NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
410204 |
1zxf   |
6726 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1zxf
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 2502
_Distance_constraint_stats_list.Viol_count 3173
_Distance_constraint_stats_list.Viol_total 6749.907
_Distance_constraint_stats_list.Viol_max 0.995
_Distance_constraint_stats_list.Viol_rms 0.0432
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0067
_Distance_constraint_stats_list.Viol_average_violations_only 0.1064
_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 1 ASN 8.752 0.894 13 6 "[ * . *1 + .* -*2]"
1 2 TYR 5.417 0.277 15 0 "[ . 1 . 2]"
1 3 ASP 3.350 0.192 9 0 "[ . 1 . 2]"
1 4 PRO 4.369 0.192 9 0 "[ . 1 . 2]"
1 5 PHE 0.240 0.083 7 0 "[ . 1 . 2]"
1 6 VAL 7.515 0.635 13 2 "[ . - + . 2]"
1 7 ARG 10.426 0.925 15 7 "[ **. * *1 * + - 2]"
1 8 HIS 10.200 0.810 10 4 "[ . - + . * *]"
1 9 SER 2.646 0.322 10 0 "[ . 1 . 2]"
1 10 VAL 19.609 0.950 2 12 "[ +* .-** ** * ** * *]"
1 11 THR 2.049 0.393 18 0 "[ . 1 . 2]"
1 12 VAL 8.655 0.334 15 0 "[ . 1 . 2]"
1 13 LYS 5.109 0.704 3 1 "[ + . 1 . 2]"
1 14 ALA 2.004 0.203 6 0 "[ . 1 . 2]"
1 15 ASP 1.452 0.138 9 0 "[ . 1 . 2]"
1 16 ARG 7.194 0.378 3 0 "[ . 1 . 2]"
1 17 LYS 6.915 0.867 9 7 "[** * +1*- * 2]"
1 18 THR 8.517 0.867 9 4 "[ * * +1 - . 2]"
1 19 ALA 5.407 0.364 15 0 "[ . 1 . 2]"
1 20 PHE 2.978 0.515 18 1 "[ . 1 . + 2]"
1 21 LYS 4.340 0.515 18 2 "[ . - 1 . + 2]"
1 22 THR 1.624 0.501 8 1 "[ . + 1 . 2]"
1 23 PHE 1.388 0.111 13 0 "[ . 1 . 2]"
1 24 LEU 8.766 0.348 5 0 "[ . 1 . 2]"
1 25 GLU 2.725 0.237 12 0 "[ . 1 . 2]"
1 26 GLY 2.202 0.305 1 0 "[ . 1 . 2]"
1 27 PHE 10.840 0.562 20 1 "[ . 1 . +]"
1 28 PRO 1.789 0.128 13 0 "[ . 1 . 2]"
1 29 GLU 2.695 0.255 13 0 "[ . 1 . 2]"
1 30 TRP 11.894 0.567 18 3 "[- . 1 . + *]"
1 31 TRP 2.083 0.355 13 0 "[ . 1 . 2]"
1 32 PRO 6.366 0.567 18 2 "[- . 1 . + 2]"
1 33 ASN 5.909 0.438 20 0 "[ . 1 . 2]"
1 34 ASN 2.540 0.438 20 0 "[ . 1 . 2]"
1 35 PHE 1.524 0.156 4 0 "[ . 1 . 2]"
1 36 ARG 2.624 0.551 12 1 "[ . 1 + . 2]"
1 37 THR 2.829 0.551 12 1 "[ . 1 + . 2]"
1 38 THR 7.349 0.298 20 0 "[ . 1 . 2]"
1 39 LYS 9.235 0.699 9 3 "[ * +1 . - 2]"
1 40 VAL 5.651 0.699 9 1 "[ . +1 . 2]"
1 41 GLY 1.767 0.344 14 0 "[ . 1 . 2]"
1 42 ALA 1.922 0.431 9 0 "[ . 1 . 2]"
1 43 PRO 0.466 0.100 9 0 "[ . 1 . 2]"
1 44 LEU 8.185 0.459 17 0 "[ . 1 . 2]"
1 45 GLY 0.650 0.134 13 0 "[ . 1 . 2]"
1 46 VAL 2.671 0.425 3 0 "[ . 1 . 2]"
1 47 ASP 0.951 0.151 12 0 "[ . 1 . 2]"
1 48 LYS 2.046 0.398 13 0 "[ . 1 . 2]"
1 49 LYS 0.921 0.223 7 0 "[ . 1 . 2]"
1 50 GLY 0.024 0.024 11 0 "[ . 1 . 2]"
1 51 GLY 1.516 0.424 6 0 "[ . 1 . 2]"
1 52 ARG 3.862 0.719 9 3 "[ - . +1 * . 2]"
1 53 TRP 6.968 0.562 20 1 "[ . 1 . +]"
1 54 TYR 6.680 0.719 9 3 "[ - . +1 * . 2]"
1 55 GLU 12.345 0.658 5 3 "[ + *1 . - 2]"
1 56 ILE 3.576 0.223 13 0 "[ . 1 . 2]"
1 57 ASP 4.518 0.264 20 0 "[ . 1 . 2]"
1 58 GLU 1.340 0.576 8 1 "[ . + 1 . 2]"
1 59 GLN 4.027 0.654 7 2 "[ . +- 1 . 2]"
1 60 GLY 0.505 0.109 10 0 "[ . 1 . 2]"
1 61 GLU 2.498 0.654 7 1 "[ . + 1 . 2]"
1 62 GLU 3.959 0.527 8 1 "[ . + 1 . 2]"
1 63 HIS 9.235 0.428 12 0 "[ . 1 . 2]"
1 64 THR 0.794 0.260 20 0 "[ . 1 . 2]"
1 65 PHE 0.211 0.211 12 0 "[ . 1 . 2]"
1 66 GLY 1.962 0.216 6 0 "[ . 1 . 2]"
1 67 LEU 4.666 0.450 12 0 "[ . 1 . 2]"
1 68 ILE 9.003 0.569 2 2 "[-+ . 1 . 2]"
1 69 ARG 1.819 0.450 12 0 "[ . 1 . 2]"
1 70 LYS 1.546 0.295 2 0 "[ . 1 . 2]"
1 71 VAL 6.411 0.569 2 2 "[-+ . 1 . 2]"
1 72 ASP 3.410 0.292 6 0 "[ . 1 . 2]"
1 73 GLU 1.083 0.512 3 1 "[ + . 1 . 2]"
1 74 PRO 2.112 0.512 3 1 "[ + . 1 . 2]"
1 75 ASP 4.428 0.198 19 0 "[ . 1 . 2]"
1 76 THR 4.626 0.168 12 0 "[ . 1 . 2]"
1 77 LEU 7.722 0.348 5 0 "[ . 1 . 2]"
1 78 VAL 3.864 0.351 9 0 "[ . 1 . 2]"
1 79 ILE 5.172 0.465 1 0 "[ . 1 . 2]"
1 80 GLY 0.020 0.020 1 0 "[ . 1 . 2]"
1 81 TRP 13.171 0.671 20 3 "[ . 1*- . +]"
1 82 ARG 2.531 0.347 12 0 "[ . 1 . 2]"
1 83 LEU 12.991 0.947 12 2 "[ . 1 + .* 2]"
1 84 ASN 7.656 0.963 18 2 "[ - . 1 . + 2]"
1 85 GLY 2.704 0.947 12 2 "[ - . 1 + . 2]"
1 86 PHE 4.722 0.963 18 3 "[ -. 1 * . + 2]"
1 87 GLY 0.878 0.283 5 0 "[ . 1 . 2]"
1 88 ARG 11.531 0.727 12 5 "[ -. 1*+ .* *]"
1 89 ILE 6.045 0.589 17 1 "[ . 1 . + 2]"
1 90 ASP 1.834 0.358 14 0 "[ . 1 . 2]"
1 91 PRO 1.601 0.225 3 0 "[ . 1 . 2]"
1 92 ASP 2.049 0.310 18 0 "[ . 1 . 2]"
1 93 ASN 2.146 0.310 18 0 "[ . 1 . 2]"
1 94 SER 1.725 0.328 8 0 "[ . 1 . 2]"
1 95 SER 2.943 0.328 8 0 "[ . 1 . 2]"
1 96 GLU 2.144 0.157 4 0 "[ . 1 . 2]"
1 97 PHE 10.609 0.995 12 3 "[ . * 1 + . -]"
1 98 THR 5.706 0.761 7 1 "[ . + 1 . 2]"
1 99 VAL 3.297 0.310 7 0 "[ . 1 . 2]"
1 100 THR 2.761 0.132 9 0 "[ . 1 . 2]"
1 101 PHE 2.163 0.146 12 0 "[ . 1 . 2]"
1 102 VAL 1.162 0.101 6 0 "[ . 1 . 2]"
1 103 ALA 1.333 0.191 19 0 "[ . 1 . 2]"
1 104 ASP 1.964 0.185 8 0 "[ . 1 . 2]"
1 105 GLY 0.562 0.139 17 0 "[ . 1 . 2]"
1 106 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 LYS 1.199 0.203 6 0 "[ . 1 . 2]"
1 108 LYS 5.010 0.393 18 0 "[ . 1 . 2]"
1 109 THR 1.495 0.316 13 0 "[ . 1 . 2]"
1 110 ARG 9.674 0.950 2 9 "[ +* .- * 1* * ** *]"
1 111 VAL 14.106 0.925 15 7 "[ **.-* *1 * + 2]"
1 112 ASP 8.661 0.726 3 3 "[ + . *1 - . 2]"
1 113 VAL 13.227 0.825 7 9 "[ **. + -1** .* **]"
1 114 GLU 10.083 0.825 7 8 "[ **. + *-* * *]"
1 115 HIS 6.408 0.682 15 2 "[ . 1 - + 2]"
1 116 THR 4.190 0.995 12 2 "[ . - 1 + . 2]"
1 117 HIS 2.535 0.313 17 0 "[ . 1 . 2]"
1 118 PHE 2.673 0.204 17 0 "[ . 1 . 2]"
1 119 ASP 2.592 0.277 15 0 "[ . 1 . 2]"
1 120 ARG 1.540 0.145 3 0 "[ . 1 . 2]"
1 121 MET 0.441 0.120 19 0 "[ . 1 . 2]"
1 122 GLY 0.287 0.214 7 0 "[ . 1 . 2]"
1 124 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 HIS 1.113 0.247 8 0 "[ . 1 . 2]"
1 126 ALA 1.323 0.214 7 0 "[ . 1 . 2]"
1 127 LYS 0.264 0.105 10 0 "[ . 1 . 2]"
1 128 ARG 4.851 0.671 20 2 "[ . 1- . +]"
1 129 VAL 2.320 0.468 6 0 "[ . 1 . 2]"
1 130 ARG 1.991 0.597 10 2 "[ . + . -2]"
1 131 ASN 6.381 0.597 10 3 "[ . + . * -2]"
1 132 GLY 0.581 0.134 6 0 "[ . 1 . 2]"
1 133 MET 1.560 0.413 13 0 "[ . 1 . 2]"
1 134 ASP 0.975 0.616 1 1 "[+ . 1 . 2]"
1 135 LYS 1.677 0.616 1 1 "[+ . 1 . 2]"
1 136 GLY 2.742 0.321 17 0 "[ . 1 . 2]"
1 137 TRP 3.690 0.225 16 0 "[ . 1 . 2]"
1 138 PRO 3.050 0.501 8 1 "[ . + 1 . 2]"
1 139 THR 8.494 0.821 5 4 "[ + 1 .- * *]"
1 140 ILE 2.962 0.216 18 0 "[ . 1 . 2]"
1 141 LEU 3.083 0.501 8 1 "[ . + 1 . 2]"
1 142 GLN 10.735 0.821 5 4 "[ + 1 .- * *]"
1 143 SER 3.459 0.392 17 0 "[ . 1 . 2]"
1 144 PHE 10.727 0.826 20 6 "[ . 1 *- ** * +]"
1 145 GLN 12.248 0.826 20 6 "[ . 1 *- ** * +]"
1 146 ASP 3.251 0.457 3 0 "[ . 1 . 2]"
1 147 LYS 2.830 0.274 12 0 "[ . 1 . 2]"
1 148 ILE 6.293 0.204 18 0 "[ . 1 . 2]"
1 149 ASP 3.555 0.957 3 4 "[ + . -1 ** . 2]"
1 150 GLU 5.895 0.879 15 2 "[ . -1 + 2]"
1 151 GLU 4.745 0.861 15 1 "[ . 1 + 2]"
1 152 GLY 0.690 0.114 13 0 "[ . 1 . 2]"
1 153 ALA 1.847 0.289 19 0 "[ . 1 . 2]"
1 154 LYS 14.479 0.957 3 4 "[ + . 1 ** * 2]"
1 155 LYS 2.764 0.400 4 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 23 PHE H 1 30 TRP HE1 3.200 . 6.000 4.523 4.284 4.843 . 0 0 "[ . 1 . 2]" 1
2 1 26 GLY H 1 30 TRP HE1 3.200 . 4.500 3.906 3.413 4.163 . 0 0 "[ . 1 . 2]" 1
3 1 30 TRP H 1 30 TRP HE1 3.300 . 4.700 4.565 4.306 4.744 0.044 4 0 "[ . 1 . 2]" 1
4 1 27 PHE H 1 30 TRP HE1 3.300 . 4.600 4.522 4.258 4.677 0.077 13 0 "[ . 1 . 2]" 1
5 1 26 GLY HA2 1 30 TRP HE1 4.300 . 6.000 4.567 4.156 4.720 . 0 0 "[ . 1 . 2]" 1
6 1 26 GLY HA3 1 30 TRP HE1 2.500 . 3.300 3.225 2.607 3.412 0.112 2 0 "[ . 1 . 2]" 1
7 1 53 TRP HE1 1 66 GLY HA3 2.900 . 6.000 5.078 2.719 5.848 . 0 0 "[ . 1 . 2]" 1
8 1 27 PHE HA 1 30 TRP HE1 3.000 . 4.100 3.503 3.050 4.123 0.023 20 0 "[ . 1 . 2]" 1
9 1 21 LYS HG3 1 30 TRP HE1 2.400 . 6.000 5.865 4.593 6.320 0.320 8 0 "[ . 1 . 2]" 1
10 1 53 TRP HE1 1 79 ILE HG12 3.400 . 4.900 4.181 2.442 5.365 0.465 1 0 "[ . 1 . 2]" 1
11 1 115 HIS H 1 115 HIS HA 3.000 . 4.100 2.935 2.889 2.951 . 0 0 "[ . 1 . 2]" 1
12 1 114 GLU HB2 1 115 HIS H 3.800 . 5.600 3.524 2.803 3.968 . 0 0 "[ . 1 . 2]" 1
13 1 7 ARG HB2 1 115 HIS H 2.400 . 6.000 4.291 3.989 4.637 . 0 0 "[ . 1 . 2]" 1
14 1 6 VAL QG 1 115 HIS H 3.400 . 4.800 3.702 3.133 4.422 . 0 0 "[ . 1 . 2]" 1
15 1 6 VAL H 1 115 HIS H 3.000 . 4.100 3.495 2.720 4.011 . 0 0 "[ . 1 . 2]" 1
16 1 115 HIS H 1 115 HIS HB3 3.100 . 4.300 2.671 2.410 3.291 . 0 0 "[ . 1 . 2]" 1
17 1 115 HIS H 1 115 HIS HB2 2.900 . 3.900 2.999 2.352 3.891 . 0 0 "[ . 1 . 2]" 1
18 1 114 GLU HB3 1 115 HIS H 3.800 . 5.600 3.922 2.962 4.416 . 0 0 "[ . 1 . 2]" 1
19 1 67 LEU H 1 80 GLY H 2.800 . 3.800 3.233 2.835 3.723 . 0 0 "[ . 1 . 2]" 1
20 1 68 ILE HA 1 80 GLY H 3.100 . 4.300 3.158 2.693 3.631 . 0 0 "[ . 1 . 2]" 1
21 1 80 GLY H 1 80 GLY HA3 2.600 . 3.500 2.350 2.317 2.406 . 0 0 "[ . 1 . 2]" 1
22 1 67 LEU QB 1 80 GLY H 3.300 . 4.700 3.463 2.073 4.265 . 0 0 "[ . 1 . 2]" 1
23 1 79 ILE HG13 1 80 GLY H 3.400 . 4.800 3.760 3.360 4.138 . 0 0 "[ . 1 . 2]" 1
24 1 55 GLU H 1 63 HIS H 3.400 . 4.800 4.375 3.208 5.113 0.313 10 0 "[ . 1 . 2]" 1
25 1 62 GLU HG3 1 63 HIS H 3.700 . 5.400 4.625 3.857 5.828 0.428 12 0 "[ . 1 . 2]" 1
26 1 62 GLU H 1 63 HIS H 3.100 . 4.300 3.656 3.255 3.965 . 0 0 "[ . 1 . 2]" 1
27 1 63 HIS H 1 63 HIS HD2 3.200 . 4.500 4.225 3.172 4.683 0.183 1 0 "[ . 1 . 2]" 1
28 1 54 TYR QE 1 63 HIS H 2.400 . 6.000 5.618 4.762 6.278 0.278 10 0 "[ . 1 . 2]" 1
29 1 54 TYR QD 1 63 HIS H 3.100 . 4.300 3.660 2.694 4.524 0.224 3 0 "[ . 1 . 2]" 1
30 1 62 GLU HA 1 63 HIS H 3.000 . 4.100 2.292 2.134 2.390 . 0 0 "[ . 1 . 2]" 1
31 1 63 HIS H 1 63 HIS QB 2.900 . 4.000 2.534 2.325 3.104 . 0 0 "[ . 1 . 2]" 1
32 1 54 TYR QB 1 63 HIS H 3.200 . 4.500 3.360 2.206 4.578 0.078 3 0 "[ . 1 . 2]" 1
33 1 62 GLU HG2 1 63 HIS H 4.000 . 6.000 4.944 4.052 5.625 . 0 0 "[ . 1 . 2]" 1
34 1 62 GLU QB 1 63 HIS H 3.800 . 5.600 3.967 3.747 4.040 . 0 0 "[ . 1 . 2]" 1
35 1 109 THR H 1 110 ARG H 3.300 . 4.700 3.989 3.862 4.171 . 0 0 "[ . 1 . 2]" 1
36 1 11 THR HA 1 110 ARG H 3.600 . 5.200 4.718 4.507 5.061 . 0 0 "[ . 1 . 2]" 1
37 1 102 VAL H 1 110 ARG H 2.900 . 4.000 3.636 3.295 3.931 . 0 0 "[ . 1 . 2]" 1
38 1 109 THR HB 1 110 ARG H 3.700 . 5.400 4.329 4.176 4.405 . 0 0 "[ . 1 . 2]" 1
39 1 110 ARG H 1 110 ARG HD2 3.900 . 5.800 5.209 4.474 5.911 0.111 7 0 "[ . 1 . 2]" 1
40 1 104 ASP QB 1 110 ARG H 2.400 . 4.300 3.619 2.558 4.257 . 0 0 "[ . 1 . 2]" 1
41 1 102 VAL HB 1 110 ARG H 2.800 . 3.800 3.020 2.639 3.539 . 0 0 "[ . 1 . 2]" 1
42 1 110 ARG H 1 110 ARG HB3 2.700 . 3.600 2.504 2.265 2.882 . 0 0 "[ . 1 . 2]" 1
43 1 110 ARG H 1 110 ARG HB2 3.100 . 4.300 2.852 2.447 3.052 . 0 0 "[ . 1 . 2]" 1
44 1 77 LEU H 1 99 VAL H 2.800 . 3.800 2.961 2.718 3.161 . 0 0 "[ . 1 . 2]" 1
45 1 79 ILE H 1 99 VAL H 3.700 . 5.400 4.144 3.691 4.379 . 0 0 "[ . 1 . 2]" 1
46 1 76 THR HA 1 99 VAL H 3.800 . 5.600 4.751 4.639 4.963 . 0 0 "[ . 1 . 2]" 1
47 1 98 THR HB 1 99 VAL H 3.600 . 5.200 4.327 4.250 4.394 . 0 0 "[ . 1 . 2]" 1
48 1 99 VAL H 1 99 VAL HB 2.800 . 3.800 2.601 2.445 3.635 . 0 0 "[ . 1 . 2]" 1
49 1 102 VAL H 1 103 ALA H 3.500 . 5.000 4.310 4.246 4.356 . 0 0 "[ . 1 . 2]" 1
50 1 102 VAL H 1 112 ASP H 4.000 . 6.000 4.062 3.739 4.668 . 0 0 "[ . 1 . 2]" 1
51 1 101 PHE QE 1 102 VAL H 4.200 . 6.000 5.998 5.923 6.064 0.064 19 0 "[ . 1 . 2]" 1
52 1 101 PHE HB2 1 102 VAL H 3.700 . 5.500 4.456 4.386 4.499 . 0 0 "[ . 1 . 2]" 1
53 1 101 PHE HB3 1 102 VAL H 2.900 . 4.000 3.661 3.522 3.804 . 0 0 "[ . 1 . 2]" 1
54 1 102 VAL H 1 110 ARG HB3 3.300 . 4.700 4.279 3.925 4.563 . 0 0 "[ . 1 . 2]" 1
55 1 101 PHE H 1 102 VAL H 3.700 . 5.400 4.325 4.233 4.415 . 0 0 "[ . 1 . 2]" 1
56 1 101 PHE QD 1 102 VAL H 3.400 . 4.900 3.862 3.759 3.972 . 0 0 "[ . 1 . 2]" 1
57 1 16 ARG HD3 1 102 VAL H 3.200 . 4.400 4.442 4.381 4.501 0.101 6 0 "[ . 1 . 2]" 1
58 1 97 PHE QE 1 137 TRP HE1 2.400 . 6.000 4.795 3.422 6.036 0.036 4 0 "[ . 1 . 2]" 1
59 1 23 PHE QE 1 137 TRP HE1 2.900 . 6.000 4.423 2.482 6.061 0.061 20 0 "[ . 1 . 2]" 1
60 1 137 TRP HB2 1 137 TRP HE1 3.500 . 5.000 5.001 4.750 5.215 0.215 12 0 "[ . 1 . 2]" 1
61 1 38 THR H 1 55 GLU HB3 3.500 . 5.000 4.277 3.335 4.976 . 0 0 "[ . 1 . 2]" 1
62 1 36 ARG HB3 1 38 THR H 3.400 . 6.000 5.915 5.162 6.196 0.196 18 0 "[ . 1 . 2]" 1
63 1 37 THR MG 1 38 THR H 3.700 . 5.400 3.233 2.182 3.807 . 0 0 "[ . 1 . 2]" 1
64 1 37 THR H 1 38 THR H 3.500 . 5.100 4.541 4.411 4.596 . 0 0 "[ . 1 . 2]" 1
65 1 38 THR H 1 39 LYS H 2.800 . 3.800 2.784 2.636 3.474 . 0 0 "[ . 1 . 2]" 1
66 1 38 THR H 1 38 THR HB 3.600 . 5.200 4.058 3.991 4.089 . 0 0 "[ . 1 . 2]" 1
67 1 38 THR H 1 55 GLU HB2 3.400 . 4.800 4.645 3.621 5.038 0.238 5 0 "[ . 1 . 2]" 1
68 1 38 THR H 1 39 LYS QB 3.700 . 5.400 4.775 4.601 5.138 . 0 0 "[ . 1 . 2]" 1
69 1 10 VAL H 1 111 VAL H 2.700 . 3.600 2.869 2.629 3.107 . 0 0 "[ . 1 . 2]" 1
70 1 111 VAL H 1 112 ASP H 3.600 . 5.200 4.498 4.407 4.571 . 0 0 "[ . 1 . 2]" 1
71 1 11 THR H 1 111 VAL H 3.500 . 5.000 4.986 4.738 5.118 0.118 2 0 "[ . 1 . 2]" 1
72 1 9 SER HA 1 111 VAL H 3.800 . 5.600 4.316 4.075 4.617 . 0 0 "[ . 1 . 2]" 1
73 1 11 THR HA 1 111 VAL H 3.600 . 5.200 3.680 3.258 3.953 . 0 0 "[ . 1 . 2]" 1
74 1 111 VAL H 1 112 ASP HA 3.400 . 6.000 5.214 4.994 5.347 . 0 0 "[ . 1 . 2]" 1
75 1 110 ARG HA 1 111 VAL H 2.600 . 3.400 2.163 2.139 2.188 . 0 0 "[ . 1 . 2]" 1
76 1 111 VAL H 1 111 VAL HA 2.800 . 3.800 2.922 2.900 2.948 . 0 0 "[ . 1 . 2]" 1
77 1 9 SER QB 1 111 VAL H 4.200 . 6.000 5.378 4.730 5.992 . 0 0 "[ . 1 . 2]" 1
78 1 110 ARG HD2 1 111 VAL H 2.800 . 6.000 3.311 2.399 4.294 . 0 0 "[ . 1 . 2]" 1
79 1 111 VAL H 1 111 VAL HB 3.100 . 4.300 2.869 2.732 3.166 . 0 0 "[ . 1 . 2]" 1
80 1 110 ARG HB3 1 111 VAL H 3.600 . 5.200 4.332 4.087 4.486 . 0 0 "[ . 1 . 2]" 1
81 1 110 ARG HG2 1 111 VAL H 2.800 . 6.000 4.570 3.582 5.045 . 0 0 "[ . 1 . 2]" 1
82 1 110 ARG HG3 1 111 VAL H 3.600 . 5.200 3.837 3.121 5.062 . 0 0 "[ . 1 . 2]" 1
83 1 111 VAL H 1 111 VAL MG2 3.700 . 5.400 3.807 3.640 3.863 . 0 0 "[ . 1 . 2]" 1
84 1 12 VAL H 1 109 THR H 2.700 . 3.600 2.832 2.571 3.077 . 0 0 "[ . 1 . 2]" 1
85 1 11 THR H 1 12 VAL H 3.600 . 5.200 4.301 4.216 4.360 . 0 0 "[ . 1 . 2]" 1
86 1 12 VAL H 1 110 ARG HA 3.300 . 4.600 3.254 2.918 3.491 . 0 0 "[ . 1 . 2]" 1
87 1 12 VAL H 1 109 THR HB 3.200 . 4.500 3.703 3.457 4.126 . 0 0 "[ . 1 . 2]" 1
88 1 12 VAL H 1 12 VAL HB 2.700 . 3.600 2.470 2.261 3.684 0.084 13 0 "[ . 1 . 2]" 1
89 1 12 VAL H 1 110 ARG HB3 4.200 . 6.000 5.870 5.597 6.074 0.074 13 0 "[ . 1 . 2]" 1
90 1 12 VAL H 1 108 LYS QG 3.400 . 6.000 3.828 3.290 4.273 . 0 0 "[ . 1 . 2]" 1
91 1 47 ASP H 1 52 ARG H 2.700 . 3.600 2.933 2.701 3.201 . 0 0 "[ . 1 . 2]" 1
92 1 47 ASP H 1 51 GLY H 3.400 . 4.800 4.692 4.518 4.818 0.018 10 0 "[ . 1 . 2]" 1
93 1 47 ASP H 1 54 TYR QD 3.200 . 4.500 3.565 3.299 3.797 . 0 0 "[ . 1 . 2]" 1
94 1 47 ASP H 1 51 GLY HA2 4.200 . 6.000 4.887 4.494 5.252 . 0 0 "[ . 1 . 2]" 1
95 1 47 ASP H 1 47 ASP HB2 2.500 . 3.300 2.932 2.732 3.108 . 0 0 "[ . 1 . 2]" 1
96 1 47 ASP H 1 47 ASP HB3 3.100 . 4.300 2.548 2.343 2.774 . 0 0 "[ . 1 . 2]" 1
97 1 47 ASP H 1 53 TRP HB3 4.500 . 6.000 5.498 4.271 5.712 . 0 0 "[ . 1 . 2]" 1
98 1 47 ASP H 1 71 VAL QG 3.800 . 6.000 5.796 5.669 5.905 . 0 0 "[ . 1 . 2]" 1
99 1 47 ASP H 1 54 TYR H 3.700 . 5.400 3.812 3.570 4.113 . 0 0 "[ . 1 . 2]" 1
100 1 46 VAL H 1 47 ASP H 3.500 . 5.000 4.320 4.249 4.391 . 0 0 "[ . 1 . 2]" 1
101 1 46 VAL HB 1 47 ASP H 3.600 . 5.200 4.018 3.894 4.171 . 0 0 "[ . 1 . 2]" 1
102 1 96 GLU QB 1 116 THR H 2.400 . 6.000 4.790 3.721 5.763 . 0 0 "[ . 1 . 2]" 1
103 1 115 HIS HB2 1 116 THR H 3.300 . 4.700 4.326 3.239 4.565 . 0 0 "[ . 1 . 2]" 1
104 1 96 GLU H 1 116 THR H 3.100 . 6.000 5.221 3.638 6.100 0.100 1 0 "[ . 1 . 2]" 1
105 1 97 PHE HA 1 116 THR H 3.800 . 5.600 3.896 3.037 5.092 . 0 0 "[ . 1 . 2]" 1
106 1 115 HIS HA 1 116 THR H 2.900 . 4.000 2.203 2.097 2.251 . 0 0 "[ . 1 . 2]" 1
107 1 116 THR H 1 116 THR HB 3.100 . 4.300 3.218 2.421 3.848 . 0 0 "[ . 1 . 2]" 1
108 1 115 HIS HB3 1 116 THR H 3.500 . 5.000 4.214 3.726 4.496 . 0 0 "[ . 1 . 2]" 1
109 1 97 PHE HB2 1 116 THR H 2.400 . 6.000 5.808 4.873 6.995 0.995 12 2 "[ . - 1 + . 2]" 1
110 1 116 THR H 1 116 THR MG 3.300 . 4.700 3.036 1.946 4.018 . 0 0 "[ . 1 . 2]" 1
111 1 103 ALA H 1 104 ASP H 3.900 . 5.800 4.542 4.438 4.623 . 0 0 "[ . 1 . 2]" 1
112 1 102 VAL HB 1 103 ALA H 3.700 . 5.400 4.327 4.296 4.374 . 0 0 "[ . 1 . 2]" 1
113 1 103 ALA H 1 109 THR MG 3.500 . 5.000 3.798 3.572 3.987 . 0 0 "[ . 1 . 2]" 1
114 1 103 ALA H 1 104 ASP HA 3.400 . 6.000 5.409 5.308 5.535 . 0 0 "[ . 1 . 2]" 1
115 1 16 ARG HD3 1 103 ALA H 2.700 . 3.600 2.974 2.700 3.155 . 0 0 "[ . 1 . 2]" 1
116 1 16 ARG HG2 1 103 ALA H 3.700 . 6.000 5.922 5.688 6.066 0.066 2 0 "[ . 1 . 2]" 1
117 1 13 LYS H 1 14 ALA H 2.700 . 3.600 2.741 2.533 3.109 . 0 0 "[ . 1 . 2]" 1
118 1 13 LYS H 1 13 LYS HA 2.900 . 3.900 2.928 2.881 2.949 . 0 0 "[ . 1 . 2]" 1
119 1 13 LYS H 1 13 LYS HB2 3.100 . 4.300 2.325 1.493 3.539 0.407 15 0 "[ . 1 . 2]" 1
120 1 13 LYS H 1 13 LYS HE3 3.500 . 5.000 3.893 3.325 4.616 . 0 0 "[ . 1 . 2]" 1
121 1 13 LYS H 1 145 GLN HB3 3.900 . 5.800 4.813 4.152 5.252 . 0 0 "[ . 1 . 2]" 1
122 1 11 THR MG 1 13 LYS H 3.300 . 6.000 4.729 4.348 5.368 . 0 0 "[ . 1 . 2]" 1
123 1 12 VAL QG 1 13 LYS H 2.800 . 3.800 2.497 1.861 2.978 0.039 14 0 "[ . 1 . 2]" 1
124 1 2 TYR HA 1 6 VAL H 3.300 . 4.700 4.157 3.532 4.714 0.014 8 0 "[ . 1 . 2]" 1
125 1 6 VAL H 1 115 HIS HB3 3.700 . 5.500 3.255 1.766 5.601 0.134 9 0 "[ . 1 . 2]" 1
126 1 6 VAL H 1 6 VAL HB 2.900 . 3.900 2.901 2.351 3.787 . 0 0 "[ . 1 . 2]" 1
127 1 6 VAL H 1 6 VAL QG 3.700 . 3.800 2.306 1.971 2.688 0.029 1 0 "[ . 1 . 2]" 1
128 1 5 PHE HB3 1 6 VAL H 3.500 . 5.000 3.646 2.664 4.165 . 0 0 "[ . 1 . 2]" 1
129 1 5 PHE HB2 1 6 VAL H 3.500 . 5.000 3.309 2.336 4.398 . 0 0 "[ . 1 . 2]" 1
130 1 6 VAL H 1 114 GLU HB2 3.600 . 6.000 5.387 3.774 6.451 0.451 7 0 "[ . 1 . 2]" 1
131 1 6 VAL H 1 7 ARG HB2 3.600 . 5.200 5.057 4.753 5.324 0.124 9 0 "[ . 1 . 2]" 1
132 1 6 VAL H 1 115 HIS HA 3.400 . 6.000 4.979 4.309 5.701 . 0 0 "[ . 1 . 2]" 1
133 1 70 LYS HG2 1 77 LEU H 3.200 . 6.000 5.528 4.896 6.054 0.054 15 0 "[ . 1 . 2]" 1
134 1 77 LEU H 1 100 THR H 3.500 . 6.000 5.042 4.982 5.217 . 0 0 "[ . 1 . 2]" 1
135 1 77 LEU H 1 78 VAL H 3.300 . 4.600 4.133 3.963 4.310 . 0 0 "[ . 1 . 2]" 1
136 1 76 THR H 1 77 LEU H 3.500 . 5.000 4.346 4.206 4.411 . 0 0 "[ . 1 . 2]" 1
137 1 77 LEU H 1 101 PHE QE 4.300 . 6.000 5.035 4.691 5.339 . 0 0 "[ . 1 . 2]" 1
138 1 77 LEU H 1 77 LEU QB 3.000 . 4.100 2.801 2.663 2.889 . 0 0 "[ . 1 . 2]" 1
139 1 76 THR MG 1 77 LEU H 3.700 . 5.400 3.396 3.226 3.574 . 0 0 "[ . 1 . 2]" 1
140 1 77 LEU H 1 77 LEU QD 2.800 . 3.800 2.334 2.152 2.608 . 0 0 "[ . 1 . 2]" 1
141 1 77 LEU H 1 99 VAL QG 3.400 . 4.800 3.147 2.268 3.445 . 0 0 "[ . 1 . 2]" 1
142 1 72 ASP HB2 1 77 LEU H 3.300 . 6.000 5.512 4.439 5.850 . 0 0 "[ . 1 . 2]" 1
143 1 67 LEU H 1 80 GLY HA3 3.200 . 4.500 3.699 3.217 4.132 . 0 0 "[ . 1 . 2]" 1
144 1 67 LEU H 1 68 ILE H 3.200 . 4.500 4.070 3.926 4.234 . 0 0 "[ . 1 . 2]" 1
145 1 53 TRP H 1 67 LEU H 3.600 . 5.200 4.768 4.463 5.104 . 0 0 "[ . 1 . 2]" 1
146 1 66 GLY H 1 67 LEU H 3.900 . 5.800 4.551 4.332 4.665 . 0 0 "[ . 1 . 2]" 1
147 1 67 LEU H 1 81 TRP HA 3.100 . 6.000 4.577 3.982 5.017 . 0 0 "[ . 1 . 2]" 1
148 1 66 GLY HA2 1 67 LEU H 2.800 . 3.800 2.241 2.111 2.397 . 0 0 "[ . 1 . 2]" 1
149 1 67 LEU H 1 79 ILE HA 3.600 . 5.200 4.864 4.504 5.268 0.068 15 0 "[ . 1 . 2]" 1
150 1 66 GLY HA3 1 67 LEU H 3.100 . 4.300 2.977 2.693 3.247 . 0 0 "[ . 1 . 2]" 1
151 1 67 LEU H 1 67 LEU QB 3.200 . 4.500 2.840 2.381 3.057 . 0 0 "[ . 1 . 2]" 1
152 1 67 LEU H 1 67 LEU HG 2.900 . 3.900 2.741 2.194 3.934 0.034 4 0 "[ . 1 . 2]" 1
153 1 67 LEU H 1 79 ILE HG13 3.200 . 4.500 4.275 3.248 4.583 0.083 14 0 "[ . 1 . 2]" 1
154 1 96 GLU H 1 97 PHE H 3.700 . 5.400 4.401 3.563 4.604 . 0 0 "[ . 1 . 2]" 1
155 1 97 PHE H 1 97 PHE HA 2.700 . 3.600 2.932 2.907 2.952 . 0 0 "[ . 1 . 2]" 1
156 1 97 PHE H 1 97 PHE HB2 3.200 . 4.500 3.723 2.716 3.861 . 0 0 "[ . 1 . 2]" 1
157 1 97 PHE H 1 97 PHE HB3 3.100 . 4.300 3.452 3.174 3.748 . 0 0 "[ . 1 . 2]" 1
158 1 79 ILE HB 1 97 PHE H 2.400 . 6.000 5.661 5.205 6.040 0.040 7 0 "[ . 1 . 2]" 1
159 1 97 PHE H 1 97 PHE QE 3.400 . 4.900 4.135 3.946 4.368 . 0 0 "[ . 1 . 2]" 1
160 1 79 ILE MD 1 97 PHE H 3.300 . 4.700 4.501 3.955 4.933 0.233 11 0 "[ . 1 . 2]" 1
161 1 97 PHE H 1 98 THR H 3.500 . 5.100 4.325 4.231 4.491 . 0 0 "[ . 1 . 2]" 1
162 1 79 ILE H 1 97 PHE H 2.900 . 3.900 3.035 2.637 3.355 . 0 0 "[ . 1 . 2]" 1
163 1 80 GLY HA2 1 97 PHE H 3.400 . 4.900 3.178 2.683 3.511 . 0 0 "[ . 1 . 2]" 1
164 1 96 GLU QB 1 97 PHE H 3.500 . 5.000 2.827 2.358 3.473 . 0 0 "[ . 1 . 2]" 1
165 1 141 LEU H 1 145 GLN QE 3.800 . 6.000 5.434 5.231 5.718 . 0 0 "[ . 1 . 2]" 1
166 1 137 TRP HA 1 141 LEU H 3.600 . 5.200 4.118 3.322 4.424 . 0 0 "[ . 1 . 2]" 1
167 1 141 LEU H 1 141 LEU HA 2.800 . 3.800 2.797 2.754 2.818 . 0 0 "[ . 1 . 2]" 1
168 1 141 LEU H 1 144 PHE HB3 3.500 . 6.000 4.590 4.435 5.504 . 0 0 "[ . 1 . 2]" 1
169 1 141 LEU H 1 141 LEU HG 2.800 . 3.800 2.336 2.158 3.938 0.138 18 0 "[ . 1 . 2]" 1
170 1 141 LEU H 1 141 LEU HB3 2.700 . 3.600 3.586 3.464 3.611 0.011 12 0 "[ . 1 . 2]" 1
171 1 140 ILE QG 1 141 LEU H 3.700 . 5.200 4.121 3.853 4.278 . 0 0 "[ . 1 . 2]" 1
172 1 141 LEU H 1 141 LEU QD 3.400 . 4.800 2.865 2.171 3.025 . 0 0 "[ . 1 . 2]" 1
173 1 140 ILE HA 1 141 LEU H 2.800 . 3.800 3.548 3.529 3.580 . 0 0 "[ . 1 . 2]" 1
174 1 141 LEU H 1 141 LEU HB2 3.700 . 5.400 2.505 2.162 2.600 . 0 0 "[ . 1 . 2]" 1
175 1 140 ILE HB 1 141 LEU H 2.700 . 3.600 2.571 2.255 2.754 . 0 0 "[ . 1 . 2]" 1
176 1 139 THR H 1 141 LEU H 3.400 . 4.800 4.120 3.968 4.284 . 0 0 "[ . 1 . 2]" 1
177 1 140 ILE MD 1 141 LEU H 2.400 . 6.000 4.624 4.105 4.848 . 0 0 "[ . 1 . 2]" 1
178 1 89 ILE H 1 90 ASP H 3.800 . 5.600 4.437 4.153 4.632 . 0 0 "[ . 1 . 2]" 1
179 1 90 ASP H 1 92 ASP QB 3.400 . 6.000 5.398 4.890 5.883 . 0 0 "[ . 1 . 2]" 1
180 1 90 ASP H 1 90 ASP QB 3.100 . 4.000 2.762 2.186 3.052 . 0 0 "[ . 1 . 2]" 1
181 1 89 ILE HB 1 90 ASP H 3.300 . 4.700 2.922 2.378 3.977 . 0 0 "[ . 1 . 2]" 1
182 1 89 ILE MG 1 90 ASP H 3.900 . 5.800 4.151 3.932 4.461 . 0 0 "[ . 1 . 2]" 1
183 1 89 ILE MD 1 90 ASP H 3.100 . 4.300 2.956 2.107 3.421 . 0 0 "[ . 1 . 2]" 1
184 1 83 LEU QD 1 90 ASP H 3.200 . 4.500 3.446 2.432 4.571 0.071 2 0 "[ . 1 . 2]" 1
185 1 90 ASP H 1 91 PRO HD2 3.900 . 5.800 5.125 4.524 5.340 . 0 0 "[ . 1 . 2]" 1
186 1 12 VAL QG 1 109 THR H 3.400 . 4.300 3.294 2.426 3.568 . 0 0 "[ . 1 . 2]" 1
187 1 15 ASP H 1 109 THR H 3.300 . 4.700 4.078 3.844 4.326 . 0 0 "[ . 1 . 2]" 1
188 1 14 ALA H 1 109 THR H 3.400 . 4.800 4.368 4.172 4.552 . 0 0 "[ . 1 . 2]" 1
189 1 11 THR HA 1 109 THR H 3.600 . 5.200 4.257 3.929 4.706 . 0 0 "[ . 1 . 2]" 1
190 1 16 ARG HA 1 109 THR H 3.900 . 6.000 5.910 5.688 6.059 0.059 3 0 "[ . 1 . 2]" 1
191 1 104 ASP QB 1 109 THR H 4.300 . 6.000 3.781 3.431 4.030 . 0 0 "[ . 1 . 2]" 1
192 1 108 LYS HB2 1 109 THR H 3.800 . 5.700 4.034 3.925 4.119 . 0 0 "[ . 1 . 2]" 1
193 1 108 LYS QG 1 109 THR H . . 2.900 2.219 1.940 2.736 0.060 2 0 "[ . 1 . 2]" 1
194 1 108 LYS H 1 109 THR H 3.500 . 5.000 4.427 4.378 4.462 . 0 0 "[ . 1 . 2]" 1
195 1 13 LYS HA 1 109 THR H 3.500 . 5.000 4.235 4.029 4.626 . 0 0 "[ . 1 . 2]" 1
196 1 108 LYS HE2 1 109 THR H 2.400 . 6.000 5.232 3.848 6.316 0.316 13 0 "[ . 1 . 2]" 1
197 1 136 GLY QA 1 137 TRP H 2.700 . 3.600 2.544 2.245 2.847 . 0 0 "[ . 1 . 2]" 1
198 1 137 TRP H 1 137 TRP HB2 2.800 . 3.800 2.326 2.161 2.579 . 0 0 "[ . 1 . 2]" 1
199 1 137 TRP H 1 138 PRO HB2 4.700 . 6.000 6.099 5.945 6.225 0.225 16 0 "[ . 1 . 2]" 1
200 1 136 GLY H 1 137 TRP H 2.900 . 4.000 2.515 1.834 2.988 . 0 0 "[ . 1 . 2]" 1
201 1 135 LYS H 1 137 TRP H 3.900 . 5.800 4.444 3.802 5.308 . 0 0 "[ . 1 . 2]" 1
202 1 137 TRP H 1 137 TRP HA 2.700 . 3.600 2.779 2.754 2.808 . 0 0 "[ . 1 . 2]" 1
203 1 137 TRP H 1 137 TRP HB3 3.000 . 4.100 2.865 2.489 3.582 . 0 0 "[ . 1 . 2]" 1
204 1 137 TRP H 1 140 ILE QG 3.800 . 6.000 4.289 4.239 4.350 . 0 0 "[ . 1 . 2]" 1
205 1 81 TRP HE1 1 83 LEU QD 3.100 . 4.300 2.454 1.878 4.152 0.022 3 0 "[ . 1 . 2]" 1
206 1 81 TRP HE1 1 83 LEU H 3.100 . 4.300 3.468 2.738 4.393 0.093 12 0 "[ . 1 . 2]" 1
207 1 81 TRP HE1 1 90 ASP HA 3.300 . 4.700 4.506 3.813 4.943 0.243 4 0 "[ . 1 . 2]" 1
208 1 81 TRP HE1 1 129 VAL HA 3.300 . 4.700 3.880 1.919 4.749 0.049 17 0 "[ . 1 . 2]" 1
209 1 81 TRP HE1 1 88 ARG HB3 3.800 . 6.000 5.836 4.506 6.285 0.285 12 0 "[ . 1 . 2]" 1
210 1 81 TRP HE1 1 83 LEU HB2 3.300 . 4.600 3.912 2.250 5.110 0.510 12 1 "[ . 1 + . 2]" 1
211 1 81 TRP H 1 81 TRP HA 3.000 . 4.100 2.862 2.798 2.921 . 0 0 "[ . 1 . 2]" 1
212 1 81 TRP H 1 96 GLU HA 3.800 . 5.600 3.550 3.102 4.385 . 0 0 "[ . 1 . 2]" 1
213 1 81 TRP H 1 94 SER HA 3.200 . 6.000 4.930 4.435 5.940 . 0 0 "[ . 1 . 2]" 1
214 1 80 GLY HA2 1 81 TRP H 2.800 . 3.700 2.351 2.190 2.523 . 0 0 "[ . 1 . 2]" 1
215 1 81 TRP H 1 94 SER QB 3.400 . 6.000 5.294 2.058 6.096 0.096 17 0 "[ . 1 . 2]" 1
216 1 81 TRP H 1 81 TRP HB3 2.800 . 3.800 2.540 2.426 2.745 . 0 0 "[ . 1 . 2]" 1
217 1 81 TRP H 1 96 GLU QB 4.000 . 6.000 4.839 4.238 5.970 . 0 0 "[ . 1 . 2]" 1
218 1 67 LEU QB 1 81 TRP H 2.400 . 6.000 5.488 4.083 6.137 0.137 17 0 "[ . 1 . 2]" 1
219 1 79 ILE MD 1 81 TRP H 3.300 . 4.700 4.367 3.817 4.782 0.082 1 0 "[ . 1 . 2]" 1
220 1 80 GLY H 1 81 TRP H 3.900 . 5.800 4.575 4.514 4.619 . 0 0 "[ . 1 . 2]" 1
221 1 81 TRP H 1 82 ARG H 3.600 . 5.200 4.565 4.451 4.616 . 0 0 "[ . 1 . 2]" 1
222 1 81 TRP H 1 118 PHE QD 3.600 . 6.000 5.983 4.533 6.204 0.204 17 0 "[ . 1 . 2]" 1
223 1 81 TRP H 1 81 TRP HB2 3.100 . 4.300 2.541 2.310 2.787 . 0 0 "[ . 1 . 2]" 1
224 1 80 GLY HA3 1 81 TRP H 3.100 . 4.300 2.814 2.593 2.943 . 0 0 "[ . 1 . 2]" 1
225 1 67 LEU QD 1 81 TRP H 3.500 . 5.000 3.215 2.804 3.594 . 0 0 "[ . 1 . 2]" 1
226 1 2 TYR HA 1 119 ASP H 3.700 . 5.400 5.499 5.297 5.677 0.277 15 0 "[ . 1 . 2]" 1
227 1 117 HIS H 1 119 ASP H 3.300 . 4.700 3.390 2.316 4.768 0.068 5 0 "[ . 1 . 2]" 1
228 1 119 ASP H 1 120 ARG H 3.000 . 4.100 2.549 2.329 2.787 . 0 0 "[ . 1 . 2]" 1
229 1 118 PHE QB 1 119 ASP H 3.500 . 5.100 2.804 2.338 3.536 . 0 0 "[ . 1 . 2]" 1
230 1 119 ASP H 1 119 ASP QB 2.800 . 3.800 2.685 2.287 2.937 . 0 0 "[ . 1 . 2]" 1
231 1 119 ASP H 1 126 ALA MB 3.900 . 5.800 5.466 4.693 5.923 0.123 5 0 "[ . 1 . 2]" 1
232 1 83 LEU HG 1 84 ASN H 3.400 . 4.900 3.507 1.790 4.569 0.110 19 0 "[ . 1 . 2]" 1
233 1 84 ASN H 1 85 GLY HA3 3.600 . 5.200 4.941 3.924 5.842 0.642 3 1 "[ + . 1 . 2]" 1
234 1 84 ASN H 1 84 ASN HB3 3.000 . 4.100 2.954 2.376 3.705 . 0 0 "[ . 1 . 2]" 1
235 1 83 LEU HB3 1 84 ASN H 3.100 . 4.300 3.298 1.769 4.092 0.131 12 0 "[ . 1 . 2]" 1
236 1 83 LEU HB2 1 84 ASN H 3.500 . 5.000 3.650 1.598 4.324 0.402 3 0 "[ . 1 . 2]" 1
237 1 83 LEU H 1 84 ASN H 3.600 . 5.300 4.253 3.557 4.691 . 0 0 "[ . 1 . 2]" 1
238 1 19 ALA H 1 20 PHE H 2.800 . 3.800 2.800 2.731 2.855 . 0 0 "[ . 1 . 2]" 1
239 1 19 ALA H 1 21 LYS H 3.200 . 4.400 4.131 3.934 4.272 . 0 0 "[ . 1 . 2]" 1
240 1 19 ALA H 1 20 PHE HA 3.700 . 6.000 5.386 5.333 5.423 . 0 0 "[ . 1 . 2]" 1
241 1 12 VAL QG 1 19 ALA H 3.200 . 4.400 2.787 2.468 3.334 . 0 0 "[ . 1 . 2]" 1
242 1 18 THR H 1 19 ALA H 2.800 . 3.800 2.492 2.373 2.642 . 0 0 "[ . 1 . 2]" 1
243 1 19 ALA H 1 20 PHE HB2 4.000 . 6.000 5.419 5.279 5.518 . 0 0 "[ . 1 . 2]" 1
244 1 19 ALA H 1 20 PHE HB3 3.600 . 5.200 4.866 4.776 4.944 . 0 0 "[ . 1 . 2]" 1
245 1 16 ARG QB 1 19 ALA H 3.600 . 5.200 4.460 4.304 4.616 . 0 0 "[ . 1 . 2]" 1
246 1 18 THR MG 1 19 ALA H 3.900 . 5.800 3.913 3.482 4.028 . 0 0 "[ . 1 . 2]" 1
247 1 19 ALA H 1 148 ILE MG 3.700 . 5.400 4.042 3.456 4.571 . 0 0 "[ . 1 . 2]" 1
248 1 99 VAL H 1 100 THR H 3.600 . 5.200 4.333 4.280 4.404 . 0 0 "[ . 1 . 2]" 1
249 1 76 THR HA 1 100 THR H 3.500 . 5.000 5.008 4.886 5.087 0.087 20 0 "[ . 1 . 2]" 1
250 1 100 THR H 1 100 THR HA 2.700 . 3.600 2.929 2.921 2.941 . 0 0 "[ . 1 . 2]" 1
251 1 99 VAL HA 1 100 THR H 2.600 . 3.500 2.156 2.081 2.183 . 0 0 "[ . 1 . 2]" 1
252 1 100 THR H 1 111 VAL HA 3.700 . 5.400 4.603 4.357 4.877 . 0 0 "[ . 1 . 2]" 1
253 1 100 THR H 1 112 ASP QB 3.600 . 5.200 4.267 3.635 5.051 . 0 0 "[ . 1 . 2]" 1
254 1 99 VAL HB 1 100 THR H 3.500 . 5.000 4.304 3.555 4.410 . 0 0 "[ . 1 . 2]" 1
255 1 100 THR H 1 100 THR MG 3.900 . 5.800 3.830 3.810 3.847 . 0 0 "[ . 1 . 2]" 1
256 1 100 THR H 1 113 VAL MG2 3.900 . 5.800 3.142 2.903 3.943 . 0 0 "[ . 1 . 2]" 1
257 1 100 THR H 1 111 VAL MG1 3.900 . 5.800 5.193 4.958 5.708 . 0 0 "[ . 1 . 2]" 1
258 1 100 THR H 1 112 ASP H 2.800 . 3.800 3.126 2.809 3.316 . 0 0 "[ . 1 . 2]" 1
259 1 100 THR H 1 112 ASP HA 3.400 . 4.800 4.763 4.535 4.847 0.047 8 0 "[ . 1 . 2]" 1
260 1 100 THR H 1 113 VAL HA 3.000 . 4.100 2.844 2.603 3.158 . 0 0 "[ . 1 . 2]" 1
261 1 100 THR H 1 113 VAL MG1 4.200 . 6.000 4.820 4.454 5.625 . 0 0 "[ . 1 . 2]" 1
