NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
432490 |
2jsd   |
15361 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jsd
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 2480
_Distance_constraint_stats_list.Viol_count 5095
_Distance_constraint_stats_list.Viol_total 3880.210
_Distance_constraint_stats_list.Viol_max 0.442
_Distance_constraint_stats_list.Viol_rms 0.0156
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0381
_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 3 PRO 1.322 0.110 13 0 "[ . 1 . 2]"
1 4 LYS 3.131 0.110 13 0 "[ . 1 . 2]"
1 5 TRP 2.554 0.112 18 0 "[ . 1 . 2]"
1 6 LYS 0.701 0.111 3 0 "[ . 1 . 2]"
1 7 LYS 4.192 0.112 8 0 "[ . 1 . 2]"
1 8 ASN 1.952 0.112 8 0 "[ . 1 . 2]"
1 9 THR 2.658 0.101 11 0 "[ . 1 . 2]"
1 10 LEU 2.176 0.100 17 0 "[ . 1 . 2]"
1 11 THR 2.115 0.069 10 0 "[ . 1 . 2]"
1 12 TYR 5.272 0.181 18 0 "[ . 1 . 2]"
1 13 ARG 3.127 0.097 1 0 "[ . 1 . 2]"
1 14 ILE 0.788 0.097 15 0 "[ . 1 . 2]"
1 15 SER 0.029 0.024 15 0 "[ . 1 . 2]"
1 16 LYS 2.884 0.123 4 0 "[ . 1 . 2]"
1 17 TYR 1.243 0.105 7 0 "[ . 1 . 2]"
1 18 THR 0.297 0.038 19 0 "[ . 1 . 2]"
1 19 PRO 0.807 0.072 10 0 "[ . 1 . 2]"
1 20 SER 2.919 0.159 3 0 "[ . 1 . 2]"
1 21 MET 4.353 0.159 3 0 "[ . 1 . 2]"
1 22 SER 3.175 0.255 18 0 "[ . 1 . 2]"
1 23 SER 0.384 0.086 17 0 "[ . 1 . 2]"
1 24 VAL 6.295 0.294 2 0 "[ . 1 . 2]"
1 25 GLU 6.114 0.294 2 0 "[ . 1 . 2]"
1 26 VAL 3.504 0.168 10 0 "[ . 1 . 2]"
1 27 ASP 1.338 0.096 4 0 "[ . 1 . 2]"
1 28 LYS 5.292 0.168 10 0 "[ . 1 . 2]"
1 29 ALA 1.129 0.078 2 0 "[ . 1 . 2]"
1 30 VAL 1.443 0.126 15 0 "[ . 1 . 2]"
1 31 GLU 5.019 0.141 1 0 "[ . 1 . 2]"
1 32 MET 2.943 0.127 17 0 "[ . 1 . 2]"
1 33 ALA 4.401 0.114 8 0 "[ . 1 . 2]"
1 34 LEU 3.174 0.204 9 0 "[ . 1 . 2]"
1 35 GLN 2.994 0.125 16 0 "[ . 1 . 2]"
1 36 ALA 1.857 0.125 16 0 "[ . 1 . 2]"
1 37 TRP 3.888 0.098 7 0 "[ . 1 . 2]"
1 38 SER 2.601 0.109 6 0 "[ . 1 . 2]"
1 39 SER 3.744 0.123 16 0 "[ . 1 . 2]"
1 40 ALA 4.092 0.095 5 0 "[ . 1 . 2]"
1 41 VAL 3.156 0.140 19 0 "[ . 1 . 2]"
1 42 PRO 1.552 0.081 4 0 "[ . 1 . 2]"
1 43 LEU 4.981 0.098 7 0 "[ . 1 . 2]"
1 44 SER 3.463 0.135 19 0 "[ . 1 . 2]"
1 45 PHE 1.215 0.068 19 0 "[ . 1 . 2]"
1 46 VAL 2.378 0.098 2 0 "[ . 1 . 2]"
1 47 ARG 2.934 0.181 18 0 "[ . 1 . 2]"
1 48 ILE 4.273 0.120 1 0 "[ . 1 . 2]"
1 49 ASN 0.444 0.062 20 0 "[ . 1 . 2]"
1 50 SER 1.253 0.120 1 0 "[ . 1 . 2]"
