NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
582944 |
2mvb   |
25259 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mvb
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 1725
_Distance_constraint_stats_list.Viol_count 4131
_Distance_constraint_stats_list.Viol_total 13856.996
_Distance_constraint_stats_list.Viol_max 1.774
_Distance_constraint_stats_list.Viol_rms 0.1017
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0201
_Distance_constraint_stats_list.Viol_average_violations_only 0.1677
_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 PRO 0.008 0.008 15 0 "[ . 1 . 2]"
1 3 ALA 0.008 0.008 15 0 "[ . 1 . 2]"
1 4 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 THR 0.035 0.035 12 0 "[ . 1 . 2]"
1 9 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 THR 0.430 0.072 1 0 "[ . 1 . 2]"
1 11 LEU 0.430 0.072 1 0 "[ . 1 . 2]"
1 14 ALA 0.250 0.075 13 0 "[ . 1 . 2]"
1 15 LEU 0.250 0.075 13 0 "[ . 1 . 2]"
1 16 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 VAL 0.344 0.210 7 0 "[ . 1 . 2]"
1 18 ILE 1.787 0.149 15 0 "[ . 1 . 2]"
1 19 GLU 1.251 0.109 20 0 "[ . 1 . 2]"
1 20 ASN 2.065 0.103 4 0 "[ . 1 . 2]"
1 21 ALA 1.046 0.103 4 0 "[ . 1 . 2]"
1 22 GLU 0.922 0.093 10 0 "[ . 1 . 2]"
1 23 LYS 3.374 0.579 11 1 "[ . 1+ . 2]"
1 24 ASN 0.158 0.080 3 0 "[ . 1 . 2]"
1 25 THR 2.457 0.105 18 0 "[ . 1 . 2]"
1 26 VAL 3.078 0.105 18 0 "[ . 1 . 2]"
1 27 VAL 2.881 0.107 5 0 "[ . 1 . 2]"
1 28 THR 1.817 0.108 12 0 "[ . 1 . 2]"
1 29 LYS 13.935 0.923 20 14 "[****. ***1 * ***-* +]"
1 30 THR 4.595 0.289 13 0 "[ . 1 . 2]"
1 31 LEU 8.408 0.753 5 3 "[ + * 1 .- 2]"
1 32 VAL 9.369 0.919 18 5 "[ .*** 1 - . + 2]"
1 33 LEU 27.825 1.232 13 20 [************+*-*****]
1 34 PRO 26.171 1.232 13 20 [************+*-*****]
1 35 LYS 15.969 1.732 17 9 "[*- . ** 1*** .*+ 2]"
1 36 SER 0.473 0.086 6 0 "[ . 1 . 2]"
1 37 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ASP 0.602 0.119 18 0 "[ . 1 . 2]"
1 39 GLY 5.820 1.036 13 6 "[*- . * 1 *+ . * 2]"
1 40 SER 29.204 1.732 17 17 "[** ***-*********+ *2]"
1 41 GLN 6.546 0.579 17 1 "[ . 1 . + 2]"
1 42 GLN 26.847 1.011 15 12 "[ -***** ** + * **]"
1 43 THR 11.047 1.011 15 7 "[ *-* ** + *2]"
1 44 GLN 7.210 0.753 5 3 "[ + * 1 .- 2]"
1 45 THR 3.480 0.098 14 0 "[ . 1 . 2]"
1 46 ILE 23.926 0.970 4 17 "[***+** ***-***** * *]"
1 47 THR 4.645 0.235 20 0 "[ . 1 . 2]"
1 48 TYR 24.641 1.386 7 16 "[******+**1 * ***-* *]"
1 49 LYS 4.498 0.250 7 0 "[ . 1 . 2]"
1 50 ASP 2.965 0.250 7 0 "[ . 1 . 2]"
1 51 LYS 11.095 0.892 13 4 "[- . * 1 + . *]"
1 52 THR 9.932 0.684 16 4 "[ * *. 1 .+ - 2]"
1 53 PHE 25.834 1.112 1 13 "[+* *.** *** ** *-*]"
1 54 LEU 6.263 0.359 5 0 "[ . 1 . 2]"
1 55 SER 0.477 0.230 17 0 "[ . 1 . 2]"
1 56 LEU 3.484 0.098 13 0 "[ . 1 . 2]"
1 57 ALA 0.745 0.121 11 0 "[ . 1 . 2]"
1 58 ILE 7.595 0.706 14 3 "[ - * +. 2]"
1 59 GLN 16.381 0.925 5 10 "[ ** +** -1 * * **]"
1 60 GLN 16.723 1.327 2 9 "[ +*-* * **** 2]"
1 61 LYS 8.730 1.068 19 5 "[ *. * 1 -* +2]"
1 62 ARG 24.674 1.360 12 15 "[** *-******+ ** **2]"
1 63 PRO 4.555 0.750 18 3 "[ - 1 * . + 2]"
1 64 VAL 2.464 0.088 5 0 "[ . 1 . 2]"
1 65 SER 2.132 0.203 5 0 "[ . 1 . 2]"
1 66 ASP 5.479 0.284 13 0 "[ . 1 . 2]"
1 67 GLU 1.826 0.249 4 0 "[ . 1 . 2]"
1 68 LEU 4.117 0.403 17 0 "[ . 1 . 2]"
1 69 LYS 2.001 0.092 2 0 "[ . 1 . 2]"
1 70 THR 1.909 0.112 11 0 "[ . 1 . 2]"
1 71 TYR 22.110 1.554 11 20 [*******-**+*********]
1 72 ILE 5.527 0.351 14 0 "[ . 1 . 2]"
1 73 ASP 4.100 0.292 5 0 "[ . 1 . 2]"
1 74 GLN 6.808 0.311 13 0 "[ . 1 . 2]"
1 75 HIS 26.528 1.554 11 20 [*******-**+*********]
1 76 GLY 3.327 0.095 11 0 "[ . 1 . 2]"
1 77 VAL 0.987 0.081 13 0 "[ . 1 . 2]"
1 78 GLU 3.847 0.753 1 5 "[+* .** 1 - . 2]"
1 79 GLU 7.268 0.753 1 5 "[+* .** 1 - . 2]"
1 80 THR 1.555 0.351 14 0 "[ . 1 . 2]"
1 81 GLN 3.622 0.102 10 0 "[ . 1 . 2]"
1 82 LYS 5.056 0.271 8 0 "[ . 1 . 2]"
1 83 ALA 2.568 0.241 8 0 "[ . 1 . 2]"
1 84 LEU 2.976 0.298 4 0 "[ . 1 . 2]"
1 85 LEU 28.396 1.424 14 17 "[******* ***-*+* ** *]"
1 86 GLU 7.965 0.241 8 0 "[ . 1 . 2]"
1 87 ALA 0.862 0.081 20 0 "[ . 1 . 2]"
1 88 GLU 47.400 1.424 14 17 "[******- *****+* ** *]"
1 89 GLU 10.701 0.654 17 7 "[- **. 1* ** + 2]"
1 90 LYS 12.290 1.113 20 8 "[ **** * 1-* . +]"
1 91 ASP 4.791 1.113 20 3 "[ * . 1 . - +]"
1 92 LYS 0.777 0.100 16 0 "[ . 1 . 2]"
1 93 SER 1.986 0.100 16 0 "[ . 1 . 2]"
1 94 ILE 2.832 0.096 20 0 "[ . 1 . 2]"
1 95 ILE 2.326 0.095 4 0 "[ . 1 . 2]"
1 96 GLU 6.614 1.225 15 4 "[ . -* 1 +* 2]"
1 97 ALA 2.467 0.363 15 0 "[ . 1 . 2]"
1 98 ARG 10.435 0.753 2 8 "[ + *. -* .*** *]"
1 99 LYS 5.797 1.225 15 4 "[ . -* 1 +* 2]"
1 100 LEU 2.331 0.109 14 0 "[ . 1 . 2]"
1 101 ALA 3.192 0.121 9 0 "[ . 1 . 2]"
1 102 GLY 3.115 0.100 4 0 "[ . 1 . 2]"
1 103 PHE 30.814 0.753 2 15 "[ +******-* * .*****]"
1 104 LYS 0.821 0.260 1 0 "[ . 1 . 2]"
1 105 LEU 9.990 0.649 5 3 "[ - + 1 . *2]"
1 106 GLU 2.313 0.115 16 0 "[ . 1 . 2]"
1 107 THR 1.214 0.088 15 0 "[ . 1 . 2]"
1 108 LYS 1.542 0.096 14 0 "[ . 1 . 2]"
1 109 LEU 23.881 0.734 10 19 "[******** +*-********]"
1 110 LEU 22.971 0.737 1 20 [+*********-*********]
1 111 SER 3.950 0.699 8 2 "[ . + 1 . -2]"
1 112 ALA 3.486 0.699 8 2 "[ . + 1 . -2]"
1 113 THR 1.903 0.555 14 1 "[ . 1 +. 2]"
1 114 GLU 7.840 0.737 1 5 "[+* * *1 -. 2]"
1 115 LEU 29.767 1.164 1 20 [+**********-********]
1 116 GLN 22.371 1.164 1 20 [+******-************]
1 117 THR 2.673 0.115 16 0 "[ . 1 . 2]"
1 118 THR 14.575 1.327 2 5 "[ + . -* .* *]"
1 119 THR 1.232 0.102 1 0 "[ . 1 . 2]"
1 120 SER 1.647 0.114 10 0 "[ . 1 . 2]"
1 121 PHE 6.999 0.646 10 1 "[ . + . 2]"
1 122 ASP 0.375 0.072 18 0 "[ . 1 . 2]"
1 123 PHE 3.668 0.890 5 2 "[ + 1 . - 2]"
1 124 GLN 5.895 0.890 5 2 "[ + 1 . * 2]"
1 125 VAL 3.963 0.567 5 1 "[ + 1 . 2]"
1 126 LEU 10.659 0.617 6 10 "[ * .+***1 * .** -*]"
1 127 ASP 2.127 0.098 12 0 "[ . 1 . 2]"
1 128 VAL 1.313 0.104 8 0 "[ . 1 . 2]"
1 129 LYS 1.336 0.104 9 0 "[ . 1 . 2]"
1 130 LYS 2.215 0.092 14 0 "[ . 1 . 2]"
1 131 ALA 2.539 0.107 1 0 "[ . 1 . 2]"
1 132 SER 8.733 1.273 12 7 "[ ** * *- + . *2]"
1 133 GLN 5.528 0.405 5 0 "[ . 1 . 2]"
1 134 LEU 4.496 0.134 20 0 "[ . 1 . 2]"
1 135 GLU 0.256 0.098 8 0 "[ . 1 . 2]"
1 136 HIS 4.208 0.503 3 1 "[ + . 1 . 2]"
1 137 LEU 4.577 0.503 3 1 "[ + . 1 . 2]"
1 138 LYS 5.459 0.436 2 0 "[ . 1 . 2]"
1 139 ASN 7.540 0.436 2 0 "[ . 1 . 2]"
1 140 ILE 3.892 0.300 4 0 "[ . 1 . 2]"
1 141 GLY 1.695 0.078 3 0 "[ . 1 . 2]"
1 142 LEU 9.494 1.273 12 6 "[ -* * *1 + . *2]"
1 143 GLU 0.995 0.500 11 0 "[ . 1 . 2]"
1 144 ASN 0.071 0.042 9 0 "[ . 1 . 2]"
1 145 LEU 4.288 0.366 20 0 "[ . 1 . 2]"
1 146 LEU 2.554 0.331 14 0 "[ . 1 . 2]"
1 147 LYS 1.662 0.091 6 0 "[ . 1 . 2]"
1 148 ASN 24.491 1.489 7 11 "[** *.*+ *** ** -2]"
1 149 GLU 7.492 0.693 19 3 "[ * . 1 -. +2]"
1 150 PRO 9.993 0.892 13 7 "[-* . * 1 +*. **]"
1 151 SER 8.952 1.386 7 7 "[ - **+ 1 *. * *]"
1 152 LYS 0.954 0.133 2 0 "[ . 1 . 2]"
1 153 TYR 33.402 1.489 7 19 "[******+*******-* ***]"
1 154 ILE 1.996 0.117 18 0 "[ . 1 . 2]"
1 155 SER 23.830 1.774 2 15 "[*+* * *** **-*** **]"
1 156 ASP 2.473 0.911 17 1 "[ . 1 . + 2]"
1 157 ARG 10.753 0.659 13 3 "[ .- 1 + . *2]"
1 158 LEU 20.996 1.774 2 15 "[*+* * *** **-*** **]"
1 159 ALA 31.634 1.537 18 19 "[ ****************+-*]"
1 160 ASN 44.180 1.537 18 19 "[ ****************+-*]"
1 161 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 162 ALA 1.115 0.103 18 0 "[ . 1 . 2]"
1 163 THR 3.436 0.112 10 0 "[ . 1 . 2]"
1 164 GLU 15.809 1.015 3 16 "[ *+*-***** ** .*****]"
1 165 GLN 32.108 1.015 3 16 "[ *+******* ** .-****]"
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 PRO HA 1 3 ALA H . . 2.600 2.468 2.173 2.608 0.008 15 0 "[ . 1 . 2]" 1
2 1 4 THR H 1 5 LYS H . . 5.500 4.317 3.721 4.583 . 0 0 "[ . 1 . 2]" 1
3 1 6 THR HA 1 6 THR HB . . 2.720 2.569 2.380 2.755 0.035 12 0 "[ . 1 . 2]" 1
4 1 9 ASP H 1 10 THR H . . 4.950 4.357 3.775 4.607 . 0 0 "[ . 1 . 2]" 1
5 1 10 THR H 1 11 LEU H . . 3.920 3.492 2.227 3.992 0.072 1 0 "[ . 1 . 2]" 1
6 1 10 THR HA 1 11 LEU H . . 3.550 2.290 2.151 2.626 . 0 0 "[ . 1 . 2]" 1
7 1 14 ALA H 1 15 LEU H . . 4.440 4.304 3.531 4.515 0.075 13 0 "[ . 1 . 2]" 1
8 1 14 ALA HA 1 15 LEU H . . 3.320 2.591 2.192 2.986 . 0 0 "[ . 1 . 2]" 1
9 1 14 ALA MB 1 15 LEU H . . 4.800 2.382 1.914 3.763 . 0 0 "[ . 1 . 2]" 1
10 1 15 LEU H 1 15 LEU MD1 . . 5.440 3.731 2.451 4.427 . 0 0 "[ . 1 . 2]" 1
11 1 15 LEU HA 1 16 PRO HD3 . . 3.220 2.539 2.428 2.639 . 0 0 "[ . 1 . 2]" 1
12 1 16 PRO HA 1 17 VAL H . . 2.910 2.436 2.195 2.678 . 0 0 "[ . 1 . 2]" 1
13 1 17 VAL H 1 17 VAL MG1 . . 4.140 2.972 1.887 3.966 . 0 0 "[ . 1 . 2]" 1
14 1 17 VAL H 1 17 VAL MG2 . . 3.870 2.761 1.936 4.080 0.210 7 0 "[ . 1 . 2]" 1
15 1 17 VAL HA 1 17 VAL MG1 . . 3.690 2.594 2.288 3.288 . 0 0 "[ . 1 . 2]" 1
16 1 17 VAL HA 1 18 ILE H . . 2.920 2.514 2.168 2.858 . 0 0 "[ . 1 . 2]" 1
17 1 17 VAL HB 1 18 ILE H . . 4.560 3.242 1.923 4.522 . 0 0 "[ . 1 . 2]" 1
18 1 18 ILE H 1 18 ILE HB . . 3.600 3.235 2.537 3.692 0.092 11 0 "[ . 1 . 2]" 1
19 1 18 ILE H 1 18 ILE HG13 . . 4.770 3.392 1.956 4.617 . 0 0 "[ . 1 . 2]" 1
20 1 18 ILE H 1 18 ILE MG . . 4.360 3.190 2.004 3.977 . 0 0 "[ . 1 . 2]" 1
21 1 18 ILE H 1 19 GLU H . . 4.470 4.330 3.163 4.549 0.079 8 0 "[ . 1 . 2]" 1
22 1 18 ILE HA 1 18 ILE HG13 . . 4.140 3.407 2.404 4.289 0.149 15 0 "[ . 1 . 2]" 1
23 1 18 ILE HA 1 18 ILE MG . . 3.710 2.463 2.169 3.284 . 0 0 "[ . 1 . 2]" 1
24 1 18 ILE HA 1 19 GLU H . . 3.040 2.392 2.196 2.642 . 0 0 "[ . 1 . 2]" 1
25 1 18 ILE MD 1 19 GLU HA . . 5.500 4.876 2.725 5.594 0.094 10 0 "[ . 1 . 2]" 1
26 1 18 ILE MG 1 19 GLU H . . 4.730 3.231 2.016 4.044 . 0 0 "[ . 1 . 2]" 1
27 1 18 ILE MG 1 19 GLU HA . . 5.430 4.489 3.119 5.539 0.109 20 0 "[ . 1 . 2]" 1
28 1 19 GLU H 1 19 GLU HB3 . . 4.140 3.352 2.841 3.924 . 0 0 "[ . 1 . 2]" 1
29 1 20 ASN H 1 20 ASN HA . . 2.880 2.896 2.765 2.955 0.075 1 0 "[ . 1 . 2]" 1
30 1 20 ASN H 1 21 ALA H . . 4.450 4.212 3.817 4.512 0.062 10 0 "[ . 1 . 2]" 1
31 1 20 ASN HA 1 20 ASN HD21 . . 2.410 2.311 1.892 2.498 0.088 1 0 "[ . 1 . 2]" 1
32 1 20 ASN HA 1 21 ALA H . . 2.730 2.403 2.119 2.807 0.077 6 0 "[ . 1 . 2]" 1
33 1 20 ASN HD21 1 21 ALA MB . . 5.500 5.151 4.544 5.603 0.103 4 0 "[ . 1 . 2]" 1
34 1 21 ALA HA 1 22 GLU H . . 3.210 2.487 2.117 3.272 0.062 18 0 "[ . 1 . 2]" 1
35 1 21 ALA MB 1 22 GLU H . . 4.560 2.605 2.037 3.713 . 0 0 "[ . 1 . 2]" 1
36 1 21 ALA MB 1 23 LYS H . . 4.420 3.908 3.031 4.484 0.064 5 0 "[ . 1 . 2]" 1
37 1 22 GLU H 1 23 LYS H . . 3.870 3.707 2.772 3.963 0.093 10 0 "[ . 1 . 2]" 1
38 1 22 GLU HA 1 23 LYS H . . 3.200 2.439 2.027 3.290 0.090 18 0 "[ . 1 . 2]" 1
39 1 23 LYS H 1 23 LYS HB3 . . 3.420 3.260 2.541 3.999 0.579 11 1 "[ . 1+ . 2]" 1
40 1 23 LYS H 1 24 ASN H . . 5.080 4.222 3.174 4.651 . 0 0 "[ . 1 . 2]" 1
41 1 23 LYS HB3 1 24 ASN H . . 5.500 3.464 2.042 4.678 . 0 0 "[ . 1 . 2]" 1
42 1 24 ASN H 1 25 THR H . . 4.980 4.354 2.817 4.716 . 0 0 "[ . 1 . 2]" 1
43 1 24 ASN HD21 1 25 THR H . . 5.500 4.593 3.248 5.580 0.080 3 0 "[ . 1 . 2]" 1
44 1 25 THR H 1 26 VAL H . . 4.440 4.441 4.220 4.523 0.083 6 0 "[ . 1 . 2]" 1
45 1 25 THR HA 1 25 THR HB . . 2.710 2.624 2.412 2.801 0.091 6 0 "[ . 1 . 2]" 1
46 1 25 THR HA 1 25 THR MG . . 3.220 2.508 2.092 3.282 0.062 9 0 "[ . 1 . 2]" 1
47 1 25 THR HA 1 26 VAL H . . 2.610 2.243 2.044 2.530 . 0 0 "[ . 1 . 2]" 1
48 1 25 THR HA 1 26 VAL HB . . 4.750 4.600 4.238 4.810 0.060 17 0 "[ . 1 . 2]" 1
49 1 25 THR HB 1 26 VAL H . . 3.810 3.486 2.309 3.871 0.061 17 0 "[ . 1 . 2]" 1
50 1 25 THR HB 1 27 VAL QG . . 5.120 4.065 2.660 5.086 . 0 0 "[ . 1 . 2]" 1
51 1 25 THR MG 1 26 VAL H . . 3.600 3.400 2.626 3.705 0.105 18 0 "[ . 1 . 2]" 1
52 1 25 THR MG 1 27 VAL QG . . 4.720 3.821 2.147 4.711 . 0 0 "[ . 1 . 2]" 1
53 1 26 VAL H 1 26 VAL HB . . 3.000 2.737 2.374 3.088 0.088 12 0 "[ . 1 . 2]" 1
54 1 26 VAL H 1 26 VAL QG . . 3.120 2.430 1.914 3.069 . 0 0 "[ . 1 . 2]" 1
55 1 26 VAL H 1 27 VAL H . . 4.680 4.327 4.003 4.618 . 0 0 "[ . 1 . 2]" 1
56 1 26 VAL HA 1 26 VAL QG . . 3.210 2.225 2.113 2.418 . 0 0 "[ . 1 . 2]" 1
57 1 26 VAL HA 1 27 VAL H . . 2.780 2.220 2.130 2.327 . 0 0 "[ . 1 . 2]" 1
58 1 26 VAL HA 1 48 TYR H . . 4.590 4.528 4.076 4.676 0.086 12 0 "[ . 1 . 2]" 1
59 1 26 VAL HA 1 49 LYS HB3 . . 4.080 2.427 2.058 4.014 . 0 0 "[ . 1 . 2]" 1
60 1 26 VAL HB 1 27 VAL H . . 4.500 4.273 3.860 4.573 0.073 5 0 "[ . 1 . 2]" 1
61 1 26 VAL QG 1 47 THR MG . . 2.880 2.084 1.827 2.419 . 0 0 "[ . 1 . 2]" 1
62 1 26 VAL QG 1 48 TYR H . . 4.370 3.553 2.778 4.308 . 0 0 "[ . 1 . 2]" 1
63 1 27 VAL H 1 27 VAL HB . . 3.500 3.051 2.318 3.590 0.090 4 0 "[ . 1 . 2]" 1
64 1 27 VAL H 1 27 VAL QG . . 3.350 2.317 1.967 2.801 . 0 0 "[ . 1 . 2]" 1
65 1 27 VAL H 1 28 THR H . . 4.890 4.389 4.064 4.602 . 0 0 "[ . 1 . 2]" 1
66 1 27 VAL H 1 28 THR HA . . 5.500 4.995 4.590 5.400 . 0 0 "[ . 1 . 2]" 1
67 1 27 VAL H 1 47 THR HA . . 5.500 4.663 4.189 5.174 . 0 0 "[ . 1 . 2]" 1
68 1 27 VAL H 1 47 THR MG . . 3.940 3.878 3.533 4.047 0.107 5 0 "[ . 1 . 2]" 1
69 1 27 VAL H 1 48 TYR H . . 3.650 3.056 2.770 3.484 . 0 0 "[ . 1 . 2]" 1
70 1 27 VAL H 1 49 LYS HA . . 4.750 3.307 2.855 4.123 . 0 0 "[ . 1 . 2]" 1
71 1 27 VAL H 1 49 LYS HB3 . . 5.500 3.584 2.819 5.414 . 0 0 "[ . 1 . 2]" 1
72 1 27 VAL HA 1 27 VAL QG . . 3.100 2.201 2.083 2.310 . 0 0 "[ . 1 . 2]" 1
73 1 27 VAL HA 1 28 THR H . . 2.670 2.328 2.137 2.574 . 0 0 "[ . 1 . 2]" 1
74 1 27 VAL HA 1 28 THR HA . . 5.210 4.520 4.459 4.630 . 0 0 "[ . 1 . 2]" 1
75 1 27 VAL HB 1 28 THR H . . 4.730 3.153 2.137 4.479 . 0 0 "[ . 1 . 2]" 1
76 1 27 VAL HB 1 48 TYR H . . 4.420 3.850 2.962 4.518 0.098 9 0 "[ . 1 . 2]" 1
77 1 27 VAL HB 1 48 TYR QE . . 4.640 4.013 3.302 4.724 0.084 10 0 "[ . 1 . 2]" 1
78 1 27 VAL QG 1 28 THR H . . 3.300 2.795 2.086 3.216 . 0 0 "[ . 1 . 2]" 1
79 1 27 VAL QG 1 28 THR HA . . 4.460 3.650 3.133 3.952 . 0 0 "[ . 1 . 2]" 1
80 1 27 VAL QG 1 28 THR HB . . 5.380 4.797 4.519 5.177 . 0 0 "[ . 1 . 2]" 1
81 1 27 VAL QG 1 29 LYS H . . 4.500 3.884 2.691 4.470 . 0 0 "[ . 1 . 2]" 1
82 1 27 VAL QG 1 47 THR HA . . 4.850 4.082 3.492 4.646 . 0 0 "[ . 1 . 2]" 1
83 1 27 VAL QG 1 48 TYR H . . 4.080 3.044 2.174 3.887 . 0 0 "[ . 1 . 2]" 1
84 1 27 VAL QG 1 48 TYR QD . . 4.310 3.017 2.687 3.340 . 0 0 "[ . 1 . 2]" 1
85 1 27 VAL QG 1 48 TYR QE . . 3.670 2.598 2.293 2.798 . 0 0 "[ . 1 . 2]" 1
86 1 27 VAL QG 1 49 LYS HA . . 4.270 2.959 2.352 3.692 . 0 0 "[ . 1 . 2]" 1
87 1 28 THR H 1 28 THR HB . . 3.250 2.916 2.499 3.337 0.087 12 0 "[ . 1 . 2]" 1
88 1 28 THR H 1 28 THR MG . . 4.050 3.844 2.614 4.014 . 0 0 "[ . 1 . 2]" 1
89 1 28 THR H 1 29 LYS H . . 4.910 4.011 3.645 4.517 . 0 0 "[ . 1 . 2]" 1
90 1 28 THR H 1 47 THR HA . . 5.500 4.787 4.281 5.077 . 0 0 "[ . 1 . 2]" 1
91 1 28 THR H 1 48 TYR H . . 5.500 4.948 4.631 5.205 . 0 0 "[ . 1 . 2]" 1
92 1 28 THR HA 1 28 THR MG . . 3.180 2.355 2.163 3.270 0.090 12 0 "[ . 1 . 2]" 1
93 1 28 THR HA 1 29 LYS H . . 2.920 2.243 2.149 2.339 . 0 0 "[ . 1 . 2]" 1
94 1 28 THR HA 1 47 THR HA . . 3.250 2.416 2.058 2.906 . 0 0 "[ . 1 . 2]" 1
95 1 28 THR HA 1 47 THR MG . . 3.840 3.520 2.756 3.920 0.080 7 0 "[ . 1 . 2]" 1
96 1 28 THR HA 1 48 TYR H . . 4.160 3.763 3.059 4.224 0.064 3 0 "[ . 1 . 2]" 1
97 1 28 THR HB 1 29 LYS H . . 4.490 4.205 3.579 4.530 0.040 4 0 "[ . 1 . 2]" 1
98 1 28 THR MG 1 29 LYS H . . 3.470 3.220 2.461 3.561 0.091 7 0 "[ . 1 . 2]" 1
99 1 28 THR MG 1 29 LYS HA . . 4.760 4.378 3.825 4.852 0.092 13 0 "[ . 1 . 2]" 1
100 1 28 THR MG 1 46 ILE H . . 5.040 3.692 3.050 4.787 . 0 0 "[ . 1 . 2]" 1
101 1 28 THR MG 1 47 THR HA . . 4.320 3.463 2.302 4.061 . 0 0 "[ . 1 . 2]" 1
102 1 28 THR MG 1 47 THR HB . . 5.090 4.885 3.978 5.198 0.108 12 0 "[ . 1 . 2]" 1
103 1 29 LYS H 1 29 LYS HG3 . . 4.640 4.464 3.271 4.742 0.102 5 0 "[ . 1 . 2]" 1
104 1 29 LYS H 1 30 THR H . . 4.490 4.504 4.303 4.571 0.081 7 0 "[ . 1 . 2]" 1
105 1 29 LYS H 1 45 THR HA . . 5.400 4.786 4.309 5.247 . 0 0 "[ . 1 . 2]" 1
106 1 29 LYS H 1 45 THR MG . . 4.990 4.033 3.205 5.053 0.063 14 0 "[ . 1 . 2]" 1
107 1 29 LYS H 1 46 ILE H . . 3.920 2.944 2.525 3.305 . 0 0 "[ . 1 . 2]" 1
108 1 29 LYS H 1 46 ILE HB . . 4.470 3.323 2.798 3.996 . 0 0 "[ . 1 . 2]" 1
109 1 29 LYS H 1 46 ILE MG . . 4.900 4.134 3.617 4.717 . 0 0 "[ . 1 . 2]" 1
110 1 29 LYS H 1 47 THR H . . 5.500 4.800 4.272 5.010 . 0 0 "[ . 1 . 2]" 1
111 1 29 LYS H 1 47 THR HA . . 4.260 3.588 3.168 3.842 . 0 0 "[ . 1 . 2]" 1
112 1 29 LYS H 1 48 TYR QE . . 5.500 4.149 3.218 5.171 . 0 0 "[ . 1 . 2]" 1
113 1 29 LYS HA 1 29 LYS HG3 . . 3.920 2.605 2.294 2.968 . 0 0 "[ . 1 . 2]" 1
114 1 29 LYS HA 1 30 THR H . . 2.730 2.376 2.177 2.561 . 0 0 "[ . 1 . 2]" 1
115 1 29 LYS HA 1 30 THR HB . . 4.810 4.398 4.135 4.722 . 0 0 "[ . 1 . 2]" 1
116 1 29 LYS HA 1 154 ILE MD . . 5.300 4.892 4.407 5.390 0.090 14 0 "[ . 1 . 2]" 1
117 1 29 LYS HG3 1 30 THR H . . 4.970 3.033 2.331 4.355 . 0 0 "[ . 1 . 2]" 1
118 1 29 LYS HG3 1 48 TYR QE . . 3.870 4.438 3.471 4.793 0.923 20 14 "[****. ***1 * ***-* +]" 1
119 1 30 THR H 1 30 THR HB . . 3.250 2.793 2.496 3.325 0.075 15 0 "[ . 1 . 2]" 1
120 1 30 THR H 1 30 THR MG . . 4.210 3.838 2.299 3.989 . 0 0 "[ . 1 . 2]" 1
121 1 30 THR H 1 31 LEU H . . 5.060 4.148 3.427 4.435 . 0 0 "[ . 1 . 2]" 1
122 1 30 THR H 1 165 GLN H . . 4.780 3.616 2.810 4.613 . 0 0 "[ . 1 . 2]" 1
123 1 30 THR HA 1 30 THR MG . . 3.130 2.484 2.238 3.199 0.069 15 0 "[ . 1 . 2]" 1
124 1 30 THR HA 1 31 LEU H . . 2.880 2.208 1.983 2.358 . 0 0 "[ . 1 . 2]" 1
125 1 30 THR HA 1 31 LEU HG . . 5.190 4.672 3.604 5.290 0.100 12 0 "[ . 1 . 2]" 1
126 1 30 THR HB 1 31 LEU H . . 4.860 4.243 3.828 4.548 . 0 0 "[ . 1 . 2]" 1
127 1 30 THR HB 1 165 GLN H . . 4.220 3.591 2.625 4.307 0.087 15 0 "[ . 1 . 2]" 1
128 1 30 THR HB 1 165 GLN HB3 . . 3.850 3.251 2.345 3.946 0.096 15 0 "[ . 1 . 2]" 1
129 1 30 THR HB 1 165 GLN HE21 . . 5.500 4.746 3.270 5.587 0.087 16 0 "[ . 1 . 2]" 1
130 1 30 THR MG 1 31 LEU H . . 3.550 2.978 2.350 3.666 0.116 15 0 "[ . 1 . 2]" 1
131 1 30 THR MG 1 165 GLN H . . 4.500 4.120 1.522 4.602 0.102 1 0 "[ . 1 . 2]" 1
132 1 30 THR MG 1 165 GLN HB3 . . 3.580 3.223 2.142 3.869 0.289 13 0 "[ . 1 . 2]" 1
133 1 30 THR MG 1 165 GLN HE21 . . 5.380 3.670 1.790 5.151 . 0 0 "[ . 1 . 2]" 1
134 1 30 THR MG 1 165 GLN HE22 . . 5.500 4.316 2.977 5.569 0.069 8 0 "[ . 1 . 2]" 1
135 1 31 LEU H 1 31 LEU HB3 . . 3.580 3.592 2.862 3.807 0.227 14 0 "[ . 1 . 2]" 1
136 1 31 LEU H 1 31 LEU QD . . 4.460 3.016 2.062 3.646 . 0 0 "[ . 1 . 2]" 1
137 1 31 LEU H 1 31 LEU HG . . 3.740 3.420 2.774 3.854 0.114 13 0 "[ . 1 . 2]" 1
138 1 31 LEU H 1 43 THR MG . . 4.100 3.230 2.396 3.929 . 0 0 "[ . 1 . 2]" 1
