NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
394216 |
1qxn   |
4776 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1qxn
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 4607
_Distance_constraint_stats_list.Viol_count 2112
_Distance_constraint_stats_list.Viol_total 1771.464
_Distance_constraint_stats_list.Viol_max 0.968
_Distance_constraint_stats_list.Viol_rms 0.0302
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0038
_Distance_constraint_stats_list.Viol_average_violations_only 0.0839
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ASP 1.325 0.507 3 1 "[ + . 1]"
1 3 MET 0.207 0.116 7 0 "[ . 1]"
1 4 GLY 0.061 0.033 9 0 "[ . 1]"
1 5 GLU 1.202 0.345 7 0 "[ . 1]"
1 6 LYS 2.755 0.503 2 1 "[ + . 1]"
1 7 PHE 2.733 0.401 10 0 "[ . 1]"
1 8 ASP 0.037 0.031 10 0 "[ . 1]"
1 9 ALA 0.000 0.000 . 0 "[ . 1]"
1 10 THR 0.018 0.018 5 0 "[ . 1]"
1 11 PHE 3.178 0.503 2 1 "[ + . 1]"
1 12 LYS 1.427 0.503 2 1 "[ + . 1]"
1 13 ALA 1.119 0.156 10 0 "[ . 1]"
1 14 GLN 0.647 0.103 1 0 "[ . 1]"
1 15 VAL 1.816 0.221 5 0 "[ . 1]"
1 16 LYS 2.314 0.440 2 0 "[ . 1]"
1 17 ALA 1.965 0.440 2 0 "[ . 1]"
1 18 ALA 0.415 0.094 7 0 "[ . 1]"
1 19 LYS 0.649 0.224 2 0 "[ . 1]"
1 20 ALA 0.000 0.000 . 0 "[ . 1]"
1 21 ASP 0.035 0.024 5 0 "[ . 1]"
1 22 MET 0.559 0.148 5 0 "[ . 1]"
1 23 VAL 0.078 0.050 7 0 "[ . 1]"
1 24 MET 3.849 0.239 3 0 "[ . 1]"
1 25 LEU 1.262 0.148 5 0 "[ . 1]"
1 26 SER 0.624 0.112 6 0 "[ . 1]"
1 27 PRO 3.086 0.190 7 0 "[ . 1]"
1 28 LYS 1.660 0.345 7 0 "[ . 1]"
1 29 ASP 1.831 0.382 5 0 "[ . 1]"
1 30 ALA 2.010 0.126 2 0 "[ . 1]"
1 31 TYR 1.943 0.150 6 0 "[ . 1]"
1 32 LYS 1.303 0.606 8 2 "[- . + 1]"
1 33 LEU 3.767 0.606 8 2 "[- . + 1]"
1 34 LEU 2.121 0.235 9 0 "[ . 1]"
1 35 GLN 1.774 0.743 5 2 "[ - + 1]"
1 36 GLU 1.708 0.245 2 0 "[ . 1]"
1 37 ASN 0.530 0.093 6 0 "[ . 1]"
1 38 PRO 0.006 0.006 2 0 "[ . 1]"
1 39 ASP 0.690 0.264 10 0 "[ . 1]"
1 40 ILE 0.157 0.039 5 0 "[ . 1]"
1 41 THR 1.728 0.530 9 1 "[ . +1]"
1 42 LEU 3.248 0.229 7 0 "[ . 1]"
1 43 ILE 4.300 0.705 8 4 "[* *. -+ 1]"
1 44 ASP 0.625 0.088 1 0 "[ . 1]"
1 45 VAL 1.764 0.225 4 0 "[ . 1]"
1 46 ARG 0.176 0.082 9 0 "[ . 1]"
1 47 ASP 0.355 0.077 9 0 "[ . 1]"
1 48 PRO 0.002 0.002 10 0 "[ . 1]"
1 49 ASP 1.204 0.310 10 0 "[ . 1]"
1 50 GLU 0.012 0.012 8 0 "[ . 1]"
1 51 LEU 2.503 0.675 10 3 "[ *. -+]"
1 52 LYS 0.119 0.046 1 0 "[ . 1]"
1 53 ALA 0.586 0.232 7 0 "[ . 1]"
1 54 MET 0.756 0.232 7 0 "[ . 1]"
1 55 GLY 2.788 0.164 9 0 "[ . 1]"
1 56 LYS 4.531 0.771 10 3 "[ -. *+]"
1 57 PRO 2.193 0.208 5 0 "[ . 1]"
1 58 ASP 0.019 0.011 3 0 "[ . 1]"
1 59 VAL 1.357 0.208 5 0 "[ . 1]"
1 60 LYS 1.882 0.205 7 0 "[ . 1]"
1 61 ASN 2.818 0.612 9 1 "[ . +1]"
1 62 TYR 5.474 0.705 8 4 "[* *. -+ 1]"
1 63 LYS 4.606 0.550 6 1 "[ .+ 1]"
1 64 HIS 2.458 0.550 6 1 "[ .+ 1]"
1 65 MET 1.270 0.134 9 0 "[ . 1]"
1 66 SER 0.308 0.101 5 0 "[ . 1]"
1 67 ARG 0.589 0.096 3 0 "[ . 1]"
1 68 GLY 0.687 0.245 2 0 "[ . 1]"
1 69 LYS 1.000 0.210 7 0 "[ . 1]"
1 70 LEU 4.932 0.472 4 0 "[ . 1]"
1 71 GLU 0.598 0.214 4 0 "[ . 1]"
1 72 PRO 0.017 0.017 2 0 "[ . 1]"
1 73 LEU 1.383 0.134 9 0 "[ . 1]"
1 74 LEU 5.061 0.472 4 0 "[ . 1]"
1 75 ALA 1.592 0.390 3 0 "[ . 1]"
1 76 LYS 0.832 0.134 2 0 "[ . 1]"
1 77 SER 0.014 0.010 8 0 "[ . 1]"
1 78 GLY 0.000 0.000 . 0 "[ . 1]"
1 79 LEU 4.371 0.440 2 0 "[ . 1]"
1 80 ASP 1.720 0.421 6 0 "[ . 1]"
1 81 PRO 0.000 0.000 . 0 "[ . 1]"
1 82 GLU 3.640 0.744 4 1 "[ +. 1]"
1 83 LYS 4.474 0.808 2 2 "[-+ . 1]"
1 84 PRO 2.417 0.331 9 0 "[ . 1]"
1 85 VAL 1.765 0.331 9 0 "[ . 1]"
1 86 VAL 1.711 0.169 7 0 "[ . 1]"
1 87 VAL 1.230 0.100 2 0 "[ . 1]"
1 88 PHE 7.035 0.403 3 0 "[ . 1]"
1 89 CYS 0.304 0.104 9 0 "[ . 1]"
1 95 ALA 0.392 0.082 9 0 "[ . 1]"
1 96 ALA 1.693 0.225 4 0 "[ . 1]"
1 97 LEU 2.202 0.210 9 0 "[ . 1]"
1 98 ALA 0.408 0.087 2 0 "[ . 1]"
1 99 GLY 0.524 0.087 2 0 "[ . 1]"
1 100 LYS 2.527 0.331 9 0 "[ . 1]"
1 101 THR 2.738 0.266 1 0 "[ . 1]"
1 102 LEU 1.418 0.149 1 0 "[ . 1]"
1 103 ARG 0.960 0.095 9 0 "[ . 1]"
1 104 GLU 2.250 0.518 6 1 "[ .+ 1]"
1 105 TYR 2.832 0.382 5 0 "[ . 1]"
1 106 GLY 0.802 0.082 3 0 "[ . 1]"
1 107 PHE 2.459 0.472 4 0 "[ . 1]"
1 108 LYS 0.583 0.300 5 0 "[ . 1]"
1 109 THR 0.423 0.082 9 0 "[ . 1]"
1 110 ILE 2.249 0.331 9 0 "[ . 1]"
1 111 TYR 3.728 0.382 5 0 "[ . 1]"
1 112 ASN 0.197 0.049 8 0 "[ . 1]"
1 113 SER 1.504 0.403 3 0 "[ . 1]"
1 114 GLU 2.043 0.205 9 0 "[ . 1]"
1 115 GLY 0.424 0.177 5 0 "[ . 1]"
1 116 GLY 0.152 0.123 8 0 "[ . 1]"
1 117 MET 0.113 0.094 3 0 "[ . 1]"
1 118 ASP 0.000 0.000 . 0 "[ . 1]"
1 119 LYS 0.793 0.177 5 0 "[ . 1]"
1 120 TRP 3.813 0.231 6 0 "[ . 1]"
1 121 LEU 1.211 0.164 9 0 "[ . 1]"
1 122 GLU 0.000 0.000 . 0 "[ . 1]"
1 123 GLU 0.525 0.345 7 0 "[ . 1]"
1 124 GLY 0.000 0.000 . 0 "[ . 1]"
1 125 LEU 1.045 0.114 1 0 "[ . 1]"
1 126 PRO 1.817 0.169 7 0 "[ . 1]"
1 127 SER 0.000 0.000 . 0 "[ . 1]"
1 128 LEU 1.551 0.771 10 2 "[ -. +]"
1 129 ASP 0.059 0.030 9 0 "[ . 1]"
1 130 ARG 1.104 0.910 2 1 "[ + . 1]"
2 2 ASP 1.454 0.488 3 0 "[ . 1]"
2 3 MET 0.265 0.124 9 0 "[ . 1]"
2 4 GLY 0.340 0.072 1 0 "[ . 1]"
2 5 GLU 1.711 0.401 10 0 "[ . 1]"
2 6 LYS 1.819 0.423 6 0 "[ . 1]"
2 7 PHE 2.976 0.401 10 0 "[ . 1]"
2 8 ASP 0.112 0.043 9 0 "[ . 1]"
2 9 ALA 0.000 0.000 . 0 "[ . 1]"
2 10 THR 0.049 0.032 6 0 "[ . 1]"
2 11 PHE 5.155 0.550 7 2 "[- . + 1]"
2 12 LYS 1.819 0.550 7 2 "[- . + 1]"
2 13 ALA 1.274 0.166 6 0 "[ . 1]"
2 14 GLN 1.601 0.210 7 0 "[ . 1]"
2 15 VAL 2.900 0.210 9 0 "[ . 1]"
2 16 LYS 1.743 0.507 1 1 "[+ . 1]"
2 17 ALA 0.484 0.146 6 0 "[ . 1]"
2 18 ALA 0.823 0.424 9 0 "[ . 1]"
2 19 LYS 0.999 0.409 3 0 "[ . 1]"
2 20 ALA 0.000 0.000 . 0 "[ . 1]"
2 21 ASP 0.757 0.424 9 0 "[ . 1]"
2 22 MET 0.590 0.122 6 0 "[ . 1]"
2 23 VAL 0.049 0.045 6 0 "[ . 1]"
2 24 MET 4.622 0.409 3 0 "[ . 1]"
2 25 LEU 1.227 0.122 6 0 "[ . 1]"
2 26 SER 0.418 0.088 7 0 "[ . 1]"
2 27 PRO 4.582 0.968 5 1 "[ + 1]"
2 28 LYS 1.906 0.968 5 1 "[ + 1]"
2 29 ASP 0.977 0.153 10 0 "[ . 1]"
2 30 ALA 2.142 0.125 1 0 "[ . 1]"
2 31 TYR 2.872 0.892 7 1 "[ . + 1]"
2 32 LYS 0.461 0.248 6 0 "[ . 1]"
2 33 LEU 2.584 0.256 10 0 "[ . 1]"
2 34 LEU 2.017 0.298 5 0 "[ . 1]"
2 35 GLN 3.024 0.789 5 3 "[ * + -]"
2 36 GLU 1.870 0.298 5 0 "[ . 1]"
2 37 ASN 0.495 0.172 2 0 "[ . 1]"
2 38 PRO 0.000 0.000 . 0 "[ . 1]"
2 39 ASP 1.075 0.274 9 0 "[ . 1]"
2 40 ILE 0.817 0.354 10 0 "[ . 1]"
2 41 THR 1.847 0.569 10 1 "[ . +]"
2 42 LEU 4.352 0.892 7 1 "[ . + 1]"
2 43 ILE 3.721 0.843 1 3 "[+ - *1]"
2 44 ASP 0.857 0.128 2 0 "[ . 1]"
2 45 VAL 2.872 0.401 10 0 "[ . 1]"
2 46 ARG 0.323 0.070 6 0 "[ . 1]"
2 47 ASP 0.435 0.157 10 0 "[ . 1]"
2 48 PRO 0.000 0.000 . 0 "[ . 1]"
2 49 ASP 0.228 0.217 6 0 "[ . 1]"
2 50 GLU 0.217 0.217 6 0 "[ . 1]"
2 51 LEU 2.556 0.839 4 2 "[ +. -1]"
2 52 LYS 0.942 0.507 1 1 "[+ . 1]"
2 53 ALA 0.137 0.052 3 0 "[ . 1]"
2 54 MET 0.250 0.053 2 0 "[ . 1]"
2 55 GLY 3.944 0.751 2 1 "[ + . 1]"
2 56 LYS 4.695 0.839 4 2 "[ +. -1]"
2 57 PRO 1.593 0.139 4 0 "[ . 1]"
2 58 ASP 0.230 0.199 5 0 "[ . 1]"
2 59 VAL 0.665 0.102 10 0 "[ . 1]"
2 60 LYS 1.566 0.279 5 0 "[ . 1]"
2 61 ASN 4.882 0.662 10 2 "[ - +]"
2 62 TYR 4.317 0.843 1 3 "[+ * -1]"
2 63 LYS 2.661 0.337 8 0 "[ . 1]"
2 64 HIS 1.781 0.286 2 0 "[ . 1]"
2 65 MET 1.705 0.127 1 0 "[ . 1]"
2 66 SER 0.355 0.126 5 0 "[ . 1]"
2 67 ARG 0.844 0.183 3 0 "[ . 1]"
2 68 GLY 0.000 0.000 . 0 "[ . 1]"
2 69 LYS 0.000 0.000 . 0 "[ . 1]"
2 70 LEU 0.976 0.076 2 0 "[ . 1]"
2 71 GLU 0.000 0.000 . 0 "[ . 1]"
2 72 PRO 0.003 0.003 9 0 "[ . 1]"
2 73 LEU 1.090 0.105 10 0 "[ . 1]"
2 74 LEU 4.320 0.242 2 0 "[ . 1]"
2 75 ALA 0.740 0.242 2 0 "[ . 1]"
2 76 LYS 0.881 0.112 1 0 "[ . 1]"
2 77 SER 0.136 0.046 6 0 "[ . 1]"
2 78 GLY 0.995 0.184 4 0 "[ . 1]"
2 79 LEU 1.620 0.312 5 0 "[ . 1]"
2 80 ASP 1.081 0.423 6 0 "[ . 1]"
2 81 PRO 0.995 0.184 4 0 "[ . 1]"
2 82 GLU 3.242 0.680 4 1 "[ +. 1]"
2 83 LYS 3.527 0.552 10 1 "[ . +]"
2 84 PRO 2.731 0.298 5 0 "[ . 1]"
2 85 VAL 1.949 0.183 10 0 "[ . 1]"
2 86 VAL 2.022 0.298 5 0 "[ . 1]"
2 87 VAL 1.816 0.210 7 0 "[ . 1]"
2 88 PHE 6.637 0.241 3 0 "[ . 1]"
2 89 CYS 0.271 0.080 9 0 "[ . 1]"
2 95 ALA 0.559 0.070 6 0 "[ . 1]"
2 96 ALA 2.928 0.409 3 0 "[ . 1]"
2 97 LEU 2.296 0.221 5 0 "[ . 1]"
2 98 ALA 0.595 0.107 6 0 "[ . 1]"
2 99 GLY 0.403 0.048 9 0 "[ . 1]"
2 100 LYS 3.946 0.753 7 1 "[ . + 1]"
2 101 THR 2.266 0.246 2 0 "[ . 1]"
2 102 LEU 0.653 0.127 1 0 "[ . 1]"
2 103 ARG 2.849 0.753 7 1 "[ . + 1]"
2 104 GLU 3.004 0.489 4 0 "[ . 1]"
2 105 TYR 2.288 0.166 6 0 "[ . 1]"
2 106 GLY 1.143 0.108 9 0 "[ . 1]"
2 107 PHE 1.503 0.401 10 0 "[ . 1]"
2 108 LYS 0.348 0.070 6 0 "[ . 1]"
2 109 THR 0.471 0.090 7 0 "[ . 1]"
2 110 ILE 2.608 0.183 10 0 "[ . 1]"
2 111 TYR 3.752 0.892 7 1 "[ . + 1]"
2 112 ASN 0.296 0.062 1 0 "[ . 1]"
2 113 SER 0.909 0.235 4 0 "[ . 1]"
2 114 GLU 1.974 0.308 5 0 "[ . 1]"
2 115 GLY 0.536 0.408 4 0 "[ . 1]"
2 116 GLY 0.208 0.103 10 0 "[ . 1]"
2 117 MET 0.000 0.000 . 0 "[ . 1]"
2 118 ASP 0.000 0.000 . 0 "[ . 1]"
2 119 LYS 0.888 0.408 4 0 "[ . 1]"
2 120 TRP 3.401 0.241 3 0 "[ . 1]"
2 121 LEU 1.071 0.154 5 0 "[ . 1]"
2 122 GLU 0.000 0.000 . 0 "[ . 1]"
2 123 GLU 0.512 0.380 9 0 "[ . 1]"
2 124 GLY 0.000 0.000 . 0 "[ . 1]"
2 125 LEU 1.022 0.081 1 0 "[ . 1]"
2 126 PRO 2.291 0.298 5 0 "[ . 1]"
2 127 SER 0.000 0.000 . 0 "[ . 1]"
2 128 LEU 1.711 0.716 4 2 "[ +. -1]"
2 129 ASP 1.511 0.751 2 1 "[ + . 1]"
2 130 ARG 1.936 0.864 4 1 "[ +. 1]"
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 85 VAL H 1 110 ILE HA 2.900 . 4.000 2.816 2.639 3.050 . 0 0 "[ . 1]" 1
2 2 85 VAL H 2 110 ILE HA 2.900 . 4.000 2.753 2.604 2.887 . 0 0 "[ . 1]" 1
3 1 40 ILE H 1 61 ASN HD22 3.600 . 5.200 3.881 3.439 4.593 . 0 0 "[ . 1]" 1
4 2 40 ILE H 2 61 ASN HD22 3.600 . 5.200 3.989 3.484 5.554 0.354 10 0 "[ . 1]" 1
5 1 56 LYS H 1 128 LEU H 2.500 . 3.300 2.594 2.305 2.970 . 0 0 "[ . 1]" 1
6 2 56 LYS H 2 128 LEU H 2.500 . 3.300 2.566 2.242 2.994 . 0 0 "[ . 1]" 1
7 1 39 ASP H 1 61 ASN HD21 4.300 . 6.000 4.400 3.869 4.874 . 0 0 "[ . 1]" 1
8 2 39 ASP H 2 61 ASN HD21 4.300 . 6.000 4.319 3.785 4.763 . 0 0 "[ . 1]" 1
9 1 23 VAL H 1 111 TYR HA 3.000 . 4.100 3.074 2.511 3.582 . 0 0 "[ . 1]" 1
10 2 23 VAL H 2 111 TYR HA 3.000 . 4.100 3.018 2.540 3.534 . 0 0 "[ . 1]" 1
11 1 24 MET HA 1 112 ASN H 3.000 . 4.100 2.883 2.610 3.226 . 0 0 "[ . 1]" 1
12 2 24 MET HA 2 112 ASN H 3.000 . 4.100 2.841 2.706 3.029 . 0 0 "[ . 1]" 1
13 1 25 LEU H 1 112 ASN H 2.900 . 3.900 3.080 2.804 3.287 . 0 0 "[ . 1]" 1
14 2 25 LEU H 2 112 ASN H 2.900 . 3.900 2.978 2.719 3.197 . 0 0 "[ . 1]" 1
15 1 96 ALA H 1 112 ASN HD22 2.800 . 3.800 2.850 2.625 3.072 . 0 0 "[ . 1]" 1
16 2 96 ALA H 2 112 ASN HD22 2.800 . 3.800 2.831 2.361 3.129 . 0 0 "[ . 1]" 1
17 1 42 LEU HA 1 86 VAL H 2.800 . 3.800 2.598 2.448 2.804 . 0 0 "[ . 1]" 1
18 2 42 LEU HA 2 86 VAL H 2.800 . 3.800 2.593 2.450 2.796 . 0 0 "[ . 1]" 1
19 1 87 VAL H 1 112 ASN HA 2.900 . 3.900 2.789 2.579 2.993 . 0 0 "[ . 1]" 1
20 2 87 VAL H 2 112 ASN HA 2.900 . 3.900 2.831 2.581 3.029 . 0 0 "[ . 1]" 1
21 1 58 ASP H 1 128 LEU H 4.300 . 6.000 3.796 3.422 4.286 . 0 0 "[ . 1]" 1
22 2 58 ASP H 2 128 LEU H 4.300 . 6.000 3.738 3.254 4.143 . 0 0 "[ . 1]" 1
23 1 41 THR H 1 85 VAL HA 2.900 . 3.900 2.770 2.615 2.948 . 0 0 "[ . 1]" 1
24 2 41 THR H 2 85 VAL HA 2.900 . 3.900 2.793 2.601 3.083 . 0 0 "[ . 1]" 1
25 1 25 LEU H 1 114 GLU H 3.500 . 5.000 3.567 3.200 4.103 . 0 0 "[ . 1]" 1
26 2 25 LEU H 2 114 GLU H 3.500 . 5.000 3.644 3.294 4.162 . 0 0 "[ . 1]" 1
27 1 43 ILE H 1 87 VAL HA 2.900 . 3.900 2.816 2.622 2.926 . 0 0 "[ . 1]" 1
28 2 43 ILE H 2 87 VAL HA 2.900 . 3.900 2.805 2.579 3.045 . 0 0 "[ . 1]" 1
29 1 44 ASP H 1 65 MET H 3.600 . 5.200 3.680 3.511 3.978 . 0 0 "[ . 1]" 1
30 2 44 ASP H 2 65 MET H 3.600 . 5.200 3.584 3.233 3.796 . 0 0 "[ . 1]" 1
31 1 44 ASP H 1 64 HIS HA 2.800 . 3.800 2.876 2.711 3.045 . 0 0 "[ . 1]" 1
32 2 44 ASP H 2 64 HIS HA 2.800 . 3.800 2.852 2.605 3.022 . 0 0 "[ . 1]" 1
33 1 43 ILE HA 1 63 LYS H 2.700 . 3.600 2.982 2.832 3.223 . 0 0 "[ . 1]" 1
34 2 43 ILE HA 2 63 LYS H 2.700 . 3.600 2.969 2.740 3.186 . 0 0 "[ . 1]" 1
35 1 42 LEU H 1 62 TYR HA 5.600 . 6.000 2.954 2.439 3.865 . 0 0 "[ . 1]" 1
36 2 42 LEU H 2 62 TYR HA 5.600 . 6.000 2.709 2.373 3.213 . 0 0 "[ . 1]" 1
37 1 58 ASP H 1 120 TRP HE1 3.500 . 5.000 2.625 2.494 2.769 . 0 0 "[ . 1]" 1
38 2 58 ASP H 2 120 TRP HE1 3.500 . 5.000 2.726 2.546 2.887 . 0 0 "[ . 1]" 1
39 1 45 VAL HA 1 65 MET H 3.400 . 4.800 3.692 3.323 3.951 . 0 0 "[ . 1]" 1
40 2 45 VAL HA 2 65 MET H 3.400 . 4.800 3.587 3.192 3.923 . 0 0 "[ . 1]" 1
41 1 106 GLY H 1 107 PHE H 2.800 . 3.800 2.219 1.974 2.905 0.026 5 0 "[ . 1]" 1
42 2 106 GLY H 2 107 PHE H 2.800 . 3.800 2.163 1.977 2.588 0.023 5 0 "[ . 1]" 1
43 1 105 TYR H 1 106 GLY H 2.400 . 3.100 2.056 1.988 2.112 0.012 4 0 "[ . 1]" 1
44 2 105 TYR H 2 106 GLY H 2.400 . 3.100 2.022 1.956 2.103 0.044 1 0 "[ . 1]" 1
45 1 106 GLY H 1 110 ILE MD 4.600 . 6.000 6.057 6.024 6.082 0.082 3 0 "[ . 1]" 1
46 2 106 GLY H 2 110 ILE MD 4.600 . 6.000 6.073 6.032 6.108 0.108 9 0 "[ . 1]" 1
47 1 106 GLY H 1 107 PHE QD 2.800 . 3.800 3.643 3.152 3.837 0.037 2 0 "[ . 1]" 1
48 2 106 GLY H 2 107 PHE QD 2.800 . 3.800 3.827 3.803 3.855 0.055 3 0 "[ . 1]" 1
49 1 105 TYR QD 1 106 GLY H 4.300 . 6.000 4.551 4.306 4.652 . 0 0 "[ . 1]" 1
50 2 105 TYR QD 2 106 GLY H 4.200 . 6.000 4.615 4.535 4.694 . 0 0 "[ . 1]" 1
51 1 103 ARG HA 1 106 GLY H 3.000 . 4.100 3.181 3.006 3.366 . 0 0 "[ . 1]" 1
52 2 103 ARG HA 2 106 GLY H 3.000 . 4.100 3.185 2.930 3.352 . 0 0 "[ . 1]" 1
53 1 104 GLU HA 1 106 GLY H 4.200 . 6.000 4.093 3.660 4.703 . 0 0 "[ . 1]" 1
54 2 104 GLU HA 2 106 GLY H 4.200 . 6.000 3.912 3.749 4.142 . 0 0 "[ . 1]" 1
55 1 106 GLY H 1 106 GLY HA3 2.500 . 3.300 2.948 2.936 2.956 . 0 0 "[ . 1]" 1
56 2 106 GLY H 2 106 GLY HA3 2.500 . 3.300 2.947 2.915 2.955 . 0 0 "[ . 1]" 1
57 1 106 GLY H 1 107 PHE HB3 5.600 . 6.000 5.414 5.236 5.608 . 0 0 "[ . 1]" 1
58 2 106 GLY H 2 107 PHE HB3 5.600 . 6.000 5.465 5.334 5.784 . 0 0 "[ . 1]" 1
59 1 106 GLY H 1 107 PHE HA 3.900 . 5.800 4.679 4.433 4.869 . 0 0 "[ . 1]" 1
60 2 106 GLY H 2 107 PHE HA 3.900 . 5.800 4.748 4.652 4.933 . 0 0 "[ . 1]" 1
61 1 106 GLY H 1 107 PHE HB2 3.800 . 5.600 3.878 3.694 4.119 . 0 0 "[ . 1]" 1
62 2 106 GLY H 2 107 PHE HB2 3.800 . 5.600 3.945 3.823 4.228 . 0 0 "[ . 1]" 1
63 1 105 TYR HB2 1 106 GLY H 3.400 . 4.800 3.175 2.611 3.535 . 0 0 "[ . 1]" 1
64 2 105 TYR HB2 2 106 GLY H 3.400 . 4.800 3.386 3.235 3.456 . 0 0 "[ . 1]" 1
65 1 67 ARG H 1 68 GLY H 3.400 . 4.800 3.752 2.339 4.684 . 0 0 "[ . 1]" 1
66 2 67 ARG H 2 68 GLY H 3.400 . 4.800 3.596 2.361 4.225 . 0 0 "[ . 1]" 1
67 1 68 GLY H 1 69 LYS H 2.700 . 3.600 2.303 2.044 3.288 . 0 0 "[ . 1]" 1
68 2 68 GLY H 2 69 LYS H 2.700 . 3.600 2.249 2.114 3.162 . 0 0 "[ . 1]" 1
69 1 68 GLY H 1 68 GLY HA2 2.500 . 3.300 2.899 2.680 2.943 . 0 0 "[ . 1]" 1
70 2 68 GLY H 2 68 GLY HA2 2.500 . 3.300 2.908 2.714 2.943 . 0 0 "[ . 1]" 1
71 1 115 GLY HA2 1 116 GLY H 3.500 . 5.000 3.410 3.168 3.553 . 0 0 "[ . 1]" 1
72 2 115 GLY HA2 2 116 GLY H 3.500 . 5.000 3.458 3.339 3.560 . 0 0 "[ . 1]" 1
73 1 114 GLU HA 1 116 GLY H 4.000 . 6.000 5.540 5.285 5.943 . 0 0 "[ . 1]" 1
74 2 114 GLU HA 2 116 GLY H 4.000 . 6.000 5.332 4.570 6.103 0.103 10 0 "[ . 1]" 1
75 1 115 GLY HA3 1 116 GLY H 4.300 . 6.000 2.230 2.108 2.447 . 0 0 "[ . 1]" 1
76 2 115 GLY HA3 2 116 GLY H 4.300 . 6.000 2.274 2.138 2.498 . 0 0 "[ . 1]" 1
77 1 116 GLY H 1 116 GLY HA3 3.000 . 4.200 2.886 2.798 2.951 . 0 0 "[ . 1]" 1
78 2 116 GLY H 2 116 GLY HA3 3.000 . 4.200 2.912 2.883 2.953 . 0 0 "[ . 1]" 1
79 1 116 GLY H 1 116 GLY HA2 2.600 . 3.400 2.658 2.443 2.802 . 0 0 "[ . 1]" 1
80 2 116 GLY H 2 116 GLY HA2 2.600 . 3.400 2.641 2.509 2.706 . 0 0 "[ . 1]" 1
81 1 115 GLY H 1 116 GLY H 3.100 . 4.300 3.675 2.529 4.423 0.123 8 0 "[ . 1]" 1
82 2 115 GLY H 2 116 GLY H 3.100 . 4.300 3.606 2.480 4.321 0.021 3 0 "[ . 1]" 1
83 1 54 MET HB3 1 55 GLY H 3.900 . 5.800 3.635 3.381 4.242 . 0 0 "[ . 1]" 1
84 2 54 MET HB3 2 55 GLY H 3.900 . 5.800 3.619 3.427 4.026 . 0 0 "[ . 1]" 1
85 1 55 GLY H 1 121 LEU HG 4.000 . 6.000 6.118 6.076 6.164 0.164 9 0 "[ . 1]" 1
86 2 55 GLY H 2 121 LEU HG 4.000 . 6.000 6.097 6.049 6.154 0.154 5 0 "[ . 1]" 1
87 1 54 MET H 1 55 GLY H 2.200 . 2.800 2.306 2.225 2.418 . 0 0 "[ . 1]" 1
88 2 54 MET H 2 55 GLY H 2.200 . 2.800 2.307 2.198 2.482 . 0 0 "[ . 1]" 1
89 1 55 GLY H 1 55 GLY HA2 2.700 . 3.600 2.493 2.456 2.570 . 0 0 "[ . 1]" 1
90 2 55 GLY H 2 55 GLY HA2 2.700 . 3.600 2.487 2.383 2.621 . 0 0 "[ . 1]" 1
91 1 55 GLY H 1 55 GLY HA3 2.200 . 2.800 2.941 2.918 2.950 0.150 1 0 "[ . 1]" 1
92 2 55 GLY H 2 55 GLY HA3 2.200 . 2.800 2.934 2.902 2.949 0.149 6 0 "[ . 1]" 1
93 1 54 MET HG2 1 55 GLY H 5.100 . 6.000 4.711 3.802 5.033 . 0 0 "[ . 1]" 1
94 2 54 MET HG2 2 55 GLY H 5.100 . 6.000 4.801 4.001 5.006 . 0 0 "[ . 1]" 1
95 1 54 MET HG3 1 55 GLY H 4.300 . 6.000 4.547 2.296 4.944 . 0 0 "[ . 1]" 1
96 2 54 MET HG3 2 55 GLY H 4.300 . 6.000 4.796 4.464 5.036 . 0 0 "[ . 1]" 1
97 1 54 MET HB2 1 55 GLY H 3.300 . 4.600 2.929 2.791 3.611 . 0 0 "[ . 1]" 1
98 2 54 MET HB2 2 55 GLY H 3.300 . 4.600 2.918 2.756 3.235 . 0 0 "[ . 1]" 1
99 1 54 MET HA 1 55 GLY H 3.300 . 4.700 3.512 3.502 3.526 . 0 0 "[ . 1]" 1
100 2 54 MET HA 2 55 GLY H 3.300 . 4.700 3.502 3.423 3.533 . 0 0 "[ . 1]" 1
101 1 99 GLY H 1 100 LYS HB3 3.700 . 5.500 4.641 4.373 4.911 . 0 0 "[ . 1]" 1
102 2 99 GLY H 2 100 LYS HB3 3.700 . 5.500 4.579 4.246 4.832 . 0 0 "[ . 1]" 1
103 1 98 ALA MB 1 99 GLY H 3.000 . 4.100 2.523 2.284 2.665 . 0 0 "[ . 1]" 1
104 2 98 ALA MB 2 99 GLY H 3.000 . 4.100 2.544 2.193 2.757 . 0 0 "[ . 1]" 1
105 1 98 ALA HA 1 99 GLY H 3.600 . 5.200 3.535 3.520 3.549 . 0 0 "[ . 1]" 1
106 2 98 ALA HA 2 99 GLY H 3.600 . 5.200 3.526 3.490 3.538 . 0 0 "[ . 1]" 1
107 1 99 GLY H 1 99 GLY QA 2.300 . 2.900 2.219 2.193 2.246 . 0 0 "[ . 1]" 1
108 2 99 GLY H 2 99 GLY QA 2.300 . 2.900 2.225 2.188 2.278 . 0 0 "[ . 1]" 1
109 1 95 ALA HA 1 99 GLY H 3.600 . 5.200 4.293 3.917 4.614 . 0 0 "[ . 1]" 1
110 2 95 ALA HA 2 99 GLY H 3.600 . 5.200 4.406 3.978 4.540 . 0 0 "[ . 1]" 1
111 1 114 GLU H 1 114 GLU HB3 2.900 . 3.900 3.090 2.450 3.588 . 0 0 "[ . 1]" 1
112 2 114 GLU H 2 114 GLU HB3 2.900 . 3.900 3.230 2.681 3.521 . 0 0 "[ . 1]" 1
113 1 124 GLY H 1 125 LEU MD1 4.400 . 6.000 5.074 4.683 5.704 . 0 0 "[ . 1]" 1
114 2 124 GLY H 2 125 LEU MD1 4.400 . 6.000 5.078 4.860 5.259 . 0 0 "[ . 1]" 1
115 1 123 GLU HB3 1 124 GLY H 3.600 . 5.200 3.932 3.218 4.396 . 0 0 "[ . 1]" 1
116 2 123 GLU HB3 2 124 GLY H 3.600 . 5.200 4.045 3.586 4.402 . 0 0 "[ . 1]" 1
117 1 123 GLU HB2 1 124 GLY H 4.000 . 6.000 3.738 3.184 4.070 . 0 0 "[ . 1]" 1
118 2 123 GLU HB2 2 124 GLY H 4.000 . 6.000 3.728 3.305 4.107 . 0 0 "[ . 1]" 1
119 1 124 GLY H 1 125 LEU HG 4.400 . 6.000 4.172 3.618 4.743 . 0 0 "[ . 1]" 1
120 2 124 GLY H 2 125 LEU HG 4.400 . 6.000 4.128 3.831 4.450 . 0 0 "[ . 1]" 1
121 1 124 GLY H 1 125 LEU MD2 4.900 . 6.000 5.155 4.679 5.431 . 0 0 "[ . 1]" 1
122 2 124 GLY H 2 125 LEU MD2 4.900 . 6.000 5.085 4.775 5.520 . 0 0 "[ . 1]" 1
123 1 124 GLY H 1 125 LEU H 2.700 . 3.600 2.493 2.265 2.694 . 0 0 "[ . 1]" 1
124 2 124 GLY H 2 125 LEU H 2.700 . 3.600 2.520 2.434 2.780 . 0 0 "[ . 1]" 1
125 1 123 GLU HA 1 124 GLY H 2.700 . 3.600 3.266 3.035 3.430 . 0 0 "[ . 1]" 1
126 2 123 GLU HA 2 124 GLY H 2.700 . 3.600 3.250 3.048 3.367 . 0 0 "[ . 1]" 1
127 1 122 GLU HA 1 124 GLY H 3.100 . 4.300 3.684 3.527 3.933 . 0 0 "[ . 1]" 1
128 2 122 GLU HA 2 124 GLY H 3.100 . 4.300 3.662 3.565 3.798 . 0 0 "[ . 1]" 1
129 1 124 GLY H 1 124 GLY HA2 2.700 . 3.600 2.308 2.289 2.346 . 0 0 "[ . 1]" 1
130 2 124 GLY H 2 124 GLY HA2 2.700 . 3.600 2.303 2.288 2.316 . 0 0 "[ . 1]" 1
131 1 124 GLY H 1 124 GLY HA3 2.300 . 3.000 2.858 2.806 2.914 . 0 0 "[ . 1]" 1
132 2 124 GLY H 2 124 GLY HA3 2.300 . 3.000 2.851 2.792 2.878 . 0 0 "[ . 1]" 1
133 1 3 MET QB 1 4 GLY H 3.800 . 5.600 3.547 3.114 3.893 . 0 0 "[ . 1]" 1
134 2 3 MET QB 2 4 GLY H 3.800 . 5.600 3.547 3.350 3.802 . 0 0 "[ . 1]" 1
135 1 4 GLY H 1 5 GLU H 3.100 . 4.300 2.776 2.693 2.947 . 0 0 "[ . 1]" 1
136 2 4 GLY H 2 5 GLU H 3.100 . 4.300 2.743 2.638 2.842 . 0 0 "[ . 1]" 1
137 1 4 GLY H 1 4 GLY HA3 2.500 . 3.300 2.299 2.289 2.320 . 0 0 "[ . 1]" 1
138 2 4 GLY H 2 4 GLY HA3 2.500 . 3.300 2.293 2.272 2.307 . 0 0 "[ . 1]" 1
139 1 4 GLY H 1 4 GLY HA2 3.000 . 4.100 2.776 2.720 2.827 . 0 0 "[ . 1]" 1
140 2 4 GLY H 2 4 GLY HA2 3.000 . 4.100 2.785 2.770 2.806 . 0 0 "[ . 1]" 1
141 1 4 GLY H 1 5 GLU QB 4.700 . 6.000 4.786 4.414 5.259 . 0 0 "[ . 1]" 1
142 2 4 GLY H 2 5 GLU QB 4.700 . 6.000 4.761 4.416 5.283 . 0 0 "[ . 1]" 1
143 1 4 GLY H 2 75 ALA HA 5.100 . 6.000 4.993 4.348 5.992 . 0 0 "[ . 1]" 1
144 1 75 ALA HA 2 4 GLY H 5.100 . 6.000 4.944 4.489 5.681 . 0 0 "[ . 1]" 1
145 1 3 MET HA 1 4 GLY H 3.400 . 4.800 3.142 3.050 3.307 . 0 0 "[ . 1]" 1
146 2 3 MET HA 2 4 GLY H 3.400 . 4.800 3.126 2.890 3.266 . 0 0 "[ . 1]" 1
147 1 85 VAL H 1 111 TYR H 3.600 . 5.200 4.159 3.984 4.493 . 0 0 "[ . 1]" 1
148 2 85 VAL H 2 111 TYR H 3.600 . 5.200 4.092 3.836 4.244 . 0 0 "[ . 1]" 1
149 1 85 VAL H 1 86 VAL H 3.800 . 5.600 4.432 4.367 4.515 . 0 0 "[ . 1]" 1
150 2 85 VAL H 2 86 VAL H 3.800 . 5.600 4.431 4.368 4.494 . 0 0 "[ . 1]" 1
151 1 84 PRO HB3 1 85 VAL H 4.000 . 6.000 3.807 3.372 4.167 . 0 0 "[ . 1]" 1
152 2 84 PRO HB3 2 85 VAL H 4.000 . 6.000 3.711 3.416 3.964 . 0 0 "[ . 1]" 1
153 1 85 VAL H 1 85 VAL HB 3.200 . 4.500 3.701 3.623 3.787 . 0 0 "[ . 1]" 1
154 2 85 VAL H 2 85 VAL HB 3.200 . 4.500 3.743 3.620 3.817 . 0 0 "[ . 1]" 1
155 1 85 VAL H 1 85 VAL MG1 2.900 . 3.900 3.327 2.899 3.583 . 0 0 "[ . 1]" 1
156 2 85 VAL H 2 85 VAL MG1 2.900 . 3.900 3.255 2.765 3.536 . 0 0 "[ . 1]" 1
157 1 85 VAL H 1 85 VAL MG2 2.400 . 3.100 2.037 1.716 2.198 . 0 0 "[ . 1]" 1
158 2 85 VAL H 2 85 VAL MG2 2.400 . 3.100 2.137 1.728 2.421 . 0 0 "[ . 1]" 1
159 1 85 VAL H 1 111 TYR QD 3.700 . 5.400 3.935 3.589 4.277 . 0 0 "[ . 1]" 1
160 2 85 VAL H 2 111 TYR QD 3.700 . 5.400 3.903 3.675 4.237 . 0 0 "[ . 1]" 1
161 1 85 VAL H 1 111 TYR QE 3.600 . 5.200 3.740 3.433 4.068 . 0 0 "[ . 1]" 1
162 2 85 VAL H 2 111 TYR QE 3.600 . 5.200 3.575 3.292 3.943 . 0 0 "[ . 1]" 1
163 1 85 VAL H 1 85 VAL HA 2.900 . 3.900 2.938 2.926 2.948 . 0 0 "[ . 1]" 1
164 2 85 VAL H 2 85 VAL HA 2.900 . 3.900 2.939 2.927 2.947 . 0 0 "[ . 1]" 1
165 1 84 PRO HA 1 85 VAL H 2.200 . 2.800 2.187 2.160 2.225 . 0 0 "[ . 1]" 1
166 2 84 PRO HA 2 85 VAL H 2.200 . 2.800 2.177 2.148 2.217 . 0 0 "[ . 1]" 1
167 1 85 VAL H 1 109 THR HB 3.600 . 5.200 4.151 3.945 4.296 . 0 0 "[ . 1]" 1
168 2 85 VAL H 2 109 THR HB 3.600 . 5.200 4.178 3.732 4.644 . 0 0 "[ . 1]" 1
169 1 35 GLN HB2 1 35 GLN HE21 2.700 . 3.600 2.949 2.593 3.114 . 0 0 "[ . 1]" 1
170 2 35 GLN HB2 2 35 GLN HE21 2.700 . 3.600 3.003 2.831 3.217 . 0 0 "[ . 1]" 1
171 1 35 GLN HA 1 35 GLN HE21 4.300 . 6.000 4.901 4.064 5.490 . 0 0 "[ . 1]" 1
172 2 35 GLN HA 2 35 GLN HE21 4.300 . 6.000 5.133 4.409 5.512 . 0 0 "[ . 1]" 1
173 1 35 GLN HE22 1 35 GLN HG3 3.900 . 5.800 3.470 3.438 3.557 . 0 0 "[ . 1]" 1
174 2 35 GLN HE22 2 35 GLN HG3 3.900 . 5.800 3.460 3.430 3.510 . 0 0 "[ . 1]" 1
175 1 35 GLN HB2 1 35 GLN HE22 3.300 . 4.700 3.564 3.308 3.813 . 0 0 "[ . 1]" 1
176 2 35 GLN HB2 2 35 GLN HE22 3.300 . 4.700 3.610 3.509 3.879 . 0 0 "[ . 1]" 1
177 1 35 GLN HA 1 35 GLN HE22 6.000 . 6.000 5.635 4.563 6.072 0.072 9 0 "[ . 1]" 1
178 2 35 GLN HA 2 35 GLN HE22 6.000 . 6.000 5.751 4.439 6.156 0.156 8 0 "[ . 1]" 1
179 1 78 GLY H 1 79 LEU H 2.800 . 3.800 2.742 2.351 3.277 . 0 0 "[ . 1]" 1
180 2 78 GLY H 2 79 LEU H 2.800 . 3.800 2.747 2.274 3.490 . 0 0 "[ . 1]" 1
181 1 78 GLY H 1 78 GLY HA3 2.800 . 3.800 2.885 2.677 2.945 . 0 0 "[ . 1]" 1
182 2 78 GLY H 2 78 GLY HA3 2.800 . 3.800 2.868 2.642 2.929 . 0 0 "[ . 1]" 1
183 1 40 ILE H 1 61 ASN HD21 4.200 . 6.000 3.887 3.421 4.449 . 0 0 "[ . 1]" 1
184 2 40 ILE H 2 61 ASN HD21 4.200 . 6.000 3.806 3.562 4.211 . 0 0 "[ . 1]" 1
185 1 39 ASP HA 1 61 ASN HD21 3.700 . 5.400 4.442 3.519 5.377 . 0 0 "[ . 1]" 1
186 2 39 ASP HA 2 61 ASN HD21 3.700 . 5.400 4.370 3.118 5.374 . 0 0 "[ . 1]" 1
187 1 41 THR HA 1 61 ASN HD21 3.100 . 4.300 3.104 2.617 3.675 . 0 0 "[ . 1]" 1
188 2 41 THR HA 2 61 ASN HD21 3.100 . 4.300 3.284 2.607 3.890 . 0 0 "[ . 1]" 1
189 1 61 ASN HB3 1 61 ASN HD21 3.900 . 5.800 2.697 2.320 3.281 . 0 0 "[ . 1]" 1
190 2 61 ASN HB3 2 61 ASN HD21 3.900 . 5.800 2.730 2.220 3.299 . 0 0 "[ . 1]" 1
191 1 61 ASN HB2 1 61 ASN HD21 2.600 . 3.500 2.446 2.101 2.774 . 0 0 "[ . 1]" 1
192 2 61 ASN HB2 2 61 ASN HD21 2.600 . 3.500 2.413 2.107 2.879 . 0 0 "[ . 1]" 1
193 1 61 ASN HA 1 61 ASN HD22 4.900 . 6.000 5.187 4.427 5.408 . 0 0 "[ . 1]" 1
194 2 61 ASN HA 2 61 ASN HD22 4.900 . 6.000 5.102 4.431 5.405 . 0 0 "[ . 1]" 1
195 1 39 ASP HA 1 61 ASN HD22 3.600 . 5.200 4.979 2.918 5.464 0.264 10 0 "[ . 1]" 1
196 2 39 ASP HA 2 61 ASN HD22 3.600 . 5.200 4.962 3.537 5.474 0.274 9 0 "[ . 1]" 1
197 1 41 THR HA 1 61 ASN HD22 4.400 . 6.000 3.781 2.680 4.607 . 0 0 "[ . 1]" 1
198 2 41 THR HA 2 61 ASN HD22 4.400 . 6.000 4.100 3.058 4.830 . 0 0 "[ . 1]" 1
199 1 61 ASN HB3 1 61 ASN HD22 4.000 . 6.000 3.686 3.509 3.959 . 0 0 "[ . 1]" 1
200 2 61 ASN HB3 2 61 ASN HD22 4.000 . 6.000 3.698 3.483 3.965 . 0 0 "[ . 1]" 1
201 1 61 ASN HB2 1 61 ASN HD22 3.600 . 5.300 3.561 3.422 3.704 . 0 0 "[ . 1]" 1
202 2 61 ASN HB2 2 61 ASN HD22 3.600 . 5.300 3.550 3.426 3.751 . 0 0 "[ . 1]" 1
203 1 39 ASP H 1 61 ASN HD22 3.900 . 5.800 4.309 3.989 4.843 . 0 0 "[ . 1]" 1
204 2 39 ASP H 2 61 ASN HD22 3.900 . 5.800 4.405 4.044 5.988 0.188 10 0 "[ . 1]" 1
205 1 54 MET H 1 54 MET HB3 3.200 . 4.500 3.539 3.196 3.656 . 0 0 "[ . 1]" 1
206 2 54 MET H 2 54 MET HB3 3.200 . 4.500 3.568 3.491 3.652 . 0 0 "[ . 1]" 1
207 1 54 MET H 1 54 MET HB2 2.700 . 3.600 2.455 2.202 3.630 0.030 7 0 "[ . 1]" 1
208 2 54 MET H 2 54 MET HB2 2.700 . 3.600 2.350 2.222 2.778 . 0 0 "[ . 1]" 1
209 1 53 ALA MB 1 54 MET H 2.700 . 3.600 2.470 2.340 2.629 . 0 0 "[ . 1]" 1
210 2 53 ALA MB 2 54 MET H 2.700 . 3.600 2.546 2.388 2.745 . 0 0 "[ . 1]" 1
211 1 54 MET H 1 54 MET HA 2.800 . 3.800 2.920 2.898 2.931 . 0 0 "[ . 1]" 1
212 2 54 MET H 2 54 MET HA 2.800 . 3.800 2.917 2.888 2.929 . 0 0 "[ . 1]" 1
213 1 53 ALA HA 1 54 MET H 3.200 . 4.500 3.568 3.532 3.590 . 0 0 "[ . 1]" 1
214 2 53 ALA HA 2 54 MET H 3.200 . 4.500 3.566 3.536 3.578 . 0 0 "[ . 1]" 1
215 1 51 LEU HA 1 54 MET H 3.700 . 5.400 3.951 3.419 4.567 . 0 0 "[ . 1]" 1
216 2 51 LEU HA 2 54 MET H 3.700 . 5.400 3.942 3.493 4.186 . 0 0 "[ . 1]" 1
217 1 54 MET H 1 54 MET HG3 3.000 . 4.100 3.171 2.112 3.646 . 0 0 "[ . 1]" 1
218 2 54 MET H 2 54 MET HG3 3.000 . 4.100 3.253 2.815 3.533 . 0 0 "[ . 1]" 1
219 1 54 MET H 1 54 MET HG2 3.400 . 4.800 3.289 2.428 3.756 . 0 0 "[ . 1]" 1
220 2 54 MET H 2 54 MET HG2 3.400 . 4.800 3.389 1.984 3.785 0.016 1 0 "[ . 1]" 1
221 1 70 LEU HB2 1 71 GLU H 3.900 . 5.800 4.314 3.978 4.570 . 0 0 "[ . 1]" 1
222 2 70 LEU HB2 2 71 GLU H 3.900 . 5.800 4.286 3.979 4.535 . 0 0 "[ . 1]" 1
223 1 70 LEU HG 1 71 GLU H 3.000 . 4.100 2.864 2.188 3.498 . 0 0 "[ . 1]" 1
224 2 70 LEU HG 2 71 GLU H 3.000 . 4.100 2.718 1.907 3.332 . 0 0 "[ . 1]" 1
225 1 70 LEU MD2 1 71 GLU H 4.900 . 6.000 3.487 2.819 4.079 . 0 0 "[ . 1]" 1
226 2 70 LEU MD2 2 71 GLU H 4.900 . 6.000 3.562 2.841 4.121 . 0 0 "[ . 1]" 1
227 1 14 GLN HE21 1 14 GLN HG2 3.300 . 4.700 3.196 2.467 3.528 . 0 0 "[ . 1]" 1
228 2 14 GLN HE21 2 14 GLN HG2 3.300 . 4.700 2.912 2.115 3.478 . 0 0 "[ . 1]" 1
229 1 14 GLN HE21 1 14 GLN HG3 2.800 . 3.800 2.472 2.128 3.562 . 0 0 "[ . 1]" 1
230 2 14 GLN HE21 2 14 GLN HG3 2.800 . 3.800 2.549 2.129 3.478 . 0 0 "[ . 1]" 1
231 1 14 GLN HA 1 14 GLN HE22 5.200 . 6.000 5.678 5.432 5.781 . 0 0 "[ . 1]" 1
232 2 14 GLN HA 2 14 GLN HE22 5.200 . 6.000 5.367 4.475 5.774 . 0 0 "[ . 1]" 1
233 1 14 GLN HE22 1 14 GLN HG3 3.900 . 5.800 3.599 3.446 4.107 . 0 0 "[ . 1]" 1
234 2 14 GLN HE22 2 14 GLN HG3 3.900 . 5.800 3.633 3.457 4.062 . 0 0 "[ . 1]" 1
235 1 28 LYS H 1 30 ALA H 3.800 . 5.600 3.669 3.502 4.093 . 0 0 "[ . 1]" 1
236 2 28 LYS H 2 30 ALA H 3.800 . 5.600 3.645 3.554 3.759 . 0 0 "[ . 1]" 1
237 1 27 PRO HG2 1 28 LYS H 2.800 . 3.800 3.045 2.832 3.361 . 0 0 "[ . 1]" 1
238 2 27 PRO HG2 2 28 LYS H 2.800 . 3.800 3.067 2.866 3.262 . 0 0 "[ . 1]" 1
239 1 28 LYS H 1 28 LYS QB 2.200 . 2.800 2.555 2.115 2.909 0.109 7 0 "[ . 1]" 1
240 2 28 LYS H 2 28 LYS QB 2.200 . 2.800 2.539 2.240 2.913 0.113 7 0 "[ . 1]" 1
241 1 28 LYS H 1 28 LYS QG 3.400 . 4.000 2.290 1.736 3.161 0.164 7 0 "[ . 1]" 1
242 2 28 LYS H 2 28 LYS HG2 3.400 . 4.900 2.898 2.038 3.573 . 0 0 "[ . 1]" 1
243 2 28 LYS H 2 28 LYS HG3 2.900 . 4.000 2.550 1.823 3.969 . 0 0 "[ . 1]" 1
244 1 28 LYS H 1 125 LEU MD2 4.100 . 6.000 4.557 4.140 5.207 . 0 0 "[ . 1]" 1
245 2 28 LYS H 2 125 LEU MD2 4.100 . 6.000 4.662 4.177 5.201 . 0 0 "[ . 1]" 1
246 1 28 LYS H 1 125 LEU MD1 3.500 . 5.100 3.450 2.965 3.900 . 0 0 "[ . 1]" 1
247 2 28 LYS H 2 125 LEU MD1 3.500 . 5.100 3.606 3.272 4.068 . 0 0 "[ . 1]" 1
248 1 28 LYS H 1 29 ASP H 2.600 . 3.400 2.501 2.433 2.741 . 0 0 "[ . 1]" 1
249 2 28 LYS H 2 29 ASP H 2.600 . 3.400 2.477 2.458 2.512 . 0 0 "[ . 1]" 1
250 1 27 PRO HD2 1 28 LYS H 3.300 . 4.600 3.579 3.425 3.929 . 0 0 "[ . 1]" 1
251 2 27 PRO HD2 2 28 LYS H 3.300 . 4.600 3.585 3.409 3.825 . 0 0 "[ . 1]" 1
252 1 28 LYS H 1 28 LYS HA 2.800 . 3.800 2.862 2.793 2.878 . 0 0 "[ . 1]" 1
253 2 28 LYS H 2 28 LYS HA 2.800 . 3.800 2.870 2.862 2.877 . 0 0 "[ . 1]" 1
254 1 27 PRO HB3 1 28 LYS H 3.900 . 5.800 4.245 3.715 4.426 . 0 0 "[ . 1]" 1
255 2 27 PRO HB3 2 28 LYS H 3.900 . 5.800 4.309 4.218 4.397 . 0 0 "[ . 1]" 1
256 1 27 PRO HG3 1 28 LYS H 4.100 . 6.000 4.458 4.320 4.565 . 0 0 "[ . 1]" 1
257 2 27 PRO HG3 2 28 LYS H 4.100 . 6.000 4.495 4.357 4.609 . 0 0 "[ . 1]" 1
258 1 27 PRO HB2 1 28 LYS H 5.900 . 6.000 3.159 2.219 3.550 . 0 0 "[ . 1]" 1
259 2 27 PRO HB2 2 28 LYS H 5.900 . 6.000 3.251 2.967 3.483 . 0 0 "[ . 1]" 1
260 1 27 PRO HA 1 28 LYS H 3.200 . 4.500 3.538 3.455 3.611 . 0 0 "[ . 1]" 1
261 2 27 PRO HA 2 28 LYS H 3.200 . 4.500 3.537 3.470 3.610 . 0 0 "[ . 1]" 1
262 1 28 LYS H 1 29 ASP HB2 4.900 . 6.000 4.473 4.256 4.656 . 0 0 "[ . 1]" 1
263 2 28 LYS H 2 29 ASP HB2 4.900 . 6.000 4.453 4.319 4.684 . 0 0 "[ . 1]" 1
264 1 59 VAL H 1 59 VAL HB 3.700 . 5.400 3.804 3.558 3.930 . 0 0 "[ . 1]" 1
265 2 59 VAL H 2 59 VAL HB 3.700 . 5.400 3.809 3.635 3.925 . 0 0 "[ . 1]" 1
266 1 58 ASP HB2 1 59 VAL H 3.900 . 5.800 4.556 4.435 4.643 . 0 0 "[ . 1]" 1
267 2 58 ASP HB2 2 59 VAL H 3.900 . 5.800 4.553 4.462 4.630 . 0 0 "[ . 1]" 1
268 1 59 VAL H 1 59 VAL MG1 2.700 . 3.600 2.970 2.559 3.595 . 0 0 "[ . 1]" 1
269 2 59 VAL H 2 59 VAL MG1 2.700 . 3.600 2.845 2.475 3.562 . 0 0 "[ . 1]" 1
270 1 59 VAL H 1 59 VAL MG2 2.300 . 3.000 2.240 1.720 2.600 . 0 0 "[ . 1]" 1
271 2 59 VAL H 2 59 VAL MG2 2.300 . 3.000 2.425 2.093 2.620 . 0 0 "[ . 1]" 1
272 1 59 VAL H 1 59 VAL HA 2.700 . 3.600 2.937 2.928 2.944 . 0 0 "[ . 1]" 1
273 2 59 VAL H 2 59 VAL HA 2.700 . 3.600 2.936 2.927 2.944 . 0 0 "[ . 1]" 1
274 1 58 ASP HA 1 59 VAL H 2.000 . 2.500 2.262 2.191 2.409 . 0 0 "[ . 1]" 1
275 2 58 ASP HA 2 59 VAL H 2.000 . 2.500 2.273 2.178 2.388 . 0 0 "[ . 1]" 1
276 1 58 ASP HB3 1 59 VAL H 3.400 . 4.900 4.457 4.383 4.554 . 0 0 "[ . 1]" 1
277 2 58 ASP HB3 2 59 VAL H 3.400 . 4.900 4.474 4.357 4.532 . 0 0 "[ . 1]" 1
278 1 59 VAL H 1 60 LYS H 4.100 . 6.000 4.432 4.392 4.475 . 0 0 "[ . 1]" 1
279 2 59 VAL H 2 60 LYS H 4.100 . 6.000 4.446 4.400 4.497 . 0 0 "[ . 1]" 1
280 1 121 LEU H 1 121 LEU HB3 3.400 . 4.800 3.433 3.317 3.540 . 0 0 "[ . 1]" 1
281 2 121 LEU H 2 121 LEU HB3 3.400 . 4.800 3.436 3.293 3.522 . 0 0 "[ . 1]" 1
282 1 121 LEU H 1 121 LEU HB2 2.700 . 3.600 2.148 2.034 2.320 . 0 0 "[ . 1]" 1
283 2 121 LEU H 2 121 LEU HB2 2.700 . 3.600 2.148 2.033 2.290 . 0 0 "[ . 1]" 1
284 1 121 LEU H 1 121 LEU HA 2.700 . 3.600 2.813 2.792 2.833 . 0 0 "[ . 1]" 1
285 2 121 LEU H 2 121 LEU HA 2.700 . 3.600 2.817 2.795 2.840 . 0 0 "[ . 1]" 1
286 1 120 TRP HA 1 121 LEU H 3.300 . 4.600 3.582 3.552 3.599 . 0 0 "[ . 1]" 1
287 2 120 TRP HA 2 121 LEU H 3.300 . 4.600 3.580 3.560 3.607 . 0 0 "[ . 1]" 1
288 1 121 LEU H 1 121 LEU HG 4.000 . 6.000 3.015 2.559 3.367 . 0 0 "[ . 1]" 1
289 2 121 LEU H 2 121 LEU HG 4.000 . 6.000 3.007 2.572 3.494 . 0 0 "[ . 1]" 1
290 1 121 LEU H 1 121 LEU QD 3.500 . 5.100 3.377 3.079 3.545 . 0 0 "[ . 1]" 1
291 2 121 LEU H 2 121 LEU QD 3.500 . 5.100 3.386 3.214 3.549 . 0 0 "[ . 1]" 1
292 1 120 TRP HD1 1 121 LEU H 3.900 . 5.800 3.997 3.812 4.098 . 0 0 "[ . 1]" 1
293 2 120 TRP HD1 2 121 LEU H 3.900 . 5.800 4.028 3.912 4.216 . 0 0 "[ . 1]" 1
294 1 120 TRP QB 1 121 LEU H 3.200 . 4.400 2.299 2.253 2.387 . 0 0 "[ . 1]" 1
295 2 120 TRP QB 2 121 LEU H 3.200 . 4.400 2.316 2.262 2.376 . 0 0 "[ . 1]" 1
296 1 76 LYS H 1 76 LYS HB3 3.400 . 4.800 3.600 3.569 3.636 . 0 0 "[ . 1]" 1
297 2 76 LYS H 2 76 LYS HB3 3.400 . 4.800 3.562 3.181 3.640 . 0 0 "[ . 1]" 1
298 1 76 LYS H 1 76 LYS HG3 3.000 . 4.100 2.863 2.444 3.327 . 0 0 "[ . 1]" 1
299 2 76 LYS H 2 76 LYS HG3 3.000 . 4.100 2.878 2.209 3.322 . 0 0 "[ . 1]" 1
300 1 76 LYS H 1 77 SER H 2.300 . 3.000 2.525 2.407 2.710 . 0 0 "[ . 1]" 1
301 2 76 LYS H 2 77 SER H 2.300 . 3.000 2.483 2.289 2.602 . 0 0 "[ . 1]" 1
302 1 76 LYS H 1 76 LYS HA 2.600 . 3.500 2.853 2.796 2.888 . 0 0 "[ . 1]" 1
303 2 76 LYS H 2 76 LYS HA 2.600 . 3.500 2.866 2.834 2.916 . 0 0 "[ . 1]" 1
304 1 75 ALA HA 1 76 LYS H 3.500 . 5.000 3.461 3.407 3.498 . 0 0 "[ . 1]" 1
305 2 75 ALA HA 2 76 LYS H 3.500 . 5.000 3.458 3.399 3.514 . 0 0 "[ . 1]" 1
306 1 76 LYS H 1 77 SER HA 3.700 . 5.400 5.110 4.994 5.277 . 0 0 "[ . 1]" 1
307 2 76 LYS H 2 77 SER HA 3.600 . 5.300 5.058 4.852 5.183 . 0 0 "[ . 1]" 1
308 1 76 LYS H 1 77 SER QB 4.400 . 6.000 4.868 4.450 5.232 . 0 0 "[ . 1]" 1
309 2 76 LYS H 2 77 SER QB 4.400 . 6.000 4.767 4.236 5.142 . 0 0 "[ . 1]" 1
310 1 74 LEU HA 1 76 LYS H 3.600 . 5.200 4.149 3.911 4.295 . 0 0 "[ . 1]" 1
311 2 74 LEU HA 2 76 LYS H 3.600 . 5.200 4.191 4.034 4.361 . 0 0 "[ . 1]" 1
312 1 56 LYS H 1 56 LYS HB2 3.100 . 4.300 3.597 3.435 3.787 . 0 0 "[ . 1]" 1
313 2 56 LYS H 2 56 LYS HB2 3.100 . 4.300 3.505 2.867 3.724 . 0 0 "[ . 1]" 1
314 1 56 LYS H 1 56 LYS HG2 4.100 . 6.000 2.915 2.215 3.511 . 0 0 "[ . 1]" 1
315 2 56 LYS H 2 56 LYS HG2 4.100 . 6.000 2.881 2.157 3.552 . 0 0 "[ . 1]" 1
316 1 56 LYS H 1 128 LEU QD 5.400 . 6.000 4.528 4.143 5.065 . 0 0 "[ . 1]" 1
317 2 56 LYS H 2 128 LEU MD2 5.400 . 6.000 5.432 5.130 5.670 . 0 0 "[ . 1]" 1
318 1 55 GLY H 1 56 LYS H 3.800 . 5.600 4.352 4.082 4.430 . 0 0 "[ . 1]" 1
319 2 55 GLY H 2 56 LYS H 3.800 . 5.600 4.335 4.082 4.444 . 0 0 "[ . 1]" 1
320 1 56 LYS H 1 56 LYS HA 2.900 . 4.000 2.925 2.914 2.939 . 0 0 "[ . 1]" 1
321 2 56 LYS H 2 56 LYS HA 2.900 . 4.000 2.927 2.914 2.935 . 0 0 "[ . 1]" 1
322 1 55 GLY HA2 1 56 LYS H 2.300 . 3.000 2.450 2.213 2.546 . 0 0 "[ . 1]" 1
323 2 55 GLY HA2 2 56 LYS H 2.300 . 3.000 2.432 2.166 2.580 . 0 0 "[ . 1]" 1
324 1 55 GLY HA3 1 56 LYS H 2.600 . 3.400 2.640 2.554 2.967 . 0 0 "[ . 1]" 1
325 2 55 GLY HA3 2 56 LYS H 2.600 . 3.400 2.673 2.486 2.950 . 0 0 "[ . 1]" 1
326 1 36 GLU H 1 36 GLU QG 3.200 . 4.400 3.307 2.732 3.960 . 0 0 "[ . 1]" 1
327 2 36 GLU H 2 36 GLU QG 3.200 . 4.400 3.589 2.575 4.029 . 0 0 "[ . 1]" 1
328 1 36 GLU H 1 36 GLU QB 1.900 . 2.300 2.194 2.047 2.307 0.007 8 0 "[ . 1]" 1
329 2 36 GLU H 2 36 GLU QB 1.900 . 2.300 2.188 2.086 2.295 . 0 0 "[ . 1]" 1
330 1 35 GLN H 1 36 GLU H 2.600 . 3.400 2.561 2.508 2.617 . 0 0 "[ . 1]" 1
331 2 35 GLN H 2 36 GLU H 2.600 . 3.400 2.589 2.548 2.623 . 0 0 "[ . 1]" 1
332 1 36 GLU H 1 37 ASN H 2.400 . 3.100 2.388 2.229 2.593 . 0 0 "[ . 1]" 1
333 2 36 GLU H 2 37 ASN H 2.400 . 3.100 2.327 2.199 2.597 . 0 0 "[ . 1]" 1
334 1 36 GLU H 1 36 GLU HA 2.700 . 3.600 2.874 2.836 2.911 . 0 0 "[ . 1]" 1
335 2 36 GLU H 2 36 GLU HA 2.700 . 3.600 2.894 2.824 2.932 . 0 0 "[ . 1]" 1
336 1 36 GLU H 1 37 ASN HB3 4.800 . 6.000 6.002 5.643 6.093 0.093 6 0 "[ . 1]" 1
337 2 36 GLU H 2 37 ASN HB3 4.800 . 6.000 5.932 5.636 6.172 0.172 2 0 "[ . 1]" 1
338 1 122 GLU QB 1 123 GLU H 2.400 . 3.100 2.612 2.314 2.944 . 0 0 "[ . 1]" 1
339 2 122 GLU QB 2 123 GLU H 2.400 . 3.100 2.645 2.516 2.819 . 0 0 "[ . 1]" 1
340 1 123 GLU H 1 123 GLU HB3 2.900 . 4.000 3.356 2.963 3.639 . 0 0 "[ . 1]" 1
341 2 123 GLU H 2 123 GLU HB3 2.900 . 4.000 3.404 2.954 3.618 . 0 0 "[ . 1]" 1
342 1 123 GLU H 1 123 GLU HB2 2.400 . 3.100 2.275 2.113 2.587 . 0 0 "[ . 1]" 1
343 2 123 GLU H 2 123 GLU HB2 2.400 . 3.100 2.357 2.167 2.727 . 0 0 "[ . 1]" 1
344 1 123 GLU H 1 124 GLY H 2.400 . 3.100 2.614 2.512 2.891 . 0 0 "[ . 1]" 1
345 2 123 GLU H 2 124 GLY H 2.400 . 3.100 2.618 2.490 2.785 . 0 0 "[ . 1]" 1
346 1 123 GLU H 1 125 LEU MD1 4.400 . 6.000 4.316 3.803 4.725 . 0 0 "[ . 1]" 1
347 2 123 GLU H 2 125 LEU MD1 4.400 . 6.000 4.280 3.990 4.503 . 0 0 "[ . 1]" 1
348 1 123 GLU H 1 125 LEU H 3.700 . 5.400 3.755 3.622 3.968 . 0 0 "[ . 1]" 1
349 2 123 GLU H 2 125 LEU H 3.700 . 5.400 3.759 3.634 3.863 . 0 0 "[ . 1]" 1
350 1 123 GLU H 1 123 GLU HA 2.600 . 3.500 2.863 2.820 2.892 . 0 0 "[ . 1]" 1
351 2 123 GLU H 2 123 GLU HA 2.600 . 3.500 2.865 2.839 2.891 . 0 0 "[ . 1]" 1
352 1 122 GLU HA 1 123 GLU H 3.300 . 4.600 3.536 3.512 3.553 . 0 0 "[ . 1]" 1
353 2 122 GLU HA 2 123 GLU H 3.300 . 4.600 3.537 3.497 3.559 . 0 0 "[ . 1]" 1
354 1 123 GLU H 1 124 GLY HA3 4.300 . 6.000 5.223 5.156 5.372 . 0 0 "[ . 1]" 1
355 2 123 GLU H 2 124 GLY HA3 4.300 . 6.000 5.230 5.140 5.327 . 0 0 "[ . 1]" 1
356 1 122 GLU HG3 1 123 GLU H 5.000 . 6.000 4.544 2.386 5.151 . 0 0 "[ . 1]" 1
357 2 122 GLU HG3 2 123 GLU H 5.000 . 6.000 5.004 4.197 5.292 . 0 0 "[ . 1]" 1
358 1 123 GLU H 1 125 LEU MD2 5.200 . 6.000 5.498 5.158 5.815 . 0 0 "[ . 1]" 1
359 2 123 GLU H 2 125 LEU MD2 5.200 . 6.000 5.386 5.181 5.682 . 0 0 "[ . 1]" 1
360 1 56 LYS H 1 128 LEU HA 4.300 . 6.000 4.687 4.510 4.943 . 0 0 "[ . 1]" 1
361 2 56 LYS H 2 128 LEU HA 4.300 . 6.000 4.657 4.378 4.969 . 0 0 "[ . 1]" 1
362 1 48 PRO HG2 1 49 ASP H 2.400 . 3.100 2.814 2.547 3.102 0.002 10 0 "[ . 1]" 1
363 2 48 PRO HG2 2 49 ASP H 2.400 . 3.100 2.818 2.598 2.919 . 0 0 "[ . 1]" 1
364 1 49 ASP H 1 50 GLU H 2.600 . 3.400 2.551 2.390 2.723 . 0 0 "[ . 1]" 1
365 2 49 ASP H 2 50 GLU H 2.600 . 3.400 2.550 2.324 2.688 . 0 0 "[ . 1]" 1
366 1 48 PRO HD2 1 49 ASP H 3.200 . 4.500 3.157 2.865 3.506 . 0 0 "[ . 1]" 1
367 2 48 PRO HD2 2 49 ASP H 3.200 . 4.500 3.061 2.680 3.464 . 0 0 "[ . 1]" 1
368 1 47 ASP HB3 1 49 ASP H 3.400 . 4.800 3.101 2.598 3.309 . 0 0 "[ . 1]" 1
369 2 47 ASP HB3 2 49 ASP H 3.400 . 4.800 3.583 2.722 4.534 . 0 0 "[ . 1]" 1
370 1 49 ASP H 1 49 ASP HB3 2.300 . 3.000 3.083 2.914 3.310 0.310 10 0 "[ . 1]" 1
371 2 49 ASP H 2 49 ASP QB 2.300 . 3.000 2.173 2.086 2.292 . 0 0 "[ . 1]" 1
372 1 68 GLY HA3 1 69 LYS H 3.900 . 5.800 2.918 2.709 3.436 . 0 0 "[ . 1]" 1
373 2 68 GLY HA3 2 69 LYS H 3.900 . 5.800 2.789 2.702 3.409 . 0 0 "[ . 1]" 1
374 1 38 PRO HB3 1 39 ASP H 4.200 . 6.000 4.495 4.313 4.571 . 0 0 "[ . 1]" 1
375 2 38 PRO HB3 2 39 ASP H 4.200 . 6.000 4.486 4.340 4.587 . 0 0 "[ . 1]" 1
376 1 38 PRO HB2 1 39 ASP H 2.800 . 3.800 3.317 2.824 3.479 . 0 0 "[ . 1]" 1
377 2 38 PRO HB2 2 39 ASP H 2.800 . 3.800 3.287 2.851 3.545 . 0 0 "[ . 1]" 1
378 1 39 ASP H 1 40 ILE HB 3.800 . 5.600 4.430 4.248 4.627 . 0 0 "[ . 1]" 1
379 2 39 ASP H 2 40 ILE HB 3.800 . 5.600 4.416 4.292 4.582 . 0 0 "[ . 1]" 1
380 1 39 ASP H 1 40 ILE HG13 3.800 . 5.600 3.747 3.572 4.089 . 0 0 "[ . 1]" 1
381 2 39 ASP H 2 40 ILE HG13 3.800 . 5.600 3.689 3.342 4.073 . 0 0 "[ . 1]" 1
382 1 39 ASP H 1 40 ILE MD 4.400 . 6.000 4.938 4.593 5.375 . 0 0 "[ . 1]" 1
383 2 39 ASP H 2 40 ILE MD 4.400 . 6.000 4.954 4.784 5.133 . 0 0 "[ . 1]" 1
384 1 39 ASP H 1 40 ILE MG 4.600 . 6.000 5.498 5.393 5.624 . 0 0 "[ . 1]" 1
385 2 39 ASP H 2 40 ILE MG 4.600 . 6.000 5.483 5.438 5.590 . 0 0 "[ . 1]" 1
386 1 39 ASP H 1 40 ILE H 2.300 . 3.000 2.134 2.005 2.543 . 0 0 "[ . 1]" 1
387 2 39 ASP H 2 40 ILE H 2.300 . 3.000 2.135 2.045 2.563 . 0 0 "[ . 1]" 1
388 1 37 ASN HA 1 39 ASP H 3.400 . 4.800 3.409 3.301 3.633 . 0 0 "[ . 1]" 1
389 2 37 ASN HA 2 39 ASP H 3.400 . 4.800 3.461 3.265 3.576 . 0 0 "[ . 1]" 1
390 1 38 PRO HA 1 39 ASP H 3.000 . 4.100 3.298 3.215 3.369 . 0 0 "[ . 1]" 1
391 2 38 PRO HA 2 39 ASP H 3.000 . 4.100 3.314 3.237 3.377 . 0 0 "[ . 1]" 1
392 1 39 ASP H 1 39 ASP HA 2.600 . 3.500 2.919 2.908 2.934 . 0 0 "[ . 1]" 1
393 2 39 ASP H 2 39 ASP HA 2.600 . 3.500 2.922 2.912 2.931 . 0 0 "[ . 1]" 1
394 1 39 ASP H 1 40 ILE HA 5.200 . 6.000 4.831 4.697 5.040 . 0 0 "[ . 1]" 1
395 2 39 ASP H 2 40 ILE HA 5.200 . 6.000 4.820 4.750 5.040 . 0 0 "[ . 1]" 1
396 1 38 PRO HD3 1 39 ASP H 3.600 . 5.200 3.910 3.592 4.171 . 0 0 "[ . 1]" 1
397 2 38 PRO HD3 2 39 ASP H 3.600 . 5.200 3.937 3.668 4.092 . 0 0 "[ . 1]" 1
398 1 38 PRO HD2 1 39 ASP H 3.100 . 4.300 2.938 2.282 3.253 . 0 0 "[ . 1]" 1
399 2 38 PRO HD2 2 39 ASP H 3.100 . 4.300 2.963 2.403 3.267 . 0 0 "[ . 1]" 1
400 1 37 ASN HB3 1 39 ASP H 3.400 . 4.800 2.759 2.324 3.143 . 0 0 "[ . 1]" 1
401 2 37 ASN HB3 2 39 ASP H 3.400 . 4.800 2.851 2.472 3.334 . 0 0 "[ . 1]" 1
402 1 39 ASP H 1 39 ASP QB 2.300 . 3.000 2.283 2.139 2.385 . 0 0 "[ . 1]" 1
403 2 39 ASP H 2 39 ASP QB 2.300 . 3.000 2.287 2.163 2.392 . 0 0 "[ . 1]" 1
404 1 45 VAL H 1 88 PHE HB2 5.100 . 6.000 5.250 4.730 5.874 . 0 0 "[ . 1]" 1
405 2 45 VAL H 2 88 PHE HB2 5.100 . 6.000 5.305 4.378 6.002 0.002 7 0 "[ . 1]" 1
406 1 42 LEU MD2 1 45 VAL H 4.800 . 6.000 6.072 6.020 6.107 0.107 6 0 "[ . 1]" 1
407 2 42 LEU MD2 2 45 VAL H 4.800 . 6.000 6.070 5.996 6.123 0.123 3 0 "[ . 1]" 1
408 1 44 ASP HA 1 45 VAL H 2.500 . 3.300 2.156 2.094 2.220 . 0 0 "[ . 1]" 1
409 2 44 ASP HA 2 45 VAL H 2.500 . 3.300 2.126 2.070 2.190 . 0 0 "[ . 1]" 1
410 1 45 VAL H 1 88 PHE HB3 3.900 . 5.800 3.903 3.441 4.363 . 0 0 "[ . 1]" 1
411 2 45 VAL H 2 88 PHE HB3 3.900 . 5.800 3.946 3.068 4.423 . 0 0 "[ . 1]" 1
412 1 45 VAL H 1 45 VAL MG2 2.600 . 3.400 1.956 1.823 2.190 . 0 0 "[ . 1]" 1
413 2 45 VAL H 2 45 VAL MG2 2.600 . 3.400 2.068 1.857 2.464 . 0 0 "[ . 1]" 1
414 1 49 ASP H 1 51 LEU H 3.700 . 5.400 3.737 3.518 3.874 . 0 0 "[ . 1]" 1
415 2 49 ASP H 2 51 LEU H 3.700 . 5.400 3.717 3.563 3.859 . 0 0 "[ . 1]" 1
416 1 47 ASP HA 1 49 ASP H 4.300 . 6.000 4.206 3.811 4.585 . 0 0 "[ . 1]" 1
417 2 47 ASP HA 2 49 ASP H 4.300 . 6.000 4.093 3.918 4.324 . 0 0 "[ . 1]" 1
418 1 49 ASP H 1 49 ASP HA 3.000 . 4.100 2.866 2.817 2.891 . 0 0 "[ . 1]" 1
419 2 49 ASP H 2 49 ASP HA 3.000 . 4.100 2.865 2.833 2.904 . 0 0 "[ . 1]" 1
420 1 48 PRO HD3 1 49 ASP H 4.200 . 6.000 4.150 3.999 4.323 . 0 0 "[ . 1]" 1
421 2 48 PRO HD3 2 49 ASP H 4.200 . 6.000 4.099 3.921 4.276 . 0 0 "[ . 1]" 1
422 1 97 LEU H 1 97 LEU HB3 3.000 . 4.100 3.448 3.406 3.497 . 0 0 "[ . 1]" 1
423 2 97 LEU H 2 97 LEU HB3 3.000 . 4.100 3.409 3.371 3.457 . 0 0 "[ . 1]" 1
424 1 96 ALA MB 1 97 LEU H 2.600 . 3.500 2.764 2.639 2.873 . 0 0 "[ . 1]" 1
425 2 96 ALA MB 2 97 LEU H 2.600 . 3.500 2.789 2.711 2.908 . 0 0 "[ . 1]" 1
426 1 95 ALA MB 1 97 LEU H 4.600 . 6.000 4.499 4.278 4.600 . 0 0 "[ . 1]" 1
427 2 95 ALA MB 2 97 LEU H 4.600 . 6.000 4.473 4.331 4.545 . 0 0 "[ . 1]" 1
428 1 97 LEU H 1 97 LEU MD1 4.200 . 6.000 4.128 3.981 4.243 . 0 0 "[ . 1]" 1
429 2 97 LEU H 2 97 LEU MD1 4.200 . 6.000 4.134 3.971 4.286 . 0 0 "[ . 1]" 1
430 1 97 LEU H 1 97 LEU MD2 2.900 . 3.900 2.451 2.313 2.633 . 0 0 "[ . 1]" 1
431 2 97 LEU H 2 97 LEU MD2 2.900 . 3.900 2.514 2.284 2.617 . 0 0 "[ . 1]" 1
432 1 97 LEU H 1 98 ALA H 2.700 . 3.600 2.527 2.395 2.639 . 0 0 "[ . 1]" 1
433 2 97 LEU H 2 98 ALA H 2.700 . 3.600 2.497 2.350 2.617 . 0 0 "[ . 1]" 1
434 1 97 LEU H 1 97 LEU HA 2.600 . 3.500 2.851 2.829 2.875 . 0 0 "[ . 1]" 1
435 2 97 LEU H 2 97 LEU HA 2.600 . 3.500 2.858 2.835 2.887 . 0 0 "[ . 1]" 1
436 1 97 LEU H 1 97 LEU HB2 2.500 . 3.300 2.161 2.134 2.205 . 0 0 "[ . 1]" 1
437 2 97 LEU H 2 97 LEU HB2 2.500 . 3.300 2.135 2.112 2.167 . 0 0 "[ . 1]" 1
438 1 19 LYS HA 1 21 ASP H 3.500 . 5.100 3.920 3.797 4.109 . 0 0 "[ . 1]" 1
439 2 19 LYS HA 2 21 ASP H 3.500 . 5.100 3.871 3.708 4.059 . 0 0 "[ . 1]" 1
440 1 73 LEU H 1 73 LEU HB3 2.700 . 3.600 3.274 3.217 3.414 . 0 0 "[ . 1]" 1
441 2 73 LEU H 2 73 LEU HB3 2.700 . 3.600 3.184 3.090 3.343 . 0 0 "[ . 1]" 1
442 1 73 LEU H 1 73 LEU HB2 2.500 . 3.300 2.153 2.122 2.209 . 0 0 "[ . 1]" 1
443 2 73 LEU H 2 73 LEU HB2 2.500 . 3.300 2.165 2.105 2.319 . 0 0 "[ . 1]" 1
444 1 73 LEU H 1 73 LEU MD2 3.400 . 4.800 3.137 2.903 3.337 . 0 0 "[ . 1]" 1
445 2 73 LEU H 2 73 LEU MD2 3.400 . 4.800 3.251 2.793 3.514 . 0 0 "[ . 1]" 1
446 1 73 LEU H 1 73 LEU MD1 4.100 . 6.000 4.368 4.265 4.469 . 0 0 "[ . 1]" 1
447 2 73 LEU H 2 73 LEU MD1 4.100 . 6.000 4.373 4.237 4.481 . 0 0 "[ . 1]" 1
448 1 73 LEU H 1 74 LEU H 2.400 . 3.100 2.261 2.145 2.360 . 0 0 "[ . 1]" 1
449 2 73 LEU H 2 74 LEU H 2.400 . 3.100 2.283 1.994 2.492 0.006 2 0 "[ . 1]" 1
450 1 73 LEU H 1 73 LEU HA 2.500 . 3.300 2.908 2.895 2.925 . 0 0 "[ . 1]" 1
451 2 73 LEU H 2 73 LEU HA 2.500 . 3.300 2.903 2.884 2.941 . 0 0 "[ . 1]" 1
452 1 73 LEU H 1 74 LEU HA 3.700 . 5.400 4.830 4.690 4.977 . 0 0 "[ . 1]" 1
453 2 73 LEU H 2 74 LEU HA 3.700 . 5.400 4.813 4.657 4.888 . 0 0 "[ . 1]" 1
454 1 19 LYS H 1 21 ASP H 4.400 . 6.000 3.969 3.816 4.251 . 0 0 "[ . 1]" 1
455 2 19 LYS H 2 21 ASP H 4.400 . 6.000 4.007 3.842 4.229 . 0 0 "[ . 1]" 1
456 1 19 LYS QB 1 21 ASP H 4.000 . 6.000 4.867 4.612 5.042 . 0 0 "[ . 1]" 1
457 2 19 LYS QB 2 21 ASP H 4.000 . 6.000 4.868 4.591 5.071 . 0 0 "[ . 1]" 1
458 1 20 ALA MB 1 21 ASP H 2.700 . 3.600 3.014 2.915 3.089 . 0 0 "[ . 1]" 1
459 2 20 ALA MB 2 21 ASP H 2.700 . 3.600 3.046 2.921 3.113 . 0 0 "[ . 1]" 1
460 1 21 ASP H 1 22 MET H 2.400 . 3.100 2.707 2.581 2.832 . 0 0 "[ . 1]" 1
461 2 21 ASP H 2 22 MET H 2.400 . 3.100 2.619 2.490 2.782 . 0 0 "[ . 1]" 1
462 1 20 ALA H 1 21 ASP H 2.300 . 2.900 2.404 2.335 2.487 . 0 0 "[ . 1]" 1
463 2 20 ALA H 2 21 ASP H 2.300 . 2.900 2.464 2.405 2.600 . 0 0 "[ . 1]" 1
464 1 21 ASP H 1 21 ASP HA 2.700 . 3.600 2.834 2.772 2.888 . 0 0 "[ . 1]" 1
465 2 21 ASP H 2 21 ASP HA 2.700 . 3.600 2.852 2.799 2.907 . 0 0 "[ . 1]" 1
466 1 20 ALA HA 1 21 ASP H 2.900 . 4.000 3.425 3.406 3.465 . 0 0 "[ . 1]" 1
467 2 20 ALA HA 2 21 ASP H 2.900 . 4.000 3.413 3.378 3.451 . 0 0 "[ . 1]" 1
468 1 21 ASP H 1 21 ASP HB3 2.600 . 3.400 2.887 2.629 3.166 . 0 0 "[ . 1]" 1
469 2 21 ASP H 2 21 ASP HB3 2.600 . 3.400 2.802 2.523 3.126 . 0 0 "[ . 1]" 1
470 1 76 LYS HB3 1 77 SER H 4.200 . 6.000 4.003 3.739 4.327 . 0 0 "[ . 1]" 1
471 2 76 LYS HB3 2 77 SER H 4.200 . 6.000 4.152 3.944 4.458 . 0 0 "[ . 1]" 1
472 1 76 LYS HG3 1 77 SER H 4.300 . 6.000 4.729 4.484 5.097 . 0 0 "[ . 1]" 1
473 2 76 LYS HG3 2 77 SER H 4.200 . 6.000 4.506 3.032 5.015 . 0 0 "[ . 1]" 1
474 1 77 SER H 1 78 GLY H 3.200 . 4.500 2.570 2.412 3.153 . 0 0 "[ . 1]" 1
475 2 77 SER H 2 78 GLY H 3.200 . 4.500 2.579 2.444 3.128 . 0 0 "[ . 1]" 1
476 1 76 LYS HA 1 77 SER H 3.000 . 4.100 3.455 3.372 3.505 . 0 0 "[ . 1]" 1
477 2 76 LYS HA 2 77 SER H 3.000 . 4.100 3.433 3.299 3.508 . 0 0 "[ . 1]" 1
478 1 77 SER H 1 77 SER HA 2.700 . 3.600 2.882 2.854 2.925 . 0 0 "[ . 1]" 1
479 2 77 SER H 2 77 SER HA 2.700 . 3.600 2.874 2.846 2.934 . 0 0 "[ . 1]" 1
480 1 77 SER H 1 78 GLY HA3 4.600 . 6.000 5.119 4.999 5.416 . 0 0 "[ . 1]" 1
481 2 77 SER H 2 78 GLY HA3 4.600 . 6.000 5.134 5.004 5.392 . 0 0 "[ . 1]" 1
482 1 77 SER H 1 77 SER QB 2.900 . 4.000 2.750 2.430 2.986 . 0 0 "[ . 1]" 1
483 2 77 SER H 2 77 SER QB 2.900 . 4.000 2.689 2.289 2.924 . 0 0 "[ . 1]" 1
484 1 74 LEU HA 1 77 SER H 3.300 . 4.600 3.690 3.420 3.914 . 0 0 "[ . 1]" 1
485 2 74 LEU HA 2 77 SER H 3.300 . 4.600 3.781 3.624 4.000 . 0 0 "[ . 1]" 1
486 1 37 ASN H 1 38 PRO HD2 4.200 . 6.000 4.933 4.384 5.206 . 0 0 "[ . 1]" 1
487 2 37 ASN H 2 38 PRO HD2 4.200 . 6.000 4.959 4.738 5.143 . 0 0 "[ . 1]" 1
488 1 36 GLU QG 1 37 ASN H 4.800 . 6.000 3.617 2.535 4.578 . 0 0 "[ . 1]" 1
489 2 36 GLU QG 2 37 ASN H 4.800 . 6.000 4.226 2.773 4.660 . 0 0 "[ . 1]" 1
490 1 36 GLU QB 1 37 ASN H 3.300 . 3.800 3.053 2.540 3.571 . 0 0 "[ . 1]" 1
491 2 36 GLU QB 2 37 ASN H 3.300 . 3.800 2.970 2.581 3.312 . 0 0 "[ . 1]" 1
492 1 37 ASN H 1 37 ASN HD22 3.500 . 5.000 4.446 3.542 5.003 0.003 5 0 "[ . 1]" 1
493 2 37 ASN H 2 37 ASN HD22 3.500 . 5.000 4.335 3.604 5.018 0.018 6 0 "[ . 1]" 1
494 1 35 GLN H 1 37 ASN H 3.400 . 4.900 4.094 4.005 4.188 . 0 0 "[ . 1]" 1
495 2 35 GLN H 2 37 ASN H 3.400 . 4.900 4.145 3.988 4.278 . 0 0 "[ . 1]" 1
496 1 33 LEU MD1 1 37 ASN H 4.200 . 6.000 5.233 4.919 5.381 . 0 0 "[ . 1]" 1
497 2 33 LEU MD1 2 37 ASN H 4.200 . 6.000 5.332 5.085 5.483 . 0 0 "[ . 1]" 1
498 1 37 ASN H 1 37 ASN HA 2.700 . 3.600 2.947 2.938 2.950 . 0 0 "[ . 1]" 1
499 2 37 ASN H 2 37 ASN HA 2.700 . 3.600 2.940 2.903 2.949 . 0 0 "[ . 1]" 1
500 1 37 ASN H 1 38 PRO HA 3.900 . 5.800 4.836 4.555 5.192 . 0 0 "[ . 1]" 1
501 2 37 ASN H 2 38 PRO HA 3.900 . 5.800 4.850 4.574 5.442 . 0 0 "[ . 1]" 1
502 1 36 GLU HA 1 37 ASN H 3.000 . 4.100 3.475 3.438 3.520 . 0 0 "[ . 1]" 1
503 2 36 GLU HA 2 37 ASN H 3.000 . 4.100 3.462 3.341 3.536 . 0 0 "[ . 1]" 1
504 1 37 ASN H 1 37 ASN HB3 3.200 . 4.400 3.676 3.465 3.906 . 0 0 "[ . 1]" 1
505 2 37 ASN H 2 37 ASN HB3 3.200 . 4.400 3.699 3.383 3.887 . 0 0 "[ . 1]" 1
506 1 37 ASN H 1 37 ASN HB2 2.600 . 3.500 2.560 2.345 3.004 . 0 0 "[ . 1]" 1
507 2 37 ASN H 2 37 ASN HB2 2.600 . 3.500 2.599 2.152 2.983 . 0 0 "[ . 1]" 1
508 1 37 ASN HB3 1 37 ASN HD21 3.500 . 5.000 3.365 3.215 3.495 . 0 0 "[ . 1]" 1
509 2 37 ASN HB3 2 37 ASN HD21 3.500 . 5.000 3.387 3.234 3.513 . 0 0 "[ . 1]" 1
510 1 37 ASN HB2 1 37 ASN HD21 2.600 . 3.500 2.172 2.099 2.304 . 0 0 "[ . 1]" 1
511 2 37 ASN HB2 2 37 ASN HD21 2.600 . 3.500 2.176 2.103 2.340 . 0 0 "[ . 1]" 1
512 1 33 LEU HG 1 37 ASN HD21 4.400 . 6.000 5.642 5.057 6.034 0.034 5 0 "[ . 1]" 1
513 2 33 LEU HG 2 37 ASN HD21 4.400 . 6.000 5.501 5.017 6.036 0.036 5 0 "[ . 1]" 1
514 1 33 LEU MD1 1 37 ASN HD21 3.900 . 5.800 4.596 4.225 4.867 . 0 0 "[ . 1]" 1
515 2 33 LEU MD1 2 37 ASN HD21 3.900 . 5.800 4.544 4.131 4.995 . 0 0 "[ . 1]" 1
516 1 33 LEU HA 1 37 ASN HD21 2.800 . 3.800 2.926 2.255 3.508 . 0 0 "[ . 1]" 1
517 2 33 LEU HA 2 37 ASN HD21 2.800 . 3.800 2.732 2.207 3.285 . 0 0 "[ . 1]" 1
518 1 37 ASN HD22 1 40 ILE MD 4.100 . 6.000 3.446 3.007 3.877 . 0 0 "[ . 1]" 1
519 2 37 ASN HD22 2 40 ILE MD 4.100 . 6.000 3.265 2.944 3.457 . 0 0 "[ . 1]" 1
520 1 33 LEU HA 1 37 ASN HD22 4.100 . 6.000 4.020 2.522 4.995 . 0 0 "[ . 1]" 1
521 2 33 LEU HA 2 37 ASN HD22 4.100 . 6.000 3.668 2.482 4.621 . 0 0 "[ . 1]" 1
522 1 33 LEU MD1 1 37 ASN HD22 4.700 . 6.000 5.784 5.200 6.024 0.024 7 0 "[ . 1]" 1
523 2 33 LEU MD1 2 37 ASN HD22 4.700 . 6.000 5.655 5.239 6.022 0.022 8 0 "[ . 1]" 1
524 1 20 ALA H 1 22 MET H 3.500 . 5.000 4.339 4.183 4.523 . 0 0 "[ . 1]" 1
525 2 20 ALA H 2 22 MET H 3.500 . 5.000 4.302 4.108 4.582 . 0 0 "[ . 1]" 1
526 1 22 MET H 1 24 MET H 4.300 . 6.000 5.348 5.007 5.601 . 0 0 "[ . 1]" 1
527 2 22 MET H 2 24 MET H 4.300 . 6.000 5.354 5.020 5.615 . 0 0 "[ . 1]" 1
