 . 2]" 1
348 1 25 ASN QD 1 32 GLU H . . 5.500 3.434 2.764 4.143 . 0 0 "[ . 1 . 2]" 1
349 1 25 ASN QD 1 32 GLU HA . . 5.470 2.751 2.319 3.401 . 0 0 "[ . 1 . 2]" 1
350 1 25 ASN QD 1 33 LEU H . . 5.020 3.965 3.577 4.622 . 0 0 "[ . 1 . 2]" 1
351 1 25 ASN QD 1 33 LEU QD . . 5.080 3.033 2.299 3.912 . 0 0 "[ . 1 . 2]" 1
352 1 26 SER H 1 26 SER HB3 . . 3.130 2.872 2.390 3.221 0.091 16 0 "[ . 1 . 2]" 1
353 1 26 SER H 1 28 ILE H . . 5.010 4.344 4.056 4.690 . 0 0 "[ . 1 . 2]" 1
354 1 26 SER HA 1 28 ILE H . . 4.600 4.045 3.769 4.613 0.013 5 0 "[ . 1 . 2]" 1
355 1 26 SER HB3 1 27 GLU H . . 4.160 3.449 2.888 3.831 . 0 0 "[ . 1 . 2]" 1
356 1 27 GLU H 1 27 GLU HB3 . . 3.880 3.387 2.561 3.750 . 0 0 "[ . 1 . 2]" 1
357 1 27 GLU H 1 27 GLU HG3 . . 3.920 2.980 2.557 3.786 . 0 0 "[ . 1 . 2]" 1
358 1 27 GLU H 1 28 ILE H . . 3.170 2.371 2.092 2.679 . 0 0 "[ . 1 . 2]" 1
359 1 27 GLU H 1 28 ILE HG13 . . 5.220 3.673 3.426 3.905 . 0 0 "[ . 1 . 2]" 1
360 1 27 GLU H 1 146 VAL MG1 . . 5.500 4.931 4.036 5.550 0.050 8 0 "[ . 1 . 2]" 1
361 1 27 GLU HA 1 27 GLU HG3 . . 3.380 3.571 2.940 3.979 0.599 3 3 "[- + . 1 * . 2]" 1
362 1 27 GLU HB3 1 28 ILE H . . 4.690 4.381 3.943 4.723 0.033 9 0 "[ . 1 . 2]" 1
363 1 28 ILE H 1 28 ILE HB . . 3.160 2.574 2.312 2.806 . 0 0 "[ . 1 . 2]" 1
364 1 28 ILE H 1 28 ILE HG13 . . 4.500 2.877 2.364 3.225 . 0 0 "[ . 1 . 2]" 1
365 1 28 ILE H 1 28 ILE MG . . 4.150 3.849 3.723 3.956 . 0 0 "[ . 1 . 2]" 1
366 1 28 ILE H 1 29 LYS H . . 4.480 4.421 4.196 4.556 0.076 7 0 "[ . 1 . 2]" 1
367 1 28 ILE H 1 31 SER H . . 5.340 5.155 4.851 5.395 0.055 17 0 "[ . 1 . 2]" 1
368 1 28 ILE H 1 31 SER HB3 . . 5.500 4.330 3.804 5.030 . 0 0 "[ . 1 . 2]" 1
369 1 28 ILE HA 1 28 ILE MD . . 3.810 3.843 3.764 3.899 0.089 18 0 "[ . 1 . 2]" 1
370 1 28 ILE HA 1 28 ILE HG13 . . 3.420 3.076 2.943 3.183 . 0 0 "[ . 1 . 2]" 1
371 1 28 ILE HA 1 28 ILE MG . . 3.120 2.443 2.316 2.556 . 0 0 "[ . 1 . 2]" 1
372 1 28 ILE HA 1 29 LYS H . . 2.770 2.265 2.023 2.519 . 0 0 "[ . 1 . 2]" 1
373 1 28 ILE HB 1 28 ILE MD . . 3.640 2.424 2.299 2.520 . 0 0 "[ . 1 . 2]" 1
374 1 28 ILE HB 1 29 LYS H . . 4.550 3.999 3.631 4.311 . 0 0 "[ . 1 . 2]" 1
375 1 28 ILE HB 1 31 SER H . . 4.020 4.089 4.058 4.113 0.093 6 0 "[ . 1 . 2]" 1
376 1 28 ILE HB 1 31 SER HA . . 4.960 4.533 4.196 4.911 . 0 0 "[ . 1 . 2]" 1
377 1 28 ILE HB 1 31 SER HB3 . . 3.960 2.662 2.069 3.711 . 0 0 "[ . 1 . 2]" 1
378 1 28 ILE MD 1 29 LYS H . . 5.050 4.897 4.588 5.136 0.086 8 0 "[ . 1 . 2]" 1
379 1 28 ILE MD 1 149 TRP HE3 . . 5.500 4.578 3.866 5.324 . 0 0 "[ . 1 . 2]" 1
380 1 28 ILE MD 1 150 SER HB3 . . 4.680 4.491 3.967 4.774 0.094 6 0 "[ . 1 . 2]" 1
381 1 28 ILE HG13 1 28 ILE MG . . 2.770 3.238 3.213 3.254 0.484 5 0 "[ . 1 . 2]" 1
382 1 28 ILE HG13 1 29 LYS H . . 4.340 5.051 4.863 5.141 0.801 8 20 [*****-*+************] 1
383 1 28 ILE MG 1 29 LYS H . . 3.500 2.379 1.967 2.848 . 0 0 "[ . 1 . 2]" 1
384 1 28 ILE MG 1 29 LYS HA . . 4.010 3.999 3.793 4.107 0.097 16 0 "[ . 1 . 2]" 1
385 1 28 ILE MG 1 30 ASP H . . 4.720 4.570 4.260 4.768 0.048 16 0 "[ . 1 . 2]" 1
386 1 28 ILE MG 1 30 ASP HB3 . . 4.930 4.859 4.491 5.018 0.088 7 0 "[ . 1 . 2]" 1
387 1 28 ILE MG 1 31 SER H . . 4.100 3.391 3.098 3.741 . 0 0 "[ . 1 . 2]" 1
388 1 28 ILE MG 1 32 GLU H . . 5.300 5.123 4.702 5.367 0.067 2 0 "[ . 1 . 2]" 1
389 1 28 ILE MG 1 150 SER HB3 . . 4.590 4.021 2.596 4.667 0.077 13 0 "[ . 1 . 2]" 1
390 1 29 LYS H 1 29 LYS HB3 . . 3.030 2.945 2.136 3.261 0.231 7 0 "[ . 1 . 2]" 1
391 1 29 LYS H 1 29 LYS HG3 . . 4.580 4.430 4.141 4.630 0.050 3 0 "[ . 1 . 2]" 1
392 1 29 LYS H 1 30 ASP H . . 4.560 4.511 4.305 4.595 0.035 13 0 "[ . 1 . 2]" 1
393 1 29 LYS H 1 31 SER H . . 5.010 4.727 4.291 5.061 0.051 1 0 "[ . 1 . 2]" 1
394 1 29 LYS HA 1 30 ASP H . . 2.640 2.160 2.084 2.250 . 0 0 "[ . 1 . 2]" 1
395 1 29 LYS HA 1 30 ASP HA . . 4.400 4.338 4.235 4.441 0.041 13 0 "[ . 1 . 2]" 1
396 1 29 LYS HA 1 31 SER H . . 3.910 3.689 3.254 3.982 0.072 11 0 "[ . 1 . 2]" 1
397 1 29 LYS HB3 1 30 ASP H . . 4.600 3.714 3.200 4.349 . 0 0 "[ . 1 . 2]" 1
398 1 29 LYS HG3 1 30 ASP H . . 3.730 3.145 2.565 4.422 0.692 4 2 "[ +. 1 .- 2]" 1
399 1 29 LYS HG3 1 31 SER H . . 5.500 5.587 4.933 6.631 1.131 4 2 "[ +. 1 .- 2]" 1
400 1 30 ASP H 1 30 ASP HA . . 2.740 2.236 2.179 2.292 . 0 0 "[ . 1 . 2]" 1
401 1 30 ASP H 1 30 ASP HB3 . . 3.980 3.856 3.564 4.048 0.068 7 0 "[ . 1 . 2]" 1
402 1 30 ASP H 1 31 SER H . . 3.280 2.789 2.511 2.999 . 0 0 "[ . 1 . 2]" 1
403 1 30 ASP HA 1 31 SER H . . 3.490 2.926 2.670 3.142 . 0 0 "[ . 1 . 2]" 1
404 1 31 SER H 1 31 SER HB3 . . 3.710 2.744 2.308 3.372 . 0 0 "[ . 1 . 2]" 1
405 1 31 SER H 1 32 GLU H . . 4.760 4.542 4.415 4.636 . 0 0 "[ . 1 . 2]" 1
406 1 31 SER HA 1 32 GLU H . . 2.910 2.360 2.121 2.590 . 0 0 "[ . 1 . 2]" 1
407 1 31 SER HB3 1 32 GLU H . . 3.570 3.548 2.513 3.882 0.312 5 0 "[ . 1 . 2]" 1
408 1 32 GLU H 1 32 GLU HB3 . . 4.170 3.637 3.340 3.765 . 0 0 "[ . 1 . 2]" 1
409 1 32 GLU H 1 32 GLU HG3 . . 4.890 4.037 3.287 4.809 . 0 0 "[ . 1 . 2]" 1
410 1 32 GLU H 1 33 LEU H . . 4.550 4.363 4.213 4.578 0.028 19 0 "[ . 1 . 2]" 1
411 1 32 GLU HA 1 32 GLU HG3 . . 3.610 2.639 2.173 3.641 0.031 3 0 "[ . 1 . 2]" 1
412 1 32 GLU HA 1 33 LEU H . . 2.850 2.356 2.159 2.538 . 0 0 "[ . 1 . 2]" 1
413 1 32 GLU HA 1 33 LEU QD . . 3.360 3.327 2.838 3.443 0.083 1 0 "[ . 1 . 2]" 1
414 1 32 GLU HB3 1 33 LEU H . . 3.780 2.647 2.236 3.171 . 0 0 "[ . 1 . 2]" 1
415 1 32 GLU HG3 1 33 LEU H . . 4.350 4.116 2.838 4.498 0.148 7 0 "[ . 1 . 2]" 1
416 1 33 LEU H 1 33 LEU HB3 . . 3.650 3.133 2.840 3.368 . 0 0 "[ . 1 . 2]" 1
417 1 33 LEU H 1 33 LEU QD . . 4.570 2.344 1.852 3.495 . 0 0 "[ . 1 . 2]" 1
418 1 33 LEU H 1 33 LEU HG . . 4.750 3.765 2.685 4.722 . 0 0 "[ . 1 . 2]" 1
419 1 33 LEU H 1 34 LYS H . . 4.630 4.256 4.040 4.444 . 0 0 "[ . 1 . 2]" 1
420 1 33 LEU HA 1 33 LEU QD . . 4.080 3.003 1.913 3.475 . 0 0 "[ . 1 . 2]" 1
421 1 33 LEU HA 1 34 LYS H . . 2.920 2.268 2.105 2.519 . 0 0 "[ . 1 . 2]" 1
422 1 33 LEU HB3 1 34 LYS H . . 4.310 4.050 3.310 4.427 0.117 20 0 "[ . 1 . 2]" 1
423 1 33 LEU QD 1 34 LYS H . . 4.790 3.862 2.995 4.314 . 0 0 "[ . 1 . 2]" 1
424 1 33 LEU HG 1 34 LYS H . . 4.410 3.853 3.152 4.507 0.097 5 0 "[ . 1 . 2]" 1
425 1 34 LYS H 1 34 LYS HB3 . . 3.900 3.532 3.083 3.829 . 0 0 "[ . 1 . 2]" 1
426 1 34 LYS H 1 35 GLU H . . 4.750 4.371 4.155 4.496 . 0 0 "[ . 1 . 2]" 1
427 1 34 LYS HA 1 34 LYS HD3 . . 3.730 3.323 2.277 4.193 0.463 6 0 "[ . 1 . 2]" 1
428 1 34 LYS HA 1 34 LYS HG3 . . 3.920 2.743 2.129 3.863 . 0 0 "[ . 1 . 2]" 1
429 1 34 LYS HA 1 35 GLU H . . 2.840 2.393 2.066 2.742 . 0 0 "[ . 1 . 2]" 1
430 1 34 LYS HA 1 72 ILE MD . . 5.050 4.628 4.242 5.149 0.099 19 0 "[ . 1 . 2]" 1
431 1 34 LYS HB3 1 35 GLU H . . 4.320 2.896 2.401 4.242 . 0 0 "[ . 1 . 2]" 1
432 1 34 LYS HD3 1 72 ILE MD . . 4.840 3.865 2.503 4.535 . 0 0 "[ . 1 . 2]" 1
433 1 34 LYS HG3 1 35 GLU H . . 4.770 3.480 2.245 4.848 0.078 12 0 "[ . 1 . 2]" 1
434 1 34 LYS HG3 1 72 ILE MD . . 3.230 2.974 2.130 4.379 1.149 19 2 "[ - . 1 . +2]" 1
435 1 35 GLU H 1 36 VAL H . . 4.820 4.468 4.114 4.588 . 0 0 "[ . 1 . 2]" 1
436 1 35 GLU HA 1 36 VAL H . . 2.950 2.255 2.058 2.484 . 0 0 "[ . 1 . 2]" 1
437 1 35 GLU HA 1 36 VAL QG . . 4.200 3.434 2.993 3.848 . 0 0 "[ . 1 . 2]" 1
438 1 36 VAL H 1 36 VAL HB . . 3.310 2.726 2.297 3.270 . 0 0 "[ . 1 . 2]" 1
439 1 36 VAL H 1 36 VAL QG . . 3.320 2.344 1.742 2.837 . 0 0 "[ . 1 . 2]" 1
440 1 36 VAL H 1 37 LYS H . . 5.400 4.477 4.095 4.707 . 0 0 "[ . 1 . 2]" 1
441 1 36 VAL HA 1 36 VAL QG . . 3.110 2.217 2.089 2.437 . 0 0 "[ . 1 . 2]" 1
442 1 36 VAL HA 1 37 LYS H . . 2.890 2.371 2.127 2.564 . 0 0 "[ . 1 . 2]" 1
443 1 36 VAL HA 1 37 LYS HB3 . . 5.310 5.606 4.903 5.944 0.634 9 7 "[ **** +1 -. *2]" 1
444 1 36 VAL HA 1 67 ILE MD . . 5.080 4.876 4.088 5.176 0.096 2 0 "[ . 1 . 2]" 1
445 1 36 VAL HA 1 68 GLN H . . 5.180 4.781 4.204 5.218 0.038 5 0 "[ . 1 . 2]" 1
446 1 36 VAL HA 1 69 LEU HB3 . . 4.260 3.229 2.225 4.366 0.106 18 0 "[ . 1 . 2]" 1
447 1 36 VAL QG 1 37 LYS H . . 3.710 2.494 2.113 3.196 . 0 0 "[ . 1 . 2]" 1
448 1 36 VAL QG 1 37 LYS HA . . 5.140 3.673 3.019 4.043 . 0 0 "[ . 1 . 2]" 1
449 1 36 VAL QG 1 67 ILE HA . . 4.590 4.025 3.614 4.492 . 0 0 "[ . 1 . 2]" 1
450 1 36 VAL QG 1 67 ILE HB . . 3.140 2.632 2.134 3.226 0.086 17 0 "[ . 1 . 2]" 1
451 1 36 VAL QG 1 68 GLN H . . 4.580 3.405 2.875 4.142 . 0 0 "[ . 1 . 2]" 1
452 1 37 LYS H 1 37 LYS HB3 . . 3.940 3.677 3.408 3.780 . 0 0 "[ . 1 . 2]" 1
453 1 37 LYS H 1 38 VAL H . . 5.480 4.397 4.298 4.536 . 0 0 "[ . 1 . 2]" 1
454 1 37 LYS H 1 67 ILE HA . . 5.500 4.747 4.350 5.112 . 0 0 "[ . 1 . 2]" 1
455 1 37 LYS H 1 67 ILE HB . . 4.560 3.877 3.502 4.413 . 0 0 "[ . 1 . 2]" 1
456 1 37 LYS H 1 67 ILE MG . . 5.500 4.671 4.224 5.497 . 0 0 "[ . 1 . 2]" 1
457 1 37 LYS H 1 68 GLN H . . 4.070 2.884 2.594 3.120 . 0 0 "[ . 1 . 2]" 1
458 1 37 LYS H 1 68 GLN HA . . 5.280 4.887 4.712 5.164 . 0 0 "[ . 1 . 2]" 1
459 1 37 LYS H 1 68 GLN HB3 . . 4.610 4.541 4.155 4.603 . 0 0 "[ . 1 . 2]" 1
460 1 37 LYS HA 1 38 VAL H . . 2.900 2.608 2.380 2.853 . 0 0 "[ . 1 . 2]" 1
461 1 37 LYS HA 1 38 VAL MG2 . . 4.610 3.748 3.221 4.133 . 0 0 "[ . 1 . 2]" 1
462 1 37 LYS HB3 1 38 VAL H . . 3.590 2.591 1.975 3.640 0.050 8 0 "[ . 1 . 2]" 1
463 1 38 VAL H 1 38 VAL HB . . 4.010 3.722 3.617 3.830 . 0 0 "[ . 1 . 2]" 1
464 1 38 VAL H 1 38 VAL MG1 . . 3.890 3.154 2.587 3.432 . 0 0 "[ . 1 . 2]" 1
465 1 38 VAL H 1 38 VAL MG2 . . 3.480 2.175 1.948 2.309 . 0 0 "[ . 1 . 2]" 1
466 1 38 VAL HA 1 38 VAL MG1 . . 3.280 2.217 2.136 2.279 . 0 0 "[ . 1 . 2]" 1
467 1 38 VAL HA 1 38 VAL MG2 . . 3.560 3.251 3.207 3.297 . 0 0 "[ . 1 . 2]" 1
468 1 38 VAL HA 1 39 SER H . . 3.320 2.402 2.130 2.854 . 0 0 "[ . 1 . 2]" 1
469 1 38 VAL HA 1 67 ILE HA . . 3.630 2.124 1.951 2.485 . 0 0 "[ . 1 . 2]" 1
470 1 38 VAL HA 1 67 ILE MG . . 3.840 3.302 2.654 3.836 . 0 0 "[ . 1 . 2]" 1
471 1 38 VAL HA 1 68 GLN H . . 4.300 3.158 2.353 3.778 . 0 0 "[ . 1 . 2]" 1
472 1 38 VAL HA 1 68 GLN HE21 . . 5.500 4.793 4.156 5.571 0.071 18 0 "[ . 1 . 2]" 1
473 1 38 VAL HB 1 39 SER H . . 3.470 2.546 1.943 3.074 . 0 0 "[ . 1 . 2]" 1
474 1 38 VAL HB 1 50 THR HB . . 5.310 4.979 4.389 5.382 0.072 5 0 "[ . 1 . 2]" 1
475 1 38 VAL HB 1 50 THR MG . . 4.960 3.339 2.146 5.046 0.086 19 0 "[ . 1 . 2]" 1
476 1 38 VAL HB 1 67 ILE HA . . 5.120 4.251 3.815 4.796 . 0 0 "[ . 1 . 2]" 1
477 1 38 VAL MG1 1 39 SER H . . 3.900 3.432 3.175 3.710 . 0 0 "[ . 1 . 2]" 1
478 1 38 VAL MG1 1 50 THR MG . . 4.970 3.022 2.062 4.453 . 0 0 "[ . 1 . 2]" 1
479 1 38 VAL MG1 1 66 GLU H . . 5.500 5.339 4.212 5.598 0.098 20 0 "[ . 1 . 2]" 1
480 1 38 VAL MG1 1 67 ILE HA . . 3.900 3.181 2.385 4.006 0.106 19 0 "[ . 1 . 2]" 1
481 1 38 VAL MG1 1 67 ILE MG . . 3.740 2.883 2.276 3.867 0.127 16 0 "[ . 1 . 2]" 1
482 1 38 VAL MG1 1 68 GLN H . . 5.070 4.455 3.763 5.154 0.084 16 0 "[ . 1 . 2]" 1
483 1 38 VAL MG2 1 50 THR H . . 5.500 4.916 3.380 5.585 0.085 2 0 "[ . 1 . 2]" 1
484 1 38 VAL MG2 1 50 THR HB . . 4.680 4.027 2.918 4.757 0.077 16 0 "[ . 1 . 2]" 1
485 1 38 VAL MG2 1 50 THR MG . . 5.100 2.804 2.028 4.767 . 0 0 "[ . 1 . 2]" 1
486 1 39 SER H 1 39 SER HB3 . . 3.330 2.835 2.219 3.394 0.064 9 0 "[ . 1 . 2]" 1
487 1 39 SER H 1 40 GLU H . . 5.220 4.402 4.147 4.621 . 0 0 "[ . 1 . 2]" 1
488 1 39 SER H 1 67 ILE HA . . 4.420 3.180 2.205 4.262 . 0 0 "[ . 1 . 2]" 1
489 1 39 SER H 1 68 GLN HE21 . . 5.320 4.112 3.846 4.451 . 0 0 "[ . 1 . 2]" 1
490 1 39 SER H 1 68 GLN HE22 . . 5.500 5.520 5.301 5.590 0.090 6 0 "[ . 1 . 2]" 1
491 1 39 SER HA 1 39 SER HB3 . . 2.930 2.927 2.561 3.051 0.121 13 0 "[ . 1 . 2]" 1
492 1 39 SER HA 1 40 GLU H . . 2.970 2.527 2.126 2.860 . 0 0 "[ . 1 . 2]" 1
493 1 39 SER HA 1 68 GLN HE21 . . 4.950 2.516 1.891 3.376 . 0 0 "[ . 1 . 2]" 1
494 1 39 SER HA 1 68 GLN HE22 . . 4.910 3.419 2.634 4.811 . 0 0 "[ . 1 . 2]" 1
495 1 39 SER HB3 1 40 GLU H . . 4.030 2.915 2.101 3.965 . 0 0 "[ . 1 . 2]" 1
496 1 39 SER HB3 1 66 GLU HB3 . . 4.530 4.079 2.485 4.930 0.400 10 0 "[ . 1 . 2]" 1
497 1 39 SER HB3 1 68 GLN HE21 . . 4.900 4.506 3.267 5.223 0.323 14 0 "[ . 1 . 2]" 1
498 1 39 SER HB3 1 68 GLN HE22 . . 5.500 5.464 4.363 6.446 0.946 15 3 "[* - 1 + 2]" 1
499 1 40 GLU HA 1 41 GLY H . . 2.820 2.594 2.167 2.882 0.062 9 0 "[ . 1 . 2]" 1
500 1 48 TYR HA 1 48 TYR QD . . 4.080 2.934 2.453 3.805 . 0 0 "[ . 1 . 2]" 1
501 1 49 LYS H 1 50 THR H . . 3.560 2.244 1.680 3.624 0.064 7 0 "[ . 1 . 2]" 1
502 1 49 LYS H 1 50 THR HB . . 3.520 3.584 3.506 3.608 0.088 10 0 "[ . 1 . 2]" 1
503 1 49 LYS H 1 50 THR MG . . 5.500 4.190 2.827 5.026 . 0 0 "[ . 1 . 2]" 1
504 1 50 THR H 1 50 THR HB . . 3.150 2.579 2.079 3.242 0.092 7 0 "[ . 1 . 2]" 1
505 1 50 THR MG 1 65 PRO HA . . 5.500 5.281 4.531 5.607 0.107 20 0 "[ . 1 . 2]" 1
506 1 50 THR MG 1 65 PRO HB3 . . 5.130 3.521 2.561 4.380 . 0 0 "[ . 1 . 2]" 1
507 1 54 ALA H 1 54 ALA MB . . 3.360 2.779 2.238 3.118 . 0 0 "[ . 1 . 2]" 1
508 1 54 ALA HA 1 55 LEU QD . . 5.280 4.296 3.549 5.099 . 0 0 "[ . 1 . 2]" 1
509 1 54 ALA MB 1 55 LEU H . . 3.870 2.542 1.828 3.671 . 0 0 "[ . 1 . 2]" 1