139 1 31 LEU H 1 44 GLN H . . 3.760 2.923 2.476 3.555 . 0 0 "[ . 1 . 2]" 1
140 1 31 LEU H 1 46 ILE MD . . 4.590 4.134 3.547 4.670 0.080 20 0 "[ . 1 . 2]" 1
141 1 31 LEU HA 1 31 LEU QD . . 3.030 2.159 2.014 2.808 . 0 0 "[ . 1 . 2]" 1
142 1 31 LEU HA 1 32 VAL H . . 2.810 2.184 2.037 2.526 . 0 0 "[ . 1 . 2]" 1
143 1 31 LEU HA 1 32 VAL HA . . 4.900 4.470 4.254 4.671 . 0 0 "[ . 1 . 2]" 1
144 1 31 LEU HA 1 32 VAL HB . . 4.770 4.595 4.170 4.828 0.058 20 0 "[ . 1 . 2]" 1
145 1 31 LEU HA 1 32 VAL QG . . 4.270 3.471 2.869 3.778 . 0 0 "[ . 1 . 2]" 1
146 1 31 LEU HA 1 162 ALA MB . . 5.370 4.493 3.796 5.128 . 0 0 "[ . 1 . 2]" 1
147 1 31 LEU HA 1 163 THR H . . 4.830 4.524 4.194 4.886 0.056 8 0 "[ . 1 . 2]" 1
148 1 31 LEU HA 1 164 GLU H . . 5.300 4.818 4.442 5.140 . 0 0 "[ . 1 . 2]" 1
149 1 31 LEU HA 1 164 GLU HA . . 3.380 2.378 1.965 2.770 . 0 0 "[ . 1 . 2]" 1
150 1 31 LEU HA 1 165 GLN H . . 4.110 3.913 3.384 4.186 0.076 7 0 "[ . 1 . 2]" 1
151 1 31 LEU HB3 1 32 VAL H . . 4.610 3.100 2.312 3.738 . 0 0 "[ . 1 . 2]" 1
152 1 31 LEU HB3 1 44 GLN H . . 4.280 4.376 3.493 5.033 0.753 5 3 "[ + * 1 .- 2]" 1
153 1 31 LEU QD 1 32 VAL H . . 3.910 3.363 2.455 3.619 . 0 0 "[ . 1 . 2]" 1
154 1 31 LEU QD 1 154 ILE HA . . 3.430 2.640 2.057 3.240 . 0 0 "[ . 1 . 2]" 1
155 1 31 LEU QD 1 157 ARG HB3 . . 4.480 2.643 2.088 3.902 . 0 0 "[ . 1 . 2]" 1
156 1 31 LEU QD 1 158 LEU HA . . 4.990 4.427 3.516 4.973 . 0 0 "[ . 1 . 2]" 1
157 1 31 LEU QD 1 163 THR H . . 4.610 4.137 2.738 4.580 . 0 0 "[ . 1 . 2]" 1
158 1 31 LEU QD 1 163 THR HA . . 4.640 4.333 3.502 4.670 0.030 17 0 "[ . 1 . 2]" 1
159 1 31 LEU QD 1 164 GLU HA . . 3.460 2.548 2.045 3.398 . 0 0 "[ . 1 . 2]" 1
160 1 31 LEU QD 1 164 GLU HG3 . . 4.210 3.294 2.478 4.126 . 0 0 "[ . 1 . 2]" 1
161 1 32 VAL H 1 32 VAL HB . . 3.230 2.591 2.437 2.898 . 0 0 "[ . 1 . 2]" 1
162 1 32 VAL H 1 32 VAL QG . . 3.230 2.456 2.081 2.928 . 0 0 "[ . 1 . 2]" 1
163 1 32 VAL H 1 33 LEU H . . 5.060 4.024 3.471 4.221 . 0 0 "[ . 1 . 2]" 1
164 1 32 VAL H 1 33 LEU QD . . 4.950 4.259 3.485 4.900 . 0 0 "[ . 1 . 2]" 1
165 1 32 VAL H 1 162 ALA MB . . 4.380 3.635 2.510 4.461 0.081 1 0 "[ . 1 . 2]" 1
166 1 32 VAL H 1 163 THR H . . 3.710 2.940 2.364 3.510 . 0 0 "[ . 1 . 2]" 1
167 1 32 VAL H 1 163 THR HB . . 5.500 4.292 3.223 5.085 . 0 0 "[ . 1 . 2]" 1
168 1 32 VAL H 1 164 GLU H . . 5.500 4.480 3.949 4.817 . 0 0 "[ . 1 . 2]" 1
169 1 32 VAL H 1 164 GLU HA . . 4.080 3.235 2.069 3.667 . 0 0 "[ . 1 . 2]" 1
170 1 32 VAL H 1 165 GLN H . . 5.500 4.930 4.126 5.522 0.022 5 0 "[ . 1 . 2]" 1
171 1 32 VAL HA 1 32 VAL QG . . 3.030 2.148 2.100 2.195 . 0 0 "[ . 1 . 2]" 1
172 1 32 VAL HA 1 33 LEU H . . 2.920 2.264 2.180 2.350 . 0 0 "[ . 1 . 2]" 1
173 1 32 VAL HA 1 43 THR HA . . 3.230 2.992 2.612 3.309 0.079 17 0 "[ . 1 . 2]" 1
174 1 32 VAL HA 1 43 THR MG . . 3.930 2.569 2.163 4.001 0.071 8 0 "[ . 1 . 2]" 1
175 1 32 VAL HA 1 44 GLN H . . 4.410 4.232 3.857 4.477 0.067 8 0 "[ . 1 . 2]" 1
176 1 32 VAL HB 1 163 THR H . . 4.590 2.929 2.581 3.518 . 0 0 "[ . 1 . 2]" 1
177 1 32 VAL HB 1 163 THR HA . . 4.690 4.668 4.377 4.769 0.079 19 0 "[ . 1 . 2]" 1
178 1 32 VAL HB 1 163 THR HB . . 3.900 3.152 2.223 3.975 0.075 15 0 "[ . 1 . 2]" 1
179 1 32 VAL QG 1 33 LEU H . . 3.700 3.360 3.030 3.576 . 0 0 "[ . 1 . 2]" 1
180 1 32 VAL QG 1 41 GLN QE . . 3.750 3.118 2.429 3.514 . 0 0 "[ . 1 . 2]" 1
181 1 32 VAL QG 1 43 THR HA . . 4.060 3.995 3.702 4.162 0.102 17 0 "[ . 1 . 2]" 1
182 1 32 VAL QG 1 43 THR HB . . 5.500 4.960 4.457 5.603 0.103 11 0 "[ . 1 . 2]" 1
183 1 32 VAL QG 1 44 GLN H . . 5.120 4.782 4.477 5.048 . 0 0 "[ . 1 . 2]" 1
184 1 32 VAL QG 1 163 THR HB . . 4.780 3.434 2.787 4.119 . 0 0 "[ . 1 . 2]" 1
185 1 32 VAL QG 1 165 GLN H . . 4.990 4.001 2.880 4.642 . 0 0 "[ . 1 . 2]" 1
186 1 32 VAL QG 1 165 GLN HB3 . . 3.820 3.972 2.061 4.739 0.919 18 5 "[ .*** 1 - . + 2]" 1
187 1 32 VAL QG 1 165 GLN HE21 . . 5.410 3.994 2.263 4.809 . 0 0 "[ . 1 . 2]" 1
188 1 32 VAL QG 1 165 GLN HE22 . . 5.260 4.595 3.332 5.528 0.268 1 0 "[ . 1 . 2]" 1
189 1 33 LEU H 1 33 LEU HB3 . . 3.480 3.524 3.451 3.575 0.095 13 0 "[ . 1 . 2]" 1
190 1 33 LEU H 1 33 LEU QD . . 3.590 2.732 2.097 3.352 . 0 0 "[ . 1 . 2]" 1
191 1 33 LEU H 1 43 THR HA . . 3.880 2.685 2.245 3.217 . 0 0 "[ . 1 . 2]" 1
192 1 33 LEU H 1 43 THR MG . . 4.870 3.821 3.341 4.851 . 0 0 "[ . 1 . 2]" 1
193 1 33 LEU H 1 44 GLN H . . 5.060 4.157 3.197 4.734 . 0 0 "[ . 1 . 2]" 1
194 1 33 LEU H 1 162 ALA MB . . 5.500 4.086 3.440 4.478 . 0 0 "[ . 1 . 2]" 1
195 1 33 LEU HA 1 33 LEU QD . . 3.350 2.069 1.972 2.266 . 0 0 "[ . 1 . 2]" 1
196 1 33 LEU HA 1 33 LEU HG . . 3.810 3.416 2.840 3.781 . 0 0 "[ . 1 . 2]" 1
197 1 33 LEU HA 1 34 PRO HD3 . . 3.590 2.424 2.235 2.574 . 0 0 "[ . 1 . 2]" 1
198 1 33 LEU HA 1 162 ALA HA . . 3.890 2.971 2.535 3.511 . 0 0 "[ . 1 . 2]" 1
199 1 33 LEU HA 1 162 ALA MB . . 3.490 2.322 2.046 2.600 . 0 0 "[ . 1 . 2]" 1
200 1 33 LEU HA 1 163 THR H . . 4.410 3.857 3.449 4.152 . 0 0 "[ . 1 . 2]" 1
201 1 33 LEU HB3 1 34 PRO HD3 . . 3.380 3.706 3.561 3.893 0.513 15 1 "[ . 1 + 2]" 1
202 1 33 LEU HB3 1 42 GLN H . . 4.860 4.647 4.020 4.949 0.089 13 0 "[ . 1 . 2]" 1
203 1 33 LEU QD 1 34 PRO HD3 . . 4.200 3.165 2.795 3.908 . 0 0 "[ . 1 . 2]" 1
204 1 33 LEU QD 1 42 GLN HE21 . . 5.100 3.350 2.595 4.244 . 0 0 "[ . 1 . 2]" 1
205 1 33 LEU QD 1 43 THR H . . 5.290 4.406 3.413 5.124 . 0 0 "[ . 1 . 2]" 1
206 1 33 LEU QD 1 43 THR HA . . 4.300 3.294 2.183 4.270 . 0 0 "[ . 1 . 2]" 1
207 1 33 LEU QD 1 44 GLN HE21 . . 4.500 3.014 2.150 3.962 . 0 0 "[ . 1 . 2]" 1
208 1 33 LEU QD 1 44 GLN HE22 . . 4.610 3.198 2.176 3.880 . 0 0 "[ . 1 . 2]" 1
209 1 33 LEU QD 1 157 ARG HA . . 5.110 3.991 2.953 4.633 . 0 0 "[ . 1 . 2]" 1
210 1 33 LEU QD 1 162 ALA HA . . 4.230 3.833 3.267 4.241 0.011 11 0 "[ . 1 . 2]" 1
211 1 33 LEU QD 1 162 ALA MB . . 3.190 2.142 1.936 2.583 . 0 0 "[ . 1 . 2]" 1
212 1 33 LEU QD 1 163 THR H . . 5.440 4.248 3.780 5.041 . 0 0 "[ . 1 . 2]" 1
213 1 33 LEU HG 1 34 PRO HD3 . . 4.350 5.330 5.059 5.582 1.232 13 20 [************+*-*****] 1
214 1 33 LEU HG 1 43 THR HA . . 4.970 4.389 2.765 5.036 0.066 8 0 "[ . 1 . 2]" 1
215 1 34 PRO HA 1 35 LYS H . . 2.660 2.497 2.181 2.726 0.066 1 0 "[ . 1 . 2]" 1
216 1 34 PRO HA 1 41 GLN QE . . 4.150 2.894 2.043 4.022 . 0 0 "[ . 1 . 2]" 1
217 1 34 PRO HB3 1 35 LYS H . . 4.020 3.455 3.282 3.832 . 0 0 "[ . 1 . 2]" 1
218 1 34 PRO HD3 1 162 ALA HA . . 4.330 2.326 2.091 2.480 . 0 0 "[ . 1 . 2]" 1
219 1 34 PRO HD3 1 162 ALA MB . . 4.880 2.631 2.094 3.316 . 0 0 "[ . 1 . 2]" 1
220 1 34 PRO HG3 1 35 LYS H . . 5.500 5.108 4.672 5.423 . 0 0 "[ . 1 . 2]" 1
221 1 34 PRO HG3 1 162 ALA HA . . 5.230 4.256 3.821 4.576 . 0 0 "[ . 1 . 2]" 1
222 1 35 LYS H 1 35 LYS HG3 . . 3.890 3.118 2.013 3.938 0.048 14 0 "[ . 1 . 2]" 1
223 1 35 LYS H 1 41 GLN QE . . 4.620 3.355 2.891 4.007 . 0 0 "[ . 1 . 2]" 1
224 1 35 LYS HA 1 36 SER H . . 2.630 2.269 2.032 2.435 . 0 0 "[ . 1 . 2]" 1
225 1 35 LYS HA 1 41 GLN HA . . 3.530 2.858 2.256 3.401 . 0 0 "[ . 1 . 2]" 1
226 1 35 LYS HA 1 42 GLN H . . 5.100 4.591 4.152 4.991 . 0 0 "[ . 1 . 2]" 1
227 1 35 LYS HG3 1 36 SER H . . 4.500 4.261 3.403 4.586 0.086 6 0 "[ . 1 . 2]" 1
228 1 35 LYS HG3 1 39 GLY QA . . 5.490 5.366 3.807 6.526 1.036 13 6 "[*- . * 1 *+ . * 2]" 1
229 1 35 LYS HG3 1 40 SER H . . 5.500 5.870 4.608 7.232 1.732 17 8 "[** . * 1*-* .*+ 2]" 1
230 1 36 SER H 1 39 GLY H . . 4.770 4.064 3.342 4.826 0.056 9 0 "[ . 1 . 2]" 1
231 1 36 SER H 1 40 SER H . . 4.030 3.308 2.397 4.094 0.064 7 0 "[ . 1 . 2]" 1
232 1 37 ASP H 1 38 ASP H . . 4.650 3.353 2.552 3.815 . 0 0 "[ . 1 . 2]" 1
233 1 38 ASP H 1 38 ASP HB3 . . 3.610 3.223 2.467 3.729 0.119 18 0 "[ . 1 . 2]" 1
234 1 38 ASP H 1 39 GLY H . . 3.450 2.921 1.899 3.540 0.090 1 0 "[ . 1 . 2]" 1
235 1 38 ASP H 1 39 GLY QA . . 5.500 4.400 3.860 4.981 . 0 0 "[ . 1 . 2]" 1
236 1 38 ASP H 1 40 SER H . . 4.330 3.589 2.932 4.423 0.093 8 0 "[ . 1 . 2]" 1
237 1 38 ASP HA 1 39 GLY QA . . 5.000 3.994 3.502 4.350 . 0 0 "[ . 1 . 2]" 1
238 1 38 ASP HB3 1 39 GLY H . . 5.190 4.152 3.216 4.515 . 0 0 "[ . 1 . 2]" 1
239 1 39 GLY H 1 40 SER H . . 3.180 2.576 1.762 3.123 . 0 0 "[ . 1 . 2]" 1
240 1 39 GLY H 1 40 SER HA . . 5.500 5.068 4.111 5.556 0.056 16 0 "[ . 1 . 2]" 1
241 1 39 GLY QA 1 63 PRO HG3 . . 5.030 3.667 2.574 4.647 . 0 0 "[ . 1 . 2]" 1
242 1 40 SER H 1 41 GLN H . . 4.300 4.365 4.120 4.392 0.092 19 0 "[ . 1 . 2]" 1
243 1 40 SER HA 1 41 GLN H . . 2.750 2.223 2.038 2.352 . 0 0 "[ . 1 . 2]" 1
244 1 40 SER HA 1 41 GLN HB3 . . 4.490 4.661 4.533 4.888 0.398 9 0 "[ . 1 . 2]" 1
245 1 40 SER HA 1 60 GLN HE21 . . 5.500 4.693 3.800 5.582 0.082 17 0 "[ . 1 . 2]" 1
246 1 40 SER HA 1 60 GLN HE22 . . 5.500 4.563 3.124 5.587 0.087 6 0 "[ . 1 . 2]" 1
247 1 40 SER HA 1 61 LYS H . . 5.130 4.661 4.095 5.091 . 0 0 "[ . 1 . 2]" 1
248 1 40 SER HA 1 62 ARG HG3 . . 4.140 4.738 3.360 5.500 1.360 12 14 "[** ***-****+ ** *2]" 1
249 1 40 SER HB3 1 41 GLN H . . 4.140 3.562 2.940 4.218 0.078 5 0 "[ . 1 . 2]" 1
250 1 41 GLN H 1 41 GLN HB3 . . 3.710 2.864 2.582 3.164 . 0 0 "[ . 1 . 2]" 1
251 1 41 GLN H 1 41 GLN HG3 . . 4.740 4.552 3.237 4.740 . 0 0 "[ . 1 . 2]" 1
252 1 41 GLN H 1 42 GLN H . . 4.350 4.319 3.744 4.430 0.080 8 0 "[ . 1 . 2]" 1
253 1 41 GLN H 1 60 GLN HA . . 5.370 5.042 4.608 5.443 0.073 5 0 "[ . 1 . 2]" 1
254 1 41 GLN H 1 60 GLN HE21 . . 4.880 3.827 2.923 5.459 0.579 17 1 "[ . 1 . + 2]" 1
255 1 41 GLN H 1 60 GLN HE22 . . 5.390 4.044 2.559 5.428 0.038 13 0 "[ . 1 . 2]" 1
256 1 41 GLN H 1 61 LYS H . . 3.730 3.227 2.916 3.765 0.035 5 0 "[ . 1 . 2]" 1
257 1 41 GLN H 1 61 LYS HB3 . . 4.620 3.598 3.032 4.266 . 0 0 "[ . 1 . 2]" 1
258 1 41 GLN HA 1 41 GLN QE . . 5.500 3.976 3.142 4.557 . 0 0 "[ . 1 . 2]" 1
259 1 41 GLN HA 1 41 GLN HG3 . . 3.650 2.503 2.236 3.714 0.064 20 0 "[ . 1 . 2]" 1
260 1 41 GLN HA 1 42 GLN H . . 2.720 2.394 2.114 2.631 . 0 0 "[ . 1 . 2]" 1
261 1 41 GLN HA 1 42 GLN HE22 . . 5.500 3.287 2.493 5.379 . 0 0 "[ . 1 . 2]" 1
262 1 41 GLN QE 1 42 GLN H . . 5.500 3.955 2.424 5.133 . 0 0 "[ . 1 . 2]" 1
263 1 41 GLN QE 1 42 GLN HE22 . . 5.500 4.632 3.415 5.385 . 0 0 "[ . 1 . 2]" 1
264 1 41 GLN HG3 1 42 GLN H . . 4.010 2.385 1.770 3.307 . 0 0 "[ . 1 . 2]" 1
265 1 42 GLN H 1 42 GLN HB3 . . 3.590 3.360 2.622 3.809 0.219 18 0 "[ . 1 . 2]" 1
266 1 42 GLN H 1 42 GLN HE22 . . 5.500 3.133 2.540 5.127 . 0 0 "[ . 1 . 2]" 1
267 1 42 GLN HA 1 42 GLN HE21 . . 5.500 4.388 3.912 5.122 . 0 0 "[ . 1 . 2]" 1
268 1 42 GLN HA 1 42 GLN HG3 . . 3.850 4.158 2.536 4.291 0.441 10 0 "[ . 1 . 2]" 1
269 1 42 GLN HA 1 43 THR H . . 2.740 2.416 2.239 2.543 . 0 0 "[ . 1 . 2]" 1
270 1 42 GLN HA 1 43 THR HB . . 5.240 4.758 4.297 5.208 . 0 0 "[ . 1 . 2]" 1
271 1 42 GLN HA 1 60 GLN HA . . 3.180 2.549 2.011 3.182 0.002 5 0 "[ . 1 . 2]" 1
272 1 42 GLN HA 1 61 LYS H . . 3.950 3.468 3.001 3.769 . 0 0 "[ . 1 . 2]" 1
273 1 42 GLN HB3 1 42 GLN HE21 . . 4.470 3.945 3.232 4.275 . 0 0 "[ . 1 . 2]" 1
274 1 42 GLN HB3 1 42 GLN HE22 . . 5.150 4.476 3.990 4.905 . 0 0 "[ . 1 . 2]" 1
275 1 42 GLN HG3 1 43 THR H . . 3.970 4.339 3.064 4.981 1.011 15 7 "[ *-* ** + *2]" 1
276 1 42 GLN HG3 1 58 ILE MG . . 4.030 3.399 2.933 3.985 . 0 0 "[ . 1 . 2]" 1
277 1 42 GLN HG3 1 59 GLN H . . 5.310 5.779 5.036 6.235 0.925 5 10 "[ -* +** *1 * * **]" 1
278 1 43 THR H 1 43 THR HB . . 3.620 2.872 2.616 3.253 . 0 0 "[ . 1 . 2]" 1
279 1 43 THR H 1 43 THR MG . . 4.260 3.961 3.883 4.074 . 0 0 "[ . 1 . 2]" 1
280 1 43 THR H 1 44 GLN H . . 4.980 4.409 4.003 4.521 . 0 0 "[ . 1 . 2]" 1
281 1 43 THR H 1 59 GLN H . . 3.980 2.849 2.573 3.481 . 0 0 "[ . 1 . 2]" 1
282 1 43 THR H 1 59 GLN HB3 . . 4.940 3.212 2.021 4.321 . 0 0 "[ . 1 . 2]" 1
283 1 43 THR H 1 60 GLN H . . 4.780 4.631 4.268 4.857 0.077 11 0 "[ . 1 . 2]" 1
284 1 43 THR H 1 60 GLN HA . . 3.930 3.951 3.603 4.024 0.094 1 0 "[ . 1 . 2]" 1
285 1 43 THR HA 1 43 THR MG . . 3.180 2.390 2.222 2.646 . 0 0 "[ . 1 . 2]" 1
286 1 43 THR HA 1 44 GLN H . . 2.910 2.496 2.161 2.891 . 0 0 "[ . 1 . 2]" 1
287 1 43 THR HB 1 44 GLN H . . 4.260 3.538 3.035 4.327 0.067 20 0 "[ . 1 . 2]" 1
288 1 43 THR HB 1 59 GLN H . . 4.900 3.379 2.281 4.178 . 0 0 "[ . 1 . 2]" 1
289 1 43 THR HB 1 59 GLN HB3 . . 3.830 3.252 2.288 3.877 0.047 5 0 "[ . 1 . 2]" 1
290 1 43 THR HB 1 59 GLN HE21 . . 5.500 3.764 2.141 5.571 0.071 1 0 "[ . 1 . 2]" 1
291 1 43 THR HB 1 59 GLN HG3 . . 4.880 3.700 2.390 4.529 . 0 0 "[ . 1 . 2]" 1
292 1 43 THR MG 1 44 GLN H . . 3.490 2.241 1.864 3.161 . 0 0 "[ . 1 . 2]" 1
293 1 43 THR MG 1 44 GLN HA . . 5.160 4.172 3.309 4.540 . 0 0 "[ . 1 . 2]" 1
294 1 43 THR MG 1 59 GLN HE21 . . 5.500 4.017 2.386 5.614 0.114 7 0 "[ . 1 . 2]" 1
295 1 44 GLN H 1 44 GLN HG3 . . 4.570 3.624 3.137 4.249 . 0 0 "[ . 1 . 2]" 1
296 1 44 GLN HA 1 44 GLN HG3 . . 4.000 2.932 2.199 3.430 . 0 0 "[ . 1 . 2]" 1
297 1 44 GLN HA 1 45 THR H . . 2.980 2.165 2.059 2.310 . 0 0 "[ . 1 . 2]" 1
298 1 44 GLN HA 1 45 THR HB . . 5.350 4.933 4.434 5.418 0.068 20 0 "[ . 1 . 2]" 1
299 1 44 GLN HA 1 56 LEU QD . . 4.360 3.780 3.121 4.388 0.028 10 0 "[ . 1 . 2]" 1
300 1 44 GLN HA 1 58 ILE HA . . 3.460 2.486 2.227 3.025 . 0 0 "[ . 1 . 2]" 1
301 1 44 GLN HA 1 58 ILE MG . . 4.680 3.830 3.315 4.351 . 0 0 "[ . 1 . 2]" 1
302 1 44 GLN HA 1 59 GLN H . . 4.180 3.356 2.853 4.173 . 0 0 "[ . 1 . 2]" 1
303 1 44 GLN HE21 1 58 ILE MD . . 4.590 3.850 2.989 5.018 0.428 14 0 "[ . 1 . 2]" 1
304 1 44 GLN HE21 1 58 ILE HG13 . . 5.500 5.196 3.613 5.803 0.303 14 0 "[ . 1 . 2]" 1
305 1 44 GLN HE21 1 58 ILE MG . . 4.750 3.767 1.960 5.138 0.388 14 0 "[ . 1 . 2]" 1
306 1 44 GLN HE22 1 58 ILE MD . . 4.940 4.225 2.808 5.035 0.095 13 0 "[ . 1 . 2]" 1
307 1 44 GLN HG3 1 58 ILE HA . . 4.730 3.834 2.701 4.799 0.069 1 0 "[ . 1 . 2]" 1
308 1 45 THR H 1 45 THR HB . . 3.550 2.835 2.332 3.474 . 0 0 "[ . 1 . 2]" 1
309 1 45 THR H 1 45 THR MG . . 4.510 3.726 2.702 3.926 . 0 0 "[ . 1 . 2]" 1
310 1 45 THR H 1 46 ILE H . . 4.740 4.516 4.327 4.683 . 0 0 "[ . 1 . 2]" 1
311 1 45 THR H 1 46 ILE HA . . 5.500 5.139 4.720 5.455 . 0 0 "[ . 1 . 2]" 1
312 1 45 THR H 1 56 LEU HA . . 4.810 4.701 4.403 4.890 0.080 10 0 "[ . 1 . 2]" 1
313 1 45 THR H 1 56 LEU QD . . 4.180 3.460 2.724 4.169 . 0 0 "[ . 1 . 2]" 1
314 1 45 THR H 1 57 ALA H . . 3.790 2.962 2.664 3.303 . 0 0 "[ . 1 . 2]" 1
315 1 45 THR H 1 57 ALA MB . . 4.530 3.305 2.789 3.682 . 0 0 "[ . 1 . 2]" 1
316 1 45 THR H 1 58 ILE HA . . 4.550 3.590 3.330 4.100 . 0 0 "[ . 1 . 2]" 1
317 1 45 THR H 1 59 GLN H . . 4.380 4.391 4.001 4.467 0.087 4 0 "[ . 1 . 2]" 1
318 1 45 THR HA 1 45 THR MG . . 3.110 2.306 2.128 3.207 0.097 14 0 "[ . 1 . 2]" 1
319 1 45 THR HA 1 46 ILE H . . 2.960 2.266 2.153 2.393 . 0 0 "[ . 1 . 2]" 1
320 1 45 THR HA 1 46 ILE HA . . 5.220 4.501 4.403 4.574 . 0 0 "[ . 1 . 2]" 1
321 1 45 THR HA 1 46 ILE HB . . 4.700 4.487 4.075 4.757 0.057 14 0 "[ . 1 . 2]" 1
322 1 45 THR HA 1 46 ILE MD . . 4.550 4.403 3.525 4.648 0.098 14 0 "[ . 1 . 2]" 1
323 1 45 THR HB 1 46 ILE H . . 4.840 3.742 2.970 4.225 . 0 0 "[ . 1 . 2]" 1
324 1 45 THR HB 1 47 THR H . . 5.000 4.964 4.276 5.095 0.095 14 0 "[ . 1 . 2]" 1
325 1 45 THR HB 1 57 ALA H . . 4.360 2.888 2.364 3.687 . 0 0 "[ . 1 . 2]" 1
326 1 45 THR HB 1 57 ALA MB . . 2.960 2.285 1.970 2.818 . 0 0 "[ . 1 . 2]" 1
327 1 45 THR MG 1 46 ILE H . . 3.610 2.655 2.174 3.234 . 0 0 "[ . 1 . 2]" 1
328 1 46 ILE H 1 46 ILE HB . . 3.380 2.711 2.433 2.965 . 0 0 "[ . 1 . 2]" 1
329 1 46 ILE H 1 46 ILE MD . . 4.030 3.821 2.886 4.094 0.064 11 0 "[ . 1 . 2]" 1
330 1 46 ILE H 1 46 ILE HG13 . . 4.520 2.993 2.664 3.503 . 0 0 "[ . 1 . 2]" 1
331 1 46 ILE H 1 46 ILE MG . . 4.400 3.897 3.782 3.974 . 0 0 "[ . 1 . 2]" 1
332 1 46 ILE H 1 47 THR H . . 4.920 3.909 3.143 4.232 . 0 0 "[ . 1 . 2]" 1
333 1 46 ILE HA 1 46 ILE MD . . 4.320 3.921 3.545 4.020 . 0 0 "[ . 1 . 2]" 1
334 1 46 ILE HA 1 46 ILE HG13 . . 4.130 2.990 2.279 3.262 . 0 0 "[ . 1 . 2]" 1
335 1 46 ILE HA 1 46 ILE MG . . 3.280 2.387 2.267 2.534 . 0 0 "[ . 1 . 2]" 1
336 1 46 ILE HA 1 47 THR H . . 2.960 2.209 2.109 2.297 . 0 0 "[ . 1 . 2]" 1
337 1 46 ILE HA 1 47 THR HB . . 4.990 4.769 4.432 5.066 0.076 18 0 "[ . 1 . 2]" 1
338 1 46 ILE HA 1 56 LEU HA . . 3.580 2.990 2.363 3.663 0.083 14 0 "[ . 1 . 2]" 1
339 1 46 ILE HA 1 56 LEU QD . . 3.910 3.090 2.545 3.748 . 0 0 "[ . 1 . 2]" 1
340 1 46 ILE HB 1 46 ILE MD . . 3.250 2.303 2.148 2.462 . 0 0 "[ . 1 . 2]" 1
341 1 46 ILE HB 1 47 THR H . . 4.730 4.444 4.132 4.593 . 0 0 "[ . 1 . 2]" 1
342 1 46 ILE HB 1 48 TYR QD . . 4.240 3.906 3.307 4.337 0.097 15 0 "[ . 1 . 2]" 1
343 1 46 ILE HB 1 48 TYR QE . . 5.470 4.116 3.458 4.709 . 0 0 "[ . 1 . 2]" 1
344 1 46 ILE MD 1 53 PHE QE . . 4.660 3.533 2.944 4.734 0.074 19 0 "[ . 1 . 2]" 1
345 1 46 ILE MD 1 153 TYR QD . . 3.850 3.893 3.634 3.969 0.119 8 0 "[ . 1 . 2]" 1
346 1 46 ILE MD 1 153 TYR QE . . 3.150 2.231 2.061 2.717 . 0 0 "[ . 1 . 2]" 1
347 1 46 ILE MD 1 154 ILE HA . . 4.770 3.799 3.375 4.250 . 0 0 "[ . 1 . 2]" 1
348 1 46 ILE MD 1 154 ILE MD . . 3.340 2.307 2.043 3.019 . 0 0 "[ . 1 . 2]" 1
349 1 46 ILE HG13 1 47 THR H . . 5.180 5.054 4.413 5.241 0.061 1 0 "[ . 1 . 2]" 1
350 1 46 ILE HG13 1 53 PHE QD . . 5.500 5.625 4.391 6.390 0.890 10 5 "[ * *. +- . *]" 1
351 1 46 ILE HG13 1 153 TYR QE . . 3.840 4.554 3.633 4.810 0.970 4 17 "[***+** *******-* * *]" 1
352 1 46 ILE MG 1 47 THR H . . 3.590 3.342 2.616 3.696 0.106 14 0 "[ . 1 . 2]" 1
353 1 46 ILE MG 1 47 THR HA . . 4.760 4.180 3.499 4.506 . 0 0 "[ . 1 . 2]" 1
354 1 46 ILE MG 1 48 TYR HB3 . . 4.110 3.362 2.815 3.757 . 0 0 "[ . 1 . 2]" 1
355 1 46 ILE MG 1 48 TYR QD . . 2.890 2.358 2.051 2.745 . 0 0 "[ . 1 . 2]" 1
356 1 46 ILE MG 1 48 TYR QE . . 4.100 3.481 2.654 4.182 0.082 7 0 "[ . 1 . 2]" 1
357 1 46 ILE MG 1 53 PHE HA . . 5.220 3.823 3.146 4.240 . 0 0 "[ . 1 . 2]" 1
358 1 46 ILE MG 1 53 PHE QD . . 3.060 2.584 2.163 3.129 0.069 20 0 "[ . 1 . 2]" 1
359 1 47 THR H 1 47 THR HB . . 3.670 2.620 2.330 2.949 . 0 0 "[ . 1 . 2]" 1
360 1 47 THR H 1 48 TYR H . . 5.190 4.583 4.453 4.725 . 0 0 "[ . 1 . 2]" 1
361 1 47 THR H 1 48 TYR QD . . 4.930 4.720 4.161 5.018 0.088 9 0 "[ . 1 . 2]" 1
362 1 47 THR H 1 56 LEU HA . . 4.250 3.503 3.090 4.104 . 0 0 "[ . 1 . 2]" 1
363 1 47 THR H 1 56 LEU QD . . 5.040 4.463 4.001 4.932 . 0 0 "[ . 1 . 2]" 1
364 1 47 THR HA 1 47 THR MG . . 3.320 2.335 2.137 2.542 . 0 0 "[ . 1 . 2]" 1
365 1 47 THR HA 1 48 TYR H . . 2.930 2.292 2.144 2.418 . 0 0 "[ . 1 . 2]" 1
366 1 47 THR HA 1 48 TYR QD . . 4.550 3.836 3.194 4.372 . 0 0 "[ . 1 . 2]" 1
367 1 47 THR HB 1 48 TYR H . . 4.210 4.133 3.777 4.288 0.078 20 0 "[ . 1 . 2]" 1
368 1 47 THR HB 1 54 LEU HB3 . . 4.780 3.887 2.581 5.015 0.235 20 0 "[ . 1 . 2]" 1
