NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
643239 |
6uhw   |
30677 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6uhw
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 3658
_Distance_constraint_stats_list.Viol_count 6785
_Distance_constraint_stats_list.Viol_total 1059.256
_Distance_constraint_stats_list.Viol_max 0.140
_Distance_constraint_stats_list.Viol_rms 0.0032
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0078
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 1.079 0.036 2 0 "[ . 1 . 2]"
1 2 ASN 0.222 0.042 13 0 "[ . 1 . 2]"
1 3 ILE 1.006 0.025 17 0 "[ . 1 . 2]"
1 4 LEU 0.467 0.015 17 0 "[ . 1 . 2]"
1 5 TYR 0.615 0.019 12 0 "[ . 1 . 2]"
1 6 LYS 0.373 0.019 12 0 "[ . 1 . 2]"
1 7 THR 0.246 0.019 2 0 "[ . 1 . 2]"
1 8 ALA 0.039 0.007 20 0 "[ . 1 . 2]"
1 9 ALA 0.122 0.014 17 0 "[ . 1 . 2]"
1 10 THR 0.234 0.030 20 0 "[ . 1 . 2]"
1 11 SER 0.277 0.030 20 0 "[ . 1 . 2]"
1 12 THR 0.499 0.028 15 0 "[ . 1 . 2]"
1 13 GLY 0.138 0.012 12 0 "[ . 1 . 2]"
1 14 GLY 0.241 0.025 6 0 "[ . 1 . 2]"
1 15 ARG 0.013 0.013 9 0 "[ . 1 . 2]"
1 16 ASP 0.218 0.021 9 0 "[ . 1 . 2]"
1 17 GLY 0.444 0.025 6 0 "[ . 1 . 2]"
1 18 ARG 0.268 0.022 18 0 "[ . 1 . 2]"
1 19 ALA 0.134 0.016 6 0 "[ . 1 . 2]"
1 20 THR 0.680 0.023 8 0 "[ . 1 . 2]"
1 21 SER 0.118 0.012 4 0 "[ . 1 . 2]"
1 22 HIS 0.013 0.006 20 0 "[ . 1 . 2]"
1 23 ASP 0.115 0.014 17 0 "[ . 1 . 2]"
1 24 GLN 0.270 0.021 20 0 "[ . 1 . 2]"
1 25 LYS 0.246 0.035 16 0 "[ . 1 . 2]"
1 26 LEU 0.858 0.037 14 0 "[ . 1 . 2]"
1 27 ASP 0.220 0.037 14 0 "[ . 1 . 2]"
1 28 VAL 0.610 0.022 8 0 "[ . 1 . 2]"
1 29 LYS 0.777 0.024 13 0 "[ . 1 . 2]"
1 30 LEU 0.905 0.031 9 0 "[ . 1 . 2]"
1 31 SER 0.231 0.017 4 0 "[ . 1 . 2]"
1 32 ALA 0.095 0.013 17 0 "[ . 1 . 2]"
1 33 PRO 0.019 0.008 1 0 "[ . 1 . 2]"
1 34 ARG 0.758 0.045 20 0 "[ . 1 . 2]"
1 35 GLU 0.307 0.035 2 0 "[ . 1 . 2]"
1 36 LEU 0.378 0.038 2 0 "[ . 1 . 2]"
1 37 GLY 0.005 0.003 20 0 "[ . 1 . 2]"
1 38 GLY 0.374 0.035 2 0 "[ . 1 . 2]"
1 39 ALA 0.407 0.069 7 0 "[ . 1 . 2]"
1 40 GLY 0.382 0.048 7 0 "[ . 1 . 2]"
1 41 ALA 0.285 0.022 12 0 "[ . 1 . 2]"
1 42 GLU 0.548 0.105 20 0 "[ . 1 . 2]"
1 43 GLY 0.489 0.105 20 0 "[ . 1 . 2]"
1 44 THR 0.441 0.031 9 0 "[ . 1 . 2]"
1 45 ASN 0.030 0.007 13 0 "[ . 1 . 2]"
1 47 GLU 0.066 0.012 17 0 "[ . 1 . 2]"
1 48 GLN 0.212 0.018 12 0 "[ . 1 . 2]"
1 49 LEU 0.037 0.005 19 0 "[ . 1 . 2]"
1 50 PHE 1.122 0.027 17 0 "[ . 1 . 2]"
1 51 ALA 0.246 0.017 12 0 "[ . 1 . 2]"
1 52 ALA 0.044 0.007 16 0 "[ . 1 . 2]"
1 53 GLY 0.029 0.005 14 0 "[ . 1 . 2]"
1 54 TYR 0.319 0.014 18 0 "[ . 1 . 2]"
1 55 SER 0.003 0.001 18 0 "[ . 1 . 2]"
1 56 ALA 0.067 0.010 13 0 "[ . 1 . 2]"
1 57 CYS 0.038 0.012 19 0 "[ . 1 . 2]"
1 58 PHE 0.171 0.011 19 0 "[ . 1 . 2]"
1 61 ALA 0.052 0.008 16 0 "[ . 1 . 2]"
1 62 MET 0.130 0.013 20 0 "[ . 1 . 2]"
1 63 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 PHE 0.140 0.008 16 0 "[ . 1 . 2]"
1 65 VAL 0.299 0.018 2 0 "[ . 1 . 2]"
1 66 ALA 0.114 0.013 20 0 "[ . 1 . 2]"
1 67 GLY 0.323 0.018 2 0 "[ . 1 . 2]"
1 68 GLN 0.573 0.023 15 0 "[ . 1 . 2]"
1 69 ASN 0.778 0.023 15 0 "[ . 1 . 2]"
1 70 LYS 0.495 0.021 14 0 "[ . 1 . 2]"
1 71 GLN 1.179 0.025 12 0 "[ . 1 . 2]"
1 72 THR 0.148 0.012 5 0 "[ . 1 . 2]"
1 73 LEU 0.503 0.032 12 0 "[ . 1 . 2]"
1 74 PRO 0.196 0.014 9 0 "[ . 1 . 2]"
1 75 ALA 0.419 0.028 16 0 "[ . 1 . 2]"
1 76 ASP 0.395 0.028 16 0 "[ . 1 . 2]"
1 77 THR 0.722 0.033 20 0 "[ . 1 . 2]"
1 78 THR 0.257 0.017 4 0 "[ . 1 . 2]"
1 79 VAL 0.574 0.028 15 0 "[ . 1 . 2]"
1 80 THR 0.561 0.028 15 0 "[ . 1 . 2]"
1 81 ALA 0.090 0.013 17 0 "[ . 1 . 2]"
1 82 GLU 0.183 0.016 19 0 "[ . 1 . 2]"
1 83 VAL 0.050 0.014 17 0 "[ . 1 . 2]"
1 84 GLY 0.102 0.011 13 0 "[ . 1 . 2]"
1 85 ILE 0.671 0.016 15 0 "[ . 1 . 2]"
1 86 GLY 0.223 0.010 15 0 "[ . 1 . 2]"
1 87 PRO 0.103 0.013 14 0 "[ . 1 . 2]"
1 88 ASN 0.254 0.016 7 0 "[ . 1 . 2]"
1 89 GLU 0.136 0.016 7 0 "[ . 1 . 2]"
1 90 GLU 0.206 0.015 20 0 "[ . 1 . 2]"
1 91 GLY 0.156 0.015 20 0 "[ . 1 . 2]"
1 92 GLY 0.090 0.012 18 0 "[ . 1 . 2]"
1 93 PHE 0.219 0.014 17 0 "[ . 1 . 2]"
1 94 ALA 0.265 0.016 15 0 "[ . 1 . 2]"
1 95 LEU 0.199 0.011 7 0 "[ . 1 . 2]"
1 96 ASP 0.575 0.031 19 0 "[ . 1 . 2]"
1 97 VAL 0.379 0.031 19 0 "[ . 1 . 2]"
1 98 GLU 0.169 0.019 15 0 "[ . 1 . 2]"
1 99 LEU 0.174 0.017 12 0 "[ . 1 . 2]"
1 100 ARG 0.539 0.029 11 0 "[ . 1 . 2]"
1 101 VAL 0.606 0.024 6 0 "[ . 1 . 2]"
1 102 ALA 0.006 0.004 19 0 "[ . 1 . 2]"
1 103 LEU 0.327 0.033 20 0 "[ . 1 . 2]"
1 104 PRO 1.022 0.023 13 0 "[ . 1 . 2]"
1 105 GLY 0.284 0.020 11 0 "[ . 1 . 2]"
1 106 LEU 0.610 0.019 4 0 "[ . 1 . 2]"
1 107 ASP 1.083 0.036 11 0 "[ . 1 . 2]"
1 108 ALA 0.521 0.036 11 0 "[ . 1 . 2]"
1 109 ALA 0.110 0.009 4 0 "[ . 1 . 2]"
1 110 ALA 0.088 0.008 4 0 "[ . 1 . 2]"
1 111 ALA 0.559 0.029 13 0 "[ . 1 . 2]"
1 112 LYS 0.262 0.012 18 0 "[ . 1 . 2]"
1 113 THR 0.651 0.017 17 0 "[ . 1 . 2]"
1 114 LEU 0.258 0.014 1 0 "[ . 1 . 2]"
1 115 VAL 0.097 0.009 3 0 "[ . 1 . 2]"
1 116 ASP 0.253 0.015 11 0 "[ . 1 . 2]"
1 117 ARG 0.677 0.041 17 0 "[ . 1 . 2]"
1 118 ALA 0.218 0.021 17 0 "[ . 1 . 2]"
1 119 HIS 0.189 0.014 8 0 "[ . 1 . 2]"
1 120 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 VAL 0.006 0.006 13 0 "[ . 1 . 2]"
1 122 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 TYR 0.507 0.024 7 0 "[ . 1 . 2]"
1 126 ASN 0.108 0.019 11 0 "[ . 1 . 2]"
1 127 ALA 0.372 0.025 16 0 "[ . 1 . 2]"
1 128 THR 0.840 0.039 1 0 "[ . 1 . 2]"
1 129 ARG 1.192 0.039 1 0 "[ . 1 . 2]"
1 130 ASN 0.557 0.058 19 0 "[ . 1 . 2]"
1 131 ASN 0.309 0.019 19 0 "[ . 1 . 2]"
1 132 VAL 0.527 0.032 19 0 "[ . 1 . 2]"
1 133 ALA 0.452 0.027 2 0 "[ . 1 . 2]"
1 134 VAL 0.679 0.027 2 0 "[ . 1 . 2]"
1 135 ARG 0.023 0.006 5 0 "[ . 1 . 2]"
1 136 LEU 0.682 0.021 2 0 "[ . 1 . 2]"
1 137 VAL 0.657 0.025 19 0 "[ . 1 . 2]"
1 138 VAL 1.018 0.045 17 0 "[ . 1 . 2]"
1 139 ALA 0.958 0.045 17 0 "[ . 1 . 2]"
2 1 MET 1.070 0.030 16 0 "[ . 1 . 2]"
2 2 ASN 0.245 0.044 14 0 "[ . 1 . 2]"
2 3 ILE 0.931 0.020 8 0 "[ . 1 . 2]"
2 4 LEU 0.401 0.016 1 0 "[ . 1 . 2]"
2 5 TYR 0.665 0.019 1 0 "[ . 1 . 2]"
2 6 LYS 0.413 0.013 12 0 "[ . 1 . 2]"
2 7 THR 0.200 0.017 20 0 "[ . 1 . 2]"
2 8 ALA 0.053 0.007 18 0 "[ . 1 . 2]"
2 9 ALA 0.139 0.016 11 0 "[ . 1 . 2]"
2 10 THR 0.324 0.030 3 0 "[ . 1 . 2]"
2 11 SER 0.313 0.030 3 0 "[ . 1 . 2]"
2 12 THR 0.549 0.025 13 0 "[ . 1 . 2]"
2 13 GLY 0.224 0.018 16 0 "[ . 1 . 2]"
2 14 GLY 0.163 0.021 14 0 "[ . 1 . 2]"
2 15 ARG 0.013 0.009 17 0 "[ . 1 . 2]"
2 16 ASP 0.282 0.021 14 0 "[ . 1 . 2]"
2 17 GLY 0.454 0.021 14 0 "[ . 1 . 2]"
2 18 ARG 0.252 0.017 16 0 "[ . 1 . 2]"
2 19 ALA 0.097 0.013 9 0 "[ . 1 . 2]"
2 20 THR 0.597 0.018 10 0 "[ . 1 . 2]"
2 21 SER 0.141 0.013 16 0 "[ . 1 . 2]"
2 22 HIS 0.023 0.011 3 0 "[ . 1 . 2]"
2 23 ASP 0.152 0.016 11 0 "[ . 1 . 2]"
2 24 GLN 0.263 0.022 20 0 "[ . 1 . 2]"
2 25 LYS 0.198 0.031 11 0 "[ . 1 . 2]"
2 26 LEU 1.050 0.042 18 0 "[ . 1 . 2]"
2 27 ASP 0.366 0.042 18 0 "[ . 1 . 2]"
2 28 VAL 0.650 0.021 12 0 "[ . 1 . 2]"
2 29 LYS 0.751 0.021 14 0 "[ . 1 . 2]"
2 30 LEU 1.042 0.034 11 0 "[ . 1 . 2]"
2 31 SER 0.241 0.021 14 0 "[ . 1 . 2]"
2 32 ALA 0.060 0.011 13 0 "[ . 1 . 2]"
2 33 PRO 0.026 0.011 7 0 "[ . 1 . 2]"
2 34 ARG 0.892 0.039 4 0 "[ . 1 . 2]"
2 35 GLU 0.326 0.031 12 0 "[ . 1 . 2]"
2 36 LEU 0.441 0.030 13 0 "[ . 1 . 2]"
2 37 GLY 0.016 0.005 19 0 "[ . 1 . 2]"
2 38 GLY 0.568 0.032 7 0 "[ . 1 . 2]"
2 39 ALA 0.514 0.072 9 0 "[ . 1 . 2]"
2 40 GLY 0.449 0.070 9 0 "[ . 1 . 2]"
2 41 ALA 0.346 0.025 4 0 "[ . 1 . 2]"
2 42 GLU 0.259 0.029 19 0 "[ . 1 . 2]"
2 43 GLY 0.259 0.029 19 0 "[ . 1 . 2]"
2 44 THR 0.397 0.022 11 0 "[ . 1 . 2]"
2 45 ASN 0.068 0.009 4 0 "[ . 1 . 2]"
2 47 GLU 0.048 0.013 6 0 "[ . 1 . 2]"
2 48 GLN 0.247 0.019 2 0 "[ . 1 . 2]"
2 49 LEU 0.031 0.005 14 0 "[ . 1 . 2]"
2 50 PHE 1.210 0.027 17 0 "[ . 1 . 2]"
2 51 ALA 0.191 0.016 3 0 "[ . 1 . 2]"
2 52 ALA 0.082 0.012 18 0 "[ . 1 . 2]"
2 53 GLY 0.027 0.005 19 0 "[ . 1 . 2]"
2 54 TYR 0.368 0.018 3 0 "[ . 1 . 2]"
2 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 56 ALA 0.034 0.006 12 0 "[ . 1 . 2]"
2 57 CYS 0.027 0.008 19 0 "[ . 1 . 2]"
2 58 PHE 0.204 0.013 8 0 "[ . 1 . 2]"
2 61 ALA 0.046 0.007 4 0 "[ . 1 . 2]"
2 62 MET 0.190 0.023 15 0 "[ . 1 . 2]"
2 63 LYS 0.048 0.046 15 0 "[ . 1 . 2]"
2 64 PHE 0.155 0.008 11 0 "[ . 1 . 2]"
2 65 VAL 0.383 0.023 15 0 "[ . 1 . 2]"
2 66 ALA 0.166 0.013 15 0 "[ . 1 . 2]"
2 67 GLY 0.267 0.015 19 0 "[ . 1 . 2]"
2 68 GLN 0.596 0.022 15 0 "[ . 1 . 2]"
2 69 ASN 0.612 0.021 17 0 "[ . 1 . 2]"
2 70 LYS 0.555 0.021 17 0 "[ . 1 . 2]"
2 71 GLN 1.134 0.027 8 0 "[ . 1 . 2]"
2 72 THR 0.200 0.013 11 0 "[ . 1 . 2]"
2 73 LEU 0.526 0.046 15 0 "[ . 1 . 2]"
2 74 PRO 0.164 0.018 3 0 "[ . 1 . 2]"
2 75 ALA 0.383 0.033 7 0 "[ . 1 . 2]"
2 76 ASP 0.356 0.033 7 0 "[ . 1 . 2]"
2 77 THR 0.718 0.040 3 0 "[ . 1 . 2]"
2 78 THR 0.435 0.140 19 0 "[ . 1 . 2]"
2 79 VAL 0.599 0.027 13 0 "[ . 1 . 2]"
2 80 THR 0.615 0.027 13 0 "[ . 1 . 2]"
2 81 ALA 0.107 0.012 18 0 "[ . 1 . 2]"
2 82 GLU 0.115 0.017 7 0 "[ . 1 . 2]"
2 83 VAL 0.041 0.009 1 0 "[ . 1 . 2]"
2 84 GLY 0.188 0.018 1 0 "[ . 1 . 2]"
2 85 ILE 0.735 0.016 7 0 "[ . 1 . 2]"
2 86 GLY 0.134 0.010 14 0 "[ . 1 . 2]"
2 87 PRO 0.092 0.012 14 0 "[ . 1 . 2]"
2 88 ASN 0.294 0.012 14 0 "[ . 1 . 2]"
2 89 GLU 0.129 0.011 6 0 "[ . 1 . 2]"
2 90 GLU 0.275 0.019 10 0 "[ . 1 . 2]"
2 91 GLY 0.200 0.019 10 0 "[ . 1 . 2]"
2 92 GLY 0.119 0.013 14 0 "[ . 1 . 2]"
2 93 PHE 0.179 0.015 3 0 "[ . 1 . 2]"
2 94 ALA 0.239 0.013 9 0 "[ . 1 . 2]"
2 95 LEU 0.203 0.015 1 0 "[ . 1 . 2]"
2 96 ASP 0.678 0.033 2 0 "[ . 1 . 2]"
2 97 VAL 0.408 0.033 2 0 "[ . 1 . 2]"
2 98 GLU 0.158 0.024 10 0 "[ . 1 . 2]"
2 99 LEU 0.164 0.017 7 0 "[ . 1 . 2]"
2 100 ARG 0.442 0.024 15 0 "[ . 1 . 2]"
2 101 VAL 0.567 0.021 1 0 "[ . 1 . 2]"
2 102 ALA 0.047 0.009 14 0 "[ . 1 . 2]"
2 103 LEU 0.280 0.040 3 0 "[ . 1 . 2]"
2 104 PRO 1.011 0.021 5 0 "[ . 1 . 2]"
2 105 GLY 0.291 0.021 5 0 "[ . 1 . 2]"
2 106 LEU 0.615 0.019 12 0 "[ . 1 . 2]"
2 107 ASP 0.694 0.034 9 0 "[ . 1 . 2]"
2 108 ALA 0.265 0.034 9 0 "[ . 1 . 2]"
2 109 ALA 0.039 0.008 10 0 "[ . 1 . 2]"
2 110 ALA 0.042 0.006 5 0 "[ . 1 . 2]"
2 111 ALA 0.380 0.025 19 0 "[ . 1 . 2]"
2 112 LYS 0.291 0.015 10 0 "[ . 1 . 2]"
2 113 THR 0.644 0.014 10 0 "[ . 1 . 2]"
2 114 LEU 0.298 0.014 10 0 "[ . 1 . 2]"
2 115 VAL 0.081 0.018 18 0 "[ . 1 . 2]"
2 116 ASP 0.242 0.012 18 0 "[ . 1 . 2]"
2 117 ARG 0.538 0.019 11 0 "[ . 1 . 2]"
2 118 ALA 0.167 0.018 10 0 "[ . 1 . 2]"
2 119 HIS 0.186 0.020 7 0 "[ . 1 . 2]"
2 120 HIS 0.011 0.007 17 0 "[ . 1 . 2]"
2 121 VAL 0.004 0.004 17 0 "[ . 1 . 2]"
2 122 CYS 0.007 0.007 17 0 "[ . 1 . 2]"
2 124 TYR 0.499 0.026 14 0 "[ . 1 . 2]"
2 126 ASN 0.094 0.013 13 0 "[ . 1 . 2]"
2 127 ALA 0.510 0.032 19 0 "[ . 1 . 2]"
2 128 THR 0.697 0.042 16 0 "[ . 1 . 2]"
2 129 ARG 1.061 0.042 16 0 "[ . 1 . 2]"
2 130 ASN 0.697 0.073 16 0 "[ . 1 . 2]"
2 131 ASN 0.384 0.073 16 0 "[ . 1 . 2]"
2 132 VAL 0.452 0.025 16 0 "[ . 1 . 2]"
2 133 ALA 0.548 0.031 12 0 "[ . 1 . 2]"
2 134 VAL 0.681 0.031 12 0 "[ . 1 . 2]"
2 135 ARG 0.033 0.007 10 0 "[ . 1 . 2]"
2 136 LEU 0.750 0.020 7 0 "[ . 1 . 2]"
2 137 VAL 0.665 0.024 15 0 "[ . 1 . 2]"
2 138 VAL 0.928 0.043 15 0 "[ . 1 . 2]"
2 139 ALA 1.112 0.043 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 84 GLY H 1 96 ASP HB3 4.360 . 4.360 3.323 2.739 3.750 . 0 0 "[ . 1 . 2]" 1
2 1 84 GLY H 1 96 ASP HB2 4.920 . 4.920 4.829 4.404 4.931 0.011 13 0 "[ . 1 . 2]" 1
3 1 2 ASN HA 1 3 ILE HG12 4.360 . 4.360 4.242 4.092 4.360 . 0 0 "[ . 1 . 2]" 1
4 1 3 ILE MG 1 5 TYR HA 3.900 . 3.900 3.382 3.148 3.550 . 0 0 "[ . 1 . 2]" 1
5 1 5 TYR HA 1 6 LYS H 3.200 . 3.200 2.171 2.148 2.192 . 0 0 "[ . 1 . 2]" 1
6 1 5 TYR HA 1 5 TYR HD1 4.490 . 4.490 3.911 3.745 4.085 . 0 0 "[ . 1 . 2]" 1
7 1 5 TYR HA 1 5 TYR HD2 4.650 . 4.650 3.242 3.061 3.495 . 0 0 "[ . 1 . 2]" 1
8 1 84 GLY HA3 2 6 LYS HA 4.200 . 4.200 3.132 2.850 3.394 . 0 0 "[ . 1 . 2]" 1
9 1 6 LYS HA 1 6 LYS HG3 3.930 . 3.930 2.591 2.541 2.641 . 0 0 "[ . 1 . 2]" 1
10 1 7 THR HA 1 7 THR MG 3.530 . 3.530 3.229 3.221 3.237 . 0 0 "[ . 1 . 2]" 1
11 1 9 ALA HA 1 22 HIS HA 4.700 . 4.700 4.219 3.907 4.554 . 0 0 "[ . 1 . 2]" 1
12 1 9 ALA HA 1 10 THR HB 4.670 . 4.670 4.556 4.404 4.670 . 0 0 "[ . 1 . 2]" 1
13 1 81 ALA H 2 10 THR HA 4.230 . 4.230 3.355 2.863 3.720 . 0 0 "[ . 1 . 2]" 1
14 1 9 ALA H 1 10 THR HA 5.030 . 5.030 4.654 4.454 4.853 . 0 0 "[ . 1 . 2]" 1
15 1 10 THR HA 1 10 THR MG 3.680 . 3.680 3.062 2.376 3.234 . 0 0 "[ . 1 . 2]" 1
16 1 79 VAL H 2 12 THR HA 4.300 . 4.300 3.452 3.127 3.747 . 0 0 "[ . 1 . 2]" 1
17 1 78 THR HA 2 12 THR HA . . 2.500 2.368 1.978 2.506 0.006 20 0 "[ . 1 . 2]" 1
18 1 10 THR H 1 21 SER HA 3.900 . 3.900 3.361 3.083 3.645 . 0 0 "[ . 1 . 2]" 1
19 1 21 SER HA 1 25 LYS H 5.150 . 5.150 4.921 4.645 5.162 0.012 4 0 "[ . 1 . 2]" 1
20 1 20 THR HA 1 21 SER HA 4.420 . 4.420 4.423 4.414 4.427 0.007 15 0 "[ . 1 . 2]" 1
21 1 21 SER HA 1 22 HIS HA 4.440 . 4.440 4.274 4.187 4.360 . 0 0 "[ . 1 . 2]" 1
22 1 9 ALA MB 1 21 SER HA 3.620 . 3.620 2.240 1.978 2.551 . 0 0 "[ . 1 . 2]" 1
23 1 20 THR HA 1 21 SER HB2 5.050 . 5.050 4.752 4.600 5.050 0.000 20 0 "[ . 1 . 2]" 1
24 1 20 THR HA 1 21 SER HB3 5.050 . 5.050 4.629 4.428 4.792 . 0 0 "[ . 1 . 2]" 1
25 1 22 HIS HA 1 24 GLN H 4.270 . 4.270 3.188 2.952 3.453 . 0 0 "[ . 1 . 2]" 1
26 1 23 ASP HA 1 24 GLN HB2 4.410 . 4.410 4.327 4.215 4.405 . 0 0 "[ . 1 . 2]" 1
27 1 26 LEU HA 1 26 LEU MD2 4.160 . 4.160 3.935 3.910 3.957 . 0 0 "[ . 1 . 2]" 1
28 1 20 THR HA 1 27 ASP HA 3.640 . 3.640 2.152 2.027 2.323 . 0 0 "[ . 1 . 2]" 1
29 1 27 ASP HA 1 28 VAL MG2 4.020 . 4.020 3.803 3.630 3.894 . 0 0 "[ . 1 . 2]" 1
30 1 26 LEU MD1 1 27 ASP HA 4.130 . 4.130 4.001 3.828 4.091 . 0 0 "[ . 1 . 2]" 1
31 1 26 LEU HG 1 27 ASP HA 4.300 . 4.300 3.230 3.103 3.435 . 0 0 "[ . 1 . 2]" 1
32 1 26 LEU HA 1 27 ASP HA 4.740 . 4.740 4.455 4.381 4.498 . 0 0 "[ . 1 . 2]" 1
33 1 28 VAL HA 1 28 VAL MG1 3.170 . 3.170 2.257 2.235 2.292 . 0 0 "[ . 1 . 2]" 1
34 1 31 SER HA 1 44 THR H 5.380 . 5.380 5.222 4.794 5.390 0.010 1 0 "[ . 1 . 2]" 1
35 1 16 ASP HB3 1 31 SER HA 4.600 . 4.600 1.852 1.783 2.052 0.017 14 0 "[ . 1 . 2]" 1
36 1 31 SER HA 1 41 ALA MB 4.630 . 4.630 4.220 3.515 4.631 0.001 13 0 "[ . 1 . 2]" 1
37 1 31 SER HA 1 32 ALA MB 4.030 . 4.030 4.011 3.960 4.041 0.011 7 0 "[ . 1 . 2]" 1
38 1 31 SER HA 1 32 ALA HA 4.560 . 4.560 4.378 4.327 4.428 . 0 0 "[ . 1 . 2]" 1
39 1 31 SER HA 1 32 ALA H 3.310 . 3.310 2.192 2.110 2.544 . 0 0 "[ . 1 . 2]" 1
40 1 34 ARG HA 1 37 GLY H 4.020 . 4.020 3.388 2.994 4.018 . 0 0 "[ . 1 . 2]" 1
41 1 35 GLU HA 1 37 GLY H 5.500 . 5.500 4.212 3.603 5.399 . 0 0 "[ . 1 . 2]" 1
42 1 35 GLU HA 1 38 GLY H 5.500 . 5.500 5.409 4.850 5.535 0.035 2 0 "[ . 1 . 2]" 1
43 1 5 TYR HD2 2 35 GLU HB2 4.670 . 4.670 3.039 2.484 4.257 . 0 0 "[ . 1 . 2]" 1
44 1 35 GLU HB2 1 36 LEU MD2 4.820 . 4.820 3.356 1.912 4.739 . 0 0 "[ . 1 . 2]" 1
45 1 5 TYR HD2 2 35 GLU HB3 4.670 . 4.670 3.183 2.472 3.850 . 0 0 "[ . 1 . 2]" 1
46 1 36 LEU HA 1 36 LEU HG 3.830 . 3.830 3.255 2.605 3.768 . 0 0 "[ . 1 . 2]" 1
47 1 45 ASN H 1 48 GLN HB2 4.320 . 4.320 4.222 3.740 4.327 0.007 13 0 "[ . 1 . 2]" 1
48 1 44 THR MG 1 48 GLN HB3 5.350 . 5.350 3.735 2.695 5.356 0.006 9 0 "[ . 1 . 2]" 1
49 1 51 ALA HA 1 81 ALA MB 3.390 . 3.390 3.142 2.691 3.403 0.013 17 0 "[ . 1 . 2]" 1
50 1 49 LEU MD1 2 53 GLY HA2 4.220 . 4.220 2.723 2.363 3.015 . 0 0 "[ . 1 . 2]" 1
51 1 61 ALA HA 1 64 PHE HB3 3.670 . 3.670 2.902 2.521 3.156 . 0 0 "[ . 1 . 2]" 1
52 1 61 ALA HA 1 64 PHE H 3.890 . 3.890 3.396 3.268 3.526 . 0 0 "[ . 1 . 2]" 1
53 1 61 ALA HA 1 64 PHE HD2 4.380 . 4.380 4.297 4.010 4.388 0.008 16 0 "[ . 1 . 2]" 1
54 1 68 GLN HG3 1 69 ASN HA 4.090 . 4.090 3.907 3.731 4.080 . 0 0 "[ . 1 . 2]" 1
55 1 76 ASP HA 1 76 ASP HB2 3.010 . 3.010 2.517 2.462 2.990 . 0 0 "[ . 1 . 2]" 1
56 1 76 ASP HA 1 104 PRO HG3 4.860 . 4.860 4.440 3.966 4.717 . 0 0 "[ . 1 . 2]" 1
57 1 75 ALA MB 1 76 ASP HA 4.190 . 4.190 4.049 3.891 4.110 . 0 0 "[ . 1 . 2]" 1
58 1 76 ASP HA 1 77 THR MG 4.720 . 4.720 4.576 4.475 4.661 . 0 0 "[ . 1 . 2]" 1
59 1 77 THR HA 1 104 PRO HD2 3.740 . 3.740 3.018 2.799 3.127 . 0 0 "[ . 1 . 2]" 1
60 1 77 THR HA 1 104 PRO HD3 3.840 . 3.840 1.982 1.790 2.122 0.010 11 0 "[ . 1 . 2]" 1
61 1 77 THR HA 1 104 PRO HG3 3.860 . 3.860 3.202 3.078 3.286 . 0 0 "[ . 1 . 2]" 1
62 1 77 THR HA 1 104 PRO HG2 4.270 . 4.270 4.269 4.177 4.282 0.012 15 0 "[ . 1 . 2]" 1
63 1 9 ALA H 2 80 THR HA 4.770 . 4.770 4.502 4.135 4.753 . 0 0 "[ . 1 . 2]" 1
64 1 81 ALA HA 1 100 ARG H 4.190 . 4.190 3.318 2.922 3.689 . 0 0 "[ . 1 . 2]" 1
65 1 81 ALA HA 1 99 LEU HA 3.940 . 3.940 2.567 2.380 2.740 . 0 0 "[ . 1 . 2]" 1
66 1 81 ALA HA 1 82 GLU HB3 4.860 . 4.860 4.704 4.576 4.795 . 0 0 "[ . 1 . 2]" 1
67 1 100 ARG HA 1 137 VAL H 4.020 . 4.020 3.334 3.052 3.524 . 0 0 "[ . 1 . 2]" 1
68 1 100 ARG HA 1 101 VAL HA 4.890 . 4.890 4.406 4.378 4.426 . 0 0 "[ . 1 . 2]" 1
69 1 100 ARG HA 1 138 VAL HA 5.130 . 5.130 4.084 3.845 4.219 . 0 0 "[ . 1 . 2]" 1
70 1 9 ALA H 2 82 GLU HA 4.000 . 4.000 3.147 2.782 3.485 . 0 0 "[ . 1 . 2]" 1
71 1 8 ALA HA 2 82 GLU HA 3.580 . 3.580 1.906 1.795 2.123 0.005 15 0 "[ . 1 . 2]" 1
72 1 82 GLU HA 1 82 GLU HG2 4.160 . 4.160 3.124 2.949 3.248 . 0 0 "[ . 1 . 2]" 1
73 1 80 THR MG 1 82 GLU HA 4.960 . 4.960 4.038 3.773 4.268 . 0 0 "[ . 1 . 2]" 1
74 1 81 ALA MB 1 82 GLU HA 5.160 . 5.160 4.249 4.138 4.296 . 0 0 "[ . 1 . 2]" 1
75 1 83 VAL HA 1 84 GLY H 3.520 . 3.520 2.181 2.122 2.237 . 0 0 "[ . 1 . 2]" 1
76 1 7 THR H 2 84 GLY HA2 4.360 . 4.360 3.432 3.323 3.552 . 0 0 "[ . 1 . 2]" 1
77 1 7 THR H 2 84 GLY HA3 4.780 . 4.780 4.605 4.416 4.774 . 0 0 "[ . 1 . 2]" 1
78 1 6 LYS HG3 2 84 GLY HA2 3.960 . 3.960 3.179 3.031 3.289 . 0 0 "[ . 1 . 2]" 1
79 1 6 LYS HB3 2 84 GLY HA2 4.380 . 4.380 4.252 4.101 4.386 0.006 3 0 "[ . 1 . 2]" 1
80 1 6 LYS HB2 2 84 GLY HA2 4.380 . 4.380 2.831 2.631 3.026 . 0 0 "[ . 1 . 2]" 1
81 1 6 LYS HG3 2 84 GLY HA3 3.770 . 3.770 3.267 3.101 3.404 . 0 0 "[ . 1 . 2]" 1
82 1 6 LYS HB2 2 84 GLY HA3 4.760 . 4.760 2.589 2.357 2.915 . 0 0 "[ . 1 . 2]" 1
83 1 87 PRO HA 1 93 PHE QD 4.180 . 4.180 2.972 2.424 3.305 . 0 0 "[ . 1 . 2]" 1
84 1 87 PRO HA 1 93 PHE HA 3.740 . 3.740 2.466 2.172 2.762 . 0 0 "[ . 1 . 2]" 1
85 1 88 ASN HA 1 89 GLU HA 4.320 . 4.320 4.304 4.262 4.330 0.010 15 0 "[ . 1 . 2]" 1
86 1 86 GLY H 1 95 LEU HA 4.130 . 4.130 3.788 3.633 3.940 . 0 0 "[ . 1 . 2]" 1
87 1 85 ILE HA 1 95 LEU HA 4.470 . 4.470 2.545 2.485 2.666 . 0 0 "[ . 1 . 2]" 1
88 1 96 ASP HA 1 97 VAL H 3.140 . 3.140 2.177 2.123 2.296 . 0 0 "[ . 1 . 2]" 1
89 1 97 VAL HA 1 98 GLU H 3.320 . 3.320 2.134 2.052 2.209 . 0 0 "[ . 1 . 2]" 1
90 1 98 GLU HA 1 134 VAL MG1 3.990 . 3.990 3.717 3.170 3.973 . 0 0 "[ . 1 . 2]" 1
91 1 101 VAL HA 1 101 VAL MG1 3.740 . 3.740 2.376 2.350 2.398 . 0 0 "[ . 1 . 2]" 1
92 1 138 VAL HA 1 138 VAL MG1 3.330 . 3.330 2.463 2.222 2.545 . 0 0 "[ . 1 . 2]" 1
93 1 101 VAL HB 1 138 VAL HA 3.910 . 3.910 2.627 2.502 2.709 . 0 0 "[ . 1 . 2]" 1
94 1 138 VAL HA 1 139 ALA H 3.000 . 3.000 2.175 2.104 2.210 . 0 0 "[ . 1 . 2]" 1
95 1 101 VAL H 1 138 VAL HA 4.740 . 4.740 2.530 2.285 2.609 . 0 0 "[ . 1 . 2]" 1
96 1 106 LEU HA 1 106 LEU HG 3.430 . 3.430 3.329 3.292 3.391 . 0 0 "[ . 1 . 2]" 1
97 1 127 ALA MB 1 128 THR HB 4.530 . 4.530 4.217 3.559 4.538 0.008 1 0 "[ . 1 . 2]" 1
98 1 126 ASN H 1 128 THR HB 5.400 . 5.400 5.310 4.780 5.419 0.019 11 0 "[ . 1 . 2]" 1
99 1 127 ALA H 1 131 ASN HB2 5.500 . 5.500 5.260 4.594 5.508 0.008 6 0 "[ . 1 . 2]" 1
100 1 128 THR H 1 131 ASN HB2 5.500 . 5.500 5.487 5.258 5.519 0.019 19 0 "[ . 1 . 2]" 1
101 1 127 ALA HA 1 131 ASN HB2 4.480 . 4.480 2.716 2.316 3.032 . 0 0 "[ . 1 . 2]" 1
102 1 128 THR H 1 131 ASN HB3 5.500 . 5.500 4.916 4.531 5.228 . 0 0 "[ . 1 . 2]" 1
103 1 127 ALA H 1 131 ASN HB3 5.500 . 5.500 5.287 4.613 5.514 0.014 8 0 "[ . 1 . 2]" 1
104 1 5 TYR HD1 1 7 THR HB 4.470 . 4.470 4.085 3.832 4.454 . 0 0 "[ . 1 . 2]" 1
105 1 1 MET HB2 1 3 ILE MD 4.680 . 4.680 4.459 4.108 4.684 0.004 20 0 "[ . 1 . 2]" 1
106 1 1 MET HB3 1 3 ILE MD 5.140 . 5.140 4.522 4.309 4.763 . 0 0 "[ . 1 . 2]" 1
107 1 1 MET HG2 1 2 ASN H 4.270 . 4.270 4.190 3.970 4.285 0.015 4 0 "[ . 1 . 2]" 1
108 1 1 MET HA 1 1 MET HG3 3.850 . 3.850 3.667 3.608 3.748 . 0 0 "[ . 1 . 2]" 1
109 1 1 MET HA 1 1 MET HG2 3.740 . 3.740 3.760 3.737 3.776 0.036 2 0 "[ . 1 . 2]" 1
110 1 1 MET HG3 1 3 ILE HA 4.660 . 4.660 3.543 3.440 3.662 . 0 0 "[ . 1 . 2]" 1
111 1 1 MET HB3 1 1 MET HG2 2.810 . 2.810 2.386 2.328 2.483 . 0 0 "[ . 1 . 2]" 1
112 1 1 MET HB2 1 1 MET HG3 2.760 . 2.760 2.482 2.406 2.531 . 0 0 "[ . 1 . 2]" 1
113 1 1 MET HG2 1 3 ILE HG12 3.830 . 3.830 3.167 2.723 3.389 . 0 0 "[ . 1 . 2]" 1
114 1 1 MET HG3 1 3 ILE HG12 3.810 . 3.810 2.557 2.116 2.813 . 0 0 "[ . 1 . 2]" 1
115 1 1 MET HG3 1 3 ILE HG13 4.270 . 4.270 4.090 3.658 4.280 0.010 16 0 "[ . 1 . 2]" 1
116 1 1 MET HG2 1 3 ILE HG13 4.560 . 4.560 4.238 3.833 4.481 . 0 0 "[ . 1 . 2]" 1
117 1 1 MET HG2 1 3 ILE MD 3.710 . 3.710 2.620 2.236 3.061 . 0 0 "[ . 1 . 2]" 1
118 1 1 MET HG3 1 3 ILE MD 3.700 . 3.700 2.520 2.252 2.701 . 0 0 "[ . 1 . 2]" 1
119 1 1 MET HG2 1 3 ILE MG 5.500 . 5.500 5.334 4.932 5.505 0.005 9 0 "[ . 1 . 2]" 1
120 1 1 MET HG3 1 3 ILE MG 4.820 . 4.820 4.724 4.579 4.822 0.002 16 0 "[ . 1 . 2]" 1
121 1 94 ALA H 2 1 MET ME 3.690 . 3.690 3.333 3.059 3.528 . 0 0 "[ . 1 . 2]" 1
122 1 1 MET ME 1 4 LEU H 4.180 . 4.180 4.102 3.995 4.183 0.003 11 0 "[ . 1 . 2]" 1
123 1 86 GLY H 2 1 MET ME 2.810 . 2.810 2.307 2.151 2.467 . 0 0 "[ . 1 . 2]" 1
124 1 1 MET ME 1 3 ILE H 4.150 . 4.150 4.158 4.030 4.175 0.025 17 0 "[ . 1 . 2]" 1
125 1 1 MET ME 1 5 TYR H 5.500 . 5.500 5.480 5.323 5.513 0.013 4 0 "[ . 1 . 2]" 1
126 1 93 PHE QD 2 1 MET ME 5.500 . 5.500 5.470 5.175 5.514 0.014 17 0 "[ . 1 . 2]" 1
127 1 85 ILE HA 2 1 MET ME 3.550 . 3.550 3.427 3.148 3.555 0.005 14 0 "[ . 1 . 2]" 1
128 1 95 LEU HA 2 1 MET ME 4.240 . 4.240 3.951 3.432 4.245 0.005 5 0 "[ . 1 . 2]" 1
129 1 1 MET ME 1 3 ILE HA 3.580 . 3.580 2.799 2.664 2.964 . 0 0 "[ . 1 . 2]" 1
130 1 1 MET ME 1 3 ILE MD 2.650 . 2.650 1.894 1.793 2.124 0.007 16 0 "[ . 1 . 2]" 1
131 1 94 ALA MB 2 1 MET ME 2.470 . 2.470 1.930 1.796 2.152 0.004 20 0 "[ . 1 . 2]" 1
132 1 2 ASN HB3 1 3 ILE H 4.840 . 4.840 4.472 4.448 4.501 . 0 0 "[ . 1 . 2]" 1
133 1 2 ASN HB2 1 3 ILE H 4.840 . 4.840 4.603 4.568 4.638 . 0 0 "[ . 1 . 2]" 1
134 1 3 ILE HA 1 4 LEU HG 3.910 . 3.910 3.910 3.815 3.922 0.012 11 0 "[ . 1 . 2]" 1
135 1 62 MET HA 1 65 VAL MG2 3.970 . 3.970 2.913 2.567 3.431 . 0 0 "[ . 1 . 2]" 1
136 1 62 MET HA 1 65 VAL MG1 4.350 . 4.350 3.679 3.422 3.961 . 0 0 "[ . 1 . 2]" 1
137 1 62 MET HA 1 65 VAL HB 4.380 . 4.380 2.309 1.934 2.640 . 0 0 "[ . 1 . 2]" 1
138 1 85 ILE H 2 3 ILE HB 5.140 . 5.140 5.130 4.902 5.147 0.007 10 0 "[ . 1 . 2]" 1
139 1 3 ILE HB 1 4 LEU H 5.040 . 5.040 4.172 4.043 4.345 . 0 0 "[ . 1 . 2]" 1
140 1 2 ASN HA 1 3 ILE HB 4.840 . 4.840 4.646 4.556 4.743 . 0 0 "[ . 1 . 2]" 1
141 1 3 ILE MG 1 4 LEU H 3.630 . 3.630 2.651 2.427 2.968 . 0 0 "[ . 1 . 2]" 1
142 1 84 GLY H 2 3 ILE MG 4.960 . 4.960 4.570 4.289 4.884 . 0 0 "[ . 1 . 2]" 1
143 1 85 ILE H 2 3 ILE MG 3.390 . 3.390 2.096 1.901 2.146 . 0 0 "[ . 1 . 2]" 1
144 1 3 ILE H 1 3 ILE MG 3.810 . 3.810 3.749 3.740 3.759 . 0 0 "[ . 1 . 2]" 1
145 1 3 ILE MG 1 7 THR H 5.470 . 5.470 5.036 4.830 5.132 . 0 0 "[ . 1 . 2]" 1
146 1 84 GLY HA2 2 3 ILE MG 3.800 . 3.800 3.050 2.805 3.351 . 0 0 "[ . 1 . 2]" 1
147 1 3 ILE MG 1 6 LYS HA 4.020 . 4.020 3.359 3.169 3.467 . 0 0 "[ . 1 . 2]" 1
148 1 3 ILE MG 1 4 LEU HA 4.260 . 4.260 3.834 3.656 4.065 . 0 0 "[ . 1 . 2]" 1
149 1 3 ILE HA 1 3 ILE MG 3.440 . 3.440 2.427 2.390 2.455 . 0 0 "[ . 1 . 2]" 1
150 1 84 GLY HA3 2 3 ILE MG 3.690 . 3.690 2.442 2.151 2.735 . 0 0 "[ . 1 . 2]" 1
151 1 3 ILE HG12 1 3 ILE MG 3.360 . 3.360 3.211 3.203 3.217 . 0 0 "[ . 1 . 2]" 1
152 1 3 ILE HG13 1 3 ILE MG 2.910 . 2.910 2.423 2.392 2.454 . 0 0 "[ . 1 . 2]" 1
153 1 3 ILE MD 1 4 LEU H 3.530 . 3.530 3.537 3.531 3.545 0.015 17 0 "[ . 1 . 2]" 1
154 1 85 ILE H 2 3 ILE MD 3.490 . 3.490 2.922 2.735 3.200 . 0 0 "[ . 1 . 2]" 1
155 1 86 GLY H 2 3 ILE MD 3.690 . 3.690 3.249 3.026 3.480 . 0 0 "[ . 1 . 2]" 1
156 1 3 ILE MD 1 5 TYR H 4.700 . 4.700 4.277 4.117 4.457 . 0 0 "[ . 1 . 2]" 1
157 1 85 ILE HA 2 3 ILE MD 3.690 . 3.690 3.238 3.027 3.367 . 0 0 "[ . 1 . 2]" 1
158 1 3 ILE HA 1 3 ILE MD 3.040 . 3.040 1.992 1.938 2.062 . 0 0 "[ . 1 . 2]" 1
159 1 84 GLY HA3 2 3 ILE MD 3.570 . 3.570 2.335 1.955 2.540 . 0 0 "[ . 1 . 2]" 1
160 1 96 ASP HB2 2 3 ILE MD 3.150 . 3.150 2.419 2.108 2.706 . 0 0 "[ . 1 . 2]" 1
161 1 96 ASP HB3 2 3 ILE MD 3.340 . 3.340 2.138 1.798 2.437 0.002 14 0 "[ . 1 . 2]" 1
162 1 3 ILE HB 1 3 ILE MD 3.310 . 3.310 3.227 3.221 3.233 . 0 0 "[ . 1 . 2]" 1
163 1 4 LEU MD1 1 5 TYR H 4.560 . 4.560 4.418 4.339 4.547 . 0 0 "[ . 1 . 2]" 1
164 1 86 GLY H 2 4 LEU MD1 4.900 . 4.900 4.855 4.557 4.906 0.006 12 0 "[ . 1 . 2]" 1
165 1 4 LEU H 1 4 LEU MD1 3.930 . 3.930 3.746 3.669 3.827 . 0 0 "[ . 1 . 2]" 1
166 1 4 LEU HA 1 4 LEU MD1 4.020 . 4.020 3.881 3.858 3.903 . 0 0 "[ . 1 . 2]" 1
167 1 36 LEU MD2 2 5 TYR HB3 4.690 . 4.690 2.969 2.071 4.244 . 0 0 "[ . 1 . 2]" 1
168 1 6 LYS HB2 1 7 THR H 4.310 . 4.310 4.002 3.905 4.120 . 0 0 "[ . 1 . 2]" 1
169 1 6 LYS HB3 1 7 THR H 4.310 . 4.310 4.121 3.976 4.238 . 0 0 "[ . 1 . 2]" 1
170 1 84 GLY HA3 2 6 LYS HB2 4.760 . 4.760 2.598 2.374 2.933 . 0 0 "[ . 1 . 2]" 1
171 1 3 ILE MG 1 6 LYS HB3 3.840 . 3.840 2.922 2.586 3.213 . 0 0 "[ . 1 . 2]" 1
172 1 3 ILE MG 1 6 LYS HB2 3.840 . 3.840 1.801 1.789 1.893 0.011 8 0 "[ . 1 . 2]" 1
173 1 6 LYS HG3 1 7 THR H 4.070 . 4.070 2.547 2.260 2.863 . 0 0 "[ . 1 . 2]" 1
174 1 6 LYS HG2 1 7 THR H 4.120 . 4.120 3.160 2.707 3.407 . 0 0 "[ . 1 . 2]" 1
175 1 6 LYS H 1 6 LYS HG2 4.640 . 4.640 4.428 4.344 4.493 . 0 0 "[ . 1 . 2]" 1
176 1 6 LYS H 1 6 LYS HG3 4.880 . 4.880 4.710 4.687 4.766 . 0 0 "[ . 1 . 2]" 1
177 1 6 LYS HA 1 6 LYS HG2 4.180 . 4.180 3.397 3.202 3.463 . 0 0 "[ . 1 . 2]" 1
178 1 84 GLY HA3 2 6 LYS HG2 4.810 . 4.810 4.660 4.403 4.814 0.004 13 0 "[ . 1 . 2]" 1
179 1 6 LYS HD2 1 7 THR H 5.500 . 5.500 5.280 5.046 5.497 . 0 0 "[ . 1 . 2]" 1
180 1 6 LYS HD3 1 7 THR H 5.500 . 5.500 4.908 4.641 5.163 . 0 0 "[ . 1 . 2]" 1
181 1 6 LYS HE2 1 7 THR H 5.500 . 5.500 4.683 4.378 5.191 . 0 0 "[ . 1 . 2]" 1
182 1 6 LYS HE3 1 7 THR H 5.500 . 5.500 5.278 5.024 5.504 0.004 10 0 "[ . 1 . 2]" 1
183 1 85 ILE H 2 6 LYS HE2 5.470 . 5.470 5.137 4.782 5.461 . 0 0 "[ . 1 . 2]" 1
184 1 85 ILE H 2 6 LYS HE3 5.500 . 5.500 4.614 4.146 5.090 . 0 0 "[ . 1 . 2]" 1
185 1 84 GLY HA2 2 6 LYS HE2 5.200 . 5.200 3.605 3.303 3.753 . 0 0 "[ . 1 . 2]" 1
186 1 84 GLY HA2 2 6 LYS HE3 5.500 . 5.500 3.753 3.359 4.266 . 0 0 "[ . 1 . 2]" 1
187 1 6 LYS HE2 1 6 LYS HG3 3.850 . 3.850 2.363 2.286 2.459 . 0 0 "[ . 1 . 2]" 1
188 1 6 LYS HE3 1 6 LYS HG3 3.850 . 3.850 3.032 2.959 3.107 . 0 0 "[ . 1 . 2]" 1
189 1 3 ILE MD 1 6 LYS HE2 4.130 . 4.130 3.829 3.562 4.114 . 0 0 "[ . 1 . 2]" 1
190 1 3 ILE MD 1 6 LYS HE3 4.130 . 4.130 3.011 2.450 3.712 . 0 0 "[ . 1 . 2]" 1
191 1 83 VAL H 2 7 THR MG 4.300 . 4.300 3.386 3.054 3.671 . 0 0 "[ . 1 . 2]" 1
192 1 48 GLN H 2 7 THR MG 3.880 . 3.880 3.697 2.855 3.884 0.004 17 0 "[ . 1 . 2]" 1
193 1 6 LYS H 1 7 THR MG 5.500 . 5.500 5.070 4.894 5.302 . 0 0 "[ . 1 . 2]" 1
194 1 47 GLU H 2 7 THR MG 5.500 . 5.500 5.398 4.446 5.512 0.012 17 0 "[ . 1 . 2]" 1
195 1 5 TYR HD1 1 7 THR MG 3.810 . 3.810 3.470 3.222 3.665 . 0 0 "[ . 1 . 2]" 1
196 1 48 GLN HA 2 7 THR MG 3.600 . 3.600 3.245 2.793 3.605 0.005 1 0 "[ . 1 . 2]" 1
197 1 48 GLN HG2 2 7 THR MG 3.820 . 3.820 3.375 2.663 3.837 0.017 20 0 "[ . 1 . 2]" 1
198 1 48 GLN HG3 2 7 THR MG 3.820 . 3.820 2.801 2.413 3.828 0.008 8 0 "[ . 1 . 2]" 1
199 1 48 GLN HB3 2 7 THR MG 3.960 . 3.960 3.355 3.207 3.500 . 0 0 "[ . 1 . 2]" 1
200 1 48 GLN HB2 2 7 THR MG 3.420 . 3.420 1.993 1.798 2.161 0.002 20 0 "[ . 1 . 2]" 1
201 1 8 ALA MB 1 9 ALA H 3.240 . 3.240 2.733 2.455 2.990 . 0 0 "[ . 1 . 2]" 1
202 1 82 GLU H 2 8 ALA MB 5.010 . 5.010 4.775 4.483 5.012 0.002 17 0 "[ . 1 . 2]" 1
203 1 82 GLU HA 2 8 ALA MB 3.480 . 3.480 3.050 2.693 3.280 . 0 0 "[ . 1 . 2]" 1
204 1 8 ALA MB 1 22 HIS HB2 4.410 . 4.410 3.448 2.918 4.233 . 0 0 "[ . 1 . 2]" 1
205 1 8 ALA MB 1 22 HIS HB3 4.410 . 4.410 2.540 1.836 3.360 . 0 0 "[ . 1 . 2]" 1
206 1 82 GLU HB3 2 8 ALA MB 4.460 . 4.460 4.172 3.973 4.447 . 0 0 "[ . 1 . 2]" 1
207 1 82 GLU HB2 2 8 ALA MB 3.470 . 3.470 2.921 2.654 3.356 . 0 0 "[ . 1 . 2]" 1
208 1 80 THR MG 2 8 ALA MB 3.100 . 3.100 2.696 2.479 3.093 . 0 0 "[ . 1 . 2]" 1
209 1 80 THR MG 2 8 ALA HA 4.390 . 4.390 4.001 3.656 4.362 . 0 0 "[ . 1 . 2]" 1
210 1 8 ALA HA 1 9 ALA MB 4.280 . 4.280 3.935 3.876 3.988 . 0 0 "[ . 1 . 2]" 1
211 1 9 ALA H 1 9 ALA MB 3.110 . 3.110 2.586 2.477 2.709 . 0 0 "[ . 1 . 2]" 1
212 1 52 ALA HA 2 9 ALA MB 3.430 . 3.430 2.868 2.360 3.345 . 0 0 "[ . 1 . 2]" 1
213 1 80 THR MG 2 10 THR HB 4.500 . 4.500 3.315 2.053 4.498 . 0 0 "[ . 1 . 2]" 1
214 1 56 ALA MB 2 11 SER HB2 4.410 . 4.410 3.071 1.939 4.230 . 0 0 "[ . 1 . 2]" 1
215 1 10 THR MG 1 11 SER HA 4.320 . 4.320 3.914 3.624 4.171 . 0 0 "[ . 1 . 2]" 1
216 1 12 THR HB 1 13 GLY H 3.550 . 3.550 3.514 3.289 3.562 0.012 12 0 "[ . 1 . 2]" 1
217 1 12 THR H 1 12 THR HB 3.830 . 3.830 2.691 2.598 2.796 . 0 0 "[ . 1 . 2]" 1
218 1 12 THR HB 1 18 ARG H 4.650 . 4.650 4.345 3.990 4.605 . 0 0 "[ . 1 . 2]" 1
219 1 78 THR HA 2 12 THR HB 5.500 . 5.500 5.322 4.912 5.506 0.006 9 0 "[ . 1 . 2]" 1
220 1 12 THR MG 1 13 GLY H 3.240 . 3.240 1.968 1.798 2.161 0.002 6 0 "[ . 1 . 2]" 1
221 1 12 THR HA 1 12 THR MG 2.730 . 2.730 2.288 2.246 2.346 . 0 0 "[ . 1 . 2]" 1
222 1 15 ARG H 1 16 ASP HA 5.490 . 5.490 5.047 4.799 5.379 . 0 0 "[ . 1 . 2]" 1
223 1 18 ARG HA 1 29 LYS HB2 4.000 . 4.000 3.004 2.549 3.372 . 0 0 "[ . 1 . 2]" 1
224 1 56 ALA MB 2 18 ARG HA 4.900 . 4.900 4.432 3.917 4.902 0.002 13 0 "[ . 1 . 2]" 1
225 1 18 ARG HA 1 18 ARG HG2 4.180 . 4.180 2.787 2.272 3.831 . 0 0 "[ . 1 . 2]" 1
226 1 18 ARG HA 1 18 ARG HG3 4.180 . 4.180 3.080 2.452 3.678 . 0 0 "[ . 1 . 2]" 1
227 1 18 ARG HD2 1 19 ALA H 5.130 . 5.130 4.546 3.237 5.133 0.003 11 0 "[ . 1 . 2]" 1
228 1 18 ARG HD3 1 19 ALA H 5.130 . 5.130 4.249 2.550 5.146 0.016 13 0 "[ . 1 . 2]" 1
229 1 100 ARG HA 1 100 ARG HD3 4.810 . 4.810 4.533 4.298 4.737 . 0 0 "[ . 1 . 2]" 1
230 1 11 SER HA 1 19 ALA MB 4.260 . 4.260 3.804 3.534 4.053 . 0 0 "[ . 1 . 2]" 1
231 1 11 SER HA 1 19 ALA HA 4.470 . 4.470 2.240 2.026 2.540 . 0 0 "[ . 1 . 2]" 1
232 1 10 THR HA 1 20 THR HB 5.500 . 5.500 5.402 5.197 5.510 0.010 20 0 "[ . 1 . 2]" 1
233 1 10 THR MG 1 20 THR HB 4.240 . 4.240 2.580 1.800 4.134 0.000 7 0 "[ . 1 . 2]" 1
234 1 52 ALA MB 2 20 THR HA 5.500 . 5.500 4.903 4.597 5.167 . 0 0 "[ . 1 . 2]" 1
235 1 20 THR MG 1 21 SER H 3.320 . 3.320 3.067 2.959 3.124 . 0 0 "[ . 1 . 2]" 1
236 1 20 THR MG 1 28 VAL H 4.290 . 4.290 4.284 4.207 4.305 0.015 18 0 "[ . 1 . 2]" 1
237 1 20 THR MG 1 27 ASP H 4.410 . 4.410 4.278 4.178 4.411 0.001 8 0 "[ . 1 . 2]" 1
238 1 10 THR H 1 20 THR MG 4.420 . 4.420 4.143 4.028 4.268 . 0 0 "[ . 1 . 2]" 1
239 1 20 THR MG 1 25 LYS H 5.050 . 5.050 4.847 4.554 5.051 0.001 6 0 "[ . 1 . 2]" 1
240 1 20 THR HA 1 20 THR MG 3.030 . 3.030 2.388 2.333 2.439 . 0 0 "[ . 1 . 2]" 1
241 1 20 THR MG 1 27 ASP HA 3.260 . 3.260 2.435 2.320 2.511 . 0 0 "[ . 1 . 2]" 1
242 1 20 THR MG 1 26 LEU HA 4.970 . 4.970 4.863 4.731 4.974 0.004 1 0 "[ . 1 . 2]" 1
243 1 20 THR MG 1 24 GLN HA 3.910 . 3.910 3.840 3.424 3.931 0.021 20 0 "[ . 1 . 2]" 1
244 1 20 THR MG 1 27 ASP HB2 3.580 . 3.580 2.231 1.864 3.322 . 0 0 "[ . 1 . 2]" 1
245 1 20 THR MG 1 27 ASP HB3 3.580 . 3.580 3.252 2.076 3.590 0.010 5 0 "[ . 1 . 2]" 1
246 1 23 ASP HA 1 24 GLN HA 5.330 . 5.330 4.933 4.857 4.992 . 0 0 "[ . 1 . 2]" 1
247 1 24 GLN H 1 24 GLN HG2 3.130 . 3.130 3.094 3.004 3.136 0.006 9 0 "[ . 1 . 2]" 1
248 1 23 ASP HA 1 24 GLN HG2 3.780 . 3.780 3.530 3.283 3.736 . 0 0 "[ . 1 . 2]" 1
249 1 24 GLN HA 1 24 GLN HG2 3.240 . 3.240 3.174 3.053 3.246 0.006 1 0 "[ . 1 . 2]" 1
250 1 26 LEU H 1 26 LEU MD1 4.620 . 4.620 4.476 4.426 4.516 . 0 0 "[ . 1 . 2]" 1
251 1 26 LEU HA 1 26 LEU MD1 3.370 . 3.370 2.223 2.135 2.282 . 0 0 "[ . 1 . 2]" 1
252 1 20 THR HA 1 26 LEU MD1 4.670 . 4.670 4.446 4.231 4.634 . 0 0 "[ . 1 . 2]" 1
253 1 26 LEU MD2 1 27 ASP H 4.340 . 4.340 4.170 4.029 4.292 . 0 0 "[ . 1 . 2]" 1
254 1 52 ALA H 2 26 LEU MD2 5.460 . 5.460 5.098 4.485 5.462 0.002 2 0 "[ . 1 . 2]" 1
255 1 20 THR HA 1 26 LEU MD2 4.800 . 4.800 3.817 3.591 4.177 . 0 0 "[ . 1 . 2]" 1
256 1 26 LEU HA 1 27 ASP HB3 5.470 . 5.470 4.478 4.158 4.645 . 0 0 "[ . 1 . 2]" 1
257 1 26 LEU HA 1 27 ASP HB2 5.470 . 5.470 4.847 4.538 5.507 0.037 14 0 "[ . 1 . 2]" 1
258 1 28 VAL HB 1 29 LYS H 4.220 . 4.220 1.984 1.919 2.322 . 0 0 "[ . 1 . 2]" 1
259 1 27 ASP H 1 28 VAL MG1 3.960 . 3.960 3.110 2.778 3.333 . 0 0 "[ . 1 . 2]" 1
260 1 28 VAL H 1 28 VAL MG1 3.870 . 3.870 3.356 3.279 3.431 . 0 0 "[ . 1 . 2]" 1
261 1 28 VAL MG1 1 29 LYS H 3.510 . 3.510 3.256 3.197 3.333 . 0 0 "[ . 1 . 2]" 1
262 1 27 ASP H 1 28 VAL MG2 3.620 . 3.620 3.429 3.229 3.625 0.005 18 0 "[ . 1 . 2]" 1
263 1 20 THR HA 1 28 VAL MG2 4.540 . 4.540 4.297 4.086 4.477 . 0 0 "[ . 1 . 2]" 1
264 1 19 ALA MB 1 28 VAL MG2 3.280 . 3.280 2.630 2.095 2.860 . 0 0 "[ . 1 . 2]" 1
265 1 29 LYS HB2 1 30 LEU H 5.110 . 5.110 3.735 3.548 3.859 . 0 0 "[ . 1 . 2]" 1
266 1 29 LYS HB3 1 30 LEU H 4.350 . 4.350 4.269 4.190 4.310 . 0 0 "[ . 1 . 2]" 1
267 1 29 LYS HB2 1 29 LYS HE2 5.500 . 5.500 3.978 2.187 4.969 . 0 0 "[ . 1 . 2]" 1
268 1 29 LYS HB2 1 29 LYS HE3 5.500 . 5.500 3.584 1.862 4.824 . 0 0 "[ . 1 . 2]" 1
269 1 28 VAL MG1 1 29 LYS HB3 5.090 . 5.090 5.107 5.102 5.112 0.022 8 0 "[ . 1 . 2]" 1
270 1 29 LYS H 1 29 LYS HG3 5.080 . 5.080 4.712 4.405 4.900 . 0 0 "[ . 1 . 2]" 1
271 1 29 LYS H 1 29 LYS HG2 5.080 . 5.080 4.060 3.616 4.508 . 0 0 "[ . 1 . 2]" 1
272 1 29 LYS HG2 1 30 LEU H 4.040 . 4.040 3.023 2.364 3.615 . 0 0 "[ . 1 . 2]" 1
273 1 29 LYS HG3 1 30 LEU H 4.040 . 4.040 3.101 2.528 4.046 0.006 19 0 "[ . 1 . 2]" 1
274 1 18 ARG HA 1 29 LYS HG2 5.290 . 5.290 4.510 3.699 5.286 . 0 0 "[ . 1 . 2]" 1
275 1 18 ARG HA 1 29 LYS HG3 5.290 . 5.290 3.912 3.476 4.709 . 0 0 "[ . 1 . 2]" 1
276 1 29 LYS HA 1 29 LYS HG3 3.850 . 3.850 3.238 2.842 3.862 0.012 14 0 "[ . 1 . 2]" 1
277 1 29 LYS HA 1 29 LYS HG2 3.850 . 3.850 3.339 2.849 3.688 . 0 0 "[ . 1 . 2]" 1
278 1 30 LEU H 1 30 LEU MD1 3.490 . 3.490 1.796 1.784 1.837 0.016 9 0 "[ . 1 . 2]" 1
279 1 30 LEU MD1 1 44 THR H 4.540 . 4.540 4.379 4.147 4.561 0.021 14 0 "[ . 1 . 2]" 1
280 1 28 VAL H 1 30 LEU MD1 5.240 . 5.240 4.954 4.462 5.168 . 0 0 "[ . 1 . 2]" 1
281 1 19 ALA HA 1 30 LEU MD1 4.770 . 4.770 4.059 3.635 4.598 . 0 0 "[ . 1 . 2]" 1
282 1 18 ARG HA 1 30 LEU MD1 4.050 . 4.050 2.748 2.363 3.367 . 0 0 "[ . 1 . 2]" 1
283 1 30 LEU HA 1 30 LEU MD1 4.430 . 4.430 3.442 3.376 3.494 . 0 0 "[ . 1 . 2]" 1
284 1 29 LYS HA 1 30 LEU MD1 4.270 . 4.270 2.487 2.276 2.704 . 0 0 "[ . 1 . 2]" 1
285 1 30 LEU MD1 1 44 THR HB 5.500 . 5.500 4.331 3.378 5.507 0.007 5 0 "[ . 1 . 2]" 1
286 1 29 LYS HB2 1 30 LEU MD1 4.590 . 4.590 4.447 4.169 4.593 0.003 5 0 "[ . 1 . 2]" 1
287 1 30 LEU MD2 1 44 THR H 4.550 . 4.550 4.556 4.456 4.581 0.031 9 0 "[ . 1 . 2]" 1
288 1 57 CYS H 2 30 LEU MD2 4.990 . 4.990 4.308 3.616 4.831 . 0 0 "[ . 1 . 2]" 1
289 1 30 LEU HA 1 30 LEU MD2 3.720 . 3.720 3.515 3.473 3.560 . 0 0 "[ . 1 . 2]" 1
290 1 29 LYS HA 1 30 LEU MD2 4.560 . 4.560 3.955 3.810 4.144 . 0 0 "[ . 1 . 2]" 1
291 1 56 ALA MB 2 30 LEU MD2 2.870 . 2.870 1.868 1.790 2.234 0.010 13 0 "[ . 1 . 2]" 1
292 1 32 ALA H 1 32 ALA MB 3.250 . 3.250 2.242 2.216 2.274 . 0 0 "[ . 1 . 2]" 1
293 1 32 ALA MB 1 40 GLY H 5.130 . 5.130 4.430 3.430 5.137 0.007 16 0 "[ . 1 . 2]" 1
294 1 32 ALA MB 1 38 GLY HA3 3.960 . 3.960 2.675 2.078 3.367 . 0 0 "[ . 1 . 2]" 1
295 1 34 ARG HB3 1 38 GLY H 4.970 . 4.970 4.505 3.741 4.946 . 0 0 "[ . 1 . 2]" 1
296 1 34 ARG H 1 34 ARG HD2 5.500 . 5.500 4.835 4.275 5.277 . 0 0 "[ . 1 . 2]" 1
297 1 34 ARG H 1 34 ARG HD3 5.500 . 5.500 4.952 4.452 5.532 0.032 5 0 "[ . 1 . 2]" 1
298 1 34 ARG HA 1 34 ARG HD2 4.590 . 4.590 3.209 2.125 4.529 . 0 0 "[ . 1 . 2]" 1
299 1 34 ARG HA 1 34 ARG HD3 4.590 . 4.590 3.445 1.869 4.588 . 0 0 "[ . 1 . 2]" 1
300 1 5 TYR HD2 2 35 GLU HA 5.500 . 5.500 5.314 3.688 5.505 0.005 4 0 "[ . 1 . 2]" 1
301 1 35 GLU HA 1 35 GLU HG2 3.830 . 3.830 3.198 2.349 3.801 . 0 0 "[ . 1 . 2]" 1
302 1 35 GLU HA 1 35 GLU HG3 3.830 . 3.830 3.380 2.438 3.824 . 0 0 "[ . 1 . 2]" 1
303 1 5 TYR HD2 2 35 GLU HG3 4.810 . 4.810 3.222 2.268 4.820 0.010 9 0 "[ . 1 . 2]" 1
304 1 5 TYR HD2 2 35 GLU HG2 4.810 . 4.810 3.410 2.001 4.737 . 0 0 "[ . 1 . 2]" 1
305 1 5 TYR HD2 2 36 LEU MD1 4.080 . 4.080 3.862 2.533 4.090 0.010 20 0 "[ . 1 . 2]" 1
306 1 36 LEU H 1 36 LEU MD1 4.060 . 4.060 3.360 2.296 4.002 . 0 0 "[ . 1 . 2]" 1
307 1 5 TYR H 2 36 LEU MD1 4.680 . 4.680 3.766 2.725 4.684 0.004 12 0 "[ . 1 . 2]" 1
308 1 36 LEU HA 1 36 LEU MD1 4.120 . 4.120 3.090 2.069 3.972 . 0 0 "[ . 1 . 2]" 1
309 1 5 TYR HB2 2 36 LEU MD1 4.690 . 4.690 2.474 1.832 3.333 . 0 0 "[ . 1 . 2]" 1
310 1 5 TYR HB3 2 36 LEU MD1 4.690 . 4.690 2.629 1.976 4.591 . 0 0 "[ . 1 . 2]" 1
311 1 35 GLU HB2 1 36 LEU MD1 4.820 . 4.820 3.615 2.200 4.801 . 0 0 "[ . 1 . 2]" 1
312 1 35 GLU HB3 1 36 LEU MD1 4.820 . 4.820 3.845 2.162 4.834 0.014 20 0 "[ . 1 . 2]" 1
313 1 5 TYR HD2 2 36 LEU MD2 4.080 . 4.080 3.699 2.921 4.089 0.009 3 0 "[ . 1 . 2]" 1
314 1 5 TYR H 2 36 LEU MD2 4.680 . 4.680 3.690 2.929 4.684 0.004 9 0 "[ . 1 . 2]" 1
315 1 36 LEU HA 1 36 LEU MD2 4.120 . 4.120 2.812 2.086 3.865 . 0 0 "[ . 1 . 2]" 1
316 1 5 TYR HB2 2 36 LEU MD2 4.690 . 4.690 2.315 1.925 2.886 . 0 0 "[ . 1 . 2]" 1
317 1 35 GLU HB3 1 36 LEU MD2 4.820 . 4.820 3.402 1.870 4.832 0.012 13 0 "[ . 1 . 2]" 1
318 1 36 LEU H 1 37 GLY HA2 5.250 . 5.250 4.657 4.409 4.826 . 0 0 "[ . 1 . 2]" 1
319 1 38 GLY HA2 1 39 ALA MB 4.720 . 4.720 4.192 3.756 4.469 . 0 0 "[ . 1 . 2]" 1
320 1 32 ALA MB 1 38 GLY HA2 3.960 . 3.960 3.119 1.925 3.943 . 0 0 "[ . 1 . 2]" 1
321 1 41 ALA HA 1 42 GLU HA 4.620 . 4.620 4.347 4.305 4.415 . 0 0 "[ . 1 . 2]" 1
322 1 39 ALA H 1 39 ALA MB 2.820 . 2.820 2.499 2.325 2.889 0.069 7 0 "[ . 1 . 2]" 1
323 1 38 GLY HA3 1 39 ALA MB 4.720 . 4.720 4.041 3.856 4.260 . 0 0 "[ . 1 . 2]" 1
324 1 34 ARG HG2 1 39 ALA HA 5.500 . 5.500 4.694 3.692 5.512 0.012 20 0 "[ . 1 . 2]" 1
325 1 34 ARG HG3 1 39 ALA HA 5.500 . 5.500 4.756 3.328 5.510 0.010 13 0 "[ . 1 . 2]" 1
326 1 41 ALA MB 1 42 GLU HA 4.600 . 4.600 4.237 4.076 4.378 . 0 0 "[ . 1 . 2]" 1
327 1 42 GLU HA 1 42 GLU HG3 3.870 . 3.870 3.680 3.071 3.870 0.000 12 0 "[ . 1 . 2]" 1
328 1 42 GLU HB2 1 43 GLY H 5.490 . 5.490 4.109 2.103 4.481 . 0 0 "[ . 1 . 2]" 1
329 1 42 GLU HB3 1 43 GLY H 5.490 . 5.490 4.386 3.435 4.640 . 0 0 "[ . 1 . 2]" 1
330 1 42 GLU H 1 42 GLU HG2 3.760 . 3.760 2.214 1.797 3.503 0.003 7 0 "[ . 1 . 2]" 1
331 1 42 GLU H 1 42 GLU HG3 3.760 . 3.760 2.918 2.059 3.411 . 0 0 "[ . 1 . 2]" 1
332 1 42 GLU HG3 1 43 GLY H 4.920 . 4.920 4.440 1.983 4.954 0.034 5 0 "[ . 1 . 2]" 1
333 1 42 GLU HG2 1 43 GLY H 4.920 . 4.920 4.596 2.371 4.946 0.026 11 0 "[ . 1 . 2]" 1
334 1 42 GLU HA 1 42 GLU HG2 3.870 . 3.870 3.487 2.552 3.757 . 0 0 "[ . 1 . 2]" 1
335 1 41 ALA MB 1 42 GLU HG2 4.800 . 4.800 3.884 3.021 4.822 0.022 17 0 "[ . 1 . 2]" 1
336 1 41 ALA MB 1 42 GLU HG3 4.800 . 4.800 4.308 3.570 4.806 0.006 7 0 "[ . 1 . 2]" 1
337 1 44 THR H 1 44 THR MG 3.850 . 3.850 3.430 2.086 3.880 0.030 11 0 "[ . 1 . 2]" 1
338 1 50 PHE HA 1 50 PHE HE1 4.990 . 4.990 4.886 4.696 4.982 . 0 0 "[ . 1 . 2]" 1
339 1 50 PHE HB2 1 51 ALA H 4.780 . 4.780 3.922 3.794 4.020 . 0 0 "[ . 1 . 2]" 1
340 1 51 ALA MB 1 52 ALA H 3.190 . 3.190 2.325 2.244 2.566 . 0 0 "[ . 1 . 2]" 1
341 1 51 ALA H 1 51 ALA MB 3.040 . 3.040 2.224 2.179 2.241 . 0 0 "[ . 1 . 2]" 1
342 1 48 GLN HA 1 51 ALA MB 3.510 . 3.510 2.393 2.200 2.578 . 0 0 "[ . 1 . 2]" 1
343 1 51 ALA MB 1 81 ALA MB 2.700 . 2.700 1.945 1.787 2.135 0.013 17 0 "[ . 1 . 2]" 1
344 1 52 ALA MB 1 53 GLY H 3.590 . 3.590 2.445 2.315 2.629 . 0 0 "[ . 1 . 2]" 1
345 1 55 SER H 1 56 ALA MB 4.770 . 4.770 4.363 4.257 4.477 . 0 0 "[ . 1 . 2]" 1
346 1 30 LEU MD1 2 56 ALA MB 3.110 . 3.110 2.070 1.803 2.403 . 0 0 "[ . 1 . 2]" 1
347 1 11 SER HB3 2 56 ALA MB 4.410 . 4.410 3.040 2.393 4.316 . 0 0 "[ . 1 . 2]" 1
348 1 61 ALA MB 1 64 PHE HD2 5.280 . 5.280 4.782 4.308 5.105 . 0 0 "[ . 1 . 2]" 1
349 1 58 PHE HA 1 61 ALA MB 3.650 . 3.650 2.467 2.167 2.846 . 0 0 "[ . 1 . 2]" 1
350 1 61 ALA MB 1 64 PHE HB3 4.490 . 4.490 4.198 3.848 4.446 . 0 0 "[ . 1 . 2]" 1
351 1 61 ALA MB 1 64 PHE HB2 5.430 . 5.430 5.181 4.746 5.437 0.007 12 0 "[ . 1 . 2]" 1
352 1 65 VAL HA 1 68 GLN HG2 3.660 . 3.660 2.098 1.896 2.312 . 0 0 "[ . 1 . 2]" 1
353 1 65 VAL HA 1 65 VAL MG2 3.210 . 3.210 2.328 2.300 2.352 . 0 0 "[ . 1 . 2]" 1
354 1 65 VAL HA 1 65 VAL MG1 3.330 . 3.330 2.499 2.457 2.537 . 0 0 "[ . 1 . 2]" 1
355 1 65 VAL H 1 65 VAL MG2 3.310 . 3.310 2.228 2.172 2.304 . 0 0 "[ . 1 . 2]" 1
356 1 65 VAL MG2 1 66 ALA H 4.000 . 4.000 3.887 3.812 4.001 0.001 12 0 "[ . 1 . 2]" 1
357 1 62 MET ME 1 65 VAL MG1 3.830 . 3.830 2.694 2.184 3.444 . 0 0 "[ . 1 . 2]" 1
358 1 66 ALA HA 1 71 GLN HE21 4.340 . 4.340 2.780 2.351 3.037 . 0 0 "[ . 1 . 2]" 1
359 1 66 ALA HA 1 71 GLN HB3 4.900 . 4.900 4.754 4.635 4.908 0.008 12 0 "[ . 1 . 2]" 1
360 1 65 VAL MG1 1 66 ALA HA 3.640 . 3.640 3.200 3.114 3.312 . 0 0 "[ . 1 . 2]" 1
361 1 65 VAL HB 1 66 ALA HA 4.500 . 4.500 4.389 4.291 4.470 . 0 0 "[ . 1 . 2]" 1
362 1 66 ALA MB 1 67 GLY H 3.230 . 3.230 2.740 2.674 2.803 . 0 0 "[ . 1 . 2]" 1
363 1 66 ALA MB 1 71 GLN HE21 4.160 . 4.160 2.099 1.811 2.375 . 0 0 "[ . 1 . 2]" 1
364 1 66 ALA H 1 66 ALA MB 3.080 . 3.080 2.234 2.222 2.241 . 0 0 "[ . 1 . 2]" 1
365 1 66 ALA MB 1 72 THR HA 3.840 . 3.840 2.988 2.577 3.536 . 0 0 "[ . 1 . 2]" 1
366 1 65 VAL HA 1 66 ALA MB 5.100 . 5.100 5.039 5.005 5.051 . 0 0 "[ . 1 . 2]" 1
367 1 66 ALA MB 1 69 ASN HB3 5.310 . 5.310 4.972 4.584 5.311 0.001 13 0 "[ . 1 . 2]" 1
368 1 66 ALA MB 1 69 ASN HB2 4.480 . 4.480 4.004 3.809 4.264 . 0 0 "[ . 1 . 2]" 1
369 1 62 MET ME 1 66 ALA MB 3.450 . 3.450 3.407 3.142 3.463 0.013 20 0 "[ . 1 . 2]" 1
370 1 65 VAL HB 1 66 ALA MB 4.200 . 4.200 4.003 3.858 4.201 0.001 12 0 "[ . 1 . 2]" 1
371 1 68 GLN HA 1 70 LYS H 4.540 . 4.540 3.566 3.495 3.705 . 0 0 "[ . 1 . 2]" 1
372 1 67 GLY H 1 68 GLN HA 5.270 . 5.270 5.207 5.136 5.261 . 0 0 "[ . 1 . 2]" 1
373 1 68 GLN HA 1 68 GLN HE21 5.100 . 5.100 4.816 4.231 5.106 0.006 18 0 "[ . 1 . 2]" 1
374 1 68 GLN HA 1 69 ASN HA 4.760 . 4.760 4.628 4.567 4.678 . 0 0 "[ . 1 . 2]" 1
375 1 68 GLN H 1 68 GLN HB2 4.190 . 4.190 3.666 3.631 3.684 . 0 0 "[ . 1 . 2]" 1
376 1 68 GLN H 1 68 GLN HB3 4.190 . 4.190 2.968 2.902 3.027 . 0 0 "[ . 1 . 2]" 1
377 1 68 GLN HB2 1 69 ASN H 4.430 . 4.430 4.041 3.932 4.163 . 0 0 "[ . 1 . 2]" 1
378 1 65 VAL HA 1 68 GLN HB3 5.000 . 5.000 4.438 4.239 4.679 . 0 0 "[ . 1 . 2]" 1
379 1 65 VAL HA 1 68 GLN HB2 5.000 . 5.000 4.911 4.765 5.004 0.004 11 0 "[ . 1 . 2]" 1
380 1 68 GLN HB3 1 69 ASN H 4.430 . 4.430 4.224 4.144 4.304 . 0 0 "[ . 1 . 2]" 1
381 1 68 GLN HG2 1 70 LYS H 5.500 . 5.500 5.287 5.103 5.460 . 0 0 "[ . 1 . 2]" 1
382 1 68 GLN HG3 1 70 LYS H 5.250 . 5.250 4.824 4.660 4.936 . 0 0 "[ . 1 . 2]" 1
383 1 66 ALA H 1 68 GLN HG3 5.420 . 5.420 5.393 5.331 5.426 0.006 13 0 "[ . 1 . 2]" 1
384 1 68 GLN HA 1 68 GLN HG3 3.760 . 3.760 3.746 3.717 3.773 0.013 2 0 "[ . 1 . 2]" 1
385 1 68 GLN HA 1 68 GLN HG2 3.850 . 3.850 3.763 3.683 3.801 . 0 0 "[ . 1 . 2]" 1