528 1 22 MET H 1 22 MET HB3 2.800 . 3.800 3.409 3.072 3.799 . 0 0 "[ . 1]" 1
529 2 22 MET H 2 22 MET HB3 2.800 . 3.800 3.416 3.096 3.829 0.029 1 0 "[ . 1]" 1
530 1 22 MET H 1 22 MET HB2 3.400 . 4.800 3.423 2.412 3.931 . 0 0 "[ . 1]" 1
531 2 22 MET H 2 22 MET HB2 3.400 . 4.800 3.274 2.400 3.916 . 0 0 "[ . 1]" 1
532 1 20 ALA MB 1 22 MET H 4.100 . 6.000 4.455 4.253 4.669 . 0 0 "[ . 1]" 1
533 2 20 ALA MB 2 22 MET H 4.100 . 6.000 4.439 4.165 4.626 . 0 0 "[ . 1]" 1
534 1 21 ASP HA 1 22 MET H 2.800 . 3.800 3.354 3.056 3.514 . 0 0 "[ . 1]" 1
535 2 21 ASP HA 2 22 MET H 2.800 . 3.800 3.359 3.026 3.485 . 0 0 "[ . 1]" 1
536 1 22 MET H 1 22 MET HA 2.700 . 3.600 2.934 2.903 2.947 . 0 0 "[ . 1]" 1
537 2 22 MET H 2 22 MET HA 2.700 . 3.600 2.940 2.924 2.949 . 0 0 "[ . 1]" 1
538 1 20 ALA HA 1 22 MET H 3.400 . 4.800 3.764 3.436 4.062 . 0 0 "[ . 1]" 1
539 2 20 ALA HA 2 22 MET H 3.400 . 4.800 3.716 3.373 3.959 . 0 0 "[ . 1]" 1
540 1 22 MET H 1 22 MET QG 2.900 . 4.000 2.518 1.856 4.025 0.025 9 0 "[ . 1]" 1
541 2 22 MET H 2 22 MET QG 2.900 . 4.000 2.574 1.783 4.084 0.084 9 0 "[ . 1]" 1
542 1 114 GLU H 1 115 GLY H 3.600 . 5.200 3.763 2.243 4.616 . 0 0 "[ . 1]" 1
543 2 114 GLU H 2 115 GLY H 3.600 . 5.200 3.846 2.423 4.630 . 0 0 "[ . 1]" 1
544 1 114 GLU HG2 1 115 GLY H 3.900 . 5.800 4.611 3.719 5.567 . 0 0 "[ . 1]" 1
545 2 114 GLU HG2 2 115 GLY H 3.900 . 5.800 4.455 3.716 5.096 . 0 0 "[ . 1]" 1
546 1 114 GLU HA 1 115 GLY H 2.600 . 3.400 2.586 2.151 3.198 . 0 0 "[ . 1]" 1
547 2 114 GLU HA 2 115 GLY H 2.600 . 3.400 2.595 2.137 3.181 . 0 0 "[ . 1]" 1
548 1 35 GLN H 1 35 GLN HG3 2.200 . 2.800 2.663 1.699 3.543 0.743 5 2 "[ - + 1]" 1
549 2 35 GLN H 2 35 GLN HG3 2.200 . 2.800 2.889 1.978 3.589 0.789 5 3 "[ * + -]" 1
550 1 34 LEU HB2 1 35 GLN H 2.600 . 3.400 2.586 2.302 2.853 . 0 0 "[ . 1]" 1
551 2 34 LEU HB2 2 35 GLN H 2.600 . 3.400 2.605 2.340 2.929 . 0 0 "[ . 1]" 1
552 1 32 LYS H 1 35 GLN H 3.800 . 5.600 4.886 4.775 5.102 . 0 0 "[ . 1]" 1
553 2 32 LYS H 2 35 GLN H 3.800 . 5.600 4.888 4.662 5.148 . 0 0 "[ . 1]" 1
554 1 35 GLN H 1 36 GLU HA 4.400 . 6.000 5.159 5.109 5.187 . 0 0 "[ . 1]" 1
555 2 35 GLN H 2 36 GLU HA 4.400 . 6.000 5.177 5.142 5.226 . 0 0 "[ . 1]" 1
556 1 52 LYS H 1 52 LYS QB 2.200 . 2.800 2.152 2.053 2.365 . 0 0 "[ . 1]" 1
557 2 52 LYS H 2 52 LYS QB 2.200 . 2.800 2.174 2.074 2.354 . 0 0 "[ . 1]" 1
558 1 52 LYS H 1 52 LYS QD 4.600 . 6.000 3.706 3.100 4.639 . 0 0 "[ . 1]" 1
559 2 52 LYS H 2 52 LYS QD 4.600 . 6.000 3.813 2.973 4.639 . 0 0 "[ . 1]" 1
560 1 51 LEU MD1 1 52 LYS H 4.400 . 6.000 4.582 4.540 4.627 . 0 0 "[ . 1]" 1
561 2 51 LEU MD1 2 52 LYS H 4.400 . 6.000 4.549 4.437 4.678 . 0 0 "[ . 1]" 1
562 1 52 LYS H 1 53 ALA H 2.500 . 3.300 2.532 2.438 2.646 . 0 0 "[ . 1]" 1
563 2 52 LYS H 2 53 ALA H 2.500 . 3.300 2.571 2.414 2.694 . 0 0 "[ . 1]" 1
564 1 49 ASP HA 1 52 LYS H 3.100 . 4.300 3.352 3.072 3.629 . 0 0 "[ . 1]" 1
565 2 49 ASP HA 2 52 LYS H 3.100 . 4.300 3.323 3.039 3.642 . 0 0 "[ . 1]" 1
566 1 52 LYS H 1 52 LYS HA 2.600 . 3.500 2.849 2.810 2.876 . 0 0 "[ . 1]" 1
567 2 52 LYS H 2 52 LYS HA 2.600 . 3.500 2.838 2.799 2.883 . 0 0 "[ . 1]" 1
568 1 51 LEU HA 1 52 LYS H 3.300 . 4.700 3.497 3.467 3.539 . 0 0 "[ . 1]" 1
569 2 51 LEU HA 2 52 LYS H 3.300 . 4.700 3.502 3.466 3.524 . 0 0 "[ . 1]" 1
570 1 52 LYS H 1 54 MET H 4.000 . 6.000 4.335 4.208 4.526 . 0 0 "[ . 1]" 1
571 2 52 LYS H 2 54 MET H 4.000 . 6.000 4.346 4.223 4.508 . 0 0 "[ . 1]" 1
572 1 51 LEU MD2 1 52 LYS H 4.400 . 6.000 4.614 4.328 4.756 . 0 0 "[ . 1]" 1
573 2 51 LEU MD2 2 52 LYS H 4.400 . 6.000 4.599 4.323 4.792 . 0 0 "[ . 1]" 1
574 1 50 GLU H 1 52 LYS H 3.800 . 5.600 3.960 3.765 4.182 . 0 0 "[ . 1]" 1
575 2 50 GLU H 2 52 LYS H 3.700 . 5.500 3.976 3.768 4.115 . 0 0 "[ . 1]" 1
576 1 19 LYS H 1 20 ALA H 2.500 . 3.300 2.289 2.192 2.466 . 0 0 "[ . 1]" 1
577 2 19 LYS H 2 20 ALA H 2.500 . 3.300 2.269 2.184 2.370 . 0 0 "[ . 1]" 1
578 1 19 LYS QB 1 20 ALA H 3.100 . 4.300 3.329 2.954 3.664 . 0 0 "[ . 1]" 1
579 2 19 LYS QB 2 20 ALA H 3.100 . 4.300 3.400 2.944 3.623 . 0 0 "[ . 1]" 1
580 1 20 ALA H 1 21 ASP HA 4.900 . 6.000 4.967 4.862 5.105 . 0 0 "[ . 1]" 1
581 2 20 ALA H 2 21 ASP HA 4.900 . 6.000 5.021 4.896 5.179 . 0 0 "[ . 1]" 1
582 1 20 ALA H 1 20 ALA HA 2.500 . 3.300 2.886 2.865 2.903 . 0 0 "[ . 1]" 1
583 2 20 ALA H 2 20 ALA HA 2.500 . 3.300 2.875 2.841 2.895 . 0 0 "[ . 1]" 1
584 1 19 LYS HA 1 20 ALA H 3.100 . 4.300 3.392 3.380 3.410 . 0 0 "[ . 1]" 1
585 2 19 LYS HA 2 20 ALA H 3.100 . 4.300 3.396 3.381 3.420 . 0 0 "[ . 1]" 1
586 1 19 LYS H 1 19 LYS QB 2.400 . 3.100 2.281 2.070 2.495 . 0 0 "[ . 1]" 1
587 2 19 LYS H 2 19 LYS QB 2.400 . 3.100 2.460 2.082 2.822 . 0 0 "[ . 1]" 1
588 1 18 ALA MB 1 19 LYS H 2.500 . 3.300 2.821 2.717 2.953 . 0 0 "[ . 1]" 1
589 2 18 ALA MB 2 19 LYS H 2.500 . 3.300 2.725 2.407 2.899 . 0 0 "[ . 1]" 1
590 1 15 VAL MG1 1 19 LYS H 3.700 . 5.400 4.571 3.980 5.185 . 0 0 "[ . 1]" 1
591 2 15 VAL MG1 2 19 LYS H 3.700 . 5.400 4.708 4.354 5.070 . 0 0 "[ . 1]" 1
592 1 18 ALA HA 1 19 LYS H 3.200 . 4.500 3.520 3.496 3.548 . 0 0 "[ . 1]" 1
593 2 18 ALA HA 2 19 LYS H 3.200 . 4.500 3.540 3.514 3.586 . 0 0 "[ . 1]" 1
594 1 19 LYS H 1 19 LYS HA 2.700 . 3.600 2.883 2.856 2.897 . 0 0 "[ . 1]" 1
595 2 19 LYS H 2 19 LYS HA 2.700 . 3.600 2.887 2.866 2.899 . 0 0 "[ . 1]" 1
596 1 15 VAL HA 1 19 LYS H 4.700 . 6.000 5.360 4.868 5.806 . 0 0 "[ . 1]" 1
597 2 15 VAL HA 2 19 LYS H 4.600 . 6.000 5.200 5.003 5.478 . 0 0 "[ . 1]" 1
598 1 65 MET HG3 1 66 SER H 4.400 . 6.000 3.659 2.907 4.011 . 0 0 "[ . 1]" 1
599 2 65 MET HG3 2 66 SER H 4.400 . 6.000 3.912 3.036 4.862 . 0 0 "[ . 1]" 1
600 1 65 MET HB2 1 66 SER H 3.900 . 5.800 4.355 3.833 4.674 . 0 0 "[ . 1]" 1
601 2 65 MET HB2 2 66 SER H 3.900 . 5.800 4.388 3.864 4.702 . 0 0 "[ . 1]" 1
602 1 65 MET H 1 66 SER H 3.700 . 5.400 4.210 3.955 4.506 . 0 0 "[ . 1]" 1
603 2 65 MET H 2 66 SER H 3.700 . 5.400 4.166 3.866 4.497 . 0 0 "[ . 1]" 1
604 1 66 SER H 1 66 SER QB 2.800 . 3.800 2.836 2.298 2.975 . 0 0 "[ . 1]" 1
605 2 66 SER H 2 66 SER QB 2.800 . 3.800 2.888 2.674 3.086 . 0 0 "[ . 1]" 1
606 1 64 HIS HD2 1 66 SER H 4.700 . 6.000 5.898 5.319 6.101 0.101 5 0 "[ . 1]" 1
607 2 64 HIS HD2 2 66 SER H 4.700 . 6.000 5.824 5.162 6.126 0.126 5 0 "[ . 1]" 1
608 1 82 GLU H 1 83 LYS HA 4.700 . 6.000 4.622 4.459 4.745 . 0 0 "[ . 1]" 1
609 2 82 GLU H 2 83 LYS HA 4.700 . 6.000 4.693 4.585 4.792 . 0 0 "[ . 1]" 1
610 1 82 GLU H 1 82 GLU HG3 2.700 . 3.600 2.747 1.756 4.344 0.744 4 1 "[ +. 1]" 1
611 2 82 GLU H 2 82 GLU HG3 2.700 . 3.600 2.588 1.695 4.280 0.680 4 1 "[ +. 1]" 1
612 1 82 GLU H 1 82 GLU QB 3.000 . 4.100 2.519 2.209 2.742 . 0 0 "[ . 1]" 1
613 2 82 GLU H 2 82 GLU QB 3.000 . 4.100 2.489 2.165 2.787 . 0 0 "[ . 1]" 1
614 1 82 GLU H 1 82 GLU QB 2.400 . 3.100 2.706 2.234 3.000 . 0 0 "[ . 1]" 1
615 2 82 GLU H 2 82 GLU QB 2.400 . 3.100 2.726 2.183 3.012 . 0 0 "[ . 1]" 1
616 1 82 GLU H 1 83 LYS HG3 4.700 . 6.000 4.275 3.593 5.150 . 0 0 "[ . 1]" 1
617 2 82 GLU H 2 83 LYS HG3 4.700 . 6.000 4.240 3.056 5.321 . 0 0 "[ . 1]" 1
618 1 82 GLU H 1 83 LYS HG2 4.100 . 6.000 3.935 3.191 6.005 0.005 3 0 "[ . 1]" 1
619 2 82 GLU H 2 83 LYS HG2 4.000 . 6.000 4.800 3.166 6.068 0.068 5 0 "[ . 1]" 1
620 1 81 PRO HB2 1 82 GLU H 4.300 . 6.000 3.919 3.538 4.168 . 0 0 "[ . 1]" 1
621 2 81 PRO HB2 2 82 GLU H 4.300 . 6.000 3.809 3.393 4.084 . 0 0 "[ . 1]" 1
622 1 80 ASP HA 1 82 GLU H 3.900 . 5.800 4.020 3.946 4.119 . 0 0 "[ . 1]" 1
623 2 80 ASP HA 2 82 GLU H 3.900 . 5.800 3.955 3.805 4.071 . 0 0 "[ . 1]" 1
624 1 81 PRO HD2 1 82 GLU H 3.200 . 4.500 3.339 3.132 3.513 . 0 0 "[ . 1]" 1
625 2 81 PRO HD2 2 82 GLU H 3.200 . 4.500 3.437 3.143 3.712 . 0 0 "[ . 1]" 1
626 1 81 PRO HA 1 82 GLU H 3.400 . 4.800 3.282 3.158 3.361 . 0 0 "[ . 1]" 1
627 2 81 PRO HA 2 82 GLU H 3.400 . 4.800 3.295 3.096 3.450 . 0 0 "[ . 1]" 1
628 1 80 ASP HB3 1 82 GLU H 3.400 . 4.800 3.172 2.391 4.307 . 0 0 "[ . 1]" 1
629 2 80 ASP HB3 2 82 GLU H 3.400 . 4.800 3.119 2.506 4.361 . 0 0 "[ . 1]" 1
630 1 25 LEU HB3 1 31 TYR H 4.100 . 6.000 5.931 5.670 6.033 0.033 1 0 "[ . 1]" 1
631 2 25 LEU HB3 2 31 TYR H 4.100 . 6.000 5.884 5.648 6.086 0.086 6 0 "[ . 1]" 1
632 1 34 LEU H 1 40 ILE MG 4.100 . 6.000 4.098 3.439 4.549 . 0 0 "[ . 1]" 1
633 2 34 LEU H 2 40 ILE MG 4.100 . 6.000 4.005 3.701 4.404 . 0 0 "[ . 1]" 1
634 1 34 LEU H 1 34 LEU HB2 2.300 . 3.000 2.209 2.052 2.440 . 0 0 "[ . 1]" 1
635 2 34 LEU H 2 34 LEU HB2 2.300 . 3.000 2.193 2.059 2.562 . 0 0 "[ . 1]" 1
636 1 33 LEU HB2 1 34 LEU H 3.300 . 4.600 3.667 3.573 3.713 . 0 0 "[ . 1]" 1
637 2 33 LEU HB2 2 34 LEU H 3.300 . 4.600 3.638 3.558 3.747 . 0 0 "[ . 1]" 1
638 1 33 LEU HG 1 34 LEU H 3.700 . 5.400 2.856 2.742 2.958 . 0 0 "[ . 1]" 1
639 2 33 LEU HG 2 34 LEU H 3.700 . 5.400 2.872 2.807 2.937 . 0 0 "[ . 1]" 1
640 1 34 LEU H 1 34 LEU MD1 3.700 . 5.400 3.595 3.512 3.680 . 0 0 "[ . 1]" 1
641 2 34 LEU H 2 34 LEU MD1 3.700 . 5.400 3.592 3.392 3.733 . 0 0 "[ . 1]" 1
642 1 33 LEU MD2 1 34 LEU H 4.800 . 6.000 4.374 4.293 4.432 . 0 0 "[ . 1]" 1
643 2 33 LEU MD2 2 34 LEU H 4.800 . 6.000 4.387 4.334 4.425 . 0 0 "[ . 1]" 1
644 1 33 LEU H 1 34 LEU H 2.500 . 3.300 2.453 2.395 2.517 . 0 0 "[ . 1]" 1
645 2 33 LEU H 2 34 LEU H 2.500 . 3.300 2.468 2.424 2.560 . 0 0 "[ . 1]" 1
646 1 30 ALA HA 1 34 LEU H 3.600 . 5.200 4.446 4.325 4.632 . 0 0 "[ . 1]" 1
647 2 30 ALA HA 2 34 LEU H 3.600 . 5.200 4.439 4.318 4.693 . 0 0 "[ . 1]" 1
648 1 7 PHE HA 1 10 THR H 3.200 . 4.500 3.203 3.026 3.504 . 0 0 "[ . 1]" 1
649 2 7 PHE HA 2 10 THR H 3.200 . 4.500 3.180 2.961 3.497 . 0 0 "[ . 1]" 1
650 1 10 THR H 1 10 THR HB 2.700 . 3.600 3.075 2.829 3.260 . 0 0 "[ . 1]" 1
651 2 10 THR H 2 10 THR HB 2.700 . 3.600 3.028 2.898 3.293 . 0 0 "[ . 1]" 1
652 1 9 ALA HA 1 10 THR H 3.200 . 4.500 3.544 3.502 3.585 . 0 0 "[ . 1]" 1
653 2 9 ALA HA 2 10 THR H 3.200 . 4.500 3.547 3.536 3.561 . 0 0 "[ . 1]" 1
654 1 9 ALA MB 1 10 THR H 2.600 . 3.500 2.640 2.493 2.845 . 0 0 "[ . 1]" 1
655 2 9 ALA MB 2 10 THR H 2.600 . 3.500 2.584 2.431 2.758 . 0 0 "[ . 1]" 1
656 1 10 THR H 1 10 THR MG 3.900 . 5.800 3.533 3.365 3.698 . 0 0 "[ . 1]" 1
657 2 10 THR H 2 10 THR MG 3.900 . 5.800 3.568 3.326 3.695 . 0 0 "[ . 1]" 1
658 1 10 THR H 1 10 THR HA 2.700 . 3.600 2.821 2.800 2.849 . 0 0 "[ . 1]" 1
659 2 10 THR H 2 10 THR HA 2.700 . 3.600 2.825 2.806 2.846 . 0 0 "[ . 1]" 1
660 1 31 TYR H 1 125 LEU MD2 4.500 . 6.000 4.662 4.287 5.048 . 0 0 "[ . 1]" 1
661 2 31 TYR H 2 125 LEU MD2 4.500 . 6.000 4.684 4.431 5.019 . 0 0 "[ . 1]" 1
662 1 31 TYR H 1 125 LEU MD1 3.700 . 5.400 4.012 3.727 4.259 . 0 0 "[ . 1]" 1
663 2 31 TYR H 2 125 LEU MD1 3.700 . 5.400 4.017 3.870 4.272 . 0 0 "[ . 1]" 1
664 1 31 TYR H 1 32 LYS H 2.700 . 3.600 2.597 2.432 2.757 . 0 0 "[ . 1]" 1
665 2 31 TYR H 2 32 LYS H 2.700 . 3.600 2.576 2.543 2.627 . 0 0 "[ . 1]" 1
666 1 31 TYR H 1 31 TYR QD 3.700 . 5.400 4.179 4.115 4.204 . 0 0 "[ . 1]" 1
667 2 31 TYR H 2 31 TYR QD 3.700 . 5.400 4.187 4.153 4.223 . 0 0 "[ . 1]" 1
668 1 30 ALA H 1 31 TYR H 2.800 . 3.800 2.580 2.482 2.703 . 0 0 "[ . 1]" 1
669 2 30 ALA H 2 31 TYR H 2.800 . 3.800 2.605 2.485 2.733 . 0 0 "[ . 1]" 1
670 1 31 TYR H 1 31 TYR HA 2.600 . 3.500 2.829 2.800 2.870 . 0 0 "[ . 1]" 1
671 2 31 TYR H 2 31 TYR HA 2.600 . 3.500 2.831 2.816 2.844 . 0 0 "[ . 1]" 1
672 1 30 ALA HA 1 31 TYR H 3.500 . 5.100 3.549 3.504 3.569 . 0 0 "[ . 1]" 1
673 2 30 ALA HA 2 31 TYR H 3.500 . 5.100 3.556 3.529 3.585 . 0 0 "[ . 1]" 1
674 1 31 TYR H 1 31 TYR HB3 2.600 . 3.400 2.412 2.304 2.504 . 0 0 "[ . 1]" 1
675 2 31 TYR H 2 31 TYR HB3 2.600 . 3.400 2.432 2.354 2.587 . 0 0 "[ . 1]" 1
676 1 31 TYR H 1 31 TYR HB2 2.600 . 3.400 2.670 2.581 2.780 . 0 0 "[ . 1]" 1
677 2 31 TYR H 2 31 TYR HB2 2.600 . 3.400 2.660 2.485 2.780 . 0 0 "[ . 1]" 1
678 1 10 THR H 2 105 TYR QE 4.300 . 6.000 5.166 4.911 5.416 . 0 0 "[ . 1]" 1
679 1 105 TYR QE 2 10 THR H 4.300 . 6.000 5.235 5.052 5.530 . 0 0 "[ . 1]" 1
680 1 10 THR H 1 12 LYS H 3.800 . 5.600 4.176 3.900 4.376 . 0 0 "[ . 1]" 1
681 2 10 THR H 2 12 LYS H 3.800 . 5.600 4.218 4.013 4.529 . 0 0 "[ . 1]" 1
682 1 12 LYS H 1 12 LYS HB3 2.400 . 3.100 2.857 2.680 3.170 0.070 4 0 "[ . 1]" 1
683 2 12 LYS H 2 12 LYS HB3 2.400 . 3.100 2.806 2.454 3.272 0.172 2 0 "[ . 1]" 1
684 1 12 LYS H 1 12 LYS HB2 2.300 . 2.900 2.207 2.027 2.365 . 0 0 "[ . 1]" 1
685 2 12 LYS H 2 12 LYS HB2 2.300 . 2.900 2.266 1.988 2.577 . 0 0 "[ . 1]" 1
686 1 11 PHE QD 1 12 LYS H 3.700 . 5.400 4.097 3.981 4.344 . 0 0 "[ . 1]" 1
687 2 11 PHE QD 2 12 LYS H 3.700 . 5.400 4.102 3.947 4.335 . 0 0 "[ . 1]" 1
688 1 11 PHE HB3 1 12 LYS H 3.000 . 4.100 2.566 2.457 2.797 . 0 0 "[ . 1]" 1
689 2 11 PHE HB3 2 12 LYS H 3.000 . 4.100 2.539 2.351 2.780 . 0 0 "[ . 1]" 1
690 1 12 LYS H 1 12 LYS HA 2.600 . 3.400 2.829 2.816 2.840 . 0 0 "[ . 1]" 1
691 2 12 LYS H 2 12 LYS HA 2.600 . 3.400 2.826 2.807 2.849 . 0 0 "[ . 1]" 1
692 1 12 LYS H 1 12 LYS QD 3.200 . 4.500 3.863 3.277 4.265 . 0 0 "[ . 1]" 1
693 2 12 LYS H 2 12 LYS QD 3.200 . 4.500 3.663 2.657 4.191 . 0 0 "[ . 1]" 1
694 1 11 PHE HB2 1 12 LYS H 6.000 . 6.000 3.439 3.406 3.477 . 0 0 "[ . 1]" 1
695 2 11 PHE HB2 2 12 LYS H 6.000 . 6.000 3.408 3.255 3.568 . 0 0 "[ . 1]" 1
696 1 12 LYS H 1 12 LYS QE 5.200 . 6.000 4.986 3.387 5.824 . 0 0 "[ . 1]" 1
697 2 12 LYS H 2 12 LYS QE 5.200 . 6.000 5.010 3.672 5.869 . 0 0 "[ . 1]" 1
698 1 32 LYS H 1 32 LYS QB 2.000 . 2.500 2.212 2.086 2.470 . 0 0 "[ . 1]" 1
699 2 32 LYS H 2 32 LYS QB 2.000 . 2.500 2.207 2.134 2.252 . 0 0 "[ . 1]" 1
700 1 32 LYS H 1 32 LYS QD 3.800 . 5.600 4.046 3.564 4.570 . 0 0 "[ . 1]" 1
701 2 32 LYS H 2 32 LYS QD 3.800 . 5.600 4.214 3.930 4.476 . 0 0 "[ . 1]" 1
702 1 32 LYS H 1 32 LYS HG3 4.000 . 6.000 4.194 3.220 4.646 . 0 0 "[ . 1]" 1
703 2 32 LYS H 2 32 LYS HG3 4.000 . 6.000 4.394 4.160 4.642 . 0 0 "[ . 1]" 1
704 1 32 LYS H 1 32 LYS HG2 4.400 . 6.000 4.087 2.394 4.653 . 0 0 "[ . 1]" 1
705 2 32 LYS H 2 32 LYS HG2 4.400 . 6.000 4.517 4.333 4.652 . 0 0 "[ . 1]" 1
706 1 32 LYS H 1 125 LEU MD1 4.600 . 6.000 5.367 4.997 5.682 . 0 0 "[ . 1]" 1
707 2 32 LYS H 2 125 LEU MD1 4.600 . 6.000 5.377 5.133 5.793 . 0 0 "[ . 1]" 1
708 1 32 LYS H 1 34 LEU H 3.500 . 5.000 3.820 3.727 3.889 . 0 0 "[ . 1]" 1
709 2 32 LYS H 2 34 LEU H 3.500 . 5.000 3.823 3.766 3.893 . 0 0 "[ . 1]" 1
710 1 31 TYR QD 1 32 LYS H 3.600 . 5.200 3.770 3.355 4.025 . 0 0 "[ . 1]" 1
711 2 31 TYR QD 2 32 LYS H 3.600 . 5.200 3.860 3.685 4.004 . 0 0 "[ . 1]" 1
712 1 31 TYR HA 1 32 LYS H 3.400 . 4.800 3.503 3.470 3.555 . 0 0 "[ . 1]" 1
713 2 31 TYR HA 2 32 LYS H 3.400 . 4.800 3.490 3.475 3.502 . 0 0 "[ . 1]" 1
714 1 32 LYS H 1 32 LYS HA 2.700 . 3.600 2.785 2.766 2.795 . 0 0 "[ . 1]" 1
715 2 32 LYS H 2 32 LYS HA 2.700 . 3.600 2.782 2.741 2.804 . 0 0 "[ . 1]" 1
716 1 31 TYR HB3 1 32 LYS H 2.600 . 3.500 2.849 2.654 2.964 . 0 0 "[ . 1]" 1
717 2 31 TYR HB3 2 32 LYS H 2.600 . 3.500 2.870 2.529 2.965 . 0 0 "[ . 1]" 1
718 1 31 TYR HB2 1 32 LYS H 3.500 . 5.100 4.069 3.978 4.136 . 0 0 "[ . 1]" 1
719 2 31 TYR HB2 2 32 LYS H 3.500 . 5.100 4.067 3.751 4.170 . 0 0 "[ . 1]" 1
720 1 130 ARG H 1 130 ARG HB3 3.700 . 5.400 3.112 2.137 4.060 . 0 0 "[ . 1]" 1
721 2 130 ARG H 2 130 ARG HB3 3.700 . 5.400 3.161 2.655 3.997 . 0 0 "[ . 1]" 1
722 1 130 ARG H 1 130 ARG HB2 3.200 . 4.500 2.471 2.090 3.211 . 0 0 "[ . 1]" 1
723 2 130 ARG H 2 130 ARG HB2 3.200 . 4.500 2.479 2.125 3.537 . 0 0 "[ . 1]" 1
724 1 130 ARG H 1 130 ARG QG 4.000 . 6.000 3.575 2.450 4.046 . 0 0 "[ . 1]" 1
725 2 130 ARG H 2 130 ARG QG 4.000 . 6.000 3.550 2.467 4.146 . 0 0 "[ . 1]" 1
726 1 129 ASP HA 1 130 ARG H 2.800 . 3.800 2.256 2.140 2.378 . 0 0 "[ . 1]" 1
727 2 129 ASP HA 2 130 ARG H 2.800 . 3.800 2.243 2.139 2.379 . 0 0 "[ . 1]" 1
728 1 129 ASP H 1 130 ARG H 4.100 . 6.000 4.375 4.237 4.473 . 0 0 "[ . 1]" 1
729 2 129 ASP H 2 130 ARG H 4.100 . 6.000 4.330 3.743 4.533 . 0 0 "[ . 1]" 1
730 1 129 ASP HB2 1 130 ARG H 5.100 . 6.000 3.561 2.892 4.082 . 0 0 "[ . 1]" 1
731 2 129 ASP HB3 2 130 ARG H 5.100 . 6.000 4.314 4.022 4.556 . 0 0 "[ . 1]" 1
732 1 129 ASP HB3 1 130 ARG H 3.700 . 5.400 4.209 3.858 4.430 . 0 0 "[ . 1]" 1
733 2 129 ASP HB2 2 130 ARG H 3.700 . 5.400 3.657 2.833 4.398 . 0 0 "[ . 1]" 1
734 1 11 PHE H 1 12 LYS H 2.700 . 3.600 2.722 2.642 2.780 . 0 0 "[ . 1]" 1
735 2 11 PHE H 2 12 LYS H 2.700 . 3.600 2.766 2.687 2.901 . 0 0 "[ . 1]" 1
736 1 11 PHE HA 1 12 LYS H 3.700 . 5.400 3.518 3.494 3.538 . 0 0 "[ . 1]" 1
737 2 11 PHE HA 2 12 LYS H 3.700 . 5.400 3.519 3.498 3.551 . 0 0 "[ . 1]" 1
738 1 52 LYS QB 1 53 ALA H 2.500 . 3.300 2.754 2.421 3.190 . 0 0 "[ . 1]" 1
739 2 52 LYS QB 2 53 ALA H 2.500 . 3.300 2.664 2.578 2.824 . 0 0 "[ . 1]" 1
740 1 53 ALA H 1 54 MET H 2.600 . 3.400 2.638 2.504 2.726 . 0 0 "[ . 1]" 1
741 2 53 ALA H 2 54 MET H 2.600 . 3.400 2.601 2.456 2.687 . 0 0 "[ . 1]" 1
742 1 53 ALA H 1 53 ALA MB 2.200 . 2.800 2.174 2.043 2.258 . 0 0 "[ . 1]" 1
743 2 53 ALA H 2 53 ALA MB 2.200 . 2.800 2.122 2.041 2.296 . 0 0 "[ . 1]" 1
744 1 53 ALA H 1 53 ALA HA 2.700 . 3.600 2.859 2.841 2.882 . 0 0 "[ . 1]" 1
745 2 53 ALA H 2 53 ALA HA 2.700 . 3.600 2.863 2.846 2.903 . 0 0 "[ . 1]" 1
746 1 52 LYS HA 1 53 ALA H 3.100 . 4.300 3.522 3.488 3.548 . 0 0 "[ . 1]" 1
747 2 52 LYS HA 2 53 ALA H 3.100 . 4.300 3.523 3.500 3.532 . 0 0 "[ . 1]" 1
748 1 51 LEU HA 1 53 ALA H 3.800 . 5.600 4.416 4.172 4.727 . 0 0 "[ . 1]" 1
749 2 51 LEU HA 2 53 ALA H 3.800 . 5.600 4.414 4.160 4.590 . 0 0 "[ . 1]" 1
750 1 53 ALA H 1 54 MET HG2 5.000 . 6.000 5.486 4.576 6.032 0.032 4 0 "[ . 1]" 1
751 2 53 ALA H 2 54 MET HG2 5.000 . 6.000 5.583 3.953 6.022 0.022 10 0 "[ . 1]" 1
752 1 52 LYS QD 1 53 ALA H 4.400 . 6.000 4.722 4.123 5.155 . 0 0 "[ . 1]" 1
753 2 52 LYS QD 2 53 ALA H 4.400 . 6.000 4.859 4.311 5.381 . 0 0 "[ . 1]" 1
754 1 53 ALA H 1 54 MET HG3 4.700 . 6.000 5.280 4.391 5.834 . 0 0 "[ . 1]" 1
755 2 53 ALA H 2 54 MET HG3 4.700 . 6.000 5.296 4.823 5.751 . 0 0 "[ . 1]" 1
756 1 128 LEU HB3 1 129 ASP H 3.100 . 4.300 3.829 3.606 3.998 . 0 0 "[ . 1]" 1
757 2 128 LEU HB3 2 129 ASP H 3.100 . 4.300 3.860 3.727 4.033 . 0 0 "[ . 1]" 1
758 1 128 LEU HB2 1 129 ASP H 3.700 . 5.400 4.507 4.257 4.608 . 0 0 "[ . 1]" 1
759 2 128 LEU HB2 2 129 ASP H 3.700 . 5.400 4.502 4.398 4.616 . 0 0 "[ . 1]" 1
760 1 128 LEU QD 1 129 ASP H 3.700 . 5.400 3.513 2.902 4.161 . 0 0 "[ . 1]" 1
761 2 128 LEU MD2 2 129 ASP H 3.700 . 5.400 3.827 3.307 4.242 . 0 0 "[ . 1]" 1
762 1 128 LEU HA 1 129 ASP H 2.500 . 3.300 2.147 2.120 2.170 . 0 0 "[ . 1]" 1
763 2 128 LEU HA 2 129 ASP H 2.500 . 3.300 2.158 2.144 2.175 . 0 0 "[ . 1]" 1
764 1 129 ASP H 1 129 ASP HA 2.600 . 3.400 2.935 2.916 2.945 . 0 0 "[ . 1]" 1
765 2 129 ASP H 2 129 ASP HA 2.600 . 3.400 2.939 2.934 2.946 . 0 0 "[ . 1]" 1
766 1 129 ASP H 1 129 ASP HB2 3.300 . 4.700 3.590 3.090 3.931 . 0 0 "[ . 1]" 1
767 2 129 ASP H 2 129 ASP HB3 3.300 . 4.700 2.595 2.316 3.061 . 0 0 "[ . 1]" 1
768 1 129 ASP H 1 129 ASP HB3 4.000 . 6.000 2.696 2.380 3.144 . 0 0 "[ . 1]" 1
769 2 129 ASP H 2 129 ASP HB2 4.000 . 6.000 3.565 3.132 3.872 . 0 0 "[ . 1]" 1
770 1 23 VAL H 1 23 VAL HB 2.300 . 3.000 2.586 2.517 2.677 . 0 0 "[ . 1]" 1
771 2 23 VAL H 2 23 VAL HB 2.300 . 3.000 2.615 2.550 2.747 . 0 0 "[ . 1]" 1
772 1 23 VAL H 1 23 VAL MG1 4.000 . 6.000 3.794 3.772 3.818 . 0 0 "[ . 1]" 1
773 2 23 VAL H 2 23 VAL MG1 4.000 . 6.000 3.787 3.759 3.817 . 0 0 "[ . 1]" 1
774 1 23 VAL H 1 111 TYR QD 4.100 . 6.000 5.134 4.792 5.542 . 0 0 "[ . 1]" 1
775 2 23 VAL H 2 111 TYR QD 4.100 . 6.000 5.035 4.580 5.324 . 0 0 "[ . 1]" 1
776 1 23 VAL H 1 24 MET H 3.600 . 5.200 4.323 4.233 4.401 . 0 0 "[ . 1]" 1
777 2 23 VAL H 2 24 MET H 3.600 . 5.200 4.326 4.189 4.397 . 0 0 "[ . 1]" 1
778 1 23 VAL H 1 23 VAL HA 3.000 . 4.100 2.890 2.853 2.918 . 0 0 "[ . 1]" 1
779 2 23 VAL H 2 23 VAL HA 3.000 . 4.100 2.879 2.819 2.925 . 0 0 "[ . 1]" 1
780 1 128 LEU HG 1 129 ASP H 4.700 . 6.000 4.539 3.873 4.884 . 0 0 "[ . 1]" 1
781 2 128 LEU HG 2 129 ASP H 4.700 . 6.000 4.662 4.201 4.927 . 0 0 "[ . 1]" 1
782 1 108 LYS QB 1 109 THR H 1.900 . 2.400 1.936 1.421 2.327 . 0 0 "[ . 1]" 1
783 2 108 LYS QB 2 109 THR H 1.900 . 2.400 1.810 1.491 1.945 . 0 0 "[ . 1]" 1
784 1 108 LYS HG3 1 109 THR H 4.600 . 6.000 4.453 4.062 4.850 . 0 0 "[ . 1]" 1
785 2 108 LYS HG3 2 109 THR H 4.600 . 6.000 4.450 4.187 4.652 . 0 0 "[ . 1]" 1
786 1 108 LYS H 1 109 THR H 3.200 . 4.400 3.160 2.867 3.400 . 0 0 "[ . 1]" 1
787 2 108 LYS H 2 109 THR H 3.200 . 4.400 3.266 3.049 3.408 . 0 0 "[ . 1]" 1
788 1 109 THR H 1 109 THR MG 3.600 . 5.200 3.861 3.756 3.959 . 0 0 "[ . 1]" 1
789 2 109 THR H 2 109 THR MG 3.600 . 5.200 3.838 3.715 3.946 . 0 0 "[ . 1]" 1
790 1 109 THR H 1 109 THR HB 2.800 . 3.800 3.062 2.840 3.250 . 0 0 "[ . 1]" 1
791 2 109 THR H 2 109 THR HB 2.800 . 3.800 3.053 2.882 3.314 . 0 0 "[ . 1]" 1
792 1 105 TYR H 1 107 PHE H 4.300 . 6.000 3.583 3.194 4.510 . 0 0 "[ . 1]" 1
793 2 105 TYR H 2 107 PHE H 4.300 . 6.000 3.437 3.112 3.972 . 0 0 "[ . 1]" 1
794 1 105 TYR H 1 107 PHE QD 3.800 . 5.600 4.192 3.876 4.500 . 0 0 "[ . 1]" 1
795 2 105 TYR H 2 107 PHE QD 3.800 . 5.600 4.085 3.593 4.287 . 0 0 "[ . 1]" 1
796 1 105 TYR H 1 107 PHE QE 4.700 . 6.000 5.876 5.613 6.059 0.059 8 0 "[ . 1]" 1
797 2 105 TYR H 2 107 PHE QE 4.700 . 6.000 5.820 5.366 6.032 0.032 6 0 "[ . 1]" 1
798 1 104 GLU HG2 1 105 TYR H 5.200 . 6.000 5.000 4.351 5.217 . 0 0 "[ . 1]" 1
799 2 104 GLU HG2 2 105 TYR H 5.100 . 6.000 5.022 4.254 5.552 . 0 0 "[ . 1]" 1
800 1 104 GLU HB2 1 105 TYR H 3.500 . 5.000 3.626 3.402 3.976 . 0 0 "[ . 1]" 1
801 2 104 GLU HB2 2 105 TYR H 3.500 . 5.000 3.592 3.451 3.974 . 0 0 "[ . 1]" 1
802 1 105 TYR H 1 105 TYR QD 3.000 . 4.100 3.498 3.330 3.604 . 0 0 "[ . 1]" 1
803 2 105 TYR H 2 105 TYR QD 3.000 . 4.100 3.517 3.356 3.589 . 0 0 "[ . 1]" 1
804 1 103 ARG HA 1 105 TYR H 3.600 . 5.300 3.479 3.357 3.602 . 0 0 "[ . 1]" 1
805 2 103 ARG HA 2 105 TYR H 3.600 . 5.300 3.438 3.291 3.530 . 0 0 "[ . 1]" 1
806 1 105 TYR H 1 105 TYR QE 4.000 . 6.000 4.991 4.784 5.252 . 0 0 "[ . 1]" 1
807 1 104 GLU HA 1 105 TYR H 3.300 . 4.700 3.328 3.282 3.359 . 0 0 "[ . 1]" 1
808 2 104 GLU HA 2 105 TYR H 3.300 . 4.700 3.323 3.298 3.357 . 0 0 "[ . 1]" 1
809 1 102 LEU HA 1 105 TYR H 3.300 . 4.700 3.602 3.437 3.894 . 0 0 "[ . 1]" 1
810 2 102 LEU HA 2 105 TYR H 3.300 . 4.700 3.641 3.494 3.772 . 0 0 "[ . 1]" 1
811 1 105 TYR H 1 106 GLY HA3 4.400 . 6.000 4.767 4.735 4.818 . 0 0 "[ . 1]" 1
812 2 105 TYR H 2 106 GLY HA3 4.400 . 6.000 4.749 4.688 4.816 . 0 0 "[ . 1]" 1
813 1 105 TYR H 1 105 TYR HB3 3.600 . 5.300 3.717 3.662 3.754 . 0 0 "[ . 1]" 1
814 2 105 TYR H 2 105 TYR HB3 3.600 . 5.300 3.722 3.702 3.753 . 0 0 "[ . 1]" 1
815 1 105 TYR H 1 105 TYR HB2 2.700 . 3.600 2.561 2.446 2.656 . 0 0 "[ . 1]" 1
816 2 105 TYR H 2 105 TYR HB2 2.700 . 3.600 2.554 2.516 2.637 . 0 0 "[ . 1]" 1
817 1 104 GLU HB3 1 105 TYR H 3.600 . 5.200 3.884 3.512 4.334 . 0 0 "[ . 1]" 1
818 2 104 GLU HB3 2 105 TYR H 3.600 . 5.200 3.968 3.463 4.378 . 0 0 "[ . 1]" 1
819 1 104 GLU HG3 1 105 TYR H 5.000 . 6.000 5.154 4.478 5.659 . 0 0 "[ . 1]" 1
820 2 104 GLU HG3 2 105 TYR H 5.000 . 6.000 5.043 4.518 5.176 . 0 0 "[ . 1]" 1
821 1 45 VAL MG1 1 67 ARG H 3.900 . 5.800 4.784 3.313 5.896 0.096 3 0 "[ . 1]" 1
822 2 45 VAL MG1 2 67 ARG H 3.900 . 5.800 3.771 2.286 4.760 . 0 0 "[ . 1]" 1
823 1 23 VAL HB 1 112 ASN H 4.200 . 6.000 3.862 3.508 4.016 . 0 0 "[ . 1]" 1
824 2 23 VAL HB 2 112 ASN H 4.200 . 6.000 3.835 3.647 3.951 . 0 0 "[ . 1]" 1
825 1 86 VAL MG2 1 112 ASN H 3.100 . 4.300 4.038 3.831 4.218 . 0 0 "[ . 1]" 1
826 2 86 VAL MG2 2 112 ASN H 3.100 . 4.300 4.074 3.901 4.316 0.016 9 0 "[ . 1]" 1
827 1 111 TYR H 1 112 ASN H 3.600 . 5.200 4.487 4.471 4.511 . 0 0 "[ . 1]" 1
828 2 111 TYR H 2 112 ASN H 3.600 . 5.200 4.490 4.474 4.510 . 0 0 "[ . 1]" 1
829 1 111 TYR HA 1 112 ASN H 2.400 . 3.100 2.254 2.201 2.329 . 0 0 "[ . 1]" 1
830 2 111 TYR HA 2 112 ASN H 2.400 . 3.100 2.248 2.207 2.316 . 0 0 "[ . 1]" 1
831 1 112 ASN H 1 112 ASN HA 3.000 . 4.100 2.949 2.934 2.954 . 0 0 "[ . 1]" 1
832 2 112 ASN H 2 112 ASN HA 3.000 . 4.100 2.951 2.943 2.955 . 0 0 "[ . 1]" 1
833 1 86 VAL HA 1 112 ASN H 4.100 . 6.000 5.038 4.963 5.115 . 0 0 "[ . 1]" 1
834 2 86 VAL HA 2 112 ASN H 4.100 . 6.000 5.048 4.934 5.190 . 0 0 "[ . 1]" 1
835 1 112 ASN H 1 112 ASN HB3 2.800 . 3.800 2.933 2.817 3.393 . 0 0 "[ . 1]" 1
836 2 112 ASN H 2 112 ASN HB3 2.800 . 3.800 2.965 2.714 3.384 . 0 0 "[ . 1]" 1
837 1 111 TYR HB3 1 112 ASN H 3.000 . 4.200 2.897 2.748 3.035 . 0 0 "[ . 1]" 1
838 2 111 TYR HB3 2 112 ASN H 3.000 . 4.200 2.920 2.859 2.992 . 0 0 "[ . 1]" 1
839 1 111 TYR HB2 1 112 ASN H 3.200 . 4.500 3.657 3.474 3.865 . 0 0 "[ . 1]" 1
840 2 111 TYR HB2 2 112 ASN H 3.200 . 4.500 3.644 3.518 3.777 . 0 0 "[ . 1]" 1
841 1 112 ASN H 1 112 ASN HB2 2.800 . 3.800 2.822 2.460 3.122 . 0 0 "[ . 1]" 1
842 2 112 ASN H 2 112 ASN HB2 2.800 . 3.800 2.744 2.449 2.954 . 0 0 "[ . 1]" 1
843 1 118 ASP H 1 120 TRP H 3.900 . 5.800 4.115 3.972 4.245 . 0 0 "[ . 1]" 1
844 2 118 ASP H 2 120 TRP H 3.900 . 5.800 4.110 3.976 4.218 . 0 0 "[ . 1]" 1
845 1 118 ASP H 1 119 LYS HB2 3.900 . 5.800 4.477 4.336 4.567 . 0 0 "[ . 1]" 1
846 2 118 ASP H 2 119 LYS HB2 3.900 . 5.800 4.437 4.333 4.530 . 0 0 "[ . 1]" 1
847 1 118 ASP H 1 119 LYS QD 3.300 . 4.600 4.432 4.003 4.537 . 0 0 "[ . 1]" 1
848 2 118 ASP H 2 119 LYS QD 3.300 . 4.600 4.439 4.037 4.551 . 0 0 "[ . 1]" 1
849 1 118 ASP H 1 119 LYS H 2.700 . 3.600 2.656 2.507 2.728 . 0 0 "[ . 1]" 1
850 2 118 ASP H 2 119 LYS H 2.700 . 3.600 2.627 2.527 2.714 . 0 0 "[ . 1]" 1
851 1 117 MET H 1 118 ASP H 2.600 . 3.500 2.647 2.396 2.840 . 0 0 "[ . 1]" 1
852 2 117 MET H 2 118 ASP H 2.600 . 3.500 2.614 2.526 2.715 . 0 0 "[ . 1]" 1
853 1 118 ASP H 1 118 ASP HA 2.700 . 3.600 2.805 2.791 2.844 . 0 0 "[ . 1]" 1
854 2 118 ASP H 2 118 ASP HA 2.700 . 3.600 2.813 2.791 2.836 . 0 0 "[ . 1]" 1
855 1 116 GLY HA2 1 118 ASP H 4.600 . 6.000 4.447 4.286 4.551 . 0 0 "[ . 1]" 1
856 2 116 GLY HA2 2 118 ASP H 4.600 . 6.000 4.422 4.313 4.558 . 0 0 "[ . 1]" 1
857 1 118 ASP H 1 118 ASP QB 2.500 . 3.300 2.260 2.108 2.472 . 0 0 "[ . 1]" 1
858 2 118 ASP H 2 118 ASP QB 2.500 . 3.300 2.345 2.049 2.802 . 0 0 "[ . 1]" 1
859 1 26 SER H 1 30 ALA H 3.500 . 5.100 4.385 3.632 4.597 . 0 0 "[ . 1]" 1
860 2 26 SER H 2 30 ALA H 3.500 . 5.100 4.252 3.564 4.478 . 0 0 "[ . 1]" 1
861 1 100 LYS H 1 101 THR H 2.300 . 3.000 2.721 2.666 2.793 . 0 0 "[ . 1]" 1
862 2 100 LYS H 2 101 THR H 2.300 . 3.000 2.737 2.659 2.853 . 0 0 "[ . 1]" 1
863 1 101 THR H 1 101 THR HB 2.400 . 3.100 2.897 2.532 3.366 0.266 1 0 "[ . 1]" 1
864 2 101 THR H 2 101 THR HB 2.400 . 3.100 2.803 2.660 3.346 0.246 2 0 "[ . 1]" 1
865 1 100 LYS HB3 1 101 THR H 3.100 . 4.300 3.724 3.616 3.862 . 0 0 "[ . 1]" 1
866 2 100 LYS HB3 2 101 THR H 3.100 . 4.300 3.711 3.605 3.836 . 0 0 "[ . 1]" 1
867 1 101 THR H 1 101 THR MG 3.600 . 5.300 3.405 2.839 3.774 . 0 0 "[ . 1]" 1
868 2 101 THR H 2 101 THR MG 3.600 . 5.300 3.660 2.935 3.780 . 0 0 "[ . 1]" 1
869 1 101 THR H 1 103 ARG H 3.800 . 5.600 4.200 4.153 4.324 . 0 0 "[ . 1]" 1
870 2 101 THR H 2 103 ARG H 3.800 . 5.600 4.267 4.149 4.458 . 0 0 "[ . 1]" 1
871 1 101 THR H 1 102 LEU H 2.700 . 3.600 2.535 2.486 2.631 . 0 0 "[ . 1]" 1
872 2 101 THR H 2 102 LEU H 2.700 . 3.600 2.497 2.429 2.599 . 0 0 "[ . 1]" 1
873 1 32 LYS HG2 1 33 LEU H 3.000 . 4.100 3.793 2.762 4.706 0.606 8 2 "[- . + 1]" 1
874 2 32 LYS HG2 2 33 LEU H 3.000 . 4.100 3.933 3.324 4.348 0.248 6 0 "[ . 1]" 1
875 1 32 LYS H 1 33 LEU H 2.300 . 3.000 2.858 2.821 2.908 . 0 0 "[ . 1]" 1
876 2 32 LYS H 2 33 LEU H 2.300 . 3.000 2.876 2.786 3.012 0.012 7 0 "[ . 1]" 1
877 1 33 LEU H 1 33 LEU HA 2.300 . 2.900 2.865 2.850 2.878 . 0 0 "[ . 1]" 1
878 2 33 LEU H 2 33 LEU HA 2.300 . 2.900 2.861 2.839 2.870 . 0 0 "[ . 1]" 1
879 1 102 LEU H 1 102 LEU HB3 3.700 . 5.400 3.522 3.470 3.568 . 0 0 "[ . 1]" 1
880 2 102 LEU H 2 102 LEU HB3 3.700 . 5.400 3.484 3.405 3.560 . 0 0 "[ . 1]" 1
881 1 102 LEU H 1 102 LEU MD2 3.700 . 5.400 3.585 3.324 3.892 . 0 0 "[ . 1]" 1
882 2 102 LEU H 2 102 LEU MD2 3.700 . 5.400 3.643 3.279 3.984 . 0 0 "[ . 1]" 1
883 1 100 LYS H 1 102 LEU H 4.100 . 6.000 4.308 4.134 4.635 . 0 0 "[ . 1]" 1
884 2 100 LYS H 2 102 LEU H 4.100 . 6.000 4.177 4.061 4.455 . 0 0 "[ . 1]" 1
885 1 102 LEU H 1 102 LEU HG 2.500 . 3.300 2.733 2.310 3.059 . 0 0 "[ . 1]" 1
886 2 102 LEU H 2 102 LEU HG 2.500 . 3.300 2.906 2.413 3.173 . 0 0 "[ . 1]" 1
887 1 101 THR HB 1 102 LEU H 2.700 . 3.600 2.791 2.698 2.917 . 0 0 "[ . 1]" 1
888 2 101 THR HB 2 102 LEU H 2.700 . 3.600 2.789 2.763 2.821 . 0 0 "[ . 1]" 1
889 1 102 LEU H 1 102 LEU HA 3.000 . 4.100 2.792 2.722 2.840 . 0 0 "[ . 1]" 1
890 2 102 LEU H 2 102 LEU HA 3.000 . 4.100 2.805 2.736 2.820 . 0 0 "[ . 1]" 1
891 1 25 LEU MD2 1 26 SER H 2.600 . 3.400 2.295 1.993 2.755 . 0 0 "[ . 1]" 1
892 2 25 LEU MD2 2 26 SER H 2.600 . 3.400 2.344 1.949 2.607 . 0 0 "[ . 1]" 1
893 1 25 LEU MD1 1 26 SER H 4.500 . 6.000 3.974 3.186 4.379 . 0 0 "[ . 1]" 1
894 2 25 LEU MD1 2 26 SER H 4.500 . 6.000 3.926 3.201 4.381 . 0 0 "[ . 1]" 1
895 1 25 LEU HA 1 26 SER H 2.100 . 2.700 2.256 2.162 2.702 0.002 1 0 "[ . 1]" 1
896 2 25 LEU HA 2 26 SER H 2.100 . 2.700 2.297 2.161 2.701 0.001 8 0 "[ . 1]" 1
897 1 26 SER H 1 26 SER HA 2.500 . 3.300 2.883 2.861 2.933 . 0 0 "[ . 1]" 1
898 2 26 SER H 2 26 SER HA 2.500 . 3.300 2.891 2.862 2.935 . 0 0 "[ . 1]" 1
899 1 26 SER H 1 26 SER HB3 3.100 . 4.300 3.453 3.249 3.771 . 0 0 "[ . 1]" 1
900 2 26 SER H 2 26 SER HB3 3.100 . 4.300 3.458 3.355 3.717 . 0 0 "[ . 1]" 1
901 1 26 SER H 1 26 SER HB2 3.200 . 4.500 3.121 2.732 3.355 . 0 0 "[ . 1]" 1
902 2 26 SER H 2 26 SER HB2 3.200 . 4.500 3.203 2.956 3.658 . 0 0 "[ . 1]" 1
903 1 26 SER H 1 30 ALA HA 4.200 . 6.000 5.973 5.112 6.112 0.112 6 0 "[ . 1]" 1
904 2 26 SER H 2 30 ALA HA 4.200 . 6.000 5.876 5.149 6.088 0.088 7 0 "[ . 1]" 1
905 1 26 SER H 1 29 ASP HB3 3.900 . 5.800 3.560 3.251 3.906 . 0 0 "[ . 1]" 1
906 2 26 SER H 2 29 ASP HB3 3.900 . 5.800 3.573 3.080 4.187 . 0 0 "[ . 1]" 1
907 1 26 SER H 1 29 ASP HB2 3.400 . 4.900 3.103 2.063 3.995 . 0 0 "[ . 1]" 1
908 2 26 SER H 2 29 ASP HB2 3.400 . 4.900 3.091 2.600 3.734 . 0 0 "[ . 1]" 1
909 1 61 ASN H 1 61 ASN HD21 4.000 . 6.000 4.266 3.375 5.053 . 0 0 "[ . 1]" 1
910 2 61 ASN H 2 61 ASN HD21 4.000 . 6.000 4.329 3.339 5.022 . 0 0 "[ . 1]" 1
911 1 15 VAL H 1 16 LYS H 2.700 . 3.600 2.760 2.724 2.818 . 0 0 "[ . 1]" 1
912 2 15 VAL H 2 16 LYS H 2.700 . 3.600 2.753 2.690 2.816 . 0 0 "[ . 1]" 1
913 1 16 LYS H 1 16 LYS QB 1.900 . 2.300 2.133 2.088 2.174 . 0 0 "[ . 1]" 1
914 2 16 LYS H 2 16 LYS QB 1.900 . 2.300 2.108 2.029 2.271 . 0 0 "[ . 1]" 1
915 1 15 VAL MG2 1 16 LYS H 4.000 . 6.000 4.208 4.116 4.313 . 0 0 "[ . 1]" 1
916 1 16 LYS H 1 17 ALA H 2.100 . 2.700 2.630 2.548 2.720 0.020 10 0 "[ . 1]" 1
917 2 16 LYS H 2 17 ALA H 2.100 . 2.700 2.594 2.521 2.705 0.005 7 0 "[ . 1]" 1
918 1 16 LYS H 1 16 LYS HA 2.400 . 3.100 2.821 2.792 2.847 . 0 0 "[ . 1]" 1
919 2 16 LYS H 2 16 LYS HA 2.400 . 3.100 2.837 2.807 2.854 . 0 0 "[ . 1]" 1
920 1 12 LYS HA 1 16 LYS H 3.400 . 4.900 3.800 3.534 4.100 . 0 0 "[ . 1]" 1
921 2 12 LYS HA 2 16 LYS H 3.400 . 4.900 3.782 3.674 3.864 . 0 0 "[ . 1]" 1
922 1 15 VAL HA 1 16 LYS H 3.500 . 5.000 3.527 3.496 3.550 . 0 0 "[ . 1]" 1
923 2 15 VAL HA 2 16 LYS H 3.500 . 5.000 3.515 3.510 3.526 . 0 0 "[ . 1]" 1
924 1 14 GLN H 1 16 LYS H 3.300 . 4.700 4.038 3.930 4.171 . 0 0 "[ . 1]" 1
925 2 14 GLN H 2 16 LYS H 3.300 . 4.700 3.968 3.890 4.027 . 0 0 "[ . 1]" 1
926 1 59 VAL HB 1 61 ASN H 3.400 . 4.900 3.078 2.470 3.534 . 0 0 "[ . 1]" 1
927 2 59 VAL HB 2 61 ASN H 3.400 . 4.900 3.213 2.479 3.866 . 0 0 "[ . 1]" 1
928 1 60 LYS QB 1 61 ASN H 2.400 . 3.100 2.970 2.551 3.166 0.066 3 0 "[ . 1]" 1
929 2 60 LYS QB 2 61 ASN H 2.400 . 3.100 2.781 2.459 3.238 0.138 5 0 "[ . 1]" 1
930 1 60 LYS HG3 1 61 ASN H 4.700 . 6.000 3.144 1.923 4.912 0.077 3 0 "[ . 1]" 1
931 2 60 LYS HG3 2 61 ASN H 4.700 . 6.000 4.064 2.557 4.759 . 0 0 "[ . 1]" 1
932 1 60 LYS HG2 1 61 ASN H 5.200 . 6.000 4.368 3.550 5.162 . 0 0 "[ . 1]" 1
933 2 60 LYS HG2 2 61 ASN H 5.200 . 6.000 4.912 3.905 5.184 . 0 0 "[ . 1]" 1
934 1 34 LEU MD2 1 61 ASN H 3.600 . 5.200 4.015 3.137 4.845 . 0 0 "[ . 1]" 1
935 2 34 LEU MD2 2 61 ASN H 3.600 . 5.200 3.933 3.262 4.896 . 0 0 "[ . 1]" 1
936 1 59 VAL MG2 1 61 ASN H 2.800 . 3.800 2.727 1.867 3.857 0.057 1 0 "[ . 1]" 1
937 2 59 VAL MG2 2 61 ASN H 2.800 . 3.800 2.485 1.821 3.829 0.029 3 0 "[ . 1]" 1
938 1 60 LYS HA 1 61 ASN H 6.000 . 6.000 3.520 3.445 3.561 . 0 0 "[ . 1]" 1
939 2 60 LYS HA 2 61 ASN H 6.000 . 6.000 3.514 3.451 3.585 . 0 0 "[ . 1]" 1
940 1 61 ASN H 1 62 TYR H 3.600 . 5.200 3.591 3.357 3.794 . 0 0 "[ . 1]" 1
941 2 61 ASN H 2 62 TYR H 3.600 . 5.200 3.520 3.316 3.760 . 0 0 "[ . 1]" 1
942 1 61 ASN H 1 61 ASN HD22 3.700 . 5.400 4.326 3.742 6.012 0.612 9 1 "[ . +1]" 1
943 2 61 ASN H 2 61 ASN HD22 3.700 . 5.400 4.482 3.610 6.062 0.662 10 2 "[ - +]" 1
944 1 61 ASN H 1 61 ASN HA 2.700 . 3.600 2.941 2.938 2.945 . 0 0 "[ . 1]" 1
945 2 61 ASN H 2 61 ASN HA 2.700 . 3.600 2.941 2.938 2.943 . 0 0 "[ . 1]" 1
946 1 61 ASN H 1 61 ASN HB3 3.100 . 4.300 3.403 3.083 3.783 . 0 0 "[ . 1]" 1
947 2 61 ASN H 2 61 ASN HB3 3.100 . 4.300 3.393 2.940 3.738 . 0 0 "[ . 1]" 1
948 1 60 LYS H 1 61 ASN H 2.900 . 4.000 2.734 2.409 2.905 . 0 0 "[ . 1]" 1
949 2 60 LYS H 2 61 ASN H 2.900 . 4.000 2.689 2.440 2.978 . 0 0 "[ . 1]" 1
950 1 51 LEU H 1 52 LYS HA 4.500 . 6.000 5.238 5.181 5.290 . 0 0 "[ . 1]" 1
951 2 51 LEU H 2 52 LYS HA 4.400 . 6.000 5.234 5.187 5.285 . 0 0 "[ . 1]" 1
952 1 51 LEU H 1 52 LYS QB 4.500 . 6.000 4.357 4.245 4.557 . 0 0 "[ . 1]" 1
953 2 51 LEU H 2 52 LYS QB 4.500 . 6.000 4.370 4.253 4.546 . 0 0 "[ . 1]" 1
954 1 51 LEU H 1 51 LEU HB3 3.600 . 5.200 3.186 3.120 3.297 . 0 0 "[ . 1]" 1
955 2 51 LEU H 2 51 LEU HB3 3.600 . 5.200 3.222 3.137 3.372 . 0 0 "[ . 1]" 1
956 1 51 LEU H 1 51 LEU HB2 2.300 . 3.000 2.056 2.031 2.113 . 0 0 "[ . 1]" 1
957 2 51 LEU H 2 51 LEU HB2 2.300 . 3.000 2.049 2.025 2.065 . 0 0 "[ . 1]" 1
958 1 50 GLU H 1 51 LEU H 2.600 . 3.400 2.433 2.363 2.504 . 0 0 "[ . 1]" 1
959 2 50 GLU H 2 51 LEU H 2.600 . 3.400 2.445 2.372 2.506 . 0 0 "[ . 1]" 1
960 1 51 LEU H 1 51 LEU HA 2.800 . 3.800 2.821 2.803 2.841 . 0 0 "[ . 1]" 1
961 2 51 LEU H 2 51 LEU HA 2.800 . 3.800 2.822 2.794 2.835 . 0 0 "[ . 1]" 1
962 1 16 LYS QB 1 17 ALA H 2.400 . 3.100 2.855 2.675 2.952 . 0 0 "[ . 1]" 1
963 2 16 LYS QB 2 17 ALA H 2.400 . 3.100 2.747 2.546 2.974 . 0 0 "[ . 1]" 1
964 1 15 VAL MG1 1 17 ALA H 3.900 . 5.800 4.615 4.385 4.857 . 0 0 "[ . 1]" 1
965 2 15 VAL MG1 2 17 ALA H 3.900 . 5.800 4.535 4.430 4.685 . 0 0 "[ . 1]" 1
966 1 17 ALA H 1 17 ALA HA 2.400 . 3.100 2.815 2.793 2.833 . 0 0 "[ . 1]" 1
967 2 17 ALA H 2 17 ALA HA 2.400 . 3.100 2.804 2.778 2.835 . 0 0 "[ . 1]" 1
968 1 15 VAL H 1 17 ALA H 3.100 . 4.300 4.231 4.171 4.311 0.011 10 0 "[ . 1]" 1
969 2 15 VAL H 2 17 ALA H 3.100 . 4.300 4.261 4.178 4.347 0.047 8 0 "[ . 1]" 1
970 1 17 ALA H 1 17 ALA MB 2.100 . 2.600 2.156 2.022 2.238 . 0 0 "[ . 1]" 1
971 2 17 ALA H 2 17 ALA MB 2.100 . 2.600 2.143 2.035 2.236 . 0 0 "[ . 1]" 1
972 1 17 ALA H 1 20 ALA H 4.300 . 6.000 4.878 4.625 5.288 . 0 0 "[ . 1]" 1
973 2 17 ALA H 2 20 ALA H 4.300 . 6.000 4.732 4.621 4.806 . 0 0 "[ . 1]" 1
974 1 16 LYS HA 1 17 ALA H 3.000 . 4.100 3.495 3.468 3.521 . 0 0 "[ . 1]" 1
975 2 16 LYS HA 2 17 ALA H 3.000 . 4.100 3.516 3.480 3.532 . 0 0 "[ . 1]" 1
976 1 5 GLU H 1 5 GLU HG2 4.200 . 6.000 3.447 1.896 4.558 0.004 9 0 "[ . 1]" 1
977 2 5 GLU H 2 5 GLU HG2 4.200 . 6.000 3.355 2.057 4.500 . 0 0 "[ . 1]" 1
978 1 5 GLU H 1 5 GLU QB 2.300 . 3.000 2.408 2.079 2.829 . 0 0 "[ . 1]" 1
979 2 5 GLU H 2 5 GLU QB 2.300 . 3.000 2.410 2.033 2.920 . 0 0 "[ . 1]" 1
980 1 5 GLU H 1 6 LYS QB 5.000 . 6.000 4.480 4.056 4.704 . 0 0 "[ . 1]" 1
981 2 5 GLU H 2 6 LYS QB 5.000 . 6.000 4.497 4.027 4.903 . 0 0 "[ . 1]" 1
982 1 5 GLU H 1 6 LYS H 2.900 . 4.000 2.501 2.434 2.572 . 0 0 "[ . 1]" 1
983 2 5 GLU H 2 6 LYS H 2.900 . 4.000 2.490 2.386 2.644 . 0 0 "[ . 1]" 1
984 1 3 MET HA 1 5 GLU H 3.800 . 5.600 3.602 3.293 4.075 . 0 0 "[ . 1]" 1
985 2 3 MET HA 2 5 GLU H 3.800 . 5.600 3.649 3.450 3.972 . 0 0 "[ . 1]" 1
986 1 5 GLU H 1 5 GLU HA 2.600 . 3.400 2.855 2.832 2.874 . 0 0 "[ . 1]" 1
987 2 5 GLU H 2 5 GLU HA 2.600 . 3.400 2.855 2.804 2.891 . 0 0 "[ . 1]" 1
988 1 4 GLY HA2 1 5 GLU H 3.400 . 4.800 3.479 3.434 3.519 . 0 0 "[ . 1]" 1
989 2 4 GLY HA2 2 5 GLU H 3.400 . 4.800 3.489 3.439 3.542 . 0 0 "[ . 1]" 1
990 1 5 GLU H 1 6 LYS HG3 5.400 . 6.000 5.263 4.571 6.050 0.050 5 0 "[ . 1]" 1
991 2 5 GLU H 2 6 LYS HG3 5.400 . 6.000 5.512 4.459 6.149 0.149 9 0 "[ . 1]" 1
992 1 119 LYS H 1 120 TRP H 2.500 . 3.300 2.508 2.434 2.637 . 0 0 "[ . 1]" 1
993 2 119 LYS H 2 120 TRP H 2.500 . 3.300 2.509 2.425 2.652 . 0 0 "[ . 1]" 1
994 1 119 LYS H 1 119 LYS HB3 3.600 . 5.200 3.325 3.266 3.394 . 0 0 "[ . 1]" 1
995 2 119 LYS H 2 119 LYS HB3 3.600 . 5.200 3.320 3.255 3.376 . 0 0 "[ . 1]" 1
996 1 119 LYS H 1 119 LYS HB2 2.300 . 3.000 2.072 2.043 2.099 . 0 0 "[ . 1]" 1
997 2 119 LYS H 2 119 LYS HB2 2.300 . 3.000 2.066 2.029 2.098 . 0 0 "[ . 1]" 1
998 1 119 LYS H 1 119 LYS HA 2.700 . 3.600 2.843 2.810 2.861 . 0 0 "[ . 1]" 1
999 2 119 LYS H 2 119 LYS HA 2.700 . 3.600 2.841 2.809 2.858 . 0 0 "[ . 1]" 1
1000 1 118 ASP QB 1 119 LYS H 2.800 . 3.800 3.341 2.567 3.599 . 0 0 "[ . 1]" 1
1001 2 118 ASP QB 2 119 LYS H 2.800 . 3.800 3.344 2.820 3.624 . 0 0 "[ . 1]" 1
1002 1 119 LYS H 1 119 LYS QD 3.500 . 5.000 2.637 2.463 2.772 . 0 0 "[ . 1]" 1
1003 2 119 LYS H 2 119 LYS QD 3.500 . 5.000 2.636 2.489 2.888 . 0 0 "[ . 1]" 1
1004 1 118 ASP HA 1 119 LYS H 3.300 . 4.700 3.518 3.487 3.544 . 0 0 "[ . 1]" 1
1005 2 118 ASP HA 2 119 LYS H 3.300 . 4.700 3.512 3.452 3.548 . 0 0 "[ . 1]" 1
1006 1 115 GLY HA2 1 119 LYS H 4.300 . 6.000 5.450 4.920 5.833 . 0 0 "[ . 1]" 1
1007 2 115 GLY HA2 2 119 LYS H 4.300 . 6.000 5.546 5.191 6.087 0.087 4 0 "[ . 1]" 1
1008 1 79 LEU H 1 79 LEU MD2 3.700 . 5.400 4.202 3.913 4.573 . 0 0 "[ . 1]" 1
1009 2 79 LEU H 2 79 LEU MD2 3.700 . 5.400 4.061 3.622 4.307 . 0 0 "[ . 1]" 1
1010 1 9 ALA H 1 9 ALA MB 2.200 . 2.800 2.091 2.002 2.222 . 0 0 "[ . 1]" 1
1011 2 9 ALA H 2 9 ALA MB 2.200 . 2.800 2.132 2.004 2.231 . 0 0 "[ . 1]" 1
1012 1 9 ALA H 1 9 ALA HA 2.500 . 3.300 2.805 2.780 2.856 . 0 0 "[ . 1]" 1
1013 2 9 ALA H 2 9 ALA HA 2.500 . 3.300 2.803 2.773 2.850 . 0 0 "[ . 1]" 1
1014 1 6 LYS QB 1 7 PHE H 2.500 . 3.300 2.416 2.256 3.053 . 0 0 "[ . 1]" 1
1015 2 6 LYS QB 2 7 PHE H 2.500 . 3.300 2.441 2.226 3.074 . 0 0 "[ . 1]" 1
1016 1 6 LYS HG2 1 7 PHE H 4.600 . 6.000 4.360 3.501 4.748 . 0 0 "[ . 1]" 1
1017 2 6 LYS HG2 2 7 PHE H 4.600 . 6.000 4.301 3.607 4.881 . 0 0 "[ . 1]" 1
1018 1 6 LYS H 1 7 PHE H 2.900 . 4.000 2.929 2.844 3.010 . 0 0 "[ . 1]" 1
1019 2 6 LYS H 2 7 PHE H 2.900 . 4.000 2.868 2.785 2.921 . 0 0 "[ . 1]" 1
1020 1 7 PHE H 1 7 PHE QE 3.500 . 5.100 4.118 3.964 4.300 . 0 0 "[ . 1]" 1
1021 2 7 PHE H 2 7 PHE QE 3.500 . 5.100 4.135 4.036 4.183 . 0 0 "[ . 1]" 1
1022 1 7 PHE H 1 7 PHE HA 3.000 . 4.100 2.863 2.823 2.901 . 0 0 "[ . 1]" 1
1023 2 7 PHE H 2 7 PHE HA 3.000 . 4.100 2.864 2.835 2.906 . 0 0 "[ . 1]" 1
1024 1 7 PHE H 1 7 PHE QD 2.900 . 4.000 2.960 2.896 3.016 . 0 0 "[ . 1]" 1
1025 2 7 PHE H 2 7 PHE QD 2.900 . 4.000 2.947 2.828 3.014 . 0 0 "[ . 1]" 1
1026 1 7 PHE H 1 7 PHE HB3 2.600 . 3.500 2.976 2.831 3.122 . 0 0 "[ . 1]" 1
1027 2 7 PHE H 2 7 PHE HB3 2.600 . 3.500 2.974 2.884 3.097 . 0 0 "[ . 1]" 1
1028 1 7 PHE H 1 7 PHE HB2 3.200 . 4.500 3.618 3.584 3.651 . 0 0 "[ . 1]" 1
1029 2 7 PHE H 2 7 PHE HB2 3.200 . 4.500 3.630 3.608 3.659 . 0 0 "[ . 1]" 1
1030 1 8 ASP H 2 75 ALA MB 3.800 . 5.600 3.849 3.139 4.547 . 0 0 "[ . 1]" 1
1031 1 75 ALA MB 2 8 ASP H 3.800 . 5.600 3.967 3.442 4.625 . 0 0 "[ . 1]" 1
1032 1 7 PHE QD 1 8 ASP H 3.400 . 4.800 2.507 2.031 2.688 . 0 0 "[ . 1]" 1
1033 2 7 PHE QD 2 8 ASP H 3.400 . 4.800 2.479 2.099 2.934 . 0 0 "[ . 1]" 1
1034 1 7 PHE HA 1 8 ASP H 3.500 . 5.000 3.434 3.401 3.487 . 0 0 "[ . 1]" 1
1035 2 7 PHE HA 2 8 ASP H 3.500 . 5.000 3.435 3.392 3.498 . 0 0 "[ . 1]" 1
1036 1 7 PHE HB3 1 8 ASP H 3.400 . 4.900 4.303 4.231 4.368 . 0 0 "[ . 1]" 1
1037 2 7 PHE HB3 2 8 ASP H 3.400 . 4.900 4.290 4.206 4.339 . 0 0 "[ . 1]" 1
1038 1 7 PHE HB2 1 8 ASP H 3.200 . 4.500 3.838 3.609 3.931 . 0 0 "[ . 1]" 1
1039 2 7 PHE HB2 2 8 ASP H 3.200 . 4.500 3.835 3.653 3.955 . 0 0 "[ . 1]" 1
1040 1 6 LYS H 1 8 ASP H 4.100 . 6.000 3.997 3.893 4.163 . 0 0 "[ . 1]" 1
1041 2 6 LYS H 2 8 ASP H 4.100 . 6.000 3.938 3.832 4.165 . 0 0 "[ . 1]" 1
1042 1 8 ASP H 2 75 ALA HA 4.600 . 6.000 5.296 4.770 5.588 . 0 0 "[ . 1]" 1
1043 1 75 ALA HA 2 8 ASP H 4.600 . 6.000 5.461 5.246 5.900 . 0 0 "[ . 1]" 1
1044 1 86 VAL MG2 1 113 SER H 3.000 . 4.100 3.662 3.394 4.030 . 0 0 "[ . 1]" 1
1045 2 86 VAL MG2 2 113 SER H 3.000 . 4.100 3.618 3.374 3.876 . 0 0 "[ . 1]" 1
1046 1 87 VAL H 1 113 SER H 4.200 . 6.000 4.098 3.845 4.655 . 0 0 "[ . 1]" 1
1047 2 87 VAL H 2 113 SER H 4.200 . 6.000 4.055 3.761 4.290 . 0 0 "[ . 1]" 1
1048 1 112 ASN HA 1 113 SER H 2.300 . 3.000 2.253 2.193 2.386 . 0 0 "[ . 1]" 1
1049 2 112 ASN HA 2 113 SER H 2.300 . 3.000 2.228 2.199 2.292 . 0 0 "[ . 1]" 1
1050 1 113 SER H 1 114 GLU H 4.700 . 6.000 4.450 4.320 4.562 . 0 0 "[ . 1]" 1
1051 2 113 SER H 2 114 GLU H 4.700 . 6.000 4.418 4.277 4.536 . 0 0 "[ . 1]" 1
1052 1 113 SER H 1 113 SER QB 2.600 . 3.400 2.386 2.082 2.856 . 0 0 "[ . 1]" 1
1053 2 113 SER H 2 113 SER QB 2.600 . 3.400 2.484 2.163 2.888 . 0 0 "[ . 1]" 1
1054 1 112 ASN H 1 113 SER H 4.000 . 6.000 4.415 4.392 4.447 . 0 0 "[ . 1]" 1
1055 2 112 ASN H 2 113 SER H 4.000 . 6.000 4.417 4.396 4.450 . 0 0 "[ . 1]" 1
1056 1 112 ASN HB2 1 113 SER H 3.600 . 5.200 4.220 4.013 4.329 . 0 0 "[ . 1]" 1
1057 2 112 ASN HB2 2 113 SER H 3.600 . 5.200 4.256 4.190 4.357 . 0 0 "[ . 1]" 1
1058 1 96 ALA H 1 100 LYS HB3 4.800 . 6.000 6.031 5.959 6.075 0.075 2 0 "[ . 1]" 1
1059 2 96 ALA H 2 100 LYS HB3 4.800 . 6.000 6.062 6.002 6.117 0.117 7 0 "[ . 1]" 1
1060 1 96 ALA H 1 96 ALA MB 2.300 . 3.000 2.117 2.020 2.221 . 0 0 "[ . 1]" 1
1061 2 96 ALA H 2 96 ALA MB 2.300 . 3.000 2.083 2.014 2.217 . 0 0 "[ . 1]" 1
1062 1 95 ALA MB 1 96 ALA H 2.900 . 4.000 2.916 2.235 3.265 . 0 0 "[ . 1]" 1
1063 2 95 ALA MB 2 96 ALA H 2.900 . 4.000 2.930 2.468 3.257 . 0 0 "[ . 1]" 1
1064 1 96 ALA H 1 97 LEU H 2.600 . 3.400 2.715 2.656 2.827 . 0 0 "[ . 1]" 1
1065 2 96 ALA H 2 97 LEU H 2.600 . 3.400 2.694 2.645 2.772 . 0 0 "[ . 1]" 1
1066 1 96 ALA H 1 112 ASN HD21 4.200 . 6.000 4.212 3.768 4.635 . 0 0 "[ . 1]" 1
1067 2 96 ALA H 2 112 ASN HD21 4.200 . 6.000 4.263 3.644 4.708 . 0 0 "[ . 1]" 1
1068 1 96 ALA H 1 96 ALA HA 2.500 . 3.300 2.788 2.757 2.805 . 0 0 "[ . 1]" 1
1069 2 96 ALA H 2 96 ALA HA 2.500 . 3.300 2.786 2.762 2.800 . 0 0 "[ . 1]" 1
1070 1 95 ALA HA 1 96 ALA H 3.200 . 4.500 3.411 3.291 3.552 . 0 0 "[ . 1]" 1
1071 2 95 ALA HA 2 96 ALA H 3.200 . 4.500 3.412 3.262 3.521 . 0 0 "[ . 1]" 1
1072 1 74 LEU HG 1 75 ALA H 3.200 . 4.400 3.725 3.061 4.444 0.044 10 0 "[ . 1]" 1
1073 2 74 LEU HG 2 75 ALA H 3.100 . 4.300 4.118 3.646 4.414 0.114 4 0 "[ . 1]" 1
1074 1 74 LEU HB2 1 75 ALA H 4.200 . 6.000 3.692 3.080 4.266 . 0 0 "[ . 1]" 1
1075 2 74 LEU HB3 2 75 ALA H 4.200 . 6.000 2.416 2.218 2.848 . 0 0 "[ . 1]" 1
1076 1 74 LEU MD2 1 75 ALA H 4.200 . 6.000 3.907 3.107 4.346 . 0 0 "[ . 1]" 1
1077 2 74 LEU MD2 2 75 ALA H 4.200 . 6.000 4.093 3.323 4.368 . 0 0 "[ . 1]" 1
1078 1 74 LEU H 1 75 ALA H 2.900 . 3.900 2.714 2.439 2.926 . 0 0 "[ . 1]" 1
1079 2 74 LEU H 2 75 ALA H 2.900 . 3.900 2.765 2.556 2.923 . 0 0 "[ . 1]" 1
1080 1 75 ALA H 1 76 LYS H 2.600 . 3.400 2.502 2.268 2.697 . 0 0 "[ . 1]" 1
1081 2 75 ALA H 2 76 LYS H 2.600 . 3.400 2.569 2.398 2.729 . 0 0 "[ . 1]" 1
1082 1 75 ALA H 1 76 LYS HA 4.500 . 6.000 5.108 4.928 5.260 . 0 0 "[ . 1]" 1
1083 2 75 ALA H 2 76 LYS HA 4.500 . 6.000 5.155 5.029 5.311 . 0 0 "[ . 1]" 1
1084 1 75 ALA H 1 75 ALA HA 2.800 . 3.800 2.846 2.804 2.896 . 0 0 "[ . 1]" 1
1085 2 75 ALA H 2 75 ALA HA 2.800 . 3.800 2.837 2.800 2.888 . 0 0 "[ . 1]" 1
1086 1 74 LEU HA 1 75 ALA H 3.200 . 4.500 3.510 3.447 3.554 . 0 0 "[ . 1]" 1
1087 2 74 LEU HA 2 75 ALA H 3.200 . 4.500 3.540 3.463 3.584 . 0 0 "[ . 1]" 1
1088 1 72 PRO HA 1 75 ALA H 3.300 . 4.600 4.168 3.659 4.617 0.017 2 0 "[ . 1]" 1
1089 2 72 PRO HA 2 75 ALA H 3.300 . 4.600 4.182 3.707 4.603 0.003 9 0 "[ . 1]" 1
1090 1 58 ASP HB3 1 127 SER H 3.800 . 5.600 3.771 3.221 4.418 . 0 0 "[ . 1]" 1
1091 2 58 ASP HB3 2 127 SER H 3.800 . 5.600 3.689 3.393 4.634 . 0 0 "[ . 1]" 1
1092 1 126 PRO HB3 1 127 SER H 3.800 . 5.600 4.135 4.015 4.227 . 0 0 "[ . 1]" 1
1093 2 126 PRO HB3 2 127 SER H 3.800 . 5.600 4.114 3.893 4.260 . 0 0 "[ . 1]" 1
1094 1 126 PRO HB2 1 127 SER H 3.400 . 4.800 3.813 3.728 3.894 . 0 0 "[ . 1]" 1
1095 2 126 PRO HB2 2 127 SER H 3.400 . 4.800 3.781 3.556 3.938 . 0 0 "[ . 1]" 1
1096 1 126 PRO HG2 1 127 SER H 4.700 . 6.000 5.075 5.034 5.146 . 0 0 "[ . 1]" 1
1097 2 126 PRO HG2 2 127 SER H 4.700 . 6.000 5.060 4.970 5.121 . 0 0 "[ . 1]" 1
1098 1 58 ASP HB2 1 127 SER H 4.000 . 6.000 4.216 3.771 4.807 . 0 0 "[ . 1]" 1
1099 2 58 ASP HB2 2 127 SER H 4.000 . 6.000 4.287 3.752 5.438 . 0 0 "[ . 1]" 1
1100 1 126 PRO HA 1 127 SER H 2.200 . 2.800 2.170 2.110 2.216 . 0 0 "[ . 1]" 1
1101 2 126 PRO HA 2 127 SER H 2.200 . 2.800 2.170 2.127 2.197 . 0 0 "[ . 1]" 1
1102 1 127 SER H 1 127 SER QB 3.000 . 4.100 2.985 2.656 3.180 . 0 0 "[ . 1]" 1
1103 2 127 SER H 2 127 SER QB 3.000 . 4.100 3.094 2.865 3.196 . 0 0 "[ . 1]" 1
1104 1 58 ASP H 1 127 SER H 4.600 . 6.000 4.240 4.023 4.685 . 0 0 "[ . 1]" 1
1105 2 58 ASP H 2 127 SER H 4.600 . 6.000 4.193 3.941 4.683 . 0 0 "[ . 1]" 1
1106 1 18 ALA H 1 19 LYS H 2.600 . 3.400 2.595 2.492 2.787 . 0 0 "[ . 1]" 1
1107 2 18 ALA H 2 19 LYS H 2.600 . 3.400 2.615 2.496 2.813 . 0 0 "[ . 1]" 1
1108 1 18 ALA H 1 20 ALA H 3.700 . 5.400 3.769 3.620 4.056 . 0 0 "[ . 1]" 1
1109 2 18 ALA H 2 20 ALA H 3.700 . 5.400 3.673 3.604 3.758 . 0 0 "[ . 1]" 1
1110 1 18 ALA H 1 18 ALA HA 2.400 . 3.100 2.838 2.786 2.862 . 0 0 "[ . 1]" 1
1111 2 18 ALA H 2 18 ALA HA 2.400 . 3.100 2.839 2.805 2.862 . 0 0 "[ . 1]" 1
1112 1 15 VAL HA 1 18 ALA H 3.200 . 4.500 3.547 3.373 3.745 . 0 0 "[ . 1]" 1
1113 2 15 VAL HA 2 18 ALA H 3.200 . 4.500 3.577 3.452 3.757 . 0 0 "[ . 1]" 1
1114 1 82 GLU H 1 83 LYS H 2.300 . 2.900 2.141 1.959 2.547 0.041 8 0 "[ . 1]" 1
1115 2 82 GLU H 2 83 LYS H 2.300 . 2.900 2.115 1.977 2.260 0.023 1 0 "[ . 1]" 1
1116 1 83 LYS H 1 83 LYS HG3 2.600 . 3.500 3.365 2.264 4.308 0.808 2 2 "[-+ . 1]" 1
1117 2 83 LYS H 2 83 LYS HG3 2.600 . 3.500 3.160 2.201 4.052 0.552 10 1 "[ . +]" 1
1118 1 80 ASP HA 1 83 LYS H 4.300 . 6.000 5.050 4.838 5.457 . 0 0 "[ . 1]" 1
1119 2 80 ASP HA 2 83 LYS H 4.300 . 6.000 4.968 4.787 5.409 . 0 0 "[ . 1]" 1
1120 1 83 LYS H 1 83 LYS HA 2.700 . 3.600 2.919 2.888 2.940 . 0 0 "[ . 1]" 1
1121 2 83 LYS H 2 83 LYS HA 2.700 . 3.600 2.909 2.850 2.945 . 0 0 "[ . 1]" 1
1122 1 81 PRO HA 1 83 LYS H 3.600 . 5.200 3.595 3.375 3.869 . 0 0 "[ . 1]" 1
1123 2 81 PRO HA 2 83 LYS H 3.600 . 5.200 3.635 3.278 3.840 . 0 0 "[ . 1]" 1
1124 1 80 ASP HB3 1 83 LYS H 4.100 . 6.000 4.071 3.286 4.939 . 0 0 "[ . 1]" 1
1125 2 80 ASP HB3 2 83 LYS H 4.100 . 6.000 3.794 3.301 4.617 . 0 0 "[ . 1]" 1
1126 1 82 GLU HG3 1 83 LYS H 4.900 . 6.000 4.006 2.590 5.704 . 0 0 "[ . 1]" 1
1127 2 82 GLU HG3 2 83 LYS H 4.900 . 6.000 3.646 2.595 5.662 . 0 0 "[ . 1]" 1
1128 1 74 LEU MD1 1 75 ALA H 4.700 . 6.000 4.487 4.355 4.607 . 0 0 "[ . 1]" 1
1129 2 74 LEU MD1 2 75 ALA H 4.700 . 6.000 4.618 4.502 4.831 . 0 0 "[ . 1]" 1
1130 1 28 LYS QB 1 29 ASP H 2.400 . 3.100 2.807 2.492 3.199 0.099 10 0 "[ . 1]" 1
1131 2 28 LYS QB 2 29 ASP H 2.400 . 3.100 2.583 2.454 2.976 . 0 0 "[ . 1]" 1
1132 1 25 LEU MD1 1 29 ASP H 5.100 . 6.000 4.671 4.348 5.086 . 0 0 "[ . 1]" 1
1133 2 25 LEU MD1 2 29 ASP H 5.100 . 6.000 4.606 4.292 4.993 . 0 0 "[ . 1]" 1
1134 1 26 SER H 1 29 ASP H 3.900 . 5.800 4.044 3.623 4.202 . 0 0 "[ . 1]" 1
1135 2 26 SER H 2 29 ASP H 3.900 . 5.800 3.942 3.544 4.146 . 0 0 "[ . 1]" 1
1136 1 29 ASP H 1 30 ALA H 2.400 . 3.100 2.406 2.291 2.485 . 0 0 "[ . 1]" 1
1137 2 29 ASP H 2 30 ALA H 2.400 . 3.100 2.405 2.294 2.481 . 0 0 "[ . 1]" 1
1138 1 29 ASP H 1 29 ASP HA 2.700 . 3.600 2.861 2.836 2.895 . 0 0 "[ . 1]" 1
1139 2 29 ASP H 2 29 ASP HA 2.700 . 3.600 2.863 2.844 2.893 . 0 0 "[ . 1]" 1
1140 1 26 SER HB3 1 29 ASP H 4.400 . 6.000 4.574 4.103 4.844 . 0 0 "[ . 1]" 1
1141 2 26 SER HB3 2 29 ASP H 4.400 . 6.000 4.723 4.484 4.934 . 0 0 "[ . 1]" 1
1142 1 26 SER HB2 1 29 ASP H 3.700 . 5.400 2.928 2.561 3.154 . 0 0 "[ . 1]" 1
1143 2 26 SER HB2 2 29 ASP H 3.700 . 5.400 3.079 2.802 3.580 . 0 0 "[ . 1]" 1
1144 1 28 LYS HA 1 29 ASP H 3.300 . 4.700 3.530 3.510 3.555 . 0 0 "[ . 1]" 1
1145 2 28 LYS HA 2 29 ASP H 3.300 . 4.700 3.534 3.517 3.544 . 0 0 "[ . 1]" 1
1146 1 29 ASP H 1 29 ASP HB3 3.200 . 4.500 3.206 2.905 3.590 . 0 0 "[ . 1]" 1
1147 2 29 ASP H 2 29 ASP HB3 3.200 . 4.500 3.220 2.878 3.593 . 0 0 "[ . 1]" 1
1148 1 29 ASP H 1 29 ASP HB2 2.400 . 3.100 2.217 2.098 2.437 . 0 0 "[ . 1]" 1
1149 2 29 ASP H 2 29 ASP HB2 2.400 . 3.100 2.213 2.101 2.448 . 0 0 "[ . 1]" 1
1150 1 40 ILE H 1 40 ILE HG13 2.300 . 3.000 2.305 1.872 2.846 . 0 0 "[ . 1]" 1
1151 2 40 ILE H 2 40 ILE HG13 2.300 . 3.000 2.281 1.940 2.562 . 0 0 "[ . 1]" 1
1152 1 40 ILE H 1 40 ILE MD 3.300 . 4.600 3.754 3.486 4.131 . 0 0 "[ . 1]" 1
1153 2 40 ILE H 2 40 ILE MD 3.300 . 4.600 3.785 3.582 3.958 . 0 0 "[ . 1]" 1
1154 1 40 ILE H 1 40 ILE MG 3.100 . 4.300 3.791 3.769 3.809 . 0 0 "[ . 1]" 1
1155 2 40 ILE H 2 40 ILE MG 3.100 . 4.300 3.785 3.766 3.803 . 0 0 "[ . 1]" 1
1156 1 37 ASN HA 1 40 ILE H 4.500 . 6.000 4.465 4.297 4.897 . 0 0 "[ . 1]" 1
1157 2 37 ASN HA 2 40 ILE H 4.500 . 6.000 4.493 4.232 4.700 . 0 0 "[ . 1]" 1
1158 1 38 PRO HA 1 40 ILE H 3.800 . 5.600 4.104 3.802 5.313 . 0 0 "[ . 1]" 1
1159 2 38 PRO HA 2 40 ILE H 3.800 . 5.600 4.117 3.713 5.328 . 0 0 "[ . 1]" 1
1160 1 40 ILE H 1 40 ILE HA 2.700 . 3.600 2.874 2.648 2.907 . 0 0 "[ . 1]" 1
1161 2 40 ILE H 2 40 ILE HA 2.700 . 3.600 2.869 2.664 2.900 . 0 0 "[ . 1]" 1
1162 1 37 ASN HB2 1 40 ILE H 3.300 . 4.700 3.309 2.848 3.603 . 0 0 "[ . 1]" 1
1163 2 37 ASN HB2 2 40 ILE H 3.300 . 4.700 3.284 3.002 3.738 . 0 0 "[ . 1]" 1
1164 1 39 ASP HA 1 40 ILE H 3.200 . 4.500 3.452 3.406 3.525 . 0 0 "[ . 1]" 1
1165 2 39 ASP HA 2 40 ILE H 3.200 . 4.500 3.443 3.392 3.524 . 0 0 "[ . 1]" 1
1166 1 83 LYS H 1 84 PRO HD3 4.800 . 6.000 4.442 4.259 4.704 . 0 0 "[ . 1]" 1
1167 2 83 LYS H 2 84 PRO HD3 4.800 . 6.000 4.532 4.383 4.639 . 0 0 "[ . 1]" 1
1168 1 80 ASP HB2 1 83 LYS H 3.900 . 5.800 5.030 4.445 5.488 . 0 0 "[ . 1]" 1
1169 2 80 ASP HB2 2 83 LYS H 3.900 . 5.800 4.933 3.266 5.680 . 0 0 "[ . 1]" 1
1170 1 107 PHE H 1 107 PHE QD 2.800 . 3.800 2.866 2.077 3.551 . 0 0 "[ . 1]" 1
1171 2 107 PHE H 2 107 PHE QD 2.800 . 3.800 2.835 2.397 3.349 . 0 0 "[ . 1]" 1
1172 1 107 PHE H 1 107 PHE QE 4.400 . 6.000 5.155 4.378 5.765 . 0 0 "[ . 1]" 1
1173 2 107 PHE H 2 107 PHE QE 4.400 . 6.000 5.126 4.727 5.598 . 0 0 "[ . 1]" 1