510 1 54 ALA MB 1 55 LEU QD . . 5.260 3.003 2.195 4.583 . 0 0 "[ . 1 . 2]" 1
511 1 54 ALA MB 1 87 TRP HE3 . . 3.860 3.542 2.538 3.959 0.099 2 0 "[ . 1 . 2]" 1
512 1 55 LEU H 1 55 LEU HB3 . . 3.760 3.588 3.162 3.858 0.098 8 0 "[ . 1 . 2]" 1
513 1 55 LEU H 1 55 LEU QD . . 5.220 2.719 2.105 3.939 . 0 0 "[ . 1 . 2]" 1
514 1 55 LEU H 1 55 LEU HG . . 3.760 3.641 2.614 3.849 0.089 20 0 "[ . 1 . 2]" 1
515 1 55 LEU HA 1 55 LEU QD . . 3.240 2.454 1.972 3.026 . 0 0 "[ . 1 . 2]" 1
516 1 55 LEU HA 1 55 LEU HG . . 3.960 2.911 1.961 3.921 . 0 0 "[ . 1 . 2]" 1
517 1 55 LEU HA 1 58 ILE HB . . 3.390 3.278 2.619 3.479 0.089 19 0 "[ . 1 . 2]" 1
518 1 55 LEU HA 1 58 ILE MD . . 4.250 2.554 1.965 4.318 0.068 17 0 "[ . 1 . 2]" 1
519 1 55 LEU HA 1 58 ILE MG . . 4.830 4.356 3.820 4.820 . 0 0 "[ . 1 . 2]" 1
520 1 55 LEU HA 1 59 GLN H . . 4.740 4.593 4.141 4.816 0.076 13 0 "[ . 1 . 2]" 1
521 1 55 LEU QD 1 58 ILE MD . . 5.210 3.409 2.157 4.695 . 0 0 "[ . 1 . 2]" 1
522 1 55 LEU QD 1 59 GLN HE21 . . 4.900 3.037 1.921 3.839 . 0 0 "[ . 1 . 2]" 1
523 1 55 LEU QD 1 59 GLN HE22 . . 4.930 3.321 2.159 4.265 . 0 0 "[ . 1 . 2]" 1
524 1 55 LEU QD 1 88 SER HB3 . . 4.280 3.356 1.993 4.316 0.036 16 0 "[ . 1 . 2]" 1
525 1 58 ILE HA 1 58 ILE MG . . 3.570 2.480 2.186 2.639 . 0 0 "[ . 1 . 2]" 1
526 1 58 ILE HA 1 130 TRP HH2 . . 4.350 4.294 3.549 4.441 0.091 16 0 "[ . 1 . 2]" 1
527 1 58 ILE HA 1 130 TRP HZ2 . . 5.240 4.422 3.576 4.912 . 0 0 "[ . 1 . 2]" 1
528 1 58 ILE HB 1 58 ILE MD . . 3.720 2.418 2.123 3.306 . 0 0 "[ . 1 . 2]" 1
529 1 58 ILE HB 1 59 GLN H . . 3.630 2.273 1.922 2.670 . 0 0 "[ . 1 . 2]" 1
530 1 58 ILE HB 1 61 ASN H . . 5.500 5.520 5.279 5.591 0.091 7 0 "[ . 1 . 2]" 1
531 1 58 ILE MD 1 90 TYR H . . 5.500 4.378 2.616 5.378 . 0 0 "[ . 1 . 2]" 1
532 1 58 ILE MD 1 90 TYR QD . . 5.390 3.367 2.174 4.952 . 0 0 "[ . 1 . 2]" 1
533 1 58 ILE MD 1 91 PRO HD3 . . 5.500 5.008 4.124 5.723 0.223 17 0 "[ . 1 . 2]" 1
534 1 58 ILE MD 1 93 THR MG . . 5.270 3.626 2.189 5.342 0.072 3 0 "[ . 1 . 2]" 1
535 1 58 ILE MD 1 130 TRP HH2 . . 4.440 3.758 2.052 4.518 0.078 3 0 "[ . 1 . 2]" 1
536 1 58 ILE MD 1 130 TRP HZ2 . . 5.370 5.076 2.377 5.468 0.098 20 0 "[ . 1 . 2]" 1
537 1 58 ILE HG13 1 130 TRP HH2 . . 5.500 3.317 2.585 5.161 . 0 0 "[ . 1 . 2]" 1
538 1 58 ILE MG 1 59 GLN H . . 3.980 2.888 2.327 3.231 . 0 0 "[ . 1 . 2]" 1
539 1 58 ILE MG 1 59 GLN HA . . 4.470 3.274 2.601 3.697 . 0 0 "[ . 1 . 2]" 1
540 1 58 ILE MG 1 59 GLN HG3 . . 4.740 3.107 2.141 4.767 0.027 3 0 "[ . 1 . 2]" 1
541 1 58 ILE MG 1 61 ASN H . . 5.500 5.316 4.767 5.606 0.106 17 0 "[ . 1 . 2]" 1
542 1 58 ILE MG 1 90 TYR QD . . 4.830 3.168 2.634 3.657 . 0 0 "[ . 1 . 2]" 1
543 1 58 ILE MG 1 90 TYR QE . . 3.950 2.650 2.093 4.059 0.109 3 0 "[ . 1 . 2]" 1
544 1 58 ILE MG 1 130 TRP HH2 . . 5.350 4.074 2.726 4.984 . 0 0 "[ . 1 . 2]" 1
545 1 58 ILE MG 1 130 TRP HZ2 . . 4.730 3.766 2.067 4.807 0.077 14 0 "[ . 1 . 2]" 1
546 1 59 GLN H 1 59 GLN HB3 . . 3.630 3.422 2.736 3.668 0.038 15 0 "[ . 1 . 2]" 1
547 1 59 GLN H 1 59 GLN HG3 . . 3.870 2.648 2.027 3.012 . 0 0 "[ . 1 . 2]" 1
548 1 59 GLN H 1 60 GLY H . . 4.840 4.240 3.751 4.598 . 0 0 "[ . 1 . 2]" 1
549 1 59 GLN HA 1 59 GLN HB3 . . 3.010 2.423 2.189 2.603 . 0 0 "[ . 1 . 2]" 1
550 1 59 GLN HA 1 59 GLN HE21 . . 5.500 4.972 4.393 5.595 0.095 3 0 "[ . 1 . 2]" 1
551 1 59 GLN HA 1 59 GLN HG3 . . 3.640 3.391 2.908 3.957 0.317 9 0 "[ . 1 . 2]" 1
552 1 59 GLN HA 1 61 ASN H . . 3.960 3.791 3.319 4.043 0.083 15 0 "[ . 1 . 2]" 1
553 1 60 GLY H 1 61 ASN H . . 4.860 2.917 2.484 3.469 . 0 0 "[ . 1 . 2]" 1
554 1 61 ASN H 1 61 ASN HB3 . . 3.650 3.360 2.436 3.729 0.079 11 0 "[ . 1 . 2]" 1
555 1 61 ASN H 1 61 ASN HD21 . . 5.500 4.579 3.079 5.149 . 0 0 "[ . 1 . 2]" 1
556 1 64 PHE H 1 64 PHE HA . . 2.920 2.902 2.802 2.966 0.046 1 0 "[ . 1 . 2]" 1
557 1 64 PHE H 1 64 PHE QD . . 4.030 3.015 2.188 3.273 . 0 0 "[ . 1 . 2]" 1
558 1 64 PHE H 1 64 PHE QE . . 4.370 4.326 3.933 4.466 0.096 5 0 "[ . 1 . 2]" 1
559 1 64 PHE HB3 1 65 PRO HD3 . . 4.360 4.000 3.605 4.391 0.031 6 0 "[ . 1 . 2]" 1
560 1 64 PHE QD 1 65 PRO HD3 . . 4.890 4.701 3.747 4.992 0.102 20 0 "[ . 1 . 2]" 1
561 1 64 PHE QD 1 93 THR MG . . 3.930 2.798 2.362 3.430 . 0 0 "[ . 1 . 2]" 1
562 1 64 PHE QD 1 96 LYS HG3 . . 5.500 3.556 2.280 4.812 . 0 0 "[ . 1 . 2]" 1
563 1 64 PHE QD 1 97 THR H . . 5.350 4.787 4.204 5.411 0.061 17 0 "[ . 1 . 2]" 1
564 1 64 PHE QE 1 93 THR MG . . 3.930 3.504 2.154 4.032 0.102 1 0 "[ . 1 . 2]" 1
565 1 64 PHE QE 1 96 LYS HD3 . . 5.500 4.557 4.094 5.460 . 0 0 "[ . 1 . 2]" 1
566 1 64 PHE QE 1 96 LYS HE3 . . 4.530 3.073 1.975 4.497 . 0 0 "[ . 1 . 2]" 1
567 1 64 PHE QE 1 96 LYS HG3 . . 4.540 2.864 2.326 4.605 0.065 10 0 "[ . 1 . 2]" 1
568 1 65 PRO HA 1 66 GLU H . . 2.720 2.334 2.176 2.535 . 0 0 "[ . 1 . 2]" 1
569 1 65 PRO HB3 1 66 GLU H . . 4.360 3.711 3.405 4.196 . 0 0 "[ . 1 . 2]" 1
570 1 65 PRO HG3 1 66 GLU H . . 5.380 5.376 4.944 5.843 0.463 14 0 "[ . 1 . 2]" 1
571 1 66 GLU H 1 66 GLU HB3 . . 3.530 3.136 1.880 3.604 0.074 10 0 "[ . 1 . 2]" 1
572 1 66 GLU H 1 66 GLU HG3 . . 3.520 3.332 2.384 4.237 0.717 4 3 "[ +. -1 * 2]" 1
573 1 66 GLU HA 1 67 ILE H . . 2.690 2.496 2.294 2.756 0.066 9 0 "[ . 1 . 2]" 1
574 1 66 GLU HA 1 67 ILE HA . . 4.610 4.475 4.296 4.589 . 0 0 "[ . 1 . 2]" 1
575 1 66 GLU HA 1 67 ILE HG13 . . 4.850 4.820 3.993 5.528 0.678 3 2 "[ + . 1 .- 2]" 1
576 1 66 GLU HA 1 67 ILE MG . . 4.310 3.569 2.957 4.101 . 0 0 "[ . 1 . 2]" 1
577 1 66 GLU HA 1 97 THR MG . . 3.310 2.716 2.028 3.404 0.094 4 0 "[ . 1 . 2]" 1
578 1 66 GLU HB3 1 67 ILE H . . 3.980 2.837 1.967 4.043 0.063 15 0 "[ . 1 . 2]" 1
579 1 66 GLU HG3 1 67 ILE H . . 4.780 3.868 1.908 4.846 0.066 2 0 "[ . 1 . 2]" 1
580 1 66 GLU HG3 1 97 THR MG . . 5.360 4.252 2.322 5.469 0.109 16 0 "[ . 1 . 2]" 1
581 1 67 ILE H 1 67 ILE MD . . 4.030 3.798 3.317 4.072 0.042 18 0 "[ . 1 . 2]" 1
582 1 67 ILE H 1 67 ILE HG13 . . 3.370 2.573 1.871 3.220 . 0 0 "[ . 1 . 2]" 1
583 1 67 ILE H 1 67 ILE MG . . 3.590 2.920 2.557 3.327 . 0 0 "[ . 1 . 2]" 1
584 1 67 ILE H 1 68 GLN H . . 4.730 4.450 4.328 4.560 . 0 0 "[ . 1 . 2]" 1
585 1 67 ILE H 1 97 THR HB . . 5.380 3.832 2.434 5.162 . 0 0 "[ . 1 . 2]" 1
586 1 67 ILE H 1 97 THR MG . . 3.430 2.721 1.876 3.280 . 0 0 "[ . 1 . 2]" 1
587 1 67 ILE H 1 101 GLN QE . . 5.420 4.426 3.616 4.820 . 0 0 "[ . 1 . 2]" 1
588 1 67 ILE HA 1 67 ILE MD . . 4.380 4.114 3.808 4.235 . 0 0 "[ . 1 . 2]" 1
589 1 67 ILE HA 1 67 ILE MG . . 3.170 2.276 2.186 2.369 . 0 0 "[ . 1 . 2]" 1
590 1 67 ILE HA 1 68 GLN H . . 2.960 2.402 2.088 2.566 . 0 0 "[ . 1 . 2]" 1
591 1 67 ILE HA 1 68 GLN HB3 . . 4.900 5.725 5.578 5.964 1.064 13 20 [*******-****+*******] 1
592 1 67 ILE HA 1 97 THR MG . . 5.350 4.831 3.967 5.329 . 0 0 "[ . 1 . 2]" 1
593 1 67 ILE HB 1 67 ILE MD . . 3.210 2.318 2.202 2.411 . 0 0 "[ . 1 . 2]" 1
594 1 67 ILE HB 1 68 GLN H . . 3.000 2.395 2.123 3.014 0.014 15 0 "[ . 1 . 2]" 1
595 1 67 ILE MD 1 68 GLN H . . 4.610 3.919 3.164 4.670 0.060 4 0 "[ . 1 . 2]" 1
596 1 67 ILE MD 1 69 LEU H . . 5.500 4.925 3.779 5.576 0.076 8 0 "[ . 1 . 2]" 1
597 1 67 ILE MD 1 97 THR H . . 5.310 4.818 4.056 5.420 0.110 20 0 "[ . 1 . 2]" 1
598 1 67 ILE MD 1 97 THR HB . . 4.150 3.024 2.223 3.689 . 0 0 "[ . 1 . 2]" 1
599 1 67 ILE MD 1 98 LEU H . . 4.030 3.108 2.582 4.083 0.053 20 0 "[ . 1 . 2]" 1
600 1 67 ILE MD 1 98 LEU HA . . 3.260 2.544 2.256 3.189 . 0 0 "[ . 1 . 2]" 1
601 1 67 ILE MD 1 98 LEU HB3 . . 3.960 4.073 3.514 5.034 1.074 20 4 "[ . *1 .*- +]" 1
602 1 67 ILE MD 1 101 GLN H . . 5.500 5.009 4.541 5.441 . 0 0 "[ . 1 . 2]" 1
603 1 67 ILE MD 1 101 GLN HB3 . . 5.480 4.863 4.167 5.424 . 0 0 "[ . 1 . 2]" 1
604 1 67 ILE MD 1 101 GLN QE . . 4.590 2.719 1.896 3.907 . 0 0 "[ . 1 . 2]" 1
605 1 67 ILE MD 1 101 GLN HG3 . . 4.720 3.375 2.537 3.847 . 0 0 "[ . 1 . 2]" 1
606 1 67 ILE HG13 1 67 ILE MG . . 3.380 3.171 2.769 3.281 . 0 0 "[ . 1 . 2]" 1
607 1 67 ILE HG13 1 68 GLN H . . 5.330 3.900 3.278 4.708 . 0 0 "[ . 1 . 2]" 1
608 1 67 ILE HG13 1 101 GLN QE . . 4.970 3.156 2.366 3.935 . 0 0 "[ . 1 . 2]" 1
609 1 67 ILE MG 1 68 GLN H . . 3.870 3.587 3.402 3.875 0.005 2 0 "[ . 1 . 2]" 1
610 1 67 ILE MG 1 97 THR H . . 4.830 3.774 3.076 4.437 . 0 0 "[ . 1 . 2]" 1
611 1 67 ILE MG 1 97 THR HB . . 3.450 2.458 2.090 3.129 . 0 0 "[ . 1 . 2]" 1
612 1 67 ILE MG 1 98 LEU H . . 4.610 3.447 2.869 4.026 . 0 0 "[ . 1 . 2]" 1
613 1 67 ILE MG 1 98 LEU HA . . 4.820 4.604 3.478 4.900 0.080 16 0 "[ . 1 . 2]" 1
614 1 68 GLN H 1 68 GLN HB3 . . 3.590 3.711 3.554 3.837 0.247 13 0 "[ . 1 . 2]" 1
615 1 68 GLN H 1 68 GLN HE21 . . 5.500 4.675 4.070 5.539 0.039 3 0 "[ . 1 . 2]" 1
616 1 68 GLN H 1 69 LEU H . . 4.490 4.311 4.098 4.480 . 0 0 "[ . 1 . 2]" 1
617 1 68 GLN HA 1 68 GLN HE21 . . 5.500 4.545 2.761 5.226 . 0 0 "[ . 1 . 2]" 1
618 1 68 GLN HA 1 69 LEU H . . 2.580 2.263 2.109 2.466 . 0 0 "[ . 1 . 2]" 1
619 1 68 GLN HB3 1 69 LEU H . . 4.190 2.852 2.504 3.255 . 0 0 "[ . 1 . 2]" 1
620 1 69 LEU H 1 69 LEU HB3 . . 4.190 3.418 2.755 3.608 . 0 0 "[ . 1 . 2]" 1
621 1 69 LEU H 1 69 LEU QD . . 3.880 2.566 2.194 4.016 0.136 18 0 "[ . 1 . 2]" 1
622 1 69 LEU H 1 69 LEU MD2 . . 4.300 2.635 2.199 4.736 0.436 18 0 "[ . 1 . 2]" 1
623 1 69 LEU H 1 69 LEU HG . . 4.570 4.139 3.804 4.620 0.050 18 0 "[ . 1 . 2]" 1
624 1 69 LEU H 1 70 ASP H . . 4.320 4.247 4.117 4.365 0.045 2 0 "[ . 1 . 2]" 1
625 1 69 LEU HA 1 69 LEU QD . . 3.330 3.266 2.066 3.418 0.088 10 0 "[ . 1 . 2]" 1
626 1 69 LEU HA 1 70 ASP H . . 2.710 2.619 2.376 2.791 0.081 8 0 "[ . 1 . 2]" 1
627 1 69 LEU HB3 1 70 ASP H . . 3.750 3.630 3.302 3.816 0.066 10 0 "[ . 1 . 2]" 1
628 1 69 LEU HB3 1 70 ASP HB3 . . 5.250 6.282 5.314 6.820 1.570 8 18 "[**-****+***** *** **]" 1
629 1 69 LEU HB3 1 72 ILE HB . . 5.500 6.061 5.532 6.546 1.046 6 12 "[* *-+**** ** * *]" 1
630 1 69 LEU HB3 1 72 ILE MD . . 4.490 4.019 3.731 4.469 . 0 0 "[ . 1 . 2]" 1
631 1 69 LEU QD 1 101 GLN QE . . 5.040 3.467 2.459 4.696 . 0 0 "[ . 1 . 2]" 1
632 1 69 LEU MD2 1 70 ASP H . . 3.890 3.720 3.198 3.971 0.081 6 0 "[ . 1 . 2]" 1
633 1 69 LEU MD2 1 101 GLN QE . . 5.000 3.564 2.483 4.814 . 0 0 "[ . 1 . 2]" 1
634 1 69 LEU HG 1 70 ASP H . . 4.480 2.507 1.790 2.930 . 0 0 "[ . 1 . 2]" 1
635 1 69 LEU HG 1 70 ASP HB3 . . 4.560 4.217 3.288 4.650 0.090 8 0 "[ . 1 . 2]" 1
636 1 69 LEU HG 1 72 ILE H . . 5.500 3.627 3.264 4.000 . 0 0 "[ . 1 . 2]" 1
637 1 69 LEU HG 1 72 ILE MD . . 3.400 2.642 2.032 3.241 . 0 0 "[ . 1 . 2]" 1
638 1 69 LEU HG 1 72 ILE MG . . 5.170 4.872 4.287 5.253 0.083 8 0 "[ . 1 . 2]" 1
639 1 70 ASP H 1 70 ASP HB3 . . 3.310 2.879 2.586 3.339 0.029 8 0 "[ . 1 . 2]" 1
640 1 70 ASP H 1 72 ILE MD . . 5.080 2.829 2.315 3.814 . 0 0 "[ . 1 . 2]" 1
641 1 70 ASP HA 1 70 ASP HB3 . . 2.890 2.945 2.781 2.974 0.084 16 0 "[ . 1 . 2]" 1
642 1 70 ASP HA 1 71 ASN H . . 2.640 2.629 2.481 2.711 0.071 19 0 "[ . 1 . 2]" 1
643 1 70 ASP HA 1 72 ILE H . . 4.990 4.953 4.593 5.069 0.079 16 0 "[ . 1 . 2]" 1
644 1 70 ASP HB3 1 71 ASN H . . 2.860 2.731 2.393 2.940 0.080 14 0 "[ . 1 . 2]" 1
645 1 71 ASN H 1 71 ASN HB3 . . 3.130 2.738 2.191 3.268 0.138 16 0 "[ . 1 . 2]" 1
646 1 71 ASN H 1 71 ASN HD21 . . 4.860 4.750 4.549 4.930 0.070 15 0 "[ . 1 . 2]" 1
647 1 71 ASN H 1 72 ILE H . . 3.860 3.834 3.592 3.938 0.078 5 0 "[ . 1 . 2]" 1
648 1 71 ASN H 1 72 ILE HG13 . . 4.500 4.145 3.491 4.563 0.063 8 0 "[ . 1 . 2]" 1
649 1 71 ASN HA 1 71 ASN HD22 . . 5.500 3.718 3.395 4.077 . 0 0 "[ . 1 . 2]" 1
650 1 71 ASN HA 1 72 ILE H . . 2.640 2.217 2.125 2.533 . 0 0 "[ . 1 . 2]" 1
651 1 71 ASN HA 1 72 ILE HB . . 4.960 4.784 4.472 5.021 0.061 12 0 "[ . 1 . 2]" 1
652 1 71 ASN HA 1 72 ILE HG13 . . 4.830 4.262 3.922 4.691 . 0 0 "[ . 1 . 2]" 1
653 1 71 ASN HB3 1 72 ILE H . . 4.830 4.326 4.070 4.359 . 0 0 "[ . 1 . 2]" 1
654 1 71 ASN HD21 1 72 ILE H . . 3.920 3.826 2.892 4.003 0.083 18 0 "[ . 1 . 2]" 1
655 1 72 ILE H 1 72 ILE HB . . 3.170 2.602 2.324 2.856 . 0 0 "[ . 1 . 2]" 1
656 1 72 ILE H 1 72 ILE MD . . 4.290 3.563 2.413 4.193 . 0 0 "[ . 1 . 2]" 1
657 1 72 ILE H 1 72 ILE HG13 . . 3.680 2.578 2.034 2.947 . 0 0 "[ . 1 . 2]" 1
658 1 72 ILE H 1 72 ILE MG . . 4.000 3.875 3.773 4.012 0.012 16 0 "[ . 1 . 2]" 1
659 1 72 ILE H 1 73 ASP H . . 4.600 4.516 4.301 4.656 0.056 6 0 "[ . 1 . 2]" 1
660 1 72 ILE HA 1 72 ILE MD . . 3.850 3.878 3.696 3.953 0.103 4 0 "[ . 1 . 2]" 1
661 1 72 ILE HA 1 72 ILE HG13 . . 3.830 3.054 2.424 3.431 . 0 0 "[ . 1 . 2]" 1
662 1 72 ILE HA 1 72 ILE MG . . 3.160 2.415 2.328 2.536 . 0 0 "[ . 1 . 2]" 1
663 1 72 ILE HA 1 73 ASP H . . 2.690 2.259 2.042 2.557 . 0 0 "[ . 1 . 2]" 1
664 1 72 ILE HA 1 73 ASP HA . . 4.720 4.485 4.392 4.627 . 0 0 "[ . 1 . 2]" 1
665 1 72 ILE HA 1 76 ASN QD . . 5.500 4.872 4.251 5.310 . 0 0 "[ . 1 . 2]" 1
666 1 72 ILE HB 1 73 ASP H . . 4.080 3.928 3.588 4.165 0.085 11 0 "[ . 1 . 2]" 1
667 1 72 ILE HB 1 74 TYR H . . 5.200 5.232 4.694 5.287 0.087 11 0 "[ . 1 . 2]" 1
668 1 72 ILE HB 1 74 TYR QD . . 5.440 4.590 4.066 5.216 . 0 0 "[ . 1 . 2]" 1
669 1 72 ILE HB 1 74 TYR QE . . 4.360 3.509 2.394 4.304 . 0 0 "[ . 1 . 2]" 1