262 1 53 TRP H 1 82 ARG QB 4.000 . 6.000 5.126 4.567 5.711 . 0 0 "[ . 1 . 2]" 1
263 1 53 TRP H 1 68 ILE H 3.900 . 5.800 4.234 3.829 4.497 . 0 0 "[ . 1 . 2]" 1
264 1 53 TRP H 1 66 GLY H 2.600 . 3.500 2.569 2.120 3.617 0.117 12 0 "[ . 1 . 2]" 1
265 1 53 TRP H 1 66 GLY HA2 3.800 . 5.600 4.156 3.771 4.852 . 0 0 "[ . 1 . 2]" 1
266 1 53 TRP H 1 53 TRP HA 2.600 . 3.400 2.943 2.912 2.962 . 0 0 "[ . 1 . 2]" 1
267 1 53 TRP H 1 66 GLY HA3 2.900 . 4.000 3.038 2.443 4.058 0.058 2 0 "[ . 1 . 2]" 1
268 1 53 TRP H 1 53 TRP HB2 3.500 . 5.000 2.567 2.416 3.603 . 0 0 "[ . 1 . 2]" 1
269 1 53 TRP H 1 68 ILE HB 4.400 . 6.000 5.704 5.157 6.036 0.036 11 0 "[ . 1 . 2]" 1
270 1 53 TRP H 1 68 ILE HG13 3.500 . 5.000 3.682 3.138 3.993 . 0 0 "[ . 1 . 2]" 1
271 1 53 TRP H 1 68 ILE MD 4.000 . 6.000 4.026 3.372 4.331 . 0 0 "[ . 1 . 2]" 1
272 1 53 TRP H 1 67 LEU HA 3.500 . 5.000 4.310 3.482 5.226 0.226 20 0 "[ . 1 . 2]" 1
273 1 52 ARG QD 1 53 TRP H 2.400 . 6.000 4.894 3.536 5.581 . 0 0 "[ . 1 . 2]" 1
274 1 100 THR HB 1 113 VAL H 3.300 . 6.000 5.409 5.241 5.912 . 0 0 "[ . 1 . 2]" 1
275 1 7 ARG HB3 1 113 VAL H 4.200 . 6.000 5.530 5.234 5.725 . 0 0 "[ . 1 . 2]" 1
276 1 112 ASP H 1 113 VAL H 3.100 . 4.300 4.086 3.929 4.254 . 0 0 "[ . 1 . 2]" 1
277 1 113 VAL H 1 113 VAL HA 2.700 . 3.600 2.927 2.895 2.949 . 0 0 "[ . 1 . 2]" 1
278 1 111 VAL HA 1 113 VAL H 2.400 . 6.000 5.698 5.540 5.979 . 0 0 "[ . 1 . 2]" 1
279 1 112 ASP HB3 1 113 VAL H 3.600 . 5.300 4.272 4.042 4.439 . 0 0 "[ . 1 . 2]" 1
280 1 7 ARG QG 1 113 VAL H 3.100 . 4.300 2.915 2.708 3.273 . 0 0 "[ . 1 . 2]" 1
281 1 99 VAL QG 1 113 VAL H 3.800 . 5.200 4.689 4.462 4.799 . 0 0 "[ . 1 . 2]" 1
282 1 113 VAL H 1 113 VAL MG2 3.400 . 4.900 2.966 2.682 3.562 . 0 0 "[ . 1 . 2]" 1
283 1 111 VAL MG1 1 113 VAL H 2.400 . 6.000 4.263 3.893 5.132 . 0 0 "[ . 1 . 2]" 1
284 1 9 SER HA 1 113 VAL H 3.200 . 4.500 3.800 3.539 4.028 . 0 0 "[ . 1 . 2]" 1
285 1 9 SER QB 1 113 VAL H 2.400 . 6.000 4.681 4.027 5.420 . 0 0 "[ . 1 . 2]" 1
286 1 8 HIS HB3 1 113 VAL H 2.900 . 3.900 3.452 2.406 3.927 0.027 6 0 "[ . 1 . 2]" 1
287 1 7 ARG HA 1 113 VAL H 3.800 . 5.600 4.045 3.779 4.299 . 0 0 "[ . 1 . 2]" 1
288 1 8 HIS H 1 113 VAL H 2.100 . 2.700 2.439 2.169 2.708 0.008 4 0 "[ . 1 . 2]" 1
289 1 10 VAL H 1 110 ARG HG3 3.700 . 5.400 4.877 4.304 5.826 0.426 19 0 "[ . 1 . 2]" 1
290 1 10 VAL H 1 112 ASP HA 3.600 . 5.200 4.279 3.859 4.562 . 0 0 "[ . 1 . 2]" 1
291 1 10 VAL H 1 110 ARG HA 3.700 . 5.400 4.361 4.049 4.639 . 0 0 "[ . 1 . 2]" 1
292 1 8 HIS HB2 1 10 VAL H 3.800 . 6.000 6.284 6.047 6.810 0.810 10 4 "[ . - + . * *]" 1
293 1 10 VAL H 1 112 ASP HB2 3.700 . 6.000 5.735 4.981 6.418 0.418 3 0 "[ . 1 . 2]" 1
294 1 10 VAL H 1 10 VAL HB 2.900 . 3.900 2.943 2.437 3.955 0.055 18 0 "[ . 1 . 2]" 1
295 1 10 VAL H 1 10 VAL QG 3.300 . 4.000 2.835 2.264 3.144 . 0 0 "[ . 1 . 2]" 1
296 1 10 VAL H 1 11 THR HA 3.500 . 5.000 4.863 4.704 4.967 . 0 0 "[ . 1 . 2]" 1
297 1 10 VAL H 1 111 VAL HB 4.000 . 6.000 4.369 4.100 4.746 . 0 0 "[ . 1 . 2]" 1
298 1 38 THR HA 1 55 GLU H 3.400 . 6.000 5.886 5.044 6.148 0.148 9 0 "[ . 1 . 2]" 1
299 1 55 GLU H 1 63 HIS QB 2.700 . 3.600 2.111 1.753 2.631 0.147 8 0 "[ . 1 . 2]" 1
300 1 54 TYR QB 1 55 GLU H 3.000 . 4.100 2.511 2.041 2.844 . 0 0 "[ . 1 . 2]" 1
301 1 98 THR H 1 99 VAL H 3.500 . 5.000 4.278 3.976 4.367 . 0 0 "[ . 1 . 2]" 1
302 1 98 THR H 1 116 THR H 4.100 . 6.000 5.155 4.295 6.054 0.054 7 0 "[ . 1 . 2]" 1
303 1 97 PHE HA 1 98 THR H 2.500 . 3.300 2.133 2.063 2.245 . 0 0 "[ . 1 . 2]" 1
304 1 98 THR H 1 115 HIS HA 3.400 . 4.900 3.666 2.941 4.134 . 0 0 "[ . 1 . 2]" 1
305 1 97 PHE HB2 1 98 THR H 3.300 . 4.600 3.135 2.642 3.814 . 0 0 "[ . 1 . 2]" 1
306 1 97 PHE HB3 1 98 THR H 3.900 . 5.800 3.840 2.928 4.145 . 0 0 "[ . 1 . 2]" 1
307 1 98 THR H 1 114 GLU HB3 3.200 . 4.500 3.992 2.957 5.261 0.761 7 1 "[ . + 1 . 2]" 1
308 1 98 THR H 1 98 THR MG 3.900 . 5.800 3.805 3.784 3.867 . 0 0 "[ . 1 . 2]" 1
309 1 78 VAL QG 1 98 THR H 3.300 . 4.700 3.928 3.474 4.395 . 0 0 "[ . 1 . 2]" 1
310 1 98 THR H 1 113 VAL MG1 3.200 . 4.500 3.353 2.943 4.123 . 0 0 "[ . 1 . 2]" 1
311 1 98 THR H 1 113 VAL HA 3.600 . 5.200 4.466 4.267 4.785 . 0 0 "[ . 1 . 2]" 1
312 1 95 SER H 1 118 PHE QD 3.500 . 5.000 3.632 1.919 4.701 0.081 18 0 "[ . 1 . 2]" 1
313 1 95 SER H 1 118 PHE QB 2.500 . 3.300 2.378 1.668 3.230 0.032 13 0 "[ . 1 . 2]" 1
314 1 118 PHE H 1 118 PHE HA 3.000 . 4.100 2.856 2.753 2.909 . 0 0 "[ . 1 . 2]" 1
315 1 118 PHE H 1 118 PHE QB 2.900 . 3.900 2.236 2.118 2.331 . 0 0 "[ . 1 . 2]" 1
316 1 117 HIS H 1 118 PHE H 2.900 . 4.000 2.688 2.295 3.616 . 0 0 "[ . 1 . 2]" 1
317 1 117 HIS HD2 1 118 PHE H 3.200 . 4.400 3.933 3.122 4.472 0.072 2 0 "[ . 1 . 2]" 1
318 1 94 SER QB 1 118 PHE H 3.600 . 4.800 4.202 3.028 4.723 . 0 0 "[ . 1 . 2]" 1
319 1 44 LEU QD 1 55 GLU H 4.200 . 6.000 4.036 3.276 4.643 . 0 0 "[ . 1 . 2]" 1
320 1 55 GLU H 1 55 GLU HB2 2.700 . 6.000 2.742 2.591 3.116 . 0 0 "[ . 1 . 2]" 1
321 1 54 TYR QD 1 55 GLU H 3.300 . 4.700 3.544 2.842 4.177 . 0 0 "[ . 1 . 2]" 1
322 1 55 GLU H 1 55 GLU HA 2.600 . 3.500 2.941 2.914 2.960 . 0 0 "[ . 1 . 2]" 1
323 1 55 GLU H 1 63 HIS HD2 3.400 . 4.800 4.504 3.479 4.971 0.171 5 0 "[ . 1 . 2]" 1
324 1 94 SER H 1 95 SER H 3.100 . 4.300 3.415 1.945 4.313 0.013 2 0 "[ . 1 . 2]" 1
325 1 95 SER H 1 95 SER HB2 3.300 . 4.700 3.291 2.380 3.674 . 0 0 "[ . 1 . 2]" 1
326 1 81 TRP HB2 1 95 SER H 3.300 . 6.000 5.487 2.942 6.124 0.124 19 0 "[ . 1 . 2]" 1
327 1 95 SER H 1 96 GLU QB 3.700 . 5.500 4.524 4.074 5.039 . 0 0 "[ . 1 . 2]" 1
328 1 81 TRP HB3 1 95 SER H 3.300 . 6.000 5.023 3.160 5.948 . 0 0 "[ . 1 . 2]" 1
329 1 55 GLU HG3 1 56 ILE H 3.700 . 5.400 4.649 4.166 5.183 . 0 0 "[ . 1 . 2]" 1
330 1 55 GLU HA 1 56 ILE H 2.600 . 3.400 2.426 2.233 2.645 . 0 0 "[ . 1 . 2]" 1
331 1 56 ILE H 1 56 ILE HA 2.600 . 3.500 2.887 2.867 2.948 . 0 0 "[ . 1 . 2]" 1
332 1 55 GLU HB2 1 56 ILE H 3.400 . 4.800 3.328 2.707 3.607 . 0 0 "[ . 1 . 2]" 1
333 1 56 ILE H 1 56 ILE HB 2.900 . 4.000 2.605 2.510 2.690 . 0 0 "[ . 1 . 2]" 1
334 1 56 ILE H 1 56 ILE HG13 3.900 . 5.800 3.733 3.500 4.171 . 0 0 "[ . 1 . 2]" 1
335 1 56 ILE H 1 56 ILE HG12 2.400 . 3.100 2.232 1.924 2.748 . 0 0 "[ . 1 . 2]" 1
336 1 5 PHE H 1 6 VAL QG 3.400 . 4.800 4.556 4.255 4.774 . 0 0 "[ . 1 . 2]" 1
337 1 2 TYR H 1 5 PHE H 3.200 . 4.500 3.774 3.417 4.185 . 0 0 "[ . 1 . 2]" 1
338 1 5 PHE H 1 5 PHE QE 3.800 . 5.600 4.691 4.243 5.359 . 0 0 "[ . 1 . 2]" 1
339 1 5 PHE H 1 5 PHE HA 2.800 . 3.800 2.895 2.863 2.943 . 0 0 "[ . 1 . 2]" 1
340 1 3 ASP HA 1 5 PHE H 3.700 . 6.000 5.694 5.356 5.906 . 0 0 "[ . 1 . 2]" 1
341 1 4 PRO HD2 1 5 PHE H 3.000 . 4.100 2.206 1.817 2.835 0.083 7 0 "[ . 1 . 2]" 1
342 1 5 PHE H 1 5 PHE HB3 3.200 . 4.500 3.594 3.315 3.919 . 0 0 "[ . 1 . 2]" 1
343 1 5 PHE H 1 5 PHE HB2 3.000 . 4.100 3.484 2.652 3.972 . 0 0 "[ . 1 . 2]" 1
344 1 4 PRO HB3 1 5 PHE H 4.000 . 6.000 3.653 3.549 3.774 . 0 0 "[ . 1 . 2]" 1
345 1 3 ASP H 1 5 PHE H 4.000 . 6.000 4.634 4.383 5.086 . 0 0 "[ . 1 . 2]" 1
346 1 32 PRO HG2 1 33 ASN H 3.800 . 5.600 2.617 1.973 4.197 0.027 19 0 "[ . 1 . 2]" 1
347 1 23 PHE H 1 24 LEU H 2.800 . 3.800 2.677 2.368 2.806 . 0 0 "[ . 1 . 2]" 1
348 1 23 PHE H 1 23 PHE QD 4.000 . 6.000 4.194 4.169 4.232 . 0 0 "[ . 1 . 2]" 1
349 1 23 PHE H 1 23 PHE HA 3.000 . 4.100 2.825 2.793 2.901 . 0 0 "[ . 1 . 2]" 1
350 1 23 PHE H 1 23 PHE HB3 2.900 . 4.000 2.585 2.520 2.640 . 0 0 "[ . 1 . 2]" 1
351 1 23 PHE H 1 23 PHE HB2 2.700 . 3.600 2.497 2.432 2.672 . 0 0 "[ . 1 . 2]" 1
352 1 32 PRO HB2 1 33 ASN H 2.100 . 6.000 1.670 1.309 2.264 . 0 0 "[ . 1 . 2]" 1
353 1 23 PHE H 1 148 ILE MD 3.500 . 5.000 4.028 3.732 4.478 . 0 0 "[ . 1 . 2]" 1
354 1 101 PHE H 1 101 PHE HA 2.800 . 3.800 2.908 2.892 2.929 . 0 0 "[ . 1 . 2]" 1
355 1 101 PHE H 1 101 PHE HB2 2.500 . 3.300 2.340 2.305 2.383 . 0 0 "[ . 1 . 2]" 1
356 1 101 PHE H 1 101 PHE HB3 3.600 . 5.200 3.591 3.570 3.622 . 0 0 "[ . 1 . 2]" 1
357 1 99 VAL QG 1 101 PHE H 3.100 . 4.300 3.512 3.175 3.672 . 0 0 "[ . 1 . 2]" 1
358 1 101 PHE H 1 101 PHE QD 3.400 . 4.800 3.215 2.955 3.434 . 0 0 "[ . 1 . 2]" 1
359 1 72 ASP H 1 76 THR H 3.300 . 4.600 3.828 3.555 4.044 . 0 0 "[ . 1 . 2]" 1
360 1 20 PHE QE 1 72 ASP H 3.100 . 4.300 4.292 4.075 4.398 0.098 6 0 "[ . 1 . 2]" 1
361 1 72 ASP H 1 75 ASP HB3 3.900 . 5.800 5.269 5.079 5.494 . 0 0 "[ . 1 . 2]" 1
362 1 70 LYS HG2 1 72 ASP H 2.800 . 3.800 3.064 2.511 3.708 . 0 0 "[ . 1 . 2]" 1
363 1 20 PHE QD 1 72 ASP H 3.400 . 6.000 5.545 5.405 5.767 . 0 0 "[ . 1 . 2]" 1
364 1 71 VAL HB 1 72 ASP H 3.700 . 5.400 4.326 3.518 4.458 . 0 0 "[ . 1 . 2]" 1
365 1 72 ASP H 1 77 LEU QB 3.600 . 5.200 3.512 1.967 3.830 0.033 6 0 "[ . 1 . 2]" 1
366 1 70 LYS HG3 1 72 ASP H 3.400 . 4.800 4.222 3.705 4.718 . 0 0 "[ . 1 . 2]" 1
367 1 72 ASP H 1 76 THR HB 3.500 . 5.000 4.884 4.681 5.060 0.060 10 0 "[ . 1 . 2]" 1
368 1 22 THR H 1 23 PHE H 2.800 . 3.800 2.666 2.517 2.738 . 0 0 "[ . 1 . 2]" 1
369 1 101 PHE H 1 101 PHE QE 3.800 . 5.600 4.992 4.830 5.119 . 0 0 "[ . 1 . 2]" 1
370 1 33 ASN H 1 34 ASN HD22 3.800 . 5.600 5.466 4.991 5.735 0.135 14 0 "[ . 1 . 2]" 1
371 1 69 ARG H 1 80 GLY H 3.600 . 5.200 3.862 3.529 4.226 . 0 0 "[ . 1 . 2]" 1
372 1 69 ARG H 1 79 ILE MD 4.300 . 6.000 5.243 4.494 5.831 . 0 0 "[ . 1 . 2]" 1
373 1 69 ARG H 1 70 LYS H 2.600 . 3.400 2.094 1.922 2.271 . 0 0 "[ . 1 . 2]" 1
374 1 69 ARG H 1 79 ILE HA 2.600 . 3.400 2.552 2.061 3.142 . 0 0 "[ . 1 . 2]" 1
375 1 69 ARG H 1 69 ARG HG2 3.300 . 4.600 3.068 1.765 4.479 0.235 17 0 "[ . 1 . 2]" 1
376 1 69 ARG H 1 70 LYS HB2 3.800 . 5.600 5.183 5.036 5.479 . 0 0 "[ . 1 . 2]" 1
377 1 69 ARG H 1 69 ARG HB3 3.500 . 5.100 3.635 3.540 3.720 . 0 0 "[ . 1 . 2]" 1
378 1 68 ILE MD 1 69 ARG H 4.100 . 6.000 4.180 3.952 4.475 . 0 0 "[ . 1 . 2]" 1
379 1 69 ARG H 1 79 ILE MG 4.000 . 6.000 4.806 4.331 5.055 . 0 0 "[ . 1 . 2]" 1
380 1 69 ARG H 1 69 ARG QD 2.700 . 3.600 3.156 2.322 3.632 0.032 10 0 "[ . 1 . 2]" 1
381 1 69 ARG H 1 71 VAL QG 4.300 . 6.000 4.871 4.587 5.138 . 0 0 "[ . 1 . 2]" 1
382 1 69 ARG H 1 78 VAL H 3.300 . 4.700 4.426 4.230 4.667 . 0 0 "[ . 1 . 2]" 1
383 1 79 ILE H 1 80 GLY H 3.400 . 4.900 4.361 4.250 4.440 . 0 0 "[ . 1 . 2]" 1
384 1 79 ILE H 1 96 GLU HA 3.400 . 4.800 4.498 4.053 4.704 . 0 0 "[ . 1 . 2]" 1
385 1 79 ILE H 1 98 THR HA 3.900 . 5.800 3.672 3.259 4.152 . 0 0 "[ . 1 . 2]" 1
386 1 79 ILE H 1 79 ILE HA 2.700 . 3.600 2.938 2.928 2.952 . 0 0 "[ . 1 . 2]" 1
387 1 79 ILE H 1 96 GLU QB 3.400 . 4.900 3.900 3.240 4.790 . 0 0 "[ . 1 . 2]" 1
388 1 78 VAL HB 1 79 ILE H 3.600 . 5.200 4.333 4.140 4.419 . 0 0 "[ . 1 . 2]" 1
389 1 77 LEU QB 1 79 ILE H 3.400 . 4.800 4.346 4.136 4.509 . 0 0 "[ . 1 . 2]" 1
390 1 79 ILE H 1 98 THR MG 4.500 . 6.000 5.248 4.840 5.713 . 0 0 "[ . 1 . 2]" 1
391 1 78 VAL QG 1 79 ILE H 4.100 . 4.900 3.031 2.918 3.177 . 0 0 "[ . 1 . 2]" 1
392 1 79 ILE H 1 79 ILE HG13 3.600 . 5.200 4.630 3.769 5.051 . 0 0 "[ . 1 . 2]" 1
393 1 79 ILE H 1 79 ILE HB 3.100 . 4.300 3.418 3.257 3.598 . 0 0 "[ . 1 . 2]" 1
394 1 71 VAL H 1 78 VAL H 3.600 . 5.200 4.944 4.768 5.218 0.018 4 0 "[ . 1 . 2]" 1
395 1 70 LYS H 1 71 VAL H 3.400 . 4.800 3.946 3.707 4.148 . 0 0 "[ . 1 . 2]" 1
396 1 71 VAL H 1 72 ASP HB2 3.600 . 6.000 5.050 4.764 6.074 0.074 13 0 "[ . 1 . 2]" 1
397 1 70 LYS HB3 1 71 VAL H 4.100 . 6.000 4.409 4.195 4.514 . 0 0 "[ . 1 . 2]" 1
398 1 70 LYS HB2 1 71 VAL H 4.200 . 6.000 4.280 4.083 4.486 . 0 0 "[ . 1 . 2]" 1
399 1 71 VAL H 1 71 VAL QG 3.100 . 4.300 2.434 1.930 2.711 0.070 2 0 "[ . 1 . 2]" 1
400 1 68 ILE MG 1 71 VAL H 3.100 . 4.300 3.318 2.957 3.623 . 0 0 "[ . 1 . 2]" 1
401 1 20 PHE H 1 22 THR H 3.300 . 4.600 4.260 4.124 4.409 . 0 0 "[ . 1 . 2]" 1
402 1 18 THR H 1 20 PHE H 3.400 . 4.800 4.239 4.063 4.357 . 0 0 "[ . 1 . 2]" 1
403 1 20 PHE H 1 21 LYS H 2.800 . 3.800 2.608 2.552 2.716 . 0 0 "[ . 1 . 2]" 1
404 1 20 PHE H 1 20 PHE QD 3.800 . 5.600 4.146 4.109 4.167 . 0 0 "[ . 1 . 2]" 1
405 1 16 ARG HA 1 20 PHE H 3.000 . 4.100 3.826 3.663 3.987 . 0 0 "[ . 1 . 2]" 1
406 1 19 ALA HA 1 20 PHE H 3.100 . 4.300 3.551 3.537 3.561 . 0 0 "[ . 1 . 2]" 1
407 1 17 LYS HA 1 20 PHE H 3.200 . 4.500 3.873 3.650 4.111 . 0 0 "[ . 1 . 2]" 1
408 1 20 PHE H 1 20 PHE HB2 3.100 . 4.300 2.706 2.629 2.786 . 0 0 "[ . 1 . 2]" 1
409 1 20 PHE H 1 101 PHE HB3 3.500 . 6.000 5.584 5.394 5.782 . 0 0 "[ . 1 . 2]" 1
410 1 20 PHE H 1 20 PHE HB3 2.500 . 3.300 2.367 2.311 2.415 . 0 0 "[ . 1 . 2]" 1
411 1 20 PHE H 1 21 LYS HB2 3.900 . 5.800 5.169 4.814 5.814 0.014 19 0 "[ . 1 . 2]" 1
412 1 16 ARG QB 1 20 PHE H 3.500 . 5.000 4.927 4.790 5.028 0.028 9 0 "[ . 1 . 2]" 1
413 1 16 ARG HG2 1 20 PHE H 3.200 . 4.500 4.343 4.069 4.510 0.010 19 0 "[ . 1 . 2]" 1
414 1 20 PHE H 1 109 THR MG 3.800 . 5.600 5.000 4.842 5.192 . 0 0 "[ . 1 . 2]" 1
415 1 12 VAL QG 1 20 PHE H 4.100 . 6.000 4.485 4.255 4.935 . 0 0 "[ . 1 . 2]" 1
416 1 20 PHE H 1 22 THR HB 3.500 . 6.000 5.569 5.336 5.826 . 0 0 "[ . 1 . 2]" 1
417 1 49 LYS H 1 50 GLY H 2.900 . 4.000 2.552 2.289 2.777 . 0 0 "[ . 1 . 2]" 1
418 1 50 GLY H 1 51 GLY H 2.700 . 3.600 2.282 2.028 2.521 . 0 0 "[ . 1 . 2]" 1
419 1 50 GLY H 1 51 GLY HA2 3.900 . 5.800 4.525 4.222 4.720 . 0 0 "[ . 1 . 2]" 1
420 1 47 ASP HB2 1 50 GLY H 3.700 . 5.400 4.699 4.392 4.836 . 0 0 "[ . 1 . 2]" 1
421 1 49 LYS HB3 1 50 GLY H 3.700 . 5.500 3.495 2.214 4.138 . 0 0 "[ . 1 . 2]" 1
422 1 49 LYS QG 1 50 GLY H 2.700 . 3.000 2.343 1.876 2.903 0.024 11 0 "[ . 1 . 2]" 1
423 1 89 ILE H 1 128 ARG HA 4.200 . 6.000 5.291 4.522 6.118 0.118 20 0 "[ . 1 . 2]" 1
424 1 89 ILE H 1 89 ILE HA 2.900 . 4.000 2.896 2.763 2.953 . 0 0 "[ . 1 . 2]" 1
425 1 88 ARG HB3 1 89 ILE H 3.300 . 4.700 2.796 1.860 3.926 0.040 2 0 "[ . 1 . 2]" 1
426 1 38 THR HB 1 57 ASP H 3.400 . 6.000 5.882 4.777 6.113 0.113 3 0 "[ . 1 . 2]" 1
427 1 56 ILE HG13 1 57 ASP H 4.300 . 6.000 5.729 5.506 5.915 . 0 0 "[ . 1 . 2]" 1
428 1 57 ASP H 1 63 HIS H 3.500 . 5.000 4.980 4.409 5.245 0.245 2 0 "[ . 1 . 2]" 1
429 1 57 ASP H 1 63 HIS HD2 3.000 . 4.100 3.671 1.977 4.193 0.093 16 0 "[ . 1 . 2]" 1
430 1 57 ASP H 1 61 GLU HA 2.300 . 3.000 2.221 1.526 3.133 0.133 3 0 "[ . 1 . 2]" 1
431 1 57 ASP H 1 57 ASP QB 2.600 . 3.500 2.369 2.243 2.877 . 0 0 "[ . 1 . 2]" 1
432 1 57 ASP H 1 63 HIS QB 3.200 . 6.000 4.047 3.282 4.842 . 0 0 "[ . 1 . 2]" 1
433 1 57 ASP H 1 61 GLU QG 3.700 . 5.400 3.858 2.803 4.465 . 0 0 "[ . 1 . 2]" 1
434 1 57 ASP H 1 61 GLU QB 4.200 . 6.000 4.246 2.965 5.089 . 0 0 "[ . 1 . 2]" 1
435 1 56 ILE HB 1 57 ASP H 3.400 . 4.900 4.355 4.233 4.429 . 0 0 "[ . 1 . 2]" 1
436 1 56 ILE MD 1 57 ASP H 4.200 . 6.000 3.890 3.657 4.182 . 0 0 "[ . 1 . 2]" 1
437 1 38 THR MG 1 57 ASP H 3.500 . 5.100 4.126 3.211 4.437 . 0 0 "[ . 1 . 2]" 1
438 1 144 PHE HA 1 146 ASP H 3.200 . 4.400 4.170 4.013 4.412 0.012 9 0 "[ . 1 . 2]" 1
439 1 145 GLN H 1 146 ASP H 2.800 . 3.700 2.602 2.464 2.753 . 0 0 "[ . 1 . 2]" 1
440 1 146 ASP H 1 147 LYS H 2.900 . 3.900 2.657 2.515 2.960 . 0 0 "[ . 1 . 2]" 1
441 1 143 SER HB2 1 146 ASP H 3.600 . 6.000 5.312 4.969 5.630 . 0 0 "[ . 1 . 2]" 1
442 1 142 GLN HA 1 146 ASP H 3.100 . 6.000 4.470 4.245 4.650 . 0 0 "[ . 1 . 2]" 1
443 1 145 GLN HA 1 146 ASP H 3.100 . 4.300 3.474 3.425 3.537 . 0 0 "[ . 1 . 2]" 1
444 1 145 GLN HB3 1 146 ASP H 3.100 . 4.300 3.559 3.424 3.691 . 0 0 "[ . 1 . 2]" 1
445 1 145 GLN HB2 1 146 ASP H 3.600 . 5.200 2.847 2.646 3.080 . 0 0 "[ . 1 . 2]" 1
446 1 146 ASP H 1 148 ILE HB 3.400 . 4.800 4.855 4.521 4.967 0.167 19 0 "[ . 1 . 2]" 1
447 1 10 VAL QG 1 146 ASP H 2.400 . 6.000 5.558 5.058 6.065 0.065 15 0 "[ . 1 . 2]" 1
448 1 52 ARG H 1 68 ILE H 3.600 . 5.200 4.751 3.985 5.214 0.014 8 0 "[ . 1 . 2]" 1
449 1 46 VAL HA 1 52 ARG H 3.600 . 5.200 4.783 4.598 5.165 . 0 0 "[ . 1 . 2]" 1
450 1 47 ASP HB3 1 52 ARG H 3.000 . 4.100 2.427 1.903 2.699 . 0 0 "[ . 1 . 2]" 1
451 1 52 ARG H 1 52 ARG QB 3.100 . 4.300 3.023 2.507 3.296 . 0 0 "[ . 1 . 2]" 1
452 1 52 ARG H 1 53 TRP H 3.500 . 5.000 4.357 4.228 4.446 . 0 0 "[ . 1 . 2]" 1
453 1 51 GLY H 1 52 ARG H 2.800 . 3.800 2.545 2.283 2.792 . 0 0 "[ . 1 . 2]" 1
454 1 52 ARG H 1 52 ARG HA 2.800 . 3.800 2.909 2.870 2.951 . 0 0 "[ . 1 . 2]" 1
455 1 51 GLY HA2 1 52 ARG H 3.700 . 5.400 2.573 2.344 2.797 . 0 0 "[ . 1 . 2]" 1
456 1 52 ARG H 1 52 ARG QD 3.100 . 4.300 3.432 2.069 4.238 . 0 0 "[ . 1 . 2]" 1
457 1 47 ASP HB2 1 52 ARG H 3.000 . 4.100 4.075 3.647 4.251 0.151 12 0 "[ . 1 . 2]" 1
458 1 52 ARG H 1 68 ILE HG13 3.100 . 4.300 3.922 3.260 4.315 0.015 12 0 "[ . 1 . 2]" 1
459 1 52 ARG H 1 54 TYR QD 3.400 . 4.900 4.671 4.118 4.986 0.086 20 0 "[ . 1 . 2]" 1
460 1 51 GLY HA3 1 52 ARG H 2.700 . 3.600 3.566 3.511 3.586 . 0 0 "[ . 1 . 2]" 1
461 1 52 ARG H 1 68 ILE HB 3.700 . 5.400 4.202 3.525 4.538 . 0 0 "[ . 1 . 2]" 1
462 1 52 ARG H 1 68 ILE MD 2.900 . 3.900 2.846 2.446 3.331 . 0 0 "[ . 1 . 2]" 1
463 1 106 GLN H 1 106 GLN QB 3.100 . 4.300 2.811 2.231 3.335 . 0 0 "[ . 1 . 2]" 1
464 1 9 SER HA 1 112 ASP H 3.400 . 4.800 4.796 4.621 4.923 0.123 9 0 "[ . 1 . 2]" 1
465 1 100 THR HA 1 112 ASP H 3.200 . 4.500 4.567 4.442 4.632 0.132 9 0 "[ . 1 . 2]" 1
466 1 112 ASP H 1 112 ASP HA 2.800 . 3.800 2.938 2.922 2.950 . 0 0 "[ . 1 . 2]" 1
467 1 99 VAL HA 1 112 ASP H 3.700 . 5.400 4.765 4.205 5.035 . 0 0 "[ . 1 . 2]" 1
468 1 100 THR HB 1 112 ASP H 2.900 . 3.900 2.850 2.413 3.160 . 0 0 "[ . 1 . 2]" 1
469 1 112 ASP H 1 112 ASP QB 3.100 . 4.300 2.630 2.500 3.016 . 0 0 "[ . 1 . 2]" 1
470 1 111 VAL HB 1 112 ASP H 3.700 . 5.400 4.038 3.710 4.157 . 0 0 "[ . 1 . 2]" 1
471 1 100 THR MG 1 112 ASP H 3.600 . 5.200 3.858 3.757 4.080 . 0 0 "[ . 1 . 2]" 1
472 1 111 VAL MG2 1 112 ASP H 2.800 . 3.800 2.375 2.159 2.554 . 0 0 "[ . 1 . 2]" 1
473 1 7 ARG QG 1 112 ASP H 3.600 . 6.000 5.865 5.572 6.111 0.111 16 0 "[ . 1 . 2]" 1
474 1 112 ASP H 1 113 VAL MG2 3.800 . 5.600 4.281 3.828 5.148 . 0 0 "[ . 1 . 2]" 1
475 1 114 GLU H 1 115 HIS H 3.500 . 5.000 4.290 4.105 4.468 . 0 0 "[ . 1 . 2]" 1
476 1 7 ARG HG3 1 114 GLU H 3.200 . 6.000 4.960 4.436 5.409 . 0 0 "[ . 1 . 2]" 1
477 1 98 THR H 1 114 GLU H 2.800 . 3.800 3.190 2.781 3.456 . 0 0 "[ . 1 . 2]" 1
478 1 97 PHE HA 1 114 GLU H 3.500 . 5.100 4.770 4.066 5.127 0.027 9 0 "[ . 1 . 2]" 1
479 1 7 ARG HA 1 114 GLU H 3.600 . 5.200 4.916 4.696 5.128 . 0 0 "[ . 1 . 2]" 1
480 1 114 GLU H 1 114 GLU HA 2.900 . 4.000 2.930 2.911 2.945 . 0 0 "[ . 1 . 2]" 1
481 1 99 VAL HA 1 114 GLU H 3.800 . 5.600 4.060 3.512 4.278 . 0 0 "[ . 1 . 2]" 1
482 1 97 PHE HB2 1 114 GLU H 3.400 . 6.000 4.430 3.978 5.967 . 0 0 "[ . 1 . 2]" 1
483 1 114 GLU H 1 114 GLU HB2 3.100 . 4.300 2.687 2.395 2.963 . 0 0 "[ . 1 . 2]" 1
484 1 113 VAL HB 1 114 GLU H 3.500 . 5.100 4.400 4.324 4.487 . 0 0 "[ . 1 . 2]" 1
485 1 99 VAL QG 1 114 GLU H 2.400 . 6.000 4.778 4.446 4.967 . 0 0 "[ . 1 . 2]" 1
486 1 24 LEU H 1 25 GLU H 2.700 . 3.600 2.258 2.078 2.495 . 0 0 "[ . 1 . 2]" 1
487 1 25 GLU H 1 26 GLY H 2.800 . 3.800 2.439 1.976 2.889 . 0 0 "[ . 1 . 2]" 1
488 1 25 GLU H 1 27 PHE H 3.800 . 5.600 4.588 3.842 5.641 0.041 1 0 "[ . 1 . 2]" 1
489 1 21 LYS HA 1 25 GLU H 2.900 . 4.000 3.055 2.663 3.320 . 0 0 "[ . 1 . 2]" 1
490 1 23 PHE HB3 1 25 GLU H 3.700 . 5.400 5.018 4.750 5.265 . 0 0 "[ . 1 . 2]" 1
491 1 25 GLU H 1 25 GLU QB 3.100 . 4.300 2.171 1.991 2.369 . 0 0 "[ . 1 . 2]" 1
492 1 24 LEU HB2 1 25 GLU H 3.500 . 5.100 3.703 3.540 4.172 . 0 0 "[ . 1 . 2]" 1
493 1 24 LEU HG 1 25 GLU H 3.400 . 4.800 4.078 3.774 4.664 . 0 0 "[ . 1 . 2]" 1
494 1 24 LEU HB3 1 25 GLU H 2.600 . 6.000 2.512 2.262 3.388 . 0 0 "[ . 1 . 2]" 1
495 1 3 ASP H 1 3 ASP HA 3.000 . 4.200 2.813 2.736 2.853 . 0 0 "[ . 1 . 2]" 1
496 1 2 TYR HA 1 3 ASP H 3.200 . 4.500 3.520 3.405 3.578 . 0 0 "[ . 1 . 2]" 1
497 1 3 ASP H 1 3 ASP HB2 2.900 . 4.000 2.614 2.443 2.959 . 0 0 "[ . 1 . 2]" 1
498 1 2 TYR HB3 1 3 ASP H 3.400 . 4.800 3.824 2.822 4.098 . 0 0 "[ . 1 . 2]" 1
499 1 7 ARG H 1 8 HIS H 3.200 . 4.500 4.371 4.295 4.500 0.000 10 0 "[ . 1 . 2]" 1
500 1 7 ARG H 1 7 ARG HA 2.600 . 3.400 2.931 2.909 2.945 . 0 0 "[ . 1 . 2]" 1
501 1 7 ARG H 1 8 HIS HA 3.100 . 6.000 4.901 4.702 5.193 . 0 0 "[ . 1 . 2]" 1
502 1 7 ARG H 1 7 ARG QD 3.800 . 5.600 4.905 4.563 5.192 . 0 0 "[ . 1 . 2]" 1
503 1 7 ARG H 1 7 ARG HB2 2.600 . 3.400 3.075 2.705 3.385 . 0 0 "[ . 1 . 2]" 1
504 1 6 VAL QG 1 7 ARG H 3.800 . 4.100 2.890 2.416 3.600 . 0 0 "[ . 1 . 2]" 1
505 1 6 VAL HB 1 7 ARG H 3.500 . 5.000 4.038 3.014 4.489 . 0 0 "[ . 1 . 2]" 1
506 1 22 THR H 1 23 PHE HB3 3.800 . 5.600 4.998 4.824 5.096 . 0 0 "[ . 1 . 2]" 1
507 1 18 THR MG 1 22 THR H 3.900 . 5.800 4.758 3.497 5.210 . 0 0 "[ . 1 . 2]" 1
508 1 22 THR H 1 24 LEU H 3.200 . 4.500 4.241 4.042 4.420 . 0 0 "[ . 1 . 2]" 1
509 1 21 LYS H 1 22 THR H 2.900 . 4.000 2.846 2.732 2.914 . 0 0 "[ . 1 . 2]" 1
510 1 22 THR H 1 22 THR HB 2.700 . 3.600 2.588 2.514 2.683 . 0 0 "[ . 1 . 2]" 1
511 1 22 THR H 1 23 PHE HB2 3.900 . 5.800 4.964 4.735 5.098 . 0 0 "[ . 1 . 2]" 1
512 1 21 LYS HB3 1 22 THR H 2.600 . 3.500 2.477 2.177 3.229 . 0 0 "[ . 1 . 2]" 1
513 1 21 LYS HD2 1 22 THR H 4.000 . 6.000 4.893 3.930 5.488 . 0 0 "[ . 1 . 2]" 1
514 1 21 LYS HG3 1 22 THR H 3.100 . 4.300 3.309 2.180 4.323 0.023 8 0 "[ . 1 . 2]" 1
515 1 22 THR H 1 22 THR MG 3.800 . 5.600 3.750 3.733 3.769 . 0 0 "[ . 1 . 2]" 1
516 1 22 THR H 1 148 ILE MD 3.600 . 5.200 4.039 3.684 4.440 . 0 0 "[ . 1 . 2]" 1
517 1 72 ASP H 1 73 GLU H 3.100 . 4.300 3.496 3.273 3.959 . 0 0 "[ . 1 . 2]" 1
518 1 73 GLU H 1 76 THR H 3.300 . 6.000 5.044 4.930 5.167 . 0 0 "[ . 1 . 2]" 1
519 1 20 PHE QE 1 73 GLU H 3.300 . 4.600 4.338 4.068 4.590 . 0 0 "[ . 1 . 2]" 1
520 1 71 VAL HA 1 73 GLU H 3.300 . 4.700 4.476 4.073 4.935 0.235 3 0 "[ . 1 . 2]" 1
521 1 73 GLU H 1 73 GLU HA 2.900 . 3.900 2.286 2.262 2.590 . 0 0 "[ . 1 . 2]" 1
522 1 71 VAL QG 1 73 GLU H 2.400 . 4.300 2.897 2.298 4.095 . 0 0 "[ . 1 . 2]" 1
523 1 133 MET H 1 133 MET HA 3.000 . 4.100 2.869 2.813 2.897 . 0 0 "[ . 1 . 2]" 1
524 1 132 GLY QA 1 133 MET H 3.100 . 4.300 2.743 2.148 2.941 . 0 0 "[ . 1 . 2]" 1
525 1 132 GLY H 1 133 MET H 3.000 . 4.100 2.167 1.766 3.427 0.134 6 0 "[ . 1 . 2]" 1
526 1 133 MET H 1 134 ASP QB 4.100 . 6.000 4.244 3.849 4.464 . 0 0 "[ . 1 . 2]" 1
527 1 96 GLU H 1 97 PHE QE 3.500 . 6.000 5.941 4.766 6.150 0.150 2 0 "[ . 1 . 2]" 1
528 1 96 GLU H 1 96 GLU HA 3.000 . 4.100 2.759 2.251 2.939 . 0 0 "[ . 1 . 2]" 1
529 1 95 SER HA 1 96 GLU H 2.900 . 4.000 2.848 2.191 3.562 . 0 0 "[ . 1 . 2]" 1
530 1 95 SER HB2 1 96 GLU H 3.400 . 4.800 3.944 1.843 4.634 0.157 4 0 "[ . 1 . 2]" 1
531 1 96 GLU H 1 118 PHE QB 3.800 . 5.600 4.321 3.603 5.363 . 0 0 "[ . 1 . 2]" 1
532 1 96 GLU H 1 96 GLU QB 3.100 . 4.300 2.397 2.071 3.030 . 0 0 "[ . 1 . 2]" 1
533 1 78 VAL QG 1 96 GLU H 3.800 . 6.000 5.676 5.040 5.950 . 0 0 "[ . 1 . 2]" 1
534 1 70 LYS H 1 78 VAL H 2.900 . 3.900 3.122 2.883 3.406 . 0 0 "[ . 1 . 2]" 1
535 1 78 VAL H 1 78 VAL HA 2.800 . 3.800 2.941 2.919 2.952 . 0 0 "[ . 1 . 2]" 1
536 1 71 VAL HA 1 78 VAL H 3.300 . 4.700 4.020 3.601 4.304 . 0 0 "[ . 1 . 2]" 1
537 1 70 LYS HG2 1 78 VAL H 2.800 . 3.800 3.291 2.897 3.652 . 0 0 "[ . 1 . 2]" 1
538 1 78 VAL H 1 78 VAL QG 3.000 . 4.100 2.414 1.893 2.597 0.007 4 0 "[ . 1 . 2]" 1
539 1 10 VAL H 1 11 THR H 3.500 . 5.100 4.385 4.225 4.478 . 0 0 "[ . 1 . 2]" 1
540 1 11 THR H 1 12 VAL HA 3.200 . 6.000 4.979 4.680 5.115 . 0 0 "[ . 1 . 2]" 1
541 1 11 THR H 1 145 GLN HB3 3.500 . 5.000 4.209 3.746 4.735 . 0 0 "[ . 1 . 2]" 1
542 1 10 VAL HB 1 11 THR H 3.600 . 5.200 3.862 2.488 4.409 . 0 0 "[ . 1 . 2]" 1
543 1 10 VAL QG 1 11 THR H 3.300 . 3.900 2.750 2.414 3.381 . 0 0 "[ . 1 . 2]" 1
544 1 129 VAL H 1 130 ARG H 2.800 . 3.800 2.530 2.384 2.826 . 0 0 "[ . 1 . 2]" 1
545 1 128 ARG H 1 129 VAL H 2.800 . 3.800 2.595 2.483 2.729 . 0 0 "[ . 1 . 2]" 1
546 1 128 ARG HD3 1 129 VAL H 4.000 . 6.000 4.681 4.159 5.025 . 0 0 "[ . 1 . 2]" 1
547 1 128 ARG QB 1 129 VAL H 3.500 . 5.100 3.521 3.263 3.659 . 0 0 "[ . 1 . 2]" 1
548 1 129 VAL H 1 129 VAL QG . . 3.600 2.170 1.793 2.487 0.207 19 0 "[ . 1 . 2]" 1
549 1 126 ALA H 1 129 VAL H 3.300 . 6.000 4.925 4.755 5.165 . 0 0 "[ . 1 . 2]" 1
550 1 127 LYS H 1 129 VAL H 3.300 . 4.600 4.126 3.868 4.581 . 0 0 "[ . 1 . 2]" 1
551 1 129 VAL H 1 129 VAL HB 2.800 . 3.800 2.536 2.303 2.972 . 0 0 "[ . 1 . 2]" 1
552 1 128 ARG HB2 1 129 VAL H 3.400 . 4.900 3.913 3.650 4.091 . 0 0 "[ . 1 . 2]" 1
553 1 89 ILE MD 1 129 VAL H 3.800 . 5.600 4.928 3.244 5.913 0.313 4 0 "[ . 1 . 2]" 1
554 1 134 ASP H 1 136 GLY H 3.500 . 5.000 4.011 3.753 4.309 . 0 0 "[ . 1 . 2]" 1
555 1 134 ASP H 1 135 LYS H 3.000 . 4.100 2.714 2.452 2.943 . 0 0 "[ . 1 . 2]" 1
556 1 131 ASN HA 1 134 ASP H 2.400 . 6.000 5.365 4.558 6.105 0.105 4 0 "[ . 1 . 2]" 1
557 1 134 ASP H 1 135 LYS HA 3.900 . 5.800 5.304 5.056 5.440 . 0 0 "[ . 1 . 2]" 1
558 1 132 GLY QA 1 134 ASP H 3.400 . 4.900 3.756 3.295 4.110 . 0 0 "[ . 1 . 2]" 1
559 1 134 ASP H 1 134 ASP QB 3.100 . 4.300 2.292 2.193 2.602 . 0 0 "[ . 1 . 2]" 1
560 1 133 MET HB2 1 134 ASP H 3.400 . 4.800 3.947 2.905 4.317 . 0 0 "[ . 1 . 2]" 1
561 1 134 ASP H 1 135 LYS HB2 3.900 . 5.800 5.200 4.465 6.416 0.616 1 1 "[+ . 1 . 2]" 1
562 1 129 VAL QG 1 134 ASP H 2.400 . 6.000 4.685 3.380 5.326 . 0 0 "[ . 1 . 2]" 1
563 1 133 MET HA 1 134 ASP H 3.100 . 4.300 3.426 3.315 3.546 . 0 0 "[ . 1 . 2]" 1
564 1 131 ASN H 1 132 GLY H 3.000 . 4.100 2.817 2.604 2.962 . 0 0 "[ . 1 . 2]" 1
565 1 131 ASN H 1 132 GLY QA 4.000 . 6.000 4.696 4.439 4.829 . 0 0 "[ . 1 . 2]" 1
566 1 131 ASN H 1 131 ASN QB 3.100 . 4.300 2.354 2.122 2.662 . 0 0 "[ . 1 . 2]" 1
567 1 130 ARG HG2 1 131 ASN H 3.300 . 4.600 4.393 2.489 5.197 0.597 10 2 "[ . + . -2]" 1
568 1 129 VAL QG 1 131 ASN H 2.400 . 5.000 4.233 3.893 4.652 . 0 0 "[ . 1 . 2]" 1
569 1 130 ARG HB2 1 131 ASN H 3.500 . 5.100 4.037 3.190 4.290 . 0 0 "[ . 1 . 2]" 1
570 1 130 ARG H 1 131 ASN H 2.900 . 4.000 2.676 2.539 2.846 . 0 0 "[ . 1 . 2]" 1
571 1 128 ARG H 1 131 ASN H 2.400 . 6.000 5.083 4.583 5.553 . 0 0 "[ . 1 . 2]" 1
572 1 130 ARG HA 1 131 ASN H 3.100 . 4.300 3.410 3.306 3.533 . 0 0 "[ . 1 . 2]" 1
573 1 131 ASN H 1 131 ASN HD21 3.400 . 4.800 3.974 2.281 4.857 0.057 14 0 "[ . 1 . 2]" 1
574 1 144 PHE H 1 145 GLN H 2.800 . 3.800 2.778 2.645 2.860 . 0 0 "[ . 1 . 2]" 1
575 1 142 GLN HA 1 145 GLN H 3.000 . 4.100 3.647 3.491 3.790 . 0 0 "[ . 1 . 2]" 1
576 1 144 PHE HB3 1 145 GLN H 3.600 . 5.200 2.314 2.192 2.436 . 0 0 "[ . 1 . 2]" 1
577 1 145 GLN H 1 145 GLN HB3 2.700 . 3.600 2.406 1.972 3.122 . 0 0 "[ . 1 . 2]" 1
578 1 145 GLN H 1 148 ILE HB 3.700 . 5.400 5.005 4.659 5.201 . 0 0 "[ . 1 . 2]" 1
579 1 10 VAL QG 1 145 GLN H 3.700 . 5.400 3.798 3.325 4.149 . 0 0 "[ . 1 . 2]" 1
580 1 12 VAL QG 1 145 GLN H 3.700 . 5.400 5.099 4.400 5.321 . 0 0 "[ . 1 . 2]" 1
581 1 143 SER HB2 1 145 GLN H 3.700 . 6.000 5.628 5.462 6.079 0.079 18 0 "[ . 1 . 2]" 1
582 1 68 ILE H 1 69 ARG H 3.500 . 5.100 4.462 4.344 4.569 . 0 0 "[ . 1 . 2]" 1
583 1 52 ARG HA 1 68 ILE H 2.800 . 3.800 2.666 1.841 2.891 . 0 0 "[ . 1 . 2]" 1
584 1 51 GLY HA2 1 68 ILE H 3.500 . 5.100 4.756 4.227 5.524 0.424 6 0 "[ . 1 . 2]" 1
585 1 51 GLY HA3 1 68 ILE H 3.900 . 5.800 4.371 3.949 5.093 . 0 0 "[ . 1 . 2]" 1
586 1 67 LEU HG 1 68 ILE H 3.500 . 5.000 4.832 4.699 4.970 . 0 0 "[ . 1 . 2]" 1
587 1 68 ILE H 1 68 ILE HG13 2.300 . 3.000 2.269 2.086 2.472 . 0 0 "[ . 1 . 2]" 1
588 1 68 ILE H 1 68 ILE MD 3.600 . 5.200 3.171 3.062 3.269 . 0 0 "[ . 1 . 2]" 1
589 1 72 ASP HB3 1 75 ASP H 3.700 . 5.500 4.688 4.140 5.452 . 0 0 "[ . 1 . 2]" 1
590 1 16 ARG HB3 1 75 ASP H 4.000 . 6.000 6.117 6.064 6.198 0.198 19 0 "[ . 1 . 2]" 1
591 1 75 ASP H 1 101 PHE H 3.600 . 5.200 5.117 4.934 5.223 0.023 8 0 "[ . 1 . 2]" 1
592 1 75 ASP H 1 76 THR H 2.800 . 3.800 2.496 2.358 2.586 . 0 0 "[ . 1 . 2]" 1
593 1 20 PHE QE 1 75 ASP H 3.500 . 6.000 4.686 4.504 4.971 . 0 0 "[ . 1 . 2]" 1
594 1 20 PHE QD 1 75 ASP H 3.200 . 4.500 3.569 3.293 3.761 . 0 0 "[ . 1 . 2]" 1
595 1 75 ASP H 1 76 THR HA 3.200 . 4.500 4.242 4.141 4.356 . 0 0 "[ . 1 . 2]" 1
596 1 75 ASP H 1 101 PHE HB2 3.000 . 4.100 3.979 3.662 4.127 0.027 2 0 "[ . 1 . 2]" 1
597 1 74 PRO HD2 1 75 ASP H 2.400 . 6.000 4.870 4.768 5.081 . 0 0 "[ . 1 . 2]" 1
598 1 72 ASP HB2 1 75 ASP H 4.000 . 6.000 5.899 4.615 6.094 0.094 8 0 "[ . 1 . 2]" 1
599 1 74 PRO HB2 1 75 ASP H 3.600 . 5.200 4.331 4.313 4.375 . 0 0 "[ . 1 . 2]" 1
600 1 73 GLU QG 1 75 ASP H 3.200 . 4.500 3.572 3.194 4.666 0.166 3 0 "[ . 1 . 2]" 1
601 1 75 ASP H 1 76 THR MG 3.600 . 5.300 4.896 4.830 5.025 . 0 0 "[ . 1 . 2]" 1
602 1 75 ASP H 1 77 LEU QD 3.100 . 4.300 3.371 2.955 3.571 . 0 0 "[ . 1 . 2]" 1
603 1 131 ASN H 1 131 ASN QB 3.300 . 4.600 2.295 2.093 2.550 . 0 0 "[ . 1 . 2]" 1
604 1 33 ASN HA 1 34 ASN H 3.200 . 4.400 3.384 3.206 3.532 . 0 0 "[ . 1 . 2]" 1
605 1 34 ASN H 1 140 ILE QG 3.000 . 4.100 3.520 2.966 4.008 . 0 0 "[ . 1 . 2]" 1
606 1 32 PRO HG2 1 34 ASN H 3.800 . 5.600 2.870 2.207 4.422 . 0 0 "[ . 1 . 2]" 1
607 1 34 ASN H 1 34 ASN HD22 3.700 . 5.400 4.295 3.346 5.054 . 0 0 "[ . 1 . 2]" 1
