NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
495476 |
2l6n   |
17318 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l6n
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 1735
_Distance_constraint_stats_list.Viol_count 4135
_Distance_constraint_stats_list.Viol_total 13755.820
_Distance_constraint_stats_list.Viol_max 1.738
_Distance_constraint_stats_list.Viol_rms 0.1041
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0198
_Distance_constraint_stats_list.Viol_average_violations_only 0.1663
_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 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 THR 0.323 0.078 13 0 "[ . 1 . 2]"
1 4 PRO 1.272 0.223 2 0 "[ . 1 . 2]"
1 5 GLN 2.065 0.223 2 0 "[ . 1 . 2]"
1 6 SER 1.418 0.095 12 0 "[ . 1 . 2]"
1 7 ASP 2.056 0.088 12 0 "[ . 1 . 2]"
1 8 THR 5.401 0.096 1 0 "[ . 1 . 2]"
1 9 PRO 5.219 0.090 11 0 "[ . 1 . 2]"
1 10 LYS 11.826 0.591 8 9 "[** * -+ 1 * ***2]"
1 11 VAL 0.306 0.073 13 0 "[ . 1 . 2]"
1 12 THR 4.274 0.326 5 0 "[ . 1 . 2]"
1 13 GLY 3.191 0.477 16 0 "[ . 1 . 2]"
1 14 LEU 8.814 0.547 20 2 "[ -. 1 . +]"
1 15 LYS 17.796 0.942 14 19 [************-+.*****]
1 16 LEU 24.022 0.942 14 19 [************-+.*****]
1 17 LYS 17.736 0.990 4 20 [*-*+****************]
1 18 ARG 1.223 0.087 4 0 "[ . 1 . 2]"
1 19 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 SER 1.680 0.885 12 1 "[ . 1 + . 2]"
1 21 ARG 3.334 0.602 9 2 "[ - . +1 . 2]"
1 22 GLN 5.233 0.885 12 3 "[ . *1 + . -2]"
1 23 LEU 2.688 0.093 18 0 "[ . 1 . 2]"
1 24 GLU 14.340 0.714 3 14 "[ *+*** ******- **]"
1 25 ILE 54.241 1.092 18 20 [**************-**+**]
1 26 SER 15.914 0.772 13 10 "[* *.*** 1-*+ .* *]"
1 27 PHE 3.764 0.731 20 1 "[ . 1 . +]"
1 28 ASP 4.046 0.116 13 0 "[ . 1 . 2]"
1 29 ASN 2.488 0.509 3 1 "[ + . 1 . 2]"
1 30 GLY 1.153 0.094 20 0 "[ . 1 . 2]"
1 31 GLN 5.197 1.368 20 1 "[ . 1 . +]"
1 32 GLN 19.114 0.772 13 10 "[* *.*** 1-*+ .* *]"
1 33 PHE 62.413 1.387 8 20 [*******+*****-******]
1 34 THR 4.289 0.383 19 0 "[ . 1 . 2]"
1 35 LEU 6.704 0.112 11 0 "[ . 1 . 2]"
1 36 SER 6.858 0.825 11 1 "[ . 1+ . 2]"
1 37 CYS 4.813 0.602 9 2 "[ - . +1 . 2]"
1 38 GLU 3.194 0.825 11 1 "[ . 1+ . 2]"
1 39 LEU 2.823 0.118 7 0 "[ . 1 . 2]"
1 40 LEU 1.603 0.092 10 0 "[ . 1 . 2]"
1 41 ARG 6.635 1.144 8 6 "[ **. +-1 * .* 2]"
1 42 VAL 6.624 0.953 18 3 "[ . 1 - *+ 2]"
1 43 TYR 14.382 1.111 20 7 "[ *-. 1 **** +]"
1 44 SER 3.123 0.215 5 0 "[ . 1 . 2]"
1 45 PRO 25.699 1.279 4 16 "[***+***-*** **** *]"
1 46 SER 5.761 0.284 16 0 "[ . 1 . 2]"
1 47 ALA 15.372 1.279 4 11 "[* *+***-*1 *** 2]"
1 48 GLU 6.055 0.881 9 2 "[ . +1 - . 2]"
1 49 VAL 7.605 0.881 9 2 "[ . +1 - . 2]"
1 50 HIS 4.681 0.416 8 0 "[ . 1 . 2]"
1 51 GLY 2.132 0.512 12 1 "[ . 1 + . 2]"
1 52 HIS 5.679 0.512 12 1 "[ . 1 + . 2]"
1 53 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ASN 8.624 0.600 13 12 "[*** * ***- + * ** 2]"
1 55 PRO 9.893 0.600 13 12 "[*** * ***- + * ** 2]"
1 56 VAL 5.275 0.403 4 0 "[ . 1 . 2]"
1 57 LEU 5.782 0.403 4 0 "[ . 1 . 2]"
1 58 VAL 1.511 0.088 15 0 "[ . 1 . 2]"
1 59 THR 2.722 0.112 6 0 "[ . 1 . 2]"
1 60 HIS 5.114 0.540 4 1 "[ +. 1 . 2]"
1 61 LYS 2.819 0.112 14 0 "[ . 1 . 2]"
1 62 LYS 28.486 1.661 1 20 [+*****-*************]
1 63 ASN 40.014 1.738 2 20 [*+******-***********]
1 64 VAL 10.222 0.841 1 9 "[+ * .** -1* *.* *]"
1 65 ASN 4.135 0.769 7 2 "[ - + 1 . 2]"
1 66 ILE 7.929 0.769 7 2 "[ - + 1 . 2]"
1 67 ASN 3.234 0.107 13 0 "[ . 1 . 2]"
1 68 ALA 5.476 0.116 13 0 "[ . 1 . 2]"
1 69 ILE 5.200 0.142 11 0 "[ . 1 . 2]"
1 70 THR 15.636 1.226 1 7 "[+ . -*** . **]"
1 71 PRO 12.910 0.663 8 5 "[ *. +-1 *. *]"
1 72 VAL 22.999 0.939 8 16 "[** ****+-** *.*****]"
1 73 GLY 2.762 0.102 7 0 "[ . 1 . 2]"
1 74 ASN 0.654 0.084 3 0 "[ . 1 . 2]"
1 75 TYR 4.288 0.102 7 0 "[ . 1 . 2]"
1 76 ALA 5.529 0.115 14 0 "[ . 1 . 2]"
1 77 VAL 3.199 0.142 11 0 "[ . 1 . 2]"
1 78 LYS 24.305 1.226 1 15 "[+* *-****** .*****]"
1 79 LEU 9.971 1.315 19 7 "[ **.* 1* *.* +2]"
1 80 VAL 2.433 0.099 10 0 "[ . 1 . 2]"
1 81 PHE 16.596 1.439 9 12 "[ ****- *+1*** ** 2]"
1 82 ASP 1.411 0.087 5 0 "[ . 1 . 2]"
1 83 ASP 0.644 0.101 5 0 "[ . 1 . 2]"
1 84 GLY 0.339 0.101 5 0 "[ . 1 . 2]"
1 85 HIS 10.947 1.439 9 7 "[ * *- +1* * * 2]"
1 86 ASP 2.073 0.537 6 1 "[ .+ 1 . 2]"
1 87 THR 0.844 0.132 11 0 "[ . 1 . 2]"
1 88 GLY 4.487 0.930 1 2 "[+ . - 1 . 2]"
1 89 LEU 11.912 1.065 2 8 "[ + * * ** ** -]"
1 90 TYR 16.870 1.315 19 9 "[* **.** 1* *.* +2]"
1 91 SER 3.813 0.463 11 0 "[ . 1 . 2]"
1 92 TRP 6.408 0.502 11 1 "[ . 1+ . 2]"
1 93 LYS 2.252 0.093 2 0 "[ . 1 . 2]"
1 94 VAL 7.511 0.463 11 0 "[ . 1 . 2]"
1 95 LEU 10.734 0.502 11 1 "[ . 1+ . 2]"
1 96 TYR 6.201 0.509 3 1 "[ + . 1 . 2]"
1 97 ASP 30.623 1.201 14 20 [-************+******]
1 98 LEU 51.524 1.201 14 20 [-************+******]
1 99 ALA 24.160 1.387 8 19 [*******+-**********2]
1 100 SER 23.896 1.363 6 20 [*****+**-***********]
1 101 ASN 38.295 1.363 6 20 [*****+**-***********]
1 102 GLN 20.516 1.134 10 14 "[******-**+** . **]"
1 103 VAL 7.484 0.121 4 0 "[ . 1 . 2]"
1 104 ASP 2.745 0.117 18 0 "[ . 1 . 2]"
1 105 LEU 30.435 1.134 10 14 "[*********+*- . **]"
1 106 TRP 6.432 0.169 9 0 "[ . 1 . 2]"
1 107 GLU 11.644 0.619 9 3 "[* . +1 - . 2]"
1 108 ASN 3.163 0.096 5 0 "[ . 1 . 2]"
1 109 TYR 11.747 1.111 20 4 "[ *-. 1 .* +]"
1 110 LEU 6.259 0.255 3 0 "[ . 1 . 2]"
1 111 ALA 3.596 0.527 13 1 "[ . 1 + . 2]"
1 112 ARG 6.380 0.534 4 1 "[ +. 1 . 2]"
1 113 LEU 8.009 0.534 4 1 "[ +. 1 . 2]"
1 114 ARG 6.197 0.527 13 1 "[ . 1 + . 2]"
1 115 ALA 1.721 0.087 12 0 "[ . 1 . 2]"
1 116 ALA 5.499 0.097 2 0 "[ . 1 . 2]"
1 117 LYS 5.288 1.116 9 3 "[ . +* - . 2]"
1 118 ALA 6.888 1.116 9 3 "[ . +* - . 2]"
1 119 SER 8.642 0.371 4 0 "[ . 1 . 2]"
1 120 ARG 13.270 1.156 5 13 "[ * *+ *-***** . ***2]"
1 121 GLU 22.168 1.156 5 13 "[ * *+ *-***** . ***2]"
1 122 PRO 59.764 1.738 2 20 [*+*******-**********]
1 123 LEU 8.610 0.540 4 1 "[ +. 1 . 2]"
1 124 ILE 6.473 0.160 20 0 "[ . 1 . 2]"
1 125 ASP 2.807 0.160 20 0 "[ . 1 . 2]"
1 126 MET 17.737 1.277 3 14 "[**+*** * -* *** ** 2]"
1 127 ALA 4.510 0.105 14 0 "[ . 1 . 2]"
1 128 VAL 3.786 0.124 20 0 "[ . 1 . 2]"
1 129 LYS 2.514 0.217 5 0 "[ . 1 . 2]"
1 130 TYR 2.541 0.124 20 0 "[ . 1 . 2]"
1 131 HIS 2.475 0.271 15 0 "[ . 1 . 2]"
1 132 THR 2.718 0.271 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 MET HA 1 3 THR H . . 3.210 2.497 2.145 2.928 . 0 0 "[ . 1 . 2]" 1
2 1 2 MET HB3 1 3 THR H . . 5.010 3.498 2.039 4.697 . 0 0 "[ . 1 . 2]" 1
3 1 3 THR H 1 3 THR HB . . 3.820 3.560 3.269 3.839 0.019 5 0 "[ . 1 . 2]" 1
4 1 3 THR HA 1 3 THR MG . . 3.510 2.235 2.142 2.342 . 0 0 "[ . 1 . 2]" 1
5 1 3 THR HA 1 4 PRO HD3 . . 3.050 2.447 2.128 2.709 . 0 0 "[ . 1 . 2]" 1
6 1 3 THR HB 1 4 PRO HD3 . . 3.730 3.653 3.272 3.802 0.072 4 0 "[ . 1 . 2]" 1
7 1 3 THR MG 1 4 PRO HD3 . . 4.100 3.444 2.688 4.178 0.078 13 0 "[ . 1 . 2]" 1
8 1 4 PRO HA 1 5 GLN H . . 2.930 2.373 2.143 2.659 . 0 0 "[ . 1 . 2]" 1
9 1 4 PRO HB3 1 5 GLN H . . 4.440 4.024 3.332 4.663 0.223 2 0 "[ . 1 . 2]" 1
10 1 4 PRO HD3 1 5 GLN H . . 5.500 5.347 4.824 5.565 0.065 4 0 "[ . 1 . 2]" 1
11 1 5 GLN H 1 5 GLN HB3 . . 4.100 3.413 2.988 3.851 . 0 0 "[ . 1 . 2]" 1
12 1 5 GLN H 1 6 SER H . . 4.260 4.073 2.328 4.349 0.089 15 0 "[ . 1 . 2]" 1
13 1 5 GLN H 1 6 SER HA . . 5.370 4.745 4.271 5.465 0.095 12 0 "[ . 1 . 2]" 1
14 1 5 GLN HA 1 6 SER H . . 3.080 2.434 2.071 3.158 0.078 7 0 "[ . 1 . 2]" 1
15 1 5 GLN HB3 1 6 SER H . . 4.460 3.302 1.865 4.343 . 0 0 "[ . 1 . 2]" 1
16 1 5 GLN HB3 1 7 ASP H . . 5.470 3.845 2.616 5.164 . 0 0 "[ . 1 . 2]" 1
17 1 6 SER HA 1 6 SER HB3 . . 2.750 2.425 2.180 2.589 . 0 0 "[ . 1 . 2]" 1
18 1 6 SER HA 1 7 ASP H . . 2.950 2.602 2.143 2.881 . 0 0 "[ . 1 . 2]" 1
19 1 6 SER HA 1 8 THR H . . 4.680 3.249 2.901 3.482 . 0 0 "[ . 1 . 2]" 1
20 1 6 SER HA 1 8 THR MG . . 5.500 4.109 2.956 5.157 . 0 0 "[ . 1 . 2]" 1
21 1 6 SER HB3 1 8 THR H . . 4.940 4.445 3.241 5.026 0.086 10 0 "[ . 1 . 2]" 1
22 1 7 ASP H 1 7 ASP HB3 . . 3.510 3.309 2.824 3.574 0.064 11 0 "[ . 1 . 2]" 1
23 1 7 ASP H 1 8 THR H . . 3.350 2.626 2.053 2.949 . 0 0 "[ . 1 . 2]" 1
24 1 7 ASP H 1 8 THR MG . . 5.470 4.079 3.521 4.850 . 0 0 "[ . 1 . 2]" 1
25 1 7 ASP HA 1 8 THR H . . 3.010 3.028 2.828 3.098 0.088 20 0 "[ . 1 . 2]" 1
26 1 7 ASP HB3 1 8 THR H . . 4.190 4.089 3.661 4.278 0.088 12 0 "[ . 1 . 2]" 1
27 1 7 ASP HB3 1 8 THR MG . . 5.450 5.203 4.651 5.535 0.085 13 0 "[ . 1 . 2]" 1
28 1 8 THR H 1 8 THR HB . . 3.500 3.455 3.221 3.565 0.065 10 0 "[ . 1 . 2]" 1
29 1 8 THR H 1 8 THR MG . . 3.730 2.798 2.430 3.326 . 0 0 "[ . 1 . 2]" 1
30 1 8 THR H 1 9 PRO HD3 . . 5.220 5.120 4.874 5.282 0.062 14 0 "[ . 1 . 2]" 1
31 1 8 THR HA 1 8 THR MG . . 3.250 2.231 2.137 2.310 . 0 0 "[ . 1 . 2]" 1
32 1 8 THR HA 1 9 PRO HB3 . . 5.410 4.956 4.749 5.090 . 0 0 "[ . 1 . 2]" 1
33 1 8 THR HA 1 9 PRO HD3 . . 3.160 2.401 2.166 2.610 . 0 0 "[ . 1 . 2]" 1
34 1 8 THR HA 1 9 PRO HG3 . . 4.490 4.534 4.425 4.562 0.072 3 0 "[ . 1 . 2]" 1
35 1 8 THR HA 1 96 TYR QE . . 5.210 4.610 3.899 5.304 0.094 1 0 "[ . 1 . 2]" 1
36 1 8 THR HB 1 9 PRO HD3 . . 3.950 3.838 3.494 4.023 0.073 20 0 "[ . 1 . 2]" 1
37 1 8 THR HB 1 93 LYS H . . 5.430 4.470 4.149 5.001 . 0 0 "[ . 1 . 2]" 1
38 1 8 THR HB 1 96 TYR QD . . 5.260 3.491 2.653 4.324 . 0 0 "[ . 1 . 2]" 1
39 1 8 THR MG 1 9 PRO HD3 . . 3.880 3.485 3.011 3.950 0.070 16 0 "[ . 1 . 2]" 1
40 1 8 THR MG 1 93 LYS H . . 4.530 4.267 3.527 4.615 0.085 7 0 "[ . 1 . 2]" 1
41 1 8 THR MG 1 93 LYS HA . . 3.950 2.341 2.050 2.772 . 0 0 "[ . 1 . 2]" 1
42 1 8 THR MG 1 93 LYS HE3 . . 5.190 4.391 3.442 5.264 0.074 10 0 "[ . 1 . 2]" 1
43 1 8 THR MG 1 96 TYR H . . 5.090 4.984 4.586 5.186 0.096 1 0 "[ . 1 . 2]" 1
44 1 8 THR MG 1 96 TYR HB3 . . 4.680 3.488 3.025 4.140 . 0 0 "[ . 1 . 2]" 1
45 1 8 THR MG 1 96 TYR QD . . 3.710 2.842 2.319 3.793 0.083 1 0 "[ . 1 . 2]" 1
46 1 8 THR MG 1 96 TYR QE . . 5.110 3.802 2.915 5.099 . 0 0 "[ . 1 . 2]" 1
47 1 8 THR MG 1 97 ASP H . . 5.500 5.113 4.708 5.567 0.067 20 0 "[ . 1 . 2]" 1
48 1 9 PRO HA 1 10 LYS H . . 2.810 2.451 2.313 2.571 . 0 0 "[ . 1 . 2]" 1
49 1 9 PRO HA 1 28 ASP H . . 5.150 5.163 4.529 5.233 0.083 6 0 "[ . 1 . 2]" 1
50 1 9 PRO HB3 1 10 LYS H . . 3.830 3.420 3.246 3.537 . 0 0 "[ . 1 . 2]" 1
51 1 9 PRO HB3 1 27 PHE HB3 . . 5.140 3.531 3.118 3.735 . 0 0 "[ . 1 . 2]" 1
52 1 9 PRO HB3 1 27 PHE QD . . 5.030 4.171 4.040 4.364 . 0 0 "[ . 1 . 2]" 1
53 1 9 PRO HB3 1 28 ASP H . . 4.580 4.391 3.153 4.648 0.068 15 0 "[ . 1 . 2]" 1
54 1 9 PRO HB3 1 29 ASN H . . 4.280 3.737 3.305 4.346 0.066 4 0 "[ . 1 . 2]" 1
55 1 9 PRO HB3 1 29 ASN HB3 . . 4.290 2.471 2.225 2.725 . 0 0 "[ . 1 . 2]" 1
56 1 9 PRO HB3 1 29 ASN HD21 . . 4.150 2.982 1.921 4.198 0.048 7 0 "[ . 1 . 2]" 1
57 1 9 PRO HB3 1 29 ASN HD22 . . 5.330 4.099 3.555 5.063 . 0 0 "[ . 1 . 2]" 1
58 1 9 PRO HB3 1 96 TYR QE . . 4.680 4.709 4.542 4.770 0.090 11 0 "[ . 1 . 2]" 1
59 1 9 PRO HD3 1 96 TYR QD . . 4.280 4.119 3.656 4.353 0.073 10 0 "[ . 1 . 2]" 1
60 1 9 PRO HD3 1 96 TYR QE . . 5.500 3.217 2.761 3.694 . 0 0 "[ . 1 . 2]" 1
61 1 9 PRO HG3 1 10 LYS H . . 5.080 5.094 4.873 5.156 0.076 2 0 "[ . 1 . 2]" 1
62 1 9 PRO HG3 1 27 PHE QD . . 5.170 3.816 3.523 4.132 . 0 0 "[ . 1 . 2]" 1
63 1 9 PRO HG3 1 29 ASN HD21 . . 4.760 2.532 1.947 3.121 . 0 0 "[ . 1 . 2]" 1
64 1 9 PRO HG3 1 29 ASN HD22 . . 5.500 2.764 2.413 3.252 . 0 0 "[ . 1 . 2]" 1
65 1 9 PRO HG3 1 96 TYR QD . . 4.090 3.879 3.433 4.169 0.079 19 0 "[ . 1 . 2]" 1
66 1 9 PRO HG3 1 96 TYR QE . . 3.900 2.469 2.228 2.640 . 0 0 "[ . 1 . 2]" 1
67 1 10 LYS H 1 10 LYS HB3 . . 3.190 3.629 3.202 3.781 0.591 8 9 "[** * -+ 1 * ***2]" 1
68 1 10 LYS H 1 10 LYS HD3 . . 5.000 3.333 2.626 5.041 0.041 9 0 "[ . 1 . 2]" 1
69 1 10 LYS H 1 10 LYS HG3 . . 4.570 3.679 3.257 4.269 . 0 0 "[ . 1 . 2]" 1
70 1 10 LYS H 1 12 THR MG . . 5.310 4.765 4.318 5.398 0.088 4 0 "[ . 1 . 2]" 1
71 1 10 LYS H 1 27 PHE HA . . 5.070 4.749 4.334 5.082 0.012 10 0 "[ . 1 . 2]" 1
72 1 10 LYS H 1 27 PHE QD . . 5.500 3.312 2.688 4.076 . 0 0 "[ . 1 . 2]" 1
73 1 10 LYS H 1 28 ASP H . . 4.080 3.476 3.131 3.797 . 0 0 "[ . 1 . 2]" 1
74 1 10 LYS H 1 28 ASP HB3 . . 4.700 3.832 3.069 4.754 0.054 4 0 "[ . 1 . 2]" 1
75 1 10 LYS HA 1 10 LYS HD3 . . 4.490 4.029 3.607 4.392 . 0 0 "[ . 1 . 2]" 1
76 1 10 LYS HA 1 10 LYS HG3 . . 3.900 2.246 2.160 2.376 . 0 0 "[ . 1 . 2]" 1
77 1 10 LYS HA 1 11 VAL HB . . 5.120 4.510 4.295 4.665 . 0 0 "[ . 1 . 2]" 1
78 1 10 LYS HA 1 11 VAL QG . . 5.100 3.536 3.408 3.669 . 0 0 "[ . 1 . 2]" 1
79 1 10 LYS HA 1 92 TRP HB3 . . 4.390 3.339 3.075 3.578 . 0 0 "[ . 1 . 2]" 1
80 1 10 LYS HA 1 92 TRP HD1 . . 3.380 2.627 2.333 3.044 . 0 0 "[ . 1 . 2]" 1
81 1 10 LYS HA 1 92 TRP HE1 . . 4.080 3.512 2.983 4.048 . 0 0 "[ . 1 . 2]" 1
82 1 10 LYS HB3 1 12 THR MG . . 5.500 4.446 3.736 5.826 0.326 5 0 "[ . 1 . 2]" 1
83 1 10 LYS HB3 1 92 TRP HD1 . . 5.450 4.180 3.718 4.683 . 0 0 "[ . 1 . 2]" 1
84 1 10 LYS HD3 1 92 TRP HD1 . . 4.950 4.833 4.193 5.021 0.071 20 0 "[ . 1 . 2]" 1
85 1 10 LYS HD3 1 92 TRP HE1 . . 5.500 5.403 4.688 5.581 0.081 12 0 "[ . 1 . 2]" 1
86 1 10 LYS HG3 1 92 TRP HD1 . . 3.630 2.313 2.056 2.765 . 0 0 "[ . 1 . 2]" 1
87 1 10 LYS HG3 1 92 TRP HE1 . . 5.330 3.174 2.532 3.920 . 0 0 "[ . 1 . 2]" 1
88 1 11 VAL HA 1 12 THR H . . 3.190 2.222 2.133 2.345 . 0 0 "[ . 1 . 2]" 1
89 1 11 VAL HA 1 12 THR HA . . 5.170 4.477 4.420 4.509 . 0 0 "[ . 1 . 2]" 1
90 1 11 VAL HA 1 12 THR MG . . 4.380 3.701 3.431 3.916 . 0 0 "[ . 1 . 2]" 1
91 1 11 VAL HA 1 25 ILE MG . . 4.760 3.901 3.573 4.232 . 0 0 "[ . 1 . 2]" 1
92 1 11 VAL HA 1 27 PHE HA . . 3.550 2.356 2.084 2.809 . 0 0 "[ . 1 . 2]" 1
93 1 11 VAL HA 1 27 PHE QD . . 4.010 2.632 2.380 2.900 . 0 0 "[ . 1 . 2]" 1
94 1 11 VAL HA 1 28 ASP H . . 4.600 3.905 3.496 4.611 0.011 12 0 "[ . 1 . 2]" 1
95 1 11 VAL HB 1 12 THR H . . 5.270 4.188 4.081 4.363 . 0 0 "[ . 1 . 2]" 1
96 1 11 VAL HB 1 12 THR HA . . 5.080 4.935 4.620 5.152 0.072 11 0 "[ . 1 . 2]" 1
97 1 11 VAL HB 1 13 GLY H . . 5.500 4.746 4.519 5.510 0.010 19 0 "[ . 1 . 2]" 1
98 1 11 VAL HB 1 14 LEU QD . . 5.120 3.533 3.055 4.033 . 0 0 "[ . 1 . 2]" 1
99 1 11 VAL HB 1 25 ILE MG . . 5.260 4.368 4.022 5.038 . 0 0 "[ . 1 . 2]" 1
100 1 11 VAL HB 1 92 TRP HE1 . . 5.250 5.021 4.565 5.323 0.073 13 0 "[ . 1 . 2]" 1
101 1 11 VAL HB 1 92 TRP HH2 . . 4.380 3.536 3.215 4.196 . 0 0 "[ . 1 . 2]" 1
102 1 11 VAL HB 1 92 TRP HZ2 . . 4.730 4.024 3.644 4.693 . 0 0 "[ . 1 . 2]" 1
103 1 11 VAL HB 1 92 TRP HZ3 . . 5.290 3.318 2.993 3.653 . 0 0 "[ . 1 . 2]" 1
104 1 11 VAL HB 1 95 LEU QD . . 5.500 4.353 3.824 4.867 . 0 0 "[ . 1 . 2]" 1
105 1 11 VAL QG 1 12 THR H . . 3.690 2.620 2.439 2.890 . 0 0 "[ . 1 . 2]" 1
106 1 11 VAL QG 1 12 THR HA . . 4.570 3.679 3.425 3.938 . 0 0 "[ . 1 . 2]" 1
107 1 11 VAL QG 1 12 THR MG . . 4.610 4.128 3.927 4.356 . 0 0 "[ . 1 . 2]" 1
108 1 11 VAL QG 1 13 GLY H . . 3.340 2.361 2.140 3.007 . 0 0 "[ . 1 . 2]" 1
109 1 11 VAL QG 1 13 GLY QA . . 5.300 3.637 3.331 3.840 . 0 0 "[ . 1 . 2]" 1
110 1 11 VAL QG 1 14 LEU H . . 5.100 4.186 2.533 4.593 . 0 0 "[ . 1 . 2]" 1
111 1 11 VAL QG 1 14 LEU HA . . 5.370 3.888 3.571 4.215 . 0 0 "[ . 1 . 2]" 1
112 1 11 VAL QG 1 14 LEU HB3 . . 5.350 4.471 4.114 4.791 . 0 0 "[ . 1 . 2]" 1
113 1 11 VAL QG 1 14 LEU QD . . 3.300 2.106 1.894 2.358 . 0 0 "[ . 1 . 2]" 1
114 1 11 VAL QG 1 14 LEU HG . . 3.730 2.220 1.985 2.524 . 0 0 "[ . 1 . 2]" 1
115 1 11 VAL QG 1 25 ILE HA . . 5.310 3.300 3.069 3.726 . 0 0 "[ . 1 . 2]" 1
116 1 11 VAL QG 1 25 ILE MD . . 4.430 3.746 3.263 4.092 . 0 0 "[ . 1 . 2]" 1
117 1 11 VAL QG 1 25 ILE MG . . 3.550 2.056 1.893 2.453 . 0 0 "[ . 1 . 2]" 1
118 1 11 VAL QG 1 26 SER H . . 4.300 2.561 2.242 2.952 . 0 0 "[ . 1 . 2]" 1
119 1 11 VAL QG 1 27 PHE HA . . 4.950 3.461 3.235 3.854 . 0 0 "[ . 1 . 2]" 1
120 1 11 VAL QG 1 27 PHE QD . . 4.320 3.063 2.448 3.453 . 0 0 "[ . 1 . 2]" 1
121 1 11 VAL QG 1 27 PHE QE . . 3.890 2.282 2.059 2.470 . 0 0 "[ . 1 . 2]" 1
122 1 11 VAL QG 1 77 VAL QG . . 5.500 3.539 3.270 3.884 . 0 0 "[ . 1 . 2]" 1
123 1 11 VAL QG 1 92 TRP H . . 5.500 4.526 4.261 4.791 . 0 0 "[ . 1 . 2]" 1
124 1 11 VAL QG 1 92 TRP HA . . 3.870 2.896 2.601 3.221 . 0 0 "[ . 1 . 2]" 1
125 1 11 VAL QG 1 92 TRP HB3 . . 5.500 2.696 2.166 3.076 . 0 0 "[ . 1 . 2]" 1
126 1 11 VAL QG 1 92 TRP HE1 . . 5.500 4.790 4.602 5.050 . 0 0 "[ . 1 . 2]" 1
127 1 11 VAL QG 1 92 TRP HE3 . . 3.740 2.359 2.157 2.528 . 0 0 "[ . 1 . 2]" 1
128 1 11 VAL QG 1 92 TRP HZ3 . . 4.760 2.882 2.620 3.306 . 0 0 "[ . 1 . 2]" 1
129 1 11 VAL QG 1 95 LEU H . . 5.500 5.169 4.634 5.447 . 0 0 "[ . 1 . 2]" 1
130 1 11 VAL QG 1 95 LEU HB3 . . 4.810 4.204 3.576 4.788 . 0 0 "[ . 1 . 2]" 1
131 1 11 VAL QG 1 95 LEU QD . . 3.650 2.475 2.006 2.884 . 0 0 "[ . 1 . 2]" 1
132 1 11 VAL QG 1 95 LEU HG . . 5.500 4.795 4.079 5.363 . 0 0 "[ . 1 . 2]" 1
133 1 11 VAL QG 1 96 TYR H . . 5.500 5.098 4.454 5.455 . 0 0 "[ . 1 . 2]" 1
134 1 12 THR H 1 12 THR MG . . 3.610 2.766 2.129 3.176 . 0 0 "[ . 1 . 2]" 1
135 1 12 THR H 1 13 GLY H . . 3.060 2.081 1.877 2.576 . 0 0 "[ . 1 . 2]" 1
136 1 12 THR H 1 13 GLY QA . . 4.780 4.043 3.519 4.328 . 0 0 "[ . 1 . 2]" 1
137 1 12 THR H 1 27 PHE HA . . 3.670 2.908 2.550 3.597 . 0 0 "[ . 1 . 2]" 1
138 1 12 THR H 1 28 ASP H . . 4.360 4.208 3.915 4.431 0.071 4 0 "[ . 1 . 2]" 1
139 1 12 THR HA 1 12 THR MG . . 3.300 2.554 2.193 3.269 . 0 0 "[ . 1 . 2]" 1
140 1 12 THR HA 1 13 GLY QA . . 5.430 4.163 3.975 4.376 . 0 0 "[ . 1 . 2]" 1
141 1 12 THR HB 1 13 GLY H . . 4.640 4.270 3.209 4.577 . 0 0 "[ . 1 . 2]" 1
142 1 12 THR MG 1 13 GLY H . . 4.270 4.023 3.029 4.373 0.103 9 0 "[ . 1 . 2]" 1
143 1 12 THR MG 1 27 PHE HA . . 4.200 3.481 2.709 4.196 . 0 0 "[ . 1 . 2]" 1
144 1 12 THR MG 1 28 ASP H . . 3.660 2.990 2.611 3.735 0.075 20 0 "[ . 1 . 2]" 1
145 1 12 THR MG 1 28 ASP HA . . 3.260 2.815 2.067 3.365 0.105 14 0 "[ . 1 . 2]" 1
146 1 12 THR MG 1 28 ASP HB3 . . 3.430 3.400 2.013 3.546 0.116 13 0 "[ . 1 . 2]" 1
147 1 12 THR MG 1 29 ASN H . . 5.380 4.858 4.177 5.458 0.078 20 0 "[ . 1 . 2]" 1
148 1 13 GLY H 1 14 LEU H . . 4.250 4.044 2.478 4.329 0.079 19 0 "[ . 1 . 2]" 1
149 1 13 GLY H 1 14 LEU QD . . 5.130 4.048 3.115 4.805 . 0 0 "[ . 1 . 2]" 1
150 1 13 GLY H 1 14 LEU HG . . 5.500 4.098 3.501 4.658 . 0 0 "[ . 1 . 2]" 1
151 1 13 GLY H 1 25 ILE HA . . 5.500 4.728 4.000 5.125 . 0 0 "[ . 1 . 2]" 1
152 1 13 GLY H 1 25 ILE MG . . 5.500 4.561 3.918 5.046 . 0 0 "[ . 1 . 2]" 1
153 1 13 GLY H 1 26 SER H . . 3.770 3.123 2.633 3.823 0.053 20 0 "[ . 1 . 2]" 1