386 1 65 VAL HA 1 68 GLN HG3 3.890 . 3.890 2.900 2.747 3.030 . 0 0 "[ . 1 . 2]" 1
387 1 65 VAL MG1 1 68 GLN HG3 3.910 . 3.910 3.358 2.940 3.493 . 0 0 "[ . 1 . 2]" 1
388 1 69 ASN H 1 69 ASN HB2 3.230 . 3.230 2.281 2.193 2.345 . 0 0 "[ . 1 . 2]" 1
389 1 66 ALA HA 1 69 ASN HB2 4.080 . 4.080 2.319 2.100 2.633 . 0 0 "[ . 1 . 2]" 1
390 1 66 ALA HA 1 69 ASN HB3 4.130 . 4.130 3.661 3.299 4.030 . 0 0 "[ . 1 . 2]" 1
391 1 69 ASN HB3 1 71 GLN HG3 3.750 . 3.750 3.592 3.332 3.750 0.000 18 0 "[ . 1 . 2]" 1
392 1 68 GLN HG3 1 69 ASN HB2 4.070 . 4.070 3.896 3.641 4.075 0.005 14 0 "[ . 1 . 2]" 1
393 1 69 ASN HB3 1 71 GLN HB3 4.300 . 4.300 3.749 3.388 4.095 . 0 0 "[ . 1 . 2]" 1
394 1 65 VAL MG1 1 69 ASN HB3 4.610 . 4.610 4.105 3.907 4.321 . 0 0 "[ . 1 . 2]" 1
395 1 65 VAL MG1 1 69 ASN HB2 4.700 . 4.700 3.061 2.915 3.215 . 0 0 "[ . 1 . 2]" 1
396 1 69 ASN H 1 70 LYS HA 4.840 . 4.840 4.500 4.356 4.624 . 0 0 "[ . 1 . 2]" 1
397 1 70 LYS HA 1 70 LYS HE2 5.500 . 5.500 4.764 4.273 5.009 . 0 0 "[ . 1 . 2]" 1
398 1 70 LYS HA 1 70 LYS HE3 5.500 . 5.500 4.653 4.101 4.908 . 0 0 "[ . 1 . 2]" 1
399 1 89 GLU HB3 1 90 GLU H 4.280 . 4.280 4.210 4.086 4.286 0.006 4 0 "[ . 1 . 2]" 1
400 1 70 LYS H 1 70 LYS HD3 3.640 . 3.640 2.322 2.008 2.681 . 0 0 "[ . 1 . 2]" 1
401 1 70 LYS H 1 70 LYS HD2 3.610 . 3.610 2.850 2.212 3.458 . 0 0 "[ . 1 . 2]" 1
402 1 69 ASN H 1 70 LYS HD2 5.260 . 5.260 4.786 4.089 5.271 0.011 4 0 "[ . 1 . 2]" 1
403 1 70 LYS HD2 1 71 GLN H 5.320 . 5.320 4.867 4.369 5.323 0.003 1 0 "[ . 1 . 2]" 1
404 1 70 LYS HD3 1 71 GLN H 4.910 . 4.910 4.666 4.355 4.922 0.012 12 0 "[ . 1 . 2]" 1
405 1 69 ASN HA 1 70 LYS HD3 4.530 . 4.530 3.637 3.299 3.823 . 0 0 "[ . 1 . 2]" 1
406 1 69 ASN HA 1 70 LYS HD2 5.280 . 5.280 5.035 4.597 5.301 0.021 14 0 "[ . 1 . 2]" 1
407 1 70 LYS HA 1 70 LYS HD2 3.190 . 3.190 2.379 2.102 2.654 . 0 0 "[ . 1 . 2]" 1
408 1 70 LYS HA 1 70 LYS HD3 3.250 . 3.250 2.944 2.544 3.265 0.015 13 0 "[ . 1 . 2]" 1
409 1 70 LYS H 1 70 LYS HE2 5.500 . 5.500 4.745 4.154 5.105 . 0 0 "[ . 1 . 2]" 1
410 1 70 LYS H 1 70 LYS HE3 5.500 . 5.500 4.631 4.168 5.141 . 0 0 "[ . 1 . 2]" 1
411 1 71 GLN HB3 1 71 GLN HE21 4.570 . 4.570 4.250 4.114 4.585 0.015 14 0 "[ . 1 . 2]" 1
412 1 71 GLN HB2 1 71 GLN HE21 4.640 . 4.640 3.218 2.967 4.009 . 0 0 "[ . 1 . 2]" 1
413 1 70 LYS H 1 71 GLN HB3 5.380 . 5.380 5.347 5.191 5.385 0.005 9 0 "[ . 1 . 2]" 1
414 1 71 GLN H 1 71 GLN HB2 3.990 . 3.990 3.734 3.681 3.798 . 0 0 "[ . 1 . 2]" 1
415 1 66 ALA MB 1 71 GLN HB2 4.410 . 4.410 4.001 3.777 4.397 . 0 0 "[ . 1 . 2]" 1
416 1 71 GLN HE21 1 71 GLN HG2 3.370 . 3.370 3.317 3.005 3.393 0.023 18 0 "[ . 1 . 2]" 1
417 1 70 LYS H 1 71 GLN HG3 4.700 . 4.700 4.504 4.324 4.704 0.004 12 0 "[ . 1 . 2]" 1
418 1 70 LYS H 1 71 GLN HG2 4.630 . 4.630 4.239 4.062 4.633 0.003 14 0 "[ . 1 . 2]" 1
419 1 71 GLN H 1 71 GLN HG2 3.580 . 3.580 2.573 2.417 2.931 . 0 0 "[ . 1 . 2]" 1
420 1 71 GLN HG2 1 72 THR H 4.980 . 4.980 4.894 4.852 4.978 . 0 0 "[ . 1 . 2]" 1
421 1 71 GLN HE22 1 71 GLN HG2 4.030 . 4.030 3.982 3.815 4.024 . 0 0 "[ . 1 . 2]" 1
422 1 71 GLN HA 1 71 GLN HG3 3.620 . 3.620 3.625 3.596 3.638 0.018 5 0 "[ . 1 . 2]" 1
423 1 71 GLN HA 1 71 GLN HG2 4.120 . 4.120 3.873 3.798 4.041 . 0 0 "[ . 1 . 2]" 1
424 1 69 ASN HA 1 71 GLN HG2 4.660 . 4.660 4.285 4.153 4.567 . 0 0 "[ . 1 . 2]" 1
425 1 69 ASN HA 1 71 GLN HG3 5.500 . 5.500 5.507 5.484 5.519 0.019 16 0 "[ . 1 . 2]" 1
426 1 69 ASN HB3 1 71 GLN HG2 3.790 . 3.790 2.053 1.846 2.229 . 0 0 "[ . 1 . 2]" 1
427 1 69 ASN HB2 1 71 GLN HG2 3.740 . 3.740 2.410 2.218 2.589 . 0 0 "[ . 1 . 2]" 1
428 1 69 ASN HB2 1 71 GLN HG3 3.740 . 3.740 3.150 3.007 3.264 . 0 0 "[ . 1 . 2]" 1
429 1 66 ALA MB 1 71 GLN HG3 3.830 . 3.830 2.279 2.127 2.454 . 0 0 "[ . 1 . 2]" 1
430 1 66 ALA MB 1 71 GLN HG2 4.100 . 4.100 3.733 3.557 3.893 . 0 0 "[ . 1 . 2]" 1
431 1 71 GLN HG3 1 73 LEU HG 4.430 . 4.430 4.224 3.889 4.434 0.004 18 0 "[ . 1 . 2]" 1
432 1 72 THR HA 1 72 THR MG 3.160 . 3.160 2.284 2.239 2.332 . 0 0 "[ . 1 . 2]" 1
433 1 72 THR HA 1 73 LEU HG 4.240 . 4.240 3.616 3.297 3.858 . 0 0 "[ . 1 . 2]" 1
434 1 72 THR HB 1 73 LEU H 3.310 . 3.310 3.088 2.869 3.316 0.006 4 0 "[ . 1 . 2]" 1
435 1 72 THR HA 1 72 THR HB 2.950 . 2.950 2.556 2.516 2.608 . 0 0 "[ . 1 . 2]" 1
436 1 72 THR HB 1 73 LEU HG 5.500 . 5.500 5.355 5.057 5.512 0.012 5 0 "[ . 1 . 2]" 1
437 1 72 THR H 1 72 THR MG 3.340 . 3.340 3.097 2.891 3.255 . 0 0 "[ . 1 . 2]" 1
438 1 10 THR MG 1 20 THR H 4.610 . 4.610 3.690 3.228 4.617 0.007 15 0 "[ . 1 . 2]" 1
439 1 66 ALA H 1 73 LEU HG 4.930 . 4.930 4.850 4.689 4.933 0.003 16 0 "[ . 1 . 2]" 1
440 1 73 LEU HA 1 73 LEU HG 3.370 . 3.370 3.190 3.014 3.402 0.032 12 0 "[ . 1 . 2]" 1
441 1 74 PRO HB2 1 75 ALA HA 4.830 . 4.830 4.822 4.738 4.841 0.011 15 0 "[ . 1 . 2]" 1
442 1 76 ASP HB2 1 77 THR H 4.740 . 4.740 4.347 3.861 4.456 . 0 0 "[ . 1 . 2]" 1
443 1 76 ASP HB3 1 104 PRO HD2 4.940 . 4.940 4.558 4.339 4.943 0.003 13 0 "[ . 1 . 2]" 1
444 1 75 ALA HA 1 76 ASP HB2 5.500 . 5.500 5.514 5.501 5.528 0.028 16 0 "[ . 1 . 2]" 1
445 1 76 ASP HB3 1 104 PRO HG3 3.520 . 3.520 2.160 1.842 2.434 . 0 0 "[ . 1 . 2]" 1
446 1 76 ASP HB3 1 104 PRO HB3 4.310 . 4.310 3.854 3.262 4.263 . 0 0 "[ . 1 . 2]" 1
447 1 75 ALA MB 1 76 ASP HB2 4.370 . 4.370 4.299 4.098 4.383 0.013 13 0 "[ . 1 . 2]" 1
448 1 77 THR HB 1 104 PRO HB3 5.500 . 5.500 5.517 5.509 5.523 0.023 13 0 "[ . 1 . 2]" 1
449 1 77 THR HA 1 77 THR MG 3.220 . 3.220 3.219 3.211 3.222 0.002 7 0 "[ . 1 . 2]" 1
450 1 78 THR HA 1 78 THR MG 2.910 . 2.910 2.330 2.220 2.411 . 0 0 "[ . 1 . 2]" 1
451 1 78 THR MG 1 79 VAL H 3.330 . 3.330 2.533 2.143 3.344 0.014 13 0 "[ . 1 . 2]" 1
452 1 79 VAL H 1 79 VAL MG1 4.160 . 4.160 3.872 3.812 3.901 . 0 0 "[ . 1 . 2]" 1
453 1 56 ALA H 1 79 VAL MG1 5.360 . 5.360 5.134 4.700 5.365 0.005 6 0 "[ . 1 . 2]" 1
454 1 79 VAL MG1 1 80 THR H 3.760 . 3.760 2.696 2.292 2.972 . 0 0 "[ . 1 . 2]" 1
455 1 55 SER HA 1 79 VAL MG1 3.580 . 3.580 2.896 2.393 3.130 . 0 0 "[ . 1 . 2]" 1
456 1 79 VAL MG1 1 99 LEU MD2 4.200 . 4.200 3.076 2.732 3.816 . 0 0 "[ . 1 . 2]" 1
457 1 80 THR HB 1 100 ARG HB2 4.660 . 4.660 2.708 1.806 3.475 . 0 0 "[ . 1 . 2]" 1
458 1 80 THR HA 1 80 THR MG 3.420 . 3.420 2.342 2.278 2.411 . 0 0 "[ . 1 . 2]" 1
459 1 80 THR MG 1 82 GLU HB2 3.900 . 3.900 3.035 2.796 3.446 . 0 0 "[ . 1 . 2]" 1
460 1 52 ALA H 1 81 ALA MB 4.060 . 4.060 3.901 3.464 4.066 0.006 19 0 "[ . 1 . 2]" 1
461 1 82 GLU HA 1 82 GLU HG3 4.160 . 4.160 2.509 2.390 2.678 . 0 0 "[ . 1 . 2]" 1
462 1 8 ALA HA 2 82 GLU HG3 4.890 . 4.890 2.886 2.371 3.749 . 0 0 "[ . 1 . 2]" 1
463 1 8 ALA HA 2 82 GLU HG2 4.890 . 4.890 4.225 3.890 4.737 . 0 0 "[ . 1 . 2]" 1
464 1 8 ALA MB 2 82 GLU HG2 4.370 . 4.370 3.646 3.480 3.991 . 0 0 "[ . 1 . 2]" 1
465 1 8 ALA MB 2 82 GLU HG3 4.370 . 4.370 2.085 1.909 2.515 . 0 0 "[ . 1 . 2]" 1
466 1 10 THR HA 1 11 SER HA 4.830 . 4.830 4.404 4.370 4.464 . 0 0 "[ . 1 . 2]" 1
467 1 85 ILE HG12 1 86 GLY H 4.280 . 4.280 2.551 2.319 2.623 . 0 0 "[ . 1 . 2]" 1
468 1 85 ILE HG12 1 93 PHE QD 4.920 . 4.920 4.001 3.809 4.374 . 0 0 "[ . 1 . 2]" 1
469 1 85 ILE HG13 1 93 PHE QD 4.920 . 4.920 4.390 4.093 4.870 . 0 0 "[ . 1 . 2]" 1
470 1 85 ILE H 1 85 ILE MG 3.210 . 3.210 2.253 2.135 2.344 . 0 0 "[ . 1 . 2]" 1
471 1 4 LEU H 2 85 ILE MG 4.500 . 4.500 3.730 3.648 3.839 . 0 0 "[ . 1 . 2]" 1
472 1 6 LYS H 2 85 ILE MG 4.810 . 4.810 4.743 4.660 4.818 0.008 3 0 "[ . 1 . 2]" 1
473 1 5 TYR HD1 2 85 ILE MG 3.390 . 3.390 2.973 2.774 3.234 . 0 0 "[ . 1 . 2]" 1
474 1 84 GLY HA2 1 85 ILE MG 4.110 . 4.110 3.423 3.315 3.515 . 0 0 "[ . 1 . 2]" 1
475 1 6 LYS HA 2 85 ILE MG 4.550 . 4.550 4.037 3.868 4.219 . 0 0 "[ . 1 . 2]" 1
476 1 4 LEU HA 2 85 ILE MG 5.260 . 5.260 5.264 5.244 5.272 0.012 4 0 "[ . 1 . 2]" 1
477 1 84 GLY HA3 1 85 ILE MG 4.580 . 4.580 4.431 4.284 4.581 0.001 9 0 "[ . 1 . 2]" 1
478 1 5 TYR HB2 2 85 ILE MG 3.900 . 3.900 3.301 3.117 3.543 . 0 0 "[ . 1 . 2]" 1
479 1 5 TYR HB3 2 85 ILE MG 3.900 . 3.900 2.100 1.941 2.274 . 0 0 "[ . 1 . 2]" 1
480 1 85 ILE MD 1 86 GLY H 3.750 . 3.750 2.915 2.775 3.066 . 0 0 "[ . 1 . 2]" 1
481 1 85 ILE MD 1 94 ALA H 4.530 . 4.530 3.523 3.349 3.713 . 0 0 "[ . 1 . 2]" 1
482 1 85 ILE MD 1 93 PHE QD 3.780 . 3.780 2.329 2.022 2.932 . 0 0 "[ . 1 . 2]" 1
483 1 85 ILE HA 1 85 ILE MD 4.060 . 4.060 3.386 3.321 3.424 . 0 0 "[ . 1 . 2]" 1
484 1 85 ILE HB 1 85 ILE MD 3.200 . 3.200 3.206 3.202 3.210 0.010 12 0 "[ . 1 . 2]" 1
485 1 85 ILE MD 1 85 ILE MG 2.970 . 2.970 1.921 1.906 1.930 . 0 0 "[ . 1 . 2]" 1
486 1 87 PRO HB2 1 93 PHE QD 5.500 . 5.500 5.330 4.662 5.505 0.005 9 0 "[ . 1 . 2]" 1
487 1 87 PRO HB3 1 93 PHE QD 4.630 . 4.630 4.078 3.400 4.408 . 0 0 "[ . 1 . 2]" 1
488 1 88 ASN HB3 1 89 GLU H 4.800 . 4.800 3.803 3.619 3.985 . 0 0 "[ . 1 . 2]" 1
489 1 89 GLU HA 1 89 GLU HB2 2.920 . 2.920 2.483 2.436 2.526 . 0 0 "[ . 1 . 2]" 1
490 1 89 GLU H 1 89 GLU HB3 4.160 . 4.160 2.599 2.513 2.722 . 0 0 "[ . 1 . 2]" 1
491 1 89 GLU HB2 1 90 GLU H 4.350 . 4.350 4.044 3.899 4.176 . 0 0 "[ . 1 . 2]" 1
492 1 88 ASN HA 1 89 GLU HB3 4.760 . 4.760 4.619 4.508 4.716 . 0 0 "[ . 1 . 2]" 1
493 1 90 GLU HB3 1 91 GLY H 4.250 . 4.250 3.074 2.974 3.156 . 0 0 "[ . 1 . 2]" 1
494 1 90 GLU HB3 1 92 GLY H 4.800 . 4.800 3.297 2.776 3.709 . 0 0 "[ . 1 . 2]" 1
495 1 90 GLU HB2 1 91 GLY H 4.290 . 4.290 4.184 4.127 4.236 . 0 0 "[ . 1 . 2]" 1
496 1 90 GLU HB3 1 91 GLY HA2 5.440 . 5.440 5.174 5.064 5.268 . 0 0 "[ . 1 . 2]" 1
497 1 90 GLU HB2 1 90 GLU HG3 2.740 . 2.740 2.450 2.387 2.526 . 0 0 "[ . 1 . 2]" 1
498 1 90 GLU HG2 1 92 GLY H 4.500 . 4.500 4.032 3.283 4.415 . 0 0 "[ . 1 . 2]" 1
499 1 90 GLU HA 1 90 GLU HG3 2.900 . 2.900 2.683 2.610 2.780 . 0 0 "[ . 1 . 2]" 1
500 1 90 GLU HG3 1 91 GLY HA3 5.380 . 5.380 5.222 5.002 5.383 0.003 17 0 "[ . 1 . 2]" 1
501 1 90 GLU HG2 1 91 GLY HA3 5.500 . 5.500 4.087 3.957 4.250 . 0 0 "[ . 1 . 2]" 1
502 1 89 GLU HG3 1 90 GLU H 3.590 . 3.590 2.896 2.548 3.293 . 0 0 "[ . 1 . 2]" 1
503 1 88 ASN H 1 92 GLY HA3 4.830 . 4.830 4.356 3.988 4.670 . 0 0 "[ . 1 . 2]" 1
504 1 88 ASN H 1 92 GLY HA2 4.830 . 4.830 4.566 4.347 4.824 . 0 0 "[ . 1 . 2]" 1
505 1 94 ALA H 1 94 ALA MB 3.370 . 3.370 2.632 2.434 2.716 . 0 0 "[ . 1 . 2]" 1
506 1 86 GLY H 1 94 ALA MB 3.590 . 3.590 3.497 3.378 3.594 0.004 14 0 "[ . 1 . 2]" 1
507 1 94 ALA MB 1 95 LEU H 3.240 . 3.240 2.967 2.687 3.198 . 0 0 "[ . 1 . 2]" 1
508 1 92 GLY H 1 94 ALA MB 5.500 . 5.500 5.453 5.157 5.512 0.012 18 0 "[ . 1 . 2]" 1
509 1 88 ASN HB2 1 94 ALA MB 3.870 . 3.870 2.142 1.801 3.226 . 0 0 "[ . 1 . 2]" 1
510 1 88 ASN HB3 1 94 ALA MB 3.870 . 3.870 3.281 1.807 3.876 0.006 16 0 "[ . 1 . 2]" 1
511 1 85 ILE H 1 95 LEU MD1 4.880 . 4.880 4.265 3.854 4.737 . 0 0 "[ . 1 . 2]" 1
512 1 86 GLY H 1 95 LEU MD1 5.350 . 5.350 4.417 4.247 5.320 . 0 0 "[ . 1 . 2]" 1
513 1 95 LEU HA 1 95 LEU MD1 4.410 . 4.410 2.049 1.994 2.370 . 0 0 "[ . 1 . 2]" 1
514 1 86 GLY H 1 95 LEU MD2 4.010 . 4.010 4.002 3.884 4.017 0.007 10 0 "[ . 1 . 2]" 1
515 1 95 LEU H 1 95 LEU MD2 4.080 . 4.080 2.663 2.528 3.841 . 0 0 "[ . 1 . 2]" 1
516 1 85 ILE HA 1 95 LEU MD2 3.940 . 3.940 3.327 2.519 3.615 . 0 0 "[ . 1 . 2]" 1
517 1 95 LEU HA 1 95 LEU MD2 3.540 . 3.540 2.392 1.934 2.437 . 0 0 "[ . 1 . 2]" 1
518 1 94 ALA HA 1 95 LEU MD2 4.570 . 4.570 3.263 3.094 4.576 0.006 13 0 "[ . 1 . 2]" 1
519 1 85 ILE HB 1 95 LEU MD2 3.430 . 3.430 3.222 2.125 3.437 0.007 16 0 "[ . 1 . 2]" 1
520 1 86 GLY H 1 96 ASP HB2 5.380 . 5.380 5.349 5.083 5.390 0.010 15 0 "[ . 1 . 2]" 1
521 1 1 MET ME 2 96 ASP HB2 4.540 . 4.540 2.880 2.279 3.751 . 0 0 "[ . 1 . 2]" 1
522 1 3 ILE HG13 2 96 ASP HB3 4.790 . 4.790 3.789 3.320 4.367 . 0 0 "[ . 1 . 2]" 1
523 1 3 ILE HG13 2 96 ASP HB2 5.030 . 5.030 4.678 4.075 5.031 0.001 10 0 "[ . 1 . 2]" 1
524 1 137 VAL H 1 137 VAL HB 4.160 . 4.160 3.445 3.299 3.581 . 0 0 "[ . 1 . 2]" 1
525 1 137 VAL HB 1 138 VAL H 4.940 . 4.940 4.063 3.814 4.150 . 0 0 "[ . 1 . 2]" 1
526 1 100 ARG HA 1 137 VAL HB 4.870 . 4.870 4.581 4.499 4.674 . 0 0 "[ . 1 . 2]" 1
527 1 99 LEU HA 1 99 LEU MD2 4.160 . 4.160 2.828 1.937 3.870 . 0 0 "[ . 1 . 2]" 1
528 1 99 LEU H 1 99 LEU MD1 4.650 . 4.650 4.038 3.881 4.174 . 0 0 "[ . 1 . 2]" 1
529 1 99 LEU HA 1 99 LEU MD1 4.160 . 4.160 2.994 1.905 3.875 . 0 0 "[ . 1 . 2]" 1
530 1 79 VAL MG1 1 99 LEU MD1 4.200 . 4.200 3.212 2.107 4.120 . 0 0 "[ . 1 . 2]" 1
531 1 136 LEU MD2 1 137 VAL H 3.540 . 3.540 3.350 3.126 3.494 . 0 0 "[ . 1 . 2]" 1
532 1 99 LEU HA 1 136 LEU MD2 5.240 . 5.240 4.693 4.475 4.887 . 0 0 "[ . 1 . 2]" 1
533 1 116 ASP HA 1 136 LEU MD2 5.250 . 5.250 4.982 4.459 5.263 0.013 2 0 "[ . 1 . 2]" 1
534 1 115 VAL HA 1 136 LEU MD2 5.080 . 5.080 4.978 4.746 5.082 0.002 18 0 "[ . 1 . 2]" 1
535 1 119 HIS HB3 1 136 LEU MD2 4.580 . 4.580 3.930 3.369 4.430 . 0 0 "[ . 1 . 2]" 1
536 1 119 HIS HB2 1 136 LEU MD2 4.580 . 4.580 3.568 3.039 4.425 . 0 0 "[ . 1 . 2]" 1
537 1 136 LEU HB2 1 136 LEU MD2 3.460 . 3.460 3.208 3.198 3.214 . 0 0 "[ . 1 . 2]" 1
538 1 136 LEU HB3 1 136 LEU MD2 3.130 . 3.130 2.397 2.355 2.438 . 0 0 "[ . 1 . 2]" 1
539 1 80 THR H 1 100 ARG HB3 4.750 . 4.750 3.186 2.366 3.949 . 0 0 "[ . 1 . 2]" 1
540 1 80 THR HB 1 100 ARG HB3 4.660 . 4.660 2.688 1.874 3.684 . 0 0 "[ . 1 . 2]" 1
541 1 100 ARG H 1 100 ARG HG3 4.830 . 4.830 3.644 2.360 4.612 . 0 0 "[ . 1 . 2]" 1
542 1 80 THR H 1 100 ARG HD2 5.500 . 5.500 5.008 4.105 5.515 0.015 20 0 "[ . 1 . 2]" 1
543 1 80 THR H 1 100 ARG HD3 5.500 . 5.500 5.131 4.231 5.518 0.018 19 0 "[ . 1 . 2]" 1
544 1 100 ARG HA 1 100 ARG HD2 4.810 . 4.810 4.540 4.278 4.814 0.004 20 0 "[ . 1 . 2]" 1
545 1 100 ARG HD3 1 137 VAL MG2 4.480 . 4.480 3.891 3.272 4.495 0.015 9 0 "[ . 1 . 2]" 1
546 1 101 VAL HB 1 102 ALA H 4.540 . 4.540 4.399 4.303 4.443 . 0 0 "[ . 1 . 2]" 1
547 1 101 VAL H 1 138 VAL MG1 5.200 . 5.200 4.105 3.512 4.348 . 0 0 "[ . 1 . 2]" 1
548 1 102 ALA H 1 102 ALA MB 2.970 . 2.970 2.340 2.301 2.421 . 0 0 "[ . 1 . 2]" 1
549 1 101 VAL H 1 102 ALA MB 5.040 . 5.040 4.919 4.715 5.028 . 0 0 "[ . 1 . 2]" 1
550 1 78 THR HA 1 102 ALA MB 5.120 . 5.120 4.550 4.303 4.690 . 0 0 "[ . 1 . 2]" 1
551 1 78 THR HB 1 102 ALA MB 4.110 . 4.110 2.969 2.516 3.723 . 0 0 "[ . 1 . 2]" 1
552 1 103 LEU HB2 1 104 PRO HD2 5.000 . 5.000 4.356 4.098 4.710 . 0 0 "[ . 1 . 2]" 1
553 1 103 LEU HB3 1 104 PRO HD2 5.000 . 5.000 4.075 2.874 4.479 . 0 0 "[ . 1 . 2]" 1
554 1 103 LEU HB2 1 104 PRO HD3 5.500 . 5.500 4.874 4.679 5.143 . 0 0 "[ . 1 . 2]" 1
555 1 103 LEU HB3 1 104 PRO HD3 5.500 . 5.500 4.811 4.067 5.065 . 0 0 "[ . 1 . 2]" 1
556 1 104 PRO HA 1 105 GLY HA2 4.660 . 4.660 4.443 4.406 4.498 . 0 0 "[ . 1 . 2]" 1
557 1 104 PRO HA 1 106 LEU HB3 4.860 . 4.860 4.474 4.209 4.661 . 0 0 "[ . 1 . 2]" 1
558 1 103 LEU H 1 104 PRO HD3 4.750 . 4.750 4.477 4.252 4.753 0.003 11 0 "[ . 1 . 2]" 1
559 1 74 PRO HB2 1 104 PRO HD2 4.030 . 4.030 2.825 2.464 3.325 . 0 0 "[ . 1 . 2]" 1
560 1 104 PRO HD2 1 106 LEU HB3 5.280 . 5.280 5.245 4.937 5.292 0.012 15 0 "[ . 1 . 2]" 1
561 1 76 ASP HB3 1 104 PRO HG2 3.790 . 3.790 3.157 2.799 3.795 0.005 13 0 "[ . 1 . 2]" 1
562 1 74 PRO HB3 1 104 PRO HG2 4.480 . 4.480 2.656 2.149 2.979 . 0 0 "[ . 1 . 2]" 1
563 1 90 GLU HB3 1 91 GLY HA3 5.200 . 5.200 4.899 4.776 4.999 . 0 0 "[ . 1 . 2]" 1
564 1 104 PRO HB2 1 105 GLY HA3 4.900 . 4.900 4.071 3.959 4.114 . 0 0 "[ . 1 . 2]" 1
565 1 104 PRO HB3 1 105 GLY HA3 5.500 . 5.500 5.496 5.424 5.509 0.009 18 0 "[ . 1 . 2]" 1
566 1 104 PRO HG2 1 105 GLY HA3 5.090 . 5.090 4.895 4.660 5.092 0.002 15 0 "[ . 1 . 2]" 1
567 1 106 LEU H 1 106 LEU HB2 3.760 . 3.760 3.213 3.115 3.334 . 0 0 "[ . 1 . 2]" 1
568 1 106 LEU H 1 106 LEU HB3 3.590 . 3.590 2.497 2.392 2.582 . 0 0 "[ . 1 . 2]" 1
569 1 106 LEU HB2 1 107 ASP H 3.980 . 3.980 3.967 3.917 3.986 0.006 11 0 "[ . 1 . 2]" 1
570 1 106 LEU HB2 1 106 LEU MD1 3.320 . 3.320 2.399 2.370 2.436 . 0 0 "[ . 1 . 2]" 1
571 1 106 LEU HB2 1 114 LEU MD1 4.000 . 4.000 3.946 3.805 4.010 0.010 19 0 "[ . 1 . 2]" 1
572 1 106 LEU H 1 106 LEU HG 4.360 . 4.360 4.279 4.185 4.338 . 0 0 "[ . 1 . 2]" 1
573 1 106 LEU HG 1 114 LEU MD1 3.970 . 3.970 3.888 3.738 3.970 0.000 2 0 "[ . 1 . 2]" 1
574 1 106 LEU MD1 1 107 ASP H 3.090 . 3.090 1.799 1.790 1.850 0.010 17 0 "[ . 1 . 2]" 1
575 1 106 LEU HA 1 106 LEU MD1 2.790 . 2.790 2.266 2.195 2.352 . 0 0 "[ . 1 . 2]" 1
576 1 106 LEU MD1 1 110 ALA MB 2.490 . 2.490 1.926 1.878 2.010 . 0 0 "[ . 1 . 2]" 1
577 1 106 LEU MD1 1 107 ASP HB3 4.400 . 4.400 3.918 3.604 4.412 0.012 14 0 "[ . 1 . 2]" 1
578 1 106 LEU MD1 1 111 ALA HA 3.370 . 3.370 2.806 2.628 2.981 . 0 0 "[ . 1 . 2]" 1
579 1 107 ASP HA 1 108 ALA HA 4.440 . 4.440 4.391 4.345 4.422 . 0 0 "[ . 1 . 2]" 1
580 1 107 ASP HB2 1 111 ALA H 4.580 . 4.580 4.408 3.678 4.609 0.029 13 0 "[ . 1 . 2]" 1
581 1 107 ASP HB3 1 111 ALA H 4.570 . 4.570 3.737 3.250 4.578 0.008 12 0 "[ . 1 . 2]" 1
582 1 107 ASP HA 1 107 ASP HB3 2.950 . 2.950 2.811 2.443 2.963 0.013 16 0 "[ . 1 . 2]" 1
583 1 107 ASP HB2 1 110 ALA MB 3.230 . 3.230 2.907 2.238 3.226 . 0 0 "[ . 1 . 2]" 1
584 1 106 LEU MD1 1 107 ASP HB2 3.650 . 3.650 3.430 3.092 3.653 0.003 16 0 "[ . 1 . 2]" 1
585 1 108 ALA HA 1 111 ALA H 4.080 . 4.080 3.527 3.222 3.821 . 0 0 "[ . 1 . 2]" 1
586 1 108 ALA HA 1 110 ALA H 4.830 . 4.830 4.605 4.325 4.764 . 0 0 "[ . 1 . 2]" 1
587 1 107 ASP HB3 1 108 ALA MB 4.280 . 4.280 4.297 4.235 4.316 0.036 11 0 "[ . 1 . 2]" 1
588 1 109 ALA HA 1 111 ALA H 5.080 . 5.080 4.601 4.472 4.716 . 0 0 "[ . 1 . 2]" 1
589 1 109 ALA MB 1 110 ALA H 2.850 . 2.850 2.412 2.342 2.519 . 0 0 "[ . 1 . 2]" 1
590 1 110 ALA HA 1 112 LYS H 4.430 . 4.430 4.244 3.986 4.432 0.002 2 0 "[ . 1 . 2]" 1
591 1 106 LEU MD1 1 110 ALA HA 4.850 . 4.850 4.099 3.988 4.298 . 0 0 "[ . 1 . 2]" 1
592 1 110 ALA HA 1 114 LEU HG 5.200 . 5.200 3.994 3.805 4.201 . 0 0 "[ . 1 . 2]" 1
593 1 109 ALA H 1 110 ALA HA 5.440 . 5.440 5.350 5.273 5.434 . 0 0 "[ . 1 . 2]" 1
594 1 107 ASP HB3 1 110 ALA MB 3.980 . 3.980 3.045 2.530 3.981 0.001 19 0 "[ . 1 . 2]" 1
595 1 110 ALA MB 1 114 LEU MD1 3.440 . 3.440 3.022 2.807 3.307 . 0 0 "[ . 1 . 2]" 1
596 1 110 ALA MB 1 114 LEU MD2 3.760 . 3.760 3.577 3.389 3.729 . 0 0 "[ . 1 . 2]" 1
597 1 110 ALA H 1 111 ALA HA 5.330 . 5.330 5.139 5.015 5.227 . 0 0 "[ . 1 . 2]" 1
598 1 111 ALA HA 1 114 LEU HB2 3.850 . 3.850 2.482 2.248 2.664 . 0 0 "[ . 1 . 2]" 1
599 1 111 ALA HA 1 138 VAL HB 4.970 . 4.970 4.533 4.325 4.980 0.010 19 0 "[ . 1 . 2]" 1
600 1 111 ALA H 1 111 ALA MB 2.900 . 2.900 2.235 2.189 2.255 . 0 0 "[ . 1 . 2]" 1
601 1 110 ALA H 1 111 ALA MB 4.220 . 4.220 4.173 4.015 4.228 0.008 4 0 "[ . 1 . 2]" 1
602 1 109 ALA H 1 111 ALA MB 4.700 . 4.700 4.510 4.283 4.631 . 0 0 "[ . 1 . 2]" 1
603 1 108 ALA HA 1 111 ALA MB 3.070 . 3.070 2.291 1.944 2.577 . 0 0 "[ . 1 . 2]" 1
604 1 111 ALA MB 1 138 VAL HA 4.530 . 4.530 4.024 3.875 4.418 . 0 0 "[ . 1 . 2]" 1
605 1 111 ALA MB 1 138 VAL MG1 3.730 . 3.730 2.686 1.799 2.961 0.001 19 0 "[ . 1 . 2]" 1
606 1 106 LEU MD1 1 111 ALA MB 2.930 . 2.930 2.940 2.931 2.949 0.019 4 0 "[ . 1 . 2]" 1
607 1 112 LYS HA 1 115 VAL HB 4.360 . 4.360 3.443 3.079 3.783 . 0 0 "[ . 1 . 2]" 1
608 1 112 LYS HA 1 138 VAL HB 4.440 . 4.440 4.326 3.158 4.446 0.006 6 0 "[ . 1 . 2]" 1
609 1 112 LYS HA 1 115 VAL MG2 4.220 . 4.220 3.905 3.662 4.177 . 0 0 "[ . 1 . 2]" 1
610 1 111 ALA MB 1 138 VAL HB 3.300 . 3.300 2.130 1.930 2.703 . 0 0 "[ . 1 . 2]" 1
611 1 112 LYS H 1 112 LYS HG3 4.040 . 4.040 2.907 2.045 3.854 . 0 0 "[ . 1 . 2]" 1
612 1 112 LYS H 1 112 LYS HG2 4.040 . 4.040 3.098 2.267 3.806 . 0 0 "[ . 1 . 2]" 1
613 1 112 LYS HA 1 112 LYS HG2 3.820 . 3.820 2.636 2.425 2.947 . 0 0 "[ . 1 . 2]" 1
614 1 112 LYS HA 1 112 LYS HG3 3.820 . 3.820 3.286 2.814 3.763 . 0 0 "[ . 1 . 2]" 1
615 1 112 LYS HG2 1 138 VAL MG2 5.060 . 5.060 2.729 2.133 3.336 . 0 0 "[ . 1 . 2]" 1
616 1 112 LYS HG3 1 138 VAL MG2 5.060 . 5.060 3.160 1.938 4.349 . 0 0 "[ . 1 . 2]" 1
617 1 112 LYS HG2 1 138 VAL MG1 5.060 . 5.060 3.233 2.578 4.659 . 0 0 "[ . 1 . 2]" 1
618 1 112 LYS HG3 1 138 VAL MG1 5.060 . 5.060 3.936 2.908 4.875 . 0 0 "[ . 1 . 2]" 1
619 1 112 LYS H 1 112 LYS HD3 4.930 . 4.930 4.387 3.711 4.878 . 0 0 "[ . 1 . 2]" 1
620 1 112 LYS HA 1 112 LYS HD2 4.750 . 4.750 3.919 2.030 4.756 0.006 9 0 "[ . 1 . 2]" 1
621 1 112 LYS HA 1 112 LYS HD3 4.750 . 4.750 3.679 2.020 4.757 0.007 17 0 "[ . 1 . 2]" 1
622 1 113 THR HB 1 114 LEU MD2 4.730 . 4.730 4.735 4.733 4.738 0.008 15 0 "[ . 1 . 2]" 1
623 1 112 LYS HB2 1 113 THR HB 4.500 . 4.500 4.083 3.831 4.322 . 0 0 "[ . 1 . 2]" 1
624 1 113 THR MG 1 114 LEU H 3.290 . 3.290 2.205 2.080 2.294 . 0 0 "[ . 1 . 2]" 1
625 1 112 LYS H 1 113 THR HA 5.420 . 5.420 5.416 5.384 5.429 0.009 13 0 "[ . 1 . 2]" 1
626 1 113 THR HA 1 115 VAL H 4.680 . 4.680 4.637 4.522 4.686 0.006 2 0 "[ . 1 . 2]" 1
627 1 113 THR HA 1 116 ASP HB2 3.890 . 3.890 2.908 2.767 2.990 . 0 0 "[ . 1 . 2]" 1
628 1 112 LYS HB3 1 113 THR HA 4.390 . 4.390 4.178 3.983 4.329 . 0 0 "[ . 1 . 2]" 1
629 1 113 THR HA 1 113 THR MG 3.180 . 3.180 3.186 3.181 3.192 0.012 6 0 "[ . 1 . 2]" 1
630 1 114 LEU HG 1 115 VAL H 4.530 . 4.530 4.224 4.121 4.297 . 0 0 "[ . 1 . 2]" 1
631 1 114 LEU HA 1 114 LEU MD2 3.000 . 3.000 2.017 1.984 2.046 . 0 0 "[ . 1 . 2]" 1
632 1 114 LEU HB2 1 114 LEU MD1 3.340 . 3.340 2.436 2.422 2.459 . 0 0 "[ . 1 . 2]" 1
633 1 114 LEU HB3 1 114 LEU MD1 3.620 . 3.620 2.318 2.303 2.332 . 0 0 "[ . 1 . 2]" 1
634 1 111 ALA HA 1 114 LEU MD1 3.250 . 3.250 2.740 2.599 2.909 . 0 0 "[ . 1 . 2]" 1
635 1 114 LEU H 1 114 LEU MD2 3.730 . 3.730 2.993 2.918 3.091 . 0 0 "[ . 1 . 2]" 1
636 1 114 LEU MD1 1 115 VAL H 4.990 . 4.990 4.497 4.412 4.590 . 0 0 "[ . 1 . 2]" 1
637 1 114 LEU MD2 1 115 VAL H 5.350 . 5.350 4.517 4.469 4.540 . 0 0 "[ . 1 . 2]" 1
638 1 115 VAL HA 1 118 ALA MB 3.790 . 3.790 2.377 2.143 2.703 . 0 0 "[ . 1 . 2]" 1
639 1 115 VAL HA 1 115 VAL MG2 3.700 . 3.700 2.383 2.318 2.418 . 0 0 "[ . 1 . 2]" 1
640 1 115 VAL MG2 1 139 ALA H 4.850 . 4.850 4.519 4.068 4.853 0.003 17 0 "[ . 1 . 2]" 1
641 1 114 LEU H 1 115 VAL MG2 4.630 . 4.630 4.217 4.074 4.340 . 0 0 "[ . 1 . 2]" 1
642 1 101 VAL HA 1 115 VAL MG2 5.200 . 5.200 4.713 4.591 4.831 . 0 0 "[ . 1 . 2]" 1
643 1 101 VAL HB 1 115 VAL MG2 3.340 . 3.340 2.395 2.220 2.566 . 0 0 "[ . 1 . 2]" 1
644 1 114 LEU HB2 1 115 VAL MG2 3.610 . 3.610 3.119 2.990 3.307 . 0 0 "[ . 1 . 2]" 1
645 1 115 VAL MG2 1 136 LEU MD1 5.110 . 5.110 4.627 4.365 4.813 . 0 0 "[ . 1 . 2]" 1
646 1 115 VAL MG2 1 136 LEU MD2 4.130 . 4.130 4.113 3.955 4.139 0.009 3 0 "[ . 1 . 2]" 1
647 1 115 VAL MG2 1 116 ASP HA 5.500 . 5.500 5.441 5.391 5.476 . 0 0 "[ . 1 . 2]" 1
648 1 116 ASP HB3 1 117 ARG HA 4.540 . 4.540 4.134 4.004 4.338 . 0 0 "[ . 1 . 2]" 1
649 1 113 THR HB 1 116 ASP HB2 5.500 . 5.500 5.461 5.337 5.510 0.010 8 0 "[ . 1 . 2]" 1
650 1 116 ASP HB2 1 117 ARG HA 5.500 . 5.500 5.502 5.459 5.514 0.014 19 0 "[ . 1 . 2]" 1
651 1 113 THR HA 1 116 ASP HB3 4.030 . 4.030 2.463 2.203 2.616 . 0 0 "[ . 1 . 2]" 1
652 1 113 THR MG 1 116 ASP HB2 5.430 . 5.430 5.405 5.288 5.445 0.015 11 0 "[ . 1 . 2]" 1
653 1 113 THR MG 1 116 ASP HB3 4.720 . 4.720 4.584 4.372 4.733 0.013 1 0 "[ . 1 . 2]" 1
654 1 117 ARG HB2 1 118 ALA H 4.620 . 4.620 3.688 3.544 3.840 . 0 0 "[ . 1 . 2]" 1
655 1 117 ARG H 1 117 ARG HD2 4.180 . 4.180 3.762 3.645 3.907 . 0 0 "[ . 1 . 2]" 1
656 1 117 ARG H 1 117 ARG HD3 4.180 . 4.180 4.193 4.172 4.221 0.041 17 0 "[ . 1 . 2]" 1
657 1 117 ARG HD2 1 118 ALA H 5.020 . 5.020 4.782 4.406 4.843 . 0 0 "[ . 1 . 2]" 1
658 1 117 ARG HD3 1 118 ALA H 5.020 . 5.020 4.444 4.375 4.782 . 0 0 "[ . 1 . 2]" 1
659 1 34 ARG HD2 1 38 GLY H 5.310 . 5.310 4.044 2.385 5.312 0.002 1 0 "[ . 1 . 2]" 1
660 1 34 ARG HD3 1 38 GLY H 5.310 . 5.310 4.332 2.617 5.318 0.008 12 0 "[ . 1 . 2]" 1
661 1 117 ARG HB2 1 118 ALA HA 5.040 . 5.040 4.519 4.384 4.649 . 0 0 "[ . 1 . 2]" 1
662 1 118 ALA MB 1 119 HIS H 3.650 . 3.650 2.428 2.265 2.639 . 0 0 "[ . 1 . 2]" 1
663 1 114 LEU HA 1 118 ALA MB 4.300 . 4.300 4.261 4.115 4.310 0.010 19 0 "[ . 1 . 2]" 1
664 1 120 HIS H 1 120 HIS HB2 3.730 . 3.730 2.696 2.308 3.019 . 0 0 "[ . 1 . 2]" 1
665 1 120 HIS H 1 120 HIS HB3 3.730 . 3.730 2.818 2.270 3.719 . 0 0 "[ . 1 . 2]" 1
666 1 120 HIS HB3 1 121 VAL H 4.590 . 4.590 2.911 2.404 3.581 . 0 0 "[ . 1 . 2]" 1
667 1 120 HIS HB2 1 121 VAL H 4.590 . 4.590 3.584 2.396 4.127 . 0 0 "[ . 1 . 2]" 1
668 1 120 HIS HB3 1 121 VAL MG2 6.190 . 6.190 4.244 3.536 5.204 . 0 0 "[ . 1 . 2]" 1
669 1 120 HIS HB3 1 121 VAL MG1 6.190 . 6.190 3.048 2.447 3.952 . 0 0 "[ . 1 . 2]" 1
670 1 120 HIS HB2 1 121 VAL MG1 6.190 . 6.190 4.052 2.720 4.665 . 0 0 "[ . 1 . 2]" 1
671 1 127 ALA HA 1 131 ASN HB3 4.480 . 4.480 2.931 2.099 3.577 . 0 0 "[ . 1 . 2]" 1
672 1 127 ALA MB 1 128 THR H 3.590 . 3.590 3.356 3.088 3.485 . 0 0 "[ . 1 . 2]" 1
673 1 127 ALA MB 1 129 ARG H 4.700 . 4.700 4.435 4.245 4.713 0.013 3 0 "[ . 1 . 2]" 1
674 1 127 ALA MB 1 128 THR HA 4.140 . 4.140 3.994 3.803 4.144 0.004 18 0 "[ . 1 . 2]" 1
675 1 128 THR H 1 128 THR MG 3.100 . 3.100 2.401 2.102 2.761 . 0 0 "[ . 1 . 2]" 1
676 1 128 THR HA 1 128 THR MG 3.210 . 3.210 3.196 3.135 3.216 0.006 19 0 "[ . 1 . 2]" 1
677 1 128 THR H 1 129 ARG HA 4.950 . 4.950 4.778 4.661 4.838 . 0 0 "[ . 1 . 2]" 1
678 1 129 ARG HA 1 130 ASN HA 4.930 . 4.930 4.681 4.620 4.734 . 0 0 "[ . 1 . 2]" 1
679 1 128 THR H 1 129 ARG HB2 5.500 . 5.500 5.524 5.507 5.539 0.039 1 0 "[ . 1 . 2]" 1
680 1 128 THR H 1 129 ARG HB3 4.890 . 4.890 4.469 4.270 4.899 0.009 17 0 "[ . 1 . 2]" 1
681 1 129 ARG H 1 129 ARG HG2 4.320 . 4.320 2.224 2.020 2.589 . 0 0 "[ . 1 . 2]" 1
682 1 128 THR H 1 129 ARG HG3 4.880 . 4.880 4.588 3.749 4.885 0.005 18 0 "[ . 1 . 2]" 1
683 1 128 THR H 1 129 ARG HG2 4.880 . 4.880 3.201 2.974 3.426 . 0 0 "[ . 1 . 2]" 1
684 1 129 ARG HG3 1 130 ASN HD22 5.180 . 5.180 2.995 2.623 3.416 . 0 0 "[ . 1 . 2]" 1
685 1 129 ARG HG3 1 130 ASN HD21 5.180 . 5.180 2.885 1.994 3.879 . 0 0 "[ . 1 . 2]" 1
686 1 129 ARG HG2 1 130 ASN HD21 5.180 . 5.180 3.860 2.748 5.146 . 0 0 "[ . 1 . 2]" 1
687 1 129 ARG HG2 1 130 ASN H 4.350 . 4.350 2.466 2.094 3.124 . 0 0 "[ . 1 . 2]" 1
688 1 129 ARG HA 1 129 ARG HG2 4.220 . 4.220 3.745 3.656 3.823 . 0 0 "[ . 1 . 2]" 1
689 1 129 ARG HA 1 129 ARG HG3 4.220 . 4.220 3.794 3.712 3.889 . 0 0 "[ . 1 . 2]" 1
690 1 129 ARG H 1 129 ARG HD2 4.780 . 4.780 4.548 4.064 4.796 0.016 3 0 "[ . 1 . 2]" 1
691 1 129 ARG H 1 129 ARG HD3 4.780 . 4.780 4.587 4.119 4.796 0.016 11 0 "[ . 1 . 2]" 1
692 1 129 ARG HD2 1 130 ASN H 4.710 . 4.710 4.499 4.161 4.717 0.007 20 0 "[ . 1 . 2]" 1
693 1 128 THR MG 1 129 ARG HD2 5.070 . 5.070 4.127 3.421 5.079 0.009 6 0 "[ . 1 . 2]" 1
694 1 128 THR MG 1 129 ARG HD3 5.070 . 5.070 4.440 3.213 5.078 0.008 9 0 "[ . 1 . 2]" 1
695 1 129 ARG HB2 1 129 ARG HD2 4.090 . 4.090 3.008 2.352 3.750 . 0 0 "[ . 1 . 2]" 1
696 1 129 ARG HB2 1 129 ARG HD3 4.090 . 4.090 3.366 2.469 3.826 . 0 0 "[ . 1 . 2]" 1
697 1 132 VAL HA 1 132 VAL MG1 3.660 . 3.660 2.389 2.338 2.447 . 0 0 "[ . 1 . 2]" 1
698 1 132 VAL HA 1 132 VAL MG2 3.660 . 3.660 2.490 2.390 3.208 . 0 0 "[ . 1 . 2]" 1
699 1 132 VAL HA 1 133 ALA MB 3.980 . 3.980 3.980 3.947 3.990 0.010 4 0 "[ . 1 . 2]" 1
700 1 133 ALA H 1 133 ALA MB 3.010 . 3.010 2.280 2.233 2.365 . 0 0 "[ . 1 . 2]" 1
701 1 97 VAL H 1 134 VAL HA 4.770 . 4.770 2.701 2.268 3.028 . 0 0 "[ . 1 . 2]" 1
702 1 134 VAL HB 1 135 ARG H 4.900 . 4.900 4.256 3.975 4.369 . 0 0 "[ . 1 . 2]" 1
703 1 97 VAL H 1 134 VAL MG1 4.570 . 4.570 4.210 3.893 4.576 0.006 6 0 "[ . 1 . 2]" 1
704 1 134 VAL H 1 134 VAL MG1 4.010 . 4.010 3.839 3.796 3.899 . 0 0 "[ . 1 . 2]" 1
705 1 54 TYR HD2 1 134 VAL MG1 5.070 . 5.070 4.788 3.942 5.078 0.008 6 0 "[ . 1 . 2]" 1
706 1 134 VAL HA 1 134 VAL MG1 3.530 . 3.530 2.360 2.248 2.462 . 0 0 "[ . 1 . 2]" 1
707 1 133 ALA HA 1 134 VAL MG1 5.500 . 5.500 5.518 5.510 5.527 0.027 2 0 "[ . 1 . 2]" 1
708 1 134 VAL MG1 1 136 LEU MD2 3.360 . 3.360 2.724 2.330 3.083 . 0 0 "[ . 1 . 2]" 1
709 1 99 LEU MD1 1 134 VAL MG1 4.070 . 4.070 2.814 1.996 3.944 . 0 0 "[ . 1 . 2]" 1
710 1 99 LEU MD2 1 134 VAL MG1 4.070 . 4.070 3.116 2.548 3.491 . 0 0 "[ . 1 . 2]" 1
711 1 119 HIS HD2 1 136 LEU MD1 3.680 . 3.680 3.317 2.199 3.692 0.012 19 0 "[ . 1 . 2]" 1
712 1 119 HIS H 1 136 LEU MD1 4.730 . 4.730 4.409 3.745 4.736 0.006 5 0 "[ . 1 . 2]" 1
713 1 116 ASP HA 1 136 LEU MD1 3.910 . 3.910 3.087 2.433 3.590 . 0 0 "[ . 1 . 2]" 1
714 1 119 HIS HB2 1 136 LEU MD1 4.090 . 4.090 2.976 2.037 3.908 . 0 0 "[ . 1 . 2]" 1
715 1 119 HIS HB3 1 136 LEU MD1 4.090 . 4.090 2.861 2.381 3.722 . 0 0 "[ . 1 . 2]" 1
716 1 115 VAL HA 1 136 LEU MD1 5.320 . 5.320 4.944 4.499 5.317 . 0 0 "[ . 1 . 2]" 1
717 1 134 VAL HB 1 136 LEU MD1 5.080 . 5.080 4.808 4.408 5.084 0.004 3 0 "[ . 1 . 2]" 1
718 1 136 LEU HB3 1 136 LEU MD1 3.130 . 3.130 2.397 2.352 2.447 . 0 0 "[ . 1 . 2]" 1
719 1 136 LEU HG 1 137 VAL H 5.060 . 5.060 4.992 4.811 5.070 0.010 12 0 "[ . 1 . 2]" 1
720 1 135 ARG HA 1 136 LEU HG 5.130 . 5.130 4.425 4.138 4.688 . 0 0 "[ . 1 . 2]" 1
721 1 99 LEU H 1 99 LEU HG 4.720 . 4.720 3.633 2.755 4.625 . 0 0 "[ . 1 . 2]" 1
722 1 137 VAL HA 1 137 VAL MG1 3.220 . 3.220 3.144 3.123 3.167 . 0 0 "[ . 1 . 2]" 1
723 1 100 ARG HA 1 137 VAL MG1 3.830 . 3.830 1.923 1.792 2.182 0.008 18 0 "[ . 1 . 2]" 1
724 1 137 VAL H 1 137 VAL MG1 3.190 . 3.190 2.008 1.848 2.165 . 0 0 "[ . 1 . 2]" 1
725 1 101 VAL H 1 137 VAL MG1 4.120 . 4.120 3.694 3.558 3.924 . 0 0 "[ . 1 . 2]" 1
726 1 136 LEU MD2 1 137 VAL MG1 4.270 . 4.270 4.278 4.207 4.291 0.021 2 0 "[ . 1 . 2]" 1
727 1 101 VAL H 1 137 VAL MG2 3.840 . 3.840 3.581 3.432 3.696 . 0 0 "[ . 1 . 2]" 1
728 1 137 VAL H 1 137 VAL MG2 3.720 . 3.720 3.657 3.600 3.711 . 0 0 "[ . 1 . 2]" 1
729 1 100 ARG H 1 137 VAL MG2 4.990 . 4.990 4.930 4.778 5.005 0.015 5 0 "[ . 1 . 2]" 1
730 1 137 VAL MG2 1 139 ALA H 4.460 . 4.460 4.410 4.296 4.464 0.004 12 0 "[ . 1 . 2]" 1
731 1 137 VAL MG2 1 138 VAL H 3.020 . 3.020 2.960 2.596 3.031 0.011 19 0 "[ . 1 . 2]" 1
732 1 100 ARG HA 1 137 VAL MG2 3.680 . 3.680 2.652 2.445 2.782 . 0 0 "[ . 1 . 2]" 1
733 1 137 VAL MG2 1 138 VAL HA 3.900 . 3.900 3.775 3.632 3.867 . 0 0 "[ . 1 . 2]" 1
734 1 137 VAL HA 1 137 VAL MG2 2.940 . 2.940 2.665 2.620 2.728 . 0 0 "[ . 1 . 2]" 1
735 1 100 ARG HD2 1 137 VAL MG2 4.480 . 4.480 4.115 3.322 4.505 0.025 19 0 "[ . 1 . 2]" 1
736 1 138 VAL HB 1 139 ALA H 4.310 . 4.310 2.954 2.823 3.808 . 0 0 "[ . 1 . 2]" 1
737 1 109 ALA HA 1 112 LYS HB2 3.700 . 3.700 3.356 2.956 3.703 0.003 17 0 "[ . 1 . 2]" 1
738 1 101 VAL H 1 101 VAL MG1 4.640 . 4.640 3.853 3.835 3.872 . 0 0 "[ . 1 . 2]" 1
739 1 138 VAL HA 1 138 VAL MG2 3.330 . 3.330 3.153 2.611 3.202 . 0 0 "[ . 1 . 2]" 1
740 1 111 ALA MB 1 138 VAL MG2 3.730 . 3.730 2.301 2.052 3.467 . 0 0 "[ . 1 . 2]" 1
741 1 138 VAL H 1 139 ALA HA 5.310 . 5.310 5.154 4.913 5.244 . 0 0 "[ . 1 . 2]" 1
742 1 101 VAL H 1 139 ALA HA 5.500 . 5.500 5.487 5.302 5.510 0.010 5 0 "[ . 1 . 2]" 1
743 1 102 ALA HA 1 139 ALA HA 4.980 . 4.980 4.377 4.148 4.836 . 0 0 "[ . 1 . 2]" 1
744 1 138 VAL HA 1 139 ALA HA 4.620 . 4.620 4.386 4.299 4.419 . 0 0 "[ . 1 . 2]" 1
745 1 138 VAL HB 1 139 ALA HA 5.400 . 5.400 4.815 4.673 4.910 . 0 0 "[ . 1 . 2]" 1
746 1 137 VAL MG2 1 139 ALA HA 4.250 . 4.250 4.230 4.066 4.257 0.007 10 0 "[ . 1 . 2]" 1
747 1 139 ALA H 1 139 ALA MB 2.600 . 2.600 2.499 2.297 2.573 . 0 0 "[ . 1 . 2]" 1
748 1 101 VAL H 1 139 ALA MB 4.020 . 4.020 3.706 3.550 4.030 0.010 19 0 "[ . 1 . 2]" 1
749 1 138 VAL HA 1 139 ALA MB 3.940 . 3.940 3.845 3.801 3.881 . 0 0 "[ . 1 . 2]" 1
750 1 102 ALA HA 1 139 ALA MB 3.030 . 3.030 2.023 1.796 2.110 0.004 19 0 "[ . 1 . 2]" 1
751 1 79 VAL MG2 1 102 ALA H 4.430 . 4.430 3.180 2.886 3.658 . 0 0 "[ . 1 . 2]" 1
752 1 79 VAL H 1 79 VAL MG2 4.210 . 4.210 2.937 2.821 3.005 . 0 0 "[ . 1 . 2]" 1
753 1 48 GLN H 1 48 GLN HG2 4.560 . 4.560 4.436 4.265 4.569 0.009 8 0 "[ . 1 . 2]" 1
754 1 48 GLN H 1 48 GLN HG3 4.560 . 4.560 4.534 4.449 4.578 0.018 12 0 "[ . 1 . 2]" 1
755 1 48 GLN HG3 1 51 ALA MB 5.340 . 5.340 4.619 3.166 5.206 . 0 0 "[ . 1 . 2]" 1
756 1 48 GLN HG2 1 51 ALA MB 5.340 . 5.340 3.892 3.374 4.788 . 0 0 "[ . 1 . 2]" 1
757 1 35 GLU H 1 35 GLU HG2 4.750 . 4.750 2.926 1.897 4.599 . 0 0 "[ . 1 . 2]" 1
758 1 35 GLU H 1 35 GLU HG3 4.750 . 4.750 3.617 2.221 4.537 . 0 0 "[ . 1 . 2]" 1
759 1 121 VAL HB 1 122 CYS H 4.610 . 4.610 4.001 3.525 4.375 . 0 0 "[ . 1 . 2]" 1
760 1 113 THR MG 1 117 ARG HD3 3.390 . 3.390 3.311 3.194 3.407 0.017 17 0 "[ . 1 . 2]" 1
761 1 113 THR MG 1 117 ARG HD2 3.390 . 3.390 3.227 2.304 3.391 0.001 1 0 "[ . 1 . 2]" 1
762 1 49 LEU MD1 1 51 ALA H 5.190 . 5.190 5.036 4.882 5.179 . 0 0 "[ . 1 . 2]" 1
763 1 49 LEU MD1 1 54 TYR H 5.500 . 5.500 5.309 5.108 5.503 0.003 18 0 "[ . 1 . 2]" 1
764 1 54 TYR H 2 49 LEU MD1 5.500 . 5.500 4.261 3.849 4.584 . 0 0 "[ . 1 . 2]" 1
765 1 49 LEU MD2 1 52 ALA H 5.290 . 5.290 4.774 4.505 5.035 . 0 0 "[ . 1 . 2]" 1
766 1 53 GLY HA3 2 49 LEU MD1 4.220 . 4.220 1.908 1.795 2.107 0.005 14 0 "[ . 1 . 2]" 1
767 1 49 LEU MD2 1 52 ALA MB 3.630 . 3.630 3.255 2.876 3.631 0.001 1 0 "[ . 1 . 2]" 1
768 1 3 ILE HG12 1 4 LEU H 5.180 . 5.180 4.957 4.919 5.009 . 0 0 "[ . 1 . 2]" 1
769 1 85 ILE H 2 3 ILE HG13 5.110 . 5.110 4.914 4.760 5.073 . 0 0 "[ . 1 . 2]" 1
770 1 103 LEU H 1 103 LEU HG 4.760 . 4.760 4.334 3.357 4.771 0.011 15 0 "[ . 1 . 2]" 1
771 1 77 THR HB 1 103 LEU HG 4.590 . 4.590 4.231 3.487 4.623 0.033 20 0 "[ . 1 . 2]" 1
772 1 106 LEU MD2 1 111 ALA H 3.690 . 3.690 3.461 3.351 3.590 . 0 0 "[ . 1 . 2]" 1
773 1 106 LEU MD2 1 107 ASP H 4.520 . 4.520 4.293 4.231 4.362 . 0 0 "[ . 1 . 2]" 1
774 1 106 LEU MD2 1 112 LYS H 5.090 . 5.090 4.877 4.763 5.062 . 0 0 "[ . 1 . 2]" 1
775 1 106 LEU H 1 106 LEU MD2 4.600 . 4.600 4.431 4.321 4.499 . 0 0 "[ . 1 . 2]" 1
776 1 106 LEU HA 1 106 LEU MD2 4.000 . 4.000 3.942 3.921 3.970 . 0 0 "[ . 1 . 2]" 1
777 1 106 LEU MD2 1 111 ALA HA 3.110 . 3.110 1.913 1.794 2.109 0.006 16 0 "[ . 1 . 2]" 1
778 1 104 PRO HD2 1 106 LEU MD2 5.430 . 5.430 5.326 5.086 5.435 0.005 12 0 "[ . 1 . 2]" 1
779 1 106 LEU MD2 1 111 ALA MB 2.560 . 2.560 2.107 1.929 2.262 . 0 0 "[ . 1 . 2]" 1
780 1 3 ILE MG 1 4 LEU HG 5.190 . 5.190 4.712 4.565 4.949 . 0 0 "[ . 1 . 2]" 1
781 1 4 LEU HA 1 4 LEU MD2 2.890 . 2.890 2.058 2.023 2.095 . 0 0 "[ . 1 . 2]" 1
782 1 2 ASN HD22 1 4 LEU MD2 4.000 . 4.000 3.108 2.652 3.413 . 0 0 "[ . 1 . 2]" 1
783 1 4 LEU H 1 4 LEU MD2 3.750 . 3.750 3.397 3.220 3.523 . 0 0 "[ . 1 . 2]" 1
784 1 74 PRO HB3 1 77 THR H 5.500 . 5.500 4.962 4.573 5.502 0.002 9 0 "[ . 1 . 2]" 1
785 1 74 PRO HB3 1 76 ASP H 4.750 . 4.750 3.322 2.919 3.989 . 0 0 "[ . 1 . 2]" 1
786 1 74 PRO HB3 1 104 PRO HD3 5.500 . 5.500 5.333 4.934 5.514 0.014 9 0 "[ . 1 . 2]" 1
787 1 74 PRO HB3 1 104 PRO HD2 4.360 . 4.360 4.246 3.732 4.373 0.013 17 0 "[ . 1 . 2]" 1
788 1 115 VAL H 1 115 VAL MG1 3.780 . 3.780 3.778 3.761 3.783 0.003 9 0 "[ . 1 . 2]" 1
789 1 115 VAL HA 1 115 VAL MG1 3.520 . 3.520 2.440 2.402 2.521 . 0 0 "[ . 1 . 2]" 1
790 1 115 VAL MG1 1 116 ASP HA 4.190 . 4.190 3.555 3.300 3.652 . 0 0 "[ . 1 . 2]" 1
791 1 115 VAL MG1 1 136 LEU MD1 3.270 . 3.270 2.259 1.962 2.702 . 0 0 "[ . 1 . 2]" 1
792 1 115 VAL MG1 1 136 LEU MD2 3.360 . 3.360 2.120 1.976 2.326 . 0 0 "[ . 1 . 2]" 1
793 1 121 VAL H 1 121 VAL MG1 3.670 . 3.670 2.404 2.175 2.716 . 0 0 "[ . 1 . 2]" 1
794 1 101 VAL H 1 101 VAL MG2 4.640 . 4.640 2.470 2.338 2.575 . 0 0 "[ . 1 . 2]" 1
795 1 101 VAL HA 1 101 VAL MG2 3.740 . 3.740 2.446 2.428 2.470 . 0 0 "[ . 1 . 2]" 1
796 1 4 LEU MD1 2 93 PHE QD 3.820 . 3.820 3.387 3.036 3.716 . 0 0 "[ . 1 . 2]" 1
797 1 64 PHE HD2 1 65 VAL MG2 3.770 . 3.770 3.364 3.079 3.773 0.003 16 0 "[ . 1 . 2]" 1
798 1 64 PHE HA 1 64 PHE HD1 3.270 . 3.270 2.478 2.288 2.688 . 0 0 "[ . 1 . 2]" 1
799 1 64 PHE HD2 1 65 VAL H 4.480 . 4.480 3.724 3.395 4.100 . 0 0 "[ . 1 . 2]" 1
800 1 64 PHE HA 1 64 PHE HE1 4.800 . 4.800 4.693 4.560 4.804 0.004 15 0 "[ . 1 . 2]" 1
801 1 64 PHE HB3 1 64 PHE HE2 4.640 . 4.640 4.621 4.610 4.632 . 0 0 "[ . 1 . 2]" 1
802 1 54 TYR HA 1 54 TYR HD1 3.600 . 3.600 2.178 2.032 2.654 . 0 0 "[ . 1 . 2]" 1
803 1 54 TYR H 1 54 TYR HD1 4.660 . 4.660 4.645 4.597 4.670 0.010 18 0 "[ . 1 . 2]" 1
804 1 54 TYR HD1 1 58 PHE HB2 4.780 . 4.780 3.503 2.604 4.060 . 0 0 "[ . 1 . 2]" 1
805 1 54 TYR HA 1 54 TYR HE1 4.720 . 4.720 4.601 4.486 4.734 0.014 18 0 "[ . 1 . 2]" 1
806 1 50 PHE HE2 1 51 ALA HA 4.910 . 4.910 4.697 4.355 4.911 0.001 5 0 "[ . 1 . 2]" 1
807 1 119 HIS HD2 1 136 LEU MD2 4.750 . 4.750 3.409 2.463 4.752 0.002 5 0 "[ . 1 . 2]" 1
808 1 1 MET HA 1 2 ASN H 2.700 . 2.700 2.637 2.470 2.705 0.005 18 0 "[ . 1 . 2]" 1
809 1 2 ASN H 1 2 ASN HB2 3.150 . 3.150 2.709 2.576 2.943 . 0 0 "[ . 1 . 2]" 1
810 1 1 MET HG3 1 2 ASN H 3.660 . 3.660 2.982 2.646 3.176 . 0 0 "[ . 1 . 2]" 1
811 1 1 MET HB2 1 2 ASN H 3.020 . 3.020 2.047 1.922 2.306 . 0 0 "[ . 1 . 2]" 1
812 1 2 ASN H 1 2 ASN HB3 3.150 . 3.150 2.511 2.425 2.580 . 0 0 "[ . 1 . 2]" 1
813 1 85 ILE MD 2 4 LEU H 4.900 . 4.900 3.700 3.621 3.801 . 0 0 "[ . 1 . 2]" 1
814 1 4 LEU H 1 4 LEU HG 4.340 . 4.340 2.456 2.324 2.558 . 0 0 "[ . 1 . 2]" 1
815 1 2 ASN H 1 3 ILE H 3.900 . 3.900 3.864 3.744 3.910 0.010 4 0 "[ . 1 . 2]" 1
816 1 3 ILE H 1 4 LEU H 4.590 . 4.590 4.513 4.414 4.566 . 0 0 "[ . 1 . 2]" 1
817 1 2 ASN HA 1 3 ILE H 2.690 . 2.690 2.343 2.251 2.434 . 0 0 "[ . 1 . 2]" 1
818 1 1 MET HA 1 3 ILE H 5.240 . 5.240 4.949 4.691 5.248 0.008 9 0 "[ . 1 . 2]" 1
819 1 3 ILE H 1 3 ILE HB 2.910 . 2.910 2.465 2.432 2.504 . 0 0 "[ . 1 . 2]" 1
820 1 3 ILE H 1 3 ILE HG12 3.200 . 3.200 2.144 2.050 2.205 . 0 0 "[ . 1 . 2]" 1
821 1 3 ILE H 1 3 ILE HG13 3.520 . 3.520 3.526 3.487 3.536 0.016 7 0 "[ . 1 . 2]" 1
822 1 3 ILE H 1 3 ILE MD 3.480 . 3.480 3.398 3.273 3.483 0.003 7 0 "[ . 1 . 2]" 1
823 1 4 LEU H 1 5 TYR H 3.910 . 3.910 2.341 2.233 2.450 . 0 0 "[ . 1 . 2]" 1
824 1 85 ILE H 2 5 TYR H 4.050 . 4.050 2.846 2.730 2.918 . 0 0 "[ . 1 . 2]" 1
825 1 5 TYR H 1 5 TYR HD1 4.800 . 4.800 4.660 4.562 4.728 . 0 0 "[ . 1 . 2]" 1
826 1 3 ILE HA 1 5 TYR H 4.190 . 4.190 3.888 3.626 4.077 . 0 0 "[ . 1 . 2]" 1
827 1 4 LEU HG 1 5 TYR H 4.430 . 4.430 4.182 4.041 4.242 . 0 0 "[ . 1 . 2]" 1
828 1 85 ILE MG 2 5 TYR H 3.380 . 3.380 2.542 2.479 2.640 . 0 0 "[ . 1 . 2]" 1
829 1 3 ILE MG 1 5 TYR H 3.330 . 3.330 2.407 2.281 2.572 . 0 0 "[ . 1 . 2]" 1
830 1 85 ILE MD 2 5 TYR H 3.750 . 3.750 3.757 3.753 3.765 0.015 14 0 "[ . 1 . 2]" 1
831 1 121 VAL H 1 121 VAL MG2 3.670 . 3.670 2.045 1.975 2.196 . 0 0 "[ . 1 . 2]" 1
832 1 121 VAL H 1 122 CYS H 4.460 . 4.460 2.410 1.999 2.689 . 0 0 "[ . 1 . 2]" 1
833 1 5 TYR HD1 1 6 LYS H 3.750 . 3.750 3.628 3.314 3.758 0.008 20 0 "[ . 1 . 2]" 1
834 1 5 TYR H 1 6 LYS H 4.260 . 4.260 4.264 4.219 4.279 0.019 12 0 "[ . 1 . 2]" 1
835 1 5 TYR HB2 1 6 LYS H 4.380 . 4.380 4.267 4.114 4.375 . 0 0 "[ . 1 . 2]" 1
836 1 5 TYR HB3 1 6 LYS H 4.380 . 4.380 4.132 4.016 4.250 . 0 0 "[ . 1 . 2]" 1
837 1 6 LYS H 1 6 LYS HB2 3.810 . 3.810 3.373 3.212 3.474 . 0 0 "[ . 1 . 2]" 1
838 1 6 LYS H 1 6 LYS HB3 3.810 . 3.810 2.766 2.653 2.833 . 0 0 "[ . 1 . 2]" 1
839 1 3 ILE MG 1 6 LYS H 3.720 . 3.720 3.461 3.232 3.559 . 0 0 "[ . 1 . 2]" 1
840 1 83 VAL H 2 7 THR H 4.330 . 4.330 3.431 3.329 3.556 . 0 0 "[ . 1 . 2]" 1
841 1 85 ILE H 2 7 THR H 5.500 . 5.500 5.463 5.243 5.511 0.011 10 0 "[ . 1 . 2]" 1
842 1 7 THR H 1 8 ALA H 4.650 . 4.650 4.391 4.312 4.456 . 0 0 "[ . 1 . 2]" 1
843 1 6 LYS H 1 7 THR H 4.440 . 4.440 4.300 4.191 4.383 . 0 0 "[ . 1 . 2]" 1
844 1 5 TYR HD1 1 7 THR H 4.520 . 4.520 4.126 3.843 4.457 . 0 0 "[ . 1 . 2]" 1
845 1 6 LYS HA 1 7 THR H 3.500 . 3.500 2.161 2.091 2.213 . 0 0 "[ . 1 . 2]" 1
846 1 82 GLU HA 2 7 THR H 4.970 . 4.970 4.839 4.655 4.973 0.003 18 0 "[ . 1 . 2]" 1
847 1 7 THR H 1 7 THR MG 3.250 . 3.250 2.276 2.073 2.523 . 0 0 "[ . 1 . 2]" 1
848 1 8 ALA H 1 9 ALA H 4.560 . 4.560 4.438 4.241 4.514 . 0 0 "[ . 1 . 2]" 1
849 1 82 GLU HA 2 8 ALA H 4.680 . 4.680 4.632 4.484 4.687 0.007 18 0 "[ . 1 . 2]" 1
850 1 7 THR HA 1 8 ALA H 3.130 . 3.130 2.395 2.239 2.642 . 0 0 "[ . 1 . 2]" 1
851 1 7 THR HB 1 8 ALA H 4.080 . 4.080 3.900 3.577 4.087 0.007 10 0 "[ . 1 . 2]" 1
852 1 7 THR MG 1 8 ALA H 4.090 . 4.090 3.524 2.931 3.846 . 0 0 "[ . 1 . 2]" 1
853 1 8 ALA H 1 8 ALA MB 3.120 . 3.120 2.498 2.390 2.720 . 0 0 "[ . 1 . 2]" 1
854 1 83 VAL H 2 9 ALA H 5.210 . 5.210 4.380 4.141 4.552 . 0 0 "[ . 1 . 2]" 1
855 1 81 ALA H 2 9 ALA H 4.290 . 4.290 3.491 3.327 3.645 . 0 0 "[ . 1 . 2]" 1
856 1 80 THR MG 2 9 ALA H 3.270 . 3.270 3.150 2.804 3.278 0.008 15 0 "[ . 1 . 2]" 1
857 1 128 THR H 1 131 ASN H 4.540 . 4.540 4.290 3.964 4.545 0.005 20 0 "[ . 1 . 2]" 1
858 1 127 ALA HA 1 131 ASN H 4.010 . 4.010 2.753 2.053 3.413 . 0 0 "[ . 1 . 2]" 1
859 1 130 ASN HB2 1 131 ASN H 4.000 . 4.000 2.837 2.298 3.192 . 0 0 "[ . 1 . 2]" 1
860 1 130 ASN HB3 1 131 ASN H 4.000 . 4.000 3.789 3.311 4.012 0.012 10 0 "[ . 1 . 2]" 1
861 1 127 ALA MB 1 131 ASN H 4.560 . 4.560 3.950 3.309 4.576 0.016 6 0 "[ . 1 . 2]" 1
862 1 130 ASN H 1 131 ASN H 4.050 . 4.050 2.490 2.378 2.633 . 0 0 "[ . 1 . 2]" 1
863 1 10 THR H 1 20 THR HA 5.500 . 5.500 5.001 4.803 5.179 . 0 0 "[ . 1 . 2]" 1
864 1 80 THR HA 2 10 THR H 5.500 . 5.500 4.625 4.459 4.781 . 0 0 "[ . 1 . 2]" 1
865 1 10 THR H 1 22 HIS HA 4.290 . 4.290 4.017 3.527 4.296 0.006 20 0 "[ . 1 . 2]" 1
866 1 10 THR H 1 10 THR HB 3.580 . 3.580 2.839 2.501 3.078 . 0 0 "[ . 1 . 2]" 1
867 1 10 THR H 1 20 THR HB 4.360 . 4.360 3.621 3.315 3.858 . 0 0 "[ . 1 . 2]" 1
868 1 10 THR H 1 10 THR MG 3.810 . 3.810 2.382 1.885 3.826 0.016 17 0 "[ . 1 . 2]" 1
869 1 8 ALA MB 1 10 THR H 5.340 . 5.340 4.796 4.543 5.296 . 0 0 "[ . 1 . 2]" 1
870 1 72 THR H 1 73 LEU H 4.540 . 4.540 4.373 4.230 4.445 . 0 0 "[ . 1 . 2]" 1
871 1 71 GLN H 1 72 THR H 4.490 . 4.490 4.472 4.436 4.494 0.004 14 0 "[ . 1 . 2]" 1
872 1 71 GLN HA 1 72 THR H 2.740 . 2.740 2.425 2.363 2.482 . 0 0 "[ . 1 . 2]" 1
873 1 72 THR H 1 72 THR HB 3.790 . 3.790 3.738 3.657 3.773 . 0 0 "[ . 1 . 2]" 1
874 1 71 GLN HG3 1 72 THR H 3.970 . 3.970 3.966 3.928 3.980 0.010 3 0 "[ . 1 . 2]" 1
875 1 71 GLN HB2 1 72 THR H 3.210 . 3.210 2.374 2.255 2.593 . 0 0 "[ . 1 . 2]" 1
876 1 71 GLN HB3 1 72 THR H 4.000 . 4.000 3.663 3.561 3.874 . 0 0 "[ . 1 . 2]" 1
877 1 66 ALA MB 1 72 THR H 4.570 . 4.570 4.236 4.043 4.544 . 0 0 "[ . 1 . 2]" 1
878 1 11 SER H 1 12 THR H 4.820 . 4.820 4.229 4.034 4.396 . 0 0 "[ . 1 . 2]" 1
879 1 10 THR HB 1 11 SER H 4.570 . 4.570 4.198 4.044 4.353 . 0 0 "[ . 1 . 2]" 1
880 1 10 THR MG 1 11 SER H 4.300 . 4.300 3.708 2.737 4.153 . 0 0 "[ . 1 . 2]" 1
881 1 12 THR H 1 13 GLY H 4.640 . 4.640 4.561 4.491 4.602 . 0 0 "[ . 1 . 2]" 1
882 1 12 THR H 1 20 THR H 4.680 . 4.680 4.523 4.245 4.691 0.011 13 0 "[ . 1 . 2]" 1
883 1 12 THR H 1 19 ALA HA 4.060 . 4.060 3.736 3.400 4.062 0.002 7 0 "[ . 1 . 2]" 1
884 1 12 THR H 1 12 THR MG 3.800 . 3.800 3.803 3.752 3.828 0.028 15 0 "[ . 1 . 2]" 1
885 1 10 THR MG 1 12 THR H 5.170 . 5.170 4.345 3.907 5.171 0.001 6 0 "[ . 1 . 2]" 1
886 1 56 ALA MB 2 12 THR H 5.500 . 5.500 5.131 4.386 5.504 0.004 13 0 "[ . 1 . 2]" 1
887 1 13 GLY H 1 14 GLY H 4.410 . 4.410 3.612 2.778 3.856 . 0 0 "[ . 1 . 2]" 1
888 1 14 GLY H 1 18 ARG H 4.720 . 4.720 3.037 2.425 3.607 . 0 0 "[ . 1 . 2]" 1
889 1 14 GLY H 1 17 GLY H 5.060 . 5.060 4.652 4.136 5.085 0.025 6 0 "[ . 1 . 2]" 1
890 1 12 THR HB 1 14 GLY H 3.640 . 3.640 3.372 2.358 3.651 0.011 8 0 "[ . 1 . 2]" 1
891 1 12 THR MG 1 14 GLY H 4.230 . 4.230 3.550 2.373 3.963 . 0 0 "[ . 1 . 2]" 1
892 1 15 ARG H 1 16 ASP H 3.880 . 3.880 2.634 2.199 3.045 . 0 0 "[ . 1 . 2]" 1
893 1 16 ASP H 1 17 GLY H 3.730 . 3.730 2.089 1.907 2.257 . 0 0 "[ . 1 . 2]" 1
894 1 16 ASP H 1 16 ASP HB2 3.170 . 3.170 3.029 2.920 3.127 . 0 0 "[ . 1 . 2]" 1
895 1 15 ARG H 1 17 GLY H 4.410 . 4.410 3.977 3.491 4.423 0.013 9 0 "[ . 1 . 2]" 1