1174 1 107 PHE H 1 107 PHE HA 3.000 . 4.100 2.883 2.787 2.939 . 0 0 "[ . 1]" 1
1175 2 107 PHE H 2 107 PHE HA 3.000 . 4.100 2.875 2.805 2.936 . 0 0 "[ . 1]" 1
1176 1 106 GLY HA2 1 107 PHE H 4.400 . 6.000 2.877 2.306 3.391 . 0 0 "[ . 1]" 1
1177 2 106 GLY HA2 2 107 PHE H 4.300 . 6.000 2.937 2.551 3.247 . 0 0 "[ . 1]" 1
1178 1 106 GLY HA3 1 107 PHE H 3.200 . 4.500 3.469 3.167 3.574 . 0 0 "[ . 1]" 1
1179 2 106 GLY HA3 2 107 PHE H 3.200 . 4.500 3.470 3.340 3.565 . 0 0 "[ . 1]" 1
1180 1 107 PHE H 1 107 PHE HB2 2.900 . 4.000 2.236 2.153 2.534 . 0 0 "[ . 1]" 1
1181 2 107 PHE H 2 107 PHE HB2 2.900 . 4.000 2.206 2.144 2.322 . 0 0 "[ . 1]" 1
1182 1 14 GLN H 1 14 GLN HB3 3.500 . 5.000 3.529 3.451 3.584 . 0 0 "[ . 1]" 1
1183 2 14 GLN H 2 14 GLN HB3 3.500 . 5.000 3.561 3.442 3.607 . 0 0 "[ . 1]" 1
1184 1 14 GLN H 1 14 GLN HG2 3.400 . 4.900 3.527 3.056 3.733 . 0 0 "[ . 1]" 1
1185 2 14 GLN H 2 14 GLN HG2 3.400 . 4.900 3.080 2.266 3.703 . 0 0 "[ . 1]" 1
1186 1 14 GLN H 1 14 GLN HB2 2.500 . 3.300 2.254 2.149 2.370 . 0 0 "[ . 1]" 1
1187 2 14 GLN H 2 14 GLN HB2 2.500 . 3.300 2.368 2.144 2.545 . 0 0 "[ . 1]" 1
1188 1 14 GLN H 1 15 VAL HB 4.200 . 6.000 4.531 4.384 4.750 . 0 0 "[ . 1]" 1
1189 2 14 GLN H 2 15 VAL HB 4.200 . 6.000 4.440 4.305 4.520 . 0 0 "[ . 1]" 1
1190 1 14 GLN H 1 15 VAL MG2 4.100 . 6.000 4.797 4.442 5.346 . 0 0 "[ . 1]" 1
1191 2 14 GLN H 2 15 VAL MG2 4.100 . 6.000 5.234 4.831 5.531 . 0 0 "[ . 1]" 1
1192 1 13 ALA HA 1 14 GLN H 3.100 . 4.300 3.531 3.511 3.550 . 0 0 "[ . 1]" 1
1193 2 13 ALA HA 2 14 GLN H 3.100 . 4.300 3.535 3.508 3.562 . 0 0 "[ . 1]" 1
1194 1 14 GLN H 1 14 GLN HA 2.700 . 3.600 2.854 2.830 2.869 . 0 0 "[ . 1]" 1
1195 2 14 GLN H 2 14 GLN HA 2.700 . 3.600 2.852 2.832 2.867 . 0 0 "[ . 1]" 1
1196 1 14 GLN H 1 14 GLN HG3 2.700 . 3.600 2.988 2.602 3.380 . 0 0 "[ . 1]" 1
1197 2 14 GLN H 2 14 GLN HG3 2.700 . 3.600 2.966 2.183 3.623 0.023 6 0 "[ . 1]" 1
1198 1 29 ASP H 1 31 TYR H 3.700 . 5.400 4.087 3.911 4.177 . 0 0 "[ . 1]" 1
1199 2 29 ASP H 2 31 TYR H 3.700 . 5.400 4.113 3.971 4.241 . 0 0 "[ . 1]" 1
1200 1 28 LYS QG 1 29 ASP H 4.800 . 6.000 3.276 1.903 4.355 0.097 6 0 "[ . 1]" 1
1201 2 28 LYS HG3 2 29 ASP H 4.800 . 6.000 3.951 2.283 4.917 . 0 0 "[ . 1]" 1
1202 1 25 LEU MD2 1 29 ASP H 4.900 . 6.000 4.460 3.863 4.871 . 0 0 "[ . 1]" 1
1203 2 25 LEU MD2 2 29 ASP H 4.900 . 6.000 4.483 4.203 4.794 . 0 0 "[ . 1]" 1
1204 1 29 ASP H 1 30 ALA HA 4.500 . 6.000 5.075 4.954 5.152 . 0 0 "[ . 1]" 1
1205 2 29 ASP H 2 30 ALA HA 4.500 . 6.000 5.073 4.975 5.145 . 0 0 "[ . 1]" 1
1206 1 40 ILE H 1 41 THR H 4.000 . 6.000 4.282 4.168 4.360 . 0 0 "[ . 1]" 1
1207 2 40 ILE H 2 41 THR H 4.000 . 6.000 4.284 4.174 4.323 . 0 0 "[ . 1]" 1
1208 1 37 ASN HB3 1 40 ILE H 3.300 . 4.700 2.810 2.151 3.479 . 0 0 "[ . 1]" 1
1209 2 37 ASN HB3 2 40 ILE H 3.300 . 4.700 2.941 2.036 3.923 . 0 0 "[ . 1]" 1
1210 1 40 ILE H 1 40 ILE HB 2.200 . 2.800 2.582 2.478 2.740 . 0 0 "[ . 1]" 1
1211 2 40 ILE H 2 40 ILE HB 2.200 . 2.800 2.573 2.454 2.754 . 0 0 "[ . 1]" 1
1212 1 107 PHE H 1 107 PHE HB3 3.500 . 5.100 3.454 3.380 3.556 . 0 0 "[ . 1]" 1
1213 2 107 PHE H 2 107 PHE HB3 3.500 . 5.100 3.449 3.410 3.504 . 0 0 "[ . 1]" 1
1214 1 79 LEU HG 1 80 ASP H 3.500 . 5.000 4.557 4.242 4.942 . 0 0 "[ . 1]" 1
1215 2 79 LEU HG 2 80 ASP H 3.500 . 5.000 4.787 4.511 4.906 . 0 0 "[ . 1]" 1
1216 1 79 LEU MD2 1 80 ASP H 3.300 . 4.700 2.955 2.258 3.446 . 0 0 "[ . 1]" 1
1217 2 79 LEU MD2 2 80 ASP H 3.300 . 4.700 3.403 2.911 3.739 . 0 0 "[ . 1]" 1
1218 1 80 ASP H 1 80 ASP HA 2.700 . 3.600 2.932 2.919 2.943 . 0 0 "[ . 1]" 1
1219 2 80 ASP H 2 80 ASP HA 2.700 . 3.600 2.936 2.919 2.944 . 0 0 "[ . 1]" 1
1220 1 79 LEU HA 1 80 ASP H 2.100 . 2.600 2.226 2.099 2.285 . 0 0 "[ . 1]" 1
1221 2 79 LEU HA 2 80 ASP H 2.100 . 2.600 2.241 2.171 2.330 . 0 0 "[ . 1]" 1
1222 1 80 ASP H 1 80 ASP HB3 3.200 . 4.500 2.949 2.355 3.673 . 0 0 "[ . 1]" 1
1223 2 80 ASP H 2 80 ASP HB3 3.200 . 4.500 2.921 2.369 3.756 . 0 0 "[ . 1]" 1
1224 1 80 ASP H 1 80 ASP HB2 2.500 . 3.300 3.058 2.562 3.711 0.411 4 0 "[ . 1]" 1
1225 2 80 ASP H 2 80 ASP HB2 2.500 . 3.300 2.974 2.615 3.642 0.342 4 0 "[ . 1]" 1
1226 1 5 GLU QB 1 6 LYS H 3.000 . 4.100 2.849 2.566 3.439 . 0 0 "[ . 1]" 1
1227 2 5 GLU QB 2 6 LYS H 3.000 . 4.100 2.962 2.724 3.528 . 0 0 "[ . 1]" 1
1228 1 6 LYS H 1 6 LYS QB 2.300 . 3.000 2.369 1.992 2.591 . 0 0 "[ . 1]" 1
1229 2 6 LYS H 2 6 LYS QB 2.300 . 3.000 2.377 2.026 2.613 . 0 0 "[ . 1]" 1
1230 1 6 LYS H 1 6 LYS QD 4.300 . 6.000 3.980 3.074 4.653 . 0 0 "[ . 1]" 1
1231 2 6 LYS H 2 6 LYS QD 4.300 . 6.000 3.816 3.240 4.687 . 0 0 "[ . 1]" 1
1232 1 6 LYS H 1 6 LYS HG3 3.800 . 5.600 3.344 2.819 3.896 . 0 0 "[ . 1]" 1
1233 2 6 LYS H 2 6 LYS HG3 3.800 . 5.600 3.575 2.846 4.044 . 0 0 "[ . 1]" 1
1234 1 6 LYS H 1 6 LYS HG2 2.900 . 4.000 2.584 1.997 4.015 0.015 2 0 "[ . 1]" 1
1235 2 6 LYS H 2 6 LYS HG2 2.900 . 4.000 2.538 1.847 4.082 0.082 2 0 "[ . 1]" 1
1236 1 3 MET HA 1 6 LYS H 3.400 . 4.800 3.245 3.013 3.633 . 0 0 "[ . 1]" 1
1237 2 3 MET HA 2 6 LYS H 3.400 . 4.800 3.153 2.841 3.430 . 0 0 "[ . 1]" 1
1238 1 128 LEU H 1 128 LEU QD . . 5.400 3.515 3.140 3.736 . 0 0 "[ . 1]" 1
1239 1 107 PHE HB2 1 108 LYS H 4.400 . 6.000 4.147 3.676 4.460 . 0 0 "[ . 1]" 1
1240 2 107 PHE HB2 2 108 LYS H 4.400 . 6.000 4.218 4.038 4.405 . 0 0 "[ . 1]" 1
1241 1 81 PRO HB2 1 108 LYS H 4.000 . 6.000 4.761 4.157 5.332 . 0 0 "[ . 1]" 1
1242 2 81 PRO HB2 2 108 LYS H 4.000 . 6.000 4.833 4.110 5.371 . 0 0 "[ . 1]" 1
1243 1 45 VAL HA 1 46 ARG H 3.200 . 4.500 2.148 2.114 2.178 . 0 0 "[ . 1]" 1
1244 2 45 VAL HA 2 46 ARG H 3.200 . 4.500 2.152 2.088 2.176 . 0 0 "[ . 1]" 1
1245 1 5 GLU HG2 1 6 LYS H 4.600 . 6.000 4.442 2.646 5.331 . 0 0 "[ . 1]" 1
1246 2 5 GLU HG2 2 6 LYS H 4.600 . 6.000 4.501 2.924 5.218 . 0 0 "[ . 1]" 1
1247 1 104 GLU H 1 105 TYR QD 3.800 . 5.600 4.810 4.604 4.962 . 0 0 "[ . 1]" 1
1248 2 104 GLU H 2 105 TYR QD 3.800 . 5.600 4.824 4.639 4.964 . 0 0 "[ . 1]" 1
1249 1 104 GLU H 1 104 GLU HA 2.500 . 3.300 2.864 2.837 2.889 . 0 0 "[ . 1]" 1
1250 2 104 GLU H 2 104 GLU HA 2.500 . 3.300 2.858 2.838 2.878 . 0 0 "[ . 1]" 1
1251 1 104 GLU H 1 104 GLU HG2 3.000 . 4.100 3.706 2.237 4.618 0.518 6 1 "[ .+ 1]" 1
1252 2 104 GLU H 2 104 GLU HG2 3.000 . 4.100 3.617 2.007 4.589 0.489 4 0 "[ . 1]" 1
1253 1 104 GLU H 1 104 GLU HB2 2.200 . 2.800 2.236 2.077 2.718 . 0 0 "[ . 1]" 1
1254 2 104 GLU H 2 104 GLU HB2 2.200 . 2.800 2.277 2.069 2.757 . 0 0 "[ . 1]" 1
1255 1 103 ARG HB2 1 104 GLU H 3.400 . 4.800 3.896 3.654 4.044 . 0 0 "[ . 1]" 1
1256 2 103 ARG HB2 2 104 GLU H 3.400 . 4.800 3.874 3.756 4.001 . 0 0 "[ . 1]" 1
1257 1 103 ARG HG3 1 104 GLU H 3.100 . 4.300 2.274 2.011 2.576 . 0 0 "[ . 1]" 1
1258 2 103 ARG HG3 2 104 GLU H 3.100 . 4.300 2.265 2.033 2.526 . 0 0 "[ . 1]" 1
1259 1 103 ARG H 1 104 GLU H 2.300 . 3.000 2.539 2.455 2.607 . 0 0 "[ . 1]" 1
1260 2 103 ARG H 2 104 GLU H 2.300 . 3.000 2.556 2.509 2.595 . 0 0 "[ . 1]" 1
1261 1 103 ARG HA 1 104 GLU H 3.300 . 4.700 3.456 3.437 3.492 . 0 0 "[ . 1]" 1
1262 2 103 ARG HA 2 104 GLU H 3.300 . 4.700 3.447 3.431 3.472 . 0 0 "[ . 1]" 1
1263 1 104 GLU H 1 104 GLU HB3 3.300 . 4.700 3.372 2.929 3.634 . 0 0 "[ . 1]" 1
1264 2 104 GLU H 2 104 GLU HB3 3.300 . 4.700 3.423 2.923 3.623 . 0 0 "[ . 1]" 1
1265 1 104 GLU H 1 104 GLU HG3 3.200 . 4.500 3.362 2.442 4.143 . 0 0 "[ . 1]" 1
1266 2 104 GLU H 2 104 GLU HG3 3.200 . 4.500 3.219 2.396 4.086 . 0 0 "[ . 1]" 1
1267 1 88 PHE H 1 88 PHE HB3 3.000 . 4.100 2.774 2.525 2.905 . 0 0 "[ . 1]" 1
1268 2 88 PHE H 2 88 PHE HB3 3.000 . 4.100 2.745 2.481 2.885 . 0 0 "[ . 1]" 1
1269 1 88 PHE H 1 88 PHE HB2 3.100 . 4.300 2.711 2.538 2.988 . 0 0 "[ . 1]" 1
1270 2 88 PHE H 2 88 PHE HB2 3.100 . 4.300 2.668 2.275 2.890 . 0 0 "[ . 1]" 1
1271 1 87 VAL H 1 88 PHE H 3.700 . 5.400 4.452 4.376 4.506 . 0 0 "[ . 1]" 1
1272 2 87 VAL H 2 88 PHE H 3.700 . 5.400 4.419 4.327 4.563 . 0 0 "[ . 1]" 1
1273 1 88 PHE H 1 88 PHE HA 2.900 . 4.000 2.939 2.915 2.950 . 0 0 "[ . 1]" 1
1274 2 88 PHE H 2 88 PHE HA 2.900 . 4.000 2.930 2.874 2.949 . 0 0 "[ . 1]" 1
1275 1 87 VAL HA 1 88 PHE H 2.300 . 2.900 2.176 2.124 2.260 . 0 0 "[ . 1]" 1
1276 2 87 VAL HA 2 88 PHE H 2.300 . 2.900 2.168 2.106 2.417 . 0 0 "[ . 1]" 1
1277 1 85 VAL HB 1 86 VAL H 2.300 . 3.000 2.711 2.542 2.851 . 0 0 "[ . 1]" 1
1278 2 85 VAL HB 2 86 VAL H 2.300 . 3.000 2.722 2.482 2.974 . 0 0 "[ . 1]" 1
1279 1 86 VAL H 1 86 VAL HB 2.700 . 3.600 3.360 3.295 3.426 . 0 0 "[ . 1]" 1
1280 2 86 VAL H 2 86 VAL HB 2.700 . 3.600 3.360 3.311 3.443 . 0 0 "[ . 1]" 1
1281 1 40 ILE MG 1 86 VAL H 3.100 . 4.300 3.594 3.057 3.810 . 0 0 "[ . 1]" 1
1282 2 40 ILE MG 2 86 VAL H 3.100 . 4.300 3.588 3.389 3.918 . 0 0 "[ . 1]" 1
1283 1 86 VAL H 1 87 VAL H 3.300 . 4.700 4.377 4.347 4.401 . 0 0 "[ . 1]" 1
1284 2 86 VAL H 2 87 VAL H 3.300 . 4.700 4.375 4.364 4.393 . 0 0 "[ . 1]" 1
1285 1 85 VAL HA 1 86 VAL H 2.400 . 3.100 2.262 2.210 2.301 . 0 0 "[ . 1]" 1
1286 2 85 VAL HA 2 86 VAL H 2.400 . 3.100 2.277 2.210 2.331 . 0 0 "[ . 1]" 1
1287 1 58 ASP HB2 1 128 LEU H 3.200 . 4.500 3.266 2.940 3.807 . 0 0 "[ . 1]" 1
1288 2 58 ASP HB2 2 128 LEU H 3.200 . 4.500 3.180 2.711 3.825 . 0 0 "[ . 1]" 1
1289 1 128 LEU H 1 128 LEU HB2 2.400 . 3.100 2.336 2.208 2.684 . 0 0 "[ . 1]" 1
1290 2 128 LEU H 2 128 LEU HB2 2.400 . 3.100 2.341 2.157 2.559 . 0 0 "[ . 1]" 1
1291 1 56 LYS HG2 1 128 LEU H 5.300 . 6.000 4.187 2.681 5.367 . 0 0 "[ . 1]" 1
1292 2 56 LYS HG2 2 128 LEU H 5.300 . 6.000 4.162 2.835 5.517 . 0 0 "[ . 1]" 1
1293 1 127 SER HA 1 128 LEU H 2.400 . 3.100 2.286 2.255 2.336 . 0 0 "[ . 1]" 1
1294 2 127 SER HA 2 128 LEU H 2.400 . 3.100 2.279 2.210 2.343 . 0 0 "[ . 1]" 1
1295 1 128 LEU H 1 128 LEU HA 2.900 . 4.000 2.936 2.926 2.946 . 0 0 "[ . 1]" 1
1296 2 128 LEU H 2 128 LEU HA 2.900 . 4.000 2.925 2.874 2.948 . 0 0 "[ . 1]" 1
1297 1 57 PRO HA 1 128 LEU H 4.100 . 6.000 3.916 3.668 4.134 . 0 0 "[ . 1]" 1
1298 2 57 PRO HA 2 128 LEU H 4.100 . 6.000 3.985 3.605 4.244 . 0 0 "[ . 1]" 1
1299 1 127 SER QB 1 128 LEU H 2.600 . 3.500 2.781 2.559 2.896 . 0 0 "[ . 1]" 1
1300 2 127 SER QB 2 128 LEU H 2.600 . 3.500 2.841 2.681 2.984 . 0 0 "[ . 1]" 1
1301 1 87 VAL H 1 87 VAL HB 3.900 . 5.800 3.683 3.641 3.708 . 0 0 "[ . 1]" 1
1302 2 87 VAL H 2 87 VAL HB 3.900 . 5.800 3.677 3.624 3.711 . 0 0 "[ . 1]" 1
1303 1 86 VAL HA 1 87 VAL H 2.100 . 2.700 2.232 2.184 2.267 . 0 0 "[ . 1]" 1
1304 2 86 VAL HA 2 87 VAL H 2.100 . 2.700 2.222 2.186 2.250 . 0 0 "[ . 1]" 1
1305 1 108 LYS H 1 108 LYS QB 2.100 . 2.700 2.155 2.032 2.552 . 0 0 "[ . 1]" 1
1306 2 108 LYS H 2 108 LYS QB 2.100 . 2.700 2.098 2.014 2.207 . 0 0 "[ . 1]" 1
1307 1 107 PHE H 1 108 LYS H 4.300 . 6.000 4.520 4.371 4.587 . 0 0 "[ . 1]" 1
1308 2 107 PHE H 2 108 LYS H 4.300 . 6.000 4.545 4.464 4.602 . 0 0 "[ . 1]" 1
1309 1 108 LYS H 1 108 LYS HG3 3.600 . 5.200 3.362 1.985 4.027 0.015 3 0 "[ . 1]" 1
1310 2 108 LYS H 2 108 LYS HG3 3.600 . 5.200 3.766 3.100 4.384 . 0 0 "[ . 1]" 1
1311 1 108 LYS H 1 108 LYS HG2 4.000 . 6.000 3.973 3.108 4.524 . 0 0 "[ . 1]" 1
1312 2 108 LYS H 2 108 LYS HG2 4.000 . 6.000 4.167 3.447 4.492 . 0 0 "[ . 1]" 1
1313 1 108 LYS H 1 110 ILE MD 3.900 . 5.800 5.573 5.103 5.833 0.033 1 0 "[ . 1]" 1
1314 2 108 LYS H 2 110 ILE MD 3.900 . 5.800 5.626 5.394 5.806 0.006 9 0 "[ . 1]" 1
1315 1 107 PHE HA 1 108 LYS H 2.300 . 3.000 2.272 2.080 2.609 . 0 0 "[ . 1]" 1
1316 2 107 PHE HA 2 108 LYS H 2.300 . 3.000 2.218 2.093 2.339 . 0 0 "[ . 1]" 1
1317 1 108 LYS H 1 108 LYS HA 2.900 . 3.900 2.805 2.737 2.894 . 0 0 "[ . 1]" 1
1318 2 108 LYS H 2 108 LYS HA 2.900 . 3.900 2.780 2.736 2.838 . 0 0 "[ . 1]" 1
1319 1 81 PRO HA 1 108 LYS H 4.400 . 6.000 3.935 3.542 4.408 . 0 0 "[ . 1]" 1
1320 2 81 PRO HA 2 108 LYS H 4.400 . 6.000 3.919 3.366 4.864 . 0 0 "[ . 1]" 1
1321 1 45 VAL HB 1 46 ARG H 4.200 . 6.000 3.968 3.876 4.201 . 0 0 "[ . 1]" 1
1322 2 45 VAL HB 2 46 ARG H 4.200 . 6.000 4.021 3.770 4.204 . 0 0 "[ . 1]" 1
1323 1 46 ARG H 1 47 ASP H 4.100 . 6.000 4.317 4.260 4.367 . 0 0 "[ . 1]" 1
1324 2 46 ARG H 2 47 ASP H 4.100 . 6.000 4.330 4.180 4.380 . 0 0 "[ . 1]" 1
1325 1 45 VAL MG2 1 46 ARG H 4.300 . 6.000 4.399 4.330 4.467 . 0 0 "[ . 1]" 1
1326 2 45 VAL MG2 2 46 ARG H 4.300 . 6.000 4.384 4.184 4.457 . 0 0 "[ . 1]" 1
1327 1 44 ASP HA 1 46 ARG H 4.200 . 6.000 5.314 5.195 5.472 . 0 0 "[ . 1]" 1
1328 2 44 ASP HA 2 46 ARG H 4.200 . 6.000 5.307 5.203 5.412 . 0 0 "[ . 1]" 1
1329 1 46 ARG H 1 46 ARG HA 2.800 . 3.800 2.892 2.869 2.917 . 0 0 "[ . 1]" 1
1330 2 46 ARG H 2 46 ARG HA 2.800 . 3.800 2.891 2.850 2.910 . 0 0 "[ . 1]" 1
1331 1 45 VAL MG1 1 46 ARG H 5.200 . 6.000 3.667 3.301 3.954 . 0 0 "[ . 1]" 1
1332 2 45 VAL MG1 2 46 ARG H 5.200 . 6.000 3.596 3.260 4.017 . 0 0 "[ . 1]" 1
1333 1 45 VAL H 1 46 ARG H 3.300 . 4.600 3.889 3.760 4.004 . 0 0 "[ . 1]" 1
1334 2 45 VAL H 2 46 ARG H 3.300 . 4.600 3.889 3.737 3.968 . 0 0 "[ . 1]" 1
1335 1 13 ALA H 1 14 GLN HG2 4.700 . 6.000 5.839 5.240 6.058 0.058 3 0 "[ . 1]" 1
1336 2 13 ALA H 2 14 GLN HG2 4.700 . 6.000 5.324 4.278 6.025 0.025 2 0 "[ . 1]" 1
1337 1 12 LYS HB3 1 13 ALA H 2.600 . 3.400 3.009 2.870 3.235 . 0 0 "[ . 1]" 1
1338 2 12 LYS HB3 2 13 ALA H 2.600 . 3.400 3.076 2.965 3.330 . 0 0 "[ . 1]" 1
1339 1 13 ALA H 1 13 ALA MB 2.200 . 2.800 2.214 2.070 2.269 . 0 0 "[ . 1]" 1
1340 2 13 ALA H 2 13 ALA MB 2.200 . 2.800 2.211 2.089 2.260 . 0 0 "[ . 1]" 1
1341 1 11 PHE HA 1 13 ALA H 4.000 . 6.000 4.030 3.924 4.109 . 0 0 "[ . 1]" 1
1342 2 11 PHE HA 2 13 ALA H 4.000 . 6.000 4.017 3.942 4.095 . 0 0 "[ . 1]" 1
1343 1 10 THR HB 1 13 ALA H 4.200 . 6.000 4.995 4.901 5.074 . 0 0 "[ . 1]" 1
1344 2 10 THR HB 2 13 ALA H 4.200 . 6.000 5.020 4.950 5.084 . 0 0 "[ . 1]" 1
1345 1 12 LYS H 1 13 ALA H 2.600 . 3.400 2.567 2.527 2.613 . 0 0 "[ . 1]" 1
1346 2 12 LYS H 2 13 ALA H 2.600 . 3.400 2.574 2.504 2.634 . 0 0 "[ . 1]" 1
1347 1 13 ALA H 1 13 ALA HA 2.500 . 3.300 2.866 2.854 2.880 . 0 0 "[ . 1]" 1
1348 2 13 ALA H 2 13 ALA HA 2.500 . 3.300 2.872 2.866 2.876 . 0 0 "[ . 1]" 1
1349 1 13 ALA H 1 14 GLN HA 4.400 . 6.000 5.153 5.125 5.182 . 0 0 "[ . 1]" 1
1350 2 13 ALA H 2 14 GLN HA 4.400 . 6.000 5.156 5.132 5.177 . 0 0 "[ . 1]" 1
1351 1 10 THR HA 1 13 ALA H 3.100 . 4.300 3.215 3.138 3.330 . 0 0 "[ . 1]" 1
1352 2 10 THR HA 2 13 ALA H 3.100 . 4.300 3.260 3.146 3.413 . 0 0 "[ . 1]" 1
1353 1 13 ALA H 1 14 GLN HG3 4.400 . 6.000 5.037 4.649 5.488 . 0 0 "[ . 1]" 1
1354 2 13 ALA H 2 14 GLN HG3 4.400 . 6.000 4.993 4.196 5.739 . 0 0 "[ . 1]" 1
1355 1 13 ALA H 1 14 GLN HB3 6.000 . 6.000 5.959 5.838 6.026 0.026 8 0 "[ . 1]" 1
1356 2 13 ALA H 2 14 GLN HB3 6.000 . 6.000 5.995 5.847 6.075 0.075 10 0 "[ . 1]" 1
1357 1 13 ALA H 1 14 GLN HB2 4.100 . 6.000 4.481 4.374 4.562 . 0 0 "[ . 1]" 1
1358 2 13 ALA H 2 14 GLN HB2 4.100 . 6.000 4.571 4.359 4.749 . 0 0 "[ . 1]" 1
1359 1 12 LYS HB2 1 13 ALA H 3.000 . 4.200 3.737 3.448 3.935 . 0 0 "[ . 1]" 1
1360 2 12 LYS HB2 2 13 ALA H 3.000 . 4.200 3.790 3.250 4.138 . 0 0 "[ . 1]" 1
1361 1 12 LYS HA 1 13 ALA H 3.100 . 4.300 3.467 3.446 3.487 . 0 0 "[ . 1]" 1
1362 2 12 LYS HA 2 13 ALA H 3.100 . 4.300 3.458 3.427 3.472 . 0 0 "[ . 1]" 1
1363 1 13 ALA H 1 14 GLN H 2.500 . 3.300 2.503 2.481 2.538 . 0 0 "[ . 1]" 1
1364 2 13 ALA H 2 14 GLN H 2.500 . 3.300 2.503 2.470 2.534 . 0 0 "[ . 1]" 1
1365 1 14 GLN HB3 1 15 VAL H 3.200 . 4.500 3.164 2.977 3.312 . 0 0 "[ . 1]" 1
1366 2 14 GLN HB3 2 15 VAL H 3.200 . 4.500 3.293 2.956 3.505 . 0 0 "[ . 1]" 1
1367 1 14 GLN HG2 1 15 VAL H 5.400 . 6.000 4.813 4.662 4.923 . 0 0 "[ . 1]" 1
1368 2 14 GLN HG2 2 15 VAL H 5.400 . 6.000 4.636 4.240 4.819 . 0 0 "[ . 1]" 1
1369 1 14 GLN HB2 1 15 VAL H 2.800 . 3.800 2.569 2.414 2.726 . 0 0 "[ . 1]" 1
1370 2 14 GLN HB2 2 15 VAL H 2.800 . 3.800 2.457 2.327 2.738 . 0 0 "[ . 1]" 1
1371 1 15 VAL H 1 16 LYS QB 3.900 . 5.800 4.506 4.406 4.595 . 0 0 "[ . 1]" 1
1372 2 15 VAL H 2 16 LYS QB 3.900 . 5.800 4.467 4.355 4.605 . 0 0 "[ . 1]" 1
1373 1 15 VAL H 1 15 VAL HB 2.300 . 3.000 2.225 2.074 2.368 . 0 0 "[ . 1]" 1
1374 2 15 VAL H 2 15 VAL HB 2.300 . 3.000 2.105 2.060 2.189 . 0 0 "[ . 1]" 1
1375 1 12 LYS QD 1 15 VAL H 4.100 . 6.000 5.614 4.653 6.075 0.075 2 0 "[ . 1]" 1
1376 2 12 LYS QD 2 15 VAL H 4.100 . 6.000 5.363 4.392 6.027 0.027 1 0 "[ . 1]" 1
1377 1 13 ALA MB 1 15 VAL H 4.300 . 6.000 4.660 4.606 4.702 . 0 0 "[ . 1]" 1
1378 2 13 ALA MB 2 15 VAL H 4.300 . 6.000 4.613 4.537 4.699 . 0 0 "[ . 1]" 1
1379 1 15 VAL H 1 15 VAL MG1 3.600 . 5.200 3.604 3.278 3.731 . 0 0 "[ . 1]" 1
1380 2 15 VAL H 2 15 VAL MG1 3.600 . 5.200 3.385 3.183 3.617 . 0 0 "[ . 1]" 1
1381 1 15 VAL H 1 15 VAL MG2 2.900 . 4.000 2.725 2.419 3.270 . 0 0 "[ . 1]" 1
1382 2 15 VAL H 2 15 VAL MG2 2.900 . 4.000 3.122 2.821 3.348 . 0 0 "[ . 1]" 1
1383 1 14 GLN HA 1 15 VAL H 3.500 . 5.000 3.551 3.540 3.564 . 0 0 "[ . 1]" 1
1384 2 14 GLN HA 2 15 VAL H 3.500 . 5.000 3.541 3.528 3.560 . 0 0 "[ . 1]" 1
1385 1 12 LYS HA 1 15 VAL H 3.400 . 4.800 3.800 3.441 4.168 . 0 0 "[ . 1]" 1
1386 2 12 LYS HA 2 15 VAL H 3.400 . 4.800 3.746 3.414 3.937 . 0 0 "[ . 1]" 1
1387 1 15 VAL H 1 15 VAL HA 3.000 . 4.100 2.791 2.781 2.802 . 0 0 "[ . 1]" 1
1388 2 15 VAL H 2 15 VAL HA 3.000 . 4.100 2.785 2.762 2.806 . 0 0 "[ . 1]" 1
1389 1 14 GLN HG3 1 15 VAL H 5.100 . 6.000 4.602 4.415 4.810 . 0 0 "[ . 1]" 1
1390 2 14 GLN HG3 2 15 VAL H 5.100 . 6.000 4.462 4.067 4.834 . 0 0 "[ . 1]" 1
1391 1 14 GLN H 1 15 VAL H 2.500 . 3.300 2.632 2.555 2.733 . 0 0 "[ . 1]" 1
1392 2 14 GLN H 2 15 VAL H 2.500 . 3.300 2.625 2.536 2.690 . 0 0 "[ . 1]" 1
1393 1 13 ALA H 1 15 VAL H 4.100 . 6.000 4.136 4.034 4.258 . 0 0 "[ . 1]" 1
1394 2 13 ALA H 2 15 VAL H 4.100 . 6.000 4.069 3.985 4.134 . 0 0 "[ . 1]" 1
1395 1 59 VAL HB 1 60 LYS H 2.700 . 3.600 2.564 2.262 2.922 . 0 0 "[ . 1]" 1
1396 2 59 VAL HB 2 60 LYS H 2.700 . 3.600 2.510 2.314 2.754 . 0 0 "[ . 1]" 1
1397 1 60 LYS H 1 60 LYS QB 2.400 . 3.100 2.705 2.091 2.926 . 0 0 "[ . 1]" 1
1398 2 60 LYS H 2 60 LYS QB 2.400 . 3.100 2.683 2.267 3.005 . 0 0 "[ . 1]" 1
1399 1 60 LYS H 1 60 LYS QD 3.800 . 5.600 3.267 2.269 3.925 . 0 0 "[ . 1]" 1
1400 2 60 LYS H 2 60 LYS QD 3.800 . 5.600 2.641 2.147 3.683 . 0 0 "[ . 1]" 1
1401 1 60 LYS H 1 60 LYS HG3 3.700 . 5.400 2.131 1.795 3.535 0.205 7 0 "[ . 1]" 1
1402 2 60 LYS H 2 60 LYS HG3 3.700 . 5.400 2.114 1.721 3.001 0.279 5 0 "[ . 1]" 1
1403 1 60 LYS H 1 60 LYS HG2 4.700 . 6.000 2.883 2.081 4.360 . 0 0 "[ . 1]" 1
1404 2 60 LYS H 2 60 LYS HG2 4.700 . 6.000 3.414 1.861 4.114 0.039 10 0 "[ . 1]" 1
1405 1 59 VAL MG1 1 60 LYS H 4.100 . 6.000 3.673 3.015 3.905 . 0 0 "[ . 1]" 1
1406 2 59 VAL MG1 2 60 LYS H 4.100 . 6.000 3.753 3.141 4.070 . 0 0 "[ . 1]" 1
1407 1 59 VAL MG2 1 60 LYS H 3.600 . 5.200 3.422 2.899 4.125 . 0 0 "[ . 1]" 1
1408 2 59 VAL MG2 2 60 LYS H 3.600 . 5.200 3.207 2.841 4.031 . 0 0 "[ . 1]" 1
1409 1 59 VAL HA 1 60 LYS H 2.500 . 3.300 2.354 2.215 2.546 . 0 0 "[ . 1]" 1
1410 2 59 VAL HA 2 60 LYS H 2.500 . 3.300 2.412 2.298 2.509 . 0 0 "[ . 1]" 1
1411 1 60 LYS H 1 60 LYS HA 2.800 . 3.800 2.790 2.752 2.884 . 0 0 "[ . 1]" 1
1412 2 60 LYS H 2 60 LYS HA 2.800 . 3.800 2.806 2.737 2.865 . 0 0 "[ . 1]" 1
1413 1 41 THR HA 1 86 VAL H 3.800 . 5.600 5.194 5.022 5.344 . 0 0 "[ . 1]" 1
1414 2 41 THR HA 2 86 VAL H 3.800 . 5.600 5.188 5.079 5.301 . 0 0 "[ . 1]" 1
1415 1 128 LEU H 1 129 ASP H 4.500 . 6.000 4.141 4.060 4.404 . 0 0 "[ . 1]" 1
1416 2 128 LEU H 2 129 ASP H 4.500 . 6.000 4.121 4.042 4.222 . 0 0 "[ . 1]" 1
1417 1 103 ARG H 1 103 ARG HB3 2.500 . 3.300 2.702 2.488 2.978 . 0 0 "[ . 1]" 1
1418 2 103 ARG H 2 103 ARG HB3 2.500 . 3.300 2.736 2.492 2.991 . 0 0 "[ . 1]" 1
1419 1 103 ARG H 1 103 ARG HB2 3.100 . 4.300 3.605 3.555 3.633 . 0 0 "[ . 1]" 1
1420 2 103 ARG H 2 103 ARG HB2 3.100 . 4.300 3.611 3.583 3.623 . 0 0 "[ . 1]" 1
1421 1 103 ARG H 1 103 ARG HG3 2.500 . 3.300 2.548 2.134 3.322 0.022 2 0 "[ . 1]" 1
1422 2 103 ARG H 2 103 ARG HG3 2.500 . 3.300 2.331 1.887 2.891 . 0 0 "[ . 1]" 1
1423 1 103 ARG H 1 103 ARG HG2 2.500 . 3.300 2.525 2.237 2.999 . 0 0 "[ . 1]" 1
1424 2 103 ARG H 2 103 ARG HG2 2.500 . 3.300 2.661 2.296 3.216 . 0 0 "[ . 1]" 1
1425 1 102 LEU HG 1 103 ARG H 4.200 . 6.000 4.709 4.572 4.869 . 0 0 "[ . 1]" 1
1426 2 102 LEU HG 2 103 ARG H 4.200 . 6.000 4.790 4.560 5.014 . 0 0 "[ . 1]" 1
1427 1 102 LEU MD1 1 103 ARG H 4.800 . 6.000 4.645 4.582 4.734 . 0 0 "[ . 1]" 1
1428 2 102 LEU MD1 2 103 ARG H 4.800 . 6.000 4.627 4.476 4.807 . 0 0 "[ . 1]" 1
1429 1 102 LEU MD2 1 103 ARG H 4.900 . 6.000 4.579 4.510 4.641 . 0 0 "[ . 1]" 1
1430 2 102 LEU MD2 2 103 ARG H 4.900 . 6.000 4.543 4.453 4.624 . 0 0 "[ . 1]" 1
1431 1 103 ARG H 1 107 PHE QD 4.300 . 6.000 4.967 4.755 5.169 . 0 0 "[ . 1]" 1
1432 2 103 ARG H 2 107 PHE QD 4.300 . 6.000 4.972 4.658 5.347 . 0 0 "[ . 1]" 1
1433 1 103 ARG H 1 103 ARG HA 2.600 . 3.400 2.840 2.818 2.868 . 0 0 "[ . 1]" 1
1434 2 103 ARG H 2 103 ARG HA 2.600 . 3.400 2.834 2.819 2.843 . 0 0 "[ . 1]" 1
1435 1 102 LEU HA 1 103 ARG H 3.900 . 5.800 3.557 3.538 3.574 . 0 0 "[ . 1]" 1
1436 2 102 LEU HA 2 103 ARG H 3.900 . 5.800 3.563 3.544 3.576 . 0 0 "[ . 1]" 1
1437 1 102 LEU H 1 103 ARG H 2.800 . 3.800 2.767 2.656 2.903 . 0 0 "[ . 1]" 1
1438 2 102 LEU H 2 103 ARG H 2.800 . 3.800 2.759 2.687 2.907 . 0 0 "[ . 1]" 1
1439 1 73 LEU HB3 1 74 LEU H 3.200 . 4.500 3.461 3.295 3.578 . 0 0 "[ . 1]" 1
1440 2 73 LEU HB3 2 74 LEU H 3.200 . 4.500 3.437 3.201 3.768 . 0 0 "[ . 1]" 1
1441 1 73 LEU HB2 1 74 LEU H 4.300 . 6.000 3.435 3.195 3.599 . 0 0 "[ . 1]" 1
1442 2 73 LEU HB2 2 74 LEU H 4.300 . 6.000 3.558 3.314 3.939 . 0 0 "[ . 1]" 1
1443 1 74 LEU H 1 74 LEU HB2 2.800 . 3.800 2.515 2.032 3.195 . 0 0 "[ . 1]" 1
1444 2 74 LEU H 2 74 LEU HB3 2.800 . 3.800 2.739 2.447 3.036 . 0 0 "[ . 1]" 1
1445 1 74 LEU H 1 74 LEU MD1 3.900 . 5.800 3.895 3.189 4.436 . 0 0 "[ . 1]" 1
1446 2 74 LEU H 2 74 LEU MD1 3.900 . 5.800 3.697 3.174 4.081 . 0 0 "[ . 1]" 1
1447 1 73 LEU HA 1 74 LEU H 2.900 . 4.000 3.413 3.375 3.486 . 0 0 "[ . 1]" 1
1448 2 73 LEU HA 2 74 LEU H 2.900 . 4.000 3.381 3.221 3.430 . 0 0 "[ . 1]" 1
1449 1 74 LEU H 1 74 LEU HA 2.600 . 3.400 2.801 2.758 2.854 . 0 0 "[ . 1]" 1
1450 2 74 LEU H 2 74 LEU HA 2.600 . 3.400 2.797 2.762 2.840 . 0 0 "[ . 1]" 1
1451 1 97 LEU MD1 1 98 ALA H 4.800 . 6.000 4.631 4.535 4.702 . 0 0 "[ . 1]" 1
1452 2 97 LEU MD1 2 98 ALA H 4.800 . 6.000 4.597 4.481 4.647 . 0 0 "[ . 1]" 1
1453 1 125 LEU H 1 125 LEU QB 3.400 . 4.900 2.361 2.266 2.542 . 0 0 "[ . 1]" 1
1454 2 125 LEU H 2 125 LEU QB 3.400 . 4.900 2.385 2.282 2.464 . 0 0 "[ . 1]" 1
1455 1 123 GLU HB3 1 125 LEU H 3.900 . 5.800 3.750 2.924 4.605 . 0 0 "[ . 1]" 1
1456 2 123 GLU HB3 2 125 LEU H 3.900 . 5.800 3.886 3.023 4.550 . 0 0 "[ . 1]" 1
1457 1 125 LEU H 1 126 PRO HD2 4.700 . 6.000 4.679 4.640 4.786 . 0 0 "[ . 1]" 1
1458 2 125 LEU H 2 126 PRO HD2 4.700 . 6.000 4.701 4.647 4.754 . 0 0 "[ . 1]" 1
1459 1 123 GLU HB2 1 125 LEU H 4.400 . 6.000 3.736 3.204 4.292 . 0 0 "[ . 1]" 1
1460 2 123 GLU HB2 2 125 LEU H 4.400 . 6.000 3.658 3.038 4.408 . 0 0 "[ . 1]" 1
1461 1 125 LEU H 1 125 LEU HG 2.500 . 3.300 2.506 2.108 2.855 . 0 0 "[ . 1]" 1
1462 2 125 LEU H 2 125 LEU HG 2.500 . 3.300 2.440 2.258 2.601 . 0 0 "[ . 1]" 1
1463 1 125 LEU H 1 125 LEU MD1 3.100 . 4.300 3.688 3.487 3.985 . 0 0 "[ . 1]" 1
1464 2 125 LEU H 2 125 LEU MD1 3.100 . 4.300 3.666 3.495 3.832 . 0 0 "[ . 1]" 1
1465 1 120 TRP HD1 1 125 LEU H 4.200 . 6.000 4.818 4.612 5.085 . 0 0 "[ . 1]" 1
1466 2 120 TRP HD1 2 125 LEU H 4.200 . 6.000 4.819 4.690 5.123 . 0 0 "[ . 1]" 1
1467 1 123 GLU HA 1 125 LEU H 3.700 . 5.400 4.705 4.589 4.919 . 0 0 "[ . 1]" 1
1468 2 123 GLU HA 2 125 LEU H 3.700 . 5.400 4.695 4.589 4.796 . 0 0 "[ . 1]" 1
1469 1 124 GLY HA3 1 125 LEU H 2.800 . 3.800 3.461 3.410 3.489 . 0 0 "[ . 1]" 1
1470 2 124 GLY HA3 2 125 LEU H 2.800 . 3.800 3.464 3.441 3.488 . 0 0 "[ . 1]" 1
1471 1 125 LEU H 1 126 PRO HD3 4.600 . 6.000 5.299 5.124 5.366 . 0 0 "[ . 1]" 1
1472 2 125 LEU H 2 126 PRO HD3 4.600 . 6.000 5.283 5.214 5.345 . 0 0 "[ . 1]" 1
1473 1 120 TRP HE1 1 125 LEU H 4.800 . 6.000 5.562 5.293 5.933 . 0 0 "[ . 1]" 1
1474 2 120 TRP HE1 2 125 LEU H 4.800 . 6.000 5.561 5.308 5.828 . 0 0 "[ . 1]" 1
1475 1 97 LEU HB2 1 98 ALA H 3.400 . 4.800 3.072 3.003 3.108 . 0 0 "[ . 1]" 1
1476 2 97 LEU HB2 2 98 ALA H 3.400 . 4.800 3.126 2.946 3.229 . 0 0 "[ . 1]" 1
1477 1 98 ALA H 1 98 ALA MB 2.400 . 3.100 2.157 2.059 2.251 . 0 0 "[ . 1]" 1
1478 2 98 ALA H 2 98 ALA MB 2.400 . 3.100 2.178 2.047 2.250 . 0 0 "[ . 1]" 1
1479 1 98 ALA H 1 98 ALA HA 2.900 . 4.000 2.854 2.839 2.868 . 0 0 "[ . 1]" 1
1480 2 98 ALA H 2 98 ALA HA 2.900 . 4.000 2.853 2.838 2.874 . 0 0 "[ . 1]" 1
1481 1 98 ALA H 1 99 GLY H 2.000 . 2.500 2.537 2.513 2.587 0.087 2 0 "[ . 1]" 1
1482 2 98 ALA H 2 99 GLY H 2.000 . 2.500 2.525 2.490 2.548 0.048 9 0 "[ . 1]" 1
1483 1 95 ALA HA 1 98 ALA H 3.200 . 4.500 3.238 2.912 3.636 . 0 0 "[ . 1]" 1
1484 2 95 ALA HA 2 98 ALA H 3.200 . 4.500 3.208 2.874 3.614 . 0 0 "[ . 1]" 1
1485 1 98 ALA H 1 99 GLY QA 4.800 . 6.000 4.435 4.395 4.461 . 0 0 "[ . 1]" 1
1486 2 98 ALA H 2 99 GLY QA 4.800 . 6.000 4.429 4.405 4.443 . 0 0 "[ . 1]" 1
1487 1 97 LEU HB3 1 98 ALA H 2.900 . 3.900 3.336 3.214 3.444 . 0 0 "[ . 1]" 1
1488 2 97 LEU HB3 2 98 ALA H 2.900 . 3.900 3.331 3.107 3.468 . 0 0 "[ . 1]" 1
1489 1 97 LEU MD2 1 98 ALA H 3.800 . 5.600 4.294 4.229 4.393 . 0 0 "[ . 1]" 1
1490 2 97 LEU MD2 2 98 ALA H 3.800 . 5.600 4.323 4.257 4.386 . 0 0 "[ . 1]" 1
1491 1 97 LEU HA 1 98 ALA H 3.000 . 4.100 3.499 3.473 3.531 . 0 0 "[ . 1]" 1
1492 2 97 LEU HA 2 98 ALA H 3.000 . 4.100 3.492 3.459 3.527 . 0 0 "[ . 1]" 1
1493 1 46 ARG HA 1 47 ASP H 3.000 . 4.100 2.443 2.228 2.839 . 0 0 "[ . 1]" 1
1494 2 46 ARG HA 2 47 ASP H 3.000 . 4.100 2.381 2.190 2.593 . 0 0 "[ . 1]" 1
1495 1 47 ASP H 1 47 ASP HB3 3.700 . 5.400 3.462 2.724 3.866 . 0 0 "[ . 1]" 1
1496 2 47 ASP H 2 47 ASP HB3 3.700 . 5.400 2.891 2.045 3.583 . 0 0 "[ . 1]" 1
1497 1 47 ASP H 1 47 ASP HB2 3.300 . 4.600 2.487 2.221 2.773 . 0 0 "[ . 1]" 1
1498 2 47 ASP H 2 47 ASP HB2 3.300 . 4.600 2.790 2.101 3.639 . 0 0 "[ . 1]" 1
1499 1 58 ASP H 1 126 PRO HB2 3.800 . 5.600 3.196 3.032 3.308 . 0 0 "[ . 1]" 1
1500 2 58 ASP H 2 126 PRO HB2 3.800 . 5.600 3.208 2.992 3.364 . 0 0 "[ . 1]" 1
1501 1 58 ASP H 1 58 ASP HB2 2.900 . 4.000 2.864 2.622 3.226 . 0 0 "[ . 1]" 1
1502 2 58 ASP H 2 58 ASP HB2 2.900 . 4.000 2.896 2.713 3.058 . 0 0 "[ . 1]" 1
1503 1 57 PRO HB3 1 58 ASP H 4.100 . 6.000 3.781 3.450 3.998 . 0 0 "[ . 1]" 1
1504 2 57 PRO HB3 2 58 ASP H 4.100 . 6.000 3.842 3.623 3.957 . 0 0 "[ . 1]" 1
1505 1 57 PRO HB2 1 58 ASP H 3.600 . 5.200 3.590 3.355 3.792 . 0 0 "[ . 1]" 1
1506 2 57 PRO HB2 2 58 ASP H 3.600 . 5.200 3.663 3.438 3.932 . 0 0 "[ . 1]" 1
1507 1 58 ASP H 1 127 SER HA 2.700 . 3.600 2.342 2.101 2.837 . 0 0 "[ . 1]" 1
1508 2 58 ASP H 2 127 SER HA 2.700 . 3.600 2.299 1.899 2.706 . 0 0 "[ . 1]" 1
1509 1 58 ASP H 1 58 ASP HA 3.000 . 4.100 2.932 2.915 2.948 . 0 0 "[ . 1]" 1
1510 2 58 ASP H 2 58 ASP HA 3.000 . 4.100 2.934 2.922 2.946 . 0 0 "[ . 1]" 1
1511 1 57 PRO HA 1 58 ASP H 2.400 . 3.100 2.139 2.116 2.171 . 0 0 "[ . 1]" 1
1512 2 57 PRO HA 2 58 ASP H 2.400 . 3.100 2.135 2.120 2.151 . 0 0 "[ . 1]" 1
1513 1 58 ASP H 1 58 ASP HB3 2.600 . 3.400 2.544 2.430 2.718 . 0 0 "[ . 1]" 1
1514 2 58 ASP H 2 58 ASP HB3 2.600 . 3.400 2.507 2.404 2.627 . 0 0 "[ . 1]" 1
1515 1 58 ASP H 1 126 PRO HB3 5.500 . 6.000 4.901 4.750 5.029 . 0 0 "[ . 1]" 1
1516 2 58 ASP H 2 126 PRO HB3 5.500 . 6.000 4.905 4.697 5.092 . 0 0 "[ . 1]" 1
1517 1 58 ASP H 1 120 TRP HZ2 3.700 . 5.400 4.014 3.660 4.373 . 0 0 "[ . 1]" 1
1518 2 58 ASP H 2 120 TRP HZ2 3.700 . 5.400 4.154 3.661 4.546 . 0 0 "[ . 1]" 1
1519 1 58 ASP H 1 127 SER QB 4.200 . 6.000 4.180 3.810 4.703 . 0 0 "[ . 1]" 1
1520 2 58 ASP H 2 127 SER QB 4.200 . 6.000 4.075 3.731 4.572 . 0 0 "[ . 1]" 1
1521 1 89 CYS H 1 116 GLY H 5.100 . 6.000 5.019 4.375 6.020 0.020 3 0 "[ . 1]" 1
1522 2 89 CYS H 2 116 GLY H 5.100 . 6.000 4.982 3.755 5.643 . 0 0 "[ . 1]" 1
1523 1 70 LEU H 1 71 GLU H 2.900 . 3.900 2.735 2.332 3.063 . 0 0 "[ . 1]" 1
1524 2 70 LEU H 2 71 GLU H 2.900 . 3.900 2.725 2.232 3.195 . 0 0 "[ . 1]" 1
1525 1 70 LEU H 1 73 LEU HB3 4.200 . 6.000 5.860 5.515 6.033 0.033 2 0 "[ . 1]" 1
1526 2 70 LEU H 2 73 LEU HB3 4.200 . 6.000 5.855 5.656 6.076 0.076 2 0 "[ . 1]" 1
1527 1 70 LEU H 1 70 LEU HB2 3.300 . 4.700 3.595 3.182 3.873 . 0 0 "[ . 1]" 1
1528 2 70 LEU H 2 70 LEU HB2 3.300 . 4.700 3.708 3.515 3.938 . 0 0 "[ . 1]" 1
1529 1 70 LEU H 1 70 LEU HG 3.700 . 5.400 4.096 3.242 4.610 . 0 0 "[ . 1]" 1
1530 2 70 LEU H 2 70 LEU HG 3.700 . 5.400 3.814 3.085 4.501 . 0 0 "[ . 1]" 1
1531 1 70 LEU H 1 70 LEU MD2 3.300 . 4.600 3.708 2.343 4.341 . 0 0 "[ . 1]" 1
1532 2 70 LEU H 2 70 LEU MD2 3.300 . 4.600 3.468 2.808 4.342 . 0 0 "[ . 1]" 1
1533 1 68 GLY H 1 70 LEU H 4.100 . 6.000 3.674 3.244 4.119 . 0 0 "[ . 1]" 1
1534 2 68 GLY H 2 70 LEU H 4.100 . 6.000 3.545 3.145 4.103 . 0 0 "[ . 1]" 1
1535 1 70 LEU H 1 70 LEU HA 2.800 . 3.800 2.491 2.243 2.868 . 0 0 "[ . 1]" 1
1536 2 70 LEU H 2 70 LEU HA 2.800 . 3.800 2.491 2.207 2.886 . 0 0 "[ . 1]" 1
1537 1 70 LEU H 1 70 LEU HB3 2.300 . 3.000 2.693 2.012 3.126 0.126 7 0 "[ . 1]" 1
1538 2 70 LEU H 2 70 LEU HB3 2.300 . 3.000 2.697 2.237 3.034 0.034 1 0 "[ . 1]" 1
1539 1 88 PHE QD 1 89 CYS H 3.500 . 5.000 2.907 2.464 3.276 . 0 0 "[ . 1]" 1
1540 2 88 PHE QD 2 89 CYS H 3.500 . 5.000 2.816 2.211 3.185 . 0 0 "[ . 1]" 1
1541 1 88 PHE HB2 1 89 CYS H 3.700 . 5.400 4.164 3.985 4.342 . 0 0 "[ . 1]" 1
1542 2 88 PHE HB2 2 89 CYS H 3.700 . 5.400 4.217 4.046 4.466 . 0 0 "[ . 1]" 1
1543 1 89 CYS H 1 95 ALA MB 3.200 . 4.500 3.863 3.518 4.265 . 0 0 "[ . 1]" 1
1544 2 89 CYS H 2 95 ALA MB 3.200 . 4.500 3.741 3.413 4.384 . 0 0 "[ . 1]" 1
1545 1 88 PHE HA 1 89 CYS H 2.200 . 2.800 2.225 2.112 2.411 . 0 0 "[ . 1]" 1
1546 2 88 PHE HA 2 89 CYS H 2.200 . 2.800 2.192 2.051 2.393 . 0 0 "[ . 1]" 1
1547 1 89 CYS H 1 113 SER QB 3.000 . 4.100 2.861 2.030 3.523 . 0 0 "[ . 1]" 1
1548 2 89 CYS H 2 113 SER QB 3.000 . 4.100 2.632 2.033 3.037 . 0 0 "[ . 1]" 1
1549 1 89 CYS H 1 116 GLY HA2 3.600 . 5.200 3.160 2.439 4.294 . 0 0 "[ . 1]" 1
1550 2 89 CYS H 2 116 GLY HA2 3.600 . 5.200 3.350 2.819 3.895 . 0 0 "[ . 1]" 1
1551 1 88 PHE HB3 1 89 CYS H 4.200 . 6.000 3.738 3.334 4.071 . 0 0 "[ . 1]" 1
1552 2 88 PHE HB3 2 89 CYS H 4.200 . 6.000 3.846 3.277 4.198 . 0 0 "[ . 1]" 1
1553 1 122 GLU H 1 122 GLU HG3 4.100 . 6.000 3.914 2.616 4.447 . 0 0 "[ . 1]" 1
1554 2 122 GLU H 2 122 GLU HG3 4.100 . 6.000 3.783 2.697 4.504 . 0 0 "[ . 1]" 1
1555 1 122 GLU H 1 122 GLU QB 2.100 . 2.600 2.150 2.032 2.282 . 0 0 "[ . 1]" 1
1556 2 122 GLU H 2 122 GLU QB 2.100 . 2.600 2.097 2.022 2.279 . 0 0 "[ . 1]" 1
1557 1 121 LEU HB2 1 122 GLU H 2.900 . 4.000 2.820 2.621 2.992 . 0 0 "[ . 1]" 1
1558 2 121 LEU HB2 2 122 GLU H 2.900 . 4.000 2.835 2.613 3.071 . 0 0 "[ . 1]" 1
1559 1 121 LEU QD 1 122 GLU H 4.000 . 6.000 4.074 4.014 4.141 . 0 0 "[ . 1]" 1
1560 2 121 LEU QD 2 122 GLU H 4.000 . 6.000 4.099 4.063 4.146 . 0 0 "[ . 1]" 1
1561 1 122 GLU H 1 122 GLU HA 2.600 . 3.400 2.813 2.796 2.831 . 0 0 "[ . 1]" 1
1562 2 122 GLU H 2 122 GLU HA 2.600 . 3.400 2.809 2.796 2.826 . 0 0 "[ . 1]" 1
1563 1 121 LEU H 1 122 GLU H 2.600 . 3.500 2.638 2.561 2.729 . 0 0 "[ . 1]" 1
1564 2 121 LEU H 2 122 GLU H 2.600 . 3.500 2.621 2.549 2.697 . 0 0 "[ . 1]" 1
1565 1 40 ILE HB 1 41 THR H 3.600 . 5.200 4.318 4.263 4.368 . 0 0 "[ . 1]" 1
1566 2 40 ILE HB 2 41 THR H 3.600 . 5.200 4.331 4.280 4.392 . 0 0 "[ . 1]" 1
1567 1 41 THR H 1 85 VAL MG1 2.800 . 3.800 2.387 2.131 2.498 . 0 0 "[ . 1]" 1
1568 2 41 THR H 2 85 VAL MG1 2.800 . 3.800 2.424 2.180 2.814 . 0 0 "[ . 1]" 1
1569 1 40 ILE MG 1 41 THR H 2.800 . 3.800 2.994 2.891 3.213 . 0 0 "[ . 1]" 1
1570 2 40 ILE MG 2 41 THR H 2.800 . 3.800 2.973 2.740 3.183 . 0 0 "[ . 1]" 1
1571 1 40 ILE HA 1 41 THR H 2.200 . 2.800 2.118 2.092 2.153 . 0 0 "[ . 1]" 1
1572 2 40 ILE HA 2 41 THR H 2.200 . 2.800 2.117 2.048 2.168 . 0 0 "[ . 1]" 1
1573 1 41 THR H 1 86 VAL H 4.300 . 6.000 4.360 4.155 4.611 . 0 0 "[ . 1]" 1
1574 2 41 THR H 2 86 VAL H 4.300 . 6.000 4.382 4.153 4.701 . 0 0 "[ . 1]" 1
1575 1 41 THR H 1 41 THR HB 2.700 . 3.600 2.935 2.579 3.241 . 0 0 "[ . 1]" 1
1576 2 41 THR H 2 41 THR HB 2.700 . 3.600 2.830 2.462 3.081 . 0 0 "[ . 1]" 1
1577 1 47 ASP H 1 50 GLU H 3.900 . 5.800 4.616 4.298 4.945 . 0 0 "[ . 1]" 1
1578 2 47 ASP H 2 50 GLU H 3.900 . 5.800 4.861 4.293 5.594 . 0 0 "[ . 1]" 1
1579 1 50 GLU H 1 51 LEU MD1 4.200 . 6.000 4.728 4.489 4.898 . 0 0 "[ . 1]" 1
1580 2 50 GLU H 2 51 LEU MD1 4.200 . 6.000 4.605 4.229 4.899 . 0 0 "[ . 1]" 1
1581 1 47 ASP HB3 1 50 GLU H 4.300 . 6.000 3.580 2.125 4.559 . 0 0 "[ . 1]" 1
1582 2 47 ASP HB3 2 50 GLU H 4.300 . 6.000 3.598 2.648 4.777 . 0 0 "[ . 1]" 1
1583 1 49 ASP HA 1 50 GLU H 3.600 . 5.200 3.538 3.499 3.566 . 0 0 "[ . 1]" 1
1584 2 49 ASP HA 2 50 GLU H 3.600 . 5.200 3.541 3.475 3.571 . 0 0 "[ . 1]" 1
1585 1 119 LYS HB3 1 120 TRP H 3.700 . 5.400 3.280 3.214 3.363 . 0 0 "[ . 1]" 1
1586 2 119 LYS HB3 2 120 TRP H 3.700 . 5.400 3.262 3.168 3.330 . 0 0 "[ . 1]" 1
1587 1 119 LYS HB2 1 120 TRP H 3.300 . 4.700 3.195 3.059 3.276 . 0 0 "[ . 1]" 1
1588 2 119 LYS HB2 2 120 TRP H 3.300 . 4.700 3.180 3.115 3.244 . 0 0 "[ . 1]" 1
1589 1 119 LYS QD 1 120 TRP H 4.200 . 6.000 4.573 4.432 4.717 . 0 0 "[ . 1]" 1
1590 2 119 LYS QD 2 120 TRP H 4.200 . 6.000 4.525 4.436 4.679 . 0 0 "[ . 1]" 1
1591 1 120 TRP H 1 125 LEU MD1 4.700 . 6.000 4.611 4.333 5.262 . 0 0 "[ . 1]" 1
1592 2 120 TRP H 2 125 LEU MD1 4.700 . 6.000 4.574 4.269 4.856 . 0 0 "[ . 1]" 1
1593 1 120 TRP H 1 122 GLU H 4.200 . 6.000 3.920 3.766 4.064 . 0 0 "[ . 1]" 1
1594 2 120 TRP H 2 122 GLU H 4.200 . 6.000 3.917 3.864 4.023 . 0 0 "[ . 1]" 1
1595 1 120 TRP H 1 120 TRP HE3 4.000 . 6.000 4.233 4.108 4.374 . 0 0 "[ . 1]" 1
1596 2 120 TRP H 2 120 TRP HE3 4.000 . 6.000 4.219 4.091 4.340 . 0 0 "[ . 1]" 1
1597 1 88 PHE QD 1 120 TRP H 5.200 . 6.000 5.623 5.502 5.792 . 0 0 "[ . 1]" 1
1598 2 88 PHE QD 2 120 TRP H 5.200 . 6.000 5.671 5.417 5.813 . 0 0 "[ . 1]" 1
1599 1 120 TRP H 1 120 TRP HD1 4.800 . 6.000 5.205 5.142 5.253 . 0 0 "[ . 1]" 1
1600 2 120 TRP H 2 120 TRP HD1 4.800 . 6.000 5.216 5.168 5.268 . 0 0 "[ . 1]" 1
1601 1 120 TRP H 1 120 TRP HA 2.600 . 3.400 2.815 2.809 2.824 . 0 0 "[ . 1]" 1
1602 2 120 TRP H 2 120 TRP HA 2.600 . 3.400 2.814 2.808 2.825 . 0 0 "[ . 1]" 1
1603 1 120 TRP H 1 120 TRP QB 2.700 . 3.600 2.203 2.180 2.239 . 0 0 "[ . 1]" 1
1604 2 120 TRP H 2 120 TRP QB 2.700 . 3.600 2.205 2.177 2.234 . 0 0 "[ . 1]" 1
1605 1 88 PHE QE 1 120 TRP H 5.000 . 6.000 3.611 3.447 3.791 . 0 0 "[ . 1]" 1
1606 2 88 PHE QE 2 120 TRP H 5.000 . 6.000 3.667 3.480 3.784 . 0 0 "[ . 1]" 1
1607 1 24 MET QB 1 25 LEU H 3.900 . 5.800 3.496 3.228 3.729 . 0 0 "[ . 1]" 1
1608 2 24 MET QB 2 25 LEU H 3.900 . 5.800 3.536 3.282 3.751 . 0 0 "[ . 1]" 1
1609 1 25 LEU H 1 25 LEU HG 3.200 . 4.500 3.968 3.639 4.354 . 0 0 "[ . 1]" 1
1610 2 25 LEU H 2 25 LEU HG 3.200 . 4.500 3.867 3.693 4.105 . 0 0 "[ . 1]" 1
1611 1 25 LEU H 1 25 LEU HB2 2.400 . 3.100 2.416 2.316 2.660 . 0 0 "[ . 1]" 1
1612 2 25 LEU H 2 25 LEU HB2 2.400 . 3.100 2.392 2.311 2.467 . 0 0 "[ . 1]" 1
1613 1 25 LEU H 1 25 LEU MD2 4.300 . 6.000 3.971 3.801 4.114 . 0 0 "[ . 1]" 1
1614 2 25 LEU H 2 25 LEU MD2 4.300 . 6.000 3.960 3.877 4.028 . 0 0 "[ . 1]" 1
1615 1 25 LEU H 1 25 LEU MD1 4.600 . 6.000 4.528 4.401 4.673 . 0 0 "[ . 1]" 1
1616 2 25 LEU H 2 25 LEU MD1 4.600 . 6.000 4.499 4.414 4.601 . 0 0 "[ . 1]" 1
1617 1 25 LEU H 1 26 SER H 3.900 . 5.800 4.405 4.280 4.454 . 0 0 "[ . 1]" 1
1618 2 25 LEU H 2 26 SER H 3.900 . 5.800 4.395 4.307 4.454 . 0 0 "[ . 1]" 1
1619 1 24 MET HA 1 25 LEU H 2.300 . 3.000 2.143 2.101 2.185 . 0 0 "[ . 1]" 1
1620 2 24 MET HA 2 25 LEU H 2.300 . 3.000 2.145 2.105 2.214 . 0 0 "[ . 1]" 1
1621 1 25 LEU H 1 25 LEU HA 2.800 . 3.800 2.941 2.927 2.948 . 0 0 "[ . 1]" 1
1622 2 25 LEU H 2 25 LEU HA 2.800 . 3.800 2.943 2.941 2.946 . 0 0 "[ . 1]" 1
1623 1 10 THR MG 1 11 PHE H 4.000 . 6.000 4.043 3.861 4.166 . 0 0 "[ . 1]" 1
1624 2 10 THR MG 2 11 PHE H 4.000 . 6.000 4.003 3.893 4.172 . 0 0 "[ . 1]" 1
1625 1 11 PHE H 1 11 PHE QD 4.000 . 6.000 4.000 3.914 4.042 . 0 0 "[ . 1]" 1
1626 2 11 PHE H 2 11 PHE QD 4.000 . 6.000 3.971 3.865 4.064 . 0 0 "[ . 1]" 1
1627 1 10 THR HB 1 11 PHE H 2.800 . 3.800 2.726 2.594 2.899 . 0 0 "[ . 1]" 1
1628 2 10 THR HB 2 11 PHE H 2.800 . 3.800 2.679 2.542 2.920 . 0 0 "[ . 1]" 1
1629 1 11 PHE H 1 11 PHE HB3 3.100 . 4.300 2.989 2.940 3.083 . 0 0 "[ . 1]" 1
1630 2 11 PHE H 2 11 PHE HB3 3.100 . 4.300 3.005 2.897 3.090 . 0 0 "[ . 1]" 1
1631 1 11 PHE H 1 11 PHE HB2 2.300 . 3.000 2.165 2.132 2.184 . 0 0 "[ . 1]" 1
1632 2 11 PHE H 2 11 PHE HB2 2.300 . 3.000 2.144 2.090 2.205 . 0 0 "[ . 1]" 1
1633 1 11 PHE H 1 13 ALA H 4.000 . 6.000 3.883 3.791 3.989 . 0 0 "[ . 1]" 1
1634 2 11 PHE H 2 13 ALA H 4.000 . 6.000 3.905 3.834 3.992 . 0 0 "[ . 1]" 1
1635 1 11 PHE H 1 11 PHE HA 2.900 . 3.900 2.791 2.775 2.806 . 0 0 "[ . 1]" 1
1636 2 11 PHE H 2 11 PHE HA 2.900 . 3.900 2.778 2.757 2.793 . 0 0 "[ . 1]" 1
1637 1 9 ALA HA 1 11 PHE H 3.800 . 5.600 4.616 4.428 4.726 . 0 0 "[ . 1]" 1
1638 2 9 ALA HA 2 11 PHE H 3.800 . 5.600 4.616 4.476 4.752 . 0 0 "[ . 1]" 1
1639 1 10 THR HA 1 11 PHE H 3.400 . 4.900 3.561 3.547 3.574 . 0 0 "[ . 1]" 1
1640 2 10 THR HA 2 11 PHE H 3.400 . 4.900 3.559 3.541 3.572 . 0 0 "[ . 1]" 1
1641 1 8 ASP H 1 11 PHE H 3.700 . 5.400 4.728 4.648 4.814 . 0 0 "[ . 1]" 1
1642 2 8 ASP H 2 11 PHE H 3.700 . 5.400 4.692 4.606 4.794 . 0 0 "[ . 1]" 1
1643 1 63 LYS HB3 1 64 HIS H 3.300 . 4.700 3.534 3.326 3.733 . 0 0 "[ . 1]" 1
1644 2 63 LYS HB3 2 64 HIS H 3.300 . 4.700 3.444 3.339 3.643 . 0 0 "[ . 1]" 1
1645 1 64 HIS H 1 65 MET H 4.400 . 6.000 4.409 4.327 4.506 . 0 0 "[ . 1]" 1
1646 2 64 HIS H 2 65 MET H 4.400 . 6.000 4.427 4.315 4.535 . 0 0 "[ . 1]" 1
1647 1 64 HIS H 1 64 HIS HD2 4.800 . 6.000 4.998 4.763 5.166 . 0 0 "[ . 1]" 1
1648 2 64 HIS H 2 64 HIS HD2 4.800 . 6.000 5.012 4.742 5.203 . 0 0 "[ . 1]" 1
1649 1 62 TYR QD 1 64 HIS H 3.800 . 5.600 4.624 4.405 4.856 . 0 0 "[ . 1]" 1
1650 2 62 TYR QD 2 64 HIS H 3.800 . 5.600 4.570 4.370 4.780 . 0 0 "[ . 1]" 1
1651 1 62 TYR QE 1 64 HIS H 3.400 . 4.900 4.259 4.001 4.499 . 0 0 "[ . 1]" 1
1652 2 62 TYR QE 2 64 HIS H 3.400 . 4.900 4.011 3.752 4.273 . 0 0 "[ . 1]" 1
1653 1 64 HIS H 1 64 HIS HA 3.000 . 4.100 2.917 2.899 2.926 . 0 0 "[ . 1]" 1
1654 2 64 HIS H 2 64 HIS HA 3.000 . 4.100 2.903 2.865 2.927 . 0 0 "[ . 1]" 1
1655 1 64 HIS H 1 64 HIS HB3 2.500 . 3.300 2.587 2.411 2.844 . 0 0 "[ . 1]" 1
1656 2 64 HIS H 2 64 HIS HB3 2.500 . 3.300 2.553 2.368 2.800 . 0 0 "[ . 1]" 1
1657 1 64 HIS H 1 64 HIS HB2 2.800 . 3.800 2.667 2.419 2.851 . 0 0 "[ . 1]" 1
1658 2 64 HIS H 2 64 HIS HB2 2.800 . 3.800 2.622 2.366 2.860 . 0 0 "[ . 1]" 1
1659 1 63 LYS HD3 1 64 HIS H 4.500 . 6.000 6.014 5.498 6.550 0.550 6 1 "[ .+ 1]" 1
1660 2 63 LYS HD3 2 64 HIS H 4.500 . 6.000 5.796 5.549 6.286 0.286 2 0 "[ . 1]" 1
1661 1 63 LYS HA 1 64 HIS H 2.200 . 2.800 2.160 2.129 2.188 . 0 0 "[ . 1]" 1
1662 2 63 LYS HA 2 64 HIS H 2.200 . 2.800 2.148 2.130 2.171 . 0 0 "[ . 1]" 1
1663 1 51 LEU MD2 1 64 HIS H 5.000 . 6.000 5.790 5.390 6.043 0.043 2 0 "[ . 1]" 1
1664 2 51 LEU MD2 2 64 HIS H 5.000 . 6.000 5.814 5.405 6.045 0.045 2 0 "[ . 1]" 1
1665 1 100 LYS H 1 100 LYS HG3 3.800 . 5.600 3.532 3.191 4.002 . 0 0 "[ . 1]" 1
1666 2 100 LYS H 2 100 LYS HG3 3.800 . 5.600 3.552 2.970 3.907 . 0 0 "[ . 1]" 1
1667 1 100 LYS H 1 100 LYS HG2 2.700 . 3.600 3.362 3.000 3.623 0.023 10 0 "[ . 1]" 1
1668 2 100 LYS H 2 100 LYS HG2 2.700 . 3.600 3.259 3.063 3.556 . 0 0 "[ . 1]" 1
1669 1 100 LYS H 1 110 ILE MD 3.700 . 5.500 4.655 4.452 4.805 . 0 0 "[ . 1]" 1
1670 2 100 LYS H 2 110 ILE MD 3.700 . 5.500 4.549 4.428 4.651 . 0 0 "[ . 1]" 1
1671 1 100 LYS H 1 100 LYS HB3 2.000 . 2.500 2.163 2.116 2.233 . 0 0 "[ . 1]" 1
1672 2 100 LYS H 2 100 LYS HB3 2.000 . 2.500 2.167 2.107 2.248 . 0 0 "[ . 1]" 1
1673 1 100 LYS H 1 100 LYS HB2 3.200 . 4.500 3.469 3.417 3.527 . 0 0 "[ . 1]" 1
1674 2 100 LYS H 2 100 LYS HB2 3.200 . 4.500 3.475 3.417 3.534 . 0 0 "[ . 1]" 1
1675 1 99 GLY H 1 100 LYS H 2.500 . 3.300 2.671 2.436 2.878 . 0 0 "[ . 1]" 1
1676 2 99 GLY H 2 100 LYS H 2.500 . 3.300 2.610 2.363 2.831 . 0 0 "[ . 1]" 1
1677 1 100 LYS H 1 101 THR HB 4.400 . 6.000 5.462 4.965 6.008 0.008 3 0 "[ . 1]" 1
1678 2 100 LYS H 2 101 THR HB 4.400 . 6.000 5.353 5.114 5.942 . 0 0 "[ . 1]" 1
1679 1 100 LYS H 1 100 LYS HA 2.500 . 3.300 2.786 2.771 2.799 . 0 0 "[ . 1]" 1
1680 2 100 LYS H 2 100 LYS HA 2.500 . 3.300 2.783 2.750 2.810 . 0 0 "[ . 1]" 1
1681 1 97 LEU HA 1 100 LYS H 3.100 . 4.300 4.214 3.994 4.340 0.040 2 0 "[ . 1]" 1
1682 2 97 LEU HA 2 100 LYS H 3.100 . 4.300 4.020 3.816 4.302 0.002 3 0 "[ . 1]" 1
1683 1 99 GLY QA 1 100 LYS H 2.600 . 3.500 2.633 2.561 2.723 . 0 0 "[ . 1]" 1
1684 2 99 GLY QA 2 100 LYS H 2.600 . 3.500 2.658 2.593 2.734 . 0 0 "[ . 1]" 1
1685 1 59 VAL MG2 1 62 TYR H 3.700 . 5.400 3.243 2.861 3.862 . 0 0 "[ . 1]" 1
1686 2 59 VAL MG2 2 62 TYR H 3.700 . 5.400 3.139 2.801 3.746 . 0 0 "[ . 1]" 1
1687 1 62 TYR H 1 62 TYR QD 3.500 . 5.000 4.145 3.928 4.245 . 0 0 "[ . 1]" 1
1688 2 62 TYR H 2 62 TYR QD 3.500 . 5.000 4.008 3.627 4.177 . 0 0 "[ . 1]" 1
1689 1 61 ASN HA 1 62 TYR H 2.100 . 2.700 2.349 2.268 2.454 . 0 0 "[ . 1]" 1
1690 2 61 ASN HA 2 62 TYR H 2.100 . 2.700 2.388 2.321 2.472 . 0 0 "[ . 1]" 1
1691 1 61 ASN HB3 1 62 TYR H 4.400 . 6.000 4.427 4.179 4.582 . 0 0 "[ . 1]" 1
1692 2 61 ASN HB3 2 62 TYR H 4.400 . 6.000 4.452 4.243 4.612 . 0 0 "[ . 1]" 1
1693 1 62 TYR H 1 62 TYR QB 2.300 . 3.000 2.381 2.263 2.529 . 0 0 "[ . 1]" 1
1694 2 62 TYR H 2 62 TYR QB 2.300 . 3.000 2.446 2.307 2.662 . 0 0 "[ . 1]" 1
1695 1 41 THR MG 1 62 TYR H 3.500 . 5.100 4.000 3.570 4.508 . 0 0 "[ . 1]" 1
1696 2 41 THR MG 2 62 TYR H 3.500 . 5.100 4.057 3.737 4.570 . 0 0 "[ . 1]" 1
1697 1 25 LEU HB3 1 30 ALA H 3.300 . 4.700 3.667 3.452 3.853 . 0 0 "[ . 1]" 1
1698 2 25 LEU HB3 2 30 ALA H 3.300 . 4.700 3.578 3.386 3.762 . 0 0 "[ . 1]" 1
1699 1 30 ALA H 1 30 ALA MB 2.300 . 3.000 2.251 2.207 2.280 . 0 0 "[ . 1]" 1
1700 2 30 ALA H 2 30 ALA MB 2.300 . 3.000 2.232 2.142 2.283 . 0 0 "[ . 1]" 1
1701 1 30 ALA H 1 33 LEU H 4.500 . 6.000 5.133 5.076 5.240 . 0 0 "[ . 1]" 1
1702 2 30 ALA H 2 33 LEU H 4.500 . 6.000 5.118 4.984 5.218 . 0 0 "[ . 1]" 1
1703 1 25 LEU HA 1 30 ALA H 5.600 . 6.000 5.739 5.497 6.057 0.057 1 0 "[ . 1]" 1
1704 2 25 LEU HA 2 30 ALA H 5.600 . 6.000 5.691 5.424 6.025 0.025 6 0 "[ . 1]" 1
1705 1 29 ASP HA 1 30 ALA H 3.000 . 4.100 3.457 3.437 3.475 . 0 0 "[ . 1]" 1
1706 2 29 ASP HA 2 30 ALA H 3.000 . 4.100 3.463 3.453 3.470 . 0 0 "[ . 1]" 1
1707 1 30 ALA H 1 30 ALA HA 2.900 . 3.900 2.850 2.815 2.868 . 0 0 "[ . 1]" 1
1708 2 30 ALA H 2 30 ALA HA 2.900 . 3.900 2.848 2.829 2.870 . 0 0 "[ . 1]" 1
1709 1 28 LYS HA 1 30 ALA H 3.800 . 5.700 4.224 4.044 4.443 . 0 0 "[ . 1]" 1
1710 2 28 LYS HA 2 30 ALA H 3.800 . 5.700 4.279 4.140 4.469 . 0 0 "[ . 1]" 1
1711 1 29 ASP HB3 1 30 ALA H 3.100 . 4.300 3.124 2.715 3.734 . 0 0 "[ . 1]" 1
1712 2 29 ASP HB3 2 30 ALA H 3.100 . 4.300 3.154 2.838 3.729 . 0 0 "[ . 1]" 1
1713 1 30 ALA H 1 31 TYR HB2 4.900 . 6.000 5.130 4.976 5.288 . 0 0 "[ . 1]" 1
1714 2 30 ALA H 2 31 TYR HB2 4.900 . 6.000 5.157 4.820 5.386 . 0 0 "[ . 1]" 1
1715 1 29 ASP HB2 1 30 ALA H 3.400 . 4.800 3.270 2.743 3.634 . 0 0 "[ . 1]" 1
1716 2 29 ASP HB2 2 30 ALA H 3.400 . 4.800 3.261 2.695 3.635 . 0 0 "[ . 1]" 1
1717 1 24 MET H 1 24 MET QB 2.800 . 3.700 2.231 2.094 2.331 . 0 0 "[ . 1]" 1
1718 2 24 MET H 2 24 MET QB 2.800 . 3.700 2.265 2.073 2.468 . 0 0 "[ . 1]" 1
1719 1 23 VAL HB 1 24 MET H 4.000 . 6.000 4.311 4.263 4.381 . 0 0 "[ . 1]" 1
1720 2 23 VAL HB 2 24 MET H 4.000 . 6.000 4.307 4.249 4.403 . 0 0 "[ . 1]" 1
1721 1 23 VAL MG2 1 24 MET H 4.200 . 6.000 4.224 4.160 4.325 . 0 0 "[ . 1]" 1
1722 2 23 VAL MG2 2 24 MET H 4.200 . 6.000 4.257 4.208 4.356 . 0 0 "[ . 1]" 1
1723 1 24 MET H 1 111 TYR QD 4.600 . 6.000 5.982 5.816 6.094 0.094 7 0 "[ . 1]" 1
1724 2 24 MET H 2 111 TYR QD 4.600 . 6.000 5.936 5.640 6.052 0.052 3 0 "[ . 1]" 1
1725 1 24 MET H 1 24 MET HA 3.000 . 4.100 2.870 2.837 2.899 . 0 0 "[ . 1]" 1
1726 2 24 MET H 2 24 MET HA 3.000 . 4.100 2.868 2.845 2.894 . 0 0 "[ . 1]" 1
1727 1 23 VAL HA 1 24 MET H 2.200 . 2.800 2.148 2.128 2.169 . 0 0 "[ . 1]" 1
1728 2 23 VAL HA 2 24 MET H 2.200 . 2.800 2.159 2.129 2.190 . 0 0 "[ . 1]" 1
1729 1 24 MET H 1 24 MET HG3 3.800 . 5.600 3.550 3.111 4.427 . 0 0 "[ . 1]" 1
1730 2 24 MET H 2 24 MET HG3 3.800 . 5.600 3.372 2.994 4.488 . 0 0 "[ . 1]" 1
1731 1 24 MET H 1 24 MET HG2 2.700 . 3.600 3.170 2.711 3.608 0.008 9 0 "[ . 1]" 1
1732 2 24 MET H 2 24 MET HG2 2.700 . 3.600 3.079 2.339 3.670 0.070 5 0 "[ . 1]" 1
1733 1 30 ALA H 1 120 TRP HZ3 4.500 . 6.000 5.043 4.681 5.418 . 0 0 "[ . 1]" 1
1734 2 30 ALA H 2 120 TRP HZ3 4.500 . 6.000 5.064 4.841 5.394 . 0 0 "[ . 1]" 1
1735 1 116 GLY HA3 1 117 MET H 3.000 . 4.200 2.473 2.282 2.806 . 0 0 "[ . 1]" 1
1736 2 116 GLY HA3 2 117 MET H 3.000 . 4.200 2.499 2.308 2.734 . 0 0 "[ . 1]" 1
1737 1 116 GLY HA2 1 117 MET H 2.900 . 3.900 2.686 2.371 2.865 . 0 0 "[ . 1]" 1
1738 2 116 GLY HA2 2 117 MET H 2.900 . 3.900 2.647 2.421 2.860 . 0 0 "[ . 1]" 1
1739 1 117 MET H 1 118 ASP QB 4.400 . 6.000 4.529 4.129 4.963 . 0 0 "[ . 1]" 1
1740 2 117 MET H 2 118 ASP QB 4.400 . 6.000 4.575 4.184 5.069 . 0 0 "[ . 1]" 1
1741 1 110 ILE H 1 110 ILE HB 2.700 . 3.600 2.851 2.756 2.924 . 0 0 "[ . 1]" 1
1742 2 110 ILE H 2 110 ILE HB 2.700 . 3.600 2.815 2.753 2.909 . 0 0 "[ . 1]" 1
1743 1 110 ILE H 1 110 ILE HG12 4.100 . 6.000 4.789 4.700 4.876 . 0 0 "[ . 1]" 1
1744 2 110 ILE H 2 110 ILE HG12 4.100 . 6.000 4.761 4.711 4.855 . 0 0 "[ . 1]" 1
1745 1 109 THR MG 1 110 ILE H 3.200 . 4.500 3.109 2.935 3.316 . 0 0 "[ . 1]" 1
1746 2 109 THR MG 2 110 ILE H 3.200 . 4.500 3.131 2.873 3.507 . 0 0 "[ . 1]" 1
1747 1 110 ILE H 1 110 ILE MG 2.600 . 3.500 2.435 2.315 2.695 . 0 0 "[ . 1]" 1
1748 2 110 ILE H 2 110 ILE MG 2.600 . 3.500 2.487 2.368 2.613 . 0 0 "[ . 1]" 1
1749 1 109 THR H 1 110 ILE H 3.500 . 5.000 4.184 4.035 4.367 . 0 0 "[ . 1]" 1
1750 2 109 THR H 2 110 ILE H 3.500 . 5.000 4.177 4.042 4.307 . 0 0 "[ . 1]" 1
1751 1 109 THR HA 1 110 ILE H 2.200 . 2.800 2.147 2.134 2.160 . 0 0 "[ . 1]" 1
1752 2 109 THR HA 2 110 ILE H 2.200 . 2.800 2.145 2.119 2.189 . 0 0 "[ . 1]" 1
1753 1 109 THR HB 1 110 ILE H 4.000 . 6.000 4.013 3.860 4.270 . 0 0 "[ . 1]" 1
1754 2 109 THR HB 2 110 ILE H 4.000 . 6.000 4.028 3.940 4.224 . 0 0 "[ . 1]" 1
1755 1 86 VAL HB 1 111 TYR H 4.600 . 6.000 3.429 3.325 3.584 . 0 0 "[ . 1]" 1
1756 2 86 VAL HB 2 111 TYR H 4.600 . 6.000 3.407 3.268 3.579 . 0 0 "[ . 1]" 1
1757 1 111 TYR H 1 111 TYR QD 2.800 . 3.700 2.276 2.134 2.372 . 0 0 "[ . 1]" 1
1758 2 111 TYR H 2 111 TYR QD 2.800 . 3.700 2.285 2.129 2.508 . 0 0 "[ . 1]" 1
1759 1 111 TYR H 1 111 TYR HA 3.000 . 4.100 2.949 2.943 2.954 . 0 0 "[ . 1]" 1
1760 2 111 TYR H 2 111 TYR HA 3.000 . 4.100 2.946 2.942 2.950 . 0 0 "[ . 1]" 1
1761 1 111 TYR H 1 111 TYR HB3 3.500 . 5.100 3.770 3.740 3.792 . 0 0 "[ . 1]" 1
1762 2 111 TYR H 2 111 TYR HB3 3.500 . 5.100 3.759 3.737 3.792 . 0 0 "[ . 1]" 1
1763 1 111 TYR H 1 111 TYR HB2 3.000 . 4.100 2.806 2.707 2.904 . 0 0 "[ . 1]" 1
1764 2 111 TYR H 2 111 TYR HB2 3.000 . 4.100 2.820 2.754 2.874 . 0 0 "[ . 1]" 1
1765 1 110 ILE H 1 111 TYR H 4.800 . 6.000 4.376 4.330 4.416 . 0 0 "[ . 1]" 1
1766 2 110 ILE H 2 111 TYR H 4.800 . 6.000 4.390 4.362 4.431 . 0 0 "[ . 1]" 1
1767 1 25 LEU MD1 1 111 TYR H 4.700 . 6.000 5.874 5.571 6.021 0.021 6 0 "[ . 1]" 1
1768 2 25 LEU MD1 2 111 TYR H 4.700 . 6.000 5.727 5.407 6.021 0.021 9 0 "[ . 1]" 1
1769 1 110 ILE HA 1 111 TYR H 2.300 . 2.900 2.151 2.129 2.179 . 0 0 "[ . 1]" 1
1770 2 110 ILE HA 2 111 TYR H 2.300 . 2.900 2.148 2.130 2.179 . 0 0 "[ . 1]" 1
1771 1 96 ALA HA 1 112 ASN HD21 3.500 . 5.000 2.668 2.239 3.364 . 0 0 "[ . 1]" 1
1772 2 96 ALA HA 2 112 ASN HD21 3.500 . 5.000 2.675 2.244 3.708 . 0 0 "[ . 1]" 1
1773 1 112 ASN HB3 1 112 ASN HD21 3.000 . 4.100 2.876 2.177 3.280 . 0 0 "[ . 1]" 1
1774 2 112 ASN HB3 2 112 ASN HD21 3.000 . 4.100 2.887 2.200 3.293 . 0 0 "[ . 1]" 1
1775 1 112 ASN HB2 1 112 ASN HD21 3.300 . 4.700 2.361 2.108 3.396 . 0 0 "[ . 1]" 1
1776 2 112 ASN HB2 2 112 ASN HD21 3.300 . 4.700 2.428 2.114 3.435 . 0 0 "[ . 1]" 1
1777 1 43 ILE H 1 43 ILE HG12 4.200 . 6.000 4.339 3.999 4.676 . 0 0 "[ . 1]" 1
1778 2 43 ILE H 2 43 ILE HG12 4.200 . 6.000 4.397 4.027 4.601 . 0 0 "[ . 1]" 1
1779 1 42 LEU MD2 1 43 ILE H 4.200 . 6.000 4.453 4.300 4.607 . 0 0 "[ . 1]" 1
1780 2 42 LEU MD2 2 43 ILE H 4.200 . 6.000 4.470 4.330 4.600 . 0 0 "[ . 1]" 1
1781 1 42 LEU HA 1 43 ILE H 2.400 . 3.100 2.129 2.106 2.155 . 0 0 "[ . 1]" 1
1782 2 42 LEU HA 2 43 ILE H 2.400 . 3.100 2.130 2.109 2.150 . 0 0 "[ . 1]" 1
1783 1 42 LEU HB3 1 43 ILE H 4.300 . 6.000 4.263 4.204 4.335 . 0 0 "[ . 1]" 1
1784 2 42 LEU HB3 2 43 ILE H 4.300 . 6.000 4.290 4.227 4.368 . 0 0 "[ . 1]" 1
1785 1 43 ILE H 1 43 ILE HB 2.600 . 3.500 2.500 2.411 2.601 . 0 0 "[ . 1]" 1
1786 2 43 ILE H 2 43 ILE HB 2.600 . 3.500 2.461 2.353 2.510 . 0 0 "[ . 1]" 1
1787 1 42 LEU HG 1 43 ILE H 2.700 . 3.600 2.950 2.696 3.157 . 0 0 "[ . 1]" 1
1788 2 42 LEU HG 2 43 ILE H 2.700 . 3.600 2.961 2.759 3.249 . 0 0 "[ . 1]" 1
1789 1 43 ILE H 1 43 ILE MD 3.300 . 4.600 3.560 2.755 4.118 . 0 0 "[ . 1]" 1
1790 2 43 ILE H 2 43 ILE MD 3.300 . 4.600 3.232 2.688 3.957 . 0 0 "[ . 1]" 1
1791 1 42 LEU MD1 1 43 ILE H 3.900 . 5.800 2.847 2.414 3.082 . 0 0 "[ . 1]" 1
1792 2 42 LEU MD1 2 43 ILE H 3.900 . 5.800 2.911 2.515 3.153 . 0 0 "[ . 1]" 1
1793 1 43 ILE H 1 86 VAL H 4.300 . 6.000 3.483 3.394 3.656 . 0 0 "[ . 1]" 1
1794 2 43 ILE H 2 86 VAL H 4.300 . 6.000 3.496 3.219 3.732 . 0 0 "[ . 1]" 1
1795 1 44 ASP H 1 44 ASP HB2 3.100 . 4.300 3.222 2.975 3.385 . 0 0 "[ . 1]" 1
1796 2 44 ASP H 2 44 ASP HB2 3.100 . 4.300 3.331 3.231 3.445 . 0 0 "[ . 1]" 1
1797 1 43 ILE HA 1 44 ASP H 2.300 . 2.900 2.117 2.101 2.139 . 0 0 "[ . 1]" 1
1798 2 43 ILE HA 2 44 ASP H 2.300 . 2.900 2.120 2.094 2.143 . 0 0 "[ . 1]" 1
1799 1 44 ASP H 1 44 ASP HB3 2.600 . 3.500 2.305 2.231 2.481 . 0 0 "[ . 1]" 1
1800 2 44 ASP H 2 44 ASP HB3 2.600 . 3.500 2.276 2.207 2.341 . 0 0 "[ . 1]" 1
1801 1 43 ILE MD 1 44 ASP H 4.100 . 6.000 5.169 4.865 5.342 . 0 0 "[ . 1]" 1
1802 2 43 ILE MD 2 44 ASP H 4.100 . 6.000 5.110 4.530 5.312 . 0 0 "[ . 1]" 1
1803 1 42 LEU MD2 1 44 ASP H 3.600 . 5.200 4.480 4.296 4.596 . 0 0 "[ . 1]" 1
1804 2 42 LEU MD2 2 44 ASP H 3.600 . 5.200 4.438 3.981 4.693 . 0 0 "[ . 1]" 1
1805 1 44 ASP H 1 62 TYR QE 3.400 . 4.900 2.457 2.171 2.861 . 0 0 "[ . 1]" 1
1806 2 44 ASP H 2 62 TYR QE 3.400 . 4.900 2.496 2.169 2.838 . 0 0 "[ . 1]" 1
1807 1 44 ASP H 1 44 ASP HA 3.000 . 4.100 2.928 2.895 2.947 . 0 0 "[ . 1]" 1
1808 2 44 ASP H 2 44 ASP HA 3.000 . 4.100 2.928 2.920 2.936 . 0 0 "[ . 1]" 1
1809 1 42 LEU HB3 1 63 LYS H 3.700 . 5.400 4.303 4.048 4.667 . 0 0 "[ . 1]" 1
1810 2 42 LEU HB3 2 63 LYS H 3.700 . 5.400 4.304 4.016 4.621 . 0 0 "[ . 1]" 1