154 1 13 GLY H 1 27 PHE HA . . 5.200 4.653 4.369 5.259 0.059 20 0 "[ . 1 . 2]" 1
155 1 13 GLY QA 1 14 LEU H . . 2.920 2.195 2.065 2.794 . 0 0 "[ . 1 . 2]" 1
156 1 13 GLY QA 1 14 LEU HA . . 5.500 4.016 3.953 4.140 . 0 0 "[ . 1 . 2]" 1
157 1 13 GLY QA 1 14 LEU HB3 . . 5.200 5.287 5.119 5.677 0.477 16 0 "[ . 1 . 2]" 1
158 1 13 GLY QA 1 14 LEU QD . . 5.060 3.879 2.623 4.728 . 0 0 "[ . 1 . 2]" 1
159 1 13 GLY QA 1 26 SER H . . 5.220 3.749 2.006 4.216 . 0 0 "[ . 1 . 2]" 1
160 1 14 LEU H 1 14 LEU HB3 . . 3.520 3.804 3.500 4.067 0.547 20 2 "[ -. 1 . +]" 1
161 1 14 LEU H 1 14 LEU QD . . 4.270 3.473 2.598 3.992 . 0 0 "[ . 1 . 2]" 1
162 1 14 LEU H 1 14 LEU HG . . 4.240 3.602 2.562 4.165 . 0 0 "[ . 1 . 2]" 1
163 1 14 LEU H 1 15 LYS H . . 4.610 4.071 3.186 4.353 . 0 0 "[ . 1 . 2]" 1
164 1 14 LEU H 1 26 SER H . . 5.500 4.821 2.650 5.509 0.009 14 0 "[ . 1 . 2]" 1
165 1 14 LEU H 1 69 ILE MD . . 5.500 5.104 4.410 5.593 0.093 5 0 "[ . 1 . 2]" 1
166 1 14 LEU HA 1 14 LEU QD . . 3.700 2.502 2.073 3.152 . 0 0 "[ . 1 . 2]" 1
167 1 14 LEU HA 1 15 LYS H . . 2.930 2.251 2.198 2.371 . 0 0 "[ . 1 . 2]" 1
168 1 14 LEU HA 1 23 LEU MD2 . . 5.500 3.715 2.258 4.535 . 0 0 "[ . 1 . 2]" 1
169 1 14 LEU HA 1 24 GLU H . . 5.130 4.569 4.226 4.764 . 0 0 "[ . 1 . 2]" 1
170 1 14 LEU HA 1 25 ILE HA . . 3.720 2.765 2.587 3.114 . 0 0 "[ . 1 . 2]" 1
171 1 14 LEU HA 1 25 ILE MG . . 4.970 4.484 4.200 4.911 . 0 0 "[ . 1 . 2]" 1
172 1 14 LEU HA 1 26 SER H . . 4.500 3.936 3.475 4.563 0.063 16 0 "[ . 1 . 2]" 1
173 1 14 LEU HB3 1 14 LEU QD . . 3.230 2.147 2.109 2.193 . 0 0 "[ . 1 . 2]" 1
174 1 14 LEU HB3 1 15 LYS H . . 4.670 3.459 2.604 4.152 . 0 0 "[ . 1 . 2]" 1
175 1 14 LEU HB3 1 69 ILE MD . . 3.950 2.639 2.002 3.708 . 0 0 "[ . 1 . 2]" 1
176 1 14 LEU QD 1 15 LYS H . . 4.290 3.732 3.032 4.376 0.086 3 0 "[ . 1 . 2]" 1
177 1 14 LEU QD 1 25 ILE HA . . 4.170 3.078 2.065 4.280 0.110 14 0 "[ . 1 . 2]" 1
178 1 14 LEU QD 1 26 SER H . . 5.500 4.059 3.373 4.711 . 0 0 "[ . 1 . 2]" 1
179 1 14 LEU QD 1 92 TRP HZ3 . . 3.850 2.792 2.138 3.421 . 0 0 "[ . 1 . 2]" 1
180 1 14 LEU HG 1 15 LYS H . . 5.350 4.738 4.323 5.168 . 0 0 "[ . 1 . 2]" 1
181 1 14 LEU HG 1 25 ILE HA . . 5.330 3.504 2.732 4.231 . 0 0 "[ . 1 . 2]" 1
182 1 14 LEU HG 1 25 ILE MG . . 5.500 3.758 3.114 4.474 . 0 0 "[ . 1 . 2]" 1
183 1 14 LEU HG 1 26 SER H . . 5.500 4.034 3.482 4.516 . 0 0 "[ . 1 . 2]" 1
184 1 14 LEU HG 1 92 TRP HZ3 . . 5.500 4.895 4.292 5.551 0.051 12 0 "[ . 1 . 2]" 1
185 1 14 LEU HG 1 95 LEU QD . . 5.500 4.469 3.397 5.134 . 0 0 "[ . 1 . 2]" 1
186 1 15 LYS H 1 15 LYS HB3 . . 3.450 3.449 2.843 3.692 0.242 10 0 "[ . 1 . 2]" 1
187 1 15 LYS H 1 15 LYS HG3 . . 4.940 4.688 3.873 4.978 0.038 7 0 "[ . 1 . 2]" 1
188 1 15 LYS H 1 16 LEU QD . . 4.000 3.908 3.584 4.057 0.057 13 0 "[ . 1 . 2]" 1
189 1 15 LYS H 1 23 LEU MD2 . . 5.420 3.646 2.303 4.668 . 0 0 "[ . 1 . 2]" 1
190 1 15 LYS H 1 24 GLU H . . 3.730 2.899 2.614 3.127 . 0 0 "[ . 1 . 2]" 1
191 1 15 LYS H 1 24 GLU HB3 . . 4.340 4.160 3.998 4.412 0.072 19 0 "[ . 1 . 2]" 1
192 1 15 LYS H 1 24 GLU HG3 . . 5.500 4.621 4.301 4.964 . 0 0 "[ . 1 . 2]" 1
193 1 15 LYS H 1 25 ILE HA . . 4.540 4.007 3.675 4.420 . 0 0 "[ . 1 . 2]" 1
194 1 15 LYS HA 1 15 LYS HG3 . . 3.900 3.093 2.325 3.664 . 0 0 "[ . 1 . 2]" 1
195 1 15 LYS HA 1 16 LEU H . . 2.800 2.329 2.009 2.571 . 0 0 "[ . 1 . 2]" 1
196 1 15 LYS HA 1 16 LEU HB3 . . 4.620 5.429 4.434 5.562 0.942 14 19 [************-+.*****] 1
197 1 15 LYS HA 1 24 GLU H . . 5.200 4.702 4.477 4.844 . 0 0 "[ . 1 . 2]" 1
198 1 15 LYS HB3 1 24 GLU H . . 4.700 4.112 3.513 4.505 . 0 0 "[ . 1 . 2]" 1
199 1 16 LEU H 1 16 LEU HB3 . . 3.250 3.452 3.213 3.625 0.375 20 0 "[ . 1 . 2]" 1
200 1 16 LEU H 1 16 LEU HG . . 4.910 4.335 2.192 4.731 . 0 0 "[ . 1 . 2]" 1
201 1 16 LEU HA 1 16 LEU QD . . 3.390 2.286 1.896 3.199 . 0 0 "[ . 1 . 2]" 1
202 1 16 LEU HA 1 17 LYS H . . 3.050 2.253 2.129 2.349 . 0 0 "[ . 1 . 2]" 1
203 1 16 LEU HA 1 22 GLN H . . 5.500 5.221 4.887 5.580 0.080 6 0 "[ . 1 . 2]" 1
204 1 16 LEU HA 1 23 LEU HA . . 3.590 2.315 2.068 2.615 . 0 0 "[ . 1 . 2]" 1
205 1 16 LEU HA 1 23 LEU MD2 . . 5.310 4.448 2.919 5.397 0.087 13 0 "[ . 1 . 2]" 1
206 1 16 LEU HA 1 24 GLU H . . 4.290 3.227 2.832 3.410 . 0 0 "[ . 1 . 2]" 1
207 1 16 LEU HB3 1 16 LEU QD . . 3.140 2.180 1.919 2.316 . 0 0 "[ . 1 . 2]" 1
208 1 16 LEU HB3 1 17 LYS H . . 4.630 2.817 2.503 3.277 . 0 0 "[ . 1 . 2]" 1
209 1 16 LEU HB3 1 66 ILE HB . . 4.780 4.691 4.241 5.160 0.380 13 0 "[ . 1 . 2]" 1
210 1 16 LEU QD 1 17 LYS H . . 3.390 2.788 2.122 3.353 . 0 0 "[ . 1 . 2]" 1
211 1 16 LEU QD 1 17 LYS HA . . 5.500 4.628 4.268 5.066 . 0 0 "[ . 1 . 2]" 1
212 1 16 LEU QD 1 18 ARG HA . . 4.350 3.928 3.513 4.381 0.031 15 0 "[ . 1 . 2]" 1
213 1 16 LEU QD 1 22 GLN H . . 4.630 4.233 3.689 4.621 . 0 0 "[ . 1 . 2]" 1
214 1 16 LEU QD 1 23 LEU H . . 5.280 4.371 3.905 5.011 . 0 0 "[ . 1 . 2]" 1
215 1 16 LEU QD 1 23 LEU HA . . 3.200 2.676 2.285 3.191 . 0 0 "[ . 1 . 2]" 1
216 1 16 LEU QD 1 23 LEU HG . . 3.060 2.531 2.163 3.107 0.047 8 0 "[ . 1 . 2]" 1
217 1 16 LEU QD 1 24 GLU H . . 3.450 3.428 3.101 3.536 0.086 3 0 "[ . 1 . 2]" 1
218 1 16 LEU QD 1 65 ASN HA . . 5.000 4.034 3.038 4.642 . 0 0 "[ . 1 . 2]" 1
219 1 16 LEU QD 1 65 ASN HD21 . . 5.500 4.390 3.369 5.457 . 0 0 "[ . 1 . 2]" 1
220 1 16 LEU QD 1 66 ILE H . . 4.290 2.938 1.927 3.780 . 0 0 "[ . 1 . 2]" 1
221 1 16 LEU QD 1 66 ILE HB . . 3.730 2.020 1.859 2.163 . 0 0 "[ . 1 . 2]" 1
222 1 16 LEU QD 1 66 ILE MG . . 3.260 2.528 2.141 2.949 . 0 0 "[ . 1 . 2]" 1
223 1 16 LEU QD 1 67 ASN H . . 5.500 5.081 4.584 5.342 . 0 0 "[ . 1 . 2]" 1
224 1 16 LEU HG 1 17 LYS H . . 4.440 3.729 2.365 4.531 0.091 16 0 "[ . 1 . 2]" 1
225 1 17 LYS H 1 17 LYS HD3 . . 4.960 3.639 3.189 4.079 . 0 0 "[ . 1 . 2]" 1
226 1 17 LYS H 1 17 LYS HG3 . . 4.310 3.901 3.080 4.173 . 0 0 "[ . 1 . 2]" 1
227 1 17 LYS H 1 18 ARG H . . 5.110 3.543 3.170 4.165 . 0 0 "[ . 1 . 2]" 1
228 1 17 LYS H 1 22 GLN H . . 4.190 3.429 3.092 3.790 . 0 0 "[ . 1 . 2]" 1
229 1 17 LYS H 1 23 LEU HA . . 4.040 3.454 3.266 3.760 . 0 0 "[ . 1 . 2]" 1
230 1 17 LYS H 1 24 GLU H . . 4.970 4.918 4.630 5.044 0.074 3 0 "[ . 1 . 2]" 1
231 1 17 LYS HA 1 17 LYS HD3 . . 4.350 5.063 4.385 5.340 0.990 4 18 "[*-*+**** ********* *]" 1
232 1 17 LYS HA 1 17 LYS HG3 . . 4.160 4.057 2.706 4.233 0.073 13 0 "[ . 1 . 2]" 1
233 1 17 LYS HA 1 18 ARG H . . 3.120 2.322 2.142 2.472 . 0 0 "[ . 1 . 2]" 1
234 1 17 LYS HD3 1 23 LEU HA . . 3.830 3.485 3.273 3.882 0.052 9 0 "[ . 1 . 2]" 1
235 1 17 LYS HD3 1 34 THR MG . . 4.930 2.548 2.274 3.292 . 0 0 "[ . 1 . 2]" 1
236 1 17 LYS HG3 1 22 GLN HE21 . . 5.500 4.575 3.534 6.281 0.781 9 2 "[ . +1 . -2]" 1
237 1 18 ARG H 1 18 ARG HB3 . . 3.690 2.453 2.222 2.808 . 0 0 "[ . 1 . 2]" 1
238 1 18 ARG H 1 18 ARG HD3 . . 4.880 4.113 3.479 4.725 . 0 0 "[ . 1 . 2]" 1
239 1 18 ARG H 1 19 LYS H . . 4.740 2.848 2.727 3.085 . 0 0 "[ . 1 . 2]" 1
240 1 18 ARG H 1 20 SER H . . 4.880 4.608 4.334 4.961 0.081 9 0 "[ . 1 . 2]" 1
241 1 18 ARG H 1 21 ARG H . . 5.500 5.089 4.720 5.312 . 0 0 "[ . 1 . 2]" 1
242 1 18 ARG HA 1 21 ARG H . . 3.820 3.202 2.923 3.882 0.062 7 0 "[ . 1 . 2]" 1
243 1 18 ARG HA 1 22 GLN H . . 4.370 4.163 3.752 4.445 0.075 7 0 "[ . 1 . 2]" 1
244 1 18 ARG HA 1 65 ASN HD21 . . 3.780 3.157 1.857 3.867 0.087 4 0 "[ . 1 . 2]" 1
245 1 18 ARG HA 1 65 ASN HD22 . . 4.080 2.885 2.098 4.157 0.077 10 0 "[ . 1 . 2]" 1
246 1 19 LYS H 1 19 LYS HB3 . . 4.070 3.537 3.425 3.597 . 0 0 "[ . 1 . 2]" 1
247 1 19 LYS H 1 19 LYS HG3 . . 5.500 2.683 1.956 3.473 . 0 0 "[ . 1 . 2]" 1
248 1 19 LYS H 1 20 SER H . . 4.430 2.936 2.377 3.165 . 0 0 "[ . 1 . 2]" 1
249 1 19 LYS H 1 21 ARG H . . 5.070 4.117 3.938 4.408 . 0 0 "[ . 1 . 2]" 1
250 1 19 LYS HA 1 19 LYS HG3 . . 4.060 3.233 2.121 3.980 . 0 0 "[ . 1 . 2]" 1
251 1 19 LYS HB3 1 20 SER H . . 4.410 3.697 3.056 4.112 . 0 0 "[ . 1 . 2]" 1
252 1 19 LYS HG3 1 20 SER H . . 5.500 4.652 3.930 5.263 . 0 0 "[ . 1 . 2]" 1
253 1 20 SER H 1 20 SER HB3 . . 3.910 3.727 3.486 3.918 0.008 12 0 "[ . 1 . 2]" 1
254 1 20 SER H 1 21 ARG H . . 3.130 2.319 1.847 2.711 . 0 0 "[ . 1 . 2]" 1
255 1 20 SER H 1 22 GLN H . . 4.340 3.608 3.153 4.321 . 0 0 "[ . 1 . 2]" 1
256 1 20 SER HB3 1 21 ARG H . . 4.610 4.485 4.221 4.681 0.071 10 0 "[ . 1 . 2]" 1
257 1 20 SER HB3 1 22 GLN HE21 . . 4.580 3.764 2.258 5.465 0.885 12 1 "[ . 1 + . 2]" 1
258 1 20 SER HB3 1 22 GLN HE22 . . 4.820 4.072 2.941 4.806 . 0 0 "[ . 1 . 2]" 1
259 1 20 SER HB3 1 22 GLN HG3 . . 5.070 4.014 3.279 4.530 . 0 0 "[ . 1 . 2]" 1
260 1 21 ARG H 1 21 ARG HD3 . . 5.120 3.664 2.291 5.267 0.147 10 0 "[ . 1 . 2]" 1
261 1 21 ARG H 1 21 ARG HG3 . . 4.600 4.055 2.593 5.093 0.493 4 0 "[ . 1 . 2]" 1
262 1 21 ARG HA 1 21 ARG HD3 . . 5.440 3.802 2.411 4.868 . 0 0 "[ . 1 . 2]" 1
263 1 21 ARG HA 1 21 ARG HG3 . . 4.190 3.158 2.088 4.205 0.015 13 0 "[ . 1 . 2]" 1
264 1 21 ARG HA 1 22 GLN H . . 3.230 2.661 2.410 3.037 . 0 0 "[ . 1 . 2]" 1
265 1 21 ARG HA 1 65 ASN HA . . 5.380 4.221 3.344 5.042 . 0 0 "[ . 1 . 2]" 1
266 1 21 ARG HA 1 65 ASN HD21 . . 4.580 3.209 2.286 4.237 . 0 0 "[ . 1 . 2]" 1
267 1 21 ARG HD3 1 65 ASN HD22 . . 5.500 4.148 1.975 5.539 0.039 19 0 "[ . 1 . 2]" 1
268 1 21 ARG HG3 1 37 CYS H . . 5.480 4.953 3.333 6.082 0.602 9 2 "[ - . +1 . 2]" 1
269 1 22 GLN H 1 22 GLN HG3 . . 4.350 3.680 3.297 4.063 . 0 0 "[ . 1 . 2]" 1
270 1 22 GLN H 1 23 LEU H . . 4.610 4.442 4.325 4.522 . 0 0 "[ . 1 . 2]" 1
271 1 22 GLN H 1 23 LEU HA . . 5.500 4.960 4.672 5.182 . 0 0 "[ . 1 . 2]" 1
272 1 22 GLN H 1 34 THR MG . . 5.220 4.945 4.691 5.238 0.018 3 0 "[ . 1 . 2]" 1
273 1 22 GLN H 1 37 CYS H . . 5.270 4.820 4.473 5.192 . 0 0 "[ . 1 . 2]" 1
274 1 22 GLN HA 1 22 GLN HE21 . . 5.500 4.759 4.486 5.143 . 0 0 "[ . 1 . 2]" 1
275 1 22 GLN HA 1 23 LEU H . . 3.090 2.381 2.252 2.521 . 0 0 "[ . 1 . 2]" 1
276 1 22 GLN HA 1 23 LEU HB3 . . 5.290 4.187 3.872 4.475 . 0 0 "[ . 1 . 2]" 1
277 1 22 GLN HA 1 34 THR MG . . 5.460 3.860 3.553 4.145 . 0 0 "[ . 1 . 2]" 1
278 1 22 GLN HA 1 36 SER HA . . 3.810 2.363 2.051 2.786 . 0 0 "[ . 1 . 2]" 1
279 1 22 GLN HA 1 36 SER HB3 . . 4.930 4.662 4.245 5.167 0.237 10 0 "[ . 1 . 2]" 1
280 1 22 GLN HA 1 37 CYS H . . 3.680 2.830 2.581 3.169 . 0 0 "[ . 1 . 2]" 1
281 1 22 GLN HE21 1 34 THR MG . . 3.930 3.033 1.765 4.048 0.118 8 0 "[ . 1 . 2]" 1
282 1 22 GLN HE21 1 36 SER HA . . 5.420 5.166 4.352 5.492 0.072 7 0 "[ . 1 . 2]" 1
283 1 22 GLN HE22 1 34 THR MG . . 3.940 3.459 3.032 3.855 . 0 0 "[ . 1 . 2]" 1
284 1 22 GLN HG3 1 23 LEU H . . 5.060 4.460 3.962 4.707 . 0 0 "[ . 1 . 2]" 1
285 1 22 GLN HG3 1 34 THR MG . . 4.500 4.080 3.661 4.522 0.022 3 0 "[ . 1 . 2]" 1
286 1 22 GLN HG3 1 36 SER HA . . 4.690 2.886 2.167 3.427 . 0 0 "[ . 1 . 2]" 1
287 1 22 GLN HG3 1 37 CYS H . . 5.430 4.088 3.412 4.715 . 0 0 "[ . 1 . 2]" 1
288 1 23 LEU H 1 23 LEU HB3 . . 3.710 2.559 2.452 2.682 . 0 0 "[ . 1 . 2]" 1
289 1 23 LEU H 1 23 LEU MD1 . . 5.140 4.335 3.581 4.772 . 0 0 "[ . 1 . 2]" 1
290 1 23 LEU H 1 23 LEU MD2 . . 4.850 4.049 3.615 4.596 . 0 0 "[ . 1 . 2]" 1
291 1 23 LEU H 1 34 THR HB . . 5.500 5.381 4.919 5.576 0.076 17 0 "[ . 1 . 2]" 1
292 1 23 LEU H 1 34 THR MG . . 3.950 2.734 2.350 2.923 . 0 0 "[ . 1 . 2]" 1
293 1 23 LEU H 1 35 LEU H . . 3.800 2.828 2.614 3.005 . 0 0 "[ . 1 . 2]" 1
294 1 23 LEU H 1 36 SER HA . . 4.400 3.769 3.442 4.273 . 0 0 "[ . 1 . 2]" 1
295 1 23 LEU H 1 37 CYS H . . 4.590 4.643 4.487 4.676 0.086 20 0 "[ . 1 . 2]" 1
296 1 23 LEU H 1 40 LEU QD . . 4.930 4.005 3.651 4.401 . 0 0 "[ . 1 . 2]" 1
297 1 23 LEU HA 1 23 LEU MD2 . . 4.460 3.192 2.337 3.761 . 0 0 "[ . 1 . 2]" 1
298 1 23 LEU HA 1 24 GLU H . . 3.130 2.148 2.026 2.235 . 0 0 "[ . 1 . 2]" 1
299 1 23 LEU HA 1 24 GLU HA . . 4.590 4.408 4.327 4.530 . 0 0 "[ . 1 . 2]" 1
300 1 23 LEU HA 1 24 GLU HG3 . . 4.580 3.579 3.234 4.043 . 0 0 "[ . 1 . 2]" 1
301 1 23 LEU HA 1 40 LEU QD . . 5.000 4.945 4.885 5.010 0.010 9 0 "[ . 1 . 2]" 1
302 1 23 LEU HB3 1 23 LEU MD2 . . 3.400 2.589 2.115 3.318 . 0 0 "[ . 1 . 2]" 1
303 1 23 LEU HB3 1 24 GLU H . . 4.360 4.213 4.021 4.374 0.014 5 0 "[ . 1 . 2]" 1
304 1 23 LEU MD2 1 24 GLU H . . 4.860 2.814 1.891 3.753 . 0 0 "[ . 1 . 2]" 1
305 1 23 LEU MD2 1 25 ILE HA . . 4.450 3.871 3.512 4.276 . 0 0 "[ . 1 . 2]" 1
306 1 23 LEU HG 1 24 GLU H . . 4.340 3.281 2.306 4.424 0.084 3 0 "[ . 1 . 2]" 1
307 1 23 LEU HG 1 25 ILE MD . . 4.680 4.359 4.001 4.773 0.093 18 0 "[ . 1 . 2]" 1
308 1 24 GLU H 1 24 GLU HB3 . . 3.740 3.723 3.645 3.788 0.048 3 0 "[ . 1 . 2]" 1
309 1 24 GLU H 1 24 GLU HG3 . . 4.320 2.682 2.351 3.022 . 0 0 "[ . 1 . 2]" 1
310 1 24 GLU H 1 25 ILE H . . 5.030 4.501 4.421 4.590 . 0 0 "[ . 1 . 2]" 1
311 1 24 GLU HA 1 24 GLU HG3 . . 4.090 3.206 3.064 3.580 . 0 0 "[ . 1 . 2]" 1
312 1 24 GLU HA 1 25 ILE H . . 2.980 2.241 2.113 2.326 . 0 0 "[ . 1 . 2]" 1
313 1 24 GLU HA 1 25 ILE HB . . 4.560 4.179 3.953 4.348 . 0 0 "[ . 1 . 2]" 1
314 1 24 GLU HA 1 25 ILE MD . . 4.740 4.225 3.568 4.661 . 0 0 "[ . 1 . 2]" 1
315 1 24 GLU HA 1 34 THR HA . . 3.330 2.162 2.072 2.274 . 0 0 "[ . 1 . 2]" 1
316 1 24 GLU HA 1 34 THR MG . . 3.570 2.774 2.481 2.927 . 0 0 "[ . 1 . 2]" 1
317 1 24 GLU HA 1 35 LEU H . . 3.720 3.752 3.651 3.803 0.083 18 0 "[ . 1 . 2]" 1
318 1 24 GLU HB3 1 25 ILE H . . 4.380 2.823 2.672 3.120 . 0 0 "[ . 1 . 2]" 1
319 1 24 GLU HB3 1 34 THR MG . . 5.500 4.103 3.901 4.425 . 0 0 "[ . 1 . 2]" 1
320 1 24 GLU HG3 1 25 ILE H . . 4.500 5.051 4.938 5.214 0.714 3 14 "[ *+*** ******- **]" 1
321 1 24 GLU HG3 1 34 THR HA . . 4.860 4.634 4.277 5.243 0.383 19 0 "[ . 1 . 2]" 1
322 1 24 GLU HG3 1 34 THR MG . . 4.880 2.859 2.566 3.403 . 0 0 "[ . 1 . 2]" 1
323 1 25 ILE H 1 25 ILE HB . . 3.480 2.556 2.482 2.652 . 0 0 "[ . 1 . 2]" 1
324 1 25 ILE H 1 25 ILE MD . . 4.490 3.830 3.384 4.140 . 0 0 "[ . 1 . 2]" 1
325 1 25 ILE H 1 25 ILE MG . . 3.970 3.829 3.754 3.896 . 0 0 "[ . 1 . 2]" 1
326 1 25 ILE H 1 26 SER H . . 4.950 4.326 4.197 4.449 . 0 0 "[ . 1 . 2]" 1
327 1 25 ILE H 1 32 GLN HA . . 5.310 4.537 4.355 4.753 . 0 0 "[ . 1 . 2]" 1
328 1 25 ILE H 1 32 GLN HG3 . . 5.330 5.480 4.984 5.582 0.252 8 0 "[ . 1 . 2]" 1
329 1 25 ILE H 1 33 PHE H . . 4.090 2.862 2.715 3.055 . 0 0 "[ . 1 . 2]" 1
330 1 25 ILE H 1 33 PHE QD . . 5.500 4.154 3.612 4.517 . 0 0 "[ . 1 . 2]" 1
331 1 25 ILE H 1 34 THR HA . . 3.730 3.393 3.103 3.609 . 0 0 "[ . 1 . 2]" 1
332 1 25 ILE H 1 34 THR MG . . 4.580 4.646 4.455 4.694 0.114 8 0 "[ . 1 . 2]" 1
333 1 25 ILE HA 1 25 ILE MD . . 4.580 3.919 3.815 4.069 . 0 0 "[ . 1 . 2]" 1
334 1 25 ILE HA 1 25 ILE MG . . 3.470 2.548 2.468 2.647 . 0 0 "[ . 1 . 2]" 1
335 1 25 ILE HA 1 26 SER H . . 3.030 2.194 2.014 2.286 . 0 0 "[ . 1 . 2]" 1
336 1 25 ILE HA 1 26 SER HB3 . . 5.040 4.692 4.237 5.140 0.100 19 0 "[ . 1 . 2]" 1
337 1 25 ILE HB 1 25 ILE MD . . 2.850 2.335 2.225 2.516 . 0 0 "[ . 1 . 2]" 1
338 1 25 ILE HB 1 26 SER H . . 4.170 4.157 3.911 4.249 0.079 7 0 "[ . 1 . 2]" 1
339 1 25 ILE HB 1 33 PHE H . . 4.440 3.351 3.220 3.725 . 0 0 "[ . 1 . 2]" 1
340 1 25 ILE HB 1 33 PHE HB3 . . 4.710 5.325 5.250 5.353 0.643 11 20 [**********+**-******] 1
341 1 25 ILE HB 1 33 PHE QD . . 4.490 2.806 2.207 3.102 . 0 0 "[ . 1 . 2]" 1
342 1 25 ILE HB 1 34 THR HA . . 4.680 4.357 3.796 4.729 0.049 18 0 "[ . 1 . 2]" 1
343 1 25 ILE MD 1 25 ILE MG . . 2.980 2.186 2.029 2.430 . 0 0 "[ . 1 . 2]" 1
344 1 25 ILE MD 1 26 SER H . . 5.250 5.172 4.906 5.330 0.080 6 0 "[ . 1 . 2]" 1
345 1 25 ILE MD 1 33 PHE H . . 5.310 4.911 4.596 5.237 . 0 0 "[ . 1 . 2]" 1
346 1 25 ILE MD 1 33 PHE HB3 . . 4.810 5.668 5.446 5.902 1.092 18 20 [*******-*********+**] 1
347 1 25 ILE MD 1 33 PHE QD . . 3.980 2.485 2.233 2.808 . 0 0 "[ . 1 . 2]" 1
348 1 25 ILE MD 1 33 PHE HZ . . 3.750 3.741 3.257 3.841 0.091 6 0 "[ . 1 . 2]" 1
349 1 25 ILE MD 1 34 THR HA . . 5.260 3.837 3.172 4.508 . 0 0 "[ . 1 . 2]" 1
350 1 25 ILE MD 1 35 LEU H . . 4.820 3.813 3.248 4.487 . 0 0 "[ . 1 . 2]" 1
351 1 25 ILE MD 1 95 LEU H . . 5.220 5.210 4.921 5.322 0.102 3 0 "[ . 1 . 2]" 1
352 1 25 ILE MD 1 95 LEU HA . . 4.620 3.888 3.645 4.181 . 0 0 "[ . 1 . 2]" 1
353 1 25 ILE MD 1 95 LEU HB3 . . 4.570 2.151 2.006 2.345 . 0 0 "[ . 1 . 2]" 1
354 1 25 ILE MD 1 95 LEU QD . . 3.630 2.054 1.890 2.555 . 0 0 "[ . 1 . 2]" 1
355 1 25 ILE MD 1 95 LEU HG . . 5.030 3.931 3.295 4.331 . 0 0 "[ . 1 . 2]" 1
356 1 25 ILE MD 1 96 TYR HA . . 5.450 4.907 4.528 5.305 . 0 0 "[ . 1 . 2]" 1
357 1 25 ILE MG 1 26 SER H . . 3.550 2.608 2.253 2.793 . 0 0 "[ . 1 . 2]" 1
358 1 25 ILE MG 1 26 SER HA . . 4.430 3.562 3.268 3.791 . 0 0 "[ . 1 . 2]" 1
359 1 25 ILE MG 1 27 PHE H . . 5.500 4.332 3.877 4.664 . 0 0 "[ . 1 . 2]" 1
360 1 25 ILE MG 1 27 PHE QD . . 4.330 3.779 3.511 4.063 . 0 0 "[ . 1 . 2]" 1
361 1 25 ILE MG 1 33 PHE H . . 4.920 4.090 3.771 4.436 . 0 0 "[ . 1 . 2]" 1
362 1 25 ILE MG 1 33 PHE HB3 . . 5.500 5.721 5.475 5.856 0.356 11 0 "[ . 1 . 2]" 1
363 1 25 ILE MG 1 33 PHE QD . . 3.730 3.693 3.481 3.803 0.073 13 0 "[ . 1 . 2]" 1
364 1 25 ILE MG 1 33 PHE HZ . . 4.120 2.898 2.382 3.225 . 0 0 "[ . 1 . 2]" 1
365 1 25 ILE MG 1 95 LEU HB3 . . 5.500 3.188 2.795 3.776 . 0 0 "[ . 1 . 2]" 1
366 1 25 ILE MG 1 95 LEU QD . . 4.290 2.853 2.376 3.210 . 0 0 "[ . 1 . 2]" 1
367 1 25 ILE MG 1 95 LEU HG . . 5.500 5.113 4.552 5.539 0.039 1 0 "[ . 1 . 2]" 1
368 1 25 ILE MG 1 96 TYR HA . . 5.260 4.782 4.466 5.037 . 0 0 "[ . 1 . 2]" 1
369 1 26 SER H 1 26 SER HB3 . . 3.900 2.916 2.361 3.859 . 0 0 "[ . 1 . 2]" 1
370 1 26 SER H 1 27 PHE H . . 4.890 4.280 4.078 4.432 . 0 0 "[ . 1 . 2]" 1
371 1 26 SER HA 1 27 PHE H . . 3.030 2.130 1.976 2.261 . 0 0 "[ . 1 . 2]" 1
372 1 26 SER HA 1 27 PHE QD . . 4.690 4.656 4.262 4.780 0.090 20 0 "[ . 1 . 2]" 1
373 1 26 SER HA 1 32 GLN HA . . 3.510 2.432 2.253 2.736 . 0 0 "[ . 1 . 2]" 1
374 1 26 SER HA 1 32 GLN HE21 . . 5.500 4.091 3.021 5.393 . 0 0 "[ . 1 . 2]" 1
375 1 26 SER HA 1 32 GLN HG3 . . 4.130 2.248 1.921 3.649 . 0 0 "[ . 1 . 2]" 1
376 1 26 SER HA 1 33 PHE H . . 4.220 3.967 3.641 4.242 0.022 13 0 "[ . 1 . 2]" 1
377 1 26 SER HB3 1 27 PHE H . . 3.900 3.826 3.254 4.158 0.258 20 0 "[ . 1 . 2]" 1
378 1 26 SER HB3 1 32 GLN HA . . 4.770 5.091 4.044 5.542 0.772 13 7 "[- *. ** 1* + . *]" 1
379 1 26 SER HB3 1 32 GLN HE21 . . 4.810 4.382 2.295 5.533 0.723 16 4 "[ -.* 1 * .+ 2]" 1
380 1 26 SER HB3 1 32 GLN HG3 . . 4.520 3.755 2.221 5.052 0.532 11 1 "[ . 1+ . 2]" 1
381 1 27 PHE H 1 27 PHE HB3 . . 3.700 3.621 3.537 3.691 . 0 0 "[ . 1 . 2]" 1
382 1 27 PHE H 1 27 PHE QD . . 3.940 3.773 3.366 4.013 0.073 14 0 "[ . 1 . 2]" 1