896 1 17 GLY H 1 30 LEU H 3.730 . 3.730 3.444 3.272 3.612 . 0 0 "[ . 1 . 2]" 1
897 1 17 GLY H 1 31 SER HA 4.270 . 4.270 3.571 3.362 3.764 . 0 0 "[ . 1 . 2]" 1
898 1 17 GLY H 1 29 LYS HB2 5.270 . 5.270 5.272 5.118 5.294 0.024 13 0 "[ . 1 . 2]" 1
899 1 17 GLY H 1 30 LEU MD1 4.800 . 4.800 4.471 4.229 4.670 . 0 0 "[ . 1 . 2]" 1
900 1 17 GLY H 1 30 LEU MD2 4.170 . 4.170 2.786 2.467 3.048 . 0 0 "[ . 1 . 2]" 1
901 1 16 ASP HB3 1 17 GLY H 3.630 . 3.630 2.420 2.349 2.544 . 0 0 "[ . 1 . 2]" 1
902 1 16 ASP HB2 1 17 GLY H 3.750 . 3.750 3.734 3.631 3.767 0.017 18 0 "[ . 1 . 2]" 1
903 1 17 GLY H 1 18 ARG H 4.350 . 4.350 4.344 4.284 4.356 0.006 4 0 "[ . 1 . 2]" 1
904 1 18 ARG H 1 19 ALA MB 4.830 . 4.830 4.585 4.291 4.833 0.003 11 0 "[ . 1 . 2]" 1
905 1 18 ARG H 1 30 LEU MD1 4.470 . 4.470 3.833 3.520 4.235 . 0 0 "[ . 1 . 2]" 1
906 1 18 ARG HA 1 19 ALA H 3.530 . 3.530 2.251 2.136 2.435 . 0 0 "[ . 1 . 2]" 1
907 1 19 ALA H 1 29 LYS HA 3.920 . 3.920 2.807 2.475 3.180 . 0 0 "[ . 1 . 2]" 1
908 1 19 ALA H 1 29 LYS HB2 4.870 . 4.870 4.426 3.816 4.867 . 0 0 "[ . 1 . 2]" 1
909 1 19 ALA H 1 19 ALA MB 3.420 . 3.420 2.540 2.375 2.723 . 0 0 "[ . 1 . 2]" 1
910 1 19 ALA H 1 28 VAL MG2 4.270 . 4.270 3.416 3.168 3.685 . 0 0 "[ . 1 . 2]" 1
911 1 19 ALA HA 1 20 THR H 3.180 . 3.180 2.143 2.114 2.182 . 0 0 "[ . 1 . 2]" 1
912 1 11 SER HA 1 20 THR H 3.990 . 3.990 2.981 2.743 3.219 . 0 0 "[ . 1 . 2]" 1
913 1 10 THR H 1 20 THR H 4.050 . 4.050 3.571 3.163 3.882 . 0 0 "[ . 1 . 2]" 1
914 1 19 ALA H 1 20 THR H 4.460 . 4.460 4.246 4.044 4.474 0.014 5 0 "[ . 1 . 2]" 1
915 1 20 THR H 1 21 SER H 4.550 . 4.550 4.080 3.982 4.179 . 0 0 "[ . 1 . 2]" 1
916 1 20 THR H 1 20 THR HB 3.460 . 3.460 2.788 2.700 2.929 . 0 0 "[ . 1 . 2]" 1
917 1 20 THR H 1 20 THR MG 4.100 . 4.100 3.930 3.898 3.995 . 0 0 "[ . 1 . 2]" 1
918 1 19 ALA MB 1 20 THR H 3.190 . 3.190 3.122 2.854 3.189 . 0 0 "[ . 1 . 2]" 1
919 1 9 ALA MB 1 20 THR H 4.280 . 4.280 3.774 3.492 4.283 0.003 3 0 "[ . 1 . 2]" 1
920 1 20 THR H 1 28 VAL MG2 5.500 . 5.500 5.348 5.038 5.507 0.007 6 0 "[ . 1 . 2]" 1
921 1 20 THR HA 1 21 SER H 3.570 . 3.570 2.156 2.130 2.177 . 0 0 "[ . 1 . 2]" 1
922 1 21 SER H 1 27 ASP HA 4.220 . 4.220 3.732 3.588 3.850 . 0 0 "[ . 1 . 2]" 1
923 1 20 THR HB 1 21 SER H 4.380 . 4.380 4.330 4.284 4.381 0.001 14 0 "[ . 1 . 2]" 1
924 1 9 ALA MB 1 21 SER H 4.790 . 4.790 3.938 3.681 4.293 . 0 0 "[ . 1 . 2]" 1
925 1 21 SER H 1 26 LEU MD1 5.110 . 5.110 4.254 4.137 4.440 . 0 0 "[ . 1 . 2]" 1
926 1 21 SER H 1 26 LEU MD2 4.750 . 4.750 3.161 2.984 3.463 . 0 0 "[ . 1 . 2]" 1
927 1 21 SER H 1 28 VAL H 5.340 . 5.340 4.892 4.782 5.082 . 0 0 "[ . 1 . 2]" 1
928 1 10 THR H 1 22 HIS H 4.780 . 4.780 3.018 2.632 3.486 . 0 0 "[ . 1 . 2]" 1
929 1 9 ALA MB 1 22 HIS H 4.300 . 4.300 3.303 3.032 3.531 . 0 0 "[ . 1 . 2]" 1
930 1 8 ALA MB 1 22 HIS H 4.720 . 4.720 3.895 3.392 4.407 . 0 0 "[ . 1 . 2]" 1
931 1 22 HIS H 1 23 ASP H 4.490 . 4.490 2.726 2.525 2.881 . 0 0 "[ . 1 . 2]" 1
932 1 23 ASP H 1 24 GLN H 3.600 . 3.600 2.690 2.477 2.882 . 0 0 "[ . 1 . 2]" 1
933 1 23 ASP H 1 23 ASP HB2 4.030 . 4.030 2.696 2.378 3.608 . 0 0 "[ . 1 . 2]" 1
934 1 23 ASP H 1 23 ASP HB3 4.030 . 4.030 3.281 2.570 3.641 . 0 0 "[ . 1 . 2]" 1
935 1 20 THR MG 1 23 ASP H 5.380 . 5.380 5.146 4.805 5.374 . 0 0 "[ . 1 . 2]" 1
936 1 9 ALA MB 1 23 ASP H 5.000 . 5.000 4.980 4.821 5.014 0.014 17 0 "[ . 1 . 2]" 1
937 1 23 ASP HB2 1 24 GLN H 4.560 . 4.560 4.051 3.765 4.439 . 0 0 "[ . 1 . 2]" 1
938 1 23 ASP HB3 1 24 GLN H 4.560 . 4.560 4.299 3.612 4.555 . 0 0 "[ . 1 . 2]" 1
939 1 20 THR MG 1 24 GLN H 4.250 . 4.250 4.079 3.845 4.239 . 0 0 "[ . 1 . 2]" 1
940 1 24 GLN H 1 25 LYS H 3.900 . 3.900 2.487 2.404 2.588 . 0 0 "[ . 1 . 2]" 1
941 1 24 GLN HB2 1 25 LYS H 4.140 . 4.140 3.995 3.900 4.128 . 0 0 "[ . 1 . 2]" 1
942 1 21 SER H 1 26 LEU H 4.310 . 4.310 2.832 2.726 2.940 . 0 0 "[ . 1 . 2]" 1
943 1 26 LEU H 1 27 ASP H 4.520 . 4.520 4.339 4.276 4.382 . 0 0 "[ . 1 . 2]" 1
944 1 20 THR HA 1 26 LEU H 4.430 . 4.430 4.434 4.346 4.453 0.023 8 0 "[ . 1 . 2]" 1
945 1 24 GLN HA 1 26 LEU H 4.200 . 4.200 3.555 3.344 3.758 . 0 0 "[ . 1 . 2]" 1
946 1 26 LEU H 1 26 LEU MD2 4.610 . 4.610 4.625 4.617 4.633 0.023 10 0 "[ . 1 . 2]" 1
947 1 26 LEU H 1 26 LEU HG 4.450 . 4.450 4.444 4.407 4.465 0.015 6 0 "[ . 1 . 2]" 1
948 1 25 LYS H 1 26 LEU H 3.700 . 3.700 2.341 2.117 2.494 . 0 0 "[ . 1 . 2]" 1
949 1 21 SER H 1 27 ASP H 4.940 . 4.940 4.332 4.215 4.486 . 0 0 "[ . 1 . 2]" 1
950 1 20 THR HA 1 27 ASP H 4.380 . 4.380 4.091 3.947 4.238 . 0 0 "[ . 1 . 2]" 1
951 1 26 LEU HA 1 27 ASP H 3.170 . 3.170 2.210 2.114 2.257 . 0 0 "[ . 1 . 2]" 1
952 1 27 ASP H 1 27 ASP HB2 3.950 . 3.950 3.601 3.396 3.955 0.005 2 0 "[ . 1 . 2]" 1
953 1 27 ASP H 1 27 ASP HB3 3.950 . 3.950 3.072 2.923 3.530 . 0 0 "[ . 1 . 2]" 1
954 1 26 LEU MD1 1 27 ASP H 3.210 . 3.210 1.929 1.797 2.064 0.003 2 0 "[ . 1 . 2]" 1
955 1 26 LEU HG 1 27 ASP H 3.970 . 3.970 2.720 2.533 2.883 . 0 0 "[ . 1 . 2]" 1
956 1 19 ALA H 1 28 VAL H 4.140 . 4.140 3.407 2.925 3.704 . 0 0 "[ . 1 . 2]" 1
957 1 27 ASP H 1 28 VAL H 4.430 . 4.430 3.564 3.416 3.767 . 0 0 "[ . 1 . 2]" 1
958 1 28 VAL H 1 29 LYS H 4.690 . 4.690 4.382 4.362 4.401 . 0 0 "[ . 1 . 2]" 1
959 1 20 THR HA 1 28 VAL H 3.770 . 3.770 3.254 3.129 3.377 . 0 0 "[ . 1 . 2]" 1
960 1 27 ASP HA 1 28 VAL H 3.460 . 3.460 2.199 2.125 2.255 . 0 0 "[ . 1 . 2]" 1
961 1 27 ASP HB2 1 28 VAL H 4.660 . 4.660 4.363 3.919 4.536 . 0 0 "[ . 1 . 2]" 1
962 1 27 ASP HB3 1 28 VAL H 4.660 . 4.660 4.498 4.407 4.612 . 0 0 "[ . 1 . 2]" 1
963 1 19 ALA MB 1 28 VAL H 3.770 . 3.770 3.719 3.544 3.774 0.004 17 0 "[ . 1 . 2]" 1
964 1 28 VAL H 1 28 VAL MG2 3.280 . 3.280 2.329 2.207 2.394 . 0 0 "[ . 1 . 2]" 1
965 1 26 LEU MD1 1 28 VAL H 3.660 . 3.660 3.666 3.663 3.673 0.013 2 0 "[ . 1 . 2]" 1
966 1 29 LYS H 1 30 LEU H 4.490 . 4.490 4.377 4.296 4.474 . 0 0 "[ . 1 . 2]" 1
967 1 29 LYS H 1 29 LYS HB3 3.460 . 3.460 2.528 2.305 2.637 . 0 0 "[ . 1 . 2]" 1
968 1 29 LYS H 1 29 LYS HB2 3.710 . 3.710 3.522 3.306 3.678 . 0 0 "[ . 1 . 2]" 1
969 1 28 VAL MG2 1 29 LYS H 3.770 . 3.770 3.352 3.258 3.656 . 0 0 "[ . 1 . 2]" 1
970 1 64 PHE H 1 64 PHE HD1 4.990 . 4.990 4.689 4.517 4.750 . 0 0 "[ . 1 . 2]" 1
971 1 64 PHE H 1 64 PHE HD2 5.420 . 5.420 4.755 4.686 4.900 . 0 0 "[ . 1 . 2]" 1
972 1 30 LEU H 1 44 THR H 4.950 . 4.950 4.459 4.112 4.727 . 0 0 "[ . 1 . 2]" 1
973 1 30 LEU H 1 30 LEU MD2 4.230 . 4.230 2.150 2.005 2.351 . 0 0 "[ . 1 . 2]" 1
974 1 30 LEU H 1 30 LEU HG 3.940 . 3.940 3.955 3.947 3.970 0.030 9 0 "[ . 1 . 2]" 1
975 1 31 SER H 1 44 THR H 4.260 . 4.260 2.564 2.114 2.980 . 0 0 "[ . 1 . 2]" 1
976 1 30 LEU HG 1 31 SER H 4.830 . 4.830 4.581 4.244 4.834 0.004 2 0 "[ . 1 . 2]" 1
977 1 31 SER H 1 44 THR MG 5.010 . 5.010 4.744 3.666 5.027 0.017 4 0 "[ . 1 . 2]" 1
978 1 30 LEU MD1 1 31 SER H 4.900 . 4.900 4.675 4.537 4.780 . 0 0 "[ . 1 . 2]" 1
979 1 30 LEU MD2 1 31 SER H 4.180 . 4.180 3.451 3.170 3.640 . 0 0 "[ . 1 . 2]" 1
980 1 32 ALA H 1 40 GLY H 5.500 . 5.500 4.991 4.246 5.508 0.008 2 0 "[ . 1 . 2]" 1
981 1 32 ALA H 1 41 ALA MB 5.260 . 5.260 5.046 4.225 5.273 0.013 17 0 "[ . 1 . 2]" 1
982 1 34 ARG H 1 34 ARG HG2 5.260 . 5.260 4.200 3.227 4.858 . 0 0 "[ . 1 . 2]" 1
983 1 34 ARG H 1 34 ARG HG3 5.260 . 5.260 4.345 3.671 4.962 . 0 0 "[ . 1 . 2]" 1
984 1 36 LEU H 1 37 GLY H 3.700 . 3.700 2.413 2.014 2.722 . 0 0 "[ . 1 . 2]" 1
985 1 34 ARG HA 1 36 LEU H 4.170 . 4.170 3.768 3.359 4.208 0.038 2 0 "[ . 1 . 2]" 1
986 1 36 LEU H 1 37 GLY HA3 5.250 . 5.250 4.942 4.666 5.051 . 0 0 "[ . 1 . 2]" 1
987 1 36 LEU H 1 36 LEU HG 4.350 . 4.350 3.324 2.242 4.269 . 0 0 "[ . 1 . 2]" 1
988 1 36 LEU H 1 36 LEU MD2 4.060 . 4.060 3.107 1.810 3.993 . 0 0 "[ . 1 . 2]" 1
989 1 38 GLY H 1 39 ALA H 3.900 . 3.900 3.740 2.729 3.934 0.034 8 0 "[ . 1 . 2]" 1
990 1 37 GLY H 1 38 GLY H 3.390 . 3.390 2.397 1.922 2.734 . 0 0 "[ . 1 . 2]" 1
991 1 36 LEU H 1 38 GLY H 3.830 . 3.830 3.385 2.958 3.839 0.009 8 0 "[ . 1 . 2]" 1
992 1 34 ARG HA 1 38 GLY H 3.060 . 3.060 1.945 1.787 2.381 0.013 1 0 "[ . 1 . 2]" 1
993 1 34 ARG HB2 1 38 GLY H 4.970 . 4.970 4.402 3.763 4.929 . 0 0 "[ . 1 . 2]" 1
994 1 115 VAL H 1 116 ASP H 3.300 . 3.300 2.585 2.544 2.648 . 0 0 "[ . 1 . 2]" 1
995 1 34 ARG HA 1 39 ALA H 3.880 . 3.880 3.276 2.553 3.882 0.002 9 0 "[ . 1 . 2]" 1
996 1 113 THR HA 1 116 ASP H 3.670 . 3.670 3.383 3.220 3.501 . 0 0 "[ . 1 . 2]" 1
997 1 116 ASP H 1 116 ASP HB2 3.230 . 3.230 2.496 2.337 2.686 . 0 0 "[ . 1 . 2]" 1
998 1 116 ASP H 1 116 ASP HB3 3.270 . 3.270 2.601 2.455 2.735 . 0 0 "[ . 1 . 2]" 1
999 1 115 VAL HB 1 116 ASP H 3.850 . 3.850 2.778 2.663 2.867 . 0 0 "[ . 1 . 2]" 1
1000 1 116 ASP H 1 117 ARG HB3 5.470 . 5.470 5.413 5.283 5.471 0.001 17 0 "[ . 1 . 2]" 1
1001 1 114 LEU HB2 1 116 ASP H 5.500 . 5.500 4.766 4.679 4.897 . 0 0 "[ . 1 . 2]" 1
1002 1 115 VAL MG2 1 116 ASP H 4.170 . 4.170 3.884 3.824 3.952 . 0 0 "[ . 1 . 2]" 1
1003 1 115 VAL MG1 1 116 ASP H 3.710 . 3.710 3.568 3.308 3.668 . 0 0 "[ . 1 . 2]" 1
1004 1 34 ARG H 1 40 GLY H 4.620 . 4.620 3.352 2.426 4.628 0.008 1 0 "[ . 1 . 2]" 1
1005 1 39 ALA H 1 40 GLY H 3.640 . 3.640 2.065 1.799 2.648 0.001 1 0 "[ . 1 . 2]" 1
1006 1 38 GLY H 1 40 GLY H 5.500 . 5.500 4.750 4.205 5.436 . 0 0 "[ . 1 . 2]" 1
1007 1 34 ARG HA 1 40 GLY H 4.470 . 4.470 3.532 2.713 4.260 . 0 0 "[ . 1 . 2]" 1
1008 1 34 ARG HG2 1 40 GLY H 5.170 . 5.170 4.073 2.360 5.192 0.022 19 0 "[ . 1 . 2]" 1
1009 1 34 ARG HG3 1 40 GLY H 5.170 . 5.170 4.154 2.423 5.183 0.013 17 0 "[ . 1 . 2]" 1
1010 1 39 ALA MB 1 40 GLY H 3.190 . 3.190 2.754 2.164 3.197 0.007 11 0 "[ . 1 . 2]" 1
1011 1 40 GLY H 1 41 ALA H 3.270 . 3.270 2.956 2.258 3.277 0.007 18 0 "[ . 1 . 2]" 1
1012 1 41 ALA H 1 41 ALA MB 2.850 . 2.850 2.607 2.253 2.861 0.011 14 0 "[ . 1 . 2]" 1
1013 1 41 ALA H 1 42 GLU H 4.600 . 4.600 4.394 4.129 4.598 . 0 0 "[ . 1 . 2]" 1
1014 1 41 ALA HA 1 42 GLU H 3.050 . 3.050 2.419 2.190 2.705 . 0 0 "[ . 1 . 2]" 1
1015 1 41 ALA MB 1 42 GLU H 2.890 . 2.890 2.364 1.824 2.895 0.005 9 0 "[ . 1 . 2]" 1
1016 1 43 GLY H 1 44 THR H 4.730 . 4.730 4.284 3.824 4.585 . 0 0 "[ . 1 . 2]" 1
1017 1 42 GLU H 1 43 GLY H 4.420 . 4.420 3.485 2.081 4.057 . 0 0 "[ . 1 . 2]" 1
1018 1 42 GLU HA 1 43 GLY H 3.190 . 3.190 2.527 2.126 3.295 0.105 20 0 "[ . 1 . 2]" 1
1019 1 41 ALA MB 1 43 GLY H 4.000 . 4.000 3.504 2.459 4.022 0.022 12 0 "[ . 1 . 2]" 1
1020 1 44 THR H 1 44 THR HB 4.090 . 4.090 2.920 2.516 3.830 . 0 0 "[ . 1 . 2]" 1
1021 1 45 ASN H 1 48 GLN H 5.120 . 5.120 4.675 4.237 5.050 . 0 0 "[ . 1 . 2]" 1
1022 1 44 THR HB 1 45 ASN H 4.130 . 4.130 3.559 2.370 4.130 0.000 10 0 "[ . 1 . 2]" 1
1023 1 45 ASN H 1 48 GLN HB3 4.250 . 4.250 3.107 2.540 3.551 . 0 0 "[ . 1 . 2]" 1
1024 1 44 THR MG 1 45 ASN H 3.770 . 3.770 2.702 1.987 3.716 . 0 0 "[ . 1 . 2]" 1
1025 1 47 GLU H 1 48 GLN H 4.400 . 4.400 2.641 2.391 2.779 . 0 0 "[ . 1 . 2]" 1
1026 1 50 PHE HE2 1 51 ALA H 5.500 . 5.500 5.506 5.501 5.514 0.014 16 0 "[ . 1 . 2]" 1
1027 1 48 GLN HA 1 51 ALA H 4.200 . 4.200 3.483 3.182 3.682 . 0 0 "[ . 1 . 2]" 1
1028 1 50 PHE HB3 1 51 ALA H 4.780 . 4.780 2.558 2.380 2.713 . 0 0 "[ . 1 . 2]" 1
1029 1 51 ALA H 1 52 ALA H 3.930 . 3.930 2.888 2.795 2.947 . 0 0 "[ . 1 . 2]" 1
1030 1 52 ALA H 1 53 GLY H 3.940 . 3.940 2.692 2.575 2.782 . 0 0 "[ . 1 . 2]" 1
1031 1 48 GLN HA 1 52 ALA H 4.000 . 4.000 3.846 3.663 4.002 0.002 6 0 "[ . 1 . 2]" 1
1032 1 52 ALA H 1 52 ALA MB 3.190 . 3.190 2.238 2.224 2.258 . 0 0 "[ . 1 . 2]" 1
1033 1 9 ALA MB 2 52 ALA H 4.220 . 4.220 3.413 3.042 3.960 . 0 0 "[ . 1 . 2]" 1
1034 1 49 LEU MD1 1 52 ALA H 5.110 . 5.110 4.945 4.701 5.113 0.003 11 0 "[ . 1 . 2]" 1
1035 1 49 LEU MD2 1 53 GLY H 4.220 . 4.220 4.133 3.888 4.224 0.004 3 0 "[ . 1 . 2]" 1
1036 1 49 LEU MD1 1 53 GLY H 4.230 . 4.230 3.699 3.476 3.913 . 0 0 "[ . 1 . 2]" 1
1037 1 49 LEU MD1 2 53 GLY H 4.600 . 4.600 3.062 2.774 3.251 . 0 0 "[ . 1 . 2]" 1
1038 1 53 GLY H 1 54 TYR H 4.330 . 4.330 2.700 2.574 2.869 . 0 0 "[ . 1 . 2]" 1
1039 1 54 TYR H 1 55 SER H 4.350 . 4.350 2.618 2.511 2.812 . 0 0 "[ . 1 . 2]" 1
1040 1 54 TYR H 1 56 ALA H 4.490 . 4.490 4.173 3.826 4.457 . 0 0 "[ . 1 . 2]" 1
1041 1 54 TYR H 1 54 TYR HD2 5.440 . 5.440 4.820 4.710 4.888 . 0 0 "[ . 1 . 2]" 1
1042 1 51 ALA HA 1 54 TYR H 4.380 . 4.380 3.734 3.472 4.066 . 0 0 "[ . 1 . 2]" 1
1043 1 54 TYR H 1 54 TYR HB2 4.150 . 4.150 2.573 2.329 2.710 . 0 0 "[ . 1 . 2]" 1
1044 1 54 TYR H 1 54 TYR HB3 4.150 . 4.150 2.475 2.305 2.673 . 0 0 "[ . 1 . 2]" 1
1045 1 52 ALA MB 1 54 TYR H 4.660 . 4.660 4.515 4.234 4.667 0.007 16 0 "[ . 1 . 2]" 1
1046 1 51 ALA HA 1 55 SER H 4.200 . 4.200 3.993 3.859 4.201 0.001 18 0 "[ . 1 . 2]" 1
1047 1 54 TYR HB2 1 55 SER H 4.460 . 4.460 3.893 3.594 4.050 . 0 0 "[ . 1 . 2]" 1
1048 1 54 TYR HB3 1 55 SER H 4.460 . 4.460 2.605 2.294 2.810 . 0 0 "[ . 1 . 2]" 1
1049 1 51 ALA MB 1 55 SER H 4.810 . 4.810 4.608 4.492 4.703 . 0 0 "[ . 1 . 2]" 1
1050 1 52 ALA MB 1 55 SER H 5.160 . 5.160 4.722 4.530 4.903 . 0 0 "[ . 1 . 2]" 1
1051 1 55 SER H 1 81 ALA MB 4.030 . 4.030 3.537 3.309 3.935 . 0 0 "[ . 1 . 2]" 1
1052 1 55 SER H 1 79 VAL MG1 5.240 . 5.240 4.823 4.376 5.146 . 0 0 "[ . 1 . 2]" 1
1053 1 55 SER H 1 56 ALA H 4.120 . 4.120 2.709 2.608 2.807 . 0 0 "[ . 1 . 2]" 1
1054 1 11 SER HB2 2 56 ALA H 4.410 . 4.410 3.708 3.202 4.174 . 0 0 "[ . 1 . 2]" 1
1055 1 11 SER HB3 2 56 ALA H 4.410 . 4.410 3.553 3.124 4.325 . 0 0 "[ . 1 . 2]" 1
1056 1 56 ALA H 1 56 ALA MB 3.150 . 3.150 2.236 2.207 2.249 . 0 0 "[ . 1 . 2]" 1
1057 1 56 ALA H 1 81 ALA MB 5.290 . 5.290 4.955 4.674 5.295 0.005 1 0 "[ . 1 . 2]" 1
1058 1 61 ALA H 1 62 MET H 4.010 . 4.010 2.703 2.584 2.840 . 0 0 "[ . 1 . 2]" 1
1059 1 61 ALA MB 1 62 MET H 4.050 . 4.050 2.410 2.313 2.538 . 0 0 "[ . 1 . 2]" 1
1060 1 65 VAL H 1 65 VAL HB 3.880 . 3.880 2.468 2.416 2.506 . 0 0 "[ . 1 . 2]" 1
1061 1 62 MET ME 1 65 VAL H 5.400 . 5.400 4.552 3.816 5.402 0.002 20 0 "[ . 1 . 2]" 1
1062 1 65 VAL H 1 65 VAL MG1 3.850 . 3.850 3.765 3.744 3.776 . 0 0 "[ . 1 . 2]" 1
1063 1 65 VAL H 1 66 ALA H 3.850 . 3.850 2.792 2.668 2.851 . 0 0 "[ . 1 . 2]" 1
1064 1 66 ALA H 1 67 GLY H 3.800 . 3.800 2.634 2.552 2.709 . 0 0 "[ . 1 . 2]" 1
1065 1 64 PHE HA 1 66 ALA H 4.910 . 4.910 4.540 4.393 4.658 . 0 0 "[ . 1 . 2]" 1
1066 1 62 MET HA 1 66 ALA H 4.180 . 4.180 3.741 3.502 4.071 . 0 0 "[ . 1 . 2]" 1
1067 1 65 VAL HB 1 66 ALA H 3.620 . 3.620 2.506 2.389 2.715 . 0 0 "[ . 1 . 2]" 1
1068 1 62 MET ME 1 66 ALA H 4.260 . 4.260 3.665 3.222 4.263 0.003 20 0 "[ . 1 . 2]" 1
1069 1 65 VAL MG1 1 66 ALA H 3.240 . 3.240 3.119 3.013 3.244 0.004 12 0 "[ . 1 . 2]" 1
1070 1 64 PHE HA 1 67 GLY H 4.210 . 4.210 3.353 3.101 3.515 . 0 0 "[ . 1 . 2]" 1
1071 1 67 GLY H 1 68 GLN HG2 4.040 . 4.040 3.875 3.740 3.988 . 0 0 "[ . 1 . 2]" 1
1072 1 67 GLY H 1 68 GLN HG3 4.910 . 4.910 4.914 4.902 4.919 0.009 8 0 "[ . 1 . 2]" 1
1073 1 65 VAL MG2 1 67 GLY H 5.400 . 5.400 5.167 5.099 5.248 . 0 0 "[ . 1 . 2]" 1
1074 1 65 VAL MG1 1 67 GLY H 4.580 . 4.580 4.590 4.583 4.598 0.018 2 0 "[ . 1 . 2]" 1
1075 1 67 GLY H 1 68 GLN H 3.560 . 3.560 2.545 2.464 2.611 . 0 0 "[ . 1 . 2]" 1
1076 1 66 ALA H 1 68 GLN H 4.600 . 4.600 4.220 4.148 4.268 . 0 0 "[ . 1 . 2]" 1
1077 1 68 GLN H 1 70 LYS H 4.150 . 4.150 3.626 3.465 3.743 . 0 0 "[ . 1 . 2]" 1
1078 1 68 GLN H 1 69 ASN H 3.330 . 3.330 2.076 2.043 2.131 . 0 0 "[ . 1 . 2]" 1
1079 1 68 GLN H 1 68 GLN HE21 4.930 . 4.930 4.564 3.772 4.939 0.009 12 0 "[ . 1 . 2]" 1
1080 1 68 GLN H 1 68 GLN HA 2.940 . 2.940 2.935 2.916 2.942 0.002 1 0 "[ . 1 . 2]" 1
1081 1 65 VAL HA 1 68 GLN H 3.860 . 3.860 3.388 3.198 3.523 . 0 0 "[ . 1 . 2]" 1
1082 1 68 GLN H 1 69 ASN HB2 4.210 . 4.210 4.002 3.986 4.023 . 0 0 "[ . 1 . 2]" 1
1083 1 68 GLN H 1 69 ASN HB3 5.500 . 5.500 5.516 5.513 5.523 0.023 15 0 "[ . 1 . 2]" 1
1084 1 68 GLN H 1 68 GLN HG2 2.880 . 2.880 2.051 1.885 2.134 . 0 0 "[ . 1 . 2]" 1
1085 1 68 GLN H 1 68 GLN HG3 2.940 . 2.940 2.785 2.728 2.849 . 0 0 "[ . 1 . 2]" 1
1086 1 66 ALA MB 1 68 GLN H 4.630 . 4.630 4.530 4.486 4.589 . 0 0 "[ . 1 . 2]" 1
1087 1 65 VAL MG2 1 68 GLN H 5.330 . 5.330 5.166 5.001 5.278 . 0 0 "[ . 1 . 2]" 1
1088 1 65 VAL MG1 1 68 GLN H 4.400 . 4.400 4.364 4.187 4.414 0.014 20 0 "[ . 1 . 2]" 1
1089 1 67 GLY H 1 69 ASN H 4.310 . 4.310 3.689 3.609 3.831 . 0 0 "[ . 1 . 2]" 1
1090 1 69 ASN H 1 71 GLN H 3.820 . 3.820 3.684 3.541 3.824 0.004 6 0 "[ . 1 . 2]" 1
1091 1 68 GLN HA 1 69 ASN H 3.450 . 3.450 3.370 3.308 3.427 . 0 0 "[ . 1 . 2]" 1
1092 1 66 ALA HA 1 69 ASN H 4.080 . 4.080 3.329 3.250 3.439 . 0 0 "[ . 1 . 2]" 1
1093 1 69 ASN H 1 69 ASN HB3 3.620 . 3.620 3.540 3.468 3.587 . 0 0 "[ . 1 . 2]" 1
1094 1 68 GLN HG2 1 69 ASN H 3.610 . 3.610 3.287 3.051 3.528 . 0 0 "[ . 1 . 2]" 1
1095 1 68 GLN HG3 1 69 ASN H 3.260 . 3.260 2.780 2.567 2.998 . 0 0 "[ . 1 . 2]" 1
1096 1 69 ASN H 1 70 LYS HD3 4.240 . 4.240 3.895 3.593 4.243 0.003 3 0 "[ . 1 . 2]" 1
1097 1 65 VAL MG1 1 69 ASN H 4.530 . 4.530 4.007 3.847 4.094 . 0 0 "[ . 1 . 2]" 1
1098 1 69 ASN H 1 71 GLN HG3 4.660 . 4.660 4.414 4.267 4.612 . 0 0 "[ . 1 . 2]" 1
1099 1 65 VAL MG2 1 68 GLN HE22 5.180 . 5.180 4.473 3.582 5.090 . 0 0 "[ . 1 . 2]" 1
1100 1 69 ASN HB2 1 69 ASN HD22 3.930 . 3.930 3.598 3.498 3.778 . 0 0 "[ . 1 . 2]" 1
1101 1 68 GLN HG2 1 69 ASN HD22 4.940 . 4.940 4.376 4.068 4.689 . 0 0 "[ . 1 . 2]" 1
1102 1 68 GLN HG3 1 69 ASN HD22 4.120 . 4.120 2.938 2.726 3.315 . 0 0 "[ . 1 . 2]" 1
1103 1 65 VAL MG1 1 69 ASN HD22 3.740 . 3.740 2.414 2.134 2.903 . 0 0 "[ . 1 . 2]" 1
1104 1 69 ASN H 1 69 ASN HD21 2.800 . 2.800 2.659 2.512 2.804 0.004 4 0 "[ . 1 . 2]" 1
1105 1 69 ASN HA 1 69 ASN HD21 4.270 . 4.270 3.143 2.356 3.607 . 0 0 "[ . 1 . 2]" 1
1106 1 66 ALA HA 1 69 ASN HD21 4.870 . 4.870 4.133 3.704 4.739 . 0 0 "[ . 1 . 2]" 1
1107 1 68 GLN HG2 1 69 ASN HD21 4.350 . 4.350 3.289 2.944 3.557 . 0 0 "[ . 1 . 2]" 1
1108 1 68 GLN HG3 1 69 ASN HD21 4.140 . 4.140 2.008 1.794 2.265 0.006 5 0 "[ . 1 . 2]" 1
1109 1 65 VAL MG1 1 69 ASN HD21 3.760 . 3.760 2.514 2.010 3.402 . 0 0 "[ . 1 . 2]" 1
1110 1 69 ASN H 1 70 LYS H 3.320 . 3.320 2.298 2.151 2.421 . 0 0 "[ . 1 . 2]" 1
1111 1 69 ASN HA 1 70 LYS H 3.400 . 3.400 3.252 3.195 3.317 . 0 0 "[ . 1 . 2]" 1
1112 1 70 LYS H 1 70 LYS HA 2.840 . 2.840 2.255 2.240 2.266 . 0 0 "[ . 1 . 2]" 1
1113 1 69 ASN HB3 1 70 LYS H 4.110 . 4.110 4.076 4.001 4.114 0.004 5 0 "[ . 1 . 2]" 1
1114 1 69 ASN HB2 1 70 LYS H 4.040 . 4.040 3.583 3.479 3.711 . 0 0 "[ . 1 . 2]" 1
1115 1 112 LYS H 1 113 THR H 3.520 . 3.520 2.857 2.796 2.894 . 0 0 "[ . 1 . 2]" 1
1116 1 113 THR H 1 115 VAL H 4.540 . 4.540 4.254 4.074 4.355 . 0 0 "[ . 1 . 2]" 1
1117 1 113 THR H 1 116 ASP H 5.020 . 5.020 4.592 4.485 4.713 . 0 0 "[ . 1 . 2]" 1
1118 1 111 ALA H 1 113 THR H 4.670 . 4.670 4.393 4.231 4.597 . 0 0 "[ . 1 . 2]" 1
1119 1 113 THR H 1 113 THR HB 3.010 . 3.010 2.432 2.333 2.512 . 0 0 "[ . 1 . 2]" 1
1120 1 112 LYS HB2 1 113 THR H 3.220 . 3.220 2.663 2.450 2.927 . 0 0 "[ . 1 . 2]" 1
1121 1 113 THR H 1 113 THR MG 3.160 . 3.160 2.515 2.307 2.696 . 0 0 "[ . 1 . 2]" 1
1122 1 113 THR H 1 114 LEU HG 4.210 . 4.210 4.096 4.014 4.212 0.002 5 0 "[ . 1 . 2]" 1
1123 1 113 THR H 1 114 LEU HB2 5.500 . 5.500 4.715 4.639 4.823 . 0 0 "[ . 1 . 2]" 1
1124 1 70 LYS H 1 71 GLN H 3.270 . 3.270 2.622 2.542 2.721 . 0 0 "[ . 1 . 2]" 1
1125 1 68 GLN H 1 71 GLN H 5.450 . 5.450 5.097 5.013 5.232 . 0 0 "[ . 1 . 2]" 1
1126 1 69 ASN HA 1 71 GLN H 4.940 . 4.940 4.564 4.402 4.774 . 0 0 "[ . 1 . 2]" 1
1127 1 66 ALA HA 1 71 GLN H 3.820 . 3.820 3.342 3.221 3.470 . 0 0 "[ . 1 . 2]" 1
1128 1 70 LYS HA 1 71 GLN H 2.950 . 2.950 2.910 2.726 2.962 0.012 15 0 "[ . 1 . 2]" 1
1129 1 69 ASN HB3 1 71 GLN H 3.900 . 3.900 3.697 3.392 3.902 0.002 17 0 "[ . 1 . 2]" 1
1130 1 69 ASN HB2 1 71 GLN H 3.960 . 3.960 3.464 3.187 3.747 . 0 0 "[ . 1 . 2]" 1
1131 1 71 GLN H 1 71 GLN HG3 3.320 . 3.320 2.365 2.223 2.523 . 0 0 "[ . 1 . 2]" 1
1132 1 71 GLN H 1 71 GLN HB3 3.440 . 3.440 3.187 3.085 3.314 . 0 0 "[ . 1 . 2]" 1
1133 1 66 ALA MB 1 71 GLN H 3.710 . 3.710 3.532 3.449 3.638 . 0 0 "[ . 1 . 2]" 1
1134 1 71 GLN H 1 72 THR MG 4.970 . 4.970 4.736 4.490 4.961 . 0 0 "[ . 1 . 2]" 1
1135 1 71 GLN HA 1 71 GLN HE21 5.500 . 5.500 5.073 4.873 5.525 0.025 12 0 "[ . 1 . 2]" 1
1136 1 69 ASN HB3 1 71 GLN HE21 5.360 . 5.360 4.986 4.253 5.363 0.003 13 0 "[ . 1 . 2]" 1
1137 1 69 ASN HB2 1 71 GLN HE21 4.630 . 4.630 4.449 3.751 4.639 0.009 2 0 "[ . 1 . 2]" 1
1138 1 71 GLN HE21 1 71 GLN HG3 3.190 . 3.190 2.160 2.129 2.175 . 0 0 "[ . 1 . 2]" 1
1139 1 62 MET ME 1 71 GLN HE21 4.070 . 4.070 3.952 3.439 4.078 0.008 1 0 "[ . 1 . 2]" 1
1140 1 71 GLN HE21 1 73 LEU HB2 5.500 . 5.500 5.075 4.640 5.503 0.003 12 0 "[ . 1 . 2]" 1
1141 1 71 GLN HE21 1 73 LEU HB3 5.500 . 5.500 4.744 3.748 5.513 0.013 14 0 "[ . 1 . 2]" 1
1142 1 65 VAL MG1 1 71 GLN HE21 4.770 . 4.770 4.616 4.089 4.779 0.009 3 0 "[ . 1 . 2]" 1
1143 1 71 GLN HE21 1 73 LEU HG 3.890 . 3.890 2.643 2.203 3.109 . 0 0 "[ . 1 . 2]" 1
1144 1 71 GLN HE22 1 71 GLN HG3 3.510 . 3.510 3.453 3.444 3.463 . 0 0 "[ . 1 . 2]" 1
1145 1 62 MET ME 1 71 GLN HE22 4.370 . 4.370 3.358 3.076 3.574 . 0 0 "[ . 1 . 2]" 1
1146 1 71 GLN HB2 1 71 GLN HE22 4.980 . 4.980 3.862 3.736 4.229 . 0 0 "[ . 1 . 2]" 1
1147 1 71 GLN HE22 1 73 LEU HB2 5.500 . 5.500 5.489 5.230 5.514 0.014 2 0 "[ . 1 . 2]" 1
1148 1 71 GLN HE22 1 73 LEU HB3 5.500 . 5.500 4.749 3.771 5.457 . 0 0 "[ . 1 . 2]" 1
1149 1 65 VAL MG1 1 71 GLN HE22 4.880 . 4.880 4.615 4.232 4.882 0.002 16 0 "[ . 1 . 2]" 1
1150 1 71 GLN HE22 1 73 LEU HG 3.890 . 3.890 3.454 3.138 3.897 0.007 6 0 "[ . 1 . 2]" 1
1151 1 72 THR HA 1 73 LEU H 3.070 . 3.070 2.177 2.107 2.256 . 0 0 "[ . 1 . 2]" 1
1152 1 72 THR MG 1 73 LEU H 3.750 . 3.750 3.707 3.551 3.759 0.009 5 0 "[ . 1 . 2]" 1
1153 1 66 ALA MB 1 73 LEU H 4.190 . 4.190 3.399 3.021 3.727 . 0 0 "[ . 1 . 2]" 1
1154 1 73 LEU H 1 73 LEU HG 3.690 . 3.690 2.554 1.979 2.965 . 0 0 "[ . 1 . 2]" 1
1155 1 75 ALA HA 1 76 ASP H 3.420 . 3.420 3.255 3.198 3.347 . 0 0 "[ . 1 . 2]" 1
1156 1 76 ASP H 1 77 THR HB 4.630 . 4.630 4.406 4.216 4.557 . 0 0 "[ . 1 . 2]" 1
1157 1 76 ASP H 1 76 ASP HB2 3.330 . 3.330 2.594 2.190 2.869 . 0 0 "[ . 1 . 2]" 1
1158 1 76 ASP H 1 76 ASP HB3 3.720 . 3.720 2.556 2.452 3.498 . 0 0 "[ . 1 . 2]" 1
1159 1 74 PRO HB2 1 76 ASP H 3.630 . 3.630 2.833 2.366 3.164 . 0 0 "[ . 1 . 2]" 1
1160 1 75 ALA MB 1 76 ASP H 3.370 . 3.370 3.256 3.037 3.349 . 0 0 "[ . 1 . 2]" 1
1161 1 76 ASP H 1 77 THR MG 4.360 . 4.360 3.715 3.578 3.889 . 0 0 "[ . 1 . 2]" 1
1162 1 76 ASP H 1 77 THR H 3.660 . 3.660 2.552 2.352 2.785 . 0 0 "[ . 1 . 2]" 1
1163 1 77 THR H 1 78 THR H 4.610 . 4.610 4.588 4.543 4.614 0.004 1 0 "[ . 1 . 2]" 1
1164 1 76 ASP HA 1 77 THR H 3.190 . 3.190 3.148 3.032 3.205 0.015 17 0 "[ . 1 . 2]" 1
1165 1 75 ALA HA 1 77 THR H 4.050 . 4.050 3.311 3.144 3.622 . 0 0 "[ . 1 . 2]" 1
1166 1 77 THR H 1 77 THR HB 3.110 . 3.110 2.734 2.650 2.882 . 0 0 "[ . 1 . 2]" 1
1167 1 77 THR H 1 104 PRO HD2 4.190 . 4.190 4.032 3.793 4.193 0.003 9 0 "[ . 1 . 2]" 1
1168 1 76 ASP HB3 1 77 THR H 4.220 . 4.220 3.748 3.554 4.227 0.007 13 0 "[ . 1 . 2]" 1
1169 1 16 ASP H 1 16 ASP HB3 3.230 . 3.230 2.750 2.599 2.895 . 0 0 "[ . 1 . 2]" 1
1170 1 74 PRO HB2 1 77 THR H 4.050 . 4.050 3.612 3.253 4.048 . 0 0 "[ . 1 . 2]" 1
1171 1 77 THR H 1 104 PRO HG3 4.540 . 4.540 3.775 3.493 4.160 . 0 0 "[ . 1 . 2]" 1
1172 1 75 ALA MB 1 77 THR H 4.560 . 4.560 4.281 4.113 4.510 . 0 0 "[ . 1 . 2]" 1
1173 1 77 THR H 1 77 THR MG 3.290 . 3.290 1.895 1.826 1.944 . 0 0 "[ . 1 . 2]" 1
1174 1 78 THR H 1 102 ALA H 4.220 . 4.220 3.685 3.384 3.973 . 0 0 "[ . 1 . 2]" 1
1175 1 77 THR HA 1 78 THR H 3.380 . 3.380 2.345 2.253 2.459 . 0 0 "[ . 1 . 2]" 1
1176 1 77 THR HB 1 78 THR H 4.280 . 4.280 3.774 3.636 3.961 . 0 0 "[ . 1 . 2]" 1
1177 1 78 THR H 1 104 PRO HD2 4.820 . 4.820 4.748 4.563 4.825 0.005 7 0 "[ . 1 . 2]" 1
1178 1 78 THR H 1 104 PRO HD3 4.640 . 4.640 3.726 3.528 3.828 . 0 0 "[ . 1 . 2]" 1
1179 1 78 THR H 1 102 ALA MB 3.450 . 3.450 2.858 2.570 3.178 . 0 0 "[ . 1 . 2]" 1
1180 1 77 THR MG 1 78 THR H 3.740 . 3.740 3.571 3.334 3.742 0.002 17 0 "[ . 1 . 2]" 1
1181 1 78 THR H 1 78 THR MG 4.010 . 4.010 3.846 3.346 4.013 0.003 10 0 "[ . 1 . 2]" 1
1182 1 78 THR HB 1 79 VAL H 3.780 . 3.780 3.505 2.706 3.797 0.017 4 0 "[ . 1 . 2]" 1
1183 1 80 THR H 1 80 THR HB 4.190 . 4.190 2.672 2.552 2.832 . 0 0 "[ . 1 . 2]" 1
1184 1 80 THR H 1 100 ARG HB2 4.750 . 4.750 3.504 2.396 4.378 . 0 0 "[ . 1 . 2]" 1
1185 1 79 VAL MG2 1 80 THR H 3.970 . 3.970 3.983 3.973 3.998 0.028 15 0 "[ . 1 . 2]" 1
1186 1 80 THR H 1 80 THR MG 3.980 . 3.980 3.867 3.833 3.943 . 0 0 "[ . 1 . 2]" 1
1187 1 11 SER H 2 81 ALA H 4.470 . 4.470 4.119 3.818 4.474 0.004 1 0 "[ . 1 . 2]" 1
1188 1 8 ALA MB 2 81 ALA H 5.150 . 5.150 4.938 4.230 5.154 0.004 20 0 "[ . 1 . 2]" 1
1189 1 80 THR MG 1 81 ALA H 3.370 . 3.370 3.045 2.944 3.135 . 0 0 "[ . 1 . 2]" 1
1190 1 81 ALA H 1 82 GLU H 4.600 . 4.600 4.250 4.187 4.359 . 0 0 "[ . 1 . 2]" 1
1191 1 82 GLU H 1 98 GLU H 4.580 . 4.580 3.498 3.017 3.819 . 0 0 "[ . 1 . 2]" 1
1192 1 82 GLU H 1 100 ARG H 4.660 . 4.660 4.054 3.666 4.347 . 0 0 "[ . 1 . 2]" 1
1193 1 82 GLU H 1 99 LEU HA 4.450 . 4.450 3.512 3.209 3.930 . 0 0 "[ . 1 . 2]" 1
1194 1 82 GLU H 1 82 GLU HB3 3.790 . 3.790 2.592 2.453 2.745 . 0 0 "[ . 1 . 2]" 1
1195 1 82 GLU H 1 82 GLU HB2 4.040 . 4.040 2.825 2.707 2.934 . 0 0 "[ . 1 . 2]" 1
1196 1 81 ALA MB 1 82 GLU H 3.510 . 3.510 3.396 3.243 3.458 . 0 0 "[ . 1 . 2]" 1
1197 1 8 ALA HA 2 83 VAL H 4.070 . 4.070 3.090 2.811 3.354 . 0 0 "[ . 1 . 2]" 1
1198 1 82 GLU HG2 1 83 VAL H 4.080 . 4.080 3.648 3.380 3.749 . 0 0 "[ . 1 . 2]" 1
1199 1 82 GLU HG3 1 83 VAL H 4.080 . 4.080 3.646 3.456 3.890 . 0 0 "[ . 1 . 2]" 1
1200 1 82 GLU HB2 1 83 VAL H 4.470 . 4.470 4.459 4.385 4.484 0.014 17 0 "[ . 1 . 2]" 1
1201 1 6 LYS HG3 2 83 VAL H 4.360 . 4.360 3.680 3.300 3.877 . 0 0 "[ . 1 . 2]" 1
1202 1 5 TYR HD1 2 85 ILE H 4.630 . 4.630 4.351 4.060 4.577 . 0 0 "[ . 1 . 2]" 1
1203 1 6 LYS HA 2 85 ILE H 4.360 . 4.360 3.540 3.304 3.638 . 0 0 "[ . 1 . 2]" 1
1204 1 85 ILE H 1 85 ILE MD 4.700 . 4.700 4.082 4.038 4.117 . 0 0 "[ . 1 . 2]" 1
1205 1 86 GLY H 1 93 PHE QD 5.250 . 5.250 4.690 4.463 5.028 . 0 0 "[ . 1 . 2]" 1
1206 1 85 ILE MG 1 86 GLY H 4.280 . 4.280 3.992 3.913 4.054 . 0 0 "[ . 1 . 2]" 1
1207 1 85 ILE HG13 1 86 GLY H 4.280 . 4.280 4.225 4.011 4.288 0.008 9 0 "[ . 1 . 2]" 1
1208 1 88 ASN H 1 94 ALA H 4.660 . 4.660 3.971 3.494 4.315 . 0 0 "[ . 1 . 2]" 1
1209 1 88 ASN H 1 89 GLU H 4.740 . 4.740 4.575 4.521 4.629 . 0 0 "[ . 1 . 2]" 1
1210 1 88 ASN H 1 93 PHE QD 4.880 . 4.880 4.453 3.821 4.883 0.003 16 0 "[ . 1 . 2]" 1
1211 1 88 ASN H 1 93 PHE HA 3.750 . 3.750 2.860 2.332 3.416 . 0 0 "[ . 1 . 2]" 1
1212 1 87 PRO HA 1 88 ASN H 3.390 . 3.390 2.152 2.118 2.197 . 0 0 "[ . 1 . 2]" 1
1213 1 87 PRO HB3 1 88 ASN H 3.880 . 3.880 3.855 3.629 3.893 0.013 14 0 "[ . 1 . 2]" 1
1214 1 88 ASN H 1 94 ALA MB 4.070 . 4.070 3.553 3.243 3.861 . 0 0 "[ . 1 . 2]" 1
1215 1 88 ASN HB2 1 89 GLU H 4.800 . 4.800 3.788 2.238 4.228 . 0 0 "[ . 1 . 2]" 1
1216 1 89 GLU H 1 89 GLU HB2 3.840 . 3.840 3.588 3.572 3.607 . 0 0 "[ . 1 . 2]" 1
1217 1 89 GLU H 1 90 GLU H 3.690 . 3.690 2.651 2.564 2.721 . 0 0 "[ . 1 . 2]" 1
1218 1 90 GLU H 1 91 GLY H 3.000 . 3.000 2.533 2.442 2.586 . 0 0 "[ . 1 . 2]" 1
1219 1 88 ASN HA 1 90 GLU H 4.110 . 4.110 3.941 3.723 4.120 0.010 16 0 "[ . 1 . 2]" 1
1220 1 89 GLU HA 1 90 GLU H 3.460 . 3.460 3.409 3.345 3.463 0.003 1 0 "[ . 1 . 2]" 1
1221 1 88 ASN HB2 1 90 GLU H 4.310 . 4.310 4.029 2.673 4.314 0.004 2 0 "[ . 1 . 2]" 1
1222 1 88 ASN HB3 1 90 GLU H 4.310 . 4.310 3.228 2.914 4.248 . 0 0 "[ . 1 . 2]" 1
1223 1 90 GLU H 1 90 GLU HB3 2.850 . 2.850 2.364 2.304 2.408 . 0 0 "[ . 1 . 2]" 1
1224 1 89 GLU HG2 1 90 GLU H 3.590 . 3.590 3.055 2.775 3.372 . 0 0 "[ . 1 . 2]" 1
1225 1 90 GLU H 1 90 GLU HB2 3.110 . 3.110 2.680 2.621 2.734 . 0 0 "[ . 1 . 2]" 1
1226 1 88 ASN H 1 92 GLY H 3.510 . 3.510 3.160 2.967 3.512 0.002 2 0 "[ . 1 . 2]" 1
1227 1 90 GLU HA 1 91 GLY H 3.550 . 3.550 3.432 3.404 3.473 . 0 0 "[ . 1 . 2]" 1
1228 1 90 GLU HG2 1 91 GLY H 3.940 . 3.940 3.948 3.941 3.955 0.015 20 0 "[ . 1 . 2]" 1
1229 1 93 PHE H 1 93 PHE QD 3.830 . 3.830 3.435 3.297 3.713 . 0 0 "[ . 1 . 2]" 1
1230 1 92 GLY H 1 93 PHE H 4.370 . 4.370 4.152 3.814 4.370 0.000 19 0 "[ . 1 . 2]" 1
1231 1 86 GLY H 1 94 ALA H 4.160 . 4.160 2.866 2.739 3.053 . 0 0 "[ . 1 . 2]" 1
1232 1 93 PHE H 1 94 ALA H 5.420 . 5.420 4.508 4.452 4.562 . 0 0 "[ . 1 . 2]" 1
1233 1 93 PHE QD 1 94 ALA H 4.150 . 4.150 3.539 3.348 3.809 . 0 0 "[ . 1 . 2]" 1
1234 1 87 PRO HA 1 94 ALA H 4.110 . 4.110 3.722 3.539 3.910 . 0 0 "[ . 1 . 2]" 1
1235 1 85 ILE MG 1 94 ALA H 5.500 . 5.500 5.507 5.500 5.516 0.016 15 0 "[ . 1 . 2]" 1
1236 1 95 LEU H 1 95 LEU MD1 4.440 . 4.440 4.120 4.055 4.366 . 0 0 "[ . 1 . 2]" 1
1237 1 86 GLY H 1 95 LEU H 5.390 . 5.390 5.098 5.050 5.129 . 0 0 "[ . 1 . 2]" 1
1238 1 84 GLY H 1 96 ASP H 4.470 . 4.470 3.059 2.683 3.309 . 0 0 "[ . 1 . 2]" 1
1239 1 85 ILE HA 1 96 ASP H 4.640 . 4.640 3.292 2.988 3.605 . 0 0 "[ . 1 . 2]" 1
1240 1 3 ILE MD 2 96 ASP H 4.040 . 4.040 3.427 3.145 3.982 . 0 0 "[ . 1 . 2]" 1
1241 1 95 LEU MD2 1 96 ASP H 4.260 . 4.260 4.209 3.287 4.271 0.011 7 0 "[ . 1 . 2]" 1
1242 1 95 LEU MD1 1 96 ASP H 4.440 . 4.440 2.979 1.908 3.279 . 0 0 "[ . 1 . 2]" 1
1243 1 96 ASP H 1 97 VAL H 4.380 . 4.380 4.203 4.020 4.387 0.007 15 0 "[ . 1 . 2]" 1
1244 1 96 ASP HB2 1 97 VAL H 4.630 . 4.630 4.363 3.942 4.527 . 0 0 "[ . 1 . 2]" 1
1245 1 96 ASP HB3 1 97 VAL H 4.290 . 4.290 4.281 4.061 4.321 0.031 19 0 "[ . 1 . 2]" 1
1246 1 97 VAL H 1 97 VAL HB 3.850 . 3.850 2.899 2.590 3.598 . 0 0 "[ . 1 . 2]" 1
1247 1 97 VAL H 1 134 VAL MG2 3.970 . 3.970 3.701 3.130 3.984 0.014 5 0 "[ . 1 . 2]" 1
1248 1 97 VAL H 1 98 GLU H 4.840 . 4.840 4.169 3.960 4.270 . 0 0 "[ . 1 . 2]" 1
1249 1 98 GLU H 1 99 LEU H 5.130 . 5.130 4.307 4.186 4.436 . 0 0 "[ . 1 . 2]" 1
1250 1 82 GLU HB3 1 98 GLU H 3.920 . 3.920 3.465 2.890 3.762 . 0 0 "[ . 1 . 2]" 1
1251 1 98 GLU H 1 134 VAL MG1 4.720 . 4.720 4.724 4.671 4.739 0.019 15 0 "[ . 1 . 2]" 1
1252 1 99 LEU H 1 136 LEU HG 5.290 . 5.290 5.145 4.732 5.302 0.012 8 0 "[ . 1 . 2]" 1
1253 1 99 LEU H 1 99 LEU MD2 4.650 . 4.650 3.986 3.577 4.440 . 0 0 "[ . 1 . 2]" 1
1254 1 80 THR HB 1 100 ARG H 4.590 . 4.590 3.697 3.293 4.096 . 0 0 "[ . 1 . 2]" 1
1255 1 100 ARG H 1 100 ARG HG2 4.830 . 4.830 4.142 3.483 4.585 . 0 0 "[ . 1 . 2]" 1
1256 1 80 THR MG 1 100 ARG H 5.130 . 5.130 4.434 4.255 4.618 . 0 0 "[ . 1 . 2]" 1
1257 1 81 ALA MB 1 100 ARG H 5.490 . 5.490 4.518 4.258 4.901 . 0 0 "[ . 1 . 2]" 1
1258 1 79 VAL MG1 1 100 ARG H 4.510 . 4.510 3.341 2.882 3.861 . 0 0 "[ . 1 . 2]" 1
1259 1 100 ARG H 1 137 VAL MG1 4.770 . 4.770 3.405 3.273 3.508 . 0 0 "[ . 1 . 2]" 1
1260 1 100 ARG H 1 137 VAL H 5.010 . 5.010 4.895 4.819 4.980 . 0 0 "[ . 1 . 2]" 1
1261 1 100 ARG H 1 101 VAL H 4.650 . 4.650 4.355 4.239 4.474 . 0 0 "[ . 1 . 2]" 1
1262 1 101 VAL H 1 137 VAL H 4.760 . 4.760 4.190 3.906 4.403 . 0 0 "[ . 1 . 2]" 1
1263 1 101 VAL H 1 101 VAL HB 3.880 . 3.880 2.610 2.579 2.650 . 0 0 "[ . 1 . 2]" 1
1264 1 101 VAL H 1 138 VAL MG2 5.200 . 5.200 5.148 3.852 5.224 0.024 6 0 "[ . 1 . 2]" 1
1265 1 102 ALA H 1 103 LEU H 4.270 . 4.270 4.156 4.065 4.206 . 0 0 "[ . 1 . 2]" 1
1266 1 80 THR H 1 102 ALA H 4.790 . 4.790 4.109 3.923 4.437 . 0 0 "[ . 1 . 2]" 1
1267 1 101 VAL H 1 102 ALA H 4.750 . 4.750 4.143 4.051 4.311 . 0 0 "[ . 1 . 2]" 1
1268 1 79 VAL HA 1 102 ALA H 4.020 . 4.020 2.759 2.575 3.047 . 0 0 "[ . 1 . 2]" 1
1269 1 102 ALA H 1 139 ALA MB 4.510 . 4.510 3.558 3.357 4.025 . 0 0 "[ . 1 . 2]" 1
1270 1 102 ALA HA 1 103 LEU H 3.160 . 3.160 2.173 2.140 2.190 . 0 0 "[ . 1 . 2]" 1
1271 1 103 LEU H 1 104 PRO HD2 4.940 . 4.940 4.871 4.693 4.943 0.003 18 0 "[ . 1 . 2]" 1
1272 1 103 LEU H 1 139 ALA MB 3.890 . 3.890 3.809 3.020 3.896 0.006 11 0 "[ . 1 . 2]" 1
1273 1 103 LEU H 1 103 LEU MD1 4.940 . 4.940 4.214 3.872 4.319 . 0 0 "[ . 1 . 2]" 1
1274 1 103 LEU H 1 103 LEU MD2 4.940 . 4.940 4.259 2.534 4.546 . 0 0 "[ . 1 . 2]" 1
1275 1 104 PRO HA 1 105 GLY H 2.930 . 2.930 2.222 2.170 2.288 . 0 0 "[ . 1 . 2]" 1
1276 1 104 PRO HB2 1 105 GLY H 3.660 . 3.660 3.044 2.898 3.186 . 0 0 "[ . 1 . 2]" 1
1277 1 104 PRO HB3 1 105 GLY H 3.680 . 3.680 3.691 3.683 3.700 0.020 11 0 "[ . 1 . 2]" 1
1278 1 104 PRO HG2 1 105 GLY H 4.950 . 4.950 4.707 4.523 4.845 . 0 0 "[ . 1 . 2]" 1
1279 1 105 GLY H 1 106 LEU HB3 5.160 . 5.160 4.802 4.650 4.990 . 0 0 "[ . 1 . 2]" 1
1280 1 105 GLY H 1 106 LEU H 3.150 . 3.150 2.595 2.492 2.714 . 0 0 "[ . 1 . 2]" 1
1281 1 104 PRO HA 1 106 LEU H 3.390 . 3.390 3.258 3.165 3.376 . 0 0 "[ . 1 . 2]" 1
1282 1 105 GLY HA2 1 106 LEU H 3.230 . 3.230 3.108 3.078 3.204 . 0 0 "[ . 1 . 2]" 1
1283 1 104 PRO HB2 1 106 LEU H 4.980 . 4.980 4.943 4.864 4.987 0.007 6 0 "[ . 1 . 2]" 1
1284 1 107 ASP H 1 111 ALA H 4.540 . 4.540 4.163 3.878 4.538 . 0 0 "[ . 1 . 2]" 1
1285 1 107 ASP H 1 110 ALA H 4.500 . 4.500 4.241 4.043 4.504 0.004 19 0 "[ . 1 . 2]" 1
1286 1 106 LEU H 1 107 ASP H 4.450 . 4.450 4.426 4.376 4.458 0.008 6 0 "[ . 1 . 2]" 1
1287 1 106 LEU HA 1 107 ASP H 2.720 . 2.720 2.199 2.155 2.228 . 0 0 "[ . 1 . 2]" 1
1288 1 107 ASP H 1 107 ASP HB2 3.150 . 3.150 2.318 2.255 2.530 . 0 0 "[ . 1 . 2]" 1
1289 1 107 ASP H 1 107 ASP HB3 3.570 . 3.570 3.166 2.891 3.577 0.007 17 0 "[ . 1 . 2]" 1
1290 1 106 LEU HG 1 107 ASP H 3.130 . 3.130 3.002 2.882 3.137 0.007 17 0 "[ . 1 . 2]" 1
1291 1 107 ASP H 1 110 ALA MB 3.570 . 3.570 2.926 2.673 3.473 . 0 0 "[ . 1 . 2]" 1
1292 1 108 ALA H 1 111 ALA H 4.870 . 4.870 4.556 4.506 4.636 . 0 0 "[ . 1 . 2]" 1
1293 1 107 ASP H 1 108 ALA H 4.620 . 4.620 4.586 4.553 4.602 . 0 0 "[ . 1 . 2]" 1
1294 1 108 ALA H 1 110 ALA H 4.590 . 4.590 4.289 4.106 4.597 0.007 19 0 "[ . 1 . 2]" 1
1295 1 107 ASP HA 1 108 ALA H 2.800 . 2.800 2.291 2.168 2.360 . 0 0 "[ . 1 . 2]" 1
1296 1 107 ASP HB3 1 108 ALA H 3.390 . 3.390 3.089 2.855 3.206 . 0 0 "[ . 1 . 2]" 1
1297 1 108 ALA H 1 108 ALA MB 2.620 . 2.620 2.205 2.178 2.246 . 0 0 "[ . 1 . 2]" 1
1298 1 108 ALA H 1 109 ALA H 3.300 . 3.300 2.606 2.532 2.798 . 0 0 "[ . 1 . 2]" 1
1299 1 109 ALA H 1 112 LYS H 4.920 . 4.920 4.750 4.631 4.866 . 0 0 "[ . 1 . 2]" 1
1300 1 109 ALA H 1 110 ALA H 2.900 . 2.900 2.748 2.641 2.855 . 0 0 "[ . 1 . 2]" 1
1301 1 109 ALA H 1 109 ALA HA 2.810 . 2.810 2.801 2.776 2.818 0.008 5 0 "[ . 1 . 2]" 1
1302 1 107 ASP HB2 1 109 ALA H 4.220 . 4.220 4.101 3.776 4.229 0.009 4 0 "[ . 1 . 2]" 1
1303 1 107 ASP HB3 1 109 ALA H 3.710 . 3.710 2.703 2.565 2.911 . 0 0 "[ . 1 . 2]" 1
1304 1 109 ALA H 1 109 ALA MB 2.400 . 2.400 2.234 2.225 2.240 . 0 0 "[ . 1 . 2]" 1
1305 1 56 ALA MB 1 57 CYS H 3.710 . 3.710 2.524 2.357 2.691 . 0 0 "[ . 1 . 2]" 1
1306 1 106 LEU MD1 1 109 ALA H 5.500 . 5.500 5.429 5.192 5.504 0.004 1 0 "[ . 1 . 2]" 1
1307 1 57 CYS H 1 58 PHE H 4.350 . 4.350 2.611 2.475 2.731 . 0 0 "[ . 1 . 2]" 1
1308 1 110 ALA H 1 111 ALA H 3.230 . 3.230 2.514 2.380 2.606 . 0 0 "[ . 1 . 2]" 1
1309 1 110 ALA H 1 112 LYS H 4.310 . 4.310 4.109 3.944 4.271 . 0 0 "[ . 1 . 2]" 1
1310 1 107 ASP HA 1 110 ALA H 4.910 . 4.910 4.649 4.520 4.801 . 0 0 "[ . 1 . 2]" 1
1311 1 107 ASP HB2 1 110 ALA H 3.790 . 3.790 3.161 2.378 3.459 . 0 0 "[ . 1 . 2]" 1
1312 1 107 ASP HB3 1 110 ALA H 3.710 . 3.710 2.259 1.796 3.151 0.004 1 0 "[ . 1 . 2]" 1
1313 1 110 ALA H 1 112 LYS HB2 5.340 . 5.340 5.162 5.002 5.338 . 0 0 "[ . 1 . 2]" 1
1314 1 110 ALA H 1 110 ALA MB 2.500 . 2.500 2.252 2.239 2.268 . 0 0 "[ . 1 . 2]" 1
1315 1 106 LEU MD1 1 110 ALA H 3.830 . 3.830 3.774 3.583 3.834 0.004 5 0 "[ . 1 . 2]" 1
1316 1 109 ALA H 1 111 ALA H 4.220 . 4.220 4.000 3.869 4.075 . 0 0 "[ . 1 . 2]" 1
1317 1 111 ALA H 1 112 LYS H 3.640 . 3.640 2.798 2.698 2.859 . 0 0 "[ . 1 . 2]" 1
1318 1 111 ALA H 1 112 LYS HB2 5.060 . 5.060 4.852 4.662 5.003 . 0 0 "[ . 1 . 2]" 1
1319 1 106 LEU HG 1 111 ALA H 3.680 . 3.680 3.182 3.006 3.391 . 0 0 "[ . 1 . 2]" 1
1320 1 110 ALA MB 1 111 ALA H 2.720 . 2.720 2.534 2.460 2.646 . 0 0 "[ . 1 . 2]" 1
1321 1 111 ALA H 1 113 THR MG 5.220 . 5.220 4.764 4.636 4.981 . 0 0 "[ . 1 . 2]" 1
1322 1 106 LEU MD1 1 111 ALA H 3.540 . 3.540 2.663 2.576 2.817 . 0 0 "[ . 1 . 2]" 1
1323 1 109 ALA HA 1 112 LYS H 4.100 . 4.100 3.772 3.572 3.880 . 0 0 "[ . 1 . 2]" 1
1324 1 108 ALA HA 1 112 LYS H 3.990 . 3.990 3.990 3.899 4.002 0.012 18 0 "[ . 1 . 2]" 1
1325 1 112 LYS H 1 112 LYS HB2 3.060 . 3.060 2.431 2.281 2.581 . 0 0 "[ . 1 . 2]" 1
1326 1 112 LYS H 1 112 LYS HD2 4.930 . 4.930 4.427 3.777 4.920 . 0 0 "[ . 1 . 2]" 1
1327 1 111 ALA MB 1 112 LYS H 2.900 . 2.900 2.565 2.404 2.695 . 0 0 "[ . 1 . 2]" 1
1328 1 112 LYS H 1 113 THR MG 5.030 . 5.030 4.600 4.329 4.798 . 0 0 "[ . 1 . 2]" 1
1329 1 112 LYS H 1 138 VAL MG1 4.310 . 4.310 3.355 3.064 3.900 . 0 0 "[ . 1 . 2]" 1
1330 1 112 LYS H 1 138 VAL MG2 4.310 . 4.310 3.107 2.602 3.909 . 0 0 "[ . 1 . 2]" 1
1331 1 114 LEU H 1 116 ASP H 4.390 . 4.390 3.857 3.791 3.992 . 0 0 "[ . 1 . 2]" 1
1332 1 114 LEU H 1 115 VAL H 3.620 . 3.620 2.718 2.620 2.817 . 0 0 "[ . 1 . 2]" 1
1333 1 112 LYS H 1 114 LEU H 4.570 . 4.570 4.169 4.093 4.251 . 0 0 "[ . 1 . 2]" 1
1334 1 113 THR H 1 114 LEU H 3.530 . 3.530 2.444 2.379 2.536 . 0 0 "[ . 1 . 2]" 1
1335 1 113 THR HB 1 114 LEU H 3.780 . 3.780 3.776 3.718 3.794 0.014 1 0 "[ . 1 . 2]" 1
1336 1 111 ALA HA 1 114 LEU H 3.760 . 3.760 3.309 3.209 3.424 . 0 0 "[ . 1 . 2]" 1
1337 1 114 LEU H 1 115 VAL HB 5.140 . 5.140 4.880 4.645 4.998 . 0 0 "[ . 1 . 2]" 1
1338 1 114 LEU H 1 114 LEU HB2 3.100 . 3.100 2.545 2.513 2.572 . 0 0 "[ . 1 . 2]" 1
1339 1 114 LEU H 1 114 LEU HG 3.460 . 3.460 2.307 2.266 2.371 . 0 0 "[ . 1 . 2]" 1
1340 1 112 LYS HA 1 115 VAL H 4.370 . 4.370 4.082 3.844 4.308 . 0 0 "[ . 1 . 2]" 1
1341 1 115 VAL H 1 115 VAL HB 3.680 . 3.680 2.522 2.428 2.564 . 0 0 "[ . 1 . 2]" 1
1342 1 114 LEU HB2 1 115 VAL H 3.550 . 3.550 2.440 2.342 2.557 . 0 0 "[ . 1 . 2]" 1
1343 1 115 VAL H 1 115 VAL MG2 3.240 . 3.240 2.118 2.004 2.255 . 0 0 "[ . 1 . 2]" 1
1344 1 116 ASP H 1 117 ARG H 3.670 . 3.670 2.869 2.783 2.916 . 0 0 "[ . 1 . 2]" 1
1345 1 113 THR HA 1 117 ARG H 4.520 . 4.520 3.870 3.679 3.985 . 0 0 "[ . 1 . 2]" 1
1346 1 114 LEU HA 1 117 ARG H 4.840 . 4.840 3.746 3.636 3.843 . 0 0 "[ . 1 . 2]" 1
1347 1 116 ASP HB2 1 117 ARG H 3.800 . 3.800 3.625 3.500 3.697 . 0 0 "[ . 1 . 2]" 1
1348 1 116 ASP HB3 1 117 ARG H 3.780 . 3.780 2.190 2.122 2.325 . 0 0 "[ . 1 . 2]" 1
1349 1 117 ARG H 1 117 ARG HG2 3.600 . 3.600 1.931 1.803 2.078 . 0 0 "[ . 1 . 2]" 1
1350 1 117 ARG H 1 117 ARG HB3 3.510 . 3.510 2.615 2.544 2.692 . 0 0 "[ . 1 . 2]" 1
1351 1 117 ARG H 1 117 ARG HG3 3.600 . 3.600 3.291 3.141 3.461 . 0 0 "[ . 1 . 2]" 1
1352 1 118 ALA H 1 119 HIS H 3.830 . 3.830 2.778 2.640 2.948 . 0 0 "[ . 1 . 2]" 1
1353 1 117 ARG H 1 118 ALA H 3.640 . 3.640 2.645 2.522 2.747 . 0 0 "[ . 1 . 2]" 1
1354 1 118 ALA H 1 120 HIS H 4.560 . 4.560 3.820 3.658 4.051 . 0 0 "[ . 1 . 2]" 1
1355 1 114 LEU HA 1 118 ALA H 4.460 . 4.460 3.945 3.860 4.016 . 0 0 "[ . 1 . 2]" 1
1356 1 115 VAL HA 1 118 ALA H 4.400 . 4.400 3.645 3.527 3.834 . 0 0 "[ . 1 . 2]" 1
1357 1 117 ARG HB3 1 118 ALA H 3.960 . 3.960 3.969 3.963 3.981 0.021 17 0 "[ . 1 . 2]" 1
1358 1 118 ALA H 1 118 ALA MB 3.030 . 3.030 2.240 2.224 2.253 . 0 0 "[ . 1 . 2]" 1
1359 1 119 HIS H 1 119 HIS HD2 5.500 . 5.500 4.872 2.834 5.319 . 0 0 "[ . 1 . 2]" 1
1360 1 116 ASP HA 1 119 HIS H 4.270 . 4.270 3.769 3.398 4.046 . 0 0 "[ . 1 . 2]" 1
1361 1 119 HIS H 1 119 HIS HB2 4.170 . 4.170 2.596 2.258 3.650 . 0 0 "[ . 1 . 2]" 1
1362 1 119 HIS H 1 119 HIS HB3 4.170 . 4.170 2.848 2.398 3.639 . 0 0 "[ . 1 . 2]" 1
1363 1 119 HIS H 1 136 LEU MD2 5.220 . 5.220 5.183 4.784 5.234 0.014 8 0 "[ . 1 . 2]" 1
1364 1 119 HIS H 1 120 HIS H 4.090 . 4.090 2.571 2.468 2.708 . 0 0 "[ . 1 . 2]" 1
1365 1 120 HIS H 1 122 CYS H 4.820 . 4.820 3.632 3.183 4.125 . 0 0 "[ . 1 . 2]" 1
1366 1 120 HIS H 1 121 VAL H 3.810 . 3.810 2.233 2.021 2.640 . 0 0 "[ . 1 . 2]" 1
1367 1 118 ALA HA 1 120 HIS H 4.480 . 4.480 3.773 3.527 4.063 . 0 0 "[ . 1 . 2]" 1
1368 1 120 HIS H 1 121 VAL MG2 4.530 . 4.530 3.512 3.248 3.946 . 0 0 "[ . 1 . 2]" 1
1369 1 120 HIS H 1 121 VAL MG1 4.530 . 4.530 3.914 3.632 4.312 . 0 0 "[ . 1 . 2]" 1
1370 1 126 ASN H 1 128 THR MG 5.050 . 5.050 4.643 4.049 4.870 . 0 0 "[ . 1 . 2]" 1
1371 1 127 ALA H 1 128 THR H 3.770 . 3.770 2.762 2.585 2.958 . 0 0 "[ . 1 . 2]" 1
1372 1 127 ALA H 1 129 ARG H 4.560 . 4.560 4.380 4.201 4.571 0.011 13 0 "[ . 1 . 2]" 1
1373 1 126 ASN HB2 1 127 ALA H 4.270 . 4.270 3.395 2.536 3.972 . 0 0 "[ . 1 . 2]" 1
1374 1 126 ASN HB3 1 127 ALA H 4.270 . 4.270 3.436 2.485 4.030 . 0 0 "[ . 1 . 2]" 1
1375 1 127 ALA H 1 127 ALA MB 3.230 . 3.230 2.219 2.182 2.262 . 0 0 "[ . 1 . 2]" 1
1376 1 127 ALA H 1 128 THR MG 4.760 . 4.760 4.459 3.979 4.757 . 0 0 "[ . 1 . 2]" 1
1377 1 128 THR H 1 128 THR HB 4.160 . 4.160 2.657 2.348 2.955 . 0 0 "[ . 1 . 2]" 1
1378 1 129 ARG HD3 1 130 ASN H 4.710 . 4.710 4.328 3.952 4.720 0.010 3 0 "[ . 1 . 2]" 1
1379 1 129 ARG HB3 1 130 ASN H 3.950 . 3.950 3.855 3.739 3.965 0.015 15 0 "[ . 1 . 2]" 1
1380 1 129 ARG HG3 1 130 ASN H 4.350 . 4.350 2.038 1.802 2.339 . 0 0 "[ . 1 . 2]" 1
1381 1 129 ARG HB2 1 130 ASN H 4.540 . 4.540 3.542 3.345 3.813 . 0 0 "[ . 1 . 2]" 1
1382 1 130 ASN HA 1 130 ASN HD21 4.660 . 4.660 3.564 1.838 4.380 . 0 0 "[ . 1 . 2]" 1
1383 1 130 ASN HA 1 130 ASN HD22 4.660 . 4.660 4.331 3.462 4.718 0.058 19 0 "[ . 1 . 2]" 1
1384 1 129 ARG HG2 1 130 ASN HD22 5.180 . 5.180 3.952 2.779 4.856 . 0 0 "[ . 1 . 2]" 1
1385 1 130 ASN H 1 132 VAL H 4.040 . 4.040 3.882 3.697 4.005 . 0 0 "[ . 1 . 2]" 1
1386 1 131 ASN H 1 132 VAL H 3.320 . 3.320 2.323 1.946 2.663 . 0 0 "[ . 1 . 2]" 1
1387 1 128 THR H 1 132 VAL H 5.000 . 5.000 4.671 4.466 4.896 . 0 0 "[ . 1 . 2]" 1
1388 1 128 THR HA 1 132 VAL H 4.490 . 4.490 3.586 3.053 4.496 0.006 3 0 "[ . 1 . 2]" 1
1389 1 130 ASN HA 1 132 VAL H 4.810 . 4.810 4.753 4.416 4.820 0.010 7 0 "[ . 1 . 2]" 1
1390 1 129 ARG HA 1 132 VAL H 4.200 . 4.200 4.096 3.456 4.219 0.019 17 0 "[ . 1 . 2]" 1
1391 1 131 ASN HB2 1 132 VAL H 4.090 . 4.090 3.807 3.675 4.069 . 0 0 "[ . 1 . 2]" 1
1392 1 131 ASN HB3 1 132 VAL H 4.090 . 4.090 2.695 2.505 3.147 . 0 0 "[ . 1 . 2]" 1
1393 1 132 VAL H 1 132 VAL HB 3.870 . 3.870 2.697 2.538 3.875 0.005 3 0 "[ . 1 . 2]" 1
1394 1 132 VAL H 1 133 ALA H 4.720 . 4.720 4.468 4.402 4.534 . 0 0 "[ . 1 . 2]" 1
1395 1 132 VAL HA 1 133 ALA H 3.410 . 3.410 2.256 2.151 2.603 . 0 0 "[ . 1 . 2]" 1
1396 1 133 ALA H 1 134 VAL MG2 4.310 . 4.310 4.069 3.634 4.316 0.006 18 0 "[ . 1 . 2]" 1
1397 1 133 ALA H 1 134 VAL H 4.520 . 4.520 4.126 3.972 4.301 . 0 0 "[ . 1 . 2]" 1
1398 1 134 VAL H 1 135 ARG H 4.400 . 4.400 4.260 4.101 4.406 0.006 5 0 "[ . 1 . 2]" 1
1399 1 133 ALA HA 1 134 VAL H 2.960 . 2.960 2.181 2.146 2.242 . 0 0 "[ . 1 . 2]" 1
1400 1 132 VAL HA 1 134 VAL H 5.500 . 5.500 5.325 4.994 5.513 0.013 3 0 "[ . 1 . 2]" 1
1401 1 129 ARG HA 1 134 VAL H 4.160 . 4.160 3.624 2.994 4.171 0.011 2 0 "[ . 1 . 2]" 1
1402 1 134 VAL H 1 134 VAL HB 3.290 . 3.290 2.638 2.539 2.784 . 0 0 "[ . 1 . 2]" 1
1403 1 133 ALA MB 1 134 VAL H 3.640 . 3.640 3.526 3.439 3.614 . 0 0 "[ . 1 . 2]" 1
1404 1 134 VAL H 1 134 VAL MG2 3.060 . 3.060 2.601 2.279 2.882 . 0 0 "[ . 1 . 2]" 1
1405 1 134 VAL MG2 1 135 ARG H 4.260 . 4.260 4.105 3.938 4.264 0.004 15 0 "[ . 1 . 2]" 1
1406 1 134 VAL MG1 1 135 ARG H 3.910 . 3.910 2.874 2.546 3.114 . 0 0 "[ . 1 . 2]" 1
1407 1 135 ARG HA 1 136 LEU H 3.150 . 3.150 2.190 2.142 2.246 . 0 0 "[ . 1 . 2]" 1
1408 1 136 LEU H 1 136 LEU HG 3.370 . 3.370 2.820 2.619 3.119 . 0 0 "[ . 1 . 2]" 1
1409 1 136 LEU H 1 136 LEU HB3 3.570 . 3.570 3.573 3.534 3.582 0.012 16 0 "[ . 1 . 2]" 1