608 1 34 ASN H 1 34 ASN QB 3.000 . 4.100 2.607 2.365 2.956 . 0 0 "[ . 1 . 2]" 1
609 1 115 HIS HB3 1 117 HIS H 2.400 . 6.000 6.059 5.364 6.313 0.313 17 0 "[ . 1 . 2]" 1
610 1 116 THR HB 1 117 HIS H 3.400 . 4.900 4.012 2.457 4.496 . 0 0 "[ . 1 . 2]" 1
611 1 117 HIS H 1 118 PHE QB 3.900 . 5.800 4.450 3.887 5.291 . 0 0 "[ . 1 . 2]" 1
612 1 116 THR MG 1 117 HIS H 3.400 . 4.900 3.622 2.294 4.456 . 0 0 "[ . 1 . 2]" 1
613 1 57 ASP H 1 58 GLU H 3.400 . 4.900 4.501 4.364 4.612 . 0 0 "[ . 1 . 2]" 1
614 1 58 GLU H 1 60 GLY H 3.600 . 5.200 4.090 3.739 4.437 . 0 0 "[ . 1 . 2]" 1
615 1 58 GLU H 1 58 GLU HA 3.000 . 4.200 2.846 2.787 2.897 . 0 0 "[ . 1 . 2]" 1
616 1 57 ASP QB 1 58 GLU H 3.300 . 3.800 2.865 1.790 3.478 0.110 3 0 "[ . 1 . 2]" 1
617 1 58 GLU H 1 58 GLU QB 3.200 . 4.500 2.634 2.509 2.756 . 0 0 "[ . 1 . 2]" 1
618 1 47 ASP HB2 1 54 TYR H 3.600 . 5.200 4.806 4.290 5.245 0.045 20 0 "[ . 1 . 2]" 1
619 1 53 TRP HB2 1 54 TYR H 3.400 . 4.900 4.309 3.106 4.453 . 0 0 "[ . 1 . 2]" 1
620 1 54 TYR H 1 55 GLU HG2 3.200 . 6.000 5.757 4.794 6.423 0.423 1 0 "[ . 1 . 2]" 1
621 1 46 VAL H 1 54 TYR H 3.500 . 5.000 4.264 3.936 4.556 . 0 0 "[ . 1 . 2]" 1
622 1 54 TYR H 1 54 TYR QE 3.900 . 5.800 4.364 4.179 4.603 . 0 0 "[ . 1 . 2]" 1
623 1 54 TYR H 1 54 TYR QD 2.800 . 3.800 2.459 2.233 2.740 . 0 0 "[ . 1 . 2]" 1
624 1 54 TYR H 1 54 TYR HA 2.800 . 3.800 2.855 2.829 2.884 . 0 0 "[ . 1 . 2]" 1
625 1 54 TYR H 1 54 TYR QB 3.300 . 4.700 3.220 3.144 3.294 . 0 0 "[ . 1 . 2]" 1
626 1 53 TRP HB3 1 54 TYR H 3.700 . 5.400 3.608 3.413 3.723 . 0 0 "[ . 1 . 2]" 1
627 1 46 VAL MG1 1 54 TYR H 4.100 . 6.000 4.569 4.267 4.961 . 0 0 "[ . 1 . 2]" 1
628 1 44 LEU QD 1 54 TYR H 3.500 . 5.000 3.800 3.435 4.278 . 0 0 "[ . 1 . 2]" 1
629 1 57 ASP H 1 61 GLU H 3.000 . 4.100 3.488 2.722 4.197 0.097 11 0 "[ . 1 . 2]" 1
630 1 56 ILE HA 1 61 GLU H 3.800 . 5.600 4.410 2.922 4.994 . 0 0 "[ . 1 . 2]" 1
631 1 59 GLN HA 1 61 GLU H 2.400 . 6.000 5.728 5.242 6.122 0.122 16 0 "[ . 1 . 2]" 1
632 1 60 GLY HA2 1 61 GLU H 3.100 . 4.300 2.932 2.347 3.513 . 0 0 "[ . 1 . 2]" 1
633 1 60 GLY HA3 1 61 GLU H 3.400 . 4.800 3.009 2.125 3.571 . 0 0 "[ . 1 . 2]" 1
634 1 57 ASP QB 1 61 GLU H 3.200 . 4.500 3.685 2.419 4.387 . 0 0 "[ . 1 . 2]" 1
635 1 59 GLN HG2 1 61 GLU H 3.400 . 6.000 4.779 3.295 6.654 0.654 7 1 "[ . + 1 . 2]" 1
636 1 61 GLU H 1 61 GLU QB 3.200 . 4.500 2.644 2.450 3.009 . 0 0 "[ . 1 . 2]" 1
637 1 61 GLU H 1 62 GLU QB 3.600 . 6.000 4.152 3.005 5.076 . 0 0 "[ . 1 . 2]" 1
638 1 56 ILE MG 1 61 GLU H 3.300 . 4.700 3.979 2.813 4.829 0.129 12 0 "[ . 1 . 2]" 1
639 1 57 ASP HA 1 59 GLN H 3.600 . 5.200 4.470 3.764 4.920 . 0 0 "[ . 1 . 2]" 1
640 1 58 GLU HA 1 59 GLN H 3.000 . 4.100 3.491 3.354 3.573 . 0 0 "[ . 1 . 2]" 1
641 1 57 ASP QB 1 59 GLN H 3.800 . 3.800 3.034 2.295 3.391 . 0 0 "[ . 1 . 2]" 1
642 1 59 GLN H 1 59 GLN HB2 3.700 . 5.400 3.627 3.183 3.754 . 0 0 "[ . 1 . 2]" 1
643 1 56 ILE MG 1 59 GLN H 3.600 . 6.000 5.759 5.278 6.078 0.078 2 0 "[ . 1 . 2]" 1
644 1 9 SER H 1 112 ASP HA 3.400 . 4.900 4.915 4.647 5.059 0.159 11 0 "[ . 1 . 2]" 1
645 1 8 HIS HB3 1 9 SER H 3.700 . 5.400 4.395 4.289 4.449 . 0 0 "[ . 1 . 2]" 1
646 1 82 ARG H 1 92 ASP H 2.400 . 6.000 5.860 5.057 6.191 0.191 4 0 "[ . 1 . 2]" 1
647 1 90 ASP QB 1 92 ASP H 3.000 . 4.100 3.202 2.598 3.909 . 0 0 "[ . 1 . 2]" 1
648 1 9 SER H 1 10 VAL QG 3.400 . 4.800 3.615 3.106 3.958 . 0 0 "[ . 1 . 2]" 1
649 1 8 HIS HA 1 9 SER H 2.900 . 3.900 2.155 2.104 2.228 . 0 0 "[ . 1 . 2]" 1
650 1 8 HIS HB2 1 9 SER H 3.600 . 5.200 3.794 3.417 4.174 . 0 0 "[ . 1 . 2]" 1
651 1 9 SER H 1 113 VAL HB 4.100 . 6.000 5.140 4.894 5.375 . 0 0 "[ . 1 . 2]" 1
652 1 91 PRO HD3 1 92 ASP H 3.700 . 5.400 3.910 3.400 4.403 . 0 0 "[ . 1 . 2]" 1
653 1 81 TRP HB3 1 92 ASP H 3.800 . 5.600 4.905 2.811 5.596 . 0 0 "[ . 1 . 2]" 1
654 1 89 ILE MD 1 92 ASP H 2.400 . 6.000 5.164 4.621 5.803 . 0 0 "[ . 1 . 2]" 1
655 1 92 ASP H 1 94 SER H 3.800 . 5.600 4.704 3.794 5.529 . 0 0 "[ . 1 . 2]" 1
656 1 92 ASP H 1 93 ASN QB 3.700 . 5.400 5.047 4.376 5.396 . 0 0 "[ . 1 . 2]" 1
657 1 92 ASP H 1 93 ASN HA 3.800 . 5.600 5.352 4.617 5.765 0.165 18 0 "[ . 1 . 2]" 1
658 1 104 ASP H 1 110 ARG H 3.900 . 5.800 4.431 3.706 5.219 . 0 0 "[ . 1 . 2]" 1
659 1 104 ASP H 1 105 GLY H 3.500 . 5.000 4.110 3.785 4.378 . 0 0 "[ . 1 . 2]" 1
660 1 104 ASP H 1 108 LYS H 3.000 . 4.100 3.611 3.248 3.824 . 0 0 "[ . 1 . 2]" 1
661 1 104 ASP H 1 108 LYS HA 3.500 . 6.000 4.907 4.710 5.369 . 0 0 "[ . 1 . 2]" 1
662 1 104 ASP H 1 105 GLY QA 3.600 . 5.200 4.779 4.430 4.906 . 0 0 "[ . 1 . 2]" 1
663 1 104 ASP H 1 109 THR MG 4.000 . 6.000 4.083 3.683 4.418 . 0 0 "[ . 1 . 2]" 1
664 1 104 ASP H 1 109 THR HB 3.700 . 5.400 4.849 4.594 5.190 . 0 0 "[ . 1 . 2]" 1
665 1 16 ARG HD3 1 104 ASP H 3.900 . 5.800 5.381 5.023 5.597 . 0 0 "[ . 1 . 2]" 1
666 1 62 GLU H 1 62 GLU HG3 3.800 . 5.600 4.393 2.933 4.976 . 0 0 "[ . 1 . 2]" 1
667 1 62 GLU H 1 62 GLU QB 3.100 . 3.800 2.455 2.230 2.799 . 0 0 "[ . 1 . 2]" 1
668 1 57 ASP H 1 62 GLU H 2.900 . 3.900 3.373 3.041 3.932 0.032 8 0 "[ . 1 . 2]" 1
669 1 59 GLN QE 1 62 GLU H 2.600 . 3.500 2.637 1.684 3.571 0.071 16 0 "[ . 1 . 2]" 1
670 1 56 ILE HA 1 62 GLU H 3.900 . 5.800 4.946 4.433 5.368 . 0 0 "[ . 1 . 2]" 1
671 1 62 GLU H 1 62 GLU HA 2.900 . 4.000 2.927 2.888 2.953 . 0 0 "[ . 1 . 2]" 1
672 1 62 GLU H 1 63 HIS QB 3.200 . 4.500 4.453 4.307 4.603 0.103 12 0 "[ . 1 . 2]" 1
673 1 61 GLU QB 1 62 GLU H 3.500 . 5.000 3.800 3.529 3.907 . 0 0 "[ . 1 . 2]" 1
674 1 57 ASP QB 1 62 GLU H 2.900 . 3.900 2.561 1.636 3.655 0.264 20 0 "[ . 1 . 2]" 1
675 1 59 GLN HG3 1 62 GLU H 3.700 . 5.400 5.175 4.140 5.927 0.527 8 1 "[ . + 1 . 2]" 1
676 1 49 LYS H 1 51 GLY HA2 3.900 . 5.800 5.205 4.858 5.480 . 0 0 "[ . 1 . 2]" 1
677 1 49 LYS H 1 49 LYS HE2 4.000 . 6.000 4.848 3.587 6.130 0.130 10 0 "[ . 1 . 2]" 1
678 1 49 LYS H 1 49 LYS HB2 3.700 . 5.400 3.370 2.724 3.666 . 0 0 "[ . 1 . 2]" 1
679 1 59 GLN QG 1 62 GLU H 3.700 . 5.400 4.024 3.189 4.823 . 0 0 "[ . 1 . 2]" 1
680 1 47 ASP HA 1 49 LYS H 3.400 . 4.800 3.633 3.258 3.922 . 0 0 "[ . 1 . 2]" 1
681 1 49 LYS H 1 51 GLY H 3.700 . 5.400 3.677 3.283 4.149 . 0 0 "[ . 1 . 2]" 1
682 1 49 LYS H 1 50 GLY HA3 4.100 . 6.000 4.890 4.642 5.089 . 0 0 "[ . 1 . 2]" 1
683 1 15 ASP HA 1 16 ARG H 2.700 . 3.600 2.419 2.325 2.519 . 0 0 "[ . 1 . 2]" 1
684 1 16 ARG H 1 16 ARG HA 2.800 . 3.800 2.820 2.799 2.853 . 0 0 "[ . 1 . 2]" 1
685 1 16 ARG H 1 16 ARG QB 2.700 . 3.600 2.164 2.100 2.228 . 0 0 "[ . 1 . 2]" 1
686 1 16 ARG H 1 16 ARG HG2 3.600 . 5.200 4.543 4.457 4.595 . 0 0 "[ . 1 . 2]" 1
687 1 93 ASN H 1 93 ASN HD22 3.800 . 5.600 4.079 3.303 5.053 . 0 0 "[ . 1 . 2]" 1
688 1 92 ASP HA 1 93 ASN H 3.100 . 4.300 2.980 2.234 3.516 . 0 0 "[ . 1 . 2]" 1
689 1 93 ASN H 1 94 SER QB 3.800 . 5.600 4.652 3.573 5.351 . 0 0 "[ . 1 . 2]" 1
690 1 93 ASN H 1 118 PHE QB 3.600 . 6.000 5.624 5.076 5.843 . 0 0 "[ . 1 . 2]" 1
691 1 93 ASN H 1 93 ASN QB 3.200 . 4.500 2.774 2.073 3.397 . 0 0 "[ . 1 . 2]" 1
692 1 92 ASP QB 1 93 ASN H 3.300 . 4.700 3.420 1.660 4.055 0.240 9 0 "[ . 1 . 2]" 1
693 1 91 PRO HG2 1 93 ASN H 3.100 . 6.000 4.987 3.008 6.124 0.124 9 0 "[ . 1 . 2]" 1
694 1 135 LYS H 1 136 GLY H 2.900 . 3.900 2.348 1.977 2.763 . 0 0 "[ . 1 . 2]" 1
695 1 135 LYS HB3 1 136 GLY H 3.500 . 5.000 3.783 2.508 4.530 . 0 0 "[ . 1 . 2]" 1
696 1 133 MET HA 1 136 GLY H 3.000 . 4.100 3.513 2.883 4.066 . 0 0 "[ . 1 . 2]" 1
697 1 134 ASP QB 1 136 GLY H 2.400 . 6.000 4.686 4.360 5.451 . 0 0 "[ . 1 . 2]" 1
698 1 135 LYS HB2 1 136 GLY H 3.400 . 4.800 3.973 2.578 4.521 . 0 0 "[ . 1 . 2]" 1
699 1 45 GLY H 1 54 TYR QD 3.700 . 5.400 5.241 4.913 5.395 . 0 0 "[ . 1 . 2]" 1
700 1 28 PRO QD 1 45 GLY H 3.400 . 4.800 4.699 4.499 4.787 . 0 0 "[ . 1 . 2]" 1
701 1 45 GLY H 1 55 GLU HB3 3.100 . 6.000 3.845 2.993 4.814 . 0 0 "[ . 1 . 2]" 1
702 1 42 ALA MB 1 45 GLY H 3.800 . 5.600 4.204 3.726 5.449 . 0 0 "[ . 1 . 2]" 1
703 1 44 LEU QB 1 45 GLY H 2.500 . 3.300 1.935 1.812 2.378 . 0 0 "[ . 1 . 2]" 1
704 1 44 LEU QD 1 45 GLY H 3.900 . 5.800 2.875 2.628 3.004 . 0 0 "[ . 1 . 2]" 1
705 1 44 LEU HG 1 45 GLY H 2.100 . 2.700 2.154 1.377 2.400 0.123 12 0 "[ . 1 . 2]" 1
706 1 44 LEU H 1 45 GLY H 3.000 . 4.100 3.236 2.868 4.209 0.109 3 0 "[ . 1 . 2]" 1
707 1 45 GLY H 1 54 TYR HA 3.300 . 6.000 5.045 4.441 5.265 . 0 0 "[ . 1 . 2]" 1
708 1 45 GLY H 1 55 GLU HG2 3.000 . 4.100 3.608 2.254 4.234 0.134 13 0 "[ . 1 . 2]" 1
709 1 15 ASP H 1 108 LYS HA 2.700 . 3.600 2.891 2.398 3.298 . 0 0 "[ . 1 . 2]" 1
710 1 15 ASP H 1 108 LYS HB3 3.700 . 5.500 5.460 5.164 5.591 0.091 11 0 "[ . 1 . 2]" 1
711 1 14 ALA H 1 15 ASP H 2.400 . 3.100 2.142 1.848 2.375 . 0 0 "[ . 1 . 2]" 1
712 1 15 ASP H 1 15 ASP HB3 3.300 . 4.700 3.628 3.500 3.862 . 0 0 "[ . 1 . 2]" 1
713 1 15 ASP H 1 15 ASP HB2 3.200 . 4.500 3.261 3.187 3.316 . 0 0 "[ . 1 . 2]" 1
714 1 15 ASP H 1 18 THR MG 3.700 . 5.400 5.212 5.028 5.538 0.138 9 0 "[ . 1 . 2]" 1
715 1 12 VAL QG 1 15 ASP H 3.200 . 4.500 2.688 2.414 2.958 . 0 0 "[ . 1 . 2]" 1
716 1 15 ASP H 1 148 ILE MG 3.900 . 5.800 4.574 4.027 4.808 . 0 0 "[ . 1 . 2]" 1
717 1 76 THR H 1 100 THR HA 4.100 . 6.000 5.509 5.354 5.733 . 0 0 "[ . 1 . 2]" 1
718 1 71 VAL HA 1 76 THR H 3.800 . 6.000 5.843 5.535 6.065 0.065 3 0 "[ . 1 . 2]" 1
719 1 76 THR H 1 77 LEU QD 3.100 . 4.300 3.424 2.876 3.548 . 0 0 "[ . 1 . 2]" 1
720 1 20 PHE QE 1 76 THR H 3.300 . 6.000 5.454 5.053 5.684 . 0 0 "[ . 1 . 2]" 1
721 1 75 ASP HA 1 76 THR H 3.300 . 4.700 3.591 3.578 3.611 . 0 0 "[ . 1 . 2]" 1
722 1 75 ASP HB3 1 76 THR H 2.700 . 3.600 2.159 2.007 2.226 . 0 0 "[ . 1 . 2]" 1
723 1 16 ARG H 1 109 THR HB 3.100 . 4.300 4.216 3.709 4.335 0.035 17 0 "[ . 1 . 2]" 1
724 1 16 ARG H 1 16 ARG HD2 4.200 . 6.000 5.779 5.698 5.898 . 0 0 "[ . 1 . 2]" 1
725 1 15 ASP HB2 1 16 ARG H 3.300 . 4.600 3.651 3.552 3.746 . 0 0 "[ . 1 . 2]" 1
726 1 16 ARG H 1 74 PRO HB2 4.000 . 6.000 5.966 5.627 6.378 0.378 3 0 "[ . 1 . 2]" 1
727 1 16 ARG H 1 108 LYS H 3.700 . 5.400 5.316 4.780 5.484 0.084 19 0 "[ . 1 . 2]" 1
728 1 33 ASN QD 1 39 LYS QD 3.500 . 4.100 3.346 2.156 3.836 . 0 0 "[ . 1 . 2]" 1
729 1 33 ASN QD 1 84 ASN HB3 3.800 . 4.700 3.844 2.097 4.540 . 0 0 "[ . 1 . 2]" 1
730 1 33 ASN QD 1 40 VAL HB 3.400 . 4.800 3.916 3.103 4.548 . 0 0 "[ . 1 . 2]" 1
731 1 33 ASN HB3 1 33 ASN QD 2.600 . 3.400 2.349 2.122 3.327 . 0 0 "[ . 1 . 2]" 1
732 1 33 ASN QD 1 136 GLY QA 3.900 . 5.200 3.945 3.150 4.370 . 0 0 "[ . 1 . 2]" 1
733 1 33 ASN QD 1 40 VAL QG 3.200 . 4.200 1.825 1.489 2.351 0.411 15 0 "[ . 1 . 2]" 1
734 1 125 HIS H 1 126 ALA H 2.900 . 4.000 2.718 2.572 2.891 . 0 0 "[ . 1 . 2]" 1
735 1 125 HIS HA 1 126 ALA H 3.100 . 4.300 3.552 3.527 3.572 . 0 0 "[ . 1 . 2]" 1
736 1 122 GLY QA 1 126 ALA H 3.200 . 4.500 3.646 1.686 4.505 0.214 7 0 "[ . 1 . 2]" 1
737 1 121 MET QB 1 126 ALA H 2.400 . 6.000 4.978 4.086 5.947 . 0 0 "[ . 1 . 2]" 1
738 1 126 ALA H 1 129 VAL QG 3.600 . 5.200 4.593 4.088 4.980 . 0 0 "[ . 1 . 2]" 1
739 1 122 GLY H 1 126 ALA H 3.200 . 4.400 4.052 3.650 4.439 0.039 4 0 "[ . 1 . 2]" 1
740 1 125 HIS QB 1 126 ALA H 2.900 . 3.900 2.410 2.306 2.553 . 0 0 "[ . 1 . 2]" 1
741 1 126 ALA H 1 128 ARG HG2 3.900 . 5.800 4.560 4.274 4.910 . 0 0 "[ . 1 . 2]" 1
742 1 23 PHE QD 1 24 LEU H 3.300 . 4.700 3.842 3.562 4.039 . 0 0 "[ . 1 . 2]" 1
743 1 23 PHE HB3 1 24 LEU H 2.700 . 3.600 2.812 2.644 3.008 . 0 0 "[ . 1 . 2]" 1
744 1 23 PHE HB2 1 24 LEU H 3.700 . 5.400 3.986 3.904 4.082 . 0 0 "[ . 1 . 2]" 1
745 1 24 LEU H 1 25 GLU QB 4.200 . 6.000 3.756 3.407 4.038 . 0 0 "[ . 1 . 2]" 1
746 1 24 LEU H 1 25 GLU QG 3.800 . 5.600 4.088 3.587 4.513 . 0 0 "[ . 1 . 2]" 1
747 1 24 LEU H 1 24 LEU HB2 2.800 . 3.800 2.759 2.657 2.905 . 0 0 "[ . 1 . 2]" 1
748 1 24 LEU H 1 24 LEU HB3 3.000 . 4.100 2.772 2.643 2.902 . 0 0 "[ . 1 . 2]" 1
749 1 24 LEU H 1 77 LEU QD 3.800 . 5.600 4.194 3.938 4.950 . 0 0 "[ . 1 . 2]" 1
750 1 57 ASP QB 1 60 GLY H 3.100 . 4.300 3.479 2.674 4.248 . 0 0 "[ . 1 . 2]" 1
751 1 60 GLY H 1 61 GLU QB 3.800 . 5.600 4.448 3.848 5.055 . 0 0 "[ . 1 . 2]" 1
752 1 59 GLN HA 1 60 GLY H 3.200 . 4.500 3.231 2.975 3.525 . 0 0 "[ . 1 . 2]" 1
753 1 60 GLY H 1 60 GLY HA2 2.900 . 4.000 2.533 2.366 2.668 . 0 0 "[ . 1 . 2]" 1
754 1 59 GLN HB3 1 60 GLY H 3.400 . 4.800 3.480 2.911 4.272 . 0 0 "[ . 1 . 2]" 1
755 1 59 GLN HB2 1 60 GLY H 3.800 . 5.600 4.406 4.081 4.567 . 0 0 "[ . 1 . 2]" 1
756 1 56 ILE MG 1 60 GLY H 3.400 . 4.900 4.469 3.933 4.871 . 0 0 "[ . 1 . 2]" 1
757 1 15 ASP HA 1 17 LYS H 3.600 . 5.200 4.286 4.146 4.540 . 0 0 "[ . 1 . 2]" 1
758 1 15 ASP HB3 1 17 LYS H 2.900 . 4.000 3.248 2.722 3.646 . 0 0 "[ . 1 . 2]" 1
759 1 17 LYS H 1 17 LYS QE 3.800 . 5.600 4.472 3.130 5.764 0.164 3 0 "[ . 1 . 2]" 1
760 1 18 THR H 1 21 LYS HB2 3.700 . 6.000 5.417 4.837 5.988 . 0 0 "[ . 1 . 2]" 1
761 1 17 LYS H 1 17 LYS HD2 3.600 . 5.200 4.474 2.832 5.977 0.777 15 2 "[- . 1 + 2]" 1
762 1 41 GLY H 1 55 GLU HB2 3.400 . 4.900 4.836 3.681 5.244 0.344 14 0 "[ . 1 . 2]" 1
763 1 41 GLY H 1 55 GLU HB3 3.600 . 5.200 4.573 3.932 4.992 . 0 0 "[ . 1 . 2]" 1
764 1 40 VAL HA 1 41 GLY H 3.000 . 4.100 2.984 2.168 3.276 . 0 0 "[ . 1 . 2]" 1
765 1 40 VAL QG 1 41 GLY H 3.400 . 4.900 3.394 2.609 3.780 . 0 0 "[ . 1 . 2]" 1
766 1 152 GLY H 1 153 ALA H 2.900 . 4.000 2.733 2.172 3.017 . 0 0 "[ . 1 . 2]" 1
767 1 149 ASP HA 1 152 GLY H 3.000 . 4.100 3.378 2.999 4.085 . 0 0 "[ . 1 . 2]" 1
768 1 151 GLU HA 1 152 GLY H 3.100 . 4.300 3.405 3.206 3.544 . 0 0 "[ . 1 . 2]" 1
769 1 148 ILE HA 1 152 GLY H 2.400 . 6.000 4.639 3.567 5.612 . 0 0 "[ . 1 . 2]" 1
770 1 151 GLU QG 1 152 GLY H 3.800 . 5.600 4.023 2.786 4.371 . 0 0 "[ . 1 . 2]" 1
771 1 151 GLU HB3 1 152 GLY H 3.600 . 5.200 3.992 2.867 4.456 . 0 0 "[ . 1 . 2]" 1
772 1 131 ASN HA 1 132 GLY H 3.200 . 4.500 3.497 3.420 3.575 . 0 0 "[ . 1 . 2]" 1
773 1 131 ASN QB 1 132 GLY H 3.200 . 4.500 2.933 2.459 3.626 . 0 0 "[ . 1 . 2]" 1
774 1 40 VAL H 1 40 VAL HA 3.000 . 4.100 2.685 2.230 2.917 . 0 0 "[ . 1 . 2]" 1
775 1 40 VAL H 1 40 VAL HB 3.200 . 4.500 3.744 2.945 4.017 . 0 0 "[ . 1 . 2]" 1
776 1 39 LYS QB 1 40 VAL H 2.900 . 3.900 2.712 1.826 4.000 0.100 18 0 "[ . 1 . 2]" 1
777 1 40 VAL H 1 42 ALA MB 3.800 . 5.600 4.917 4.500 5.626 0.026 19 0 "[ . 1 . 2]" 1
778 1 39 LYS HG2 1 40 VAL H 3.500 . 5.000 3.846 1.934 4.907 0.066 19 0 "[ . 1 . 2]" 1
779 1 39 LYS HG3 1 40 VAL H 3.700 . 5.400 4.491 2.549 5.643 0.243 8 0 "[ . 1 . 2]" 1
780 1 40 VAL H 1 40 VAL QG 3.100 . 4.300 2.441 1.848 2.854 0.052 19 0 "[ . 1 . 2]" 1
781 1 40 VAL H 1 41 GLY QA 3.900 . 5.800 4.014 3.485 4.822 . 0 0 "[ . 1 . 2]" 1
782 1 148 ILE HA 1 149 ASP H 3.000 . 4.100 3.500 3.467 3.540 . 0 0 "[ . 1 . 2]" 1
783 1 145 GLN HA 1 149 ASP H 3.300 . 4.600 4.067 3.590 4.376 . 0 0 "[ . 1 . 2]" 1
784 1 148 ILE MG 1 149 ASP H 3.100 . 4.300 3.424 3.062 3.675 . 0 0 "[ . 1 . 2]" 1
785 1 13 LYS HE3 1 149 ASP H 3.500 . 6.000 4.603 3.345 5.463 . 0 0 "[ . 1 . 2]" 1
786 1 148 ILE MD 1 149 ASP H 2.400 . 6.000 4.780 4.585 4.935 . 0 0 "[ . 1 . 2]" 1
787 1 127 LYS H 1 127 LYS QB 2.900 . 4.000 2.250 2.152 2.403 . 0 0 "[ . 1 . 2]" 1
788 1 46 VAL H 1 54 TYR QD 3.800 . 5.600 5.636 5.519 5.707 0.107 20 0 "[ . 1 . 2]" 1
789 1 46 VAL H 1 47 ASP HA 3.200 . 6.000 4.768 4.678 4.923 . 0 0 "[ . 1 . 2]" 1
790 1 46 VAL H 1 46 VAL HA 2.800 . 3.800 2.926 2.918 2.935 . 0 0 "[ . 1 . 2]" 1
791 1 45 GLY QA 1 46 VAL H 2.600 . 3.500 2.515 2.045 2.751 . 0 0 "[ . 1 . 2]" 1
792 1 28 PRO QD 1 46 VAL H 4.000 . 6.000 4.010 3.601 4.691 . 0 0 "[ . 1 . 2]" 1
793 1 46 VAL H 1 46 VAL HB 2.900 . 4.000 2.798 2.712 2.875 . 0 0 "[ . 1 . 2]" 1
794 1 46 VAL H 1 53 TRP HB3 4.600 . 6.000 5.943 4.932 6.160 0.160 9 0 "[ . 1 . 2]" 1
795 1 44 LEU QD 1 46 VAL H 3.100 . 6.000 3.316 2.783 5.099 . 0 0 "[ . 1 . 2]" 1
796 1 66 GLY HA2 1 82 ARG H 2.900 . 6.000 3.981 2.447 4.865 . 0 0 "[ . 1 . 2]" 1
797 1 81 TRP HB2 1 82 ARG H 3.000 . 4.100 3.985 3.669 4.209 0.109 19 0 "[ . 1 . 2]" 1
798 1 82 ARG H 1 90 ASP QB 3.500 . 5.000 4.754 4.508 4.929 . 0 0 "[ . 1 . 2]" 1
799 1 82 ARG H 1 82 ARG QB 3.100 . 3.900 2.718 2.453 3.002 . 0 0 "[ . 1 . 2]" 1
800 1 82 ARG H 1 83 LEU HB3 4.100 . 6.000 5.227 4.576 6.347 0.347 12 0 "[ . 1 . 2]" 1
801 1 82 ARG H 1 82 ARG HA 2.900 . 4.000 2.895 2.758 2.943 . 0 0 "[ . 1 . 2]" 1
802 1 81 TRP HB3 1 82 ARG H 3.400 . 4.800 3.783 3.223 4.192 . 0 0 "[ . 1 . 2]" 1
803 1 148 ILE HB 1 149 ASP H 2.700 . 3.600 2.800 2.572 2.973 . 0 0 "[ . 1 . 2]" 1
804 1 13 LYS QG 1 149 ASP H 3.700 . 5.400 3.936 3.194 4.844 . 0 0 "[ . 1 . 2]" 1
805 1 146 ASP H 1 149 ASP H 3.200 . 6.000 4.448 4.290 4.609 . 0 0 "[ . 1 . 2]" 1
806 1 149 ASP H 1 150 GLU H 2.800 . 3.800 2.594 2.506 2.670 . 0 0 "[ . 1 . 2]" 1
807 1 148 ILE H 1 149 ASP H 2.800 . 3.800 2.578 2.375 2.713 . 0 0 "[ . 1 . 2]" 1
808 1 149 ASP H 1 151 GLU QG 4.100 . 6.000 4.806 4.435 5.509 . 0 0 "[ . 1 . 2]" 1
809 1 149 ASP H 1 150 GLU QB 4.000 . 6.000 3.881 3.705 4.071 . 0 0 "[ . 1 . 2]" 1
810 1 127 LYS H 1 128 ARG H 2.800 . 3.800 2.672 2.544 2.827 . 0 0 "[ . 1 . 2]" 1
811 1 126 ALA HA 1 127 LYS H 3.300 . 4.600 3.507 3.442 3.574 . 0 0 "[ . 1 . 2]" 1
812 1 126 ALA MB 1 127 LYS H 3.100 . 4.300 2.686 2.421 2.893 . 0 0 "[ . 1 . 2]" 1
813 1 150 GLU H 1 151 GLU H 2.700 . 3.600 2.502 2.445 2.575 . 0 0 "[ . 1 . 2]" 1
814 1 148 ILE H 1 151 GLU H 3.500 . 5.000 4.848 4.530 5.063 0.063 13 0 "[ . 1 . 2]" 1
815 1 149 ASP HA 1 151 GLU H 3.100 . 4.300 4.060 3.726 4.344 0.044 3 0 "[ . 1 . 2]" 1
816 1 151 GLU H 1 151 GLU HA 3.000 . 4.100 2.862 2.813 2.903 . 0 0 "[ . 1 . 2]" 1
817 1 149 ASP QB 1 151 GLU H 3.900 . 5.200 4.639 4.479 4.825 . 0 0 "[ . 1 . 2]" 1
818 1 151 GLU H 1 151 GLU QG 2.700 . 3.600 2.240 1.971 3.627 0.029 19 0 "[ . 1 . 2]" 1
819 1 150 GLU QB 1 151 GLU H 3.000 . 4.100 2.697 2.317 3.024 . 0 0 "[ . 1 . 2]" 1
820 1 151 GLU H 1 154 LYS HB3 3.700 . 5.400 5.184 4.775 6.261 0.861 15 1 "[ . 1 + 2]" 1
821 1 148 ILE HB 1 151 GLU H 2.400 . 6.000 5.328 5.123 5.489 . 0 0 "[ . 1 . 2]" 1
822 1 14 ALA MB 1 151 GLU H 3.400 . 4.900 4.293 3.770 4.942 0.042 2 0 "[ . 1 . 2]" 1
823 1 148 ILE MG 1 151 GLU H 3.400 . 4.900 4.146 3.831 4.436 . 0 0 "[ . 1 . 2]" 1
824 1 142 GLN H 1 143 SER HB2 4.100 . 6.000 4.922 4.670 5.715 . 0 0 "[ . 1 . 2]" 1
825 1 142 GLN H 1 142 GLN HA 3.000 . 4.100 2.850 2.819 2.867 . 0 0 "[ . 1 . 2]" 1
826 1 142 GLN H 1 144 PHE HB3 3.600 . 5.200 4.440 4.194 5.215 0.015 8 0 "[ . 1 . 2]" 1
827 1 140 ILE HB 1 142 GLN H 3.500 . 5.000 4.994 4.789 5.118 0.118 12 0 "[ . 1 . 2]" 1
828 1 141 LEU H 1 142 GLN H 2.800 . 3.800 2.739 2.666 2.842 . 0 0 "[ . 1 . 2]" 1
829 1 142 GLN H 1 143 SER H 2.900 . 3.900 2.698 2.611 2.790 . 0 0 "[ . 1 . 2]" 1
830 1 142 GLN H 1 145 GLN QE 3.900 . 5.800 4.185 3.682 4.674 . 0 0 "[ . 1 . 2]" 1
831 1 142 GLN H 1 143 SER HA 3.800 . 5.600 5.284 5.222 5.362 . 0 0 "[ . 1 . 2]" 1
832 1 140 ILE HA 1 142 GLN H 2.900 . 6.000 4.261 4.103 4.420 . 0 0 "[ . 1 . 2]" 1
833 1 142 GLN H 1 142 GLN HG2 3.500 . 5.000 3.317 2.112 4.372 . 0 0 "[ . 1 . 2]" 1
834 1 142 GLN H 1 142 GLN QB 2.900 . 3.900 2.312 2.060 2.545 . 0 0 "[ . 1 . 2]" 1
835 1 141 LEU HB2 1 142 GLN H 3.400 . 4.800 2.850 2.641 3.119 . 0 0 "[ . 1 . 2]" 1
836 1 141 LEU HB3 1 142 GLN H 2.700 . 6.000 3.803 3.587 3.945 . 0 0 "[ . 1 . 2]" 1
837 1 10 VAL QG 1 142 GLN H 4.000 . 6.000 4.831 4.601 5.180 . 0 0 "[ . 1 . 2]" 1
838 1 140 ILE H 1 141 LEU H 2.800 . 3.800 2.772 2.629 2.857 . 0 0 "[ . 1 . 2]" 1
839 1 139 THR H 1 140 ILE H 2.800 . 3.700 2.529 2.403 2.663 . 0 0 "[ . 1 . 2]" 1
840 1 137 TRP HA 1 140 ILE H 3.000 . 4.100 3.417 3.184 3.613 . 0 0 "[ . 1 . 2]" 1
841 1 139 THR HA 1 140 ILE H 3.200 . 4.500 3.514 3.485 3.547 . 0 0 "[ . 1 . 2]" 1
842 1 32 PRO HB2 1 140 ILE H 3.700 . 5.400 3.831 3.563 5.368 . 0 0 "[ . 1 . 2]" 1
843 1 140 ILE H 1 140 ILE HB 2.600 . 3.500 2.424 2.326 2.577 . 0 0 "[ . 1 . 2]" 1
844 1 140 ILE H 1 140 ILE QG 3.300 . 3.600 2.320 2.077 3.101 . 0 0 "[ . 1 . 2]" 1
845 1 140 ILE H 1 140 ILE MG 3.800 . 5.600 3.740 3.698 3.778 . 0 0 "[ . 1 . 2]" 1
846 1 21 LYS H 1 22 THR HB 3.700 . 5.500 5.147 4.967 5.291 . 0 0 "[ . 1 . 2]" 1
847 1 18 THR HA 1 21 LYS H 3.300 . 4.700 3.284 3.166 3.474 . 0 0 "[ . 1 . 2]" 1
848 1 20 PHE HB2 1 21 LYS H 3.700 . 5.400 3.919 3.831 4.075 . 0 0 "[ . 1 . 2]" 1
849 1 20 PHE HB3 1 21 LYS H 2.600 . 3.500 2.567 2.432 2.822 . 0 0 "[ . 1 . 2]" 1
850 1 21 LYS H 1 21 LYS HD2 4.300 . 6.000 5.008 4.548 5.868 . 0 0 "[ . 1 . 2]" 1
851 1 18 THR MG 1 21 LYS H 3.900 . 5.800 4.975 4.611 5.162 . 0 0 "[ . 1 . 2]" 1
852 1 21 LYS H 1 25 GLU QB 4.100 . 6.000 5.142 4.775 5.954 . 0 0 "[ . 1 . 2]" 1
853 1 37 THR H 1 39 LYS H 3.100 . 4.300 4.307 4.111 4.510 0.210 2 0 "[ . 1 . 2]" 1
854 1 39 LYS H 1 39 LYS QB 3.000 . 4.100 2.486 2.236 2.824 . 0 0 "[ . 1 . 2]" 1
855 1 39 LYS H 1 39 LYS HG3 3.900 . 5.800 4.506 1.401 5.114 0.599 9 1 "[ . +1 . 2]" 1
856 1 39 LYS H 1 40 VAL H 2.900 . 3.900 2.730 1.970 4.029 0.129 5 0 "[ . 1 . 2]" 1
857 1 39 LYS H 1 55 GLU HB3 3.700 . 5.400 5.493 4.665 6.058 0.658 5 3 "[ + *1 . - 2]" 1
858 1 39 LYS H 1 40 VAL QG 3.800 . 5.600 4.231 3.800 4.779 . 0 0 "[ . 1 . 2]" 1
859 1 8 HIS H 1 8 HIS HA 2.800 . 3.800 2.948 2.940 2.958 . 0 0 "[ . 1 . 2]" 1
860 1 8 HIS H 1 8 HIS HB2 3.400 . 4.900 3.449 3.045 3.719 . 0 0 "[ . 1 . 2]" 1
861 1 8 HIS H 1 8 HIS HB3 2.800 . 3.800 2.413 2.301 2.599 . 0 0 "[ . 1 . 2]" 1
862 1 8 HIS H 1 113 VAL MG2 3.800 . 5.600 3.711 3.543 3.978 . 0 0 "[ . 1 . 2]" 1
863 1 8 HIS H 1 114 GLU HA 3.400 . 4.800 4.513 4.252 4.681 . 0 0 "[ . 1 . 2]" 1
864 1 7 ARG QG 1 8 HIS H 2.600 . 3.500 2.544 2.178 2.857 . 0 0 "[ . 1 . 2]" 1
865 1 8 HIS H 1 113 VAL HB 2.400 . 3.100 2.030 1.815 2.622 . 0 0 "[ . 1 . 2]" 1
866 1 8 HIS H 1 99 VAL QG 4.200 . 6.000 5.479 5.291 5.737 . 0 0 "[ . 1 . 2]" 1
867 1 8 HIS H 1 9 SER H 3.500 . 5.100 4.386 4.294 4.443 . 0 0 "[ . 1 . 2]" 1
868 1 94 SER H 1 94 SER QB 3.100 . 4.300 2.851 2.387 3.331 . 0 0 "[ . 1 . 2]" 1
869 1 93 ASN QB 1 94 SER H 3.200 . 4.500 3.014 1.927 3.941 0.073 14 0 "[ . 1 . 2]" 1
870 1 29 GLU H 1 30 TRP H 2.600 . 3.400 2.128 1.736 2.420 0.064 16 0 "[ . 1 . 2]" 1
871 1 29 GLU H 1 30 TRP HA 4.100 . 6.000 4.632 4.438 4.836 . 0 0 "[ . 1 . 2]" 1
872 1 26 GLY HA2 1 29 GLU H 3.700 . 5.400 4.169 3.722 5.092 . 0 0 "[ . 1 . 2]" 1
873 1 27 PHE HA 1 29 GLU H 3.000 . 6.000 4.064 3.848 4.377 . 0 0 "[ . 1 . 2]" 1
874 1 29 GLU H 1 30 TRP HB2 4.300 . 6.000 4.593 4.132 4.987 . 0 0 "[ . 1 . 2]" 1
875 1 29 GLU H 1 29 GLU HB3 3.100 . 4.300 2.288 2.138 2.658 . 0 0 "[ . 1 . 2]" 1
876 1 28 PRO HB3 1 29 GLU H 3.700 . 5.400 4.640 4.525 4.719 . 0 0 "[ . 1 . 2]" 1
877 1 28 PRO HG2 1 29 GLU H 3.100 . 6.000 3.744 3.184 4.389 . 0 0 "[ . 1 . 2]" 1
878 1 22 THR MG 1 29 GLU H 4.100 . 6.000 5.398 4.907 6.021 0.021 16 0 "[ . 1 . 2]" 1
879 1 87 GLY H 1 88 ARG HB2 4.000 . 6.000 4.593 3.858 5.803 . 0 0 "[ . 1 . 2]" 1
880 1 87 GLY H 1 88 ARG H 3.000 . 4.100 2.733 1.875 3.752 0.025 15 0 "[ . 1 . 2]" 1
881 1 86 PHE HB3 1 87 GLY H 3.100 . 4.300 3.373 1.854 4.432 0.132 19 0 "[ . 1 . 2]" 1
882 1 150 GLU H 1 150 GLU QB 3.000 . 4.100 2.067 1.979 2.135 . 0 0 "[ . 1 . 2]" 1
883 1 150 GLU H 1 151 GLU HB3 4.600 . 6.000 5.954 4.122 6.113 0.113 1 0 "[ . 1 . 2]" 1
884 1 148 ILE MG 1 150 GLU H 3.500 . 5.000 4.738 4.574 5.038 0.038 5 0 "[ . 1 . 2]" 1
885 1 150 GLU H 1 153 ALA H 3.600 . 5.200 5.098 4.651 5.268 0.068 8 0 "[ . 1 . 2]" 1
886 1 148 ILE H 1 150 GLU H 3.200 . 4.500 4.026 3.862 4.143 . 0 0 "[ . 1 . 2]" 1
887 1 148 ILE HB 1 150 GLU H 3.600 . 5.200 4.999 4.836 5.166 . 0 0 "[ . 1 . 2]" 1
888 1 150 GLU H 1 154 LYS HG2 3.900 . 5.800 5.523 4.316 6.679 0.879 15 1 "[ . 1 + 2]" 1
889 1 14 ALA MB 1 150 GLU H 3.600 . 6.000 5.579 5.196 6.006 0.006 1 0 "[ . 1 . 2]" 1
890 1 86 PHE H 1 86 PHE HA 3.000 . 4.100 2.511 2.250 2.951 . 0 0 "[ . 1 . 2]" 1
891 1 85 GLY HA2 1 86 PHE H 3.300 . 4.600 3.089 2.178 3.578 . 0 0 "[ . 1 . 2]" 1
892 1 86 PHE H 1 86 PHE HB3 3.300 . 4.700 3.440 2.352 4.151 . 0 0 "[ . 1 . 2]" 1
893 1 86 PHE H 1 88 ARG HB2 3.600 . 5.200 4.610 3.414 5.720 0.520 4 1 "[ +. 1 . 2]" 1
894 1 84 ASN HA 1 86 PHE H 3.400 . 4.800 4.120 3.191 4.877 0.077 3 0 "[ . 1 . 2]" 1
895 1 86 PHE H 1 87 GLY HA2 3.800 . 5.600 5.336 4.485 5.883 0.283 5 0 "[ . 1 . 2]" 1
896 1 84 ASN HB2 1 86 PHE H 3.800 . 5.600 5.204 3.389 6.563 0.963 18 1 "[ . 1 . + 2]" 1
897 1 86 PHE H 1 88 ARG HB3 3.200 . 6.000 5.265 3.199 6.237 0.237 18 0 "[ . 1 . 2]" 1
898 1 36 ARG HB2 1 37 THR H 3.500 . 5.000 3.956 3.239 4.290 . 0 0 "[ . 1 . 2]" 1
899 1 36 ARG HB3 1 37 THR H 2.900 . 3.900 2.870 2.011 3.473 . 0 0 "[ . 1 . 2]" 1
900 1 105 GLY H 1 108 LYS H 3.500 . 6.000 5.158 4.864 5.332 . 0 0 "[ . 1 . 2]" 1
901 1 104 ASP QB 1 105 GLY H 3.600 . 5.200 3.770 3.220 3.981 . 0 0 "[ . 1 . 2]" 1
902 1 105 GLY H 1 108 LYS HB3 3.900 . 5.800 5.209 4.720 5.544 . 0 0 "[ . 1 . 2]" 1
903 1 103 ALA MB 1 105 GLY H 3.400 . 4.800 4.523 3.996 4.843 0.043 17 0 "[ . 1 . 2]" 1
904 1 105 GLY H 1 106 GLN QB 3.600 . 6.000 5.188 4.380 5.802 . 0 0 "[ . 1 . 2]" 1
905 1 103 ALA HA 1 105 GLY H 3.900 . 5.800 5.668 5.317 5.939 0.139 17 0 "[ . 1 . 2]" 1
906 1 105 GLY H 1 106 GLN H 3.300 . 4.600 3.643 2.685 4.429 . 0 0 "[ . 1 . 2]" 1
907 1 105 GLY H 1 106 GLN HA 3.600 . 6.000 5.288 4.851 5.778 . 0 0 "[ . 1 . 2]" 1
908 1 150 GLU QB 1 154 LYS H 4.000 . 6.000 4.787 4.046 5.745 . 0 0 "[ . 1 . 2]" 1
909 1 152 GLY HA2 1 154 LYS H 3.800 . 6.000 5.411 4.724 6.099 0.099 5 0 "[ . 1 . 2]" 1
910 1 154 LYS H 1 154 LYS HB3 3.000 . 4.100 2.556 2.164 3.059 . 0 0 "[ . 1 . 2]" 1
911 1 153 ALA MB 1 154 LYS H 3.500 . 5.000 3.348 2.430 3.665 . 0 0 "[ . 1 . 2]" 1
912 1 25 GLU QB 1 26 GLY H 3.300 . 4.700 3.073 2.403 3.806 . 0 0 "[ . 1 . 2]" 1
913 1 26 GLY H 1 27 PHE H 2.600 . 3.500 2.793 2.133 3.805 0.305 1 0 "[ . 1 . 2]" 1
914 1 26 GLY H 1 27 PHE HA 3.900 . 5.800 4.229 3.618 4.627 . 0 0 "[ . 1 . 2]" 1
915 1 26 GLY H 1 29 GLU HG2 3.700 . 5.400 4.865 4.435 5.339 . 0 0 "[ . 1 . 2]" 1
916 1 24 LEU HB2 1 26 GLY H 2.400 . 6.000 5.558 5.274 6.063 0.063 12 0 "[ . 1 . 2]" 1
917 1 22 THR MG 1 26 GLY H 3.800 . 5.600 4.788 4.390 5.362 . 0 0 "[ . 1 . 2]" 1
918 1 129 VAL HA 1 130 ARG H 3.100 . 4.300 3.510 3.404 3.590 . 0 0 "[ . 1 . 2]" 1
919 1 130 ARG H 1 130 ARG HB3 3.000 . 4.100 2.676 2.294 3.596 . 0 0 "[ . 1 . 2]" 1
920 1 130 ARG H 1 130 ARG QG 3.700 . 5.500 3.626 2.202 4.044 . 0 0 "[ . 1 . 2]" 1
921 1 130 ARG H 1 130 ARG HB2 2.900 . 3.900 2.568 2.243 3.645 . 0 0 "[ . 1 . 2]" 1
922 1 121 MET H 1 122 GLY H 3.000 . 4.100 2.744 2.397 3.113 . 0 0 "[ . 1 . 2]" 1
923 1 118 PHE QB 1 121 MET H 2.400 . 6.000 5.046 4.533 5.356 . 0 0 "[ . 1 . 2]" 1
924 1 121 MET H 1 125 HIS QB 3.400 . 4.900 3.860 3.293 4.817 . 0 0 "[ . 1 . 2]" 1
925 1 119 ASP QB 1 121 MET H 3.600 . 5.200 4.455 4.176 4.671 . 0 0 "[ . 1 . 2]" 1
926 1 121 MET H 1 121 MET QB 2.800 . 3.800 2.360 2.187 2.529 . 0 0 "[ . 1 . 2]" 1
927 1 121 MET H 1 126 ALA MB 3.400 . 4.800 4.763 4.276 4.920 0.120 19 0 "[ . 1 . 2]" 1
928 1 142 GLN HA 1 142 GLN HE21 2.900 . 3.900 2.478 2.056 2.957 . 0 0 "[ . 1 . 2]" 1
929 1 142 GLN HE21 1 144 PHE HB3 3.900 . 6.000 5.810 5.202 6.122 0.122 8 0 "[ . 1 . 2]" 1
930 1 142 GLN HB2 1 142 GLN HE21 2.900 . 3.900 3.683 1.905 4.053 0.153 14 0 "[ . 1 . 2]" 1
931 1 141 LEU HB2 1 142 GLN HE21 3.300 . 4.600 3.131 2.403 4.424 . 0 0 "[ . 1 . 2]" 1
932 1 10 VAL QG 1 142 GLN HE21 3.700 . 5.400 4.124 3.710 4.958 . 0 0 "[ . 1 . 2]" 1
933 1 144 PHE H 1 145 GLN HA 3.800 . 5.600 5.360 5.249 5.422 . 0 0 "[ . 1 . 2]" 1
934 1 140 ILE HA 1 144 PHE H 2.900 . 4.000 3.971 3.826 4.075 0.075 20 0 "[ . 1 . 2]" 1
935 1 144 PHE H 1 146 ASP H 3.100 . 4.300 3.738 3.564 3.968 . 0 0 "[ . 1 . 2]" 1
936 1 31 TRP H 1 144 PHE H 3.900 . 6.000 5.816 5.438 6.062 0.062 16 0 "[ . 1 . 2]" 1
937 1 143 SER HA 1 144 PHE H 3.000 . 4.100 3.450 3.428 3.475 . 0 0 "[ . 1 . 2]" 1
938 1 144 PHE H 1 144 PHE HA 3.000 . 4.100 2.800 2.778 2.824 . 0 0 "[ . 1 . 2]" 1
939 1 144 PHE H 1 144 PHE HB3 2.900 . 4.000 2.425 2.287 3.141 . 0 0 "[ . 1 . 2]" 1
940 1 144 PHE H 1 145 GLN HG2 4.400 . 6.000 6.369 6.000 6.826 0.826 20 6 "[ . 1 *- ** * +]" 1
941 1 144 PHE H 1 144 PHE HB2 2.700 . 3.600 2.550 1.994 2.701 . 0 0 "[ . 1 . 2]" 1
942 1 32 PRO HG3 1 144 PHE H 3.600 . 5.300 3.506 3.125 3.884 . 0 0 "[ . 1 . 2]" 1
943 1 143 SER HB2 1 144 PHE H 3.300 . 4.600 3.157 2.855 4.042 . 0 0 "[ . 1 . 2]" 1
944 1 32 PRO HD3 1 144 PHE H 3.300 . 4.700 4.309 3.802 4.769 0.069 4 0 "[ . 1 . 2]" 1
945 1 32 PRO HG2 1 144 PHE H 2.700 . 6.000 5.235 4.640 5.589 . 0 0 "[ . 1 . 2]" 1
946 1 140 ILE MG 1 144 PHE H 3.400 . 4.800 3.842 3.626 4.015 . 0 0 "[ . 1 . 2]" 1
947 1 22 THR MG 1 144 PHE H 4.000 . 6.000 5.593 4.693 6.014 0.014 9 0 "[ . 1 . 2]" 1
948 1 12 VAL H 1 14 ALA H 3.600 . 5.200 5.193 5.087 5.255 0.055 16 0 "[ . 1 . 2]" 1
949 1 14 ALA H 1 108 LYS H 3.900 . 5.800 5.592 5.015 5.833 0.033 16 0 "[ . 1 . 2]" 1
950 1 14 ALA H 1 107 LYS HA 3.600 . 5.300 5.041 4.233 5.368 0.068 1 0 "[ . 1 . 2]" 1
951 1 14 ALA H 1 109 THR HB 3.400 . 4.900 4.674 4.494 4.896 . 0 0 "[ . 1 . 2]" 1