1 51 GLY 4.992 0.442 8 0 "[ . 1 . 2]"
1 52 GLU 3.013 0.442 8 0 "[ . 1 . 2]"
1 53 ALA 2.300 0.120 12 0 "[ . 1 . 2]"
1 54 ASP 3.645 0.100 18 0 "[ . 1 . 2]"
1 55 ILE 3.727 0.137 2 0 "[ . 1 . 2]"
1 56 MET 2.958 0.169 12 0 "[ . 1 . 2]"
1 57 ILE 0.931 0.047 19 0 "[ . 1 . 2]"
1 58 SER 0.669 0.066 11 0 "[ . 1 . 2]"
1 59 PHE 0.947 0.123 4 0 "[ . 1 . 2]"
1 60 GLU 1.648 0.108 19 0 "[ . 1 . 2]"
1 61 ASN 0.050 0.021 18 0 "[ . 1 . 2]"
1 62 GLY 0.208 0.075 19 0 "[ . 1 . 2]"
1 63 ASP 0.181 0.037 10 0 "[ . 1 . 2]"
1 64 HIS 2.013 0.108 19 0 "[ . 1 . 2]"
1 65 GLY 0.035 0.029 18 0 "[ . 1 . 2]"
1 66 ASP 1.004 0.082 2 0 "[ . 1 . 2]"
1 67 SER 1.173 0.229 8 0 "[ . 1 . 2]"
1 68 TYR 1.825 0.099 2 0 "[ . 1 . 2]"
1 69 PRO 1.785 0.229 8 0 "[ . 1 . 2]"
1 70 PHE 1.724 0.113 10 0 "[ . 1 . 2]"
1 71 ASP 1.454 0.132 3 0 "[ . 1 . 2]"
1 72 GLY 0.621 0.120 3 0 "[ . 1 . 2]"
1 73 PRO 0.895 0.119 12 0 "[ . 1 . 2]"
1 74 ARG 3.083 0.248 18 0 "[ . 1 . 2]"
1 75 GLY 3.792 0.248 18 0 "[ . 1 . 2]"
1 76 THR 2.558 0.164 5 0 "[ . 1 . 2]"
1 77 LEU 2.459 0.126 18 0 "[ . 1 . 2]"
1 78 ALA 2.964 0.114 6 0 "[ . 1 . 2]"
1 79 HIS 1.779 0.103 11 0 "[ . 1 . 2]"
1 80 ALA 1.788 0.103 11 0 "[ . 1 . 2]"
1 81 PHE 4.001 0.101 7 0 "[ . 1 . 2]"
1 82 ALA 0.544 0.048 14 0 "[ . 1 . 2]"
1 83 PRO 1.505 0.085 12 0 "[ . 1 . 2]"
1 84 GLY 0.160 0.062 12 0 "[ . 1 . 2]"
1 85 GLU 0.921 0.128 7 0 "[ . 1 . 2]"
1 86 GLY 0.449 0.128 7 0 "[ . 1 . 2]"
1 87 LEU 1.933 0.187 10 0 "[ . 1 . 2]"
1 88 GLY 1.883 0.187 10 0 "[ . 1 . 2]"
1 89 GLY 1.361 0.070 8 0 "[ . 1 . 2]"
1 90 ASP 2.128 0.138 6 0 "[ . 1 . 2]"
1 91 THR 0.984 0.083 10 0 "[ . 1 . 2]"
1 92 HIS 1.837 0.089 16 0 "[ . 1 . 2]"
1 93 PHE 1.822 0.089 16 0 "[ . 1 . 2]"
1 94 ASP 1.750 0.085 3 0 "[ . 1 . 2]"
1 95 ASN 1.678 0.371 11 0 "[ . 1 . 2]"
1 96 ALA 0.656 0.092 5 0 "[ . 1 . 2]"
1 97 GLU 2.985 0.126 18 0 "[ . 1 . 2]"
1 98 LYS 3.441 0.170 6 0 "[ . 1 . 2]"
1 99 TRP 3.037 0.163 14 0 "[ . 1 . 2]"
1 100 THR 2.508 0.170 6 0 "[ . 1 . 2]"
1 101 MET 0.678 0.085 12 0 "[ . 1 . 2]"
1 102 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 THR 0.512 0.067 7 0 "[ . 1 . 2]"
1 104 ASN 1.011 0.111 7 0 "[ . 1 . 2]"
1 105 GLY 0.990 0.111 7 0 "[ . 1 . 2]"
1 106 PHE 0.775 0.072 15 0 "[ . 1 . 2]"
1 107 ASN 0.277 0.064 16 0 "[ . 1 . 2]"
1 108 LEU 0.999 0.137 16 0 "[ . 1 . 2]"
1 109 PHE 0.573 0.095 10 0 "[ . 1 . 2]"
1 110 THR 1.273 0.099 18 0 "[ . 1 . 2]"