1410 1 136 LEU H 1 137 VAL MG1 4.710 . 4.710 4.581 4.438 4.724 0.014 11 0 "[ . 1 . 2]" 1
1411 1 136 LEU H 1 136 LEU MD1 4.000 . 4.000 3.829 3.674 3.927 . 0 0 "[ . 1 . 2]" 1
1412 1 136 LEU H 1 136 LEU MD2 4.100 . 4.100 3.717 3.481 3.969 . 0 0 "[ . 1 . 2]" 1
1413 1 136 LEU H 1 137 VAL H 4.550 . 4.550 4.331 4.199 4.470 . 0 0 "[ . 1 . 2]" 1
1414 1 136 LEU HB2 1 137 VAL H 4.770 . 4.770 4.421 4.258 4.539 . 0 0 "[ . 1 . 2]" 1
1415 1 136 LEU HB3 1 137 VAL H 3.960 . 3.960 3.610 3.208 3.833 . 0 0 "[ . 1 . 2]" 1
1416 1 136 LEU MD1 1 137 VAL H 5.330 . 5.330 5.193 4.939 5.335 0.005 8 0 "[ . 1 . 2]" 1
1417 1 101 VAL H 1 138 VAL H 4.890 . 4.890 4.651 4.618 4.692 . 0 0 "[ . 1 . 2]" 1
1418 1 137 VAL H 1 138 VAL H 4.620 . 4.620 4.217 4.111 4.334 . 0 0 "[ . 1 . 2]" 1
1419 1 138 VAL H 1 139 ALA H 4.600 . 4.600 4.494 4.422 4.544 . 0 0 "[ . 1 . 2]" 1
1420 1 137 VAL HA 1 138 VAL H 2.830 . 2.830 2.123 2.102 2.170 . 0 0 "[ . 1 . 2]" 1
1421 1 138 VAL H 1 138 VAL HB 3.770 . 3.770 3.677 2.899 3.753 . 0 0 "[ . 1 . 2]" 1
1422 1 111 ALA MB 1 138 VAL H 5.260 . 5.260 5.066 4.916 5.265 0.005 17 0 "[ . 1 . 2]" 1
1423 1 138 VAL H 1 138 VAL MG1 3.990 . 3.990 2.362 2.092 3.913 . 0 0 "[ . 1 . 2]" 1
1424 1 138 VAL H 1 138 VAL MG2 3.990 . 3.990 2.266 1.966 2.370 . 0 0 "[ . 1 . 2]" 1
1425 1 101 VAL H 1 139 ALA H 4.100 . 4.100 3.358 3.246 3.470 . 0 0 "[ . 1 . 2]" 1
1426 1 102 ALA HA 1 139 ALA H 3.980 . 3.980 3.111 2.970 3.353 . 0 0 "[ . 1 . 2]" 1
1427 1 101 VAL HB 1 139 ALA H 3.410 . 3.410 3.412 3.321 3.425 0.015 10 0 "[ . 1 . 2]" 1
1428 1 111 ALA MB 1 139 ALA H 4.120 . 4.120 3.945 3.715 4.124 0.004 4 0 "[ . 1 . 2]" 1
1429 1 102 ALA MB 1 139 ALA H 4.750 . 4.750 4.301 4.142 4.485 . 0 0 "[ . 1 . 2]" 1
1430 1 24 GLN H 1 24 GLN HE22 4.120 . 4.120 3.736 3.459 4.075 . 0 0 "[ . 1 . 2]" 1
1431 1 22 HIS HA 1 24 GLN HE22 4.490 . 4.490 3.814 3.117 4.493 0.003 3 0 "[ . 1 . 2]" 1
1432 1 24 GLN HA 1 24 GLN HE22 4.500 . 4.500 3.212 3.154 3.263 . 0 0 "[ . 1 . 2]" 1
1433 1 24 GLN HE22 1 24 GLN HG2 3.700 . 3.700 3.490 3.469 3.503 . 0 0 "[ . 1 . 2]" 1
1434 1 20 THR MG 1 24 GLN HE22 3.570 . 3.570 3.411 2.949 3.575 0.005 11 0 "[ . 1 . 2]" 1
1435 1 24 GLN H 1 24 GLN HE21 3.970 . 3.970 2.350 2.206 2.580 . 0 0 "[ . 1 . 2]" 1
1436 1 22 HIS HA 1 24 GLN HE21 4.050 . 4.050 3.217 2.670 3.781 . 0 0 "[ . 1 . 2]" 1
1437 1 24 GLN HA 1 24 GLN HE21 4.320 . 4.320 2.667 2.467 2.854 . 0 0 "[ . 1 . 2]" 1
1438 1 24 GLN HE21 1 24 GLN HG2 3.270 . 3.270 2.237 2.206 2.263 . 0 0 "[ . 1 . 2]" 1
1439 1 20 THR MG 1 24 GLN HE21 4.060 . 4.060 3.989 3.596 4.070 0.010 14 0 "[ . 1 . 2]" 1
1440 1 2 ASN HB2 1 2 ASN HD22 3.860 . 3.860 3.799 3.746 3.902 0.042 13 0 "[ . 1 . 2]" 1
1441 1 2 ASN HB3 1 2 ASN HD22 3.860 . 3.860 3.482 3.383 3.505 . 0 0 "[ . 1 . 2]" 1
1442 1 2 ASN HB2 1 2 ASN HD21 3.270 . 3.270 2.965 2.846 3.284 0.014 13 0 "[ . 1 . 2]" 1
1443 1 2 ASN HB3 1 2 ASN HD21 3.270 . 3.270 2.223 2.087 2.286 . 0 0 "[ . 1 . 2]" 1
1444 1 2 ASN HD21 1 4 LEU MD2 3.980 . 3.980 3.804 3.004 3.992 0.012 18 0 "[ . 1 . 2]" 1
1445 1 129 ARG H 1 130 ASN H 4.350 . 4.350 2.052 1.814 2.235 . 0 0 "[ . 1 . 2]" 1
1446 1 128 THR H 1 129 ARG H 3.640 . 3.640 2.112 1.935 2.280 . 0 0 "[ . 1 . 2]" 1
1447 1 126 ASN HA 1 129 ARG H 4.500 . 4.500 4.111 3.358 4.518 0.018 19 0 "[ . 1 . 2]" 1
1448 1 129 ARG H 1 130 ASN HA 4.760 . 4.760 4.680 4.526 4.777 0.017 6 0 "[ . 1 . 2]" 1
1449 1 129 ARG H 1 129 ARG HB2 3.810 . 3.810 3.748 3.684 3.844 0.034 11 0 "[ . 1 . 2]" 1
1450 1 129 ARG H 1 129 ARG HB3 3.430 . 3.430 3.137 2.846 3.434 0.004 17 0 "[ . 1 . 2]" 1
1451 1 129 ARG H 1 129 ARG HG3 4.320 . 4.320 3.072 2.513 3.299 . 0 0 "[ . 1 . 2]" 1
1452 1 128 THR MG 1 129 ARG H 3.910 . 3.910 2.932 2.600 3.276 . 0 0 "[ . 1 . 2]" 1
1453 1 84 GLY H 1 85 ILE H 4.570 . 4.570 4.406 4.372 4.458 . 0 0 "[ . 1 . 2]" 1
1454 1 83 VAL HB 1 84 GLY H 4.270 . 4.270 3.385 2.781 4.164 . 0 0 "[ . 1 . 2]" 1
1455 1 6 LYS HG3 2 84 GLY H 4.120 . 4.120 4.097 3.926 4.126 0.006 2 0 "[ . 1 . 2]" 1
1456 1 3 ILE MD 2 84 GLY H 4.410 . 4.410 3.841 3.552 4.127 . 0 0 "[ . 1 . 2]" 1
1457 1 54 TYR HD1 1 58 PHE H 4.340 . 4.340 3.713 3.373 3.981 . 0 0 "[ . 1 . 2]" 1
1458 1 56 ALA H 1 58 PHE H 4.760 . 4.760 3.980 3.851 4.089 . 0 0 "[ . 1 . 2]" 1
1459 1 58 PHE H 1 79 VAL MG2 5.500 . 5.500 5.467 5.147 5.511 0.011 19 0 "[ . 1 . 2]" 1
1460 1 58 PHE H 1 79 VAL MG1 5.500 . 5.500 5.277 4.901 5.506 0.006 2 0 "[ . 1 . 2]" 1
1461 1 54 TYR HD1 1 57 CYS H 4.650 . 4.650 4.594 4.265 4.662 0.012 19 0 "[ . 1 . 2]" 1
1462 1 56 ALA H 1 57 CYS H 4.040 . 4.040 2.656 2.503 2.762 . 0 0 "[ . 1 . 2]" 1
1463 1 61 ALA H 1 63 LYS H 4.500 . 4.500 3.892 3.695 4.116 . 0 0 "[ . 1 . 2]" 1
1464 1 80 THR MG 2 11 SER H 4.330 . 4.330 4.320 4.167 4.342 0.012 15 0 "[ . 1 . 2]" 1
1465 1 28 VAL HA 1 29 LYS H 3.250 . 3.250 2.512 2.335 2.568 . 0 0 "[ . 1 . 2]" 1
1466 1 31 SER H 1 32 ALA H 4.490 . 4.490 4.101 3.532 4.350 . 0 0 "[ . 1 . 2]" 1
1467 1 54 TYR HD1 1 55 SER H 5.070 . 5.070 4.539 3.790 4.809 . 0 0 "[ . 1 . 2]" 1
1468 1 54 TYR HD2 1 55 SER H 5.390 . 5.390 4.834 4.401 5.391 0.001 18 0 "[ . 1 . 2]" 1
1469 1 68 GLN H 1 69 ASN HA 4.880 . 4.880 4.796 4.755 4.854 . 0 0 "[ . 1 . 2]" 1
1470 1 80 THR H 1 81 ALA H 4.610 . 4.610 4.238 4.040 4.338 . 0 0 "[ . 1 . 2]" 1
1471 1 96 ASP H 1 96 ASP HB3 4.010 . 4.010 2.601 2.451 2.834 . 0 0 "[ . 1 . 2]" 1
1472 1 96 ASP H 1 96 ASP HB2 4.040 . 4.040 3.044 2.707 3.329 . 0 0 "[ . 1 . 2]" 1
1473 1 66 ALA HA 1 69 ASN HD22 5.500 . 5.500 5.352 5.059 5.503 0.003 14 0 "[ . 1 . 2]" 1
1474 1 69 ASN HA 1 69 ASN HD22 4.260 . 4.260 3.873 3.516 4.099 . 0 0 "[ . 1 . 2]" 1
1475 2 84 GLY H 2 96 ASP HB3 4.360 . 4.360 3.349 2.739 3.571 . 0 0 "[ . 1 . 2]" 1
1476 2 84 GLY H 2 96 ASP HB2 4.920 . 4.920 4.861 4.385 4.938 0.018 1 0 "[ . 1 . 2]" 1
1477 2 2 ASN HA 2 3 ILE HG12 4.360 . 4.360 4.232 4.081 4.363 0.003 8 0 "[ . 1 . 2]" 1
1478 2 3 ILE MG 2 5 TYR HA 3.900 . 3.900 3.412 3.105 3.716 . 0 0 "[ . 1 . 2]" 1
1479 2 5 TYR HA 2 6 LYS H 3.200 . 3.200 2.171 2.135 2.214 . 0 0 "[ . 1 . 2]" 1
1480 2 5 TYR HA 2 5 TYR HD1 4.490 . 4.490 3.882 3.516 4.017 . 0 0 "[ . 1 . 2]" 1
1481 2 5 TYR HA 2 5 TYR HD2 4.650 . 4.650 3.294 3.134 3.752 . 0 0 "[ . 1 . 2]" 1
1482 1 6 LYS HA 2 84 GLY HA3 4.200 . 4.200 3.185 2.966 3.391 . 0 0 "[ . 1 . 2]" 1
1483 2 6 LYS HA 2 6 LYS HG3 3.930 . 3.930 2.576 2.529 2.617 . 0 0 "[ . 1 . 2]" 1
1484 2 7 THR HA 2 7 THR MG 3.530 . 3.530 3.230 3.222 3.242 . 0 0 "[ . 1 . 2]" 1
1485 2 9 ALA HA 2 22 HIS HA 4.700 . 4.700 4.111 3.828 4.471 . 0 0 "[ . 1 . 2]" 1
1486 2 9 ALA HA 2 10 THR HB 4.670 . 4.670 4.541 4.369 4.665 . 0 0 "[ . 1 . 2]" 1
1487 1 10 THR HA 2 81 ALA H 4.230 . 4.230 3.323 2.860 3.668 . 0 0 "[ . 1 . 2]" 1
1488 2 9 ALA H 2 10 THR HA 5.030 . 5.030 4.700 4.511 4.857 . 0 0 "[ . 1 . 2]" 1
1489 2 10 THR HA 2 10 THR MG 3.680 . 3.680 2.853 2.356 3.237 . 0 0 "[ . 1 . 2]" 1
1490 1 12 THR HA 2 79 VAL H 4.300 . 4.300 3.577 3.219 3.938 . 0 0 "[ . 1 . 2]" 1
1491 1 12 THR HA 2 78 THR HA . . 2.500 2.394 1.955 2.514 0.014 9 0 "[ . 1 . 2]" 1
1492 2 10 THR H 2 21 SER HA 3.900 . 3.900 3.345 2.918 3.665 . 0 0 "[ . 1 . 2]" 1
1493 2 21 SER HA 2 25 LYS H 5.150 . 5.150 4.907 4.775 5.153 0.003 20 0 "[ . 1 . 2]" 1
1494 2 20 THR HA 2 21 SER HA 4.420 . 4.420 4.423 4.413 4.430 0.010 8 0 "[ . 1 . 2]" 1
1495 2 21 SER HA 2 22 HIS HA 4.440 . 4.440 4.274 4.226 4.329 . 0 0 "[ . 1 . 2]" 1
1496 2 9 ALA MB 2 21 SER HA 3.620 . 3.620 2.286 2.120 2.458 . 0 0 "[ . 1 . 2]" 1
1497 2 20 THR HA 2 21 SER HB2 5.050 . 5.050 4.737 4.588 4.936 . 0 0 "[ . 1 . 2]" 1
1498 2 20 THR HA 2 21 SER HB3 5.050 . 5.050 4.647 4.499 4.827 . 0 0 "[ . 1 . 2]" 1
1499 2 22 HIS HA 2 24 GLN H 4.270 . 4.270 3.245 3.050 3.465 . 0 0 "[ . 1 . 2]" 1
1500 2 23 ASP HA 2 24 GLN HB2 4.410 . 4.410 4.315 4.211 4.409 . 0 0 "[ . 1 . 2]" 1
1501 2 26 LEU HA 2 26 LEU MD2 4.160 . 4.160 3.940 3.918 3.971 . 0 0 "[ . 1 . 2]" 1
1502 2 20 THR HA 2 27 ASP HA 3.640 . 3.640 2.163 2.072 2.337 . 0 0 "[ . 1 . 2]" 1
1503 2 27 ASP HA 2 28 VAL MG2 4.020 . 4.020 3.814 3.696 3.906 . 0 0 "[ . 1 . 2]" 1
1504 2 26 LEU MD1 2 27 ASP HA 4.130 . 4.130 4.012 3.889 4.132 0.002 17 0 "[ . 1 . 2]" 1
1505 2 26 LEU HG 2 27 ASP HA 4.300 . 4.300 3.247 3.165 3.484 . 0 0 "[ . 1 . 2]" 1
1506 2 26 LEU HA 2 27 ASP HA 4.740 . 4.740 4.446 4.383 4.503 . 0 0 "[ . 1 . 2]" 1
1507 2 28 VAL HA 2 28 VAL MG1 3.170 . 3.170 2.259 2.236 2.283 . 0 0 "[ . 1 . 2]" 1
1508 2 31 SER HA 2 44 THR H 5.380 . 5.380 5.243 4.894 5.393 0.013 7 0 "[ . 1 . 2]" 1
1509 2 31 SER HA 2 41 ALA MB 4.630 . 4.630 4.113 3.634 4.372 . 0 0 "[ . 1 . 2]" 1
1510 2 31 SER HA 2 32 ALA MB 4.030 . 4.030 4.010 3.974 4.041 0.011 13 0 "[ . 1 . 2]" 1
1511 2 31 SER HA 2 32 ALA HA 4.560 . 4.560 4.384 4.340 4.416 . 0 0 "[ . 1 . 2]" 1
1512 2 31 SER HA 2 32 ALA H 3.310 . 3.310 2.166 2.107 2.275 . 0 0 "[ . 1 . 2]" 1
1513 2 34 ARG HA 2 37 GLY H 4.020 . 4.020 3.380 3.045 3.759 . 0 0 "[ . 1 . 2]" 1
1514 2 35 GLU HA 2 37 GLY H 5.500 . 5.500 4.247 3.701 5.338 . 0 0 "[ . 1 . 2]" 1
1515 2 35 GLU HA 2 38 GLY H 5.500 . 5.500 5.469 5.143 5.531 0.031 13 0 "[ . 1 . 2]" 1
1516 1 35 GLU HB2 2 5 TYR HD2 4.670 . 4.670 2.968 2.260 4.032 . 0 0 "[ . 1 . 2]" 1
1517 2 35 GLU HB2 2 36 LEU MD2 4.820 . 4.820 3.270 1.816 4.411 . 0 0 "[ . 1 . 2]" 1
1518 1 35 GLU HB3 2 5 TYR HD2 4.670 . 4.670 3.201 2.746 3.701 . 0 0 "[ . 1 . 2]" 1
1519 2 36 LEU HA 2 36 LEU HG 3.830 . 3.830 3.264 2.670 3.777 . 0 0 "[ . 1 . 2]" 1
1520 2 45 ASN H 2 48 GLN HB3 4.320 . 4.320 3.183 2.601 3.413 . 0 0 "[ . 1 . 2]" 1
1521 2 51 ALA HA 2 81 ALA MB 3.390 . 3.390 3.144 2.701 3.397 0.007 16 0 "[ . 1 . 2]" 1
1522 1 53 GLY HA2 2 49 LEU MD1 4.220 . 4.220 2.681 2.332 3.095 . 0 0 "[ . 1 . 2]" 1
1523 2 61 ALA HA 2 64 PHE HB3 3.670 . 3.670 2.932 2.530 3.182 . 0 0 "[ . 1 . 2]" 1
1524 2 61 ALA HA 2 64 PHE H 3.890 . 3.890 3.422 3.231 3.621 . 0 0 "[ . 1 . 2]" 1
1525 2 61 ALA HA 2 64 PHE HD2 4.380 . 4.380 4.338 3.782 4.387 0.007 4 0 "[ . 1 . 2]" 1
1526 2 68 GLN HG3 2 69 ASN HA 4.090 . 4.090 3.876 3.685 4.038 . 0 0 "[ . 1 . 2]" 1
1527 2 76 ASP HA 2 104 PRO HG3 4.860 . 4.860 4.496 4.114 4.757 . 0 0 "[ . 1 . 2]" 1
1528 2 75 ALA MB 2 76 ASP HA 4.190 . 4.190 3.906 3.750 4.057 . 0 0 "[ . 1 . 2]" 1
1529 2 76 ASP HA 2 77 THR MG 4.720 . 4.720 4.559 4.393 4.717 . 0 0 "[ . 1 . 2]" 1
1530 2 77 THR HA 2 104 PRO HD2 3.740 . 3.740 2.955 2.722 3.107 . 0 0 "[ . 1 . 2]" 1
1531 2 77 THR HA 2 104 PRO HD3 3.840 . 3.840 1.982 1.810 2.197 . 0 0 "[ . 1 . 2]" 1
1532 2 77 THR HA 2 104 PRO HG3 3.860 . 3.860 3.194 2.916 3.331 . 0 0 "[ . 1 . 2]" 1
1533 2 77 THR HA 2 104 PRO HG2 4.270 . 4.270 4.251 4.100 4.283 0.013 9 0 "[ . 1 . 2]" 1
1534 1 80 THR HA 2 9 ALA H 4.770 . 4.770 4.574 4.385 4.721 . 0 0 "[ . 1 . 2]" 1
1535 2 81 ALA HA 2 100 ARG H 4.190 . 4.190 3.236 2.986 3.612 . 0 0 "[ . 1 . 2]" 1
1536 2 81 ALA HA 2 99 LEU HA 3.940 . 3.940 2.523 2.348 2.668 . 0 0 "[ . 1 . 2]" 1
1537 2 81 ALA HA 2 82 GLU HB3 4.860 . 4.860 4.719 4.568 4.847 . 0 0 "[ . 1 . 2]" 1
1538 2 100 ARG HA 2 137 VAL H 4.020 . 4.020 3.333 3.165 3.455 . 0 0 "[ . 1 . 2]" 1
1539 2 100 ARG HA 2 101 VAL HA 4.890 . 4.890 4.399 4.387 4.415 . 0 0 "[ . 1 . 2]" 1
1540 2 100 ARG HA 2 138 VAL HA 5.130 . 5.130 4.033 3.923 4.130 . 0 0 "[ . 1 . 2]" 1
1541 1 82 GLU HA 2 9 ALA H 4.000 . 4.000 3.021 2.779 3.303 . 0 0 "[ . 1 . 2]" 1
1542 1 82 GLU HA 2 8 ALA HA 3.580 . 3.580 1.901 1.797 2.041 0.003 12 0 "[ . 1 . 2]" 1
1543 2 82 GLU HA 2 82 GLU HG2 4.160 . 4.160 3.130 3.022 3.248 . 0 0 "[ . 1 . 2]" 1
1544 2 80 THR MG 2 82 GLU HA 4.960 . 4.960 4.116 3.951 4.391 . 0 0 "[ . 1 . 2]" 1
1545 2 81 ALA MB 2 82 GLU HA 5.160 . 5.160 4.230 4.124 4.293 . 0 0 "[ . 1 . 2]" 1
1546 2 83 VAL HA 2 84 GLY H 3.520 . 3.520 2.199 2.142 2.269 . 0 0 "[ . 1 . 2]" 1
1547 1 84 GLY HA2 2 7 THR H 4.360 . 4.360 3.395 3.196 3.555 . 0 0 "[ . 1 . 2]" 1
1548 1 84 GLY HA3 2 7 THR H 4.780 . 4.780 4.558 4.269 4.782 0.002 12 0 "[ . 1 . 2]" 1
1549 1 84 GLY HA2 2 6 LYS HG3 3.960 . 3.960 3.150 2.954 3.343 . 0 0 "[ . 1 . 2]" 1
1550 1 84 GLY HA2 2 6 LYS HB2 4.330 . 4.330 2.890 2.679 3.061 . 0 0 "[ . 1 . 2]" 1
1551 1 84 GLY HA2 2 6 LYS HB3 4.380 . 4.380 4.287 4.112 4.381 0.001 11 0 "[ . 1 . 2]" 1
1552 1 84 GLY HA3 2 6 LYS HG3 3.770 . 3.770 3.205 2.927 3.422 . 0 0 "[ . 1 . 2]" 1
1553 1 84 GLY HA3 2 6 LYS HB3 4.630 . 4.630 4.307 4.080 4.626 . 0 0 "[ . 1 . 2]" 1
1554 2 87 PRO HA 2 93 PHE QD 4.180 . 4.180 2.833 2.287 3.228 . 0 0 "[ . 1 . 2]" 1
1555 2 87 PRO HA 2 93 PHE HA 3.740 . 3.740 2.513 2.262 2.902 . 0 0 "[ . 1 . 2]" 1
1556 2 88 ASN HA 2 89 GLU HA 4.320 . 4.320 4.312 4.263 4.331 0.011 6 0 "[ . 1 . 2]" 1
1557 2 86 GLY H 2 95 LEU HA 4.130 . 4.130 3.780 3.530 3.897 . 0 0 "[ . 1 . 2]" 1
1558 2 85 ILE HA 2 95 LEU HA 4.470 . 4.470 2.542 2.442 2.694 . 0 0 "[ . 1 . 2]" 1
1559 2 96 ASP HA 2 97 VAL H 3.140 . 3.140 2.166 2.125 2.225 . 0 0 "[ . 1 . 2]" 1
1560 2 97 VAL HA 2 98 GLU H 3.320 . 3.320 2.130 2.057 2.237 . 0 0 "[ . 1 . 2]" 1
1561 2 98 GLU HA 2 134 VAL MG1 3.990 . 3.990 3.623 3.123 4.000 0.010 19 0 "[ . 1 . 2]" 1
1562 2 101 VAL HA 2 101 VAL MG1 3.240 . 3.240 2.438 2.412 2.470 . 0 0 "[ . 1 . 2]" 1
1563 2 138 VAL HA 2 138 VAL MG1 3.330 . 3.330 2.493 2.429 2.546 . 0 0 "[ . 1 . 2]" 1
1564 2 101 VAL HB 2 138 VAL HA 3.910 . 3.910 2.479 2.359 2.585 . 0 0 "[ . 1 . 2]" 1
1565 2 138 VAL HA 2 139 ALA H 3.000 . 3.000 2.180 2.156 2.207 . 0 0 "[ . 1 . 2]" 1
1566 2 101 VAL H 2 138 VAL HA 4.740 . 4.740 2.505 2.459 2.575 . 0 0 "[ . 1 . 2]" 1
1567 2 106 LEU HA 2 106 LEU HG 3.430 . 3.430 3.329 3.257 3.374 . 0 0 "[ . 1 . 2]" 1
1568 2 127 ALA MB 2 128 THR HB 4.530 . 4.530 4.207 3.569 4.535 0.005 19 0 "[ . 1 . 2]" 1
1569 2 126 ASN H 2 128 THR HB 5.400 . 5.400 5.324 4.978 5.413 0.013 13 0 "[ . 1 . 2]" 1
1570 2 127 ALA H 2 131 ASN HB2 5.500 . 5.500 5.368 4.857 5.516 0.016 3 0 "[ . 1 . 2]" 1
1571 2 128 THR H 2 131 ASN HB2 5.500 . 5.500 5.395 5.111 5.521 0.021 19 0 "[ . 1 . 2]" 1
1572 2 127 ALA HA 2 131 ASN HB2 4.480 . 4.480 2.707 2.488 3.052 . 0 0 "[ . 1 . 2]" 1
1573 2 128 THR H 2 131 ASN HB3 5.500 . 5.500 4.760 4.407 5.070 . 0 0 "[ . 1 . 2]" 1
1574 2 127 ALA H 2 131 ASN HB3 5.500 . 5.500 5.367 4.838 5.513 0.013 9 0 "[ . 1 . 2]" 1
1575 2 5 TYR HD1 2 7 THR HB 4.470 . 4.470 4.143 3.711 4.414 . 0 0 "[ . 1 . 2]" 1
1576 2 1 MET HB2 2 3 ILE MD 4.680 . 4.680 4.399 4.098 4.687 0.007 20 0 "[ . 1 . 2]" 1
1577 2 1 MET HB3 2 3 ILE MD 5.140 . 5.140 4.586 4.503 4.762 . 0 0 "[ . 1 . 2]" 1
1578 2 1 MET HG2 2 2 ASN H 4.270 . 4.270 4.218 4.072 4.291 0.021 14 0 "[ . 1 . 2]" 1
1579 2 1 MET HA 2 1 MET HG3 3.850 . 3.850 3.696 3.627 3.772 . 0 0 "[ . 1 . 2]" 1
1580 2 1 MET HA 2 1 MET HG2 3.740 . 3.740 3.752 3.716 3.770 0.030 16 0 "[ . 1 . 2]" 1
1581 2 1 MET HG3 2 3 ILE HA 4.660 . 4.660 3.544 3.431 3.652 . 0 0 "[ . 1 . 2]" 1
1582 2 1 MET HB3 2 1 MET HG2 2.810 . 2.810 2.406 2.347 2.495 . 0 0 "[ . 1 . 2]" 1
1583 2 1 MET HB2 2 1 MET HG3 2.760 . 2.760 2.469 2.400 2.520 . 0 0 "[ . 1 . 2]" 1
1584 2 1 MET HG2 2 3 ILE HG12 3.830 . 3.830 3.180 2.988 3.380 . 0 0 "[ . 1 . 2]" 1
1585 2 1 MET HG3 2 3 ILE HG12 3.810 . 3.810 2.450 2.125 2.737 . 0 0 "[ . 1 . 2]" 1
1586 2 1 MET HG3 2 3 ILE HG13 4.270 . 4.270 3.992 3.643 4.278 0.008 16 0 "[ . 1 . 2]" 1
1587 2 1 MET HG2 2 3 ILE HG13 4.560 . 4.560 4.269 4.084 4.536 . 0 0 "[ . 1 . 2]" 1
1588 2 1 MET HG2 2 3 ILE MD 3.710 . 3.710 2.768 2.456 3.030 . 0 0 "[ . 1 . 2]" 1
1589 2 1 MET HG3 2 3 ILE MD 3.700 . 3.700 2.512 2.328 2.654 . 0 0 "[ . 1 . 2]" 1
1590 2 1 MET HG2 2 3 ILE MG 5.500 . 5.500 5.427 5.166 5.506 0.006 15 0 "[ . 1 . 2]" 1
1591 2 1 MET HG3 2 3 ILE MG 4.820 . 4.820 4.697 4.598 4.822 0.002 2 0 "[ . 1 . 2]" 1
1592 1 1 MET ME 2 94 ALA H 3.690 . 3.690 3.347 3.021 3.658 . 0 0 "[ . 1 . 2]" 1
1593 2 1 MET ME 2 4 LEU H 4.180 . 4.180 4.084 4.013 4.179 . 0 0 "[ . 1 . 2]" 1
1594 1 1 MET ME 2 86 GLY H 2.810 . 2.810 2.315 2.149 2.485 . 0 0 "[ . 1 . 2]" 1
1595 2 1 MET ME 2 3 ILE H 4.150 . 4.150 4.136 3.959 4.170 0.020 8 0 "[ . 1 . 2]" 1
1596 2 1 MET ME 2 5 TYR H 5.500 . 5.500 5.502 5.404 5.519 0.019 1 0 "[ . 1 . 2]" 1
1597 1 1 MET ME 2 93 PHE QD 5.500 . 5.500 5.445 5.107 5.515 0.015 3 0 "[ . 1 . 2]" 1
1598 1 1 MET ME 2 85 ILE HA 3.550 . 3.550 3.330 3.062 3.557 0.007 19 0 "[ . 1 . 2]" 1
1599 1 1 MET ME 2 95 LEU HA 4.240 . 4.240 3.779 3.213 4.242 0.002 6 0 "[ . 1 . 2]" 1
1600 2 1 MET ME 2 3 ILE HA 3.580 . 3.580 2.796 2.714 2.891 . 0 0 "[ . 1 . 2]" 1
1601 2 1 MET ME 2 3 ILE MD 2.650 . 2.650 1.907 1.793 2.151 0.007 20 0 "[ . 1 . 2]" 1
1602 1 1 MET ME 2 94 ALA MB 2.470 . 2.470 1.964 1.801 2.264 . 0 0 "[ . 1 . 2]" 1
1603 2 2 ASN HB3 2 3 ILE H 4.840 . 4.840 4.475 4.431 4.507 . 0 0 "[ . 1 . 2]" 1
1604 2 2 ASN HB2 2 3 ILE H 4.840 . 4.840 4.594 4.543 4.635 . 0 0 "[ . 1 . 2]" 1
1605 2 3 ILE HA 2 4 LEU HG 3.910 . 3.910 3.915 3.911 3.919 0.009 15 0 "[ . 1 . 2]" 1
1606 2 62 MET HA 2 65 VAL MG2 3.970 . 3.970 2.851 2.289 3.384 . 0 0 "[ . 1 . 2]" 1
1607 2 62 MET HA 2 65 VAL MG1 4.350 . 4.350 3.617 3.324 3.924 . 0 0 "[ . 1 . 2]" 1
1608 2 62 MET HA 2 65 VAL HB 4.380 . 4.380 2.238 1.798 2.556 0.002 2 0 "[ . 1 . 2]" 1
1609 1 3 ILE HB 2 85 ILE H 5.140 . 5.140 5.140 5.076 5.150 0.010 9 0 "[ . 1 . 2]" 1
1610 2 3 ILE HB 2 4 LEU H 5.040 . 5.040 4.213 4.085 4.358 . 0 0 "[ . 1 . 2]" 1
1611 2 2 ASN HA 2 3 ILE HB 4.840 . 4.840 4.617 4.515 4.705 . 0 0 "[ . 1 . 2]" 1
1612 2 3 ILE HB 2 6 LYS HE3 4.880 . 4.880 3.812 3.384 4.299 . 0 0 "[ . 1 . 2]" 1
1613 2 3 ILE MG 2 4 LEU H 3.630 . 3.630 2.708 2.470 3.021 . 0 0 "[ . 1 . 2]" 1
1614 1 3 ILE MG 2 84 GLY H 4.960 . 4.960 4.593 4.120 4.917 . 0 0 "[ . 1 . 2]" 1
1615 1 3 ILE MG 2 85 ILE H 3.390 . 3.390 2.110 2.084 2.207 . 0 0 "[ . 1 . 2]" 1
1616 2 3 ILE H 2 3 ILE MG 3.810 . 3.810 3.750 3.730 3.761 . 0 0 "[ . 1 . 2]" 1
1617 2 3 ILE MG 2 7 THR H 5.470 . 5.470 5.049 4.973 5.123 . 0 0 "[ . 1 . 2]" 1
1618 1 3 ILE MG 2 84 GLY HA2 3.800 . 3.800 2.999 2.641 3.284 . 0 0 "[ . 1 . 2]" 1
1619 2 3 ILE MG 2 6 LYS HA 4.020 . 4.020 3.377 3.283 3.460 . 0 0 "[ . 1 . 2]" 1
1620 2 3 ILE MG 2 4 LEU HA 4.260 . 4.260 3.889 3.716 4.087 . 0 0 "[ . 1 . 2]" 1
1621 2 3 ILE HA 2 3 ILE MG 3.440 . 3.440 2.433 2.405 2.462 . 0 0 "[ . 1 . 2]" 1
1622 1 3 ILE MG 2 84 GLY HA3 3.690 . 3.690 2.458 1.872 2.785 . 0 0 "[ . 1 . 2]" 1
1623 2 3 ILE HG12 2 3 ILE MG 3.360 . 3.360 3.210 3.200 3.215 . 0 0 "[ . 1 . 2]" 1
1624 2 3 ILE HG13 2 3 ILE MG 2.910 . 2.910 2.426 2.398 2.449 . 0 0 "[ . 1 . 2]" 1
1625 2 3 ILE MD 2 4 LEU H 3.530 . 3.530 3.531 3.388 3.546 0.016 1 0 "[ . 1 . 2]" 1
1626 1 3 ILE MD 2 85 ILE H 3.490 . 3.490 2.925 2.623 3.284 . 0 0 "[ . 1 . 2]" 1
1627 1 3 ILE MD 2 86 GLY H 3.690 . 3.690 3.317 3.167 3.526 . 0 0 "[ . 1 . 2]" 1
1628 2 3 ILE MD 2 5 TYR H 4.700 . 4.700 4.267 4.083 4.405 . 0 0 "[ . 1 . 2]" 1
1629 1 3 ILE MD 2 85 ILE HA 3.690 . 3.690 3.269 3.202 3.401 . 0 0 "[ . 1 . 2]" 1
1630 2 3 ILE HA 2 3 ILE MD 3.040 . 3.040 1.989 1.922 2.033 . 0 0 "[ . 1 . 2]" 1
1631 1 3 ILE MD 2 84 GLY HA3 3.570 . 3.570 2.250 1.923 2.503 . 0 0 "[ . 1 . 2]" 1
1632 1 3 ILE MD 2 96 ASP HB2 3.150 . 3.150 2.402 1.996 2.669 . 0 0 "[ . 1 . 2]" 1
1633 1 3 ILE MD 2 96 ASP HB3 3.340 . 3.340 2.065 1.794 2.463 0.006 12 0 "[ . 1 . 2]" 1
1634 2 3 ILE HB 2 3 ILE MD 3.310 . 3.310 3.228 3.222 3.235 . 0 0 "[ . 1 . 2]" 1
1635 2 4 LEU MD1 2 5 TYR H 4.560 . 4.560 4.411 4.300 4.557 . 0 0 "[ . 1 . 2]" 1
1636 1 4 LEU MD1 2 86 GLY H 4.900 . 4.900 4.860 4.742 4.906 0.006 14 0 "[ . 1 . 2]" 1
1637 2 4 LEU H 2 4 LEU MD1 3.930 . 3.930 3.712 3.616 3.825 . 0 0 "[ . 1 . 2]" 1
1638 2 4 LEU HA 2 4 LEU MD1 4.020 . 4.020 3.885 3.877 3.898 . 0 0 "[ . 1 . 2]" 1
1639 1 5 TYR HB3 2 36 LEU MD2 4.690 . 4.690 2.764 2.026 4.408 . 0 0 "[ . 1 . 2]" 1
1640 2 6 LYS HB3 2 7 THR H 4.310 . 4.310 4.111 3.907 4.239 . 0 0 "[ . 1 . 2]" 1
1641 2 6 LYS HB2 2 7 THR H 4.260 . 4.260 4.013 3.902 4.123 . 0 0 "[ . 1 . 2]" 1
1642 1 6 LYS HB3 2 84 GLY HA3 4.760 . 4.760 4.311 4.080 4.617 . 0 0 "[ . 1 . 2]" 1
1643 2 6 LYS HB2 2 6 LYS HE3 4.270 . 4.270 2.121 2.011 2.234 . 0 0 "[ . 1 . 2]" 1
1644 2 6 LYS HB3 2 6 LYS HE3 4.300 . 4.300 3.378 3.147 3.524 . 0 0 "[ . 1 . 2]" 1
1645 2 3 ILE MG 2 6 LYS HB2 3.840 . 3.840 1.805 1.790 1.878 0.010 20 0 "[ . 1 . 2]" 1
1646 2 3 ILE MG 2 6 LYS HB3 3.770 . 3.770 2.977 2.677 3.139 . 0 0 "[ . 1 . 2]" 1
1647 2 3 ILE MD 2 6 LYS HB3 5.500 . 5.500 5.209 4.787 5.481 . 0 0 "[ . 1 . 2]" 1
1648 2 3 ILE MD 2 6 LYS HB2 4.840 . 4.840 3.760 3.388 3.985 . 0 0 "[ . 1 . 2]" 1
1649 2 6 LYS HG3 2 7 THR H 4.070 . 4.070 2.558 2.340 2.760 . 0 0 "[ . 1 . 2]" 1
1650 2 6 LYS HG2 2 7 THR H 4.120 . 4.120 3.149 2.626 3.475 . 0 0 "[ . 1 . 2]" 1
1651 2 6 LYS H 2 6 LYS HG2 4.640 . 4.640 4.432 4.367 4.516 . 0 0 "[ . 1 . 2]" 1
1652 2 6 LYS H 2 6 LYS HG3 4.880 . 4.880 4.704 4.671 4.751 . 0 0 "[ . 1 . 2]" 1
1653 2 6 LYS HA 2 6 LYS HG2 4.180 . 4.180 3.386 3.265 3.457 . 0 0 "[ . 1 . 2]" 1
1654 1 6 LYS HG2 2 84 GLY HA3 4.810 . 4.810 4.700 4.554 4.817 0.007 10 0 "[ . 1 . 2]" 1
1655 2 6 LYS HE2 2 6 LYS HG2 4.040 . 4.040 3.632 3.596 3.689 . 0 0 "[ . 1 . 2]" 1
1656 2 6 LYS HA 2 6 LYS HD2 4.710 . 4.710 4.649 4.607 4.712 0.002 8 0 "[ . 1 . 2]" 1
1657 2 6 LYS H 2 6 LYS HD2 5.340 . 5.340 5.321 5.266 5.346 0.006 15 0 "[ . 1 . 2]" 1
1658 2 6 LYS HD2 2 7 THR H 5.500 . 5.500 5.275 4.912 5.502 0.002 5 0 "[ . 1 . 2]" 1
1659 2 6 LYS HD3 2 7 THR H 5.500 . 5.500 4.903 4.523 5.170 . 0 0 "[ . 1 . 2]" 1
1660 2 3 ILE MG 2 6 LYS HD2 4.030 . 4.030 3.607 3.262 3.944 . 0 0 "[ . 1 . 2]" 1
1661 2 6 LYS H 2 6 LYS HE3 5.500 . 5.500 5.429 5.231 5.508 0.008 18 0 "[ . 1 . 2]" 1
1662 2 6 LYS HE2 2 7 THR H 5.500 . 5.500 4.727 4.492 5.119 . 0 0 "[ . 1 . 2]" 1
1663 2 6 LYS HE3 2 7 THR H 5.500 . 5.500 5.310 5.064 5.506 0.006 9 0 "[ . 1 . 2]" 1
1664 1 6 LYS HE2 2 85 ILE H 5.500 . 5.500 5.288 4.898 5.507 0.007 17 0 "[ . 1 . 2]" 1
1665 1 6 LYS HE3 2 85 ILE H 5.500 . 5.500 4.658 4.196 5.345 . 0 0 "[ . 1 . 2]" 1
1666 1 6 LYS HE2 2 84 GLY HA2 5.500 . 5.500 3.652 3.378 3.854 . 0 0 "[ . 1 . 2]" 1
1667 1 6 LYS HE3 2 84 GLY HA2 5.500 . 5.500 3.676 3.349 4.192 . 0 0 "[ . 1 . 2]" 1
1668 2 6 LYS HD2 2 6 LYS HE3 2.850 . 2.850 2.403 2.355 2.448 . 0 0 "[ . 1 . 2]" 1
1669 2 6 LYS HE2 2 6 LYS HG3 3.470 . 3.470 2.388 2.330 2.476 . 0 0 "[ . 1 . 2]" 1
1670 2 6 LYS HE3 2 6 LYS HG3 3.850 . 3.850 3.065 2.955 3.203 . 0 0 "[ . 1 . 2]" 1
1671 2 3 ILE MG 2 6 LYS HE3 3.280 . 3.280 2.231 1.892 2.545 . 0 0 "[ . 1 . 2]" 1
1672 2 3 ILE MD 2 6 LYS HE2 3.970 . 3.970 3.727 3.442 3.974 0.004 5 0 "[ . 1 . 2]" 1
1673 2 3 ILE MD 2 6 LYS HE3 4.130 . 4.130 3.063 2.718 3.504 . 0 0 "[ . 1 . 2]" 1
1674 1 7 THR MG 2 83 VAL H 4.300 . 4.300 3.427 3.051 3.705 . 0 0 "[ . 1 . 2]" 1
1675 1 7 THR MG 2 48 GLN H 3.880 . 3.880 3.669 2.949 3.885 0.005 20 0 "[ . 1 . 2]" 1
1676 2 6 LYS H 2 7 THR MG 5.500 . 5.500 5.094 4.900 5.259 . 0 0 "[ . 1 . 2]" 1
1677 1 7 THR MG 2 47 GLU H 5.500 . 5.500 5.355 4.584 5.513 0.013 6 0 "[ . 1 . 2]" 1
1678 2 5 TYR HD1 2 7 THR MG 3.810 . 3.810 3.466 3.206 3.812 0.002 15 0 "[ . 1 . 2]" 1
1679 1 7 THR MG 2 48 GLN HA 3.600 . 3.600 3.142 2.693 3.592 . 0 0 "[ . 1 . 2]" 1
1680 1 7 THR MG 2 48 GLN HG2 3.820 . 3.820 3.335 2.403 3.833 0.013 17 0 "[ . 1 . 2]" 1
1681 1 7 THR MG 2 48 GLN HG3 3.820 . 3.820 2.748 2.073 3.839 0.019 2 0 "[ . 1 . 2]" 1
1682 1 7 THR MG 2 48 GLN HB2 3.960 . 3.960 1.983 1.805 2.157 . 0 0 "[ . 1 . 2]" 1
1683 1 7 THR MG 2 48 GLN HB3 3.960 . 3.960 3.359 3.144 3.525 . 0 0 "[ . 1 . 2]" 1
1684 2 8 ALA MB 2 9 ALA H 3.240 . 3.240 2.795 2.661 2.995 . 0 0 "[ . 1 . 2]" 1
1685 1 8 ALA MB 2 82 GLU H 5.010 . 5.010 4.625 4.044 5.006 . 0 0 "[ . 1 . 2]" 1
1686 1 8 ALA MB 2 82 GLU HA 3.480 . 3.480 2.939 2.325 3.242 . 0 0 "[ . 1 . 2]" 1
1687 2 8 ALA MB 2 22 HIS HB2 4.410 . 4.410 3.384 2.862 4.240 . 0 0 "[ . 1 . 2]" 1
1688 2 8 ALA MB 2 22 HIS HB3 4.410 . 4.410 2.440 1.979 3.327 . 0 0 "[ . 1 . 2]" 1
1689 1 8 ALA MB 2 82 GLU HB3 4.460 . 4.460 4.062 3.657 4.292 . 0 0 "[ . 1 . 2]" 1
1690 1 8 ALA MB 2 82 GLU HB2 3.470 . 3.470 2.794 2.352 3.170 . 0 0 "[ . 1 . 2]" 1
1691 1 8 ALA MB 2 80 THR MG 3.100 . 3.100 2.627 2.075 2.994 . 0 0 "[ . 1 . 2]" 1
1692 1 8 ALA HA 2 80 THR MG 4.390 . 4.390 4.032 3.576 4.354 . 0 0 "[ . 1 . 2]" 1
1693 2 8 ALA HA 2 9 ALA MB 4.280 . 4.280 3.944 3.884 3.992 . 0 0 "[ . 1 . 2]" 1
1694 2 9 ALA H 2 9 ALA MB 3.110 . 3.110 2.563 2.478 2.648 . 0 0 "[ . 1 . 2]" 1
1695 1 9 ALA MB 2 52 ALA HA 3.430 . 3.430 2.742 2.375 3.238 . 0 0 "[ . 1 . 2]" 1
1696 1 10 THR HB 2 80 THR MG 4.500 . 4.500 2.813 2.042 4.429 . 0 0 "[ . 1 . 2]" 1
1697 1 11 SER HB2 2 56 ALA MB 4.410 . 4.410 2.844 2.249 3.835 . 0 0 "[ . 1 . 2]" 1
1698 2 10 THR MG 2 11 SER HA 4.320 . 4.320 3.912 3.612 4.222 . 0 0 "[ . 1 . 2]" 1
1699 2 12 THR HB 2 13 GLY H 3.550 . 3.550 3.541 3.345 3.560 0.010 2 0 "[ . 1 . 2]" 1
1700 2 12 THR H 2 12 THR HB 3.830 . 3.830 2.674 2.590 2.735 . 0 0 "[ . 1 . 2]" 1
1701 2 12 THR HB 2 18 ARG H 4.650 . 4.650 4.394 3.856 4.653 0.003 5 0 "[ . 1 . 2]" 1
1702 1 12 THR HB 2 78 THR HA 5.500 . 5.500 5.360 4.906 5.509 0.009 12 0 "[ . 1 . 2]" 1
1703 2 12 THR MG 2 13 GLY H 3.240 . 3.240 1.981 1.798 2.053 0.002 14 0 "[ . 1 . 2]" 1
1704 2 12 THR HA 2 12 THR MG 2.730 . 2.730 2.295 2.268 2.340 . 0 0 "[ . 1 . 2]" 1
1705 2 15 ARG H 2 16 ASP HA 5.490 . 5.490 5.047 4.738 5.334 . 0 0 "[ . 1 . 2]" 1
1706 2 18 ARG HA 2 29 LYS HB2 4.000 . 4.000 3.027 2.344 3.468 . 0 0 "[ . 1 . 2]" 1
1707 1 18 ARG HA 2 56 ALA MB 4.900 . 4.900 4.375 3.559 4.873 . 0 0 "[ . 1 . 2]" 1
1708 2 18 ARG HA 2 18 ARG HG2 4.180 . 4.180 3.046 2.375 3.937 . 0 0 "[ . 1 . 2]" 1
1709 2 18 ARG HA 2 18 ARG HG3 4.180 . 4.180 3.067 2.504 3.688 . 0 0 "[ . 1 . 2]" 1
1710 2 18 ARG HD2 2 19 ALA H 5.130 . 5.130 4.282 3.055 5.046 . 0 0 "[ . 1 . 2]" 1
1711 2 18 ARG HD3 2 19 ALA H 5.130 . 5.130 4.197 2.166 5.135 0.005 16 0 "[ . 1 . 2]" 1
1712 2 100 ARG HA 2 100 ARG HD3 4.810 . 4.810 4.445 2.988 4.721 . 0 0 "[ . 1 . 2]" 1
1713 2 11 SER HA 2 19 ALA MB 4.260 . 4.260 3.810 3.467 4.078 . 0 0 "[ . 1 . 2]" 1
1714 2 11 SER HA 2 19 ALA HA 4.470 . 4.470 2.230 1.909 2.490 . 0 0 "[ . 1 . 2]" 1
1715 2 10 THR HA 2 20 THR HB 5.500 . 5.500 5.371 5.043 5.507 0.007 14 0 "[ . 1 . 2]" 1
1716 2 10 THR MG 2 20 THR HB 4.240 . 4.240 3.020 1.799 4.241 0.001 2 0 "[ . 1 . 2]" 1
1717 1 20 THR HA 2 52 ALA MB 5.500 . 5.500 4.847 4.306 5.227 . 0 0 "[ . 1 . 2]" 1
1718 2 20 THR MG 2 21 SER H 3.320 . 3.320 3.062 2.964 3.129 . 0 0 "[ . 1 . 2]" 1
1719 2 20 THR MG 2 28 VAL H 4.290 . 4.290 4.281 4.119 4.304 0.014 12 0 "[ . 1 . 2]" 1
1720 2 20 THR MG 2 27 ASP H 4.410 . 4.410 4.268 4.191 4.354 . 0 0 "[ . 1 . 2]" 1
1721 2 10 THR H 2 20 THR MG 4.420 . 4.420 4.155 3.877 4.299 . 0 0 "[ . 1 . 2]" 1
1722 2 20 THR MG 2 25 LYS H 5.050 . 5.050 4.795 4.573 5.050 . 0 0 "[ . 1 . 2]" 1
1723 2 20 THR HA 2 20 THR MG 3.030 . 3.030 2.393 2.353 2.441 . 0 0 "[ . 1 . 2]" 1
1724 2 20 THR MG 2 27 ASP HA 3.260 . 3.260 2.424 2.209 2.537 . 0 0 "[ . 1 . 2]" 1
1725 2 20 THR MG 2 26 LEU HA 4.970 . 4.970 4.825 4.730 4.922 . 0 0 "[ . 1 . 2]" 1
1726 2 20 THR MG 2 24 GLN HA 3.910 . 3.910 3.805 3.422 3.926 0.016 14 0 "[ . 1 . 2]" 1
1727 2 20 THR MG 2 27 ASP HB2 3.580 . 3.580 2.406 1.990 3.317 . 0 0 "[ . 1 . 2]" 1
1728 2 20 THR MG 2 27 ASP HB3 3.580 . 3.580 3.034 1.946 3.589 0.009 11 0 "[ . 1 . 2]" 1
1729 2 23 ASP HA 2 24 GLN HA 5.330 . 5.330 4.918 4.816 5.019 . 0 0 "[ . 1 . 2]" 1
1730 2 24 GLN H 2 24 GLN HG2 3.130 . 3.130 3.077 2.785 3.138 0.008 20 0 "[ . 1 . 2]" 1
1731 2 23 ASP HA 2 24 GLN HG2 3.780 . 3.780 3.530 3.257 3.788 0.008 12 0 "[ . 1 . 2]" 1
1732 2 24 GLN HA 2 24 GLN HG2 3.240 . 3.240 3.169 3.039 3.239 . 0 0 "[ . 1 . 2]" 1
1733 2 26 LEU H 2 26 LEU MD1 4.620 . 4.620 4.482 4.443 4.538 . 0 0 "[ . 1 . 2]" 1
1734 2 26 LEU HA 2 26 LEU MD1 3.370 . 3.370 2.229 2.156 2.307 . 0 0 "[ . 1 . 2]" 1
1735 2 20 THR HA 2 26 LEU MD1 4.670 . 4.670 4.489 4.258 4.617 . 0 0 "[ . 1 . 2]" 1
1736 2 26 LEU MD2 2 27 ASP H 4.340 . 4.340 4.130 3.980 4.340 . 0 0 "[ . 1 . 2]" 1
1737 1 26 LEU MD2 2 52 ALA H 5.460 . 5.460 4.915 4.333 5.462 0.002 18 0 "[ . 1 . 2]" 1
1738 2 20 THR HA 2 26 LEU MD2 4.800 . 4.800 3.862 3.563 4.098 . 0 0 "[ . 1 . 2]" 1
1739 2 26 LEU HA 2 27 ASP HB3 5.470 . 5.470 4.428 4.136 4.693 . 0 0 "[ . 1 . 2]" 1
1740 2 26 LEU HA 2 27 ASP HB2 5.470 . 5.470 4.977 4.475 5.512 0.042 18 0 "[ . 1 . 2]" 1
1741 2 28 VAL HB 2 29 LYS H 4.220 . 4.220 1.987 1.924 2.553 . 0 0 "[ . 1 . 2]" 1
1742 2 27 ASP H 2 28 VAL MG1 3.960 . 3.960 3.096 2.889 3.264 . 0 0 "[ . 1 . 2]" 1
1743 2 28 VAL H 2 28 VAL MG1 3.870 . 3.870 3.332 3.225 3.420 . 0 0 "[ . 1 . 2]" 1
1744 2 28 VAL MG1 2 29 LYS H 3.510 . 3.510 3.263 3.198 3.364 . 0 0 "[ . 1 . 2]" 1
1745 2 27 ASP H 2 28 VAL MG2 3.620 . 3.620 3.475 3.175 3.625 0.005 6 0 "[ . 1 . 2]" 1
1746 2 20 THR HA 2 28 VAL MG2 4.540 . 4.540 4.251 4.032 4.399 . 0 0 "[ . 1 . 2]" 1
1747 2 19 ALA MB 2 28 VAL MG2 3.280 . 3.280 2.584 2.155 2.876 . 0 0 "[ . 1 . 2]" 1
1748 2 29 LYS HB2 2 30 LEU H 5.110 . 5.110 3.805 3.629 3.930 . 0 0 "[ . 1 . 2]" 1
1749 2 29 LYS HB3 2 30 LEU H 4.350 . 4.350 4.252 4.168 4.315 . 0 0 "[ . 1 . 2]" 1
1750 2 29 LYS HB2 2 29 LYS HE2 5.500 . 5.500 3.726 2.770 4.931 . 0 0 "[ . 1 . 2]" 1
1751 2 29 LYS HB2 2 29 LYS HE3 5.500 . 5.500 3.664 1.953 4.865 . 0 0 "[ . 1 . 2]" 1
1752 2 28 VAL MG1 2 29 LYS HB3 5.090 . 5.090 5.107 5.103 5.111 0.021 12 0 "[ . 1 . 2]" 1
1753 2 29 LYS H 2 29 LYS HG3 5.080 . 5.080 4.719 4.461 5.005 . 0 0 "[ . 1 . 2]" 1
1754 2 29 LYS H 2 29 LYS HG2 5.080 . 5.080 4.077 3.802 4.484 . 0 0 "[ . 1 . 2]" 1
1755 2 29 LYS HG2 2 30 LEU H 4.040 . 4.040 3.059 2.379 3.613 . 0 0 "[ . 1 . 2]" 1
1756 2 29 LYS HG3 2 30 LEU H 4.040 . 4.040 2.941 2.539 4.044 0.004 10 0 "[ . 1 . 2]" 1
1757 2 18 ARG HA 2 29 LYS HG2 5.290 . 5.290 4.586 3.537 5.092 . 0 0 "[ . 1 . 2]" 1
1758 2 18 ARG HA 2 29 LYS HG3 5.290 . 5.290 3.719 3.425 4.295 . 0 0 "[ . 1 . 2]" 1
1759 2 29 LYS HA 2 29 LYS HG3 3.850 . 3.850 3.084 2.829 3.800 . 0 0 "[ . 1 . 2]" 1
1760 2 29 LYS HA 2 29 LYS HG2 3.850 . 3.850 3.358 2.881 3.636 . 0 0 "[ . 1 . 2]" 1
1761 2 30 LEU H 2 30 LEU MD1 3.490 . 3.490 1.794 1.780 1.881 0.020 11 0 "[ . 1 . 2]" 1
1762 2 30 LEU MD1 2 44 THR H 4.540 . 4.540 4.382 4.153 4.550 0.010 20 0 "[ . 1 . 2]" 1
1763 2 28 VAL H 2 30 LEU MD1 5.240 . 5.240 5.008 4.469 5.247 0.007 9 0 "[ . 1 . 2]" 1
1764 2 19 ALA HA 2 30 LEU MD1 4.770 . 4.770 4.068 3.555 4.473 . 0 0 "[ . 1 . 2]" 1
1765 2 18 ARG HA 2 30 LEU MD1 4.050 . 4.050 2.853 2.352 3.476 . 0 0 "[ . 1 . 2]" 1
1766 2 30 LEU HA 2 30 LEU MD1 4.430 . 4.430 3.455 3.408 3.518 . 0 0 "[ . 1 . 2]" 1
1767 2 29 LYS HA 2 30 LEU MD1 4.270 . 4.270 2.524 2.380 2.667 . 0 0 "[ . 1 . 2]" 1
1768 2 30 LEU MD1 2 44 THR HB 5.500 . 5.500 4.688 3.625 5.509 0.009 4 0 "[ . 1 . 2]" 1
1769 2 29 LYS HB2 2 30 LEU MD1 4.590 . 4.590 4.513 4.341 4.594 0.004 2 0 "[ . 1 . 2]" 1
1770 2 30 LEU MD2 2 44 THR H 4.550 . 4.550 4.562 4.552 4.572 0.022 11 0 "[ . 1 . 2]" 1
1771 1 30 LEU MD2 2 57 CYS H 4.990 . 4.990 4.386 3.507 4.907 . 0 0 "[ . 1 . 2]" 1
1772 2 30 LEU HA 2 30 LEU MD2 3.720 . 3.720 3.516 3.467 3.552 . 0 0 "[ . 1 . 2]" 1
1773 2 29 LYS HA 2 30 LEU MD2 4.560 . 4.560 3.993 3.795 4.198 . 0 0 "[ . 1 . 2]" 1
1774 1 30 LEU MD2 2 56 ALA MB 2.870 . 2.870 1.888 1.797 2.238 0.003 20 0 "[ . 1 . 2]" 1
1775 2 32 ALA H 2 32 ALA MB 3.250 . 3.250 2.241 2.214 2.301 . 0 0 "[ . 1 . 2]" 1
1776 2 32 ALA MB 2 40 GLY H 5.130 . 5.130 4.286 3.044 5.137 0.007 7 0 "[ . 1 . 2]" 1
1777 2 32 ALA MB 2 38 GLY HA3 3.960 . 3.960 2.621 1.945 3.080 . 0 0 "[ . 1 . 2]" 1
1778 2 34 ARG HB3 2 38 GLY H 4.970 . 4.970 4.463 3.644 4.976 0.006 10 0 "[ . 1 . 2]" 1
1779 2 34 ARG H 2 34 ARG HD2 5.500 . 5.500 4.774 3.693 5.390 . 0 0 "[ . 1 . 2]" 1
1780 2 34 ARG H 2 34 ARG HD3 5.500 . 5.500 4.690 2.139 5.539 0.039 4 0 "[ . 1 . 2]" 1
1781 2 34 ARG HA 2 34 ARG HD2 4.590 . 4.590 3.244 1.879 4.194 . 0 0 "[ . 1 . 2]" 1
1782 2 34 ARG HA 2 34 ARG HD3 4.590 . 4.590 3.231 1.878 4.597 0.007 8 0 "[ . 1 . 2]" 1
1783 1 35 GLU HA 2 5 TYR HD2 5.500 . 5.500 5.411 4.939 5.517 0.017 1 0 "[ . 1 . 2]" 1
1784 2 35 GLU HA 2 35 GLU HG2 3.830 . 3.830 3.435 2.975 3.861 0.031 12 0 "[ . 1 . 2]" 1
1785 2 35 GLU HA 2 35 GLU HG3 3.830 . 3.830 3.353 2.386 3.840 0.010 20 0 "[ . 1 . 2]" 1
1786 1 35 GLU HG3 2 5 TYR HD2 4.810 . 4.810 3.220 2.161 4.814 0.004 20 0 "[ . 1 . 2]" 1
1787 1 35 GLU HG2 2 5 TYR HD2 4.810 . 4.810 3.627 1.960 4.811 0.001 20 0 "[ . 1 . 2]" 1
1788 1 36 LEU MD1 2 5 TYR HD2 4.080 . 4.080 3.698 2.471 4.087 0.007 4 0 "[ . 1 . 2]" 1
1789 2 36 LEU H 2 36 LEU MD1 4.060 . 4.060 3.373 2.424 3.971 . 0 0 "[ . 1 . 2]" 1
1790 1 36 LEU MD1 2 5 TYR H 4.680 . 4.680 3.649 3.112 4.262 . 0 0 "[ . 1 . 2]" 1
1791 2 36 LEU HA 2 36 LEU MD1 4.120 . 4.120 3.133 2.034 3.949 . 0 0 "[ . 1 . 2]" 1
1792 1 36 LEU MD1 2 5 TYR HB2 4.690 . 4.690 2.284 1.900 2.767 . 0 0 "[ . 1 . 2]" 1
1793 1 36 LEU MD1 2 5 TYR HB3 4.690 . 4.690 2.574 2.100 3.323 . 0 0 "[ . 1 . 2]" 1
1794 2 35 GLU HB2 2 36 LEU MD1 4.820 . 4.820 3.586 1.977 4.821 0.001 19 0 "[ . 1 . 2]" 1
1795 2 35 GLU HB3 2 36 LEU MD1 4.820 . 4.820 4.033 2.345 4.832 0.012 5 0 "[ . 1 . 2]" 1
1796 1 36 LEU MD2 2 5 TYR HD2 4.080 . 4.080 3.725 2.776 4.087 0.007 16 0 "[ . 1 . 2]" 1
1797 1 36 LEU MD2 2 5 TYR H 4.680 . 4.680 3.926 2.969 4.629 . 0 0 "[ . 1 . 2]" 1
1798 2 36 LEU HA 2 36 LEU MD2 4.120 . 4.120 2.744 2.104 3.881 . 0 0 "[ . 1 . 2]" 1
1799 1 36 LEU MD2 2 5 TYR HB2 4.690 . 4.690 2.479 2.036 3.116 . 0 0 "[ . 1 . 2]" 1
1800 2 35 GLU HB3 2 36 LEU MD2 4.820 . 4.820 3.420 1.869 4.833 0.013 8 0 "[ . 1 . 2]" 1
1801 2 36 LEU H 2 37 GLY HA2 5.250 . 5.250 4.641 4.393 4.757 . 0 0 "[ . 1 . 2]" 1
1802 2 38 GLY HA2 2 39 ALA MB 4.720 . 4.720 4.199 3.845 4.414 . 0 0 "[ . 1 . 2]" 1
1803 2 32 ALA MB 2 38 GLY HA2 3.960 . 3.960 3.167 1.885 3.877 . 0 0 "[ . 1 . 2]" 1
1804 2 41 ALA HA 2 42 GLU HA 4.620 . 4.620 4.344 4.274 4.430 . 0 0 "[ . 1 . 2]" 1
1805 2 39 ALA H 2 39 ALA MB 2.820 . 2.820 2.472 2.318 2.892 0.072 9 0 "[ . 1 . 2]" 1
1806 2 38 GLY HA3 2 39 ALA MB 4.720 . 4.720 4.067 3.824 4.231 . 0 0 "[ . 1 . 2]" 1
1807 2 34 ARG HG2 2 39 ALA HA 5.500 . 5.500 4.347 2.530 5.516 0.016 6 0 "[ . 1 . 2]" 1
1808 2 34 ARG HG3 2 39 ALA HA 5.500 . 5.500 4.660 3.211 5.507 0.007 19 0 "[ . 1 . 2]" 1
1809 2 41 ALA MB 2 42 GLU HA 4.600 . 4.600 4.210 4.031 4.335 . 0 0 "[ . 1 . 2]" 1
1810 2 42 GLU HA 2 42 GLU HG3 3.870 . 3.870 3.677 3.117 3.874 0.004 17 0 "[ . 1 . 2]" 1
1811 2 42 GLU HB2 2 43 GLY H 5.490 . 5.490 4.270 3.712 4.480 . 0 0 "[ . 1 . 2]" 1
1812 2 42 GLU HB3 2 43 GLY H 5.490 . 5.490 4.509 4.216 4.655 . 0 0 "[ . 1 . 2]" 1
1813 2 42 GLU H 2 42 GLU HG2 3.760 . 3.760 2.231 1.795 3.511 0.005 3 0 "[ . 1 . 2]" 1
1814 2 42 GLU H 2 42 GLU HG3 3.760 . 3.760 2.869 1.873 3.310 . 0 0 "[ . 1 . 2]" 1
1815 2 42 GLU HG3 2 43 GLY H 4.920 . 4.920 4.432 3.536 4.949 0.029 19 0 "[ . 1 . 2]" 1
1816 2 42 GLU HG2 2 43 GLY H 4.920 . 4.920 4.514 3.527 4.943 0.023 4 0 "[ . 1 . 2]" 1
1817 2 42 GLU HA 2 42 GLU HG2 3.870 . 3.870 3.423 2.577 3.738 . 0 0 "[ . 1 . 2]" 1
1818 2 41 ALA MB 2 42 GLU HG2 4.800 . 4.800 3.674 2.903 4.812 0.012 19 0 "[ . 1 . 2]" 1
1819 2 41 ALA MB 2 42 GLU HG3 4.800 . 4.800 4.155 3.193 4.804 0.004 20 0 "[ . 1 . 2]" 1
1820 2 44 THR H 2 44 THR MG 3.850 . 3.850 3.246 2.076 3.871 0.021 9 0 "[ . 1 . 2]" 1
1821 2 50 PHE HA 2 50 PHE HE1 4.990 . 4.990 4.932 4.831 4.991 0.001 5 0 "[ . 1 . 2]" 1
1822 2 50 PHE HB2 2 51 ALA H 4.780 . 4.780 3.966 3.883 4.038 . 0 0 "[ . 1 . 2]" 1
1823 2 51 ALA MB 2 52 ALA H 3.190 . 3.190 2.308 2.244 2.438 . 0 0 "[ . 1 . 2]" 1
1824 2 51 ALA H 2 51 ALA MB 3.040 . 3.040 2.227 2.209 2.241 . 0 0 "[ . 1 . 2]" 1
1825 2 48 GLN HA 2 51 ALA MB 3.510 . 3.510 2.423 2.113 2.851 . 0 0 "[ . 1 . 2]" 1
1826 2 51 ALA MB 2 81 ALA MB 2.700 . 2.700 1.984 1.792 2.180 0.008 16 0 "[ . 1 . 2]" 1
1827 2 52 ALA MB 2 53 GLY H 3.590 . 3.590 2.413 2.268 2.581 . 0 0 "[ . 1 . 2]" 1
1828 2 55 SER H 2 56 ALA MB 4.770 . 4.770 4.364 4.279 4.434 . 0 0 "[ . 1 . 2]" 1
1829 1 56 ALA MB 2 30 LEU MD1 3.110 . 3.110 2.066 1.866 2.582 . 0 0 "[ . 1 . 2]" 1
1830 1 56 ALA MB 2 11 SER HB3 4.410 . 4.410 2.976 2.448 4.212 . 0 0 "[ . 1 . 2]" 1
1831 2 61 ALA MB 2 64 PHE HD2 5.280 . 5.280 4.816 3.993 5.050 . 0 0 "[ . 1 . 2]" 1
1832 2 58 PHE HA 2 61 ALA MB 3.650 . 3.650 2.411 2.022 2.689 . 0 0 "[ . 1 . 2]" 1
1833 2 61 ALA MB 2 64 PHE HB3 4.490 . 4.490 4.213 3.827 4.416 . 0 0 "[ . 1 . 2]" 1
1834 2 61 ALA MB 2 64 PHE HB2 5.430 . 5.430 5.183 4.891 5.433 0.003 4 0 "[ . 1 . 2]" 1
1835 2 65 VAL HA 2 68 GLN HG2 3.660 . 3.660 2.128 1.979 2.278 . 0 0 "[ . 1 . 2]" 1
1836 2 65 VAL HA 2 65 VAL MG2 3.210 . 3.210 2.316 2.252 2.348 . 0 0 "[ . 1 . 2]" 1
1837 2 65 VAL HA 2 65 VAL MG1 3.330 . 3.330 2.520 2.477 2.632 . 0 0 "[ . 1 . 2]" 1
1838 2 65 VAL H 2 65 VAL MG2 3.310 . 3.310 2.260 2.174 2.487 . 0 0 "[ . 1 . 2]" 1
1839 2 65 VAL MG2 2 66 ALA H 4.000 . 4.000 3.914 3.835 3.972 . 0 0 "[ . 1 . 2]" 1
1840 2 62 MET ME 2 65 VAL MG1 3.830 . 3.830 2.727 2.162 3.853 0.023 15 0 "[ . 1 . 2]" 1
1841 2 66 ALA HA 2 71 GLN HE21 4.340 . 4.340 2.784 1.842 3.025 . 0 0 "[ . 1 . 2]" 1
1842 2 66 ALA HA 2 71 GLN HB3 4.900 . 4.900 4.739 4.561 4.903 0.003 8 0 "[ . 1 . 2]" 1
1843 2 65 VAL MG1 2 66 ALA HA 3.640 . 3.640 3.156 2.785 3.327 . 0 0 "[ . 1 . 2]" 1
1844 2 65 VAL HB 2 66 ALA HA 4.500 . 4.500 4.406 4.329 4.513 0.013 15 0 "[ . 1 . 2]" 1
1845 2 66 ALA MB 2 67 GLY H 3.230 . 3.230 2.740 2.693 2.775 . 0 0 "[ . 1 . 2]" 1
1846 2 66 ALA MB 2 71 GLN HE21 4.160 . 4.160 2.080 1.892 2.329 . 0 0 "[ . 1 . 2]" 1
1847 2 66 ALA H 2 66 ALA MB 3.080 . 3.080 2.232 2.224 2.237 . 0 0 "[ . 1 . 2]" 1
1848 2 66 ALA MB 2 72 THR HA 3.840 . 3.840 2.981 2.413 3.410 . 0 0 "[ . 1 . 2]" 1
1849 2 65 VAL HA 2 66 ALA MB 5.100 . 5.100 5.033 5.013 5.049 . 0 0 "[ . 1 . 2]" 1
1850 2 66 ALA MB 2 69 ASN HB3 5.310 . 5.310 4.955 4.506 5.315 0.005 15 0 "[ . 1 . 2]" 1
1851 2 66 ALA MB 2 69 ASN HB2 4.480 . 4.480 3.968 3.694 4.306 . 0 0 "[ . 1 . 2]" 1
1852 2 62 MET ME 2 66 ALA MB 3.450 . 3.450 3.315 1.908 3.461 0.011 9 0 "[ . 1 . 2]" 1
1853 2 65 VAL HB 2 66 ALA MB 4.200 . 4.200 4.035 3.930 4.172 . 0 0 "[ . 1 . 2]" 1
1854 2 68 GLN HA 2 70 LYS H 4.540 . 4.540 3.584 3.431 3.822 . 0 0 "[ . 1 . 2]" 1
1855 2 67 GLY H 2 68 GLN HA 5.270 . 5.270 5.216 5.184 5.265 . 0 0 "[ . 1 . 2]" 1
1856 2 68 GLN HA 2 68 GLN HE21 5.100 . 5.100 4.883 4.208 5.105 0.005 10 0 "[ . 1 . 2]" 1
1857 2 68 GLN HA 2 69 ASN HA 4.760 . 4.760 4.641 4.607 4.685 . 0 0 "[ . 1 . 2]" 1
1858 2 68 GLN H 2 68 GLN HB2 4.190 . 4.190 3.668 3.639 3.706 . 0 0 "[ . 1 . 2]" 1
1859 2 68 GLN H 2 68 GLN HB3 4.190 . 4.190 2.967 2.910 3.013 . 0 0 "[ . 1 . 2]" 1
1860 2 68 GLN HB2 2 69 ASN H 4.430 . 4.430 4.057 3.970 4.110 . 0 0 "[ . 1 . 2]" 1
1861 2 65 VAL HA 2 68 GLN HB3 5.000 . 5.000 4.471 4.281 4.650 . 0 0 "[ . 1 . 2]" 1
1862 2 65 VAL HA 2 68 GLN HB2 5.000 . 5.000 4.948 4.828 5.009 0.009 12 0 "[ . 1 . 2]" 1
1863 2 68 GLN HB3 2 69 ASN H 4.430 . 4.430 4.231 4.159 4.276 . 0 0 "[ . 1 . 2]" 1
1864 2 68 GLN HG2 2 70 LYS H 5.500 . 5.500 5.344 5.199 5.506 0.006 12 0 "[ . 1 . 2]" 1
1865 2 68 GLN HG3 2 70 LYS H 5.250 . 5.250 4.836 4.682 4.960 . 0 0 "[ . 1 . 2]" 1
1866 2 66 ALA H 2 68 GLN HG3 5.420 . 5.420 5.396 5.320 5.426 0.006 19 0 "[ . 1 . 2]" 1
1867 2 68 GLN HA 2 68 GLN HG3 3.760 . 3.760 3.739 3.697 3.768 0.008 20 0 "[ . 1 . 2]" 1
1868 2 68 GLN HA 2 68 GLN HG2 3.850 . 3.850 3.774 3.706 3.834 . 0 0 "[ . 1 . 2]" 1
1869 2 65 VAL HA 2 68 GLN HG3 3.890 . 3.890 2.921 2.818 3.015 . 0 0 "[ . 1 . 2]" 1
1870 2 65 VAL MG1 2 68 GLN HG3 3.910 . 3.910 3.332 2.950 3.793 . 0 0 "[ . 1 . 2]" 1
1871 2 69 ASN H 2 69 ASN HB2 3.230 . 3.230 2.280 2.212 2.332 . 0 0 "[ . 1 . 2]" 1
1872 2 66 ALA HA 2 69 ASN HB2 4.080 . 4.080 2.277 1.950 2.679 . 0 0 "[ . 1 . 2]" 1
1873 2 66 ALA HA 2 69 ASN HB3 4.130 . 4.130 3.639 3.174 4.031 . 0 0 "[ . 1 . 2]" 1
1874 2 69 ASN HB3 2 71 GLN HG3 3.750 . 3.750 3.589 3.328 3.719 . 0 0 "[ . 1 . 2]" 1
1875 2 68 GLN HG3 2 69 ASN HB2 4.070 . 4.070 3.919 3.578 4.075 0.005 8 0 "[ . 1 . 2]" 1
1876 2 69 ASN HB3 2 71 GLN HB3 4.300 . 4.300 3.761 3.340 4.081 . 0 0 "[ . 1 . 2]" 1
1877 2 65 VAL MG1 2 69 ASN HB3 4.610 . 4.610 4.024 3.842 4.228 . 0 0 "[ . 1 . 2]" 1
1878 2 65 VAL MG1 2 69 ASN HB2 4.700 . 4.700 3.017 2.862 3.225 . 0 0 "[ . 1 . 2]" 1
1879 2 69 ASN H 2 70 LYS HA 4.840 . 4.840 4.520 4.439 4.592 . 0 0 "[ . 1 . 2]" 1
1880 2 70 LYS HA 2 70 LYS HE2 5.500 . 5.500 4.629 4.135 5.032 . 0 0 "[ . 1 . 2]" 1
1881 2 70 LYS HA 2 70 LYS HE3 5.500 . 5.500 4.740 4.362 5.069 . 0 0 "[ . 1 . 2]" 1
1882 2 89 GLU HB3 2 90 GLU H 4.280 . 4.280 4.215 4.122 4.285 0.005 1 0 "[ . 1 . 2]" 1
1883 2 70 LYS H 2 70 LYS HD3 3.640 . 3.640 2.535 2.050 2.677 . 0 0 "[ . 1 . 2]" 1
1884 2 70 LYS H 2 70 LYS HD2 3.610 . 3.610 2.510 2.264 3.328 . 0 0 "[ . 1 . 2]" 1
1885 2 69 ASN H 2 70 LYS HD2 5.260 . 5.260 4.395 4.108 5.268 0.008 4 0 "[ . 1 . 2]" 1
1886 2 70 LYS HD2 2 71 GLN H 5.320 . 5.320 4.671 4.348 5.211 . 0 0 "[ . 1 . 2]" 1
1887 2 70 LYS HD3 2 71 GLN H 4.910 . 4.910 4.784 4.369 4.920 0.010 18 0 "[ . 1 . 2]" 1
1888 2 69 ASN HA 2 70 LYS HD3 4.530 . 4.530 3.417 2.956 3.713 . 0 0 "[ . 1 . 2]" 1
1889 2 69 ASN HA 2 70 LYS HD2 5.280 . 5.280 4.709 4.318 5.301 0.021 17 0 "[ . 1 . 2]" 1
1890 2 70 LYS HA 2 70 LYS HD2 3.190 . 3.190 2.364 2.140 2.566 . 0 0 "[ . 1 . 2]" 1
1891 2 70 LYS HA 2 70 LYS HD3 3.250 . 3.250 3.170 2.644 3.268 0.018 6 0 "[ . 1 . 2]" 1
1892 2 70 LYS H 2 70 LYS HE2 5.500 . 5.500 4.674 4.230 5.085 . 0 0 "[ . 1 . 2]" 1
1893 2 70 LYS H 2 70 LYS HE3 5.500 . 5.500 4.569 4.148 4.974 . 0 0 "[ . 1 . 2]" 1
1894 2 71 GLN HB3 2 71 GLN HE21 4.570 . 4.570 4.233 4.092 4.583 0.013 19 0 "[ . 1 . 2]" 1
1895 2 71 GLN HB2 2 71 GLN HE21 4.640 . 4.640 3.183 2.972 3.995 . 0 0 "[ . 1 . 2]" 1
1896 2 70 LYS H 2 71 GLN HB3 5.380 . 5.380 5.348 5.154 5.389 0.009 20 0 "[ . 1 . 2]" 1
1897 2 71 GLN H 2 71 GLN HB2 3.990 . 3.990 3.739 3.678 3.810 . 0 0 "[ . 1 . 2]" 1
1898 2 66 ALA MB 2 71 GLN HB2 4.410 . 4.410 3.970 3.782 4.314 . 0 0 "[ . 1 . 2]" 1
1899 2 71 GLN HE21 2 71 GLN HG2 3.370 . 3.370 3.327 2.957 3.392 0.022 4 0 "[ . 1 . 2]" 1
1900 2 70 LYS H 2 71 GLN HG3 4.700 . 4.700 4.496 4.321 4.670 . 0 0 "[ . 1 . 2]" 1
1901 2 70 LYS H 2 71 GLN HG2 4.630 . 4.630 4.206 4.019 4.631 0.001 19 0 "[ . 1 . 2]" 1
1902 2 71 GLN H 2 71 GLN HG2 3.580 . 3.580 2.567 2.432 2.777 . 0 0 "[ . 1 . 2]" 1
1903 2 71 GLN HG2 2 72 THR H 4.980 . 4.980 4.890 4.813 4.948 . 0 0 "[ . 1 . 2]" 1
1904 2 71 GLN HE22 2 71 GLN HG2 4.030 . 4.030 3.989 3.800 4.029 . 0 0 "[ . 1 . 2]" 1
1905 2 71 GLN HA 2 71 GLN HG3 3.620 . 3.620 3.622 3.577 3.642 0.022 12 0 "[ . 1 . 2]" 1
1906 2 71 GLN HA 2 71 GLN HG2 4.120 . 4.120 3.862 3.763 4.011 . 0 0 "[ . 1 . 2]" 1
1907 2 69 ASN HA 2 71 GLN HG2 4.660 . 4.660 4.273 4.150 4.491 . 0 0 "[ . 1 . 2]" 1
1908 2 69 ASN HA 2 71 GLN HG3 5.500 . 5.500 5.504 5.469 5.521 0.021 19 0 "[ . 1 . 2]" 1
1909 2 69 ASN HB3 2 71 GLN HG2 3.790 . 3.790 2.043 1.799 2.205 0.001 8 0 "[ . 1 . 2]" 1
1910 2 69 ASN HB2 2 71 GLN HG2 3.740 . 3.740 2.364 2.091 2.571 . 0 0 "[ . 1 . 2]" 1
1911 2 69 ASN HB2 2 71 GLN HG3 3.740 . 3.740 3.105 2.967 3.255 . 0 0 "[ . 1 . 2]" 1
1912 2 66 ALA MB 2 71 GLN HG3 3.830 . 3.830 2.267 2.138 2.499 . 0 0 "[ . 1 . 2]" 1
1913 2 66 ALA MB 2 71 GLN HG2 4.100 . 4.100 3.718 3.602 3.924 . 0 0 "[ . 1 . 2]" 1
1914 2 71 GLN HG3 2 73 LEU HG 4.430 . 4.430 4.178 3.766 4.433 0.003 18 0 "[ . 1 . 2]" 1
1915 2 72 THR HA 2 72 THR MG 3.160 . 3.160 2.287 2.229 2.348 . 0 0 "[ . 1 . 2]" 1
1916 2 72 THR HA 2 73 LEU HG 4.240 . 4.240 3.649 3.269 3.841 . 0 0 "[ . 1 . 2]" 1
1917 2 72 THR HB 2 73 LEU H 3.310 . 3.310 3.105 2.851 3.310 0.000 11 0 "[ . 1 . 2]" 1
1918 2 72 THR HA 2 72 THR HB 2.950 . 2.950 2.556 2.484 2.643 . 0 0 "[ . 1 . 2]" 1
1919 2 72 THR HB 2 73 LEU HG 5.500 . 5.500 5.399 5.094 5.510 0.010 6 0 "[ . 1 . 2]" 1