383 1 27 PHE H 1 28 ASP H . . 5.010 4.539 4.405 4.653 . 0 0 "[ . 1 . 2]" 1
384 1 27 PHE H 1 28 ASP HA . . 5.500 5.119 4.922 5.555 0.055 15 0 "[ . 1 . 2]" 1
385 1 27 PHE H 1 29 ASN H . . 5.060 4.767 4.085 5.135 0.075 3 0 "[ . 1 . 2]" 1
386 1 27 PHE H 1 30 GLY H . . 5.150 4.310 3.441 4.807 . 0 0 "[ . 1 . 2]" 1
387 1 27 PHE H 1 31 GLN H . . 4.590 3.399 2.863 4.485 . 0 0 "[ . 1 . 2]" 1
388 1 27 PHE H 1 32 GLN HA . . 3.920 3.606 3.381 3.926 0.006 13 0 "[ . 1 . 2]" 1
389 1 27 PHE H 1 32 GLN HG3 . . 4.870 3.373 3.011 4.947 0.077 11 0 "[ . 1 . 2]" 1
390 1 27 PHE HA 1 27 PHE QD . . 4.170 2.255 2.036 2.461 . 0 0 "[ . 1 . 2]" 1
391 1 27 PHE HA 1 28 ASP H . . 3.180 2.330 2.130 2.480 . 0 0 "[ . 1 . 2]" 1
392 1 27 PHE HA 1 29 ASN H . . 4.520 4.051 3.938 4.172 . 0 0 "[ . 1 . 2]" 1
393 1 27 PHE HA 1 30 GLY H . . 5.490 5.116 4.502 5.584 0.094 20 0 "[ . 1 . 2]" 1
394 1 27 PHE HB3 1 28 ASP H . . 4.600 2.664 2.157 2.995 . 0 0 "[ . 1 . 2]" 1
395 1 27 PHE HB3 1 29 ASN H . . 3.920 2.459 2.142 2.861 . 0 0 "[ . 1 . 2]" 1
396 1 27 PHE HB3 1 30 GLY H . . 5.470 3.814 3.234 4.433 . 0 0 "[ . 1 . 2]" 1
397 1 27 PHE HB3 1 31 GLN H . . 4.340 3.958 3.687 5.071 0.731 20 1 "[ . 1 . +]" 1
398 1 27 PHE QD 1 28 ASP H . . 4.530 2.956 2.617 3.231 . 0 0 "[ . 1 . 2]" 1
399 1 27 PHE QD 1 29 ASN H . . 5.020 4.346 3.899 4.778 . 0 0 "[ . 1 . 2]" 1
400 1 27 PHE QD 1 31 GLN H . . 5.500 4.499 4.107 5.054 . 0 0 "[ . 1 . 2]" 1
401 1 27 PHE QD 1 31 GLN HB3 . . 5.020 3.222 2.641 5.155 0.135 20 0 "[ . 1 . 2]" 1
402 1 27 PHE QD 1 32 GLN H . . 5.340 5.034 4.491 5.436 0.096 20 0 "[ . 1 . 2]" 1
403 1 27 PHE QD 1 32 GLN HA . . 5.110 4.631 4.167 5.034 . 0 0 "[ . 1 . 2]" 1
404 1 27 PHE QE 1 96 TYR H . . 4.780 4.273 3.757 4.663 . 0 0 "[ . 1 . 2]" 1
405 1 27 PHE QE 1 96 TYR HA . . 4.260 3.295 2.277 3.865 . 0 0 "[ . 1 . 2]" 1
406 1 27 PHE QE 1 96 TYR HB3 . . 5.290 4.272 3.983 4.556 . 0 0 "[ . 1 . 2]" 1
407 1 28 ASP H 1 28 ASP HB3 . . 4.130 2.706 2.104 3.242 . 0 0 "[ . 1 . 2]" 1
408 1 28 ASP H 1 29 ASN H . . 3.780 2.671 2.377 2.898 . 0 0 "[ . 1 . 2]" 1
409 1 28 ASP H 1 30 GLY H . . 4.930 4.473 4.101 4.842 . 0 0 "[ . 1 . 2]" 1
410 1 28 ASP HA 1 30 GLY H . . 4.190 3.798 3.249 4.260 0.070 20 0 "[ . 1 . 2]" 1
411 1 29 ASN H 1 29 ASN HB3 . . 3.730 2.627 2.303 2.943 . 0 0 "[ . 1 . 2]" 1
412 1 29 ASN H 1 29 ASN HD22 . . 5.500 4.240 3.740 4.775 . 0 0 "[ . 1 . 2]" 1
413 1 29 ASN H 1 30 GLY H . . 3.230 2.503 2.034 2.810 . 0 0 "[ . 1 . 2]" 1
414 1 29 ASN H 1 30 GLY HA2 . . 5.060 4.830 4.313 5.123 0.063 17 0 "[ . 1 . 2]" 1
415 1 29 ASN HA 1 30 GLY HA3 . . 4.590 4.573 4.448 4.662 0.072 12 0 "[ . 1 . 2]" 1
416 1 29 ASN HD21 1 96 TYR QE . . 4.280 4.143 2.432 4.789 0.509 3 1 "[ + . 1 . 2]" 1
417 1 29 ASN HD22 1 31 GLN HG3 . . 5.440 2.723 2.169 3.350 . 0 0 "[ . 1 . 2]" 1
418 1 29 ASN HD22 1 96 TYR QE . . 5.500 3.531 2.750 4.353 . 0 0 "[ . 1 . 2]" 1
419 1 30 GLY H 1 31 GLN H . . 3.320 2.478 2.012 2.896 . 0 0 "[ . 1 . 2]" 1
420 1 31 GLN H 1 31 GLN HB3 . . 3.850 3.758 3.489 3.899 0.049 3 0 "[ . 1 . 2]" 1
421 1 31 GLN H 1 32 GLN H . . 4.780 4.382 4.227 4.720 . 0 0 "[ . 1 . 2]" 1
422 1 31 GLN HA 1 31 GLN HE21 . . 5.500 3.442 2.063 4.865 . 0 0 "[ . 1 . 2]" 1
423 1 31 GLN HA 1 31 GLN HE22 . . 5.120 3.915 3.042 5.541 0.421 20 0 "[ . 1 . 2]" 1
424 1 31 GLN HA 1 31 GLN HG3 . . 4.150 3.730 3.544 3.854 . 0 0 "[ . 1 . 2]" 1
425 1 31 GLN HA 1 32 GLN H . . 2.810 2.311 2.174 2.674 . 0 0 "[ . 1 . 2]" 1
426 1 31 GLN HA 1 32 GLN HA . . 5.180 4.526 4.449 4.721 . 0 0 "[ . 1 . 2]" 1
427 1 31 GLN HB3 1 31 GLN HE22 . . 4.650 3.897 3.533 4.708 0.058 17 0 "[ . 1 . 2]" 1
428 1 31 GLN HB3 1 32 GLN H . . 4.510 2.718 2.483 3.559 . 0 0 "[ . 1 . 2]" 1
429 1 31 GLN HB3 1 33 PHE QE . . 4.150 3.785 2.993 5.518 1.368 20 1 "[ . 1 . +]" 1
430 1 31 GLN HB3 1 96 TYR QE . . 4.550 4.486 3.992 4.644 0.094 14 0 "[ . 1 . 2]" 1
431 1 31 GLN HE22 1 32 GLN H . . 4.720 4.238 3.486 4.787 0.067 13 0 "[ . 1 . 2]" 1
432 1 31 GLN HG3 1 32 GLN H . . 4.800 4.782 4.051 4.943 0.143 16 0 "[ . 1 . 2]" 1
433 1 32 GLN H 1 33 PHE H . . 4.550 4.291 4.082 4.408 . 0 0 "[ . 1 . 2]" 1
434 1 32 GLN HA 1 32 GLN HG3 . . 4.070 2.365 2.098 3.440 . 0 0 "[ . 1 . 2]" 1
435 1 32 GLN HA 1 33 PHE H . . 2.950 2.315 2.190 2.456 . 0 0 "[ . 1 . 2]" 1
436 1 32 GLN HA 1 33 PHE QD . . 4.490 3.984 3.269 4.417 . 0 0 "[ . 1 . 2]" 1
437 1 32 GLN HG3 1 33 PHE H . . 4.060 4.059 3.750 4.181 0.121 1 0 "[ . 1 . 2]" 1
438 1 33 PHE H 1 33 PHE HB3 . . 4.200 3.691 3.570 3.796 . 0 0 "[ . 1 . 2]" 1
439 1 33 PHE H 1 33 PHE QD . . 3.530 3.504 3.336 3.606 0.076 9 0 "[ . 1 . 2]" 1
440 1 33 PHE H 1 99 ALA MB . . 5.310 5.321 5.089 5.411 0.101 10 0 "[ . 1 . 2]" 1
441 1 33 PHE HA 1 33 PHE QD . . 3.730 3.761 3.686 3.794 0.064 4 0 "[ . 1 . 2]" 1
442 1 33 PHE HA 1 34 THR H . . 2.830 2.563 2.421 2.719 . 0 0 "[ . 1 . 2]" 1
443 1 33 PHE HA 1 99 ALA MB . . 5.040 4.759 4.327 5.049 0.009 15 0 "[ . 1 . 2]" 1
444 1 33 PHE HB3 1 34 THR H . . 3.580 3.485 3.328 3.658 0.078 3 0 "[ . 1 . 2]" 1
445 1 33 PHE HB3 1 99 ALA HA . . 4.670 5.652 4.756 6.057 1.387 8 19 [*******+-**********2] 1
446 1 33 PHE HB3 1 99 ALA MB . . 3.810 3.284 2.826 3.626 . 0 0 "[ . 1 . 2]" 1
447 1 33 PHE HB3 1 102 GLN QE . . 4.980 4.894 3.947 5.377 0.397 5 0 "[ . 1 . 2]" 1
448 1 33 PHE QD 1 34 THR H . . 4.040 3.506 2.932 3.893 . 0 0 "[ . 1 . 2]" 1
449 1 33 PHE QD 1 35 LEU MD1 . . 4.070 3.225 2.191 4.173 0.103 11 0 "[ . 1 . 2]" 1
450 1 33 PHE QD 1 35 LEU HG . . 4.560 3.457 2.766 4.631 0.071 18 0 "[ . 1 . 2]" 1
451 1 33 PHE QD 1 99 ALA MB . . 3.310 2.480 2.170 2.767 . 0 0 "[ . 1 . 2]" 1
452 1 33 PHE QE 1 96 TYR QE . . 3.870 3.601 3.029 3.977 0.107 12 0 "[ . 1 . 2]" 1
453 1 33 PHE QE 1 99 ALA MB . . 3.930 2.655 2.360 3.133 . 0 0 "[ . 1 . 2]" 1
454 1 33 PHE HZ 1 35 LEU MD1 . . 5.080 4.795 4.295 5.192 0.112 11 0 "[ . 1 . 2]" 1
455 1 33 PHE HZ 1 95 LEU HB3 . . 4.330 3.675 3.097 4.345 0.015 1 0 "[ . 1 . 2]" 1
456 1 33 PHE HZ 1 96 TYR H . . 4.220 3.627 3.336 4.135 . 0 0 "[ . 1 . 2]" 1
457 1 33 PHE HZ 1 96 TYR HA . . 3.570 2.319 2.097 2.579 . 0 0 "[ . 1 . 2]" 1
458 1 33 PHE HZ 1 96 TYR QD . . 4.180 3.839 3.532 4.177 . 0 0 "[ . 1 . 2]" 1
459 1 33 PHE HZ 1 99 ALA MB . . 4.020 3.470 2.913 3.869 . 0 0 "[ . 1 . 2]" 1
460 1 34 THR H 1 34 THR HB . . 3.280 2.750 2.544 2.988 . 0 0 "[ . 1 . 2]" 1
461 1 34 THR H 1 34 THR MG . . 4.530 3.916 3.859 3.961 . 0 0 "[ . 1 . 2]" 1
462 1 34 THR H 1 35 LEU HG . . 5.440 4.420 3.962 4.852 . 0 0 "[ . 1 . 2]" 1
463 1 34 THR H 1 99 ALA MB . . 4.960 4.091 3.564 4.747 . 0 0 "[ . 1 . 2]" 1
464 1 34 THR H 1 102 GLN QE . . 4.570 3.323 3.022 3.766 . 0 0 "[ . 1 . 2]" 1
465 1 34 THR HA 1 34 THR MG . . 3.210 2.419 2.269 2.657 . 0 0 "[ . 1 . 2]" 1
466 1 34 THR HA 1 35 LEU H . . 2.940 2.286 2.169 2.375 . 0 0 "[ . 1 . 2]" 1
467 1 34 THR HA 1 35 LEU HG . . 4.760 4.488 4.233 4.818 0.058 17 0 "[ . 1 . 2]" 1
468 1 34 THR HB 1 35 LEU H . . 4.300 3.915 3.633 4.122 . 0 0 "[ . 1 . 2]" 1
469 1 34 THR HB 1 35 LEU HA . . 4.820 4.628 4.298 4.893 0.073 3 0 "[ . 1 . 2]" 1
470 1 34 THR HB 1 102 GLN QE . . 5.500 4.095 3.701 4.363 . 0 0 "[ . 1 . 2]" 1
471 1 34 THR MG 1 35 LEU H . . 3.360 2.459 2.236 2.722 . 0 0 "[ . 1 . 2]" 1
472 1 34 THR MG 1 36 SER H . . 5.060 4.893 4.505 5.136 0.076 3 0 "[ . 1 . 2]" 1
473 1 34 THR MG 1 102 GLN QE . . 5.500 4.533 4.342 4.687 . 0 0 "[ . 1 . 2]" 1
474 1 35 LEU H 1 35 LEU HB3 . . 4.190 3.642 3.521 3.924 . 0 0 "[ . 1 . 2]" 1
475 1 35 LEU H 1 35 LEU MD1 . . 3.800 3.835 2.975 3.908 0.108 7 0 "[ . 1 . 2]" 1
476 1 35 LEU H 1 35 LEU HG . . 3.940 3.567 3.261 3.800 . 0 0 "[ . 1 . 2]" 1
477 1 35 LEU H 1 36 SER H . . 4.660 4.442 4.348 4.518 . 0 0 "[ . 1 . 2]" 1
478 1 35 LEU H 1 40 LEU QD . . 5.500 4.171 3.876 4.799 . 0 0 "[ . 1 . 2]" 1
479 1 35 LEU H 1 102 GLN QE . . 5.500 4.488 4.118 4.689 . 0 0 "[ . 1 . 2]" 1
480 1 35 LEU HA 1 35 LEU MD1 . . 4.000 3.793 3.693 3.875 . 0 0 "[ . 1 . 2]" 1
481 1 35 LEU HA 1 35 LEU MD2 . . 3.230 2.343 2.133 3.215 . 0 0 "[ . 1 . 2]" 1
482 1 35 LEU HA 1 35 LEU HG . . 3.690 2.569 2.411 2.754 . 0 0 "[ . 1 . 2]" 1
483 1 35 LEU HA 1 36 SER H . . 3.010 2.346 2.195 2.493 . 0 0 "[ . 1 . 2]" 1
484 1 35 LEU HA 1 36 SER HA . . 4.900 4.408 4.328 4.512 . 0 0 "[ . 1 . 2]" 1
485 1 35 LEU HA 1 39 LEU QD . . 4.360 4.264 3.953 4.414 0.054 2 0 "[ . 1 . 2]" 1
486 1 35 LEU HA 1 102 GLN QE . . 3.640 2.685 1.962 3.111 . 0 0 "[ . 1 . 2]" 1
487 1 35 LEU HB3 1 36 SER H . . 4.690 2.594 2.113 2.774 . 0 0 "[ . 1 . 2]" 1
488 1 35 LEU HB3 1 39 LEU QD . . 5.500 3.716 2.626 4.001 . 0 0 "[ . 1 . 2]" 1
489 1 35 LEU MD1 1 36 SER H . . 4.500 4.590 4.549 4.607 0.107 1 0 "[ . 1 . 2]" 1
490 1 35 LEU MD1 1 95 LEU HA . . 5.120 3.087 2.774 4.004 . 0 0 "[ . 1 . 2]" 1
491 1 35 LEU MD1 1 98 LEU H . . 5.010 4.309 3.870 5.084 0.074 20 0 "[ . 1 . 2]" 1
492 1 35 LEU MD1 1 98 LEU HA . . 5.150 4.734 4.265 5.227 0.077 20 0 "[ . 1 . 2]" 1
493 1 35 LEU MD1 1 98 LEU HB3 . . 3.620 3.049 2.570 3.380 . 0 0 "[ . 1 . 2]" 1
494 1 35 LEU MD1 1 99 ALA H . . 3.950 2.684 2.335 3.495 . 0 0 "[ . 1 . 2]" 1
495 1 35 LEU MD1 1 99 ALA HA . . 3.490 3.107 2.297 3.558 0.068 13 0 "[ . 1 . 2]" 1
496 1 35 LEU MD1 1 99 ALA MB . . 3.470 2.343 2.089 3.134 . 0 0 "[ . 1 . 2]" 1
497 1 35 LEU MD1 1 102 GLN QE . . 4.670 4.116 3.632 4.372 . 0 0 "[ . 1 . 2]" 1
498 1 35 LEU MD2 1 36 SER H . . 3.830 2.873 2.609 3.694 . 0 0 "[ . 1 . 2]" 1
499 1 35 LEU MD2 1 39 LEU QD . . 4.770 1.967 1.882 2.056 . 0 0 "[ . 1 . 2]" 1
500 1 35 LEU MD2 1 95 LEU HA . . 5.020 4.872 4.500 5.110 0.090 3 0 "[ . 1 . 2]" 1
501 1 35 LEU MD2 1 98 LEU HB3 . . 3.740 2.456 2.076 2.985 . 0 0 "[ . 1 . 2]" 1
502 1 35 LEU MD2 1 99 ALA H . . 3.950 3.291 2.864 3.650 . 0 0 "[ . 1 . 2]" 1
503 1 35 LEU MD2 1 99 ALA HA . . 3.110 2.309 2.097 2.663 . 0 0 "[ . 1 . 2]" 1
504 1 35 LEU MD2 1 99 ALA MB . . 3.800 3.185 2.757 3.668 . 0 0 "[ . 1 . 2]" 1
505 1 35 LEU MD2 1 100 SER H . . 5.380 4.939 4.420 5.189 . 0 0 "[ . 1 . 2]" 1
506 1 35 LEU MD2 1 102 GLN H . . 4.700 4.495 4.231 4.733 0.033 19 0 "[ . 1 . 2]" 1
507 1 35 LEU MD2 1 102 GLN HA . . 5.460 3.761 3.248 4.213 . 0 0 "[ . 1 . 2]" 1
508 1 35 LEU MD2 1 102 GLN HB3 . . 3.660 2.307 2.092 2.710 . 0 0 "[ . 1 . 2]" 1
509 1 35 LEU MD2 1 102 GLN QE . . 3.830 2.718 1.856 3.507 . 0 0 "[ . 1 . 2]" 1
510 1 35 LEU MD2 1 102 GLN HG3 . . 5.500 4.141 3.797 4.411 . 0 0 "[ . 1 . 2]" 1
511 1 35 LEU HG 1 36 SER H . . 4.440 4.397 4.150 4.523 0.083 13 0 "[ . 1 . 2]" 1
512 1 35 LEU HG 1 39 LEU QD . . 5.410 4.402 4.030 4.671 . 0 0 "[ . 1 . 2]" 1
513 1 35 LEU HG 1 99 ALA HA . . 4.510 2.979 2.263 3.731 . 0 0 "[ . 1 . 2]" 1
514 1 35 LEU HG 1 99 ALA MB . . 4.220 2.858 2.541 4.244 0.024 20 0 "[ . 1 . 2]" 1
515 1 35 LEU HG 1 102 GLN HB3 . . 5.230 4.216 3.523 4.712 . 0 0 "[ . 1 . 2]" 1
516 1 35 LEU HG 1 102 GLN QE . . 4.690 2.902 2.440 3.260 . 0 0 "[ . 1 . 2]" 1
517 1 36 SER H 1 36 SER HB3 . . 3.580 3.277 2.482 3.639 0.059 20 0 "[ . 1 . 2]" 1
518 1 36 SER H 1 39 LEU H . . 4.790 4.245 3.794 4.685 . 0 0 "[ . 1 . 2]" 1
519 1 36 SER H 1 39 LEU HB3 . . 4.820 3.308 2.860 3.778 . 0 0 "[ . 1 . 2]" 1
520 1 36 SER H 1 39 LEU QD . . 4.230 3.631 3.338 3.959 . 0 0 "[ . 1 . 2]" 1
521 1 36 SER H 1 102 GLN QE . . 5.500 4.425 3.263 5.133 . 0 0 "[ . 1 . 2]" 1
522 1 36 SER HA 1 37 CYS H . . 3.100 2.241 2.145 2.375 . 0 0 "[ . 1 . 2]" 1
523 1 36 SER HA 1 38 GLU H . . 4.760 4.100 3.673 4.484 . 0 0 "[ . 1 . 2]" 1
524 1 36 SER HB3 1 37 CYS H . . 3.730 3.409 2.825 4.112 0.382 10 0 "[ . 1 . 2]" 1
525 1 36 SER HB3 1 38 GLU H . . 3.920 3.345 2.557 4.745 0.825 11 1 "[ . 1+ . 2]" 1
526 1 36 SER HB3 1 39 LEU H . . 4.710 3.488 2.533 4.413 . 0 0 "[ . 1 . 2]" 1
527 1 37 CYS H 1 37 CYS HB3 . . 3.650 3.380 2.389 3.671 0.021 14 0 "[ . 1 . 2]" 1
528 1 37 CYS H 1 38 GLU H . . 3.740 2.802 2.348 3.103 . 0 0 "[ . 1 . 2]" 1
529 1 37 CYS H 1 40 LEU QD . . 5.080 3.955 3.513 4.478 . 0 0 "[ . 1 . 2]" 1
530 1 37 CYS HA 1 40 LEU H . . 4.420 3.475 3.049 3.640 . 0 0 "[ . 1 . 2]" 1
531 1 37 CYS HA 1 40 LEU HB3 . . 4.430 3.816 3.387 4.489 0.059 20 0 "[ . 1 . 2]" 1
532 1 37 CYS HA 1 40 LEU QD . . 3.500 2.331 2.067 2.654 . 0 0 "[ . 1 . 2]" 1
533 1 37 CYS HA 1 41 ARG H . . 4.830 4.451 4.120 4.909 0.079 16 0 "[ . 1 . 2]" 1
534 1 37 CYS HA 1 66 ILE MD . . 4.210 3.944 3.213 4.309 0.099 5 0 "[ . 1 . 2]" 1
535 1 37 CYS HB3 1 38 GLU H . . 4.110 3.844 3.525 4.165 0.055 6 0 "[ . 1 . 2]" 1
536 1 37 CYS HB3 1 64 VAL QG . . 4.690 2.656 1.921 4.302 . 0 0 "[ . 1 . 2]" 1
537 1 37 CYS HB3 1 66 ILE MD . . 5.440 4.332 3.144 4.774 . 0 0 "[ . 1 . 2]" 1
538 1 37 CYS HB3 1 66 ILE HG13 . . 5.500 4.135 3.370 5.623 0.123 5 0 "[ . 1 . 2]" 1
539 1 38 GLU H 1 38 GLU HB3 . . 3.400 2.706 2.135 3.541 0.141 19 0 "[ . 1 . 2]" 1
540 1 38 GLU H 1 39 LEU H . . 3.680 2.880 2.657 3.007 . 0 0 "[ . 1 . 2]" 1
541 1 38 GLU H 1 40 LEU H . . 5.180 4.172 3.962 4.310 . 0 0 "[ . 1 . 2]" 1
542 1 38 GLU HA 1 41 ARG H . . 4.310 3.609 2.978 4.148 . 0 0 "[ . 1 . 2]" 1
543 1 38 GLU HA 1 42 VAL QG . . 5.500 3.649 3.205 4.706 . 0 0 "[ . 1 . 2]" 1
544 1 38 GLU HA 1 64 VAL H . . 5.440 5.399 4.918 5.528 0.088 3 0 "[ . 1 . 2]" 1
545 1 38 GLU HA 1 64 VAL QG . . 3.560 3.055 2.070 3.614 0.054 20 0 "[ . 1 . 2]" 1
546 1 38 GLU HB3 1 39 LEU H . . 4.780 3.210 2.311 4.094 . 0 0 "[ . 1 . 2]" 1
547 1 39 LEU H 1 39 LEU HB3 . . 3.570 2.777 2.576 3.183 . 0 0 "[ . 1 . 2]" 1
548 1 39 LEU H 1 39 LEU QD . . 4.680 3.616 3.473 3.738 . 0 0 "[ . 1 . 2]" 1
549 1 39 LEU H 1 39 LEU HG . . 4.940 4.484 3.833 4.671 . 0 0 "[ . 1 . 2]" 1
550 1 39 LEU H 1 40 LEU H . . 3.920 2.783 2.618 2.938 . 0 0 "[ . 1 . 2]" 1
551 1 39 LEU H 1 40 LEU HA . . 5.410 5.415 5.308 5.481 0.071 8 0 "[ . 1 . 2]" 1
552 1 39 LEU H 1 40 LEU QD . . 5.500 4.545 4.108 5.004 . 0 0 "[ . 1 . 2]" 1
553 1 39 LEU H 1 41 ARG H . . 4.790 4.368 3.997 4.812 0.022 8 0 "[ . 1 . 2]" 1
554 1 39 LEU H 1 42 VAL QG . . 5.500 3.927 3.592 4.314 . 0 0 "[ . 1 . 2]" 1
555 1 39 LEU H 1 106 TRP HZ3 . . 5.500 4.948 4.247 5.559 0.059 8 0 "[ . 1 . 2]" 1
556 1 39 LEU HA 1 39 LEU QD . . 3.220 2.198 2.008 2.478 . 0 0 "[ . 1 . 2]" 1
557 1 39 LEU HA 1 39 LEU HG . . 3.800 2.778 2.357 3.628 . 0 0 "[ . 1 . 2]" 1
558 1 39 LEU HA 1 42 VAL H . . 4.860 3.497 2.960 3.840 . 0 0 "[ . 1 . 2]" 1
559 1 39 LEU HA 1 42 VAL HB . . 5.360 4.387 2.103 5.106 . 0 0 "[ . 1 . 2]" 1
560 1 39 LEU HA 1 42 VAL QG . . 3.560 2.113 1.915 3.032 . 0 0 "[ . 1 . 2]" 1
561 1 39 LEU HA 1 43 TYR QD . . 5.500 4.980 4.241 5.593 0.093 14 0 "[ . 1 . 2]" 1
562 1 39 LEU HA 1 106 TRP HE3 . . 5.170 3.869 3.077 4.466 . 0 0 "[ . 1 . 2]" 1
563 1 39 LEU HA 1 106 TRP HZ3 . . 4.330 3.887 3.082 4.418 0.088 4 0 "[ . 1 . 2]" 1
564 1 39 LEU HB3 1 40 LEU H . . 3.920 2.707 2.451 3.126 . 0 0 "[ . 1 . 2]" 1
565 1 39 LEU QD 1 40 LEU H . . 4.400 4.000 3.632 4.152 . 0 0 "[ . 1 . 2]" 1
566 1 39 LEU QD 1 42 VAL QG . . 4.360 2.589 2.023 3.257 . 0 0 "[ . 1 . 2]" 1
567 1 39 LEU QD 1 43 TYR HB3 . . 5.500 3.804 2.351 5.022 . 0 0 "[ . 1 . 2]" 1
568 1 39 LEU QD 1 43 TYR QD . . 3.720 2.876 1.894 3.586 . 0 0 "[ . 1 . 2]" 1
569 1 39 LEU QD 1 98 LEU H . . 5.500 5.328 4.850 5.495 . 0 0 "[ . 1 . 2]" 1
570 1 39 LEU QD 1 98 LEU MD2 . . 3.530 2.591 2.025 3.135 . 0 0 "[ . 1 . 2]" 1
571 1 39 LEU QD 1 99 ALA H . . 5.500 4.910 4.505 5.243 . 0 0 "[ . 1 . 2]" 1
572 1 39 LEU QD 1 102 GLN H . . 4.590 4.495 4.298 4.575 . 0 0 "[ . 1 . 2]" 1
573 1 39 LEU QD 1 102 GLN HA . . 3.470 2.429 2.259 2.739 . 0 0 "[ . 1 . 2]" 1
574 1 39 LEU QD 1 102 GLN HB3 . . 4.260 2.906 2.443 3.274 . 0 0 "[ . 1 . 2]" 1
575 1 39 LEU QD 1 102 GLN HG3 . . 5.260 4.220 3.674 4.475 . 0 0 "[ . 1 . 2]" 1
576 1 39 LEU QD 1 103 VAL H . . 5.490 4.745 4.542 5.089 . 0 0 "[ . 1 . 2]" 1
577 1 39 LEU QD 1 105 LEU H . . 5.210 4.480 4.048 4.831 . 0 0 "[ . 1 . 2]" 1
578 1 39 LEU QD 1 105 LEU HB3 . . 5.050 3.317 2.146 4.596 . 0 0 "[ . 1 . 2]" 1
579 1 39 LEU QD 1 105 LEU QD . . 4.640 3.023 1.711 3.684 . 0 0 "[ . 1 . 2]" 1
580 1 39 LEU QD 1 106 TRP H . . 3.910 3.338 2.828 3.783 . 0 0 "[ . 1 . 2]" 1
581 1 39 LEU QD 1 106 TRP HA . . 3.680 2.851 2.326 3.559 . 0 0 "[ . 1 . 2]" 1
582 1 39 LEU QD 1 106 TRP HE3 . . 3.340 2.283 2.063 3.175 . 0 0 "[ . 1 . 2]" 1
583 1 39 LEU QD 1 106 TRP HZ3 . . 4.330 3.601 3.114 4.304 . 0 0 "[ . 1 . 2]" 1
584 1 39 LEU QD 1 109 TYR QE . . 3.210 2.811 1.972 3.286 0.076 4 0 "[ . 1 . 2]" 1
585 1 39 LEU HG 1 42 VAL QG . . 5.200 3.612 2.979 4.481 . 0 0 "[ . 1 . 2]" 1
586 1 39 LEU HG 1 43 TYR QD . . 3.930 3.682 2.729 4.048 0.118 7 0 "[ . 1 . 2]" 1
587 1 39 LEU HG 1 98 LEU MD2 . . 4.560 3.333 2.235 4.656 0.096 2 0 "[ . 1 . 2]" 1
588 1 39 LEU HG 1 109 TYR QE . . 4.660 4.445 3.531 4.756 0.096 8 0 "[ . 1 . 2]" 1
589 1 40 LEU H 1 40 LEU QD . . 3.890 2.780 2.372 3.282 . 0 0 "[ . 1 . 2]" 1
590 1 40 LEU H 1 41 ARG H . . 3.700 2.905 2.696 3.061 . 0 0 "[ . 1 . 2]" 1
591 1 40 LEU H 1 81 PHE HZ . . 5.500 5.402 4.750 5.592 0.092 10 0 "[ . 1 . 2]" 1
592 1 40 LEU HA 1 40 LEU QD . . 3.090 2.091 1.988 2.204 . 0 0 "[ . 1 . 2]" 1
593 1 40 LEU HA 1 40 LEU HG . . 4.220 2.930 2.642 3.682 . 0 0 "[ . 1 . 2]" 1
594 1 40 LEU HA 1 79 LEU QD . . 5.180 4.792 4.257 5.200 0.020 5 0 "[ . 1 . 2]" 1
595 1 40 LEU HA 1 90 TYR QE . . 5.360 3.193 2.733 3.622 . 0 0 "[ . 1 . 2]" 1
596 1 40 LEU HB3 1 81 PHE HZ . . 3.730 2.398 2.140 3.779 0.049 16 0 "[ . 1 . 2]" 1
597 1 40 LEU HB3 1 90 TYR QE . . 4.230 3.767 2.634 4.303 0.073 9 0 "[ . 1 . 2]" 1
598 1 40 LEU QD 1 41 ARG H . . 4.780 4.185 3.994 4.456 . 0 0 "[ . 1 . 2]" 1
599 1 40 LEU QD 1 79 LEU QD . . 3.970 2.196 1.809 2.867 . 0 0 "[ . 1 . 2]" 1
600 1 40 LEU QD 1 81 PHE HZ . . 5.050 3.368 2.351 4.662 . 0 0 "[ . 1 . 2]" 1
601 1 40 LEU QD 1 90 TYR QD . . 5.500 3.580 2.444 4.385 . 0 0 "[ . 1 . 2]" 1
602 1 40 LEU QD 1 90 TYR QE . . 3.470 3.265 2.454 3.522 0.052 16 0 "[ . 1 . 2]" 1
603 1 41 ARG H 1 41 ARG HB3 . . 3.740 2.877 2.509 3.309 . 0 0 "[ . 1 . 2]" 1
604 1 41 ARG H 1 81 PHE HZ . . 5.050 4.230 3.267 4.901 . 0 0 "[ . 1 . 2]" 1
605 1 41 ARG HA 1 41 ARG HD3 . . 4.410 2.943 2.290 3.649 . 0 0 "[ . 1 . 2]" 1
606 1 41 ARG HA 1 41 ARG HE . . 5.500 4.648 2.706 5.282 . 0 0 "[ . 1 . 2]" 1
607 1 41 ARG HA 1 44 SER H . . 4.800 4.440 3.289 4.870 0.070 19 0 "[ . 1 . 2]" 1
608 1 41 ARG HA 1 81 PHE HZ . . 4.620 3.675 2.485 4.688 0.068 14 0 "[ . 1 . 2]" 1
609 1 41 ARG HB3 1 42 VAL H . . 4.280 2.896 2.428 3.498 . 0 0 "[ . 1 . 2]" 1
610 1 41 ARG HE 1 81 PHE HB3 . . 5.500 5.514 3.818 6.644 1.144 8 6 "[ **. +-1 * .* 2]" 1
611 1 41 ARG HE 1 85 HIS HB3 . . 5.270 4.214 2.576 5.568 0.298 13 0 "[ . 1 . 2]" 1
