NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
622054 |
5lw4   |
19984 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5lw4
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 1099
_Distance_constraint_stats_list.Viol_count 307
_Distance_constraint_stats_list.Viol_total 462.007
_Distance_constraint_stats_list.Viol_max 0.607
_Distance_constraint_stats_list.Viol_rms 0.0123
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0011
_Distance_constraint_stats_list.Viol_average_violations_only 0.0752
_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 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 GLY 0.029 0.029 20 0 "[ . 1 . 2]"
1 3 PHE 0.361 0.152 5 0 "[ . 1 . 2]"
1 4 ILE 0.371 0.162 9 0 "[ . 1 . 2]"
1 5 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 LYS 1.015 0.139 8 0 "[ . 1 . 2]"
1 7 PRO 0.372 0.135 13 0 "[ . 1 . 2]"
1 8 GLY 0.786 0.139 8 0 "[ . 1 . 2]"
1 9 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ALA 0.009 0.009 15 0 "[ . 1 . 2]"
1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 CYS 0.009 0.009 15 0 "[ . 1 . 2]"
1 15 SER 0.013 0.013 11 0 "[ . 1 . 2]"
1 16 GLU 0.192 0.074 6 0 "[ . 1 . 2]"
1 17 ALA 0.013 0.013 11 0 "[ . 1 . 2]"
1 18 PHE 0.022 0.022 6 0 "[ . 1 . 2]"
1 19 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 PHE 0.109 0.042 9 0 "[ . 1 . 2]"
1 21 LEU 0.178 0.055 6 0 "[ . 1 . 2]"
1 22 ASN 0.182 0.080 5 0 "[ . 1 . 2]"
1 23 LEU 0.100 0.080 5 0 "[ . 1 . 2]"
1 24 ASN 0.098 0.059 4 0 "[ . 1 . 2]"
1 25 CYS 0.078 0.059 4 0 "[ . 1 . 2]"
1 26 GLY 0.074 0.036 19 0 "[ . 1 . 2]"
1 27 SER 0.074 0.036 19 0 "[ . 1 . 2]"
1 28 VAL 0.617 0.270 8 0 "[ . 1 . 2]"
1 29 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 TYR 3.057 0.607 13 1 "[ . 1 + . 2]"
1 31 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 GLN 0.338 0.140 6 0 "[ . 1 . 2]"
1 34 SER 3.057 0.607 13 1 "[ . 1 + . 2]"
1 35 LEU 0.097 0.097 5 0 "[ . 1 . 2]"
1 36 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 LYS 0.098 0.025 17 0 "[ . 1 . 2]"
1 39 LYS 0.161 0.120 14 0 "[ . 1 . 2]"
1 40 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 PHE 0.064 0.064 8 0 "[ . 1 . 2]"
1 42 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 HIS 0.117 0.064 8 0 "[ . 1 . 2]"
1 44 SER 0.189 0.114 13 0 "[ . 1 . 2]"
1 45 GLY 0.135 0.114 13 0 "[ . 1 . 2]"
1 46 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 ALA 0.959 0.220 8 0 "[ . 1 . 2]"
1 48 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 GLY 0.625 0.259 13 0 "[ . 1 . 2]"
1 50 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLY 0.959 0.220 8 0 "[ . 1 . 2]"
1 57 LEU 0.036 0.036 13 0 "[ . 1 . 2]"
1 58 PHE 0.211 0.110 6 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ILE 0.186 0.106 4 0 "[ . 1 . 2]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 SER 0.359 0.074 16 0 "[ . 1 . 2]"
1 67 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ASN 0.617 0.270 8 0 "[ . 1 . 2]"
1 69 ARG 0.359 0.074 16 0 "[ . 1 . 2]"
1 70 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 PHE 0.868 0.252 1 0 "[ . 1 . 2]"
1 72 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 HIS 0.476 0.071 12 0 "[ . 1 . 2]"
1 74 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 MET 0.779 0.096 1 0 "[ . 1 . 2]"
1 76 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 GLU 0.010 0.010 15 0 "[ . 1 . 2]"
1 80 HIS 0.614 0.096 1 0 "[ . 1 . 2]"
1 81 THR 0.120 0.050 8 0 "[ . 1 . 2]"
1 82 PHE 0.377 0.135 13 0 "[ . 1 . 2]"
1 83 THR 0.224 0.085 9 0 "[ . 1 . 2]"
1 84 TRP 0.194 0.162 9 0 "[ . 1 . 2]"
1 85 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 TYR 0.597 0.140 6 0 "[ . 1 . 2]"
1 87 THR 0.283 0.152 5 0 "[ . 1 . 2]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 THR 0.552 0.163 4 0 "[ . 1 . 2]"
1 93 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 GLN 0.007 0.007 7 0 "[ . 1 . 2]"
1 95 TRP 1.745 0.140 18 0 "[ . 1 . 2]"
1 96 HIS 0.019 0.012 5 0 "[ . 1 . 2]"
1 97 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 TYR 0.027 0.027 13 0 "[ . 1 . 2]"
1 99 ILE 0.468 0.246 14 0 "[ . 1 . 2]"
1 100 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 TRP 0.095 0.064 2 0 "[ . 1 . 2]"
1 105 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 LEU 0.257 0.110 6 0 "[ . 1 . 2]"
1 111 LYS 0.218 0.091 16 0 "[ . 1 . 2]"
1 112 ARG 0.512 0.091 16 0 "[ . 1 . 2]"
1 113 ALA 0.343 0.052 9 0 "[ . 1 . 2]"
1 114 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 PHE 0.055 0.044 11 0 "[ . 1 . 2]"
1 116 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 LEU 1.391 0.197 9 0 "[ . 1 . 2]"
1 118 ILE 0.413 0.246 14 0 "[ . 1 . 2]"
1 119 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 ALA 1.391 0.197 9 0 "[ . 1 . 2]"
1 121 VAL 2.613 0.285 17 0 "[ . 1 . 2]"
1 122 PRO 1.512 0.140 18 0 "[ . 1 . 2]"
1 123 HIS 1.199 0.163 4 0 "[ . 1 . 2]"
1 124 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 GLY 0.680 0.125 16 0 "[ . 1 . 2]"
1 126 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 PRO 0.029 0.021 12 0 "[ . 1 . 2]"
1 128 ALA 0.029 0.021 12 0 "[ . 1 . 2]"
1 129 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 130 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 131 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 LEU 0.385 0.116 9 0 "[ . 1 . 2]"
1 133 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 134 HIS 1.455 0.211 20 0 "[ . 1 . 2]"
1 135 HIS 2.008 0.285 17 0 "[ . 1 . 2]"
1 136 ILE 0.438 0.210 5 0 "[ . 1 . 2]"
1 137 TYR 0.010 0.010 15 0 "[ . 1 . 2]"
1 138 ILE 0.000 0.000 16 0 "[ . 1 . 2]"
1 139 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 GLU 0.032 0.032 5 0 "[ . 1 . 2]"
1 141 ASP 0.032 0.032 5 0 "[ . 1 . 2]"
1 142 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 143 LEU 1.545 0.137 4 0 "[ . 1 . 2]"
1 144 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 145 TYR 0.380 0.106 4 0 "[ . 1 . 2]"
1 146 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 ILE 0.653 0.210 5 0 "[ . 1 . 2]"
1 149 LEU 0.029 0.027 13 0 "[ . 1 . 2]"
1 150 ALA 0.059 0.059 9 0 "[ . 1 . 2]"
1 151 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 153 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 154 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 155 ALA 0.033 0.033 2 0 "[ . 1 . 2]"
1 156 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 157 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 158 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 159 ASN 0.142 0.120 14 0 "[ . 1 . 2]"
1 160 ALA 0.234 0.112 17 0 "[ . 1 . 2]"
1 161 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 162 TYR 0.821 0.259 13 0 "[ . 1 . 2]"
1 163 GLN 0.097 0.097 5 0 "[ . 1 . 2]"
1 164 VAL 0.061 0.059 9 0 "[ . 1 . 2]"
1 165 ILE 0.629 0.252 1 0 "[ . 1 . 2]"
1 166 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 167 VAL 0.031 0.015 5 0 "[ . 1 . 2]"
1 168 ASP 0.340 0.083 5 0 "[ . 1 . 2]"
1 169 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 170 VAL 1.270 0.137 4 0 "[ . 1 . 2]"
1 171 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 172 LYS 0.276 0.074 5 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 1 HIS HA 1 2 GLY H 3.210 . 3.810 2.504 2.187 3.542 . 0 0 "[ . 1 . 2]" 1
2 1 1 HIS QB 1 2 GLY H 4.050 . 4.650 3.183 2.153 4.059 . 0 0 "[ . 1 . 2]" 1
3 1 2 GLY H 1 33 GLN QG 5.340 . 5.940 4.534 2.543 5.826 . 0 0 "[ . 1 . 2]" 1
4 1 2 GLY QA 1 3 PHE H 2.990 . 3.590 2.300 2.130 2.411 . 0 0 "[ . 1 . 2]" 1
5 1 2 GLY QA 1 3 PHE QD 5.940 . 6.540 3.472 2.923 4.011 . 0 0 "[ . 1 . 2]" 1
6 1 2 GLY QA 1 86 TYR HA 3.050 . 3.650 2.637 2.025 3.679 0.029 20 0 "[ . 1 . 2]" 1
7 1 3 PHE H 1 3 PHE HA 2.900 . 3.500 2.838 2.779 2.885 . 0 0 "[ . 1 . 2]" 1
8 1 3 PHE H 1 84 TRP QB 5.000 . 5.600 4.733 4.132 5.330 . 0 0 "[ . 1 . 2]" 1
9 1 3 PHE H 1 85 THR H 3.520 . 4.120 3.104 2.700 3.424 . 0 0 "[ . 1 . 2]" 1
10 1 3 PHE H 1 85 THR MG 5.340 . 5.940 3.857 2.745 5.266 . 0 0 "[ . 1 . 2]" 1
11 1 3 PHE H 1 86 TYR HA 3.140 . 3.740 3.394 3.174 3.794 0.054 2 0 "[ . 1 . 2]" 1
12 1 3 PHE HA 1 3 PHE QB 2.580 . 3.180 2.211 2.117 2.341 . 0 0 "[ . 1 . 2]" 1
13 1 3 PHE HA 1 4 ILE H 2.990 . 3.590 2.358 2.195 2.558 . 0 0 "[ . 1 . 2]" 1
14 1 3 PHE QB 1 4 ILE H 3.250 . 3.850 2.624 2.235 3.134 . 0 0 "[ . 1 . 2]" 1
15 1 3 PHE QD 1 4 ILE H 7.500 . 8.100 3.724 2.975 4.354 . 0 0 "[ . 1 . 2]" 1
16 1 3 PHE QD 1 85 THR H 7.440 . 8.040 4.695 4.399 5.306 . 0 0 "[ . 1 . 2]" 1
17 1 3 PHE QD 1 85 THR MG 7.410 . 8.010 3.627 2.384 5.170 . 0 0 "[ . 1 . 2]" 1
18 1 3 PHE QE 1 87 THR HB 4.780 . 5.380 3.894 2.163 5.532 0.152 5 0 "[ . 1 . 2]" 1
19 1 4 ILE H 1 4 ILE HB 3.240 . 3.840 2.570 2.425 2.900 . 0 0 "[ . 1 . 2]" 1
20 1 4 ILE H 1 4 ILE QG 4.310 . 4.910 2.546 2.252 4.070 . 0 0 "[ . 1 . 2]" 1
21 1 4 ILE HA 1 4 ILE MG 3.510 . 4.110 2.476 2.374 3.178 . 0 0 "[ . 1 . 2]" 1
22 1 4 ILE HA 1 5 GLU H 2.930 . 3.530 2.213 2.153 2.258 . 0 0 "[ . 1 . 2]" 1
23 1 4 ILE HA 1 84 TRP HA 2.590 . 3.190 2.532 2.333 2.912 . 0 0 "[ . 1 . 2]" 1
24 1 4 ILE HB 1 4 ILE MD 3.420 . 4.020 2.612 2.256 3.222 . 0 0 "[ . 1 . 2]" 1
25 1 4 ILE MD 1 71 PHE QE 6.200 . 6.800 4.247 2.595 6.594 . 0 0 "[ . 1 . 2]" 1
26 1 4 ILE MD 1 82 PHE QD 6.140 . 6.740 5.248 2.642 6.307 . 0 0 "[ . 1 . 2]" 1
27 1 4 ILE MD 1 84 TRP HD1 6.520 . 7.120 3.966 2.454 5.464 . 0 0 "[ . 1 . 2]" 1
28 1 4 ILE MD 1 84 TRP HE1 4.940 . 5.540 3.375 2.205 4.218 . 0 0 "[ . 1 . 2]" 1
29 1 4 ILE MD 1 165 ILE MD 4.630 . 5.230 2.789 1.953 4.554 . 0 0 "[ . 1 . 2]" 1
30 1 4 ILE MG 1 5 GLU H 5.590 . 6.190 2.973 2.758 3.871 . 0 0 "[ . 1 . 2]" 1
31 1 4 ILE MG 1 6 LYS H 3.420 . 4.020 2.523 1.821 4.111 0.091 9 0 "[ . 1 . 2]" 1
32 1 4 ILE MG 1 83 THR H 4.440 . 5.040 3.859 3.326 5.125 0.085 9 0 "[ . 1 . 2]" 1
33 1 4 ILE MG 1 84 TRP HA 3.980 . 4.580 3.794 3.346 4.742 0.162 9 0 "[ . 1 . 2]" 1
34 1 4 ILE MG 1 84 TRP HD1 3.420 . 4.020 2.756 2.064 4.052 0.032 8 0 "[ . 1 . 2]" 1
35 1 5 GLU H 1 5 GLU HB2 3.330 . 3.930 2.480 2.200 2.733 . 0 0 "[ . 1 . 2]" 1
36 1 5 GLU H 1 5 GLU QB 2.750 . 3.350 2.269 2.133 2.417 . 0 0 "[ . 1 . 2]" 1
37 1 5 GLU H 1 5 GLU HB3 3.330 . 3.930 2.845 2.403 3.590 . 0 0 "[ . 1 . 2]" 1
38 1 5 GLU H 1 6 LYS H 2.430 . 3.030 2.430 2.096 2.936 . 0 0 "[ . 1 . 2]" 1
39 1 5 GLU H 1 84 TRP HA 2.900 . 3.500 2.760 2.369 3.472 . 0 0 "[ . 1 . 2]" 1
40 1 5 GLU HA 1 6 LYS H 3.480 . 4.080 3.316 2.732 3.476 . 0 0 "[ . 1 . 2]" 1
41 1 5 GLU QB 1 6 LYS H 4.380 . 4.980 2.825 2.364 3.762 . 0 0 "[ . 1 . 2]" 1
42 1 5 GLU QB 1 83 THR H 5.340 . 5.940 4.305 3.906 4.784 . 0 0 "[ . 1 . 2]" 1
43 1 5 GLU QG 1 6 LYS H 4.790 . 5.390 4.056 3.554 4.667 . 0 0 "[ . 1 . 2]" 1
44 1 6 LYS H 1 83 THR H 3.920 . 4.520 3.396 2.676 4.594 0.074 3 0 "[ . 1 . 2]" 1
45 1 6 LYS H 1 83 THR HB 5.500 . 6.100 3.452 2.336 5.330 . 0 0 "[ . 1 . 2]" 1
46 1 6 LYS HA 1 8 GLY H 2.620 . 3.220 2.831 1.980 3.359 0.139 8 0 "[ . 1 . 2]" 1
47 1 6 LYS QB 1 8 GLY H 3.770 . 4.370 3.702 2.723 4.463 0.093 4 0 "[ . 1 . 2]" 1
48 1 6 LYS QG 1 8 GLY H 4.000 . 4.600 3.698 2.693 4.616 0.016 15 0 "[ . 1 . 2]" 1
49 1 7 PRO HA 1 8 GLY H 2.400 . 3.000 2.138 2.024 2.256 . 0 0 "[ . 1 . 2]" 1
50 1 7 PRO QB 1 8 GLY H 3.340 . 3.940 3.299 2.867 3.774 . 0 0 "[ . 1 . 2]" 1
51 1 7 PRO QB 1 73 HIS HD2 5.340 . 5.940 5.072 2.113 6.009 0.069 14 0 "[ . 1 . 2]" 1
52 1 7 PRO QD 1 82 PHE HA 3.770 . 4.370 2.620 2.057 4.505 0.135 13 0 "[ . 1 . 2]" 1
53 1 7 PRO QD 1 82 PHE QD 4.430 . 5.030 2.817 2.229 4.283 . 0 0 "[ . 1 . 2]" 1
54 1 7 PRO QD 1 83 THR H 4.210 . 4.810 3.587 3.127 4.485 . 0 0 "[ . 1 . 2]" 1
55 1 8 GLY H 1 9 SER H 4.420 . 5.020 3.843 2.289 4.668 . 0 0 "[ . 1 . 2]" 1
56 1 8 GLY HA2 1 9 SER H 3.240 . 3.840 2.686 2.148 3.420 . 0 0 "[ . 1 . 2]" 1
57 1 8 GLY HA3 1 9 SER H 3.240 . 3.840 2.854 2.312 3.437 . 0 0 "[ . 1 . 2]" 1
58 1 9 SER H 1 9 SER QB 3.190 . 3.790 2.468 2.250 2.842 . 0 0 "[ . 1 . 2]" 1
59 1 9 SER HA 1 10 ARG H 3.450 . 4.050 2.251 2.164 2.352 . 0 0 "[ . 1 . 2]" 1
60 1 9 SER HA 1 11 ALA H 3.790 . 4.390 3.762 3.337 4.067 . 0 0 "[ . 1 . 2]" 1
61 1 9 SER HA 1 12 ALA H 4.790 . 5.390 4.825 4.427 5.351 . 0 0 "[ . 1 . 2]" 1
62 1 10 ARG H 1 10 ARG HB2 3.760 . 4.360 3.073 2.120 3.604 . 0 0 "[ . 1 . 2]" 1
63 1 10 ARG H 1 10 ARG HB3 3.760 . 4.360 2.705 2.451 3.584 . 0 0 "[ . 1 . 2]" 1
64 1 10 ARG H 1 11 ALA H 3.210 . 3.810 2.517 2.299 2.670 . 0 0 "[ . 1 . 2]" 1
65 1 10 ARG HA 1 12 ALA H 4.070 . 4.670 3.948 3.683 4.266 . 0 0 "[ . 1 . 2]" 1