1920 2 72 THR H 2 72 THR MG 3.340 . 3.340 3.100 2.939 3.334 . 0 0 "[ . 1 . 2]" 1
1921 2 10 THR MG 2 20 THR H 4.610 . 4.610 3.982 3.324 4.618 0.008 8 0 "[ . 1 . 2]" 1
1922 2 66 ALA H 2 73 LEU HG 4.930 . 4.930 4.826 4.577 4.939 0.009 19 0 "[ . 1 . 2]" 1
1923 2 73 LEU HA 2 73 LEU HG 3.370 . 3.370 3.159 2.996 3.402 0.032 19 0 "[ . 1 . 2]" 1
1924 2 74 PRO HB2 2 75 ALA HA 4.830 . 4.830 4.816 4.646 4.848 0.018 3 0 "[ . 1 . 2]" 1
1925 2 76 ASP HB2 2 77 THR H 4.740 . 4.740 4.229 3.846 4.533 . 0 0 "[ . 1 . 2]" 1
1926 2 77 THR HB 2 104 PRO HB3 5.500 . 5.500 5.516 5.510 5.521 0.021 9 0 "[ . 1 . 2]" 1
1927 2 77 THR HA 2 77 THR MG 3.220 . 3.220 3.219 3.213 3.223 0.003 19 0 "[ . 1 . 2]" 1
1928 2 78 THR HA 2 78 THR MG 2.910 . 2.910 2.350 2.215 3.050 0.140 19 0 "[ . 1 . 2]" 1
1929 2 78 THR MG 2 79 VAL H 3.330 . 3.330 2.654 2.142 3.347 0.017 12 0 "[ . 1 . 2]" 1
1930 2 79 VAL H 2 79 VAL MG1 4.160 . 4.160 3.870 3.848 3.897 . 0 0 "[ . 1 . 2]" 1
1931 2 56 ALA H 2 79 VAL MG1 5.360 . 5.360 5.123 4.705 5.363 0.003 3 0 "[ . 1 . 2]" 1
1932 2 79 VAL MG1 2 80 THR H 3.760 . 3.760 2.708 2.133 2.977 . 0 0 "[ . 1 . 2]" 1
1933 2 55 SER HA 2 79 VAL MG1 3.580 . 3.580 2.903 2.454 3.252 . 0 0 "[ . 1 . 2]" 1
1934 2 79 VAL MG1 2 99 LEU MD2 4.200 . 4.200 3.102 2.789 3.346 . 0 0 "[ . 1 . 2]" 1
1935 2 80 THR HB 2 100 ARG HB2 4.660 . 4.660 2.694 1.808 3.522 . 0 0 "[ . 1 . 2]" 1
1936 2 80 THR HA 2 80 THR MG 3.420 . 3.420 2.327 2.261 2.397 . 0 0 "[ . 1 . 2]" 1
1937 2 80 THR MG 2 82 GLU HB2 3.900 . 3.900 3.152 2.880 3.774 . 0 0 "[ . 1 . 2]" 1
1938 2 52 ALA H 2 81 ALA MB 4.060 . 4.060 3.992 3.625 4.072 0.012 18 0 "[ . 1 . 2]" 1
1939 2 82 GLU HA 2 82 GLU HG3 4.160 . 4.160 2.498 2.428 2.635 . 0 0 "[ . 1 . 2]" 1
1940 1 82 GLU HG3 2 8 ALA HA 4.890 . 4.890 2.780 2.453 3.622 . 0 0 "[ . 1 . 2]" 1
1941 1 82 GLU HG2 2 8 ALA HA 4.890 . 4.890 4.126 3.873 4.521 . 0 0 "[ . 1 . 2]" 1
1942 1 82 GLU HG2 2 8 ALA MB 4.370 . 4.370 3.666 3.504 3.901 . 0 0 "[ . 1 . 2]" 1
1943 1 82 GLU HG3 2 8 ALA MB 4.370 . 4.370 2.100 1.882 2.351 . 0 0 "[ . 1 . 2]" 1
1944 2 10 THR HA 2 11 SER HA 4.830 . 4.830 4.405 4.366 4.465 . 0 0 "[ . 1 . 2]" 1
1945 2 85 ILE HG12 2 86 GLY H 4.280 . 4.280 2.566 2.451 2.646 . 0 0 "[ . 1 . 2]" 1
1946 2 85 ILE HG12 2 93 PHE QD 4.920 . 4.920 3.968 3.651 4.223 . 0 0 "[ . 1 . 2]" 1
1947 2 85 ILE HG13 2 93 PHE QD 4.920 . 4.920 4.338 3.991 4.728 . 0 0 "[ . 1 . 2]" 1
1948 2 85 ILE H 2 85 ILE MG 3.210 . 3.210 2.227 2.040 2.362 . 0 0 "[ . 1 . 2]" 1
1949 1 85 ILE MG 2 4 LEU H 4.500 . 4.500 3.752 3.675 3.859 . 0 0 "[ . 1 . 2]" 1
1950 1 85 ILE MG 2 6 LYS H 4.810 . 4.810 4.759 4.612 4.820 0.010 5 0 "[ . 1 . 2]" 1
1951 1 85 ILE MG 2 5 TYR HD1 3.390 . 3.390 2.960 2.657 3.231 . 0 0 "[ . 1 . 2]" 1
1952 2 84 GLY HA2 2 85 ILE MG 4.110 . 4.110 3.416 3.321 3.533 . 0 0 "[ . 1 . 2]" 1
1953 1 85 ILE MG 2 6 LYS HA 4.550 . 4.550 4.051 3.911 4.190 . 0 0 "[ . 1 . 2]" 1
1954 1 85 ILE MG 2 4 LEU HA 5.260 . 5.260 5.256 5.210 5.269 0.009 18 0 "[ . 1 . 2]" 1
1955 2 84 GLY HA3 2 85 ILE MG 4.580 . 4.580 4.449 4.308 4.587 0.007 1 0 "[ . 1 . 2]" 1
1956 1 85 ILE MG 2 5 TYR HB2 3.900 . 3.900 3.325 3.089 3.566 . 0 0 "[ . 1 . 2]" 1
1957 1 85 ILE MG 2 5 TYR HB3 3.900 . 3.900 2.105 1.890 2.362 . 0 0 "[ . 1 . 2]" 1
1958 2 85 ILE MD 2 86 GLY H 3.750 . 3.750 2.892 2.699 2.965 . 0 0 "[ . 1 . 2]" 1
1959 2 85 ILE MD 2 94 ALA H 4.530 . 4.530 3.512 3.272 3.669 . 0 0 "[ . 1 . 2]" 1
1960 2 85 ILE MD 2 93 PHE QD 3.780 . 3.780 2.324 1.993 2.727 . 0 0 "[ . 1 . 2]" 1
1961 2 85 ILE HA 2 85 ILE MD 4.060 . 4.060 3.373 3.281 3.413 . 0 0 "[ . 1 . 2]" 1
1962 2 85 ILE HB 2 85 ILE MD 3.200 . 3.200 3.208 3.205 3.215 0.015 17 0 "[ . 1 . 2]" 1
1963 2 85 ILE MD 2 85 ILE MG 2.970 . 2.970 1.927 1.913 1.951 . 0 0 "[ . 1 . 2]" 1
1964 2 87 PRO HB2 2 93 PHE QD 5.500 . 5.500 5.264 4.727 5.506 0.006 6 0 "[ . 1 . 2]" 1
1965 2 87 PRO HB3 2 93 PHE QD 4.630 . 4.630 4.047 3.565 4.507 . 0 0 "[ . 1 . 2]" 1
1966 2 88 ASN HB3 2 89 GLU H 4.800 . 4.800 3.890 3.664 4.074 . 0 0 "[ . 1 . 2]" 1
1967 2 89 GLU HA 2 89 GLU HB2 2.920 . 2.920 2.483 2.440 2.528 . 0 0 "[ . 1 . 2]" 1
1968 2 89 GLU H 2 89 GLU HB3 4.160 . 4.160 2.608 2.512 2.701 . 0 0 "[ . 1 . 2]" 1
1969 2 89 GLU HB2 2 90 GLU H 4.350 . 4.350 4.059 3.925 4.146 . 0 0 "[ . 1 . 2]" 1
1970 2 88 ASN HA 2 89 GLU HB3 4.760 . 4.760 4.610 4.491 4.717 . 0 0 "[ . 1 . 2]" 1
1971 2 90 GLU HB3 2 91 GLY H 4.250 . 4.250 3.099 2.961 3.211 . 0 0 "[ . 1 . 2]" 1
1972 2 90 GLU HB3 2 92 GLY H 4.800 . 4.800 3.409 2.824 3.718 . 0 0 "[ . 1 . 2]" 1
1973 2 90 GLU HB2 2 91 GLY H 4.290 . 4.290 4.198 4.100 4.269 . 0 0 "[ . 1 . 2]" 1
1974 2 90 GLU HB3 2 91 GLY HA2 5.440 . 5.440 5.208 5.031 5.326 . 0 0 "[ . 1 . 2]" 1
1975 2 90 GLU HB2 2 90 GLU HG3 2.740 . 2.740 2.457 2.412 2.535 . 0 0 "[ . 1 . 2]" 1
1976 2 90 GLU HG2 2 92 GLY H 4.500 . 4.500 4.106 3.235 4.426 . 0 0 "[ . 1 . 2]" 1
1977 2 90 GLU HA 2 90 GLU HG3 2.900 . 2.900 2.681 2.614 2.751 . 0 0 "[ . 1 . 2]" 1
1978 2 90 GLU HG3 2 91 GLY HA3 5.380 . 5.380 5.194 4.929 5.373 . 0 0 "[ . 1 . 2]" 1
1979 2 90 GLU HG2 2 91 GLY HA3 5.500 . 5.500 4.106 3.988 4.267 . 0 0 "[ . 1 . 2]" 1
1980 2 89 GLU HG3 2 90 GLU H 3.590 . 3.590 2.957 2.642 3.434 . 0 0 "[ . 1 . 2]" 1
1981 2 88 ASN H 2 92 GLY HA3 4.830 . 4.830 4.389 4.211 4.709 . 0 0 "[ . 1 . 2]" 1
1982 2 88 ASN H 2 92 GLY HA2 4.830 . 4.830 4.606 4.374 4.836 0.006 14 0 "[ . 1 . 2]" 1
1983 2 94 ALA H 2 94 ALA MB 3.370 . 3.370 2.614 2.462 2.721 . 0 0 "[ . 1 . 2]" 1
1984 2 86 GLY H 2 94 ALA MB 3.590 . 3.590 3.500 3.366 3.594 0.004 17 0 "[ . 1 . 2]" 1
1985 2 94 ALA MB 2 95 LEU H 3.240 . 3.240 2.958 2.837 3.108 . 0 0 "[ . 1 . 2]" 1
1986 2 92 GLY H 2 94 ALA MB 5.500 . 5.500 5.488 5.170 5.513 0.013 14 0 "[ . 1 . 2]" 1
1987 2 88 ASN HB2 2 94 ALA MB 3.870 . 3.870 2.318 1.804 3.517 . 0 0 "[ . 1 . 2]" 1
1988 2 88 ASN HB3 2 94 ALA MB 3.870 . 3.870 3.420 1.910 3.877 0.007 10 0 "[ . 1 . 2]" 1
1989 2 85 ILE H 2 95 LEU MD1 4.880 . 4.880 4.234 4.016 4.456 . 0 0 "[ . 1 . 2]" 1
1990 2 86 GLY H 2 95 LEU MD1 5.350 . 5.350 4.365 4.132 4.492 . 0 0 "[ . 1 . 2]" 1
1991 2 95 LEU HA 2 95 LEU MD1 4.410 . 4.410 2.031 1.974 2.111 . 0 0 "[ . 1 . 2]" 1
1992 2 86 GLY H 2 95 LEU MD2 4.010 . 4.010 4.006 3.969 4.019 0.009 20 0 "[ . 1 . 2]" 1
1993 2 95 LEU H 2 95 LEU MD2 4.080 . 4.080 2.609 2.515 2.731 . 0 0 "[ . 1 . 2]" 1
1994 2 85 ILE HA 2 95 LEU MD2 3.940 . 3.940 3.371 3.224 3.580 . 0 0 "[ . 1 . 2]" 1
1995 2 95 LEU HA 2 95 LEU MD2 3.540 . 3.540 2.421 2.397 2.448 . 0 0 "[ . 1 . 2]" 1
1996 2 94 ALA HA 2 95 LEU MD2 4.570 . 4.570 3.172 3.054 3.360 . 0 0 "[ . 1 . 2]" 1
1997 2 85 ILE HB 2 95 LEU MD2 3.430 . 3.430 3.309 3.126 3.436 0.006 3 0 "[ . 1 . 2]" 1
1998 2 86 GLY H 2 96 ASP HB2 5.380 . 5.380 5.368 5.298 5.390 0.010 14 0 "[ . 1 . 2]" 1
1999 1 96 ASP HB2 2 1 MET ME 4.540 . 4.540 3.141 2.091 3.851 . 0 0 "[ . 1 . 2]" 1
2000 1 96 ASP HB3 2 3 ILE HG13 4.790 . 4.790 3.794 2.943 4.165 . 0 0 "[ . 1 . 2]" 1
2001 1 96 ASP HB2 2 3 ILE HG13 5.030 . 5.030 4.636 4.096 4.987 . 0 0 "[ . 1 . 2]" 1
2002 2 137 VAL H 2 137 VAL HB 4.160 . 4.160 3.429 3.336 3.554 . 0 0 "[ . 1 . 2]" 1
2003 2 137 VAL HB 2 138 VAL H 4.940 . 4.940 4.065 3.930 4.157 . 0 0 "[ . 1 . 2]" 1
2004 2 100 ARG HA 2 137 VAL HB 4.870 . 4.870 4.588 4.453 4.735 . 0 0 "[ . 1 . 2]" 1
2005 2 99 LEU HA 2 99 LEU MD2 4.160 . 4.160 2.558 1.942 3.871 . 0 0 "[ . 1 . 2]" 1
2006 2 99 LEU H 2 99 LEU MD1 4.650 . 4.650 3.978 3.844 4.166 . 0 0 "[ . 1 . 2]" 1
2007 2 99 LEU HA 2 99 LEU MD1 4.160 . 4.160 3.287 1.833 3.872 . 0 0 "[ . 1 . 2]" 1
2008 2 79 VAL MG1 2 99 LEU MD1 4.200 . 4.200 3.481 2.210 4.206 0.006 6 0 "[ . 1 . 2]" 1
2009 2 136 LEU MD2 2 137 VAL H 3.540 . 3.540 3.413 3.304 3.503 . 0 0 "[ . 1 . 2]" 1
2010 2 99 LEU HA 2 136 LEU MD2 5.240 . 5.240 4.760 4.511 4.950 . 0 0 "[ . 1 . 2]" 1
2011 2 116 ASP HA 2 136 LEU MD2 5.250 . 5.250 4.936 4.284 5.255 0.005 6 0 "[ . 1 . 2]" 1
2012 2 115 VAL HA 2 136 LEU MD2 5.080 . 5.080 4.949 4.790 5.078 . 0 0 "[ . 1 . 2]" 1
2013 2 119 HIS HB3 2 136 LEU MD2 4.580 . 4.580 3.906 3.083 4.496 . 0 0 "[ . 1 . 2]" 1
2014 2 119 HIS HB2 2 136 LEU MD2 4.580 . 4.580 3.576 3.107 4.196 . 0 0 "[ . 1 . 2]" 1
2015 2 136 LEU HB2 2 136 LEU MD2 3.460 . 3.460 3.208 3.202 3.214 . 0 0 "[ . 1 . 2]" 1
2016 2 136 LEU HB3 2 136 LEU MD2 3.130 . 3.130 2.400 2.338 2.429 . 0 0 "[ . 1 . 2]" 1
2017 2 80 THR H 2 100 ARG HB3 4.750 . 4.750 3.326 2.677 3.941 . 0 0 "[ . 1 . 2]" 1
2018 2 80 THR HB 2 100 ARG HB3 4.660 . 4.660 2.723 1.826 3.529 . 0 0 "[ . 1 . 2]" 1
2019 2 100 ARG H 2 100 ARG HG3 4.830 . 4.830 3.629 2.487 4.679 . 0 0 "[ . 1 . 2]" 1
2020 2 80 THR H 2 100 ARG HD2 5.500 . 5.500 5.112 4.186 5.511 0.011 14 0 "[ . 1 . 2]" 1
2021 2 80 THR H 2 100 ARG HD3 5.500 . 5.500 4.995 4.076 5.515 0.015 15 0 "[ . 1 . 2]" 1
2022 2 100 ARG HA 2 100 ARG HD2 4.810 . 4.810 4.501 4.054 4.704 . 0 0 "[ . 1 . 2]" 1
2023 2 100 ARG HD3 2 137 VAL MG2 4.480 . 4.480 3.976 3.393 4.494 0.014 14 0 "[ . 1 . 2]" 1
2024 2 101 VAL HB 2 102 ALA H 4.540 . 4.540 4.405 4.233 4.458 . 0 0 "[ . 1 . 2]" 1
2025 2 101 VAL H 2 138 VAL MG1 5.200 . 5.200 4.074 3.927 4.284 . 0 0 "[ . 1 . 2]" 1
2026 2 102 ALA H 2 102 ALA MB 2.970 . 2.970 2.379 2.312 2.512 . 0 0 "[ . 1 . 2]" 1
2027 2 101 VAL H 2 102 ALA MB 5.040 . 5.040 4.972 4.845 5.048 0.008 10 0 "[ . 1 . 2]" 1
2028 2 78 THR HA 2 102 ALA MB 5.120 . 5.120 4.521 4.325 4.677 . 0 0 "[ . 1 . 2]" 1
2029 2 78 THR HB 2 102 ALA MB 4.110 . 4.110 2.967 2.396 4.115 0.005 19 0 "[ . 1 . 2]" 1
2030 2 103 LEU HB2 2 104 PRO HD2 5.000 . 5.000 4.285 4.038 4.651 . 0 0 "[ . 1 . 2]" 1
2031 2 103 LEU HB3 2 104 PRO HD2 5.000 . 5.000 4.231 3.338 4.498 . 0 0 "[ . 1 . 2]" 1
2032 2 103 LEU HB2 2 104 PRO HD3 5.500 . 5.500 4.872 4.699 5.169 . 0 0 "[ . 1 . 2]" 1
2033 2 103 LEU HB3 2 104 PRO HD3 5.500 . 5.500 4.939 4.434 5.160 . 0 0 "[ . 1 . 2]" 1
2034 2 104 PRO HA 2 105 GLY HA2 4.660 . 4.660 4.428 4.359 4.498 . 0 0 "[ . 1 . 2]" 1
2035 2 104 PRO HA 2 106 LEU HB3 4.860 . 4.860 4.538 4.386 4.730 . 0 0 "[ . 1 . 2]" 1
2036 2 103 LEU H 2 104 PRO HD3 4.750 . 4.750 4.489 4.197 4.643 . 0 0 "[ . 1 . 2]" 1
2037 2 74 PRO HB2 2 104 PRO HD2 4.030 . 4.030 2.893 2.257 3.644 . 0 0 "[ . 1 . 2]" 1
2038 2 104 PRO HD2 2 106 LEU HB3 5.280 . 5.280 5.269 5.137 5.291 0.011 10 0 "[ . 1 . 2]" 1
2039 2 74 PRO HB3 2 104 PRO HG2 4.480 . 4.480 2.647 2.086 2.997 . 0 0 "[ . 1 . 2]" 1
2040 2 90 GLU HB3 2 91 GLY HA3 5.200 . 5.200 4.926 4.774 5.052 . 0 0 "[ . 1 . 2]" 1
2041 2 104 PRO HB2 2 105 GLY HA3 4.900 . 4.900 4.076 4.012 4.146 . 0 0 "[ . 1 . 2]" 1
2042 2 104 PRO HB3 2 105 GLY HA3 5.500 . 5.500 5.489 5.402 5.506 0.006 7 0 "[ . 1 . 2]" 1
2043 2 104 PRO HG2 2 105 GLY HA3 5.090 . 5.090 4.946 4.680 5.095 0.005 5 0 "[ . 1 . 2]" 1
2044 2 106 LEU H 2 106 LEU HB2 3.760 . 3.760 3.221 3.042 3.395 . 0 0 "[ . 1 . 2]" 1
2045 2 106 LEU H 2 106 LEU HB3 3.590 . 3.590 2.516 2.382 2.625 . 0 0 "[ . 1 . 2]" 1
2046 2 106 LEU HB2 2 107 ASP H 3.980 . 3.980 3.974 3.914 3.986 0.006 11 0 "[ . 1 . 2]" 1
2047 2 106 LEU HB2 2 106 LEU MD1 3.320 . 3.320 2.400 2.371 2.436 . 0 0 "[ . 1 . 2]" 1
2048 2 106 LEU HB2 2 114 LEU MD1 4.000 . 4.000 3.938 3.737 4.010 0.010 11 0 "[ . 1 . 2]" 1
2049 2 106 LEU H 2 106 LEU HG 4.360 . 4.360 4.290 4.234 4.345 . 0 0 "[ . 1 . 2]" 1
2050 2 106 LEU HG 2 114 LEU MD1 3.970 . 3.970 3.875 3.740 3.974 0.004 6 0 "[ . 1 . 2]" 1
2051 2 106 LEU MD1 2 107 ASP H 3.090 . 3.090 1.799 1.792 1.819 0.008 16 0 "[ . 1 . 2]" 1
2052 2 106 LEU HA 2 106 LEU MD1 2.790 . 2.790 2.268 2.197 2.316 . 0 0 "[ . 1 . 2]" 1
2053 2 106 LEU MD1 2 110 ALA MB 2.490 . 2.490 1.942 1.861 2.041 . 0 0 "[ . 1 . 2]" 1
2054 2 106 LEU MD1 2 107 ASP HB3 4.400 . 4.400 4.180 3.580 4.412 0.012 1 0 "[ . 1 . 2]" 1
2055 2 106 LEU MD1 2 111 ALA HA 3.370 . 3.370 2.836 2.618 3.012 . 0 0 "[ . 1 . 2]" 1
2056 2 107 ASP HA 2 108 ALA HA 4.440 . 4.440 4.364 4.302 4.441 0.001 8 0 "[ . 1 . 2]" 1
2057 2 107 ASP HB2 2 111 ALA H 4.580 . 4.580 4.253 3.862 4.605 0.025 19 0 "[ . 1 . 2]" 1
2058 2 107 ASP HB3 2 111 ALA H 4.570 . 4.570 4.166 3.225 4.578 0.008 20 0 "[ . 1 . 2]" 1
2059 2 107 ASP HA 2 107 ASP HB3 2.950 . 2.950 2.679 2.485 2.964 0.014 10 0 "[ . 1 . 2]" 1
2060 2 107 ASP HB2 2 110 ALA MB 3.230 . 3.230 2.794 2.291 3.196 . 0 0 "[ . 1 . 2]" 1
2061 2 106 LEU MD1 2 107 ASP HB2 3.650 . 3.650 3.298 3.089 3.654 0.004 8 0 "[ . 1 . 2]" 1
2062 2 108 ALA HA 2 111 ALA H 4.080 . 4.080 3.400 3.223 3.700 . 0 0 "[ . 1 . 2]" 1
2063 2 108 ALA HA 2 110 ALA H 4.830 . 4.830 4.581 4.352 4.724 . 0 0 "[ . 1 . 2]" 1
2064 2 107 ASP HB3 2 108 ALA MB 4.280 . 4.280 4.269 4.179 4.314 0.034 9 0 "[ . 1 . 2]" 1
2065 2 109 ALA HA 2 111 ALA H 5.080 . 5.080 4.554 4.442 4.728 . 0 0 "[ . 1 . 2]" 1
2066 2 109 ALA MB 2 110 ALA H 2.850 . 2.850 2.384 2.307 2.511 . 0 0 "[ . 1 . 2]" 1
2067 2 110 ALA HA 2 112 LYS H 4.430 . 4.430 4.203 4.070 4.356 . 0 0 "[ . 1 . 2]" 1
2068 2 106 LEU MD1 2 110 ALA HA 4.850 . 4.850 4.154 3.958 4.300 . 0 0 "[ . 1 . 2]" 1
2069 2 110 ALA HA 2 114 LEU HG 5.200 . 5.200 4.034 3.848 4.209 . 0 0 "[ . 1 . 2]" 1
2070 2 109 ALA H 2 110 ALA HA 5.440 . 5.440 5.383 5.273 5.437 . 0 0 "[ . 1 . 2]" 1
2071 2 107 ASP HB3 2 110 ALA MB 3.980 . 3.980 3.452 2.536 3.982 0.002 7 0 "[ . 1 . 2]" 1
2072 2 110 ALA MB 2 114 LEU MD1 3.440 . 3.440 3.023 2.772 3.188 . 0 0 "[ . 1 . 2]" 1
2073 2 110 ALA MB 2 114 LEU MD2 3.760 . 3.760 3.580 3.347 3.762 0.002 19 0 "[ . 1 . 2]" 1
2074 2 110 ALA H 2 111 ALA HA 5.330 . 5.330 5.142 5.039 5.196 . 0 0 "[ . 1 . 2]" 1
2075 2 111 ALA HA 2 114 LEU HB2 3.850 . 3.850 2.433 2.217 2.630 . 0 0 "[ . 1 . 2]" 1
2076 2 111 ALA HA 2 138 VAL HB 4.970 . 4.970 4.594 4.470 4.785 . 0 0 "[ . 1 . 2]" 1
2077 2 111 ALA H 2 111 ALA MB 2.900 . 2.900 2.235 2.221 2.257 . 0 0 "[ . 1 . 2]" 1
2078 2 110 ALA H 2 111 ALA MB 4.220 . 4.220 4.183 4.063 4.225 0.005 9 0 "[ . 1 . 2]" 1
2079 2 109 ALA H 2 111 ALA MB 4.700 . 4.700 4.468 4.341 4.605 . 0 0 "[ . 1 . 2]" 1
2080 2 108 ALA HA 2 111 ALA MB 3.070 . 3.070 2.164 1.998 2.472 . 0 0 "[ . 1 . 2]" 1
2081 2 111 ALA MB 2 138 VAL HA 4.530 . 4.530 3.982 3.709 4.222 . 0 0 "[ . 1 . 2]" 1
2082 2 111 ALA MB 2 138 VAL MG1 3.730 . 3.730 2.665 2.385 2.848 . 0 0 "[ . 1 . 2]" 1
2083 2 106 LEU MD1 2 111 ALA MB 2.930 . 2.930 2.939 2.931 2.949 0.019 12 0 "[ . 1 . 2]" 1
2084 2 112 LYS HA 2 115 VAL HB 4.360 . 4.360 3.359 2.788 3.627 . 0 0 "[ . 1 . 2]" 1
2085 2 112 LYS HA 2 138 VAL HB 4.440 . 4.440 4.377 4.228 4.455 0.015 10 0 "[ . 1 . 2]" 1
2086 2 112 LYS HA 2 115 VAL MG2 4.220 . 4.220 3.733 3.241 4.218 . 0 0 "[ . 1 . 2]" 1
2087 2 111 ALA MB 2 138 VAL HB 3.300 . 3.300 2.130 2.014 2.300 . 0 0 "[ . 1 . 2]" 1
2088 2 112 LYS H 2 112 LYS HG3 4.040 . 4.040 2.755 2.202 3.868 . 0 0 "[ . 1 . 2]" 1
2089 2 112 LYS H 2 112 LYS HG2 4.040 . 4.040 3.203 2.213 3.731 . 0 0 "[ . 1 . 2]" 1
2090 2 112 LYS HA 2 112 LYS HG2 3.820 . 3.820 2.605 2.413 3.008 . 0 0 "[ . 1 . 2]" 1
2091 2 112 LYS HA 2 112 LYS HG3 3.820 . 3.820 3.198 2.864 3.773 . 0 0 "[ . 1 . 2]" 1
2092 2 112 LYS HG2 2 138 VAL MG2 5.060 . 5.060 2.655 2.286 2.907 . 0 0 "[ . 1 . 2]" 1
2093 2 112 LYS HG3 2 138 VAL MG2 5.060 . 5.060 2.772 2.087 4.182 . 0 0 "[ . 1 . 2]" 1
2094 2 112 LYS HG2 2 138 VAL MG1 5.060 . 5.060 2.957 2.396 3.739 . 0 0 "[ . 1 . 2]" 1
2095 2 112 LYS HG3 2 138 VAL MG1 5.060 . 5.060 3.590 3.012 4.794 . 0 0 "[ . 1 . 2]" 1
2096 2 112 LYS H 2 112 LYS HD3 4.930 . 4.930 4.344 3.594 4.882 . 0 0 "[ . 1 . 2]" 1
2097 2 112 LYS HA 2 112 LYS HD2 4.750 . 4.750 4.081 1.926 4.763 0.013 13 0 "[ . 1 . 2]" 1
2098 2 112 LYS HA 2 112 LYS HD3 4.750 . 4.750 3.931 2.048 4.756 0.006 9 0 "[ . 1 . 2]" 1
2099 2 113 THR HB 2 114 LEU MD2 4.730 . 4.730 4.736 4.733 4.740 0.010 18 0 "[ . 1 . 2]" 1
2100 2 112 LYS HB2 2 113 THR HB 4.500 . 4.500 4.073 3.884 4.247 . 0 0 "[ . 1 . 2]" 1
2101 2 113 THR MG 2 114 LEU H 3.290 . 3.290 2.219 2.146 2.412 . 0 0 "[ . 1 . 2]" 1
2102 2 112 LYS H 2 113 THR HA 5.420 . 5.420 5.412 5.307 5.430 0.010 10 0 "[ . 1 . 2]" 1
2103 2 113 THR HA 2 115 VAL H 4.680 . 4.680 4.546 4.294 4.682 0.002 18 0 "[ . 1 . 2]" 1
2104 2 113 THR HA 2 116 ASP HB2 3.890 . 3.890 2.912 2.751 2.968 . 0 0 "[ . 1 . 2]" 1
2105 2 112 LYS HB3 2 113 THR HA 4.390 . 4.390 4.201 3.965 4.374 . 0 0 "[ . 1 . 2]" 1
2106 2 113 THR HA 2 113 THR MG 3.180 . 3.180 3.179 3.052 3.194 0.014 10 0 "[ . 1 . 2]" 1
2107 2 114 LEU HG 2 115 VAL H 4.530 . 4.530 4.244 4.172 4.348 . 0 0 "[ . 1 . 2]" 1
2108 2 114 LEU HA 2 114 LEU MD2 3.000 . 3.000 2.014 1.974 2.040 . 0 0 "[ . 1 . 2]" 1
2109 2 114 LEU HB2 2 114 LEU MD1 3.340 . 3.340 2.438 2.401 2.463 . 0 0 "[ . 1 . 2]" 1
2110 2 114 LEU HB3 2 114 LEU MD1 3.620 . 3.620 2.318 2.293 2.356 . 0 0 "[ . 1 . 2]" 1
2111 2 111 ALA HA 2 114 LEU MD1 3.250 . 3.250 2.700 2.372 2.993 . 0 0 "[ . 1 . 2]" 1
2112 2 114 LEU H 2 114 LEU MD2 3.730 . 3.730 2.992 2.907 3.198 . 0 0 "[ . 1 . 2]" 1
2113 2 114 LEU MD1 2 115 VAL H 4.990 . 4.990 4.547 4.447 4.652 . 0 0 "[ . 1 . 2]" 1
2114 2 114 LEU MD2 2 115 VAL H 5.350 . 5.350 4.521 4.477 4.580 . 0 0 "[ . 1 . 2]" 1
2115 2 115 VAL HA 2 118 ALA MB 3.790 . 3.790 2.452 2.264 2.726 . 0 0 "[ . 1 . 2]" 1
2116 2 115 VAL HA 2 115 VAL MG2 3.700 . 3.700 2.388 2.328 2.444 . 0 0 "[ . 1 . 2]" 1
2117 2 115 VAL MG2 2 139 ALA H 4.850 . 4.850 4.761 4.475 4.868 0.018 18 0 "[ . 1 . 2]" 1
2118 2 114 LEU H 2 115 VAL MG2 4.630 . 4.630 4.174 4.039 4.366 . 0 0 "[ . 1 . 2]" 1
2119 2 101 VAL HA 2 115 VAL MG2 5.200 . 5.200 4.666 4.566 4.830 . 0 0 "[ . 1 . 2]" 1
2120 2 101 VAL HB 2 115 VAL MG2 3.340 . 3.340 2.488 2.360 2.602 . 0 0 "[ . 1 . 2]" 1
2121 2 114 LEU HB2 2 115 VAL MG2 3.610 . 3.610 3.155 2.971 3.313 . 0 0 "[ . 1 . 2]" 1
2122 2 115 VAL MG2 2 136 LEU MD1 5.110 . 5.110 4.525 4.255 4.971 . 0 0 "[ . 1 . 2]" 1
2123 2 115 VAL MG2 2 136 LEU MD2 4.130 . 4.130 4.106 3.938 4.140 0.010 19 0 "[ . 1 . 2]" 1
2124 2 115 VAL MG2 2 116 ASP HA 5.500 . 5.500 5.436 5.380 5.492 . 0 0 "[ . 1 . 2]" 1
2125 2 116 ASP HB3 2 117 ARG HA 4.540 . 4.540 4.154 4.048 4.319 . 0 0 "[ . 1 . 2]" 1
2126 2 113 THR HB 2 116 ASP HB2 5.500 . 5.500 5.476 5.349 5.509 0.009 8 0 "[ . 1 . 2]" 1
2127 2 116 ASP HB2 2 117 ARG HA 5.500 . 5.500 5.505 5.492 5.512 0.012 7 0 "[ . 1 . 2]" 1
2128 2 113 THR HA 2 116 ASP HB3 4.030 . 4.030 2.483 2.257 2.674 . 0 0 "[ . 1 . 2]" 1
2129 2 113 THR MG 2 116 ASP HB2 5.430 . 5.430 5.405 5.126 5.442 0.012 18 0 "[ . 1 . 2]" 1
2130 2 113 THR MG 2 116 ASP HB3 4.720 . 4.720 4.545 4.144 4.725 0.005 3 0 "[ . 1 . 2]" 1
2131 2 117 ARG HB2 2 118 ALA H 4.620 . 4.620 3.669 3.596 3.763 . 0 0 "[ . 1 . 2]" 1
2132 2 117 ARG H 2 117 ARG HD2 4.180 . 4.180 3.783 3.641 3.918 . 0 0 "[ . 1 . 2]" 1
2133 2 117 ARG H 2 117 ARG HD3 4.180 . 4.180 4.176 4.025 4.199 0.019 11 0 "[ . 1 . 2]" 1
2134 2 117 ARG HD2 2 118 ALA H 5.020 . 5.020 4.790 4.710 4.878 . 0 0 "[ . 1 . 2]" 1
2135 2 117 ARG HD3 2 118 ALA H 5.020 . 5.020 4.407 4.281 4.495 . 0 0 "[ . 1 . 2]" 1
2136 2 34 ARG HD2 2 38 GLY H 5.310 . 5.310 4.091 2.517 5.333 0.023 7 0 "[ . 1 . 2]" 1
2137 2 34 ARG HD3 2 38 GLY H 5.310 . 5.310 4.002 2.366 5.303 . 0 0 "[ . 1 . 2]" 1
2138 2 117 ARG HB2 2 118 ALA HA 5.040 . 5.040 4.485 4.328 4.646 . 0 0 "[ . 1 . 2]" 1
2139 2 118 ALA MB 2 119 HIS H 3.650 . 3.650 2.526 2.277 2.973 . 0 0 "[ . 1 . 2]" 1
2140 2 114 LEU HA 2 118 ALA MB 4.300 . 4.300 4.266 3.975 4.311 0.011 15 0 "[ . 1 . 2]" 1
2141 2 120 HIS H 2 120 HIS HB2 3.730 . 3.730 2.749 2.302 3.178 . 0 0 "[ . 1 . 2]" 1
2142 2 120 HIS H 2 120 HIS HB3 3.730 . 3.730 2.734 2.381 3.703 . 0 0 "[ . 1 . 2]" 1
2143 2 120 HIS HB3 2 121 VAL H 4.590 . 4.590 2.937 2.492 3.721 . 0 0 "[ . 1 . 2]" 1
2144 2 120 HIS HB2 2 121 VAL H 4.590 . 4.590 3.778 2.526 4.182 . 0 0 "[ . 1 . 2]" 1
2145 2 120 HIS HB3 2 121 VAL MG2 6.190 . 6.190 4.116 3.334 5.236 . 0 0 "[ . 1 . 2]" 1
2146 2 120 HIS HB3 2 121 VAL MG1 6.190 . 6.190 3.019 2.634 3.829 . 0 0 "[ . 1 . 2]" 1
2147 2 120 HIS HB2 2 121 VAL MG1 6.190 . 6.190 4.219 2.657 4.700 . 0 0 "[ . 1 . 2]" 1
2148 2 127 ALA HA 2 131 ASN HB3 4.480 . 4.480 3.008 2.050 3.529 . 0 0 "[ . 1 . 2]" 1
2149 2 127 ALA MB 2 128 THR H 3.590 . 3.590 3.372 3.017 3.470 . 0 0 "[ . 1 . 2]" 1
2150 2 127 ALA MB 2 129 ARG H 4.700 . 4.700 4.520 4.256 4.709 0.009 5 0 "[ . 1 . 2]" 1
2151 2 127 ALA MB 2 128 THR HA 4.140 . 4.140 4.022 3.741 4.144 0.004 3 0 "[ . 1 . 2]" 1
2152 2 128 THR H 2 128 THR MG 3.100 . 3.100 2.395 2.058 2.662 . 0 0 "[ . 1 . 2]" 1
2153 2 128 THR HA 2 128 THR MG 3.210 . 3.210 3.193 3.155 3.217 0.007 12 0 "[ . 1 . 2]" 1
2154 2 128 THR H 2 129 ARG HA 4.950 . 4.950 4.752 4.652 4.854 . 0 0 "[ . 1 . 2]" 1
2155 2 129 ARG HA 2 130 ASN HA 4.930 . 4.930 4.667 4.595 4.722 . 0 0 "[ . 1 . 2]" 1
2156 2 128 THR H 2 129 ARG HB2 5.500 . 5.500 5.522 5.503 5.542 0.042 16 0 "[ . 1 . 2]" 1
2157 2 128 THR H 2 129 ARG HB3 4.890 . 4.890 4.474 4.319 4.704 . 0 0 "[ . 1 . 2]" 1
2158 2 129 ARG H 2 129 ARG HG2 4.320 . 4.320 2.170 1.985 2.433 . 0 0 "[ . 1 . 2]" 1
2159 2 128 THR H 2 129 ARG HG3 4.880 . 4.880 4.567 4.125 4.883 0.003 15 0 "[ . 1 . 2]" 1
2160 2 128 THR H 2 129 ARG HG2 4.880 . 4.880 3.185 2.968 3.465 . 0 0 "[ . 1 . 2]" 1
2161 2 129 ARG HG3 2 130 ASN HD22 5.180 . 5.180 3.030 2.523 3.742 . 0 0 "[ . 1 . 2]" 1
2162 2 129 ARG HG3 2 130 ASN HD21 5.180 . 5.180 3.041 1.920 3.838 . 0 0 "[ . 1 . 2]" 1
2163 2 129 ARG HG2 2 130 ASN HD21 5.180 . 5.180 3.940 2.794 5.180 0.000 12 0 "[ . 1 . 2]" 1
2164 2 129 ARG HG2 2 130 ASN H 4.350 . 4.350 2.504 2.178 2.920 . 0 0 "[ . 1 . 2]" 1
2165 2 129 ARG HA 2 129 ARG HG2 4.220 . 4.220 3.753 3.653 3.834 . 0 0 "[ . 1 . 2]" 1
2166 2 129 ARG HA 2 129 ARG HG3 4.220 . 4.220 3.802 3.718 3.898 . 0 0 "[ . 1 . 2]" 1
2167 2 129 ARG H 2 129 ARG HD2 4.780 . 4.780 4.514 4.016 4.799 0.019 16 0 "[ . 1 . 2]" 1
2168 2 129 ARG H 2 129 ARG HD3 4.780 . 4.780 4.552 4.312 4.792 0.012 6 0 "[ . 1 . 2]" 1
2169 2 129 ARG HD2 2 130 ASN H 4.710 . 4.710 4.525 4.297 4.726 0.016 17 0 "[ . 1 . 2]" 1
2170 2 128 THR MG 2 129 ARG HD2 5.070 . 5.070 4.274 3.213 5.073 0.003 7 0 "[ . 1 . 2]" 1
2171 2 128 THR MG 2 129 ARG HD3 5.070 . 5.070 4.495 3.579 5.084 0.014 2 0 "[ . 1 . 2]" 1
2172 2 129 ARG HB2 2 129 ARG HD2 4.090 . 4.090 2.937 2.362 3.809 . 0 0 "[ . 1 . 2]" 1
2173 2 129 ARG HB2 2 129 ARG HD3 4.090 . 4.090 3.411 2.628 3.762 . 0 0 "[ . 1 . 2]" 1
2174 2 132 VAL HA 2 132 VAL MG1 3.660 . 3.660 2.376 2.305 2.416 . 0 0 "[ . 1 . 2]" 1
2175 2 132 VAL HA 2 132 VAL MG2 3.660 . 3.660 2.507 2.413 3.223 . 0 0 "[ . 1 . 2]" 1
2176 2 132 VAL HA 2 133 ALA MB 3.980 . 3.980 3.987 3.982 3.996 0.016 3 0 "[ . 1 . 2]" 1
2177 2 133 ALA H 2 133 ALA MB 3.010 . 3.010 2.280 2.229 2.348 . 0 0 "[ . 1 . 2]" 1
2178 2 97 VAL H 2 134 VAL HA 4.770 . 4.770 2.754 2.520 2.981 . 0 0 "[ . 1 . 2]" 1
2179 2 134 VAL HB 2 135 ARG H 4.900 . 4.900 4.263 3.947 4.412 . 0 0 "[ . 1 . 2]" 1
2180 2 97 VAL H 2 134 VAL MG1 4.570 . 4.570 4.254 3.915 4.582 0.012 15 0 "[ . 1 . 2]" 1
2181 2 134 VAL H 2 134 VAL MG1 4.010 . 4.010 3.839 3.782 3.915 . 0 0 "[ . 1 . 2]" 1
2182 2 54 TYR HD2 2 134 VAL MG1 5.070 . 5.070 4.899 4.183 5.076 0.006 9 0 "[ . 1 . 2]" 1
2183 2 134 VAL HA 2 134 VAL MG1 3.530 . 3.530 2.365 2.220 2.461 . 0 0 "[ . 1 . 2]" 1
2184 2 133 ALA HA 2 134 VAL MG1 5.500 . 5.500 5.521 5.513 5.531 0.031 12 0 "[ . 1 . 2]" 1
2185 2 134 VAL MG1 2 136 LEU MD2 3.360 . 3.360 2.680 2.362 3.366 0.006 19 0 "[ . 1 . 2]" 1
2186 2 99 LEU MD1 2 134 VAL MG1 4.070 . 4.070 2.636 1.983 3.693 . 0 0 "[ . 1 . 2]" 1
2187 2 99 LEU MD2 2 134 VAL MG1 4.070 . 4.070 3.226 2.642 3.658 . 0 0 "[ . 1 . 2]" 1
2188 2 119 HIS HD2 2 136 LEU MD1 3.680 . 3.680 3.391 2.457 3.694 0.014 15 0 "[ . 1 . 2]" 1
2189 2 119 HIS H 2 136 LEU MD1 4.730 . 4.730 4.401 4.113 4.689 . 0 0 "[ . 1 . 2]" 1
2190 2 116 ASP HA 2 136 LEU MD1 3.910 . 3.910 2.979 2.408 3.373 . 0 0 "[ . 1 . 2]" 1
2191 2 119 HIS HB2 2 136 LEU MD1 4.090 . 4.090 2.893 2.461 3.244 . 0 0 "[ . 1 . 2]" 1
2192 2 119 HIS HB3 2 136 LEU MD1 4.090 . 4.090 2.881 2.353 3.825 . 0 0 "[ . 1 . 2]" 1
2193 2 115 VAL HA 2 136 LEU MD1 5.320 . 5.320 4.827 4.558 5.225 . 0 0 "[ . 1 . 2]" 1
2194 2 134 VAL HB 2 136 LEU MD1 5.080 . 5.080 4.921 4.445 5.090 0.010 19 0 "[ . 1 . 2]" 1
2195 2 136 LEU HB3 2 136 LEU MD1 3.130 . 3.130 2.397 2.378 2.481 . 0 0 "[ . 1 . 2]" 1
2196 2 136 LEU HG 2 137 VAL H 5.060 . 5.060 5.033 4.838 5.073 0.013 10 0 "[ . 1 . 2]" 1
2197 2 135 ARG HA 2 136 LEU HG 5.130 . 5.130 4.327 4.023 4.651 . 0 0 "[ . 1 . 2]" 1
2198 2 99 LEU H 2 99 LEU HG 4.720 . 4.720 3.318 2.614 4.619 . 0 0 "[ . 1 . 2]" 1
2199 2 137 VAL HA 2 137 VAL MG1 3.220 . 3.220 3.149 3.110 3.177 . 0 0 "[ . 1 . 2]" 1
2200 2 100 ARG HA 2 137 VAL MG1 3.830 . 3.830 1.923 1.794 2.124 0.006 16 0 "[ . 1 . 2]" 1
2201 2 137 VAL H 2 137 VAL MG1 3.190 . 3.190 1.995 1.884 2.097 . 0 0 "[ . 1 . 2]" 1
2202 2 101 VAL H 2 137 VAL MG1 4.120 . 4.120 3.686 3.577 3.866 . 0 0 "[ . 1 . 2]" 1
2203 2 136 LEU MD2 2 137 VAL MG1 4.270 . 4.270 4.282 4.273 4.290 0.020 7 0 "[ . 1 . 2]" 1
2204 2 101 VAL H 2 137 VAL MG2 3.840 . 3.840 3.589 3.382 3.840 0.000 10 0 "[ . 1 . 2]" 1
2205 2 137 VAL H 2 137 VAL MG2 3.720 . 3.720 3.665 3.572 3.729 0.009 10 0 "[ . 1 . 2]" 1
2206 2 100 ARG H 2 137 VAL MG2 4.990 . 4.990 4.914 4.703 4.999 0.009 3 0 "[ . 1 . 2]" 1
2207 2 137 VAL MG2 2 139 ALA H 4.460 . 4.460 4.391 4.271 4.465 0.005 7 0 "[ . 1 . 2]" 1
2208 2 137 VAL MG2 2 138 VAL H 3.020 . 3.020 2.952 2.647 3.028 0.008 18 0 "[ . 1 . 2]" 1
2209 2 100 ARG HA 2 137 VAL MG2 3.680 . 3.680 2.680 2.367 2.838 . 0 0 "[ . 1 . 2]" 1
2210 2 137 VAL MG2 2 138 VAL HA 3.900 . 3.900 3.749 3.672 3.870 . 0 0 "[ . 1 . 2]" 1
2211 2 137 VAL HA 2 137 VAL MG2 2.940 . 2.940 2.656 2.592 2.756 . 0 0 "[ . 1 . 2]" 1
2212 2 100 ARG HD2 2 137 VAL MG2 4.480 . 4.480 4.050 3.372 4.504 0.024 15 0 "[ . 1 . 2]" 1
2213 2 138 VAL HB 2 139 ALA H 4.310 . 4.310 2.921 2.828 3.007 . 0 0 "[ . 1 . 2]" 1
2214 2 109 ALA HA 2 112 LYS HB2 3.700 . 3.700 3.436 2.966 3.703 0.003 11 0 "[ . 1 . 2]" 1
2215 2 101 VAL H 2 101 VAL MG1 4.640 . 4.640 3.799 3.754 3.855 . 0 0 "[ . 1 . 2]" 1
2216 2 138 VAL HA 2 138 VAL MG2 3.330 . 3.330 3.185 3.177 3.194 . 0 0 "[ . 1 . 2]" 1
2217 2 111 ALA MB 2 138 VAL MG2 3.730 . 3.730 2.257 2.026 2.414 . 0 0 "[ . 1 . 2]" 1
2218 2 138 VAL H 2 139 ALA HA 5.310 . 5.310 5.135 5.016 5.318 0.008 1 0 "[ . 1 . 2]" 1
2219 2 101 VAL H 2 139 ALA HA 5.500 . 5.500 5.202 4.622 5.506 0.006 11 0 "[ . 1 . 2]" 1
2220 2 102 ALA HA 2 139 ALA HA 4.980 . 4.980 4.688 4.297 4.986 0.006 8 0 "[ . 1 . 2]" 1
2221 2 138 VAL HA 2 139 ALA HA 4.620 . 4.620 4.303 4.205 4.359 . 0 0 "[ . 1 . 2]" 1
2222 2 138 VAL HB 2 139 ALA HA 5.400 . 5.400 5.056 4.841 5.266 . 0 0 "[ . 1 . 2]" 1
2223 2 137 VAL MG2 2 139 ALA HA 4.250 . 4.250 3.930 3.520 4.203 . 0 0 "[ . 1 . 2]" 1
2224 2 139 ALA H 2 139 ALA MB 2.600 . 2.600 2.331 2.223 2.473 . 0 0 "[ . 1 . 2]" 1
2225 2 101 VAL H 2 139 ALA MB 4.020 . 4.020 3.893 3.602 4.026 0.006 1 0 "[ . 1 . 2]" 1
2226 2 138 VAL HA 2 139 ALA MB 3.940 . 3.940 3.905 3.810 3.950 0.010 13 0 "[ . 1 . 2]" 1
2227 2 102 ALA HA 2 139 ALA MB 3.030 . 3.030 1.908 1.791 2.194 0.009 14 0 "[ . 1 . 2]" 1
2228 2 79 VAL MG2 2 102 ALA H 4.430 . 4.430 3.247 2.847 3.650 . 0 0 "[ . 1 . 2]" 1
2229 2 79 VAL H 2 79 VAL MG2 4.210 . 4.210 2.964 2.783 3.079 . 0 0 "[ . 1 . 2]" 1
2230 2 48 GLN H 2 48 GLN HG2 4.560 . 4.560 4.449 4.344 4.571 0.011 4 0 "[ . 1 . 2]" 1
2231 2 48 GLN H 2 48 GLN HG3 4.560 . 4.560 4.492 4.386 4.570 0.010 8 0 "[ . 1 . 2]" 1
2232 2 48 GLN HG3 2 51 ALA MB 5.340 . 5.340 4.398 3.697 5.258 . 0 0 "[ . 1 . 2]" 1
2233 2 48 GLN HG2 2 51 ALA MB 5.340 . 5.340 4.115 3.385 4.943 . 0 0 "[ . 1 . 2]" 1
2234 2 35 GLU H 2 35 GLU HG2 4.750 . 4.750 2.820 1.849 4.583 . 0 0 "[ . 1 . 2]" 1
2235 2 35 GLU H 2 35 GLU HG3 4.750 . 4.750 3.586 1.940 4.537 . 0 0 "[ . 1 . 2]" 1
2236 2 121 VAL HB 2 122 CYS H 4.610 . 4.610 4.051 3.709 4.465 . 0 0 "[ . 1 . 2]" 1
2237 2 113 THR MG 2 117 ARG HD3 3.390 . 3.390 3.285 2.903 3.395 0.005 1 0 "[ . 1 . 2]" 1
2238 2 113 THR MG 2 117 ARG HD2 3.390 . 3.390 3.263 2.780 3.397 0.007 7 0 "[ . 1 . 2]" 1
2239 2 49 LEU MD1 2 51 ALA H 5.190 . 5.190 4.979 4.917 5.142 . 0 0 "[ . 1 . 2]" 1
2240 2 49 LEU MD1 2 54 TYR H 5.500 . 5.500 5.300 4.873 5.503 0.003 8 0 "[ . 1 . 2]" 1
2241 1 49 LEU MD1 2 54 TYR H 5.500 . 5.500 4.177 3.641 4.459 . 0 0 "[ . 1 . 2]" 1
2242 2 49 LEU MD2 2 52 ALA H 5.290 . 5.290 4.741 4.538 4.925 . 0 0 "[ . 1 . 2]" 1
2243 1 49 LEU MD1 2 53 GLY HA3 4.220 . 4.220 1.847 1.795 1.948 0.005 19 0 "[ . 1 . 2]" 1
2244 2 49 LEU MD2 2 52 ALA MB 3.630 . 3.630 3.218 2.916 3.485 . 0 0 "[ . 1 . 2]" 1
2245 2 3 ILE HG12 2 4 LEU H 5.180 . 5.180 4.950 4.897 4.979 . 0 0 "[ . 1 . 2]" 1
2246 1 3 ILE HG13 2 85 ILE H 5.110 . 5.110 4.907 4.804 5.010 . 0 0 "[ . 1 . 2]" 1
2247 2 103 LEU H 2 103 LEU HG 4.760 . 4.760 4.489 3.409 4.777 0.017 3 0 "[ . 1 . 2]" 1
2248 2 77 THR HB 2 103 LEU HG 4.590 . 4.590 4.334 4.041 4.630 0.040 3 0 "[ . 1 . 2]" 1
2249 2 106 LEU MD2 2 111 ALA H 3.690 . 3.690 3.483 3.318 3.577 . 0 0 "[ . 1 . 2]" 1
2250 2 106 LEU MD2 2 107 ASP H 4.520 . 4.520 4.317 4.201 4.365 . 0 0 "[ . 1 . 2]" 1
2251 2 106 LEU MD2 2 112 LYS H 5.090 . 5.090 4.898 4.785 5.019 . 0 0 "[ . 1 . 2]" 1
2252 2 106 LEU H 2 106 LEU MD2 4.600 . 4.600 4.451 4.338 4.526 . 0 0 "[ . 1 . 2]" 1
2253 2 106 LEU HA 2 106 LEU MD2 4.000 . 4.000 3.937 3.917 3.975 . 0 0 "[ . 1 . 2]" 1
2254 2 106 LEU MD2 2 111 ALA HA 3.110 . 3.110 1.945 1.797 2.129 0.003 9 0 "[ . 1 . 2]" 1
2255 2 104 PRO HD2 2 106 LEU MD2 5.430 . 5.430 5.374 5.269 5.444 0.014 1 0 "[ . 1 . 2]" 1
2256 2 106 LEU MD2 2 111 ALA MB 2.560 . 2.560 2.107 1.888 2.199 . 0 0 "[ . 1 . 2]" 1
2257 2 3 ILE MG 2 4 LEU HG 5.190 . 5.190 4.755 4.616 4.962 . 0 0 "[ . 1 . 2]" 1
2258 2 4 LEU HA 2 4 LEU MD2 2.890 . 2.890 2.059 2.035 2.093 . 0 0 "[ . 1 . 2]" 1
2259 2 2 ASN HD22 2 4 LEU MD2 4.000 . 4.000 3.100 2.553 3.462 . 0 0 "[ . 1 . 2]" 1
2260 2 4 LEU H 2 4 LEU MD2 3.750 . 3.750 3.418 3.310 3.475 . 0 0 "[ . 1 . 2]" 1
2261 2 74 PRO HB3 2 77 THR H 5.500 . 5.500 5.031 4.617 5.500 0.000 14 0 "[ . 1 . 2]" 1
2262 2 74 PRO HB3 2 76 ASP H 4.750 . 4.750 3.434 3.086 3.952 . 0 0 "[ . 1 . 2]" 1
2263 2 74 PRO HB3 2 104 PRO HD3 5.500 . 5.500 5.322 4.689 5.507 0.007 14 0 "[ . 1 . 2]" 1
2264 2 74 PRO HB3 2 104 PRO HD2 4.360 . 4.360 4.219 3.335 4.371 0.011 1 0 "[ . 1 . 2]" 1
2265 2 115 VAL H 2 115 VAL MG1 3.780 . 3.780 3.776 3.760 3.782 0.002 16 0 "[ . 1 . 2]" 1
2266 2 115 VAL HA 2 115 VAL MG1 3.520 . 3.520 2.440 2.389 2.518 . 0 0 "[ . 1 . 2]" 1
2267 2 115 VAL MG1 2 116 ASP HA 4.190 . 4.190 3.543 3.293 3.701 . 0 0 "[ . 1 . 2]" 1
2268 2 115 VAL MG1 2 136 LEU MD1 3.270 . 3.270 2.146 1.852 2.561 . 0 0 "[ . 1 . 2]" 1
2269 2 115 VAL MG1 2 136 LEU MD2 3.360 . 3.360 2.108 1.892 2.288 . 0 0 "[ . 1 . 2]" 1
2270 2 121 VAL H 2 121 VAL MG1 3.670 . 3.670 2.499 2.255 3.053 . 0 0 "[ . 1 . 2]" 1
2271 2 101 VAL H 2 101 VAL MG2 3.840 . 3.840 2.588 2.493 2.743 . 0 0 "[ . 1 . 2]" 1
2272 2 100 ARG HA 2 101 VAL MG2 4.430 . 4.430 3.619 3.471 3.724 . 0 0 "[ . 1 . 2]" 1
2273 2 101 VAL HA 2 101 VAL MG2 3.740 . 3.740 2.381 2.338 2.421 . 0 0 "[ . 1 . 2]" 1
2274 1 93 PHE QD 2 4 LEU MD1 3.820 . 3.820 3.425 2.817 3.744 . 0 0 "[ . 1 . 2]" 1
2275 2 64 PHE HD2 2 65 VAL MG2 3.770 . 3.770 3.405 2.821 3.774 0.004 11 0 "[ . 1 . 2]" 1
2276 2 64 PHE HA 2 64 PHE HD1 3.270 . 3.270 2.488 2.224 2.642 . 0 0 "[ . 1 . 2]" 1
2277 2 64 PHE HD2 2 65 VAL H 4.480 . 4.480 3.746 3.286 4.111 . 0 0 "[ . 1 . 2]" 1
2278 2 64 PHE HA 2 64 PHE HE1 4.800 . 4.800 4.694 4.557 4.805 0.005 12 0 "[ . 1 . 2]" 1
2279 2 64 PHE HB3 2 64 PHE HE2 4.640 . 4.640 4.622 4.609 4.638 . 0 0 "[ . 1 . 2]" 1
2280 2 54 TYR HA 2 54 TYR HD1 3.600 . 3.600 2.164 2.009 2.298 . 0 0 "[ . 1 . 2]" 1
2281 2 54 TYR H 2 54 TYR HD1 4.660 . 4.660 4.644 4.590 4.670 0.010 9 0 "[ . 1 . 2]" 1
2282 2 54 TYR HA 2 54 TYR HE1 4.720 . 4.720 4.611 4.470 4.734 0.014 3 0 "[ . 1 . 2]" 1
2283 2 50 PHE HE2 2 51 ALA HA 4.910 . 4.910 4.693 4.425 4.920 0.010 17 0 "[ . 1 . 2]" 1
2284 2 119 HIS HD2 2 136 LEU MD2 4.750 . 4.750 3.301 2.277 4.474 . 0 0 "[ . 1 . 2]" 1
2285 2 1 MET HA 2 2 ASN H 2.700 . 2.700 2.610 2.481 2.705 0.005 6 0 "[ . 1 . 2]" 1
2286 2 2 ASN H 2 2 ASN HB2 3.150 . 3.150 2.779 2.579 2.947 . 0 0 "[ . 1 . 2]" 1
2287 2 1 MET HG3 2 2 ASN H 3.660 . 3.660 3.044 2.785 3.216 . 0 0 "[ . 1 . 2]" 1
2288 2 1 MET HB2 2 2 ASN H 3.020 . 3.020 2.049 1.888 2.254 . 0 0 "[ . 1 . 2]" 1
2289 2 2 ASN H 2 2 ASN HB3 3.150 . 3.150 2.516 2.443 2.604 . 0 0 "[ . 1 . 2]" 1
2290 1 4 LEU H 2 85 ILE MD 4.900 . 4.900 3.705 3.617 3.835 . 0 0 "[ . 1 . 2]" 1
2291 2 4 LEU H 2 4 LEU HG 4.340 . 4.340 2.436 2.288 2.563 . 0 0 "[ . 1 . 2]" 1
2292 2 2 ASN H 2 3 ILE H 3.900 . 3.900 3.846 3.731 3.903 0.003 13 0 "[ . 1 . 2]" 1
2293 2 3 ILE H 2 4 LEU H 4.590 . 4.590 4.502 4.375 4.573 . 0 0 "[ . 1 . 2]" 1
2294 2 2 ASN HA 2 3 ILE H 2.690 . 2.690 2.328 2.228 2.432 . 0 0 "[ . 1 . 2]" 1
2295 2 1 MET HA 2 3 ILE H 5.240 . 5.240 5.032 4.717 5.252 0.012 14 0 "[ . 1 . 2]" 1
2296 2 3 ILE H 2 3 ILE HB 2.910 . 2.910 2.465 2.402 2.517 . 0 0 "[ . 1 . 2]" 1
2297 2 3 ILE H 2 3 ILE HG12 3.200 . 3.200 2.143 2.031 2.202 . 0 0 "[ . 1 . 2]" 1
2298 2 3 ILE H 2 3 ILE HG13 3.520 . 3.520 3.521 3.443 3.537 0.017 18 0 "[ . 1 . 2]" 1
2299 2 3 ILE H 2 3 ILE MD 3.480 . 3.480 3.408 3.334 3.482 0.002 5 0 "[ . 1 . 2]" 1
2300 2 4 LEU H 2 5 TYR H 3.910 . 3.910 2.376 2.238 2.524 . 0 0 "[ . 1 . 2]" 1
2301 1 5 TYR H 2 85 ILE H 4.050 . 4.050 2.860 2.791 3.008 . 0 0 "[ . 1 . 2]" 1
2302 2 5 TYR H 2 5 TYR HD1 4.800 . 4.800 4.624 4.493 4.754 . 0 0 "[ . 1 . 2]" 1
2303 2 3 ILE HA 2 5 TYR H 4.190 . 4.190 3.879 3.714 4.040 . 0 0 "[ . 1 . 2]" 1
2304 2 4 LEU HG 2 5 TYR H 4.430 . 4.430 4.206 4.134 4.254 . 0 0 "[ . 1 . 2]" 1
2305 1 5 TYR H 2 85 ILE MG 3.380 . 3.380 2.538 2.472 2.583 . 0 0 "[ . 1 . 2]" 1
2306 2 3 ILE MG 2 5 TYR H 3.330 . 3.330 2.436 2.257 2.711 . 0 0 "[ . 1 . 2]" 1
2307 1 5 TYR H 2 85 ILE MD 3.750 . 3.750 3.757 3.750 3.761 0.011 17 0 "[ . 1 . 2]" 1
2308 2 121 VAL H 2 121 VAL MG2 3.670 . 3.670 2.013 1.910 2.125 . 0 0 "[ . 1 . 2]" 1
2309 2 121 VAL H 2 122 CYS H 4.460 . 4.460 2.531 2.143 3.471 . 0 0 "[ . 1 . 2]" 1
2310 2 5 TYR HD1 2 6 LYS H 3.750 . 3.750 3.608 3.173 3.760 0.010 6 0 "[ . 1 . 2]" 1
2311 2 5 TYR H 2 6 LYS H 4.260 . 4.260 4.261 4.232 4.273 0.013 12 0 "[ . 1 . 2]" 1
2312 2 5 TYR HB2 2 6 LYS H 4.380 . 4.380 4.269 4.184 4.382 0.002 1 0 "[ . 1 . 2]" 1
2313 2 5 TYR HB3 2 6 LYS H 4.380 . 4.380 4.163 4.032 4.250 . 0 0 "[ . 1 . 2]" 1
2314 2 6 LYS H 2 6 LYS HB3 3.640 . 3.640 2.743 2.707 2.786 . 0 0 "[ . 1 . 2]" 1
2315 2 6 LYS H 2 6 LYS HB2 3.810 . 3.810 3.333 3.268 3.400 . 0 0 "[ . 1 . 2]" 1
2316 2 3 ILE MG 2 6 LYS H 3.720 . 3.720 3.466 3.296 3.607 . 0 0 "[ . 1 . 2]" 1
2317 1 7 THR H 2 83 VAL H 4.330 . 4.330 3.381 3.195 3.530 . 0 0 "[ . 1 . 2]" 1
2318 1 7 THR H 2 85 ILE H 5.500 . 5.500 5.461 5.137 5.516 0.016 7 0 "[ . 1 . 2]" 1
2319 2 7 THR H 2 8 ALA H 4.650 . 4.650 4.393 4.293 4.489 . 0 0 "[ . 1 . 2]" 1
2320 2 6 LYS H 2 7 THR H 4.440 . 4.440 4.315 4.233 4.399 . 0 0 "[ . 1 . 2]" 1
2321 2 5 TYR HD1 2 7 THR H 4.520 . 4.520 4.074 3.668 4.453 . 0 0 "[ . 1 . 2]" 1
2322 2 6 LYS HA 2 7 THR H 3.500 . 3.500 2.163 2.116 2.233 . 0 0 "[ . 1 . 2]" 1
2323 1 7 THR H 2 82 GLU HA 4.970 . 4.970 4.777 4.479 4.973 0.003 9 0 "[ . 1 . 2]" 1
2324 2 7 THR H 2 7 THR MG 3.250 . 3.250 2.243 2.059 2.436 . 0 0 "[ . 1 . 2]" 1
2325 2 8 ALA H 2 9 ALA H 4.560 . 4.560 4.454 4.376 4.523 . 0 0 "[ . 1 . 2]" 1
2326 1 8 ALA H 2 82 GLU HA 4.680 . 4.680 4.589 4.371 4.687 0.007 20 0 "[ . 1 . 2]" 1
2327 2 7 THR HA 2 8 ALA H 3.130 . 3.130 2.339 2.206 2.561 . 0 0 "[ . 1 . 2]" 1
2328 2 7 THR HB 2 8 ALA H 4.080 . 4.080 3.943 3.701 4.082 0.002 3 0 "[ . 1 . 2]" 1
2329 2 7 THR MG 2 8 ALA H 4.090 . 4.090 3.670 3.251 3.915 . 0 0 "[ . 1 . 2]" 1
2330 2 8 ALA H 2 8 ALA MB 3.120 . 3.120 2.458 2.378 2.606 . 0 0 "[ . 1 . 2]" 1
2331 1 9 ALA H 2 83 VAL H 5.210 . 5.210 4.522 4.190 4.934 . 0 0 "[ . 1 . 2]" 1
2332 1 9 ALA H 2 81 ALA H 4.290 . 4.290 3.428 3.137 3.677 . 0 0 "[ . 1 . 2]" 1
2333 1 9 ALA H 2 80 THR MG 3.270 . 3.270 3.157 2.741 3.276 0.006 9 0 "[ . 1 . 2]" 1
2334 2 128 THR H 2 131 ASN H 4.540 . 4.540 4.242 3.998 4.547 0.007 13 0 "[ . 1 . 2]" 1
2335 2 127 ALA HA 2 131 ASN H 4.010 . 4.010 2.902 2.199 3.412 . 0 0 "[ . 1 . 2]" 1
2336 2 130 ASN HB2 2 131 ASN H 4.000 . 4.000 2.871 2.381 3.578 . 0 0 "[ . 1 . 2]" 1
2337 2 130 ASN HB3 2 131 ASN H 4.000 . 4.000 3.803 3.412 4.073 0.073 16 0 "[ . 1 . 2]" 1
2338 2 127 ALA MB 2 131 ASN H 4.560 . 4.560 4.107 3.114 4.565 0.005 15 0 "[ . 1 . 2]" 1
2339 2 130 ASN H 2 131 ASN H 4.050 . 4.050 2.465 2.329 2.634 . 0 0 "[ . 1 . 2]" 1
2340 2 10 THR H 2 20 THR HA 5.500 . 5.500 4.984 4.655 5.166 . 0 0 "[ . 1 . 2]" 1
2341 1 10 THR H 2 80 THR HA 5.500 . 5.500 4.558 4.383 4.883 . 0 0 "[ . 1 . 2]" 1
2342 2 10 THR H 2 22 HIS HA 4.290 . 4.290 3.880 3.292 4.301 0.011 3 0 "[ . 1 . 2]" 1
2343 2 10 THR H 2 10 THR HB 3.580 . 3.580 2.792 2.479 3.302 . 0 0 "[ . 1 . 2]" 1
2344 2 10 THR H 2 20 THR HB 4.360 . 4.360 3.646 3.334 3.978 . 0 0 "[ . 1 . 2]" 1
2345 2 10 THR H 2 10 THR MG 3.810 . 3.810 2.842 1.927 3.830 0.020 7 0 "[ . 1 . 2]" 1
2346 2 8 ALA MB 2 10 THR H 5.340 . 5.340 4.874 4.519 5.344 0.004 15 0 "[ . 1 . 2]" 1
2347 2 72 THR H 2 73 LEU H 4.540 . 4.540 4.370 4.282 4.425 . 0 0 "[ . 1 . 2]" 1
2348 2 71 GLN H 2 72 THR H 4.490 . 4.490 4.466 4.425 4.490 . 0 0 "[ . 1 . 2]" 1
2349 2 71 GLN HA 2 72 THR H 2.740 . 2.740 2.425 2.340 2.484 . 0 0 "[ . 1 . 2]" 1
2350 2 72 THR H 2 72 THR HB 3.790 . 3.790 3.738 3.671 3.794 0.004 14 0 "[ . 1 . 2]" 1
2351 2 71 GLN HG3 2 72 THR H 3.970 . 3.970 3.961 3.818 3.980 0.010 19 0 "[ . 1 . 2]" 1
2352 2 71 GLN HB2 2 72 THR H 3.210 . 3.210 2.366 2.261 2.527 . 0 0 "[ . 1 . 2]" 1
2353 2 71 GLN HB3 2 72 THR H 4.000 . 4.000 3.653 3.548 3.799 . 0 0 "[ . 1 . 2]" 1
2354 2 66 ALA MB 2 72 THR H 4.570 . 4.570 4.217 4.063 4.481 . 0 0 "[ . 1 . 2]" 1
2355 2 11 SER H 2 12 THR H 4.820 . 4.820 4.226 4.075 4.362 . 0 0 "[ . 1 . 2]" 1
2356 2 10 THR HB 2 11 SER H 4.570 . 4.570 4.225 3.955 4.350 . 0 0 "[ . 1 . 2]" 1
2357 2 10 THR MG 2 11 SER H 4.300 . 4.300 3.490 2.796 4.213 . 0 0 "[ . 1 . 2]" 1
2358 2 12 THR H 2 13 GLY H 4.640 . 4.640 4.556 4.507 4.593 . 0 0 "[ . 1 . 2]" 1
2359 2 12 THR H 2 20 THR H 4.680 . 4.680 4.464 4.103 4.688 0.008 20 0 "[ . 1 . 2]" 1
2360 2 12 THR H 2 19 ALA HA 4.060 . 4.060 3.746 3.345 4.063 0.003 6 0 "[ . 1 . 2]" 1
2361 2 12 THR H 2 12 THR MG 3.800 . 3.800 3.809 3.760 3.825 0.025 13 0 "[ . 1 . 2]" 1
2362 2 10 THR MG 2 12 THR H 5.170 . 5.170 4.266 3.735 4.705 . 0 0 "[ . 1 . 2]" 1
2363 1 12 THR H 2 56 ALA MB 5.500 . 5.500 5.108 4.070 5.506 0.006 12 0 "[ . 1 . 2]" 1
2364 2 13 GLY H 2 14 GLY H 4.410 . 4.410 3.709 2.704 3.844 . 0 0 "[ . 1 . 2]" 1
2365 2 14 GLY H 2 18 ARG H 4.720 . 4.720 2.973 2.316 3.760 . 0 0 "[ . 1 . 2]" 1
2366 2 14 GLY H 2 17 GLY H 5.060 . 5.060 4.618 4.352 5.081 0.021 14 0 "[ . 1 . 2]" 1
2367 2 12 THR HB 2 14 GLY H 3.640 . 3.640 3.496 2.514 3.649 0.009 20 0 "[ . 1 . 2]" 1
2368 2 12 THR MG 2 14 GLY H 4.230 . 4.230 3.625 2.398 3.964 . 0 0 "[ . 1 . 2]" 1
2369 2 15 ARG H 2 16 ASP H 3.880 . 3.880 2.659 2.403 2.980 . 0 0 "[ . 1 . 2]" 1
2370 2 16 ASP H 2 17 GLY H 3.730 . 3.730 2.108 1.943 2.214 . 0 0 "[ . 1 . 2]" 1
2371 2 16 ASP H 2 16 ASP HB3 3.230 . 3.230 2.734 2.594 2.898 . 0 0 "[ . 1 . 2]" 1
2372 2 15 ARG H 2 17 GLY H 4.410 . 4.410 4.028 3.495 4.419 0.009 17 0 "[ . 1 . 2]" 1
2373 2 17 GLY H 2 30 LEU H 3.730 . 3.730 3.425 3.243 3.574 . 0 0 "[ . 1 . 2]" 1
2374 2 17 GLY H 2 31 SER HA 4.270 . 4.270 3.544 3.332 3.781 . 0 0 "[ . 1 . 2]" 1
2375 2 17 GLY H 2 29 LYS HB2 5.270 . 5.270 5.275 5.129 5.291 0.021 14 0 "[ . 1 . 2]" 1
2376 2 17 GLY H 2 30 LEU MD1 4.800 . 4.800 4.460 4.129 4.658 . 0 0 "[ . 1 . 2]" 1
2377 2 17 GLY H 2 30 LEU MD2 4.170 . 4.170 2.836 2.639 3.046 . 0 0 "[ . 1 . 2]" 1
2378 2 16 ASP HB2 2 17 GLY H 3.750 . 3.750 3.729 3.520 3.769 0.019 1 0 "[ . 1 . 2]" 1
2379 2 16 ASP HB3 2 17 GLY H 3.750 . 3.750 2.401 2.314 2.448 . 0 0 "[ . 1 . 2]" 1
2380 2 17 GLY H 2 18 ARG H 4.350 . 4.350 4.341 4.294 4.357 0.007 2 0 "[ . 1 . 2]" 1
2381 2 18 ARG H 2 19 ALA MB 4.830 . 4.830 4.596 4.267 4.832 0.002 20 0 "[ . 1 . 2]" 1
2382 2 18 ARG H 2 30 LEU MD1 4.470 . 4.470 3.859 3.319 4.419 . 0 0 "[ . 1 . 2]" 1
2383 2 18 ARG HA 2 19 ALA H 3.530 . 3.530 2.222 2.143 2.310 . 0 0 "[ . 1 . 2]" 1
2384 2 19 ALA H 2 29 LYS HA 3.920 . 3.920 2.783 2.342 3.033 . 0 0 "[ . 1 . 2]" 1
2385 2 19 ALA H 2 29 LYS HB2 4.870 . 4.870 4.434 3.821 4.837 . 0 0 "[ . 1 . 2]" 1
2386 2 19 ALA H 2 19 ALA MB 3.420 . 3.420 2.504 2.344 2.672 . 0 0 "[ . 1 . 2]" 1
2387 2 19 ALA H 2 28 VAL MG2 4.270 . 4.270 3.381 3.163 3.682 . 0 0 "[ . 1 . 2]" 1
2388 2 19 ALA HA 2 20 THR H 3.180 . 3.180 2.144 2.118 2.164 . 0 0 "[ . 1 . 2]" 1
2389 2 11 SER HA 2 20 THR H 3.990 . 3.990 2.900 2.624 3.283 . 0 0 "[ . 1 . 2]" 1
2390 2 10 THR H 2 20 THR H 4.050 . 4.050 3.553 2.957 3.852 . 0 0 "[ . 1 . 2]" 1
2391 2 19 ALA H 2 20 THR H 4.460 . 4.460 4.270 4.101 4.426 . 0 0 "[ . 1 . 2]" 1
2392 2 20 THR H 2 21 SER H 4.550 . 4.550 4.104 3.999 4.170 . 0 0 "[ . 1 . 2]" 1
2393 2 20 THR H 2 20 THR HB 3.460 . 3.460 2.765 2.708 2.835 . 0 0 "[ . 1 . 2]" 1
2394 2 20 THR H 2 20 THR MG 4.100 . 4.100 3.922 3.892 3.948 . 0 0 "[ . 1 . 2]" 1
2395 2 19 ALA MB 2 20 THR H 3.190 . 3.190 3.150 3.063 3.184 . 0 0 "[ . 1 . 2]" 1
2396 2 9 ALA MB 2 20 THR H 4.280 . 4.280 3.866 3.529 4.271 . 0 0 "[ . 1 . 2]" 1
2397 2 20 THR H 2 28 VAL MG2 5.500 . 5.500 5.314 5.064 5.514 0.014 7 0 "[ . 1 . 2]" 1
2398 2 20 THR HA 2 21 SER H 3.570 . 3.570 2.158 2.139 2.183 . 0 0 "[ . 1 . 2]" 1
2399 2 21 SER H 2 27 ASP HA 4.220 . 4.220 3.725 3.618 3.883 . 0 0 "[ . 1 . 2]" 1
2400 2 20 THR HB 2 21 SER H 4.380 . 4.380 4.331 4.309 4.373 . 0 0 "[ . 1 . 2]" 1
2401 2 9 ALA MB 2 21 SER H 4.790 . 4.790 4.045 3.818 4.311 . 0 0 "[ . 1 . 2]" 1
2402 2 21 SER H 2 26 LEU MD1 5.110 . 5.110 4.278 4.141 4.397 . 0 0 "[ . 1 . 2]" 1
2403 2 21 SER H 2 26 LEU MD2 4.750 . 4.750 3.188 3.035 3.322 . 0 0 "[ . 1 . 2]" 1
2404 2 21 SER H 2 28 VAL H 5.340 . 5.340 4.837 4.663 5.010 . 0 0 "[ . 1 . 2]" 1
2405 2 10 THR H 2 22 HIS H 4.780 . 4.780 2.939 2.418 3.386 . 0 0 "[ . 1 . 2]" 1
2406 2 9 ALA MB 2 22 HIS H 4.300 . 4.300 3.243 2.980 3.485 . 0 0 "[ . 1 . 2]" 1
2407 2 8 ALA MB 2 22 HIS H 4.720 . 4.720 3.959 3.691 4.433 . 0 0 "[ . 1 . 2]" 1
2408 2 22 HIS H 2 23 ASP H 4.490 . 4.490 2.761 2.630 2.880 . 0 0 "[ . 1 . 2]" 1
2409 2 23 ASP H 2 24 GLN H 3.600 . 3.600 2.738 2.503 2.895 . 0 0 "[ . 1 . 2]" 1
2410 2 23 ASP H 2 23 ASP HB2 4.030 . 4.030 2.735 2.337 3.651 . 0 0 "[ . 1 . 2]" 1
2411 2 23 ASP H 2 23 ASP HB3 4.030 . 4.030 3.321 2.597 3.626 . 0 0 "[ . 1 . 2]" 1
2412 2 20 THR MG 2 23 ASP H 5.380 . 5.380 5.148 4.911 5.268 . 0 0 "[ . 1 . 2]" 1
2413 2 9 ALA MB 2 23 ASP H 5.000 . 5.000 4.991 4.806 5.016 0.016 11 0 "[ . 1 . 2]" 1
2414 2 23 ASP HB2 2 24 GLN H 4.560 . 4.560 4.059 3.641 4.461 . 0 0 "[ . 1 . 2]" 1
2415 2 23 ASP HB3 2 24 GLN H 4.560 . 4.560 4.380 3.859 4.565 0.005 19 0 "[ . 1 . 2]" 1
2416 2 20 THR MG 2 24 GLN H 4.250 . 4.250 4.035 3.799 4.249 . 0 0 "[ . 1 . 2]" 1
2417 2 24 GLN H 2 25 LYS H 3.900 . 3.900 2.492 2.404 2.617 . 0 0 "[ . 1 . 2]" 1
2418 2 24 GLN HB2 2 25 LYS H 4.140 . 4.140 4.001 3.894 4.107 . 0 0 "[ . 1 . 2]" 1
2419 2 21 SER H 2 26 LEU H 4.310 . 4.310 2.829 2.678 2.925 . 0 0 "[ . 1 . 2]" 1
2420 2 26 LEU H 2 27 ASP H 4.520 . 4.520 4.345 4.312 4.382 . 0 0 "[ . 1 . 2]" 1
2421 2 20 THR HA 2 26 LEU H 4.430 . 4.430 4.433 4.359 4.448 0.018 10 0 "[ . 1 . 2]" 1
2422 2 24 GLN HA 2 26 LEU H 4.200 . 4.200 3.565 3.325 3.805 . 0 0 "[ . 1 . 2]" 1
2423 2 26 LEU H 2 26 LEU MD2 4.610 . 4.610 4.626 4.615 4.634 0.024 11 0 "[ . 1 . 2]" 1
2424 2 26 LEU H 2 26 LEU HG 4.450 . 4.450 4.441 4.395 4.458 0.008 17 0 "[ . 1 . 2]" 1
2425 2 25 LYS H 2 26 LEU H 3.700 . 3.700 2.360 2.249 2.476 . 0 0 "[ . 1 . 2]" 1