952 1 13 LYS HB3 1 14 ALA H 3.700 . 5.400 4.624 4.475 4.698 . 0 0 "[ . 1 . 2]" 1
953 1 14 ALA H 1 18 THR MG 3.800 . 5.600 4.897 4.430 5.223 . 0 0 "[ . 1 . 2]" 1
954 1 12 VAL QG 1 14 ALA H 2.700 . 6.000 1.746 1.584 2.230 . 0 0 "[ . 1 . 2]" 1
955 1 14 ALA H 1 148 ILE MG 3.100 . 4.300 3.041 2.617 3.283 . 0 0 "[ . 1 . 2]" 1
956 1 42 ALA H 1 43 PRO HA 3.500 . 6.000 5.709 5.071 5.935 . 0 0 "[ . 1 . 2]" 1
957 1 40 VAL QG 1 42 ALA H 2.400 . 6.000 4.694 3.221 5.099 . 0 0 "[ . 1 . 2]" 1
958 1 41 GLY H 1 42 ALA H 2.700 . 3.600 2.299 1.792 3.624 0.024 10 0 "[ . 1 . 2]" 1
959 1 39 LYS H 1 42 ALA H 3.400 . 4.900 4.023 3.335 4.899 . 0 0 "[ . 1 . 2]" 1
960 1 41 GLY QA 1 42 ALA H 3.000 . 4.100 2.757 2.464 2.923 . 0 0 "[ . 1 . 2]" 1
961 1 42 ALA H 1 55 GLU HB2 2.900 . 4.000 2.427 1.683 3.706 0.117 1 0 "[ . 1 . 2]" 1
962 1 42 ALA H 1 55 GLU HB3 2.700 . 3.600 2.934 2.493 3.839 0.239 10 0 "[ . 1 . 2]" 1
963 1 39 LYS QB 1 42 ALA H 2.400 . 6.000 5.527 4.962 5.752 . 0 0 "[ . 1 . 2]" 1
964 1 44 LEU H 1 44 LEU HG 3.900 . 5.800 4.339 2.481 4.716 . 0 0 "[ . 1 . 2]" 1
965 1 28 PRO QD 1 44 LEU H 3.300 . 6.000 4.264 3.604 5.020 . 0 0 "[ . 1 . 2]" 1
966 1 43 PRO HB2 1 44 LEU H 3.100 . 4.300 4.085 3.169 4.335 0.035 4 0 "[ . 1 . 2]" 1
967 1 44 LEU H 1 55 GLU HG2 3.400 . 4.800 4.426 1.900 5.259 0.459 17 0 "[ . 1 . 2]" 1
968 1 42 ALA HA 1 44 LEU H 3.300 . 4.700 4.440 4.100 4.843 0.143 3 0 "[ . 1 . 2]" 1
969 1 41 GLY QA 1 44 LEU H 3.200 . 6.000 5.042 4.152 5.768 . 0 0 "[ . 1 . 2]" 1
970 1 28 PRO HB3 1 44 LEU H 3.000 . 4.100 3.590 2.753 4.145 0.045 2 0 "[ . 1 . 2]" 1
971 1 44 LEU H 1 44 LEU QD 4.100 . 6.000 3.810 1.791 4.079 0.209 13 0 "[ . 1 . 2]" 1
972 1 44 LEU H 1 46 VAL H 3.800 . 6.000 5.378 4.944 6.425 0.425 3 0 "[ . 1 . 2]" 1
973 1 44 LEU H 1 45 GLY QA 3.200 . 6.000 3.884 3.611 4.355 . 0 0 "[ . 1 . 2]" 1
974 1 44 LEU H 1 56 ILE HB 3.700 . 6.000 5.509 4.334 6.035 0.035 16 0 "[ . 1 . 2]" 1
975 1 44 LEU H 1 44 LEU HA 3.000 . 4.200 2.872 2.799 2.941 . 0 0 "[ . 1 . 2]" 1
976 1 44 LEU H 1 44 LEU QB 2.900 . 3.900 2.780 2.352 3.164 . 0 0 "[ . 1 . 2]" 1
977 1 42 ALA MB 1 44 LEU H 3.000 . 4.100 3.394 2.663 3.921 . 0 0 "[ . 1 . 2]" 1
978 1 148 ILE H 1 151 GLU QG 3.900 . 5.800 4.451 4.070 5.253 . 0 0 "[ . 1 . 2]" 1
979 1 146 ASP HB3 1 148 ILE H 3.700 . 6.000 4.950 4.696 5.468 . 0 0 "[ . 1 . 2]" 1
980 1 148 ILE H 1 150 GLU QB 3.700 . 5.400 4.482 4.299 4.599 . 0 0 "[ . 1 . 2]" 1
981 1 147 LYS HB2 1 148 ILE H 3.500 . 5.000 3.865 3.414 4.047 . 0 0 "[ . 1 . 2]" 1
982 1 22 THR MG 1 148 ILE H 3.300 . 4.700 3.615 3.337 4.003 . 0 0 "[ . 1 . 2]" 1
983 1 148 ILE H 1 148 ILE HG12 3.700 . 5.400 3.504 3.404 3.678 . 0 0 "[ . 1 . 2]" 1
984 1 143 SER H 1 144 PHE HA 3.900 . 5.800 5.143 5.049 5.205 . 0 0 "[ . 1 . 2]" 1
985 1 143 SER H 1 143 SER HB3 2.600 . 6.000 3.415 2.514 3.611 . 0 0 "[ . 1 . 2]" 1
986 1 140 ILE HA 1 143 SER H 2.900 . 4.000 3.749 3.524 3.938 . 0 0 "[ . 1 . 2]" 1
987 1 142 GLN HG2 1 143 SER H 4.000 . 6.000 4.562 4.019 5.109 . 0 0 "[ . 1 . 2]" 1
988 1 142 GLN QB 1 143 SER H 2.900 . 3.900 2.385 2.182 2.668 . 0 0 "[ . 1 . 2]" 1
989 1 143 SER H 1 144 PHE HB2 3.800 . 5.600 4.850 4.215 5.039 . 0 0 "[ . 1 . 2]" 1
990 1 32 PRO HD3 1 143 SER H 3.900 . 5.800 4.567 3.986 5.471 . 0 0 "[ . 1 . 2]" 1
991 1 32 PRO HG3 1 143 SER H 4.300 . 6.000 4.054 3.700 4.663 . 0 0 "[ . 1 . 2]" 1
992 1 140 ILE MG 1 143 SER H 3.700 . 5.400 4.871 4.694 5.055 . 0 0 "[ . 1 . 2]" 1
993 1 143 SER H 1 144 PHE HB3 3.900 . 5.800 4.654 4.513 5.453 . 0 0 "[ . 1 . 2]" 1
994 1 145 GLN H 1 147 LYS H 3.500 . 5.100 4.455 4.246 4.785 . 0 0 "[ . 1 . 2]" 1
995 1 147 LYS H 1 149 ASP H 3.300 . 4.600 3.944 3.735 4.192 . 0 0 "[ . 1 . 2]" 1
996 1 31 TRP H 1 147 LYS H 3.400 . 6.000 5.224 4.730 5.558 . 0 0 "[ . 1 . 2]" 1
997 1 30 TRP HA 1 147 LYS H 4.000 . 6.000 5.800 5.086 6.153 0.153 8 0 "[ . 1 . 2]" 1
998 1 147 LYS H 1 147 LYS HA 2.900 . 4.000 2.828 2.795 2.871 . 0 0 "[ . 1 . 2]" 1
999 1 30 TRP HB3 1 147 LYS H 4.000 . 6.000 5.343 4.357 6.054 0.054 19 0 "[ . 1 . 2]" 1
1000 1 145 GLN HA 1 147 LYS H 3.300 . 6.000 4.669 4.486 4.927 . 0 0 "[ . 1 . 2]" 1
1001 1 146 ASP HB2 1 147 LYS H 3.100 . 4.300 3.655 2.865 3.944 . 0 0 "[ . 1 . 2]" 1
1002 1 147 LYS H 1 150 GLU QB 3.900 . 5.800 5.465 4.891 5.826 0.026 15 0 "[ . 1 . 2]" 1
1003 1 147 LYS H 1 147 LYS HB2 2.600 . 3.500 2.520 2.135 2.744 . 0 0 "[ . 1 . 2]" 1
1004 1 147 LYS H 1 148 ILE HB 3.800 . 5.600 4.716 4.545 4.927 . 0 0 "[ . 1 . 2]" 1
1005 1 147 LYS H 1 148 ILE HG12 4.300 . 6.000 5.912 5.738 6.204 0.204 18 0 "[ . 1 . 2]" 1
1006 1 65 PHE HB3 1 66 GLY H 3.400 . 4.900 3.722 1.689 4.459 0.211 12 0 "[ . 1 . 2]" 1
1007 1 53 TRP HB2 1 66 GLY H 4.200 . 6.000 2.240 1.837 4.329 0.163 12 0 "[ . 1 . 2]" 1
1008 1 66 GLY H 1 79 ILE MD 3.800 . 5.600 4.714 4.021 5.633 0.033 20 0 "[ . 1 . 2]" 1
1009 1 66 GLY H 1 66 GLY HA3 2.700 . 3.600 2.383 2.268 2.707 . 0 0 "[ . 1 . 2]" 1
1010 1 53 TRP HB3 1 66 GLY H 2.700 . 6.000 3.562 3.215 5.014 . 0 0 "[ . 1 . 2]" 1
1011 1 125 HIS HA 1 128 ARG H 3.500 . 5.100 3.704 3.374 3.998 . 0 0 "[ . 1 . 2]" 1
1012 1 126 ALA HA 1 128 ARG H 3.300 . 4.700 4.427 4.236 4.656 . 0 0 "[ . 1 . 2]" 1
1013 1 128 ARG H 1 128 ARG HD3 4.200 . 6.000 4.390 3.711 4.830 . 0 0 "[ . 1 . 2]" 1
1014 1 128 ARG H 1 128 ARG HB2 3.700 . 5.400 3.619 3.584 3.648 . 0 0 "[ . 1 . 2]" 1
1015 1 128 ARG H 1 129 VAL QG 4.300 . 5.400 3.993 3.643 4.320 . 0 0 "[ . 1 . 2]" 1
1016 1 128 ARG H 1 129 VAL HB 3.900 . 5.800 4.872 4.627 5.549 . 0 0 "[ . 1 . 2]" 1
1017 1 91 PRO HB2 1 93 ASN HD21 3.300 . 4.600 4.199 3.143 4.825 0.225 3 0 "[ . 1 . 2]" 1
1018 1 92 ASP HA 1 93 ASN HD21 3.100 . 6.000 4.653 2.579 5.659 . 0 0 "[ . 1 . 2]" 1
1019 1 59 GLN HA 1 59 GLN QE 4.300 . 5.400 4.150 3.860 4.860 . 0 0 "[ . 1 . 2]" 1
1020 1 59 GLN QE 1 59 GLN QG 3.500 . 4.100 2.261 2.089 2.699 . 0 0 "[ . 1 . 2]" 1
1021 1 58 GLU HA 1 59 GLN QE 3.900 . 5.800 4.941 4.361 5.548 . 0 0 "[ . 1 . 2]" 1
1022 1 59 GLN HB2 1 59 GLN QE 4.500 . 6.000 3.817 3.185 4.343 . 0 0 "[ . 1 . 2]" 1
1023 1 69 ARG HA 1 70 LYS H 3.100 . 4.300 3.453 3.365 3.528 . 0 0 "[ . 1 . 2]" 1
1024 1 69 ARG QD 1 70 LYS H 3.900 . 5.800 4.642 3.994 5.035 . 0 0 "[ . 1 . 2]" 1
1025 1 70 LYS H 1 70 LYS HB2 3.200 . 4.500 3.491 3.214 3.688 . 0 0 "[ . 1 . 2]" 1
1026 1 70 LYS H 1 71 VAL QG 4.100 . 6.000 3.950 3.757 4.118 . 0 0 "[ . 1 . 2]" 1
1027 1 68 ILE MG 1 70 LYS H 2.600 . 3.500 2.202 1.957 2.515 . 0 0 "[ . 1 . 2]" 1
1028 1 68 ILE MD 1 70 LYS H 4.500 . 6.000 4.535 4.317 4.852 . 0 0 "[ . 1 . 2]" 1
1029 1 70 LYS H 1 77 LEU HA 3.500 . 5.100 4.750 4.570 5.072 . 0 0 "[ . 1 . 2]" 1
1030 1 70 LYS H 1 78 VAL HA 3.400 . 6.000 4.778 4.580 5.067 . 0 0 "[ . 1 . 2]" 1
1031 1 70 LYS H 1 70 LYS HA 2.800 . 3.800 2.890 2.843 2.939 . 0 0 "[ . 1 . 2]" 1
1032 1 68 ILE HA 1 70 LYS H 3.400 . 4.800 3.567 3.324 3.939 . 0 0 "[ . 1 . 2]" 1
1033 1 84 ASN QD 1 133 MET HA 3.800 . 3.800 3.360 2.413 3.843 0.043 5 0 "[ . 1 . 2]" 1
1034 1 33 ASN HA 1 84 ASN QD 3.600 . 5.300 5.052 4.570 5.245 . 0 0 "[ . 1 . 2]" 1
1035 1 84 ASN QD 1 136 GLY QA 2.900 . 3.900 2.515 1.726 3.240 0.174 4 0 "[ . 1 . 2]" 1
1036 1 142 GLN HA 1 145 GLN QE 2.800 . 3.800 2.755 2.036 3.459 . 0 0 "[ . 1 . 2]" 1
1037 1 144 PHE HB3 1 145 GLN QE 2.400 . 6.000 4.111 3.507 4.623 . 0 0 "[ . 1 . 2]" 1
1038 1 84 ASN HB2 1 84 ASN QD 3.800 . 3.900 2.692 2.112 3.267 . 0 0 "[ . 1 . 2]" 1
1039 1 47 ASP HB3 1 51 GLY H 2.900 . 3.900 3.199 2.950 3.463 . 0 0 "[ . 1 . 2]" 1
1040 1 51 GLY H 1 68 ILE MG 4.300 . 6.000 5.412 5.037 5.785 . 0 0 "[ . 1 . 2]" 1
1041 1 51 GLY H 1 68 ILE MD 3.800 . 5.600 3.996 3.544 4.655 . 0 0 "[ . 1 . 2]" 1
1042 1 47 ASP HB2 1 51 GLY H 3.500 . 5.000 4.750 4.464 5.008 0.008 13 0 "[ . 1 . 2]" 1
1043 1 51 GLY H 1 52 ARG QB 3.300 . 4.700 4.376 3.891 4.617 . 0 0 "[ . 1 . 2]" 1
1044 1 51 GLY H 1 68 ILE HB 4.100 . 6.000 4.914 4.496 5.212 . 0 0 "[ . 1 . 2]" 1
1045 1 51 GLY H 1 71 VAL QG 3.600 . 5.200 4.486 4.086 5.129 . 0 0 "[ . 1 . 2]" 1
1046 1 34 ASN H 1 35 PHE H 3.000 . 4.100 2.902 2.553 3.816 . 0 0 "[ . 1 . 2]" 1
1047 1 33 ASN HA 1 35 PHE H 3.100 . 4.300 3.653 3.321 4.379 0.079 3 0 "[ . 1 . 2]" 1
1048 1 35 PHE H 1 35 PHE HB3 3.000 . 4.200 2.682 2.470 3.040 . 0 0 "[ . 1 . 2]" 1
1049 1 35 PHE H 1 36 ARG HG2 3.200 . 6.000 3.873 2.919 5.625 . 0 0 "[ . 1 . 2]" 1
1050 1 35 PHE H 1 36 ARG HG3 3.400 . 6.000 5.077 3.577 6.064 0.064 5 0 "[ . 1 . 2]" 1
1051 1 121 MET QB 1 122 GLY H 3.400 . 4.700 3.437 2.933 3.782 . 0 0 "[ . 1 . 2]" 1
1052 1 122 GLY H 1 126 ALA MB 3.200 . 4.500 3.449 2.671 4.289 . 0 0 "[ . 1 . 2]" 1
1053 1 122 GLY H 1 125 HIS QB 3.100 . 4.300 3.525 2.901 4.080 . 0 0 "[ . 1 . 2]" 1
1054 1 119 ASP QB 1 122 GLY H 3.200 . 6.000 5.054 4.388 5.759 . 0 0 "[ . 1 . 2]" 1
1055 1 34 ASN QB 1 34 ASN HD21 3.200 . 3.600 2.164 2.124 2.225 . 0 0 "[ . 1 . 2]" 1
1056 1 36 ARG H 1 36 ARG HG3 3.600 . 5.200 4.103 2.453 4.649 . 0 0 "[ . 1 . 2]" 1
1057 1 34 ASN HA 1 36 ARG H 3.200 . 4.500 3.339 2.895 4.096 . 0 0 "[ . 1 . 2]" 1
1058 1 35 PHE HB3 1 36 ARG H 3.400 . 4.800 3.823 2.986 4.578 . 0 0 "[ . 1 . 2]" 1
1059 1 36 ARG H 1 36 ARG HB2 3.000 . 4.100 2.581 2.301 2.888 . 0 0 "[ . 1 . 2]" 1
1060 1 36 ARG H 1 36 ARG HG2 3.300 . 4.700 3.118 2.411 4.512 . 0 0 "[ . 1 . 2]" 1
1061 1 36 ARG H 1 36 ARG HB3 3.400 . 4.800 3.708 3.376 3.850 . 0 0 "[ . 1 . 2]" 1
1062 1 30 TRP H 1 31 TRP H 3.500 . 5.000 4.495 4.230 4.602 . 0 0 "[ . 1 . 2]" 1
1063 1 30 TRP HA 1 31 TRP H 2.900 . 3.900 2.541 2.237 2.942 . 0 0 "[ . 1 . 2]" 1
1064 1 30 TRP HB3 1 31 TRP H 2.800 . 3.800 2.240 1.898 2.695 . 0 0 "[ . 1 . 2]" 1
1065 1 31 TRP H 1 32 PRO HD2 3.000 . 4.100 2.336 1.884 2.995 0.016 11 0 "[ . 1 . 2]" 1
1066 1 30 TRP HB2 1 31 TRP H 2.700 . 3.600 3.083 2.303 3.678 0.078 14 0 "[ . 1 . 2]" 1
1067 1 31 TRP H 1 31 TRP QB 3.000 . 4.100 2.620 2.477 3.104 . 0 0 "[ . 1 . 2]" 1
1068 1 31 TRP H 1 31 TRP HD1 2.700 . 3.600 3.050 2.033 3.576 . 0 0 "[ . 1 . 2]" 1
1069 1 31 TRP H 1 32 PRO HG3 4.200 . 6.000 4.215 3.732 4.521 . 0 0 "[ . 1 . 2]" 1
1070 1 2 TYR HA 1 120 ARG H 3.200 . 4.500 4.545 4.293 4.641 0.141 15 0 "[ . 1 . 2]" 1
1071 1 120 ARG H 1 121 MET H 2.900 . 4.000 2.727 2.579 2.879 . 0 0 "[ . 1 . 2]" 1
1072 1 118 PHE QB 1 120 ARG H 2.400 . 6.000 4.879 4.539 5.535 . 0 0 "[ . 1 . 2]" 1
1073 1 119 ASP QB 1 120 ARG H 3.000 . 4.100 2.713 2.124 3.212 . 0 0 "[ . 1 . 2]" 1
1074 1 84 ASN H 1 88 ARG H 3.900 . 5.800 5.647 4.812 5.997 0.197 12 0 "[ . 1 . 2]" 1
1075 1 88 ARG H 1 89 ILE H 3.600 . 5.200 4.428 4.300 4.525 . 0 0 "[ . 1 . 2]" 1
1076 1 86 PHE HA 1 88 ARG H 3.400 . 4.800 4.038 3.362 4.823 0.023 10 0 "[ . 1 . 2]" 1
1077 1 87 GLY HA2 1 88 ARG H 3.100 . 4.300 2.984 2.378 3.485 . 0 0 "[ . 1 . 2]" 1
1078 1 87 GLY HA3 1 88 ARG H 3.500 . 5.000 3.376 2.923 3.561 . 0 0 "[ . 1 . 2]" 1
1079 1 88 ARG H 1 131 ASN QB 3.800 . 6.000 5.836 4.127 6.238 0.238 17 0 "[ . 1 . 2]" 1
1080 1 88 ARG H 1 88 ARG HB3 2.800 . 3.800 3.221 2.534 3.776 . 0 0 "[ . 1 . 2]" 1
1081 1 88 ARG H 1 88 ARG HB2 3.300 . 4.700 2.723 2.203 3.559 . 0 0 "[ . 1 . 2]" 1
1082 1 88 ARG H 1 88 ARG QD 3.600 . 5.200 4.279 2.216 5.099 . 0 0 "[ . 1 . 2]" 1
1083 1 125 HIS H 1 125 HIS QB 2.800 . 3.800 2.353 2.091 2.630 . 0 0 "[ . 1 . 2]" 1
1084 1 124 LYS HB2 1 125 HIS H 3.200 . 4.500 3.399 2.242 4.124 . 0 0 "[ . 1 . 2]" 1
1085 1 124 LYS HB3 1 125 HIS H 3.200 . 4.500 3.382 2.392 4.462 . 0 0 "[ . 1 . 2]" 1
1086 1 134 ASP HA 1 135 LYS H 3.200 . 4.500 3.504 3.389 3.576 . 0 0 "[ . 1 . 2]" 1
1087 1 134 ASP QB 1 135 LYS H 3.200 . 4.500 2.991 2.419 3.727 . 0 0 "[ . 1 . 2]" 1
1088 1 135 LYS H 1 135 LYS HB2 3.100 . 4.300 2.745 2.126 3.732 . 0 0 "[ . 1 . 2]" 1
1089 1 1 ASN HB3 1 2 TYR H 3.900 . 5.800 3.998 2.958 4.527 . 0 0 "[ . 1 . 2]" 1
1090 1 29 GLU QB 1 30 TRP H 3.800 . 5.600 3.843 3.782 3.911 . 0 0 "[ . 1 . 2]" 1
1091 1 138 PRO QG 1 139 THR H 2.900 . 3.900 2.309 2.085 2.468 . 0 0 "[ . 1 . 2]" 1
1092 1 138 PRO HB2 1 139 THR H 3.000 . 4.100 3.062 2.861 3.232 . 0 0 "[ . 1 . 2]" 1
1093 1 139 THR H 1 139 THR MG 4.000 . 6.000 3.744 3.677 3.776 . 0 0 "[ . 1 . 2]" 1
1094 1 139 THR H 1 140 ILE HA 3.800 . 5.600 5.160 5.042 5.277 . 0 0 "[ . 1 . 2]" 1
1095 1 139 THR H 1 140 ILE MD 4.100 . 6.000 5.243 3.672 5.574 . 0 0 "[ . 1 . 2]" 1
1096 1 136 GLY QA 1 139 THR H 3.600 . 5.200 3.805 3.187 4.142 . 0 0 "[ . 1 . 2]" 1
1097 1 29 GLU HA 1 30 TRP H 3.500 . 5.000 3.317 3.246 3.442 . 0 0 "[ . 1 . 2]" 1
1098 1 30 TRP H 1 31 TRP HA 3.300 . 6.000 5.481 5.079 5.721 . 0 0 "[ . 1 . 2]" 1
1099 1 27 PHE HA 1 30 TRP H 3.200 . 6.000 4.812 4.359 5.474 . 0 0 "[ . 1 . 2]" 1
1100 1 30 TRP H 1 30 TRP HB3 2.600 . 6.000 3.635 3.600 3.688 . 0 0 "[ . 1 . 2]" 1
1101 1 84 ASN HA 1 84 ASN QD 3.500 . 5.100 4.000 3.684 4.285 . 0 0 "[ . 1 . 2]" 1
1102 1 40 VAL QG 1 84 ASN QD 4.000 . 6.000 3.224 2.286 3.618 . 0 0 "[ . 1 . 2]" 1
1103 1 30 TRP H 1 32 PRO HG2 4.000 . 6.000 5.615 4.897 6.037 0.037 11 0 "[ . 1 . 2]" 1
1104 1 22 THR MG 1 30 TRP H 3.500 . 5.100 5.055 4.776 5.251 0.151 8 0 "[ . 1 . 2]" 1
1105 1 92 ASP QB 1 93 ASN HD22 3.400 . 6.000 4.840 3.080 6.310 0.310 18 0 "[ . 1 . 2]" 1
1106 1 105 GLY QA 1 108 LYS H 3.400 . 4.900 4.182 3.964 4.493 . 0 0 "[ . 1 . 2]" 1
1107 1 107 LYS QG 1 108 LYS H 3.600 . 5.200 4.112 2.905 4.806 . 0 0 "[ . 1 . 2]" 1
1108 1 142 GLN HE22 1 142 GLN HG2 3.700 . 5.400 3.785 3.474 4.078 . 0 0 "[ . 1 . 2]" 1
1109 1 141 LEU HB2 1 142 GLN HE22 3.400 . 4.900 3.511 2.398 4.911 0.011 18 0 "[ . 1 . 2]" 1
1110 1 10 VAL QG 1 142 GLN HE22 3.600 . 5.200 4.275 3.804 4.757 . 0 0 "[ . 1 . 2]" 1
1111 1 106 GLN H 1 108 LYS H 3.500 . 5.100 3.167 2.368 3.705 . 0 0 "[ . 1 . 2]" 1
1112 1 15 ASP HA 1 108 LYS H 2.900 . 3.900 3.366 2.987 3.642 . 0 0 "[ . 1 . 2]" 1
1113 1 108 LYS H 1 109 THR HB 3.400 . 6.000 5.725 5.553 5.881 . 0 0 "[ . 1 . 2]" 1
1114 1 27 PHE H 1 27 PHE QD 3.300 . 4.700 4.092 3.885 4.244 . 0 0 "[ . 1 . 2]" 1
1115 1 26 GLY HA3 1 27 PHE H 3.200 . 4.500 3.477 3.384 3.542 . 0 0 "[ . 1 . 2]" 1
1116 1 27 PHE H 1 30 TRP H 3.500 . 6.000 6.018 5.798 6.128 0.128 2 0 "[ . 1 . 2]" 1
1117 1 26 GLY HA2 1 27 PHE H 3.100 . 4.300 2.789 2.152 3.003 . 0 0 "[ . 1 . 2]" 1
1118 1 27 PHE H 1 28 PRO QD 3.300 . 4.600 2.385 2.010 2.549 . 0 0 "[ . 1 . 2]" 1
1119 1 27 PHE H 1 27 PHE HB3 3.300 . 4.700 2.666 2.502 2.989 . 0 0 "[ . 1 . 2]" 1
1120 1 27 PHE H 1 28 PRO HB3 3.800 . 5.600 5.661 5.310 5.728 0.128 13 0 "[ . 1 . 2]" 1
1121 1 27 PHE H 1 46 VAL MG2 3.300 . 4.700 4.050 3.725 4.409 . 0 0 "[ . 1 . 2]" 1
1122 1 82 ARG H 1 83 LEU H 2.200 . 6.000 2.077 1.447 3.580 . 0 0 "[ . 1 . 2]" 1
1123 1 83 LEU H 1 83 LEU HA 2.600 . 3.500 2.368 2.246 2.826 . 0 0 "[ . 1 . 2]" 1
1124 1 83 LEU H 1 83 LEU HB3 3.200 . 4.500 3.676 2.794 4.098 . 0 0 "[ . 1 . 2]" 1
1125 1 83 LEU H 1 83 LEU HB2 2.900 . 4.000 3.282 3.083 3.964 . 0 0 "[ . 1 . 2]" 1
1126 1 83 LEU H 1 83 LEU HG 3.600 . 5.300 4.682 1.880 5.394 0.094 4 0 "[ . 1 . 2]" 1
1127 1 31 TRP HB2 1 31 TRP HE1 3.600 . 5.300 4.806 4.729 5.284 . 0 0 "[ . 1 . 2]" 1
1128 1 31 TRP HE1 1 147 LYS HB2 2.800 . 3.800 3.159 2.203 3.826 0.026 18 0 "[ . 1 . 2]" 1
1129 1 31 TRP HE1 1 154 LYS HE3 3.200 . 6.000 5.513 4.196 6.355 0.355 13 0 "[ . 1 . 2]" 1
1130 1 99 VAL H 1 113 VAL MG2 3.100 . 4.300 3.569 3.180 3.967 . 0 0 "[ . 1 . 2]" 1
1131 1 53 TRP HE1 1 68 ILE HG12 1.900 . 2.400 2.330 1.869 2.562 0.162 20 0 "[ . 1 . 2]" 1
1132 1 102 VAL H 1 111 VAL MG1 3.900 . 5.800 5.133 4.814 5.293 . 0 0 "[ . 1 . 2]" 1
1133 1 67 LEU H 1 79 ILE MG 4.000 . 6.000 5.636 4.924 6.005 0.005 14 0 "[ . 1 . 2]" 1
1134 1 82 ARG H 1 83 LEU QD 4.300 . 6.000 4.959 4.338 5.400 . 0 0 "[ . 1 . 2]" 1
1135 1 81 TRP HE1 1 82 ARG H 3.700 . 5.400 4.615 3.858 5.406 0.006 16 0 "[ . 1 . 2]" 1
1136 1 5 PHE H 1 6 VAL H 3.400 . 4.800 4.256 4.004 4.346 . 0 0 "[ . 1 . 2]" 1
1137 1 6 VAL H 1 7 ARG H 3.500 . 5.100 4.366 4.129 4.548 . 0 0 "[ . 1 . 2]" 1
1138 1 78 VAL H 1 99 VAL H 3.400 . 4.800 4.641 4.159 4.873 0.073 20 0 "[ . 1 . 2]" 1
1139 1 6 VAL H 1 116 THR MG 3.400 . 4.800 4.112 2.567 5.117 0.317 18 0 "[ . 1 . 2]" 1
1140 1 130 ARG H 1 132 GLY H 3.500 . 5.000 4.630 4.109 5.078 0.078 20 0 "[ . 1 . 2]" 1
1141 1 14 ALA H 1 148 ILE MD 3.900 . 5.800 4.751 4.407 5.087 . 0 0 "[ . 1 . 2]" 1
1142 1 115 HIS H 1 116 THR H 3.600 . 5.300 4.144 3.841 4.484 . 0 0 "[ . 1 . 2]" 1
1143 1 8 HIS H 1 115 HIS H 3.800 . 6.000 5.115 4.539 6.073 0.073 9 0 "[ . 1 . 2]" 1
1144 1 146 ASP H 1 148 ILE H 3.100 . 4.300 3.928 3.787 4.048 . 0 0 "[ . 1 . 2]" 1
1145 1 70 LYS H 1 79 ILE MG 3.900 . 5.800 5.242 4.964 5.577 . 0 0 "[ . 1 . 2]" 1
1146 1 70 LYS H 1 80 GLY H 4.400 . 6.000 5.826 5.544 6.020 0.020 1 0 "[ . 1 . 2]" 1
1147 1 37 THR H 1 37 THR HB 3.200 . 4.500 3.298 2.578 3.621 . 0 0 "[ . 1 . 2]" 1
1148 1 36 ARG HD2 1 37 THR H 3.300 . 4.700 4.181 3.288 5.251 0.551 12 1 "[ . 1 + . 2]" 1
1149 1 37 THR H 1 38 THR MG 3.400 . 6.000 5.587 5.266 6.073 0.073 3 0 "[ . 1 . 2]" 1
1150 1 83 LEU QD 1 88 ARG H 3.400 . 4.800 2.523 1.845 4.036 0.155 10 0 "[ . 1 . 2]" 1
1151 1 88 ARG H 1 89 ILE MG 4.100 . 6.000 5.573 5.069 5.836 . 0 0 "[ . 1 . 2]" 1
1152 1 139 THR H 1 140 ILE QG 3.600 . 5.200 4.276 4.092 4.900 . 0 0 "[ . 1 . 2]" 1
1153 1 119 ASP H 1 121 MET H 3.300 . 4.700 3.907 3.560 4.314 . 0 0 "[ . 1 . 2]" 1
1154 1 80 GLY H 1 96 GLU HA 3.600 . 5.200 3.997 3.532 4.404 . 0 0 "[ . 1 . 2]" 1
1155 1 69 ARG QD 1 80 GLY H 3.000 . 4.100 3.386 2.895 4.037 . 0 0 "[ . 1 . 2]" 1
1156 1 148 ILE MG 1 152 GLY H 2.400 . 6.000 4.183 3.496 5.134 . 0 0 "[ . 1 . 2]" 1
1157 1 24 LEU H 1 26 GLY H 3.100 . 4.300 3.485 3.136 3.846 . 0 0 "[ . 1 . 2]" 1
1158 1 136 GLY H 1 139 THR H 3.300 . 4.700 4.532 3.929 4.874 0.174 2 0 "[ . 1 . 2]" 1
1159 1 136 GLY H 1 139 THR MG 3.800 . 6.000 5.976 5.535 6.171 0.171 9 0 "[ . 1 . 2]" 1
1160 1 136 GLY H 1 140 ILE MD 3.900 . 6.000 5.362 4.794 5.824 . 0 0 "[ . 1 . 2]" 1
1161 1 86 PHE HA 1 87 GLY H 2.800 . 3.800 3.111 2.101 3.582 . 0 0 "[ . 1 . 2]" 1
1162 1 30 TRP HA 1 32 PRO HD2 3.900 . 5.800 3.724 3.149 4.527 . 0 0 "[ . 1 . 2]" 1
1163 1 92 ASP H 1 92 ASP HA 2.700 . 3.600 2.382 2.245 2.888 . 0 0 "[ . 1 . 2]" 1
1164 1 92 ASP HA 1 92 ASP QB 2.800 . 3.800 2.327 2.155 2.451 . 0 0 "[ . 1 . 2]" 1
1165 1 104 ASP HA 1 105 GLY H 2.700 . 3.600 2.159 2.120 2.237 . 0 0 "[ . 1 . 2]" 1
1166 1 104 ASP HA 1 104 ASP QB 2.600 . 3.500 2.407 2.295 2.485 . 0 0 "[ . 1 . 2]" 1
1167 1 104 ASP HA 1 108 LYS HB3 3.600 . 5.200 4.417 4.168 4.613 . 0 0 "[ . 1 . 2]" 1
1168 1 1 ASN HA 1 2 TYR H 2.500 . 3.300 2.263 2.093 2.648 . 0 0 "[ . 1 . 2]" 1
1169 1 1 ASN HA 1 1 ASN QB 2.600 . 3.400 2.202 2.180 2.376 . 0 0 "[ . 1 . 2]" 1
1170 1 15 ASP HA 1 104 ASP QB 3.000 . 6.000 5.236 4.622 5.678 . 0 0 "[ . 1 . 2]" 1
1171 1 15 ASP HA 1 109 THR MG 3.500 . 5.000 4.612 4.372 4.799 . 0 0 "[ . 1 . 2]" 1
1172 1 88 ARG HA 1 88 ARG HB3 2.800 . 3.800 2.733 2.276 3.022 . 0 0 "[ . 1 . 2]" 1
1173 1 88 ARG HA 1 89 ILE H 2.600 . 3.400 2.517 2.241 2.717 . 0 0 "[ . 1 . 2]" 1
1174 1 88 ARG H 1 88 ARG HA 2.800 . 3.800 2.920 2.881 2.943 . 0 0 "[ . 1 . 2]" 1
1175 1 15 ASP HA 1 148 ILE MG 3.700 . 6.000 5.956 5.414 6.092 0.092 19 0 "[ . 1 . 2]" 1
1176 1 24 LEU HB2 1 25 GLU HA 3.700 . 5.400 5.482 5.365 5.637 0.237 12 0 "[ . 1 . 2]" 1
1177 1 25 GLU H 1 25 GLU HA 2.700 . 3.600 2.901 2.867 2.948 . 0 0 "[ . 1 . 2]" 1
1178 1 25 GLU HA 1 26 GLY H 2.600 . 3.400 3.318 2.888 3.514 0.114 16 0 "[ . 1 . 2]" 1
1179 1 25 GLU HA 1 25 GLU QG 3.200 . 4.500 2.417 2.298 2.533 . 0 0 "[ . 1 . 2]" 1
1180 1 125 HIS HA 1 128 ARG HB2 3.500 . 5.000 2.467 2.042 3.054 . 0 0 "[ . 1 . 2]" 1
1181 1 125 HIS HA 1 129 VAL QG 3.200 . 4.500 3.916 3.493 4.321 . 0 0 "[ . 1 . 2]" 1
1182 1 70 LYS HA 1 70 LYS HB3 3.000 . 4.100 3.015 2.999 3.024 . 0 0 "[ . 1 . 2]" 1
1183 1 59 GLN H 1 59 GLN HA 2.800 . 3.800 2.902 2.858 2.938 . 0 0 "[ . 1 . 2]" 1
1184 1 59 GLN HA 1 59 GLN HB3 3.100 . 4.300 2.517 2.288 2.834 . 0 0 "[ . 1 . 2]" 1
1185 1 39 LYS HA 1 39 LYS HG3 2.900 . 4.000 3.050 2.491 3.656 . 0 0 "[ . 1 . 2]" 1
1186 1 39 LYS HA 1 40 VAL QG 3.200 . 4.500 3.676 2.999 4.393 . 0 0 "[ . 1 . 2]" 1
1187 1 39 LYS HA 1 39 LYS QE 3.500 . 5.100 4.513 3.654 5.168 0.068 9 0 "[ . 1 . 2]" 1
1188 1 39 LYS HA 1 40 VAL H 3.100 . 4.300 3.132 2.190 3.574 . 0 0 "[ . 1 . 2]" 1
1189 1 39 LYS HA 1 39 LYS HG2 2.900 . 4.000 2.813 2.200 4.011 0.011 9 0 "[ . 1 . 2]" 1
1190 1 13 LYS H 1 149 ASP HA 3.300 . 4.600 4.329 3.738 4.621 0.021 10 0 "[ . 1 . 2]" 1
1191 1 149 ASP H 1 149 ASP HA 2.700 . 3.600 2.812 2.785 2.841 . 0 0 "[ . 1 . 2]" 1
1192 1 149 ASP HA 1 154 LYS HE2 3.600 . 5.200 4.791 4.225 6.157 0.957 3 3 "[ + . 1 -* . 2]" 1
1193 1 149 ASP HA 1 150 GLU H 2.800 . 3.800 3.488 3.434 3.523 . 0 0 "[ . 1 . 2]" 1
1194 1 148 ILE H 1 149 ASP HA 3.600 . 6.000 5.195 5.001 5.317 . 0 0 "[ . 1 . 2]" 1
1195 1 13 LYS HB3 1 149 ASP HA 3.700 . 5.400 4.503 3.351 5.409 0.009 11 0 "[ . 1 . 2]" 1
1196 1 148 ILE MG 1 149 ASP HA 2.700 . 3.600 3.403 3.072 3.630 0.030 6 0 "[ . 1 . 2]" 1
1197 1 70 LYS HA 1 71 VAL H 2.600 . 3.400 2.158 2.119 2.206 . 0 0 "[ . 1 . 2]" 1
1198 1 70 LYS HA 1 70 LYS HG2 3.200 . 4.500 3.287 3.117 3.495 . 0 0 "[ . 1 . 2]" 1
1199 1 70 LYS HA 1 70 LYS HG3 2.600 . 3.500 2.694 2.500 2.852 . 0 0 "[ . 1 . 2]" 1
1200 1 152 GLY H 1 153 ALA HA 3.500 . 5.000 4.880 4.691 5.060 0.060 19 0 "[ . 1 . 2]" 1
1201 1 71 VAL HA 1 71 VAL HB 2.800 . 3.800 2.968 2.579 3.039 . 0 0 "[ . 1 . 2]" 1
1202 1 102 VAL H 1 102 VAL HA 2.700 . 3.600 2.920 2.907 2.929 . 0 0 "[ . 1 . 2]" 1
1203 1 102 VAL HA 1 102 VAL HB 2.800 . 3.800 3.026 3.025 3.028 . 0 0 "[ . 1 . 2]" 1
1204 1 102 VAL HA 1 103 ALA MB 4.000 . 6.000 4.009 3.978 4.037 . 0 0 "[ . 1 . 2]" 1
1205 1 6 VAL HA 1 7 ARG H 2.400 . 3.100 2.166 2.105 2.265 . 0 0 "[ . 1 . 2]" 1
1206 1 31 TRP HD1 1 143 SER HA 2.800 . 3.800 3.781 3.290 3.940 0.140 5 0 "[ . 1 . 2]" 1
1207 1 6 VAL HA 1 6 VAL QG 2.700 . 3.600 2.271 2.119 2.581 . 0 0 "[ . 1 . 2]" 1
1208 1 71 VAL HA 1 71 VAL QG 2.700 . 3.600 2.157 2.132 2.217 . 0 0 "[ . 1 . 2]" 1
1209 1 101 PHE HA 1 102 VAL HA 3.200 . 4.500 4.406 4.390 4.414 . 0 0 "[ . 1 . 2]" 1
1210 1 146 ASP H 1 146 ASP HA 2.800 . 3.800 2.843 2.782 2.868 . 0 0 "[ . 1 . 2]" 1
1211 1 146 ASP HA 1 147 LYS HB3 3.600 . 6.000 5.919 5.747 6.274 0.274 12 0 "[ . 1 . 2]" 1
1212 1 16 ARG HD3 1 102 VAL HA 3.000 . 4.100 3.863 3.648 4.068 . 0 0 "[ . 1 . 2]" 1
1213 1 102 VAL HA 1 102 VAL QG 2.800 . 3.800 2.136 2.125 2.144 . 0 0 "[ . 1 . 2]" 1
1214 1 102 VAL HA 1 103 ALA H 2.600 . 3.400 2.142 2.127 2.160 . 0 0 "[ . 1 . 2]" 1
1215 1 146 ASP HA 1 149 ASP H 2.800 . 3.800 3.299 2.961 3.791 . 0 0 "[ . 1 . 2]" 1
1216 1 139 THR HB 1 140 ILE H 2.700 . 3.600 2.581 2.371 2.742 . 0 0 "[ . 1 . 2]" 1
1217 1 136 GLY QA 1 139 THR HB 3.500 . 5.000 2.940 2.307 3.737 . 0 0 "[ . 1 . 2]" 1
1218 1 61 GLU HA 1 62 GLU H 2.500 . 3.300 2.785 2.334 3.209 . 0 0 "[ . 1 . 2]" 1
1219 1 61 GLU HA 1 61 GLU QB 2.600 . 3.400 2.365 2.143 2.461 . 0 0 "[ . 1 . 2]" 1
1220 1 61 GLU HA 1 62 GLU QB 3.500 . 5.100 4.742 4.393 5.029 . 0 0 "[ . 1 . 2]" 1
1221 1 56 ILE MG 1 61 GLU HA 3.200 . 4.500 3.415 2.776 4.071 . 0 0 "[ . 1 . 2]" 1
1222 1 119 ASP H 1 119 ASP HA 2.800 . 3.800 2.834 2.759 2.870 . 0 0 "[ . 1 . 2]" 1
1223 1 119 ASP HA 1 119 ASP QB 2.800 . 3.800 2.240 2.156 2.430 . 0 0 "[ . 1 . 2]" 1
1224 1 50 GLY H 1 50 GLY HA2 3.000 . 4.100 2.920 2.876 2.960 . 0 0 "[ . 1 . 2]" 1
1225 1 50 GLY HA2 1 51 GLY H 3.400 . 4.800 3.501 3.433 3.561 . 0 0 "[ . 1 . 2]" 1
1226 1 41 GLY QA 1 55 GLU HB3 3.300 . 6.000 5.067 3.595 5.571 . 0 0 "[ . 1 . 2]" 1
1227 1 49 LYS QG 1 50 GLY HA2 4.000 . 6.000 3.647 3.121 4.121 . 0 0 "[ . 1 . 2]" 1
1228 1 120 ARG HA 1 120 ARG QB 2.900 . 3.900 2.338 2.173 2.445 . 0 0 "[ . 1 . 2]" 1
1229 1 150 GLU H 1 150 GLU HA 2.600 . 3.400 2.838 2.809 2.857 . 0 0 "[ . 1 . 2]" 1
1230 1 142 GLN HA 1 143 SER HB2 3.600 . 6.000 5.893 5.728 6.392 0.392 17 0 "[ . 1 . 2]" 1
1231 1 141 LEU QD 1 142 GLN HA 2.200 . 6.000 5.164 5.059 5.278 . 0 0 "[ . 1 . 2]" 1
1232 1 139 THR HA 1 139 THR MG 2.900 . 4.000 2.394 2.300 2.586 . 0 0 "[ . 1 . 2]" 1
1233 1 152 GLY QA 1 155 LYS QE 3.000 . 6.000 5.589 4.427 6.114 0.114 13 0 "[ . 1 . 2]" 1
1234 1 152 GLY QA 1 153 ALA MB 3.200 . 4.500 3.562 3.418 3.985 . 0 0 "[ . 1 . 2]" 1
1235 1 126 ALA H 1 126 ALA HA 2.800 . 3.800 2.834 2.789 2.872 . 0 0 "[ . 1 . 2]" 1
1236 1 148 ILE HA 1 151 GLU H 3.000 . 4.100 3.167 2.908 3.467 . 0 0 "[ . 1 . 2]" 1
1237 1 148 ILE H 1 148 ILE HA 2.500 . 3.300 2.827 2.794 2.880 . 0 0 "[ . 1 . 2]" 1
1238 1 148 ILE HA 1 149 ASP HA 3.000 . 6.000 4.808 4.738 4.862 . 0 0 "[ . 1 . 2]" 1
1239 1 147 LYS HA 1 148 ILE HA 3.000 . 6.000 4.776 4.704 4.848 . 0 0 "[ . 1 . 2]" 1
1240 1 148 ILE HA 1 151 GLU HB3 3.800 . 5.600 4.213 1.886 4.821 0.114 5 0 "[ . 1 . 2]" 1
1241 1 148 ILE HA 1 148 ILE HB 2.600 . 3.500 3.018 3.001 3.027 . 0 0 "[ . 1 . 2]" 1
1242 1 14 ALA MB 1 148 ILE HA 3.300 . 4.600 3.995 3.386 4.497 . 0 0 "[ . 1 . 2]" 1
1243 1 148 ILE HA 1 148 ILE MG 2.500 . 3.300 2.473 2.385 2.609 . 0 0 "[ . 1 . 2]" 1
1244 1 68 ILE HA 1 69 ARG H 2.200 . 2.800 2.121 2.057 2.198 . 0 0 "[ . 1 . 2]" 1
1245 1 68 ILE H 1 68 ILE HA 2.400 . 3.100 2.883 2.857 2.920 . 0 0 "[ . 1 . 2]" 1
1246 1 148 ILE HA 1 150 GLU H 3.000 . 4.100 3.988 3.683 4.190 0.090 5 0 "[ . 1 . 2]" 1
1247 1 68 ILE HA 1 79 ILE HA 2.000 . 2.500 2.029 1.792 2.376 . 0 0 "[ . 1 . 2]" 1
1248 1 68 ILE HA 1 69 ARG QD 3.400 . 4.900 4.040 3.179 4.803 . 0 0 "[ . 1 . 2]" 1
1249 1 148 ILE HA 1 151 GLU QG 2.400 . 3.100 2.405 1.939 2.814 . 0 0 "[ . 1 . 2]" 1
1250 1 68 ILE HA 1 79 ILE MG 3.400 . 4.800 4.157 3.729 4.453 . 0 0 "[ . 1 . 2]" 1
1251 1 88 ARG HB3 1 88 ARG QD 3.100 . 4.300 2.674 2.236 3.488 . 0 0 "[ . 1 . 2]" 1
1252 1 88 ARG HB2 1 88 ARG QD 2.800 . 3.800 2.935 2.226 3.432 . 0 0 "[ . 1 . 2]" 1
1253 1 88 ARG QD 1 89 ILE H 2.900 . 3.900 3.346 1.531 3.925 0.369 18 0 "[ . 1 . 2]" 1
1254 1 88 ARG QD 1 129 VAL HA 3.000 . 6.000 5.115 2.255 6.107 0.107 16 0 "[ . 1 . 2]" 1
1255 1 128 ARG H 1 128 ARG HD2 3.300 . 4.700 3.967 2.958 4.759 0.059 10 0 "[ . 1 . 2]" 1
1256 1 125 HIS H 1 128 ARG HD2 3.200 . 6.000 4.959 4.077 6.247 0.247 8 0 "[ . 1 . 2]" 1
1257 1 11 THR H 1 110 ARG HD2 2.900 . 6.000 5.028 3.880 6.045 0.045 18 0 "[ . 1 . 2]" 1
1258 1 67 LEU QD 1 69 ARG QD 3.200 . 4.300 2.987 1.946 4.033 0.054 2 0 "[ . 1 . 2]" 1
1259 1 72 ASP H 1 72 ASP HB2 2.400 . 3.100 2.565 2.382 2.728 . 0 0 "[ . 1 . 2]" 1
1260 1 72 ASP HB2 1 73 GLU H 3.400 . 4.900 4.601 4.347 4.655 . 0 0 "[ . 1 . 2]" 1
1261 1 72 ASP HB2 1 76 THR H 3.000 . 4.100 3.742 2.245 4.025 . 0 0 "[ . 1 . 2]" 1
1262 1 72 ASP HA 1 72 ASP HB2 2.900 . 4.000 2.739 2.578 3.020 . 0 0 "[ . 1 . 2]" 1
1263 1 72 ASP HB2 1 76 THR HB 2.900 . 4.000 3.998 3.349 4.153 0.153 6 0 "[ . 1 . 2]" 1
1264 1 1 ASN HB2 1 7 ARG HB3 3.500 . 5.000 5.120 3.927 5.894 0.894 13 4 "[ * . *1 + . - 2]" 1
1265 1 27 PHE H 1 27 PHE HB2 2.300 . 3.000 2.370 2.106 2.684 . 0 0 "[ . 1 . 2]" 1
1266 1 118 PHE QB 1 118 PHE QD 2.700 . 3.600 2.131 2.109 2.183 . 0 0 "[ . 1 . 2]" 1
1267 1 118 PHE HA 1 118 PHE QB 3.000 . 4.100 2.353 2.155 2.505 . 0 0 "[ . 1 . 2]" 1
1268 1 125 HIS H 1 128 ARG HD3 3.500 . 6.000 5.287 4.342 6.209 0.209 10 0 "[ . 1 . 2]" 1
1269 1 86 PHE HB3 1 86 PHE QD 2.800 . 3.800 2.345 2.268 2.685 . 0 0 "[ . 1 . 2]" 1
1270 1 33 ASN HB3 1 34 ASN H 2.600 . 3.500 3.112 2.526 3.530 0.030 8 0 "[ . 1 . 2]" 1
1271 1 33 ASN HB3 1 34 ASN HD21 2.900 . 6.000 5.801 4.864 6.438 0.438 20 0 "[ . 1 . 2]" 1
1272 1 33 ASN HB3 1 84 ASN QD 3.400 . 4.800 3.080 2.342 3.568 . 0 0 "[ . 1 . 2]" 1
1273 1 33 ASN HB3 1 140 ILE HA 3.900 . 5.800 4.865 4.155 5.596 . 0 0 "[ . 1 . 2]" 1
1274 1 146 ASP HB3 1 147 LYS H 2.700 . 3.600 2.621 2.298 3.454 . 0 0 "[ . 1 . 2]" 1
1275 1 149 ASP QB 1 150 GLU HA 3.100 . 4.300 4.123 3.980 4.288 . 0 0 "[ . 1 . 2]" 1
1276 1 149 ASP QB 1 150 GLU QG 2.900 . 3.900 3.386 3.082 3.720 . 0 0 "[ . 1 . 2]" 1
1277 1 149 ASP QB 1 150 GLU HB3 3.300 . 4.600 3.358 3.065 3.680 . 0 0 "[ . 1 . 2]" 1
1278 1 149 ASP H 1 149 ASP QB 2.700 . 3.300 2.224 2.174 2.270 . 0 0 "[ . 1 . 2]" 1
1279 1 149 ASP QB 1 150 GLU H 2.500 . 3.300 2.731 2.549 2.884 . 0 0 "[ . 1 . 2]" 1
1280 1 149 ASP QB 1 154 LYS QD 3.400 . 4.800 3.869 3.326 4.365 . 0 0 "[ . 1 . 2]" 1
1281 1 13 LYS QG 1 149 ASP QB 3.700 . 5.400 2.920 2.496 3.576 . 0 0 "[ . 1 . 2]" 1
1282 1 148 ILE MG 1 149 ASP QB 3.500 . 6.000 4.289 3.852 4.565 . 0 0 "[ . 1 . 2]" 1
1283 1 146 ASP H 1 149 ASP QB 2.200 . 6.000 4.549 4.233 4.836 . 0 0 "[ . 1 . 2]" 1
1284 1 148 ILE H 1 149 ASP QB 3.500 . 5.000 4.317 4.145 4.459 . 0 0 "[ . 1 . 2]" 1
1285 1 33 ASN HB2 1 34 ASN H 3.300 . 4.700 4.096 3.693 4.286 . 0 0 "[ . 1 . 2]" 1
1286 1 33 ASN HB2 1 139 THR H 3.200 . 6.000 5.993 5.613 6.193 0.193 9 0 "[ . 1 . 2]" 1
1287 1 33 ASN HB2 1 136 GLY QA 2.800 . 3.700 2.907 2.456 3.381 . 0 0 "[ . 1 . 2]" 1
1288 1 59 GLN H 1 59 GLN HG2 3.300 . 4.700 3.434 2.308 4.369 . 0 0 "[ . 1 . 2]" 1
1289 1 59 GLN HA 1 59 GLN HG2 3.200 . 4.500 3.642 3.098 4.262 . 0 0 "[ . 1 . 2]" 1