612 1 42 VAL H 1 42 VAL HB . . 3.680 3.273 2.051 3.719 0.039 1 0 "[ . 1 . 2]" 1
613 1 42 VAL H 1 42 VAL QG . . 3.440 2.072 1.935 2.526 . 0 0 "[ . 1 . 2]" 1
614 1 42 VAL H 1 43 TYR H . . 3.450 2.695 2.519 2.945 . 0 0 "[ . 1 . 2]" 1
615 1 42 VAL H 1 43 TYR HA . . 5.330 5.281 5.091 5.398 0.068 12 0 "[ . 1 . 2]" 1
616 1 42 VAL H 1 43 TYR HB3 . . 5.270 5.474 5.048 6.223 0.953 18 3 "[ . 1 - *+ 2]" 1
617 1 42 VAL H 1 44 SER H . . 5.280 4.743 4.139 5.169 . 0 0 "[ . 1 . 2]" 1
618 1 42 VAL HA 1 58 VAL H . . 5.440 5.285 4.562 5.528 0.088 15 0 "[ . 1 . 2]" 1
619 1 42 VAL HA 1 58 VAL HB . . 3.700 2.866 2.237 3.778 0.078 2 0 "[ . 1 . 2]" 1
620 1 42 VAL HA 1 58 VAL QG . . 3.620 2.172 1.888 2.562 . 0 0 "[ . 1 . 2]" 1
621 1 42 VAL HB 1 43 TYR H . . 4.280 3.622 2.240 4.143 . 0 0 "[ . 1 . 2]" 1
622 1 42 VAL HB 1 58 VAL QG . . 5.250 2.976 1.863 4.572 . 0 0 "[ . 1 . 2]" 1
623 1 42 VAL QG 1 43 TYR H . . 3.720 2.295 1.932 2.999 . 0 0 "[ . 1 . 2]" 1
624 1 42 VAL QG 1 43 TYR HA . . 4.990 3.531 2.981 4.009 . 0 0 "[ . 1 . 2]" 1
625 1 42 VAL QG 1 43 TYR HB3 . . 5.000 4.051 3.566 4.814 . 0 0 "[ . 1 . 2]" 1
626 1 42 VAL QG 1 43 TYR QD . . 3.660 3.471 3.009 3.737 0.077 10 0 "[ . 1 . 2]" 1
627 1 42 VAL QG 1 44 SER H . . 5.500 4.419 4.267 4.812 . 0 0 "[ . 1 . 2]" 1
628 1 42 VAL QG 1 58 VAL H . . 5.330 4.162 3.182 4.980 . 0 0 "[ . 1 . 2]" 1
629 1 42 VAL QG 1 58 VAL HB . . 4.500 2.509 2.005 4.293 . 0 0 "[ . 1 . 2]" 1
630 1 42 VAL QG 1 58 VAL QG . . 3.540 2.163 1.852 2.696 . 0 0 "[ . 1 . 2]" 1
631 1 42 VAL QG 1 61 LYS H . . 5.500 4.519 3.823 5.347 . 0 0 "[ . 1 . 2]" 1
632 1 42 VAL QG 1 106 TRP HE3 . . 4.770 3.215 2.268 3.947 . 0 0 "[ . 1 . 2]" 1
633 1 42 VAL QG 1 106 TRP HH2 . . 5.180 3.982 3.035 4.864 . 0 0 "[ . 1 . 2]" 1
634 1 42 VAL QG 1 106 TRP HZ3 . . 3.830 2.483 1.930 3.413 . 0 0 "[ . 1 . 2]" 1
635 1 42 VAL QG 1 109 TYR HB3 . . 5.500 4.034 2.636 4.640 . 0 0 "[ . 1 . 2]" 1
636 1 42 VAL QG 1 109 TYR QE . . 3.640 2.609 2.161 3.309 . 0 0 "[ . 1 . 2]" 1
637 1 43 TYR H 1 43 TYR HB3 . . 3.480 2.945 2.731 3.514 0.034 15 0 "[ . 1 . 2]" 1
638 1 43 TYR H 1 44 SER H . . 3.550 3.310 2.494 3.625 0.075 15 0 "[ . 1 . 2]" 1
639 1 43 TYR H 1 58 VAL QG . . 5.460 4.655 4.164 5.087 . 0 0 "[ . 1 . 2]" 1
640 1 43 TYR H 1 98 LEU MD2 . . 5.500 4.712 4.237 5.405 . 0 0 "[ . 1 . 2]" 1
641 1 43 TYR HA 1 43 TYR QD . . 3.590 2.729 2.199 2.977 . 0 0 "[ . 1 . 2]" 1
642 1 43 TYR HA 1 58 VAL QG . . 5.280 4.627 3.916 5.182 . 0 0 "[ . 1 . 2]" 1
643 1 43 TYR HA 1 98 LEU MD2 . . 5.020 4.476 4.177 4.735 . 0 0 "[ . 1 . 2]" 1
644 1 43 TYR HA 1 109 TYR QE . . 4.470 4.400 3.789 4.566 0.096 17 0 "[ . 1 . 2]" 1
645 1 43 TYR HB3 1 44 SER H . . 5.100 4.251 2.587 4.529 . 0 0 "[ . 1 . 2]" 1
646 1 43 TYR HB3 1 98 LEU MD1 . . 4.150 2.737 2.173 3.564 . 0 0 "[ . 1 . 2]" 1
647 1 43 TYR HB3 1 98 LEU MD2 . . 3.590 2.564 2.115 3.592 0.002 20 0 "[ . 1 . 2]" 1
648 1 43 TYR HB3 1 109 TYR QE . . 4.770 5.016 4.186 5.881 1.111 20 4 "[ *-. 1 .* +]" 1
649 1 43 TYR QD 1 98 LEU MD2 . . 3.900 2.536 2.254 2.772 . 0 0 "[ . 1 . 2]" 1
650 1 43 TYR QD 1 98 LEU HG . . 4.670 4.672 4.187 4.772 0.102 15 0 "[ . 1 . 2]" 1
651 1 43 TYR QE 1 98 LEU MD2 . . 4.920 3.268 2.854 3.697 . 0 0 "[ . 1 . 2]" 1
652 1 43 TYR QE 1 105 LEU HA . . 5.500 3.911 2.747 4.608 . 0 0 "[ . 1 . 2]" 1
653 1 43 TYR QE 1 105 LEU HB3 . . 3.910 2.619 2.058 3.974 0.064 16 0 "[ . 1 . 2]" 1
654 1 43 TYR QE 1 105 LEU QD . . 3.160 2.139 1.864 2.556 . 0 0 "[ . 1 . 2]" 1
655 1 44 SER H 1 44 SER HB3 . . 3.380 3.149 2.479 3.595 0.215 5 0 "[ . 1 . 2]" 1
656 1 44 SER H 1 45 PRO HD3 . . 5.420 4.900 3.450 5.095 . 0 0 "[ . 1 . 2]" 1
657 1 44 SER H 1 46 SER H . . 5.230 5.215 4.811 5.304 0.074 14 0 "[ . 1 . 2]" 1
658 1 44 SER H 1 47 ALA MB . . 5.260 3.940 2.781 5.340 0.080 3 0 "[ . 1 . 2]" 1
659 1 44 SER H 1 58 VAL QG . . 4.720 4.340 3.973 4.606 . 0 0 "[ . 1 . 2]" 1
660 1 44 SER HA 1 45 PRO HD3 . . 3.830 2.380 2.061 2.912 . 0 0 "[ . 1 . 2]" 1
661 1 44 SER HA 1 45 PRO HG3 . . 4.720 4.549 4.358 4.704 . 0 0 "[ . 1 . 2]" 1
662 1 44 SER HA 1 90 TYR QE . . 4.190 3.237 2.253 4.278 0.088 1 0 "[ . 1 . 2]" 1
663 1 44 SER HB3 1 46 SER H . . 4.850 3.588 2.543 4.784 . 0 0 "[ . 1 . 2]" 1
664 1 44 SER HB3 1 47 ALA MB . . 5.430 3.961 2.847 4.883 . 0 0 "[ . 1 . 2]" 1
665 1 45 PRO HB3 1 46 SER H . . 4.170 4.372 4.245 4.454 0.284 16 0 "[ . 1 . 2]" 1
666 1 45 PRO HD3 1 46 SER H . . 4.550 3.934 3.664 4.240 . 0 0 "[ . 1 . 2]" 1
667 1 45 PRO HD3 1 47 ALA MB . . 5.450 6.107 5.703 6.729 1.279 4 11 "[* *+***-*1 *** 2]" 1
668 1 45 PRO HD3 1 89 LEU H . . 5.500 5.573 4.091 6.565 1.065 2 8 "[ + * * ** ** -]" 1
669 1 45 PRO HD3 1 90 TYR QD . . 5.500 3.670 2.683 4.720 . 0 0 "[ . 1 . 2]" 1
670 1 45 PRO HD3 1 90 TYR QE . . 5.500 3.238 2.529 4.502 . 0 0 "[ . 1 . 2]" 1
671 1 45 PRO HD3 1 94 VAL MG1 . . 5.500 3.133 2.512 4.042 . 0 0 "[ . 1 . 2]" 1
672 1 45 PRO HG3 1 46 SER H . . 4.970 4.319 3.981 4.735 . 0 0 "[ . 1 . 2]" 1
673 1 45 PRO HG3 1 89 LEU H . . 5.120 4.611 2.781 5.200 0.080 12 0 "[ . 1 . 2]" 1
674 1 45 PRO HG3 1 90 TYR HA . . 4.030 2.930 2.087 4.049 0.019 4 0 "[ . 1 . 2]" 1
675 1 45 PRO HG3 1 94 VAL MG1 . . 3.570 3.153 2.518 3.672 0.102 3 0 "[ . 1 . 2]" 1
676 1 46 SER H 1 49 VAL QG . . 5.500 4.718 4.211 5.476 . 0 0 "[ . 1 . 2]" 1
677 1 46 SER HA 1 47 ALA H . . 3.050 2.641 2.144 3.135 0.085 12 0 "[ . 1 . 2]" 1
678 1 46 SER HA 1 47 ALA MB . . 4.710 4.422 4.018 4.793 0.083 19 0 "[ . 1 . 2]" 1
679 1 47 ALA H 1 47 ALA MB . . 3.140 2.542 2.231 3.039 . 0 0 "[ . 1 . 2]" 1
680 1 47 ALA H 1 48 GLU H . . 3.290 2.737 2.032 3.390 0.100 3 0 "[ . 1 . 2]" 1
681 1 47 ALA H 1 49 VAL HB . . 5.500 4.657 3.225 5.562 0.062 17 0 "[ . 1 . 2]" 1
682 1 47 ALA HA 1 56 VAL QG . . 5.100 4.186 2.685 5.127 0.027 9 0 "[ . 1 . 2]" 1
683 1 47 ALA MB 1 48 GLU H . . 2.930 2.104 1.937 2.845 . 0 0 "[ . 1 . 2]" 1
684 1 47 ALA MB 1 48 GLU HA . . 4.760 4.041 3.719 4.281 . 0 0 "[ . 1 . 2]" 1
685 1 47 ALA MB 1 48 GLU HG3 . . 4.420 3.749 2.352 4.839 0.419 12 0 "[ . 1 . 2]" 1
686 1 47 ALA MB 1 49 VAL H . . 5.350 4.242 3.567 5.121 . 0 0 "[ . 1 . 2]" 1
687 1 47 ALA MB 1 49 VAL QG . . 4.360 3.968 2.936 4.408 0.048 20 0 "[ . 1 . 2]" 1
688 1 47 ALA MB 1 55 PRO HA . . 4.120 3.141 2.072 4.094 . 0 0 "[ . 1 . 2]" 1
689 1 47 ALA MB 1 55 PRO HB3 . . 5.180 3.880 2.251 5.256 0.076 18 0 "[ . 1 . 2]" 1
690 1 47 ALA MB 1 56 VAL H . . 5.500 3.216 2.092 4.061 . 0 0 "[ . 1 . 2]" 1
691 1 47 ALA MB 1 56 VAL QG . . 4.710 2.953 1.966 4.045 . 0 0 "[ . 1 . 2]" 1
692 1 48 GLU H 1 48 GLU HA . . 2.850 2.908 2.835 2.931 0.081 11 0 "[ . 1 . 2]" 1
693 1 48 GLU H 1 48 GLU HB3 . . 3.780 3.326 2.702 3.847 0.067 7 0 "[ . 1 . 2]" 1
694 1 48 GLU H 1 48 GLU HG3 . . 3.910 2.977 2.320 3.974 0.064 3 0 "[ . 1 . 2]" 1
695 1 48 GLU H 1 49 VAL H . . 3.750 3.182 2.345 3.799 0.049 13 0 "[ . 1 . 2]" 1
696 1 48 GLU HA 1 48 GLU HG3 . . 3.760 3.317 2.238 3.840 0.080 5 0 "[ . 1 . 2]" 1
697 1 48 GLU HA 1 49 VAL H . . 2.780 2.604 2.232 2.855 0.075 12 0 "[ . 1 . 2]" 1
698 1 48 GLU HA 1 49 VAL QG . . 4.400 4.127 3.775 4.318 . 0 0 "[ . 1 . 2]" 1
699 1 48 GLU HA 1 50 HIS H . . 5.020 3.680 3.132 4.964 . 0 0 "[ . 1 . 2]" 1
700 1 48 GLU HG3 1 49 VAL H . . 4.710 4.718 3.355 5.591 0.881 9 2 "[ . +1 - . 2]" 1
701 1 49 VAL H 1 49 VAL HB . . 3.050 2.745 2.336 3.149 0.099 12 0 "[ . 1 . 2]" 1
702 1 49 VAL H 1 49 VAL QG . . 3.200 2.223 1.878 2.764 . 0 0 "[ . 1 . 2]" 1
703 1 49 VAL H 1 50 HIS H . . 3.620 2.313 1.928 2.800 . 0 0 "[ . 1 . 2]" 1
704 1 49 VAL H 1 50 HIS HA . . 4.440 4.404 3.955 4.520 0.080 7 0 "[ . 1 . 2]" 1
705 1 49 VAL H 1 55 PRO HA . . 5.080 4.818 3.528 5.163 0.083 19 0 "[ . 1 . 2]" 1
706 1 49 VAL HA 1 49 VAL QG . . 3.130 2.207 2.018 2.395 . 0 0 "[ . 1 . 2]" 1
707 1 49 VAL HA 1 50 HIS HB3 . . 5.100 5.088 4.713 5.516 0.416 8 0 "[ . 1 . 2]" 1
708 1 49 VAL HB 1 50 HIS H . . 3.980 3.338 2.042 4.065 0.085 20 0 "[ . 1 . 2]" 1
709 1 49 VAL HB 1 53 GLY QA . . 5.250 4.098 2.505 5.142 . 0 0 "[ . 1 . 2]" 1
710 1 49 VAL QG 1 50 HIS H . . 4.100 2.905 1.889 3.629 . 0 0 "[ . 1 . 2]" 1
711 1 49 VAL QG 1 50 HIS HB3 . . 5.350 4.480 3.181 5.467 0.117 20 0 "[ . 1 . 2]" 1
712 1 49 VAL QG 1 51 GLY H . . 5.500 2.956 1.810 4.821 . 0 0 "[ . 1 . 2]" 1
713 1 49 VAL QG 1 53 GLY QA . . 5.130 2.765 1.834 3.789 . 0 0 "[ . 1 . 2]" 1
714 1 50 HIS H 1 50 HIS HB3 . . 3.970 3.703 2.818 3.890 . 0 0 "[ . 1 . 2]" 1
715 1 50 HIS H 1 50 HIS HD2 . . 4.110 4.101 3.862 4.213 0.103 11 0 "[ . 1 . 2]" 1
716 1 50 HIS HA 1 50 HIS HD2 . . 2.790 2.535 2.053 2.869 0.079 10 0 "[ . 1 . 2]" 1
717 1 50 HIS HA 1 51 GLY H . . 3.330 2.976 2.337 3.411 0.081 12 0 "[ . 1 . 2]" 1
718 1 50 HIS HB3 1 51 GLY H . . 5.500 3.789 2.633 4.516 . 0 0 "[ . 1 . 2]" 1
719 1 51 GLY HA2 1 52 HIS HA . . 5.010 4.637 4.256 4.882 . 0 0 "[ . 1 . 2]" 1
720 1 51 GLY HA3 1 52 HIS HA . . 4.750 4.527 4.230 5.112 0.362 12 0 "[ . 1 . 2]" 1
721 1 51 GLY HA3 1 52 HIS HD2 . . 4.370 3.990 2.905 4.882 0.512 12 1 "[ . 1 + . 2]" 1
722 1 52 HIS HA 1 52 HIS HD2 . . 4.360 2.897 2.290 4.436 0.076 16 0 "[ . 1 . 2]" 1
723 1 52 HIS HA 1 53 GLY QA . . 5.130 4.139 3.904 4.430 . 0 0 "[ . 1 . 2]" 1
724 1 52 HIS HB3 1 52 HIS HD2 . . 3.520 3.583 2.577 3.941 0.421 15 0 "[ . 1 . 2]" 1
725 1 52 HIS HB3 1 53 GLY H . . 5.210 3.925 2.410 4.553 . 0 0 "[ . 1 . 2]" 1
726 1 53 GLY QA 1 54 ASN H . . 3.390 2.317 2.157 2.901 . 0 0 "[ . 1 . 2]" 1
727 1 53 GLY QA 1 54 ASN HA . . 4.770 4.042 3.983 4.172 . 0 0 "[ . 1 . 2]" 1
728 1 54 ASN H 1 54 ASN HB3 . . 3.820 3.195 2.810 3.490 . 0 0 "[ . 1 . 2]" 1
729 1 54 ASN H 1 54 ASN HD21 . . 4.650 3.583 2.365 4.633 . 0 0 "[ . 1 . 2]" 1
730 1 54 ASN H 1 54 ASN HD22 . . 5.420 3.828 2.984 4.435 . 0 0 "[ . 1 . 2]" 1
731 1 54 ASN H 1 55 PRO HD3 . . 5.500 4.967 4.658 5.193 . 0 0 "[ . 1 . 2]" 1
732 1 54 ASN HA 1 54 ASN HD22 . . 5.500 5.198 4.985 5.459 . 0 0 "[ . 1 . 2]" 1
733 1 54 ASN HA 1 55 PRO HD3 . . 2.870 2.332 2.169 2.504 . 0 0 "[ . 1 . 2]" 1
734 1 54 ASN HB3 1 54 ASN HD21 . . 3.610 2.769 2.161 3.571 . 0 0 "[ . 1 . 2]" 1
735 1 54 ASN HB3 1 55 PRO HD3 . . 3.750 4.181 3.821 4.350 0.600 13 12 "[*** * ***- + * ** 2]" 1
736 1 55 PRO HA 1 56 VAL H . . 2.630 2.365 2.087 2.698 0.068 4 0 "[ . 1 . 2]" 1
737 1 55 PRO HA 1 56 VAL HA . . 4.610 4.463 4.207 4.675 0.065 19 0 "[ . 1 . 2]" 1
738 1 55 PRO HA 1 56 VAL QG . . 3.790 3.429 2.950 3.801 0.011 1 0 "[ . 1 . 2]" 1
739 1 55 PRO HB3 1 56 VAL H . . 3.760 3.605 3.270 3.835 0.075 2 0 "[ . 1 . 2]" 1
740 1 56 VAL H 1 56 VAL QG . . 2.960 2.309 1.816 2.935 . 0 0 "[ . 1 . 2]" 1
741 1 56 VAL HA 1 56 VAL QG . . 3.020 2.276 2.135 2.481 . 0 0 "[ . 1 . 2]" 1
742 1 56 VAL HA 1 57 LEU H . . 2.680 2.342 2.139 2.675 . 0 0 "[ . 1 . 2]" 1
743 1 56 VAL HA 1 57 LEU HA . . 4.820 4.465 4.335 4.646 . 0 0 "[ . 1 . 2]" 1
744 1 56 VAL HA 1 57 LEU HB3 . . 4.680 4.880 4.632 5.083 0.403 4 0 "[ . 1 . 2]" 1
745 1 56 VAL HB 1 57 LEU H . . 3.890 3.597 2.141 3.976 0.086 8 0 "[ . 1 . 2]" 1
746 1 56 VAL QG 1 57 LEU H . . 3.380 2.404 1.925 3.039 . 0 0 "[ . 1 . 2]" 1
747 1 56 VAL QG 1 57 LEU HB3 . . 4.880 3.849 3.165 4.827 . 0 0 "[ . 1 . 2]" 1
748 1 56 VAL QG 1 58 VAL H . . 4.980 4.155 3.653 4.786 . 0 0 "[ . 1 . 2]" 1
749 1 56 VAL QG 1 58 VAL HA . . 4.440 3.920 3.215 4.424 . 0 0 "[ . 1 . 2]" 1
750 1 57 LEU H 1 57 LEU HB3 . . 3.240 2.620 2.401 2.886 . 0 0 "[ . 1 . 2]" 1
751 1 57 LEU H 1 57 LEU QD . . 4.410 3.760 3.551 3.884 . 0 0 "[ . 1 . 2]" 1
752 1 57 LEU H 1 58 VAL H . . 4.590 4.443 4.113 4.658 0.068 15 0 "[ . 1 . 2]" 1
753 1 57 LEU HA 1 57 LEU QD . . 3.190 2.158 2.000 2.837 . 0 0 "[ . 1 . 2]" 1
754 1 57 LEU HA 1 58 VAL H . . 3.110 2.243 2.134 2.432 . 0 0 "[ . 1 . 2]" 1
755 1 57 LEU HA 1 58 VAL QG . . 3.910 3.557 3.035 3.898 . 0 0 "[ . 1 . 2]" 1
756 1 57 LEU HB3 1 58 VAL H . . 5.330 4.224 3.750 4.556 . 0 0 "[ . 1 . 2]" 1
757 1 57 LEU QD 1 58 VAL H . . 3.630 2.743 2.269 3.115 . 0 0 "[ . 1 . 2]" 1
758 1 57 LEU QD 1 59 THR MG . . 3.480 3.325 3.009 3.553 0.073 4 0 "[ . 1 . 2]" 1
759 1 57 LEU QD 1 112 ARG H . . 5.290 4.396 3.908 4.832 . 0 0 "[ . 1 . 2]" 1
760 1 57 LEU QD 1 112 ARG HA . . 4.550 3.982 3.723 4.229 . 0 0 "[ . 1 . 2]" 1
761 1 57 LEU QD 1 112 ARG HB3 . . 3.710 2.362 2.080 2.748 . 0 0 "[ . 1 . 2]" 1
762 1 57 LEU QD 1 112 ARG HE . . 5.500 4.328 2.100 5.414 . 0 0 "[ . 1 . 2]" 1
763 1 57 LEU QD 1 112 ARG HG3 . . 5.500 3.739 3.276 4.102 . 0 0 "[ . 1 . 2]" 1
764 1 57 LEU QD 1 113 LEU H . . 4.530 3.424 3.004 3.961 . 0 0 "[ . 1 . 2]" 1
765 1 57 LEU QD 1 113 LEU HA . . 3.560 2.368 1.972 2.920 . 0 0 "[ . 1 . 2]" 1
766 1 57 LEU QD 1 115 ALA MB . . 5.500 4.529 3.910 4.869 . 0 0 "[ . 1 . 2]" 1
767 1 57 LEU QD 1 116 ALA H . . 4.830 4.123 3.777 4.458 . 0 0 "[ . 1 . 2]" 1
768 1 57 LEU QD 1 116 ALA HA . . 5.500 4.580 4.032 5.152 . 0 0 "[ . 1 . 2]" 1
769 1 57 LEU QD 1 116 ALA MB . . 3.370 2.296 1.895 2.822 . 0 0 "[ . 1 . 2]" 1
770 1 57 LEU QD 1 118 ALA H . . 5.500 4.146 3.550 4.951 . 0 0 "[ . 1 . 2]" 1
771 1 57 LEU QD 1 118 ALA MB . . 3.750 2.528 2.053 3.078 . 0 0 "[ . 1 . 2]" 1
772 1 57 LEU QD 1 119 SER H . . 5.500 5.278 4.657 5.509 0.009 19 0 "[ . 1 . 2]" 1
773 1 57 LEU HG 1 58 VAL H . . 5.010 4.005 2.073 5.091 0.081 7 0 "[ . 1 . 2]" 1
774 1 58 VAL H 1 58 VAL HB . . 3.540 2.881 2.600 3.547 0.007 14 0 "[ . 1 . 2]" 1
775 1 58 VAL H 1 58 VAL QG . . 3.280 2.411 1.801 2.997 . 0 0 "[ . 1 . 2]" 1
776 1 58 VAL H 1 59 THR H . . 5.130 4.428 4.251 4.560 . 0 0 "[ . 1 . 2]" 1
777 1 58 VAL HA 1 58 VAL QG . . 3.260 2.155 2.051 2.382 . 0 0 "[ . 1 . 2]" 1
778 1 58 VAL HA 1 59 THR H . . 2.770 2.278 2.048 2.557 . 0 0 "[ . 1 . 2]" 1
779 1 58 VAL HB 1 59 THR H . . 4.540 3.558 2.513 4.253 . 0 0 "[ . 1 . 2]" 1
780 1 58 VAL QG 1 59 THR H . . 3.740 2.324 1.745 3.120 . 0 0 "[ . 1 . 2]" 1
781 1 58 VAL QG 1 59 THR HA . . 5.270 4.159 3.873 4.546 . 0 0 "[ . 1 . 2]" 1
782 1 59 THR H 1 59 THR MG . . 3.730 2.666 2.342 3.138 . 0 0 "[ . 1 . 2]" 1
783 1 59 THR H 1 118 ALA MB . . 5.100 4.868 4.178 5.181 0.081 18 0 "[ . 1 . 2]" 1
784 1 59 THR HA 1 59 THR MG . . 3.470 2.267 2.032 2.528 . 0 0 "[ . 1 . 2]" 1
785 1 59 THR HA 1 60 HIS H . . 3.430 2.615 2.373 2.896 . 0 0 "[ . 1 . 2]" 1
786 1 59 THR HA 1 113 LEU QD . . 4.390 2.937 2.041 3.571 . 0 0 "[ . 1 . 2]" 1
787 1 59 THR HA 1 118 ALA MB . . 4.980 3.879 2.938 4.300 . 0 0 "[ . 1 . 2]" 1
788 1 59 THR HA 1 120 ARG HA . . 5.140 4.999 4.420 5.222 0.082 5 0 "[ . 1 . 2]" 1
789 1 59 THR HB 1 60 HIS H . . 3.990 2.286 1.983 2.651 . 0 0 "[ . 1 . 2]" 1
790 1 59 THR HB 1 60 HIS HD2 . . 5.410 5.052 4.548 5.490 0.080 4 0 "[ . 1 . 2]" 1
791 1 59 THR HB 1 118 ALA MB . . 4.670 4.180 3.035 4.764 0.094 4 0 "[ . 1 . 2]" 1
792 1 59 THR HB 1 119 SER H . . 4.800 4.117 3.293 4.876 0.076 4 0 "[ . 1 . 2]" 1
793 1 59 THR HB 1 120 ARG HA . . 4.950 3.958 3.190 4.907 . 0 0 "[ . 1 . 2]" 1
794 1 59 THR MG 1 60 HIS H . . 4.240 3.491 2.430 3.938 . 0 0 "[ . 1 . 2]" 1
795 1 59 THR MG 1 60 HIS HD2 . . 5.500 5.456 4.823 5.612 0.112 6 0 "[ . 1 . 2]" 1
796 1 59 THR MG 1 113 LEU HA . . 5.110 4.532 3.959 5.051 . 0 0 "[ . 1 . 2]" 1
797 1 59 THR MG 1 113 LEU QD . . 3.640 2.479 2.039 3.221 . 0 0 "[ . 1 . 2]" 1
798 1 59 THR MG 1 118 ALA H . . 4.960 4.588 4.366 4.850 . 0 0 "[ . 1 . 2]" 1
799 1 59 THR MG 1 118 ALA HA . . 4.960 3.798 2.786 4.250 . 0 0 "[ . 1 . 2]" 1
800 1 59 THR MG 1 118 ALA MB . . 3.090 2.033 1.910 2.233 . 0 0 "[ . 1 . 2]" 1
801 1 59 THR MG 1 119 SER H . . 4.290 2.180 1.872 2.532 . 0 0 "[ . 1 . 2]" 1
802 1 60 HIS H 1 60 HIS HD2 . . 3.970 3.114 2.379 4.077 0.107 4 0 "[ . 1 . 2]" 1
803 1 60 HIS H 1 113 LEU QD . . 5.440 3.283 2.564 4.015 . 0 0 "[ . 1 . 2]" 1
804 1 60 HIS H 1 118 ALA MB . . 5.500 5.275 4.270 5.585 0.085 6 0 "[ . 1 . 2]" 1
805 1 60 HIS H 1 120 ARG HA . . 3.540 3.200 2.765 3.510 . 0 0 "[ . 1 . 2]" 1
806 1 60 HIS HA 1 120 ARG HA . . 5.420 5.375 5.113 5.516 0.096 4 0 "[ . 1 . 2]" 1
807 1 60 HIS HA 1 121 GLU H . . 4.960 5.026 4.950 5.064 0.104 20 0 "[ . 1 . 2]" 1
808 1 60 HIS HB3 1 60 HIS HD2 . . 3.950 3.484 2.126 3.801 . 0 0 "[ . 1 . 2]" 1
809 1 60 HIS HB3 1 61 LYS H . . 5.390 2.411 2.029 3.374 . 0 0 "[ . 1 . 2]" 1
810 1 60 HIS HB3 1 61 LYS HA . . 4.540 4.535 3.694 4.633 0.093 18 0 "[ . 1 . 2]" 1
811 1 60 HIS HB3 1 123 LEU MD1 . . 4.760 3.111 2.523 3.965 . 0 0 "[ . 1 . 2]" 1
812 1 60 HIS HB3 1 123 LEU MD2 . . 4.760 4.438 3.642 5.300 0.540 4 1 "[ +. 1 . 2]" 1
813 1 60 HIS HB3 1 123 LEU HG . . 4.710 2.915 2.140 3.974 . 0 0 "[ . 1 . 2]" 1
814 1 60 HIS HD2 1 123 LEU MD1 . . 4.590 3.956 2.537 4.664 0.074 15 0 "[ . 1 . 2]" 1
815 1 60 HIS HD2 1 123 LEU HG . . 5.500 4.234 3.578 4.874 . 0 0 "[ . 1 . 2]" 1
816 1 61 LYS H 1 123 LEU HG . . 4.340 4.216 3.487 4.437 0.097 4 0 "[ . 1 . 2]" 1
817 1 61 LYS HA 1 61 LYS HE3 . . 3.380 3.099 1.808 3.474 0.094 18 0 "[ . 1 . 2]" 1
818 1 61 LYS HA 1 62 LYS HA . . 4.370 4.228 3.935 4.419 0.049 12 0 "[ . 1 . 2]" 1
819 1 61 LYS HA 1 121 GLU HB3 . . 4.610 3.722 3.083 4.722 0.112 14 0 "[ . 1 . 2]" 1
820 1 61 LYS HA 1 121 GLU HG3 . . 4.190 3.348 2.420 4.280 0.090 6 0 "[ . 1 . 2]" 1
821 1 62 LYS H 1 62 LYS HB3 . . 3.850 2.937 2.454 3.307 . 0 0 "[ . 1 . 2]" 1
822 1 62 LYS H 1 62 LYS HD3 . . 4.050 2.392 1.826 4.116 0.066 10 0 "[ . 1 . 2]" 1
823 1 62 LYS H 1 63 ASN H . . 3.940 3.233 2.346 3.861 . 0 0 "[ . 1 . 2]" 1
824 1 62 LYS H 1 64 VAL H . . 5.500 5.182 3.631 5.581 0.081 9 0 "[ . 1 . 2]" 1
825 1 62 LYS H 1 122 PRO HG3 . . 4.780 6.099 5.836 6.441 1.661 1 20 [+*****-*************] 1
826 1 62 LYS HB3 1 63 ASN H . . 4.520 3.789 3.181 4.140 . 0 0 "[ . 1 . 2]" 1
827 1 62 LYS HB3 1 63 ASN HD21 . . 5.330 4.213 3.473 5.069 . 0 0 "[ . 1 . 2]" 1
828 1 62 LYS HB3 1 63 ASN HD22 . . 5.500 4.431 2.623 5.996 0.496 19 0 "[ . 1 . 2]" 1
829 1 62 LYS HB3 1 122 PRO HG3 . . 4.950 3.601 3.128 4.018 . 0 0 "[ . 1 . 2]" 1
830 1 63 ASN H 1 63 ASN HB3 . . 3.840 3.786 3.461 3.937 0.097 8 0 "[ . 1 . 2]" 1
831 1 63 ASN H 1 63 ASN HD21 . . 4.990 3.891 3.499 4.436 . 0 0 "[ . 1 . 2]" 1
832 1 63 ASN H 1 63 ASN HD22 . . 5.420 4.518 4.002 5.294 . 0 0 "[ . 1 . 2]" 1
833 1 63 ASN H 1 64 VAL H . . 3.320 3.166 2.457 3.397 0.077 15 0 "[ . 1 . 2]" 1
834 1 63 ASN H 1 64 VAL QG . . 5.330 3.553 2.954 4.441 . 0 0 "[ . 1 . 2]" 1
835 1 63 ASN H 1 122 PRO HG3 . . 5.060 6.560 5.864 6.798 1.738 2 20 [*+*******-**********] 1
836 1 63 ASN HA 1 63 ASN HD21 . . 4.890 3.848 3.388 4.250 . 0 0 "[ . 1 . 2]" 1
837 1 63 ASN HB3 1 64 VAL H . . 4.840 4.382 4.118 4.659 . 0 0 "[ . 1 . 2]" 1
838 1 63 ASN HB3 1 64 VAL HA . . 5.360 5.530 4.740 6.201 0.841 1 9 "[+ * .** -1* *.* *]" 1
839 1 63 ASN HD21 1 122 PRO HG3 . . 5.160 4.641 4.238 4.801 . 0 0 "[ . 1 . 2]" 1