1 111 VAL 0.573 0.059 7 0 "[ . 1 . 2]"
1 112 ALA 0.545 0.049 13 0 "[ . 1 . 2]"
1 113 ALA 0.977 0.067 6 0 "[ . 1 . 2]"
1 114 HIS 1.540 0.116 9 0 "[ . 1 . 2]"
1 115 GLU 2.326 0.114 6 0 "[ . 1 . 2]"
1 116 PHE 1.832 0.101 4 0 "[ . 1 . 2]"
1 117 GLY 2.357 0.085 20 0 "[ . 1 . 2]"
1 118 HIS 2.872 0.092 18 0 "[ . 1 . 2]"
1 119 ALA 1.827 0.091 4 0 "[ . 1 . 2]"
1 120 LEU 8.829 0.158 17 0 "[ . 1 . 2]"
1 121 GLY 2.261 0.095 1 0 "[ . 1 . 2]"
1 122 LEU 4.474 0.158 17 0 "[ . 1 . 2]"
1 123 ALA 0.770 0.066 3 0 "[ . 1 . 2]"
1 124 HIS 3.783 0.224 1 0 "[ . 1 . 2]"
1 125 SER 3.909 0.168 1 0 "[ . 1 . 2]"
1 126 THR 0.317 0.135 5 0 "[ . 1 . 2]"
1 127 ASP 4.878 0.298 13 0 "[ . 1 . 2]"
1 128 PRO 0.135 0.044 2 0 "[ . 1 . 2]"
1 129 SER 1.282 0.137 16 0 "[ . 1 . 2]"
1 130 ALA 1.376 0.125 13 0 "[ . 1 . 2]"
1 131 LEU 1.944 0.115 9 0 "[ . 1 . 2]"
1 132 MET 4.508 0.136 18 0 "[ . 1 . 2]"
1 133 TYR 4.726 0.298 13 0 "[ . 1 . 2]"
1 134 PRO 0.915 0.129 14 0 "[ . 1 . 2]"
1 135 THR 1.184 0.076 16 0 "[ . 1 . 2]"
1 136 TYR 0.095 0.056 14 0 "[ . 1 . 2]"
1 137 LYS 3.048 0.221 11 0 "[ . 1 . 2]"
1 138 TYR 3.776 0.221 11 0 "[ . 1 . 2]"
1 139 LYS 2.507 0.123 5 0 "[ . 1 . 2]"
1 140 ASN 3.413 0.123 5 0 "[ . 1 . 2]"
1 141 PRO 0.784 0.047 5 0 "[ . 1 . 2]"
1 142 TYR 0.806 0.078 17 0 "[ . 1 . 2]"
1 143 GLY 0.133 0.073 20 0 "[ . 1 . 2]"
1 144 PHE 0.957 0.065 2 0 "[ . 1 . 2]"
1 145 HIS 2.458 0.143 14 0 "[ . 1 . 2]"
1 146 LEU 6.443 0.162 11 0 "[ . 1 . 2]"
1 147 PRO 1.173 0.096 1 0 "[ . 1 . 2]"
1 148 LYS 7.340 0.162 11 0 "[ . 1 . 2]"
1 149 ASP 1.246 0.117 2 0 "[ . 1 . 2]"
1 150 ASP 1.515 0.112 9 0 "[ . 1 . 2]"
1 151 VAL 5.687 0.139 8 0 "[ . 1 . 2]"
1 152 LYS 0.701 0.088 16 0 "[ . 1 . 2]"
1 153 GLY 0.806 0.088 16 0 "[ . 1 . 2]"
1 154 ILE 2.888 0.104 13 0 "[ . 1 . 2]"
1 155 GLN 0.829 0.083 8 0 "[ . 1 . 2]"
1 156 ALA 2.118 0.079 6 0 "[ . 1 . 2]"
1 157 LEU 2.118 0.091 20 0 "[ . 1 . 2]"
1 158 TYR 2.899 0.140 19 0 "[ . 1 . 2]"
1 159 GLY 1.360 0.091 20 0 "[ . 1 . 2]"
1 160 PRO 0.201 0.036 3 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 3 PRO HA 1 4 LYS H . . 3.370 3.266 2.342 3.480 0.110 13 0 "[ . 1 . 2]" 1
2 1 3 PRO HB2 1 4 LYS H . . 3.970 3.681 2.230 4.044 0.074 16 0 "[ . 1 . 2]" 1
3 1 3 PRO HB2 1 83 PRO HG3 . . 6.150 4.397 3.721 4.881 . 0 0 "[ . 1 . 2]" 1
4 1 3 PRO HB3 1 83 PRO HG3 . . 6.150 6.032 5.486 6.176 0.026 18 0 "[ . 1 . 2]" 1
5 1 3 PRO HG2 1 4 LYS H . . 4.350 3.113 2.445 4.185 . 0 0 "[ . 1 . 2]" 1