670 1 72 ILE MD 1 72 ILE MG . . 3.330 2.199 2.023 2.752 . 0 0 "[ . 1 . 2]" 1
671 1 72 ILE MD 1 74 TYR QE . . 4.090 3.628 2.785 4.189 0.099 11 0 "[ . 1 . 2]" 1
672 1 72 ILE MG 1 73 ASP H . . 3.430 2.418 2.044 2.901 . 0 0 "[ . 1 . 2]" 1
673 1 72 ILE MG 1 73 ASP HB3 . . 5.500 4.562 4.110 4.975 . 0 0 "[ . 1 . 2]" 1
674 1 72 ILE MG 1 74 TYR H . . 4.080 3.885 3.407 4.155 0.075 4 0 "[ . 1 . 2]" 1
675 1 72 ILE MG 1 74 TYR HA . . 3.920 3.446 2.857 3.830 . 0 0 "[ . 1 . 2]" 1
676 1 72 ILE MG 1 74 TYR QD . . 3.360 3.088 2.577 3.458 0.098 4 0 "[ . 1 . 2]" 1
677 1 72 ILE MG 1 74 TYR QE . . 3.290 3.051 2.168 3.413 0.123 19 0 "[ . 1 . 2]" 1
678 1 73 ASP H 1 73 ASP HB3 . . 3.310 2.928 2.499 3.404 0.094 7 0 "[ . 1 . 2]" 1
679 1 73 ASP H 1 74 TYR H . . 4.660 4.211 3.966 4.449 . 0 0 "[ . 1 . 2]" 1
680 1 73 ASP H 1 76 ASN QD . . 4.850 3.259 2.615 3.773 . 0 0 "[ . 1 . 2]" 1
681 1 73 ASP HA 1 74 TYR H . . 2.980 2.189 2.073 2.339 . 0 0 "[ . 1 . 2]" 1
682 1 73 ASP HA 1 75 ASN H . . 4.360 3.700 3.232 4.100 . 0 0 "[ . 1 . 2]" 1
683 1 73 ASP HB3 1 76 ASN H . . 4.300 3.503 2.259 4.363 0.063 8 0 "[ . 1 . 2]" 1
684 1 73 ASP HB3 1 76 ASN QD . . 3.990 2.345 1.926 3.097 . 0 0 "[ . 1 . 2]" 1
685 1 74 TYR H 1 74 TYR HB3 . . 3.580 3.601 3.528 3.656 0.076 7 0 "[ . 1 . 2]" 1
686 1 74 TYR H 1 74 TYR QD . . 3.150 2.905 2.320 3.249 0.099 6 0 "[ . 1 . 2]" 1
687 1 74 TYR H 1 74 TYR QE . . 4.790 4.236 3.955 4.554 . 0 0 "[ . 1 . 2]" 1
688 1 74 TYR H 1 75 ASN H . . 3.420 2.611 2.309 3.310 . 0 0 "[ . 1 . 2]" 1
689 1 74 TYR H 1 75 ASN QD . . 5.500 4.720 3.255 5.422 . 0 0 "[ . 1 . 2]" 1
690 1 74 TYR H 1 76 ASN H . . 5.190 4.632 4.342 5.204 0.014 8 0 "[ . 1 . 2]" 1
691 1 74 TYR H 1 80 ILE MD . . 5.480 4.959 4.675 5.420 . 0 0 "[ . 1 . 2]" 1
692 1 74 TYR HA 1 74 TYR QD . . 2.900 2.400 2.145 2.867 . 0 0 "[ . 1 . 2]" 1
693 1 74 TYR HA 1 77 TYR H . . 4.780 4.227 3.805 4.671 . 0 0 "[ . 1 . 2]" 1
694 1 74 TYR HA 1 77 TYR QD . . 4.220 2.632 2.144 3.452 . 0 0 "[ . 1 . 2]" 1
695 1 74 TYR HA 1 80 ILE MD . . 3.830 3.057 2.411 3.534 . 0 0 "[ . 1 . 2]" 1
696 1 74 TYR HB3 1 75 ASN H . . 3.990 4.131 3.963 4.474 0.484 6 0 "[ . 1 . 2]" 1
697 1 74 TYR HB3 1 80 ILE MD . . 4.670 2.269 2.056 3.005 . 0 0 "[ . 1 . 2]" 1
698 1 74 TYR QD 1 75 ASN H . . 4.570 4.421 4.055 4.659 0.089 8 0 "[ . 1 . 2]" 1
699 1 74 TYR QD 1 80 ILE MD . . 2.940 2.765 2.275 3.052 0.112 5 0 "[ . 1 . 2]" 1
700 1 74 TYR QD 1 80 ILE MG . . 4.780 3.999 3.260 4.664 . 0 0 "[ . 1 . 2]" 1
701 1 74 TYR QD 1 98 LEU QD . . 5.500 3.795 3.451 4.076 . 0 0 "[ . 1 . 2]" 1
702 1 74 TYR QD 1 101 GLN HB3 . . 5.450 4.578 4.162 5.817 0.367 6 0 "[ . 1 . 2]" 1
703 1 74 TYR QD 1 102 MET ME . . 4.220 3.995 2.880 4.319 0.099 8 0 "[ . 1 . 2]" 1
704 1 74 TYR QD 1 102 MET HG3 . . 4.350 4.270 3.596 4.986 0.636 4 3 "[ +. * 1 - . 2]" 1
705 1 74 TYR QE 1 80 ILE MD . . 4.430 4.309 3.851 4.552 0.122 11 0 "[ . 1 . 2]" 1
706 1 74 TYR QE 1 98 LEU QD . . 2.780 2.587 2.198 2.793 0.013 8 0 "[ . 1 . 2]" 1
707 1 74 TYR QE 1 101 GLN HB3 . . 4.590 2.646 2.226 4.293 . 0 0 "[ . 1 . 2]" 1
708 1 74 TYR QE 1 102 MET H . . 5.500 4.251 3.875 4.799 . 0 0 "[ . 1 . 2]" 1
709 1 74 TYR QE 1 102 MET HA . . 3.720 3.626 3.180 3.789 0.069 13 0 "[ . 1 . 2]" 1
710 1 74 TYR QE 1 102 MET ME . . 5.040 4.835 3.779 5.141 0.101 1 0 "[ . 1 . 2]" 1
711 1 74 TYR QE 1 102 MET HG3 . . 3.620 3.926 3.140 4.950 1.330 4 7 "[* +. **1 **. -2]" 1
712 1 75 ASN H 1 75 ASN HB3 . . 3.560 3.374 2.828 3.633 0.073 4 0 "[ . 1 . 2]" 1
713 1 75 ASN H 1 75 ASN QD . . 5.050 3.222 2.081 4.104 . 0 0 "[ . 1 . 2]" 1
714 1 75 ASN H 1 76 ASN H . . 3.270 2.743 2.075 2.918 . 0 0 "[ . 1 . 2]" 1
715 1 75 ASN H 1 76 ASN HA . . 5.340 5.321 4.803 5.410 0.070 3 0 "[ . 1 . 2]" 1
716 1 75 ASN H 1 77 TYR H . . 5.200 4.475 3.941 4.706 . 0 0 "[ . 1 . 2]" 1
717 1 75 ASN HA 1 77 TYR H . . 3.700 3.703 3.480 3.778 0.078 17 0 "[ . 1 . 2]" 1
718 1 75 ASN HB3 1 76 ASN H . . 4.620 3.502 2.565 4.251 . 0 0 "[ . 1 . 2]" 1
719 1 75 ASN QD 1 105 TYR HA . . 4.590 3.491 2.276 4.268 . 0 0 "[ . 1 . 2]" 1
720 1 75 ASN QD 1 106 ARG HG3 . . 5.500 4.218 2.760 5.176 . 0 0 "[ . 1 . 2]" 1
721 1 76 ASN H 1 76 ASN HB3 . . 3.090 2.996 2.384 3.635 0.545 1 6 "[+* . *1* . -* 2]" 1
722 1 76 ASN H 1 76 ASN QD . . 4.860 2.875 1.967 4.074 . 0 0 "[ . 1 . 2]" 1
723 1 76 ASN H 1 77 TYR QD . . 4.370 3.658 2.762 4.421 0.051 13 0 "[ . 1 . 2]" 1
724 1 76 ASN HB3 1 77 TYR H . . 4.820 4.554 4.151 4.769 . 0 0 "[ . 1 . 2]" 1
725 1 76 ASN QD 1 77 TYR QE . . 4.600 3.271 2.302 4.382 . 0 0 "[ . 1 . 2]" 1
726 1 77 TYR H 1 77 TYR HB3 . . 3.490 3.814 3.605 3.903 0.413 5 0 "[ . 1 . 2]" 1
727 1 77 TYR H 1 77 TYR QD . . 3.680 3.018 2.575 3.743 0.063 6 0 "[ . 1 . 2]" 1
728 1 77 TYR H 1 78 ASP H . . 4.830 4.412 4.172 4.643 . 0 0 "[ . 1 . 2]" 1
729 1 77 TYR H 1 78 ASP HA . . 5.500 4.842 4.610 5.212 . 0 0 "[ . 1 . 2]" 1
730 1 77 TYR H 1 80 ILE MD . . 5.390 4.327 3.439 4.868 . 0 0 "[ . 1 . 2]" 1
731 1 77 TYR HA 1 77 TYR QD . . 4.030 2.889 2.370 3.248 . 0 0 "[ . 1 . 2]" 1
732 1 77 TYR HA 1 78 ASP H . . 3.100 2.354 2.091 2.600 . 0 0 "[ . 1 . 2]" 1
733 1 77 TYR HA 1 78 ASP HB3 . . 4.900 4.844 4.573 5.209 0.309 13 0 "[ . 1 . 2]" 1
734 1 77 TYR HA 1 79 LEU H . . 4.120 3.953 3.474 4.193 0.073 18 0 "[ . 1 . 2]" 1
735 1 77 TYR HB3 1 78 ASP H . . 4.490 2.736 2.313 3.576 . 0 0 "[ . 1 . 2]" 1
736 1 77 TYR HB3 1 79 LEU H . . 4.410 2.793 2.559 3.040 . 0 0 "[ . 1 . 2]" 1
737 1 77 TYR HB3 1 80 ILE MD . . 4.560 4.133 3.523 4.898 0.338 12 0 "[ . 1 . 2]" 1
738 1 77 TYR HB3 1 80 ILE HG13 . . 4.710 3.912 3.103 4.565 . 0 0 "[ . 1 . 2]" 1
739 1 77 TYR QD 1 78 ASP H . . 5.230 3.966 3.292 4.455 . 0 0 "[ . 1 . 2]" 1
740 1 77 TYR QD 1 79 LEU H . . 5.500 4.525 3.735 4.875 . 0 0 "[ . 1 . 2]" 1
741 1 78 ASP H 1 78 ASP HB3 . . 3.720 2.722 2.523 2.923 . 0 0 "[ . 1 . 2]" 1
742 1 78 ASP H 1 79 LEU H . . 3.060 2.127 1.808 2.537 . 0 0 "[ . 1 . 2]" 1
743 1 78 ASP H 1 79 LEU QD . . 5.500 5.048 4.695 5.226 . 0 0 "[ . 1 . 2]" 1
744 1 78 ASP HB3 1 79 LEU H . . 3.890 3.282 2.794 3.665 . 0 0 "[ . 1 . 2]" 1
745 1 78 ASP HB3 1 79 LEU HB3 . . 5.450 4.949 3.648 5.486 0.036 9 0 "[ . 1 . 2]" 1
746 1 79 LEU H 1 79 LEU HB3 . . 3.910 3.106 2.445 3.499 . 0 0 "[ . 1 . 2]" 1
747 1 79 LEU H 1 79 LEU QD . . 4.650 3.835 3.605 4.061 . 0 0 "[ . 1 . 2]" 1
748 1 79 LEU H 1 79 LEU HG . . 5.350 4.558 3.640 4.982 . 0 0 "[ . 1 . 2]" 1
749 1 79 LEU H 1 80 ILE H . . 4.810 4.317 4.125 4.433 . 0 0 "[ . 1 . 2]" 1
750 1 79 LEU HA 1 79 LEU QD . . 3.160 2.188 1.995 2.584 . 0 0 "[ . 1 . 2]" 1
751 1 79 LEU HA 1 80 ILE H . . 3.030 2.276 2.125 2.357 . 0 0 "[ . 1 . 2]" 1
752 1 79 LEU HA 1 108 GLU H . . 3.580 2.428 2.178 2.745 . 0 0 "[ . 1 . 2]" 1
753 1 79 LEU HB3 1 80 ILE H . . 5.060 3.749 3.292 4.453 . 0 0 "[ . 1 . 2]" 1
754 1 79 LEU QD 1 80 ILE H . . 3.320 2.312 1.939 2.924 . 0 0 "[ . 1 . 2]" 1
755 1 79 LEU QD 1 108 GLU H . . 4.070 3.289 2.727 3.758 . 0 0 "[ . 1 . 2]" 1
756 1 79 LEU QD 1 108 GLU HB3 . . 3.530 2.854 2.302 3.470 . 0 0 "[ . 1 . 2]" 1
757 1 79 LEU QD 1 109 VAL HA . . 3.950 3.641 2.989 4.011 0.061 9 0 "[ . 1 . 2]" 1
758 1 79 LEU QD 1 110 ALA H . . 4.100 3.848 3.339 4.158 0.058 11 0 "[ . 1 . 2]" 1
759 1 79 LEU QD 1 110 ALA MB . . 3.950 3.225 2.633 3.751 . 0 0 "[ . 1 . 2]" 1
760 1 79 LEU QD 1 149 TRP HB3 . . 4.280 2.457 2.138 2.777 . 0 0 "[ . 1 . 2]" 1
761 1 79 LEU QD 1 149 TRP HD1 . . 5.500 4.412 3.516 4.818 . 0 0 "[ . 1 . 2]" 1
762 1 79 LEU QD 1 150 SER H . . 4.450 3.855 3.252 4.393 . 0 0 "[ . 1 . 2]" 1
763 1 79 LEU QD 1 150 SER HA . . 3.450 2.537 1.929 3.203 . 0 0 "[ . 1 . 2]" 1
764 1 79 LEU QD 1 151 LYS H . . 5.430 4.733 4.007 5.335 . 0 0 "[ . 1 . 2]" 1
765 1 79 LEU HG 1 80 ILE H . . 4.620 4.373 3.567 4.685 0.065 3 0 "[ . 1 . 2]" 1
766 1 80 ILE H 1 80 ILE HB . . 3.550 2.735 2.564 2.943 . 0 0 "[ . 1 . 2]" 1
767 1 80 ILE H 1 80 ILE MD . . 5.260 4.337 4.187 4.521 . 0 0 "[ . 1 . 2]" 1
768 1 80 ILE H 1 81 LEU H . . 5.180 4.214 3.985 4.476 . 0 0 "[ . 1 . 2]" 1
769 1 80 ILE H 1 102 MET ME . . 5.500 5.048 4.627 5.561 0.061 6 0 "[ . 1 . 2]" 1
770 1 80 ILE H 1 108 GLU H . . 3.690 3.699 3.515 3.771 0.081 7 0 "[ . 1 . 2]" 1
771 1 80 ILE H 1 109 VAL HA . . 3.610 3.010 2.563 3.663 0.053 20 0 "[ . 1 . 2]" 1
772 1 80 ILE H 1 109 VAL MG2 . . 5.040 4.044 3.539 4.748 . 0 0 "[ . 1 . 2]" 1
773 1 80 ILE HA 1 80 ILE MD . . 4.230 3.800 3.713 3.891 . 0 0 "[ . 1 . 2]" 1
774 1 80 ILE HA 1 80 ILE HG13 . . 3.730 3.049 2.897 3.161 . 0 0 "[ . 1 . 2]" 1
775 1 80 ILE HA 1 80 ILE MG . . 3.300 2.444 2.328 2.594 . 0 0 "[ . 1 . 2]" 1
776 1 80 ILE HA 1 81 LEU H . . 2.980 2.129 2.065 2.227 . 0 0 "[ . 1 . 2]" 1
777 1 80 ILE HA 1 102 MET ME . . 5.170 5.124 4.793 5.268 0.098 10 0 "[ . 1 . 2]" 1
778 1 80 ILE HB 1 81 LEU H . . 4.820 4.355 3.992 4.556 . 0 0 "[ . 1 . 2]" 1
779 1 80 ILE HB 1 109 VAL HA . . 4.080 3.284 2.703 3.950 . 0 0 "[ . 1 . 2]" 1
780 1 80 ILE HB 1 110 ALA H . . 5.350 4.589 4.135 5.314 . 0 0 "[ . 1 . 2]" 1
781 1 80 ILE MD 1 80 ILE MG . . 3.290 2.083 2.047 2.144 . 0 0 "[ . 1 . 2]" 1
782 1 80 ILE MD 1 81 LEU H . . 5.500 5.178 4.783 5.476 . 0 0 "[ . 1 . 2]" 1
783 1 80 ILE MD 1 102 MET ME . . 3.180 2.116 1.876 2.414 . 0 0 "[ . 1 . 2]" 1
784 1 80 ILE MD 1 102 MET HG3 . . 5.500 4.926 4.516 5.789 0.289 6 0 "[ . 1 . 2]" 1
785 1 80 ILE MD 1 109 VAL MG2 . . 4.680 3.726 2.979 4.623 . 0 0 "[ . 1 . 2]" 1
786 1 80 ILE HG13 1 80 ILE MG . . 2.810 3.243 3.216 3.308 0.498 6 0 "[ . 1 . 2]" 1
787 1 80 ILE MG 1 81 LEU H . . 3.370 2.885 2.339 3.319 . 0 0 "[ . 1 . 2]" 1
788 1 80 ILE MG 1 82 ILE H . . 5.500 4.649 4.147 5.175 . 0 0 "[ . 1 . 2]" 1
789 1 80 ILE MG 1 82 ILE HG13 . . 4.640 2.833 2.370 3.640 . 0 0 "[ . 1 . 2]" 1
790 1 80 ILE MG 1 102 MET ME . . 3.160 2.369 2.066 3.084 . 0 0 "[ . 1 . 2]" 1
791 1 80 ILE MG 1 109 VAL HA . . 4.860 4.127 3.350 4.691 . 0 0 "[ . 1 . 2]" 1
792 1 80 ILE MG 1 109 VAL MG1 . . 4.060 3.217 2.352 4.179 0.119 20 0 "[ . 1 . 2]" 1
793 1 81 LEU H 1 81 LEU HB3 . . 3.960 3.615 3.428 3.797 . 0 0 "[ . 1 . 2]" 1
794 1 81 LEU H 1 81 LEU QD . . 3.920 3.014 2.381 3.477 . 0 0 "[ . 1 . 2]" 1
795 1 81 LEU H 1 81 LEU HG . . 4.230 3.493 2.491 4.311 0.081 7 0 "[ . 1 . 2]" 1
796 1 81 LEU H 1 82 ILE H . . 4.820 4.494 4.367 4.573 . 0 0 "[ . 1 . 2]" 1
797 1 81 LEU HA 1 81 LEU QD . . 3.290 2.116 1.906 2.350 . 0 0 "[ . 1 . 2]" 1
798 1 81 LEU HA 1 81 LEU HG . . 4.020 3.381 2.726 3.789 . 0 0 "[ . 1 . 2]" 1
799 1 81 LEU HA 1 82 ILE H . . 2.920 2.247 2.144 2.427 . 0 0 "[ . 1 . 2]" 1
800 1 81 LEU HA 1 82 ILE MD . . 4.940 4.615 4.015 4.968 0.028 13 0 "[ . 1 . 2]" 1
801 1 81 LEU HA 1 82 ILE MG . . 5.320 5.320 5.072 5.409 0.089 13 0 "[ . 1 . 2]" 1
802 1 81 LEU HA 1 109 VAL MG1 . . 4.990 4.207 3.643 4.775 . 0 0 "[ . 1 . 2]" 1
803 1 81 LEU HA 1 110 ALA H . . 3.650 2.934 2.669 3.277 . 0 0 "[ . 1 . 2]" 1
804 1 81 LEU HA 1 110 ALA MB . . 4.270 3.293 2.878 4.001 . 0 0 "[ . 1 . 2]" 1
805 1 81 LEU HA 1 111 SER HA . . 4.610 3.983 3.360 4.406 . 0 0 "[ . 1 . 2]" 1
806 1 81 LEU HB3 1 81 LEU QD . . 3.240 2.219 2.097 2.467 . 0 0 "[ . 1 . 2]" 1
807 1 81 LEU HB3 1 82 ILE H . . 4.370 2.963 2.664 3.296 . 0 0 "[ . 1 . 2]" 1
808 1 81 LEU HB3 1 112 PHE QD . . 4.350 2.703 2.505 2.830 . 0 0 "[ . 1 . 2]" 1
809 1 81 LEU HB3 1 112 PHE QE . . 3.760 2.453 2.110 2.897 . 0 0 "[ . 1 . 2]" 1
810 1 81 LEU QD 1 110 ALA H . . 3.910 2.994 2.122 3.616 . 0 0 "[ . 1 . 2]" 1
811 1 81 LEU QD 1 110 ALA MB . . 3.200 1.976 1.841 2.175 . 0 0 "[ . 1 . 2]" 1
812 1 81 LEU QD 1 111 SER HA . . 4.680 4.054 3.000 4.636 . 0 0 "[ . 1 . 2]" 1
813 1 81 LEU QD 1 112 PHE QE . . 5.500 3.603 3.088 4.031 . 0 0 "[ . 1 . 2]" 1
814 1 81 LEU QD 1 149 TRP HB3 . . 4.200 2.769 2.151 3.835 . 0 0 "[ . 1 . 2]" 1
815 1 81 LEU QD 1 149 TRP HE3 . . 3.730 2.386 2.082 3.170 . 0 0 "[ . 1 . 2]" 1
816 1 81 LEU QD 1 149 TRP HZ3 . . 4.500 3.179 2.395 4.159 . 0 0 "[ . 1 . 2]" 1
817 1 81 LEU HG 1 110 ALA MB . . 4.610 4.255 3.297 4.701 0.091 2 0 "[ . 1 . 2]" 1
818 1 82 ILE H 1 82 ILE HB . . 3.370 2.713 2.466 3.006 . 0 0 "[ . 1 . 2]" 1
819 1 82 ILE H 1 82 ILE MD . . 4.250 4.038 3.331 4.195 . 0 0 "[ . 1 . 2]" 1
820 1 82 ILE H 1 82 ILE HG13 . . 4.560 2.817 2.592 3.088 . 0 0 "[ . 1 . 2]" 1
821 1 82 ILE H 1 82 ILE MG . . 4.270 3.871 3.766 3.965 . 0 0 "[ . 1 . 2]" 1
822 1 82 ILE H 1 83 GLY H . . 5.500 4.378 4.211 4.506 . 0 0 "[ . 1 . 2]" 1
823 1 82 ILE H 1 110 ALA MB . . 5.500 4.287 4.063 4.626 . 0 0 "[ . 1 . 2]" 1
824 1 82 ILE H 1 111 SER H . . 5.500 4.688 4.458 4.960 . 0 0 "[ . 1 . 2]" 1
825 1 82 ILE H 1 111 SER HA . . 3.460 2.395 2.007 2.714 . 0 0 "[ . 1 . 2]" 1
826 1 82 ILE H 1 111 SER HB3 . . 4.890 4.993 3.987 5.668 0.778 17 5 "[ **. 1 - + *2]" 1
827 1 82 ILE H 1 112 PHE H . . 4.390 3.434 2.978 3.776 . 0 0 "[ . 1 . 2]" 1
828 1 82 ILE H 1 112 PHE QD . . 5.230 2.808 2.446 3.140 . 0 0 "[ . 1 . 2]" 1
829 1 82 ILE H 1 112 PHE QE . . 5.340 3.371 2.883 3.834 . 0 0 "[ . 1 . 2]" 1
830 1 82 ILE HA 1 82 ILE MD . . 4.200 3.977 3.819 4.102 . 0 0 "[ . 1 . 2]" 1
831 1 82 ILE HA 1 82 ILE HG13 . . 3.880 3.273 3.074 3.505 . 0 0 "[ . 1 . 2]" 1