840 1 63 ASN HD22 1 122 PRO HG3 . . 4.790 4.604 4.051 4.909 0.119 4 0 "[ . 1 . 2]" 1
841 1 64 VAL H 1 64 VAL HB . . 3.210 2.631 2.282 3.045 . 0 0 "[ . 1 . 2]" 1
842 1 64 VAL H 1 64 VAL QG . . 3.460 2.172 1.809 2.591 . 0 0 "[ . 1 . 2]" 1
843 1 64 VAL H 1 65 ASN H . . 4.620 4.486 3.927 4.681 0.061 6 0 "[ . 1 . 2]" 1
844 1 64 VAL HA 1 64 VAL QG . . 3.310 2.215 2.079 2.439 . 0 0 "[ . 1 . 2]" 1
845 1 64 VAL HA 1 65 ASN H . . 2.960 2.252 2.083 2.452 . 0 0 "[ . 1 . 2]" 1
846 1 64 VAL HA 1 65 ASN HA . . 5.230 4.475 4.389 4.588 . 0 0 "[ . 1 . 2]" 1
847 1 64 VAL HA 1 82 ASP H . . 4.990 4.600 3.571 5.057 0.067 3 0 "[ . 1 . 2]" 1
848 1 64 VAL HB 1 65 ASN H . . 4.200 4.074 3.519 4.287 0.087 10 0 "[ . 1 . 2]" 1
849 1 64 VAL QG 1 65 ASN H . . 3.340 2.640 2.102 3.302 . 0 0 "[ . 1 . 2]" 1
850 1 64 VAL QG 1 65 ASN HA . . 4.280 3.561 3.031 4.219 . 0 0 "[ . 1 . 2]" 1
851 1 64 VAL QG 1 81 PHE HA . . 5.500 3.394 2.843 3.817 . 0 0 "[ . 1 . 2]" 1
852 1 64 VAL QG 1 81 PHE HB3 . . 4.980 2.371 2.043 2.896 . 0 0 "[ . 1 . 2]" 1
853 1 64 VAL QG 1 82 ASP H . . 4.050 3.251 2.198 4.001 . 0 0 "[ . 1 . 2]" 1
854 1 64 VAL QG 1 83 ASP H . . 4.050 2.947 2.308 3.654 . 0 0 "[ . 1 . 2]" 1
855 1 64 VAL QG 1 83 ASP HB3 . . 4.840 3.147 2.025 4.787 . 0 0 "[ . 1 . 2]" 1
856 1 64 VAL QG 1 84 GLY H . . 5.500 4.652 2.274 5.420 . 0 0 "[ . 1 . 2]" 1
857 1 65 ASN H 1 65 ASN HB3 . . 3.870 3.682 3.287 3.902 0.032 7 0 "[ . 1 . 2]" 1
858 1 65 ASN H 1 65 ASN HD21 . . 5.500 4.503 3.660 5.194 . 0 0 "[ . 1 . 2]" 1
859 1 65 ASN H 1 65 ASN HD22 . . 5.500 5.341 4.738 5.594 0.094 11 0 "[ . 1 . 2]" 1
860 1 65 ASN H 1 66 ILE H . . 5.030 4.263 2.457 4.671 . 0 0 "[ . 1 . 2]" 1
861 1 65 ASN H 1 82 ASP H . . 4.190 3.265 2.811 4.149 . 0 0 "[ . 1 . 2]" 1
862 1 65 ASN H 1 83 ASP H . . 5.500 4.136 2.988 4.964 . 0 0 "[ . 1 . 2]" 1
863 1 65 ASN HA 1 65 ASN HD22 . . 5.500 3.581 3.200 4.058 . 0 0 "[ . 1 . 2]" 1
864 1 65 ASN HA 1 66 ILE H . . 3.260 2.370 2.018 2.899 . 0 0 "[ . 1 . 2]" 1
865 1 65 ASN HA 1 66 ILE HB . . 4.750 4.573 4.332 4.819 0.069 11 0 "[ . 1 . 2]" 1
866 1 65 ASN HA 1 66 ILE MD . . 5.500 5.065 4.093 5.512 0.012 6 0 "[ . 1 . 2]" 1
867 1 65 ASN HA 1 66 ILE HG13 . . 4.800 3.933 3.430 5.569 0.769 7 2 "[ - + 1 . 2]" 1
868 1 65 ASN HB3 1 65 ASN HD22 . . 4.060 3.810 3.512 4.170 0.110 13 0 "[ . 1 . 2]" 1
869 1 65 ASN HB3 1 66 ILE H . . 4.290 2.862 1.985 4.362 0.072 5 0 "[ . 1 . 2]" 1
870 1 66 ILE H 1 66 ILE HB . . 3.310 2.530 2.323 3.394 0.084 5 0 "[ . 1 . 2]" 1
871 1 66 ILE H 1 66 ILE MD . . 4.500 3.961 3.581 4.435 . 0 0 "[ . 1 . 2]" 1
872 1 66 ILE H 1 66 ILE HG13 . . 4.110 2.856 1.878 4.323 0.213 5 0 "[ . 1 . 2]" 1
873 1 66 ILE H 1 66 ILE MG . . 4.260 3.804 3.728 4.167 . 0 0 "[ . 1 . 2]" 1
874 1 66 ILE H 1 67 ASN H . . 4.740 4.423 4.134 4.600 . 0 0 "[ . 1 . 2]" 1
875 1 66 ILE H 1 81 PHE HA . . 5.020 4.902 3.441 5.109 0.089 15 0 "[ . 1 . 2]" 1
876 1 66 ILE H 1 82 ASP H . . 5.500 4.848 2.951 5.543 0.043 2 0 "[ . 1 . 2]" 1
877 1 66 ILE HA 1 66 ILE MG . . 3.690 2.558 2.327 2.669 . 0 0 "[ . 1 . 2]" 1
878 1 66 ILE HA 1 67 ASN H . . 3.310 2.140 2.006 2.293 . 0 0 "[ . 1 . 2]" 1
879 1 66 ILE HA 1 68 ALA H . . 4.160 3.896 3.328 4.146 . 0 0 "[ . 1 . 2]" 1
880 1 66 ILE HA 1 80 VAL HA . . 5.500 5.514 5.371 5.578 0.078 7 0 "[ . 1 . 2]" 1
881 1 66 ILE HA 1 81 PHE HA . . 3.590 2.562 2.346 3.067 . 0 0 "[ . 1 . 2]" 1
882 1 66 ILE HA 1 82 ASP H . . 4.190 3.402 2.691 4.174 . 0 0 "[ . 1 . 2]" 1
883 1 66 ILE HB 1 66 ILE MD . . 3.510 2.622 2.345 3.309 . 0 0 "[ . 1 . 2]" 1
884 1 66 ILE HB 1 67 ASN H . . 5.200 4.168 3.931 4.446 . 0 0 "[ . 1 . 2]" 1
885 1 66 ILE HB 1 68 ALA H . . 5.040 4.571 3.878 4.847 . 0 0 "[ . 1 . 2]" 1
886 1 66 ILE MD 1 67 ASN H . . 5.500 4.727 3.405 5.343 . 0 0 "[ . 1 . 2]" 1
887 1 66 ILE MD 1 68 ALA H . . 4.740 4.776 3.897 4.856 0.116 13 0 "[ . 1 . 2]" 1
888 1 66 ILE MD 1 79 LEU QD . . 3.990 2.336 1.825 2.936 . 0 0 "[ . 1 . 2]" 1
889 1 66 ILE MD 1 79 LEU HG . . 4.420 3.095 2.069 4.511 0.091 19 0 "[ . 1 . 2]" 1
890 1 66 ILE MD 1 81 PHE HA . . 5.180 4.677 2.598 5.258 0.078 8 0 "[ . 1 . 2]" 1
891 1 66 ILE MD 1 81 PHE HZ . . 5.500 4.184 2.889 5.105 . 0 0 "[ . 1 . 2]" 1
892 1 66 ILE HG13 1 67 ASN H . . 5.420 4.977 4.674 5.273 . 0 0 "[ . 1 . 2]" 1
893 1 66 ILE HG13 1 79 LEU QD . . 5.500 4.499 3.412 5.281 . 0 0 "[ . 1 . 2]" 1
894 1 66 ILE MG 1 67 ASN H . . 3.600 2.618 2.298 3.159 . 0 0 "[ . 1 . 2]" 1
895 1 66 ILE MG 1 67 ASN HA . . 4.470 3.976 3.649 4.289 . 0 0 "[ . 1 . 2]" 1
896 1 66 ILE MG 1 67 ASN HB3 . . 5.500 4.623 4.277 5.097 . 0 0 "[ . 1 . 2]" 1
897 1 66 ILE MG 1 68 ALA H . . 3.350 2.137 1.843 2.374 . 0 0 "[ . 1 . 2]" 1
898 1 66 ILE MG 1 68 ALA HA . . 5.190 3.345 2.995 3.946 . 0 0 "[ . 1 . 2]" 1
899 1 66 ILE MG 1 68 ALA MB . . 5.500 3.917 3.768 4.026 . 0 0 "[ . 1 . 2]" 1
900 1 66 ILE MG 1 69 ILE H . . 5.430 4.366 4.046 4.905 . 0 0 "[ . 1 . 2]" 1
901 1 66 ILE MG 1 79 LEU HA . . 4.650 3.299 2.738 3.798 . 0 0 "[ . 1 . 2]" 1
902 1 66 ILE MG 1 80 VAL H . . 3.990 2.836 2.519 3.190 . 0 0 "[ . 1 . 2]" 1
903 1 66 ILE MG 1 80 VAL HB . . 5.250 4.435 3.196 5.329 0.079 5 0 "[ . 1 . 2]" 1
904 1 66 ILE MG 1 80 VAL QG . . 5.500 3.381 2.724 4.113 . 0 0 "[ . 1 . 2]" 1
905 1 66 ILE MG 1 81 PHE H . . 5.500 5.112 4.327 5.520 0.020 5 0 "[ . 1 . 2]" 1
906 1 66 ILE MG 1 81 PHE HA . . 4.440 4.126 3.520 4.524 0.084 15 0 "[ . 1 . 2]" 1
907 1 67 ASN H 1 67 ASN HB3 . . 3.950 3.298 2.868 3.626 . 0 0 "[ . 1 . 2]" 1
908 1 67 ASN H 1 67 ASN HD21 . . 5.070 3.820 2.543 4.694 . 0 0 "[ . 1 . 2]" 1
909 1 67 ASN H 1 67 ASN HD22 . . 5.360 4.962 4.018 5.453 0.093 16 0 "[ . 1 . 2]" 1
910 1 67 ASN H 1 68 ALA H . . 3.140 2.399 2.156 2.646 . 0 0 "[ . 1 . 2]" 1
911 1 67 ASN H 1 68 ALA MB . . 4.400 4.458 4.290 4.507 0.107 13 0 "[ . 1 . 2]" 1
912 1 67 ASN H 1 80 VAL H . . 5.110 4.160 3.832 4.910 . 0 0 "[ . 1 . 2]" 1
913 1 67 ASN H 1 80 VAL HB . . 4.880 3.977 2.769 4.974 0.094 5 0 "[ . 1 . 2]" 1
914 1 67 ASN H 1 80 VAL QG . . 4.360 2.870 2.057 3.810 . 0 0 "[ . 1 . 2]" 1
915 1 67 ASN H 1 81 PHE HA . . 3.870 3.370 2.573 3.927 0.057 15 0 "[ . 1 . 2]" 1
916 1 67 ASN HA 1 67 ASN HD22 . . 5.210 4.103 3.468 4.458 . 0 0 "[ . 1 . 2]" 1
917 1 67 ASN HA 1 80 VAL QG . . 5.340 4.245 3.805 4.992 . 0 0 "[ . 1 . 2]" 1
918 1 67 ASN HB3 1 68 ALA H . . 4.030 3.256 2.774 3.901 . 0 0 "[ . 1 . 2]" 1
919 1 67 ASN HB3 1 68 ALA MB . . 4.310 3.079 2.655 3.810 . 0 0 "[ . 1 . 2]" 1
920 1 67 ASN HB3 1 80 VAL HB . . 5.300 3.907 2.603 4.608 . 0 0 "[ . 1 . 2]" 1
921 1 67 ASN HB3 1 80 VAL QG . . 4.350 2.581 1.974 3.497 . 0 0 "[ . 1 . 2]" 1
922 1 67 ASN HD21 1 80 VAL QG . . 4.520 3.396 2.330 4.240 . 0 0 "[ . 1 . 2]" 1
923 1 67 ASN HD21 1 82 ASP HA . . 4.120 2.701 2.106 3.613 . 0 0 "[ . 1 . 2]" 1
924 1 67 ASN HD21 1 82 ASP HB3 . . 5.010 4.224 2.271 5.086 0.076 7 0 "[ . 1 . 2]" 1
925 1 67 ASN HD22 1 80 VAL QG . . 5.030 4.522 3.820 5.036 0.006 17 0 "[ . 1 . 2]" 1
926 1 67 ASN HD22 1 82 ASP H . . 5.500 4.963 3.758 5.578 0.078 2 0 "[ . 1 . 2]" 1
927 1 67 ASN HD22 1 82 ASP HA . . 3.950 3.110 2.122 4.033 0.083 2 0 "[ . 1 . 2]" 1
928 1 67 ASN HD22 1 82 ASP HB3 . . 4.770 4.260 3.265 4.857 0.087 5 0 "[ . 1 . 2]" 1
929 1 68 ALA H 1 68 ALA MB . . 3.380 2.789 2.617 2.926 . 0 0 "[ . 1 . 2]" 1
930 1 68 ALA H 1 69 ILE H . . 4.280 4.307 4.174 4.337 0.057 2 0 "[ . 1 . 2]" 1
931 1 68 ALA H 1 69 ILE HA . . 5.440 4.742 4.594 4.909 . 0 0 "[ . 1 . 2]" 1
932 1 68 ALA H 1 69 ILE MD . . 5.500 5.255 4.313 5.602 0.102 4 0 "[ . 1 . 2]" 1
933 1 68 ALA H 1 80 VAL H . . 3.860 3.183 2.867 3.633 . 0 0 "[ . 1 . 2]" 1
934 1 68 ALA H 1 80 VAL QG . . 4.130 2.584 1.779 3.529 . 0 0 "[ . 1 . 2]" 1
935 1 68 ALA H 1 81 PHE HA . . 5.470 5.321 4.835 5.556 0.086 15 0 "[ . 1 . 2]" 1
936 1 68 ALA HA 1 69 ILE H . . 2.780 2.467 2.262 2.611 . 0 0 "[ . 1 . 2]" 1
937 1 68 ALA HA 1 69 ILE HB . . 4.580 4.493 4.257 4.644 0.064 1 0 "[ . 1 . 2]" 1
938 1 68 ALA MB 1 69 ILE H . . 3.070 2.234 2.073 2.514 . 0 0 "[ . 1 . 2]" 1
939 1 68 ALA MB 1 69 ILE HB . . 5.120 4.549 4.218 4.769 . 0 0 "[ . 1 . 2]" 1
940 1 68 ALA MB 1 70 THR H . . 5.180 4.851 4.408 5.207 0.027 11 0 "[ . 1 . 2]" 1
941 1 68 ALA MB 1 80 VAL H . . 4.800 3.989 3.455 4.362 . 0 0 "[ . 1 . 2]" 1
942 1 68 ALA MB 1 80 VAL QG . . 3.440 2.230 1.963 2.693 . 0 0 "[ . 1 . 2]" 1
943 1 69 ILE H 1 69 ILE HB . . 3.330 2.632 2.361 2.775 . 0 0 "[ . 1 . 2]" 1
944 1 69 ILE H 1 69 ILE MD . . 4.240 3.729 2.480 4.324 0.084 20 0 "[ . 1 . 2]" 1
945 1 69 ILE H 1 69 ILE HG13 . . 4.510 3.239 2.983 3.620 . 0 0 "[ . 1 . 2]" 1
946 1 69 ILE H 1 69 ILE MG . . 4.140 3.854 3.747 3.957 . 0 0 "[ . 1 . 2]" 1
947 1 69 ILE H 1 70 THR H . . 4.610 4.255 4.142 4.376 . 0 0 "[ . 1 . 2]" 1
948 1 69 ILE HA 1 69 ILE MD . . 3.950 3.836 3.556 3.982 0.032 1 0 "[ . 1 . 2]" 1
949 1 69 ILE HA 1 69 ILE HG13 . . 4.070 2.887 2.410 3.269 . 0 0 "[ . 1 . 2]" 1
950 1 69 ILE HA 1 69 ILE MG . . 3.340 2.523 2.378 2.706 . 0 0 "[ . 1 . 2]" 1
951 1 69 ILE HA 1 70 THR H . . 3.010 2.246 2.151 2.410 . 0 0 "[ . 1 . 2]" 1
952 1 69 ILE HA 1 78 LYS H . . 4.980 4.517 4.146 5.041 0.061 19 0 "[ . 1 . 2]" 1
953 1 69 ILE HA 1 78 LYS HB3 . . 5.430 4.554 3.987 5.097 . 0 0 "[ . 1 . 2]" 1
954 1 69 ILE HA 1 79 LEU QD . . 3.720 2.907 2.532 3.463 . 0 0 "[ . 1 . 2]" 1
955 1 69 ILE HA 1 80 VAL QG . . 5.370 3.756 3.246 4.491 . 0 0 "[ . 1 . 2]" 1
956 1 69 ILE HB 1 69 ILE MD . . 3.210 2.373 2.229 2.546 . 0 0 "[ . 1 . 2]" 1
957 1 69 ILE HB 1 70 THR H . . 4.490 4.128 3.898 4.280 . 0 0 "[ . 1 . 2]" 1
958 1 69 ILE HB 1 70 THR HA . . 4.640 4.673 4.489 4.728 0.088 2 0 "[ . 1 . 2]" 1
959 1 69 ILE MD 1 79 LEU HA . . 5.240 4.935 4.229 5.349 0.109 17 0 "[ . 1 . 2]" 1
960 1 69 ILE MD 1 79 LEU QD . . 5.500 3.271 2.513 4.178 . 0 0 "[ . 1 . 2]" 1
961 1 69 ILE HG13 1 70 THR H . . 5.350 4.953 4.516 5.321 . 0 0 "[ . 1 . 2]" 1
962 1 69 ILE HG13 1 79 LEU HA . . 5.180 4.232 3.236 4.812 . 0 0 "[ . 1 . 2]" 1
963 1 69 ILE MG 1 70 THR H . . 3.650 2.651 2.331 2.940 . 0 0 "[ . 1 . 2]" 1
964 1 69 ILE MG 1 71 PRO HD3 . . 5.500 3.085 2.124 3.821 . 0 0 "[ . 1 . 2]" 1
965 1 69 ILE MG 1 77 VAL HB . . 3.390 2.661 2.050 3.532 0.142 11 0 "[ . 1 . 2]" 1
966 1 69 ILE MG 1 77 VAL QG . . 3.300 2.041 1.689 2.643 . 0 0 "[ . 1 . 2]" 1
967 1 69 ILE MG 1 78 LYS H . . 4.260 3.915 3.332 4.276 0.016 20 0 "[ . 1 . 2]" 1
968 1 69 ILE MG 1 79 LEU HA . . 5.400 4.079 3.686 4.753 . 0 0 "[ . 1 . 2]" 1
969 1 69 ILE MG 1 79 LEU QD . . 5.330 2.472 1.968 3.325 . 0 0 "[ . 1 . 2]" 1
970 1 70 THR H 1 70 THR HB . . 3.340 2.803 2.551 3.209 . 0 0 "[ . 1 . 2]" 1
971 1 70 THR H 1 70 THR MG . . 3.980 3.924 3.815 4.045 0.065 8 0 "[ . 1 . 2]" 1
972 1 70 THR H 1 71 PRO HD3 . . 5.400 4.207 3.717 4.724 . 0 0 "[ . 1 . 2]" 1
973 1 70 THR H 1 72 VAL QG . . 5.370 4.778 4.450 5.133 . 0 0 "[ . 1 . 2]" 1
974 1 70 THR H 1 77 VAL HB . . 4.540 3.861 3.237 4.638 0.098 7 0 "[ . 1 . 2]" 1
975 1 70 THR H 1 77 VAL QG . . 4.850 3.112 1.778 4.072 . 0 0 "[ . 1 . 2]" 1
976 1 70 THR H 1 78 LYS H . . 4.030 2.743 2.286 3.167 . 0 0 "[ . 1 . 2]" 1
977 1 70 THR H 1 78 LYS HB3 . . 4.930 3.370 2.655 4.364 . 0 0 "[ . 1 . 2]" 1
978 1 70 THR H 1 79 LEU QD . . 4.460 3.806 3.307 4.263 . 0 0 "[ . 1 . 2]" 1
979 1 70 THR H 1 80 VAL H . . 5.130 5.027 4.566 5.201 0.071 6 0 "[ . 1 . 2]" 1
980 1 70 THR H 1 80 VAL QG . . 4.600 4.267 3.691 4.638 0.038 5 0 "[ . 1 . 2]" 1
981 1 70 THR HA 1 70 THR MG . . 3.180 2.451 2.239 2.658 . 0 0 "[ . 1 . 2]" 1
982 1 70 THR HA 1 71 PRO HD3 . . 3.360 2.440 2.337 2.759 . 0 0 "[ . 1 . 2]" 1
983 1 70 THR HA 1 71 PRO HG3 . . 4.250 4.397 4.389 4.409 0.159 14 0 "[ . 1 . 2]" 1
984 1 70 THR HB 1 72 VAL QG . . 5.270 3.787 3.134 4.554 . 0 0 "[ . 1 . 2]" 1
985 1 70 THR HB 1 78 LYS H . . 4.280 3.445 3.021 3.966 . 0 0 "[ . 1 . 2]" 1
986 1 70 THR HB 1 78 LYS HB3 . . 3.750 2.643 2.106 3.415 . 0 0 "[ . 1 . 2]" 1
987 1 70 THR HB 1 78 LYS HE3 . . 4.700 3.878 2.217 4.786 0.086 10 0 "[ . 1 . 2]" 1
988 1 70 THR HB 1 78 LYS HG3 . . 5.470 4.692 4.127 5.500 0.030 5 0 "[ . 1 . 2]" 1
989 1 70 THR HB 1 80 VAL QG . . 4.980 4.198 3.461 4.830 . 0 0 "[ . 1 . 2]" 1
990 1 70 THR MG 1 71 PRO HD3 . . 4.470 3.957 3.678 4.507 0.037 14 0 "[ . 1 . 2]" 1
991 1 70 THR MG 1 71 PRO HG3 . . 5.500 4.935 4.287 5.386 . 0 0 "[ . 1 . 2]" 1
992 1 70 THR MG 1 72 VAL HA . . 5.500 4.350 3.683 4.787 . 0 0 "[ . 1 . 2]" 1
993 1 70 THR MG 1 72 VAL QG . . 3.690 2.989 2.378 3.749 0.059 6 0 "[ . 1 . 2]" 1
994 1 70 THR MG 1 78 LYS H . . 4.520 4.191 3.805 4.452 . 0 0 "[ . 1 . 2]" 1
995 1 70 THR MG 1 78 LYS HB3 . . 3.530 4.019 3.536 4.756 1.226 1 7 "[+ . -*** . **]" 1
996 1 71 PRO HA 1 72 VAL H . . 3.020 2.169 2.031 2.258 . 0 0 "[ . 1 . 2]" 1
997 1 71 PRO HA 1 72 VAL HA . . 5.440 4.465 4.381 4.520 . 0 0 "[ . 1 . 2]" 1
998 1 71 PRO HA 1 72 VAL HB . . 4.760 4.551 4.205 4.771 0.011 6 0 "[ . 1 . 2]" 1
999 1 71 PRO HA 1 72 VAL QG . . 4.440 3.509 3.161 3.773 . 0 0 "[ . 1 . 2]" 1
1000 1 71 PRO HA 1 76 ALA H . . 5.500 4.397 4.034 4.964 . 0 0 "[ . 1 . 2]" 1
1001 1 71 PRO HA 1 76 ALA HA . . 5.450 5.378 5.090 5.540 0.090 6 0 "[ . 1 . 2]" 1
1002 1 71 PRO HA 1 76 ALA MB . . 4.660 4.754 4.647 4.775 0.115 14 0 "[ . 1 . 2]" 1
1003 1 71 PRO HA 1 77 VAL HA . . 3.570 2.202 2.001 2.343 . 0 0 "[ . 1 . 2]" 1
1004 1 71 PRO HA 1 77 VAL HB . . 5.060 3.874 3.323 4.408 . 0 0 "[ . 1 . 2]" 1
1005 1 71 PRO HA 1 77 VAL QG . . 3.320 2.130 2.019 2.276 . 0 0 "[ . 1 . 2]" 1
1006 1 71 PRO HA 1 78 LYS H . . 4.550 3.640 3.408 3.974 . 0 0 "[ . 1 . 2]" 1
1007 1 71 PRO HG3 1 72 VAL H . . 5.180 5.555 5.243 5.843 0.663 8 5 "[ *. +-1 *. *]" 1
1008 1 71 PRO HG3 1 77 VAL QG . . 5.280 4.260 3.583 4.804 . 0 0 "[ . 1 . 2]" 1
1009 1 72 VAL H 1 72 VAL HB . . 3.600 2.711 2.467 2.899 . 0 0 "[ . 1 . 2]" 1
1010 1 72 VAL H 1 72 VAL QG . . 3.460 2.698 2.021 3.104 . 0 0 "[ . 1 . 2]" 1
1011 1 72 VAL H 1 72 VAL MG2 . . 3.750 2.763 2.029 3.250 . 0 0 "[ . 1 . 2]" 1
1012 1 72 VAL H 1 73 GLY H . . 4.540 4.206 3.793 4.497 . 0 0 "[ . 1 . 2]" 1
1013 1 72 VAL H 1 76 ALA H . . 4.300 3.230 2.743 4.216 . 0 0 "[ . 1 . 2]" 1
1014 1 72 VAL H 1 76 ALA MB . . 4.420 3.514 3.281 3.709 . 0 0 "[ . 1 . 2]" 1
1015 1 72 VAL H 1 77 VAL HA . . 3.760 2.878 2.342 3.300 . 0 0 "[ . 1 . 2]" 1
1016 1 72 VAL H 1 77 VAL QG . . 3.930 3.588 3.360 3.899 . 0 0 "[ . 1 . 2]" 1
1017 1 72 VAL H 1 78 LYS H . . 4.680 4.345 3.488 4.752 0.072 11 0 "[ . 1 . 2]" 1
1018 1 72 VAL H 1 89 LEU QD . . 5.500 4.011 3.516 4.697 . 0 0 "[ . 1 . 2]" 1
1019 1 72 VAL HA 1 72 VAL QG . . 2.950 2.132 2.081 2.187 . 0 0 "[ . 1 . 2]" 1
1020 1 72 VAL HA 1 73 GLY H . . 2.760 2.201 2.095 2.827 0.067 6 0 "[ . 1 . 2]" 1
1021 1 72 VAL HA 1 73 GLY HA2 . . 4.330 4.370 4.302 4.407 0.077 12 0 "[ . 1 . 2]" 1
1022 1 72 VAL HA 1 89 LEU QD . . 4.820 4.513 4.223 4.809 . 0 0 "[ . 1 . 2]" 1
1023 1 72 VAL HB 1 73 GLY H . . 4.630 4.192 2.620 4.529 . 0 0 "[ . 1 . 2]" 1
1024 1 72 VAL HB 1 75 TYR QE . . 4.500 4.302 2.961 4.575 0.075 3 0 "[ . 1 . 2]" 1
1025 1 72 VAL HB 1 76 ALA H . . 5.010 4.209 3.526 5.028 0.018 5 0 "[ . 1 . 2]" 1
1026 1 72 VAL HB 1 76 ALA MB . . 3.180 2.661 2.053 3.241 0.061 7 0 "[ . 1 . 2]" 1
1027 1 72 VAL HB 1 77 VAL H . . 5.100 4.853 4.279 5.165 0.065 9 0 "[ . 1 . 2]" 1
1028 1 72 VAL HB 1 77 VAL HA . . 4.940 4.159 3.644 4.469 . 0 0 "[ . 1 . 2]" 1
1029 1 72 VAL HB 1 89 LEU QD . . 3.480 2.361 2.020 2.837 . 0 0 "[ . 1 . 2]" 1
1030 1 72 VAL QG 1 73 GLY H . . 3.580 2.796 1.700 3.296 . 0 0 "[ . 1 . 2]" 1
1031 1 72 VAL QG 1 73 GLY HA2 . . 5.100 4.049 3.552 4.595 . 0 0 "[ . 1 . 2]" 1
1032 1 72 VAL QG 1 73 GLY HA3 . . 5.500 3.504 3.111 4.005 . 0 0 "[ . 1 . 2]" 1
1033 1 72 VAL QG 1 75 TYR H . . 5.390 4.787 4.377 5.126 . 0 0 "[ . 1 . 2]" 1
1034 1 72 VAL QG 1 75 TYR QD . . 5.040 4.295 3.595 4.917 . 0 0 "[ . 1 . 2]" 1
1035 1 72 VAL QG 1 75 TYR QE . . 3.870 3.175 2.452 3.968 0.098 11 0 "[ . 1 . 2]" 1
1036 1 72 VAL QG 1 77 VAL H . . 4.920 4.493 3.441 5.018 0.098 17 0 "[ . 1 . 2]" 1
1037 1 72 VAL QG 1 77 VAL HA . . 3.830 3.067 2.348 3.636 . 0 0 "[ . 1 . 2]" 1
1038 1 72 VAL QG 1 78 LYS H . . 3.750 2.992 2.422 3.799 0.049 17 0 "[ . 1 . 2]" 1
1039 1 72 VAL QG 1 78 LYS HA . . 4.690 4.121 3.461 4.690 0.000 18 0 "[ . 1 . 2]" 1
1040 1 72 VAL QG 1 78 LYS HB3 . . 3.470 4.114 3.452 4.409 0.939 8 15 "[** *-**+*** .*****]" 1
1041 1 72 VAL QG 1 78 LYS HE3 . . 4.290 2.921 2.121 3.550 . 0 0 "[ . 1 . 2]" 1
1042 1 72 VAL MG1 1 73 GLY H . . 3.710 2.854 1.702 3.425 . 0 0 "[ . 1 . 2]" 1
1043 1 72 VAL MG1 1 75 TYR H . . 5.300 5.043 4.550 5.380 0.080 16 0 "[ . 1 . 2]" 1
1044 1 73 GLY H 1 75 TYR H . . 5.390 4.754 4.372 5.232 . 0 0 "[ . 1 . 2]" 1
1045 1 73 GLY H 1 75 TYR QE . . 5.470 4.524 2.318 5.042 . 0 0 "[ . 1 . 2]" 1
1046 1 73 GLY HA2 1 74 ASN HA . . 5.310 4.963 4.434 5.241 . 0 0 "[ . 1 . 2]" 1
1047 1 73 GLY HA2 1 75 TYR H . . 4.660 4.397 4.056 4.748 0.088 4 0 "[ . 1 . 2]" 1
1048 1 73 GLY HA2 1 75 TYR QD . . 4.570 4.479 3.928 4.672 0.102 7 0 "[ . 1 . 2]" 1
1049 1 73 GLY HA2 1 75 TYR QE . . 4.120 4.024 3.718 4.213 0.093 6 0 "[ . 1 . 2]" 1
1050 1 73 GLY HA3 1 75 TYR H . . 4.260 3.329 2.860 3.628 . 0 0 "[ . 1 . 2]" 1
1051 1 73 GLY HA3 1 75 TYR QD . . 3.800 3.069 2.400 3.531 . 0 0 "[ . 1 . 2]" 1
1052 1 73 GLY HA3 1 75 TYR QE . . 3.800 2.611 2.242 2.970 . 0 0 "[ . 1 . 2]" 1
1053 1 73 GLY HA3 1 76 ALA H . . 5.500 4.892 4.239 5.272 . 0 0 "[ . 1 . 2]" 1
1054 1 74 ASN H 1 74 ASN HD21 . . 5.500 4.077 2.884 5.189 . 0 0 "[ . 1 . 2]" 1
1055 1 74 ASN H 1 74 ASN HD22 . . 5.360 4.756 3.988 5.444 0.084 3 0 "[ . 1 . 2]" 1
1056 1 74 ASN H 1 75 TYR H . . 3.460 2.549 1.545 3.263 . 0 0 "[ . 1 . 2]" 1
1057 1 74 ASN H 1 76 ALA H . . 4.680 3.924 3.152 4.427 . 0 0 "[ . 1 . 2]" 1
1058 1 74 ASN H 1 76 ALA MB . . 5.500 5.253 4.642 5.582 0.082 16 0 "[ . 1 . 2]" 1
1059 1 74 ASN HA 1 74 ASN HD21 . . 4.820 3.167 1.992 4.628 . 0 0 "[ . 1 . 2]" 1
1060 1 74 ASN HA 1 74 ASN HD22 . . 5.500 4.177 3.226 5.439 . 0 0 "[ . 1 . 2]" 1
1061 1 74 ASN HA 1 76 ALA H . . 5.050 4.136 3.596 4.478 . 0 0 "[ . 1 . 2]" 1
1062 1 75 TYR H 1 75 TYR HB3 . . 3.790 3.109 2.479 3.354 . 0 0 "[ . 1 . 2]" 1
1063 1 75 TYR H 1 75 TYR QD . . 3.020 2.401 1.819 3.087 0.067 12 0 "[ . 1 . 2]" 1
1064 1 75 TYR H 1 76 ALA H . . 2.910 2.283 2.030 2.754 . 0 0 "[ . 1 . 2]" 1
1065 1 75 TYR H 1 76 ALA HA . . 5.370 4.952 4.701 5.329 . 0 0 "[ . 1 . 2]" 1
1066 1 75 TYR H 1 76 ALA MB . . 4.730 3.900 3.451 4.305 . 0 0 "[ . 1 . 2]" 1
1067 1 75 TYR H 1 92 TRP HE1 . . 5.500 4.595 3.768 5.226 . 0 0 "[ . 1 . 2]" 1
1068 1 75 TYR HA 1 75 TYR QD . . 4.360 3.738 3.644 3.771 . 0 0 "[ . 1 . 2]" 1