369 1 47 THR HB 1 54 LEU QD . . 4.340 3.988 3.401 4.322 . 0 0 "[ . 1 . 2]" 1
370 1 47 THR HB 1 55 SER H . . 3.600 2.541 2.027 3.292 . 0 0 "[ . 1 . 2]" 1
371 1 47 THR HB 1 55 SER HA . . 4.970 4.568 4.056 5.024 0.054 20 0 "[ . 1 . 2]" 1
372 1 47 THR MG 1 48 TYR H . . 3.570 2.800 2.441 3.110 . 0 0 "[ . 1 . 2]" 1
373 1 47 THR MG 1 54 LEU HB3 . . 5.090 3.494 2.871 4.329 . 0 0 "[ . 1 . 2]" 1
374 1 47 THR MG 1 55 SER H . . 5.230 3.842 3.323 4.447 . 0 0 "[ . 1 . 2]" 1
375 1 48 TYR H 1 48 TYR QD . . 3.450 3.085 2.589 3.516 0.066 14 0 "[ . 1 . 2]" 1
376 1 48 TYR H 1 48 TYR QE . . 4.960 4.659 4.215 4.978 0.018 4 0 "[ . 1 . 2]" 1
377 1 48 TYR H 1 49 LYS H . . 5.220 4.375 4.293 4.481 . 0 0 "[ . 1 . 2]" 1
378 1 48 TYR H 1 49 LYS HA . . 5.480 4.666 4.484 5.043 . 0 0 "[ . 1 . 2]" 1
379 1 48 TYR H 1 54 LEU QD . . 5.500 3.685 3.225 4.586 . 0 0 "[ . 1 . 2]" 1
380 1 48 TYR H 1 54 LEU HG . . 5.500 5.328 4.589 5.578 0.078 4 0 "[ . 1 . 2]" 1
381 1 48 TYR HA 1 49 LYS H . . 3.160 2.474 2.346 2.619 . 0 0 "[ . 1 . 2]" 1
382 1 48 TYR HA 1 52 THR H . . 5.500 4.763 4.380 5.203 . 0 0 "[ . 1 . 2]" 1
383 1 48 TYR HA 1 53 PHE HA . . 4.550 3.977 3.190 4.421 . 0 0 "[ . 1 . 2]" 1
384 1 48 TYR HA 1 54 LEU H . . 3.320 2.622 2.179 2.943 . 0 0 "[ . 1 . 2]" 1
385 1 48 TYR HA 1 54 LEU QD . . 3.910 2.216 1.888 2.630 . 0 0 "[ . 1 . 2]" 1
386 1 48 TYR HA 1 54 LEU HG . . 3.530 2.884 2.135 3.612 0.082 4 0 "[ . 1 . 2]" 1
387 1 48 TYR HB3 1 49 LYS H . . 4.040 3.767 3.611 3.922 . 0 0 "[ . 1 . 2]" 1
388 1 48 TYR HB3 1 53 PHE HA . . 3.700 3.162 2.576 3.748 0.048 7 0 "[ . 1 . 2]" 1
389 1 48 TYR HB3 1 54 LEU H . . 4.870 3.390 2.894 3.900 . 0 0 "[ . 1 . 2]" 1
390 1 48 TYR HB3 1 55 SER H . . 5.500 5.108 4.771 5.477 . 0 0 "[ . 1 . 2]" 1
391 1 48 TYR HB3 1 150 PRO HB3 . . 4.980 2.700 2.519 2.921 . 0 0 "[ . 1 . 2]" 1
392 1 48 TYR HB3 1 150 PRO HG3 . . 4.960 2.967 2.543 3.652 . 0 0 "[ . 1 . 2]" 1
393 1 48 TYR QD 1 49 LYS H . . 4.120 3.324 3.128 3.451 . 0 0 "[ . 1 . 2]" 1
394 1 48 TYR QD 1 50 ASP H . . 4.770 2.960 2.372 3.832 . 0 0 "[ . 1 . 2]" 1
395 1 48 TYR QD 1 50 ASP HA . . 5.130 4.577 3.808 5.155 0.025 18 0 "[ . 1 . 2]" 1
396 1 48 TYR QD 1 52 THR H . . 5.500 4.488 3.722 5.133 . 0 0 "[ . 1 . 2]" 1
397 1 48 TYR QD 1 150 PRO HB3 . . 4.610 3.833 3.170 4.378 . 0 0 "[ . 1 . 2]" 1
398 1 48 TYR QD 1 150 PRO HG3 . . 5.000 3.203 2.618 3.882 . 0 0 "[ . 1 . 2]" 1
399 1 48 TYR QD 1 154 ILE MD . . 4.200 3.979 2.894 4.317 0.117 18 0 "[ . 1 . 2]" 1
400 1 48 TYR QE 1 49 LYS H . . 5.500 5.508 5.367 5.583 0.083 2 0 "[ . 1 . 2]" 1
401 1 48 TYR QE 1 50 ASP H . . 5.500 5.034 4.493 5.421 . 0 0 "[ . 1 . 2]" 1
402 1 48 TYR QE 1 151 SER H . . 5.500 5.114 4.463 5.580 0.080 7 0 "[ . 1 . 2]" 1
403 1 48 TYR QE 1 151 SER HB3 . . 4.730 4.787 3.518 6.116 1.386 7 7 "[ - **+ 1 *. * *]" 1
404 1 48 TYR QE 1 154 ILE MD . . 3.550 3.021 2.178 3.637 0.087 16 0 "[ . 1 . 2]" 1
405 1 49 LYS H 1 49 LYS HB3 . . 4.170 3.304 2.682 3.654 . 0 0 "[ . 1 . 2]" 1
406 1 49 LYS H 1 49 LYS HG3 . . 4.930 3.912 3.487 4.716 . 0 0 "[ . 1 . 2]" 1
407 1 49 LYS H 1 50 ASP H . . 4.440 1.952 1.660 4.033 . 0 0 "[ . 1 . 2]" 1
408 1 49 LYS H 1 54 LEU H . . 4.550 4.585 4.008 4.636 0.086 15 0 "[ . 1 . 2]" 1
409 1 49 LYS H 1 54 LEU QD . . 4.260 2.613 1.981 3.095 . 0 0 "[ . 1 . 2]" 1
410 1 49 LYS H 1 54 LEU HG . . 3.970 3.548 2.841 4.053 0.083 2 0 "[ . 1 . 2]" 1
411 1 49 LYS HA 1 49 LYS HG3 . . 3.920 3.778 2.564 3.902 . 0 0 "[ . 1 . 2]" 1
412 1 49 LYS HA 1 50 ASP H . . 3.060 3.080 2.101 3.156 0.096 8 0 "[ . 1 . 2]" 1
413 1 49 LYS HB3 1 50 ASP H . . 4.440 4.375 4.231 4.690 0.250 7 0 "[ . 1 . 2]" 1
414 1 49 LYS HG3 1 50 ASP H . . 4.490 3.954 3.264 4.531 0.041 7 0 "[ . 1 . 2]" 1
415 1 49 LYS HG3 1 50 ASP HA . . 4.960 4.674 4.017 5.151 0.191 6 0 "[ . 1 . 2]" 1
416 1 50 ASP H 1 50 ASP HA . . 2.940 2.894 2.102 2.995 0.055 15 0 "[ . 1 . 2]" 1
417 1 50 ASP H 1 50 ASP HB3 . . 4.140 3.757 3.193 4.087 . 0 0 "[ . 1 . 2]" 1
418 1 50 ASP H 1 51 LYS H . . 5.360 3.055 2.718 4.145 . 0 0 "[ . 1 . 2]" 1
419 1 50 ASP H 1 54 LEU QD . . 5.500 3.970 3.036 5.237 . 0 0 "[ . 1 . 2]" 1
420 1 50 ASP HA 1 51 LYS HA . . 4.760 4.728 4.639 4.823 0.063 4 0 "[ . 1 . 2]" 1
421 1 50 ASP HB3 1 51 LYS H . . 3.100 2.173 1.698 2.436 . 0 0 "[ . 1 . 2]" 1
422 1 50 ASP HB3 1 51 LYS HB3 . . 5.410 4.340 3.566 5.192 . 0 0 "[ . 1 . 2]" 1
423 1 50 ASP HB3 1 52 THR H . . 4.410 4.127 3.368 4.480 0.070 10 0 "[ . 1 . 2]" 1
424 1 51 LYS H 1 51 LYS HB3 . . 3.490 3.431 2.648 3.898 0.408 3 0 "[ . 1 . 2]" 1
425 1 51 LYS H 1 51 LYS HG3 . . 4.460 3.748 2.391 4.516 0.056 4 0 "[ . 1 . 2]" 1
426 1 51 LYS H 1 52 THR H . . 3.200 2.073 1.919 2.371 . 0 0 "[ . 1 . 2]" 1
427 1 51 LYS H 1 52 THR HA . . 4.550 4.549 4.327 4.621 0.071 17 0 "[ . 1 . 2]" 1
428 1 51 LYS HA 1 150 PRO HD3 . . 3.350 3.505 2.873 4.242 0.892 13 4 "[- . * 1 + . *]" 1
429 1 51 LYS HA 1 150 PRO HG3 . . 4.680 3.156 2.524 3.702 . 0 0 "[ . 1 . 2]" 1
430 1 51 LYS HA 1 151 SER H . . 5.420 5.094 4.600 5.495 0.075 18 0 "[ . 1 . 2]" 1
431 1 51 LYS HB3 1 51 LYS HG3 . . 2.750 2.872 2.536 3.067 0.317 6 0 "[ . 1 . 2]" 1
432 1 51 LYS HB3 1 52 THR H . . 5.090 4.394 3.826 4.673 . 0 0 "[ . 1 . 2]" 1
433 1 52 THR H 1 52 THR HA . . 2.940 2.972 2.942 2.994 0.054 9 0 "[ . 1 . 2]" 1
434 1 52 THR H 1 52 THR HB . . 3.200 2.695 2.401 3.066 . 0 0 "[ . 1 . 2]" 1
435 1 52 THR H 1 52 THR MG . . 4.120 3.569 2.170 3.926 . 0 0 "[ . 1 . 2]" 1
436 1 52 THR H 1 53 PHE H . . 4.770 4.425 4.321 4.507 . 0 0 "[ . 1 . 2]" 1
437 1 52 THR H 1 54 LEU QD . . 5.500 4.375 3.048 5.129 . 0 0 "[ . 1 . 2]" 1
438 1 52 THR HA 1 53 PHE H . . 2.940 2.263 2.017 2.438 . 0 0 "[ . 1 . 2]" 1
439 1 52 THR HA 1 53 PHE QD . . 4.360 3.744 3.452 4.178 . 0 0 "[ . 1 . 2]" 1
440 1 52 THR HA 1 150 PRO HA . . 5.190 5.254 5.137 5.293 0.103 10 0 "[ . 1 . 2]" 1
441 1 52 THR HB 1 54 LEU QD . . 4.680 3.898 2.423 4.652 . 0 0 "[ . 1 . 2]" 1
442 1 52 THR MG 1 53 PHE H . . 3.460 2.530 2.208 3.034 . 0 0 "[ . 1 . 2]" 1
443 1 52 THR MG 1 53 PHE HA . . 4.870 4.104 3.849 4.571 . 0 0 "[ . 1 . 2]" 1
444 1 52 THR MG 1 53 PHE HB3 . . 4.470 4.745 4.321 5.154 0.684 16 4 "[ * *. 1 .+ - 2]" 1
445 1 52 THR MG 1 53 PHE QD . . 5.470 4.222 3.236 5.032 . 0 0 "[ . 1 . 2]" 1
446 1 52 THR MG 1 54 LEU HA . . 4.260 3.650 2.823 4.344 0.084 16 0 "[ . 1 . 2]" 1
447 1 52 THR MG 1 54 LEU QD . . 4.090 3.304 1.896 4.063 . 0 0 "[ . 1 . 2]" 1
448 1 52 THR MG 1 54 LEU HG . . 4.210 4.187 3.182 4.330 0.120 6 0 "[ . 1 . 2]" 1
449 1 52 THR MG 1 146 LEU QD . . 4.020 3.634 2.367 4.052 0.032 11 0 "[ . 1 . 2]" 1
450 1 53 PHE H 1 53 PHE HB3 . . 3.240 3.526 3.436 3.637 0.397 5 0 "[ . 1 . 2]" 1
451 1 53 PHE H 1 53 PHE QD . . 3.530 2.507 2.241 2.790 . 0 0 "[ . 1 . 2]" 1
452 1 53 PHE H 1 146 LEU QD . . 4.640 3.440 2.738 3.844 . 0 0 "[ . 1 . 2]" 1
453 1 53 PHE H 1 150 PRO HG3 . . 5.310 4.694 4.092 5.344 0.034 2 0 "[ . 1 . 2]" 1
454 1 53 PHE HA 1 53 PHE QD . . 3.870 2.965 2.672 3.166 . 0 0 "[ . 1 . 2]" 1
455 1 53 PHE HA 1 54 LEU H . . 3.090 2.281 2.189 2.416 . 0 0 "[ . 1 . 2]" 1
456 1 53 PHE HA 1 150 PRO HG3 . . 4.780 4.338 3.884 4.760 . 0 0 "[ . 1 . 2]" 1
457 1 53 PHE HB3 1 54 LEU H . . 5.370 3.944 3.746 4.120 . 0 0 "[ . 1 . 2]" 1
458 1 53 PHE HB3 1 123 PHE QD . . 4.610 2.635 2.281 3.289 . 0 0 "[ . 1 . 2]" 1
459 1 53 PHE HB3 1 146 LEU QD . . 3.500 3.365 2.542 3.831 0.331 14 0 "[ . 1 . 2]" 1
460 1 53 PHE QD 1 54 LEU H . . 5.500 4.668 4.303 4.892 . 0 0 "[ . 1 . 2]" 1
461 1 53 PHE QD 1 56 LEU QD . . 4.290 3.565 2.662 4.256 . 0 0 "[ . 1 . 2]" 1
462 1 53 PHE QD 1 145 LEU QD . . 3.680 2.729 2.408 3.153 . 0 0 "[ . 1 . 2]" 1
463 1 53 PHE QD 1 146 LEU HA . . 3.710 3.082 2.410 3.781 0.071 7 0 "[ . 1 . 2]" 1
464 1 53 PHE QD 1 146 LEU QD . . 3.410 2.702 2.198 3.193 . 0 0 "[ . 1 . 2]" 1
465 1 53 PHE QD 1 150 PRO HA . . 3.870 3.572 3.190 3.805 . 0 0 "[ . 1 . 2]" 1
466 1 53 PHE QE 1 145 LEU QD . . 3.620 2.479 2.238 2.863 . 0 0 "[ . 1 . 2]" 1
467 1 53 PHE QE 1 145 LEU HG . . 4.580 3.293 2.868 4.610 0.030 11 0 "[ . 1 . 2]" 1
468 1 53 PHE QE 1 148 ASN HB3 . . 4.730 5.119 4.618 5.842 1.112 1 8 "[+ *.** ** * -2]" 1
469 1 53 PHE QE 1 150 PRO HA . . 3.230 2.854 2.626 3.024 . 0 0 "[ . 1 . 2]" 1
470 1 54 LEU H 1 54 LEU HB3 . . 4.130 3.583 3.458 3.646 . 0 0 "[ . 1 . 2]" 1
471 1 54 LEU H 1 54 LEU QD . . 4.140 2.997 2.017 3.373 . 0 0 "[ . 1 . 2]" 1
472 1 54 LEU H 1 54 LEU HG . . 3.760 2.952 2.331 3.853 0.093 2 0 "[ . 1 . 2]" 1
473 1 54 LEU H 1 55 SER H . . 3.200 2.578 2.380 2.881 . 0 0 "[ . 1 . 2]" 1
474 1 54 LEU H 1 150 PRO HG3 . . 5.500 5.282 4.709 5.577 0.077 12 0 "[ . 1 . 2]" 1
475 1 54 LEU HA 1 54 LEU QD . . 2.800 2.190 1.936 2.332 . 0 0 "[ . 1 . 2]" 1
476 1 54 LEU HA 1 54 LEU HG . . 3.680 3.037 2.628 3.702 0.022 2 0 "[ . 1 . 2]" 1
477 1 54 LEU HA 1 123 PHE HB3 . . 5.060 4.510 3.642 5.131 0.071 17 0 "[ . 1 . 2]" 1
478 1 54 LEU HA 1 124 GLN HG3 . . 4.610 3.211 2.752 4.662 0.052 5 0 "[ . 1 . 2]" 1
479 1 54 LEU HB3 1 55 SER H . . 3.580 3.453 2.960 3.810 0.230 17 0 "[ . 1 . 2]" 1
480 1 54 LEU QD 1 55 SER H . . 4.870 4.013 3.732 4.398 . 0 0 "[ . 1 . 2]" 1
481 1 54 LEU QD 1 124 GLN H . . 5.360 4.624 4.114 5.040 . 0 0 "[ . 1 . 2]" 1
482 1 54 LEU QD 1 124 GLN HA . . 5.500 4.564 3.570 5.311 . 0 0 "[ . 1 . 2]" 1
483 1 54 LEU QD 1 124 GLN HE21 . . 5.210 4.365 3.169 5.148 . 0 0 "[ . 1 . 2]" 1
484 1 54 LEU QD 1 124 GLN HE22 . . 5.130 4.546 3.385 5.085 . 0 0 "[ . 1 . 2]" 1
485 1 54 LEU QD 1 124 GLN HG3 . . 3.800 2.858 2.303 3.256 . 0 0 "[ . 1 . 2]" 1
486 1 54 LEU HG 1 124 GLN HG3 . . 5.380 5.208 4.640 5.739 0.359 5 0 "[ . 1 . 2]" 1
487 1 55 SER H 1 56 LEU H . . 4.940 4.294 4.073 4.389 . 0 0 "[ . 1 . 2]" 1
488 1 55 SER HA 1 56 LEU H . . 2.880 2.346 2.140 2.490 . 0 0 "[ . 1 . 2]" 1
489 1 55 SER HA 1 123 PHE H . . 3.650 2.271 1.897 2.723 . 0 0 "[ . 1 . 2]" 1
490 1 55 SER HA 1 123 PHE QD . . 4.290 2.700 2.194 3.811 . 0 0 "[ . 1 . 2]" 1
491 1 55 SER HB3 1 56 LEU H . . 4.080 3.462 2.693 3.880 . 0 0 "[ . 1 . 2]" 1
492 1 55 SER HB3 1 122 ASP HA . . 4.490 2.516 1.980 3.948 . 0 0 "[ . 1 . 2]" 1
493 1 56 LEU H 1 56 LEU HB3 . . 4.000 2.633 2.503 2.782 . 0 0 "[ . 1 . 2]" 1
494 1 56 LEU H 1 56 LEU HG . . 5.500 4.617 4.296 5.054 . 0 0 "[ . 1 . 2]" 1
495 1 56 LEU H 1 57 ALA H . . 4.950 4.192 3.988 4.410 . 0 0 "[ . 1 . 2]" 1
496 1 56 LEU H 1 57 ALA MB . . 5.490 4.493 4.287 4.913 . 0 0 "[ . 1 . 2]" 1
497 1 56 LEU H 1 120 SER HA . . 5.080 4.646 4.220 5.068 . 0 0 "[ . 1 . 2]" 1
498 1 56 LEU H 1 121 PHE H . . 3.850 3.027 2.805 3.271 . 0 0 "[ . 1 . 2]" 1
499 1 56 LEU H 1 121 PHE HB3 . . 4.700 4.364 4.082 4.586 . 0 0 "[ . 1 . 2]" 1
500 1 56 LEU H 1 121 PHE QD . . 4.990 4.334 4.004 4.578 . 0 0 "[ . 1 . 2]" 1
501 1 56 LEU H 1 122 ASP HA . . 5.500 4.015 3.629 4.426 . 0 0 "[ . 1 . 2]" 1
502 1 56 LEU H 1 123 PHE QE . . 4.350 4.172 3.627 4.445 0.095 10 0 "[ . 1 . 2]" 1
503 1 56 LEU HA 1 56 LEU QD . . 3.180 2.330 2.120 2.528 . 0 0 "[ . 1 . 2]" 1
504 1 56 LEU HA 1 56 LEU HG . . 4.230 3.353 2.857 3.815 . 0 0 "[ . 1 . 2]" 1
505 1 56 LEU HA 1 57 ALA H . . 2.950 2.230 2.136 2.459 . 0 0 "[ . 1 . 2]" 1
506 1 56 LEU HA 1 57 ALA MB . . 5.160 4.091 3.966 4.243 . 0 0 "[ . 1 . 2]" 1
507 1 56 LEU HA 1 121 PHE QD . . 5.110 5.075 4.719 5.208 0.098 13 0 "[ . 1 . 2]" 1
508 1 56 LEU HA 1 123 PHE QE . . 5.370 4.537 4.000 5.402 0.032 15 0 "[ . 1 . 2]" 1
509 1 56 LEU HB3 1 56 LEU QD . . 3.220 2.212 2.122 2.322 . 0 0 "[ . 1 . 2]" 1
510 1 56 LEU HB3 1 57 ALA H . . 5.330 4.295 3.859 4.516 . 0 0 "[ . 1 . 2]" 1
511 1 56 LEU HB3 1 121 PHE H . . 5.240 3.980 3.481 4.496 . 0 0 "[ . 1 . 2]" 1
512 1 56 LEU HB3 1 121 PHE HB3 . . 4.910 3.983 3.525 4.547 . 0 0 "[ . 1 . 2]" 1
513 1 56 LEU HB3 1 121 PHE QD . . 3.660 3.187 2.585 3.729 0.069 13 0 "[ . 1 . 2]" 1
514 1 56 LEU HB3 1 123 PHE QD . . 4.050 3.909 3.012 4.138 0.088 17 0 "[ . 1 . 2]" 1
515 1 56 LEU HB3 1 123 PHE QE . . 3.990 2.726 2.468 3.115 . 0 0 "[ . 1 . 2]" 1
516 1 56 LEU HB3 1 123 PHE HZ . . 4.450 3.691 2.725 4.522 0.072 4 0 "[ . 1 . 2]" 1
517 1 56 LEU QD 1 57 ALA H . . 3.370 2.575 1.850 3.209 . 0 0 "[ . 1 . 2]" 1
518 1 56 LEU QD 1 58 ILE MD . . 3.180 2.551 2.060 3.176 . 0 0 "[ . 1 . 2]" 1
519 1 56 LEU QD 1 121 PHE H . . 5.500 4.303 3.630 5.050 . 0 0 "[ . 1 . 2]" 1
520 1 56 LEU QD 1 121 PHE HB3 . . 5.500 4.240 3.634 4.824 . 0 0 "[ . 1 . 2]" 1
521 1 56 LEU QD 1 121 PHE QD . . 3.370 2.484 1.948 3.446 0.076 20 0 "[ . 1 . 2]" 1
522 1 56 LEU QD 1 123 PHE HZ . . 3.790 3.080 2.016 3.797 0.007 15 0 "[ . 1 . 2]" 1
523 1 56 LEU QD 1 142 LEU QD . . 3.520 2.607 1.932 3.306 . 0 0 "[ . 1 . 2]" 1
524 1 56 LEU QD 1 145 LEU QD . . 3.300 2.172 1.784 2.717 . 0 0 "[ . 1 . 2]" 1
525 1 56 LEU HG 1 57 ALA H . . 4.860 3.746 2.110 4.926 0.066 18 0 "[ . 1 . 2]" 1
526 1 56 LEU HG 1 58 ILE H . . 5.500 5.052 4.009 5.593 0.093 6 0 "[ . 1 . 2]" 1
527 1 57 ALA H 1 57 ALA MB . . 3.250 2.581 2.291 2.798 . 0 0 "[ . 1 . 2]" 1
528 1 57 ALA HA 1 58 ILE H . . 2.950 2.214 2.045 2.392 . 0 0 "[ . 1 . 2]" 1
529 1 57 ALA HA 1 58 ILE HB . . 4.750 4.586 4.303 4.815 0.065 8 0 "[ . 1 . 2]" 1
530 1 57 ALA HA 1 118 THR MG . . 4.560 3.891 3.340 4.600 0.040 11 0 "[ . 1 . 2]" 1
531 1 57 ALA HA 1 120 SER HA . . 3.120 2.193 1.981 2.452 . 0 0 "[ . 1 . 2]" 1
532 1 57 ALA HA 1 121 PHE H . . 4.050 3.272 3.028 3.533 . 0 0 "[ . 1 . 2]" 1
533 1 57 ALA HA 1 121 PHE QD . . 5.100 3.534 2.367 4.455 . 0 0 "[ . 1 . 2]" 1
534 1 57 ALA MB 1 58 ILE H . . 3.500 3.054 2.336 3.563 0.063 14 0 "[ . 1 . 2]" 1
535 1 57 ALA MB 1 59 GLN H . . 5.500 4.644 4.172 5.073 . 0 0 "[ . 1 . 2]" 1
536 1 57 ALA MB 1 118 THR MG . . 3.630 2.478 2.091 3.751 0.121 11 0 "[ . 1 . 2]" 1
537 1 57 ALA MB 1 120 SER HA . . 3.730 2.680 2.106 3.336 . 0 0 "[ . 1 . 2]" 1
538 1 57 ALA MB 1 121 PHE H . . 4.580 3.799 3.163 4.626 0.046 8 0 "[ . 1 . 2]" 1
539 1 57 ALA MB 1 121 PHE QD . . 5.500 4.860 3.876 5.571 0.071 11 0 "[ . 1 . 2]" 1
540 1 58 ILE H 1 58 ILE HB . . 3.530 2.650 2.303 2.920 . 0 0 "[ . 1 . 2]" 1
541 1 58 ILE H 1 58 ILE MD . . 4.310 3.860 2.557 4.371 0.061 4 0 "[ . 1 . 2]" 1
542 1 58 ILE H 1 58 ILE HG13 . . 4.390 2.785 2.172 3.654 . 0 0 "[ . 1 . 2]" 1
543 1 58 ILE H 1 58 ILE MG . . 4.370 3.877 3.736 3.985 . 0 0 "[ . 1 . 2]" 1
544 1 58 ILE H 1 118 THR MG . . 4.050 3.554 2.889 4.143 0.093 15 0 "[ . 1 . 2]" 1
545 1 58 ILE H 1 119 THR H . . 3.880 3.233 2.628 3.949 0.069 2 0 "[ . 1 . 2]" 1
546 1 58 ILE H 1 119 THR HB . . 4.730 3.605 3.228 4.054 . 0 0 "[ . 1 . 2]" 1
547 1 58 ILE H 1 120 SER HA . . 4.050 3.699 3.120 4.086 0.036 2 0 "[ . 1 . 2]" 1
548 1 58 ILE H 1 121 PHE H . . 5.500 4.896 4.131 5.563 0.063 12 0 "[ . 1 . 2]" 1
549 1 58 ILE H 1 121 PHE QE . . 5.500 3.965 3.016 5.506 0.006 11 0 "[ . 1 . 2]" 1
550 1 58 ILE HA 1 58 ILE MD . . 3.960 3.880 3.606 4.000 0.040 2 0 "[ . 1 . 2]" 1
551 1 58 ILE HA 1 58 ILE MG . . 3.180 2.404 2.303 2.543 . 0 0 "[ . 1 . 2]" 1
552 1 58 ILE HA 1 59 GLN H . . 2.850 2.146 2.035 2.254 . 0 0 "[ . 1 . 2]" 1
553 1 58 ILE HB 1 58 ILE MD . . 3.350 2.416 2.262 2.676 . 0 0 "[ . 1 . 2]" 1
554 1 58 ILE HB 1 119 THR H . . 4.270 3.573 3.217 3.877 . 0 0 "[ . 1 . 2]" 1
555 1 58 ILE HB 1 119 THR HB . . 3.460 3.082 2.640 3.518 0.058 16 0 "[ . 1 . 2]" 1
556 1 58 ILE MD 1 59 GLN H . . 5.500 5.343 5.113 5.527 0.027 7 0 "[ . 1 . 2]" 1
557 1 58 ILE MD 1 119 THR HB . . 4.300 3.925 2.458 4.367 0.067 3 0 "[ . 1 . 2]" 1
558 1 58 ILE MD 1 121 PHE QE . . 3.570 2.470 2.009 3.137 . 0 0 "[ . 1 . 2]" 1
559 1 58 ILE HG13 1 119 THR HB . . 5.370 4.610 4.004 5.436 0.066 15 0 "[ . 1 . 2]" 1
560 1 58 ILE HG13 1 121 PHE QE . . 3.990 3.260 2.368 4.636 0.646 10 1 "[ . + . 2]" 1
561 1 58 ILE MG 1 59 GLN H . . 3.680 2.974 2.676 3.234 . 0 0 "[ . 1 . 2]" 1
562 1 58 ILE MG 1 59 GLN HA . . 4.730 4.128 3.600 4.500 . 0 0 "[ . 1 . 2]" 1
563 1 58 ILE MG 1 60 GLN H . . 5.270 4.777 4.160 5.188 . 0 0 "[ . 1 . 2]" 1
564 1 58 ILE MG 1 60 GLN HE21 . . 5.500 5.526 5.080 6.206 0.706 14 2 "[ - 1 +. 2]" 1
565 1 59 GLN H 1 59 GLN HB3 . . 3.580 3.409 2.905 3.664 0.084 8 0 "[ . 1 . 2]" 1
566 1 59 GLN HA 1 59 GLN HG3 . . 3.720 2.791 2.365 3.652 . 0 0 "[ . 1 . 2]" 1
567 1 59 GLN HA 1 60 GLN H . . 2.850 2.388 2.157 2.578 . 0 0 "[ . 1 . 2]" 1
568 1 59 GLN HA 1 118 THR HA . . 3.290 2.177 1.959 2.436 . 0 0 "[ . 1 . 2]" 1
569 1 59 GLN HA 1 118 THR HB . . 4.320 4.282 4.042 4.399 0.079 17 0 "[ . 1 . 2]" 1
570 1 59 GLN HA 1 118 THR MG . . 4.060 2.599 2.232 2.847 . 0 0 "[ . 1 . 2]" 1
571 1 59 GLN HA 1 119 THR H . . 4.200 3.736 3.492 4.029 . 0 0 "[ . 1 . 2]" 1
572 1 59 GLN HB3 1 118 THR MG . . 4.240 4.433 4.051 4.786 0.546 2 3 "[ + . -1 . *]" 1
573 1 59 GLN HE21 1 118 THR MG . . 5.370 4.455 3.157 5.453 0.083 17 0 "[ . 1 . 2]" 1
574 1 59 GLN HG3 1 118 THR MG . . 3.750 2.771 2.179 3.837 0.087 6 0 "[ . 1 . 2]" 1
575 1 60 GLN H 1 60 GLN HB3 . . 3.510 2.926 2.551 3.552 0.042 2 0 "[ . 1 . 2]" 1
576 1 60 GLN H 1 60 GLN HG3 . . 4.490 4.685 4.368 5.082 0.592 15 4 "[ *-. 1 +* 2]" 1
577 1 60 GLN H 1 61 LYS H . . 4.740 4.372 4.198 4.569 . 0 0 "[ . 1 . 2]" 1
578 1 60 GLN H 1 116 GLN HA . . 5.000 4.570 4.311 5.051 0.051 11 0 "[ . 1 . 2]" 1
579 1 60 GLN H 1 117 THR H . . 3.660 2.879 2.584 3.167 . 0 0 "[ . 1 . 2]" 1
580 1 60 GLN H 1 117 THR HB . . 4.730 4.126 3.612 4.645 . 0 0 "[ . 1 . 2]" 1
581 1 60 GLN H 1 117 THR MG . . 5.500 5.061 4.734 5.530 0.030 10 0 "[ . 1 . 2]" 1
582 1 60 GLN H 1 118 THR HA . . 4.070 3.437 2.804 3.829 . 0 0 "[ . 1 . 2]" 1
583 1 60 GLN H 1 118 THR HB . . 5.500 5.492 5.032 5.580 0.080 1 0 "[ . 1 . 2]" 1
584 1 60 GLN HA 1 60 GLN HE21 . . 5.500 2.975 2.041 4.527 . 0 0 "[ . 1 . 2]" 1
585 1 60 GLN HA 1 60 GLN HE22 . . 5.500 3.843 3.520 4.281 . 0 0 "[ . 1 . 2]" 1
586 1 60 GLN HA 1 60 GLN HG3 . . 3.610 3.230 2.847 3.646 0.036 3 0 "[ . 1 . 2]" 1
587 1 60 GLN HA 1 61 LYS H . . 2.810 2.344 2.268 2.418 . 0 0 "[ . 1 . 2]" 1
588 1 60 GLN HB3 1 60 GLN HG3 . . 2.980 2.540 2.421 2.712 . 0 0 "[ . 1 . 2]" 1
589 1 60 GLN HB3 1 117 THR HB . . 4.890 2.463 2.080 3.462 . 0 0 "[ . 1 . 2]" 1
590 1 60 GLN HB3 1 118 THR H . . 4.960 5.195 4.580 6.287 1.327 2 3 "[ + . * .- 2]" 1
591 1 60 GLN HE21 1 61 LYS H . . 4.740 2.706 1.843 4.797 0.057 17 0 "[ . 1 . 2]" 1
592 1 60 GLN HE22 1 61 LYS H . . 5.500 3.499 2.323 4.523 . 0 0 "[ . 1 . 2]" 1
593 1 60 GLN HG3 1 61 LYS H . . 4.230 3.407 2.540 4.492 0.262 10 0 "[ . 1 . 2]" 1
594 1 61 LYS H 1 61 LYS HB3 . . 3.460 3.179 2.674 3.539 0.079 12 0 "[ . 1 . 2]" 1
595 1 61 LYS H 1 61 LYS HG3 . . 5.210 4.577 4.018 5.049 . 0 0 "[ . 1 . 2]" 1
596 1 61 LYS H 1 62 ARG H . . 4.040 4.070 3.910 4.119 0.079 15 0 "[ . 1 . 2]" 1
597 1 61 LYS HA 1 61 LYS HG3 . . 3.910 2.479 2.108 3.294 . 0 0 "[ . 1 . 2]" 1