832 1 82 ILE HA 1 82 ILE MG . . 3.420 2.328 2.159 2.565 . 0 0 "[ . 1 . 2]" 1
833 1 82 ILE HA 1 83 GLY H . . 3.120 2.332 2.159 2.567 . 0 0 "[ . 1 . 2]" 1
834 1 82 ILE HA 1 83 GLY HA3 . . 4.650 4.490 4.336 4.627 . 0 0 "[ . 1 . 2]" 1
835 1 82 ILE HA 1 95 ILE MG . . 5.360 5.025 4.586 5.410 0.050 10 0 "[ . 1 . 2]" 1
836 1 82 ILE HB 1 83 GLY H . . 5.490 4.184 3.831 4.459 . 0 0 "[ . 1 . 2]" 1
837 1 82 ILE HB 1 111 SER HA . . 4.150 2.826 2.092 3.691 . 0 0 "[ . 1 . 2]" 1
838 1 82 ILE HB 1 111 SER HB3 . . 4.810 4.114 2.462 4.981 0.171 20 0 "[ . 1 . 2]" 1
839 1 82 ILE HB 1 112 PHE H . . 4.880 4.182 3.819 4.685 . 0 0 "[ . 1 . 2]" 1
840 1 82 ILE MD 1 95 ILE MG . . 3.460 2.496 2.054 3.324 . 0 0 "[ . 1 . 2]" 1
841 1 82 ILE MD 1 99 LEU HA . . 5.040 4.615 4.029 5.123 0.083 15 0 "[ . 1 . 2]" 1
842 1 82 ILE MD 1 99 LEU QD . . 4.490 2.600 2.102 3.505 . 0 0 "[ . 1 . 2]" 1
843 1 82 ILE MD 1 127 PHE QE . . 3.480 3.386 2.572 3.617 0.137 2 0 "[ . 1 . 2]" 1
844 1 82 ILE MG 1 83 GLY H . . 3.880 2.712 2.311 3.176 . 0 0 "[ . 1 . 2]" 1
845 1 82 ILE MG 1 83 GLY HA2 . . 5.500 3.818 3.444 4.312 . 0 0 "[ . 1 . 2]" 1
846 1 82 ILE MG 1 84 SER H . . 5.500 4.823 4.287 5.365 . 0 0 "[ . 1 . 2]" 1
847 1 82 ILE MG 1 95 ILE MG . . 3.190 2.023 1.850 2.445 . 0 0 "[ . 1 . 2]" 1
848 1 82 ILE MG 1 111 SER HA . . 4.960 4.175 3.507 4.924 . 0 0 "[ . 1 . 2]" 1
849 1 82 ILE MG 1 111 SER HB3 . . 4.660 4.940 3.546 5.952 1.292 13 7 "[ * *- + * * *]" 1
850 1 83 GLY H 1 84 SER H . . 4.970 4.507 4.391 4.632 . 0 0 "[ . 1 . 2]" 1
851 1 83 GLY H 1 95 ILE MD . . 5.310 3.784 3.211 4.194 . 0 0 "[ . 1 . 2]" 1
852 1 83 GLY H 1 112 PHE QE . . 5.060 3.694 2.885 4.929 . 0 0 "[ . 1 . 2]" 1
853 1 83 GLY HA2 1 84 SER H . . 3.160 2.287 2.165 2.405 . 0 0 "[ . 1 . 2]" 1
854 1 83 GLY HA2 1 111 SER HA . . 4.630 4.411 4.092 4.691 0.061 18 0 "[ . 1 . 2]" 1
855 1 83 GLY HA2 1 112 PHE H . . 4.640 2.960 2.556 3.351 . 0 0 "[ . 1 . 2]" 1
856 1 83 GLY HA2 1 112 PHE QD . . 5.370 3.843 3.157 4.487 . 0 0 "[ . 1 . 2]" 1
857 1 83 GLY HA2 1 112 PHE QE . . 5.090 4.132 3.359 5.166 0.076 12 0 "[ . 1 . 2]" 1
858 1 83 GLY HA2 1 113 PHE HA . . 4.730 3.914 3.309 4.408 . 0 0 "[ . 1 . 2]" 1
859 1 83 GLY HA3 1 112 PHE H . . 4.560 4.146 3.297 4.637 0.077 1 0 "[ . 1 . 2]" 1
860 1 83 GLY HA3 1 112 PHE QE . . 4.430 3.410 2.765 4.370 . 0 0 "[ . 1 . 2]" 1
861 1 84 SER H 1 112 PHE H . . 5.120 4.711 4.074 5.191 0.071 2 0 "[ . 1 . 2]" 1
862 1 84 SER H 1 113 PHE HA . . 3.820 2.903 2.202 3.499 . 0 0 "[ . 1 . 2]" 1
863 1 84 SER H 1 113 PHE HB3 . . 5.140 3.948 3.146 4.833 . 0 0 "[ . 1 . 2]" 1
864 1 84 SER H 1 114 THR MG . . 5.500 4.660 3.563 5.583 0.083 7 0 "[ . 1 . 2]" 1
865 1 84 SER HA 1 85 PRO HD3 . . 3.700 2.457 2.261 2.666 . 0 0 "[ . 1 . 2]" 1
866 1 84 SER HA 1 92 ALA MB . . 5.020 4.959 4.583 5.129 0.109 16 0 "[ . 1 . 2]" 1
867 1 84 SER HA 1 95 ILE MD . . 4.350 3.948 3.571 4.438 0.088 1 0 "[ . 1 . 2]" 1
868 1 84 SER HB3 1 95 ILE HG13 . . 5.100 3.592 2.687 4.906 . 0 0 "[ . 1 . 2]" 1
869 1 84 SER HB3 1 123 TYR QE . . 4.400 4.115 2.436 5.664 1.264 18 4 "[ . *1- * . + 2]" 1
870 1 85 PRO HA 1 86 VAL H . . 3.440 2.495 2.378 2.590 . 0 0 "[ . 1 . 2]" 1
871 1 85 PRO HA 1 86 VAL HA . . 4.860 4.611 4.515 4.685 . 0 0 "[ . 1 . 2]" 1
872 1 85 PRO HA 1 86 VAL QG . . 4.820 3.578 3.079 4.220 . 0 0 "[ . 1 . 2]" 1
873 1 85 PRO HA 1 114 THR H . . 4.000 3.505 2.432 4.056 0.056 11 0 "[ . 1 . 2]" 1
874 1 85 PRO HD3 1 92 ALA MB . . 4.730 4.456 3.716 4.820 0.090 16 0 "[ . 1 . 2]" 1
875 1 86 VAL H 1 86 VAL HB . . 3.610 3.314 3.043 3.519 . 0 0 "[ . 1 . 2]" 1
876 1 86 VAL H 1 86 VAL QG . . 3.730 2.734 2.633 2.860 . 0 0 "[ . 1 . 2]" 1
877 1 86 VAL H 1 87 TRP H . . 5.280 4.112 3.789 4.330 . 0 0 "[ . 1 . 2]" 1
878 1 86 VAL H 1 115 SER HB3 . . 3.950 2.569 2.046 3.424 . 0 0 "[ . 1 . 2]" 1
879 1 86 VAL HA 1 87 TRP H . . 3.110 2.271 2.117 2.412 . 0 0 "[ . 1 . 2]" 1
880 1 86 VAL HA 1 87 TRP HA . . 4.900 4.462 4.371 4.548 . 0 0 "[ . 1 . 2]" 1
881 1 86 VAL HA 1 90 TYR H . . 5.500 5.466 5.167 5.577 0.077 5 0 "[ . 1 . 2]" 1
882 1 86 VAL HA 1 123 TYR QD . . 4.290 4.261 3.902 4.380 0.090 19 0 "[ . 1 . 2]" 1
883 1 86 VAL HA 1 123 TYR QR . . 4.030 3.922 3.610 4.111 0.081 11 0 "[ . 1 . 2]" 1
884 1 86 VAL HB 1 115 SER HB3 . . 3.920 4.421 3.714 4.751 0.831 11 11 "[* **-* *+***.* 2]" 1
885 1 86 VAL QG 1 87 TRP H . . 3.840 2.565 2.037 3.007 . 0 0 "[ . 1 . 2]" 1
886 1 86 VAL QG 1 87 TRP HA . . 5.370 3.312 2.924 3.738 . 0 0 "[ . 1 . 2]" 1
887 1 86 VAL QG 1 87 TRP HB3 . . 5.500 4.803 4.557 5.142 . 0 0 "[ . 1 . 2]" 1
888 1 86 VAL QG 1 88 SER H . . 5.390 3.250 2.824 3.575 . 0 0 "[ . 1 . 2]" 1
889 1 86 VAL QG 1 88 SER HA . . 4.920 4.556 4.094 4.863 . 0 0 "[ . 1 . 2]" 1
890 1 86 VAL QG 1 89 GLY H . . 3.200 2.733 2.064 3.257 0.057 17 0 "[ . 1 . 2]" 1
891 1 86 VAL QG 1 89 GLY HA2 . . 3.610 3.184 2.391 3.647 0.037 9 0 "[ . 1 . 2]" 1
892 1 86 VAL QG 1 89 GLY HA3 . . 4.410 4.161 3.638 4.438 0.028 15 0 "[ . 1 . 2]" 1
893 1 86 VAL QG 1 90 TYR H . . 4.230 3.923 3.566 4.278 0.048 3 0 "[ . 1 . 2]" 1
894 1 86 VAL QG 1 113 PHE HA . . 5.340 4.467 3.654 5.276 . 0 0 "[ . 1 . 2]" 1
895 1 86 VAL QG 1 113 PHE HB3 . . 4.330 3.363 2.483 4.258 . 0 0 "[ . 1 . 2]" 1
896 1 86 VAL QG 1 113 PHE QD . . 3.430 2.718 2.064 3.268 . 0 0 "[ . 1 . 2]" 1
897 1 86 VAL QG 1 113 PHE QE . . 5.080 3.666 2.387 4.420 . 0 0 "[ . 1 . 2]" 1
898 1 86 VAL QG 1 114 THR H . . 4.900 4.239 3.485 4.899 . 0 0 "[ . 1 . 2]" 1
899 1 86 VAL QG 1 115 SER H . . 5.500 3.365 2.885 4.066 . 0 0 "[ . 1 . 2]" 1
900 1 86 VAL QG 1 115 SER HB3 . . 4.000 3.170 1.964 4.349 0.349 8 0 "[ . 1 . 2]" 1
901 1 86 VAL QG 1 116 ALA HA . . 4.660 3.656 2.540 4.166 . 0 0 "[ . 1 . 2]" 1
902 1 86 VAL QG 1 116 ALA MB . . 4.770 4.344 3.635 4.795 0.025 14 0 "[ . 1 . 2]" 1
903 1 86 VAL QG 1 119 ASN HB3 . . 5.150 2.466 2.113 3.064 . 0 0 "[ . 1 . 2]" 1
904 1 86 VAL QG 1 119 ASN HD22 . . 5.500 4.624 3.921 5.489 . 0 0 "[ . 1 . 2]" 1
905 1 86 VAL QG 1 123 TYR H . . 5.340 3.711 3.155 4.370 . 0 0 "[ . 1 . 2]" 1
906 1 86 VAL QG 1 123 TYR HA . . 5.190 3.535 2.986 4.228 . 0 0 "[ . 1 . 2]" 1
907 1 86 VAL QG 1 123 TYR HB3 . . 5.480 3.325 3.030 3.841 . 0 0 "[ . 1 . 2]" 1
908 1 86 VAL QG 1 123 TYR QD . . 3.430 2.095 1.897 2.305 . 0 0 "[ . 1 . 2]" 1
909 1 86 VAL QG 1 123 TYR QR . . 3.580 2.050 1.838 2.280 . 0 0 "[ . 1 . 2]" 1
910 1 86 VAL QG 1 123 TYR QE . . 4.790 3.114 2.172 3.594 . 0 0 "[ . 1 . 2]" 1
911 1 87 TRP H 1 87 TRP HB3 . . 4.210 3.143 2.758 3.826 . 0 0 "[ . 1 . 2]" 1
912 1 87 TRP H 1 88 SER H . . 5.500 1.870 1.743 2.047 . 0 0 "[ . 1 . 2]" 1
913 1 87 TRP H 1 89 GLY H . . 5.500 3.665 3.083 4.797 . 0 0 "[ . 1 . 2]" 1
914 1 87 TRP H 1 90 TYR H . . 4.910 4.768 4.471 4.986 0.076 16 0 "[ . 1 . 2]" 1
915 1 87 TRP H 1 91 PRO HA . . 5.500 5.313 4.541 5.591 0.091 17 0 "[ . 1 . 2]" 1
916 1 87 TRP H 1 91 PRO HD3 . . 5.500 2.481 2.046 2.939 . 0 0 "[ . 1 . 2]" 1
917 1 87 TRP H 1 123 TYR QR . . 5.350 5.310 4.854 5.466 0.116 3 0 "[ . 1 . 2]" 1
918 1 87 TRP HA 1 88 SER H . . 3.300 3.373 3.296 3.393 0.093 16 0 "[ . 1 . 2]" 1
919 1 87 TRP HA 1 88 SER HA . . 4.310 4.387 4.354 4.405 0.095 8 0 "[ . 1 . 2]" 1
920 1 87 TRP HA 1 89 GLY H . . 5.040 4.329 3.798 5.068 0.028 16 0 "[ . 1 . 2]" 1
921 1 87 TRP HB3 1 88 SER H . . 5.060 3.240 2.502 4.192 . 0 0 "[ . 1 . 2]" 1
922 1 88 SER H 1 89 GLY H . . 4.020 2.794 1.953 3.550 . 0 0 "[ . 1 . 2]" 1
923 1 88 SER H 1 90 TYR H . . 5.420 3.874 3.438 4.335 . 0 0 "[ . 1 . 2]" 1
924 1 88 SER HA 1 89 GLY H . . 3.390 2.683 2.154 3.180 . 0 0 "[ . 1 . 2]" 1
925 1 88 SER HA 1 119 ASN HD21 . . 5.500 5.114 4.210 5.584 0.084 19 0 "[ . 1 . 2]" 1
926 1 88 SER HA 1 119 ASN HD22 . . 4.630 4.278 3.583 4.701 0.071 2 0 "[ . 1 . 2]" 1
927 1 89 GLY H 1 90 TYR H . . 3.630 3.554 3.307 3.710 0.080 12 0 "[ . 1 . 2]" 1
928 1 89 GLY H 1 91 PRO HD3 . . 5.500 3.601 2.969 4.165 . 0 0 "[ . 1 . 2]" 1
929 1 89 GLY H 1 119 ASN HA . . 5.030 4.982 4.406 5.112 0.082 4 0 "[ . 1 . 2]" 1
930 1 89 GLY H 1 122 ALA MB . . 5.500 4.071 3.591 4.694 . 0 0 "[ . 1 . 2]" 1
931 1 89 GLY HA2 1 90 TYR QD . . 5.500 4.844 4.105 5.107 . 0 0 "[ . 1 . 2]" 1
932 1 89 GLY HA2 1 119 ASN HB3 . . 5.130 3.593 2.283 4.784 . 0 0 "[ . 1 . 2]" 1
933 1 89 GLY HA2 1 122 ALA MB . . 3.630 2.501 2.089 2.915 . 0 0 "[ . 1 . 2]" 1
934 1 89 GLY HA3 1 119 ASN HD21 . . 5.440 4.397 3.216 5.385 . 0 0 "[ . 1 . 2]" 1
935 1 89 GLY HA3 1 122 ALA MB . . 3.560 3.314 2.751 3.666 0.106 16 0 "[ . 1 . 2]" 1
936 1 90 TYR H 1 90 TYR QD . . 3.700 2.217 1.941 2.670 . 0 0 "[ . 1 . 2]" 1
937 1 90 TYR H 1 90 TYR QE . . 5.060 4.091 3.778 4.751 . 0 0 "[ . 1 . 2]" 1
938 1 90 TYR H 1 91 PRO HD3 . . 5.500 2.728 2.181 3.435 . 0 0 "[ . 1 . 2]" 1
939 1 90 TYR QD 1 91 PRO HD3 . . 5.010 4.499 3.892 5.251 0.241 6 0 "[ . 1 . 2]" 1
940 1 90 TYR QD 1 126 HIS HA . . 3.870 3.803 3.351 3.971 0.101 7 0 "[ . 1 . 2]" 1
941 1 90 TYR QD 1 126 HIS HB3 . . 4.120 2.439 2.082 4.273 0.153 3 0 "[ . 1 . 2]" 1
942 1 90 TYR QD 1 130 TRP HE1 . . 5.170 4.332 3.465 4.969 . 0 0 "[ . 1 . 2]" 1
943 1 90 TYR QD 1 130 TRP HH2 . . 4.620 3.699 3.110 4.677 0.057 17 0 "[ . 1 . 2]" 1
944 1 90 TYR QD 1 130 TRP HZ2 . . 3.920 3.424 2.916 3.969 0.049 2 0 "[ . 1 . 2]" 1
945 1 90 TYR QE 1 126 HIS HA . . 4.270 3.852 2.257 4.363 0.093 18 0 "[ . 1 . 2]" 1
946 1 90 TYR QE 1 126 HIS HB3 . . 4.030 3.755 2.471 5.504 1.474 17 1 "[ . 1 . + 2]" 1
947 1 90 TYR QE 1 126 HIS HD2 . . 4.870 3.950 2.693 4.959 0.089 12 0 "[ . 1 . 2]" 1
948 1 90 TYR QE 1 130 TRP HE1 . . 4.660 4.253 3.166 4.750 0.090 3 0 "[ . 1 . 2]" 1
949 1 90 TYR QE 1 130 TRP HZ2 . . 4.560 3.977 3.452 4.626 0.066 3 0 "[ . 1 . 2]" 1
950 1 91 PRO HA 1 92 ALA MB . . 5.060 4.710 4.439 5.006 . 0 0 "[ . 1 . 2]" 1
951 1 92 ALA H 1 92 ALA MB . . 3.430 2.550 2.166 2.878 . 0 0 "[ . 1 . 2]" 1
952 1 92 ALA H 1 94 PRO HD3 . . 4.420 5.094 4.772 5.427 1.007 19 17 "[** ********* **- *+*]" 1
953 1 92 ALA HA 1 93 THR H . . 3.570 2.456 2.320 2.639 . 0 0 "[ . 1 . 2]" 1
954 1 92 ALA MB 1 93 THR H . . 3.440 2.715 2.546 2.935 . 0 0 "[ . 1 . 2]" 1
955 1 92 ALA MB 1 93 THR MG . . 4.660 4.394 4.211 4.565 . 0 0 "[ . 1 . 2]" 1
956 1 92 ALA MB 1 94 PRO HD3 . . 3.590 2.047 1.923 2.178 . 0 0 "[ . 1 . 2]" 1
957 1 92 ALA MB 1 95 ILE H . . 4.620 4.547 4.251 4.716 0.096 13 0 "[ . 1 . 2]" 1
958 1 92 ALA MB 1 95 ILE MD . . 4.770 4.859 4.549 4.908 0.138 15 0 "[ . 1 . 2]" 1
959 1 92 ALA MB 1 95 ILE HG13 . . 5.140 5.837 5.133 6.242 1.102 13 18 "[****.* *****+*****-*]" 1
960 1 93 THR H 1 93 THR MG . . 4.120 3.314 3.021 3.628 . 0 0 "[ . 1 . 2]" 1
961 1 93 THR H 1 94 PRO HD3 . . 4.340 2.284 2.166 2.533 . 0 0 "[ . 1 . 2]" 1
962 1 93 THR HB 1 96 LYS H . . 4.710 4.666 3.591 4.797 0.087 10 0 "[ . 1 . 2]" 1
963 1 94 PRO HA 1 95 ILE MD . . 4.270 4.160 4.004 4.341 0.071 7 0 "[ . 1 . 2]" 1
964 1 94 PRO HA 1 96 LYS H . . 5.000 3.867 3.573 4.151 . 0 0 "[ . 1 . 2]" 1
965 1 94 PRO HA 1 97 THR H . . 4.530 4.565 4.336 4.624 0.094 16 0 "[ . 1 . 2]" 1
966 1 94 PRO HD3 1 95 ILE H . . 4.590 3.889 3.632 4.047 . 0 0 "[ . 1 . 2]" 1
967 1 94 PRO HD3 1 95 ILE HG13 . . 5.350 6.534 6.079 6.753 1.403 16 20 [******-********+****] 1
968 1 95 ILE H 1 95 ILE HB . . 3.490 2.827 2.584 3.040 . 0 0 "[ . 1 . 2]" 1
969 1 95 ILE H 1 95 ILE MD . . 4.010 2.963 2.506 3.393 . 0 0 "[ . 1 . 2]" 1
970 1 95 ILE H 1 95 ILE HG13 . . 4.180 3.849 3.502 4.066 . 0 0 "[ . 1 . 2]" 1
971 1 95 ILE H 1 95 ILE MG . . 4.120 3.854 3.754 3.973 . 0 0 "[ . 1 . 2]" 1
972 1 95 ILE H 1 96 LYS H . . 3.600 3.106 2.395 3.551 . 0 0 "[ . 1 . 2]" 1
973 1 95 ILE H 1 97 THR H . . 5.500 5.202 4.856 5.562 0.062 6 0 "[ . 1 . 2]" 1
974 1 95 ILE HA 1 95 ILE MD . . 3.120 2.607 2.410 2.779 . 0 0 "[ . 1 . 2]" 1
975 1 95 ILE HA 1 95 ILE MG . . 3.410 2.205 2.024 2.313 . 0 0 "[ . 1 . 2]" 1
976 1 95 ILE HA 1 97 THR H . . 5.410 4.562 4.146 4.865 . 0 0 "[ . 1 . 2]" 1
977 1 95 ILE HA 1 98 LEU H . . 4.080 3.795 3.373 4.099 0.019 6 0 "[ . 1 . 2]" 1
978 1 95 ILE HA 1 98 LEU HB3 . . 3.380 3.504 3.059 4.325 0.945 16 3 "[ . *1 .+ -]" 1
979 1 95 ILE HA 1 99 LEU H . . 4.540 4.067 3.669 4.332 . 0 0 "[ . 1 . 2]" 1
980 1 95 ILE HB 1 96 LYS H . . 4.210 4.208 3.348 4.302 0.092 3 0 "[ . 1 . 2]" 1
981 1 95 ILE HB 1 127 PHE QE . . 3.860 3.758 3.195 3.959 0.099 1 0 "[ . 1 . 2]" 1
982 1 95 ILE MD 1 95 ILE MG . . 3.600 2.229 2.049 2.390 . 0 0 "[ . 1 . 2]" 1
983 1 95 ILE MG 1 96 LYS H . . 5.320 4.032 3.767 4.283 . 0 0 "[ . 1 . 2]" 1
984 1 95 ILE MG 1 96 LYS HA . . 5.200 4.253 4.083 4.433 . 0 0 "[ . 1 . 2]" 1
985 1 95 ILE MG 1 98 LEU H . . 5.080 4.835 4.175 5.169 0.089 5 0 "[ . 1 . 2]" 1
986 1 95 ILE MG 1 98 LEU HB3 . . 4.000 3.572 2.757 4.069 0.069 5 0 "[ . 1 . 2]" 1
987 1 95 ILE MG 1 99 LEU H . . 4.620 3.924 3.039 4.370 . 0 0 "[ . 1 . 2]" 1
988 1 95 ILE MG 1 99 LEU QD . . 3.550 2.073 1.835 2.378 . 0 0 "[ . 1 . 2]" 1
989 1 95 ILE MG 1 99 LEU HG . . 3.870 3.220 2.087 3.988 0.118 9 0 "[ . 1 . 2]" 1
990 1 95 ILE MG 1 127 PHE QE . . 3.420 2.265 1.986 3.386 . 0 0 "[ . 1 . 2]" 1
991 1 96 LYS H 1 96 LYS HB3 . . 3.490 3.298 2.419 3.565 0.075 16 0 "[ . 1 . 2]" 1
992 1 96 LYS H 1 96 LYS HG3 . . 4.980 4.782 4.295 5.269 0.289 8 0 "[ . 1 . 2]" 1