1069 1 75 TYR HA 1 92 TRP HD1 . . 4.350 3.563 2.777 4.416 0.066 12 0 "[ . 1 . 2]" 1
1070 1 75 TYR HA 1 92 TRP HE1 . . 3.530 2.107 1.899 2.384 . 0 0 "[ . 1 . 2]" 1
1071 1 75 TYR HA 1 92 TRP HZ2 . . 4.010 3.610 2.805 4.104 0.094 20 0 "[ . 1 . 2]" 1
1072 1 75 TYR HB3 1 76 ALA H . . 4.830 4.560 4.418 4.671 . 0 0 "[ . 1 . 2]" 1
1073 1 75 TYR HB3 1 76 ALA MB . . 5.250 5.046 4.874 5.293 0.043 11 0 "[ . 1 . 2]" 1
1074 1 75 TYR HB3 1 92 TRP HE1 . . 4.820 4.141 3.393 4.545 . 0 0 "[ . 1 . 2]" 1
1075 1 75 TYR QD 1 76 ALA H . . 5.080 3.256 2.546 4.123 . 0 0 "[ . 1 . 2]" 1
1076 1 75 TYR QD 1 76 ALA MB . . 3.870 2.746 2.042 3.824 . 0 0 "[ . 1 . 2]" 1
1077 1 75 TYR QD 1 92 TRP HE1 . . 5.330 5.336 5.046 5.419 0.089 5 0 "[ . 1 . 2]" 1
1078 1 76 ALA H 1 76 ALA MB . . 3.490 2.698 2.493 2.799 . 0 0 "[ . 1 . 2]" 1
1079 1 76 ALA H 1 77 VAL H . . 4.850 4.329 4.172 4.425 . 0 0 "[ . 1 . 2]" 1
1080 1 76 ALA H 1 91 SER HA . . 5.420 5.000 4.522 5.504 0.084 12 0 "[ . 1 . 2]" 1
1081 1 76 ALA H 1 92 TRP HE1 . . 5.500 4.472 4.047 5.013 . 0 0 "[ . 1 . 2]" 1
1082 1 76 ALA H 1 92 TRP HZ2 . . 5.500 3.489 3.076 3.784 . 0 0 "[ . 1 . 2]" 1
1083 1 76 ALA HA 1 77 VAL H . . 3.210 2.445 2.126 2.747 . 0 0 "[ . 1 . 2]" 1
1084 1 76 ALA HA 1 77 VAL QG . . 4.720 3.457 2.763 4.155 . 0 0 "[ . 1 . 2]" 1
1085 1 76 ALA HA 1 91 SER HA . . 3.490 2.604 2.160 2.987 . 0 0 "[ . 1 . 2]" 1
1086 1 76 ALA HA 1 92 TRP HE3 . . 4.390 3.905 3.181 4.428 0.038 20 0 "[ . 1 . 2]" 1
1087 1 76 ALA MB 1 77 VAL H . . 3.200 2.272 2.083 2.410 . 0 0 "[ . 1 . 2]" 1
1088 1 76 ALA MB 1 78 LYS H . . 5.500 4.958 4.755 5.202 . 0 0 "[ . 1 . 2]" 1
1089 1 76 ALA MB 1 89 LEU HB3 . . 4.450 3.660 2.094 4.562 0.112 11 0 "[ . 1 . 2]" 1
1090 1 76 ALA MB 1 90 TYR H . . 4.330 3.097 2.630 3.659 . 0 0 "[ . 1 . 2]" 1
1091 1 76 ALA MB 1 91 SER H . . 4.780 4.020 3.517 4.752 . 0 0 "[ . 1 . 2]" 1
1092 1 76 ALA MB 1 91 SER HB3 . . 4.940 3.840 2.841 4.966 0.026 16 0 "[ . 1 . 2]" 1
1093 1 76 ALA MB 1 92 TRP H . . 4.600 4.084 3.686 4.628 0.028 16 0 "[ . 1 . 2]" 1
1094 1 76 ALA MB 1 92 TRP HE1 . . 5.500 5.584 5.496 5.615 0.115 14 0 "[ . 1 . 2]" 1
1095 1 77 VAL H 1 77 VAL QG . . 3.360 2.485 2.090 3.036 . 0 0 "[ . 1 . 2]" 1
1096 1 77 VAL H 1 78 LYS H . . 4.960 4.229 4.018 4.400 . 0 0 "[ . 1 . 2]" 1
1097 1 77 VAL H 1 79 LEU QD . . 5.500 4.597 3.852 5.248 . 0 0 "[ . 1 . 2]" 1
1098 1 77 VAL H 1 90 TYR H . . 4.050 2.974 2.562 4.159 0.109 19 0 "[ . 1 . 2]" 1
1099 1 77 VAL H 1 92 TRP HZ3 . . 4.580 4.076 3.342 4.632 0.052 14 0 "[ . 1 . 2]" 1
1100 1 77 VAL HA 1 78 LYS H . . 3.310 2.110 1.920 2.444 . 0 0 "[ . 1 . 2]" 1
1101 1 77 VAL HB 1 78 LYS H . . 3.770 3.181 2.092 3.867 0.097 20 0 "[ . 1 . 2]" 1
1102 1 77 VAL HB 1 79 LEU QD . . 4.860 3.025 2.215 4.240 . 0 0 "[ . 1 . 2]" 1
1103 1 77 VAL HB 1 92 TRP HZ3 . . 5.500 4.026 2.444 5.040 . 0 0 "[ . 1 . 2]" 1
1104 1 77 VAL QG 1 78 LYS H . . 3.970 2.919 2.113 3.548 . 0 0 "[ . 1 . 2]" 1
1105 1 77 VAL QG 1 78 LYS HA . . 4.880 4.005 3.425 4.482 . 0 0 "[ . 1 . 2]" 1
1106 1 77 VAL QG 1 79 LEU QD . . 3.330 2.054 1.744 2.845 . 0 0 "[ . 1 . 2]" 1
1107 1 77 VAL QG 1 79 LEU HG . . 4.040 3.527 2.143 4.075 0.035 10 0 "[ . 1 . 2]" 1
1108 1 77 VAL QG 1 90 TYR H . . 4.480 3.736 3.209 4.518 0.038 19 0 "[ . 1 . 2]" 1
1109 1 77 VAL QG 1 90 TYR HB3 . . 4.180 3.795 2.893 4.207 0.027 12 0 "[ . 1 . 2]" 1
1110 1 77 VAL QG 1 90 TYR QD . . 4.700 3.564 2.790 4.375 . 0 0 "[ . 1 . 2]" 1
1111 1 77 VAL QG 1 92 TRP HE3 . . 5.500 3.803 3.455 4.479 . 0 0 "[ . 1 . 2]" 1
1112 1 77 VAL QG 1 92 TRP HH2 . . 3.180 2.106 1.974 2.451 . 0 0 "[ . 1 . 2]" 1
1113 1 77 VAL QG 1 92 TRP HZ2 . . 3.980 3.904 3.711 3.990 0.010 20 0 "[ . 1 . 2]" 1
1114 1 77 VAL QG 1 92 TRP HZ3 . . 3.120 2.238 2.072 2.689 . 0 0 "[ . 1 . 2]" 1
1115 1 78 LYS H 1 78 LYS HB3 . . 3.910 3.078 2.611 3.506 . 0 0 "[ . 1 . 2]" 1
1116 1 78 LYS H 1 78 LYS HG3 . . 4.640 3.911 2.849 4.452 . 0 0 "[ . 1 . 2]" 1
1117 1 78 LYS H 1 89 LEU HA . . 4.910 4.681 3.929 4.995 0.085 18 0 "[ . 1 . 2]" 1
1118 1 78 LYS H 1 89 LEU QD . . 4.810 3.571 2.929 4.325 . 0 0 "[ . 1 . 2]" 1
1119 1 78 LYS HA 1 79 LEU QD . . 5.500 4.088 3.518 4.795 . 0 0 "[ . 1 . 2]" 1
1120 1 78 LYS HA 1 89 LEU HA . . 4.040 2.726 2.299 3.107 . 0 0 "[ . 1 . 2]" 1
1121 1 78 LYS HA 1 89 LEU QD . . 4.590 2.799 2.032 3.456 . 0 0 "[ . 1 . 2]" 1
1122 1 78 LYS HE3 1 78 LYS HG3 . . 4.100 3.487 2.558 3.771 . 0 0 "[ . 1 . 2]" 1
1123 1 78 LYS HE3 1 89 LEU QD . . 4.250 3.792 3.275 4.202 . 0 0 "[ . 1 . 2]" 1
1124 1 78 LYS HG3 1 89 LEU QD . . 4.200 2.195 1.946 2.653 . 0 0 "[ . 1 . 2]" 1
1125 1 79 LEU HA 1 79 LEU QD . . 3.290 2.162 2.076 2.267 . 0 0 "[ . 1 . 2]" 1
1126 1 79 LEU HA 1 80 VAL H . . 3.250 2.197 2.026 2.310 . 0 0 "[ . 1 . 2]" 1
1127 1 79 LEU HA 1 80 VAL QG . . 4.320 3.510 3.165 3.969 . 0 0 "[ . 1 . 2]" 1
1128 1 79 LEU HB3 1 80 VAL H . . 4.900 3.699 2.755 4.447 . 0 0 "[ . 1 . 2]" 1
1129 1 79 LEU HB3 1 90 TYR QD . . 4.440 4.729 2.352 5.755 1.315 19 7 "[ -*.* 1* *.* +2]" 1
1130 1 79 LEU HB3 1 90 TYR QE . . 5.020 4.208 2.368 5.602 0.582 19 1 "[ . 1 . +2]" 1
1131 1 79 LEU QD 1 80 VAL H . . 3.960 3.871 3.539 3.969 0.009 1 0 "[ . 1 . 2]" 1
1132 1 79 LEU QD 1 90 TYR QD . . 4.290 2.842 2.262 3.499 . 0 0 "[ . 1 . 2]" 1
1133 1 79 LEU QD 1 90 TYR QE . . 3.930 3.174 2.287 3.877 . 0 0 "[ . 1 . 2]" 1
1134 1 80 VAL H 1 80 VAL HB . . 3.570 3.088 2.364 3.669 0.099 10 0 "[ . 1 . 2]" 1
1135 1 80 VAL H 1 80 VAL QG . . 3.360 2.151 1.944 2.609 . 0 0 "[ . 1 . 2]" 1
1136 1 80 VAL H 1 81 PHE H . . 5.240 4.478 3.892 4.746 . 0 0 "[ . 1 . 2]" 1
1137 1 80 VAL H 1 86 ASP HA . . 5.340 4.909 4.005 5.384 0.044 7 0 "[ . 1 . 2]" 1
1138 1 80 VAL HA 1 80 VAL QG . . 3.340 2.276 2.106 2.443 . 0 0 "[ . 1 . 2]" 1
1139 1 80 VAL HA 1 81 PHE H . . 3.420 2.264 2.045 2.534 . 0 0 "[ . 1 . 2]" 1
1140 1 80 VAL HA 1 86 ASP HA . . 3.790 2.395 1.929 2.935 . 0 0 "[ . 1 . 2]" 1
1141 1 80 VAL HA 1 86 ASP HB3 . . 4.790 3.916 2.497 4.768 . 0 0 "[ . 1 . 2]" 1
1142 1 80 VAL QG 1 81 PHE H . . 3.850 3.161 2.417 3.618 . 0 0 "[ . 1 . 2]" 1
1143 1 80 VAL QG 1 86 ASP H . . 5.500 4.311 3.228 4.902 . 0 0 "[ . 1 . 2]" 1
1144 1 80 VAL QG 1 86 ASP HA . . 3.980 2.806 2.154 3.643 . 0 0 "[ . 1 . 2]" 1
1145 1 80 VAL QG 1 86 ASP HB3 . . 3.690 2.778 2.247 3.442 . 0 0 "[ . 1 . 2]" 1
1146 1 81 PHE H 1 81 PHE HB3 . . 4.140 3.674 3.542 3.817 . 0 0 "[ . 1 . 2]" 1
1147 1 81 PHE H 1 82 ASP H . . 5.400 4.487 4.305 4.635 . 0 0 "[ . 1 . 2]" 1
1148 1 81 PHE H 1 83 ASP H . . 5.500 5.070 4.714 5.550 0.050 20 0 "[ . 1 . 2]" 1
1149 1 81 PHE H 1 84 GLY H . . 5.400 4.733 3.928 5.355 . 0 0 "[ . 1 . 2]" 1
1150 1 81 PHE H 1 85 HIS H . . 5.230 3.685 2.896 5.063 . 0 0 "[ . 1 . 2]" 1
1151 1 81 PHE H 1 86 ASP HA . . 4.170 2.916 1.987 3.830 . 0 0 "[ . 1 . 2]" 1
1152 1 81 PHE H 1 86 ASP HB3 . . 5.320 4.349 2.985 5.395 0.075 9 0 "[ . 1 . 2]" 1
1153 1 81 PHE HA 1 82 ASP H . . 3.200 2.193 2.017 2.373 . 0 0 "[ . 1 . 2]" 1
1154 1 81 PHE HA 1 82 ASP HA . . 4.580 4.394 4.211 4.481 . 0 0 "[ . 1 . 2]" 1
1155 1 81 PHE HA 1 83 ASP H . . 4.670 3.829 3.581 4.242 . 0 0 "[ . 1 . 2]" 1
1156 1 81 PHE HB3 1 82 ASP H . . 4.290 3.073 2.550 3.499 . 0 0 "[ . 1 . 2]" 1
1157 1 81 PHE HB3 1 83 ASP H . . 3.950 2.630 2.136 3.035 . 0 0 "[ . 1 . 2]" 1
1158 1 81 PHE HB3 1 85 HIS H . . 3.950 4.286 3.027 5.389 1.439 9 7 "[ * *- +1* * * 2]" 1
1159 1 82 ASP H 1 82 ASP HB3 . . 3.890 2.624 2.243 3.567 . 0 0 "[ . 1 . 2]" 1
1160 1 82 ASP H 1 83 ASP H . . 3.650 2.665 2.201 2.916 . 0 0 "[ . 1 . 2]" 1
1161 1 82 ASP H 1 84 GLY H . . 5.030 4.327 3.583 4.702 . 0 0 "[ . 1 . 2]" 1
1162 1 83 ASP H 1 85 HIS H . . 4.460 4.330 3.696 4.543 0.083 19 0 "[ . 1 . 2]" 1
1163 1 83 ASP HA 1 84 GLY HA2 . . 5.190 4.914 4.438 5.291 0.101 5 0 "[ . 1 . 2]" 1
1164 1 83 ASP HB3 1 84 GLY H . . 4.870 3.427 2.617 4.399 . 0 0 "[ . 1 . 2]" 1
1165 1 84 GLY H 1 85 HIS H . . 3.300 2.530 2.038 3.266 . 0 0 "[ . 1 . 2]" 1
1166 1 84 GLY H 1 85 HIS HA . . 5.160 4.916 4.052 5.238 0.078 17 0 "[ . 1 . 2]" 1
1167 1 85 HIS H 1 85 HIS HB3 . . 3.420 3.356 2.640 3.608 0.188 20 0 "[ . 1 . 2]" 1
1168 1 85 HIS H 1 86 ASP HA . . 5.500 4.583 3.975 5.392 . 0 0 "[ . 1 . 2]" 1
1169 1 85 HIS HA 1 86 ASP H . . 3.110 2.342 2.066 3.097 . 0 0 "[ . 1 . 2]" 1
1170 1 85 HIS HA 1 86 ASP HB3 . . 5.080 4.625 3.760 5.617 0.537 6 1 "[ .+ 1 . 2]" 1
1171 1 85 HIS HB3 1 86 ASP H . . 5.200 3.946 2.894 4.558 . 0 0 "[ . 1 . 2]" 1
1172 1 86 ASP H 1 86 ASP HB3 . . 4.200 2.884 2.257 3.688 . 0 0 "[ . 1 . 2]" 1
1173 1 86 ASP H 1 87 THR HA . . 5.370 5.028 4.363 5.460 0.090 2 0 "[ . 1 . 2]" 1
1174 1 86 ASP H 1 87 THR MG . . 4.540 3.831 3.098 4.643 0.103 11 0 "[ . 1 . 2]" 1
1175 1 86 ASP HA 1 87 THR MG . . 5.380 4.798 4.346 5.512 0.132 11 0 "[ . 1 . 2]" 1
1176 1 86 ASP HA 1 88 GLY H . . 5.190 4.921 3.414 5.275 0.085 5 0 "[ . 1 . 2]" 1
1177 1 87 THR HA 1 87 THR MG . . 3.380 2.352 2.120 3.293 . 0 0 "[ . 1 . 2]" 1
1178 1 87 THR HA 1 89 LEU QD . . 5.500 4.337 2.564 4.892 . 0 0 "[ . 1 . 2]" 1
1179 1 87 THR HB 1 88 GLY H . . 4.720 3.980 2.498 4.521 . 0 0 "[ . 1 . 2]" 1
1180 1 87 THR HB 1 88 GLY HA2 . . 5.370 4.728 4.301 5.458 0.088 14 0 "[ . 1 . 2]" 1
1181 1 87 THR MG 1 88 GLY H . . 5.050 4.005 2.132 4.521 . 0 0 "[ . 1 . 2]" 1
1182 1 88 GLY H 1 89 LEU H . . 4.310 3.664 2.172 4.396 0.086 2 0 "[ . 1 . 2]" 1
1183 1 88 GLY H 1 89 LEU QD . . 5.500 3.646 2.875 4.847 . 0 0 "[ . 1 . 2]" 1
1184 1 88 GLY H 1 90 TYR QE . . 5.020 4.576 3.960 5.072 0.052 20 0 "[ . 1 . 2]" 1
1185 1 88 GLY HA2 1 90 TYR QE . . 4.190 4.103 2.965 5.120 0.930 1 2 "[+ . - 1 . 2]" 1
1186 1 88 GLY HA3 1 89 LEU H . . 3.290 3.003 2.429 3.685 0.395 12 0 "[ . 1 . 2]" 1
1187 1 89 LEU H 1 89 LEU HB3 . . 3.630 3.539 3.197 3.731 0.101 3 0 "[ . 1 . 2]" 1
1188 1 89 LEU H 1 89 LEU QD . . 4.160 3.170 2.319 3.683 . 0 0 "[ . 1 . 2]" 1
1189 1 89 LEU H 1 90 TYR H . . 5.020 4.012 2.093 4.549 . 0 0 "[ . 1 . 2]" 1
1190 1 89 LEU H 1 90 TYR HA . . 5.390 5.007 3.967 5.391 0.001 2 0 "[ . 1 . 2]" 1
1191 1 89 LEU HA 1 89 LEU QD . . 3.390 2.055 1.915 2.818 . 0 0 "[ . 1 . 2]" 1
1192 1 89 LEU HA 1 89 LEU HG . . 4.190 3.607 2.360 3.799 . 0 0 "[ . 1 . 2]" 1
1193 1 89 LEU HA 1 90 TYR H . . 3.280 2.266 2.031 3.342 0.062 19 0 "[ . 1 . 2]" 1
1194 1 89 LEU HA 1 90 TYR QD . . 4.810 3.109 2.708 3.663 . 0 0 "[ . 1 . 2]" 1
1195 1 89 LEU HB3 1 89 LEU QD . . 3.090 2.323 2.057 2.590 . 0 0 "[ . 1 . 2]" 1
1196 1 89 LEU HB3 1 90 TYR H . . 4.770 3.347 2.350 4.037 . 0 0 "[ . 1 . 2]" 1
1197 1 89 LEU QD 1 90 TYR H . . 4.260 2.681 2.191 3.842 . 0 0 "[ . 1 . 2]" 1
1198 1 89 LEU HG 1 90 TYR H . . 4.690 4.649 3.616 4.780 0.090 12 0 "[ . 1 . 2]" 1
1199 1 90 TYR H 1 90 TYR QD . . 3.320 2.869 2.415 3.411 0.091 14 0 "[ . 1 . 2]" 1
1200 1 90 TYR H 1 91 SER H . . 5.080 4.064 2.728 4.540 . 0 0 "[ . 1 . 2]" 1
1201 1 90 TYR H 1 95 LEU QD . . 5.500 4.654 4.056 5.100 . 0 0 "[ . 1 . 2]" 1
1202 1 90 TYR HA 1 90 TYR QD . . 4.560 3.079 2.656 3.275 . 0 0 "[ . 1 . 2]" 1
1203 1 90 TYR HA 1 91 SER H . . 3.250 2.224 2.088 2.427 . 0 0 "[ . 1 . 2]" 1
1204 1 90 TYR HA 1 94 VAL MG1 . . 3.870 3.339 2.591 3.986 0.116 15 0 "[ . 1 . 2]" 1
1205 1 90 TYR HA 1 94 VAL MG2 . . 4.070 3.619 2.606 4.164 0.094 20 0 "[ . 1 . 2]" 1
1206 1 90 TYR HA 1 95 LEU QD . . 5.430 3.843 3.025 4.538 . 0 0 "[ . 1 . 2]" 1
1207 1 90 TYR HB3 1 91 SER H . . 5.110 3.592 2.434 4.154 . 0 0 "[ . 1 . 2]" 1
1208 1 90 TYR HB3 1 95 LEU QD . . 4.140 2.265 1.980 2.776 . 0 0 "[ . 1 . 2]" 1
1209 1 90 TYR HB3 1 95 LEU HG . . 4.590 2.874 2.146 3.605 . 0 0 "[ . 1 . 2]" 1
1210 1 90 TYR QD 1 91 SER H . . 5.500 4.530 3.878 4.924 . 0 0 "[ . 1 . 2]" 1
1211 1 90 TYR QD 1 94 VAL MG1 . . 3.370 2.919 2.241 3.488 0.118 9 0 "[ . 1 . 2]" 1
1212 1 90 TYR QD 1 94 VAL MG2 . . 5.390 4.746 3.898 5.347 . 0 0 "[ . 1 . 2]" 1
1213 1 90 TYR QD 1 95 LEU H . . 5.500 5.027 4.325 5.491 . 0 0 "[ . 1 . 2]" 1
1214 1 90 TYR QD 1 95 LEU HA . . 5.500 4.619 3.982 5.213 . 0 0 "[ . 1 . 2]" 1
1215 1 90 TYR QD 1 95 LEU QD . . 3.480 3.012 2.311 3.494 0.014 13 0 "[ . 1 . 2]" 1
1216 1 90 TYR QD 1 95 LEU HG . . 3.990 3.674 2.415 4.083 0.093 20 0 "[ . 1 . 2]" 1
1217 1 90 TYR QD 1 98 LEU MD1 . . 4.230 3.570 2.715 4.154 . 0 0 "[ . 1 . 2]" 1
1218 1 90 TYR QE 1 94 VAL MG1 . . 4.270 4.024 3.529 4.355 0.085 4 0 "[ . 1 . 2]" 1
1219 1 90 TYR QE 1 98 LEU MD1 . . 3.900 3.632 2.750 4.052 0.152 10 0 "[ . 1 . 2]" 1
1220 1 91 SER H 1 91 SER HB3 . . 3.930 3.184 2.151 3.801 . 0 0 "[ . 1 . 2]" 1
1221 1 91 SER H 1 93 LYS H . . 5.500 5.251 4.802 5.563 0.063 4 0 "[ . 1 . 2]" 1
1222 1 91 SER H 1 94 VAL HB . . 3.910 2.677 2.171 3.590 . 0 0 "[ . 1 . 2]" 1
1223 1 91 SER H 1 94 VAL MG1 . . 4.990 3.567 2.921 4.088 . 0 0 "[ . 1 . 2]" 1
1224 1 91 SER H 1 94 VAL MG2 . . 4.450 2.727 2.027 3.167 . 0 0 "[ . 1 . 2]" 1
1225 1 91 SER H 1 95 LEU H . . 5.480 4.467 3.722 5.498 0.018 11 0 "[ . 1 . 2]" 1
1226 1 91 SER H 1 95 LEU HG . . 5.500 4.896 3.487 5.586 0.086 3 0 "[ . 1 . 2]" 1
1227 1 91 SER HA 1 92 TRP H . . 3.420 2.293 2.177 2.446 . 0 0 "[ . 1 . 2]" 1
1228 1 91 SER HA 1 94 VAL H . . 4.560 4.638 4.551 4.663 0.103 1 0 "[ . 1 . 2]" 1
1229 1 91 SER HB3 1 92 TRP H . . 3.970 3.328 2.609 3.999 0.029 17 0 "[ . 1 . 2]" 1
1230 1 91 SER HB3 1 93 LYS H . . 5.360 3.690 2.954 5.242 . 0 0 "[ . 1 . 2]" 1
1231 1 91 SER HB3 1 94 VAL HB . . 5.130 4.493 2.511 5.593 0.463 11 0 "[ . 1 . 2]" 1
1232 1 91 SER HB3 1 94 VAL MG2 . . 4.760 3.362 2.126 4.180 . 0 0 "[ . 1 . 2]" 1
1233 1 92 TRP H 1 92 TRP HB3 . . 3.910 3.541 3.504 3.580 . 0 0 "[ . 1 . 2]" 1
1234 1 92 TRP H 1 92 TRP HE3 . . 4.410 3.367 3.017 4.032 . 0 0 "[ . 1 . 2]" 1
1235 1 92 TRP H 1 93 LYS H . . 3.770 2.902 2.692 3.107 . 0 0 "[ . 1 . 2]" 1
1236 1 92 TRP H 1 95 LEU H . . 5.500 5.038 4.745 5.553 0.053 11 0 "[ . 1 . 2]" 1
1237 1 92 TRP H 1 95 LEU QD . . 5.500 4.058 3.492 5.238 . 0 0 "[ . 1 . 2]" 1
1238 1 92 TRP HA 1 92 TRP HE3 . . 3.300 2.121 2.055 2.185 . 0 0 "[ . 1 . 2]" 1
1239 1 92 TRP HA 1 92 TRP HZ3 . . 4.490 4.540 4.471 4.565 0.075 11 0 "[ . 1 . 2]" 1
1240 1 92 TRP HA 1 95 LEU H . . 4.390 3.590 3.365 3.773 . 0 0 "[ . 1 . 2]" 1
1241 1 92 TRP HA 1 95 LEU HB3 . . 5.050 4.749 4.448 5.552 0.502 11 1 "[ . 1+ . 2]" 1
1242 1 92 TRP HA 1 95 LEU QD . . 3.860 2.435 2.051 3.313 . 0 0 "[ . 1 . 2]" 1
1243 1 92 TRP HA 1 96 TYR H . . 5.360 4.301 4.030 4.738 . 0 0 "[ . 1 . 2]" 1
1244 1 92 TRP HB3 1 93 LYS H . . 3.970 3.804 3.676 3.995 0.025 11 0 "[ . 1 . 2]" 1
1245 1 92 TRP HE3 1 95 LEU QD . . 3.430 2.308 2.098 2.611 . 0 0 "[ . 1 . 2]" 1
1246 1 92 TRP HZ3 1 95 LEU QD . . 3.900 2.986 2.718 3.296 . 0 0 "[ . 1 . 2]" 1
1247 1 93 LYS H 1 93 LYS HB3 . . 3.420 2.644 2.512 2.890 . 0 0 "[ . 1 . 2]" 1
1248 1 93 LYS H 1 93 LYS HG3 . . 4.650 4.452 4.176 4.693 0.043 18 0 "[ . 1 . 2]" 1
1249 1 93 LYS H 1 94 VAL H . . 3.300 2.733 2.641 2.824 . 0 0 "[ . 1 . 2]" 1
1250 1 93 LYS H 1 94 VAL HA . . 5.300 5.342 5.254 5.376 0.076 3 0 "[ . 1 . 2]" 1
1251 1 93 LYS H 1 94 VAL HB . . 4.980 4.896 4.512 5.059 0.079 1 0 "[ . 1 . 2]" 1
1252 1 93 LYS H 1 94 VAL MG2 . . 4.480 4.138 3.869 4.482 0.002 2 0 "[ . 1 . 2]" 1
1253 1 93 LYS HA 1 96 TYR H . . 4.260 3.633 3.387 3.848 . 0 0 "[ . 1 . 2]" 1
1254 1 93 LYS HA 1 96 TYR HB3 . . 4.180 3.208 2.783 3.452 . 0 0 "[ . 1 . 2]" 1
1255 1 93 LYS HA 1 96 TYR QD . . 4.440 4.092 3.429 4.533 0.093 2 0 "[ . 1 . 2]" 1
1256 1 93 LYS HA 1 97 ASP H . . 4.330 4.143 3.939 4.391 0.061 9 0 "[ . 1 . 2]" 1
1257 1 93 LYS HB3 1 93 LYS HE3 . . 5.400 4.241 2.518 4.831 . 0 0 "[ . 1 . 2]" 1
1258 1 93 LYS HB3 1 94 VAL H . . 4.030 2.637 2.500 2.897 . 0 0 "[ . 1 . 2]" 1
1259 1 93 LYS HB3 1 94 VAL MG2 . . 3.990 3.138 2.809 3.373 . 0 0 "[ . 1 . 2]" 1
1260 1 93 LYS HG3 1 94 VAL H . . 5.500 5.032 4.704 5.373 . 0 0 "[ . 1 . 2]" 1
1261 1 94 VAL H 1 94 VAL HB . . 3.220 2.429 2.252 2.674 . 0 0 "[ . 1 . 2]" 1
1262 1 94 VAL H 1 94 VAL MG1 . . 3.780 3.766 3.703 3.816 0.036 15 0 "[ . 1 . 2]" 1
1263 1 94 VAL H 1 94 VAL MG2 . . 3.060 2.169 1.942 2.361 . 0 0 "[ . 1 . 2]" 1
1264 1 94 VAL H 1 95 LEU H . . 3.560 2.724 2.517 2.853 . 0 0 "[ . 1 . 2]" 1
1265 1 94 VAL H 1 96 TYR H . . 5.110 4.204 4.055 4.375 . 0 0 "[ . 1 . 2]" 1
1266 1 94 VAL HA 1 94 VAL MG1 . . 3.300 2.528 2.356 2.748 . 0 0 "[ . 1 . 2]" 1
1267 1 94 VAL HA 1 94 VAL MG2 . . 3.010 2.415 2.282 2.554 . 0 0 "[ . 1 . 2]" 1
1268 1 94 VAL HA 1 97 ASP HB3 . . 3.780 3.330 2.770 3.703 . 0 0 "[ . 1 . 2]" 1
1269 1 94 VAL HA 1 98 LEU H . . 4.810 4.084 3.650 4.450 . 0 0 "[ . 1 . 2]" 1
1270 1 94 VAL HA 1 98 LEU HG . . 5.120 4.130 3.733 4.701 . 0 0 "[ . 1 . 2]" 1
1271 1 94 VAL HB 1 95 LEU H . . 3.700 2.597 2.386 2.972 . 0 0 "[ . 1 . 2]" 1
1272 1 94 VAL MG1 1 95 LEU H . . 3.960 3.391 3.000 3.655 . 0 0 "[ . 1 . 2]" 1
1273 1 94 VAL MG1 1 95 LEU HA . . 3.850 3.469 3.154 3.919 0.069 9 0 "[ . 1 . 2]" 1
1274 1 94 VAL MG1 1 95 LEU QD . . 4.160 3.430 2.926 4.061 . 0 0 "[ . 1 . 2]" 1
1275 1 94 VAL MG1 1 97 ASP H . . 5.320 4.908 4.661 5.148 . 0 0 "[ . 1 . 2]" 1
1276 1 94 VAL MG1 1 97 ASP HB3 . . 4.840 4.338 3.739 4.957 0.117 17 0 "[ . 1 . 2]" 1
1277 1 94 VAL MG1 1 98 LEU H . . 4.790 4.161 3.905 4.530 . 0 0 "[ . 1 . 2]" 1
1278 1 94 VAL MG1 1 98 LEU MD1 . . 3.680 2.302 2.039 2.844 . 0 0 "[ . 1 . 2]" 1
1279 1 94 VAL MG1 1 98 LEU MD2 . . 4.450 3.696 3.179 4.460 0.010 17 0 "[ . 1 . 2]" 1
1280 1 94 VAL MG2 1 95 LEU H . . 4.090 3.908 3.622 4.163 0.073 7 0 "[ . 1 . 2]" 1
1281 1 94 VAL MG2 1 95 LEU HG . . 5.440 5.283 4.560 5.555 0.115 10 0 "[ . 1 . 2]" 1
1282 1 94 VAL MG2 1 97 ASP HB3 . . 5.500 4.976 4.290 5.360 . 0 0 "[ . 1 . 2]" 1
1283 1 95 LEU H 1 95 LEU HB3 . . 3.680 3.596 3.533 3.646 . 0 0 "[ . 1 . 2]" 1
1284 1 95 LEU H 1 95 LEU QD . . 4.170 2.601 1.850 3.243 . 0 0 "[ . 1 . 2]" 1
1285 1 95 LEU H 1 95 LEU HG . . 3.640 2.735 2.079 3.339 . 0 0 "[ . 1 . 2]" 1
1286 1 95 LEU H 1 96 TYR H . . 3.390 2.763 2.679 2.894 . 0 0 "[ . 1 . 2]" 1
1287 1 95 LEU H 1 98 LEU MD1 . . 5.210 4.541 3.933 5.298 0.088 6 0 "[ . 1 . 2]" 1
1288 1 95 LEU HA 1 95 LEU QD . . 3.200 2.584 2.095 3.082 . 0 0 "[ . 1 . 2]" 1
1289 1 95 LEU HA 1 98 LEU H . . 4.570 3.813 3.373 4.222 . 0 0 "[ . 1 . 2]" 1
1290 1 95 LEU HA 1 98 LEU HB3 . . 4.290 4.583 4.135 4.779 0.489 6 0 "[ . 1 . 2]" 1
1291 1 95 LEU HA 1 98 LEU MD1 . . 3.900 2.893 2.269 3.538 . 0 0 "[ . 1 . 2]" 1
1292 1 95 LEU HA 1 98 LEU HG . . 5.100 4.193 3.254 4.932 . 0 0 "[ . 1 . 2]" 1
1293 1 95 LEU HA 1 99 ALA H . . 4.920 4.031 3.860 4.455 . 0 0 "[ . 1 . 2]" 1
1294 1 95 LEU HA 1 99 ALA MB . . 5.500 4.493 4.148 4.866 . 0 0 "[ . 1 . 2]" 1
1295 1 95 LEU HB3 1 96 TYR H . . 4.250 3.653 3.494 3.977 . 0 0 "[ . 1 . 2]" 1
