NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
569316 |
3zfj   |
18943 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_3zfj
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 2151
_Distance_constraint_stats_list.Viol_count 5723
_Distance_constraint_stats_list.Viol_total 17375.125
_Distance_constraint_stats_list.Viol_max 1.992
_Distance_constraint_stats_list.Viol_rms 0.0925
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0202
_Distance_constraint_stats_list.Viol_average_violations_only 0.1518
_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 12 SER 5.610 0.862 16 5 "[ . -*1* * .+ 2]"
1 13 TYR 10.924 0.862 16 5 "[ . -*1* * .+ 2]"
1 14 ILE 3.458 0.297 11 0 "[ . 1 . 2]"
1 15 ASP 3.968 0.297 11 0 "[ . 1 . 2]"
1 16 GLY 2.249 0.288 10 0 "[ . 1 . 2]"
1 17 ASP 0.099 0.076 1 0 "[ . 1 . 2]"
1 18 GLN 7.084 0.645 13 3 "[ - 1 *+ . 2]"
1 19 ALA 5.450 0.778 5 4 "[ - *+ *1 . 2]"
1 20 GLY 7.701 0.778 5 8 "[ -**+ *1 * .* *]"
1 21 GLN 13.443 0.851 2 7 "[ +* . *1 - .* * *]"
1 22 LYS 11.987 0.825 18 8 "[ -* . * ****+ 2]"
1 23 ALA 14.195 0.755 19 3 "[ . *1 - . +2]"
1 24 GLU 6.578 0.755 19 3 "[ . *1 - . +2]"
1 25 ASN 3.650 0.559 4 4 "[ +. 1 -**. 2]"
1 26 LEU 5.055 0.502 14 1 "[ . 1 +. 2]"
1 27 THR 3.486 0.619 7 1 "[ . + 1 . 2]"
1 28 PRO 2.433 0.186 16 0 "[ . 1 . 2]"
1 29 ASP 8.121 0.907 7 4 "[* * . + 1 *. 2]"
1 30 GLU 7.828 0.907 7 4 "[* * . + 1 -. 2]"
1 31 VAL 43.875 1.626 7 20 [***-**+*************]
1 32 SER 11.846 0.799 15 3 "[ . - 1 *+ 2]"
1 33 LYS 6.644 0.799 15 3 "[ . - 1 *+ 2]"
1 34 ARG 6.843 0.930 9 2 "[ -. +1 . 2]"
1 35 GLU 4.457 0.238 1 0 "[ . 1 . 2]"
1 36 GLY 2.241 0.144 11 0 "[ . 1 . 2]"
1 37 ILE 31.564 0.974 18 19 "[********** *-****+**]"
1 38 ASN 0.879 0.125 14 0 "[ . 1 . 2]"
1 39 ALA 15.523 1.140 10 11 "[* -** ** +* * * *2]"
1 40 GLU 3.998 0.945 11 1 "[ . 1+ . 2]"
1 41 GLN 3.347 0.945 11 1 "[ . 1+ . 2]"
1 42 ILE 9.193 0.470 9 0 "[ . 1 . 2]"
1 43 VAL 4.600 0.176 19 0 "[ . 1 . 2]"
1 44 ILE 15.128 0.491 17 0 "[ . 1 . 2]"
1 45 LYS 11.883 0.717 1 2 "[+ . 1 . - 2]"
1 46 ILE 6.450 0.570 15 1 "[ . 1 + 2]"
1 47 THR 26.174 1.090 10 19 [*********+****.*-***]
1 48 ASP 4.750 0.694 6 2 "[ .+ -1 . 2]"
1 49 GLN 2.802 0.758 5 2 "[ + 1- . 2]"
1 50 GLY 0.442 0.133 1 0 "[ . 1 . 2]"
1 51 TYR 13.140 0.903 9 8 "[* ** -+* * . * 2]"
1 52 VAL 15.410 0.536 17 6 "[ *** 1 * . +- 2]"
1 53 THR 32.667 1.364 8 20 [*******+************]
1 54 SER 6.989 0.357 3 0 "[ . 1 . 2]"
1 55 HIS 68.490 1.626 7 20 [******+*****-*******]
1 56 GLY 8.819 0.652 13 1 "[ . 1 + . 2]"
1 57 ASP 0.776 0.107 14 0 "[ . 1 . 2]"
1 58 HIS 42.018 0.974 18 19 "[*********- ******+**]"
1 59 TYR 16.985 0.536 17 6 "[ *** 1 * . +- 2]"
1 60 HIS 10.380 0.486 9 0 "[ . 1 . 2]"
1 61 TYR 11.474 0.632 5 2 "[ + -1 . 2]"
1 62 TYR 7.784 0.296 3 0 "[ . 1 . 2]"
1 63 ASN 17.185 0.839 12 4 "[ .* 1 +* . * 2]"
1 64 GLY 8.871 0.839 12 4 "[ .* 1 +* . * 2]"
1 65 LYS 3.156 0.450 6 0 "[ . 1 . 2]"
1 66 VAL 6.811 0.236 8 0 "[ . 1 . 2]"
1 67 PRO 16.065 0.201 11 0 "[ . 1 . 2]"
1 68 TYR 25.500 0.889 10 3 "[ . + - .* 2]"
1 69 ASP 7.152 0.889 10 2 "[ . + .- 2]"
1 70 ALA 10.342 0.201 11 0 "[ . 1 . 2]"
1 71 ILE 10.258 0.766 11 1 "[ . 1+ . 2]"
1 72 ILE 11.683 0.758 4 9 "[ +.** *1** -* *]"
1 73 SER 2.482 0.500 12 0 "[ . 1 . 2]"
1 74 GLU 13.661 0.796 16 3 "[ . * 1 .+ * 2]"
1 75 GLU 6.618 0.760 2 3 "[ + . * 1 - . 2]"
1 76 LEU 23.197 0.758 4 10 "[* +.** *1** -* *]"
1 77 LEU 17.198 0.786 16 5 "[** . * 1 .+ - 2]"
1 78 MET 9.429 0.786 16 5 "[** . - 1 .+ * 2]"
1 79 LYS 2.988 0.626 16 1 "[ . 1 .+ 2]"
1 80 ASP 9.070 0.894 16 6 "[ * - * * .+* 2]"
1 81 PRO 13.741 0.288 12 0 "[ . 1 . 2]"
1 82 ASN 2.677 0.894 16 1 "[ . 1 .+ 2]"
1 83 TYR 47.237 1.992 4 20 [***+****-***********]
1 84 GLN 22.800 0.588 9 3 "[ . +1 * * 2]"
1 85 LEU 6.063 0.588 9 2 "[ . +1 - . 2]"
1 86 LYS 21.678 0.999 16 4 "[ . * 1 *.+ -2]"
1 87 ASP 11.307 0.989 11 4 "[ - . * 1+ . *]"
1 88 SER 11.661 0.989 11 6 "[ * . * 1+ .* -*]"
1 89 ASP 10.611 0.999 16 6 "[ . ** 1 **.+ -2]"
1 90 ILE 6.337 0.154 16 0 "[ . 1 . 2]"
1 91 VAL 23.094 0.674 9 15 "[** ** -*+1 **** ****]"
1 92 ASN 11.956 0.667 8 8 "[ * -+ * *. ** *]"
1 93 GLU 21.791 0.571 12 1 "[ . 1 + . 2]"
1 94 ILE 28.777 0.571 5 1 "[ + 1 . 2]"
1 95 LYS 19.744 0.393 4 0 "[ . 1 . 2]"
1 96 GLY 7.760 0.541 5 3 "[ + 1 .* -]"
1 97 GLY 7.793 0.571 5 1 "[ + 1 . 2]"
1 98 TYR 19.933 0.368 3 0 "[ . 1 . 2]"
1 99 VAL 15.557 1.036 15 9 "[ * -* * *+ ** *]"
1 100 ILE 9.618 0.278 8 0 "[ . 1 . 2]"
1 101 LYS 7.547 0.285 7 0 "[ . 1 . 2]"
1 102 VAL 3.324 0.146 2 0 "[ . 1 . 2]"
1 103 ASP 15.384 1.992 4 12 "[*-*+.* * * **.** *]"
1 104 GLY 3.692 0.285 7 0 "[ . 1 . 2]"
1 105 LYS 4.458 0.611 13 2 "[ . 1 + - 2]"
1 106 TYR 48.321 1.090 10 20 [******-**+**********]
1 107 TYR 9.384 0.306 1 0 "[ . 1 . 2]"
1 108 VAL 8.389 0.262 20 0 "[ . 1 . 2]"
1 109 TYR 33.838 1.090 19 17 "[*** ******* * ***-+*]"
1 110 LEU 54.509 1.804 16 20 [***************+***-]
1 111 LYS 14.162 0.429 6 0 "[ . 1 . 2]"
1 112 ASP 8.412 0.327 18 0 "[ . 1 . 2]"
1 113 ALA 5.346 0.295 14 0 "[ . 1 . 2]"
1 114 ALA 4.489 0.185 20 0 "[ . 1 . 2]"
1 115 HIS 2.302 0.189 6 0 "[ . 1 . 2]"
1 116 ALA 40.382 1.804 16 20 [***************+*-**]
1 117 ASP 6.282 0.286 1 0 "[ . 1 . 2]"
1 118 ASN 8.247 0.306 11 0 "[ . 1 . 2]"
1 119 ILE 12.960 0.796 16 1 "[ . 1 .+ 2]"
1 120 ARG 9.531 0.664 3 1 "[ + . 1 . 2]"
1 121 THR 10.631 0.387 16 0 "[ . 1 . 2]"
1 122 LYS 12.049 0.760 2 4 "[ + . * 1 * - 2]"
1 123 GLU 9.049 0.473 4 0 "[ . 1 . 2]"
1 124 GLU 6.610 0.824 19 1 "[ . 1 . +2]"
1 125 ILE 16.799 0.795 7 17 "[******+ *** ****** -]"
1 126 LYS 19.768 0.795 7 17 "[******+ *** ****** -]"
1 127 ARG 3.556 0.433 5 0 "[ . 1 . 2]"
1 128 GLN 26.226 1.140 10 20 [***-*****+**********]
1 129 LYS 17.774 0.695 5 18 "[***-+***** ******* *]"
1 130 GLN 19.573 0.737 11 2 "[ . - 1+ . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 35 GLU HG2 1 60 HIS HE1 3.379 . 4.806 4.419 3.553 4.854 0.048 9 0 "[ . 1 . 2]" 1
2 1 35 GLU HB3 1 60 HIS HE1 2.805 . 3.788 3.378 2.975 3.798 0.010 9 0 "[ . 1 . 2]" 1
3 1 35 GLU HB2 1 60 HIS HE1 2.945 . 4.029 3.988 3.472 4.199 0.170 15 0 "[ . 1 . 2]" 1
4 1 31 VAL QG 1 60 HIS HE1 2.831 . 3.833 3.322 2.726 3.900 0.067 9 0 "[ . 1 . 2]" 1
5 1 55 HIS HE1 1 60 HIS HD2 4.177 . 6.358 6.475 6.369 6.512 0.154 15 0 "[ . 1 . 2]" 1
6 1 35 GLU HG2 1 55 HIS HE1 3.913 . 5.827 4.043 3.836 4.269 . 0 0 "[ . 1 . 2]" 1
7 1 35 GLU HB3 1 55 HIS HE1 4.141 . 6.284 5.524 5.293 6.298 0.014 1 0 "[ . 1 . 2]" 1
8 1 35 GLU HG3 1 55 HIS HE1 4.093 . 6.187 4.268 4.044 4.646 . 0 0 "[ . 1 . 2]" 1
9 1 31 VAL QG 1 55 HIS HE1 2.114 . 2.673 2.788 2.679 2.867 0.194 3 0 "[ . 1 . 2]" 1
10 1 58 HIS HE1 1 60 HIS HE1 3.254 . 4.578 4.697 4.631 4.756 0.178 14 0 "[ . 1 . 2]" 1
11 1 55 HIS HE1 1 58 HIS HE1 3.730 . 5.469 5.661 5.615 5.728 0.259 7 0 "[ . 1 . 2]" 1
12 1 56 GLY HA3 1 58 HIS HE1 3.485 . 5.003 5.128 5.007 5.193 0.190 19 0 "[ . 1 . 2]" 1
13 1 37 ILE HB 1 58 HIS HE1 3.434 . 4.908 5.620 3.971 5.882 0.974 18 19 "[*********- ******+**]" 1
14 1 37 ILE HG12 1 58 HIS HE1 3.359 . 4.769 3.591 3.321 3.810 . 0 0 "[ . 1 . 2]" 1
15 1 37 ILE HG13 1 58 HIS HE1 3.440 . 4.919 4.688 2.032 5.037 0.118 15 0 "[ . 1 . 2]" 1
16 1 37 ILE MG 1 58 HIS HE1 2.630 . 3.495 3.687 3.595 3.792 0.297 14 0 "[ . 1 . 2]" 1
17 1 37 ILE MD 1 58 HIS HE1 2.049 . 2.574 2.562 2.402 2.642 0.068 9 0 "[ . 1 . 2]" 1
18 1 115 HIS HA 1 115 HIS HD2 2.602 . 3.448 3.068 2.539 3.637 0.189 6 0 "[ . 1 . 2]" 1
19 1 115 HIS QB 1 115 HIS HD2 3.075 . 4.257 2.882 2.779 3.153 . 0 0 "[ . 1 . 2]" 1
20 1 114 ALA MB 1 115 HIS HD2 2.833 . 3.836 3.814 1.886 4.021 0.185 20 0 "[ . 1 . 2]" 1
21 1 58 HIS HA 1 59 TYR QD 3.166 . 4.419 4.309 4.248 4.336 . 0 0 "[ . 1 . 2]" 1
22 1 54 SER HB3 1 59 TYR QD 3.189 . 4.461 3.328 2.108 3.836 . 0 0 "[ . 1 . 2]" 1
23 1 59 TYR HA 1 59 TYR QD 2.704 . 3.618 2.088 1.967 2.182 . 0 0 "[ . 1 . 2]" 1
24 1 54 SER HA 1 59 TYR QD 2.549 . 3.361 2.086 1.785 2.363 . 0 0 "[ . 1 . 2]" 1
25 1 59 TYR HB3 1 59 TYR QD 2.709 . 3.626 2.737 2.691 2.760 . 0 0 "[ . 1 . 2]" 1
26 1 59 TYR HB2 1 59 TYR QD 2.657 . 3.539 2.336 2.305 2.385 . 0 0 "[ . 1 . 2]" 1
27 1 44 ILE MD 1 59 TYR QD 2.505 . 3.289 2.659 2.521 2.843 . 0 0 "[ . 1 . 2]" 1
28 1 52 VAL QG 1 59 TYR QD 2.615 . 3.470 3.923 3.810 4.006 0.536 17 6 "[ *** 1 * . +- 2]" 1
29 1 54 SER HB2 1 59 TYR QD 3.459 . 4.955 2.479 2.119 3.939 . 0 0 "[ . 1 . 2]" 1
30 1 44 ILE HG13 1 59 TYR QD 3.869 . 5.740 5.133 4.895 5.329 . 0 0 "[ . 1 . 2]" 1
31 1 83 TYR QD 1 109 TYR QD 2.569 . 3.394 3.984 3.415 4.484 1.090 19 13 "[** *****1* * *- +*]" 1
32 1 83 TYR QE 1 109 TYR QD 3.188 . 4.458 4.146 1.486 4.545 0.432 4 0 "[ . 1 . 2]" 1
33 1 109 TYR QD 1 110 LEU HA 3.628 . 5.274 4.562 4.168 4.889 . 0 0 "[ . 1 . 2]" 1
34 1 78 MET HA 1 109 TYR QD 4.290 . 6.591 5.766 3.799 6.374 . 0 0 "[ . 1 . 2]" 1
35 1 85 LEU HA 1 109 TYR QD 3.945 . 5.890 4.371 3.538 4.764 . 0 0 "[ . 1 . 2]" 1
36 1 97 GLY HA2 1 109 TYR QD 3.893 . 5.787 3.902 3.094 5.202 . 0 0 "[ . 1 . 2]" 1
37 1 109 TYR QB 1 109 TYR QD 2.795 . 3.772 2.136 2.111 2.149 . 0 0 "[ . 1 . 2]" 1
38 1 98 TYR HB2 1 109 TYR QD 3.632 . 5.281 2.324 1.987 4.030 . 0 0 "[ . 1 . 2]" 1
39 1 78 MET QG 1 109 TYR QD 3.411 . 4.865 3.047 2.008 3.637 . 0 0 "[ . 1 . 2]" 1
40 1 78 MET HB2 1 109 TYR QD 3.865 . 5.732 4.624 3.130 5.124 . 0 0 "[ . 1 . 2]" 1
41 1 109 TYR HA 1 109 TYR QD 2.761 . 3.714 2.524 2.204 2.671 . 0 0 "[ . 1 . 2]" 1
42 1 78 MET HB3 1 109 TYR QD 3.141 . 4.375 3.314 1.509 3.646 0.398 6 0 "[ . 1 . 2]" 1
43 1 109 TYR QD 1 111 LYS QG 3.903 . 5.807 3.313 3.023 3.812 . 0 0 "[ . 1 . 2]" 1
44 1 85 LEU QB 1 109 TYR QD 3.756 . 5.045 3.015 1.879 3.605 0.114 6 0 "[ . 1 . 2]" 1
45 1 100 ILE MG 1 109 TYR QD 3.275 . 4.616 4.133 3.830 4.439 . 0 0 "[ . 1 . 2]" 1
46 1 78 MET ME 1 109 TYR QD 3.761 . 5.529 4.931 4.247 5.352 . 0 0 "[ . 1 . 2]" 1
47 1 100 ILE MD 1 109 TYR QD 2.986 . 4.100 3.669 3.430 3.892 . 0 0 "[ . 1 . 2]" 1
48 1 85 LEU QD 1 109 TYR QD 2.849 . 3.864 1.941 1.742 2.539 0.092 8 0 "[ . 1 . 2]" 1
49 1 98 TYR HB3 1 109 TYR QD 4.326 . 6.665 3.956 3.660 5.501 . 0 0 "[ . 1 . 2]" 1
50 1 12 SER HA 1 13 TYR HD1 3.834 . 5.672 5.531 3.219 6.534 0.862 16 5 "[ . -*1* * .+ 2]" 1
51 1 13 TYR HB2 1 13 TYR HD1 2.600 . 3.445 3.343 2.423 3.739 0.294 17 0 "[ . 1 . 2]" 1
52 1 13 TYR HB3 1 13 TYR HD1 2.591 . 3.430 2.931 2.420 3.731 0.301 12 0 "[ . 1 . 2]" 1
53 1 106 TYR HA 1 106 TYR QD 2.769 . 3.727 2.920 2.429 2.977 . 0 0 "[ . 1 . 2]" 1
54 1 47 THR HA 1 106 TYR QD 2.729 . 3.660 3.391 3.007 3.683 0.023 6 0 "[ . 1 . 2]" 1
55 1 106 TYR HB2 1 106 TYR QD 2.607 . 3.457 2.310 2.131 2.350 . 0 0 "[ . 1 . 2]" 1
56 1 99 VAL QG 1 106 TYR QD 2.308 . 2.974 2.317 2.071 4.010 1.036 15 1 "[ . 1 + 2]" 1
57 1 46 ILE HB 1 106 TYR QD 2.999 . 4.123 3.230 3.002 3.789 . 0 0 "[ . 1 . 2]" 1
58 1 46 ILE MG 1 106 TYR QD 2.622 . 3.481 2.352 2.180 2.998 . 0 0 "[ . 1 . 2]" 1
59 1 91 VAL HB 1 106 TYR QD 3.728 . 5.465 5.060 4.647 5.277 . 0 0 "[ . 1 . 2]" 1
60 1 90 ILE HA 1 98 TYR QD 3.817 . 5.638 3.678 3.220 4.053 . 0 0 "[ . 1 . 2]" 1
61 1 98 TYR HB3 1 98 TYR HD1 2.782 . 3.749 3.720 3.704 3.743 . 0 0 "[ . 1 . 2]" 1
62 1 93 GLU QB 1 98 TYR HD1 3.247 . 4.564 4.517 3.171 4.642 0.078 4 0 "[ . 1 . 2]" 1
63 1 93 GLU HG3 1 98 TYR HD1 3.614 . 5.247 3.623 3.449 4.856 . 0 0 "[ . 1 . 2]" 1
64 1 98 TYR HD1 1 111 LYS HD2 4.114 . 6.230 4.729 3.617 5.647 . 0 0 "[ . 1 . 2]" 1
65 1 98 TYR HD1 1 111 LYS HB2 3.833 . 5.669 5.821 5.633 6.003 0.334 5 0 "[ . 1 . 2]" 1
66 1 85 LEU QD 1 98 TYR HD1 2.651 . 2.952 2.948 2.918 2.991 0.039 19 0 "[ . 1 . 2]" 1
67 1 97 GLY HA3 1 98 TYR HD1 3.662 . 5.338 4.515 4.402 4.598 . 0 0 "[ . 1 . 2]" 1
68 1 84 GLN HA 1 109 TYR QE 3.482 . 4.998 4.342 3.835 5.090 0.092 4 0 "[ . 1 . 2]" 1
69 1 109 TYR QE 1 111 LYS HA 2.679 . 3.576 3.718 3.353 4.005 0.429 6 0 "[ . 1 . 2]" 1
70 1 85 LEU HA 1 109 TYR QE 3.690 . 5.392 4.907 4.455 5.274 . 0 0 "[ . 1 . 2]" 1
71 1 78 MET QG 1 109 TYR QE 3.878 . 5.758 4.619 2.644 5.208 . 0 0 "[ . 1 . 2]" 1
72 1 98 TYR HD1 1 111 LYS QG 3.555 . 5.134 3.596 3.350 3.742 . 0 0 "[ . 1 . 2]" 1
73 1 85 LEU QB 1 109 TYR QE 3.470 . 4.816 2.940 2.652 3.405 . 0 0 "[ . 1 . 2]" 1
74 1 85 LEU HG 1 109 TYR QE 4.894 . 7.888 4.925 4.613 5.623 . 0 0 "[ . 1 . 2]" 1
75 1 68 TYR HD1 1 93 GLU HG2 4.046 . 6.092 5.057 4.885 5.236 . 0 0 "[ . 1 . 2]" 1
76 1 68 TYR HD1 1 95 LYS HB3 3.692 . 5.395 3.821 3.520 4.131 . 0 0 "[ . 1 . 2]" 1
77 1 68 TYR HD1 1 69 ASP HA 3.016 . 4.153 3.443 3.339 3.597 . 0 0 "[ . 1 . 2]" 1
78 1 68 TYR HD1 1 94 ILE HA 2.586 . 3.422 3.220 2.866 3.404 . 0 0 "[ . 1 . 2]" 1
79 1 68 TYR HA 1 68 TYR HD1 2.642 . 3.514 2.945 2.526 3.371 . 0 0 "[ . 1 . 2]" 1
80 1 68 TYR HD1 1 95 LYS HA 3.284 . 4.632 3.033 2.713 3.445 . 0 0 "[ . 1 . 2]" 1
81 1 68 TYR HD1 1 95 LYS QE 3.778 . 5.562 3.698 2.616 5.352 . 0 0 "[ . 1 . 2]" 1
82 1 68 TYR HB3 1 68 TYR HD1 2.463 . 3.221 2.871 2.670 3.096 . 0 0 "[ . 1 . 2]" 1
83 1 68 TYR HD1 1 69 ASP HB3 3.290 . 4.643 4.542 4.086 5.532 0.889 10 2 "[ . + .- 2]" 1
84 1 68 TYR HD1 1 95 LYS HD2 4.310 . 6.632 4.535 3.431 5.488 . 0 0 "[ . 1 . 2]" 1
85 1 68 TYR QD 1 94 ILE HB 3.516 . 5.061 4.071 3.713 4.337 . 0 0 "[ . 1 . 2]" 1
86 1 68 TYR HD1 1 94 ILE MG 3.217 . 4.510 4.545 4.264 4.666 0.156 7 0 "[ . 1 . 2]" 1
87 1 68 TYR HD1 1 93 GLU HG3 4.143 . 6.289 6.468 6.371 6.598 0.309 2 0 "[ . 1 . 2]" 1
88 1 68 TYR HD1 1 95 LYS HG3 4.030 . 6.060 3.687 2.844 5.246 . 0 0 "[ . 1 . 2]" 1
89 1 68 TYR HD1 1 95 LYS HB2 3.439 . 4.918 2.237 1.991 2.527 . 0 0 "[ . 1 . 2]" 1
90 1 106 TYR HA 1 107 TYR QD 2.630 . 3.495 3.457 3.244 3.581 0.086 15 0 "[ . 1 . 2]" 1
91 1 105 LYS QE 1 107 TYR QD 3.918 . 5.837 5.055 4.374 5.244 . 0 0 "[ . 1 . 2]" 1
92 1 101 LYS HA 1 107 TYR QD 3.613 . 5.245 3.760 3.506 4.128 . 0 0 "[ . 1 . 2]" 1
93 1 60 HIS HD2 1 61 TYR HB2 3.288 . 4.640 4.495 4.089 4.794 0.154 8 0 "[ . 1 . 2]" 1
94 1 107 TYR HB2 1 107 TYR QD 2.650 . 3.528 2.382 2.355 2.433 . 0 0 "[ . 1 . 2]" 1
95 1 24 GLU QG 1 60 HIS HD2 2.778 . 3.743 3.054 2.682 4.229 0.486 9 0 "[ . 1 . 2]" 1
96 1 105 LYS QB 1 107 TYR QD 3.347 . 4.747 3.825 3.647 3.897 . 0 0 "[ . 1 . 2]" 1
97 1 78 MET HB2 1 107 TYR QD 3.361 . 4.773 3.497 2.574 4.084 . 0 0 "[ . 1 . 2]" 1
98 1 100 ILE QG 1 107 TYR QD 3.214 . 4.505 2.832 2.686 2.956 . 0 0 "[ . 1 . 2]" 1
99 1 78 MET ME 1 107 TYR QD 2.596 . 3.438 2.773 2.589 2.993 . 0 0 "[ . 1 . 2]" 1
100 1 102 VAL QG 1 107 TYR QD 2.677 . 3.573 1.921 1.724 2.123 0.057 7 0 "[ . 1 . 2]" 1
101 1 98 TYR HA 1 98 TYR QE 3.356 . 4.764 4.513 4.424 4.581 . 0 0 "[ . 1 . 2]" 1
102 1 60 HIS HA 1 60 HIS HD2 2.972 . 4.076 2.864 2.617 3.028 . 0 0 "[ . 1 . 2]" 1
103 1 83 TYR QD 1 84 GLN HA 2.695 . 3.603 3.735 3.539 3.865 0.262 10 0 "[ . 1 . 2]" 1
104 1 83 TYR QD 1 85 LEU HA 3.306 . 4.672 3.886 3.486 4.214 . 0 0 "[ . 1 . 2]" 1
105 1 97 GLY HA2 1 98 TYR HE1 3.575 . 5.173 5.281 5.183 5.367 0.194 16 0 "[ . 1 . 2]" 1
106 1 98 TYR HB3 1 98 TYR QE 3.326 . 4.709 4.372 4.363 4.389 . 0 0 "[ . 1 . 2]" 1
107 1 83 TYR QB 1 83 TYR QD 2.622 . 3.297 2.133 2.110 2.149 . 0 0 "[ . 1 . 2]" 1
108 1 93 GLU QB 1 98 TYR HE1 3.043 . 4.201 4.077 3.165 4.236 0.035 11 0 "[ . 1 . 2]" 1
109 1 85 LEU HG 1 98 TYR QE 3.943 . 5.886 4.963 4.778 5.167 . 0 0 "[ . 1 . 2]" 1
110 1 98 TYR HE1 1 111 LYS QG 3.928 . 5.323 4.216 3.926 4.440 . 0 0 "[ . 1 . 2]" 1
111 1 85 LEU QD 1 98 TYR QE 2.348 . 3.037 2.992 2.863 3.069 0.032 6 0 "[ . 1 . 2]" 1
112 1 83 TYR QD 1 103 ASP QB 3.585 . 5.192 5.915 5.156 7.184 1.992 4 12 "[*-*+.* * * **.** *]" 1
113 1 106 TYR HA 1 107 TYR QE 3.425 . 4.891 4.632 4.420 4.796 . 0 0 "[ . 1 . 2]" 1
114 1 61 TYR HA 1 61 TYR HD1 2.791 . 3.765 2.634 2.032 2.957 . 0 0 "[ . 1 . 2]" 1
115 1 101 LYS HA 1 107 TYR QE 3.779 . 5.564 4.776 4.572 5.212 . 0 0 "[ . 1 . 2]" 1
116 1 23 ALA HA 1 61 TYR HD1 2.503 . 3.286 2.811 2.503 3.361 0.075 8 0 "[ . 1 . 2]" 1
117 1 102 VAL HA 1 107 TYR QE 3.598 . 5.216 4.801 4.654 5.126 . 0 0 "[ . 1 . 2]" 1
118 1 61 TYR HB2 1 61 TYR HD1 2.732 . 3.665 3.693 3.549 3.742 0.077 13 0 "[ . 1 . 2]" 1
119 1 61 TYR HB3 1 61 TYR HD1 2.703 . 3.616 3.040 2.776 3.350 . 0 0 "[ . 1 . 2]" 1
120 1 107 TYR HB2 1 107 TYR QE 3.290 . 4.643 4.354 4.344 4.370 . 0 0 "[ . 1 . 2]" 1
121 1 23 ALA MB 1 61 TYR HD1 2.629 . 3.493 3.321 2.968 3.617 0.124 4 0 "[ . 1 . 2]" 1
122 1 105 LYS HE2 1 107 TYR QE 3.210 . 4.498 3.684 2.900 4.804 0.306 1 0 "[ . 1 . 2]" 1
123 1 105 LYS QB 1 107 TYR QE 2.540 . 3.347 2.364 2.162 2.457 . 0 0 "[ . 1 . 2]" 1
124 1 78 MET ME 1 107 TYR QE 2.610 . 3.462 3.264 3.031 3.510 0.048 17 0 "[ . 1 . 2]" 1
125 1 100 ILE MD 1 107 TYR QE 3.416 . 4.875 5.068 4.988 5.153 0.278 8 0 "[ . 1 . 2]" 1
126 1 105 LYS QG 1 107 TYR QE 3.552 . 5.129 4.358 3.932 4.450 . 0 0 "[ . 1 . 2]" 1
127 1 51 TYR HA 1 51 TYR QD 3.033 . 4.183 3.423 2.912 3.722 . 0 0 "[ . 1 . 2]" 1
128 1 51 TYR QD 1 66 VAL MG2 2.910 . 3.969 2.180 1.759 2.809 0.092 7 0 "[ . 1 . 2]" 1
129 1 51 TYR HB2 1 51 TYR QD 2.861 . 3.884 2.430 2.195 2.611 . 0 0 "[ . 1 . 2]" 1
130 1 46 ILE MG 1 51 TYR QD 3.540 . 5.107 2.810 1.711 4.177 0.262 4 0 "[ . 1 . 2]" 1
131 1 51 TYR QD 1 52 VAL HA 3.885 . 5.772 3.915 2.493 5.666 . 0 0 "[ . 1 . 2]" 1
132 1 44 ILE HB 1 59 TYR QE 3.767 . 5.541 5.502 5.290 5.634 0.093 1 0 "[ . 1 . 2]" 1
133 1 43 VAL MG1 1 51 TYR QD 2.588 . 3.425 3.118 2.771 3.373 . 0 0 "[ . 1 . 2]" 1
134 1 51 TYR QD 1 66 VAL MG1 3.647 . 5.309 3.816 3.092 4.599 . 0 0 "[ . 1 . 2]" 1
135 1 54 SER HB3 1 59 TYR HE1 2.792 . 3.767 3.333 2.331 3.857 0.090 5 0 "[ . 1 . 2]" 1
136 1 59 TYR HB3 1 59 TYR QE 3.284 . 4.632 4.491 4.476 4.504 . 0 0 "[ . 1 . 2]" 1
137 1 59 TYR HE1 1 129 LYS QE 3.009 . 4.141 3.708 2.820 4.071 . 0 0 "[ . 1 . 2]" 1
138 1 59 TYR HE1 1 129 LYS HD3 3.808 . 5.621 5.284 3.190 5.841 0.220 2 0 "[ . 1 . 2]" 1
139 1 59 TYR HA 1 59 TYR QE 3.102 . 4.305 4.384 4.283 4.430 0.125 18 0 "[ . 1 . 2]" 1
140 1 58 HIS HA 1 59 TYR QE 3.438 . 4.915 4.936 4.759 5.033 0.118 14 0 "[ . 1 . 2]" 1
141 1 54 SER HA 1 59 TYR HE1 2.954 . 4.045 3.854 3.541 4.162 0.117 5 0 "[ . 1 . 2]" 1
142 1 12 SER HA 1 13 TYR QE 3.693 . 5.398 4.998 4.312 5.478 0.080 20 0 "[ . 1 . 2]" 1
143 1 54 SER HB2 1 59 TYR HE1 3.038 . 4.192 2.578 2.196 3.879 . 0 0 "[ . 1 . 2]" 1
144 1 101 LYS HB2 1 106 TYR QE 3.486 . 5.005 2.835 2.561 3.093 . 0 0 "[ . 1 . 2]" 1
145 1 101 LYS HG3 1 106 TYR QE 3.565 . 5.154 3.777 3.097 4.061 . 0 0 "[ . 1 . 2]" 1
146 1 106 TYR HA 1 106 TYR QE 3.582 . 5.186 4.429 4.397 4.460 . 0 0 "[ . 1 . 2]" 1
147 1 47 THR HA 1 106 TYR QE 2.588 . 3.425 4.313 2.819 4.515 1.090 10 19 [*******-*+****.*****] 1
148 1 48 ASP HA 1 106 TYR QE 2.891 . 3.935 2.825 1.833 3.636 0.014 20 0 "[ . 1 . 2]" 1
149 1 91 VAL HA 1 106 TYR QE 3.634 . 5.285 5.675 5.497 5.923 0.638 15 2 "[ . - 1 + 2]" 1
150 1 48 ASP HB3 1 106 TYR QE 3.323 . 4.703 3.994 1.989 5.397 0.694 6 2 "[ .+ -1 . 2]" 1
151 1 101 LYS HE2 1 106 TYR QE 3.638 . 5.292 5.189 4.910 5.387 0.095 19 0 "[ . 1 . 2]" 1
152 1 101 LYS HE3 1 106 TYR QE 3.022 . 4.163 4.222 3.792 4.292 0.129 11 0 "[ . 1 . 2]" 1
153 1 91 VAL HB 1 106 TYR QE 3.467 . 4.969 3.103 2.720 5.408 0.439 15 0 "[ . 1 . 2]" 1
154 1 91 VAL QG 1 106 TYR QE 2.276 . 2.709 2.783 2.728 2.840 0.131 8 0 "[ . 1 . 2]" 1
155 1 101 LYS HG2 1 106 TYR QE 3.920 . 5.841 4.836 4.436 4.955 . 0 0 "[ . 1 . 2]" 1
156 1 46 ILE MG 1 106 TYR QE 2.908 . 3.965 2.922 2.684 4.113 0.148 15 0 "[ . 1 . 2]" 1
157 1 101 LYS HA 1 106 TYR QE 3.841 . 5.685 4.443 4.248 4.648 . 0 0 "[ . 1 . 2]" 1
158 1 68 TYR QE 1 95 LYS QE 3.367 . 4.784 3.824 2.315 4.706 . 0 0 "[ . 1 . 2]" 1
159 1 68 TYR QE 1 93 GLU HG3 3.582 . 5.186 4.778 3.577 5.226 0.040 3 0 "[ . 1 . 2]" 1
160 1 68 TYR QE 1 95 LYS HB3 3.327 . 4.710 4.052 3.895 4.213 . 0 0 "[ . 1 . 2]" 1
161 1 68 TYR QE 1 93 GLU HA 4.076 . 6.153 6.269 5.696 6.724 0.571 12 1 "[ . 1 + . 2]" 1
162 1 68 TYR QE 1 69 ASP HA 3.580 . 5.182 5.343 5.219 5.446 0.264 18 0 "[ . 1 . 2]" 1
163 1 68 TYR QE 1 94 ILE HA 3.098 . 4.298 4.103 3.890 4.288 . 0 0 "[ . 1 . 2]" 1
164 1 68 TYR HA 1 68 TYR QE 3.388 . 4.823 4.527 4.407 4.623 . 0 0 "[ . 1 . 2]" 1
165 1 68 TYR QE 1 95 LYS HA 2.626 . 3.488 1.605 1.371 2.071 0.393 4 0 "[ . 1 . 2]" 1
166 1 68 TYR HB2 1 68 TYR QE 3.184 . 4.451 4.383 4.372 4.398 . 0 0 "[ . 1 . 2]" 1
167 1 68 TYR HB3 1 68 TYR QE 3.221 . 4.518 4.489 4.463 4.507 . 0 0 "[ . 1 . 2]" 1
168 1 68 TYR QE 1 93 GLU HG2 3.105 . 4.310 3.685 3.051 4.217 . 0 0 "[ . 1 . 2]" 1
169 1 68 TYR QE 1 95 LYS HD2 3.340 . 4.735 4.672 4.033 5.028 0.293 9 0 "[ . 1 . 2]" 1
170 1 68 TYR QE 1 95 LYS HD3 3.411 . 4.865 4.645 2.438 5.114 0.249 8 0 "[ . 1 . 2]" 1
171 1 68 TYR QE 1 95 LYS HG3 3.078 . 4.263 2.606 2.047 4.340 0.077 19 0 "[ . 1 . 2]" 1
172 1 68 TYR QE 1 95 LYS HG2 3.439 . 4.918 3.896 3.258 4.521 . 0 0 "[ . 1 . 2]" 1
173 1 68 TYR QE 1 95 LYS HB2 3.059 . 4.229 2.972 2.650 3.348 . 0 0 "[ . 1 . 2]" 1
174 1 68 TYR QE 1 94 ILE MG 3.834 . 5.671 5.456 5.263 5.599 . 0 0 "[ . 1 . 2]" 1
175 1 31 VAL QG 1 62 TYR QE . . 3.233 2.388 1.703 3.242 0.296 3 0 "[ . 1 . 2]" 1
176 1 62 TYR HA 1 62 TYR QE 4.098 . 6.197 4.974 4.686 5.648 . 0 0 "[ . 1 . 2]" 1
177 1 53 THR MG 1 62 TYR QE 3.362 . 4.775 3.875 3.010 4.896 0.121 19 0 "[ . 1 . 2]" 1
178 1 55 HIS HD2 1 60 HIS HE1 4.020 . 6.041 6.187 6.160 6.212 0.171 4 0 "[ . 1 . 2]" 1
179 1 55 HIS HD2 1 59 TYR HA 3.654 . 5.323 4.287 4.108 4.487 . 0 0 "[ . 1 . 2]" 1
180 1 55 HIS HA 1 55 HIS HD2 3.074 . 4.255 4.071 4.005 4.140 . 0 0 "[ . 1 . 2]" 1
181 1 55 HIS HD2 1 60 HIS QB 2.975 . 4.081 2.503 2.377 2.658 . 0 0 "[ . 1 . 2]" 1
182 1 53 THR MG 1 55 HIS HD2 3.328 . 4.712 5.756 5.480 6.076 1.364 8 20 [*******+****-*******] 1
183 1 31 VAL QG 1 55 HIS HD2 3.021 . 4.162 5.553 5.179 5.788 1.626 7 20 [-*****+*************] 1
184 1 52 VAL HA 1 61 TYR QE 3.753 . 5.514 4.958 4.074 5.350 . 0 0 "[ . 1 . 2]" 1
185 1 55 HIS HD2 1 60 HIS HA 3.619 . 5.256 5.045 4.897 5.244 . 0 0 "[ . 1 . 2]" 1
186 1 54 SER HA 1 55 HIS HD2 3.497 . 5.025 4.193 4.066 4.295 . 0 0 "[ . 1 . 2]" 1
187 1 53 THR HB 1 55 HIS HD2 3.837 . 5.678 4.912 4.579 5.266 . 0 0 "[ . 1 . 2]" 1
188 1 55 HIS HB3 1 55 HIS HD2 2.526 . 3.324 3.424 3.314 3.498 0.174 18 0 "[ . 1 . 2]" 1
189 1 41 GLN QG 1 55 HIS HD2 3.359 . 4.769 4.644 4.407 4.792 0.023 7 0 "[ . 1 . 2]" 1
190 1 53 THR HA 1 55 HIS HD2 4.459 . 6.945 6.480 6.339 6.611 . 0 0 "[ . 1 . 2]" 1
191 1 50 GLY QA 1 61 TYR QE 3.553 . 5.131 3.265 2.502 4.483 . 0 0 "[ . 1 . 2]" 1
192 1 61 TYR HA 1 61 TYR QE 3.469 . 4.973 4.461 4.206 4.662 . 0 0 "[ . 1 . 2]" 1
193 1 23 ALA HA 1 61 TYR QE 3.171 . 4.428 4.385 3.940 4.680 0.252 8 0 "[ . 1 . 2]" 1
194 1 61 TYR HB3 1 61 TYR HE1 3.705 . 5.421 4.999 4.846 5.206 . 0 0 "[ . 1 . 2]" 1
195 1 23 ALA MB 1 61 TYR HE1 2.681 . 3.579 3.700 3.399 3.839 0.260 1 0 "[ . 1 . 2]" 1
196 1 47 THR MG 1 61 TYR QE 3.200 . 4.480 4.450 3.851 5.112 0.632 5 2 "[ + -1 . 2]" 1
197 1 52 VAL QG 1 61 TYR HE1 2.700 . 3.611 3.345 2.897 3.637 0.026 4 0 "[ . 1 . 2]" 1
198 1 61 TYR HE1 1 63 ASN HA 3.412 . 4.868 4.414 3.643 4.994 0.126 18 0 "[ . 1 . 2]" 1
199 1 83 TYR QE 1 109 TYR QE 3.461 . 4.958 5.276 2.565 5.749 0.791 19 15 "[*** * ***** * ***-+2]" 1
200 1 51 TYR HE2 1 65 LYS HA 3.884 . 5.769 3.945 2.659 5.127 . 0 0 "[ . 1 . 2]" 1
201 1 83 TYR QE 1 100 ILE MG 3.840 . 5.683 4.052 3.500 4.279 . 0 0 "[ . 1 . 2]" 1
202 1 83 TYR QE 1 85 LEU QD . . 3.107 3.110 3.030 3.173 0.066 14 0 "[ . 1 . 2]" 1
203 1 83 TYR QB 1 83 TYR QE 3.953 . 5.906 3.937 3.919 3.951 . 0 0 "[ . 1 . 2]" 1
204 1 83 TYR QE 1 100 ILE HB 4.231 . 6.469 4.746 4.291 5.076 . 0 0 "[ . 1 . 2]" 1
205 1 51 TYR HE2 1 53 THR MG 3.724 . 5.458 5.157 4.732 5.636 0.178 12 0 "[ . 1 . 2]" 1
206 1 83 TYR QE 1 102 VAL QG . . 3.115 2.792 2.494 3.254 0.139 4 0 "[ . 1 . 2]" 1
207 1 83 TYR QE 1 109 TYR QB 4.195 . 6.395 3.592 3.280 4.112 . 0 0 "[ . 1 . 2]" 1
208 1 55 HIS HD2 1 58 HIS HD2 2.715 . 3.636 2.344 2.250 2.399 . 0 0 "[ . 1 . 2]" 1
209 1 58 HIS HA 1 58 HIS HD2 2.952 . 4.041 4.244 4.222 4.270 0.229 14 0 "[ . 1 . 2]" 1
210 1 54 SER HA 1 58 HIS HD2 4.206 . 6.417 4.515 4.376 4.655 . 0 0 "[ . 1 . 2]" 1
211 1 58 HIS HB2 1 58 HIS HD2 2.820 . 3.814 3.148 3.103 3.188 . 0 0 "[ . 1 . 2]" 1
212 1 58 HIS HB3 1 58 HIS HD2 2.973 . 4.078 3.981 3.971 3.990 . 0 0 "[ . 1 . 2]" 1
213 1 37 ILE MD 1 58 HIS HD2 3.985 . 5.970 3.827 3.632 4.319 . 0 0 "[ . 1 . 2]" 1
214 1 58 HIS HD2 1 59 TYR HA 3.347 . 4.748 3.550 3.469 3.592 . 0 0 "[ . 1 . 2]" 1
215 1 55 HIS HA 1 58 HIS HD2 3.803 . 5.611 5.928 5.890 5.967 0.356 10 0 "[ . 1 . 2]" 1
216 1 52 VAL HB 1 53 THR HA 4.374 . 6.766 4.733 4.606 4.903 . 0 0 "[ . 1 . 2]" 1
217 1 53 THR HA 1 54 SER HB2 3.927 . 5.854 4.916 4.516 5.748 . 0 0 "[ . 1 . 2]" 1
218 1 43 VAL MG2 1 53 THR HA 3.704 . 5.419 3.595 3.452 3.787 . 0 0 "[ . 1 . 2]" 1
219 1 44 ILE MD 1 53 THR HA 4.101 . 6.203 4.238 4.086 4.439 . 0 0 "[ . 1 . 2]" 1
220 1 53 THR HA 1 54 SER HB3 4.097 . 6.195 4.738 4.606 5.715 . 0 0 "[ . 1 . 2]" 1
221 1 53 THR HA 1 54 SER HA 3.839 . 5.681 4.416 4.395 4.444 . 0 0 "[ . 1 . 2]" 1
222 1 59 TYR HA 1 60 HIS HA 4.133 . 6.268 4.379 4.366 4.397 . 0 0 "[ . 1 . 2]" 1
223 1 54 SER HB3 1 59 TYR HA 4.016 . 6.032 4.667 3.658 5.091 . 0 0 "[ . 1 . 2]" 1
224 1 44 ILE MD 1 59 TYR HA 4.075 . 6.151 3.761 3.540 4.025 . 0 0 "[ . 1 . 2]" 1
225 1 54 SER HA 1 59 TYR HA 2.812 . 3.800 2.153 2.033 2.269 . 0 0 "[ . 1 . 2]" 1
226 1 58 HIS HA 1 59 TYR HA 4.148 . 6.298 4.391 4.364 4.423 . 0 0 "[ . 1 . 2]" 1
227 1 54 SER HB2 1 59 TYR HA 4.334 . 6.682 4.004 3.753 5.172 . 0 0 "[ . 1 . 2]" 1
228 1 89 ASP HB3 1 100 ILE HA 4.449 . 6.923 4.771 4.369 5.666 . 0 0 "[ . 1 . 2]" 1
229 1 90 ILE MD 1 100 ILE HA 4.200 . 6.405 5.836 5.531 6.128 . 0 0 "[ . 1 . 2]" 1
230 1 99 VAL QG 1 100 ILE HA 3.553 . 5.131 3.654 3.560 3.914 . 0 0 "[ . 1 . 2]" 1
231 1 100 ILE HA 1 101 LYS HA 4.211 . 6.428 4.387 4.363 4.421 . 0 0 "[ . 1 . 2]" 1
232 1 99 VAL HA 1 100 ILE HA 4.293 . 6.597 4.357 4.326 4.375 . 0 0 "[ . 1 . 2]" 1
233 1 98 TYR HA 1 99 VAL HB 3.940 . 5.880 4.828 4.753 4.966 . 0 0 "[ . 1 . 2]" 1
234 1 118 ASN HA 1 119 ILE HA 4.142 . 6.287 4.456 4.383 4.566 . 0 0 "[ . 1 . 2]" 1
235 1 74 GLU HA 1 119 ILE HA 4.341 . 6.696 4.749 4.524 5.130 . 0 0 "[ . 1 . 2]" 1