66 1 10 ARG HA 1 13 LEU H 4.790 . 5.390 3.579 3.169 4.104 . 0 0 "[ . 1 . 2]" 1
67 1 10 ARG HA 1 13 LEU QB 4.150 . 4.750 3.552 2.779 4.423 . 0 0 "[ . 1 . 2]" 1
68 1 10 ARG HB2 1 11 ALA H 4.170 . 4.770 3.886 2.692 4.340 . 0 0 "[ . 1 . 2]" 1
69 1 10 ARG HB3 1 11 ALA H 4.170 . 4.770 3.672 2.699 4.232 . 0 0 "[ . 1 . 2]" 1
70 1 11 ALA H 1 12 ALA H 2.930 . 3.530 2.719 2.570 2.850 . 0 0 "[ . 1 . 2]" 1
71 1 11 ALA HA 1 13 LEU H 3.700 . 4.300 3.956 3.738 4.223 . 0 0 "[ . 1 . 2]" 1
72 1 11 ALA HA 1 14 CYS H 4.790 . 5.390 3.234 3.077 3.511 . 0 0 "[ . 1 . 2]" 1
73 1 11 ALA HA 1 14 CYS HB2 2.960 . 3.560 2.879 2.286 3.569 0.009 15 0 "[ . 1 . 2]" 1
74 1 11 ALA MB 1 12 ALA H 4.290 . 4.890 2.791 2.697 2.964 . 0 0 "[ . 1 . 2]" 1
75 1 12 ALA H 1 12 ALA HA 2.930 . 3.530 2.755 2.729 2.790 . 0 0 "[ . 1 . 2]" 1
76 1 12 ALA H 1 12 ALA MB 3.420 . 4.020 2.233 2.224 2.248 . 0 0 "[ . 1 . 2]" 1
77 1 12 ALA H 1 13 LEU H 2.900 . 3.500 2.648 2.511 2.772 . 0 0 "[ . 1 . 2]" 1
78 1 12 ALA HA 1 14 CYS H 4.760 . 5.360 3.913 3.593 4.418 . 0 0 "[ . 1 . 2]" 1
79 1 12 ALA HA 1 15 SER H 4.790 . 5.390 3.994 3.437 4.698 . 0 0 "[ . 1 . 2]" 1
80 1 12 ALA HA 1 15 SER QB 5.030 . 5.630 3.871 3.209 4.755 . 0 0 "[ . 1 . 2]" 1
81 1 12 ALA MB 1 13 LEU H 3.790 . 4.390 2.769 2.499 2.911 . 0 0 "[ . 1 . 2]" 1
82 1 13 LEU H 1 13 LEU QB 3.250 . 3.850 2.364 2.146 2.486 . 0 0 "[ . 1 . 2]" 1
83 1 13 LEU H 1 14 CYS H 2.990 . 3.590 2.318 2.161 2.470 . 0 0 "[ . 1 . 2]" 1
84 1 13 LEU HA 1 14 CYS H 3.390 . 3.990 3.265 3.189 3.402 . 0 0 "[ . 1 . 2]" 1
85 1 13 LEU QB 1 14 CYS H 2.960 . 3.560 3.136 2.583 3.412 . 0 0 "[ . 1 . 2]" 1
86 1 13 LEU QB 1 73 HIS HE1 5.340 . 5.940 4.786 3.361 5.925 . 0 0 "[ . 1 . 2]" 1
87 1 13 LEU HB2 1 14 CYS H 3.700 . 4.300 3.282 2.639 3.643 . 0 0 "[ . 1 . 2]" 1
88 1 13 LEU HB3 1 14 CYS H 3.700 . 4.300 4.012 3.651 4.227 . 0 0 "[ . 1 . 2]" 1
89 1 13 LEU QD 1 71 PHE QE 7.300 . 7.900 4.316 2.277 5.557 . 0 0 "[ . 1 . 2]" 1
90 1 13 LEU QD 1 73 HIS HE1 3.590 . 4.190 2.473 1.865 3.408 . 0 0 "[ . 1 . 2]" 1
91 1 13 LEU QD 1 74 ILE H 5.140 . 5.740 4.887 3.663 5.642 . 0 0 "[ . 1 . 2]" 1
92 1 14 CYS CB 1 25 CYS SG 3.100 . 3.700 3.050 3.010 3.080 . 0 0 "[ . 1 . 2]" 1
93 1 14 CYS H 1 14 CYS HB2 2.830 . 3.430 2.504 2.234 2.830 . 0 0 "[ . 1 . 2]" 1
94 1 14 CYS H 1 14 CYS HB3 2.400 . 3.000 2.411 2.101 2.745 . 0 0 "[ . 1 . 2]" 1
95 1 14 CYS H 1 15 SER H 2.960 . 3.560 2.359 1.968 2.632 . 0 0 "[ . 1 . 2]" 1
96 1 14 CYS HB2 1 15 SER H 4.110 . 4.710 3.905 3.674 4.138 . 0 0 "[ . 1 . 2]" 1
97 1 14 CYS HB3 1 15 SER H 2.830 . 3.430 2.918 2.452 3.331 . 0 0 "[ . 1 . 2]" 1
98 1 14 CYS SG 1 25 CYS CB 3.100 . 3.700 3.043 2.981 3.106 . 0 0 "[ . 1 . 2]" 1
99 1 14 CYS SG 1 25 CYS SG 2.100 . 2.700 2.030 2.024 2.037 . 0 0 "[ . 1 . 2]" 1
100 1 15 SER H 1 16 GLU H 5.500 . 6.100 4.596 4.527 4.646 . 0 0 "[ . 1 . 2]" 1
101 1 15 SER HA 1 15 SER HB2 2.990 . 3.590 2.480 2.366 2.926 . 0 0 "[ . 1 . 2]" 1
102 1 15 SER HA 1 15 SER QB 2.480 . 3.080 2.291 2.167 2.463 . 0 0 "[ . 1 . 2]" 1
103 1 15 SER HA 1 15 SER HB3 2.990 . 3.590 2.795 2.383 2.934 . 0 0 "[ . 1 . 2]" 1
104 1 15 SER HA 1 16 GLU H 2.400 . 3.000 2.237 2.110 2.355 . 0 0 "[ . 1 . 2]" 1
105 1 15 SER HA 1 17 ALA H 4.510 . 5.110 3.822 3.548 5.072 . 0 0 "[ . 1 . 2]" 1
106 1 15 SER HB2 1 16 GLU H 4.320 . 4.920 3.825 2.678 4.160 . 0 0 "[ . 1 . 2]" 1
107 1 15 SER HB2 1 17 ALA H 5.000 . 5.600 3.860 2.534 5.613 0.013 11 0 "[ . 1 . 2]" 1
108 1 15 SER HB3 1 16 GLU H 4.320 . 4.920 3.827 2.982 4.124 . 0 0 "[ . 1 . 2]" 1
109 1 15 SER HB3 1 17 ALA H 5.000 . 5.600 3.372 2.226 4.650 . 0 0 "[ . 1 . 2]" 1
110 1 16 GLU H 1 16 GLU HB2 3.640 . 4.240 2.762 2.240 3.533 . 0 0 "[ . 1 . 2]" 1
111 1 16 GLU H 1 16 GLU QB 2.900 . 3.500 2.391 2.191 2.511 . 0 0 "[ . 1 . 2]" 1
112 1 16 GLU H 1 16 GLU HB3 3.640 . 4.240 3.134 2.376 3.518 . 0 0 "[ . 1 . 2]" 1
113 1 16 GLU H 1 17 ALA H 2.860 . 3.460 2.639 2.508 3.007 . 0 0 "[ . 1 . 2]" 1
114 1 16 GLU H 1 17 ALA MB 5.900 . 6.500 4.319 4.180 4.976 . 0 0 "[ . 1 . 2]" 1
115 1 16 GLU QB 1 18 PHE H 4.500 . 5.100 4.457 3.773 4.741 . 0 0 "[ . 1 . 2]" 1
116 1 16 GLU QB 1 19 GLY H 4.680 . 5.280 4.522 4.008 4.934 . 0 0 "[ . 1 . 2]" 1
117 1 16 GLU QB 1 21 LEU H 5.340 . 5.940 5.568 4.706 5.995 0.055 6 0 "[ . 1 . 2]" 1
118 1 16 GLU QB 1 22 ASN H 5.340 . 5.940 5.047 3.818 6.014 0.074 6 0 "[ . 1 . 2]" 1
119 1 16 GLU HB2 1 17 ALA H 3.790 . 4.390 3.385 2.756 4.122 . 0 0 "[ . 1 . 2]" 1
120 1 16 GLU HB3 1 17 ALA H 3.790 . 4.390 3.877 1.956 4.145 . 0 0 "[ . 1 . 2]" 1
121 1 17 ALA H 1 17 ALA MB 3.420 . 4.020 2.232 2.199 2.479 . 0 0 "[ . 1 . 2]" 1
122 1 17 ALA H 1 18 PHE H 2.620 . 3.220 2.729 2.189 2.908 . 0 0 "[ . 1 . 2]" 1
123 1 17 ALA H 1 19 GLY H 4.200 . 4.800 4.351 3.657 4.513 . 0 0 "[ . 1 . 2]" 1
124 1 17 ALA HA 1 18 PHE H 3.420 . 4.020 3.341 3.296 3.433 . 0 0 "[ . 1 . 2]" 1
125 1 17 ALA HA 1 20 PHE H 4.790 . 5.390 4.279 3.073 5.284 . 0 0 "[ . 1 . 2]" 1
126 1 17 ALA MB 1 18 PHE H 3.950 . 4.550 3.038 2.477 3.151 . 0 0 "[ . 1 . 2]" 1
127 1 17 ALA MB 1 19 GLY H 5.560 . 6.160 4.423 4.290 4.521 . 0 0 "[ . 1 . 2]" 1
128 1 18 PHE H 1 19 GLY H 2.680 . 3.280 2.553 1.924 2.700 . 0 0 "[ . 1 . 2]" 1
129 1 18 PHE HA 1 19 GLY H 3.300 . 3.900 3.284 2.879 3.379 . 0 0 "[ . 1 . 2]" 1
130 1 18 PHE QB 1 19 GLY H 3.830 . 4.430 3.285 3.048 3.764 . 0 0 "[ . 1 . 2]" 1
131 1 18 PHE QB 1 20 PHE H 4.180 . 4.780 4.438 3.944 4.802 0.022 6 0 "[ . 1 . 2]" 1
132 1 18 PHE HB2 1 19 GLY H 4.380 . 4.980 4.104 3.205 4.268 . 0 0 "[ . 1 . 2]" 1
133 1 18 PHE HB3 1 19 GLY H 4.380 . 4.980 3.508 3.157 4.438 . 0 0 "[ . 1 . 2]" 1
134 1 19 GLY H 1 19 GLY QA 2.300 . 2.900 2.408 2.223 2.457 . 0 0 "[ . 1 . 2]" 1
135 1 19 GLY QA 1 20 PHE H 2.980 . 3.580 2.771 2.513 2.876 . 0 0 "[ . 1 . 2]" 1
136 1 19 GLY HA2 1 20 PHE H 3.550 . 4.150 3.251 2.578 3.428 . 0 0 "[ . 1 . 2]" 1
137 1 19 GLY HA3 1 20 PHE H 3.550 . 4.150 3.066 2.822 3.478 . 0 0 "[ . 1 . 2]" 1
138 1 20 PHE H 1 20 PHE HB2 3.550 . 4.150 3.023 2.351 3.146 . 0 0 "[ . 1 . 2]" 1
139 1 20 PHE H 1 20 PHE HB3 3.550 . 4.150 3.666 2.621 3.942 . 0 0 "[ . 1 . 2]" 1
140 1 20 PHE H 1 21 LEU H 3.170 . 3.770 3.258 2.663 3.812 0.042 9 0 "[ . 1 . 2]" 1
141 1 20 PHE H 1 22 ASN H 4.170 . 4.770 3.857 3.388 4.296 . 0 0 "[ . 1 . 2]" 1
142 1 20 PHE HA 1 21 LEU H 3.550 . 4.150 3.265 2.769 3.494 . 0 0 "[ . 1 . 2]" 1
143 1 20 PHE QB 1 21 LEU H 3.880 . 4.480 3.065 2.269 3.862 . 0 0 "[ . 1 . 2]" 1
144 1 21 LEU H 1 21 LEU HA 2.860 . 3.460 2.818 2.756 2.872 . 0 0 "[ . 1 . 2]" 1
145 1 21 LEU H 1 21 LEU HG 3.050 . 3.650 2.470 2.252 2.795 . 0 0 "[ . 1 . 2]" 1
146 1 21 LEU H 1 22 ASN H 3.210 . 3.810 2.372 2.104 2.625 . 0 0 "[ . 1 . 2]" 1
147 1 21 LEU QB 1 22 ASN H 3.350 . 3.950 3.011 2.462 3.355 . 0 0 "[ . 1 . 2]" 1
148 1 21 LEU QD 1 22 ASN H 6.420 . 7.020 4.273 4.000 4.420 . 0 0 "[ . 1 . 2]" 1
149 1 21 LEU HG 1 22 ASN H 4.720 . 5.320 4.459 4.158 4.669 . 0 0 "[ . 1 . 2]" 1
150 1 22 ASN H 1 22 ASN QB 3.010 . 3.610 2.711 2.272 3.315 . 0 0 "[ . 1 . 2]" 1
151 1 22 ASN HA 1 23 LEU H 2.460 . 3.060 2.434 2.169 2.880 . 0 0 "[ . 1 . 2]" 1
152 1 22 ASN QB 1 23 LEU H 3.020 . 3.620 2.811 2.083 3.700 0.080 5 0 "[ . 1 . 2]" 1
153 1 23 LEU H 1 23 LEU HA 2.770 . 3.370 2.835 2.789 2.886 . 0 0 "[ . 1 . 2]" 1
154 1 23 LEU H 1 23 LEU HG 3.330 . 3.930 3.509 2.692 3.892 . 0 0 "[ . 1 . 2]" 1
155 1 23 LEU HA 1 24 ASN H 2.800 . 3.400 2.371 2.131 2.491 . 0 0 "[ . 1 . 2]" 1
156 1 23 LEU HB2 1 24 ASN H 3.890 . 4.490 3.339 2.630 4.419 . 0 0 "[ . 1 . 2]" 1
157 1 23 LEU HB3 1 24 ASN H 3.890 . 4.490 3.392 2.293 4.135 . 0 0 "[ . 1 . 2]" 1
158 1 23 LEU HG 1 24 ASN H 3.420 . 4.020 3.834 3.477 4.030 0.010 11 0 "[ . 1 . 2]" 1
159 1 24 ASN H 1 24 ASN HA 2.680 . 3.280 2.781 2.120 2.915 . 0 0 "[ . 1 . 2]" 1
160 1 24 ASN H 1 24 ASN HB2 3.920 . 4.520 2.979 2.220 3.860 . 0 0 "[ . 1 . 2]" 1
161 1 24 ASN H 1 24 ASN QB 3.420 . 4.020 2.655 2.194 3.129 . 0 0 "[ . 1 . 2]" 1
162 1 24 ASN H 1 24 ASN HB3 3.920 . 4.520 3.211 2.698 3.786 . 0 0 "[ . 1 . 2]" 1
163 1 24 ASN H 1 25 CYS H 2.680 . 3.280 2.845 2.054 3.339 0.059 4 0 "[ . 1 . 2]" 1
164 1 24 ASN HA 1 25 CYS H 2.900 . 3.500 2.819 2.285 3.401 . 0 0 "[ . 1 . 2]" 1
165 1 24 ASN QB 1 25 CYS H 4.110 . 4.710 3.729 2.892 4.026 . 0 0 "[ . 1 . 2]" 1
166 1 24 ASN HB2 1 25 CYS H 4.690 . 5.290 4.204 2.992 4.611 . 0 0 "[ . 1 . 2]" 1
167 1 24 ASN HB3 1 25 CYS H 4.690 . 5.290 4.243 3.561 4.584 . 0 0 "[ . 1 . 2]" 1
168 1 25 CYS H 1 25 CYS HB2 2.930 . 3.530 2.673 2.055 3.411 . 0 0 "[ . 1 . 2]" 1
169 1 25 CYS H 1 25 CYS HB3 2.930 . 3.530 2.972 2.555 3.482 . 0 0 "[ . 1 . 2]" 1
170 1 25 CYS H 1 26 GLY H 2.490 . 3.090 2.221 1.501 2.900 . 0 0 "[ . 1 . 2]" 1
171 1 25 CYS QB 1 26 GLY H 3.250 . 3.850 2.792 1.920 3.548 . 0 0 "[ . 1 . 2]" 1
172 1 25 CYS HB2 1 26 GLY H 3.830 . 4.430 3.673 2.908 4.253 . 0 0 "[ . 1 . 2]" 1
173 1 25 CYS HB3 1 26 GLY H 3.830 . 4.430 2.948 1.931 4.252 . 0 0 "[ . 1 . 2]" 1
174 1 26 GLY H 1 26 GLY HA2 2.830 . 3.430 2.299 2.253 2.719 . 0 0 "[ . 1 . 2]" 1
175 1 26 GLY H 1 26 GLY HA3 2.830 . 3.430 2.791 2.247 2.874 . 0 0 "[ . 1 . 2]" 1
176 1 26 GLY H 1 27 SER H 3.980 . 4.580 4.365 3.130 4.616 0.036 19 0 "[ . 1 . 2]" 1
177 1 26 GLY HA2 1 27 SER H 3.360 . 3.960 2.520 2.193 3.529 . 0 0 "[ . 1 . 2]" 1
178 1 26 GLY HA3 1 27 SER H 3.360 . 3.960 2.704 2.279 3.089 . 0 0 "[ . 1 . 2]" 1
179 1 27 SER H 1 27 SER HA 2.900 . 3.500 2.776 2.724 2.824 . 0 0 "[ . 1 . 2]" 1
180 1 27 SER H 1 28 VAL H 3.390 . 3.990 2.594 2.389 2.828 . 0 0 "[ . 1 . 2]" 1
181 1 27 SER HA 1 29 MET H 3.790 . 4.390 3.490 3.194 4.028 . 0 0 "[ . 1 . 2]" 1
182 1 28 VAL H 1 28 VAL HB 2.830 . 3.430 2.561 2.323 3.250 . 0 0 "[ . 1 . 2]" 1
183 1 28 VAL H 1 28 VAL MG1 3.850 . 4.450 2.946 2.298 3.774 . 0 0 "[ . 1 . 2]" 1
184 1 28 VAL H 1 28 VAL QG 3.340 . 3.940 2.097 1.684 2.369 . 0 0 "[ . 1 . 2]" 1
185 1 28 VAL H 1 28 VAL MG2 3.850 . 4.450 2.868 1.686 3.749 . 0 0 "[ . 1 . 2]" 1
186 1 28 VAL H 1 29 MET H 2.990 . 3.590 2.719 2.485 2.919 . 0 0 "[ . 1 . 2]" 1
187 1 28 VAL HB 1 29 MET H 3.950 . 4.550 3.767 2.869 4.281 . 0 0 "[ . 1 . 2]" 1
188 1 28 VAL QG 1 29 MET H 3.470 . 4.070 3.121 2.688 3.607 . 0 0 "[ . 1 . 2]" 1
189 1 28 VAL QG 1 30 TYR H 4.260 . 4.860 4.211 3.894 4.594 . 0 0 "[ . 1 . 2]" 1
190 1 28 VAL QG 1 68 ASN QB 4.600 . 5.200 4.116 2.565 5.470 0.270 8 0 "[ . 1 . 2]" 1
191 1 29 MET H 1 29 MET QB 2.680 . 3.280 2.374 2.293 2.483 . 0 0 "[ . 1 . 2]" 1
192 1 29 MET H 1 29 MET QG 2.420 . 3.020 2.250 2.107 2.372 . 0 0 "[ . 1 . 2]" 1
193 1 29 MET H 1 30 TYR H 2.960 . 3.560 2.867 2.500 3.084 . 0 0 "[ . 1 . 2]" 1
194 1 29 MET QG 1 30 TYR H 3.830 . 4.430 2.750 2.433 2.998 . 0 0 "[ . 1 . 2]" 1
195 1 30 TYR H 1 30 TYR HB2 3.020 . 3.620 2.658 2.482 2.958 . 0 0 "[ . 1 . 2]" 1
196 1 30 TYR H 1 30 TYR HB3 3.300 . 3.900 2.387 2.185 2.572 . 0 0 "[ . 1 . 2]" 1
197 1 30 TYR H 1 31 GLU H 3.360 . 3.960 2.539 2.110 2.762 . 0 0 "[ . 1 . 2]" 1
198 1 30 TYR HA 1 30 TYR HB2 2.400 . 3.000 2.371 2.270 2.448 . 0 0 "[ . 1 . 2]" 1
199 1 30 TYR HB3 1 31 GLU H 2.900 . 3.500 2.713 2.465 3.204 . 0 0 "[ . 1 . 2]" 1
200 1 30 TYR QE 1 34 SER HB2 6.080 . 6.680 6.778 6.339 7.287 0.607 13 1 "[ . 1 + . 2]" 1
201 1 31 GLU HA 1 33 GLN H 5.500 . 6.100 3.283 3.036 3.841 . 0 0 "[ . 1 . 2]" 1
202 1 31 GLU QB 1 34 SER H 4.380 . 4.980 3.235 2.298 4.127 . 0 0 "[ . 1 . 2]" 1
203 1 32 PRO HB2 1 33 GLN H 3.450 . 4.050 3.709 3.218 3.995 . 0 0 "[ . 1 . 2]" 1
204 1 32 PRO QD 1 33 GLN H 4.560 . 5.160 2.755 2.577 3.002 . 0 0 "[ . 1 . 2]" 1
205 1 33 GLN H 1 33 GLN QB 2.880 . 3.480 2.586 2.244 2.957 . 0 0 "[ . 1 . 2]" 1
206 1 33 GLN H 1 34 SER H 2.860 . 3.460 2.439 2.205 2.727 . 0 0 "[ . 1 . 2]" 1
207 1 33 GLN QB 1 34 SER H 4.210 . 4.810 3.678 2.719 3.927 . 0 0 "[ . 1 . 2]" 1
208 1 33 GLN HB2 1 34 SER H 4.790 . 5.390 4.170 3.764 4.462 . 0 0 "[ . 1 . 2]" 1
209 1 33 GLN HB3 1 34 SER H 4.790 . 5.390 4.153 2.779 4.567 . 0 0 "[ . 1 . 2]" 1
210 1 33 GLN QG 1 86 TYR QE 5.660 . 6.260 5.376 3.740 6.400 0.140 6 0 "[ . 1 . 2]" 1
211 1 34 SER H 1 34 SER HB2 3.110 . 3.710 2.720 2.402 3.063 . 0 0 "[ . 1 . 2]" 1
212 1 34 SER H 1 34 SER HB3 3.140 . 3.740 2.888 2.552 3.622 . 0 0 "[ . 1 . 2]" 1
213 1 34 SER H 1 35 LEU H 5.500 . 6.100 3.951 3.415 4.383 . 0 0 "[ . 1 . 2]" 1
214 1 34 SER HA 1 34 SER HB2 2.520 . 3.120 2.568 2.410 2.920 . 0 0 "[ . 1 . 2]" 1
215 1 34 SER HA 1 35 LEU H 3.550 . 4.150 2.258 2.152 2.469 . 0 0 "[ . 1 . 2]" 1