1811 1 42 LEU MD2 1 63 LYS H 3.900 . 5.800 4.722 4.511 4.912 . 0 0 "[ . 1]" 1
1812 2 42 LEU MD2 2 63 LYS H 3.900 . 5.800 4.650 3.922 4.944 . 0 0 "[ . 1]" 1
1813 1 62 TYR H 1 63 LYS H 4.200 . 6.000 4.367 4.315 4.433 . 0 0 "[ . 1]" 1
1814 2 62 TYR H 2 63 LYS H 4.200 . 6.000 4.349 4.294 4.387 . 0 0 "[ . 1]" 1
1815 1 63 LYS H 1 63 LYS HB3 3.300 . 4.700 3.786 3.695 3.857 . 0 0 "[ . 1]" 1
1816 2 63 LYS H 2 63 LYS HB3 3.300 . 4.700 3.822 3.712 3.902 . 0 0 "[ . 1]" 1
1817 1 41 THR MG 1 63 LYS H 3.300 . 4.700 3.431 2.773 3.866 . 0 0 "[ . 1]" 1
1818 2 41 THR MG 2 63 LYS H 3.300 . 4.700 3.236 2.900 3.589 . 0 0 "[ . 1]" 1
1819 1 59 VAL MG2 1 63 LYS H 4.300 . 6.000 4.652 4.067 5.061 . 0 0 "[ . 1]" 1
1820 2 59 VAL MG2 2 63 LYS H 4.300 . 6.000 4.880 4.640 5.261 . 0 0 "[ . 1]" 1
1821 1 43 ILE MD 1 63 LYS H 4.800 . 6.000 4.984 4.182 5.415 . 0 0 "[ . 1]" 1
1822 2 43 ILE MD 2 63 LYS H 4.800 . 6.000 4.804 3.543 5.529 . 0 0 "[ . 1]" 1
1823 1 62 TYR QD 1 63 LYS H 3.100 . 4.300 2.468 2.306 2.642 . 0 0 "[ . 1]" 1
1824 2 62 TYR QD 2 63 LYS H 3.100 . 4.300 2.474 2.320 2.802 . 0 0 "[ . 1]" 1
1825 1 62 TYR HA 1 63 LYS H 2.100 . 2.700 2.191 2.161 2.230 . 0 0 "[ . 1]" 1
1826 2 62 TYR HA 2 63 LYS H 2.100 . 2.700 2.178 2.154 2.231 . 0 0 "[ . 1]" 1
1827 1 63 LYS H 1 63 LYS HA 2.700 . 3.600 2.938 2.924 2.945 . 0 0 "[ . 1]" 1
1828 2 63 LYS H 2 63 LYS HA 2.700 . 3.600 2.939 2.922 2.950 . 0 0 "[ . 1]" 1
1829 1 63 LYS H 1 64 HIS H 3.700 . 5.400 4.219 4.065 4.293 . 0 0 "[ . 1]" 1
1830 2 63 LYS H 2 64 HIS H 3.700 . 5.400 4.255 4.212 4.349 . 0 0 "[ . 1]" 1
1831 1 62 TYR QB 1 63 LYS H 3.600 . 5.200 3.752 3.539 3.916 . 0 0 "[ . 1]" 1
1832 2 62 TYR QB 2 63 LYS H 3.600 . 5.200 3.625 3.293 3.767 . 0 0 "[ . 1]" 1
1833 1 42 LEU H 1 42 LEU HA 2.900 . 3.900 2.939 2.933 2.944 . 0 0 "[ . 1]" 1
1834 2 42 LEU H 2 42 LEU HA 2.900 . 3.900 2.940 2.933 2.942 . 0 0 "[ . 1]" 1
1835 1 42 LEU H 1 42 LEU HB3 2.500 . 3.300 2.447 2.371 2.495 . 0 0 "[ . 1]" 1
1836 2 42 LEU H 2 42 LEU HB3 2.500 . 3.300 2.448 2.394 2.545 . 0 0 "[ . 1]" 1
1837 1 41 THR MG 1 42 LEU H 2.400 . 3.100 2.367 1.941 2.775 . 0 0 "[ . 1]" 1
1838 2 41 THR MG 2 42 LEU H 2.400 . 3.100 2.267 2.039 2.696 . 0 0 "[ . 1]" 1
1839 1 42 LEU H 1 43 ILE H 4.400 . 6.000 4.376 4.306 4.415 . 0 0 "[ . 1]" 1
1840 2 42 LEU H 2 43 ILE H 4.400 . 6.000 4.360 4.306 4.398 . 0 0 "[ . 1]" 1
1841 1 41 THR H 1 42 LEU H 4.500 . 6.000 4.572 4.520 4.615 . 0 0 "[ . 1]" 1
1842 2 41 THR H 2 42 LEU H 4.500 . 6.000 4.575 4.532 4.618 . 0 0 "[ . 1]" 1
1843 1 41 THR HA 1 42 LEU H 2.200 . 2.800 2.276 2.233 2.311 . 0 0 "[ . 1]" 1
1844 2 41 THR HA 2 42 LEU H 2.200 . 2.800 2.269 2.237 2.312 . 0 0 "[ . 1]" 1
1845 1 41 THR HB 1 42 LEU H 3.900 . 5.800 3.556 3.219 3.882 . 0 0 "[ . 1]" 1
1846 2 41 THR HB 2 42 LEU H 3.900 . 5.800 3.662 3.397 4.011 . 0 0 "[ . 1]" 1
1847 1 120 TRP HE1 1 121 LEU MD2 4.100 . 6.000 5.632 5.347 5.840 . 0 0 "[ . 1]" 1
1848 2 120 TRP HE1 2 121 LEU MD2 4.100 . 6.000 5.666 5.239 5.909 . 0 0 "[ . 1]" 1
1849 1 57 PRO HB3 1 120 TRP HE1 4.000 . 6.000 3.009 2.822 3.239 . 0 0 "[ . 1]" 1
1850 2 57 PRO HB3 2 120 TRP HE1 4.000 . 6.000 2.983 2.733 3.245 . 0 0 "[ . 1]" 1
1851 1 57 PRO HB2 1 120 TRP HE1 4.700 . 6.000 3.928 3.599 4.309 . 0 0 "[ . 1]" 1
1852 2 57 PRO HB2 2 120 TRP HE1 4.700 . 6.000 3.955 3.670 4.235 . 0 0 "[ . 1]" 1
1853 1 120 TRP HE1 1 125 LEU MD1 3.000 . 4.100 4.143 4.088 4.214 0.114 1 0 "[ . 1]" 1
1854 2 120 TRP HE1 2 125 LEU MD1 3.000 . 4.100 4.147 4.095 4.181 0.081 1 0 "[ . 1]" 1
1855 1 57 PRO HA 1 120 TRP HE1 2.400 . 3.200 2.220 2.051 2.396 . 0 0 "[ . 1]" 1
1856 2 57 PRO HA 2 120 TRP HE1 2.400 . 3.200 2.204 1.973 2.381 . 0 0 "[ . 1]" 1
1857 1 120 TRP HE1 1 125 LEU HA 4.400 . 6.000 5.163 4.942 5.311 . 0 0 "[ . 1]" 1
1858 2 120 TRP HE1 2 125 LEU HA 4.400 . 6.000 5.159 4.985 5.439 . 0 0 "[ . 1]" 1
1859 1 64 HIS HB3 1 65 MET H 4.200 . 6.000 4.223 4.058 4.394 . 0 0 "[ . 1]" 1
1860 2 64 HIS HB3 2 65 MET H 4.200 . 6.000 4.233 4.094 4.384 . 0 0 "[ . 1]" 1
1861 1 65 MET H 1 65 MET HB3 3.900 . 5.800 3.343 3.176 3.538 . 0 0 "[ . 1]" 1
1862 2 65 MET H 2 65 MET HB3 3.900 . 5.800 3.347 3.136 3.593 . 0 0 "[ . 1]" 1
1863 1 43 ILE MD 1 65 MET H 4.600 . 6.000 5.885 5.392 6.123 0.123 9 0 "[ . 1]" 1
1864 2 43 ILE MD 2 65 MET H 4.600 . 6.000 5.989 5.439 6.093 0.093 10 0 "[ . 1]" 1
1865 1 64 HIS HD2 1 65 MET H 2.900 . 3.900 2.995 2.460 3.723 . 0 0 "[ . 1]" 1
1866 2 64 HIS HD2 2 65 MET H 2.900 . 3.900 3.096 2.392 3.846 . 0 0 "[ . 1]" 1
1867 1 64 HIS HA 1 65 MET H 2.300 . 3.000 2.169 2.158 2.188 . 0 0 "[ . 1]" 1
1868 2 64 HIS HA 2 65 MET H 2.300 . 3.000 2.172 2.147 2.202 . 0 0 "[ . 1]" 1
1869 1 65 MET H 1 65 MET HA 2.900 . 4.000 2.943 2.927 2.954 . 0 0 "[ . 1]" 1
1870 2 65 MET H 2 65 MET HA 2.900 . 4.000 2.940 2.926 2.955 . 0 0 "[ . 1]" 1
1871 1 65 MET H 1 65 MET HG2 4.300 . 6.000 4.747 4.567 4.908 . 0 0 "[ . 1]" 1
1872 2 65 MET H 2 65 MET HG2 4.300 . 6.000 4.597 3.153 4.976 . 0 0 "[ . 1]" 1
1873 1 65 MET H 1 65 MET HB2 3.100 . 4.300 2.363 2.276 2.574 . 0 0 "[ . 1]" 1
1874 2 65 MET H 2 65 MET HB2 3.100 . 4.300 2.384 2.205 2.633 . 0 0 "[ . 1]" 1
1875 2 45 VAL MG2 2 67 ARG H 4.400 . 6.000 5.974 4.956 6.183 0.183 3 0 "[ . 1]" 1
1876 2 96 ALA H 2 97 LEU HB3 4.400 . 6.000 6.033 5.962 6.166 0.166 5 0 "[ . 1]" 1
1877 2 73 LEU HB3 2 75 ALA H 4.500 . 6.000 5.551 5.067 5.896 . 0 0 "[ . 1]" 1
1878 2 13 ALA HA 2 15 VAL H 4.400 . 6.000 4.860 4.754 5.021 . 0 0 "[ . 1]" 1
1879 1 24 MET ME 1 25 LEU H 3.200 . 4.500 3.688 3.300 4.175 . 0 0 "[ . 1]" 1
1880 2 24 MET ME 2 25 LEU H 3.200 . 4.500 3.564 3.247 4.293 . 0 0 "[ . 1]" 1
1881 1 24 MET HA 1 24 MET ME 2.600 . 3.400 2.697 2.192 3.083 . 0 0 "[ . 1]" 1
1882 2 24 MET HA 2 24 MET ME 2.600 . 3.400 2.548 2.126 3.242 . 0 0 "[ . 1]" 1
1883 1 40 ILE HA 1 40 ILE MD 3.900 . 5.800 3.780 3.296 3.946 . 0 0 "[ . 1]" 1
1884 2 40 ILE HA 2 40 ILE MD 3.900 . 5.800 3.784 3.714 3.825 . 0 0 "[ . 1]" 1
1885 1 24 MET ME 1 24 MET HG3 2.400 . 3.100 3.012 2.006 3.339 0.239 3 0 "[ . 1]" 1
1886 2 24 MET ME 2 24 MET HG3 2.400 . 3.100 3.186 2.062 3.402 0.302 2 0 "[ . 1]" 1
1887 1 40 ILE HB 1 40 ILE MD 2.500 . 3.300 2.492 2.312 2.895 . 0 0 "[ . 1]" 1
1888 2 40 ILE HB 2 40 ILE MD 2.500 . 3.300 2.512 2.379 2.604 . 0 0 "[ . 1]" 1
1889 1 40 ILE MD 1 109 THR MG 3.600 . 5.200 4.768 4.288 5.021 . 0 0 "[ . 1]" 1
1890 2 40 ILE MD 2 109 THR MG 3.600 . 5.200 4.922 4.588 5.137 . 0 0 "[ . 1]" 1
1891 1 37 ASN HB3 1 40 ILE MD 3.300 . 4.700 3.133 2.789 3.791 . 0 0 "[ . 1]" 1
1892 2 37 ASN HB3 2 40 ILE MD 3.300 . 4.700 3.193 2.731 3.522 . 0 0 "[ . 1]" 1
1893 1 40 ILE MD 1 111 TYR QD 4.100 . 6.000 4.821 4.291 5.107 . 0 0 "[ . 1]" 1
1894 2 40 ILE MD 2 111 TYR QD 4.100 . 6.000 4.858 4.610 5.139 . 0 0 "[ . 1]" 1
1895 1 37 ASN HB2 1 40 ILE MD 2.800 . 3.800 2.299 1.918 3.010 . 0 0 "[ . 1]" 1
1896 2 37 ASN HB2 2 40 ILE MD 2.800 . 3.800 2.342 1.993 2.693 . 0 0 "[ . 1]" 1
1897 1 40 ILE MD 1 111 TYR QE 3.200 . 4.500 3.203 2.712 3.529 . 0 0 "[ . 1]" 1
1898 2 40 ILE MD 2 111 TYR QE 3.200 . 4.500 3.234 2.926 3.532 . 0 0 "[ . 1]" 1
1899 1 43 ILE HB 1 43 ILE MD 2.300 . 3.000 2.237 1.995 2.447 . 0 0 "[ . 1]" 1
1900 2 43 ILE HB 2 43 ILE MD 2.300 . 3.000 2.226 2.033 2.371 . 0 0 "[ . 1]" 1
1901 1 43 ILE MD 1 85 VAL HB 2.600 . 3.500 2.826 2.363 3.176 . 0 0 "[ . 1]" 1
1902 2 43 ILE MD 2 85 VAL HB 2.600 . 3.500 2.755 2.396 3.339 . 0 0 "[ . 1]" 1
1903 1 43 ILE MD 1 102 LEU MD1 2.400 . 3.100 2.952 2.595 3.152 0.052 8 0 "[ . 1]" 1
1904 2 43 ILE MD 2 102 LEU MD1 2.400 . 3.100 2.910 2.123 3.157 0.057 4 0 "[ . 1]" 1
1905 1 43 ILE MD 1 85 VAL MG1 2.800 . 3.800 2.294 1.981 2.435 . 0 0 "[ . 1]" 1
1906 2 43 ILE MD 2 85 VAL MG1 2.800 . 3.800 2.397 1.986 3.163 . 0 0 "[ . 1]" 1
1907 1 43 ILE MD 1 43 ILE HG13 2.100 . 2.700 2.094 2.074 2.120 . 0 0 "[ . 1]" 1
1908 2 43 ILE MD 2 43 ILE HG13 2.100 . 2.700 2.099 2.077 2.122 . 0 0 "[ . 1]" 1
1909 1 43 ILE HA 1 43 ILE MD 3.800 . 5.600 3.640 3.104 3.867 . 0 0 "[ . 1]" 1
1910 2 43 ILE HA 2 43 ILE MD 3.800 . 5.600 3.493 2.725 3.830 . 0 0 "[ . 1]" 1
1911 1 107 PHE HB2 1 110 ILE MD 3.500 . 5.000 3.223 2.823 3.504 . 0 0 "[ . 1]" 1
1912 2 107 PHE HB2 2 110 ILE MD 3.500 . 5.000 3.141 3.006 3.284 . 0 0 "[ . 1]" 1
1913 1 102 LEU MD2 1 110 ILE MD 4.100 . 6.000 3.955 3.806 4.178 . 0 0 "[ . 1]" 1
1914 2 102 LEU MD2 2 110 ILE MD 4.100 . 6.000 3.854 3.619 4.001 . 0 0 "[ . 1]" 1
1915 1 107 PHE HB3 1 110 ILE MD 3.200 . 4.500 3.174 2.742 3.585 . 0 0 "[ . 1]" 1
1916 2 107 PHE HB3 2 110 ILE MD 3.200 . 4.500 3.098 2.807 3.560 . 0 0 "[ . 1]" 1
1917 1 102 LEU H 1 110 ILE MD 4.100 . 6.000 3.627 3.458 3.746 . 0 0 "[ . 1]" 1
1918 2 102 LEU H 2 110 ILE MD 4.100 . 6.000 3.574 3.453 3.714 . 0 0 "[ . 1]" 1
1919 1 107 PHE QD 1 110 ILE MD 3.200 . 4.500 3.210 2.568 3.467 . 0 0 "[ . 1]" 1
1920 2 107 PHE QD 2 110 ILE MD 3.200 . 4.500 3.267 2.732 3.755 . 0 0 "[ . 1]" 1
1921 1 110 ILE HB 1 110 ILE MD 2.300 . 2.900 2.126 1.996 2.234 . 0 0 "[ . 1]" 1
1922 2 110 ILE HB 2 110 ILE MD 2.300 . 2.900 2.087 1.989 2.203 . 0 0 "[ . 1]" 1
1923 1 110 ILE MD 1 110 ILE HG12 2.200 . 2.800 2.097 2.071 2.118 . 0 0 "[ . 1]" 1
1924 2 110 ILE MD 2 110 ILE HG12 2.200 . 2.800 2.088 2.071 2.114 . 0 0 "[ . 1]" 1
1925 1 102 LEU MD1 1 110 ILE MD 2.600 . 3.400 2.347 2.042 2.636 . 0 0 "[ . 1]" 1
1926 2 102 LEU MD1 2 110 ILE MD 2.600 . 3.400 2.283 2.110 2.461 . 0 0 "[ . 1]" 1
1927 1 110 ILE HA 1 110 ILE MD 2.800 . 3.800 3.246 3.083 3.396 . 0 0 "[ . 1]" 1
1928 2 110 ILE HA 2 110 ILE MD 2.800 . 3.800 3.294 3.110 3.420 . 0 0 "[ . 1]" 1
1929 1 40 ILE HB 1 40 ILE MG 2.200 . 2.800 2.113 2.090 2.131 . 0 0 "[ . 1]" 1
1930 2 40 ILE HB 2 40 ILE MG 2.200 . 2.800 2.107 2.084 2.126 . 0 0 "[ . 1]" 1
1931 1 40 ILE MG 1 85 VAL MG1 3.600 . 5.200 3.918 3.671 4.143 . 0 0 "[ . 1]" 1
1932 2 40 ILE MG 2 85 VAL MG1 3.600 . 5.200 3.931 3.759 4.095 . 0 0 "[ . 1]" 1
1933 1 33 LEU MD2 1 40 ILE MG 4.000 . 6.000 3.902 3.722 4.235 . 0 0 "[ . 1]" 1
1934 2 33 LEU MD2 2 40 ILE MG 4.000 . 6.000 3.885 3.487 4.255 . 0 0 "[ . 1]" 1
1935 1 40 ILE MG 1 85 VAL HA 2.800 . 3.700 2.813 2.369 3.085 . 0 0 "[ . 1]" 1
1936 2 40 ILE MG 2 85 VAL HA 2.800 . 3.700 2.801 2.562 2.948 . 0 0 "[ . 1]" 1
1937 1 30 ALA HA 1 30 ALA MB 2.400 . 3.100 2.121 2.108 2.129 . 0 0 "[ . 1]" 1
1938 2 30 ALA HA 2 30 ALA MB 2.400 . 3.100 2.119 2.108 2.126 . 0 0 "[ . 1]" 1
1939 1 27 PRO HA 1 30 ALA MB 2.700 . 3.600 2.313 1.948 2.832 . 0 0 "[ . 1]" 1
1940 2 27 PRO HA 2 30 ALA MB 2.700 . 3.600 2.283 2.045 2.505 . 0 0 "[ . 1]" 1
1941 1 30 ALA MB 1 33 LEU MD1 2.400 . 3.100 3.131 2.993 3.179 0.079 8 0 "[ . 1]" 1
1942 2 30 ALA MB 2 33 LEU MD1 2.400 . 3.100 3.150 3.131 3.174 0.074 5 0 "[ . 1]" 1
1943 1 30 ALA MB 1 86 VAL MG1 2.000 . 2.500 2.457 2.099 2.538 0.038 6 0 "[ . 1]" 1
1944 2 30 ALA MB 2 86 VAL MG1 2.000 . 2.500 2.478 2.335 2.531 0.031 7 0 "[ . 1]" 1
1945 1 43 ILE MG 1 65 MET HA 4.700 . 6.000 4.623 4.372 5.107 . 0 0 "[ . 1]" 1
1946 2 43 ILE MG 2 65 MET HA 4.700 . 6.000 4.525 4.257 4.662 . 0 0 "[ . 1]" 1
1947 1 43 ILE MG 1 65 MET HG2 3.700 . 5.500 3.857 3.472 4.470 . 0 0 "[ . 1]" 1
1948 2 43 ILE MG 2 65 MET HG2 3.700 . 5.500 3.680 2.035 4.478 . 0 0 "[ . 1]" 1
1949 1 43 ILE HG13 1 43 ILE MG 2.800 . 3.800 3.050 2.722 3.198 . 0 0 "[ . 1]" 1
1950 2 43 ILE HG13 2 43 ILE MG 2.800 . 3.800 2.953 2.599 3.189 . 0 0 "[ . 1]" 1
1951 1 43 ILE H 1 43 ILE MG 3.800 . 5.600 3.736 3.603 3.835 . 0 0 "[ . 1]" 1
1952 2 43 ILE H 2 43 ILE MG 3.800 . 5.600 3.714 3.484 3.785 . 0 0 "[ . 1]" 1
1953 1 43 ILE MG 1 87 VAL HA 3.800 . 5.600 3.766 3.425 4.218 . 0 0 "[ . 1]" 1
1954 2 43 ILE MG 2 87 VAL HA 3.800 . 5.600 3.686 2.876 3.966 . 0 0 "[ . 1]" 1
1955 1 10 THR MG 1 13 ALA MB 3.100 . 4.300 3.016 2.699 3.249 . 0 0 "[ . 1]" 1
1956 2 10 THR MG 2 13 ALA MB 3.100 . 4.300 3.071 2.676 3.262 . 0 0 "[ . 1]" 1
1957 1 45 VAL HB 1 45 VAL MG2 3.100 . 4.300 2.113 2.089 2.131 . 0 0 "[ . 1]" 1
1958 2 45 VAL HB 2 45 VAL MG2 3.100 . 4.300 2.110 2.083 2.131 . 0 0 "[ . 1]" 1
1959 1 87 VAL HB 1 95 ALA MB 2.100 . 2.700 1.894 1.483 2.696 0.017 3 0 "[ . 1]" 1
1960 2 87 VAL HB 2 95 ALA MB 2.100 . 2.700 1.881 1.478 2.341 0.022 3 0 "[ . 1]" 1
1961 1 95 ALA HA 1 95 ALA MB 2.300 . 3.000 2.114 2.080 2.133 . 0 0 "[ . 1]" 1
1962 2 95 ALA HA 2 95 ALA MB 2.300 . 3.000 2.112 2.085 2.130 . 0 0 "[ . 1]" 1
1963 1 87 VAL MG1 1 95 ALA MB 3.300 . 4.600 3.244 2.740 3.918 . 0 0 "[ . 1]" 1
1964 2 87 VAL MG1 2 95 ALA MB 3.300 . 4.600 3.247 2.800 3.673 . 0 0 "[ . 1]" 1
1965 1 10 THR HA 1 13 ALA MB 2.400 . 3.100 2.336 2.112 2.519 . 0 0 "[ . 1]" 1
1966 2 10 THR HA 2 13 ALA MB 2.400 . 3.100 2.366 2.199 2.575 . 0 0 "[ . 1]" 1
1967 1 13 ALA HA 1 13 ALA MB 2.000 . 2.500 2.119 2.092 2.131 . 0 0 "[ . 1]" 1
1968 2 13 ALA HA 2 13 ALA MB 2.000 . 2.500 2.120 2.091 2.130 . 0 0 "[ . 1]" 1
1969 1 88 PHE HA 1 95 ALA MB 3.000 . 4.100 3.774 3.417 4.071 . 0 0 "[ . 1]" 1
1970 2 88 PHE HA 2 95 ALA MB 3.000 . 4.100 3.820 3.589 4.163 0.063 4 0 "[ . 1]" 1
1971 1 95 ALA MB 1 96 ALA MB 3.100 . 4.300 4.032 3.505 4.321 0.021 6 0 "[ . 1]" 1
1972 2 95 ALA MB 2 96 ALA MB 3.100 . 4.300 4.036 3.610 4.320 0.020 5 0 "[ . 1]" 1
1973 1 45 VAL MG2 1 95 ALA MB 2.700 . 3.600 2.428 1.954 3.000 . 0 0 "[ . 1]" 1
1974 2 45 VAL MG2 2 95 ALA MB 2.700 . 3.600 2.511 2.144 3.033 . 0 0 "[ . 1]" 1
1975 1 45 VAL MG2 1 95 ALA HA 2.700 . 3.600 2.122 1.813 2.416 . 0 0 "[ . 1]" 1
1976 2 45 VAL MG2 2 95 ALA HA 2.700 . 3.600 2.178 2.005 2.703 . 0 0 "[ . 1]" 1
1977 1 20 ALA HA 1 20 ALA MB 1.900 . 2.400 2.093 2.081 2.125 . 0 0 "[ . 1]" 1
1978 2 20 ALA HA 2 20 ALA MB 1.900 . 2.400 2.094 2.083 2.104 . 0 0 "[ . 1]" 1
1979 1 98 ALA HA 1 98 ALA MB 2.300 . 3.000 2.112 2.089 2.129 . 0 0 "[ . 1]" 1
1980 2 98 ALA HA 2 98 ALA MB 2.300 . 3.000 2.116 2.091 2.132 . 0 0 "[ . 1]" 1
1981 1 75 ALA HA 1 75 ALA MB 2.300 . 2.900 2.105 2.079 2.130 . 0 0 "[ . 1]" 1
1982 2 75 ALA HA 2 75 ALA MB 2.300 . 2.900 2.093 2.075 2.125 . 0 0 "[ . 1]" 1
1983 1 75 ALA MB 2 7 PHE QD 3.900 . 5.800 4.216 3.381 5.272 . 0 0 "[ . 1]" 1
1984 1 7 PHE QD 2 75 ALA MB 3.900 . 5.800 4.119 2.771 4.761 . 0 0 "[ . 1]" 1
1985 1 95 ALA HA 1 98 ALA MB 2.600 . 3.500 2.813 2.230 3.337 . 0 0 "[ . 1]" 1
1986 2 95 ALA HA 2 98 ALA MB 2.600 . 3.500 2.802 2.413 3.106 . 0 0 "[ . 1]" 1
1987 1 70 LEU MD2 1 98 ALA MB 2.300 . 2.900 2.152 1.748 2.916 0.016 10 0 "[ . 1]" 1
1988 2 70 LEU MD2 2 98 ALA MB 2.300 . 2.900 2.023 1.689 2.795 0.011 6 0 "[ . 1]" 1
1989 1 110 ILE HB 1 110 ILE MG 2.300 . 2.900 2.093 2.076 2.121 . 0 0 "[ . 1]" 1
1990 2 110 ILE HB 2 110 ILE MG 2.300 . 2.900 2.089 2.075 2.113 . 0 0 "[ . 1]" 1
1991 1 59 VAL MG2 1 62 TYR HA 3.400 . 4.800 2.922 2.180 3.449 . 0 0 "[ . 1]" 1
1992 2 59 VAL MG2 2 62 TYR HA 3.400 . 4.800 3.249 2.860 3.961 . 0 0 "[ . 1]" 1
1993 1 59 VAL MG2 1 62 TYR QE 4.400 . 6.000 4.846 4.102 5.319 . 0 0 "[ . 1]" 1
1994 2 59 VAL MG2 2 62 TYR QE 4.400 . 6.000 4.959 3.809 5.438 . 0 0 "[ . 1]" 1
1995 1 85 VAL MG2 1 86 VAL H 3.600 . 5.200 3.936 3.696 4.102 . 0 0 "[ . 1]" 1
1996 2 85 VAL MG2 2 86 VAL H 3.600 . 5.200 3.857 3.378 4.141 . 0 0 "[ . 1]" 1
1997 1 85 VAL HB 1 85 VAL MG2 2.300 . 3.000 2.117 2.106 2.129 . 0 0 "[ . 1]" 1
1998 2 85 VAL HB 2 85 VAL MG2 2.300 . 3.000 2.116 2.089 2.128 . 0 0 "[ . 1]" 1
1999 1 59 VAL HA 1 59 VAL MG2 3.200 . 4.500 3.176 3.093 3.207 . 0 0 "[ . 1]" 1
2000 2 59 VAL HA 2 59 VAL MG2 3.200 . 4.500 3.175 3.122 3.210 . 0 0 "[ . 1]" 1
2001 1 84 PRO HA 1 85 VAL MG2 3.800 . 5.600 3.329 3.024 3.733 . 0 0 "[ . 1]" 1
2002 2 84 PRO HA 2 85 VAL MG2 3.800 . 5.600 3.467 3.188 4.110 . 0 0 "[ . 1]" 1
2003 1 75 ALA MB 2 8 ASP QB 2.200 . 2.800 2.092 1.759 2.575 . 0 0 "[ . 1]" 1
2004 1 8 ASP QB 2 75 ALA MB 2.200 . 2.800 2.006 1.675 2.537 . 0 0 "[ . 1]" 1
2005 1 42 LEU HB3 1 59 VAL MG2 2.600 . 3.500 2.826 2.614 3.199 . 0 0 "[ . 1]" 1
2006 2 42 LEU HB3 2 59 VAL MG2 2.600 . 3.500 2.877 2.421 3.272 . 0 0 "[ . 1]" 1
2007 1 43 ILE MD 1 85 VAL MG2 2.500 . 3.300 3.191 2.649 3.325 0.025 7 0 "[ . 1]" 1
2008 2 43 ILE MD 2 85 VAL MG2 2.500 . 3.300 3.177 2.524 3.347 0.047 7 0 "[ . 1]" 1
2009 1 85 VAL MG1 1 85 VAL MG2 2.000 . 2.500 2.032 1.964 2.069 . 0 0 "[ . 1]" 1
2010 2 85 VAL MG1 2 85 VAL MG2 2.000 . 2.500 2.022 1.896 2.083 . 0 0 "[ . 1]" 1
2011 1 110 ILE HG12 1 110 ILE MG 2.300 . 2.900 2.020 1.941 2.161 . 0 0 "[ . 1]" 1
2012 2 110 ILE HG12 2 110 ILE MG 2.300 . 2.900 2.035 1.911 2.159 . 0 0 "[ . 1]" 1
2013 1 59 VAL MG1 1 59 VAL MG2 2.100 . 2.600 1.958 1.846 2.078 . 0 0 "[ . 1]" 1
2014 2 59 VAL MG1 2 59 VAL MG2 2.100 . 2.600 2.012 1.883 2.080 . 0 0 "[ . 1]" 1
2015 1 59 VAL MG2 1 62 TYR QB 2.400 . 3.100 1.710 1.598 1.841 0.102 1 0 "[ . 1]" 1
2016 2 59 VAL MG2 2 62 TYR QB 2.400 . 3.100 1.743 1.665 1.860 0.035 10 0 "[ . 1]" 1
2017 1 59 VAL HB 1 59 VAL MG2 2.200 . 2.800 2.097 2.077 2.127 . 0 0 "[ . 1]" 1
2018 2 59 VAL HB 2 59 VAL MG2 2.200 . 2.800 2.113 2.096 2.127 . 0 0 "[ . 1]" 1
2019 1 86 VAL MG2 1 87 VAL HA 3.100 . 4.300 3.650 3.563 3.732 . 0 0 "[ . 1]" 1
2020 2 86 VAL MG2 2 87 VAL HA 3.100 . 4.300 3.655 3.539 3.736 . 0 0 "[ . 1]" 1
2021 1 86 VAL MG2 1 112 ASN HA 2.800 . 3.800 3.257 2.986 3.545 . 0 0 "[ . 1]" 1
2022 2 86 VAL MG2 2 112 ASN HA 2.800 . 3.800 3.297 3.054 3.474 . 0 0 "[ . 1]" 1
2023 1 86 VAL MG2 1 87 VAL H 2.200 . 2.800 2.200 1.950 2.404 . 0 0 "[ . 1]" 1
2024 2 86 VAL MG2 2 87 VAL H 2.200 . 2.800 2.195 2.000 2.394 . 0 0 "[ . 1]" 1
2025 1 53 ALA MB 1 54 MET HG2 2.800 . 3.800 3.309 2.614 3.801 0.001 4 0 "[ . 1]" 1
2026 2 53 ALA MB 2 54 MET HG2 2.800 . 3.800 3.356 2.137 3.814 0.014 4 0 "[ . 1]" 1
2027 1 53 ALA MB 1 54 MET HA 3.600 . 5.200 3.783 3.670 3.858 . 0 0 "[ . 1]" 1
2028 2 53 ALA MB 2 54 MET HA 3.600 . 5.200 3.740 3.678 3.789 . 0 0 "[ . 1]" 1
2029 1 53 ALA MB 1 54 MET HG3 2.700 . 3.600 3.435 2.759 3.832 0.232 7 0 "[ . 1]" 1
2030 2 53 ALA MB 2 54 MET HG3 2.700 . 3.600 3.351 2.569 3.652 0.052 3 0 "[ . 1]" 1
2031 1 45 VAL HA 1 45 VAL MG1 2.600 . 3.500 2.085 1.910 2.205 . 0 0 "[ . 1]" 1
2032 2 45 VAL HA 2 45 VAL MG1 2.600 . 3.500 2.126 2.003 2.228 . 0 0 "[ . 1]" 1
2033 1 45 VAL H 1 45 VAL MG1 3.600 . 5.200 3.615 3.371 3.858 . 0 0 "[ . 1]" 1
2034 2 45 VAL H 2 45 VAL MG1 3.600 . 5.200 3.648 3.164 3.903 . 0 0 "[ . 1]" 1
2035 1 10 THR HA 1 10 THR MG 2.200 . 2.800 2.002 1.928 2.153 . 0 0 "[ . 1]" 1
2036 2 10 THR HA 2 10 THR MG 2.200 . 2.800 2.123 2.034 2.206 . 0 0 "[ . 1]" 1
2037 1 10 THR HB 1 10 THR MG 2.200 . 2.800 2.105 2.094 2.123 . 0 0 "[ . 1]" 1
2038 2 10 THR HB 2 10 THR MG 2.200 . 2.800 2.126 2.107 2.137 . 0 0 "[ . 1]" 1
2039 1 10 THR MG 1 14 GLN HG3 2.900 . 4.000 3.546 2.726 4.018 0.018 5 0 "[ . 1]" 1
2040 2 10 THR MG 2 14 GLN HG3 2.900 . 4.000 3.428 2.665 4.032 0.032 6 0 "[ . 1]" 1
2041 1 10 THR MG 2 105 TYR QD 2.900 . 4.000 3.256 2.713 3.568 . 0 0 "[ . 1]" 1
2042 1 105 TYR QD 2 10 THR MG 2.900 . 4.000 3.158 2.675 3.549 . 0 0 "[ . 1]" 1
2043 1 10 THR MG 2 105 TYR QE 2.700 . 3.600 2.303 1.829 2.671 . 0 0 "[ . 1]" 1
2044 1 105 TYR QE 2 10 THR MG 2.700 . 3.600 2.416 2.043 2.866 . 0 0 "[ . 1]" 1
2045 1 10 THR MG 1 14 GLN HG2 3.900 . 5.800 4.640 3.993 5.312 . 0 0 "[ . 1]" 1
2046 2 10 THR MG 2 14 GLN HG2 3.900 . 5.800 4.076 3.450 5.273 . 0 0 "[ . 1]" 1
2047 1 23 VAL HA 1 23 VAL MG2 2.300 . 2.900 2.448 2.383 2.561 . 0 0 "[ . 1]" 1
2048 2 23 VAL HA 2 23 VAL MG2 2.300 . 2.900 2.479 2.389 2.620 . 0 0 "[ . 1]" 1
2049 1 23 VAL MG2 1 111 TYR HA 4.100 . 6.000 3.734 3.326 4.044 . 0 0 "[ . 1]" 1
2050 2 23 VAL MG2 2 111 TYR HA 4.100 . 6.000 3.630 3.332 3.865 . 0 0 "[ . 1]" 1
2051 1 23 VAL MG2 1 111 TYR QE 3.200 . 4.500 4.287 3.973 4.518 0.018 1 0 "[ . 1]" 1
2052 2 23 VAL MG2 2 111 TYR QE 3.200 . 4.500 4.110 3.607 4.479 . 0 0 "[ . 1]" 1
2053 1 23 VAL MG1 1 23 VAL MG2 2.000 . 2.500 2.017 1.882 2.061 . 0 0 "[ . 1]" 1
2054 2 23 VAL MG1 2 23 VAL MG2 2.000 . 2.500 2.025 1.948 2.087 . 0 0 "[ . 1]" 1
2055 1 7 PHE HA 1 10 THR MG 3.900 . 5.800 4.087 3.877 4.365 . 0 0 "[ . 1]" 1
2056 2 7 PHE HA 2 10 THR MG 3.900 . 5.800 4.119 3.902 4.354 . 0 0 "[ . 1]" 1
2057 1 23 VAL MG2 1 111 TYR QD 3.300 . 4.600 3.892 3.573 4.165 . 0 0 "[ . 1]" 1
2058 2 23 VAL MG2 2 111 TYR QD 3.300 . 4.600 3.708 3.278 4.031 . 0 0 "[ . 1]" 1
2059 1 87 VAL MG2 1 111 TYR H 3.500 . 5.000 4.256 4.085 4.483 . 0 0 "[ . 1]" 1
2060 2 87 VAL MG2 2 111 TYR H 3.500 . 5.000 4.269 4.104 4.434 . 0 0 "[ . 1]" 1
2061 1 87 VAL MG2 1 111 TYR HB2 4.200 . 6.000 4.697 4.542 4.888 . 0 0 "[ . 1]" 1
2062 2 87 VAL MG2 2 111 TYR HB2 4.100 . 6.000 4.696 4.571 4.806 . 0 0 "[ . 1]" 1
2063 1 87 VAL HB 1 87 VAL MG1 2.200 . 2.800 2.104 2.085 2.124 . 0 0 "[ . 1]" 1
2064 2 87 VAL HB 2 87 VAL MG1 2.200 . 2.800 2.100 2.080 2.119 . 0 0 "[ . 1]" 1
2065 1 86 VAL HA 1 87 VAL MG2 3.500 . 5.000 3.560 3.404 3.729 . 0 0 "[ . 1]" 1
2066 2 86 VAL HA 2 87 VAL MG2 3.500 . 5.000 3.545 3.408 3.707 . 0 0 "[ . 1]" 1
2067 1 42 LEU MD1 1 87 VAL MG1 3.500 . 5.000 4.478 4.243 4.670 . 0 0 "[ . 1]" 1
2068 2 42 LEU MD1 2 87 VAL MG1 3.500 . 5.000 4.506 4.301 4.938 . 0 0 "[ . 1]" 1
2069 1 86 VAL HA 1 87 VAL MG1 3.000 . 4.100 3.843 3.698 3.980 . 0 0 "[ . 1]" 1
2070 2 86 VAL HA 2 87 VAL MG1 3.000 . 4.100 3.881 3.765 4.026 . 0 0 "[ . 1]" 1
2071 1 15 VAL HB 1 15 VAL MG1 2.100 . 2.700 2.109 2.083 2.130 . 0 0 "[ . 1]" 1
2072 2 15 VAL HB 2 15 VAL MG1 2.100 . 2.700 2.112 2.084 2.125 . 0 0 "[ . 1]" 1
2073 1 23 VAL MG1 1 111 TYR QD 2.400 . 3.100 2.505 2.261 2.693 . 0 0 "[ . 1]" 1
2074 2 23 VAL MG1 2 111 TYR QD 2.400 . 3.100 2.428 2.094 2.655 . 0 0 "[ . 1]" 1
2075 1 23 VAL HB 1 23 VAL MG1 2.300 . 3.000 2.107 2.086 2.129 . 0 0 "[ . 1]" 1
2076 2 23 VAL HB 2 23 VAL MG1 2.300 . 3.000 2.110 2.087 2.129 . 0 0 "[ . 1]" 1
2077 1 97 LEU MD2 1 100 LYS HB3 3.800 . 5.600 5.061 4.737 5.427 . 0 0 "[ . 1]" 1
2078 2 97 LEU MD2 2 100 LYS HB3 3.800 . 5.600 4.892 4.466 5.364 . 0 0 "[ . 1]" 1
2079 1 15 VAL MG1 1 15 VAL MG2 2.200 . 2.800 2.039 1.919 2.094 . 0 0 "[ . 1]" 1
2080 2 15 VAL MG1 2 15 VAL MG2 2.200 . 2.800 2.045 1.945 2.101 . 0 0 "[ . 1]" 1
2081 1 23 VAL MG1 1 25 LEU MD1 3.500 . 5.000 3.561 2.986 3.815 . 0 0 "[ . 1]" 1
2082 2 23 VAL MG1 2 25 LEU MD1 3.500 . 5.000 3.479 2.809 3.836 . 0 0 "[ . 1]" 1
2083 1 23 VAL MG1 1 111 TYR HA 3.700 . 5.500 3.763 3.527 3.999 . 0 0 "[ . 1]" 1
2084 2 23 VAL MG1 2 111 TYR HA 3.700 . 5.500 3.744 3.533 3.966 . 0 0 "[ . 1]" 1
2085 1 97 LEU MD1 1 97 LEU MD2 2.100 . 2.700 2.005 1.884 2.060 . 0 0 "[ . 1]" 1
2086 2 97 LEU MD1 2 97 LEU MD2 2.100 . 2.700 1.982 1.876 2.079 . 0 0 "[ . 1]" 1
2087 1 97 LEU HA 1 97 LEU MD2 2.300 . 2.900 2.281 2.086 2.527 . 0 0 "[ . 1]" 1
2088 2 97 LEU HA 2 97 LEU MD2 2.200 . 2.800 2.301 2.079 2.523 . 0 0 "[ . 1]" 1
2089 1 23 VAL HA 1 23 VAL MG1 2.400 . 3.100 2.313 2.210 2.424 . 0 0 "[ . 1]" 1
2090 2 23 VAL HA 2 23 VAL MG1 2.400 . 3.100 2.320 2.197 2.391 . 0 0 "[ . 1]" 1
2091 1 23 VAL MG1 1 111 TYR QE 2.800 . 3.800 3.468 3.256 3.722 . 0 0 "[ . 1]" 1
2092 2 23 VAL MG1 2 111 TYR QE 2.800 . 3.800 3.374 3.041 3.597 . 0 0 "[ . 1]" 1
2093 1 41 THR MG 1 63 LYS HG2 2.600 . 3.400 3.106 2.339 3.448 0.048 7 0 "[ . 1]" 1
2094 2 41 THR MG 2 63 LYS HG2 2.600 . 3.400 3.155 2.196 3.440 0.040 7 0 "[ . 1]" 1
2095 1 109 THR HB 1 109 THR MG 2.300 . 3.000 2.113 2.098 2.135 . 0 0 "[ . 1]" 1
2096 2 109 THR HB 2 109 THR MG 2.300 . 3.000 2.118 2.095 2.135 . 0 0 "[ . 1]" 1
2097 1 109 THR HA 1 109 THR MG 2.200 . 2.800 2.063 1.963 2.233 . 0 0 "[ . 1]" 1
2098 2 109 THR HA 2 109 THR MG 2.200 . 2.800 2.093 1.941 2.201 . 0 0 "[ . 1]" 1
2099 1 85 VAL H 1 109 THR MG 4.000 . 6.000 5.175 4.810 5.460 . 0 0 "[ . 1]" 1
2100 2 85 VAL H 2 109 THR MG 4.000 . 6.000 5.205 4.934 5.548 . 0 0 "[ . 1]" 1
2101 1 41 THR MG 1 63 LYS QE 3.500 . 5.000 2.091 1.950 2.611 0.050 2 0 "[ . 1]" 1
2102 2 41 THR MG 2 63 LYS QE 3.500 . 5.000 2.020 1.913 2.221 0.087 6 0 "[ . 1]" 1
2103 1 84 PRO HB2 1 109 THR MG 3.900 . 5.800 4.676 4.105 5.020 . 0 0 "[ . 1]" 1
2104 2 84 PRO HB2 2 109 THR MG 3.900 . 5.800 4.757 4.432 5.077 . 0 0 "[ . 1]" 1
2105 1 41 THR HA 1 41 THR MG 2.100 . 2.700 2.124 1.976 2.338 . 0 0 "[ . 1]" 1
2106 2 41 THR HA 2 41 THR MG 2.100 . 2.700 2.181 1.947 2.460 . 0 0 "[ . 1]" 1
2107 1 102 LEU MD2 1 107 PHE QD 3.600 . 5.200 3.146 3.069 3.383 . 0 0 "[ . 1]" 1
2108 2 102 LEU MD2 2 107 PHE QD 3.600 . 5.200 3.026 2.791 3.248 . 0 0 "[ . 1]" 1
2109 1 101 THR MG 1 102 LEU MD2 3.400 . 4.900 4.438 3.983 4.946 0.046 1 0 "[ . 1]" 1
2110 2 101 THR MG 2 102 LEU MD2 3.400 . 4.900 4.430 3.986 4.897 . 0 0 "[ . 1]" 1
2111 1 101 THR MG 1 102 LEU H 3.300 . 4.700 3.821 3.635 3.978 . 0 0 "[ . 1]" 1
2112 2 101 THR MG 2 102 LEU H 3.300 . 4.700 3.910 3.820 4.010 . 0 0 "[ . 1]" 1
2113 1 101 THR MG 1 105 TYR QE 2.600 . 3.400 2.760 2.288 3.411 0.011 1 0 "[ . 1]" 1
2114 2 101 THR MG 2 105 TYR QE 2.600 . 3.400 2.530 2.210 3.321 . 0 0 "[ . 1]" 1
2115 1 70 LEU MD2 1 101 THR MG 3.200 . 4.500 4.565 4.528 4.611 0.111 4 0 "[ . 1]" 1
2116 1 101 THR MG 1 105 TYR QD 3.400 . 4.800 4.060 3.410 4.818 0.018 3 0 "[ . 1]" 1
2117 2 101 THR MG 2 105 TYR QD 3.400 . 4.800 3.841 3.484 4.784 . 0 0 "[ . 1]" 1
2118 1 101 THR HB 1 101 THR MG 2.200 . 2.800 2.115 2.092 2.133 . 0 0 "[ . 1]" 1
2119 2 101 THR HB 2 101 THR MG 2.200 . 2.800 2.121 2.092 2.136 . 0 0 "[ . 1]" 1
2120 1 84 PRO HA 1 109 THR MG 3.900 . 5.800 4.629 4.343 4.998 . 0 0 "[ . 1]" 1
2121 2 84 PRO HA 2 109 THR MG 3.900 . 5.800 4.651 4.382 4.851 . 0 0 "[ . 1]" 1
2122 1 102 LEU HA 1 102 LEU MD2 2.400 . 3.100 1.862 1.701 2.117 . 0 0 "[ . 1]" 1
2123 2 102 LEU HA 2 102 LEU MD2 2.400 . 3.100 1.796 1.683 2.027 0.017 1 0 "[ . 1]" 1
2124 1 101 THR HA 1 101 THR MG 2.400 . 3.100 2.297 2.029 2.431 . 0 0 "[ . 1]" 1
2125 2 101 THR HA 2 101 THR MG 2.400 . 3.100 2.237 2.015 2.356 . 0 0 "[ . 1]" 1
2126 1 31 TYR QE 1 59 VAL MG1 2.300 . 2.900 2.025 1.868 2.235 . 0 0 "[ . 1]" 1
2127 2 31 TYR QE 2 59 VAL MG1 2.300 . 2.900 2.114 1.738 2.559 . 0 0 "[ . 1]" 1
2128 1 59 VAL HA 1 59 VAL MG1 2.400 . 3.100 2.321 2.024 2.580 . 0 0 "[ . 1]" 1
2129 2 59 VAL HA 2 59 VAL MG1 2.400 . 3.100 2.394 1.993 2.595 . 0 0 "[ . 1]" 1
2130 1 59 VAL HB 1 59 VAL MG1 2.200 . 2.800 2.098 2.070 2.125 . 0 0 "[ . 1]" 1
2131 2 59 VAL HB 2 59 VAL MG1 2.200 . 2.800 2.096 2.080 2.118 . 0 0 "[ . 1]" 1
2132 1 31 TYR QD 1 59 VAL MG1 2.300 . 2.900 1.979 1.799 2.113 . 0 0 "[ . 1]" 1
2133 2 31 TYR QD 2 59 VAL MG1 2.300 . 2.900 2.028 1.707 2.488 . 0 0 "[ . 1]" 1
2134 1 102 LEU HB3 1 102 LEU MD2 2.700 . 3.600 2.405 2.277 2.473 . 0 0 "[ . 1]" 1
2135 2 102 LEU HB3 2 102 LEU MD2 2.700 . 3.600 2.445 2.311 2.503 . 0 0 "[ . 1]" 1
2136 1 73 LEU HA 1 73 LEU MD2 2.000 . 2.500 1.843 1.528 2.190 . 0 0 "[ . 1]" 1
2137 2 73 LEU HA 2 73 LEU MD2 2.000 . 2.500 1.889 1.544 2.299 . 0 0 "[ . 1]" 1
2138 1 63 LYS QE 1 79 LEU MD2 2.200 . 2.800 2.410 1.850 2.801 0.001 7 0 "[ . 1]" 1
2139 2 63 LYS QE 2 79 LEU MD2 2.200 . 2.800 2.238 1.667 2.620 . 0 0 "[ . 1]" 1
2140 1 31 TYR QE 1 125 LEU MD2 3.000 . 4.100 3.884 3.545 4.131 0.031 8 0 "[ . 1]" 1
2141 2 31 TYR QE 2 125 LEU MD2 3.000 . 4.100 3.835 3.486 4.132 0.032 1 0 "[ . 1]" 1
2142 1 74 LEU MD2 1 101 THR HB 3.600 . 5.200 5.109 4.668 5.276 0.076 7 0 "[ . 1]" 1
2143 2 74 LEU MD2 2 101 THR HB 3.500 . 5.000 5.009 4.891 5.133 0.133 2 0 "[ . 1]" 1
2144 1 125 LEU MD2 1 126 PRO HD3 3.300 . 4.600 3.217 2.821 3.872 . 0 0 "[ . 1]" 1
2145 2 125 LEU MD2 2 126 PRO HD3 3.300 . 4.600 3.236 2.925 3.487 . 0 0 "[ . 1]" 1
2146 1 25 LEU MD2 1 33 LEU MD2 3.700 . 5.400 3.914 3.753 4.211 . 0 0 "[ . 1]" 1
2147 2 25 LEU MD2 2 33 LEU MD2 3.700 . 5.400 3.910 3.695 4.029 . 0 0 "[ . 1]" 1
2148 1 25 LEU MD1 1 25 LEU MD2 2.100 . 2.600 1.975 1.867 2.087 . 0 0 "[ . 1]" 1
2149 2 25 LEU MD1 2 25 LEU MD2 2.100 . 2.600 2.007 1.913 2.087 . 0 0 "[ . 1]" 1
2150 1 74 LEU H 1 74 LEU MD2 4.300 . 6.000 3.925 3.169 4.161 . 0 0 "[ . 1]" 1
2151 2 74 LEU H 2 74 LEU MD2 4.300 . 6.000 4.127 4.045 4.206 . 0 0 "[ . 1]" 1
2152 1 74 LEU MD2 1 74 LEU HG 2.300 . 2.900 2.101 2.081 2.125 . 0 0 "[ . 1]" 1
2153 2 74 LEU MD2 2 74 LEU HG 2.300 . 2.900 2.095 2.079 2.125 . 0 0 "[ . 1]" 1
2154 1 128 LEU HB2 1 128 LEU QD . . 2.200 2.084 1.927 2.198 . 0 0 "[ . 1]" 1
2155 2 128 LEU HB2 2 128 LEU MD2 2.800 . 3.800 3.119 3.024 3.168 . 0 0 "[ . 1]" 1
2156 1 79 LEU MD2 1 79 LEU HG 1.900 . 2.400 2.098 2.081 2.130 . 0 0 "[ . 1]" 1
2157 2 79 LEU MD2 2 79 LEU HG 1.900 . 2.400 2.110 2.085 2.128 . 0 0 "[ . 1]" 1
2158 1 128 LEU HA 1 128 LEU QD 2.200 . 2.800 2.464 2.054 2.715 . 0 0 "[ . 1]" 1
2159 2 128 LEU HA 2 128 LEU MD2 2.200 . 2.800 2.528 2.337 2.823 0.023 2 0 "[ . 1]" 1
2160 1 58 ASP HB2 1 128 LEU QD 3.300 . 4.300 2.737 2.210 3.505 . 0 0 "[ . 1]" 1
2161 2 58 ASP HB2 2 128 LEU MD2 3.300 . 4.700 3.519 2.901 4.502 . 0 0 "[ . 1]" 1
2162 1 128 LEU QD 1 128 LEU HG 1.900 . 2.400 1.877 1.856 1.893 . 0 0 "[ . 1]" 1
2163 2 128 LEU MD2 2 128 LEU HG 1.900 . 2.400 2.112 2.085 2.126 . 0 0 "[ . 1]" 1
2164 1 31 TYR QD 1 125 LEU MD2 2.600 . 3.400 2.921 2.771 3.149 . 0 0 "[ . 1]" 1
2165 2 31 TYR QD 2 125 LEU MD2 2.600 . 3.400 2.902 2.731 3.032 . 0 0 "[ . 1]" 1
2166 1 25 LEU HA 1 25 LEU MD2 2.000 . 2.500 1.634 1.521 1.859 . 0 0 "[ . 1]" 1
2167 2 25 LEU HA 2 25 LEU MD2 2.000 . 2.500 1.653 1.551 1.858 . 0 0 "[ . 1]" 1
2168 1 125 LEU MD2 1 125 LEU HG 2.100 . 2.600 2.113 2.085 2.131 . 0 0 "[ . 1]" 1
2169 2 125 LEU MD2 2 125 LEU HG 2.100 . 2.600 2.105 2.085 2.128 . 0 0 "[ . 1]" 1
2170 1 79 LEU HA 1 79 LEU MD2 2.300 . 3.000 2.322 1.701 2.820 . 0 0 "[ . 1]" 1
2171 2 79 LEU HA 2 79 LEU MD2 2.300 . 3.000 2.360 2.019 2.610 . 0 0 "[ . 1]" 1
2172 1 58 ASP HA 1 128 LEU QD . . 3.100 2.543 2.206 3.108 0.008 6 0 "[ . 1]" 1
2173 2 58 ASP HA 2 128 LEU MD2 3.700 . 5.400 4.448 3.679 5.350 . 0 0 "[ . 1]" 1
2174 1 25 LEU MD2 1 111 TYR QE 3.600 . 5.200 4.851 4.462 5.193 . 0 0 "[ . 1]" 1
2175 2 25 LEU MD2 2 111 TYR QE 3.600 . 5.200 4.867 4.604 5.029 . 0 0 "[ . 1]" 1
2176 1 85 VAL HB 1 85 VAL MG1 2.200 . 2.800 2.104 2.086 2.126 . 0 0 "[ . 1]" 1
2177 2 85 VAL HB 2 85 VAL MG1 2.200 . 2.800 2.099 2.083 2.124 . 0 0 "[ . 1]" 1
2178 1 33 LEU MD1 1 33 LEU HG 1.900 . 2.400 2.105 2.092 2.115 . 0 0 "[ . 1]" 1
2179 2 33 LEU MD1 2 33 LEU HG 1.900 . 2.400 2.105 2.099 2.111 . 0 0 "[ . 1]" 1
2180 1 85 VAL MG1 1 102 LEU MD1 3.600 . 5.200 3.788 3.402 4.138 . 0 0 "[ . 1]" 1
2181 2 85 VAL MG1 2 102 LEU MD1 3.600 . 5.200 3.664 3.414 4.051 . 0 0 "[ . 1]" 1
2182 1 33 LEU MD1 1 33 LEU MD2 2.000 . 2.500 2.025 1.908 2.088 . 0 0 "[ . 1]" 1
2183 2 33 LEU MD1 2 33 LEU MD2 2.000 . 2.500 2.016 1.939 2.076 . 0 0 "[ . 1]" 1
2184 1 86 VAL H 1 86 VAL MG1 2.800 . 3.800 2.081 1.929 2.174 . 0 0 "[ . 1]" 1
2185 2 86 VAL H 2 86 VAL MG1 2.800 . 3.800 2.097 1.808 2.232 . 0 0 "[ . 1]" 1
2186 1 85 VAL HA 1 85 VAL MG1 2.500 . 3.300 2.120 1.991 2.243 . 0 0 "[ . 1]" 1
2187 2 85 VAL HA 2 85 VAL MG1 2.500 . 3.300 2.161 2.004 2.387 . 0 0 "[ . 1]" 1
2188 1 85 VAL MG1 1 86 VAL H 3.700 . 5.400 3.362 3.117 3.537 . 0 0 "[ . 1]" 1
2189 2 85 VAL MG1 2 86 VAL H 3.700 . 5.400 3.509 3.254 3.803 . 0 0 "[ . 1]" 1
2190 1 33 LEU H 1 33 LEU MD1 3.500 . 5.000 3.200 3.112 3.251 . 0 0 "[ . 1]" 1
2191 2 33 LEU H 2 33 LEU MD1 3.500 . 5.000 3.181 3.073 3.307 . 0 0 "[ . 1]" 1
2192 1 33 LEU MD1 1 111 TYR QD 3.600 . 5.200 3.600 3.416 3.893 . 0 0 "[ . 1]" 1
2193 2 33 LEU MD1 2 111 TYR QD 3.600 . 5.200 3.498 3.235 3.742 . 0 0 "[ . 1]" 1
2194 1 33 LEU MD1 1 34 LEU H 3.000 . 4.100 2.812 2.734 2.891 . 0 0 "[ . 1]" 1
2195 2 33 LEU MD1 2 34 LEU H 3.000 . 4.100 2.827 2.756 2.871 . 0 0 "[ . 1]" 1
2196 1 33 LEU MD1 1 111 TYR QE 3.100 . 4.300 3.088 2.766 3.491 . 0 0 "[ . 1]" 1
2197 2 33 LEU MD1 2 111 TYR QE 3.100 . 4.300 2.988 2.747 3.218 . 0 0 "[ . 1]" 1
2198 1 41 THR HB 1 85 VAL MG1 2.400 . 3.100 2.254 1.791 2.714 . 0 0 "[ . 1]" 1
2199 2 41 THR HB 2 85 VAL MG1 2.400 . 3.100 2.225 1.878 2.604 . 0 0 "[ . 1]" 1
2200 1 70 LEU HA 1 70 LEU MD1 3.000 . 4.100 3.457 3.236 3.787 . 0 0 "[ . 1]" 1
2201 2 70 LEU HA 2 70 LEU MD1 3.000 . 4.100 3.639 3.390 3.876 . 0 0 "[ . 1]" 1
2202 1 51 LEU HA 1 51 LEU MD2 3.500 . 5.000 3.742 3.699 3.773 . 0 0 "[ . 1]" 1
2203 2 51 LEU HA 2 51 LEU MD2 3.500 . 5.000 3.718 3.608 3.774 . 0 0 "[ . 1]" 1
2204 1 51 LEU MD2 1 64 HIS HB3 3.500 . 5.100 4.264 3.928 4.607 . 0 0 "[ . 1]" 1
2205 2 51 LEU MD2 2 64 HIS HB3 3.500 . 5.100 4.465 3.733 4.875 . 0 0 "[ . 1]" 1
2206 1 34 LEU HA 1 34 LEU MD2 2.300 . 2.900 2.256 1.910 2.532 . 0 0 "[ . 1]" 1
2207 2 34 LEU HA 2 34 LEU MD2 2.300 . 2.900 2.240 1.940 2.783 . 0 0 "[ . 1]" 1
2208 1 48 PRO HA 1 51 LEU MD2 3.000 . 4.100 2.960 2.651 3.374 . 0 0 "[ . 1]" 1
2209 2 48 PRO HA 2 51 LEU MD2 3.000 . 4.100 2.961 2.558 3.431 . 0 0 "[ . 1]" 1
2210 1 51 LEU HB2 1 51 LEU MD2 2.100 . 2.600 1.988 1.948 2.031 . 0 0 "[ . 1]" 1
2211 2 51 LEU HB2 2 51 LEU MD2 2.100 . 2.600 2.003 1.978 2.033 . 0 0 "[ . 1]" 1
2212 1 51 LEU HB3 1 51 LEU MD2 2.300 . 3.000 2.180 2.072 2.274 . 0 0 "[ . 1]" 1
2213 2 51 LEU HB3 2 51 LEU MD2 2.300 . 3.000 2.135 1.970 2.302 . 0 0 "[ . 1]" 1
2214 1 51 LEU MD2 1 56 LYS HE2 3.200 . 4.500 4.004 2.946 4.617 0.117 10 0 "[ . 1]" 1
2215 2 51 LEU MD2 2 56 LYS HE2 3.200 . 4.500 3.770 2.744 4.840 0.340 9 0 "[ . 1]" 1
2216 1 11 PHE HZ 1 15 VAL MG2 3.800 . 5.600 4.238 4.069 4.592 . 0 0 "[ . 1]" 1
2217 2 11 PHE HZ 2 15 VAL MG2 3.700 . 5.500 4.488 3.941 4.954 . 0 0 "[ . 1]" 1
2218 1 15 VAL MG2 2 97 LEU HB3 3.000 . 4.100 4.213 4.147 4.321 0.221 5 0 "[ . 1]" 1
2219 1 97 LEU HB3 2 15 VAL MG2 2.900 . 4.000 4.134 4.084 4.210 0.210 9 0 "[ . 1]" 1
2220 1 56 LYS HB2 1 56 LYS HG2 2.200 . 2.800 2.369 2.151 2.531 . 0 0 "[ . 1]" 1
2221 2 56 LYS HB2 2 56 LYS HG2 2.200 . 2.800 2.414 2.168 2.562 . 0 0 "[ . 1]" 1
2222 1 15 VAL MG2 2 97 LEU MD1 2.600 . 3.400 3.002 2.696 3.274 . 0 0 "[ . 1]" 1
2223 1 97 LEU MD1 2 15 VAL MG2 2.600 . 3.400 2.926 2.684 3.161 . 0 0 "[ . 1]" 1
2224 1 51 LEU HB3 1 51 LEU MD1 3.400 . 4.900 3.166 3.137 3.192 . 0 0 "[ . 1]" 1
2225 2 51 LEU HB3 2 51 LEU MD1 3.400 . 4.900 3.154 3.101 3.183 . 0 0 "[ . 1]" 1
2226 1 51 LEU MD1 1 64 HIS HB2 3.700 . 5.400 5.003 4.500 5.408 0.008 6 0 "[ . 1]" 1
2227 2 51 LEU MD1 2 64 HIS HB2 3.700 . 5.400 5.148 4.463 5.462 0.062 1 0 "[ . 1]" 1
2228 1 34 LEU MD2 1 42 LEU H 3.200 . 4.400 2.518 2.310 2.791 . 0 0 "[ . 1]" 1
2229 2 34 LEU MD2 2 42 LEU H 3.200 . 4.400 2.580 2.341 2.826 . 0 0 "[ . 1]" 1
2230 1 15 VAL HA 1 15 VAL MG2 2.400 . 3.100 2.137 1.925 2.257 . 0 0 "[ . 1]" 1
2231 2 15 VAL HA 2 15 VAL MG2 2.400 . 3.100 2.051 1.899 2.169 . 0 0 "[ . 1]" 1
2232 1 56 LYS HE3 1 56 LYS HG2 3.900 . 5.800 3.349 2.476 3.920 . 0 0 "[ . 1]" 1
2233 2 56 LYS HE3 2 56 LYS HG2 3.900 . 5.800 3.086 2.384 3.768 . 0 0 "[ . 1]" 1
2234 1 12 LYS HA 1 15 VAL MG2 3.400 . 4.900 4.277 3.978 4.763 . 0 0 "[ . 1]" 1
2235 2 12 LYS HA 2 15 VAL MG2 3.400 . 4.900 4.397 3.790 4.594 . 0 0 "[ . 1]" 1
2236 1 56 LYS HE3 1 56 LYS HG3 3.900 . 5.800 3.153 2.291 3.930 . 0 0 "[ . 1]" 1
2237 2 56 LYS HE3 2 56 LYS HG3 3.900 . 5.800 3.083 2.008 3.738 . 0 0 "[ . 1]" 1
2238 1 11 PHE QD 1 15 VAL MG2 3.100 . 4.300 2.357 1.975 2.774 . 0 0 "[ . 1]" 1
2239 2 11 PHE QD 2 15 VAL MG2 3.100 . 4.300 2.742 2.120 3.121 . 0 0 "[ . 1]" 1
2240 1 15 VAL HB 1 15 VAL MG2 2.100 . 2.700 2.116 2.089 2.129 . 0 0 "[ . 1]" 1
2241 2 15 VAL HB 2 15 VAL MG2 2.100 . 2.700 2.109 2.083 2.133 . 0 0 "[ . 1]" 1
2242 1 51 LEU HB2 1 51 LEU MD1 2.100 . 2.700 1.911 1.863 1.963 . 0 0 "[ . 1]" 1
2243 2 51 LEU HB2 2 51 LEU MD1 2.100 . 2.700 1.903 1.840 1.964 . 0 0 "[ . 1]" 1
2244 1 51 LEU MD1 1 64 HIS HD2 3.100 . 4.300 3.915 3.063 4.317 0.017 9 0 "[ . 1]" 1
2245 2 51 LEU MD1 2 64 HIS HD2 3.100 . 4.300 3.852 3.317 4.289 . 0 0 "[ . 1]" 1
2246 1 51 LEU HA 1 51 LEU MD1 2.700 . 3.600 2.389 2.132 2.639 . 0 0 "[ . 1]" 1
2247 2 51 LEU HA 2 51 LEU MD1 2.700 . 3.600 2.531 2.110 2.803 . 0 0 "[ . 1]" 1
2248 1 34 LEU H 1 34 LEU MD2 3.800 . 5.600 3.951 3.532 4.306 . 0 0 "[ . 1]" 1
2249 2 34 LEU H 2 34 LEU MD2 3.800 . 5.600 3.973 3.372 4.348 . 0 0 "[ . 1]" 1
2250 1 11 PHE QE 1 15 VAL MG2 2.500 . 3.300 2.208 1.949 2.575 . 0 0 "[ . 1]" 1
2251 2 11 PHE QE 2 15 VAL MG2 2.500 . 3.300 2.419 1.814 2.882 . 0 0 "[ . 1]" 1
2252 1 56 LYS HE2 1 56 LYS HG3 3.100 . 4.300 2.824 2.083 3.596 . 0 0 "[ . 1]" 1
2253 2 56 LYS HE2 2 56 LYS HG3 3.100 . 4.300 3.086 2.247 3.672 . 0 0 "[ . 1]" 1
2254 1 74 LEU MD1 1 102 LEU HA 4.900 . 6.000 5.080 4.547 6.020 0.020 4 0 "[ . 1]" 1
2255 2 74 LEU MD1 2 102 LEU HA 4.800 . 6.000 5.093 4.851 5.370 . 0 0 "[ . 1]" 1
2256 1 97 LEU HB3 1 97 LEU MD1 2.300 . 3.000 2.297 2.203 2.403 . 0 0 "[ . 1]" 1
2257 2 97 LEU HB3 2 97 LEU MD1 2.300 . 3.000 2.310 2.109 2.436 . 0 0 "[ . 1]" 1
2258 1 97 LEU HA 1 97 LEU MD1 2.800 . 3.800 2.106 1.892 2.390 . 0 0 "[ . 1]" 1
2259 2 97 LEU HA 2 97 LEU MD1 2.800 . 3.800 2.110 1.815 2.511 . 0 0 "[ . 1]" 1
2260 1 97 LEU HB2 1 97 LEU MD1 3.200 . 4.500 3.184 3.164 3.199 . 0 0 "[ . 1]" 1
2261 2 97 LEU HB2 2 97 LEU MD1 3.200 . 4.500 3.184 3.152 3.204 . 0 0 "[ . 1]" 1
2262 1 97 LEU MD1 2 15 VAL HA 3.500 . 5.000 4.088 3.813 4.411 . 0 0 "[ . 1]" 1
2263 1 15 VAL HA 2 97 LEU MD1 3.500 . 5.000 4.289 3.713 4.713 . 0 0 "[ . 1]" 1
2264 1 74 LEU MD1 1 74 LEU HG 2.400 . 3.100 2.109 2.086 2.128 . 0 0 "[ . 1]" 1
2265 2 74 LEU MD1 2 74 LEU HG 2.400 . 3.100 2.100 2.083 2.125 . 0 0 "[ . 1]" 1
2266 1 63 LYS HB3 1 63 LYS HG2 1.900 . 2.400 2.546 2.437 2.608 0.208 3 0 "[ . 1]" 1
2267 2 63 LYS HB3 2 63 LYS HG2 1.900 . 2.400 2.543 2.447 2.737 0.337 8 0 "[ . 1]" 1
2268 1 63 LYS HD3 1 63 LYS HG2 2.600 . 3.400 2.277 2.213 2.668 . 0 0 "[ . 1]" 1
2269 2 63 LYS HD3 2 63 LYS HG2 2.600 . 3.400 2.345 2.216 2.554 . 0 0 "[ . 1]" 1
2270 1 74 LEU HB3 1 74 LEU MD1 3.200 . 4.500 3.130 2.898 3.193 . 0 0 "[ . 1]" 1
2271 2 74 LEU HB2 2 74 LEU MD1 3.200 . 4.500 2.288 2.024 2.467 . 0 0 "[ . 1]" 1
2272 1 63 LYS QE 1 63 LYS HG2 2.700 . 3.600 2.969 2.129 3.231 . 0 0 "[ . 1]" 1
2273 2 63 LYS QE 2 63 LYS HG2 2.700 . 3.600 2.808 2.231 3.295 . 0 0 "[ . 1]" 1
2274 1 73 LEU HA 1 76 LYS HG3 1.800 . 2.200 2.250 2.224 2.289 0.089 10 0 "[ . 1]" 1
2275 2 73 LEU HA 2 76 LYS HG3 1.800 . 2.200 2.225 2.132 2.264 0.064 9 0 "[ . 1]" 1
2276 1 74 LEU HA 1 74 LEU MD1 2.700 . 3.600 2.378 1.823 3.390 . 0 0 "[ . 1]" 1
2277 2 74 LEU HA 2 74 LEU MD1 2.700 . 3.600 2.150 1.770 2.682 0.030 8 0 "[ . 1]" 1
2278 1 120 TRP HA 1 125 LEU MD1 2.400 . 3.100 2.348 2.051 2.976 . 0 0 "[ . 1]" 1
2279 2 120 TRP HA 2 125 LEU MD1 2.400 . 3.100 2.282 1.990 2.569 . 0 0 "[ . 1]" 1
2280 1 31 TYR QD 1 125 LEU MD1 3.400 . 4.800 4.024 3.496 4.505 . 0 0 "[ . 1]" 1
2281 2 31 TYR QD 2 125 LEU MD1 3.400 . 4.800 3.965 3.534 4.475 . 0 0 "[ . 1]" 1
2282 1 27 PRO HG3 1 125 LEU MD1 3.800 . 5.600 3.951 3.769 4.166 . 0 0 "[ . 1]" 1
2283 2 27 PRO HG3 2 125 LEU MD1 3.800 . 5.600 3.969 3.746 4.130 . 0 0 "[ . 1]" 1
2284 2 128 LEU HA 2 128 LEU MD1 3.700 . 5.400 3.801 3.619 3.921 . 0 0 "[ . 1]" 1
2285 1 63 LYS HA 1 63 LYS HG2 3.600 . 5.300 2.695 2.388 3.251 . 0 0 "[ . 1]" 1
2286 2 63 LYS HA 2 63 LYS HG2 3.600 . 5.300 2.714 2.487 3.456 . 0 0 "[ . 1]" 1
2287 1 120 TRP HE3 1 125 LEU MD1 3.500 . 5.000 2.875 2.698 3.091 . 0 0 "[ . 1]" 1
2288 2 120 TRP HE3 2 125 LEU MD1 3.500 . 5.000 2.882 2.788 3.008 . 0 0 "[ . 1]" 1
2289 1 27 PRO HB2 1 125 LEU MD1 2.200 . 2.800 1.970 1.888 2.089 . 0 0 "[ . 1]" 1
2290 2 27 PRO HB2 2 125 LEU MD1 2.200 . 2.800 1.951 1.773 2.079 . 0 0 "[ . 1]" 1
2291 1 63 LYS H 1 63 LYS HG2 4.300 . 6.000 3.386 2.346 3.919 . 0 0 "[ . 1]" 1
2292 2 63 LYS H 2 63 LYS HG2 4.300 . 6.000 3.400 2.653 3.881 . 0 0 "[ . 1]" 1
2293 1 56 LYS HE2 1 128 LEU QD 3.800 . 5.600 3.103 2.159 4.218 . 0 0 "[ . 1]" 1
2294 2 56 LYS HE2 2 128 LEU MD1 3.800 . 5.600 3.414 2.403 4.230 . 0 0 "[ . 1]" 1
2295 1 56 LYS HE3 1 128 LEU QD 2.300 . 3.000 2.703 1.866 3.771 0.771 10 2 "[ -. +]" 1
2296 2 56 LYS HE3 2 128 LEU MD1 2.300 . 3.000 2.695 1.838 3.559 0.559 9 1 "[ . +1]" 1
2297 1 31 TYR HB3 1 125 LEU MD1 3.200 . 4.500 3.214 2.712 3.697 . 0 0 "[ . 1]" 1
2298 2 31 TYR HB3 2 125 LEU MD1 3.200 . 4.500 3.197 2.822 3.728 . 0 0 "[ . 1]" 1
2299 2 58 ASP HA 2 128 LEU MD1 2.400 . 3.100 2.454 2.018 3.131 0.031 1 0 "[ . 1]" 1
2300 1 27 PRO HB3 1 125 LEU MD1 3.300 . 4.700 3.148 2.528 3.328 . 0 0 "[ . 1]" 1
2301 2 27 PRO HB3 2 125 LEU MD1 3.300 . 4.700 3.115 2.785 3.289 . 0 0 "[ . 1]" 1
2302 1 31 TYR QE 1 125 LEU MD1 4.100 . 6.000 5.304 4.742 5.778 . 0 0 "[ . 1]" 1
2303 2 31 TYR QE 2 125 LEU MD1 4.100 . 6.000 5.244 4.702 5.794 . 0 0 "[ . 1]" 1
2304 2 58 ASP HB2 2 128 LEU MD1 3.100 . 4.300 2.876 2.242 3.534 . 0 0 "[ . 1]" 1
2305 1 42 LEU H 1 42 LEU MD2 3.700 . 5.400 4.211 4.124 4.283 . 0 0 "[ . 1]" 1
2306 2 42 LEU H 2 42 LEU MD2 3.700 . 5.400 4.186 4.028 4.276 . 0 0 "[ . 1]" 1
2307 1 42 LEU MD2 1 62 TYR QD 2.700 . 3.600 2.982 2.689 3.206 . 0 0 "[ . 1]" 1
2308 2 42 LEU MD2 2 62 TYR QD 2.700 . 3.600 2.939 2.107 3.301 . 0 0 "[ . 1]" 1
2309 1 42 LEU MD2 1 62 TYR QE 3.500 . 5.000 3.791 3.212 4.157 . 0 0 "[ . 1]" 1
2310 2 42 LEU MD2 2 62 TYR QE 3.500 . 5.000 3.965 3.081 4.377 . 0 0 "[ . 1]" 1
2311 1 42 LEU MD1 1 62 TYR QE 4.500 . 6.000 5.213 4.859 5.620 . 0 0 "[ . 1]" 1
2312 2 42 LEU MD1 2 62 TYR QE 4.500 . 6.000 5.460 5.090 5.907 . 0 0 "[ . 1]" 1
2313 1 42 LEU MD1 1 62 TYR QD 3.700 . 5.400 4.693 4.445 4.973 . 0 0 "[ . 1]" 1
2314 2 42 LEU MD1 2 62 TYR QD 3.700 . 5.400 4.641 4.379 4.949 . 0 0 "[ . 1]" 1
2315 1 33 LEU HA 1 33 LEU MD2 3.900 . 5.800 3.816 3.738 3.881 . 0 0 "[ . 1]" 1
2316 2 33 LEU HA 2 33 LEU MD2 3.900 . 5.800 3.787 3.718 3.869 . 0 0 "[ . 1]" 1
2317 1 63 LYS QE 1 79 LEU MD1 2.900 . 3.900 3.238 2.474 3.967 0.067 10 0 "[ . 1]" 1
2318 2 63 LYS QE 2 79 LEU MD1 2.900 . 3.900 3.725 3.175 3.957 0.057 3 0 "[ . 1]" 1
2319 1 42 LEU MD1 1 88 PHE HB2 2.600 . 3.500 1.805 1.703 2.108 . 0 0 "[ . 1]" 1
2320 2 42 LEU MD1 2 88 PHE HB2 2.600 . 3.500 1.750 1.681 1.855 0.019 5 0 "[ . 1]" 1
2321 1 42 LEU MD1 1 88 PHE HB3 3.900 . 5.800 3.112 2.774 3.582 . 0 0 "[ . 1]" 1
2322 2 42 LEU MD1 2 88 PHE HB3 3.900 . 5.800 3.112 2.671 3.313 . 0 0 "[ . 1]" 1
2323 1 33 LEU H 1 33 LEU MD2 3.900 . 5.800 3.010 2.863 3.191 . 0 0 "[ . 1]" 1
2324 2 33 LEU H 2 33 LEU MD2 3.900 . 5.800 2.994 2.908 3.046 . 0 0 "[ . 1]" 1
2325 1 33 LEU MD2 1 33 LEU HG 2.100 . 2.700 2.109 2.085 2.128 . 0 0 "[ . 1]" 1
2326 2 33 LEU MD2 2 33 LEU HG 2.100 . 2.700 2.108 2.082 2.130 . 0 0 "[ . 1]" 1
2327 1 42 LEU HB3 1 42 LEU MD1 3.200 . 4.500 3.143 3.108 3.174 . 0 0 "[ . 1]" 1
2328 2 42 LEU HB3 2 42 LEU MD1 3.200 . 4.500 3.128 3.044 3.179 . 0 0 "[ . 1]" 1
2329 1 33 LEU HB3 1 33 LEU MD2 2.300 . 3.000 2.036 1.887 2.147 . 0 0 "[ . 1]" 1
2330 2 33 LEU HB3 2 33 LEU MD2 2.300 . 3.000 2.019 1.902 2.144 . 0 0 "[ . 1]" 1
2331 1 42 LEU MD1 1 42 LEU HG 2.300 . 3.000 2.088 2.079 2.122 . 0 0 "[ . 1]" 1
2332 2 42 LEU MD1 2 42 LEU HG 2.300 . 3.000 2.092 2.079 2.114 . 0 0 "[ . 1]" 1
2333 1 34 LEU MD1 1 42 LEU MD1 2.500 . 3.300 2.530 2.287 2.987 . 0 0 "[ . 1]" 1
2334 2 34 LEU MD1 2 42 LEU MD1 2.500 . 3.300 2.437 1.955 2.778 . 0 0 "[ . 1]" 1
2335 1 42 LEU MD1 1 86 VAL MG2 2.200 . 2.800 2.235 2.002 2.641 . 0 0 "[ . 1]" 1
2336 2 42 LEU MD1 2 86 VAL MG2 2.200 . 2.800 2.237 1.937 2.548 . 0 0 "[ . 1]" 1
2337 1 102 LEU H 1 102 LEU MD1 3.700 . 5.400 3.838 3.670 4.040 . 0 0 "[ . 1]" 1
2338 2 102 LEU H 2 102 LEU MD1 3.700 . 5.400 3.917 3.655 4.055 . 0 0 "[ . 1]" 1
2339 1 43 ILE MD 1 79 LEU MD1 2.200 . 2.800 1.900 1.592 2.303 0.008 7 0 "[ . 1]" 1
2340 2 43 ILE MD 2 79 LEU MD1 2.200 . 2.800 2.090 1.718 2.367 . 0 0 "[ . 1]" 1
2341 1 33 LEU MD2 1 40 ILE MD 2.700 . 3.600 3.280 3.078 3.553 . 0 0 "[ . 1]" 1
2342 2 33 LEU MD2 2 40 ILE MD 2.700 . 3.600 3.264 3.065 3.394 . 0 0 "[ . 1]" 1
2343 1 27 PRO HD2 1 28 LYS QG 3.800 . 5.600 4.613 3.841 5.428 . 0 0 "[ . 1]" 1
2344 2 27 PRO HD2 2 28 LYS HG3 3.800 . 5.600 4.988 4.022 6.568 0.968 5 1 "[ + 1]" 1
2345 1 102 LEU MD1 1 110 ILE HG12 3.600 . 5.200 4.583 4.337 4.776 . 0 0 "[ . 1]" 1
2346 2 102 LEU MD1 2 110 ILE HG12 3.600 . 5.200 4.548 4.424 4.744 . 0 0 "[ . 1]" 1
2347 1 121 LEU HA 1 121 LEU MD1 4.100 . 6.000 3.777 3.690 3.880 . 0 0 "[ . 1]" 1
2348 2 121 LEU HA 2 121 LEU MD1 4.100 . 6.000 3.783 3.649 3.861 . 0 0 "[ . 1]" 1
2349 1 28 LYS QE 1 28 LYS QG . . 3.600 2.228 1.943 2.792 0.057 8 0 "[ . 1]" 1
2350 2 28 LYS QE 2 28 LYS HG3 3.700 . 5.400 2.552 2.172 3.081 . 0 0 "[ . 1]" 1
2351 1 118 ASP HA 1 121 LEU MD1 3.700 . 5.400 3.882 3.224 4.460 . 0 0 "[ . 1]" 1
2352 2 118 ASP HA 2 121 LEU MD1 3.700 . 5.400 3.789 3.110 4.410 . 0 0 "[ . 1]" 1
2353 1 121 LEU MD1 1 121 LEU HG 2.400 . 3.100 2.098 2.079 2.114 . 0 0 "[ . 1]" 1
2354 2 121 LEU MD1 2 121 LEU HG 2.400 . 3.100 2.103 2.078 2.123 . 0 0 "[ . 1]" 1
2355 1 70 LEU MD2 1 70 LEU HG 2.000 . 2.500 2.103 2.076 2.125 . 0 0 "[ . 1]" 1
2356 2 70 LEU MD2 2 70 LEU HG 2.000 . 2.500 2.105 2.089 2.125 . 0 0 "[ . 1]" 1
2357 1 70 LEU MD2 1 101 THR HB 4.300 . 6.000 4.762 4.266 5.191 . 0 0 "[ . 1]" 1
2358 2 70 LEU MD2 2 101 THR HB 4.300 . 6.000 4.944 4.516 5.364 . 0 0 "[ . 1]" 1
2359 1 130 ARG HB3 1 130 ARG QG 2.200 . 2.800 2.335 2.135 2.523 . 0 0 "[ . 1]" 1
2360 2 130 ARG HB3 2 130 ARG QG 2.200 . 2.800 2.379 2.146 2.519 . 0 0 "[ . 1]" 1
2361 2 28 LYS QE 2 28 LYS HG2 2.700 . 3.600 3.083 2.005 3.617 0.017 2 0 "[ . 1]" 1
2362 1 70 LEU HA 1 70 LEU MD2 4.100 . 6.000 4.044 3.930 4.102 . 0 0 "[ . 1]" 1
2363 2 70 LEU HA 2 70 LEU MD2 4.100 . 6.000 3.989 3.816 4.077 . 0 0 "[ . 1]" 1
2364 1 28 LYS HA 1 28 LYS QG 3.100 . 4.300 2.791 2.084 3.301 . 0 0 "[ . 1]" 1
2365 2 28 LYS HA 2 28 LYS HG3 3.100 . 4.300 3.475 3.098 3.691 . 0 0 "[ . 1]" 1
2366 1 73 LEU HB3 1 73 LEU MD1 2.200 . 2.800 2.211 2.045 2.386 . 0 0 "[ . 1]" 1
2367 2 73 LEU HB3 2 73 LEU MD1 2.200 . 2.800 2.187 2.016 2.413 . 0 0 "[ . 1]" 1
2368 2 128 LEU MD1 2 128 LEU HG 2.200 . 2.800 2.094 2.081 2.124 . 0 0 "[ . 1]" 1
2369 1 100 LYS HA 1 103 ARG HG2 2.800 . 3.700 2.168 1.877 2.529 0.023 9 0 "[ . 1]" 1
2370 2 100 LYS HA 2 103 ARG HG2 2.800 . 3.700 2.265 2.085 2.397 . 0 0 "[ . 1]" 1
2371 1 25 LEU MD1 1 30 ALA MB 2.500 . 3.300 3.020 2.747 3.326 0.026 10 0 "[ . 1]" 1
2372 2 25 LEU MD1 2 30 ALA MB 2.500 . 3.300 3.110 2.797 3.338 0.038 7 0 "[ . 1]" 1
2373 1 58 ASP HA 1 128 LEU HG 3.500 . 5.000 3.651 2.810 4.780 . 0 0 "[ . 1]" 1
2374 2 58 ASP HA 2 128 LEU HG 3.500 . 5.000 3.428 2.804 4.627 . 0 0 "[ . 1]" 1
2375 1 103 ARG HD2 1 103 ARG HG3 2.800 . 3.800 2.841 2.248 3.015 . 0 0 "[ . 1]" 1
2376 2 103 ARG HD2 2 103 ARG HG3 2.800 . 3.800 2.735 2.195 3.010 . 0 0 "[ . 1]" 1
2377 1 25 LEU HA 1 25 LEU MD1 4.500 . 6.000 3.665 3.577 3.716 . 0 0 "[ . 1]" 1
2378 2 25 LEU HA 2 25 LEU MD1 4.500 . 6.000 3.668 3.603 3.720 . 0 0 "[ . 1]" 1
2379 1 25 LEU MD1 1 30 ALA H 3.400 . 4.900 3.541 3.102 3.911 . 0 0 "[ . 1]" 1
2380 2 25 LEU MD1 2 30 ALA H 3.400 . 4.900 3.499 3.227 3.897 . 0 0 "[ . 1]" 1
2381 1 73 LEU HA 1 73 LEU MD1 3.000 . 4.100 2.528 2.092 3.157 . 0 0 "[ . 1]" 1
2382 2 73 LEU HA 2 73 LEU MD1 3.000 . 4.100 2.580 2.117 2.971 . 0 0 "[ . 1]" 1
2383 1 58 ASP HB3 1 128 LEU HG 4.300 . 6.000 3.853 3.256 4.544 . 0 0 "[ . 1]" 1
2384 2 58 ASP HB3 2 128 LEU HG 4.300 . 6.000 3.622 3.170 4.616 . 0 0 "[ . 1]" 1
2385 1 128 LEU HA 1 128 LEU HG 3.100 . 4.300 2.493 2.191 2.786 . 0 0 "[ . 1]" 1
2386 2 128 LEU HA 2 128 LEU HG 3.100 . 4.300 2.553 2.256 2.800 . 0 0 "[ . 1]" 1
2387 1 34 LEU MD1 1 42 LEU HG 3.800 . 5.600 4.081 3.974 4.240 . 0 0 "[ . 1]" 1
2388 2 34 LEU MD1 2 42 LEU HG 3.800 . 5.600 4.073 3.964 4.195 . 0 0 "[ . 1]" 1
2389 1 34 LEU HA 1 34 LEU MD1 4.200 . 6.000 3.797 3.711 3.877 . 0 0 "[ . 1]" 1
2390 2 34 LEU HA 2 34 LEU MD1 4.200 . 6.000 3.791 3.644 3.913 . 0 0 "[ . 1]" 1
2391 1 34 LEU MD1 1 34 LEU HG 2.300 . 2.900 2.120 2.086 2.128 . 0 0 "[ . 1]" 1
2392 2 34 LEU MD1 2 34 LEU HG 2.300 . 2.900 2.105 2.086 2.125 . 0 0 "[ . 1]" 1
2393 1 34 LEU HB3 1 34 LEU MD1 2.700 . 3.600 2.488 2.390 2.556 . 0 0 "[ . 1]" 1
2394 2 34 LEU HB3 2 34 LEU MD1 2.700 . 3.600 2.505 2.397 2.710 . 0 0 "[ . 1]" 1
2395 1 57 PRO HA 1 126 PRO HG2 3.500 . 5.100 4.828 4.646 4.997 . 0 0 "[ . 1]" 1
2396 2 57 PRO HA 2 126 PRO HG2 3.500 . 5.100 4.769 4.529 5.032 . 0 0 "[ . 1]" 1
2397 1 126 PRO HD3 1 126 PRO HG3 2.800 . 3.800 2.343 2.322 2.351 . 0 0 "[ . 1]" 1
2398 2 126 PRO HD3 2 126 PRO HG3 2.800 . 3.800 2.339 2.322 2.352 . 0 0 "[ . 1]" 1
2399 1 57 PRO HB3 1 126 PRO HG2 3.600 . 5.200 5.287 5.239 5.321 0.121 9 0 "[ . 1]" 1
2400 2 57 PRO HB3 2 126 PRO HG2 3.600 . 5.200 5.267 5.205 5.308 0.108 7 0 "[ . 1]" 1
2401 1 104 GLU HA 1 104 GLU HB3 2.900 . 4.000 2.700 2.359 2.951 . 0 0 "[ . 1]" 1
2402 2 104 GLU HA 2 104 GLU HB3 2.900 . 4.000 2.647 2.342 2.955 . 0 0 "[ . 1]" 1
2403 1 48 PRO HA 1 48 PRO HG2 3.900 . 5.800 3.863 3.829 3.894 . 0 0 "[ . 1]" 1
2404 2 48 PRO HA 2 48 PRO HG2 3.900 . 5.800 3.859 3.831 3.884 . 0 0 "[ . 1]" 1
2405 1 48 PRO HA 1 48 PRO HG3 4.100 . 6.000 3.946 3.816 4.023 . 0 0 "[ . 1]" 1
2406 1 63 LYS HD2 1 79 LEU MD2 3.400 . 4.900 4.000 2.395 4.834 . 0 0 "[ . 1]" 1
2407 2 63 LYS HD2 2 79 LEU MD2 3.400 . 4.900 3.237 2.065 4.724 . 0 0 "[ . 1]" 1
2408 1 63 LYS HD2 1 63 LYS QE 2.100 . 2.600 2.151 2.133 2.230 . 0 0 "[ . 1]" 1
2409 2 63 LYS HD2 2 63 LYS QE 2.100 . 2.600 2.155 2.132 2.194 . 0 0 "[ . 1]" 1
2410 1 63 LYS HA 1 63 LYS HD2 3.900 . 5.800 4.350 4.047 5.098 . 0 0 "[ . 1]" 1
2411 2 63 LYS HA 2 63 LYS HD2 3.900 . 5.800 4.481 3.956 4.976 . 0 0 "[ . 1]" 1
2412 1 56 LYS HD2 1 128 LEU QD 2.800 . 3.800 3.195 2.338 3.755 . 0 0 "[ . 1]" 1
2413 2 56 LYS HD2 2 128 LEU MD1 2.800 . 3.800 2.854 2.041 4.516 0.716 4 1 "[ +. 1]" 1
2414 1 59 VAL MG1 1 60 LYS QD 3.700 . 5.400 5.217 4.479 5.512 0.112 6 0 "[ . 1]" 1
2415 2 59 VAL MG1 2 60 LYS QD 3.700 . 5.400 4.808 3.503 5.502 0.102 10 0 "[ . 1]" 1
2416 1 56 LYS HD3 1 128 LEU QD 3.200 . 4.500 3.969 2.447 4.432 . 0 0 "[ . 1]" 1
2417 2 56 LYS HD3 2 128 LEU MD1 3.200 . 4.500 3.878 3.523 4.512 0.012 9 0 "[ . 1]" 1
2418 1 28 LYS QD 1 125 LEU MD2 3.200 . 4.500 3.796 2.118 4.549 0.049 10 0 "[ . 1]" 1
2419 2 28 LYS QD 2 125 LEU MD2 3.200 . 4.500 3.591 2.138 4.531 0.031 4 0 "[ . 1]" 1
2420 1 56 LYS HD3 1 56 LYS HE3 2.800 . 3.800 2.860 2.563 3.015 . 0 0 "[ . 1]" 1
2421 2 56 LYS HD3 2 56 LYS HE3 2.800 . 3.800 2.871 2.449 3.017 . 0 0 "[ . 1]" 1
2422 1 103 ARG HB2 1 103 ARG HD2 3.600 . 5.200 2.670 2.209 3.441 . 0 0 "[ . 1]" 1
2423 2 103 ARG HB2 2 103 ARG HD2 3.600 . 5.200 2.602 2.047 3.522 . 0 0 "[ . 1]" 1
2424 1 56 LYS HD2 1 56 LYS HE3 2.600 . 3.400 2.333 2.218 2.560 . 0 0 "[ . 1]" 1
2425 2 56 LYS HD2 2 56 LYS HE3 2.600 . 3.400 2.401 2.213 2.779 . 0 0 "[ . 1]" 1
2426 1 103 ARG HB3 1 103 ARG HD2 3.800 . 5.600 3.066 2.576 4.145 . 0 0 "[ . 1]" 1
2427 2 103 ARG HB3 2 103 ARG HD2 3.800 . 5.600 3.292 2.733 4.161 . 0 0 "[ . 1]" 1
2428 1 56 LYS HD2 1 56 LYS HE2 2.800 . 3.800 2.857 2.559 3.013 . 0 0 "[ . 1]" 1
2429 2 56 LYS HD2 2 56 LYS HE2 2.800 . 3.800 2.868 2.443 3.015 . 0 0 "[ . 1]" 1
2430 1 5 GLU QB 1 6 LYS HG3 4.100 . 6.000 4.997 4.412 6.001 0.001 2 0 "[ . 1]" 1
2431 2 5 GLU QB 2 6 LYS HG3 4.100 . 6.000 5.217 4.403 5.981 . 0 0 "[ . 1]" 1
2432 1 5 GLU QB 1 5 GLU HG2 2.200 . 2.800 2.347 2.125 2.526 . 0 0 "[ . 1]" 1
2433 2 5 GLU QB 2 5 GLU HG2 2.200 . 2.800 2.336 2.133 2.520 . 0 0 "[ . 1]" 1
2434 1 51 LEU MD2 1 56 LYS HD3 3.800 . 5.600 2.614 1.982 4.070 0.018 7 0 "[ . 1]" 1
2435 2 51 LEU MD2 2 56 LYS HD3 3.800 . 5.600 2.680 1.997 4.018 0.003 10 0 "[ . 1]" 1