6 1 3 PRO HG2 1 4 LYS HG3 . . 6.150 4.591 3.782 6.196 0.046 8 0 "[ . 1 . 2]" 1
7 1 3 PRO HG2 1 83 PRO HB3 . . 6.150 5.846 4.987 6.177 0.027 15 0 "[ . 1 . 2]" 1
8 1 3 PRO HG2 1 83 PRO HG3 . . 6.150 4.055 3.640 4.520 . 0 0 "[ . 1 . 2]" 1
9 1 3 PRO HG3 1 83 PRO HG3 . . 6.150 5.608 5.266 6.020 . 0 0 "[ . 1 . 2]" 1
10 1 3 PRO QD 1 4 LYS H . . 4.850 3.104 2.337 4.869 0.019 8 0 "[ . 1 . 2]" 1
11 1 3 PRO QD 1 4 LYS HA . . 6.100 5.128 4.569 5.465 . 0 0 "[ . 1 . 2]" 1
12 1 3 PRO QD 1 4 LYS HB3 . . 6.150 4.719 3.619 6.146 . 0 0 "[ . 1 . 2]" 1
13 1 3 PRO QD 1 83 PRO HG3 . . 6.150 5.515 4.264 6.081 . 0 0 "[ . 1 . 2]" 1
14 1 4 LYS H 1 4 LYS HB2 . . 4.030 3.664 3.540 3.879 . 0 0 "[ . 1 . 2]" 1
15 1 4 LYS H 1 4 LYS HB3 . . 4.100 2.871 2.611 3.482 . 0 0 "[ . 1 . 2]" 1
16 1 4 LYS H 1 4 LYS HD2 . . 4.520 3.372 2.828 4.519 . 0 0 "[ . 1 . 2]" 1
17 1 4 LYS H 1 4 LYS HD3 . . 4.280 4.277 4.028 4.343 0.063 15 0 "[ . 1 . 2]" 1
18 1 4 LYS H 1 4 LYS HG2 . . 3.820 3.456 1.865 3.913 0.093 10 0 "[ . 1 . 2]" 1
19 1 4 LYS H 1 4 LYS HG3 . . 4.050 2.040 1.800 2.629 . 0 0 "[ . 1 . 2]" 1
20 1 4 LYS H 1 4 LYS QE . . 6.150 4.189 3.119 5.053 . 0 0 "[ . 1 . 2]" 1
21 1 4 LYS H 1 5 TRP H . . 4.860 4.559 4.424 4.657 . 0 0 "[ . 1 . 2]" 1
22 1 4 LYS HA 1 4 LYS QE . . 6.150 5.355 4.090 5.571 . 0 0 "[ . 1 . 2]" 1
23 1 4 LYS HA 1 5 TRP H . . 3.070 2.379 2.239 2.717 . 0 0 "[ . 1 . 2]" 1
24 1 4 LYS HB2 1 5 TRP H . . 3.540 2.245 1.993 2.379 . 0 0 "[ . 1 . 2]" 1
25 1 4 LYS HB2 1 157 LEU MD2 . . 5.240 3.388 2.788 4.100 . 0 0 "[ . 1 . 2]" 1
26 1 4 LYS HB3 1 5 TRP H . . 3.470 3.507 3.463 3.575 0.105 8 0 "[ . 1 . 2]" 1
27 1 4 LYS HB3 1 157 LEU MD2 . . 5.460 2.763 2.154 3.440 . 0 0 "[ . 1 . 2]" 1
28 1 4 LYS HD2 1 5 TRP H . . 4.590 3.984 2.628 4.568 . 0 0 "[ . 1 . 2]" 1
29 1 4 LYS HD2 1 157 LEU MD2 . . 6.150 4.993 4.000 5.749 . 0 0 "[ . 1 . 2]" 1
30 1 4 LYS HD3 1 5 TRP H . . 4.280 3.655 3.106 4.346 0.066 18 0 "[ . 1 . 2]" 1
31 1 4 LYS HD3 1 157 LEU MD2 . . 6.150 4.209 3.179 4.956 . 0 0 "[ . 1 . 2]" 1
32 1 4 LYS HG2 1 5 TRP H . . 4.950 4.637 4.270 4.862 . 0 0 "[ . 1 . 2]" 1
33 1 4 LYS HG3 1 5 TRP H . . 4.700 4.637 3.561 4.803 0.103 3 0 "[ . 1 . 2]" 1
34 1 4 LYS QE 1 6 LYS HA . . 6.150 5.276 3.424 6.176 0.026 12 0 "[ . 1 . 2]" 1
35 1 5 TRP H 1 5 TRP HB2 . . 3.660 2.563 2.370 2.821 . 0 0 "[ . 1 . 2]" 1