216 1 34 SER HB2 1 35 LEU H 5.130 . 5.730 4.531 4.302 4.640 . 0 0 "[ . 1 . 2]" 1
217 1 35 LEU H 1 35 LEU HB2 3.580 . 4.180 2.619 2.146 3.091 . 0 0 "[ . 1 . 2]" 1
218 1 35 LEU H 1 35 LEU QB 2.780 . 3.380 2.483 2.108 2.636 . 0 0 "[ . 1 . 2]" 1
219 1 35 LEU H 1 35 LEU HB3 3.580 . 4.180 3.392 2.477 3.738 . 0 0 "[ . 1 . 2]" 1
220 1 35 LEU H 1 36 GLU H 5.340 . 5.940 4.227 3.518 4.515 . 0 0 "[ . 1 . 2]" 1
221 1 35 LEU HA 1 35 LEU QD 3.440 . 4.040 2.346 2.122 2.913 . 0 0 "[ . 1 . 2]" 1
222 1 35 LEU HA 1 36 GLU H 2.490 . 3.090 2.273 2.152 2.425 . 0 0 "[ . 1 . 2]" 1
223 1 35 LEU QD 1 161 PHE QE 8.440 . 9.040 6.201 2.196 7.951 . 0 0 "[ . 1 . 2]" 1
224 1 35 LEU QD 1 163 GLN HA 3.410 . 4.010 3.095 2.443 4.107 0.097 5 0 "[ . 1 . 2]" 1
225 1 36 GLU H 1 36 GLU QB 2.700 . 3.300 2.554 2.326 3.163 . 0 0 "[ . 1 . 2]" 1
226 1 36 GLU H 1 37 ALA H 5.160 . 5.760 4.445 4.209 4.580 . 0 0 "[ . 1 . 2]" 1
227 1 36 GLU HA 1 37 ALA H 2.550 . 3.150 2.228 2.142 2.287 . 0 0 "[ . 1 . 2]" 1
228 1 36 GLU QB 1 37 ALA H 3.280 . 3.880 3.000 2.738 3.531 . 0 0 "[ . 1 . 2]" 1
229 1 36 GLU HB2 1 37 ALA H 3.860 . 4.460 3.995 2.836 4.393 . 0 0 "[ . 1 . 2]" 1
230 1 36 GLU HB3 1 37 ALA H 3.860 . 4.460 3.135 2.825 3.721 . 0 0 "[ . 1 . 2]" 1
231 1 37 ALA H 1 160 ALA H 5.500 . 6.100 3.331 2.555 5.052 . 0 0 "[ . 1 . 2]" 1
232 1 37 ALA H 1 161 PHE HA 3.640 . 4.240 3.479 2.755 4.029 . 0 0 "[ . 1 . 2]" 1
233 1 37 ALA H 1 162 TYR QD 7.380 . 7.980 4.504 3.161 6.459 . 0 0 "[ . 1 . 2]" 1
234 1 37 ALA H 1 162 TYR QE 7.630 . 8.230 5.129 3.222 7.036 . 0 0 "[ . 1 . 2]" 1
235 1 37 ALA HA 1 38 LYS H 2.830 . 3.430 2.355 2.170 2.495 . 0 0 "[ . 1 . 2]" 1
236 1 37 ALA MB 1 38 LYS H 3.760 . 4.360 2.837 2.307 3.490 . 0 0 "[ . 1 . 2]" 1
237 1 37 ALA MB 1 162 TYR QD 7.190 . 7.790 2.871 2.085 4.640 . 0 0 "[ . 1 . 2]" 1
238 1 37 ALA MB 1 162 TYR QE 5.770 . 6.370 2.854 1.893 4.452 . 0 0 "[ . 1 . 2]" 1
239 1 38 LYS H 1 38 LYS HB2 2.460 . 3.060 2.744 2.397 3.085 0.025 17 0 "[ . 1 . 2]" 1
240 1 38 LYS H 1 38 LYS HB3 3.110 . 3.710 2.925 2.533 3.626 . 0 0 "[ . 1 . 2]" 1
241 1 38 LYS HA 1 38 LYS HB2 2.930 . 3.530 2.549 2.360 2.920 . 0 0 "[ . 1 . 2]" 1
242 1 38 LYS HA 1 39 LYS H 2.800 . 3.400 2.404 2.187 3.419 0.019 19 0 "[ . 1 . 2]" 1
243 1 38 LYS HA 1 160 ALA H 4.850 . 5.450 3.725 2.500 5.011 . 0 0 "[ . 1 . 2]" 1
244 1 38 LYS HB2 1 160 ALA H 5.130 . 5.730 5.022 2.201 5.749 0.019 5 0 "[ . 1 . 2]" 1
245 1 38 LYS HB3 1 39 LYS H 3.450 . 4.050 3.337 1.989 3.973 . 0 0 "[ . 1 . 2]" 1
246 1 39 LYS H 1 39 LYS HB2 3.450 . 4.050 2.691 2.240 3.520 . 0 0 "[ . 1 . 2]" 1
247 1 39 LYS H 1 39 LYS QB 2.820 . 3.420 2.388 2.213 2.564 . 0 0 "[ . 1 . 2]" 1
248 1 39 LYS H 1 39 LYS HB3 3.450 . 4.050 3.254 2.335 3.655 . 0 0 "[ . 1 . 2]" 1
249 1 39 LYS H 1 159 ASN HA 3.360 . 3.960 3.277 2.371 4.080 0.120 14 0 "[ . 1 . 2]" 1
250 1 39 LYS HA 1 40 GLY H 3.480 . 4.080 2.311 2.144 2.807 . 0 0 "[ . 1 . 2]" 1
251 1 39 LYS QB 1 40 GLY H 2.900 . 3.500 2.853 1.926 3.360 . 0 0 "[ . 1 . 2]" 1
252 1 40 GLY QA 1 41 PHE QD 4.430 . 5.030 4.043 3.426 4.572 . 0 0 "[ . 1 . 2]" 1
253 1 41 PHE QD 1 43 HIS QB 4.900 . 5.500 4.821 3.450 5.564 0.064 8 0 "[ . 1 . 2]" 1
254 1 42 PRO QD 1 43 HIS H 4.850 . 5.450 4.351 2.344 4.992 . 0 0 "[ . 1 . 2]" 1
255 1 43 HIS H 1 43 HIS QB 3.640 . 4.240 2.667 2.191 3.509 . 0 0 "[ . 1 . 2]" 1
256 1 43 HIS H 1 44 SER H 2.680 . 3.280 2.373 1.687 3.266 . 0 0 "[ . 1 . 2]" 1
257 1 43 HIS QB 1 44 SER H 3.170 . 3.770 3.046 2.343 3.824 0.054 4 0 "[ . 1 . 2]" 1
258 1 44 SER H 1 44 SER HA 2.400 . 3.000 2.433 2.132 2.864 . 0 0 "[ . 1 . 2]" 1
259 1 44 SER H 1 44 SER QB 3.510 . 4.110 2.778 2.254 3.380 . 0 0 "[ . 1 . 2]" 1
260 1 44 SER QB 1 45 GLY H 2.600 . 3.200 2.662 1.868 3.314 0.114 13 0 "[ . 1 . 2]" 1
261 1 45 GLY H 1 45 GLY HA2 2.740 . 3.340 2.847 2.779 2.902 . 0 0 "[ . 1 . 2]" 1
262 1 45 GLY H 1 45 GLY QA 2.290 . 2.890 2.210 2.152 2.300 . 0 0 "[ . 1 . 2]" 1
263 1 45 GLY H 1 45 GLY HA3 2.740 . 3.340 2.303 2.241 2.412 . 0 0 "[ . 1 . 2]" 1
264 1 45 GLY QA 1 46 PRO QD 2.770 . 3.370 2.135 2.011 2.264 . 0 0 "[ . 1 . 2]" 1
265 1 46 PRO QB 1 47 ALA H 3.310 . 3.910 2.669 2.085 3.509 . 0 0 "[ . 1 . 2]" 1
266 1 47 ALA H 1 47 ALA HA 2.710 . 3.310 2.789 2.691 2.877 . 0 0 "[ . 1 . 2]" 1
267 1 47 ALA HA 1 48 ASP H 2.650 . 3.250 2.190 2.129 2.238 . 0 0 "[ . 1 . 2]" 1
268 1 47 ALA MB 1 48 ASP H 4.010 . 4.610 3.261 2.837 3.606 . 0 0 "[ . 1 . 2]" 1
269 1 47 ALA MB 1 50 GLN H 5.250 . 5.850 4.335 3.262 5.481 . 0 0 "[ . 1 . 2]" 1
270 1 47 ALA MB 1 50 GLN QE 6.290 . 6.890 3.531 2.031 6.520 . 0 0 "[ . 1 . 2]" 1
271 1 47 ALA MB 1 56 GLY QA 4.930 . 5.530 4.706 2.176 5.750 0.220 8 0 "[ . 1 . 2]" 1
272 1 48 ASP H 1 48 ASP QB 2.790 . 3.390 2.505 2.097 2.748 . 0 0 "[ . 1 . 2]" 1
273 1 48 ASP HA 1 48 ASP QB 2.380 . 2.980 2.346 2.259 2.433 . 0 0 "[ . 1 . 2]" 1
274 1 48 ASP HA 1 49 GLY H 2.680 . 3.280 2.417 2.128 2.665 . 0 0 "[ . 1 . 2]" 1
275 1 48 ASP HA 1 50 GLN H 3.360 . 3.960 3.279 2.686 3.828 . 0 0 "[ . 1 . 2]" 1
276 1 48 ASP HA 1 51 ILE H 5.380 . 5.980 4.863 3.590 5.667 . 0 0 "[ . 1 . 2]" 1
277 1 48 ASP QB 1 49 GLY H 3.610 . 4.210 2.958 2.408 3.496 . 0 0 "[ . 1 . 2]" 1
278 1 49 GLY H 1 49 GLY QA 2.300 . 2.900 2.175 2.138 2.215 . 0 0 "[ . 1 . 2]" 1
279 1 49 GLY H 1 50 GLN H 2.930 . 3.530 2.819 2.258 3.355 . 0 0 "[ . 1 . 2]" 1
280 1 49 GLY H 1 51 ILE H 5.040 . 5.640 3.965 3.217 4.665 . 0 0 "[ . 1 . 2]" 1
281 1 49 GLY QA 1 50 GLN H 3.060 . 3.660 2.816 2.740 2.886 . 0 0 "[ . 1 . 2]" 1
282 1 49 GLY QA 1 162 TYR QE 5.080 . 5.680 4.994 2.895 5.939 0.259 13 0 "[ . 1 . 2]" 1
283 1 50 GLN H 1 50 GLN QB 2.710 . 3.310 2.559 2.094 3.205 . 0 0 "[ . 1 . 2]" 1
284 1 50 GLN H 1 51 ILE H 2.590 . 3.190 2.698 1.837 3.185 . 0 0 "[ . 1 . 2]" 1
285 1 50 GLN HA 1 51 ILE H 3.330 . 3.930 3.039 2.640 3.432 . 0 0 "[ . 1 . 2]" 1
286 1 50 GLN HA 1 52 ALA H 5.470 . 6.070 3.776 3.342 4.307 . 0 0 "[ . 1 . 2]" 1
287 1 50 GLN QB 1 51 ILE H 4.120 . 4.720 3.539 2.922 3.852 . 0 0 "[ . 1 . 2]" 1
288 1 51 ILE H 1 51 ILE HA 2.860 . 3.460 2.749 2.679 2.791 . 0 0 "[ . 1 . 2]" 1
289 1 51 ILE H 1 51 ILE HB 2.680 . 3.280 2.534 2.418 2.632 . 0 0 "[ . 1 . 2]" 1
290 1 51 ILE H 1 51 ILE MD 4.380 . 4.980 3.336 1.760 3.619 . 0 0 "[ . 1 . 2]" 1
291 1 51 ILE H 1 51 ILE QG 2.750 . 3.350 2.147 1.956 2.716 . 0 0 "[ . 1 . 2]" 1
292 1 51 ILE H 1 51 ILE MG 4.530 . 5.130 3.789 3.767 3.815 . 0 0 "[ . 1 . 2]" 1
293 1 51 ILE H 1 52 ALA H 2.740 . 3.340 2.658 2.503 2.965 . 0 0 "[ . 1 . 2]" 1
294 1 51 ILE HA 1 51 ILE MG 3.420 . 4.020 2.504 2.436 2.636 . 0 0 "[ . 1 . 2]" 1
295 1 51 ILE HA 1 52 ALA H 3.450 . 4.050 3.463 3.425 3.502 . 0 0 "[ . 1 . 2]" 1
296 1 51 ILE HB 1 52 ALA H 3.240 . 3.840 2.736 2.359 2.988 . 0 0 "[ . 1 . 2]" 1
297 1 51 ILE MD 1 52 ALA H 5.060 . 5.660 4.623 3.629 4.871 . 0 0 "[ . 1 . 2]" 1
298 1 51 ILE MG 1 52 ALA H 5.000 . 5.600 3.565 3.351 3.793 . 0 0 "[ . 1 . 2]" 1
299 1 52 ALA HA 1 54 ALA H 4.450 . 5.050 3.820 3.363 4.907 . 0 0 "[ . 1 . 2]" 1
300 1 53 SER H 1 53 SER HA 2.930 . 3.530 2.852 2.795 2.886 . 0 0 "[ . 1 . 2]" 1
301 1 53 SER H 1 53 SER QB 2.980 . 3.580 2.617 2.340 2.786 . 0 0 "[ . 1 . 2]" 1
302 1 53 SER HA 1 53 SER QB 2.310 . 2.910 2.215 2.147 2.328 . 0 0 "[ . 1 . 2]" 1
303 1 54 ALA H 1 54 ALA HA 2.460 . 3.060 2.184 2.149 2.233 . 0 0 "[ . 1 . 2]" 1
304 1 54 ALA H 1 55 GLY H 2.830 . 3.430 2.834 2.711 3.043 . 0 0 "[ . 1 . 2]" 1
305 1 54 ALA HA 1 55 GLY H 2.900 . 3.500 2.931 2.638 3.196 . 0 0 "[ . 1 . 2]" 1
306 1 54 ALA HA 1 56 GLY H 3.790 . 4.390 3.685 2.984 4.306 . 0 0 "[ . 1 . 2]" 1
307 1 54 ALA HA 1 57 LEU H 4.820 . 5.420 4.034 2.668 5.142 . 0 0 "[ . 1 . 2]" 1
308 1 54 ALA MB 1 55 GLY H 5.650 . 6.250 3.596 3.372 3.733 . 0 0 "[ . 1 . 2]" 1
309 1 54 ALA MB 1 57 LEU H 6.520 . 7.120 4.491 3.635 5.455 . 0 0 "[ . 1 . 2]" 1
310 1 55 GLY H 1 56 GLY H 2.740 . 3.340 2.433 1.930 3.156 . 0 0 "[ . 1 . 2]" 1
311 1 55 GLY QA 1 56 GLY H 3.090 . 3.690 2.778 2.661 2.893 . 0 0 "[ . 1 . 2]" 1
312 1 56 GLY H 1 57 LEU H 2.620 . 3.220 2.641 2.325 2.927 . 0 0 "[ . 1 . 2]" 1
313 1 56 GLY QA 1 57 LEU H 2.960 . 3.560 2.825 2.733 2.902 . 0 0 "[ . 1 . 2]" 1
314 1 56 GLY HA2 1 57 LEU H 3.390 . 3.990 3.302 3.017 3.481 . 0 0 "[ . 1 . 2]" 1
315 1 56 GLY HA3 1 57 LEU H 3.390 . 3.990 3.103 2.861 3.390 . 0 0 "[ . 1 . 2]" 1
316 1 57 LEU H 1 57 LEU HA 2.900 . 3.500 2.761 2.704 2.846 . 0 0 "[ . 1 . 2]" 1
317 1 57 LEU H 1 57 LEU HG 2.620 . 3.220 2.435 2.134 3.256 0.036 13 0 "[ . 1 . 2]" 1
318 1 57 LEU H 1 58 PHE H 4.170 . 4.770 2.644 2.277 2.885 . 0 0 "[ . 1 . 2]" 1
319 1 57 LEU HA 1 57 LEU QB 2.610 . 3.210 2.315 2.121 2.461 . 0 0 "[ . 1 . 2]" 1
320 1 57 LEU HA 1 57 LEU QD 3.410 . 4.010 2.287 2.114 3.415 . 0 0 "[ . 1 . 2]" 1
321 1 57 LEU HA 1 58 PHE H 3.450 . 4.050 3.405 3.283 3.504 . 0 0 "[ . 1 . 2]" 1
322 1 57 LEU HA 1 59 GLY H 3.760 . 4.360 3.755 3.333 4.285 . 0 0 "[ . 1 . 2]" 1
323 1 57 LEU HA 1 60 GLY H 4.630 . 5.230 3.799 2.973 4.724 . 0 0 "[ . 1 . 2]" 1
324 1 57 LEU QB 1 58 PHE H 3.080 . 3.680 2.822 2.184 3.560 . 0 0 "[ . 1 . 2]" 1
325 1 57 LEU QB 1 59 GLY H 4.330 . 4.930 4.499 4.187 4.887 . 0 0 "[ . 1 . 2]" 1
326 1 57 LEU QB 1 60 GLY H 5.340 . 5.940 4.757 4.164 5.421 . 0 0 "[ . 1 . 2]" 1
327 1 58 PHE HA 1 59 GLY H 3.420 . 4.020 3.359 3.191 3.470 . 0 0 "[ . 1 . 2]" 1
328 1 58 PHE HA 1 60 GLY H 3.640 . 4.240 3.728 3.348 4.139 . 0 0 "[ . 1 . 2]" 1
329 1 58 PHE HA 1 61 ILE H 3.700 . 4.300 3.644 3.187 4.273 . 0 0 "[ . 1 . 2]" 1
330 1 58 PHE QD 1 59 GLY H 7.600 . 8.200 4.365 3.453 4.722 . 0 0 "[ . 1 . 2]" 1
331 1 58 PHE QE 1 110 LEU MD1 7.010 . 7.610 4.116 2.485 6.304 . 0 0 "[ . 1 . 2]" 1
332 1 58 PHE QE 1 110 LEU MD2 7.010 . 7.610 4.072 2.295 7.304 . 0 0 "[ . 1 . 2]" 1
333 1 58 PHE QE 1 110 LEU HG 5.990 . 6.590 5.412 4.083 6.700 0.110 6 0 "[ . 1 . 2]" 1
334 1 58 PHE HZ 1 111 LYS QE 4.620 . 5.220 4.068 2.133 5.269 0.049 1 0 "[ . 1 . 2]" 1
335 1 59 GLY H 1 59 GLY HA2 2.830 . 3.430 2.781 2.730 2.830 . 0 0 "[ . 1 . 2]" 1
336 1 59 GLY H 1 59 GLY QA 2.340 . 2.940 2.168 2.144 2.192 . 0 0 "[ . 1 . 2]" 1
337 1 59 GLY H 1 59 GLY HA3 2.830 . 3.430 2.262 2.241 2.283 . 0 0 "[ . 1 . 2]" 1
338 1 59 GLY H 1 60 GLY H 2.770 . 3.370 2.617 2.420 2.822 . 0 0 "[ . 1 . 2]" 1
339 1 59 GLY QA 1 60 GLY H 3.010 . 3.610 2.803 2.745 2.871 . 0 0 "[ . 1 . 2]" 1
340 1 60 GLY H 1 61 ILE H 2.460 . 3.060 2.651 2.564 2.776 . 0 0 "[ . 1 . 2]" 1
341 1 60 GLY QA 1 63 ASP QB 3.070 . 3.670 2.663 2.208 3.331 . 0 0 "[ . 1 . 2]" 1
342 1 60 GLY HA2 1 63 ASP H 4.660 . 5.260 3.211 2.910 3.952 . 0 0 "[ . 1 . 2]" 1
343 1 60 GLY HA3 1 63 ASP H 4.660 . 5.260 4.377 4.201 5.050 . 0 0 "[ . 1 . 2]" 1
344 1 61 ILE H 1 61 ILE HA 2.900 . 3.500 2.774 2.705 2.837 . 0 0 "[ . 1 . 2]" 1
345 1 61 ILE H 1 61 ILE HB 2.520 . 3.120 2.552 2.510 2.646 . 0 0 "[ . 1 . 2]" 1
346 1 61 ILE H 1 61 ILE MD 4.320 . 4.920 3.280 3.111 3.498 . 0 0 "[ . 1 . 2]" 1
347 1 61 ILE H 1 61 ILE HG12 3.420 . 4.020 2.299 2.059 3.464 . 0 0 "[ . 1 . 2]" 1
348 1 61 ILE H 1 61 ILE HG13 3.420 . 4.020 3.421 2.035 3.754 . 0 0 "[ . 1 . 2]" 1
349 1 61 ILE H 1 62 LEU H 2.930 . 3.530 2.524 2.227 2.864 . 0 0 "[ . 1 . 2]" 1
350 1 61 ILE H 1 63 ASP H 4.230 . 4.830 3.906 3.698 4.354 . 0 0 "[ . 1 . 2]" 1
351 1 61 ILE HA 1 63 ASP H 4.290 . 4.890 4.179 3.731 4.660 . 0 0 "[ . 1 . 2]" 1
352 1 61 ILE HA 1 64 GLN H 4.040 . 4.640 3.893 3.462 4.554 . 0 0 "[ . 1 . 2]" 1
353 1 61 ILE HA 1 64 GLN QE 5.050 . 5.650 3.148 1.908 4.981 . 0 0 "[ . 1 . 2]" 1
354 1 61 ILE HB 1 62 LEU H 3.020 . 3.620 2.705 2.543 2.929 . 0 0 "[ . 1 . 2]" 1
355 1 61 ILE HB 1 63 ASP H 4.690 . 5.290 4.930 4.774 5.154 . 0 0 "[ . 1 . 2]" 1
356 1 61 ILE MD 1 64 GLN QE 5.820 . 6.420 3.600 2.441 6.176 . 0 0 "[ . 1 . 2]" 1
357 1 61 ILE MD 1 145 TYR QD 7.530 . 8.130 6.495 2.495 8.236 0.106 4 0 "[ . 1 . 2]" 1
358 1 61 ILE MD 1 145 TYR QE 6.950 . 7.550 5.572 3.234 7.598 0.048 2 0 "[ . 1 . 2]" 1
359 1 61 ILE MG 1 64 GLN H 6.520 . 7.120 4.771 4.288 5.297 . 0 0 "[ . 1 . 2]" 1
360 1 61 ILE MG 1 64 GLN QE 6.290 . 6.890 3.779 2.328 5.603 . 0 0 "[ . 1 . 2]" 1
361 1 62 LEU H 1 62 LEU HG 3.760 . 4.360 3.735 2.288 4.033 . 0 0 "[ . 1 . 2]" 1
362 1 62 LEU H 1 63 ASP H 2.400 . 3.000 2.509 2.279 2.637 . 0 0 "[ . 1 . 2]" 1
363 1 62 LEU HA 1 62 LEU QD 3.410 . 4.010 2.704 2.223 2.874 . 0 0 "[ . 1 . 2]" 1
364 1 62 LEU HA 1 62 LEU HG 2.550 . 3.150 2.530 2.453 3.042 . 0 0 "[ . 1 . 2]" 1