1290 1 58 GLU H 1 58 GLU HG3 3.300 . 4.600 3.010 1.998 3.366 0.002 8 0 "[ . 1 . 2]" 1
1291 1 72 ASP H 1 72 ASP HB3 3.500 . 5.100 3.064 2.685 3.691 . 0 0 "[ . 1 . 2]" 1
1292 1 72 ASP HB3 1 73 GLU H 3.300 . 4.600 4.307 4.196 4.363 . 0 0 "[ . 1 . 2]" 1
1293 1 72 ASP HA 1 72 ASP HB3 2.800 . 3.800 2.901 2.450 3.007 . 0 0 "[ . 1 . 2]" 1
1294 1 72 ASP HB3 1 77 LEU QD 3.400 . 6.000 4.547 3.142 5.168 . 0 0 "[ . 1 . 2]" 1
1295 1 72 ASP HB3 1 76 THR H 2.700 . 3.600 2.560 2.078 3.319 . 0 0 "[ . 1 . 2]" 1
1296 1 71 VAL HA 1 72 ASP HB3 4.400 . 6.000 5.248 4.950 5.778 . 0 0 "[ . 1 . 2]" 1
1297 1 57 ASP HA 1 58 GLU HG3 4.200 . 6.000 5.498 4.821 6.014 0.014 15 0 "[ . 1 . 2]" 1
1298 1 58 GLU HG3 1 59 GLN QE 3.300 . 6.000 3.983 2.803 5.555 . 0 0 "[ . 1 . 2]" 1
1299 1 148 ILE H 1 150 GLU QG 3.100 . 6.000 5.069 4.840 5.501 . 0 0 "[ . 1 . 2]" 1
1300 1 59 GLN QE 1 59 GLN HG3 3.200 . 4.500 2.928 2.145 3.274 . 0 0 "[ . 1 . 2]" 1
1301 1 145 GLN HA 1 145 GLN HG3 2.800 . 3.800 2.745 2.162 3.062 . 0 0 "[ . 1 . 2]" 1
1302 1 10 VAL QG 1 145 GLN HG3 2.800 . 3.800 2.418 1.977 3.238 . 0 0 "[ . 1 . 2]" 1
1303 1 12 VAL QG 1 145 GLN HG3 3.200 . 4.400 3.950 3.129 4.467 0.067 9 0 "[ . 1 . 2]" 1
1304 1 141 LEU HB3 1 145 GLN HG3 3.500 . 6.000 4.445 3.852 5.897 . 0 0 "[ . 1 . 2]" 1
1305 1 58 GLU HG2 1 59 GLN HA 3.600 . 5.200 5.166 4.813 5.776 0.576 8 1 "[ . + 1 . 2]" 1
1306 1 21 LYS HG2 1 151 GLU QG 2.200 . 6.000 5.268 4.206 5.828 . 0 0 "[ . 1 . 2]" 1
1307 1 29 GLU HG3 1 30 TRP H 2.500 . 3.300 3.275 3.012 3.433 0.133 3 0 "[ . 1 . 2]" 1
1308 1 29 GLU QG 1 30 TRP HA 2.900 . 4.000 3.278 3.013 3.879 . 0 0 "[ . 1 . 2]" 1
1309 1 29 GLU QG 1 30 TRP H 2.600 . 3.500 2.989 2.776 3.158 . 0 0 "[ . 1 . 2]" 1
1310 1 29 GLU H 1 29 GLU QG 3.000 . 4.100 2.338 2.162 2.665 . 0 0 "[ . 1 . 2]" 1
1311 1 29 GLU QG 1 32 PRO HD2 3.800 . 6.000 6.084 5.963 6.255 0.255 13 0 "[ . 1 . 2]" 1
1312 1 26 GLY HA2 1 29 GLU QG 2.700 . 3.600 2.978 2.438 3.285 . 0 0 "[ . 1 . 2]" 1
1313 1 28 PRO QD 1 29 GLU QG 2.700 . 6.000 3.757 3.142 4.449 . 0 0 "[ . 1 . 2]" 1
1314 1 29 GLU QG 1 147 LYS HB3 3.100 . 6.000 5.214 4.101 6.085 0.085 16 0 "[ . 1 . 2]" 1
1315 1 150 GLU HA 1 150 GLU QB 2.600 . 3.400 2.382 2.341 2.489 . 0 0 "[ . 1 . 2]" 1
1316 1 149 ASP QB 1 150 GLU QB 3.600 . 5.200 4.577 4.271 4.779 . 0 0 "[ . 1 . 2]" 1
1317 1 61 GLU H 1 61 GLU QG 3.100 . 4.300 2.985 2.534 3.734 . 0 0 "[ . 1 . 2]" 1
1318 1 10 VAL HB 1 141 LEU QD 3.200 . 4.500 3.659 3.250 4.418 . 0 0 "[ . 1 . 2]" 1
1319 1 10 VAL HB 1 19 ALA MB 3.000 . 6.000 5.929 5.418 6.364 0.364 15 0 "[ . 1 . 2]" 1
1320 1 52 ARG HG3 1 54 TYR QB 3.300 . 4.700 4.179 3.418 5.419 0.719 9 3 "[ - . +1 * . 2]" 1
1321 1 21 LYS H 1 21 LYS HB3 2.500 . 3.300 2.392 2.070 2.644 . 0 0 "[ . 1 . 2]" 1
1322 1 40 VAL HA 1 40 VAL HB 2.700 . 3.600 2.556 2.366 3.035 . 0 0 "[ . 1 . 2]" 1
1323 1 107 LYS QB 1 107 LYS QE 3.300 . 4.700 3.074 1.797 3.850 0.103 2 0 "[ . 1 . 2]" 1
1324 1 15 ASP H 1 107 LYS QB 3.200 . 4.500 3.962 3.305 4.329 . 0 0 "[ . 1 . 2]" 1
1325 1 114 GLU H 1 114 GLU HB3 2.800 . 3.800 3.014 2.397 3.745 . 0 0 "[ . 1 . 2]" 1
1326 1 114 GLU HB3 1 115 HIS HB2 3.500 . 6.000 5.915 5.527 6.682 0.682 15 1 "[ . 1 + 2]" 1
1327 1 114 GLU HA 1 114 GLU HB3 2.900 . 4.000 2.802 2.430 3.028 . 0 0 "[ . 1 . 2]" 1
1328 1 102 VAL H 1 102 VAL HB 2.600 . 3.400 2.557 2.522 2.607 . 0 0 "[ . 1 . 2]" 1
1329 1 12 VAL HB 1 13 LYS H 3.100 . 4.300 4.025 2.368 4.343 0.043 18 0 "[ . 1 . 2]" 1
1330 1 20 PHE QD 1 21 LYS HB3 3.400 . 4.800 4.847 4.284 5.315 0.515 18 1 "[ . 1 . + 2]" 1
1331 1 135 LYS HB3 1 138 PRO QG 3.400 . 6.000 5.281 3.865 6.020 0.020 16 0 "[ . 1 . 2]" 1
1332 1 154 LYS HB2 1 154 LYS HE2 2.500 . 3.300 2.497 1.883 4.199 0.899 13 1 "[ . 1 + . 2]" 1
1333 1 135 LYS H 1 135 LYS HB3 2.800 . 3.800 3.077 2.527 3.702 . 0 0 "[ . 1 . 2]" 1
1334 1 49 LYS HB2 1 51 GLY H 3.900 . 5.800 5.656 5.412 6.023 0.223 7 0 "[ . 1 . 2]" 1
1335 1 49 LYS HB2 1 50 GLY H 3.000 . 4.100 3.700 3.498 3.933 . 0 0 "[ . 1 . 2]" 1
1336 1 16 ARG QB 1 103 ALA HA 2.800 . 3.800 2.945 2.468 3.178 . 0 0 "[ . 1 . 2]" 1
1337 1 46 VAL HA 1 53 TRP HB3 4.100 . 6.000 3.947 2.731 4.174 . 0 0 "[ . 1 . 2]" 1
1338 1 15 ASP HB3 1 16 ARG HB3 3.500 . 6.000 5.549 5.066 5.779 . 0 0 "[ . 1 . 2]" 1
1339 1 155 LYS HA 1 155 LYS HB3 2.700 . 3.600 2.511 2.353 3.032 . 0 0 "[ . 1 . 2]" 1
1340 1 155 LYS HB3 1 155 LYS HD3 2.900 . 3.900 3.122 2.499 4.188 0.288 18 0 "[ . 1 . 2]" 1
1341 1 155 LYS H 1 155 LYS HB3 2.900 . 4.000 3.415 2.580 4.120 0.120 10 0 "[ . 1 . 2]" 1
1342 1 155 LYS HB3 1 155 LYS QE 3.300 . 4.700 3.752 1.885 4.472 0.015 20 0 "[ . 1 . 2]" 1
1343 1 108 LYS H 1 108 LYS HB3 2.500 . 3.300 2.789 2.609 3.328 0.028 19 0 "[ . 1 . 2]" 1
1344 1 108 LYS HB3 1 109 THR H 3.300 . 4.700 3.671 2.910 4.012 . 0 0 "[ . 1 . 2]" 1
1345 1 108 LYS HB3 1 108 LYS QE 3.100 . 4.300 3.562 2.061 4.247 . 0 0 "[ . 1 . 2]" 1
1346 1 79 ILE HA 1 96 GLU QB 3.100 . 6.000 5.360 4.657 5.802 . 0 0 "[ . 1 . 2]" 1
1347 1 78 VAL QG 1 96 GLU QB 3.300 . 4.600 3.360 2.151 4.081 . 0 0 "[ . 1 . 2]" 1
1348 1 154 LYS HA 1 154 LYS HB3 2.900 . 4.000 3.021 2.972 3.033 . 0 0 "[ . 1 . 2]" 1
1349 1 150 GLU QG 1 154 LYS HB3 3.100 . 4.300 2.933 2.175 4.156 . 0 0 "[ . 1 . 2]" 1
1350 1 150 GLU QB 1 154 LYS HB3 3.400 . 4.900 3.747 3.173 4.900 . 0 0 "[ . 1 . 2]" 1
1351 1 17 LYS HA 1 17 LYS HB2 2.700 . 3.600 2.725 2.382 3.025 . 0 0 "[ . 1 . 2]" 1
1352 1 17 LYS HB2 1 17 LYS HE3 3.400 . 4.800 4.038 1.666 5.493 0.693 11 1 "[ . 1+ . 2]" 1
1353 1 154 LYS HB3 1 155 LYS QE 3.400 . 6.000 5.268 3.686 6.079 0.079 7 0 "[ . 1 . 2]" 1
1354 1 154 LYS HB3 1 154 LYS HG3 2.800 . 3.800 2.855 2.473 3.016 . 0 0 "[ . 1 . 2]" 1
1355 1 39 LYS QB 1 39 LYS HE2 3.400 . 4.900 3.689 1.885 4.467 0.015 3 0 "[ . 1 . 2]" 1
1356 1 12 VAL QG 1 148 ILE HB 3.100 . 4.300 3.255 2.391 3.673 . 0 0 "[ . 1 . 2]" 1
1357 1 148 ILE H 1 148 ILE HB 2.500 . 3.300 2.421 2.329 2.535 . 0 0 "[ . 1 . 2]" 1
1358 1 148 ILE HB 1 148 ILE MG 2.400 . 3.100 2.126 2.119 2.133 . 0 0 "[ . 1 . 2]" 1
1359 1 155 LYS H 1 155 LYS HB2 3.000 . 4.100 3.291 2.503 3.986 . 0 0 "[ . 1 . 2]" 1
1360 1 155 LYS HA 1 155 LYS HB2 3.000 . 4.100 2.761 2.428 3.036 . 0 0 "[ . 1 . 2]" 1
1361 1 155 LYS HB2 1 155 LYS HG2 3.000 . 4.200 2.825 2.391 3.014 . 0 0 "[ . 1 . 2]" 1
1362 1 155 LYS HB2 1 155 LYS QE 3.400 . 4.800 3.593 2.005 4.491 . 0 0 "[ . 1 . 2]" 1
1363 1 128 ARG H 1 128 ARG HG2 3.400 . 4.900 2.196 1.863 2.538 0.037 5 0 "[ . 1 . 2]" 1
1364 1 154 LYS HD2 1 155 LYS HA 3.000 . 6.000 5.646 4.418 6.400 0.400 4 0 "[ . 1 . 2]" 1
1365 1 24 LEU HG 1 48 LYS QE 2.600 . 6.000 3.223 1.852 4.267 . 0 0 "[ . 1 . 2]" 1
1366 1 24 LEU H 1 24 LEU HG 3.400 . 4.900 4.606 4.551 4.674 . 0 0 "[ . 1 . 2]" 1
1367 1 13 LYS QG 1 154 LYS HE2 3.800 . 6.000 5.736 5.132 6.704 0.704 3 1 "[ + . 1 . 2]" 1
1368 1 39 LYS H 1 42 ALA MB 3.300 . 4.700 3.919 3.327 4.396 . 0 0 "[ . 1 . 2]" 1
1369 1 42 ALA H 1 42 ALA MB 2.500 . 3.300 2.336 2.235 3.099 . 0 0 "[ . 1 . 2]" 1
1370 1 42 ALA MB 1 55 GLU HA 3.300 . 4.600 3.136 2.752 3.552 . 0 0 "[ . 1 . 2]" 1
1371 1 42 ALA MB 1 55 GLU HG2 3.300 . 4.700 2.944 2.486 3.721 . 0 0 "[ . 1 . 2]" 1
1372 1 19 ALA H 1 19 ALA MB 2.600 . 3.400 2.247 2.226 2.273 . 0 0 "[ . 1 . 2]" 1
1373 1 19 ALA MB 1 20 PHE H 2.500 . 3.300 2.417 2.297 2.588 . 0 0 "[ . 1 . 2]" 1
1374 1 18 THR H 1 19 ALA MB 3.600 . 5.200 4.190 4.071 4.312 . 0 0 "[ . 1 . 2]" 1
1375 1 8 HIS HE1 1 19 ALA MB 3.000 . 6.000 6.055 5.846 6.123 0.123 6 0 "[ . 1 . 2]" 1
1376 1 12 VAL QG 1 19 ALA MB 2.800 . 3.800 1.674 1.466 1.886 0.334 15 0 "[ . 1 . 2]" 1
1377 1 19 ALA MB 1 101 PHE HA 3.400 . 4.900 4.818 4.621 4.946 0.046 9 0 "[ . 1 . 2]" 1
1378 1 19 ALA MB 1 109 THR HB 2.800 . 3.800 2.945 2.765 3.174 . 0 0 "[ . 1 . 2]" 1
1379 1 19 ALA MB 1 20 PHE HB2 3.300 . 4.700 4.016 3.916 4.236 . 0 0 "[ . 1 . 2]" 1
1380 1 12 VAL HB 1 19 ALA MB 3.000 . 4.100 3.015 2.692 3.931 . 0 0 "[ . 1 . 2]" 1
1381 1 21 LYS HG3 1 24 LEU H 3.100 . 6.000 5.649 5.374 6.065 0.065 8 0 "[ . 1 . 2]" 1
1382 1 152 GLY H 1 153 ALA MB 3.600 . 5.200 4.785 3.954 5.042 . 0 0 "[ . 1 . 2]" 1
1383 1 153 ALA H 1 153 ALA MB 3.000 . 4.100 2.691 2.251 2.984 . 0 0 "[ . 1 . 2]" 1
1384 1 150 GLU HA 1 153 ALA MB 3.500 . 6.000 5.613 5.003 5.993 . 0 0 "[ . 1 . 2]" 1
1385 1 73 GLU H 1 73 GLU QG 3.200 . 4.400 3.382 2.514 3.647 . 0 0 "[ . 1 . 2]" 1
1386 1 73 GLU QG 1 74 PRO HD2 2.800 . 3.700 2.870 2.641 3.510 . 0 0 "[ . 1 . 2]" 1
1387 1 49 LYS H 1 49 LYS QG 3.000 . 4.100 2.534 1.751 3.911 0.149 15 0 "[ . 1 . 2]" 1
1388 1 107 LYS QE 1 107 LYS QG 3.000 . 4.100 2.329 2.073 2.765 . 0 0 "[ . 1 . 2]" 1
1389 1 108 LYS HA 1 108 LYS QG 2.800 . 3.800 2.439 2.273 2.599 . 0 0 "[ . 1 . 2]" 1
1390 1 107 LYS HA 1 107 LYS QG 3.200 . 4.300 2.852 2.271 3.390 . 0 0 "[ . 1 . 2]" 1
1391 1 105 GLY QA 1 107 LYS QG 2.800 . 6.000 4.885 3.948 5.530 . 0 0 "[ . 1 . 2]" 1
1392 1 70 LYS HG2 1 71 VAL H 3.200 . 4.500 3.622 3.267 4.006 . 0 0 "[ . 1 . 2]" 1
1393 1 1 ASN HD21 1 6 VAL QG 2.700 . 3.600 2.516 1.576 3.635 0.224 11 0 "[ . 1 . 2]" 1
1394 1 6 VAL QG 1 8 HIS HA 3.100 . 6.000 4.874 4.274 5.798 . 0 0 "[ . 1 . 2]" 1
1395 1 1 ASN HB2 1 6 VAL QG 3.300 . 4.700 2.653 1.995 3.343 . 0 0 "[ . 1 . 2]" 1
1396 1 6 VAL QG 1 114 GLU HB2 3.500 . 6.000 5.775 5.257 6.512 0.512 10 1 "[ . + . 2]" 1
1397 1 70 LYS HG2 1 77 LEU HA 2.700 . 6.000 3.516 2.774 4.050 . 0 0 "[ . 1 . 2]" 1
1398 1 14 ALA MB 1 19 ALA H 3.800 . 5.600 4.579 4.290 4.973 . 0 0 "[ . 1 . 2]" 1
1399 1 14 ALA MB 1 15 ASP H 3.200 . 4.500 3.624 3.550 3.682 . 0 0 "[ . 1 . 2]" 1
1400 1 126 ALA H 1 126 ALA MB 2.800 . 3.800 2.238 2.199 2.260 . 0 0 "[ . 1 . 2]" 1
1401 1 2 TYR HA 1 126 ALA MB 2.200 . 6.000 4.829 3.632 6.082 0.082 7 0 "[ . 1 . 2]" 1
1402 1 126 ALA MB 1 127 LYS HA 3.100 . 4.300 3.865 3.668 4.019 . 0 0 "[ . 1 . 2]" 1
1403 1 125 HIS QB 1 126 ALA MB 3.500 . 5.000 3.629 3.426 3.741 . 0 0 "[ . 1 . 2]" 1
1404 1 121 MET QB 1 126 ALA MB 2.200 . 6.000 5.179 4.272 5.751 . 0 0 "[ . 1 . 2]" 1
1405 1 126 ALA MB 1 130 ARG HA 3.200 . 6.000 5.722 5.228 6.123 0.123 6 0 "[ . 1 . 2]" 1
1406 1 126 ALA MB 1 127 LYS QB 3.500 . 5.000 3.937 3.634 4.338 . 0 0 "[ . 1 . 2]" 1
1407 1 129 VAL QG 1 133 MET H 2.900 . 4.000 3.754 3.036 4.048 0.048 18 0 "[ . 1 . 2]" 1
1408 1 129 VAL QG 1 132 GLY H 3.000 . 6.000 4.273 3.827 4.654 . 0 0 "[ . 1 . 2]" 1
1409 1 129 VAL QG 1 130 ARG H 3.100 . 4.300 3.129 2.239 3.399 . 0 0 "[ . 1 . 2]" 1
1410 1 129 VAL HA 1 129 VAL QG 2.900 . 3.800 2.163 2.109 2.433 . 0 0 "[ . 1 . 2]" 1
1411 1 129 VAL QG 1 134 ASP QB 3.300 . 6.000 4.934 3.400 5.639 . 0 0 "[ . 1 . 2]" 1
1412 1 129 VAL QG 1 130 ARG HA 2.900 . 3.900 3.327 2.959 3.809 . 0 0 "[ . 1 . 2]" 1
1413 1 128 ARG HG3 1 129 VAL QG 3.900 . 4.100 2.698 2.188 3.631 . 0 0 "[ . 1 . 2]" 1
1414 1 129 VAL QG 1 130 ARG HB2 3.400 . 6.000 4.354 3.444 5.257 . 0 0 "[ . 1 . 2]" 1
1415 1 22 THR MG 1 30 TRP HE1 2.700 . 3.600 2.151 1.780 2.673 0.020 14 0 "[ . 1 . 2]" 1
1416 1 14 ALA H 1 14 ALA MB 2.700 . 3.600 2.731 2.664 2.842 . 0 0 "[ . 1 . 2]" 1
1417 1 14 ALA MB 1 18 THR HB 3.000 . 4.100 2.986 2.317 3.314 . 0 0 "[ . 1 . 2]" 1
1418 1 14 ALA MB 1 151 GLU QG 3.700 . 5.400 3.998 2.577 4.932 . 0 0 "[ . 1 . 2]" 1
1419 1 14 ALA MB 1 148 ILE MG 2.500 . 3.300 2.097 1.719 2.567 . 0 0 "[ . 1 . 2]" 1
1420 1 14 ALA MB 1 148 ILE MD 4.100 . 6.000 4.174 3.777 4.587 . 0 0 "[ . 1 . 2]" 1
1421 1 74 PRO HA 1 74 PRO HG3 2.800 . 3.800 2.248 2.200 2.258 . 0 0 "[ . 1 . 2]" 1
1422 1 109 THR H 1 109 THR MG 3.100 . 4.300 3.926 3.887 3.947 . 0 0 "[ . 1 . 2]" 1
1423 1 16 ARG HA 1 109 THR MG 2.400 . 3.100 2.324 2.123 2.505 . 0 0 "[ . 1 . 2]" 1
1424 1 101 PHE HB3 1 109 THR MG 2.600 . 3.400 2.192 1.891 2.323 . 0 0 "[ . 1 . 2]" 1
1425 1 16 ARG QB 1 109 THR MG 3.300 . 4.700 2.879 2.660 3.026 . 0 0 "[ . 1 . 2]" 1
1426 1 101 PHE H 1 109 THR MG 3.800 . 5.600 4.870 4.590 4.978 . 0 0 "[ . 1 . 2]" 1
1427 1 11 THR HA 1 109 THR MG 3.200 . 6.000 4.929 4.577 5.239 . 0 0 "[ . 1 . 2]" 1
1428 1 104 ASP QB 1 109 THR MG 3.200 . 6.000 4.698 4.277 5.200 . 0 0 "[ . 1 . 2]" 1
1429 1 102 VAL MG1 1 109 THR MG 3.500 . 5.100 4.400 4.290 4.532 . 0 0 "[ . 1 . 2]" 1
1430 1 101 PHE HB2 1 109 THR MG 3.600 . 5.200 3.658 3.398 3.794 . 0 0 "[ . 1 . 2]" 1
1431 1 109 THR MG 1 110 ARG H 2.800 . 3.800 2.869 2.557 3.042 . 0 0 "[ . 1 . 2]" 1
1432 1 102 VAL H 1 109 THR MG 2.600 . 3.400 2.819 2.542 3.045 . 0 0 "[ . 1 . 2]" 1
1433 1 16 ARG H 1 109 THR MG 3.400 . 4.800 3.987 3.765 4.088 . 0 0 "[ . 1 . 2]" 1
1434 1 109 THR HA 1 109 THR MG 2.700 . 3.600 2.484 2.449 2.528 . 0 0 "[ . 1 . 2]" 1
1435 1 103 ALA HA 1 109 THR MG 3.200 . 4.500 2.804 2.566 3.291 . 0 0 "[ . 1 . 2]" 1
1436 1 16 ARG HD2 1 100 THR MG 3.300 . 6.000 5.526 5.220 6.011 0.011 13 0 "[ . 1 . 2]" 1
1437 1 100 THR MG 1 101 PHE HA 3.000 . 4.100 4.084 4.017 4.135 0.035 3 0 "[ . 1 . 2]" 1
1438 1 100 THR MG 1 102 VAL H 3.200 . 6.000 3.899 3.694 4.109 . 0 0 "[ . 1 . 2]" 1
1439 1 76 THR HA 1 100 THR MG 3.800 . 5.600 4.520 4.367 4.770 . 0 0 "[ . 1 . 2]" 1
1440 1 100 THR MG 1 111 VAL HA 3.200 . 4.500 4.498 4.304 4.548 0.048 20 0 "[ . 1 . 2]" 1
1441 1 46 VAL MG2 1 53 TRP HD1 3.200 . 4.500 3.380 2.868 3.884 . 0 0 "[ . 1 . 2]" 1
1442 1 76 THR MG 1 99 VAL H 3.300 . 4.700 4.693 4.515 4.784 0.084 11 0 "[ . 1 . 2]" 1
1443 1 76 THR MG 1 101 PHE H 3.000 . 4.100 2.878 2.697 3.028 . 0 0 "[ . 1 . 2]" 1
1444 1 76 THR MG 1 78 VAL H 3.500 . 6.000 5.904 5.603 6.095 0.095 13 0 "[ . 1 . 2]" 1
1445 1 76 THR H 1 76 THR MG 3.000 . 4.200 3.444 3.379 3.533 . 0 0 "[ . 1 . 2]" 1
1446 1 76 THR MG 1 101 PHE QD 3.500 . 5.000 4.629 4.455 4.792 . 0 0 "[ . 1 . 2]" 1
1447 1 76 THR HA 1 76 THR MG 2.600 . 3.500 2.210 2.172 2.239 . 0 0 "[ . 1 . 2]" 1
1448 1 16 ARG HD2 1 76 THR MG 3.500 . 5.000 5.061 4.921 5.168 0.168 12 0 "[ . 1 . 2]" 1
1449 1 11 THR MG 1 108 LYS HE3 3.100 . 4.300 3.144 1.935 4.693 0.393 18 0 "[ . 1 . 2]" 1
1450 1 98 THR MG 1 99 VAL H 3.100 . 4.300 3.095 2.950 3.342 . 0 0 "[ . 1 . 2]" 1
1451 1 98 THR HA 1 98 THR MG 2.700 . 3.600 2.358 2.311 2.385 . 0 0 "[ . 1 . 2]" 1
1452 1 18 THR MG 1 148 ILE HB 4.100 . 6.000 5.715 4.253 6.093 0.093 19 0 "[ . 1 . 2]" 1
1453 1 18 THR MG 1 19 ALA MB 3.900 . 5.800 4.989 4.248 5.176 . 0 0 "[ . 1 . 2]" 1
1454 1 17 LYS HD3 1 18 THR MG 2.200 . 6.000 5.660 4.062 6.867 0.867 9 4 "[ * * +1 - . 2]" 1
1455 1 18 THR H 1 18 THR MG 2.600 . 3.500 2.651 2.270 3.718 0.218 5 0 "[ . 1 . 2]" 1
1456 1 76 THR HA 1 98 THR MG 3.300 . 4.700 4.436 4.134 4.801 0.101 12 0 "[ . 1 . 2]" 1
1457 1 18 THR MG 1 151 GLU HB2 2.700 . 3.600 2.926 2.153 4.062 0.462 5 0 "[ . 1 . 2]" 1
1458 1 18 THR MG 1 148 ILE MD 4.000 . 6.000 4.472 2.829 5.083 . 0 0 "[ . 1 . 2]" 1
1459 1 124 LYS QE 1 124 LYS HG3 3.000 . 4.100 2.707 2.307 3.312 . 0 0 "[ . 1 . 2]" 1
1460 1 70 LYS HG3 1 71 VAL H 2.900 . 4.000 3.403 2.631 4.026 0.026 11 0 "[ . 1 . 2]" 1
1461 1 23 PHE QE 1 24 LEU QD 3.300 . 6.000 3.569 2.692 3.934 . 0 0 "[ . 1 . 2]" 1
1462 1 24 LEU QD 1 25 GLU H 3.600 . 5.300 3.957 3.762 4.393 . 0 0 "[ . 1 . 2]" 1
1463 1 24 LEU H 1 24 LEU QD 3.700 . 5.200 3.817 3.752 3.886 . 0 0 "[ . 1 . 2]" 1
1464 1 24 LEU HA 1 24 LEU QD . . 3.300 1.894 1.786 2.014 0.114 15 0 "[ . 1 . 2]" 1
1465 1 24 LEU QD 1 48 LYS HA 2.800 . 3.800 3.562 3.118 3.774 . 0 0 "[ . 1 . 2]" 1
1466 1 24 LEU QD 1 48 LYS QE 2.900 . 4.700 2.759 1.587 3.659 0.313 19 0 "[ . 1 . 2]" 1
1467 1 24 LEU QD 1 25 GLU QG 3.000 . 4.200 3.266 2.903 3.641 . 0 0 "[ . 1 . 2]" 1
1468 1 24 LEU HB2 1 24 LEU QD 2.700 . 3.400 2.120 2.104 2.129 . 0 0 "[ . 1 . 2]" 1
1469 1 24 LEU HB3 1 24 LEU QD 2.600 . 3.500 2.246 2.180 2.292 . 0 0 "[ . 1 . 2]" 1
1470 1 24 LEU QD 1 71 VAL QG 2.800 . 3.800 2.135 1.846 2.415 . 0 0 "[ . 1 . 2]" 1
1471 1 24 LEU QD 1 68 ILE MD 2.400 . 3.100 2.202 1.851 2.512 . 0 0 "[ . 1 . 2]" 1
1472 1 46 VAL MG1 1 47 ASP H 2.200 . 2.800 2.363 2.178 2.557 . 0 0 "[ . 1 . 2]" 1
1473 1 46 VAL MG1 1 52 ARG H 2.900 . 3.900 3.613 3.177 3.995 0.095 8 0 "[ . 1 . 2]" 1
1474 1 46 VAL MG1 1 53 TRP HD1 2.600 . 3.500 2.707 2.232 3.539 0.039 2 0 "[ . 1 . 2]" 1
1475 1 46 VAL MG1 1 54 TYR QD 3.600 . 5.200 5.067 4.807 5.224 0.024 13 0 "[ . 1 . 2]" 1
1476 1 46 VAL HA 1 46 VAL MG1 2.600 . 3.500 2.420 2.377 2.481 . 0 0 "[ . 1 . 2]" 1
1477 1 25 GLU HA 1 46 VAL MG1 3.100 . 6.000 4.505 3.946 5.050 . 0 0 "[ . 1 . 2]" 1
1478 1 46 VAL MG1 1 51 GLY HA2 3.900 . 5.800 4.236 3.638 4.804 . 0 0 "[ . 1 . 2]" 1
1479 1 46 VAL MG1 1 47 ASP HB2 3.500 . 5.000 4.649 4.473 4.767 . 0 0 "[ . 1 . 2]" 1
1480 1 46 VAL MG1 1 47 ASP HB3 3.700 . 5.400 4.191 3.787 4.407 . 0 0 "[ . 1 . 2]" 1
1481 1 25 GLU QG 1 46 VAL MG1 3.100 . 6.000 4.634 4.236 5.062 . 0 0 "[ . 1 . 2]" 1
1482 1 46 VAL MG1 1 53 TRP HB3 3.700 . 5.400 4.490 2.599 4.856 . 0 0 "[ . 1 . 2]" 1
1483 1 46 VAL MG1 1 52 ARG QB 3.500 . 5.100 4.623 4.344 4.855 . 0 0 "[ . 1 . 2]" 1
1484 1 46 VAL MG1 1 68 ILE MD 2.700 . 3.600 2.243 1.899 2.556 . 0 0 "[ . 1 . 2]" 1
1485 1 46 VAL MG1 1 53 TRP HE3 3.400 . 6.000 5.554 4.990 6.024 0.024 20 0 "[ . 1 . 2]" 1
1486 1 128 ARG HD3 1 129 VAL QG 3.100 . 4.300 4.059 3.524 4.768 0.468 6 0 "[ . 1 . 2]" 1
1487 1 128 ARG HB2 1 129 VAL QG 2.200 . 6.000 4.416 4.003 4.875 . 0 0 "[ . 1 . 2]" 1
1488 1 139 THR MG 1 140 ILE H 3.100 . 4.300 3.534 3.067 3.750 . 0 0 "[ . 1 . 2]" 1
1489 1 136 GLY QA 1 139 THR MG 3.800 . 5.600 4.069 3.480 4.828 . 0 0 "[ . 1 . 2]" 1
1490 1 139 THR MG 1 142 GLN HB3 3.300 . 4.700 4.927 4.530 5.521 0.821 5 4 "[ + 1 .- * *]" 1
1491 1 6 VAL QG 1 115 HIS HB3 3.600 . 5.200 2.360 1.365 5.124 0.635 13 1 "[ . 1 + . 2]" 1
1492 1 1 ASN HD22 1 6 VAL QG 3.600 . 5.200 2.931 2.097 3.967 . 0 0 "[ . 1 . 2]" 1
1493 1 2 TYR H 1 6 VAL QG 3.000 . 4.100 3.149 1.864 3.892 0.036 13 0 "[ . 1 . 2]" 1
1494 1 6 VAL QG 1 119 ASP QB 2.800 . 3.800 2.646 1.891 3.256 . 0 0 "[ . 1 . 2]" 1
1495 1 5 PHE HA 1 6 VAL QG 3.500 . 5.000 3.575 3.186 3.928 . 0 0 "[ . 1 . 2]" 1
1496 1 2 TYR HA 1 6 VAL QG 2.800 . 3.800 1.977 1.714 2.547 0.086 20 0 "[ . 1 . 2]" 1
1497 1 6 VAL MG1 1 6 VAL MG2 2.900 . 4.000 2.088 2.071 2.106 . 0 0 "[ . 1 . 2]" 1
1498 1 6 VAL QG 1 116 THR MG 3.200 . 6.000 4.409 3.559 5.315 . 0 0 "[ . 1 . 2]" 1
1499 1 11 THR MG 1 12 VAL H 3.000 . 4.100 2.953 2.900 2.999 . 0 0 "[ . 1 . 2]" 1
1500 1 11 THR MG 1 109 THR H 3.100 . 4.300 3.530 3.085 3.919 . 0 0 "[ . 1 . 2]" 1
1501 1 11 THR H 1 11 THR MG 3.600 . 5.200 3.822 3.779 3.909 . 0 0 "[ . 1 . 2]" 1
1502 1 11 THR HA 1 11 THR MG 2.700 . 3.600 2.337 2.243 2.417 . 0 0 "[ . 1 . 2]" 1
1503 1 11 THR MG 1 108 LYS QE 3.000 . 4.100 2.724 1.855 3.988 0.045 1 0 "[ . 1 . 2]" 1
1504 1 43 PRO HD2 1 56 ILE MG 2.200 . 6.000 4.435 3.506 5.198 . 0 0 "[ . 1 . 2]" 1
1505 1 56 ILE MG 1 57 ASP H 3.100 . 4.300 3.198 2.936 3.412 . 0 0 "[ . 1 . 2]" 1
1506 1 56 ILE MG 1 62 GLU H 3.800 . 5.600 5.357 4.990 5.639 0.039 2 0 "[ . 1 . 2]" 1
1507 1 56 ILE HA 1 56 ILE MG 2.600 . 3.500 2.341 2.274 2.420 . 0 0 "[ . 1 . 2]" 1
1508 1 43 PRO HB2 1 56 ILE MG 2.200 . 6.000 5.127 4.013 6.087 0.087 13 0 "[ . 1 . 2]" 1
1509 1 56 ILE MG 1 61 GLU QG 2.600 . 3.500 2.408 1.610 3.356 0.090 13 0 "[ . 1 . 2]" 1
1510 1 24 LEU QD 1 27 PHE QD 3.200 . 4.500 4.521 4.351 4.614 0.114 2 0 "[ . 1 . 2]" 1
1511 1 24 LEU QD 1 53 TRP HD1 2.900 . 3.900 3.732 3.225 3.903 0.003 16 0 "[ . 1 . 2]" 1
1512 1 23 PHE QD 1 24 LEU QD 2.900 . 3.900 3.100 2.657 3.371 . 0 0 "[ . 1 . 2]" 1
1513 1 24 LEU QD 1 51 GLY HA2 4.700 . 6.000 4.565 4.017 5.147 . 0 0 "[ . 1 . 2]" 1
1514 1 24 LEU QD 1 68 ILE MG 3.800 . 4.500 3.473 3.093 3.784 . 0 0 "[ . 1 . 2]" 1
1515 1 24 LEU QD 1 79 ILE MG 3.200 . 4.500 3.934 3.641 4.266 . 0 0 "[ . 1 . 2]" 1
1516 1 23 PHE HA 1 24 LEU QD 3.300 . 6.000 5.222 5.022 5.388 . 0 0 "[ . 1 . 2]" 1
1517 1 24 LEU QD 1 25 GLU HB2 3.600 . 5.300 3.235 2.887 3.588 . 0 0 "[ . 1 . 2]" 1
1518 1 10 VAL QG 1 111 VAL H 3.100 . 4.300 3.293 2.642 3.648 . 0 0 "[ . 1 . 2]" 1
1519 1 10 VAL QG 1 141 LEU HB3 3.800 . 5.600 2.079 1.781 2.420 0.219 2 0 "[ . 1 . 2]" 1
1520 1 9 SER HA 1 10 VAL QG 3.300 . 4.600 3.920 3.379 4.231 . 0 0 "[ . 1 . 2]" 1
1521 1 10 VAL QG 1 145 GLN QE 2.800 . 3.700 2.203 1.764 2.504 0.136 17 0 "[ . 1 . 2]" 1
1522 1 8 HIS HE1 1 10 VAL QG 3.400 . 4.800 3.703 3.171 3.950 . 0 0 "[ . 1 . 2]" 1
1523 1 34 ASN HD21 1 40 VAL QG 3.000 . 6.000 4.091 2.508 5.528 . 0 0 "[ . 1 . 2]" 1
1524 1 40 VAL HA 1 40 VAL QG 3.100 . 3.900 2.246 2.124 2.378 . 0 0 "[ . 1 . 2]" 1
1525 1 34 ASN QB 1 40 VAL QG 3.400 . 4.400 2.882 1.975 3.624 0.025 20 0 "[ . 1 . 2]" 1
1526 1 39 LYS QD 1 40 VAL QG 2.900 . 4.000 2.639 1.537 3.836 0.263 4 0 "[ . 1 . 2]" 1
1527 1 10 VAL QG 1 110 ARG HD3 3.300 . 4.600 4.846 4.115 5.550 0.950 2 9 "[ +* .- * 1* * ** *]" 1
1528 1 10 VAL QG 1 19 ALA MB 3.100 . 4.300 4.043 3.538 4.283 . 0 0 "[ . 1 . 2]" 1
1529 1 70 LYS H 1 78 VAL QG 3.300 . 4.300 3.508 2.721 3.800 . 0 0 "[ . 1 . 2]" 1
1530 1 78 VAL QG 1 98 THR HA 2.600 . 3.400 2.486 1.920 2.878 . 0 0 "[ . 1 . 2]" 1
1531 1 70 LYS HE2 1 78 VAL QG 3.000 . 4.100 3.383 1.905 4.395 0.295 2 0 "[ . 1 . 2]" 1
1532 1 69 ARG HB3 1 78 VAL QG 2.200 . 5.000 3.430 2.991 4.097 . 0 0 "[ . 1 . 2]" 1
1533 1 12 VAL QG 1 13 LYS HA 3.200 . 4.500 3.733 3.421 3.952 . 0 0 "[ . 1 . 2]" 1
1534 1 12 VAL QG 1 19 ALA HA 3.000 . 4.100 2.609 2.402 3.025 . 0 0 "[ . 1 . 2]" 1
1535 1 12 VAL QG 1 145 GLN HG2 3.100 . 6.000 3.503 2.391 4.404 . 0 0 "[ . 1 . 2]" 1
1536 1 12 VAL QG 1 148 ILE MD 2.800 . 3.800 1.871 1.662 2.026 0.138 15 0 "[ . 1 . 2]" 1
1537 1 12 VAL H 1 12 VAL QG 3.100 . 3.800 2.547 1.984 2.735 . 0 0 "[ . 1 . 2]" 1
1538 1 12 VAL HA 1 12 VAL QG 2.800 . 3.500 2.134 2.063 2.462 . 0 0 "[ . 1 . 2]" 1
1539 1 12 VAL QG 1 109 THR HB 2.700 . 3.600 2.519 1.760 2.834 0.040 13 0 "[ . 1 . 2]" 1
1540 1 12 VAL QG 1 14 ALA MB 3.400 . 4.800 3.010 2.690 3.634 . 0 0 "[ . 1 . 2]" 1
1541 1 56 ILE MD 1 62 GLU H 3.900 . 5.800 5.710 5.398 6.007 0.207 2 0 "[ . 1 . 2]" 1
1542 1 89 ILE H 1 89 ILE MG 2.500 . 3.300 1.913 1.690 2.165 0.010 13 0 "[ . 1 . 2]" 1
1543 1 89 ILE MG 1 128 ARG HA 3.200 . 4.500 3.173 2.281 4.075 . 0 0 "[ . 1 . 2]" 1
1544 1 89 ILE MG 1 128 ARG HD2 3.700 . 5.400 4.425 2.997 5.484 0.084 13 0 "[ . 1 . 2]" 1
1545 1 89 ILE MG 1 131 ASN HB2 2.900 . 3.900 3.846 1.991 4.489 0.589 17 1 "[ . 1 . + 2]" 1
1546 1 56 ILE H 1 56 ILE MD 3.100 . 4.300 3.180 2.912 3.614 . 0 0 "[ . 1 . 2]" 1
1547 1 44 LEU H 1 56 ILE MD 2.200 . 6.000 5.646 4.358 6.121 0.121 3 0 "[ . 1 . 2]" 1
1548 1 54 TYR QD 1 56 ILE MD 3.000 . 4.100 3.844 3.167 4.131 0.031 17 0 "[ . 1 . 2]" 1
1549 1 44 LEU HA 1 56 ILE MD 2.200 . 6.000 5.178 4.236 6.172 0.172 13 0 "[ . 1 . 2]" 1
1550 1 56 ILE HA 1 56 ILE MD 2.600 . 3.400 2.068 1.887 2.230 . 0 0 "[ . 1 . 2]" 1
1551 1 43 PRO HB2 1 56 ILE MD 2.200 . 6.000 5.337 4.046 6.100 0.100 9 0 "[ . 1 . 2]" 1
1552 1 56 ILE MD 1 61 GLU QG 2.600 . 3.400 2.027 1.766 2.563 0.034 12 0 "[ . 1 . 2]" 1
1553 1 56 ILE MD 1 61 GLU QB 3.300 . 4.600 3.198 2.011 4.201 . 0 0 "[ . 1 . 2]" 1
1554 1 56 ILE HB 1 56 ILE MD 3.500 . 5.000 3.236 3.222 3.243 . 0 0 "[ . 1 . 2]" 1
1555 1 37 THR H 1 37 THR MG 3.000 . 4.100 2.986 2.328 3.895 . 0 0 "[ . 1 . 2]" 1
1556 1 101 PHE QD 1 111 VAL MG2 3.400 . 4.800 3.062 2.896 3.419 . 0 0 "[ . 1 . 2]" 1
1557 1 77 LEU HG 1 78 VAL H 3.700 . 5.400 4.808 4.561 5.275 . 0 0 "[ . 1 . 2]" 1
1558 1 76 THR H 1 77 LEU HG 2.700 . 6.000 4.501 4.107 5.941 . 0 0 "[ . 1 . 2]" 1
1559 1 77 LEU HA 1 77 LEU HG 2.600 . 3.400 2.769 2.595 3.603 0.203 10 0 "[ . 1 . 2]" 1
1560 1 30 TRP HB3 1 32 PRO HG2 3.200 . 4.500 3.717 2.821 5.067 0.567 18 2 "[- . 1 . + 2]" 1
1561 1 20 PHE HA 1 77 LEU HG 3.500 . 6.000 5.648 5.442 5.972 . 0 0 "[ . 1 . 2]" 1
1562 1 20 PHE HB2 1 77 LEU HG 3.200 . 6.000 5.581 5.288 5.886 . 0 0 "[ . 1 . 2]" 1
1563 1 70 LYS HG2 1 77 LEU HG 3.100 . 6.000 5.664 5.067 6.083 0.083 13 0 "[ . 1 . 2]" 1
1564 1 24 LEU QD 1 77 LEU HG 3.300 . 4.700 3.329 2.335 3.726 . 0 0 "[ . 1 . 2]" 1
1565 1 68 ILE MG 1 77 LEU HG 3.000 . 6.000 5.042 4.657 5.380 . 0 0 "[ . 1 . 2]" 1
1566 1 77 LEU HG 1 79 ILE MG 3.400 . 6.000 5.272 4.407 5.618 . 0 0 "[ . 1 . 2]" 1
1567 1 77 LEU HG 1 99 VAL QG 3.700 . 5.400 4.316 3.883 4.595 . 0 0 "[ . 1 . 2]" 1
1568 1 64 THR MG 1 83 LEU QD 3.000 . 4.100 3.676 2.433 4.159 0.059 12 0 "[ . 1 . 2]" 1
1569 1 8 HIS HA 1 111 VAL MG2 3.400 . 6.000 5.995 5.395 6.165 0.165 6 0 "[ . 1 . 2]" 1
1570 1 71 VAL MG1 1 71 VAL MG2 2.900 . 3.900 2.081 2.070 2.088 . 0 0 "[ . 1 . 2]" 1
1571 1 68 ILE MG 1 71 VAL QG 3.200 . 4.500 1.622 1.331 1.756 0.569 2 2 "[-+ . 1 . 2]" 1
1572 1 111 VAL MG2 1 112 ASP HB2 3.500 . 5.000 4.721 4.443 5.138 0.138 9 0 "[ . 1 . 2]" 1
1573 1 8 HIS HE1 1 111 VAL MG2 2.700 . 3.600 2.995 2.221 3.625 0.025 18 0 "[ . 1 . 2]" 1
1574 1 111 VAL MG1 1 111 VAL MG2 2.700 . 3.600 2.054 1.989 2.075 . 0 0 "[ . 1 . 2]" 1
1575 1 99 VAL QG 1 111 VAL MG2 2.700 . 6.000 1.822 1.699 2.082 . 0 0 "[ . 1 . 2]" 1
1576 1 141 LEU QD 1 145 GLN H 3.700 . 5.400 4.898 4.522 5.129 . 0 0 "[ . 1 . 2]" 1
1577 1 141 LEU QD 1 145 GLN QE 3.900 . 4.900 3.821 3.366 4.139 . 0 0 "[ . 1 . 2]" 1
1578 1 23 PHE QD 1 141 LEU QD 2.800 . 3.800 3.859 3.799 3.911 0.111 13 0 "[ . 1 . 2]" 1
1579 1 23 PHE HA 1 141 LEU QD 3.200 . 6.000 5.764 5.450 5.932 . 0 0 "[ . 1 . 2]" 1
1580 1 141 LEU HA 1 141 LEU QD 2.500 . 3.300 1.963 1.899 2.117 . 0 0 "[ . 1 . 2]" 1
1581 1 141 LEU HB3 1 141 LEU QD 3.400 . 3.800 2.133 2.099 2.346 . 0 0 "[ . 1 . 2]" 1
1582 1 39 LYS HE2 1 40 VAL QG 2.200 . 6.000 3.920 2.489 5.138 . 0 0 "[ . 1 . 2]" 1
1583 1 141 LEU QD 1 144 PHE HB3 3.400 . 4.900 3.392 3.088 3.917 . 0 0 "[ . 1 . 2]" 1
1584 1 113 VAL MG2 1 141 LEU QD 2.200 . 6.000 4.222 3.873 4.611 . 0 0 "[ . 1 . 2]" 1
1585 1 67 LEU QD 1 95 SER HB2 3.300 . 6.000 4.726 3.178 6.174 0.174 9 0 "[ . 1 . 2]" 1
1586 1 67 LEU QD 1 82 ARG QB 2.700 . 3.600 2.717 1.864 3.466 . 0 0 "[ . 1 . 2]" 1
1587 1 77 LEU QD 1 101 PHE HB2 3.100 . 6.000 4.309 4.095 4.502 . 0 0 "[ . 1 . 2]" 1
1588 1 68 ILE MD 1 77 LEU QD 3.500 . 6.000 3.740 3.298 4.500 . 0 0 "[ . 1 . 2]" 1
1589 1 77 LEU QD 1 101 PHE H 3.200 . 6.000 4.249 3.950 4.476 . 0 0 "[ . 1 . 2]" 1
1590 1 77 LEU QD 1 78 VAL H 3.700 . 5.400 4.370 3.723 4.540 . 0 0 "[ . 1 . 2]" 1
1591 1 76 THR H 1 77 LEU QD 2.800 . 3.800 3.594 2.882 3.770 . 0 0 "[ . 1 . 2]" 1
1592 1 77 LEU QD 1 97 PHE QD 3.500 . 6.000 5.630 5.489 5.921 . 0 0 "[ . 1 . 2]" 1
1593 1 8 HIS HE1 1 77 LEU QD 3.300 . 6.000 5.572 5.067 5.950 . 0 0 "[ . 1 . 2]" 1
1594 1 77 LEU HA 1 77 LEU QD 3.200 . 4.500 3.037 2.102 3.202 . 0 0 "[ . 1 . 2]" 1
1595 1 71 VAL HA 1 77 LEU QD 3.400 . 6.000 3.417 1.805 3.887 . 0 0 "[ . 1 . 2]" 1
1596 1 23 PHE HB3 1 77 LEU QD 2.900 . 4.000 3.443 3.153 4.003 0.003 6 0 "[ . 1 . 2]" 1
1597 1 20 PHE HA 1 77 LEU QD 2.900 . 4.000 3.247 3.032 3.583 . 0 0 "[ . 1 . 2]" 1
1598 1 20 PHE HB2 1 77 LEU QD 2.700 . 3.600 3.496 3.401 3.578 . 0 0 "[ . 1 . 2]" 1
1599 1 72 ASP HB3 1 77 LEU QD 2.200 . 6.000 4.951 3.150 5.648 . 0 0 "[ . 1 . 2]" 1
1600 1 77 LEU QD 1 111 VAL HB 4.100 . 6.000 5.715 5.421 5.970 . 0 0 "[ . 1 . 2]" 1
1601 1 24 LEU QD 1 77 LEU QD 3.800 . 5.600 1.811 1.652 2.809 0.348 5 0 "[ . 1 . 2]" 1
1602 1 77 LEU QD 1 79 ILE MG 3.300 . 4.700 3.631 3.346 4.151 . 0 0 "[ . 1 . 2]" 1
1603 1 77 LEU QD 1 99 VAL QG 2.600 . 3.500 2.137 1.862 2.433 . 0 0 "[ . 1 . 2]" 1
1604 1 67 LEU QD 1 80 GLY H 3.300 . 4.600 3.439 3.172 3.676 . 0 0 "[ . 1 . 2]" 1
1605 1 67 LEU H 1 67 LEU QD 2.700 . 3.600 1.831 1.720 2.303 0.080 17 0 "[ . 1 . 2]" 1
1606 1 67 LEU QD 1 94 SER H 2.900 . 6.000 3.815 2.788 4.306 . 0 0 "[ . 1 . 2]" 1
1607 1 66 GLY H 1 67 LEU QD 3.600 . 5.300 4.689 4.076 5.022 . 0 0 "[ . 1 . 2]" 1
1608 1 67 LEU QD 1 81 TRP HB2 3.000 . 6.000 4.876 4.278 5.226 . 0 0 "[ . 1 . 2]" 1
1609 1 44 LEU QD 1 56 ILE H 4.200 . 6.000 3.479 1.777 4.682 0.223 13 0 "[ . 1 . 2]" 1
1610 1 44 LEU QD 1 54 TYR HA 3.600 . 5.200 4.623 4.155 4.867 . 0 0 "[ . 1 . 2]" 1
1611 1 67 LEU QD 1 68 ILE HA 3.500 . 6.000 5.053 4.789 5.414 . 0 0 "[ . 1 . 2]" 1
1612 1 67 LEU QD 1 81 TRP HE3 3.300 . 6.000 5.725 5.340 5.942 . 0 0 "[ . 1 . 2]" 1
1613 1 67 LEU QD 1 81 TRP HA 2.900 . 4.000 3.945 3.565 4.110 0.110 10 0 "[ . 1 . 2]" 1
1614 1 44 LEU QD 1 55 GLU HG2 4.000 . 6.000 4.958 1.892 5.698 0.108 3 0 "[ . 1 . 2]" 1
1615 1 67 LEU QD 1 96 GLU HA 3.800 . 6.000 4.630 4.153 5.372 . 0 0 "[ . 1 . 2]" 1
1616 1 67 LEU QD 1 69 ARG HG2 3.400 . 4.800 4.531 3.826 5.250 0.450 12 0 "[ . 1 . 2]" 1
1617 1 67 LEU QD 1 68 ILE H 3.700 . 5.400 4.538 4.464 4.635 . 0 0 "[ . 1 . 2]" 1
1618 1 67 LEU QD 1 79 ILE HA 3.600 . 6.000 4.930 4.634 5.198 . 0 0 "[ . 1 . 2]" 1
1619 1 67 LEU QD 1 94 SER QB 3.200 . 6.000 4.580 3.230 5.081 . 0 0 "[ . 1 . 2]" 1
1620 1 67 LEU QD 1 93 ASN QB 3.200 . 6.000 4.179 1.944 5.113 . 0 0 "[ . 1 . 2]" 1
1621 1 99 VAL H 1 99 VAL QG 2.700 . 3.600 2.241 1.862 2.364 0.038 2 0 "[ . 1 . 2]" 1
1622 1 99 VAL QG 1 100 THR H 3.500 . 4.300 3.059 3.013 3.224 . 0 0 "[ . 1 . 2]" 1
1623 1 97 PHE QD 1 99 VAL QG 2.800 . 3.800 2.375 2.085 2.758 . 0 0 "[ . 1 . 2]" 1