2436 1 82 GLU HA 1 82 GLU QB . . 2.600 2.281 2.175 2.497 . 0 0 "[ . 1]" 1
2437 2 82 GLU HA 2 82 GLU QB . . 2.600 2.249 2.142 2.510 . 0 0 "[ . 1]" 1
2438 1 35 GLN HA 1 35 GLN HB2 2.500 . 3.300 2.548 2.333 3.020 . 0 0 "[ . 1]" 1
2439 2 35 GLN HA 2 35 GLN HB2 2.500 . 3.300 2.512 2.323 3.020 . 0 0 "[ . 1]" 1
2440 1 36 GLU HA 1 36 GLU QB 3.200 . 4.500 2.330 2.147 2.537 . 0 0 "[ . 1]" 1
2441 2 36 GLU HA 2 36 GLU QB 3.200 . 4.500 2.455 2.151 2.527 . 0 0 "[ . 1]" 1
2442 1 3 MET HA 1 3 MET QB 2.500 . 3.300 2.477 2.153 2.535 . 0 0 "[ . 1]" 1
2443 2 3 MET HA 2 3 MET QB 2.500 . 3.300 2.510 2.367 2.538 . 0 0 "[ . 1]" 1
2444 1 3 MET QB 1 3 MET QG 2.200 . 2.800 2.009 1.940 2.052 . 0 0 "[ . 1]" 1
2445 2 3 MET QB 2 3 MET QG 2.200 . 2.800 2.024 1.973 2.076 . 0 0 "[ . 1]" 1
2446 1 28 LYS QB 1 28 LYS HE3 3.100 . 4.300 3.200 2.604 3.698 . 0 0 "[ . 1]" 1
2447 2 28 LYS QB 2 28 LYS HE3 3.100 . 4.300 3.128 2.467 3.785 . 0 0 "[ . 1]" 1
2448 1 12 LYS HA 1 15 VAL HB 2.700 . 3.600 3.000 2.716 3.396 . 0 0 "[ . 1]" 1
2449 2 12 LYS HA 2 15 VAL HB 2.700 . 3.600 3.035 2.370 3.361 . 0 0 "[ . 1]" 1
2450 1 76 LYS HB3 1 76 LYS HG3 2.400 . 3.100 2.833 2.674 2.986 . 0 0 "[ . 1]" 1
2451 2 76 LYS HB3 2 76 LYS HG3 2.400 . 3.100 2.779 2.506 3.010 . 0 0 "[ . 1]" 1
2452 1 3 MET QG 2 81 PRO HD2 4.500 . 6.000 3.393 2.200 4.382 . 0 0 "[ . 1]" 1
2453 1 81 PRO HD2 2 3 MET QG 4.500 . 6.000 3.698 2.429 4.638 . 0 0 "[ . 1]" 1
2454 1 23 VAL HB 1 111 TYR QE 3.900 . 5.800 4.382 4.118 4.646 . 0 0 "[ . 1]" 1
2455 2 23 VAL HB 2 111 TYR QE 3.900 . 5.800 4.297 3.858 4.598 . 0 0 "[ . 1]" 1
2456 1 38 PRO HB2 1 38 PRO HD3 4.000 . 6.000 3.915 3.856 4.001 . 0 0 "[ . 1]" 1
2457 2 38 PRO HB2 2 38 PRO HD3 4.000 . 6.000 3.904 3.860 3.993 . 0 0 "[ . 1]" 1
2458 1 3 MET QG 2 81 PRO HD3 3.800 . 5.600 3.775 2.403 4.497 . 0 0 "[ . 1]" 1
2459 1 81 PRO HD3 2 3 MET QG 3.800 . 5.600 3.497 2.339 4.523 . 0 0 "[ . 1]" 1
2460 1 54 MET HA 1 54 MET HG3 3.800 . 5.600 3.453 3.096 3.702 . 0 0 "[ . 1]" 1
2461 2 54 MET HA 2 54 MET HG3 3.800 . 5.600 3.412 3.115 3.931 . 0 0 "[ . 1]" 1
2462 1 60 LYS HA 1 60 LYS QB 2.200 . 2.800 2.228 2.136 2.515 . 0 0 "[ . 1]" 1
2463 2 60 LYS HA 2 60 LYS QB 2.200 . 2.800 2.274 2.143 2.470 . 0 0 "[ . 1]" 1
2464 1 119 LYS HB2 1 122 GLU H 4.300 . 6.000 5.568 5.322 5.786 . 0 0 "[ . 1]" 1
2465 2 119 LYS HB2 2 122 GLU H 4.300 . 6.000 5.555 5.348 5.814 . 0 0 "[ . 1]" 1
2466 1 87 VAL HA 1 87 VAL HB 2.800 . 3.800 2.543 2.505 2.575 . 0 0 "[ . 1]" 1
2467 2 87 VAL HA 2 87 VAL HB 2.800 . 3.800 2.548 2.503 2.605 . 0 0 "[ . 1]" 1
2468 1 54 MET HB2 1 54 MET HG3 2.700 . 3.600 2.282 2.206 2.639 . 0 0 "[ . 1]" 1
2469 2 54 MET HB2 2 54 MET HG3 2.700 . 3.600 2.238 2.209 2.364 . 0 0 "[ . 1]" 1
2470 1 56 LYS HB2 1 56 LYS HG2 2.900 . 3.900 2.891 2.749 2.988 . 0 0 "[ . 1]" 1
2471 2 56 LYS HB2 2 56 LYS HG2 2.900 . 3.900 2.893 2.771 2.971 . 0 0 "[ . 1]" 1
2472 1 14 GLN HB2 1 14 GLN HG3 2.500 . 3.300 2.271 2.218 2.417 . 0 0 "[ . 1]" 1
2473 2 14 GLN HB2 2 14 GLN HG3 2.500 . 3.300 2.261 2.205 2.376 . 0 0 "[ . 1]" 1
2474 1 14 GLN HA 1 14 GLN HG2 2.600 . 3.400 2.200 2.051 2.395 . 0 0 "[ . 1]" 1
2475 2 14 GLN HA 2 14 GLN HG2 2.600 . 3.400 2.377 2.060 2.812 . 0 0 "[ . 1]" 1
2476 1 14 GLN HB3 1 14 GLN HG3 3.000 . 4.100 2.941 2.892 3.007 . 0 0 "[ . 1]" 1
2477 2 14 GLN HB3 2 14 GLN HG3 3.000 . 4.100 2.862 2.534 3.002 . 0 0 "[ . 1]" 1
2478 1 108 LYS QB 1 108 LYS HG3 2.100 . 2.600 2.271 2.132 2.523 . 0 0 "[ . 1]" 1
2479 2 108 LYS QB 2 108 LYS HG3 2.100 . 2.600 2.225 2.142 2.293 . 0 0 "[ . 1]" 1
2480 1 108 LYS QB 1 108 LYS HG2 2.600 . 3.400 2.405 2.128 2.529 . 0 0 "[ . 1]" 1
2481 2 108 LYS QB 2 108 LYS HG2 2.600 . 3.400 2.453 2.390 2.523 . 0 0 "[ . 1]" 1
2482 1 63 LYS HA 1 63 LYS HB3 2.700 . 3.600 2.371 2.216 2.509 . 0 0 "[ . 1]" 1
2483 2 63 LYS HA 2 63 LYS HB3 2.700 . 3.600 2.359 2.231 2.462 . 0 0 "[ . 1]" 1
2484 1 63 LYS H 1 63 LYS HB2 3.400 . 4.800 2.893 2.591 3.440 . 0 0 "[ . 1]" 1
2485 2 63 LYS H 2 63 LYS HB2 3.400 . 4.800 2.929 2.656 3.629 . 0 0 "[ . 1]" 1
2486 1 41 THR HA 1 61 ASN HB3 4.100 . 6.000 3.760 2.025 4.566 . 0 0 "[ . 1]" 1
2487 2 41 THR HA 2 61 ASN HB3 4.100 . 6.000 3.617 1.967 4.625 0.033 5 0 "[ . 1]" 1
2488 1 41 THR MG 1 61 ASN HB2 2.700 . 3.600 2.362 1.787 4.130 0.530 9 1 "[ . +1]" 1
2489 2 41 THR MG 2 61 ASN HB2 2.700 . 3.600 2.746 1.750 4.169 0.569 10 1 "[ . +]" 1
2490 1 41 THR MG 1 61 ASN HB3 3.500 . 5.000 3.092 2.126 3.915 . 0 0 "[ . 1]" 1
2491 2 41 THR MG 2 61 ASN HB3 3.500 . 5.000 3.329 2.377 4.109 . 0 0 "[ . 1]" 1
2492 1 42 LEU H 1 61 ASN HB3 4.800 . 6.000 4.995 3.153 5.742 . 0 0 "[ . 1]" 1
2493 2 42 LEU H 2 61 ASN HB3 4.800 . 6.000 4.868 3.194 5.784 . 0 0 "[ . 1]" 1
2494 1 42 LEU H 1 61 ASN HB2 3.900 . 5.800 3.862 3.112 4.852 . 0 0 "[ . 1]" 1
2495 2 42 LEU H 2 61 ASN HB2 3.900 . 5.800 3.993 3.192 5.077 . 0 0 "[ . 1]" 1
2496 1 41 THR HA 1 61 ASN HB2 2.600 . 3.500 2.663 1.821 3.673 0.173 9 0 "[ . 1]" 1
2497 2 41 THR HA 2 61 ASN HB2 2.600 . 3.500 2.740 1.895 3.759 0.259 10 0 "[ . 1]" 1
2498 1 58 ASP HB3 1 126 PRO HB2 2.400 . 3.100 2.117 1.689 2.627 0.011 3 0 "[ . 1]" 1
2499 2 58 ASP HB3 2 126 PRO HB2 2.400 . 3.100 2.200 1.501 2.738 0.199 5 0 "[ . 1]" 1
2500 1 58 ASP HB3 1 128 LEU QD 4.400 . 6.000 3.927 3.393 4.578 . 0 0 "[ . 1]" 1
2501 2 58 ASP HB3 2 128 LEU MD1 4.400 . 6.000 4.174 3.765 4.561 . 0 0 "[ . 1]" 1
2502 1 55 GLY HA3 1 129 ASP HB2 3.300 . 4.700 3.212 2.667 4.172 . 0 0 "[ . 1]" 1
2503 2 55 GLY HA3 2 129 ASP HB3 3.300 . 4.700 4.103 2.324 5.451 0.751 2 1 "[ + . 1]" 1
2504 1 74 LEU HB2 1 74 LEU MD1 3.200 . 4.400 2.272 2.012 2.469 . 0 0 "[ . 1]" 1
2505 2 74 LEU HB3 2 74 LEU MD1 3.200 . 4.400 3.161 3.084 3.199 . 0 0 "[ . 1]" 1
2506 1 74 LEU HB2 1 74 LEU MD2 3.300 . 4.600 2.498 2.193 2.956 . 0 0 "[ . 1]" 1
2507 2 74 LEU HB3 2 74 LEU MD2 3.300 . 4.600 2.193 1.982 2.420 0.018 5 0 "[ . 1]" 1
2508 1 110 ILE HB 1 110 ILE MD 2.300 . 3.000 1.876 1.811 1.922 . 0 0 "[ . 1]" 1
2509 2 110 ILE HB 2 110 ILE MD 2.300 . 3.000 1.858 1.809 1.910 . 0 0 "[ . 1]" 1
2510 1 51 LEU HB2 1 51 LEU MD2 3.200 . 4.500 2.476 2.350 2.603 . 0 0 "[ . 1]" 1
2511 2 51 LEU HB2 2 51 LEU MD2 3.200 . 4.500 2.530 2.401 2.659 . 0 0 "[ . 1]" 1
2512 1 33 LEU HA 1 33 LEU HB3 3.000 . 4.100 2.272 2.252 2.298 . 0 0 "[ . 1]" 1
2513 2 33 LEU HA 2 33 LEU HB3 3.000 . 4.100 2.265 2.249 2.285 . 0 0 "[ . 1]" 1
2514 1 33 LEU HA 1 33 LEU HB2 3.000 . 4.100 2.634 2.601 2.672 . 0 0 "[ . 1]" 1
2515 2 33 LEU HA 2 33 LEU HB2 3.000 . 4.100 2.646 2.607 2.680 . 0 0 "[ . 1]" 1
2516 1 33 LEU HB3 1 40 ILE MD 4.300 . 6.000 3.133 2.992 3.266 . 0 0 "[ . 1]" 1
2517 2 33 LEU HB3 2 40 ILE MD 4.300 . 6.000 3.001 2.742 3.270 . 0 0 "[ . 1]" 1
2518 1 33 LEU HB3 1 33 LEU MD1 4.200 . 6.000 3.071 3.047 3.103 . 0 0 "[ . 1]" 1
2519 2 33 LEU HB3 2 33 LEU MD1 4.200 . 6.000 3.064 3.046 3.088 . 0 0 "[ . 1]" 1
2520 1 103 ARG HD3 1 103 ARG HG2 2.600 . 3.500 2.469 2.241 2.951 . 0 0 "[ . 1]" 1
2521 2 103 ARG HD3 2 103 ARG HG2 2.600 . 3.500 2.488 2.228 3.009 . 0 0 "[ . 1]" 1
2522 1 100 LYS HA 1 103 ARG HD2 3.100 . 4.300 3.710 3.238 4.333 0.033 5 0 "[ . 1]" 1
2523 2 100 LYS HA 2 103 ARG HD2 3.100 . 4.300 3.924 2.458 5.053 0.753 7 1 "[ . + 1]" 1
2524 1 103 ARG HD3 1 103 ARG HG3 2.100 . 2.600 2.569 2.353 2.668 0.068 8 0 "[ . 1]" 1
2525 2 103 ARG HD3 2 103 ARG HG3 2.100 . 2.600 2.644 2.372 2.976 0.376 7 0 "[ . 1]" 1
2526 1 103 ARG HD2 1 103 ARG HG2 2.100 . 2.600 2.564 2.348 2.662 0.062 1 0 "[ . 1]" 1
2527 2 103 ARG HD2 2 103 ARG HG2 2.100 . 2.600 2.641 2.373 2.973 0.373 7 0 "[ . 1]" 1
2528 1 103 ARG HA 1 103 ARG HD3 3.800 . 5.600 5.189 4.038 5.526 . 0 0 "[ . 1]" 1
2529 2 103 ARG HA 2 103 ARG HD3 3.800 . 5.600 5.023 3.874 5.491 . 0 0 "[ . 1]" 1
2530 1 100 LYS HA 1 103 ARG HD3 3.900 . 5.800 3.106 2.315 4.606 . 0 0 "[ . 1]" 1
2531 2 100 LYS HA 2 103 ARG HD3 3.900 . 5.800 3.400 2.478 4.852 . 0 0 "[ . 1]" 1
2532 1 103 ARG HB3 1 103 ARG HD3 3.200 . 4.500 3.712 3.413 3.953 . 0 0 "[ . 1]" 1
2533 2 103 ARG HB3 2 103 ARG HD3 3.200 . 4.500 3.635 3.162 4.042 . 0 0 "[ . 1]" 1
2534 1 103 ARG HD3 1 110 ILE MD 3.900 . 5.800 5.611 5.199 5.830 0.030 3 0 "[ . 1]" 1
2535 2 103 ARG HD3 2 110 ILE MD 3.900 . 5.800 5.630 5.078 5.876 0.076 10 0 "[ . 1]" 1
2536 1 130 ARG HD3 1 130 ARG QG 2.300 . 3.000 2.415 2.172 2.529 . 0 0 "[ . 1]" 1
2537 2 130 ARG HD3 2 130 ARG QG 2.300 . 3.000 2.341 2.134 2.516 . 0 0 "[ . 1]" 1
2538 1 130 ARG HD2 1 130 ARG QG 2.200 . 2.800 2.253 2.140 2.483 . 0 0 "[ . 1]" 1
2539 2 130 ARG HD2 2 130 ARG QG 2.200 . 2.800 2.279 2.139 2.522 . 0 0 "[ . 1]" 1
2540 1 130 ARG HB2 1 130 ARG HD3 3.100 . 4.300 2.935 1.930 3.955 . 0 0 "[ . 1]" 1
2541 2 130 ARG HB2 2 130 ARG HD3 3.100 . 4.300 3.064 1.926 4.009 . 0 0 "[ . 1]" 1
2542 1 130 ARG HA 1 130 ARG HD2 4.000 . 6.000 4.252 3.207 4.892 . 0 0 "[ . 1]" 1
2543 2 130 ARG HA 2 130 ARG HD2 4.000 . 6.000 4.515 4.102 4.712 . 0 0 "[ . 1]" 1
2544 1 130 ARG HB3 1 130 ARG HD2 3.000 . 4.100 3.188 1.952 4.011 . 0 0 "[ . 1]" 1
2545 2 130 ARG HB3 2 130 ARG HD2 3.000 . 4.100 3.134 1.963 4.042 . 0 0 "[ . 1]" 1
2546 1 130 ARG HB3 1 130 ARG HD3 2.400 . 3.100 2.725 1.948 4.010 0.910 2 1 "[ + . 1]" 1
2547 2 130 ARG HB3 2 130 ARG HD3 2.400 . 3.100 2.825 2.002 3.964 0.864 4 1 "[ +. 1]" 1
2548 1 130 ARG HB2 1 130 ARG HD2 2.700 . 3.600 3.046 2.336 3.640 0.040 4 0 "[ . 1]" 1
2549 2 130 ARG HB2 2 130 ARG HD2 2.700 . 3.600 3.183 2.196 3.892 0.292 3 0 "[ . 1]" 1
2550 1 55 GLY HA3 1 129 ASP HB3 4.300 . 6.000 4.011 2.305 5.472 . 0 0 "[ . 1]" 1
2551 2 55 GLY HA3 2 129 ASP HB2 4.300 . 6.000 3.251 2.594 3.920 . 0 0 "[ . 1]" 1
2552 1 128 LEU HA 1 128 LEU HB2 3.000 . 4.100 2.940 2.857 3.019 . 0 0 "[ . 1]" 1
2553 2 128 LEU HA 2 128 LEU HB2 3.000 . 4.100 2.972 2.832 3.023 . 0 0 "[ . 1]" 1
2554 1 128 LEU HB3 1 128 LEU QD 2.800 . 3.800 2.047 1.910 2.147 . 0 0 "[ . 1]" 1
2555 2 128 LEU HB3 2 128 LEU MD1 2.800 . 3.800 2.624 2.398 2.826 . 0 0 "[ . 1]" 1
2556 1 115 GLY HA2 1 119 LYS HB2 3.300 . 4.600 4.133 3.352 4.777 0.177 5 0 "[ . 1]" 1
2557 2 115 GLY HA2 2 119 LYS HB2 3.300 . 4.600 4.213 3.829 5.008 0.408 4 0 "[ . 1]" 1
2558 1 80 ASP HA 1 81 PRO HB3 4.000 . 6.000 5.017 4.780 5.427 . 0 0 "[ . 1]" 1
2559 2 80 ASP HA 2 81 PRO HB3 4.000 . 6.000 5.169 4.848 5.452 . 0 0 "[ . 1]" 1
2560 1 80 ASP HA 1 81 PRO HD2 3.100 . 4.300 2.531 2.247 3.090 . 0 0 "[ . 1]" 1
2561 2 80 ASP HA 2 81 PRO HD2 3.100 . 4.300 2.422 2.025 2.797 . 0 0 "[ . 1]" 1
2562 1 80 ASP HA 1 81 PRO HD3 2.600 . 3.500 2.175 1.770 2.400 . 0 0 "[ . 1]" 1
2563 2 80 ASP HA 2 81 PRO HD3 2.600 . 3.500 2.085 1.778 2.452 . 0 0 "[ . 1]" 1
2564 1 125 LEU MD1 1 126 PRO HD3 5.300 . 6.000 5.102 4.840 5.310 . 0 0 "[ . 1]" 1
2565 2 125 LEU MD1 2 126 PRO HD3 5.300 . 6.000 5.083 4.884 5.324 . 0 0 "[ . 1]" 1
2566 1 125 LEU MD1 1 126 PRO HD2 4.500 . 6.000 3.731 3.551 3.908 . 0 0 "[ . 1]" 1
2567 2 125 LEU MD1 2 126 PRO HD2 4.500 . 6.000 3.733 3.499 3.992 . 0 0 "[ . 1]" 1
2568 1 37 ASN HA 1 38 PRO HD3 2.600 . 3.500 2.117 1.837 2.623 . 0 0 "[ . 1]" 1
2569 2 37 ASN HA 2 38 PRO HD3 2.600 . 3.500 2.073 1.832 2.441 . 0 0 "[ . 1]" 1
2570 1 37 ASN HA 1 38 PRO HD2 2.400 . 3.100 2.409 1.936 2.585 . 0 0 "[ . 1]" 1
2571 2 37 ASN HA 2 38 PRO HD2 2.400 . 3.100 2.398 1.990 2.599 . 0 0 "[ . 1]" 1
2572 1 37 ASN HA 1 40 ILE MD 4.300 . 6.000 4.822 4.586 5.493 . 0 0 "[ . 1]" 1
2573 2 37 ASN HA 2 40 ILE MD 4.300 . 6.000 4.813 4.683 4.984 . 0 0 "[ . 1]" 1
2574 1 37 ASN HA 1 37 ASN HB2 3.000 . 4.200 2.999 2.935 3.025 . 0 0 "[ . 1]" 1
2575 2 37 ASN HA 2 37 ASN HB2 3.000 . 4.200 2.998 2.927 3.027 . 0 0 "[ . 1]" 1
2576 1 37 ASN HA 1 38 PRO QG 4.100 . 6.000 3.826 3.714 3.914 . 0 0 "[ . 1]" 1
2577 2 37 ASN HA 2 38 PRO QG 4.100 . 6.000 3.808 3.708 3.871 . 0 0 "[ . 1]" 1
2578 1 37 ASN HA 1 37 ASN HB3 2.800 . 3.800 2.553 2.332 2.745 . 0 0 "[ . 1]" 1
2579 2 37 ASN HA 2 37 ASN HB3 2.800 . 3.800 2.524 2.305 2.753 . 0 0 "[ . 1]" 1
2580 1 38 PRO HB3 1 38 PRO HD3 3.500 . 5.000 3.747 2.981 4.064 . 0 0 "[ . 1]" 1
2581 2 38 PRO HB3 2 38 PRO HD3 3.500 . 5.000 3.751 2.953 4.068 . 0 0 "[ . 1]" 1
2582 1 38 PRO HD2 1 38 PRO QG 2.500 . 3.300 2.229 2.178 2.253 . 0 0 "[ . 1]" 1
2583 2 38 PRO HD2 2 38 PRO QG 2.500 . 3.300 2.231 2.180 2.256 . 0 0 "[ . 1]" 1
2584 1 38 PRO HD3 1 38 PRO QG 2.600 . 3.400 2.198 2.185 2.234 . 0 0 "[ . 1]" 1
2585 2 38 PRO HD3 2 38 PRO QG 2.600 . 3.400 2.199 2.187 2.238 . 0 0 "[ . 1]" 1
2586 1 112 ASN HA 1 112 ASN HB2 2.800 . 3.800 2.646 2.572 2.905 . 0 0 "[ . 1]" 1
2587 2 112 ASN HA 2 112 ASN HB2 2.800 . 3.800 2.677 2.539 2.904 . 0 0 "[ . 1]" 1
2588 1 61 ASN HA 1 61 ASN HB3 2.400 . 3.100 2.383 2.237 2.930 . 0 0 "[ . 1]" 1
2589 2 61 ASN HA 2 61 ASN HB3 2.400 . 3.100 2.436 2.235 2.990 . 0 0 "[ . 1]" 1
2590 1 61 ASN HA 1 61 ASN HB2 2.600 . 3.500 2.697 2.515 2.975 . 0 0 "[ . 1]" 1
2591 2 61 ASN HA 2 61 ASN HB2 2.600 . 3.500 2.706 2.532 2.960 . 0 0 "[ . 1]" 1
2592 1 24 MET HA 1 24 MET QB 3.200 . 4.500 2.460 2.410 2.517 . 0 0 "[ . 1]" 1
2593 2 24 MET HA 2 24 MET QB 3.200 . 4.500 2.442 2.344 2.526 . 0 0 "[ . 1]" 1
2594 1 125 LEU HA 1 126 PRO HG3 4.500 . 6.000 4.636 4.518 4.720 . 0 0 "[ . 1]" 1
2595 2 125 LEU HA 2 126 PRO HG3 4.500 . 6.000 4.648 4.547 4.698 . 0 0 "[ . 1]" 1
2596 1 83 LYS HA 1 84 PRO HD3 3.000 . 4.100 1.885 1.799 2.225 0.101 10 0 "[ . 1]" 1
2597 2 83 LYS HA 2 84 PRO HD3 3.000 . 4.100 1.846 1.821 1.887 0.079 6 0 "[ . 1]" 1
2598 1 83 LYS HA 1 84 PRO HD2 2.600 . 3.400 2.613 2.145 2.836 . 0 0 "[ . 1]" 1
2599 2 83 LYS HA 2 84 PRO HD2 2.600 . 3.400 2.782 2.569 3.052 . 0 0 "[ . 1]" 1
2600 1 125 LEU HA 1 126 PRO HD2 2.900 . 4.000 2.338 2.245 2.442 . 0 0 "[ . 1]" 1
2601 2 125 LEU HA 2 126 PRO HD2 2.900 . 4.000 2.386 2.259 2.537 . 0 0 "[ . 1]" 1
2602 1 83 LYS HA 1 83 LYS HG3 3.700 . 5.400 3.507 2.098 3.921 . 0 0 "[ . 1]" 1
2603 2 83 LYS HA 2 83 LYS HG3 3.700 . 5.400 2.975 2.033 3.946 . 0 0 "[ . 1]" 1
2604 1 125 LEU HA 1 125 LEU MD1 4.200 . 6.000 3.846 3.755 3.931 . 0 0 "[ . 1]" 1
2605 2 125 LEU HA 2 125 LEU MD1 4.200 . 6.000 3.849 3.795 3.889 . 0 0 "[ . 1]" 1
2606 1 83 LYS HA 1 83 LYS HG2 3.800 . 5.600 2.761 2.322 3.273 . 0 0 "[ . 1]" 1
2607 2 83 LYS HA 2 83 LYS HG2 3.800 . 5.600 2.923 2.541 3.335 . 0 0 "[ . 1]" 1
2608 1 125 LEU HA 1 126 PRO HD3 2.800 . 3.800 2.599 2.387 2.684 . 0 0 "[ . 1]" 1
2609 2 125 LEU HA 2 126 PRO HD3 2.800 . 3.800 2.580 2.502 2.664 . 0 0 "[ . 1]" 1
2610 1 47 ASP HA 1 48 PRO HD3 3.000 . 4.100 2.373 2.280 2.479 . 0 0 "[ . 1]" 1
2611 2 47 ASP HA 2 48 PRO HD3 3.000 . 4.100 2.320 2.132 2.525 . 0 0 "[ . 1]" 1
2612 1 21 ASP HA 1 21 ASP HB2 2.500 . 3.300 2.651 2.512 2.808 . 0 0 "[ . 1]" 1
2613 2 21 ASP HA 2 21 ASP HB2 2.500 . 3.300 2.614 2.468 2.794 . 0 0 "[ . 1]" 1
2614 1 21 ASP HA 1 21 ASP HB3 2.400 . 3.100 2.974 2.884 3.023 . 0 0 "[ . 1]" 1
2615 2 21 ASP HA 2 21 ASP HB3 2.400 . 3.100 2.988 2.897 3.026 . 0 0 "[ . 1]" 1
2616 1 56 LYS HA 1 57 PRO QD 2.700 . 3.600 2.164 1.915 2.346 . 0 0 "[ . 1]" 1
2617 2 56 LYS HA 2 57 PRO QD 2.700 . 3.600 2.154 2.048 2.265 . 0 0 "[ . 1]" 1
2618 1 128 LEU HA 1 128 LEU HB3 2.300 . 3.000 2.690 2.413 2.846 . 0 0 "[ . 1]" 1
2619 2 128 LEU HA 2 128 LEU HB3 2.300 . 3.000 2.629 2.468 2.878 . 0 0 "[ . 1]" 1
2620 1 47 ASP HA 1 48 PRO HD2 2.600 . 3.500 2.235 2.029 2.873 . 0 0 "[ . 1]" 1
2621 2 47 ASP HA 2 48 PRO HD2 2.600 . 3.500 2.183 2.020 2.461 . 0 0 "[ . 1]" 1
2622 1 65 MET HA 1 73 LEU MD1 3.000 . 4.100 3.084 2.261 3.657 . 0 0 "[ . 1]" 1
2623 2 65 MET HA 2 73 LEU MD1 3.000 . 4.100 2.936 2.163 4.142 0.042 2 0 "[ . 1]" 1
2624 1 2 ASP HA 1 2 ASP HB3 2.000 . 2.500 2.610 2.407 3.007 0.507 3 1 "[ + . 1]" 1
2625 2 2 ASP HA 2 2 ASP HB3 2.000 . 2.500 2.611 2.256 2.988 0.488 3 0 "[ . 1]" 1
2626 1 22 MET HA 1 23 VAL MG2 3.300 . 4.700 3.519 3.314 3.701 . 0 0 "[ . 1]" 1
2627 2 22 MET HA 2 23 VAL MG2 3.300 . 4.700 3.504 3.304 3.676 . 0 0 "[ . 1]" 1
2628 1 70 LEU MD2 1 98 ALA HA 2.800 . 3.800 2.380 1.953 3.370 . 0 0 "[ . 1]" 1
2629 2 70 LEU MD2 2 98 ALA HA 2.800 . 3.800 2.154 1.843 2.433 . 0 0 "[ . 1]" 1
2630 1 39 ASP HA 1 39 ASP QB 2.300 . 3.000 2.500 2.378 2.548 . 0 0 "[ . 1]" 1
2631 2 39 ASP HA 2 39 ASP QB 2.300 . 3.000 2.509 2.443 2.550 . 0 0 "[ . 1]" 1
2632 1 129 ASP HA 1 129 ASP HB2 2.400 . 3.100 2.327 2.244 2.472 . 0 0 "[ . 1]" 1
2633 2 129 ASP HA 2 129 ASP HB3 2.400 . 3.100 2.878 2.548 3.026 . 0 0 "[ . 1]" 1
2634 1 87 VAL MG1 1 95 ALA HA 3.700 . 5.400 4.039 3.145 4.532 . 0 0 "[ . 1]" 1
2635 2 87 VAL MG1 2 95 ALA HA 3.700 . 5.400 4.059 3.586 4.521 . 0 0 "[ . 1]" 1
2636 1 54 MET HA 1 54 MET HG2 2.700 . 3.600 2.440 2.099 3.755 0.155 7 0 "[ . 1]" 1
2637 2 54 MET HA 2 54 MET HG2 2.700 . 3.600 2.286 2.115 2.943 . 0 0 "[ . 1]" 1
2638 1 129 ASP HA 1 129 ASP HB3 2.300 . 3.000 2.867 2.567 3.030 0.030 9 0 "[ . 1]" 1
2639 2 129 ASP HA 2 129 ASP HB2 2.300 . 3.000 2.306 2.240 2.432 . 0 0 "[ . 1]" 1
2640 1 64 HIS HA 1 64 HIS HB2 2.800 . 3.800 2.527 2.438 2.666 . 0 0 "[ . 1]" 1
2641 2 64 HIS HA 2 64 HIS HB2 2.800 . 3.800 2.517 2.426 2.648 . 0 0 "[ . 1]" 1
2642 1 87 VAL HB 1 95 ALA HA 3.700 . 5.400 3.406 2.455 3.913 . 0 0 "[ . 1]" 1
2643 2 87 VAL HB 2 95 ALA HA 3.700 . 5.400 3.449 2.921 3.866 . 0 0 "[ . 1]" 1
2644 1 17 ALA HA 1 17 ALA MB 1.900 . 2.400 2.111 2.082 2.129 . 0 0 "[ . 1]" 1
2645 2 17 ALA HA 2 17 ALA MB 1.900 . 2.400 2.107 2.083 2.131 . 0 0 "[ . 1]" 1
2646 1 18 ALA HA 1 21 ASP HB3 3.100 . 4.300 3.926 3.284 4.324 0.024 5 0 "[ . 1]" 1
2647 2 18 ALA HA 2 21 ASP HB3 3.100 . 4.300 4.021 3.542 4.724 0.424 9 0 "[ . 1]" 1
2648 1 76 LYS HA 1 76 LYS QE 4.800 . 6.000 3.443 2.349 4.661 . 0 0 "[ . 1]" 1
2649 2 76 LYS HA 2 76 LYS QE 4.800 . 6.000 3.766 2.487 4.665 . 0 0 "[ . 1]" 1
2650 1 76 LYS HA 1 76 LYS HB2 2.500 . 3.300 3.013 2.984 3.022 . 0 0 "[ . 1]" 1
2651 2 76 LYS HA 2 76 LYS HB2 2.500 . 3.300 2.967 2.625 3.023 . 0 0 "[ . 1]" 1
2652 1 76 LYS HA 1 76 LYS HB3 2.200 . 2.800 2.451 2.311 2.550 . 0 0 "[ . 1]" 1
2653 2 76 LYS HA 2 76 LYS HB3 2.200 . 2.800 2.373 2.265 2.463 . 0 0 "[ . 1]" 1
2654 1 76 LYS HA 1 76 LYS HG3 2.800 . 3.800 3.629 3.229 3.934 0.134 2 0 "[ . 1]" 1
2655 2 76 LYS HA 2 76 LYS HG3 2.800 . 3.800 3.769 3.366 3.912 0.112 1 0 "[ . 1]" 1
2656 1 12 LYS HA 1 13 ALA HA 3.700 . 5.400 4.749 4.726 4.766 . 0 0 "[ . 1]" 1
2657 2 12 LYS HA 2 13 ALA HA 3.700 . 5.400 4.750 4.731 4.780 . 0 0 "[ . 1]" 1
2658 1 79 LEU HA 1 79 LEU MD1 3.500 . 5.000 3.786 3.695 3.894 . 0 0 "[ . 1]" 1
2659 2 79 LEU HA 2 79 LEU MD1 3.500 . 5.000 3.889 3.819 3.958 . 0 0 "[ . 1]" 1
2660 1 63 LYS HA 1 63 LYS HD3 3.100 . 4.300 4.341 4.123 4.667 0.367 6 0 "[ . 1]" 1
2661 2 63 LYS HA 2 63 LYS HD3 3.100 . 4.300 4.239 3.818 4.518 0.218 2 0 "[ . 1]" 1
2662 1 30 ALA HA 1 33 LEU MD2 3.600 . 5.200 2.832 2.612 3.114 . 0 0 "[ . 1]" 1
2663 2 30 ALA HA 2 33 LEU MD2 3.600 . 5.200 2.887 2.293 3.261 . 0 0 "[ . 1]" 1
2664 1 30 ALA HA 1 33 LEU H 3.900 . 5.800 3.839 3.710 4.075 . 0 0 "[ . 1]" 1
2665 2 30 ALA HA 2 33 LEU H 3.900 . 5.800 3.827 3.705 3.937 . 0 0 "[ . 1]" 1
2666 1 130 ARG HA 1 130 ARG HD3 4.000 . 6.000 4.034 2.594 4.620 . 0 0 "[ . 1]" 1
2667 2 130 ARG HA 2 130 ARG HD3 4.000 . 6.000 4.417 4.149 4.801 . 0 0 "[ . 1]" 1
2668 1 130 ARG HA 1 130 ARG HB3 2.400 . 3.100 2.848 2.436 3.019 . 0 0 "[ . 1]" 1
2669 2 130 ARG HA 2 130 ARG HB3 2.400 . 3.100 2.838 2.445 3.010 . 0 0 "[ . 1]" 1
2670 1 130 ARG HA 1 130 ARG QG 2.200 . 2.800 2.272 1.991 2.860 0.060 9 0 "[ . 1]" 1
2671 2 130 ARG HA 2 130 ARG QG 2.200 . 2.800 2.232 2.060 2.509 . 0 0 "[ . 1]" 1
2672 1 73 LEU HA 1 73 LEU HB2 2.800 . 3.800 2.879 2.842 2.953 . 0 0 "[ . 1]" 1
2673 2 73 LEU HA 2 73 LEU HB2 2.800 . 3.800 2.837 2.786 2.918 . 0 0 "[ . 1]" 1
2674 1 36 GLU HA 1 60 LYS QE 3.500 . 5.000 4.664 4.239 5.058 0.058 4 0 "[ . 1]" 1
2675 2 36 GLU HA 2 60 LYS QE 3.500 . 5.000 4.731 4.248 5.028 0.028 2 0 "[ . 1]" 1
2676 1 29 ASP HA 1 29 ASP HB2 2.800 . 3.800 2.831 2.683 3.030 . 0 0 "[ . 1]" 1
2677 2 29 ASP HA 2 29 ASP HB2 2.800 . 3.800 2.838 2.661 3.030 . 0 0 "[ . 1]" 1
2678 1 26 SER HA 1 27 PRO HG2 3.800 . 5.600 4.217 4.134 4.312 . 0 0 "[ . 1]" 1
2679 2 26 SER HA 2 27 PRO HG2 3.800 . 5.600 4.242 4.077 4.383 . 0 0 "[ . 1]" 1
2680 1 26 SER HA 1 26 SER HB3 2.700 . 3.600 2.265 2.245 2.359 . 0 0 "[ . 1]" 1
2681 2 26 SER HA 2 26 SER HB3 2.700 . 3.600 2.258 2.243 2.315 . 0 0 "[ . 1]" 1
2682 1 26 SER HA 1 26 SER HB2 2.600 . 3.500 2.895 2.794 3.015 . 0 0 "[ . 1]" 1
2683 2 26 SER HA 2 26 SER HB2 2.600 . 3.500 2.865 2.669 2.958 . 0 0 "[ . 1]" 1
2684 1 26 SER HA 1 27 PRO HG3 4.700 . 6.000 4.493 4.460 4.555 . 0 0 "[ . 1]" 1
2685 2 26 SER HA 2 27 PRO HG3 4.700 . 6.000 4.515 4.443 4.590 . 0 0 "[ . 1]" 1
2686 1 42 LEU MD2 1 62 TYR HA 4.200 . 6.000 3.867 3.587 4.078 . 0 0 "[ . 1]" 1
2687 2 42 LEU MD2 2 62 TYR HA 4.200 . 6.000 3.801 3.253 4.229 . 0 0 "[ . 1]" 1
2688 1 88 PHE HA 1 88 PHE HB2 2.900 . 3.900 2.587 2.443 2.659 . 0 0 "[ . 1]" 1
2689 2 88 PHE HA 2 88 PHE HB2 2.900 . 3.900 2.580 2.469 2.671 . 0 0 "[ . 1]" 1
2690 1 62 TYR HA 1 62 TYR QB 2.900 . 3.900 2.269 2.211 2.344 . 0 0 "[ . 1]" 1
2691 2 62 TYR HA 2 62 TYR QB 2.900 . 3.900 2.223 2.153 2.272 . 0 0 "[ . 1]" 1
2692 1 108 LYS HA 1 108 LYS HG3 2.500 . 3.300 2.853 2.023 3.318 0.018 9 0 "[ . 1]" 1
2693 2 108 LYS HA 2 108 LYS HG3 2.500 . 3.300 2.849 2.552 3.319 0.019 9 0 "[ . 1]" 1
2694 1 108 LYS HA 1 108 LYS HG2 2.300 . 3.000 2.400 2.051 3.300 0.300 5 0 "[ . 1]" 1
2695 2 108 LYS HA 2 108 LYS HG2 2.300 . 3.000 2.375 2.041 2.752 . 0 0 "[ . 1]" 1
2696 1 108 LYS HA 1 108 LYS QB 2.200 . 2.800 2.495 2.329 2.541 . 0 0 "[ . 1]" 1
2697 2 108 LYS HA 2 108 LYS QB 2.200 . 2.800 2.494 2.397 2.539 . 0 0 "[ . 1]" 1
2698 1 8 ASP HA 1 11 PHE HB2 2.600 . 3.500 3.214 2.861 3.531 0.031 10 0 "[ . 1]" 1
2699 2 8 ASP HA 2 11 PHE HB2 2.600 . 3.500 3.041 2.547 3.543 0.043 9 0 "[ . 1]" 1
2700 1 33 LEU MD2 1 34 LEU HA 4.500 . 6.000 5.711 5.593 5.789 . 0 0 "[ . 1]" 1
2701 2 33 LEU MD2 2 34 LEU HA 4.500 . 6.000 5.733 5.601 5.799 . 0 0 "[ . 1]" 1
2702 1 8 ASP HA 1 11 PHE HB3 3.400 . 4.800 3.493 3.196 3.908 . 0 0 "[ . 1]" 1
2703 2 8 ASP HA 2 11 PHE HB3 3.400 . 4.800 3.405 3.077 3.974 . 0 0 "[ . 1]" 1
2704 1 8 ASP HA 2 75 ALA MB 3.300 . 4.600 3.849 2.946 4.352 . 0 0 "[ . 1]" 1
2705 1 75 ALA MB 2 8 ASP HA 3.300 . 4.600 3.990 3.595 4.535 . 0 0 "[ . 1]" 1
2706 1 34 LEU H 1 34 LEU HA 2.800 . 3.800 2.814 2.801 2.837 . 0 0 "[ . 1]" 1
2707 2 34 LEU H 2 34 LEU HA 2.800 . 3.800 2.814 2.776 2.869 . 0 0 "[ . 1]" 1
2708 1 8 ASP HA 1 11 PHE QD 3.700 . 5.400 4.455 4.021 4.768 . 0 0 "[ . 1]" 1
2709 2 8 ASP HA 2 11 PHE QD 3.700 . 5.400 4.248 3.572 4.681 . 0 0 "[ . 1]" 1
2710 1 118 ASP HA 1 121 LEU QD 3.600 . 5.200 3.812 3.203 4.330 . 0 0 "[ . 1]" 1
2711 2 118 ASP HA 2 121 LEU QD 3.600 . 5.200 3.726 3.090 4.292 . 0 0 "[ . 1]" 1
2712 1 7 PHE HA 2 105 TYR HB3 3.400 . 4.800 3.887 3.313 4.423 . 0 0 "[ . 1]" 1
2713 1 105 TYR HB3 2 7 PHE HA 3.400 . 4.800 3.947 3.526 4.424 . 0 0 "[ . 1]" 1
2714 1 85 VAL HA 1 85 VAL HB 2.900 . 3.900 2.606 2.509 2.692 . 0 0 "[ . 1]" 1
2715 2 85 VAL HA 2 85 VAL HB 2.900 . 3.900 2.564 2.395 2.664 . 0 0 "[ . 1]" 1
2716 1 59 VAL HA 1 59 VAL HB 2.300 . 3.000 2.463 2.327 2.735 . 0 0 "[ . 1]" 1
2717 2 59 VAL HA 2 59 VAL HB 2.300 . 3.000 2.422 2.295 2.700 . 0 0 "[ . 1]" 1
2718 1 51 LEU HA 1 51 LEU HB2 2.400 . 3.100 2.293 2.207 2.368 . 0 0 "[ . 1]" 1
2719 2 51 LEU HA 2 51 LEU HB2 2.400 . 3.100 2.254 2.146 2.375 . 0 0 "[ . 1]" 1
2720 1 51 LEU HA 1 51 LEU HB3 2.600 . 3.400 2.879 2.823 2.908 . 0 0 "[ . 1]" 1
2721 2 51 LEU HA 2 51 LEU HB3 2.600 . 3.400 2.858 2.773 2.902 . 0 0 "[ . 1]" 1
2722 1 74 LEU HA 1 74 LEU HB3 2.900 . 3.900 2.956 2.848 3.023 . 0 0 "[ . 1]" 1
2723 2 74 LEU HA 2 74 LEU HB2 2.900 . 3.900 2.586 2.420 2.740 . 0 0 "[ . 1]" 1
2724 1 6 LYS HA 1 6 LYS HG3 3.200 . 4.400 3.667 3.407 3.822 . 0 0 "[ . 1]" 1
2725 2 6 LYS HA 2 6 LYS HG3 3.100 . 4.300 3.699 3.426 3.874 . 0 0 "[ . 1]" 1
2726 1 6 LYS HA 1 6 LYS QD 2.300 . 3.000 2.633 1.763 3.072 0.072 2 0 "[ . 1]" 1
2727 2 6 LYS HA 2 6 LYS QD 2.300 . 3.000 2.286 1.714 3.037 0.037 2 0 "[ . 1]" 1
2728 1 5 GLU HA 1 8 ASP HA 4.700 . 6.000 5.524 5.187 6.000 . 0 0 "[ . 1]" 1
2729 2 5 GLU HA 2 8 ASP HA 4.700 . 6.000 5.602 5.289 6.034 0.034 10 0 "[ . 1]" 1
2730 1 60 LYS HA 1 60 LYS QD 3.100 . 4.300 4.130 3.399 4.453 0.153 4 0 "[ . 1]" 1
2731 2 60 LYS HA 2 60 LYS QD 3.100 . 4.300 3.992 3.667 4.310 0.010 10 0 "[ . 1]" 1
2732 1 60 LYS HA 1 60 LYS HG2 3.000 . 4.100 3.545 2.935 3.919 . 0 0 "[ . 1]" 1
2733 2 60 LYS HA 2 60 LYS HG2 3.000 . 4.100 3.413 2.887 4.047 . 0 0 "[ . 1]" 1
2734 1 81 PRO HA 1 107 PHE HA 3.100 . 4.300 2.620 2.337 2.879 . 0 0 "[ . 1]" 1
2735 2 81 PRO HA 2 107 PHE HA 3.100 . 4.300 2.656 2.182 3.278 . 0 0 "[ . 1]" 1
2736 1 104 GLU HA 1 104 GLU HG2 2.200 . 2.800 2.363 2.049 3.239 0.439 6 0 "[ . 1]" 1
2737 2 104 GLU HA 2 104 GLU HG2 2.200 . 2.800 2.568 2.158 3.117 0.317 10 0 "[ . 1]" 1
2738 1 107 PHE HA 1 107 PHE QD 3.200 . 4.500 2.893 2.769 3.059 . 0 0 "[ . 1]" 1
2739 2 107 PHE HA 2 107 PHE QD 3.200 . 4.500 2.925 2.826 3.021 . 0 0 "[ . 1]" 1
2740 1 104 GLU HA 1 104 GLU HG3 3.400 . 4.800 3.090 2.063 3.832 . 0 0 "[ . 1]" 1
2741 2 104 GLU HA 2 104 GLU HG3 3.400 . 4.800 2.969 2.049 3.887 . 0 0 "[ . 1]" 1
2742 1 45 VAL HA 1 45 VAL MG2 3.600 . 5.300 3.027 2.675 3.155 . 0 0 "[ . 1]" 1
2743 2 45 VAL HA 2 45 VAL MG2 3.600 . 5.300 2.973 2.735 3.220 . 0 0 "[ . 1]" 1
2744 1 5 GLU HA 1 5 GLU QB 2.200 . 2.800 2.354 2.164 2.531 . 0 0 "[ . 1]" 1
2745 2 5 GLU HA 2 5 GLU QB 2.200 . 2.800 2.358 2.149 2.538 . 0 0 "[ . 1]" 1
2746 1 14 GLN HA 1 14 GLN HB2 2.700 . 3.600 2.989 2.945 3.018 . 0 0 "[ . 1]" 1
2747 2 14 GLN HA 2 14 GLN HB2 2.700 . 3.600 3.006 2.940 3.026 . 0 0 "[ . 1]" 1
2748 1 14 GLN HA 1 14 GLN HG3 3.500 . 5.000 3.219 2.930 3.504 . 0 0 "[ . 1]" 1
2749 2 14 GLN HA 2 14 GLN HG3 3.500 . 5.000 3.450 3.166 3.808 . 0 0 "[ . 1]" 1
2750 1 103 ARG HA 1 103 ARG HG3 2.900 . 4.000 3.620 3.583 3.676 . 0 0 "[ . 1]" 1
2751 2 103 ARG HA 2 103 ARG HG3 2.900 . 4.000 3.602 3.559 3.641 . 0 0 "[ . 1]" 1
2752 1 103 ARG HA 1 103 ARG HG2 3.300 . 4.700 3.940 3.772 4.146 . 0 0 "[ . 1]" 1
2753 2 103 ARG HA 2 103 ARG HG2 3.300 . 4.700 3.996 3.865 4.202 . 0 0 "[ . 1]" 1
2754 1 103 ARG HA 1 103 ARG HB2 2.600 . 3.400 2.490 2.406 2.619 . 0 0 "[ . 1]" 1
2755 2 103 ARG HA 2 103 ARG HB2 2.600 . 3.400 2.509 2.396 2.616 . 0 0 "[ . 1]" 1
2756 1 43 ILE HA 1 43 ILE MG 2.700 . 3.600 2.538 2.375 2.686 . 0 0 "[ . 1]" 1
2757 2 43 ILE HA 2 43 ILE MG 2.700 . 3.600 2.547 2.442 2.771 . 0 0 "[ . 1]" 1
2758 1 86 VAL HA 1 111 TYR H 2.600 . 3.400 2.201 2.084 2.273 . 0 0 "[ . 1]" 1
2759 2 86 VAL HA 2 111 TYR H 2.600 . 3.400 2.199 2.141 2.289 . 0 0 "[ . 1]" 1
2760 1 103 ARG HA 1 103 ARG HB3 2.500 . 3.300 2.409 2.299 2.489 . 0 0 "[ . 1]" 1
2761 2 103 ARG HA 2 103 ARG HB3 2.500 . 3.300 2.388 2.292 2.494 . 0 0 "[ . 1]" 1
2762 1 70 LEU HA 1 70 LEU HB3 2.800 . 3.800 2.745 2.610 2.889 . 0 0 "[ . 1]" 1
2763 2 70 LEU HA 2 70 LEU HB3 2.800 . 3.800 2.629 2.464 2.765 . 0 0 "[ . 1]" 1
2764 1 70 LEU HA 1 70 LEU HB2 2.700 . 3.600 2.231 2.201 2.291 . 0 0 "[ . 1]" 1
2765 2 70 LEU HA 2 70 LEU HB2 2.700 . 3.600 2.274 2.207 2.360 . 0 0 "[ . 1]" 1
2766 1 105 TYR HA 1 105 TYR HB3 3.000 . 4.100 2.478 2.426 2.567 . 0 0 "[ . 1]" 1
2767 2 105 TYR HA 2 105 TYR HB3 3.000 . 4.100 2.488 2.435 2.535 . 0 0 "[ . 1]" 1
2768 1 105 TYR H 1 105 TYR HA 2.900 . 4.000 2.940 2.928 2.944 . 0 0 "[ . 1]" 1
2769 2 105 TYR H 2 105 TYR HA 2.900 . 4.000 2.941 2.937 2.946 . 0 0 "[ . 1]" 1
2770 1 16 LYS HA 1 16 LYS QB 2.200 . 2.800 2.480 2.260 2.525 . 0 0 "[ . 1]" 1
2771 2 16 LYS HA 2 16 LYS QB 2.200 . 2.800 2.507 2.402 2.537 . 0 0 "[ . 1]" 1
2772 1 15 VAL MG1 1 16 LYS HA 3.200 . 4.500 3.116 2.885 3.358 . 0 0 "[ . 1]" 1
2773 2 15 VAL MG1 2 16 LYS HA 3.200 . 4.500 2.993 2.818 3.212 . 0 0 "[ . 1]" 1
2774 1 11 PHE HA 1 11 PHE HB2 2.900 . 4.000 2.688 2.667 2.743 . 0 0 "[ . 1]" 1
2775 2 11 PHE HA 2 11 PHE HB2 2.900 . 4.000 2.693 2.644 2.751 . 0 0 "[ . 1]" 1
2776 1 16 LYS HA 1 16 LYS HG3 3.000 . 4.100 2.827 2.243 3.570 . 0 0 "[ . 1]" 1
2777 2 16 LYS HA 2 16 LYS HG3 3.000 . 4.100 2.813 2.388 3.505 . 0 0 "[ . 1]" 1
2778 1 11 PHE HA 1 11 PHE QD 2.800 . 3.800 2.819 2.536 3.052 . 0 0 "[ . 1]" 1
2779 2 11 PHE HA 2 11 PHE QD 2.800 . 3.800 2.785 2.455 3.039 . 0 0 "[ . 1]" 1
2780 1 77 SER HA 1 77 SER QB 2.500 . 3.300 2.234 2.155 2.359 . 0 0 "[ . 1]" 1
2781 2 77 SER HA 2 77 SER QB 2.500 . 3.300 2.257 2.153 2.440 . 0 0 "[ . 1]" 1
2782 1 43 ILE MD 1 87 VAL HA 4.000 . 6.000 4.689 4.224 5.040 . 0 0 "[ . 1]" 1
2783 2 43 ILE MD 2 87 VAL HA 4.000 . 6.000 4.538 4.069 4.846 . 0 0 "[ . 1]" 1
2784 1 63 LYS QE 1 77 SER HA 4.500 . 6.000 5.054 4.383 5.559 . 0 0 "[ . 1]" 1
2785 2 63 LYS QE 2 77 SER HA 4.500 . 6.000 4.680 3.682 5.407 . 0 0 "[ . 1]" 1
2786 1 40 ILE HA 1 40 ILE MG 2.400 . 3.100 2.329 2.213 2.482 . 0 0 "[ . 1]" 1
2787 2 40 ILE HA 2 40 ILE MG 2.400 . 3.100 2.354 2.100 2.502 . 0 0 "[ . 1]" 1
2788 1 40 ILE HA 1 40 ILE HB 2.900 . 3.900 3.022 3.014 3.027 . 0 0 "[ . 1]" 1
2789 2 40 ILE HA 2 40 ILE HB 2.900 . 3.900 3.021 3.002 3.027 . 0 0 "[ . 1]" 1
2790 1 84 PRO HA 1 84 PRO HB3 2.800 . 3.800 2.278 2.263 2.312 . 0 0 "[ . 1]" 1
2791 2 84 PRO HA 2 84 PRO HB3 2.800 . 3.800 2.271 2.264 2.280 . 0 0 "[ . 1]" 1
2792 1 84 PRO HA 1 84 PRO HG2 3.700 . 5.500 4.036 3.874 4.090 . 0 0 "[ . 1]" 1
2793 2 84 PRO HA 2 84 PRO HG2 3.700 . 5.500 4.060 4.005 4.106 . 0 0 "[ . 1]" 1
2794 1 57 PRO HA 1 127 SER HA 2.900 . 3.900 2.610 2.461 2.748 . 0 0 "[ . 1]" 1
2795 2 57 PRO HA 2 127 SER HA 2.900 . 3.900 2.654 2.392 3.094 . 0 0 "[ . 1]" 1
2796 1 57 PRO HA 1 127 SER QB 3.800 . 5.600 3.600 3.161 4.087 . 0 0 "[ . 1]" 1
2797 2 57 PRO HA 2 127 SER QB 3.800 . 5.600 3.506 3.128 4.452 . 0 0 "[ . 1]" 1
2798 1 57 PRO HA 1 57 PRO HB3 2.600 . 3.400 2.265 2.257 2.277 . 0 0 "[ . 1]" 1
2799 2 57 PRO HA 2 57 PRO HB3 2.600 . 3.400 2.261 2.253 2.268 . 0 0 "[ . 1]" 1
2800 1 31 TYR HA 1 31 TYR HB2 2.900 . 3.900 2.403 2.367 2.439 . 0 0 "[ . 1]" 1
2801 2 31 TYR HA 2 31 TYR HB2 2.900 . 3.900 2.411 2.371 2.482 . 0 0 "[ . 1]" 1
2802 1 38 PRO HA 1 38 PRO HD3 3.400 . 4.800 3.787 3.533 3.914 . 0 0 "[ . 1]" 1
2803 2 38 PRO HA 2 38 PRO HD3 3.400 . 4.800 3.784 3.568 3.881 . 0 0 "[ . 1]" 1
2804 1 38 PRO HA 1 38 PRO HB2 2.500 . 3.300 2.689 2.631 2.721 . 0 0 "[ . 1]" 1
2805 2 38 PRO HA 2 38 PRO HB2 2.500 . 3.300 2.679 2.649 2.708 . 0 0 "[ . 1]" 1
2806 1 113 SER HA 1 113 SER QB 2.600 . 3.500 2.302 2.155 2.524 . 0 0 "[ . 1]" 1
2807 2 113 SER HA 2 113 SER QB 2.600 . 3.500 2.296 2.158 2.500 . 0 0 "[ . 1]" 1
2808 1 38 PRO HA 1 38 PRO HB3 2.100 . 2.700 2.281 2.266 2.326 . 0 0 "[ . 1]" 1
2809 2 38 PRO HA 2 38 PRO HB3 2.100 . 2.700 2.286 2.269 2.324 . 0 0 "[ . 1]" 1
2810 1 81 PRO HA 1 107 PHE QE 3.400 . 4.900 3.261 2.932 3.773 . 0 0 "[ . 1]" 1
2811 2 81 PRO HA 2 107 PHE QE 3.400 . 4.900 3.133 2.741 3.460 . 0 0 "[ . 1]" 1
2812 1 38 PRO HA 1 60 LYS QD 4.000 . 6.000 3.713 2.344 6.006 0.006 2 0 "[ . 1]" 1
2813 2 38 PRO HA 2 60 LYS QD 4.000 . 6.000 4.361 2.429 5.099 . 0 0 "[ . 1]" 1
2814 1 81 PRO HA 1 81 PRO HB3 2.600 . 3.400 2.281 2.267 2.290 . 0 0 "[ . 1]" 1
2815 2 81 PRO HA 2 81 PRO HB3 2.600 . 3.400 2.279 2.250 2.298 . 0 0 "[ . 1]" 1
2816 1 126 PRO HA 1 126 PRO HG2 3.300 . 4.600 3.830 3.819 3.855 . 0 0 "[ . 1]" 1
2817 2 126 PRO HA 2 126 PRO HG2 3.300 . 4.600 3.830 3.815 3.849 . 0 0 "[ . 1]" 1
2818 1 126 PRO HA 1 126 PRO HB3 2.200 . 2.800 2.287 2.277 2.301 . 0 0 "[ . 1]" 1
2819 2 126 PRO HA 2 126 PRO HB3 2.200 . 2.800 2.287 2.272 2.297 . 0 0 "[ . 1]" 1
2820 1 48 PRO HA 1 48 PRO HB3 2.600 . 3.500 2.266 2.247 2.285 . 0 0 "[ . 1]" 1
2821 2 48 PRO HA 2 48 PRO HB3 2.600 . 3.500 2.272 2.253 2.293 . 0 0 "[ . 1]" 1
2822 1 48 PRO HA 1 51 LEU HB3 4.600 . 6.000 3.098 2.675 3.455 . 0 0 "[ . 1]" 1
2823 2 48 PRO HA 2 51 LEU HB3 4.600 . 6.000 3.125 2.751 3.609 . 0 0 "[ . 1]" 1
2824 1 48 PRO HA 1 51 LEU MD1 3.100 . 4.300 3.794 3.431 4.187 . 0 0 "[ . 1]" 1
2825 2 48 PRO HA 2 51 LEU MD1 3.100 . 4.300 3.513 2.902 3.915 . 0 0 "[ . 1]" 1
2826 1 27 PRO HA 1 27 PRO HD2 4.000 . 6.000 3.973 3.867 4.017 . 0 0 "[ . 1]" 1
2827 2 27 PRO HA 2 27 PRO HD2 4.000 . 6.000 3.975 3.906 4.024 . 0 0 "[ . 1]" 1
2828 1 27 PRO HA 1 27 PRO HG2 4.100 . 6.000 3.874 3.857 3.906 . 0 0 "[ . 1]" 1
2829 2 27 PRO HA 2 27 PRO HG2 4.100 . 6.000 3.873 3.857 3.892 . 0 0 "[ . 1]" 1
2830 1 48 PRO HA 1 51 LEU HB2 3.100 . 4.300 2.343 2.039 2.666 . 0 0 "[ . 1]" 1
2831 2 48 PRO HA 2 51 LEU HB2 3.100 . 4.300 2.247 1.989 2.697 . 0 0 "[ . 1]" 1
2832 1 27 PRO HA 1 27 PRO HB3 2.500 . 3.300 2.253 2.246 2.263 . 0 0 "[ . 1]" 1
2833 2 27 PRO HA 2 27 PRO HB3 2.500 . 3.300 2.251 2.243 2.259 . 0 0 "[ . 1]" 1
2834 1 27 PRO HA 1 30 ALA H 3.500 . 5.000 3.440 3.239 3.754 . 0 0 "[ . 1]" 1
2835 2 27 PRO HA 2 30 ALA H 3.500 . 5.000 3.452 3.324 3.652 . 0 0 "[ . 1]" 1
2836 1 15 VAL HA 1 15 VAL MG1 2.700 . 3.600 2.722 2.542 2.963 . 0 0 "[ . 1]" 1
2837 2 15 VAL HA 2 15 VAL MG1 2.700 . 3.600 2.934 2.706 3.059 . 0 0 "[ . 1]" 1
2838 1 101 THR HA 1 102 LEU H 3.600 . 5.200 3.533 3.522 3.548 . 0 0 "[ . 1]" 1
2839 2 101 THR HA 2 102 LEU H 3.600 . 5.200 3.517 3.505 3.539 . 0 0 "[ . 1]" 1
2840 1 10 THR HB 2 105 TYR QD 3.600 . 5.300 3.604 3.268 3.925 . 0 0 "[ . 1]" 1
2841 1 105 TYR QD 2 10 THR HB 3.600 . 5.300 3.625 3.225 3.931 . 0 0 "[ . 1]" 1
2842 1 41 THR HB 1 43 ILE MD 3.500 . 5.100 3.487 2.483 4.212 . 0 0 "[ . 1]" 1
2843 2 41 THR HB 2 43 ILE MD 3.500 . 5.100 3.208 2.595 4.047 . 0 0 "[ . 1]" 1
2844 1 41 THR HB 1 41 THR MG 2.100 . 2.700 2.103 2.090 2.130 . 0 0 "[ . 1]" 1
2845 2 41 THR HB 2 41 THR MG 2.100 . 2.700 2.106 2.094 2.124 . 0 0 "[ . 1]" 1
2846 2 96 ALA MB 2 97 LEU MD2 2.200 . 2.800 2.816 2.764 2.847 0.047 9 0 "[ . 1]" 1
2847 2 100 LYS HG3 2 101 THR MG 3.200 . 4.500 4.129 3.155 4.543 0.043 4 0 "[ . 1]" 1
2848 2 97 LEU MD1 2 100 LYS HG2 3.000 . 4.100 3.497 2.948 4.016 . 0 0 "[ . 1]" 1
2849 2 74 LEU HB2 2 79 LEU MD1 3.200 . 4.500 4.287 4.021 4.549 0.049 3 0 "[ . 1]" 1
2850 2 25 LEU MD1 2 30 ALA HA 2.700 . 3.600 2.640 2.419 2.843 . 0 0 "[ . 1]" 1
2851 2 81 PRO HB2 2 107 PHE HA 3.600 . 5.200 3.470 2.817 3.999 . 0 0 "[ . 1]" 1
2852 2 76 LYS HB2 2 77 SER HA 3.100 . 4.300 4.228 4.040 4.346 0.046 6 0 "[ . 1]" 1
2853 1 24 MET ME 1 114 GLU HA 2.700 . 3.600 2.644 1.963 3.227 . 0 0 "[ . 1]" 1
2854 2 24 MET ME 2 114 GLU HA 2.700 . 3.600 2.583 2.316 2.947 . 0 0 "[ . 1]" 1
2855 1 24 MET ME 1 24 MET HG2 3.200 . 4.500 2.380 1.990 3.219 . 0 0 "[ . 1]" 1
2856 2 24 MET ME 2 24 MET HG2 3.200 . 4.500 2.347 2.153 2.907 . 0 0 "[ . 1]" 1
2857 1 24 MET ME 1 112 ASN HD21 3.000 . 4.100 3.362 2.706 4.124 0.024 6 0 "[ . 1]" 1
2858 2 24 MET ME 2 112 ASN HD21 3.000 . 4.100 3.494 2.745 4.054 . 0 0 "[ . 1]" 1
2859 1 24 MET ME 1 112 ASN HD22 3.500 . 5.000 3.705 3.148 4.135 . 0 0 "[ . 1]" 1
2860 2 24 MET ME 2 112 ASN HD22 3.500 . 5.000 3.912 3.417 4.149 . 0 0 "[ . 1]" 1
2861 1 24 MET H 1 24 MET ME 3.800 . 5.600 4.664 4.313 5.055 . 0 0 "[ . 1]" 1
2862 2 24 MET H 2 24 MET ME 3.800 . 5.600 4.570 3.938 5.078 . 0 0 "[ . 1]" 1
2863 1 24 MET ME 1 114 GLU H 3.300 . 4.700 3.625 3.094 4.451 . 0 0 "[ . 1]" 1
2864 2 24 MET ME 2 114 GLU H 3.300 . 4.700 3.504 3.042 3.945 . 0 0 "[ . 1]" 1
2865 1 37 ASN H 1 40 ILE MD 4.000 . 6.000 4.119 3.878 4.567 . 0 0 "[ . 1]" 1
2866 2 37 ASN H 2 40 ILE MD 4.000 . 6.000 4.133 3.675 4.526 . 0 0 "[ . 1]" 1
2867 1 33 LEU HG 1 40 ILE MD 4.100 . 6.000 4.129 3.986 4.360 . 0 0 "[ . 1]" 1
2868 2 33 LEU HG 2 40 ILE MD 4.100 . 6.000 4.064 3.930 4.256 . 0 0 "[ . 1]" 1
2869 1 40 ILE MD 1 41 THR H 5.200 . 6.000 5.265 4.647 5.467 . 0 0 "[ . 1]" 1
2870 2 40 ILE MD 2 41 THR H 5.200 . 6.000 5.283 5.166 5.453 . 0 0 "[ . 1]" 1
2871 1 43 ILE MD 1 85 VAL HA 4.300 . 6.000 4.634 4.092 5.052 . 0 0 "[ . 1]" 1
2872 2 43 ILE MD 2 85 VAL HA 4.300 . 6.000 4.457 4.063 5.364 . 0 0 "[ . 1]" 1
2873 1 42 LEU HA 1 43 ILE MD 3.600 . 5.200 4.530 3.520 5.222 0.022 4 0 "[ . 1]" 1
2874 2 42 LEU HA 2 43 ILE MD 3.600 . 5.200 4.147 3.459 5.146 . 0 0 "[ . 1]" 1
2875 1 110 ILE MD 1 111 TYR H 4.000 . 6.000 4.206 4.073 4.491 . 0 0 "[ . 1]" 1
2876 2 110 ILE MD 2 111 TYR H 4.000 . 6.000 4.251 4.135 4.341 . 0 0 "[ . 1]" 1
2877 1 103 ARG H 1 110 ILE MD 2.600 . 3.400 2.900 2.458 3.382 . 0 0 "[ . 1]" 1
2878 2 103 ARG H 2 110 ILE MD 2.600 . 3.400 2.864 2.694 3.171 . 0 0 "[ . 1]" 1
2879 1 99 GLY QA 1 110 ILE MD 2.500 . 3.300 1.888 1.720 2.189 . 0 0 "[ . 1]" 1
2880 2 99 GLY QA 2 110 ILE MD 2.500 . 3.300 1.773 1.683 2.031 0.017 6 0 "[ . 1]" 1
2881 1 30 ALA MB 1 125 LEU MD2 4.700 . 6.000 5.723 5.410 6.016 0.016 4 0 "[ . 1]" 1
2882 2 30 ALA MB 2 125 LEU MD2 4.700 . 6.000 5.741 5.446 6.001 0.001 5 0 "[ . 1]" 1
2883 1 29 ASP HB3 1 30 ALA MB 4.300 . 6.000 4.175 3.909 4.743 . 0 0 "[ . 1]" 1
2884 2 29 ASP HB3 2 30 ALA MB 4.300 . 6.000 4.225 3.991 4.864 . 0 0 "[ . 1]" 1
2885 1 30 ALA MB 1 86 VAL MG2 2.700 . 3.600 2.081 1.847 2.386 . 0 0 "[ . 1]" 1
2886 2 30 ALA MB 2 86 VAL MG2 2.700 . 3.600 2.089 1.806 2.438 . 0 0 "[ . 1]" 1
2887 1 43 ILE HB 1 43 ILE MG 2.200 . 2.800 2.105 2.088 2.132 . 0 0 "[ . 1]" 1
2888 2 43 ILE HB 2 43 ILE MG 2.200 . 2.800 2.106 2.085 2.125 . 0 0 "[ . 1]" 1
2889 1 42 LEU HA 1 43 ILE MG 4.600 . 6.000 5.418 5.337 5.464 . 0 0 "[ . 1]" 1
2890 2 42 LEU HA 2 43 ILE MG 4.600 . 6.000 5.413 5.254 5.453 . 0 0 "[ . 1]" 1
2891 1 87 VAL MG2 1 95 ALA MB 2.300 . 3.000 2.141 1.931 2.448 . 0 0 "[ . 1]" 1
2892 2 87 VAL MG2 2 95 ALA MB 2.300 . 3.000 2.291 2.055 2.499 . 0 0 "[ . 1]" 1
2893 1 95 ALA MB 1 112 ASN HD21 4.500 . 6.000 4.004 2.917 4.721 . 0 0 "[ . 1]" 1
2894 2 95 ALA MB 2 112 ASN HD21 4.500 . 6.000 4.078 2.736 5.013 . 0 0 "[ . 1]" 1
2895 1 13 ALA MB 1 14 GLN HG3 3.600 . 5.200 3.773 3.305 4.133 . 0 0 "[ . 1]" 1
2896 2 13 ALA MB 2 14 GLN HG3 3.600 . 5.200 3.904 3.056 4.513 . 0 0 "[ . 1]" 1
2897 1 13 ALA MB 1 14 GLN H 2.600 . 3.400 2.523 2.443 2.646 . 0 0 "[ . 1]" 1
2898 2 13 ALA MB 2 14 GLN H 2.600 . 3.400 2.485 2.366 2.710 . 0 0 "[ . 1]" 1
2899 1 95 ALA MB 1 112 ASN HD22 3.200 . 4.500 2.949 2.348 3.599 . 0 0 "[ . 1]" 1
2900 2 95 ALA MB 2 112 ASN HD22 3.200 . 4.500 3.098 2.418 3.856 . 0 0 "[ . 1]" 1
2901 1 8 ASP HA 1 9 ALA MB 4.200 . 6.000 5.022 5.012 5.036 . 0 0 "[ . 1]" 1
2902 2 8 ASP HA 2 9 ALA MB 4.100 . 6.000 5.024 4.997 5.045 . 0 0 "[ . 1]" 1
2903 1 8 ASP H 1 9 ALA MB 4.200 . 6.000 4.453 4.358 4.507 . 0 0 "[ . 1]" 1
2904 2 8 ASP H 2 9 ALA MB 4.200 . 6.000 4.474 4.383 4.569 . 0 0 "[ . 1]" 1
2905 1 8 ASP QB 1 9 ALA MB 3.800 . 5.600 3.874 3.665 4.148 . 0 0 "[ . 1]" 1
2906 2 8 ASP QB 2 9 ALA MB 3.800 . 5.600 3.971 3.841 4.173 . 0 0 "[ . 1]" 1
2907 1 45 VAL MG1 1 45 VAL MG2 2.500 . 3.300 2.046 1.889 2.090 . 0 0 "[ . 1]" 1
2908 2 45 VAL MG1 2 45 VAL MG2 2.500 . 3.300 2.002 1.923 2.089 . 0 0 "[ . 1]" 1
2909 1 19 LYS QB 1 20 ALA MB 3.700 . 5.400 4.345 3.816 4.758 . 0 0 "[ . 1]" 1
2910 2 19 LYS QB 2 20 ALA MB 3.700 . 5.400 4.417 3.902 4.699 . 0 0 "[ . 1]" 1
2911 1 20 ALA MB 1 21 ASP HA 3.600 . 5.200 3.790 3.705 3.883 . 0 0 "[ . 1]" 1
2912 2 20 ALA MB 2 21 ASP HA 3.600 . 5.200 3.826 3.694 3.888 . 0 0 "[ . 1]" 1
2913 1 20 ALA H 1 20 ALA MB 2.000 . 2.500 2.142 2.089 2.252 . 0 0 "[ . 1]" 1
2914 2 20 ALA H 2 20 ALA MB 2.000 . 2.500 2.137 2.058 2.232 . 0 0 "[ . 1]" 1
2915 1 19 LYS H 1 20 ALA MB 4.100 . 6.000 3.895 3.790 4.117 . 0 0 "[ . 1]" 1
2916 2 19 LYS H 2 20 ALA MB 4.100 . 6.000 3.877 3.785 4.006 . 0 0 "[ . 1]" 1
2917 1 96 ALA MB 1 100 LYS HB3 3.300 . 4.700 3.439 3.217 3.640 . 0 0 "[ . 1]" 1
2918 2 96 ALA MB 2 100 LYS HB3 3.300 . 4.700 3.488 3.361 3.594 . 0 0 "[ . 1]" 1
2919 1 96 ALA MB 1 112 ASN HD21 3.600 . 5.200 3.131 2.718 3.470 . 0 0 "[ . 1]" 1
2920 2 96 ALA MB 2 112 ASN HD21 3.600 . 5.200 3.084 2.656 3.402 . 0 0 "[ . 1]" 1
2921 1 96 ALA MB 1 100 LYS HA 4.000 . 6.000 5.590 5.284 5.810 . 0 0 "[ . 1]" 1
2922 2 96 ALA MB 2 100 LYS HA 4.000 . 6.000 5.589 5.373 5.716 . 0 0 "[ . 1]" 1
2923 1 96 ALA MB 1 112 ASN HD22 2.900 . 4.000 2.659 2.154 3.141 . 0 0 "[ . 1]" 1
2924 2 96 ALA MB 2 112 ASN HD22 2.900 . 4.000 2.514 2.179 2.840 . 0 0 "[ . 1]" 1
2925 1 19 LYS H 1 96 ALA MB 3.700 . 5.500 4.143 3.723 4.333 . 0 0 "[ . 1]" 1
2926 2 19 LYS H 2 96 ALA MB 3.700 . 5.400 3.811 3.262 4.318 . 0 0 "[ . 1]" 1
2927 1 96 ALA MB 1 101 THR H 4.600 . 6.000 5.782 5.570 5.998 . 0 0 "[ . 1]" 1
2928 2 96 ALA MB 2 101 THR H 4.600 . 6.000 5.812 5.495 5.954 . 0 0 "[ . 1]" 1
2929 1 45 VAL MG2 1 98 ALA MB 2.700 . 3.600 2.634 2.033 3.618 0.018 5 0 "[ . 1]" 1
2930 2 45 VAL MG2 2 98 ALA MB 2.700 . 3.600 2.505 2.134 3.441 . 0 0 "[ . 1]" 1
2931 1 110 ILE MG 1 111 TYR HA 3.700 . 5.400 3.842 3.698 3.967 . 0 0 "[ . 1]" 1
2932 2 110 ILE MG 2 111 TYR HA 3.700 . 5.400 3.815 3.715 3.954 . 0 0 "[ . 1]" 1
2933 1 58 ASP HA 1 59 VAL MG2 4.200 . 6.000 4.102 3.410 4.479 . 0 0 "[ . 1]" 1
2934 2 58 ASP HA 2 59 VAL MG2 4.200 . 6.000 4.237 3.491 4.626 . 0 0 "[ . 1]" 1
2935 1 75 ALA MB 1 76 LYS HG2 3.300 . 4.700 3.474 2.756 4.262 . 0 0 "[ . 1]" 1
2936 2 75 ALA MB 2 76 LYS HG2 3.300 . 4.700 3.343 2.622 3.737 . 0 0 "[ . 1]" 1
2937 1 75 ALA MB 1 76 LYS H 2.800 . 3.800 2.872 2.707 3.077 . 0 0 "[ . 1]" 1
2938 2 75 ALA MB 2 76 LYS H 2.800 . 3.800 2.928 2.741 3.071 . 0 0 "[ . 1]" 1
2939 1 75 ALA H 1 75 ALA MB 2.300 . 3.000 2.135 2.028 2.280 . 0 0 "[ . 1]" 1
2940 2 75 ALA H 2 75 ALA MB 2.300 . 3.000 2.095 2.006 2.227 . 0 0 "[ . 1]" 1
2941 1 74 LEU H 1 75 ALA MB 4.600 . 6.000 4.335 4.153 4.481 . 0 0 "[ . 1]" 1
2942 2 74 LEU H 2 75 ALA MB 4.600 . 6.000 4.368 4.217 4.511 . 0 0 "[ . 1]" 1
2943 1 85 VAL HA 1 85 VAL MG2 3.400 . 4.900 3.159 3.106 3.201 . 0 0 "[ . 1]" 1
2944 2 85 VAL HA 2 85 VAL MG2 3.400 . 4.900 3.176 3.128 3.205 . 0 0 "[ . 1]" 1
2945 1 41 THR H 1 85 VAL MG2 5.400 . 6.000 4.747 4.617 4.813 . 0 0 "[ . 1]" 1
2946 2 41 THR H 2 85 VAL MG2 5.400 . 6.000 4.786 4.647 4.886 . 0 0 "[ . 1]" 1
2947 1 74 LEU MD1 1 85 VAL MG2 4.700 . 6.000 4.988 4.610 5.482 . 0 0 "[ . 1]" 1
2948 2 74 LEU MD1 2 85 VAL MG2 4.700 . 6.000 4.919 4.414 5.467 . 0 0 "[ . 1]" 1
2949 1 86 VAL MG2 1 99 GLY QA 5.100 . 6.000 5.994 5.888 6.062 0.062 4 0 "[ . 1]" 1
2950 2 86 VAL MG2 2 99 GLY QA 5.100 . 6.000 5.968 5.802 6.034 0.034 2 0 "[ . 1]" 1
2951 1 86 VAL MG2 1 95 ALA MB 4.000 . 6.000 5.045 4.840 5.367 . 0 0 "[ . 1]" 1
2952 2 86 VAL MG2 2 95 ALA MB 4.000 . 6.000 5.072 4.878 5.261 . 0 0 "[ . 1]" 1
2953 1 86 VAL MG2 1 111 TYR HA 4.500 . 6.000 4.324 4.206 4.451 . 0 0 "[ . 1]" 1
2954 2 86 VAL MG2 2 111 TYR HA 4.500 . 6.000 4.349 4.179 4.505 . 0 0 "[ . 1]" 1
2955 1 52 LYS HB3 1 53 ALA MB 3.200 . 4.500 4.090 3.479 4.528 0.028 7 0 "[ . 1]" 1
2956 2 52 LYS HB3 2 53 ALA MB 3.200 . 4.500 4.009 3.331 4.296 . 0 0 "[ . 1]" 1
2957 1 52 LYS H 1 53 ALA MB 4.500 . 6.000 4.201 4.114 4.344 . 0 0 "[ . 1]" 1
2958 2 52 LYS H 2 53 ALA MB 4.500 . 6.000 4.204 4.019 4.394 . 0 0 "[ . 1]" 1
2959 1 53 ALA MB 1 54 MET HB3 3.900 . 5.800 4.794 3.802 5.009 . 0 0 "[ . 1]" 1
2960 2 53 ALA MB 2 54 MET HB3 3.900 . 5.800 4.894 4.617 5.014 . 0 0 "[ . 1]" 1
2961 1 53 ALA HA 1 53 ALA MB 2.100 . 2.700 2.104 2.079 2.122 . 0 0 "[ . 1]" 1
2962 2 53 ALA HA 2 53 ALA MB 2.100 . 2.700 2.090 2.075 2.117 . 0 0 "[ . 1]" 1
2963 1 45 VAL HB 1 45 VAL MG1 3.200 . 4.400 2.111 2.082 2.127 . 0 0 "[ . 1]" 1
2964 2 45 VAL HB 2 45 VAL MG1 3.200 . 4.400 2.108 2.095 2.124 . 0 0 "[ . 1]" 1
2965 1 43 ILE MG 1 45 VAL MG1 2.600 . 3.400 3.188 2.756 3.468 0.068 2 0 "[ . 1]" 1
2966 2 43 ILE MG 2 45 VAL MG1 2.600 . 3.400 3.157 2.235 3.515 0.115 2 0 "[ . 1]" 1
2967 1 7 PHE HB3 1 10 THR MG 5.300 . 6.000 5.352 5.076 5.797 . 0 0 "[ . 1]" 1
2968 2 7 PHE HB3 2 10 THR MG 5.300 . 6.000 5.328 4.983 5.847 . 0 0 "[ . 1]" 1
2969 1 23 VAL H 1 23 VAL MG2 2.400 . 3.100 2.248 1.989 2.436 . 0 0 "[ . 1]" 1
2970 2 23 VAL H 2 23 VAL MG2 2.400 . 3.100 2.156 1.819 2.488 . 0 0 "[ . 1]" 1
2971 1 23 VAL HB 1 23 VAL MG2 2.200 . 2.800 2.100 2.083 2.124 . 0 0 "[ . 1]" 1
2972 2 23 VAL HB 2 23 VAL MG2 2.200 . 2.800 2.102 2.083 2.130 . 0 0 "[ . 1]" 1
2973 1 87 VAL MG1 1 113 SER H 4.700 . 6.000 5.508 5.295 5.993 . 0 0 "[ . 1]" 1
2974 2 87 VAL MG1 2 113 SER H 4.700 . 6.000 5.487 5.303 5.631 . 0 0 "[ . 1]" 1
2975 1 42 LEU HA 1 87 VAL MG1 4.300 . 6.000 5.069 4.858 5.239 . 0 0 "[ . 1]" 1
2976 2 42 LEU HA 2 87 VAL MG1 4.300 . 6.000 5.004 4.832 5.342 . 0 0 "[ . 1]" 1
2977 1 87 VAL MG1 1 111 TYR QD 4.200 . 6.000 5.943 5.809 6.021 0.021 10 0 "[ . 1]" 1
2978 2 87 VAL MG1 2 111 TYR QD 4.200 . 6.000 5.935 5.811 6.012 0.012 4 0 "[ . 1]" 1
2979 1 87 VAL MG1 1 111 TYR HB2 4.200 . 6.000 5.890 5.788 6.028 0.028 7 0 "[ . 1]" 1
2980 2 87 VAL MG1 2 111 TYR HB2 4.200 . 6.000 5.947 5.820 6.057 0.057 7 0 "[ . 1]" 1
2981 1 87 VAL MG1 1 112 ASN HA 4.800 . 6.000 4.464 4.274 4.647 . 0 0 "[ . 1]" 1
2982 2 87 VAL MG1 2 112 ASN HA 4.800 . 6.000 4.506 4.394 4.667 . 0 0 "[ . 1]" 1
2983 1 87 VAL H 1 87 VAL MG1 2.900 . 3.900 2.961 2.873 3.042 . 0 0 "[ . 1]" 1
2984 2 87 VAL H 2 87 VAL MG1 2.900 . 3.900 2.981 2.842 3.118 . 0 0 "[ . 1]" 1
2985 1 87 VAL MG2 1 111 TYR QD 4.700 . 6.000 5.503 5.398 5.765 . 0 0 "[ . 1]" 1
2986 2 87 VAL MG2 2 111 TYR QD 4.600 . 6.000 5.466 5.285 5.572 . 0 0 "[ . 1]" 1
2987 1 23 VAL MG1 1 24 MET H 3.100 . 4.300 2.994 2.783 3.200 . 0 0 "[ . 1]" 1
2988 2 23 VAL MG1 2 24 MET H 3.100 . 4.300 3.026 2.840 3.291 . 0 0 "[ . 1]" 1
2989 1 15 VAL MG1 1 16 LYS H 3.200 . 4.500 3.044 2.637 3.379 . 0 0 "[ . 1]" 1
2990 2 15 VAL MG1 2 16 LYS H 3.200 . 4.500 2.667 2.383 3.121 . 0 0 "[ . 1]" 1
2991 1 41 THR MG 1 63 LYS HB3 4.100 . 6.000 4.398 3.938 4.752 . 0 0 "[ . 1]" 1
2992 2 41 THR MG 2 63 LYS HB3 4.100 . 6.000 4.376 4.156 4.674 . 0 0 "[ . 1]" 1
2993 1 41 THR H 1 41 THR MG 3.800 . 5.600 3.732 3.551 3.823 . 0 0 "[ . 1]" 1
2994 2 41 THR H 2 41 THR MG 3.800 . 5.600 3.772 3.671 3.809 . 0 0 "[ . 1]" 1
2995 1 41 THR MG 1 43 ILE MD 4.100 . 6.000 3.840 2.695 4.802 . 0 0 "[ . 1]" 1
2996 2 41 THR MG 2 43 ILE MD 4.100 . 6.000 3.468 2.390 4.499 . 0 0 "[ . 1]" 1
2997 1 41 THR MG 1 61 ASN HA 3.900 . 5.800 3.478 3.116 3.876 . 0 0 "[ . 1]" 1
2998 2 41 THR MG 2 61 ASN HA 3.900 . 5.800 3.590 3.137 4.426 . 0 0 "[ . 1]" 1
2999 1 84 PRO HB3 1 109 THR MG 4.000 . 6.000 3.668 2.986 3.978 . 0 0 "[ . 1]" 1
3000 2 84 PRO HB3 2 109 THR MG 4.000 . 6.000 3.628 3.300 3.848 . 0 0 "[ . 1]" 1
3001 1 102 LEU MD2 1 102 LEU HG 2.400 . 3.100 2.098 2.080 2.129 . 0 0 "[ . 1]" 1
3002 2 102 LEU MD2 2 102 LEU HG 2.400 . 3.100 2.116 2.083 2.128 . 0 0 "[ . 1]" 1
3003 1 31 TYR HA 1 59 VAL MG1 3.600 . 5.200 3.677 3.349 4.006 . 0 0 "[ . 1]" 1
3004 2 31 TYR HA 2 59 VAL MG1 3.600 . 5.200 3.823 3.507 4.245 . 0 0 "[ . 1]" 1
3005 1 59 VAL MG1 1 120 TRP HZ2 2.300 . 3.000 2.268 2.122 2.392 . 0 0 "[ . 1]" 1
3006 2 59 VAL MG1 2 120 TRP HZ2 2.300 . 3.000 2.233 2.023 2.385 . 0 0 "[ . 1]" 1
3007 1 59 VAL MG1 1 61 ASN H 5.100 . 6.000 4.401 3.759 4.656 . 0 0 "[ . 1]" 1
3008 2 59 VAL MG1 2 61 ASN H 5.100 . 6.000 4.439 3.809 4.854 . 0 0 "[ . 1]" 1
3009 1 59 VAL MG1 1 120 TRP HE1 4.200 . 6.000 3.978 3.473 4.487 . 0 0 "[ . 1]" 1
3010 2 59 VAL MG1 2 120 TRP HE1 4.200 . 6.000 3.854 3.421 4.071 . 0 0 "[ . 1]" 1
3011 1 121 LEU MD2 1 124 GLY H 3.800 . 5.600 4.910 4.442 5.533 . 0 0 "[ . 1]" 1
3012 2 121 LEU MD2 2 124 GLY H 3.800 . 5.600 4.867 4.466 5.435 . 0 0 "[ . 1]" 1
3013 1 121 LEU HA 1 121 LEU MD2 2.300 . 2.900 1.987 1.710 2.524 . 0 0 "[ . 1]" 1
3014 2 121 LEU HA 2 121 LEU MD2 2.300 . 2.900 1.964 1.696 2.374 0.004 6 0 "[ . 1]" 1
3015 1 121 LEU HB2 1 121 LEU MD2 3.400 . 4.800 3.170 3.108 3.184 . 0 0 "[ . 1]" 1
3016 2 121 LEU HB2 2 121 LEU MD2 3.400 . 4.800 3.177 3.152 3.198 . 0 0 "[ . 1]" 1
3017 1 73 LEU HB2 1 73 LEU MD2 2.600 . 3.400 2.567 2.371 2.921 . 0 0 "[ . 1]" 1
3018 2 73 LEU HB2 2 73 LEU MD2 2.600 . 3.400 2.514 2.304 2.697 . 0 0 "[ . 1]" 1
3019 1 74 LEU MD1 1 74 LEU MD2 2.100 . 2.700 2.017 1.909 2.069 . 0 0 "[ . 1]" 1
3020 2 74 LEU MD1 2 74 LEU MD2 2.100 . 2.700 1.964 1.858 2.071 . 0 0 "[ . 1]" 1
3021 1 74 LEU HA 1 74 LEU MD2 3.400 . 4.900 3.910 3.784 4.085 . 0 0 "[ . 1]" 1
3022 2 74 LEU HA 2 74 LEU MD2 3.400 . 4.900 3.847 3.754 3.944 . 0 0 "[ . 1]" 1
3023 1 25 LEU MD2 1 26 SER HA 4.700 . 6.000 4.735 4.442 5.068 . 0 0 "[ . 1]" 1
3024 2 25 LEU MD2 2 26 SER HA 4.700 . 6.000 4.812 4.533 5.045 . 0 0 "[ . 1]" 1
3025 1 25 LEU MD2 1 30 ALA HA 4.800 . 6.000 4.775 4.507 5.027 . 0 0 "[ . 1]" 1
3026 2 25 LEU MD2 2 30 ALA HA 4.800 . 6.000 4.829 4.738 4.956 . 0 0 "[ . 1]" 1
3027 1 25 LEU HB3 1 25 LEU MD2 2.500 . 3.300 2.628 2.545 2.736 . 0 0 "[ . 1]" 1
3028 2 25 LEU HB3 2 25 LEU MD2 2.500 . 3.300 2.603 2.483 2.703 . 0 0 "[ . 1]" 1
3029 1 25 LEU MD2 1 29 ASP HB2 3.200 . 4.500 2.884 2.434 3.204 . 0 0 "[ . 1]" 1
3030 2 25 LEU MD2 2 29 ASP HB2 3.200 . 4.500 2.877 2.573 3.203 . 0 0 "[ . 1]" 1
3031 1 125 LEU MD1 1 125 LEU MD2 1.900 . 2.300 1.986 1.860 2.051 . 0 0 "[ . 1]" 1
3032 2 125 LEU MD1 2 125 LEU MD2 1.900 . 2.300 1.975 1.862 2.045 . 0 0 "[ . 1]" 1
3033 2 56 LYS HE3 2 128 LEU MD2 4.900 . 6.000 3.994 2.732 4.931 . 0 0 "[ . 1]" 1
3034 1 125 LEU HA 1 125 LEU MD2 2.100 . 2.600 1.965 1.610 2.280 . 0 0 "[ . 1]" 1
3035 2 125 LEU HA 2 125 LEU MD2 2.100 . 2.600 2.013 1.752 2.248 . 0 0 "[ . 1]" 1
3036 1 40 ILE HA 1 85 VAL MG1 3.600 . 5.200 3.779 3.555 3.963 . 0 0 "[ . 1]" 1
3037 2 40 ILE HA 2 85 VAL MG1 3.600 . 5.200 3.707 3.331 4.220 . 0 0 "[ . 1]" 1
3038 1 120 TRP HE1 1 125 LEU MD2 4.500 . 6.000 5.085 4.906 5.400 . 0 0 "[ . 1]" 1
3039 2 120 TRP HE1 2 125 LEU MD2 4.500 . 6.000 5.111 4.880 5.340 . 0 0 "[ . 1]" 1
3040 2 58 ASP HB3 2 128 LEU MD2 4.300 . 6.000 4.704 4.121 5.886 . 0 0 "[ . 1]" 1
3041 1 125 LEU MD2 1 126 PRO HD2 2.700 . 3.600 2.411 2.042 2.940 . 0 0 "[ . 1]" 1
3042 2 125 LEU MD2 2 126 PRO HD2 2.700 . 3.600 2.475 2.240 2.657 . 0 0 "[ . 1]" 1
3043 1 125 LEU QB 1 125 LEU MD2 3.500 . 5.000 2.313 2.248 2.437 . 0 0 "[ . 1]" 1
3044 2 125 LEU QB 2 125 LEU MD2 3.500 . 5.000 2.286 2.181 2.397 . 0 0 "[ . 1]" 1
3045 1 125 LEU H 1 125 LEU MD2 3.500 . 5.100 3.543 3.247 3.658 . 0 0 "[ . 1]" 1
3046 2 125 LEU H 2 125 LEU MD2 3.500 . 5.100 3.492 3.371 3.750 . 0 0 "[ . 1]" 1
3047 1 86 VAL MG1 1 87 VAL H 3.300 . 4.600 4.035 3.921 4.094 . 0 0 "[ . 1]" 1
3048 2 86 VAL MG1 2 87 VAL H 3.300 . 4.600 4.044 3.929 4.135 . 0 0 "[ . 1]" 1
3049 1 29 ASP HB3 1 33 LEU MD1 4.200 . 6.000 5.313 4.980 5.587 . 0 0 "[ . 1]" 1
3050 2 29 ASP HB3 2 33 LEU MD1 4.200 . 6.000 5.270 4.989 5.599 . 0 0 "[ . 1]" 1
3051 1 70 LEU MD1 1 70 LEU HG 2.400 . 3.100 2.105 2.084 2.127 . 0 0 "[ . 1]" 1
3052 2 70 LEU MD1 2 70 LEU HG 2.400 . 3.100 2.097 2.080 2.128 . 0 0 "[ . 1]" 1
3053 1 70 LEU MD1 1 74 LEU MD2 2.800 . 3.800 3.098 2.471 3.533 . 0 0 "[ . 1]" 1
3054 2 70 LEU MD1 2 74 LEU MD2 2.800 . 3.800 3.232 2.912 3.404 . 0 0 "[ . 1]" 1
3055 1 70 LEU H 1 70 LEU MD1 4.600 . 6.000 4.693 4.250 4.949 . 0 0 "[ . 1]" 1
3056 2 70 LEU H 2 70 LEU MD1 4.600 . 6.000 4.645 4.249 4.907 . 0 0 "[ . 1]" 1
3057 1 51 LEU MD2 1 56 LYS HG2 2.700 . 3.600 3.356 2.480 4.275 0.675 10 3 "[ *. -+]" 1
3058 2 51 LEU MD2 2 56 LYS HG2 2.700 . 3.600 3.297 2.166 4.439 0.839 4 2 "[ +. -1]" 1
3059 1 51 LEU H 1 51 LEU MD2 3.900 . 5.800 4.204 4.096 4.312 . 0 0 "[ . 1]" 1
3060 2 51 LEU H 2 51 LEU MD2 3.900 . 5.800 4.220 4.112 4.339 . 0 0 "[ . 1]" 1
3061 1 51 LEU MD2 1 64 HIS HB2 3.200 . 4.500 3.605 3.095 3.973 . 0 0 "[ . 1]" 1