598 1 61 LYS HA 1 62 ARG H . . 2.750 2.235 2.123 2.322 . 0 0 "[ . 1 . 2]" 1
599 1 61 LYS HA 1 62 ARG HG3 . . 4.240 4.347 3.722 5.308 1.068 19 5 "[ *. * 1 -* +2]" 1
600 1 61 LYS HA 1 115 LEU H . . 5.120 4.694 4.446 4.985 . 0 0 "[ . 1 . 2]" 1
601 1 61 LYS HA 1 115 LEU QD . . 5.400 3.931 2.833 4.758 . 0 0 "[ . 1 . 2]" 1
602 1 61 LYS HA 1 116 GLN H . . 5.500 4.945 4.588 5.353 . 0 0 "[ . 1 . 2]" 1
603 1 61 LYS HA 1 116 GLN HA . . 3.260 2.411 2.094 2.801 . 0 0 "[ . 1 . 2]" 1
604 1 61 LYS HB3 1 62 ARG H . . 4.160 3.980 3.320 4.245 0.085 6 0 "[ . 1 . 2]" 1
605 1 61 LYS HG3 1 62 ARG H . . 4.540 3.932 3.367 4.617 0.077 1 0 "[ . 1 . 2]" 1
606 1 61 LYS HG3 1 116 GLN HA . . 4.880 3.198 2.296 4.942 0.062 1 0 "[ . 1 . 2]" 1
607 1 62 ARG H 1 62 ARG HG3 . . 3.700 2.993 2.597 3.510 . 0 0 "[ . 1 . 2]" 1
608 1 62 ARG H 1 115 LEU H . . 3.640 3.327 2.970 3.726 0.086 3 0 "[ . 1 . 2]" 1
609 1 62 ARG H 1 115 LEU QD . . 5.330 2.735 2.215 3.414 . 0 0 "[ . 1 . 2]" 1
610 1 62 ARG H 1 116 GLN HA . . 4.070 3.832 3.374 4.109 0.039 8 0 "[ . 1 . 2]" 1
611 1 62 ARG HA 1 63 PRO HD3 . . 3.170 2.470 2.316 2.770 . 0 0 "[ . 1 . 2]" 1
612 1 62 ARG HB3 1 63 PRO HD3 . . 4.320 3.818 3.317 4.399 0.079 4 0 "[ . 1 . 2]" 1
613 1 62 ARG HG3 1 63 PRO HD3 . . 5.420 5.541 5.053 6.170 0.750 18 3 "[ - 1 * . + 2]" 1
614 1 63 PRO HA 1 64 VAL H . . 2.700 2.370 2.259 2.475 . 0 0 "[ . 1 . 2]" 1
615 1 63 PRO HA 1 64 VAL HA . . 4.740 4.487 4.367 4.538 . 0 0 "[ . 1 . 2]" 1
616 1 63 PRO HA 1 64 VAL QG . . 4.260 3.302 2.881 3.507 . 0 0 "[ . 1 . 2]" 1
617 1 63 PRO HB3 1 64 VAL H . . 3.680 3.568 3.368 3.742 0.062 5 0 "[ . 1 . 2]" 1
618 1 64 VAL H 1 64 VAL HB . . 3.780 3.682 3.540 3.852 0.072 7 0 "[ . 1 . 2]" 1
619 1 64 VAL H 1 64 VAL QG . . 3.050 1.975 1.770 2.314 . 0 0 "[ . 1 . 2]" 1
620 1 64 VAL H 1 65 SER H . . 4.770 4.476 4.294 4.643 . 0 0 "[ . 1 . 2]" 1
621 1 64 VAL H 1 113 THR HA . . 4.680 3.687 3.310 4.121 . 0 0 "[ . 1 . 2]" 1
622 1 64 VAL H 1 113 THR MG . . 5.270 4.741 3.959 5.302 0.032 12 0 "[ . 1 . 2]" 1
623 1 64 VAL H 1 114 GLU H . . 4.520 4.533 4.216 4.608 0.088 5 0 "[ . 1 . 2]" 1
624 1 64 VAL H 1 114 GLU HA . . 3.590 3.055 2.691 3.515 . 0 0 "[ . 1 . 2]" 1
625 1 64 VAL H 1 115 LEU H . . 4.750 4.672 4.282 4.831 0.081 16 0 "[ . 1 . 2]" 1
626 1 64 VAL HA 1 64 VAL QG . . 3.060 2.332 2.201 2.445 . 0 0 "[ . 1 . 2]" 1
627 1 64 VAL HA 1 65 SER H . . 2.710 2.589 2.212 2.787 0.077 4 0 "[ . 1 . 2]" 1
628 1 64 VAL HA 1 115 LEU QD . . 4.070 3.272 2.258 4.118 0.048 7 0 "[ . 1 . 2]" 1
629 1 64 VAL HB 1 65 SER H . . 3.600 2.242 1.879 2.888 . 0 0 "[ . 1 . 2]" 1
630 1 64 VAL QG 1 65 SER H . . 3.690 2.892 2.470 3.242 . 0 0 "[ . 1 . 2]" 1
631 1 64 VAL QG 1 69 LYS H . . 3.840 3.765 3.476 3.870 0.030 4 0 "[ . 1 . 2]" 1
632 1 64 VAL QG 1 113 THR H . . 5.370 3.881 3.421 4.187 . 0 0 "[ . 1 . 2]" 1
633 1 64 VAL QG 1 113 THR HA . . 3.380 2.102 1.920 2.298 . 0 0 "[ . 1 . 2]" 1
634 1 64 VAL QG 1 113 THR MG . . 3.880 3.197 2.296 3.778 . 0 0 "[ . 1 . 2]" 1
635 1 64 VAL QG 1 114 GLU H . . 4.200 2.974 2.558 3.369 . 0 0 "[ . 1 . 2]" 1
636 1 64 VAL QG 1 114 GLU HA . . 3.800 2.575 2.155 3.342 . 0 0 "[ . 1 . 2]" 1
637 1 64 VAL QG 1 115 LEU H . . 4.300 3.260 2.496 3.919 . 0 0 "[ . 1 . 2]" 1
638 1 64 VAL QG 1 115 LEU QD . . 2.720 2.162 1.912 2.695 . 0 0 "[ . 1 . 2]" 1
639 1 65 SER H 1 66 ASP H . . 5.000 3.702 1.574 4.603 . 0 0 "[ . 1 . 2]" 1
640 1 65 SER H 1 68 LEU H . . 4.340 3.557 3.215 4.303 . 0 0 "[ . 1 . 2]" 1
641 1 65 SER H 1 68 LEU HB3 . . 4.140 3.584 2.714 4.343 0.203 5 0 "[ . 1 . 2]" 1
642 1 65 SER H 1 68 LEU QD . . 4.510 4.138 3.133 4.655 0.145 20 0 "[ . 1 . 2]" 1
643 1 65 SER H 1 69 LYS H . . 4.760 4.088 3.447 4.577 . 0 0 "[ . 1 . 2]" 1
644 1 65 SER HA 1 66 ASP H . . 2.920 2.756 2.560 3.020 0.100 16 0 "[ . 1 . 2]" 1
645 1 66 ASP H 1 66 ASP HB3 . . 3.170 3.257 2.801 3.454 0.284 13 0 "[ . 1 . 2]" 1
646 1 66 ASP H 1 67 GLU H . . 3.720 2.766 2.516 3.236 . 0 0 "[ . 1 . 2]" 1
647 1 66 ASP H 1 68 LEU H . . 5.200 4.046 2.796 4.927 . 0 0 "[ . 1 . 2]" 1
648 1 66 ASP HA 1 66 ASP HB3 . . 2.930 2.805 2.530 3.065 0.135 20 0 "[ . 1 . 2]" 1
649 1 66 ASP HA 1 67 GLU H . . 3.550 3.514 3.373 3.600 0.050 7 0 "[ . 1 . 2]" 1
650 1 66 ASP HA 1 69 LYS HB3 . . 3.670 3.551 3.261 3.746 0.076 4 0 "[ . 1 . 2]" 1
651 1 66 ASP HB3 1 67 GLU H . . 3.550 3.087 1.877 3.799 0.249 4 0 "[ . 1 . 2]" 1
652 1 67 GLU H 1 67 GLU HB3 . . 3.660 3.544 3.232 3.666 0.006 20 0 "[ . 1 . 2]" 1
653 1 67 GLU H 1 68 LEU H . . 3.480 2.833 2.540 3.043 . 0 0 "[ . 1 . 2]" 1
654 1 67 GLU HA 1 69 LYS H . . 4.770 4.594 4.250 4.849 0.079 5 0 "[ . 1 . 2]" 1
655 1 67 GLU HA 1 70 THR H . . 4.400 4.015 3.509 4.479 0.079 5 0 "[ . 1 . 2]" 1
656 1 67 GLU HB3 1 68 LEU H . . 3.620 3.291 2.425 3.707 0.087 12 0 "[ . 1 . 2]" 1
657 1 68 LEU H 1 68 LEU HB3 . . 3.040 3.115 2.717 3.443 0.403 17 0 "[ . 1 . 2]" 1
658 1 68 LEU H 1 68 LEU QD . . 4.200 3.268 2.513 3.903 . 0 0 "[ . 1 . 2]" 1
659 1 68 LEU H 1 69 LYS H . . 3.040 2.511 1.974 2.795 . 0 0 "[ . 1 . 2]" 1
660 1 68 LEU HA 1 68 LEU QD . . 3.020 2.009 1.904 2.169 . 0 0 "[ . 1 . 2]" 1
661 1 68 LEU HA 1 72 ILE H . . 4.670 4.251 3.612 4.723 0.053 14 0 "[ . 1 . 2]" 1
662 1 68 LEU HB3 1 68 LEU QD . . 3.240 2.270 2.129 2.425 . 0 0 "[ . 1 . 2]" 1
663 1 68 LEU HB3 1 69 LYS H . . 3.950 3.122 2.611 3.924 . 0 0 "[ . 1 . 2]" 1
664 1 68 LEU QD 1 71 TYR H . . 5.210 3.859 3.430 4.718 . 0 0 "[ . 1 . 2]" 1
665 1 68 LEU QD 1 71 TYR HB3 . . 4.120 2.660 2.090 3.310 . 0 0 "[ . 1 . 2]" 1
666 1 68 LEU QD 1 72 ILE H . . 4.870 3.846 3.374 4.487 . 0 0 "[ . 1 . 2]" 1
667 1 69 LYS H 1 69 LYS HB3 . . 3.270 3.292 2.951 3.362 0.092 2 0 "[ . 1 . 2]" 1
668 1 69 LYS H 1 70 THR H . . 3.260 2.800 2.412 3.321 0.061 5 0 "[ . 1 . 2]" 1
669 1 69 LYS H 1 71 TYR H . . 4.970 4.483 4.095 4.847 . 0 0 "[ . 1 . 2]" 1
670 1 69 LYS HA 1 72 ILE H . . 4.280 3.475 3.079 4.198 . 0 0 "[ . 1 . 2]" 1
671 1 69 LYS HA 1 72 ILE HB . . 3.490 2.657 2.220 3.499 0.009 5 0 "[ . 1 . 2]" 1
672 1 69 LYS HA 1 72 ILE MD . . 3.370 2.413 2.056 3.452 0.082 4 0 "[ . 1 . 2]" 1
673 1 69 LYS HB3 1 70 THR H . . 3.830 3.116 2.484 3.665 . 0 0 "[ . 1 . 2]" 1
674 1 70 THR H 1 70 THR HB . . 2.990 2.721 2.337 3.073 0.083 12 0 "[ . 1 . 2]" 1
675 1 70 THR H 1 70 THR MG . . 3.720 3.715 3.398 3.802 0.082 11 0 "[ . 1 . 2]" 1
676 1 70 THR H 1 71 TYR H . . 3.440 2.933 2.647 3.163 . 0 0 "[ . 1 . 2]" 1
677 1 70 THR H 1 71 TYR HB3 . . 5.460 5.222 4.848 5.519 0.059 10 0 "[ . 1 . 2]" 1
678 1 70 THR H 1 72 ILE H . . 5.270 4.326 4.125 4.540 . 0 0 "[ . 1 . 2]" 1
679 1 70 THR HA 1 70 THR MG . . 2.990 2.315 2.201 2.581 . 0 0 "[ . 1 . 2]" 1
680 1 70 THR HA 1 73 ASP H . . 4.370 3.574 3.401 3.783 . 0 0 "[ . 1 . 2]" 1
681 1 70 THR HA 1 73 ASP HB3 . . 3.680 3.390 2.828 3.738 0.058 4 0 "[ . 1 . 2]" 1
682 1 70 THR HB 1 71 TYR H . . 3.200 2.628 2.255 2.959 . 0 0 "[ . 1 . 2]" 1
683 1 70 THR MG 1 71 TYR H . . 3.900 3.702 3.237 3.984 0.084 15 0 "[ . 1 . 2]" 1
684 1 70 THR MG 1 73 ASP H . . 4.900 4.787 4.505 4.938 0.038 15 0 "[ . 1 . 2]" 1
685 1 70 THR MG 1 74 GLN H . . 5.320 4.206 3.904 4.978 . 0 0 "[ . 1 . 2]" 1
686 1 70 THR MG 1 74 GLN HE21 . . 4.450 3.214 2.092 4.562 0.112 11 0 "[ . 1 . 2]" 1
687 1 70 THR MG 1 74 GLN HE22 . . 4.410 3.731 2.604 4.504 0.094 14 0 "[ . 1 . 2]" 1
688 1 70 THR MG 1 74 GLN HG3 . . 4.990 2.911 2.346 3.771 . 0 0 "[ . 1 . 2]" 1
689 1 71 TYR H 1 71 TYR HB3 . . 3.250 2.579 2.401 2.813 . 0 0 "[ . 1 . 2]" 1
690 1 71 TYR H 1 71 TYR QD . . 4.600 4.218 4.133 4.280 . 0 0 "[ . 1 . 2]" 1
691 1 71 TYR H 1 72 ILE H . . 3.480 2.763 2.536 3.100 . 0 0 "[ . 1 . 2]" 1
692 1 71 TYR H 1 72 ILE HB . . 5.220 4.912 4.587 5.245 0.025 20 0 "[ . 1 . 2]" 1
693 1 71 TYR H 1 73 ASP H . . 5.110 4.201 3.949 4.429 . 0 0 "[ . 1 . 2]" 1
694 1 71 TYR HA 1 71 TYR QD . . 3.380 3.013 2.807 3.250 . 0 0 "[ . 1 . 2]" 1
695 1 71 TYR HA 1 74 GLN HB3 . . 5.130 4.214 3.808 4.989 . 0 0 "[ . 1 . 2]" 1
696 1 71 TYR HA 1 75 HIS HD2 . . 3.860 3.311 2.500 3.892 0.032 15 0 "[ . 1 . 2]" 1
697 1 71 TYR HB3 1 72 ILE H . . 4.200 2.717 2.549 2.842 . 0 0 "[ . 1 . 2]" 1
698 1 71 TYR HB3 1 80 THR MG . . 5.290 3.223 2.478 3.835 . 0 0 "[ . 1 . 2]" 1
699 1 71 TYR QD 1 72 ILE H . . 4.270 3.482 3.163 3.651 . 0 0 "[ . 1 . 2]" 1
700 1 71 TYR QD 1 72 ILE HA . . 4.960 3.081 2.852 3.548 . 0 0 "[ . 1 . 2]" 1
701 1 71 TYR QD 1 75 HIS HB3 . . 3.850 4.842 4.412 5.404 1.554 11 20 [*******-**+*********] 1
702 1 71 TYR QD 1 75 HIS HD2 . . 3.720 3.524 3.146 3.804 0.084 17 0 "[ . 1 . 2]" 1
703 1 71 TYR QD 1 76 GLY H . . 4.610 3.919 3.363 4.676 0.066 6 0 "[ . 1 . 2]" 1
704 1 71 TYR QD 1 80 THR HA . . 3.400 2.924 2.407 3.464 0.064 6 0 "[ . 1 . 2]" 1
705 1 71 TYR QD 1 80 THR MG . . 2.890 2.515 2.144 2.819 . 0 0 "[ . 1 . 2]" 1
706 1 71 TYR QD 1 83 ALA MB . . 4.400 3.478 2.803 4.067 . 0 0 "[ . 1 . 2]" 1
707 1 71 TYR QE 1 72 ILE HA . . 4.610 4.538 4.128 4.700 0.090 11 0 "[ . 1 . 2]" 1
708 1 71 TYR QE 1 75 HIS HB3 . . 3.830 3.544 3.261 4.189 0.359 6 0 "[ . 1 . 2]" 1
709 1 71 TYR QE 1 75 HIS HD2 . . 4.200 3.498 3.096 4.040 . 0 0 "[ . 1 . 2]" 1
710 1 71 TYR QE 1 79 GLU HB3 . . 3.880 2.671 2.182 3.210 . 0 0 "[ . 1 . 2]" 1
711 1 71 TYR QE 1 79 GLU HG3 . . 5.500 4.852 4.398 5.477 . 0 0 "[ . 1 . 2]" 1
712 1 71 TYR QE 1 80 THR HA . . 2.790 2.384 2.104 2.688 . 0 0 "[ . 1 . 2]" 1
713 1 71 TYR QE 1 83 ALA MB . . 3.090 2.873 2.607 3.124 0.034 8 0 "[ . 1 . 2]" 1
714 1 72 ILE H 1 72 ILE HB . . 3.240 2.462 2.334 2.641 . 0 0 "[ . 1 . 2]" 1
715 1 72 ILE H 1 72 ILE MD . . 3.830 3.372 3.171 3.803 . 0 0 "[ . 1 . 2]" 1
716 1 72 ILE H 1 72 ILE HG13 . . 3.450 2.154 1.921 2.385 . 0 0 "[ . 1 . 2]" 1
717 1 72 ILE H 1 72 ILE MG . . 4.130 3.765 3.716 3.823 . 0 0 "[ . 1 . 2]" 1
718 1 72 ILE H 1 73 ASP H . . 3.570 2.691 2.512 2.882 . 0 0 "[ . 1 . 2]" 1
719 1 72 ILE H 1 73 ASP HB3 . . 5.500 5.374 4.868 5.776 0.276 5 0 "[ . 1 . 2]" 1
720 1 72 ILE H 1 74 GLN H . . 4.210 4.240 4.106 4.288 0.078 1 0 "[ . 1 . 2]" 1
721 1 72 ILE H 1 80 THR MG . . 3.990 3.907 3.323 4.077 0.087 2 0 "[ . 1 . 2]" 1
722 1 72 ILE HA 1 72 ILE MG . . 3.570 2.457 2.358 2.557 . 0 0 "[ . 1 . 2]" 1
723 1 72 ILE HA 1 74 GLN H . . 5.200 4.601 3.938 4.757 . 0 0 "[ . 1 . 2]" 1
724 1 72 ILE HA 1 75 HIS H . . 4.080 3.752 3.276 3.957 . 0 0 "[ . 1 . 2]" 1
725 1 72 ILE HA 1 76 GLY H . . 3.670 2.769 2.348 3.338 . 0 0 "[ . 1 . 2]" 1
726 1 72 ILE HB 1 73 ASP H . . 3.240 2.821 2.591 3.121 . 0 0 "[ . 1 . 2]" 1
727 1 72 ILE HB 1 112 ALA MB . . 5.500 4.551 3.886 5.213 . 0 0 "[ . 1 . 2]" 1
728 1 72 ILE MD 1 73 ASP H . . 5.060 4.662 4.437 5.074 0.014 12 0 "[ . 1 . 2]" 1
729 1 72 ILE MD 1 112 ALA HA . . 3.420 2.774 2.045 3.496 0.076 15 0 "[ . 1 . 2]" 1
730 1 72 ILE HG13 1 80 THR HB . . 4.950 4.455 4.091 5.016 0.066 2 0 "[ . 1 . 2]" 1
731 1 72 ILE HG13 1 80 THR MG . . 2.530 2.459 2.181 2.881 0.351 14 0 "[ . 1 . 2]" 1
732 1 72 ILE MG 1 73 ASP H . . 3.960 3.606 3.394 3.893 . 0 0 "[ . 1 . 2]" 1
733 1 72 ILE MG 1 73 ASP HA . . 4.130 3.658 3.327 4.017 . 0 0 "[ . 1 . 2]" 1
734 1 72 ILE MG 1 74 GLN H . . 5.410 5.272 4.769 5.497 0.087 3 0 "[ . 1 . 2]" 1
735 1 72 ILE MG 1 75 HIS H . . 5.230 5.088 4.625 5.307 0.077 19 0 "[ . 1 . 2]" 1
736 1 72 ILE MG 1 76 GLY H . . 4.440 4.042 3.451 4.377 . 0 0 "[ . 1 . 2]" 1
737 1 72 ILE MG 1 76 GLY HA3 . . 4.680 4.509 4.076 4.775 0.095 11 0 "[ . 1 . 2]" 1
738 1 72 ILE MG 1 112 ALA HA . . 3.310 2.877 2.096 3.408 0.098 3 0 "[ . 1 . 2]" 1
739 1 72 ILE MG 1 112 ALA MB . . 3.220 2.431 2.137 2.839 . 0 0 "[ . 1 . 2]" 1
740 1 73 ASP H 1 73 ASP HB3 . . 3.110 2.876 2.387 3.202 0.092 5 0 "[ . 1 . 2]" 1
741 1 73 ASP H 1 74 GLN H . . 3.460 2.582 2.272 2.808 . 0 0 "[ . 1 . 2]" 1
742 1 73 ASP HA 1 73 ASP HB3 . . 2.890 2.949 2.860 2.979 0.089 16 0 "[ . 1 . 2]" 1
743 1 73 ASP HA 1 76 GLY H . . 5.500 5.508 5.209 5.583 0.083 16 0 "[ . 1 . 2]" 1
744 1 73 ASP HB3 1 74 GLN H . . 3.720 2.703 2.258 3.392 . 0 0 "[ . 1 . 2]" 1
745 1 73 ASP HB3 1 74 GLN HA . . 5.130 4.063 3.782 4.331 . 0 0 "[ . 1 . 2]" 1
746 1 73 ASP HB3 1 74 GLN HG3 . . 5.290 4.164 2.643 5.582 0.292 5 0 "[ . 1 . 2]" 1
747 1 74 GLN H 1 74 GLN HB3 . . 3.600 3.557 3.454 3.590 . 0 0 "[ . 1 . 2]" 1
748 1 74 GLN H 1 74 GLN HE22 . . 5.110 5.070 4.713 5.185 0.075 13 0 "[ . 1 . 2]" 1
749 1 74 GLN H 1 74 GLN HG3 . . 3.700 2.888 2.166 3.504 . 0 0 "[ . 1 . 2]" 1
750 1 74 GLN H 1 75 HIS H . . 3.300 2.704 2.155 2.894 . 0 0 "[ . 1 . 2]" 1
751 1 74 GLN H 1 75 HIS HA . . 5.500 5.391 4.954 5.517 0.017 11 0 "[ . 1 . 2]" 1
752 1 74 GLN H 1 75 HIS HD2 . . 5.500 4.464 3.814 4.722 . 0 0 "[ . 1 . 2]" 1
753 1 74 GLN HA 1 74 GLN HE21 . . 5.500 3.715 2.102 5.061 . 0 0 "[ . 1 . 2]" 1
754 1 74 GLN HA 1 74 GLN HG3 . . 3.460 3.368 2.904 3.771 0.311 13 0 "[ . 1 . 2]" 1
755 1 74 GLN HB3 1 75 HIS H . . 3.770 3.580 3.151 3.839 0.069 4 0 "[ . 1 . 2]" 1
756 1 74 GLN HB3 1 75 HIS HA . . 4.750 4.510 4.073 4.795 0.045 11 0 "[ . 1 . 2]" 1
757 1 74 GLN HB3 1 75 HIS HD2 . . 3.740 3.037 2.415 3.711 . 0 0 "[ . 1 . 2]" 1
758 1 74 GLN HE21 1 75 HIS H . . 5.500 5.233 4.259 5.573 0.073 10 0 "[ . 1 . 2]" 1
759 1 74 GLN HG3 1 75 HIS H . . 5.230 4.633 4.244 5.003 . 0 0 "[ . 1 . 2]" 1
760 1 75 HIS H 1 75 HIS HB3 . . 3.580 3.693 3.554 3.810 0.230 11 0 "[ . 1 . 2]" 1
761 1 75 HIS H 1 75 HIS HD2 . . 3.730 3.112 2.696 3.546 . 0 0 "[ . 1 . 2]" 1
762 1 75 HIS H 1 76 GLY H . . 3.060 2.757 2.411 3.022 . 0 0 "[ . 1 . 2]" 1
763 1 75 HIS HB3 1 75 HIS HD2 . . 3.750 3.861 3.759 3.934 0.184 6 0 "[ . 1 . 2]" 1
764 1 75 HIS HB3 1 76 GLY H . . 4.350 2.843 2.594 3.220 . 0 0 "[ . 1 . 2]" 1
765 1 75 HIS HB3 1 79 GLU H . . 5.440 4.273 3.710 4.828 . 0 0 "[ . 1 . 2]" 1
766 1 75 HIS HB3 1 80 THR H . . 5.480 4.815 4.188 5.295 . 0 0 "[ . 1 . 2]" 1
767 1 76 GLY H 1 77 VAL H . . 4.270 4.268 4.117 4.319 0.049 10 0 "[ . 1 . 2]" 1
768 1 76 GLY H 1 79 GLU H . . 4.130 4.192 3.992 4.218 0.088 16 0 "[ . 1 . 2]" 1
769 1 76 GLY H 1 80 THR H . . 5.500 4.018 3.631 4.461 . 0 0 "[ . 1 . 2]" 1
770 1 76 GLY HA3 1 77 VAL H . . 3.350 2.748 2.513 3.004 . 0 0 "[ . 1 . 2]" 1
771 1 76 GLY HA3 1 77 VAL HA . . 4.980 4.724 4.660 4.786 . 0 0 "[ . 1 . 2]" 1
772 1 76 GLY HA3 1 78 GLU H . . 4.970 3.547 3.238 4.036 . 0 0 "[ . 1 . 2]" 1
773 1 77 VAL H 1 77 VAL HB . . 3.180 2.480 1.931 2.831 . 0 0 "[ . 1 . 2]" 1
774 1 77 VAL H 1 77 VAL QG . . 3.290 2.021 1.776 2.478 . 0 0 "[ . 1 . 2]" 1
775 1 77 VAL H 1 78 GLU H . . 3.640 2.833 2.375 3.200 . 0 0 "[ . 1 . 2]" 1
776 1 77 VAL H 1 80 THR H . . 5.500 4.750 4.596 4.898 . 0 0 "[ . 1 . 2]" 1
777 1 77 VAL HA 1 77 VAL QG . . 3.110 2.263 2.115 2.508 . 0 0 "[ . 1 . 2]" 1
778 1 77 VAL HA 1 79 GLU H . . 5.500 4.504 4.108 4.762 . 0 0 "[ . 1 . 2]" 1
779 1 77 VAL HA 1 80 THR H . . 4.150 3.357 2.995 3.679 . 0 0 "[ . 1 . 2]" 1
780 1 77 VAL HA 1 80 THR HB . . 4.090 2.876 2.183 4.031 . 0 0 "[ . 1 . 2]" 1
781 1 77 VAL HA 1 81 GLN H . . 4.980 4.500 3.639 5.047 0.067 5 0 "[ . 1 . 2]" 1
782 1 77 VAL HB 1 112 ALA HA . . 5.340 3.980 2.264 5.421 0.081 13 0 "[ . 1 . 2]" 1
783 1 77 VAL QG 1 78 GLU H . . 3.840 2.759 2.113 3.442 . 0 0 "[ . 1 . 2]" 1
784 1 77 VAL QG 1 78 GLU HA . . 4.380 3.461 3.091 3.970 . 0 0 "[ . 1 . 2]" 1
785 1 77 VAL QG 1 112 ALA H . . 4.260 2.838 2.258 3.288 . 0 0 "[ . 1 . 2]" 1
786 1 77 VAL QG 1 112 ALA HA . . 3.580 2.572 2.115 3.316 . 0 0 "[ . 1 . 2]" 1
787 1 78 GLU H 1 79 GLU H . . 3.310 2.755 2.414 2.937 . 0 0 "[ . 1 . 2]" 1
788 1 78 GLU H 1 80 THR H . . 4.790 3.978 3.744 4.128 . 0 0 "[ . 1 . 2]" 1
789 1 78 GLU HB3 1 79 GLU H . . 3.550 3.671 2.793 4.303 0.753 1 5 "[+* .** 1 - . 2]" 1
790 1 79 GLU H 1 79 GLU HB3 . . 3.660 3.511 3.340 3.654 . 0 0 "[ . 1 . 2]" 1
791 1 79 GLU H 1 79 GLU HG3 . . 3.520 3.317 2.348 3.690 0.170 5 0 "[ . 1 . 2]" 1
792 1 79 GLU H 1 80 THR H . . 3.470 2.546 2.258 2.781 . 0 0 "[ . 1 . 2]" 1
793 1 79 GLU H 1 81 GLN H . . 4.970 4.432 4.132 4.716 . 0 0 "[ . 1 . 2]" 1
794 1 79 GLU H 1 82 LYS H . . 5.500 5.222 4.841 5.566 0.066 15 0 "[ . 1 . 2]" 1
795 1 79 GLU HA 1 79 GLU HG3 . . 3.560 3.531 3.019 3.713 0.153 20 0 "[ . 1 . 2]" 1
796 1 79 GLU HA 1 82 LYS H . . 3.700 3.386 3.061 3.740 0.040 1 0 "[ . 1 . 2]" 1
797 1 80 THR H 1 80 THR HB . . 3.300 2.757 2.540 3.150 . 0 0 "[ . 1 . 2]" 1
798 1 80 THR H 1 80 THR MG . . 4.320 3.746 3.565 3.796 . 0 0 "[ . 1 . 2]" 1
799 1 80 THR H 1 81 GLN H . . 3.250 2.855 2.656 3.080 . 0 0 "[ . 1 . 2]" 1
800 1 80 THR H 1 109 LEU QD . . 5.500 3.926 3.327 4.382 . 0 0 "[ . 1 . 2]" 1
801 1 80 THR HA 1 80 THR MG . . 3.020 2.334 2.204 2.451 . 0 0 "[ . 1 . 2]" 1
802 1 80 THR HB 1 81 GLN H . . 3.690 2.847 2.545 3.180 . 0 0 "[ . 1 . 2]" 1
803 1 80 THR HB 1 109 LEU QD . . 3.420 2.105 1.843 2.402 . 0 0 "[ . 1 . 2]" 1
804 1 80 THR MG 1 81 GLN H . . 4.990 3.877 3.535 4.255 . 0 0 "[ . 1 . 2]" 1
805 1 80 THR MG 1 84 LEU H . . 5.500 4.168 3.765 4.980 . 0 0 "[ . 1 . 2]" 1
806 1 80 THR MG 1 84 LEU QD . . 2.920 2.466 1.946 2.934 0.014 18 0 "[ . 1 . 2]" 1
807 1 81 GLN H 1 82 LYS H . . 3.510 2.813 2.603 2.986 . 0 0 "[ . 1 . 2]" 1
808 1 81 GLN H 1 84 LEU QD . . 5.500 4.287 3.858 4.643 . 0 0 "[ . 1 . 2]" 1
809 1 81 GLN H 1 109 LEU QD . . 4.190 2.859 2.184 3.185 . 0 0 "[ . 1 . 2]" 1
810 1 81 GLN HA 1 81 GLN QE . . 4.390 3.816 2.619 4.492 0.102 10 0 "[ . 1 . 2]" 1
811 1 81 GLN HA 1 81 GLN HG3 . . 3.660 2.890 2.211 3.510 . 0 0 "[ . 1 . 2]" 1
812 1 81 GLN HA 1 84 LEU H . . 4.330 3.684 3.334 4.155 . 0 0 "[ . 1 . 2]" 1
813 1 81 GLN HA 1 84 LEU QD . . 3.150 2.634 2.177 3.121 . 0 0 "[ . 1 . 2]" 1
814 1 81 GLN HA 1 109 LEU HA . . 4.790 4.703 4.328 4.873 0.083 2 0 "[ . 1 . 2]" 1
815 1 81 GLN HA 1 109 LEU HB3 . . 4.910 3.433 2.917 4.082 . 0 0 "[ . 1 . 2]" 1
816 1 81 GLN HA 1 109 LEU QD . . 4.050 2.952 2.011 3.611 . 0 0 "[ . 1 . 2]" 1
817 1 81 GLN QE 1 82 LYS H . . 5.500 5.349 4.662 5.600 0.100 13 0 "[ . 1 . 2]" 1
818 1 81 GLN QE 1 84 LEU QD . . 5.420 3.708 2.240 5.180 . 0 0 "[ . 1 . 2]" 1
819 1 81 GLN QE 1 85 LEU H . . 5.400 4.831 3.586 5.482 0.082 5 0 "[ . 1 . 2]" 1
820 1 81 GLN QE 1 85 LEU QD . . 3.640 2.124 1.809 2.844 . 0 0 "[ . 1 . 2]" 1
821 1 81 GLN QE 1 85 LEU HG . . 3.880 3.701 2.413 3.978 0.098 14 0 "[ . 1 . 2]" 1
822 1 81 GLN QE 1 108 LYS H . . 5.500 4.838 3.943 5.581 0.081 5 0 "[ . 1 . 2]" 1
823 1 81 GLN QE 1 108 LYS HA . . 3.660 2.511 1.919 3.152 . 0 0 "[ . 1 . 2]" 1
824 1 81 GLN QE 1 108 LYS HB3 . . 5.350 4.615 3.382 5.421 0.071 5 0 "[ . 1 . 2]" 1
825 1 81 GLN QE 1 109 LEU H . . 4.620 3.227 2.315 3.815 . 0 0 "[ . 1 . 2]" 1
826 1 81 GLN HG3 1 82 LYS H . . 5.040 3.826 3.310 4.460 . 0 0 "[ . 1 . 2]" 1
827 1 81 GLN HG3 1 85 LEU QD . . 4.460 2.520 2.087 3.371 . 0 0 "[ . 1 . 2]" 1
828 1 82 LYS H 1 83 ALA H . . 3.320 2.611 2.273 2.879 . 0 0 "[ . 1 . 2]" 1