1624 1 23 PHE QD 1 99 VAL QG 3.200 . 4.500 3.402 3.157 3.941 . 0 0 "[ . 1 . 2]" 1
1625 1 97 PHE HA 1 99 VAL QG 3.500 . 6.000 5.209 4.429 5.503 . 0 0 "[ . 1 . 2]" 1
1626 1 99 VAL QG 1 113 VAL MG2 2.700 . 3.600 1.755 1.690 1.864 0.110 12 0 "[ . 1 . 2]" 1
1627 1 99 VAL QG 1 111 VAL MG1 3.300 . 4.700 3.500 3.323 3.798 . 0 0 "[ . 1 . 2]" 1
1628 1 99 VAL MG1 1 99 VAL MG2 2.800 . 3.800 2.077 2.066 2.085 . 0 0 "[ . 1 . 2]" 1
1629 1 9 SER H 1 141 LEU QD 3.000 . 4.100 3.265 2.838 3.701 . 0 0 "[ . 1 . 2]" 1
1630 1 8 HIS HE1 1 141 LEU QD 3.300 . 4.600 3.075 2.671 3.452 . 0 0 "[ . 1 . 2]" 1
1631 1 8 HIS HA 1 141 LEU QD 3.100 . 4.300 3.301 2.951 3.789 . 0 0 "[ . 1 . 2]" 1
1632 1 138 PRO HB3 1 141 LEU QD 2.200 . 6.000 4.216 3.660 4.997 . 0 0 "[ . 1 . 2]" 1
1633 1 141 LEU QD 1 142 GLN H 3.700 . 5.500 4.163 4.030 4.226 . 0 0 "[ . 1 . 2]" 1
1634 1 137 TRP HB3 1 141 LEU QD 2.200 . 6.000 4.201 2.674 4.975 . 0 0 "[ . 1 . 2]" 1
1635 1 113 VAL MG1 1 141 LEU QD 2.200 . 6.000 4.814 4.329 5.544 . 0 0 "[ . 1 . 2]" 1
1636 1 12 VAL QG 1 148 ILE H 3.800 . 5.600 4.964 4.229 5.264 . 0 0 "[ . 1 . 2]" 1
1637 1 12 VAL QG 1 16 ARG HA 3.700 . 4.400 3.541 3.311 3.748 . 0 0 "[ . 1 . 2]" 1
1638 1 12 VAL QG 1 145 GLN HA 2.900 . 3.900 3.410 2.289 3.706 . 0 0 "[ . 1 . 2]" 1
1639 1 12 VAL QG 1 145 GLN HB3 3.300 . 4.600 3.672 3.091 4.091 . 0 0 "[ . 1 . 2]" 1
1640 1 10 VAL QG 1 12 VAL QG 2.800 . 3.700 2.068 1.863 2.962 0.037 13 0 "[ . 1 . 2]" 1
1641 1 12 VAL QG 1 108 LYS QG 3.600 . 6.000 4.390 3.878 4.669 . 0 0 "[ . 1 . 2]" 1
1642 1 12 VAL QG 1 13 LYS HD3 3.300 . 4.700 4.255 3.696 4.561 . 0 0 "[ . 1 . 2]" 1
1643 1 81 TRP HE1 1 89 ILE MD 3.300 . 6.000 5.905 3.396 6.231 0.231 14 0 "[ . 1 . 2]" 1
1644 1 89 ILE H 1 89 ILE MD 3.700 . 5.400 4.063 3.736 4.288 . 0 0 "[ . 1 . 2]" 1
1645 1 89 ILE MD 1 91 PRO HD3 2.700 . 3.600 3.171 1.721 3.690 0.090 16 0 "[ . 1 . 2]" 1
1646 1 89 ILE MD 1 91 PRO HD2 3.500 . 5.100 4.356 3.136 4.883 . 0 0 "[ . 1 . 2]" 1
1647 1 89 ILE HA 1 89 ILE MD 3.200 . 4.500 3.296 2.239 3.615 . 0 0 "[ . 1 . 2]" 1
1648 1 89 ILE MD 1 90 ASP QB 3.500 . 5.000 4.139 3.737 4.473 . 0 0 "[ . 1 . 2]" 1
1649 1 89 ILE MD 1 128 ARG HD2 3.300 . 4.700 3.586 1.943 4.335 . 0 0 "[ . 1 . 2]" 1
1650 1 89 ILE MD 1 131 ASN QB 3.600 . 6.000 5.592 4.589 6.039 0.039 12 0 "[ . 1 . 2]" 1
1651 1 89 ILE MD 1 91 PRO HG2 3.700 . 5.400 4.923 3.751 5.428 0.028 8 0 "[ . 1 . 2]" 1
1652 1 83 LEU QD 1 89 ILE MD 3.100 . 4.300 3.872 2.904 4.469 0.169 4 0 "[ . 1 . 2]" 1
1653 1 31 TRP H 1 140 ILE MG 4.400 . 6.000 5.868 5.402 6.091 0.091 1 0 "[ . 1 . 2]" 1
1654 1 38 THR MG 1 63 HIS QB 3.300 . 6.000 5.263 2.937 5.724 . 0 0 "[ . 1 . 2]" 1
1655 1 139 THR H 1 140 ILE MG 3.900 . 5.800 5.706 5.550 5.863 0.063 4 0 "[ . 1 . 2]" 1
1656 1 78 VAL QG 1 97 PHE H 3.000 . 4.100 3.764 3.118 4.052 . 0 0 "[ . 1 . 2]" 1
1657 1 69 ARG QD 1 78 VAL QG 3.000 . 4.100 3.574 2.707 4.079 . 0 0 "[ . 1 . 2]" 1
1658 1 78 VAL QG 1 98 THR MG 3.500 . 5.000 1.942 1.649 2.782 0.351 9 0 "[ . 1 . 2]" 1
1659 1 38 THR MG 1 57 ASP QB 3.000 . 4.100 3.394 1.771 3.825 0.129 3 0 "[ . 1 . 2]" 1
1660 1 38 THR MG 1 57 ASP HA 2.700 . 3.600 1.886 1.672 2.168 0.128 20 0 "[ . 1 . 2]" 1
1661 1 38 THR MG 1 42 ALA MB 3.000 . 4.100 2.803 2.073 3.513 . 0 0 "[ . 1 . 2]" 1
1662 1 38 THR H 1 38 THR MG 2.800 . 3.800 2.701 2.564 2.814 . 0 0 "[ . 1 . 2]" 1
1663 1 38 THR HA 1 38 THR MG 2.900 . 4.000 2.281 2.132 2.391 . 0 0 "[ . 1 . 2]" 1
1664 1 145 GLN HA 1 148 ILE MG 3.300 . 4.700 3.816 3.366 4.088 . 0 0 "[ . 1 . 2]" 1
1665 1 13 LYS H 1 148 ILE MG 2.500 . 3.300 2.511 1.876 3.140 . 0 0 "[ . 1 . 2]" 1
1666 1 148 ILE H 1 148 ILE MG 3.500 . 5.000 3.740 3.708 3.774 . 0 0 "[ . 1 . 2]" 1
1667 1 12 VAL HA 1 148 ILE MG 3.100 . 4.300 3.195 2.564 4.320 0.020 14 0 "[ . 1 . 2]" 1
1668 1 148 ILE MG 1 152 GLY HA3 3.400 . 6.000 4.510 3.855 5.852 . 0 0 "[ . 1 . 2]" 1
1669 1 13 LYS QE 1 148 ILE MG 3.300 . 4.700 4.409 3.732 4.728 0.028 17 0 "[ . 1 . 2]" 1
1670 1 12 VAL HB 1 148 ILE MG 3.200 . 4.500 3.905 1.811 4.321 0.089 4 0 "[ . 1 . 2]" 1
1671 1 12 VAL QG 1 148 ILE MG 2.500 . 3.300 1.676 1.564 2.343 0.136 17 0 "[ . 1 . 2]" 1
1672 1 148 ILE MD 1 148 ILE MG 2.500 . 3.300 1.887 1.785 2.051 . 0 0 "[ . 1 . 2]" 1
1673 1 140 ILE HA 1 140 ILE MG 2.600 . 3.500 2.514 2.404 2.593 . 0 0 "[ . 1 . 2]" 1
1674 1 68 ILE MG 1 69 ARG H 3.000 . 4.100 2.650 2.337 2.905 . 0 0 "[ . 1 . 2]" 1
1675 1 68 ILE HA 1 68 ILE MG 2.500 . 3.300 2.335 2.265 2.401 . 0 0 "[ . 1 . 2]" 1
1676 1 68 ILE MG 1 71 VAL HB 3.200 . 4.500 3.968 3.591 4.159 . 0 0 "[ . 1 . 2]" 1
1677 1 68 ILE HB 1 68 ILE MG 2.400 . 3.100 2.129 2.126 2.132 . 0 0 "[ . 1 . 2]" 1
1678 1 68 ILE MD 1 68 ILE MG 2.400 . 3.100 1.824 1.778 1.855 . 0 0 "[ . 1 . 2]" 1
1679 1 68 ILE MG 1 79 ILE MG 2.900 . 3.900 3.805 3.107 3.972 0.072 8 0 "[ . 1 . 2]" 1
1680 1 68 ILE H 1 68 ILE MG 3.500 . 5.000 3.802 3.782 3.840 . 0 0 "[ . 1 . 2]" 1
1681 1 68 ILE MG 1 70 LYS HA 3.100 . 4.300 3.511 3.146 3.910 . 0 0 "[ . 1 . 2]" 1
1682 1 51 GLY HA2 1 68 ILE MG 3.300 . 4.700 3.424 3.085 3.829 . 0 0 "[ . 1 . 2]" 1
1683 1 83 LEU QD 1 131 ASN HD21 3.200 . 6.000 4.747 3.940 5.413 . 0 0 "[ . 1 . 2]" 1
1684 1 83 LEU QD 1 84 ASN HB3 3.300 . 4.600 3.873 2.644 5.091 0.491 3 0 "[ . 1 . 2]" 1
1685 1 83 LEU HB2 1 83 LEU QD 3.100 . 3.900 2.268 2.090 2.487 . 0 0 "[ . 1 . 2]" 1
1686 1 83 LEU QD 1 84 ASN H 2.600 . 3.500 2.043 1.592 3.005 0.208 5 0 "[ . 1 . 2]" 1
1687 1 83 LEU H 1 83 LEU QD 3.500 . 4.700 3.621 2.734 4.211 . 0 0 "[ . 1 . 2]" 1
1688 1 83 LEU HA 1 83 LEU QD 3.000 . 4.200 2.238 1.632 3.369 0.168 5 0 "[ . 1 . 2]" 1
1689 1 83 LEU QD 1 131 ASN QB 3.300 . 4.500 3.906 2.515 4.479 . 0 0 "[ . 1 . 2]" 1
1690 1 83 LEU QD 1 133 MET HB2 3.200 . 6.000 4.815 3.053 6.413 0.413 13 0 "[ . 1 . 2]" 1
1691 1 83 LEU QD 1 88 ARG QG 3.100 . 4.300 2.703 1.564 3.236 0.336 1 0 "[ . 1 . 2]" 1
1692 1 19 ALA H 1 148 ILE MD 3.200 . 4.500 3.725 3.428 4.337 . 0 0 "[ . 1 . 2]" 1
1693 1 146 ASP H 1 148 ILE MD 2.200 . 6.000 5.372 5.041 5.616 . 0 0 "[ . 1 . 2]" 1
1694 1 148 ILE H 1 148 ILE MD 3.300 . 4.700 3.672 3.531 3.794 . 0 0 "[ . 1 . 2]" 1
1695 1 12 VAL HA 1 148 ILE MD 3.200 . 4.500 3.631 3.193 4.459 . 0 0 "[ . 1 . 2]" 1
1696 1 22 THR HB 1 148 ILE MD 2.400 . 3.100 2.346 2.013 2.830 . 0 0 "[ . 1 . 2]" 1
1697 1 19 ALA HA 1 148 ILE MD 2.400 . 3.100 2.041 1.672 2.618 0.028 14 0 "[ . 1 . 2]" 1
1698 1 148 ILE HA 1 148 ILE MD 3.500 . 5.000 3.777 3.720 3.838 . 0 0 "[ . 1 . 2]" 1
1699 1 145 GLN HA 1 148 ILE MD 2.600 . 3.400 2.829 2.472 3.078 . 0 0 "[ . 1 . 2]" 1
1700 1 148 ILE MD 1 151 GLU QG 2.200 . 6.000 4.910 4.387 5.197 . 0 0 "[ . 1 . 2]" 1
1701 1 148 ILE HB 1 148 ILE MD 2.600 . 3.400 2.450 2.418 2.489 . 0 0 "[ . 1 . 2]" 1
1702 1 22 THR MG 1 148 ILE MD 3.100 . 4.300 2.895 2.068 3.368 . 0 0 "[ . 1 . 2]" 1
1703 1 141 LEU QD 1 148 ILE MD 2.200 . 6.000 5.484 5.249 5.735 . 0 0 "[ . 1 . 2]" 1
1704 1 13 LYS H 1 148 ILE MD 2.200 . 6.000 4.214 3.723 4.594 . 0 0 "[ . 1 . 2]" 1
1705 1 12 VAL HB 1 148 ILE MD 3.300 . 4.700 3.973 2.311 4.320 . 0 0 "[ . 1 . 2]" 1
1706 1 19 ALA MB 1 148 ILE MD 3.400 . 4.800 2.961 2.608 3.488 . 0 0 "[ . 1 . 2]" 1
1707 1 68 ILE MD 1 71 VAL H 3.600 . 6.000 5.267 4.814 5.631 . 0 0 "[ . 1 . 2]" 1
1708 1 68 ILE H 1 68 ILE MD 3.500 . 5.100 3.734 3.588 3.919 . 0 0 "[ . 1 . 2]" 1
1709 1 68 ILE MD 1 70 LYS H 4.500 . 6.000 5.056 4.819 5.398 . 0 0 "[ . 1 . 2]" 1
1710 1 53 TRP HD1 1 68 ILE MD 2.500 . 3.300 2.191 1.649 2.753 0.051 20 0 "[ . 1 . 2]" 1
1711 1 52 ARG HA 1 68 ILE MD 2.900 . 4.000 3.441 2.972 3.692 . 0 0 "[ . 1 . 2]" 1
1712 1 67 LEU HA 1 68 ILE MD 4.000 . 6.000 5.411 5.057 5.808 . 0 0 "[ . 1 . 2]" 1
1713 1 68 ILE MD 1 79 ILE HA 4.300 . 6.000 4.996 4.736 5.605 . 0 0 "[ . 1 . 2]" 1
1714 1 51 GLY HA2 1 68 ILE MD 3.300 . 6.000 2.156 1.849 3.069 . 0 0 "[ . 1 . 2]" 1
1715 1 51 GLY HA3 1 68 ILE MD 2.300 . 6.000 3.308 2.839 4.201 . 0 0 "[ . 1 . 2]" 1
1716 1 48 LYS QE 1 68 ILE MD 2.200 . 6.000 4.929 3.688 5.673 . 0 0 "[ . 1 . 2]" 1
1717 1 47 ASP HB3 1 68 ILE MD 2.200 . 6.000 4.721 4.392 5.218 . 0 0 "[ . 1 . 2]" 1
1718 1 53 TRP HB3 1 68 ILE MD 2.200 . 6.000 5.277 3.346 5.554 . 0 0 "[ . 1 . 2]" 1
1719 1 68 ILE HB 1 68 ILE MD 2.600 . 3.500 2.445 2.365 2.528 . 0 0 "[ . 1 . 2]" 1
1720 1 68 ILE MD 1 68 ILE HG13 2.300 . 3.000 2.121 2.118 2.123 . 0 0 "[ . 1 . 2]" 1
1721 1 68 ILE MD 1 68 ILE MG 2.400 . 3.100 1.892 1.820 1.935 . 0 0 "[ . 1 . 2]" 1
1722 1 68 ILE MD 1 79 ILE MG 3.500 . 5.000 4.344 4.004 4.875 . 0 0 "[ . 1 . 2]" 1
1723 1 27 PHE QD 1 44 LEU HG 3.700 . 5.400 5.434 2.899 5.637 0.237 18 0 "[ . 1 . 2]" 1
1724 1 28 PRO QD 1 44 LEU HG 3.500 . 6.000 5.459 3.071 5.842 . 0 0 "[ . 1 . 2]" 1
1725 1 44 LEU HG 1 54 TYR HA 3.100 . 6.000 5.702 5.381 6.090 0.090 3 0 "[ . 1 . 2]" 1
1726 1 44 LEU HG 1 55 GLU HG3 3.500 . 6.000 4.919 3.560 6.043 0.043 2 0 "[ . 1 . 2]" 1
1727 1 44 LEU QB 1 44 LEU HG 2.600 . 3.400 2.359 2.330 2.468 . 0 0 "[ . 1 . 2]" 1
1728 1 83 LEU QD 1 89 ILE H 2.900 . 4.000 3.122 2.466 3.795 . 0 0 "[ . 1 . 2]" 1
1729 1 83 LEU QD 1 87 GLY H 3.500 . 6.000 3.855 2.575 5.224 . 0 0 "[ . 1 . 2]" 1
1730 1 83 LEU QD 1 133 MET HA 3.200 . 6.000 4.960 4.178 5.627 . 0 0 "[ . 1 . 2]" 1
1731 1 83 LEU QD 1 89 ILE HA 2.900 . 6.000 3.585 2.243 4.416 . 0 0 "[ . 1 . 2]" 1
1732 1 83 LEU QD 1 90 ASP QB 3.200 . 4.500 2.629 1.542 4.117 0.358 14 0 "[ . 1 . 2]" 1
1733 1 83 LEU QD 1 88 ARG HB2 2.700 . 3.600 1.983 1.073 3.192 0.727 12 2 "[ . 1 + .- 2]" 1
1734 1 83 LEU QD 1 89 ILE MG 3.200 . 4.500 3.689 3.127 4.614 0.114 4 0 "[ . 1 . 2]" 1
1735 1 112 ASP HB3 1 113 VAL MG2 2.200 . 6.000 5.563 5.191 6.183 0.183 13 0 "[ . 1 . 2]" 1
1736 1 113 VAL MG2 1 114 GLU H 3.100 . 4.300 3.662 2.796 3.932 . 0 0 "[ . 1 . 2]" 1
1737 1 97 PHE QD 1 113 VAL MG2 2.800 . 3.800 2.946 2.369 3.568 . 0 0 "[ . 1 . 2]" 1
1738 1 112 ASP HA 1 113 VAL MG2 2.200 . 6.000 4.179 3.833 5.122 . 0 0 "[ . 1 . 2]" 1
1739 1 99 VAL HA 1 113 VAL MG2 2.400 . 3.100 1.726 1.607 2.176 0.093 5 0 "[ . 1 . 2]" 1
1740 1 113 VAL HA 1 113 VAL MG2 2.600 . 3.400 2.220 2.116 2.306 . 0 0 "[ . 1 . 2]" 1
1741 1 8 HIS HB3 1 113 VAL MG2 2.700 . 3.600 2.672 2.067 3.330 . 0 0 "[ . 1 . 2]" 1
1742 1 113 VAL MG2 1 114 GLU HB3 3.700 . 6.000 6.136 5.514 6.825 0.825 7 6 "[ **. + -1* . *]" 1
1743 1 99 VAL HB 1 113 VAL MG2 3.200 . 4.400 3.551 1.860 3.904 0.140 20 0 "[ . 1 . 2]" 1
1744 1 7 ARG HG3 1 113 VAL MG2 3.700 . 5.400 5.311 5.059 5.561 0.161 2 0 "[ . 1 . 2]" 1
1745 1 113 VAL HB 1 113 VAL MG2 2.400 . 3.100 2.119 2.110 2.124 . 0 0 "[ . 1 . 2]" 1
1746 1 79 ILE MD 1 80 GLY H 2.900 . 4.000 2.913 2.059 3.839 . 0 0 "[ . 1 . 2]" 1
1747 1 67 LEU H 1 79 ILE MD 2.800 . 3.800 3.010 2.269 3.612 . 0 0 "[ . 1 . 2]" 1
1748 1 79 ILE H 1 79 ILE MD 3.400 . 4.800 4.155 3.837 4.482 . 0 0 "[ . 1 . 2]" 1
1749 1 79 ILE MD 1 97 PHE QD 3.400 . 4.900 4.291 3.318 4.989 0.089 3 0 "[ . 1 . 2]" 1
1750 1 79 ILE MD 1 81 TRP HE3 3.000 . 4.100 3.909 2.784 4.281 0.181 10 0 "[ . 1 . 2]" 1
1751 1 66 GLY HA2 1 79 ILE MD 3.100 . 4.300 3.297 2.600 4.128 . 0 0 "[ . 1 . 2]" 1
1752 1 79 ILE HA 1 79 ILE MD 3.200 . 4.500 3.277 2.417 3.937 . 0 0 "[ . 1 . 2]" 1
1753 1 68 ILE HA 1 79 ILE MD 3.600 . 5.200 3.916 2.886 4.584 . 0 0 "[ . 1 . 2]" 1
1754 1 66 GLY HA3 1 79 ILE MD 2.700 . 3.600 2.668 1.767 3.622 0.033 16 0 "[ . 1 . 2]" 1
1755 1 68 ILE MG 1 79 ILE MD 2.200 . 6.000 4.567 3.719 5.213 . 0 0 "[ . 1 . 2]" 1
1756 1 79 ILE MD 1 79 ILE MG 2.700 . 3.600 2.341 1.808 3.233 . 0 0 "[ . 1 . 2]" 1
1757 1 111 VAL H 1 111 VAL MG1 2.500 . 3.300 2.039 1.892 2.146 . 0 0 "[ . 1 . 2]" 1
1758 1 10 VAL H 1 111 VAL MG1 2.500 . 3.300 1.850 1.652 2.124 0.048 15 0 "[ . 1 . 2]" 1
1759 1 111 VAL MG1 1 112 ASP H 3.500 . 5.000 3.793 3.619 4.056 . 0 0 "[ . 1 . 2]" 1
1760 1 101 PHE HA 1 111 VAL MG1 3.500 . 5.000 4.372 4.105 4.555 . 0 0 "[ . 1 . 2]" 1
1761 1 111 VAL HA 1 111 VAL MG1 3.100 . 4.300 3.191 3.139 3.210 . 0 0 "[ . 1 . 2]" 1
1762 1 111 VAL MG1 1 113 VAL HB 3.200 . 6.000 4.835 4.407 6.216 0.216 7 0 "[ . 1 . 2]" 1
1763 1 8 HIS HE1 1 111 VAL MG1 2.800 . 3.800 2.727 2.422 3.101 . 0 0 "[ . 1 . 2]" 1
1764 1 9 SER HA 1 111 VAL MG1 3.400 . 4.800 2.827 2.510 3.458 . 0 0 "[ . 1 . 2]" 1
1765 1 7 ARG HG2 1 111 VAL MG1 3.300 . 6.000 6.230 6.047 6.925 0.925 15 3 "[ -. * 1 + 2]" 1
1766 1 79 ILE MG 1 80 GLY H 3.500 . 5.000 4.189 3.943 4.410 . 0 0 "[ . 1 . 2]" 1
1767 1 79 ILE MG 1 97 PHE H 3.200 . 4.500 3.636 3.087 3.994 . 0 0 "[ . 1 . 2]" 1
1768 1 79 ILE H 1 79 ILE MG 2.500 . 3.300 2.117 2.052 2.178 . 0 0 "[ . 1 . 2]" 1
1769 1 79 ILE MG 1 97 PHE HZ 3.200 . 4.500 3.231 2.626 4.612 0.112 12 0 "[ . 1 . 2]" 1
1770 1 79 ILE MG 1 97 PHE QD 2.900 . 3.900 3.009 2.469 3.467 . 0 0 "[ . 1 . 2]" 1
1771 1 79 ILE MG 1 81 TRP HE3 3.800 . 6.000 5.338 4.385 6.035 0.035 4 0 "[ . 1 . 2]" 1
1772 1 23 PHE QD 1 79 ILE MG 2.200 . 6.000 4.799 4.369 5.203 . 0 0 "[ . 1 . 2]" 1
1773 1 66 GLY HA3 1 79 ILE MG 3.500 . 6.000 5.589 4.619 6.092 0.092 14 0 "[ . 1 . 2]" 1
1774 1 77 LEU QB 1 79 ILE MG 2.600 . 3.400 2.831 2.484 3.055 . 0 0 "[ . 1 . 2]" 1
1775 1 79 ILE HG12 1 79 ILE MG 2.900 . 4.000 2.811 2.189 3.173 . 0 0 "[ . 1 . 2]" 1
1776 1 99 VAL QG 1 112 ASP H 3.700 . 5.400 4.241 3.978 4.459 . 0 0 "[ . 1 . 2]" 1
1777 1 8 HIS HE1 1 99 VAL QG 2.800 . 3.800 3.186 2.717 3.542 . 0 0 "[ . 1 . 2]" 1
1778 1 76 THR HA 1 99 VAL QG 3.000 . 4.100 3.589 2.941 3.780 . 0 0 "[ . 1 . 2]" 1
1779 1 99 VAL QG 1 112 ASP HA 3.600 . 6.000 5.322 5.101 5.527 . 0 0 "[ . 1 . 2]" 1
1780 1 99 VAL HA 1 99 VAL QG 2.600 . 3.500 2.193 2.133 2.620 . 0 0 "[ . 1 . 2]" 1
1781 1 99 VAL QG 1 113 VAL HA 3.500 . 5.000 3.646 3.449 3.753 . 0 0 "[ . 1 . 2]" 1
1782 1 99 VAL QG 1 111 VAL HA 3.700 . 5.400 4.366 4.149 4.565 . 0 0 "[ . 1 . 2]" 1
1783 1 99 VAL QG 1 100 THR HB 3.600 . 5.200 4.840 4.791 4.902 . 0 0 "[ . 1 . 2]" 1
1784 1 20 PHE HA 1 99 VAL QG 3.400 . 6.000 4.904 4.610 5.118 . 0 0 "[ . 1 . 2]" 1
1785 1 99 VAL QG 1 111 VAL HB 3.100 . 4.300 3.699 3.447 3.856 . 0 0 "[ . 1 . 2]" 1
1786 1 137 TRP H 1 140 ILE MD 3.100 . 4.300 3.977 3.740 4.322 0.022 4 0 "[ . 1 . 2]" 1
1787 1 140 ILE H 1 140 ILE MD 3.500 . 5.000 3.631 2.028 3.826 . 0 0 "[ . 1 . 2]" 1
1788 1 35 PHE H 1 140 ILE MD 2.200 . 6.000 6.031 5.279 6.156 0.156 4 0 "[ . 1 . 2]" 1
1789 1 27 PHE QE 1 140 ILE MD 2.200 . 6.000 4.196 3.431 5.922 . 0 0 "[ . 1 . 2]" 1
1790 1 137 TRP HA 1 140 ILE MD 2.500 . 3.300 2.398 1.874 3.357 0.057 1 0 "[ . 1 . 2]" 1
1791 1 136 GLY QA 1 140 ILE MD 2.200 . 6.000 3.426 2.607 3.885 . 0 0 "[ . 1 . 2]" 1
1792 1 32 PRO HD2 1 140 ILE MD 2.200 . 6.000 5.541 4.586 6.027 0.027 18 0 "[ . 1 . 2]" 1
1793 1 140 ILE HA 1 140 ILE MD 3.400 . 4.900 3.670 1.943 3.810 . 0 0 "[ . 1 . 2]" 1
1794 1 33 ASN HB3 1 140 ILE MD 2.500 . 3.300 2.122 1.783 2.824 . 0 0 "[ . 1 . 2]" 1
1795 1 140 ILE MD 1 141 LEU HG 2.200 . 6.000 5.263 4.921 6.216 0.216 18 0 "[ . 1 . 2]" 1
1796 1 140 ILE MD 1 144 PHE HB2 2.200 . 6.000 5.524 5.328 6.004 0.004 8 0 "[ . 1 . 2]" 1
1797 1 140 ILE HB 1 140 ILE MD 2.800 . 3.800 2.511 2.404 2.939 . 0 0 "[ . 1 . 2]" 1
1798 1 32 PRO HG3 1 140 ILE MD 3.100 . 6.000 4.404 3.399 4.798 . 0 0 "[ . 1 . 2]" 1
1799 1 32 PRO HB3 1 140 ILE MD 3.900 . 5.800 4.857 2.653 5.378 . 0 0 "[ . 1 . 2]" 1
1800 1 140 ILE MD 1 140 ILE MG 2.700 . 3.600 1.946 1.847 2.983 . 0 0 "[ . 1 . 2]" 1
1801 1 113 VAL MG1 1 115 HIS H 2.900 . 4.000 3.372 2.923 4.025 0.025 8 0 "[ . 1 . 2]" 1
1802 1 113 VAL H 1 113 VAL MG1 3.500 . 5.000 3.605 3.150 3.737 . 0 0 "[ . 1 . 2]" 1
1803 1 113 VAL MG1 1 114 GLU H 2.700 . 3.600 2.895 2.672 3.037 . 0 0 "[ . 1 . 2]" 1
1804 1 8 HIS H 1 113 VAL MG1 2.700 . 3.600 2.656 1.729 3.222 0.071 2 0 "[ . 1 . 2]" 1
1805 1 97 PHE QD 1 113 VAL MG1 3.500 . 5.000 2.775 2.176 3.607 . 0 0 "[ . 1 . 2]" 1
1806 1 1 ASN HD21 1 113 VAL MG1 2.200 . 6.000 6.111 5.275 6.750 0.750 16 2 "[ . 1 .+ -2]" 1
1807 1 97 PHE HA 1 113 VAL MG1 3.100 . 4.300 3.641 3.263 4.061 . 0 0 "[ . 1 . 2]" 1
1808 1 7 ARG HA 1 113 VAL MG1 2.400 . 3.100 2.924 2.152 3.205 0.105 12 0 "[ . 1 . 2]" 1
1809 1 99 VAL HA 1 113 VAL MG1 3.600 . 5.200 3.607 3.098 4.376 . 0 0 "[ . 1 . 2]" 1
1810 1 113 VAL HA 1 113 VAL MG1 2.900 . 3.900 2.666 2.498 3.045 . 0 0 "[ . 1 . 2]" 1
1811 1 113 VAL MG1 1 115 HIS HB3 3.000 . 4.100 3.585 2.939 4.240 0.140 10 0 "[ . 1 . 2]" 1
1812 1 8 HIS HB2 1 113 VAL MG1 3.300 . 4.700 3.732 3.218 4.303 . 0 0 "[ . 1 . 2]" 1
1813 1 113 VAL MG1 1 115 HIS HB2 3.100 . 4.300 2.746 2.196 4.432 0.132 15 0 "[ . 1 . 2]" 1
1814 1 97 PHE HB2 1 113 VAL MG1 2.400 . 3.100 2.014 1.668 3.787 0.687 12 1 "[ . 1 + . 2]" 1
1815 1 97 PHE HB3 1 113 VAL MG1 2.900 . 3.900 2.940 2.299 3.393 . 0 0 "[ . 1 . 2]" 1
1816 1 113 VAL HB 1 113 VAL MG1 2.400 . 3.100 2.132 2.123 2.142 . 0 0 "[ . 1 . 2]" 1
1817 1 99 VAL QG 1 113 VAL MG1 3.500 . 5.100 3.161 2.660 3.923 . 0 0 "[ . 1 . 2]" 1
1818 1 7 ARG HG3 1 113 VAL MG1 3.400 . 4.900 4.334 3.743 4.738 . 0 0 "[ . 1 . 2]" 1
1819 1 113 VAL MG1 1 113 VAL MG2 2.700 . 3.600 2.077 2.048 2.090 . 0 0 "[ . 1 . 2]" 1
1820 1 93 ASN H 1 93 ASN HA 2.800 . 3.800 2.839 2.282 2.946 . 0 0 "[ . 1 . 2]" 1
1821 1 93 ASN HA 1 93 ASN QB 2.800 . 3.800 2.330 2.167 2.532 . 0 0 "[ . 1 . 2]" 1
1822 1 93 ASN HA 1 94 SER H 3.000 . 4.200 3.379 2.312 3.585 . 0 0 "[ . 1 . 2]" 1
1823 1 70 LYS HG3 1 72 ASP HA 3.000 . 6.000 4.344 3.797 4.848 . 0 0 "[ . 1 . 2]" 1
1824 1 90 ASP H 1 90 ASP HA 2.700 . 3.600 2.911 2.799 2.938 . 0 0 "[ . 1 . 2]" 1
1825 1 90 ASP HA 1 92 ASP H 3.100 . 4.300 4.051 3.167 4.360 0.060 15 0 "[ . 1 . 2]" 1
1826 1 89 ILE HA 1 90 ASP HA 3.400 . 4.800 4.374 4.281 4.451 . 0 0 "[ . 1 . 2]" 1
1827 1 90 ASP HA 1 91 PRO HB2 3.800 . 5.600 5.260 5.001 5.563 . 0 0 "[ . 1 . 2]" 1
1828 1 3 ASP HA 1 120 ARG QB 2.900 . 6.000 4.413 1.881 5.613 . 0 0 "[ . 1 . 2]" 1
1829 1 3 ASP HA 1 120 ARG HG3 3.000 . 6.000 4.370 2.426 6.145 0.145 3 0 "[ . 1 . 2]" 1
1830 1 3 ASP HA 1 3 ASP HB2 2.800 . 3.800 2.468 2.382 2.993 . 0 0 "[ . 1 . 2]" 1
1831 1 3 ASP HA 1 3 ASP HB3 2.900 . 4.000 2.987 2.318 3.033 . 0 0 "[ . 1 . 2]" 1
1832 1 14 ALA HA 1 107 LYS QB 2.900 . 3.800 3.194 2.101 3.837 0.037 12 0 "[ . 1 . 2]" 1
1833 1 14 ALA HA 1 15 ASP H 2.800 . 3.800 2.904 2.735 3.005 . 0 0 "[ . 1 . 2]" 1
1834 1 14 ALA H 1 14 ALA HA 2.700 . 3.600 2.897 2.846 2.920 . 0 0 "[ . 1 . 2]" 1
1835 1 14 ALA HA 1 108 LYS HA 3.300 . 6.000 4.921 4.493 5.337 . 0 0 "[ . 1 . 2]" 1
1836 1 14 ALA HA 1 15 ASP HB2 3.100 . 4.300 4.211 3.792 4.350 0.050 7 0 "[ . 1 . 2]" 1
1837 1 12 VAL QG 1 14 ALA HA 3.600 . 5.300 4.099 3.941 4.617 . 0 0 "[ . 1 . 2]" 1
1838 1 14 ALA HA 1 148 ILE MG 3.900 . 5.800 4.316 4.022 4.694 . 0 0 "[ . 1 . 2]" 1
1839 1 42 ALA H 1 42 ALA HA 2.700 . 3.600 2.844 2.289 2.941 . 0 0 "[ . 1 . 2]" 1
1840 1 112 ASP HA 1 113 VAL H 2.300 . 3.000 2.122 2.060 2.198 . 0 0 "[ . 1 . 2]" 1
1841 1 9 SER HA 1 112 ASP HA 2.600 . 3.400 2.792 2.591 2.948 . 0 0 "[ . 1 . 2]" 1
1842 1 38 THR HA 1 57 ASP HA 3.100 . 4.300 3.818 3.055 4.494 0.194 3 0 "[ . 1 . 2]" 1
1843 1 7 ARG QG 1 112 ASP HA 2.900 . 4.000 3.499 3.321 3.679 . 0 0 "[ . 1 . 2]" 1
1844 1 57 ASP H 1 57 ASP HA 2.500 . 3.300 2.893 2.811 2.940 . 0 0 "[ . 1 . 2]" 1
1845 1 57 ASP HA 1 58 GLU HB3 3.400 . 4.800 4.562 4.298 4.790 . 0 0 "[ . 1 . 2]" 1
1846 1 57 ASP HA 1 58 GLU H 2.500 . 3.300 2.524 2.104 2.855 . 0 0 "[ . 1 . 2]" 1
1847 1 38 THR HB 1 57 ASP HA 2.900 . 6.000 3.477 2.645 5.152 . 0 0 "[ . 1 . 2]" 1
1848 1 57 ASP HA 1 57 ASP QB 2.600 . 3.400 2.398 2.171 2.474 . 0 0 "[ . 1 . 2]" 1
1849 1 12 VAL HA 1 13 LYS H 2.400 . 3.100 2.223 2.094 2.451 . 0 0 "[ . 1 . 2]" 1
1850 1 75 ASP H 1 75 ASP HA 2.600 . 3.400 2.864 2.824 2.896 . 0 0 "[ . 1 . 2]" 1
1851 1 75 ASP HA 1 75 ASP HB2 2.600 . 3.400 2.425 2.386 2.488 . 0 0 "[ . 1 . 2]" 1
1852 1 75 ASP HA 1 75 ASP HB3 3.000 . 4.100 3.026 3.017 3.032 . 0 0 "[ . 1 . 2]" 1
1853 1 95 SER H 1 95 SER HA 2.500 . 3.300 2.343 2.237 2.814 . 0 0 "[ . 1 . 2]" 1
1854 1 10 VAL HA 1 11 THR HB 3.900 . 5.800 4.735 4.585 4.937 . 0 0 "[ . 1 . 2]" 1
1855 1 10 VAL HA 1 10 VAL HB 2.700 . 3.600 2.790 2.316 3.002 . 0 0 "[ . 1 . 2]" 1
1856 1 10 VAL HA 1 10 VAL QG 2.800 . 3.600 2.185 2.070 2.473 . 0 0 "[ . 1 . 2]" 1
1857 1 38 THR HA 1 38 THR HB 2.600 . 3.500 2.492 2.408 2.611 . 0 0 "[ . 1 . 2]" 1
1858 1 10 VAL QG 1 138 PRO HA 3.900 . 5.800 5.465 5.184 5.792 . 0 0 "[ . 1 . 2]" 1
1859 1 18 THR H 1 18 THR HA 2.700 . 3.600 2.856 2.796 2.892 . 0 0 "[ . 1 . 2]" 1
1860 1 22 THR H 1 22 THR HA 2.700 . 3.600 2.824 2.807 2.865 . 0 0 "[ . 1 . 2]" 1
1861 1 22 THR HA 1 26 GLY H 3.100 . 4.300 3.419 2.851 4.055 . 0 0 "[ . 1 . 2]" 1
1862 1 21 LYS HG3 1 22 THR HA 2.500 . 6.000 3.332 3.008 4.436 . 0 0 "[ . 1 . 2]" 1
1863 1 22 THR HA 1 22 THR MG 2.700 . 3.600 2.353 2.284 2.402 . 0 0 "[ . 1 . 2]" 1
1864 1 22 THR HA 1 26 GLY HA2 4.000 . 6.000 4.551 3.904 5.166 . 0 0 "[ . 1 . 2]" 1
1865 1 138 PRO HA 1 138 PRO QG 3.600 . 5.200 3.486 3.470 3.503 . 0 0 "[ . 1 . 2]" 1
1866 1 138 PRO HA 1 141 LEU HB2 3.600 . 5.200 3.090 2.633 3.540 . 0 0 "[ . 1 . 2]" 1
1867 1 138 PRO HA 1 139 THR H 2.900 . 3.900 3.552 3.512 3.589 . 0 0 "[ . 1 . 2]" 1
1868 1 22 THR HA 1 23 PHE HB2 3.500 . 6.000 5.777 5.614 5.846 . 0 0 "[ . 1 . 2]" 1
1869 1 138 PRO HA 1 141 LEU QD 2.900 . 4.000 2.789 2.333 3.401 . 0 0 "[ . 1 . 2]" 1
1870 1 37 THR H 1 37 THR HA 2.700 . 3.600 2.879 2.851 2.956 . 0 0 "[ . 1 . 2]" 1
1871 1 64 THR HA 1 82 ARG QG 3.000 . 4.100 3.736 2.909 4.155 0.055 11 0 "[ . 1 . 2]" 1
1872 1 21 LYS HA 1 24 LEU H 3.000 . 4.100 3.991 3.717 4.133 0.033 19 0 "[ . 1 . 2]" 1
1873 1 21 LYS H 1 21 LYS HA 2.600 . 3.500 2.774 2.756 2.806 . 0 0 "[ . 1 . 2]" 1
1874 1 48 LYS HA 1 48 LYS QD 3.100 . 4.300 2.496 1.782 3.757 0.118 9 0 "[ . 1 . 2]" 1
1875 1 48 LYS HA 1 48 LYS QE 3.000 . 4.100 3.573 2.521 4.045 . 0 0 "[ . 1 . 2]" 1
1876 1 17 LYS HA 1 74 PRO HB2 3.300 . 4.700 3.360 2.917 3.948 . 0 0 "[ . 1 . 2]" 1
1877 1 17 LYS HA 1 17 LYS HD3 3.300 . 6.000 4.198 2.181 4.848 . 0 0 "[ . 1 . 2]" 1
1878 1 17 LYS HA 1 20 PHE HB3 3.000 . 4.100 3.310 3.011 3.551 . 0 0 "[ . 1 . 2]" 1
1879 1 19 ALA HA 1 22 THR MG 3.600 . 5.300 4.640 4.280 4.932 . 0 0 "[ . 1 . 2]" 1
1880 1 47 ASP H 1 47 ASP HA 2.500 . 3.300 2.941 2.920 2.952 . 0 0 "[ . 1 . 2]" 1
1881 1 46 VAL MG1 1 47 ASP HA 3.200 . 4.500 3.579 3.474 3.794 . 0 0 "[ . 1 . 2]" 1
1882 1 47 ASP HA 1 48 LYS HB2 3.800 . 5.600 4.620 4.103 5.699 0.099 7 0 "[ . 1 . 2]" 1
1883 1 47 ASP HA 1 47 ASP HB2 2.700 . 3.600 2.470 2.388 2.594 . 0 0 "[ . 1 . 2]" 1
1884 1 47 ASP HA 1 47 ASP HB3 2.700 . 3.600 3.024 3.009 3.033 . 0 0 "[ . 1 . 2]" 1
1885 1 47 ASP HA 1 54 TYR QD 3.500 . 6.000 5.169 4.541 5.644 . 0 0 "[ . 1 . 2]" 1
1886 1 44 LEU HA 1 45 GLY H 3.100 . 4.300 3.444 2.624 3.551 . 0 0 "[ . 1 . 2]" 1
1887 1 44 LEU HA 1 44 LEU QB 2.600 . 3.400 2.307 2.121 2.439 . 0 0 "[ . 1 . 2]" 1
1888 1 42 ALA MB 1 44 LEU HA 3.700 . 5.400 5.320 4.019 5.497 0.097 7 0 "[ . 1 . 2]" 1
1889 1 44 LEU HA 1 44 LEU QD 2.800 . 6.000 2.201 1.923 3.444 . 0 0 "[ . 1 . 2]" 1
1890 1 98 THR H 1 114 GLU HA 3.200 . 6.000 4.797 4.500 5.098 . 0 0 "[ . 1 . 2]" 1
1891 1 114 GLU HA 1 115 HIS H 2.600 . 3.400 2.113 2.046 2.171 . 0 0 "[ . 1 . 2]" 1
1892 1 114 GLU HA 1 114 GLU HB2 2.800 . 3.800 2.374 2.203 2.502 . 0 0 "[ . 1 . 2]" 1
1893 1 52 ARG HA 1 53 TRP H 2.400 . 3.100 2.293 2.191 2.447 . 0 0 "[ . 1 . 2]" 1
1894 1 52 ARG HA 1 53 TRP HB3 3.700 . 6.000 5.712 4.972 5.850 . 0 0 "[ . 1 . 2]" 1
1895 1 52 ARG HA 1 71 VAL QG 3.700 . 6.000 5.748 5.437 5.977 . 0 0 "[ . 1 . 2]" 1
1896 1 52 ARG HA 1 68 ILE HG13 2.300 . 3.000 2.621 2.175 2.985 . 0 0 "[ . 1 . 2]" 1
1897 1 44 LEU QB 1 55 GLU HA 2.200 . 2.800 2.096 1.548 3.047 0.247 13 0 "[ . 1 . 2]" 1
1898 1 54 TYR QB 1 55 GLU HA 3.100 . 6.000 4.528 4.377 4.703 . 0 0 "[ . 1 . 2]" 1
1899 1 55 GLU HA 1 55 GLU HB2 2.700 . 3.600 2.741 2.460 2.903 . 0 0 "[ . 1 . 2]" 1
1900 1 55 GLU HA 1 55 GLU HB3 2.200 . 6.000 2.403 2.272 2.473 . 0 0 "[ . 1 . 2]" 1
1901 1 7 ARG HA 1 8 HIS H 2.200 . 2.800 2.158 2.080 2.200 . 0 0 "[ . 1 . 2]" 1
1902 1 9 SER H 1 9 SER HA 2.700 . 3.600 2.916 2.896 2.935 . 0 0 "[ . 1 . 2]" 1
1903 1 8 HIS HA 1 9 SER HA 3.400 . 4.800 4.364 4.323 4.432 . 0 0 "[ . 1 . 2]" 1
1904 1 9 SER HA 1 141 LEU QD 3.400 . 4.800 4.740 4.557 4.856 0.056 11 0 "[ . 1 . 2]" 1
1905 1 9 SER HA 1 10 VAL H 2.400 . 3.100 2.088 2.032 2.149 . 0 0 "[ . 1 . 2]" 1
1906 1 9 SER HA 1 111 VAL HA 3.200 . 6.000 5.154 4.905 5.414 . 0 0 "[ . 1 . 2]" 1
1907 1 81 TRP HA 1 81 TRP HH2 3.700 . 6.000 6.038 5.770 6.153 0.153 12 0 "[ . 1 . 2]" 1
1908 1 81 TRP HA 1 82 ARG H 2.500 . 3.300 2.244 2.040 2.435 . 0 0 "[ . 1 . 2]" 1
1909 1 80 GLY HA3 1 96 GLU HA 3.500 . 5.000 3.121 2.640 3.545 . 0 0 "[ . 1 . 2]" 1
1910 1 96 GLU HA 1 97 PHE H 2.600 . 3.400 2.189 2.130 2.274 . 0 0 "[ . 1 . 2]" 1
1911 1 5 PHE HA 1 5 PHE HB2 2.900 . 4.000 2.694 2.409 3.039 . 0 0 "[ . 1 . 2]" 1
1912 1 5 PHE HA 1 6 VAL H 2.600 . 3.500 2.293 2.148 2.535 . 0 0 "[ . 1 . 2]" 1
1913 1 2 TYR HA 1 5 PHE HA 3.000 . 6.000 4.545 3.362 6.058 0.058 8 0 "[ . 1 . 2]" 1
1914 1 94 SER HA 1 95 SER H 2.900 . 4.000 3.267 2.639 3.553 . 0 0 "[ . 1 . 2]" 1
1915 1 46 VAL HA 1 47 ASP H 2.300 . 3.000 2.185 2.080 2.243 . 0 0 "[ . 1 . 2]" 1
1916 1 46 VAL HA 1 53 TRP HD1 3.500 . 5.000 3.947 3.326 4.693 . 0 0 "[ . 1 . 2]" 1
1917 1 98 THR HA 1 99 VAL H 2.400 . 3.100 2.153 2.112 2.217 . 0 0 "[ . 1 . 2]" 1
1918 1 78 VAL HA 1 98 THR HA 2.400 . 3.100 2.265 1.963 2.735 . 0 0 "[ . 1 . 2]" 1
1919 1 76 THR HA 1 100 THR HA 3.100 . 4.300 3.000 2.810 3.226 . 0 0 "[ . 1 . 2]" 1
1920 1 100 THR HA 1 100 THR HB 2.700 . 3.600 3.021 3.012 3.027 . 0 0 "[ . 1 . 2]" 1
1921 1 100 THR HA 1 101 PHE H 2.400 . 3.100 2.173 2.147 2.203 . 0 0 "[ . 1 . 2]" 1
1922 1 11 THR HA 1 110 ARG HB2 2.800 . 3.800 3.739 3.493 3.857 0.057 7 0 "[ . 1 . 2]" 1
1923 1 11 THR HA 1 12 VAL H 2.500 . 3.300 2.114 2.082 2.148 . 0 0 "[ . 1 . 2]" 1
1924 1 11 THR HA 1 110 ARG HA 2.400 . 3.100 2.397 2.158 2.599 . 0 0 "[ . 1 . 2]" 1
1925 1 11 THR HA 1 11 THR HB 2.800 . 3.800 3.026 3.006 3.031 . 0 0 "[ . 1 . 2]" 1
1926 1 11 THR HA 1 12 VAL QG 3.700 . 5.400 3.752 3.197 4.231 . 0 0 "[ . 1 . 2]" 1
1927 1 11 THR HA 1 12 VAL HB 3.700 . 5.400 4.483 4.156 5.589 0.189 13 0 "[ . 1 . 2]" 1
1928 1 76 THR HA 1 77 LEU QD 2.600 . 3.400 2.712 2.578 2.910 . 0 0 "[ . 1 . 2]" 1
1929 1 76 THR HA 1 77 LEU H 2.500 . 3.300 2.212 2.160 2.340 . 0 0 "[ . 1 . 2]" 1
1930 1 76 THR HA 1 101 PHE H 2.700 . 3.600 3.045 2.802 3.169 . 0 0 "[ . 1 . 2]" 1
1931 1 76 THR H 1 76 THR HA 2.600 . 3.400 2.927 2.911 2.937 . 0 0 "[ . 1 . 2]" 1
1932 1 76 THR HA 1 76 THR HB 2.700 . 3.600 2.621 2.594 2.659 . 0 0 "[ . 1 . 2]" 1
1933 1 76 THR HA 1 77 LEU QB 3.600 . 5.200 2.691 2.564 2.878 . 0 0 "[ . 1 . 2]" 1
1934 1 53 TRP HA 1 54 TYR H 2.400 . 3.100 2.186 2.142 2.259 . 0 0 "[ . 1 . 2]" 1
1935 1 53 TRP HA 1 68 ILE HG13 3.300 . 6.000 5.121 4.649 5.441 . 0 0 "[ . 1 . 2]" 1
1936 1 53 TRP HA 1 53 TRP HB2 2.300 . 6.000 3.011 2.652 3.036 . 0 0 "[ . 1 . 2]" 1
1937 1 53 TRP HA 1 53 TRP HB3 2.900 . 3.900 2.491 2.264 2.541 . 0 0 "[ . 1 . 2]" 1
1938 1 24 LEU HA 1 24 LEU HB2 2.500 . 3.300 2.560 2.501 2.625 . 0 0 "[ . 1 . 2]" 1
1939 1 24 LEU HA 1 24 LEU HB3 2.800 . 3.800 2.999 2.982 3.011 . 0 0 "[ . 1 . 2]" 1
1940 1 31 TRP H 1 31 TRP HA 2.600 . 3.400 2.898 2.850 2.936 . 0 0 "[ . 1 . 2]" 1
1941 1 19 ALA H 1 19 ALA HA 2.600 . 3.400 2.791 2.776 2.809 . 0 0 "[ . 1 . 2]" 1
1942 1 26 GLY H 1 26 GLY HA2 2.800 . 3.800 2.933 2.898 2.962 . 0 0 "[ . 1 . 2]" 1
1943 1 26 GLY HA2 1 29 GLU HG2 2.500 . 3.300 3.015 2.459 3.335 0.035 13 0 "[ . 1 . 2]" 1
1944 1 28 PRO QD 1 45 GLY QA 2.100 . 6.000 2.612 2.257 3.090 . 0 0 "[ . 1 . 2]" 1
1945 1 40 VAL QG 1 45 GLY QA 2.200 . 6.000 4.818 4.176 5.560 . 0 0 "[ . 1 . 2]" 1
1946 1 45 GLY QA 1 53 TRP HB3 4.000 . 6.000 4.701 4.331 4.892 . 0 0 "[ . 1 . 2]" 1
1947 1 76 THR HB 1 77 LEU H 2.600 . 3.500 2.954 2.564 3.432 . 0 0 "[ . 1 . 2]" 1
1948 1 76 THR HB 1 78 VAL H 3.000 . 6.000 4.738 4.445 4.986 . 0 0 "[ . 1 . 2]" 1
1949 1 76 THR H 1 76 THR HB 3.000 . 4.100 3.776 3.704 3.819 . 0 0 "[ . 1 . 2]" 1
1950 1 76 THR HB 1 77 LEU HA 2.900 . 6.000 4.121 3.991 4.283 . 0 0 "[ . 1 . 2]" 1
1951 1 72 ASP HB3 1 76 THR HB 3.500 . 5.000 4.006 3.578 4.638 . 0 0 "[ . 1 . 2]" 1
1952 1 100 THR H 1 100 THR HB 2.600 . 3.500 2.620 2.550 2.683 . 0 0 "[ . 1 . 2]" 1
1953 1 100 THR HB 1 112 ASP QB 2.900 . 4.000 2.947 2.396 4.080 0.080 9 0 "[ . 1 . 2]" 1
1954 1 11 THR HB 1 12 VAL H 3.400 . 4.900 4.241 4.106 4.304 . 0 0 "[ . 1 . 2]" 1
1955 1 11 THR H 1 11 THR HB 2.700 . 3.600 2.612 2.477 2.792 . 0 0 "[ . 1 . 2]" 1
1956 1 143 SER H 1 143 SER HB2 3.100 . 4.300 2.536 2.323 3.193 . 0 0 "[ . 1 . 2]" 1
1957 1 137 TRP HA 1 140 ILE MG 3.500 . 5.100 3.678 3.394 4.165 . 0 0 "[ . 1 . 2]" 1
1958 1 113 VAL HA 1 113 VAL HB 2.500 . 3.300 2.979 2.823 3.015 . 0 0 "[ . 1 . 2]" 1
1959 1 113 VAL HA 1 114 GLU H 2.500 . 3.300 2.128 2.091 2.180 . 0 0 "[ . 1 . 2]" 1
1960 1 94 SER HA 1 94 SER QB 3.000 . 3.600 2.300 2.148 2.428 . 0 0 "[ . 1 . 2]" 1
1961 1 129 VAL H 1 129 VAL HA 2.700 . 3.600 2.863 2.777 2.907 . 0 0 "[ . 1 . 2]" 1