1296 1 95 LEU HB3 1 96 TYR HA . . 5.340 4.425 4.244 4.683 . 0 0 "[ . 1 . 2]" 1
1297 1 95 LEU QD 1 96 TYR H . . 5.210 3.961 3.519 4.239 . 0 0 "[ . 1 . 2]" 1
1298 1 95 LEU HG 1 96 TYR H . . 5.480 4.726 4.286 5.141 . 0 0 "[ . 1 . 2]" 1
1299 1 96 TYR H 1 96 TYR HB3 . . 3.460 2.793 2.446 3.036 . 0 0 "[ . 1 . 2]" 1
1300 1 96 TYR H 1 96 TYR QD . . 4.550 4.144 4.043 4.231 . 0 0 "[ . 1 . 2]" 1
1301 1 96 TYR H 1 97 ASP H . . 3.500 2.722 2.490 2.870 . 0 0 "[ . 1 . 2]" 1
1302 1 96 TYR H 1 98 LEU H . . 5.010 4.398 4.080 4.912 . 0 0 "[ . 1 . 2]" 1
1303 1 96 TYR H 1 99 ALA MB . . 5.500 4.693 4.258 5.105 . 0 0 "[ . 1 . 2]" 1
1304 1 96 TYR HA 1 96 TYR QD . . 3.110 2.538 2.254 3.020 . 0 0 "[ . 1 . 2]" 1
1305 1 96 TYR HA 1 96 TYR QE . . 5.390 4.471 4.280 4.675 . 0 0 "[ . 1 . 2]" 1
1306 1 96 TYR HA 1 97 ASP HA . . 4.750 4.777 4.646 4.825 0.075 15 0 "[ . 1 . 2]" 1
1307 1 96 TYR HA 1 98 LEU H . . 5.220 4.733 4.343 5.150 . 0 0 "[ . 1 . 2]" 1
1308 1 96 TYR HA 1 99 ALA H . . 4.460 3.664 3.274 3.923 . 0 0 "[ . 1 . 2]" 1
1309 1 96 TYR HA 1 99 ALA MB . . 3.520 2.680 2.308 3.125 . 0 0 "[ . 1 . 2]" 1
1310 1 96 TYR HB3 1 97 ASP H . . 4.460 2.572 2.411 2.758 . 0 0 "[ . 1 . 2]" 1
1311 1 96 TYR HB3 1 99 ALA MB . . 5.450 5.105 4.767 5.518 0.068 16 0 "[ . 1 . 2]" 1
1312 1 96 TYR QD 1 97 ASP H . . 4.390 4.290 3.968 4.482 0.092 1 0 "[ . 1 . 2]" 1
1313 1 96 TYR QD 1 97 ASP HA . . 4.750 4.181 3.458 4.798 0.048 15 0 "[ . 1 . 2]" 1
1314 1 96 TYR QD 1 99 ALA H . . 5.290 4.891 4.394 5.366 0.076 10 0 "[ . 1 . 2]" 1
1315 1 96 TYR QD 1 99 ALA MB . . 3.960 3.441 2.625 4.048 0.088 12 0 "[ . 1 . 2]" 1
1316 1 96 TYR QD 1 100 SER H . . 5.500 3.744 3.110 4.963 . 0 0 "[ . 1 . 2]" 1
1317 1 97 ASP H 1 97 ASP HB3 . . 2.990 2.864 2.547 3.070 0.080 1 0 "[ . 1 . 2]" 1
1318 1 97 ASP H 1 98 LEU H . . 3.430 2.776 2.619 2.901 . 0 0 "[ . 1 . 2]" 1
1319 1 97 ASP H 1 98 LEU HB3 . . 5.190 6.218 6.005 6.391 1.201 14 20 [*************+*****-] 1
1320 1 97 ASP H 1 98 LEU HG . . 5.050 4.695 4.257 5.039 . 0 0 "[ . 1 . 2]" 1
1321 1 97 ASP H 1 99 ALA MB . . 5.500 4.841 4.466 5.181 . 0 0 "[ . 1 . 2]" 1
1322 1 97 ASP H 1 100 SER H . . 5.500 4.879 4.605 5.370 . 0 0 "[ . 1 . 2]" 1
1323 1 97 ASP HA 1 100 SER H . . 4.470 3.628 3.328 4.303 . 0 0 "[ . 1 . 2]" 1
1324 1 97 ASP HA 1 100 SER HB3 . . 4.500 4.002 2.961 4.576 0.076 17 0 "[ . 1 . 2]" 1
1325 1 97 ASP HA 1 101 ASN H . . 4.630 4.705 4.692 4.723 0.093 7 0 "[ . 1 . 2]" 1
1326 1 97 ASP HA 1 101 ASN HD21 . . 3.970 3.131 2.806 3.664 . 0 0 "[ . 1 . 2]" 1
1327 1 97 ASP HA 1 101 ASN HD22 . . 4.170 3.739 3.341 4.233 0.063 12 0 "[ . 1 . 2]" 1
1328 1 97 ASP HB3 1 98 LEU H . . 3.690 2.579 2.046 2.891 . 0 0 "[ . 1 . 2]" 1
1329 1 97 ASP HB3 1 98 LEU HA . . 5.390 4.156 4.058 4.388 . 0 0 "[ . 1 . 2]" 1
1330 1 97 ASP HB3 1 98 LEU HB3 . . 5.400 5.701 5.394 5.946 0.546 1 1 "[+ . 1 . 2]" 1
1331 1 97 ASP HB3 1 98 LEU HG . . 5.230 3.440 3.169 3.967 . 0 0 "[ . 1 . 2]" 1
1332 1 97 ASP HB3 1 101 ASN HD21 . . 5.460 4.501 3.885 5.156 . 0 0 "[ . 1 . 2]" 1
1333 1 98 LEU H 1 98 LEU HB3 . . 3.350 3.562 3.406 3.642 0.292 1 0 "[ . 1 . 2]" 1
1334 1 98 LEU H 1 98 LEU MD1 . . 4.150 3.493 3.093 3.883 . 0 0 "[ . 1 . 2]" 1
1335 1 98 LEU H 1 98 LEU MD2 . . 3.820 3.515 3.244 3.896 0.076 20 0 "[ . 1 . 2]" 1
1336 1 98 LEU H 1 98 LEU HG . . 3.470 2.340 2.125 2.607 . 0 0 "[ . 1 . 2]" 1
1337 1 98 LEU H 1 99 ALA H . . 3.110 2.784 2.493 2.908 . 0 0 "[ . 1 . 2]" 1
1338 1 98 LEU H 1 99 ALA MB . . 4.570 4.432 4.165 4.623 0.053 10 0 "[ . 1 . 2]" 1
1339 1 98 LEU H 1 101 ASN H . . 5.300 5.057 4.880 5.220 . 0 0 "[ . 1 . 2]" 1
1340 1 98 LEU H 1 105 LEU QD . . 4.990 4.678 4.206 5.010 0.020 10 0 "[ . 1 . 2]" 1
1341 1 98 LEU HA 1 98 LEU MD1 . . 4.190 3.874 3.762 3.961 . 0 0 "[ . 1 . 2]" 1
1342 1 98 LEU HA 1 98 LEU MD2 . . 3.070 2.109 1.971 2.275 . 0 0 "[ . 1 . 2]" 1
1343 1 98 LEU HA 1 101 ASN H . . 4.910 3.612 3.066 3.941 . 0 0 "[ . 1 . 2]" 1
1344 1 98 LEU HA 1 101 ASN HB3 . . 5.030 5.042 4.486 5.526 0.496 3 0 "[ . 1 . 2]" 1
1345 1 98 LEU HA 1 105 LEU HB3 . . 5.040 5.345 4.309 5.995 0.955 2 9 "[ +**** **- * . 2]" 1
1346 1 98 LEU HA 1 105 LEU QD . . 3.160 2.696 2.081 3.156 . 0 0 "[ . 1 . 2]" 1
1347 1 98 LEU HB3 1 98 LEU MD1 . . 3.440 2.470 2.323 2.616 . 0 0 "[ . 1 . 2]" 1
1348 1 98 LEU HB3 1 99 ALA H . . 3.520 3.436 3.262 3.627 0.107 12 0 "[ . 1 . 2]" 1
1349 1 98 LEU HB3 1 99 ALA HA . . 5.410 4.291 4.080 4.595 . 0 0 "[ . 1 . 2]" 1
1350 1 98 LEU HB3 1 99 ALA MB . . 5.050 4.628 4.327 5.012 . 0 0 "[ . 1 . 2]" 1
1351 1 98 LEU MD1 1 99 ALA H . . 5.000 4.416 4.276 4.708 . 0 0 "[ . 1 . 2]" 1
1352 1 98 LEU MD2 1 99 ALA H . . 4.630 4.711 4.685 4.736 0.106 2 0 "[ . 1 . 2]" 1
1353 1 98 LEU HG 1 99 ALA H . . 4.790 4.446 4.207 4.670 . 0 0 "[ . 1 . 2]" 1
1354 1 98 LEU HG 1 105 LEU QD . . 4.970 4.169 3.162 4.930 . 0 0 "[ . 1 . 2]" 1
1355 1 99 ALA H 1 99 ALA MB . . 3.080 2.227 2.130 2.304 . 0 0 "[ . 1 . 2]" 1
1356 1 99 ALA H 1 101 ASN H . . 4.390 4.171 3.921 4.323 . 0 0 "[ . 1 . 2]" 1
1357 1 99 ALA HA 1 102 GLN H . . 4.750 4.051 3.283 4.666 . 0 0 "[ . 1 . 2]" 1
1358 1 99 ALA HA 1 102 GLN HB3 . . 4.040 2.695 2.135 3.369 . 0 0 "[ . 1 . 2]" 1
1359 1 99 ALA HA 1 102 GLN QE . . 4.240 2.701 2.214 3.389 . 0 0 "[ . 1 . 2]" 1
1360 1 99 ALA HA 1 102 GLN HG3 . . 5.150 4.882 4.084 5.511 0.361 20 0 "[ . 1 . 2]" 1
1361 1 99 ALA MB 1 100 SER H . . 3.700 2.626 2.205 3.431 . 0 0 "[ . 1 . 2]" 1
1362 1 99 ALA MB 1 100 SER HA . . 4.750 3.898 3.450 4.335 . 0 0 "[ . 1 . 2]" 1
1363 1 99 ALA MB 1 100 SER HB3 . . 5.450 5.124 4.427 5.543 0.093 12 0 "[ . 1 . 2]" 1
1364 1 99 ALA MB 1 102 GLN QE . . 4.830 3.219 2.656 3.940 . 0 0 "[ . 1 . 2]" 1
1365 1 100 SER H 1 100 SER HB3 . . 3.800 3.230 2.490 3.551 . 0 0 "[ . 1 . 2]" 1
1366 1 100 SER H 1 101 ASN H . . 3.300 2.635 1.941 2.879 . 0 0 "[ . 1 . 2]" 1
1367 1 100 SER H 1 101 ASN HB3 . . 5.080 6.158 5.628 6.443 1.363 6 20 [*****+**-***********] 1
1368 1 100 SER H 1 102 GLN H . . 5.500 4.726 4.200 5.044 . 0 0 "[ . 1 . 2]" 1
1369 1 100 SER HA 1 101 ASN H . . 3.510 3.461 3.358 3.536 0.026 3 0 "[ . 1 . 2]" 1
1370 1 100 SER HA 1 101 ASN HD22 . . 5.500 5.469 5.189 5.582 0.082 7 0 "[ . 1 . 2]" 1
1371 1 100 SER HA 1 102 GLN H . . 4.580 4.446 4.105 4.661 0.081 14 0 "[ . 1 . 2]" 1
1372 1 100 SER HB3 1 101 ASN H . . 3.850 3.652 3.002 3.932 0.082 20 0 "[ . 1 . 2]" 1
1373 1 100 SER HB3 1 101 ASN HA . . 5.430 4.582 4.400 4.726 . 0 0 "[ . 1 . 2]" 1
1374 1 100 SER HB3 1 101 ASN HD21 . . 5.070 3.364 2.387 4.102 . 0 0 "[ . 1 . 2]" 1
1375 1 100 SER HB3 1 101 ASN HD22 . . 5.230 3.139 2.510 3.613 . 0 0 "[ . 1 . 2]" 1
1376 1 101 ASN H 1 101 ASN HB3 . . 3.380 3.769 3.647 3.924 0.544 9 1 "[ . +1 . 2]" 1
1377 1 101 ASN H 1 101 ASN HD21 . . 4.170 2.983 2.642 3.245 . 0 0 "[ . 1 . 2]" 1
1378 1 101 ASN H 1 101 ASN HD22 . . 4.720 4.255 3.623 4.418 . 0 0 "[ . 1 . 2]" 1
1379 1 101 ASN H 1 102 GLN H . . 3.230 2.741 2.466 2.978 . 0 0 "[ . 1 . 2]" 1
1380 1 101 ASN H 1 102 GLN HA . . 4.480 4.058 3.803 4.363 . 0 0 "[ . 1 . 2]" 1
1381 1 101 ASN H 1 103 VAL H . . 5.500 4.953 4.695 5.250 . 0 0 "[ . 1 . 2]" 1
1382 1 101 ASN H 1 105 LEU QD . . 4.360 3.873 3.447 4.153 . 0 0 "[ . 1 . 2]" 1
1383 1 101 ASN HA 1 101 ASN HD22 . . 5.500 4.542 4.404 4.697 . 0 0 "[ . 1 . 2]" 1
1384 1 101 ASN HA 1 102 GLN HA . . 4.950 4.721 4.581 4.806 . 0 0 "[ . 1 . 2]" 1
1385 1 101 ASN HA 1 103 VAL H . . 4.350 3.814 3.345 4.295 . 0 0 "[ . 1 . 2]" 1
1386 1 101 ASN HA 1 103 VAL HB . . 5.410 4.890 4.411 5.470 0.060 19 0 "[ . 1 . 2]" 1
1387 1 101 ASN HA 1 103 VAL MG2 . . 5.500 4.875 4.071 5.488 . 0 0 "[ . 1 . 2]" 1
1388 1 101 ASN HA 1 104 ASP H . . 4.680 3.823 3.538 4.217 . 0 0 "[ . 1 . 2]" 1
1389 1 101 ASN HA 1 105 LEU H . . 5.460 4.464 4.160 4.969 . 0 0 "[ . 1 . 2]" 1
1390 1 101 ASN HA 1 105 LEU QD . . 4.780 4.164 3.644 4.557 . 0 0 "[ . 1 . 2]" 1
1391 1 101 ASN HA 1 105 LEU HG . . 4.930 4.602 4.133 5.025 0.095 15 0 "[ . 1 . 2]" 1
1392 1 101 ASN HB3 1 101 ASN HD21 . . 3.560 3.469 3.365 3.542 . 0 0 "[ . 1 . 2]" 1
1393 1 101 ASN HB3 1 101 ASN HD22 . . 3.910 4.056 3.987 4.106 0.196 4 0 "[ . 1 . 2]" 1
1394 1 101 ASN HB3 1 105 LEU H . . 4.970 3.580 3.114 4.190 . 0 0 "[ . 1 . 2]" 1
1395 1 101 ASN HB3 1 105 LEU QD . . 3.570 2.625 1.962 3.100 . 0 0 "[ . 1 . 2]" 1
1396 1 101 ASN HB3 1 105 LEU HG . . 4.090 2.815 2.155 3.822 . 0 0 "[ . 1 . 2]" 1
1397 1 101 ASN HD21 1 105 LEU QD . . 4.870 3.579 3.184 3.936 . 0 0 "[ . 1 . 2]" 1
1398 1 101 ASN HD22 1 105 LEU QD . . 5.470 4.548 4.201 5.133 . 0 0 "[ . 1 . 2]" 1
1399 1 102 GLN H 1 102 GLN HB3 . . 3.420 2.726 2.422 3.011 . 0 0 "[ . 1 . 2]" 1
1400 1 102 GLN H 1 102 GLN QE . . 5.350 4.156 3.585 4.662 . 0 0 "[ . 1 . 2]" 1
1401 1 102 GLN H 1 102 GLN HG3 . . 4.050 3.235 2.778 4.000 . 0 0 "[ . 1 . 2]" 1
1402 1 102 GLN H 1 103 VAL H . . 3.830 2.521 2.377 2.907 . 0 0 "[ . 1 . 2]" 1
1403 1 102 GLN H 1 103 VAL HB . . 5.390 4.616 4.315 5.065 . 0 0 "[ . 1 . 2]" 1
1404 1 102 GLN H 1 103 VAL MG1 . . 5.500 5.613 5.591 5.621 0.121 4 0 "[ . 1 . 2]" 1
1405 1 102 GLN H 1 103 VAL MG2 . . 4.970 3.489 3.091 3.973 . 0 0 "[ . 1 . 2]" 1
1406 1 102 GLN H 1 105 LEU QD . . 4.820 4.527 3.849 4.797 . 0 0 "[ . 1 . 2]" 1
1407 1 102 GLN HA 1 105 LEU HB3 . . 3.660 4.404 3.758 4.794 1.134 10 14 "[******-**+** . **]" 1
1408 1 102 GLN HA 1 105 LEU QD . . 3.880 3.233 2.240 3.888 0.008 1 0 "[ . 1 . 2]" 1
1409 1 102 GLN HA 1 105 LEU HG . . 5.500 3.991 1.861 5.230 . 0 0 "[ . 1 . 2]" 1
1410 1 102 GLN HA 1 106 TRP H . . 4.610 3.981 3.633 4.456 . 0 0 "[ . 1 . 2]" 1
1411 1 102 GLN HB3 1 103 VAL H . . 4.760 4.223 3.922 4.539 . 0 0 "[ . 1 . 2]" 1
1412 1 102 GLN QE 1 103 VAL MG2 . . 5.450 4.597 4.065 4.912 . 0 0 "[ . 1 . 2]" 1
1413 1 102 GLN HG3 1 103 VAL H . . 3.830 3.090 2.332 3.889 0.059 1 0 "[ . 1 . 2]" 1
1414 1 102 GLN HG3 1 103 VAL MG2 . . 3.550 2.520 2.128 3.055 . 0 0 "[ . 1 . 2]" 1
1415 1 103 VAL H 1 103 VAL HB . . 3.060 2.446 2.067 2.716 . 0 0 "[ . 1 . 2]" 1
1416 1 103 VAL H 1 103 VAL MG1 . . 3.790 3.705 3.573 3.815 0.025 1 0 "[ . 1 . 2]" 1
1417 1 103 VAL H 1 103 VAL MG2 . . 2.880 2.166 1.892 2.514 . 0 0 "[ . 1 . 2]" 1
1418 1 103 VAL H 1 104 ASP H . . 3.260 2.472 2.114 2.756 . 0 0 "[ . 1 . 2]" 1
1419 1 103 VAL HA 1 103 VAL MG1 . . 3.050 2.396 2.181 2.665 . 0 0 "[ . 1 . 2]" 1
1420 1 103 VAL HA 1 103 VAL MG2 . . 2.900 2.456 2.184 2.666 . 0 0 "[ . 1 . 2]" 1
1421 1 103 VAL HA 1 106 TRP H . . 4.210 3.740 3.354 4.157 . 0 0 "[ . 1 . 2]" 1
1422 1 103 VAL HA 1 106 TRP HB3 . . 4.020 2.843 2.523 3.160 . 0 0 "[ . 1 . 2]" 1
1423 1 103 VAL HA 1 106 TRP HD1 . . 4.100 4.048 3.485 4.186 0.086 17 0 "[ . 1 . 2]" 1
1424 1 103 VAL HB 1 104 ASP H . . 3.300 2.416 2.012 2.662 . 0 0 "[ . 1 . 2]" 1
1425 1 103 VAL HB 1 104 ASP HA . . 5.240 4.199 4.069 4.436 . 0 0 "[ . 1 . 2]" 1
1426 1 103 VAL MG1 1 104 ASP H . . 3.610 3.393 2.783 3.688 0.078 6 0 "[ . 1 . 2]" 1
1427 1 103 VAL MG1 1 104 ASP HA . . 3.980 3.513 2.986 4.013 0.033 19 0 "[ . 1 . 2]" 1
1428 1 103 VAL MG1 1 105 LEU H . . 5.500 5.150 4.747 5.471 . 0 0 "[ . 1 . 2]" 1
1429 1 103 VAL MG1 1 106 TRP H . . 5.500 4.939 4.473 5.191 . 0 0 "[ . 1 . 2]" 1
1430 1 103 VAL MG1 1 106 TRP HB3 . . 5.080 4.189 3.627 4.661 . 0 0 "[ . 1 . 2]" 1
1431 1 103 VAL MG1 1 106 TRP HD1 . . 5.500 4.434 3.772 5.088 . 0 0 "[ . 1 . 2]" 1
1432 1 103 VAL MG1 1 107 GLU H . . 5.010 4.263 3.912 4.709 . 0 0 "[ . 1 . 2]" 1
1433 1 103 VAL MG1 1 107 GLU HB3 . . 5.280 5.264 4.818 5.379 0.099 1 0 "[ . 1 . 2]" 1
1434 1 103 VAL MG2 1 104 ASP H . . 3.770 3.692 3.403 3.866 0.096 16 0 "[ . 1 . 2]" 1
1435 1 103 VAL MG2 1 104 ASP HA . . 5.270 5.359 5.273 5.387 0.117 18 0 "[ . 1 . 2]" 1
1436 1 103 VAL MG2 1 106 TRP H . . 5.360 5.330 5.102 5.469 0.109 13 0 "[ . 1 . 2]" 1
1437 1 103 VAL MG2 1 106 TRP HB3 . . 5.500 4.813 4.445 5.100 . 0 0 "[ . 1 . 2]" 1
1438 1 104 ASP H 1 105 LEU H . . 3.370 2.606 2.287 2.840 . 0 0 "[ . 1 . 2]" 1
1439 1 104 ASP H 1 106 TRP H . . 4.800 3.990 3.494 4.241 . 0 0 "[ . 1 . 2]" 1
1440 1 104 ASP H 1 107 GLU H . . 4.900 4.728 4.387 4.953 0.053 5 0 "[ . 1 . 2]" 1
1441 1 104 ASP HA 1 106 TRP H . . 4.620 4.345 3.906 4.550 . 0 0 "[ . 1 . 2]" 1
1442 1 104 ASP HA 1 107 GLU H . . 3.930 3.513 3.266 3.907 . 0 0 "[ . 1 . 2]" 1
1443 1 104 ASP HA 1 107 GLU HB3 . . 4.390 3.674 2.858 4.198 . 0 0 "[ . 1 . 2]" 1
1444 1 105 LEU H 1 105 LEU HB3 . . 4.020 3.351 2.066 3.665 . 0 0 "[ . 1 . 2]" 1
1445 1 105 LEU H 1 105 LEU QD . . 3.940 3.012 2.019 3.292 . 0 0 "[ . 1 . 2]" 1
1446 1 105 LEU H 1 105 LEU HG . . 3.370 2.576 2.222 3.431 0.061 18 0 "[ . 1 . 2]" 1
1447 1 105 LEU H 1 106 TRP H . . 3.500 2.653 2.388 2.820 . 0 0 "[ . 1 . 2]" 1
1448 1 105 LEU H 1 106 TRP HA . . 5.410 5.295 5.057 5.414 0.004 18 0 "[ . 1 . 2]" 1
1449 1 105 LEU H 1 106 TRP HB3 . . 5.160 4.798 4.346 5.030 . 0 0 "[ . 1 . 2]" 1
1450 1 105 LEU HA 1 105 LEU HG . . 4.000 3.253 2.816 3.875 . 0 0 "[ . 1 . 2]" 1
1451 1 105 LEU HA 1 107 GLU H . . 5.450 4.659 4.241 4.868 . 0 0 "[ . 1 . 2]" 1
1452 1 105 LEU HA 1 108 ASN HB3 . . 3.730 3.269 2.816 3.733 0.003 7 0 "[ . 1 . 2]" 1
1453 1 105 LEU HA 1 108 ASN HD21 . . 4.910 4.122 3.005 4.979 0.069 2 0 "[ . 1 . 2]" 1
1454 1 105 LEU HB3 1 106 TRP H . . 3.970 3.655 3.266 4.139 0.169 9 0 "[ . 1 . 2]" 1
1455 1 105 LEU HB3 1 107 GLU H . . 5.500 5.806 5.579 6.119 0.619 9 3 "[* . +1 - . 2]" 1
1456 1 105 LEU QD 1 106 TRP H . . 5.030 3.912 2.305 4.425 . 0 0 "[ . 1 . 2]" 1
1457 1 105 LEU QD 1 108 ASN H . . 5.500 4.937 4.646 5.248 . 0 0 "[ . 1 . 2]" 1
1458 1 105 LEU QD 1 108 ASN HD21 . . 5.030 4.506 3.957 5.042 0.012 9 0 "[ . 1 . 2]" 1
1459 1 105 LEU QD 1 108 ASN HD22 . . 5.500 5.053 4.340 5.520 0.020 10 0 "[ . 1 . 2]" 1
1460 1 105 LEU HG 1 106 TRP H . . 5.500 4.317 2.639 4.763 . 0 0 "[ . 1 . 2]" 1
1461 1 106 TRP H 1 106 TRP HB3 . . 3.150 2.447 2.309 2.556 . 0 0 "[ . 1 . 2]" 1
1462 1 106 TRP H 1 106 TRP HD1 . . 5.060 4.940 4.776 5.096 0.036 8 0 "[ . 1 . 2]" 1
1463 1 106 TRP H 1 106 TRP HE3 . . 5.020 4.719 4.590 5.069 0.049 1 0 "[ . 1 . 2]" 1
1464 1 106 TRP H 1 107 GLU H . . 3.440 2.692 2.356 2.887 . 0 0 "[ . 1 . 2]" 1
1465 1 106 TRP H 1 108 ASN H . . 4.830 4.149 3.542 4.492 . 0 0 "[ . 1 . 2]" 1
1466 1 106 TRP H 1 109 TYR QE . . 5.500 5.221 4.329 5.573 0.073 17 0 "[ . 1 . 2]" 1
1467 1 106 TRP HA 1 106 TRP HE3 . . 3.390 2.272 2.144 2.407 . 0 0 "[ . 1 . 2]" 1
1468 1 106 TRP HA 1 106 TRP HZ3 . . 4.700 4.557 4.350 4.692 . 0 0 "[ . 1 . 2]" 1
1469 1 106 TRP HA 1 109 TYR H . . 4.260 3.525 3.320 3.727 . 0 0 "[ . 1 . 2]" 1
1470 1 106 TRP HA 1 109 TYR QE . . 3.950 3.787 2.997 4.039 0.089 2 0 "[ . 1 . 2]" 1
1471 1 106 TRP HA 1 110 LEU H . . 4.740 4.626 4.203 4.824 0.084 16 0 "[ . 1 . 2]" 1
1472 1 106 TRP HA 1 110 LEU QD . . 5.420 3.873 3.104 4.675 . 0 0 "[ . 1 . 2]" 1
1473 1 106 TRP HB3 1 106 TRP HE1 . . 4.900 4.730 4.672 4.797 . 0 0 "[ . 1 . 2]" 1
1474 1 106 TRP HB3 1 107 GLU H . . 3.520 2.491 2.310 2.704 . 0 0 "[ . 1 . 2]" 1
1475 1 106 TRP HB3 1 110 LEU QD . . 5.500 3.993 3.432 4.618 . 0 0 "[ . 1 . 2]" 1
1476 1 106 TRP HD1 1 107 GLU H . . 4.200 3.915 3.644 4.262 0.062 13 0 "[ . 1 . 2]" 1
1477 1 106 TRP HD1 1 110 LEU QD . . 3.320 2.922 2.577 3.308 . 0 0 "[ . 1 . 2]" 1
1478 1 106 TRP HD1 1 110 LEU HG . . 5.250 4.839 3.888 5.341 0.091 20 0 "[ . 1 . 2]" 1
1479 1 106 TRP HE1 1 110 LEU QD . . 3.570 2.498 2.074 2.801 . 0 0 "[ . 1 . 2]" 1
1480 1 106 TRP HE1 1 110 LEU HG . . 5.190 4.302 3.579 4.964 . 0 0 "[ . 1 . 2]" 1
1481 1 106 TRP HE3 1 107 GLU H . . 5.500 5.554 5.435 5.580 0.080 14 0 "[ . 1 . 2]" 1
1482 1 106 TRP HE3 1 109 TYR HB3 . . 5.500 4.813 4.152 5.228 . 0 0 "[ . 1 . 2]" 1
1483 1 106 TRP HE3 1 109 TYR QE . . 4.790 4.082 3.320 4.635 . 0 0 "[ . 1 . 2]" 1
1484 1 106 TRP HH2 1 110 LEU QD . . 4.590 3.787 3.240 4.310 . 0 0 "[ . 1 . 2]" 1
1485 1 106 TRP HZ2 1 110 LEU QD . . 3.560 2.838 2.139 3.398 . 0 0 "[ . 1 . 2]" 1
1486 1 106 TRP HZ3 1 109 TYR HB3 . . 4.880 4.497 3.393 4.967 0.087 18 0 "[ . 1 . 2]" 1
1487 1 106 TRP HZ3 1 110 LEU QD . . 5.280 4.252 3.890 4.602 . 0 0 "[ . 1 . 2]" 1
1488 1 107 GLU H 1 107 GLU HB3 . . 3.450 3.276 2.889 3.498 0.048 10 0 "[ . 1 . 2]" 1
1489 1 107 GLU H 1 108 ASN H . . 3.520 2.848 2.700 3.002 . 0 0 "[ . 1 . 2]" 1
1490 1 107 GLU H 1 109 TYR H . . 4.980 4.344 3.844 4.574 . 0 0 "[ . 1 . 2]" 1
1491 1 107 GLU H 1 110 LEU QD . . 4.970 3.839 3.397 4.694 . 0 0 "[ . 1 . 2]" 1
1492 1 107 GLU HA 1 108 ASN HA . . 4.920 4.852 4.742 4.995 0.075 1 0 "[ . 1 . 2]" 1
1493 1 107 GLU HA 1 110 LEU H . . 4.150 3.403 3.062 3.680 . 0 0 "[ . 1 . 2]" 1
1494 1 107 GLU HA 1 110 LEU HB3 . . 4.520 4.405 3.499 4.775 0.255 3 0 "[ . 1 . 2]" 1
1495 1 107 GLU HA 1 110 LEU QD . . 3.550 2.234 1.945 2.786 . 0 0 "[ . 1 . 2]" 1
1496 1 107 GLU HA 1 110 LEU HG . . 5.040 3.731 2.605 4.755 . 0 0 "[ . 1 . 2]" 1
1497 1 107 GLU HB3 1 108 ASN H . . 3.700 2.902 2.309 3.416 . 0 0 "[ . 1 . 2]" 1
1498 1 107 GLU HB3 1 108 ASN HD21 . . 5.500 5.468 4.745 5.596 0.096 5 0 "[ . 1 . 2]" 1
1499 1 108 ASN H 1 108 ASN HB3 . . 3.290 2.554 2.033 3.087 . 0 0 "[ . 1 . 2]" 1
1500 1 108 ASN H 1 108 ASN HD21 . . 4.740 3.680 3.087 4.173 . 0 0 "[ . 1 . 2]" 1
1501 1 108 ASN H 1 108 ASN HD22 . . 5.500 5.176 4.732 5.561 0.061 12 0 "[ . 1 . 2]" 1
1502 1 108 ASN H 1 109 TYR H . . 3.290 2.903 2.687 3.107 . 0 0 "[ . 1 . 2]" 1
1503 1 108 ASN H 1 111 ALA MB . . 5.320 4.848 4.526 5.086 . 0 0 "[ . 1 . 2]" 1
1504 1 108 ASN HA 1 108 ASN HD21 . . 4.010 3.248 2.156 3.970 . 0 0 "[ . 1 . 2]" 1
1505 1 108 ASN HA 1 108 ASN HD22 . . 4.630 4.099 3.365 4.725 0.095 19 0 "[ . 1 . 2]" 1
1506 1 108 ASN HA 1 109 TYR HA . . 5.250 4.733 4.624 4.941 . 0 0 "[ . 1 . 2]" 1
1507 1 108 ASN HA 1 111 ALA H . . 3.890 3.582 3.156 3.881 . 0 0 "[ . 1 . 2]" 1
1508 1 108 ASN HA 1 111 ALA MB . . 3.340 2.751 2.297 3.030 . 0 0 "[ . 1 . 2]" 1
1509 1 108 ASN HA 1 112 ARG H . . 5.090 3.935 3.425 4.357 . 0 0 "[ . 1 . 2]" 1
1510 1 108 ASN HB3 1 109 TYR H . . 3.820 3.178 2.445 3.886 0.066 16 0 "[ . 1 . 2]" 1
1511 1 108 ASN HB3 1 111 ALA MB . . 5.500 5.119 4.789 5.387 . 0 0 "[ . 1 . 2]" 1
1512 1 108 ASN HD21 1 111 ALA MB . . 5.500 5.122 4.185 5.596 0.096 15 0 "[ . 1 . 2]" 1
1513 1 108 ASN HD22 1 112 ARG HG3 . . 5.500 4.338 3.163 5.557 0.057 4 0 "[ . 1 . 2]" 1
1514 1 109 TYR H 1 109 TYR QE . . 4.780 4.743 4.363 4.864 0.084 3 0 "[ . 1 . 2]" 1
1515 1 109 TYR H 1 110 LEU H . . 3.600 2.447 1.988 2.938 . 0 0 "[ . 1 . 2]" 1
1516 1 109 TYR H 1 110 LEU QD . . 5.500 3.607 2.721 4.901 . 0 0 "[ . 1 . 2]" 1
1517 1 109 TYR H 1 110 LEU HG . . 5.320 4.985 3.900 5.422 0.102 9 0 "[ . 1 . 2]" 1