365 1 62 LEU QB 1 62 LEU HG 2.470 . 3.070 2.293 2.279 2.310 . 0 0 "[ . 1 . 2]" 1
366 1 62 LEU QB 1 63 ASP H 2.930 . 3.530 2.826 2.585 3.177 . 0 0 "[ . 1 . 2]" 1
367 1 62 LEU HB2 1 63 ASP H 3.450 . 4.050 2.961 2.693 3.392 . 0 0 "[ . 1 . 2]" 1
368 1 62 LEU HB3 1 63 ASP H 3.450 . 4.050 3.599 3.329 3.853 . 0 0 "[ . 1 . 2]" 1
369 1 63 ASP H 1 63 ASP HB2 2.430 . 3.030 2.457 2.331 2.712 . 0 0 "[ . 1 . 2]" 1
370 1 63 ASP H 1 63 ASP HB3 2.430 . 3.030 2.639 2.441 2.703 . 0 0 "[ . 1 . 2]" 1
371 1 63 ASP H 1 64 GLN H 3.110 . 3.710 2.658 2.419 2.817 . 0 0 "[ . 1 . 2]" 1
372 1 63 ASP HA 1 64 GLN H 3.480 . 4.080 3.350 3.046 3.491 . 0 0 "[ . 1 . 2]" 1
373 1 63 ASP QB 1 64 GLN H 3.530 . 4.130 2.988 2.432 3.626 . 0 0 "[ . 1 . 2]" 1
374 1 64 GLN H 1 65 GLN H 3.790 . 4.390 2.727 2.132 3.125 . 0 0 "[ . 1 . 2]" 1
375 1 64 GLN HA 1 65 GLN H 3.080 . 3.680 3.248 2.919 3.494 . 0 0 "[ . 1 . 2]" 1
376 1 65 GLN H 1 65 GLN QB 3.160 . 3.760 2.697 2.448 3.155 . 0 0 "[ . 1 . 2]" 1
377 1 65 GLN H 1 66 SER H 3.610 . 4.210 2.917 2.190 4.108 . 0 0 "[ . 1 . 2]" 1
378 1 65 GLN HA 1 66 SER H 2.400 . 3.000 2.626 2.174 2.970 . 0 0 "[ . 1 . 2]" 1
379 1 66 SER H 1 66 SER QB 3.080 . 3.680 2.516 2.286 2.771 . 0 0 "[ . 1 . 2]" 1
380 1 66 SER H 1 67 GLU H 4.690 . 5.290 4.470 4.277 4.616 . 0 0 "[ . 1 . 2]" 1
381 1 66 SER H 1 69 ARG H 3.790 . 4.390 3.885 3.170 4.276 . 0 0 "[ . 1 . 2]" 1
382 1 66 SER H 1 69 ARG HB2 3.170 . 3.770 2.397 2.129 2.765 . 0 0 "[ . 1 . 2]" 1
383 1 66 SER H 1 69 ARG HB3 3.170 . 3.770 3.738 3.388 3.844 0.074 16 0 "[ . 1 . 2]" 1
384 1 66 SER H 1 69 ARG QG 5.170 . 5.770 3.858 3.344 4.434 . 0 0 "[ . 1 . 2]" 1
385 1 66 SER HA 1 66 SER QB 2.510 . 3.110 2.304 2.268 2.350 . 0 0 "[ . 1 . 2]" 1
386 1 66 SER HA 1 67 GLU H 2.860 . 3.460 2.424 2.230 2.736 . 0 0 "[ . 1 . 2]" 1
387 1 66 SER QB 1 69 ARG H 3.770 . 4.370 3.152 2.650 3.905 . 0 0 "[ . 1 . 2]" 1
388 1 67 GLU H 1 67 GLU HB2 3.240 . 3.840 2.389 2.095 2.533 . 0 0 "[ . 1 . 2]" 1
389 1 67 GLU H 1 67 GLU HB3 3.240 . 3.840 2.825 2.412 3.534 . 0 0 "[ . 1 . 2]" 1
390 1 67 GLU H 1 68 ASN H 3.080 . 3.680 2.502 2.252 2.665 . 0 0 "[ . 1 . 2]" 1
391 1 67 GLU QB 1 68 ASN H 2.930 . 3.530 2.790 2.510 3.016 . 0 0 "[ . 1 . 2]" 1
392 1 67 GLU HB2 1 68 ASN H 3.580 . 4.180 3.587 2.932 3.965 . 0 0 "[ . 1 . 2]" 1
393 1 67 GLU HB3 1 68 ASN H 3.580 . 4.180 3.092 2.550 3.983 . 0 0 "[ . 1 . 2]" 1
394 1 68 ASN H 1 68 ASN HB2 3.830 . 4.430 2.643 2.285 3.656 . 0 0 "[ . 1 . 2]" 1
395 1 68 ASN H 1 68 ASN QB 3.160 . 3.760 2.416 2.251 2.650 . 0 0 "[ . 1 . 2]" 1
396 1 68 ASN H 1 68 ASN HB3 3.830 . 4.430 3.374 2.543 3.640 . 0 0 "[ . 1 . 2]" 1
397 1 68 ASN H 1 69 ARG H 2.490 . 3.090 2.618 2.427 2.827 . 0 0 "[ . 1 . 2]" 1
398 1 68 ASN HA 1 69 ARG H 2.960 . 3.560 3.001 2.859 3.276 . 0 0 "[ . 1 . 2]" 1
399 1 68 ASN QB 1 69 ARG H 4.150 . 4.750 3.665 3.204 3.956 . 0 0 "[ . 1 . 2]" 1
400 1 69 ARG H 1 69 ARG HA 2.800 . 3.400 2.736 2.688 2.806 . 0 0 "[ . 1 . 2]" 1
401 1 69 ARG H 1 69 ARG HB2 2.680 . 3.280 2.514 2.282 2.770 . 0 0 "[ . 1 . 2]" 1
402 1 69 ARG H 1 69 ARG QB 2.320 . 2.920 2.169 2.072 2.221 . 0 0 "[ . 1 . 2]" 1
403 1 69 ARG H 1 69 ARG HB3 2.680 . 3.280 2.412 2.164 2.688 . 0 0 "[ . 1 . 2]" 1
404 1 69 ARG H 1 69 ARG QG 4.650 . 5.250 3.934 3.891 3.978 . 0 0 "[ . 1 . 2]" 1
405 1 69 ARG H 1 70 TRP H 4.940 . 5.540 4.638 4.564 4.681 . 0 0 "[ . 1 . 2]" 1
406 1 69 ARG HA 1 70 TRP HD1 5.500 . 6.100 4.434 3.081 6.083 . 0 0 "[ . 1 . 2]" 1
407 1 69 ARG QB 1 70 TRP HD1 5.340 . 5.940 5.340 4.572 5.851 . 0 0 "[ . 1 . 2]" 1
408 1 69 ARG HB2 1 70 TRP H 3.830 . 4.430 3.901 3.686 4.083 . 0 0 "[ . 1 . 2]" 1
409 1 69 ARG HB3 1 70 TRP H 3.830 . 4.430 3.914 3.228 4.252 . 0 0 "[ . 1 . 2]" 1
410 1 70 TRP H 1 70 TRP HB2 3.830 . 4.430 2.887 2.219 3.667 . 0 0 "[ . 1 . 2]" 1
411 1 70 TRP H 1 70 TRP QB 3.140 . 3.740 2.470 2.150 2.812 . 0 0 "[ . 1 . 2]" 1
412 1 70 TRP H 1 70 TRP HB3 3.830 . 4.430 3.155 2.174 3.561 . 0 0 "[ . 1 . 2]" 1
413 1 70 TRP H 1 70 TRP HD1 3.920 . 4.520 3.028 2.317 3.803 . 0 0 "[ . 1 . 2]" 1
414 1 70 TRP H 1 71 PHE H 4.760 . 5.360 4.588 4.521 4.645 . 0 0 "[ . 1 . 2]" 1
415 1 70 TRP HA 1 71 PHE H 2.400 . 3.000 2.345 2.170 2.474 . 0 0 "[ . 1 . 2]" 1
416 1 70 TRP HD1 1 71 PHE H 5.500 . 6.100 4.788 3.867 5.895 . 0 0 "[ . 1 . 2]" 1
417 1 70 TRP HD1 1 164 VAL QG 6.420 . 7.020 4.227 2.586 6.662 . 0 0 "[ . 1 . 2]" 1
418 1 70 TRP HE1 1 164 VAL QG 6.420 . 7.020 4.292 2.831 6.767 . 0 0 "[ . 1 . 2]" 1
419 1 71 PHE H 1 71 PHE HA 2.860 . 3.460 2.771 2.648 2.828 . 0 0 "[ . 1 . 2]" 1
420 1 71 PHE H 1 165 ILE MG 5.000 . 5.600 5.320 4.415 5.738 0.138 1 0 "[ . 1 . 2]" 1
421 1 71 PHE HA 1 72 LYS H 2.400 . 3.000 2.234 2.140 2.315 . 0 0 "[ . 1 . 2]" 1
422 1 71 PHE QD 1 72 LYS H 6.670 . 7.270 3.997 3.463 4.866 . 0 0 "[ . 1 . 2]" 1
423 1 71 PHE QE 1 73 HIS QB 4.520 . 5.120 4.421 2.457 5.191 0.071 12 0 "[ . 1 . 2]" 1
424 1 71 PHE QE 1 165 ILE MD 5.550 . 6.150 3.681 2.556 6.402 0.252 1 0 "[ . 1 . 2]" 1
425 1 71 PHE QE 1 165 ILE MG 6.140 . 6.740 2.844 2.144 5.534 . 0 0 "[ . 1 . 2]" 1
426 1 72 LYS H 1 72 LYS HA 2.930 . 3.530 2.865 2.770 2.911 . 0 0 "[ . 1 . 2]" 1
427 1 72 LYS H 1 72 LYS QB 2.390 . 2.990 2.488 2.254 2.658 . 0 0 "[ . 1 . 2]" 1
428 1 72 LYS HA 1 73 HIS H 2.800 . 3.400 2.253 2.182 2.308 . 0 0 "[ . 1 . 2]" 1
429 1 72 LYS HA 1 166 ASP H 4.790 . 5.390 3.905 3.206 4.619 . 0 0 "[ . 1 . 2]" 1
430 1 72 LYS QB 1 73 HIS H 3.610 . 4.210 3.146 2.728 3.754 . 0 0 "[ . 1 . 2]" 1
431 1 73 HIS H 1 73 HIS QB 2.930 . 3.530 2.505 2.291 2.637 . 0 0 "[ . 1 . 2]" 1
432 1 73 HIS H 1 73 HIS HD2 5.500 . 6.100 4.960 3.469 5.800 . 0 0 "[ . 1 . 2]" 1
433 1 73 HIS H 1 167 VAL HA 3.170 . 3.770 2.516 2.205 2.934 . 0 0 "[ . 1 . 2]" 1
434 1 73 HIS H 1 168 ASP H 3.830 . 4.430 3.666 3.305 4.280 . 0 0 "[ . 1 . 2]" 1
435 1 73 HIS HA 1 73 HIS QB 2.340 . 2.940 2.346 2.278 2.437 . 0 0 "[ . 1 . 2]" 1
436 1 74 ILE H 1 74 ILE HB 3.920 . 4.520 2.585 2.476 2.795 . 0 0 "[ . 1 . 2]" 1
437 1 74 ILE HA 1 74 ILE MD 4.260 . 4.860 3.845 3.641 3.930 . 0 0 "[ . 1 . 2]" 1
438 1 74 ILE HA 1 168 ASP H 3.730 . 4.330 2.737 2.282 2.939 . 0 0 "[ . 1 . 2]" 1
439 1 74 ILE QG 1 75 MET H 4.500 . 5.100 3.845 2.396 4.229 . 0 0 "[ . 1 . 2]" 1
440 1 74 ILE QG 1 168 ASP H 4.290 . 4.890 4.088 3.798 4.346 . 0 0 "[ . 1 . 2]" 1
441 1 74 ILE MG 1 75 MET H 4.010 . 4.610 2.832 2.396 3.860 . 0 0 "[ . 1 . 2]" 1
442 1 75 MET H 1 75 MET HB2 3.170 . 3.770 2.927 2.639 3.209 . 0 0 "[ . 1 . 2]" 1
443 1 75 MET H 1 75 MET QB 2.770 . 3.370 2.676 2.585 2.745 . 0 0 "[ . 1 . 2]" 1
444 1 75 MET H 1 75 MET HB3 3.170 . 3.770 3.273 2.937 3.755 . 0 0 "[ . 1 . 2]" 1
445 1 75 MET H 1 167 VAL HB 4.420 . 5.020 4.721 4.212 5.032 0.012 10 0 "[ . 1 . 2]" 1
446 1 75 MET H 1 168 ASP H 3.420 . 4.020 3.738 3.330 4.081 0.061 17 0 "[ . 1 . 2]" 1
447 1 75 MET H 1 168 ASP QB 4.680 . 5.280 3.592 3.298 3.888 . 0 0 "[ . 1 . 2]" 1
448 1 75 MET H 1 169 LEU HA 3.080 . 3.680 3.105 2.969 3.286 . 0 0 "[ . 1 . 2]" 1
449 1 75 MET H 1 169 LEU QD 4.470 . 5.070 3.484 2.825 4.195 . 0 0 "[ . 1 . 2]" 1
450 1 75 MET H 1 170 VAL H 3.610 . 4.210 3.747 3.352 4.208 . 0 0 "[ . 1 . 2]" 1
451 1 75 MET HA 1 76 THR H 2.620 . 3.220 2.396 2.264 2.509 . 0 0 "[ . 1 . 2]" 1
452 1 75 MET QB 1 80 HIS HE1 3.560 . 4.160 3.874 2.595 4.256 0.096 1 0 "[ . 1 . 2]" 1
453 1 75 MET ME 1 80 HIS HD2 3.730 . 4.330 3.272 2.726 4.067 . 0 0 "[ . 1 . 2]" 1
454 1 75 MET ME 1 80 HIS HE1 4.410 . 5.010 3.937 3.143 5.021 0.011 9 0 "[ . 1 . 2]" 1
455 1 75 MET ME 1 82 PHE QD 6.170 . 6.770 5.420 4.120 6.797 0.027 20 0 "[ . 1 . 2]" 1
456 1 76 THR H 1 76 THR HB 3.760 . 4.360 3.578 3.517 3.624 . 0 0 "[ . 1 . 2]" 1
457 1 76 THR HA 1 76 THR HB 2.400 . 3.000 2.480 2.455 2.529 . 0 0 "[ . 1 . 2]" 1
458 1 76 THR HA 1 76 THR MG 3.420 . 4.020 2.341 2.292 2.423 . 0 0 "[ . 1 . 2]" 1
459 1 76 THR HA 1 77 GLY H 2.680 . 3.280 2.582 2.462 2.733 . 0 0 "[ . 1 . 2]" 1
460 1 76 THR HA 1 170 VAL H 2.770 . 3.370 2.766 2.350 3.195 . 0 0 "[ . 1 . 2]" 1
461 1 76 THR HB 1 77 GLY H 2.650 . 3.250 2.334 2.128 2.534 . 0 0 "[ . 1 . 2]" 1
462 1 76 THR MG 1 77 GLY H 5.530 . 6.130 3.649 3.528 3.735 . 0 0 "[ . 1 . 2]" 1
463 1 76 THR MG 1 170 VAL QG 4.410 . 5.010 2.816 2.218 3.805 . 0 0 "[ . 1 . 2]" 1
464 1 77 GLY H 1 169 LEU QD 5.640 . 6.240 4.835 3.752 6.061 . 0 0 "[ . 1 . 2]" 1
465 1 77 GLY QA 1 78 GLY H 2.990 . 3.590 2.260 2.184 2.306 . 0 0 "[ . 1 . 2]" 1
466 1 78 GLY H 1 138 ILE H 4.070 . 4.670 3.560 3.264 4.134 . 0 0 "[ . 1 . 2]" 1
467 1 78 GLY H 1 138 ILE HB 4.600 . 5.200 3.354 3.003 3.689 . 0 0 "[ . 1 . 2]" 1
468 1 78 GLY QA 1 79 GLU H 2.410 . 3.010 2.303 2.235 2.372 . 0 0 "[ . 1 . 2]" 1
469 1 78 GLY QA 1 137 TYR QE 4.250 . 4.850 3.028 2.418 4.311 . 0 0 "[ . 1 . 2]" 1
470 1 78 GLY HA2 1 79 GLU H 2.770 . 3.370 2.616 2.466 2.772 . 0 0 "[ . 1 . 2]" 1
471 1 78 GLY HA2 1 137 TYR QE 5.120 . 5.720 3.084 2.438 4.497 . 0 0 "[ . 1 . 2]" 1
472 1 78 GLY HA3 1 79 GLU H 2.770 . 3.370 2.573 2.358 2.793 . 0 0 "[ . 1 . 2]" 1
473 1 78 GLY HA3 1 137 TYR QE 5.120 . 5.720 4.511 3.960 5.532 . 0 0 "[ . 1 . 2]" 1
474 1 79 GLU H 1 79 GLU QB 2.390 . 2.990 2.270 2.095 2.614 . 0 0 "[ . 1 . 2]" 1
475 1 79 GLU H 1 79 GLU QG 4.260 . 4.860 3.398 2.465 4.039 . 0 0 "[ . 1 . 2]" 1
476 1 79 GLU H 1 137 TYR QD 7.380 . 7.980 3.563 3.155 4.080 . 0 0 "[ . 1 . 2]" 1
477 1 79 GLU HA 1 80 HIS H 2.400 . 3.000 2.243 2.196 2.319 . 0 0 "[ . 1 . 2]" 1
478 1 79 GLU HA 1 137 TYR HA 3.140 . 3.740 2.125 1.948 2.388 . 0 0 "[ . 1 . 2]" 1
479 1 79 GLU HA 1 138 ILE H 3.170 . 3.770 2.942 2.412 3.471 . 0 0 "[ . 1 . 2]" 1
480 1 79 GLU QB 1 80 HIS H 3.820 . 4.420 3.293 2.725 3.650 . 0 0 "[ . 1 . 2]" 1
481 1 79 GLU QG 1 80 HIS H 5.340 . 5.940 3.322 2.202 4.152 . 0 0 "[ . 1 . 2]" 1
482 1 79 GLU QG 1 137 TYR QE 5.370 . 5.970 4.922 3.867 5.980 0.010 15 0 "[ . 1 . 2]" 1
483 1 80 HIS H 1 80 HIS HB2 4.040 . 4.640 2.746 2.566 2.980 . 0 0 "[ . 1 . 2]" 1
484 1 80 HIS H 1 80 HIS HB3 4.040 . 4.640 3.763 3.668 3.840 . 0 0 "[ . 1 . 2]" 1
485 1 80 HIS H 1 80 HIS HD2 5.500 . 6.100 4.242 3.387 5.306 . 0 0 "[ . 1 . 2]" 1
486 1 80 HIS H 1 136 ILE H 3.830 . 4.430 3.006 2.752 3.226 . 0 0 "[ . 1 . 2]" 1
487 1 80 HIS H 1 137 TYR HA 3.760 . 4.360 3.244 2.963 3.462 . 0 0 "[ . 1 . 2]" 1
488 1 80 HIS HA 1 81 THR H 2.400 . 3.000 2.314 2.111 2.451 . 0 0 "[ . 1 . 2]" 1
489 1 80 HIS QB 1 81 THR H 2.820 . 3.420 2.787 2.545 3.277 . 0 0 "[ . 1 . 2]" 1
490 1 80 HIS HD2 1 81 THR H 5.500 . 6.100 4.914 4.286 6.059 . 0 0 "[ . 1 . 2]" 1
491 1 80 HIS HD2 1 138 ILE HB 5.500 . 6.100 5.116 2.361 6.100 0.000 16 0 "[ . 1 . 2]" 1
492 1 80 HIS HD2 1 138 ILE MD 6.520 . 7.120 5.647 2.248 6.957 . 0 0 "[ . 1 . 2]" 1
493 1 80 HIS HD2 1 138 ILE QG 5.340 . 5.940 4.748 2.029 5.907 . 0 0 "[ . 1 . 2]" 1
494 1 80 HIS HD2 1 138 ILE MG 6.520 . 7.120 5.868 3.843 6.642 . 0 0 "[ . 1 . 2]" 1
495 1 81 THR H 1 81 THR HB 2.860 . 3.460 2.650 2.476 2.821 . 0 0 "[ . 1 . 2]" 1
496 1 81 THR HA 1 81 THR MG 3.540 . 4.140 2.378 2.298 2.431 . 0 0 "[ . 1 . 2]" 1
497 1 81 THR HA 1 82 PHE H 2.400 . 3.000 2.189 2.145 2.255 . 0 0 "[ . 1 . 2]" 1
498 1 81 THR HA 1 82 PHE QD 4.530 . 5.130 3.583 3.141 4.118 . 0 0 "[ . 1 . 2]" 1
499 1 81 THR HA 1 135 HIS HA 2.460 . 3.060 2.418 2.260 2.562 . 0 0 "[ . 1 . 2]" 1
500 1 81 THR HA 1 136 ILE H 3.700 . 4.300 3.347 3.058 3.763 . 0 0 "[ . 1 . 2]" 1
501 1 81 THR HB 1 82 PHE H 4.230 . 4.830 4.142 3.948 4.301 . 0 0 "[ . 1 . 2]" 1
502 1 81 THR MG 1 82 PHE H 4.320 . 4.920 2.821 2.552 3.083 . 0 0 "[ . 1 . 2]" 1
503 1 81 THR MG 1 133 SER QB 3.460 . 4.060 3.611 2.616 3.948 . 0 0 "[ . 1 . 2]" 1
504 1 81 THR MG 1 135 HIS HD2 6.520 . 7.120 3.866 2.654 4.916 . 0 0 "[ . 1 . 2]" 1
505 1 81 THR MG 1 135 HIS HE1 3.420 . 4.020 3.558 2.704 4.070 0.050 8 0 "[ . 1 . 2]" 1
506 1 82 PHE H 1 82 PHE HB2 3.610 . 4.210 2.461 2.338 2.638 . 0 0 "[ . 1 . 2]" 1
507 1 82 PHE H 1 82 PHE HB3 3.610 . 4.210 3.599 3.524 3.716 . 0 0 "[ . 1 . 2]" 1
508 1 82 PHE H 1 134 HIS H 3.760 . 4.360 3.199 2.994 3.462 . 0 0 "[ . 1 . 2]" 1
509 1 82 PHE H 1 135 HIS HA 3.270 . 3.870 3.512 3.293 3.805 . 0 0 "[ . 1 . 2]" 1
510 1 82 PHE HA 1 83 THR H 2.400 . 3.000 2.240 2.171 2.286 . 0 0 "[ . 1 . 2]" 1
511 1 82 PHE QB 1 134 HIS H 5.340 . 5.940 3.546 3.148 3.918 . 0 0 "[ . 1 . 2]" 1
512 1 82 PHE HB2 1 83 THR H 4.320 . 4.920 4.142 3.910 4.370 . 0 0 "[ . 1 . 2]" 1
513 1 82 PHE HB3 1 83 THR H 4.320 . 4.920 3.249 3.009 3.664 . 0 0 "[ . 1 . 2]" 1