1962 1 128 ARG HG3 1 129 VAL HA 3.400 . 4.900 3.715 3.379 4.122 . 0 0 "[ . 1 . 2]" 1
1963 1 129 VAL HA 1 129 VAL HB 2.900 . 3.900 2.959 2.332 3.038 . 0 0 "[ . 1 . 2]" 1
1964 1 98 THR H 1 98 THR HB 2.600 . 3.400 2.563 2.513 2.690 . 0 0 "[ . 1 . 2]" 1
1965 1 98 THR HB 1 114 GLU HB2 3.100 . 4.300 3.552 2.428 4.336 0.036 18 0 "[ . 1 . 2]" 1
1966 1 78 VAL QG 1 98 THR HB 3.500 . 5.100 3.817 3.474 4.443 . 0 0 "[ . 1 . 2]" 1
1967 1 64 THR HB 1 82 ARG QG 2.700 . 3.600 2.497 1.540 3.634 0.260 20 0 "[ . 1 . 2]" 1
1968 1 37 THR HB 1 38 THR MG 2.800 . 3.800 3.376 2.903 3.929 0.129 10 0 "[ . 1 . 2]" 1
1969 1 140 ILE H 1 140 ILE HA 2.400 . 3.100 2.783 2.762 2.830 . 0 0 "[ . 1 . 2]" 1
1970 1 32 PRO HA 1 140 ILE HA 3.800 . 5.600 4.109 2.751 4.443 . 0 0 "[ . 1 . 2]" 1
1971 1 140 ILE HA 1 140 ILE HB 2.500 . 3.300 3.013 2.996 3.029 . 0 0 "[ . 1 . 2]" 1
1972 1 140 ILE HA 1 140 ILE QG 2.400 . 3.100 2.334 2.242 2.974 . 0 0 "[ . 1 . 2]" 1
1973 1 32 PRO HG3 1 140 ILE HA 2.900 . 4.000 2.194 1.842 2.900 . 0 0 "[ . 1 . 2]" 1
1974 1 73 GLU HB2 1 74 PRO HA 3.300 . 6.000 4.865 4.762 5.039 . 0 0 "[ . 1 . 2]" 1
1975 1 145 GLN HA 1 148 ILE HB 2.500 . 3.300 2.560 2.214 2.852 . 0 0 "[ . 1 . 2]" 1
1976 1 145 GLN HA 1 145 GLN HB3 2.900 . 3.900 2.305 2.064 2.374 . 0 0 "[ . 1 . 2]" 1
1977 1 145 GLN HA 1 145 GLN HB2 2.600 . 3.400 3.017 2.995 3.027 . 0 0 "[ . 1 . 2]" 1
1978 1 10 VAL QG 1 145 GLN HA 3.300 . 4.700 3.777 3.177 4.499 . 0 0 "[ . 1 . 2]" 1
1979 1 145 GLN HA 1 148 ILE H 3.000 . 4.100 3.609 3.419 3.846 . 0 0 "[ . 1 . 2]" 1
1980 1 144 PHE HA 1 144 PHE HB2 2.900 . 4.000 2.435 2.377 2.801 . 0 0 "[ . 1 . 2]" 1
1981 1 141 LEU HA 1 144 PHE HA 3.900 . 5.900 4.812 4.531 5.090 . 0 0 "[ . 1 . 2]" 1
1982 1 144 PHE HA 1 144 PHE HB3 2.500 . 3.300 3.020 2.911 3.033 . 0 0 "[ . 1 . 2]" 1
1983 1 20 PHE H 1 20 PHE HA 2.700 . 3.600 2.844 2.807 2.859 . 0 0 "[ . 1 . 2]" 1
1984 1 20 PHE HA 1 24 LEU H 2.900 . 4.000 3.842 3.617 4.030 0.030 14 0 "[ . 1 . 2]" 1
1985 1 20 PHE HA 1 21 LYS H 2.800 . 3.800 3.548 3.517 3.565 . 0 0 "[ . 1 . 2]" 1
1986 1 20 PHE HA 1 101 PHE QD 3.500 . 5.000 4.286 3.983 4.654 . 0 0 "[ . 1 . 2]" 1
1987 1 20 PHE HA 1 20 PHE HB3 2.900 . 3.900 3.019 3.013 3.025 . 0 0 "[ . 1 . 2]" 1
1988 1 20 PHE HA 1 74 PRO HG3 4.500 . 6.000 5.616 5.299 6.005 0.005 14 0 "[ . 1 . 2]" 1
1989 1 142 GLN HB3 1 143 SER HB3 3.400 . 6.000 5.838 5.122 6.389 0.389 20 0 "[ . 1 . 2]" 1
1990 1 32 PRO HG3 1 143 SER HB3 3.500 . 5.000 3.480 2.159 4.459 . 0 0 "[ . 1 . 2]" 1
1991 1 16 ARG HA 1 109 THR HB 2.800 . 3.700 3.125 2.914 3.331 . 0 0 "[ . 1 . 2]" 1
1992 1 16 ARG HA 1 19 ALA MB 2.500 . 3.300 2.260 2.034 2.481 . 0 0 "[ . 1 . 2]" 1
1993 1 16 ARG HA 1 20 PHE HB3 3.000 . 6.000 5.399 5.157 5.618 . 0 0 "[ . 1 . 2]" 1
1994 1 16 ARG HA 1 16 ARG HD2 3.500 . 5.000 4.649 4.504 4.843 . 0 0 "[ . 1 . 2]" 1
1995 1 118 PHE HA 1 118 PHE QD 2.900 . 3.900 2.681 1.926 3.731 . 0 0 "[ . 1 . 2]" 1
1996 1 79 ILE HA 1 80 GLY H 2.300 . 3.000 2.180 2.140 2.251 . 0 0 "[ . 1 . 2]" 1
1997 1 125 HIS HA 1 125 HIS HD2 2.800 . 3.800 2.997 2.497 3.838 0.038 11 0 "[ . 1 . 2]" 1
1998 1 125 HIS HA 1 126 ALA HA 3.000 . 6.000 4.725 4.657 4.805 . 0 0 "[ . 1 . 2]" 1
1999 1 13 LYS HA 1 14 ALA H 2.600 . 3.400 2.999 2.599 3.207 . 0 0 "[ . 1 . 2]" 1
2000 1 13 LYS HA 1 13 LYS HB2 2.900 . 4.000 2.702 2.471 3.024 . 0 0 "[ . 1 . 2]" 1
2001 1 13 LYS HA 1 13 LYS QE 3.600 . 5.200 4.437 3.716 5.264 0.064 18 0 "[ . 1 . 2]" 1
2002 1 51 GLY H 1 51 GLY HA2 2.800 . 3.800 2.378 2.310 2.546 . 0 0 "[ . 1 . 2]" 1
2003 1 51 GLY HA2 1 68 ILE HB 2.300 . 3.000 2.875 2.373 3.372 0.372 6 0 "[ . 1 . 2]" 1
2004 1 135 LYS H 1 136 GLY QA 3.600 . 4.800 4.070 3.846 4.368 . 0 0 "[ . 1 . 2]" 1
2005 1 75 ASP HB2 1 101 PHE HB2 3.600 . 5.200 5.183 4.927 5.296 0.096 3 0 "[ . 1 . 2]" 1
2006 1 73 GLU QG 1 75 ASP HB2 2.800 . 3.800 2.721 2.195 3.903 0.103 3 0 "[ . 1 . 2]" 1
2007 1 75 ASP HB2 1 76 THR MG 3.400 . 4.900 4.789 4.633 4.941 0.041 10 0 "[ . 1 . 2]" 1
2008 1 16 ARG HD3 1 101 PHE HA 3.400 . 6.000 4.461 4.249 4.594 . 0 0 "[ . 1 . 2]" 1
2009 1 16 ARG HD3 1 109 THR MG 2.900 . 4.000 2.805 2.428 3.223 . 0 0 "[ . 1 . 2]" 1
2010 1 16 ARG HD3 1 101 PHE HB2 3.300 . 4.700 3.299 2.933 3.611 . 0 0 "[ . 1 . 2]" 1
2011 1 16 ARG QB 1 16 ARG HD3 2.600 . 3.500 2.114 2.078 2.150 . 0 0 "[ . 1 . 2]" 1
2012 1 16 ARG HD3 1 103 ALA MB 2.600 . 3.500 2.518 2.055 3.057 . 0 0 "[ . 1 . 2]" 1
2013 1 75 ASP HB3 1 101 PHE HB2 3.400 . 6.000 5.394 5.196 5.545 . 0 0 "[ . 1 . 2]" 1
2014 1 73 GLU QG 1 75 ASP HB3 2.900 . 3.900 2.618 2.250 3.914 0.014 3 0 "[ . 1 . 2]" 1
2015 1 75 ASP HB3 1 76 THR MG 3.000 . 4.100 4.100 4.011 4.172 0.072 15 0 "[ . 1 . 2]" 1
2016 1 25 GLU H 1 25 GLU QG . . 2.900 2.434 2.086 2.757 . 0 0 "[ . 1 . 2]" 1
2017 1 24 LEU HB2 1 25 GLU QG 3.800 . 5.600 4.293 3.931 4.513 . 0 0 "[ . 1 . 2]" 1
2018 1 25 GLU QG 1 48 LYS QD 2.400 . 3.100 2.423 1.536 3.065 0.164 20 0 "[ . 1 . 2]" 1
2019 1 131 ASN H 1 131 ASN HB3 3.200 . 4.500 2.979 2.591 3.362 . 0 0 "[ . 1 . 2]" 1
2020 1 69 ARG QD 1 96 GLU QG 3.200 . 4.500 3.215 2.598 4.240 . 0 0 "[ . 1 . 2]" 1
2021 1 96 GLU QG 1 97 PHE H 3.300 . 4.600 3.340 2.395 4.340 . 0 0 "[ . 1 . 2]" 1
2022 1 96 GLU HA 1 96 GLU QG 2.900 . 3.900 2.548 2.308 2.757 . 0 0 "[ . 1 . 2]" 1
2023 1 13 LYS H 1 13 LYS QG . . 2.900 2.292 1.763 2.948 0.137 14 0 "[ . 1 . 2]" 1
2024 1 89 ILE MD 1 89 ILE MG 2.700 . 3.600 2.242 1.897 3.245 . 0 0 "[ . 1 . 2]" 1
2025 1 89 ILE MG 1 131 ASN HD21 2.700 . 3.600 2.999 1.830 3.673 0.073 13 0 "[ . 1 . 2]" 1
2026 1 1 ASN HA 1 1 ASN HB2 2.600 . 3.400 2.550 2.415 3.028 . 0 0 "[ . 1 . 2]" 1
2027 1 1 ASN HA 1 1 ASN HB3 2.600 . 3.400 2.421 2.343 2.511 . 0 0 "[ . 1 . 2]" 1
2028 1 33 ASN HA 1 33 ASN HB2 2.700 . 3.600 2.475 2.262 2.632 . 0 0 "[ . 1 . 2]" 1
2029 1 86 PHE HA 1 86 PHE HB2 2.700 . 3.600 2.552 2.345 3.021 . 0 0 "[ . 1 . 2]" 1
2030 1 86 PHE HB2 1 86 PHE QD 2.900 . 4.000 2.499 2.269 2.761 . 0 0 "[ . 1 . 2]" 1
2031 1 146 ASP H 1 146 ASP HB3 3.200 . 4.500 2.741 2.413 3.555 . 0 0 "[ . 1 . 2]" 1
2032 1 146 ASP H 1 146 ASP HB2 2.500 . 3.300 2.453 2.131 2.634 . 0 0 "[ . 1 . 2]" 1
2033 1 104 ASP QB 1 108 LYS HB2 3.900 . 5.800 3.229 2.778 3.388 . 0 0 "[ . 1 . 2]" 1
2034 1 104 ASP QB 1 108 LYS HB3 2.400 . 3.000 1.628 1.515 1.901 0.185 8 0 "[ . 1 . 2]" 1
2035 1 104 ASP H 1 104 ASP QB 3.300 . 3.300 2.512 2.349 2.633 . 0 0 "[ . 1 . 2]" 1
2036 1 77 LEU HA 1 77 LEU QB 2.600 . 3.400 2.311 2.271 2.339 . 0 0 "[ . 1 . 2]" 1
2037 1 77 LEU HB2 1 97 PHE QD 3.000 . 6.000 5.562 5.308 5.968 . 0 0 "[ . 1 . 2]" 1
2038 1 77 LEU QB 1 78 VAL H 3.200 . 4.500 3.304 3.098 3.475 . 0 0 "[ . 1 . 2]" 1
2039 1 77 LEU H 1 77 LEU HB2 2.600 . 3.400 2.873 2.720 2.970 . 0 0 "[ . 1 . 2]" 1
2040 1 77 LEU HB2 1 77 LEU QD 2.500 . 3.300 2.043 2.022 2.061 . 0 0 "[ . 1 . 2]" 1
2041 1 24 LEU QD 1 77 LEU HB3 2.900 . 3.900 3.467 3.228 3.684 . 0 0 "[ . 1 . 2]" 1
2042 1 16 ARG HG2 1 74 PRO HD2 2.200 . 6.000 5.821 5.480 6.101 0.101 3 0 "[ . 1 . 2]" 1
2043 1 51 GLY H 1 51 GLY HA3 2.400 . 3.100 2.922 2.875 2.963 . 0 0 "[ . 1 . 2]" 1
2044 1 51 GLY HA3 1 68 ILE HB 2.900 . 4.000 2.609 2.101 3.149 . 0 0 "[ . 1 . 2]" 1
2045 1 14 ALA HA 1 107 LYS HA 2.800 . 3.800 3.722 3.024 4.003 0.203 6 0 "[ . 1 . 2]" 1
2046 1 72 ASP HA 1 73 GLU H 2.800 . 3.800 2.428 2.113 2.585 . 0 0 "[ . 1 . 2]" 1
2047 1 67 LEU HA 1 67 LEU QD 3.600 . 5.200 3.220 2.889 3.379 . 0 0 "[ . 1 . 2]" 1
2048 1 67 LEU HA 1 68 ILE H 2.500 . 3.300 2.245 2.174 2.373 . 0 0 "[ . 1 . 2]" 1
2049 1 44 LEU HA 1 56 ILE H 3.900 . 5.800 5.268 2.859 5.953 0.153 13 0 "[ . 1 . 2]" 1
2050 1 72 ASP H 1 72 ASP HA 2.800 . 3.800 2.942 2.930 2.952 . 0 0 "[ . 1 . 2]" 1
2051 1 104 ASP H 1 104 ASP HA 2.800 . 3.700 2.940 2.931 2.949 . 0 0 "[ . 1 . 2]" 1
2052 1 88 ARG HA 1 88 ARG HB2 2.700 . 3.600 2.771 2.315 3.025 . 0 0 "[ . 1 . 2]" 1
2053 1 34 ASN HA 1 34 ASN QB 3.100 . 4.300 2.265 2.149 2.385 . 0 0 "[ . 1 . 2]" 1
2054 1 15 ASP HA 1 15 ASP HB2 2.600 . 3.500 2.445 2.361 2.626 . 0 0 "[ . 1 . 2]" 1
2055 1 88 ARG HA 1 89 ILE HA 3.100 . 6.000 4.346 4.202 4.453 . 0 0 "[ . 1 . 2]" 1
2056 1 34 ASN HA 1 35 PHE H 2.800 . 3.800 2.960 2.393 3.365 . 0 0 "[ . 1 . 2]" 1
2057 1 103 ALA HA 1 104 ASP H 2.500 . 3.300 2.159 2.095 2.261 . 0 0 "[ . 1 . 2]" 1
2058 1 77 LEU HA 1 78 VAL H 2.500 . 3.300 2.158 2.128 2.192 . 0 0 "[ . 1 . 2]" 1
2059 1 72 ASP H 1 77 LEU HA 2.600 . 3.500 2.927 2.570 3.112 . 0 0 "[ . 1 . 2]" 1
2060 1 76 THR H 1 77 LEU HA 2.900 . 6.000 4.859 4.699 4.942 . 0 0 "[ . 1 . 2]" 1
2061 1 71 VAL HA 1 77 LEU HA 2.700 . 3.600 3.010 2.689 3.354 . 0 0 "[ . 1 . 2]" 1
2062 1 70 LYS HG3 1 77 LEU HA 3.600 . 5.200 5.157 4.526 5.342 0.142 13 0 "[ . 1 . 2]" 1
2063 1 16 ARG HB3 1 103 ALA HA 2.800 . 6.000 4.130 3.723 4.285 . 0 0 "[ . 1 . 2]" 1
2064 1 102 VAL QG 1 103 ALA HA 3.300 . 4.600 4.149 4.072 4.257 . 0 0 "[ . 1 . 2]" 1
2065 1 16 ARG HD3 1 103 ALA HA 2.500 . 3.300 3.246 2.871 3.491 0.191 19 0 "[ . 1 . 2]" 1
2066 1 121 MET HA 1 125 HIS QB 3.300 . 6.000 4.796 4.412 5.713 . 0 0 "[ . 1 . 2]" 1
2067 1 77 LEU HA 1 77 LEU QD 2.700 . 3.600 2.491 2.088 2.643 . 0 0 "[ . 1 . 2]" 1
2068 1 44 LEU QD 1 55 GLU HA 4.100 . 6.000 2.653 1.877 3.633 0.023 9 0 "[ . 1 . 2]" 1
2069 1 103 ALA H 1 103 ALA HA 2.600 . 3.500 2.848 2.784 2.880 . 0 0 "[ . 1 . 2]" 1
2070 1 103 ALA HA 1 110 ARG H 3.400 . 4.900 4.279 3.849 4.646 . 0 0 "[ . 1 . 2]" 1
2071 1 73 GLU HA 1 73 GLU HB3 2.800 . 3.800 2.449 2.384 2.538 . 0 0 "[ . 1 . 2]" 1
2072 1 73 GLU HA 1 73 GLU HB2 2.500 . 3.300 2.410 2.346 2.469 . 0 0 "[ . 1 . 2]" 1
2073 1 83 LEU HA 1 84 ASN H 2.500 . 3.300 2.474 2.125 3.344 0.044 12 0 "[ . 1 . 2]" 1
2074 1 7 ARG HG3 1 114 GLU HA 2.600 . 6.000 3.812 3.468 4.264 . 0 0 "[ . 1 . 2]" 1
2075 1 52 ARG HA 1 68 ILE HB 3.100 . 4.300 3.836 3.048 4.308 0.008 11 0 "[ . 1 . 2]" 1
2076 1 7 ARG HA 1 7 ARG HB2 2.800 . 3.800 2.181 2.149 2.219 . 0 0 "[ . 1 . 2]" 1
2077 1 107 LYS HA 1 108 LYS H 2.800 . 3.800 3.092 2.611 3.409 . 0 0 "[ . 1 . 2]" 1
2078 1 15 ASP H 1 107 LYS HA 2.600 . 3.500 3.249 2.792 3.508 0.008 2 0 "[ . 1 . 2]" 1
2079 1 107 LYS HA 1 107 LYS QB 2.600 . 3.400 2.312 2.161 2.518 . 0 0 "[ . 1 . 2]" 1
2080 1 15 ASP HA 1 107 LYS HA 3.000 . 4.100 3.352 2.803 3.738 . 0 0 "[ . 1 . 2]" 1
2081 1 30 TRP H 1 30 TRP HA 2.600 . 3.400 2.873 2.831 2.942 . 0 0 "[ . 1 . 2]" 1
2082 1 30 TRP HA 1 30 TRP HB3 2.900 . 4.000 2.389 2.298 2.456 . 0 0 "[ . 1 . 2]" 1
2083 1 86 PHE HA 1 86 PHE QD 2.900 . 3.900 2.633 2.142 3.726 . 0 0 "[ . 1 . 2]" 1
2084 1 108 LYS H 1 108 LYS HA 2.600 . 3.500 2.943 2.929 2.954 . 0 0 "[ . 1 . 2]" 1
2085 1 14 ALA H 1 108 LYS HA 2.700 . 3.600 3.572 3.263 3.671 0.071 9 0 "[ . 1 . 2]" 1
2086 1 108 LYS HA 1 109 THR H 2.500 . 3.300 2.315 2.236 2.386 . 0 0 "[ . 1 . 2]" 1
2087 1 13 LYS HA 1 108 LYS HA 2.600 . 3.400 2.988 2.618 3.455 0.055 19 0 "[ . 1 . 2]" 1
2088 1 108 LYS HA 1 108 LYS HB2 2.500 . 3.300 2.546 2.405 2.874 . 0 0 "[ . 1 . 2]" 1
2089 1 108 LYS HA 1 108 LYS HB3 2.900 . 3.900 3.005 2.832 3.032 . 0 0 "[ . 1 . 2]" 1
2090 1 61 GLU HA 1 61 GLU QG 2.600 . 3.400 2.489 2.174 3.227 . 0 0 "[ . 1 . 2]" 1
2091 1 141 LEU HA 1 141 LEU HB3 2.800 . 3.800 2.476 2.434 2.647 . 0 0 "[ . 1 . 2]" 1
2092 1 69 ARG HA 1 69 ARG QD 3.000 . 4.100 2.804 2.102 4.059 . 0 0 "[ . 1 . 2]" 1
2093 1 146 ASP HA 1 154 LYS HE2 2.900 . 4.000 3.820 2.659 4.457 0.457 3 0 "[ . 1 . 2]" 1
2094 1 141 LEU HA 1 142 GLN HE21 3.200 . 6.000 4.961 4.357 5.702 . 0 0 "[ . 1 . 2]" 1
2095 1 135 LYS H 1 135 LYS HA 2.800 . 3.800 2.933 2.870 2.950 . 0 0 "[ . 1 . 2]" 1
2096 1 69 ARG H 1 69 ARG HA 2.700 . 3.600 2.926 2.893 2.946 . 0 0 "[ . 1 . 2]" 1
2097 1 155 LYS H 1 155 LYS HA 2.700 . 3.600 2.776 2.256 2.941 . 0 0 "[ . 1 . 2]" 1
2098 1 95 SER HA 1 95 SER HB3 2.700 . 3.600 2.623 2.379 3.035 . 0 0 "[ . 1 . 2]" 1
2099 1 95 SER HA 1 118 PHE QB 3.000 . 3.600 2.357 1.928 2.909 . 0 0 "[ . 1 . 2]" 1
2100 1 155 LYS HA 1 155 LYS QG 3.100 . 4.300 2.885 2.348 3.500 . 0 0 "[ . 1 . 2]" 1
2101 1 12 VAL HA 1 13 LYS QD 2.900 . 4.000 2.778 2.298 3.990 . 0 0 "[ . 1 . 2]" 1
2102 1 12 VAL HA 1 12 VAL HB 2.700 . 3.600 2.930 2.285 3.027 . 0 0 "[ . 1 . 2]" 1
2103 1 12 VAL HA 1 145 GLN HB3 3.400 . 4.800 3.885 3.023 4.268 . 0 0 "[ . 1 . 2]" 1
2104 1 125 HIS HA 1 128 ARG HB2 3.900 . 5.800 5.057 4.688 5.523 . 0 0 "[ . 1 . 2]" 1
2105 1 151 GLU HA 1 151 GLU QG 3.500 . 4.300 3.045 2.657 3.343 . 0 0 "[ . 1 . 2]" 1
2106 1 95 SER HA 1 118 PHE QD 3.200 . 4.500 3.690 1.881 4.669 0.169 8 0 "[ . 1 . 2]" 1
2107 1 75 ASP HA 1 101 PHE H 3.100 . 4.300 3.974 3.728 4.157 . 0 0 "[ . 1 . 2]" 1
2108 1 145 GLN H 1 145 GLN HA 2.600 . 3.500 2.815 2.781 2.863 . 0 0 "[ . 1 . 2]" 1
2109 1 46 VAL HA 1 46 VAL HB 2.700 . 3.600 3.026 3.018 3.031 . 0 0 "[ . 1 . 2]" 1
2110 1 27 PHE H 1 27 PHE HA 2.600 . 3.400 2.764 2.715 2.903 . 0 0 "[ . 1 . 2]" 1
2111 1 27 PHE HA 1 27 PHE HB3 2.700 . 3.600 3.015 2.971 3.027 . 0 0 "[ . 1 . 2]" 1
2112 1 56 ILE HA 1 57 ASP H 2.400 . 3.100 2.170 2.123 2.275 . 0 0 "[ . 1 . 2]" 1
2113 1 56 ILE HA 1 61 GLU QG 2.500 . 3.300 2.922 2.443 3.274 . 0 0 "[ . 1 . 2]" 1
2114 1 10 VAL HA 1 11 THR H 2.600 . 3.500 2.197 2.141 2.293 . 0 0 "[ . 1 . 2]" 1
2115 1 10 VAL H 1 10 VAL HA 2.600 . 3.400 2.949 2.925 2.961 . 0 0 "[ . 1 . 2]" 1
2116 1 111 VAL HA 1 112 ASP H 2.500 . 3.300 2.147 2.108 2.190 . 0 0 "[ . 1 . 2]" 1
2117 1 100 THR HA 1 101 PHE HB3 4.200 . 6.000 5.715 5.682 5.766 . 0 0 "[ . 1 . 2]" 1
2118 1 100 THR HA 1 102 VAL MG2 3.300 . 6.000 4.813 4.491 5.067 . 0 0 "[ . 1 . 2]" 1
2119 1 111 VAL HA 1 111 VAL MG2 2.900 . 3.900 2.360 2.286 2.552 . 0 0 "[ . 1 . 2]" 1
2120 1 23 PHE HA 1 30 TRP HE1 2.800 . 6.000 3.903 3.396 4.607 . 0 0 "[ . 1 . 2]" 1
2121 1 71 VAL HA 1 72 ASP H 2.600 . 3.400 2.224 2.165 2.273 . 0 0 "[ . 1 . 2]" 1
2122 1 143 SER H 1 143 SER HA 2.600 . 3.500 2.843 2.818 2.866 . 0 0 "[ . 1 . 2]" 1
2123 1 2 TYR HA 1 6 VAL HA 2.800 . 6.000 4.226 3.334 4.962 . 0 0 "[ . 1 . 2]" 1
2124 1 1 ASN HB2 1 6 VAL HA 2.200 . 2.800 1.885 1.382 2.844 0.218 1 0 "[ . 1 . 2]" 1
2125 1 72 ASP HB2 1 76 THR HA 3.100 . 6.000 5.286 4.034 5.537 . 0 0 "[ . 1 . 2]" 1
2126 1 11 THR H 1 11 THR HA 2.600 . 3.500 2.928 2.904 2.946 . 0 0 "[ . 1 . 2]" 1
2127 1 6 VAL H 1 6 VAL HA 2.600 . 3.400 2.927 2.898 2.946 . 0 0 "[ . 1 . 2]" 1
2128 1 109 THR HA 1 110 ARG H 2.500 . 3.300 2.122 2.091 2.174 . 0 0 "[ . 1 . 2]" 1
2129 1 109 THR H 1 109 THR HA 2.500 . 3.300 2.882 2.870 2.891 . 0 0 "[ . 1 . 2]" 1
2130 1 103 ALA HA 1 109 THR HA 2.900 . 3.900 2.853 2.581 3.356 . 0 0 "[ . 1 . 2]" 1
2131 1 109 THR HA 1 109 THR HB 2.700 . 3.600 3.021 3.012 3.026 . 0 0 "[ . 1 . 2]" 1
2132 1 108 LYS HB3 1 109 THR HA 3.100 . 6.000 4.311 3.783 4.668 . 0 0 "[ . 1 . 2]" 1
2133 1 103 ALA MB 1 109 THR HA 3.700 . 5.400 4.428 4.193 4.822 . 0 0 "[ . 1 . 2]" 1
2134 1 102 VAL QG 1 109 THR HA 3.600 . 5.200 4.374 4.182 4.731 . 0 0 "[ . 1 . 2]" 1
2135 1 137 TRP HA 1 140 ILE HB 2.200 . 2.800 2.417 2.010 2.858 0.058 18 0 "[ . 1 . 2]" 1
2136 1 89 ILE HA 1 89 ILE HG13 3.400 . 4.900 3.630 3.465 3.731 . 0 0 "[ . 1 . 2]" 1
2137 1 89 ILE HA 1 90 ASP H 2.600 . 3.500 2.164 2.095 2.258 . 0 0 "[ . 1 . 2]" 1
2138 1 104 ASP H 1 109 THR HA 2.800 . 3.800 2.757 2.148 3.416 . 0 0 "[ . 1 . 2]" 1
2139 1 4 PRO HA 1 4 PRO HB3 2.600 . 3.500 2.278 2.235 2.301 . 0 0 "[ . 1 . 2]" 1
2140 1 4 PRO HA 1 120 ARG QB 2.800 . 6.000 4.789 3.783 5.460 . 0 0 "[ . 1 . 2]" 1
2141 1 73 GLU HB3 1 74 PRO HA 3.100 . 4.300 4.172 3.829 4.812 0.512 3 1 "[ + . 1 . 2]" 1
2142 1 94 SER QB 1 95 SER H 2.800 . 3.800 1.974 1.472 3.321 0.328 8 0 "[ . 1 . 2]" 1
2143 1 139 THR HA 1 142 GLN QB 2.900 . 3.900 3.113 2.771 3.457 . 0 0 "[ . 1 . 2]" 1
2144 1 139 THR H 1 139 THR HA 2.800 . 3.800 2.837 2.792 2.874 . 0 0 "[ . 1 . 2]" 1
2145 1 9 SER QB 1 10 VAL H 3.600 . 5.200 3.570 3.303 3.911 . 0 0 "[ . 1 . 2]" 1
2146 1 9 SER H 1 9 SER QB 2.800 . 3.800 2.778 2.623 3.220 . 0 0 "[ . 1 . 2]" 1
2147 1 8 HIS HA 1 9 SER QB 3.400 . 4.800 4.243 3.893 4.468 . 0 0 "[ . 1 . 2]" 1
2148 1 139 THR HA 1 139 THR HB 2.900 . 4.000 3.029 3.009 3.041 . 0 0 "[ . 1 . 2]" 1
2149 1 22 THR HA 1 29 GLU QG 3.400 . 6.000 4.276 3.326 5.152 . 0 0 "[ . 1 . 2]" 1
2150 1 21 LYS HB3 1 22 THR HA 3.100 . 6.000 4.412 3.993 5.207 . 0 0 "[ . 1 . 2]" 1
2151 1 139 THR H 1 139 THR HB 2.600 . 3.400 2.530 2.260 2.710 . 0 0 "[ . 1 . 2]" 1
2152 1 38 THR HB 1 39 LYS H 3.100 . 4.300 4.327 3.724 4.437 0.137 9 0 "[ . 1 . 2]" 1
2153 1 109 THR H 1 109 THR HB 2.500 . 3.300 2.946 2.911 2.982 . 0 0 "[ . 1 . 2]" 1
2154 1 98 THR HB 1 114 GLU H 2.700 . 3.600 3.087 2.857 3.327 . 0 0 "[ . 1 . 2]" 1
2155 1 98 THR HA 1 98 THR HB 2.700 . 3.600 3.028 3.019 3.034 . 0 0 "[ . 1 . 2]" 1
2156 1 135 LYS QE 1 139 THR HB 2.200 . 6.000 5.502 4.089 5.911 . 0 0 "[ . 1 . 2]" 1
2157 1 138 PRO HG2 1 139 THR HB 3.200 . 4.400 4.395 4.049 4.439 0.039 17 0 "[ . 1 . 2]" 1
2158 1 22 THR HA 1 148 ILE HG12 3.400 . 6.000 5.070 4.774 5.486 . 0 0 "[ . 1 . 2]" 1
2159 1 18 THR HA 1 19 ALA H 2.900 . 3.900 3.529 3.506 3.555 . 0 0 "[ . 1 . 2]" 1
2160 1 9 SER QB 1 112 ASP HA 3.100 . 4.300 3.724 2.797 4.319 0.019 20 0 "[ . 1 . 2]" 1
2161 1 8 HIS HB2 1 9 SER QB 3.600 . 6.000 5.931 5.544 6.322 0.322 10 0 "[ . 1 . 2]" 1
2162 1 94 SER QB 1 96 GLU QB 3.600 . 5.200 3.665 2.458 4.635 . 0 0 "[ . 1 . 2]" 1
2163 1 40 VAL HA 1 42 ALA H 3.400 . 4.800 4.178 3.697 5.231 0.431 9 0 "[ . 1 . 2]" 1
2164 1 40 VAL HA 1 41 GLY QA 3.100 . 6.000 4.121 3.923 4.251 . 0 0 "[ . 1 . 2]" 1
2165 1 74 PRO HA 1 101 PHE QD 2.900 . 4.000 3.990 3.693 4.065 0.065 14 0 "[ . 1 . 2]" 1
2166 1 2 TYR H 1 4 PRO HA 3.700 . 6.000 5.979 5.584 6.172 0.172 1 0 "[ . 1 . 2]" 1
2167 1 4 PRO HA 1 5 PHE H 3.200 . 4.500 3.550 3.531 3.573 . 0 0 "[ . 1 . 2]" 1
2168 1 144 PHE HA 1 145 GLN H 2.900 . 4.000 3.564 3.545 3.587 . 0 0 "[ . 1 . 2]" 1
2169 1 22 THR MG 1 144 PHE HA 2.700 . 3.600 3.285 2.406 3.703 0.103 9 0 "[ . 1 . 2]" 1
2170 1 32 PRO HG3 1 144 PHE HA 3.000 . 4.100 4.183 3.707 4.322 0.222 13 0 "[ . 1 . 2]" 1
2171 1 27 PHE HA 1 46 VAL MG2 3.400 . 4.800 4.243 3.783 4.916 0.116 3 0 "[ . 1 . 2]" 1
2172 1 27 PHE HA 1 34 ASN HD21 3.000 . 6.000 3.870 3.105 6.037 0.037 10 0 "[ . 1 . 2]" 1
2173 1 100 THR HA 1 101 PHE HA 3.200 . 6.000 4.416 4.396 4.432 . 0 0 "[ . 1 . 2]" 1
2174 1 144 PHE HB3 1 145 GLN HA 2.200 . 6.000 4.384 3.749 4.499 . 0 0 "[ . 1 . 2]" 1
2175 1 12 VAL HA 1 145 GLN HA 2.800 . 3.800 3.905 3.752 4.029 0.229 16 0 "[ . 1 . 2]" 1
2176 1 46 VAL HA 1 54 TYR QD 3.100 . 4.300 3.932 3.712 4.119 . 0 0 "[ . 1 . 2]" 1
2177 1 24 LEU HA 1 27 PHE QD 2.700 . 6.000 4.134 3.647 5.049 . 0 0 "[ . 1 . 2]" 1
2178 1 24 LEU H 1 24 LEU HA 2.700 . 3.600 2.943 2.928 2.951 . 0 0 "[ . 1 . 2]" 1
2179 1 142 GLN HA 1 142 GLN HE22 3.500 . 5.100 3.510 3.149 4.101 . 0 0 "[ . 1 . 2]" 1
2180 1 5 PHE HA 1 5 PHE HB3 2.700 . 3.600 2.467 2.389 2.523 . 0 0 "[ . 1 . 2]" 1
2181 1 75 ASP HA 1 76 THR MG 3.000 . 4.100 4.031 3.967 4.120 0.020 1 0 "[ . 1 . 2]" 1
2182 1 125 HIS QB 1 126 ALA HA 3.300 . 4.600 3.833 3.605 3.984 . 0 0 "[ . 1 . 2]" 1
2183 1 12 VAL H 1 12 VAL HA 2.600 . 3.500 2.924 2.909 2.936 . 0 0 "[ . 1 . 2]" 1
2184 1 101 PHE HA 1 102 VAL H 2.400 . 3.100 2.153 2.133 2.164 . 0 0 "[ . 1 . 2]" 1
2185 1 101 PHE HA 1 101 PHE HB2 2.700 . 3.600 3.014 3.009 3.020 . 0 0 "[ . 1 . 2]" 1
2186 1 101 PHE HA 1 101 PHE HB3 2.400 . 3.100 2.569 2.546 2.583 . 0 0 "[ . 1 . 2]" 1
2187 1 101 PHE HA 1 102 VAL HB 3.600 . 5.200 4.698 4.642 4.765 . 0 0 "[ . 1 . 2]" 1
2188 1 101 PHE HA 1 109 THR MG 3.000 . 4.100 2.956 2.710 3.090 . 0 0 "[ . 1 . 2]" 1
2189 1 154 LYS HA 1 154 LYS HB2 2.600 . 3.500 2.465 2.285 2.602 . 0 0 "[ . 1 . 2]" 1
2190 1 154 LYS HA 1 154 LYS HG2 3.000 . 4.100 3.229 2.439 3.982 . 0 0 "[ . 1 . 2]" 1
2191 1 81 TRP HA 1 81 TRP HB3 2.600 . 3.400 3.016 3.001 3.025 . 0 0 "[ . 1 . 2]" 1
2192 1 54 TYR HA 1 55 GLU H 2.600 . 3.500 2.377 2.162 2.681 . 0 0 "[ . 1 . 2]" 1
2193 1 7 ARG HA 1 114 GLU HA 2.600 . 3.400 3.241 2.788 3.495 0.095 7 0 "[ . 1 . 2]" 1
2194 1 7 ARG HA 1 8 HIS HA 3.200 . 4.500 4.383 4.363 4.425 . 0 0 "[ . 1 . 2]" 1
2195 1 7 ARG HA 1 7 ARG QD 3.600 . 5.200 4.082 3.926 4.230 . 0 0 "[ . 1 . 2]" 1
2196 1 53 TRP HA 1 53 TRP HD1 2.600 . 3.500 2.961 2.668 3.776 0.276 20 0 "[ . 1 . 2]" 1
2197 1 3 ASP HA 1 4 PRO HD2 3.300 . 4.600 4.301 3.951 4.513 . 0 0 "[ . 1 . 2]" 1
2198 1 3 ASP HA 1 4 PRO HD3 3.400 . 4.800 3.845 3.722 4.143 . 0 0 "[ . 1 . 2]" 1
2199 1 4 PRO HB3 1 4 PRO HD2 3.500 . 5.000 3.935 3.891 3.962 . 0 0 "[ . 1 . 2]" 1
2200 1 4 PRO HB3 1 4 PRO HD3 3.000 . 4.100 3.635 3.078 3.876 . 0 0 "[ . 1 . 2]" 1
2201 1 3 ASP HA 1 4 PRO HB3 3.500 . 6.000 5.993 5.826 6.151 0.151 16 0 "[ . 1 . 2]" 1
2202 1 3 ASP HA 1 4 PRO HG2 3.800 . 6.000 6.124 5.855 6.192 0.192 9 0 "[ . 1 . 2]" 1
2203 1 91 PRO HD2 1 92 ASP H 2.600 . 3.400 2.670 1.857 3.480 0.080 4 0 "[ . 1 . 2]" 1
2204 1 28 PRO QD 1 34 ASN QB 3.100 . 6.000 5.080 4.564 5.519 . 0 0 "[ . 1 . 2]" 1
2205 1 28 PRO HB3 1 28 PRO QD 2.700 . 3.600 2.905 2.798 3.203 . 0 0 "[ . 1 . 2]" 1
2206 1 28 PRO QD 1 46 VAL MG2 3.700 . 5.400 4.229 3.934 4.829 . 0 0 "[ . 1 . 2]" 1
2207 1 84 ASN H 1 84 ASN HA 2.800 . 3.800 2.901 2.745 2.948 . 0 0 "[ . 1 . 2]" 1
2208 1 31 TRP HA 1 32 PRO HD2 2.900 . 4.000 3.756 3.413 3.917 . 0 0 "[ . 1 . 2]" 1
2209 1 32 PRO HD2 1 140 ILE QG 3.300 . 6.000 4.780 4.338 5.455 . 0 0 "[ . 1 . 2]" 1
2210 1 77 LEU HB3 1 79 ILE MG 2.500 . 3.300 3.193 2.873 3.400 0.100 9 0 "[ . 1 . 2]" 1
2211 1 77 LEU HB2 1 99 VAL QG 2.800 . 3.800 2.622 2.179 2.816 . 0 0 "[ . 1 . 2]" 1
2212 1 152 GLY QA 1 153 ALA H 2.900 . 4.000 2.480 2.297 2.826 . 0 0 "[ . 1 . 2]" 1
2213 1 26 GLY H 1 26 GLY HA3 2.600 . 3.400 2.472 2.328 2.683 . 0 0 "[ . 1 . 2]" 1
2214 1 26 GLY HA3 1 29 GLU HG2 2.600 . 3.400 2.699 2.176 3.175 . 0 0 "[ . 1 . 2]" 1
2215 1 56 ILE MG 1 60 GLY HA3 3.600 . 6.000 5.461 4.565 6.109 0.109 10 0 "[ . 1 . 2]" 1
2216 1 60 GLY HA3 1 62 GLU H 3.500 . 6.000 4.530 3.729 5.638 . 0 0 "[ . 1 . 2]" 1
2217 1 50 GLY H 1 50 GLY HA3 2.600 . 3.400 2.359 2.310 2.459 . 0 0 "[ . 1 . 2]" 1
2218 1 56 ILE MG 1 60 GLY HA2 2.900 . 6.000 4.266 3.441 4.947 . 0 0 "[ . 1 . 2]" 1
2219 1 3 ASP H 1 3 ASP HB3 3.000 . 4.100 2.570 2.408 3.493 . 0 0 "[ . 1 . 2]" 1
2220 1 149 ASP HA 1 149 ASP QB 2.600 . 3.400 2.409 2.340 2.451 . 0 0 "[ . 1 . 2]" 1
2221 1 72 ASP HB2 1 77 LEU QD 3.100 . 6.000 4.643 3.799 4.983 . 0 0 "[ . 1 . 2]" 1
2222 1 78 VAL QG 1 96 GLU QG 2.800 . 3.800 2.724 1.996 3.685 . 0 0 "[ . 1 . 2]" 1
2223 1 58 GLU H 1 58 GLU HG2 2.400 . 3.100 2.005 1.793 3.070 . 0 0 "[ . 1 . 2]" 1
2224 1 58 GLU HA 1 58 GLU HG2 3.600 . 5.200 3.737 3.636 4.146 . 0 0 "[ . 1 . 2]" 1
2225 1 58 GLU HA 1 58 GLU HG3 3.500 . 5.000 3.769 3.593 3.890 . 0 0 "[ . 1 . 2]" 1
2226 1 104 ASP H 1 108 LYS HB3 3.300 . 4.600 3.853 3.542 4.501 . 0 0 "[ . 1 . 2]" 1
2227 1 68 ILE HB 1 68 ILE MD 2.700 . 3.600 2.347 2.286 2.408 . 0 0 "[ . 1 . 2]" 1
2228 1 150 GLU H 1 150 GLU QG 2.500 . 3.300 2.276 2.077 2.803 . 0 0 "[ . 1 . 2]" 1
2229 1 59 GLN H 1 59 GLN HG3 3.400 . 4.800 3.805 2.005 4.482 . 0 0 "[ . 1 . 2]" 1
2230 1 59 GLN QE 1 59 GLN HG2 3.300 . 4.000 2.622 2.142 3.306 . 0 0 "[ . 1 . 2]" 1
2231 1 59 GLN HA 1 59 GLN HG3 3.700 . 5.500 4.143 3.721 4.264 . 0 0 "[ . 1 . 2]" 1
2232 1 71 VAL H 1 71 VAL HB 2.700 . 3.600 2.781 2.579 3.659 0.059 20 0 "[ . 1 . 2]" 1
2233 1 113 VAL H 1 113 VAL HB 2.400 . 3.100 2.339 2.240 2.434 . 0 0 "[ . 1 . 2]" 1
2234 1 21 LYS H 1 21 LYS HB2 2.700 . 3.600 2.682 2.427 3.291 . 0 0 "[ . 1 . 2]" 1
2235 1 21 LYS HA 1 21 LYS HB2 2.400 . 3.100 2.377 2.239 2.496 . 0 0 "[ . 1 . 2]" 1
2236 1 124 LYS HA 1 124 LYS HB2 2.800 . 3.800 2.746 2.388 3.026 . 0 0 "[ . 1 . 2]" 1
2237 1 124 LYS HA 1 124 LYS HB3 2.700 . 3.600 2.697 2.319 3.028 . 0 0 "[ . 1 . 2]" 1
2238 1 73 GLU H 1 73 GLU HB2 3.500 . 5.000 3.912 3.615 3.950 . 0 0 "[ . 1 . 2]" 1
2239 1 73 GLU H 1 73 GLU HB3 2.700 . 3.600 2.910 2.404 2.968 . 0 0 "[ . 1 . 2]" 1
2240 1 61 GLU H 1 61 GLU QB 3.000 . 4.100 3.113 2.675 3.368 . 0 0 "[ . 1 . 2]" 1
2241 1 151 GLU H 1 151 GLU HB3 3.500 . 5.000 3.516 1.996 3.631 0.004 5 0 "[ . 1 . 2]" 1
2242 1 151 GLU H 1 151 GLU HB2 2.600 . 3.400 2.573 2.250 2.931 . 0 0 "[ . 1 . 2]" 1
2243 1 58 GLU H 1 58 GLU HB3 2.700 . 3.600 2.709 2.562 2.859 . 0 0 "[ . 1 . 2]" 1
2244 1 150 GLU H 1 150 GLU QB 2.700 . 3.600 2.413 2.153 2.552 . 0 0 "[ . 1 . 2]" 1
2245 1 46 VAL MG2 1 54 TYR QD 4.000 . 6.000 5.442 5.217 5.655 . 0 0 "[ . 1 . 2]" 1
2246 1 46 VAL MG2 1 54 TYR HA 3.500 . 6.000 5.820 5.544 6.190 0.190 3 0 "[ . 1 . 2]" 1
2247 1 46 VAL HA 1 46 VAL MG2 2.700 . 3.600 2.380 2.323 2.433 . 0 0 "[ . 1 . 2]" 1
2248 1 40 VAL QG 1 41 GLY QA 3.200 . 6.000 3.488 3.033 3.879 . 0 0 "[ . 1 . 2]" 1
2249 1 140 ILE MG 1 141 LEU H 2.900 . 3.900 3.119 2.869 3.351 . 0 0 "[ . 1 . 2]" 1
2250 1 38 THR MG 1 58 GLU H 3.000 . 4.100 2.901 1.959 3.754 . 0 0 "[ . 1 . 2]" 1
2251 1 10 VAL QG 1 13 LYS H 3.400 . 6.000 5.327 4.982 5.877 . 0 0 "[ . 1 . 2]" 1
2252 1 102 VAL H 1 111 VAL MG2 2.200 . 6.000 4.248 3.867 4.756 . 0 0 "[ . 1 . 2]" 1
2253 1 38 THR MG 1 63 HIS HD2 3.100 . 4.300 4.313 3.856 4.598 0.298 20 0 "[ . 1 . 2]" 1
2254 1 111 VAL MG1 1 112 ASP HB2 3.500 . 5.000 5.192 4.982 5.726 0.726 3 3 "[ + . *1 - . 2]" 1
2255 1 8 HIS HB2 1 111 VAL MG1 3.200 . 6.000 5.202 4.805 5.919 . 0 0 "[ . 1 . 2]" 1
2256 1 103 ALA H 1 103 ALA MB 2.800 . 3.700 2.249 2.223 2.280 . 0 0 "[ . 1 . 2]" 1
2257 1 103 ALA MB 1 104 ASP H 3.200 . 4.500 2.991 2.727 3.152 . 0 0 "[ . 1 . 2]" 1
2258 1 46 VAL H 1 46 VAL MG1 3.400 . 4.900 3.895 3.856 3.927 . 0 0 "[ . 1 . 2]" 1
2259 1 103 ALA MB 1 110 ARG H 3.800 . 6.000 5.500 5.163 5.721 . 0 0 "[ . 1 . 2]" 1
2260 1 38 THR MG 1 39 LYS H 3.100 . 4.300 4.299 3.879 4.372 0.072 3 0 "[ . 1 . 2]" 1
2261 1 10 VAL QG 1 141 LEU HA 3.100 . 4.300 3.104 2.835 3.421 . 0 0 "[ . 1 . 2]" 1
2262 1 10 VAL QG 1 144 PHE HB3 3.700 . 5.500 3.458 3.020 3.782 . 0 0 "[ . 1 . 2]" 1
2263 1 10 VAL QG 1 111 VAL MG1 3.000 . 4.200 2.087 1.289 2.534 0.511 6 1 "[ .+ 1 . 2]" 1
2264 1 59 GLN H 1 59 GLN HB3 2.500 . 6.000 2.661 2.069 3.062 . 0 0 "[ . 1 . 2]" 1
2265 1 59 GLN HA 1 59 GLN HB3 2.900 . 4.000 2.542 2.297 2.902 . 0 0 "[ . 1 . 2]" 1
2266 1 72 ASP HB3 1 76 THR MG 3.500 . 5.000 4.332 4.170 4.769 . 0 0 "[ . 1 . 2]" 1
2267 1 92 ASP H 1 92 ASP QB 3.000 . 4.100 2.838 2.095 3.121 . 0 0 "[ . 1 . 2]" 1
2268 1 78 VAL HA 1 79 ILE H 2.400 . 3.100 2.152 2.086 2.202 . 0 0 "[ . 1 . 2]" 1
2269 1 78 VAL HA 1 78 VAL QG 2.800 . 3.600 2.150 2.127 2.451 . 0 0 "[ . 1 . 2]" 1
2270 1 27 PHE HB3 1 30 TRP HE1 2.700 . 6.000 6.156 5.754 6.562 0.562 20 1 "[ . 1 . +]" 1
2271 1 30 TRP HE1 1 147 LYS HB2 4.000 . 6.000 5.792 5.214 6.242 0.242 5 0 "[ . 1 . 2]" 1
2272 1 69 ARG H 1 80 GLY H 3.500 . 5.100 3.610 3.390 3.791 . 0 0 "[ . 1 . 2]" 1
2273 1 67 LEU QD 1 80 GLY H 2.800 . 3.800 2.601 1.998 3.474 . 0 0 "[ . 1 . 2]" 1
2274 1 12 VAL H 1 110 ARG H 3.400 . 4.900 3.966 3.880 4.078 . 0 0 "[ . 1 . 2]" 1
2275 1 98 THR H 1 99 VAL H 3.500 . 5.000 3.834 3.684 3.889 . 0 0 "[ . 1 . 2]" 1
2276 1 102 VAL H 1 102 VAL HA 3.000 . 4.100 2.468 2.264 2.687 . 0 0 "[ . 1 . 2]" 1
2277 1 19 ALA MB 1 102 VAL H 4.000 . 6.000 5.063 4.867 5.190 . 0 0 "[ . 1 . 2]" 1
2278 1 102 VAL H 1 102 VAL MG1 4.000 . 6.000 3.546 3.416 3.660 . 0 0 "[ . 1 . 2]" 1
2279 1 37 THR HA 1 38 THR H 2.700 . 3.600 1.973 1.933 2.037 . 0 0 "[ . 1 . 2]" 1
2280 1 12 VAL H 1 19 ALA MB 3.700 . 5.400 4.259 4.043 4.369 . 0 0 "[ . 1 . 2]" 1
2281 1 12 VAL HB 1 13 LYS H 3.300 . 4.700 3.098 2.342 3.460 . 0 0 "[ . 1 . 2]" 1
2282 1 6 VAL H 1 6 VAL HA 2.800 . 3.800 2.832 2.652 2.923 . 0 0 "[ . 1 . 2]" 1
2283 1 2 TYR H 1 6 VAL H 3.300 . 4.700 4.139 2.768 4.811 0.111 12 0 "[ . 1 . 2]" 1
2284 1 72 ASP H 1 77 LEU H 3.700 . 5.400 4.299 4.168 4.388 . 0 0 "[ . 1 . 2]" 1
2285 1 20 PHE QD 1 77 LEU H 3.900 . 5.800 4.516 4.234 4.749 . 0 0 "[ . 1 . 2]" 1
2286 1 77 LEU H 1 77 LEU HA 2.900 . 4.000 2.900 2.865 2.923 . 0 0 "[ . 1 . 2]" 1
2287 1 67 LEU H 1 67 LEU HA 3.000 . 4.100 2.902 2.855 2.923 . 0 0 "[ . 1 . 2]" 1
2288 1 140 ILE H 1 141 LEU H 2.800 . 3.800 2.454 2.358 2.513 . 0 0 "[ . 1 . 2]" 1
2289 1 81 TRP HE1 1 88 ARG HG2 3.800 . 6.000 5.648 3.789 6.671 0.671 20 2 "[ . 1- . +]" 1
2290 1 14 ALA HA 1 19 ALA H 3.600 . 5.200 5.169 5.064 5.230 0.030 19 0 "[ . 1 . 2]" 1
2291 1 16 ARG HA 1 19 ALA H 3.000 . 4.100 2.950 2.526 3.119 . 0 0 "[ . 1 . 2]" 1
2292 1 52 ARG QB 1 53 TRP H 2.900 . 4.000 2.665 2.401 3.093 . 0 0 "[ . 1 . 2]" 1
2293 1 8 HIS HA 1 113 VAL H 3.500 . 5.000 3.984 3.632 4.143 . 0 0 "[ . 1 . 2]" 1
2294 1 94 SER HA 1 95 SER H 2.900 . 4.000 2.711 2.461 2.790 . 0 0 "[ . 1 . 2]" 1
2295 1 10 VAL H 1 112 ASP H 3.600 . 5.200 4.611 4.465 4.766 . 0 0 "[ . 1 . 2]" 1
2296 1 9 SER H 1 10 VAL H 3.400 . 4.900 3.701 3.653 3.770 . 0 0 "[ . 1 . 2]" 1
2297 1 10 VAL H 1 110 ARG HB2 4.000 . 6.000 4.494 4.156 4.842 . 0 0 "[ . 1 . 2]" 1
2298 1 21 LYS H 1 23 PHE H 3.500 . 5.000 3.925 3.614 4.218 . 0 0 "[ . 1 . 2]" 1