36 1 5 TRP H 1 5 TRP HB3 . . 3.670 3.615 3.539 3.683 0.013 8 0 "[ . 1 . 2]" 1
37 1 5 TRP H 1 5 TRP HD1 . . 4.110 2.504 2.131 3.284 . 0 0 "[ . 1 . 2]" 1
38 1 5 TRP H 1 6 LYS H . . 6.150 4.636 4.526 4.747 . 0 0 "[ . 1 . 2]" 1
39 1 5 TRP H 1 83 PRO HB2 . . 5.090 3.970 3.463 4.484 . 0 0 "[ . 1 . 2]" 1
40 1 5 TRP H 1 83 PRO HB3 . . 4.870 3.898 3.355 4.367 . 0 0 "[ . 1 . 2]" 1
41 1 5 TRP H 1 120 LEU HA . . 4.720 4.650 4.123 4.832 0.112 18 0 "[ . 1 . 2]" 1
42 1 5 TRP H 1 157 LEU MD2 . . 5.810 5.205 4.595 5.788 . 0 0 "[ . 1 . 2]" 1
43 1 5 TRP H 1 158 TYR HH . . 4.980 4.653 4.046 5.020 0.040 13 0 "[ . 1 . 2]" 1
44 1 5 TRP HA 1 6 LYS HA . . 6.150 4.417 4.289 4.517 . 0 0 "[ . 1 . 2]" 1
45 1 5 TRP HB2 1 7 LYS H . . 3.700 3.605 3.062 3.744 0.044 3 0 "[ . 1 . 2]" 1
46 1 5 TRP HB2 1 10 LEU MD1 . . 6.150 3.914 2.978 4.481 . 0 0 "[ . 1 . 2]" 1
47 1 5 TRP HB2 1 10 LEU MD2 . . 6.150 3.434 2.817 3.959 . 0 0 "[ . 1 . 2]" 1
48 1 5 TRP HB3 1 7 LYS H . . 3.820 2.575 2.141 2.991 . 0 0 "[ . 1 . 2]" 1
49 1 5 TRP HB3 1 10 LEU MD1 . . 6.150 4.266 2.965 4.923 . 0 0 "[ . 1 . 2]" 1
50 1 5 TRP HB3 1 10 LEU MD2 . . 6.150 2.906 2.458 3.314 . 0 0 "[ . 1 . 2]" 1
51 1 5 TRP HD1 1 10 LEU MD1 . . 6.150 3.501 2.774 4.219 . 0 0 "[ . 1 . 2]" 1
52 1 5 TRP HD1 1 55 ILE MD . . 6.150 5.498 4.222 6.156 0.006 3 0 "[ . 1 . 2]" 1
53 1 5 TRP HD1 1 83 PRO HG3 . . 6.150 4.595 4.274 5.058 . 0 0 "[ . 1 . 2]" 1
54 1 5 TRP HD1 1 119 ALA MB . . 6.150 5.609 5.002 6.010 . 0 0 "[ . 1 . 2]" 1
55 1 5 TRP HD1 1 120 LEU HB3 . . 6.150 4.592 3.900 5.222 . 0 0 "[ . 1 . 2]" 1
56 1 5 TRP HD1 1 120 LEU MD1 . . 6.150 5.070 3.726 6.156 0.006 18 0 "[ . 1 . 2]" 1
57 1 5 TRP HD1 1 120 LEU MD2 . . 6.150 4.666 3.644 6.029 . 0 0 "[ . 1 . 2]" 1
58 1 5 TRP HD1 1 158 TYR HH . . 6.150 2.718 2.263 3.071 . 0 0 "[ . 1 . 2]" 1
59 1 5 TRP HE1 1 10 LEU MD1 . . 6.150 3.823 3.035 4.803 . 0 0 "[ . 1 . 2]" 1
60 1 5 TRP HE1 1 83 PRO HA . . 6.150 3.515 2.808 4.269 . 0 0 "[ . 1 . 2]" 1
61 1 5 TRP HE1 1 120 LEU MD2 . . 6.150 4.700 3.542 6.199 0.049 8 0 "[ . 1 . 2]" 1
62 1 5 TRP HE3 1 10 LEU MD2 . . 6.150 3.372 2.677 4.284 . 0 0 "[ . 1 . 2]" 1
63 1 5 TRP HH2 1 84 GLY H . . 4.320 3.270 2.683 4.300 . 0 0 "[ . 1 . 2]" 1
64 1 5 TRP HZ2 1 10 LEU MD1 . . 6.150 4.923 3.417 5.870 . 0 0 "[ . 1 . 2]" 1
65 1 5 TRP HZ2 1 55 ILE HA . . 6.150 5.588 4.727 6.148 . 0 0 "[ . 1 . 2]" 1
66 1 5 TRP HZ2 1 55 ILE MD . . 6.150 4.064 3.001 4.824 . 0 0 "[ . 1 . 2]" 1