1518 1 109 TYR H 1 111 ALA MB . . 5.420 4.737 4.466 5.092 . 0 0 "[ . 1 . 2]" 1
1519 1 109 TYR HA 1 109 TYR QE . . 5.500 4.454 4.202 4.637 . 0 0 "[ . 1 . 2]" 1
1520 1 109 TYR HA 1 111 ALA H . . 4.450 4.320 3.915 4.511 0.061 6 0 "[ . 1 . 2]" 1
1521 1 109 TYR HA 1 112 ARG H . . 3.960 3.391 3.018 3.602 . 0 0 "[ . 1 . 2]" 1
1522 1 109 TYR HA 1 112 ARG HG3 . . 4.150 3.281 2.530 4.227 0.077 1 0 "[ . 1 . 2]" 1
1523 1 109 TYR HA 1 113 LEU H . . 4.760 3.638 3.356 3.918 . 0 0 "[ . 1 . 2]" 1
1524 1 109 TYR HB3 1 110 LEU H . . 4.160 3.563 3.222 3.839 . 0 0 "[ . 1 . 2]" 1
1525 1 109 TYR HB3 1 110 LEU QD . . 3.770 3.562 3.082 3.831 0.061 13 0 "[ . 1 . 2]" 1
1526 1 110 LEU H 1 110 LEU HB3 . . 3.680 3.559 3.422 3.659 . 0 0 "[ . 1 . 2]" 1
1527 1 110 LEU H 1 110 LEU QD . . 3.520 2.241 1.696 2.980 . 0 0 "[ . 1 . 2]" 1
1528 1 110 LEU H 1 110 LEU HG . . 3.520 2.910 1.965 3.597 0.077 8 0 "[ . 1 . 2]" 1
1529 1 110 LEU H 1 111 ALA MB . . 5.430 4.396 4.247 4.547 . 0 0 "[ . 1 . 2]" 1
1530 1 110 LEU HA 1 110 LEU QD . . 3.080 2.437 2.062 3.005 . 0 0 "[ . 1 . 2]" 1
1531 1 110 LEU HA 1 112 ARG H . . 5.460 5.032 4.763 5.236 . 0 0 "[ . 1 . 2]" 1
1532 1 110 LEU HA 1 113 LEU H . . 4.280 3.901 3.662 4.160 . 0 0 "[ . 1 . 2]" 1
1533 1 110 LEU HA 1 113 LEU HB3 . . 4.170 2.877 2.487 3.310 . 0 0 "[ . 1 . 2]" 1
1534 1 110 LEU HA 1 113 LEU QD . . 3.500 3.077 2.535 3.540 0.040 20 0 "[ . 1 . 2]" 1
1535 1 110 LEU HA 1 113 LEU HG . . 5.010 4.577 3.746 5.082 0.072 4 0 "[ . 1 . 2]" 1
1536 1 110 LEU HA 1 114 ARG H . . 5.410 4.563 4.015 5.085 . 0 0 "[ . 1 . 2]" 1
1537 1 110 LEU HB3 1 111 ALA H . . 3.720 3.670 3.412 3.949 0.229 10 0 "[ . 1 . 2]" 1
1538 1 111 ALA H 1 111 ALA MB . . 2.900 2.209 2.164 2.237 . 0 0 "[ . 1 . 2]" 1
1539 1 111 ALA HA 1 114 ARG H . . 3.810 3.855 3.779 3.903 0.093 13 0 "[ . 1 . 2]" 1
1540 1 111 ALA HA 1 114 ARG HD3 . . 4.530 4.083 3.135 5.057 0.527 13 1 "[ . 1 + . 2]" 1
1541 1 111 ALA MB 1 112 ARG H . . 3.390 2.265 2.133 2.418 . 0 0 "[ . 1 . 2]" 1
1542 1 111 ALA MB 1 112 ARG HG3 . . 4.720 3.861 3.097 4.456 . 0 0 "[ . 1 . 2]" 1
1543 1 111 ALA MB 1 113 LEU H . . 4.550 4.377 4.233 4.603 0.053 6 0 "[ . 1 . 2]" 1
1544 1 112 ARG H 1 112 ARG HB3 . . 4.080 3.637 3.583 3.671 . 0 0 "[ . 1 . 2]" 1
1545 1 112 ARG H 1 112 ARG HE . . 5.500 4.841 3.977 5.574 0.074 18 0 "[ . 1 . 2]" 1
1546 1 112 ARG H 1 112 ARG HG3 . . 3.190 2.702 2.238 3.233 0.043 5 0 "[ . 1 . 2]" 1
1547 1 112 ARG H 1 113 LEU H . . 3.390 2.831 2.726 2.922 . 0 0 "[ . 1 . 2]" 1
1548 1 112 ARG H 1 113 LEU HA . . 5.420 5.433 5.284 5.487 0.067 18 0 "[ . 1 . 2]" 1
1549 1 112 ARG HA 1 115 ALA H . . 3.680 3.379 2.947 3.729 0.049 2 0 "[ . 1 . 2]" 1
1550 1 112 ARG HA 1 115 ALA MB . . 3.230 2.510 2.047 2.881 . 0 0 "[ . 1 . 2]" 1
1551 1 112 ARG HA 1 116 ALA H . . 4.620 4.420 4.035 4.684 0.064 13 0 "[ . 1 . 2]" 1
1552 1 112 ARG HB3 1 113 LEU H . . 3.640 3.886 3.421 4.174 0.534 4 1 "[ +. 1 . 2]" 1
1553 1 112 ARG HG3 1 113 LEU H . . 5.500 4.541 4.145 4.965 . 0 0 "[ . 1 . 2]" 1
1554 1 113 LEU H 1 113 LEU HB3 . . 3.320 2.318 2.200 2.592 . 0 0 "[ . 1 . 2]" 1
1555 1 113 LEU H 1 113 LEU QD . . 4.230 3.695 3.573 3.777 . 0 0 "[ . 1 . 2]" 1
1556 1 113 LEU H 1 114 ARG H . . 3.490 2.871 2.717 3.089 . 0 0 "[ . 1 . 2]" 1
1557 1 113 LEU H 1 114 ARG HA . . 5.300 5.377 5.365 5.388 0.088 16 0 "[ . 1 . 2]" 1
1558 1 113 LEU H 1 115 ALA H . . 4.940 4.125 3.816 4.423 . 0 0 "[ . 1 . 2]" 1
1559 1 113 LEU H 1 116 ALA MB . . 5.500 4.597 4.250 5.139 . 0 0 "[ . 1 . 2]" 1
1560 1 113 LEU HA 1 113 LEU QD . . 3.230 2.360 2.144 3.016 . 0 0 "[ . 1 . 2]" 1
1561 1 113 LEU HA 1 113 LEU HG . . 4.170 3.418 2.498 3.840 . 0 0 "[ . 1 . 2]" 1
1562 1 113 LEU HA 1 115 ALA H . . 5.180 4.558 4.133 4.773 . 0 0 "[ . 1 . 2]" 1
1563 1 113 LEU HA 1 115 ALA MB . . 5.500 5.201 4.961 5.448 . 0 0 "[ . 1 . 2]" 1
1564 1 113 LEU HA 1 116 ALA H . . 4.270 3.625 3.309 4.281 0.011 13 0 "[ . 1 . 2]" 1
1565 1 113 LEU HA 1 116 ALA MB . . 3.600 2.821 2.284 3.692 0.092 13 0 "[ . 1 . 2]" 1
1566 1 113 LEU HA 1 118 ALA H . . 4.080 3.648 3.321 4.084 0.004 3 0 "[ . 1 . 2]" 1
1567 1 113 LEU HA 1 118 ALA MB . . 3.480 3.005 2.343 3.469 . 0 0 "[ . 1 . 2]" 1
1568 1 113 LEU HB3 1 113 LEU QD . . 3.270 2.283 2.126 2.424 . 0 0 "[ . 1 . 2]" 1
1569 1 113 LEU HB3 1 114 ARG H . . 3.870 2.475 2.153 2.658 . 0 0 "[ . 1 . 2]" 1
1570 1 113 LEU QD 1 114 ARG H . . 4.950 3.370 2.629 3.890 . 0 0 "[ . 1 . 2]" 1
1571 1 113 LEU QD 1 114 ARG HA . . 4.610 3.313 2.454 4.172 . 0 0 "[ . 1 . 2]" 1
1572 1 113 LEU QD 1 114 ARG HG3 . . 5.500 3.476 2.125 5.614 0.114 16 0 "[ . 1 . 2]" 1
1573 1 113 LEU QD 1 116 ALA H . . 5.500 4.214 3.793 5.120 . 0 0 "[ . 1 . 2]" 1
1574 1 113 LEU QD 1 118 ALA H . . 4.860 2.373 2.033 3.909 . 0 0 "[ . 1 . 2]" 1
1575 1 113 LEU QD 1 118 ALA MB . . 3.230 1.988 1.861 2.580 . 0 0 "[ . 1 . 2]" 1
1576 1 113 LEU QD 1 119 SER H . . 4.730 3.583 3.286 3.918 . 0 0 "[ . 1 . 2]" 1
1577 1 113 LEU QD 1 120 ARG H . . 4.740 4.037 3.650 4.329 . 0 0 "[ . 1 . 2]" 1
1578 1 113 LEU QD 1 120 ARG HA . . 4.860 2.804 2.342 3.299 . 0 0 "[ . 1 . 2]" 1
1579 1 113 LEU QD 1 120 ARG HE . . 5.500 4.282 3.036 4.983 . 0 0 "[ . 1 . 2]" 1
1580 1 113 LEU QD 1 120 ARG HG3 . . 4.610 3.206 1.921 4.402 . 0 0 "[ . 1 . 2]" 1
1581 1 113 LEU HG 1 114 ARG H . . 5.460 3.834 2.984 5.042 . 0 0 "[ . 1 . 2]" 1
1582 1 113 LEU HG 1 118 ALA H . . 5.270 4.501 3.677 5.360 0.090 20 0 "[ . 1 . 2]" 1
1583 1 114 ARG H 1 114 ARG HB3 . . 3.590 3.419 2.316 3.674 0.084 14 0 "[ . 1 . 2]" 1
1584 1 114 ARG H 1 114 ARG HD3 . . 4.490 3.890 2.200 4.563 0.073 3 0 "[ . 1 . 2]" 1
1585 1 114 ARG H 1 114 ARG HG3 . . 3.490 2.866 1.613 3.558 0.068 19 0 "[ . 1 . 2]" 1
1586 1 114 ARG H 1 116 ALA H . . 4.730 3.941 3.789 4.188 . 0 0 "[ . 1 . 2]" 1
1587 1 114 ARG HA 1 114 ARG HD3 . . 4.580 4.458 3.895 4.677 0.097 13 0 "[ . 1 . 2]" 1
1588 1 114 ARG HA 1 114 ARG HG3 . . 3.740 2.679 2.205 3.655 . 0 0 "[ . 1 . 2]" 1
1589 1 114 ARG HA 1 116 ALA H . . 4.660 3.724 3.128 3.977 . 0 0 "[ . 1 . 2]" 1
1590 1 114 ARG HA 1 117 LYS H . . 3.820 3.445 2.876 3.900 0.080 10 0 "[ . 1 . 2]" 1
1591 1 114 ARG HA 1 118 ALA H . . 4.380 4.174 2.922 4.459 0.079 3 0 "[ . 1 . 2]" 1
1592 1 114 ARG HB3 1 116 ALA H . . 5.120 5.140 4.881 5.214 0.094 1 0 "[ . 1 . 2]" 1
1593 1 115 ALA H 1 115 ALA MB . . 2.780 2.222 2.144 2.275 . 0 0 "[ . 1 . 2]" 1
1594 1 115 ALA H 1 116 ALA H . . 3.200 2.602 2.436 2.745 . 0 0 "[ . 1 . 2]" 1
1595 1 115 ALA H 1 116 ALA HA . . 5.140 5.208 5.122 5.227 0.087 12 0 "[ . 1 . 2]" 1
1596 1 115 ALA MB 1 116 ALA H . . 3.290 3.052 2.755 3.313 0.023 13 0 "[ . 1 . 2]" 1
1597 1 115 ALA MB 1 116 ALA HA . . 4.180 4.067 3.787 4.254 0.074 10 0 "[ . 1 . 2]" 1
1598 1 116 ALA H 1 116 ALA MB . . 2.900 2.333 2.206 2.456 . 0 0 "[ . 1 . 2]" 1
1599 1 116 ALA H 1 117 LYS H . . 2.860 2.358 2.024 2.778 . 0 0 "[ . 1 . 2]" 1
1600 1 116 ALA H 1 117 LYS HA . . 4.430 4.426 4.256 4.509 0.079 20 0 "[ . 1 . 2]" 1
1601 1 116 ALA H 1 118 ALA H . . 4.010 3.814 3.341 4.067 0.057 8 0 "[ . 1 . 2]" 1
1602 1 116 ALA H 1 118 ALA MB . . 4.580 4.566 4.295 4.677 0.097 2 0 "[ . 1 . 2]" 1
1603 1 116 ALA HA 1 117 LYS HA . . 5.150 5.130 4.864 5.221 0.071 8 0 "[ . 1 . 2]" 1
1604 1 116 ALA HA 1 118 ALA H . . 5.030 4.806 4.418 5.122 0.092 10 0 "[ . 1 . 2]" 1
1605 1 116 ALA MB 1 117 LYS H . . 3.510 3.062 1.841 3.440 . 0 0 "[ . 1 . 2]" 1
1606 1 116 ALA MB 1 118 ALA H . . 3.680 3.052 2.598 3.734 0.054 9 0 "[ . 1 . 2]" 1
1607 1 116 ALA MB 1 118 ALA HA . . 4.900 4.567 4.119 4.909 0.009 9 0 "[ . 1 . 2]" 1
1608 1 117 LYS H 1 117 LYS HA . . 2.860 2.328 2.175 2.925 0.065 13 0 "[ . 1 . 2]" 1
1609 1 117 LYS H 1 117 LYS HB3 . . 4.070 3.901 2.900 4.082 0.012 14 0 "[ . 1 . 2]" 1
1610 1 117 LYS H 1 117 LYS HD3 . . 4.570 3.463 2.592 4.622 0.052 19 0 "[ . 1 . 2]" 1
1611 1 117 LYS H 1 118 ALA H . . 3.140 2.700 1.674 3.101 . 0 0 "[ . 1 . 2]" 1
1612 1 117 LYS HA 1 117 LYS HD3 . . 4.490 4.083 3.584 4.571 0.081 19 0 "[ . 1 . 2]" 1
1613 1 117 LYS HA 1 118 ALA H . . 3.180 2.910 2.439 3.253 0.073 13 0 "[ . 1 . 2]" 1
1614 1 117 LYS HA 1 118 ALA MB . . 5.020 4.623 4.415 4.836 . 0 0 "[ . 1 . 2]" 1
1615 1 117 LYS HB3 1 118 ALA H . . 4.670 4.518 4.320 4.721 0.051 12 0 "[ . 1 . 2]" 1
1616 1 117 LYS HB3 1 118 ALA HA . . 4.900 5.037 4.423 6.016 1.116 9 3 "[ . +* - . 2]" 1
1617 1 118 ALA H 1 118 ALA MB . . 3.110 2.278 2.077 2.557 . 0 0 "[ . 1 . 2]" 1
1618 1 118 ALA H 1 119 SER H . . 4.930 4.582 4.485 4.683 . 0 0 "[ . 1 . 2]" 1
1619 1 118 ALA HA 1 119 SER H . . 3.130 2.591 2.194 2.755 . 0 0 "[ . 1 . 2]" 1
1620 1 118 ALA MB 1 119 SER H . . 3.140 2.271 2.048 2.854 . 0 0 "[ . 1 . 2]" 1
1621 1 118 ALA MB 1 119 SER HB3 . . 5.260 5.234 5.106 5.569 0.309 13 0 "[ . 1 . 2]" 1
1622 1 119 SER H 1 119 SER HB3 . . 3.300 3.563 3.423 3.671 0.371 4 0 "[ . 1 . 2]" 1
1623 1 119 SER H 1 120 ARG H . . 4.740 4.627 4.341 4.703 . 0 0 "[ . 1 . 2]" 1
1624 1 119 SER HA 1 120 ARG H . . 3.190 2.369 2.182 2.746 . 0 0 "[ . 1 . 2]" 1
1625 1 119 SER HA 1 120 ARG HG3 . . 4.240 3.881 3.317 4.308 0.068 10 0 "[ . 1 . 2]" 1
1626 1 119 SER HB3 1 120 ARG H . . 4.630 2.696 2.069 3.858 . 0 0 "[ . 1 . 2]" 1
1627 1 119 SER HB3 1 121 GLU H . . 3.850 3.890 3.338 4.193 0.343 14 0 "[ . 1 . 2]" 1
1628 1 120 ARG H 1 120 ARG HG3 . . 3.530 2.829 2.040 3.592 0.062 15 0 "[ . 1 . 2]" 1
1629 1 120 ARG H 1 121 GLU H . . 3.230 3.263 2.861 3.318 0.088 20 0 "[ . 1 . 2]" 1
1630 1 120 ARG H 1 121 GLU HG3 . . 5.500 5.976 4.948 6.656 1.156 5 13 "[ * *+ *-***** . ***2]" 1
1631 1 120 ARG HA 1 121 GLU H . . 3.500 2.368 2.072 2.679 . 0 0 "[ . 1 . 2]" 1
1632 1 120 ARG HB3 1 121 GLU H . . 4.680 4.390 4.191 4.601 . 0 0 "[ . 1 . 2]" 1
1633 1 121 GLU H 1 121 GLU HB3 . . 3.280 3.460 2.635 3.619 0.339 9 0 "[ . 1 . 2]" 1
1634 1 121 GLU H 1 121 GLU HG3 . . 3.870 3.503 1.817 3.906 0.036 7 0 "[ . 1 . 2]" 1
1635 1 121 GLU H 1 122 PRO HD3 . . 5.000 5.047 4.913 5.082 0.082 7 0 "[ . 1 . 2]" 1
1636 1 121 GLU HA 1 122 PRO HD3 . . 3.530 2.326 2.172 2.384 . 0 0 "[ . 1 . 2]" 1
1637 1 121 GLU HA 1 122 PRO HG3 . . 4.660 4.641 4.556 4.724 0.064 20 0 "[ . 1 . 2]" 1
1638 1 121 GLU HB3 1 122 PRO HD3 . . 4.860 3.398 3.003 4.169 . 0 0 "[ . 1 . 2]" 1
1639 1 122 PRO HA 1 123 LEU H . . 2.830 2.189 1.986 2.378 . 0 0 "[ . 1 . 2]" 1
1640 1 122 PRO HA 1 123 LEU HB3 . . 4.610 4.519 3.896 4.676 0.066 2 0 "[ . 1 . 2]" 1
1641 1 122 PRO HA 1 123 LEU MD1 . . 4.990 3.208 2.695 5.110 0.120 1 0 "[ . 1 . 2]" 1
1642 1 122 PRO HA 1 124 ILE H . . 5.250 3.730 3.236 5.302 0.052 1 0 "[ . 1 . 2]" 1
1643 1 122 PRO HA 1 124 ILE MD . . 5.460 2.769 2.295 4.081 . 0 0 "[ . 1 . 2]" 1
1644 1 122 PRO HB3 1 123 LEU H . . 4.010 3.974 3.656 4.095 0.085 12 0 "[ . 1 . 2]" 1
1645 1 123 LEU H 1 123 LEU HB3 . . 3.450 3.231 2.433 3.514 0.064 19 0 "[ . 1 . 2]" 1
1646 1 123 LEU H 1 123 LEU MD1 . . 3.620 2.006 1.678 3.489 . 0 0 "[ . 1 . 2]" 1
1647 1 123 LEU H 1 123 LEU MD2 . . 3.820 3.763 3.443 3.957 0.137 1 0 "[ . 1 . 2]" 1
1648 1 123 LEU H 1 124 ILE H . . 3.720 2.058 1.654 3.681 . 0 0 "[ . 1 . 2]" 1
1649 1 123 LEU H 1 124 ILE HA . . 4.710 4.271 4.027 4.679 . 0 0 "[ . 1 . 2]" 1
1650 1 123 LEU HA 1 123 LEU MD1 . . 3.240 3.368 3.352 3.372 0.132 11 0 "[ . 1 . 2]" 1
1651 1 123 LEU HA 1 123 LEU MD2 . . 3.610 3.592 2.069 3.713 0.103 4 0 "[ . 1 . 2]" 1
1652 1 123 LEU HA 1 124 ILE H . . 3.070 3.082 2.211 3.157 0.087 19 0 "[ . 1 . 2]" 1
1653 1 123 LEU HB3 1 123 LEU MD1 . . 2.980 2.507 2.146 2.854 . 0 0 "[ . 1 . 2]" 1
1654 1 123 LEU HB3 1 123 LEU MD2 . . 3.560 3.200 3.034 3.275 . 0 0 "[ . 1 . 2]" 1
1655 1 123 LEU HB3 1 123 LEU HG . . 2.920 2.289 2.225 2.556 . 0 0 "[ . 1 . 2]" 1
1656 1 123 LEU MD1 1 124 ILE H . . 3.760 2.801 2.602 3.716 . 0 0 "[ . 1 . 2]" 1
1657 1 123 LEU MD1 1 124 ILE HA . . 5.500 3.377 2.989 3.911 . 0 0 "[ . 1 . 2]" 1
1658 1 123 LEU MD1 1 125 ASP H . . 5.500 5.220 4.214 5.594 0.094 20 0 "[ . 1 . 2]" 1
1659 1 123 LEU MD2 1 124 ILE H . . 4.150 3.687 2.685 4.272 0.122 4 0 "[ . 1 . 2]" 1
1660 1 123 LEU MD2 1 125 ASP H . . 5.500 4.315 3.723 5.513 0.013 4 0 "[ . 1 . 2]" 1
1661 1 124 ILE H 1 124 ILE HA . . 2.860 2.850 2.757 2.931 0.071 1 0 "[ . 1 . 2]" 1
1662 1 124 ILE H 1 124 ILE HB . . 2.990 2.700 2.393 2.905 . 0 0 "[ . 1 . 2]" 1
1663 1 124 ILE H 1 124 ILE MD . . 4.070 1.812 1.618 2.477 . 0 0 "[ . 1 . 2]" 1
1664 1 124 ILE H 1 124 ILE HG13 . . 3.730 2.738 2.280 3.396 . 0 0 "[ . 1 . 2]" 1
1665 1 124 ILE H 1 124 ILE MG . . 3.690 3.768 3.706 3.796 0.106 9 0 "[ . 1 . 2]" 1
1666 1 124 ILE H 1 125 ASP H . . 4.690 4.540 4.381 4.677 . 0 0 "[ . 1 . 2]" 1
1667 1 124 ILE HA 1 124 ILE MD . . 3.750 3.587 2.634 3.843 0.093 11 0 "[ . 1 . 2]" 1
1668 1 124 ILE HA 1 124 ILE HG13 . . 3.740 2.713 2.416 3.850 0.110 4 0 "[ . 1 . 2]" 1
1669 1 124 ILE HA 1 124 ILE MG . . 3.130 2.329 2.228 2.505 . 0 0 "[ . 1 . 2]" 1
1670 1 124 ILE HA 1 125 ASP H . . 2.620 2.181 1.980 2.381 . 0 0 "[ . 1 . 2]" 1
1671 1 124 ILE HA 1 125 ASP HA . . 4.790 4.468 4.194 4.545 . 0 0 "[ . 1 . 2]" 1
1672 1 124 ILE HA 1 125 ASP HB3 . . 4.700 4.630 4.341 4.860 0.160 20 0 "[ . 1 . 2]" 1
1673 1 124 ILE HB 1 124 ILE MD . . 3.450 2.338 2.194 3.305 . 0 0 "[ . 1 . 2]" 1
1674 1 124 ILE HB 1 125 ASP H . . 3.710 3.732 3.173 3.799 0.089 15 0 "[ . 1 . 2]" 1
1675 1 124 ILE HG13 1 124 ILE MG . . 3.000 2.665 2.073 3.060 0.060 11 0 "[ . 1 . 2]" 1
1676 1 124 ILE HG13 1 125 ASP H . . 5.010 4.575 4.222 4.707 . 0 0 "[ . 1 . 2]" 1
1677 1 124 ILE MG 1 125 ASP H . . 3.470 2.266 1.825 2.420 . 0 0 "[ . 1 . 2]" 1
1678 1 124 ILE MG 1 125 ASP HA . . 4.620 3.763 3.384 4.317 . 0 0 "[ . 1 . 2]" 1
1679 1 124 ILE MG 1 125 ASP HB3 . . 5.060 4.517 3.528 5.010 . 0 0 "[ . 1 . 2]" 1
1680 1 124 ILE MG 1 126 MET HA . . 5.110 4.369 3.079 5.209 0.099 7 0 "[ . 1 . 2]" 1
1681 1 124 ILE MG 1 126 MET ME . . 4.310 3.930 2.621 4.436 0.126 9 0 "[ . 1 . 2]" 1
1682 1 125 ASP H 1 125 ASP HB3 . . 3.250 2.853 2.248 3.261 0.011 20 0 "[ . 1 . 2]" 1
1683 1 125 ASP HA 1 126 MET H . . 2.580 2.323 2.080 2.556 . 0 0 "[ . 1 . 2]" 1
1684 1 125 ASP HA 1 127 ALA H . . 4.130 3.906 2.857 4.218 0.088 9 0 "[ . 1 . 2]" 1
1685 1 125 ASP HA 1 127 ALA MB . . 5.500 4.938 3.770 5.585 0.085 13 0 "[ . 1 . 2]" 1
1686 1 125 ASP HB3 1 127 ALA H . . 4.730 3.716 2.945 4.791 0.061 7 0 "[ . 1 . 2]" 1
1687 1 126 MET H 1 126 MET HB3 . . 3.180 2.967 2.280 3.653 0.473 7 0 "[ . 1 . 2]" 1
1688 1 126 MET H 1 126 MET ME . . 4.730 4.098 1.914 4.828 0.098 7 0 "[ . 1 . 2]" 1
1689 1 126 MET H 1 127 ALA MB . . 5.500 3.848 3.196 4.994 . 0 0 "[ . 1 . 2]" 1
1690 1 126 MET HA 1 126 MET ME . . 4.360 3.671 2.053 4.392 0.032 19 0 "[ . 1 . 2]" 1
1691 1 126 MET HA 1 126 MET HG3 . . 4.050 2.801 2.112 4.103 0.053 12 0 "[ . 1 . 2]" 1
1692 1 126 MET HA 1 127 ALA MB . . 4.740 4.676 4.288 4.814 0.074 7 0 "[ . 1 . 2]" 1
1693 1 126 MET HA 1 128 VAL H . . 4.790 4.188 3.300 4.864 0.074 9 0 "[ . 1 . 2]" 1
1694 1 126 MET HB3 1 126 MET ME . . 2.450 3.123 2.034 3.727 1.277 3 14 "[**+*** * -* *** ** 2]" 1
1695 1 126 MET HB3 1 127 ALA H . . 4.570 4.035 3.544 4.592 0.022 19 0 "[ . 1 . 2]" 1
1696 1 126 MET ME 1 126 MET HG3 . . 3.770 2.894 2.329 3.472 . 0 0 "[ . 1 . 2]" 1
1697 1 127 ALA H 1 127 ALA HA . . 2.840 2.882 2.215 2.932 0.092 9 0 "[ . 1 . 2]" 1
1698 1 127 ALA H 1 127 ALA MB . . 3.160 2.428 2.170 2.808 . 0 0 "[ . 1 . 2]" 1
1699 1 127 ALA H 1 128 VAL H . . 3.630 3.184 2.485 3.708 0.078 18 0 "[ . 1 . 2]" 1
1700 1 127 ALA HA 1 128 VAL H . . 2.770 2.578 2.242 2.857 0.087 1 0 "[ . 1 . 2]" 1
1701 1 127 ALA MB 1 128 VAL H . . 3.620 3.669 3.587 3.725 0.105 14 0 "[ . 1 . 2]" 1
1702 1 127 ALA MB 1 128 VAL HA . . 4.730 4.351 4.181 4.491 . 0 0 "[ . 1 . 2]" 1
1703 1 128 VAL H 1 128 VAL HB . . 3.190 2.746 2.315 3.244 0.054 12 0 "[ . 1 . 2]" 1
1704 1 128 VAL H 1 128 VAL MG1 . . 4.220 3.433 1.920 4.001 . 0 0 "[ . 1 . 2]" 1
1705 1 128 VAL H 1 129 LYS H . . 4.400 4.408 4.068 4.492 0.092 1 0 "[ . 1 . 2]" 1
1706 1 128 VAL HA 1 128 VAL MG1 . . 3.260 2.615 2.213 3.290 0.030 20 0 "[ . 1 . 2]" 1
1707 1 128 VAL HA 1 129 LYS H . . 2.720 2.251 2.061 2.441 . 0 0 "[ . 1 . 2]" 1
1708 1 128 VAL HB 1 129 LYS H . . 4.150 3.991 3.666 4.234 0.084 19 0 "[ . 1 . 2]" 1
1709 1 128 VAL HB 1 130 TYR QE . . 5.240 3.823 2.325 5.278 0.038 2 0 "[ . 1 . 2]" 1
1710 1 128 VAL MG1 1 129 LYS H . . 3.980 2.796 2.110 3.765 . 0 0 "[ . 1 . 2]" 1
1711 1 128 VAL MG1 1 129 LYS HA . . 4.930 3.989 3.329 4.848 . 0 0 "[ . 1 . 2]" 1
1712 1 128 VAL MG1 1 130 TYR H . . 5.500 4.586 3.765 5.557 0.057 20 0 "[ . 1 . 2]" 1
1713 1 128 VAL MG1 1 130 TYR QE . . 4.970 2.880 2.114 5.094 0.124 20 0 "[ . 1 . 2]" 1
1714 1 129 LYS H 1 129 LYS HG3 . . 4.580 3.516 2.315 4.533 . 0 0 "[ . 1 . 2]" 1
1715 1 129 LYS H 1 130 TYR HA . . 5.310 4.907 4.194 5.392 0.082 20 0 "[ . 1 . 2]" 1
1716 1 129 LYS HA 1 129 LYS HG3 . . 3.890 3.171 2.246 4.107 0.217 5 0 "[ . 1 . 2]" 1
1717 1 129 LYS HA 1 130 TYR H . . 2.850 2.242 2.099 2.396 . 0 0 "[ . 1 . 2]" 1
1718 1 129 LYS HA 1 130 TYR QD . . 4.590 3.855 2.991 4.666 0.076 16 0 "[ . 1 . 2]" 1
1719 1 129 LYS HA 1 131 HIS HD2 . . 4.490 4.260 2.398 4.577 0.087 12 0 "[ . 1 . 2]" 1
1720 1 130 TYR H 1 130 TYR HB3 . . 3.590 3.567 3.207 3.669 0.079 6 0 "[ . 1 . 2]" 1
1721 1 130 TYR H 1 130 TYR QD . . 3.450 3.013 2.023 3.516 0.066 6 0 "[ . 1 . 2]" 1
1722 1 130 TYR HA 1 130 TYR QD . . 2.950 2.905 2.245 3.072 0.122 15 0 "[ . 1 . 2]" 1
1723 1 130 TYR HA 1 131 HIS H . . 3.220 2.472 2.058 3.287 0.067 9 0 "[ . 1 . 2]" 1
1724 1 130 TYR HA 1 131 HIS HD2 . . 5.500 4.788 3.782 5.578 0.078 9 0 "[ . 1 . 2]" 1
1725 1 130 TYR HB3 1 131 HIS H . . 4.920 3.813 2.142 4.486 . 0 0 "[ . 1 . 2]" 1
1726 1 130 TYR QD 1 131 HIS H . . 5.500 4.546 3.517 5.090 . 0 0 "[ . 1 . 2]" 1
1727 1 131 HIS H 1 132 THR H . . 4.280 4.159 2.369 4.355 0.075 19 0 "[ . 1 . 2]" 1
1728 1 131 HIS HA 1 131 HIS HB3 . . 2.830 2.420 2.270 2.628 . 0 0 "[ . 1 . 2]" 1
1729 1 131 HIS HA 1 132 THR H . . 3.100 2.485 2.061 3.159 0.059 4 0 "[ . 1 . 2]" 1
1730 1 131 HIS HA 1 132 THR MG . . 5.210 4.026 3.445 4.624 . 0 0 "[ . 1 . 2]" 1
1731 1 131 HIS HB3 1 132 THR H . . 4.360 3.099 2.008 4.372 0.012 4 0 "[ . 1 . 2]" 1
1732 1 131 HIS HB3 1 132 THR MG . . 5.500 4.765 3.191 5.771 0.271 15 0 "[ . 1 . 2]" 1
1733 1 132 THR H 1 132 THR MG . . 4.290 2.862 2.130 3.619 . 0 0 "[ . 1 . 2]" 1
1734 1 132 THR HA 1 132 THR HB . . 2.400 2.460 2.403 2.491 0.091 19 0 "[ . 1 . 2]" 1
1735 1 132 THR HA 1 132 THR MG . . 3.680 2.730 2.143 3.310 . 0 0 "[ . 1 . 2]" 1
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