236 1 98 TYR HA 1 99 VAL QG 3.994 . 5.988 3.615 3.500 3.906 . 0 0 "[ . 1 . 2]" 1
237 1 94 ILE HG12 1 98 TYR HA 3.367 . 4.784 2.828 2.664 3.051 . 0 0 "[ . 1 . 2]" 1
238 1 93 GLU QB 1 98 TYR HA 4.073 . 6.146 3.892 2.654 4.207 . 0 0 "[ . 1 . 2]" 1
239 1 94 ILE MG 1 98 TYR HA 4.171 . 6.346 4.115 3.952 4.235 . 0 0 "[ . 1 . 2]" 1
240 1 72 ILE HA 1 119 ILE HA 4.464 . 6.955 4.885 4.760 4.999 . 0 0 "[ . 1 . 2]" 1
241 1 119 ILE HA 1 120 ARG HB2 4.489 . 7.008 4.537 4.207 4.864 . 0 0 "[ . 1 . 2]" 1
242 1 105 LYS HA 1 106 TYR HA 3.635 . 5.287 4.324 4.279 4.400 . 0 0 "[ . 1 . 2]" 1
243 1 120 ARG HA 1 121 THR HB 4.407 . 6.835 5.701 5.653 5.760 . 0 0 "[ . 1 . 2]" 1
244 1 120 ARG HA 1 124 GLU HB3 4.153 . 6.309 3.090 2.626 3.934 . 0 0 "[ . 1 . 2]" 1
245 1 71 ILE MG 1 120 ARG HA 3.831 . 5.665 4.354 3.982 4.668 . 0 0 "[ . 1 . 2]" 1
246 1 120 ARG HA 1 121 THR HA 3.882 . 5.766 4.382 4.305 4.443 . 0 0 "[ . 1 . 2]" 1
247 1 51 TYR HA 1 52 VAL HA 3.809 . 5.623 4.421 4.342 4.469 . 0 0 "[ . 1 . 2]" 1
248 1 51 TYR HA 1 66 VAL MG2 3.701 . 5.413 5.326 4.817 5.649 0.236 8 0 "[ . 1 . 2]" 1
249 1 54 SER HA 1 55 HIS HA 3.543 . 5.112 4.357 4.341 4.373 . 0 0 "[ . 1 . 2]" 1
250 1 41 GLN QG 1 55 HIS HA 4.040 . 6.081 5.026 4.443 5.545 . 0 0 "[ . 1 . 2]" 1
251 1 37 ILE MD 1 55 HIS HA 4.182 . 6.368 4.603 4.343 5.215 . 0 0 "[ . 1 . 2]" 1
252 1 50 GLY QA 1 63 ASN HA 3.189 . 4.461 2.166 1.784 2.722 0.133 1 0 "[ . 1 . 2]" 1
253 1 61 TYR HA 1 61 TYR HE1 3.705 . 5.421 4.668 4.306 4.873 . 0 0 "[ . 1 . 2]" 1
254 1 61 TYR HA 1 62 TYR QB 4.157 . 6.317 4.253 3.571 4.663 . 0 0 "[ . 1 . 2]" 1
255 1 23 ALA HA 1 61 TYR HA 3.812 . 5.629 4.404 4.015 4.715 . 0 0 "[ . 1 . 2]" 1
256 1 52 VAL QG 1 61 TYR HA 3.333 . 3.598 2.218 1.946 2.537 . 0 0 "[ . 1 . 2]" 1
257 1 61 TYR HA 1 62 TYR HA 4.193 . 6.391 4.421 4.353 4.477 . 0 0 "[ . 1 . 2]" 1
258 1 91 VAL HA 1 92 ASN HA 4.076 . 6.153 4.596 4.553 4.688 . 0 0 "[ . 1 . 2]" 1
259 1 91 VAL QG 1 92 ASN HA 3.377 . 4.803 4.180 3.997 4.351 . 0 0 "[ . 1 . 2]" 1
260 1 109 TYR HA 1 109 TYR QE 3.590 . 5.201 4.597 4.260 4.681 . 0 0 "[ . 1 . 2]" 1
261 1 109 TYR HA 1 110 LEU QD 4.074 . 4.840 4.800 4.615 5.005 0.165 18 0 "[ . 1 . 2]" 1
262 1 109 TYR HA 1 110 LEU HG 4.152 . 6.307 6.511 6.439 6.547 0.240 4 0 "[ . 1 . 2]" 1
263 1 99 VAL HA 1 108 VAL HA 3.705 . 5.421 2.352 2.054 2.660 . 0 0 "[ . 1 . 2]" 1
264 1 99 VAL QG 1 108 VAL HA 3.958 . 4.572 3.896 3.528 4.083 . 0 0 "[ . 1 . 2]" 1
265 1 47 THR HB 1 48 ASP H 3.179 . 4.442 2.174 1.926 2.678 . 0 0 "[ . 1 . 2]" 1
266 1 121 THR HB 1 122 LYS H 2.295 . 2.954 2.591 2.420 2.832 . 0 0 "[ . 1 . 2]" 1
267 1 121 THR H 1 121 THR HB 3.174 . 4.433 3.582 3.546 3.613 . 0 0 "[ . 1 . 2]" 1
268 1 121 THR HB 1 124 GLU H 3.313 . 4.685 3.065 2.923 3.156 . 0 0 "[ . 1 . 2]" 1
269 1 121 THR HA 1 121 THR HB 2.354 . 3.047 2.564 2.533 2.604 . 0 0 "[ . 1 . 2]" 1
270 1 121 THR HB 1 122 LYS HB2 3.171 . 4.428 4.180 3.981 4.436 0.008 9 0 "[ . 1 . 2]" 1
271 1 121 THR HB 1 121 THR MG 2.149 . 2.726 2.138 2.130 2.146 . 0 0 "[ . 1 . 2]" 1
272 1 121 THR HB 1 123 GLU HA 3.405 . 4.854 5.028 4.917 5.121 0.267 15 0 "[ . 1 . 2]" 1
273 1 53 THR HB 1 54 SER H 2.591 . 3.430 3.018 2.705 3.183 . 0 0 "[ . 1 . 2]" 1
274 1 42 ILE H 1 53 THR HB 3.263 . 4.594 2.734 2.265 3.211 . 0 0 "[ . 1 . 2]" 1
275 1 53 THR HA 1 53 THR HB 2.464 . 3.223 2.504 2.474 2.546 . 0 0 "[ . 1 . 2]" 1
276 1 41 GLN HB3 1 53 THR HB 3.202 . 4.484 2.899 2.459 3.389 . 0 0 "[ . 1 . 2]" 1
277 1 53 THR HB 1 53 THR MG 2.279 . 2.928 2.134 2.130 2.140 . 0 0 "[ . 1 . 2]" 1
278 1 27 THR HB 1 29 ASP HB2 3.297 . 4.656 4.368 3.710 5.275 0.619 7 1 "[ . + 1 . 2]" 1
279 1 27 THR HB 1 29 ASP H 2.565 . 3.388 3.185 2.720 3.419 0.031 4 0 "[ . 1 . 2]" 1
280 1 27 THR HB 1 30 GLU H 3.371 . 4.791 3.860 3.652 4.254 . 0 0 "[ . 1 . 2]" 1
281 1 27 THR HB 1 28 PRO HD2 2.405 . 3.128 1.995 1.732 2.184 . 0 0 "[ . 1 . 2]" 1
282 1 27 THR HB 1 28 PRO HD3 2.651 . 3.529 3.547 3.363 3.606 0.077 19 0 "[ . 1 . 2]" 1
283 1 27 THR HB 1 28 PRO HG2 3.177 . 4.439 3.627 3.286 4.005 . 0 0 "[ . 1 . 2]" 1
284 1 27 THR HB 1 27 THR MG 2.163 . 2.748 2.133 2.129 2.136 . 0 0 "[ . 1 . 2]" 1
285 1 31 VAL HA 1 34 ARG H 3.140 . 4.372 4.146 3.883 4.304 . 0 0 "[ . 1 . 2]" 1
286 1 31 VAL HA 1 34 ARG QD 3.079 . 4.264 3.800 3.030 4.193 . 0 0 "[ . 1 . 2]" 1
287 1 30 GLU HB2 1 31 VAL HA 3.329 . 4.714 4.392 3.942 4.711 . 0 0 "[ . 1 . 2]" 1
288 1 28 PRO HA 1 62 TYR QE 2.902 . 3.955 2.622 2.000 3.427 . 0 0 "[ . 1 . 2]" 1
289 1 28 PRO HA 1 41 GLN HE22 2.853 . 3.871 2.738 2.041 3.653 . 0 0 "[ . 1 . 2]" 1
290 1 28 PRO HA 1 31 VAL H 2.835 . 3.839 3.498 3.141 3.706 . 0 0 "[ . 1 . 2]" 1
291 1 28 PRO HA 1 41 GLN HE21 3.076 . 4.259 3.738 2.829 4.314 0.055 8 0 "[ . 1 . 2]" 1
292 1 28 PRO HA 1 31 VAL HB 2.416 . 3.146 2.746 2.318 3.137 . 0 0 "[ . 1 . 2]" 1
293 1 28 PRO HA 1 28 PRO HB2 2.459 . 3.215 2.806 2.767 2.861 . 0 0 "[ . 1 . 2]" 1
294 1 28 PRO HA 1 28 PRO HB3 2.430 . 3.168 2.254 2.236 2.273 . 0 0 "[ . 1 . 2]" 1
295 1 28 PRO HA 1 31 VAL QG 2.707 . 3.623 2.309 1.959 2.675 . 0 0 "[ . 1 . 2]" 1
296 1 125 ILE H 1 125 ILE HA 2.653 . 3.533 2.755 2.721 2.797 . 0 0 "[ . 1 . 2]" 1
297 1 125 ILE HA 1 126 LYS H 3.071 . 4.250 3.548 3.526 3.580 . 0 0 "[ . 1 . 2]" 1
298 1 122 LYS HA 1 125 ILE HA 3.733 . 5.475 5.115 4.752 5.370 . 0 0 "[ . 1 . 2]" 1
299 1 125 ILE HA 1 125 ILE HG12 2.259 . 2.897 2.469 2.399 2.549 . 0 0 "[ . 1 . 2]" 1
300 1 125 ILE HA 1 125 ILE MG 2.000 . 2.500 2.480 2.432 2.517 0.017 6 0 "[ . 1 . 2]" 1
301 1 125 ILE HA 1 128 GLN QG 3.557 . 5.139 2.987 2.398 3.470 . 0 0 "[ . 1 . 2]" 1
302 1 43 VAL HA 1 44 ILE HG12 3.034 . 4.184 3.785 3.694 3.893 . 0 0 "[ . 1 . 2]" 1
303 1 91 VAL HA 1 92 ASN H 2.982 . 4.094 3.497 3.461 3.556 . 0 0 "[ . 1 . 2]" 1
304 1 90 ILE MG 1 91 VAL HA 3.152 . 4.394 3.711 3.601 3.896 . 0 0 "[ . 1 . 2]" 1
305 1 91 VAL H 1 91 VAL HA 2.621 . 3.480 2.908 2.872 2.920 . 0 0 "[ . 1 . 2]" 1
306 1 91 VAL HA 1 100 ILE HA 3.639 . 5.295 4.986 4.403 5.143 . 0 0 "[ . 1 . 2]" 1
307 1 91 VAL HA 1 91 VAL HB 2.599 . 3.443 3.027 3.018 3.034 . 0 0 "[ . 1 . 2]" 1
308 1 91 VAL HA 1 91 VAL QG 1.988 . 2.482 2.131 2.119 2.148 . 0 0 "[ . 1 . 2]" 1
309 1 73 SER QB 1 74 GLU QG 3.723 . 5.455 4.511 3.736 4.773 . 0 0 "[ . 1 . 2]" 1
310 1 73 SER QB 1 74 GLU H 3.691 . 5.298 3.452 2.817 3.621 . 0 0 "[ . 1 . 2]" 1
311 1 44 ILE MG 1 73 SER QB 2.706 . 2.976 1.974 1.755 2.717 0.036 14 0 "[ . 1 . 2]" 1
312 1 73 SER QB 1 125 ILE MD 2.618 . 3.475 2.208 1.797 2.444 . 0 0 "[ . 1 . 2]" 1
313 1 42 ILE MG 1 73 SER QB 2.898 . 3.948 2.661 2.319 3.359 . 0 0 "[ . 1 . 2]" 1
314 1 73 SER QB 1 76 LEU H 3.407 . 4.858 3.471 3.213 3.798 . 0 0 "[ . 1 . 2]" 1
315 1 73 SER QB 1 122 LYS QG 3.170 . 4.426 4.379 3.757 4.926 0.500 12 0 "[ . 1 . 2]" 1
316 1 44 ILE MG 1 54 SER HB2 2.464 . 3.223 2.552 2.110 3.385 0.162 2 0 "[ . 1 . 2]" 1
317 1 72 ILE MG 1 73 SER QB 2.472 . 3.236 3.230 3.179 3.400 0.164 2 0 "[ . 1 . 2]" 1
318 1 44 ILE MG 1 54 SER HB3 2.532 . 3.333 2.344 2.163 3.467 0.134 1 0 "[ . 1 . 2]" 1
319 1 44 ILE MD 1 54 SER HB3 2.591 . 3.430 2.985 1.920 3.647 0.217 1 0 "[ . 1 . 2]" 1
320 1 90 ILE HA 1 91 VAL H 2.125 . 2.690 2.143 2.120 2.171 . 0 0 "[ . 1 . 2]" 1
321 1 90 ILE HA 1 92 ASN H 2.832 . 3.834 3.495 3.278 3.851 0.017 5 0 "[ . 1 . 2]" 1
322 1 90 ILE H 1 90 ILE HA 2.736 . 3.671 2.805 2.763 2.842 . 0 0 "[ . 1 . 2]" 1
323 1 90 ILE HA 1 90 ILE HG13 2.598 . 3.442 2.806 2.731 2.890 . 0 0 "[ . 1 . 2]" 1
324 1 90 ILE HA 1 100 ILE MG 2.127 . 2.692 1.699 1.540 1.873 0.022 5 0 "[ . 1 . 2]" 1
325 1 90 ILE HA 1 90 ILE HG12 2.454 . 3.207 2.618 2.583 2.665 . 0 0 "[ . 1 . 2]" 1
326 1 90 ILE HA 1 101 LYS H 3.381 . 4.810 3.641 3.441 4.104 . 0 0 "[ . 1 . 2]" 1
327 1 90 ILE HA 1 91 VAL HA 3.403 . 4.850 4.399 4.373 4.439 . 0 0 "[ . 1 . 2]" 1
328 1 81 PRO HA 1 82 ASN H 2.721 . 3.647 3.419 3.335 3.554 . 0 0 "[ . 1 . 2]" 1
329 1 81 PRO HA 1 83 TYR H 3.054 . 4.220 4.058 3.332 4.451 0.231 16 0 "[ . 1 . 2]" 1
330 1 80 ASP HA 1 81 PRO HA 3.275 . 4.616 4.433 4.399 4.495 . 0 0 "[ . 1 . 2]" 1
331 1 81 PRO HA 1 81 PRO HB2 1.958 . 2.437 2.702 2.681 2.725 0.288 12 0 "[ . 1 . 2]" 1
332 1 81 PRO HA 1 81 PRO HB3 2.087 . 2.631 2.293 2.281 2.311 . 0 0 "[ . 1 . 2]" 1
333 1 81 PRO HA 1 81 PRO HD2 3.480 . 4.994 4.084 4.015 4.095 . 0 0 "[ . 1 . 2]" 1
334 1 32 SER H 1 32 SER HA 2.532 . 3.334 2.789 2.721 2.852 . 0 0 "[ . 1 . 2]" 1
335 1 32 SER HA 1 33 LYS H 2.613 . 3.466 3.526 3.498 3.547 0.081 12 0 "[ . 1 . 2]" 1
336 1 32 SER HA 1 41 GLN HE21 3.441 . 4.921 4.302 3.659 4.803 . 0 0 "[ . 1 . 2]" 1
337 1 32 SER HA 1 35 GLU HB3 3.183 . 4.450 4.370 4.056 4.688 0.238 1 0 "[ . 1 . 2]" 1
338 1 31 VAL QG 1 32 SER HA 3.102 . 4.305 2.939 2.720 3.090 . 0 0 "[ . 1 . 2]" 1
339 1 31 VAL HB 1 32 SER HA 3.176 . 4.437 4.022 3.781 4.166 . 0 0 "[ . 1 . 2]" 1
340 1 31 VAL HB 1 32 SER HB3 3.337 . 4.729 5.038 4.730 5.186 0.457 4 0 "[ . 1 . 2]" 1
341 1 32 SER H 1 32 SER HB3 2.701 . 3.613 3.332 2.911 3.539 . 0 0 "[ . 1 . 2]" 1
342 1 32 SER HB3 1 33 LYS H 3.108 . 4.315 3.279 2.622 4.156 . 0 0 "[ . 1 . 2]" 1
343 1 31 VAL HB 1 32 SER HB2 3.461 . 4.958 4.185 3.575 5.034 0.076 8 0 "[ . 1 . 2]" 1
344 1 32 SER HA 1 41 GLN HE22 3.513 . 5.055 4.762 3.945 5.152 0.097 8 0 "[ . 1 . 2]" 1
345 1 87 ASP HB2 1 88 SER QB 3.606 . 5.201 4.501 3.950 5.556 0.355 3 0 "[ . 1 . 2]" 1
346 1 88 SER QB 1 89 ASP H 3.488 . 4.446 3.033 2.853 3.187 . 0 0 "[ . 1 . 2]" 1
347 1 67 PRO HA 1 68 TYR HA 3.567 . 5.157 4.220 4.163 4.264 . 0 0 "[ . 1 . 2]" 1
348 1 67 PRO HA 1 68 TYR H 1.971 . 2.457 2.290 2.176 2.383 . 0 0 "[ . 1 . 2]" 1
349 1 67 PRO HA 1 67 PRO HD3 3.095 . 4.292 3.633 3.564 3.693 . 0 0 "[ . 1 . 2]" 1
350 1 67 PRO HA 1 68 TYR HB2 3.261 . 4.590 4.304 4.180 4.379 . 0 0 "[ . 1 . 2]" 1
351 1 67 PRO HA 1 67 PRO HD2 3.094 . 4.290 4.075 4.067 4.084 . 0 0 "[ . 1 . 2]" 1
352 1 67 PRO HA 1 67 PRO HB3 2.063 . 2.595 2.274 2.257 2.284 . 0 0 "[ . 1 . 2]" 1
353 1 67 PRO HA 1 67 PRO HB2 2.098 . 2.648 2.718 2.706 2.743 0.095 14 0 "[ . 1 . 2]" 1
354 1 67 PRO HA 1 70 ALA MB 3.518 . 5.065 4.391 4.128 4.504 . 0 0 "[ . 1 . 2]" 1
355 1 68 TYR HA 1 95 LYS H 2.655 . 3.536 3.561 3.454 3.680 0.144 19 0 "[ . 1 . 2]" 1
356 1 68 TYR HA 1 68 TYR HB2 2.479 . 3.247 2.611 2.576 2.625 . 0 0 "[ . 1 . 2]" 1
357 1 68 TYR HA 1 68 TYR HB3 2.648 . 3.525 3.007 2.998 3.014 . 0 0 "[ . 1 . 2]" 1
358 1 68 TYR HA 1 94 ILE HB 2.610 . 3.462 3.492 3.338 3.625 0.163 4 0 "[ . 1 . 2]" 1
359 1 46 ILE HA 1 51 TYR HB3 2.669 . 3.559 2.363 1.982 2.788 . 0 0 "[ . 1 . 2]" 1
360 1 46 ILE HA 1 46 ILE HB 2.735 . 3.670 2.995 2.966 3.026 . 0 0 "[ . 1 . 2]" 1
361 1 46 ILE HA 1 46 ILE HG13 2.547 . 3.358 3.268 3.076 3.371 0.013 18 0 "[ . 1 . 2]" 1
362 1 46 ILE HA 1 46 ILE HG12 2.947 . 4.033 2.894 2.604 3.034 . 0 0 "[ . 1 . 2]" 1
363 1 108 VAL HA 1 109 TYR H 2.217 . 2.831 2.071 2.001 2.113 . 0 0 "[ . 1 . 2]" 1
364 1 108 VAL HA 1 109 TYR QB 3.240 . 4.553 3.992 3.890 4.097 . 0 0 "[ . 1 . 2]" 1
365 1 108 VAL HA 1 108 VAL HB 2.709 . 3.626 3.021 3.011 3.025 . 0 0 "[ . 1 . 2]" 1
366 1 108 VAL HA 1 108 VAL MG2 2.179 . 2.772 2.331 2.287 2.371 . 0 0 "[ . 1 . 2]" 1
367 1 100 ILE MD 1 108 VAL HA 3.011 . 4.144 4.046 3.900 4.165 0.021 5 0 "[ . 1 . 2]" 1
368 1 108 VAL H 1 108 VAL HA 2.930 . 4.003 2.934 2.927 2.938 . 0 0 "[ . 1 . 2]" 1
369 1 46 ILE HA 1 51 TYR QD 3.672 . 5.357 3.621 2.129 4.659 . 0 0 "[ . 1 . 2]" 1
370 1 102 VAL HA 1 103 ASP QB 3.445 . 4.929 4.160 4.093 4.230 . 0 0 "[ . 1 . 2]" 1
371 1 102 VAL HA 1 104 GLY H 3.324 . 4.705 3.508 3.344 3.646 . 0 0 "[ . 1 . 2]" 1
372 1 102 VAL HA 1 102 VAL QG 2.231 . 2.853 2.570 2.552 2.600 . 0 0 "[ . 1 . 2]" 1
373 1 14 ILE HA 1 14 ILE HB 2.923 . 3.991 2.782 2.353 3.026 . 0 0 "[ . 1 . 2]" 1
374 1 14 ILE HA 1 19 ALA MB 3.681 . 5.375 4.555 2.565 5.493 0.118 17 0 "[ . 1 . 2]" 1
375 1 66 VAL HA 1 66 VAL HB 2.794 . 3.770 3.026 3.016 3.035 . 0 0 "[ . 1 . 2]" 1
376 1 51 TYR QD 1 66 VAL HA 3.341 . 4.736 3.522 2.727 4.138 . 0 0 "[ . 1 . 2]" 1
377 1 66 VAL HA 1 67 PRO HD3 2.122 . 2.685 2.314 2.230 2.384 . 0 0 "[ . 1 . 2]" 1
378 1 66 VAL HA 1 66 VAL MG2 2.272 . 2.917 2.510 2.442 2.559 . 0 0 "[ . 1 . 2]" 1
379 1 102 VAL HA 1 102 VAL HB 2.716 . 3.638 2.245 2.229 2.261 . 0 0 "[ . 1 . 2]" 1
380 1 42 ILE HA 1 71 ILE HB 2.774 . 3.736 2.256 2.139 2.417 . 0 0 "[ . 1 . 2]" 1
381 1 42 ILE HA 1 42 ILE QG 3.017 . 4.155 2.474 2.421 2.528 . 0 0 "[ . 1 . 2]" 1
382 1 42 ILE HA 1 42 ILE MD 2.807 . 3.792 3.869 3.848 3.905 0.113 2 0 "[ . 1 . 2]" 1
383 1 42 ILE HA 1 42 ILE MG 2.227 . 2.847 2.340 2.304 2.381 . 0 0 "[ . 1 . 2]" 1
384 1 42 ILE HA 1 43 VAL H 2.155 . 2.735 2.199 2.170 2.227 . 0 0 "[ . 1 . 2]" 1
385 1 27 THR H 1 27 THR HA 2.622 . 3.481 2.874 2.836 2.905 . 0 0 "[ . 1 . 2]" 1
386 1 27 THR HA 1 28 PRO HD2 2.441 . 3.186 2.346 2.235 2.479 . 0 0 "[ . 1 . 2]" 1
387 1 27 THR HA 1 28 PRO HD3 2.271 . 2.916 2.492 2.288 2.667 . 0 0 "[ . 1 . 2]" 1
388 1 27 THR HA 1 27 THR MG 2.280 . 2.930 2.336 2.222 2.447 . 0 0 "[ . 1 . 2]" 1
389 1 121 THR HA 1 123 GLU H 3.425 . 4.892 4.085 3.909 4.329 . 0 0 "[ . 1 . 2]" 1
390 1 121 THR HA 1 122 LYS H 2.158 . 2.740 2.387 2.318 2.445 . 0 0 "[ . 1 . 2]" 1
391 1 74 GLU QG 1 121 THR HA 2.400 . 3.120 1.660 1.465 1.909 0.215 9 0 "[ . 1 . 2]" 1
392 1 74 GLU HB2 1 121 THR HA 2.519 . 3.312 3.413 3.287 3.699 0.387 16 0 "[ . 1 . 2]" 1
393 1 37 ILE H 1 37 ILE HA 2.799 . 3.778 2.836 2.762 2.879 . 0 0 "[ . 1 . 2]" 1
394 1 37 ILE HA 1 37 ILE HB 2.337 . 3.020 2.515 2.449 2.939 . 0 0 "[ . 1 . 2]" 1
395 1 37 ILE HA 1 37 ILE MG 2.273 . 2.919 2.325 2.181 2.763 . 0 0 "[ . 1 . 2]" 1
396 1 37 ILE HA 1 37 ILE MD 3.199 . 4.479 4.098 2.724 4.188 . 0 0 "[ . 1 . 2]" 1
397 1 43 VAL H 1 72 ILE HA 2.578 . 3.409 2.591 2.426 2.764 . 0 0 "[ . 1 . 2]" 1
398 1 72 ILE H 1 72 ILE HA 2.831 . 3.833 2.952 2.948 2.956 . 0 0 "[ . 1 . 2]" 1
399 1 72 ILE HA 1 73 SER H 2.256 . 2.892 2.250 2.199 2.332 . 0 0 "[ . 1 . 2]" 1
400 1 43 VAL HB 1 72 ILE HA 2.343 . 3.029 2.643 2.423 2.803 . 0 0 "[ . 1 . 2]" 1
401 1 72 ILE HA 1 72 ILE HG13 2.911 . 3.971 3.794 3.762 3.832 . 0 0 "[ . 1 . 2]" 1
402 1 72 ILE HA 1 72 ILE MG 2.200 . 2.805 2.375 2.336 2.420 . 0 0 "[ . 1 . 2]" 1
403 1 42 ILE MG 1 72 ILE HA 2.545 . 3.355 3.245 3.087 3.385 0.030 16 0 "[ . 1 . 2]" 1
404 1 83 TYR HA 1 84 GLN HB2 3.125 . 4.346 4.511 4.393 4.880 0.534 15 2 "[ . -1 + 2]" 1
405 1 122 LYS H 1 122 LYS HA 2.483 . 3.254 2.799 2.762 2.827 . 0 0 "[ . 1 . 2]" 1
406 1 122 LYS HA 1 125 ILE H 2.747 . 3.690 3.369 3.120 3.573 . 0 0 "[ . 1 . 2]" 1
407 1 52 VAL HA 1 53 THR H 2.201 . 2.806 2.162 2.132 2.219 . 0 0 "[ . 1 . 2]" 1
408 1 52 VAL H 1 52 VAL HA 2.685 . 3.586 2.932 2.905 2.951 . 0 0 "[ . 1 . 2]" 1
409 1 52 VAL HA 1 62 TYR H 3.107 . 4.314 2.949 2.677 3.452 . 0 0 "[ . 1 . 2]" 1
410 1 52 VAL HA 1 61 TYR HD1 3.337 . 4.729 3.851 2.756 4.452 . 0 0 "[ . 1 . 2]" 1
411 1 52 VAL HA 1 52 VAL HB 2.842 . 3.852 3.020 3.007 3.033 . 0 0 "[ . 1 . 2]" 1
412 1 52 VAL HA 1 52 VAL QG 2.132 . 2.700 2.129 2.114 2.150 . 0 0 "[ . 1 . 2]" 1
413 1 52 VAL HA 1 61 TYR HB3 3.783 . 5.572 5.076 4.558 5.427 . 0 0 "[ . 1 . 2]" 1
414 1 37 ILE HA 1 38 ASN QB 3.384 . 4.816 4.200 3.972 4.733 . 0 0 "[ . 1 . 2]" 1
415 1 37 ILE HA 1 39 ALA H 3.657 . 5.328 3.713 3.336 4.134 . 0 0 "[ . 1 . 2]" 1
416 1 68 TYR HB3 1 94 ILE HA 3.413 . 4.869 4.643 4.380 4.895 0.026 11 0 "[ . 1 . 2]" 1
417 1 94 ILE H 1 94 ILE HA 2.797 . 3.775 2.932 2.923 2.938 . 0 0 "[ . 1 . 2]" 1
418 1 68 TYR HA 1 94 ILE HA 2.073 . 2.610 2.021 1.897 2.215 . 0 0 "[ . 1 . 2]" 1
419 1 68 TYR HB2 1 94 ILE HA 3.249 . 4.569 4.322 4.086 4.567 . 0 0 "[ . 1 . 2]" 1
420 1 94 ILE HA 1 94 ILE HB 2.296 . 2.955 2.474 2.455 2.501 . 0 0 "[ . 1 . 2]" 1
421 1 88 SER HA 1 89 ASP H 2.868 . 3.896 3.454 3.373 3.533 . 0 0 "[ . 1 . 2]" 1
422 1 88 SER HA 1 88 SER QB 2.078 . 2.618 2.356 2.222 2.412 . 0 0 "[ . 1 . 2]" 1
423 1 83 TYR HA 1 84 GLN H 1.923 . 2.385 2.111 2.031 2.197 . 0 0 "[ . 1 . 2]" 1
424 1 83 TYR HA 1 83 TYR QB 2.277 . 2.925 2.378 2.254 2.425 . 0 0 "[ . 1 . 2]" 1
425 1 122 LYS HA 1 126 LYS H 3.060 . 4.231 4.330 4.163 4.421 0.190 8 0 "[ . 1 . 2]" 1
426 1 123 GLU HA 1 123 GLU HG3 2.379 . 3.087 3.084 2.819 3.560 0.473 4 0 "[ . 1 . 2]" 1
427 1 71 ILE HA 1 72 ILE H 2.132 . 2.700 2.267 2.228 2.301 . 0 0 "[ . 1 . 2]" 1
428 1 71 ILE H 1 71 ILE HA 2.781 . 3.748 2.933 2.917 2.947 . 0 0 "[ . 1 . 2]" 1
429 1 71 ILE HA 1 118 ASN QB 2.769 . 3.727 2.342 1.803 2.593 0.044 1 0 "[ . 1 . 2]" 1
430 1 71 ILE HA 1 71 ILE HB 2.877 . 3.912 3.023 3.016 3.032 . 0 0 "[ . 1 . 2]" 1
431 1 71 ILE HA 1 71 ILE HG13 2.750 . 3.695 3.730 3.684 3.782 0.087 20 0 "[ . 1 . 2]" 1
432 1 71 ILE HA 1 71 ILE MG 2.288 . 2.942 2.362 2.306 2.423 . 0 0 "[ . 1 . 2]" 1
433 1 125 ILE MG 1 126 LYS HA 2.848 . 3.862 3.267 2.992 3.448 . 0 0 "[ . 1 . 2]" 1
434 1 126 LYS H 1 126 LYS HA 2.356 . 3.050 2.847 2.787 2.873 . 0 0 "[ . 1 . 2]" 1
435 1 47 THR HA 1 47 THR MG 2.380 . 3.088 2.356 2.291 2.455 . 0 0 "[ . 1 . 2]" 1
436 1 33 LYS H 1 33 LYS HA 2.127 . 2.692 2.777 2.721 2.832 0.140 15 0 "[ . 1 . 2]" 1
437 1 33 LYS HA 1 33 LYS HG2 2.356 . 3.050 2.531 2.433 2.627 . 0 0 "[ . 1 . 2]" 1
438 1 33 LYS HA 1 33 LYS HG3 2.418 . 3.149 2.997 2.729 3.104 . 0 0 "[ . 1 . 2]" 1
439 1 33 LYS HA 1 38 ASN HA 3.105 . 4.310 4.257 3.438 4.435 0.125 14 0 "[ . 1 . 2]" 1
440 1 128 GLN HA 1 129 LYS H 2.880 . 3.917 3.437 3.336 3.525 . 0 0 "[ . 1 . 2]" 1
441 1 128 GLN HA 1 128 GLN QB 2.174 . 2.765 2.350 2.139 2.450 . 0 0 "[ . 1 . 2]" 1
442 1 111 LYS HA 1 111 LYS HB3 1.917 . 2.376 2.471 2.442 2.507 0.131 5 0 "[ . 1 . 2]" 1
443 1 95 LYS HA 1 96 GLY H 1.976 . 2.464 2.084 2.051 2.105 . 0 0 "[ . 1 . 2]" 1
444 1 95 LYS HA 1 96 GLY HA3 3.443 . 4.925 4.339 4.330 4.365 . 0 0 "[ . 1 . 2]" 1
445 1 95 LYS HA 1 95 LYS HB3 2.524 . 3.320 2.989 2.934 3.014 . 0 0 "[ . 1 . 2]" 1
446 1 95 LYS HA 1 95 LYS HG3 2.352 . 3.043 2.353 2.211 2.846 . 0 0 "[ . 1 . 2]" 1
447 1 95 LYS HA 1 95 LYS HB2 2.296 . 2.955 2.570 2.450 2.716 . 0 0 "[ . 1 . 2]" 1
448 1 95 LYS H 1 95 LYS HA 2.502 . 3.284 2.849 2.826 2.875 . 0 0 "[ . 1 . 2]" 1
449 1 91 VAL H 1 100 ILE HA 2.464 . 3.223 2.218 1.724 2.421 . 0 0 "[ . 1 . 2]" 1
450 1 100 ILE HA 1 101 LYS H 2.174 . 2.765 2.225 2.134 2.277 . 0 0 "[ . 1 . 2]" 1
451 1 92 ASN H 1 100 ILE HA 3.327 . 4.710 3.618 3.465 3.829 . 0 0 "[ . 1 . 2]" 1
452 1 90 ILE HA 1 100 ILE HA 2.449 . 3.199 2.625 2.250 2.943 . 0 0 "[ . 1 . 2]" 1
453 1 89 ASP HB2 1 100 ILE HA 3.786 . 5.578 5.147 3.962 5.608 0.030 18 0 "[ . 1 . 2]" 1
454 1 91 VAL HB 1 100 ILE HA 3.394 . 4.834 3.706 3.166 3.886 . 0 0 "[ . 1 . 2]" 1
455 1 100 ILE HA 1 100 ILE HB 2.371 . 3.074 2.495 2.472 2.523 . 0 0 "[ . 1 . 2]" 1
456 1 100 ILE HA 1 100 ILE MD 3.349 . 4.751 4.192 4.182 4.198 . 0 0 "[ . 1 . 2]" 1
457 1 110 LEU HA 1 111 LYS HA 3.251 . 4.572 4.347 4.316 4.365 . 0 0 "[ . 1 . 2]" 1
458 1 111 LYS H 1 111 LYS HA 2.533 . 3.335 2.881 2.860 2.907 . 0 0 "[ . 1 . 2]" 1
459 1 106 TYR HA 1 107 TYR H 2.142 . 2.716 2.122 2.099 2.146 . 0 0 "[ . 1 . 2]" 1
460 1 106 TYR HA 1 106 TYR HB2 2.645 . 3.519 2.875 2.845 3.017 . 0 0 "[ . 1 . 2]" 1
461 1 106 TYR HA 1 106 TYR HB3 2.561 . 3.381 2.793 2.481 2.831 . 0 0 "[ . 1 . 2]" 1
462 1 99 VAL QG 1 106 TYR HA 3.353 . 4.758 4.699 4.561 4.774 0.016 12 0 "[ . 1 . 2]" 1
463 1 101 LYS HB3 1 106 TYR HA 3.412 . 4.868 4.904 4.738 5.113 0.245 9 0 "[ . 1 . 2]" 1
464 1 124 GLU HA 1 127 ARG QB 2.090 . 2.636 2.253 1.501 2.632 0.043 19 0 "[ . 1 . 2]" 1
465 1 124 GLU HA 1 125 ILE H 3.112 . 4.323 3.500 3.456 3.536 . 0 0 "[ . 1 . 2]" 1
466 1 124 GLU HA 1 127 ARG H 2.834 . 3.838 3.016 2.692 3.255 . 0 0 "[ . 1 . 2]" 1
467 1 124 GLU HA 1 124 GLU HG3 2.756 . 3.706 2.402 2.273 2.586 . 0 0 "[ . 1 . 2]" 1
468 1 124 GLU HA 1 124 GLU HB2 2.305 . 2.969 2.478 2.395 2.531 . 0 0 "[ . 1 . 2]" 1
469 1 124 GLU HA 1 127 ARG HG2 3.681 . 5.374 4.260 3.597 5.132 . 0 0 "[ . 1 . 2]" 1
470 1 75 GLU HA 1 76 LEU H 3.027 . 4.172 3.440 3.400 3.485 . 0 0 "[ . 1 . 2]" 1
471 1 75 GLU HA 1 77 LEU H 3.184 . 4.451 4.072 3.763 4.482 0.031 18 0 "[ . 1 . 2]" 1
472 1 75 GLU HA 1 75 GLU HB2 2.247 . 2.878 2.994 2.959 3.004 0.126 6 0 "[ . 1 . 2]" 1
473 1 34 ARG H 1 34 ARG HA 2.148 . 2.724 2.838 2.762 2.875 0.151 17 0 "[ . 1 . 2]" 1
474 1 34 ARG HA 1 34 ARG HG2 2.306 . 2.970 2.561 2.385 3.586 0.616 4 2 "[ +. -1 . 2]" 1
475 1 74 GLU HA 1 74 GLU HB2 2.133 . 2.702 2.405 2.368 2.480 . 0 0 "[ . 1 . 2]" 1
476 1 74 GLU HA 1 77 LEU HG 2.115 . 2.674 2.170 1.639 2.444 . 0 0 "[ . 1 . 2]" 1
477 1 44 ILE H 1 53 THR HA 2.950 . 4.038 2.321 2.198 2.496 . 0 0 "[ . 1 . 2]" 1
478 1 43 VAL HA 1 53 THR HA 2.454 . 3.206 1.929 1.830 2.011 . 0 0 "[ . 1 . 2]" 1
479 1 44 ILE HG12 1 53 THR HA 2.943 . 4.026 2.862 2.683 3.113 . 0 0 "[ . 1 . 2]" 1
480 1 43 VAL MG1 1 53 THR HA 2.764 . 3.719 3.713 3.567 3.808 0.089 2 0 "[ . 1 . 2]" 1
481 1 45 LYS H 1 53 THR HA 3.469 . 4.974 3.986 3.831 4.159 . 0 0 "[ . 1 . 2]" 1
482 1 13 TYR HA 1 13 TYR HB2 2.572 . 3.399 2.909 2.477 3.029 . 0 0 "[ . 1 . 2]" 1
483 1 13 TYR HA 1 13 TYR HB3 2.705 . 3.620 2.442 2.292 2.562 . 0 0 "[ . 1 . 2]" 1
484 1 35 GLU H 1 35 GLU HA 2.382 . 3.091 2.870 2.790 2.920 . 0 0 "[ . 1 . 2]" 1
485 1 116 ALA MB 1 119 ILE HA 3.805 . 5.614 5.040 4.500 5.868 0.254 14 0 "[ . 1 . 2]" 1
486 1 73 SER HA 1 74 GLU H 2.146 . 2.722 2.215 2.172 2.270 . 0 0 "[ . 1 . 2]" 1
487 1 73 SER HA 1 120 ARG H 2.986 . 4.100 3.180 2.819 3.452 . 0 0 "[ . 1 . 2]" 1
488 1 73 SER H 1 73 SER HA 2.902 . 3.955 2.870 2.855 2.896 . 0 0 "[ . 1 . 2]" 1
489 1 73 SER HA 1 119 ILE HA 3.400 . 4.845 4.351 4.043 4.651 . 0 0 "[ . 1 . 2]" 1
490 1 87 ASP HA 1 89 ASP H 3.428 . 4.897 3.959 3.652 4.193 . 0 0 "[ . 1 . 2]" 1
491 1 87 ASP HA 1 90 ILE H 2.918 . 3.982 3.422 3.025 3.688 . 0 0 "[ . 1 . 2]" 1
492 1 87 ASP HA 1 90 ILE MD 2.016 . 2.524 1.480 1.434 1.534 0.074 6 0 "[ . 1 . 2]" 1
493 1 87 ASP HA 1 90 ILE HB 2.710 . 3.628 2.889 2.424 3.378 . 0 0 "[ . 1 . 2]" 1
494 1 87 ASP HA 1 90 ILE HG13 2.608 . 3.458 2.970 2.628 3.288 . 0 0 "[ . 1 . 2]" 1
495 1 72 ILE H 1 119 ILE HA 2.771 . 3.731 2.964 2.774 3.153 . 0 0 "[ . 1 . 2]" 1
496 1 119 ILE HA 1 120 ARG H 2.050 . 2.575 2.087 2.060 2.117 . 0 0 "[ . 1 . 2]" 1
497 1 119 ILE H 1 119 ILE HA 2.673 . 3.566 2.928 2.906 2.944 . 0 0 "[ . 1 . 2]" 1
498 1 119 ILE HA 1 119 ILE HB 2.654 . 3.534 3.014 3.005 3.020 . 0 0 "[ . 1 . 2]" 1
499 1 119 ILE HA 1 119 ILE HG12 2.733 . 3.666 3.091 2.944 3.199 . 0 0 "[ . 1 . 2]" 1
500 1 119 ILE HA 1 119 ILE MG 2.296 . 2.955 2.387 2.347 2.477 . 0 0 "[ . 1 . 2]" 1
501 1 93 GLU H 1 93 GLU HA 2.926 . 3.996 2.944 2.924 2.949 . 0 0 "[ . 1 . 2]" 1
502 1 93 GLU HA 1 99 VAL H 3.153 . 4.396 2.920 2.212 3.496 . 0 0 "[ . 1 . 2]" 1
503 1 93 GLU HA 1 94 ILE H 2.139 . 2.711 2.163 2.110 2.318 . 0 0 "[ . 1 . 2]" 1
504 1 93 GLU HA 1 98 TYR HA 2.498 . 3.278 2.267 2.046 2.427 . 0 0 "[ . 1 . 2]" 1
505 1 93 GLU HA 1 93 GLU HG2 2.510 . 3.297 3.213 3.023 3.505 0.208 8 0 "[ . 1 . 2]" 1
506 1 93 GLU HA 1 93 GLU QB 2.280 . 2.930 2.264 2.146 2.286 . 0 0 "[ . 1 . 2]" 1
507 1 93 GLU HA 1 94 ILE HG13 3.349 . 4.751 5.104 4.971 5.208 0.457 16 0 "[ . 1 . 2]" 1
508 1 54 SER HA 1 54 SER HB3 2.855 . 3.874 2.863 2.425 3.039 . 0 0 "[ . 1 . 2]" 1
509 1 44 ILE MG 1 54 SER HA 3.459 . 4.955 4.115 3.979 4.292 . 0 0 "[ . 1 . 2]" 1
510 1 42 ILE MG 1 73 SER HA 2.714 . 3.635 2.783 2.524 3.013 . 0 0 "[ . 1 . 2]" 1
511 1 29 ASP HA 1 31 VAL HB 3.425 . 4.892 4.717 4.403 4.937 0.045 6 0 "[ . 1 . 2]" 1
512 1 29 ASP HA 1 32 SER H 2.812 . 3.801 3.630 3.337 3.814 0.013 4 0 "[ . 1 . 2]" 1
513 1 87 ASP HA 1 90 ILE MG 3.165 . 4.417 4.009 3.730 4.256 . 0 0 "[ . 1 . 2]" 1
514 1 129 LYS HA 1 130 GLN H 2.885 . 3.925 3.313 3.257 3.534 . 0 0 "[ . 1 . 2]" 1
515 1 129 LYS HA 1 129 LYS QE 3.092 . 4.287 4.137 4.077 4.250 . 0 0 "[ . 1 . 2]" 1
516 1 129 LYS HA 1 129 LYS QB 2.219 . 2.835 2.189 2.155 2.358 . 0 0 "[ . 1 . 2]" 1
517 1 98 TYR HA 1 99 VAL H 2.241 . 2.869 2.167 2.140 2.235 . 0 0 "[ . 1 . 2]" 1
518 1 94 ILE H 1 98 TYR HA 2.666 . 3.554 2.383 2.285 2.498 . 0 0 "[ . 1 . 2]" 1
519 1 98 TYR HA 1 98 TYR HD1 2.779 . 3.744 3.202 2.974 3.320 . 0 0 "[ . 1 . 2]" 1
520 1 98 TYR HA 1 98 TYR HB3 2.461 . 3.218 2.660 2.647 2.686 . 0 0 "[ . 1 . 2]" 1
521 1 98 TYR HA 1 98 TYR HB2 2.725 . 3.653 2.984 2.974 2.995 . 0 0 "[ . 1 . 2]" 1
522 1 44 ILE H 1 45 LYS HA 3.878 . 5.758 4.852 4.803 4.910 . 0 0 "[ . 1 . 2]" 1
523 1 45 LYS HA 1 46 ILE H 2.050 . 2.575 2.201 2.146 2.238 . 0 0 "[ . 1 . 2]" 1
524 1 45 LYS HA 1 45 LYS HB2 2.253 . 2.887 2.395 2.344 2.454 . 0 0 "[ . 1 . 2]" 1
525 1 45 LYS HA 1 45 LYS HB3 2.333 . 3.013 3.010 2.998 3.022 0.009 1 0 "[ . 1 . 2]" 1
526 1 45 LYS HA 1 45 LYS HG2 2.607 . 3.456 3.222 2.446 3.481 0.025 11 0 "[ . 1 . 2]" 1
527 1 45 LYS HA 1 76 LEU MD2 2.341 . 3.026 2.628 2.175 3.009 . 0 0 "[ . 1 . 2]" 1
528 1 59 TYR HA 1 59 TYR HB3 2.562 . 3.382 2.439 2.416 2.465 . 0 0 "[ . 1 . 2]" 1
529 1 59 TYR HA 1 59 TYR HB2 2.819 . 3.813 3.028 3.024 3.031 . 0 0 "[ . 1 . 2]" 1
530 1 52 VAL QG 1 59 TYR HA 3.139 . 4.370 3.630 3.504 3.784 . 0 0 "[ . 1 . 2]" 1
531 1 47 THR H 1 51 TYR HA 2.723 . 3.650 2.772 2.387 2.966 . 0 0 "[ . 1 . 2]" 1
532 1 51 TYR HA 1 52 VAL H 2.158 . 2.740 2.452 2.342 2.525 . 0 0 "[ . 1 . 2]" 1
533 1 46 ILE HA 1 51 TYR HA 2.410 . 3.136 2.440 2.041 2.815 . 0 0 "[ . 1 . 2]" 1
534 1 51 TYR HA 1 51 TYR HB3 2.346 . 3.034 2.337 2.210 2.439 . 0 0 "[ . 1 . 2]" 1
535 1 51 TYR HA 1 52 VAL HB 3.591 . 5.203 4.864 4.747 4.974 . 0 0 "[ . 1 . 2]" 1
536 1 47 THR MG 1 51 TYR HA 3.608 . 5.235 3.993 3.677 4.540 . 0 0 "[ . 1 . 2]" 1
537 1 45 LYS H 1 51 TYR HA 4.258 . 6.524 5.102 4.923 5.304 . 0 0 "[ . 1 . 2]" 1
538 1 109 TYR H 1 109 TYR HA 2.853 . 3.870 2.887 2.872 2.901 . 0 0 "[ . 1 . 2]" 1
539 1 109 TYR HA 1 110 LEU H 2.090 . 2.636 2.116 2.005 2.180 . 0 0 "[ . 1 . 2]" 1
540 1 78 MET HB3 1 109 TYR HA 2.878 . 3.914 2.204 1.844 2.547 . 0 0 "[ . 1 . 2]" 1
541 1 78 MET HB2 1 109 TYR HA 3.625 . 5.267 3.524 2.782 4.087 . 0 0 "[ . 1 . 2]" 1
542 1 41 GLN HA 1 55 HIS HA 3.364 . 4.778 3.706 3.130 4.112 . 0 0 "[ . 1 . 2]" 1
543 1 41 GLN HA 1 53 THR HB 3.112 . 4.323 2.957 2.645 3.250 . 0 0 "[ . 1 . 2]" 1
544 1 41 GLN HA 1 41 GLN QG 3.243 . 3.816 2.318 2.134 2.454 . 0 0 "[ . 1 . 2]" 1