829 1 82 LYS H 1 83 ALA MB . . 4.600 4.237 3.924 4.455 . 0 0 "[ . 1 . 2]" 1
830 1 82 LYS H 1 84 LEU H . . 4.890 4.260 3.854 4.800 . 0 0 "[ . 1 . 2]" 1
831 1 82 LYS H 1 84 LEU QD . . 5.500 4.797 4.022 5.135 . 0 0 "[ . 1 . 2]" 1
832 1 82 LYS H 1 85 LEU QD . . 5.500 4.297 3.983 4.533 . 0 0 "[ . 1 . 2]" 1
833 1 82 LYS HA 1 82 LYS HG3 . . 3.670 3.347 2.156 3.941 0.271 8 0 "[ . 1 . 2]" 1
834 1 82 LYS HA 1 83 ALA H . . 3.460 3.530 3.511 3.540 0.080 6 0 "[ . 1 . 2]" 1
835 1 82 LYS HA 1 85 LEU QD . . 3.270 2.637 1.941 3.326 0.056 4 0 "[ . 1 . 2]" 1
836 1 83 ALA H 1 83 ALA MB . . 2.820 2.220 2.156 2.266 . 0 0 "[ . 1 . 2]" 1
837 1 83 ALA H 1 84 LEU H . . 3.320 3.011 2.830 3.274 . 0 0 "[ . 1 . 2]" 1
838 1 83 ALA H 1 86 GLU H . . 5.500 4.909 4.751 5.188 . 0 0 "[ . 1 . 2]" 1
839 1 83 ALA HA 1 86 GLU H . . 3.820 3.624 3.338 3.882 0.062 3 0 "[ . 1 . 2]" 1
840 1 83 ALA HA 1 86 GLU HB3 . . 3.400 3.204 2.668 3.641 0.241 8 0 "[ . 1 . 2]" 1
841 1 83 ALA MB 1 84 LEU H . . 3.170 2.738 2.404 3.255 0.085 5 0 "[ . 1 . 2]" 1
842 1 84 LEU H 1 84 LEU HB3 . . 3.570 3.584 3.461 3.643 0.073 17 0 "[ . 1 . 2]" 1
843 1 84 LEU H 1 84 LEU QD . . 3.800 2.420 1.700 2.984 . 0 0 "[ . 1 . 2]" 1
844 1 84 LEU H 1 84 LEU HG . . 3.480 2.705 1.964 3.578 0.098 12 0 "[ . 1 . 2]" 1
845 1 84 LEU H 1 85 LEU H . . 3.350 2.761 2.361 3.114 . 0 0 "[ . 1 . 2]" 1
846 1 84 LEU H 1 86 GLU H . . 4.430 4.298 3.782 4.496 0.066 20 0 "[ . 1 . 2]" 1
847 1 84 LEU H 1 87 ALA MB . . 5.320 4.788 4.354 5.173 . 0 0 "[ . 1 . 2]" 1
848 1 84 LEU HA 1 84 LEU HB3 . . 2.980 2.402 2.198 2.632 . 0 0 "[ . 1 . 2]" 1
849 1 84 LEU HA 1 84 LEU QD . . 2.850 2.451 2.233 2.726 . 0 0 "[ . 1 . 2]" 1
850 1 84 LEU HA 1 84 LEU HG . . 3.690 3.242 2.255 3.762 0.072 16 0 "[ . 1 . 2]" 1
851 1 84 LEU HB3 1 85 LEU H . . 3.810 3.545 2.883 3.887 0.077 20 0 "[ . 1 . 2]" 1
852 1 84 LEU QD 1 85 LEU H . . 4.830 3.795 2.996 4.083 . 0 0 "[ . 1 . 2]" 1
853 1 84 LEU QD 1 85 LEU QD . . 3.960 3.453 3.125 3.682 . 0 0 "[ . 1 . 2]" 1
854 1 84 LEU QD 1 87 ALA MB . . 4.540 4.111 3.552 4.487 . 0 0 "[ . 1 . 2]" 1
855 1 84 LEU QD 1 107 THR HB . . 4.760 3.047 2.191 4.491 . 0 0 "[ . 1 . 2]" 1
856 1 84 LEU QD 1 107 THR MG . . 2.950 2.271 1.994 2.827 . 0 0 "[ . 1 . 2]" 1
857 1 84 LEU QD 1 108 LYS H . . 4.570 3.361 2.566 4.188 . 0 0 "[ . 1 . 2]" 1
858 1 84 LEU QD 1 109 LEU H . . 5.500 3.170 2.605 3.961 . 0 0 "[ . 1 . 2]" 1
859 1 84 LEU QD 1 109 LEU HA . . 3.710 2.884 2.501 3.291 . 0 0 "[ . 1 . 2]" 1
860 1 84 LEU QD 1 109 LEU HB3 . . 3.950 3.780 3.432 4.248 0.298 4 0 "[ . 1 . 2]" 1
861 1 85 LEU H 1 85 LEU HB3 . . 3.160 3.575 3.514 3.665 0.505 2 2 "[ + . 1 - . 2]" 1
862 1 85 LEU H 1 85 LEU QD . . 3.680 2.487 1.662 3.138 . 0 0 "[ . 1 . 2]" 1
863 1 85 LEU H 1 86 GLU H . . 3.310 2.657 2.488 2.877 . 0 0 "[ . 1 . 2]" 1
864 1 85 LEU HA 1 85 LEU QD . . 2.780 2.131 1.961 2.500 . 0 0 "[ . 1 . 2]" 1
865 1 85 LEU HA 1 85 LEU HG . . 3.910 3.415 2.720 3.838 . 0 0 "[ . 1 . 2]" 1
866 1 85 LEU HA 1 88 GLU HB3 . . 3.940 4.793 4.124 5.364 1.424 14 17 "[******* *****+* *- *]" 1
867 1 85 LEU HB3 1 86 GLU H . . 3.620 3.448 3.138 3.837 0.217 5 0 "[ . 1 . 2]" 1
868 1 85 LEU QD 1 86 GLU H . . 4.620 3.859 3.194 4.175 . 0 0 "[ . 1 . 2]" 1
869 1 85 LEU QD 1 88 GLU HG3 . . 5.050 3.675 2.849 4.381 . 0 0 "[ . 1 . 2]" 1
870 1 85 LEU QD 1 106 GLU HA . . 5.130 3.796 3.189 4.729 . 0 0 "[ . 1 . 2]" 1
871 1 85 LEU QD 1 107 THR H . . 4.120 2.914 2.259 4.004 . 0 0 "[ . 1 . 2]" 1
872 1 85 LEU QD 1 107 THR HB . . 3.720 2.794 2.028 3.734 0.014 20 0 "[ . 1 . 2]" 1
873 1 85 LEU HG 1 86 GLU H . . 4.740 4.610 4.100 4.831 0.091 1 0 "[ . 1 . 2]" 1
874 1 86 GLU H 1 86 GLU HB3 . . 3.080 3.094 2.796 3.238 0.158 5 0 "[ . 1 . 2]" 1
875 1 86 GLU H 1 86 GLU HG3 . . 3.740 3.719 3.192 3.902 0.162 15 0 "[ . 1 . 2]" 1
876 1 86 GLU H 1 87 ALA H . . 3.300 2.747 2.497 2.959 . 0 0 "[ . 1 . 2]" 1
877 1 86 GLU H 1 87 ALA MB . . 4.960 4.486 4.288 4.633 . 0 0 "[ . 1 . 2]" 1
878 1 86 GLU H 1 88 GLU H . . 4.370 4.287 4.078 4.440 0.070 14 0 "[ . 1 . 2]" 1
879 1 86 GLU HA 1 86 GLU HB3 . . 2.850 2.932 2.762 3.028 0.178 16 0 "[ . 1 . 2]" 1
880 1 86 GLU HA 1 86 GLU HG3 . . 3.510 2.676 2.299 3.626 0.116 15 0 "[ . 1 . 2]" 1
881 1 86 GLU HB3 1 87 ALA H . . 3.560 3.125 2.633 3.621 0.061 13 0 "[ . 1 . 2]" 1
882 1 87 ALA H 1 87 ALA MB . . 2.750 2.305 2.226 2.358 . 0 0 "[ . 1 . 2]" 1
883 1 87 ALA H 1 89 GLU H . . 4.140 4.114 3.797 4.221 0.081 20 0 "[ . 1 . 2]" 1
884 1 87 ALA HA 1 89 GLU H . . 4.860 4.335 3.873 4.815 . 0 0 "[ . 1 . 2]" 1
885 1 87 ALA HA 1 90 LYS H . . 4.080 3.726 3.230 4.134 0.054 12 0 "[ . 1 . 2]" 1
886 1 87 ALA MB 1 88 GLU H . . 3.660 2.702 2.159 3.182 . 0 0 "[ . 1 . 2]" 1
887 1 87 ALA MB 1 89 GLU H . . 4.780 4.592 4.458 4.830 0.050 4 0 "[ . 1 . 2]" 1
888 1 87 ALA MB 1 90 LYS H . . 5.180 4.688 4.339 5.035 . 0 0 "[ . 1 . 2]" 1
889 1 88 GLU H 1 88 GLU HB3 . . 3.190 3.643 3.584 3.736 0.546 14 3 "[ *. - 1 +. 2]" 1
890 1 88 GLU H 1 88 GLU HG3 . . 3.810 3.456 2.171 3.869 0.059 7 0 "[ . 1 . 2]" 1
891 1 88 GLU H 1 89 GLU H . . 3.370 2.650 2.086 3.068 . 0 0 "[ . 1 . 2]" 1
892 1 88 GLU H 1 90 LYS H . . 5.340 4.180 3.645 4.451 . 0 0 "[ . 1 . 2]" 1
893 1 88 GLU H 1 94 ILE MD . . 5.370 4.375 3.849 4.644 . 0 0 "[ . 1 . 2]" 1
894 1 88 GLU HA 1 88 GLU HG3 . . 3.680 3.715 3.324 3.774 0.094 16 0 "[ . 1 . 2]" 1
895 1 88 GLU HA 1 90 LYS H . . 4.670 4.018 3.763 4.511 . 0 0 "[ . 1 . 2]" 1
896 1 88 GLU HA 1 91 ASP H . . 4.340 3.535 3.114 3.902 . 0 0 "[ . 1 . 2]" 1
897 1 88 GLU HA 1 91 ASP HB3 . . 3.910 3.487 2.777 3.891 . 0 0 "[ . 1 . 2]" 1
898 1 88 GLU HA 1 94 ILE MD . . 3.480 2.113 1.959 2.572 . 0 0 "[ . 1 . 2]" 1
899 1 88 GLU HA 1 94 ILE HG13 . . 5.310 4.528 3.814 4.787 . 0 0 "[ . 1 . 2]" 1
900 1 88 GLU HA 1 94 ILE MG . . 4.020 3.482 2.234 4.017 . 0 0 "[ . 1 . 2]" 1
901 1 88 GLU HB3 1 88 GLU HG3 . . 2.480 2.446 2.251 3.043 0.563 5 2 "[ + 1 . -]" 1
902 1 88 GLU HB3 1 89 GLU H . . 3.460 3.853 3.440 4.014 0.554 15 6 "[- **. 1* *+ 2]" 1
903 1 88 GLU HB3 1 90 LYS H . . 4.910 5.374 5.080 5.618 0.708 7 8 "[ **** + 1-* . *]" 1
904 1 88 GLU HB3 1 94 ILE MD . . 4.800 2.638 2.135 3.829 . 0 0 "[ . 1 . 2]" 1
905 1 88 GLU HB3 1 105 LEU QD . . 4.500 2.921 2.292 3.484 . 0 0 "[ . 1 . 2]" 1
906 1 88 GLU HG3 1 89 GLU H . . 4.990 4.823 3.735 5.072 0.082 6 0 "[ . 1 . 2]" 1
907 1 88 GLU HG3 1 105 LEU QD . . 3.780 3.045 2.098 3.857 0.077 4 0 "[ . 1 . 2]" 1
908 1 89 GLU H 1 89 GLU HG3 . . 3.650 2.970 2.113 3.680 0.030 16 0 "[ . 1 . 2]" 1
909 1 89 GLU H 1 90 LYS H . . 3.360 2.662 2.466 2.898 . 0 0 "[ . 1 . 2]" 1
910 1 89 GLU H 1 91 ASP H . . 4.950 4.223 3.931 4.446 . 0 0 "[ . 1 . 2]" 1
911 1 89 GLU H 1 94 ILE MG . . 5.500 5.063 4.654 5.563 0.063 15 0 "[ . 1 . 2]" 1
912 1 89 GLU HA 1 89 GLU HG3 . . 3.640 3.664 3.308 3.711 0.071 19 0 "[ . 1 . 2]" 1
913 1 89 GLU HA 1 91 ASP H . . 4.930 4.157 3.737 4.794 . 0 0 "[ . 1 . 2]" 1
914 1 89 GLU HG3 1 91 ASP H . . 5.430 5.039 4.631 6.084 0.654 17 1 "[ . 1 . + 2]" 1
915 1 90 LYS H 1 90 LYS HB3 . . 3.260 2.993 2.623 3.326 0.066 8 0 "[ . 1 . 2]" 1
916 1 90 LYS H 1 91 ASP H . . 3.230 2.378 2.096 2.784 . 0 0 "[ . 1 . 2]" 1
917 1 90 LYS H 1 91 ASP HA . . 5.270 4.712 4.248 5.126 . 0 0 "[ . 1 . 2]" 1
918 1 90 LYS H 1 91 ASP HB3 . . 5.150 4.870 4.338 5.302 0.152 2 0 "[ . 1 . 2]" 1
919 1 90 LYS H 1 95 ILE MD . . 5.360 4.466 3.788 4.951 . 0 0 "[ . 1 . 2]" 1
920 1 90 LYS HA 1 95 ILE MD . . 3.470 2.607 2.051 3.398 . 0 0 "[ . 1 . 2]" 1
921 1 90 LYS HG3 1 91 ASP HA . . 4.910 4.327 3.464 6.023 1.113 20 2 "[ - . 1 . +]" 1
922 1 91 ASP H 1 91 ASP HB3 . . 3.370 2.701 2.534 3.004 . 0 0 "[ . 1 . 2]" 1
923 1 91 ASP H 1 92 LYS H . . 4.950 4.411 3.715 4.589 . 0 0 "[ . 1 . 2]" 1
924 1 91 ASP H 1 93 SER H . . 5.500 5.527 5.245 5.578 0.078 5 0 "[ . 1 . 2]" 1
925 1 91 ASP H 1 94 ILE H . . 5.500 4.636 3.969 4.999 . 0 0 "[ . 1 . 2]" 1
926 1 91 ASP H 1 94 ILE MD . . 4.750 3.692 2.946 4.221 . 0 0 "[ . 1 . 2]" 1
927 1 91 ASP H 1 95 ILE MD . . 4.610 3.692 2.381 4.611 0.001 16 0 "[ . 1 . 2]" 1
928 1 91 ASP HA 1 92 LYS H . . 2.570 2.223 2.144 2.415 . 0 0 "[ . 1 . 2]" 1
929 1 91 ASP HA 1 94 ILE H . . 4.800 4.445 4.288 4.671 . 0 0 "[ . 1 . 2]" 1
930 1 91 ASP HA 1 94 ILE MD . . 4.620 4.568 4.368 4.696 0.076 20 0 "[ . 1 . 2]" 1
931 1 91 ASP HB3 1 94 ILE H . . 4.410 2.613 2.311 3.241 . 0 0 "[ . 1 . 2]" 1
932 1 91 ASP HB3 1 94 ILE HB . . 3.500 2.196 1.998 3.257 . 0 0 "[ . 1 . 2]" 1
933 1 91 ASP HB3 1 94 ILE MD . . 3.620 2.236 2.100 2.345 . 0 0 "[ . 1 . 2]" 1
934 1 91 ASP HB3 1 94 ILE HG13 . . 5.140 2.655 2.372 3.812 . 0 0 "[ . 1 . 2]" 1
935 1 92 LYS H 1 93 SER H . . 3.510 2.872 2.579 3.610 0.100 16 0 "[ . 1 . 2]" 1
936 1 92 LYS H 1 94 ILE H . . 5.500 4.283 3.991 4.600 . 0 0 "[ . 1 . 2]" 1
937 1 92 LYS H 1 95 ILE MD . . 5.060 3.668 2.520 4.205 . 0 0 "[ . 1 . 2]" 1
938 1 92 LYS HA 1 95 ILE H . . 4.000 3.514 3.053 3.816 . 0 0 "[ . 1 . 2]" 1
939 1 92 LYS HA 1 95 ILE HB . . 3.110 2.603 2.246 3.080 . 0 0 "[ . 1 . 2]" 1
940 1 92 LYS HA 1 95 ILE MD . . 3.170 2.283 2.101 2.790 . 0 0 "[ . 1 . 2]" 1
941 1 92 LYS HA 1 96 GLU H . . 4.090 4.039 3.748 4.164 0.074 15 0 "[ . 1 . 2]" 1
942 1 93 SER H 1 94 ILE H . . 3.070 2.527 2.331 2.680 . 0 0 "[ . 1 . 2]" 1
943 1 93 SER H 1 94 ILE HA . . 5.170 5.163 4.996 5.242 0.072 10 0 "[ . 1 . 2]" 1
944 1 93 SER HA 1 95 ILE H . . 5.500 4.641 4.298 4.873 . 0 0 "[ . 1 . 2]" 1
945 1 93 SER HA 1 96 GLU H . . 3.940 3.702 3.249 4.014 0.074 13 0 "[ . 1 . 2]" 1
946 1 94 ILE H 1 94 ILE HB . . 3.340 2.506 2.254 2.614 . 0 0 "[ . 1 . 2]" 1
947 1 94 ILE H 1 94 ILE HG13 . . 4.100 2.452 1.934 4.064 . 0 0 "[ . 1 . 2]" 1
948 1 94 ILE H 1 94 ILE MG . . 4.110 3.793 3.681 3.866 . 0 0 "[ . 1 . 2]" 1
949 1 94 ILE H 1 95 ILE H . . 3.260 2.519 1.964 2.851 . 0 0 "[ . 1 . 2]" 1
950 1 94 ILE HA 1 94 ILE MD . . 3.940 3.816 2.714 3.950 0.010 16 0 "[ . 1 . 2]" 1
951 1 94 ILE HA 1 94 ILE HG13 . . 3.740 2.940 2.772 3.265 . 0 0 "[ . 1 . 2]" 1
952 1 94 ILE HA 1 94 ILE MG . . 3.360 2.424 2.277 2.608 . 0 0 "[ . 1 . 2]" 1
953 1 94 ILE HA 1 97 ALA H . . 4.150 3.294 2.935 3.579 . 0 0 "[ . 1 . 2]" 1
954 1 94 ILE HA 1 97 ALA MB . . 3.370 2.710 2.181 3.408 0.038 2 0 "[ . 1 . 2]" 1
955 1 94 ILE HA 1 98 ARG H . . 5.200 4.088 3.785 4.662 . 0 0 "[ . 1 . 2]" 1
956 1 94 ILE HB 1 94 ILE MD . . 3.220 2.467 2.209 2.725 . 0 0 "[ . 1 . 2]" 1
957 1 94 ILE HB 1 95 ILE H . . 3.790 2.792 2.540 3.050 . 0 0 "[ . 1 . 2]" 1
958 1 94 ILE HB 1 95 ILE HB . . 5.110 5.116 4.822 5.201 0.091 16 0 "[ . 1 . 2]" 1
959 1 94 ILE MD 1 95 ILE H . . 5.500 4.734 4.216 4.926 . 0 0 "[ . 1 . 2]" 1
960 1 94 ILE MG 1 95 ILE H . . 4.100 3.512 2.939 4.014 . 0 0 "[ . 1 . 2]" 1
961 1 94 ILE MG 1 97 ALA H . . 4.480 4.478 4.198 4.576 0.096 20 0 "[ . 1 . 2]" 1
962 1 94 ILE MG 1 98 ARG H . . 4.640 3.819 3.570 4.350 . 0 0 "[ . 1 . 2]" 1
963 1 94 ILE MG 1 98 ARG HD3 . . 3.910 3.042 2.150 3.993 0.083 18 0 "[ . 1 . 2]" 1
964 1 95 ILE H 1 95 ILE HB . . 3.250 2.409 2.247 2.527 . 0 0 "[ . 1 . 2]" 1
965 1 95 ILE H 1 95 ILE MD . . 3.890 3.324 3.079 3.710 . 0 0 "[ . 1 . 2]" 1
966 1 95 ILE H 1 95 ILE HG13 . . 3.810 2.186 2.045 2.448 . 0 0 "[ . 1 . 2]" 1
967 1 95 ILE H 1 95 ILE MG . . 4.090 3.775 3.702 3.820 . 0 0 "[ . 1 . 2]" 1
968 1 95 ILE H 1 96 GLU H . . 3.560 2.805 2.561 2.923 . 0 0 "[ . 1 . 2]" 1
969 1 95 ILE H 1 97 ALA H . . 4.610 4.266 3.793 4.663 0.053 2 0 "[ . 1 . 2]" 1
970 1 95 ILE HA 1 95 ILE MD . . 3.950 3.870 3.785 3.924 . 0 0 "[ . 1 . 2]" 1
971 1 95 ILE HA 1 95 ILE HG13 . . 3.500 2.762 2.619 2.917 . 0 0 "[ . 1 . 2]" 1
972 1 95 ILE HA 1 95 ILE MG . . 3.230 2.540 2.427 2.682 . 0 0 "[ . 1 . 2]" 1
973 1 95 ILE HA 1 98 ARG H . . 4.200 3.385 3.000 3.688 . 0 0 "[ . 1 . 2]" 1
974 1 95 ILE HB 1 95 ILE MD . . 3.160 2.312 2.239 2.415 . 0 0 "[ . 1 . 2]" 1
975 1 95 ILE HB 1 96 GLU H . . 3.320 2.620 2.422 2.771 . 0 0 "[ . 1 . 2]" 1
976 1 95 ILE MD 1 96 GLU H . . 4.420 4.481 4.381 4.515 0.095 4 0 "[ . 1 . 2]" 1
977 1 95 ILE HG13 1 95 ILE MG . . 3.440 3.214 3.179 3.243 . 0 0 "[ . 1 . 2]" 1
978 1 95 ILE HG13 1 96 GLU H . . 5.290 4.402 4.284 4.423 . 0 0 "[ . 1 . 2]" 1
979 1 95 ILE MG 1 96 GLU H . . 3.780 3.296 2.771 3.613 . 0 0 "[ . 1 . 2]" 1
980 1 95 ILE MG 1 96 GLU HA . . 3.580 3.441 3.042 3.667 0.087 9 0 "[ . 1 . 2]" 1
981 1 96 GLU H 1 97 ALA H . . 3.500 2.829 2.605 3.057 . 0 0 "[ . 1 . 2]" 1
982 1 96 GLU H 1 97 ALA MB . . 4.900 4.486 4.286 4.749 . 0 0 "[ . 1 . 2]" 1
983 1 96 GLU H 1 98 ARG H . . 5.500 4.233 4.000 4.488 . 0 0 "[ . 1 . 2]" 1
984 1 96 GLU HA 1 98 ARG H . . 5.010 4.516 4.172 4.825 . 0 0 "[ . 1 . 2]" 1
985 1 96 GLU HA 1 99 LYS H . . 4.410 3.971 3.599 4.479 0.069 14 0 "[ . 1 . 2]" 1
986 1 96 GLU HA 1 99 LYS HG3 . . 4.380 3.697 2.550 5.605 1.225 15 4 "[ . -* 1 +* 2]" 1
987 1 97 ALA H 1 97 ALA MB . . 3.000 2.228 2.049 2.309 . 0 0 "[ . 1 . 2]" 1
988 1 97 ALA H 1 98 ARG H . . 3.440 2.599 2.257 2.883 . 0 0 "[ . 1 . 2]" 1
989 1 97 ALA HA 1 99 LYS H . . 5.150 3.739 3.417 3.974 . 0 0 "[ . 1 . 2]" 1
990 1 97 ALA HA 1 100 LEU H . . 4.430 3.924 3.678 4.263 . 0 0 "[ . 1 . 2]" 1
991 1 97 ALA HA 1 100 LEU QD . . 3.400 2.494 2.192 2.894 . 0 0 "[ . 1 . 2]" 1
992 1 97 ALA HA 1 100 LEU HG . . 3.880 3.520 2.667 3.976 0.096 15 0 "[ . 1 . 2]" 1
993 1 97 ALA MB 1 98 ARG H . . 3.590 2.655 2.415 2.879 . 0 0 "[ . 1 . 2]" 1
994 1 97 ALA MB 1 98 ARG HA . . 5.140 3.923 3.759 4.091 . 0 0 "[ . 1 . 2]" 1
995 1 97 ALA MB 1 103 PHE QE . . 3.110 2.721 2.552 2.867 . 0 0 "[ . 1 . 2]" 1
996 1 97 ALA MB 1 103 PHE HZ . . 3.250 3.035 2.831 3.342 0.092 2 0 "[ . 1 . 2]" 1
997 1 97 ALA MB 1 136 HIS HB3 . . 4.130 3.571 2.694 4.493 0.363 15 0 "[ . 1 . 2]" 1
998 1 97 ALA MB 1 136 HIS HD2 . . 5.190 3.503 2.077 4.957 . 0 0 "[ . 1 . 2]" 1
999 1 98 ARG H 1 98 ARG HB3 . . 4.160 3.594 3.390 3.692 . 0 0 "[ . 1 . 2]" 1
1000 1 98 ARG H 1 98 ARG HD3 . . 5.110 4.540 3.454 4.993 . 0 0 "[ . 1 . 2]" 1
1001 1 98 ARG H 1 98 ARG HG3 . . 3.470 3.011 2.194 3.488 0.018 17 0 "[ . 1 . 2]" 1
1002 1 98 ARG H 1 99 LYS H . . 3.580 2.923 2.730 3.030 . 0 0 "[ . 1 . 2]" 1
1003 1 98 ARG H 1 103 PHE QD . . 4.960 3.912 3.626 4.264 . 0 0 "[ . 1 . 2]" 1
1004 1 98 ARG HA 1 98 ARG HD3 . . 5.160 4.162 2.938 4.971 . 0 0 "[ . 1 . 2]" 1
1005 1 98 ARG HA 1 98 ARG HG3 . . 4.130 3.471 2.280 3.841 . 0 0 "[ . 1 . 2]" 1
1006 1 98 ARG HA 1 100 LEU H . . 4.050 3.549 2.883 3.971 . 0 0 "[ . 1 . 2]" 1
1007 1 98 ARG HA 1 103 PHE QD . . 3.270 2.284 2.105 2.683 . 0 0 "[ . 1 . 2]" 1
1008 1 98 ARG HB3 1 98 ARG HD3 . . 4.090 3.250 2.403 3.724 . 0 0 "[ . 1 . 2]" 1
1009 1 98 ARG HB3 1 99 LYS H . . 4.490 4.164 3.791 4.536 0.046 5 0 "[ . 1 . 2]" 1
1010 1 98 ARG HB3 1 103 PHE QD . . 4.570 4.396 4.026 4.729 0.159 2 0 "[ . 1 . 2]" 1
1011 1 98 ARG HB3 1 103 PHE QE . . 4.720 4.887 4.789 5.473 0.753 2 3 "[ + . 1 .- *]" 1
1012 1 98 ARG HD3 1 103 PHE QE . . 5.040 3.762 2.417 5.117 0.077 2 0 "[ . 1 . 2]" 1
1013 1 98 ARG HG3 1 103 PHE QD . . 4.430 4.374 2.537 5.154 0.724 4 5 "[ +. -* . ** 2]" 1
1014 1 98 ARG HG3 1 103 PHE QE . . 5.390 3.552 2.171 4.273 . 0 0 "[ . 1 . 2]" 1
1015 1 99 LYS H 1 99 LYS HB3 . . 3.510 3.382 2.298 3.587 0.077 14 0 "[ . 1 . 2]" 1
1016 1 99 LYS H 1 99 LYS HG3 . . 3.800 2.863 2.197 3.960 0.160 8 0 "[ . 1 . 2]" 1
1017 1 99 LYS H 1 100 LEU H . . 3.140 2.656 2.395 2.895 . 0 0 "[ . 1 . 2]" 1
1018 1 99 LYS H 1 100 LEU QD . . 4.600 3.997 2.825 4.594 . 0 0 "[ . 1 . 2]" 1
1019 1 99 LYS HA 1 99 LYS HG3 . . 3.920 3.139 2.470 3.879 . 0 0 "[ . 1 . 2]" 1
1020 1 99 LYS HB3 1 100 LEU H . . 4.530 4.039 3.575 4.346 . 0 0 "[ . 1 . 2]" 1
1021 1 100 LEU H 1 100 LEU HB3 . . 3.600 3.555 3.414 3.668 0.068 3 0 "[ . 1 . 2]" 1
1022 1 100 LEU H 1 100 LEU QD . . 4.000 2.821 2.109 3.246 . 0 0 "[ . 1 . 2]" 1
1023 1 100 LEU H 1 100 LEU HG . . 3.490 2.767 2.183 3.583 0.093 19 0 "[ . 1 . 2]" 1
1024 1 100 LEU H 1 101 ALA H . . 4.620 4.555 4.307 4.674 0.054 12 0 "[ . 1 . 2]" 1
1025 1 100 LEU H 1 103 PHE H . . 5.110 5.023 4.455 5.187 0.077 10 0 "[ . 1 . 2]" 1
1026 1 100 LEU H 1 103 PHE QD . . 5.500 4.551 4.124 4.931 . 0 0 "[ . 1 . 2]" 1
1027 1 100 LEU H 1 126 LEU QD . . 5.500 4.949 4.458 5.372 . 0 0 "[ . 1 . 2]" 1
1028 1 100 LEU HA 1 100 LEU QD . . 2.950 2.323 2.155 2.506 . 0 0 "[ . 1 . 2]" 1
1029 1 100 LEU HA 1 101 ALA H . . 2.650 2.280 2.138 2.579 . 0 0 "[ . 1 . 2]" 1
1030 1 100 LEU HB3 1 101 ALA H . . 4.410 2.936 2.182 3.284 . 0 0 "[ . 1 . 2]" 1
1031 1 100 LEU HB3 1 102 GLY H . . 5.500 2.713 2.380 3.087 . 0 0 "[ . 1 . 2]" 1
1032 1 100 LEU HB3 1 103 PHE H . . 4.810 3.961 3.538 4.496 . 0 0 "[ . 1 . 2]" 1
1033 1 100 LEU HB3 1 103 PHE HB3 . . 4.070 3.777 3.476 4.131 0.061 2 0 "[ . 1 . 2]" 1
1034 1 100 LEU QD 1 101 ALA H . . 3.840 3.564 3.065 3.822 . 0 0 "[ . 1 . 2]" 1
1035 1 100 LEU QD 1 103 PHE H . . 4.900 4.565 4.097 5.009 0.109 14 0 "[ . 1 . 2]" 1
1036 1 100 LEU QD 1 103 PHE HB3 . . 5.350 3.361 2.641 4.198 . 0 0 "[ . 1 . 2]" 1
1037 1 100 LEU QD 1 103 PHE QD . . 5.020 3.865 3.247 4.863 . 0 0 "[ . 1 . 2]" 1
1038 1 100 LEU QD 1 126 LEU QD . . 3.220 1.918 1.787 2.130 . 0 0 "[ . 1 . 2]" 1
1039 1 100 LEU QD 1 127 ASP H . . 4.630 2.159 1.663 2.789 . 0 0 "[ . 1 . 2]" 1
1040 1 100 LEU QD 1 127 ASP HB3 . . 4.820 3.018 2.022 3.712 . 0 0 "[ . 1 . 2]" 1
1041 1 100 LEU QD 1 131 ALA H . . 4.150 3.349 2.921 3.869 . 0 0 "[ . 1 . 2]" 1
1042 1 100 LEU QD 1 131 ALA HA . . 3.710 2.833 2.328 3.547 . 0 0 "[ . 1 . 2]" 1
1043 1 100 LEU HG 1 103 PHE HB3 . . 5.090 4.411 3.824 4.780 . 0 0 "[ . 1 . 2]" 1
1044 1 101 ALA H 1 101 ALA MB . . 2.820 2.321 2.196 2.477 . 0 0 "[ . 1 . 2]" 1
1045 1 101 ALA H 1 102 GLY H . . 4.660 2.824 2.510 3.089 . 0 0 "[ . 1 . 2]" 1
1046 1 101 ALA H 1 103 PHE H . . 5.500 4.788 4.321 5.125 . 0 0 "[ . 1 . 2]" 1
1047 1 101 ALA HA 1 102 GLY H . . 2.800 2.881 2.873 2.891 0.091 4 0 "[ . 1 . 2]" 1
1048 1 101 ALA HA 1 102 GLY HA2 . . 4.800 4.485 4.371 4.630 . 0 0 "[ . 1 . 2]" 1
1049 1 101 ALA HA 1 103 PHE H . . 3.960 3.949 3.665 4.043 0.083 19 0 "[ . 1 . 2]" 1
1050 1 101 ALA HA 1 125 VAL QG . . 4.760 4.346 3.583 4.612 . 0 0 "[ . 1 . 2]" 1
1051 1 101 ALA MB 1 102 GLY H . . 3.590 3.565 3.479 3.633 0.043 11 0 "[ . 1 . 2]" 1
1052 1 101 ALA MB 1 102 GLY HA2 . . 5.500 4.427 4.243 4.566 . 0 0 "[ . 1 . 2]" 1
1053 1 101 ALA MB 1 103 PHE H . . 5.500 4.974 4.748 5.117 . 0 0 "[ . 1 . 2]" 1
1054 1 101 ALA MB 1 125 VAL HA . . 5.260 4.586 4.237 4.954 . 0 0 "[ . 1 . 2]" 1
1055 1 101 ALA MB 1 125 VAL HB . . 4.100 3.140 2.637 4.221 0.121 9 0 "[ . 1 . 2]" 1
1056 1 101 ALA MB 1 125 VAL QG . . 3.380 2.861 1.896 3.202 . 0 0 "[ . 1 . 2]" 1
1057 1 102 GLY H 1 103 PHE H . . 3.320 2.108 1.836 2.265 . 0 0 "[ . 1 . 2]" 1