3062 2 51 LEU MD2 2 64 HIS HB2 3.200 . 4.500 3.660 3.129 3.979 . 0 0 "[ . 1]" 1
3063 1 34 LEU MD2 1 35 GLN H 4.000 . 6.000 4.477 4.314 4.662 . 0 0 "[ . 1]" 1
3064 2 34 LEU MD2 2 35 GLN H 4.000 . 6.000 4.424 4.183 4.658 . 0 0 "[ . 1]" 1
3065 1 51 LEU MD2 1 56 LYS HE3 4.100 . 6.000 4.278 2.275 5.087 . 0 0 "[ . 1]" 1
3066 2 51 LEU MD2 2 56 LYS HE3 4.100 . 6.000 4.321 3.563 5.063 . 0 0 "[ . 1]" 1
3067 1 46 ARG H 1 51 LEU MD2 3.800 . 5.600 4.722 4.206 5.440 . 0 0 "[ . 1]" 1
3068 2 46 ARG H 2 51 LEU MD2 3.800 . 5.600 4.730 4.351 5.296 . 0 0 "[ . 1]" 1
3069 1 46 ARG H 1 51 LEU MD1 3.000 . 4.200 3.872 3.479 4.209 0.009 7 0 "[ . 1]" 1
3070 2 46 ARG H 2 51 LEU MD1 3.000 . 4.200 3.827 3.168 4.179 . 0 0 "[ . 1]" 1
3071 1 51 LEU H 1 51 LEU MD1 2.300 . 3.000 2.973 2.814 3.051 0.051 10 0 "[ . 1]" 1
3072 2 51 LEU H 2 51 LEU MD1 2.300 . 3.000 2.881 2.472 3.044 0.044 1 0 "[ . 1]" 1
3073 1 97 LEU MD1 2 11 PHE QD 3.700 . 5.400 5.275 5.004 5.448 0.048 10 0 "[ . 1]" 1
3074 1 11 PHE QD 2 97 LEU MD1 3.700 . 5.400 5.340 4.976 5.428 0.028 8 0 "[ . 1]" 1
3075 1 74 LEU MD1 2 11 PHE HB2 3.700 . 5.400 5.268 4.577 5.466 0.066 2 0 "[ . 1]" 1
3076 1 11 PHE HB2 2 74 LEU MD1 3.700 . 5.400 5.254 4.628 5.479 0.079 2 0 "[ . 1]" 1
3077 1 74 LEU MD1 1 102 LEU HG 3.100 . 4.300 3.426 2.991 3.990 . 0 0 "[ . 1]" 1
3078 2 74 LEU MD1 2 102 LEU HG 3.100 . 4.300 3.183 2.991 3.422 . 0 0 "[ . 1]" 1
3079 1 74 LEU MD1 2 11 PHE HZ 4.000 . 6.000 4.814 4.300 5.521 . 0 0 "[ . 1]" 1
3080 1 11 PHE HZ 2 74 LEU MD1 4.000 . 6.000 4.571 4.178 4.811 . 0 0 "[ . 1]" 1
3081 1 27 PRO HA 1 125 LEU MD1 4.300 . 6.000 3.817 3.596 3.978 . 0 0 "[ . 1]" 1
3082 2 27 PRO HA 2 125 LEU MD1 4.300 . 6.000 3.789 3.615 3.870 . 0 0 "[ . 1]" 1
3083 1 27 PRO HG2 1 125 LEU MD1 4.000 . 6.000 3.369 3.119 3.733 . 0 0 "[ . 1]" 1
3084 2 27 PRO HG2 2 125 LEU MD1 4.000 . 6.000 3.444 3.219 3.696 . 0 0 "[ . 1]" 1
3085 1 125 LEU QB 1 125 LEU MD1 2.900 . 3.900 2.049 2.031 2.067 . 0 0 "[ . 1]" 1
3086 2 125 LEU QB 2 125 LEU MD1 2.900 . 3.900 2.052 2.030 2.081 . 0 0 "[ . 1]" 1
3087 1 120 TRP HZ2 1 125 LEU MD1 3.200 . 4.400 3.115 2.968 3.220 . 0 0 "[ . 1]" 1
3088 2 120 TRP HZ2 2 125 LEU MD1 3.200 . 4.400 3.135 2.957 3.290 . 0 0 "[ . 1]" 1
3089 1 125 LEU MD1 1 125 LEU HG 2.300 . 2.900 2.079 2.075 2.085 . 0 0 "[ . 1]" 1
3090 2 125 LEU MD1 2 125 LEU HG 2.300 . 2.900 2.085 2.075 2.114 . 0 0 "[ . 1]" 1
3091 2 128 LEU HB2 2 128 LEU MD1 1.800 . 2.200 2.084 1.959 2.213 0.013 1 0 "[ . 1]" 1
3092 1 59 VAL H 1 128 LEU QD 3.900 . 5.800 4.098 3.533 4.504 . 0 0 "[ . 1]" 1
3093 2 59 VAL H 2 128 LEU MD1 3.900 . 5.800 4.096 3.565 4.917 . 0 0 "[ . 1]" 1
3094 2 128 LEU H 2 128 LEU MD1 3.700 . 5.400 3.584 3.046 4.111 . 0 0 "[ . 1]" 1
3095 1 42 LEU HB3 1 42 LEU MD2 2.700 . 3.600 2.109 2.030 2.177 . 0 0 "[ . 1]" 1
3096 2 42 LEU HB3 2 42 LEU MD2 2.700 . 3.600 2.089 1.965 2.200 . 0 0 "[ . 1]" 1
3097 1 42 LEU HA 1 42 LEU MD2 3.800 . 5.600 3.981 3.951 4.047 . 0 0 "[ . 1]" 1
3098 2 42 LEU HA 2 42 LEU MD2 3.800 . 5.600 3.986 3.947 4.035 . 0 0 "[ . 1]" 1
3099 1 42 LEU MD2 1 42 LEU HG 2.400 . 3.100 2.111 2.082 2.128 . 0 0 "[ . 1]" 1
3100 2 42 LEU MD2 2 42 LEU HG 2.400 . 3.100 2.112 2.087 2.126 . 0 0 "[ . 1]" 1
3101 1 42 LEU HA 1 42 LEU MD1 3.000 . 4.100 2.464 2.174 2.625 . 0 0 "[ . 1]" 1
3102 2 42 LEU HA 2 42 LEU MD1 3.000 . 4.100 2.555 2.266 2.857 . 0 0 "[ . 1]" 1
3103 1 42 LEU H 1 42 LEU MD1 4.400 . 6.000 4.406 4.307 4.495 . 0 0 "[ . 1]" 1
3104 2 42 LEU H 2 42 LEU MD1 4.400 . 6.000 4.442 4.376 4.512 . 0 0 "[ . 1]" 1
3105 1 42 LEU HB2 1 42 LEU MD1 2.500 . 3.300 2.134 2.013 2.283 . 0 0 "[ . 1]" 1
3106 2 42 LEU HB2 2 42 LEU MD1 2.500 . 3.300 2.090 1.940 2.314 . 0 0 "[ . 1]" 1
3107 1 33 LEU HB2 1 33 LEU MD2 3.400 . 4.800 2.761 2.699 2.819 . 0 0 "[ . 1]" 1
3108 2 33 LEU HB2 2 33 LEU MD2 3.400 . 4.800 2.782 2.725 2.833 . 0 0 "[ . 1]" 1
3109 1 25 LEU MD1 1 33 LEU MD2 2.100 . 2.700 2.120 1.954 2.435 . 0 0 "[ . 1]" 1
3110 2 25 LEU MD1 2 33 LEU MD2 2.100 . 2.700 2.127 1.984 2.211 . 0 0 "[ . 1]" 1
3111 1 102 LEU HB3 1 102 LEU MD1 3.200 . 4.500 2.292 2.200 2.365 . 0 0 "[ . 1]" 1
3112 2 102 LEU HB3 2 102 LEU MD1 3.200 . 4.500 2.244 2.103 2.520 . 0 0 "[ . 1]" 1
3113 1 121 LEU H 1 121 LEU MD1 4.500 . 6.000 3.844 3.214 4.180 . 0 0 "[ . 1]" 1
3114 2 121 LEU H 2 121 LEU MD1 4.500 . 6.000 3.824 3.415 4.247 . 0 0 "[ . 1]" 1
3115 1 73 LEU MD1 1 76 LYS HG2 3.600 . 5.300 4.652 4.125 5.379 0.079 2 0 "[ . 1]" 1
3116 2 73 LEU MD1 2 76 LYS HG2 3.600 . 5.300 4.499 3.585 5.175 . 0 0 "[ . 1]" 1
3117 1 25 LEU HB3 1 25 LEU MD1 2.400 . 3.100 2.070 1.979 2.150 . 0 0 "[ . 1]" 1
3118 2 25 LEU HB3 2 25 LEU MD1 2.400 . 3.100 2.128 1.994 2.221 . 0 0 "[ . 1]" 1
3119 1 73 LEU HB2 1 73 LEU MD1 4.100 . 6.000 3.134 2.904 3.198 . 0 0 "[ . 1]" 1
3120 2 73 LEU HB2 2 73 LEU MD1 4.100 . 6.000 3.146 3.075 3.198 . 0 0 "[ . 1]" 1
3121 1 25 LEU MD1 1 30 ALA HA 2.700 . 3.600 2.568 2.330 2.799 . 0 0 "[ . 1]" 1
3122 1 34 LEU MD1 1 35 GLN H 4.700 . 6.000 4.356 4.200 4.470 . 0 0 "[ . 1]" 1
3123 2 34 LEU MD1 2 35 GLN H 4.700 . 6.000 4.309 4.177 4.574 . 0 0 "[ . 1]" 1
3124 2 85 VAL MG1 2 110 ILE HA 4.700 . 6.000 5.091 4.976 5.151 . 0 0 "[ . 1]" 1
3125 2 15 VAL MG2 2 16 LYS H 3.900 . 5.800 4.293 4.244 4.319 . 0 0 "[ . 1]" 1
3126 2 70 LEU MD2 2 101 THR MG 3.800 . 5.600 5.180 4.717 5.667 0.067 6 0 "[ . 1]" 1
3127 1 42 LEU MD2 1 88 PHE HA 5.300 . 6.000 4.890 4.473 5.233 . 0 0 "[ . 1]" 1
3128 2 42 LEU MD2 2 88 PHE HA 5.300 . 6.000 4.924 4.567 5.312 . 0 0 "[ . 1]" 1
3129 1 111 TYR HA 1 111 TYR QD 3.100 . 4.300 3.217 3.132 3.312 . 0 0 "[ . 1]" 1
3130 2 111 TYR HA 2 111 TYR QD 3.100 . 4.300 3.203 3.066 3.279 . 0 0 "[ . 1]" 1
3131 1 23 VAL HB 1 111 TYR HA 2.800 . 3.700 2.441 2.252 2.622 . 0 0 "[ . 1]" 1
3132 2 23 VAL HB 2 111 TYR HA 2.800 . 3.700 2.352 2.195 2.458 . 0 0 "[ . 1]" 1
3133 1 24 MET HA 1 111 TYR HA 5.000 . 6.000 4.675 4.392 5.028 . 0 0 "[ . 1]" 1
3134 2 24 MET HA 2 111 TYR HA 5.000 . 6.000 4.612 4.443 4.815 . 0 0 "[ . 1]" 1
3135 1 111 TYR HA 1 111 TYR HB3 2.900 . 4.000 2.354 2.324 2.386 . 0 0 "[ . 1]" 1
3136 2 111 TYR HA 2 111 TYR HB3 2.900 . 4.000 2.343 2.326 2.363 . 0 0 "[ . 1]" 1
3137 1 25 LEU MD1 1 111 TYR HA 5.400 . 6.000 4.988 4.726 5.103 . 0 0 "[ . 1]" 1
3138 2 25 LEU MD1 2 111 TYR HA 5.400 . 6.000 4.873 4.567 5.066 . 0 0 "[ . 1]" 1
3139 1 57 PRO HG2 1 62 TYR QE 4.000 . 6.000 3.428 2.840 3.913 . 0 0 "[ . 1]" 1
3140 2 57 PRO HG2 2 62 TYR QE 4.000 . 6.000 3.577 2.837 4.176 . 0 0 "[ . 1]" 1
3141 1 59 VAL MG1 1 62 TYR QE 4.800 . 6.000 6.019 5.786 6.159 0.159 1 0 "[ . 1]" 1
3142 2 59 VAL MG1 2 62 TYR QE 4.800 . 6.000 5.962 5.500 6.097 0.097 4 0 "[ . 1]" 1
3143 1 62 TYR QE 1 64 HIS HB3 3.400 . 4.900 4.525 4.181 4.926 0.026 2 0 "[ . 1]" 1
3144 2 62 TYR QE 2 64 HIS HB3 3.400 . 4.900 4.493 4.181 4.793 . 0 0 "[ . 1]" 1
3145 1 44 ASP HA 1 62 TYR QE 5.500 . 6.000 4.036 3.840 4.255 . 0 0 "[ . 1]" 1
3146 2 44 ASP HA 2 62 TYR QE 5.500 . 6.000 4.113 3.960 4.289 . 0 0 "[ . 1]" 1
3147 1 56 LYS HG2 1 62 TYR QE 4.600 . 6.000 4.414 3.665 4.884 . 0 0 "[ . 1]" 1
3148 2 56 LYS HG2 2 62 TYR QE 4.600 . 6.000 4.534 3.974 5.310 . 0 0 "[ . 1]" 1
3149 1 62 TYR QE 1 88 PHE QD 4.500 . 6.000 5.267 4.792 6.032 0.032 1 0 "[ . 1]" 1
3150 2 62 TYR QE 2 88 PHE QD 4.500 . 6.000 5.445 4.651 6.007 0.007 1 0 "[ . 1]" 1
3151 1 62 TYR QE 1 63 LYS H 4.300 . 6.000 4.048 3.931 4.162 . 0 0 "[ . 1]" 1
3152 2 62 TYR QE 2 63 LYS H 4.300 . 6.000 4.093 3.919 4.347 . 0 0 "[ . 1]" 1
3153 1 44 ASP HB2 1 62 TYR QE 3.000 . 4.100 2.692 2.251 3.125 . 0 0 "[ . 1]" 1
3154 2 44 ASP HB2 2 62 TYR QE 3.000 . 4.100 2.955 2.446 3.157 . 0 0 "[ . 1]" 1
3155 1 62 TYR QE 1 64 HIS HD2 4.300 . 6.000 3.710 3.075 4.474 . 0 0 "[ . 1]" 1
3156 2 62 TYR QE 2 64 HIS HD2 4.300 . 6.000 3.564 2.769 4.471 . 0 0 "[ . 1]" 1
3157 1 57 PRO QD 1 62 TYR QE 3.500 . 5.000 3.556 3.138 4.204 . 0 0 "[ . 1]" 1
3158 2 57 PRO QD 2 62 TYR QE 3.500 . 5.000 3.726 3.066 4.142 . 0 0 "[ . 1]" 1
3159 1 56 LYS HA 1 62 TYR QE 4.800 . 6.000 5.263 4.853 6.018 0.018 1 0 "[ . 1]" 1
3160 2 56 LYS HA 2 62 TYR QE 4.800 . 6.000 5.405 4.810 5.758 . 0 0 "[ . 1]" 1
3161 1 56 LYS HD2 1 62 TYR QE 3.800 . 5.600 2.963 1.968 4.129 0.032 8 0 "[ . 1]" 1
3162 2 56 LYS HD2 2 62 TYR QE 3.800 . 5.600 3.018 1.833 5.245 0.167 8 0 "[ . 1]" 1
3163 1 62 TYR QE 1 64 HIS HA 3.400 . 4.800 3.114 2.759 3.553 . 0 0 "[ . 1]" 1
3164 2 62 TYR QE 2 64 HIS HA 3.400 . 4.800 2.835 2.522 3.547 . 0 0 "[ . 1]" 1
3165 1 56 LYS HE2 1 62 TYR QE 4.900 . 6.000 4.255 2.248 5.234 . 0 0 "[ . 1]" 1
3166 2 56 LYS HE2 2 62 TYR QE 4.900 . 6.000 4.742 4.186 5.314 . 0 0 "[ . 1]" 1
3167 1 56 LYS HE3 1 62 TYR QE 3.600 . 5.200 4.065 1.882 5.618 0.418 10 0 "[ . 1]" 1
3168 2 56 LYS HE3 2 62 TYR QE 3.600 . 5.200 4.433 3.452 5.700 0.500 9 1 "[ . +1]" 1
3169 1 62 TYR QE 1 63 LYS HA 4.000 . 6.000 4.845 4.470 5.259 . 0 0 "[ . 1]" 1
3170 2 62 TYR QE 2 63 LYS HA 4.000 . 6.000 4.585 4.359 4.836 . 0 0 "[ . 1]" 1
3171 1 43 ILE HG13 1 62 TYR QE 5.100 . 6.000 6.334 6.033 6.705 0.705 8 4 "[* *. -+ 1]" 1
3172 2 43 ILE HG13 2 62 TYR QE 5.100 . 6.000 6.244 6.015 6.843 0.843 1 3 "[+ - *1]" 1
3173 1 62 TYR QE 1 128 LEU QD 4.000 . 6.000 4.063 3.116 5.560 . 0 0 "[ . 1]" 1
3174 2 62 TYR QE 2 128 LEU MD1 4.000 . 6.000 3.788 3.116 4.494 . 0 0 "[ . 1]" 1
3175 1 44 ASP HB3 1 62 TYR QE 1.900 . 2.400 1.416 1.312 1.792 0.088 1 0 "[ . 1]" 1
3176 2 44 ASP HB3 2 62 TYR QE 1.900 . 2.400 1.366 1.310 1.429 0.090 7 0 "[ . 1]" 1
3177 1 120 TRP HD1 1 121 LEU HG 3.400 . 4.900 4.095 3.492 4.517 . 0 0 "[ . 1]" 1
3178 2 120 TRP HD1 2 121 LEU HG 3.400 . 4.900 4.062 3.680 4.720 . 0 0 "[ . 1]" 1
3179 1 88 PHE QD 1 120 TRP HD1 4.300 . 6.000 6.175 6.141 6.231 0.231 6 0 "[ . 1]" 1
3180 2 88 PHE QD 2 120 TRP HD1 4.300 . 6.000 6.178 6.120 6.241 0.241 3 0 "[ . 1]" 1
3181 1 120 TRP HD1 1 121 LEU HA 3.600 . 5.200 3.842 3.564 4.043 . 0 0 "[ . 1]" 1
3182 2 120 TRP HD1 2 121 LEU HA 3.600 . 5.200 3.857 3.662 4.027 . 0 0 "[ . 1]" 1
3183 1 120 TRP HD1 1 121 LEU QD 4.000 . 6.000 3.783 3.501 4.018 . 0 0 "[ . 1]" 1
3184 2 120 TRP HD1 2 121 LEU QD 4.000 . 6.000 3.813 3.431 4.013 . 0 0 "[ . 1]" 1
3185 1 57 PRO HA 1 120 TRP HD1 4.100 . 6.000 3.150 2.963 3.333 . 0 0 "[ . 1]" 1
3186 2 57 PRO HA 2 120 TRP HD1 4.100 . 6.000 3.177 2.847 3.453 . 0 0 "[ . 1]" 1
3187 1 120 TRP HD1 1 125 LEU MD1 3.800 . 5.700 4.391 4.257 4.611 . 0 0 "[ . 1]" 1
3188 2 120 TRP HD1 2 125 LEU MD1 3.800 . 5.700 4.367 4.152 4.566 . 0 0 "[ . 1]" 1
3189 1 120 TRP HA 1 120 TRP HD1 4.100 . 6.000 4.078 4.012 4.155 . 0 0 "[ . 1]" 1
3190 2 120 TRP HA 2 120 TRP HD1 4.100 . 6.000 4.080 4.025 4.140 . 0 0 "[ . 1]" 1
3191 1 120 TRP HD1 1 125 LEU HA 4.200 . 6.000 5.781 5.660 5.954 . 0 0 "[ . 1]" 1
3192 2 120 TRP HD1 2 125 LEU HA 4.200 . 6.000 5.777 5.574 6.021 0.021 3 0 "[ . 1]" 1
3193 1 120 TRP HD1 1 127 SER HA 4.300 . 6.000 3.577 3.356 3.749 . 0 0 "[ . 1]" 1
3194 2 120 TRP HD1 2 127 SER HA 4.300 . 6.000 3.655 3.266 3.950 . 0 0 "[ . 1]" 1
3195 1 120 TRP HD1 1 121 LEU MD2 3.200 . 4.500 3.871 3.538 4.134 . 0 0 "[ . 1]" 1
3196 2 120 TRP HD1 2 121 LEU MD2 3.200 . 4.500 3.909 3.472 4.138 . 0 0 "[ . 1]" 1
3197 1 57 PRO HB2 1 120 TRP HD1 5.800 . 6.000 5.444 5.127 5.817 . 0 0 "[ . 1]" 1
3198 2 57 PRO HB2 2 120 TRP HD1 5.800 . 6.000 5.487 5.092 5.793 . 0 0 "[ . 1]" 1
3199 1 27 PRO HD2 1 88 PHE QE 4.700 . 6.000 4.578 4.315 5.363 . 0 0 "[ . 1]" 1
3200 2 27 PRO HD2 2 88 PHE QE 4.700 . 6.000 4.668 4.413 5.169 . 0 0 "[ . 1]" 1
3201 1 44 ASP HB2 1 88 PHE QE 4.000 . 6.000 5.304 4.499 5.763 . 0 0 "[ . 1]" 1
3202 2 44 ASP HB2 2 88 PHE QE 4.000 . 6.000 5.248 4.871 5.626 . 0 0 "[ . 1]" 1
3203 1 88 PHE QE 1 117 MET HA 2.400 . 3.100 2.224 1.766 2.859 . 0 0 "[ . 1]" 1
3204 2 88 PHE QE 2 117 MET HA 2.400 . 3.100 2.314 2.010 2.922 . 0 0 "[ . 1]" 1
3205 1 88 PHE QE 1 120 TRP HD1 3.700 . 5.400 4.479 4.382 4.636 . 0 0 "[ . 1]" 1
3206 2 88 PHE QE 2 120 TRP HD1 3.700 . 5.400 4.444 4.326 4.627 . 0 0 "[ . 1]" 1
3207 1 88 PHE QE 1 120 TRP QB 3.900 . 5.800 2.105 1.941 2.593 0.059 10 0 "[ . 1]" 1
3208 2 88 PHE QE 2 120 TRP QB 3.900 . 5.800 2.193 1.920 2.595 0.080 4 0 "[ . 1]" 1
3209 1 88 PHE QE 1 113 SER QB 4.800 . 6.000 2.726 2.335 3.459 . 0 0 "[ . 1]" 1
3210 2 88 PHE QE 2 113 SER QB 4.800 . 6.000 2.726 2.492 3.229 . 0 0 "[ . 1]" 1
3211 1 56 LYS HA 1 88 PHE QE 4.400 . 6.000 5.092 4.346 5.596 . 0 0 "[ . 1]" 1
3212 2 56 LYS HA 2 88 PHE QE 4.400 . 6.000 4.957 4.546 5.487 . 0 0 "[ . 1]" 1
3213 1 57 PRO QD 1 88 PHE QE 3.900 . 5.800 3.290 2.312 4.274 . 0 0 "[ . 1]" 1
3214 2 57 PRO QD 2 88 PHE QE 3.900 . 5.800 3.111 2.431 4.154 . 0 0 "[ . 1]" 1
3215 1 88 PHE QE 1 116 GLY HA2 4.900 . 6.000 4.071 3.441 4.887 . 0 0 "[ . 1]" 1
3216 2 88 PHE QE 2 116 GLY HA2 4.900 . 6.000 4.125 3.596 4.587 . 0 0 "[ . 1]" 1
3217 1 84 PRO HB3 1 111 TYR QE 3.800 . 5.600 3.204 2.455 3.795 . 0 0 "[ . 1]" 1
3218 2 84 PRO HB3 2 111 TYR QE 3.800 . 5.600 3.012 2.671 3.439 . 0 0 "[ . 1]" 1
3219 1 33 LEU MD2 1 111 TYR QE 3.400 . 4.900 3.229 2.812 3.576 . 0 0 "[ . 1]" 1
3220 2 33 LEU MD2 2 111 TYR QE 3.400 . 4.900 3.184 2.925 3.417 . 0 0 "[ . 1]" 1
3221 1 40 ILE MG 1 111 TYR QE 2.900 . 4.000 2.655 1.949 3.316 . 0 0 "[ . 1]" 1
3222 2 40 ILE MG 2 111 TYR QE 2.900 . 4.000 2.569 2.298 3.010 . 0 0 "[ . 1]" 1
3223 1 41 THR H 1 111 TYR QE 4.700 . 6.000 5.938 5.713 6.052 0.052 8 0 "[ . 1]" 1
3224 2 41 THR H 2 111 TYR QE 4.700 . 6.000 5.808 5.434 6.028 0.028 8 0 "[ . 1]" 1
3225 1 109 THR HB 1 111 TYR QE 3.700 . 5.400 3.077 2.655 3.756 . 0 0 "[ . 1]" 1
3226 2 109 THR HB 2 111 TYR QE 3.700 . 5.400 3.142 2.855 3.660 . 0 0 "[ . 1]" 1
3227 1 84 PRO HG3 1 111 TYR QE 4.300 . 6.000 5.174 4.620 5.796 . 0 0 "[ . 1]" 1
3228 2 84 PRO HG3 2 111 TYR QE 4.300 . 6.000 5.019 4.780 5.272 . 0 0 "[ . 1]" 1
3229 1 84 PRO HA 1 111 TYR QE 4.000 . 6.000 4.029 3.800 4.304 . 0 0 "[ . 1]" 1
3230 2 84 PRO HA 2 111 TYR QE 4.000 . 6.000 3.931 3.727 4.256 . 0 0 "[ . 1]" 1
3231 1 33 LEU HB2 1 111 TYR QE 4.700 . 6.000 4.969 4.695 5.368 . 0 0 "[ . 1]" 1
3232 2 33 LEU HB2 2 111 TYR QE 4.700 . 6.000 4.852 4.651 5.130 . 0 0 "[ . 1]" 1
3233 1 111 TYR HA 1 111 TYR QE 4.400 . 6.000 4.986 4.890 5.065 . 0 0 "[ . 1]" 1
3234 2 111 TYR HA 2 111 TYR QE 4.400 . 6.000 4.995 4.934 5.060 . 0 0 "[ . 1]" 1
3235 1 44 ASP HB3 1 62 TYR QD 4.400 . 6.000 3.505 3.033 4.171 . 0 0 "[ . 1]" 1
3236 2 44 ASP HB3 2 62 TYR QD 4.400 . 6.000 3.108 2.574 3.649 . 0 0 "[ . 1]" 1
3237 1 42 LEU HB3 1 62 TYR QD 4.200 . 6.000 3.420 2.882 4.208 . 0 0 "[ . 1]" 1
3238 2 42 LEU HB3 2 62 TYR QD 4.200 . 6.000 3.530 2.929 4.181 . 0 0 "[ . 1]" 1
3239 1 62 TYR QB 1 62 TYR QD 2.200 . 2.800 2.169 2.137 2.214 . 0 0 "[ . 1]" 1
3240 2 62 TYR QB 2 62 TYR QD 2.200 . 2.800 2.152 2.133 2.179 . 0 0 "[ . 1]" 1
3241 1 62 TYR HA 1 62 TYR QD 3.500 . 5.000 2.468 2.122 2.940 . 0 0 "[ . 1]" 1
3242 2 62 TYR HA 2 62 TYR QD 3.500 . 5.000 2.727 2.486 3.249 . 0 0 "[ . 1]" 1
3243 1 59 VAL MG2 1 62 TYR QD 3.600 . 5.200 3.327 2.779 3.663 . 0 0 "[ . 1]" 1
3244 2 59 VAL MG2 2 62 TYR QD 3.600 . 5.200 3.313 2.074 3.750 . 0 0 "[ . 1]" 1
3245 1 61 ASN HA 1 62 TYR QD 5.100 . 6.000 6.034 5.951 6.085 0.085 9 0 "[ . 1]" 1
3246 2 61 ASN HA 2 62 TYR QD 5.100 . 6.000 5.979 5.723 6.122 0.122 5 0 "[ . 1]" 1
3247 1 44 ASP HB2 1 62 TYR QD 3.800 . 5.600 4.176 3.855 4.374 . 0 0 "[ . 1]" 1
3248 2 44 ASP HB2 2 62 TYR QD 3.800 . 5.600 4.089 3.644 4.320 . 0 0 "[ . 1]" 1
3249 1 79 LEU MD2 2 7 PHE HZ 4.000 . 6.000 4.719 4.300 5.615 . 0 0 "[ . 1]" 1
3250 1 7 PHE HZ 2 79 LEU MD2 4.000 . 6.000 5.118 4.751 5.552 . 0 0 "[ . 1]" 1
3251 1 79 LEU HG 2 7 PHE HZ 3.500 . 5.000 4.949 4.824 5.090 0.090 6 0 "[ . 1]" 1
3252 1 7 PHE HZ 2 79 LEU HG 3.500 . 5.000 4.976 4.855 5.040 0.040 10 0 "[ . 1]" 1
3253 1 80 ASP HA 2 7 PHE HZ 3.500 . 5.000 3.933 3.412 4.589 . 0 0 "[ . 1]" 1
3254 1 7 PHE HZ 2 80 ASP HA 3.500 . 5.000 3.845 3.394 4.359 . 0 0 "[ . 1]" 1
3255 1 79 LEU MD1 2 7 PHE HZ 3.300 . 4.700 3.941 3.478 4.484 . 0 0 "[ . 1]" 1
3256 1 7 PHE HZ 2 79 LEU MD1 3.300 . 4.700 3.975 3.788 4.329 . 0 0 "[ . 1]" 1
3257 1 74 LEU MD2 2 7 PHE HZ 3.600 . 5.200 4.267 3.923 4.645 . 0 0 "[ . 1]" 1
3258 1 7 PHE HZ 2 74 LEU MD2 3.600 . 5.200 4.129 3.849 4.583 . 0 0 "[ . 1]" 1
3259 1 34 LEU MD1 1 120 TRP HH2 2.400 . 3.100 2.521 2.374 2.602 . 0 0 "[ . 1]" 1
3260 2 34 LEU MD1 2 120 TRP HH2 2.400 . 3.100 2.487 2.239 2.743 . 0 0 "[ . 1]" 1
3261 1 31 TYR HA 1 120 TRP HH2 2.600 . 3.500 2.925 2.634 3.125 . 0 0 "[ . 1]" 1
3262 2 31 TYR HA 2 120 TRP HH2 2.600 . 3.500 2.891 2.741 3.112 . 0 0 "[ . 1]" 1
3263 1 31 TYR QE 1 32 LYS HA 3.800 . 5.600 4.757 4.233 5.064 . 0 0 "[ . 1]" 1
3264 2 31 TYR QE 2 32 LYS HA 3.800 . 5.600 4.873 4.603 5.185 . 0 0 "[ . 1]" 1
3265 1 31 TYR QE 1 126 PRO HB3 4.400 . 6.000 4.645 4.424 4.838 . 0 0 "[ . 1]" 1
3266 2 31 TYR QE 2 126 PRO HB3 4.400 . 6.000 4.667 4.389 4.833 . 0 0 "[ . 1]" 1
3267 1 31 TYR QE 1 120 TRP HE1 5.100 . 6.000 5.570 4.809 5.946 . 0 0 "[ . 1]" 1
3268 2 31 TYR QE 2 120 TRP HE1 5.100 . 6.000 5.510 4.939 6.025 0.025 8 0 "[ . 1]" 1
3269 1 31 TYR HB2 1 31 TYR QE 3.500 . 5.000 4.447 4.424 4.468 . 0 0 "[ . 1]" 1
3270 2 31 TYR HB2 2 31 TYR QE 3.500 . 5.000 4.456 4.433 4.493 . 0 0 "[ . 1]" 1
3271 1 31 TYR QE 1 59 VAL MG2 4.300 . 6.000 4.413 3.993 4.635 . 0 0 "[ . 1]" 1
3272 2 31 TYR QE 2 59 VAL MG2 4.300 . 6.000 4.276 3.819 4.587 . 0 0 "[ . 1]" 1
3273 1 31 TYR HB3 1 31 TYR QE 3.500 . 5.000 4.394 4.385 4.403 . 0 0 "[ . 1]" 1
3274 2 31 TYR HB3 2 31 TYR QE 3.500 . 5.000 4.393 4.383 4.404 . 0 0 "[ . 1]" 1
3275 1 31 TYR QE 1 126 PRO HG3 3.300 . 4.700 2.857 2.703 2.953 . 0 0 "[ . 1]" 1
3276 2 31 TYR QE 2 126 PRO HG3 3.300 . 4.700 2.837 2.568 3.012 . 0 0 "[ . 1]" 1
3277 1 31 TYR QE 1 57 PRO HB2 4.500 . 6.000 6.062 6.032 6.101 0.101 8 0 "[ . 1]" 1
3278 2 31 TYR QE 2 57 PRO HB2 4.500 . 6.000 6.027 5.744 6.107 0.107 3 0 "[ . 1]" 1
3279 1 31 TYR QE 1 126 PRO HG2 3.400 . 4.800 3.107 2.543 3.584 . 0 0 "[ . 1]" 1
3280 2 31 TYR QE 2 126 PRO HG2 3.400 . 4.800 3.062 2.493 3.406 . 0 0 "[ . 1]" 1
3281 1 88 PHE HA 1 88 PHE QD 2.800 . 3.800 2.055 1.804 2.290 . 0 0 "[ . 1]" 1
3282 2 88 PHE HA 2 88 PHE QD 2.800 . 3.800 1.989 1.786 2.118 0.014 5 0 "[ . 1]" 1
3283 1 44 ASP HB2 1 88 PHE QD 2.800 . 3.800 3.100 2.452 3.656 . 0 0 "[ . 1]" 1
3284 2 44 ASP HB2 2 88 PHE QD 2.800 . 3.800 3.061 2.738 3.438 . 0 0 "[ . 1]" 1
3285 1 88 PHE QD 1 113 SER QB . . 2.500 1.931 1.597 2.478 0.403 3 0 "[ . 1]" 1
3286 2 88 PHE QD 2 113 SER QB . . 2.500 1.995 1.765 2.309 0.235 4 0 "[ . 1]" 1
3287 1 88 PHE HB3 1 88 PHE QD 2.200 . 2.800 2.295 2.260 2.356 . 0 0 "[ . 1]" 1
3288 2 88 PHE HB3 2 88 PHE QD 2.200 . 2.800 2.313 2.276 2.390 . 0 0 "[ . 1]" 1
3289 1 88 PHE HB2 1 88 PHE QD 2.600 . 3.400 2.719 2.656 2.756 . 0 0 "[ . 1]" 1
3290 2 88 PHE HB2 2 88 PHE QD 2.600 . 3.400 2.734 2.706 2.767 . 0 0 "[ . 1]" 1
3291 1 88 PHE QD 1 117 MET HA 3.600 . 5.200 3.767 3.389 4.295 . 0 0 "[ . 1]" 1
3292 2 88 PHE QD 2 117 MET HA 3.600 . 5.200 3.838 3.302 4.394 . 0 0 "[ . 1]" 1
3293 1 88 PHE H 1 88 PHE QD 4.500 . 6.000 4.253 4.175 4.332 . 0 0 "[ . 1]" 1
3294 2 88 PHE H 2 88 PHE QD 4.500 . 6.000 4.236 4.052 4.329 . 0 0 "[ . 1]" 1
3295 1 57 PRO QD 1 88 PHE QD 2.700 . 3.600 3.145 2.784 3.613 0.013 5 0 "[ . 1]" 1
3296 2 57 PRO QD 2 88 PHE QD 2.700 . 3.600 3.117 2.709 3.670 0.070 5 0 "[ . 1]" 1
3297 1 44 ASP HA 1 88 PHE QD 3.200 . 4.500 4.337 3.961 4.532 0.032 6 0 "[ . 1]" 1
3298 2 44 ASP HA 2 88 PHE QD 3.200 . 4.500 4.346 4.027 4.560 0.060 3 0 "[ . 1]" 1
3299 1 88 PHE QD 1 120 TRP QB 3.800 . 5.600 4.058 3.931 4.241 . 0 0 "[ . 1]" 1
3300 2 88 PHE QD 2 120 TRP QB 3.800 . 5.600 4.109 3.962 4.305 . 0 0 "[ . 1]" 1
3301 1 27 PRO HD2 1 88 PHE QD 4.400 . 6.000 6.143 6.094 6.190 0.190 7 0 "[ . 1]" 1
3302 2 27 PRO HD2 2 88 PHE QD 4.400 . 6.000 6.137 6.095 6.209 0.209 2 0 "[ . 1]" 1
3303 1 27 PRO HG3 1 88 PHE QD 4.100 . 6.000 5.016 4.845 5.188 . 0 0 "[ . 1]" 1
3304 2 27 PRO HG3 2 88 PHE QD 4.100 . 6.000 5.085 4.873 5.302 . 0 0 "[ . 1]" 1
3305 1 42 LEU HB2 1 88 PHE QD 4.400 . 6.000 6.130 6.081 6.229 0.229 7 0 "[ . 1]" 1
3306 2 42 LEU HB2 2 88 PHE QD 4.400 . 6.000 6.146 6.114 6.182 0.182 7 0 "[ . 1]" 1
3307 1 27 PRO HB3 1 88 PHE QD 3.900 . 5.800 3.996 3.671 4.946 . 0 0 "[ . 1]" 1
3308 2 27 PRO HB3 2 88 PHE QD 3.900 . 5.800 4.076 3.819 4.629 . 0 0 "[ . 1]" 1
3309 1 88 PHE QD 1 112 ASN HA 5.400 . 6.000 5.909 5.383 6.049 0.049 8 0 "[ . 1]" 1
3310 2 88 PHE QD 2 112 ASN HA 5.400 . 6.000 6.027 5.996 6.062 0.062 1 0 "[ . 1]" 1
3311 1 88 PHE QD 1 116 GLY HA2 3.900 . 5.800 4.542 3.626 5.651 . 0 0 "[ . 1]" 1
3312 2 88 PHE QD 2 116 GLY HA2 3.900 . 5.800 4.659 4.150 4.930 . 0 0 "[ . 1]" 1
3313 1 7 PHE HB3 2 105 TYR QE 4.300 . 6.000 4.845 4.013 5.368 . 0 0 "[ . 1]" 1
3314 1 105 TYR QE 2 7 PHE HB3 4.300 . 6.000 4.764 3.885 5.301 . 0 0 "[ . 1]" 1
3315 1 11 PHE HB2 2 105 TYR QE 2.500 . 3.300 2.760 2.523 3.034 . 0 0 "[ . 1]" 1
3316 1 105 TYR QE 2 11 PHE HB2 2.500 . 3.300 2.859 2.464 3.180 . 0 0 "[ . 1]" 1
3317 1 102 LEU MD2 1 105 TYR QE 3.400 . 4.900 3.452 2.726 4.024 . 0 0 "[ . 1]" 1
3318 2 102 LEU MD2 2 105 TYR QE 3.400 . 4.900 3.627 2.728 4.428 . 0 0 "[ . 1]" 1
3319 1 11 PHE HB3 2 105 TYR QE 3.600 . 5.200 4.114 3.838 4.496 . 0 0 "[ . 1]" 1
3320 1 105 TYR QE 2 11 PHE HB3 3.600 . 5.200 4.211 3.707 4.516 . 0 0 "[ . 1]" 1
3321 1 10 THR HA 2 105 TYR QE 4.200 . 6.000 4.683 4.570 4.826 . 0 0 "[ . 1]" 1
3322 1 105 TYR QE 2 10 THR HA 4.200 . 6.000 4.745 4.609 4.898 . 0 0 "[ . 1]" 1
3323 1 10 THR HB 2 105 TYR QE 2.500 . 3.300 2.836 2.346 3.190 . 0 0 "[ . 1]" 1
3324 1 105 TYR QE 2 10 THR HB 2.500 . 3.300 2.929 2.444 3.271 . 0 0 "[ . 1]" 1
3325 1 7 PHE HA 2 105 TYR QE 3.800 . 5.600 4.712 3.961 5.037 . 0 0 "[ . 1]" 1
3326 1 105 TYR QE 2 7 PHE HA 3.800 . 5.600 4.734 3.876 5.216 . 0 0 "[ . 1]" 1
3327 1 74 LEU MD2 1 105 TYR QE 3.900 . 5.800 3.865 3.260 4.472 . 0 0 "[ . 1]" 1
3328 2 74 LEU MD2 2 105 TYR QE 3.900 . 5.800 3.880 3.271 4.440 . 0 0 "[ . 1]" 1
3329 1 86 VAL HB 1 111 TYR QD 2.700 . 3.600 2.185 1.925 2.440 . 0 0 "[ . 1]" 1
3330 2 86 VAL HB 2 111 TYR QD 2.700 . 3.600 2.060 1.798 2.289 0.002 10 0 "[ . 1]" 1
3331 1 85 VAL HB 1 111 TYR QD 3.600 . 5.200 5.228 5.146 5.248 0.048 5 0 "[ . 1]" 1
3332 2 85 VAL HB 2 111 TYR QD 3.600 . 5.200 5.212 5.012 5.267 0.067 6 0 "[ . 1]" 1
3333 1 29 ASP HB3 1 111 TYR QD 4.000 . 6.000 6.080 6.033 6.126 0.126 7 0 "[ . 1]" 1
3334 2 29 ASP HB3 2 111 TYR QD 4.000 . 6.000 6.067 6.022 6.103 0.103 7 0 "[ . 1]" 1
3335 1 109 THR HB 1 111 TYR QD 4.300 . 6.000 4.620 4.320 5.227 . 0 0 "[ . 1]" 1
3336 2 109 THR HB 2 111 TYR QD 4.200 . 6.000 4.609 4.288 5.084 . 0 0 "[ . 1]" 1
3337 1 11 PHE HA 2 105 TYR QE 3.000 . 4.100 2.625 2.008 3.400 . 0 0 "[ . 1]" 1
3338 1 105 TYR QE 2 11 PHE HA 3.000 . 4.100 2.786 1.850 3.268 0.050 5 0 "[ . 1]" 1
3339 1 25 LEU HG 1 111 TYR QD 2.400 . 3.100 2.572 2.151 3.010 . 0 0 "[ . 1]" 1
3340 2 25 LEU HG 2 111 TYR QD 2.400 . 3.100 2.552 2.230 2.786 . 0 0 "[ . 1]" 1
3341 1 14 GLN HB2 2 105 TYR QE 3.700 . 5.400 4.279 3.496 4.924 . 0 0 "[ . 1]" 1
3342 1 105 TYR QE 2 14 GLN HB2 3.700 . 5.400 4.386 3.903 4.866 . 0 0 "[ . 1]" 1
3343 1 105 TYR HB2 1 105 TYR QE 4.100 . 6.000 4.412 4.401 4.438 . 0 0 "[ . 1]" 1
3344 2 105 TYR HB2 2 105 TYR QE 4.100 . 6.000 4.415 4.395 4.446 . 0 0 "[ . 1]" 1
3345 1 101 THR HA 1 105 TYR QE 4.400 . 6.000 4.517 4.125 4.827 . 0 0 "[ . 1]" 1
3346 2 101 THR HA 2 105 TYR QE 4.300 . 6.000 4.672 4.015 4.856 . 0 0 "[ . 1]" 1
3347 1 86 VAL HA 1 111 TYR QD 3.600 . 5.200 2.740 2.519 2.907 . 0 0 "[ . 1]" 1
3348 2 86 VAL HA 2 111 TYR QD 3.600 . 5.200 2.670 2.508 2.806 . 0 0 "[ . 1]" 1
3349 1 30 ALA HA 1 111 TYR QD 5.200 . 6.000 5.074 4.926 5.306 . 0 0 "[ . 1]" 1
3350 2 30 ALA HA 2 111 TYR QD 5.200 . 6.000 5.013 4.845 5.131 . 0 0 "[ . 1]" 1
3351 1 111 TYR HB3 1 111 TYR QD 2.500 . 3.300 2.339 2.305 2.368 . 0 0 "[ . 1]" 1
3352 2 111 TYR HB3 2 111 TYR QD 2.500 . 3.300 2.350 2.329 2.405 . 0 0 "[ . 1]" 1
3353 1 25 LEU HA 1 111 TYR QD 4.300 . 6.000 5.268 5.010 5.602 . 0 0 "[ . 1]" 1
3354 2 25 LEU HA 2 111 TYR QD 4.300 . 6.000 5.315 4.916 5.709 . 0 0 "[ . 1]" 1
3355 1 109 THR MG 1 111 TYR QD 2.900 . 4.000 3.994 3.833 4.060 0.060 5 0 "[ . 1]" 1
3356 2 109 THR MG 2 111 TYR QD 2.900 . 4.000 3.943 3.738 4.090 0.090 7 0 "[ . 1]" 1
3357 1 25 LEU HB3 1 111 TYR QD 3.800 . 5.700 4.362 4.078 4.728 . 0 0 "[ . 1]" 1
3358 2 25 LEU HB3 2 111 TYR QD 3.800 . 5.700 4.459 3.889 4.889 . 0 0 "[ . 1]" 1
3359 1 111 TYR HB2 1 111 TYR QD 2.600 . 3.500 2.477 2.437 2.534 . 0 0 "[ . 1]" 1
3360 2 111 TYR HB2 2 111 TYR QD 2.600 . 3.500 2.461 2.391 2.486 . 0 0 "[ . 1]" 1
3361 1 33 LEU MD2 1 111 TYR QD 3.700 . 5.400 3.891 3.534 4.285 . 0 0 "[ . 1]" 1
3362 2 33 LEU MD2 2 111 TYR QD 3.700 . 5.400 3.853 3.605 4.144 . 0 0 "[ . 1]" 1
3363 1 111 TYR QD 1 112 ASN H 4.300 . 6.000 4.452 4.367 4.549 . 0 0 "[ . 1]" 1
3364 2 111 TYR QD 2 112 ASN H 4.300 . 6.000 4.483 4.423 4.532 . 0 0 "[ . 1]" 1
3365 1 86 VAL H 1 111 TYR QD 4.300 . 6.000 3.837 3.662 3.965 . 0 0 "[ . 1]" 1
3366 2 86 VAL H 2 111 TYR QD 4.300 . 6.000 3.737 3.613 3.852 . 0 0 "[ . 1]" 1
3367 1 25 LEU HB2 1 111 TYR QD 3.100 . 4.300 3.234 2.876 3.617 . 0 0 "[ . 1]" 1
3368 2 25 LEU HB2 2 111 TYR QD 3.100 . 4.300 3.353 2.760 3.863 . 0 0 "[ . 1]" 1
3369 1 40 ILE MG 1 111 TYR QD 3.100 . 4.300 3.610 3.069 3.944 . 0 0 "[ . 1]" 1
3370 2 40 ILE MG 2 111 TYR QD 3.100 . 4.300 3.633 3.420 3.868 . 0 0 "[ . 1]" 1
3371 1 23 VAL HB 1 111 TYR QD 2.500 . 3.300 2.863 2.568 3.236 . 0 0 "[ . 1]" 1
3372 2 23 VAL HB 2 111 TYR QD 2.500 . 3.300 2.693 2.215 3.038 . 0 0 "[ . 1]" 1
3373 1 25 LEU MD1 1 111 TYR QD 2.800 . 3.800 2.446 1.972 2.670 . 0 0 "[ . 1]" 1
3374 2 25 LEU MD1 2 111 TYR QD 2.800 . 3.800 2.454 2.295 2.614 . 0 0 "[ . 1]" 1
3375 1 25 LEU MD2 1 111 TYR QD 3.700 . 5.400 4.094 3.805 4.441 . 0 0 "[ . 1]" 1
3376 2 25 LEU MD2 2 111 TYR QD 3.700 . 5.400 4.060 3.872 4.219 . 0 0 "[ . 1]" 1
3377 1 86 VAL MG2 1 111 TYR QD 3.600 . 5.200 3.590 3.418 3.806 . 0 0 "[ . 1]" 1
3378 2 86 VAL MG2 2 111 TYR QD 3.600 . 5.200 3.525 3.349 3.733 . 0 0 "[ . 1]" 1
3379 1 110 ILE HA 1 111 TYR QD 3.800 . 5.600 3.340 3.119 3.471 . 0 0 "[ . 1]" 1
3380 2 110 ILE HA 2 111 TYR QD 3.800 . 5.600 3.402 3.192 3.636 . 0 0 "[ . 1]" 1
3381 1 64 HIS HD2 1 65 MET HB2 4.800 . 6.000 5.257 4.509 5.998 . 0 0 "[ . 1]" 1
3382 2 64 HIS HD2 2 65 MET HB2 4.800 . 6.000 5.366 4.545 6.003 0.003 3 0 "[ . 1]" 1
3383 1 64 HIS HB3 1 64 HIS HD2 3.200 . 4.500 3.927 3.854 3.969 . 0 0 "[ . 1]" 1
3384 2 64 HIS HB3 2 64 HIS HD2 3.200 . 4.500 3.943 3.917 3.973 . 0 0 "[ . 1]" 1
3385 1 44 ASP H 1 64 HIS HD2 4.300 . 6.000 3.910 3.180 4.291 . 0 0 "[ . 1]" 1
3386 2 44 ASP H 2 64 HIS HD2 4.300 . 6.000 4.033 3.759 4.273 . 0 0 "[ . 1]" 1
3387 1 45 VAL HA 1 64 HIS HD2 3.900 . 5.800 3.395 2.909 4.000 . 0 0 "[ . 1]" 1
3388 2 45 VAL HA 2 64 HIS HD2 3.900 . 5.800 3.323 2.692 3.758 . 0 0 "[ . 1]" 1
3389 1 64 HIS HA 1 64 HIS HD2 2.900 . 3.900 2.436 2.097 2.733 . 0 0 "[ . 1]" 1
3390 2 64 HIS HA 2 64 HIS HD2 2.900 . 3.900 2.502 2.330 2.816 . 0 0 "[ . 1]" 1
3391 1 51 LEU MD2 1 64 HIS HD2 2.900 . 3.900 3.725 3.436 3.949 0.049 3 0 "[ . 1]" 1
3392 2 51 LEU MD2 2 64 HIS HD2 2.900 . 3.900 3.652 3.195 3.916 0.016 5 0 "[ . 1]" 1
3393 1 44 ASP HB3 1 64 HIS HD2 2.600 . 3.500 3.176 2.177 3.570 0.070 5 0 "[ . 1]" 1
3394 2 44 ASP HB3 2 64 HIS HD2 2.600 . 3.500 3.412 2.959 3.628 0.128 2 0 "[ . 1]" 1
3395 1 102 LEU HA 2 11 PHE HZ 4.700 . 6.000 5.985 5.814 6.149 0.149 1 0 "[ . 1]" 1
3396 1 11 PHE HZ 2 102 LEU HA 4.600 . 6.000 5.897 5.617 6.106 0.106 2 0 "[ . 1]" 1
3397 1 101 THR MG 2 11 PHE HZ 3.500 . 5.000 3.387 3.114 3.628 . 0 0 "[ . 1]" 1
3398 1 11 PHE HZ 2 101 THR MG 3.500 . 5.000 3.775 3.507 4.120 . 0 0 "[ . 1]" 1
3399 1 70 LEU HB2 2 11 PHE HZ 5.200 . 6.000 5.871 5.586 6.049 0.049 1 0 "[ . 1]" 1
3400 1 11 PHE HZ 2 70 LEU HB2 5.100 . 6.000 5.868 5.536 6.038 0.038 7 0 "[ . 1]" 1
3401 1 98 ALA MB 2 11 PHE HZ 5.600 . 6.000 3.585 3.017 3.896 . 0 0 "[ . 1]" 1
3402 1 11 PHE HZ 2 98 ALA MB 5.600 . 6.000 3.682 3.206 4.346 . 0 0 "[ . 1]" 1
3403 1 70 LEU HG 2 11 PHE HZ 2.900 . 3.900 3.903 3.744 4.012 0.112 4 0 "[ . 1]" 1
3404 1 11 PHE HZ 2 70 LEU HG 2.900 . 3.900 3.701 3.346 3.967 0.067 1 0 "[ . 1]" 1
3405 1 101 THR HA 2 11 PHE HZ 4.100 . 6.000 5.832 5.685 6.003 0.003 6 0 "[ . 1]" 1
3406 1 11 PHE HZ 2 101 THR HA 4.100 . 6.000 5.840 5.513 6.020 0.020 8 0 "[ . 1]" 1
3407 1 31 TYR H 1 120 TRP HZ2 3.800 . 5.600 3.720 3.492 3.957 . 0 0 "[ . 1]" 1
3408 2 31 TYR H 2 120 TRP HZ2 3.800 . 5.600 3.689 3.586 3.801 . 0 0 "[ . 1]" 1
3409 1 34 LEU MD1 1 120 TRP HZ2 3.300 . 4.600 3.376 3.184 3.512 . 0 0 "[ . 1]" 1
3410 2 34 LEU MD1 2 120 TRP HZ2 3.300 . 4.600 3.351 3.161 3.516 . 0 0 "[ . 1]" 1
3411 1 31 TYR HB2 1 120 TRP HZ2 3.200 . 4.400 2.960 2.839 3.103 . 0 0 "[ . 1]" 1
3412 2 31 TYR HB2 2 120 TRP HZ2 3.200 . 4.400 2.952 2.825 3.136 . 0 0 "[ . 1]" 1
3413 1 27 PRO HA 1 120 TRP HZ3 3.300 . 4.700 2.676 2.192 2.932 . 0 0 "[ . 1]" 1
3414 2 27 PRO HA 2 120 TRP HZ3 3.300 . 4.700 2.632 2.512 2.821 . 0 0 "[ . 1]" 1
3415 1 102 LEU MD2 1 107 PHE QE 2.500 . 3.300 2.481 2.203 2.644 . 0 0 "[ . 1]" 1
3416 2 102 LEU MD2 2 107 PHE QE 2.500 . 3.300 2.383 2.177 2.674 . 0 0 "[ . 1]" 1
3417 1 79 LEU MD2 1 107 PHE QE 2.700 . 3.600 2.614 2.091 3.283 . 0 0 "[ . 1]" 1
3418 2 79 LEU MD2 2 107 PHE QE 2.700 . 3.600 3.242 2.781 3.621 0.021 10 0 "[ . 1]" 1
3419 1 85 VAL MG2 1 107 PHE QE 2.700 . 3.600 2.508 2.368 2.686 . 0 0 "[ . 1]" 1
3420 2 85 VAL MG2 2 107 PHE QE 2.700 . 3.600 2.644 2.438 2.901 . 0 0 "[ . 1]" 1
3421 1 43 ILE MD 1 107 PHE QE 4.300 . 6.000 4.421 4.053 4.816 . 0 0 "[ . 1]" 1
3422 2 43 ILE MD 2 107 PHE QE 4.300 . 6.000 4.367 3.992 4.754 . 0 0 "[ . 1]" 1
3423 1 85 VAL MG1 1 107 PHE QE 2.700 . 3.600 2.828 2.395 3.543 . 0 0 "[ . 1]" 1
3424 2 85 VAL MG1 2 107 PHE QE 2.700 . 3.600 2.504 2.022 2.947 . 0 0 "[ . 1]" 1
3425 1 105 TYR HB2 1 107 PHE QE 3.500 . 5.000 4.020 3.550 4.429 . 0 0 "[ . 1]" 1
3426 2 105 TYR HB2 2 107 PHE QE 3.500 . 5.000 3.976 3.264 4.415 . 0 0 "[ . 1]" 1
3427 1 79 LEU MD1 1 107 PHE QE 3.400 . 4.800 3.618 2.412 4.585 . 0 0 "[ . 1]" 1
3428 2 79 LEU MD1 2 107 PHE QE 3.400 . 4.800 3.939 3.574 4.212 . 0 0 "[ . 1]" 1
3429 1 31 TYR QD 1 34 LEU HB2 3.300 . 4.700 3.422 3.011 3.929 . 0 0 "[ . 1]" 1
3430 2 31 TYR QD 2 34 LEU HB2 3.300 . 4.700 3.382 2.914 3.807 . 0 0 "[ . 1]" 1
3431 1 31 TYR QD 1 42 LEU HB2 4.900 . 6.000 5.846 5.605 6.085 0.085 2 0 "[ . 1]" 1
3432 2 31 TYR QD 2 42 LEU HB2 4.900 . 6.000 5.869 5.556 6.068 0.068 2 0 "[ . 1]" 1
3433 1 31 TYR QD 1 126 PRO HD3 5.100 . 6.000 4.742 4.204 5.228 . 0 0 "[ . 1]" 1
3434 2 31 TYR QD 2 126 PRO HD3 5.100 . 6.000 4.691 4.386 5.199 . 0 0 "[ . 1]" 1
3435 1 31 TYR QD 1 34 LEU MD1 2.900 . 4.000 2.871 2.565 3.146 . 0 0 "[ . 1]" 1
3436 2 31 TYR QD 2 34 LEU MD1 2.900 . 4.000 2.870 2.480 3.360 . 0 0 "[ . 1]" 1
3437 1 31 TYR HA 1 31 TYR QD 2.400 . 3.100 2.618 2.418 2.771 . 0 0 "[ . 1]" 1
3438 2 31 TYR HA 2 31 TYR QD 2.400 . 3.100 2.583 2.269 2.778 . 0 0 "[ . 1]" 1
3439 1 28 LYS HA 1 31 TYR QD 3.500 . 5.000 4.036 3.612 4.298 . 0 0 "[ . 1]" 1
3440 2 28 LYS HA 2 31 TYR QD 3.500 . 5.000 4.102 3.667 4.335 . 0 0 "[ . 1]" 1
3441 1 31 TYR QD 1 34 LEU HG 4.100 . 6.000 5.214 4.680 5.766 . 0 0 "[ . 1]" 1
3442 2 31 TYR QD 2 34 LEU HG 4.100 . 6.000 5.202 4.491 5.674 . 0 0 "[ . 1]" 1
3443 1 11 PHE HB3 1 11 PHE QD 2.700 . 3.600 2.651 2.528 2.715 . 0 0 "[ . 1]" 1
3444 2 11 PHE HB3 2 11 PHE QD 2.700 . 3.600 2.656 2.545 2.752 . 0 0 "[ . 1]" 1
3445 1 11 PHE QD 1 15 VAL HB 2.500 . 3.300 3.051 2.329 3.328 0.028 2 0 "[ . 1]" 1
3446 2 11 PHE QD 2 15 VAL HB 2.500 . 3.300 2.758 2.318 3.304 0.004 4 0 "[ . 1]" 1
3447 1 74 LEU HG 2 11 PHE QD 4.900 . 6.000 4.809 4.543 5.150 . 0 0 "[ . 1]" 1
3448 1 11 PHE QD 2 74 LEU HG 4.900 . 6.000 4.835 4.582 5.228 . 0 0 "[ . 1]" 1
3449 1 105 TYR QE 2 11 PHE QD 2.800 . 3.800 2.468 2.001 3.237 . 0 0 "[ . 1]" 1
3450 1 11 PHE QD 2 105 TYR QE 2.800 . 3.800 2.526 1.935 3.018 . 0 0 "[ . 1]" 1
3451 1 11 PHE QD 1 12 LYS QD 3.600 . 5.200 5.015 4.581 5.274 0.074 5 0 "[ . 1]" 1
3452 2 11 PHE QD 2 12 LYS QD 3.600 . 5.200 4.875 4.180 5.242 0.042 3 0 "[ . 1]" 1
3453 1 11 PHE QD 1 15 VAL HA 4.000 . 6.000 5.016 4.760 5.420 . 0 0 "[ . 1]" 1
3454 2 11 PHE QD 2 15 VAL HA 4.000 . 6.000 4.941 4.620 5.223 . 0 0 "[ . 1]" 1
3455 1 79 LEU MD1 2 11 PHE QD 5.400 . 6.000 5.988 5.805 6.074 0.074 5 0 "[ . 1]" 1
3456 1 11 PHE QD 2 79 LEU MD1 5.300 . 6.000 6.035 5.936 6.075 0.075 8 0 "[ . 1]" 1
3457 1 11 PHE HB2 1 11 PHE QD 2.300 . 2.900 2.270 2.256 2.284 . 0 0 "[ . 1]" 1
3458 2 11 PHE HB2 2 11 PHE QD 2.300 . 2.900 2.272 2.255 2.299 . 0 0 "[ . 1]" 1
3459 1 70 LEU HG 2 11 PHE QD 3.200 . 4.500 4.438 4.117 4.585 0.085 7 0 "[ . 1]" 1
3460 1 11 PHE QD 2 70 LEU HG 3.200 . 4.500 4.408 4.017 4.536 0.036 6 0 "[ . 1]" 1
3461 1 105 TYR HB3 1 105 TYR QD 2.600 . 3.500 2.763 2.732 2.776 . 0 0 "[ . 1]" 1
3462 2 105 TYR HB3 2 105 TYR QD 2.600 . 3.500 2.759 2.734 2.773 . 0 0 "[ . 1]" 1
3463 1 105 TYR HA 1 105 TYR QD 2.500 . 3.300 1.944 1.747 2.084 . 0 0 "[ . 1]" 1
3464 2 105 TYR HA 2 105 TYR QD 2.500 . 3.300 1.903 1.791 2.057 . 0 0 "[ . 1]" 1
3465 1 105 TYR HB2 1 105 TYR QD 2.400 . 3.100 2.380 2.342 2.493 . 0 0 "[ . 1]" 1
3466 2 105 TYR HB2 2 105 TYR QD 2.400 . 3.100 2.389 2.325 2.498 . 0 0 "[ . 1]" 1
3467 1 7 PHE QD 1 8 ASP QB 4.100 . 6.000 3.360 2.986 3.549 . 0 0 "[ . 1]" 1
3468 2 7 PHE QD 2 8 ASP QB 4.100 . 6.000 3.351 2.997 3.646 . 0 0 "[ . 1]" 1
3469 1 7 PHE HB3 1 7 PHE QD 2.400 . 3.100 2.262 2.243 2.288 . 0 0 "[ . 1]" 1
3470 2 7 PHE HB3 2 7 PHE QD 2.400 . 3.100 2.267 2.249 2.302 . 0 0 "[ . 1]" 1
3471 1 7 PHE HA 1 7 PHE QD 2.900 . 4.000 3.713 3.687 3.735 . 0 0 "[ . 1]" 1
3472 2 7 PHE HA 2 7 PHE QD 2.900 . 4.000 3.713 3.673 3.739 . 0 0 "[ . 1]" 1
3473 1 3 MET ME 1 7 PHE QD 4.200 . 6.000 5.582 4.269 6.074 0.074 1 0 "[ . 1]" 1
3474 2 3 MET ME 2 7 PHE QD 4.200 . 6.000 5.198 3.530 6.023 0.023 9 0 "[ . 1]" 1
3475 1 7 PHE HB2 1 7 PHE QD 2.500 . 3.300 2.597 2.526 2.698 . 0 0 "[ . 1]" 1
3476 2 7 PHE HB2 2 7 PHE QD 2.500 . 3.300 2.599 2.487 2.715 . 0 0 "[ . 1]" 1
3477 1 4 GLY HA2 1 7 PHE QD 2.900 . 3.900 3.659 3.517 3.758 . 0 0 "[ . 1]" 1
3478 2 4 GLY HA2 2 7 PHE QD 2.900 . 3.900 3.578 3.304 3.716 . 0 0 "[ . 1]" 1
3479 1 18 ALA MB 1 96 ALA H 3.900 . 5.800 4.851 4.557 5.336 . 0 0 "[ . 1]" 1
3480 2 18 ALA MB 2 96 ALA H 3.900 . 5.800 4.903 4.528 5.262 . 0 0 "[ . 1]" 1
3481 1 107 PHE HB3 1 107 PHE QD 2.600 . 3.400 2.275 2.266 2.286 . 0 0 "[ . 1]" 1
3482 2 107 PHE HB3 2 107 PHE QD 2.600 . 3.400 2.285 2.272 2.331 . 0 0 "[ . 1]" 1
3483 1 107 PHE HB2 1 107 PHE QD 2.700 . 3.600 2.577 2.535 2.617 . 0 0 "[ . 1]" 1
3484 2 107 PHE HB2 2 107 PHE QD 2.700 . 3.600 2.553 2.465 2.599 . 0 0 "[ . 1]" 1
3485 1 85 VAL H 1 107 PHE QD 3.300 . 4.700 3.843 3.473 4.124 . 0 0 "[ . 1]" 1
3486 2 85 VAL H 2 107 PHE QD 3.300 . 4.700 3.840 3.308 4.251 . 0 0 "[ . 1]" 1
3487 1 105 TYR HB2 1 107 PHE QD 3.000 . 4.100 3.181 2.771 3.572 . 0 0 "[ . 1]" 1
3488 2 105 TYR HB2 2 107 PHE QD 3.000 . 4.100 3.112 2.403 3.576 . 0 0 "[ . 1]" 1
3489 1 85 VAL MG1 1 107 PHE QD 3.400 . 4.800 3.685 3.146 4.490 . 0 0 "[ . 1]" 1
3490 2 85 VAL MG1 2 107 PHE QD 3.400 . 4.800 3.307 2.805 3.666 . 0 0 "[ . 1]" 1
3491 1 74 LEU MD2 2 7 PHE QE 2.700 . 3.600 2.713 2.240 3.309 . 0 0 "[ . 1]" 1
3492 1 7 PHE QE 2 74 LEU MD2 2.700 . 3.600 2.740 2.387 3.575 . 0 0 "[ . 1]" 1
3493 1 27 PRO HB2 1 120 TRP HE3 3.300 . 4.600 2.737 2.423 3.487 . 0 0 "[ . 1]" 1
3494 2 27 PRO HB2 2 120 TRP HE3 3.300 . 4.600 2.809 2.569 3.330 . 0 0 "[ . 1]" 1
3495 1 27 PRO HB3 1 120 TRP HE3 2.400 . 3.100 1.931 1.775 2.204 . 0 0 "[ . 1]" 1
3496 2 27 PRO HB3 2 120 TRP HE3 2.400 . 3.100 1.903 1.664 2.031 0.036 7 0 "[ . 1]" 1
3497 1 117 MET HA 1 120 TRP HE3 4.900 . 6.000 4.960 4.734 5.198 . 0 0 "[ . 1]" 1
3498 2 117 MET HA 2 120 TRP HE3 4.900 . 6.000 4.918 4.714 5.161 . 0 0 "[ . 1]" 1
3499 1 119 LYS HB3 1 120 TRP HE3 3.600 . 5.200 5.043 4.747 5.314 0.114 4 0 "[ . 1]" 1
3500 2 119 LYS HB3 2 120 TRP HE3 3.600 . 5.200 5.019 4.754 5.253 0.053 9 0 "[ . 1]" 1
3501 1 27 PRO HG2 1 120 TRP HE3 5.000 . 6.000 4.477 4.278 4.759 . 0 0 "[ . 1]" 1
3502 2 27 PRO HG2 2 120 TRP HE3 5.000 . 6.000 4.551 4.373 4.807 . 0 0 "[ . 1]" 1
3503 1 27 PRO HD3 1 120 TRP HE3 3.500 . 5.000 4.771 4.377 5.012 0.012 5 0 "[ . 1]" 1
3504 2 27 PRO HD3 2 120 TRP HE3 3.500 . 5.000 4.714 4.542 4.872 . 0 0 "[ . 1]" 1
3505 1 120 TRP QB 1 120 TRP HE3 2.700 . 3.600 2.645 2.573 2.740 . 0 0 "[ . 1]" 1
3506 2 120 TRP QB 2 120 TRP HE3 2.700 . 3.600 2.647 2.587 2.690 . 0 0 "[ . 1]" 1
3507 1 27 PRO HA 1 120 TRP HE3 4.500 . 6.000 3.528 2.984 3.892 . 0 0 "[ . 1]" 1
3508 2 27 PRO HA 2 120 TRP HE3 4.500 . 6.000 3.500 3.188 3.816 . 0 0 "[ . 1]" 1
3509 1 27 PRO HG3 1 120 TRP HE3 4.100 . 6.000 3.718 3.285 3.938 . 0 0 "[ . 1]" 1
3510 2 27 PRO HG3 2 120 TRP HE3 4.100 . 6.000 3.760 3.566 3.972 . 0 0 "[ . 1]" 1
3511 1 88 PHE QD 1 120 TRP HE3 2.900 . 3.900 3.939 3.736 4.067 0.167 10 0 "[ . 1]" 1
3512 2 88 PHE QD 2 120 TRP HE3 2.900 . 3.900 3.952 3.899 4.013 0.113 5 0 "[ . 1]" 1
3513 1 120 TRP HA 1 120 TRP HE3 2.800 . 3.800 3.155 3.023 3.288 . 0 0 "[ . 1]" 1
3514 2 120 TRP HA 2 120 TRP HE3 2.800 . 3.800 3.149 3.029 3.279 . 0 0 "[ . 1]" 1
3515 1 65 MET H 1 73 LEU HB3 3.900 . 5.800 5.820 5.659 5.934 0.134 9 0 "[ . 1]" 1
3516 2 65 MET H 2 73 LEU HB3 3.900 . 5.800 5.787 5.515 5.905 0.105 10 0 "[ . 1]" 1
3517 1 43 ILE MG 1 65 MET H 3.900 . 5.800 3.106 2.810 3.804 . 0 0 "[ . 1]" 1
3518 2 43 ILE MG 2 65 MET H 3.900 . 5.800 3.036 2.648 3.456 . 0 0 "[ . 1]" 1
3519 1 45 VAL MG1 1 65 MET H 3.800 . 5.600 3.757 3.492 4.267 . 0 0 "[ . 1]" 1
3520 2 45 VAL MG1 2 65 MET H 3.800 . 5.600 3.660 2.437 4.414 . 0 0 "[ . 1]" 1
3521 1 56 LYS HA 1 128 LEU H 3.800 . 5.600 4.527 4.398 4.687 . 0 0 "[ . 1]" 1
3522 2 56 LYS HA 2 128 LEU H 3.800 . 5.600 4.522 4.355 4.692 . 0 0 "[ . 1]" 1
3523 2 105 TYR H 2 105 TYR QE 3.900 . 5.800 5.031 4.839 5.175 . 0 0 "[ . 1]" 1
3524 2 11 PHE QD 2 12 LYS HB3 4.600 . 6.000 6.153 6.009 6.550 0.550 7 2 "[- . + 1]" 1
3525 1 81 PRO HB3 1 106 GLY H 4.500 . 6.000 4.952 4.415 5.343 . 0 0 "[ . 1]" 1
3526 1 105 TYR HA 1 106 GLY H 2.600 . 3.400 2.429 2.332 2.534 . 0 0 "[ . 1]" 1
3527 1 103 ARG HB3 1 106 GLY H 4.900 . 6.000 4.838 4.693 4.933 . 0 0 "[ . 1]" 1
3528 1 66 SER HA 1 68 GLY H 3.500 . 5.000 3.338 3.149 3.506 . 0 0 "[ . 1]" 1
3529 1 51 LEU HB3 1 55 GLY H 4.000 . 6.000 4.162 4.092 4.249 . 0 0 "[ . 1]" 1
3530 1 22 MET HB2 1 99 GLY H 4.800 . 6.000 5.701 5.414 5.833 . 0 0 "[ . 1]" 1
3531 1 87 VAL MG2 1 99 GLY H 2.900 . 3.900 2.930 2.623 3.102 . 0 0 "[ . 1]" 1
3532 1 27 PRO HB2 1 114 GLU H 3.600 . 5.200 4.945 4.710 5.219 0.019 9 0 "[ . 1]" 1
3533 1 24 MET QB 1 114 GLU H 4.300 . 6.000 3.772 2.188 4.305 . 0 0 "[ . 1]" 1
3534 1 24 MET ME 1 114 GLU H 2.600 . 3.500 2.351 2.100 2.815 . 0 0 "[ . 1]" 1
3535 1 122 GLU QB 1 124 GLY H 3.700 . 5.400 3.974 3.888 4.071 . 0 0 "[ . 1]" 1
3536 1 40 ILE HA 1 85 VAL H 4.400 . 6.000 4.501 4.254 4.640 . 0 0 "[ . 1]" 1
3537 1 40 ILE HB 1 61 ASN HD21 4.200 . 6.000 4.218 3.421 4.712 . 0 0 "[ . 1]" 1
3538 1 34 LEU MD2 1 61 ASN HD21 3.800 . 5.600 3.115 2.579 3.710 . 0 0 "[ . 1]" 1
3539 1 40 ILE MG 1 61 ASN HD21 4.200 . 6.000 4.560 3.757 5.338 . 0 0 "[ . 1]" 1
3540 1 40 ILE HB 1 61 ASN HD22 3.800 . 5.600 3.880 3.156 5.457 . 0 0 "[ . 1]" 1
3541 1 34 LEU MD2 1 61 ASN HD22 4.300 . 6.000 3.268 2.711 3.892 . 0 0 "[ . 1]" 1
3542 1 52 LYS HB3 1 54 MET H 4.100 . 6.000 5.453 4.995 5.661 . 0 0 "[ . 1]" 1
3543 1 70 LEU HB3 1 71 GLU H 3.200 . 4.500 3.599 2.876 3.909 . 0 0 "[ . 1]" 1
3544 1 65 MET HB3 1 71 GLU H 4.100 . 6.000 5.626 4.895 6.031 0.031 5 0 "[ . 1]" 1
3545 1 14 GLN HE22 1 14 GLN HG2 3.700 . 5.400 3.656 3.230 3.992 . 0 0 "[ . 1]" 1
3546 1 28 LYS H 1 28 LYS QE 5.000 . 6.000 4.063 2.980 4.649 . 0 0 "[ . 1]" 1
3547 1 57 PRO HG3 1 59 VAL H 4.200 . 6.000 5.383 4.832 6.208 0.208 5 0 "[ . 1]" 1
3548 1 58 ASP H 1 59 VAL H 3.600 . 5.300 3.774 3.608 3.930 . 0 0 "[ . 1]" 1
3549 1 57 PRO HA 1 59 VAL H 3.900 . 5.800 4.520 4.287 4.653 . 0 0 "[ . 1]" 1
3550 1 75 ALA MB 1 76 LYS H 2.200 . 2.800 2.363 2.238 2.604 . 0 0 "[ . 1]" 1
3551 1 56 LYS H 1 58 ASP HB2 4.000 . 6.000 5.109 4.726 5.460 . 0 0 "[ . 1]" 1
3552 1 51 LEU HG 1 56 LYS H 3.200 . 4.500 2.981 2.845 3.186 . 0 0 "[ . 1]" 1
3553 1 35 GLN HB3 1 36 GLU H 3.100 . 4.300 2.185 2.041 2.297 . 0 0 "[ . 1]" 1
3554 1 33 LEU HA 1 36 GLU H 2.800 . 3.800 3.069 2.988 3.131 . 0 0 "[ . 1]" 1
3555 1 123 GLU H 1 124 GLY HA2 4.500 . 6.000 4.737 4.642 4.867 . 0 0 "[ . 1]" 1
3556 1 47 ASP HB2 1 49 ASP H 3.100 . 4.300 2.227 2.096 2.333 . 0 0 "[ . 1]" 1
3557 1 44 ASP HB2 1 45 VAL H 4.200 . 6.000 3.198 2.905 3.351 . 0 0 "[ . 1]" 1
3558 1 48 PRO HA 1 49 ASP H 3.600 . 5.200 3.427 3.396 3.442 . 0 0 "[ . 1]" 1
3559 1 72 PRO QB 1 73 LEU H 2.700 . 3.600 3.180 3.074 3.463 . 0 0 "[ . 1]" 1
3560 1 65 MET HB3 1 73 LEU H 3.800 . 5.600 5.291 4.972 5.647 0.047 10 0 "[ . 1]" 1
3561 1 70 LEU HA 1 73 LEU H 3.000 . 4.100 3.074 2.973 3.141 . 0 0 "[ . 1]" 1
3562 1 21 ASP H 1 21 ASP HB2 3.000 . 4.200 2.245 2.106 2.458 . 0 0 "[ . 1]" 1
3563 1 75 ALA MB 1 77 SER H 2.800 . 3.800 3.013 2.832 3.229 . 0 0 "[ . 1]" 1
3564 1 76 LYS HG2 1 77 SER H 4.000 . 6.000 4.301 3.875 4.718 . 0 0 "[ . 1]" 1
3565 1 33 LEU HB3 1 37 ASN H 4.100 . 6.000 4.513 3.736 4.734 . 0 0 "[ . 1]" 1
3566 1 34 LEU MD2 1 37 ASN H 3.700 . 5.400 3.994 3.802 4.338 . 0 0 "[ . 1]" 1
3567 1 33 LEU HA 1 37 ASN H 2.800 . 3.800 3.278 3.197 3.448 . 0 0 "[ . 1]" 1
3568 1 18 ALA MB 1 22 MET H 4.200 . 6.000 5.813 5.626 6.094 0.094 7 0 "[ . 1]" 1
3569 1 22 MET H 1 23 VAL MG2 4.200 . 6.000 4.735 4.547 4.940 . 0 0 "[ . 1]" 1
3570 1 114 GLU HB3 1 115 GLY H 3.900 . 5.800 3.567 2.348 4.162 . 0 0 "[ . 1]" 1
3571 1 27 PRO HG3 1 115 GLY H 4.300 . 6.000 3.923 1.984 5.117 0.016 1 0 "[ . 1]" 1
3572 1 24 MET ME 1 115 GLY H 3.100 . 4.300 3.754 3.266 4.056 . 0 0 "[ . 1]" 1
3573 1 27 PRO HB2 1 115 GLY H 4.700 . 6.000 4.753 3.798 5.508 . 0 0 "[ . 1]" 1
3574 1 34 LEU HB3 1 35 GLN H 2.300 . 2.900 2.423 1.977 2.692 . 0 0 "[ . 1]" 1
3575 1 32 LYS HG3 1 35 GLN H 5.000 . 6.000 4.942 4.584 5.432 . 0 0 "[ . 1]" 1
3576 1 34 LEU MD2 1 35 GLN H 4.500 . 6.000 4.350 4.218 4.514 . 0 0 "[ . 1]" 1
3577 1 34 LEU HA 1 35 GLN H 2.400 . 3.100 2.739 2.731 2.747 . 0 0 "[ . 1]" 1
3578 1 51 LEU HB3 1 52 LYS H 3.000 . 4.100 2.687 2.342 2.963 . 0 0 "[ . 1]" 1
3579 1 48 PRO HA 1 52 LYS H 3.500 . 5.100 3.640 3.538 3.735 . 0 0 "[ . 1]" 1
3580 1 49 ASP HB3 1 52 LYS H 4.300 . 6.000 4.971 4.674 5.295 . 0 0 "[ . 1]" 1
3581 1 20 ALA H 1 21 ASP HB3 4.700 . 6.000 4.761 4.513 5.071 . 0 0 "[ . 1]" 1
3582 1 17 ALA H 1 20 ALA H 3.500 . 5.100 3.650 3.497 3.933 . 0 0 "[ . 1]" 1
3583 1 17 ALA HA 1 20 ALA H 2.800 . 3.800 3.091 2.929 3.250 . 0 0 "[ . 1]" 1
3584 1 20 ALA H 1 21 ASP HB2 4.300 . 6.000 4.128 3.900 4.450 . 0 0 "[ . 1]" 1
3585 1 65 MET HG2 1 66 SER H 3.500 . 5.000 3.595 2.719 4.142 . 0 0 "[ . 1]" 1
3586 1 66 SER H 1 70 LEU MD2 3.700 . 5.400 3.725 2.811 4.398 . 0 0 "[ . 1]" 1
3587 1 65 MET HA 1 66 SER H 2.000 . 2.500 2.207 2.110 2.349 . 0 0 "[ . 1]" 1
3588 1 82 GLU H 1 107 PHE QD 4.300 . 6.000 4.957 4.708 5.195 . 0 0 "[ . 1]" 1
3589 1 81 PRO HD3 1 82 GLU H 2.700 . 3.600 2.884 2.865 2.895 . 0 0 "[ . 1]" 1
3590 1 32 LYS HB3 1 34 LEU H 3.200 . 4.500 3.311 3.195 3.398 . 0 0 "[ . 1]" 1
3591 1 33 LEU HB3 1 34 LEU H 2.400 . 3.100 2.879 2.400 3.335 0.235 9 0 "[ . 1]" 1
3592 1 34 LEU H 1 34 LEU MD2 3.700 . 5.400 3.643 3.409 3.844 . 0 0 "[ . 1]" 1
3593 1 33 LEU HA 1 34 LEU H 2.600 . 3.500 2.696 2.684 2.713 . 0 0 "[ . 1]" 1
3594 1 7 PHE QD 1 10 THR H 3.900 . 5.800 4.946 4.821 5.130 . 0 0 "[ . 1]" 1
3595 1 9 ALA HA 1 12 LYS H 3.000 . 4.200 3.644 3.364 3.873 . 0 0 "[ . 1]" 1
3596 1 31 TYR QE 1 32 LYS H 4.700 . 6.000 5.074 4.932 5.227 . 0 0 "[ . 1]" 1
3597 1 23 VAL H 1 112 ASN H 4.200 . 6.000 3.927 3.297 4.370 . 0 0 "[ . 1]" 1
3598 1 40 ILE MD 1 109 THR H 3.900 . 5.800 4.332 4.053 4.582 . 0 0 "[ . 1]" 1
3599 1 108 LYS HA 1 109 THR H 2.700 . 3.600 2.800 2.785 2.810 . 0 0 "[ . 1]" 1
3600 1 105 TYR H 1 105 TYR HA 2.900 . 4.000 2.899 2.885 2.906 . 0 0 "[ . 1]" 1
3601 1 24 MET ME 1 112 ASN H 3.700 . 5.400 3.870 3.599 4.305 . 0 0 "[ . 1]" 1
3602 1 116 GLY HA3 1 118 ASP H 3.800 . 5.600 3.342 3.187 3.561 . 0 0 "[ . 1]" 1
3603 1 100 LYS HA 1 101 THR H 2.400 . 3.100 2.722 2.699 2.739 . 0 0 "[ . 1]" 1
3604 1 45 VAL MG2 1 67 ARG H 4.400 . 6.000 5.830 5.338 6.085 0.085 2 0 "[ . 1]" 1
3605 1 100 LYS HA 1 102 LEU H 3.300 . 4.600 3.398 3.363 3.436 . 0 0 "[ . 1]" 1
3606 1 102 LEU H 1 102 LEU HB2 2.600 . 3.400 2.243 2.146 2.390 . 0 0 "[ . 1]" 1
3607 1 25 LEU HB2 1 26 SER H 3.100 . 4.300 3.831 3.186 3.945 . 0 0 "[ . 1]" 1
3608 1 61 ASN H 1 61 ASN HB2 2.900 . 3.900 3.238 2.516 3.500 . 0 0 "[ . 1]" 1
3609 1 49 ASP HA 1 51 LEU H 3.900 . 5.800 4.183 4.040 4.326 . 0 0 "[ . 1]" 1
3610 1 51 LEU H 1 53 ALA H 3.800 . 5.600 3.884 3.760 3.945 . 0 0 "[ . 1]" 1
3611 1 48 PRO HA 1 51 LEU H 3.100 . 4.300 3.102 3.036 3.158 . 0 0 "[ . 1]" 1
3612 1 16 LYS H 1 16 LYS HG2 2.300 . 2.900 3.069 2.755 3.340 0.440 2 0 "[ . 1]" 1
3613 1 15 VAL MG1 1 16 LYS H 2.500 . 3.300 2.921 2.560 3.274 . 0 0 "[ . 1]" 1
3614 1 79 LEU H 1 80 ASP H 3.800 . 5.600 4.120 3.772 4.346 . 0 0 "[ . 1]" 1
3615 1 3 MET HG3 1 5 GLU H 3.800 . 5.600 3.234 1.884 4.458 0.116 7 0 "[ . 1]" 1
3616 1 27 PRO HG3 1 119 LYS H 4.000 . 6.000 4.039 3.821 4.335 . 0 0 "[ . 1]" 1
3617 1 115 GLY HA3 1 119 LYS H 4.400 . 6.000 4.247 3.976 4.536 . 0 0 "[ . 1]" 1
3618 1 74 LEU MD2 1 79 LEU H 4.800 . 6.000 5.602 5.243 5.982 . 0 0 "[ . 1]" 1
3619 1 13 ALA HA 1 16 LYS H 6.000 . 6.000 2.467 2.246 2.624 . 0 0 "[ . 1]" 1
3620 1 79 LEU H 1 79 LEU HA 2.500 . 3.300 2.848 2.681 2.926 . 0 0 "[ . 1]" 1
3621 1 7 PHE H 1 8 ASP HB3 2.400 . 3.100 2.499 2.320 2.727 . 0 0 "[ . 1]" 1
3622 1 7 PHE H 1 8 ASP H 2.400 . 3.100 2.352 2.236 2.465 . 0 0 "[ . 1]" 1
3623 1 24 MET ME 1 113 SER H 3.800 . 5.600 3.627 3.253 3.827 . 0 0 "[ . 1]" 1
3624 1 25 LEU HB2 1 113 SER H 4.300 . 6.000 5.096 4.807 5.360 . 0 0 "[ . 1]" 1
3625 1 116 GLY HA3 1 119 LYS H 3.800 . 5.700 3.513 3.132 3.792 . 0 0 "[ . 1]" 1
3626 1 96 ALA H 1 97 LEU HB3 4.400 . 6.000 5.879 5.805 6.003 0.003 5 0 "[ . 1]" 1
3627 1 19 LYS HB3 1 96 ALA H 3.700 . 5.400 5.433 5.319 5.624 0.224 2 0 "[ . 1]" 1
3628 1 74 LEU HB3 1 75 ALA H 2.000 . 2.500 2.018 1.834 2.234 . 0 0 "[ . 1]" 1
3629 1 73 LEU HB3 1 75 ALA H 4.600 . 6.000 5.447 5.098 5.728 . 0 0 "[ . 1]" 1
3630 1 16 LYS QB 1 18 ALA H 3.300 . 4.700 4.215 3.962 4.536 . 0 0 "[ . 1]" 1
3631 1 17 ALA MB 1 18 ALA H 2.100 . 2.700 2.090 1.997 2.175 . 0 0 "[ . 1]" 1
3632 1 16 LYS HA 1 18 ALA H 3.300 . 4.700 3.758 3.638 3.885 . 0 0 "[ . 1]" 1
3633 1 82 GLU HG2 1 83 LYS H 2.500 . 3.300 3.487 3.310 3.587 0.287 4 0 "[ . 1]" 1
3634 1 82 GLU QB 1 83 LYS H 2.900 . 3.900 2.442 2.163 2.846 . 0 0 "[ . 1]" 1
3635 1 82 GLU HA 1 83 LYS H 2.800 . 3.800 3.200 2.945 3.380 . 0 0 "[ . 1]" 1
3636 1 73 LEU H 1 75 ALA H 4.000 . 6.000 3.570 2.865 4.081 . 0 0 "[ . 1]" 1
3637 1 28 LYS QD 1 29 ASP H 3.500 . 5.000 3.701 3.207 4.007 . 0 0 "[ . 1]" 1
3638 1 34 LEU HA 1 40 ILE H 4.700 . 6.000 4.330 4.206 4.731 . 0 0 "[ . 1]" 1
3639 1 102 LEU HB2 1 107 PHE H 4.000 . 6.000 4.470 4.352 4.615 . 0 0 "[ . 1]" 1
3640 1 104 GLU H 1 107 PHE H 4.000 . 6.000 3.495 3.144 4.322 . 0 0 "[ . 1]" 1
3641 1 14 GLN H 1 16 LYS HG2 4.100 . 6.000 4.987 4.717 5.143 . 0 0 "[ . 1]" 1
3642 1 12 LYS HB3 1 14 GLN H 3.900 . 5.800 4.471 4.300 4.602 . 0 0 "[ . 1]" 1
3643 1 80 ASP H 1 81 PRO HD3 4.100 . 6.000 4.682 4.388 4.905 . 0 0 "[ . 1]" 1
3644 1 3 MET QG 1 6 LYS H 4.900 . 6.000 3.672 2.195 4.530 . 0 0 "[ . 1]" 1
3645 1 5 GLU HA 1 6 LYS H 2.700 . 3.600 2.684 2.669 2.704 . 0 0 "[ . 1]" 1
3646 1 102 LEU HB2 1 104 GLU H 5.100 . 6.000 4.170 4.043 4.274 . 0 0 "[ . 1]" 1
3647 1 101 THR H 1 104 GLU H 3.900 . 5.800 3.839 3.760 3.930 . 0 0 "[ . 1]" 1
3648 1 104 GLU H 1 105 TYR HA 4.700 . 6.000 4.870 4.771 4.992 . 0 0 "[ . 1]" 1
3649 1 42 LEU HG 1 86 VAL H 4.400 . 6.000 5.176 4.993 5.309 . 0 0 "[ . 1]" 1
3650 1 85 VAL MG2 1 86 VAL H 2.400 . 3.100 2.073 1.924 2.166 . 0 0 "[ . 1]" 1
3651 1 58 ASP HA 1 128 LEU H 3.800 . 5.600 4.210 3.912 4.495 . 0 0 "[ . 1]" 1
3652 1 56 LYS HD3 1 128 LEU H 3.000 . 4.100 3.501 2.850 3.960 . 0 0 "[ . 1]" 1
3653 1 58 ASP HB3 1 128 LEU H 4.300 . 6.000 4.236 3.639 4.611 . 0 0 "[ . 1]" 1
3654 1 86 VAL MG2 1 87 VAL H 2.100 . 2.600 2.138 1.924 2.316 . 0 0 "[ . 1]" 1
3655 1 46 ARG H 1 95 ALA HA 4.400 . 6.000 5.922 5.520 6.082 0.082 9 0 "[ . 1]" 1
3656 1 107 PHE HB3 1 108 LYS H 2.900 . 4.000 2.891 2.173 3.232 . 0 0 "[ . 1]" 1
3657 1 11 PHE H 1 13 ALA H 3.300 . 4.700 3.558 3.510 3.660 . 0 0 "[ . 1]" 1
3658 1 15 VAL H 1 16 LYS HG2 4.400 . 6.000 4.423 4.312 4.506 . 0 0 "[ . 1]" 1
3659 1 15 VAL H 1 17 ALA H 3.500 . 5.000 4.065 4.011 4.121 . 0 0 "[ . 1]" 1
3660 1 13 ALA HA 1 15 VAL H 4.400 . 6.000 4.829 4.735 4.942 . 0 0 "[ . 1]" 1
3661 1 34 LEU MD2 1 60 LYS H 4.500 . 6.000 5.206 4.233 5.994 . 0 0 "[ . 1]" 1
3662 1 31 TYR QE 1 60 LYS H 4.400 . 6.000 3.821 3.376 4.144 . 0 0 "[ . 1]" 1
3663 1 102 LEU HB2 1 103 ARG H 2.300 . 2.900 2.425 2.253 2.517 . 0 0 "[ . 1]" 1
3664 1 101 THR H 1 103 ARG H 3.700 . 5.400 3.981 3.891 4.141 . 0 0 "[ . 1]" 1
3665 1 100 LYS HA 1 103 ARG H 3.400 . 4.900 3.494 3.359 3.676 . 0 0 "[ . 1]" 1
3666 1 103 ARG H 1 104 GLU HB3 4.300 . 6.000 3.692 3.417 3.960 . 0 0 "[ . 1]" 1
3667 1 74 LEU H 1 74 LEU HB3 2.300 . 3.000 2.510 2.025 3.016 0.016 4 0 "[ . 1]" 1
3668 1 124 GLY HA2 1 125 LEU H 2.600 . 3.500 2.603 2.565 2.627 . 0 0 "[ . 1]" 1
3669 1 57 PRO HG3 1 58 ASP H 4.600 . 6.000 4.510 3.874 5.016 . 0 0 "[ . 1]" 1
3670 1 58 ASP H 1 59 VAL MG2 4.400 . 6.000 3.969 3.579 4.426 . 0 0 "[ . 1]" 1
3671 1 31 TYR QE 1 58 ASP H 3.700 . 5.400 3.831 3.652 3.999 . 0 0 "[ . 1]" 1
3672 1 24 MET ME 1 89 CYS H 4.400 . 6.000 5.728 5.341 6.104 0.104 9 0 "[ . 1]" 1
3673 1 119 LYS HB2 1 122 GLU H 4.000 . 6.000 4.553 4.323 4.691 . 0 0 "[ . 1]" 1
3674 1 119 LYS HA 1 122 GLU H 2.800 . 3.800 3.003 2.821 3.146 . 0 0 "[ . 1]" 1
3675 1 40 ILE MD 1 41 THR H 3.100 . 4.300 3.540 3.407 3.610 . 0 0 "[ . 1]" 1
3676 1 39 ASP H 1 41 THR H 4.400 . 6.000 4.442 4.406 4.472 . 0 0 "[ . 1]" 1
3677 1 50 GLU H 1 51 LEU HB3 4.700 . 6.000 4.477 4.345 4.589 . 0 0 "[ . 1]" 1
3678 1 48 PRO HA 1 50 GLU H 2.800 . 3.800 2.832 2.813 2.844 . 0 0 "[ . 1]" 1
3679 1 47 ASP HB2 1 50 GLU H 3.200 . 4.500 2.909 2.389 3.177 . 0 0 "[ . 1]" 1
3680 1 49 ASP HB3 1 50 GLU H 3.200 . 4.500 2.731 2.396 2.861 . 0 0 "[ . 1]" 1
3681 1 117 MET HA 1 120 TRP H 2.900 . 4.000 3.003 2.947 3.106 . 0 0 "[ . 1]" 1
3682 1 120 TRP H 1 122 GLU QB 4.200 . 6.000 4.457 4.223 4.749 . 0 0 "[ . 1]" 1
3683 1 22 MET HB3 1 25 LEU H 4.500 . 6.000 5.384 4.484 6.148 0.148 5 0 "[ . 1]" 1
3684 1 24 MET ME 1 25 LEU H 2.900 . 4.000 3.133 3.007 3.350 . 0 0 "[ . 1]" 1
3685 1 24 MET HG2 1 25 LEU H 4.800 . 6.000 4.220 3.799 4.875 . 0 0 "[ . 1]" 1
3686 1 24 MET HG3 1 25 LEU H 4.700 . 6.000 4.528 4.320 4.721 . 0 0 "[ . 1]" 1
3687 1 11 PHE H 1 12 LYS HB2 4.500 . 6.000 4.638 4.378 4.852 . 0 0 "[ . 1]" 1