993 1 96 LYS H 1 97 THR H . . 3.490 2.380 1.967 3.138 . 0 0 "[ . 1 . 2]" 1
994 1 96 LYS H 1 97 THR HB . . 5.270 4.376 4.043 5.328 0.058 1 0 "[ . 1 . 2]" 1
995 1 96 LYS H 1 98 LEU H . . 4.950 3.291 2.556 4.363 . 0 0 "[ . 1 . 2]" 1
996 1 96 LYS H 1 99 LEU QD . . 5.500 3.891 3.038 4.783 . 0 0 "[ . 1 . 2]" 1
997 1 96 LYS HA 1 96 LYS HD3 . . 4.610 2.257 2.079 2.555 . 0 0 "[ . 1 . 2]" 1
998 1 96 LYS HA 1 96 LYS HG3 . . 4.180 3.520 3.148 3.650 . 0 0 "[ . 1 . 2]" 1
999 1 96 LYS HA 1 98 LEU H . . 5.300 4.712 4.438 5.094 . 0 0 "[ . 1 . 2]" 1
1000 1 96 LYS HA 1 99 LEU H . . 4.280 4.020 3.709 4.359 0.079 7 0 "[ . 1 . 2]" 1
1001 1 96 LYS HA 1 99 LEU HB3 . . 3.750 4.783 4.069 4.929 1.179 3 19 "[**+************** -*]" 1
1002 1 96 LYS HA 1 99 LEU QD . . 4.060 2.532 1.960 3.643 . 0 0 "[ . 1 . 2]" 1
1003 1 96 LYS HA 1 100 ASP H . . 4.910 4.837 4.171 4.988 0.078 10 0 "[ . 1 . 2]" 1
1004 1 96 LYS HB3 1 97 THR H . . 4.090 2.639 2.238 2.975 . 0 0 "[ . 1 . 2]" 1
1005 1 96 LYS HD3 1 97 THR HA . . 5.350 5.189 4.126 5.480 0.130 19 0 "[ . 1 . 2]" 1
1006 1 96 LYS HD3 1 130 TRP HA . . 5.500 4.290 3.889 4.705 . 0 0 "[ . 1 . 2]" 1
1007 1 96 LYS HE3 1 130 TRP HA . . 4.870 4.090 3.043 4.946 0.076 20 0 "[ . 1 . 2]" 1
1008 1 96 LYS HE3 1 130 TRP HE1 . . 5.300 4.881 4.056 5.366 0.066 17 0 "[ . 1 . 2]" 1
1009 1 96 LYS HG3 1 97 THR H . . 5.170 4.642 2.948 5.220 0.050 5 0 "[ . 1 . 2]" 1
1010 1 97 THR H 1 97 THR HB . . 3.460 2.594 2.290 3.469 0.009 19 0 "[ . 1 . 2]" 1
1011 1 97 THR H 1 97 THR MG . . 4.150 3.642 3.151 3.809 . 0 0 "[ . 1 . 2]" 1
1012 1 97 THR H 1 98 LEU H . . 3.590 2.850 2.545 3.136 . 0 0 "[ . 1 . 2]" 1
1013 1 97 THR H 1 98 LEU HB3 . . 5.500 5.380 4.889 6.019 0.519 20 1 "[ . 1 . +]" 1
1014 1 97 THR H 1 99 LEU H . . 5.400 4.589 4.270 4.961 . 0 0 "[ . 1 . 2]" 1
1015 1 97 THR H 1 99 LEU HB3 . . 5.500 7.075 6.346 7.294 1.794 15 20 [**************+**-**] 1
1016 1 97 THR H 1 100 ASP H . . 5.500 5.157 4.724 5.423 . 0 0 "[ . 1 . 2]" 1
1017 1 97 THR HA 1 97 THR MG . . 3.080 2.399 2.272 2.628 . 0 0 "[ . 1 . 2]" 1
1018 1 97 THR HA 1 99 LEU H . . 5.500 4.608 4.299 4.906 . 0 0 "[ . 1 . 2]" 1
1019 1 97 THR HA 1 100 ASP H . . 4.020 3.561 3.152 3.886 . 0 0 "[ . 1 . 2]" 1
1020 1 97 THR HA 1 100 ASP HB3 . . 3.860 3.394 2.394 3.927 0.067 4 0 "[ . 1 . 2]" 1
1021 1 97 THR HA 1 101 GLN H . . 5.010 4.853 4.370 5.094 0.084 9 0 "[ . 1 . 2]" 1
1022 1 97 THR HB 1 98 LEU H . . 3.490 2.663 2.429 3.044 . 0 0 "[ . 1 . 2]" 1
1023 1 97 THR MG 1 98 LEU H . . 4.420 3.679 3.089 4.042 . 0 0 "[ . 1 . 2]" 1
1024 1 97 THR MG 1 98 LEU HA . . 4.380 3.867 3.101 4.482 0.102 19 0 "[ . 1 . 2]" 1
1025 1 97 THR MG 1 100 ASP H . . 5.180 4.684 4.234 5.261 0.081 19 0 "[ . 1 . 2]" 1
1026 1 97 THR MG 1 100 ASP HB3 . . 5.160 3.924 3.048 4.470 . 0 0 "[ . 1 . 2]" 1
1027 1 97 THR MG 1 101 GLN H . . 5.500 4.668 4.085 5.382 . 0 0 "[ . 1 . 2]" 1
1028 1 97 THR MG 1 101 GLN QE . . 4.010 2.707 2.023 3.632 . 0 0 "[ . 1 . 2]" 1
1029 1 97 THR MG 1 101 GLN HG3 . . 4.060 3.156 2.371 3.873 . 0 0 "[ . 1 . 2]" 1
1030 1 98 LEU H 1 98 LEU HB3 . . 3.440 2.820 2.456 3.268 . 0 0 "[ . 1 . 2]" 1
1031 1 98 LEU H 1 98 LEU QD . . 4.090 3.514 3.112 3.704 . 0 0 "[ . 1 . 2]" 1
1032 1 98 LEU H 1 98 LEU HG . . 4.800 4.494 4.379 4.587 . 0 0 "[ . 1 . 2]" 1
1033 1 98 LEU H 1 99 LEU H . . 3.780 2.887 2.642 3.103 . 0 0 "[ . 1 . 2]" 1
1034 1 98 LEU H 1 99 LEU HB3 . . 4.870 6.259 6.054 6.415 1.545 3 20 [**+**************-**] 1
1035 1 98 LEU HA 1 98 LEU QD . . 2.970 2.104 1.946 2.389 . 0 0 "[ . 1 . 2]" 1
1036 1 98 LEU HA 1 98 LEU HG . . 3.960 3.624 2.426 3.875 . 0 0 "[ . 1 . 2]" 1
1037 1 98 LEU HA 1 101 GLN H . . 4.240 3.369 3.112 3.533 . 0 0 "[ . 1 . 2]" 1
1038 1 98 LEU HA 1 101 GLN HB3 . . 4.310 4.506 4.120 4.578 0.268 11 0 "[ . 1 . 2]" 1
1039 1 98 LEU HA 1 101 GLN QE . . 5.500 4.197 2.758 5.301 . 0 0 "[ . 1 . 2]" 1
1040 1 98 LEU HA 1 101 GLN HG3 . . 4.630 2.841 2.380 3.211 . 0 0 "[ . 1 . 2]" 1
1041 1 98 LEU HB3 1 99 LEU H . . 3.660 2.541 2.306 2.872 . 0 0 "[ . 1 . 2]" 1
1042 1 98 LEU HB3 1 99 LEU QD . . 5.250 3.560 2.430 4.620 . 0 0 "[ . 1 . 2]" 1
1043 1 98 LEU HB3 1 100 ASP H . . 5.500 5.000 4.851 5.149 . 0 0 "[ . 1 . 2]" 1
1044 1 98 LEU QD 1 99 LEU H . . 4.330 3.593 3.132 4.026 . 0 0 "[ . 1 . 2]" 1
1045 1 98 LEU QD 1 99 LEU HA . . 4.610 3.558 2.968 4.272 . 0 0 "[ . 1 . 2]" 1
1046 1 98 LEU QD 1 101 GLN H . . 5.150 3.890 3.574 4.752 . 0 0 "[ . 1 . 2]" 1
1047 1 98 LEU QD 1 101 GLN HB3 . . 5.110 3.945 3.546 4.687 . 0 0 "[ . 1 . 2]" 1
1048 1 98 LEU QD 1 101 GLN HG3 . . 5.370 3.713 3.187 4.265 . 0 0 "[ . 1 . 2]" 1
1049 1 98 LEU QD 1 102 MET H . . 5.050 3.740 3.101 4.598 . 0 0 "[ . 1 . 2]" 1
1050 1 98 LEU QD 1 102 MET HG3 . . 5.110 2.353 2.030 3.474 . 0 0 "[ . 1 . 2]" 1
1051 1 99 LEU H 1 99 LEU HB3 . . 3.100 3.530 3.438 3.631 0.531 2 2 "[ + . 1 - . 2]" 1
1052 1 99 LEU H 1 99 LEU QD . . 3.680 2.738 2.077 3.420 . 0 0 "[ . 1 . 2]" 1
1053 1 99 LEU H 1 99 LEU HG . . 3.850 3.218 2.327 3.940 0.090 14 0 "[ . 1 . 2]" 1
1054 1 99 LEU H 1 100 ASP H . . 3.560 2.842 2.668 2.983 . 0 0 "[ . 1 . 2]" 1
1055 1 99 LEU HA 1 99 LEU QD . . 3.060 2.123 2.021 2.212 . 0 0 "[ . 1 . 2]" 1
1056 1 99 LEU HA 1 99 LEU HG . . 3.300 2.992 2.513 3.387 0.087 10 0 "[ . 1 . 2]" 1
1057 1 99 LEU HA 1 101 GLN H . . 4.780 4.061 3.774 4.332 . 0 0 "[ . 1 . 2]" 1
1058 1 99 LEU HA 1 102 MET H . . 4.030 3.397 2.903 3.619 . 0 0 "[ . 1 . 2]" 1
1059 1 99 LEU HA 1 102 MET ME . . 4.170 4.012 3.264 4.274 0.104 20 0 "[ . 1 . 2]" 1
1060 1 99 LEU HA 1 102 MET HG3 . . 4.570 3.063 2.348 3.776 . 0 0 "[ . 1 . 2]" 1
1061 1 99 LEU HB3 1 100 ASP H . . 3.740 3.494 3.086 3.874 0.134 4 0 "[ . 1 . 2]" 1
1062 1 99 LEU HB3 1 131 ALA HA . . 4.850 3.484 2.820 4.127 . 0 0 "[ . 1 . 2]" 1
1063 1 99 LEU QD 1 100 ASP H . . 5.160 4.026 3.776 4.456 . 0 0 "[ . 1 . 2]" 1
1064 1 99 LEU QD 1 102 MET H . . 4.880 4.720 4.347 4.842 . 0 0 "[ . 1 . 2]" 1
1065 1 99 LEU QD 1 102 MET ME . . 4.670 3.329 2.927 3.910 . 0 0 "[ . 1 . 2]" 1
1066 1 99 LEU QD 1 127 PHE HA . . 5.250 4.872 4.517 5.161 . 0 0 "[ . 1 . 2]" 1
1067 1 99 LEU QD 1 127 PHE QD . . 4.470 3.609 3.291 3.901 . 0 0 "[ . 1 . 2]" 1
1068 1 99 LEU QD 1 127 PHE QE . . 3.690 2.339 2.068 2.828 . 0 0 "[ . 1 . 2]" 1
1069 1 99 LEU QD 1 130 TRP H . . 5.170 5.078 4.891 5.150 . 0 0 "[ . 1 . 2]" 1
1070 1 99 LEU QD 1 130 TRP HA . . 4.790 4.479 4.068 4.703 . 0 0 "[ . 1 . 2]" 1
1071 1 99 LEU QD 1 131 ALA H . . 4.480 4.066 3.816 4.340 . 0 0 "[ . 1 . 2]" 1
1072 1 99 LEU QD 1 131 ALA HA . . 3.580 2.362 1.958 3.124 . 0 0 "[ . 1 . 2]" 1
1073 1 99 LEU QD 1 131 ALA MB . . 3.640 2.232 1.986 3.177 . 0 0 "[ . 1 . 2]" 1
1074 1 99 LEU HG 1 127 PHE QE . . 5.480 4.160 3.764 4.579 . 0 0 "[ . 1 . 2]" 1
1075 1 100 ASP H 1 100 ASP HB3 . . 3.390 2.743 2.276 3.391 0.001 7 0 "[ . 1 . 2]" 1
1076 1 100 ASP H 1 101 GLN H . . 3.500 2.572 2.170 2.886 . 0 0 "[ . 1 . 2]" 1
1077 1 100 ASP H 1 102 MET H . . 4.760 4.031 3.771 4.279 . 0 0 "[ . 1 . 2]" 1
1078 1 100 ASP HA 1 102 MET H . . 5.210 4.073 3.593 4.427 . 0 0 "[ . 1 . 2]" 1
1079 1 100 ASP HA 1 103 LYS HE3 . . 3.890 3.174 1.923 4.879 0.989 12 3 "[ . * 1 + . - 2]" 1
1080 1 100 ASP HB3 1 101 GLN H . . 3.940 3.160 2.650 3.964 0.024 7 0 "[ . 1 . 2]" 1
1081 1 101 GLN H 1 101 GLN HB3 . . 3.370 3.664 3.606 3.722 0.352 2 0 "[ . 1 . 2]" 1
1082 1 101 GLN H 1 101 GLN HG3 . . 3.620 2.597 2.167 3.406 . 0 0 "[ . 1 . 2]" 1
1083 1 101 GLN H 1 102 MET H . . 3.280 2.344 2.145 2.520 . 0 0 "[ . 1 . 2]" 1
1084 1 101 GLN H 1 102 MET HA . . 5.170 5.004 4.831 5.167 . 0 0 "[ . 1 . 2]" 1
1085 1 101 GLN H 1 103 LYS H . . 4.660 4.438 3.913 4.749 0.089 9 0 "[ . 1 . 2]" 1
1086 1 101 GLN HA 1 101 GLN QE . . 5.500 4.743 4.310 5.047 . 0 0 "[ . 1 . 2]" 1
1087 1 101 GLN HA 1 101 GLN HG3 . . 3.640 3.337 3.051 3.719 0.079 20 0 "[ . 1 . 2]" 1
1088 1 101 GLN HA 1 103 LYS H . . 4.350 3.639 3.287 4.114 . 0 0 "[ . 1 . 2]" 1
1089 1 101 GLN HB3 1 102 MET H . . 4.440 4.000 3.729 4.281 . 0 0 "[ . 1 . 2]" 1
1090 1 101 GLN HG3 1 102 MET H . . 5.500 4.487 4.028 5.035 . 0 0 "[ . 1 . 2]" 1
1091 1 102 MET H 1 102 MET HB3 . . 3.950 3.614 3.503 3.860 . 0 0 "[ . 1 . 2]" 1
1092 1 102 MET H 1 102 MET ME . . 4.860 4.687 4.334 4.918 0.058 8 0 "[ . 1 . 2]" 1
1093 1 102 MET H 1 102 MET HG3 . . 4.200 2.520 1.989 3.563 . 0 0 "[ . 1 . 2]" 1
1094 1 102 MET H 1 103 LYS H . . 3.380 3.061 2.770 3.426 0.046 11 0 "[ . 1 . 2]" 1
1095 1 102 MET HA 1 102 MET ME . . 4.100 4.017 3.708 4.179 0.079 14 0 "[ . 1 . 2]" 1
1096 1 102 MET HA 1 102 MET HG3 . . 3.620 3.273 2.931 3.765 0.145 13 0 "[ . 1 . 2]" 1
1097 1 102 MET HA 1 103 LYS H . . 3.510 3.160 2.839 3.281 . 0 0 "[ . 1 . 2]" 1
1098 1 102 MET HA 1 104 ASN H . . 4.450 3.508 3.203 4.068 . 0 0 "[ . 1 . 2]" 1
1099 1 102 MET HA 1 105 TYR H . . 4.530 3.960 3.400 4.524 . 0 0 "[ . 1 . 2]" 1
1100 1 102 MET HB3 1 102 MET ME . . 3.160 2.202 2.061 2.319 . 0 0 "[ . 1 . 2]" 1
1101 1 102 MET HB3 1 105 TYR H . . 5.250 3.906 3.688 4.247 . 0 0 "[ . 1 . 2]" 1
1102 1 102 MET HB3 1 105 TYR HB3 . . 5.030 2.831 2.300 3.752 . 0 0 "[ . 1 . 2]" 1
1103 1 102 MET ME 1 105 TYR HA . . 5.350 5.050 4.564 5.431 0.081 9 0 "[ . 1 . 2]" 1
1104 1 102 MET ME 1 105 TYR QD . . 4.010 3.204 2.405 4.109 0.099 19 0 "[ . 1 . 2]" 1
1105 1 102 MET ME 1 109 VAL HA . . 4.930 4.418 3.796 5.026 0.096 9 0 "[ . 1 . 2]" 1
1106 1 102 MET ME 1 109 VAL MG2 . . 3.220 2.513 1.966 3.312 0.092 3 0 "[ . 1 . 2]" 1
1107 1 103 LYS H 1 103 LYS HB3 . . 3.680 3.573 3.456 3.716 0.036 9 0 "[ . 1 . 2]" 1
1108 1 103 LYS H 1 103 LYS HE3 . . 5.500 4.795 3.164 6.255 0.755 17 1 "[ . 1 . + 2]" 1
1109 1 103 LYS H 1 104 ASN H . . 3.530 3.000 2.847 3.310 . 0 0 "[ . 1 . 2]" 1
1110 1 103 LYS H 1 105 TYR H . . 4.700 4.570 4.258 4.796 0.096 9 0 "[ . 1 . 2]" 1
1111 1 103 LYS H 1 134 LEU QD . . 5.180 4.141 3.558 4.439 . 0 0 "[ . 1 . 2]" 1
1112 1 103 LYS HA 1 103 LYS HB3 . . 2.950 2.605 2.386 2.807 . 0 0 "[ . 1 . 2]" 1
1113 1 103 LYS HA 1 103 LYS HE3 . . 3.900 3.971 2.097 4.806 0.906 12 7 "[ *.** * + -. * 2]" 1
1114 1 103 LYS HA 1 104 ASN HA . . 4.770 4.588 4.454 4.729 . 0 0 "[ . 1 . 2]" 1
1115 1 103 LYS HA 1 105 TYR H . . 4.210 3.946 3.667 4.250 0.040 2 0 "[ . 1 . 2]" 1
1116 1 103 LYS HA 1 134 LEU QD . . 3.290 3.033 2.238 3.331 0.041 17 0 "[ . 1 . 2]" 1
1117 1 103 LYS HB3 1 104 ASN HD22 . . 5.500 4.122 3.008 5.579 0.079 1 0 "[ . 1 . 2]" 1
1118 1 103 LYS HE3 1 134 LEU QD . . 5.040 4.346 2.647 5.459 0.419 8 0 "[ . 1 . 2]" 1
1119 1 104 ASN H 1 104 ASN HB3 . . 3.330 3.610 3.097 3.759 0.429 18 0 "[ . 1 . 2]" 1
1120 1 104 ASN H 1 104 ASN HD21 . . 4.690 3.061 2.022 4.138 . 0 0 "[ . 1 . 2]" 1
1121 1 104 ASN H 1 104 ASN HD22 . . 5.380 4.091 2.865 5.076 . 0 0 "[ . 1 . 2]" 1
1122 1 104 ASN H 1 105 TYR H . . 3.230 2.451 1.719 3.062 . 0 0 "[ . 1 . 2]" 1
1123 1 104 ASN H 1 134 LEU QD . . 5.080 4.505 3.679 5.024 . 0 0 "[ . 1 . 2]" 1
1124 1 104 ASN HA 1 104 ASN HD21 . . 4.580 3.474 1.963 4.250 . 0 0 "[ . 1 . 2]" 1
1125 1 104 ASN HA 1 104 ASN HD22 . . 5.040 4.238 3.570 5.084 0.044 1 0 "[ . 1 . 2]" 1
1126 1 104 ASN HB3 1 104 ASN HD21 . . 3.550 3.195 2.385 3.647 0.097 6 0 "[ . 1 . 2]" 1
1127 1 105 TYR H 1 105 TYR HB3 . . 3.540 2.546 2.152 3.610 0.070 9 0 "[ . 1 . 2]" 1
1128 1 105 TYR H 1 105 TYR QD . . 4.450 3.171 1.989 4.194 . 0 0 "[ . 1 . 2]" 1
1129 1 105 TYR H 1 106 ARG H . . 4.690 4.601 4.379 4.725 0.035 14 0 "[ . 1 . 2]" 1
1130 1 105 TYR H 1 134 LEU QD . . 3.930 3.462 1.973 3.971 0.041 12 0 "[ . 1 . 2]" 1
1131 1 105 TYR HA 1 105 TYR QD . . 3.920 2.880 2.266 3.782 . 0 0 "[ . 1 . 2]" 1
1132 1 105 TYR HA 1 106 ARG H . . 2.880 2.307 2.115 2.506 . 0 0 "[ . 1 . 2]" 1
1133 1 105 TYR HA 1 106 ARG HG3 . . 4.800 4.581 3.854 4.869 0.069 3 0 "[ . 1 . 2]" 1
1134 1 105 TYR HB3 1 106 ARG H . . 4.520 3.721 2.316 4.271 . 0 0 "[ . 1 . 2]" 1
1135 1 105 TYR HB3 1 134 LEU QD . . 4.210 2.992 2.305 3.426 . 0 0 "[ . 1 . 2]" 1
1136 1 105 TYR QD 1 106 ARG H . . 5.500 3.077 2.343 4.077 . 0 0 "[ . 1 . 2]" 1
1137 1 105 TYR QD 1 134 LEU QD . . 3.160 2.741 2.245 3.268 0.108 9 0 "[ . 1 . 2]" 1
1138 1 106 ARG H 1 106 ARG HB3 . . 3.930 3.711 3.555 3.815 . 0 0 "[ . 1 . 2]" 1
1139 1 106 ARG H 1 106 ARG HD3 . . 5.180 5.310 4.164 5.772 0.592 10 4 "[ . * + * . - 2]" 1
1140 1 106 ARG H 1 106 ARG HG3 . . 3.920 3.792 3.392 4.008 0.088 3 0 "[ . 1 . 2]" 1
1141 1 106 ARG H 1 107 GLY HA2 . . 5.500 5.193 4.688 5.574 0.074 19 0 "[ . 1 . 2]" 1
1142 1 106 ARG H 1 107 GLY HA3 . . 5.500 4.326 3.773 4.759 . 0 0 "[ . 1 . 2]" 1
1143 1 106 ARG HA 1 106 ARG HD3 . . 4.140 3.692 2.313 4.057 . 0 0 "[ . 1 . 2]" 1
1144 1 106 ARG HA 1 106 ARG HG3 . . 3.810 3.670 3.405 3.908 0.098 6 0 "[ . 1 . 2]" 1
1145 1 106 ARG HB3 1 106 ARG HD3 . . 4.060 3.155 2.234 3.656 . 0 0 "[ . 1 . 2]" 1
1146 1 107 GLY HA2 1 108 GLU H . . 3.410 2.914 2.550 3.281 . 0 0 "[ . 1 . 2]" 1
1147 1 107 GLY HA3 1 108 GLU H . . 3.290 2.401 2.140 2.719 . 0 0 "[ . 1 . 2]" 1
1148 1 108 GLU H 1 108 GLU HB3 . . 3.980 3.569 2.165 3.976 . 0 0 "[ . 1 . 2]" 1
1149 1 108 GLU H 1 108 GLU HG3 . . 4.410 3.312 2.754 4.467 0.057 9 0 "[ . 1 . 2]" 1