514 1 82 PHE QD 1 136 ILE H 7.630 . 8.230 3.649 3.134 4.243 . 0 0 "[ . 1 . 2]" 1
515 1 82 PHE QD 1 136 ILE HB 4.650 . 5.250 3.060 2.634 3.743 . 0 0 "[ . 1 . 2]" 1
516 1 82 PHE QD 1 136 ILE MD 8.030 . 8.630 3.512 2.200 4.388 . 0 0 "[ . 1 . 2]" 1
517 1 82 PHE QD 1 136 ILE QG 4.430 . 5.030 2.901 2.355 4.228 . 0 0 "[ . 1 . 2]" 1
518 1 82 PHE QD 1 136 ILE MG 5.920 . 6.520 4.320 3.937 4.866 . 0 0 "[ . 1 . 2]" 1
519 1 82 PHE QD 1 148 ILE MD 8.060 . 8.660 4.373 3.352 5.566 . 0 0 "[ . 1 . 2]" 1
520 1 82 PHE QD 1 148 ILE MG 5.550 . 6.150 5.049 4.104 6.267 0.117 8 0 "[ . 1 . 2]" 1
521 1 82 PHE QE 1 136 ILE MG 6.140 . 6.740 3.500 3.087 4.450 . 0 0 "[ . 1 . 2]" 1
522 1 82 PHE QE 1 148 ILE MD 7.200 . 7.800 3.232 2.321 4.737 . 0 0 "[ . 1 . 2]" 1
523 1 83 THR H 1 83 THR HB 2.830 . 3.430 2.794 2.626 3.246 . 0 0 "[ . 1 . 2]" 1
524 1 83 THR HA 1 83 THR MG 3.480 . 4.080 2.440 2.325 3.149 . 0 0 "[ . 1 . 2]" 1
525 1 83 THR HA 1 84 TRP H 2.430 . 3.030 2.183 2.111 2.283 . 0 0 "[ . 1 . 2]" 1
526 1 83 THR HA 1 84 TRP HD1 5.500 . 6.100 4.148 3.182 5.655 . 0 0 "[ . 1 . 2]" 1
527 1 83 THR HA 1 133 SER HA 2.740 . 3.340 2.519 2.186 3.223 . 0 0 "[ . 1 . 2]" 1
528 1 83 THR HA 1 134 HIS H 4.230 . 4.830 3.664 3.223 4.059 . 0 0 "[ . 1 . 2]" 1
529 1 83 THR MG 1 84 TRP H 4.010 . 4.610 2.867 2.451 3.579 . 0 0 "[ . 1 . 2]" 1
530 1 84 TRP H 1 84 TRP HB2 3.790 . 4.390 2.585 2.437 2.782 . 0 0 "[ . 1 . 2]" 1
531 1 84 TRP H 1 84 TRP HB3 3.790 . 4.390 3.660 3.517 3.751 . 0 0 "[ . 1 . 2]" 1
532 1 84 TRP H 1 84 TRP HD1 3.480 . 4.080 3.506 2.812 4.056 . 0 0 "[ . 1 . 2]" 1
533 1 84 TRP H 1 133 SER HA 3.480 . 4.080 3.502 2.588 3.958 . 0 0 "[ . 1 . 2]" 1
534 1 84 TRP HA 1 85 THR H 2.520 . 3.120 2.355 2.252 2.435 . 0 0 "[ . 1 . 2]" 1
535 1 84 TRP QB 1 85 THR H 3.000 . 3.600 2.857 2.723 3.114 . 0 0 "[ . 1 . 2]" 1
536 1 84 TRP HB2 1 85 THR H 3.830 . 4.430 3.883 3.572 4.036 . 0 0 "[ . 1 . 2]" 1
537 1 84 TRP HB3 1 85 THR H 3.830 . 4.430 2.943 2.799 3.258 . 0 0 "[ . 1 . 2]" 1
538 1 84 TRP HE1 1 150 ALA MB 6.520 . 7.120 5.504 4.005 6.495 . 0 0 "[ . 1 . 2]" 1
539 1 85 THR H 1 85 THR HB 3.670 . 4.270 3.435 3.196 3.791 . 0 0 "[ . 1 . 2]" 1
540 1 85 THR H 1 85 THR MG 3.980 . 4.580 2.733 2.358 3.416 . 0 0 "[ . 1 . 2]" 1
541 1 85 THR HA 1 85 THR HB 2.400 . 3.000 2.483 2.296 2.666 . 0 0 "[ . 1 . 2]" 1
542 1 85 THR HA 1 86 TYR H 2.620 . 3.220 2.365 2.154 2.438 . 0 0 "[ . 1 . 2]" 1
543 1 85 THR HB 1 86 TYR H 4.110 . 4.710 3.483 2.549 4.002 . 0 0 "[ . 1 . 2]" 1
544 1 85 THR MG 1 86 TYR H 5.370 . 5.970 3.492 3.155 4.306 . 0 0 "[ . 1 . 2]" 1
545 1 86 TYR H 1 86 TYR QB 2.710 . 3.310 2.580 2.339 2.695 . 0 0 "[ . 1 . 2]" 1
546 1 86 TYR H 1 132 LEU HG 5.310 . 5.910 5.217 4.209 6.026 0.116 9 0 "[ . 1 . 2]" 1
547 1 86 TYR HA 1 87 THR H 2.740 . 3.340 2.323 2.102 2.491 . 0 0 "[ . 1 . 2]" 1
548 1 86 TYR HA 1 88 ALA H 4.040 . 4.640 3.942 3.565 4.400 . 0 0 "[ . 1 . 2]" 1
549 1 86 TYR QB 1 87 THR H 3.500 . 4.100 2.996 2.544 3.332 . 0 0 "[ . 1 . 2]" 1
550 1 86 TYR QD 1 87 THR H 7.630 . 8.230 3.588 2.213 4.345 . 0 0 "[ . 1 . 2]" 1
551 1 87 THR H 1 87 THR HB 3.520 . 4.120 2.835 2.530 3.600 . 0 0 "[ . 1 . 2]" 1
552 1 87 THR H 1 88 ALA H 3.080 . 3.680 2.541 2.389 2.703 . 0 0 "[ . 1 . 2]" 1
553 1 87 THR HA 1 87 THR HB 2.400 . 3.000 2.462 2.370 2.540 . 0 0 "[ . 1 . 2]" 1
554 1 87 THR HA 1 87 THR MG 3.420 . 4.020 3.026 2.352 3.195 . 0 0 "[ . 1 . 2]" 1
555 1 87 THR MG 1 88 ALA H 6.520 . 7.120 3.029 2.404 4.124 . 0 0 "[ . 1 . 2]" 1
556 1 90 HIS HA 1 90 HIS HB2 2.990 . 3.590 2.616 2.403 2.901 . 0 0 "[ . 1 . 2]" 1
557 1 90 HIS HA 1 90 HIS QB 2.540 . 3.140 2.349 2.125 2.430 . 0 0 "[ . 1 . 2]" 1
558 1 90 HIS HA 1 90 HIS HB3 2.990 . 3.590 2.741 2.368 2.907 . 0 0 "[ . 1 . 2]" 1
559 1 90 HIS QB 1 91 ASN H 3.670 . 4.270 3.267 2.619 3.851 . 0 0 "[ . 1 . 2]" 1
560 1 90 HIS HD2 1 154 VAL QG 6.420 . 7.020 4.360 2.053 5.367 . 0 0 "[ . 1 . 2]" 1
561 1 90 HIS HE1 1 154 VAL QG 5.760 . 6.360 3.152 1.907 5.571 . 0 0 "[ . 1 . 2]" 1
562 1 91 ASN H 1 91 ASN HA 2.800 . 3.400 2.790 2.743 2.860 . 0 0 "[ . 1 . 2]" 1
563 1 91 ASN H 1 91 ASN HB2 3.830 . 4.430 2.446 2.338 2.672 . 0 0 "[ . 1 . 2]" 1
564 1 91 ASN H 1 91 ASN QB 3.340 . 3.940 2.334 2.195 2.424 . 0 0 "[ . 1 . 2]" 1
565 1 91 ASN H 1 91 ASN HB3 3.830 . 4.430 3.234 2.414 3.554 . 0 0 "[ . 1 . 2]" 1
566 1 92 THR HA 1 92 THR MG 3.510 . 4.110 2.488 2.317 3.151 . 0 0 "[ . 1 . 2]" 1
567 1 92 THR HA 1 93 SER H 2.770 . 3.370 2.320 2.209 2.482 . 0 0 "[ . 1 . 2]" 1
568 1 92 THR HA 1 152 TRP HE1 5.500 . 6.100 3.855 2.159 5.580 . 0 0 "[ . 1 . 2]" 1
569 1 92 THR HA 1 154 VAL HA 2.620 . 3.220 2.584 2.273 3.108 . 0 0 "[ . 1 . 2]" 1
570 1 92 THR HA 1 155 ALA H 3.550 . 4.150 3.163 2.246 4.183 0.033 2 0 "[ . 1 . 2]" 1
571 1 92 THR HB 1 123 HIS HD2 3.890 . 4.490 3.767 2.725 4.593 0.103 14 0 "[ . 1 . 2]" 1
572 1 92 THR HB 1 152 TRP HE1 5.500 . 6.100 3.748 2.327 4.676 . 0 0 "[ . 1 . 2]" 1
573 1 92 THR MG 1 93 SER H 4.410 . 5.010 2.843 2.349 3.969 . 0 0 "[ . 1 . 2]" 1
574 1 92 THR MG 1 94 GLN H 5.000 . 5.600 3.049 2.176 5.181 . 0 0 "[ . 1 . 2]" 1
575 1 92 THR MG 1 123 HIS HD2 3.980 . 4.580 4.117 2.116 4.743 0.163 4 0 "[ . 1 . 2]" 1
576 1 92 THR MG 1 152 TRP HE1 4.470 . 5.070 2.592 1.907 4.342 . 0 0 "[ . 1 . 2]" 1
577 1 93 SER H 1 93 SER QB 2.850 . 3.450 2.546 2.275 3.000 . 0 0 "[ . 1 . 2]" 1
578 1 93 SER H 1 94 GLN H 3.020 . 3.620 2.226 2.009 2.480 . 0 0 "[ . 1 . 2]" 1
579 1 93 SER H 1 154 VAL HA 3.670 . 4.270 3.042 2.264 3.881 . 0 0 "[ . 1 . 2]" 1
580 1 93 SER H 1 155 ALA H 3.920 . 4.520 3.532 2.973 4.205 . 0 0 "[ . 1 . 2]" 1
581 1 93 SER HA 1 93 SER HB2 2.830 . 3.430 2.484 2.361 2.923 . 0 0 "[ . 1 . 2]" 1
582 1 93 SER HA 1 93 SER QB 2.340 . 2.940 2.239 2.132 2.312 . 0 0 "[ . 1 . 2]" 1
583 1 93 SER HA 1 93 SER HB3 2.830 . 3.430 2.660 2.290 2.935 . 0 0 "[ . 1 . 2]" 1
584 1 93 SER QB 1 94 GLN H 3.970 . 4.570 2.754 2.245 3.408 . 0 0 "[ . 1 . 2]" 1
585 1 93 SER QB 1 155 ALA MB 3.700 . 4.300 2.600 2.220 3.601 . 0 0 "[ . 1 . 2]" 1
586 1 94 GLN H 1 153 ASP H 3.860 . 4.460 3.375 3.011 3.556 . 0 0 "[ . 1 . 2]" 1
587 1 94 GLN HA 1 94 GLN HB2 2.860 . 3.460 2.459 2.388 2.765 . 0 0 "[ . 1 . 2]" 1
588 1 94 GLN HA 1 94 GLN QB 2.420 . 3.020 2.266 2.137 2.460 . 0 0 "[ . 1 . 2]" 1
589 1 94 GLN HA 1 94 GLN HB3 2.860 . 3.460 2.698 2.380 2.921 . 0 0 "[ . 1 . 2]" 1
590 1 94 GLN HA 1 95 TRP H 2.860 . 3.460 2.378 2.252 2.499 . 0 0 "[ . 1 . 2]" 1
591 1 94 GLN HA 1 122 PRO HA 2.400 . 3.000 2.303 2.171 2.484 . 0 0 "[ . 1 . 2]" 1
592 1 94 GLN HA 1 123 HIS H 2.990 . 3.590 2.700 2.101 3.211 . 0 0 "[ . 1 . 2]" 1
593 1 94 GLN QB 1 94 GLN QG 2.180 . 2.780 2.007 1.949 2.028 . 0 0 "[ . 1 . 2]" 1
594 1 94 GLN QB 1 95 TRP H 3.880 . 4.480 3.085 2.285 3.660 . 0 0 "[ . 1 . 2]" 1
595 1 94 GLN QG 1 95 TRP H 3.460 . 4.060 2.966 2.404 3.684 . 0 0 "[ . 1 . 2]" 1
596 1 94 GLN QG 1 96 HIS HD2 5.340 . 5.940 3.719 2.150 5.947 0.007 7 0 "[ . 1 . 2]" 1
597 1 94 GLN HG2 1 95 TRP H 4.170 . 4.770 3.468 2.451 4.738 . 0 0 "[ . 1 . 2]" 1
598 1 94 GLN HG3 1 95 TRP H 4.170 . 4.770 3.453 2.645 4.095 . 0 0 "[ . 1 . 2]" 1
599 1 95 TRP H 1 95 TRP QB 3.140 . 3.740 3.209 3.112 3.283 . 0 0 "[ . 1 . 2]" 1
600 1 95 TRP H 1 95 TRP HD1 3.640 . 4.240 3.285 2.488 4.217 . 0 0 "[ . 1 . 2]" 1
601 1 95 TRP H 1 121 VAL H 4.170 . 4.770 3.325 3.136 3.614 . 0 0 "[ . 1 . 2]" 1
602 1 95 TRP H 1 122 PRO HA 3.520 . 4.120 3.182 3.028 3.296 . 0 0 "[ . 1 . 2]" 1
603 1 95 TRP H 1 122 PRO QB 4.180 . 4.780 4.856 4.787 4.920 0.140 18 0 "[ . 1 . 2]" 1
604 1 95 TRP HA 1 96 HIS H 2.490 . 3.090 2.271 2.206 2.345 . 0 0 "[ . 1 . 2]" 1
605 1 95 TRP HA 1 152 TRP HA 3.110 . 3.710 2.729 2.417 2.951 . 0 0 "[ . 1 . 2]" 1
606 1 95 TRP HA 1 153 ASP H 3.640 . 4.240 3.103 2.901 3.406 . 0 0 "[ . 1 . 2]" 1
607 1 95 TRP QB 1 96 HIS H 3.730 . 4.330 2.843 2.639 3.118 . 0 0 "[ . 1 . 2]" 1
608 1 95 TRP QB 1 152 TRP HD1 5.340 . 5.940 3.857 2.029 5.509 . 0 0 "[ . 1 . 2]" 1
609 1 95 TRP HD1 1 121 VAL H 5.500 . 6.100 4.577 3.147 5.551 . 0 0 "[ . 1 . 2]" 1
610 1 95 TRP HD1 1 132 LEU QD 4.840 . 5.440 4.647 3.261 5.525 0.085 16 0 "[ . 1 . 2]" 1
611 1 95 TRP HE1 1 121 VAL QG 6.420 . 7.020 2.701 2.295 3.692 . 0 0 "[ . 1 . 2]" 1
612 1 95 TRP HZ3 1 132 LEU QD 3.410 . 4.010 3.478 2.962 4.112 0.102 1 0 "[ . 1 . 2]" 1
613 1 96 HIS H 1 96 HIS QB 3.110 . 3.710 3.240 3.144 3.327 . 0 0 "[ . 1 . 2]" 1
614 1 96 HIS H 1 96 HIS HD2 2.830 . 3.430 2.885 1.977 3.442 0.012 5 0 "[ . 1 . 2]" 1
615 1 96 HIS H 1 151 VAL H 3.050 . 3.650 2.990 2.799 3.257 . 0 0 "[ . 1 . 2]" 1
616 1 96 HIS H 1 151 VAL HB 4.070 . 4.670 3.457 2.816 3.929 . 0 0 "[ . 1 . 2]" 1
617 1 96 HIS H 1 151 VAL QG 6.420 . 7.020 3.968 3.498 4.227 . 0 0 "[ . 1 . 2]" 1
618 1 96 HIS H 1 152 TRP HA 4.660 . 5.260 3.932 3.639 4.146 . 0 0 "[ . 1 . 2]" 1
619 1 96 HIS HA 1 97 TYR QE 6.700 . 7.300 4.188 3.594 5.005 . 0 0 "[ . 1 . 2]" 1
620 1 96 HIS HA 1 120 ALA HA 2.400 . 3.000 2.268 2.153 2.445 . 0 0 "[ . 1 . 2]" 1
621 1 96 HIS HA 1 120 ALA MB 4.470 . 5.070 3.503 3.219 3.753 . 0 0 "[ . 1 . 2]" 1
622 1 96 HIS HA 1 121 VAL H 3.420 . 4.020 3.178 2.976 3.445 . 0 0 "[ . 1 . 2]" 1
623 1 96 HIS HA 1 121 VAL QG 4.710 . 5.310 4.245 3.485 4.684 . 0 0 "[ . 1 . 2]" 1
624 1 96 HIS HB2 1 97 TYR H 3.360 . 3.960 2.635 2.418 3.014 . 0 0 "[ . 1 . 2]" 1
625 1 96 HIS HB3 1 97 TYR H 3.360 . 3.960 3.568 2.892 3.843 . 0 0 "[ . 1 . 2]" 1
626 1 96 HIS HD2 1 151 VAL H 5.500 . 6.100 4.347 2.624 5.505 . 0 0 "[ . 1 . 2]" 1
627 1 96 HIS HD2 1 151 VAL HB 5.500 . 6.100 3.292 2.061 4.096 . 0 0 "[ . 1 . 2]" 1
628 1 96 HIS HD2 1 151 VAL QG 6.420 . 7.020 3.506 2.638 4.209 . 0 0 "[ . 1 . 2]" 1
629 1 96 HIS HE1 1 151 VAL QG 4.710 . 5.310 3.205 2.441 4.863 . 0 0 "[ . 1 . 2]" 1
630 1 97 TYR H 1 97 TYR HB2 3.830 . 4.430 3.285 2.409 3.885 . 0 0 "[ . 1 . 2]" 1
631 1 97 TYR H 1 97 TYR HB3 3.830 . 4.430 3.593 3.253 3.772 . 0 0 "[ . 1 . 2]" 1
632 1 97 TYR H 1 119 GLY H 3.860 . 4.460 3.490 3.360 3.729 . 0 0 "[ . 1 . 2]" 1
633 1 97 TYR H 1 120 ALA HA 3.390 . 3.990 3.368 3.193 3.609 . 0 0 "[ . 1 . 2]" 1
634 1 97 TYR HA 1 98 TYR H 2.550 . 3.150 2.252 2.189 2.318 . 0 0 "[ . 1 . 2]" 1
635 1 97 TYR HA 1 150 ALA HA 2.400 . 3.000 2.417 2.239 2.791 . 0 0 "[ . 1 . 2]" 1
636 1 97 TYR HA 1 151 VAL H 3.450 . 4.050 3.475 3.227 3.778 . 0 0 "[ . 1 . 2]" 1
637 1 97 TYR HB2 1 98 TYR H 4.290 . 4.890 3.204 2.608 4.236 . 0 0 "[ . 1 . 2]" 1
638 1 97 TYR HB3 1 98 TYR H 4.290 . 4.890 3.311 2.879 3.768 . 0 0 "[ . 1 . 2]" 1
639 1 97 TYR QD 1 99 ILE MG 5.550 . 6.150 4.701 2.949 5.865 . 0 0 "[ . 1 . 2]" 1
640 1 97 TYR QD 1 118 ILE MG 5.980 . 6.580 2.837 1.974 4.695 . 0 0 "[ . 1 . 2]" 1
641 1 97 TYR QD 1 119 GLY H 7.630 . 8.230 4.109 3.053 5.659 . 0 0 "[ . 1 . 2]" 1
642 1 97 TYR QD 1 121 VAL QG 5.600 . 6.200 4.341 3.793 4.982 . 0 0 "[ . 1 . 2]" 1
643 1 97 TYR QD 1 136 ILE MD 5.550 . 6.150 3.834 2.864 4.813 . 0 0 "[ . 1 . 2]" 1
644 1 97 TYR QD 1 136 ILE MG 6.170 . 6.770 5.107 3.806 6.500 . 0 0 "[ . 1 . 2]" 1
645 1 97 TYR QE 1 118 ILE MG 6.390 . 6.990 3.869 2.176 5.490 . 0 0 "[ . 1 . 2]" 1
646 1 97 TYR QE 1 121 VAL QG 5.760 . 6.360 3.293 2.390 5.235 . 0 0 "[ . 1 . 2]" 1
647 1 97 TYR QE 1 134 HIS QB 4.670 . 5.270 3.854 3.235 4.895 . 0 0 "[ . 1 . 2]" 1
648 1 97 TYR QE 1 136 ILE MD 6.210 . 6.810 3.538 2.357 5.117 . 0 0 "[ . 1 . 2]" 1
649 1 97 TYR QE 1 150 ALA MB 6.820 . 7.420 4.360 2.446 5.823 . 0 0 "[ . 1 . 2]" 1
650 1 98 TYR H 1 98 TYR QB 3.550 . 4.150 2.707 2.443 3.238 . 0 0 "[ . 1 . 2]" 1
651 1 98 TYR H 1 148 ILE MG 5.770 . 6.370 3.622 3.155 4.005 . 0 0 "[ . 1 . 2]" 1
652 1 98 TYR H 1 149 LEU H 3.360 . 3.960 3.043 2.935 3.223 . 0 0 "[ . 1 . 2]" 1
653 1 98 TYR H 1 149 LEU QB 4.710 . 5.310 3.217 2.876 3.690 . 0 0 "[ . 1 . 2]" 1
654 1 98 TYR H 1 149 LEU QD 6.420 . 7.020 4.276 3.678 4.939 . 0 0 "[ . 1 . 2]" 1
655 1 98 TYR H 1 150 ALA HA 4.140 . 4.740 3.496 3.235 3.625 . 0 0 "[ . 1 . 2]" 1
656 1 98 TYR HA 1 99 ILE H 2.710 . 3.310 2.446 2.383 2.513 . 0 0 "[ . 1 . 2]" 1
657 1 98 TYR HA 1 117 LEU HA 3.110 . 3.710 2.522 2.216 2.883 . 0 0 "[ . 1 . 2]" 1
658 1 98 TYR HA 1 117 LEU QD 4.810 . 5.410 3.584 3.284 4.420 . 0 0 "[ . 1 . 2]" 1
659 1 98 TYR HA 1 118 ILE H 3.170 . 3.770 2.375 2.193 2.653 . 0 0 "[ . 1 . 2]" 1
660 1 98 TYR HA 1 119 GLY H 3.950 . 4.550 4.153 3.998 4.386 . 0 0 "[ . 1 . 2]" 1
661 1 98 TYR QB 1 99 ILE H 2.860 . 3.460 2.536 2.389 2.738 . 0 0 "[ . 1 . 2]" 1
662 1 98 TYR QB 1 149 LEU H 4.490 . 5.090 3.520 3.067 4.808 . 0 0 "[ . 1 . 2]" 1