3688 1 9 ALA MB 1 11 PHE H 4.200 . 6.000 4.542 4.421 4.615 . 0 0 "[ . 1]" 1
3689 1 8 ASP QB 1 11 PHE H 5.000 . 6.000 4.769 4.559 4.928 . 0 0 "[ . 1]" 1
3690 1 43 ILE HG13 1 64 HIS H 3.600 . 5.300 5.120 4.867 5.323 0.023 1 0 "[ . 1]" 1
3691 1 56 LYS HD3 1 64 HIS H 4.500 . 6.000 4.665 4.308 5.083 . 0 0 "[ . 1]" 1
3692 1 42 LEU H 1 62 TYR H 3.900 . 5.800 4.096 3.980 4.282 . 0 0 "[ . 1]" 1
3693 1 41 THR HA 1 62 TYR H 4.200 . 6.000 4.638 4.455 4.917 . 0 0 "[ . 1]" 1
3694 1 25 LEU MD2 1 30 ALA H 4.000 . 6.000 4.147 3.717 4.398 . 0 0 "[ . 1]" 1
3695 1 25 LEU MD1 1 30 ALA H 3.400 . 4.800 3.445 3.054 3.770 . 0 0 "[ . 1]" 1
3696 1 26 SER HB2 1 30 ALA H 4.800 . 6.000 4.274 4.187 4.402 . 0 0 "[ . 1]" 1
3697 1 19 LYS HB2 1 24 MET H 4.000 . 6.000 4.498 4.241 4.846 . 0 0 "[ . 1]" 1
3698 1 22 MET HB2 1 110 ILE H 4.500 . 6.000 5.279 4.412 5.907 . 0 0 "[ . 1]" 1
3699 1 25 LEU HG 1 111 TYR H 4.900 . 6.000 4.283 4.228 4.366 . 0 0 "[ . 1]" 1
3700 1 86 VAL MG1 1 111 TYR H 2.900 . 4.000 3.275 3.222 3.327 . 0 0 "[ . 1]" 1
3701 1 23 VAL MG1 1 111 TYR H 4.800 . 6.000 4.833 4.695 4.920 . 0 0 "[ . 1]" 1
3702 1 43 ILE H 1 86 VAL HB 4.100 . 6.000 4.886 4.751 5.018 . 0 0 "[ . 1]" 1
3703 1 34 LEU MD2 1 43 ILE H 3.800 . 5.600 3.383 3.284 3.597 . 0 0 "[ . 1]" 1
3704 1 43 ILE HG13 1 63 LYS H 2.500 . 3.300 2.795 2.457 3.023 . 0 0 "[ . 1]" 1
3705 1 42 LEU H 1 42 LEU HG 3.500 . 5.000 3.781 3.657 3.889 . 0 0 "[ . 1]" 1
3706 1 40 ILE MG 1 42 LEU H 3.100 . 4.300 3.609 3.204 3.874 . 0 0 "[ . 1]" 1
3707 1 42 LEU H 1 61 ASN HB2 3.600 . 5.200 3.589 3.043 4.292 . 0 0 "[ . 1]" 1
3708 1 42 LEU H 1 42 LEU HB2 2.900 . 4.000 3.087 2.961 3.285 . 0 0 "[ . 1]" 1
3709 1 58 ASP HB2 1 120 TRP HE1 4.500 . 6.000 5.054 4.747 5.454 . 0 0 "[ . 1]" 1
3710 1 31 TYR QE 1 120 TRP HE1 4.400 . 6.000 4.624 4.346 4.727 . 0 0 "[ . 1]" 1
3711 1 65 MET H 1 70 LEU MD2 4.200 . 6.000 5.109 4.641 5.480 . 0 0 "[ . 1]" 1
3712 1 46 ARG H 1 65 MET H 4.000 . 6.000 3.918 3.741 4.200 . 0 0 "[ . 1]" 1
3713 1 44 ASP HB3 1 65 MET H 3.700 . 5.400 4.018 3.822 4.153 . 0 0 "[ . 1]" 1
3714 2 81 PRO HB3 2 106 GLY H 4.500 . 6.000 4.959 4.499 5.399 . 0 0 "[ . 1]" 1
3715 2 105 TYR HA 2 106 GLY H 2.600 . 3.400 2.382 2.309 2.444 . 0 0 "[ . 1]" 1
3716 2 103 ARG HB3 2 106 GLY H 4.900 . 6.000 4.776 4.571 4.943 . 0 0 "[ . 1]" 1
3717 2 66 SER HA 2 68 GLY H 3.500 . 5.000 3.322 3.155 3.444 . 0 0 "[ . 1]" 1
3718 2 51 LEU HB3 2 55 GLY H 4.000 . 6.000 4.181 4.100 4.329 . 0 0 "[ . 1]" 1
3719 2 22 MET HB2 2 99 GLY H 4.800 . 6.000 5.697 5.464 5.881 . 0 0 "[ . 1]" 1
3720 2 87 VAL MG2 2 99 GLY H 2.900 . 3.900 2.889 2.625 3.098 . 0 0 "[ . 1]" 1
3721 2 27 PRO HB2 2 114 GLU H 3.600 . 5.200 4.947 4.691 5.260 0.060 5 0 "[ . 1]" 1
3722 2 24 MET QB 2 114 GLU H 4.300 . 6.000 3.695 1.899 4.465 0.001 5 0 "[ . 1]" 1
3723 2 24 MET ME 2 114 GLU H 2.600 . 3.500 2.340 2.074 3.050 . 0 0 "[ . 1]" 1
3724 2 122 GLU QB 2 124 GLY H 3.700 . 5.400 3.954 3.899 4.012 . 0 0 "[ . 1]" 1
3725 2 40 ILE HA 2 85 VAL H 4.400 . 6.000 4.485 4.302 4.634 . 0 0 "[ . 1]" 1
3726 2 40 ILE HB 2 61 ASN HD21 4.200 . 6.000 4.082 3.449 4.816 . 0 0 "[ . 1]" 1
3727 2 34 LEU MD2 2 61 ASN HD21 3.800 . 5.600 3.266 2.403 3.923 . 0 0 "[ . 1]" 1
3728 2 40 ILE MG 2 61 ASN HD21 4.200 . 6.000 4.540 3.645 5.216 . 0 0 "[ . 1]" 1
3729 2 40 ILE HB 2 61 ASN HD22 3.800 . 5.600 3.979 3.293 5.879 0.279 10 0 "[ . 1]" 1
3730 2 34 LEU MD2 2 61 ASN HD22 4.300 . 6.000 3.298 2.959 3.871 . 0 0 "[ . 1]" 1
3731 2 52 LYS HB3 2 54 MET H 4.100 . 6.000 5.424 5.083 5.614 . 0 0 "[ . 1]" 1
3732 2 70 LEU HB3 2 71 GLU H 3.200 . 4.500 3.762 3.303 4.213 . 0 0 "[ . 1]" 1
3733 2 65 MET HB3 2 71 GLU H 4.100 . 6.000 5.726 5.220 5.986 . 0 0 "[ . 1]" 1
3734 1 104 GLU HG2 2 14 GLN HE22 3.700 . 5.400 3.665 3.371 4.010 . 0 0 "[ . 1]" 1
3735 2 28 LYS H 2 28 LYS QE 5.000 . 6.000 4.155 3.526 4.815 . 0 0 "[ . 1]" 1
3736 2 57 PRO HG3 2 59 VAL H 4.200 . 6.000 5.233 4.820 5.816 . 0 0 "[ . 1]" 1
3737 2 58 ASP H 2 59 VAL H 3.600 . 5.300 3.761 3.587 3.973 . 0 0 "[ . 1]" 1
3738 2 57 PRO HA 2 59 VAL H 3.900 . 5.800 4.482 4.335 4.620 . 0 0 "[ . 1]" 1
3739 2 75 ALA MB 2 76 LYS H 2.200 . 2.800 2.499 2.327 2.812 0.012 5 0 "[ . 1]" 1
3740 2 56 LYS H 2 58 ASP HB2 4.000 . 6.000 5.064 4.704 5.253 . 0 0 "[ . 1]" 1
3741 2 51 LEU HG 2 56 LYS H 3.200 . 4.500 2.905 2.724 3.274 . 0 0 "[ . 1]" 1
3742 2 35 GLN HB3 2 36 GLU H 3.100 . 4.300 2.179 2.081 2.281 . 0 0 "[ . 1]" 1
3743 2 33 LEU HA 2 36 GLU H 2.800 . 3.800 3.105 3.012 3.148 . 0 0 "[ . 1]" 1
3744 2 123 GLU H 2 124 GLY HA2 4.500 . 6.000 4.746 4.614 4.847 . 0 0 "[ . 1]" 1
3745 1 49 ASP HB2 2 49 ASP H 3.100 . 4.300 2.156 2.077 2.285 . 0 0 "[ . 1]" 1
3746 2 44 ASP HB2 2 45 VAL H 4.200 . 6.000 3.135 2.872 3.371 . 0 0 "[ . 1]" 1
3747 1 50 GLU HA 2 49 ASP H 3.600 . 5.200 3.410 3.368 3.450 . 0 0 "[ . 1]" 1
3748 2 72 PRO QB 2 73 LEU H 2.700 . 3.600 3.163 2.997 3.358 . 0 0 "[ . 1]" 1
3749 2 65 MET HB3 2 73 LEU H 3.800 . 5.600 5.407 4.956 5.629 0.029 5 0 "[ . 1]" 1
3750 2 70 LEU HA 2 73 LEU H 3.000 . 4.100 3.075 2.954 3.146 . 0 0 "[ . 1]" 1
3751 2 21 ASP H 2 21 ASP HB2 3.000 . 4.200 2.318 2.134 2.514 . 0 0 "[ . 1]" 1
3752 2 75 ALA MB 2 77 SER H 2.800 . 3.800 3.095 2.844 3.668 . 0 0 "[ . 1]" 1
3753 2 76 LYS HG2 2 77 SER H 4.000 . 6.000 3.924 3.640 4.384 . 0 0 "[ . 1]" 1
3754 2 33 LEU HB3 2 37 ASN H 4.100 . 6.000 4.504 4.231 4.880 . 0 0 "[ . 1]" 1
3755 2 34 LEU MD2 2 37 ASN H 3.700 . 5.400 3.995 3.624 4.297 . 0 0 "[ . 1]" 1
3756 2 33 LEU HA 2 37 ASN H 2.800 . 3.800 3.319 3.160 3.506 . 0 0 "[ . 1]" 1
3757 2 18 ALA MB 2 22 MET H 4.200 . 6.000 5.864 5.620 6.039 0.039 9 0 "[ . 1]" 1
3758 2 22 MET H 2 23 VAL MG2 4.200 . 6.000 4.689 4.408 4.784 . 0 0 "[ . 1]" 1
3759 2 114 GLU HB3 2 115 GLY H 3.900 . 5.800 3.597 2.670 4.387 . 0 0 "[ . 1]" 1
3760 2 27 PRO HG3 2 115 GLY H 4.300 . 6.000 3.860 1.985 5.099 0.015 7 0 "[ . 1]" 1
3761 2 24 MET ME 2 115 GLY H 3.100 . 4.300 3.763 3.581 4.016 . 0 0 "[ . 1]" 1
3762 2 27 PRO HB2 2 115 GLY H 4.700 . 6.000 4.908 4.211 5.807 . 0 0 "[ . 1]" 1
3763 2 34 LEU HB3 2 35 GLN H 2.300 . 2.900 2.401 2.056 2.620 . 0 0 "[ . 1]" 1
3764 2 32 LYS HG3 2 35 GLN H 5.000 . 6.000 5.095 4.743 5.505 . 0 0 "[ . 1]" 1
3765 2 34 LEU MD2 2 35 GLN H 4.500 . 6.000 4.304 4.092 4.523 . 0 0 "[ . 1]" 1
3766 2 34 LEU HA 2 35 GLN H 2.400 . 3.100 2.733 2.719 2.743 . 0 0 "[ . 1]" 1
3767 2 51 LEU HB3 2 52 LYS H 3.000 . 4.100 2.644 2.374 3.009 . 0 0 "[ . 1]" 1
3768 2 48 PRO HA 2 52 LYS H 3.500 . 5.000 3.645 3.510 3.773 . 0 0 "[ . 1]" 1
3769 1 49 ASP HB3 2 52 LYS H 4.300 . 6.000 4.689 4.497 4.949 . 0 0 "[ . 1]" 1
3770 2 20 ALA H 2 21 ASP HB3 4.700 . 6.000 4.718 4.434 4.911 . 0 0 "[ . 1]" 1
3771 2 17 ALA H 2 20 ALA H 3.500 . 5.100 3.554 3.484 3.628 . 0 0 "[ . 1]" 1
3772 2 17 ALA HA 2 20 ALA H 2.800 . 3.800 3.076 2.998 3.158 . 0 0 "[ . 1]" 1
3773 2 20 ALA H 2 21 ASP HB2 4.300 . 6.000 4.221 3.997 4.439 . 0 0 "[ . 1]" 1
3774 2 65 MET HG2 2 66 SER H 3.500 . 5.000 3.637 2.748 4.352 . 0 0 "[ . 1]" 1
3775 2 66 SER H 2 70 LEU MD2 3.700 . 5.400 3.636 2.375 4.918 . 0 0 "[ . 1]" 1
3776 2 65 MET HA 2 66 SER H 2.000 . 2.500 2.219 2.146 2.333 . 0 0 "[ . 1]" 1
3777 1 7 PHE QE 2 82 GLU H 4.300 . 6.000 4.899 4.628 5.090 . 0 0 "[ . 1]" 1
3778 2 81 PRO HD3 2 82 GLU H 2.700 . 3.600 2.883 2.869 2.899 . 0 0 "[ . 1]" 1
3779 2 32 LYS HB3 2 34 LEU H 3.200 . 4.500 3.289 3.209 3.414 . 0 0 "[ . 1]" 1
3780 2 33 LEU HB3 2 34 LEU H 2.400 . 3.100 2.912 2.174 3.356 0.256 10 0 "[ . 1]" 1
3781 2 34 LEU H 2 34 LEU MD2 3.700 . 5.400 3.633 3.295 3.768 . 0 0 "[ . 1]" 1
3782 2 33 LEU HA 2 34 LEU H 2.600 . 3.500 2.696 2.667 2.737 . 0 0 "[ . 1]" 1
3783 1 105 TYR QD 2 10 THR H 3.900 . 5.800 4.942 4.765 5.222 . 0 0 "[ . 1]" 1
3784 2 9 ALA HA 2 12 LYS H 3.000 . 4.200 3.674 3.453 3.881 . 0 0 "[ . 1]" 1
3785 2 31 TYR QE 2 32 LYS H 4.700 . 6.000 5.103 4.922 5.207 . 0 0 "[ . 1]" 1
3786 2 23 VAL H 2 112 ASN H 4.200 . 6.000 3.961 3.458 4.536 . 0 0 "[ . 1]" 1
3787 2 40 ILE MD 2 109 THR H 3.900 . 5.800 4.346 4.054 4.883 . 0 0 "[ . 1]" 1
3788 2 108 LYS HA 2 109 THR H 2.700 . 3.600 2.800 2.790 2.809 . 0 0 "[ . 1]" 1
3789 2 105 TYR H 2 105 TYR HA 2.900 . 4.000 2.901 2.893 2.908 . 0 0 "[ . 1]" 1
3790 2 24 MET ME 2 112 ASN H 3.700 . 5.400 3.803 3.551 4.212 . 0 0 "[ . 1]" 1
3791 2 116 GLY HA3 2 118 ASP H 3.800 . 5.600 3.319 3.216 3.476 . 0 0 "[ . 1]" 1
3792 2 100 LYS HA 2 101 THR H 2.400 . 3.100 2.732 2.714 2.745 . 0 0 "[ . 1]" 1
3793 2 100 LYS HA 2 102 LEU H 3.300 . 4.600 3.366 3.335 3.436 . 0 0 "[ . 1]" 1
3794 2 102 LEU H 2 102 LEU HB2 2.600 . 3.400 2.175 2.076 2.347 . 0 0 "[ . 1]" 1
3795 2 25 LEU HB2 2 26 SER H 3.100 . 4.300 3.751 3.135 3.929 . 0 0 "[ . 1]" 1
3796 2 61 ASN H 2 61 ASN HB2 2.900 . 3.900 3.158 2.471 3.507 . 0 0 "[ . 1]" 1
3797 2 49 ASP HA 2 51 LEU H 3.900 . 5.800 4.169 3.956 4.327 . 0 0 "[ . 1]" 1
3798 2 51 LEU H 2 53 ALA H 3.800 . 5.600 3.914 3.855 3.971 . 0 0 "[ . 1]" 1
3799 2 48 PRO HA 2 51 LEU H 3.100 . 4.300 3.069 2.966 3.204 . 0 0 "[ . 1]" 1
3800 2 16 LYS H 2 16 LYS HG2 2.300 . 2.900 2.814 2.201 3.046 0.146 6 0 "[ . 1]" 1
3801 2 15 VAL MG1 2 16 LYS H 2.500 . 3.300 2.584 2.366 2.917 . 0 0 "[ . 1]" 1
3802 1 4 GLY H 2 79 LEU H 3.700 . 5.400 4.163 3.878 4.410 . 0 0 "[ . 1]" 1
3803 2 3 MET HG3 2 5 GLU H 3.800 . 5.600 3.056 1.876 4.389 0.124 9 0 "[ . 1]" 1
3804 2 27 PRO HG3 2 119 LYS H 4.000 . 6.000 3.983 3.868 4.088 . 0 0 "[ . 1]" 1
3805 2 115 GLY HA3 2 119 LYS H 4.400 . 6.000 4.291 4.053 4.549 . 0 0 "[ . 1]" 1
3806 2 74 LEU MD2 2 79 LEU H 4.800 . 6.000 5.559 5.256 5.860 . 0 0 "[ . 1]" 1
3807 2 13 ALA HA 2 16 LYS H 6.000 . 6.000 2.491 2.295 2.742 . 0 0 "[ . 1]" 1
3808 1 4 GLY HA3 2 79 LEU H 2.500 . 3.300 2.872 2.832 2.923 . 0 0 "[ . 1]" 1
3809 2 7 PHE H 2 8 ASP HB3 2.400 . 3.100 2.591 2.467 2.740 . 0 0 "[ . 1]" 1
3810 2 7 PHE H 2 8 ASP H 2.400 . 3.100 2.349 2.244 2.469 . 0 0 "[ . 1]" 1
3811 2 24 MET ME 2 113 SER H 3.800 . 5.600 3.806 3.619 4.220 . 0 0 "[ . 1]" 1
3812 2 25 LEU HB2 2 113 SER H 4.300 . 6.000 5.056 4.724 5.355 . 0 0 "[ . 1]" 1
3813 2 116 GLY HA3 2 119 LYS H 3.800 . 5.700 3.490 3.226 3.677 . 0 0 "[ . 1]" 1
3814 2 19 LYS HB3 2 96 ALA H 3.700 . 5.400 5.321 4.519 5.809 0.409 3 0 "[ . 1]" 1
3815 2 74 LEU HB2 2 75 ALA H 2.000 . 2.500 2.078 1.992 2.197 . 0 0 "[ . 1]" 1
3816 2 16 LYS QB 2 18 ALA H 3.300 . 4.700 4.224 3.967 4.467 . 0 0 "[ . 1]" 1
3817 2 17 ALA MB 2 18 ALA H 2.100 . 2.700 2.102 1.988 2.169 . 0 0 "[ . 1]" 1
3818 2 16 LYS HA 2 18 ALA H 3.300 . 4.700 3.824 3.667 3.964 . 0 0 "[ . 1]" 1
3819 2 82 GLU HG2 2 83 LYS H 2.500 . 3.300 3.452 3.312 3.564 0.264 7 0 "[ . 1]" 1
3820 2 82 GLU QB 2 83 LYS H 2.800 . 3.800 2.422 2.091 2.756 . 0 0 "[ . 1]" 1
3821 2 82 GLU HA 2 83 LYS H 2.800 . 3.800 3.274 3.173 3.329 . 0 0 "[ . 1]" 1
3822 1 7 PHE QE 2 75 ALA H 4.000 . 6.000 3.583 3.187 3.946 . 0 0 "[ . 1]" 1
3823 2 28 LYS QD 2 29 ASP H 3.500 . 5.000 3.852 3.591 3.967 . 0 0 "[ . 1]" 1
3824 2 34 LEU HA 2 40 ILE H 4.700 . 6.000 4.379 4.177 4.983 . 0 0 "[ . 1]" 1
3825 2 102 LEU HB2 2 107 PHE H 4.000 . 6.000 4.444 4.296 4.585 . 0 0 "[ . 1]" 1
3826 2 104 GLU H 2 107 PHE H 4.000 . 6.000 3.366 3.068 3.866 . 0 0 "[ . 1]" 1
3827 2 14 GLN H 2 16 LYS HG2 4.100 . 6.000 4.921 4.690 5.177 . 0 0 "[ . 1]" 1
3828 2 12 LYS HB3 2 14 GLN H 3.900 . 5.800 4.461 4.318 4.591 . 0 0 "[ . 1]" 1
3829 2 80 ASP H 2 81 PRO HD3 4.000 . 6.000 4.556 4.326 4.794 . 0 0 "[ . 1]" 1
3830 2 3 MET QG 2 6 LYS H 4.900 . 6.000 3.322 2.169 4.057 . 0 0 "[ . 1]" 1
3831 2 5 GLU HA 2 6 LYS H 2.700 . 3.600 2.699 2.681 2.714 . 0 0 "[ . 1]" 1
3832 2 102 LEU HB2 2 104 GLU H 5.100 . 6.000 4.163 4.094 4.320 . 0 0 "[ . 1]" 1
3833 2 101 THR H 2 104 GLU H 3.900 . 5.800 3.841 3.737 3.915 . 0 0 "[ . 1]" 1
3834 2 104 GLU H 2 105 TYR HA 4.700 . 6.000 4.894 4.842 4.950 . 0 0 "[ . 1]" 1
3835 2 42 LEU HG 2 86 VAL H 4.400 . 6.000 5.157 5.000 5.349 . 0 0 "[ . 1]" 1
3836 2 85 VAL MG2 2 86 VAL H 2.400 . 3.100 2.087 1.806 2.219 . 0 0 "[ . 1]" 1
3837 2 58 ASP HA 2 128 LEU H 3.800 . 5.600 4.186 3.779 4.613 . 0 0 "[ . 1]" 1
3838 2 56 LYS HD3 2 128 LEU H 3.000 . 4.100 3.261 2.855 4.026 . 0 0 "[ . 1]" 1
3839 2 58 ASP HB3 2 128 LEU H 4.300 . 6.000 4.062 3.673 4.441 . 0 0 "[ . 1]" 1
3840 2 86 VAL MG2 2 87 VAL H 2.100 . 2.600 2.138 1.962 2.300 . 0 0 "[ . 1]" 1
3841 2 46 ARG H 2 95 ALA HA 4.400 . 6.000 5.993 5.790 6.070 0.070 6 0 "[ . 1]" 1
3842 2 107 PHE HB3 2 108 LYS H 2.900 . 4.000 3.036 2.733 3.352 . 0 0 "[ . 1]" 1
3843 2 11 PHE H 2 13 ALA H 3.300 . 4.700 3.546 3.498 3.597 . 0 0 "[ . 1]" 1
3844 2 15 VAL H 2 16 LYS HG2 4.400 . 6.000 4.433 4.360 4.530 . 0 0 "[ . 1]" 1
3845 2 34 LEU MD2 2 60 LYS H 4.500 . 6.000 5.112 4.158 6.032 0.032 1 0 "[ . 1]" 1
3846 2 31 TYR QE 2 60 LYS H 4.400 . 6.000 3.843 3.305 4.193 . 0 0 "[ . 1]" 1
3847 2 102 LEU HB2 2 103 ARG H 2.300 . 2.900 2.444 2.342 2.629 . 0 0 "[ . 1]" 1
3848 2 101 THR H 2 103 ARG H 3.700 . 5.400 4.048 3.958 4.135 . 0 0 "[ . 1]" 1
3849 2 100 LYS HA 2 103 ARG H 3.400 . 4.900 3.490 3.290 3.662 . 0 0 "[ . 1]" 1
3850 2 103 ARG H 2 104 GLU HB3 4.300 . 6.000 3.707 3.265 4.285 . 0 0 "[ . 1]" 1
3851 2 74 LEU H 2 74 LEU HB2 2.300 . 3.000 2.240 2.053 2.444 . 0 0 "[ . 1]" 1
3852 2 124 GLY HA2 2 125 LEU H 2.600 . 3.500 2.600 2.563 2.630 . 0 0 "[ . 1]" 1
3853 2 57 PRO HG3 2 58 ASP H 4.600 . 6.000 4.348 3.898 4.810 . 0 0 "[ . 1]" 1
3854 2 58 ASP H 2 59 VAL MG2 4.400 . 6.000 4.551 3.653 5.054 . 0 0 "[ . 1]" 1
3855 2 31 TYR QE 2 58 ASP H 3.700 . 5.400 3.829 3.653 4.024 . 0 0 "[ . 1]" 1
3856 2 24 MET ME 2 89 CYS H 4.400 . 6.000 5.731 5.331 6.080 0.080 9 0 "[ . 1]" 1
3857 2 119 LYS HB2 2 122 GLU H 4.000 . 6.000 4.549 4.424 4.660 . 0 0 "[ . 1]" 1
3858 2 119 LYS HA 2 122 GLU H 2.800 . 3.800 2.998 2.826 3.165 . 0 0 "[ . 1]" 1
3859 2 40 ILE MD 2 41 THR H 3.100 . 4.300 3.578 3.504 3.610 . 0 0 "[ . 1]" 1
3860 2 39 ASP H 2 41 THR H 4.400 . 6.000 4.445 4.428 4.460 . 0 0 "[ . 1]" 1
3861 2 50 GLU H 2 51 LEU HB3 4.700 . 6.000 4.521 4.391 4.650 . 0 0 "[ . 1]" 1
3862 2 48 PRO HA 2 50 GLU H 2.800 . 3.800 2.828 2.792 2.852 . 0 0 "[ . 1]" 1
3863 1 49 ASP HB2 2 50 GLU H 3.200 . 4.500 2.616 2.464 2.767 . 0 0 "[ . 1]" 1
3864 1 49 ASP HB3 2 50 GLU H 3.200 . 4.500 2.622 2.526 2.814 . 0 0 "[ . 1]" 1
3865 2 117 MET HA 2 120 TRP H 2.900 . 4.000 2.997 2.881 3.063 . 0 0 "[ . 1]" 1
3866 2 120 TRP H 2 122 GLU QB 4.200 . 6.000 4.389 4.307 4.460 . 0 0 "[ . 1]" 1
3867 2 22 MET HB3 2 25 LEU H 4.500 . 6.000 5.424 4.917 6.122 0.122 6 0 "[ . 1]" 1
3868 2 24 MET ME 2 25 LEU H 2.900 . 4.000 3.106 2.987 3.312 . 0 0 "[ . 1]" 1
3869 2 24 MET HG2 2 25 LEU H 4.800 . 6.000 4.175 4.022 4.675 . 0 0 "[ . 1]" 1
3870 2 24 MET HG3 2 25 LEU H 4.700 . 6.000 4.498 4.147 4.671 . 0 0 "[ . 1]" 1
3871 2 11 PHE H 2 12 LYS HB2 4.500 . 6.000 4.706 4.345 5.039 . 0 0 "[ . 1]" 1
3872 2 9 ALA MB 2 11 PHE H 4.200 . 6.000 4.471 4.126 4.627 . 0 0 "[ . 1]" 1
3873 2 8 ASP QB 2 11 PHE H 5.000 . 6.000 4.669 4.455 4.846 . 0 0 "[ . 1]" 1
3874 2 43 ILE HG13 2 64 HIS H 3.600 . 5.300 5.065 4.793 5.334 0.034 1 0 "[ . 1]" 1
3875 2 56 LYS HD3 2 64 HIS H 4.500 . 6.000 4.655 4.380 5.008 . 0 0 "[ . 1]" 1
3876 2 42 LEU H 2 62 TYR H 3.900 . 5.800 4.050 4.000 4.173 . 0 0 "[ . 1]" 1
3877 2 41 THR HA 2 62 TYR H 4.200 . 6.000 4.574 4.477 4.775 . 0 0 "[ . 1]" 1
3878 2 25 LEU MD2 2 30 ALA H 4.000 . 6.000 4.192 4.056 4.377 . 0 0 "[ . 1]" 1
3879 2 25 LEU MD1 2 30 ALA H 3.400 . 4.800 3.409 3.170 3.720 . 0 0 "[ . 1]" 1
3880 2 26 SER HB2 2 30 ALA H 4.800 . 6.000 4.338 4.252 4.509 . 0 0 "[ . 1]" 1
3881 2 19 LYS HB2 2 24 MET H 4.000 . 6.000 4.440 3.887 4.801 . 0 0 "[ . 1]" 1
3882 2 22 MET HB2 2 110 ILE H 4.500 . 6.000 5.266 4.610 6.095 0.095 10 0 "[ . 1]" 1
3883 2 25 LEU HG 2 111 TYR H 4.900 . 6.000 4.283 4.230 4.313 . 0 0 "[ . 1]" 1
3884 2 86 VAL MG1 2 111 TYR H 2.900 . 4.000 3.288 3.239 3.362 . 0 0 "[ . 1]" 1
3885 2 23 VAL MG1 2 111 TYR H 4.800 . 6.000 4.821 4.588 5.024 . 0 0 "[ . 1]" 1
3886 2 43 ILE H 2 86 VAL HB 4.100 . 6.000 4.870 4.744 5.036 . 0 0 "[ . 1]" 1
3887 2 34 LEU MD2 2 43 ILE H 3.800 . 5.600 3.387 3.210 3.546 . 0 0 "[ . 1]" 1
3888 2 43 ILE HG13 2 63 LYS H 2.500 . 3.300 2.779 2.325 3.009 . 0 0 "[ . 1]" 1
3889 2 42 LEU H 2 42 LEU HG 3.500 . 5.000 3.792 3.728 3.915 . 0 0 "[ . 1]" 1
3890 2 40 ILE MG 2 42 LEU H 3.100 . 4.300 3.665 3.389 4.231 . 0 0 "[ . 1]" 1
3891 2 42 LEU H 2 61 ASN HB2 3.600 . 5.200 3.439 3.103 4.073 . 0 0 "[ . 1]" 1
3892 2 42 LEU H 2 42 LEU HB2 2.900 . 4.000 3.119 3.018 3.243 . 0 0 "[ . 1]" 1
3893 2 58 ASP HB2 2 120 TRP HE1 4.500 . 6.000 5.173 4.897 5.428 . 0 0 "[ . 1]" 1
3894 2 31 TYR QE 2 120 TRP HE1 4.400 . 6.000 4.607 4.411 4.740 . 0 0 "[ . 1]" 1
3895 2 65 MET H 2 70 LEU MD2 4.200 . 6.000 4.911 4.418 5.626 . 0 0 "[ . 1]" 1
3896 2 46 ARG H 2 65 MET H 4.000 . 6.000 3.898 3.693 4.232 . 0 0 "[ . 1]" 1
3897 2 44 ASP HB3 2 65 MET H 3.700 . 5.400 4.028 3.814 4.229 . 0 0 "[ . 1]" 1
3898 1 19 LYS HA 1 24 MET ME 2.600 . 3.400 3.176 2.766 3.460 0.060 7 0 "[ . 1]" 1
3899 1 33 LEU HA 1 40 ILE MD 4.200 . 6.000 3.325 3.147 3.464 . 0 0 "[ . 1]" 1
3900 1 37 ASN HA 1 40 ILE MD 4.600 . 6.000 4.455 4.348 4.571 . 0 0 "[ . 1]" 1
3901 1 41 THR HB 1 43 ILE MD 3.800 . 5.600 3.289 2.473 3.910 . 0 0 "[ . 1]" 1
3902 1 43 ILE MD 1 86 VAL H 3.600 . 5.200 4.378 3.917 4.959 . 0 0 "[ . 1]" 1
3903 1 41 THR MG 1 43 ILE MD 2.400 . 3.100 2.906 2.570 3.140 0.040 1 0 "[ . 1]" 1
3904 1 22 MET HB2 1 110 ILE MD 3.200 . 4.500 4.439 4.290 4.595 0.095 9 0 "[ . 1]" 1
3905 1 26 SER HA 1 30 ALA MB 3.100 . 4.300 3.817 3.557 3.997 . 0 0 "[ . 1]" 1
3906 1 43 ILE MG 1 45 VAL MG1 2.400 . 3.100 2.570 2.370 2.936 . 0 0 "[ . 1]" 1
3907 1 42 LEU HA 1 43 ILE MG 4.100 . 6.000 3.820 3.501 4.119 . 0 0 "[ . 1]" 1
3908 1 20 ALA MB 1 21 ASP HB3 3.900 . 5.800 4.726 4.482 5.024 . 0 0 "[ . 1]" 1
3909 1 45 VAL MG2 1 65 MET HB2 3.100 . 4.300 2.622 2.028 3.575 . 0 0 "[ . 1]" 1
3910 1 87 VAL HA 1 95 ALA MB 4.200 . 6.000 3.624 3.378 3.996 . 0 0 "[ . 1]" 1
3911 1 12 LYS HB3 1 13 ALA MB 2.800 . 3.800 3.717 3.527 3.824 0.024 1 0 "[ . 1]" 1
3912 1 17 ALA HA 1 17 ALA MB 1.900 . 2.300 1.876 1.864 1.892 . 0 0 "[ . 1]" 1
3913 1 96 ALA MB 1 97 LEU MD2 2.200 . 2.800 2.806 2.723 2.846 0.046 10 0 "[ . 1]" 1
3914 1 45 VAL MG1 1 98 ALA MB 2.300 . 3.000 2.031 1.622 2.223 . 0 0 "[ . 1]" 1
3915 1 85 VAL MG2 1 99 GLY HA3 3.600 . 5.200 3.397 2.982 3.600 . 0 0 "[ . 1]" 1
3916 1 71 GLU HA 1 75 ALA MB 3.700 . 5.400 5.455 5.380 5.614 0.214 4 0 "[ . 1]" 1
3917 1 70 LEU HB3 1 98 ALA MB 3.300 . 4.700 3.620 3.243 4.021 . 0 0 "[ . 1]" 1
3918 1 86 VAL MG2 1 99 GLY QA 3.800 . 5.600 3.418 2.992 3.612 . 0 0 "[ . 1]" 1
3919 1 85 VAL MG2 1 110 ILE HA 2.900 . 4.000 2.690 2.601 2.780 . 0 0 "[ . 1]" 1
3920 1 85 VAL MG2 1 86 VAL HA 3.200 . 4.500 4.072 3.766 4.284 . 0 0 "[ . 1]" 1
3921 1 85 VAL MG2 1 102 LEU MD1 2.600 . 3.400 2.526 2.208 2.942 . 0 0 "[ . 1]" 1
3922 1 42 LEU MD1 1 59 VAL MG2 2.800 . 3.800 2.891 1.926 3.554 . 0 0 "[ . 1]" 1
3923 1 42 LEU H 1 59 VAL MG2 3.400 . 4.800 3.569 3.199 3.855 . 0 0 "[ . 1]" 1
3924 1 27 PRO HB3 1 86 VAL MG2 3.800 . 5.600 4.889 4.656 5.089 . 0 0 "[ . 1]" 1
3925 1 24 MET HA 1 86 VAL MG2 4.600 . 6.000 4.987 4.892 5.051 . 0 0 "[ . 1]" 1
3926 1 45 VAL MG1 1 67 ARG HA 3.200 . 4.500 3.243 2.016 4.191 . 0 0 "[ . 1]" 1
3927 1 45 VAL MG1 1 65 MET HB2 2.400 . 3.100 2.703 2.169 3.053 . 0 0 "[ . 1]" 1
3928 1 45 VAL H 1 87 VAL MG2 3.900 . 5.800 4.912 4.767 4.973 . 0 0 "[ . 1]" 1
3929 1 43 ILE H 1 87 VAL MG1 2.900 . 4.000 2.838 2.755 2.887 . 0 0 "[ . 1]" 1
3930 1 45 VAL H 1 87 VAL MG1 3.400 . 4.900 4.142 4.018 4.287 . 0 0 "[ . 1]" 1
3931 1 23 VAL MG1 1 30 ALA MB 4.000 . 6.000 5.961 5.869 6.050 0.050 7 0 "[ . 1]" 1
3932 1 97 LEU HB3 1 97 LEU MD2 2.700 . 3.600 3.149 3.114 3.174 . 0 0 "[ . 1]" 1
3933 1 23 VAL MG1 1 24 MET HG3 4.600 . 6.000 5.443 5.195 5.760 . 0 0 "[ . 1]" 1
3934 1 18 ALA MB 1 97 LEU MD2 2.600 . 3.400 3.246 3.090 3.394 . 0 0 "[ . 1]" 1
3935 1 23 VAL MG1 1 24 MET ME 3.700 . 5.400 4.680 4.549 4.910 . 0 0 "[ . 1]" 1
3936 1 41 THR MG 1 42 LEU H 2.400 . 3.100 2.324 1.925 2.716 . 0 0 "[ . 1]" 1
3937 1 41 THR HB 1 41 THR MG 2.200 . 2.800 2.102 2.090 2.129 . 0 0 "[ . 1]" 1
3938 1 41 THR MG 1 43 ILE HG13 2.400 . 3.100 2.228 1.959 2.994 . 0 0 "[ . 1]" 1
3939 1 79 LEU HA 1 102 LEU MD2 4.700 . 6.000 5.985 5.801 6.072 0.072 1 0 "[ . 1]" 1
3940 1 100 LYS HG3 1 101 THR MG 3.300 . 4.700 3.794 2.866 4.367 . 0 0 "[ . 1]" 1
3941 1 85 VAL MG2 1 102 LEU MD2 3.100 . 4.300 2.994 2.920 3.062 . 0 0 "[ . 1]" 1
3942 1 74 LEU MD2 1 102 LEU MD2 2.000 . 2.500 1.722 1.569 1.967 . 0 0 "[ . 1]" 1
3943 1 72 PRO HB2 1 73 LEU MD2 2.700 . 3.600 2.750 2.544 2.913 . 0 0 "[ . 1]" 1
3944 1 74 LEU MD1 1 74 LEU MD2 1.900 . 2.300 1.721 1.573 1.998 . 0 0 "[ . 1]" 1
3945 1 74 LEU MD2 1 79 LEU MD2 3.000 . 4.100 3.571 2.789 4.054 . 0 0 "[ . 1]" 1
3946 1 27 PRO HB2 1 125 LEU MD2 2.100 . 2.700 2.172 1.945 2.428 . 0 0 "[ . 1]" 1
3947 1 74 LEU MD2 1 78 GLY HA2 3.900 . 5.800 5.658 5.529 5.758 . 0 0 "[ . 1]" 1
3948 1 70 LEU MD1 1 74 LEU MD2 2.400 . 3.100 2.384 2.052 2.814 . 0 0 "[ . 1]" 1
3949 1 41 THR HB 1 79 LEU MD2 2.900 . 4.000 3.228 2.812 3.725 . 0 0 "[ . 1]" 1
3950 1 34 LEU MD2 1 42 LEU HG 3.300 . 4.700 3.644 3.532 3.735 . 0 0 "[ . 1]" 1
3951 1 30 ALA MB 1 85 VAL MG1 3.800 . 5.600 5.663 5.607 5.726 0.126 2 0 "[ . 1]" 1
3952 1 34 LEU MD2 1 87 VAL HA 3.400 . 4.900 4.327 4.175 4.473 . 0 0 "[ . 1]" 1
3953 1 43 ILE H 1 86 VAL MG1 3.400 . 4.800 3.292 3.207 3.453 . 0 0 "[ . 1]" 1
3954 1 27 PRO HG3 1 86 VAL MG1 4.200 . 6.000 5.949 5.605 6.169 0.169 7 0 "[ . 1]" 1
3955 1 33 LEU HA 1 33 LEU MD1 2.400 . 3.100 3.078 2.956 3.164 0.064 9 0 "[ . 1]" 1
3956 1 41 THR MG 1 85 VAL MG1 2.000 . 2.500 2.020 1.958 2.057 . 0 0 "[ . 1]" 1
3957 1 70 LEU MD1 1 74 LEU MD1 2.500 . 3.300 2.121 1.779 2.890 . 0 0 "[ . 1]" 1
3958 1 48 PRO HB3 1 51 LEU MD2 3.600 . 5.200 3.668 2.264 4.179 . 0 0 "[ . 1]" 1
3959 1 33 LEU HB2 1 33 LEU MD1 1.900 . 2.400 1.831 1.766 1.885 . 0 0 "[ . 1]" 1
3960 1 30 ALA MB 1 86 VAL MG1 2.300 . 3.000 2.374 2.071 2.438 . 0 0 "[ . 1]" 1
3961 1 30 ALA MB 1 33 LEU MD1 2.600 . 3.500 2.571 2.310 2.703 . 0 0 "[ . 1]" 1
3962 1 25 LEU HA 1 86 VAL MG1 4.400 . 6.000 5.949 5.779 6.073 0.073 6 0 "[ . 1]" 1
3963 1 25 LEU HB3 1 86 VAL MG1 2.500 . 3.300 3.200 2.831 3.339 0.039 5 0 "[ . 1]" 1
3964 1 14 GLN HA 1 15 VAL MG2 3.400 . 4.900 4.457 4.048 4.770 . 0 0 "[ . 1]" 1
3965 1 15 VAL MG2 1 17 ALA MB 3.000 . 4.100 3.751 3.442 4.074 . 0 0 "[ . 1]" 1
3966 1 46 ARG HA 1 51 LEU MD1 2.800 . 3.800 3.549 3.336 3.772 . 0 0 "[ . 1]" 1
3967 1 74 LEU MD1 1 74 LEU MD2 2.300 . 3.000 1.886 1.719 1.993 . 0 0 "[ . 1]" 1
3968 1 97 LEU MD1 1 100 LYS HG2 3.100 . 4.300 3.473 3.306 3.616 . 0 0 "[ . 1]" 1
3969 1 97 LEU H 1 97 LEU MD1 3.300 . 4.700 3.525 3.352 3.628 . 0 0 "[ . 1]" 1
3970 1 6 LYS QE 1 6 LYS HG2 2.100 . 2.600 2.444 2.158 3.021 0.421 6 0 "[ . 1]" 1
3971 1 70 LEU MD1 1 74 LEU MD1 2.500 . 3.300 1.859 1.732 2.107 . 0 0 "[ . 1]" 1
3972 1 27 PRO HG2 1 125 LEU MD1 3.700 . 5.500 3.305 3.088 3.606 . 0 0 "[ . 1]" 1
3973 1 42 LEU MD2 1 62 TYR HA 3.900 . 5.800 3.778 3.533 3.964 . 0 0 "[ . 1]" 1
3974 1 34 LEU MD2 1 42 LEU MD2 3.200 . 4.500 2.834 2.682 2.945 . 0 0 "[ . 1]" 1
3975 1 56 LYS HD3 1 128 LEU QD 2.000 . 2.500 1.868 1.820 1.891 . 0 0 "[ . 1]" 1
3976 1 31 TYR HB3 1 42 LEU MD2 4.600 . 6.000 6.103 6.070 6.150 0.150 6 0 "[ . 1]" 1
3977 1 42 LEU MD1 1 88 PHE QD 3.800 . 5.600 3.255 3.052 3.479 . 0 0 "[ . 1]" 1
3978 1 42 LEU MD1 1 43 ILE H 3.500 . 5.000 2.783 2.393 2.970 . 0 0 "[ . 1]" 1
3979 1 74 LEU HB3 1 79 LEU MD1 3.300 . 4.700 4.309 3.619 5.090 0.390 3 0 "[ . 1]" 1
3980 1 34 LEU HB3 1 42 LEU MD1 3.900 . 5.800 3.944 3.786 4.239 . 0 0 "[ . 1]" 1
3981 1 77 SER HA 1 79 LEU MD1 4.300 . 6.000 4.935 4.324 5.711 . 0 0 "[ . 1]" 1
3982 1 40 ILE MG 1 42 LEU MD1 3.300 . 4.700 4.173 3.972 4.338 . 0 0 "[ . 1]" 1
3983 1 74 LEU MD2 1 79 LEU MD1 3.200 . 4.400 2.689 2.273 3.108 . 0 0 "[ . 1]" 1
3984 1 74 LEU MD1 1 102 LEU MD1 2.300 . 3.000 1.896 1.757 2.003 . 0 0 "[ . 1]" 1
3985 1 102 LEU HB2 1 102 LEU MD1 2.000 . 2.500 2.100 1.916 2.231 . 0 0 "[ . 1]" 1
3986 1 70 LEU MD2 1 74 LEU MD1 3.600 . 5.200 3.659 3.012 4.521 . 0 0 "[ . 1]" 1
3987 1 54 MET ME 1 121 LEU MD1 2.600 . 3.500 2.306 2.072 2.587 . 0 0 "[ . 1]" 1
3988 1 70 LEU HB3 1 70 LEU MD2 2.000 . 2.500 1.899 1.690 2.079 . 0 0 "[ . 1]" 1
3989 1 40 ILE HG13 1 84 PRO HD3 2.900 . 4.000 2.462 2.239 2.928 . 0 0 "[ . 1]" 1
3990 1 27 PRO HG3 1 125 LEU HG 4.000 . 6.000 6.040 6.017 6.077 0.077 10 0 "[ . 1]" 1
3991 1 65 MET HA 1 73 LEU MD1 3.000 . 4.100 2.895 2.234 3.259 . 0 0 "[ . 1]" 1
3992 1 41 THR MG 1 43 ILE HG13 2.200 . 2.800 1.823 1.781 1.881 . 0 0 "[ . 1]" 1
3993 1 30 ALA MB 1 34 LEU MD1 2.400 . 3.100 2.156 2.066 2.244 . 0 0 "[ . 1]" 1
3994 1 34 LEU MD1 1 34 LEU MD2 2.200 . 2.800 1.915 1.808 1.957 . 0 0 "[ . 1]" 1
3995 1 16 LYS QD 1 16 LYS QE 1.700 . 2.200 1.738 1.690 1.775 . 0 0 "[ . 1]" 1
3996 1 5 GLU QB 1 6 LYS QE 3.400 . 4.800 4.264 3.523 5.145 0.345 7 0 "[ . 1]" 1
3997 1 42 LEU MD2 1 56 LYS HD3 4.800 . 6.000 4.457 3.724 5.195 . 0 0 "[ . 1]" 1
3998 1 25 LEU HB3 1 27 PRO HB3 3.700 . 5.400 4.887 4.636 5.307 . 0 0 "[ . 1]" 1
3999 1 16 LYS QB 1 16 LYS HE3 3.900 . 5.800 2.528 1.954 3.217 0.046 1 0 "[ . 1]" 1
4000 1 53 ALA MB 1 54 MET HG2 3.000 . 4.100 2.733 2.216 3.120 . 0 0 "[ . 1]" 1
4001 1 53 ALA MB 1 54 MET HG3 3.200 . 4.500 2.265 1.975 2.985 . 0 0 "[ . 1]" 1
4002 1 43 ILE H 1 87 VAL HB 3.900 . 5.800 3.614 3.589 3.636 . 0 0 "[ . 1]" 1
4003 1 82 GLU HA 1 108 LYS HB2 3.200 . 4.400 3.051 2.300 4.145 . 0 0 "[ . 1]" 1
4004 1 24 MET ME 1 114 GLU HG3 2.200 . 2.800 2.577 2.190 2.991 0.191 4 0 "[ . 1]" 1
4005 1 40 ILE HB 1 61 ASN HB2 4.000 . 6.000 4.711 3.552 5.290 . 0 0 "[ . 1]" 1
4006 1 34 LEU MD2 1 40 ILE HB 2.700 . 3.600 2.412 2.283 2.742 . 0 0 "[ . 1]" 1
4007 1 49 ASP HA 1 49 ASP HB2 3.200 . 4.500 2.735 2.654 2.841 . 0 0 "[ . 1]" 1
4008 1 49 ASP HA 1 49 ASP HB3 3.400 . 4.900 2.908 2.822 2.979 . 0 0 "[ . 1]" 1
4009 1 58 ASP HA 1 58 ASP HB2 3.000 . 4.100 2.466 2.353 2.580 . 0 0 "[ . 1]" 1
4010 1 58 ASP HB3 1 126 PRO HA 2.700 . 3.600 2.307 2.230 2.454 . 0 0 "[ . 1]" 1
4011 1 18 ALA HA 1 21 ASP HB2 3.600 . 5.200 2.992 2.571 3.803 . 0 0 "[ . 1]" 1
4012 1 51 LEU HB3 1 56 LYS HG2 3.400 . 4.800 3.061 2.904 3.162 . 0 0 "[ . 1]" 1
4013 1 42 LEU HB2 1 42 LEU MD1 2.700 . 3.600 1.918 1.844 2.010 . 0 0 "[ . 1]" 1
4014 1 100 LYS HB2 1 103 ARG HD2 2.500 . 3.300 2.821 2.232 2.991 . 0 0 "[ . 1]" 1
4015 1 56 LYS HB2 1 57 PRO QD 3.100 . 4.300 1.910 1.693 2.091 0.207 10 0 "[ . 1]" 1
4016 1 86 VAL MG2 1 112 ASN HA 2.900 . 3.900 3.178 2.952 3.428 . 0 0 "[ . 1]" 1
4017 1 24 MET HA 1 24 MET ME 2.900 . 3.900 2.660 2.188 3.004 . 0 0 "[ . 1]" 1
4018 1 24 MET HA 1 24 MET HG2 3.800 . 5.600 2.456 2.084 3.264 . 0 0 "[ . 1]" 1
4019 1 51 LEU MD2 1 56 LYS HA 4.700 . 6.000 4.140 3.329 4.710 . 0 0 "[ . 1]" 1
4020 1 56 LYS HA 1 56 LYS HB2 2.900 . 4.000 2.516 2.337 2.682 . 0 0 "[ . 1]" 1
4021 1 98 ALA H 1 98 ALA HA 3.100 . 4.300 2.740 2.726 2.753 . 0 0 "[ . 1]" 1
4022 1 54 MET HA 1 55 GLY HA2 3.500 . 5.000 4.959 4.880 5.025 0.025 4 0 "[ . 1]" 1
4023 1 15 VAL MG1 1 18 ALA HA 4.100 . 6.000 5.924 5.665 6.080 0.080 8 0 "[ . 1]" 1
4024 1 41 THR MG 1 42 LEU HA 4.200 . 6.000 3.616 3.442 3.808 . 0 0 "[ . 1]" 1
4025 1 17 ALA HA 1 21 ASP HB2 3.800 . 5.600 2.984 2.566 3.795 . 0 0 "[ . 1]" 1
4026 1 95 ALA HA 1 98 ALA H 3.300 . 4.700 3.137 2.861 3.489 . 0 0 "[ . 1]" 1
4027 1 12 LYS HB3 1 13 ALA HA 2.400 . 3.100 2.844 2.668 3.077 . 0 0 "[ . 1]" 1
4028 1 63 LYS HA 1 63 LYS HE2 4.500 . 6.000 4.599 4.205 4.916 . 0 0 "[ . 1]" 1
4029 1 23 VAL MG2 1 111 TYR HA 3.700 . 5.400 3.514 3.218 3.670 . 0 0 "[ . 1]" 1
4030 1 25 LEU MD2 1 30 ALA HA 3.800 . 5.600 3.940 3.763 4.101 . 0 0 "[ . 1]" 1
4031 1 25 LEU MD1 1 30 ALA HA 2.500 . 3.300 2.098 1.932 2.303 . 0 0 "[ . 1]" 1
4032 1 49 ASP HA 1 49 ASP HB3 2.800 . 3.800 2.902 2.817 2.977 . 0 0 "[ . 1]" 1
4033 1 24 MET ME 1 26 SER HA 3.500 . 5.100 3.287 2.352 4.348 . 0 0 "[ . 1]" 1
4034 1 42 LEU H 1 62 TYR HA 2.400 . 3.100 2.122 2.038 2.217 . 0 0 "[ . 1]" 1
4035 1 58 ASP HA 1 127 SER HA 4.000 . 6.000 3.944 3.830 4.080 . 0 0 "[ . 1]" 1
4036 1 33 LEU HA 1 33 LEU HB2 2.500 . 3.300 2.509 2.368 2.586 . 0 0 "[ . 1]" 1
4037 1 24 MET ME 1 114 GLU HA 1.900 . 2.400 2.044 1.787 2.281 . 0 0 "[ . 1]" 1
4038 1 24 MET QB 1 114 GLU HA 3.600 . 5.300 4.388 3.912 5.036 . 0 0 "[ . 1]" 1
4039 1 40 ILE MD 1 85 VAL HA 3.200 . 4.400 2.891 2.834 2.934 . 0 0 "[ . 1]" 1
4040 1 7 PHE HA 1 7 PHE QD 3.400 . 4.800 3.433 3.233 3.570 . 0 0 "[ . 1]" 1
4041 1 65 MET HA 1 74 LEU HA 4.200 . 6.000 5.948 5.654 6.103 0.103 3 0 "[ . 1]" 1
4042 1 48 PRO HA 1 51 LEU HA 3.700 . 5.400 4.416 4.287 4.512 . 0 0 "[ . 1]" 1
4043 1 63 LYS HD2 1 74 LEU HA 3.300 . 4.600 3.022 2.600 3.292 . 0 0 "[ . 1]" 1
4044 1 51 LEU HA 1 55 GLY HA2 3.300 . 4.600 4.116 3.734 4.651 0.051 6 0 "[ . 1]" 1
4045 1 5 GLU HA 1 8 ASP QB 2.300 . 3.000 2.647 2.341 3.006 0.006 8 0 "[ . 1]" 1
4046 1 49 ASP HB3 1 50 GLU HA 2.600 . 3.400 3.035 2.646 3.412 0.012 8 0 "[ . 1]" 1
4047 1 85 VAL MG2 1 107 PHE HA 3.900 . 5.800 4.579 4.291 4.756 . 0 0 "[ . 1]" 1
4048 1 42 LEU HG 1 43 ILE HA 2.700 . 3.600 2.445 2.006 2.824 . 0 0 "[ . 1]" 1
4049 1 85 VAL MG2 1 110 ILE HA 2.700 . 3.600 2.522 2.466 2.594 . 0 0 "[ . 1]" 1
4050 1 86 VAL MG1 1 87 VAL HA 3.400 . 4.800 3.121 3.109 3.132 . 0 0 "[ . 1]" 1
4051 1 75 ALA MB 1 77 SER HA 3.200 . 4.400 4.277 4.078 4.410 0.010 8 0 "[ . 1]" 1
4052 1 63 LYS HB3 1 77 SER HA 3.500 . 5.100 4.694 4.409 5.102 0.002 3 0 "[ . 1]" 1
4053 1 43 ILE H 1 87 VAL HA 3.000 . 4.200 2.558 2.450 2.611 . 0 0 "[ . 1]" 1
4054 1 40 ILE MD 1 84 PRO HA 3.700 . 5.400 3.288 3.010 3.666 . 0 0 "[ . 1]" 1
4055 1 40 ILE HA 1 83 LYS HA 3.900 . 5.800 5.006 4.436 5.438 . 0 0 "[ . 1]" 1
4056 1 71 GLU HA 1 74 LEU MD1 3.900 . 5.800 4.336 3.666 5.167 . 0 0 "[ . 1]" 1
4057 1 84 PRO HA 1 108 LYS HA 4.200 . 6.000 4.469 4.378 4.743 . 0 0 "[ . 1]" 1
4058 1 26 SER HB2 1 27 PRO HB2 4.000 . 6.000 4.767 4.519 4.925 . 0 0 "[ . 1]" 1
4059 1 23 VAL HA 1 23 VAL MG2 2.000 . 2.500 1.997 1.891 2.138 . 0 0 "[ . 1]" 1
4060 1 31 TYR HA 1 31 TYR QE 3.300 . 4.600 2.893 2.620 3.069 . 0 0 "[ . 1]" 1
4061 1 81 PRO HA 1 107 PHE QD 3.200 . 4.500 3.021 2.813 3.330 . 0 0 "[ . 1]" 1
4062 1 63 LYS HA 1 77 SER QB 4.200 . 6.000 4.352 3.977 4.631 . 0 0 "[ . 1]" 1
4063 1 27 PRO HA 1 27 PRO HB2 2.600 . 3.400 2.204 1.914 2.571 . 0 0 "[ . 1]" 1
4064 1 15 VAL HA 1 17 ALA MB 2.800 . 3.800 2.985 2.808 3.231 . 0 0 "[ . 1]" 1
4065 1 41 THR HB 1 43 ILE HG13 4.300 . 6.000 3.421 2.608 3.985 . 0 0 "[ . 1]" 1
4066 1 41 THR HB 1 63 LYS HA 4.200 . 6.000 5.929 5.622 6.113 0.113 3 0 "[ . 1]" 1
4067 2 19 LYS HA 2 24 MET ME 2.600 . 3.400 3.424 3.401 3.458 0.058 4 0 "[ . 1]" 1
4068 2 33 LEU HA 2 40 ILE MD 4.200 . 6.000 3.256 3.095 3.418 . 0 0 "[ . 1]" 1
4069 2 37 ASN HA 2 40 ILE MD 4.600 . 6.000 4.472 4.329 4.675 . 0 0 "[ . 1]" 1
4070 2 41 THR HB 2 43 ILE MD 3.800 . 5.600 3.087 2.586 3.770 . 0 0 "[ . 1]" 1
4071 2 43 ILE MD 2 86 VAL H 3.600 . 5.200 4.111 3.508 4.837 . 0 0 "[ . 1]" 1
4072 2 41 THR MG 2 43 ILE MD 2.400 . 3.100 2.773 2.290 3.122 0.022 1 0 "[ . 1]" 1
4073 2 22 MET HB2 2 110 ILE MD 3.200 . 4.500 4.280 3.778 4.468 . 0 0 "[ . 1]" 1
4074 2 26 SER HA 2 30 ALA MB 3.100 . 4.300 3.774 3.554 4.020 . 0 0 "[ . 1]" 1
4075 2 43 ILE MG 2 45 VAL MG1 2.400 . 3.100 2.463 2.043 2.751 . 0 0 "[ . 1]" 1
4076 2 42 LEU HA 2 43 ILE MG 4.100 . 6.000 3.852 3.562 4.152 . 0 0 "[ . 1]" 1
4077 2 20 ALA MB 2 21 ASP HB3 3.900 . 5.800 4.551 4.233 5.007 . 0 0 "[ . 1]" 1
4078 2 45 VAL MG2 2 65 MET HB2 3.100 . 4.300 2.483 2.120 3.413 . 0 0 "[ . 1]" 1
4079 2 87 VAL HA 2 95 ALA MB 4.200 . 6.000 3.433 2.458 3.826 . 0 0 "[ . 1]" 1
4080 2 12 LYS HB3 2 13 ALA MB 2.800 . 3.800 3.732 3.604 3.823 0.023 10 0 "[ . 1]" 1
4081 2 17 ALA HA 2 17 ALA MB 1.900 . 2.300 1.878 1.864 1.895 . 0 0 "[ . 1]" 1
4082 2 45 VAL MG1 2 98 ALA MB 2.300 . 3.000 1.959 1.639 2.199 . 0 0 "[ . 1]" 1
4083 2 85 VAL MG2 2 99 GLY HA3 3.600 . 5.200 3.345 3.165 3.589 . 0 0 "[ . 1]" 1
4084 2 70 LEU HB3 2 98 ALA MB 3.300 . 4.700 3.702 3.323 3.907 . 0 0 "[ . 1]" 1
4085 2 86 VAL MG2 2 99 GLY QA 3.800 . 5.600 3.372 3.177 3.611 . 0 0 "[ . 1]" 1
4086 2 85 VAL MG2 2 110 ILE HA 2.900 . 4.000 2.603 2.519 2.761 . 0 0 "[ . 1]" 1
4087 2 85 VAL MG2 2 86 VAL HA 3.200 . 4.500 3.953 3.565 4.291 . 0 0 "[ . 1]" 1
4088 2 85 VAL MG2 2 102 LEU MD1 2.600 . 3.400 2.462 2.116 2.812 . 0 0 "[ . 1]" 1
4089 2 42 LEU MD1 2 59 VAL MG2 2.800 . 3.800 2.979 1.836 3.554 . 0 0 "[ . 1]" 1
4090 2 42 LEU H 2 59 VAL MG2 3.400 . 4.800 3.694 3.377 4.357 . 0 0 "[ . 1]" 1
4091 2 27 PRO HB3 2 86 VAL MG2 3.800 . 5.600 4.949 4.831 5.125 . 0 0 "[ . 1]" 1
4092 2 24 MET HA 2 86 VAL MG2 4.600 . 6.000 5.000 4.919 5.104 . 0 0 "[ . 1]" 1
4093 2 45 VAL MG1 2 67 ARG HA 3.200 . 4.500 3.281 1.915 4.248 . 0 0 "[ . 1]" 1
4094 2 45 VAL MG1 2 65 MET HB2 2.400 . 3.100 2.726 2.118 3.207 0.107 6 0 "[ . 1]" 1
4095 2 45 VAL H 2 87 VAL MG2 3.900 . 5.800 4.893 4.824 4.962 . 0 0 "[ . 1]" 1
4096 2 43 ILE H 2 87 VAL MG1 2.900 . 4.000 2.836 2.727 2.949 . 0 0 "[ . 1]" 1
4097 2 45 VAL H 2 87 VAL MG1 3.400 . 4.900 4.122 4.035 4.210 . 0 0 "[ . 1]" 1
4098 2 23 VAL MG1 2 30 ALA MB 4.000 . 6.000 5.930 5.777 6.045 0.045 6 0 "[ . 1]" 1
4099 1 97 LEU HB3 2 97 LEU MD2 2.700 . 3.600 3.148 3.109 3.167 . 0 0 "[ . 1]" 1
4100 2 23 VAL MG1 2 24 MET HG3 4.600 . 6.000 5.346 5.161 5.548 . 0 0 "[ . 1]" 1
4101 2 18 ALA MB 2 97 LEU MD2 2.500 . 3.300 3.010 2.748 3.318 0.018 5 0 "[ . 1]" 1
4102 2 23 VAL MG1 2 24 MET ME 3.700 . 5.400 4.670 4.493 4.823 . 0 0 "[ . 1]" 1
4103 2 41 THR MG 2 42 LEU H 2.400 . 3.100 2.224 2.001 2.612 . 0 0 "[ . 1]" 1
4104 2 41 THR HB 2 41 THR MG 2.200 . 2.800 2.104 2.092 2.123 . 0 0 "[ . 1]" 1
4105 2 41 THR MG 2 43 ILE HG13 2.400 . 3.100 2.073 1.669 3.028 0.031 2 0 "[ . 1]" 1
4106 2 85 VAL MG2 2 102 LEU MD2 3.100 . 4.300 2.972 2.849 3.022 . 0 0 "[ . 1]" 1
4107 2 74 LEU MD2 2 102 LEU MD2 2.000 . 2.500 1.676 1.572 1.813 . 0 0 "[ . 1]" 1
4108 2 72 PRO HB2 2 73 LEU MD2 2.700 . 3.600 2.784 2.391 3.567 . 0 0 "[ . 1]" 1
4109 2 74 LEU MD1 2 74 LEU MD2 1.900 . 2.300 1.655 1.529 1.809 . 0 0 "[ . 1]" 1
4110 2 74 LEU MD2 2 79 LEU MD2 3.000 . 4.100 3.834 3.293 4.095 . 0 0 "[ . 1]" 1
4111 2 27 PRO HB2 2 125 LEU MD2 2.100 . 2.700 2.425 2.144 2.706 0.006 10 0 "[ . 1]" 1
4112 2 74 LEU MD2 2 78 GLY HA2 3.800 . 5.600 5.689 5.498 5.784 0.184 4 0 "[ . 1]" 1
4113 2 70 LEU MD1 2 74 LEU MD2 2.400 . 3.100 2.155 1.966 2.351 . 0 0 "[ . 1]" 1
4114 2 41 THR HB 2 79 LEU MD2 2.900 . 4.000 2.790 2.478 3.290 . 0 0 "[ . 1]" 1
4115 2 34 LEU MD2 2 42 LEU HG 3.300 . 4.700 3.639 3.519 3.742 . 0 0 "[ . 1]" 1
4116 2 30 ALA MB 2 85 VAL MG1 3.700 . 5.500 5.586 5.552 5.625 0.125 1 0 "[ . 1]" 1
4117 2 34 LEU MD2 2 87 VAL HA 3.400 . 4.900 4.321 4.133 4.524 . 0 0 "[ . 1]" 1
4118 2 43 ILE H 2 86 VAL MG1 3.400 . 4.800 3.298 3.152 3.433 . 0 0 "[ . 1]" 1
4119 2 27 PRO HG3 2 86 VAL MG1 4.200 . 6.000 6.070 5.761 6.298 0.298 5 0 "[ . 1]" 1
4120 2 33 LEU HA 2 33 LEU MD1 2.400 . 3.100 3.109 2.960 3.165 0.065 1 0 "[ . 1]" 1
4121 2 41 THR MG 2 85 VAL MG1 2.000 . 2.500 2.010 1.891 2.068 . 0 0 "[ . 1]" 1
4122 2 70 LEU MD1 2 74 LEU MD1 2.500 . 3.300 1.929 1.698 2.185 0.002 6 0 "[ . 1]" 1
4123 2 48 PRO HB3 2 51 LEU MD2 3.600 . 5.200 3.686 3.363 4.089 . 0 0 "[ . 1]" 1
4124 2 33 LEU HB2 2 33 LEU MD1 1.900 . 2.400 1.795 1.742 1.858 . 0 0 "[ . 1]" 1
4125 2 30 ALA MB 2 86 VAL MG1 2.300 . 3.000 2.392 2.277 2.434 . 0 0 "[ . 1]" 1
4126 2 30 ALA MB 2 33 LEU MD1 2.600 . 3.500 2.344 1.746 2.650 . 0 0 "[ . 1]" 1
4127 2 25 LEU HA 2 86 VAL MG1 4.400 . 6.000 5.951 5.834 6.039 0.039 6 0 "[ . 1]" 1
4128 2 25 LEU HB3 2 86 VAL MG1 2.500 . 3.300 3.259 2.967 3.356 0.056 6 0 "[ . 1]" 1
4129 2 15 VAL MG2 2 17 ALA MB 2.900 . 3.900 3.576 3.436 3.737 . 0 0 "[ . 1]" 1
4130 2 46 ARG HA 2 51 LEU MD1 2.800 . 3.800 3.358 2.841 3.649 . 0 0 "[ . 1]" 1
4131 2 74 LEU MD1 2 74 LEU MD2 2.300 . 3.000 1.840 1.716 1.979 . 0 0 "[ . 1]" 1
4132 1 11 PHE QE 2 97 LEU MD1 3.300 . 4.600 3.537 3.327 3.639 . 0 0 "[ . 1]" 1
4133 2 6 LYS QE 2 6 LYS HG2 2.100 . 2.600 2.380 1.894 3.023 0.423 6 0 "[ . 1]" 1
4134 2 70 LEU MD1 2 74 LEU MD1 2.500 . 3.300 1.915 1.693 2.151 0.007 6 0 "[ . 1]" 1
4135 2 27 PRO HG2 2 125 LEU MD1 3.700 . 5.500 3.377 3.188 3.609 . 0 0 "[ . 1]" 1
4136 2 42 LEU MD2 2 62 TYR HA 3.900 . 5.800 3.712 3.226 4.083 . 0 0 "[ . 1]" 1
4137 2 34 LEU MD2 2 42 LEU MD2 3.200 . 4.500 2.822 2.657 2.976 . 0 0 "[ . 1]" 1
4138 2 56 LYS HD3 2 128 LEU MD1 2.000 . 2.500 2.085 2.067 2.112 . 0 0 "[ . 1]" 1
4139 2 31 TYR HB3 2 42 LEU MD2 4.600 . 6.000 6.192 6.069 6.892 0.892 7 1 "[ . + 1]" 1
4140 2 42 LEU MD1 2 88 PHE QD 3.800 . 5.600 3.246 3.183 3.464 . 0 0 "[ . 1]" 1
4141 2 42 LEU MD1 2 43 ILE H 3.500 . 5.000 2.842 2.493 3.072 . 0 0 "[ . 1]" 1
4142 2 34 LEU HB3 2 42 LEU MD1 3.900 . 5.800 3.962 3.825 4.130 . 0 0 "[ . 1]" 1
4143 2 77 SER HA 2 79 LEU MD1 4.300 . 6.000 4.671 4.392 4.824 . 0 0 "[ . 1]" 1
4144 2 40 ILE MG 2 42 LEU MD1 3.300 . 4.700 4.207 3.809 4.395 . 0 0 "[ . 1]" 1
4145 2 74 LEU MD2 2 79 LEU MD1 3.200 . 4.400 2.846 2.642 3.078 . 0 0 "[ . 1]" 1
4146 2 74 LEU MD1 2 102 LEU MD1 2.300 . 3.000 1.885 1.728 1.988 . 0 0 "[ . 1]" 1
4147 2 102 LEU HB2 2 102 LEU MD1 2.000 . 2.500 2.081 1.962 2.190 . 0 0 "[ . 1]" 1
4148 2 70 LEU MD2 2 74 LEU MD1 3.600 . 5.200 3.793 2.672 4.237 . 0 0 "[ . 1]" 1
4149 2 54 MET ME 2 121 LEU MD1 2.600 . 3.500 2.295 2.147 2.482 . 0 0 "[ . 1]" 1
4150 2 70 LEU HB3 2 70 LEU MD2 2.000 . 2.500 1.956 1.874 2.079 . 0 0 "[ . 1]" 1
4151 2 40 ILE HG13 2 84 PRO HD3 2.900 . 4.000 2.479 2.225 2.987 . 0 0 "[ . 1]" 1
4152 2 27 PRO HG3 2 125 LEU HG 4.000 . 6.000 6.042 5.978 6.070 0.070 5 0 "[ . 1]" 1
4153 2 65 MET HA 2 73 LEU MD1 3.000 . 4.100 2.746 2.130 3.481 . 0 0 "[ . 1]" 1
4154 2 41 THR MG 2 43 ILE HG13 2.200 . 2.800 1.825 1.769 1.892 . 0 0 "[ . 1]" 1
4155 2 30 ALA MB 2 34 LEU MD1 2.400 . 3.100 2.103 1.967 2.234 . 0 0 "[ . 1]" 1
4156 2 34 LEU MD1 2 34 LEU MD2 2.200 . 2.800 1.862 1.693 2.002 . 0 0 "[ . 1]" 1
4157 2 16 LYS QD 2 16 LYS QE 1.700 . 2.200 1.755 1.719 1.812 . 0 0 "[ . 1]" 1
4158 2 5 GLU QB 2 6 LYS QE 3.400 . 4.800 4.035 2.435 5.180 0.380 9 0 "[ . 1]" 1
4159 2 42 LEU MD2 2 56 LYS HD3 4.800 . 6.000 4.584 4.156 5.225 . 0 0 "[ . 1]" 1
4160 2 25 LEU HB3 2 27 PRO HB3 3.700 . 5.400 4.856 4.642 5.113 . 0 0 "[ . 1]" 1
4161 2 16 LYS QB 2 16 LYS HE3 3.900 . 5.800 2.175 1.493 2.970 0.507 1 1 "[+ . 1]" 1
4162 2 53 ALA MB 2 54 MET HG2 3.000 . 4.100 2.782 1.937 3.100 . 0 0 "[ . 1]" 1
4163 2 53 ALA MB 2 54 MET HG3 3.200 . 4.500 2.273 1.946 3.027 . 0 0 "[ . 1]" 1
4164 2 43 ILE H 2 87 VAL HB 3.900 . 5.800 3.605 3.581 3.617 . 0 0 "[ . 1]" 1
4165 2 82 GLU HA 2 108 LYS HB2 3.200 . 4.400 2.913 2.548 3.484 . 0 0 "[ . 1]" 1
4166 2 24 MET ME 2 114 GLU HG3 2.200 . 2.800 2.478 2.154 2.961 0.161 3 0 "[ . 1]" 1
4167 2 40 ILE HB 2 61 ASN HB2 4.000 . 6.000 4.406 3.281 4.879 . 0 0 "[ . 1]" 1
4168 2 34 LEU MD2 2 40 ILE HB 2.700 . 3.600 2.439 2.335 2.515 . 0 0 "[ . 1]" 1
4169 1 49 ASP HA 2 49 ASP QB 3.200 . 4.500 2.503 2.487 2.518 . 0 0 "[ . 1]" 1
4170 2 58 ASP HA 2 58 ASP HB2 3.000 . 4.100 2.447 2.382 2.531 . 0 0 "[ . 1]" 1
4171 2 58 ASP HB3 2 126 PRO HA 2.700 . 3.600 2.797 2.513 2.968 . 0 0 "[ . 1]" 1
4172 2 18 ALA HA 2 21 ASP HB2 3.600 . 5.200 3.261 2.914 3.708 . 0 0 "[ . 1]" 1
4173 2 51 LEU HB3 2 56 LYS HG2 3.400 . 4.800 3.059 2.829 3.143 . 0 0 "[ . 1]" 1
4174 2 42 LEU HB2 2 42 LEU MD1 2.700 . 3.600 1.874 1.800 1.966 . 0 0 "[ . 1]" 1
4175 2 100 LYS HB2 2 103 ARG HD2 2.500 . 3.300 2.717 2.181 2.985 . 0 0 "[ . 1]" 1
4176 2 56 LYS HB2 2 57 PRO QD 3.100 . 4.300 1.924 1.761 2.064 0.139 4 0 "[ . 1]" 1
4177 2 86 VAL MG2 2 112 ASN HA 2.900 . 3.900 3.217 3.009 3.374 . 0 0 "[ . 1]" 1
4178 2 24 MET HA 2 24 MET ME 2.900 . 3.900 2.535 2.121 3.204 . 0 0 "[ . 1]" 1
4179 2 24 MET HA 2 24 MET HG2 3.800 . 5.600 2.392 2.184 3.265 . 0 0 "[ . 1]" 1
4180 2 51 LEU MD2 2 56 LYS HA 4.700 . 6.000 4.055 3.529 4.447 . 0 0 "[ . 1]" 1
4181 2 56 LYS HA 2 56 LYS HB2 2.900 . 4.000 2.531 2.387 2.747 . 0 0 "[ . 1]" 1
4182 2 98 ALA H 2 98 ALA HA 3.100 . 4.300 2.737 2.721 2.756 . 0 0 "[ . 1]" 1
4183 2 54 MET HA 2 55 GLY HA2 3.500 . 5.000 4.954 4.775 5.053 0.053 2 0 "[ . 1]" 1
4184 2 41 THR MG 2 42 LEU HA 4.200 . 6.000 3.560 3.215 3.703 . 0 0 "[ . 1]" 1
4185 2 17 ALA HA 2 21 ASP HB2 3.800 . 5.600 3.246 2.903 3.726 . 0 0 "[ . 1]" 1
4186 2 95 ALA HA 2 98 ALA H 3.300 . 4.700 3.126 2.843 3.451 . 0 0 "[ . 1]" 1
4187 2 12 LYS HB3 2 13 ALA HA 2.400 . 3.100 2.784 2.603 3.043 . 0 0 "[ . 1]" 1
4188 2 63 LYS HA 2 63 LYS HE2 4.500 . 6.000 4.528 3.992 4.858 . 0 0 "[ . 1]" 1
4189 2 23 VAL MG2 2 111 TYR HA 3.700 . 5.400 3.448 3.235 3.642 . 0 0 "[ . 1]" 1
4190 2 25 LEU MD2 2 30 ALA HA 3.800 . 5.600 3.932 3.636 4.065 . 0 0 "[ . 1]" 1
4191 2 25 LEU MD1 2 30 ALA HA 2.500 . 3.300 2.102 1.962 2.249 . 0 0 "[ . 1]" 1
4192 2 24 MET ME 2 26 SER HA 3.500 . 5.100 3.255 2.084 4.619 . 0 0 "[ . 1]" 1
4193 2 42 LEU H 2 62 TYR HA 2.400 . 3.100 2.084 2.032 2.130 . 0 0 "[ . 1]" 1
4194 2 58 ASP HA 2 127 SER HA 4.000 . 6.000 3.938 3.818 4.081 . 0 0 "[ . 1]" 1
4195 2 33 LEU HA 2 33 LEU HB2 2.500 . 3.300 2.581 2.542 2.605 . 0 0 "[ . 1]" 1
4196 2 24 MET ME 2 114 GLU HA 1.900 . 2.400 2.049 1.897 2.267 . 0 0 "[ . 1]" 1
4197 2 24 MET QB 2 114 GLU HA 3.600 . 5.300 4.578 4.000 5.181 . 0 0 "[ . 1]" 1
4198 2 40 ILE MD 2 85 VAL HA 3.200 . 4.400 2.908 2.867 2.950 . 0 0 "[ . 1]" 1
4199 1 105 TYR QD 2 7 PHE HA 3.400 . 4.800 3.447 3.259 3.524 . 0 0 "[ . 1]" 1
4200 2 65 MET HA 2 74 LEU HA 4.200 . 6.000 5.921 5.381 6.127 0.127 1 0 "[ . 1]" 1
4201 2 48 PRO HA 2 51 LEU HA 3.700 . 5.400 4.394 4.301 4.509 . 0 0 "[ . 1]" 1
4202 2 63 LYS HD2 2 74 LEU HA 3.300 . 4.600 2.821 2.635 2.968 . 0 0 "[ . 1]" 1
4203 2 51 LEU HA 2 55 GLY HA2 3.300 . 4.600 4.166 3.796 4.625 0.025 3 0 "[ . 1]" 1
4204 2 5 GLU HA 2 8 ASP QB 2.300 . 3.000 2.644 2.366 3.035 0.035 1 0 "[ . 1]" 1
4205 1 49 ASP HB3 2 50 GLU HA 2.600 . 3.400 3.208 3.051 3.617 0.217 6 0 "[ . 1]" 1
4206 2 85 VAL MG2 2 107 PHE HA 3.900 . 5.800 4.499 4.262 4.664 . 0 0 "[ . 1]" 1
4207 2 42 LEU HG 2 43 ILE HA 2.700 . 3.600 2.317 2.074 2.768 . 0 0 "[ . 1]" 1
4208 2 85 VAL MG2 2 110 ILE HA 2.700 . 3.600 2.466 2.417 2.530 . 0 0 "[ . 1]" 1
4209 2 86 VAL MG1 2 87 VAL HA 3.400 . 4.800 3.116 3.104 3.131 . 0 0 "[ . 1]" 1
4210 2 63 LYS HB3 2 77 SER HA 3.500 . 5.100 4.329 3.976 4.688 . 0 0 "[ . 1]" 1
4211 2 43 ILE H 2 87 VAL HA 3.000 . 4.200 2.549 2.423 2.663 . 0 0 "[ . 1]" 1
4212 2 40 ILE MD 2 84 PRO HA 3.700 . 5.400 3.412 3.166 3.982 . 0 0 "[ . 1]" 1
4213 2 40 ILE HA 2 83 LYS HA 3.900 . 5.800 5.015 4.474 5.413 . 0 0 "[ . 1]" 1
4214 2 71 GLU HA 2 74 LEU MD1 3.900 . 5.800 4.169 3.498 4.581 . 0 0 "[ . 1]" 1
4215 2 84 PRO HA 2 108 LYS HA 4.200 . 6.000 4.389 4.264 4.496 . 0 0 "[ . 1]" 1
4216 2 26 SER HB2 2 27 PRO HB2 4.000 . 6.000 4.752 4.682 4.865 . 0 0 "[ . 1]" 1
4217 2 23 VAL HA 2 23 VAL MG2 2.000 . 2.500 2.040 1.875 2.202 . 0 0 "[ . 1]" 1
4218 2 31 TYR HA 2 31 TYR QE 3.300 . 4.600 2.861 2.722 3.061 . 0 0 "[ . 1]" 1
4219 1 7 PHE QE 2 81 PRO HA 3.200 . 4.500 2.967 2.824 3.178 . 0 0 "[ . 1]" 1
4220 2 63 LYS HA 2 77 SER QB 4.200 . 6.000 4.423 4.125 4.829 . 0 0 "[ . 1]" 1
4221 2 27 PRO HA 2 27 PRO HB2 2.600 . 3.400 2.187 2.001 2.353 . 0 0 "[ . 1]" 1
4222 2 15 VAL HA 2 17 ALA MB 2.800 . 3.800 2.991 2.800 3.182 . 0 0 "[ . 1]" 1
4223 2 41 THR HB 2 43 ILE HG13 4.300 . 6.000 3.653 3.254 4.065 . 0 0 "[ . 1]" 1
4224 2 41 THR HB 2 63 LYS HA 4.200 . 6.000 5.758 5.482 6.047 0.047 1 0 "[ . 1]" 1
4225 1 24 MET QB 1 24 MET ME 2.400 . 3.100 3.005 2.617 3.305 0.205 9 0 "[ . 1]" 1
4226 1 23 VAL MG2 1 24 MET ME 4.000 . 6.000 4.481 4.264 4.609 . 0 0 "[ . 1]" 1
4227 1 43 ILE MD 1 74 LEU MD2 2.500 . 3.300 2.933 2.551 3.137 . 0 0 "[ . 1]" 1
4228 1 43 ILE MD 1 44 ASP H 4.800 . 6.000 4.504 3.952 4.736 . 0 0 "[ . 1]" 1
4229 1 43 ILE MD 1 43 ILE HG13 2.200 . 2.800 2.087 2.067 2.112 . 0 0 "[ . 1]" 1
4230 1 43 ILE MD 1 79 LEU MD1 1.900 . 2.300 1.879 1.589 2.263 . 0 0 "[ . 1]" 1
4231 1 85 VAL HB 1 110 ILE MD 3.400 . 4.900 3.450 3.100 3.670 . 0 0 "[ . 1]" 1
4232 1 107 PHE HB2 1 110 ILE MD 3.500 . 5.100 3.213 2.819 3.485 . 0 0 "[ . 1]" 1
4233 1 33 LEU HA 1 40 ILE MG 3.900 . 5.800 2.914 2.228 3.471 . 0 0 "[ . 1]" 1
4234 1 29 ASP H 1 30 ALA MB 4.100 . 6.000 3.779 3.720 3.835 . 0 0 "[ . 1]" 1
4235 1 43 ILE MG 1 65 MET HB2 2.400 . 3.100 2.220 2.017 2.649 . 0 0 "[ . 1]" 1
4236 1 89 CYS H 1 95 ALA MB 3.600 . 5.200 3.637 3.409 3.887 . 0 0 "[ . 1]" 1
4237 1 95 ALA MB 1 98 ALA HA 3.200 . 4.400 4.208 3.785 4.374 . 0 0 "[ . 1]" 1
4238 1 20 ALA MB 1 21 ASP HB2 4.700 . 6.000 4.158 3.874 4.325 . 0 0 "[ . 1]" 1
4239 1 17 ALA H 1 20 ALA MB 4.100 . 6.000 4.015 3.848 4.422 . 0 0 "[ . 1]" 1
4240 1 19 LYS QB 1 96 ALA MB 3.300 . 4.600 3.782 3.272 4.107 . 0 0 "[ . 1]" 1
4241 1 96 ALA MB 1 98 ALA H 4.300 . 6.000 4.084 4.018 4.179 . 0 0 "[ . 1]" 1
4242 1 15 VAL MG1 1 96 ALA MB 3.300 . 4.700 4.106 3.890 4.345 . 0 0 "[ . 1]" 1
4243 1 21 ASP H 1 96 ALA MB 3.500 . 5.100 4.911 4.629 5.107 0.007 5 0 "[ . 1]" 1
4244 1 85 VAL MG2 1 111 TYR H 3.200 . 4.500 3.465 3.289 3.591 . 0 0 "[ . 1]" 1
4245 1 85 VAL MG2 1 99 GLY H 4.200 . 6.000 4.598 4.428 4.728 . 0 0 "[ . 1]" 1
4246 1 84 PRO HG3 1 85 VAL MG2 3.500 . 5.000 5.034 4.793 5.331 0.331 9 0 "[ . 1]" 1
4247 1 98 ALA H 1 98 ALA MB 2.400 . 3.100 2.034 1.992 2.107 . 0 0 "[ . 1]" 1
4248 1 23 VAL H 1 110 ILE MG 3.200 . 4.500 3.143 2.788 3.365 . 0 0 "[ . 1]" 1
4249 1 40 ILE HA 1 85 VAL MG2 5.000 . 6.000 4.039 3.944 4.300 . 0 0 "[ . 1]" 1
4250 1 42 LEU HB3 1 59 VAL MG2 3.000 . 4.100 2.810 2.609 3.126 . 0 0 "[ . 1]" 1
4251 1 31 TYR QE 1 59 VAL MG2 2.500 . 3.300 2.229 1.719 2.586 . 0 0 "[ . 1]" 1
4252 1 85 VAL MG2 1 86 VAL H 4.000 . 6.000 3.819 3.625 3.956 . 0 0 "[ . 1]" 1
4253 1 86 VAL MG2 1 99 GLY H 3.300 . 4.700 4.021 3.819 4.194 . 0 0 "[ . 1]" 1
4254 1 25 LEU HB3 1 86 VAL MG2 3.000 . 4.100 3.916 3.718 4.098 . 0 0 "[ . 1]" 1
4255 1 24 MET QB 1 86 VAL MG2 4.300 . 6.000 6.018 5.609 6.155 0.155 7 0 "[ . 1]" 1
4256 1 24 MET HG2 1 86 VAL MG2 4.000 . 6.000 5.581 5.306 6.100 0.100 4 0 "[ . 1]" 1
4257 1 10 THR H 1 10 THR MG 3.700 . 5.400 3.317 3.230 3.382 . 0 0 "[ . 1]" 1
4258 1 23 VAL MG2 1 24 MET H 3.800 . 5.600 4.005 3.937 4.063 . 0 0 "[ . 1]" 1
4259 1 23 VAL MG2 1 24 MET HG3 5.200 . 6.000 5.533 5.375 5.696 . 0 0 "[ . 1]" 1
4260 1 87 VAL MG1 1 100 LYS HA 4.200 . 6.000 6.066 6.028 6.100 0.100 2 0 "[ . 1]" 1
4261 1 25 LEU HB2 1 87 VAL MG1 3.800 . 5.600 5.465 5.348 5.586 . 0 0 "[ . 1]" 1
4262 1 22 MET HB2 1 87 VAL MG2 3.400 . 4.800 4.392 3.972 4.712 . 0 0 "[ . 1]" 1
4263 1 15 VAL MG1 1 16 LYS QE 3.700 . 5.400 5.297 5.085 5.497 0.097 4 0 "[ . 1]" 1
4264 1 15 VAL MG1 2 68 GLY H 4.100 . 6.000 4.659 4.403 4.842 . 0 0 "[ . 1]" 1
4265 1 15 VAL MG1 1 17 ALA H 3.700 . 5.400 3.924 3.824 4.128 . 0 0 "[ . 1]" 1
4266 1 97 LEU MD2 1 98 ALA H 4.600 . 6.000 4.171 4.118 4.281 . 0 0 "[ . 1]" 1
4267 1 15 VAL MG2 1 97 LEU MD2 3.300 . 4.600 4.470 4.291 4.601 0.001 7 0 "[ . 1]" 1
4268 1 18 ALA MB 1 97 LEU MD2 2.500 . 3.300 2.650 2.597 2.697 . 0 0 "[ . 1]" 1
4269 1 97 LEU HB2 1 97 LEU MD2 2.500 . 3.300 2.430 2.334 2.521 . 0 0 "[ . 1]" 1
4270 1 15 VAL MG1 1 16 LYS HG3 3.100 . 4.300 3.566 3.074 4.115 . 0 0 "[ . 1]" 1
4271 1 14 GLN HA 1 15 VAL MG1 3.300 . 4.700 4.446 4.170 4.642 . 0 0 "[ . 1]" 1
4272 1 25 LEU HG 1 109 THR MG 4.400 . 6.000 5.064 4.969 5.154 . 0 0 "[ . 1]" 1
4273 1 70 LEU HB3 1 101 THR MG 4.300 . 6.000 5.641 4.966 6.008 0.008 2 0 "[ . 1]" 1
4274 1 100 LYS HG3 1 101 THR MG 3.800 . 5.600 3.627 2.856 4.045 . 0 0 "[ . 1]" 1
4275 1 79 LEU MD1 1 102 LEU MD2 3.300 . 4.600 2.797 2.610 2.902 . 0 0 "[ . 1]" 1
4276 1 79 LEU HA 1 102 LEU MD2 5.000 . 6.000 5.369 5.158 5.585 . 0 0 "[ . 1]" 1
4277 1 102 LEU MD2 1 107 PHE QD 3.600 . 5.200 2.977 2.896 3.079 . 0 0 "[ . 1]" 1
4278 1 42 LEU MD1 1 59 VAL MG1 2.400 . 3.100 2.692 2.231 3.125 0.025 9 0 "[ . 1]" 1
4279 1 35 GLN H 1 59 VAL MG1 3.300 . 4.600 3.517 3.087 4.010 . 0 0 "[ . 1]" 1
4280 1 31 TYR QE 1 59 VAL MG1 2.200 . 2.800 1.977 1.848 2.108 . 0 0 "[ . 1]" 1
4281 1 30 ALA MB 1 59 VAL MG1 3.600 . 5.200 3.643 3.232 4.082 . 0 0 "[ . 1]" 1
4282 1 59 VAL MG1 1 60 LYS QB 4.000 . 6.000 4.332 4.091 4.657 . 0 0 "[ . 1]" 1
4283 1 31 TYR HB2 1 59 VAL MG1 4.200 . 6.000 3.301 2.982 3.531 . 0 0 "[ . 1]" 1
4284 1 59 VAL HB 1 59 VAL MG1 2.300 . 3.000 2.084 2.041 2.112 . 0 0 "[ . 1]" 1
4285 1 59 VAL MG1 1 60 LYS H 4.100 . 6.000 3.309 2.893 3.460 . 0 0 "[ . 1]" 1
4286 1 42 LEU HA 1 79 LEU MD2 4.500 . 6.000 4.890 4.459 5.172 . 0 0 "[ . 1]" 1
4287 1 40 ILE HA 1 79 LEU MD2 2.600 . 3.500 2.321 1.701 2.816 . 0 0 "[ . 1]" 1
4288 1 74 LEU HB3 1 74 LEU MD2 2.300 . 2.900 2.172 1.934 2.429 . 0 0 "[ . 1]" 1
4289 1 25 LEU HB2 1 25 LEU MD2 3.000 . 4.100 3.083 3.036 3.127 . 0 0 "[ . 1]" 1
4290 1 40 ILE MD 1 85 VAL MG1 2.800 . 3.800 3.547 3.214 3.820 0.020 8 0 "[ . 1]" 1
4291 1 85 VAL MG1 1 103 ARG HA 4.700 . 6.000 5.155 5.047 5.244 . 0 0 "[ . 1]" 1
4292 1 25 LEU HB2 1 86 VAL MG1 4.000 . 6.000 4.947 4.650 5.133 . 0 0 "[ . 1]" 1
4293 1 25 LEU HB3 1 86 VAL MG1 3.200 . 4.500 4.169 3.798 4.312 . 0 0 "[ . 1]" 1
4294 1 33 LEU MD1 1 36 GLU HA 5.300 . 6.000 5.891 5.326 6.245 0.245 2 0 "[ . 1]" 1
4295 1 33 LEU HB3 1 33 LEU MD1 2.700 . 3.600 2.587 2.472 2.795 . 0 0 "[ . 1]" 1
4296 1 33 LEU MD1 1 37 ASN H 3.600 . 5.200 4.952 4.719 5.160 . 0 0 "[ . 1]" 1
4297 1 30 ALA MB 1 33 LEU MD1 3.000 . 4.200 2.791 2.399 3.019 . 0 0 "[ . 1]" 1
4298 1 65 MET HA 1 70 LEU MD1 4.500 . 6.000 4.514 4.368 4.669 . 0 0 "[ . 1]" 1
4299 1 65 MET HB3 1 70 LEU MD1 2.900 . 3.900 2.663 2.144 3.380 . 0 0 "[ . 1]" 1
4300 1 33 LEU MD1 1 85 VAL H 4.800 . 6.000 5.592 5.269 5.834 . 0 0 "[ . 1]" 1
4301 1 34 LEU HB3 1 34 LEU MD2 2.400 . 3.100 2.164 2.051 2.278 . 0 0 "[ . 1]" 1
4302 1 15 VAL MG2 1 16 LYS HG3 3.700 . 5.400 4.949 4.717 5.362 . 0 0 "[ . 1]" 1
4303 1 48 PRO HB3 1 51 LEU MD1 4.900 . 6.000 5.088 4.269 5.538 . 0 0 "[ . 1]" 1
4304 1 74 LEU MD1 1 79 LEU HA 5.500 . 6.000 5.234 4.371 6.043 0.043 10 0 "[ . 1]" 1
4305 1 31 TYR QE 1 125 LEU MD1 3.700 . 5.500 3.658 3.319 3.826 . 0 0 "[ . 1]" 1
4306 1 42 LEU MD2 1 43 ILE HA 4.100 . 6.000 4.674 4.465 4.880 . 0 0 "[ . 1]" 1
4307 1 42 LEU MD2 1 45 VAL H 5.000 . 6.000 5.331 5.280 5.402 . 0 0 "[ . 1]" 1
4308 1 41 THR MG 1 42 LEU MD2 3.800 . 5.600 5.205 4.916 5.457 . 0 0 "[ . 1]" 1
4309 1 42 LEU MD2 1 44 ASP H 3.400 . 4.900 4.087 3.948 4.219 . 0 0 "[ . 1]" 1
4310 1 85 VAL MG2 1 102 LEU MD1 2.300 . 2.900 1.989 1.882 2.162 . 0 0 "[ . 1]" 1
4311 1 70 LEU MD2 1 74 LEU HB3 2.800 . 3.800 2.589 1.903 3.876 0.076 2 0 "[ . 1]" 1
4312 1 70 LEU MD2 1 74 LEU MD2 4.300 . 6.000 3.775 3.373 4.435 . 0 0 "[ . 1]" 1
4313 1 67 ARG HA 1 70 LEU MD2 3.500 . 5.000 4.613 3.479 5.058 0.058 6 0 "[ . 1]" 1
4314 1 27 PRO HB2 1 125 LEU HG 2.900 . 4.000 2.540 1.894 3.598 . 0 0 "[ . 1]" 1
4315 1 25 LEU HB2 1 25 LEU MD1 2.800 . 3.800 2.417 2.343 2.488 . 0 0 "[ . 1]" 1
4316 2 24 MET QB 2 24 MET ME 2.400 . 3.100 2.805 2.271 3.408 0.308 5 0 "[ . 1]" 1