2426 2 21 SER H 2 27 ASP H 4.940 . 4.940 4.327 4.213 4.435 . 0 0 "[ . 1 . 2]" 1
2427 2 20 THR HA 2 27 ASP H 4.380 . 4.380 4.110 3.924 4.244 . 0 0 "[ . 1 . 2]" 1
2428 2 26 LEU HA 2 27 ASP H 3.170 . 3.170 2.204 2.112 2.262 . 0 0 "[ . 1 . 2]" 1
2429 2 27 ASP H 2 27 ASP HB2 3.950 . 3.950 3.662 3.331 3.959 0.009 3 0 "[ . 1 . 2]" 1
2430 2 27 ASP H 2 27 ASP HB3 3.950 . 3.950 3.122 2.849 3.456 . 0 0 "[ . 1 . 2]" 1
2431 2 26 LEU MD1 2 27 ASP H 3.210 . 3.210 1.896 1.796 2.121 0.004 19 0 "[ . 1 . 2]" 1
2432 2 26 LEU HG 2 27 ASP H 3.970 . 3.970 2.676 2.484 2.903 . 0 0 "[ . 1 . 2]" 1
2433 2 19 ALA H 2 28 VAL H 4.140 . 4.140 3.467 3.133 3.783 . 0 0 "[ . 1 . 2]" 1
2434 2 27 ASP H 2 28 VAL H 4.430 . 4.430 3.561 3.438 3.700 . 0 0 "[ . 1 . 2]" 1
2435 2 28 VAL H 2 29 LYS H 4.690 . 4.690 4.383 4.362 4.409 . 0 0 "[ . 1 . 2]" 1
2436 2 20 THR HA 2 28 VAL H 3.770 . 3.770 3.221 3.057 3.314 . 0 0 "[ . 1 . 2]" 1
2437 2 27 ASP HA 2 28 VAL H 3.460 . 3.460 2.207 2.152 2.267 . 0 0 "[ . 1 . 2]" 1
2438 2 27 ASP HB2 2 28 VAL H 4.660 . 4.660 4.283 3.875 4.564 . 0 0 "[ . 1 . 2]" 1
2439 2 27 ASP HB3 2 28 VAL H 4.660 . 4.660 4.511 4.405 4.600 . 0 0 "[ . 1 . 2]" 1
2440 2 19 ALA MB 2 28 VAL H 3.770 . 3.770 3.722 3.459 3.780 0.010 17 0 "[ . 1 . 2]" 1
2441 2 28 VAL H 2 28 VAL MG2 3.280 . 3.280 2.311 2.210 2.400 . 0 0 "[ . 1 . 2]" 1
2442 2 26 LEU MD1 2 28 VAL H 3.660 . 3.660 3.666 3.662 3.671 0.011 10 0 "[ . 1 . 2]" 1
2443 2 29 LYS H 2 30 LEU H 4.490 . 4.490 4.373 4.294 4.497 0.007 7 0 "[ . 1 . 2]" 1
2444 2 29 LYS H 2 29 LYS HB3 3.460 . 3.460 2.525 2.190 2.688 . 0 0 "[ . 1 . 2]" 1
2445 2 29 LYS H 2 29 LYS HB2 3.710 . 3.710 3.468 3.214 3.627 . 0 0 "[ . 1 . 2]" 1
2446 2 28 VAL MG2 2 29 LYS H 3.770 . 3.770 3.346 3.250 3.777 0.007 7 0 "[ . 1 . 2]" 1
2447 2 64 PHE H 2 64 PHE HD1 4.990 . 4.990 4.690 4.579 4.823 . 0 0 "[ . 1 . 2]" 1
2448 2 64 PHE H 2 64 PHE HD2 5.420 . 5.420 4.765 4.605 4.870 . 0 0 "[ . 1 . 2]" 1
2449 2 30 LEU H 2 44 THR H 4.950 . 4.950 4.363 4.074 4.755 . 0 0 "[ . 1 . 2]" 1
2450 2 30 LEU H 2 30 LEU MD2 4.230 . 4.230 2.183 1.988 2.336 . 0 0 "[ . 1 . 2]" 1
2451 2 30 LEU H 2 30 LEU HG 3.940 . 3.940 3.959 3.945 3.974 0.034 11 0 "[ . 1 . 2]" 1
2452 2 31 SER H 2 44 THR H 4.260 . 4.260 2.670 2.313 2.898 . 0 0 "[ . 1 . 2]" 1
2453 2 30 LEU HG 2 31 SER H 4.830 . 4.830 4.547 4.280 4.833 0.003 3 0 "[ . 1 . 2]" 1
2454 2 31 SER H 2 44 THR MG 5.010 . 5.010 4.619 3.685 5.025 0.015 5 0 "[ . 1 . 2]" 1
2455 2 30 LEU MD1 2 31 SER H 4.900 . 4.900 4.667 4.536 4.772 . 0 0 "[ . 1 . 2]" 1
2456 2 30 LEU MD2 2 31 SER H 4.180 . 4.180 3.399 3.135 3.683 . 0 0 "[ . 1 . 2]" 1
2457 2 32 ALA H 2 40 GLY H 5.500 . 5.500 4.897 3.824 5.503 0.003 7 0 "[ . 1 . 2]" 1
2458 2 32 ALA H 2 41 ALA MB 5.260 . 5.260 5.021 4.184 5.271 0.011 14 0 "[ . 1 . 2]" 1
2459 2 34 ARG H 2 34 ARG HG2 5.260 . 5.260 4.000 2.054 4.642 . 0 0 "[ . 1 . 2]" 1
2460 2 34 ARG H 2 34 ARG HG3 5.260 . 5.260 4.276 2.832 5.258 . 0 0 "[ . 1 . 2]" 1
2461 2 36 LEU H 2 37 GLY H 3.700 . 3.700 2.358 1.867 2.596 . 0 0 "[ . 1 . 2]" 1
2462 2 34 ARG HA 2 36 LEU H 4.170 . 4.170 3.800 3.276 4.200 0.030 13 0 "[ . 1 . 2]" 1
2463 2 36 LEU H 2 37 GLY HA3 5.250 . 5.250 4.927 4.593 5.079 . 0 0 "[ . 1 . 2]" 1
2464 2 36 LEU H 2 36 LEU HG 4.350 . 4.350 3.233 2.207 4.362 0.012 8 0 "[ . 1 . 2]" 1
2465 2 36 LEU H 2 36 LEU MD2 4.060 . 4.060 3.096 1.809 3.896 . 0 0 "[ . 1 . 2]" 1
2466 2 38 GLY H 2 39 ALA H 3.900 . 3.900 3.794 2.698 3.932 0.032 7 0 "[ . 1 . 2]" 1
2467 2 37 GLY H 2 38 GLY H 3.390 . 3.390 2.349 1.891 2.750 . 0 0 "[ . 1 . 2]" 1
2468 2 36 LEU H 2 38 GLY H 3.830 . 3.830 3.462 2.914 3.845 0.015 8 0 "[ . 1 . 2]" 1
2469 2 34 ARG HA 2 38 GLY H 3.060 . 3.060 1.936 1.785 2.199 0.015 8 0 "[ . 1 . 2]" 1
2470 2 34 ARG HB2 2 38 GLY H 4.970 . 4.970 4.544 3.929 4.982 0.012 12 0 "[ . 1 . 2]" 1
2471 2 115 VAL H 2 116 ASP H 3.300 . 3.300 2.586 2.521 2.667 . 0 0 "[ . 1 . 2]" 1
2472 2 34 ARG HA 2 39 ALA H 3.880 . 3.880 3.399 2.411 3.884 0.004 20 0 "[ . 1 . 2]" 1
2473 2 113 THR HA 2 116 ASP H 3.670 . 3.670 3.335 3.103 3.493 . 0 0 "[ . 1 . 2]" 1
2474 2 116 ASP H 2 116 ASP HB2 3.230 . 3.230 2.502 2.396 2.645 . 0 0 "[ . 1 . 2]" 1
2475 2 116 ASP H 2 116 ASP HB3 3.270 . 3.270 2.580 2.447 2.669 . 0 0 "[ . 1 . 2]" 1
2476 2 115 VAL HB 2 116 ASP H 3.850 . 3.850 2.734 2.573 2.834 . 0 0 "[ . 1 . 2]" 1
2477 2 116 ASP H 2 117 ARG HB3 5.470 . 5.470 5.411 5.296 5.472 0.002 6 0 "[ . 1 . 2]" 1
2478 2 114 LEU HB2 2 116 ASP H 5.500 . 5.500 4.836 4.743 4.954 . 0 0 "[ . 1 . 2]" 1
2479 2 115 VAL MG2 2 116 ASP H 4.170 . 4.170 3.866 3.719 3.957 . 0 0 "[ . 1 . 2]" 1
2480 2 115 VAL MG1 2 116 ASP H 3.710 . 3.710 3.537 3.327 3.646 . 0 0 "[ . 1 . 2]" 1
2481 2 34 ARG H 2 40 GLY H 4.620 . 4.620 3.378 2.553 4.640 0.020 7 0 "[ . 1 . 2]" 1
2482 2 39 ALA H 2 40 GLY H 3.640 . 3.640 2.035 1.790 2.285 0.010 18 0 "[ . 1 . 2]" 1
2483 2 38 GLY H 2 40 GLY H 5.500 . 5.500 4.685 4.065 5.287 . 0 0 "[ . 1 . 2]" 1
2484 2 34 ARG HA 2 40 GLY H 4.470 . 4.470 3.500 2.780 4.475 0.005 1 0 "[ . 1 . 2]" 1
2485 2 34 ARG HG2 2 40 GLY H 5.170 . 5.170 3.786 2.791 5.184 0.014 15 0 "[ . 1 . 2]" 1
2486 2 34 ARG HG3 2 40 GLY H 5.170 . 5.170 4.212 1.977 5.184 0.014 3 0 "[ . 1 . 2]" 1
2487 2 39 ALA MB 2 40 GLY H 3.190 . 3.190 2.791 2.329 3.229 0.039 9 0 "[ . 1 . 2]" 1
2488 2 40 GLY H 2 41 ALA H 3.270 . 3.270 2.967 2.204 3.284 0.014 16 0 "[ . 1 . 2]" 1
2489 2 41 ALA H 2 41 ALA MB 2.850 . 2.850 2.552 2.248 2.870 0.020 1 0 "[ . 1 . 2]" 1
2490 2 41 ALA H 2 42 GLU H 4.600 . 4.600 4.426 4.247 4.598 . 0 0 "[ . 1 . 2]" 1
2491 2 41 ALA HA 2 42 GLU H 3.050 . 3.050 2.527 2.262 2.707 . 0 0 "[ . 1 . 2]" 1
2492 2 41 ALA MB 2 42 GLU H 2.890 . 2.890 2.154 1.802 2.697 . 0 0 "[ . 1 . 2]" 1
2493 2 43 GLY H 2 44 THR H 4.730 . 4.730 4.302 3.627 4.539 . 0 0 "[ . 1 . 2]" 1
2494 2 42 GLU H 2 43 GLY H 4.420 . 4.420 3.215 2.267 3.960 . 0 0 "[ . 1 . 2]" 1
2495 2 42 GLU HA 2 43 GLY H 3.190 . 3.190 2.718 2.272 3.199 0.009 18 0 "[ . 1 . 2]" 1
2496 2 41 ALA MB 2 43 GLY H 4.000 . 4.000 3.213 2.439 4.017 0.017 17 0 "[ . 1 . 2]" 1
2497 2 44 THR H 2 44 THR HB 4.090 . 4.090 2.940 2.531 3.726 . 0 0 "[ . 1 . 2]" 1
2498 2 45 ASN H 2 48 GLN H 5.120 . 5.120 4.858 4.342 5.119 . 0 0 "[ . 1 . 2]" 1
2499 2 44 THR HB 2 45 ASN H 4.130 . 4.130 3.501 2.051 4.124 . 0 0 "[ . 1 . 2]" 1
2500 2 45 ASN H 2 48 GLN HB2 4.320 . 4.320 4.228 3.489 4.329 0.009 4 0 "[ . 1 . 2]" 1
2501 2 44 THR MG 2 45 ASN H 3.770 . 3.770 2.764 1.861 3.695 . 0 0 "[ . 1 . 2]" 1
2502 2 47 GLU H 2 48 GLN H 4.400 . 4.400 2.604 2.443 2.753 . 0 0 "[ . 1 . 2]" 1
2503 2 50 PHE HE2 2 51 ALA H 5.500 . 5.500 5.504 5.485 5.512 0.012 10 0 "[ . 1 . 2]" 1
2504 2 48 GLN HA 2 51 ALA H 4.200 . 4.200 3.486 3.242 3.803 . 0 0 "[ . 1 . 2]" 1
2505 2 50 PHE HB3 2 51 ALA H 4.780 . 4.780 2.619 2.490 2.719 . 0 0 "[ . 1 . 2]" 1
2506 2 51 ALA H 2 52 ALA H 3.930 . 3.930 2.870 2.787 2.936 . 0 0 "[ . 1 . 2]" 1
2507 2 52 ALA H 2 53 GLY H 3.940 . 3.940 2.736 2.601 2.843 . 0 0 "[ . 1 . 2]" 1
2508 2 48 GLN HA 2 52 ALA H 4.000 . 4.000 3.894 3.728 4.007 0.007 17 0 "[ . 1 . 2]" 1
2509 2 52 ALA H 2 52 ALA MB 3.190 . 3.190 2.236 2.229 2.240 . 0 0 "[ . 1 . 2]" 1
2510 1 52 ALA H 2 9 ALA MB 4.220 . 4.220 3.514 3.098 3.787 . 0 0 "[ . 1 . 2]" 1
2511 2 49 LEU MD1 2 52 ALA H 5.110 . 5.110 4.961 4.756 5.091 . 0 0 "[ . 1 . 2]" 1
2512 2 49 LEU MD2 2 53 GLY H 4.220 . 4.220 4.066 3.835 4.225 0.005 4 0 "[ . 1 . 2]" 1
2513 2 49 LEU MD1 2 53 GLY H 4.230 . 4.230 3.711 3.449 3.911 . 0 0 "[ . 1 . 2]" 1
2514 1 53 GLY H 2 49 LEU MD1 4.600 . 4.600 3.148 2.818 3.383 . 0 0 "[ . 1 . 2]" 1
2515 2 53 GLY H 2 54 TYR H 4.330 . 4.330 2.701 2.592 2.853 . 0 0 "[ . 1 . 2]" 1
2516 2 54 TYR H 2 55 SER H 4.350 . 4.350 2.646 2.491 2.866 . 0 0 "[ . 1 . 2]" 1
2517 2 54 TYR H 2 56 ALA H 4.490 . 4.490 4.186 3.989 4.431 . 0 0 "[ . 1 . 2]" 1
2518 2 54 TYR H 2 54 TYR HD2 5.440 . 5.440 4.814 4.710 4.894 . 0 0 "[ . 1 . 2]" 1
2519 2 51 ALA HA 2 54 TYR H 4.380 . 4.380 3.713 3.516 3.914 . 0 0 "[ . 1 . 2]" 1
2520 2 54 TYR H 2 54 TYR HB2 4.150 . 4.150 2.616 2.496 2.701 . 0 0 "[ . 1 . 2]" 1
2521 2 54 TYR H 2 54 TYR HB3 4.150 . 4.150 2.435 2.321 2.529 . 0 0 "[ . 1 . 2]" 1
2522 2 52 ALA MB 2 54 TYR H 4.660 . 4.660 4.485 4.367 4.666 0.006 1 0 "[ . 1 . 2]" 1
2523 2 51 ALA HA 2 55 SER H 4.200 . 4.200 3.947 3.696 4.115 . 0 0 "[ . 1 . 2]" 1
2524 2 54 TYR HB2 2 55 SER H 4.460 . 4.460 3.913 3.784 4.057 . 0 0 "[ . 1 . 2]" 1
2525 2 54 TYR HB3 2 55 SER H 4.460 . 4.460 2.598 2.410 2.833 . 0 0 "[ . 1 . 2]" 1
2526 2 51 ALA MB 2 55 SER H 4.810 . 4.810 4.564 4.442 4.643 . 0 0 "[ . 1 . 2]" 1
2527 2 52 ALA MB 2 55 SER H 5.160 . 5.160 4.750 4.545 4.902 . 0 0 "[ . 1 . 2]" 1
2528 2 55 SER H 2 81 ALA MB 4.030 . 4.030 3.529 3.076 3.986 . 0 0 "[ . 1 . 2]" 1
2529 2 55 SER H 2 79 VAL MG1 5.240 . 5.240 4.820 4.482 5.057 . 0 0 "[ . 1 . 2]" 1
2530 2 55 SER H 2 56 ALA H 4.120 . 4.120 2.716 2.621 2.812 . 0 0 "[ . 1 . 2]" 1
2531 1 56 ALA H 2 11 SER HB2 4.410 . 4.410 3.801 3.142 4.190 . 0 0 "[ . 1 . 2]" 1
2532 1 56 ALA H 2 11 SER HB3 4.410 . 4.410 3.645 3.154 4.412 0.002 9 0 "[ . 1 . 2]" 1
2533 2 56 ALA H 2 56 ALA MB 3.150 . 3.150 2.236 2.224 2.249 . 0 0 "[ . 1 . 2]" 1
2534 2 56 ALA H 2 81 ALA MB 5.290 . 5.290 4.986 4.652 5.293 0.003 4 0 "[ . 1 . 2]" 1
2535 2 61 ALA H 2 62 MET H 4.010 . 4.010 2.705 2.589 2.818 . 0 0 "[ . 1 . 2]" 1
2536 2 61 ALA MB 2 62 MET H 4.050 . 4.050 2.432 2.302 2.590 . 0 0 "[ . 1 . 2]" 1
2537 2 65 VAL H 2 65 VAL HB 3.880 . 3.880 2.444 2.312 2.511 . 0 0 "[ . 1 . 2]" 1
2538 2 62 MET ME 2 65 VAL H 5.400 . 5.400 4.622 3.808 5.406 0.006 1 0 "[ . 1 . 2]" 1
2539 2 65 VAL H 2 65 VAL MG1 3.850 . 3.850 3.759 3.695 3.783 . 0 0 "[ . 1 . 2]" 1
2540 2 65 VAL H 2 66 ALA H 3.850 . 3.850 2.796 2.700 2.896 . 0 0 "[ . 1 . 2]" 1
2541 2 66 ALA H 2 67 GLY H 3.800 . 3.800 2.655 2.535 2.727 . 0 0 "[ . 1 . 2]" 1
2542 2 64 PHE HA 2 66 ALA H 4.910 . 4.910 4.511 4.308 4.673 . 0 0 "[ . 1 . 2]" 1
2543 2 62 MET HA 2 66 ALA H 4.180 . 4.180 3.772 3.284 4.114 . 0 0 "[ . 1 . 2]" 1
2544 2 65 VAL HB 2 66 ALA H 3.620 . 3.620 2.538 2.406 2.668 . 0 0 "[ . 1 . 2]" 1
2545 2 62 MET ME 2 66 ALA H 4.260 . 4.260 3.667 2.897 4.262 0.002 16 0 "[ . 1 . 2]" 1
2546 2 65 VAL MG1 2 66 ALA H 3.240 . 3.240 3.090 2.596 3.242 0.002 8 0 "[ . 1 . 2]" 1
2547 2 64 PHE HA 2 67 GLY H 4.210 . 4.210 3.389 3.036 3.639 . 0 0 "[ . 1 . 2]" 1
2548 2 67 GLY H 2 68 GLN HG2 4.040 . 4.040 3.906 3.713 4.042 0.002 7 0 "[ . 1 . 2]" 1
2549 2 67 GLY H 2 68 GLN HG3 4.910 . 4.910 4.915 4.911 4.919 0.009 16 0 "[ . 1 . 2]" 1
2550 2 65 VAL MG2 2 67 GLY H 5.400 . 5.400 5.201 5.136 5.272 . 0 0 "[ . 1 . 2]" 1
2551 2 65 VAL MG1 2 67 GLY H 4.580 . 4.580 4.576 4.351 4.595 0.015 19 0 "[ . 1 . 2]" 1
2552 2 67 GLY H 2 68 GLN H 3.560 . 3.560 2.556 2.514 2.604 . 0 0 "[ . 1 . 2]" 1
2553 2 66 ALA H 2 68 GLN H 4.600 . 4.600 4.235 4.109 4.362 . 0 0 "[ . 1 . 2]" 1
2554 2 68 GLN H 2 70 LYS H 4.150 . 4.150 3.665 3.531 3.818 . 0 0 "[ . 1 . 2]" 1
2555 2 68 GLN H 2 69 ASN H 3.330 . 3.330 2.073 2.027 2.145 . 0 0 "[ . 1 . 2]" 1
2556 2 68 GLN H 2 68 GLN HE21 4.930 . 4.930 4.698 3.867 4.937 0.007 3 0 "[ . 1 . 2]" 1
2557 2 68 GLN H 2 68 GLN HA 2.940 . 2.940 2.937 2.927 2.943 0.003 15 0 "[ . 1 . 2]" 1
2558 2 65 VAL HA 2 68 GLN H 3.860 . 3.860 3.403 3.273 3.518 . 0 0 "[ . 1 . 2]" 1
2559 2 68 GLN H 2 69 ASN HB2 4.210 . 4.210 3.999 3.975 4.026 . 0 0 "[ . 1 . 2]" 1
2560 2 68 GLN H 2 69 ASN HB3 5.500 . 5.500 5.514 5.506 5.521 0.021 9 0 "[ . 1 . 2]" 1
2561 2 68 GLN H 2 68 GLN HG2 2.880 . 2.880 2.077 1.941 2.242 . 0 0 "[ . 1 . 2]" 1
2562 2 68 GLN H 2 68 GLN HG3 2.940 . 2.940 2.772 2.723 2.829 . 0 0 "[ . 1 . 2]" 1
2563 2 66 ALA MB 2 68 GLN H 4.630 . 4.630 4.526 4.463 4.631 0.001 8 0 "[ . 1 . 2]" 1
2564 2 65 VAL MG2 2 68 GLN H 5.330 . 5.330 5.170 5.081 5.267 . 0 0 "[ . 1 . 2]" 1
2565 2 65 VAL MG1 2 68 GLN H 4.400 . 4.400 4.340 4.146 4.422 0.022 15 0 "[ . 1 . 2]" 1
2566 2 67 GLY H 2 69 ASN H 4.310 . 4.310 3.695 3.583 3.854 . 0 0 "[ . 1 . 2]" 1
2567 2 69 ASN H 2 71 GLN H 3.820 . 3.820 3.685 3.598 3.821 0.001 10 0 "[ . 1 . 2]" 1
2568 2 68 GLN HA 2 69 ASN H 3.450 . 3.450 3.370 3.324 3.414 . 0 0 "[ . 1 . 2]" 1
2569 2 66 ALA HA 2 69 ASN H 4.080 . 4.080 3.306 3.204 3.412 . 0 0 "[ . 1 . 2]" 1
2570 2 69 ASN H 2 69 ASN HB3 3.620 . 3.620 3.541 3.480 3.583 . 0 0 "[ . 1 . 2]" 1
2571 2 68 GLN HG2 2 69 ASN H 3.610 . 3.610 3.320 3.195 3.439 . 0 0 "[ . 1 . 2]" 1
2572 2 68 GLN HG3 2 69 ASN H 3.260 . 3.260 2.781 2.519 2.947 . 0 0 "[ . 1 . 2]" 1
2573 2 69 ASN H 2 70 LYS HD3 4.240 . 4.240 4.058 3.495 4.245 0.005 13 0 "[ . 1 . 2]" 1
2574 2 65 VAL MG1 2 69 ASN H 4.530 . 4.530 3.964 3.823 4.086 . 0 0 "[ . 1 . 2]" 1
2575 2 69 ASN H 2 71 GLN HG3 4.660 . 4.660 4.392 4.265 4.611 . 0 0 "[ . 1 . 2]" 1
2576 2 65 VAL MG2 2 68 GLN HE22 5.180 . 5.180 4.546 3.852 5.181 0.001 16 0 "[ . 1 . 2]" 1
2577 2 69 ASN HB2 2 69 ASN HD22 3.930 . 3.930 3.651 3.485 3.794 . 0 0 "[ . 1 . 2]" 1
2578 2 68 GLN HG2 2 69 ASN HD22 4.940 . 4.940 4.354 4.112 4.904 . 0 0 "[ . 1 . 2]" 1
2579 2 68 GLN HG3 2 69 ASN HD22 4.120 . 4.120 2.899 2.681 3.322 . 0 0 "[ . 1 . 2]" 1
2580 2 65 VAL MG1 2 69 ASN HD22 3.740 . 3.740 2.420 2.087 2.847 . 0 0 "[ . 1 . 2]" 1
2581 2 69 ASN H 2 69 ASN HD21 2.800 . 2.800 2.638 2.441 2.805 0.005 11 0 "[ . 1 . 2]" 1
2582 2 69 ASN HA 2 69 ASN HD21 4.270 . 4.270 2.897 2.268 3.665 . 0 0 "[ . 1 . 2]" 1
2583 2 66 ALA HA 2 69 ASN HD21 4.870 . 4.870 4.304 3.782 4.810 . 0 0 "[ . 1 . 2]" 1
2584 2 68 GLN HG2 2 69 ASN HD21 4.350 . 4.350 3.339 3.011 3.833 . 0 0 "[ . 1 . 2]" 1
2585 2 68 GLN HG3 2 69 ASN HD21 4.140 . 4.140 1.954 1.790 2.265 0.010 10 0 "[ . 1 . 2]" 1
2586 2 65 VAL MG1 2 69 ASN HD21 3.760 . 3.760 2.671 2.025 3.417 . 0 0 "[ . 1 . 2]" 1
2587 2 69 ASN H 2 70 LYS H 3.320 . 3.320 2.318 2.207 2.394 . 0 0 "[ . 1 . 2]" 1
2588 2 69 ASN HA 2 70 LYS H 3.400 . 3.400 3.270 3.219 3.331 . 0 0 "[ . 1 . 2]" 1
2589 2 70 LYS H 2 70 LYS HA 2.840 . 2.840 2.254 2.238 2.267 . 0 0 "[ . 1 . 2]" 1
2590 2 69 ASN HB3 2 70 LYS H 4.110 . 4.110 4.076 4.014 4.118 0.008 2 0 "[ . 1 . 2]" 1
2591 2 69 ASN HB2 2 70 LYS H 4.040 . 4.040 3.575 3.409 3.703 . 0 0 "[ . 1 . 2]" 1
2592 2 112 LYS H 2 113 THR H 3.520 . 3.520 2.851 2.693 2.888 . 0 0 "[ . 1 . 2]" 1
2593 2 113 THR H 2 115 VAL H 4.540 . 4.540 4.199 4.024 4.319 . 0 0 "[ . 1 . 2]" 1
2594 2 113 THR H 2 116 ASP H 5.020 . 5.020 4.606 4.504 4.797 . 0 0 "[ . 1 . 2]" 1
2595 2 111 ALA H 2 113 THR H 4.670 . 4.670 4.406 4.210 4.574 . 0 0 "[ . 1 . 2]" 1
2596 2 113 THR H 2 113 THR HB 3.010 . 3.010 2.419 2.128 2.495 . 0 0 "[ . 1 . 2]" 1
2597 2 112 LYS HB2 2 113 THR H 3.220 . 3.220 2.637 2.477 2.869 . 0 0 "[ . 1 . 2]" 1
2598 2 113 THR H 2 113 THR MG 3.160 . 3.160 2.538 2.404 3.081 . 0 0 "[ . 1 . 2]" 1
2599 2 113 THR H 2 114 LEU HG 4.210 . 4.210 4.103 3.980 4.215 0.005 9 0 "[ . 1 . 2]" 1
2600 2 113 THR H 2 114 LEU HB2 5.500 . 5.500 4.717 4.628 4.835 . 0 0 "[ . 1 . 2]" 1
2601 2 70 LYS H 2 71 GLN H 3.270 . 3.270 2.618 2.520 2.686 . 0 0 "[ . 1 . 2]" 1
2602 2 68 GLN H 2 71 GLN H 5.450 . 5.450 5.102 4.940 5.254 . 0 0 "[ . 1 . 2]" 1
2603 2 69 ASN HA 2 71 GLN H 4.940 . 4.940 4.600 4.401 4.774 . 0 0 "[ . 1 . 2]" 1
2604 2 66 ALA HA 2 71 GLN H 3.820 . 3.820 3.329 3.029 3.547 . 0 0 "[ . 1 . 2]" 1
2605 2 70 LYS HA 2 71 GLN H 2.950 . 2.950 2.906 2.743 2.959 0.009 1 0 "[ . 1 . 2]" 1
2606 2 69 ASN HB3 2 71 GLN H 3.900 . 3.900 3.720 3.479 3.903 0.003 6 0 "[ . 1 . 2]" 1
2607 2 69 ASN HB2 2 71 GLN H 3.960 . 3.960 3.445 3.209 3.661 . 0 0 "[ . 1 . 2]" 1
2608 2 71 GLN H 2 71 GLN HG3 3.320 . 3.320 2.367 2.224 2.596 . 0 0 "[ . 1 . 2]" 1
2609 2 71 GLN H 2 71 GLN HB3 3.440 . 3.440 3.207 3.024 3.362 . 0 0 "[ . 1 . 2]" 1
2610 2 66 ALA MB 2 71 GLN H 3.710 . 3.710 3.515 3.314 3.680 . 0 0 "[ . 1 . 2]" 1
2611 2 71 GLN H 2 72 THR MG 4.970 . 4.970 4.728 4.568 4.978 0.008 18 0 "[ . 1 . 2]" 1
2612 2 71 GLN HA 2 71 GLN HE21 5.500 . 5.500 5.047 4.854 5.527 0.027 8 0 "[ . 1 . 2]" 1
2613 2 69 ASN HB3 2 71 GLN HE21 5.360 . 5.360 4.983 4.035 5.309 . 0 0 "[ . 1 . 2]" 1
2614 2 69 ASN HB2 2 71 GLN HE21 4.630 . 4.630 4.414 3.454 4.641 0.011 18 0 "[ . 1 . 2]" 1
2615 2 71 GLN HE21 2 71 GLN HG3 3.190 . 3.190 2.154 2.101 2.170 . 0 0 "[ . 1 . 2]" 1
2616 2 62 MET ME 2 71 GLN HE21 4.070 . 4.070 3.813 3.157 4.082 0.012 14 0 "[ . 1 . 2]" 1
2617 2 71 GLN HE21 2 73 LEU HB2 5.500 . 5.500 4.969 4.578 5.504 0.004 19 0 "[ . 1 . 2]" 1
2618 2 71 GLN HE21 2 73 LEU HB3 5.500 . 5.500 4.813 3.566 5.470 . 0 0 "[ . 1 . 2]" 1
2619 2 65 VAL MG1 2 71 GLN HE21 4.770 . 4.770 4.561 2.375 4.781 0.011 7 0 "[ . 1 . 2]" 1
2620 2 71 GLN HE21 2 73 LEU HG 3.890 . 3.890 2.567 2.152 3.373 . 0 0 "[ . 1 . 2]" 1
2621 2 71 GLN HE22 2 71 GLN HG3 3.510 . 3.510 3.449 3.418 3.461 . 0 0 "[ . 1 . 2]" 1
2622 2 62 MET ME 2 71 GLN HE22 4.370 . 4.370 3.192 2.143 4.384 0.014 15 0 "[ . 1 . 2]" 1
2623 2 71 GLN HB2 2 71 GLN HE22 4.980 . 4.980 3.847 3.736 4.258 . 0 0 "[ . 1 . 2]" 1
2624 2 71 GLN HE22 2 73 LEU HB2 5.500 . 5.500 5.422 4.967 5.515 0.015 20 0 "[ . 1 . 2]" 1
2625 2 71 GLN HE22 2 73 LEU HB3 5.500 . 5.500 4.835 3.344 5.501 0.001 12 0 "[ . 1 . 2]" 1
2626 2 65 VAL MG1 2 71 GLN HE22 4.880 . 4.880 4.524 2.772 4.883 0.003 8 0 "[ . 1 . 2]" 1
2627 2 71 GLN HE22 2 73 LEU HG 3.890 . 3.890 3.371 2.713 3.895 0.005 18 0 "[ . 1 . 2]" 1
2628 2 72 THR HA 2 73 LEU H 3.070 . 3.070 2.177 2.125 2.231 . 0 0 "[ . 1 . 2]" 1
2629 2 72 THR MG 2 73 LEU H 3.750 . 3.750 3.719 3.523 3.763 0.013 11 0 "[ . 1 . 2]" 1
2630 2 66 ALA MB 2 73 LEU H 4.190 . 4.190 3.377 2.808 3.727 . 0 0 "[ . 1 . 2]" 1
2631 2 73 LEU H 2 73 LEU HG 3.690 . 3.690 2.608 2.063 2.924 . 0 0 "[ . 1 . 2]" 1
2632 2 75 ALA HA 2 76 ASP H 3.420 . 3.420 3.363 3.279 3.436 0.016 12 0 "[ . 1 . 2]" 1
2633 2 76 ASP H 2 77 THR HB 4.630 . 4.630 4.519 4.311 4.640 0.010 3 0 "[ . 1 . 2]" 1
2634 2 76 ASP H 2 76 ASP HB2 3.720 . 3.720 2.524 2.317 2.763 . 0 0 "[ . 1 . 2]" 1
2635 2 76 ASP H 2 76 ASP HB3 3.720 . 3.720 2.933 2.422 3.581 . 0 0 "[ . 1 . 2]" 1
2636 2 74 PRO HB2 2 76 ASP H 3.630 . 3.630 2.952 2.333 3.635 0.005 15 0 "[ . 1 . 2]" 1
2637 2 75 ALA MB 2 76 ASP H 3.370 . 3.370 3.038 2.794 3.305 . 0 0 "[ . 1 . 2]" 1
2638 2 76 ASP H 2 77 THR MG 4.360 . 4.360 3.870 3.658 4.015 . 0 0 "[ . 1 . 2]" 1
2639 2 76 ASP H 2 77 THR H 3.660 . 3.660 2.722 2.471 2.962 . 0 0 "[ . 1 . 2]" 1
2640 2 77 THR H 2 78 THR H 4.610 . 4.610 4.576 4.510 4.613 0.003 5 0 "[ . 1 . 2]" 1
2641 2 76 ASP HA 2 77 THR H 3.190 . 3.190 3.107 2.974 3.201 0.011 20 0 "[ . 1 . 2]" 1
2642 2 75 ALA HA 2 77 THR H 4.050 . 4.050 3.423 3.225 3.575 . 0 0 "[ . 1 . 2]" 1
2643 2 77 THR H 2 77 THR HB 3.110 . 3.110 2.746 2.598 2.964 . 0 0 "[ . 1 . 2]" 1
2644 2 77 THR H 2 104 PRO HD2 4.190 . 4.190 4.100 3.814 4.198 0.008 2 0 "[ . 1 . 2]" 1
2645 2 76 ASP HB3 2 77 THR H 4.740 . 4.740 4.009 3.630 4.446 . 0 0 "[ . 1 . 2]" 1
2646 2 16 ASP H 2 16 ASP HB2 3.230 . 3.230 3.026 2.839 3.133 . 0 0 "[ . 1 . 2]" 1
2647 2 74 PRO HB2 2 77 THR H 4.050 . 4.050 3.660 3.163 4.054 0.004 2 0 "[ . 1 . 2]" 1
2648 2 77 THR H 2 104 PRO HG3 4.540 . 4.540 3.836 3.395 4.120 . 0 0 "[ . 1 . 2]" 1
2649 2 75 ALA MB 2 77 THR H 4.560 . 4.560 4.234 4.156 4.358 . 0 0 "[ . 1 . 2]" 1
2650 2 77 THR H 2 77 THR MG 3.290 . 3.290 1.910 1.798 2.033 0.002 15 0 "[ . 1 . 2]" 1
2651 2 78 THR H 2 102 ALA H 4.220 . 4.220 3.690 3.498 3.904 . 0 0 "[ . 1 . 2]" 1
2652 2 77 THR HA 2 78 THR H 3.380 . 3.380 2.385 2.237 2.513 . 0 0 "[ . 1 . 2]" 1
2653 2 77 THR HB 2 78 THR H 4.280 . 4.280 3.745 3.582 4.030 . 0 0 "[ . 1 . 2]" 1
2654 2 78 THR H 2 104 PRO HD2 4.820 . 4.820 4.649 4.293 4.822 0.002 15 0 "[ . 1 . 2]" 1
2655 2 78 THR H 2 104 PRO HD3 4.640 . 4.640 3.732 3.486 3.866 . 0 0 "[ . 1 . 2]" 1
2656 2 78 THR H 2 102 ALA MB 3.450 . 3.450 2.918 2.719 3.167 . 0 0 "[ . 1 . 2]" 1
2657 2 77 THR MG 2 78 THR H 3.740 . 3.740 3.493 3.229 3.744 0.004 1 0 "[ . 1 . 2]" 1
2658 2 78 THR H 2 78 THR MG 4.010 . 4.010 3.741 2.393 4.016 0.006 7 0 "[ . 1 . 2]" 1
2659 2 78 THR HB 2 79 VAL H 3.780 . 3.780 3.446 2.680 3.799 0.019 19 0 "[ . 1 . 2]" 1
2660 2 80 THR H 2 80 THR HB 4.190 . 4.190 2.697 2.613 2.859 . 0 0 "[ . 1 . 2]" 1
2661 2 80 THR H 2 100 ARG HB2 4.750 . 4.750 3.554 2.503 4.597 . 0 0 "[ . 1 . 2]" 1
2662 2 79 VAL MG2 2 80 THR H 3.970 . 3.970 3.975 3.791 3.997 0.027 13 0 "[ . 1 . 2]" 1
2663 2 80 THR H 2 80 THR MG 3.980 . 3.980 3.876 3.840 3.955 . 0 0 "[ . 1 . 2]" 1
2664 1 81 ALA H 2 11 SER H 4.470 . 4.470 4.005 3.577 4.473 0.003 6 0 "[ . 1 . 2]" 1
2665 1 81 ALA H 2 8 ALA MB 5.150 . 5.150 5.077 4.809 5.155 0.005 1 0 "[ . 1 . 2]" 1
2666 2 80 THR MG 2 81 ALA H 3.370 . 3.370 3.063 2.822 3.154 . 0 0 "[ . 1 . 2]" 1
2667 2 81 ALA H 2 82 GLU H 4.600 . 4.600 4.269 4.215 4.375 . 0 0 "[ . 1 . 2]" 1
2668 2 82 GLU H 2 98 GLU H 4.580 . 4.580 3.530 3.128 3.970 . 0 0 "[ . 1 . 2]" 1
2669 2 82 GLU H 2 100 ARG H 4.660 . 4.660 3.976 3.510 4.483 . 0 0 "[ . 1 . 2]" 1
2670 2 82 GLU H 2 99 LEU HA 4.450 . 4.450 3.476 3.061 3.772 . 0 0 "[ . 1 . 2]" 1
2671 2 82 GLU H 2 82 GLU HB3 3.790 . 3.790 2.602 2.467 2.715 . 0 0 "[ . 1 . 2]" 1
2672 2 82 GLU H 2 82 GLU HB2 4.040 . 4.040 2.842 2.703 3.021 . 0 0 "[ . 1 . 2]" 1
2673 2 81 ALA MB 2 82 GLU H 3.510 . 3.510 3.392 3.264 3.456 . 0 0 "[ . 1 . 2]" 1
2674 1 83 VAL H 2 8 ALA HA 4.070 . 4.070 3.088 2.862 3.393 . 0 0 "[ . 1 . 2]" 1
2675 2 82 GLU HG2 2 83 VAL H 4.080 . 4.080 3.581 2.674 3.844 . 0 0 "[ . 1 . 2]" 1
2676 2 82 GLU HG3 2 83 VAL H 4.080 . 4.080 3.555 2.956 3.808 . 0 0 "[ . 1 . 2]" 1
2677 2 82 GLU HB2 2 83 VAL H 4.470 . 4.470 4.430 4.118 4.476 0.006 3 0 "[ . 1 . 2]" 1
2678 1 83 VAL H 2 6 LYS HG3 4.360 . 4.360 3.701 3.400 3.978 . 0 0 "[ . 1 . 2]" 1
2679 1 85 ILE H 2 5 TYR HD1 4.630 . 4.630 4.305 4.005 4.629 . 0 0 "[ . 1 . 2]" 1
2680 1 85 ILE H 2 6 LYS HA 4.360 . 4.360 3.539 3.441 3.625 . 0 0 "[ . 1 . 2]" 1
2681 1 85 ILE H 2 6 LYS HB3 5.360 . 5.360 5.257 5.045 5.366 0.006 8 0 "[ . 1 . 2]" 1
2682 2 85 ILE H 2 85 ILE MD 4.700 . 4.700 4.074 4.033 4.108 . 0 0 "[ . 1 . 2]" 1
2683 2 86 GLY H 2 93 PHE QD 5.250 . 5.250 4.597 4.381 4.813 . 0 0 "[ . 1 . 2]" 1
2684 2 85 ILE MG 2 86 GLY H 4.280 . 4.280 3.989 3.908 4.032 . 0 0 "[ . 1 . 2]" 1
2685 2 85 ILE HG13 2 86 GLY H 4.280 . 4.280 4.234 4.106 4.283 0.003 16 0 "[ . 1 . 2]" 1
2686 2 88 ASN H 2 94 ALA H 4.660 . 4.660 3.915 3.433 4.583 . 0 0 "[ . 1 . 2]" 1
2687 2 88 ASN H 2 89 GLU H 4.740 . 4.740 4.562 4.454 4.634 . 0 0 "[ . 1 . 2]" 1
2688 2 88 ASN H 2 93 PHE QD 4.880 . 4.880 4.265 3.650 4.883 0.003 9 0 "[ . 1 . 2]" 1
2689 2 88 ASN H 2 93 PHE HA 3.750 . 3.750 2.780 2.214 3.522 . 0 0 "[ . 1 . 2]" 1
2690 2 87 PRO HA 2 88 ASN H 3.390 . 3.390 2.149 2.101 2.274 . 0 0 "[ . 1 . 2]" 1
2691 2 87 PRO HB3 2 88 ASN H 3.880 . 3.880 3.834 3.581 3.892 0.012 14 0 "[ . 1 . 2]" 1
2692 2 88 ASN H 2 94 ALA MB 4.070 . 4.070 3.581 3.242 4.026 . 0 0 "[ . 1 . 2]" 1
2693 2 88 ASN HB2 2 89 GLU H 4.800 . 4.800 3.879 2.335 4.269 . 0 0 "[ . 1 . 2]" 1
2694 2 89 GLU H 2 89 GLU HB2 3.840 . 3.840 3.590 3.572 3.615 . 0 0 "[ . 1 . 2]" 1
2695 2 89 GLU H 2 90 GLU H 3.690 . 3.690 2.625 2.572 2.686 . 0 0 "[ . 1 . 2]" 1
2696 2 90 GLU H 2 91 GLY H 3.000 . 3.000 2.533 2.425 2.594 . 0 0 "[ . 1 . 2]" 1
2697 2 88 ASN HA 2 90 GLU H 4.110 . 4.110 3.862 3.674 4.118 0.008 16 0 "[ . 1 . 2]" 1
2698 2 89 GLU HA 2 90 GLU H 3.460 . 3.460 3.402 3.366 3.459 . 0 0 "[ . 1 . 2]" 1
2699 2 88 ASN HB2 2 90 GLU H 4.310 . 4.310 4.052 2.686 4.319 0.009 14 0 "[ . 1 . 2]" 1
2700 2 88 ASN HB3 2 90 GLU H 4.310 . 4.310 3.303 2.928 4.237 . 0 0 "[ . 1 . 2]" 1
2701 2 90 GLU H 2 90 GLU HB3 2.850 . 2.850 2.348 2.273 2.410 . 0 0 "[ . 1 . 2]" 1
2702 2 89 GLU HG2 2 90 GLU H 3.590 . 3.590 3.040 2.654 3.342 . 0 0 "[ . 1 . 2]" 1
2703 2 90 GLU H 2 90 GLU HB2 3.110 . 3.110 2.685 2.634 2.751 . 0 0 "[ . 1 . 2]" 1
2704 2 88 ASN H 2 92 GLY H 3.510 . 3.510 3.212 2.846 3.516 0.006 20 0 "[ . 1 . 2]" 1
2705 2 90 GLU HA 2 91 GLY H 3.550 . 3.550 3.422 3.389 3.452 . 0 0 "[ . 1 . 2]" 1
2706 2 90 GLU HG2 2 91 GLY H 3.940 . 3.940 3.950 3.938 3.959 0.019 10 0 "[ . 1 . 2]" 1
2707 2 93 PHE H 2 93 PHE QD 3.830 . 3.830 3.470 3.235 3.799 . 0 0 "[ . 1 . 2]" 1
2708 2 92 GLY H 2 93 PHE H 4.370 . 4.370 4.183 3.768 4.376 0.006 14 0 "[ . 1 . 2]" 1
2709 2 86 GLY H 2 94 ALA H 4.160 . 4.160 2.845 2.691 3.015 . 0 0 "[ . 1 . 2]" 1
2710 2 93 PHE H 2 94 ALA H 5.420 . 5.420 4.504 4.422 4.554 . 0 0 "[ . 1 . 2]" 1
2711 2 93 PHE QD 2 94 ALA H 4.150 . 4.150 3.480 3.313 3.689 . 0 0 "[ . 1 . 2]" 1
2712 2 87 PRO HA 2 94 ALA H 4.110 . 4.110 3.747 3.397 3.967 . 0 0 "[ . 1 . 2]" 1
2713 2 85 ILE MG 2 94 ALA H 5.500 . 5.500 5.506 5.499 5.513 0.013 9 0 "[ . 1 . 2]" 1
2714 2 95 LEU H 2 95 LEU MD1 4.440 . 4.440 4.112 4.070 4.161 . 0 0 "[ . 1 . 2]" 1
2715 2 86 GLY H 2 95 LEU H 5.390 . 5.390 5.092 4.985 5.121 . 0 0 "[ . 1 . 2]" 1
2716 2 84 GLY H 2 96 ASP H 4.470 . 4.470 3.017 2.692 3.316 . 0 0 "[ . 1 . 2]" 1
2717 2 85 ILE HA 2 96 ASP H 4.640 . 4.640 3.313 3.036 3.617 . 0 0 "[ . 1 . 2]" 1
2718 1 96 ASP H 2 3 ILE MD 4.040 . 4.040 3.444 3.064 4.042 0.002 5 0 "[ . 1 . 2]" 1
2719 2 95 LEU MD2 2 96 ASP H 4.260 . 4.260 4.263 4.229 4.275 0.015 1 0 "[ . 1 . 2]" 1
2720 2 95 LEU MD1 2 96 ASP H 4.440 . 4.440 3.021 2.804 3.238 . 0 0 "[ . 1 . 2]" 1
2721 2 96 ASP H 2 97 VAL H 4.380 . 4.380 4.146 4.001 4.344 . 0 0 "[ . 1 . 2]" 1
2722 2 96 ASP HB2 2 97 VAL H 4.630 . 4.630 4.398 4.151 4.526 . 0 0 "[ . 1 . 2]" 1
2723 2 96 ASP HB3 2 97 VAL H 4.290 . 4.290 4.305 4.255 4.323 0.033 2 0 "[ . 1 . 2]" 1
2724 2 97 VAL H 2 97 VAL HB 3.850 . 3.850 2.926 2.613 3.455 . 0 0 "[ . 1 . 2]" 1
2725 2 97 VAL H 2 134 VAL MG2 3.970 . 3.970 3.673 3.384 3.974 0.004 16 0 "[ . 1 . 2]" 1
2726 2 97 VAL H 2 98 GLU H 4.840 . 4.840 4.229 3.999 4.475 . 0 0 "[ . 1 . 2]" 1
2727 2 98 GLU H 2 99 LEU H 5.130 . 5.130 4.264 3.987 4.395 . 0 0 "[ . 1 . 2]" 1
2728 2 82 GLU HB3 2 98 GLU H 3.920 . 3.920 3.584 2.890 3.908 . 0 0 "[ . 1 . 2]" 1
2729 2 98 GLU H 2 134 VAL MG1 4.720 . 4.720 4.668 3.780 4.744 0.024 10 0 "[ . 1 . 2]" 1
2730 2 99 LEU H 2 136 LEU HG 5.290 . 5.290 5.201 5.064 5.297 0.007 3 0 "[ . 1 . 2]" 1
2731 2 99 LEU H 2 99 LEU MD2 4.650 . 4.650 3.845 3.451 4.434 . 0 0 "[ . 1 . 2]" 1
2732 2 80 THR HB 2 100 ARG H 4.590 . 4.590 3.726 3.358 3.945 . 0 0 "[ . 1 . 2]" 1
2733 2 100 ARG H 2 100 ARG HG2 4.830 . 4.830 4.145 3.658 4.563 . 0 0 "[ . 1 . 2]" 1
2734 2 80 THR MG 2 100 ARG H 5.130 . 5.130 4.450 4.253 4.681 . 0 0 "[ . 1 . 2]" 1
2735 2 81 ALA MB 2 100 ARG H 5.490 . 5.490 4.464 4.127 4.730 . 0 0 "[ . 1 . 2]" 1
2736 2 79 VAL MG1 2 100 ARG H 4.510 . 4.510 3.434 3.229 3.884 . 0 0 "[ . 1 . 2]" 1
2737 2 100 ARG H 2 137 VAL MG1 4.770 . 4.770 3.370 3.270 3.491 . 0 0 "[ . 1 . 2]" 1
2738 2 100 ARG H 2 137 VAL H 5.010 . 5.010 4.900 4.792 5.006 . 0 0 "[ . 1 . 2]" 1
2739 2 100 ARG H 2 101 VAL H 4.650 . 4.650 4.376 4.274 4.480 . 0 0 "[ . 1 . 2]" 1
2740 2 101 VAL H 2 137 VAL H 4.760 . 4.760 4.213 4.026 4.451 . 0 0 "[ . 1 . 2]" 1
2741 2 101 VAL H 2 101 VAL HB 3.880 . 3.880 2.504 2.413 2.622 . 0 0 "[ . 1 . 2]" 1
2742 2 101 VAL H 2 138 VAL MG2 5.200 . 5.200 5.208 5.188 5.221 0.021 1 0 "[ . 1 . 2]" 1
2743 2 102 ALA H 2 103 LEU H 4.270 . 4.270 4.110 3.977 4.216 . 0 0 "[ . 1 . 2]" 1
2744 2 80 THR H 2 102 ALA H 4.790 . 4.790 4.162 3.883 4.510 . 0 0 "[ . 1 . 2]" 1
2745 2 101 VAL H 2 102 ALA H 4.750 . 4.750 4.231 4.111 4.377 . 0 0 "[ . 1 . 2]" 1
2746 2 79 VAL HA 2 102 ALA H 4.020 . 4.020 2.829 2.572 3.039 . 0 0 "[ . 1 . 2]" 1
2747 2 102 ALA H 2 139 ALA MB 4.510 . 4.510 3.745 3.385 4.107 . 0 0 "[ . 1 . 2]" 1
2748 2 102 ALA HA 2 103 LEU H 3.160 . 3.160 2.174 2.150 2.191 . 0 0 "[ . 1 . 2]" 1
2749 2 103 LEU H 2 104 PRO HD2 4.940 . 4.940 4.838 4.711 4.936 . 0 0 "[ . 1 . 2]" 1
2750 2 103 LEU H 2 139 ALA MB 3.890 . 3.890 3.438 2.810 3.849 . 0 0 "[ . 1 . 2]" 1
2751 2 103 LEU H 2 103 LEU MD1 4.940 . 4.940 4.254 3.996 4.333 . 0 0 "[ . 1 . 2]" 1
2752 2 103 LEU H 2 103 LEU MD2 4.940 . 4.940 4.368 3.204 4.593 . 0 0 "[ . 1 . 2]" 1
2753 2 101 VAL MG1 2 103 LEU H 4.190 . 4.190 3.264 3.098 3.479 . 0 0 "[ . 1 . 2]" 1
2754 2 104 PRO HA 2 105 GLY H 2.930 . 2.930 2.202 2.118 2.290 . 0 0 "[ . 1 . 2]" 1
2755 2 104 PRO HB2 2 105 GLY H 3.660 . 3.660 3.087 2.897 3.249 . 0 0 "[ . 1 . 2]" 1
2756 2 104 PRO HB3 2 105 GLY H 3.680 . 3.680 3.691 3.673 3.701 0.021 5 0 "[ . 1 . 2]" 1
2757 2 104 PRO HG2 2 105 GLY H 4.950 . 4.950 4.742 4.557 4.864 . 0 0 "[ . 1 . 2]" 1
2758 2 105 GLY H 2 106 LEU HB3 5.160 . 5.160 4.824 4.699 4.985 . 0 0 "[ . 1 . 2]" 1
2759 2 105 GLY H 2 106 LEU H 3.150 . 3.150 2.590 2.492 2.705 . 0 0 "[ . 1 . 2]" 1
2760 2 104 PRO HA 2 106 LEU H 3.390 . 3.390 3.265 3.175 3.346 . 0 0 "[ . 1 . 2]" 1
2761 2 105 GLY HA2 2 106 LEU H 3.230 . 3.230 3.116 3.075 3.238 0.008 1 0 "[ . 1 . 2]" 1
2762 2 104 PRO HB2 2 106 LEU H 4.980 . 4.980 4.951 4.864 4.989 0.009 17 0 "[ . 1 . 2]" 1
2763 2 107 ASP H 2 111 ALA H 4.540 . 4.540 4.312 3.817 4.541 0.001 18 0 "[ . 1 . 2]" 1
2764 2 107 ASP H 2 110 ALA H 4.500 . 4.500 4.342 3.956 4.506 0.006 5 0 "[ . 1 . 2]" 1
2765 2 106 LEU H 2 107 ASP H 4.450 . 4.450 4.406 4.319 4.456 0.006 5 0 "[ . 1 . 2]" 1
2766 2 106 LEU HA 2 107 ASP H 2.720 . 2.720 2.174 2.124 2.244 . 0 0 "[ . 1 . 2]" 1
2767 2 107 ASP H 2 107 ASP HB2 3.150 . 3.150 2.328 2.245 2.431 . 0 0 "[ . 1 . 2]" 1
2768 2 107 ASP H 2 107 ASP HB3 3.570 . 3.570 3.372 2.902 3.579 0.009 12 0 "[ . 1 . 2]" 1
2769 2 106 LEU HG 2 107 ASP H 3.130 . 3.130 3.045 2.831 3.134 0.004 3 0 "[ . 1 . 2]" 1
2770 2 107 ASP H 2 110 ALA MB 3.570 . 3.570 3.055 2.558 3.322 . 0 0 "[ . 1 . 2]" 1
2771 2 108 ALA H 2 111 ALA H 4.870 . 4.870 4.555 4.471 4.620 . 0 0 "[ . 1 . 2]" 1
2772 2 107 ASP H 2 108 ALA H 4.620 . 4.620 4.593 4.577 4.612 . 0 0 "[ . 1 . 2]" 1
2773 2 108 ALA H 2 110 ALA H 4.590 . 4.590 4.353 4.170 4.586 . 0 0 "[ . 1 . 2]" 1
2774 2 107 ASP HA 2 108 ALA H 2.800 . 2.800 2.280 2.211 2.384 . 0 0 "[ . 1 . 2]" 1
2775 2 107 ASP HB3 2 108 ALA H 3.390 . 3.390 2.967 2.696 3.163 . 0 0 "[ . 1 . 2]" 1
2776 2 108 ALA H 2 108 ALA MB 2.620 . 2.620 2.223 2.182 2.245 . 0 0 "[ . 1 . 2]" 1
2777 2 108 ALA H 2 109 ALA H 3.300 . 3.300 2.627 2.555 2.736 . 0 0 "[ . 1 . 2]" 1
2778 2 109 ALA H 2 112 LYS H 4.920 . 4.920 4.766 4.645 4.855 . 0 0 "[ . 1 . 2]" 1
2779 2 109 ALA H 2 110 ALA H 2.900 . 2.900 2.791 2.654 2.869 . 0 0 "[ . 1 . 2]" 1
2780 2 109 ALA H 2 109 ALA HA 2.810 . 2.810 2.794 2.774 2.818 0.008 10 0 "[ . 1 . 2]" 1
2781 2 107 ASP HB2 2 109 ALA H 4.220 . 4.220 4.019 3.821 4.226 0.006 10 0 "[ . 1 . 2]" 1
2782 2 107 ASP HB3 2 109 ALA H 3.710 . 3.710 2.713 2.578 2.934 . 0 0 "[ . 1 . 2]" 1
2783 2 109 ALA H 2 109 ALA MB 2.400 . 2.400 2.235 2.230 2.241 . 0 0 "[ . 1 . 2]" 1
2784 2 56 ALA MB 2 57 CYS H 3.710 . 3.710 2.511 2.397 2.654 . 0 0 "[ . 1 . 2]" 1
2785 2 106 LEU MD1 2 109 ALA H 5.500 . 5.500 5.399 5.252 5.503 0.003 19 0 "[ . 1 . 2]" 1
2786 2 57 CYS H 2 58 PHE H 4.350 . 4.350 2.607 2.495 2.695 . 0 0 "[ . 1 . 2]" 1
2787 2 110 ALA H 2 111 ALA H 3.230 . 3.230 2.520 2.394 2.584 . 0 0 "[ . 1 . 2]" 1
2788 2 110 ALA H 2 112 LYS H 4.310 . 4.310 4.126 3.990 4.232 . 0 0 "[ . 1 . 2]" 1
2789 2 107 ASP HA 2 110 ALA H 4.910 . 4.910 4.721 4.590 4.882 . 0 0 "[ . 1 . 2]" 1
2790 2 107 ASP HB2 2 110 ALA H 3.790 . 3.790 2.988 2.533 3.442 . 0 0 "[ . 1 . 2]" 1
2791 2 107 ASP HB3 2 110 ALA H 3.710 . 3.710 2.676 1.816 3.141 . 0 0 "[ . 1 . 2]" 1
2792 2 110 ALA H 2 112 LYS HB2 5.340 . 5.340 5.195 4.951 5.344 0.004 7 0 "[ . 1 . 2]" 1
2793 2 110 ALA H 2 110 ALA MB 2.500 . 2.500 2.250 2.239 2.268 . 0 0 "[ . 1 . 2]" 1
2794 2 106 LEU MD1 2 110 ALA H 3.830 . 3.830 3.776 3.589 3.835 0.005 16 0 "[ . 1 . 2]" 1
2795 2 109 ALA H 2 111 ALA H 4.220 . 4.220 3.971 3.881 4.109 . 0 0 "[ . 1 . 2]" 1
2796 2 111 ALA H 2 112 LYS H 3.640 . 3.640 2.770 2.716 2.843 . 0 0 "[ . 1 . 2]" 1
2797 2 111 ALA H 2 112 LYS HB2 5.060 . 5.060 4.831 4.623 4.993 . 0 0 "[ . 1 . 2]" 1
2798 2 106 LEU HG 2 111 ALA H 3.680 . 3.680 3.275 3.049 3.435 . 0 0 "[ . 1 . 2]" 1
2799 2 110 ALA MB 2 111 ALA H 2.720 . 2.720 2.560 2.483 2.654 . 0 0 "[ . 1 . 2]" 1
2800 2 111 ALA H 2 113 THR MG 5.220 . 5.220 4.811 4.663 5.195 . 0 0 "[ . 1 . 2]" 1
2801 2 106 LEU MD1 2 111 ALA H 3.540 . 3.540 2.710 2.579 2.850 . 0 0 "[ . 1 . 2]" 1
2802 2 109 ALA HA 2 112 LYS H 4.100 . 4.100 3.777 3.645 4.004 . 0 0 "[ . 1 . 2]" 1
2803 2 108 ALA HA 2 112 LYS H 3.990 . 3.990 3.986 3.849 4.003 0.013 19 0 "[ . 1 . 2]" 1
2804 2 112 LYS H 2 112 LYS HB2 3.060 . 3.060 2.429 2.291 2.514 . 0 0 "[ . 1 . 2]" 1
2805 2 112 LYS H 2 112 LYS HD2 4.930 . 4.930 4.381 3.816 4.874 . 0 0 "[ . 1 . 2]" 1
2806 2 111 ALA MB 2 112 LYS H 2.900 . 2.900 2.591 2.450 2.724 . 0 0 "[ . 1 . 2]" 1
2807 2 112 LYS H 2 113 THR MG 5.030 . 5.030 4.612 4.441 5.038 0.008 14 0 "[ . 1 . 2]" 1
2808 2 112 LYS H 2 138 VAL MG1 4.310 . 4.310 3.173 2.698 3.440 . 0 0 "[ . 1 . 2]" 1
2809 2 112 LYS H 2 138 VAL MG2 4.310 . 4.310 2.986 2.439 3.523 . 0 0 "[ . 1 . 2]" 1
2810 2 114 LEU H 2 116 ASP H 4.390 . 4.390 3.898 3.755 4.065 . 0 0 "[ . 1 . 2]" 1
2811 2 114 LEU H 2 115 VAL H 3.620 . 3.620 2.693 2.592 2.781 . 0 0 "[ . 1 . 2]" 1
2812 2 112 LYS H 2 114 LEU H 4.570 . 4.570 4.137 4.034 4.226 . 0 0 "[ . 1 . 2]" 1
2813 2 113 THR H 2 114 LEU H 3.530 . 3.530 2.446 2.360 2.556 . 0 0 "[ . 1 . 2]" 1
2814 2 113 THR HB 2 114 LEU H 3.780 . 3.780 3.764 3.442 3.794 0.014 10 0 "[ . 1 . 2]" 1
2815 2 111 ALA HA 2 114 LEU H 3.760 . 3.760 3.287 3.135 3.432 . 0 0 "[ . 1 . 2]" 1
2816 2 114 LEU H 2 115 VAL HB 5.140 . 5.140 4.857 4.689 5.024 . 0 0 "[ . 1 . 2]" 1
2817 2 114 LEU H 2 114 LEU HB2 3.100 . 3.100 2.546 2.494 2.577 . 0 0 "[ . 1 . 2]" 1
2818 2 114 LEU H 2 114 LEU HG 3.460 . 3.460 2.306 2.244 2.365 . 0 0 "[ . 1 . 2]" 1
2819 2 112 LYS HA 2 115 VAL H 4.370 . 4.370 4.012 3.636 4.358 . 0 0 "[ . 1 . 2]" 1
2820 2 115 VAL H 2 115 VAL HB 3.680 . 3.680 2.519 2.436 2.600 . 0 0 "[ . 1 . 2]" 1
2821 2 114 LEU HB2 2 115 VAL H 3.550 . 3.550 2.501 2.392 2.631 . 0 0 "[ . 1 . 2]" 1
2822 2 115 VAL H 2 115 VAL MG2 3.240 . 3.240 2.114 1.989 2.250 . 0 0 "[ . 1 . 2]" 1
2823 2 116 ASP H 2 117 ARG H 3.670 . 3.670 2.862 2.794 2.913 . 0 0 "[ . 1 . 2]" 1
2824 2 113 THR HA 2 117 ARG H 4.520 . 4.520 3.927 3.829 4.043 . 0 0 "[ . 1 . 2]" 1
2825 2 114 LEU HA 2 117 ARG H 4.840 . 4.840 3.708 3.626 3.796 . 0 0 "[ . 1 . 2]" 1
2826 2 116 ASP HB2 2 117 ARG H 3.800 . 3.800 3.647 3.555 3.757 . 0 0 "[ . 1 . 2]" 1
2827 2 116 ASP HB3 2 117 ARG H 3.780 . 3.780 2.216 2.129 2.358 . 0 0 "[ . 1 . 2]" 1
2828 2 117 ARG H 2 117 ARG HG2 3.600 . 3.600 1.930 1.884 1.974 . 0 0 "[ . 1 . 2]" 1
2829 2 117 ARG H 2 117 ARG HB3 3.510 . 3.510 2.627 2.583 2.683 . 0 0 "[ . 1 . 2]" 1
2830 2 117 ARG H 2 117 ARG HG3 3.600 . 3.600 3.275 3.153 3.380 . 0 0 "[ . 1 . 2]" 1
2831 2 118 ALA H 2 119 HIS H 3.830 . 3.830 2.707 2.577 2.942 . 0 0 "[ . 1 . 2]" 1
2832 2 117 ARG H 2 118 ALA H 3.640 . 3.640 2.654 2.569 2.749 . 0 0 "[ . 1 . 2]" 1
2833 2 118 ALA H 2 120 HIS H 4.560 . 4.560 3.913 3.702 4.039 . 0 0 "[ . 1 . 2]" 1
2834 2 114 LEU HA 2 118 ALA H 4.460 . 4.460 3.931 3.830 4.030 . 0 0 "[ . 1 . 2]" 1
2835 2 115 VAL HA 2 118 ALA H 4.400 . 4.400 3.650 3.522 3.871 . 0 0 "[ . 1 . 2]" 1
2836 2 117 ARG HB3 2 118 ALA H 3.960 . 3.960 3.965 3.951 3.978 0.018 10 0 "[ . 1 . 2]" 1
2837 2 118 ALA H 2 118 ALA MB 3.030 . 3.030 2.241 2.226 2.261 . 0 0 "[ . 1 . 2]" 1
2838 2 119 HIS H 2 119 HIS HD2 5.500 . 5.500 4.815 2.628 5.335 . 0 0 "[ . 1 . 2]" 1
2839 2 116 ASP HA 2 119 HIS H 4.270 . 4.270 3.764 3.462 4.241 . 0 0 "[ . 1 . 2]" 1
2840 2 119 HIS H 2 119 HIS HB2 4.170 . 4.170 2.378 2.202 2.607 . 0 0 "[ . 1 . 2]" 1
2841 2 119 HIS H 2 119 HIS HB3 4.170 . 4.170 3.121 2.559 3.758 . 0 0 "[ . 1 . 2]" 1
2842 2 119 HIS H 2 136 LEU MD2 5.220 . 5.220 5.216 5.038 5.240 0.020 7 0 "[ . 1 . 2]" 1
2843 2 119 HIS H 2 120 HIS H 4.090 . 4.090 2.614 2.308 2.823 . 0 0 "[ . 1 . 2]" 1
2844 2 120 HIS H 2 122 CYS H 4.820 . 4.820 3.805 3.416 4.827 0.007 17 0 "[ . 1 . 2]" 1
2845 2 120 HIS H 2 121 VAL H 3.810 . 3.810 2.169 1.981 2.565 . 0 0 "[ . 1 . 2]" 1
2846 2 118 ALA HA 2 120 HIS H 4.480 . 4.480 3.683 3.471 4.050 . 0 0 "[ . 1 . 2]" 1
2847 2 120 HIS H 2 121 VAL MG2 4.530 . 4.530 3.389 3.246 3.763 . 0 0 "[ . 1 . 2]" 1
2848 2 120 HIS H 2 121 VAL MG1 4.530 . 4.530 3.888 3.594 4.534 0.004 17 0 "[ . 1 . 2]" 1
2849 2 126 ASN H 2 128 THR MG 5.050 . 5.050 4.532 4.135 4.891 . 0 0 "[ . 1 . 2]" 1
2850 2 127 ALA H 2 128 THR H 3.770 . 3.770 2.745 2.551 2.966 . 0 0 "[ . 1 . 2]" 1
2851 2 127 ALA H 2 129 ARG H 4.560 . 4.560 4.355 4.135 4.578 0.018 13 0 "[ . 1 . 2]" 1
2852 2 126 ASN HB2 2 127 ALA H 4.270 . 4.270 3.467 2.376 4.017 . 0 0 "[ . 1 . 2]" 1
2853 2 126 ASN HB3 2 127 ALA H 4.270 . 4.270 3.316 2.376 4.062 . 0 0 "[ . 1 . 2]" 1
2854 2 127 ALA H 2 127 ALA MB 3.230 . 3.230 2.222 2.181 2.276 . 0 0 "[ . 1 . 2]" 1
2855 2 127 ALA H 2 128 THR MG 4.760 . 4.760 4.423 4.142 4.765 0.005 10 0 "[ . 1 . 2]" 1
2856 2 128 THR H 2 128 THR HB 4.160 . 4.160 2.684 2.582 2.829 . 0 0 "[ . 1 . 2]" 1
2857 2 129 ARG HD3 2 130 ASN H 4.710 . 4.710 4.390 4.056 4.730 0.020 11 0 "[ . 1 . 2]" 1
2858 2 129 ARG HB3 2 130 ASN H 3.950 . 3.950 3.865 3.739 3.958 0.008 19 0 "[ . 1 . 2]" 1
2859 2 129 ARG HG3 2 130 ASN H 4.350 . 4.350 2.026 1.804 2.387 . 0 0 "[ . 1 . 2]" 1
2860 2 129 ARG HB2 2 130 ASN H 4.540 . 4.540 3.538 3.241 3.783 . 0 0 "[ . 1 . 2]" 1
2861 2 130 ASN HA 2 130 ASN HD21 4.660 . 4.660 3.558 1.802 4.389 . 0 0 "[ . 1 . 2]" 1
2862 2 130 ASN HA 2 130 ASN HD22 4.660 . 4.660 4.306 3.437 4.729 0.069 16 0 "[ . 1 . 2]" 1
2863 2 129 ARG HG2 2 130 ASN HD22 5.180 . 5.180 4.062 2.980 5.061 . 0 0 "[ . 1 . 2]" 1
2864 2 130 ASN H 2 132 VAL H 4.040 . 4.040 3.933 3.822 4.049 0.009 5 0 "[ . 1 . 2]" 1
2865 2 131 ASN H 2 132 VAL H 3.320 . 3.320 2.340 1.986 2.645 . 0 0 "[ . 1 . 2]" 1
2866 2 128 THR H 2 132 VAL H 5.000 . 5.000 4.676 4.281 4.909 . 0 0 "[ . 1 . 2]" 1
2867 2 128 THR HA 2 132 VAL H 4.490 . 4.490 3.412 2.840 4.491 0.001 14 0 "[ . 1 . 2]" 1
2868 2 130 ASN HA 2 132 VAL H 4.810 . 4.810 4.774 4.567 4.824 0.014 20 0 "[ . 1 . 2]" 1
2869 2 129 ARG HA 2 132 VAL H 4.200 . 4.200 4.066 3.675 4.215 0.015 14 0 "[ . 1 . 2]" 1
2870 2 131 ASN HB2 2 132 VAL H 4.090 . 4.090 3.807 3.697 3.971 . 0 0 "[ . 1 . 2]" 1
2871 2 131 ASN HB3 2 132 VAL H 4.090 . 4.090 2.623 2.483 2.839 . 0 0 "[ . 1 . 2]" 1
2872 2 132 VAL H 2 132 VAL HB 3.870 . 3.870 2.694 2.537 3.860 . 0 0 "[ . 1 . 2]" 1
2873 2 132 VAL H 2 133 ALA H 4.720 . 4.720 4.501 4.346 4.594 . 0 0 "[ . 1 . 2]" 1
2874 2 132 VAL HA 2 133 ALA H 3.410 . 3.410 2.315 2.142 2.608 . 0 0 "[ . 1 . 2]" 1
2875 2 133 ALA H 2 134 VAL MG2 4.310 . 4.310 3.959 3.567 4.266 . 0 0 "[ . 1 . 2]" 1
2876 2 133 ALA H 2 134 VAL H 4.520 . 4.520 4.071 3.834 4.292 . 0 0 "[ . 1 . 2]" 1
2877 2 134 VAL H 2 135 ARG H 4.400 . 4.400 4.234 4.058 4.404 0.004 11 0 "[ . 1 . 2]" 1
2878 2 133 ALA HA 2 134 VAL H 2.960 . 2.960 2.195 2.138 2.303 . 0 0 "[ . 1 . 2]" 1
2879 2 132 VAL HA 2 134 VAL H 5.500 . 5.500 5.260 4.937 5.504 0.004 2 0 "[ . 1 . 2]" 1
2880 2 129 ARG HA 2 134 VAL H 4.160 . 4.160 3.560 2.748 4.168 0.008 10 0 "[ . 1 . 2]" 1
2881 2 134 VAL H 2 134 VAL HB 3.290 . 3.290 2.647 2.506 2.815 . 0 0 "[ . 1 . 2]" 1
2882 2 133 ALA MB 2 134 VAL H 3.640 . 3.640 3.548 3.444 3.644 0.004 1 0 "[ . 1 . 2]" 1
2883 2 134 VAL H 2 134 VAL MG2 3.060 . 3.060 2.653 2.273 2.916 . 0 0 "[ . 1 . 2]" 1
2884 2 134 VAL MG2 2 135 ARG H 4.260 . 4.260 4.108 3.881 4.266 0.006 10 0 "[ . 1 . 2]" 1
2885 2 134 VAL MG1 2 135 ARG H 3.910 . 3.910 2.884 2.298 3.134 . 0 0 "[ . 1 . 2]" 1
2886 2 135 ARG HA 2 136 LEU H 3.150 . 3.150 2.168 2.133 2.208 . 0 0 "[ . 1 . 2]" 1
2887 2 136 LEU H 2 136 LEU HG 3.370 . 3.370 2.728 2.526 3.021 . 0 0 "[ . 1 . 2]" 1
2888 2 136 LEU H 2 136 LEU HB3 3.570 . 3.570 3.576 3.547 3.586 0.016 14 0 "[ . 1 . 2]" 1
2889 2 136 LEU H 2 137 VAL MG1 4.710 . 4.710 4.587 4.402 4.714 0.004 1 0 "[ . 1 . 2]" 1
2890 2 136 LEU H 2 136 LEU MD1 4.000 . 4.000 3.802 3.686 3.941 . 0 0 "[ . 1 . 2]" 1
2891 2 136 LEU H 2 136 LEU MD2 4.100 . 4.100 3.641 3.452 3.960 . 0 0 "[ . 1 . 2]" 1
2892 2 136 LEU H 2 137 VAL H 4.550 . 4.550 4.334 4.209 4.454 . 0 0 "[ . 1 . 2]" 1
2893 2 136 LEU HB2 2 137 VAL H 4.770 . 4.770 4.408 4.318 4.513 . 0 0 "[ . 1 . 2]" 1
2894 2 136 LEU HB3 2 137 VAL H 3.960 . 3.960 3.608 3.408 3.809 . 0 0 "[ . 1 . 2]" 1
2895 2 136 LEU MD1 2 137 VAL H 5.330 . 5.330 5.212 5.072 5.332 0.002 19 0 "[ . 1 . 2]" 1
2896 2 101 VAL H 2 138 VAL H 4.890 . 4.890 4.642 4.595 4.679 . 0 0 "[ . 1 . 2]" 1
2897 2 137 VAL H 2 138 VAL H 4.620 . 4.620 4.226 4.128 4.351 . 0 0 "[ . 1 . 2]" 1
2898 2 138 VAL H 2 139 ALA H 4.600 . 4.600 4.491 4.466 4.525 . 0 0 "[ . 1 . 2]" 1
2899 2 137 VAL HA 2 138 VAL H 2.830 . 2.830 2.118 2.084 2.165 . 0 0 "[ . 1 . 2]" 1
2900 2 138 VAL H 2 138 VAL HB 3.770 . 3.770 3.734 3.690 3.769 . 0 0 "[ . 1 . 2]" 1
2901 2 111 ALA MB 2 138 VAL H 5.260 . 5.260 5.072 4.907 5.268 0.008 12 0 "[ . 1 . 2]" 1
2902 2 138 VAL H 2 138 VAL MG1 3.990 . 3.990 2.275 2.087 2.402 . 0 0 "[ . 1 . 2]" 1
2903 2 138 VAL H 2 138 VAL MG2 3.990 . 3.990 2.304 2.163 2.398 . 0 0 "[ . 1 . 2]" 1
2904 2 101 VAL H 2 139 ALA H 4.100 . 4.100 3.390 3.193 3.501 . 0 0 "[ . 1 . 2]" 1
2905 2 102 ALA HA 2 139 ALA H 3.980 . 3.980 3.311 3.070 3.531 . 0 0 "[ . 1 . 2]" 1
2906 2 101 VAL HB 2 139 ALA H 3.410 . 3.410 3.418 3.412 3.423 0.013 4 0 "[ . 1 . 2]" 1
2907 2 111 ALA MB 2 139 ALA H 4.120 . 4.120 4.001 3.828 4.130 0.010 15 0 "[ . 1 . 2]" 1
2908 2 102 ALA MB 2 139 ALA H 4.750 . 4.750 4.373 4.211 4.500 . 0 0 "[ . 1 . 2]" 1
2909 2 101 VAL MG1 2 139 ALA H 3.870 . 3.870 3.878 3.875 3.882 0.012 10 0 "[ . 1 . 2]" 1
2910 2 24 GLN H 2 24 GLN HE22 4.120 . 4.120 3.756 3.525 4.133 0.013 12 0 "[ . 1 . 2]" 1
2911 2 22 HIS HA 2 24 GLN HE22 4.490 . 4.490 3.969 3.126 4.464 . 0 0 "[ . 1 . 2]" 1
2912 2 24 GLN HA 2 24 GLN HE22 4.500 . 4.500 3.233 3.162 3.742 . 0 0 "[ . 1 . 2]" 1
2913 2 24 GLN HE22 2 24 GLN HG2 3.700 . 3.700 3.491 3.471 3.503 . 0 0 "[ . 1 . 2]" 1
2914 2 20 THR MG 2 24 GLN HE22 3.570 . 3.570 3.382 3.037 3.574 0.004 15 0 "[ . 1 . 2]" 1
2915 2 24 GLN H 2 24 GLN HE21 3.970 . 3.970 2.408 2.176 3.441 . 0 0 "[ . 1 . 2]" 1
2916 2 22 HIS HA 2 24 GLN HE21 4.050 . 4.050 3.371 2.646 4.002 . 0 0 "[ . 1 . 2]" 1
2917 2 24 GLN HA 2 24 GLN HE21 4.320 . 4.320 2.722 2.474 3.766 . 0 0 "[ . 1 . 2]" 1
2918 2 24 GLN HE21 2 24 GLN HG2 3.270 . 3.270 2.237 2.201 2.262 . 0 0 "[ . 1 . 2]" 1
2919 2 20 THR MG 2 24 GLN HE21 4.060 . 4.060 3.976 3.524 4.075 0.015 12 0 "[ . 1 . 2]" 1
2920 2 2 ASN HB2 2 2 ASN HD22 3.860 . 3.860 3.793 3.760 3.904 0.044 14 0 "[ . 1 . 2]" 1
2921 2 2 ASN HB3 2 2 ASN HD22 3.860 . 3.860 3.483 3.382 3.504 . 0 0 "[ . 1 . 2]" 1
2922 2 2 ASN HB2 2 2 ASN HD21 3.270 . 3.270 2.952 2.873 3.288 0.018 14 0 "[ . 1 . 2]" 1
2923 2 2 ASN HB3 2 2 ASN HD21 3.270 . 3.270 2.229 2.088 2.277 . 0 0 "[ . 1 . 2]" 1
2924 2 2 ASN HD21 2 4 LEU MD2 3.980 . 3.980 3.689 2.977 3.986 0.006 12 0 "[ . 1 . 2]" 1
2925 2 129 ARG H 2 130 ASN H 4.350 . 4.350 2.092 1.881 2.268 . 0 0 "[ . 1 . 2]" 1
2926 2 128 THR H 2 129 ARG H 3.640 . 3.640 2.070 1.914 2.223 . 0 0 "[ . 1 . 2]" 1
2927 2 126 ASN HA 2 129 ARG H 4.500 . 4.500 4.071 3.533 4.513 0.013 16 0 "[ . 1 . 2]" 1
2928 2 129 ARG H 2 130 ASN HA 4.760 . 4.760 4.727 4.575 4.782 0.022 18 0 "[ . 1 . 2]" 1
2929 2 129 ARG H 2 129 ARG HB2 3.810 . 3.810 3.726 3.663 3.819 0.009 14 0 "[ . 1 . 2]" 1
2930 2 129 ARG H 2 129 ARG HB3 3.430 . 3.430 3.094 2.862 3.436 0.006 14 0 "[ . 1 . 2]" 1
2931 2 129 ARG H 2 129 ARG HG3 4.320 . 4.320 3.038 2.661 3.291 . 0 0 "[ . 1 . 2]" 1
2932 2 128 THR MG 2 129 ARG H 3.910 . 3.910 2.851 2.574 3.213 . 0 0 "[ . 1 . 2]" 1
2933 2 84 GLY H 2 85 ILE H 4.570 . 4.570 4.392 4.365 4.428 . 0 0 "[ . 1 . 2]" 1
2934 2 83 VAL HB 2 84 GLY H 4.270 . 4.270 3.225 2.677 4.123 . 0 0 "[ . 1 . 2]" 1
2935 1 84 GLY H 2 6 LYS HG3 4.120 . 4.120 4.029 3.629 4.124 0.004 4 0 "[ . 1 . 2]" 1