67 1 5 TRP HZ2 1 83 PRO HA . . 6.150 2.809 2.413 3.255 . 0 0 "[ . 1 . 2]" 1
68 1 5 TRP HZ2 1 83 PRO HB2 . . 6.150 4.480 4.100 4.789 . 0 0 "[ . 1 . 2]" 1
69 1 5 TRP HZ2 1 83 PRO HB3 . . 6.150 3.679 3.024 3.998 . 0 0 "[ . 1 . 2]" 1
70 1 5 TRP HZ2 1 83 PRO HG3 . . 6.150 5.981 5.332 6.207 0.057 7 0 "[ . 1 . 2]" 1
71 1 5 TRP HZ2 1 84 GLY H . . 4.030 3.256 2.625 4.044 0.014 12 0 "[ . 1 . 2]" 1
72 1 5 TRP HZ2 1 89 GLY HA3 . . 6.150 2.480 2.032 3.116 . 0 0 "[ . 1 . 2]" 1
73 1 5 TRP HZ2 1 119 ALA MB . . 6.150 3.618 2.941 4.291 . 0 0 "[ . 1 . 2]" 1
74 1 6 LYS H 1 6 LYS HD2 . . 4.970 4.257 2.008 4.960 . 0 0 "[ . 1 . 2]" 1
75 1 6 LYS H 1 6 LYS HD3 . . 5.040 3.958 2.041 5.058 0.018 13 0 "[ . 1 . 2]" 1
76 1 6 LYS H 1 7 LYS H . . 4.040 2.656 2.374 2.881 . 0 0 "[ . 1 . 2]" 1
77 1 6 LYS HA 1 6 LYS HD2 . . 5.480 4.200 2.274 4.991 . 0 0 "[ . 1 . 2]" 1
78 1 6 LYS HA 1 6 LYS HD3 . . 5.110 4.249 2.627 4.984 . 0 0 "[ . 1 . 2]" 1
79 1 6 LYS HA 1 6 LYS QE . . 6.150 4.702 3.460 5.635 . 0 0 "[ . 1 . 2]" 1
80 1 6 LYS HA 1 7 LYS H . . 3.490 3.406 3.078 3.534 0.044 10 0 "[ . 1 . 2]" 1
81 1 6 LYS HB2 1 7 LYS H . . 4.430 3.839 2.957 4.445 0.015 1 0 "[ . 1 . 2]" 1
82 1 6 LYS HB2 1 7 LYS QB . . 4.880 4.377 3.580 4.929 0.049 9 0 "[ . 1 . 2]" 1
83 1 6 LYS HB3 1 7 LYS H . . 4.320 4.031 2.921 4.431 0.111 3 0 "[ . 1 . 2]" 1
84 1 7 LYS H 1 7 LYS HD2 . . 4.590 2.610 1.969 4.689 0.099 3 0 "[ . 1 . 2]" 1
85 1 7 LYS H 1 7 LYS HD3 . . 4.010 3.791 2.063 4.059 0.049 17 0 "[ . 1 . 2]" 1
86 1 7 LYS H 1 7 LYS HE2 . . 4.230 3.704 2.434 4.256 0.026 3 0 "[ . 1 . 2]" 1
87 1 7 LYS H 1 7 LYS HE3 . . 4.250 3.867 2.308 4.359 0.109 8 0 "[ . 1 . 2]" 1
88 1 7 LYS H 1 7 LYS HG2 . . 4.150 3.733 1.968 4.169 0.019 5 0 "[ . 1 . 2]" 1
89 1 7 LYS H 1 7 LYS HG3 . . 4.410 4.208 3.222 4.455 0.045 11 0 "[ . 1 . 2]" 1
90 1 7 LYS H 1 7 LYS QB . . 3.400 2.845 2.560 3.071 . 0 0 "[ . 1 . 2]" 1
91 1 7 LYS H 1 8 ASN H . . 4.830 4.333 2.176 4.602 . 0 0 "[ . 1 . 2]" 1
92 1 7 LYS H 1 10 LEU MD1 . . 6.150 5.824 4.702 6.178 0.028 15 0 "[ . 1 . 2]" 1
93 1 7 LYS H 1 10 LEU MD2 . . 4.950 4.400 3.949 4.715 . 0 0 "[ . 1 . 2]" 1
94 1 7 LYS HA 1 7 LYS HE2 . . 6.150 5.264 4.264 6.161 0.011 4 0 "[ . 1 . 2]" 1
95 1 7 LYS HA 1 7 LYS HE3 . . 6.150 5.790 4.616 6.159 0.009 5 0 "[ . 1 . 2]" 1
96 1 7 LYS HA 1 8 ASN H . . 3.300 2.433 2.265 3.333 0.033 13 0 "[ . 1 . 2]" 1