2299 1 19 ALA MB 1 23 PHE H 3.700 . 5.400 4.340 4.191 4.494 . 0 0 "[ . 1 . 2]" 1
2300 1 32 PRO HB3 1 33 ASN H 3.200 . 4.500 2.820 2.266 3.015 . 0 0 "[ . 1 . 2]" 1
2301 1 72 ASP H 1 73 GLU H 3.200 . 4.500 3.358 3.194 3.629 . 0 0 "[ . 1 . 2]" 1
2302 1 72 ASP H 1 72 ASP HA 3.000 . 4.100 2.609 2.417 2.693 . 0 0 "[ . 1 . 2]" 1
2303 1 71 VAL QG 1 72 ASP H 3.200 . 4.500 2.938 2.626 3.263 . 0 0 "[ . 1 . 2]" 1
2304 1 68 ILE HG13 1 69 ARG H 4.100 . 6.000 4.490 3.929 5.031 . 0 0 "[ . 1 . 2]" 1
2305 1 67 LEU HA 1 69 ARG H 3.500 . 5.100 4.655 4.522 4.813 . 0 0 "[ . 1 . 2]" 1
2306 1 71 VAL H 1 72 ASP HA 3.400 . 4.800 4.368 4.229 4.485 . 0 0 "[ . 1 . 2]" 1
2307 1 88 ARG HB2 1 89 ILE H 2.900 . 3.900 2.839 2.414 3.313 . 0 0 "[ . 1 . 2]" 1
2308 1 143 SER HA 1 146 ASP H 3.100 . 4.300 2.629 2.555 2.755 . 0 0 "[ . 1 . 2]" 1
2309 1 69 ARG H 1 78 VAL H 3.400 . 4.800 3.838 3.769 3.919 . 0 0 "[ . 1 . 2]" 1
2310 1 70 LYS HB3 1 78 VAL H 2.800 . 3.800 2.277 1.894 2.780 . 0 0 "[ . 1 . 2]" 1
2311 1 70 LYS HB2 1 78 VAL H 3.700 . 5.400 3.300 3.096 3.569 . 0 0 "[ . 1 . 2]" 1
2312 1 70 LYS HG3 1 78 VAL H 3.900 . 5.800 4.072 3.867 4.448 . 0 0 "[ . 1 . 2]" 1
2313 1 11 THR H 1 12 VAL H 3.600 . 5.200 4.059 3.967 4.110 . 0 0 "[ . 1 . 2]" 1
2314 1 11 THR H 1 12 VAL QG 3.700 . 5.500 4.314 3.894 4.795 . 0 0 "[ . 1 . 2]" 1
2315 1 89 ILE MG 1 131 ASN H 3.000 . 4.200 3.269 2.577 4.102 . 0 0 "[ . 1 . 2]" 1
2316 1 143 SER HA 1 145 GLN H 3.700 . 5.400 4.260 4.032 4.488 . 0 0 "[ . 1 . 2]" 1
2317 1 144 PHE HB2 1 145 GLN H 2.800 . 3.800 2.390 2.294 2.537 . 0 0 "[ . 1 . 2]" 1
2318 1 141 LEU HB3 1 145 GLN H 3.700 . 5.400 4.623 4.213 4.838 . 0 0 "[ . 1 . 2]" 1
2319 1 67 LEU HB3 1 68 ILE H 2.900 . 4.000 2.589 2.499 2.682 . 0 0 "[ . 1 . 2]" 1
2320 1 75 ASP H 1 75 ASP HB3 3.200 . 4.500 2.974 2.895 3.095 . 0 0 "[ . 1 . 2]" 1
2321 1 34 ASN H 1 34 ASN HD21 2.900 . 3.900 2.812 1.998 3.660 . 0 0 "[ . 1 . 2]" 1
2322 1 34 ASN H 1 136 GLY QA 4.100 . 6.000 5.763 5.351 6.321 0.321 17 0 "[ . 1 . 2]" 1
2323 1 33 ASN HB3 1 34 ASN H 3.100 . 4.300 2.442 2.322 2.636 . 0 0 "[ . 1 . 2]" 1
2324 1 53 TRP H 1 54 TYR H 3.400 . 4.900 3.840 3.728 3.940 . 0 0 "[ . 1 . 2]" 1
2325 1 52 ARG HA 1 54 TYR H 3.300 . 4.700 4.448 4.377 4.597 . 0 0 "[ . 1 . 2]" 1
2326 1 58 GLU HG3 1 59 GLN H 2.700 . 3.600 2.310 1.935 2.756 . 0 0 "[ . 1 . 2]" 1
2327 1 8 HIS H 1 9 SER H 3.700 . 5.400 3.985 3.588 4.246 . 0 0 "[ . 1 . 2]" 1
2328 1 9 SER H 1 10 VAL H 3.500 . 5.000 3.822 3.770 3.888 . 0 0 "[ . 1 . 2]" 1
2329 1 104 ASP H 1 104 ASP HA 3.000 . 4.100 2.502 2.098 2.772 . 0 0 "[ . 1 . 2]" 1
2330 1 102 VAL HA 1 104 ASP H 3.800 . 5.600 4.597 4.334 4.688 . 0 0 "[ . 1 . 2]" 1
2331 1 12 VAL QG 1 104 ASP H 3.900 . 5.800 5.488 5.177 5.660 . 0 0 "[ . 1 . 2]" 1
2332 1 49 LYS H 1 49 LYS HA 2.800 . 3.800 2.498 2.234 2.667 . 0 0 "[ . 1 . 2]" 1
2333 1 15 ASP HB3 1 16 ARG H 3.200 . 4.500 3.369 2.846 3.592 . 0 0 "[ . 1 . 2]" 1
2334 1 15 ASP HB2 1 16 ARG H 3.200 . 4.500 2.667 2.063 3.150 . 0 0 "[ . 1 . 2]" 1
2335 1 16 ARG H 1 19 ALA MB 3.600 . 5.200 3.527 3.196 3.831 . 0 0 "[ . 1 . 2]" 1
2336 1 14 ALA HA 1 15 ASP H 2.700 . 3.600 2.190 2.159 2.213 . 0 0 "[ . 1 . 2]" 1
2337 1 15 ASP H 1 19 ALA MB 3.500 . 5.100 3.820 3.271 4.114 . 0 0 "[ . 1 . 2]" 1
2338 1 20 PHE QD 1 76 THR H 3.300 . 4.700 4.097 3.983 4.193 . 0 0 "[ . 1 . 2]" 1
2339 1 16 ARG H 1 17 LYS HA 3.700 . 5.400 4.806 3.936 5.117 . 0 0 "[ . 1 . 2]" 1
2340 1 20 PHE QD 1 24 LEU H 3.600 . 5.200 4.627 4.388 4.789 . 0 0 "[ . 1 . 2]" 1
2341 1 17 LYS H 1 21 LYS H 3.300 . 4.700 4.455 4.323 4.536 . 0 0 "[ . 1 . 2]" 1
2342 1 15 ASP HB2 1 17 LYS H 3.600 . 5.200 4.191 4.091 4.387 . 0 0 "[ . 1 . 2]" 1
2343 1 17 LYS H 1 20 PHE HB3 3.500 . 6.000 4.822 4.635 4.973 . 0 0 "[ . 1 . 2]" 1
2344 1 17 LYS H 1 17 LYS HB3 3.100 . 4.300 2.685 2.085 3.282 . 0 0 "[ . 1 . 2]" 1
2345 1 17 LYS H 1 17 LYS HG2 3.300 . 4.700 3.204 1.877 4.131 0.023 17 0 "[ . 1 . 2]" 1
2346 1 16 ARG HA 1 17 LYS H 3.200 . 4.500 3.024 2.338 3.185 . 0 0 "[ . 1 . 2]" 1
2347 1 39 LYS QD 1 40 VAL H 3.800 . 5.600 3.586 1.301 4.441 0.699 9 1 "[ . +1 . 2]" 1
2348 1 13 LYS QG 1 149 ASP H 3.400 . 4.900 3.573 2.538 3.970 . 0 0 "[ . 1 . 2]" 1
2349 1 39 LYS HA 1 40 VAL H 3.100 . 4.300 2.540 2.122 2.729 . 0 0 "[ . 1 . 2]" 1
2350 1 127 LYS H 1 127 LYS HE2 4.100 . 6.000 5.215 4.197 6.105 0.105 10 0 "[ . 1 . 2]" 1
2351 1 151 GLU H 1 153 ALA MB 4.000 . 6.000 5.893 4.995 6.289 0.289 19 0 "[ . 1 . 2]" 1
2352 1 32 PRO HA 1 140 ILE H 3.500 . 5.000 3.769 3.547 3.904 . 0 0 "[ . 1 . 2]" 1
2353 1 19 ALA MB 1 21 LYS H 3.900 . 5.800 4.151 3.975 4.438 . 0 0 "[ . 1 . 2]" 1
2354 1 39 LYS H 1 39 LYS QD 3.600 . 5.200 4.251 3.379 4.580 . 0 0 "[ . 1 . 2]" 1
2355 1 93 ASN HA 1 94 SER H 3.100 . 4.300 2.718 2.230 2.809 . 0 0 "[ . 1 . 2]" 1
2356 1 28 PRO HA 1 29 GLU H 2.900 . 4.000 2.712 2.570 2.764 . 0 0 "[ . 1 . 2]" 1
2357 1 28 PRO QD 1 29 GLU H 3.500 . 5.100 3.084 2.791 3.691 . 0 0 "[ . 1 . 2]" 1
2358 1 149 ASP H 1 150 GLU H 2.700 . 3.600 2.267 2.220 2.328 . 0 0 "[ . 1 . 2]" 1
2359 1 86 PHE H 1 86 PHE QD 3.600 . 5.200 3.357 1.943 4.203 0.057 18 0 "[ . 1 . 2]" 1
2360 1 85 GLY HA3 1 86 PHE H 3.200 . 4.500 2.835 2.438 3.101 . 0 0 "[ . 1 . 2]" 1
2361 1 153 ALA HA 1 154 LYS H 3.000 . 4.200 2.503 2.136 2.777 . 0 0 "[ . 1 . 2]" 1
2362 1 25 GLU HA 1 26 GLY H 3.000 . 4.100 2.742 2.578 2.797 . 0 0 "[ . 1 . 2]" 1
2363 1 24 LEU QD 1 26 GLY H 3.700 . 5.400 4.912 4.503 5.297 . 0 0 "[ . 1 . 2]" 1
2364 1 129 VAL H 1 130 ARG H 2.800 . 3.800 2.307 2.222 2.455 . 0 0 "[ . 1 . 2]" 1
2365 1 118 PHE HA 1 121 MET H 3.500 . 5.000 3.550 3.227 3.802 . 0 0 "[ . 1 . 2]" 1
2366 1 141 LEU HA 1 144 PHE H 3.100 . 4.300 3.162 2.740 3.466 . 0 0 "[ . 1 . 2]" 1
2367 1 14 ALA H 1 14 ALA HA 3.300 . 4.600 2.850 2.791 2.875 . 0 0 "[ . 1 . 2]" 1
2368 1 13 LYS QG 1 14 ALA H 3.800 . 5.600 3.967 3.617 4.664 . 0 0 "[ . 1 . 2]" 1
2369 1 41 GLY QA 1 42 ALA H 3.400 . 4.800 2.742 2.456 2.907 . 0 0 "[ . 1 . 2]" 1
2370 1 66 GLY H 1 67 LEU QD 4.000 . 6.000 4.477 4.019 4.764 . 0 0 "[ . 1 . 2]" 1
2371 1 66 GLY H 1 67 LEU QB 3.900 . 5.800 5.746 5.254 6.016 0.216 6 0 "[ . 1 . 2]" 1
2372 1 84 ASN HB2 1 84 ASN QD 3.300 . 4.700 2.183 1.948 2.535 . 0 0 "[ . 1 . 2]" 1
2373 1 70 LYS H 1 70 LYS HB3 2.800 . 3.800 2.519 2.282 2.967 . 0 0 "[ . 1 . 2]" 1
2374 1 69 ARG HB3 1 70 LYS H 3.500 . 5.000 3.692 3.361 3.886 . 0 0 "[ . 1 . 2]" 1
2375 1 68 ILE HG13 1 70 LYS H 3.900 . 5.800 3.483 2.717 3.757 . 0 0 "[ . 1 . 2]" 1
2376 1 141 LEU HB2 1 145 GLN QE 2.900 . 3.900 2.813 2.614 3.374 . 0 0 "[ . 1 . 2]" 1
2377 1 51 GLY H 1 68 ILE HG13 3.700 . 5.400 4.320 3.991 4.651 . 0 0 "[ . 1 . 2]" 1
2378 1 124 LYS HG2 1 125 HIS H 3.600 . 5.200 3.841 2.717 4.228 . 0 0 "[ . 1 . 2]" 1
2379 1 137 TRP H 1 139 THR H 3.400 . 4.900 3.717 3.598 3.851 . 0 0 "[ . 1 . 2]" 1
2380 1 32 PRO HB2 1 139 THR H 4.200 . 6.000 4.947 4.725 5.177 . 0 0 "[ . 1 . 2]" 1
2381 1 104 ASP HA 1 108 LYS H 3.400 . 4.800 4.467 4.271 4.591 . 0 0 "[ . 1 . 2]" 1
2382 1 106 GLN HA 1 108 LYS H 3.200 . 4.400 3.015 2.599 3.272 . 0 0 "[ . 1 . 2]" 1
2383 1 107 LYS QB 1 108 LYS H 3.200 . 4.500 2.857 2.470 3.168 . 0 0 "[ . 1 . 2]" 1
2384 1 68 ILE HG12 1 78 VAL H 3.600 . 6.000 5.770 5.566 5.995 . 0 0 "[ . 1 . 2]" 1
2385 1 112 ASP H 1 113 VAL H 3.300 . 4.700 3.757 3.689 3.851 . 0 0 "[ . 1 . 2]" 1
2386 1 45 GLY H 1 55 GLU H 3.600 . 5.200 3.853 3.506 4.514 . 0 0 "[ . 1 . 2]" 1
2387 1 12 VAL H 1 110 ARG HA 2.500 . 3.300 2.132 2.099 2.167 . 0 0 "[ . 1 . 2]" 1
2388 1 103 ALA MB 1 104 ASP HA 3.400 . 4.900 4.027 3.896 4.134 . 0 0 "[ . 1 . 2]" 1
2389 1 15 ASP H 1 15 ASP HA 2.400 . 3.200 2.078 2.045 2.108 . 0 0 "[ . 1 . 2]" 1
2390 1 15 ASP HA 1 16 ARG HA 3.100 . 4.300 3.216 2.764 3.506 . 0 0 "[ . 1 . 2]" 1
2391 1 15 ASP HA 1 15 ASP HB3 2.900 . 4.000 2.544 1.761 2.963 0.039 17 0 "[ . 1 . 2]" 1
2392 1 57 ASP QB 1 59 GLN HA 3.400 . 4.800 4.282 4.094 4.389 . 0 0 "[ . 1 . 2]" 1
2393 1 13 LYS HB2 1 149 ASP HA 2.900 . 4.000 2.724 2.022 2.973 . 0 0 "[ . 1 . 2]" 1
2394 1 70 LYS HA 1 71 VAL QG 3.900 . 5.800 3.584 3.360 3.754 . 0 0 "[ . 1 . 2]" 1
2395 1 6 VAL HA 1 8 HIS H 3.500 . 6.000 4.972 4.896 5.031 . 0 0 "[ . 1 . 2]" 1
2396 1 146 ASP HA 1 147 LYS H 3.000 . 4.100 3.421 3.356 3.486 . 0 0 "[ . 1 . 2]" 1
2397 1 151 GLU H 1 151 GLU HA 2.800 . 3.800 2.719 2.698 2.749 . 0 0 "[ . 1 . 2]" 1
2398 1 141 LEU HA 1 141 LEU HB3 3.000 . 4.100 2.303 2.131 2.451 . 0 0 "[ . 1 . 2]" 1
2399 1 120 ARG HA 1 120 ARG HG3 3.200 . 4.400 2.731 2.404 3.451 . 0 0 "[ . 1 . 2]" 1
2400 1 58 GLU H 1 58 GLU HA 2.800 . 3.800 2.726 2.685 2.774 . 0 0 "[ . 1 . 2]" 1
2401 1 124 LYS HA 1 127 LYS H 2.800 . 3.800 3.044 2.611 3.290 . 0 0 "[ . 1 . 2]" 1
2402 1 142 GLN HA 1 143 SER H 2.900 . 4.000 3.374 3.055 3.495 . 0 0 "[ . 1 . 2]" 1
2403 1 68 ILE HA 1 69 ARG HA 3.100 . 4.300 4.047 4.011 4.070 . 0 0 "[ . 1 . 2]" 1
2404 1 68 ILE HA 1 77 LEU HB3 2.800 . 6.000 4.180 3.896 4.402 . 0 0 "[ . 1 . 2]" 1
2405 1 68 ILE HA 1 68 ILE HG12 2.600 . 3.400 2.528 2.366 2.690 . 0 0 "[ . 1 . 2]" 1
2406 1 86 PHE H 1 86 PHE HB3 2.900 . 4.000 2.781 1.848 3.562 . 0 0 "[ . 1 . 2]" 1
2407 1 32 PRO HG2 1 33 ASN HB3 3.400 . 4.900 3.157 2.396 3.558 . 0 0 "[ . 1 . 2]" 1
2408 1 13 LYS HB3 1 149 ASP QB 3.400 . 4.800 4.013 3.577 4.478 . 0 0 "[ . 1 . 2]" 1
2409 1 146 ASP HB3 1 147 LYS HB3 3.500 . 5.100 4.435 3.924 5.027 . 0 0 "[ . 1 . 2]" 1
2410 1 32 PRO HG2 1 33 ASN HB2 3.900 . 5.800 4.048 3.623 4.387 . 0 0 "[ . 1 . 2]" 1
2411 1 26 GLY HA3 1 29 GLU HG2 3.000 . 4.100 2.575 2.149 2.894 . 0 0 "[ . 1 . 2]" 1
2412 1 48 LYS HA 1 48 LYS HB2 2.900 . 3.900 2.309 2.161 2.440 . 0 0 "[ . 1 . 2]" 1
2413 1 48 LYS HB2 1 48 LYS QE 3.200 . 4.500 2.530 1.502 3.743 0.398 13 0 "[ . 1 . 2]" 1
2414 1 17 LYS H 1 17 LYS HB2 2.700 . 3.600 2.419 2.100 3.245 . 0 0 "[ . 1 . 2]" 1
2415 1 154 LYS H 1 154 LYS HB3 2.600 . 3.500 2.366 1.771 3.009 . 0 0 "[ . 1 . 2]" 1
2416 1 21 LYS HA 1 24 LEU HG 3.000 . 6.000 4.690 3.952 5.239 . 0 0 "[ . 1 . 2]" 1
2417 1 14 ALA MB 1 19 ALA MB 3.900 . 5.800 4.652 4.383 4.878 . 0 0 "[ . 1 . 2]" 1
2418 1 48 LYS HA 1 48 LYS HG2 3.300 . 4.600 2.759 2.334 3.121 . 0 0 "[ . 1 . 2]" 1
2419 1 49 LYS HA 1 49 LYS QG 3.100 . 4.300 2.601 2.296 3.119 . 0 0 "[ . 1 . 2]" 1
2420 1 120 ARG HD2 1 120 ARG HG3 2.700 . 3.600 2.406 2.156 2.779 . 0 0 "[ . 1 . 2]" 1
2421 1 154 LYS HG2 1 155 LYS H 2.700 . 3.600 2.862 1.604 3.789 0.196 20 0 "[ . 1 . 2]" 1
2422 1 21 LYS HE3 1 21 LYS HG2 2.900 . 3.900 2.487 2.141 3.147 . 0 0 "[ . 1 . 2]" 1
2423 1 107 LYS QG 1 108 LYS H 3.300 . 4.700 3.598 2.847 3.880 . 0 0 "[ . 1 . 2]" 1
2424 1 12 VAL HA 1 14 ALA MB 3.700 . 5.400 4.772 4.608 4.976 . 0 0 "[ . 1 . 2]" 1
2425 1 13 LYS QG 1 14 ALA MB 3.700 . 5.400 3.632 2.924 4.616 . 0 0 "[ . 1 . 2]" 1
2426 1 76 THR MG 1 77 LEU HA 3.500 . 5.000 4.691 4.562 4.782 . 0 0 "[ . 1 . 2]" 1
2427 1 75 ASP HB3 1 76 THR MG 3.300 . 4.700 4.006 3.938 4.058 . 0 0 "[ . 1 . 2]" 1
2428 1 76 THR MG 1 77 LEU HG 3.400 . 4.900 4.210 3.980 4.572 . 0 0 "[ . 1 . 2]" 1
2429 1 18 THR MG 1 21 LYS HB3 3.400 . 4.800 3.603 3.165 3.866 . 0 0 "[ . 1 . 2]" 1
2430 1 18 THR MG 1 19 ALA H 3.600 . 5.200 3.432 3.228 3.484 . 0 0 "[ . 1 . 2]" 1
2431 1 24 LEU QD 1 53 TRP HA 3.600 . 5.200 4.302 4.136 4.449 . 0 0 "[ . 1 . 2]" 1
2432 1 46 VAL MG1 1 68 ILE HG13 3.200 . 4.500 3.509 3.203 3.766 . 0 0 "[ . 1 . 2]" 1
2433 1 81 TRP H 1 129 VAL QG 2.200 . 6.000 4.522 3.738 5.411 . 0 0 "[ . 1 . 2]" 1
2434 1 11 THR MG 1 108 LYS HB2 3.000 . 4.100 3.357 2.586 3.668 . 0 0 "[ . 1 . 2]" 1
2435 1 56 ILE MG 1 57 ASP QB 3.600 . 5.200 4.273 3.995 4.604 . 0 0 "[ . 1 . 2]" 1
2436 1 24 LEU QD 1 27 PHE HB2 3.800 . 5.600 4.281 3.835 4.672 . 0 0 "[ . 1 . 2]" 1
2437 1 78 VAL QG 1 99 VAL H 2.900 . 4.000 2.317 2.224 2.401 . 0 0 "[ . 1 . 2]" 1
2438 1 12 VAL QG 1 14 ALA HA 3.400 . 4.900 3.466 3.312 3.638 . 0 0 "[ . 1 . 2]" 1
2439 1 32 PRO HG2 1 33 ASN H 3.100 . 4.300 2.468 1.962 3.176 . 0 0 "[ . 1 . 2]" 1
2440 1 32 PRO HG2 1 143 SER HA 3.000 . 4.200 3.469 3.123 4.131 . 0 0 "[ . 1 . 2]" 1
2441 1 32 PRO HG2 1 150 GLU QG 2.300 . 6.000 5.510 4.776 6.292 0.292 6 0 "[ . 1 . 2]" 1
2442 1 71 VAL QG 1 77 LEU QD 3.300 . 4.600 2.725 2.218 3.192 . 0 0 "[ . 1 . 2]" 1
2443 1 37 THR MG 1 38 THR H 3.400 . 4.800 3.010 2.170 3.357 . 0 0 "[ . 1 . 2]" 1
2444 1 67 LEU HA 1 67 LEU QD 3.600 . 5.200 2.995 2.792 3.142 . 0 0 "[ . 1 . 2]" 1
2445 1 44 LEU QD 1 54 TYR H 3.500 . 5.000 3.610 3.335 3.919 . 0 0 "[ . 1 . 2]" 1
2446 1 67 LEU QD 1 81 TRP HD1 3.200 . 6.000 4.695 3.001 5.107 . 0 0 "[ . 1 . 2]" 1
2447 1 11 THR H 1 12 VAL QG 3.200 . 4.500 4.177 3.684 4.282 . 0 0 "[ . 1 . 2]" 1
2448 1 38 THR MG 1 39 LYS H 3.300 . 4.700 3.520 3.393 3.560 . 0 0 "[ . 1 . 2]" 1
2449 1 69 ARG H 1 78 VAL QG 3.100 . 4.300 2.834 2.673 2.936 . 0 0 "[ . 1 . 2]" 1
2450 1 148 ILE MG 1 149 ASP H 2.900 . 4.000 3.258 3.004 3.482 . 0 0 "[ . 1 . 2]" 1
2451 1 83 LEU QD 1 85 GLY HA3 3.200 . 4.500 3.446 1.891 5.447 0.947 12 1 "[ . 1 + . 2]" 1
2452 1 146 ASP HB2 1 148 ILE MD 2.200 . 6.000 5.535 5.332 5.691 . 0 0 "[ . 1 . 2]" 1
2453 1 100 THR H 1 113 VAL MG2 3.300 . 4.700 2.700 2.533 3.279 . 0 0 "[ . 1 . 2]" 1
2454 1 68 ILE HB 1 79 ILE MD 2.500 . 6.000 5.493 4.379 6.126 0.126 18 0 "[ . 1 . 2]" 1
2455 1 8 HIS HA 1 111 VAL MG1 3.500 . 5.000 4.731 4.477 5.310 0.310 7 0 "[ . 1 . 2]" 1
2456 1 77 LEU HA 1 79 ILE MG 3.300 . 4.700 4.012 3.486 4.328 . 0 0 "[ . 1 . 2]" 1
2457 1 99 VAL QG 1 101 PHE HB3 3.400 . 6.000 4.792 4.590 4.972 . 0 0 "[ . 1 . 2]" 1
2458 1 76 THR MG 1 99 VAL QG 3.400 . 4.800 3.604 3.386 3.677 . 0 0 "[ . 1 . 2]" 1
2459 1 21 LYS HG3 1 22 THR HA 2.600 . 3.500 3.233 2.965 4.001 0.501 8 1 "[ . + 1 . 2]" 1
2460 1 37 THR HA 1 37 THR MG 2.900 . 3.900 2.061 1.958 2.238 . 0 0 "[ . 1 . 2]" 1
2461 1 17 LYS H 1 17 LYS HA 2.700 . 3.600 2.698 2.681 2.731 . 0 0 "[ . 1 . 2]" 1
2462 1 17 LYS HA 1 17 LYS HE3 3.700 . 5.400 4.099 3.072 4.714 . 0 0 "[ . 1 . 2]" 1
2463 1 55 GLU H 1 55 GLU HA 2.400 . 3.100 2.315 2.170 2.467 . 0 0 "[ . 1 . 2]" 1
2464 1 76 THR MG 1 100 THR HA 2.400 . 6.000 1.753 1.573 1.922 . 0 0 "[ . 1 . 2]" 1
2465 1 76 THR HB 1 77 LEU HG 3.000 . 4.100 3.503 3.203 3.944 . 0 0 "[ . 1 . 2]" 1
2466 1 100 THR HB 1 102 VAL MG2 3.300 . 4.700 3.378 3.051 3.516 . 0 0 "[ . 1 . 2]" 1
2467 1 137 TRP H 1 137 TRP HA 2.600 . 3.500 2.731 2.632 2.777 . 0 0 "[ . 1 . 2]" 1
2468 1 100 THR H 1 113 VAL HA 2.600 . 3.500 2.564 2.434 2.680 . 0 0 "[ . 1 . 2]" 1
2469 1 40 VAL H 1 40 VAL HA 2.700 . 3.600 2.467 2.107 2.715 . 0 0 "[ . 1 . 2]" 1
2470 1 19 ALA MB 1 20 PHE HA 2.900 . 4.000 3.082 2.932 3.294 . 0 0 "[ . 1 . 2]" 1
2471 1 16 ARG H 1 16 ARG HA 2.600 . 3.400 2.704 2.685 2.725 . 0 0 "[ . 1 . 2]" 1
2472 1 69 ARG H 1 79 ILE HA 2.400 . 3.100 2.385 2.022 2.699 . 0 0 "[ . 1 . 2]" 1
2473 1 24 LEU H 1 25 GLU HA 3.000 . 4.200 3.472 3.450 3.483 . 0 0 "[ . 1 . 2]" 1
2474 1 125 HIS HA 1 125 HIS QB 2.800 . 3.700 2.211 1.810 2.419 0.090 19 0 "[ . 1 . 2]" 1
2475 1 13 LYS HA 1 13 LYS QG 3.000 . 4.100 2.991 2.419 3.244 . 0 0 "[ . 1 . 2]" 1
2476 1 51 GLY HA2 1 68 ILE HG13 3.300 . 4.700 2.911 2.600 3.351 . 0 0 "[ . 1 . 2]" 1
2477 1 50 GLY H 1 51 GLY HA2 3.400 . 4.800 2.559 2.333 2.772 . 0 0 "[ . 1 . 2]" 1
2478 1 25 GLU HA 1 25 GLU QG 2.800 . 3.800 2.284 2.083 2.413 . 0 0 "[ . 1 . 2]" 1
2479 1 40 VAL H 1 40 VAL HB 3.000 . 4.100 3.505 2.835 3.736 . 0 0 "[ . 1 . 2]" 1
2480 1 86 PHE H 1 86 PHE HB2 3.000 . 4.100 3.045 2.445 3.405 . 0 0 "[ . 1 . 2]" 1
2481 1 15 ASP H 1 15 ASP HB2 3.000 . 4.100 3.044 3.009 3.086 . 0 0 "[ . 1 . 2]" 1
2482 1 15 ASP H 1 15 ASP HB3 2.900 . 4.000 3.139 2.799 3.238 . 0 0 "[ . 1 . 2]" 1
2483 1 73 GLU HG2 1 74 PRO HD2 3.200 . 4.500 2.304 2.254 2.313 . 0 0 "[ . 1 . 2]" 1
2484 1 72 ASP HA 1 72 ASP HB2 3.000 . 4.100 2.717 2.564 2.985 . 0 0 "[ . 1 . 2]" 1
2485 1 15 ASP HA 1 19 ALA MB 3.400 . 4.900 4.695 4.554 4.853 . 0 0 "[ . 1 . 2]" 1
2486 1 154 LYS H 1 154 LYS HA 2.800 . 3.800 2.469 2.087 2.808 . 0 0 "[ . 1 . 2]" 1
2487 1 147 LYS H 1 147 LYS HA 2.700 . 3.600 2.719 2.695 2.751 . 0 0 "[ . 1 . 2]" 1
2488 1 75 ASP HA 1 75 ASP HB2 2.600 . 3.400 2.099 1.858 2.323 . 0 0 "[ . 1 . 2]" 1
2489 1 142 GLN HA 1 142 GLN HB3 2.500 . 3.300 2.089 2.036 2.151 . 0 0 "[ . 1 . 2]" 1
2490 1 71 VAL HA 1 72 ASP HA 2.800 . 3.800 2.959 2.666 3.258 . 0 0 "[ . 1 . 2]" 1
2491 1 139 THR HA 1 140 ILE H 2.900 . 3.900 3.143 2.955 3.275 . 0 0 "[ . 1 . 2]" 1
2492 1 11 THR HB 1 108 LYS HB2 3.500 . 6.000 5.688 4.923 6.032 0.032 9 0 "[ . 1 . 2]" 1
2493 1 26 GLY HA3 1 27 PHE HA 3.100 . 4.300 4.157 4.108 4.211 . 0 0 "[ . 1 . 2]" 1
2494 1 18 THR HB 1 145 GLN HA 3.800 . 5.600 5.703 5.615 5.802 0.202 12 0 "[ . 1 . 2]" 1
2495 1 101 PHE HA 1 102 VAL MG2 3.100 . 4.300 2.690 2.289 3.168 . 0 0 "[ . 1 . 2]" 1
2496 1 50 GLY H 1 51 GLY HA3 2.500 . 6.000 3.486 3.420 3.514 . 0 0 "[ . 1 . 2]" 1
2497 1 70 LYS HG3 1 72 ASP HB2 3.000 . 4.200 3.087 2.466 3.949 . 0 0 "[ . 1 . 2]" 1
2498 1 39 LYS QB 1 40 VAL H 2.600 . 3.400 2.299 1.804 2.867 . 0 0 "[ . 1 . 2]" 1
2499 1 16 ARG QB 1 17 LYS H 2.800 . 3.800 2.748 2.575 2.836 . 0 0 "[ . 1 . 2]" 1
2500 1 99 VAL QG 1 112 ASP H 3.700 . 5.400 3.964 3.764 4.143 . 0 0 "[ . 1 . 2]" 1
2501 1 40 VAL H 1 40 VAL QG 2.900 . 3.900 2.381 1.838 2.762 0.062 19 0 "[ . 1 . 2]" 1
2502 1 18 THR MG 1 20 PHE QD 3.500 . 6.000 6.010 5.872 6.146 0.146 12 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 100
_Distance_constraint_stats_list.Viol_count 465
_Distance_constraint_stats_list.Viol_total 513.390
_Distance_constraint_stats_list.Viol_max 0.277
_Distance_constraint_stats_list.Viol_rms 0.0320
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0128
_Distance_constraint_stats_list.Viol_average_violations_only 0.0552
_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 6 VAL 0.030 0.030 10 0 "[ . 1 . 2]"
1 8 HIS 2.012 0.187 9 0 "[ . 1 . 2]"
1 10 VAL 2.508 0.277 1 0 "[ . 1 . 2]"
1 12 VAL 0.245 0.052 14 0 "[ . 1 . 2]"
1 15 ASP 1.693 0.105 6 0 "[ . 1 . 2]"
1 16 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 LYS 0.080 0.042 17 0 "[ . 1 . 2]"
1 18 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ALA 1.805 0.105 6 0 "[ . 1 . 2]"
1 20 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 LYS 0.780 0.105 1 0 "[ . 1 . 2]"
1 22 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 PHE 0.112 0.041 18 0 "[ . 1 . 2]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 GLU 0.700 0.105 1 0 "[ . 1 . 2]"
1 45 GLY 2.238 0.171 9 0 "[ . 1 . 2]"
1 47 ASP 1.198 0.120 2 0 "[ . 1 . 2]"
1 52 ARG 1.198 0.120 2 0 "[ . 1 . 2]"
1 54 TYR 2.238 0.171 9 0 "[ . 1 . 2]"
1 67 LEU 1.425 0.139 9 0 "[ . 1 . 2]"
1 70 LYS 0.460 0.098 10 0 "[ . 1 . 2]"
1 72 ASP 1.269 0.081 10 0 "[ . 1 . 2]"
1 76 THR 1.269 0.081 10 0 "[ . 1 . 2]"
1 77 LEU 0.102 0.058 13 0 "[ . 1 . 2]"
1 78 VAL 0.460 0.098 10 0 "[ . 1 . 2]"
1 79 ILE 0.448 0.115 12 0 "[ . 1 . 2]"
1 80 GLY 1.425 0.139 9 0 "[ . 1 . 2]"
1 97 PHE 0.448 0.115 12 0 "[ . 1 . 2]"
1 98 THR 0.503 0.076 7 0 "[ . 1 . 2]"
1 99 VAL 0.102 0.058 13 0 "[ . 1 . 2]"
1 100 THR 0.218 0.064 5 0 "[ . 1 . 2]"
1 102 VAL 0.376 0.058 10 0 "[ . 1 . 2]"
1 104 ASP 0.811 0.126 19 0 "[ . 1 . 2]"
1 108 LYS 0.811 0.126 19 0 "[ . 1 . 2]"
1 109 THR 0.245 0.052 14 0 "[ . 1 . 2]"
1 110 ARG 0.376 0.058 10 0 "[ . 1 . 2]"
1 111 VAL 2.508 0.277 1 0 "[ . 1 . 2]"
1 112 ASP 0.218 0.064 5 0 "[ . 1 . 2]"
1 113 VAL 2.012 0.187 9 0 "[ . 1 . 2]"
1 114 GLU 0.503 0.076 7 0 "[ . 1 . 2]"
1 115 HIS 0.030 0.030 10 0 "[ . 1 . 2]"
1 121 MET 1.585 0.223 4 0 "[ . 1 . 2]"
1 123 THR 0.570 0.100 9 0 "[ . 1 . 2]"
1 124 LYS 0.055 0.026 14 0 "[ . 1 . 2]"
1 125 HIS 4.504 0.223 4 0 "[ . 1 . 2]"
1 126 ALA 0.063 0.022 20 0 "[ . 1 . 2]"
1 127 LYS 0.570 0.100 9 0 "[ . 1 . 2]"
1 128 ARG 0.055 0.026 14 0 "[ . 1 . 2]"
1 129 VAL 2.919 0.175 16 0 "[ . 1 . 2]"
1 130 ARG 0.063 0.022 20 0 "[ . 1 . 2]"
1 136 GLY 0.021 0.018 9 0 "[ . 1 . 2]"
1 137 TRP 0.086 0.024 1 0 "[ . 1 . 2]"
1 139 THR 2.577 0.179 18 0 "[ . 1 . 2]"
1 140 ILE 0.129 0.045 18 0 "[ . 1 . 2]"
1 141 LEU 0.225 0.052 8 0 "[ . 1 . 2]"
1 142 GLN 0.889 0.104 17 0 "[ . 1 . 2]"
1 143 SER 2.577 0.179 18 0 "[ . 1 . 2]"
1 144 PHE 0.337 0.073 4 0 "[ . 1 . 2]"
1 145 GLN 0.139 0.052 8 0 "[ . 1 . 2]"
1 146 ASP 0.889 0.104 17 0 "[ . 1 . 2]"
1 147 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 ILE 0.229 0.073 4 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 15 ASP O 1 19 ALA H 1.900 . 2.200 2.252 2.130 2.305 0.105 6 0 "[ . 1 . 2]" 2
2 1 15 ASP O 1 19 ALA N 2.900 2.600 3.200 3.200 3.047 3.278 0.078 6 0 "[ . 1 . 2]" 2
3 1 16 ARG O 1 20 PHE H 1.900 . 2.200 1.959 1.877 2.034 . 0 0 "[ . 1 . 2]" 2
4 1 16 ARG O 1 20 PHE N 2.900 2.600 3.200 2.920 2.841 2.987 . 0 0 "[ . 1 . 2]" 2
5 1 17 LYS O 1 21 LYS H 1.900 . 2.200 2.004 1.804 2.242 0.042 17 0 "[ . 1 . 2]" 2
6 1 17 LYS O 1 21 LYS N 2.900 2.600 3.200 2.933 2.717 3.152 . 0 0 "[ . 1 . 2]" 2
7 1 18 THR O 1 22 THR H 1.900 . 2.200 1.774 1.700 1.846 . 0 0 "[ . 1 . 2]" 2
8 1 18 THR O 1 22 THR N 2.900 2.600 3.200 2.737 2.652 2.798 . 0 0 "[ . 1 . 2]" 2
9 1 19 ALA O 1 23 PHE H 1.900 . 2.200 2.093 1.861 2.241 0.041 18 0 "[ . 1 . 2]" 2
10 1 19 ALA O 1 23 PHE N 2.900 2.600 3.200 2.986 2.805 3.127 . 0 0 "[ . 1 . 2]" 2
11 1 20 PHE O 1 24 LEU H 1.900 . 2.200 1.992 1.835 2.132 . 0 0 "[ . 1 . 2]" 2
12 1 20 PHE O 1 24 LEU N 2.900 2.600 3.200 2.899 2.773 2.997 . 0 0 "[ . 1 . 2]" 2
13 1 21 LYS O 1 25 GLU H 1.900 . 2.200 2.211 2.034 2.305 0.105 1 0 "[ . 1 . 2]" 2
14 1 21 LYS O 1 25 GLU N 2.900 2.600 3.200 2.848 2.795 2.926 . 0 0 "[ . 1 . 2]" 2
15 1 45 GLY O 1 54 TYR H 1.900 . 2.200 2.178 2.030 2.278 0.078 3 0 "[ . 1 . 2]" 2
16 1 45 GLY O 1 54 TYR N 2.900 2.600 3.200 2.791 2.655 3.006 . 0 0 "[ . 1 . 2]" 2
17 1 45 GLY H 1 54 TYR O 1.900 . 2.200 2.287 1.993 2.371 0.171 9 0 "[ . 1 . 2]" 2
18 1 45 GLY N 1 54 TYR O 2.900 2.600 3.200 2.959 2.828 3.227 0.027 9 0 "[ . 1 . 2]" 2
19 1 47 ASP O 1 52 ARG H 1.900 . 2.200 2.235 2.043 2.320 0.120 2 0 "[ . 1 . 2]" 2
20 1 47 ASP O 1 52 ARG N 2.900 2.600 3.200 3.148 2.977 3.246 0.046 2 0 "[ . 1 . 2]" 2
21 1 47 ASP H 1 52 ARG O 1.900 . 2.200 1.704 1.614 1.832 . 0 0 "[ . 1 . 2]" 2
22 1 47 ASP N 1 52 ARG O 2.900 2.600 3.200 2.666 2.592 2.726 0.008 9 0 "[ . 1 . 2]" 2
23 1 67 LEU H 1 80 GLY O 1.900 . 2.200 2.187 1.902 2.339 0.139 9 0 "[ . 1 . 2]" 2
24 1 67 LEU N 1 80 GLY O 2.900 2.600 3.200 3.115 2.857 3.274 0.074 9 0 "[ . 1 . 2]" 2
25 1 67 LEU O 1 80 GLY H 1.900 . 2.200 1.676 1.598 1.799 0.002 20 0 "[ . 1 . 2]" 2
26 1 67 LEU O 1 80 GLY N 2.900 2.600 3.200 2.633 2.563 2.722 0.037 20 0 "[ . 1 . 2]" 2
27 1 70 LYS O 1 78 VAL H 1.900 . 2.200 1.983 1.717 2.194 . 0 0 "[ . 1 . 2]" 2
28 1 70 LYS O 1 78 VAL N 2.900 2.600 3.200 2.881 2.682 3.034 . 0 0 "[ . 1 . 2]" 2
29 1 70 LYS H 1 78 VAL O 1.900 . 2.200 2.187 2.037 2.298 0.098 10 0 "[ . 1 . 2]" 2
30 1 70 LYS N 1 78 VAL O 2.900 2.600 3.200 3.061 2.846 3.217 0.017 11 0 "[ . 1 . 2]" 2
31 1 72 ASP O 1 76 THR H 1.900 . 2.200 2.239 2.168 2.281 0.081 10 0 "[ . 1 . 2]" 2
32 1 72 ASP O 1 76 THR N 2.900 2.600 3.200 3.215 3.145 3.250 0.050 10 0 "[ . 1 . 2]" 2
33 1 72 ASP H 1 76 THR O 1.900 . 2.200 2.049 1.817 2.250 0.050 6 0 "[ . 1 . 2]" 2
34 1 72 ASP N 1 76 THR O 2.900 2.600 3.200 2.895 2.720 3.045 . 0 0 "[ . 1 . 2]" 2
35 1 79 ILE H 1 97 PHE O 1.900 . 2.200 2.125 1.879 2.315 0.115 12 0 "[ . 1 . 2]" 2
36 1 79 ILE N 1 97 PHE O 2.900 2.600 3.200 3.054 2.863 3.204 0.004 13 0 "[ . 1 . 2]" 2
37 1 79 ILE O 1 97 PHE H 1.900 . 2.200 1.862 1.637 2.218 0.018 17 0 "[ . 1 . 2]" 2
38 1 79 ILE O 1 97 PHE N 2.900 2.600 3.200 2.823 2.615 3.178 . 0 0 "[ . 1 . 2]" 2
39 1 77 LEU H 1 99 VAL O 1.900 . 2.200 2.101 1.958 2.258 0.058 13 0 "[ . 1 . 2]" 2
40 1 77 LEU N 1 99 VAL O 2.900 2.600 3.200 3.010 2.904 3.144 . 0 0 "[ . 1 . 2]" 2
41 1 77 LEU O 1 99 VAL H 1.900 . 2.200 1.742 1.643 1.867 . 0 0 "[ . 1 . 2]" 2
42 1 77 LEU O 1 99 VAL N 2.900 2.600 3.200 2.711 2.622 2.835 . 0 0 "[ . 1 . 2]" 2
43 1 104 ASP O 1 108 LYS H 1.900 . 2.200 2.179 1.841 2.326 0.126 19 0 "[ . 1 . 2]" 2
44 1 104 ASP O 1 108 LYS N 2.900 2.600 3.200 3.035 2.738 3.207 0.007 13 0 "[ . 1 . 2]" 2
45 1 104 ASP H 1 108 LYS O 1.900 . 2.200 1.847 1.716 2.236 0.036 14 0 "[ . 1 . 2]" 2
46 1 104 ASP N 1 108 LYS O 2.900 2.600 3.200 2.721 2.649 2.869 . 0 0 "[ . 1 . 2]" 2
47 1 102 VAL O 1 110 ARG H 1.900 . 2.200 2.159 1.801 2.258 0.058 10 0 "[ . 1 . 2]" 2
48 1 102 VAL O 1 110 ARG N 2.900 2.600 3.200 2.964 2.733 3.089 . 0 0 "[ . 1 . 2]" 2
49 1 102 VAL H 1 110 ARG O 1.900 . 2.200 1.983 1.756 2.246 0.046 19 0 "[ . 1 . 2]" 2
50 1 102 VAL N 1 110 ARG O 2.900 2.600 3.200 2.896 2.704 3.127 . 0 0 "[ . 1 . 2]" 2
51 1 100 THR O 1 112 ASP H 1.900 . 2.200 1.807 1.665 2.129 . 0 0 "[ . 1 . 2]" 2
52 1 100 THR O 1 112 ASP N 2.900 2.600 3.200 2.756 2.644 2.996 . 0 0 "[ . 1 . 2]" 2
53 1 100 THR H 1 112 ASP O 1.900 . 2.200 2.119 1.818 2.264 0.064 5 0 "[ . 1 . 2]" 2
54 1 100 THR N 1 112 ASP O 2.900 2.600 3.200 3.000 2.759 3.116 . 0 0 "[ . 1 . 2]" 2
55 1 98 THR O 1 114 GLU H 1.900 . 2.200 2.153 1.846 2.274 0.074 19 0 "[ . 1 . 2]" 2
56 1 98 THR O 1 114 GLU N 2.900 2.600 3.200 3.046 2.789 3.166 . 0 0 "[ . 1 . 2]" 2
57 1 98 THR H 1 114 GLU O 1.900 . 2.200 1.963 1.668 2.276 0.076 7 0 "[ . 1 . 2]" 2
58 1 98 THR N 1 114 GLU O 2.900 2.600 3.200 2.907 2.630 3.245 0.045 7 0 "[ . 1 . 2]" 2
59 1 6 VAL O 1 115 HIS H 2.900 . 4.200 2.168 1.700 3.615 . 0 0 "[ . 1 . 2]" 2
60 1 6 VAL O 1 115 HIS N 3.900 2.600 5.200 2.932 2.640 3.814 . 0 0 "[ . 1 . 2]" 2
61 1 6 VAL H 1 115 HIS O 2.900 . 4.200 2.412 1.722 4.230 0.030 10 0 "[ . 1 . 2]" 2
62 1 6 VAL N 1 115 HIS O 3.900 2.600 5.200 3.266 2.662 4.847 . 0 0 "[ . 1 . 2]" 2
63 1 8 HIS O 1 113 VAL H 1.900 . 2.200 1.775 1.687 1.892 . 0 0 "[ . 1 . 2]" 2
64 1 8 HIS O 1 113 VAL N 2.900 2.600 3.200 2.696 2.648 2.802 . 0 0 "[ . 1 . 2]" 2
65 1 8 HIS H 1 113 VAL O 1.900 . 2.200 2.294 2.195 2.387 0.187 9 0 "[ . 1 . 2]" 2
66 1 8 HIS N 1 113 VAL O 2.900 2.600 3.200 3.159 3.023 3.237 0.037 9 0 "[ . 1 . 2]" 2
67 1 10 VAL O 1 111 VAL H 1.900 . 2.200 1.891 1.706 2.021 . 0 0 "[ . 1 . 2]" 2
68 1 10 VAL O 1 111 VAL N 2.900 2.600 3.200 2.830 2.676 2.959 . 0 0 "[ . 1 . 2]" 2
69 1 10 VAL H 1 111 VAL O 1.900 . 2.200 2.289 1.993 2.477 0.277 1 0 "[ . 1 . 2]" 2
70 1 10 VAL N 1 111 VAL O 2.900 2.600 3.200 3.149 2.930 3.257 0.057 1 0 "[ . 1 . 2]" 2
71 1 12 VAL O 1 109 THR H 1.900 . 2.200 2.123 1.970 2.252 0.052 14 0 "[ . 1 . 2]" 2
72 1 12 VAL O 1 109 THR N 2.900 2.600 3.200 2.984 2.835 3.184 . 0 0 "[ . 1 . 2]" 2
73 1 12 VAL H 1 109 THR O 1.900 . 2.200 1.717 1.615 1.806 . 0 0 "[ . 1 . 2]" 2
74 1 12 VAL N 1 109 THR O 2.900 2.600 3.200 2.674 2.584 2.781 0.016 3 0 "[ . 1 . 2]" 2
75 1 121 MET O 1 125 HIS H 3.000 . 4.300 4.379 4.311 4.523 0.223 4 0 "[ . 1 . 2]" 2
76 1 121 MET O 1 125 HIS N 4.000 2.700 5.300 5.189 5.084 5.298 . 0 0 "[ . 1 . 2]" 2
77 1 123 THR O 1 127 LYS H 1.900 . 2.200 2.093 1.719 2.300 0.100 9 0 "[ . 1 . 2]" 2
78 1 123 THR O 1 127 LYS N 2.900 2.600 3.200 2.954 2.662 3.181 . 0 0 "[ . 1 . 2]" 2
79 1 124 LYS O 1 128 ARG H 1.900 . 2.200 2.020 1.738 2.226 0.026 14 0 "[ . 1 . 2]" 2
80 1 124 LYS O 1 128 ARG N 2.900 2.600 3.200 2.921 2.670 3.142 . 0 0 "[ . 1 . 2]" 2
81 1 125 HIS O 1 129 VAL H 1.900 . 2.200 2.304 2.206 2.375 0.175 16 0 "[ . 1 . 2]" 2
82 1 125 HIS O 1 129 VAL N 2.900 2.600 3.200 3.227 3.073 3.316 0.116 19 0 "[ . 1 . 2]" 2
83 1 126 ALA O 1 130 ARG H 1.900 . 2.200 2.033 1.671 2.222 0.022 20 0 "[ . 1 . 2]" 2
84 1 126 ALA O 1 130 ARG N 2.900 2.600 3.200 2.896 2.632 3.125 . 0 0 "[ . 1 . 2]" 2
85 1 136 GLY O 1 140 ILE H 1.900 . 2.200 1.762 1.624 1.842 . 0 0 "[ . 1 . 2]" 2
86 1 136 GLY O 1 140 ILE N 2.900 2.600 3.200 2.684 2.582 2.762 0.018 9 0 "[ . 1 . 2]" 2
87 1 137 TRP O 1 141 LEU H 1.900 . 2.200 2.029 1.655 2.224 0.024 1 0 "[ . 1 . 2]" 2
88 1 137 TRP O 1 141 LEU N 2.900 2.600 3.200 2.946 2.632 3.158 . 0 0 "[ . 1 . 2]" 2
89 1 139 THR O 1 143 SER H 1.900 . 2.200 2.274 2.184 2.379 0.179 18 0 "[ . 1 . 2]" 2
90 1 139 THR O 1 143 SER N 2.900 2.600 3.200 3.252 3.164 3.357 0.157 18 0 "[ . 1 . 2]" 2
91 1 140 ILE O 1 144 PHE H 1.900 . 2.200 1.798 1.669 1.874 . 0 0 "[ . 1 . 2]" 2
92 1 140 ILE O 1 144 PHE N 2.900 2.600 3.200 2.618 2.555 2.687 0.045 18 0 "[ . 1 . 2]" 2
93 1 141 LEU O 1 145 GLN H 1.900 . 2.200 2.111 1.753 2.252 0.052 8 0 "[ . 1 . 2]" 2
94 1 141 LEU O 1 145 GLN N 2.900 2.600 3.200 3.068 2.736 3.200 0.000 8 0 "[ . 1 . 2]" 2
95 1 142 GLN O 1 146 ASP H 1.900 . 2.200 2.235 2.054 2.304 0.104 17 0 "[ . 1 . 2]" 2
96 1 142 GLN O 1 146 ASP N 2.900 2.600 3.200 3.050 2.931 3.172 . 0 0 "[ . 1 . 2]" 2
97 1 143 SER O 1 147 LYS H 1.900 . 2.200 1.906 1.744 2.116 . 0 0 "[ . 1 . 2]" 2
98 1 143 SER O 1 147 LYS N 2.900 2.600 3.200 2.847 2.679 3.083 . 0 0 "[ . 1 . 2]" 2
99 1 144 PHE O 1 148 ILE H 1.900 . 2.200 2.131 1.891 2.273 0.073 4 0 "[ . 1 . 2]" 2
100 1 144 PHE O 1 148 ILE N 2.900 2.600 3.200 3.070 2.854 3.224 0.024 4 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 2:09:08 PM GMT (wattos1)