545 1 48 ASP HA 1 48 ASP HB2 2.365 . 3.064 2.503 2.373 3.014 . 0 0 "[ . 1 . 2]" 1
546 1 48 ASP HA 1 48 ASP HB3 2.512 . 3.301 2.723 2.399 3.029 . 0 0 "[ . 1 . 2]" 1
547 1 49 GLN HA 1 49 GLN HG3 2.203 . 2.810 2.769 2.420 3.568 0.758 5 2 "[ + 1- . 2]" 1
548 1 49 GLN HA 1 49 GLN QB 2.112 . 2.669 2.367 2.308 2.523 . 0 0 "[ . 1 . 2]" 1
549 1 107 TYR HA 1 107 TYR HB3 2.249 . 2.882 2.430 2.408 2.468 . 0 0 "[ . 1 . 2]" 1
550 1 51 TYR HA 1 52 VAL QG 2.654 . 3.534 3.234 3.092 3.353 . 0 0 "[ . 1 . 2]" 1
551 1 53 THR H 1 61 TYR HA 3.194 . 4.470 3.350 3.061 3.708 . 0 0 "[ . 1 . 2]" 1
552 1 52 VAL HA 1 61 TYR HA 2.616 . 3.472 2.167 1.840 2.503 . 0 0 "[ . 1 . 2]" 1
553 1 61 TYR HA 1 61 TYR HB3 2.574 . 3.402 3.001 2.967 3.029 . 0 0 "[ . 1 . 2]" 1
554 1 18 GLN HA 1 18 GLN HG2 2.537 . 3.342 2.792 2.426 3.769 0.427 1 0 "[ . 1 . 2]" 1
555 1 18 GLN HA 1 18 GLN HB3 2.486 . 3.258 2.561 2.346 3.027 . 0 0 "[ . 1 . 2]" 1
556 1 18 GLN HA 1 18 GLN HB2 2.868 . 3.896 2.877 2.361 3.024 . 0 0 "[ . 1 . 2]" 1
557 1 85 LEU H 1 85 LEU HA 2.508 . 3.294 2.773 2.751 2.854 . 0 0 "[ . 1 . 2]" 1
558 1 84 GLN HA 1 85 LEU HA 3.322 . 4.702 4.235 4.187 4.289 . 0 0 "[ . 1 . 2]" 1
559 1 85 LEU HA 1 86 LYS H 2.042 . 2.563 2.134 2.117 2.162 . 0 0 "[ . 1 . 2]" 1
560 1 83 TYR QE 1 85 LEU HA 2.426 . 3.162 2.344 2.084 2.630 . 0 0 "[ . 1 . 2]" 1
561 1 85 LEU HA 1 85 LEU QB 2.479 . 3.114 2.329 2.309 2.365 . 0 0 "[ . 1 . 2]" 1
562 1 107 TYR HA 1 107 TYR HB2 2.592 . 3.432 3.032 3.028 3.036 . 0 0 "[ . 1 . 2]" 1
563 1 76 LEU HB3 1 107 TYR HA 2.612 . 3.465 3.065 2.612 3.410 . 0 0 "[ . 1 . 2]" 1
564 1 107 TYR H 1 107 TYR HA 2.763 . 3.717 2.931 2.923 2.939 . 0 0 "[ . 1 . 2]" 1
565 1 107 TYR HA 1 108 VAL H 2.245 . 2.875 2.436 2.356 2.576 . 0 0 "[ . 1 . 2]" 1
566 1 107 TYR HA 1 108 VAL MG2 2.578 . 3.409 3.548 3.477 3.602 0.193 10 0 "[ . 1 . 2]" 1
567 1 62 TYR HA 1 63 ASN H 2.231 . 2.853 2.346 2.144 2.532 . 0 0 "[ . 1 . 2]" 1
568 1 62 TYR HA 1 62 TYR QB 2.564 . 3.386 2.293 2.146 2.423 . 0 0 "[ . 1 . 2]" 1
569 1 22 LYS HA 1 23 ALA H 2.023 . 2.535 2.376 2.000 2.674 0.139 19 0 "[ . 1 . 2]" 1
570 1 24 GLU HA 1 26 LEU H 3.312 . 4.683 3.496 3.004 4.156 . 0 0 "[ . 1 . 2]" 1
571 1 22 LYS HA 1 22 LYS QG 2.411 . 3.137 2.439 2.150 2.894 . 0 0 "[ . 1 . 2]" 1
572 1 130 GLN H 1 130 GLN HA 2.309 . 2.976 2.883 2.834 2.921 . 0 0 "[ . 1 . 2]" 1
573 1 130 GLN HA 1 130 GLN HG3 2.277 . 2.925 3.122 3.005 3.651 0.726 11 1 "[ . 1+ . 2]" 1
574 1 130 GLN HA 1 130 GLN HB3 2.133 . 2.702 2.469 2.370 2.682 . 0 0 "[ . 1 . 2]" 1
575 1 130 GLN HA 1 130 GLN HB2 2.291 . 2.947 2.949 2.235 3.016 0.069 15 0 "[ . 1 . 2]" 1
576 1 58 HIS HA 1 58 HIS HB2 2.814 . 3.804 2.491 2.471 2.508 . 0 0 "[ . 1 . 2]" 1
577 1 77 LEU HA 1 77 LEU HB2 2.350 . 3.040 2.838 2.357 3.000 . 0 0 "[ . 1 . 2]" 1
578 1 77 LEU HA 1 108 VAL HB 2.865 . 3.891 2.685 1.834 3.407 0.005 18 0 "[ . 1 . 2]" 1
579 1 77 LEU HA 1 77 LEU HB3 2.398 . 3.117 2.533 2.396 2.595 . 0 0 "[ . 1 . 2]" 1
580 1 77 LEU HA 1 78 MET H 2.223 . 2.841 2.158 2.083 2.317 . 0 0 "[ . 1 . 2]" 1
581 1 77 LEU H 1 77 LEU HA 2.768 . 3.726 2.785 2.720 2.820 . 0 0 "[ . 1 . 2]" 1
582 1 58 HIS HA 1 59 TYR HE1 3.583 . 5.188 5.228 5.140 5.272 0.084 11 0 "[ . 1 . 2]" 1
583 1 77 LEU HA 1 78 MET HB3 3.145 . 4.382 4.415 4.157 4.497 0.115 12 0 "[ . 1 . 2]" 1
584 1 79 LYS HA 1 79 LYS HB3 2.207 . 2.816 2.705 2.435 3.034 0.218 9 0 "[ . 1 . 2]" 1
585 1 79 LYS HA 1 79 LYS QG 2.107 . 2.662 2.462 2.323 2.725 0.063 13 0 "[ . 1 . 2]" 1
586 1 79 LYS HA 1 79 LYS HB2 2.475 . 3.241 2.806 2.449 3.031 . 0 0 "[ . 1 . 2]" 1
587 1 103 ASP H 1 103 ASP HA 2.242 . 2.871 2.266 2.258 2.275 . 0 0 "[ . 1 . 2]" 1
588 1 21 GLN HA 1 21 GLN HG2 2.538 . 3.343 3.025 2.441 4.194 0.851 2 1 "[ + . 1 . 2]" 1
589 1 21 GLN HA 1 21 GLN HB2 2.598 . 3.442 2.882 2.380 3.026 . 0 0 "[ . 1 . 2]" 1
590 1 21 GLN HA 1 22 LYS H 2.244 . 2.873 2.434 2.104 2.918 0.045 19 0 "[ . 1 . 2]" 1
591 1 65 LYS H 1 65 LYS HA 2.540 . 3.346 2.920 2.890 2.951 . 0 0 "[ . 1 . 2]" 1
592 1 65 LYS HA 1 65 LYS QD 2.128 . 2.694 2.399 1.912 2.777 0.083 6 0 "[ . 1 . 2]" 1
593 1 65 LYS HA 1 65 LYS QG 2.424 . 3.159 2.718 2.395 2.957 . 0 0 "[ . 1 . 2]" 1
594 1 65 LYS HA 1 66 VAL MG2 2.765 . 3.720 3.480 3.317 3.664 . 0 0 "[ . 1 . 2]" 1
595 1 65 LYS HA 1 66 VAL H 2.125 . 2.689 2.275 2.161 2.386 . 0 0 "[ . 1 . 2]" 1
596 1 60 HIS HA 1 61 TYR H 2.343 . 3.029 2.139 2.080 2.212 . 0 0 "[ . 1 . 2]" 1
597 1 89 ASP HA 1 90 ILE H 2.818 . 3.811 3.395 3.304 3.439 . 0 0 "[ . 1 . 2]" 1
598 1 78 MET HA 1 107 TYR QD 2.599 . 3.444 3.096 2.336 3.513 0.069 11 0 "[ . 1 . 2]" 1
599 1 78 MET HA 1 78 MET QG 3.178 . 4.440 2.965 2.566 3.159 . 0 0 "[ . 1 . 2]" 1
600 1 78 MET HA 1 78 MET HB3 2.548 . 3.360 3.013 2.994 3.023 . 0 0 "[ . 1 . 2]" 1
601 1 78 MET HA 1 78 MET HB2 2.741 . 3.680 2.378 2.326 2.411 . 0 0 "[ . 1 . 2]" 1
602 1 103 ASP HA 1 104 GLY HA2 3.440 . 4.919 4.743 4.667 4.811 . 0 0 "[ . 1 . 2]" 1
603 1 102 VAL QG 1 103 ASP HA 2.972 . 4.076 4.027 3.874 4.111 0.035 20 0 "[ . 1 . 2]" 1
604 1 103 ASP HA 1 103 ASP QB 2.092 . 2.639 2.381 2.362 2.417 . 0 0 "[ . 1 . 2]" 1
605 1 101 LYS HA 1 106 TYR HA 2.555 . 3.371 2.147 2.008 2.329 . 0 0 "[ . 1 . 2]" 1
606 1 101 LYS HA 1 101 LYS HG2 2.694 . 3.602 3.150 2.964 3.258 . 0 0 "[ . 1 . 2]" 1
607 1 101 LYS HA 1 101 LYS HG3 2.634 . 3.501 2.572 2.461 2.714 . 0 0 "[ . 1 . 2]" 1
608 1 101 LYS HA 1 101 LYS HB3 2.605 . 3.453 3.027 3.023 3.030 . 0 0 "[ . 1 . 2]" 1
609 1 115 HIS HA 1 115 HIS QB 2.266 . 2.908 2.372 2.293 2.542 . 0 0 "[ . 1 . 2]" 1
610 1 89 ASP H 1 89 ASP HA 2.522 . 3.317 2.929 2.912 2.943 . 0 0 "[ . 1 . 2]" 1
611 1 117 ASP HA 1 118 ASN H 2.795 . 3.772 2.478 2.345 3.011 . 0 0 "[ . 1 . 2]" 1
612 1 117 ASP H 1 117 ASP HA 2.728 . 3.658 2.925 2.891 2.937 . 0 0 "[ . 1 . 2]" 1
613 1 117 ASP HA 1 117 ASP HB3 2.171 . 2.760 2.874 2.252 3.008 0.248 18 0 "[ . 1 . 2]" 1
614 1 116 ALA MB 1 117 ASP HA 3.131 . 4.356 4.108 3.971 4.322 . 0 0 "[ . 1 . 2]" 1
615 1 105 LYS HA 1 106 TYR H 2.082 . 2.624 2.332 2.214 2.487 . 0 0 "[ . 1 . 2]" 1
616 1 76 LEU H 1 76 LEU HA 2.329 . 3.007 2.924 2.904 2.943 . 0 0 "[ . 1 . 2]" 1
617 1 76 LEU HA 1 107 TYR HA 3.187 . 4.457 3.713 3.397 3.976 . 0 0 "[ . 1 . 2]" 1
618 1 105 LYS HA 1 105 LYS QG 2.796 . 3.773 2.375 2.289 2.498 . 0 0 "[ . 1 . 2]" 1
619 1 17 ASP H 1 17 ASP HA 2.567 . 3.391 2.870 2.657 2.951 . 0 0 "[ . 1 . 2]" 1
620 1 17 ASP HA 1 17 ASP QB 2.015 . 2.522 2.349 2.171 2.444 . 0 0 "[ . 1 . 2]" 1
621 1 113 ALA H 1 113 ALA HA 2.525 . 3.322 2.866 2.801 2.890 . 0 0 "[ . 1 . 2]" 1
622 1 112 ASP HA 1 113 ALA HA 3.407 . 4.858 4.497 4.402 4.622 . 0 0 "[ . 1 . 2]" 1
623 1 110 LEU HB3 1 113 ALA HA 2.681 . 3.580 3.118 2.864 3.642 0.062 14 0 "[ . 1 . 2]" 1
624 1 110 LEU QD 1 113 ALA HA 2.173 . 2.763 1.504 1.470 1.537 0.113 14 0 "[ . 1 . 2]" 1
625 1 113 ALA HA 1 114 ALA H 2.903 . 3.956 3.349 3.285 3.453 . 0 0 "[ . 1 . 2]" 1
626 1 113 ALA HA 1 116 ALA H 3.270 . 4.607 3.883 3.354 4.263 . 0 0 "[ . 1 . 2]" 1
627 1 92 ASN HA 1 93 GLU H 2.138 . 2.709 2.401 2.281 2.546 . 0 0 "[ . 1 . 2]" 1
628 1 92 ASN H 1 92 ASN HA 2.505 . 3.289 2.882 2.845 2.911 . 0 0 "[ . 1 . 2]" 1
629 1 92 ASN HA 1 92 ASN HD21 2.944 . 4.027 3.975 3.619 4.033 0.006 19 0 "[ . 1 . 2]" 1
630 1 92 ASN HA 1 92 ASN HD22 3.184 . 4.451 4.493 4.413 4.928 0.477 5 0 "[ . 1 . 2]" 1
631 1 92 ASN HA 1 92 ASN QB 2.088 . 2.633 2.344 2.152 2.377 . 0 0 "[ . 1 . 2]" 1
632 1 92 ASN HA 1 93 GLU QB 3.197 . 4.474 3.986 3.912 4.109 . 0 0 "[ . 1 . 2]" 1
633 1 65 LYS QD 1 92 ASN HA 3.284 . 4.632 4.423 3.741 4.691 0.059 5 0 "[ . 1 . 2]" 1
634 1 90 ILE MG 1 92 ASN HA 2.682 . 3.581 3.226 2.751 3.463 . 0 0 "[ . 1 . 2]" 1
635 1 86 LYS H 1 86 LYS HA 2.508 . 3.294 2.922 2.892 2.950 . 0 0 "[ . 1 . 2]" 1
636 1 86 LYS HA 1 87 ASP HA 3.201 . 4.482 4.324 4.247 4.400 . 0 0 "[ . 1 . 2]" 1
637 1 86 LYS HA 1 87 ASP HB2 3.302 . 4.665 4.527 4.357 4.716 0.051 14 0 "[ . 1 . 2]" 1
638 1 86 LYS HA 1 86 LYS HD3 2.199 . 2.803 2.577 1.501 2.870 0.094 16 0 "[ . 1 . 2]" 1
639 1 85 LEU HA 1 86 LYS HA 3.247 . 4.565 4.393 4.374 4.422 . 0 0 "[ . 1 . 2]" 1
640 1 57 ASP H 1 57 ASP HA 2.754 . 3.702 2.940 2.932 2.950 . 0 0 "[ . 1 . 2]" 1
641 1 57 ASP HA 1 129 LYS HA 2.854 . 3.872 3.504 3.006 3.922 0.050 17 0 "[ . 1 . 2]" 1
642 1 57 ASP HA 1 57 ASP QB 2.175 . 2.766 2.343 2.280 2.511 . 0 0 "[ . 1 . 2]" 1
643 1 57 ASP HA 1 129 LYS QD 2.652 . 3.531 3.353 2.928 3.563 0.032 18 0 "[ . 1 . 2]" 1
644 1 57 ASP HA 1 129 LYS QE 3.063 . 4.236 4.154 3.745 4.256 0.020 18 0 "[ . 1 . 2]" 1
645 1 57 ASP HA 1 129 LYS QB 3.461 . 4.958 2.392 2.138 2.687 . 0 0 "[ . 1 . 2]" 1
646 1 23 ALA MB 1 25 ASN HA 3.642 . 5.300 5.265 4.898 5.425 0.125 17 0 "[ . 1 . 2]" 1
647 1 26 LEU HA 1 26 LEU HB3 2.656 . 3.538 2.842 2.491 2.974 . 0 0 "[ . 1 . 2]" 1
648 1 113 ALA MB 1 114 ALA HA 2.831 . 3.833 3.875 3.772 3.911 0.078 14 0 "[ . 1 . 2]" 1
649 1 114 ALA HA 1 115 HIS H 2.769 . 3.728 3.531 3.302 3.589 . 0 0 "[ . 1 . 2]" 1
650 1 113 ALA HA 1 114 ALA HA 3.320 . 4.698 4.690 4.600 4.770 0.072 16 0 "[ . 1 . 2]" 1
651 1 63 ASN HA 1 64 GLY H 2.242 . 2.870 2.329 2.236 2.671 . 0 0 "[ . 1 . 2]" 1
652 1 25 ASN HA 1 26 LEU H 2.605 . 3.453 3.406 3.182 3.512 0.059 14 0 "[ . 1 . 2]" 1
653 1 25 ASN HA 1 25 ASN HB3 1.983 . 2.474 2.602 2.408 3.033 0.559 4 4 "[ +. 1 -**. 2]" 1
654 1 82 ASN HA 1 83 TYR H 3.358 . 4.767 3.409 3.237 3.537 . 0 0 "[ . 1 . 2]" 1
655 1 84 GLN H 1 84 GLN HA 2.519 . 3.312 2.922 2.872 2.948 . 0 0 "[ . 1 . 2]" 1
656 1 84 GLN HA 1 84 GLN HG3 2.321 . 2.995 2.938 2.620 3.093 0.098 19 0 "[ . 1 . 2]" 1
657 1 84 GLN HA 1 85 LEU QB 3.155 . 4.399 4.063 3.969 4.162 . 0 0 "[ . 1 . 2]" 1
658 1 84 GLN HA 1 85 LEU H 1.880 . 2.322 2.237 2.112 2.366 0.044 19 0 "[ . 1 . 2]" 1
659 1 84 GLN HA 1 84 GLN HB3 2.153 . 2.732 2.614 2.480 2.991 0.259 1 0 "[ . 1 . 2]" 1
660 1 84 GLN HA 1 84 GLN HB2 2.243 . 2.872 2.863 2.298 3.014 0.142 6 0 "[ . 1 . 2]" 1
661 1 63 ASN HA 1 63 ASN HB3 2.447 . 3.196 2.979 2.745 3.030 . 0 0 "[ . 1 . 2]" 1
662 1 63 ASN HA 1 63 ASN HB2 2.674 . 3.568 2.474 2.203 2.595 . 0 0 "[ . 1 . 2]" 1
663 1 38 ASN HA 1 39 ALA H 2.511 . 3.299 3.112 2.979 3.315 0.016 15 0 "[ . 1 . 2]" 1
664 1 38 ASN HA 1 38 ASN QB 2.310 . 2.858 2.385 2.163 2.460 . 0 0 "[ . 1 . 2]" 1
665 1 69 ASP HA 1 69 ASP HB2 2.092 . 2.639 2.450 2.376 2.539 . 0 0 "[ . 1 . 2]" 1
666 1 69 ASP HA 1 95 LYS HB2 2.954 . 4.045 2.857 2.541 3.267 . 0 0 "[ . 1 . 2]" 1
667 1 67 PRO HD2 1 70 ALA HA 3.270 . 4.607 4.484 4.154 4.639 0.032 15 0 "[ . 1 . 2]" 1
668 1 66 VAL MG1 1 70 ALA HA 3.041 . 4.197 4.293 4.247 4.333 0.136 17 0 "[ . 1 . 2]" 1
669 1 70 ALA HA 1 71 ILE H 1.947 . 2.421 2.291 2.169 2.455 0.034 4 0 "[ . 1 . 2]" 1
670 1 70 ALA HA 1 71 ILE HB 3.605 . 5.229 4.656 4.505 4.774 . 0 0 "[ . 1 . 2]" 1
671 1 55 HIS HA 1 55 HIS HB2 2.931 . 4.005 2.343 2.322 2.361 . 0 0 "[ . 1 . 2]" 1
672 1 39 ALA MB 1 55 HIS HA 2.905 . 3.960 3.730 3.501 3.938 . 0 0 "[ . 1 . 2]" 1
673 1 118 ASN HA 1 118 ASN QB 2.430 . 3.093 2.187 2.139 2.329 . 0 0 "[ . 1 . 2]" 1
674 1 118 ASN HA 1 119 ILE H 2.680 . 3.578 2.958 2.550 3.199 . 0 0 "[ . 1 . 2]" 1
675 1 71 ILE MD 1 118 ASN HA 2.582 . 3.415 2.431 2.228 2.669 . 0 0 "[ . 1 . 2]" 1
676 1 112 ASP HA 1 112 ASP HB3 2.301 . 2.963 2.986 2.584 3.031 0.068 7 0 "[ . 1 . 2]" 1
677 1 112 ASP HA 1 113 ALA H 2.122 . 2.685 2.292 2.140 2.518 . 0 0 "[ . 1 . 2]" 1
678 1 112 ASP HA 1 114 ALA H 3.142 . 4.376 3.196 3.052 3.506 . 0 0 "[ . 1 . 2]" 1
679 1 116 ALA HA 1 116 ALA MB 1.945 . 2.418 2.114 2.109 2.118 . 0 0 "[ . 1 . 2]" 1
680 1 110 LEU QD 1 116 ALA HA 3.092 . 4.287 2.857 2.361 3.243 . 0 0 "[ . 1 . 2]" 1
681 1 80 ASP HA 1 81 PRO HD3 2.110 . 2.666 2.282 2.156 2.409 . 0 0 "[ . 1 . 2]" 1
682 1 80 ASP HA 1 80 ASP HB3 2.640 . 3.511 2.869 2.385 3.028 . 0 0 "[ . 1 . 2]" 1
683 1 80 ASP HA 1 80 ASP HB2 2.484 . 3.255 2.647 2.488 3.008 . 0 0 "[ . 1 . 2]" 1
684 1 80 ASP HA 1 81 PRO HG2 3.082 . 4.269 4.388 4.238 4.513 0.244 6 0 "[ . 1 . 2]" 1
685 1 39 ALA HA 1 40 GLU H 2.065 . 2.598 2.368 2.294 2.439 . 0 0 "[ . 1 . 2]" 1
686 1 39 ALA HA 1 39 ALA MB 2.042 . 2.563 2.124 2.119 2.130 . 0 0 "[ . 1 . 2]" 1
687 1 67 PRO HD3 1 67 PRO HG2 2.321 . 2.994 2.958 2.948 2.968 . 0 0 "[ . 1 . 2]" 1
688 1 51 TYR QD 1 67 PRO HD3 3.750 . 5.508 5.084 4.329 5.496 . 0 0 "[ . 1 . 2]" 1
689 1 67 PRO HB3 1 67 PRO HD2 3.418 . 4.878 3.919 3.894 3.947 . 0 0 "[ . 1 . 2]" 1
690 1 67 PRO HD2 1 67 PRO HG3 2.323 . 2.998 2.743 2.722 2.761 . 0 0 "[ . 1 . 2]" 1
691 1 66 VAL MG1 1 67 PRO HD2 2.419 . 3.151 2.121 2.053 2.196 . 0 0 "[ . 1 . 2]" 1
692 1 23 ALA HA 1 24 GLU H 2.134 . 2.703 2.363 2.183 2.581 . 0 0 "[ . 1 . 2]" 1
693 1 23 ALA H 1 23 ALA HA 2.691 . 3.596 2.478 2.246 2.933 . 0 0 "[ . 1 . 2]" 1
694 1 23 ALA HA 1 61 TYR HB3 2.511 . 3.299 3.163 2.623 3.403 0.104 6 0 "[ . 1 . 2]" 1
695 1 23 ALA HA 1 24 GLU QG 3.398 . 4.841 3.782 3.371 4.090 . 0 0 "[ . 1 . 2]" 1
696 1 23 ALA HA 1 24 GLU HB2 3.479 . 4.992 4.962 4.638 5.747 0.755 19 3 "[ . *1 - . +2]" 1
697 1 120 ARG HA 1 120 ARG HB2 2.578 . 3.409 2.988 2.537 3.035 . 0 0 "[ . 1 . 2]" 1
698 1 120 ARG HA 1 120 ARG QG 2.667 . 3.556 2.921 2.495 3.276 . 0 0 "[ . 1 . 2]" 1
699 1 119 ILE MG 1 120 ARG HA 3.318 . 4.694 3.650 3.161 3.809 . 0 0 "[ . 1 . 2]" 1
700 1 80 ASP H 1 81 PRO HD2 3.670 . 5.354 4.816 4.516 4.979 . 0 0 "[ . 1 . 2]" 1
701 1 80 ASP HA 1 81 PRO HD2 2.657 . 3.539 2.241 2.037 2.391 . 0 0 "[ . 1 . 2]" 1
702 1 80 ASP HB3 1 81 PRO HD2 3.367 . 4.784 3.662 2.311 4.390 . 0 0 "[ . 1 . 2]" 1
703 1 81 PRO HB2 1 81 PRO HD2 2.860 . 3.882 4.020 3.849 4.050 0.168 3 0 "[ . 1 . 2]" 1
704 1 81 PRO HD2 1 81 PRO HG2 2.375 . 3.080 2.297 2.259 2.312 . 0 0 "[ . 1 . 2]" 1
705 1 80 ASP HB3 1 81 PRO HD3 3.432 . 4.905 4.609 3.708 4.911 0.006 8 0 "[ . 1 . 2]" 1
706 1 80 ASP H 1 81 PRO HD3 3.506 . 5.042 4.718 4.230 4.871 . 0 0 "[ . 1 . 2]" 1
707 1 80 ASP HB2 1 81 PRO HD3 3.423 . 4.888 4.755 4.513 4.917 0.029 12 0 "[ . 1 . 2]" 1
708 1 81 PRO HB2 1 81 PRO HD3 3.039 . 4.193 3.932 3.887 4.062 . 0 0 "[ . 1 . 2]" 1
709 1 81 PRO HD3 1 81 PRO HG2 2.304 . 2.968 2.972 2.902 2.984 0.016 3 0 "[ . 1 . 2]" 1
710 1 28 PRO HB3 1 28 PRO HD3 3.751 . 5.510 3.046 2.927 3.210 . 0 0 "[ . 1 . 2]" 1
711 1 28 PRO HD2 1 28 PRO HG2 2.441 . 3.186 2.307 2.278 2.332 . 0 0 "[ . 1 . 2]" 1
712 1 28 PRO HD2 1 28 PRO HG3 2.669 . 3.559 2.688 2.654 2.733 . 0 0 "[ . 1 . 2]" 1
713 1 28 PRO HA 1 28 PRO HD2 3.654 . 5.323 4.036 3.984 4.071 . 0 0 "[ . 1 . 2]" 1
714 1 28 PRO HD3 1 29 ASP H 3.067 . 4.243 4.190 4.025 4.317 0.074 8 0 "[ . 1 . 2]" 1
715 1 28 PRO HD3 1 28 PRO HG3 2.604 . 3.452 2.313 2.287 2.336 . 0 0 "[ . 1 . 2]" 1
716 1 28 PRO HD3 1 28 PRO HG2 2.531 . 3.332 2.986 2.962 3.001 . 0 0 "[ . 1 . 2]" 1
717 1 27 THR MG 1 28 PRO HD3 3.018 . 4.156 3.966 3.609 4.246 0.090 10 0 "[ . 1 . 2]" 1
718 1 50 GLY QA 1 51 TYR QD 3.426 . 4.893 3.775 3.601 3.928 . 0 0 "[ . 1 . 2]" 1
719 1 49 GLN H 1 50 GLY QA 3.750 . 5.508 4.379 4.205 4.486 . 0 0 "[ . 1 . 2]" 1
720 1 36 GLY HA2 1 37 ILE H 3.259 . 4.587 3.551 3.351 3.602 . 0 0 "[ . 1 . 2]" 1
721 1 97 GLY HA3 1 111 LYS H 3.197 . 4.475 4.191 4.017 4.480 0.005 14 0 "[ . 1 . 2]" 1
722 1 97 GLY HA3 1 110 LEU QD 2.745 . 3.687 2.297 2.011 2.637 . 0 0 "[ . 1 . 2]" 1
723 1 97 GLY HA2 1 98 TYR HD1 3.144 . 4.379 3.368 3.266 3.426 . 0 0 "[ . 1 . 2]" 1
724 1 97 GLY HA2 1 111 LYS QG 2.945 . 4.029 3.300 2.992 3.670 . 0 0 "[ . 1 . 2]" 1
725 1 97 GLY HA2 1 110 LEU HA 2.386 . 3.097 2.243 1.990 2.436 . 0 0 "[ . 1 . 2]" 1
726 1 97 GLY HA2 1 110 LEU QD 2.702 . 3.615 2.585 2.344 2.759 . 0 0 "[ . 1 . 2]" 1
727 1 94 ILE MD 1 97 GLY HA2 3.472 . 4.979 4.652 4.423 4.907 . 0 0 "[ . 1 . 2]" 1
728 1 56 GLY HA2 1 129 LYS HA 3.271 . 4.608 4.059 3.840 4.328 . 0 0 "[ . 1 . 2]" 1
729 1 37 ILE MD 1 56 GLY HA2 3.185 . 4.453 2.959 2.665 3.253 . 0 0 "[ . 1 . 2]" 1
730 1 39 ALA MB 1 56 GLY HA2 2.920 . 3.986 2.041 1.851 2.227 0.003 9 0 "[ . 1 . 2]" 1
731 1 39 ALA MB 1 56 GLY HA3 2.900 . 3.952 2.835 2.699 3.009 . 0 0 "[ . 1 . 2]" 1
732 1 56 GLY HA3 1 129 LYS HA 3.544 . 5.114 5.067 4.973 5.242 0.128 10 0 "[ . 1 . 2]" 1
733 1 101 LYS HG3 1 104 GLY HA3 3.565 . 5.154 5.179 4.929 5.439 0.285 7 0 "[ . 1 . 2]" 1
734 1 96 GLY HA3 1 110 LEU HA 3.781 . 5.568 4.947 4.656 5.162 . 0 0 "[ . 1 . 2]" 1
735 1 16 GLY HA2 1 17 ASP QB 3.746 . 5.500 4.959 4.259 5.502 0.002 4 0 "[ . 1 . 2]" 1
736 1 96 GLY HA2 1 110 LEU QD 3.005 . 4.134 4.276 3.703 4.675 0.541 5 3 "[ + 1 .* -]" 1
737 1 95 LYS HA 1 96 GLY HA2 3.042 . 4.199 4.301 4.280 4.314 0.115 1 0 "[ . 1 . 2]" 1
738 1 96 GLY HA2 1 111 LYS HB2 3.474 . 4.982 3.587 3.173 4.082 . 0 0 "[ . 1 . 2]" 1
739 1 104 GLY H 1 104 GLY HA2 2.237 . 2.863 2.337 2.314 2.369 . 0 0 "[ . 1 . 2]" 1
740 1 101 LYS HE2 1 104 GLY HA2 2.794 . 3.770 2.510 1.852 2.768 . 0 0 "[ . 1 . 2]" 1
741 1 101 LYS HE3 1 104 GLY HA2 3.016 . 4.153 3.094 2.799 3.302 . 0 0 "[ . 1 . 2]" 1
742 1 101 LYS HG2 1 104 GLY HA2 3.324 . 4.705 3.380 3.087 3.621 . 0 0 "[ . 1 . 2]" 1
743 1 101 LYS HG3 1 104 GLY HA2 3.062 . 4.234 3.864 3.683 4.121 . 0 0 "[ . 1 . 2]" 1
744 1 26 LEU HB3 1 27 THR H 2.656 . 3.538 3.212 2.688 3.715 0.177 14 0 "[ . 1 . 2]" 1
745 1 26 LEU HB3 1 30 GLU HB2 2.960 . 4.055 3.502 2.743 4.557 0.502 14 1 "[ . 1 +. 2]" 1
746 1 64 GLY H 1 64 GLY HA3 2.616 . 3.471 2.928 2.868 2.954 . 0 0 "[ . 1 . 2]" 1
747 1 64 GLY HA3 1 65 LYS H 2.208 . 2.818 2.279 2.154 2.430 . 0 0 "[ . 1 . 2]" 1
748 1 63 ASN HB3 1 64 GLY HA3 3.396 . 4.838 4.642 4.187 5.368 0.530 6 2 "[ .+ 1 - . 2]" 1
749 1 63 ASN HB3 1 64 GLY HA2 3.484 . 5.001 5.001 4.535 5.840 0.839 12 4 "[ .* 1 +- . * 2]" 1
750 1 64 GLY H 1 64 GLY HA2 2.516 . 3.308 2.403 2.307 2.595 . 0 0 "[ . 1 . 2]" 1
751 1 64 GLY HA2 1 65 LYS H 2.276 . 2.923 2.858 2.718 3.016 0.093 9 0 "[ . 1 . 2]" 1
752 1 63 ASN HA 1 64 GLY HA2 3.563 . 5.150 4.563 4.446 4.755 . 0 0 "[ . 1 . 2]" 1
753 1 98 TYR HB3 1 99 VAL H 2.774 . 3.736 3.534 3.308 3.591 . 0 0 "[ . 1 . 2]" 1
754 1 98 TYR HB3 1 100 ILE MG 2.344 . 3.031 1.853 1.747 2.097 . 0 0 "[ . 1 . 2]" 1
755 1 85 LEU QD 1 98 TYR HB3 3.281 . 4.626 2.448 2.284 2.613 . 0 0 "[ . 1 . 2]" 1
756 1 90 ILE HG12 1 98 TYR HB3 3.077 . 4.261 2.920 2.580 3.077 . 0 0 "[ . 1 . 2]" 1
757 1 107 TYR HB3 1 107 TYR QD 2.677 . 3.573 2.358 2.321 2.380 . 0 0 "[ . 1 . 2]" 1
758 1 90 ILE HG12 1 98 TYR HB2 3.005 . 4.134 3.971 3.601 4.150 0.016 15 0 "[ . 1 . 2]" 1
759 1 98 TYR HB2 1 98 TYR HD1 2.678 . 3.574 2.654 2.596 2.754 . 0 0 "[ . 1 . 2]" 1
760 1 98 TYR HB2 1 109 TYR QB 3.185 . 4.453 1.951 1.681 3.131 0.236 20 0 "[ . 1 . 2]" 1
761 1 98 TYR HB2 1 100 ILE MG 2.409 . 3.134 2.735 2.667 2.822 . 0 0 "[ . 1 . 2]" 1
762 1 78 MET HB2 1 107 TYR HB2 2.984 . 4.097 2.670 2.252 2.956 . 0 0 "[ . 1 . 2]" 1
763 1 34 ARG H 1 34 ARG QD 3.413 . 4.869 3.906 2.336 4.316 . 0 0 "[ . 1 . 2]" 1
764 1 34 ARG HA 1 34 ARG QD 3.317 . 4.692 3.969 2.224 4.399 . 0 0 "[ . 1 . 2]" 1
765 1 34 ARG QD 1 34 ARG HG2 2.235 . 2.859 2.312 2.178 2.387 . 0 0 "[ . 1 . 2]" 1
766 1 124 GLU HA 1 127 ARG HD3 3.700 . 5.411 3.643 2.402 5.120 . 0 0 "[ . 1 . 2]" 1
767 1 127 ARG H 1 127 ARG HD2 3.632 . 5.281 4.527 3.854 5.083 . 0 0 "[ . 1 . 2]" 1
768 1 34 ARG QB 1 34 ARG QD 2.314 . 2.983 2.270 2.103 2.462 . 0 0 "[ . 1 . 2]" 1
769 1 75 GLU H 1 76 LEU HB2 3.412 . 4.868 4.761 4.585 4.910 0.042 15 0 "[ . 1 . 2]" 1
770 1 76 LEU HB2 1 76 LEU MD2 2.295 . 2.953 3.177 3.172 3.181 0.228 13 0 "[ . 1 . 2]" 1
771 1 76 LEU HB3 1 108 VAL H 3.263 . 4.594 3.576 2.849 4.225 . 0 0 "[ . 1 . 2]" 1
772 1 76 LEU H 1 76 LEU HB3 2.738 . 3.675 3.638 3.602 3.689 0.014 9 0 "[ . 1 . 2]" 1
773 1 110 LEU HB2 1 113 ALA HA 2.973 . 4.078 4.180 4.103 4.373 0.295 14 0 "[ . 1 . 2]" 1
774 1 110 LEU HB2 1 110 LEU QD 2.327 . 3.004 2.137 2.119 2.158 . 0 0 "[ . 1 . 2]" 1
775 1 110 LEU HB2 1 112 ASP H 3.282 . 4.629 4.594 4.466 4.693 0.064 5 0 "[ . 1 . 2]" 1
776 1 127 ARG HA 1 127 ARG HD3 3.235 . 4.543 4.447 3.556 4.702 0.159 14 0 "[ . 1 . 2]" 1
777 1 127 ARG HD3 1 127 ARG HG2 2.433 . 3.173 2.429 2.350 2.510 . 0 0 "[ . 1 . 2]" 1
778 1 127 ARG QB 1 127 ARG HD3 2.540 . 3.346 2.426 2.246 3.231 . 0 0 "[ . 1 . 2]" 1
779 1 127 ARG HA 1 127 ARG HD2 3.221 . 4.518 4.506 4.302 4.662 0.144 7 0 "[ . 1 . 2]" 1
780 1 127 ARG HD2 1 127 ARG HG2 2.478 . 3.245 2.979 2.420 3.015 . 0 0 "[ . 1 . 2]" 1
781 1 76 LEU HB2 1 77 LEU H 3.405 . 4.854 3.460 2.984 3.756 . 0 0 "[ . 1 . 2]" 1
782 1 65 LYS HA 1 65 LYS QE 2.915 . 3.977 3.649 1.403 4.244 0.450 6 0 "[ . 1 . 2]" 1
783 1 65 LYS QD 1 65 LYS QE 1.829 . 2.247 1.991 1.925 2.060 . 0 0 "[ . 1 . 2]" 1
784 1 65 LYS QE 1 65 LYS QG 2.235 . 2.859 2.413 2.119 2.719 . 0 0 "[ . 1 . 2]" 1
785 1 65 LYS QE 1 91 VAL QG 2.043 . 2.565 2.148 1.685 2.615 0.050 15 0 "[ . 1 . 2]" 1
786 1 74 GLU HA 1 77 LEU HB2 3.002 . 4.128 3.918 3.333 4.798 0.670 8 2 "[ . + 1 . - 2]" 1
787 1 77 LEU HB2 1 77 LEU QD 2.287 . 2.941 2.292 2.080 2.578 . 0 0 "[ . 1 . 2]" 1
788 1 94 ILE HB 1 94 ILE MD 2.050 . 2.575 2.515 2.492 2.554 . 0 0 "[ . 1 . 2]" 1
789 1 94 ILE HB 1 94 ILE HG12 2.458 . 3.213 3.020 3.015 3.025 . 0 0 "[ . 1 . 2]" 1
790 1 90 ILE HA 1 100 ILE HB 3.524 . 5.077 3.273 2.933 3.731 . 0 0 "[ . 1 . 2]" 1
791 1 100 ILE HB 1 100 ILE QG 3.024 . 4.167 2.365 2.331 2.390 . 0 0 "[ . 1 . 2]" 1
792 1 77 LEU H 1 77 LEU HB3 2.561 . 3.381 3.265 2.469 3.548 0.167 6 0 "[ . 1 . 2]" 1
793 1 74 GLU HA 1 77 LEU HB3 3.667 . 5.348 4.425 3.238 4.966 . 0 0 "[ . 1 . 2]" 1
794 1 77 LEU HB3 1 78 MET HB3 3.773 . 5.553 5.342 4.556 6.339 0.786 16 5 "[** . - 1 .+ * 2]" 1
795 1 105 LYS HE2 1 105 LYS QG 2.251 . 2.884 2.782 2.422 3.495 0.611 13 2 "[ . 1 + - 2]" 1
796 1 52 VAL QG 1 59 TYR HB2 2.893 . 3.939 3.632 3.434 3.922 . 0 0 "[ . 1 . 2]" 1
797 1 94 ILE H 1 94 ILE HB 3.300 . 4.661 3.780 3.710 3.814 . 0 0 "[ . 1 . 2]" 1
798 1 80 ASP HB3 1 83 TYR H 2.979 . 4.088 2.738 2.002 4.140 0.052 10 0 "[ . 1 . 2]" 1
799 1 100 ILE MD 1 109 TYR QB 2.722 . 3.377 1.960 1.725 2.260 0.071 2 0 "[ . 1 . 2]" 1
800 1 22 LYS HE2 1 22 LYS QG 2.155 . 2.736 2.747 2.289 3.481 0.745 3 5 "[ + . * ** - 2]" 1
801 1 95 LYS QE 1 95 LYS HG3 2.658 . 3.541 2.626 2.312 3.425 . 0 0 "[ . 1 . 2]" 1
802 1 126 LYS HA 1 129 LYS QE 2.672 . 3.565 2.280 1.741 3.570 0.038 9 0 "[ . 1 . 2]" 1
803 1 129 LYS QB 1 129 LYS QE 2.209 . 2.819 1.954 1.862 2.228 . 0 0 "[ . 1 . 2]" 1
804 1 125 ILE MG 1 129 LYS QE 2.227 . 2.847 2.361 1.902 3.261 0.414 14 0 "[ . 1 . 2]" 1
805 1 129 LYS QE 1 129 LYS HG2 2.220 . 2.836 2.585 2.434 3.331 0.495 14 0 "[ . 1 . 2]" 1
806 1 98 TYR H 1 109 TYR QB 3.468 . 4.500 2.584 2.155 3.459 . 0 0 "[ . 1 . 2]" 1
807 1 109 TYR H 1 109 TYR QB 2.785 . 3.333 2.186 2.127 2.321 . 0 0 "[ . 1 . 2]" 1
808 1 101 LYS HE2 1 104 GLY HA3 3.184 . 4.451 4.204 3.583 4.482 0.031 10 0 "[ . 1 . 2]" 1
809 1 80 ASP HB2 1 81 PRO HD2 3.392 . 4.830 3.959 3.812 4.170 . 0 0 "[ . 1 . 2]" 1
810 1 80 ASP HB2 1 83 TYR H 3.522 . 5.073 3.797 2.831 4.457 . 0 0 "[ . 1 . 2]" 1
811 1 101 LYS HE3 1 104 GLY HA3 3.390 . 4.826 4.464 4.155 4.690 . 0 0 "[ . 1 . 2]" 1
812 1 46 ILE HB 1 106 TYR HB2 2.558 . 3.376 2.533 2.241 2.767 . 0 0 "[ . 1 . 2]" 1
813 1 46 ILE MG 1 106 TYR HB2 3.227 . 4.529 3.483 3.206 3.768 . 0 0 "[ . 1 . 2]" 1
814 1 106 TYR HB3 1 106 TYR QD 2.584 . 3.419 2.446 2.406 2.622 . 0 0 "[ . 1 . 2]" 1
815 1 46 ILE HB 1 106 TYR HB3 2.670 . 3.561 1.913 1.755 2.214 0.024 8 0 "[ . 1 . 2]" 1
816 1 101 LYS HE3 1 104 GLY H 3.310 . 4.679 4.732 4.622 4.785 0.106 2 0 "[ . 1 . 2]" 1
817 1 72 ILE HB 1 73 SER H 3.424 . 4.889 3.773 3.537 3.888 . 0 0 "[ . 1 . 2]" 1
818 1 85 LEU QB 1 86 LYS H 3.565 . 4.782 3.861 3.692 3.927 . 0 0 "[ . 1 . 2]" 1
819 1 85 LEU QB 1 85 LEU HG 2.558 . 3.376 2.409 2.376 2.444 . 0 0 "[ . 1 . 2]" 1
820 1 83 TYR QE 1 85 LEU QB 3.622 . 4.282 3.995 3.593 4.153 . 0 0 "[ . 1 . 2]" 1
821 1 46 ILE HB 1 47 THR H 3.734 . 5.477 3.748 3.511 4.034 . 0 0 "[ . 1 . 2]" 1
822 1 85 LEU QB 1 85 LEU QD 2.308 . 2.545 1.908 1.889 1.941 . 0 0 "[ . 1 . 2]" 1
823 1 15 ASP H 1 15 ASP QB 2.880 . 3.916 2.695 2.226 3.096 . 0 0 "[ . 1 . 2]" 1
824 1 72 ILE H 1 72 ILE HB 2.360 . 3.056 2.656 2.605 2.715 . 0 0 "[ . 1 . 2]" 1
825 1 72 ILE HB 1 120 ARG H 3.655 . 5.325 4.676 4.387 5.112 . 0 0 "[ . 1 . 2]" 1
826 1 72 ILE HB 1 119 ILE HA 2.850 . 3.865 3.352 3.164 3.665 . 0 0 "[ . 1 . 2]" 1
827 1 72 ILE HA 1 72 ILE HB 2.759 . 3.710 3.021 3.017 3.028 . 0 0 "[ . 1 . 2]" 1
828 1 72 ILE HB 1 72 ILE HG12 2.540 . 3.347 2.512 2.475 2.532 . 0 0 "[ . 1 . 2]" 1
829 1 46 ILE HB 1 106 TYR H 3.557 . 5.138 4.574 4.227 5.063 . 0 0 "[ . 1 . 2]" 1
830 1 46 ILE HB 1 46 ILE HG12 2.579 . 3.410 3.023 3.016 3.027 . 0 0 "[ . 1 . 2]" 1
831 1 46 ILE HB 1 76 LEU MD2 3.035 . 4.186 3.772 3.295 4.064 . 0 0 "[ . 1 . 2]" 1
832 1 89 ASP HB3 1 90 ILE H 3.416 . 4.874 3.983 3.817 4.177 . 0 0 "[ . 1 . 2]" 1
833 1 89 ASP H 1 89 ASP HB3 2.705 . 3.619 3.563 3.030 3.688 0.069 1 0 "[ . 1 . 2]" 1
834 1 89 ASP HB3 1 101 LYS H 3.708 . 5.427 3.426 2.958 4.577 . 0 0 "[ . 1 . 2]" 1
835 1 89 ASP HB3 1 100 ILE HB 2.841 . 3.850 3.080 2.664 3.901 0.051 13 0 "[ . 1 . 2]" 1
836 1 89 ASP HB2 1 100 ILE HB 2.838 . 3.845 3.288 2.133 3.813 . 0 0 "[ . 1 . 2]" 1
837 1 17 ASP H 1 17 ASP QB . . 3.183 2.387 2.225 2.617 . 0 0 "[ . 1 . 2]" 1
838 1 15 ASP HA 1 15 ASP QB 2.592 . 3.432 2.339 2.182 2.421 . 0 0 "[ . 1 . 2]" 1
839 1 44 ILE HB 1 45 LYS H 3.418 . 4.879 3.836 3.664 3.891 . 0 0 "[ . 1 . 2]" 1
840 1 44 ILE HB 1 45 LYS HB2 3.634 . 5.285 4.362 4.138 4.583 . 0 0 "[ . 1 . 2]" 1
841 1 44 ILE H 1 44 ILE HB 3.181 . 4.446 3.641 3.615 3.664 . 0 0 "[ . 1 . 2]" 1
842 1 44 ILE HA 1 44 ILE HB 2.949 . 4.036 2.525 2.498 2.560 . 0 0 "[ . 1 . 2]" 1
843 1 89 ASP HB3 1 100 ILE MG 3.418 . 4.878 4.221 3.968 4.732 . 0 0 "[ . 1 . 2]" 1
844 1 29 ASP H 1 29 ASP HB2 2.024 . 2.536 2.518 2.387 2.717 0.181 7 0 "[ . 1 . 2]" 1
845 1 24 GLU QG 1 62 TYR QB 2.483 . 3.254 2.873 1.978 3.236 . 0 0 "[ . 1 . 2]" 1
846 1 24 GLU QB 1 62 TYR QB 3.064 . 4.237 2.987 1.715 4.370 0.176 8 0 "[ . 1 . 2]" 1
847 1 92 ASN QB 1 92 ASN HD21 2.693 . 3.354 2.164 2.118 2.186 . 0 0 "[ . 1 . 2]" 1
848 1 92 ASN QB 1 92 ASN HD22 3.085 . 3.977 3.263 3.235 3.273 . 0 0 "[ . 1 . 2]" 1
849 1 65 LYS QD 1 92 ASN QB 2.718 . 3.642 2.301 1.842 2.770 . 0 0 "[ . 1 . 2]" 1