97 1 7 LYS HA 1 9 THR MG . . 6.150 5.725 5.287 6.170 0.020 10 0 "[ . 1 . 2]" 1
98 1 7 LYS HD2 1 8 ASN H . . 4.640 4.353 3.058 4.752 0.112 8 0 "[ . 1 . 2]" 1
99 1 7 LYS HD2 1 9 THR H . . 4.490 4.174 3.026 4.579 0.089 8 0 "[ . 1 . 2]" 1
100 1 7 LYS HD2 1 9 THR MG . . 6.150 5.990 4.581 6.237 0.087 8 0 "[ . 1 . 2]" 1
101 1 7 LYS HD3 1 8 ASN H . . 4.810 4.649 3.879 4.893 0.083 3 0 "[ . 1 . 2]" 1
102 1 7 LYS HD3 1 9 THR H . . 4.320 3.850 3.258 4.380 0.060 10 0 "[ . 1 . 2]" 1
103 1 7 LYS HD3 1 10 LEU MD2 . . 6.150 2.733 2.101 5.231 . 0 0 "[ . 1 . 2]" 1
104 1 7 LYS HE2 1 10 LEU HA . . 6.150 5.335 3.844 6.105 . 0 0 "[ . 1 . 2]" 1
105 1 7 LYS HE2 1 10 LEU HG . . 6.150 5.895 4.370 6.184 0.034 12 0 "[ . 1 . 2]" 1
106 1 7 LYS HE2 1 10 LEU MD2 . . 6.150 3.916 2.316 4.420 . 0 0 "[ . 1 . 2]" 1
107 1 7 LYS HE3 1 10 LEU HA . . 5.920 4.529 2.602 5.738 . 0 0 "[ . 1 . 2]" 1
108 1 7 LYS HE3 1 10 LEU MD2 . . 6.150 2.970 1.972 4.007 . 0 0 "[ . 1 . 2]" 1
109 1 7 LYS HG2 1 9 THR H . . 3.810 2.270 1.775 3.862 0.052 3 0 "[ . 1 . 2]" 1
110 1 7 LYS HG2 1 9 THR MG . . 6.150 4.362 3.794 6.191 0.041 10 0 "[ . 1 . 2]" 1
111 1 7 LYS HG2 1 10 LEU MD2 . . 6.150 3.972 3.388 4.257 . 0 0 "[ . 1 . 2]" 1
112 1 7 LYS HG3 1 9 THR H . . 3.670 3.343 2.085 3.672 0.002 2 0 "[ . 1 . 2]" 1
113 1 7 LYS HG3 1 9 THR MG . . 6.150 4.880 4.598 5.193 . 0 0 "[ . 1 . 2]" 1
114 1 7 LYS HG3 1 10 LEU MD2 . . 6.150 4.354 3.211 4.818 . 0 0 "[ . 1 . 2]" 1
115 1 7 LYS QB 1 8 ASN H . . 3.670 2.614 2.135 3.713 0.043 13 0 "[ . 1 . 2]" 1
116 1 7 LYS QB 1 8 ASN HA . . 6.150 4.895 4.572 5.360 . 0 0 "[ . 1 . 2]" 1
117 1 7 LYS QB 1 9 THR H . . 3.340 3.202 2.582 3.395 0.055 13 0 "[ . 1 . 2]" 1
118 1 8 ASN H 1 8 ASN HB2 . . 3.710 2.463 2.251 3.698 . 0 0 "[ . 1 . 2]" 1
119 1 8 ASN H 1 8 ASN HB3 . . 3.940 3.594 3.464 3.977 0.037 13 0 "[ . 1 . 2]" 1
120 1 8 ASN H 1 8 ASN HD21 . . 5.740 4.884 4.259 5.402 . 0 0 "[ . 1 . 2]" 1
121 1 8 ASN H 1 9 THR H . . 3.360 2.341 1.957 3.359 . 0 0 "[ . 1 . 2]" 1
122 1 8 ASN HA 1 9 THR H . . 3.530 3.436 3.268 3.542 0.012 13 0 "[ . 1 . 2]" 1
123 1 8 ASN HA 1 43 LEU MD2 . . 5.390 4.102 3.713 4.594 . 0 0 "[ . 1 . 2]" 1
124 1 8 ASN HB2 1 9 THR H . . 4.150 3.196 2.772 3.749 . 0 0 "[ . 1 . 2]" 1
125 1 8 ASN HB2 1 43 LEU MD2 . . 6.150 6.139 5.860 6.196 0.046 12 0 "[ . 1 . 2]" 1
126 1 8 ASN HB2 1 44 SER H . . 5.800 4.837 4.219 5.272 . 0 0 "[ . 1 . 2]" 1