663 1 98 TYR HB2 1 99 ILE H 3.520 . 4.120 3.423 2.578 3.766 . 0 0 "[ . 1 . 2]" 1
664 1 98 TYR HB3 1 99 ILE H 3.520 . 4.120 2.693 2.429 3.540 . 0 0 "[ . 1 . 2]" 1
665 1 98 TYR QD 1 99 ILE H 7.570 . 8.170 4.156 3.661 4.400 . 0 0 "[ . 1 . 2]" 1
666 1 98 TYR QD 1 118 ILE H 7.630 . 8.230 4.358 4.120 4.737 . 0 0 "[ . 1 . 2]" 1
667 1 98 TYR QD 1 149 LEU MD1 8.650 . 9.250 4.375 3.543 6.021 . 0 0 "[ . 1 . 2]" 1
668 1 98 TYR QD 1 149 LEU QD 7.480 . 8.080 3.662 2.304 4.322 . 0 0 "[ . 1 . 2]" 1
669 1 98 TYR QD 1 149 LEU MD2 8.650 . 9.250 4.430 2.311 5.557 . 0 0 "[ . 1 . 2]" 1
670 1 98 TYR QD 1 149 LEU HG 5.120 . 5.720 5.197 4.231 5.747 0.027 13 0 "[ . 1 . 2]" 1
671 1 98 TYR QD 1 151 VAL QG 6.440 . 7.040 3.380 2.811 4.165 . 0 0 "[ . 1 . 2]" 1
672 1 98 TYR QE 1 149 LEU QD 8.000 . 8.600 4.604 2.102 5.835 . 0 0 "[ . 1 . 2]" 1
673 1 98 TYR QE 1 151 VAL QG 6.470 . 7.070 2.622 2.151 4.233 . 0 0 "[ . 1 . 2]" 1
674 1 99 ILE H 1 99 ILE HB 3.950 . 4.550 3.812 3.765 3.908 . 0 0 "[ . 1 . 2]" 1
675 1 99 ILE H 1 99 ILE MG 3.910 . 4.510 3.036 2.850 3.178 . 0 0 "[ . 1 . 2]" 1
676 1 99 ILE H 1 115 PHE QB 4.730 . 5.330 4.256 3.351 5.374 0.044 11 0 "[ . 1 . 2]" 1
677 1 99 ILE H 1 115 PHE QD 7.630 . 8.230 4.843 3.171 5.865 . 0 0 "[ . 1 . 2]" 1
678 1 99 ILE H 1 116 GLU H 3.020 . 3.620 2.821 2.565 3.155 . 0 0 "[ . 1 . 2]" 1
679 1 99 ILE H 1 116 GLU QB 5.340 . 5.940 3.652 2.819 4.757 . 0 0 "[ . 1 . 2]" 1
680 1 99 ILE H 1 117 LEU HA 3.640 . 4.240 3.968 3.765 4.193 . 0 0 "[ . 1 . 2]" 1
681 1 99 ILE H 1 118 ILE MG 4.530 . 5.130 3.894 3.226 4.233 . 0 0 "[ . 1 . 2]" 1
682 1 99 ILE HA 1 99 ILE QG 3.690 . 4.290 3.275 3.227 3.454 . 0 0 "[ . 1 . 2]" 1
683 1 99 ILE HA 1 100 THR H 2.650 . 3.250 2.387 2.262 2.491 . 0 0 "[ . 1 . 2]" 1
684 1 99 ILE HA 1 148 ILE HA 2.990 . 3.590 2.569 2.366 2.848 . 0 0 "[ . 1 . 2]" 1
685 1 99 ILE HA 1 149 LEU H 3.330 . 3.930 3.129 2.794 3.311 . 0 0 "[ . 1 . 2]" 1
686 1 99 ILE HB 1 99 ILE MD 3.420 . 4.020 2.508 2.336 3.219 . 0 0 "[ . 1 . 2]" 1
687 1 99 ILE HB 1 100 THR H 3.050 . 3.650 2.757 2.566 3.035 . 0 0 "[ . 1 . 2]" 1
688 1 99 ILE MD 1 136 ILE MG 6.240 . 6.840 4.630 3.109 5.765 . 0 0 "[ . 1 . 2]" 1
689 1 99 ILE QG 1 118 ILE MG 3.380 . 3.980 3.548 2.193 4.226 0.246 14 0 "[ . 1 . 2]" 1
690 1 99 ILE MG 1 100 THR H 5.000 . 5.600 3.825 3.719 3.932 . 0 0 "[ . 1 . 2]" 1
691 1 100 THR H 1 100 THR MG 4.070 . 4.670 2.709 1.961 3.844 . 0 0 "[ . 1 . 2]" 1
692 1 100 THR H 1 147 VAL H 3.240 . 3.840 3.159 2.397 3.785 . 0 0 "[ . 1 . 2]" 1
693 1 100 THR H 1 147 VAL HB 5.500 . 6.100 3.882 2.946 5.335 . 0 0 "[ . 1 . 2]" 1
694 1 100 THR H 1 147 VAL QG 5.830 . 6.430 4.115 3.265 4.447 . 0 0 "[ . 1 . 2]" 1
695 1 100 THR H 1 148 ILE HA 3.730 . 4.330 3.889 3.624 4.249 . 0 0 "[ . 1 . 2]" 1
696 1 100 THR HA 1 101 LYS H 2.770 . 3.370 2.269 2.176 2.366 . 0 0 "[ . 1 . 2]" 1
697 1 100 THR HB 1 147 VAL H 5.500 . 6.100 3.762 1.862 4.965 . 0 0 "[ . 1 . 2]" 1
698 1 100 THR MG 1 115 PHE QD 6.850 . 7.450 4.383 2.382 6.424 . 0 0 "[ . 1 . 2]" 1
699 1 100 THR MG 1 147 VAL H 4.630 . 5.230 3.147 1.729 4.396 . 0 0 "[ . 1 . 2]" 1
700 1 100 THR MG 1 147 VAL HB 4.010 . 4.610 2.719 2.145 4.451 . 0 0 "[ . 1 . 2]" 1
701 1 100 THR MG 1 147 VAL QG 4.770 . 5.370 2.760 2.155 3.636 . 0 0 "[ . 1 . 2]" 1
702 1 101 LYS HA 1 102 LYS H 2.710 . 3.310 2.193 2.150 2.261 . 0 0 "[ . 1 . 2]" 1
703 1 102 LYS H 1 102 LYS HA 2.930 . 3.530 2.833 2.795 2.870 . 0 0 "[ . 1 . 2]" 1
704 1 102 LYS H 1 102 LYS QB 2.960 . 3.560 2.457 2.176 2.694 . 0 0 "[ . 1 . 2]" 1
705 1 102 LYS HA 1 103 GLY H 2.830 . 3.430 2.351 2.251 2.420 . 0 0 "[ . 1 . 2]" 1
706 1 103 GLY H 1 104 TRP H 3.080 . 3.680 2.412 2.070 2.623 . 0 0 "[ . 1 . 2]" 1
707 1 103 GLY QA 1 104 TRP HD1 5.340 . 5.940 5.319 4.384 5.921 . 0 0 "[ . 1 . 2]" 1
708 1 104 TRP H 1 104 TRP HB2 3.760 . 4.360 3.515 3.451 3.547 . 0 0 "[ . 1 . 2]" 1
709 1 104 TRP H 1 104 TRP HB3 3.760 . 4.360 2.634 2.504 2.882 . 0 0 "[ . 1 . 2]" 1
710 1 104 TRP H 1 104 TRP HD1 3.730 . 4.330 3.830 2.950 4.283 . 0 0 "[ . 1 . 2]" 1
711 1 104 TRP HA 1 105 ASP H 2.400 . 3.000 2.322 2.196 2.388 . 0 0 "[ . 1 . 2]" 1
712 1 104 TRP QB 1 105 ASP H 2.570 . 3.170 2.673 2.464 2.906 . 0 0 "[ . 1 . 2]" 1
713 1 104 TRP HD1 1 105 ASP H 4.600 . 5.200 4.131 3.765 4.621 . 0 0 "[ . 1 . 2]" 1
714 1 104 TRP HH2 1 110 LEU QD 3.830 . 4.430 3.722 3.094 4.494 0.064 2 0 "[ . 1 . 2]" 1
715 1 104 TRP HZ2 1 110 LEU QD 3.960 . 4.560 2.891 2.265 3.645 . 0 0 "[ . 1 . 2]" 1
716 1 105 ASP H 1 105 ASP HB2 3.360 . 3.960 2.601 2.284 3.657 . 0 0 "[ . 1 . 2]" 1
717 1 105 ASP H 1 105 ASP QB 2.920 . 3.520 2.472 2.255 2.785 . 0 0 "[ . 1 . 2]" 1
718 1 105 ASP H 1 105 ASP HB3 3.360 . 3.960 3.459 2.851 3.671 . 0 0 "[ . 1 . 2]" 1
719 1 106 PRO QB 1 107 ASP H 3.030 . 3.630 3.464 3.384 3.612 . 0 0 "[ . 1 . 2]" 1
720 1 106 PRO QB 1 108 LYS H 4.850 . 5.450 4.697 4.525 4.874 . 0 0 "[ . 1 . 2]" 1
721 1 106 PRO HB2 1 107 ASP H 3.860 . 4.460 3.675 3.568 3.848 . 0 0 "[ . 1 . 2]" 1
722 1 106 PRO HB3 1 107 ASP H 3.860 . 4.460 4.239 4.169 4.385 . 0 0 "[ . 1 . 2]" 1
723 1 107 ASP H 1 107 ASP HB2 2.680 . 3.280 2.485 2.130 2.718 . 0 0 "[ . 1 . 2]" 1
724 1 107 ASP H 1 107 ASP HB3 2.650 . 3.250 2.477 2.197 2.898 . 0 0 "[ . 1 . 2]" 1
725 1 107 ASP H 1 108 LYS H 2.590 . 3.190 2.553 2.452 2.696 . 0 0 "[ . 1 . 2]" 1
726 1 107 ASP HA 1 107 ASP HB2 2.520 . 3.120 2.442 2.327 2.639 . 0 0 "[ . 1 . 2]" 1
727 1 107 ASP HB2 1 108 LYS H 4.290 . 4.890 4.072 3.697 4.454 . 0 0 "[ . 1 . 2]" 1
728 1 107 ASP HB3 1 108 LYS H 3.830 . 4.430 3.185 2.815 3.987 . 0 0 "[ . 1 . 2]" 1
729 1 108 LYS H 1 108 LYS HB2 3.610 . 4.210 2.464 2.292 2.668 . 0 0 "[ . 1 . 2]" 1
730 1 108 LYS H 1 108 LYS QB 3.150 . 3.750 2.423 2.263 2.612 . 0 0 "[ . 1 . 2]" 1
731 1 108 LYS H 1 108 LYS HB3 3.610 . 4.210 3.591 3.492 3.727 . 0 0 "[ . 1 . 2]" 1
732 1 108 LYS HA 1 109 PRO HD2 3.210 . 3.810 2.500 2.291 2.793 . 0 0 "[ . 1 . 2]" 1
733 1 108 LYS HA 1 109 PRO QD 2.650 . 3.250 2.271 2.133 2.423 . 0 0 "[ . 1 . 2]" 1
734 1 108 LYS HA 1 109 PRO HD3 3.210 . 3.810 2.614 2.478 2.744 . 0 0 "[ . 1 . 2]" 1
735 1 108 LYS HA 1 110 LEU H 5.500 . 6.100 5.586 4.920 5.962 . 0 0 "[ . 1 . 2]" 1
736 1 108 LYS QE 1 108 LYS QG 2.360 . 2.960 2.151 2.018 2.329 . 0 0 "[ . 1 . 2]" 1
737 1 109 PRO HA 1 111 LYS H 4.690 . 5.290 3.948 3.430 4.501 . 0 0 "[ . 1 . 2]" 1
738 1 109 PRO HA 1 113 ALA H 5.500 . 6.100 5.253 4.958 5.930 . 0 0 "[ . 1 . 2]" 1
739 1 110 LEU H 1 110 LEU QD 3.530 . 4.130 3.247 1.744 3.730 . 0 0 "[ . 1 . 2]" 1
740 1 110 LEU H 1 111 LYS H 3.580 . 4.180 2.894 2.687 3.098 . 0 0 "[ . 1 . 2]" 1
741 1 110 LEU HA 1 113 ALA H 4.970 . 5.570 3.332 2.795 4.130 . 0 0 "[ . 1 . 2]" 1
742 1 110 LEU HA 1 113 ALA MB 5.090 . 5.690 2.871 2.194 4.078 . 0 0 "[ . 1 . 2]" 1
743 1 110 LEU QB 1 111 LYS H 3.130 . 3.730 2.698 2.370 3.410 . 0 0 "[ . 1 . 2]" 1
744 1 110 LEU QD 1 111 LYS H 6.270 . 6.870 3.615 3.006 4.533 . 0 0 "[ . 1 . 2]" 1
745 1 111 LYS H 1 111 LYS QB 3.190 . 3.790 2.448 2.046 2.585 . 0 0 "[ . 1 . 2]" 1
746 1 111 LYS H 1 111 LYS QE 4.730 . 5.330 4.017 2.953 4.856 . 0 0 "[ . 1 . 2]" 1
747 1 111 LYS HA 1 111 LYS QB 2.640 . 3.240 2.267 2.110 2.430 . 0 0 "[ . 1 . 2]" 1
748 1 111 LYS HA 1 112 ARG H 3.390 . 3.990 3.367 3.181 3.467 . 0 0 "[ . 1 . 2]" 1
749 1 111 LYS QE 1 112 ARG H 5.110 . 5.710 5.247 4.817 5.801 0.091 16 0 "[ . 1 . 2]" 1
750 1 112 ARG H 1 112 ARG HB2 2.400 . 3.000 2.330 2.153 2.538 . 0 0 "[ . 1 . 2]" 1
751 1 112 ARG H 1 112 ARG HD2 5.500 . 6.100 4.095 2.748 5.154 . 0 0 "[ . 1 . 2]" 1
752 1 112 ARG H 1 112 ARG QD 4.830 . 5.430 3.635 2.540 4.717 . 0 0 "[ . 1 . 2]" 1
753 1 112 ARG H 1 112 ARG HD3 5.500 . 6.100 4.231 2.947 5.927 . 0 0 "[ . 1 . 2]" 1
754 1 112 ARG H 1 113 ALA H 3.170 . 3.770 2.311 2.107 2.522 . 0 0 "[ . 1 . 2]" 1
755 1 112 ARG HB2 1 113 ALA H 3.420 . 4.020 2.795 2.472 3.750 . 0 0 "[ . 1 . 2]" 1
756 1 112 ARG HB2 1 114 ASP H 4.690 . 5.290 5.018 4.692 5.279 . 0 0 "[ . 1 . 2]" 1
757 1 112 ARG HB3 1 113 ALA H 2.740 . 3.340 3.244 2.550 3.392 0.052 9 0 "[ . 1 . 2]" 1
758 1 112 ARG QG 1 113 ALA H 4.290 . 4.890 4.248 3.881 4.515 . 0 0 "[ . 1 . 2]" 1
759 1 113 ALA H 1 114 ASP H 3.550 . 4.150 2.669 2.522 2.880 . 0 0 "[ . 1 . 2]" 1
760 1 113 ALA MB 1 114 ASP H 4.630 . 5.230 3.190 2.805 3.470 . 0 0 "[ . 1 . 2]" 1
761 1 114 ASP H 1 114 ASP HB2 3.520 . 4.120 2.541 2.035 3.569 . 0 0 "[ . 1 . 2]" 1
762 1 114 ASP H 1 114 ASP QB 2.880 . 3.480 2.266 2.012 2.575 . 0 0 "[ . 1 . 2]" 1
763 1 114 ASP H 1 114 ASP HB3 3.520 . 4.120 2.898 2.295 3.542 . 0 0 "[ . 1 . 2]" 1
764 1 114 ASP HA 1 114 ASP HB2 2.830 . 3.430 2.610 2.386 2.917 . 0 0 "[ . 1 . 2]" 1
765 1 114 ASP HA 1 114 ASP HB3 2.830 . 3.430 2.717 2.389 2.928 . 0 0 "[ . 1 . 2]" 1
766 1 114 ASP HA 1 115 PHE H 3.420 . 4.020 3.431 3.328 3.486 . 0 0 "[ . 1 . 2]" 1
767 1 114 ASP QB 1 115 PHE QD 5.130 . 5.730 3.086 2.321 4.253 . 0 0 "[ . 1 . 2]" 1
768 1 115 PHE H 1 115 PHE QB 2.570 . 3.170 2.752 2.385 3.029 . 0 0 "[ . 1 . 2]" 1
769 1 115 PHE HA 1 116 GLU H 2.830 . 3.430 2.250 2.140 2.356 . 0 0 "[ . 1 . 2]" 1
770 1 115 PHE QB 1 116 GLU H 4.440 . 5.040 2.990 2.455 3.751 . 0 0 "[ . 1 . 2]" 1
771 1 115 PHE QD 1 149 LEU QD 5.930 . 6.530 3.432 2.258 5.000 . 0 0 "[ . 1 . 2]" 1
772 1 116 GLU H 1 116 GLU QB 3.370 . 3.970 2.558 2.362 2.937 . 0 0 "[ . 1 . 2]" 1
773 1 116 GLU HA 1 117 LEU H 2.430 . 3.030 2.279 2.180 2.412 . 0 0 "[ . 1 . 2]" 1
774 1 116 GLU QB 1 117 LEU H 3.470 . 4.070 3.015 2.696 3.495 . 0 0 "[ . 1 . 2]" 1
775 1 117 LEU H 1 117 LEU HB2 3.210 . 3.810 2.592 2.449 2.744 . 0 0 "[ . 1 . 2]" 1
776 1 117 LEU H 1 117 LEU QB 2.770 . 3.370 2.246 2.213 2.288 . 0 0 "[ . 1 . 2]" 1
777 1 117 LEU H 1 117 LEU HB3 3.210 . 3.810 2.468 2.414 2.561 . 0 0 "[ . 1 . 2]" 1
778 1 117 LEU H 1 117 LEU HG 5.440 . 6.040 4.435 4.392 4.485 . 0 0 "[ . 1 . 2]" 1
779 1 117 LEU HA 1 119 GLY H 3.980 . 4.580 3.526 3.312 3.662 . 0 0 "[ . 1 . 2]" 1
780 1 117 LEU QB 1 118 ILE H 3.880 . 4.480 3.769 3.652 3.879 . 0 0 "[ . 1 . 2]" 1
781 1 117 LEU QB 1 120 ALA MB 4.140 . 4.740 4.795 4.566 4.937 0.197 9 0 "[ . 1 . 2]" 1
782 1 117 LEU QD 1 119 GLY H 3.500 . 4.100 2.711 2.469 2.979 . 0 0 "[ . 1 . 2]" 1
783 1 117 LEU QD 1 120 ALA MB 5.370 . 5.970 2.233 2.066 2.381 . 0 0 "[ . 1 . 2]" 1
784 1 117 LEU HG 1 119 GLY H 4.850 . 5.450 2.323 2.057 2.764 . 0 0 "[ . 1 . 2]" 1
785 1 117 LEU HG 1 120 ALA MB 3.730 . 4.330 3.788 3.478 4.039 . 0 0 "[ . 1 . 2]" 1
786 1 118 ILE H 1 118 ILE MG 4.010 . 4.610 2.373 2.016 2.947 . 0 0 "[ . 1 . 2]" 1
787 1 118 ILE H 1 119 GLY H 2.400 . 3.000 2.100 1.861 2.294 . 0 0 "[ . 1 . 2]" 1
788 1 118 ILE HA 1 118 ILE HB 2.590 . 3.190 2.502 2.409 2.653 . 0 0 "[ . 1 . 2]" 1
789 1 118 ILE HB 1 119 GLY H 3.920 . 4.520 4.194 4.069 4.352 . 0 0 "[ . 1 . 2]" 1
790 1 118 ILE MG 1 119 GLY H 4.780 . 5.380 3.049 2.779 4.289 . 0 0 "[ . 1 . 2]" 1
791 1 119 GLY QA 1 120 ALA H 2.410 . 3.010 2.184 2.100 2.232 . 0 0 "[ . 1 . 2]" 1
792 1 119 GLY HA2 1 120 ALA H 2.860 . 3.460 2.271 2.156 2.348 . 0 0 "[ . 1 . 2]" 1
793 1 119 GLY HA3 1 120 ALA H 2.860 . 3.460 2.853 2.760 3.029 . 0 0 "[ . 1 . 2]" 1
794 1 120 ALA HA 1 121 VAL H 2.400 . 3.000 2.255 2.215 2.311 . 0 0 "[ . 1 . 2]" 1
795 1 120 ALA MB 1 121 VAL H 4.070 . 4.670 2.970 2.806 3.220 . 0 0 "[ . 1 . 2]" 1
796 1 121 VAL H 1 121 VAL HB 2.990 . 3.590 2.913 2.751 3.556 . 0 0 "[ . 1 . 2]" 1
797 1 121 VAL H 1 121 VAL QG 4.050 . 4.650 2.760 2.329 2.938 . 0 0 "[ . 1 . 2]" 1
798 1 121 VAL QG 1 134 HIS HA 5.580 . 6.180 5.445 4.785 5.718 . 0 0 "[ . 1 . 2]" 1
799 1 121 VAL QG 1 134 HIS QB 3.680 . 4.280 4.190 3.905 4.491 0.211 20 0 "[ . 1 . 2]" 1
800 1 121 VAL QG 1 134 HIS HD2 6.420 . 7.020 3.342 2.746 4.302 . 0 0 "[ . 1 . 2]" 1
801 1 121 VAL QG 1 135 HIS H 5.640 . 6.240 6.238 5.443 6.525 0.285 17 0 "[ . 1 . 2]" 1
802 1 122 PRO HA 1 123 HIS H 2.550 . 3.150 2.357 2.258 2.449 . 0 0 "[ . 1 . 2]" 1
803 1 122 PRO HB2 1 123 HIS H 3.390 . 3.990 2.770 2.362 3.171 . 0 0 "[ . 1 . 2]" 1
804 1 122 PRO HB3 1 123 HIS H 3.390 . 3.990 3.637 3.387 3.834 . 0 0 "[ . 1 . 2]" 1
805 1 123 HIS H 1 123 HIS HB2 3.110 . 3.710 3.026 2.770 3.340 . 0 0 "[ . 1 . 2]" 1
806 1 123 HIS H 1 123 HIS QB 2.710 . 3.310 2.433 2.236 2.693 . 0 0 "[ . 1 . 2]" 1
807 1 123 HIS H 1 123 HIS HB3 3.110 . 3.710 2.569 2.355 2.891 . 0 0 "[ . 1 . 2]" 1
808 1 123 HIS HA 1 124 ASP H 2.710 . 3.310 2.138 1.980 2.295 . 0 0 "[ . 1 . 2]" 1