850 1 91 VAL QG 1 92 ASN QB 3.182 . 4.448 2.985 2.754 3.150 . 0 0 "[ . 1 . 2]" 1
851 1 92 ASN H 1 92 ASN QB 3.474 . 4.983 2.812 2.705 3.224 . 0 0 "[ . 1 . 2]" 1
852 1 92 ASN QB 1 94 ILE MG 3.255 . 4.579 3.933 3.720 4.408 . 0 0 "[ . 1 . 2]" 1
853 1 63 ASN H 1 63 ASN HB3 2.483 . 3.254 2.616 2.269 2.904 . 0 0 "[ . 1 . 2]" 1
854 1 62 TYR HA 1 63 ASN HB3 3.540 . 5.107 4.572 3.770 4.891 . 0 0 "[ . 1 . 2]" 1
855 1 42 ILE HB 1 54 SER H 3.513 . 5.055 3.036 2.765 3.272 . 0 0 "[ . 1 . 2]" 1
856 1 69 ASP H 1 69 ASP HB3 2.639 . 3.510 2.810 2.532 3.045 . 0 0 "[ . 1 . 2]" 1
857 1 69 ASP HA 1 69 ASP HB3 2.754 . 3.702 2.533 2.361 3.014 . 0 0 "[ . 1 . 2]" 1
858 1 52 VAL QG 1 61 TYR HB2 3.011 . 4.144 2.767 1.850 3.327 0.028 8 0 "[ . 1 . 2]" 1
859 1 61 TYR H 1 61 TYR HB3 3.254 . 4.578 2.732 2.491 2.903 . 0 0 "[ . 1 . 2]" 1
860 1 103 ASP QB 1 104 GLY H 3.082 . 4.269 3.796 3.732 3.874 . 0 0 "[ . 1 . 2]" 1
861 1 86 LYS HD2 1 87 ASP HB2 3.587 . 5.195 4.764 3.990 5.599 0.404 3 0 "[ . 1 . 2]" 1
862 1 42 ILE HB 1 44 ILE MG 3.328 . 4.713 3.400 3.137 3.740 . 0 0 "[ . 1 . 2]" 1
863 1 42 ILE HB 1 42 ILE MD 2.384 . 3.094 2.391 2.338 2.425 . 0 0 "[ . 1 . 2]" 1
864 1 42 ILE HB 1 42 ILE MG 2.230 . 2.852 2.131 2.128 2.134 . 0 0 "[ . 1 . 2]" 1
865 1 42 ILE HB 1 54 SER HB2 3.183 . 4.449 4.439 2.685 4.806 0.357 3 0 "[ . 1 . 2]" 1
866 1 46 ILE HA 1 51 TYR HB2 2.726 . 3.655 3.251 2.526 3.793 0.138 1 0 "[ . 1 . 2]" 1
867 1 51 TYR HA 1 51 TYR HB2 2.693 . 3.599 2.647 2.437 2.918 . 0 0 "[ . 1 . 2]" 1
868 1 51 TYR HB3 1 51 TYR QD 2.749 . 3.693 2.349 2.169 2.561 . 0 0 "[ . 1 . 2]" 1
869 1 46 ILE HG12 1 51 TYR HB3 3.508 . 5.046 3.370 3.095 3.630 . 0 0 "[ . 1 . 2]" 1
870 1 43 VAL MG1 1 51 TYR HB3 2.940 . 4.021 2.518 2.225 2.873 . 0 0 "[ . 1 . 2]" 1
871 1 103 ASP H 1 103 ASP QB 3.057 . 4.225 2.896 2.856 2.941 . 0 0 "[ . 1 . 2]" 1
872 1 102 VAL QG 1 103 ASP QB . . 2.491 2.292 2.103 2.376 . 0 0 "[ . 1 . 2]" 1
873 1 37 ILE HB 1 39 ALA H 3.514 . 5.057 2.607 2.448 3.924 . 0 0 "[ . 1 . 2]" 1
874 1 37 ILE HB 1 37 ILE HG12 2.617 . 3.473 3.008 2.708 3.027 . 0 0 "[ . 1 . 2]" 1
875 1 25 ASN HA 1 25 ASN HB2 2.569 . 3.394 2.618 2.374 3.036 . 0 0 "[ . 1 . 2]" 1
876 1 90 ILE HB 1 91 VAL H 3.417 . 4.877 4.361 4.208 4.422 . 0 0 "[ . 1 . 2]" 1
877 1 90 ILE H 1 90 ILE HB 2.228 . 2.848 2.468 2.383 2.550 . 0 0 "[ . 1 . 2]" 1
878 1 90 ILE HA 1 90 ILE HB 2.830 . 3.831 3.019 3.014 3.022 . 0 0 "[ . 1 . 2]" 1
879 1 90 ILE HB 1 90 ILE HG13 2.526 . 3.324 2.547 2.533 2.566 . 0 0 "[ . 1 . 2]" 1
880 1 89 ASP H 1 90 ILE HB 3.104 . 4.308 4.302 4.105 4.389 0.081 10 0 "[ . 1 . 2]" 1
881 1 80 ASP HB2 1 83 TYR QB 3.102 . 4.304 3.114 2.505 5.111 0.807 12 1 "[ . 1 + . 2]" 1
882 1 78 MET QG 1 83 TYR QB 3.381 . 4.810 3.225 2.858 3.895 . 0 0 "[ . 1 . 2]" 1
883 1 122 LYS HA 1 125 ILE HB 2.437 . 3.179 2.608 2.416 2.871 . 0 0 "[ . 1 . 2]" 1
884 1 125 ILE HB 1 125 ILE MG 2.039 . 2.559 2.131 2.128 2.144 . 0 0 "[ . 1 . 2]" 1
885 1 14 ILE HB 1 19 ALA MB 3.019 . 4.158 3.817 1.841 4.373 0.215 9 0 "[ . 1 . 2]" 1
886 1 14 ILE HB 1 15 ASP H 4.198 . 6.401 3.641 2.049 4.488 . 0 0 "[ . 1 . 2]" 1
887 1 125 ILE HA 1 125 ILE HB 2.928 . 4.000 3.023 3.014 3.030 . 0 0 "[ . 1 . 2]" 1
888 1 119 ILE HB 1 120 ARG H 3.043 . 4.200 4.239 4.202 4.277 0.077 12 0 "[ . 1 . 2]" 1
889 1 119 ILE H 1 119 ILE HB 2.265 . 2.906 2.602 2.538 2.765 . 0 0 "[ . 1 . 2]" 1
890 1 74 GLU HB2 1 119 ILE HB 3.624 . 5.266 5.439 5.284 6.062 0.796 16 1 "[ . 1 .+ 2]" 1
891 1 119 ILE HB 1 119 ILE HG12 2.044 . 2.566 2.430 2.403 2.468 . 0 0 "[ . 1 . 2]" 1
892 1 75 GLU H 1 75 GLU QG 2.650 . 3.452 2.285 1.860 2.672 . 0 0 "[ . 1 . 2]" 1
893 1 75 GLU QG 1 76 LEU H 3.517 . 5.063 4.211 3.944 4.428 . 0 0 "[ . 1 . 2]" 1
894 1 75 GLU HA 1 75 GLU QG 2.530 . 3.320 2.413 2.247 2.580 . 0 0 "[ . 1 . 2]" 1
895 1 75 GLU HB2 1 75 GLU QG 2.229 . 2.799 2.315 2.136 2.390 . 0 0 "[ . 1 . 2]" 1
896 1 75 GLU QG 1 122 LYS QG 3.173 . 4.059 2.103 1.770 2.323 0.144 4 0 "[ . 1 . 2]" 1
897 1 75 GLU QG 1 122 LYS HD2 2.972 . 3.163 2.847 1.753 3.923 0.760 2 3 "[ + . * 1 - . 2]" 1
898 1 75 GLU QG 1 122 LYS HB2 3.190 . 4.462 4.267 3.891 4.441 . 0 0 "[ . 1 . 2]" 1
899 1 93 GLU HG3 1 94 ILE H 3.056 . 4.223 3.053 2.750 4.057 . 0 0 "[ . 1 . 2]" 1
900 1 93 GLU HG3 1 98 TYR HE1 3.064 . 4.237 2.967 2.829 3.569 . 0 0 "[ . 1 . 2]" 1
901 1 93 GLU QB 1 93 GLU HG3 2.123 . 2.687 2.286 2.150 2.361 . 0 0 "[ . 1 . 2]" 1
902 1 93 GLU H 1 93 GLU HG2 3.004 . 4.132 4.175 3.724 4.239 0.107 11 0 "[ . 1 . 2]" 1
903 1 93 GLU HG2 1 94 ILE HA 2.667 . 3.556 3.467 3.297 3.637 0.081 13 0 "[ . 1 . 2]" 1
904 1 40 GLU QG 1 41 GLN H 3.437 . 4.914 4.284 4.003 4.512 . 0 0 "[ . 1 . 2]" 1
905 1 40 GLU H 1 40 GLU QG 2.848 . 3.862 2.477 2.101 3.310 . 0 0 "[ . 1 . 2]" 1
906 1 40 GLU QG 1 128 GLN QE 3.425 . 4.891 4.003 2.892 4.771 . 0 0 "[ . 1 . 2]" 1
907 1 40 GLU HA 1 40 GLU QG 2.643 . 3.517 2.763 2.401 3.468 . 0 0 "[ . 1 . 2]" 1
908 1 93 GLU HG2 1 98 TYR HE1 3.092 . 4.287 4.533 4.437 4.642 0.355 20 0 "[ . 1 . 2]" 1
909 1 27 THR H 1 30 GLU QG 2.850 . 3.866 3.071 2.616 3.375 . 0 0 "[ . 1 . 2]" 1
910 1 30 GLU H 1 30 GLU QG 2.729 . 3.556 2.682 1.944 3.385 . 0 0 "[ . 1 . 2]" 1
911 1 30 GLU HA 1 30 GLU QG 2.496 . 3.118 2.722 2.440 2.996 . 0 0 "[ . 1 . 2]" 1
912 1 30 GLU HB3 1 30 GLU QG 2.303 . 2.779 2.262 2.140 2.399 . 0 0 "[ . 1 . 2]" 1
913 1 26 LEU HG 1 30 GLU QG 2.979 . 4.088 2.959 2.523 3.574 . 0 0 "[ . 1 . 2]" 1
914 1 26 LEU QD 1 30 GLU QG 2.907 . 3.963 3.029 2.812 3.297 . 0 0 "[ . 1 . 2]" 1
915 1 71 ILE HB 1 72 ILE H 3.622 . 5.262 3.926 3.840 4.048 . 0 0 "[ . 1 . 2]" 1
916 1 43 VAL H 1 71 ILE HB 3.367 . 4.784 3.948 3.700 4.136 . 0 0 "[ . 1 . 2]" 1
917 1 123 GLU HA 1 123 GLU HG2 2.537 . 3.342 2.571 2.412 2.980 . 0 0 "[ . 1 . 2]" 1
918 1 123 GLU HB2 1 123 GLU HG2 2.240 . 2.867 2.960 2.384 2.994 0.127 10 0 "[ . 1 . 2]" 1
919 1 123 GLU HB2 1 123 GLU HG3 2.218 . 2.833 2.440 2.377 2.539 . 0 0 "[ . 1 . 2]" 1
920 1 118 ASN QB 1 118 ASN HD22 2.715 . 3.636 3.233 3.124 3.277 . 0 0 "[ . 1 . 2]" 1
921 1 118 ASN H 1 118 ASN QB 3.019 . 3.443 3.230 3.150 3.434 . 0 0 "[ . 1 . 2]" 1
922 1 118 ASN QB 1 118 ASN HD21 2.889 . 3.932 2.135 1.987 2.231 . 0 0 "[ . 1 . 2]" 1
923 1 118 ASN QB 1 119 ILE H 3.469 . 4.973 3.956 3.801 4.045 . 0 0 "[ . 1 . 2]" 1
924 1 32 SER HA 1 35 GLU HG2 2.582 . 3.415 2.098 1.750 2.407 . 0 0 "[ . 1 . 2]" 1
925 1 35 GLU HB2 1 35 GLU HG2 2.628 . 3.491 2.997 2.956 3.007 . 0 0 "[ . 1 . 2]" 1
926 1 117 ASP HA 1 118 ASN QB 3.119 . 4.335 4.101 3.923 4.389 0.054 16 0 "[ . 1 . 2]" 1
927 1 124 GLU HG3 1 128 GLN H 3.231 . 4.536 4.048 3.581 4.341 . 0 0 "[ . 1 . 2]" 1
928 1 124 GLU HG3 1 128 GLN QG 2.859 . 3.881 2.959 2.516 3.961 0.080 19 0 "[ . 1 . 2]" 1
929 1 124 GLU HB3 1 124 GLU HG3 2.524 . 3.320 2.988 2.951 3.011 . 0 0 "[ . 1 . 2]" 1
930 1 124 GLU HG3 1 125 ILE H 3.285 . 4.634 4.749 4.694 4.937 0.303 17 0 "[ . 1 . 2]" 1
931 1 35 GLU H 1 35 GLU HG3 2.653 . 3.533 2.931 2.107 3.377 . 0 0 "[ . 1 . 2]" 1
932 1 31 VAL QG 1 35 GLU HG3 3.189 . 4.460 4.327 3.760 4.496 0.036 2 0 "[ . 1 . 2]" 1
933 1 124 GLU HG2 1 128 GLN HA 3.404 . 4.852 4.978 4.790 5.676 0.824 19 1 "[ . 1 . +2]" 1
934 1 124 GLU HG2 1 128 GLN QG 2.927 . 3.998 2.112 1.848 3.420 0.008 17 0 "[ . 1 . 2]" 1
935 1 124 GLU HB3 1 124 GLU HG2 2.033 . 2.550 2.343 2.263 2.404 . 0 0 "[ . 1 . 2]" 1
936 1 121 THR H 1 124 GLU HG2 3.571 . 5.165 4.268 3.902 5.025 . 0 0 "[ . 1 . 2]" 1
937 1 45 LYS H 1 45 LYS HB2 2.693 . 3.599 3.327 3.136 3.461 . 0 0 "[ . 1 . 2]" 1
938 1 124 GLU HG3 1 127 ARG HG2 3.529 . 5.085 4.679 3.420 5.518 0.433 5 0 "[ . 1 . 2]" 1
939 1 52 VAL HB 1 52 VAL QG 2.021 . 2.532 1.893 1.887 1.898 . 0 0 "[ . 1 . 2]" 1
940 1 74 GLU H 1 74 GLU QG 2.705 . 3.258 2.326 2.102 2.957 . 0 0 "[ . 1 . 2]" 1
941 1 74 GLU HA 1 74 GLU QG 3.013 . 4.025 3.401 3.308 3.615 . 0 0 "[ . 1 . 2]" 1
942 1 74 GLU QG 1 119 ILE MG 3.235 . 4.355 3.665 3.287 3.773 . 0 0 "[ . 1 . 2]" 1
943 1 74 GLU QG 1 122 LYS H 2.819 . 3.813 2.022 1.742 2.300 0.127 4 0 "[ . 1 . 2]" 1
944 1 74 GLU HB3 1 74 GLU QG 2.453 . 3.170 2.169 2.120 2.238 . 0 0 "[ . 1 . 2]" 1
945 1 105 LYS QB 1 106 TYR H 2.909 . 3.629 2.459 2.197 2.725 . 0 0 "[ . 1 . 2]" 1
946 1 105 LYS QB 1 105 LYS HE2 3.308 . 4.590 2.332 1.832 3.421 0.108 12 0 "[ . 1 . 2]" 1
947 1 24 GLU HB2 1 24 GLU QG 2.636 . 3.505 2.183 2.147 2.384 . 0 0 "[ . 1 . 2]" 1
948 1 24 GLU QG 1 62 TYR QE 3.515 . 5.060 3.659 2.944 4.524 . 0 0 "[ . 1 . 2]" 1
949 1 24 GLU QG 1 31 VAL QG 3.172 . 3.857 2.055 1.699 2.676 0.256 1 0 "[ . 1 . 2]" 1
950 1 24 GLU HA 1 24 GLU QG 3.246 . 4.563 3.203 3.060 3.467 . 0 0 "[ . 1 . 2]" 1
951 1 102 VAL H 1 102 VAL HB 2.727 . 3.657 3.784 3.762 3.803 0.146 2 0 "[ . 1 . 2]" 1
952 1 102 VAL HB 1 103 ASP QB 3.430 . 4.901 4.080 3.963 4.201 . 0 0 "[ . 1 . 2]" 1
953 1 128 GLN QE 1 128 GLN QG 2.664 . 3.551 2.422 2.160 2.710 . 0 0 "[ . 1 . 2]" 1
954 1 128 GLN HA 1 128 GLN QG 2.690 . 3.333 2.835 2.435 3.280 . 0 0 "[ . 1 . 2]" 1
955 1 127 ARG QB 1 128 GLN QG 3.214 . 4.505 3.107 2.786 4.099 . 0 0 "[ . 1 . 2]" 1
956 1 85 LEU HA 1 86 LYS HB2 4.035 . 6.070 4.353 4.181 4.722 . 0 0 "[ . 1 . 2]" 1
957 1 86 LYS HB2 1 86 LYS HG2 2.196 . 2.799 2.400 2.262 2.501 . 0 0 "[ . 1 . 2]" 1
958 1 86 LYS HA 1 86 LYS HB2 2.965 . 4.064 2.607 2.362 2.896 . 0 0 "[ . 1 . 2]" 1
959 1 85 LEU HA 1 86 LYS HB3 3.554 . 5.133 4.903 4.447 5.535 0.402 16 0 "[ . 1 . 2]" 1
960 1 86 LYS HB3 1 88 SER H 3.387 . 4.821 3.144 2.671 4.038 . 0 0 "[ . 1 . 2]" 1
961 1 86 LYS HB3 1 87 ASP H 3.558 . 5.140 3.853 3.393 4.314 . 0 0 "[ . 1 . 2]" 1
962 1 86 LYS HB3 1 86 LYS HG2 2.240 . 2.867 2.456 2.336 2.986 0.119 16 0 "[ . 1 . 2]" 1
963 1 91 VAL QG 1 101 LYS HB2 2.576 . 3.405 2.344 2.135 2.517 . 0 0 "[ . 1 . 2]" 1
964 1 101 LYS HB2 1 101 LYS HG2 2.502 . 3.284 3.009 3.003 3.012 . 0 0 "[ . 1 . 2]" 1
965 1 101 LYS HB2 1 101 LYS HG3 2.662 . 3.548 2.457 2.365 2.529 . 0 0 "[ . 1 . 2]" 1
966 1 101 LYS HB2 1 102 VAL H 3.666 . 5.346 4.440 4.414 4.459 . 0 0 "[ . 1 . 2]" 1
967 1 101 LYS HB3 1 106 TYR QE 3.233 . 4.540 4.137 3.921 4.319 . 0 0 "[ . 1 . 2]" 1
968 1 101 LYS HB3 1 102 VAL H 3.749 . 5.506 4.394 4.349 4.434 . 0 0 "[ . 1 . 2]" 1
969 1 49 GLN HA 1 49 GLN HG2 2.707 . 3.623 3.104 2.483 3.668 0.045 12 0 "[ . 1 . 2]" 1
970 1 49 GLN QB 1 49 GLN HG2 2.297 . 2.956 2.273 2.129 2.472 . 0 0 "[ . 1 . 2]" 1
971 1 130 GLN HA 1 130 GLN HG2 2.711 . 3.630 2.663 2.426 3.781 0.151 7 0 "[ . 1 . 2]" 1
972 1 130 GLN HB2 1 130 GLN HG2 2.373 . 3.077 3.001 2.977 3.009 . 0 0 "[ . 1 . 2]" 1
973 1 49 GLN QB 1 49 GLN HG3 1.974 . 2.461 2.350 2.105 2.442 . 0 0 "[ . 1 . 2]" 1
974 1 108 VAL H 1 108 VAL HB 2.512 . 3.301 2.645 2.591 2.738 . 0 0 "[ . 1 . 2]" 1
975 1 94 ILE MD 1 108 VAL HB 3.057 . 4.225 4.142 4.012 4.281 0.056 20 0 "[ . 1 . 2]" 1
976 1 60 HIS H 1 60 HIS QB 3.045 . 4.204 2.567 2.515 2.603 . 0 0 "[ . 1 . 2]" 1
977 1 41 GLN QG 1 55 HIS HB3 3.299 . 4.659 2.933 2.452 3.504 . 0 0 "[ . 1 . 2]" 1
978 1 53 THR MG 1 60 HIS QB 3.626 . 5.269 4.312 3.976 4.662 . 0 0 "[ . 1 . 2]" 1
979 1 130 GLN H 1 130 GLN HG3 2.654 . 3.535 2.486 2.197 3.713 0.178 7 0 "[ . 1 . 2]" 1
980 1 130 GLN HB2 1 130 GLN HG3 2.370 . 3.072 2.440 2.365 2.500 . 0 0 "[ . 1 . 2]" 1
981 1 55 HIS HB2 1 55 HIS HD2 2.899 . 3.949 3.884 3.830 3.922 . 0 0 "[ . 1 . 2]" 1
982 1 18 GLN HB3 1 18 GLN HG2 1.896 . 2.346 2.522 2.382 2.991 0.645 13 3 "[ - 1 *+ . 2]" 1
983 1 18 GLN HB2 1 18 GLN HG2 2.260 . 2.898 2.911 2.411 3.004 0.106 4 0 "[ . 1 . 2]" 1
984 1 55 HIS H 1 55 HIS HB2 3.189 . 4.460 3.866 3.842 3.887 . 0 0 "[ . 1 . 2]" 1
985 1 84 GLN H 1 84 GLN HG2 2.952 . 4.042 4.047 3.711 4.209 0.167 20 0 "[ . 1 . 2]" 1
986 1 84 GLN HB3 1 84 GLN HG2 2.238 . 2.864 2.435 2.366 2.522 . 0 0 "[ . 1 . 2]" 1
987 1 84 GLN HB2 1 84 GLN HG2 2.212 . 2.823 2.991 2.961 3.002 0.179 14 0 "[ . 1 . 2]" 1
988 1 84 GLN HG2 1 85 LEU H 3.436 . 4.912 3.808 2.673 4.323 . 0 0 "[ . 1 . 2]" 1
989 1 65 LYS H 1 65 LYS HB3 2.790 . 3.763 3.639 3.576 3.770 0.007 4 0 "[ . 1 . 2]" 1
990 1 65 LYS HA 1 65 LYS HB3 2.702 . 3.615 2.492 2.456 2.542 . 0 0 "[ . 1 . 2]" 1
991 1 65 LYS HB3 1 92 ASN HD22 3.484 . 5.001 4.195 3.625 4.627 . 0 0 "[ . 1 . 2]" 1
992 1 65 LYS HB3 1 65 LYS QE 2.952 . 4.041 3.341 2.072 3.907 . 0 0 "[ . 1 . 2]" 1
993 1 65 LYS HA 1 65 LYS HB2 2.701 . 3.613 3.018 3.004 3.029 . 0 0 "[ . 1 . 2]" 1
994 1 65 LYS HB2 1 65 LYS QE 3.357 . 4.766 4.022 3.201 4.526 . 0 0 "[ . 1 . 2]" 1
995 1 65 LYS HB2 1 65 LYS QG 2.391 . 3.106 2.144 2.126 2.164 . 0 0 "[ . 1 . 2]" 1
996 1 65 LYS HB2 1 66 VAL H 3.040 . 4.195 3.847 3.520 4.166 . 0 0 "[ . 1 . 2]" 1
997 1 67 PRO HB3 1 70 ALA H 3.700 . 5.411 4.929 4.678 5.057 . 0 0 "[ . 1 . 2]" 1
998 1 41 GLN H 1 41 GLN QG 3.001 . 4.127 2.782 2.258 3.557 . 0 0 "[ . 1 . 2]" 1
999 1 41 GLN HE22 1 41 GLN QG 3.156 . 4.401 3.209 3.201 3.223 . 0 0 "[ . 1 . 2]" 1
1000 1 41 GLN HE21 1 41 GLN QG 2.835 . 3.839 2.168 2.136 2.208 . 0 0 "[ . 1 . 2]" 1
1001 1 22 LYS HB2 1 23 ALA H 2.983 . 4.095 3.919 3.138 4.479 0.384 4 0 "[ . 1 . 2]" 1
1002 1 22 LYS H 1 22 LYS HB2 2.730 . 3.661 3.040 2.357 3.631 . 0 0 "[ . 1 . 2]" 1
1003 1 22 LYS HA 1 22 LYS HB2 2.435 . 3.176 2.971 2.365 3.028 . 0 0 "[ . 1 . 2]" 1
1004 1 22 LYS HB2 1 22 LYS HE2 3.794 . 5.593 4.259 3.079 5.083 . 0 0 "[ . 1 . 2]" 1
1005 1 22 LYS HB2 1 22 LYS QG 2.204 . 2.811 2.274 2.128 2.436 . 0 0 "[ . 1 . 2]" 1
1006 1 22 LYS HB3 1 23 ALA H 3.278 . 4.621 3.227 1.871 4.394 0.064 3 0 "[ . 1 . 2]" 1
1007 1 22 LYS HA 1 22 LYS HB3 2.593 . 3.433 2.555 2.447 3.013 . 0 0 "[ . 1 . 2]" 1
1008 1 22 LYS HB3 1 22 LYS QG 2.229 . 2.850 2.343 2.149 2.512 . 0 0 "[ . 1 . 2]" 1
1009 1 41 GLN QG 1 55 HIS HB2 3.467 . 4.970 3.139 2.583 3.691 . 0 0 "[ . 1 . 2]" 1
1010 1 67 PRO HB3 1 67 PRO HD3 2.926 . 3.997 3.138 3.074 3.209 . 0 0 "[ . 1 . 2]" 1
1011 1 67 PRO HB3 1 70 ALA MB 3.117 . 4.332 4.210 3.972 4.293 . 0 0 "[ . 1 . 2]" 1
1012 1 67 PRO HB2 1 70 ALA H 2.891 . 3.935 3.411 3.045 3.588 . 0 0 "[ . 1 . 2]" 1
1013 1 67 PRO HB2 1 67 PRO HD3 2.885 . 3.925 3.965 3.947 3.986 0.061 9 0 "[ . 1 . 2]" 1
1014 1 67 PRO HB2 1 67 PRO HD2 2.899 . 3.950 3.966 3.934 3.992 0.042 13 0 "[ . 1 . 2]" 1
1015 1 67 PRO HB2 1 70 ALA MB 2.734 . 3.668 3.474 3.077 3.617 . 0 0 "[ . 1 . 2]" 1
1016 1 91 VAL H 1 91 VAL HB 2.466 . 3.226 2.592 2.458 2.641 . 0 0 "[ . 1 . 2]" 1
1017 1 90 ILE HA 1 91 VAL HB 3.318 . 4.695 4.721 4.531 4.764 0.069 16 0 "[ . 1 . 2]" 1
1018 1 111 LYS H 1 111 LYS HB3 2.751 . 3.697 3.599 3.561 3.630 . 0 0 "[ . 1 . 2]" 1
1019 1 111 LYS HB3 1 112 ASP HA 3.583 . 5.188 4.892 4.749 5.074 . 0 0 "[ . 1 . 2]" 1
1020 1 111 LYS HA 1 111 LYS HB2 2.584 . 3.418 3.018 3.012 3.024 . 0 0 "[ . 1 . 2]" 1
1021 1 111 LYS HB2 1 112 ASP HB3 3.664 . 5.342 4.676 4.129 5.492 0.150 19 0 "[ . 1 . 2]" 1
1022 1 111 LYS HB2 1 111 LYS QG 2.415 . 3.144 2.315 2.241 2.378 . 0 0 "[ . 1 . 2]" 1
1023 1 66 VAL HB 1 92 ASN HD21 3.294 . 4.651 3.019 2.680 3.851 . 0 0 "[ . 1 . 2]" 1
1024 1 66 VAL HB 1 92 ASN HD22 2.936 . 4.013 3.603 2.040 4.052 0.039 16 0 "[ . 1 . 2]" 1
1025 1 66 VAL HB 1 66 VAL MG2 2.127 . 2.693 2.128 2.124 2.131 . 0 0 "[ . 1 . 2]" 1
1026 1 43 VAL HB 1 43 VAL MG1 2.083 . 2.625 2.124 2.119 2.128 . 0 0 "[ . 1 . 2]" 1
1027 1 43 VAL HB 1 44 ILE H 3.326 . 4.709 4.341 4.296 4.387 . 0 0 "[ . 1 . 2]" 1
1028 1 43 VAL HB 1 73 SER H 3.147 . 4.385 3.701 3.475 3.865 . 0 0 "[ . 1 . 2]" 1
1029 1 120 ARG HB2 1 120 ARG HG2 2.683 . 3.583 2.404 2.316 2.560 . 0 0 "[ . 1 . 2]" 1
1030 1 42 ILE MD 1 120 ARG HB3 2.859 . 3.881 2.913 2.507 3.444 . 0 0 "[ . 1 . 2]" 1
1031 1 42 ILE MG 1 120 ARG HB3 2.919 . 3.984 3.434 1.974 4.320 0.336 8 0 "[ . 1 . 2]" 1
1032 1 81 PRO HB2 1 82 ASN H 3.422 . 4.885 3.666 2.853 3.823 . 0 0 "[ . 1 . 2]" 1
1033 1 81 PRO HB3 1 82 ASN H 3.366 . 4.782 4.328 3.861 4.423 . 0 0 "[ . 1 . 2]" 1
1034 1 120 ARG H 1 120 ARG HB2 3.133 . 4.360 2.511 2.195 2.787 . 0 0 "[ . 1 . 2]" 1
1035 1 120 ARG HB3 1 120 ARG HG2 2.586 . 3.422 2.843 2.413 3.011 . 0 0 "[ . 1 . 2]" 1
1036 1 120 ARG HB3 1 121 THR H 3.575 . 5.173 3.455 3.084 4.177 . 0 0 "[ . 1 . 2]" 1
1037 1 120 ARG H 1 120 ARG HB3 3.031 . 4.179 3.593 2.526 3.766 . 0 0 "[ . 1 . 2]" 1
1038 1 120 ARG HB3 1 128 GLN QG 3.188 . 4.459 3.238 2.439 4.613 0.154 3 0 "[ . 1 . 2]" 1
1039 1 78 MET QG 1 100 ILE MD 3.402 . 3.490 2.785 2.105 3.297 . 0 0 "[ . 1 . 2]" 1
1040 1 40 GLU HA 1 40 GLU HB2 2.772 . 3.732 2.987 2.402 3.031 . 0 0 "[ . 1 . 2]" 1
1041 1 40 GLU HB2 1 71 ILE HG13 2.692 . 3.598 3.084 1.836 3.545 . 0 0 "[ . 1 . 2]" 1
1042 1 31 VAL HB 1 41 GLN HE21 3.044 . 4.202 3.045 2.650 3.768 . 0 0 "[ . 1 . 2]" 1
1043 1 31 VAL HB 1 41 GLN HE22 2.792 . 3.767 2.560 1.979 3.419 . 0 0 "[ . 1 . 2]" 1
1044 1 31 VAL HA 1 31 VAL HB 2.750 . 3.695 3.025 3.016 3.033 . 0 0 "[ . 1 . 2]" 1
1045 1 129 LYS H 1 129 LYS QB 2.541 . 3.291 2.493 2.400 2.597 . 0 0 "[ . 1 . 2]" 1
1046 1 129 LYS QB 1 130 GLN H 3.231 . 4.317 3.745 3.307 3.895 . 0 0 "[ . 1 . 2]" 1
1047 1 40 GLU HA 1 40 GLU HB3 2.614 . 3.468 2.481 2.362 2.538 . 0 0 "[ . 1 . 2]" 1
1048 1 126 LYS HA 1 129 LYS QB 2.452 . 3.204 3.128 2.381 3.293 0.089 7 0 "[ . 1 . 2]" 1
1049 1 40 GLU HB3 1 40 GLU QG 2.098 . 2.648 2.263 2.128 2.383 . 0 0 "[ . 1 . 2]" 1
1050 1 40 GLU HB3 1 71 ILE MG 3.042 . 4.199 3.765 2.966 4.965 0.766 11 1 "[ . 1+ . 2]" 1
1051 1 78 MET QG 1 83 TYR QD 3.235 . 4.088 2.609 2.022 3.425 . 0 0 "[ . 1 . 2]" 1
1052 1 78 MET QG 1 83 TYR QE 3.765 . 5.537 3.392 2.640 4.388 . 0 0 "[ . 1 . 2]" 1
1053 1 95 LYS HB3 1 118 ASN HD22 3.404 . 4.852 3.706 1.904 4.622 0.052 1 0 "[ . 1 . 2]" 1
1054 1 95 LYS HB3 1 118 ASN HD21 3.249 . 4.568 3.227 2.650 4.022 . 0 0 "[ . 1 . 2]" 1
1055 1 95 LYS HB3 1 95 LYS QE 3.110 . 4.319 3.310 1.907 4.116 . 0 0 "[ . 1 . 2]" 1
1056 1 95 LYS HB2 1 96 GLY H 3.153 . 4.395 4.421 4.117 4.500 0.105 15 0 "[ . 1 . 2]" 1
1057 1 95 LYS HB2 1 118 ASN HD22 3.689 . 5.390 4.888 3.308 5.424 0.034 19 0 "[ . 1 . 2]" 1
1058 1 95 LYS HB2 1 118 ASN HD21 3.628 . 5.273 4.648 4.075 5.338 0.065 14 0 "[ . 1 . 2]" 1
1059 1 95 LYS HB2 1 95 LYS HG3 2.354 . 3.047 2.525 2.408 2.987 . 0 0 "[ . 1 . 2]" 1
1060 1 95 LYS HB2 1 95 LYS QE 3.323 . 4.703 2.688 1.787 4.135 0.156 12 0 "[ . 1 . 2]" 1
1061 1 35 GLU HA 1 35 GLU HB3 2.700 . 3.611 2.371 2.275 2.473 . 0 0 "[ . 1 . 2]" 1
1062 1 35 GLU HB3 1 35 GLU HG2 2.542 . 3.350 2.409 2.266 2.489 . 0 0 "[ . 1 . 2]" 1
1063 1 35 GLU H 1 35 GLU HB2 2.748 . 3.692 3.615 3.548 3.690 . 0 0 "[ . 1 . 2]" 1
1064 1 35 GLU HA 1 35 GLU HB2 2.566 . 3.389 2.503 2.403 2.638 . 0 0 "[ . 1 . 2]" 1
1065 1 28 PRO HB2 1 29 ASP H 2.723 . 3.650 3.084 2.772 3.479 . 0 0 "[ . 1 . 2]" 1
1066 1 28 PRO HB2 1 29 ASP HB2 3.812 . 5.629 5.081 4.228 5.508 . 0 0 "[ . 1 . 2]" 1
1067 1 28 PRO HB2 1 28 PRO HD2 3.312 . 4.683 4.013 3.939 4.058 . 0 0 "[ . 1 . 2]" 1
1068 1 28 PRO HB2 1 28 PRO HG3 2.641 . 3.513 2.708 2.679 2.758 . 0 0 "[ . 1 . 2]" 1
1069 1 28 PRO HB3 1 28 PRO HD2 3.529 . 5.086 3.936 3.893 4.000 . 0 0 "[ . 1 . 2]" 1
1070 1 30 GLU HB2 1 31 VAL H 2.554 . 3.369 2.683 2.358 3.092 . 0 0 "[ . 1 . 2]" 1
1071 1 30 GLU H 1 30 GLU HB2 2.526 . 3.324 2.338 2.200 2.511 . 0 0 "[ . 1 . 2]" 1
1072 1 30 GLU HA 1 30 GLU HB2 2.597 . 3.440 3.011 2.988 3.028 . 0 0 "[ . 1 . 2]" 1
1073 1 26 LEU HG 1 30 GLU HB2 2.452 . 3.203 2.179 1.699 2.537 0.002 1 0 "[ . 1 . 2]" 1
1074 1 26 LEU QD 1 30 GLU HB2 2.761 . 3.714 2.642 2.095 2.937 . 0 0 "[ . 1 . 2]" 1
1075 1 30 GLU HB3 1 31 VAL H 2.710 . 3.628 3.563 3.423 3.706 0.078 6 0 "[ . 1 . 2]" 1
1076 1 30 GLU H 1 30 GLU HB3 2.620 . 3.478 3.514 3.481 3.551 0.073 12 0 "[ . 1 . 2]" 1
1077 1 26 LEU HG 1 30 GLU HB3 2.344 . 3.031 2.341 2.075 2.716 . 0 0 "[ . 1 . 2]" 1
1078 1 26 LEU QD 1 30 GLU HB3 2.404 . 3.126 1.823 1.641 2.061 0.150 3 0 "[ . 1 . 2]" 1
1079 1 30 GLU HA 1 30 GLU HB3 2.371 . 3.074 2.551 2.441 2.653 . 0 0 "[ . 1 . 2]" 1
1080 1 31 VAL HA 1 34 ARG QB 2.716 . 3.638 3.374 3.005 3.627 . 0 0 "[ . 1 . 2]" 1
1081 1 75 GLU H 1 75 GLU HB3 2.768 . 3.726 3.570 3.494 3.594 . 0 0 "[ . 1 . 2]" 1
1082 1 75 GLU HA 1 75 GLU HB3 2.410 . 3.136 2.499 2.395 2.597 . 0 0 "[ . 1 . 2]" 1
1083 1 127 ARG HA 1 127 ARG QB 2.227 . 2.847 2.347 2.295 2.412 . 0 0 "[ . 1 . 2]" 1
1084 1 127 ARG QB 1 127 ARG HD2 2.228 . 2.849 2.354 2.221 2.469 . 0 0 "[ . 1 . 2]" 1
1085 1 125 ILE H 1 125 ILE HG12 2.553 . 3.368 3.417 3.377 3.455 0.087 17 0 "[ . 1 . 2]" 1
1086 1 122 LYS HA 1 125 ILE HG12 3.493 . 5.018 4.220 3.757 4.565 . 0 0 "[ . 1 . 2]" 1
1087 1 42 ILE MG 1 125 ILE HG12 3.126 . 4.348 2.142 1.884 2.385 0.020 19 0 "[ . 1 . 2]" 1
1088 1 84 GLN HB3 1 84 GLN HG3 2.180 . 2.774 2.985 2.965 2.995 0.221 17 0 "[ . 1 . 2]" 1
1089 1 84 GLN HB2 1 85 LEU H 3.198 . 4.476 3.947 3.686 4.196 . 0 0 "[ . 1 . 2]" 1
1090 1 78 MET HB2 1 107 TYR HB3 3.048 . 4.209 2.104 1.844 2.561 0.043 4 0 "[ . 1 . 2]" 1
1091 1 125 ILE HA 1 125 ILE HG13 2.880 . 3.917 2.947 2.919 2.991 . 0 0 "[ . 1 . 2]" 1
1092 1 42 ILE MG 1 125 ILE HG13 2.861 . 3.884 3.517 3.250 3.845 . 0 0 "[ . 1 . 2]" 1
1093 1 122 LYS HA 1 125 ILE HG13 3.407 . 4.858 2.857 2.344 3.279 . 0 0 "[ . 1 . 2]" 1
1094 1 95 LYS HA 1 95 LYS HD3 3.289 . 4.641 4.388 1.985 4.719 0.078 16 0 "[ . 1 . 2]" 1
1095 1 78 MET HB2 1 100 ILE MD 3.168 . 4.423 2.743 2.082 3.236 . 0 0 "[ . 1 . 2]" 1
1096 1 101 LYS HD2 1 106 TYR QE 3.201 . 4.482 2.332 2.056 2.656 . 0 0 "[ . 1 . 2]" 1
1097 1 101 LYS HD2 1 101 LYS HE2 2.732 . 3.665 3.012 3.005 3.016 . 0 0 "[ . 1 . 2]" 1
1098 1 101 LYS HD2 1 101 LYS HG2 2.642 . 3.515 3.015 3.013 3.018 . 0 0 "[ . 1 . 2]" 1
1099 1 101 LYS HD2 1 101 LYS HE3 2.703 . 3.616 2.445 2.388 2.507 . 0 0 "[ . 1 . 2]" 1
1100 1 101 LYS HB3 1 101 LYS HD2 2.731 . 3.663 3.083 2.941 3.206 . 0 0 "[ . 1 . 2]" 1
1101 1 101 LYS HB3 1 101 LYS HD3 2.787 . 3.758 2.504 2.359 2.597 . 0 0 "[ . 1 . 2]" 1
1102 1 101 LYS HD3 1 106 TYR QE 3.151 . 4.392 3.852 3.425 4.262 . 0 0 "[ . 1 . 2]" 1
1103 1 101 LYS HD3 1 101 LYS HE2 2.770 . 3.729 2.442 2.381 2.505 . 0 0 "[ . 1 . 2]" 1
1104 1 101 LYS HD3 1 101 LYS HE3 2.708 . 3.624 3.012 3.006 3.018 . 0 0 "[ . 1 . 2]" 1
1105 1 101 LYS HD3 1 101 LYS HG2 2.678 . 3.575 2.450 2.429 2.489 . 0 0 "[ . 1 . 2]" 1
1106 1 21 GLN HA 1 21 GLN HB3 2.670 . 3.561 2.461 2.321 2.525 . 0 0 "[ . 1 . 2]" 1
1107 1 21 GLN H 1 21 GLN HB3 2.962 . 4.059 3.589 2.604 4.092 0.033 8 0 "[ . 1 . 2]" 1
1108 1 21 GLN HB3 1 21 GLN HG2 2.177 . 2.769 2.538 2.305 3.010 0.241 9 0 "[ . 1 . 2]" 1
1109 1 111 LYS HD2 1 111 LYS QG 2.462 . 3.220 2.294 2.165 2.441 . 0 0 "[ . 1 . 2]" 1
1110 1 21 GLN H 1 21 GLN HB2 2.643 . 3.516 3.047 2.457 3.944 0.428 19 0 "[ . 1 . 2]" 1
1111 1 21 GLN HB2 1 22 LYS H 3.286 . 4.636 3.267 1.791 4.072 0.145 19 0 "[ . 1 . 2]" 1
1112 1 105 LYS HD3 1 105 LYS QG 1.974 . 2.461 2.202 2.166 2.399 . 0 0 "[ . 1 . 2]" 1
1113 1 45 LYS QD 1 46 ILE H 3.265 . 4.598 4.314 3.420 4.408 . 0 0 "[ . 1 . 2]" 1
1114 1 45 LYS QD 1 45 LYS HG2 2.064 . 2.597 2.173 2.144 2.485 . 0 0 "[ . 1 . 2]" 1
1115 1 45 LYS QD 1 52 VAL QG 2.273 . 2.919 2.318 1.676 2.996 0.077 15 0 "[ . 1 . 2]" 1
1116 1 124 GLU HB2 1 125 ILE H 3.215 . 4.507 3.935 3.766 4.195 . 0 0 "[ . 1 . 2]" 1
1117 1 120 ARG HA 1 124 GLU HB2 3.561 . 5.146 4.268 3.836 5.146 . 0 0 "[ . 1 . 2]" 1
1118 1 130 GLN H 1 130 GLN HB3 2.618 . 3.475 3.500 2.331 3.652 0.177 5 0 "[ . 1 . 2]" 1
1119 1 130 GLN HB3 1 130 GLN HG3 2.060 . 2.590 2.999 2.959 3.007 0.417 14 0 "[ . 1 . 2]" 1
1120 1 123 GLU HA 1 123 GLU HB3 2.428 . 3.165 2.481 2.413 2.527 . 0 0 "[ . 1 . 2]" 1
1121 1 121 THR H 1 124 GLU HB3 3.056 . 4.223 2.337 1.940 2.920 . 0 0 "[ . 1 . 2]" 1
1122 1 124 GLU HB3 1 125 ILE H 3.027 . 4.173 2.793 2.570 3.169 . 0 0 "[ . 1 . 2]" 1
1123 1 123 GLU HA 1 123 GLU HB2 2.326 . 3.002 3.011 2.986 3.018 0.016 16 0 "[ . 1 . 2]" 1
1124 1 122 LYS HA 1 122 LYS HD2 3.027 . 4.172 3.995 2.017 4.748 0.576 15 1 "[ . 1 + 2]" 1
1125 1 114 ALA MB 1 115 HIS QB 3.748 . 5.504 3.865 3.125 4.469 . 0 0 "[ . 1 . 2]" 1
1126 1 74 GLU HB2 1 122 LYS H 3.683 . 5.378 4.660 4.382 4.909 . 0 0 "[ . 1 . 2]" 1
1127 1 74 GLU H 1 74 GLU HB2 2.665 . 3.553 3.542 3.450 3.581 0.028 12 0 "[ . 1 . 2]" 1
1128 1 74 GLU H 1 74 GLU HB3 2.547 . 3.358 2.423 2.377 2.558 . 0 0 "[ . 1 . 2]" 1
1129 1 74 GLU HA 1 74 GLU HB3 2.405 . 3.128 2.477 2.389 2.517 . 0 0 "[ . 1 . 2]" 1
1130 1 74 GLU HB3 1 121 THR MG 3.407 . 4.858 2.768 2.296 3.441 . 0 0 "[ . 1 . 2]" 1
1131 1 74 GLU HB3 1 77 LEU QD 2.957 . 4.050 3.517 2.904 3.771 . 0 0 "[ . 1 . 2]" 1
1132 1 74 GLU HB3 1 119 ILE MG 2.456 . 3.210 2.218 1.916 2.337 . 0 0 "[ . 1 . 2]" 1
1133 1 90 ILE HG13 1 91 VAL H 3.402 . 4.849 4.906 4.870 4.939 0.090 17 0 "[ . 1 . 2]" 1
1134 1 90 ILE HB 1 90 ILE HG12 2.891 . 3.935 3.014 3.010 3.017 . 0 0 "[ . 1 . 2]" 1
1135 1 87 ASP HA 1 90 ILE HG12 3.353 . 4.758 4.112 3.896 4.306 . 0 0 "[ . 1 . 2]" 1
1136 1 115 HIS H 1 115 HIS QB 2.937 . 3.098 2.528 2.065 2.708 . 0 0 "[ . 1 . 2]" 1
1137 1 115 HIS QB 1 116 ALA MB 3.229 . 4.532 4.158 4.084 4.342 . 0 0 "[ . 1 . 2]" 1
1138 1 129 LYS HD3 1 129 LYS QE 1.990 . 2.485 2.335 2.261 2.446 . 0 0 "[ . 1 . 2]" 1
1139 1 90 ILE HG13 1 100 ILE MG 2.406 . 3.129 2.852 2.601 3.031 . 0 0 "[ . 1 . 2]" 1
1140 1 90 ILE H 1 90 ILE HG12 2.935 . 4.012 3.544 3.444 3.721 . 0 0 "[ . 1 . 2]" 1
1141 1 90 ILE HG12 1 100 ILE MG 2.546 . 3.356 2.287 2.035 2.686 . 0 0 "[ . 1 . 2]" 1
1142 1 128 GLN H 1 128 GLN HB2 2.973 . 4.078 2.568 2.246 3.674 . 0 0 "[ . 1 . 2]" 1
1143 1 125 ILE HA 1 128 GLN HB2 3.615 . 5.249 2.879 2.034 5.614 0.365 19 0 "[ . 1 . 2]" 1
1144 1 128 GLN HB2 1 129 LYS H 3.282 . 4.629 3.230 2.744 4.179 . 0 0 "[ . 1 . 2]" 1
1145 1 128 GLN HA 1 128 GLN HB2 2.625 . 3.486 2.924 2.364 3.018 . 0 0 "[ . 1 . 2]" 1
1146 1 39 ALA MB 1 128 GLN QB 2.998 . 4.121 4.640 4.072 5.261 1.140 10 11 "[* -** ** +* * * *2]" 1
1147 1 67 PRO HG2 1 69 ASP H 3.315 . 4.688 4.033 3.758 4.358 . 0 0 "[ . 1 . 2]" 1
1148 1 67 PRO HA 1 67 PRO HG2 2.925 . 3.994 3.882 3.858 3.909 . 0 0 "[ . 1 . 2]" 1
1149 1 67 PRO HD2 1 67 PRO HG2 2.406 . 3.130 2.288 2.282 2.297 . 0 0 "[ . 1 . 2]" 1
1150 1 67 PRO HB3 1 67 PRO HG2 2.209 . 2.819 2.945 2.935 2.954 0.135 13 0 "[ . 1 . 2]" 1
1151 1 67 PRO HG3 1 69 ASP H 3.684 . 5.380 5.179 5.016 5.398 0.018 14 0 "[ . 1 . 2]" 1