1150 1 108 GLU H 1 109 VAL H . . 4.950 4.439 4.163 4.666 . 0 0 "[ . 1 . 2]" 1
1151 1 108 GLU H 1 137 ILE MD . . 5.500 5.315 4.597 5.622 0.122 5 0 "[ . 1 . 2]" 1
1152 1 108 GLU HA 1 108 GLU HG3 . . 3.960 2.871 2.263 3.747 . 0 0 "[ . 1 . 2]" 1
1153 1 108 GLU HA 1 109 VAL H . . 3.100 2.286 2.114 2.492 . 0 0 "[ . 1 . 2]" 1
1154 1 108 GLU HA 1 135 ASN HD21 . . 4.600 2.409 1.889 3.368 . 0 0 "[ . 1 . 2]" 1
1155 1 108 GLU HA 1 135 ASN HD22 . . 5.010 3.841 2.774 5.042 0.032 20 0 "[ . 1 . 2]" 1
1156 1 108 GLU HB3 1 135 ASN HD21 . . 5.500 3.648 2.261 4.744 . 0 0 "[ . 1 . 2]" 1
1157 1 108 GLU HB3 1 137 ILE MD . . 3.730 2.588 2.091 3.872 0.142 9 0 "[ . 1 . 2]" 1
1158 1 108 GLU HB3 1 137 ILE MG . . 3.550 3.386 2.518 4.585 1.035 9 1 "[ . +1 . 2]" 1
1159 1 108 GLU HG3 1 109 VAL H . . 4.940 4.749 3.907 5.047 0.107 2 0 "[ . 1 . 2]" 1
1160 1 108 GLU HG3 1 135 ASN HD21 . . 4.510 3.463 1.708 4.550 0.040 1 0 "[ . 1 . 2]" 1
1161 1 108 GLU HG3 1 135 ASN HD22 . . 4.470 4.036 2.757 5.103 0.633 1 1 "[+ . 1 . 2]" 1
1162 1 108 GLU HG3 1 137 ILE MG . . 4.140 4.089 2.172 4.596 0.456 18 0 "[ . 1 . 2]" 1
1163 1 109 VAL H 1 109 VAL HB . . 3.350 2.738 2.552 2.987 . 0 0 "[ . 1 . 2]" 1
1164 1 109 VAL H 1 109 VAL MG2 . . 4.150 2.567 2.356 2.867 . 0 0 "[ . 1 . 2]" 1
1165 1 109 VAL H 1 135 ASN HB3 . . 5.100 3.525 3.221 3.645 . 0 0 "[ . 1 . 2]" 1
1166 1 109 VAL H 1 135 ASN HD21 . . 5.500 3.330 2.855 3.993 . 0 0 "[ . 1 . 2]" 1
1167 1 109 VAL H 1 136 VAL HA . . 3.960 3.085 2.457 3.614 . 0 0 "[ . 1 . 2]" 1
1168 1 109 VAL H 1 137 ILE H . . 4.240 3.506 3.243 3.801 . 0 0 "[ . 1 . 2]" 1
1169 1 109 VAL H 1 137 ILE MD . . 4.460 3.614 2.269 4.550 0.090 6 0 "[ . 1 . 2]" 1
1170 1 109 VAL H 1 137 ILE MG . . 3.910 3.654 3.162 4.004 0.094 1 0 "[ . 1 . 2]" 1
1171 1 109 VAL HA 1 109 VAL MG1 . . 3.270 2.307 2.208 2.449 . 0 0 "[ . 1 . 2]" 1
1172 1 109 VAL HA 1 109 VAL MG2 . . 3.120 2.511 2.310 2.708 . 0 0 "[ . 1 . 2]" 1
1173 1 109 VAL HA 1 110 ALA H . . 2.890 2.197 2.099 2.286 . 0 0 "[ . 1 . 2]" 1
1174 1 109 VAL HA 1 110 ALA HA . . 4.480 4.431 4.330 4.499 0.019 10 0 "[ . 1 . 2]" 1
1175 1 109 VAL HA 1 110 ALA MB . . 4.280 4.086 3.833 4.296 0.016 15 0 "[ . 1 . 2]" 1
1176 1 109 VAL HB 1 110 ALA H . . 4.970 4.077 3.819 4.324 . 0 0 "[ . 1 . 2]" 1
1177 1 109 VAL HB 1 136 VAL H . . 5.110 4.460 3.421 5.176 0.066 13 0 "[ . 1 . 2]" 1
1178 1 109 VAL HB 1 136 VAL HA . . 3.250 2.601 2.075 3.044 . 0 0 "[ . 1 . 2]" 1
1179 1 109 VAL HB 1 136 VAL QG . . 3.530 2.831 2.167 3.426 . 0 0 "[ . 1 . 2]" 1
1180 1 109 VAL HB 1 137 ILE H . . 4.210 4.144 3.820 4.291 0.081 10 0 "[ . 1 . 2]" 1
1181 1 109 VAL MG1 1 110 ALA H . . 3.290 2.586 2.339 3.005 . 0 0 "[ . 1 . 2]" 1
1182 1 109 VAL MG1 1 110 ALA MB . . 4.500 4.169 3.951 4.417 . 0 0 "[ . 1 . 2]" 1
1183 1 109 VAL MG2 1 110 ALA H . . 4.710 4.168 3.848 4.409 . 0 0 "[ . 1 . 2]" 1
1184 1 109 VAL MG2 1 135 ASN HB3 . . 5.500 3.450 2.818 3.916 . 0 0 "[ . 1 . 2]" 1
1185 1 109 VAL MG2 1 136 VAL H . . 5.500 4.819 4.000 5.286 . 0 0 "[ . 1 . 2]" 1
1186 1 110 ALA H 1 110 ALA MB . . 3.560 2.637 2.410 2.823 . 0 0 "[ . 1 . 2]" 1
1187 1 110 ALA H 1 111 SER H . . 4.920 4.408 4.320 4.491 . 0 0 "[ . 1 . 2]" 1
1188 1 110 ALA HA 1 111 SER H . . 3.320 2.448 2.296 2.550 . 0 0 "[ . 1 . 2]" 1
1189 1 110 ALA HA 1 138 GLY H . . 3.970 2.946 2.459 3.552 . 0 0 "[ . 1 . 2]" 1
1190 1 110 ALA HA 1 139 VAL HA . . 5.120 4.616 3.967 4.891 . 0 0 "[ . 1 . 2]" 1
1191 1 110 ALA MB 1 111 SER H . . 3.410 2.496 2.193 2.833 . 0 0 "[ . 1 . 2]" 1
1192 1 110 ALA MB 1 111 SER HA . . 5.500 4.061 3.842 4.352 . 0 0 "[ . 1 . 2]" 1
1193 1 110 ALA MB 1 137 ILE H . . 4.330 3.783 3.318 4.418 0.088 16 0 "[ . 1 . 2]" 1
1194 1 110 ALA MB 1 137 ILE MD . . 3.670 2.280 2.049 3.782 0.112 16 0 "[ . 1 . 2]" 1
1195 1 110 ALA MB 1 138 GLY H . . 4.070 3.335 2.721 3.930 . 0 0 "[ . 1 . 2]" 1
1196 1 110 ALA MB 1 138 GLY HA3 . . 5.170 2.847 2.002 4.183 . 0 0 "[ . 1 . 2]" 1
1197 1 110 ALA MB 1 139 VAL H . . 5.500 4.766 3.964 5.411 . 0 0 "[ . 1 . 2]" 1
1198 1 110 ALA MB 1 139 VAL QG . . 5.500 4.360 3.843 4.896 . 0 0 "[ . 1 . 2]" 1
1199 1 110 ALA MB 1 149 TRP H . . 5.500 5.389 4.915 5.594 0.094 4 0 "[ . 1 . 2]" 1
1200 1 110 ALA MB 1 149 TRP HB3 . . 4.960 3.035 2.408 3.497 . 0 0 "[ . 1 . 2]" 1
1201 1 110 ALA MB 1 149 TRP HD1 . . 4.740 3.649 3.233 4.326 . 0 0 "[ . 1 . 2]" 1
1202 1 110 ALA MB 1 149 TRP HE1 . . 5.020 3.644 3.008 4.147 . 0 0 "[ . 1 . 2]" 1
1203 1 110 ALA MB 1 149 TRP HE3 . . 3.940 3.417 2.862 3.849 . 0 0 "[ . 1 . 2]" 1
1204 1 111 SER H 1 111 SER HB3 . . 4.130 3.053 2.716 3.775 . 0 0 "[ . 1 . 2]" 1
1205 1 111 SER H 1 112 PHE H . . 5.270 4.222 3.802 4.519 . 0 0 "[ . 1 . 2]" 1
1206 1 111 SER H 1 138 GLY H . . 5.100 4.437 3.916 5.157 0.057 16 0 "[ . 1 . 2]" 1
1207 1 111 SER H 1 139 VAL H . . 5.500 4.742 3.798 5.574 0.074 1 0 "[ . 1 . 2]" 1
1208 1 111 SER H 1 139 VAL HA . . 3.480 2.867 2.224 3.318 . 0 0 "[ . 1 . 2]" 1
1209 1 111 SER H 1 139 VAL QG . . 4.070 3.328 2.226 3.814 . 0 0 "[ . 1 . 2]" 1
1210 1 111 SER H 1 140 ALA H . . 4.500 4.068 3.692 4.588 0.088 12 0 "[ . 1 . 2]" 1
1211 1 111 SER HA 1 112 PHE H . . 3.230 2.233 2.144 2.395 . 0 0 "[ . 1 . 2]" 1
1212 1 111 SER HA 1 112 PHE HA . . 5.260 4.448 4.384 4.560 . 0 0 "[ . 1 . 2]" 1
1213 1 111 SER HA 1 112 PHE QD . . 4.640 3.251 2.800 3.709 . 0 0 "[ . 1 . 2]" 1
1214 1 111 SER HB3 1 112 PHE H . . 4.600 4.041 3.345 4.467 . 0 0 "[ . 1 . 2]" 1
1215 1 111 SER HB3 1 139 VAL QG . . 4.330 2.869 1.978 3.902 . 0 0 "[ . 1 . 2]" 1
1216 1 112 PHE H 1 112 PHE QD . . 4.130 2.434 2.023 3.272 . 0 0 "[ . 1 . 2]" 1
1217 1 112 PHE H 1 113 PHE H . . 5.280 4.261 3.798 4.657 . 0 0 "[ . 1 . 2]" 1
1218 1 112 PHE HA 1 113 PHE H . . 3.270 2.237 2.085 2.417 . 0 0 "[ . 1 . 2]" 1
1219 1 112 PHE HA 1 139 VAL HA . . 4.840 4.445 3.674 4.933 0.093 16 0 "[ . 1 . 2]" 1
1220 1 112 PHE HA 1 139 VAL QG . . 5.500 4.593 3.606 5.145 . 0 0 "[ . 1 . 2]" 1
1221 1 112 PHE HA 1 140 ALA H . . 3.740 3.218 2.770 3.800 0.060 16 0 "[ . 1 . 2]" 1
1222 1 112 PHE HA 1 140 ALA MB . . 4.760 4.303 3.838 4.824 0.064 17 0 "[ . 1 . 2]" 1
1223 1 112 PHE HA 1 141 ARG HA . . 5.230 3.850 3.005 4.509 . 0 0 "[ . 1 . 2]" 1
1224 1 112 PHE HA 1 149 TRP HH2 . . 4.450 3.595 2.933 4.509 0.059 12 0 "[ . 1 . 2]" 1
1225 1 112 PHE HB3 1 113 PHE H . . 4.700 4.330 4.030 4.636 . 0 0 "[ . 1 . 2]" 1
1226 1 112 PHE HB3 1 140 ALA H . . 5.080 4.582 3.957 5.138 0.058 16 0 "[ . 1 . 2]" 1
1227 1 112 PHE HB3 1 149 TRP HH2 . . 3.940 3.263 2.640 3.748 . 0 0 "[ . 1 . 2]" 1
1228 1 112 PHE HB3 1 149 TRP HZ3 . . 4.890 2.722 2.112 3.538 . 0 0 "[ . 1 . 2]" 1
1229 1 112 PHE QD 1 113 PHE H . . 5.500 4.435 3.494 5.009 . 0 0 "[ . 1 . 2]" 1
1230 1 112 PHE QD 1 114 THR MG . . 4.140 3.220 2.004 4.200 0.060 8 0 "[ . 1 . 2]" 1
1231 1 112 PHE QD 1 142 ASP H . . 5.500 4.584 3.558 5.498 . 0 0 "[ . 1 . 2]" 1
1232 1 112 PHE QD 1 142 ASP HA . . 5.070 4.069 2.615 5.071 0.001 7 0 "[ . 1 . 2]" 1
1233 1 112 PHE QE 1 114 THR MG . . 4.290 3.681 2.547 4.413 0.123 19 0 "[ . 1 . 2]" 1
1234 1 113 PHE H 1 113 PHE QD . . 3.950 2.519 1.870 3.136 . 0 0 "[ . 1 . 2]" 1
1235 1 113 PHE H 1 140 ALA H . . 4.620 4.342 3.859 4.696 0.076 3 0 "[ . 1 . 2]" 1
1236 1 113 PHE H 1 141 ARG HA . . 3.670 2.584 2.094 3.273 . 0 0 "[ . 1 . 2]" 1
1237 1 113 PHE H 1 142 ASP H . . 4.070 3.686 2.815 4.132 0.062 17 0 "[ . 1 . 2]" 1
1238 1 113 PHE HA 1 114 THR H . . 3.390 2.311 2.152 2.548 . 0 0 "[ . 1 . 2]" 1
1239 1 113 PHE HA 1 114 THR MG . . 4.690 3.457 2.942 4.098 . 0 0 "[ . 1 . 2]" 1
1240 1 113 PHE HB3 1 114 THR H . . 4.890 3.920 3.599 4.380 . 0 0 "[ . 1 . 2]" 1
1241 1 113 PHE QD 1 114 THR H . . 4.690 3.921 3.077 4.773 0.083 7 0 "[ . 1 . 2]" 1
1242 1 113 PHE QD 1 115 SER H . . 4.940 2.546 1.880 4.239 . 0 0 "[ . 1 . 2]" 1
1243 1 113 PHE QD 1 115 SER HB3 . . 4.710 4.793 3.652 5.720 1.010 18 8 "[***-. ** 1 . *+ 2]" 1
1244 1 113 PHE QD 1 116 ALA MB . . 5.110 3.736 2.542 4.715 . 0 0 "[ . 1 . 2]" 1
1245 1 113 PHE QD 1 120 HIS HD2 . . 4.380 4.403 4.115 4.468 0.088 3 0 "[ . 1 . 2]" 1
1246 1 113 PHE QD 1 141 ARG HA . . 4.820 3.404 2.392 4.232 . 0 0 "[ . 1 . 2]" 1
1247 1 113 PHE QE 1 116 ALA MB . . 5.210 3.053 2.086 4.602 . 0 0 "[ . 1 . 2]" 1
1248 1 113 PHE QE 1 120 HIS HD2 . . 3.020 2.411 2.142 3.104 0.084 14 0 "[ . 1 . 2]" 1
1249 1 113 PHE QE 1 124 VAL MG2 . . 4.550 3.388 2.293 4.657 0.107 9 0 "[ . 1 . 2]" 1
1250 1 113 PHE QE 1 140 ALA HA . . 4.080 3.320 2.396 4.148 0.068 12 0 "[ . 1 . 2]" 1
1251 1 113 PHE QE 1 140 ALA MB . . 4.730 4.491 3.977 4.833 0.103 9 0 "[ . 1 . 2]" 1
1252 1 113 PHE QE 1 141 ARG H . . 4.540 3.896 3.281 4.618 0.078 20 0 "[ . 1 . 2]" 1
1253 1 113 PHE QE 1 141 ARG HA . . 5.130 3.626 2.823 4.552 . 0 0 "[ . 1 . 2]" 1
1254 1 113 PHE QE 1 141 ARG HG3 . . 5.040 4.511 2.918 5.169 0.129 11 0 "[ . 1 . 2]" 1
1255 1 114 THR H 1 114 THR MG . . 3.990 2.772 2.251 3.092 . 0 0 "[ . 1 . 2]" 1
1256 1 114 THR HA 1 114 THR MG . . 3.350 2.377 2.220 3.271 . 0 0 "[ . 1 . 2]" 1
1257 1 114 THR HA 1 115 SER H . . 3.420 3.034 2.487 3.466 0.046 2 0 "[ . 1 . 2]" 1
1258 1 114 THR HA 1 142 ASP H . . 4.730 3.259 2.328 3.797 . 0 0 "[ . 1 . 2]" 1
1259 1 114 THR HA 1 142 ASP HA . . 4.470 4.013 2.930 4.550 0.080 13 0 "[ . 1 . 2]" 1
1260 1 114 THR HB 1 115 SER H . . 4.520 4.378 4.022 4.559 0.039 19 0 "[ . 1 . 2]" 1
1261 1 114 THR MG 1 115 SER H . . 4.460 4.355 3.931 4.462 0.002 8 0 "[ . 1 . 2]" 1
1262 1 114 THR MG 1 142 ASP H . . 4.700 3.637 2.742 4.796 0.096 19 0 "[ . 1 . 2]" 1
1263 1 114 THR MG 1 142 ASP HA . . 5.280 3.250 2.215 4.668 . 0 0 "[ . 1 . 2]" 1
1264 1 115 SER H 1 116 ALA H . . 4.670 3.789 2.286 4.604 . 0 0 "[ . 1 . 2]" 1
1265 1 115 SER HA 1 116 ALA H . . 3.260 2.368 2.051 2.897 . 0 0 "[ . 1 . 2]" 1
1266 1 115 SER HB3 1 116 ALA H . . 4.280 3.674 2.669 4.460 0.180 11 0 "[ . 1 . 2]" 1
1267 1 116 ALA H 1 116 ALA MB . . 3.240 2.512 2.197 2.878 . 0 0 "[ . 1 . 2]" 1
1268 1 116 ALA H 1 117 GLY H . . 3.750 2.408 1.809 3.809 0.059 14 0 "[ . 1 . 2]" 1
1269 1 116 ALA HA 1 117 GLY H . . 3.430 3.172 2.190 3.482 0.052 5 0 "[ . 1 . 2]" 1
1270 1 116 ALA MB 1 117 GLY H . . 4.010 3.421 2.653 3.751 . 0 0 "[ . 1 . 2]" 1
1271 1 117 GLY H 1 118 THR H . . 4.210 3.177 2.098 3.687 . 0 0 "[ . 1 . 2]" 1
1272 1 117 GLY QA 1 118 THR H . . 3.380 2.655 2.269 3.001 . 0 0 "[ . 1 . 2]" 1
1273 1 117 GLY QA 1 118 THR MG . . 4.630 4.159 3.189 4.741 0.111 11 0 "[ . 1 . 2]" 1
1274 1 118 THR H 1 118 THR HB . . 4.120 3.334 2.881 3.781 . 0 0 "[ . 1 . 2]" 1
1275 1 118 THR H 1 118 THR MG . . 4.170 3.601 2.853 4.075 . 0 0 "[ . 1 . 2]" 1
1276 1 118 THR H 1 119 ASN H . . 4.150 2.152 1.821 2.827 . 0 0 "[ . 1 . 2]" 1
1277 1 118 THR HA 1 118 THR MG . . 3.260 2.221 2.141 2.391 . 0 0 "[ . 1 . 2]" 1
1278 1 118 THR HA 1 119 ASN H . . 3.560 3.276 3.039 3.506 . 0 0 "[ . 1 . 2]" 1
1279 1 118 THR HB 1 119 ASN H . . 4.410 4.030 3.514 4.465 0.055 8 0 "[ . 1 . 2]" 1
1280 1 118 THR MG 1 119 ASN H . . 4.930 4.433 4.244 4.584 . 0 0 "[ . 1 . 2]" 1
1281 1 119 ASN H 1 119 ASN HB3 . . 3.970 3.504 2.939 3.824 . 0 0 "[ . 1 . 2]" 1
1282 1 119 ASN H 1 119 ASN HD21 . . 5.270 4.908 4.484 5.234 . 0 0 "[ . 1 . 2]" 1
1283 1 119 ASN HA 1 119 ASN HD21 . . 3.850 2.426 2.042 2.916 . 0 0 "[ . 1 . 2]" 1
1284 1 119 ASN HA 1 119 ASN HD22 . . 4.160 3.516 3.303 3.737 . 0 0 "[ . 1 . 2]" 1
1285 1 119 ASN HA 1 122 ALA H . . 3.950 3.990 3.737 4.040 0.090 11 0 "[ . 1 . 2]" 1
1286 1 119 ASN HA 1 122 ALA MB . . 3.650 3.646 3.367 3.754 0.104 9 0 "[ . 1 . 2]" 1
1287 1 119 ASN HA 1 123 TYR H . . 5.500 4.976 4.586 5.544 0.044 6 0 "[ . 1 . 2]" 1
1288 1 119 ASN HB3 1 119 ASN HD21 . . 3.650 2.759 2.404 3.678 0.028 14 0 "[ . 1 . 2]" 1
1289 1 119 ASN HB3 1 122 ALA MB . . 4.830 3.542 2.635 4.096 . 0 0 "[ . 1 . 2]" 1
1290 1 119 ASN HD21 1 122 ALA H . . 4.500 3.485 3.077 4.582 0.082 11 0 "[ . 1 . 2]" 1
1291 1 119 ASN HD21 1 122 ALA MB . . 5.200 2.110 1.669 3.054 . 0 0 "[ . 1 . 2]" 1
1292 1 119 ASN HD22 1 122 ALA H . . 4.570 4.515 4.119 4.656 0.086 20 0 "[ . 1 . 2]" 1
1293 1 119 ASN HD22 1 122 ALA MB . . 4.820 2.472 2.004 2.821 . 0 0 "[ . 1 . 2]" 1
1294 1 120 HIS HA 1 120 HIS HD2 . . 3.680 2.476 2.263 2.865 . 0 0 "[ . 1 . 2]" 1
1295 1 120 HIS HA 1 122 ALA H . . 4.870 4.558 4.330 4.867 . 0 0 "[ . 1 . 2]" 1
1296 1 120 HIS HA 1 123 TYR H . . 4.320 3.924 3.605 4.365 0.045 1 0 "[ . 1 . 2]" 1
1297 1 120 HIS HA 1 123 TYR HB3 . . 4.870 3.656 2.974 4.219 . 0 0 "[ . 1 . 2]" 1
1298 1 120 HIS HD2 1 124 VAL MG2 . . 4.110 3.398 2.323 4.208 0.098 2 0 "[ . 1 . 2]" 1
1299 1 121 LYS HA 1 121 LYS HB3 . . 2.930 2.732 2.366 3.008 0.078 13 0 "[ . 1 . 2]" 1
1300 1 121 LYS HA 1 121 LYS HG3 . . 4.020 3.478 2.666 3.889 . 0 0 "[ . 1 . 2]" 1
1301 1 121 LYS HA 1 124 VAL HB . . 3.540 3.363 2.839 3.610 0.070 13 0 "[ . 1 . 2]" 1
1302 1 121 LYS HA 1 124 VAL MG1 . . 4.720 4.470 4.054 4.761 0.041 7 0 "[ . 1 . 2]" 1
1303 1 121 LYS HA 1 124 VAL MG2 . . 3.880 2.881 2.384 3.638 . 0 0 "[ . 1 . 2]" 1
1304 1 121 LYS HB3 1 122 ALA H . . 3.950 3.430 2.749 4.276 0.326 6 0 "[ . 1 . 2]" 1
1305 1 121 LYS HB3 1 122 ALA HA . . 4.770 4.385 3.811 5.909 1.139 6 2 "[ -+ 1 . 2]" 1