1058 1 102 GLY H 1 125 VAL QG . . 4.250 3.840 3.031 4.199 . 0 0 "[ . 1 . 2]" 1
1059 1 102 GLY HA2 1 122 ASP H . . 4.650 3.683 3.420 3.889 . 0 0 "[ . 1 . 2]" 1
1060 1 102 GLY HA2 1 122 ASP HB3 . . 3.990 3.194 2.637 3.799 . 0 0 "[ . 1 . 2]" 1
1061 1 102 GLY HA2 1 125 VAL HB . . 4.230 4.109 3.626 4.330 0.100 4 0 "[ . 1 . 2]" 1
1062 1 102 GLY HA2 1 125 VAL QG . . 3.460 2.287 1.862 2.699 . 0 0 "[ . 1 . 2]" 1
1063 1 102 GLY HA3 1 122 ASP HB3 . . 4.520 3.599 3.008 4.592 0.072 18 0 "[ . 1 . 2]" 1
1064 1 102 GLY HA3 1 125 VAL HB . . 4.340 3.807 3.297 4.426 0.086 17 0 "[ . 1 . 2]" 1
1065 1 102 GLY HA3 1 125 VAL QG . . 3.260 2.204 1.923 2.468 . 0 0 "[ . 1 . 2]" 1
1066 1 102 GLY HA3 1 126 LEU H . . 5.050 3.301 2.817 4.115 . 0 0 "[ . 1 . 2]" 1
1067 1 102 GLY HA3 1 126 LEU HA . . 3.160 2.942 2.609 3.221 0.061 17 0 "[ . 1 . 2]" 1
1068 1 102 GLY HA3 1 126 LEU QD . . 4.160 3.415 3.059 4.016 . 0 0 "[ . 1 . 2]" 1
1069 1 103 PHE H 1 103 PHE HB3 . . 3.550 2.509 2.330 2.693 . 0 0 "[ . 1 . 2]" 1
1070 1 103 PHE H 1 103 PHE QD . . 4.510 4.040 3.887 4.183 . 0 0 "[ . 1 . 2]" 1
1071 1 103 PHE H 1 126 LEU QD . . 4.340 4.063 2.832 4.369 0.029 12 0 "[ . 1 . 2]" 1
1072 1 103 PHE HA 1 103 PHE QD . . 3.510 2.892 2.625 3.131 . 0 0 "[ . 1 . 2]" 1
1073 1 103 PHE HA 1 104 LYS H . . 2.860 2.238 2.167 2.315 . 0 0 "[ . 1 . 2]" 1
1074 1 103 PHE HA 1 121 PHE QD . . 5.470 3.651 2.879 4.355 . 0 0 "[ . 1 . 2]" 1
1075 1 103 PHE HA 1 122 ASP H . . 4.170 3.628 3.338 3.919 . 0 0 "[ . 1 . 2]" 1
1076 1 103 PHE HA 1 126 LEU QD . . 5.080 3.579 2.427 4.323 . 0 0 "[ . 1 . 2]" 1
1077 1 103 PHE HB3 1 104 LYS H . . 4.760 4.316 4.015 4.635 . 0 0 "[ . 1 . 2]" 1
1078 1 103 PHE HB3 1 126 LEU QD . . 3.540 3.893 3.396 4.157 0.617 6 10 "[ * .+***1 * .** -*]" 1
1079 1 103 PHE QD 1 104 LYS H . . 4.260 3.440 2.757 4.121 . 0 0 "[ . 1 . 2]" 1
1080 1 103 PHE QD 1 104 LYS HA . . 4.390 3.704 3.150 4.394 0.004 17 0 "[ . 1 . 2]" 1
1081 1 103 PHE QD 1 105 LEU H . . 5.210 5.009 4.511 5.298 0.088 7 0 "[ . 1 . 2]" 1
1082 1 103 PHE QD 1 121 PHE HA . . 5.170 4.312 3.992 4.725 . 0 0 "[ . 1 . 2]" 1
1083 1 103 PHE QD 1 121 PHE QD . . 3.130 3.038 2.491 3.242 0.112 7 0 "[ . 1 . 2]" 1
1084 1 103 PHE QD 1 121 PHE QE . . 3.140 2.584 2.220 3.233 0.093 16 0 "[ . 1 . 2]" 1
1085 1 103 PHE QD 1 126 LEU QD . . 4.660 3.796 2.937 4.418 . 0 0 "[ . 1 . 2]" 1
1086 1 103 PHE QE 1 105 LEU HB3 . . 3.610 3.753 2.898 4.178 0.568 19 1 "[ . 1 . +2]" 1
1087 1 103 PHE QE 1 105 LEU QD . . 4.480 3.250 2.859 3.705 . 0 0 "[ . 1 . 2]" 1
1088 1 103 PHE QE 1 105 LEU HG . . 5.360 4.743 3.939 5.463 0.103 10 0 "[ . 1 . 2]" 1
1089 1 103 PHE QE 1 119 THR MG . . 3.140 2.201 2.020 2.545 . 0 0 "[ . 1 . 2]" 1
1090 1 103 PHE QE 1 121 PHE QE . . 3.390 3.185 2.657 3.502 0.112 1 0 "[ . 1 . 2]" 1
1091 1 103 PHE QE 1 121 PHE HZ . . 4.040 3.918 3.417 4.120 0.080 15 0 "[ . 1 . 2]" 1
1092 1 103 PHE QE 1 136 HIS HD2 . . 3.990 3.258 2.222 4.078 0.088 1 0 "[ . 1 . 2]" 1
1093 1 103 PHE QE 1 137 LEU QD . . 3.670 2.687 2.003 3.656 . 0 0 "[ . 1 . 2]" 1
1094 1 103 PHE QE 1 137 LEU HG . . 5.440 4.464 3.558 5.385 . 0 0 "[ . 1 . 2]" 1
1095 1 103 PHE HZ 1 105 LEU HB3 . . 3.740 3.912 3.300 4.389 0.649 5 2 "[ - + 1 . 2]" 1
1096 1 103 PHE HZ 1 105 LEU QD . . 4.440 2.438 2.220 3.576 . 0 0 "[ . 1 . 2]" 1
1097 1 103 PHE HZ 1 119 THR MG . . 3.560 3.219 2.656 3.625 0.065 10 0 "[ . 1 . 2]" 1
1098 1 104 LYS H 1 104 LYS HB3 . . 3.930 3.159 2.549 3.663 . 0 0 "[ . 1 . 2]" 1
1099 1 104 LYS H 1 104 LYS HG3 . . 4.850 4.554 3.812 5.110 0.260 1 0 "[ . 1 . 2]" 1
1100 1 104 LYS H 1 105 LEU H . . 4.680 4.344 4.244 4.535 . 0 0 "[ . 1 . 2]" 1
1101 1 104 LYS H 1 119 THR HA . . 4.940 4.681 4.373 5.005 0.065 8 0 "[ . 1 . 2]" 1
1102 1 104 LYS H 1 120 SER H . . 3.790 3.071 2.802 3.644 . 0 0 "[ . 1 . 2]" 1
1103 1 104 LYS HA 1 104 LYS HG3 . . 4.200 2.631 2.192 3.665 . 0 0 "[ . 1 . 2]" 1
1104 1 104 LYS HA 1 105 LEU H . . 2.730 2.274 2.183 2.382 . 0 0 "[ . 1 . 2]" 1
1105 1 104 LYS HB3 1 105 LEU H . . 3.990 3.337 2.584 4.052 0.062 4 0 "[ . 1 . 2]" 1
1106 1 104 LYS HB3 1 120 SER H . . 4.510 3.308 2.827 3.915 . 0 0 "[ . 1 . 2]" 1
1107 1 104 LYS HG3 1 105 LEU H . . 4.150 3.428 2.159 4.221 0.071 18 0 "[ . 1 . 2]" 1
1108 1 105 LEU H 1 105 LEU HB3 . . 4.180 2.908 2.673 3.057 . 0 0 "[ . 1 . 2]" 1
1109 1 105 LEU H 1 105 LEU QD . . 4.630 3.995 3.907 4.110 . 0 0 "[ . 1 . 2]" 1
1110 1 105 LEU H 1 106 GLU H . . 4.850 4.251 3.973 4.457 . 0 0 "[ . 1 . 2]" 1
1111 1 105 LEU HA 1 105 LEU QD . . 3.250 2.534 2.187 2.896 . 0 0 "[ . 1 . 2]" 1
1112 1 105 LEU HA 1 105 LEU HG . . 3.440 2.701 2.441 3.526 0.086 11 0 "[ . 1 . 2]" 1
1113 1 105 LEU HA 1 106 GLU H . . 2.930 2.317 2.162 2.442 . 0 0 "[ . 1 . 2]" 1
1114 1 105 LEU HB3 1 106 GLU H . . 5.100 4.071 3.754 4.294 . 0 0 "[ . 1 . 2]" 1
1115 1 105 LEU QD 1 106 GLU H . . 3.430 2.453 1.672 3.124 . 0 0 "[ . 1 . 2]" 1
1116 1 105 LEU QD 1 118 THR H . . 4.270 3.183 2.160 3.976 . 0 0 "[ . 1 . 2]" 1
1117 1 105 LEU QD 1 120 SER H . . 5.500 4.737 4.042 5.268 . 0 0 "[ . 1 . 2]" 1
1118 1 105 LEU HG 1 106 GLU H . . 3.940 3.302 2.057 4.025 0.085 11 0 "[ . 1 . 2]" 1
1119 1 105 LEU HG 1 118 THR H . . 4.920 4.425 3.758 5.010 0.090 11 0 "[ . 1 . 2]" 1
1120 1 105 LEU HG 1 119 THR HA . . 4.630 3.734 2.847 4.696 0.066 4 0 "[ . 1 . 2]" 1
1121 1 106 GLU H 1 106 GLU HB3 . . 3.340 2.948 2.398 3.347 0.007 9 0 "[ . 1 . 2]" 1
1122 1 106 GLU H 1 106 GLU HG3 . . 4.470 4.157 3.188 4.552 0.082 20 0 "[ . 1 . 2]" 1
1123 1 106 GLU H 1 107 THR H . . 4.860 4.184 3.638 4.415 . 0 0 "[ . 1 . 2]" 1
1124 1 106 GLU H 1 117 THR HA . . 5.500 4.612 4.353 4.841 . 0 0 "[ . 1 . 2]" 1
1125 1 106 GLU H 1 117 THR MG . . 4.410 3.366 3.002 3.892 . 0 0 "[ . 1 . 2]" 1
1126 1 106 GLU H 1 118 THR H . . 3.660 2.841 2.698 3.006 . 0 0 "[ . 1 . 2]" 1
1127 1 106 GLU H 1 118 THR MG . . 5.170 4.479 4.164 5.023 . 0 0 "[ . 1 . 2]" 1
1128 1 106 GLU HA 1 106 GLU HG3 . . 3.950 2.958 2.178 3.929 . 0 0 "[ . 1 . 2]" 1
1129 1 106 GLU HA 1 107 THR H . . 2.750 2.263 2.165 2.394 . 0 0 "[ . 1 . 2]" 1
1130 1 106 GLU HB3 1 107 THR H . . 4.490 4.185 3.636 4.543 0.053 2 0 "[ . 1 . 2]" 1
1131 1 106 GLU HB3 1 118 THR MG . . 5.300 4.724 3.504 5.379 0.079 18 0 "[ . 1 . 2]" 1
1132 1 106 GLU HG3 1 107 THR H . . 4.110 2.979 2.101 3.914 . 0 0 "[ . 1 . 2]" 1
1133 1 106 GLU HG3 1 117 THR MG . . 5.270 5.225 4.706 5.385 0.115 16 0 "[ . 1 . 2]" 1
1134 1 107 THR H 1 107 THR HB . . 3.210 2.966 2.442 3.289 0.079 19 0 "[ . 1 . 2]" 1
1135 1 107 THR H 1 117 THR HA . . 5.440 4.731 4.550 5.132 . 0 0 "[ . 1 . 2]" 1
1136 1 107 THR HA 1 107 THR MG . . 3.170 2.233 2.062 2.402 . 0 0 "[ . 1 . 2]" 1
1137 1 107 THR HA 1 108 LYS H . . 2.790 2.350 2.193 2.466 . 0 0 "[ . 1 . 2]" 1
1138 1 107 THR HA 1 117 THR HA . . 3.160 2.177 1.997 2.541 . 0 0 "[ . 1 . 2]" 1
1139 1 107 THR HA 1 117 THR MG . . 4.110 2.619 2.130 3.302 . 0 0 "[ . 1 . 2]" 1
1140 1 107 THR HA 1 118 THR H . . 4.000 3.752 3.520 4.068 0.068 2 0 "[ . 1 . 2]" 1
1141 1 107 THR HB 1 108 LYS H . . 4.680 3.510 2.986 4.021 . 0 0 "[ . 1 . 2]" 1
1142 1 107 THR HB 1 108 LYS HA . . 4.170 4.079 3.553 4.258 0.088 15 0 "[ . 1 . 2]" 1
1143 1 107 THR MG 1 108 LYS H . . 3.200 2.462 2.124 3.003 . 0 0 "[ . 1 . 2]" 1
1144 1 107 THR MG 1 108 LYS HA . . 4.730 4.141 3.361 4.767 0.037 19 0 "[ . 1 . 2]" 1
1145 1 107 THR MG 1 116 GLN H . . 4.870 3.869 3.229 4.424 . 0 0 "[ . 1 . 2]" 1
1146 1 107 THR MG 1 117 THR MG . . 2.400 2.229 2.038 2.435 0.035 8 0 "[ . 1 . 2]" 1
1147 1 108 LYS H 1 108 LYS HB3 . . 3.710 2.857 2.620 3.139 . 0 0 "[ . 1 . 2]" 1
1148 1 108 LYS H 1 109 LEU H . . 4.870 4.220 3.986 4.370 . 0 0 "[ . 1 . 2]" 1
1149 1 108 LYS H 1 117 THR HA . . 3.980 3.483 3.200 3.826 . 0 0 "[ . 1 . 2]" 1
1150 1 108 LYS HA 1 109 LEU H . . 2.610 2.204 1.950 2.409 . 0 0 "[ . 1 . 2]" 1
1151 1 108 LYS HB3 1 110 LEU MD2 . . 4.750 4.009 3.365 4.846 0.096 14 0 "[ . 1 . 2]" 1
1152 1 108 LYS HB3 1 116 GLN H . . 5.000 4.095 3.582 5.086 0.086 1 0 "[ . 1 . 2]" 1
1153 1 109 LEU H 1 109 LEU HB3 . . 3.260 2.656 2.458 2.911 . 0 0 "[ . 1 . 2]" 1
1154 1 109 LEU H 1 109 LEU QD . . 4.320 3.757 3.470 3.914 . 0 0 "[ . 1 . 2]" 1
1155 1 109 LEU H 1 109 LEU HG . . 4.480 4.493 4.384 4.563 0.083 13 0 "[ . 1 . 2]" 1
1156 1 109 LEU HA 1 109 LEU QD . . 2.700 2.185 1.924 2.709 0.009 9 0 "[ . 1 . 2]" 1
1157 1 109 LEU HA 1 109 LEU HG . . 4.250 2.859 2.058 3.669 . 0 0 "[ . 1 . 2]" 1
1158 1 109 LEU HA 1 110 LEU H . . 3.130 2.250 2.153 2.343 . 0 0 "[ . 1 . 2]" 1
1159 1 109 LEU HA 1 110 LEU HB3 . . 5.120 5.759 5.600 5.854 0.734 10 19 "[******** +-*********]" 1
1160 1 109 LEU HA 1 110 LEU HG . . 4.430 4.200 3.807 4.489 0.059 10 0 "[ . 1 . 2]" 1
1161 1 109 LEU HA 1 111 SER H . . 3.770 3.798 3.669 3.851 0.081 20 0 "[ . 1 . 2]" 1
1162 1 109 LEU HA 1 115 LEU H . . 5.330 5.204 4.915 5.385 0.055 5 0 "[ . 1 . 2]" 1
1163 1 109 LEU HA 1 115 LEU HA . . 3.360 2.448 2.277 2.584 . 0 0 "[ . 1 . 2]" 1
1164 1 109 LEU HA 1 115 LEU HB3 . . 4.410 3.457 2.989 4.215 . 0 0 "[ . 1 . 2]" 1
1165 1 109 LEU HA 1 115 LEU HG . . 5.500 5.264 4.480 5.557 0.057 5 0 "[ . 1 . 2]" 1
1166 1 109 LEU HA 1 116 GLN H . . 4.180 3.530 3.165 3.793 . 0 0 "[ . 1 . 2]" 1
1167 1 109 LEU HB3 1 110 LEU H . . 4.700 4.204 3.843 4.440 . 0 0 "[ . 1 . 2]" 1
1168 1 109 LEU HB3 1 115 LEU HA . . 4.980 5.352 5.083 5.526 0.546 7 4 "[ * * + 1 - . 2]" 1
1169 1 109 LEU QD 1 110 LEU H . . 4.310 3.033 2.067 3.757 . 0 0 "[ . 1 . 2]" 1
1170 1 109 LEU QD 1 111 SER H . . 3.760 2.727 1.534 3.438 . 0 0 "[ . 1 . 2]" 1
1171 1 109 LEU QD 1 115 LEU HA . . 3.930 3.163 2.461 3.790 . 0 0 "[ . 1 . 2]" 1
1172 1 109 LEU QD 1 116 GLN H . . 5.500 4.605 3.945 5.074 . 0 0 "[ . 1 . 2]" 1
1173 1 109 LEU HG 1 111 SER H . . 3.490 2.790 2.243 3.595 0.105 18 0 "[ . 1 . 2]" 1
1174 1 110 LEU H 1 110 LEU HB3 . . 3.470 3.600 3.580 3.621 0.151 9 0 "[ . 1 . 2]" 1
1175 1 110 LEU H 1 110 LEU MD1 . . 3.920 3.786 3.484 3.958 0.038 10 0 "[ . 1 . 2]" 1
1176 1 110 LEU H 1 110 LEU MD2 . . 3.740 3.600 3.312 3.772 0.032 4 0 "[ . 1 . 2]" 1
1177 1 110 LEU H 1 110 LEU HG . . 3.350 2.623 2.251 2.928 . 0 0 "[ . 1 . 2]" 1
1178 1 110 LEU H 1 114 GLU H . . 5.500 4.443 3.983 4.976 . 0 0 "[ . 1 . 2]" 1
1179 1 110 LEU H 1 115 LEU H . . 5.500 4.384 4.034 4.721 . 0 0 "[ . 1 . 2]" 1
1180 1 110 LEU H 1 115 LEU HA . . 3.390 2.092 1.823 2.456 . 0 0 "[ . 1 . 2]" 1
1181 1 110 LEU H 1 116 GLN H . . 4.470 3.797 3.186 4.315 . 0 0 "[ . 1 . 2]" 1
1182 1 110 LEU HA 1 110 LEU MD1 . . 4.230 3.855 3.805 3.894 . 0 0 "[ . 1 . 2]" 1
1183 1 110 LEU HA 1 110 LEU MD2 . . 2.630 2.122 2.043 2.175 . 0 0 "[ . 1 . 2]" 1
1184 1 110 LEU HA 1 110 LEU HG . . 4.070 3.132 2.903 3.280 . 0 0 "[ . 1 . 2]" 1
1185 1 110 LEU HB3 1 110 LEU MD1 . . 3.070 2.341 2.263 2.452 . 0 0 "[ . 1 . 2]" 1
1186 1 110 LEU HB3 1 114 GLU H . . 5.290 5.533 5.067 6.027 0.737 1 4 "[+- * *1 . 2]" 1
1187 1 110 LEU MD1 1 115 LEU H . . 4.190 3.786 3.218 4.265 0.075 5 0 "[ . 1 . 2]" 1
1188 1 110 LEU MD1 1 115 LEU HA . . 5.210 3.824 3.258 4.441 . 0 0 "[ . 1 . 2]" 1
1189 1 110 LEU MD1 1 116 GLN H . . 5.180 4.237 3.708 4.816 . 0 0 "[ . 1 . 2]" 1
1190 1 110 LEU MD1 1 116 GLN HA . . 5.170 3.883 3.472 4.306 . 0 0 "[ . 1 . 2]" 1
1191 1 110 LEU MD1 1 116 GLN HB3 . . 4.130 3.521 2.722 4.237 0.107 17 0 "[ . 1 . 2]" 1
1192 1 110 LEU MD1 1 116 GLN HE22 . . 4.970 4.676 3.974 5.596 0.626 8 1 "[ . + 1 . 2]" 1
1193 1 110 LEU MD2 1 116 GLN H . . 4.490 4.342 3.851 4.569 0.079 3 0 "[ . 1 . 2]" 1
1194 1 110 LEU MD2 1 116 GLN HE21 . . 4.470 3.254 2.170 4.543 0.073 9 0 "[ . 1 . 2]" 1
1195 1 110 LEU MD2 1 116 GLN HE22 . . 5.120 3.120 2.547 4.080 . 0 0 "[ . 1 . 2]" 1
1196 1 110 LEU HG 1 115 LEU H . . 4.940 4.600 4.040 4.996 0.056 17 0 "[ . 1 . 2]" 1
1197 1 110 LEU HG 1 116 GLN H . . 4.430 3.311 2.740 3.670 . 0 0 "[ . 1 . 2]" 1
1198 1 111 SER H 1 112 ALA H . . 4.340 4.323 4.228 4.374 0.034 1 0 "[ . 1 . 2]" 1
1199 1 111 SER H 1 113 THR H . . 4.290 3.962 3.621 4.364 0.074 4 0 "[ . 1 . 2]" 1
1200 1 111 SER H 1 114 GLU H . . 3.810 3.064 2.758 3.556 . 0 0 "[ . 1 . 2]" 1
1201 1 111 SER H 1 115 LEU HA . . 5.360 4.005 3.757 4.276 . 0 0 "[ . 1 . 2]" 1
1202 1 111 SER HA 1 112 ALA H . . 3.020 2.569 2.423 2.733 . 0 0 "[ . 1 . 2]" 1
1203 1 111 SER HA 1 112 ALA MB . . 4.430 4.247 4.104 4.374 . 0 0 "[ . 1 . 2]" 1
1204 1 111 SER HA 1 113 THR H . . 4.230 4.138 3.853 4.304 0.074 18 0 "[ . 1 . 2]" 1
1205 1 111 SER HB3 1 112 ALA H . . 3.030 2.861 2.203 3.729 0.699 8 2 "[ . + 1 . -2]" 1
1206 1 111 SER HB3 1 113 THR H . . 5.130 2.759 1.896 4.231 . 0 0 "[ . 1 . 2]" 1
1207 1 112 ALA H 1 112 ALA MB . . 2.940 2.205 2.169 2.262 . 0 0 "[ . 1 . 2]" 1
1208 1 112 ALA H 1 113 THR H . . 3.650 2.911 2.582 3.190 . 0 0 "[ . 1 . 2]" 1
1209 1 112 ALA H 1 113 THR MG . . 5.000 4.542 3.425 5.093 0.093 15 0 "[ . 1 . 2]" 1
1210 1 112 ALA H 1 114 GLU H . . 5.150 4.546 4.265 5.113 . 0 0 "[ . 1 . 2]" 1
1211 1 112 ALA MB 1 113 THR H . . 3.830 3.242 2.727 3.525 . 0 0 "[ . 1 . 2]" 1
1212 1 112 ALA MB 1 113 THR HA . . 4.570 4.250 3.945 4.372 . 0 0 "[ . 1 . 2]" 1
1213 1 112 ALA MB 1 114 GLU H . . 4.960 4.879 4.695 5.047 0.087 12 0 "[ . 1 . 2]" 1
1214 1 113 THR H 1 113 THR MG . . 3.600 3.173 2.277 3.680 0.080 15 0 "[ . 1 . 2]" 1
1215 1 113 THR H 1 114 GLU H . . 2.930 2.243 1.839 2.771 . 0 0 "[ . 1 . 2]" 1
1216 1 113 THR H 1 114 GLU HA . . 5.500 4.796 4.564 5.235 . 0 0 "[ . 1 . 2]" 1
1217 1 113 THR HA 1 113 THR HB . . 2.870 2.590 2.480 2.861 . 0 0 "[ . 1 . 2]" 1
1218 1 113 THR HA 1 113 THR MG . . 2.850 2.279 2.112 2.995 0.145 16 0 "[ . 1 . 2]" 1
1219 1 113 THR HB 1 114 GLU H . . 4.840 4.366 4.155 4.509 . 0 0 "[ . 1 . 2]" 1
1220 1 113 THR HB 1 114 GLU HG3 . . 5.100 4.226 3.457 5.655 0.555 14 1 "[ . 1 +. 2]" 1
1221 1 113 THR MG 1 114 GLU H . . 4.610 4.450 2.925 4.661 0.051 13 0 "[ . 1 . 2]" 1
1222 1 114 GLU H 1 114 GLU HG3 . . 4.470 3.943 2.831 4.521 0.051 1 0 "[ . 1 . 2]" 1
1223 1 114 GLU H 1 115 LEU H . . 4.920 4.301 4.049 4.438 . 0 0 "[ . 1 . 2]" 1
1224 1 114 GLU HA 1 114 GLU HG3 . . 3.870 2.930 2.234 3.847 . 0 0 "[ . 1 . 2]" 1
1225 1 114 GLU HA 1 115 LEU H . . 2.750 2.258 2.152 2.335 . 0 0 "[ . 1 . 2]" 1
1226 1 114 GLU HG3 1 115 LEU H . . 4.880 4.550 3.788 4.963 0.083 3 0 "[ . 1 . 2]" 1
1227 1 115 LEU H 1 115 LEU HB3 . . 4.090 3.175 2.958 3.417 . 0 0 "[ . 1 . 2]" 1
1228 1 115 LEU H 1 115 LEU HG . . 4.400 3.761 3.068 4.323 . 0 0 "[ . 1 . 2]" 1
1229 1 115 LEU HA 1 115 LEU QD . . 3.560 3.372 3.243 3.419 . 0 0 "[ . 1 . 2]" 1
1230 1 115 LEU HA 1 115 LEU HG . . 4.130 3.795 3.639 4.191 0.061 20 0 "[ . 1 . 2]" 1
1231 1 115 LEU HA 1 116 GLN H . . 2.870 2.434 2.203 2.618 . 0 0 "[ . 1 . 2]" 1
1232 1 115 LEU HB3 1 116 GLN H . . 4.180 3.899 3.700 4.120 . 0 0 "[ . 1 . 2]" 1
1233 1 115 LEU HB3 1 116 GLN HA . . 4.780 5.756 5.498 5.944 1.164 1 20 [+-******************] 1
1234 1 115 LEU QD 1 116 GLN H . . 3.920 3.396 2.391 4.017 0.097 1 0 "[ . 1 . 2]" 1
1235 1 115 LEU QD 1 116 GLN HA . . 4.780 3.756 2.318 4.455 . 0 0 "[ . 1 . 2]" 1
1236 1 115 LEU QD 1 117 THR H . . 5.300 4.601 3.073 5.342 0.042 1 0 "[ . 1 . 2]" 1
1237 1 115 LEU HG 1 116 GLN H . . 4.070 3.444 2.746 4.152 0.082 15 0 "[ . 1 . 2]" 1
1238 1 115 LEU HG 1 116 GLN HA . . 5.080 4.035 3.400 5.175 0.095 20 0 "[ . 1 . 2]" 1
1239 1 116 GLN H 1 116 GLN HB3 . . 3.690 2.640 2.408 2.852 . 0 0 "[ . 1 . 2]" 1
1240 1 116 GLN HA 1 116 GLN HE21 . . 5.500 4.968 4.032 5.335 . 0 0 "[ . 1 . 2]" 1
1241 1 116 GLN HA 1 117 THR H . . 2.870 2.324 2.182 2.425 . 0 0 "[ . 1 . 2]" 1
1242 1 116 GLN HA 1 117 THR HB . . 5.120 4.929 4.624 5.170 0.050 11 0 "[ . 1 . 2]" 1
1243 1 117 THR H 1 117 THR HB . . 3.570 3.017 2.749 3.239 . 0 0 "[ . 1 . 2]" 1
1244 1 117 THR H 1 117 THR MG . . 4.660 4.014 3.861 4.092 . 0 0 "[ . 1 . 2]" 1
1245 1 117 THR H 1 118 THR H . . 5.390 4.387 4.321 4.507 . 0 0 "[ . 1 . 2]" 1
1246 1 117 THR HA 1 117 THR MG . . 3.320 2.261 2.131 2.390 . 0 0 "[ . 1 . 2]" 1
1247 1 117 THR HA 1 118 THR H . . 2.870 2.435 2.351 2.617 . 0 0 "[ . 1 . 2]" 1
1248 1 117 THR HA 1 118 THR HB . . 4.550 4.582 4.284 4.628 0.078 15 0 "[ . 1 . 2]" 1
1249 1 117 THR HB 1 118 THR H . . 3.940 3.448 3.102 3.774 . 0 0 "[ . 1 . 2]" 1
1250 1 117 THR MG 1 118 THR H . . 3.380 2.098 1.887 2.389 . 0 0 "[ . 1 . 2]" 1
1251 1 118 THR H 1 118 THR HB . . 2.930 2.888 2.761 3.005 0.075 2 0 "[ . 1 . 2]" 1
1252 1 118 THR H 1 118 THR MG . . 4.030 3.969 3.903 4.008 . 0 0 "[ . 1 . 2]" 1
1253 1 118 THR H 1 119 THR H . . 4.280 4.131 3.706 4.323 0.043 17 0 "[ . 1 . 2]" 1
1254 1 118 THR H 1 119 THR HA . . 5.500 4.576 4.196 4.727 . 0 0 "[ . 1 . 2]" 1
1255 1 118 THR HA 1 118 THR MG . . 3.110 2.435 2.357 2.537 . 0 0 "[ . 1 . 2]" 1
1256 1 118 THR HA 1 119 THR H . . 2.940 2.241 2.136 2.347 . 0 0 "[ . 1 . 2]" 1
1257 1 118 THR HA 1 119 THR MG . . 5.500 5.418 5.233 5.554 0.054 5 0 "[ . 1 . 2]" 1
1258 1 118 THR HB 1 119 THR H . . 4.440 4.117 3.916 4.477 0.037 2 0 "[ . 1 . 2]" 1
1259 1 118 THR MG 1 119 THR H . . 3.520 2.641 2.334 3.266 . 0 0 "[ . 1 . 2]" 1
1260 1 118 THR MG 1 119 THR HA . . 5.470 3.810 3.499 4.288 . 0 0 "[ . 1 . 2]" 1
1261 1 118 THR MG 1 120 SER H . . 4.030 4.048 3.608 4.144 0.114 10 0 "[ . 1 . 2]" 1
1262 1 118 THR MG 1 120 SER HA . . 4.880 4.002 3.367 4.540 . 0 0 "[ . 1 . 2]" 1
1263 1 119 THR H 1 119 THR HB . . 3.580 2.765 2.517 2.924 . 0 0 "[ . 1 . 2]" 1
1264 1 119 THR H 1 119 THR MG . . 4.450 3.874 3.761 3.976 . 0 0 "[ . 1 . 2]" 1
1265 1 119 THR H 1 120 SER H . . 5.370 4.298 3.989 4.524 . 0 0 "[ . 1 . 2]" 1
1266 1 119 THR HA 1 119 THR MG . . 3.300 2.273 2.211 2.376 . 0 0 "[ . 1 . 2]" 1
1267 1 119 THR HA 1 120 SER H . . 2.820 2.249 2.076 2.341 . 0 0 "[ . 1 . 2]" 1
1268 1 119 THR HB 1 120 SER H . . 4.590 4.108 3.810 4.424 . 0 0 "[ . 1 . 2]" 1
1269 1 119 THR HB 1 121 PHE QE . . 4.340 3.028 2.188 4.412 0.072 1 0 "[ . 1 . 2]" 1
1270 1 119 THR MG 1 120 SER H . . 3.460 2.912 2.522 3.506 0.046 15 0 "[ . 1 . 2]" 1
1271 1 119 THR MG 1 121 PHE QE . . 3.230 2.846 2.616 3.332 0.102 1 0 "[ . 1 . 2]" 1
1272 1 120 SER H 1 121 PHE QD . . 5.500 5.038 4.528 5.554 0.054 1 0 "[ . 1 . 2]" 1
1273 1 120 SER HA 1 121 PHE H . . 2.830 2.166 2.037 2.294 . 0 0 "[ . 1 . 2]" 1
1274 1 120 SER HA 1 121 PHE QD . . 4.220 3.774 2.966 4.297 0.077 11 0 "[ . 1 . 2]" 1
1275 1 121 PHE H 1 121 PHE HB3 . . 3.870 3.699 3.587 3.829 . 0 0 "[ . 1 . 2]" 1
1276 1 121 PHE H 1 121 PHE QD . . 3.250 2.996 2.602 3.324 0.074 10 0 "[ . 1 . 2]" 1
1277 1 121 PHE HA 1 121 PHE QD . . 3.500 2.684 2.422 3.184 . 0 0 "[ . 1 . 2]" 1
1278 1 121 PHE HA 1 122 ASP H . . 2.850 2.184 2.056 2.391 . 0 0 "[ . 1 . 2]" 1
1279 1 121 PHE HA 1 126 LEU QD . . 4.900 3.287 2.386 4.127 . 0 0 "[ . 1 . 2]" 1