1152 1 67 PRO HG2 1 70 ALA MB 2.788 . 3.759 1.664 1.616 1.714 0.201 11 0 "[ . 1 . 2]" 1
1153 1 66 VAL MG1 1 67 PRO HG2 3.397 . 4.839 3.489 3.332 3.703 . 0 0 "[ . 1 . 2]" 1
1154 1 67 PRO HA 1 67 PRO HG3 2.972 . 4.076 3.962 3.908 3.991 . 0 0 "[ . 1 . 2]" 1
1155 1 67 PRO HG3 1 70 ALA H 3.305 . 4.670 4.737 4.693 4.787 0.117 14 0 "[ . 1 . 2]" 1
1156 1 67 PRO HD3 1 67 PRO HG3 2.512 . 3.301 2.287 2.276 2.296 . 0 0 "[ . 1 . 2]" 1
1157 1 66 VAL MG1 1 67 PRO HG3 3.192 . 4.466 4.363 4.242 4.509 0.043 9 0 "[ . 1 . 2]" 1
1158 1 75 GLU HB3 1 76 LEU HG 2.938 . 4.017 3.958 3.685 4.106 0.089 12 0 "[ . 1 . 2]" 1
1159 1 75 GLU H 1 76 LEU HG 3.318 . 4.694 4.269 3.943 4.528 . 0 0 "[ . 1 . 2]" 1
1160 1 76 LEU HA 1 76 LEU HG 2.987 . 4.102 3.000 2.931 3.106 . 0 0 "[ . 1 . 2]" 1
1161 1 76 LEU MD2 1 76 LEU HG 2.089 . 2.635 2.125 2.120 2.128 . 0 0 "[ . 1 . 2]" 1
1162 1 117 ASP HB2 1 119 ILE HG12 3.283 . 4.630 4.431 1.841 4.876 0.246 3 0 "[ . 1 . 2]" 1
1163 1 120 ARG HA 1 120 ARG HG2 3.319 . 4.696 3.371 2.999 3.694 . 0 0 "[ . 1 . 2]" 1
1164 1 34 ARG HA 1 34 ARG HG3 2.590 . 3.429 2.890 2.522 3.093 . 0 0 "[ . 1 . 2]" 1
1165 1 34 ARG QB 1 34 ARG HG3 1.875 . 2.315 2.318 2.283 2.349 0.034 9 0 "[ . 1 . 2]" 1
1166 1 31 VAL HA 1 34 ARG HG3 3.516 . 5.061 4.868 4.159 5.752 0.691 4 1 "[ +. 1 . 2]" 1
1167 1 34 ARG QD 1 34 ARG HG3 2.240 . 2.867 2.248 2.157 2.367 . 0 0 "[ . 1 . 2]" 1
1168 1 77 LEU H 1 77 LEU HG 2.456 . 3.210 2.680 2.109 3.331 0.121 7 0 "[ . 1 . 2]" 1
1169 1 28 PRO HG2 1 67 PRO HB3 3.201 . 4.482 3.559 2.757 4.342 . 0 0 "[ . 1 . 2]" 1
1170 1 127 ARG H 1 127 ARG HG2 3.383 . 4.814 3.958 3.173 4.490 . 0 0 "[ . 1 . 2]" 1
1171 1 127 ARG HA 1 127 ARG HG2 2.681 . 3.580 2.804 2.410 3.240 . 0 0 "[ . 1 . 2]" 1
1172 1 127 ARG QB 1 127 ARG HG2 2.234 . 2.858 2.361 2.317 2.471 . 0 0 "[ . 1 . 2]" 1
1173 1 71 ILE HG12 1 72 ILE H 3.747 . 5.502 5.122 4.939 5.191 . 0 0 "[ . 1 . 2]" 1
1174 1 71 ILE H 1 71 ILE HG12 2.677 . 3.573 2.419 2.291 2.664 . 0 0 "[ . 1 . 2]" 1
1175 1 70 ALA HA 1 71 ILE HG12 3.611 . 5.241 3.369 3.280 3.512 . 0 0 "[ . 1 . 2]" 1
1176 1 71 ILE HB 1 71 ILE HG12 2.447 . 3.196 2.426 2.364 2.539 . 0 0 "[ . 1 . 2]" 1
1177 1 71 ILE HA 1 71 ILE HG12 3.045 . 4.204 3.176 2.871 3.345 . 0 0 "[ . 1 . 2]" 1
1178 1 71 ILE H 1 71 ILE HG13 2.762 . 3.716 3.830 3.728 3.923 0.207 9 0 "[ . 1 . 2]" 1
1179 1 70 ALA HA 1 71 ILE HG13 3.491 . 5.014 5.102 5.027 5.174 0.160 13 0 "[ . 1 . 2]" 1
1180 1 71 ILE HB 1 71 ILE HG13 2.551 . 3.364 2.466 2.357 2.525 . 0 0 "[ . 1 . 2]" 1
1181 1 14 ILE HA 1 14 ILE HG13 3.485 . 5.003 3.092 2.426 3.784 . 0 0 "[ . 1 . 2]" 1
1182 1 28 PRO HG3 1 29 ASP H 3.534 . 5.096 4.201 4.023 4.326 . 0 0 "[ . 1 . 2]" 1
1183 1 28 PRO HG3 1 62 TYR QE 3.752 . 5.512 4.670 3.216 5.698 0.186 16 0 "[ . 1 . 2]" 1
1184 1 28 PRO HA 1 28 PRO HG3 2.991 . 4.109 3.880 3.739 3.963 . 0 0 "[ . 1 . 2]" 1
1185 1 80 ASP HA 1 81 PRO HG3 3.572 . 5.167 4.402 4.335 4.480 . 0 0 "[ . 1 . 2]" 1
1186 1 81 PRO HG3 1 82 ASN H 3.165 . 4.417 4.239 3.576 4.435 0.018 12 0 "[ . 1 . 2]" 1
1187 1 81 PRO HB2 1 81 PRO HG3 2.278 . 2.926 2.673 2.662 2.742 . 0 0 "[ . 1 . 2]" 1
1188 1 81 PRO HA 1 81 PRO HG2 3.579 . 5.180 3.858 3.842 3.950 . 0 0 "[ . 1 . 2]" 1
1189 1 81 PRO HB2 1 81 PRO HG2 2.352 . 3.043 2.316 2.278 2.323 . 0 0 "[ . 1 . 2]" 1
1190 1 26 LEU HA 1 26 LEU HG 3.389 . 4.824 3.018 2.620 3.885 . 0 0 "[ . 1 . 2]" 1
1191 1 26 LEU QD 1 26 LEU HG 2.097 . 2.136 1.889 1.881 1.895 . 0 0 "[ . 1 . 2]" 1
1192 1 46 ILE H 1 46 ILE HG12 2.975 . 4.082 3.774 3.634 3.981 . 0 0 "[ . 1 . 2]" 1
1193 1 72 ILE H 1 72 ILE HG13 2.870 . 3.900 3.939 3.888 3.966 0.066 6 0 "[ . 1 . 2]" 1
1194 1 43 VAL HB 1 72 ILE HG13 3.719 . 5.448 4.574 4.403 4.783 . 0 0 "[ . 1 . 2]" 1
1195 1 72 ILE HB 1 72 ILE HG13 2.554 . 3.369 2.398 2.381 2.432 . 0 0 "[ . 1 . 2]" 1
1196 1 72 ILE H 1 72 ILE HG12 2.826 . 3.824 2.614 2.552 2.666 . 0 0 "[ . 1 . 2]" 1
1197 1 72 ILE HA 1 72 ILE HG12 3.023 . 4.165 3.033 2.949 3.134 . 0 0 "[ . 1 . 2]" 1
1198 1 43 VAL HB 1 72 ILE HG12 3.204 . 4.487 4.236 4.127 4.434 . 0 0 "[ . 1 . 2]" 1
1199 1 46 ILE H 1 46 ILE HG13 3.326 . 4.709 2.557 2.423 2.855 . 0 0 "[ . 1 . 2]" 1
1200 1 46 ILE HG13 1 46 ILE MG 2.609 . 3.460 3.182 3.171 3.194 . 0 0 "[ . 1 . 2]" 1
1201 1 110 LEU HG 1 113 ALA HA 3.113 . 4.324 3.327 2.972 3.710 . 0 0 "[ . 1 . 2]" 1
1202 1 110 LEU QD 1 110 LEU HG 1.701 . 2.063 1.891 1.886 1.893 . 0 0 "[ . 1 . 2]" 1
1203 1 100 ILE QG 1 107 TYR HA 3.639 . 5.295 4.173 4.026 4.296 . 0 0 "[ . 1 . 2]" 1
1204 1 44 ILE HG13 1 53 THR HA 3.621 . 5.260 4.129 3.735 4.460 . 0 0 "[ . 1 . 2]" 1
1205 1 44 ILE HB 1 44 ILE HG13 2.654 . 3.535 2.527 2.480 2.612 . 0 0 "[ . 1 . 2]" 1
1206 1 37 ILE HG12 1 39 ALA H 3.390 . 4.826 4.602 3.720 5.085 0.259 11 0 "[ . 1 . 2]" 1
1207 1 100 ILE HA 1 100 ILE QG 3.678 . 5.369 3.321 3.308 3.331 . 0 0 "[ . 1 . 2]" 1
1208 1 100 ILE QG 1 107 TYR HB3 3.162 . 4.412 3.558 3.317 3.730 . 0 0 "[ . 1 . 2]" 1
1209 1 100 ILE QG 1 107 TYR HB2 2.810 . 3.797 2.140 1.908 2.295 . 0 0 "[ . 1 . 2]" 1
1210 1 44 ILE H 1 44 ILE HG13 2.713 . 3.633 2.570 2.274 2.775 . 0 0 "[ . 1 . 2]" 1
1211 1 43 VAL HA 1 44 ILE HG13 3.464 . 4.964 4.588 4.279 4.788 . 0 0 "[ . 1 . 2]" 1
1212 1 44 ILE HB 1 44 ILE HG12 2.909 . 3.967 3.021 3.003 3.027 . 0 0 "[ . 1 . 2]" 1
1213 1 44 ILE H 1 44 ILE HG12 2.697 . 3.606 1.972 1.865 2.132 . 0 0 "[ . 1 . 2]" 1
1214 1 44 ILE MD 1 44 ILE HG12 2.173 . 2.763 2.111 2.107 2.114 . 0 0 "[ . 1 . 2]" 1
1215 1 85 LEU H 1 85 LEU HG 3.453 . 4.944 4.436 4.402 4.495 . 0 0 "[ . 1 . 2]" 1
1216 1 85 LEU HA 1 85 LEU HG 2.953 . 4.043 3.059 2.923 3.124 . 0 0 "[ . 1 . 2]" 1
1217 1 85 LEU HG 1 90 ILE MD 2.954 . 4.045 1.975 1.821 2.555 0.042 17 0 "[ . 1 . 2]" 1
1218 1 110 LEU QD 1 113 ALA H 3.170 . 4.426 3.573 3.258 3.762 . 0 0 "[ . 1 . 2]" 1
1219 1 110 LEU H 1 110 LEU QD 2.657 . 3.539 3.578 3.427 3.727 0.188 4 0 "[ . 1 . 2]" 1
1220 1 110 LEU HA 1 110 LEU QD . . 3.122 1.760 1.652 2.043 0.274 18 0 "[ . 1 . 2]" 1
1221 1 110 LEU HB3 1 110 LEU QD 1.984 . 2.476 2.254 2.212 2.310 . 0 0 "[ . 1 . 2]" 1
1222 1 73 SER H 1 76 LEU MD1 2.892 . 3.938 2.933 2.571 3.112 . 0 0 "[ . 1 . 2]" 1
1223 1 76 LEU H 1 76 LEU MD1 2.554 . 3.370 3.770 3.568 3.895 0.525 1 1 "[+ . 1 . 2]" 1
1224 1 44 ILE HA 1 76 LEU MD1 3.213 . 4.503 2.838 2.583 3.095 . 0 0 "[ . 1 . 2]" 1
1225 1 76 LEU HA 1 76 LEU MD1 3.104 . 4.308 3.845 3.799 3.882 . 0 0 "[ . 1 . 2]" 1
1226 1 72 ILE HA 1 76 LEU MD1 3.253 . 4.576 3.985 3.655 4.243 . 0 0 "[ . 1 . 2]" 1
1227 1 73 SER QB 1 76 LEU MD1 3.078 . 4.262 2.893 2.447 3.219 . 0 0 "[ . 1 . 2]" 1
1228 1 76 LEU HB2 1 76 LEU MD1 2.280 . 2.930 2.310 2.257 2.356 . 0 0 "[ . 1 . 2]" 1
1229 1 76 LEU HB3 1 76 LEU MD1 2.059 . 2.589 2.384 2.322 2.435 . 0 0 "[ . 1 . 2]" 1
1230 1 46 ILE HG12 1 76 LEU MD1 2.795 . 3.772 2.535 2.286 2.867 . 0 0 "[ . 1 . 2]" 1
1231 1 85 LEU QD 1 85 LEU HG 1.700 . 2.061 1.891 1.888 1.893 . 0 0 "[ . 1 . 2]" 1
1232 1 85 LEU QD 1 90 ILE MD 2.366 . 3.066 2.161 2.009 2.507 . 0 0 "[ . 1 . 2]" 1
1233 1 109 TYR QE 1 111 LYS QG 3.176 . 4.437 2.169 1.775 3.980 0.140 18 0 "[ . 1 . 2]" 1
1234 1 111 LYS HA 1 111 LYS QG 2.601 . 3.446 2.402 2.351 2.469 . 0 0 "[ . 1 . 2]" 1
1235 1 111 LYS H 1 111 LYS QG 2.921 . 3.399 2.389 2.252 2.564 . 0 0 "[ . 1 . 2]" 1
1236 1 65 LYS H 1 65 LYS QG 2.760 . 3.343 2.642 2.353 3.114 . 0 0 "[ . 1 . 2]" 1
1237 1 74 GLU H 1 77 LEU QD 3.424 . 4.889 4.360 3.712 4.694 . 0 0 "[ . 1 . 2]" 1
1238 1 77 LEU QD 1 78 MET H . . 3.283 2.945 2.757 3.131 . 0 0 "[ . 1 . 2]" 1
1239 1 77 LEU QD 1 110 LEU H 3.404 . 3.974 3.426 2.861 3.965 . 0 0 "[ . 1 . 2]" 1
1240 1 77 LEU H 1 77 LEU QD 2.768 . 3.476 2.927 1.812 3.266 . 0 0 "[ . 1 . 2]" 1
1241 1 77 LEU HA 1 77 LEU QD 3.202 . 3.394 2.163 1.750 3.215 0.171 10 0 "[ . 1 . 2]" 1
1242 1 74 GLU HA 1 77 LEU QD 2.232 . 2.855 2.332 1.707 2.715 0.082 7 0 "[ . 1 . 2]" 1
1243 1 74 GLU HB2 1 77 LEU QD 2.652 . 3.531 2.928 2.156 3.398 . 0 0 "[ . 1 . 2]" 1
1244 1 77 LEU QD 1 77 LEU HG 1.879 . 2.320 1.891 1.885 1.896 . 0 0 "[ . 1 . 2]" 1
1245 1 77 LEU HB3 1 77 LEU QD 1.922 . 2.221 2.108 2.024 2.227 0.006 18 0 "[ . 1 . 2]" 1
1246 1 26 LEU HA 1 26 LEU QD . . 3.099 2.236 1.778 3.221 0.185 8 0 "[ . 1 . 2]" 1
1247 1 26 LEU QD 1 31 VAL HA 2.820 . 3.814 2.785 2.180 3.264 . 0 0 "[ . 1 . 2]" 1
1248 1 26 LEU QD 1 34 ARG QD 2.304 . 2.967 2.123 1.734 2.561 0.167 1 0 "[ . 1 . 2]" 1
1249 1 26 LEU HB3 1 26 LEU QD 1.794 . 2.196 2.191 2.091 2.258 0.062 12 0 "[ . 1 . 2]" 1
1250 1 94 ILE HG12 1 95 LYS H 3.011 . 4.144 4.234 4.206 4.270 0.126 15 0 "[ . 1 . 2]" 1
1251 1 94 ILE HA 1 94 ILE HG12 3.155 . 4.399 3.654 3.629 3.683 . 0 0 "[ . 1 . 2]" 1
1252 1 94 ILE HA 1 94 ILE HG13 3.436 . 4.912 3.782 3.769 3.798 . 0 0 "[ . 1 . 2]" 1
1253 1 94 ILE HB 1 94 ILE HG13 2.712 . 3.631 2.409 2.398 2.419 . 0 0 "[ . 1 . 2]" 1
1254 1 94 ILE HG13 1 98 TYR HA 3.252 . 4.574 4.183 3.925 4.440 . 0 0 "[ . 1 . 2]" 1
1255 1 105 LYS QE 1 105 LYS QG 2.432 . 3.171 2.567 2.186 2.709 . 0 0 "[ . 1 . 2]" 1
1256 1 65 LYS QG 1 66 VAL H 3.322 . 4.701 4.294 4.107 4.444 . 0 0 "[ . 1 . 2]" 1
1257 1 26 LEU QD 1 31 VAL H 2.884 . 3.923 3.356 2.885 3.809 . 0 0 "[ . 1 . 2]" 1
1258 1 26 LEU H 1 26 LEU QD 2.834 . 3.505 2.934 1.704 3.406 0.126 18 0 "[ . 1 . 2]" 1
1259 1 74 GLU QG 1 122 LYS QG 3.497 . 4.021 2.572 2.068 3.013 . 0 0 "[ . 1 . 2]" 1
1260 1 122 LYS HA 1 122 LYS QG 2.891 . 3.024 2.355 2.100 2.777 . 0 0 "[ . 1 . 2]" 1
1261 1 122 LYS H 1 122 LYS QG 2.670 . 3.407 2.386 1.913 2.749 . 0 0 "[ . 1 . 2]" 1
1262 1 126 LYS H 1 126 LYS HG2 3.173 . 4.431 4.016 3.168 4.592 0.161 13 0 "[ . 1 . 2]" 1
1263 1 126 LYS HA 1 126 LYS HG2 2.662 . 3.548 2.991 2.404 3.820 0.272 13 0 "[ . 1 . 2]" 1
1264 1 45 LYS HG3 1 46 ILE H 2.925 . 3.994 2.669 2.337 3.973 . 0 0 "[ . 1 . 2]" 1
1265 1 45 LYS HA 1 45 LYS HG3 3.203 . 4.486 2.689 2.524 3.392 . 0 0 "[ . 1 . 2]" 1
1266 1 33 LYS H 1 33 LYS HG3 2.964 . 4.062 2.234 2.034 2.553 . 0 0 "[ . 1 . 2]" 1
1267 1 33 LYS HB2 1 33 LYS HG3 2.256 . 2.892 2.458 2.388 2.540 . 0 0 "[ . 1 . 2]" 1
1268 1 105 LYS H 1 105 LYS QG 3.180 . 4.444 3.148 2.947 3.308 . 0 0 "[ . 1 . 2]" 1
1269 1 45 LYS HB2 1 45 LYS HG2 2.479 . 3.247 2.994 2.731 3.017 . 0 0 "[ . 1 . 2]" 1
1270 1 45 LYS HB3 1 45 LYS HG2 1.981 . 2.471 2.447 2.361 2.914 0.443 1 0 "[ . 1 . 2]" 1
1271 1 45 LYS HG2 1 52 VAL QG 2.777 . 3.741 2.927 2.673 4.187 0.446 1 0 "[ . 1 . 2]" 1
1272 1 45 LYS HG2 1 46 ILE H 2.845 . 3.857 2.840 2.281 3.131 . 0 0 "[ . 1 . 2]" 1
1273 1 79 LYS HB2 1 79 LYS QG 2.298 . 2.958 2.330 2.159 2.382 . 0 0 "[ . 1 . 2]" 1
1274 1 101 LYS HE2 1 101 LYS HG2 2.975 . 4.082 2.498 2.389 2.616 . 0 0 "[ . 1 . 2]" 1
1275 1 101 LYS HG2 1 102 VAL H 3.382 . 4.812 3.732 3.459 3.876 . 0 0 "[ . 1 . 2]" 1
1276 1 101 LYS HE3 1 101 LYS HG2 2.897 . 3.946 3.042 2.948 3.144 . 0 0 "[ . 1 . 2]" 1
1277 1 101 LYS HB3 1 101 LYS HG2 2.277 . 2.925 2.430 2.367 2.534 . 0 0 "[ . 1 . 2]" 1
1278 1 101 LYS HG3 1 102 VAL H 3.258 . 4.585 3.727 3.545 3.939 . 0 0 "[ . 1 . 2]" 1
1279 1 101 LYS HG3 1 106 TYR HA 3.756 . 5.520 3.604 3.357 3.940 . 0 0 "[ . 1 . 2]" 1
1280 1 101 LYS HE3 1 101 LYS HG3 2.840 . 3.848 2.502 2.406 2.612 . 0 0 "[ . 1 . 2]" 1
1281 1 101 LYS HG3 1 104 GLY H 3.645 . 5.305 4.230 4.132 4.258 . 0 0 "[ . 1 . 2]" 1
1282 1 101 LYS HE2 1 101 LYS HG3 3.007 . 4.137 3.072 2.938 3.178 . 0 0 "[ . 1 . 2]" 1
1283 1 101 LYS HD3 1 101 LYS HG3 2.607 . 3.457 3.017 3.015 3.021 . 0 0 "[ . 1 . 2]" 1
1284 1 101 LYS HB3 1 101 LYS HG3 2.463 . 3.222 3.009 3.002 3.014 . 0 0 "[ . 1 . 2]" 1
1285 1 95 LYS HB3 1 95 LYS HG3 2.233 . 2.856 2.949 2.483 2.991 0.135 15 0 "[ . 1 . 2]" 1
1286 1 95 LYS HG2 1 96 GLY H 2.976 . 4.083 3.600 3.347 4.213 0.130 19 0 "[ . 1 . 2]" 1
1287 1 95 LYS HG2 1 96 GLY HA3 3.697 . 5.405 4.116 3.751 4.969 . 0 0 "[ . 1 . 2]" 1
1288 1 95 LYS HA 1 95 LYS HG2 2.632 . 3.498 3.043 2.672 3.672 0.174 19 0 "[ . 1 . 2]" 1
1289 1 95 LYS QE 1 95 LYS HG2 2.727 . 3.657 2.911 2.310 3.488 . 0 0 "[ . 1 . 2]" 1
1290 1 95 LYS HB3 1 95 LYS HG2 2.192 . 2.793 2.357 2.260 2.425 . 0 0 "[ . 1 . 2]" 1
1291 1 129 LYS H 1 129 LYS HG3 2.847 . 3.860 3.358 3.045 3.598 . 0 0 "[ . 1 . 2]" 1
1292 1 129 LYS HG3 1 130 GLN H 3.728 . 5.465 3.566 2.536 5.153 . 0 0 "[ . 1 . 2]" 1
1293 1 57 ASP HA 1 129 LYS HG3 3.549 . 5.124 4.064 3.613 5.231 0.107 14 0 "[ . 1 . 2]" 1
1294 1 126 LYS HA 1 129 LYS HG3 2.536 . 3.340 3.170 2.031 3.413 0.073 9 0 "[ . 1 . 2]" 1
1295 1 129 LYS QE 1 129 LYS HG3 2.663 . 3.549 3.138 2.201 3.309 . 0 0 "[ . 1 . 2]" 1
1296 1 126 LYS HA 1 129 LYS HG2 2.529 . 3.328 2.001 1.641 3.490 0.162 14 0 "[ . 1 . 2]" 1
1297 1 129 LYS QB 1 129 LYS HG2 2.351 . 3.042 2.314 2.259 2.522 . 0 0 "[ . 1 . 2]" 1
1298 1 31 VAL QG 1 32 SER H 2.977 . 3.501 2.869 2.770 2.938 . 0 0 "[ . 1 . 2]" 1
1299 1 31 VAL H 1 31 VAL QG 2.070 . 2.606 2.041 1.946 2.146 . 0 0 "[ . 1 . 2]" 1
1300 1 31 VAL HA 1 31 VAL QG 2.034 . 2.551 2.135 2.116 2.163 . 0 0 "[ . 1 . 2]" 1
1301 1 31 VAL HB 1 31 VAL QG 1.984 . 2.476 1.896 1.891 1.899 . 0 0 "[ . 1 . 2]" 1
1302 1 31 VAL MG1 1 31 VAL MG2 1.834 . 2.254 2.082 2.057 2.094 . 0 0 "[ . 1 . 2]" 1
1303 1 76 LEU MD2 1 107 TYR HA 2.720 . 3.645 3.584 3.003 3.745 0.100 14 0 "[ . 1 . 2]" 1
1304 1 44 ILE HA 1 76 LEU MD2 3.219 . 4.514 4.502 4.385 4.609 0.095 14 0 "[ . 1 . 2]" 1
1305 1 46 ILE H 1 76 LEU MD2 2.413 . 3.141 3.035 2.488 3.219 0.078 20 0 "[ . 1 . 2]" 1
1306 1 76 LEU HB3 1 76 LEU MD2 1.864 . 2.299 2.307 2.275 2.342 0.043 1 0 "[ . 1 . 2]" 1
1307 1 51 TYR QD 1 53 THR MG 2.305 . 2.969 2.818 2.031 3.872 0.903 9 8 "[* ** -+* * . * 2]" 1
1308 1 53 THR HA 1 53 THR MG 2.366 . 3.066 2.327 2.290 2.384 . 0 0 "[ . 1 . 2]" 1
1309 1 43 VAL HA 1 53 THR MG 2.381 . 3.090 2.009 1.801 2.173 . 0 0 "[ . 1 . 2]" 1
1310 1 43 VAL HB 1 53 THR MG 2.711 . 3.630 3.745 3.676 3.806 0.176 19 0 "[ . 1 . 2]" 1
1311 1 43 VAL MG2 1 53 THR MG 2.094 . 2.642 1.723 1.540 1.892 0.006 5 0 "[ . 1 . 2]" 1
1312 1 75 GLU HB3 1 76 LEU MD2 3.582 . 5.186 3.920 3.433 4.275 . 0 0 "[ . 1 . 2]" 1
1313 1 85 LEU QD 1 86 LYS H 2.197 . 2.800 2.841 2.797 2.872 0.072 6 0 "[ . 1 . 2]" 1
1314 1 85 LEU HA 1 85 LEU QD 2.022 . 2.533 2.140 1.985 2.211 . 0 0 "[ . 1 . 2]" 1
1315 1 85 LEU QD 1 98 TYR HB2 3.079 . 4.264 2.148 1.870 2.329 0.024 6 0 "[ . 1 . 2]" 1
1316 1 85 LEU QD 1 90 ILE HG13 2.450 . 3.201 2.785 2.455 2.991 . 0 0 "[ . 1 . 2]" 1
1317 1 96 GLY HA3 1 110 LEU QD 2.731 . 3.664 3.291 2.705 3.717 0.053 16 0 "[ . 1 . 2]" 1
1318 1 43 VAL H 1 43 VAL MG2 2.213 . 2.825 2.090 1.979 2.192 . 0 0 "[ . 1 . 2]" 1
1319 1 43 VAL MG2 1 71 ILE H 3.060 . 4.230 3.846 3.548 4.056 . 0 0 "[ . 1 . 2]" 1
1320 1 43 VAL MG2 1 51 TYR QD 2.518 . 3.310 2.999 2.654 3.384 0.074 8 0 "[ . 1 . 2]" 1
1321 1 43 VAL MG2 1 51 TYR HE2 3.240 . 4.552 4.123 3.444 4.649 0.097 8 0 "[ . 1 . 2]" 1
1322 1 43 VAL HA 1 43 VAL MG2 2.352 . 3.044 2.405 2.354 2.470 . 0 0 "[ . 1 . 2]" 1
1323 1 42 ILE HA 1 43 VAL MG2 2.841 . 3.850 3.823 3.685 3.901 0.051 19 0 "[ . 1 . 2]" 1
1324 1 43 VAL HB 1 43 VAL MG2 2.158 . 2.740 2.126 2.121 2.131 . 0 0 "[ . 1 . 2]" 1
1325 1 43 VAL MG2 1 66 VAL MG1 2.041 . 2.562 2.357 2.081 2.567 0.005 18 0 "[ . 1 . 2]" 1
1326 1 26 LEU QD 1 27 THR H 2.539 . 3.345 3.052 2.766 3.296 . 0 0 "[ . 1 . 2]" 1
1327 1 27 THR H 1 27 THR MG 2.086 . 2.630 2.338 2.077 2.646 0.016 18 0 "[ . 1 . 2]" 1
1328 1 27 THR MG 1 30 GLU H 3.588 . 5.197 4.583 3.970 4.925 . 0 0 "[ . 1 . 2]" 1
1329 1 26 LEU HA 1 27 THR MG 3.127 . 4.349 3.675 3.542 3.893 . 0 0 "[ . 1 . 2]" 1
1330 1 27 THR MG 1 28 PRO HD2 2.736 . 3.672 3.094 2.734 3.358 . 0 0 "[ . 1 . 2]" 1
1331 1 27 THR MG 1 30 GLU QG 2.669 . 3.559 3.527 3.255 3.747 0.188 11 0 "[ . 1 . 2]" 1
1332 1 121 THR MG 1 122 LYS H 2.607 . 3.457 3.521 3.410 3.599 0.142 19 0 "[ . 1 . 2]" 1
1333 1 121 THR H 1 121 THR MG 2.121 . 2.683 2.447 2.347 2.547 . 0 0 "[ . 1 . 2]" 1
1334 1 121 THR MG 1 123 GLU H 3.071 . 4.250 4.097 4.004 4.270 0.020 15 0 "[ . 1 . 2]" 1
1335 1 120 ARG HA 1 121 THR MG 2.864 . 3.889 3.997 3.946 4.067 0.178 18 0 "[ . 1 . 2]" 1
1336 1 121 THR HA 1 121 THR MG 2.191 . 2.791 2.254 2.219 2.296 . 0 0 "[ . 1 . 2]" 1
1337 1 91 VAL QG 1 106 TYR QD 2.622 . 3.481 3.969 2.485 4.155 0.674 9 14 "[** ** **+1 ***. -***]" 1
1338 1 91 VAL H 1 91 VAL QG 2.225 . 2.844 2.239 2.136 2.370 . 0 0 "[ . 1 . 2]" 1
1339 1 91 VAL QG 1 101 LYS H 2.406 . 3.130 2.251 2.097 2.414 . 0 0 "[ . 1 . 2]" 1
1340 1 91 VAL QG 1 92 ASN H 2.681 . 3.340 3.274 3.150 3.371 0.031 11 0 "[ . 1 . 2]" 1
1341 1 91 VAL QG 1 100 ILE HA 2.360 . 3.056 2.806 2.384 2.998 . 0 0 "[ . 1 . 2]" 1
1342 1 90 ILE HA 1 91 VAL QG 2.818 . 3.810 3.670 3.549 3.765 . 0 0 "[ . 1 . 2]" 1
1343 1 91 VAL HB 1 91 VAL QG 2.013 . 2.519 1.894 1.889 1.895 . 0 0 "[ . 1 . 2]" 1
1344 1 91 VAL QG 1 101 LYS HB3 2.288 . 2.943 2.421 2.188 2.572 . 0 0 "[ . 1 . 2]" 1
1345 1 52 VAL QG 1 61 TYR HD1 2.285 . 2.937 3.035 2.857 3.126 0.189 4 0 "[ . 1 . 2]" 1
1346 1 99 VAL HA 1 99 VAL QG 2.840 . 3.814 2.357 2.136 2.437 . 0 0 "[ . 1 . 2]" 1
1347 1 99 VAL HB 1 99 VAL QG 2.088 . 2.569 1.890 1.882 1.895 . 0 0 "[ . 1 . 2]" 1
1348 1 46 ILE MD 1 99 VAL QG 2.125 . 2.689 1.915 1.675 2.319 . 0 0 "[ . 1 . 2]" 1
1349 1 46 ILE MG 1 99 VAL QG 2.204 . 2.811 2.305 1.721 2.475 . 0 0 "[ . 1 . 2]" 1
1350 1 92 ASN HD21 1 99 VAL QG 3.115 . 4.328 2.158 1.969 3.756 . 0 0 "[ . 1 . 2]" 1
1351 1 92 ASN HD22 1 99 VAL QG 2.547 . 3.358 3.327 2.041 3.489 0.131 2 0 "[ . 1 . 2]" 1
1352 1 66 VAL HB 1 99 VAL QG 2.019 . 2.529 2.126 1.772 2.512 . 0 0 "[ . 1 . 2]" 1
1353 1 99 VAL MG1 1 99 VAL MG2 1.807 . 2.215 2.085 2.049 2.094 . 0 0 "[ . 1 . 2]" 1
1354 1 94 ILE MG 1 99 VAL QG 1.810 . 2.219 2.219 1.934 2.380 0.161 2 0 "[ . 1 . 2]" 1
1355 1 43 VAL MG1 1 44 ILE H 2.379 . 3.086 3.058 2.984 3.122 0.036 18 0 "[ . 1 . 2]" 1
1356 1 43 VAL MG1 1 45 LYS H 2.264 . 2.905 2.716 2.581 2.860 . 0 0 "[ . 1 . 2]" 1
1357 1 43 VAL HA 1 43 VAL MG1 2.285 . 2.938 2.366 2.317 2.394 . 0 0 "[ . 1 . 2]" 1
1358 1 43 VAL MG1 1 51 TYR HB2 2.625 . 3.486 1.957 1.732 2.360 0.032 16 0 "[ . 1 . 2]" 1
1359 1 100 ILE H 1 108 VAL MG2 3.223 . 4.521 3.611 3.397 3.777 . 0 0 "[ . 1 . 2]" 1
1360 1 99 VAL HA 1 108 VAL MG2 3.065 . 4.239 2.325 2.118 2.529 . 0 0 "[ . 1 . 2]" 1
1361 1 108 VAL HB 1 108 VAL MG2 1.885 . 2.329 2.132 2.125 2.138 . 0 0 "[ . 1 . 2]" 1
1362 1 72 ILE HG13 1 108 VAL MG2 2.298 . 2.958 2.164 1.862 2.520 . 0 0 "[ . 1 . 2]" 1
1363 1 94 ILE MD 1 108 VAL MG2 1.977 . 2.466 2.647 2.558 2.728 0.262 20 0 "[ . 1 . 2]" 1
1364 1 47 THR H 1 47 THR MG 2.419 . 3.151 3.135 2.934 3.218 0.067 5 0 "[ . 1 . 2]" 1
1365 1 47 THR HB 1 47 THR MG 2.461 . 3.218 2.134 2.126 2.139 . 0 0 "[ . 1 . 2]" 1
1366 1 46 ILE HA 1 47 THR MG 3.073 . 4.254 3.868 3.733 4.212 . 0 0 "[ . 1 . 2]" 1
1367 1 45 LYS QD 1 47 THR MG 2.336 . 3.018 2.767 1.733 3.089 0.071 15 0 "[ . 1 . 2]" 1
1368 1 45 LYS HG3 1 47 THR MG 2.445 . 3.192 3.393 3.228 3.909 0.717 1 2 "[+ . 1 . - 2]" 1
1369 1 108 VAL MG1 1 109 TYR H 2.412 . 3.139 3.043 2.827 3.206 0.067 6 0 "[ . 1 . 2]" 1
1370 1 98 TYR H 1 108 VAL MG1 3.121 . 4.338 3.028 2.805 3.372 . 0 0 "[ . 1 . 2]" 1
1371 1 108 VAL H 1 108 VAL MG1 2.856 . 3.875 3.819 3.793 3.840 . 0 0 "[ . 1 . 2]" 1
1372 1 108 VAL MG1 1 110 LEU H 3.131 . 4.357 3.934 3.738 4.389 0.032 4 0 "[ . 1 . 2]" 1
1373 1 108 VAL HA 1 108 VAL MG1 2.482 . 3.252 2.468 2.424 2.506 . 0 0 "[ . 1 . 2]" 1
1374 1 97 GLY HA3 1 108 VAL MG1 3.121 . 4.338 2.655 2.455 3.129 . 0 0 "[ . 1 . 2]" 1
1375 1 108 VAL MG1 1 109 TYR QB 3.610 . 5.239 4.267 3.932 4.513 . 0 0 "[ . 1 . 2]" 1
1376 1 108 VAL HB 1 108 VAL MG1 2.033 . 2.550 2.134 2.126 2.138 . 0 0 "[ . 1 . 2]" 1
1377 1 72 ILE HG13 1 108 VAL MG1 2.428 . 3.165 1.989 1.681 2.197 0.010 2 0 "[ . 1 . 2]" 1
1378 1 94 ILE MD 1 108 VAL MG1 1.864 . 2.298 1.818 1.611 1.922 . 0 0 "[ . 1 . 2]" 1
1379 1 66 VAL H 1 66 VAL MG1 2.764 . 3.719 3.769 3.751 3.785 0.066 17 0 "[ . 1 . 2]" 1
1380 1 66 VAL MG1 1 67 PRO HD3 2.535 . 3.338 3.393 3.345 3.434 0.096 18 0 "[ . 1 . 2]" 1
1381 1 66 VAL HA 1 66 VAL MG1 2.229 . 2.850 2.323 2.282 2.382 . 0 0 "[ . 1 . 2]" 1
1382 1 66 VAL HB 1 66 VAL MG1 2.063 . 2.595 2.125 2.122 2.128 . 0 0 "[ . 1 . 2]" 1
1383 1 102 VAL QG 1 103 ASP H 3.214 . 3.508 3.103 3.028 3.196 . 0 0 "[ . 1 . 2]" 1
1384 1 102 VAL QG 1 107 TYR QE 2.364 . 2.816 1.771 1.638 1.877 0.027 5 0 "[ . 1 . 2]" 1
1385 1 89 ASP HB3 1 102 VAL QG 2.330 . 3.009 2.035 1.706 2.961 . 0 0 "[ . 1 . 2]" 1
1386 1 102 VAL HB 1 102 VAL QG 2.002 . 2.214 1.889 1.888 1.892 . 0 0 "[ . 1 . 2]" 1
1387 1 100 ILE HB 1 102 VAL QG 2.618 . 3.475 2.444 2.288 2.581 . 0 0 "[ . 1 . 2]" 1
1388 1 102 VAL MG1 1 102 VAL MG2 1.756 . 2.142 2.060 2.046 2.073 . 0 0 "[ . 1 . 2]" 1
1389 1 65 LYS QD 1 91 VAL QG 2.222 . 2.839 2.467 1.918 2.816 . 0 0 "[ . 1 . 2]" 1
1390 1 71 ILE HB 1 71 ILE MG 2.107 . 2.662 2.123 2.115 2.131 . 0 0 "[ . 1 . 2]" 1
1391 1 71 ILE HG12 1 71 ILE MG 2.505 . 3.289 3.193 3.171 3.203 . 0 0 "[ . 1 . 2]" 1
1392 1 42 ILE HA 1 71 ILE MG 2.923 . 3.991 2.907 2.398 3.232 . 0 0 "[ . 1 . 2]" 1
1393 1 39 ALA MB 1 55 HIS HB2 2.679 . 3.576 3.201 2.797 3.555 . 0 0 "[ . 1 . 2]" 1
1394 1 37 ILE MD 1 39 ALA MB 2.359 . 3.055 3.013 2.667 3.246 0.191 11 0 "[ . 1 . 2]" 1
1395 1 70 ALA MB 1 71 ILE H 2.146 . 2.722 2.497 2.214 2.754 0.032 7 0 "[ . 1 . 2]" 1
1396 1 70 ALA H 1 70 ALA MB 1.949 . 2.424 2.240 2.165 2.266 . 0 0 "[ . 1 . 2]" 1
1397 1 70 ALA HA 1 70 ALA MB 1.903 . 2.356 2.121 2.104 2.127 . 0 0 "[ . 1 . 2]" 1
1398 1 67 PRO HD3 1 70 ALA MB 2.674 . 3.568 3.406 3.195 3.538 . 0 0 "[ . 1 . 2]" 1
1399 1 67 PRO HD2 1 70 ALA MB 2.228 . 2.848 2.052 1.758 2.263 . 0 0 "[ . 1 . 2]" 1
1400 1 67 PRO HG3 1 70 ALA MB 2.309 . 2.975 3.075 3.013 3.161 0.186 20 0 "[ . 1 . 2]" 1
1401 1 66 VAL MG1 1 70 ALA MB 1.716 . 2.084 1.824 1.769 1.918 . 0 0 "[ . 1 . 2]" 1
1402 1 31 VAL QG 1 41 GLN HE21 2.713 . 3.633 2.976 2.532 3.602 . 0 0 "[ . 1 . 2]" 1
1403 1 31 VAL QG 1 41 GLN HE22 2.543 . 3.351 2.915 2.142 3.581 0.230 15 0 "[ . 1 . 2]" 1
1404 1 31 VAL QG 1 35 GLU HG2 2.702 . 3.614 3.219 2.588 3.512 . 0 0 "[ . 1 . 2]" 1
1405 1 116 ALA H 1 116 ALA MB 2.188 . 2.786 2.908 2.875 2.929 0.143 14 0 "[ . 1 . 2]" 1
1406 1 116 ALA MB 1 119 ILE H 2.658 . 3.541 2.941 2.282 3.418 . 0 0 "[ . 1 . 2]" 1
1407 1 110 LEU QD 1 116 ALA MB 1.922 . 2.384 3.927 3.466 4.188 1.804 16 20 [***************+*-**] 1
1408 1 23 ALA MB 1 61 TYR HB3 2.824 . 3.821 3.660 3.216 3.843 0.022 15 0 "[ . 1 . 2]" 1
1409 1 23 ALA HA 1 23 ALA MB 2.017 . 2.525 2.129 2.116 2.140 . 0 0 "[ . 1 . 2]" 1
1410 1 19 ALA HA 1 19 ALA MB 1.891 . 2.338 2.127 2.106 2.137 . 0 0 "[ . 1 . 2]" 1
1411 1 19 ALA MB 1 20 GLY HA2 3.089 . 4.282 4.289 3.696 5.060 0.778 5 4 "[ - *+ *1 . 2]" 1
1412 1 44 ILE MG 1 54 SER H 2.766 . 3.722 2.513 2.288 2.732 . 0 0 "[ . 1 . 2]" 1
1413 1 44 ILE MG 1 73 SER H 3.149 . 4.388 3.974 3.819 4.251 . 0 0 "[ . 1 . 2]" 1
1414 1 44 ILE HA 1 44 ILE MG 2.751 . 3.697 2.255 2.173 2.290 . 0 0 "[ . 1 . 2]" 1
1415 1 44 ILE HB 1 44 ILE MG 2.060 . 2.590 2.127 2.122 2.132 . 0 0 "[ . 1 . 2]" 1
1416 1 44 ILE MG 1 125 ILE MD 1.887 . 2.332 2.211 1.915 2.392 0.060 7 0 "[ . 1 . 2]" 1
1417 1 42 ILE MG 1 44 ILE MG 2.458 . 3.213 2.719 2.496 2.931 . 0 0 "[ . 1 . 2]" 1
1418 1 110 LEU QD 1 113 ALA MB 2.225 . 2.844 2.695 2.439 2.870 0.026 12 0 "[ . 1 . 2]" 1
1419 1 113 ALA H 1 113 ALA MB 2.079 . 2.619 2.252 2.216 2.273 . 0 0 "[ . 1 . 2]" 1
1420 1 113 ALA MB 1 114 ALA H 2.467 . 3.227 3.124 2.809 3.243 0.016 6 0 "[ . 1 . 2]" 1
1421 1 112 ASP HA 1 113 ALA MB 3.021 . 4.162 4.149 3.994 4.291 0.129 19 0 "[ . 1 . 2]" 1
1422 1 113 ALA HA 1 113 ALA MB 1.791 . 2.192 2.125 2.118 2.128 . 0 0 "[ . 1 . 2]" 1
1423 1 112 ASP HA 1 114 ALA MB 3.252 . 4.574 4.263 4.025 4.610 0.036 18 0 "[ . 1 . 2]" 1
1424 1 114 ALA H 1 114 ALA MB 1.982 . 2.473 2.282 2.236 2.335 . 0 0 "[ . 1 . 2]" 1
1425 1 114 ALA HA 1 114 ALA MB 1.743 . 2.123 2.124 2.118 2.129 0.006 14 0 "[ . 1 . 2]" 1
1426 1 94 ILE MG 1 99 VAL H 2.931 . 4.005 3.177 2.992 3.432 . 0 0 "[ . 1 . 2]" 1
1427 1 94 ILE H 1 94 ILE MG 2.642 . 3.514 2.940 2.819 3.066 . 0 0 "[ . 1 . 2]" 1
1428 1 92 ASN HD21 1 94 ILE MG 2.549 . 3.361 2.440 2.032 3.522 0.161 2 0 "[ . 1 . 2]" 1
1429 1 92 ASN HD22 1 94 ILE MG 2.389 . 3.102 2.773 2.178 3.122 0.020 8 0 "[ . 1 . 2]" 1
1430 1 94 ILE HA 1 94 ILE MG 2.180 . 2.774 2.288 2.246 2.323 . 0 0 "[ . 1 . 2]" 1
1431 1 68 TYR HA 1 94 ILE MG 2.283 . 2.934 2.579 2.167 2.950 0.016 4 0 "[ . 1 . 2]" 1
1432 1 94 ILE MG 1 99 VAL HB 3.208 . 4.494 3.211 2.864 3.895 . 0 0 "[ . 1 . 2]" 1
1433 1 94 ILE HB 1 94 ILE MG 1.952 . 2.428 2.126 2.122 2.130 . 0 0 "[ . 1 . 2]" 1
1434 1 94 ILE HG12 1 94 ILE MG 2.111 . 2.668 2.474 2.458 2.495 . 0 0 "[ . 1 . 2]" 1
1435 1 72 ILE MG 1 119 ILE HA 3.562 . 5.148 4.355 4.201 4.683 . 0 0 "[ . 1 . 2]" 1
1436 1 72 ILE H 1 72 ILE MG 2.814 . 3.804 3.860 3.838 3.882 0.078 6 0 "[ . 1 . 2]" 1
1437 1 72 ILE MG 1 76 LEU H 2.887 . 3.929 3.428 3.218 3.669 . 0 0 "[ . 1 . 2]" 1
1438 1 43 VAL HB 1 72 ILE MG 2.591 . 3.430 2.836 2.589 3.121 . 0 0 "[ . 1 . 2]" 1
1439 1 72 ILE HB 1 72 ILE MG 1.938 . 2.407 2.128 2.126 2.131 . 0 0 "[ . 1 . 2]" 1
1440 1 72 ILE MG 1 76 LEU HB3 2.158 . 2.740 3.173 2.813 3.498 0.758 4 9 "[ +.** *1** -* *]" 1
1441 1 72 ILE HG13 1 72 ILE MG 2.130 . 2.697 2.458 2.404 2.494 . 0 0 "[ . 1 . 2]" 1
1442 1 72 ILE MD 1 72 ILE MG 2.000 . 2.500 1.884 1.737 1.933 . 0 0 "[ . 1 . 2]" 1
1443 1 91 VAL H 1 100 ILE MG 2.412 . 3.139 3.038 2.843 3.253 0.114 6 0 "[ . 1 . 2]" 1
1444 1 100 ILE MG 1 101 LYS H 2.669 . 3.559 3.641 3.598 3.690 0.131 6 0 "[ . 1 . 2]" 1
1445 1 100 ILE HA 1 100 ILE MG 2.213 . 2.825 2.265 2.238 2.305 . 0 0 "[ . 1 . 2]" 1
1446 1 100 ILE MG 1 109 TYR QB 2.753 . 3.526 2.852 2.709 3.059 . 0 0 "[ . 1 . 2]" 1
1447 1 100 ILE HB 1 100 ILE MG 2.044 . 2.566 2.125 2.122 2.128 . 0 0 "[ . 1 . 2]" 1
1448 1 85 LEU QD 1 100 ILE MG 1.855 . 2.285 1.967 1.857 2.087 . 0 0 "[ . 1 . 2]" 1
1449 1 74 GLU H 1 119 ILE MG 2.476 . 3.242 2.908 2.558 3.210 . 0 0 "[ . 1 . 2]" 1
1450 1 119 ILE MG 1 120 ARG H 2.172 . 2.762 2.802 2.655 2.891 0.129 12 0 "[ . 1 . 2]" 1
1451 1 119 ILE H 1 119 ILE MG 2.716 . 3.638 3.827 3.798 3.901 0.263 20 0 "[ . 1 . 2]" 1
1452 1 74 GLU HA 1 119 ILE MG 2.140 . 2.713 2.062 1.872 2.360 . 0 0 "[ . 1 . 2]" 1