2936 1 84 GLY H 2 3 ILE MD 4.410 . 4.410 3.877 3.627 4.157 . 0 0 "[ . 1 . 2]" 1
2937 2 54 TYR HD1 2 58 PHE H 4.340 . 4.340 3.739 3.438 4.228 . 0 0 "[ . 1 . 2]" 1
2938 2 56 ALA H 2 58 PHE H 4.760 . 4.760 3.988 3.920 4.136 . 0 0 "[ . 1 . 2]" 1
2939 2 58 PHE H 2 79 VAL MG2 5.500 . 5.500 5.499 5.423 5.513 0.013 8 0 "[ . 1 . 2]" 1
2940 2 58 PHE H 2 79 VAL MG1 5.500 . 5.500 5.245 4.790 5.511 0.011 6 0 "[ . 1 . 2]" 1
2941 2 54 TYR HD1 2 57 CYS H 4.650 . 4.650 4.605 4.505 4.658 0.008 19 0 "[ . 1 . 2]" 1
2942 2 56 ALA H 2 57 CYS H 4.040 . 4.040 2.668 2.572 2.764 . 0 0 "[ . 1 . 2]" 1
2943 2 61 ALA H 2 63 LYS H 4.500 . 4.500 3.927 3.694 4.177 . 0 0 "[ . 1 . 2]" 1
2944 1 11 SER H 2 80 THR MG 4.330 . 4.330 4.337 4.326 4.344 0.014 11 0 "[ . 1 . 2]" 1
2945 2 28 VAL HA 2 29 LYS H 3.250 . 3.250 2.509 2.235 2.603 . 0 0 "[ . 1 . 2]" 1
2946 2 31 SER H 2 32 ALA H 4.490 . 4.490 4.125 3.876 4.375 . 0 0 "[ . 1 . 2]" 1
2947 2 54 TYR HD1 2 55 SER H 5.070 . 5.070 4.546 4.135 4.883 . 0 0 "[ . 1 . 2]" 1
2948 2 54 TYR HD2 2 55 SER H 5.390 . 5.390 4.678 4.272 4.991 . 0 0 "[ . 1 . 2]" 1
2949 2 68 GLN H 2 69 ASN HA 4.880 . 4.880 4.789 4.750 4.842 . 0 0 "[ . 1 . 2]" 1
2950 2 80 THR H 2 81 ALA H 4.610 . 4.610 4.219 4.042 4.279 . 0 0 "[ . 1 . 2]" 1
2951 2 96 ASP H 2 96 ASP HB3 4.010 . 4.010 2.609 2.471 2.834 . 0 0 "[ . 1 . 2]" 1
2952 2 96 ASP H 2 96 ASP HB2 4.040 . 4.040 3.056 2.827 3.239 . 0 0 "[ . 1 . 2]" 1
2953 2 66 ALA HA 2 69 ASN HD22 5.500 . 5.500 5.386 5.201 5.506 0.006 13 0 "[ . 1 . 2]" 1
2954 2 69 ASN HA 2 69 ASN HD22 4.260 . 4.260 3.765 3.448 4.134 . 0 0 "[ . 1 . 2]" 1
2955 1 1 MET HA 1 2 ASN QB 4.530 . 4.530 4.315 4.082 4.461 . 0 0 "[ . 1 . 2]" 1
2956 1 2 ASN QB 1 2 ASN HD22 3.310 . 3.310 3.221 3.189 3.229 . 0 0 "[ . 1 . 2]" 1
2957 1 2 ASN QB 1 3 ILE H 4.170 . 4.170 4.039 4.020 4.059 . 0 0 "[ . 1 . 2]" 1
2958 1 3 ILE HB 1 6 LYS QE 4.760 . 4.760 3.902 3.138 4.340 . 0 0 "[ . 1 . 2]" 1
2959 1 3 ILE MG 1 6 LYS QD 3.960 . 3.960 3.470 3.144 3.858 . 0 0 "[ . 1 . 2]" 1
2960 1 3 ILE MG 1 6 LYS QE 3.240 . 3.240 2.404 2.006 2.717 . 0 0 "[ . 1 . 2]" 1
2961 1 3 ILE MD 1 6 LYS QB 4.540 . 4.540 3.609 3.057 3.953 . 0 0 "[ . 1 . 2]" 1
2962 1 3 ILE MD 1 6 LYS QE 3.600 . 3.600 2.891 2.411 3.380 . 0 0 "[ . 1 . 2]" 1
2963 1 4 LEU H 2 36 LEU QD 5.440 . 5.440 4.118 3.807 4.398 . 0 0 "[ . 1 . 2]" 1
2964 1 4 LEU HA 2 36 LEU QD 4.240 . 4.240 4.056 3.394 4.253 0.013 17 0 "[ . 1 . 2]" 1
2965 1 4 LEU HG 2 36 LEU QD 5.430 . 5.430 3.987 3.691 4.303 . 0 0 "[ . 1 . 2]" 1
2966 1 4 LEU MD1 2 36 LEU QD 3.110 . 3.110 2.454 1.981 3.004 . 0 0 "[ . 1 . 2]" 1
2967 1 5 TYR H 2 36 LEU QD 4.090 . 4.090 3.146 2.690 3.404 . 0 0 "[ . 1 . 2]" 1
2968 1 5 TYR QB 2 36 LEU HG 4.900 . 4.900 3.311 2.668 4.147 . 0 0 "[ . 1 . 2]" 1
2969 1 5 TYR QB 2 36 LEU QD 3.420 . 3.420 1.858 1.789 2.059 0.011 18 0 "[ . 1 . 2]" 1
2970 1 5 TYR QB 2 85 ILE MG 3.330 . 3.330 2.078 1.924 2.249 . 0 0 "[ . 1 . 2]" 1
2971 1 5 TYR QB 2 85 ILE MD 4.290 . 4.290 3.746 3.617 3.925 . 0 0 "[ . 1 . 2]" 1
2972 1 5 TYR HD2 2 35 GLU QB 4.090 . 4.090 2.674 2.269 3.179 . 0 0 "[ . 1 . 2]" 1
2973 1 5 TYR HD2 2 36 LEU QD 3.580 . 3.580 3.285 2.510 3.585 0.005 18 0 "[ . 1 . 2]" 1
2974 1 6 LYS H 1 6 LYS QB 3.310 . 3.310 2.646 2.534 2.707 . 0 0 "[ . 1 . 2]" 1
2975 1 6 LYS H 1 6 LYS QD 5.190 . 5.190 5.063 4.923 5.167 . 0 0 "[ . 1 . 2]" 1
2976 1 6 LYS H 1 6 LYS QE 5.340 . 5.340 5.209 4.938 5.346 0.006 5 0 "[ . 1 . 2]" 1
2977 1 6 LYS HA 1 6 LYS QD 4.600 . 4.600 4.247 4.212 4.280 . 0 0 "[ . 1 . 2]" 1
2978 1 6 LYS HA 2 83 VAL QG 4.280 . 4.280 3.919 3.723 4.289 0.009 1 0 "[ . 1 . 2]" 1
2979 1 6 LYS QB 1 6 LYS QE 3.740 . 3.740 2.130 1.972 2.274 . 0 0 "[ . 1 . 2]" 1
2980 1 6 LYS QB 2 82 GLU QG 4.640 . 4.640 4.144 3.979 4.358 . 0 0 "[ . 1 . 2]" 1
2981 1 6 LYS QB 2 84 GLY HA3 4.180 . 4.180 2.569 2.343 2.885 . 0 0 "[ . 1 . 2]" 1
2982 1 6 LYS QB 2 85 ILE H 5.210 . 5.210 3.713 3.490 3.947 . 0 0 "[ . 1 . 2]" 1
2983 1 6 LYS QE 1 6 LYS HG2 3.680 . 3.680 3.303 3.290 3.318 . 0 0 "[ . 1 . 2]" 1
2984 1 6 LYS QE 1 6 LYS HG3 3.230 . 3.230 2.283 2.229 2.350 . 0 0 "[ . 1 . 2]" 1
2985 1 6 LYS HG3 2 82 GLU QG 3.680 . 3.680 2.646 2.385 2.888 . 0 0 "[ . 1 . 2]" 1
2986 1 6 LYS QD 1 6 LYS QE 2.360 . 2.360 2.095 2.088 2.099 . 0 0 "[ . 1 . 2]" 1
2987 1 6 LYS QE 2 82 GLU QG 4.360 . 4.360 3.059 2.724 3.419 . 0 0 "[ . 1 . 2]" 1
2988 1 6 LYS QE 2 84 GLY HA2 4.750 . 4.750 3.259 2.996 3.548 . 0 0 "[ . 1 . 2]" 1
2989 1 7 THR H 2 83 VAL QG 4.130 . 4.130 3.022 2.724 3.934 . 0 0 "[ . 1 . 2]" 1
2990 1 7 THR MG 2 48 GLN QB 3.230 . 3.230 1.968 1.795 2.133 0.005 17 0 "[ . 1 . 2]" 1
2991 1 7 THR MG 2 48 GLN QG 3.310 . 3.310 2.503 2.057 2.969 . 0 0 "[ . 1 . 2]" 1
2992 1 8 ALA H 1 22 HIS QB 4.670 . 4.670 3.885 3.170 4.602 . 0 0 "[ . 1 . 2]" 1
2993 1 8 ALA H 2 82 GLU QG 5.010 . 5.010 4.072 3.617 4.914 . 0 0 "[ . 1 . 2]" 1
2994 1 8 ALA MB 1 22 HIS QB 3.820 . 3.820 2.468 1.818 3.228 . 0 0 "[ . 1 . 2]" 1
2995 1 8 ALA MB 2 82 GLU QG 3.640 . 3.640 2.073 1.901 2.490 . 0 0 "[ . 1 . 2]" 1
2996 1 9 ALA MB 1 21 SER QB 3.840 . 3.840 3.065 2.718 3.625 . 0 0 "[ . 1 . 2]" 1
2997 1 10 THR H 1 11 SER QB 5.340 . 5.340 5.312 5.114 5.370 0.030 20 0 "[ . 1 . 2]" 1
2998 1 11 SER QB 1 12 THR H 4.160 . 4.160 3.436 3.020 3.888 . 0 0 "[ . 1 . 2]" 1
2999 1 11 SER QB 1 19 ALA MB 4.700 . 4.700 3.069 2.535 3.472 . 0 0 "[ . 1 . 2]" 1
3000 1 11 SER QB 2 56 ALA H 3.830 . 3.830 3.208 2.949 3.497 . 0 0 "[ . 1 . 2]" 1
3001 1 11 SER QB 2 56 ALA MB 3.560 . 3.560 2.556 2.138 3.563 0.003 4 0 "[ . 1 . 2]" 1
3002 1 12 THR HB 1 13 GLY QA 4.420 . 4.420 4.420 4.375 4.431 0.011 18 0 "[ . 1 . 2]" 1
3003 1 12 THR HB 1 18 ARG QB 4.660 . 4.660 2.276 1.820 2.743 . 0 0 "[ . 1 . 2]" 1
3004 1 13 GLY QA 1 17 GLY QA 4.520 . 4.520 2.732 2.043 3.570 . 0 0 "[ . 1 . 2]" 1
3005 1 13 GLY QA 1 18 ARG H 4.470 . 4.470 3.566 3.185 3.813 . 0 0 "[ . 1 . 2]" 1
3006 1 14 GLY H 1 18 ARG QG 4.680 . 4.680 4.394 2.753 4.702 0.022 18 0 "[ . 1 . 2]" 1
3007 1 16 ASP H 1 17 GLY QA 4.370 . 4.370 3.858 3.799 3.977 . 0 0 "[ . 1 . 2]" 1
3008 1 16 ASP H 1 29 LYS QG 4.110 . 4.110 3.655 3.268 4.131 0.021 9 0 "[ . 1 . 2]" 1
3009 1 16 ASP HA 1 17 GLY QA 4.610 . 4.610 4.187 4.160 4.217 . 0 0 "[ . 1 . 2]" 1
3010 1 16 ASP HB3 1 29 LYS QG 5.050 . 5.050 4.578 4.194 5.053 0.003 14 0 "[ . 1 . 2]" 1
3011 1 17 GLY H 1 29 LYS QG 3.650 . 3.650 3.248 2.984 3.654 0.004 14 0 "[ . 1 . 2]" 1
3012 1 17 GLY QA 1 30 LEU MD1 4.850 . 4.850 3.483 3.232 3.720 . 0 0 "[ . 1 . 2]" 1
3013 1 17 GLY QA 1 30 LEU MD2 3.590 . 3.590 1.960 1.799 2.196 0.001 4 0 "[ . 1 . 2]" 1
3014 1 18 ARG H 1 18 ARG QB 3.650 . 3.650 2.611 2.448 2.745 . 0 0 "[ . 1 . 2]" 1
3015 1 18 ARG H 1 18 ARG QG 4.570 . 4.570 4.103 3.324 4.348 . 0 0 "[ . 1 . 2]" 1
3016 1 18 ARG HA 1 18 ARG QD 4.400 . 4.400 3.661 2.296 4.284 . 0 0 "[ . 1 . 2]" 1
3017 1 18 ARG HA 1 29 LYS QG 4.610 . 4.610 3.580 3.382 4.043 . 0 0 "[ . 1 . 2]" 1
3018 1 18 ARG QB 1 18 ARG QD 3.200 . 3.200 2.260 2.081 2.649 . 0 0 "[ . 1 . 2]" 1
3019 1 18 ARG QB 1 19 ALA H 3.990 . 3.990 3.547 2.214 3.982 . 0 0 "[ . 1 . 2]" 1
3020 1 18 ARG QB 1 29 LYS HA 4.640 . 4.640 3.583 3.028 4.228 . 0 0 "[ . 1 . 2]" 1
3021 1 18 ARG QG 1 19 ALA H 3.770 . 3.770 2.810 2.163 3.771 0.001 5 0 "[ . 1 . 2]" 1
3022 1 18 ARG QG 1 29 LYS HA 4.230 . 4.230 3.008 2.337 4.043 . 0 0 "[ . 1 . 2]" 1
3023 1 18 ARG QD 1 19 ALA H 4.250 . 4.250 3.765 2.518 4.266 0.016 6 0 "[ . 1 . 2]" 1
3024 1 18 ARG QD 1 29 LYS HB2 5.270 . 5.270 3.942 1.884 4.995 . 0 0 "[ . 1 . 2]" 1
3025 1 20 THR HA 1 21 SER QB 4.280 . 4.280 4.170 4.133 4.207 . 0 0 "[ . 1 . 2]" 1
3026 1 20 THR MG 1 27 ASP QB 2.990 . 2.990 2.037 1.857 2.401 . 0 0 "[ . 1 . 2]" 1
3027 1 21 SER QB 1 22 HIS H 4.390 . 4.390 3.823 3.727 3.877 . 0 0 "[ . 1 . 2]" 1
3028 1 21 SER QB 1 25 LYS H 4.170 . 4.170 2.834 2.517 3.056 . 0 0 "[ . 1 . 2]" 1
3029 1 21 SER QB 1 26 LEU H 4.380 . 4.380 1.848 1.795 2.135 0.005 5 0 "[ . 1 . 2]" 1
3030 1 22 HIS H 1 22 HIS QB 3.640 . 3.640 2.202 2.046 2.251 . 0 0 "[ . 1 . 2]" 1
3031 1 22 HIS QB 1 23 ASP H 3.810 . 3.810 3.030 2.745 3.563 . 0 0 "[ . 1 . 2]" 1
3032 1 23 ASP H 1 23 ASP QB 3.420 . 3.420 2.474 2.245 2.896 . 0 0 "[ . 1 . 2]" 1
3033 1 23 ASP QB 1 24 GLN H 3.990 . 3.990 3.673 3.428 3.946 . 0 0 "[ . 1 . 2]" 1
3034 1 23 ASP QB 1 25 LYS QE 4.160 . 4.160 2.270 1.793 3.364 0.007 13 0 "[ . 1 . 2]" 1
3035 1 24 GLN H 1 25 LYS QG 4.790 . 4.790 4.173 3.774 4.799 0.009 16 0 "[ . 1 . 2]" 1
3036 1 24 GLN H 1 25 LYS QE 5.340 . 5.340 5.188 4.694 5.356 0.016 17 0 "[ . 1 . 2]" 1
3037 1 25 LYS H 1 25 LYS QG 3.680 . 3.680 2.475 2.048 3.019 . 0 0 "[ . 1 . 2]" 1
3038 1 25 LYS H 1 25 LYS QE 4.280 . 4.280 3.920 3.291 4.282 0.002 12 0 "[ . 1 . 2]" 1
3039 1 25 LYS HA 1 25 LYS QG 3.710 . 3.710 2.748 2.207 3.364 . 0 0 "[ . 1 . 2]" 1
3040 1 25 LYS HA 1 25 LYS QE 4.560 . 4.560 4.226 1.790 4.595 0.035 16 0 "[ . 1 . 2]" 1
3041 1 25 LYS QE 1 25 LYS QG 2.950 . 2.950 2.302 2.096 2.562 . 0 0 "[ . 1 . 2]" 1
3042 1 26 LEU HA 1 27 ASP QB 4.790 . 4.790 4.103 3.945 4.321 . 0 0 "[ . 1 . 2]" 1
3043 1 29 LYS H 1 29 LYS QG 4.200 . 4.200 3.831 3.458 4.165 . 0 0 "[ . 1 . 2]" 1
3044 1 29 LYS QD 1 29 LYS QG 2.310 . 2.310 2.041 1.999 2.103 . 0 0 "[ . 1 . 2]" 1
3045 1 29 LYS QE 1 29 LYS QG 3.330 . 3.330 2.454 2.154 2.862 . 0 0 "[ . 1 . 2]" 1
3046 1 29 LYS QG 1 30 LEU H 3.520 . 3.520 2.527 2.349 2.658 . 0 0 "[ . 1 . 2]" 1
3047 1 29 LYS QG 1 30 LEU HA 5.340 . 5.340 3.370 2.945 3.767 . 0 0 "[ . 1 . 2]" 1
3048 1 29 LYS QG 1 30 LEU MD1 4.210 . 4.210 3.855 3.780 3.941 . 0 0 "[ . 1 . 2]" 1
3049 1 29 LYS QG 1 30 LEU MD2 3.830 . 3.830 3.823 3.737 3.853 0.023 4 0 "[ . 1 . 2]" 1
3050 1 29 LYS QG 1 31 SER H 5.110 . 5.110 4.755 4.124 5.115 0.005 8 0 "[ . 1 . 2]" 1
3051 1 29 LYS QG 1 43 GLY QA 4.760 . 4.760 3.277 2.415 4.278 . 0 0 "[ . 1 . 2]" 1
3052 1 29 LYS QG 1 44 THR H 5.340 . 5.340 4.494 3.781 5.317 . 0 0 "[ . 1 . 2]" 1
3053 1 29 LYS QD 1 43 GLY QA 5.180 . 5.180 3.774 1.995 5.142 . 0 0 "[ . 1 . 2]" 1
3054 1 30 LEU MD2 1 31 SER QB 5.160 . 5.160 4.584 4.086 4.888 . 0 0 "[ . 1 . 2]" 1
3055 1 31 SER H 1 43 GLY QA 4.090 . 4.090 2.945 2.481 3.613 . 0 0 "[ . 1 . 2]" 1
3056 1 31 SER QB 1 32 ALA H 3.960 . 3.960 3.114 2.115 3.805 . 0 0 "[ . 1 . 2]" 1
3057 1 31 SER QB 1 40 GLY H 5.120 . 5.120 4.167 3.610 5.032 . 0 0 "[ . 1 . 2]" 1
3058 1 31 SER QB 1 41 ALA H 4.190 . 4.190 3.212 2.107 4.194 0.004 7 0 "[ . 1 . 2]" 1
3059 1 31 SER QB 1 41 ALA HA 5.270 . 5.270 4.473 4.167 4.963 . 0 0 "[ . 1 . 2]" 1
3060 1 31 SER QB 1 41 ALA MB 3.330 . 3.330 2.097 1.795 2.388 0.005 1 0 "[ . 1 . 2]" 1
3061 1 31 SER QB 1 43 GLY QA 4.250 . 4.250 2.943 2.188 3.696 . 0 0 "[ . 1 . 2]" 1
3062 1 31 SER QB 1 44 THR H 5.340 . 5.340 4.389 4.093 4.758 . 0 0 "[ . 1 . 2]" 1
3063 1 32 ALA MB 1 38 GLY QA 3.160 . 3.160 2.489 1.830 3.164 0.004 20 0 "[ . 1 . 2]" 1
3064 1 34 ARG H 1 34 ARG QG 4.430 . 4.430 3.743 3.117 4.102 . 0 0 "[ . 1 . 2]" 1
3065 1 34 ARG H 1 34 ARG QD 4.830 . 4.830 4.310 3.998 4.558 . 0 0 "[ . 1 . 2]" 1
3066 1 34 ARG HA 1 34 ARG QG 3.090 . 3.090 2.468 2.143 3.000 . 0 0 "[ . 1 . 2]" 1
3067 1 34 ARG HA 1 34 ARG QD 3.830 . 3.830 2.744 1.857 3.875 0.045 20 0 "[ . 1 . 2]" 1
3068 1 34 ARG QB 1 34 ARG QD 2.920 . 2.920 2.314 2.083 2.706 . 0 0 "[ . 1 . 2]" 1
3069 1 34 ARG QB 1 38 GLY H 4.380 . 4.380 3.941 3.485 4.294 . 0 0 "[ . 1 . 2]" 1
3070 1 34 ARG QB 1 39 ALA H 5.110 . 5.110 3.980 2.715 5.114 0.004 9 0 "[ . 1 . 2]" 1
3071 1 34 ARG QB 1 41 ALA H 4.540 . 4.540 4.330 3.323 4.550 0.010 14 0 "[ . 1 . 2]" 1
3072 1 34 ARG QG 1 38 GLY H 4.100 . 4.100 3.315 2.338 4.107 0.007 11 0 "[ . 1 . 2]" 1
3073 1 34 ARG QG 1 40 GLY H 4.490 . 4.490 3.422 2.342 4.515 0.025 4 0 "[ . 1 . 2]" 1
3074 1 34 ARG QG 1 40 GLY QA 4.010 . 4.010 2.908 1.815 3.970 . 0 0 "[ . 1 . 2]" 1
3075 1 34 ARG QD 1 38 GLY H 4.430 . 4.430 3.460 2.368 4.439 0.009 18 0 "[ . 1 . 2]" 1
3076 1 34 ARG QD 1 40 GLY H 4.310 . 4.310 3.878 2.989 4.331 0.021 8 0 "[ . 1 . 2]" 1
3077 1 35 GLU H 1 35 GLU QG 4.140 . 4.140 2.615 1.889 4.069 . 0 0 "[ . 1 . 2]" 1
3078 1 35 GLU HA 1 36 LEU QD 4.860 . 4.860 4.070 3.706 4.534 . 0 0 "[ . 1 . 2]" 1
3079 1 35 GLU QB 1 36 LEU H 3.680 . 3.680 2.605 2.043 3.001 . 0 0 "[ . 1 . 2]" 1
3080 1 35 GLU QB 1 36 LEU HA 4.390 . 4.390 4.024 3.773 4.313 . 0 0 "[ . 1 . 2]" 1
3081 1 35 GLU QB 1 36 LEU QB 4.520 . 4.520 4.053 3.540 4.470 . 0 0 "[ . 1 . 2]" 1
3082 1 35 GLU QB 1 36 LEU HG 4.770 . 4.770 3.548 2.191 4.772 0.002 15 0 "[ . 1 . 2]" 1
3083 1 35 GLU QB 1 36 LEU QD 2.970 . 2.970 2.419 1.815 2.979 0.009 20 0 "[ . 1 . 2]" 1
3084 1 35 GLU QB 1 37 GLY H 4.770 . 4.770 4.428 3.884 4.773 0.003 20 0 "[ . 1 . 2]" 1
3085 1 35 GLU QB 2 5 TYR HD2 4.090 . 4.090 2.676 2.188 3.000 . 0 0 "[ . 1 . 2]" 1
3086 1 35 GLU QG 1 36 LEU QD 4.930 . 4.930 3.804 2.224 4.622 . 0 0 "[ . 1 . 2]" 1
3087 1 36 LEU H 1 36 LEU QD 3.380 . 3.380 2.671 1.794 3.336 0.006 6 0 "[ . 1 . 2]" 1
3088 1 36 LEU H 1 37 GLY QA 4.500 . 4.500 4.262 4.050 4.383 . 0 0 "[ . 1 . 2]" 1
3089 1 36 LEU HA 1 36 LEU QD 2.940 . 2.940 2.183 2.042 2.556 . 0 0 "[ . 1 . 2]" 1
3090 1 36 LEU HG 2 5 TYR QB 4.900 . 4.900 3.326 2.800 4.119 . 0 0 "[ . 1 . 2]" 1
3091 1 36 LEU QD 1 37 GLY H 4.500 . 4.500 4.011 3.546 4.367 . 0 0 "[ . 1 . 2]" 1
3092 1 36 LEU QD 1 85 ILE MG 3.330 . 3.330 2.260 1.844 2.744 . 0 0 "[ . 1 . 2]" 1
3093 1 36 LEU QD 2 4 LEU H 5.440 . 5.440 4.178 3.818 4.659 . 0 0 "[ . 1 . 2]" 1
3094 1 36 LEU QD 2 4 LEU HA 4.240 . 4.240 4.062 3.548 4.251 0.011 4 0 "[ . 1 . 2]" 1
3095 1 36 LEU QD 2 4 LEU HG 5.430 . 5.430 4.037 3.729 4.553 . 0 0 "[ . 1 . 2]" 1
3096 1 36 LEU QD 2 4 LEU MD1 3.110 . 3.110 2.438 1.889 2.920 . 0 0 "[ . 1 . 2]" 1
3097 1 36 LEU QD 2 5 TYR H 4.090 . 4.090 3.203 2.899 3.701 . 0 0 "[ . 1 . 2]" 1
3098 1 36 LEU QD 2 5 TYR QB 3.420 . 3.420 1.897 1.788 2.319 0.012 20 0 "[ . 1 . 2]" 1
3099 1 36 LEU QD 2 5 TYR HD2 3.580 . 3.580 3.181 2.451 3.586 0.006 10 0 "[ . 1 . 2]" 1
3100 1 37 GLY H 1 38 GLY QA 4.350 . 4.350 4.110 3.459 4.352 0.002 15 0 "[ . 1 . 2]" 1
3101 1 38 GLY QA 1 39 ALA MB 3.930 . 3.930 3.654 3.523 3.747 . 0 0 "[ . 1 . 2]" 1
3102 1 39 ALA H 1 40 GLY QA 4.020 . 4.020 3.909 3.619 4.068 0.048 7 0 "[ . 1 . 2]" 1
3103 1 41 ALA HA 1 42 GLU QB 5.030 . 5.030 4.490 4.288 4.772 . 0 0 "[ . 1 . 2]" 1
3104 1 41 ALA HA 1 42 GLU QG 4.250 . 4.250 3.804 3.055 4.256 0.006 18 0 "[ . 1 . 2]" 1
3105 1 41 ALA MB 1 42 GLU QG 4.050 . 4.050 3.501 2.968 4.054 0.004 9 0 "[ . 1 . 2]" 1
3106 1 42 GLU H 1 42 GLU QB 2.920 . 2.920 2.667 2.485 2.895 . 0 0 "[ . 1 . 2]" 1
3107 1 42 GLU HA 1 42 GLU QG 3.400 . 3.400 3.177 2.434 3.356 . 0 0 "[ . 1 . 2]" 1
3108 1 42 GLU QB 1 42 GLU QG 2.190 . 2.190 2.086 2.076 2.094 . 0 0 "[ . 1 . 2]" 1
3109 1 48 GLN HB2 1 83 VAL QG 3.960 . 3.960 3.097 2.547 3.819 . 0 0 "[ . 1 . 2]" 1
3110 1 48 GLN HB3 1 83 VAL QG 5.030 . 5.030 4.151 3.693 4.708 . 0 0 "[ . 1 . 2]" 1
3111 1 48 GLN QG 1 51 ALA MB 4.590 . 4.590 3.586 3.035 3.850 . 0 0 "[ . 1 . 2]" 1
3112 1 48 GLN QG 1 83 VAL QG 4.680 . 4.680 3.428 2.899 4.167 . 0 0 "[ . 1 . 2]" 1
3113 1 48 GLN QG 2 7 THR MG 3.310 . 3.310 2.601 2.315 3.202 . 0 0 "[ . 1 . 2]" 1
3114 1 49 LEU MD1 1 53 GLY QA 4.420 . 4.420 3.642 3.404 3.796 . 0 0 "[ . 1 . 2]" 1
3115 1 49 LEU MD2 1 53 GLY QA 5.150 . 5.150 4.455 4.055 4.717 . 0 0 "[ . 1 . 2]" 1
3116 1 49 LEU MD2 2 53 GLY QA 5.340 . 5.340 4.034 3.589 4.253 . 0 0 "[ . 1 . 2]" 1
3117 1 50 PHE QB 1 51 ALA H 3.970 . 3.970 2.526 2.356 2.672 . 0 0 "[ . 1 . 2]" 1
3118 1 51 ALA HA 1 99 LEU QD 4.320 . 4.320 4.112 3.524 4.337 0.017 12 0 "[ . 1 . 2]" 1
3119 1 52 ALA MB 1 53 GLY QA 4.280 . 4.280 3.526 3.473 3.638 . 0 0 "[ . 1 . 2]" 1
3120 1 53 GLY QA 2 49 LEU MD2 5.340 . 5.340 4.096 3.763 4.320 . 0 0 "[ . 1 . 2]" 1
3121 1 54 TYR HE2 1 99 LEU QD 3.890 . 3.890 2.934 1.897 3.891 0.001 2 0 "[ . 1 . 2]" 1
3122 1 54 TYR HD2 1 99 LEU QD 4.170 . 4.170 3.327 2.782 3.971 . 0 0 "[ . 1 . 2]" 1
3123 1 55 SER H 1 99 LEU QD 4.640 . 4.640 3.987 3.585 4.398 . 0 0 "[ . 1 . 2]" 1
3124 1 55 SER HA 1 99 LEU QD 4.590 . 4.590 3.089 2.433 3.689 . 0 0 "[ . 1 . 2]" 1
3125 1 56 ALA H 2 11 SER QB 3.830 . 3.830 3.292 2.902 3.587 . 0 0 "[ . 1 . 2]" 1
3126 1 56 ALA MB 2 11 SER QB 3.560 . 3.560 2.576 1.904 3.506 . 0 0 "[ . 1 . 2]" 1
3127 1 62 MET HA 1 73 LEU QD 3.980 . 3.980 3.652 3.222 3.988 0.008 16 0 "[ . 1 . 2]" 1
3128 1 62 MET ME 1 73 LEU QD 3.210 . 3.210 2.286 1.817 2.981 . 0 0 "[ . 1 . 2]" 1
3129 1 63 LYS H 1 73 LEU QD 4.440 . 4.440 3.712 3.299 4.181 . 0 0 "[ . 1 . 2]" 1
3130 1 65 VAL HA 1 68 GLN QB 4.370 . 4.370 4.127 3.964 4.295 . 0 0 "[ . 1 . 2]" 1
3131 1 66 ALA H 1 73 LEU QD 4.200 . 4.200 3.487 3.257 3.693 . 0 0 "[ . 1 . 2]" 1
3132 1 66 ALA HA 1 73 LEU QD 4.490 . 4.490 3.999 3.747 4.190 . 0 0 "[ . 1 . 2]" 1
3133 1 66 ALA MB 1 73 LEU QD 2.980 . 2.980 2.188 1.922 2.365 . 0 0 "[ . 1 . 2]" 1
3134 1 67 GLY H 1 73 LEU QD 5.230 . 5.230 4.974 4.704 5.238 0.008 8 0 "[ . 1 . 2]" 1
3135 1 68 GLN H 1 68 GLN QB 3.680 . 3.680 2.847 2.797 2.888 . 0 0 "[ . 1 . 2]" 1
3136 1 70 LYS H 1 70 LYS QG 3.760 . 3.760 3.477 3.179 3.773 0.013 3 0 "[ . 1 . 2]" 1
3137 1 70 LYS H 1 70 LYS QE 4.830 . 4.830 4.124 3.790 4.404 . 0 0 "[ . 1 . 2]" 1
3138 1 70 LYS HA 1 70 LYS QG 3.710 . 3.710 2.958 2.533 3.313 . 0 0 "[ . 1 . 2]" 1
3139 1 70 LYS QB 1 70 LYS HD2 3.710 . 3.710 2.871 2.609 3.206 . 0 0 "[ . 1 . 2]" 1
3140 1 70 LYS QB 1 70 LYS HD3 3.590 . 3.590 2.922 2.489 3.240 . 0 0 "[ . 1 . 2]" 1
3141 1 70 LYS QE 1 70 LYS QG 2.360 . 2.360 2.280 2.130 2.365 0.005 7 0 "[ . 1 . 2]" 1
3142 1 70 LYS QG 1 71 GLN H 5.190 . 5.190 4.815 4.557 5.017 . 0 0 "[ . 1 . 2]" 1
3143 1 73 LEU H 1 73 LEU QB 3.340 . 3.340 2.723 2.433 3.130 . 0 0 "[ . 1 . 2]" 1
3144 1 73 LEU H 1 73 LEU QD 3.980 . 3.980 2.809 1.799 3.457 0.001 3 0 "[ . 1 . 2]" 1
3145 1 73 LEU HA 1 73 LEU QD 3.970 . 3.970 2.572 2.002 3.380 . 0 0 "[ . 1 . 2]" 1
3146 1 73 LEU QB 1 73 LEU QD 2.810 . 2.810 1.945 1.931 1.954 . 0 0 "[ . 1 . 2]" 1
3147 1 74 PRO HB3 1 103 LEU QD 4.790 . 4.790 4.544 3.542 4.797 0.007 6 0 "[ . 1 . 2]" 1
3148 1 77 THR H 1 103 LEU QD 4.510 . 4.510 4.148 3.981 4.517 0.007 13 0 "[ . 1 . 2]" 1
3149 1 77 THR HA 1 103 LEU QD 4.000 . 4.000 3.554 3.360 3.805 . 0 0 "[ . 1 . 2]" 1
3150 1 77 THR HB 1 103 LEU QD 4.080 . 4.080 1.860 1.781 2.157 0.019 15 0 "[ . 1 . 2]" 1
3151 1 77 THR MG 1 103 LEU QD 3.130 . 3.130 2.603 2.420 2.763 . 0 0 "[ . 1 . 2]" 1
3152 1 78 THR H 1 103 LEU QD 4.410 . 4.410 4.181 3.560 4.410 . 12 0 "[ . 1 . 2]" 1
3153 1 79 VAL MG1 1 99 LEU QD 3.310 . 3.310 2.622 2.052 3.081 . 0 0 "[ . 1 . 2]" 1
3154 1 79 VAL MG2 1 99 LEU QD 5.440 . 5.440 4.268 3.693 4.755 . 0 0 "[ . 1 . 2]" 1
3155 1 80 THR H 1 100 ARG QB 4.140 . 4.140 2.590 2.350 2.918 . 0 0 "[ . 1 . 2]" 1
3156 1 80 THR H 1 100 ARG QG 5.230 . 5.230 4.181 3.493 4.915 . 0 0 "[ . 1 . 2]" 1
3157 1 80 THR HB 1 100 ARG QB 3.970 . 3.970 2.022 1.798 2.287 0.002 15 0 "[ . 1 . 2]" 1
3158 1 81 ALA H 1 99 LEU QD 4.530 . 4.530 4.095 3.712 4.522 . 0 0 "[ . 1 . 2]" 1
3159 1 81 ALA HA 1 99 LEU QD 3.610 . 3.610 2.312 2.062 2.638 . 0 0 "[ . 1 . 2]" 1
3160 1 81 ALA MB 1 99 LEU QD 2.990 . 2.990 2.254 2.040 2.471 . 0 0 "[ . 1 . 2]" 1
3161 1 82 GLU H 1 82 GLU QG 4.790 . 4.790 4.049 3.999 4.096 . 0 0 "[ . 1 . 2]" 1
3162 1 82 GLU H 1 97 VAL QG 3.980 . 3.980 3.721 3.064 3.996 0.016 19 0 "[ . 1 . 2]" 1
3163 1 82 GLU H 1 99 LEU QD 3.880 . 3.880 3.768 3.310 3.892 0.012 11 0 "[ . 1 . 2]" 1
3164 1 82 GLU HA 1 82 GLU QG 3.650 . 3.650 2.409 2.314 2.498 . 0 0 "[ . 1 . 2]" 1
3165 1 82 GLU QG 1 83 VAL H 3.390 . 3.390 3.243 3.110 3.308 . 0 0 "[ . 1 . 2]" 1
3166 1 82 GLU QG 2 6 LYS HB2 5.200 . 5.200 4.688 4.533 5.053 . 0 0 "[ . 1 . 2]" 1
3167 1 82 GLU QG 2 6 LYS HB3 5.210 . 5.210 4.643 4.337 5.085 . 0 0 "[ . 1 . 2]" 1
3168 1 82 GLU QG 2 6 LYS HG3 3.680 . 3.680 2.722 2.466 3.066 . 0 0 "[ . 1 . 2]" 1
3169 1 82 GLU QG 2 6 LYS HE2 4.460 . 4.460 3.268 2.804 3.808 . 0 0 "[ . 1 . 2]" 1
3170 1 82 GLU QG 2 8 ALA H 5.010 . 5.010 4.082 3.734 4.630 . 0 0 "[ . 1 . 2]" 1
3171 1 82 GLU QG 2 8 ALA MB 3.640 . 3.640 2.088 1.874 2.333 . 0 0 "[ . 1 . 2]" 1
3172 1 83 VAL H 1 83 VAL QG 3.720 . 3.720 1.990 1.904 2.396 . 0 0 "[ . 1 . 2]" 1
3173 1 83 VAL QG 1 84 GLY H 4.210 . 4.210 3.006 2.338 3.450 . 0 0 "[ . 1 . 2]" 1
3174 1 83 VAL QG 1 96 ASP H 5.400 . 5.400 4.416 3.480 5.152 . 0 0 "[ . 1 . 2]" 1
3175 1 83 VAL QG 2 6 LYS HA 4.280 . 4.280 3.918 3.666 4.285 0.005 17 0 "[ . 1 . 2]" 1
3176 1 83 VAL QG 2 7 THR H 4.130 . 4.130 2.973 2.687 3.905 . 0 0 "[ . 1 . 2]" 1
3177 1 85 ILE MG 2 5 TYR QB 3.330 . 3.330 2.083 1.874 2.331 . 0 0 "[ . 1 . 2]" 1
3178 1 85 ILE QG 1 86 GLY H 3.750 . 3.750 2.531 2.305 2.601 . 0 0 "[ . 1 . 2]" 1
3179 1 85 ILE QG 1 93 PHE QD 4.290 . 4.290 3.709 3.504 4.077 . 0 0 "[ . 1 . 2]" 1
3180 1 85 ILE MD 2 5 TYR QB 4.290 . 4.290 3.751 3.549 3.911 . 0 0 "[ . 1 . 2]" 1
3181 1 88 ASN H 1 88 ASN QB 3.650 . 3.650 2.381 2.260 2.804 . 0 0 "[ . 1 . 2]" 1
3182 1 88 ASN HA 1 89 GLU QG 5.020 . 5.020 4.006 3.784 4.268 . 0 0 "[ . 1 . 2]" 1
3183 1 88 ASN QB 1 89 GLU H 4.080 . 4.080 3.316 2.218 3.647 . 0 0 "[ . 1 . 2]" 1
3184 1 88 ASN QB 1 89 GLU HA 4.940 . 4.940 4.883 4.539 4.956 0.016 7 0 "[ . 1 . 2]" 1
3185 1 88 ASN QB 1 90 GLU H 3.670 . 3.670 2.955 2.640 3.080 . 0 0 "[ . 1 . 2]" 1
3186 1 88 ASN QB 1 94 ALA MB 3.170 . 3.170 1.924 1.795 2.307 0.005 5 0 "[ . 1 . 2]" 1
3187 1 89 GLU H 1 89 GLU QG 4.190 . 4.190 1.995 1.852 2.169 . 0 0 "[ . 1 . 2]" 1
3188 1 89 GLU HA 1 89 GLU QG 3.680 . 3.680 3.346 3.336 3.359 . 0 0 "[ . 1 . 2]" 1
3189 1 89 GLU QG 1 90 GLU H 2.810 . 2.810 2.632 2.392 2.798 . 0 0 "[ . 1 . 2]" 1
3190 1 96 ASP H 1 97 VAL QG 5.440 . 5.440 3.970 3.336 4.774 . 0 0 "[ . 1 . 2]" 1
3191 1 97 VAL H 1 97 VAL QG 3.940 . 3.940 2.465 1.998 2.707 . 0 0 "[ . 1 . 2]" 1
3192 1 97 VAL QG 1 98 GLU H 3.560 . 3.560 2.955 2.459 3.097 . 0 0 "[ . 1 . 2]" 1
3193 1 97 VAL QG 1 98 GLU HA 3.980 . 3.980 3.807 3.520 3.982 0.002 17 0 "[ . 1 . 2]" 1
3194 1 97 VAL QG 1 99 LEU QD 3.450 . 3.450 2.625 2.195 3.255 . 0 0 "[ . 1 . 2]" 1
3195 1 98 GLU HA 1 135 ARG QB 3.600 . 3.600 2.237 1.824 2.814 . 0 0 "[ . 1 . 2]" 1
3196 1 99 LEU H 1 99 LEU QD 3.850 . 3.850 3.554 3.322 3.819 . 0 0 "[ . 1 . 2]" 1
3197 1 99 LEU H 1 135 ARG QB 3.970 . 3.970 3.621 3.257 3.974 0.004 4 0 "[ . 1 . 2]" 1
3198 1 99 LEU HA 1 99 LEU QD 3.330 . 3.330 1.964 1.900 2.057 . 0 0 "[ . 1 . 2]" 1
3199 1 99 LEU QB 1 137 VAL H 4.720 . 4.720 3.560 3.311 3.775 . 0 0 "[ . 1 . 2]" 1
3200 1 99 LEU QB 1 137 VAL MG1 4.570 . 4.570 3.869 3.698 4.087 . 0 0 "[ . 1 . 2]" 1
3201 1 99 LEU QD 1 100 ARG H 3.770 . 3.770 3.315 2.702 3.665 . 0 0 "[ . 1 . 2]" 1
3202 1 99 LEU QD 1 134 VAL HB 5.230 . 5.230 4.453 3.963 5.098 . 0 0 "[ . 1 . 2]" 1
3203 1 99 LEU QD 1 134 VAL MG1 3.190 . 3.190 2.388 1.981 2.963 . 0 0 "[ . 1 . 2]" 1
3204 1 99 LEU QD 1 136 LEU HG 4.790 . 4.790 4.181 3.629 4.645 . 0 0 "[ . 1 . 2]" 1
3205 1 99 LEU QD 1 136 LEU MD1 4.480 . 4.480 4.134 3.933 4.382 . 0 0 "[ . 1 . 2]" 1
3206 1 99 LEU QD 1 136 LEU MD2 2.970 . 2.970 2.290 2.110 2.549 . 0 0 "[ . 1 . 2]" 1
3207 1 100 ARG H 1 100 ARG QG 4.190 . 4.190 3.341 2.324 4.039 . 0 0 "[ . 1 . 2]" 1
3208 1 100 ARG H 1 100 ARG QD 5.340 . 5.340 4.276 3.910 4.868 . 0 0 "[ . 1 . 2]" 1
3209 1 100 ARG HA 1 100 ARG QG 3.530 . 3.530 2.436 2.336 2.540 . 0 0 "[ . 1 . 2]" 1
3210 1 100 ARG HA 1 100 ARG QD 4.130 . 4.130 4.023 3.958 4.159 0.029 11 0 "[ . 1 . 2]" 1
3211 1 100 ARG HA 1 101 VAL QG 4.400 . 4.400 3.490 3.403 3.579 . 0 0 "[ . 1 . 2]" 1
3212 1 100 ARG QB 1 100 ARG QD 3.120 . 3.120 2.147 2.072 2.329 . 0 0 "[ . 1 . 2]" 1
3213 1 100 ARG QB 1 101 VAL H 4.290 . 4.290 3.642 3.105 3.953 . 0 0 "[ . 1 . 2]" 1
3214 1 100 ARG QG 1 101 VAL H 4.280 . 4.280 3.675 3.015 4.300 0.020 17 0 "[ . 1 . 2]" 1
3215 1 100 ARG QG 1 137 VAL H 5.340 . 5.340 4.654 4.146 5.338 . 0 0 "[ . 1 . 2]" 1
3216 1 100 ARG QG 1 137 VAL HB 5.020 . 5.020 4.297 3.855 5.025 0.005 20 0 "[ . 1 . 2]" 1
3217 1 100 ARG QG 1 137 VAL MG1 3.290 . 3.290 2.419 1.803 3.220 . 0 0 "[ . 1 . 2]" 1
3218 1 100 ARG QG 1 137 VAL MG2 2.960 . 2.960 2.102 1.866 2.457 . 0 0 "[ . 1 . 2]" 1
3219 1 100 ARG QD 1 137 VAL MG1 4.430 . 4.430 3.712 3.468 4.260 . 0 0 "[ . 1 . 2]" 1
3220 1 100 ARG QD 1 137 VAL MG2 3.770 . 3.770 3.410 3.197 3.611 . 0 0 "[ . 1 . 2]" 1
3221 1 101 VAL H 1 101 VAL QG 3.670 . 3.670 2.442 2.319 2.539 . 0 0 "[ . 1 . 2]" 1
3222 1 101 VAL H 1 138 VAL QG 4.220 . 4.220 3.947 3.256 4.144 . 0 0 "[ . 1 . 2]" 1
3223 1 101 VAL HA 1 101 VAL QG 3.060 . 3.060 2.146 2.139 2.153 . 0 0 "[ . 1 . 2]" 1
3224 1 101 VAL QG 1 103 LEU H 4.170 . 4.170 3.530 3.296 3.741 . 0 0 "[ . 1 . 2]" 1
3225 1 101 VAL QG 1 139 ALA H 3.850 . 3.850 3.831 3.731 3.864 0.014 11 0 "[ . 1 . 2]" 1
3226 1 103 LEU H 1 103 LEU QB 2.900 . 2.900 2.416 2.307 2.489 . 0 0 "[ . 1 . 2]" 1
3227 1 103 LEU H 1 103 LEU QD 4.250 . 4.250 3.741 2.503 3.931 . 0 0 "[ . 1 . 2]" 1
3228 1 103 LEU QB 1 104 PRO HD2 4.370 . 4.370 3.682 2.831 3.903 . 0 0 "[ . 1 . 2]" 1
3229 1 103 LEU QB 1 104 PRO HD3 4.830 . 4.830 4.290 3.892 4.461 . 0 0 "[ . 1 . 2]" 1
3230 1 103 LEU QD 1 104 PRO HD2 3.930 . 3.930 1.950 1.791 2.662 0.009 12 0 "[ . 1 . 2]" 1
3231 1 103 LEU QD 1 104 PRO HD3 4.410 . 4.410 3.126 2.948 3.743 . 0 0 "[ . 1 . 2]" 1
3232 1 108 ALA HA 1 138 VAL QG 4.180 . 4.180 2.640 2.302 3.651 . 0 0 "[ . 1 . 2]" 1
3233 1 109 ALA H 1 112 LYS QG 5.340 . 5.340 4.683 4.373 5.185 . 0 0 "[ . 1 . 2]" 1
3234 1 109 ALA HA 1 112 LYS QG 4.150 . 4.150 3.175 2.621 3.736 . 0 0 "[ . 1 . 2]" 1
3235 1 111 ALA MB 1 138 VAL QG 2.510 . 2.510 2.114 1.793 2.286 0.007 19 0 "[ . 1 . 2]" 1
3236 1 112 LYS H 1 112 LYS QG 3.480 . 3.480 2.370 2.028 2.644 . 0 0 "[ . 1 . 2]" 1
3237 1 112 LYS H 1 112 LYS QD 4.330 . 4.330 3.832 3.563 4.255 . 0 0 "[ . 1 . 2]" 1
3238 1 112 LYS H 1 138 VAL QG 3.640 . 3.640 2.854 2.470 3.479 . 0 0 "[ . 1 . 2]" 1
3239 1 112 LYS HA 1 112 LYS QG 3.310 . 3.310 2.530 2.312 2.844 . 0 0 "[ . 1 . 2]" 1
3240 1 112 LYS HA 1 112 LYS QD 4.170 . 4.170 3.253 1.989 4.176 0.006 3 0 "[ . 1 . 2]" 1
3241 1 112 LYS HA 1 138 VAL QG 4.000 . 4.000 2.041 1.861 2.256 . 0 0 "[ . 1 . 2]" 1
3242 1 112 LYS QE 1 112 LYS QG 3.270 . 3.270 2.347 2.148 2.816 . 0 0 "[ . 1 . 2]" 1
3243 1 112 LYS QG 1 113 THR H 4.730 . 4.730 4.214 4.051 4.410 . 0 0 "[ . 1 . 2]" 1
3244 1 112 LYS QG 1 138 VAL QG 3.320 . 3.320 2.332 1.855 2.823 . 0 0 "[ . 1 . 2]" 1
3245 1 112 LYS QD 1 113 THR H 5.140 . 5.140 4.868 4.568 5.149 0.009 17 0 "[ . 1 . 2]" 1
3246 1 113 THR H 1 138 VAL QG 5.110 . 5.110 4.493 4.283 4.776 . 0 0 "[ . 1 . 2]" 1
3247 1 113 THR MG 1 117 ARG QD 2.940 . 2.940 2.895 2.269 2.956 0.016 9 0 "[ . 1 . 2]" 1
3248 1 116 ASP H 1 117 ARG QG 3.930 . 3.930 3.842 3.651 3.932 0.002 13 0 "[ . 1 . 2]" 1
3249 1 116 ASP H 1 117 ARG QD 5.340 . 5.340 5.242 4.997 5.315 . 0 0 "[ . 1 . 2]" 1
3250 1 117 ARG H 1 117 ARG QG 2.990 . 2.990 1.918 1.796 2.062 0.004 17 0 "[ . 1 . 2]" 1
3251 1 117 ARG H 1 117 ARG QD 3.600 . 3.600 3.507 3.432 3.596 . 0 0 "[ . 1 . 2]" 1
3252 1 117 ARG HB2 1 117 ARG QD 3.060 . 3.060 2.960 2.856 3.030 . 0 0 "[ . 1 . 2]" 1
3253 1 117 ARG QD 1 117 ARG QG 2.360 . 2.360 2.008 1.978 2.022 . 0 0 "[ . 1 . 2]" 1
3254 1 117 ARG QG 1 118 ALA H 3.240 . 3.240 2.150 2.088 2.233 . 0 0 "[ . 1 . 2]" 1
3255 1 117 ARG QG 1 118 ALA HA 5.300 . 5.300 3.478 3.362 3.851 . 0 0 "[ . 1 . 2]" 1
3256 1 117 ARG QG 1 118 ALA MB 3.790 . 3.790 3.149 3.064 3.317 . 0 0 "[ . 1 . 2]" 1
3257 1 117 ARG QD 1 118 ALA H 4.170 . 4.170 4.086 4.053 4.146 . 0 0 "[ . 1 . 2]" 1
3258 1 118 ALA HA 1 121 VAL QG 3.600 . 3.600 2.226 1.794 2.959 0.006 13 0 "[ . 1 . 2]" 1
3259 1 119 HIS QB 1 136 LEU MD2 3.970 . 3.970 3.271 2.964 3.827 . 0 0 "[ . 1 . 2]" 1
3260 1 120 HIS H 1 121 VAL QG 3.770 . 3.770 3.273 3.032 3.654 . 0 0 "[ . 1 . 2]" 1
3261 1 120 HIS QB 1 120 HIS HD2 3.400 . 3.400 3.012 2.643 3.276 . 0 0 "[ . 1 . 2]" 1
3262 1 120 HIS QB 1 121 VAL H 4.020 . 4.020 2.636 2.362 2.848 . 0 0 "[ . 1 . 2]" 1
3263 1 120 HIS QB 1 121 VAL QG 3.840 . 3.840 2.762 2.392 3.071 . 0 0 "[ . 1 . 2]" 1
3264 1 120 HIS HB2 1 121 VAL MG2 6.190 . 6.190 4.944 3.772 5.537 . 0 0 "[ . 1 . 2]" 1
3265 1 121 VAL H 1 121 VAL QG 3.170 . 3.170 1.936 1.880 2.108 . 0 0 "[ . 1 . 2]" 1
3266 1 126 ASN H 1 126 ASN QB 3.690 . 3.690 2.415 2.250 2.619 . 0 0 "[ . 1 . 2]" 1
3267 1 126 ASN QB 1 127 ALA H 3.740 . 3.740 2.865 2.454 3.536 . 0 0 "[ . 1 . 2]" 1
3268 1 127 ALA HA 1 131 ASN QB 3.660 . 3.660 2.476 2.002 2.865 . 0 0 "[ . 1 . 2]" 1
3269 1 127 ALA HA 1 132 VAL QG 4.710 . 4.710 4.246 3.050 4.720 0.010 18 0 "[ . 1 . 2]" 1
3270 1 128 THR H 1 129 ARG QG 4.300 . 4.300 3.138 2.924 3.362 . 0 0 "[ . 1 . 2]" 1
3271 1 128 THR H 1 131 ASN QB 4.690 . 4.690 4.581 4.331 4.696 0.006 12 0 "[ . 1 . 2]" 1
3272 1 128 THR MG 1 129 ARG QD 4.340 . 4.340 3.656 3.125 4.060 . 0 0 "[ . 1 . 2]" 1
3273 1 129 ARG H 1 129 ARG QG 3.690 . 3.690 2.162 1.996 2.316 . 0 0 "[ . 1 . 2]" 1
3274 1 129 ARG H 1 129 ARG QD 4.150 . 4.150 4.047 3.760 4.176 0.026 17 0 "[ . 1 . 2]" 1
3275 1 129 ARG HA 1 129 ARG QG 3.670 . 3.670 3.356 3.315 3.385 . 0 0 "[ . 1 . 2]" 1
3276 1 129 ARG HA 1 129 ARG QD 4.640 . 4.640 4.454 4.232 4.573 . 0 0 "[ . 1 . 2]" 1
3277 1 129 ARG HB2 1 129 ARG QD 3.590 . 3.590 2.717 2.281 3.104 . 0 0 "[ . 1 . 2]" 1
3278 1 129 ARG HB3 1 129 ARG QD 3.240 . 3.240 2.517 2.358 3.112 . 0 0 "[ . 1 . 2]" 1
3279 1 129 ARG HB3 1 130 ASN QD 5.340 . 5.340 5.020 4.466 5.357 0.017 6 0 "[ . 1 . 2]" 1
3280 1 129 ARG QG 1 130 ASN H 3.820 . 3.820 1.921 1.790 2.070 0.010 5 0 "[ . 1 . 2]" 1
3281 1 129 ARG QG 1 130 ASN HA 4.260 . 4.260 3.507 3.115 3.820 . 0 0 "[ . 1 . 2]" 1
3282 1 129 ARG QG 1 130 ASN QD 3.690 . 3.690 2.469 1.896 2.883 . 0 0 "[ . 1 . 2]" 1
3283 1 129 ARG QD 1 130 ASN H 4.050 . 4.050 3.909 3.626 4.063 0.013 18 0 "[ . 1 . 2]" 1
3284 1 130 ASN H 1 130 ASN QD 4.770 . 4.770 2.917 2.140 3.689 . 0 0 "[ . 1 . 2]" 1
3285 1 130 ASN HA 1 130 ASN QD 3.980 . 3.980 3.350 1.832 4.003 0.023 8 0 "[ . 1 . 2]" 1
3286 1 130 ASN QB 1 130 ASN QD 3.070 . 3.070 2.223 2.072 2.713 . 0 0 "[ . 1 . 2]" 1
3287 1 130 ASN QB 1 132 VAL H 5.340 . 5.340 4.759 4.448 5.093 . 0 0 "[ . 1 . 2]" 1
3288 1 131 ASN H 1 131 ASN QB 3.480 . 3.480 2.320 2.228 2.456 . 0 0 "[ . 1 . 2]" 1
3289 1 131 ASN QB 1 132 VAL H 3.540 . 3.540 2.640 2.472 3.047 . 0 0 "[ . 1 . 2]" 1
3290 1 131 ASN QB 1 132 VAL QG 3.930 . 3.930 2.449 2.036 2.769 . 0 0 "[ . 1 . 2]" 1
3291 1 132 VAL H 1 132 VAL QG 3.190 . 3.190 2.450 2.195 2.726 . 0 0 "[ . 1 . 2]" 1
3292 1 132 VAL HA 1 132 VAL QG 3.100 . 3.100 2.162 2.147 2.300 . 0 0 "[ . 1 . 2]" 1
3293 1 132 VAL QG 1 133 ALA MB 4.080 . 4.080 3.562 3.164 4.100 0.020 3 0 "[ . 1 . 2]" 1
3294 1 134 VAL HA 1 135 ARG QB 4.910 . 4.910 4.279 3.938 4.684 . 0 0 "[ . 1 . 2]" 1
3295 1 135 ARG H 1 135 ARG QB 3.560 . 3.560 2.434 2.164 2.782 . 0 0 "[ . 1 . 2]" 1
3296 1 135 ARG HA 1 135 ARG QB 2.620 . 2.620 2.354 2.243 2.521 . 0 0 "[ . 1 . 2]" 1
3297 1 135 ARG QB 1 135 ARG QD 3.260 . 3.260 2.381 2.092 2.838 . 0 0 "[ . 1 . 2]" 1
3298 1 135 ARG QB 1 136 LEU H 4.430 . 4.430 3.705 3.201 4.008 . 0 0 "[ . 1 . 2]" 1
3299 1 137 VAL H 1 138 VAL QG 4.340 . 4.340 4.212 3.696 4.342 0.002 13 0 "[ . 1 . 2]" 1
3300 1 137 VAL HA 1 138 VAL QG 3.580 . 3.580 3.301 3.218 3.357 . 0 0 "[ . 1 . 2]" 1
3301 1 138 VAL H 1 138 VAL QG 2.820 . 2.820 2.022 1.934 2.285 . 0 0 "[ . 1 . 2]" 1
3302 1 138 VAL HA 1 138 VAL QG 2.870 . 2.870 2.379 2.106 2.447 . 0 0 "[ . 1 . 2]" 1
3303 1 138 VAL QG 1 139 ALA H 3.220 . 3.220 3.210 2.403 3.265 0.045 17 0 "[ . 1 . 2]" 1
3304 1 138 VAL QG 1 139 ALA HA 4.210 . 4.210 3.644 3.450 4.212 0.002 17 0 "[ . 1 . 2]" 1
3305 2 1 MET HA 2 2 ASN QB 4.530 . 4.530 4.249 4.109 4.440 . 0 0 "[ . 1 . 2]" 1
3306 2 2 ASN QB 2 2 ASN HD22 3.310 . 3.310 3.221 3.189 3.230 . 0 0 "[ . 1 . 2]" 1
3307 2 2 ASN QB 2 3 ILE H 4.170 . 4.170 4.037 4.005 4.053 . 0 0 "[ . 1 . 2]" 1
3308 2 8 ALA H 2 22 HIS QB 4.670 . 4.670 3.781 3.338 4.585 . 0 0 "[ . 1 . 2]" 1
3309 2 8 ALA MB 2 22 HIS QB 3.820 . 3.820 2.384 1.945 3.212 . 0 0 "[ . 1 . 2]" 1
3310 2 9 ALA MB 2 21 SER QB 3.840 . 3.840 3.221 2.852 3.562 . 0 0 "[ . 1 . 2]" 1
3311 2 10 THR H 2 11 SER QB 5.340 . 5.340 5.318 5.069 5.370 0.030 3 0 "[ . 1 . 2]" 1
3312 2 11 SER QB 2 12 THR H 4.160 . 4.160 3.461 3.131 3.918 . 0 0 "[ . 1 . 2]" 1
3313 2 11 SER QB 2 19 ALA MB 4.700 . 4.700 3.092 2.534 3.737 . 0 0 "[ . 1 . 2]" 1
3314 2 12 THR HB 2 13 GLY QA 4.420 . 4.420 4.419 4.359 4.438 0.018 16 0 "[ . 1 . 2]" 1
3315 2 12 THR HB 2 18 ARG QB 4.660 . 4.660 2.373 1.990 2.891 . 0 0 "[ . 1 . 2]" 1
3316 2 13 GLY QA 2 17 GLY QA 4.520 . 4.520 2.758 2.114 3.421 . 0 0 "[ . 1 . 2]" 1
3317 2 13 GLY QA 2 18 ARG H 4.470 . 4.470 3.533 3.103 3.882 . 0 0 "[ . 1 . 2]" 1
3318 2 14 GLY H 2 18 ARG QG 4.680 . 4.680 4.614 4.130 4.697 0.017 5 0 "[ . 1 . 2]" 1
3319 2 16 ASP H 2 17 GLY QA 4.370 . 4.370 3.861 3.693 4.010 . 0 0 "[ . 1 . 2]" 1
3320 2 16 ASP H 2 29 LYS QG 4.110 . 4.110 3.565 3.167 3.915 . 0 0 "[ . 1 . 2]" 1
3321 2 16 ASP HA 2 17 GLY QA 4.610 . 4.610 4.189 4.165 4.215 . 0 0 "[ . 1 . 2]" 1
3322 2 16 ASP QB 2 17 GLY H 3.280 . 3.280 2.373 2.284 2.418 . 0 0 "[ . 1 . 2]" 1
3323 2 16 ASP QB 2 29 LYS QG 4.910 . 4.910 4.249 3.776 4.616 . 0 0 "[ . 1 . 2]" 1
3324 2 16 ASP QB 2 31 SER HA 4.500 . 4.500 1.835 1.779 2.030 0.021 14 0 "[ . 1 . 2]" 1
3325 2 17 GLY H 2 29 LYS QG 3.650 . 3.650 3.113 2.861 3.328 . 0 0 "[ . 1 . 2]" 1
3326 2 17 GLY QA 2 30 LEU MD1 4.850 . 4.850 3.422 3.007 3.688 . 0 0 "[ . 1 . 2]" 1
3327 2 17 GLY QA 2 30 LEU MD2 3.590 . 3.590 1.927 1.799 2.028 0.001 11 0 "[ . 1 . 2]" 1
3328 2 18 ARG H 2 18 ARG QB 3.650 . 3.650 2.596 2.438 2.709 . 0 0 "[ . 1 . 2]" 1
3329 2 18 ARG H 2 18 ARG QG 4.570 . 4.570 4.144 3.812 4.351 . 0 0 "[ . 1 . 2]" 1
3330 2 18 ARG HA 2 18 ARG QD 4.400 . 4.400 3.438 2.222 4.303 . 0 0 "[ . 1 . 2]" 1
3331 2 18 ARG HA 2 29 LYS QG 4.610 . 4.610 3.512 3.273 3.740 . 0 0 "[ . 1 . 2]" 1
3332 2 18 ARG QB 2 18 ARG QD 3.200 . 3.200 2.342 2.119 2.765 . 0 0 "[ . 1 . 2]" 1
3333 2 18 ARG QB 2 19 ALA H 3.990 . 3.990 3.707 3.437 3.982 . 0 0 "[ . 1 . 2]" 1
3334 2 18 ARG QB 2 29 LYS HA 4.640 . 4.640 3.621 3.218 4.125 . 0 0 "[ . 1 . 2]" 1
3335 2 18 ARG QG 2 19 ALA H 3.770 . 3.770 2.835 2.154 3.773 0.003 10 0 "[ . 1 . 2]" 1
3336 2 18 ARG QG 2 29 LYS HA 4.230 . 4.230 3.318 2.643 4.247 0.017 16 0 "[ . 1 . 2]" 1
3337 2 18 ARG QD 2 19 ALA H 4.250 . 4.250 3.590 2.149 4.263 0.013 9 0 "[ . 1 . 2]" 1
3338 2 18 ARG QD 2 29 LYS HB2 5.270 . 5.270 3.850 2.073 5.212 . 0 0 "[ . 1 . 2]" 1
3339 2 20 THR HA 2 21 SER QB 4.280 . 4.280 4.174 4.129 4.221 . 0 0 "[ . 1 . 2]" 1
3340 2 20 THR MG 2 27 ASP QB 2.990 . 2.990 2.081 1.905 2.413 . 0 0 "[ . 1 . 2]" 1
3341 2 21 SER QB 2 22 HIS H 4.390 . 4.390 3.824 3.765 3.871 . 0 0 "[ . 1 . 2]" 1
3342 2 21 SER QB 2 25 LYS H 4.170 . 4.170 2.810 2.498 3.005 . 0 0 "[ . 1 . 2]" 1
3343 2 21 SER QB 2 26 LEU H 4.380 . 4.380 1.819 1.787 2.051 0.013 16 0 "[ . 1 . 2]" 1
3344 2 22 HIS H 2 22 HIS QB 3.640 . 3.640 2.181 2.042 2.229 . 0 0 "[ . 1 . 2]" 1
3345 2 22 HIS QB 2 23 ASP H 3.810 . 3.810 2.971 2.637 3.501 . 0 0 "[ . 1 . 2]" 1
3346 2 23 ASP H 2 23 ASP QB 3.420 . 3.420 2.476 2.275 2.850 . 0 0 "[ . 1 . 2]" 1
3347 2 23 ASP QB 2 24 GLN H 3.990 . 3.990 3.722 3.463 3.973 . 0 0 "[ . 1 . 2]" 1
3348 2 23 ASP QB 2 25 LYS QE 4.160 . 4.160 2.834 1.794 3.965 0.006 8 0 "[ . 1 . 2]" 1
3349 2 24 GLN H 2 25 LYS QG 4.790 . 4.790 4.140 3.798 4.802 0.012 11 0 "[ . 1 . 2]" 1
3350 2 24 GLN H 2 25 LYS QE 5.340 . 5.340 5.230 4.684 5.362 0.022 20 0 "[ . 1 . 2]" 1
3351 2 25 LYS H 2 25 LYS QG 3.680 . 3.680 2.469 2.141 3.139 . 0 0 "[ . 1 . 2]" 1
3352 2 25 LYS H 2 25 LYS QE 4.280 . 4.280 3.925 3.385 4.290 0.010 13 0 "[ . 1 . 2]" 1
3353 2 25 LYS HA 2 25 LYS QG 3.710 . 3.710 2.736 2.205 3.345 . 0 0 "[ . 1 . 2]" 1
3354 2 25 LYS HA 2 25 LYS QE 4.560 . 4.560 3.763 1.793 4.591 0.031 11 0 "[ . 1 . 2]" 1
3355 2 25 LYS QE 2 25 LYS QG 2.950 . 2.950 2.288 2.090 2.504 . 0 0 "[ . 1 . 2]" 1
3356 2 26 LEU HA 2 27 ASP QB 4.790 . 4.790 4.100 3.934 4.274 . 0 0 "[ . 1 . 2]" 1
3357 2 29 LYS H 2 29 LYS QG 4.200 . 4.200 3.846 3.624 4.163 . 0 0 "[ . 1 . 2]" 1
3358 2 29 LYS QD 2 29 LYS QG 2.310 . 2.310 2.024 1.983 2.096 . 0 0 "[ . 1 . 2]" 1
3359 2 29 LYS QE 2 29 LYS QG 3.330 . 3.330 2.467 2.318 2.922 . 0 0 "[ . 1 . 2]" 1
3360 2 29 LYS QG 2 30 LEU H 3.520 . 3.520 2.538 2.363 2.642 . 0 0 "[ . 1 . 2]" 1
3361 2 29 LYS QG 2 30 LEU HA 5.340 . 5.340 3.346 3.087 3.773 . 0 0 "[ . 1 . 2]" 1
3362 2 29 LYS QG 2 30 LEU MD1 4.210 . 4.210 3.843 3.743 3.925 . 0 0 "[ . 1 . 2]" 1
3363 2 29 LYS QG 2 30 LEU MD2 3.830 . 3.830 3.824 3.713 3.843 0.013 16 0 "[ . 1 . 2]" 1
3364 2 29 LYS QG 2 31 SER H 5.110 . 5.110 4.757 4.424 5.113 0.003 10 0 "[ . 1 . 2]" 1
3365 2 29 LYS QG 2 43 GLY QA 4.760 . 4.760 2.940 2.333 4.123 . 0 0 "[ . 1 . 2]" 1
3366 2 29 LYS QG 2 44 THR H 5.340 . 5.340 4.298 3.560 5.016 . 0 0 "[ . 1 . 2]" 1
3367 2 29 LYS QD 2 43 GLY QA 5.180 . 5.180 3.721 2.097 5.183 0.003 7 0 "[ . 1 . 2]" 1
3368 2 30 LEU MD2 2 31 SER QB 5.160 . 5.160 4.585 4.120 4.818 . 0 0 "[ . 1 . 2]" 1
3369 2 31 SER H 2 43 GLY QA 4.090 . 4.090 3.038 2.456 4.044 . 0 0 "[ . 1 . 2]" 1
3370 2 31 SER QB 2 32 ALA H 3.960 . 3.960 3.097 2.724 3.387 . 0 0 "[ . 1 . 2]" 1
3371 2 31 SER QB 2 40 GLY H 5.120 . 5.120 3.975 3.228 5.122 0.002 6 0 "[ . 1 . 2]" 1
3372 2 31 SER QB 2 41 ALA H 4.190 . 4.190 2.928 1.871 4.171 . 0 0 "[ . 1 . 2]" 1
3373 2 31 SER QB 2 41 ALA HA 5.270 . 5.270 4.399 3.871 4.813 . 0 0 "[ . 1 . 2]" 1
3374 2 31 SER QB 2 41 ALA MB 3.330 . 3.330 2.162 1.868 2.619 . 0 0 "[ . 1 . 2]" 1
3375 2 31 SER QB 2 43 GLY QA 4.250 . 4.250 2.921 2.103 3.717 . 0 0 "[ . 1 . 2]" 1
3376 2 31 SER QB 2 44 THR H 5.340 . 5.340 4.377 3.797 4.924 . 0 0 "[ . 1 . 2]" 1
3377 2 32 ALA MB 2 38 GLY QA 3.160 . 3.160 2.478 1.813 2.948 . 0 0 "[ . 1 . 2]" 1
3378 2 34 ARG H 2 34 ARG QG 4.430 . 4.430 3.588 2.036 4.122 . 0 0 "[ . 1 . 2]" 1
3379 2 34 ARG H 2 34 ARG QD 4.830 . 4.830 4.139 2.126 4.550 . 0 0 "[ . 1 . 2]" 1
3380 2 34 ARG HA 2 34 ARG QG 3.090 . 3.090 2.486 2.168 2.933 . 0 0 "[ . 1 . 2]" 1
3381 2 34 ARG HA 2 34 ARG QD 3.830 . 3.830 2.660 1.863 3.869 0.039 5 0 "[ . 1 . 2]" 1
3382 2 34 ARG QB 2 34 ARG QD 2.920 . 2.920 2.375 2.094 2.889 . 0 0 "[ . 1 . 2]" 1
3383 2 34 ARG QB 2 38 GLY H 4.380 . 4.380 3.985 3.503 4.354 . 0 0 "[ . 1 . 2]" 1
3384 2 34 ARG QB 2 39 ALA H 5.110 . 5.110 4.303 3.266 5.117 0.007 20 0 "[ . 1 . 2]" 1
3385 2 34 ARG QB 2 41 ALA H 4.540 . 4.540 4.510 4.001 4.565 0.025 4 0 "[ . 1 . 2]" 1
3386 2 34 ARG QG 2 38 GLY H 4.100 . 4.100 3.529 2.328 4.116 0.016 9 0 "[ . 1 . 2]" 1
3387 2 34 ARG QG 2 40 GLY H 4.490 . 4.490 3.265 1.947 4.511 0.021 10 0 "[ . 1 . 2]" 1
3388 2 34 ARG QG 2 40 GLY QA 4.010 . 4.010 2.755 1.795 3.971 0.005 7 0 "[ . 1 . 2]" 1
3389 2 34 ARG QD 2 38 GLY H 4.430 . 4.430 3.339 2.350 4.451 0.021 8 0 "[ . 1 . 2]" 1
3390 2 34 ARG QD 2 40 GLY H 4.310 . 4.310 3.892 2.229 4.328 0.018 18 0 "[ . 1 . 2]" 1
3391 2 35 GLU H 2 35 GLU QG 4.140 . 4.140 2.554 1.842 4.059 . 0 0 "[ . 1 . 2]" 1
3392 2 35 GLU HA 2 36 LEU QD 4.860 . 4.860 4.167 3.503 4.714 . 0 0 "[ . 1 . 2]" 1
3393 2 35 GLU QB 2 36 LEU H 3.680 . 3.680 2.590 1.922 2.970 . 0 0 "[ . 1 . 2]" 1
3394 2 35 GLU QB 2 36 LEU HA 4.390 . 4.390 3.977 3.813 4.247 . 0 0 "[ . 1 . 2]" 1
3395 2 35 GLU QB 2 36 LEU QB 4.520 . 4.520 4.033 3.589 4.420 . 0 0 "[ . 1 . 2]" 1
3396 2 35 GLU QB 2 36 LEU HG 4.770 . 4.770 3.421 2.212 4.766 . 0 0 "[ . 1 . 2]" 1
3397 2 35 GLU QB 2 36 LEU QD 2.970 . 2.970 2.471 1.784 2.976 0.016 12 0 "[ . 1 . 2]" 1
3398 2 35 GLU QB 2 37 GLY H 4.770 . 4.770 4.419 3.624 4.772 0.002 17 0 "[ . 1 . 2]" 1
3399 2 35 GLU QG 2 36 LEU QD 4.930 . 4.930 3.776 2.530 4.458 . 0 0 "[ . 1 . 2]" 1
3400 2 36 LEU H 2 36 LEU QD 3.380 . 3.380 2.714 1.796 3.302 0.004 13 0 "[ . 1 . 2]" 1
3401 2 36 LEU H 2 37 GLY QA 4.500 . 4.500 4.248 3.996 4.357 . 0 0 "[ . 1 . 2]" 1
3402 2 36 LEU HA 2 36 LEU QD 2.940 . 2.940 2.148 2.011 2.402 . 0 0 "[ . 1 . 2]" 1
3403 2 36 LEU QD 2 37 GLY H 4.500 . 4.500 4.020 3.332 4.398 . 0 0 "[ . 1 . 2]" 1
3404 2 36 LEU QD 2 85 ILE MG 3.330 . 3.330 2.167 1.795 3.236 0.005 4 0 "[ . 1 . 2]" 1
3405 2 37 GLY H 2 38 GLY QA 4.350 . 4.350 4.065 3.567 4.355 0.005 19 0 "[ . 1 . 2]" 1
3406 2 38 GLY QA 2 39 ALA MB 3.930 . 3.930 3.673 3.524 3.744 . 0 0 "[ . 1 . 2]" 1
3407 2 39 ALA H 2 40 GLY QA 4.020 . 4.020 3.922 3.562 4.090 0.070 9 0 "[ . 1 . 2]" 1
3408 2 41 ALA HA 2 42 GLU QB 5.030 . 5.030 4.481 4.179 4.930 . 0 0 "[ . 1 . 2]" 1
3409 2 41 ALA HA 2 42 GLU QG 4.250 . 4.250 3.837 3.132 4.254 0.004 16 0 "[ . 1 . 2]" 1
3410 2 41 ALA MB 2 42 GLU QG 4.050 . 4.050 3.306 2.842 3.857 . 0 0 "[ . 1 . 2]" 1
3411 2 42 GLU H 2 42 GLU QB 2.920 . 2.920 2.666 2.530 2.925 0.005 1 0 "[ . 1 . 2]" 1
3412 2 42 GLU HA 2 42 GLU QG 3.400 . 3.400 3.135 2.481 3.353 . 0 0 "[ . 1 . 2]" 1
3413 2 42 GLU QB 2 42 GLU QG 2.190 . 2.190 2.088 2.075 2.095 . 0 0 "[ . 1 . 2]" 1
3414 2 44 THR MG 2 48 GLN QB 5.200 . 5.200 3.714 2.610 5.206 0.006 5 0 "[ . 1 . 2]" 1
3415 2 48 GLN QB 2 83 VAL QG 3.820 . 3.820 3.178 2.516 3.826 0.006 1 0 "[ . 1 . 2]" 1
3416 2 48 GLN QG 2 51 ALA MB 4.590 . 4.590 3.634 3.323 4.215 . 0 0 "[ . 1 . 2]" 1
3417 2 48 GLN QG 2 83 VAL QG 4.680 . 4.680 3.586 2.879 4.161 . 0 0 "[ . 1 . 2]" 1
3418 2 49 LEU MD1 2 53 GLY QA 4.420 . 4.420 3.696 3.429 3.867 . 0 0 "[ . 1 . 2]" 1
3419 2 49 LEU MD2 2 53 GLY QA 5.150 . 5.150 4.439 4.206 4.640 . 0 0 "[ . 1 . 2]" 1
3420 2 50 PHE QB 2 51 ALA H 3.970 . 3.970 2.584 2.462 2.679 . 0 0 "[ . 1 . 2]" 1
3421 2 51 ALA HA 2 99 LEU QD 4.320 . 4.320 4.107 3.640 4.336 0.016 3 0 "[ . 1 . 2]" 1
3422 2 52 ALA MB 2 53 GLY QA 4.280 . 4.280 3.518 3.462 3.579 . 0 0 "[ . 1 . 2]" 1
3423 2 54 TYR HD1 2 58 PHE QB 4.670 . 4.670 3.399 2.885 4.171 . 0 0 "[ . 1 . 2]" 1
3424 2 54 TYR HE2 2 99 LEU QD 3.890 . 3.890 2.530 1.823 3.670 . 0 0 "[ . 1 . 2]" 1
3425 2 54 TYR HD2 2 99 LEU QD 4.170 . 4.170 3.120 2.572 3.953 . 0 0 "[ . 1 . 2]" 1
3426 2 55 SER H 2 99 LEU QD 4.640 . 4.640 4.122 3.834 4.386 . 0 0 "[ . 1 . 2]" 1
3427 2 55 SER HA 2 99 LEU QD 4.590 . 4.590 3.295 2.742 3.787 . 0 0 "[ . 1 . 2]" 1
3428 2 62 MET HA 2 73 LEU QD 3.980 . 3.980 3.743 3.135 3.984 0.004 13 0 "[ . 1 . 2]" 1
3429 2 62 MET ME 2 73 LEU QD 3.210 . 3.210 2.324 1.793 3.114 0.007 15 0 "[ . 1 . 2]" 1
3430 2 63 LYS H 2 73 LEU QD 4.440 . 4.440 3.728 3.288 4.486 0.046 15 0 "[ . 1 . 2]" 1
3431 2 65 VAL HA 2 68 GLN QB 4.370 . 4.370 4.158 4.021 4.279 . 0 0 "[ . 1 . 2]" 1
3432 2 66 ALA H 2 73 LEU QD 4.200 . 4.200 3.490 3.240 3.683 . 0 0 "[ . 1 . 2]" 1
3433 2 66 ALA HA 2 73 LEU QD 4.490 . 4.490 3.998 3.675 4.222 . 0 0 "[ . 1 . 2]" 1
3434 2 66 ALA MB 2 73 LEU QD 2.980 . 2.980 2.220 2.000 2.512 . 0 0 "[ . 1 . 2]" 1
3435 2 67 GLY H 2 73 LEU QD 5.230 . 5.230 5.021 4.536 5.240 0.010 15 0 "[ . 1 . 2]" 1
3436 2 68 GLN H 2 68 GLN QB 3.680 . 3.680 2.847 2.800 2.884 . 0 0 "[ . 1 . 2]" 1
3437 2 70 LYS H 2 70 LYS QG 3.760 . 3.760 3.702 3.320 3.771 0.011 20 0 "[ . 1 . 2]" 1
3438 2 70 LYS H 2 70 LYS QE 4.830 . 4.830 4.072 3.890 4.376 . 0 0 "[ . 1 . 2]" 1
3439 2 70 LYS HA 2 70 LYS QG 3.710 . 3.710 2.678 2.526 3.299 . 0 0 "[ . 1 . 2]" 1
3440 2 70 LYS QB 2 70 LYS HD2 3.710 . 3.710 3.094 2.685 3.220 . 0 0 "[ . 1 . 2]" 1
3441 2 70 LYS QB 2 70 LYS HD3 3.590 . 3.590 2.656 2.482 3.208 . 0 0 "[ . 1 . 2]" 1
3442 2 70 LYS QE 2 70 LYS QG 2.360 . 2.360 2.316 2.127 2.372 0.012 6 0 "[ . 1 . 2]" 1
3443 2 70 LYS QG 2 71 GLN H 5.190 . 5.190 4.952 4.671 5.015 . 0 0 "[ . 1 . 2]" 1
3444 2 73 LEU H 2 73 LEU QB 3.340 . 3.340 2.657 2.388 3.122 . 0 0 "[ . 1 . 2]" 1
3445 2 73 LEU H 2 73 LEU QD 3.980 . 3.980 2.930 1.796 3.440 0.004 18 0 "[ . 1 . 2]" 1
3446 2 73 LEU HA 2 73 LEU QD 3.970 . 3.970 2.434 1.995 3.365 . 0 0 "[ . 1 . 2]" 1
3447 2 73 LEU QB 2 73 LEU QD 2.810 . 2.810 1.948 1.933 1.958 . 0 0 "[ . 1 . 2]" 1