1306 1 122 ALA H 1 122 ALA MB . . 3.030 2.177 2.014 2.245 . 0 0 "[ . 1 . 2]" 1
1307 1 122 ALA H 1 123 TYR H . . 3.530 2.841 2.632 3.098 . 0 0 "[ . 1 . 2]" 1
1308 1 122 ALA HA 1 125 SER H . . 4.030 3.679 3.468 3.884 . 0 0 "[ . 1 . 2]" 1
1309 1 122 ALA HA 1 126 HIS H . . 4.780 4.110 3.837 4.449 . 0 0 "[ . 1 . 2]" 1
1310 1 122 ALA MB 1 123 TYR H . . 3.540 2.506 2.130 2.773 . 0 0 "[ . 1 . 2]" 1
1311 1 122 ALA MB 1 123 TYR HA . . 5.120 3.757 3.595 3.864 . 0 0 "[ . 1 . 2]" 1
1312 1 122 ALA MB 1 125 SER H . . 5.500 4.701 4.538 4.859 . 0 0 "[ . 1 . 2]" 1
1313 1 122 ALA MB 1 125 SER HB3 . . 5.420 4.793 4.142 5.523 0.103 15 0 "[ . 1 . 2]" 1
1314 1 122 ALA MB 1 126 HIS H . . 5.500 4.371 4.167 4.598 . 0 0 "[ . 1 . 2]" 1
1315 1 123 TYR H 1 123 TYR HB3 . . 3.590 2.548 2.362 2.701 . 0 0 "[ . 1 . 2]" 1
1316 1 123 TYR H 1 123 TYR QR . . 4.700 4.122 4.041 4.205 . 0 0 "[ . 1 . 2]" 1
1317 1 123 TYR H 1 124 VAL H . . 3.830 2.801 2.644 3.009 . 0 0 "[ . 1 . 2]" 1
1318 1 123 TYR H 1 124 VAL HA . . 5.500 5.401 5.268 5.561 0.061 12 0 "[ . 1 . 2]" 1
1319 1 123 TYR H 1 124 VAL MG2 . . 5.160 4.022 3.739 4.378 . 0 0 "[ . 1 . 2]" 1
1320 1 123 TYR HA 1 123 TYR QR . . 4.160 2.906 2.766 3.158 . 0 0 "[ . 1 . 2]" 1
1321 1 123 TYR HA 1 124 VAL MG2 . . 5.500 4.951 4.828 5.048 . 0 0 "[ . 1 . 2]" 1
1322 1 123 TYR HA 1 126 HIS H . . 4.450 3.471 3.240 3.754 . 0 0 "[ . 1 . 2]" 1
1323 1 123 TYR HA 1 126 HIS HB3 . . 4.880 3.764 2.120 4.536 . 0 0 "[ . 1 . 2]" 1
1324 1 123 TYR HA 1 127 PHE H . . 4.900 3.753 3.430 4.140 . 0 0 "[ . 1 . 2]" 1
1325 1 123 TYR HB3 1 124 VAL H . . 4.340 2.614 2.405 2.919 . 0 0 "[ . 1 . 2]" 1
1326 1 123 TYR HB3 1 124 VAL MG2 . . 4.650 3.189 2.915 3.643 . 0 0 "[ . 1 . 2]" 1
1327 1 123 TYR QR 1 124 VAL H . . 4.640 3.462 3.222 3.704 . 0 0 "[ . 1 . 2]" 1
1328 1 123 TYR QR 1 124 VAL HA . . 4.670 3.158 2.927 3.526 . 0 0 "[ . 1 . 2]" 1
1329 1 123 TYR QR 1 124 VAL MG1 . . 5.090 4.596 4.367 4.891 . 0 0 "[ . 1 . 2]" 1
1330 1 123 TYR QR 1 124 VAL MG2 . . 4.060 3.140 2.834 3.245 . 0 0 "[ . 1 . 2]" 1
1331 1 123 TYR QR 1 127 PHE H . . 5.500 4.302 3.966 4.484 . 0 0 "[ . 1 . 2]" 1
1332 1 123 TYR QR 1 139 VAL HB . . 5.440 4.546 2.181 5.526 0.086 1 0 "[ . 1 . 2]" 1
1333 1 123 TYR QR 1 139 VAL QG . . 3.170 2.308 1.874 2.883 . 0 0 "[ . 1 . 2]" 1
1334 1 123 TYR QD 1 124 VAL H . . 4.280 3.493 3.244 3.744 . 0 0 "[ . 1 . 2]" 1
1335 1 123 TYR QD 1 124 VAL HA . . 3.750 3.211 2.968 3.596 . 0 0 "[ . 1 . 2]" 1
1336 1 123 TYR QD 1 124 VAL MG2 . . 3.170 3.181 2.872 3.287 0.117 15 0 "[ . 1 . 2]" 1
1337 1 123 TYR QE 1 127 PHE QD . . 4.470 4.170 3.299 4.565 0.095 1 0 "[ . 1 . 2]" 1
1338 1 123 TYR QE 1 139 VAL QG . . 3.440 2.625 2.070 3.408 . 0 0 "[ . 1 . 2]" 1
1339 1 124 VAL H 1 124 VAL HB . . 3.390 2.488 2.230 2.623 . 0 0 "[ . 1 . 2]" 1
1340 1 124 VAL H 1 124 VAL MG1 . . 3.880 3.736 3.676 3.771 . 0 0 "[ . 1 . 2]" 1
1341 1 124 VAL H 1 124 VAL MG2 . . 3.110 2.012 1.888 2.158 . 0 0 "[ . 1 . 2]" 1
1342 1 124 VAL H 1 125 SER H . . 3.790 2.784 2.572 2.917 . 0 0 "[ . 1 . 2]" 1
1343 1 124 VAL H 1 139 VAL QG . . 4.830 3.976 3.592 4.208 . 0 0 "[ . 1 . 2]" 1
1344 1 124 VAL HA 1 124 VAL MG1 . . 3.220 2.439 2.315 2.612 . 0 0 "[ . 1 . 2]" 1
1345 1 124 VAL HA 1 124 VAL MG2 . . 3.290 2.437 2.338 2.544 . 0 0 "[ . 1 . 2]" 1
1346 1 124 VAL HA 1 126 HIS H . . 5.500 4.770 4.402 5.014 . 0 0 "[ . 1 . 2]" 1
1347 1 124 VAL HA 1 139 VAL HB . . 4.520 3.958 3.396 4.570 0.050 5 0 "[ . 1 . 2]" 1
1348 1 124 VAL HA 1 139 VAL QG . . 3.480 2.139 1.975 2.331 . 0 0 "[ . 1 . 2]" 1
1349 1 124 VAL HB 1 125 SER H . . 3.360 2.643 2.251 3.163 . 0 0 "[ . 1 . 2]" 1
1350 1 124 VAL HB 1 125 SER HA . . 5.090 4.429 4.071 4.769 . 0 0 "[ . 1 . 2]" 1
1351 1 124 VAL HB 1 125 SER HB3 . . 5.280 5.220 4.890 5.362 0.082 9 0 "[ . 1 . 2]" 1
1352 1 124 VAL MG1 1 125 SER H . . 3.730 3.526 3.252 3.828 0.098 8 0 "[ . 1 . 2]" 1
1353 1 124 VAL MG1 1 125 SER HA . . 4.080 3.656 3.461 4.063 . 0 0 "[ . 1 . 2]" 1
1354 1 124 VAL MG1 1 125 SER HB3 . . 5.340 5.380 4.945 5.434 0.094 15 0 "[ . 1 . 2]" 1
1355 1 124 VAL MG1 1 126 HIS H . . 5.500 5.318 5.111 5.537 0.037 13 0 "[ . 1 . 2]" 1
1356 1 124 VAL MG1 1 128 ASN HD21 . . 3.740 2.950 2.249 3.789 0.049 12 0 "[ . 1 . 2]" 1
1357 1 124 VAL MG1 1 128 ASN HD22 . . 3.680 3.177 2.500 3.832 0.152 4 0 "[ . 1 . 2]" 1
1358 1 124 VAL MG2 1 125 SER H . . 4.280 3.878 3.656 4.204 . 0 0 "[ . 1 . 2]" 1
1359 1 124 VAL MG2 1 139 VAL H . . 5.250 5.132 4.284 5.365 0.115 16 0 "[ . 1 . 2]" 1
1360 1 125 SER H 1 125 SER HB3 . . 3.310 2.888 2.274 3.385 0.075 14 0 "[ . 1 . 2]" 1
1361 1 125 SER H 1 126 HIS H . . 3.470 2.572 2.184 2.784 . 0 0 "[ . 1 . 2]" 1
1362 1 125 SER H 1 127 PHE H . . 4.770 4.119 3.615 4.448 . 0 0 "[ . 1 . 2]" 1
1363 1 125 SER HA 1 127 PHE H . . 5.200 4.541 4.129 4.993 . 0 0 "[ . 1 . 2]" 1
1364 1 125 SER HA 1 128 ASN HB3 . . 4.350 4.330 4.134 4.424 0.074 12 0 "[ . 1 . 2]" 1
1365 1 125 SER HA 1 128 ASN HD21 . . 4.570 3.019 2.426 3.300 . 0 0 "[ . 1 . 2]" 1
1366 1 125 SER HA 1 128 ASN HD22 . . 4.720 4.582 4.054 4.793 0.073 3 0 "[ . 1 . 2]" 1
1367 1 125 SER HB3 1 126 HIS H . . 3.740 2.825 2.281 3.542 . 0 0 "[ . 1 . 2]" 1
1368 1 126 HIS H 1 126 HIS HB3 . . 3.970 3.300 2.000 3.607 . 0 0 "[ . 1 . 2]" 1
1369 1 126 HIS H 1 126 HIS HD2 . . 4.500 3.572 2.747 4.600 0.100 17 0 "[ . 1 . 2]" 1
1370 1 126 HIS H 1 127 PHE H . . 3.560 2.839 2.466 3.175 . 0 0 "[ . 1 . 2]" 1
1371 1 126 HIS H 1 128 ASN H . . 4.930 4.305 4.067 4.429 . 0 0 "[ . 1 . 2]" 1
1372 1 126 HIS HA 1 129 GLU H . . 3.840 3.679 3.337 3.903 0.063 13 0 "[ . 1 . 2]" 1
1373 1 126 HIS HA 1 130 TRP H . . 4.810 4.528 3.962 4.876 0.066 12 0 "[ . 1 . 2]" 1
1374 1 126 HIS HB3 1 127 PHE H . . 4.510 3.476 2.349 3.865 . 0 0 "[ . 1 . 2]" 1
1375 1 127 PHE H 1 127 PHE HB3 . . 3.670 2.470 2.246 2.709 . 0 0 "[ . 1 . 2]" 1
1376 1 127 PHE H 1 127 PHE QD . . 4.190 4.184 4.023 4.247 0.057 4 0 "[ . 1 . 2]" 1
1377 1 127 PHE H 1 128 ASN H . . 3.690 2.703 2.601 2.814 . 0 0 "[ . 1 . 2]" 1
1378 1 127 PHE H 1 129 GLU H . . 5.030 4.332 4.154 4.470 . 0 0 "[ . 1 . 2]" 1
1379 1 127 PHE H 1 139 VAL QG . . 5.500 4.363 3.993 4.852 . 0 0 "[ . 1 . 2]" 1
1380 1 127 PHE HA 1 127 PHE QD . . 3.540 2.256 2.048 2.550 . 0 0 "[ . 1 . 2]" 1
1381 1 127 PHE HA 1 129 GLU H . . 5.500 4.399 4.067 4.620 . 0 0 "[ . 1 . 2]" 1
1382 1 127 PHE HA 1 130 TRP H . . 4.500 3.260 3.048 3.539 . 0 0 "[ . 1 . 2]" 1
1383 1 127 PHE HA 1 131 ALA MB . . 5.010 3.967 3.426 4.422 . 0 0 "[ . 1 . 2]" 1
1384 1 127 PHE HB3 1 128 ASN H . . 3.860 2.738 2.461 3.196 . 0 0 "[ . 1 . 2]" 1
1385 1 127 PHE HB3 1 139 VAL QG . . 4.910 2.865 2.395 3.503 . 0 0 "[ . 1 . 2]" 1
1386 1 127 PHE QD 1 128 ASN H . . 4.320 3.995 2.962 4.392 0.072 17 0 "[ . 1 . 2]" 1
1387 1 127 PHE QD 1 128 ASN HA . . 4.500 4.298 3.386 4.587 0.087 5 0 "[ . 1 . 2]" 1
1388 1 127 PHE QD 1 130 TRP H . . 4.600 4.653 4.431 4.703 0.103 7 0 "[ . 1 . 2]" 1
1389 1 127 PHE QD 1 139 VAL QG . . 3.000 2.142 1.864 2.679 . 0 0 "[ . 1 . 2]" 1
1390 1 127 PHE QE 1 131 ALA HA . . 4.980 4.752 4.361 5.037 0.057 4 0 "[ . 1 . 2]" 1
1391 1 127 PHE QE 1 136 VAL QG . . 3.180 2.393 1.981 3.133 . 0 0 "[ . 1 . 2]" 1
1392 1 128 ASN H 1 128 ASN HB3 . . 3.770 3.558 3.467 3.628 . 0 0 "[ . 1 . 2]" 1
1393 1 128 ASN H 1 128 ASN HD21 . . 4.740 3.172 2.407 4.093 . 0 0 "[ . 1 . 2]" 1
1394 1 128 ASN H 1 128 ASN HD22 . . 4.720 4.368 3.908 4.793 0.073 8 0 "[ . 1 . 2]" 1
1395 1 128 ASN H 1 129 GLU H . . 3.640 2.830 2.626 2.955 . 0 0 "[ . 1 . 2]" 1
1396 1 128 ASN H 1 131 ALA MB . . 4.740 4.726 4.330 4.839 0.099 17 0 "[ . 1 . 2]" 1
1397 1 128 ASN H 1 139 VAL QG . . 5.500 4.235 3.625 4.624 . 0 0 "[ . 1 . 2]" 1
1398 1 128 ASN HA 1 131 ALA MB . . 3.360 3.141 2.472 3.453 0.093 3 0 "[ . 1 . 2]" 1
1399 1 128 ASN HD21 1 139 VAL QG . . 5.500 3.978 2.798 5.213 . 0 0 "[ . 1 . 2]" 1
1400 1 128 ASN HD22 1 136 VAL QG . . 5.500 4.125 3.402 5.332 . 0 0 "[ . 1 . 2]" 1
1401 1 128 ASN HD22 1 139 VAL QG . . 5.340 3.588 2.402 4.419 . 0 0 "[ . 1 . 2]" 1
1402 1 129 GLU H 1 129 GLU HB3 . . 3.520 3.479 1.732 3.599 0.079 11 0 "[ . 1 . 2]" 1
1403 1 129 GLU H 1 129 GLU HG3 . . 3.900 3.531 2.257 4.002 0.102 15 0 "[ . 1 . 2]" 1
1404 1 129 GLU H 1 130 TRP H . . 3.480 2.701 2.376 2.952 . 0 0 "[ . 1 . 2]" 1
1405 1 129 GLU H 1 131 ALA H . . 4.880 4.122 3.874 4.418 . 0 0 "[ . 1 . 2]" 1
1406 1 129 GLU H 1 131 ALA MB . . 5.500 5.129 4.794 5.349 . 0 0 "[ . 1 . 2]" 1
1407 1 129 GLU HA 1 129 GLU HG3 . . 3.730 3.611 2.745 3.815 0.085 18 0 "[ . 1 . 2]" 1
1408 1 129 GLU HA 1 131 ALA H . . 3.920 3.980 3.839 4.009 0.089 14 0 "[ . 1 . 2]" 1
1409 1 129 GLU HA 1 132 ASP H . . 4.740 3.985 3.220 4.449 . 0 0 "[ . 1 . 2]" 1
1410 1 129 GLU HA 1 132 ASP HB3 . . 4.610 4.216 3.487 4.672 0.062 3 0 "[ . 1 . 2]" 1
1411 1 129 GLU HB3 1 130 TRP H . . 3.790 3.739 2.608 3.874 0.084 12 0 "[ . 1 . 2]" 1
1412 1 129 GLU HB3 1 130 TRP HD1 . . 4.410 2.901 2.310 3.930 . 0 0 "[ . 1 . 2]" 1
1413 1 129 GLU HG3 1 130 TRP H . . 5.270 4.969 3.558 5.339 0.069 10 0 "[ . 1 . 2]" 1
1414 1 129 GLU HG3 1 130 TRP HD1 . . 4.740 4.610 2.437 5.056 0.316 3 0 "[ . 1 . 2]" 1
1415 1 130 TRP H 1 130 TRP HD1 . . 3.600 3.077 2.808 3.353 . 0 0 "[ . 1 . 2]" 1
1416 1 130 TRP H 1 131 ALA H . . 3.370 2.496 2.290 2.683 . 0 0 "[ . 1 . 2]" 1
1417 1 130 TRP H 1 131 ALA MB . . 4.970 4.006 3.795 4.285 . 0 0 "[ . 1 . 2]" 1
1418 1 130 TRP H 1 132 ASP H . . 5.000 4.227 3.919 4.668 . 0 0 "[ . 1 . 2]" 1
1419 1 130 TRP HA 1 130 TRP HD1 . . 2.830 2.524 2.213 2.909 0.079 17 0 "[ . 1 . 2]" 1
1420 1 130 TRP HA 1 130 TRP HE1 . . 4.900 4.762 4.567 4.953 0.053 6 0 "[ . 1 . 2]" 1
1421 1 130 TRP HA 1 131 ALA HA . . 4.670 4.573 4.468 4.728 0.058 20 0 "[ . 1 . 2]" 1
1422 1 130 TRP HA 1 132 ASP H . . 4.770 4.156 3.699 4.564 . 0 0 "[ . 1 . 2]" 1
1423 1 130 TRP HD1 1 131 ALA H . . 5.170 4.855 4.725 4.981 . 0 0 "[ . 1 . 2]" 1
1424 1 131 ALA H 1 131 ALA MB . . 3.040 2.485 2.289 2.710 . 0 0 "[ . 1 . 2]" 1
1425 1 131 ALA H 1 132 ASP H . . 3.430 2.172 1.726 2.687 . 0 0 "[ . 1 . 2]" 1
1426 1 131 ALA HA 1 134 LEU H . . 5.120 4.740 4.222 5.178 0.058 15 0 "[ . 1 . 2]" 1
1427 1 131 ALA MB 1 132 ASP H . . 4.350 3.367 2.718 3.707 . 0 0 "[ . 1 . 2]" 1
1428 1 131 ALA MB 1 133 GLY H . . 5.500 4.472 3.894 5.212 . 0 0 "[ . 1 . 2]" 1
1429 1 131 ALA MB 1 134 LEU H . . 4.290 4.111 3.727 4.339 0.049 8 0 "[ . 1 . 2]" 1
1430 1 132 ASP H 1 132 ASP HB3 . . 3.260 2.556 2.305 2.809 . 0 0 "[ . 1 . 2]" 1
1431 1 132 ASP H 1 133 GLY H . . 4.380 4.080 3.634 4.456 0.076 15 0 "[ . 1 . 2]" 1
1432 1 132 ASP H 1 134 LEU H . . 5.320 5.142 4.750 5.393 0.073 5 0 "[ . 1 . 2]" 1
1433 1 132 ASP HA 1 133 GLY H . . 2.720 2.261 2.041 2.680 . 0 0 "[ . 1 . 2]" 1
1434 1 132 ASP HA 1 133 GLY HA3 . . 4.340 4.563 4.409 4.796 0.456 12 0 "[ . 1 . 2]" 1
1435 1 132 ASP HB3 1 133 GLY H . . 4.200 4.290 4.168 4.514 0.314 2 0 "[ . 1 . 2]" 1
1436 1 133 GLY H 1 134 LEU H . . 3.270 2.127 1.798 2.663 . 0 0 "[ . 1 . 2]" 1
1437 1 133 GLY H 1 134 LEU HG . . 5.260 5.205 4.931 5.352 0.092 9 0 "[ . 1 . 2]" 1
1438 1 134 LEU H 1 134 LEU HB3 . . 3.770 3.615 3.396 3.842 0.072 5 0 "[ . 1 . 2]" 1
1439 1 134 LEU H 1 134 LEU QD . . 3.850 2.734 1.855 3.585 . 0 0 "[ . 1 . 2]" 1
1440 1 134 LEU H 1 134 LEU HG . . 3.560 3.364 2.594 3.654 0.094 18 0 "[ . 1 . 2]" 1
1441 1 134 LEU H 1 135 ASN H . . 4.970 4.503 4.375 4.669 . 0 0 "[ . 1 . 2]" 1
1442 1 134 LEU HA 1 134 LEU QD . . 3.050 2.256 2.092 2.443 . 0 0 "[ . 1 . 2]" 1
1443 1 134 LEU HA 1 135 ASN H . . 3.160 2.321 2.145 2.478 . 0 0 "[ . 1 . 2]" 1
1444 1 134 LEU HB3 1 135 ASN H . . 3.680 2.674 2.359 3.084 . 0 0 "[ . 1 . 2]" 1
1445 1 134 LEU QD 1 135 ASN H . . 3.900 3.422 3.022 3.780 . 0 0 "[ . 1 . 2]" 1
1446 1 134 LEU HG 1 135 ASN H . . 5.500 4.929 4.725 5.318 . 0 0 "[ . 1 . 2]" 1
1447 1 135 ASN H 1 135 ASN HB3 . . 3.520 2.527 2.338 2.720 . 0 0 "[ . 1 . 2]" 1
1448 1 135 ASN H 1 135 ASN HD21 . . 5.060 4.665 4.393 4.887 . 0 0 "[ . 1 . 2]" 1
1449 1 135 ASN H 1 136 VAL H . . 4.590 4.255 3.755 4.665 0.075 14 0 "[ . 1 . 2]" 1
1450 1 135 ASN H 1 136 VAL QG . . 5.150 4.573 4.002 4.948 . 0 0 "[ . 1 . 2]" 1
1451 1 135 ASN HA 1 136 VAL H . . 2.920 2.292 2.170 2.476 . 0 0 "[ . 1 . 2]" 1
1452 1 135 ASN HB3 1 136 VAL H . . 4.480 4.391 3.452 4.539 0.059 9 0 "[ . 1 . 2]" 1
1453 1 135 ASN HB3 1 137 ILE MG . . 5.390 4.262 3.929 4.673 . 0 0 "[ . 1 . 2]" 1
1454 1 135 ASN HD21 1 136 VAL HA . . 5.000 4.886 4.222 5.086 0.086 4 0 "[ . 1 . 2]" 1
1455 1 135 ASN HD21 1 137 ILE MG . . 5.290 2.760 2.102 3.183 . 0 0 "[ . 1 . 2]" 1
1456 1 135 ASN HD22 1 136 VAL H . . 5.500 5.267 3.691 5.563 0.063 10 0 "[ . 1 . 2]" 1
1457 1 135 ASN HD22 1 137 ILE H . . 5.500 5.320 4.757 5.577 0.077 16 0 "[ . 1 . 2]" 1
1458 1 135 ASN HD22 1 137 ILE MG . . 4.040 2.283 1.984 2.572 . 0 0 "[ . 1 . 2]" 1
1459 1 136 VAL H 1 136 VAL HB . . 2.920 2.667 2.371 2.994 0.074 13 0 "[ . 1 . 2]" 1
1460 1 136 VAL H 1 136 VAL QG . . 3.220 2.388 1.808 3.053 . 0 0 "[ . 1 . 2]" 1
1461 1 136 VAL H 1 137 ILE H . . 4.830 4.448 4.099 4.598 . 0 0 "[ . 1 . 2]" 1
1462 1 136 VAL HA 1 136 VAL QG . . 3.110 2.216 2.092 2.456 . 0 0 "[ . 1 . 2]" 1