1453 1 74 GLU HB2 1 119 ILE MG 2.201 . 2.807 2.937 2.813 3.331 0.524 16 1 "[ . 1 .+ 2]" 1
1454 1 119 ILE HB 1 119 ILE MG 1.825 . 2.241 2.125 2.118 2.134 . 0 0 "[ . 1 . 2]" 1
1455 1 46 ILE MG 1 47 THR H 2.268 . 2.911 2.397 2.072 2.847 . 0 0 "[ . 1 . 2]" 1
1456 1 46 ILE H 1 46 ILE MG 3.184 . 4.451 3.938 3.880 3.965 . 0 0 "[ . 1 . 2]" 1
1457 1 46 ILE MG 1 51 TYR HA 3.024 . 4.167 3.665 3.191 4.220 0.053 15 0 "[ . 1 . 2]" 1
1458 1 46 ILE HA 1 46 ILE MG 2.253 . 2.887 2.190 2.146 2.349 . 0 0 "[ . 1 . 2]" 1
1459 1 46 ILE MG 1 51 TYR HB3 2.730 . 3.661 2.483 2.000 3.194 . 0 0 "[ . 1 . 2]" 1
1460 1 46 ILE MG 1 106 TYR HB3 2.946 . 4.031 2.888 2.415 3.272 . 0 0 "[ . 1 . 2]" 1
1461 1 46 ILE HG12 1 46 ILE MG 2.411 . 3.138 2.327 2.293 2.371 . 0 0 "[ . 1 . 2]" 1
1462 1 46 ILE HB 1 46 ILE MG 1.934 . 2.402 2.120 2.112 2.127 . 0 0 "[ . 1 . 2]" 1
1463 1 43 VAL MG1 1 46 ILE MG 2.491 . 3.267 3.124 2.706 3.358 0.091 15 0 "[ . 1 . 2]" 1
1464 1 14 ILE HA 1 14 ILE MG 2.466 . 3.226 2.724 2.334 3.224 . 0 0 "[ . 1 . 2]" 1
1465 1 14 ILE MG 1 15 ASP QB 2.481 . 3.251 2.900 2.487 3.514 0.263 20 0 "[ . 1 . 2]" 1
1466 1 37 ILE H 1 37 ILE MG 2.575 . 3.404 2.444 2.217 3.539 0.135 11 0 "[ . 1 . 2]" 1
1467 1 37 ILE HB 1 37 ILE MG 2.082 . 2.624 2.114 2.111 2.121 . 0 0 "[ . 1 . 2]" 1
1468 1 37 ILE HG12 1 37 ILE MG 2.614 . 3.468 2.455 2.395 3.064 . 0 0 "[ . 1 . 2]" 1
1469 1 90 ILE MG 1 91 VAL H 2.361 . 3.058 3.020 2.741 3.189 0.131 7 0 "[ . 1 . 2]" 1
1470 1 90 ILE MG 1 92 ASN H 2.355 . 3.048 2.724 2.483 3.058 0.010 8 0 "[ . 1 . 2]" 1
1471 1 90 ILE H 1 90 ILE MG 2.762 . 3.716 3.742 3.724 3.760 0.044 3 0 "[ . 1 . 2]" 1
1472 1 90 ILE HA 1 90 ILE MG 2.317 . 2.988 2.436 2.387 2.477 . 0 0 "[ . 1 . 2]" 1
1473 1 90 ILE MG 1 98 TYR HB3 2.530 . 3.330 3.218 2.842 3.380 0.050 8 0 "[ . 1 . 2]" 1
1474 1 90 ILE HB 1 90 ILE MG 1.982 . 2.473 2.129 2.127 2.133 . 0 0 "[ . 1 . 2]" 1
1475 1 42 ILE MG 1 74 GLU H 3.287 . 4.637 4.480 4.174 4.702 0.065 7 0 "[ . 1 . 2]" 1
1476 1 42 ILE MG 1 73 SER H 2.478 . 3.246 3.018 2.769 3.262 0.016 2 0 "[ . 1 . 2]" 1
1477 1 42 ILE MD 1 42 ILE MG 1.832 . 2.251 1.996 1.927 2.094 . 0 0 "[ . 1 . 2]" 1
1478 1 42 ILE MG 1 125 ILE HA 3.378 . 4.804 3.879 3.311 4.346 . 0 0 "[ . 1 . 2]" 1
1479 1 44 ILE MD 1 54 SER H 3.181 . 4.446 3.601 3.376 3.799 . 0 0 "[ . 1 . 2]" 1
1480 1 44 ILE MD 1 45 LYS H 2.888 . 3.930 3.969 3.728 4.029 0.099 16 0 "[ . 1 . 2]" 1
1481 1 44 ILE MD 1 59 TYR HE1 2.214 . 2.827 2.907 2.815 2.985 0.158 16 0 "[ . 1 . 2]" 1
1482 1 44 ILE MD 1 54 SER HB2 2.930 . 4.003 2.381 1.721 3.674 0.136 19 0 "[ . 1 . 2]" 1
1483 1 44 ILE MD 1 52 VAL HB 2.511 . 3.299 3.476 3.204 3.725 0.426 18 0 "[ . 1 . 2]" 1
1484 1 44 ILE MD 1 45 LYS HB3 2.856 . 3.875 4.087 3.933 4.366 0.491 17 0 "[ . 1 . 2]" 1
1485 1 44 ILE MD 1 44 ILE HG13 1.972 . 2.458 2.111 2.106 2.114 . 0 0 "[ . 1 . 2]" 1
1486 1 44 ILE H 1 44 ILE MD 2.666 . 3.554 3.628 3.583 3.676 0.122 4 0 "[ . 1 . 2]" 1
1487 1 44 ILE HB 1 44 ILE MD 2.165 . 2.751 2.372 2.300 2.423 . 0 0 "[ . 1 . 2]" 1
1488 1 46 ILE MD 1 106 TYR QD 3.331 . 4.718 2.332 1.996 4.612 . 0 0 "[ . 1 . 2]" 1
1489 1 46 ILE MD 1 107 TYR HA 3.040 . 4.195 3.220 2.987 3.612 . 0 0 "[ . 1 . 2]" 1
1490 1 46 ILE MD 1 106 TYR HB2 2.663 . 3.550 3.500 3.292 4.120 0.570 15 1 "[ . 1 + 2]" 1
1491 1 46 ILE MD 1 106 TYR HB3 2.990 . 4.108 1.974 1.770 3.163 0.102 14 0 "[ . 1 . 2]" 1
1492 1 46 ILE MD 1 46 ILE HG12 1.956 . 2.434 2.118 2.114 2.122 . 0 0 "[ . 1 . 2]" 1
1493 1 46 ILE HB 1 46 ILE MD 1.928 . 2.393 2.316 2.278 2.395 0.002 15 0 "[ . 1 . 2]" 1
1494 1 46 ILE MD 1 46 ILE MG 1.888 . 2.334 1.942 1.886 1.982 . 0 0 "[ . 1 . 2]" 1
1495 1 78 MET ME 1 83 TYR QE 2.751 . 3.697 3.001 2.641 3.556 . 0 0 "[ . 1 . 2]" 1
1496 1 78 MET HA 1 78 MET ME 2.806 . 3.790 3.752 3.224 3.918 0.128 4 0 "[ . 1 . 2]" 1
1497 1 78 MET ME 1 83 TYR QB 2.544 . 3.353 3.152 2.941 3.321 . 0 0 "[ . 1 . 2]" 1
1498 1 78 MET ME 1 78 MET QG 2.472 . 2.630 2.231 2.169 2.320 . 0 0 "[ . 1 . 2]" 1
1499 1 78 MET HB2 1 78 MET ME 2.291 . 2.947 2.569 2.142 3.068 0.121 17 0 "[ . 1 . 2]" 1
1500 1 78 MET ME 1 100 ILE QG 2.542 . 3.350 3.294 2.991 3.392 0.042 14 0 "[ . 1 . 2]" 1
1501 1 94 ILE MD 1 97 GLY HA3 3.593 . 5.206 3.224 2.924 3.558 . 0 0 "[ . 1 . 2]" 1
1502 1 94 ILE MD 1 98 TYR H 3.266 . 4.599 4.147 3.700 4.491 . 0 0 "[ . 1 . 2]" 1
1503 1 94 ILE MD 1 95 LYS H 2.819 . 3.812 3.870 3.830 3.920 0.108 20 0 "[ . 1 . 2]" 1
1504 1 94 ILE HA 1 94 ILE MD 2.959 . 4.054 4.163 4.151 4.176 0.122 20 0 "[ . 1 . 2]" 1
1505 1 100 ILE H 1 100 ILE MD 2.999 . 4.123 3.825 3.766 3.866 . 0 0 "[ . 1 . 2]" 1
1506 1 125 ILE MD 1 126 LYS H 2.901 . 3.953 4.562 4.364 4.748 0.795 7 17 "[******+ *** ****** -]" 1
1507 1 73 SER HA 1 125 ILE MD 2.559 . 3.377 2.421 1.953 2.912 . 0 0 "[ . 1 . 2]" 1
1508 1 122 LYS HA 1 125 ILE MD 2.075 . 2.613 2.006 1.769 2.374 . 0 0 "[ . 1 . 2]" 1
1509 1 125 ILE MD 1 125 ILE HG12 1.875 . 2.315 2.119 2.113 2.122 . 0 0 "[ . 1 . 2]" 1
1510 1 122 LYS QG 1 125 ILE MD 2.590 . 3.428 2.745 2.128 3.393 . 0 0 "[ . 1 . 2]" 1
1511 1 74 GLU H 1 125 ILE MD 2.829 . 3.829 3.186 2.761 3.582 . 0 0 "[ . 1 . 2]" 1
1512 1 42 ILE MD 1 128 GLN QE 2.751 . 3.692 3.077 2.355 3.646 . 0 0 "[ . 1 . 2]" 1
1513 1 42 ILE MD 1 125 ILE HA 2.413 . 3.141 2.726 2.331 3.086 . 0 0 "[ . 1 . 2]" 1
1514 1 42 ILE MD 1 128 GLN QG 3.035 . 4.187 2.777 2.258 3.179 . 0 0 "[ . 1 . 2]" 1
1515 1 42 ILE MD 1 125 ILE HG12 2.309 . 2.975 2.501 1.768 3.041 0.066 12 0 "[ . 1 . 2]" 1
1516 1 42 ILE MD 1 42 ILE QG 2.045 . 2.217 1.884 1.881 1.887 . 0 0 "[ . 1 . 2]" 1
1517 1 42 ILE MD 1 120 ARG HG2 2.287 . 2.941 2.749 1.462 3.411 0.470 9 0 "[ . 1 . 2]" 1
1518 1 42 ILE MD 1 120 ARG HA 3.612 . 5.243 4.731 4.461 5.159 . 0 0 "[ . 1 . 2]" 1
1519 1 94 ILE MD 1 98 TYR HA 3.360 . 4.771 4.083 3.866 4.291 . 0 0 "[ . 1 . 2]" 1
1520 1 72 ILE HG13 1 94 ILE MD 2.549 . 3.361 2.172 2.002 2.503 . 0 0 "[ . 1 . 2]" 1
1521 1 94 ILE MD 1 94 ILE HG12 1.726 . 2.098 2.116 2.114 2.120 0.022 20 0 "[ . 1 . 2]" 1
1522 1 100 ILE MD 1 107 TYR QD 3.013 . 4.148 3.574 3.496 3.642 . 0 0 "[ . 1 . 2]" 1
1523 1 83 TYR QE 1 100 ILE MD 2.492 . 3.269 2.446 2.139 2.762 . 0 0 "[ . 1 . 2]" 1
1524 1 100 ILE MD 1 107 TYR HB2 2.577 . 3.407 2.483 2.300 2.638 . 0 0 "[ . 1 . 2]" 1
1525 1 37 ILE MD 1 57 ASP H 3.268 . 4.603 2.684 2.454 2.873 . 0 0 "[ . 1 . 2]" 1
1526 1 37 ILE MD 1 56 GLY HA3 3.002 . 4.128 1.619 1.224 1.874 0.652 13 1 "[ . 1 + . 2]" 1
1527 1 37 ILE MD 1 57 ASP QB 2.869 . 3.898 3.780 3.334 3.935 0.037 10 0 "[ . 1 . 2]" 1
1528 1 35 GLU HG3 1 37 ILE MD 3.131 . 4.356 3.879 3.408 4.486 0.130 14 0 "[ . 1 . 2]" 1
1529 1 37 ILE HB 1 37 ILE MD 2.376 . 3.082 2.484 2.411 3.099 0.017 11 0 "[ . 1 . 2]" 1
1530 1 37 ILE MD 1 37 ILE HG12 2.098 . 2.648 2.119 2.111 2.123 . 0 0 "[ . 1 . 2]" 1
1531 1 37 ILE MD 1 37 ILE MG 2.028 . 2.542 1.808 1.750 1.860 . 0 0 "[ . 1 . 2]" 1
1532 1 14 ILE HB 1 14 ILE MD 2.652 . 3.531 2.670 2.390 3.240 . 0 0 "[ . 1 . 2]" 1
1533 1 14 ILE MD 1 14 ILE HG13 2.117 . 2.677 2.120 2.118 2.121 . 0 0 "[ . 1 . 2]" 1
1534 1 14 ILE HA 1 14 ILE MD 3.120 . 4.337 3.103 1.897 3.865 0.006 9 0 "[ . 1 . 2]" 1
1535 1 89 ASP H 1 90 ILE MD 3.071 . 4.250 4.337 4.277 4.404 0.154 16 0 "[ . 1 . 2]" 1
1536 1 90 ILE H 1 90 ILE MD 2.542 . 3.350 3.354 3.277 3.426 0.076 2 0 "[ . 1 . 2]" 1
1537 1 90 ILE HB 1 90 ILE MD 2.066 . 2.600 2.331 2.310 2.348 . 0 0 "[ . 1 . 2]" 1
1538 1 90 ILE MD 1 90 ILE HG13 1.908 . 2.363 2.118 2.115 2.119 . 0 0 "[ . 1 . 2]" 1
1539 1 90 ILE MD 1 90 ILE MG 1.830 . 2.249 2.068 2.027 2.100 . 0 0 "[ . 1 . 2]" 1
1540 1 72 ILE H 1 72 ILE MD 2.808 . 3.793 3.706 3.562 3.785 . 0 0 "[ . 1 . 2]" 1
1541 1 72 ILE HA 1 72 ILE MD 2.433 . 3.173 2.153 2.089 2.204 . 0 0 "[ . 1 . 2]" 1
1542 1 72 ILE MD 1 72 ILE HG13 1.993 . 2.489 2.118 2.115 2.121 . 0 0 "[ . 1 . 2]" 1
1543 1 72 ILE MD 1 72 ILE HG12 1.806 . 2.214 2.117 2.115 2.118 . 0 0 "[ . 1 . 2]" 1
1544 1 72 ILE MD 1 108 VAL MG2 1.721 . 2.091 2.087 1.818 2.171 0.080 14 0 "[ . 1 . 2]" 1
1545 1 43 VAL HB 1 72 ILE MD 2.390 . 3.104 1.798 1.674 1.960 0.002 9 0 "[ . 1 . 2]" 1
1546 1 71 ILE H 1 71 ILE MD 2.811 . 3.799 3.323 3.003 3.855 0.056 11 0 "[ . 1 . 2]" 1
1547 1 40 GLU HA 1 71 ILE MD 3.735 . 5.479 5.159 4.851 5.374 . 0 0 "[ . 1 . 2]" 1
1548 1 70 ALA HA 1 71 ILE MD 3.385 . 4.817 3.865 3.435 4.640 . 0 0 "[ . 1 . 2]" 1
1549 1 71 ILE MD 1 118 ASN QB 2.827 . 3.633 1.865 1.728 2.185 0.100 11 0 "[ . 1 . 2]" 1
1550 1 40 GLU QG 1 71 ILE MD 2.771 . 3.731 3.481 2.858 3.686 . 0 0 "[ . 1 . 2]" 1
1551 1 71 ILE MD 1 72 ILE H 2.885 . 3.925 3.765 3.630 3.835 . 0 0 "[ . 1 . 2]" 1
1552 1 71 ILE HA 1 71 ILE MD 2.479 . 3.247 2.070 2.010 2.125 . 0 0 "[ . 1 . 2]" 1
1553 1 40 GLU HB3 1 71 ILE MD 2.618 . 3.475 3.509 3.202 4.060 0.585 11 1 "[ . 1+ . 2]" 1
1554 1 71 ILE MD 1 71 ILE HG12 2.000 . 2.500 2.114 2.103 2.118 . 0 0 "[ . 1 . 2]" 1
1555 1 71 ILE MD 1 71 ILE HG13 1.956 . 2.434 2.108 2.092 2.117 . 0 0 "[ . 1 . 2]" 1
1556 1 72 ILE H 1 119 ILE MD 2.853 . 3.870 2.744 2.594 2.872 . 0 0 "[ . 1 . 2]" 1
1557 1 119 ILE H 1 119 ILE MD 2.848 . 3.862 3.499 3.222 3.807 . 0 0 "[ . 1 . 2]" 1
1558 1 119 ILE HA 1 119 ILE MD 2.158 . 2.740 1.961 1.872 2.032 . 0 0 "[ . 1 . 2]" 1
1559 1 74 GLU HA 1 119 ILE MD 2.709 . 3.626 3.226 2.339 3.607 . 0 0 "[ . 1 . 2]" 1
1560 1 119 ILE HB 1 119 ILE MD 2.470 . 3.233 3.233 3.223 3.240 0.007 16 0 "[ . 1 . 2]" 1
1561 1 72 ILE HB 1 119 ILE MD 1.960 . 2.440 1.782 1.671 2.022 . 0 0 "[ . 1 . 2]" 1
1562 1 119 ILE MD 1 119 ILE HG12 1.824 . 2.240 2.118 2.111 2.123 . 0 0 "[ . 1 . 2]" 1
1563 1 90 ILE H 1 91 VAL H 4.196 . 6.396 4.399 4.272 4.494 . 0 0 "[ . 1 . 2]" 1
1564 1 90 ILE MD 1 91 VAL H 3.711 . 5.433 5.350 5.215 5.443 0.010 7 0 "[ . 1 . 2]" 1
1565 1 102 VAL HA 1 103 ASP H 2.255 . 2.890 2.156 2.120 2.206 . 0 0 "[ . 1 . 2]" 1
1566 1 43 VAL H 1 43 VAL HB 2.463 . 3.221 2.571 2.498 2.643 . 0 0 "[ . 1 . 2]" 1
1567 1 43 VAL H 1 53 THR MG 3.609 . 5.237 2.877 2.700 3.195 . 0 0 "[ . 1 . 2]" 1
1568 1 42 ILE MG 1 43 VAL H 2.639 . 3.510 3.306 3.195 3.338 . 0 0 "[ . 1 . 2]" 1
1569 1 43 VAL H 1 66 VAL MG1 3.492 . 5.016 4.763 4.437 5.070 0.054 20 0 "[ . 1 . 2]" 1
1570 1 109 TYR H 1 110 LEU H 3.900 . 5.801 4.301 4.233 4.547 . 0 0 "[ . 1 . 2]" 1
1571 1 100 ILE QG 1 109 TYR H 2.566 . 3.389 2.793 2.562 3.125 . 0 0 "[ . 1 . 2]" 1
1572 1 100 ILE MD 1 109 TYR H 3.402 . 4.848 3.070 2.761 3.336 . 0 0 "[ . 1 . 2]" 1
1573 1 99 VAL HA 1 109 TYR H 3.206 . 4.491 3.685 3.433 4.181 . 0 0 "[ . 1 . 2]" 1
1574 1 108 VAL HB 1 109 TYR H 3.466 . 4.968 4.381 4.291 4.454 . 0 0 "[ . 1 . 2]" 1
1575 1 78 MET HB2 1 79 LYS H 3.842 . 5.687 4.261 3.703 4.551 . 0 0 "[ . 1 . 2]" 1
1576 1 78 MET HA 1 79 LYS H 2.277 . 2.925 2.210 2.133 2.338 . 0 0 "[ . 1 . 2]" 1
1577 1 79 LYS H 1 80 ASP HB2 4.138 . 6.278 5.051 4.227 6.904 0.626 16 1 "[ . 1 .+ 2]" 1
1578 1 79 LYS H 1 79 LYS HB2 2.998 . 4.122 2.768 2.413 3.276 . 0 0 "[ . 1 . 2]" 1
1579 1 79 LYS H 1 79 LYS HB3 2.869 . 3.898 3.275 2.503 3.862 . 0 0 "[ . 1 . 2]" 1
1580 1 79 LYS H 1 79 LYS QG 3.217 . 4.510 3.219 2.045 4.125 . 0 0 "[ . 1 . 2]" 1
1581 1 55 HIS H 1 58 HIS H 3.097 . 4.296 3.719 3.552 3.883 . 0 0 "[ . 1 . 2]" 1
1582 1 55 HIS H 1 59 TYR HA 2.988 . 4.104 3.285 3.092 3.480 . 0 0 "[ . 1 . 2]" 1
1583 1 54 SER HA 1 55 HIS H 2.349 . 3.039 2.239 2.202 2.263 . 0 0 "[ . 1 . 2]" 1
1584 1 54 SER HB3 1 55 HIS H 3.781 . 5.568 4.460 4.024 4.574 . 0 0 "[ . 1 . 2]" 1
1585 1 55 HIS H 1 55 HIS HB3 2.900 . 3.951 2.961 2.883 3.015 . 0 0 "[ . 1 . 2]" 1
1586 1 55 HIS H 1 60 HIS H 3.853 . 5.709 3.645 3.392 3.819 . 0 0 "[ . 1 . 2]" 1
1587 1 54 SER HB2 1 55 HIS H 3.975 . 5.950 4.419 3.987 4.586 . 0 0 "[ . 1 . 2]" 1
1588 1 83 TYR QD 1 84 GLN H 3.416 . 4.875 3.354 2.308 3.736 . 0 0 "[ . 1 . 2]" 1
1589 1 83 TYR QB 1 84 GLN H 3.052 . 4.217 3.668 3.511 3.816 . 0 0 "[ . 1 . 2]" 1
1590 1 84 GLN H 1 84 GLN HB3 2.691 . 3.596 3.418 2.350 3.734 0.138 16 0 "[ . 1 . 2]" 1
1591 1 84 GLN H 1 84 GLN HB2 2.251 . 2.884 2.644 2.414 3.256 0.372 13 0 "[ . 1 . 2]" 1
1592 1 56 GLY HA2 1 57 ASP H 2.612 . 3.465 3.441 3.417 3.470 0.005 9 0 "[ . 1 . 2]" 1
1593 1 57 ASP H 1 58 HIS H 2.706 . 3.621 1.796 1.724 1.851 0.067 16 0 "[ . 1 . 2]" 1
1594 1 57 ASP H 1 129 LYS HA 4.098 . 6.197 5.023 4.651 5.290 . 0 0 "[ . 1 . 2]" 1
1595 1 56 GLY HA3 1 57 ASP H 2.321 . 2.994 2.204 2.172 2.249 . 0 0 "[ . 1 . 2]" 1
1596 1 57 ASP H 1 57 ASP QB 2.971 . 3.641 2.524 2.457 2.585 . 0 0 "[ . 1 . 2]" 1
1597 1 109 TYR QB 1 110 LEU H 4.051 . 6.102 3.888 3.708 3.943 . 0 0 "[ . 1 . 2]" 1
1598 1 110 LEU H 1 110 LEU HB2 2.261 . 2.900 2.379 2.225 2.671 . 0 0 "[ . 1 . 2]" 1
1599 1 110 LEU H 1 111 LYS H 3.023 . 4.166 4.405 4.262 4.535 0.369 14 0 "[ . 1 . 2]" 1
1600 1 110 LEU H 1 110 LEU HB3 2.862 . 3.886 2.817 2.595 2.933 . 0 0 "[ . 1 . 2]" 1
1601 1 74 GLU H 1 75 GLU H 2.774 . 3.736 2.632 2.544 2.699 . 0 0 "[ . 1 . 2]" 1
1602 1 74 GLU H 1 120 ARG H 3.116 . 4.330 3.945 3.450 4.403 0.073 2 0 "[ . 1 . 2]" 1
1603 1 73 SER H 1 74 GLU H 3.859 . 5.721 4.567 4.518 4.592 . 0 0 "[ . 1 . 2]" 1
1604 1 74 GLU H 1 75 GLU HA 3.554 . 5.133 5.175 5.089 5.240 0.107 18 0 "[ . 1 . 2]" 1
1605 1 74 GLU H 1 74 GLU HA 2.431 . 3.170 2.804 2.782 2.822 . 0 0 "[ . 1 . 2]" 1
1606 1 74 GLU H 1 119 ILE MD 3.464 . 4.964 4.454 3.393 4.811 . 0 0 "[ . 1 . 2]" 1
1607 1 23 ALA H 1 23 ALA MB 2.252 . 2.886 2.932 2.550 3.112 0.226 19 0 "[ . 1 . 2]" 1
1608 1 46 ILE H 1 47 THR H 3.645 . 5.306 4.357 4.232 4.433 . 0 0 "[ . 1 . 2]" 1
1609 1 45 LYS H 1 46 ILE H 3.670 . 5.353 4.343 4.285 4.409 . 0 0 "[ . 1 . 2]" 1
1610 1 45 LYS HB2 1 46 ILE H 3.035 . 4.187 3.964 3.835 4.103 . 0 0 "[ . 1 . 2]" 1
1611 1 45 LYS HB3 1 46 ILE H 2.928 . 4.000 4.075 3.986 4.137 0.137 15 0 "[ . 1 . 2]" 1
1612 1 46 ILE H 1 46 ILE MD 2.942 . 4.024 3.918 3.823 4.055 0.031 15 0 "[ . 1 . 2]" 1
1613 1 46 ILE H 1 46 ILE HB 2.269 . 2.912 2.942 2.716 3.045 0.133 18 0 "[ . 1 . 2]" 1
1614 1 23 ALA H 1 62 TYR H 4.174 . 6.351 5.039 3.989 6.498 0.147 8 0 "[ . 1 . 2]" 1
1615 1 22 LYS QG 1 23 ALA H 3.213 . 4.504 4.031 2.453 4.563 0.059 13 0 "[ . 1 . 2]" 1
1616 1 71 ILE H 1 72 ILE H 3.543 . 5.112 4.513 4.463 4.565 . 0 0 "[ . 1 . 2]" 1
1617 1 71 ILE MG 1 72 ILE H 2.293 . 2.950 2.366 2.284 2.516 . 0 0 "[ . 1 . 2]" 1
1618 1 101 LYS HA 1 102 VAL H 2.257 . 2.894 2.149 2.109 2.170 . 0 0 "[ . 1 . 2]" 1
1619 1 102 VAL H 1 105 LYS H 2.645 . 3.519 3.379 3.115 3.635 0.116 18 0 "[ . 1 . 2]" 1
1620 1 102 VAL H 1 107 TYR QE 3.138 . 4.369 3.057 2.849 3.482 . 0 0 "[ . 1 . 2]" 1
1621 1 102 VAL H 1 106 TYR HA 2.992 . 4.111 3.309 3.143 3.671 . 0 0 "[ . 1 . 2]" 1
1622 1 102 VAL H 1 102 VAL HA 2.599 . 3.444 2.932 2.920 2.937 . 0 0 "[ . 1 . 2]" 1
1623 1 102 VAL H 1 102 VAL QG 2.901 . 3.018 2.139 2.111 2.184 . 0 0 "[ . 1 . 2]" 1
1624 1 115 HIS HA 1 116 ALA H 2.504 . 3.288 3.136 2.999 3.341 0.053 18 0 "[ . 1 . 2]" 1
1625 1 116 ALA H 1 116 ALA HA 2.567 . 3.391 2.254 2.215 2.264 . 0 0 "[ . 1 . 2]" 1
1626 1 85 LEU H 1 85 LEU QB 2.250 . 2.883 2.188 2.171 2.217 . 0 0 "[ . 1 . 2]" 1
1627 1 84 GLN HB3 1 85 LEU H 2.618 . 3.475 3.133 2.553 4.063 0.588 9 2 "[ . +1 - . 2]" 1
1628 1 85 LEU H 1 85 LEU QD 2.946 . 4.031 3.664 3.627 3.713 . 0 0 "[ . 1 . 2]" 1
1629 1 120 ARG H 1 121 THR H 3.333 . 4.722 4.372 4.299 4.465 . 0 0 "[ . 1 . 2]" 1
1630 1 73 SER H 1 120 ARG H 3.558 . 5.140 4.888 4.644 5.208 0.068 14 0 "[ . 1 . 2]" 1
1631 1 119 ILE H 1 120 ARG H 4.030 . 6.060 4.306 4.167 4.362 . 0 0 "[ . 1 . 2]" 1
1632 1 120 ARG H 1 120 ARG HG2 2.903 . 3.957 3.102 2.420 4.621 0.664 3 1 "[ + . 1 . 2]" 1
1633 1 119 ILE MD 1 120 ARG H 2.741 . 3.680 3.584 3.336 3.703 0.023 4 0 "[ . 1 . 2]" 1
1634 1 42 ILE H 1 55 HIS HA 3.975 . 5.950 3.257 2.932 3.442 . 0 0 "[ . 1 . 2]" 1
1635 1 41 GLN HA 1 42 ILE H 2.458 . 3.213 2.142 2.093 2.255 . 0 0 "[ . 1 . 2]" 1
1636 1 42 ILE H 1 42 ILE HA 2.704 . 3.618 2.918 2.877 2.936 . 0 0 "[ . 1 . 2]" 1
1637 1 42 ILE H 1 54 SER HB2 3.997 . 5.994 5.784 4.458 6.127 0.133 19 0 "[ . 1 . 2]" 1
1638 1 41 GLN QG 1 42 ILE H 3.499 . 5.029 4.173 3.926 4.406 . 0 0 "[ . 1 . 2]" 1
1639 1 41 GLN HB3 1 42 ILE H 3.644 . 5.304 3.763 3.582 4.055 . 0 0 "[ . 1 . 2]" 1
1640 1 42 ILE H 1 42 ILE HB 2.528 . 3.327 2.573 2.536 2.619 . 0 0 "[ . 1 . 2]" 1
1641 1 42 ILE H 1 42 ILE QG 2.718 . 3.641 2.246 2.035 2.461 . 0 0 "[ . 1 . 2]" 1
1642 1 42 ILE H 1 53 THR MG 3.468 . 4.971 3.762 3.314 4.272 . 0 0 "[ . 1 . 2]" 1
1643 1 42 ILE H 1 42 ILE MD 2.878 . 3.913 3.619 3.455 3.753 . 0 0 "[ . 1 . 2]" 1
1644 1 42 ILE H 1 43 VAL H 4.450 . 6.925 4.165 4.100 4.241 . 0 0 "[ . 1 . 2]" 1
1645 1 66 VAL H 1 66 VAL HA 2.810 . 3.797 2.846 2.779 2.891 . 0 0 "[ . 1 . 2]" 1
1646 1 65 LYS HB3 1 66 VAL H 2.595 . 3.437 2.711 2.364 3.163 . 0 0 "[ . 1 . 2]" 1
1647 1 66 VAL H 1 66 VAL HB 2.259 . 2.897 2.651 2.568 2.745 . 0 0 "[ . 1 . 2]" 1
1648 1 66 VAL H 1 66 VAL MG2 2.261 . 2.900 1.951 1.840 2.071 . 0 0 "[ . 1 . 2]" 1
1649 1 66 VAL H 1 99 VAL QG 3.438 . 4.916 3.099 2.767 3.277 . 0 0 "[ . 1 . 2]" 1
1650 1 85 LEU H 1 86 LYS H 3.141 . 4.374 4.421 4.343 4.538 0.164 14 0 "[ . 1 . 2]" 1
1651 1 86 LYS H 1 89 ASP HB2 3.310 . 4.680 3.613 3.061 4.894 0.214 13 0 "[ . 1 . 2]" 1
1652 1 86 LYS H 1 86 LYS HB2 2.894 . 3.941 2.578 2.156 2.974 . 0 0 "[ . 1 . 2]" 1
1653 1 86 LYS H 1 86 LYS HB3 2.398 . 3.117 2.821 2.356 3.411 0.294 16 0 "[ . 1 . 2]" 1
1654 1 85 LEU HG 1 86 LYS H 2.851 . 3.867 3.379 2.760 3.655 . 0 0 "[ . 1 . 2]" 1
1655 1 37 ILE MG 1 38 ASN H 4.216 . 6.438 3.845 2.586 4.159 . 0 0 "[ . 1 . 2]" 1
1656 1 14 ILE HA 1 15 ASP H 2.643 . 3.516 3.069 2.049 3.574 0.058 3 0 "[ . 1 . 2]" 1
1657 1 15 ASP H 1 15 ASP HA 2.919 . 3.984 2.704 2.253 2.951 . 0 0 "[ . 1 . 2]" 1
1658 1 19 ALA H 1 19 ALA HA 2.253 . 2.887 2.704 2.254 2.940 0.053 13 0 "[ . 1 . 2]" 1
1659 1 19 ALA H 1 19 ALA MB 2.425 . 3.160 2.522 2.240 2.912 . 0 0 "[ . 1 . 2]" 1
1660 1 37 ILE HA 1 38 ASN H 3.134 . 4.362 2.642 2.108 3.547 . 0 0 "[ . 1 . 2]" 1
1661 1 38 ASN H 1 38 ASN QB 3.574 . 4.702 2.700 2.382 3.261 . 0 0 "[ . 1 . 2]" 1
1662 1 37 ILE HB 1 38 ASN H 3.812 . 5.628 3.215 2.750 3.655 . 0 0 "[ . 1 . 2]" 1
1663 1 86 LYS HA 1 87 ASP H 2.261 . 2.900 2.131 2.080 2.232 . 0 0 "[ . 1 . 2]" 1
1664 1 87 ASP H 1 87 ASP HB2 2.251 . 2.885 2.457 2.280 2.637 . 0 0 "[ . 1 . 2]" 1
1665 1 87 ASP H 1 88 SER H 2.563 . 3.384 2.608 2.528 2.681 . 0 0 "[ . 1 . 2]" 1
1666 1 87 ASP H 1 87 ASP HA 2.304 . 2.968 2.816 2.782 2.845 . 0 0 "[ . 1 . 2]" 1
1667 1 86 LYS HB2 1 87 ASP H 2.974 . 4.080 4.268 4.052 4.513 0.433 4 0 "[ . 1 . 2]" 1
1668 1 86 LYS HD2 1 87 ASP H 2.690 . 3.594 2.989 2.316 3.684 0.090 2 0 "[ . 1 . 2]" 1
1669 1 86 LYS HG2 1 87 ASP H 3.390 . 4.827 4.507 3.951 5.071 0.244 19 0 "[ . 1 . 2]" 1
1670 1 124 GLU H 1 124 GLU HA 2.499 . 3.280 2.857 2.822 2.906 . 0 0 "[ . 1 . 2]" 1
1671 1 123 GLU HA 1 124 GLU H 3.019 . 4.159 3.528 3.378 3.567 . 0 0 "[ . 1 . 2]" 1
1672 1 124 GLU H 1 124 GLU HG3 3.205 . 4.489 4.436 4.354 4.531 0.042 16 0 "[ . 1 . 2]" 1
1673 1 124 GLU H 1 124 GLU HB2 2.283 . 2.935 2.560 2.426 2.779 . 0 0 "[ . 1 . 2]" 1
1674 1 123 GLU HB3 1 124 GLU H 2.866 . 3.893 3.618 3.399 3.981 0.088 8 0 "[ . 1 . 2]" 1
1675 1 124 GLU H 1 124 GLU HB3 2.257 . 2.894 2.563 2.390 2.686 . 0 0 "[ . 1 . 2]" 1
1676 1 121 THR MG 1 124 GLU H 3.571 . 5.165 4.027 3.877 4.248 . 0 0 "[ . 1 . 2]" 1
1677 1 91 VAL H 1 101 LYS H 3.838 . 5.680 3.225 3.039 3.474 . 0 0 "[ . 1 . 2]" 1
1678 1 100 ILE HB 1 101 LYS H 2.332 . 3.012 2.741 2.528 2.907 . 0 0 "[ . 1 . 2]" 1
1679 1 101 LYS H 1 101 LYS HB2 2.722 . 3.648 3.020 2.935 3.098 . 0 0 "[ . 1 . 2]" 1
1680 1 99 VAL QG 1 101 LYS H 3.517 . 5.063 4.834 4.690 5.002 . 0 0 "[ . 1 . 2]" 1
1681 1 101 LYS H 1 101 LYS HB3 2.652 . 3.531 2.589 2.510 2.672 . 0 0 "[ . 1 . 2]" 1
1682 1 101 LYS H 1 102 VAL QG 2.801 . 3.781 3.463 3.343 3.557 . 0 0 "[ . 1 . 2]" 1
1683 1 100 ILE MD 1 101 LYS H 3.529 . 5.086 4.669 4.492 4.829 . 0 0 "[ . 1 . 2]" 1
1684 1 61 TYR HA 1 62 TYR H 2.255 . 2.891 2.218 2.181 2.270 . 0 0 "[ . 1 . 2]" 1
1685 1 62 TYR H 1 62 TYR QB 2.850 . 3.866 2.741 2.446 3.360 . 0 0 "[ . 1 . 2]" 1
1686 1 62 TYR H 1 63 ASN H 3.041 . 4.197 4.417 4.319 4.484 0.287 14 0 "[ . 1 . 2]" 1
1687 1 52 VAL QG 1 62 TYR H 3.418 . 4.878 3.350 2.880 3.730 . 0 0 "[ . 1 . 2]" 1
1688 1 98 TYR H 1 99 VAL H 3.419 . 4.881 4.223 4.135 4.333 . 0 0 "[ . 1 . 2]" 1
1689 1 94 ILE H 1 99 VAL H 3.371 . 4.791 3.218 3.038 3.438 . 0 0 "[ . 1 . 2]" 1
1690 1 98 TYR HB2 1 99 VAL H 3.144 . 4.379 4.453 4.349 4.491 0.112 18 0 "[ . 1 . 2]" 1
1691 1 99 VAL H 1 99 VAL HB 2.263 . 2.903 2.838 2.619 2.942 0.039 15 0 "[ . 1 . 2]" 1
1692 1 99 VAL H 1 99 VAL QG 2.782 . 2.906 1.907 1.791 2.163 0.024 15 0 "[ . 1 . 2]" 1
1693 1 99 VAL H 1 100 ILE MG 3.070 . 4.248 3.775 3.722 3.874 . 0 0 "[ . 1 . 2]" 1
1694 1 92 ASN H 1 99 VAL H 2.787 . 3.758 4.236 3.810 4.425 0.667 8 8 "[ * -+ * *. ** *]" 1
1695 1 94 ILE HG13 1 99 VAL H 3.225 . 4.525 4.582 4.302 4.826 0.301 6 0 "[ . 1 . 2]" 1
1696 1 22 LYS H 1 23 ALA H 3.045 . 4.204 3.745 2.363 4.484 0.280 16 0 "[ . 1 . 2]" 1
1697 1 22 LYS H 1 22 LYS HA 2.549 . 3.361 2.614 2.236 2.949 . 0 0 "[ . 1 . 2]" 1
1698 1 21 GLN HG2 1 22 LYS H 3.473 . 4.980 4.317 2.658 5.201 0.221 5 0 "[ . 1 . 2]" 1
1699 1 21 GLN HB3 1 22 LYS H 2.341 . 3.026 2.800 1.704 3.851 0.825 18 4 "[ -* . 1 .* + 2]" 1
1700 1 22 LYS H 1 22 LYS QG 2.806 . 3.790 3.065 2.487 3.828 0.038 7 0 "[ . 1 . 2]" 1
1701 1 78 MET H 1 79 LYS H 4.688 . 7.436 4.230 3.804 4.555 . 0 0 "[ . 1 . 2]" 1
1702 1 78 MET H 1 109 TYR HA 3.181 . 4.446 3.069 2.283 3.449 . 0 0 "[ . 1 . 2]" 1
1703 1 78 MET H 1 78 MET HA 2.762 . 3.716 2.895 2.810 2.940 . 0 0 "[ . 1 . 2]" 1
1704 1 78 MET H 1 107 TYR HB3 3.327 . 4.711 3.508 3.248 3.888 . 0 0 "[ . 1 . 2]" 1
1705 1 78 MET H 1 78 MET QG 3.404 . 4.853 3.932 3.808 3.979 . 0 0 "[ . 1 . 2]" 1
1706 1 78 MET H 1 78 MET HB3 2.257 . 2.894 2.383 2.310 2.468 . 0 0 "[ . 1 . 2]" 1
1707 1 77 LEU HB2 1 78 MET H 2.979 . 4.088 3.767 2.535 4.234 0.146 9 0 "[ . 1 . 2]" 1
1708 1 78 MET H 1 78 MET HB2 2.337 . 3.020 2.941 2.688 3.195 0.175 9 0 "[ . 1 . 2]" 1
1709 1 77 LEU HB3 1 78 MET H 2.746 . 3.688 3.228 2.808 3.970 0.282 16 0 "[ . 1 . 2]" 1
1710 1 33 LYS H 1 33 LYS HB2 2.253 . 2.887 2.478 2.401 2.587 . 0 0 "[ . 1 . 2]" 1
1711 1 29 ASP HA 1 33 LYS H 3.526 . 5.080 3.982 3.582 4.320 . 0 0 "[ . 1 . 2]" 1
1712 1 32 SER HB2 1 33 LYS H 2.258 . 2.895 2.644 1.941 3.694 0.799 15 3 "[ . - 1 *+ 2]" 1
1713 1 44 ILE HA 1 45 LYS H 3.658 . 5.331 3.443 3.387 3.502 . 0 0 "[ . 1 . 2]" 1
1714 1 45 LYS H 1 45 LYS HA 2.620 . 3.478 2.930 2.920 2.948 . 0 0 "[ . 1 . 2]" 1
1715 1 43 VAL HA 1 45 LYS H 2.996 . 4.118 3.487 3.385 3.606 . 0 0 "[ . 1 . 2]" 1
1716 1 45 LYS H 1 45 LYS HB3 2.766 . 3.722 2.678 2.598 2.786 . 0 0 "[ . 1 . 2]" 1
1717 1 100 ILE H 1 109 TYR H 3.631 . 5.279 3.971 3.794 4.101 . 0 0 "[ . 1 . 2]" 1
1718 1 100 ILE H 1 107 TYR H 2.857 . 3.877 2.873 2.760 2.990 . 0 0 "[ . 1 . 2]" 1
1719 1 100 ILE H 1 107 TYR HA 4.180 . 6.364 4.664 4.592 4.778 . 0 0 "[ . 1 . 2]" 1
1720 1 100 ILE H 1 108 VAL HA 2.846 . 3.859 3.047 2.811 3.215 . 0 0 "[ . 1 . 2]" 1
1721 1 99 VAL HA 1 100 ILE H 2.255 . 2.891 2.112 2.091 2.142 . 0 0 "[ . 1 . 2]" 1
1722 1 100 ILE H 1 107 TYR HB2 4.207 . 6.419 3.993 3.861 4.168 . 0 0 "[ . 1 . 2]" 1
1723 1 99 VAL HB 1 100 ILE H 4.270 . 6.549 4.246 4.194 4.289 . 0 0 "[ . 1 . 2]" 1
1724 1 100 ILE H 1 100 ILE HB 3.460 . 4.957 3.783 3.739 3.817 . 0 0 "[ . 1 . 2]" 1
1725 1 100 ILE H 1 100 ILE QG 2.786 . 3.093 2.108 2.031 2.157 . 0 0 "[ . 1 . 2]" 1
1726 1 99 VAL QG 1 100 ILE H 2.258 . 2.895 2.882 2.777 2.930 0.035 6 0 "[ . 1 . 2]" 1
1727 1 100 ILE H 1 100 ILE MG 2.580 . 3.412 2.999 2.918 3.054 . 0 0 "[ . 1 . 2]" 1
1728 1 24 GLU H 1 61 TYR H 4.151 . 6.305 4.932 4.425 5.312 . 0 0 "[ . 1 . 2]" 1
1729 1 60 HIS QB 1 61 TYR H 3.958 . 4.891 3.646 3.488 3.766 . 0 0 "[ . 1 . 2]" 1
1730 1 61 TYR H 1 61 TYR HB2 3.108 . 4.315 2.447 2.285 2.763 . 0 0 "[ . 1 . 2]" 1
1731 1 24 GLU QG 1 61 TYR H 3.509 . 5.048 4.511 4.032 4.878 . 0 0 "[ . 1 . 2]" 1
1732 1 23 ALA HA 1 61 TYR H 4.031 . 6.062 4.996 4.235 5.493 . 0 0 "[ . 1 . 2]" 1
1733 1 29 ASP H 1 31 VAL H 2.670 . 3.561 3.718 3.645 3.790 0.229 20 0 "[ . 1 . 2]" 1
1734 1 31 VAL H 1 35 GLU H 4.174 . 6.351 6.241 6.036 6.405 0.054 7 0 "[ . 1 . 2]" 1
1735 1 30 GLU HA 1 31 VAL H 3.403 . 4.850 3.505 3.463 3.532 . 0 0 "[ . 1 . 2]" 1
1736 1 31 VAL H 1 31 VAL HA 2.472 . 3.236 2.805 2.754 2.844 . 0 0 "[ . 1 . 2]" 1
1737 1 31 VAL H 1 31 VAL HB 2.281 . 2.931 2.545 2.441 2.595 . 0 0 "[ . 1 . 2]" 1
1738 1 13 TYR H 1 14 ILE H 3.169 . 4.424 3.742 2.442 4.517 0.093 11 0 "[ . 1 . 2]" 1
1739 1 12 SER HA 1 13 TYR H 2.555 . 3.371 2.442 2.115 3.541 0.170 20 0 "[ . 1 . 2]" 1
1740 1 12 SER HB2 1 13 TYR H 3.941 . 5.882 3.728 2.380 4.412 . 0 0 "[ . 1 . 2]" 1
1741 1 13 TYR H 1 13 TYR HB2 3.569 . 5.162 3.088 2.393 3.877 . 0 0 "[ . 1 . 2]" 1
1742 1 13 TYR H 1 13 TYR HB3 3.080 . 4.266 3.700 3.075 4.092 . 0 0 "[ . 1 . 2]" 1
1743 1 31 VAL H 1 33 LYS H 3.345 . 4.744 4.380 4.048 4.771 0.027 1 0 "[ . 1 . 2]" 1
1744 1 33 LYS H 1 33 LYS HG2 2.749 . 3.693 3.450 3.204 3.689 . 0 0 "[ . 1 . 2]" 1
1745 1 44 ILE H 1 45 LYS H 2.530 . 3.330 2.125 2.058 2.194 . 0 0 "[ . 1 . 2]" 1
1746 1 44 ILE HG13 1 45 LYS H 2.847 . 3.860 2.313 2.022 2.379 . 0 0 "[ . 1 . 2]" 1
1747 1 44 ILE HG12 1 45 LYS H 2.947 . 4.033 3.132 2.938 3.470 . 0 0 "[ . 1 . 2]" 1
1748 1 45 LYS H 1 76 LEU MD1 3.180 . 4.444 3.156 2.844 3.375 . 0 0 "[ . 1 . 2]" 1
1749 1 94 ILE HB 1 95 LYS H 2.258 . 2.895 1.952 1.885 2.008 . 0 0 "[ . 1 . 2]" 1
1750 1 95 LYS H 1 96 GLY H 3.572 . 5.167 4.385 4.351 4.462 . 0 0 "[ . 1 . 2]" 1
1751 1 94 ILE H 1 95 LYS H 3.780 . 5.566 4.360 4.324 4.398 . 0 0 "[ . 1 . 2]" 1
1752 1 68 TYR QE 1 95 LYS H 3.727 . 5.464 3.584 3.339 3.764 . 0 0 "[ . 1 . 2]" 1
1753 1 94 ILE HA 1 95 LYS H 2.345 . 3.033 2.687 2.662 2.722 . 0 0 "[ . 1 . 2]" 1
1754 1 95 LYS H 1 95 LYS HB3 2.325 . 3.000 2.725 2.532 3.000 . 0 0 "[ . 1 . 2]" 1
1755 1 95 LYS H 1 95 LYS HG3 3.032 . 4.181 4.269 3.994 4.386 0.205 1 0 "[ . 1 . 2]" 1
1756 1 95 LYS H 1 95 LYS HB2 2.261 . 2.900 2.362 2.143 2.610 . 0 0 "[ . 1 . 2]" 1
1757 1 94 ILE MG 1 95 LYS H 2.837 . 3.843 3.510 3.412 3.581 . 0 0 "[ . 1 . 2]" 1