809 1 123 HIS HA 1 125 GLY H 4.510 . 5.110 4.173 2.905 5.235 0.125 16 0 "[ . 1 . 2]" 1
810 1 124 ASP H 1 124 ASP HB2 3.580 . 4.180 3.251 2.512 3.725 . 0 0 "[ . 1 . 2]" 1
811 1 124 ASP H 1 124 ASP HB3 3.580 . 4.180 3.122 2.634 3.781 . 0 0 "[ . 1 . 2]" 1
812 1 124 ASP H 1 125 GLY H 3.020 . 3.620 2.613 1.786 3.404 . 0 0 "[ . 1 . 2]" 1
813 1 124 ASP HA 1 124 ASP HB2 2.800 . 3.400 2.507 2.319 2.908 . 0 0 "[ . 1 . 2]" 1
814 1 124 ASP HA 1 124 ASP HB3 2.800 . 3.400 2.650 2.245 2.908 . 0 0 "[ . 1 . 2]" 1
815 1 124 ASP QB 1 125 GLY H 3.590 . 4.190 2.883 1.709 4.008 . 0 0 "[ . 1 . 2]" 1
816 1 125 GLY H 1 125 GLY QA 2.510 . 3.110 2.304 2.156 2.457 . 0 0 "[ . 1 . 2]" 1
817 1 126 SER H 1 126 SER QB 3.660 . 4.260 2.627 2.239 3.345 . 0 0 "[ . 1 . 2]" 1
818 1 127 PRO HA 1 128 ALA H 2.590 . 3.190 2.760 2.284 3.211 0.021 12 0 "[ . 1 . 2]" 1
819 1 127 PRO HA 1 129 SER H 5.500 . 6.100 4.017 3.133 4.534 . 0 0 "[ . 1 . 2]" 1
820 1 127 PRO QB 1 128 ALA H 3.860 . 4.460 2.782 1.863 4.015 . 0 0 "[ . 1 . 2]" 1
821 1 127 PRO HB2 1 128 ALA H 4.600 . 5.200 2.908 1.874 4.389 . 0 0 "[ . 1 . 2]" 1
822 1 127 PRO HB3 1 128 ALA H 4.600 . 5.200 3.771 3.259 4.651 . 0 0 "[ . 1 . 2]" 1
823 1 127 PRO QG 1 128 ALA H 5.030 . 5.630 3.543 2.767 4.211 . 0 0 "[ . 1 . 2]" 1
824 1 128 ALA H 1 129 SER H 3.980 . 4.580 2.755 2.552 3.101 . 0 0 "[ . 1 . 2]" 1
825 1 128 ALA MB 1 129 SER H 6.520 . 7.120 2.848 2.503 3.099 . 0 0 "[ . 1 . 2]" 1
826 1 129 SER H 1 130 ARG H 3.580 . 4.180 2.664 2.312 2.877 . 0 0 "[ . 1 . 2]" 1
827 1 129 SER HA 1 131 ASN H 3.730 . 4.330 3.526 3.170 4.071 . 0 0 "[ . 1 . 2]" 1
828 1 130 ARG H 1 130 ARG QB 2.860 . 3.460 2.267 2.113 2.472 . 0 0 "[ . 1 . 2]" 1
829 1 130 ARG H 1 130 ARG QG 4.260 . 4.860 3.372 2.135 3.978 . 0 0 "[ . 1 . 2]" 1
830 1 130 ARG HA 1 131 ASN H 3.480 . 4.080 3.302 2.993 3.468 . 0 0 "[ . 1 . 2]" 1
831 1 130 ARG HB2 1 131 ASN H 4.140 . 4.740 3.880 2.713 4.395 . 0 0 "[ . 1 . 2]" 1
832 1 130 ARG HB3 1 131 ASN H 4.140 . 4.740 3.546 2.686 4.499 . 0 0 "[ . 1 . 2]" 1
833 1 130 ARG QG 1 131 ASN H 5.340 . 5.940 4.027 2.633 4.938 . 0 0 "[ . 1 . 2]" 1
834 1 131 ASN H 1 131 ASN HB2 3.700 . 4.300 2.374 2.154 2.566 . 0 0 "[ . 1 . 2]" 1
835 1 131 ASN H 1 131 ASN QB 3.220 . 3.820 2.320 2.132 2.495 . 0 0 "[ . 1 . 2]" 1
836 1 131 ASN H 1 131 ASN HB3 3.700 . 4.300 3.423 2.547 3.630 . 0 0 "[ . 1 . 2]" 1
837 1 131 ASN HA 1 132 LEU H 2.400 . 3.000 2.234 2.144 2.370 . 0 0 "[ . 1 . 2]" 1
838 1 131 ASN HA 1 133 SER H 3.670 . 4.270 3.677 3.241 4.215 . 0 0 "[ . 1 . 2]" 1
839 1 131 ASN QB 1 132 LEU H 4.440 . 5.040 3.178 2.665 3.830 . 0 0 "[ . 1 . 2]" 1
840 1 132 LEU H 1 132 LEU HB2 3.050 . 3.650 2.173 2.050 2.473 . 0 0 "[ . 1 . 2]" 1
841 1 132 LEU H 1 132 LEU QB 2.320 . 2.920 2.108 2.027 2.242 . 0 0 "[ . 1 . 2]" 1
842 1 132 LEU H 1 132 LEU HB3 3.050 . 3.650 3.086 2.426 3.476 . 0 0 "[ . 1 . 2]" 1
843 1 132 LEU H 1 132 LEU HG 4.290 . 4.890 4.231 3.905 4.484 . 0 0 "[ . 1 . 2]" 1
844 1 132 LEU H 1 133 SER H 2.710 . 3.310 2.527 2.198 2.735 . 0 0 "[ . 1 . 2]" 1
845 1 132 LEU HA 1 133 SER H 3.420 . 4.020 3.319 3.247 3.443 . 0 0 "[ . 1 . 2]" 1
846 1 132 LEU QB 1 133 SER H 3.450 . 4.050 3.099 2.761 3.280 . 0 0 "[ . 1 . 2]" 1
847 1 132 LEU HB2 1 133 SER H 4.110 . 4.710 3.608 3.332 4.186 . 0 0 "[ . 1 . 2]" 1
848 1 132 LEU HB3 1 133 SER H 4.110 . 4.710 3.449 2.883 3.901 . 0 0 "[ . 1 . 2]" 1
849 1 132 LEU HG 1 133 SER H 5.500 . 6.100 5.336 4.321 5.665 . 0 0 "[ . 1 . 2]" 1
850 1 133 SER H 1 133 SER HB2 3.300 . 3.900 2.747 2.466 2.850 . 0 0 "[ . 1 . 2]" 1
851 1 133 SER H 1 133 SER HB3 3.300 . 3.900 2.601 2.429 3.584 . 0 0 "[ . 1 . 2]" 1
852 1 133 SER HA 1 134 HIS H 2.490 . 3.090 2.228 2.166 2.292 . 0 0 "[ . 1 . 2]" 1
853 1 133 SER QB 1 134 HIS H 3.700 . 4.300 3.649 2.913 3.778 . 0 0 "[ . 1 . 2]" 1
854 1 134 HIS H 1 134 HIS QB 3.370 . 3.970 2.589 2.362 2.709 . 0 0 "[ . 1 . 2]" 1
855 1 134 HIS H 1 134 HIS HD2 5.500 . 6.100 4.868 3.363 5.537 . 0 0 "[ . 1 . 2]" 1
856 1 134 HIS HA 1 134 HIS HD2 2.710 . 3.310 3.192 2.516 3.409 0.099 8 0 "[ . 1 . 2]" 1
857 1 134 HIS HA 1 135 HIS H 2.400 . 3.000 2.212 2.120 2.281 . 0 0 "[ . 1 . 2]" 1
858 1 134 HIS QB 1 135 HIS H 3.130 . 3.730 3.167 2.677 3.653 . 0 0 "[ . 1 . 2]" 1
859 1 134 HIS HD2 1 135 HIS H 4.790 . 5.390 4.463 2.492 5.337 . 0 0 "[ . 1 . 2]" 1
860 1 135 HIS H 1 135 HIS QB 2.740 . 3.340 2.370 2.235 2.556 . 0 0 "[ . 1 . 2]" 1
861 1 135 HIS H 1 135 HIS HD2 5.500 . 6.100 2.847 2.433 3.302 . 0 0 "[ . 1 . 2]" 1
862 1 135 HIS HA 1 136 ILE H 2.400 . 3.000 2.242 2.208 2.274 . 0 0 "[ . 1 . 2]" 1
863 1 135 HIS QB 1 136 ILE H 3.320 . 3.920 3.094 2.985 3.274 . 0 0 "[ . 1 . 2]" 1
864 1 135 HIS HB2 1 136 ILE H 4.010 . 4.610 4.102 3.942 4.262 . 0 0 "[ . 1 . 2]" 1
865 1 135 HIS HB3 1 136 ILE H 4.010 . 4.610 3.202 3.071 3.403 . 0 0 "[ . 1 . 2]" 1
866 1 136 ILE H 1 136 ILE HB 2.800 . 3.400 2.757 2.693 2.843 . 0 0 "[ . 1 . 2]" 1
867 1 136 ILE H 1 136 ILE QG 3.490 . 4.090 3.038 2.875 3.727 . 0 0 "[ . 1 . 2]" 1
868 1 136 ILE HA 1 136 ILE MD 3.790 . 4.390 2.865 2.265 3.903 . 0 0 "[ . 1 . 2]" 1
869 1 136 ILE HA 1 137 TYR H 2.400 . 3.000 2.266 2.228 2.305 . 0 0 "[ . 1 . 2]" 1
870 1 136 ILE HB 1 137 TYR H 3.980 . 4.580 4.236 4.140 4.391 . 0 0 "[ . 1 . 2]" 1
871 1 136 ILE MD 1 137 TYR H 5.280 . 5.880 4.522 3.923 5.508 . 0 0 "[ . 1 . 2]" 1
872 1 136 ILE QG 1 137 TYR H 5.340 . 5.940 4.558 4.137 4.796 . 0 0 "[ . 1 . 2]" 1
873 1 136 ILE QG 1 148 ILE MD 4.560 . 5.160 4.844 3.794 5.370 0.210 5 0 "[ . 1 . 2]" 1
874 1 136 ILE MG 1 137 TYR H 4.260 . 4.860 2.904 2.716 3.261 . 0 0 "[ . 1 . 2]" 1
875 1 137 TYR H 1 137 TYR HB2 2.710 . 3.310 2.726 2.573 2.835 . 0 0 "[ . 1 . 2]" 1
876 1 137 TYR H 1 137 TYR HB3 2.710 . 3.310 2.489 2.348 2.688 . 0 0 "[ . 1 . 2]" 1
877 1 137 TYR HA 1 138 ILE H 2.430 . 3.030 2.236 2.193 2.268 . 0 0 "[ . 1 . 2]" 1
878 1 137 TYR QB 1 138 ILE H 4.170 . 4.770 3.636 3.536 3.756 . 0 0 "[ . 1 . 2]" 1
879 1 137 TYR QD 1 138 ILE H 7.630 . 8.230 3.357 3.087 3.607 . 0 0 "[ . 1 . 2]" 1
880 1 138 ILE H 1 138 ILE HB 2.830 . 3.430 2.641 2.486 2.795 . 0 0 "[ . 1 . 2]" 1
881 1 138 ILE H 1 138 ILE MD 5.470 . 6.070 3.862 3.522 4.114 . 0 0 "[ . 1 . 2]" 1
882 1 138 ILE H 1 138 ILE QG 3.280 . 3.880 2.795 2.576 2.959 . 0 0 "[ . 1 . 2]" 1
883 1 138 ILE HA 1 138 ILE MD 4.350 . 4.950 2.629 2.145 3.905 . 0 0 "[ . 1 . 2]" 1
884 1 138 ILE HA 1 138 ILE QG 3.310 . 3.910 2.767 2.394 2.954 . 0 0 "[ . 1 . 2]" 1
885 1 139 PRO HA 1 140 GLU H 2.520 . 3.120 2.280 2.124 2.407 . 0 0 "[ . 1 . 2]" 1
886 1 139 PRO QB 1 140 GLU H 3.540 . 4.140 2.812 2.477 3.110 . 0 0 "[ . 1 . 2]" 1
887 1 140 GLU H 1 140 GLU HB2 2.770 . 3.370 2.777 2.349 3.181 . 0 0 "[ . 1 . 2]" 1
888 1 140 GLU H 1 140 GLU QB 2.380 . 2.980 2.464 2.228 2.754 . 0 0 "[ . 1 . 2]" 1
889 1 140 GLU H 1 140 GLU HB3 2.770 . 3.370 2.778 2.548 3.020 . 0 0 "[ . 1 . 2]" 1
890 1 140 GLU H 1 141 ASP H 3.420 . 4.020 2.928 1.950 4.052 0.032 5 0 "[ . 1 . 2]" 1
891 1 141 ASP H 1 141 ASP HA 2.800 . 3.400 2.820 2.717 2.862 . 0 0 "[ . 1 . 2]" 1
892 1 141 ASP H 1 141 ASP HB2 3.670 . 4.270 3.573 3.498 3.662 . 0 0 "[ . 1 . 2]" 1
893 1 141 ASP H 1 141 ASP HB3 2.710 . 3.310 2.646 2.440 2.837 . 0 0 "[ . 1 . 2]" 1
894 1 141 ASP H 1 142 ARG H 2.740 . 3.340 2.447 2.167 2.821 . 0 0 "[ . 1 . 2]" 1
895 1 141 ASP HA 1 141 ASP HB2 2.680 . 3.280 2.412 2.361 2.504 . 0 0 "[ . 1 . 2]" 1
896 1 141 ASP HA 1 141 ASP HB3 2.550 . 3.150 2.444 2.399 2.484 . 0 0 "[ . 1 . 2]" 1
897 1 141 ASP HB3 1 142 ARG H 4.010 . 4.610 4.104 3.851 4.402 . 0 0 "[ . 1 . 2]" 1
898 1 142 ARG H 1 142 ARG HB2 3.860 . 4.460 3.131 2.703 3.928 . 0 0 "[ . 1 . 2]" 1
899 1 142 ARG H 1 142 ARG HB3 3.860 . 4.460 3.665 3.311 3.852 . 0 0 "[ . 1 . 2]" 1
900 1 142 ARG H 1 143 LEU H 4.540 . 5.140 4.376 4.277 4.453 . 0 0 "[ . 1 . 2]" 1
901 1 142 ARG HA 1 142 ARG HB2 2.900 . 3.500 2.750 2.372 2.912 . 0 0 "[ . 1 . 2]" 1
902 1 142 ARG HA 1 142 ARG QB 2.490 . 3.090 2.273 2.104 2.422 . 0 0 "[ . 1 . 2]" 1
903 1 142 ARG HA 1 142 ARG HB3 2.900 . 3.500 2.441 2.346 2.613 . 0 0 "[ . 1 . 2]" 1
904 1 142 ARG QB 1 143 LEU H 2.570 . 3.170 2.447 2.154 2.875 . 0 0 "[ . 1 . 2]" 1
905 1 142 ARG HB2 1 143 LEU H 3.330 . 3.930 3.262 2.298 3.887 . 0 0 "[ . 1 . 2]" 1
906 1 142 ARG HB3 1 143 LEU H 3.330 . 3.930 2.851 2.192 3.850 . 0 0 "[ . 1 . 2]" 1
907 1 143 LEU H 1 143 LEU QB 2.790 . 3.390 2.554 2.263 2.984 . 0 0 "[ . 1 . 2]" 1
908 1 143 LEU H 1 143 LEU MD1 5.220 . 5.820 3.118 2.214 4.099 . 0 0 "[ . 1 . 2]" 1
909 1 143 LEU H 1 143 LEU MD2 5.220 . 5.820 3.391 1.740 4.555 . 0 0 "[ . 1 . 2]" 1
910 1 143 LEU HA 1 170 VAL HB 3.300 . 3.900 3.954 3.759 4.037 0.137 4 0 "[ . 1 . 2]" 1
911 1 143 LEU HB2 1 144 GLY H 4.420 . 5.020 3.584 2.708 4.375 . 0 0 "[ . 1 . 2]" 1
912 1 143 LEU HB3 1 144 GLY H 4.420 . 5.020 3.440 2.733 4.091 . 0 0 "[ . 1 . 2]" 1
913 1 143 LEU QD 1 144 GLY H 4.490 . 5.090 4.104 3.687 4.432 . 0 0 "[ . 1 . 2]" 1
914 1 143 LEU MD1 1 144 GLY H 5.430 . 6.030 4.698 3.782 5.105 . 0 0 "[ . 1 . 2]" 1
915 1 143 LEU MD1 1 172 LYS H 6.520 . 7.120 6.394 5.688 7.161 0.041 7 0 "[ . 1 . 2]" 1
916 1 143 LEU MD2 1 144 GLY H 5.430 . 6.030 4.643 3.938 5.106 . 0 0 "[ . 1 . 2]" 1
917 1 143 LEU MD2 1 172 LYS H 6.520 . 7.120 6.516 5.661 7.194 0.074 5 0 "[ . 1 . 2]" 1
918 1 143 LEU HG 1 144 GLY H 4.760 . 5.360 4.264 3.799 4.567 . 0 0 "[ . 1 . 2]" 1
919 1 144 GLY H 1 169 LEU H 3.950 . 4.550 3.446 3.139 3.796 . 0 0 "[ . 1 . 2]" 1
920 1 144 GLY H 1 169 LEU QB 5.170 . 5.770 3.944 3.544 4.597 . 0 0 "[ . 1 . 2]" 1
921 1 144 GLY H 1 170 VAL HA 3.480 . 4.080 3.227 2.752 3.678 . 0 0 "[ . 1 . 2]" 1
922 1 144 GLY QA 1 145 TYR H 3.040 . 3.640 2.207 2.105 2.304 . 0 0 "[ . 1 . 2]" 1
923 1 145 TYR H 1 145 TYR HB2 3.450 . 4.050 3.540 3.444 3.636 . 0 0 "[ . 1 . 2]" 1
924 1 145 TYR H 1 145 TYR HB3 3.450 . 4.050 2.793 2.534 2.951 . 0 0 "[ . 1 . 2]" 1
925 1 145 TYR HA 1 146 HIS H 2.590 . 3.190 2.206 2.101 2.279 . 0 0 "[ . 1 . 2]" 1
926 1 145 TYR HA 1 169 LEU H 3.920 . 4.520 2.838 2.425 3.267 . 0 0 "[ . 1 . 2]" 1
927 1 145 TYR QB 1 146 HIS H 3.750 . 4.350 2.765 2.647 2.899 . 0 0 "[ . 1 . 2]" 1
928 1 145 TYR QB 1 168 ASP HA 3.260 . 3.860 2.867 2.299 3.434 . 0 0 "[ . 1 . 2]" 1
929 1 145 TYR HB2 1 146 HIS H 4.290 . 4.890 2.841 2.711 2.995 . 0 0 "[ . 1 . 2]" 1
930 1 145 TYR HB3 1 146 HIS H 4.290 . 4.890 3.801 3.615 3.939 . 0 0 "[ . 1 . 2]" 1
931 1 145 TYR QD 1 168 ASP QB 4.520 . 5.120 4.797 4.295 5.203 0.083 5 0 "[ . 1 . 2]" 1
932 1 145 TYR QE 1 147 VAL QG 6.530 . 7.130 4.647 2.686 5.939 . 0 0 "[ . 1 . 2]" 1
933 1 146 HIS H 1 146 HIS QB 3.610 . 4.210 2.799 2.570 3.135 . 0 0 "[ . 1 . 2]" 1
934 1 146 HIS H 1 167 VAL H 5.040 . 5.640 3.129 2.854 3.340 . 0 0 "[ . 1 . 2]" 1
935 1 146 HIS H 1 167 VAL QG 4.980 . 5.580 3.097 2.707 4.017 . 0 0 "[ . 1 . 2]" 1
936 1 146 HIS H 1 168 ASP HA 3.860 . 4.460 3.392 3.037 3.668 . 0 0 "[ . 1 . 2]" 1
937 1 146 HIS HA 1 147 VAL H 2.930 . 3.530 2.392 2.211 2.522 . 0 0 "[ . 1 . 2]" 1
938 1 146 HIS QB 1 147 VAL H 2.960 . 3.560 2.780 2.462 3.402 . 0 0 "[ . 1 . 2]" 1
939 1 147 VAL H 1 147 VAL HB 3.330 . 3.930 2.758 2.599 3.658 . 0 0 "[ . 1 . 2]" 1
940 1 147 VAL HA 1 148 ILE H 2.520 . 3.120 2.240 2.188 2.293 . 0 0 "[ . 1 . 2]" 1
941 1 147 VAL HA 1 166 ASP HA 3.830 . 4.430 2.372 2.037 2.764 . 0 0 "[ . 1 . 2]" 1
942 1 147 VAL HA 1 167 VAL H 3.730 . 4.330 3.174 2.888 3.535 . 0 0 "[ . 1 . 2]" 1
943 1 147 VAL QG 1 166 ASP HA 3.740 . 4.340 2.747 2.360 3.235 . 0 0 "[ . 1 . 2]" 1
944 1 148 ILE H 1 148 ILE HB 2.740 . 3.340 2.596 2.536 2.749 . 0 0 "[ . 1 . 2]" 1
945 1 148 ILE H 1 148 ILE MG 4.190 . 4.790 3.856 3.823 3.922 . 0 0 "[ . 1 . 2]" 1
946 1 148 ILE H 1 165 ILE H 3.480 . 4.080 3.035 2.714 3.296 . 0 0 "[ . 1 . 2]" 1
947 1 148 ILE HA 1 149 LEU H 2.430 . 3.030 2.242 2.175 2.284 . 0 0 "[ . 1 . 2]" 1
948 1 148 ILE HB 1 148 ILE MD 3.420 . 4.020 2.430 2.398 2.483 . 0 0 "[ . 1 . 2]" 1
949 1 148 ILE HB 1 149 LEU H 4.170 . 4.770 4.145 4.061 4.284 . 0 0 "[ . 1 . 2]" 1
950 1 148 ILE HB 1 165 ILE H 3.890 . 4.490 3.345 2.899 3.699 . 0 0 "[ . 1 . 2]" 1
951 1 148 ILE MG 1 149 LEU H 4.410 . 5.010 2.758 2.617 2.999 . 0 0 "[ . 1 . 2]" 1
952 1 148 ILE MG 1 165 ILE H 4.720 . 5.320 4.211 3.894 4.471 . 0 0 "[ . 1 . 2]" 1
953 1 149 LEU H 1 149 LEU HB2 3.950 . 4.550 2.589 2.353 3.066 . 0 0 "[ . 1 . 2]" 1
954 1 149 LEU H 1 149 LEU QB 3.360 . 3.960 2.470 2.321 2.558 . 0 0 "[ . 1 . 2]" 1