1463 1 136 VAL HA 1 137 ILE H . . 3.020 2.151 2.034 2.271 . 0 0 "[ . 1 . 2]" 1
1464 1 136 VAL HA 1 137 ILE MG . . 3.990 3.712 3.386 4.038 0.048 19 0 "[ . 1 . 2]" 1
1465 1 136 VAL HA 1 138 GLY H . . 3.960 3.634 3.375 3.889 . 0 0 "[ . 1 . 2]" 1
1466 1 136 VAL HB 1 137 ILE H . . 4.960 4.185 3.774 4.490 . 0 0 "[ . 1 . 2]" 1
1467 1 136 VAL HB 1 138 GLY H . . 5.010 4.621 4.191 5.003 . 0 0 "[ . 1 . 2]" 1
1468 1 136 VAL QG 1 137 ILE H . . 3.560 2.732 2.405 3.127 . 0 0 "[ . 1 . 2]" 1
1469 1 136 VAL QG 1 138 GLY H . . 3.040 2.272 2.042 2.637 . 0 0 "[ . 1 . 2]" 1
1470 1 136 VAL QG 1 139 VAL H . . 5.500 4.485 4.107 5.077 . 0 0 "[ . 1 . 2]" 1
1471 1 137 ILE H 1 137 ILE HB . . 4.170 3.803 3.645 3.917 . 0 0 "[ . 1 . 2]" 1
1472 1 137 ILE H 1 137 ILE MD . . 3.630 2.617 1.838 3.716 0.086 6 0 "[ . 1 . 2]" 1
1473 1 137 ILE H 1 137 ILE MG . . 3.290 2.863 2.385 3.164 . 0 0 "[ . 1 . 2]" 1
1474 1 137 ILE H 1 138 GLY H . . 3.350 2.210 1.945 2.488 . 0 0 "[ . 1 . 2]" 1
1475 1 137 ILE H 1 138 GLY HA3 . . 5.500 4.490 4.136 4.965 . 0 0 "[ . 1 . 2]" 1
1476 1 137 ILE HA 1 137 ILE HB . . 2.870 2.419 2.278 2.545 . 0 0 "[ . 1 . 2]" 1
1477 1 137 ILE HA 1 137 ILE MD . . 4.180 3.721 3.602 4.141 . 0 0 "[ . 1 . 2]" 1
1478 1 137 ILE HA 1 137 ILE MG . . 2.940 2.325 2.192 2.484 . 0 0 "[ . 1 . 2]" 1
1479 1 137 ILE HB 1 137 ILE MD . . 3.200 2.734 2.270 3.276 0.076 9 0 "[ . 1 . 2]" 1
1480 1 137 ILE HB 1 138 GLY H . . 4.570 4.447 4.230 4.575 0.005 7 0 "[ . 1 . 2]" 1
1481 1 137 ILE HB 1 149 TRP HD1 . . 5.150 4.296 3.634 4.946 . 0 0 "[ . 1 . 2]" 1
1482 1 137 ILE MD 1 138 GLY H . . 4.260 3.079 2.345 4.318 0.058 6 0 "[ . 1 . 2]" 1
1483 1 137 ILE MD 1 138 GLY HA2 . . 5.250 4.310 3.590 5.242 . 0 0 "[ . 1 . 2]" 1
1484 1 137 ILE MD 1 149 TRP HA . . 3.500 2.950 2.130 3.575 0.075 9 0 "[ . 1 . 2]" 1
1485 1 137 ILE MD 1 149 TRP HD1 . . 3.300 2.518 2.074 3.344 0.044 10 0 "[ . 1 . 2]" 1
1486 1 137 ILE MD 1 149 TRP HE1 . . 4.900 3.688 3.083 4.288 . 0 0 "[ . 1 . 2]" 1
1487 1 137 ILE MG 1 138 GLY H . . 4.320 4.351 4.208 4.419 0.099 13 0 "[ . 1 . 2]" 1
1488 1 138 GLY H 1 139 VAL H . . 4.410 4.198 3.911 4.342 . 0 0 "[ . 1 . 2]" 1
1489 1 138 GLY H 1 139 VAL HA . . 5.500 5.003 4.674 5.290 . 0 0 "[ . 1 . 2]" 1
1490 1 138 GLY H 1 149 TRP HE1 . . 5.360 4.462 3.875 5.115 . 0 0 "[ . 1 . 2]" 1
1491 1 138 GLY HA2 1 139 VAL H . . 3.000 2.227 2.087 2.374 . 0 0 "[ . 1 . 2]" 1
1492 1 138 GLY HA2 1 139 VAL QG . . 4.700 3.629 3.061 3.996 . 0 0 "[ . 1 . 2]" 1
1493 1 138 GLY HA2 1 149 TRP HE1 . . 3.980 2.964 2.034 3.884 . 0 0 "[ . 1 . 2]" 1
1494 1 138 GLY HA2 1 149 TRP HZ2 . . 4.500 3.746 2.874 4.577 0.077 16 0 "[ . 1 . 2]" 1
1495 1 138 GLY HA3 1 139 VAL H . . 3.220 3.074 2.746 3.303 0.083 12 0 "[ . 1 . 2]" 1
1496 1 138 GLY HA3 1 139 VAL QG . . 5.300 4.191 3.933 4.348 . 0 0 "[ . 1 . 2]" 1
1497 1 138 GLY HA3 1 149 TRP HE1 . . 3.600 2.274 1.778 2.867 . 0 0 "[ . 1 . 2]" 1
1498 1 138 GLY HA3 1 149 TRP HZ2 . . 4.050 3.152 2.364 3.593 . 0 0 "[ . 1 . 2]" 1
1499 1 139 VAL H 1 139 VAL HB . . 3.480 3.097 2.687 3.575 0.095 15 0 "[ . 1 . 2]" 1
1500 1 139 VAL H 1 139 VAL QG . . 3.780 2.857 1.955 3.047 . 0 0 "[ . 1 . 2]" 1
1501 1 139 VAL H 1 140 ALA H . . 4.530 3.685 3.222 4.155 . 0 0 "[ . 1 . 2]" 1
1502 1 139 VAL H 1 140 ALA MB . . 5.260 3.629 3.274 3.981 . 0 0 "[ . 1 . 2]" 1
1503 1 139 VAL H 1 149 TRP HE1 . . 4.730 4.254 3.690 4.788 0.058 2 0 "[ . 1 . 2]" 1
1504 1 139 VAL H 1 149 TRP HZ2 . . 4.220 3.359 2.380 4.082 . 0 0 "[ . 1 . 2]" 1
1505 1 139 VAL HA 1 140 ALA H . . 3.110 2.246 2.071 2.362 . 0 0 "[ . 1 . 2]" 1
1506 1 139 VAL HA 1 140 ALA HA . . 5.160 4.471 4.364 4.570 . 0 0 "[ . 1 . 2]" 1
1507 1 139 VAL HA 1 140 ALA MB . . 4.710 4.144 3.826 4.287 . 0 0 "[ . 1 . 2]" 1
1508 1 139 VAL HA 1 149 TRP HH2 . . 4.710 4.494 3.404 4.790 0.080 6 0 "[ . 1 . 2]" 1
1509 1 139 VAL HB 1 140 ALA H . . 4.680 4.401 3.895 4.583 . 0 0 "[ . 1 . 2]" 1
1510 1 139 VAL QG 1 140 ALA H . . 3.810 3.268 2.324 3.612 . 0 0 "[ . 1 . 2]" 1
1511 1 140 ALA H 1 140 ALA MB . . 3.590 2.643 2.456 2.761 . 0 0 "[ . 1 . 2]" 1
1512 1 140 ALA H 1 141 ARG H . . 5.010 4.403 4.253 4.573 . 0 0 "[ . 1 . 2]" 1
1513 1 140 ALA H 1 149 TRP HH2 . . 3.560 2.956 2.328 3.651 0.091 4 0 "[ . 1 . 2]" 1
1514 1 140 ALA H 1 149 TRP HZ2 . . 3.750 3.275 2.303 3.806 0.056 14 0 "[ . 1 . 2]" 1
1515 1 140 ALA HA 1 141 ARG H . . 3.100 2.580 2.288 2.943 . 0 0 "[ . 1 . 2]" 1
1516 1 140 ALA MB 1 141 ARG H . . 3.220 2.348 1.981 2.702 . 0 0 "[ . 1 . 2]" 1
1517 1 140 ALA MB 1 141 ARG HA . . 5.030 4.206 4.029 4.371 . 0 0 "[ . 1 . 2]" 1
1518 1 140 ALA MB 1 144 SER H . . 5.330 4.361 3.678 4.953 . 0 0 "[ . 1 . 2]" 1
1519 1 140 ALA MB 1 144 SER HB3 . . 5.230 3.776 2.299 4.943 . 0 0 "[ . 1 . 2]" 1
1520 1 140 ALA MB 1 145 GLU H . . 3.970 3.814 3.407 4.073 0.103 6 0 "[ . 1 . 2]" 1
1521 1 140 ALA MB 1 145 GLU HA . . 5.120 4.881 4.518 5.185 0.065 6 0 "[ . 1 . 2]" 1
1522 1 140 ALA MB 1 145 GLU HB3 . . 3.390 3.822 3.299 4.156 0.766 13 7 "[- *.* 1 +*.** 2]" 1
1523 1 140 ALA MB 1 145 GLU HG3 . . 3.320 2.344 2.123 2.633 . 0 0 "[ . 1 . 2]" 1
1524 1 140 ALA MB 1 149 TRP HE1 . . 4.780 4.643 4.195 4.875 0.095 2 0 "[ . 1 . 2]" 1
1525 1 140 ALA MB 1 149 TRP HH2 . . 3.740 2.348 2.090 3.323 . 0 0 "[ . 1 . 2]" 1
1526 1 140 ALA MB 1 149 TRP HZ2 . . 3.250 2.478 2.188 2.944 . 0 0 "[ . 1 . 2]" 1
1527 1 141 ARG H 1 141 ARG HB3 . . 3.620 2.694 2.290 3.205 . 0 0 "[ . 1 . 2]" 1
1528 1 141 ARG H 1 141 ARG HG3 . . 4.430 3.802 3.021 4.550 0.120 15 0 "[ . 1 . 2]" 1
1529 1 141 ARG H 1 142 ASP H . . 4.940 4.474 4.256 4.631 . 0 0 "[ . 1 . 2]" 1
1530 1 141 ARG H 1 144 SER HB3 . . 5.470 4.985 3.244 5.536 0.066 10 0 "[ . 1 . 2]" 1
1531 1 141 ARG HA 1 141 ARG HG3 . . 3.990 3.487 2.454 4.155 0.165 5 0 "[ . 1 . 2]" 1
1532 1 141 ARG HA 1 142 ASP H . . 3.220 2.262 2.097 2.386 . 0 0 "[ . 1 . 2]" 1
1533 1 141 ARG HA 1 142 ASP HA . . 4.630 4.401 4.248 4.563 . 0 0 "[ . 1 . 2]" 1
1534 1 141 ARG HB3 1 142 ASP H . . 4.940 3.895 3.648 4.174 . 0 0 "[ . 1 . 2]" 1
1535 1 141 ARG HG3 1 142 ASP H . . 4.560 3.489 2.486 4.463 . 0 0 "[ . 1 . 2]" 1
1536 1 142 ASP H 1 143 ASP H . . 5.500 4.632 4.145 4.767 . 0 0 "[ . 1 . 2]" 1
1537 1 142 ASP HA 1 143 ASP HA . . 4.430 4.459 4.315 4.532 0.102 14 0 "[ . 1 . 2]" 1
1538 1 143 ASP H 1 144 SER H . . 3.600 2.756 2.173 3.665 0.065 11 0 "[ . 1 . 2]" 1
1539 1 143 ASP HA 1 146 VAL H . . 4.590 3.877 3.407 4.662 0.072 14 0 "[ . 1 . 2]" 1
1540 1 143 ASP HA 1 146 VAL HB . . 5.000 4.560 3.846 5.064 0.064 14 0 "[ . 1 . 2]" 1
1541 1 143 ASP HA 1 146 VAL MG2 . . 3.280 2.293 2.059 2.661 . 0 0 "[ . 1 . 2]" 1
1542 1 143 ASP HB3 1 144 SER H . . 5.250 4.585 4.123 4.700 . 0 0 "[ . 1 . 2]" 1
1543 1 143 ASP HB3 1 146 VAL MG2 . . 3.910 3.033 2.416 3.646 . 0 0 "[ . 1 . 2]" 1
1544 1 144 SER H 1 144 SER HB3 . . 3.200 2.777 2.223 3.485 0.285 15 0 "[ . 1 . 2]" 1
1545 1 144 SER H 1 145 GLU H . . 3.820 2.681 1.750 3.166 . 0 0 "[ . 1 . 2]" 1
1546 1 144 SER H 1 145 GLU HG3 . . 5.490 4.291 3.703 4.726 . 0 0 "[ . 1 . 2]" 1
1547 1 144 SER H 1 146 VAL H . . 5.120 4.357 3.253 5.203 0.083 14 0 "[ . 1 . 2]" 1
1548 1 144 SER H 1 146 VAL MG2 . . 5.500 4.070 3.005 4.592 . 0 0 "[ . 1 . 2]" 1
1549 1 144 SER HA 1 145 GLU HG3 . . 5.120 4.973 4.507 5.266 0.146 9 0 "[ . 1 . 2]" 1
1550 1 144 SER HA 1 146 VAL H . . 4.850 4.232 3.805 4.924 0.074 14 0 "[ . 1 . 2]" 1
1551 1 144 SER HB3 1 145 GLU H . . 4.020 3.371 2.978 4.140 0.120 15 0 "[ . 1 . 2]" 1
1552 1 144 SER HB3 1 145 GLU HG3 . . 5.180 2.941 2.233 3.769 . 0 0 "[ . 1 . 2]" 1
1553 1 145 GLU H 1 145 GLU HB3 . . 3.660 3.815 3.655 3.972 0.312 17 0 "[ . 1 . 2]" 1
1554 1 145 GLU H 1 145 GLU HG3 . . 4.250 2.994 2.610 3.287 . 0 0 "[ . 1 . 2]" 1
1555 1 145 GLU H 1 146 VAL H . . 3.120 2.370 2.124 3.179 0.059 14 0 "[ . 1 . 2]" 1
1556 1 145 GLU H 1 146 VAL HA . . 4.670 4.444 4.174 4.725 0.055 18 0 "[ . 1 . 2]" 1
1557 1 145 GLU H 1 146 VAL MG2 . . 4.190 3.137 2.817 3.565 . 0 0 "[ . 1 . 2]" 1
1558 1 145 GLU H 1 147 ASP H . . 5.280 4.703 4.332 5.213 . 0 0 "[ . 1 . 2]" 1
1559 1 145 GLU HA 1 145 GLU HG3 . . 3.450 3.442 3.270 3.515 0.065 17 0 "[ . 1 . 2]" 1
1560 1 145 GLU HA 1 147 ASP H . . 4.190 3.563 3.172 4.029 . 0 0 "[ . 1 . 2]" 1
1561 1 145 GLU HA 1 148 LYS H . . 4.070 3.767 3.421 4.150 0.080 6 0 "[ . 1 . 2]" 1
1562 1 145 GLU HA 1 149 TRP H . . 5.500 5.235 4.464 5.571 0.071 3 0 "[ . 1 . 2]" 1
1563 1 145 GLU HB3 1 146 VAL H . . 5.090 4.509 4.363 4.672 . 0 0 "[ . 1 . 2]" 1
1564 1 145 GLU HB3 1 148 LYS H . . 5.500 4.188 3.943 4.500 . 0 0 "[ . 1 . 2]" 1
1565 1 145 GLU HB3 1 149 TRP H . . 5.500 4.928 3.844 5.401 . 0 0 "[ . 1 . 2]" 1
1566 1 145 GLU HB3 1 149 TRP HE1 . . 4.230 3.787 3.012 4.298 0.068 11 0 "[ . 1 . 2]" 1
1567 1 145 GLU HB3 1 149 TRP HH2 . . 4.990 4.905 4.499 5.377 0.387 4 0 "[ . 1 . 2]" 1
1568 1 145 GLU HB3 1 149 TRP HZ2 . . 3.930 3.707 3.300 4.052 0.122 11 0 "[ . 1 . 2]" 1
1569 1 146 VAL H 1 146 VAL HB . . 3.100 2.425 2.264 2.582 . 0 0 "[ . 1 . 2]" 1
1570 1 146 VAL H 1 146 VAL MG1 . . 3.760 3.757 3.709 3.852 0.092 14 0 "[ . 1 . 2]" 1
1571 1 146 VAL H 1 146 VAL MG2 . . 3.230 2.141 1.912 2.550 . 0 0 "[ . 1 . 2]" 1
1572 1 146 VAL H 1 147 ASP H . . 3.290 2.683 2.296 3.110 . 0 0 "[ . 1 . 2]" 1
1573 1 146 VAL H 1 148 LYS H . . 4.940 4.443 4.226 4.721 . 0 0 "[ . 1 . 2]" 1
1574 1 146 VAL H 1 149 TRP H . . 5.500 5.102 4.695 5.318 . 0 0 "[ . 1 . 2]" 1
1575 1 146 VAL HA 1 146 VAL MG1 . . 3.340 2.494 2.364 2.642 . 0 0 "[ . 1 . 2]" 1
1576 1 146 VAL HA 1 146 VAL MG2 . . 3.190 2.380 2.277 2.515 . 0 0 "[ . 1 . 2]" 1
1577 1 146 VAL HA 1 148 LYS H . . 4.360 3.944 3.455 4.423 0.063 15 0 "[ . 1 . 2]" 1
1578 1 146 VAL HA 1 149 TRP H . . 3.380 3.260 2.934 3.464 0.084 2 0 "[ . 1 . 2]" 1
1579 1 146 VAL HA 1 149 TRP HE3 . . 4.050 2.522 2.217 3.409 . 0 0 "[ . 1 . 2]" 1
1580 1 146 VAL HB 1 147 ASP H . . 3.390 2.888 2.605 3.323 . 0 0 "[ . 1 . 2]" 1
1581 1 146 VAL MG1 1 147 ASP H . . 3.800 3.600 3.284 3.881 0.081 1 0 "[ . 1 . 2]" 1
1582 1 146 VAL MG1 1 147 ASP HA . . 3.950 3.716 3.423 4.039 0.089 1 0 "[ . 1 . 2]" 1
1583 1 146 VAL MG1 1 148 LYS H . . 5.500 4.847 4.463 5.304 . 0 0 "[ . 1 . 2]" 1
1584 1 146 VAL MG1 1 149 TRP H . . 4.760 4.353 3.952 4.744 . 0 0 "[ . 1 . 2]" 1
1585 1 146 VAL MG1 1 149 TRP HE3 . . 4.670 3.651 3.070 4.508 . 0 0 "[ . 1 . 2]" 1
1586 1 146 VAL MG1 1 149 TRP HZ3 . . 5.250 4.842 3.922 5.347 0.097 2 0 "[ . 1 . 2]" 1
1587 1 146 VAL MG2 1 147 ASP H . . 4.190 4.000 3.765 4.261 0.071 2 0 "[ . 1 . 2]" 1
1588 1 146 VAL MG2 1 149 TRP HE3 . . 4.130 2.903 2.211 4.201 0.071 2 0 "[ . 1 . 2]" 1
1589 1 146 VAL MG2 1 149 TRP HZ3 . . 4.420 2.965 2.269 3.961 . 0 0 "[ . 1 . 2]" 1
1590 1 147 ASP H 1 148 LYS H . . 3.170 2.880 1.976 3.105 . 0 0 "[ . 1 . 2]" 1
1591 1 147 ASP H 1 149 TRP H . . 4.160 4.173 3.763 4.235 0.075 14 0 "[ . 1 . 2]" 1
1592 1 148 LYS H 1 148 LYS HG3 . . 4.270 2.879 2.539 3.753 . 0 0 "[ . 1 . 2]" 1
1593 1 148 LYS H 1 149 TRP H . . 3.100 2.242 1.863 2.688 . 0 0 "[ . 1 . 2]" 1
1594 1 148 LYS H 1 149 TRP HB3 . . 5.190 5.818 5.378 6.280 1.090 7 9 "[ * ** + 1** *- *2]" 1
1595 1 148 LYS H 1 150 SER H . . 4.320 4.237 3.635 4.391 0.071 1 0 "[ . 1 . 2]" 1
1596 1 148 LYS H 1 151 LYS H . . 4.860 4.931 4.900 4.948 0.088 8 0 "[ . 1 . 2]" 1
1597 1 148 LYS HA 1 148 LYS HG3 . . 3.910 3.633 2.274 3.805 . 0 0 "[ . 1 . 2]" 1
1598 1 148 LYS HA 1 151 LYS H . . 5.060 3.483 3.024 4.016 . 0 0 "[ . 1 . 2]" 1
1599 1 148 LYS HA 1 151 LYS HB3 . . 5.150 4.329 3.260 4.997 . 0 0 "[ . 1 . 2]" 1
1600 1 148 LYS HG3 1 149 TRP HA . . 4.510 4.151 3.717 5.932 1.422 2 1 "[ + . 1 . 2]" 1
1601 1 148 LYS HG3 1 149 TRP HD1 . . 3.800 2.888 2.340 5.014 1.214 2 1 "[ + . 1 . 2]" 1
1602 1 149 TRP H 1 149 TRP HB3 . . 3.360 3.664 3.545 3.769 0.409 13 0 "[ . 1 . 2]" 1
1603 1 149 TRP H 1 149 TRP HD1 . . 3.650 3.526 3.189 3.723 0.073 17 0 "[ . 1 . 2]" 1
1604 1 149 TRP H 1 149 TRP HE1 . . 5.210 5.004 4.676 5.281 0.071 18 0 "[ . 1 . 2]" 1
1605 1 149 TRP H 1 151 LYS H . . 4.760 4.253 4.004 4.515 . 0 0 "[ . 1 . 2]" 1
1606 1 149 TRP HA 1 149 TRP HD1 . . 2.890 2.524 2.287 2.596 . 0 0 "[ . 1 . 2]" 1
1607 1 149 TRP HA 1 149 TRP HE1 . . 4.950 4.990 4.796 5.033 0.083 2 0 "[ . 1 . 2]" 1
1608 1 149 TRP HA 1 151 LYS H . . 4.710 4.524 3.885 4.803 0.093 4 0 "[ . 1 . 2]" 1
1609 1 149 TRP HB3 1 149 TRP HE3 . . 3.400 3.470 3.330 3.627 0.227 7 0 "[ . 1 . 2]" 1
1610 1 149 TRP HB3 1 150 SER H . . 4.100 4.505 4.195 4.621 0.521 11 2 "[ . 1+- . 2]" 1
1611 1 149 TRP HD1 1 150 SER H . . 5.500 5.053 4.748 5.433 . 0 0 "[ . 1 . 2]" 1
1612 1 150 SER H 1 150 SER HB3 . . 3.550 3.109 2.412 3.637 0.087 20 0 "[ . 1 . 2]" 1
1613 1 150 SER H 1 151 LYS H . . 3.180 1.844 1.647 2.443 . 0 0 "[ . 1 . 2]" 1
1614 1 150 SER H 1 151 LYS HB3 . . 5.180 4.790 3.955 5.373 0.193 8 0 "[ . 1 . 2]" 1
1615 1 150 SER HB3 1 151 LYS H . . 4.730 3.197 2.396 4.190 . 0 0 "[ . 1 . 2]" 1
1616 1 151 LYS H 1 151 LYS HB3 . . 3.160 3.205 2.335 3.932 0.772 9 5 "[- *. *+1 * 2]" 1
stop_
save_
Contact the webmaster for help, if required. Sunday, May 19, 2024 7:33:23 AM GMT (wattos1)