1758 1 94 ILE HG13 1 95 LYS H 3.012 . 4.146 3.147 3.089 3.230 . 0 0 "[ . 1 . 2]" 1
1759 1 80 ASP H 1 80 ASP HB2 2.253 . 2.888 2.846 2.112 3.493 0.605 16 1 "[ . 1 .+ 2]" 1
1760 1 80 ASP H 1 80 ASP HA 2.717 . 3.640 2.844 2.554 2.950 . 0 0 "[ . 1 . 2]" 1
1761 1 79 LYS HA 1 80 ASP H 2.741 . 3.680 2.220 2.106 2.503 . 0 0 "[ . 1 . 2]" 1
1762 1 80 ASP H 1 80 ASP HB3 2.248 . 2.880 2.918 2.675 3.506 0.626 3 4 "[ + - * . * 2]" 1
1763 1 79 LYS HB2 1 80 ASP H 3.218 . 4.513 4.170 3.283 4.466 . 0 0 "[ . 1 . 2]" 1
1764 1 79 LYS HB3 1 80 ASP H 3.159 . 4.406 3.651 2.195 4.421 0.015 15 0 "[ . 1 . 2]" 1
1765 1 82 ASN H 1 83 TYR H 2.251 . 2.884 2.165 1.982 2.558 . 0 0 "[ . 1 . 2]" 1
1766 1 93 GLU H 1 93 GLU QB 2.282 . 2.933 2.453 2.349 2.923 . 0 0 "[ . 1 . 2]" 1
1767 1 14 ILE H 1 15 ASP H 2.812 . 3.800 3.112 1.817 4.097 0.297 11 0 "[ . 1 . 2]" 1
1768 1 13 TYR HA 1 14 ILE H 2.366 . 3.065 2.406 2.085 2.933 . 0 0 "[ . 1 . 2]" 1
1769 1 14 ILE H 1 14 ILE HB 2.854 . 3.872 2.919 2.395 3.629 . 0 0 "[ . 1 . 2]" 1
1770 1 105 LYS H 1 105 LYS QB 2.281 . 2.931 2.452 2.334 2.562 . 0 0 "[ . 1 . 2]" 1
1771 1 105 LYS H 1 106 TYR H 3.272 . 4.611 4.461 4.391 4.537 . 0 0 "[ . 1 . 2]" 1
1772 1 105 LYS H 1 105 LYS HA 2.252 . 2.886 2.936 2.909 2.945 0.059 20 0 "[ . 1 . 2]" 1
1773 1 104 GLY HA3 1 105 LYS H 2.757 . 3.707 3.246 3.063 3.404 . 0 0 "[ . 1 . 2]" 1
1774 1 104 GLY HA2 1 105 LYS H 2.770 . 3.729 3.298 3.130 3.487 . 0 0 "[ . 1 . 2]" 1
1775 1 83 TYR H 1 83 TYR QB 2.286 . 2.939 2.372 2.184 2.505 . 0 0 "[ . 1 . 2]" 1
1776 1 39 ALA H 1 39 ALA HA 2.406 . 3.130 2.829 2.805 2.864 . 0 0 "[ . 1 . 2]" 1
1777 1 83 TYR H 1 83 TYR HA 2.383 . 3.093 2.904 2.807 2.945 . 0 0 "[ . 1 . 2]" 1
1778 1 39 ALA H 1 39 ALA MB 2.274 . 2.920 2.228 2.218 2.248 . 0 0 "[ . 1 . 2]" 1
1779 1 37 ILE MG 1 39 ALA H 2.871 . 3.901 3.995 1.828 4.206 0.305 13 0 "[ . 1 . 2]" 1
1780 1 93 GLU H 1 94 ILE H 3.615 . 5.249 4.372 4.148 4.480 . 0 0 "[ . 1 . 2]" 1
1781 1 92 ASN HD21 1 93 GLU H 3.336 . 4.727 3.008 2.798 3.333 . 0 0 "[ . 1 . 2]" 1
1782 1 92 ASN QB 1 93 GLU H 2.737 . 3.674 3.213 2.421 3.293 . 0 0 "[ . 1 . 2]" 1
1783 1 40 GLU H 1 41 GLN H 3.303 . 4.667 4.569 4.508 4.606 . 0 0 "[ . 1 . 2]" 1
1784 1 40 GLU H 1 56 GLY H 3.272 . 4.611 4.365 4.113 4.643 0.032 18 0 "[ . 1 . 2]" 1
1785 1 40 GLU H 1 42 ILE H 4.144 . 6.290 6.060 5.569 6.385 0.095 10 0 "[ . 1 . 2]" 1
1786 1 40 GLU H 1 40 GLU HA 2.253 . 2.888 2.833 2.820 2.849 . 0 0 "[ . 1 . 2]" 1
1787 1 40 GLU H 1 40 GLU HB2 2.440 . 3.184 2.531 2.378 3.644 0.460 11 0 "[ . 1 . 2]" 1
1788 1 40 GLU H 1 40 GLU HB3 2.690 . 3.595 3.544 2.597 3.613 0.018 18 0 "[ . 1 . 2]" 1
1789 1 39 ALA MB 1 40 GLU H 2.428 . 3.165 2.421 2.244 2.547 . 0 0 "[ . 1 . 2]" 1
1790 1 70 ALA H 1 71 ILE H 3.807 . 5.618 4.602 4.570 4.621 . 0 0 "[ . 1 . 2]" 1
1791 1 71 ILE H 1 71 ILE HB 2.374 . 3.078 2.547 2.420 2.625 . 0 0 "[ . 1 . 2]" 1
1792 1 71 ILE H 1 71 ILE MG 3.051 . 4.214 3.798 3.742 3.838 . 0 0 "[ . 1 . 2]" 1
1793 1 97 GLY HA2 1 111 LYS H 3.040 . 4.195 2.889 2.746 3.087 . 0 0 "[ . 1 . 2]" 1
1794 1 111 LYS H 1 111 LYS HB2 2.269 . 2.913 2.439 2.375 2.500 . 0 0 "[ . 1 . 2]" 1
1795 1 110 LEU QD 1 111 LYS H 2.662 . 3.548 2.857 2.123 3.159 . 0 0 "[ . 1 . 2]" 1
1796 1 110 LEU HA 1 111 LYS H 2.255 . 2.891 2.101 2.070 2.166 . 0 0 "[ . 1 . 2]" 1
1797 1 110 LEU HB3 1 111 LYS H 2.923 . 3.991 3.912 3.779 4.025 0.034 9 0 "[ . 1 . 2]" 1
1798 1 89 ASP H 1 90 ILE H 2.312 . 2.980 2.111 1.943 2.239 . 0 0 "[ . 1 . 2]" 1
1799 1 86 LYS HB2 1 89 ASP H 3.222 . 4.519 4.175 3.321 4.617 0.098 13 0 "[ . 1 . 2]" 1
1800 1 69 ASP H 1 70 ALA H 2.262 . 2.902 2.594 2.428 2.696 . 0 0 "[ . 1 . 2]" 1
1801 1 69 ASP HA 1 70 ALA H 2.528 . 3.327 3.126 3.080 3.236 . 0 0 "[ . 1 . 2]" 1
1802 1 70 ALA H 1 70 ALA HA 2.285 . 2.937 2.846 2.788 2.878 . 0 0 "[ . 1 . 2]" 1
1803 1 67 PRO HG2 1 70 ALA H 2.582 . 3.416 3.044 2.976 3.155 . 0 0 "[ . 1 . 2]" 1
1804 1 66 VAL MG1 1 70 ALA H 2.800 . 3.780 3.532 3.346 3.798 0.018 20 0 "[ . 1 . 2]" 1
1805 1 40 GLU HA 1 41 GLN H 2.256 . 2.892 2.162 2.091 2.209 . 0 0 "[ . 1 . 2]" 1
1806 1 40 GLU HB2 1 41 GLN H 3.120 . 4.337 4.030 3.119 4.223 . 0 0 "[ . 1 . 2]" 1
1807 1 41 GLN H 1 41 GLN HB2 2.298 . 2.958 2.372 2.225 2.500 . 0 0 "[ . 1 . 2]" 1
1808 1 40 GLU HB3 1 41 GLN H 2.435 . 3.176 3.115 2.884 4.121 0.945 11 1 "[ . 1+ . 2]" 1
1809 1 41 GLN H 1 71 ILE MD 3.556 . 5.137 5.133 4.890 5.244 0.107 12 0 "[ . 1 . 2]" 1
1810 1 89 ASP H 1 89 ASP HB2 2.335 . 3.017 2.627 2.389 3.673 0.656 7 3 "[ . + 1 -*. 2]" 1
1811 1 86 LYS HB3 1 89 ASP H 2.573 . 3.400 2.581 1.881 3.141 . 0 0 "[ . 1 . 2]" 1
1812 1 86 LYS HG2 1 89 ASP H 3.003 . 4.130 4.245 3.358 5.129 0.999 16 4 "[ . * 1 *.+ -2]" 1
1813 1 127 ARG H 1 127 ARG QB 2.257 . 2.894 2.342 2.183 2.550 . 0 0 "[ . 1 . 2]" 1
1814 1 26 LEU H 1 26 LEU HA 2.786 . 3.756 2.846 2.794 2.896 . 0 0 "[ . 1 . 2]" 1
1815 1 25 ASN HB2 1 26 LEU H 3.402 . 4.849 3.781 2.703 4.404 . 0 0 "[ . 1 . 2]" 1
1816 1 30 GLU H 1 31 VAL QG 2.911 . 3.970 3.940 3.569 4.042 0.072 15 0 "[ . 1 . 2]" 1
1817 1 26 LEU H 1 26 LEU HB3 2.254 . 2.889 2.813 2.330 2.984 0.095 20 0 "[ . 1 . 2]" 1
1818 1 122 LYS H 1 122 LYS HB2 2.360 . 3.056 2.425 2.272 2.793 . 0 0 "[ . 1 . 2]" 1
1819 1 116 ALA HA 1 117 ASP H 2.273 . 2.919 2.091 2.017 2.276 . 0 0 "[ . 1 . 2]" 1
1820 1 116 ALA H 1 117 ASP H 3.273 . 4.612 3.670 3.281 4.292 . 0 0 "[ . 1 . 2]" 1
1821 1 117 ASP H 1 117 ASP HB2 2.752 . 3.699 2.597 2.258 3.352 . 0 0 "[ . 1 . 2]" 1
1822 1 117 ASP H 1 117 ASP HB3 2.845 . 3.857 3.138 2.763 3.499 . 0 0 "[ . 1 . 2]" 1
1823 1 125 ILE H 1 127 ARG H 3.141 . 4.374 3.944 3.762 4.085 . 0 0 "[ . 1 . 2]" 1
1824 1 125 ILE H 1 125 ILE HB 2.260 . 2.899 2.530 2.466 2.565 . 0 0 "[ . 1 . 2]" 1
1825 1 124 GLU H 1 125 ILE H 2.427 . 3.163 2.494 2.228 2.623 . 0 0 "[ . 1 . 2]" 1
1826 1 125 ILE H 1 125 ILE HG13 2.397 . 3.115 2.187 2.088 2.254 . 0 0 "[ . 1 . 2]" 1
1827 1 16 GLY HA2 1 17 ASP H 2.915 . 3.977 3.257 2.539 3.500 . 0 0 "[ . 1 . 2]" 1
1828 1 16 GLY HA3 1 17 ASP H 2.676 . 3.571 3.156 2.879 3.549 . 0 0 "[ . 1 . 2]" 1
1829 1 106 TYR H 1 106 TYR HA 2.766 . 3.722 2.933 2.893 2.951 . 0 0 "[ . 1 . 2]" 1
1830 1 106 TYR H 1 106 TYR HB2 2.261 . 2.900 2.308 2.184 2.447 . 0 0 "[ . 1 . 2]" 1
1831 1 105 LYS QG 1 106 TYR H 3.152 . 4.181 3.599 3.459 3.852 . 0 0 "[ . 1 . 2]" 1
1832 1 127 ARG H 1 128 GLN H 2.263 . 2.903 2.541 2.363 2.854 . 0 0 "[ . 1 . 2]" 1
1833 1 126 LYS H 1 127 ARG H 2.523 . 3.319 2.567 2.437 2.721 . 0 0 "[ . 1 . 2]" 1
1834 1 127 ARG H 1 127 ARG HA 2.256 . 2.892 2.840 2.771 2.877 . 0 0 "[ . 1 . 2]" 1
1835 1 126 LYS HA 1 127 ARG H 3.024 . 4.167 3.494 3.458 3.559 . 0 0 "[ . 1 . 2]" 1
1836 1 126 LYS HG2 1 127 ARG H 3.580 . 5.182 4.639 3.875 5.373 0.191 4 0 "[ . 1 . 2]" 1
1837 1 30 GLU H 1 31 VAL H 2.283 . 2.934 2.673 2.363 2.804 . 0 0 "[ . 1 . 2]" 1
1838 1 29 ASP HA 1 30 GLU H 2.824 . 3.821 3.521 3.445 3.577 . 0 0 "[ . 1 . 2]" 1
1839 1 30 GLU H 1 30 GLU HA 2.520 . 3.314 2.770 2.732 2.856 . 0 0 "[ . 1 . 2]" 1
1840 1 29 ASP HB2 1 30 GLU H 2.311 . 2.978 2.678 2.246 3.885 0.907 7 4 "[* - . + 1 *. 2]" 1
1841 1 116 ALA MB 1 117 ASP H 2.533 . 3.335 3.215 2.279 3.491 0.156 1 0 "[ . 1 . 2]" 1
1842 1 18 GLN H 1 18 GLN HA 2.552 . 3.366 2.881 2.551 2.947 . 0 0 "[ . 1 . 2]" 1
1843 1 17 ASP QB 1 18 GLN H 3.304 . 4.669 2.523 1.863 3.888 0.076 1 0 "[ . 1 . 2]" 1
1844 1 18 GLN H 1 18 GLN HB3 3.175 . 4.435 3.365 2.360 3.786 . 0 0 "[ . 1 . 2]" 1
1845 1 18 GLN H 1 19 ALA H 2.505 . 3.289 2.496 1.883 3.397 0.108 9 0 "[ . 1 . 2]" 1
1846 1 18 GLN H 1 18 GLN HG2 3.007 . 4.137 3.501 2.199 4.505 0.368 11 0 "[ . 1 . 2]" 1
1847 1 18 GLN H 1 18 GLN HB2 2.630 . 3.494 2.634 2.323 3.668 0.174 1 0 "[ . 1 . 2]" 1
1848 1 24 GLU H 1 24 GLU QG 2.739 . 2.908 1.834 1.653 1.956 0.148 3 0 "[ . 1 . 2]" 1
1849 1 24 GLU H 1 24 GLU HB2 2.451 . 3.202 2.960 2.683 3.573 0.371 19 0 "[ . 1 . 2]" 1
1850 1 23 ALA H 1 24 GLU H 2.806 . 3.790 2.789 2.046 3.871 0.081 8 0 "[ . 1 . 2]" 1
1851 1 24 GLU H 1 62 TYR HA 3.179 . 4.442 1.954 1.794 2.216 0.122 11 0 "[ . 1 . 2]" 1
1852 1 75 GLU H 1 75 GLU HA 2.393 . 3.109 2.813 2.772 2.868 . 0 0 "[ . 1 . 2]" 1
1853 1 74 GLU HA 1 75 GLU H 2.960 . 4.055 3.421 3.370 3.520 . 0 0 "[ . 1 . 2]" 1
1854 1 74 GLU QG 1 75 GLU H . . 2.916 2.465 2.143 2.898 . 0 0 "[ . 1 . 2]" 1
1855 1 75 GLU H 1 75 GLU HB2 2.304 . 2.968 2.428 2.192 2.607 . 0 0 "[ . 1 . 2]" 1
1856 1 68 TYR H 1 68 TYR HA 2.437 . 3.179 2.785 2.750 2.831 . 0 0 "[ . 1 . 2]" 1
1857 1 68 TYR H 1 68 TYR HB2 2.252 . 2.886 2.218 2.149 2.285 . 0 0 "[ . 1 . 2]" 1
1858 1 68 TYR H 1 68 TYR HB3 2.267 . 2.909 2.823 2.728 2.889 . 0 0 "[ . 1 . 2]" 1
1859 1 67 PRO HB2 1 68 TYR H 2.524 . 3.320 2.819 2.676 2.969 . 0 0 "[ . 1 . 2]" 1
1860 1 67 PRO HB3 1 68 TYR H 2.570 . 3.395 3.481 3.435 3.550 0.155 8 0 "[ . 1 . 2]" 1
1861 1 52 VAL H 1 52 VAL QG 2.262 . 2.902 2.563 2.278 2.780 . 0 0 "[ . 1 . 2]" 1
1862 1 44 ILE H 1 52 VAL H 3.162 . 4.412 4.237 4.049 4.388 . 0 0 "[ . 1 . 2]" 1
1863 1 46 ILE HA 1 52 VAL H 3.154 . 4.397 3.483 3.304 3.714 . 0 0 "[ . 1 . 2]" 1
1864 1 51 TYR HB2 1 52 VAL H 2.531 . 3.332 2.434 2.050 3.133 . 0 0 "[ . 1 . 2]" 1
1865 1 51 TYR HB3 1 52 VAL H 2.766 . 3.722 3.196 2.563 3.573 . 0 0 "[ . 1 . 2]" 1
1866 1 52 VAL H 1 52 VAL HB 2.269 . 2.912 2.831 2.756 2.920 0.008 17 0 "[ . 1 . 2]" 1
1867 1 45 LYS HB3 1 52 VAL H 3.100 . 4.301 3.050 2.614 3.425 . 0 0 "[ . 1 . 2]" 1
1868 1 97 GLY H 1 98 TYR H 3.424 . 4.890 4.482 4.377 4.553 . 0 0 "[ . 1 . 2]" 1
1869 1 97 GLY HA3 1 98 TYR H 2.255 . 2.891 2.659 2.435 2.812 . 0 0 "[ . 1 . 2]" 1
1870 1 98 TYR H 1 109 TYR H 2.566 . 3.389 2.560 2.447 2.927 . 0 0 "[ . 1 . 2]" 1
1871 1 98 TYR H 1 111 LYS H 3.788 . 5.582 4.953 4.853 5.136 . 0 0 "[ . 1 . 2]" 1
1872 1 98 TYR H 1 110 LEU H 4.061 . 6.123 4.571 4.441 4.765 . 0 0 "[ . 1 . 2]" 1
1873 1 98 TYR H 1 108 VAL HA 3.319 . 4.696 3.867 3.723 4.105 . 0 0 "[ . 1 . 2]" 1
1874 1 97 GLY HA2 1 98 TYR H 2.324 . 2.999 2.412 2.317 2.573 . 0 0 "[ . 1 . 2]" 1
1875 1 98 TYR H 1 98 TYR HB3 3.167 . 4.421 3.603 3.558 3.661 . 0 0 "[ . 1 . 2]" 1
1876 1 98 TYR H 1 98 TYR HB2 2.952 . 4.041 2.475 2.410 2.601 . 0 0 "[ . 1 . 2]" 1
1877 1 98 TYR H 1 100 ILE MG 2.881 . 3.918 4.082 4.028 4.141 0.223 4 0 "[ . 1 . 2]" 1
1878 1 98 TYR H 1 110 LEU QD 2.953 . 4.043 4.098 3.949 4.272 0.229 18 0 "[ . 1 . 2]" 1
1879 1 94 ILE HG13 1 98 TYR H 3.217 . 4.510 4.548 4.225 4.878 0.368 3 0 "[ . 1 . 2]" 1
1880 1 25 ASN H 1 26 LEU QD 4.491 . 7.012 4.151 2.662 4.802 . 0 0 "[ . 1 . 2]" 1
1881 1 25 ASN H 1 26 LEU H 2.474 . 3.239 2.181 1.786 2.451 . 0 0 "[ . 1 . 2]" 1
1882 1 25 ASN H 1 25 ASN HA 2.834 . 3.838 2.911 2.858 2.952 . 0 0 "[ . 1 . 2]" 1
1883 1 24 GLU HA 1 25 ASN H 2.256 . 2.892 2.165 2.086 2.488 . 0 0 "[ . 1 . 2]" 1
1884 1 25 ASN H 1 25 ASN HB3 2.938 . 4.017 2.983 2.389 3.658 . 0 0 "[ . 1 . 2]" 1
1885 1 24 GLU HB2 1 25 ASN H 3.148 . 4.387 3.874 2.412 4.296 . 0 0 "[ . 1 . 2]" 1
1886 1 21 GLN H 1 22 LYS H 3.565 . 5.154 4.509 4.173 4.655 . 0 0 "[ . 1 . 2]" 1
1887 1 21 GLN H 1 21 GLN HA 2.608 . 3.458 2.774 2.265 2.952 . 0 0 "[ . 1 . 2]" 1
1888 1 20 GLY HA2 1 21 GLN H 2.296 . 2.955 2.749 2.094 3.554 0.599 16 5 "[ * . *1 - .+ *]" 1
1889 1 21 GLN H 1 21 GLN HG2 2.867 . 3.894 3.257 1.932 4.233 0.339 5 0 "[ . 1 . 2]" 1
1890 1 122 LYS H 1 123 GLU H 2.641 . 3.513 2.635 2.513 2.805 . 0 0 "[ . 1 . 2]" 1
1891 1 123 GLU H 1 124 GLU H 2.363 . 3.061 2.612 2.311 2.833 . 0 0 "[ . 1 . 2]" 1
1892 1 121 THR HB 1 123 GLU H 2.512 . 3.301 2.427 2.309 2.628 . 0 0 "[ . 1 . 2]" 1
1893 1 123 GLU H 1 123 GLU HA 2.296 . 2.955 2.826 2.782 2.881 . 0 0 "[ . 1 . 2]" 1
1894 1 123 GLU H 1 123 GLU HG2 2.985 . 4.099 3.401 2.439 3.677 . 0 0 "[ . 1 . 2]" 1
1895 1 123 GLU H 1 123 GLU HG3 2.859 . 3.880 2.335 1.820 3.805 0.018 9 0 "[ . 1 . 2]" 1
1896 1 74 GLU QG 1 123 GLU H 3.544 . 5.114 4.218 3.927 4.648 . 0 0 "[ . 1 . 2]" 1
1897 1 123 GLU H 1 123 GLU HB2 2.259 . 2.897 2.470 2.352 2.639 . 0 0 "[ . 1 . 2]" 1
1898 1 122 LYS HB2 1 123 GLU H 2.474 . 3.239 2.800 2.457 3.140 . 0 0 "[ . 1 . 2]" 1
1899 1 122 LYS QG 1 123 GLU H 3.402 . 4.849 4.148 3.741 4.373 . 0 0 "[ . 1 . 2]" 1
1900 1 32 SER H 1 34 ARG H 3.515 . 5.059 4.157 3.885 4.318 . 0 0 "[ . 1 . 2]" 1
1901 1 77 LEU H 1 77 LEU HB2 2.254 . 2.889 2.606 2.243 3.575 0.686 18 5 "[-* . * 1 .* + 2]" 1
1902 1 77 LEU H 1 78 MET H 3.225 . 4.525 4.545 4.483 4.597 0.072 18 0 "[ . 1 . 2]" 1
1903 1 74 GLU HA 1 77 LEU H 2.933 . 4.008 3.378 3.117 3.730 . 0 0 "[ . 1 . 2]" 1
1904 1 90 ILE H 1 90 ILE HG13 2.326 . 3.002 2.137 2.026 2.333 . 0 0 "[ . 1 . 2]" 1
1905 1 89 ASP HB2 1 90 ILE H 3.443 . 4.925 3.236 2.917 3.884 . 0 0 "[ . 1 . 2]" 1
1906 1 34 ARG H 1 35 GLU H 2.258 . 2.895 2.565 2.390 2.833 . 0 0 "[ . 1 . 2]" 1
1907 1 31 VAL H 1 34 ARG H 3.678 . 5.369 4.896 4.791 5.050 . 0 0 "[ . 1 . 2]" 1
1908 1 33 LYS HB2 1 34 ARG H 2.252 . 2.886 2.809 2.638 2.952 0.066 1 0 "[ . 1 . 2]" 1
1909 1 34 ARG H 1 34 ARG HG3 2.613 . 3.467 2.852 2.440 4.397 0.930 9 2 "[ -. +1 . 2]" 1
1910 1 73 SER H 1 75 GLU H 3.970 . 5.940 4.993 4.805 5.275 . 0 0 "[ . 1 . 2]" 1
1911 1 73 SER H 1 73 SER QB 2.627 . 3.194 2.232 2.179 2.390 . 0 0 "[ . 1 . 2]" 1
1912 1 73 SER H 1 76 LEU HG 3.801 . 5.607 4.355 4.114 4.562 . 0 0 "[ . 1 . 2]" 1
1913 1 72 ILE MG 1 73 SER H 2.257 . 2.894 2.069 1.604 2.196 0.016 2 0 "[ . 1 . 2]" 1
1914 1 72 ILE MD 1 73 SER H 3.538 . 5.102 3.664 3.531 3.774 . 0 0 "[ . 1 . 2]" 1
1915 1 125 ILE HB 1 126 LYS H 2.253 . 2.888 2.543 2.375 2.761 . 0 0 "[ . 1 . 2]" 1
1916 1 125 ILE H 1 126 LYS H 2.475 . 3.241 2.824 2.713 2.955 . 0 0 "[ . 1 . 2]" 1
1917 1 123 GLU HA 1 126 LYS H 2.797 . 3.775 3.885 3.809 4.019 0.244 16 0 "[ . 1 . 2]" 1
1918 1 125 ILE MG 1 126 LYS H 2.663 . 3.549 3.224 3.002 3.425 . 0 0 "[ . 1 . 2]" 1
1919 1 43 VAL H 1 73 SER H 3.464 . 4.964 3.993 3.754 4.277 . 0 0 "[ . 1 . 2]" 1
1920 1 129 LYS H 1 130 GLN H 2.286 . 2.939 2.454 2.280 2.599 . 0 0 "[ . 1 . 2]" 1
1921 1 129 LYS H 1 129 LYS HA 2.270 . 2.914 2.890 2.856 2.912 . 0 0 "[ . 1 . 2]" 1
1922 1 129 LYS H 1 129 LYS HG2 2.846 . 3.858 2.471 2.376 2.831 . 0 0 "[ . 1 . 2]" 1
1923 1 112 ASP H 1 114 ALA H 3.488 . 5.009 5.064 5.004 5.132 0.123 15 0 "[ . 1 . 2]" 1
1924 1 111 LYS H 1 112 ASP H 2.264 . 2.905 2.372 2.300 2.470 . 0 0 "[ . 1 . 2]" 1
1925 1 112 ASP H 1 112 ASP HA 2.675 . 3.570 2.922 2.878 2.942 . 0 0 "[ . 1 . 2]" 1
1926 1 111 LYS HA 1 112 ASP H 2.738 . 3.675 3.417 3.382 3.471 . 0 0 "[ . 1 . 2]" 1
1927 1 112 ASP H 1 112 ASP HB2 2.405 . 3.128 3.131 2.536 3.455 0.327 18 0 "[ . 1 . 2]" 1
1928 1 112 ASP H 1 112 ASP HB3 2.595 . 3.437 2.921 2.738 3.661 0.224 12 0 "[ . 1 . 2]" 1
1929 1 111 LYS HB3 1 112 ASP H 2.944 . 4.027 4.035 3.851 4.099 0.072 13 0 "[ . 1 . 2]" 1
1930 1 111 LYS HB2 1 112 ASP H 2.478 . 3.246 3.145 2.956 3.269 0.023 15 0 "[ . 1 . 2]" 1
1931 1 110 LEU HB3 1 112 ASP H 2.700 . 3.611 3.499 3.315 3.650 0.039 4 0 "[ . 1 . 2]" 1
1932 1 113 ALA H 1 114 ALA H 2.310 . 2.977 2.521 2.436 2.709 . 0 0 "[ . 1 . 2]" 1
1933 1 114 ALA H 1 114 ALA HA 2.248 . 2.879 2.883 2.826 2.923 0.044 19 0 "[ . 1 . 2]" 1
1934 1 93 GLU HG2 1 94 ILE H 3.145 . 4.382 2.951 2.625 3.403 . 0 0 "[ . 1 . 2]" 1
1935 1 94 ILE H 1 94 ILE HG12 2.708 . 3.625 2.078 1.927 2.143 . 0 0 "[ . 1 . 2]" 1
1936 1 94 ILE H 1 94 ILE HG13 2.655 . 3.536 3.069 2.965 3.132 . 0 0 "[ . 1 . 2]" 1
1937 1 117 ASP H 1 119 ILE H 3.348 . 4.749 3.114 2.580 4.049 . 0 0 "[ . 1 . 2]" 1
1938 1 119 ILE H 1 119 ILE HG12 2.259 . 2.897 2.682 2.455 2.944 0.047 18 0 "[ . 1 . 2]" 1
1939 1 63 ASN H 1 63 ASN HA 2.808 . 3.793 2.944 2.916 2.960 . 0 0 "[ . 1 . 2]" 1
1940 1 63 ASN H 1 63 ASN HB2 2.264 . 2.905 3.024 2.632 3.528 0.623 12 4 "[ .* 1 +- . * 2]" 1
1941 1 62 TYR QB 1 63 ASN H 2.772 . 3.733 2.726 1.995 3.602 . 0 0 "[ . 1 . 2]" 1
1942 1 23 ALA MB 1 63 ASN H 2.768 . 3.726 3.707 3.228 3.864 0.138 19 0 "[ . 1 . 2]" 1
1943 1 108 VAL H 1 108 VAL MG2 2.259 . 2.897 2.924 2.844 3.078 0.181 18 0 "[ . 1 . 2]" 1
1944 1 107 TYR HB3 1 108 VAL H 2.479 . 3.247 2.290 2.127 2.449 . 0 0 "[ . 1 . 2]" 1
1945 1 107 TYR HB2 1 108 VAL H 2.752 . 3.699 3.331 3.116 3.470 . 0 0 "[ . 1 . 2]" 1
1946 1 112 ASP H 1 116 ALA HA 4.178 . 6.360 6.486 6.431 6.632 0.272 14 0 "[ . 1 . 2]" 1
1947 1 59 TYR H 1 59 TYR QD 3.952 . 5.904 3.344 3.284 3.427 . 0 0 "[ . 1 . 2]" 1
1948 1 58 HIS HA 1 59 TYR H 2.715 . 3.636 2.498 2.425 2.580 . 0 0 "[ . 1 . 2]" 1
1949 1 58 HIS HB3 1 59 TYR H 2.574 . 3.402 3.460 3.414 3.507 0.105 11 0 "[ . 1 . 2]" 1
1950 1 59 TYR H 1 59 TYR HB2 2.892 . 3.937 2.559 2.513 2.591 . 0 0 "[ . 1 . 2]" 1
1951 1 58 HIS HB2 1 59 TYR H 2.440 . 3.184 2.029 1.923 2.119 . 0 0 "[ . 1 . 2]" 1
1952 1 43 VAL HA 1 44 ILE H 2.413 . 3.141 2.144 2.115 2.160 . 0 0 "[ . 1 . 2]" 1
1953 1 44 ILE H 1 44 ILE MG 2.474 . 3.239 2.750 2.663 2.915 . 0 0 "[ . 1 . 2]" 1
1954 1 42 ILE QG 1 44 ILE H 4.349 . 6.714 6.607 6.496 6.745 0.031 3 0 "[ . 1 . 2]" 1
1955 1 51 TYR H 1 52 VAL QG 3.451 . 4.940 4.325 4.122 4.774 . 0 0 "[ . 1 . 2]" 1
1956 1 24 GLU H 1 63 ASN H 2.970 . 4.072 3.451 2.949 4.084 0.012 8 0 "[ . 1 . 2]" 1
1957 1 51 TYR H 1 51 TYR QD 3.372 . 4.793 3.279 2.863 3.485 . 0 0 "[ . 1 . 2]" 1
1958 1 51 TYR H 1 51 TYR HA 2.806 . 3.791 2.908 2.876 2.939 . 0 0 "[ . 1 . 2]" 1
1959 1 50 GLY QA 1 51 TYR H 2.313 . 2.982 2.223 2.100 2.330 . 0 0 "[ . 1 . 2]" 1
1960 1 51 TYR H 1 51 TYR HB3 3.639 . 5.294 3.611 3.353 3.926 . 0 0 "[ . 1 . 2]" 1
1961 1 65 LYS H 1 65 LYS HB2 2.264 . 2.905 2.453 2.340 2.630 . 0 0 "[ . 1 . 2]" 1
1962 1 76 LEU H 1 77 LEU H 2.263 . 2.903 2.340 2.155 2.515 . 0 0 "[ . 1 . 2]" 1
1963 1 76 LEU H 1 76 LEU HB2 2.280 . 2.930 2.439 2.361 2.532 . 0 0 "[ . 1 . 2]" 1
1964 1 76 LEU H 1 76 LEU HG 2.286 . 2.939 2.733 2.463 2.894 . 0 0 "[ . 1 . 2]" 1
1965 1 75 GLU H 1 76 LEU H 2.351 . 3.042 2.600 2.443 2.714 . 0 0 "[ . 1 . 2]" 1
1966 1 74 GLU HA 1 76 LEU H 3.210 . 4.498 3.660 3.448 3.951 . 0 0 "[ . 1 . 2]" 1
1967 1 75 GLU HB3 1 76 LEU H 3.245 . 4.561 3.893 3.681 4.150 . 0 0 "[ . 1 . 2]" 1
1968 1 76 LEU H 1 77 LEU HG 3.302 . 4.665 4.104 3.766 4.774 0.109 7 0 "[ . 1 . 2]" 1
1969 1 76 LEU H 1 76 LEU MD2 2.894 . 3.941 3.702 3.520 3.814 . 0 0 "[ . 1 . 2]" 1
1970 1 57 ASP HA 1 58 HIS H 2.944 . 4.028 3.332 3.258 3.421 . 0 0 "[ . 1 . 2]" 1
1971 1 56 GLY HA3 1 58 HIS H 3.851 . 5.705 3.647 3.533 3.749 . 0 0 "[ . 1 . 2]" 1
1972 1 58 HIS H 1 58 HIS HB3 3.570 . 5.163 3.292 3.186 3.380 . 0 0 "[ . 1 . 2]" 1
1973 1 46 ILE HA 1 47 THR H 2.257 . 2.894 2.213 2.172 2.254 . 0 0 "[ . 1 . 2]" 1
1974 1 47 THR H 1 47 THR HA 2.739 . 3.677 2.923 2.913 2.930 . 0 0 "[ . 1 . 2]" 1
1975 1 47 THR H 1 51 TYR HB3 3.597 . 5.214 3.463 3.259 3.792 . 0 0 "[ . 1 . 2]" 1
1976 1 128 GLN H 1 129 LYS H 2.583 . 3.417 2.530 2.374 2.651 . 0 0 "[ . 1 . 2]" 1
1977 1 128 GLN H 1 128 GLN HA 2.593 . 3.433 2.834 2.798 2.871 . 0 0 "[ . 1 . 2]" 1
1978 1 125 ILE HA 1 128 GLN H 3.731 . 5.471 3.339 3.066 3.762 . 0 0 "[ . 1 . 2]" 1
1979 1 128 GLN H 1 128 GLN QG 2.634 . 3.501 2.293 2.058 2.591 . 0 0 "[ . 1 . 2]" 1
1980 1 127 ARG QB 1 128 GLN H 2.396 . 3.114 2.464 2.284 2.671 . 0 0 "[ . 1 . 2]" 1
1981 1 128 GLN H 1 129 LYS QB 2.895 . 3.943 4.554 4.380 4.638 0.695 5 18 "[***-+***** ******* *]" 1
1982 1 58 HIS H 1 58 HIS HB2 3.813 . 5.630 3.817 3.722 3.857 . 0 0 "[ . 1 . 2]" 1
1983 1 102 VAL H 1 107 TYR H 3.474 . 4.983 4.046 3.897 4.169 . 0 0 "[ . 1 . 2]" 1
1984 1 106 TYR H 1 107 TYR H 3.641 . 5.298 4.446 4.384 4.500 . 0 0 "[ . 1 . 2]" 1
1985 1 101 LYS HA 1 107 TYR H 2.925 . 3.994 3.374 3.236 3.563 . 0 0 "[ . 1 . 2]" 1
1986 1 107 TYR H 1 107 TYR HB3 3.296 . 4.654 3.871 3.841 3.896 . 0 0 "[ . 1 . 2]" 1
1987 1 106 TYR HB2 1 107 TYR H 3.133 . 4.360 4.316 4.194 4.361 0.001 7 0 "[ . 1 . 2]" 1
1988 1 106 TYR HB3 1 107 TYR H 2.824 . 3.821 3.335 3.223 3.441 . 0 0 "[ . 1 . 2]" 1
1989 1 100 ILE QG 1 107 TYR H 3.033 . 3.859 2.666 2.598 2.835 . 0 0 "[ . 1 . 2]" 1
1990 1 99 VAL QG 1 107 TYR H 3.096 . 4.294 4.087 3.876 4.205 . 0 0 "[ . 1 . 2]" 1
1991 1 100 ILE MD 1 107 TYR H 3.444 . 4.927 4.239 4.173 4.403 . 0 0 "[ . 1 . 2]" 1
1992 1 107 TYR H 1 107 TYR HB2 3.073 . 4.253 2.830 2.768 2.887 . 0 0 "[ . 1 . 2]" 1
1993 1 53 THR H 1 60 HIS QB 4.066 . 6.132 3.637 3.447 3.854 . 0 0 "[ . 1 . 2]" 1
1994 1 52 VAL HB 1 53 THR H 3.668 . 5.350 4.035 3.848 4.150 . 0 0 "[ . 1 . 2]" 1
1995 1 53 THR H 1 53 THR MG 2.805 . 3.789 2.761 2.658 2.887 . 0 0 "[ . 1 . 2]" 1
1996 1 52 VAL QG 1 53 THR H 2.316 . 2.987 2.650 2.428 2.814 . 0 0 "[ . 1 . 2]" 1
1997 1 117 ASP H 1 118 ASN H 2.423 . 3.157 3.227 2.567 3.443 0.286 1 0 "[ . 1 . 2]" 1
1998 1 118 ASN H 1 119 ILE H 2.253 . 2.888 2.382 2.238 2.817 . 0 0 "[ . 1 . 2]" 1
1999 1 118 ASN H 1 118 ASN HA 2.314 . 2.983 2.289 2.252 2.324 . 0 0 "[ . 1 . 2]" 1
2000 1 116 ALA MB 1 118 ASN H 2.319 . 2.991 3.148 2.650 3.274 0.283 19 0 "[ . 1 . 2]" 1
2001 1 34 ARG HA 1 35 GLU H 2.805 . 3.789 3.525 3.447 3.569 . 0 0 "[ . 1 . 2]" 1
2002 1 35 GLU H 1 35 GLU HG2 2.501 . 3.283 2.003 1.725 2.224 . 0 0 "[ . 1 . 2]" 1
2003 1 35 GLU H 1 35 GLU HB3 2.282 . 2.933 2.806 2.578 2.989 0.056 18 0 "[ . 1 . 2]" 1
2004 1 34 ARG QB 1 35 GLU H 2.436 . 3.178 2.719 2.446 3.157 . 0 0 "[ . 1 . 2]" 1
2005 1 31 VAL QG 1 35 GLU H 3.681 . 5.375 4.284 3.928 4.521 . 0 0 "[ . 1 . 2]" 1
2006 1 53 THR H 1 60 HIS H 2.371 . 3.073 3.007 2.830 3.167 0.094 5 0 "[ . 1 . 2]" 1
2007 1 59 TYR HA 1 60 HIS H 2.258 . 2.895 2.165 2.146 2.187 . 0 0 "[ . 1 . 2]" 1
2008 1 52 VAL HA 1 60 HIS H 3.537 . 5.101 4.575 4.337 4.790 . 0 0 "[ . 1 . 2]" 1
2009 1 59 TYR HB3 1 60 HIS H 2.637 . 3.506 3.256 3.206 3.325 . 0 0 "[ . 1 . 2]" 1
2010 1 52 VAL QG 1 60 HIS H 2.742 . 3.682 3.029 2.854 3.258 . 0 0 "[ . 1 . 2]" 1
2011 1 44 ILE H 1 54 SER H 3.487 . 5.007 3.163 2.963 3.390 . 0 0 "[ . 1 . 2]" 1
2012 1 42 ILE H 1 54 SER H 2.740 . 3.679 3.584 3.257 3.738 0.059 15 0 "[ . 1 . 2]" 1
2013 1 53 THR HA 1 54 SER H 2.252 . 2.886 2.213 2.162 2.276 . 0 0 "[ . 1 . 2]" 1
2014 1 43 VAL HA 1 54 SER H 3.216 . 4.509 3.577 3.351 3.729 . 0 0 "[ . 1 . 2]" 1
2015 1 54 SER H 1 54 SER HB2 2.620 . 3.478 3.052 2.572 3.686 0.208 11 0 "[ . 1 . 2]" 1
2016 1 54 SER H 1 54 SER HB3 2.853 . 3.871 2.680 2.456 3.671 . 0 0 "[ . 1 . 2]" 1
2017 1 42 ILE MD 1 54 SER H 3.641 . 5.298 4.793 4.523 5.076 . 0 0 "[ . 1 . 2]" 1
2018 1 53 THR H 1 54 SER H 4.152 . 6.307 4.476 4.430 4.529 . 0 0 "[ . 1 . 2]" 1
2019 1 81 PRO HD2 1 82 ASN H 2.787 . 3.758 2.698 2.214 2.948 . 0 0 "[ . 1 . 2]" 1
2020 1 81 PRO HD3 1 82 ASN H 2.804 . 3.786 3.862 3.606 3.981 0.195 12 0 "[ . 1 . 2]" 1
2021 1 80 ASP HB3 1 82 ASN H 3.320 . 4.697 3.252 2.426 5.591 0.894 16 1 "[ . 1 .+ 2]" 1
2022 1 82 ASN H 1 82 ASN HB3 2.269 . 2.912 2.548 2.466 2.652 . 0 0 "[ . 1 . 2]" 1
2023 1 82 ASN H 1 82 ASN HB2 2.341 . 3.026 2.856 2.543 3.055 0.029 14 0 "[ . 1 . 2]" 1
2024 1 81 PRO HG2 1 82 ASN H 2.790 . 3.763 2.876 2.105 3.110 . 0 0 "[ . 1 . 2]" 1
2025 1 47 THR H 1 48 ASP H 3.655 . 5.325 4.382 4.353 4.406 . 0 0 "[ . 1 . 2]" 1
2026 1 48 ASP H 1 106 TYR QE 3.181 . 4.446 4.092 2.937 4.491 0.045 16 0 "[ . 1 . 2]" 1
2027 1 48 ASP H 1 48 ASP HA 2.789 . 3.762 2.869 2.817 2.902 . 0 0 "[ . 1 . 2]" 1
2028 1 48 ASP H 1 49 GLN HA 3.758 . 5.523 5.090 4.906 5.291 . 0 0 "[ . 1 . 2]" 1
2029 1 48 ASP H 1 48 ASP HB2 2.669 . 3.560 3.054 2.333 3.674 0.114 7 0 "[ . 1 . 2]" 1
2030 1 48 ASP H 1 48 ASP HB3 2.413 . 3.141 2.692 2.438 3.588 0.447 1 0 "[ . 1 . 2]" 1
2031 1 47 THR MG 1 48 ASP H 2.780 . 3.746 3.576 3.453 3.859 0.113 8 0 "[ . 1 . 2]" 1
2032 1 47 THR HA 1 48 ASP H 2.260 . 2.898 2.573 2.309 2.698 . 0 0 "[ . 1 . 2]" 1
2033 1 31 VAL H 1 32 SER H 2.260 . 2.898 2.861 2.710 2.991 0.093 4 0 "[ . 1 . 2]" 1
2034 1 32 SER H 1 33 LYS H 2.360 . 3.056 2.724 2.515 2.963 . 0 0 "[ . 1 . 2]" 1
2035 1 32 SER H 1 41 GLN HE21 2.925 . 3.995 3.630 3.187 4.039 0.044 7 0 "[ . 1 . 2]" 1
2036 1 32 SER H 1 41 GLN HE22 2.963 . 4.061 3.365 2.682 4.119 0.058 9 0 "[ . 1 . 2]" 1
2037 1 32 SER H 1 32 SER HB2 2.343 . 3.029 2.388 2.000 3.113 0.084 10 0 "[ . 1 . 2]" 1
2038 1 31 VAL HA 1 32 SER H 3.240 . 4.552 3.547 3.521 3.590 . 0 0 "[ . 1 . 2]" 1
2039 1 31 VAL HB 1 32 SER H 2.353 . 3.045 2.136 2.031 2.267 . 0 0 "[ . 1 . 2]" 1
2040 1 49 GLN H 1 50 GLY H 2.262 . 2.902 2.376 2.180 2.563 . 0 0 "[ . 1 . 2]" 1
2041 1 48 ASP H 1 49 GLN H 2.627 . 3.489 2.459 2.217 2.681 . 0 0 "[ . 1 . 2]" 1
2042 1 47 THR HB 1 49 GLN H 2.403 . 3.125 2.623 2.282 3.083 . 0 0 "[ . 1 . 2]" 1
2043 1 49 GLN H 1 49 GLN HA 2.560 . 3.379 2.905 2.871 2.939 . 0 0 "[ . 1 . 2]" 1
2044 1 48 ASP HB2 1 49 GLN H 3.487 . 5.007 4.021 3.188 4.417 . 0 0 "[ . 1 . 2]" 1
2045 1 49 GLN H 1 49 GLN HG2 3.326 . 4.709 4.098 3.575 4.477 . 0 0 "[ . 1 . 2]" 1
2046 1 49 GLN H 1 49 GLN HG3 3.290 . 4.643 3.639 2.334 4.604 . 0 0 "[ . 1 . 2]" 1
2047 1 49 GLN H 1 49 GLN QB 2.790 . 3.059 2.373 2.127 2.603 . 0 0 "[ . 1 . 2]" 1
2048 1 47 THR MG 1 49 GLN H 3.669 . 5.352 4.144 3.825 4.551 . 0 0 "[ . 1 . 2]" 1
2049 1 130 GLN H 1 130 GLN HG2 2.606 . 3.455 3.457 2.049 3.656 0.201 6 0 "[ . 1 . 2]" 1
2050 1 130 GLN H 1 130 GLN HB2 2.255 . 2.891 2.560 2.395 3.628 0.737 11 2 "[ . - 1+ . 2]" 1
2051 1 115 HIS H 1 115 HIS HA 2.503 . 3.286 2.941 2.886 2.955 . 0 0 "[ . 1 . 2]" 1
2052 1 114 ALA H 1 115 HIS H 2.267 . 2.909 2.466 2.284 2.685 . 0 0 "[ . 1 . 2]" 1
2053 1 115 HIS H 1 116 ALA H 2.257 . 2.894 2.342 2.069 2.474 . 0 0 "[ . 1 . 2]" 1
2054 1 115 HIS H 1 116 ALA MB 3.318 . 4.694 4.674 4.510 4.762 0.068 14 0 "[ . 1 . 2]" 1
2055 1 114 ALA MB 1 115 HIS H 2.626 . 3.488 2.673 2.512 3.257 . 0 0 "[ . 1 . 2]" 1
2056 1 29 ASP H 1 30 GLU H 2.341 . 3.026 2.512 2.372 2.671 . 0 0 "[ . 1 . 2]" 1
2057 1 29 ASP H 1 29 ASP HA 2.270 . 2.914 2.862 2.829 2.896 . 0 0 "[ . 1 . 2]" 1
2058 1 28 PRO HD2 1 29 ASP H 2.964 . 4.062 3.247 3.000 3.454 . 0 0 "[ . 1 . 2]" 1
2059 1 28 PRO HG2 1 29 ASP H 2.260 . 2.899 2.740 2.465 2.938 0.039 4 0 "[ . 1 . 2]" 1
2060 1 28 PRO HB3 1 29 ASP H 3.091 . 4.285 4.150 4.017 4.318 0.033 5 0 "[ . 1 . 2]" 1
2061 1 37 ILE H 1 58 HIS HE1 3.924 . 5.849 4.956 4.624 5.253 . 0 0 "[ . 1 . 2]" 1
2062 1 36 GLY HA3 1 37 ILE H 3.104 . 4.308 2.750 2.536 3.194 . 0 0 "[ . 1 . 2]" 1
2063 1 35 GLU HB3 1 37 ILE H 3.548 . 5.121 5.066 4.451 5.257 0.136 1 0 "[ . 1 . 2]" 1