4317 2 23 VAL MG2 2 24 MET ME 4.000 . 6.000 4.603 4.434 4.928 . 0 0 "[ . 1]" 1
4318 2 43 ILE MD 2 74 LEU MD2 2.500 . 3.300 2.893 2.119 3.132 . 0 0 "[ . 1]" 1
4319 2 43 ILE MD 2 44 ASP H 4.800 . 6.000 4.378 3.423 4.816 . 0 0 "[ . 1]" 1
4320 2 43 ILE MD 2 43 ILE HG13 2.200 . 2.800 2.091 2.063 2.118 . 0 0 "[ . 1]" 1
4321 2 43 ILE MD 2 79 LEU MD1 1.900 . 2.300 2.052 1.712 2.279 . 0 0 "[ . 1]" 1
4322 2 85 VAL HB 2 110 ILE MD 3.400 . 4.900 3.517 3.057 3.870 . 0 0 "[ . 1]" 1
4323 2 107 PHE HB2 2 110 ILE MD 3.500 . 5.100 3.134 3.002 3.274 . 0 0 "[ . 1]" 1
4324 2 33 LEU HA 2 40 ILE MG 3.900 . 5.800 2.865 2.442 3.573 . 0 0 "[ . 1]" 1
4325 2 29 ASP H 2 30 ALA MB 4.100 . 6.000 3.759 3.697 3.855 . 0 0 "[ . 1]" 1
4326 2 43 ILE MG 2 65 MET HB2 2.400 . 3.100 2.172 1.823 2.433 . 0 0 "[ . 1]" 1
4327 2 89 CYS H 2 95 ALA MB 3.600 . 5.200 3.550 3.313 3.948 . 0 0 "[ . 1]" 1
4328 2 95 ALA MB 2 98 ALA HA 3.200 . 4.400 4.243 3.754 4.455 0.055 8 0 "[ . 1]" 1
4329 2 20 ALA MB 2 21 ASP HB2 4.700 . 6.000 4.166 3.998 4.260 . 0 0 "[ . 1]" 1
4330 2 17 ALA H 2 20 ALA MB 4.100 . 6.000 3.816 3.723 3.961 . 0 0 "[ . 1]" 1
4331 2 19 LYS QB 2 96 ALA MB 3.300 . 4.600 3.412 2.879 3.908 . 0 0 "[ . 1]" 1
4332 2 96 ALA MB 2 98 ALA H 4.200 . 6.000 4.067 4.000 4.135 . 0 0 "[ . 1]" 1
4333 2 87 VAL MG2 2 96 ALA MB 3.200 . 4.500 4.315 4.191 4.498 . 0 0 "[ . 1]" 1
4334 2 21 ASP H 2 96 ALA MB 3.500 . 5.100 4.852 4.520 5.108 0.008 5 0 "[ . 1]" 1
4335 2 85 VAL MG2 2 111 TYR H 3.200 . 4.500 3.407 3.277 3.533 . 0 0 "[ . 1]" 1
4336 2 85 VAL MG2 2 99 GLY H 4.200 . 6.000 4.580 4.421 4.739 . 0 0 "[ . 1]" 1
4337 2 84 PRO HG3 2 85 VAL MG2 3.500 . 5.000 5.005 4.493 5.183 0.183 10 0 "[ . 1]" 1
4338 2 98 ALA H 2 98 ALA MB 2.400 . 3.100 2.050 1.955 2.114 . 0 0 "[ . 1]" 1
4339 2 23 VAL H 2 110 ILE MG 3.200 . 4.500 3.012 2.747 3.221 . 0 0 "[ . 1]" 1
4340 2 40 ILE HA 2 85 VAL MG2 5.000 . 6.000 4.059 3.868 4.187 . 0 0 "[ . 1]" 1
4341 2 42 LEU HB3 2 59 VAL MG2 3.000 . 4.100 2.850 2.419 3.255 . 0 0 "[ . 1]" 1
4342 2 31 TYR QE 2 59 VAL MG2 2.500 . 3.300 2.408 2.089 2.605 . 0 0 "[ . 1]" 1
4343 2 86 VAL MG2 2 99 GLY H 3.300 . 4.700 4.055 3.887 4.288 . 0 0 "[ . 1]" 1
4344 2 25 LEU HB3 2 86 VAL MG2 3.000 . 4.100 3.939 3.632 4.114 0.014 9 0 "[ . 1]" 1
4345 2 24 MET QB 2 86 VAL MG2 4.300 . 6.000 6.009 5.676 6.154 0.154 8 0 "[ . 1]" 1
4346 2 24 MET HG2 2 86 VAL MG2 4.000 . 6.000 5.641 5.456 5.805 . 0 0 "[ . 1]" 1
4347 2 10 THR H 2 10 THR MG 3.700 . 5.400 3.328 3.202 3.380 . 0 0 "[ . 1]" 1
4348 2 23 VAL MG2 2 24 MET H 3.800 . 5.600 4.019 3.992 4.041 . 0 0 "[ . 1]" 1
4349 2 23 VAL MG2 2 24 MET HG3 5.200 . 6.000 5.412 5.151 5.623 . 0 0 "[ . 1]" 1
4350 2 87 VAL MG1 2 100 LYS HA 4.200 . 6.000 6.047 6.016 6.093 0.093 10 0 "[ . 1]" 1
4351 2 25 LEU HB2 2 87 VAL MG1 3.800 . 5.600 5.483 5.274 5.620 0.020 5 0 "[ . 1]" 1
4352 2 22 MET HB2 2 87 VAL MG2 3.400 . 4.800 4.459 4.283 4.663 . 0 0 "[ . 1]" 1
4353 2 15 VAL MG1 2 16 LYS QE 3.600 . 5.300 5.124 4.580 5.406 0.106 4 0 "[ . 1]" 1
4354 2 15 VAL MG1 2 17 ALA H 3.700 . 5.400 4.025 3.809 4.131 . 0 0 "[ . 1]" 1
4355 2 97 LEU MD2 2 98 ALA H 4.500 . 6.000 4.186 4.109 4.245 . 0 0 "[ . 1]" 1
4356 2 96 ALA MB 2 97 LEU MD2 2.500 . 3.300 2.713 2.622 2.759 . 0 0 "[ . 1]" 1
4357 1 97 LEU HB2 2 97 LEU MD2 2.400 . 3.100 2.421 2.333 2.549 . 0 0 "[ . 1]" 1
4358 2 15 VAL MG1 2 16 LYS HG3 3.100 . 4.300 3.631 3.120 3.894 . 0 0 "[ . 1]" 1
4359 1 69 LYS HA 2 15 VAL MG1 3.300 . 4.700 4.754 4.460 4.910 0.210 7 0 "[ . 1]" 1
4360 2 25 LEU HG 2 109 THR MG 4.400 . 6.000 5.039 4.853 5.363 . 0 0 "[ . 1]" 1
4361 2 100 LYS HG3 2 101 THR MG 3.700 . 5.400 3.912 3.125 4.198 . 0 0 "[ . 1]" 1
4362 2 79 LEU MD1 2 102 LEU MD2 3.300 . 4.600 2.885 2.688 2.963 . 0 0 "[ . 1]" 1
4363 1 10 THR HB 2 102 LEU MD2 4.700 . 6.000 5.637 5.248 5.798 . 0 0 "[ . 1]" 1
4364 1 7 PHE QE 2 102 LEU MD2 3.600 . 5.200 2.927 2.759 3.115 . 0 0 "[ . 1]" 1
4365 2 42 LEU MD1 2 59 VAL MG1 2.400 . 3.100 2.633 2.203 3.140 0.040 4 0 "[ . 1]" 1
4366 2 35 GLN H 2 59 VAL MG1 3.300 . 4.600 3.440 3.096 3.842 . 0 0 "[ . 1]" 1
4367 2 31 TYR QE 2 59 VAL MG1 2.200 . 2.800 2.019 1.734 2.240 . 0 0 "[ . 1]" 1
4368 2 30 ALA MB 2 59 VAL MG1 3.600 . 5.200 3.793 3.385 4.215 . 0 0 "[ . 1]" 1
4369 2 59 VAL MG1 2 60 LYS QB 4.000 . 6.000 4.330 4.030 4.638 . 0 0 "[ . 1]" 1
4370 2 31 TYR HB2 2 59 VAL MG1 4.200 . 6.000 3.189 2.826 3.516 . 0 0 "[ . 1]" 1
4371 2 59 VAL HB 2 59 VAL MG1 2.300 . 3.000 2.083 2.060 2.106 . 0 0 "[ . 1]" 1
4372 2 59 VAL MG1 2 60 LYS H 4.100 . 6.000 3.353 2.992 3.543 . 0 0 "[ . 1]" 1
4373 2 42 LEU HA 2 79 LEU MD2 4.500 . 6.000 5.132 4.902 5.240 . 0 0 "[ . 1]" 1
4374 2 40 ILE HA 2 79 LEU MD2 2.600 . 3.500 2.359 2.018 2.607 . 0 0 "[ . 1]" 1
4375 2 74 LEU HB2 2 74 LEU MD2 2.300 . 2.900 2.423 2.146 2.644 . 0 0 "[ . 1]" 1
4376 2 25 LEU HB2 2 25 LEU MD2 3.000 . 4.100 3.093 3.070 3.122 . 0 0 "[ . 1]" 1
4377 2 40 ILE MD 2 85 VAL MG1 2.800 . 3.800 3.548 3.228 3.808 0.008 6 0 "[ . 1]" 1
4378 2 25 LEU HB2 2 86 VAL MG1 4.000 . 6.000 4.925 4.758 5.107 . 0 0 "[ . 1]" 1
4379 2 25 LEU HB3 2 86 VAL MG1 3.200 . 4.500 4.181 4.024 4.296 . 0 0 "[ . 1]" 1
4380 2 33 LEU MD1 2 36 GLU HA 5.100 . 6.000 6.036 5.959 6.129 0.129 7 0 "[ . 1]" 1
4381 2 33 LEU HB3 2 33 LEU MD1 2.700 . 3.600 2.590 2.309 2.784 . 0 0 "[ . 1]" 1
4382 1 7 PHE QD 2 70 LEU MD1 3.600 . 5.200 5.028 4.846 5.151 . 0 0 "[ . 1]" 1
4383 2 30 ALA MB 2 33 LEU MD1 3.000 . 4.200 2.500 1.757 2.926 0.043 1 0 "[ . 1]" 1
4384 2 65 MET HA 2 70 LEU MD1 4.400 . 6.000 4.578 4.265 4.928 . 0 0 "[ . 1]" 1
4385 2 65 MET HB3 2 70 LEU MD1 2.900 . 3.900 2.599 1.973 3.329 . 0 0 "[ . 1]" 1
4386 2 33 LEU MD1 2 85 VAL H 4.800 . 6.000 5.384 5.189 5.517 . 0 0 "[ . 1]" 1
4387 2 34 LEU HB3 2 34 LEU MD2 2.400 . 3.100 2.183 1.960 2.308 . 0 0 "[ . 1]" 1
4388 1 69 LYS HA 2 15 VAL MG2 3.500 . 5.100 4.693 4.163 5.177 0.077 9 0 "[ . 1]" 1
4389 2 15 VAL MG2 2 16 LYS HG3 3.500 . 5.000 4.897 4.621 5.052 0.052 6 0 "[ . 1]" 1
4390 2 48 PRO HB3 2 51 LEU MD1 4.900 . 6.000 4.941 4.392 5.362 . 0 0 "[ . 1]" 1
4391 1 4 GLY HA3 2 74 LEU MD1 5.500 . 6.000 5.668 5.302 6.033 0.033 9 0 "[ . 1]" 1
4392 2 31 TYR QE 2 125 LEU MD1 3.700 . 5.500 3.659 3.403 3.957 . 0 0 "[ . 1]" 1
4393 2 42 LEU MD2 2 43 ILE HA 4.100 . 6.000 4.654 4.229 4.899 . 0 0 "[ . 1]" 1
4394 2 42 LEU MD2 2 45 VAL H 5.000 . 6.000 5.334 5.272 5.380 . 0 0 "[ . 1]" 1
4395 2 41 THR MG 2 42 LEU MD2 3.800 . 5.600 5.116 4.937 5.318 . 0 0 "[ . 1]" 1
4396 2 42 LEU MD2 2 44 ASP H 3.400 . 4.900 4.036 3.519 4.266 . 0 0 "[ . 1]" 1
4397 2 85 VAL MG2 2 102 LEU MD1 2.300 . 2.900 1.966 1.866 2.062 . 0 0 "[ . 1]" 1
4398 2 70 LEU MD2 2 74 LEU HB2 2.800 . 3.800 2.779 2.283 3.844 0.044 5 0 "[ . 1]" 1
4399 2 70 LEU MD2 2 74 LEU MD2 4.300 . 6.000 4.214 3.184 4.752 . 0 0 "[ . 1]" 1
4400 2 67 ARG HA 2 70 LEU MD2 3.500 . 5.000 4.294 3.455 5.042 0.042 2 0 "[ . 1]" 1
4401 2 27 PRO HB2 2 125 LEU HG 2.900 . 4.000 2.687 2.268 3.102 . 0 0 "[ . 1]" 1
4402 2 25 LEU HB2 2 25 LEU MD1 2.800 . 3.800 2.434 2.308 2.510 . 0 0 "[ . 1]" 1
4403 1 86 VAL MG1 1 111 TYR HA 3.800 . 5.600 3.662 3.546 3.785 . 0 0 "[ . 1]" 1
4404 1 45 VAL MG2 1 62 TYR QE 4.300 . 6.000 4.654 4.059 5.019 . 0 0 "[ . 1]" 1
4405 1 51 LEU HG 1 62 TYR QE 3.900 . 5.800 3.925 3.569 4.342 . 0 0 "[ . 1]" 1
4406 1 120 TRP HD1 1 121 LEU HB3 4.600 . 6.000 5.739 5.513 5.858 . 0 0 "[ . 1]" 1
4407 1 55 GLY HA2 1 120 TRP HD1 4.700 . 6.000 5.578 5.037 6.094 0.094 3 0 "[ . 1]" 1
4408 1 33 LEU HB3 1 111 TYR QE 4.300 . 6.000 4.692 4.427 4.839 . 0 0 "[ . 1]" 1
4409 1 88 PHE QE 1 115 GLY HA3 4.800 . 6.000 3.995 3.570 4.267 . 0 0 "[ . 1]" 1
4410 1 42 LEU MD1 1 88 PHE QE 4.400 . 6.000 4.356 4.180 4.557 . 0 0 "[ . 1]" 1
4411 1 25 LEU MD2 1 111 TYR QE 3.500 . 5.000 3.795 3.361 4.319 . 0 0 "[ . 1]" 1
4412 1 25 LEU MD1 1 111 TYR QE 3.100 . 4.300 2.680 2.495 2.929 . 0 0 "[ . 1]" 1
4413 1 84 PRO HB2 1 111 TYR QE 3.300 . 4.600 2.709 2.410 3.163 . 0 0 "[ . 1]" 1
4414 1 25 LEU HB3 1 111 TYR QE 4.500 . 6.000 4.835 4.418 5.120 . 0 0 "[ . 1]" 1
4415 1 25 LEU HB2 1 111 TYR QE 4.300 . 6.000 4.849 4.683 5.162 . 0 0 "[ . 1]" 1
4416 1 40 ILE MD 1 111 TYR QE 3.000 . 4.200 3.081 2.678 3.304 . 0 0 "[ . 1]" 1
4417 1 23 VAL MG2 1 111 TYR QE 3.700 . 5.400 4.089 3.872 4.254 . 0 0 "[ . 1]" 1
4418 1 23 VAL HB 1 111 TYR QE 3.200 . 4.400 4.051 3.797 4.288 . 0 0 "[ . 1]" 1
4419 1 42 LEU HG 1 62 TYR QD 3.900 . 5.800 3.226 2.873 3.529 . 0 0 "[ . 1]" 1
4420 1 34 LEU MD2 1 62 TYR QD 4.600 . 6.000 4.330 4.021 4.655 . 0 0 "[ . 1]" 1
4421 1 56 LYS HB2 1 62 TYR QD 3.900 . 5.800 3.828 3.127 4.310 . 0 0 "[ . 1]" 1
4422 1 34 LEU MD1 1 62 TYR QD 4.400 . 6.000 5.033 4.642 5.393 . 0 0 "[ . 1]" 1
4423 1 42 LEU HB2 1 62 TYR QD 4.300 . 6.000 4.862 4.469 5.459 . 0 0 "[ . 1]" 1
4424 1 42 LEU HG 1 62 TYR QD 3.700 . 5.400 3.207 2.869 3.505 . 0 0 "[ . 1]" 1
4425 1 74 LEU MD1 2 7 PHE HZ 3.600 . 5.200 3.772 2.796 4.807 . 0 0 "[ . 1]" 1
4426 1 74 LEU HB3 2 7 PHE HZ 3.500 . 5.000 4.594 3.757 5.197 0.197 5 0 "[ . 1]" 1
4427 1 4 GLY HA3 1 7 PHE HZ 4.000 . 6.000 3.431 3.239 3.773 . 0 0 "[ . 1]" 1
4428 1 42 LEU HB2 1 120 TRP HH2 4.200 . 6.000 3.679 3.048 4.140 . 0 0 "[ . 1]" 1
4429 1 31 TYR QE 1 34 LEU HB3 2.700 . 3.600 3.214 2.908 3.443 . 0 0 "[ . 1]" 1
4430 1 31 TYR QE 1 59 VAL HB 3.500 . 5.100 3.337 2.430 4.045 . 0 0 "[ . 1]" 1
4431 1 31 TYR QE 1 35 GLN HA 4.100 . 6.000 4.509 4.216 4.806 . 0 0 "[ . 1]" 1
4432 1 31 TYR QE 1 59 VAL HB 3.500 . 5.100 3.158 2.418 3.699 . 0 0 "[ . 1]" 1
4433 1 42 LEU HG 1 88 PHE QD 3.800 . 5.600 4.690 4.332 5.172 . 0 0 "[ . 1]" 1
4434 1 34 LEU MD1 1 88 PHE QD 4.100 . 6.000 5.396 5.159 5.656 . 0 0 "[ . 1]" 1
4435 1 27 PRO HD3 1 88 PHE QD 4.000 . 6.000 4.309 4.242 4.371 . 0 0 "[ . 1]" 1
4436 1 42 LEU MD1 1 88 PHE QD 3.400 . 4.800 3.233 3.033 3.407 . 0 0 "[ . 1]" 1
4437 1 13 ALA MB 2 105 TYR QE 3.400 . 4.800 4.874 4.760 4.956 0.156 10 0 "[ . 1]" 1
4438 1 29 ASP HB2 1 111 TYR QD 5.000 . 6.000 5.777 5.010 6.382 0.382 5 0 "[ . 1]" 1
4439 1 85 VAL H 1 111 TYR QD 3.900 . 5.800 3.900 3.572 4.221 . 0 0 "[ . 1]" 1
4440 1 33 LEU HB3 1 111 TYR QD 3.800 . 5.600 5.558 5.402 5.668 0.068 5 0 "[ . 1]" 1
4441 1 9 ALA HA 2 105 TYR QE 4.700 . 6.000 5.484 5.393 5.570 . 0 0 "[ . 1]" 1
4442 1 42 LEU HG 1 111 TYR QD 5.100 . 6.000 5.583 5.403 5.656 . 0 0 "[ . 1]" 1
4443 1 25 LEU HA 1 111 TYR QD 4.400 . 6.000 4.951 4.783 5.214 . 0 0 "[ . 1]" 1
4444 1 85 VAL MG2 1 111 TYR QD 3.000 . 4.100 3.248 3.137 3.398 . 0 0 "[ . 1]" 1
4445 1 44 ASP HB2 1 64 HIS HD2 4.400 . 6.000 4.351 3.736 4.628 . 0 0 "[ . 1]" 1
4446 1 64 HIS HD2 1 65 MET HA 3.800 . 5.600 4.876 4.522 5.521 . 0 0 "[ . 1]" 1
4447 1 44 ASP HB3 1 64 HIS HD2 2.700 . 3.600 2.812 2.151 3.087 . 0 0 "[ . 1]" 1
4448 1 11 PHE HZ 1 15 VAL MG1 3.700 . 5.400 5.312 5.196 5.408 0.008 10 0 "[ . 1]" 1
4449 1 11 PHE HZ 1 14 GLN HB2 3.100 . 4.300 4.256 3.858 4.403 0.103 1 0 "[ . 1]" 1
4450 1 45 VAL MG1 2 11 PHE HZ 4.300 . 6.000 5.198 4.805 5.726 . 0 0 "[ . 1]" 1
4451 1 79 LEU MD1 2 11 PHE HZ 4.100 . 6.000 5.962 5.737 6.038 0.038 3 0 "[ . 1]" 1
4452 1 27 PRO HD3 1 120 TRP HZ3 3.800 . 5.600 3.862 3.590 4.118 . 0 0 "[ . 1]" 1
4453 1 25 LEU MD1 1 120 TRP HZ3 4.400 . 6.000 6.046 5.925 6.115 0.115 6 0 "[ . 1]" 1
4454 1 34 LEU HA 1 120 TRP HZ2 4.100 . 6.000 5.534 5.415 5.665 . 0 0 "[ . 1]" 1
4455 1 4 GLY HA3 2 107 PHE QE 4.200 . 6.000 4.681 4.238 5.041 . 0 0 "[ . 1]" 1
4456 1 81 PRO HA 1 107 PHE QE 3.500 . 5.100 3.259 2.930 3.767 . 0 0 "[ . 1]" 1
4457 1 74 LEU HA 1 107 PHE QE 4.300 . 6.000 4.758 4.280 5.265 . 0 0 "[ . 1]" 1
4458 1 70 LEU MD1 1 107 PHE QE 5.000 . 6.000 6.070 5.770 6.472 0.472 4 0 "[ . 1]" 1
4459 1 74 LEU MD2 1 107 PHE QE 3.100 . 4.300 3.074 2.958 3.328 . 0 0 "[ . 1]" 1
4460 1 30 ALA MB 1 31 TYR QD 3.000 . 4.100 3.374 2.991 3.819 . 0 0 "[ . 1]" 1
4461 1 31 TYR QD 1 34 LEU HB3 3.300 . 4.700 3.291 3.011 3.619 . 0 0 "[ . 1]" 1
4462 1 31 TYR QD 1 35 GLN HG3 3.800 . 5.600 3.670 3.486 3.828 . 0 0 "[ . 1]" 1
4463 1 31 TYR QD 1 32 LYS HB2 3.300 . 4.700 3.229 2.980 3.498 . 0 0 "[ . 1]" 1
4464 1 31 TYR QD 1 42 LEU MD1 4.700 . 6.000 4.981 4.843 5.113 . 0 0 "[ . 1]" 1
4465 1 28 LYS QB 1 31 TYR QD 3.800 . 5.600 4.827 4.464 5.262 . 0 0 "[ . 1]" 1
4466 1 70 LEU HB3 2 11 PHE QE 3.300 . 4.700 4.661 4.014 5.026 0.326 10 0 "[ . 1]" 1
4467 1 79 LEU MD1 2 11 PHE QE 4.100 . 6.000 5.134 4.946 5.239 . 0 0 "[ . 1]" 1
4468 1 70 LEU HG 2 11 PHE QE 2.600 . 3.500 3.359 3.211 3.468 . 0 0 "[ . 1]" 1
4469 1 10 THR MG 1 11 PHE QD 5.200 . 6.000 5.717 5.464 5.901 . 0 0 "[ . 1]" 1
4470 1 11 PHE QD 1 12 LYS HB3 4.600 . 6.000 5.479 5.188 5.662 . 0 0 "[ . 1]" 1
4471 1 6 LYS HB2 1 11 PHE QD 4.600 . 6.000 6.087 5.967 6.503 0.503 2 1 "[ + . 1]" 1
4472 1 70 LEU HB3 2 11 PHE QD 3.800 . 5.600 4.381 3.977 5.116 . 0 0 "[ . 1]" 1
4473 1 7 PHE HB3 1 11 PHE QD 3.100 . 4.300 3.842 3.683 4.270 . 0 0 "[ . 1]" 1
4474 1 8 ASP HB2 1 11 PHE QD 5.900 . 6.000 5.459 5.061 5.667 . 0 0 "[ . 1]" 1
4475 1 10 THR HB 2 105 TYR QD 2.500 . 3.300 2.739 2.665 2.783 . 0 0 "[ . 1]" 1
4476 1 74 LEU MD2 1 105 TYR QD 4.200 . 6.000 3.745 3.083 4.119 . 0 0 "[ . 1]" 1
4477 1 101 THR HA 1 105 TYR QD 3.700 . 5.400 4.673 4.519 4.926 . 0 0 "[ . 1]" 1
4478 1 6 LYS HD3 1 7 PHE QD 4.200 . 6.000 5.220 4.671 5.382 . 0 0 "[ . 1]" 1
4479 1 6 LYS HG2 1 7 PHE QD 4.200 . 6.000 5.631 3.209 6.215 0.215 1 0 "[ . 1]" 1
4480 1 3 MET HB3 1 7 PHE QD 3.100 . 4.300 3.096 2.448 4.110 . 0 0 "[ . 1]" 1
4481 1 4 GLY HA3 1 7 PHE QD 3.400 . 4.900 4.724 4.666 4.824 . 0 0 "[ . 1]" 1
4482 1 70 LEU MD1 2 7 PHE QD 4.200 . 6.000 4.765 3.860 5.387 . 0 0 "[ . 1]" 1
4483 1 74 LEU MD1 2 7 PHE QE 3.000 . 4.100 2.701 2.247 3.035 . 0 0 "[ . 1]" 1
4484 1 3 MET ME 1 7 PHE QE 4.200 . 6.000 4.160 3.808 4.798 . 0 0 "[ . 1]" 1
4485 1 3 MET ME 1 7 PHE QE 3.900 . 5.800 4.145 3.807 4.695 . 0 0 "[ . 1]" 1
4486 1 85 VAL HB 1 107 PHE QD 4.700 . 6.000 4.737 4.570 4.944 . 0 0 "[ . 1]" 1
4487 1 3 MET QB 1 7 PHE QE 2.800 . 3.800 2.753 2.175 3.799 . 0 0 "[ . 1]" 1
4488 1 74 LEU HA 2 7 PHE QE 3.800 . 5.600 4.016 3.765 4.403 . 0 0 "[ . 1]" 1
4489 1 7 PHE H 1 7 PHE QE 3.600 . 5.200 2.793 2.072 3.345 . 0 0 "[ . 1]" 1
4490 1 74 LEU H 2 7 PHE QE 4.800 . 6.000 4.994 4.650 5.145 . 0 0 "[ . 1]" 1
4491 1 105 TYR HA 1 107 PHE QD 3.600 . 5.200 4.648 4.424 4.811 . 0 0 "[ . 1]" 1
4492 1 81 PRO HD2 2 7 PHE QE 3.100 . 4.300 3.145 2.985 3.245 . 0 0 "[ . 1]" 1
4493 1 6 LYS HB2 1 7 PHE QE 3.400 . 4.900 4.148 3.714 4.480 . 0 0 "[ . 1]" 1
4494 1 4 GLY HA3 1 7 PHE QE 4.000 . 6.000 3.527 3.380 3.687 . 0 0 "[ . 1]" 1
4495 1 70 LEU MD1 2 7 PHE QE 4.800 . 6.000 4.348 3.979 4.628 . 0 0 "[ . 1]" 1
4496 1 81 PRO HA 1 107 PHE QD 3.000 . 4.100 3.019 2.812 3.326 . 0 0 "[ . 1]" 1
4497 1 5 GLU HG2 1 7 PHE QE 4.300 . 6.000 5.702 4.858 6.225 0.225 4 0 "[ . 1]" 1
4498 1 85 VAL MG2 1 107 PHE QD 2.800 . 3.800 2.138 1.837 2.447 . 0 0 "[ . 1]" 1
4499 1 79 LEU MD1 2 7 PHE QE 2.800 . 3.800 2.131 1.837 2.438 . 0 0 "[ . 1]" 1
4500 1 102 LEU HA 1 107 PHE QD 3.300 . 4.700 3.745 3.508 4.089 . 0 0 "[ . 1]" 1
4501 1 79 LEU MD2 1 107 PHE QD 3.800 . 5.600 4.043 3.728 4.607 . 0 0 "[ . 1]" 1
4502 1 79 LEU MD2 1 107 PHE QD 3.900 . 5.800 4.189 3.820 4.744 . 0 0 "[ . 1]" 1
4503 1 85 VAL MG1 1 108 LYS H 4.200 . 6.000 5.595 5.394 5.926 . 0 0 "[ . 1]" 1
4504 1 82 GLU QB 1 108 LYS H 4.000 . 6.000 4.989 4.708 5.256 . 0 0 "[ . 1]" 1
4505 1 47 ASP HA 1 64 HIS HE1 3.100 . 4.300 4.014 3.225 4.377 0.077 9 0 "[ . 1]" 1
4506 2 86 VAL MG1 2 111 TYR HA 3.800 . 5.600 3.644 3.568 3.729 . 0 0 "[ . 1]" 1
4507 2 45 VAL MG2 2 62 TYR QE 4.300 . 6.000 4.697 3.776 4.995 . 0 0 "[ . 1]" 1
4508 2 51 LEU HG 2 62 TYR QE 3.900 . 5.800 4.076 3.329 4.565 . 0 0 "[ . 1]" 1
4509 2 120 TRP HD1 2 121 LEU HB3 4.600 . 6.000 5.751 5.585 5.881 . 0 0 "[ . 1]" 1
4510 2 55 GLY HA2 2 120 TRP HD1 4.700 . 6.000 5.654 5.103 5.990 . 0 0 "[ . 1]" 1
4511 2 33 LEU HB3 2 111 TYR QE 4.300 . 6.000 4.638 4.503 4.750 . 0 0 "[ . 1]" 1
4512 2 88 PHE QE 2 115 GLY HA3 4.800 . 6.000 4.048 3.752 4.365 . 0 0 "[ . 1]" 1
4513 2 42 LEU MD1 2 88 PHE QE 4.400 . 6.000 4.339 4.202 4.480 . 0 0 "[ . 1]" 1
4514 2 25 LEU MD2 2 111 TYR QE 3.500 . 5.000 3.821 3.203 4.299 . 0 0 "[ . 1]" 1
4515 2 25 LEU MD1 2 111 TYR QE 3.100 . 4.300 2.679 2.550 2.771 . 0 0 "[ . 1]" 1
4516 2 84 PRO HB2 2 111 TYR QE 3.300 . 4.600 2.544 2.230 2.693 . 0 0 "[ . 1]" 1
4517 2 25 LEU HB3 2 111 TYR QE 4.500 . 6.000 4.820 4.659 4.913 . 0 0 "[ . 1]" 1
4518 2 25 LEU HB2 2 111 TYR QE 4.300 . 6.000 4.895 4.594 5.175 . 0 0 "[ . 1]" 1
4519 2 40 ILE MD 2 111 TYR QE 3.000 . 4.200 3.084 2.844 3.329 . 0 0 "[ . 1]" 1
4520 2 23 VAL MG2 2 111 TYR QE 3.700 . 5.400 3.943 3.545 4.222 . 0 0 "[ . 1]" 1
4521 2 23 VAL HB 2 111 TYR QE 3.200 . 4.400 3.941 3.677 4.129 . 0 0 "[ . 1]" 1
4522 2 42 LEU HG 2 62 TYR QD 3.900 . 5.800 3.182 2.850 3.522 . 0 0 "[ . 1]" 1
4523 2 34 LEU MD2 2 62 TYR QD 4.600 . 6.000 4.279 4.088 4.545 . 0 0 "[ . 1]" 1
4524 2 56 LYS HB2 2 62 TYR QD 3.900 . 5.800 3.972 3.647 4.373 . 0 0 "[ . 1]" 1
4525 2 34 LEU MD1 2 62 TYR QD 4.400 . 6.000 5.095 4.793 5.336 . 0 0 "[ . 1]" 1
4526 2 42 LEU HB2 2 62 TYR QD 4.300 . 6.000 4.898 4.513 5.382 . 0 0 "[ . 1]" 1
4527 2 42 LEU HG 2 62 TYR QD 3.700 . 5.400 3.167 2.846 3.475 . 0 0 "[ . 1]" 1
4528 1 7 PHE HZ 2 74 LEU MD1 3.600 . 5.200 4.287 3.862 4.768 . 0 0 "[ . 1]" 1
4529 1 7 PHE HZ 2 74 LEU HB2 3.500 . 5.000 4.768 3.674 5.242 0.242 2 0 "[ . 1]" 1
4530 1 7 PHE HZ 2 79 LEU HA 4.000 . 6.000 3.499 3.262 3.773 . 0 0 "[ . 1]" 1
4531 1 7 PHE HZ 2 74 LEU HG 4.200 . 6.000 3.755 3.483 4.208 . 0 0 "[ . 1]" 1
4532 2 31 TYR QE 2 34 LEU HB3 2.700 . 3.600 3.103 2.819 3.631 0.031 10 0 "[ . 1]" 1
4533 2 31 TYR QE 2 59 VAL HB 3.500 . 5.100 3.100 2.125 4.138 . 0 0 "[ . 1]" 1
4534 2 31 TYR QE 2 35 GLN HA 4.100 . 6.000 4.329 4.031 4.670 . 0 0 "[ . 1]" 1
4535 2 31 TYR QE 2 59 VAL HB 3.500 . 5.100 2.904 2.123 3.625 . 0 0 "[ . 1]" 1
4536 2 42 LEU HG 2 88 PHE QD 3.800 . 5.600 4.677 4.392 5.146 . 0 0 "[ . 1]" 1
4537 2 34 LEU MD1 2 88 PHE QD 4.100 . 6.000 5.368 5.311 5.430 . 0 0 "[ . 1]" 1
4538 2 27 PRO HD3 2 88 PHE QD 4.000 . 6.000 4.288 4.179 4.347 . 0 0 "[ . 1]" 1
4539 2 42 LEU MD1 2 88 PHE QD 3.400 . 4.800 3.221 3.164 3.401 . 0 0 "[ . 1]" 1
4540 1 105 TYR QE 2 13 ALA MB 3.400 . 4.800 4.897 4.811 4.966 0.166 6 0 "[ . 1]" 1
4541 2 29 ASP HB2 2 111 TYR QD 5.000 . 6.000 5.744 5.016 6.153 0.153 10 0 "[ . 1]" 1
4542 2 85 VAL H 2 111 TYR QD 3.700 . 5.400 3.857 3.647 4.166 . 0 0 "[ . 1]" 1
4543 2 33 LEU HB3 2 111 TYR QD 3.800 . 5.600 5.481 5.175 5.631 0.031 5 0 "[ . 1]" 1
4544 1 105 TYR QE 2 9 ALA HA 4.700 . 6.000 5.449 5.332 5.556 . 0 0 "[ . 1]" 1
4545 2 42 LEU HG 2 111 TYR QD 5.100 . 6.000 5.556 5.315 5.693 . 0 0 "[ . 1]" 1
4546 2 25 LEU HA 2 111 TYR QD 4.400 . 6.000 4.949 4.708 5.219 . 0 0 "[ . 1]" 1
4547 2 85 VAL MG2 2 111 TYR QD 3.000 . 4.100 3.140 2.829 3.283 . 0 0 "[ . 1]" 1
4548 2 44 ASP HB2 2 64 HIS HD2 4.400 . 6.000 4.347 4.144 4.663 . 0 0 "[ . 1]" 1
4549 2 64 HIS HD2 2 65 MET HA 3.800 . 5.600 4.929 4.558 5.531 . 0 0 "[ . 1]" 1
4550 2 44 ASP HB3 2 64 HIS HD2 2.700 . 3.600 2.956 2.762 3.093 . 0 0 "[ . 1]" 1
4551 1 11 PHE HZ 2 87 VAL MG2 3.700 . 5.400 5.265 5.123 5.419 0.019 1 0 "[ . 1]" 1
4552 1 11 PHE HZ 2 97 LEU HB3 3.100 . 4.300 4.172 3.695 4.406 0.106 2 0 "[ . 1]" 1
4553 1 11 PHE HZ 2 45 VAL MG1 4.300 . 6.000 5.243 4.930 5.679 . 0 0 "[ . 1]" 1
4554 1 11 PHE HZ 2 79 LEU MD1 4.000 . 6.000 5.930 5.751 6.044 0.044 1 0 "[ . 1]" 1
4555 2 27 PRO HD3 2 120 TRP HZ3 3.800 . 5.600 3.838 3.440 4.168 . 0 0 "[ . 1]" 1
4556 2 25 LEU MD1 2 120 TRP HZ3 4.400 . 6.000 6.040 6.004 6.092 0.092 7 0 "[ . 1]" 1
4557 2 34 LEU HA 2 120 TRP HZ2 4.100 . 6.000 5.536 5.447 5.697 . 0 0 "[ . 1]" 1
4558 1 107 PHE QE 2 4 GLY HA3 4.200 . 6.000 4.746 4.206 5.095 . 0 0 "[ . 1]" 1
4559 2 81 PRO HA 2 107 PHE QE 3.500 . 5.100 3.131 2.740 3.458 . 0 0 "[ . 1]" 1
4560 2 74 LEU HA 2 107 PHE QE 4.300 . 6.000 4.662 4.069 5.125 . 0 0 "[ . 1]" 1
4561 2 70 LEU MD1 2 107 PHE QE 5.000 . 6.000 5.942 5.665 6.069 0.069 10 0 "[ . 1]" 1
4562 2 74 LEU MD2 2 107 PHE QE 3.100 . 4.300 3.048 2.781 3.578 . 0 0 "[ . 1]" 1
4563 2 30 ALA MB 2 31 TYR QD 3.000 . 4.100 3.336 2.898 3.714 . 0 0 "[ . 1]" 1
4564 2 31 TYR QD 2 34 LEU HB3 3.300 . 4.700 3.223 2.960 3.602 . 0 0 "[ . 1]" 1
4565 2 31 TYR QD 2 35 GLN HG3 3.800 . 5.600 3.698 3.426 3.870 . 0 0 "[ . 1]" 1
4566 2 31 TYR QD 2 32 LYS HB2 3.300 . 4.700 3.164 2.936 3.477 . 0 0 "[ . 1]" 1
4567 2 31 TYR QD 2 42 LEU MD1 4.700 . 6.000 4.950 4.743 5.156 . 0 0 "[ . 1]" 1
4568 2 28 LYS QB 2 31 TYR QD 3.800 . 5.600 4.913 4.533 5.157 . 0 0 "[ . 1]" 1
4569 1 11 PHE QE 2 70 LEU HB3 3.300 . 4.700 4.465 4.066 4.742 0.042 3 0 "[ . 1]" 1
4570 1 11 PHE QE 2 79 LEU MD1 4.100 . 6.000 5.240 5.098 5.314 . 0 0 "[ . 1]" 1
4571 1 11 PHE QE 2 70 LEU HG 2.600 . 3.500 3.285 3.133 3.433 . 0 0 "[ . 1]" 1
4572 1 11 PHE QD 2 43 ILE MD 5.200 . 6.000 5.703 5.431 5.988 . 0 0 "[ . 1]" 1
4573 1 11 PHE QD 2 102 LEU HB3 4.600 . 6.000 5.434 5.271 5.643 . 0 0 "[ . 1]" 1
4574 1 11 PHE QD 2 70 LEU HB3 3.800 . 5.600 4.190 3.720 4.657 . 0 0 "[ . 1]" 1
4575 2 7 PHE HB3 2 11 PHE QD 3.100 . 4.300 3.855 3.592 4.304 0.004 7 0 "[ . 1]" 1
4576 2 8 ASP HB2 2 11 PHE QD 5.800 . 6.000 5.171 4.399 5.504 . 0 0 "[ . 1]" 1
4577 1 105 TYR QD 2 10 THR HB 2.500 . 3.300 2.739 2.659 2.793 . 0 0 "[ . 1]" 1
4578 2 74 LEU MD2 2 105 TYR QD 4.200 . 6.000 3.573 3.185 3.967 . 0 0 "[ . 1]" 1
4579 2 101 THR HA 2 105 TYR QD 3.700 . 5.400 4.769 4.526 4.975 . 0 0 "[ . 1]" 1
4580 1 7 PHE QD 2 102 LEU HG 4.200 . 6.000 5.249 4.981 5.472 . 0 0 "[ . 1]" 1
4581 1 7 PHE QD 2 79 LEU HG 4.200 . 6.000 5.631 3.851 6.312 0.312 5 0 "[ . 1]" 1
4582 1 7 PHE QD 2 74 LEU HB2 3.100 . 4.300 2.955 2.615 3.309 . 0 0 "[ . 1]" 1
4583 2 4 GLY HA3 2 7 PHE QD 3.400 . 4.900 4.711 4.583 4.819 . 0 0 "[ . 1]" 1
4584 1 7 PHE QD 2 70 LEU MD1 4.200 . 6.000 3.472 2.741 4.141 . 0 0 "[ . 1]" 1
4585 1 7 PHE QE 2 74 LEU MD1 3.000 . 4.100 2.851 2.670 3.058 . 0 0 "[ . 1]" 1
4586 2 3 MET ME 2 7 PHE QE 4.100 . 6.000 4.268 3.994 4.635 . 0 0 "[ . 1]" 1
4587 2 3 MET ME 2 7 PHE QE 3.900 . 5.800 4.260 3.980 4.652 . 0 0 "[ . 1]" 1
4588 2 85 VAL HB 2 107 PHE QD 4.700 . 6.000 4.687 4.414 4.920 . 0 0 "[ . 1]" 1
4589 1 7 PHE QE 2 74 LEU HB2 2.800 . 3.800 2.731 2.438 3.254 . 0 0 "[ . 1]" 1
4590 1 7 PHE QE 2 74 LEU HA 3.800 . 5.600 3.889 3.735 4.028 . 0 0 "[ . 1]" 1
4591 2 7 PHE H 2 7 PHE QE 3.600 . 5.200 2.778 2.382 3.213 . 0 0 "[ . 1]" 1
4592 1 7 PHE QE 2 74 LEU H 4.800 . 6.000 5.013 4.850 5.182 . 0 0 "[ . 1]" 1
4593 2 105 TYR HA 2 107 PHE QD 3.600 . 5.200 4.685 4.515 4.822 . 0 0 "[ . 1]" 1
4594 1 7 PHE QE 2 81 PRO HD2 3.100 . 4.300 3.016 2.762 3.255 . 0 0 "[ . 1]" 1
4595 2 6 LYS HB2 2 7 PHE QE 3.400 . 4.900 4.142 3.914 4.369 . 0 0 "[ . 1]" 1
4596 1 7 PHE QE 2 79 LEU HA 4.000 . 6.000 3.543 3.350 3.694 . 0 0 "[ . 1]" 1
4597 1 7 PHE QE 2 70 LEU MD1 4.800 . 6.000 3.184 2.521 4.119 . 0 0 "[ . 1]" 1
4598 1 7 PHE QE 2 81 PRO HA 3.000 . 4.100 2.965 2.822 3.175 . 0 0 "[ . 1]" 1
4599 1 7 PHE QE 2 82 GLU HG3 4.200 . 6.000 5.856 5.281 6.401 0.401 10 0 "[ . 1]" 1
4600 2 85 VAL MG2 2 107 PHE QD 2.800 . 3.800 2.044 1.921 2.252 . 0 0 "[ . 1]" 1
4601 1 7 PHE QE 2 79 LEU MD1 2.800 . 3.800 2.039 1.915 2.246 . 0 0 "[ . 1]" 1
4602 1 7 PHE QE 2 102 LEU HA 3.300 . 4.700 3.771 3.332 4.151 . 0 0 "[ . 1]" 1
4603 1 7 PHE QE 2 79 LEU MD2 3.800 . 5.600 4.270 4.019 4.420 . 0 0 "[ . 1]" 1
4604 1 7 PHE QE 2 79 LEU MD2 3.900 . 5.800 4.628 4.277 4.929 . 0 0 "[ . 1]" 1
4605 2 85 VAL MG1 2 108 LYS H 4.200 . 6.000 5.462 5.302 5.679 . 0 0 "[ . 1]" 1
4606 2 82 GLU QB 2 108 LYS H 3.900 . 5.900 4.926 4.661 5.303 . 0 0 "[ . 1]" 1
4607 2 47 ASP HA 2 64 HIS HE1 3.100 . 4.300 4.249 3.823 4.457 0.157 10 0 "[ . 1]" 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 196
_Distance_constraint_stats_list.Viol_count 131
_Distance_constraint_stats_list.Viol_total 93.855
_Distance_constraint_stats_list.Viol_max 0.341
_Distance_constraint_stats_list.Viol_rms 0.0251
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0048
_Distance_constraint_stats_list.Viol_average_violations_only 0.0716
_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 8 ASP 0.000 0.000 . 0 "[ . 1]"
1 9 ALA 0.000 0.000 . 0 "[ . 1]"
1 10 THR 0.000 0.000 . 0 "[ . 1]"
1 11 PHE 0.300 0.082 4 0 "[ . 1]"
1 12 LYS 0.000 0.000 . 0 "[ . 1]"
1 13 ALA 0.000 0.000 . 0 "[ . 1]"
1 14 GLN 0.000 0.000 . 0 "[ . 1]"
1 15 VAL 0.300 0.082 4 0 "[ . 1]"
1 16 LYS 0.000 0.000 . 0 "[ . 1]"
1 17 ALA 0.000 0.000 . 0 "[ . 1]"
1 18 ALA 0.000 0.000 . 0 "[ . 1]"
1 19 LYS 0.028 0.015 2 0 "[ . 1]"
1 21 ASP 0.000 0.000 . 0 "[ . 1]"
1 22 MET 0.028 0.015 2 0 "[ . 1]"
1 23 VAL 0.000 0.000 . 0 "[ . 1]"
1 24 MET 0.000 0.000 . 0 "[ . 1]"
1 25 LEU 0.000 0.000 . 0 "[ . 1]"
1 26 SER 0.000 0.000 . 0 "[ . 1]"
1 28 LYS 0.014 0.009 5 0 "[ . 1]"
1 29 ASP 0.000 0.000 . 0 "[ . 1]"
1 30 ALA 0.000 0.000 . 0 "[ . 1]"
1 31 TYR 0.000 0.000 . 0 "[ . 1]"
1 32 LYS 0.014 0.009 5 0 "[ . 1]"
1 37 ASN 0.000 0.000 . 0 "[ . 1]"
1 39 ASP 0.711 0.143 5 0 "[ . 1]"
1 41 THR 0.744 0.143 5 0 "[ . 1]"
1 47 ASP 0.000 0.000 . 0 "[ . 1]"
1 49 ASP 0.984 0.214 7 0 "[ . 1]"
1 50 GLU 0.000 0.000 . 0 "[ . 1]"
1 51 LEU 0.000 0.000 . 0 "[ . 1]"
1 52 LYS 0.000 0.000 . 0 "[ . 1]"
1 53 ALA 0.984 0.214 7 0 "[ . 1]"
1 54 MET 0.000 0.000 . 0 "[ . 1]"
1 55 GLY 0.000 0.000 . 0 "[ . 1]"
1 56 LYS 0.023 0.014 5 0 "[ . 1]"
1 58 ASP 0.023 0.014 5 0 "[ . 1]"
1 59 VAL 0.099 0.024 5 0 "[ . 1]"
1 61 ASN 0.033 0.022 8 0 "[ . 1]"
1 66 SER 0.000 0.000 . 0 "[ . 1]"
1 67 ARG 0.000 0.000 . 0 "[ . 1]"
1 68 GLY 0.989 0.341 4 0 "[ . 1]"
1 69 LYS 0.000 0.000 . 0 "[ . 1]"
1 70 LEU 0.000 0.000 . 0 "[ . 1]"
1 71 GLU 0.989 0.341 4 0 "[ . 1]"
1 73 LEU 0.000 0.000 . 0 "[ . 1]"
1 74 LEU 0.000 0.000 . 0 "[ . 1]"
1 75 ALA 0.000 0.000 . 0 "[ . 1]"
1 76 LYS 0.461 0.131 1 0 "[ . 1]"
1 77 SER 0.000 0.000 . 0 "[ . 1]"
1 79 LEU 0.461 0.131 1 0 "[ . 1]"
1 80 ASP 0.000 0.000 . 0 "[ . 1]"
1 82 GLU 0.000 0.000 . 0 "[ . 1]"
1 83 LYS 0.000 0.000 . 0 "[ . 1]"
1 89 CYS 0.000 0.000 . 0 "[ . 1]"
1 96 ALA 0.000 0.000 . 0 "[ . 1]"
1 97 LEU 0.217 0.076 9 0 "[ . 1]"
1 98 ALA 0.000 0.000 . 0 "[ . 1]"
1 99 GLY 0.000 0.000 . 0 "[ . 1]"
1 100 LYS 0.000 0.000 . 0 "[ . 1]"
1 101 THR 0.000 0.000 . 0 "[ . 1]"
1 102 LEU 0.000 0.000 . 0 "[ . 1]"
1 103 ARG 0.000 0.000 . 0 "[ . 1]"
1 104 GLU 0.000 0.000 . 0 "[ . 1]"
1 105 TYR 0.000 0.000 . 0 "[ . 1]"
1 106 GLY 0.000 0.000 . 0 "[ . 1]"
1 107 PHE 0.000 0.000 . 0 "[ . 1]"
1 110 ILE 0.000 0.000 . 0 "[ . 1]"
1 112 ASN 0.438 0.091 8 0 "[ . 1]"
1 113 SER 0.000 0.000 . 0 "[ . 1]"
1 114 GLU 0.340 0.091 8 0 "[ . 1]"
1 116 GLY 0.119 0.067 1 0 "[ . 1]"
1 117 MET 0.000 0.000 . 0 "[ . 1]"
1 118 ASP 0.370 0.088 1 0 "[ . 1]"
1 119 LYS 0.000 0.000 . 0 "[ . 1]"
1 120 TRP 0.099 0.024 5 0 "[ . 1]"
1 121 LEU 0.000 0.000 . 0 "[ . 1]"
1 122 GLU 0.370 0.088 1 0 "[ . 1]"
1 123 GLU 0.000 0.000 . 0 "[ . 1]"
1 124 GLY 0.000 0.000 . 0 "[ . 1]"
1 125 LEU 0.000 0.000 . 0 "[ . 1]"
1 127 SER 0.000 0.000 . 0 "[ . 1]"
1 128 LEU 0.000 0.000 . 0 "[ . 1]"
2 8 ASP 0.000 0.000 . 0 "[ . 1]"
2 9 ALA 0.000 0.000 . 0 "[ . 1]"
2 10 THR 0.000 0.000 . 0 "[ . 1]"
2 11 PHE 0.266 0.069 4 0 "[ . 1]"
2 12 LYS 0.000 0.000 . 0 "[ . 1]"
2 13 ALA 0.000 0.000 . 0 "[ . 1]"
2 14 GLN 0.000 0.000 . 0 "[ . 1]"
2 15 VAL 0.266 0.069 4 0 "[ . 1]"
2 16 LYS 0.000 0.000 . 0 "[ . 1]"
2 17 ALA 0.000 0.000 . 0 "[ . 1]"
2 18 ALA 0.000 0.000 . 0 "[ . 1]"
2 19 LYS 0.000 0.000 . 0 "[ . 1]"
2 21 ASP 0.000 0.000 . 0 "[ . 1]"
2 22 MET 0.000 0.000 . 0 "[ . 1]"
2 23 VAL 0.000 0.000 . 0 "[ . 1]"
2 24 MET 0.000 0.000 . 0 "[ . 1]"
2 25 LEU 0.000 0.000 . 0 "[ . 1]"
2 26 SER 0.000 0.000 . 0 "[ . 1]"
2 28 LYS 0.000 0.000 . 0 "[ . 1]"
2 29 ASP 0.000 0.000 . 0 "[ . 1]"
2 30 ALA 0.000 0.000 . 0 "[ . 1]"
2 31 TYR 0.000 0.000 . 0 "[ . 1]"
2 32 LYS 0.000 0.000 . 0 "[ . 1]"
2 37 ASN 0.000 0.000 . 0 "[ . 1]"
2 39 ASP 0.707 0.220 5 0 "[ . 1]"
2 41 THR 0.735 0.220 5 0 "[ . 1]"
2 47 ASP 0.000 0.000 . 0 "[ . 1]"
2 49 ASP 1.200 0.249 4 0 "[ . 1]"
2 50 GLU 0.000 0.000 . 0 "[ . 1]"
2 51 LEU 0.000 0.000 . 0 "[ . 1]"
2 52 LYS 0.000 0.000 . 0 "[ . 1]"
2 53 ALA 1.200 0.249 4 0 "[ . 1]"
2 54 MET 0.000 0.000 . 0 "[ . 1]"
2 55 GLY 0.000 0.000 . 0 "[ . 1]"
2 56 LYS 0.015 0.015 2 0 "[ . 1]"
2 58 ASP 0.015 0.015 2 0 "[ . 1]"
2 59 VAL 0.055 0.024 6 0 "[ . 1]"
2 61 ASN 0.027 0.027 2 0 "[ . 1]"
2 66 SER 0.000 0.000 . 0 "[ . 1]"
2 67 ARG 0.000 0.000 . 0 "[ . 1]"
2 68 GLY 1.130 0.329 2 0 "[ . 1]"
2 69 LYS 0.000 0.000 . 0 "[ . 1]"
2 70 LEU 0.000 0.000 . 0 "[ . 1]"
2 71 GLU 1.130 0.329 2 0 "[ . 1]"
2 73 LEU 0.000 0.000 . 0 "[ . 1]"
2 74 LEU 0.000 0.000 . 0 "[ . 1]"
2 75 ALA 0.000 0.000 . 0 "[ . 1]"
2 76 LYS 0.309 0.108 10 0 "[ . 1]"
2 77 SER 0.000 0.000 . 0 "[ . 1]"
2 79 LEU 0.309 0.108 10 0 "[ . 1]"
2 80 ASP 0.000 0.000 . 0 "[ . 1]"
2 82 GLU 0.000 0.000 . 0 "[ . 1]"
2 83 LYS 0.000 0.000 . 0 "[ . 1]"
2 89 CYS 0.000 0.000 . 0 "[ . 1]"
2 96 ALA 0.000 0.000 . 0 "[ . 1]"
2 97 LEU 0.225 0.091 9 0 "[ . 1]"
2 98 ALA 0.000 0.000 . 0 "[ . 1]"
2 99 GLY 0.000 0.000 . 0 "[ . 1]"
2 100 LYS 0.000 0.000 . 0 "[ . 1]"
2 101 THR 0.000 0.000 . 0 "[ . 1]"
2 102 LEU 0.000 0.000 . 0 "[ . 1]"
2 103 ARG 0.000 0.000 . 0 "[ . 1]"
2 104 GLU 0.000 0.000 . 0 "[ . 1]"
2 105 TYR 0.000 0.000 . 0 "[ . 1]"
2 106 GLY 0.000 0.000 . 0 "[ . 1]"
2 107 PHE 0.000 0.000 . 0 "[ . 1]"
2 110 ILE 0.000 0.000 . 0 "[ . 1]"
2 112 ASN 0.669 0.174 8 0 "[ . 1]"
2 113 SER 0.000 0.000 . 0 "[ . 1]"
2 114 GLU 0.488 0.174 8 0 "[ . 1]"
2 116 GLY 0.043 0.033 3 0 "[ . 1]"
2 117 MET 0.000 0.000 . 0 "[ . 1]"
2 118 ASP 0.396 0.130 4 0 "[ . 1]"
2 119 LYS 0.000 0.000 . 0 "[ . 1]"
2 120 TRP 0.055 0.024 6 0 "[ . 1]"
2 121 LEU 0.000 0.000 . 0 "[ . 1]"
2 122 GLU 0.396 0.130 4 0 "[ . 1]"
2 123 GLU 0.000 0.000 . 0 "[ . 1]"
2 124 GLY 0.000 0.000 . 0 "[ . 1]"
2 125 LEU 0.000 0.000 . 0 "[ . 1]"
2 127 SER 0.000 0.000 . 0 "[ . 1]"
2 128 LEU 0.000 0.000 . 0 "[ . 1]"
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 8 ASP H 1 10 THR H 6.000 . 6.000 4.201 4.056 4.308 . 0 0 "[ . 1]" 2
2 1 9 ALA H 1 10 THR H 6.000 . 6.000 2.704 2.506 2.827 . 0 0 "[ . 1]" 2
3 1 9 ALA H 1 11 PHE H 6.000 . 6.000 4.284 4.181 4.359 . 0 0 "[ . 1]" 2
4 1 9 ALA H 1 12 LYS H 6.000 . 6.000 4.916 4.731 5.206 . 0 0 "[ . 1]" 2
5 1 10 THR H 1 11 PHE H 6.000 . 6.000 2.683 2.562 2.741 . 0 0 "[ . 1]" 2
6 1 10 THR H 1 13 ALA H 6.000 . 6.000 4.646 4.571 4.698 . 0 0 "[ . 1]" 2
7 1 11 PHE H 1 14 GLN H 6.000 . 6.000 4.817 4.717 4.962 . 0 0 "[ . 1]" 2
8 1 11 PHE H 1 15 VAL H 6.000 . 6.000 6.030 5.998 6.082 0.082 4 0 "[ . 1]" 2
9 1 12 LYS H 1 14 GLN H 6.000 . 6.000 4.288 4.201 4.387 . 0 0 "[ . 1]" 2
10 1 12 LYS H 1 15 VAL H 6.000 . 6.000 4.906 4.740 5.008 . 0 0 "[ . 1]" 2
11 1 12 LYS H 1 16 LYS H 6.000 . 6.000 5.863 5.713 5.953 . 0 0 "[ . 1]" 2
12 1 13 ALA H 1 16 LYS H 6.000 . 6.000 4.671 4.600 4.765 . 0 0 "[ . 1]" 2
13 1 14 GLN H 1 17 ALA H 6.000 . 6.000 4.973 4.745 5.148 . 0 0 "[ . 1]" 2
14 1 18 ALA H 1 21 ASP H 6.000 . 6.000 4.935 4.667 5.389 . 0 0 "[ . 1]" 2
15 1 16 LYS H 1 19 LYS H 6.000 . 6.000 5.285 5.002 5.656 . 0 0 "[ . 1]" 2
16 1 17 ALA H 1 19 LYS H 6.000 . 6.000 4.275 4.058 4.551 . 0 0 "[ . 1]" 2
17 1 19 LYS H 1 22 MET H 6.000 . 6.000 5.737 5.529 6.015 0.015 2 0 "[ . 1]" 2
18 1 23 VAL H 1 110 ILE H 6.000 . 6.000 4.790 4.399 5.237 . 0 0 "[ . 1]" 2
19 1 23 VAL H 1 112 ASN H 6.000 . 6.000 3.937 3.299 4.390 . 0 0 "[ . 1]" 2
20 1 24 MET H 1 112 ASN H 6.000 . 6.000 4.561 4.433 4.686 . 0 0 "[ . 1]" 2
21 1 24 MET H 1 25 LEU H 6.000 . 6.000 4.377 4.258 4.515 . 0 0 "[ . 1]" 2
22 1 25 LEU H 1 113 SER H 6.000 . 6.000 4.828 4.759 4.900 . 0 0 "[ . 1]" 2
23 1 26 SER H 1 114 GLU H 6.000 . 6.000 4.562 4.425 4.693 . 0 0 "[ . 1]" 2
24 1 26 SER H 1 28 LYS H 6.000 . 6.000 5.059 4.796 5.609 . 0 0 "[ . 1]" 2
25 1 28 LYS H 1 31 TYR H 6.000 . 6.000 4.490 4.414 4.601 . 0 0 "[ . 1]" 2
26 1 28 LYS H 1 32 LYS H 6.000 . 6.000 5.897 5.789 6.009 0.009 5 0 "[ . 1]" 2
27 1 29 ASP H 1 32 LYS H 6.000 . 6.000 4.675 4.527 4.877 . 0 0 "[ . 1]" 2
28 1 30 ALA H 1 32 LYS H 6.000 . 6.000 3.882 3.721 4.242 . 0 0 "[ . 1]" 2
29 1 37 ASN H 1 39 ASP H 6.000 . 6.000 4.896 4.781 5.055 . 0 0 "[ . 1]" 2
30 1 39 ASP H 1 41 THR H 6.000 . 6.000 6.046 5.748 6.143 0.143 5 0 "[ . 1]" 2
31 1 41 THR H 1 61 ASN HD21 6.000 . 6.000 4.573 3.671 5.085 . 0 0 "[ . 1]" 2
32 1 41 THR H 1 61 ASN HD22 6.000 . 6.000 5.213 4.216 6.022 0.022 8 0 "[ . 1]" 2
33 1 47 ASP H 1 49 ASP H 6.000 . 6.000 5.295 5.086 5.604 . 0 0 "[ . 1]" 2
34 1 47 ASP H 1 51 LEU H 6.000 . 6.000 4.773 4.471 5.325 . 0 0 "[ . 1]" 2
35 1 49 ASP H 1 52 LYS H 6.000 . 6.000 4.584 4.464 4.740 . 0 0 "[ . 1]" 2
36 1 49 ASP H 1 53 ALA H 6.000 . 6.000 6.075 5.830 6.214 0.214 7 0 "[ . 1]" 2
37 1 50 GLU H 1 53 ALA H 6.000 . 6.000 4.674 4.520 4.759 . 0 0 "[ . 1]" 2
38 1 51 LEU H 1 52 LYS H 6.000 . 6.000 2.599 2.543 2.678 . 0 0 "[ . 1]" 2
39 1 51 LEU H 1 53 ALA H 6.000 . 6.000 4.044 3.846 4.194 . 0 0 "[ . 1]" 2
40 1 51 LEU H 1 54 MET H 6.000 . 6.000 4.795 4.636 4.940 . 0 0 "[ . 1]" 2
41 1 51 LEU H 1 55 GLY H 6.000 . 6.000 5.065 4.787 5.306 . 0 0 "[ . 1]" 2
42 1 52 LYS H 1 55 GLY H 6.000 . 6.000 4.621 4.438 4.811 . 0 0 "[ . 1]" 2
43 1 53 ALA H 1 55 GLY H 6.000 . 6.000 3.991 3.928 4.061 . 0 0 "[ . 1]" 2
44 1 56 LYS H 1 58 ASP H 6.000 . 6.000 5.797 5.487 6.014 0.014 5 0 "[ . 1]" 2
45 1 58 ASP H 1 59 VAL H 6.000 . 6.000 3.917 3.687 4.069 . 0 0 "[ . 1]" 2
46 1 59 VAL H 1 120 TRP HE1 6.000 . 6.000 5.887 5.584 6.024 0.024 5 0 "[ . 1]" 2
47 1 59 VAL H 1 61 ASN H 6.000 . 6.000 5.168 4.948 5.393 . 0 0 "[ . 1]" 2
48 1 66 SER H 1 67 ARG H 6.000 . 6.000 4.067 3.400 4.591 . 0 0 "[ . 1]" 2
49 1 67 ARG H 1 69 LYS H 6.000 . 6.000 4.453 2.988 5.928 . 0 0 "[ . 1]" 2
50 1 67 ARG H 1 70 LEU H 6.000 . 6.000 4.403 2.836 4.990 . 0 0 "[ . 1]" 2
51 1 68 GLY H 1 71 GLU H 6.000 . 6.000 5.306 4.150 6.341 0.341 4 0 "[ . 1]" 2
52 1 69 LYS H 1 70 LEU H 6.000 . 6.000 2.430 2.060 3.020 . 0 0 "[ . 1]" 2
53 1 69 LYS H 1 71 GLU H 6.000 . 6.000 3.822 2.800 5.087 . 0 0 "[ . 1]" 2
54 1 71 GLU H 1 73 LEU H 6.000 . 6.000 4.124 3.932 4.305 . 0 0 "[ . 1]" 2
55 1 71 GLU H 1 74 LEU H 6.000 . 6.000 4.867 4.728 4.990 . 0 0 "[ . 1]" 2
56 1 73 LEU H 1 75 ALA H 6.000 . 6.000 4.360 3.992 4.688 . 0 0 "[ . 1]" 2
57 1 74 LEU H 1 76 LYS H 6.000 . 6.000 3.860 3.701 4.098 . 0 0 "[ . 1]" 2
58 1 74 LEU H 1 77 SER H 6.000 . 6.000 4.952 4.740 5.174 . 0 0 "[ . 1]" 2
59 1 75 ALA H 1 77 SER H 6.000 . 6.000 4.141 3.935 4.396 . 0 0 "[ . 1]" 2
60 1 76 LYS H 1 79 LEU H 6.000 . 6.000 5.975 5.651 6.131 0.131 1 0 "[ . 1]" 2
61 1 77 SER H 1 79 LEU H 6.000 . 6.000 4.629 4.093 5.273 . 0 0 "[ . 1]" 2
62 1 79 LEU H 1 80 ASP H 6.000 . 6.000 4.485 4.359 4.651 . 0 0 "[ . 1]" 2
63 1 80 ASP H 1 82 GLU H 6.000 . 6.000 4.369 4.105 4.674 . 0 0 "[ . 1]" 2
64 1 80 ASP H 1 83 LYS H 6.000 . 6.000 4.101 3.763 4.383 . 0 0 "[ . 1]" 2
65 1 89 CYS H 1 117 MET H 6.000 . 6.000 4.345 3.594 5.076 . 0 0 "[ . 1]" 2
66 1 96 ALA H 1 100 LYS H 6.000 . 6.000 5.647 5.564 5.752 . 0 0 "[ . 1]" 2
67 1 96 ALA H 1 98 ALA H 6.000 . 6.000 4.154 3.912 4.442 . 0 0 "[ . 1]" 2
68 1 96 ALA H 1 99 GLY H 6.000 . 6.000 4.818 4.732 4.941 . 0 0 "[ . 1]" 2
69 1 97 LEU H 1 100 LYS H 6.000 . 6.000 4.861 4.727 4.942 . 0 0 "[ . 1]" 2
70 1 97 LEU H 1 99 GLY H 6.000 . 6.000 4.175 4.088 4.332 . 0 0 "[ . 1]" 2
71 1 98 ALA H 1 100 LYS H 6.000 . 6.000 4.314 4.218 4.403 . 0 0 "[ . 1]" 2
72 1 98 ALA H 1 101 THR H 6.000 . 6.000 4.973 4.820 5.139 . 0 0 "[ . 1]" 2
73 1 99 GLY H 1 101 THR H 6.000 . 6.000 4.078 3.923 4.304 . 0 0 "[ . 1]" 2
74 1 100 LYS H 1 103 ARG H 6.000 . 6.000 5.047 4.853 5.402 . 0 0 "[ . 1]" 2
75 1 102 LEU H 1 104 GLU H 6.000 . 6.000 3.949 3.741 4.253 . 0 0 "[ . 1]" 2
76 1 103 ARG H 1 107 PHE H 6.000 . 6.000 4.757 4.426 5.201 . 0 0 "[ . 1]" 2
77 1 104 GLU H 1 105 TYR H 6.000 . 6.000 2.541 2.435 2.685 . 0 0 "[ . 1]" 2
78 1 104 GLU H 1 106 GLY H 6.000 . 6.000 4.055 3.926 4.176 . 0 0 "[ . 1]" 2
79 1 104 GLU H 1 107 PHE H 6.000 . 6.000 4.917 4.697 5.539 . 0 0 "[ . 1]" 2
80 1 97 LEU H 1 112 ASN HD21 6.000 . 6.000 5.924 5.659 6.076 0.076 9 0 "[ . 1]" 2
81 1 97 LEU H 1 112 ASN HD22 6.000 . 6.000 4.962 4.628 5.536 . 0 0 "[ . 1]" 2
82 1 112 ASN H 1 114 GLU H 6.000 . 6.000 5.876 5.572 6.091 0.091 8 0 "[ . 1]" 2
83 1 114 GLU H 1 116 GLY H 6.000 . 6.000 5.568 4.575 6.067 0.067 1 0 "[ . 1]" 2
84 1 117 MET H 1 119 LYS H 6.000 . 6.000 4.140 3.912 4.430 . 0 0 "[ . 1]" 2
85 1 118 ASP H 1 121 LEU H 6.000 . 6.000 5.188 5.004 5.351 . 0 0 "[ . 1]" 2
86 1 118 ASP H 1 122 GLU H 6.000 . 6.000 6.034 5.982 6.088 0.088 1 0 "[ . 1]" 2
87 1 119 LYS H 1 121 LEU H 6.000 . 6.000 4.413 4.183 4.568 . 0 0 "[ . 1]" 2
88 1 119 LYS H 1 122 GLU H 6.000 . 6.000 4.597 4.457 4.754 . 0 0 "[ . 1]" 2
89 1 120 TRP HE1 1 127 SER H 6.000 . 6.000 4.514 4.342 4.719 . 0 0 "[ . 1]" 2
90 1 120 TRP HE1 1 128 LEU H 6.000 . 6.000 5.282 4.917 5.661 . 0 0 "[ . 1]" 2
91 1 120 TRP H 1 121 LEU H 6.000 . 6.000 2.782 2.705 2.801 . 0 0 "[ . 1]" 2
92 1 121 LEU H 1 123 GLU H 6.000 . 6.000 4.288 4.181 4.391 . 0 0 "[ . 1]" 2
93 1 121 LEU H 1 124 GLY H 6.000 . 6.000 5.234 4.973 5.689 . 0 0 "[ . 1]" 2
94 1 121 LEU H 1 125 LEU H 6.000 . 6.000 5.239 5.109 5.490 . 0 0 "[ . 1]" 2
95 1 122 GLU H 1 123 GLU H 6.000 . 6.000 2.713 2.665 2.755 . 0 0 "[ . 1]" 2
96 1 122 GLU H 1 124 GLY H 6.000 . 6.000 4.026 3.920 4.279 . 0 0 "[ . 1]" 2
97 1 122 GLU H 1 125 LEU H 6.000 . 6.000 5.220 5.031 5.463 . 0 0 "[ . 1]" 2
98 1 127 SER H 1 128 LEU H 6.000 . 6.000 4.420 4.385 4.465 . 0 0 "[ . 1]" 2
99 2 8 ASP H 2 10 THR H 6.000 . 6.000 4.205 4.087 4.299 . 0 0 "[ . 1]" 2
100 2 9 ALA H 2 10 THR H 6.000 . 6.000 2.711 2.544 2.822 . 0 0 "[ . 1]" 2
101 2 9 ALA H 2 11 PHE H 6.000 . 6.000 4.259 4.152 4.353 . 0 0 "[ . 1]" 2
102 2 9 ALA H 2 12 LYS H 6.000 . 6.000 4.942 4.698 5.234 . 0 0 "[ . 1]" 2
103 2 10 THR H 2 11 PHE H 6.000 . 6.000 2.671 2.578 2.766 . 0 0 "[ . 1]" 2
104 2 10 THR H 2 13 ALA H 6.000 . 6.000 4.702 4.531 4.855 . 0 0 "[ . 1]" 2
105 2 11 PHE H 2 14 GLN H 6.000 . 6.000 4.848 4.735 4.935 . 0 0 "[ . 1]" 2
106 2 11 PHE H 2 15 VAL H 6.000 . 6.000 5.996 5.816 6.069 0.069 4 0 "[ . 1]" 2
107 2 12 LYS H 2 14 GLN H 6.000 . 6.000 4.329 4.254 4.455 . 0 0 "[ . 1]" 2
108 2 12 LYS H 2 15 VAL H 6.000 . 6.000 4.861 4.793 4.924 . 0 0 "[ . 1]" 2
109 2 12 LYS H 2 16 LYS H 6.000 . 6.000 5.818 5.738 5.868 . 0 0 "[ . 1]" 2
110 2 13 ALA H 2 16 LYS H 6.000 . 6.000 4.572 4.475 4.629 . 0 0 "[ . 1]" 2
111 2 14 GLN H 2 17 ALA H 6.000 . 6.000 4.883 4.746 5.011 . 0 0 "[ . 1]" 2
112 2 18 ALA H 2 21 ASP H 6.000 . 6.000 4.938 4.748 5.316 . 0 0 "[ . 1]" 2
113 2 16 LYS H 2 19 LYS H 6.000 . 6.000 5.244 5.014 5.469 . 0 0 "[ . 1]" 2
114 2 17 ALA H 2 19 LYS H 6.000 . 6.000 4.351 4.172 4.675 . 0 0 "[ . 1]" 2
115 2 19 LYS H 2 22 MET H 6.000 . 6.000 5.681 5.458 5.970 . 0 0 "[ . 1]" 2
116 2 23 VAL H 2 110 ILE H 6.000 . 6.000 4.631 4.294 5.001 . 0 0 "[ . 1]" 2
117 2 23 VAL H 2 112 ASN H 6.000 . 6.000 3.973 3.461 4.560 . 0 0 "[ . 1]" 2
118 2 24 MET H 2 112 ASN H 6.000 . 6.000 4.517 4.319 4.727 . 0 0 "[ . 1]" 2
119 2 24 MET H 2 25 LEU H 6.000 . 6.000 4.355 4.278 4.433 . 0 0 "[ . 1]" 2
120 2 25 LEU H 2 113 SER H 6.000 . 6.000 4.874 4.762 4.949 . 0 0 "[ . 1]" 2
121 2 26 SER H 2 114 GLU H 6.000 . 6.000 4.576 4.193 4.884 . 0 0 "[ . 1]" 2
122 2 26 SER H 2 28 LYS H 6.000 . 6.000 4.914 4.513 5.122 . 0 0 "[ . 1]" 2
123 2 28 LYS H 2 31 TYR H 6.000 . 6.000 4.487 4.449 4.528 . 0 0 "[ . 1]" 2
124 2 28 LYS H 2 32 LYS H 6.000 . 6.000 5.840 5.778 5.884 . 0 0 "[ . 1]" 2
125 2 29 ASP H 2 32 LYS H 6.000 . 6.000 4.629 4.515 4.693 . 0 0 "[ . 1]" 2
126 2 30 ALA H 2 32 LYS H 6.000 . 6.000 3.834 3.766 3.891 . 0 0 "[ . 1]" 2
127 2 37 ASN H 2 39 ASP H 6.000 . 6.000 4.945 4.792 5.130 . 0 0 "[ . 1]" 2
128 2 39 ASP H 2 41 THR H 6.000 . 6.000 6.052 5.816 6.220 0.220 5 0 "[ . 1]" 2
129 2 41 THR H 2 61 ASN HD21 6.000 . 6.000 4.675 4.090 5.291 . 0 0 "[ . 1]" 2
130 2 41 THR H 2 61 ASN HD22 6.000 . 6.000 5.392 4.544 6.027 0.027 2 0 "[ . 1]" 2
131 2 47 ASP H 2 49 ASP H 6.000 . 6.000 5.385 4.947 5.511 . 0 0 "[ . 1]" 2
132 2 47 ASP H 2 51 LEU H 6.000 . 6.000 5.120 4.419 5.688 . 0 0 "[ . 1]" 2
133 2 49 ASP H 2 52 LYS H 6.000 . 6.000 4.558 4.415 4.780 . 0 0 "[ . 1]" 2
134 2 49 ASP H 2 53 ALA H 6.000 . 6.000 6.113 5.930 6.249 0.249 4 0 "[ . 1]" 2
135 2 50 GLU H 2 53 ALA H 6.000 . 6.000 4.728 4.583 4.802 . 0 0 "[ . 1]" 2
136 2 51 LEU H 2 52 LYS H 6.000 . 6.000 2.597 2.535 2.657 . 0 0 "[ . 1]" 2
137 2 51 LEU H 2 53 ALA H 6.000 . 6.000 4.071 3.928 4.172 . 0 0 "[ . 1]" 2
138 2 51 LEU H 2 54 MET H 6.000 . 6.000 4.801 4.665 4.925 . 0 0 "[ . 1]" 2
139 2 51 LEU H 2 55 GLY H 6.000 . 6.000 5.119 4.811 5.606 . 0 0 "[ . 1]" 2
140 2 52 LYS H 2 55 GLY H 6.000 . 6.000 4.649 4.365 4.933 . 0 0 "[ . 1]" 2
141 2 53 ALA H 2 55 GLY H 6.000 . 6.000 3.955 3.833 4.075 . 0 0 "[ . 1]" 2
142 2 56 LYS H 2 58 ASP H 6.000 . 6.000 5.712 5.553 6.015 0.015 2 0 "[ . 1]" 2
143 2 58 ASP H 2 59 VAL H 6.000 . 6.000 3.903 3.688 4.084 . 0 0 "[ . 1]" 2
144 2 59 VAL H 2 120 TRP HE1 6.000 . 6.000 5.875 5.586 6.024 0.024 6 0 "[ . 1]" 2
145 2 59 VAL H 2 61 ASN H 6.000 . 6.000 5.148 4.852 5.459 . 0 0 "[ . 1]" 2
146 2 66 SER H 2 67 ARG H 6.000 . 6.000 4.170 3.331 4.575 . 0 0 "[ . 1]" 2
147 2 67 ARG H 2 69 LYS H 6.000 . 6.000 4.253 3.500 5.044 . 0 0 "[ . 1]" 2
148 2 67 ARG H 2 70 LEU H 6.000 . 6.000 3.840 2.294 5.502 . 0 0 "[ . 1]" 2
149 2 68 GLY H 2 71 GLU H 6.000 . 6.000 5.237 4.170 6.329 0.329 2 0 "[ . 1]" 2
150 2 69 LYS H 2 70 LEU H 6.000 . 6.000 2.603 2.170 3.161 . 0 0 "[ . 1]" 2
151 2 69 LYS H 2 71 GLU H 6.000 . 6.000 3.945 2.801 5.252 . 0 0 "[ . 1]" 2
152 2 71 GLU H 2 73 LEU H 6.000 . 6.000 4.112 3.874 4.261 . 0 0 "[ . 1]" 2
153 2 71 GLU H 2 74 LEU H 6.000 . 6.000 4.967 4.528 5.595 . 0 0 "[ . 1]" 2
154 2 73 LEU H 2 75 ALA H 6.000 . 6.000 4.497 3.846 5.019 . 0 0 "[ . 1]" 2
155 2 74 LEU H 2 76 LYS H 6.000 . 6.000 3.935 3.764 4.128 . 0 0 "[ . 1]" 2
156 2 74 LEU H 2 77 SER H 6.000 . 6.000 5.009 4.728 5.311 . 0 0 "[ . 1]" 2
157 2 75 ALA H 2 77 SER H 6.000 . 6.000 4.195 4.017 4.345 . 0 0 "[ . 1]" 2
158 2 76 LYS H 2 79 LEU H 6.000 . 6.000 5.994 5.810 6.108 0.108 10 0 "[ . 1]" 2
159 2 77 SER H 2 79 LEU H 6.000 . 6.000 4.600 4.018 5.138 . 0 0 "[ . 1]" 2
160 2 79 LEU H 2 80 ASP H 6.000 . 6.000 4.482 4.349 4.599 . 0 0 "[ . 1]" 2
161 2 80 ASP H 2 82 GLU H 6.000 . 6.000 4.464 4.083 4.913 . 0 0 "[ . 1]" 2
162 2 80 ASP H 2 83 LYS H 6.000 . 6.000 4.146 3.906 4.448 . 0 0 "[ . 1]" 2
163 2 89 CYS H 2 117 MET H 6.000 . 6.000 4.598 3.978 5.624 . 0 0 "[ . 1]" 2
164 2 96 ALA H 2 100 LYS H 6.000 . 6.000 5.695 5.600 5.767 . 0 0 "[ . 1]" 2
165 2 96 ALA H 2 98 ALA H 6.000 . 6.000 4.127 3.923 4.384 . 0 0 "[ . 1]" 2
166 2 96 ALA H 2 99 GLY H 6.000 . 6.000 4.847 4.731 4.915 . 0 0 "[ . 1]" 2
167 2 97 LEU H 2 100 LYS H 6.000 . 6.000 4.791 4.652 4.916 . 0 0 "[ . 1]" 2
168 2 97 LEU H 2 99 GLY H 6.000 . 6.000 4.121 3.974 4.350 . 0 0 "[ . 1]" 2
169 2 98 ALA H 2 100 LYS H 6.000 . 6.000 4.264 4.094 4.475 . 0 0 "[ . 1]" 2
170 2 98 ALA H 2 101 THR H 6.000 . 6.000 4.999 4.809 5.165 . 0 0 "[ . 1]" 2
171 2 99 GLY H 2 101 THR H 6.000 . 6.000 4.104 3.848 4.325 . 0 0 "[ . 1]" 2
172 2 100 LYS H 2 103 ARG H 6.000 . 6.000 5.026 4.865 5.186 . 0 0 "[ . 1]" 2
173 2 102 LEU H 2 104 GLU H 6.000 . 6.000 3.939 3.777 4.122 . 0 0 "[ . 1]" 2
174 2 103 ARG H 2 107 PHE H 6.000 . 6.000 4.756 4.458 4.975 . 0 0 "[ . 1]" 2
175 2 104 GLU H 2 105 TYR H 6.000 . 6.000 2.574 2.495 2.639 . 0 0 "[ . 1]" 2
176 2 104 GLU H 2 106 GLY H 6.000 . 6.000 4.030 3.915 4.103 . 0 0 "[ . 1]" 2
177 2 104 GLU H 2 107 PHE H 6.000 . 6.000 4.854 4.593 5.308 . 0 0 "[ . 1]" 2
178 2 97 LEU H 2 112 ASN HD21 6.000 . 6.000 5.890 5.570 6.091 0.091 9 0 "[ . 1]" 2
179 2 97 LEU H 2 112 ASN HD22 6.000 . 6.000 4.816 4.459 5.115 . 0 0 "[ . 1]" 2
180 2 112 ASN H 2 114 GLU H 6.000 . 6.000 5.804 5.442 6.174 0.174 8 0 "[ . 1]" 2
181 2 114 GLU H 2 116 GLY H 6.000 . 6.000 5.413 4.884 6.033 0.033 3 0 "[ . 1]" 2
182 2 117 MET H 2 119 LYS H 6.000 . 6.000 4.099 3.928 4.201 . 0 0 "[ . 1]" 2
183 2 118 ASP H 2 121 LEU H 6.000 . 6.000 5.188 4.976 5.356 . 0 0 "[ . 1]" 2
184 2 118 ASP H 2 122 GLU H 6.000 . 6.000 6.035 5.967 6.130 0.130 4 0 "[ . 1]" 2
185 2 119 LYS H 2 121 LEU H 6.000 . 6.000 4.399 4.263 4.558 . 0 0 "[ . 1]" 2
186 2 119 LYS H 2 122 GLU H 6.000 . 6.000 4.591 4.523 4.744 . 0 0 "[ . 1]" 2
187 2 120 TRP HE1 2 127 SER H 6.000 . 6.000 4.583 4.257 4.979 . 0 0 "[ . 1]" 2
188 2 120 TRP HE1 2 128 LEU H 6.000 . 6.000 5.362 5.089 5.595 . 0 0 "[ . 1]" 2
189 2 120 TRP H 2 121 LEU H 6.000 . 6.000 2.783 2.750 2.825 . 0 0 "[ . 1]" 2
190 2 121 LEU H 2 123 GLU H 6.000 . 6.000 4.312 4.211 4.395 . 0 0 "[ . 1]" 2
191 2 121 LEU H 2 124 GLY H 6.000 . 6.000 5.235 4.969 5.418 . 0 0 "[ . 1]" 2
192 2 121 LEU H 2 125 LEU H 6.000 . 6.000 5.242 5.060 5.373 . 0 0 "[ . 1]" 2
193 2 122 GLU H 2 123 GLU H 6.000 . 6.000 2.727 2.687 2.756 . 0 0 "[ . 1]" 2
194 2 122 GLU H 2 124 GLY H 6.000 . 6.000 4.006 3.905 4.111 . 0 0 "[ . 1]" 2
195 2 122 GLU H 2 125 LEU H 6.000 . 6.000 5.205 5.091 5.361 . 0 0 "[ . 1]" 2
196 2 127 SER H 2 128 LEU H 6.000 . 6.000 4.409 4.329 4.439 . 0 0 "[ . 1]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 4
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_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 11 PHE 0.000 0.000 . 0 "[ . 1]"
1 12 LYS 0.000 0.000 . 0 "[ . 1]"
1 105 TYR 0.000 0.000 . 0 "[ . 1]"
2 11 PHE 0.000 0.000 . 0 "[ . 1]"
2 12 LYS 0.000 0.000 . 0 "[ . 1]"
2 105 TYR 0.000 0.000 . 0 "[ . 1]"
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 11 PHE H 2 105 TYR QE 4.000 . 6.000 3.407 2.792 3.790 . 0 0 "[ . 1]" 3
2 1 12 LYS H 2 105 TYR QE 4.000 . 6.000 5.267 4.766 5.738 . 0 0 "[ . 1]" 3
3 1 105 TYR QE 2 11 PHE H 4.000 . 6.000 3.509 2.922 3.911 . 0 0 "[ . 1]" 3
4 1 105 TYR QE 2 12 LYS H 4.000 . 6.000 5.386 4.737 5.696 . 0 0 "[ . 1]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 44
_Distance_constraint_stats_list.Viol_count 160
_Distance_constraint_stats_list.Viol_total 63.829
_Distance_constraint_stats_list.Viol_max 0.131
_Distance_constraint_stats_list.Viol_rms 0.0264
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0145
_Distance_constraint_stats_list.Viol_average_violations_only 0.0399
_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 23 VAL 0.269 0.057 4 0 "[ . 1]"
1 25 LEU 0.782 0.077 1 0 "[ . 1]"
1 41 THR 0.000 0.000 . 0 "[ . 1]"
1 42 LEU 0.054 0.020 5 0 "[ . 1]"
1 43 ILE 0.370 0.071 2 0 "[ . 1]"
1 44 ASP 1.468 0.131 5 0 "[ . 1]"
1 63 LYS 0.814 0.131 5 0 "[ . 1]"
1 65 MET 0.707 0.103 3 0 "[ . 1]"
1 85 VAL 0.010 0.010 10 0 "[ . 1]"
1 86 VAL 0.317 0.071 2 0 "[ . 1]"
1 87 VAL 0.555 0.084 5 0 "[ . 1]"
1 88 PHE 0.053 0.040 4 0 "[ . 1]"
1 109 THR 0.010 0.010 10 0 "[ . 1]"
1 111 TYR 0.555 0.084 5 0 "[ . 1]"
1 112 ASN 1.051 0.077 1 0 "[ . 1]"
2 23 VAL 0.389 0.061 3 0 "[ . 1]"
2 25 LEU 0.523 0.096 7 0 "[ . 1]"
2 41 THR 0.000 0.000 . 0 "[ . 1]"
2 42 LEU 0.000 0.000 . 0 "[ . 1]"
2 43 ILE 0.277 0.046 4 0 "[ . 1]"
2 44 ASP 1.199 0.120 9 0 "[ . 1]"
2 63 LYS 0.736 0.120 9 0 "[ . 1]"
2 65 MET 0.463 0.097 6 0 "[ . 1]"
2 85 VAL 0.110 0.098 5 0 "[ . 1]"
2 86 VAL 0.212 0.046 4 0 "[ . 1]"
2 87 VAL 0.377 0.058 5 0 "[ . 1]"
2 88 PHE 0.065 0.021 8 0 "[ . 1]"
2 109 THR 0.103 0.098 5 0 "[ . 1]"
2 111 TYR 0.384 0.058 5 0 "[ . 1]"
2 112 ASN 0.912 0.096 7 0 "[ . 1]"
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 25 LEU H 1 112 ASN O 1.800 . 2.300 1.788 1.750 1.829 0.050 1 0 "[ . 1]" 4
2 1 25 LEU N 1 112 ASN O 2.800 2.800 3.300 2.742 2.723 2.762 0.077 1 0 "[ . 1]" 4
3 1 23 VAL O 1 112 ASN H 1.800 . 2.300 1.838 1.783 1.956 0.017 4 0 "[ . 1]" 4
4 1 23 VAL O 1 112 ASN N 2.800 2.800 3.300 2.788 2.743 2.876 0.057 4 0 "[ . 1]" 4
5 1 85 VAL H 1 109 THR O 1.800 . 2.300 2.087 1.885 2.279 . 0 0 "[ . 1]" 4
6 1 85 VAL N 1 109 THR O 2.800 2.800 3.300 2.884 2.790 3.091 0.010 10 0 "[ . 1]" 4
7 1 85 VAL O 1 111 TYR H 1.800 . 2.300 1.944 1.878 2.034 . 0 0 "[ . 1]" 4
8 1 85 VAL O 1 111 TYR N 2.800 2.800 3.300 2.881 2.821 2.947 . 0 0 "[ . 1]" 4
9 1 87 VAL H 1 111 TYR O 1.800 . 2.300 1.810 1.757 1.900 0.043 2 0 "[ . 1]" 4
10 1 87 VAL N 1 111 TYR O 2.800 2.800 3.300 2.765 2.716 2.855 0.084 5 0 "[ . 1]" 4
11 1 41 THR O 1 86 VAL H 1.800 . 2.300 2.084 1.999 2.246 . 0 0 "[ . 1]" 4
12 1 41 THR O 1 86 VAL N 2.800 2.800 3.300 3.024 2.943 3.204 . 0 0 "[ . 1]" 4
13 1 43 ILE H 1 86 VAL O 1.800 . 2.300 1.817 1.750 1.890 0.050 2 0 "[ . 1]" 4
14 1 43 ILE N 1 86 VAL O 2.800 2.800 3.300 2.787 2.729 2.834 0.071 2 0 "[ . 1]" 4
15 1 43 ILE O 1 88 PHE H 1.800 . 2.300 1.991 1.787 2.286 0.013 4 0 "[ . 1]" 4
16 1 43 ILE O 1 88 PHE N 2.800 2.800 3.300 2.931 2.760 3.199 0.040 4 0 "[ . 1]" 4
17 1 42 LEU O 1 63 LYS H 1.800 . 2.300 2.015 1.804 2.302 0.002 3 0 "[ . 1]" 4
18 1 42 LEU O 1 63 LYS N 2.800 2.800 3.300 2.987 2.780 3.278 0.020 5 0 "[ . 1]" 4
19 1 44 ASP H 1 63 LYS O 1.800 . 2.300 2.375 2.341 2.431 0.131 5 0 "[ . 1]" 4
20 1 44 ASP N 1 63 LYS O 2.800 2.800 3.300 3.250 3.136 3.313 0.013 6 0 "[ . 1]" 4
21 1 44 ASP O 1 65 MET H 1.800 . 2.300 2.340 2.170 2.403 0.103 3 0 "[ . 1]" 4
22 1 44 ASP O 1 65 MET N 2.800 2.800 3.300 3.269 3.152 3.339 0.039 3 0 "[ . 1]" 4
23 2 25 LEU H 2 112 ASN O 1.800 . 2.300 1.821 1.722 1.889 0.078 7 0 "[ . 1]" 4
24 2 25 LEU N 2 112 ASN O 2.800 2.800 3.300 2.760 2.704 2.807 0.096 7 0 "[ . 1]" 4
25 2 23 VAL O 2 112 ASN H 1.800 . 2.300 1.824 1.781 1.870 0.019 2 0 "[ . 1]" 4
26 2 23 VAL O 2 112 ASN N 2.800 2.800 3.300 2.768 2.739 2.802 0.061 3 0 "[ . 1]" 4
27 2 85 VAL H 2 109 THR O 1.800 . 2.300 2.064 1.867 2.398 0.098 5 0 "[ . 1]" 4
28 2 85 VAL N 2 109 THR O 2.800 2.800 3.300 2.854 2.795 2.973 0.005 7 0 "[ . 1]" 4
29 2 85 VAL O 2 111 TYR H 1.800 . 2.300 1.917 1.847 2.010 . 0 0 "[ . 1]" 4
30 2 85 VAL O 2 111 TYR N 2.800 2.800 3.300 2.854 2.796 2.939 0.004 1 0 "[ . 1]" 4
31 2 87 VAL H 2 111 TYR O 1.800 . 2.300 1.815 1.785 1.891 0.015 5 0 "[ . 1]" 4
32 2 87 VAL N 2 111 TYR O 2.800 2.800 3.300 2.772 2.742 2.858 0.058 5 0 "[ . 1]" 4
33 2 41 THR O 2 86 VAL H 1.800 . 2.300 2.068 1.960 2.152 . 0 0 "[ . 1]" 4
34 2 41 THR O 2 86 VAL N 2.800 2.800 3.300 3.006 2.906 3.078 . 0 0 "[ . 1]" 4
35 2 43 ILE H 2 86 VAL O 1.800 . 2.300 1.836 1.789 1.935 0.011 4 0 "[ . 1]" 4
36 2 43 ILE N 2 86 VAL O 2.800 2.800 3.300 2.795 2.754 2.889 0.046 4 0 "[ . 1]" 4
37 2 43 ILE O 2 88 PHE H 1.800 . 2.300 2.024 1.816 2.321 0.021 8 0 "[ . 1]" 4
38 2 43 ILE O 2 88 PHE N 2.800 2.800 3.300 2.959 2.780 3.176 0.020 10 0 "[ . 1]" 4
39 2 42 LEU O 2 63 LYS H 1.800 . 2.300 2.003 1.880 2.179 . 0 0 "[ . 1]" 4
40 2 42 LEU O 2 63 LYS N 2.800 2.800 3.300 2.962 2.860 3.156 . 0 0 "[ . 1]" 4
41 2 44 ASP H 2 63 LYS O 1.800 . 2.300 2.370 2.292 2.420 0.120 9 0 "[ . 1]" 4
42 2 44 ASP N 2 63 LYS O 2.800 2.800 3.300 3.257 3.176 3.326 0.026 9 0 "[ . 1]" 4
43 2 44 ASP O 2 65 MET H 1.800 . 2.300 2.244 1.885 2.397 0.097 6 0 "[ . 1]" 4
44 2 44 ASP O 2 65 MET N 2.800 2.800 3.300 3.157 2.862 3.325 0.025 6 0 "[ . 1]" 4
stop_
save_
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