1280 1 121 PHE HB3 1 122 ASP H . . 4.210 3.630 2.654 4.104 . 0 0 "[ . 1 . 2]" 1
1281 1 121 PHE HB3 1 126 LEU QD . . 3.530 2.463 2.077 3.448 . 0 0 "[ . 1 . 2]" 1
1282 1 121 PHE QD 1 122 ASP H . . 5.350 4.358 3.913 4.678 . 0 0 "[ . 1 . 2]" 1
1283 1 121 PHE QD 1 126 LEU QD . . 3.270 2.580 2.078 3.220 . 0 0 "[ . 1 . 2]" 1
1284 1 121 PHE QD 1 126 LEU HG . . 5.360 4.404 2.296 5.465 0.105 7 0 "[ . 1 . 2]" 1
1285 1 121 PHE QD 1 142 LEU QD . . 3.700 3.140 2.787 3.535 . 0 0 "[ . 1 . 2]" 1
1286 1 121 PHE QD 1 142 LEU HG . . 5.500 4.895 3.365 5.558 0.058 19 0 "[ . 1 . 2]" 1
1287 1 121 PHE QE 1 137 LEU QD . . 3.180 1.997 1.858 2.178 . 0 0 "[ . 1 . 2]" 1
1288 1 121 PHE QE 1 137 LEU HG . . 5.500 3.860 2.398 4.988 . 0 0 "[ . 1 . 2]" 1
1289 1 121 PHE QE 1 140 ILE MD . . 2.900 2.781 2.182 3.012 0.112 16 0 "[ . 1 . 2]" 1
1290 1 121 PHE QE 1 140 ILE MG . . 4.020 3.669 2.886 4.112 0.092 12 0 "[ . 1 . 2]" 1
1291 1 121 PHE QE 1 142 LEU QD . . 3.600 3.131 2.816 3.490 . 0 0 "[ . 1 . 2]" 1
1292 1 121 PHE HZ 1 137 LEU HA . . 4.610 4.457 3.626 4.691 0.081 19 0 "[ . 1 . 2]" 1
1293 1 121 PHE HZ 1 137 LEU HB3 . . 4.730 4.422 2.842 4.810 0.080 3 0 "[ . 1 . 2]" 1
1294 1 121 PHE HZ 1 137 LEU QD . . 4.240 2.479 1.921 3.497 . 0 0 "[ . 1 . 2]" 1
1295 1 121 PHE HZ 1 140 ILE MD . . 3.020 2.333 2.097 2.901 . 0 0 "[ . 1 . 2]" 1
1296 1 122 ASP H 1 122 ASP HB3 . . 3.650 3.413 2.721 3.684 0.034 6 0 "[ . 1 . 2]" 1
1297 1 122 ASP H 1 123 PHE H . . 5.140 3.910 3.635 4.088 . 0 0 "[ . 1 . 2]" 1
1298 1 122 ASP H 1 125 VAL H . . 5.500 5.142 4.885 5.502 0.002 3 0 "[ . 1 . 2]" 1
1299 1 122 ASP H 1 125 VAL QG . . 5.500 4.092 3.644 4.314 . 0 0 "[ . 1 . 2]" 1
1300 1 122 ASP H 1 126 LEU QD . . 4.620 3.563 2.991 4.359 . 0 0 "[ . 1 . 2]" 1
1301 1 122 ASP HA 1 123 PHE H . . 3.090 2.326 2.148 2.495 . 0 0 "[ . 1 . 2]" 1
1302 1 122 ASP HA 1 124 GLN H . . 4.710 3.648 3.329 3.954 . 0 0 "[ . 1 . 2]" 1
1303 1 122 ASP HA 1 125 VAL QG . . 5.500 4.172 4.022 4.330 . 0 0 "[ . 1 . 2]" 1
1304 1 122 ASP HB3 1 123 PHE H . . 4.600 4.232 4.097 4.367 . 0 0 "[ . 1 . 2]" 1
1305 1 122 ASP HB3 1 125 VAL HB . . 5.300 4.724 4.089 5.367 0.067 19 0 "[ . 1 . 2]" 1
1306 1 122 ASP HB3 1 125 VAL QG . . 4.620 2.168 1.840 2.605 . 0 0 "[ . 1 . 2]" 1
1307 1 123 PHE H 1 123 PHE HB3 . . 3.600 3.610 3.446 3.674 0.074 9 0 "[ . 1 . 2]" 1
1308 1 123 PHE H 1 123 PHE QD . . 3.920 3.008 2.330 3.330 . 0 0 "[ . 1 . 2]" 1
1309 1 123 PHE H 1 123 PHE QE . . 5.500 4.748 4.423 5.027 . 0 0 "[ . 1 . 2]" 1
1310 1 123 PHE H 1 124 GLN H . . 3.580 2.941 2.756 3.118 . 0 0 "[ . 1 . 2]" 1
1311 1 123 PHE H 1 124 GLN HE21 . . 4.950 3.545 2.876 4.572 . 0 0 "[ . 1 . 2]" 1
1312 1 123 PHE H 1 124 GLN HE22 . . 5.500 4.189 2.587 4.806 . 0 0 "[ . 1 . 2]" 1
1313 1 123 PHE H 1 124 GLN HG3 . . 5.340 4.877 4.528 6.230 0.890 5 2 "[ + 1 . - 2]" 1
1314 1 123 PHE H 1 125 VAL H . . 4.850 4.516 4.299 4.896 0.046 3 0 "[ . 1 . 2]" 1
1315 1 123 PHE H 1 125 VAL QG . . 5.500 4.857 4.633 5.088 . 0 0 "[ . 1 . 2]" 1
1316 1 123 PHE H 1 126 LEU H . . 5.300 4.724 4.434 5.104 . 0 0 "[ . 1 . 2]" 1
1317 1 123 PHE H 1 126 LEU HB3 . . 4.960 4.504 3.897 4.830 . 0 0 "[ . 1 . 2]" 1
1318 1 123 PHE H 1 126 LEU QD . . 5.060 4.405 3.808 4.966 . 0 0 "[ . 1 . 2]" 1
1319 1 123 PHE HA 1 123 PHE QD . . 3.430 2.432 2.065 2.875 . 0 0 "[ . 1 . 2]" 1
1320 1 123 PHE HA 1 126 LEU H . . 3.960 3.028 2.654 3.255 . 0 0 "[ . 1 . 2]" 1
1321 1 123 PHE HA 1 126 LEU HB3 . . 3.950 2.276 2.060 2.565 . 0 0 "[ . 1 . 2]" 1
1322 1 123 PHE HA 1 126 LEU QD . . 4.200 3.096 2.663 3.512 . 0 0 "[ . 1 . 2]" 1
1323 1 123 PHE HB3 1 124 GLN H . . 4.820 3.812 3.429 4.272 . 0 0 "[ . 1 . 2]" 1
1324 1 123 PHE QD 1 126 LEU HB3 . . 4.640 3.317 2.314 4.158 . 0 0 "[ . 1 . 2]" 1
1325 1 123 PHE QD 1 126 LEU QD . . 3.320 2.714 2.161 3.375 0.055 2 0 "[ . 1 . 2]" 1
1326 1 123 PHE QD 1 128 VAL QG . . 4.110 2.637 2.001 3.647 . 0 0 "[ . 1 . 2]" 1
1327 1 123 PHE QD 1 142 LEU QD . . 4.200 3.868 3.435 4.190 . 0 0 "[ . 1 . 2]" 1
1328 1 123 PHE QD 1 146 LEU QD . . 4.020 2.567 2.060 3.481 . 0 0 "[ . 1 . 2]" 1
1329 1 123 PHE QE 1 126 LEU QD . . 3.800 3.005 2.175 3.521 . 0 0 "[ . 1 . 2]" 1
1330 1 123 PHE QE 1 128 VAL QG . . 5.040 2.656 1.985 3.753 . 0 0 "[ . 1 . 2]" 1
1331 1 123 PHE QE 1 142 LEU QD . . 3.960 2.271 1.988 2.741 . 0 0 "[ . 1 . 2]" 1
1332 1 123 PHE QE 1 146 LEU QD . . 4.290 2.547 2.105 3.499 . 0 0 "[ . 1 . 2]" 1
1333 1 123 PHE HZ 1 142 LEU QD . . 3.520 2.175 1.998 2.442 . 0 0 "[ . 1 . 2]" 1
1334 1 123 PHE HZ 1 145 LEU QD . . 3.950 2.224 2.004 3.596 . 0 0 "[ . 1 . 2]" 1
1335 1 123 PHE HZ 1 146 LEU QD . . 4.500 3.508 3.045 4.156 . 0 0 "[ . 1 . 2]" 1
1336 1 124 GLN H 1 124 GLN HB3 . . 3.700 3.604 3.540 3.713 0.013 10 0 "[ . 1 . 2]" 1
1337 1 124 GLN H 1 124 GLN HE21 . . 5.500 2.157 1.873 2.584 . 0 0 "[ . 1 . 2]" 1
1338 1 124 GLN H 1 124 GLN HE22 . . 5.500 3.359 2.539 3.775 . 0 0 "[ . 1 . 2]" 1
1339 1 124 GLN H 1 124 GLN HG3 . . 3.290 2.529 2.012 4.067 0.777 5 1 "[ + 1 . 2]" 1
1340 1 124 GLN H 1 125 VAL H . . 3.200 2.708 2.191 3.023 . 0 0 "[ . 1 . 2]" 1
1341 1 124 GLN H 1 125 VAL QG . . 4.210 3.615 2.995 3.869 . 0 0 "[ . 1 . 2]" 1
1342 1 124 GLN H 1 126 LEU H . . 4.190 3.935 3.528 4.224 0.034 2 0 "[ . 1 . 2]" 1
1343 1 124 GLN HA 1 124 GLN HG3 . . 3.720 2.701 2.501 3.354 . 0 0 "[ . 1 . 2]" 1
1344 1 124 GLN HB3 1 125 VAL H . . 4.310 3.958 3.296 4.125 . 0 0 "[ . 1 . 2]" 1
1345 1 124 GLN HB3 1 125 VAL QG . . 4.470 3.425 2.986 4.218 . 0 0 "[ . 1 . 2]" 1
1346 1 124 GLN HE21 1 125 VAL H . . 4.550 3.790 2.912 4.619 0.069 5 0 "[ . 1 . 2]" 1
1347 1 124 GLN HE22 1 125 VAL H . . 4.930 4.853 4.368 5.025 0.095 5 0 "[ . 1 . 2]" 1
1348 1 124 GLN HG3 1 125 VAL H . . 4.780 4.665 4.320 5.347 0.567 5 1 "[ + 1 . 2]" 1
1349 1 125 VAL H 1 125 VAL HB . . 3.850 3.529 2.852 3.799 . 0 0 "[ . 1 . 2]" 1
1350 1 125 VAL H 1 125 VAL QG . . 3.130 2.152 1.844 2.300 . 0 0 "[ . 1 . 2]" 1
1351 1 125 VAL H 1 126 LEU H . . 3.000 2.007 1.804 2.426 . 0 0 "[ . 1 . 2]" 1
1352 1 125 VAL HA 1 125 VAL QG . . 3.170 2.214 2.131 2.390 . 0 0 "[ . 1 . 2]" 1
1353 1 125 VAL QG 1 126 LEU H . . 3.660 2.960 2.409 3.458 . 0 0 "[ . 1 . 2]" 1
1354 1 126 LEU H 1 126 LEU HB3 . . 3.550 2.431 2.260 2.600 . 0 0 "[ . 1 . 2]" 1
1355 1 126 LEU H 1 126 LEU QD . . 4.460 3.703 3.574 3.855 . 0 0 "[ . 1 . 2]" 1
1356 1 126 LEU H 1 126 LEU HG . . 4.650 4.529 4.392 4.722 0.072 19 0 "[ . 1 . 2]" 1
1357 1 126 LEU H 1 127 ASP H . . 5.060 4.540 4.357 4.662 . 0 0 "[ . 1 . 2]" 1
1358 1 126 LEU HA 1 126 LEU QD . . 3.070 2.177 2.042 2.457 . 0 0 "[ . 1 . 2]" 1
1359 1 126 LEU HA 1 126 LEU HG . . 3.950 3.284 2.697 3.765 . 0 0 "[ . 1 . 2]" 1
1360 1 126 LEU HA 1 127 ASP H . . 2.890 2.232 2.141 2.306 . 0 0 "[ . 1 . 2]" 1
1361 1 126 LEU HA 1 127 ASP HA . . 4.870 4.508 4.389 4.571 . 0 0 "[ . 1 . 2]" 1
1362 1 126 LEU HB3 1 126 LEU QD . . 3.080 2.221 2.053 2.378 . 0 0 "[ . 1 . 2]" 1
1363 1 126 LEU HB3 1 127 ASP H . . 5.170 4.245 3.958 4.406 . 0 0 "[ . 1 . 2]" 1
1364 1 126 LEU HB3 1 128 VAL QG . . 4.950 3.309 2.530 4.761 . 0 0 "[ . 1 . 2]" 1
1365 1 126 LEU QD 1 127 ASP H . . 3.510 2.475 1.650 3.422 . 0 0 "[ . 1 . 2]" 1
1366 1 126 LEU QD 1 128 VAL HA . . 3.650 2.731 1.884 3.423 . 0 0 "[ . 1 . 2]" 1
1367 1 126 LEU QD 1 131 ALA H . . 5.330 3.784 2.782 4.551 . 0 0 "[ . 1 . 2]" 1
1368 1 126 LEU QD 1 131 ALA MB . . 3.160 2.051 1.725 2.385 . 0 0 "[ . 1 . 2]" 1
1369 1 126 LEU QD 1 142 LEU QD . . 3.780 2.678 2.035 3.430 . 0 0 "[ . 1 . 2]" 1
1370 1 126 LEU HG 1 127 ASP H . . 3.920 3.579 2.850 4.018 0.098 12 0 "[ . 1 . 2]" 1
1371 1 126 LEU HG 1 128 VAL H . . 5.010 3.807 2.819 5.092 0.082 8 0 "[ . 1 . 2]" 1
1372 1 126 LEU HG 1 128 VAL HA . . 4.110 3.261 2.435 4.214 0.104 8 0 "[ . 1 . 2]" 1
1373 1 126 LEU HG 1 131 ALA H . . 5.180 4.774 4.179 5.277 0.097 12 0 "[ . 1 . 2]" 1
1374 1 126 LEU HG 1 131 ALA HA . . 5.500 5.256 4.715 5.578 0.078 1 0 "[ . 1 . 2]" 1
1375 1 127 ASP H 1 127 ASP HB3 . . 3.530 3.271 2.579 3.604 0.074 4 0 "[ . 1 . 2]" 1
1376 1 127 ASP H 1 128 VAL H . . 4.990 3.843 3.637 4.028 . 0 0 "[ . 1 . 2]" 1
1377 1 127 ASP H 1 129 LYS H . . 5.500 5.525 5.343 5.588 0.088 2 0 "[ . 1 . 2]" 1
1378 1 127 ASP HA 1 128 VAL H . . 2.620 2.339 2.126 2.491 . 0 0 "[ . 1 . 2]" 1
1379 1 127 ASP HA 1 128 VAL HB . . 4.870 4.645 4.143 4.950 0.080 17 0 "[ . 1 . 2]" 1
1380 1 127 ASP HA 1 128 VAL QG . . 4.680 3.819 3.283 4.204 . 0 0 "[ . 1 . 2]" 1
1381 1 127 ASP HA 1 130 LYS H . . 5.500 4.397 4.190 4.774 . 0 0 "[ . 1 . 2]" 1
1382 1 127 ASP HB3 1 128 VAL H . . 4.940 4.299 4.121 4.507 . 0 0 "[ . 1 . 2]" 1
1383 1 127 ASP HB3 1 130 LYS H . . 5.200 2.931 2.510 3.178 . 0 0 "[ . 1 . 2]" 1
1384 1 128 VAL H 1 128 VAL HB . . 2.960 2.543 2.337 2.926 . 0 0 "[ . 1 . 2]" 1
1385 1 128 VAL H 1 128 VAL QG . . 2.990 2.002 1.734 2.353 . 0 0 "[ . 1 . 2]" 1
1386 1 128 VAL H 1 130 LYS H . . 5.500 4.653 4.442 4.981 . 0 0 "[ . 1 . 2]" 1
1387 1 128 VAL H 1 131 ALA MB . . 5.290 4.072 3.533 4.416 . 0 0 "[ . 1 . 2]" 1
1388 1 128 VAL HA 1 128 VAL QG . . 2.920 2.185 2.080 2.431 . 0 0 "[ . 1 . 2]" 1
1389 1 128 VAL HA 1 130 LYS H . . 5.380 4.412 3.958 4.876 . 0 0 "[ . 1 . 2]" 1
1390 1 128 VAL HA 1 131 ALA H . . 3.960 3.112 2.678 3.524 . 0 0 "[ . 1 . 2]" 1
1391 1 128 VAL HA 1 131 ALA MB . . 3.020 2.088 1.815 2.548 . 0 0 "[ . 1 . 2]" 1
1392 1 128 VAL HA 1 132 SER H . . 4.490 3.867 3.291 4.538 0.048 7 0 "[ . 1 . 2]" 1
1393 1 128 VAL HB 1 146 LEU QD . . 4.240 3.241 2.289 3.903 . 0 0 "[ . 1 . 2]" 1
1394 1 128 VAL QG 1 129 LYS H . . 4.500 3.105 2.321 3.508 . 0 0 "[ . 1 . 2]" 1
1395 1 128 VAL QG 1 131 ALA MB . . 3.830 2.937 2.178 3.502 . 0 0 "[ . 1 . 2]" 1
1396 1 128 VAL QG 1 132 SER H . . 4.830 3.788 3.363 4.157 . 0 0 "[ . 1 . 2]" 1
1397 1 128 VAL QG 1 143 GLU H . . 5.500 3.918 2.722 5.328 . 0 0 "[ . 1 . 2]" 1
1398 1 128 VAL QG 1 143 GLU HA . . 4.260 2.974 2.013 3.689 . 0 0 "[ . 1 . 2]" 1
1399 1 128 VAL QG 1 146 LEU QD . . 3.880 1.911 1.795 2.074 . 0 0 "[ . 1 . 2]" 1
1400 1 129 LYS H 1 129 LYS HB3 . . 3.160 2.919 2.690 3.264 0.104 9 0 "[ . 1 . 2]" 1
1401 1 129 LYS H 1 130 LYS H . . 3.110 2.838 2.624 3.165 0.055 16 0 "[ . 1 . 2]" 1
1402 1 129 LYS HB3 1 130 LYS H . . 3.490 2.603 2.191 3.259 . 0 0 "[ . 1 . 2]" 1
1403 1 129 LYS HB3 1 133 GLN HE21 . . 5.500 4.806 3.494 5.565 0.065 19 0 "[ . 1 . 2]" 1
1404 1 130 LYS H 1 130 LYS HB3 . . 3.160 3.185 2.880 3.252 0.092 14 0 "[ . 1 . 2]" 1
1405 1 130 LYS H 1 130 LYS HG3 . . 4.150 3.956 3.275 4.237 0.087 11 0 "[ . 1 . 2]" 1
1406 1 130 LYS H 1 131 ALA H . . 3.220 2.453 2.047 2.885 . 0 0 "[ . 1 . 2]" 1
1407 1 130 LYS H 1 131 ALA MB . . 4.390 4.121 3.750 4.473 0.083 9 0 "[ . 1 . 2]" 1
1408 1 130 LYS H 1 133 GLN HE21 . . 4.950 4.692 4.086 5.031 0.081 18 0 "[ . 1 . 2]" 1
1409 1 130 LYS HA 1 130 LYS HG3 . . 3.670 3.155 2.258 3.606 . 0 0 "[ . 1 . 2]" 1
1410 1 130 LYS HA 1 133 GLN H . . 4.570 3.749 3.523 3.869 . 0 0 "[ . 1 . 2]" 1
1411 1 130 LYS HA 1 133 GLN HE21 . . 4.860 2.714 2.282 3.164 . 0 0 "[ . 1 . 2]" 1
1412 1 130 LYS HA 1 133 GLN HE22 . . 5.500 3.755 3.095 4.361 . 0 0 "[ . 1 . 2]" 1
1413 1 130 LYS HA 1 133 GLN HG3 . . 4.380 2.838 2.549 3.157 . 0 0 "[ . 1 . 2]" 1
1414 1 130 LYS HB3 1 131 ALA H . . 3.430 3.235 2.799 3.503 0.073 3 0 "[ . 1 . 2]" 1
1415 1 131 ALA H 1 131 ALA MB . . 2.940 2.193 2.035 2.254 . 0 0 "[ . 1 . 2]" 1
1416 1 131 ALA H 1 132 SER H . . 3.440 2.925 2.728 3.164 . 0 0 "[ . 1 . 2]" 1
1417 1 131 ALA H 1 133 GLN H . . 4.830 4.288 4.103 4.436 . 0 0 "[ . 1 . 2]" 1
1418 1 131 ALA HA 1 133 GLN H . . 4.540 3.798 3.567 4.031 . 0 0 "[ . 1 . 2]" 1
1419 1 131 ALA HA 1 134 LEU H . . 4.570 4.227 3.336 4.657 0.087 9 0 "[ . 1 . 2]" 1
1420 1 131 ALA HA 1 134 LEU QD . . 3.080 2.266 1.946 2.626 . 0 0 "[ . 1 . 2]" 1
1421 1 131 ALA HA 1 134 LEU HG . . 3.480 2.811 2.350 3.387 . 0 0 "[ . 1 . 2]" 1
1422 1 131 ALA MB 1 132 SER H . . 3.510 2.547 2.315 2.960 . 0 0 "[ . 1 . 2]" 1
1423 1 131 ALA MB 1 132 SER HA . . 5.500 3.815 3.678 4.032 . 0 0 "[ . 1 . 2]" 1
1424 1 131 ALA MB 1 133 GLN H . . 4.240 4.274 4.170 4.347 0.107 1 0 "[ . 1 . 2]" 1
1425 1 131 ALA MB 1 134 LEU H . . 5.500 4.946 4.369 5.361 . 0 0 "[ . 1 . 2]" 1
1426 1 131 ALA MB 1 134 LEU HG . . 4.730 4.364 3.862 4.827 0.097 1 0 "[ . 1 . 2]" 1
1427 1 131 ALA MB 1 142 LEU QD . . 4.250 3.161 2.356 4.148 . 0 0 "[ . 1 . 2]" 1
1428 1 132 SER H 1 132 SER HB3 . . 3.080 2.683 1.874 3.607 0.527 10 1 "[ . + . 2]" 1
1429 1 132 SER H 1 133 GLN H . . 3.370 2.789 2.560 2.956 . 0 0 "[ . 1 . 2]" 1
1430 1 132 SER H 1 133 GLN HG3 . . 5.500 4.628 3.640 5.558 0.058 14 0 "[ . 1 . 2]" 1
1431 1 132 SER H 1 134 LEU H . . 5.020 4.652 4.344 5.075 0.055 16 0 "[ . 1 . 2]" 1
1432 1 132 SER H 1 134 LEU HG . . 4.970 4.991 4.715 5.050 0.080 5 0 "[ . 1 . 2]" 1
1433 1 132 SER HA 1 134 LEU H . . 4.490 3.839 3.413 4.536 0.046 1 0 "[ . 1 . 2]" 1
1434 1 132 SER HA 1 142 LEU QD . . 4.760 3.972 2.847 4.698 . 0 0 "[ . 1 . 2]" 1
1435 1 132 SER HB3 1 133 GLN H . . 4.420 4.206 3.479 4.540 0.120 10 0 "[ . 1 . 2]" 1
1436 1 132 SER HB3 1 142 LEU HB3 . . 4.810 4.299 2.296 6.083 1.273 12 6 "[ -* * *1 + . *2]" 1
1437 1 132 SER HB3 1 143 GLU HG3 . . 5.190 3.837 2.511 5.690 0.500 11 0 "[ . 1 . 2]" 1
1438 1 133 GLN H 1 133 GLN HB3 . . 3.380 3.377 2.939 3.785 0.405 5 0 "[ . 1 . 2]" 1
1439 1 133 GLN H 1 133 GLN HE21 . . 4.510 4.310 3.531 4.576 0.066 13 0 "[ . 1 . 2]" 1
1440 1 133 GLN H 1 133 GLN HG3 . . 3.730 2.762 2.433 3.227 . 0 0 "[ . 1 . 2]" 1
1441 1 133 GLN H 1 134 LEU H . . 3.060 2.509 2.054 2.944 . 0 0 "[ . 1 . 2]" 1
1442 1 133 GLN H 1 134 LEU QD . . 4.160 3.970 3.606 4.153 . 0 0 "[ . 1 . 2]" 1
1443 1 133 GLN H 1 134 LEU HG . . 3.380 3.360 3.108 3.464 0.084 6 0 "[ . 1 . 2]" 1
1444 1 133 GLN HA 1 133 GLN HG3 . . 4.200 3.675 3.110 3.996 . 0 0 "[ . 1 . 2]" 1
1445 1 133 GLN HA 1 134 LEU H . . 3.310 3.110 2.741 3.377 0.067 17 0 "[ . 1 . 2]" 1
1446 1 133 GLN HB3 1 133 GLN HE21 . . 4.440 3.450 2.758 4.504 0.064 17 0 "[ . 1 . 2]" 1
1447 1 134 LEU H 1 134 LEU HB3 . . 3.870 3.656 3.524 3.776 . 0 0 "[ . 1 . 2]" 1
1448 1 134 LEU H 1 134 LEU QD . . 3.620 3.364 3.082 3.676 0.056 10 0 "[ . 1 . 2]" 1
1449 1 134 LEU H 1 134 LEU HG . . 3.300 2.795 2.463 3.316 0.016 10 0 "[ . 1 . 2]" 1
1450 1 134 LEU H 1 135 GLU H . . 4.880 4.186 2.827 4.636 . 0 0 "[ . 1 . 2]" 1
1451 1 134 LEU H 1 137 LEU H . . 4.740 4.016 3.493 4.398 . 0 0 "[ . 1 . 2]" 1
1452 1 134 LEU H 1 137 LEU QD . . 5.440 3.974 3.456 4.699 . 0 0 "[ . 1 . 2]" 1
1453 1 134 LEU H 1 138 LYS H . . 4.430 4.372 3.648 4.522 0.092 9 0 "[ . 1 . 2]" 1
1454 1 134 LEU HA 1 134 LEU QD . . 3.180 2.129 2.040 2.273 . 0 0 "[ . 1 . 2]" 1
1455 1 134 LEU HA 1 135 GLU H . . 3.040 2.363 2.104 3.019 . 0 0 "[ . 1 . 2]" 1
1456 1 134 LEU HB3 1 135 GLU H . . 4.450 3.304 2.191 4.511 0.061 8 0 "[ . 1 . 2]" 1
1457 1 134 LEU HB3 1 136 HIS H . . 4.900 3.291 2.487 4.388 . 0 0 "[ . 1 . 2]" 1
1458 1 134 LEU HB3 1 137 LEU H . . 4.910 3.624 3.084 4.056 . 0 0 "[ . 1 . 2]" 1
1459 1 134 LEU QD 1 135 GLU H . . 4.400 3.696 3.218 4.396 . 0 0 "[ . 1 . 2]" 1
1460 1 134 LEU QD 1 136 HIS H . . 5.450 4.354 3.711 5.222 . 0 0 "[ . 1 . 2]" 1
1461 1 134 LEU QD 1 137 LEU H . . 4.380 4.319 3.732 4.514 0.134 20 0 "[ . 1 . 2]" 1
1462 1 135 GLU H 1 135 GLU HB3 . . 3.560 3.181 2.494 3.658 0.098 8 0 "[ . 1 . 2]" 1
1463 1 135 GLU H 1 136 HIS H . . 4.660 3.105 2.284 4.229 . 0 0 "[ . 1 . 2]" 1
1464 1 135 GLU HA 1 137 LEU H . . 4.910 4.208 3.728 4.686 . 0 0 "[ . 1 . 2]" 1
1465 1 135 GLU HA 1 138 LYS H . . 4.180 3.716 3.149 4.243 0.063 1 0 "[ . 1 . 2]" 1
1466 1 135 GLU HB3 1 136 HIS H . . 4.320 2.788 2.024 3.574 . 0 0 "[ . 1 . 2]" 1
1467 1 136 HIS H 1 136 HIS HB3 . . 4.100 2.853 2.379 3.312 . 0 0 "[ . 1 . 2]" 1
1468 1 136 HIS H 1 137 LEU H . . 4.100 2.789 2.608 2.956 . 0 0 "[ . 1 . 2]" 1
1469 1 136 HIS HA 1 138 LYS H . . 4.630 4.432 3.980 4.683 0.053 17 0 "[ . 1 . 2]" 1
1470 1 136 HIS HA 1 139 ASN HD21 . . 5.500 4.335 2.381 5.250 . 0 0 "[ . 1 . 2]" 1
1471 1 136 HIS HA 1 139 ASN HD22 . . 5.500 4.602 2.623 5.571 0.071 10 0 "[ . 1 . 2]" 1
1472 1 136 HIS HB3 1 136 HIS HD2 . . 3.970 2.740 2.359 3.716 . 0 0 "[ . 1 . 2]" 1
1473 1 136 HIS HB3 1 137 LEU H . . 4.280 3.121 2.340 4.492 0.212 15 0 "[ . 1 . 2]" 1
1474 1 136 HIS HB3 1 137 LEU QD . . 4.640 2.731 1.971 4.533 . 0 0 "[ . 1 . 2]" 1
1475 1 136 HIS HB3 1 137 LEU HG . . 4.300 3.067 2.136 4.803 0.503 3 1 "[ + . 1 . 2]" 1
1476 1 136 HIS HD2 1 137 LEU QD . . 3.010 2.493 2.010 3.079 0.069 6 0 "[ . 1 . 2]" 1
1477 1 136 HIS HD2 1 137 LEU HG . . 4.570 3.658 2.382 4.409 . 0 0 "[ . 1 . 2]" 1
1478 1 137 LEU H 1 137 LEU HB3 . . 3.850 3.727 3.535 3.879 0.029 9 0 "[ . 1 . 2]" 1
1479 1 137 LEU H 1 137 LEU QD . . 3.810 2.825 1.906 3.432 . 0 0 "[ . 1 . 2]" 1
1480 1 137 LEU H 1 137 LEU HG . . 3.810 2.949 2.017 3.761 . 0 0 "[ . 1 . 2]" 1
1481 1 137 LEU H 1 138 LYS H . . 3.130 2.358 1.972 3.185 0.055 1 0 "[ . 1 . 2]" 1
1482 1 137 LEU H 1 139 ASN H . . 5.500 4.528 3.981 5.025 . 0 0 "[ . 1 . 2]" 1
1483 1 137 LEU HA 1 137 LEU QD . . 2.960 2.458 2.094 2.918 . 0 0 "[ . 1 . 2]" 1
1484 1 137 LEU HA 1 137 LEU HG . . 4.140 2.966 2.113 3.508 . 0 0 "[ . 1 . 2]" 1
1485 1 137 LEU HA 1 140 ILE H . . 4.560 3.650 3.306 4.147 . 0 0 "[ . 1 . 2]" 1
1486 1 137 LEU HA 1 140 ILE HB . . 4.590 3.843 3.349 4.362 . 0 0 "[ . 1 . 2]" 1
1487 1 137 LEU HA 1 140 ILE MD . . 3.680 2.451 2.106 2.950 . 0 0 "[ . 1 . 2]" 1
1488 1 137 LEU HA 1 140 ILE HG13 . . 4.300 2.522 2.197 2.780 . 0 0 "[ . 1 . 2]" 1
1489 1 137 LEU HA 1 140 ILE MG . . 4.920 4.754 4.331 5.019 0.099 19 0 "[ . 1 . 2]" 1
1490 1 137 LEU HA 1 142 LEU QD . . 5.370 4.206 3.147 5.124 . 0 0 "[ . 1 . 2]" 1
1491 1 137 LEU HB3 1 138 LYS H . . 5.070 4.345 3.835 4.591 . 0 0 "[ . 1 . 2]" 1
1492 1 137 LEU HB3 1 142 LEU QD . . 5.000 2.948 2.156 3.838 . 0 0 "[ . 1 . 2]" 1
1493 1 137 LEU QD 1 138 LYS H . . 5.500 4.261 3.797 4.502 . 0 0 "[ . 1 . 2]" 1
1494 1 138 LYS H 1 139 ASN H . . 3.950 2.635 1.964 2.801 . 0 0 "[ . 1 . 2]" 1
1495 1 138 LYS H 1 139 ASN HA . . 5.170 5.214 4.627 5.265 0.095 11 0 "[ . 1 . 2]" 1
1496 1 138 LYS HA 1 139 ASN HA . . 4.620 4.675 4.586 4.698 0.078 4 0 "[ . 1 . 2]" 1
1497 1 138 LYS HB3 1 139 ASN H . . 3.640 3.453 2.825 4.076 0.436 2 0 "[ . 1 . 2]" 1
1498 1 139 ASN H 1 139 ASN HB3 . . 3.930 2.909 2.372 3.658 . 0 0 "[ . 1 . 2]" 1
1499 1 139 ASN H 1 139 ASN HD21 . . 5.220 2.432 1.926 3.770 . 0 0 "[ . 1 . 2]" 1
1500 1 139 ASN H 1 139 ASN HD22 . . 5.080 3.427 2.843 4.236 . 0 0 "[ . 1 . 2]" 1
1501 1 139 ASN H 1 140 ILE H . . 3.500 2.675 2.481 2.884 . 0 0 "[ . 1 . 2]" 1
1502 1 139 ASN H 1 140 ILE HG13 . . 5.500 3.555 3.187 3.827 . 0 0 "[ . 1 . 2]" 1
1503 1 139 ASN HA 1 139 ASN HB3 . . 2.400 2.469 2.353 2.621 0.221 12 0 "[ . 1 . 2]" 1