2064 1 37 ILE H 1 37 ILE HB 3.043 . 4.200 3.568 2.093 3.669 . 0 0 "[ . 1 . 2]" 1
2065 1 37 ILE H 1 37 ILE HG12 2.824 . 3.821 2.030 1.795 3.034 0.032 15 0 "[ . 1 . 2]" 1
2066 1 37 ILE H 1 37 ILE HG13 2.452 . 3.203 3.116 2.803 3.380 0.177 11 0 "[ . 1 . 2]" 1
2067 1 37 ILE H 1 37 ILE MD 3.483 . 5.000 3.640 3.497 4.226 . 0 0 "[ . 1 . 2]" 1
2068 1 68 TYR HB3 1 69 ASP H 2.261 . 2.900 2.707 2.532 2.944 0.044 18 0 "[ . 1 . 2]" 1
2069 1 67 PRO HB3 1 69 ASP H 3.102 . 4.305 4.378 4.259 4.421 0.116 4 0 "[ . 1 . 2]" 1
2070 1 68 TYR H 1 69 ASP H 2.256 . 2.892 2.772 2.618 2.885 . 0 0 "[ . 1 . 2]" 1
2071 1 69 ASP H 1 69 ASP HA 2.550 . 3.363 2.928 2.908 2.944 . 0 0 "[ . 1 . 2]" 1
2072 1 68 TYR HB2 1 69 ASP H 2.860 . 3.882 3.717 3.609 3.897 0.015 19 0 "[ . 1 . 2]" 1
2073 1 120 ARG HA 1 121 THR H 2.251 . 2.884 2.160 2.119 2.200 . 0 0 "[ . 1 . 2]" 1
2074 1 119 ILE MG 1 121 THR H 3.722 . 5.453 3.803 3.090 4.315 . 0 0 "[ . 1 . 2]" 1
2075 1 74 GLU H 1 121 THR H 3.736 . 5.481 4.839 4.576 5.223 . 0 0 "[ . 1 . 2]" 1
2076 1 121 THR H 1 124 GLU H 3.670 . 5.353 3.572 3.261 3.930 . 0 0 "[ . 1 . 2]" 1
2077 1 121 THR H 1 121 THR HA 2.896 . 3.944 2.828 2.805 2.860 . 0 0 "[ . 1 . 2]" 1
2078 1 121 THR H 1 124 GLU HB2 2.755 . 3.703 3.137 2.661 3.763 0.060 3 0 "[ . 1 . 2]" 1
2079 1 120 ARG HB2 1 121 THR H 3.137 . 4.367 4.242 3.950 4.446 0.079 13 0 "[ . 1 . 2]" 1
2080 1 55 HIS HA 1 56 GLY H 2.323 . 2.997 2.283 2.216 2.351 . 0 0 "[ . 1 . 2]" 1
2081 1 56 GLY H 1 129 LYS HA 4.233 . 6.473 4.171 3.825 4.401 . 0 0 "[ . 1 . 2]" 1
2082 1 56 GLY H 1 56 GLY HA2 2.442 . 3.187 2.298 2.293 2.312 . 0 0 "[ . 1 . 2]" 1
2083 1 56 GLY H 1 56 GLY HA3 2.605 . 3.453 2.841 2.822 2.876 . 0 0 "[ . 1 . 2]" 1
2084 1 39 ALA MB 1 56 GLY H 2.511 . 3.299 2.021 1.844 2.309 . 0 0 "[ . 1 . 2]" 1
2085 1 55 HIS H 1 56 GLY H 3.287 . 4.637 4.441 4.421 4.456 . 0 0 "[ . 1 . 2]" 1
2086 1 56 GLY H 1 128 GLN QB 3.844 . 5.691 5.273 4.621 5.813 0.122 9 0 "[ . 1 . 2]" 1
2087 1 53 THR MG 1 56 GLY H 4.732 . 7.530 7.420 7.032 7.642 0.112 9 0 "[ . 1 . 2]" 1
2088 1 37 ILE MD 1 56 GLY H 4.066 . 6.132 3.481 3.301 4.093 . 0 0 "[ . 1 . 2]" 1
2089 1 68 TYR HA 1 69 ASP H 3.330 . 4.716 3.533 3.487 3.564 . 0 0 "[ . 1 . 2]" 1
2090 1 67 PRO HB2 1 69 ASP H 2.575 . 3.404 2.729 2.627 2.821 . 0 0 "[ . 1 . 2]" 1
2091 1 69 ASP H 1 70 ALA MB 3.481 . 4.996 4.151 3.990 4.246 . 0 0 "[ . 1 . 2]" 1
2092 1 96 GLY H 1 97 GLY H 2.412 . 3.139 3.115 2.982 3.258 0.119 19 0 "[ . 1 . 2]" 1
2093 1 96 GLY H 1 96 GLY HA3 2.332 . 3.012 2.883 2.838 2.898 . 0 0 "[ . 1 . 2]" 1
2094 1 96 GLY H 1 96 GLY HA2 2.297 . 2.957 2.306 2.282 2.318 . 0 0 "[ . 1 . 2]" 1
2095 1 95 LYS HB3 1 96 GLY H 3.625 . 5.267 4.168 3.987 4.312 . 0 0 "[ . 1 . 2]" 1
2096 1 95 LYS HG3 1 96 GLY H 2.883 . 3.922 3.476 2.681 3.951 0.029 13 0 "[ . 1 . 2]" 1
2097 1 124 GLU HG3 1 128 GLN QE 4.494 . 7.019 4.928 3.636 5.646 . 0 0 "[ . 1 . 2]" 1
2098 1 40 GLU HB2 1 128 GLN QE 3.655 . 5.325 3.836 2.689 5.284 . 0 0 "[ . 1 . 2]" 1
2099 1 66 VAL MG2 1 92 ASN HD21 3.176 . 4.437 4.195 3.885 4.524 0.087 2 0 "[ . 1 . 2]" 1
2100 1 88 SER H 1 89 ASP H 2.478 . 3.245 2.398 2.294 2.548 . 0 0 "[ . 1 . 2]" 1
2101 1 88 SER H 1 90 ILE H 3.559 . 5.142 3.811 3.690 3.950 . 0 0 "[ . 1 . 2]" 1
2102 1 88 SER H 1 88 SER HA 2.358 . 3.053 2.883 2.858 2.900 . 0 0 "[ . 1 . 2]" 1
2103 1 88 SER H 1 88 SER QB 2.640 . 3.004 2.293 2.204 2.629 . 0 0 "[ . 1 . 2]" 1
2104 1 87 ASP HB2 1 88 SER H 2.460 . 3.216 3.318 2.835 4.205 0.989 11 4 "[ - . * 1+ . *]" 1
2105 1 86 LYS HB2 1 88 SER H 3.014 . 4.150 4.365 4.221 4.633 0.483 4 0 "[ . 1 . 2]" 1
2106 1 86 LYS HD2 1 88 SER H 3.624 . 5.265 3.833 2.403 4.726 . 0 0 "[ . 1 . 2]" 1
2107 1 86 LYS HG2 1 88 SER H 3.050 . 4.213 3.782 3.197 5.191 0.978 16 2 "[ . 1 .+ -2]" 1
2108 1 32 SER HB2 1 41 GLN HE21 4.549 . 7.136 4.047 1.835 5.149 0.127 14 0 "[ . 1 . 2]" 1
2109 1 71 ILE MG 1 118 ASN HD22 4.082 . 6.164 5.701 5.249 6.353 0.189 18 0 "[ . 1 . 2]" 1
2110 1 71 ILE MG 1 118 ASN HD21 3.753 . 5.513 5.555 5.290 5.819 0.306 11 0 "[ . 1 . 2]" 1
2111 1 26 LEU HA 1 27 THR H 2.289 . 2.944 2.492 2.339 2.679 . 0 0 "[ . 1 . 2]" 1
2112 1 26 LEU HG 1 27 THR H 2.277 . 2.925 2.330 1.913 2.776 . 0 0 "[ . 1 . 2]" 1
2113 1 27 THR H 1 30 GLU H 3.287 . 4.637 4.252 3.816 4.681 0.044 11 0 "[ . 1 . 2]" 1
2114 1 27 THR H 1 30 GLU HB3 2.997 . 4.120 3.855 3.440 4.207 0.087 5 0 "[ . 1 . 2]" 1
2115 1 64 GLY H 1 65 LYS H 3.500 . 5.031 4.523 4.360 4.628 . 0 0 "[ . 1 . 2]" 1
2116 1 50 GLY QA 1 64 GLY H 2.899 . 3.950 2.768 2.217 3.803 . 0 0 "[ . 1 . 2]" 1
2117 1 63 ASN HB3 1 64 GLY H 2.676 . 3.571 3.733 2.886 4.211 0.640 17 3 "[ .* 1 - . + 2]" 1
2118 1 63 ASN HB2 1 64 GLY H 3.110 . 4.319 3.835 2.824 4.158 . 0 0 "[ . 1 . 2]" 1
2119 1 91 VAL HB 1 92 ASN H 2.258 . 2.895 2.698 2.483 2.915 0.020 11 0 "[ . 1 . 2]" 1
2120 1 91 VAL H 1 92 ASN H 2.296 . 2.955 2.158 2.070 2.334 . 0 0 "[ . 1 . 2]" 1
2121 1 92 ASN H 1 99 VAL QG 3.401 . 4.847 2.756 2.370 3.549 . 0 0 "[ . 1 . 2]" 1
2122 1 47 THR H 1 50 GLY H 2.983 . 4.095 3.545 3.264 3.854 . 0 0 "[ . 1 . 2]" 1
2123 1 49 GLN HA 1 50 GLY H 3.092 . 4.287 3.326 3.040 3.472 . 0 0 "[ . 1 . 2]" 1
2124 1 49 GLN QB 1 50 GLY H 3.404 . 3.702 3.190 2.839 3.618 . 0 0 "[ . 1 . 2]" 1
2125 1 47 THR MG 1 50 GLY H 3.440 . 4.919 4.565 4.037 5.011 0.092 5 0 "[ . 1 . 2]" 1
2126 1 15 ASP HA 1 16 GLY H 2.459 . 3.215 2.822 2.115 3.503 0.288 10 0 "[ . 1 . 2]" 1
2127 1 16 GLY H 1 16 GLY HA3 2.762 . 3.716 2.932 2.851 2.962 . 0 0 "[ . 1 . 2]" 1
2128 1 16 GLY H 1 16 GLY HA2 2.775 . 3.737 2.409 2.304 2.473 . 0 0 "[ . 1 . 2]" 1
2129 1 97 GLY H 1 111 LYS H 3.703 . 5.417 4.754 4.622 4.994 . 0 0 "[ . 1 . 2]" 1
2130 1 97 GLY H 1 97 GLY HA3 2.598 . 3.442 2.448 2.422 2.460 . 0 0 "[ . 1 . 2]" 1
2131 1 96 GLY HA3 1 97 GLY H 2.792 . 3.766 2.895 2.853 2.994 . 0 0 "[ . 1 . 2]" 1
2132 1 96 GLY HA2 1 97 GLY H 2.973 . 4.078 3.505 3.465 3.533 . 0 0 "[ . 1 . 2]" 1
2133 1 97 GLY H 1 97 GLY HA2 2.366 . 3.065 2.963 2.951 2.972 . 0 0 "[ . 1 . 2]" 1
2134 1 95 LYS HA 1 97 GLY H 3.031 . 4.179 3.856 3.659 3.973 . 0 0 "[ . 1 . 2]" 1
2135 1 94 ILE HG12 1 97 GLY H 2.648 . 3.525 3.795 3.581 4.096 0.571 5 1 "[ + 1 . 2]" 1
2136 1 97 GLY H 1 110 LEU QD 2.942 . 4.024 3.180 2.828 3.523 . 0 0 "[ . 1 . 2]" 1
2137 1 94 ILE HG13 1 97 GLY H 3.184 . 4.452 2.522 2.382 2.782 . 0 0 "[ . 1 . 2]" 1
2138 1 20 GLY H 1 20 GLY HA2 2.260 . 2.899 2.609 2.296 2.954 0.055 13 0 "[ . 1 . 2]" 1
2139 1 20 GLY H 1 21 GLN H 3.062 . 4.234 3.765 2.127 4.478 0.244 6 0 "[ . 1 . 2]" 1
2140 1 19 ALA HA 1 20 GLY H 2.398 . 3.117 2.485 2.142 3.273 0.156 6 0 "[ . 1 . 2]" 1
2141 1 19 ALA MB 1 20 GLY H 2.991 . 4.109 2.969 1.859 3.717 0.014 15 0 "[ . 1 . 2]" 1
2142 1 36 GLY H 1 36 GLY HA3 2.255 . 2.891 2.947 2.894 2.957 0.066 10 0 "[ . 1 . 2]" 1
2143 1 36 GLY H 1 37 ILE H 2.546 . 3.356 2.922 2.525 3.181 . 0 0 "[ . 1 . 2]" 1
2144 1 35 GLU HA 1 36 GLY H 3.148 . 4.386 3.504 3.350 3.620 . 0 0 "[ . 1 . 2]" 1
2145 1 36 GLY H 1 36 GLY HA2 2.362 . 3.059 2.526 2.325 2.628 . 0 0 "[ . 1 . 2]" 1
2146 1 35 GLU HB3 1 36 GLY H 2.970 . 4.073 4.115 3.923 4.217 0.144 11 0 "[ . 1 . 2]" 1
2147 1 35 GLU HB2 1 36 GLY H 3.527 . 5.082 3.772 3.122 4.160 . 0 0 "[ . 1 . 2]" 1
2148 1 103 ASP HA 1 104 GLY H 2.258 . 2.895 2.923 2.803 2.986 0.091 12 0 "[ . 1 . 2]" 1
2149 1 104 GLY H 1 104 GLY HA3 2.258 . 2.895 2.906 2.879 2.930 0.035 13 0 "[ . 1 . 2]" 1
2150 1 104 GLY H 1 105 LYS H 2.448 . 3.197 2.581 2.388 2.867 . 0 0 "[ . 1 . 2]" 1
2151 1 101 LYS HG2 1 104 GLY H 3.040 . 4.195 3.264 2.954 3.476 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 73
_Distance_constraint_stats_list.Viol_count 1
_Distance_constraint_stats_list.Viol_total 2.795
_Distance_constraint_stats_list.Viol_max 0.140
_Distance_constraint_stats_list.Viol_rms 0.0037
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.1398
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 26 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 ALA 0.140 0.140 14 0 "[ . 1 . 2]"
1 116 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 ILE 0.140 0.140 14 0 "[ . 1 . 2]"
1 121 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 26 LEU QD 1 31 VAL QG 7.000 . 7.000 2.747 1.719 3.417 . 0 0 "[ . 1 . 2]" 2
2 1 37 ILE HG12 1 39 ALA MB 7.000 . 7.000 4.956 4.426 5.204 . 0 0 "[ . 1 . 2]" 2
3 1 37 ILE MG 1 39 ALA MB 7.000 . 7.000 3.762 2.146 3.985 . 0 0 "[ . 1 . 2]" 2
4 1 42 ILE MG 1 43 VAL MG2 7.000 . 7.000 4.647 4.508 4.727 . 0 0 "[ . 1 . 2]" 2
5 1 42 ILE MD 1 44 ILE MG 7.000 . 7.000 4.384 4.099 4.723 . 0 0 "[ . 1 . 2]" 2
6 1 43 VAL MG1 1 46 ILE MD 7.000 . 7.000 3.212 2.942 3.509 . 0 0 "[ . 1 . 2]" 2
7 1 45 LYS HG2 1 47 THR MG 7.000 . 7.000 2.729 2.442 3.213 . 0 0 "[ . 1 . 2]" 2
8 1 44 ILE MD 1 52 VAL QG 7.000 . 7.000 2.778 2.532 2.932 . 0 0 "[ . 1 . 2]" 2
9 1 44 ILE HG12 1 52 VAL QG 7.000 . 7.000 3.505 3.424 3.702 . 0 0 "[ . 1 . 2]" 2
10 1 44 ILE HG13 1 52 VAL QG 7.000 . 7.000 3.411 3.219 3.548 . 0 0 "[ . 1 . 2]" 2
11 1 46 ILE MD 1 66 VAL MG2 7.000 . 7.000 3.664 3.095 4.169 . 0 0 "[ . 1 . 2]" 2
12 1 46 ILE HG13 1 66 VAL MG2 7.000 . 7.000 5.335 4.625 5.859 . 0 0 "[ . 1 . 2]" 2
13 1 46 ILE HG12 1 66 VAL MG2 7.000 . 7.000 3.894 3.156 4.402 . 0 0 "[ . 1 . 2]" 2
14 1 46 ILE MG 1 66 VAL MG2 7.000 . 7.000 3.050 2.762 3.481 . 0 0 "[ . 1 . 2]" 2
15 1 43 VAL MG2 1 70 ALA MB 7.000 . 7.000 2.711 2.505 2.994 . 0 0 "[ . 1 . 2]" 2
16 1 66 VAL MG2 1 70 ALA MB 7.000 . 7.000 3.928 3.700 4.097 . 0 0 "[ . 1 . 2]" 2
17 1 42 ILE MD 1 71 ILE MG 7.000 . 7.000 3.070 2.776 3.472 . 0 0 "[ . 1 . 2]" 2
18 1 42 ILE MG 1 71 ILE MG 7.000 . 7.000 2.230 1.816 2.435 . 0 0 "[ . 1 . 2]" 2
19 1 43 VAL MG1 1 72 ILE MD 7.000 . 7.000 2.888 2.796 3.063 . 0 0 "[ . 1 . 2]" 2
20 1 43 VAL MG2 1 72 ILE MD 7.000 . 7.000 2.405 2.207 2.592 . 0 0 "[ . 1 . 2]" 2
21 1 43 VAL MG2 1 72 ILE MG 7.000 . 7.000 4.106 3.940 4.317 . 0 0 "[ . 1 . 2]" 2
22 1 66 VAL MG1 1 72 ILE MD 7.000 . 7.000 2.194 1.955 2.491 . 0 0 "[ . 1 . 2]" 2
23 1 70 ALA MB 1 72 ILE MD 7.000 . 7.000 3.223 2.853 3.558 . 0 0 "[ . 1 . 2]" 2
24 1 70 ALA MB 1 72 ILE HG13 7.000 . 7.000 5.105 4.799 5.330 . 0 0 "[ . 1 . 2]" 2
25 1 43 VAL MG1 1 76 LEU MD1 7.000 . 7.000 2.371 2.062 2.694 . 0 0 "[ . 1 . 2]" 2
26 1 46 ILE MD 1 76 LEU MD2 7.000 . 7.000 2.742 2.427 3.094 . 0 0 "[ . 1 . 2]" 2
27 1 46 ILE MD 1 76 LEU MD1 7.000 . 7.000 2.010 1.885 2.163 . 0 0 "[ . 1 . 2]" 2
28 1 72 ILE MG 1 76 LEU MD2 7.000 . 7.000 4.169 3.937 4.405 . 0 0 "[ . 1 . 2]" 2
29 1 72 ILE MG 1 76 LEU MD1 7.000 . 7.000 2.326 2.019 2.758 . 0 0 "[ . 1 . 2]" 2
30 1 72 ILE MD 1 77 LEU QD 7.000 . 7.000 5.351 4.642 5.932 . 0 0 "[ . 1 . 2]" 2
31 1 85 LEU QD 1 90 ILE MG 7.000 . 7.000 3.417 3.218 3.615 . 0 0 "[ . 1 . 2]" 2
32 1 65 LYS QG 1 91 VAL QG 7.000 . 7.000 3.984 3.569 4.205 . 0 0 "[ . 1 . 2]" 2
33 1 90 ILE MG 1 91 VAL QG 7.000 . 7.000 4.069 3.953 4.158 . 0 0 "[ . 1 . 2]" 2
34 1 66 VAL MG1 1 94 ILE MG 7.000 . 7.000 2.132 1.948 2.421 . 0 0 "[ . 1 . 2]" 2
35 1 66 VAL MG2 1 94 ILE MG 7.000 . 7.000 3.539 3.286 3.843 . 0 0 "[ . 1 . 2]" 2
36 1 72 ILE MD 1 94 ILE MD 7.000 . 7.000 2.418 2.276 2.713 . 0 0 "[ . 1 . 2]" 2
37 1 72 ILE MD 1 94 ILE MG 7.000 . 7.000 3.206 3.037 3.394 . 0 0 "[ . 1 . 2]" 2
38 1 72 ILE MD 1 99 VAL QG 7.000 . 7.000 3.390 2.920 3.678 . 0 0 "[ . 1 . 2]" 2
39 1 85 LEU QD 1 100 ILE MD 7.000 . 7.000 2.418 2.265 2.597 . 0 0 "[ . 1 . 2]" 2
40 1 90 ILE MD 1 100 ILE MG 7.000 . 7.000 3.564 3.385 3.865 . 0 0 "[ . 1 . 2]" 2
41 1 91 VAL QG 1 100 ILE MG 7.000 . 7.000 4.097 3.963 4.275 . 0 0 "[ . 1 . 2]" 2
42 1 91 VAL QG 1 101 LYS HG3 7.000 . 7.000 4.256 3.956 4.446 . 0 0 "[ . 1 . 2]" 2
43 1 91 VAL QG 1 101 LYS HG2 7.000 . 7.000 4.255 4.065 4.360 . 0 0 "[ . 1 . 2]" 2
44 1 78 MET ME 1 102 VAL QG 7.000 . 7.000 1.804 1.582 1.989 . 0 0 "[ . 1 . 2]" 2
45 1 100 ILE MD 1 102 VAL QG 7.000 . 7.000 2.019 1.877 2.172 . 0 0 "[ . 1 . 2]" 2
46 1 100 ILE QG 1 102 VAL QG 7.000 . 7.000 2.354 2.226 2.493 . 0 0 "[ . 1 . 2]" 2
47 1 100 ILE MG 1 102 VAL QG 7.000 . 7.000 3.554 3.458 3.622 . 0 0 "[ . 1 . 2]" 2
48 1 72 ILE MD 1 108 VAL MG1 7.000 . 7.000 3.340 3.054 3.518 . 0 0 "[ . 1 . 2]" 2
49 1 72 ILE HG12 1 108 VAL MG1 7.000 . 7.000 3.372 3.139 3.541 . 0 0 "[ . 1 . 2]" 2
50 1 72 ILE MG 1 108 VAL MG1 7.000 . 7.000 2.726 2.354 3.104 . 0 0 "[ . 1 . 2]" 2
51 1 72 ILE MG 1 108 VAL MG2 5.500 . 5.500 1.647 1.446 1.954 . 0 0 "[ . 1 . 2]" 2
52 1 76 LEU MD2 1 108 VAL MG2 7.000 . 7.000 4.234 3.945 4.499 . 0 0 "[ . 1 . 2]" 2
53 1 76 LEU MD1 1 108 VAL MG2 7.000 . 7.000 3.252 2.822 3.692 . 0 0 "[ . 1 . 2]" 2
54 1 77 LEU QD 1 108 VAL MG1 5.500 . 5.500 3.124 2.331 4.264 . 0 0 "[ . 1 . 2]" 2
55 1 94 ILE MD 1 110 LEU QD 7.000 . 7.000 3.910 3.444 4.475 . 0 0 "[ . 1 . 2]" 2
56 1 108 VAL MG1 1 110 LEU QD 7.000 . 7.000 2.773 2.408 3.772 . 0 0 "[ . 1 . 2]" 2
57 1 77 LEU QD 1 113 ALA MB 7.000 . 7.000 3.030 2.383 4.548 . 0 0 "[ . 1 . 2]" 2
58 1 72 ILE MD 1 119 ILE MD 7.000 . 7.000 4.047 3.892 4.209 . 0 0 "[ . 1 . 2]" 2
59 1 72 ILE MG 1 119 ILE MD 7.000 . 7.000 2.685 2.506 3.062 . 0 0 "[ . 1 . 2]" 2
60 1 77 LEU QD 1 119 ILE MD 7.000 . 7.000 2.038 1.620 2.290 . 0 0 "[ . 1 . 2]" 2
61 1 77 LEU QD 1 119 ILE MG 7.000 . 7.000 1.762 1.518 2.518 . 0 0 "[ . 1 . 2]" 2
62 1 108 VAL MG1 1 119 ILE MD 7.000 . 7.000 2.461 2.101 3.105 . 0 0 "[ . 1 . 2]" 2
63 1 108 VAL MG2 1 119 ILE MD 7.000 . 7.000 3.716 3.477 4.109 . 0 0 "[ . 1 . 2]" 2
64 1 110 LEU QD 1 119 ILE MD 7.000 . 7.000 2.461 1.900 4.537 . 0 0 "[ . 1 . 2]" 2
65 1 110 LEU QD 1 119 ILE MG 7.000 . 7.000 3.368 2.945 5.438 . 0 0 "[ . 1 . 2]" 2
66 1 113 ALA MB 1 119 ILE MD 7.000 . 7.000 5.775 5.192 7.140 0.140 14 0 "[ . 1 . 2]" 2
67 1 116 ALA MB 1 119 ILE MD 7.000 . 7.000 5.244 4.809 5.707 . 0 0 "[ . 1 . 2]" 2
68 1 116 ALA MB 1 119 ILE MG 7.000 . 7.000 4.333 3.871 5.481 . 0 0 "[ . 1 . 2]" 2
69 1 119 ILE MG 1 121 THR MG 7.000 . 7.000 3.354 2.748 4.005 . 0 0 "[ . 1 . 2]" 2
70 1 42 ILE MG 1 125 ILE MD 7.000 . 7.000 2.547 2.075 3.014 . 0 0 "[ . 1 . 2]" 2
71 1 42 ILE MD 1 125 ILE MG 7.000 . 7.000 2.632 2.213 3.069 . 0 0 "[ . 1 . 2]" 2
72 1 44 ILE MG 1 125 ILE MG 7.000 . 7.000 2.912 2.537 3.223 . 0 0 "[ . 1 . 2]" 2
73 1 125 ILE MG 1 129 LYS HG3 7.000 . 7.000 4.797 2.048 5.522 . 0 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 98
_Distance_constraint_stats_list.Viol_count 246
_Distance_constraint_stats_list.Viol_total 1539.224
_Distance_constraint_stats_list.Viol_max 1.910
_Distance_constraint_stats_list.Viol_rms 0.1944
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0393
_Distance_constraint_stats_list.Viol_average_violations_only 0.3129
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 13 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 GLN 0.044 0.037 6 0 "[ . 1 . 2]"
1 22 LYS 0.767 0.139 3 0 "[ . 1 . 2]"
1 23 ALA 0.723 0.139 3 0 "[ . 1 . 2]"
1 24 GLU 10.465 0.705 9 13 "[ ***.*- +** *** * *]"
1 25 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 PRO 10.888 0.705 9 13 "[ ***.*- +** *** * *]"
1 29 ASP 0.449 0.088 10 0 "[ . 1 . 2]"
1 30 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 VAL 0.058 0.026 6 0 "[ . 1 . 2]"
1 32 SER 0.507 0.088 10 0 "[ . 1 . 2]"
1 33 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ALA 0.723 0.139 3 0 "[ . 1 . 2]"
1 40 GLU 0.820 0.139 3 0 "[ . 1 . 2]"
1 41 GLN 0.399 0.181 18 0 "[ . 1 . 2]"
1 42 ILE 0.097 0.073 12 0 "[ . 1 . 2]"
1 43 VAL 0.070 0.041 3 0 "[ . 1 . 2]"
1 44 ILE 0.027 0.027 1 0 "[ . 1 . 2]"
1 45 LYS 0.070 0.041 3 0 "[ . 1 . 2]"
1 46 ILE 2.431 0.597 2 1 "[ + . 1 . 2]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ASP 0.083 0.058 1 0 "[ . 1 . 2]"
1 49 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 GLY 0.083 0.058 1 0 "[ . 1 . 2]"
1 51 TYR 2.793 0.178 2 0 "[ . 1 . 2]"
1 52 VAL 0.070 0.041 3 0 "[ . 1 . 2]"
1 53 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLY 0.399 0.181 18 0 "[ . 1 . 2]"
1 59 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 HIS 10.497 0.705 9 13 "[ ***.*- +** *** * *]"
1 61 TYR 2.451 0.178 2 0 "[ . 1 . 2]"
1 62 TYR 0.027 0.027 1 0 "[ . 1 . 2]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 ILE 1.122 0.181 18 0 "[ . 1 . 2]"
1 72 ILE 0.020 0.018 9 0 "[ . 1 . 2]"
1 73 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLU 3.092 0.406 7 0 "[ . 1 . 2]"
1 76 LEU 2.138 0.135 5 0 "[ . 1 . 2]"
1 77 LEU 1.540 0.406 7 0 "[ . 1 . 2]"
1 78 MET 12.308 0.890 10 12 "[ *** * +-**** * *]"
1 80 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 TYR 0.216 0.077 7 0 "[ . 1 . 2]"
1 84 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ASN 0.597 0.597 2 1 "[ + . 1 . 2]"
1 93 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ILE 0.617 0.597 2 1 "[ + . 1 . 2]"
1 98 TYR 9.033 0.375 14 0 "[ . 1 . 2]"
1 99 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ILE 4.253 0.234 19 0 "[ . 1 . 2]"
1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 VAL 10.655 0.705 9 13 "[ ***.*- +** *** * *]"
1 105 LYS 0.612 0.115 4 0 "[ . 1 . 2]"
1 106 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 TYR 13.977 0.705 9 13 "[ ***.*- +** *** * *]"
1 108 VAL 12.314 0.890 10 12 "[ *** * +-**** * *]"
1 109 TYR 10.117 0.375 14 0 "[ . 1 . 2]"
1 110 LEU 35.388 1.910 14 20 [**-**********+******]
1 111 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 ASP 34.304 1.910 14 20 [**-**********+******]
1 116 ALA 34.304 1.910 14 20 [**-**********+******]
1 118 ASN 0.020 0.018 9 0 "[ . 1 . 2]"
1 119 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 LYS 2.156 0.406 7 0 "[ . 1 . 2]"
1 123 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 GLU 0.521 0.088 17 0 "[ . 1 . 2]"
1 125 ILE 0.616 0.088 17 0 "[ . 1 . 2]"
1 126 LYS 0.521 0.088 17 0 "[ . 1 . 2]"
1 127 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 44 ILE HG12 1 59 TYR QD 3.349 . 4.751 3.677 3.491 3.862 . 0 0 "[ . 1 . 2]" 3
2 1 109 TYR QD 1 111 LYS HB2 4.243 . 6.494 4.723 3.930 5.338 . 0 0 "[ . 1 . 2]" 3
3 1 98 TYR QD 1 109 TYR QB 2.911 . 3.970 3.429 3.179 3.734 . 0 0 "[ . 1 . 2]" 3
4 1 98 TYR QD 1 109 TYR HA 3.032 . 4.181 4.475 4.217 4.556 0.375 14 0 "[ . 1 . 2]" 3
5 1 78 MET ME 1 109 TYR QE 3.513 . 5.055 4.766 4.510 4.916 . 0 0 "[ . 1 . 2]" 3
6 1 98 TYR QD 1 100 ILE MD 3.148 . 4.387 4.545 4.451 4.621 0.234 19 0 "[ . 1 . 2]" 3
7 1 24 GLU HA 1 60 HIS HD2 3.015 . 4.151 4.673 4.399 4.856 0.705 9 13 "[ ***.*- +** *** * *]" 3
8 1 105 LYS QB 1 107 TYR QD 3.020 . 4.160 3.754 3.610 3.843 . 0 0 "[ . 1 . 2]" 3
9 1 83 TYR QD 1 102 VAL QG 2.726 . 3.655 1.911 1.720 2.109 0.077 7 0 "[ . 1 . 2]" 3
10 1 83 TYR QD 1 109 TYR HA 4.021 . 6.042 4.850 4.724 4.972 . 0 0 "[ . 1 . 2]" 3
11 1 83 TYR QD 1 85 LEU QD 2.853 . 3.870 2.958 2.826 3.030 . 0 0 "[ . 1 . 2]" 3
12 1 60 HIS QB 1 60 HIS HD2 2.819 . 3.813 3.029 2.999 3.060 . 0 0 "[ . 1 . 2]" 3
13 1 76 LEU HA 1 107 TYR QE 3.215 . 4.507 4.494 4.321 4.622 0.115 4 0 "[ . 1 . 2]" 3
14 1 61 TYR QD 1 62 TYR HA 2.832 . 3.834 3.454 2.972 3.772 . 0 0 "[ . 1 . 2]" 3
15 1 51 TYR HB2 1 61 TYR QD 3.007 . 4.137 4.257 4.167 4.315 0.178 2 0 "[ . 1 . 2]" 3
16 1 100 ILE QG 1 107 TYR QE 3.259 . 4.587 4.073 3.792 4.158 . 0 0 "[ . 1 . 2]" 3
17 1 13 TYR HB2 1 13 TYR QE 3.109 . 4.317 3.359 2.703 3.787 . 0 0 "[ . 1 . 2]" 3
18 1 13 TYR HB3 1 13 TYR QE 3.159 . 4.406 4.111 3.839 4.275 . 0 0 "[ . 1 . 2]" 3
19 1 51 TYR QD 1 62 TYR QB 3.176 . 4.437 3.310 2.570 4.291 . 0 0 "[ . 1 . 2]" 3
20 1 24 GLU QB 1 62 TYR QE 3.950 . 5.900 3.586 3.110 3.969 . 0 0 "[ . 1 . 2]" 3
21 1 31 VAL QG 1 55 HIS HD2 3.527 . 5.082 4.713 4.566 4.847 . 0 0 "[ . 1 . 2]" 3
22 1 52 VAL QG 1 55 HIS HD2 3.126 . 4.348 2.909 2.806 3.011 . 0 0 "[ . 1 . 2]" 3
23 1 83 TYR QB 1 83 TYR QE 4.201 . 6.407 3.319 3.128 3.572 . 0 0 "[ . 1 . 2]" 3
24 1 43 VAL MG2 1 52 VAL HA 4.113 . 6.228 3.910 3.476 4.103 . 0 0 "[ . 1 . 2]" 3
25 1 45 LYS HG2 1 52 VAL HA 4.239 . 6.485 5.074 4.895 5.596 . 0 0 "[ . 1 . 2]" 3
26 1 76 LEU MD2 1 107 TYR HA 2.842 . 3.852 2.953 2.753 3.041 . 0 0 "[ . 1 . 2]" 3
27 1 26 LEU QB 1 31 VAL HA 3.089 . 4.282 3.457 3.185 4.182 . 0 0 "[ . 1 . 2]" 3
28 1 73 SER QB 1 76 LEU HG 3.439 . 4.917 2.940 2.676 3.476 . 0 0 "[ . 1 . 2]" 3
29 1 44 ILE HB 1 73 SER QB 3.245 . 4.561 3.459 3.170 3.917 . 0 0 "[ . 1 . 2]" 3
30 1 31 VAL H 1 32 SER HA 3.452 . 4.942 4.843 4.572 4.968 0.026 6 0 "[ . 1 . 2]" 3
31 1 46 ILE HA 1 52 VAL QG 3.206 . 4.491 4.222 4.025 4.453 . 0 0 "[ . 1 . 2]" 3
32 1 122 LYS HA 1 122 LYS QB 1.817 . 2.230 2.208 2.136 2.270 0.040 12 0 "[ . 1 . 2]" 3
33 1 126 LYS HA 1 129 LYS QD 2.319 . 2.991 2.476 2.026 2.652 . 0 0 "[ . 1 . 2]" 3
34 1 30 GLU HA 1 30 GLU HB2 2.442 . 3.187 2.527 2.337 2.679 . 0 0 "[ . 1 . 2]" 3
35 1 123 GLU HA 1 124 GLU HA 3.506 . 5.043 4.220 3.954 4.387 . 0 0 "[ . 1 . 2]" 3
36 1 75 GLU HA 1 77 LEU HG 3.283 . 4.630 4.341 3.347 5.036 0.406 7 0 "[ . 1 . 2]" 3
37 1 73 SER HA 1 74 GLU HB3 3.835 . 5.674 4.266 4.206 4.407 . 0 0 "[ . 1 . 2]" 3
38 1 72 ILE MG 1 73 SER HA 2.399 . 3.119 2.387 1.946 2.824 . 0 0 "[ . 1 . 2]" 3
39 1 90 ILE MG 1 93 GLU HA 3.057 . 4.225 3.335 3.209 3.426 . 0 0 "[ . 1 . 2]" 3
40 1 100 ILE QG 1 109 TYR HA 2.838 . 3.844 3.897 3.814 4.009 0.165 14 0 "[ . 1 . 2]" 3
41 1 22 LYS HA 1 23 ALA MB 2.695 . 3.603 3.576 3.412 3.742 0.139 3 0 "[ . 1 . 2]" 3
42 1 40 GLU HB3 1 70 ALA HA 3.842 . 5.687 4.652 4.224 5.069 . 0 0 "[ . 1 . 2]" 3
43 1 110 LEU HA 1 116 ALA HA 3.333 . 4.722 6.437 6.340 6.632 1.910 14 20 [**-**********+******] 3
44 1 102 VAL QG 1 107 TYR HB2 2.820 . 3.814 3.047 2.845 3.281 . 0 0 "[ . 1 . 2]" 3
45 1 15 ASP H 1 15 ASP QB 2.571 . 3.397 2.251 2.067 2.454 . 0 0 "[ . 1 . 2]" 3
46 1 46 ILE HB 1 106 TYR HA 3.587 . 5.195 4.356 4.138 4.633 . 0 0 "[ . 1 . 2]" 3
47 1 48 ASP HB2 1 49 GLN QB 3.777 . 5.560 4.584 4.204 4.783 . 0 0 "[ . 1 . 2]" 3
48 1 21 GLN HB2 1 61 TYR HB3 3.879 . 5.760 3.657 1.961 5.021 0.037 6 0 "[ . 1 . 2]" 3
49 1 24 GLU QB 1 25 ASN HB3 3.916 . 5.833 4.534 3.653 4.819 . 0 0 "[ . 1 . 2]" 3
50 1 74 GLU H 1 119 ILE HB 3.345 . 4.744 4.504 4.293 4.609 . 0 0 "[ . 1 . 2]" 3
51 1 74 GLU HB3 1 75 GLU QG 3.349 . 4.751 3.774 3.401 3.970 . 0 0 "[ . 1 . 2]" 3
52 1 45 LYS HB3 1 52 VAL QG 2.396 . 3.114 2.517 1.928 2.972 . 0 0 "[ . 1 . 2]" 3
53 1 124 GLU H 1 124 GLU HG2 3.032 . 4.181 3.609 3.314 3.776 . 0 0 "[ . 1 . 2]" 3
54 1 28 PRO HA 1 41 GLN QG 3.444 . 4.927 3.691 3.364 4.114 . 0 0 "[ . 1 . 2]" 3
55 1 78 MET QG 1 80 ASP H 3.194 . 4.469 3.346 2.530 4.394 . 0 0 "[ . 1 . 2]" 3
56 1 78 MET QG 1 80 ASP HB3 3.555 . 5.135 3.039 2.410 3.601 . 0 0 "[ . 1 . 2]" 3
57 1 30 GLU HB3 1 30 GLU QG 1.788 . 2.188 2.033 1.949 2.131 . 0 0 "[ . 1 . 2]" 3
58 1 86 LYS H 1 86 LYS HD3 2.981 . 4.091 3.595 3.073 3.842 . 0 0 "[ . 1 . 2]" 3
59 1 126 LYS HA 1 129 LYS QD 2.355 . 3.049 2.653 2.407 2.907 . 0 0 "[ . 1 . 2]" 3
60 1 85 LEU HG 1 98 TYR QD 3.295 . 4.652 4.130 4.022 4.276 . 0 0 "[ . 1 . 2]" 3
61 1 84 GLN HA 1 85 LEU QD 3.298 . 4.657 4.093 3.939 4.202 . 0 0 "[ . 1 . 2]" 3
62 1 33 LYS QB 1 33 LYS HG2 1.832 . 2.252 1.826 1.771 1.883 . 0 0 "[ . 1 . 2]" 3
63 1 43 VAL MG1 1 45 LYS HG3 2.989 . 4.106 3.969 3.726 4.147 0.041 3 0 "[ . 1 . 2]" 3
64 1 24 GLU QB 1 31 VAL QG 1.954 . 2.431 2.007 1.722 2.209 . 0 0 "[ . 1 . 2]" 3
65 1 44 ILE H 1 53 THR MG 2.905 . 3.960 3.611 3.459 3.759 . 0 0 "[ . 1 . 2]" 3
66 1 86 LYS HB3 1 86 LYS QG 1.798 . 2.202 1.967 1.918 2.002 . 0 0 "[ . 1 . 2]" 3
67 1 85 LEU QB 1 85 LEU QD 1.831 . 2.250 1.724 1.677 1.765 . 0 0 "[ . 1 . 2]" 3
68 1 45 LYS HB3 1 52 VAL QG 2.192 . 2.793 2.126 1.607 2.596 . 0 0 "[ . 1 . 2]" 3
69 1 46 ILE HG12 1 108 VAL MG2 2.802 . 3.783 3.681 3.611 3.789 0.006 13 0 "[ . 1 . 2]" 3
70 1 71 ILE H 1 71 ILE MG 2.768 . 3.726 2.842 2.585 3.039 . 0 0 "[ . 1 . 2]" 3
71 1 46 ILE MD 1 51 TYR HB2 3.304 . 4.668 4.587 4.335 4.741 0.073 18 0 "[ . 1 . 2]" 3
72 1 46 ILE MD 1 76 LEU HB3 2.548 . 3.360 2.510 1.997 3.007 . 0 0 "[ . 1 . 2]" 3
73 1 78 MET H 1 78 MET ME 2.891 . 3.936 4.551 4.234 4.826 0.890 10 12 "[ *** * +-**** * *]" 3
74 1 40 GLU HB2 1 42 ILE MD 2.668 . 3.558 3.462 2.610 3.631 0.073 12 0 "[ . 1 . 2]" 3
75 1 46 ILE H 1 76 LEU MD1 2.392 . 3.107 3.183 3.128 3.242 0.135 5 0 "[ . 1 . 2]" 3
76 1 23 ALA H 1 47 THR MG 4.326 . 6.666 5.338 4.235 5.755 . 0 0 "[ . 1 . 2]" 3
77 1 72 ILE H 1 74 GLU H 4.470 . 6.967 5.495 5.305 5.617 . 0 0 "[ . 1 . 2]" 3
78 1 50 GLY QA 1 66 VAL H 4.235 . 6.477 5.682 5.122 6.461 . 0 0 "[ . 1 . 2]" 3
79 1 46 ILE MG 1 66 VAL H 2.937 . 4.015 3.675 3.580 3.715 . 0 0 "[ . 1 . 2]" 3
80 1 122 LYS HB2 1 124 GLU H 3.034 . 4.184 4.181 3.946 4.272 0.088 17 0 "[ . 1 . 2]" 3
81 1 52 VAL QG 1 61 TYR H 4.176 . 6.355 3.477 3.166 3.871 . 0 0 "[ . 1 . 2]" 3
82 1 26 LEU QB 1 31 VAL H 3.081 . 4.267 3.313 2.944 3.631 . 0 0 "[ . 1 . 2]" 3
83 1 101 LYS HG2 1 105 LYS H 3.155 . 4.399 3.415 3.206 3.567 . 0 0 "[ . 1 . 2]" 3
84 1 67 PRO HD2 1 70 ALA H 3.451 . 4.940 3.715 3.597 3.825 . 0 0 "[ . 1 . 2]" 3
85 1 24 GLU H 1 62 TYR QB 4.480 . 6.988 3.377 1.945 3.819 0.027 1 0 "[ . 1 . 2]" 3
86 1 76 LEU HB3 1 77 LEU H 3.662 . 5.338 3.785 3.367 4.034 . 0 0 "[ . 1 . 2]" 3
87 1 72 ILE HG12 1 73 SER H 3.731 . 5.471 4.578 4.201 4.707 . 0 0 "[ . 1 . 2]" 3
88 1 44 ILE H 1 45 LYS HB2 4.129 . 6.260 4.006 3.807 4.146 . 0 0 "[ . 1 . 2]" 3
89 1 45 LYS HG2 1 47 THR H 3.575 . 5.172 4.139 3.713 4.630 . 0 0 "[ . 1 . 2]" 3
90 1 28 PRO HA 1 32 SER H 2.617 . 3.473 3.422 3.221 3.561 0.088 10 0 "[ . 1 . 2]" 3
91 1 46 ILE MG 1 92 ASN HD21 4.122 . 6.246 5.745 5.321 6.843 0.597 2 1 "[ + . 1 . 2]" 3
92 1 46 ILE MG 1 92 ASN HD22 4.304 . 6.620 6.280 5.578 6.539 . 0 0 "[ . 1 . 2]" 3
93 1 28 PRO HA 1 41 GLN HE21 3.691 . 5.394 3.631 2.822 4.113 . 0 0 "[ . 1 . 2]" 3
94 1 41 GLN HE22 1 56 GLY H 4.827 . 7.739 7.512 6.810 7.920 0.181 18 0 "[ . 1 . 2]" 3
95 1 72 ILE MD 1 118 ASN HD22 3.918 . 5.837 2.633 1.981 3.975 0.018 9 0 "[ . 1 . 2]" 3
96 1 72 ILE MD 1 118 ASN HD21 3.780 . 5.566 3.441 2.571 4.086 . 0 0 "[ . 1 . 2]" 3
97 1 48 ASP H 1 50 GLY H 2.809 . 3.795 3.675 3.546 3.853 0.058 1 0 "[ . 1 . 2]" 3
98 1 33 LYS HA 1 36 GLY H 3.176 . 4.437 3.541 3.250 3.838 . 0 0 "[ . 1 . 2]" 3
stop_
save_
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