3448 2 74 PRO HB3 2 103 LEU QD 4.790 . 4.790 4.343 3.692 4.796 0.006 16 0 "[ . 1 . 2]" 1
3449 2 75 ALA HA 2 76 ASP QB 5.340 . 5.340 5.192 5.033 5.360 0.020 8 0 "[ . 1 . 2]" 1
3450 2 75 ALA MB 2 76 ASP QB 4.280 . 4.280 4.135 3.670 4.313 0.033 7 0 "[ . 1 . 2]" 1
3451 2 76 ASP H 2 76 ASP QB 3.110 . 3.110 2.301 2.248 2.375 . 0 0 "[ . 1 . 2]" 1
3452 2 76 ASP QB 2 77 THR H 3.950 . 3.950 3.601 3.461 3.744 . 0 0 "[ . 1 . 2]" 1
3453 2 76 ASP QB 2 104 PRO HB3 4.220 . 4.220 3.799 3.152 4.216 . 0 0 "[ . 1 . 2]" 1
3454 2 76 ASP QB 2 104 PRO HG2 3.730 . 3.730 3.244 2.939 3.554 . 0 0 "[ . 1 . 2]" 1
3455 2 76 ASP QB 2 104 PRO HG3 3.470 . 3.470 2.257 1.928 2.572 . 0 0 "[ . 1 . 2]" 1
3456 2 76 ASP QB 2 104 PRO HD2 4.820 . 4.820 4.531 4.303 4.805 . 0 0 "[ . 1 . 2]" 1
3457 2 77 THR H 2 103 LEU QD 4.510 . 4.510 4.169 3.930 4.478 . 0 0 "[ . 1 . 2]" 1
3458 2 77 THR HA 2 103 LEU QD 4.000 . 4.000 3.527 3.386 3.792 . 0 0 "[ . 1 . 2]" 1
3459 2 77 THR HB 2 103 LEU QD 4.080 . 4.080 1.876 1.782 2.123 0.018 4 0 "[ . 1 . 2]" 1
3460 2 77 THR MG 2 103 LEU QD 3.130 . 3.130 2.624 2.335 2.906 . 0 0 "[ . 1 . 2]" 1
3461 2 78 THR H 2 103 LEU QD 4.410 . 4.410 4.103 3.216 4.415 0.005 1 0 "[ . 1 . 2]" 1
3462 2 79 VAL MG1 2 99 LEU QD 3.310 . 3.310 2.785 2.133 3.221 . 0 0 "[ . 1 . 2]" 1
3463 2 79 VAL MG2 2 99 LEU QD 5.440 . 5.440 4.432 3.741 4.870 . 0 0 "[ . 1 . 2]" 1
3464 2 80 THR H 2 100 ARG QB 4.140 . 4.140 2.708 2.475 2.911 . 0 0 "[ . 1 . 2]" 1
3465 2 80 THR H 2 100 ARG QG 5.230 . 5.230 4.302 3.399 4.921 . 0 0 "[ . 1 . 2]" 1
3466 2 80 THR HB 2 100 ARG QB 3.970 . 3.970 2.013 1.799 2.256 0.001 13 0 "[ . 1 . 2]" 1
3467 2 81 ALA H 2 99 LEU QD 4.530 . 4.530 4.143 3.635 4.534 0.004 17 0 "[ . 1 . 2]" 1
3468 2 81 ALA HA 2 99 LEU QD 3.610 . 3.610 2.302 2.085 2.635 . 0 0 "[ . 1 . 2]" 1
3469 2 81 ALA MB 2 99 LEU QD 2.990 . 2.990 2.219 2.029 2.477 . 0 0 "[ . 1 . 2]" 1
3470 2 82 GLU H 2 82 GLU QG 4.790 . 4.790 4.051 3.996 4.095 . 0 0 "[ . 1 . 2]" 1
3471 2 82 GLU H 2 97 VAL QG 3.980 . 3.980 3.816 2.797 3.989 0.009 5 0 "[ . 1 . 2]" 1
3472 2 82 GLU H 2 99 LEU QD 3.880 . 3.880 3.688 3.355 3.897 0.017 7 0 "[ . 1 . 2]" 1
3473 2 82 GLU HA 2 82 GLU QG 3.650 . 3.650 2.403 2.345 2.493 . 0 0 "[ . 1 . 2]" 1
3474 2 82 GLU QG 2 83 VAL H 3.390 . 3.390 3.172 2.486 3.289 . 0 0 "[ . 1 . 2]" 1
3475 2 83 VAL H 2 83 VAL QG 3.720 . 3.720 2.018 1.879 2.505 . 0 0 "[ . 1 . 2]" 1
3476 2 83 VAL QG 2 84 GLY H 4.210 . 4.210 3.076 2.297 3.444 . 0 0 "[ . 1 . 2]" 1
3477 2 83 VAL QG 2 96 ASP H 5.400 . 5.400 4.516 3.259 5.180 . 0 0 "[ . 1 . 2]" 1
3478 2 85 ILE QG 2 86 GLY H 3.750 . 3.750 2.545 2.433 2.622 . 0 0 "[ . 1 . 2]" 1
3479 2 85 ILE QG 2 93 PHE QD 4.290 . 4.290 3.671 3.381 3.934 . 0 0 "[ . 1 . 2]" 1
3480 2 88 ASN H 2 88 ASN QB 3.650 . 3.650 2.377 2.250 2.970 . 0 0 "[ . 1 . 2]" 1
3481 2 88 ASN HA 2 89 GLU QG 5.020 . 5.020 3.961 3.744 4.246 . 0 0 "[ . 1 . 2]" 1
3482 2 88 ASN QB 2 89 GLU H 4.080 . 4.080 3.397 2.312 3.709 . 0 0 "[ . 1 . 2]" 1
3483 2 88 ASN QB 2 89 GLU HA 4.940 . 4.940 4.884 4.624 4.950 0.010 10 0 "[ . 1 . 2]" 1
3484 2 88 ASN QB 2 90 GLU H 3.670 . 3.670 3.018 2.655 3.183 . 0 0 "[ . 1 . 2]" 1
3485 2 88 ASN QB 2 94 ALA MB 3.170 . 3.170 2.084 1.798 2.435 0.002 20 0 "[ . 1 . 2]" 1
3486 2 89 GLU H 2 89 GLU QG 4.190 . 4.190 1.990 1.856 2.134 . 0 0 "[ . 1 . 2]" 1
3487 2 89 GLU HA 2 89 GLU QG 3.680 . 3.680 3.346 3.330 3.363 . 0 0 "[ . 1 . 2]" 1
3488 2 89 GLU QG 2 90 GLU H 2.810 . 2.810 2.649 2.462 2.809 . 0 0 "[ . 1 . 2]" 1
3489 2 96 ASP H 2 97 VAL QG 5.440 . 5.440 4.031 3.634 4.715 . 0 0 "[ . 1 . 2]" 1
3490 2 97 VAL H 2 97 VAL QG 3.940 . 3.940 2.384 1.988 2.854 . 0 0 "[ . 1 . 2]" 1
3491 2 97 VAL QG 2 98 GLU H 3.560 . 3.560 2.874 2.200 3.050 . 0 0 "[ . 1 . 2]" 1
3492 2 97 VAL QG 2 98 GLU HA 3.980 . 3.980 3.702 3.447 3.940 . 0 0 "[ . 1 . 2]" 1
3493 2 97 VAL QG 2 99 LEU QD 3.450 . 3.450 2.505 2.175 2.993 . 0 0 "[ . 1 . 2]" 1
3494 2 98 GLU HA 2 135 ARG QB 3.600 . 3.600 2.313 1.941 2.572 . 0 0 "[ . 1 . 2]" 1
3495 2 99 LEU H 2 99 LEU QD 3.850 . 3.850 3.466 3.223 3.809 . 0 0 "[ . 1 . 2]" 1
3496 2 99 LEU H 2 135 ARG QB 3.970 . 3.970 3.734 3.130 3.977 0.007 10 0 "[ . 1 . 2]" 1
3497 2 99 LEU HA 2 99 LEU QD 3.330 . 3.330 1.981 1.830 2.055 . 0 0 "[ . 1 . 2]" 1
3498 2 99 LEU QB 2 137 VAL H 4.720 . 4.720 3.558 3.394 3.773 . 0 0 "[ . 1 . 2]" 1
3499 2 99 LEU QB 2 137 VAL MG1 4.570 . 4.570 3.819 3.656 4.003 . 0 0 "[ . 1 . 2]" 1
3500 2 99 LEU QD 2 100 ARG H 3.770 . 3.770 3.424 2.891 3.716 . 0 0 "[ . 1 . 2]" 1
3501 2 99 LEU QD 2 134 VAL HB 5.230 . 5.230 4.407 3.959 4.927 . 0 0 "[ . 1 . 2]" 1
3502 2 99 LEU QD 2 134 VAL MG1 3.190 . 3.190 2.345 1.970 2.831 . 0 0 "[ . 1 . 2]" 1
3503 2 99 LEU QD 2 136 LEU HG 4.790 . 4.790 4.269 3.301 4.790 0.000 7 0 "[ . 1 . 2]" 1
3504 2 99 LEU QD 2 136 LEU MD1 4.480 . 4.480 4.216 3.870 4.485 0.005 4 0 "[ . 1 . 2]" 1
3505 2 99 LEU QD 2 136 LEU MD2 2.970 . 2.970 2.357 2.019 2.639 . 0 0 "[ . 1 . 2]" 1
3506 2 100 ARG H 2 100 ARG QG 4.190 . 4.190 3.328 2.448 4.054 . 0 0 "[ . 1 . 2]" 1
3507 2 100 ARG H 2 100 ARG QD 5.340 . 5.340 4.226 3.861 4.494 . 0 0 "[ . 1 . 2]" 1
3508 2 100 ARG HA 2 100 ARG QG 3.530 . 3.530 2.435 2.313 2.559 . 0 0 "[ . 1 . 2]" 1
3509 2 100 ARG HA 2 100 ARG QD 4.130 . 4.130 3.956 2.915 4.050 . 0 0 "[ . 1 . 2]" 1
3510 2 100 ARG QB 2 100 ARG QD 3.120 . 3.120 2.125 2.087 2.292 . 0 0 "[ . 1 . 2]" 1
3511 2 100 ARG QB 2 101 VAL H 4.290 . 4.290 3.565 3.123 3.926 . 0 0 "[ . 1 . 2]" 1
3512 2 100 ARG QG 2 101 VAL H 4.280 . 4.280 3.618 2.725 4.286 0.006 5 0 "[ . 1 . 2]" 1
3513 2 100 ARG QG 2 137 VAL H 5.340 . 5.340 4.643 4.144 5.306 . 0 0 "[ . 1 . 2]" 1
3514 2 100 ARG QG 2 137 VAL HB 5.020 . 5.020 4.292 3.841 5.003 . 0 0 "[ . 1 . 2]" 1
3515 2 100 ARG QG 2 137 VAL MG1 3.290 . 3.290 2.423 1.858 3.292 0.002 4 0 "[ . 1 . 2]" 1
3516 2 100 ARG QG 2 137 VAL MG2 2.960 . 2.960 2.055 1.849 2.283 . 0 0 "[ . 1 . 2]" 1
3517 2 100 ARG QD 2 137 VAL MG1 4.430 . 4.430 3.750 3.592 4.035 . 0 0 "[ . 1 . 2]" 1
3518 2 100 ARG QD 2 137 VAL MG2 3.770 . 3.770 3.414 3.281 3.702 . 0 0 "[ . 1 . 2]" 1
3519 2 101 VAL H 2 138 VAL QG 4.220 . 4.220 3.935 3.819 4.092 . 0 0 "[ . 1 . 2]" 1
3520 2 103 LEU H 2 103 LEU QB 2.900 . 2.900 2.445 2.339 2.536 . 0 0 "[ . 1 . 2]" 1
3521 2 103 LEU H 2 103 LEU QD 4.250 . 4.250 3.821 3.119 3.936 . 0 0 "[ . 1 . 2]" 1
3522 2 103 LEU QB 2 104 PRO HD2 4.370 . 4.370 3.759 3.255 3.940 . 0 0 "[ . 1 . 2]" 1
3523 2 103 LEU QB 2 104 PRO HD3 4.830 . 4.830 4.357 4.177 4.502 . 0 0 "[ . 1 . 2]" 1
3524 2 103 LEU QD 2 104 PRO HD2 3.930 . 3.930 1.872 1.793 2.460 0.007 15 0 "[ . 1 . 2]" 1
3525 2 103 LEU QD 2 104 PRO HD3 4.410 . 4.410 3.117 2.884 3.658 . 0 0 "[ . 1 . 2]" 1
3526 2 108 ALA HA 2 138 VAL QG 4.180 . 4.180 2.461 2.113 2.830 . 0 0 "[ . 1 . 2]" 1
3527 2 109 ALA H 2 112 LYS QG 5.340 . 5.340 4.667 4.206 4.907 . 0 0 "[ . 1 . 2]" 1
3528 2 109 ALA HA 2 112 LYS QG 4.150 . 4.150 3.161 2.497 3.550 . 0 0 "[ . 1 . 2]" 1
3529 2 111 ALA MB 2 138 VAL QG 2.510 . 2.510 2.135 1.982 2.285 . 0 0 "[ . 1 . 2]" 1
3530 2 112 LYS H 2 112 LYS QG 3.480 . 3.480 2.341 2.180 2.661 . 0 0 "[ . 1 . 2]" 1
3531 2 112 LYS H 2 112 LYS QD 4.330 . 4.330 3.798 3.472 4.280 . 0 0 "[ . 1 . 2]" 1
3532 2 112 LYS H 2 138 VAL QG 3.640 . 3.640 2.706 2.386 2.853 . 0 0 "[ . 1 . 2]" 1
3533 2 112 LYS HA 2 112 LYS QG 3.310 . 3.310 2.492 2.331 2.891 . 0 0 "[ . 1 . 2]" 1
3534 2 112 LYS HA 2 112 LYS QD 4.170 . 4.170 3.466 1.918 4.184 0.014 6 0 "[ . 1 . 2]" 1
3535 2 112 LYS HA 2 138 VAL QG 4.000 . 4.000 1.983 1.867 2.091 . 0 0 "[ . 1 . 2]" 1
3536 2 112 LYS QE 2 112 LYS QG 3.270 . 3.270 2.366 2.145 2.805 . 0 0 "[ . 1 . 2]" 1
3537 2 112 LYS QG 2 113 THR H 4.730 . 4.730 4.194 4.045 4.309 . 0 0 "[ . 1 . 2]" 1
3538 2 112 LYS QG 2 138 VAL QG 3.320 . 3.320 2.152 1.952 2.557 . 0 0 "[ . 1 . 2]" 1
3539 2 112 LYS QD 2 113 THR H 5.140 . 5.140 4.854 4.627 5.151 0.011 9 0 "[ . 1 . 2]" 1
3540 2 113 THR H 2 138 VAL QG 5.110 . 5.110 4.416 4.251 4.543 . 0 0 "[ . 1 . 2]" 1
3541 2 113 THR MG 2 117 ARG QD 2.940 . 2.940 2.905 2.655 2.949 0.009 20 0 "[ . 1 . 2]" 1
3542 2 116 ASP H 2 117 ARG QG 3.930 . 3.930 3.847 3.707 3.933 0.003 14 0 "[ . 1 . 2]" 1
3543 2 116 ASP H 2 117 ARG QD 5.340 . 5.340 5.250 5.117 5.342 0.002 10 0 "[ . 1 . 2]" 1
3544 2 117 ARG H 2 117 ARG QG 2.990 . 2.990 1.917 1.870 1.961 . 0 0 "[ . 1 . 2]" 1
3545 2 117 ARG H 2 117 ARG QD 3.600 . 3.600 3.513 3.431 3.598 . 0 0 "[ . 1 . 2]" 1
3546 2 117 ARG HB2 2 117 ARG QD 3.060 . 3.060 2.952 2.809 3.041 . 0 0 "[ . 1 . 2]" 1
3547 2 117 ARG QD 2 117 ARG QG 2.360 . 2.360 2.013 2.004 2.030 . 0 0 "[ . 1 . 2]" 1
3548 2 117 ARG QG 2 118 ALA H 3.240 . 3.240 2.129 2.018 2.203 . 0 0 "[ . 1 . 2]" 1
3549 2 117 ARG QG 2 118 ALA HA 5.300 . 5.300 3.475 3.367 3.614 . 0 0 "[ . 1 . 2]" 1
3550 2 117 ARG QG 2 118 ALA MB 3.790 . 3.790 3.084 2.847 3.239 . 0 0 "[ . 1 . 2]" 1
3551 2 117 ARG QD 2 118 ALA H 4.170 . 4.170 4.072 3.982 4.151 . 0 0 "[ . 1 . 2]" 1
3552 2 118 ALA HA 2 121 VAL QG 3.600 . 3.600 2.430 1.988 3.597 . 0 0 "[ . 1 . 2]" 1
3553 2 119 HIS QB 2 136 LEU MD2 3.970 . 3.970 3.295 2.757 3.855 . 0 0 "[ . 1 . 2]" 1
3554 2 120 HIS H 2 121 VAL QG 3.770 . 3.770 3.185 3.068 3.547 . 0 0 "[ . 1 . 2]" 1
3555 2 120 HIS QB 2 120 HIS HD2 3.400 . 3.400 2.939 2.625 3.295 . 0 0 "[ . 1 . 2]" 1
3556 2 120 HIS QB 2 121 VAL H 4.020 . 4.020 2.749 2.462 3.123 . 0 0 "[ . 1 . 2]" 1
3557 2 120 HIS QB 2 121 VAL QG 3.840 . 3.840 2.795 2.505 3.103 . 0 0 "[ . 1 . 2]" 1
3558 2 120 HIS HB2 2 121 VAL MG2 6.190 . 6.190 5.011 3.707 5.586 . 0 0 "[ . 1 . 2]" 1
3559 2 121 VAL H 2 121 VAL QG 3.170 . 3.170 1.927 1.853 2.087 . 0 0 "[ . 1 . 2]" 1
3560 2 126 ASN H 2 126 ASN QB 3.690 . 3.690 2.404 2.222 2.667 . 0 0 "[ . 1 . 2]" 1
3561 2 126 ASN QB 2 127 ALA H 3.740 . 3.740 2.833 2.345 3.509 . 0 0 "[ . 1 . 2]" 1
3562 2 127 ALA HA 2 131 ASN QB 3.660 . 3.660 2.511 1.959 2.880 . 0 0 "[ . 1 . 2]" 1
3563 2 127 ALA HA 2 132 VAL QG 4.710 . 4.710 4.422 3.221 4.718 0.008 19 0 "[ . 1 . 2]" 1
3564 2 128 THR H 2 129 ARG QG 4.300 . 4.300 3.125 2.920 3.396 . 0 0 "[ . 1 . 2]" 1
3565 2 128 THR H 2 131 ASN QB 4.690 . 4.690 4.461 4.161 4.667 . 0 0 "[ . 1 . 2]" 1
3566 2 128 THR MG 2 129 ARG QD 4.340 . 4.340 3.765 3.063 4.207 . 0 0 "[ . 1 . 2]" 1
3567 2 129 ARG H 2 129 ARG QG 3.690 . 3.690 2.119 1.963 2.289 . 0 0 "[ . 1 . 2]" 1
3568 2 129 ARG H 2 129 ARG QD 4.150 . 4.150 4.020 3.744 4.164 0.014 14 0 "[ . 1 . 2]" 1
3569 2 129 ARG HA 2 129 ARG QG 3.670 . 3.670 3.363 3.344 3.377 . 0 0 "[ . 1 . 2]" 1
3570 2 129 ARG HA 2 129 ARG QD 4.640 . 4.640 4.440 4.219 4.554 . 0 0 "[ . 1 . 2]" 1
3571 2 129 ARG HB2 2 129 ARG QD 3.590 . 3.590 2.710 2.302 3.048 . 0 0 "[ . 1 . 2]" 1
3572 2 129 ARG HB3 2 129 ARG QD 3.240 . 3.240 2.470 2.364 2.790 . 0 0 "[ . 1 . 2]" 1
3573 2 129 ARG HB3 2 130 ASN QD 5.340 . 5.340 5.091 4.525 5.356 0.016 7 0 "[ . 1 . 2]" 1
3574 2 129 ARG QG 2 130 ASN H 3.820 . 3.820 1.919 1.788 2.147 0.012 17 0 "[ . 1 . 2]" 1
3575 2 129 ARG QG 2 130 ASN HA 4.260 . 4.260 3.538 3.335 3.769 . 0 0 "[ . 1 . 2]" 1
3576 2 129 ARG QG 2 130 ASN QD 3.690 . 3.690 2.581 1.843 3.090 . 0 0 "[ . 1 . 2]" 1
3577 2 129 ARG QD 2 130 ASN H 4.050 . 4.050 3.944 3.771 4.055 0.005 19 0 "[ . 1 . 2]" 1
3578 2 130 ASN H 2 130 ASN QD 4.770 . 4.770 2.909 2.129 3.700 . 0 0 "[ . 1 . 2]" 1
3579 2 130 ASN HA 2 130 ASN QD 3.980 . 3.980 3.335 1.796 3.998 0.018 20 0 "[ . 1 . 2]" 1
3580 2 130 ASN QB 2 130 ASN QD 3.070 . 3.070 2.270 2.098 2.702 . 0 0 "[ . 1 . 2]" 1
3581 2 130 ASN QB 2 132 VAL H 5.340 . 5.340 4.808 4.525 5.239 . 0 0 "[ . 1 . 2]" 1
3582 2 131 ASN H 2 131 ASN QB 3.480 . 3.480 2.319 2.206 2.471 . 0 0 "[ . 1 . 2]" 1
3583 2 131 ASN QB 2 132 VAL H 3.540 . 3.540 2.578 2.447 2.767 . 0 0 "[ . 1 . 2]" 1
3584 2 131 ASN QB 2 132 VAL QG 3.930 . 3.930 2.431 2.004 2.878 . 0 0 "[ . 1 . 2]" 1
3585 2 132 VAL H 2 132 VAL QG 3.190 . 3.190 2.385 2.187 2.669 . 0 0 "[ . 1 . 2]" 1
3586 2 132 VAL HA 2 132 VAL QG 3.100 . 3.100 2.161 2.147 2.257 . 0 0 "[ . 1 . 2]" 1
3587 2 132 VAL QG 2 133 ALA MB 4.080 . 4.080 3.421 3.214 4.052 . 0 0 "[ . 1 . 2]" 1
3588 2 134 VAL HA 2 135 ARG QB 4.910 . 4.910 4.186 4.023 4.553 . 0 0 "[ . 1 . 2]" 1
3589 2 135 ARG H 2 135 ARG QB 3.560 . 3.560 2.336 2.128 2.613 . 0 0 "[ . 1 . 2]" 1
3590 2 135 ARG HA 2 135 ARG QB 2.620 . 2.620 2.386 2.270 2.528 . 0 0 "[ . 1 . 2]" 1
3591 2 135 ARG QB 2 135 ARG QD 3.260 . 3.260 2.375 2.082 2.825 . 0 0 "[ . 1 . 2]" 1
3592 2 135 ARG QB 2 136 LEU H 4.430 . 4.430 3.719 3.313 3.993 . 0 0 "[ . 1 . 2]" 1
3593 2 137 VAL H 2 138 VAL QG 4.340 . 4.340 4.205 4.005 4.347 0.007 10 0 "[ . 1 . 2]" 1
3594 2 137 VAL HA 2 138 VAL QG 3.580 . 3.580 3.303 3.231 3.366 . 0 0 "[ . 1 . 2]" 1
3595 2 138 VAL H 2 138 VAL QG 2.820 . 2.820 2.035 1.965 2.090 . 0 0 "[ . 1 . 2]" 1
3596 2 138 VAL HA 2 138 VAL QG 2.870 . 2.870 2.408 2.357 2.449 . 0 0 "[ . 1 . 2]" 1
3597 2 138 VAL QG 2 139 ALA H 3.220 . 3.220 3.251 3.237 3.263 0.043 15 0 "[ . 1 . 2]" 1
3598 2 138 VAL QG 2 139 ALA HA 4.210 . 4.210 3.910 3.677 4.193 . 0 0 "[ . 1 . 2]" 1
3599 1 10 THR HA 2 80 THR HA 2.500 . 2.500 1.995 1.792 2.383 0.008 13 0 "[ . 1 . 2]" 1
3600 1 80 THR HA 2 10 THR HA 2.500 . 2.500 2.064 1.798 2.322 0.002 16 0 "[ . 1 . 2]" 1
3601 1 50 PHE HD1 2 50 PHE HD1 2.500 . 2.500 1.795 1.786 1.800 0.014 17 0 "[ . 1 . 2]" 1
3602 1 50 PHE HD1 2 50 PHE HE1 3.500 . 3.500 2.943 2.509 3.396 . 0 0 "[ . 1 . 2]" 1
3603 1 50 PHE HE1 2 50 PHE HD1 . . 3.500 2.916 2.601 3.217 . 0 0 "[ . 1 . 2]" 1
3604 1 50 PHE HE1 2 50 PHE HE1 3.500 . 3.500 2.842 2.601 3.288 . 0 0 "[ . 1 . 2]" 1
3605 1 124 TYR HE1 2 50 PHE HD2 3.500 . 3.500 3.326 2.693 3.513 0.013 19 0 "[ . 1 . 2]" 1
3606 1 124 TYR HE1 2 50 PHE HE2 4.500 . 4.500 4.188 3.520 4.519 0.019 7 0 "[ . 1 . 2]" 1
3607 1 124 TYR HE1 2 50 PHE HD1 4.500 . 4.500 3.175 2.893 3.728 . 0 0 "[ . 1 . 2]" 1
3608 1 124 TYR HE1 2 50 PHE HE1 5.500 . 5.500 4.067 3.613 4.977 . 0 0 "[ . 1 . 2]" 1
3609 1 124 TYR HD1 2 50 PHE HD1 5.500 . 5.500 4.265 3.748 4.789 . 0 0 "[ . 1 . 2]" 1
3610 1 124 TYR HD1 2 50 PHE HE1 5.500 . 5.500 4.104 3.378 5.202 . 0 0 "[ . 1 . 2]" 1
3611 1 124 TYR HD1 2 50 PHE HD2 5.500 . 5.500 5.159 3.513 5.512 0.012 1 0 "[ . 1 . 2]" 1
3612 1 124 TYR HD1 2 50 PHE HE2 5.500 . 5.500 5.034 3.383 5.511 0.011 10 0 "[ . 1 . 2]" 1
3613 1 50 PHE HD2 2 124 TYR HE1 3.500 . 3.500 3.260 2.984 3.525 0.025 17 0 "[ . 1 . 2]" 1
3614 1 50 PHE HE2 2 124 TYR HE1 4.500 . 4.500 4.004 2.948 4.504 0.004 19 0 "[ . 1 . 2]" 1
3615 1 50 PHE HD1 2 124 TYR HE1 4.500 . 4.500 3.261 2.875 3.787 . 0 0 "[ . 1 . 2]" 1
3616 1 50 PHE HE1 2 124 TYR HE1 5.500 . 5.500 4.014 3.211 4.681 . 0 0 "[ . 1 . 2]" 1
3617 1 50 PHE HD1 2 124 TYR HD1 5.500 . 5.500 4.269 3.789 4.806 . 0 0 "[ . 1 . 2]" 1
3618 1 50 PHE HE1 2 124 TYR HD1 5.500 . 5.500 4.217 3.520 4.993 . 0 0 "[ . 1 . 2]" 1
3619 1 50 PHE HD2 2 124 TYR HD1 5.500 . 5.500 5.218 4.525 5.511 0.011 14 0 "[ . 1 . 2]" 1
3620 1 50 PHE HE2 2 124 TYR HD1 5.500 . 5.500 5.182 4.178 5.508 0.008 7 0 "[ . 1 . 2]" 1
3621 1 93 PHE HE1 2 64 PHE HE1 4.000 . 4.000 3.577 2.854 4.004 0.004 12 0 "[ . 1 . 2]" 1
3622 1 93 PHE HE1 2 64 PHE HD2 4.500 . 4.500 4.494 4.298 4.508 0.008 11 0 "[ . 1 . 2]" 1
3623 1 93 PHE HE1 2 64 PHE HE2 4.500 . 4.500 2.967 2.293 4.046 . 0 0 "[ . 1 . 2]" 1
3624 1 64 PHE HE1 2 93 PHE HE1 4.000 . 4.000 3.616 3.043 4.005 0.005 5 0 "[ . 1 . 2]" 1
3625 1 64 PHE HD2 2 93 PHE HE1 4.500 . 4.500 4.457 4.124 4.508 0.008 12 0 "[ . 1 . 2]" 1
3626 1 64 PHE HE2 2 93 PHE HE1 4.500 . 4.500 3.003 2.209 4.133 . 0 0 "[ . 1 . 2]" 1
3627 1 50 PHE HE1 1 124 TYR HD1 2.500 . 2.500 2.318 1.942 2.507 0.007 10 0 "[ . 1 . 2]" 1
3628 1 50 PHE HD1 1 124 TYR HD1 4.500 . 4.500 4.498 4.196 4.524 0.024 7 0 "[ . 1 . 2]" 1
3629 1 50 PHE HZ 1 124 TYR HD1 4.000 . 4.000 3.521 2.925 4.004 0.004 19 0 "[ . 1 . 2]" 1
3630 1 50 PHE HE1 1 124 TYR HE1 3.500 . 3.500 3.073 2.736 3.503 0.003 15 0 "[ . 1 . 2]" 1
3631 1 50 PHE HD1 1 124 TYR HE1 4.500 . 4.500 4.102 3.532 4.516 0.016 14 0 "[ . 1 . 2]" 1
3632 2 50 PHE HE1 2 124 TYR HD1 2.500 . 2.500 2.378 2.220 2.506 0.006 17 0 "[ . 1 . 2]" 1
3633 2 50 PHE HD1 2 124 TYR HD1 4.500 . 4.500 4.507 4.382 4.526 0.026 14 0 "[ . 1 . 2]" 1
3634 2 50 PHE HZ 2 124 TYR HD1 4.000 . 4.000 3.681 3.129 4.006 0.006 17 0 "[ . 1 . 2]" 1
3635 2 50 PHE HE1 2 124 TYR HE1 3.500 . 3.500 3.243 2.390 3.503 0.003 19 0 "[ . 1 . 2]" 1
3636 2 50 PHE HD1 2 124 TYR HE1 4.500 . 4.500 4.244 3.261 4.518 0.018 7 0 "[ . 1 . 2]" 1
3637 1 54 TYR HE1 1 58 PHE HD2 3.000 . 3.000 2.470 2.218 2.777 . 0 0 "[ . 1 . 2]" 1
3638 1 54 TYR HD1 1 58 PHE HD2 4.000 . 4.000 3.874 3.728 4.005 0.005 16 0 "[ . 1 . 2]" 1
3639 1 54 TYR HE1 1 58 PHE HE2 4.000 . 4.000 4.002 3.980 4.011 0.011 18 0 "[ . 1 . 2]" 1
3640 2 54 TYR HE1 2 58 PHE HD2 3.000 . 3.000 2.362 2.082 3.001 0.001 19 0 "[ . 1 . 2]" 1
3641 2 54 TYR HD1 2 58 PHE HD2 4.000 . 4.000 3.908 3.626 4.009 0.009 9 0 "[ . 1 . 2]" 1
3642 2 54 TYR HE1 2 58 PHE HE2 4.000 . 4.000 3.936 3.243 4.008 0.008 13 0 "[ . 1 . 2]" 1
3643 1 50 PHE HZ 1 54 TYR HD2 4.000 . 4.000 3.718 3.136 4.003 0.003 10 0 "[ . 1 . 2]" 1
3644 1 50 PHE HZ 1 54 TYR HE2 4.500 . 4.500 4.434 3.782 4.513 0.013 14 0 "[ . 1 . 2]" 1
3645 1 50 PHE HZ 2 50 PHE HE1 4.500 . 4.500 4.498 4.286 4.517 0.017 3 0 "[ . 1 . 2]" 1
3646 2 50 PHE HZ 2 54 TYR HD2 4.000 . 4.000 3.784 3.524 4.003 0.003 12 0 "[ . 1 . 2]" 1
3647 2 50 PHE HZ 2 54 TYR HE2 4.500 . 4.500 4.503 4.454 4.518 0.018 3 0 "[ . 1 . 2]" 1
3648 1 50 PHE HE1 2 50 PHE HZ 4.500 . 4.500 4.467 4.020 4.527 0.027 17 0 "[ . 1 . 2]" 1
3649 1 33 PRO HG3 2 5 TYR HE1 5.500 . 5.500 4.209 3.365 5.503 0.003 9 0 "[ . 1 . 2]" 1
3650 1 33 PRO HG3 2 5 TYR HE2 5.500 . 5.500 4.309 2.407 5.224 . 0 0 "[ . 1 . 2]" 1
3651 1 33 PRO HG2 2 5 TYR HE1 5.500 . 5.500 4.728 3.152 5.502 0.002 10 0 "[ . 1 . 2]" 1
3652 1 33 PRO HG2 2 5 TYR HE2 5.500 . 5.500 4.372 2.133 5.508 0.008 1 0 "[ . 1 . 2]" 1
3653 1 5 TYR HE1 2 33 PRO HG3 5.500 . 5.500 4.166 3.174 5.502 0.002 6 0 "[ . 1 . 2]" 1
3654 1 5 TYR HE2 2 33 PRO HG3 5.500 . 5.500 4.521 3.439 5.401 . 0 0 "[ . 1 . 2]" 1
3655 1 5 TYR HE1 2 33 PRO HG2 5.500 . 5.500 4.775 3.527 5.502 0.002 20 0 "[ . 1 . 2]" 1
3656 1 5 TYR HE2 2 33 PRO HG2 5.500 . 5.500 4.806 3.537 5.511 0.011 7 0 "[ . 1 . 2]" 1
3657 1 127 ALA MB 2 132 VAL MG2 4.500 . 4.500 4.375 3.762 4.525 0.025 16 0 "[ . 1 . 2]" 1
3658 1 132 VAL MG2 2 127 ALA MB 4.500 . 4.500 4.396 3.553 4.532 0.032 19 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 222
_Distance_constraint_stats_list.Viol_count 1083
_Distance_constraint_stats_list.Viol_total 220.335
_Distance_constraint_stats_list.Viol_max 0.052
_Distance_constraint_stats_list.Viol_rms 0.0068
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0025
_Distance_constraint_stats_list.Viol_average_violations_only 0.0102
_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 4 LEU 0.167 0.018 17 0 "[ . 1 . 2]"
1 5 TYR 0.554 0.030 12 0 "[ . 1 . 2]"
1 7 THR 0.053 0.008 10 0 "[ . 1 . 2]"
1 9 ALA 0.040 0.010 12 0 "[ . 1 . 2]"
1 10 THR 0.116 0.020 20 0 "[ . 1 . 2]"
1 11 SER 0.016 0.006 11 0 "[ . 1 . 2]"
1 12 THR 0.141 0.020 5 0 "[ . 1 . 2]"
1 17 GLY 0.735 0.051 12 0 "[ . 1 . 2]"
1 18 ARG 0.141 0.020 5 0 "[ . 1 . 2]"
1 19 ALA 0.028 0.012 2 0 "[ . 1 . 2]"
1 20 THR 0.116 0.020 20 0 "[ . 1 . 2]"
1 21 SER 2.043 0.044 18 0 "[ . 1 . 2]"
1 26 LEU 2.043 0.044 18 0 "[ . 1 . 2]"
1 28 VAL 0.028 0.012 2 0 "[ . 1 . 2]"
1 30 LEU 0.735 0.051 12 0 "[ . 1 . 2]"
1 31 SER 0.073 0.012 11 0 "[ . 1 . 2]"
1 44 THR 0.073 0.012 11 0 "[ . 1 . 2]"
1 46 PRO 0.109 0.017 18 0 "[ . 1 . 2]"
1 47 GLU 0.022 0.012 1 0 "[ . 1 . 2]"
1 48 GLN 0.013 0.007 18 0 "[ . 1 . 2]"
1 49 LEU 0.018 0.012 14 0 "[ . 1 . 2]"
1 50 PHE 0.156 0.017 18 0 "[ . 1 . 2]"
1 51 ALA 0.028 0.012 1 0 "[ . 1 . 2]"
1 52 ALA 0.059 0.008 10 0 "[ . 1 . 2]"
1 53 GLY 0.021 0.012 14 0 "[ . 1 . 2]"
1 54 TYR 0.079 0.012 16 0 "[ . 1 . 2]"
1 55 SER 0.006 0.003 19 0 "[ . 1 . 2]"
1 56 ALA 0.046 0.008 10 0 "[ . 1 . 2]"
1 57 CYS 0.003 0.003 16 0 "[ . 1 . 2]"
1 58 PHE 0.046 0.010 17 0 "[ . 1 . 2]"
1 60 SER 0.119 0.019 6 0 "[ . 1 . 2]"
1 61 ALA 0.021 0.006 12 0 "[ . 1 . 2]"
1 62 MET 0.025 0.007 14 0 "[ . 1 . 2]"
1 64 PHE 0.119 0.019 6 0 "[ . 1 . 2]"
1 65 VAL 0.093 0.014 5 0 "[ . 1 . 2]"
1 66 ALA 0.010 0.004 5 0 "[ . 1 . 2]"
1 69 ASN 0.072 0.014 5 0 "[ . 1 . 2]"
1 78 THR 0.055 0.012 12 0 "[ . 1 . 2]"
1 79 VAL 0.030 0.011 2 0 "[ . 1 . 2]"
1 80 THR 0.006 0.006 15 0 "[ . 1 . 2]"
1 81 ALA 0.052 0.010 15 0 "[ . 1 . 2]"
1 82 GLU 0.006 0.003 5 0 "[ . 1 . 2]"
1 83 VAL 0.037 0.006 7 0 "[ . 1 . 2]"
1 84 GLY 0.068 0.011 17 0 "[ . 1 . 2]"
1 85 ILE 0.664 0.028 20 0 "[ . 1 . 2]"
1 86 GLY 0.121 0.019 9 0 "[ . 1 . 2]"
1 88 ASN 0.001 0.001 4 0 "[ . 1 . 2]"
1 92 GLY 0.001 0.001 4 0 "[ . 1 . 2]"
1 94 ALA 0.121 0.019 9 0 "[ . 1 . 2]"
1 96 ASP 0.068 0.011 17 0 "[ . 1 . 2]"
1 97 VAL 0.304 0.029 17 0 "[ . 1 . 2]"
1 98 GLU 0.006 0.003 5 0 "[ . 1 . 2]"
1 99 LEU 0.080 0.008 10 0 "[ . 1 . 2]"
1 100 ARG 0.006 0.006 15 0 "[ . 1 . 2]"
1 101 VAL 0.023 0.007 11 0 "[ . 1 . 2]"
1 102 ALA 0.055 0.012 12 0 "[ . 1 . 2]"
1 107 ASP 0.044 0.008 8 0 "[ . 1 . 2]"
1 108 ALA 0.012 0.004 14 0 "[ . 1 . 2]"
1 110 ALA 0.089 0.011 9 0 "[ . 1 . 2]"
1 111 ALA 0.044 0.008 8 0 "[ . 1 . 2]"
1 112 LYS 0.012 0.004 14 0 "[ . 1 . 2]"
1 113 THR 0.018 0.006 16 0 "[ . 1 . 2]"
1 114 LEU 0.128 0.011 9 0 "[ . 1 . 2]"
1 115 VAL 0.042 0.010 4 0 "[ . 1 . 2]"
1 117 ARG 0.061 0.014 3 0 "[ . 1 . 2]"
1 118 ALA 0.039 0.006 7 0 "[ . 1 . 2]"
1 119 HIS 0.042 0.010 4 0 "[ . 1 . 2]"
1 121 VAL 0.043 0.014 3 0 "[ . 1 . 2]"
1 133 ALA 0.135 0.024 6 0 "[ . 1 . 2]"
1 135 ARG 0.195 0.029 17 0 "[ . 1 . 2]"
1 137 VAL 0.057 0.008 10 0 "[ . 1 . 2]"
1 139 ALA 0.020 0.007 11 0 "[ . 1 . 2]"
2 4 LEU 0.157 0.018 17 0 "[ . 1 . 2]"
2 5 TYR 0.507 0.028 20 0 "[ . 1 . 2]"
2 7 THR 0.037 0.006 7 0 "[ . 1 . 2]"
2 9 ALA 0.052 0.010 15 0 "[ . 1 . 2]"
2 10 THR 0.147 0.018 11 0 "[ . 1 . 2]"
2 11 SER 0.030 0.011 2 0 "[ . 1 . 2]"
2 12 THR 0.134 0.017 10 0 "[ . 1 . 2]"
2 17 GLY 0.714 0.052 14 0 "[ . 1 . 2]"
2 18 ARG 0.134 0.017 10 0 "[ . 1 . 2]"
2 19 ALA 0.080 0.021 14 0 "[ . 1 . 2]"
2 20 THR 0.147 0.018 11 0 "[ . 1 . 2]"
2 21 SER 2.111 0.042 11 0 "[ . 1 . 2]"
2 26 LEU 2.111 0.042 11 0 "[ . 1 . 2]"
2 28 VAL 0.080 0.021 14 0 "[ . 1 . 2]"
2 30 LEU 0.714 0.052 14 0 "[ . 1 . 2]"
2 31 SER 0.013 0.006 20 0 "[ . 1 . 2]"
2 44 THR 0.013 0.006 20 0 "[ . 1 . 2]"
2 46 PRO 0.170 0.016 18 0 "[ . 1 . 2]"
2 47 GLU 0.016 0.008 2 0 "[ . 1 . 2]"
2 48 GLN 0.010 0.005 7 0 "[ . 1 . 2]"
2 49 LEU 0.027 0.007 19 0 "[ . 1 . 2]"
2 50 PHE 0.196 0.016 18 0 "[ . 1 . 2]"
2 51 ALA 0.016 0.008 2 0 "[ . 1 . 2]"
2 52 ALA 0.081 0.016 6 0 "[ . 1 . 2]"
2 53 GLY 0.029 0.007 19 0 "[ . 1 . 2]"
2 54 TYR 0.059 0.009 19 0 "[ . 1 . 2]"
2 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 56 ALA 0.071 0.016 6 0 "[ . 1 . 2]"
2 57 CYS 0.003 0.002 1 0 "[ . 1 . 2]"
2 58 PHE 0.039 0.008 7 0 "[ . 1 . 2]"
2 60 SER 0.179 0.022 18 0 "[ . 1 . 2]"
2 61 ALA 0.002 0.002 17 0 "[ . 1 . 2]"
2 62 MET 0.020 0.004 13 0 "[ . 1 . 2]"
2 64 PHE 0.179 0.022 18 0 "[ . 1 . 2]"
2 65 VAL 0.043 0.010 2 0 "[ . 1 . 2]"
2 66 ALA 0.013 0.004 13 0 "[ . 1 . 2]"
2 69 ASN 0.040 0.010 2 0 "[ . 1 . 2]"
2 78 THR 0.027 0.009 15 0 "[ . 1 . 2]"
2 79 VAL 0.016 0.006 11 0 "[ . 1 . 2]"
2 80 THR 0.006 0.004 11 0 "[ . 1 . 2]"
2 81 ALA 0.040 0.010 12 0 "[ . 1 . 2]"
2 82 GLU 0.031 0.007 20 0 "[ . 1 . 2]"
2 83 VAL 0.053 0.008 10 0 "[ . 1 . 2]"
2 84 GLY 0.105 0.016 15 0 "[ . 1 . 2]"
2 85 ILE 0.721 0.030 12 0 "[ . 1 . 2]"
2 86 GLY 0.087 0.011 8 0 "[ . 1 . 2]"
2 88 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 94 ALA 0.087 0.011 8 0 "[ . 1 . 2]"
2 96 ASP 0.105 0.016 15 0 "[ . 1 . 2]"
2 97 VAL 0.300 0.020 2 0 "[ . 1 . 2]"
2 98 GLU 0.031 0.007 20 0 "[ . 1 . 2]"
2 99 LEU 0.126 0.011 10 0 "[ . 1 . 2]"
2 100 ARG 0.006 0.004 11 0 "[ . 1 . 2]"
2 101 VAL 0.009 0.003 6 0 "[ . 1 . 2]"
2 102 ALA 0.027 0.009 15 0 "[ . 1 . 2]"
2 107 ASP 0.018 0.007 9 0 "[ . 1 . 2]"
2 108 ALA 0.019 0.006 3 0 "[ . 1 . 2]"
2 110 ALA 0.130 0.016 20 0 "[ . 1 . 2]"
2 111 ALA 0.018 0.007 9 0 "[ . 1 . 2]"
2 112 LYS 0.019 0.006 3 0 "[ . 1 . 2]"
2 113 THR 0.017 0.007 19 0 "[ . 1 . 2]"
2 114 LEU 0.184 0.016 20 0 "[ . 1 . 2]"
2 115 VAL 0.063 0.015 10 0 "[ . 1 . 2]"
2 117 ARG 0.017 0.007 19 0 "[ . 1 . 2]"
2 118 ALA 0.054 0.007 5 0 "[ . 1 . 2]"
2 119 HIS 0.063 0.015 10 0 "[ . 1 . 2]"
2 133 ALA 0.186 0.020 2 0 "[ . 1 . 2]"
2 135 ARG 0.168 0.019 7 0 "[ . 1 . 2]"
2 137 VAL 0.074 0.011 10 0 "[ . 1 . 2]"
2 139 ALA 0.006 0.003 6 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 10 THR O 1 20 THR H 2.000 . 2.000 1.930 1.808 2.005 0.005 17 0 "[ . 1 . 2]" 2
2 1 10 THR O 1 20 THR N 3.000 2.700 3.000 2.793 2.695 2.900 0.005 11 0 "[ . 1 . 2]" 2
3 1 12 THR O 1 18 ARG H 2.000 . 2.000 1.986 1.894 2.020 0.020 5 0 "[ . 1 . 2]" 2
4 1 12 THR O 1 18 ARG N 3.000 2.700 3.000 2.749 2.685 2.864 0.015 7 0 "[ . 1 . 2]" 2
5 1 17 GLY O 1 30 LEU H 2.000 . 2.000 1.927 1.873 2.008 0.008 9 0 "[ . 1 . 2]" 2
6 1 17 GLY O 1 30 LEU N 3.000 2.700 3.000 2.799 2.741 2.896 . 0 0 "[ . 1 . 2]" 2
7 1 19 ALA O 1 28 VAL H 2.000 . 2.000 1.864 1.799 1.938 0.001 11 0 "[ . 1 . 2]" 2
8 1 19 ALA O 1 28 VAL N 3.000 2.700 3.000 2.839 2.772 2.920 . 0 0 "[ . 1 . 2]" 2
9 1 10 THR H 1 20 THR O 2.000 . 2.000 1.865 1.780 1.979 0.020 20 0 "[ . 1 . 2]" 2
10 1 10 THR N 1 20 THR O 3.000 2.700 3.000 2.705 2.684 2.764 0.016 15 0 "[ . 1 . 2]" 2
11 1 21 SER O 1 26 LEU H 2.500 . 2.500 2.536 2.528 2.544 0.044 18 0 "[ . 1 . 2]" 2
12 1 21 SER O 1 26 LEU N 3.500 2.700 3.500 3.524 3.516 3.536 0.036 17 0 "[ . 1 . 2]" 2
13 1 21 SER H 1 26 LEU O 2.000 . 2.000 2.021 2.003 2.029 0.029 13 0 "[ . 1 . 2]" 2
14 1 21 SER N 1 26 LEU O 3.000 2.700 3.000 2.679 2.669 2.696 0.031 14 0 "[ . 1 . 2]" 2
15 1 19 ALA H 1 28 VAL O 2.000 . 2.000 1.883 1.796 2.007 0.007 2 0 "[ . 1 . 2]" 2
16 1 19 ALA N 1 28 VAL O 3.000 2.700 3.000 2.764 2.688 2.815 0.012 2 0 "[ . 1 . 2]" 2
17 1 17 GLY H 1 30 LEU O 2.000 . 2.000 2.036 2.018 2.051 0.051 12 0 "[ . 1 . 2]" 2
18 1 17 GLY N 1 30 LEU O 3.000 2.700 3.000 2.808 2.702 2.965 . 0 0 "[ . 1 . 2]" 2
19 1 31 SER H 1 44 THR O 2.000 . 2.000 1.991 1.912 2.012 0.012 11 0 "[ . 1 . 2]" 2
20 1 31 SER N 1 44 THR O 3.000 2.700 3.000 2.902 2.784 2.969 . 0 0 "[ . 1 . 2]" 2
21 1 46 PRO O 1 50 PHE H 2.000 . 2.000 1.996 1.904 2.017 0.017 18 0 "[ . 1 . 2]" 2
22 1 46 PRO O 1 50 PHE N 3.000 2.700 3.000 2.961 2.862 2.988 . 0 0 "[ . 1 . 2]" 2
23 1 47 GLU O 1 51 ALA H 2.000 . 2.000 1.932 1.843 2.012 0.012 1 0 "[ . 1 . 2]" 2
24 1 47 GLU O 1 51 ALA N 3.000 2.700 3.000 2.881 2.734 2.976 . 0 0 "[ . 1 . 2]" 2
25 1 48 GLN O 1 52 ALA H 2.000 . 2.000 1.883 1.793 2.004 0.007 18 0 "[ . 1 . 2]" 2
26 1 48 GLN O 1 52 ALA N 3.000 2.700 3.000 2.837 2.701 2.967 . 0 0 "[ . 1 . 2]" 2
27 1 49 LEU O 1 53 GLY H 2.000 . 2.000 1.949 1.849 2.012 0.012 14 0 "[ . 1 . 2]" 2
28 1 49 LEU O 1 53 GLY N 3.000 2.700 3.000 2.890 2.782 2.984 . 0 0 "[ . 1 . 2]" 2
29 1 50 PHE O 1 54 TYR H 2.000 . 2.000 1.820 1.788 1.878 0.012 16 0 "[ . 1 . 2]" 2
30 1 50 PHE O 1 54 TYR N 3.000 2.700 3.000 2.732 2.691 2.780 0.009 13 0 "[ . 1 . 2]" 2
31 1 51 ALA O 1 55 SER H 2.000 . 2.000 1.940 1.819 2.003 0.003 19 0 "[ . 1 . 2]" 2
32 1 51 ALA O 1 55 SER N 3.000 2.700 3.000 2.871 2.737 2.964 . 0 0 "[ . 1 . 2]" 2
33 1 52 ALA O 1 56 ALA H 2.000 . 2.000 1.969 1.861 2.008 0.008 10 0 "[ . 1 . 2]" 2
34 1 52 ALA O 1 56 ALA N 3.000 2.700 3.000 2.925 2.803 2.985 . 0 0 "[ . 1 . 2]" 2
35 1 53 GLY O 1 57 CYS H 2.000 . 2.000 1.857 1.800 1.928 . 0 0 "[ . 1 . 2]" 2
36 1 53 GLY O 1 57 CYS N 3.000 2.700 3.000 2.753 2.697 2.805 0.003 16 0 "[ . 1 . 2]" 2
37 1 54 TYR O 1 58 PHE H 2.000 . 2.000 1.916 1.810 2.005 0.005 19 0 "[ . 1 . 2]" 2
38 1 54 TYR O 1 58 PHE N 3.000 2.700 3.000 2.747 2.690 2.868 0.010 17 0 "[ . 1 . 2]" 2
39 1 58 PHE O 1 62 MET H 2.000 . 2.000 1.932 1.850 2.007 0.007 14 0 "[ . 1 . 2]" 2
40 1 58 PHE O 1 62 MET N 3.000 2.700 3.000 2.863 2.790 2.952 . 0 0 "[ . 1 . 2]" 2
41 1 60 SER O 1 64 PHE H 2.000 . 2.000 1.999 1.933 2.019 0.019 6 0 "[ . 1 . 2]" 2
42 1 60 SER O 1 64 PHE N 3.000 2.700 3.000 2.940 2.847 2.984 . 0 0 "[ . 1 . 2]" 2
43 1 61 ALA O 1 65 VAL H 2.000 . 2.000 1.836 1.794 1.997 0.006 12 0 "[ . 1 . 2]" 2
44 1 61 ALA O 1 65 VAL N 3.000 2.700 3.000 2.795 2.737 2.958 . 0 0 "[ . 1 . 2]" 2
45 1 62 MET O 1 66 ALA H 2.000 . 2.000 1.910 1.799 2.004 0.004 5 0 "[ . 1 . 2]" 2
46 1 62 MET O 1 66 ALA N 3.000 2.700 3.000 2.845 2.733 2.962 . 0 0 "[ . 1 . 2]" 2
47 1 65 VAL O 1 69 ASN H 2.000 . 2.000 1.993 1.947 2.014 0.014 5 0 "[ . 1 . 2]" 2
48 1 65 VAL O 1 69 ASN N 3.000 2.700 3.000 2.758 2.693 2.864 0.007 19 0 "[ . 1 . 2]" 2
49 1 81 ALA O 2 9 ALA H 2.000 . 2.000 1.952 1.865 2.003 0.003 12 0 "[ . 1 . 2]" 2
50 1 81 ALA O 2 9 ALA N 3.000 2.700 3.000 2.830 2.735 2.914 . 0 0 "[ . 1 . 2]" 2
51 1 79 VAL O 2 11 SER H 2.000 . 2.000 1.861 1.797 1.944 0.003 20 0 "[ . 1 . 2]" 2
52 1 79 VAL O 2 11 SER N 3.000 2.700 3.000 2.763 2.694 2.890 0.006 11 0 "[ . 1 . 2]" 2
53 1 11 SER O 2 79 VAL H 2.000 . 2.000 1.883 1.796 1.968 0.004 4 0 "[ . 1 . 2]" 2
54 1 11 SER O 2 79 VAL N 3.000 2.700 3.000 2.843 2.743 2.943 . 0 0 "[ . 1 . 2]" 2
55 1 9 ALA O 2 81 ALA H 2.000 . 2.000 1.912 1.855 2.001 0.001 17 0 "[ . 1 . 2]" 2
56 1 9 ALA O 2 81 ALA N 3.000 2.700 3.000 2.735 2.690 2.796 0.010 12 0 "[ . 1 . 2]" 2
57 1 83 VAL O 2 7 THR H 2.000 . 2.000 1.857 1.802 1.914 . 0 0 "[ . 1 . 2]" 2
58 1 83 VAL O 2 7 THR N 3.000 2.700 3.000 2.798 2.721 2.867 . 0 0 "[ . 1 . 2]" 2
59 1 7 THR O 2 83 VAL H 2.000 . 2.000 1.988 1.896 2.008 0.008 10 0 "[ . 1 . 2]" 2
60 1 7 THR O 2 83 VAL N 3.000 2.700 3.000 2.840 2.745 2.938 . 0 0 "[ . 1 . 2]" 2
61 1 85 ILE O 2 5 TYR H 2.000 . 2.000 2.020 2.014 2.028 0.028 20 0 "[ . 1 . 2]" 2
62 1 85 ILE O 2 5 TYR N 3.000 2.700 3.000 2.998 2.988 3.005 0.005 15 0 "[ . 1 . 2]" 2
63 1 85 ILE O 2 4 LEU H 2.000 . 2.000 1.877 1.800 1.995 . 0 0 "[ . 1 . 2]" 2
64 1 85 ILE O 2 4 LEU N 3.000 2.700 3.000 2.692 2.682 2.700 0.018 17 0 "[ . 1 . 2]" 2
65 1 5 TYR O 2 85 ILE H 2.000 . 2.000 1.808 1.790 1.848 0.010 3 0 "[ . 1 . 2]" 2
66 1 5 TYR O 2 85 ILE N 3.000 2.700 3.000 2.706 2.688 2.772 0.012 11 0 "[ . 1 . 2]" 2
67 1 86 GLY O 1 94 ALA H 2.000 . 2.000 1.910 1.816 2.002 0.002 7 0 "[ . 1 . 2]" 2
68 1 86 GLY O 1 94 ALA N 3.000 2.700 3.000 2.723 2.694 2.775 0.006 5 0 "[ . 1 . 2]" 2
69 1 88 ASN H 1 92 GLY O 2.000 . 2.000 1.902 1.812 2.001 0.001 4 0 "[ . 1 . 2]" 2
70 1 88 ASN N 1 92 GLY O 3.000 2.700 3.000 2.826 2.701 2.952 . 0 0 "[ . 1 . 2]" 2
71 1 86 GLY H 1 94 ALA O 2.000 . 2.000 1.996 1.935 2.019 0.019 9 0 "[ . 1 . 2]" 2
72 1 86 GLY N 1 94 ALA O 3.000 2.700 3.000 2.969 2.916 2.989 . 0 0 "[ . 1 . 2]" 2
73 1 84 GLY H 1 96 ASP O 2.000 . 2.000 1.833 1.789 1.946 0.011 17 0 "[ . 1 . 2]" 2
74 1 84 GLY N 1 96 ASP O 3.000 2.700 3.000 2.730 2.691 2.777 0.009 10 0 "[ . 1 . 2]" 2
75 1 97 VAL O 1 135 ARG H 2.000 . 2.000 1.898 1.797 2.008 0.008 19 0 "[ . 1 . 2]" 2
76 1 97 VAL O 1 135 ARG N 3.000 2.700 3.000 2.714 2.671 2.892 0.029 17 0 "[ . 1 . 2]" 2
77 1 84 GLY O 1 96 ASP H 2.000 . 2.000 1.879 1.806 1.994 . 0 0 "[ . 1 . 2]" 2
78 1 84 GLY O 1 96 ASP N 3.000 2.700 3.000 2.821 2.718 2.949 . 0 0 "[ . 1 . 2]" 2
79 1 82 GLU H 1 98 GLU O 2.000 . 2.000 1.926 1.840 2.003 0.003 5 0 "[ . 1 . 2]" 2
80 1 82 GLU N 1 98 GLU O 3.000 2.700 3.000 2.886 2.820 2.961 . 0 0 "[ . 1 . 2]" 2
81 1 99 LEU O 1 137 VAL H 2.000 . 2.000 1.984 1.892 2.008 0.008 10 0 "[ . 1 . 2]" 2
82 1 99 LEU O 1 137 VAL N 3.000 2.700 3.000 2.926 2.856 2.985 . 0 0 "[ . 1 . 2]" 2
83 1 101 VAL O 1 139 ALA H 2.000 . 2.000 1.815 1.793 1.875 0.007 11 0 "[ . 1 . 2]" 2
84 1 101 VAL O 1 139 ALA N 3.000 2.700 3.000 2.746 2.707 2.821 . 0 0 "[ . 1 . 2]" 2
85 1 78 THR H 1 102 ALA O 2.000 . 2.000 1.989 1.941 2.012 0.012 12 0 "[ . 1 . 2]" 2
86 1 78 THR N 1 102 ALA O 3.000 2.700 3.000 2.955 2.905 2.994 . 0 0 "[ . 1 . 2]" 2
87 1 82 GLU O 1 98 GLU H 2.000 . 2.000 1.860 1.801 2.001 0.001 14 0 "[ . 1 . 2]" 2
88 1 82 GLU O 1 98 GLU N 3.000 2.700 3.000 2.777 2.699 2.879 0.001 9 0 "[ . 1 . 2]" 2
89 1 80 THR H 1 100 ARG O 2.000 . 2.000 1.869 1.814 1.928 . 0 0 "[ . 1 . 2]" 2
90 1 80 THR N 1 100 ARG O 3.000 2.700 3.000 2.796 2.737 2.852 . 0 0 "[ . 1 . 2]" 2
91 1 80 THR O 1 100 ARG H 2.000 . 2.000 1.913 1.794 1.996 0.006 15 0 "[ . 1 . 2]" 2
92 1 80 THR O 1 100 ARG N 3.000 2.700 3.000 2.859 2.765 2.930 . 0 0 "[ . 1 . 2]" 2
93 1 107 ASP O 1 111 ALA H 2.000 . 2.000 1.947 1.814 2.008 0.008 8 0 "[ . 1 . 2]" 2
94 1 107 ASP O 1 111 ALA N 3.000 2.700 3.000 2.839 2.732 2.893 . 0 0 "[ . 1 . 2]" 2
95 1 108 ALA O 1 112 LYS H 2.000 . 2.000 1.967 1.890 2.004 0.004 14 0 "[ . 1 . 2]" 2
96 1 108 ALA O 1 112 LYS N 3.000 2.700 3.000 2.871 2.774 2.954 . 0 0 "[ . 1 . 2]" 2
97 1 110 ALA O 1 114 LEU H 2.000 . 2.000 1.993 1.918 2.011 0.011 9 0 "[ . 1 . 2]" 2
98 1 110 ALA O 1 114 LEU N 3.000 2.700 3.000 2.936 2.853 2.976 . 0 0 "[ . 1 . 2]" 2
99 1 113 THR O 1 117 ARG H 2.000 . 2.000 1.945 1.818 2.006 0.006 16 0 "[ . 1 . 2]" 2
100 1 113 THR O 1 117 ARG N 3.000 2.700 3.000 2.927 2.797 2.992 . 0 0 "[ . 1 . 2]" 2
101 1 114 LEU O 1 118 ALA H 2.000 . 2.000 1.991 1.922 2.006 0.006 7 0 "[ . 1 . 2]" 2
102 1 114 LEU O 1 118 ALA N 3.000 2.700 3.000 2.912 2.813 2.947 . 0 0 "[ . 1 . 2]" 2
103 1 115 VAL O 1 119 HIS H 2.000 . 2.000 1.948 1.848 2.010 0.010 4 0 "[ . 1 . 2]" 2
104 1 115 VAL O 1 119 HIS N 3.000 2.700 3.000 2.861 2.699 2.995 0.001 19 0 "[ . 1 . 2]" 2
105 1 117 ARG O 1 121 VAL H 2.000 . 2.000 1.952 1.830 2.014 0.014 3 0 "[ . 1 . 2]" 2
106 1 117 ARG O 1 121 VAL N 3.000 2.700 3.000 2.831 2.723 2.941 . 0 0 "[ . 1 . 2]" 2
107 1 97 VAL H 1 133 ALA O 2.000 . 2.000 1.990 1.883 2.024 0.024 6 0 "[ . 1 . 2]" 2
108 1 97 VAL N 1 133 ALA O 3.000 2.700 3.000 2.942 2.852 2.998 . 0 0 "[ . 1 . 2]" 2
109 1 99 LEU H 1 135 ARG O 2.000 . 2.000 1.969 1.832 2.007 0.007 17 0 "[ . 1 . 2]" 2
110 1 99 LEU N 1 135 ARG O 3.000 2.700 3.000 2.860 2.771 2.948 . 0 0 "[ . 1 . 2]" 2
111 1 101 VAL H 1 137 VAL O 2.000 . 2.000 1.936 1.879 2.002 0.002 14 0 "[ . 1 . 2]" 2
112 1 101 VAL N 1 137 VAL O 3.000 2.700 3.000 2.863 2.807 2.922 . 0 0 "[ . 1 . 2]" 2
113 2 10 THR O 2 20 THR H 2.000 . 2.000 1.958 1.822 2.007 0.007 11 0 "[ . 1 . 2]" 2
114 2 10 THR O 2 20 THR N 3.000 2.700 3.000 2.818 2.728 2.882 . 0 0 "[ . 1 . 2]" 2
115 2 12 THR O 2 18 ARG H 2.000 . 2.000 1.992 1.891 2.017 0.017 10 0 "[ . 1 . 2]" 2
116 2 12 THR O 2 18 ARG N 3.000 2.700 3.000 2.761 2.684 2.904 0.016 3 0 "[ . 1 . 2]" 2
117 2 17 GLY O 2 30 LEU H 2.000 . 2.000 1.919 1.844 2.001 0.001 2 0 "[ . 1 . 2]" 2
118 2 17 GLY O 2 30 LEU N 3.000 2.700 3.000 2.787 2.725 2.842 . 0 0 "[ . 1 . 2]" 2
119 2 19 ALA O 2 28 VAL H 2.000 . 2.000 1.865 1.800 1.932 0.000 16 0 "[ . 1 . 2]" 2
120 2 19 ALA O 2 28 VAL N 3.000 2.700 3.000 2.841 2.762 2.913 . 0 0 "[ . 1 . 2]" 2
121 2 10 THR H 2 20 THR O 2.000 . 2.000 1.862 1.789 1.978 0.011 3 0 "[ . 1 . 2]" 2
122 2 10 THR N 2 20 THR O 3.000 2.700 3.000 2.711 2.682 2.754 0.018 11 0 "[ . 1 . 2]" 2
123 2 21 SER O 2 26 LEU H 2.500 . 2.500 2.536 2.530 2.542 0.042 11 0 "[ . 1 . 2]" 2
124 2 21 SER O 2 26 LEU N 3.500 2.700 3.500 3.525 3.511 3.533 0.033 9 0 "[ . 1 . 2]" 2
125 2 21 SER H 2 26 LEU O 2.000 . 2.000 2.022 2.017 2.030 0.030 11 0 "[ . 1 . 2]" 2
126 2 21 SER N 2 26 LEU O 3.000 2.700 3.000 2.678 2.665 2.696 0.035 13 0 "[ . 1 . 2]" 2
127 2 19 ALA H 2 28 VAL O 2.000 . 2.000 1.901 1.802 2.011 0.011 14 0 "[ . 1 . 2]" 2
128 2 19 ALA N 2 28 VAL O 3.000 2.700 3.000 2.756 2.679 2.860 0.021 14 0 "[ . 1 . 2]" 2
129 2 17 GLY H 2 30 LEU O 2.000 . 2.000 2.035 2.023 2.052 0.052 14 0 "[ . 1 . 2]" 2
130 2 17 GLY N 2 30 LEU O 3.000 2.700 3.000 2.789 2.698 2.846 0.002 5 0 "[ . 1 . 2]" 2
131 2 31 SER H 2 44 THR O 2.000 . 2.000 1.926 1.845 2.006 0.006 20 0 "[ . 1 . 2]" 2
132 2 31 SER N 2 44 THR O 3.000 2.700 3.000 2.859 2.726 2.970 . 0 0 "[ . 1 . 2]" 2
133 2 46 PRO O 2 50 PHE H 2.000 . 2.000 2.008 1.985 2.016 0.016 18 0 "[ . 1 . 2]" 2
134 2 46 PRO O 2 50 PHE N 3.000 2.700 3.000 2.978 2.946 2.993 . 0 0 "[ . 1 . 2]" 2
135 2 47 GLU O 2 51 ALA H 2.000 . 2.000 1.930 1.799 2.008 0.008 2 0 "[ . 1 . 2]" 2
136 2 47 GLU O 2 51 ALA N 3.000 2.700 3.000 2.864 2.736 2.959 . 0 0 "[ . 1 . 2]" 2
137 2 48 GLN O 2 52 ALA H 2.000 . 2.000 1.893 1.798 2.005 0.005 7 0 "[ . 1 . 2]" 2
138 2 48 GLN O 2 52 ALA N 3.000 2.700 3.000 2.854 2.711 2.978 . 0 0 "[ . 1 . 2]" 2
139 2 49 LEU O 2 53 GLY H 2.000 . 2.000 1.964 1.890 2.007 0.007 19 0 "[ . 1 . 2]" 2
140 2 49 LEU O 2 53 GLY N 3.000 2.700 3.000 2.919 2.837 2.983 . 0 0 "[ . 1 . 2]" 2
141 2 50 PHE O 2 54 TYR H 2.000 . 2.000 1.828 1.797 1.915 0.003 15 0 "[ . 1 . 2]" 2
142 2 50 PHE O 2 54 TYR N 3.000 2.700 3.000 2.733 2.691 2.818 0.009 19 0 "[ . 1 . 2]" 2
143 2 51 ALA O 2 55 SER H 2.000 . 2.000 1.903 1.826 1.969 . 0 0 "[ . 1 . 2]" 2
144 2 51 ALA O 2 55 SER N 3.000 2.700 3.000 2.844 2.784 2.926 . 0 0 "[ . 1 . 2]" 2
145 2 52 ALA O 2 56 ALA H 2.000 . 2.000 1.986 1.900 2.016 0.016 6 0 "[ . 1 . 2]" 2
146 2 52 ALA O 2 56 ALA N 3.000 2.700 3.000 2.946 2.861 2.994 . 0 0 "[ . 1 . 2]" 2
147 2 53 GLY O 2 57 CYS H 2.000 . 2.000 1.884 1.798 1.999 0.002 1 0 "[ . 1 . 2]" 2
148 2 53 GLY O 2 57 CYS N 3.000 2.700 3.000 2.775 2.700 2.868 0.000 1 0 "[ . 1 . 2]" 2
149 2 54 TYR O 2 58 PHE H 2.000 . 2.000 1.905 1.845 2.004 0.004 12 0 "[ . 1 . 2]" 2
150 2 54 TYR O 2 58 PHE N 3.000 2.700 3.000 2.732 2.692 2.923 0.008 7 0 "[ . 1 . 2]" 2
151 2 58 PHE O 2 62 MET H 2.000 . 2.000 1.927 1.807 2.003 0.003 14 0 "[ . 1 . 2]" 2
152 2 58 PHE O 2 62 MET N 3.000 2.700 3.000 2.840 2.698 2.947 0.002 19 0 "[ . 1 . 2]" 2
153 2 60 SER O 2 64 PHE H 2.000 . 2.000 1.994 1.896 2.022 0.022 18 0 "[ . 1 . 2]" 2
154 2 60 SER O 2 64 PHE N 3.000 2.700 3.000 2.933 2.806 2.984 . 0 0 "[ . 1 . 2]" 2
155 2 61 ALA O 2 65 VAL H 2.000 . 2.000 1.846 1.798 1.983 0.002 17 0 "[ . 1 . 2]" 2
156 2 61 ALA O 2 65 VAL N 3.000 2.700 3.000 2.797 2.742 2.913 . 0 0 "[ . 1 . 2]" 2
157 2 62 MET O 2 66 ALA H 2.000 . 2.000 1.908 1.804 2.004 0.004 13 0 "[ . 1 . 2]" 2
158 2 62 MET O 2 66 ALA N 3.000 2.700 3.000 2.844 2.725 2.981 . 0 0 "[ . 1 . 2]" 2
159 2 65 VAL O 2 69 ASN H 2.000 . 2.000 1.983 1.920 2.010 0.010 2 0 "[ . 1 . 2]" 2
160 2 65 VAL O 2 69 ASN N 3.000 2.700 3.000 2.747 2.695 2.834 0.005 20 0 "[ . 1 . 2]" 2
161 1 11 SER H 2 79 VAL O 2.000 . 2.000 1.844 1.797 1.986 0.003 8 0 "[ . 1 . 2]" 2
162 1 11 SER N 2 79 VAL O 3.000 2.700 3.000 2.764 2.694 2.907 0.006 11 0 "[ . 1 . 2]" 2
163 1 79 VAL H 2 11 SER O 2.000 . 2.000 1.870 1.789 1.982 0.011 2 0 "[ . 1 . 2]" 2
164 1 79 VAL N 2 11 SER O 3.000 2.700 3.000 2.839 2.754 2.944 . 0 0 "[ . 1 . 2]" 2
165 1 9 ALA H 2 81 ALA O 2.000 . 2.000 1.966 1.890 2.004 0.004 11 0 "[ . 1 . 2]" 2
166 1 9 ALA N 2 81 ALA O 3.000 2.700 3.000 2.848 2.700 2.949 0.000 5 0 "[ . 1 . 2]" 2
167 1 81 ALA H 2 9 ALA O 2.000 . 2.000 1.934 1.854 2.009 0.009 15 0 "[ . 1 . 2]" 2
168 1 81 ALA N 2 9 ALA O 3.000 2.700 3.000 2.727 2.690 2.801 0.010 15 0 "[ . 1 . 2]" 2
169 1 7 THR H 2 83 VAL O 2.000 . 2.000 1.871 1.800 1.966 . 0 0 "[ . 1 . 2]" 2
170 1 7 THR N 2 83 VAL O 3.000 2.700 3.000 2.802 2.723 2.915 . 0 0 "[ . 1 . 2]" 2
171 1 83 VAL H 2 7 THR O 2.000 . 2.000 1.989 1.921 2.006 0.006 7 0 "[ . 1 . 2]" 2
172 1 83 VAL N 2 7 THR O 3.000 2.700 3.000 2.841 2.715 2.925 . 0 0 "[ . 1 . 2]" 2
173 1 5 TYR H 2 85 ILE O 2.000 . 2.000 2.021 2.011 2.030 0.030 12 0 "[ . 1 . 2]" 2
174 1 5 TYR N 2 85 ILE O 3.000 2.700 3.000 2.998 2.991 3.004 0.004 12 0 "[ . 1 . 2]" 2
175 1 4 LEU H 2 85 ILE O 2.000 . 2.000 1.853 1.798 1.949 0.002 14 0 "[ . 1 . 2]" 2
176 1 4 LEU N 2 85 ILE O 3.000 2.700 3.000 2.692 2.682 2.698 0.018 17 0 "[ . 1 . 2]" 2
177 1 85 ILE H 2 5 TYR O 2.000 . 2.000 1.815 1.795 1.850 0.005 14 0 "[ . 1 . 2]" 2
178 1 85 ILE N 2 5 TYR O 3.000 2.700 3.000 2.700 2.689 2.726 0.011 10 0 "[ . 1 . 2]" 2
179 2 86 GLY O 2 94 ALA H 2.000 . 2.000 1.896 1.805 1.975 . 0 0 "[ . 1 . 2]" 2
180 2 86 GLY O 2 94 ALA N 3.000 2.700 3.000 2.733 2.694 2.825 0.006 1 0 "[ . 1 . 2]" 2
181 2 88 ASN H 2 92 GLY O 2.000 . 2.000 1.887 1.811 1.977 . 0 0 "[ . 1 . 2]" 2
182 2 88 ASN N 2 92 GLY O 3.000 2.700 3.000 2.787 2.703 2.936 . 0 0 "[ . 1 . 2]" 2
183 2 86 GLY H 2 94 ALA O 2.000 . 2.000 1.986 1.879 2.011 0.011 8 0 "[ . 1 . 2]" 2
184 2 86 GLY N 2 94 ALA O 3.000 2.700 3.000 2.957 2.860 2.989 . 0 0 "[ . 1 . 2]" 2
185 2 84 GLY H 2 96 ASP O 2.000 . 2.000 1.841 1.792 1.944 0.008 6 0 "[ . 1 . 2]" 2
186 2 84 GLY N 2 96 ASP O 3.000 2.700 3.000 2.713 2.684 2.830 0.016 15 0 "[ . 1 . 2]" 2
187 2 97 VAL O 2 135 ARG H 2.000 . 2.000 1.920 1.845 2.004 0.004 18 0 "[ . 1 . 2]" 2
188 2 97 VAL O 2 135 ARG N 3.000 2.700 3.000 2.727 2.681 2.820 0.019 7 0 "[ . 1 . 2]" 2
189 2 84 GLY O 2 96 ASP H 2.000 . 2.000 1.854 1.814 1.899 . 0 0 "[ . 1 . 2]" 2
190 2 84 GLY O 2 96 ASP N 3.000 2.700 3.000 2.802 2.761 2.857 . 0 0 "[ . 1 . 2]" 2
191 2 82 GLU H 2 98 GLU O 2.000 . 2.000 1.948 1.838 2.007 0.007 20 0 "[ . 1 . 2]" 2
192 2 82 GLU N 2 98 GLU O 3.000 2.700 3.000 2.903 2.812 2.981 . 0 0 "[ . 1 . 2]" 2
193 2 99 LEU O 2 137 VAL H 2.000 . 2.000 1.982 1.884 2.011 0.011 10 0 "[ . 1 . 2]" 2
194 2 99 LEU O 2 137 VAL N 3.000 2.700 3.000 2.931 2.837 2.973 . 0 0 "[ . 1 . 2]" 2
195 2 101 VAL O 2 139 ALA H 2.000 . 2.000 1.838 1.797 1.931 0.003 6 0 "[ . 1 . 2]" 2
196 2 101 VAL O 2 139 ALA N 3.000 2.700 3.000 2.765 2.698 2.856 0.002 2 0 "[ . 1 . 2]" 2
197 2 78 THR H 2 102 ALA O 2.000 . 2.000 1.977 1.905 2.009 0.009 15 0 "[ . 1 . 2]" 2
198 2 78 THR N 2 102 ALA O 3.000 2.700 3.000 2.944 2.884 2.989 . 0 0 "[ . 1 . 2]" 2
199 2 82 GLU O 2 98 GLU H 2.000 . 2.000 1.893 1.823 2.003 0.003 20 0 "[ . 1 . 2]" 2
200 2 82 GLU O 2 98 GLU N 3.000 2.700 3.000 2.827 2.726 2.978 . 0 0 "[ . 1 . 2]" 2
201 2 80 THR H 2 100 ARG O 2.000 . 2.000 1.885 1.796 1.984 0.004 11 0 "[ . 1 . 2]" 2
202 2 80 THR N 2 100 ARG O 3.000 2.700 3.000 2.805 2.716 2.908 . 0 0 "[ . 1 . 2]" 2
203 2 80 THR O 2 100 ARG H 2.000 . 2.000 1.899 1.799 1.975 0.001 2 0 "[ . 1 . 2]" 2
204 2 80 THR O 2 100 ARG N 3.000 2.700 3.000 2.836 2.719 2.903 . 0 0 "[ . 1 . 2]" 2
205 2 107 ASP O 2 111 ALA H 2.000 . 2.000 1.906 1.823 2.007 0.007 9 0 "[ . 1 . 2]" 2
206 2 107 ASP O 2 111 ALA N 3.000 2.700 3.000 2.802 2.725 2.884 . 0 0 "[ . 1 . 2]" 2
207 2 108 ALA O 2 112 LYS H 2.000 . 2.000 1.975 1.890 2.006 0.006 3 0 "[ . 1 . 2]" 2
208 2 108 ALA O 2 112 LYS N 3.000 2.700 3.000 2.866 2.722 2.925 . 0 0 "[ . 1 . 2]" 2
209 2 110 ALA O 2 114 LEU H 2.000 . 2.000 2.003 1.976 2.016 0.016 20 0 "[ . 1 . 2]" 2
210 2 110 ALA O 2 114 LEU N 3.000 2.700 3.000 2.947 2.887 2.985 . 0 0 "[ . 1 . 2]" 2
211 2 113 THR O 2 117 ARG H 2.000 . 2.000 1.968 1.907 2.007 0.007 19 0 "[ . 1 . 2]" 2
212 2 113 THR O 2 117 ARG N 3.000 2.700 3.000 2.947 2.890 2.991 . 0 0 "[ . 1 . 2]" 2
213 2 114 LEU O 2 118 ALA H 2.000 . 2.000 1.998 1.951 2.007 0.007 5 0 "[ . 1 . 2]" 2
214 2 114 LEU O 2 118 ALA N 3.000 2.700 3.000 2.923 2.859 2.954 . 0 0 "[ . 1 . 2]" 2
215 2 115 VAL O 2 119 HIS H 2.000 . 2.000 1.946 1.842 2.015 0.015 10 0 "[ . 1 . 2]" 2
216 2 115 VAL O 2 119 HIS N 3.000 2.700 3.000 2.826 2.699 2.994 0.001 15 0 "[ . 1 . 2]" 2
217 2 97 VAL H 2 133 ALA O 2.000 . 2.000 2.002 1.926 2.020 0.020 2 0 "[ . 1 . 2]" 2
218 2 97 VAL N 2 133 ALA O 3.000 2.700 3.000 2.965 2.892 2.999 . 0 0 "[ . 1 . 2]" 2
219 2 99 LEU H 2 135 ARG O 2.000 . 2.000 1.979 1.861 2.008 0.008 3 0 "[ . 1 . 2]" 2
220 2 99 LEU N 2 135 ARG O 3.000 2.700 3.000 2.868 2.811 2.949 . 0 0 "[ . 1 . 2]" 2
221 2 101 VAL H 2 137 VAL O 2.000 . 2.000 1.930 1.846 2.001 0.001 3 0 "[ . 1 . 2]" 2
222 2 101 VAL N 2 137 VAL O 3.000 2.700 3.000 2.853 2.786 2.926 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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