1504 1 139 ASN HB3 1 140 ILE H . . 4.240 4.252 3.742 4.540 0.300 4 0 "[ . 1 . 2]" 1
1505 1 140 ILE H 1 140 ILE HB . . 3.170 2.716 2.556 3.056 . 0 0 "[ . 1 . 2]" 1
1506 1 140 ILE H 1 140 ILE MD . . 4.570 3.709 3.401 4.028 . 0 0 "[ . 1 . 2]" 1
1507 1 140 ILE H 1 140 ILE HG13 . . 3.640 2.180 1.783 2.495 . 0 0 "[ . 1 . 2]" 1
1508 1 140 ILE H 1 140 ILE MG . . 4.070 3.837 3.726 3.984 . 0 0 "[ . 1 . 2]" 1
1509 1 140 ILE HA 1 140 ILE HG13 . . 3.970 3.362 3.193 3.585 . 0 0 "[ . 1 . 2]" 1
1510 1 140 ILE HA 1 140 ILE MG . . 3.190 2.300 2.187 2.412 . 0 0 "[ . 1 . 2]" 1
1511 1 140 ILE HA 1 141 GLY H . . 3.040 2.316 1.972 3.118 0.078 3 0 "[ . 1 . 2]" 1
1512 1 140 ILE HB 1 140 ILE MD . . 3.460 2.405 2.291 2.540 . 0 0 "[ . 1 . 2]" 1
1513 1 140 ILE HB 1 141 GLY H . . 3.830 3.778 3.252 3.905 0.075 13 0 "[ . 1 . 2]" 1
1514 1 140 ILE HB 1 142 LEU H . . 4.420 3.239 2.768 3.624 . 0 0 "[ . 1 . 2]" 1
1515 1 140 ILE HB 1 142 LEU HA . . 5.180 4.760 3.917 5.239 0.059 20 0 "[ . 1 . 2]" 1
1516 1 140 ILE HB 1 142 LEU QD . . 5.490 2.369 2.001 2.818 . 0 0 "[ . 1 . 2]" 1
1517 1 140 ILE MD 1 140 ILE MG . . 3.230 2.074 2.031 2.121 . 0 0 "[ . 1 . 2]" 1
1518 1 140 ILE MD 1 141 GLY H . . 5.500 5.076 4.819 5.458 . 0 0 "[ . 1 . 2]" 1
1519 1 140 ILE MD 1 142 LEU H . . 5.210 4.965 4.599 5.303 0.093 6 0 "[ . 1 . 2]" 1
1520 1 140 ILE MD 1 142 LEU QD . . 4.650 2.507 2.078 2.870 . 0 0 "[ . 1 . 2]" 1
1521 1 140 ILE HG13 1 142 LEU QD . . 4.380 4.014 3.313 4.390 0.010 9 0 "[ . 1 . 2]" 1
1522 1 140 ILE MG 1 141 GLY H . . 5.230 2.422 1.984 4.306 . 0 0 "[ . 1 . 2]" 1
1523 1 140 ILE MG 1 142 LEU H . . 4.090 3.176 2.413 4.189 0.099 3 0 "[ . 1 . 2]" 1
1524 1 140 ILE MG 1 142 LEU HA . . 4.140 3.565 3.059 4.200 0.060 3 0 "[ . 1 . 2]" 1
1525 1 140 ILE MG 1 142 LEU QD . . 4.150 2.346 1.972 2.771 . 0 0 "[ . 1 . 2]" 1
1526 1 141 GLY H 1 142 LEU H . . 3.410 3.356 2.705 3.487 0.077 20 0 "[ . 1 . 2]" 1
1527 1 141 GLY HA2 1 143 GLU H . . 4.880 3.958 3.498 4.395 . 0 0 "[ . 1 . 2]" 1
1528 1 142 LEU H 1 142 LEU HB3 . . 3.340 3.435 3.131 3.674 0.334 20 0 "[ . 1 . 2]" 1
1529 1 142 LEU H 1 142 LEU QD . . 4.200 2.912 2.023 3.700 . 0 0 "[ . 1 . 2]" 1
1530 1 142 LEU H 1 143 GLU H . . 3.430 2.940 2.566 3.242 . 0 0 "[ . 1 . 2]" 1
1531 1 142 LEU H 1 144 ASN H . . 5.130 4.208 3.677 4.752 . 0 0 "[ . 1 . 2]" 1
1532 1 142 LEU HA 1 142 LEU QD . . 3.050 2.066 1.951 2.350 . 0 0 "[ . 1 . 2]" 1
1533 1 142 LEU HA 1 142 LEU HG . . 4.150 3.261 2.254 3.799 . 0 0 "[ . 1 . 2]" 1
1534 1 142 LEU HA 1 145 LEU H . . 3.970 3.557 2.995 4.041 0.071 8 0 "[ . 1 . 2]" 1
1535 1 142 LEU HA 1 145 LEU QD . . 4.000 3.350 2.480 3.834 . 0 0 "[ . 1 . 2]" 1
1536 1 142 LEU HB3 1 143 GLU H . . 3.750 2.944 2.365 3.598 . 0 0 "[ . 1 . 2]" 1
1537 1 142 LEU QD 1 143 GLU H . . 5.310 4.005 3.770 4.396 . 0 0 "[ . 1 . 2]" 1
1538 1 142 LEU QD 1 145 LEU QD . . 3.710 2.734 2.026 3.493 . 0 0 "[ . 1 . 2]" 1
1539 1 142 LEU HG 1 143 GLU H . . 5.210 4.885 4.610 5.210 . 0 0 "[ . 1 . 2]" 1
1540 1 143 GLU H 1 143 GLU HG3 . . 3.990 3.046 2.054 4.064 0.074 17 0 "[ . 1 . 2]" 1
1541 1 143 GLU H 1 144 ASN H . . 3.350 2.694 2.392 2.967 . 0 0 "[ . 1 . 2]" 1
1542 1 143 GLU H 1 144 ASN HA . . 5.500 5.338 5.147 5.542 0.042 9 0 "[ . 1 . 2]" 1
1543 1 143 GLU HA 1 143 GLU HG3 . . 3.750 3.472 2.831 3.828 0.078 2 0 "[ . 1 . 2]" 1
1544 1 143 GLU HA 1 146 LEU QD . . 4.050 3.561 2.456 4.064 0.014 9 0 "[ . 1 . 2]" 1
1545 1 144 ASN H 1 146 LEU H . . 4.730 4.108 3.507 4.536 . 0 0 "[ . 1 . 2]" 1
1546 1 144 ASN HA 1 146 LEU H . . 5.500 4.374 3.968 4.730 . 0 0 "[ . 1 . 2]" 1
1547 1 145 LEU H 1 145 LEU HB3 . . 3.190 2.429 2.117 2.733 . 0 0 "[ . 1 . 2]" 1
1548 1 145 LEU H 1 145 LEU QD . . 4.300 3.704 3.511 3.847 . 0 0 "[ . 1 . 2]" 1
1549 1 145 LEU H 1 145 LEU HG . . 4.720 4.418 4.179 4.490 . 0 0 "[ . 1 . 2]" 1
1550 1 145 LEU H 1 146 LEU H . . 3.420 2.552 2.175 2.834 . 0 0 "[ . 1 . 2]" 1
1551 1 145 LEU HA 1 145 LEU HB3 . . 2.930 3.042 3.011 3.061 0.131 12 0 "[ . 1 . 2]" 1
1552 1 145 LEU HA 1 145 LEU QD . . 3.370 2.803 2.289 3.184 . 0 0 "[ . 1 . 2]" 1
1553 1 145 LEU HA 1 145 LEU HG . . 3.870 2.641 2.416 2.978 . 0 0 "[ . 1 . 2]" 1
1554 1 145 LEU HA 1 146 LEU H . . 3.560 3.566 3.468 3.612 0.052 8 0 "[ . 1 . 2]" 1
1555 1 145 LEU HA 1 148 ASN HD21 . . 3.920 3.729 2.962 4.286 0.366 20 0 "[ . 1 . 2]" 1
1556 1 145 LEU HA 1 148 ASN HD22 . . 4.300 3.149 2.332 4.369 0.069 12 0 "[ . 1 . 2]" 1
1557 1 145 LEU HB3 1 146 LEU H . . 3.970 2.512 2.283 2.810 . 0 0 "[ . 1 . 2]" 1
1558 1 145 LEU QD 1 146 LEU H . . 5.450 3.292 2.798 3.901 . 0 0 "[ . 1 . 2]" 1
1559 1 145 LEU QD 1 146 LEU HA . . 4.900 3.340 2.432 4.199 . 0 0 "[ . 1 . 2]" 1
1560 1 145 LEU QD 1 146 LEU QD . . 3.420 2.906 2.143 3.400 . 0 0 "[ . 1 . 2]" 1
1561 1 145 LEU QD 1 153 TYR QD . . 4.040 3.588 3.107 3.985 . 0 0 "[ . 1 . 2]" 1
1562 1 145 LEU QD 1 153 TYR QE . . 3.560 2.750 2.177 3.374 . 0 0 "[ . 1 . 2]" 1
1563 1 145 LEU HG 1 146 LEU H . . 4.980 4.128 3.472 4.797 . 0 0 "[ . 1 . 2]" 1
1564 1 145 LEU HG 1 147 LYS H . . 5.500 5.010 4.271 5.590 0.090 11 0 "[ . 1 . 2]" 1
1565 1 145 LEU HG 1 148 ASN HD22 . . 5.500 3.863 2.916 4.475 . 0 0 "[ . 1 . 2]" 1
1566 1 145 LEU HG 1 153 TYR QE . . 5.500 4.358 2.841 5.038 . 0 0 "[ . 1 . 2]" 1
1567 1 146 LEU H 1 146 LEU QD . . 4.800 3.446 2.973 3.814 . 0 0 "[ . 1 . 2]" 1
1568 1 146 LEU HA 1 146 LEU QD . . 2.880 2.093 2.003 2.207 . 0 0 "[ . 1 . 2]" 1
1569 1 146 LEU HA 1 146 LEU HG . . 3.610 2.999 2.713 3.333 . 0 0 "[ . 1 . 2]" 1
1570 1 146 LEU HA 1 147 LYS HA . . 4.470 4.497 4.285 4.561 0.091 6 0 "[ . 1 . 2]" 1
1571 1 146 LEU HA 1 148 ASN H . . 4.030 3.511 3.121 3.752 . 0 0 "[ . 1 . 2]" 1
1572 1 146 LEU QD 1 147 LYS H . . 5.500 4.325 3.757 4.531 . 0 0 "[ . 1 . 2]" 1
1573 1 146 LEU HG 1 147 LYS H . . 5.410 4.840 4.415 5.429 0.019 20 0 "[ . 1 . 2]" 1
1574 1 147 LYS H 1 147 LYS HB3 . . 3.900 3.528 2.590 3.912 0.012 8 0 "[ . 1 . 2]" 1
1575 1 147 LYS H 1 148 ASN H . . 3.020 2.488 1.735 3.107 0.087 12 0 "[ . 1 . 2]" 1
1576 1 147 LYS H 1 148 ASN HA . . 5.370 4.985 4.485 5.426 0.056 6 0 "[ . 1 . 2]" 1
1577 1 148 ASN H 1 149 GLU H . . 4.560 4.389 4.273 4.506 . 0 0 "[ . 1 . 2]" 1
1578 1 148 ASN HA 1 148 ASN HD22 . . 5.460 5.080 4.826 5.189 . 0 0 "[ . 1 . 2]" 1
1579 1 148 ASN HA 1 149 GLU H . . 2.800 2.568 2.367 2.854 0.054 13 0 "[ . 1 . 2]" 1
1580 1 148 ASN HB3 1 149 GLU H . . 3.480 3.644 3.315 3.878 0.398 12 0 "[ . 1 . 2]" 1
1581 1 148 ASN HB3 1 152 LYS HB3 . . 5.130 4.356 3.637 5.141 0.011 15 0 "[ . 1 . 2]" 1
1582 1 148 ASN HB3 1 153 TYR H . . 5.030 5.559 4.377 6.519 1.489 7 10 "[*- *.*+ ** ** *2]" 1
1583 1 149 GLU H 1 149 GLU HB3 . . 3.550 3.366 2.295 3.733 0.183 13 0 "[ . 1 . 2]" 1
1584 1 149 GLU H 1 152 LYS H . . 5.500 4.047 3.735 4.511 . 0 0 "[ . 1 . 2]" 1
1585 1 149 GLU HA 1 149 GLU HG3 . . 3.960 3.501 2.175 4.011 0.051 8 0 "[ . 1 . 2]" 1
1586 1 149 GLU HA 1 150 PRO HD3 . . 3.220 2.614 2.526 2.701 . 0 0 "[ . 1 . 2]" 1
1587 1 149 GLU HB3 1 150 PRO HD3 . . 4.210 3.906 3.433 4.903 0.693 19 3 "[ * . 1 -. +2]" 1
1588 1 149 GLU HB3 1 151 SER H . . 4.720 3.184 2.118 4.543 . 0 0 "[ . 1 . 2]" 1
1589 1 149 GLU HB3 1 152 LYS H . . 4.230 3.569 1.988 4.363 0.133 2 0 "[ . 1 . 2]" 1
1590 1 150 PRO HA 1 153 TYR H . . 4.880 4.876 4.555 4.967 0.087 10 0 "[ . 1 . 2]" 1
1591 1 150 PRO HA 1 153 TYR QD . . 4.770 3.987 3.444 4.402 . 0 0 "[ . 1 . 2]" 1
1592 1 150 PRO HB3 1 151 SER H . . 4.400 4.344 4.067 4.472 0.072 12 0 "[ . 1 . 2]" 1
1593 1 150 PRO HD3 1 151 SER H . . 4.560 4.088 3.897 4.319 . 0 0 "[ . 1 . 2]" 1
1594 1 150 PRO HG3 1 151 SER H . . 5.400 4.238 3.834 4.565 . 0 0 "[ . 1 . 2]" 1
1595 1 151 SER H 1 151 SER HB3 . . 3.920 2.854 2.451 3.704 . 0 0 "[ . 1 . 2]" 1
1596 1 151 SER H 1 152 LYS H . . 3.590 2.375 1.984 2.729 . 0 0 "[ . 1 . 2]" 1
1597 1 151 SER H 1 153 TYR H . . 4.890 4.742 4.293 4.963 0.073 19 0 "[ . 1 . 2]" 1
1598 1 151 SER HA 1 154 ILE H . . 4.280 3.346 3.107 3.681 . 0 0 "[ . 1 . 2]" 1
1599 1 151 SER HA 1 154 ILE HB . . 3.590 2.836 2.254 3.267 . 0 0 "[ . 1 . 2]" 1
1600 1 151 SER HA 1 154 ILE MD . . 3.650 2.188 1.944 2.465 . 0 0 "[ . 1 . 2]" 1
1601 1 151 SER HA 1 155 SER H . . 4.690 4.724 4.041 4.777 0.087 18 0 "[ . 1 . 2]" 1
1602 1 151 SER HB3 1 152 LYS H . . 4.550 3.717 2.922 4.550 . 0 0 "[ . 1 . 2]" 1
1603 1 152 LYS H 1 152 LYS HB3 . . 3.330 2.779 2.245 3.419 0.089 15 0 "[ . 1 . 2]" 1
1604 1 152 LYS H 1 153 TYR H . . 3.170 2.884 2.550 3.223 0.053 6 0 "[ . 1 . 2]" 1
1605 1 152 LYS H 1 154 ILE H . . 4.590 4.057 3.691 4.363 . 0 0 "[ . 1 . 2]" 1
1606 1 153 TYR H 1 153 TYR HB3 . . 3.520 2.360 2.151 2.498 . 0 0 "[ . 1 . 2]" 1
1607 1 153 TYR H 1 153 TYR QD . . 3.860 2.248 2.107 2.352 . 0 0 "[ . 1 . 2]" 1
1608 1 153 TYR H 1 153 TYR QE . . 4.490 4.566 4.474 4.588 0.098 13 0 "[ . 1 . 2]" 1
1609 1 153 TYR H 1 154 ILE H . . 3.390 2.677 2.402 2.951 . 0 0 "[ . 1 . 2]" 1
1610 1 153 TYR HA 1 153 TYR QD . . 3.590 3.683 3.671 3.694 0.104 16 0 "[ . 1 . 2]" 1
1611 1 153 TYR HA 1 155 SER H . . 4.230 4.071 3.825 4.304 0.074 3 0 "[ . 1 . 2]" 1
1612 1 153 TYR HA 1 156 ASP H . . 3.880 3.082 2.663 3.362 . 0 0 "[ . 1 . 2]" 1
1613 1 153 TYR HA 1 156 ASP HB3 . . 3.950 3.008 2.258 4.090 0.140 17 0 "[ . 1 . 2]" 1
1614 1 153 TYR HA 1 157 ARG H . . 4.590 4.305 3.898 4.650 0.060 15 0 "[ . 1 . 2]" 1
1615 1 153 TYR HB3 1 154 ILE H . . 4.270 4.119 3.994 4.171 . 0 0 "[ . 1 . 2]" 1
1616 1 153 TYR QD 1 154 ILE H . . 3.660 2.567 2.224 2.832 . 0 0 "[ . 1 . 2]" 1
1617 1 153 TYR QD 1 154 ILE HA . . 5.330 4.105 3.787 4.315 . 0 0 "[ . 1 . 2]" 1
1618 1 153 TYR QD 1 154 ILE MD . . 4.110 4.108 3.930 4.222 0.112 7 0 "[ . 1 . 2]" 1
1619 1 153 TYR QD 1 154 ILE HG13 . . 4.700 2.776 2.548 2.925 . 0 0 "[ . 1 . 2]" 1
1620 1 154 ILE H 1 154 ILE HB . . 3.230 2.517 2.212 2.698 . 0 0 "[ . 1 . 2]" 1
1621 1 154 ILE H 1 154 ILE MD . . 4.110 3.684 3.562 3.791 . 0 0 "[ . 1 . 2]" 1
1622 1 154 ILE H 1 154 ILE HG13 . . 4.240 2.114 1.952 2.316 . 0 0 "[ . 1 . 2]" 1
1623 1 154 ILE H 1 155 SER H . . 3.550 2.762 2.506 2.974 . 0 0 "[ . 1 . 2]" 1
1624 1 154 ILE H 1 156 ASP H . . 5.500 4.092 3.828 4.375 . 0 0 "[ . 1 . 2]" 1
1625 1 154 ILE HA 1 154 ILE MD . . 4.190 3.782 3.669 3.897 . 0 0 "[ . 1 . 2]" 1
1626 1 154 ILE HA 1 154 ILE HG13 . . 3.910 3.060 2.829 3.299 . 0 0 "[ . 1 . 2]" 1
1627 1 154 ILE HA 1 157 ARG HB3 . . 5.020 4.285 3.826 4.881 . 0 0 "[ . 1 . 2]" 1
1628 1 154 ILE HB 1 155 SER H . . 3.430 2.691 2.419 2.889 . 0 0 "[ . 1 . 2]" 1
1629 1 154 ILE HG13 1 155 SER H . . 5.140 4.287 4.073 4.549 . 0 0 "[ . 1 . 2]" 1
1630 1 155 SER H 1 155 SER HB3 . . 3.530 3.017 2.409 3.603 0.073 11 0 "[ . 1 . 2]" 1
1631 1 155 SER H 1 156 ASP H . . 3.440 2.685 2.443 2.798 . 0 0 "[ . 1 . 2]" 1
1632 1 155 SER H 1 156 ASP HA . . 5.500 5.348 5.118 5.454 . 0 0 "[ . 1 . 2]" 1
1633 1 155 SER H 1 156 ASP HB3 . . 5.180 5.105 4.734 6.091 0.911 17 1 "[ . 1 . + 2]" 1
1634 1 155 SER H 1 157 ARG H . . 4.010 4.083 4.054 4.102 0.092 4 0 "[ . 1 . 2]" 1
1635 1 155 SER HA 1 158 LEU HB3 . . 3.940 4.832 2.729 5.714 1.774 2 15 "[*+* * *** **-*** **]" 1
1636 1 155 SER HA 1 158 LEU QD . . 3.690 3.244 2.162 3.722 0.032 20 0 "[ . 1 . 2]" 1
1637 1 155 SER HB3 1 156 ASP H . . 4.440 3.123 2.176 4.246 . 0 0 "[ . 1 . 2]" 1
1638 1 156 ASP H 1 156 ASP HB3 . . 3.140 2.681 2.397 3.370 0.230 17 0 "[ . 1 . 2]" 1
1639 1 156 ASP H 1 157 ARG H . . 3.340 2.514 2.107 2.819 . 0 0 "[ . 1 . 2]" 1
1640 1 156 ASP H 1 158 LEU QD . . 5.500 5.049 4.559 5.358 . 0 0 "[ . 1 . 2]" 1
1641 1 156 ASP HA 1 159 ALA H . . 3.830 3.460 3.031 3.872 0.042 6 0 "[ . 1 . 2]" 1
1642 1 156 ASP HA 1 159 ALA MB . . 3.520 2.550 2.169 3.191 . 0 0 "[ . 1 . 2]" 1
1643 1 156 ASP HA 1 160 ASN H . . 4.510 4.373 4.001 4.594 0.084 18 0 "[ . 1 . 2]" 1
1644 1 156 ASP HA 1 160 ASN HD21 . . 5.500 3.945 3.315 5.370 . 0 0 "[ . 1 . 2]" 1
1645 1 156 ASP HA 1 160 ASN HD22 . . 5.500 4.487 3.724 5.575 0.075 19 0 "[ . 1 . 2]" 1
1646 1 156 ASP HB3 1 157 ARG H . . 3.770 2.811 2.538 3.283 . 0 0 "[ . 1 . 2]" 1
1647 1 157 ARG H 1 157 ARG HB3 . . 4.130 3.647 3.487 3.742 . 0 0 "[ . 1 . 2]" 1
1648 1 157 ARG H 1 157 ARG HG3 . . 3.420 3.597 3.217 4.079 0.659 13 3 "[ .- 1 + . *2]" 1
1649 1 157 ARG H 1 158 LEU H . . 3.530 2.932 2.451 3.180 . 0 0 "[ . 1 . 2]" 1
1650 1 157 ARG H 1 158 LEU QD . . 4.630 4.071 3.592 4.562 . 0 0 "[ . 1 . 2]" 1
1651 1 157 ARG H 1 162 ALA MB . . 5.390 5.006 4.679 5.407 0.017 18 0 "[ . 1 . 2]" 1
1652 1 157 ARG HA 1 159 ALA H . . 4.590 4.450 4.009 4.662 0.072 17 0 "[ . 1 . 2]" 1
1653 1 157 ARG HA 1 160 ASN H . . 4.180 3.372 3.029 3.848 . 0 0 "[ . 1 . 2]" 1
1654 1 157 ARG HA 1 160 ASN HB3 . . 3.970 4.179 3.772 4.465 0.495 10 0 "[ . 1 . 2]" 1
1655 1 157 ARG HA 1 162 ALA MB . . 5.060 3.514 3.149 3.827 . 0 0 "[ . 1 . 2]" 1
1656 1 158 LEU H 1 158 LEU HB3 . . 3.820 3.474 2.122 3.609 . 0 0 "[ . 1 . 2]" 1
1657 1 158 LEU H 1 158 LEU QD . . 3.790 2.120 1.771 3.492 . 0 0 "[ . 1 . 2]" 1
1658 1 158 LEU H 1 159 ALA H . . 3.500 2.937 2.767 3.103 . 0 0 "[ . 1 . 2]" 1
1659 1 158 LEU H 1 159 ALA MB . . 4.940 4.599 4.426 4.727 . 0 0 "[ . 1 . 2]" 1
1660 1 158 LEU H 1 160 ASN H . . 5.010 4.204 3.986 4.345 . 0 0 "[ . 1 . 2]" 1
1661 1 158 LEU H 1 162 ALA MB . . 4.830 3.503 3.082 4.057 . 0 0 "[ . 1 . 2]" 1
1662 1 158 LEU H 1 163 THR HA . . 5.500 5.578 5.550 5.589 0.089 8 0 "[ . 1 . 2]" 1
1663 1 158 LEU HA 1 158 LEU QD . . 3.300 2.382 1.964 2.988 . 0 0 "[ . 1 . 2]" 1
1664 1 158 LEU HA 1 158 LEU HG . . 3.930 3.222 2.133 3.882 . 0 0 "[ . 1 . 2]" 1
1665 1 158 LEU HA 1 162 ALA H . . 3.310 2.739 2.061 3.373 0.063 14 0 "[ . 1 . 2]" 1
1666 1 158 LEU HA 1 162 ALA MB . . 3.340 2.581 2.080 3.240 . 0 0 "[ . 1 . 2]" 1
1667 1 158 LEU HB3 1 159 ALA H . . 4.280 3.334 2.537 3.736 . 0 0 "[ . 1 . 2]" 1
1668 1 158 LEU QD 1 159 ALA H . . 5.090 3.871 2.345 4.099 . 0 0 "[ . 1 . 2]" 1
1669 1 158 LEU QD 1 160 ASN H . . 5.500 5.023 4.239 5.274 . 0 0 "[ . 1 . 2]" 1
1670 1 158 LEU QD 1 162 ALA H . . 4.930 4.155 3.821 4.472 . 0 0 "[ . 1 . 2]" 1
1671 1 158 LEU QD 1 162 ALA MB . . 3.960 3.048 2.576 3.640 . 0 0 "[ . 1 . 2]" 1
1672 1 158 LEU QD 1 163 THR H . . 4.910 3.779 3.453 4.080 . 0 0 "[ . 1 . 2]" 1
1673 1 158 LEU QD 1 163 THR HA . . 2.620 2.010 1.857 2.193 . 0 0 "[ . 1 . 2]" 1
1674 1 158 LEU QD 1 164 GLU H . . 3.690 2.836 2.353 3.382 . 0 0 "[ . 1 . 2]" 1
1675 1 158 LEU QD 1 164 GLU HA . . 4.610 3.583 3.195 4.126 . 0 0 "[ . 1 . 2]" 1
1676 1 158 LEU QD 1 164 GLU HG3 . . 3.810 2.717 2.098 3.764 . 0 0 "[ . 1 . 2]" 1
1677 1 158 LEU HG 1 159 ALA H . . 5.060 4.924 4.418 5.139 0.079 14 0 "[ . 1 . 2]" 1
1678 1 158 LEU HG 1 163 THR HA . . 5.410 3.875 2.260 4.885 . 0 0 "[ . 1 . 2]" 1
1679 1 159 ALA H 1 159 ALA MB . . 2.880 2.239 2.189 2.311 . 0 0 "[ . 1 . 2]" 1
1680 1 159 ALA H 1 160 ASN H . . 3.190 2.723 2.455 2.945 . 0 0 "[ . 1 . 2]" 1
1681 1 159 ALA H 1 160 ASN HB3 . . 4.870 6.178 4.938 6.407 1.537 18 19 "[ ****************+-*]" 1
1682 1 159 ALA H 1 162 ALA MB . . 5.500 4.915 4.641 5.184 . 0 0 "[ . 1 . 2]" 1
1683 1 159 ALA HA 1 161 GLY H . . 4.250 3.602 3.274 4.002 . 0 0 "[ . 1 . 2]" 1
1684 1 159 ALA MB 1 160 ASN H . . 3.540 2.924 2.574 3.435 . 0 0 "[ . 1 . 2]" 1
1685 1 159 ALA MB 1 160 ASN HA . . 4.610 4.089 3.937 4.425 . 0 0 "[ . 1 . 2]" 1
1686 1 159 ALA MB 1 160 ASN HB3 . . 5.250 5.356 3.714 5.688 0.438 18 0 "[ . 1 . 2]" 1
1687 1 159 ALA MB 1 160 ASN HD21 . . 4.530 3.356 2.617 4.476 . 0 0 "[ . 1 . 2]" 1
1688 1 159 ALA MB 1 160 ASN HD22 . . 5.070 4.146 3.261 5.164 0.094 1 0 "[ . 1 . 2]" 1
1689 1 159 ALA MB 1 161 GLY H . . 5.440 4.366 4.163 4.723 . 0 0 "[ . 1 . 2]" 1
1690 1 159 ALA MB 1 162 ALA H . . 5.500 5.514 5.316 5.603 0.103 18 0 "[ . 1 . 2]" 1
1691 1 160 ASN H 1 160 ASN HB3 . . 3.280 3.541 2.902 3.676 0.396 18 0 "[ . 1 . 2]" 1
1692 1 160 ASN H 1 160 ASN HD21 . . 5.450 2.953 2.220 3.925 . 0 0 "[ . 1 . 2]" 1
1693 1 160 ASN H 1 161 GLY H . . 3.480 2.779 2.448 3.414 . 0 0 "[ . 1 . 2]" 1
1694 1 160 ASN H 1 161 GLY HA2 . . 5.500 5.054 4.706 5.498 . 0 0 "[ . 1 . 2]" 1
1695 1 160 ASN H 1 162 ALA H . . 4.370 3.616 3.193 4.005 . 0 0 "[ . 1 . 2]" 1
1696 1 160 ASN H 1 162 ALA MB . . 5.500 4.236 3.768 4.684 . 0 0 "[ . 1 . 2]" 1
1697 1 160 ASN HA 1 160 ASN HD22 . . 5.500 4.089 3.752 5.360 . 0 0 "[ . 1 . 2]" 1
1698 1 160 ASN HB3 1 160 ASN HD22 . . 3.910 4.010 3.415 4.161 0.251 20 0 "[ . 1 . 2]" 1
1699 1 160 ASN HB3 1 161 GLY H . . 5.160 4.314 3.972 4.577 . 0 0 "[ . 1 . 2]" 1
1700 1 160 ASN HB3 1 162 ALA H . . 5.500 4.965 4.469 5.559 0.059 1 0 "[ . 1 . 2]" 1
1701 1 160 ASN HB3 1 162 ALA MB . . 5.500 4.760 4.072 5.511 0.011 1 0 "[ . 1 . 2]" 1
1702 1 161 GLY H 1 162 ALA H . . 3.260 2.406 2.058 3.002 . 0 0 "[ . 1 . 2]" 1
1703 1 161 GLY H 1 162 ALA MB . . 5.500 4.188 3.842 4.691 . 0 0 "[ . 1 . 2]" 1
1704 1 162 ALA H 1 162 ALA MB . . 3.100 2.388 2.217 2.565 . 0 0 "[ . 1 . 2]" 1
1705 1 162 ALA H 1 163 THR H . . 4.560 4.486 4.395 4.610 0.050 10 0 "[ . 1 . 2]" 1
1706 1 162 ALA HA 1 163 THR H . . 3.000 2.574 2.482 2.703 . 0 0 "[ . 1 . 2]" 1
1707 1 162 ALA MB 1 163 THR H . . 3.210 2.247 2.070 2.389 . 0 0 "[ . 1 . 2]" 1
1708 1 162 ALA MB 1 163 THR HA . . 4.470 3.811 3.632 3.992 . 0 0 "[ . 1 . 2]" 1
1709 1 163 THR H 1 163 THR HB . . 4.050 3.518 2.988 3.854 . 0 0 "[ . 1 . 2]" 1
1710 1 163 THR H 1 163 THR MG . . 3.790 3.689 3.329 3.902 0.112 10 0 "[ . 1 . 2]" 1
1711 1 163 THR H 1 164 GLU H . . 4.770 4.383 4.302 4.444 . 0 0 "[ . 1 . 2]" 1
1712 1 163 THR HA 1 163 THR MG . . 2.880 2.219 2.069 2.325 . 0 0 "[ . 1 . 2]" 1
1713 1 163 THR HA 1 164 GLU H . . 2.900 2.649 2.509 2.914 0.014 1 0 "[ . 1 . 2]" 1
1714 1 163 THR HB 1 164 GLU H . . 3.160 2.426 1.987 3.191 0.031 12 0 "[ . 1 . 2]" 1
1715 1 163 THR MG 1 164 GLU H . . 3.580 2.755 1.772 3.523 . 0 0 "[ . 1 . 2]" 1
1716 1 164 GLU H 1 164 GLU HB3 . . 3.460 3.288 2.835 3.533 0.073 3 0 "[ . 1 . 2]" 1
1717 1 164 GLU H 1 165 GLN H . . 4.720 4.378 4.199 4.478 . 0 0 "[ . 1 . 2]" 1
1718 1 164 GLU HA 1 164 GLU HG3 . . 3.910 3.384 2.395 3.717 . 0 0 "[ . 1 . 2]" 1
1719 1 164 GLU HA 1 165 GLN H . . 2.750 2.445 2.096 2.649 . 0 0 "[ . 1 . 2]" 1
1720 1 164 GLU HA 1 165 GLN HB3 . . 4.870 5.495 3.842 5.885 1.015 3 16 "[ *+*-***** ** .*****]" 1
1721 1 164 GLU HB3 1 165 GLN H . . 4.050 2.562 1.838 3.573 . 0 0 "[ . 1 . 2]" 1
1722 1 164 GLU HG3 1 165 GLN H . . 4.280 4.266 3.048 4.372 0.092 13 0 "[ . 1 . 2]" 1
1723 1 165 GLN H 1 165 GLN HB3 . . 3.350 3.649 2.924 3.943 0.593 3 5 "[ +*.** 1 .- 2]" 1
1724 1 165 GLN HA 1 165 GLN HB3 . . 2.950 2.665 2.396 2.948 . 0 0 "[ . 1 . 2]" 1
1725 1 165 GLN HB3 1 165 GLN HE22 . . 5.500 3.809 3.210 4.764 . 0 0 "[ . 1 . 2]" 1
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