955 1 149 LEU H 1 149 LEU HB3 3.950 . 4.550 3.454 2.506 3.666 . 0 0 "[ . 1 . 2]" 1
956 1 149 LEU HA 1 149 LEU QD 3.830 . 4.430 2.562 2.199 3.131 . 0 0 "[ . 1 . 2]" 1
957 1 149 LEU HA 1 164 VAL HA 4.570 . 5.170 2.717 2.336 3.045 . 0 0 "[ . 1 . 2]" 1
958 1 149 LEU HA 1 164 VAL HB 3.830 . 4.430 3.817 2.861 4.432 0.002 11 0 "[ . 1 . 2]" 1
959 1 149 LEU HA 1 165 ILE H 3.830 . 4.430 3.808 3.417 4.121 . 0 0 "[ . 1 . 2]" 1
960 1 149 LEU QB 1 150 ALA H 3.500 . 4.100 3.185 2.785 3.760 . 0 0 "[ . 1 . 2]" 1
961 1 149 LEU QD 1 150 ALA H 4.350 . 4.950 3.732 2.270 4.363 . 0 0 "[ . 1 . 2]" 1
962 1 150 ALA H 1 150 ALA HA 2.900 . 3.500 2.875 2.847 2.899 . 0 0 "[ . 1 . 2]" 1
963 1 150 ALA H 1 163 GLN H 3.270 . 3.870 3.088 2.868 3.594 . 0 0 "[ . 1 . 2]" 1
964 1 150 ALA H 1 163 GLN QB 5.110 . 5.710 4.212 3.339 5.148 . 0 0 "[ . 1 . 2]" 1
965 1 150 ALA H 1 164 VAL HA 3.140 . 3.740 3.410 2.984 3.799 0.059 9 0 "[ . 1 . 2]" 1
966 1 150 ALA H 1 164 VAL QG 4.170 . 4.770 3.992 2.614 4.657 . 0 0 "[ . 1 . 2]" 1
967 1 150 ALA HA 1 151 VAL H 2.550 . 3.150 2.233 2.167 2.280 . 0 0 "[ . 1 . 2]" 1
968 1 150 ALA MB 1 151 VAL H 4.780 . 5.380 2.853 2.602 3.202 . 0 0 "[ . 1 . 2]" 1
969 1 150 ALA MB 1 163 GLN H 5.090 . 5.690 3.384 2.915 3.778 . 0 0 "[ . 1 . 2]" 1
970 1 151 VAL H 1 151 VAL HB 3.170 . 3.770 2.745 2.521 2.983 . 0 0 "[ . 1 . 2]" 1
971 1 151 VAL H 1 151 VAL QG 3.860 . 4.460 2.687 2.439 2.837 . 0 0 "[ . 1 . 2]" 1
972 1 151 VAL HA 1 152 TRP H 2.770 . 3.370 2.220 2.182 2.258 . 0 0 "[ . 1 . 2]" 1
973 1 151 VAL HA 1 162 TYR HA 2.400 . 3.000 2.596 2.329 2.925 . 0 0 "[ . 1 . 2]" 1
974 1 151 VAL HA 1 163 GLN H 3.730 . 4.330 3.664 3.354 3.903 . 0 0 "[ . 1 . 2]" 1
975 1 151 VAL QG 1 152 TRP H 4.320 . 4.920 2.554 2.419 2.646 . 0 0 "[ . 1 . 2]" 1
976 1 151 VAL QG 1 162 TYR QD 6.350 . 6.950 2.827 1.977 4.288 . 0 0 "[ . 1 . 2]" 1
977 1 151 VAL QG 1 162 TYR QE 5.450 . 6.050 3.374 1.990 5.748 . 0 0 "[ . 1 . 2]" 1
978 1 151 VAL QG 1 163 GLN H 4.170 . 4.770 4.028 3.597 4.448 . 0 0 "[ . 1 . 2]" 1
979 1 151 VAL MG1 1 162 TYR QD 7.310 . 7.910 3.423 2.256 5.076 . 0 0 "[ . 1 . 2]" 1
980 1 151 VAL MG1 1 162 TYR QE 6.270 . 6.870 3.996 2.009 6.749 . 0 0 "[ . 1 . 2]" 1
981 1 151 VAL MG2 1 162 TYR QD 7.310 . 7.910 3.084 2.124 4.633 . 0 0 "[ . 1 . 2]" 1
982 1 151 VAL MG2 1 162 TYR QE 6.270 . 6.870 3.810 2.384 6.227 . 0 0 "[ . 1 . 2]" 1
983 1 152 TRP H 1 152 TRP HB2 3.420 . 4.020 2.974 2.706 3.265 . 0 0 "[ . 1 . 2]" 1
984 1 152 TRP H 1 152 TRP QB 2.770 . 3.370 2.466 2.375 2.578 . 0 0 "[ . 1 . 2]" 1
985 1 152 TRP H 1 152 TRP HB3 3.420 . 4.020 2.654 2.445 2.910 . 0 0 "[ . 1 . 2]" 1
986 1 152 TRP H 1 161 PHE H 3.270 . 3.870 3.301 2.911 3.752 . 0 0 "[ . 1 . 2]" 1
987 1 152 TRP H 1 161 PHE QB 5.340 . 5.940 3.524 2.917 4.530 . 0 0 "[ . 1 . 2]" 1
988 1 152 TRP H 1 162 TYR HA 3.670 . 4.270 3.433 2.986 3.791 . 0 0 "[ . 1 . 2]" 1
989 1 152 TRP HA 1 153 ASP H 2.710 . 3.310 2.175 2.080 2.235 . 0 0 "[ . 1 . 2]" 1
990 1 152 TRP HZ2 1 154 VAL QG 6.150 . 6.750 4.527 3.171 5.367 . 0 0 "[ . 1 . 2]" 1
991 1 153 ASP H 1 153 ASP HB2 3.390 . 3.990 2.444 2.315 2.601 . 0 0 "[ . 1 . 2]" 1
992 1 153 ASP H 1 153 ASP HB3 3.390 . 3.990 3.319 2.538 3.660 . 0 0 "[ . 1 . 2]" 1
993 1 153 ASP HA 1 154 VAL H 2.490 . 3.090 2.197 2.135 2.281 . 0 0 "[ . 1 . 2]" 1
994 1 153 ASP HA 1 160 ALA HA 3.920 . 4.520 3.391 2.858 3.949 . 0 0 "[ . 1 . 2]" 1
995 1 153 ASP HA 1 160 ALA MB 3.420 . 4.020 2.766 2.210 3.850 . 0 0 "[ . 1 . 2]" 1
996 1 153 ASP HA 1 161 PHE H 4.170 . 4.770 3.656 3.347 3.982 . 0 0 "[ . 1 . 2]" 1
997 1 153 ASP QB 1 154 VAL H 4.410 . 5.010 3.414 2.971 3.963 . 0 0 "[ . 1 . 2]" 1
998 1 153 ASP HB2 1 154 VAL H 5.070 . 5.670 4.259 4.032 4.528 . 0 0 "[ . 1 . 2]" 1
999 1 153 ASP HB3 1 154 VAL H 5.070 . 5.670 3.620 3.058 4.378 . 0 0 "[ . 1 . 2]" 1
1000 1 154 VAL H 1 154 VAL HB 2.930 . 3.530 2.663 2.445 3.501 . 0 0 "[ . 1 . 2]" 1
1001 1 154 VAL H 1 160 ALA HA 3.450 . 4.050 3.085 2.398 3.831 . 0 0 "[ . 1 . 2]" 1
1002 1 154 VAL H 1 160 ALA MB 5.500 . 6.100 3.464 2.704 4.704 . 0 0 "[ . 1 . 2]" 1
1003 1 154 VAL HA 1 155 ALA H 2.770 . 3.370 2.253 2.150 2.437 . 0 0 "[ . 1 . 2]" 1
1004 1 154 VAL QG 1 155 ALA H 4.740 . 5.340 2.670 2.115 2.927 . 0 0 "[ . 1 . 2]" 1
1005 1 154 VAL QG 1 156 ASP H 4.410 . 5.010 2.037 1.823 2.325 . 0 0 "[ . 1 . 2]" 1
1006 1 154 VAL QG 1 157 THR H 4.680 . 5.280 2.726 2.204 3.278 . 0 0 "[ . 1 . 2]" 1
1007 1 155 ALA H 1 156 ASP H 3.140 . 3.740 2.407 1.965 2.679 . 0 0 "[ . 1 . 2]" 1
1008 1 155 ALA HA 1 156 ASP H 3.080 . 3.680 3.330 3.034 3.424 . 0 0 "[ . 1 . 2]" 1
1009 1 155 ALA HA 1 157 THR H 3.730 . 4.330 3.744 3.394 4.203 . 0 0 "[ . 1 . 2]" 1
1010 1 155 ALA MB 1 156 ASP H 4.070 . 4.670 2.918 2.568 3.485 . 0 0 "[ . 1 . 2]" 1
1011 1 156 ASP H 1 156 ASP HB2 3.580 . 4.180 2.665 2.023 3.693 . 0 0 "[ . 1 . 2]" 1
1012 1 156 ASP H 1 156 ASP HB3 3.580 . 4.180 3.350 2.732 3.610 . 0 0 "[ . 1 . 2]" 1
1013 1 156 ASP H 1 157 THR H 2.680 . 3.280 2.658 2.307 2.928 . 0 0 "[ . 1 . 2]" 1
1014 1 156 ASP HA 1 157 THR H 3.450 . 4.050 3.216 2.950 3.356 . 0 0 "[ . 1 . 2]" 1
1015 1 156 ASP QB 1 157 THR H 3.880 . 4.480 3.343 2.912 4.008 . 0 0 "[ . 1 . 2]" 1
1016 1 157 THR H 1 157 THR HB 3.700 . 4.300 3.690 3.338 3.871 . 0 0 "[ . 1 . 2]" 1
1017 1 157 THR H 1 157 THR MG 4.100 . 4.700 2.935 2.386 3.261 . 0 0 "[ . 1 . 2]" 1
1018 1 157 THR HA 1 157 THR HB 2.400 . 3.000 2.513 2.391 2.597 . 0 0 "[ . 1 . 2]" 1
1019 1 157 THR HA 1 157 THR MG 3.420 . 4.020 2.552 2.330 3.177 . 0 0 "[ . 1 . 2]" 1
1020 1 157 THR HA 1 158 GLU H 2.960 . 3.560 2.408 2.309 2.499 . 0 0 "[ . 1 . 2]" 1
1021 1 157 THR HA 1 159 ASN H 4.290 . 4.890 3.815 3.588 4.249 . 0 0 "[ . 1 . 2]" 1
1022 1 157 THR MG 1 158 GLU H 5.310 . 5.910 3.616 3.142 3.749 . 0 0 "[ . 1 . 2]" 1
1023 1 158 GLU H 1 158 GLU HB2 3.140 . 3.740 2.339 2.107 2.590 . 0 0 "[ . 1 . 2]" 1
1024 1 158 GLU H 1 158 GLU QB 2.680 . 3.280 2.252 2.082 2.530 . 0 0 "[ . 1 . 2]" 1
1025 1 158 GLU H 1 158 GLU HB3 3.140 . 3.740 3.115 2.332 3.575 . 0 0 "[ . 1 . 2]" 1
1026 1 158 GLU H 1 159 ASN H 3.020 . 3.620 2.544 2.348 2.778 . 0 0 "[ . 1 . 2]" 1
1027 1 158 GLU HA 1 159 ASN H 3.480 . 4.080 3.200 3.019 3.374 . 0 0 "[ . 1 . 2]" 1
1028 1 158 GLU HB2 1 159 ASN H 3.610 . 4.210 3.739 3.172 4.192 . 0 0 "[ . 1 . 2]" 1
1029 1 158 GLU HB3 1 159 ASN H 3.610 . 4.210 3.776 2.992 4.210 . 0 0 "[ . 1 . 2]" 1
1030 1 159 ASN H 1 159 ASN QB 3.430 . 4.030 2.414 2.279 2.509 . 0 0 "[ . 1 . 2]" 1
1031 1 159 ASN HA 1 160 ALA H 2.680 . 3.280 2.371 2.305 2.543 . 0 0 "[ . 1 . 2]" 1
1032 1 159 ASN QB 1 160 ALA H 2.810 . 3.410 2.536 2.250 2.867 . 0 0 "[ . 1 . 2]" 1
1033 1 159 ASN HB2 1 160 ALA H 3.300 . 3.900 3.706 3.479 3.858 . 0 0 "[ . 1 . 2]" 1
1034 1 159 ASN HB3 1 160 ALA H 3.300 . 3.900 2.584 2.278 2.960 . 0 0 "[ . 1 . 2]" 1
1035 1 160 ALA HA 1 161 PHE H 2.620 . 3.220 2.459 2.288 2.606 . 0 0 "[ . 1 . 2]" 1
1036 1 160 ALA MB 1 161 PHE H 4.260 . 4.860 2.563 2.182 2.981 . 0 0 "[ . 1 . 2]" 1
1037 1 160 ALA MB 1 162 TYR QD 8.650 . 9.250 4.225 2.928 5.078 . 0 0 "[ . 1 . 2]" 1
1038 1 160 ALA MB 1 162 TYR QE 6.020 . 6.620 4.262 2.215 6.732 0.112 17 0 "[ . 1 . 2]" 1
1039 1 161 PHE H 1 161 PHE HB2 3.450 . 4.050 2.670 2.339 3.157 . 0 0 "[ . 1 . 2]" 1
1040 1 161 PHE H 1 161 PHE QB 3.020 . 3.620 2.532 2.307 2.761 . 0 0 "[ . 1 . 2]" 1
1041 1 161 PHE H 1 161 PHE HB3 3.450 . 4.050 3.474 2.438 3.769 . 0 0 "[ . 1 . 2]" 1
1042 1 161 PHE HA 1 162 TYR H 2.740 . 3.340 2.233 2.113 2.394 . 0 0 "[ . 1 . 2]" 1
1043 1 162 TYR H 1 162 TYR HB2 4.040 . 4.640 3.029 2.327 3.868 . 0 0 "[ . 1 . 2]" 1
1044 1 162 TYR H 1 162 TYR QB 3.390 . 3.990 2.716 2.288 3.130 . 0 0 "[ . 1 . 2]" 1
1045 1 162 TYR H 1 162 TYR HB3 4.040 . 4.640 3.425 2.633 3.805 . 0 0 "[ . 1 . 2]" 1
1046 1 162 TYR HA 1 162 TYR QB 2.560 . 3.160 2.241 2.071 2.416 . 0 0 "[ . 1 . 2]" 1
1047 1 162 TYR HA 1 163 GLN H 2.710 . 3.310 2.290 2.186 2.413 . 0 0 "[ . 1 . 2]" 1
1048 1 162 TYR QB 1 163 GLN H 3.550 . 4.150 2.959 2.571 3.636 . 0 0 "[ . 1 . 2]" 1
1049 1 162 TYR HB2 1 163 GLN H 4.290 . 4.890 3.627 2.614 4.307 . 0 0 "[ . 1 . 2]" 1
1050 1 162 TYR HB3 1 163 GLN H 4.290 . 4.890 3.415 2.712 4.097 . 0 0 "[ . 1 . 2]" 1
1051 1 162 TYR QD 1 163 GLN H 7.630 . 8.230 3.976 3.396 4.940 . 0 0 "[ . 1 . 2]" 1
1052 1 163 GLN H 1 163 GLN QB 3.370 . 3.970 2.890 2.456 3.250 . 0 0 "[ . 1 . 2]" 1
1053 1 163 GLN HA 1 163 GLN HB2 2.680 . 3.280 2.613 2.346 2.889 . 0 0 "[ . 1 . 2]" 1
1054 1 163 GLN HA 1 163 GLN HB3 2.680 . 3.280 2.438 2.221 2.883 . 0 0 "[ . 1 . 2]" 1
1055 1 163 GLN HA 1 164 VAL H 2.990 . 3.590 2.314 2.185 2.440 . 0 0 "[ . 1 . 2]" 1
1056 1 164 VAL HA 1 165 ILE H 3.020 . 3.620 2.245 2.163 2.375 . 0 0 "[ . 1 . 2]" 1
1057 1 165 ILE H 1 165 ILE HB 3.140 . 3.740 2.832 2.739 2.877 . 0 0 "[ . 1 . 2]" 1
1058 1 165 ILE H 1 165 ILE MG 4.380 . 4.980 3.955 3.916 3.981 . 0 0 "[ . 1 . 2]" 1
1059 1 165 ILE HA 1 165 ILE MD 3.850 . 4.450 3.740 2.241 3.938 . 0 0 "[ . 1 . 2]" 1
1060 1 165 ILE HA 1 166 ASP H 2.860 . 3.460 2.254 2.186 2.389 . 0 0 "[ . 1 . 2]" 1
1061 1 165 ILE MG 1 166 ASP H 6.520 . 7.120 2.869 2.694 3.134 . 0 0 "[ . 1 . 2]" 1
1062 1 166 ASP HA 1 167 VAL H 3.170 . 3.770 2.244 2.147 2.324 . 0 0 "[ . 1 . 2]" 1
1063 1 166 ASP QB 1 167 VAL H 3.790 . 4.390 3.449 2.970 3.717 . 0 0 "[ . 1 . 2]" 1
1064 1 167 VAL HA 1 167 VAL HB 2.800 . 3.400 2.491 2.436 2.612 . 0 0 "[ . 1 . 2]" 1
1065 1 167 VAL HA 1 168 ASP H 2.400 . 3.000 2.275 2.125 2.443 . 0 0 "[ . 1 . 2]" 1
1066 1 167 VAL HB 1 168 ASP H 2.770 . 3.370 2.925 2.432 3.385 0.015 5 0 "[ . 1 . 2]" 1
1067 1 167 VAL QG 1 168 ASP H 5.010 . 5.610 3.368 3.164 3.564 . 0 0 "[ . 1 . 2]" 1
1068 1 168 ASP H 1 168 ASP HB2 3.110 . 3.710 2.692 2.371 3.088 . 0 0 "[ . 1 . 2]" 1
1069 1 168 ASP H 1 168 ASP QB 2.710 . 3.310 2.424 2.258 2.596 . 0 0 "[ . 1 . 2]" 1
1070 1 168 ASP H 1 168 ASP HB3 3.110 . 3.710 2.807 2.503 3.148 . 0 0 "[ . 1 . 2]" 1
1071 1 168 ASP HA 1 169 LEU H 2.400 . 3.000 2.204 2.172 2.248 . 0 0 "[ . 1 . 2]" 1
1072 1 169 LEU H 1 169 LEU HB2 3.790 . 4.390 2.488 2.167 2.618 . 0 0 "[ . 1 . 2]" 1
1073 1 169 LEU H 1 169 LEU HB3 3.790 . 4.390 3.600 3.405 3.693 . 0 0 "[ . 1 . 2]" 1
1074 1 169 LEU H 1 169 LEU MD1 5.340 . 5.940 3.785 2.944 4.160 . 0 0 "[ . 1 . 2]" 1
1075 1 169 LEU H 1 169 LEU QD 4.520 . 5.120 3.268 2.457 3.477 . 0 0 "[ . 1 . 2]" 1
1076 1 169 LEU H 1 169 LEU MD2 5.340 . 5.940 3.698 2.479 4.336 . 0 0 "[ . 1 . 2]" 1
1077 1 169 LEU H 1 169 LEU HG 3.240 . 3.840 2.862 2.431 3.824 . 0 0 "[ . 1 . 2]" 1
1078 1 169 LEU HA 1 170 VAL H 2.400 . 3.000 2.199 2.143 2.267 . 0 0 "[ . 1 . 2]" 1
1079 1 169 LEU QB 1 170 VAL H 4.390 . 4.990 3.311 2.968 3.562 . 0 0 "[ . 1 . 2]" 1
1080 1 169 LEU QD 1 170 VAL H 4.320 . 4.920 3.718 3.376 3.967 . 0 0 "[ . 1 . 2]" 1
1081 1 170 VAL H 1 170 VAL HA 2.860 . 3.460 2.842 2.814 2.868 . 0 0 "[ . 1 . 2]" 1
1082 1 170 VAL HA 1 170 VAL HB 2.400 . 3.000 2.454 2.400 2.523 . 0 0 "[ . 1 . 2]" 1
1083 1 170 VAL HA 1 170 VAL MG1 3.420 . 4.020 2.439 2.393 2.495 . 0 0 "[ . 1 . 2]" 1
1084 1 170 VAL HA 1 170 VAL MG2 3.420 . 4.020 3.187 3.178 3.204 . 0 0 "[ . 1 . 2]" 1
1085 1 170 VAL HB 1 171 ASN H 2.400 . 3.000 2.443 2.210 2.661 . 0 0 "[ . 1 . 2]" 1
1086 1 170 VAL QG 1 171 ASN H 3.830 . 4.430 3.158 2.986 3.298 . 0 0 "[ . 1 . 2]" 1
1087 1 171 ASN H 1 171 ASN HB2 3.610 . 4.210 2.574 2.344 3.564 . 0 0 "[ . 1 . 2]" 1
1088 1 171 ASN H 1 171 ASN QB 3.120 . 3.720 2.330 2.200 2.713 . 0 0 "[ . 1 . 2]" 1
1089 1 171 ASN H 1 171 ASN HB3 3.610 . 4.210 2.997 2.460 3.573 . 0 0 "[ . 1 . 2]" 1
1090 1 171 ASN H 1 172 LYS H 5.500 . 6.100 4.588 4.513 4.649 . 0 0 "[ . 1 . 2]" 1
1091 1 171 ASN HA 1 172 LYS H 2.400 . 3.000 2.382 2.168 2.563 . 0 0 "[ . 1 . 2]" 1
1092 1 171 ASN HB2 1 172 LYS H 3.860 . 4.460 3.723 2.248 4.067 . 0 0 "[ . 1 . 2]" 1
1093 1 171 ASN HB3 1 172 LYS H 3.860 . 4.460 3.230 2.498 4.014 . 0 0 "[ . 1 . 2]" 1
1094 1 172 LYS H 1 172 LYS HA 2.710 . 3.310 2.726 2.163 2.885 . 0 0 "[ . 1 . 2]" 1
1095 1 172 LYS H 1 172 LYS QB 2.760 . 3.360 2.565 2.320 3.050 . 0 0 "[ . 1 . 2]" 1
1096 1 172 LYS H 1 172 LYS QD 3.640 . 4.240 3.831 3.133 4.194 . 0 0 "[ . 1 . 2]" 1
1097 1 172 LYS HA 1 172 LYS HB2 2.770 . 3.370 2.546 2.335 2.905 . 0 0 "[ . 1 . 2]" 1
1098 1 172 LYS HA 1 172 LYS QB 2.410 . 3.010 2.212 2.109 2.357 . 0 0 "[ . 1 . 2]" 1
1099 1 172 LYS HA 1 172 LYS HB3 2.770 . 3.370 2.481 2.292 2.911 . 0 0 "[ . 1 . 2]" 1
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