127 1 8 ASN HB3 1 9 THR H . . 3.940 3.972 3.816 4.041 0.101 11 0 "[ . 1 . 2]" 1
128 1 8 ASN HB3 1 42 PRO QB . . 6.150 4.786 3.944 5.505 . 0 0 "[ . 1 . 2]" 1
129 1 8 ASN HB3 1 43 LEU MD2 . . 6.150 4.906 4.615 5.287 . 0 0 "[ . 1 . 2]" 1
130 1 8 ASN HB3 1 44 SER H . . 6.070 3.693 3.414 3.961 . 0 0 "[ . 1 . 2]" 1
131 1 8 ASN HD21 1 41 VAL MG1 . . 6.150 5.072 3.346 6.069 . 0 0 "[ . 1 . 2]" 1
132 1 8 ASN HD22 1 41 VAL MG1 . . 6.150 5.095 3.658 5.962 . 0 0 "[ . 1 . 2]" 1
133 1 9 THR H 1 9 THR HB . . 3.660 3.589 3.414 3.692 0.032 9 0 "[ . 1 . 2]" 1
134 1 9 THR H 1 9 THR MG . . 3.300 2.646 2.392 3.241 . 0 0 "[ . 1 . 2]" 1
135 1 9 THR H 1 10 LEU H . . 4.310 4.228 4.094 4.373 0.063 13 0 "[ . 1 . 2]" 1
136 1 9 THR H 1 10 LEU HG . . 4.810 4.392 3.898 4.620 . 0 0 "[ . 1 . 2]" 1
137 1 9 THR H 1 10 LEU MD1 . . 5.770 5.570 4.962 5.789 0.019 5 0 "[ . 1 . 2]" 1
138 1 9 THR H 1 10 LEU MD2 . . 5.130 4.835 4.347 5.128 . 0 0 "[ . 1 . 2]" 1
139 1 9 THR H 1 44 SER H . . 5.190 4.822 4.547 5.033 . 0 0 "[ . 1 . 2]" 1
140 1 9 THR HA 1 10 LEU H . . 3.480 2.158 2.087 2.264 . 0 0 "[ . 1 . 2]" 1
141 1 9 THR HA 1 44 SER H . . 3.260 3.164 2.871 3.299 0.039 8 0 "[ . 1 . 2]" 1
142 1 9 THR HA 1 44 SER HB2 . . 5.260 3.318 2.048 5.284 0.024 5 0 "[ . 1 . 2]" 1
143 1 9 THR HA 1 44 SER HB3 . . 5.200 4.098 3.443 4.946 . 0 0 "[ . 1 . 2]" 1
144 1 9 THR HB 1 10 LEU H . . 6.150 3.865 3.614 4.066 . 0 0 "[ . 1 . 2]" 1
145 1 9 THR MG 1 44 SER HA . . 6.150 5.355 4.886 6.157 0.007 5 0 "[ . 1 . 2]" 1
146 1 9 THR MG 1 44 SER HB2 . . 6.150 3.171 2.184 5.151 . 0 0 "[ . 1 . 2]" 1
147 1 9 THR MG 1 44 SER HB3 . . 6.150 3.884 3.210 4.537 . 0 0 "[ . 1 . 2]" 1
148 1 10 LEU H 1 10 LEU HB2 . . 4.070 2.462 2.333 2.681 . 0 0 "[ . 1 . 2]" 1
149 1 10 LEU H 1 10 LEU HB3 . . 3.890 3.679 3.623 3.828 . 0 0 "[ . 1 . 2]" 1
150 1 10 LEU H 1 10 LEU HG . . 3.770 2.874 2.603 3.130 . 0 0 "[ . 1 . 2]" 1
151 1 10 LEU H 1 10 LEU MD1 . . 4.650 3.730 3.411 4.031 . 0 0 "[ . 1 . 2]" 1
152 1 10 LEU H 1 10 LEU MD2 . . 5.480 3.970 3.819 4.097 . 0 0 "[ . 1 . 2]" 1
153 1 10 LEU H 1 11 THR H . . 6.150 4.578 4.469 4.683 . 0 0 "[ . 1 . 2]" 1
154 1 10 LEU H 1 44 SER H . . 3.520 3.513 3.255 3.620 0.100 17 0 "[ . 1 . 2]" 1
155 1 10 LEU H 1 45 PHE HA . . 5.480 3.100 2.759 3.561 . 0 0 "[ . 1 . 2]" 1
156 1 10 LEU H 1 45 PHE QD . . 4.770 4.395 3.313 4.784 0.014 16 0 "[ . 1 . 2]" 1
157 1 10 LEU H 1 46 VAL H . . 4.490 3.896 3.590 4.261 . 0 0 "[ . 1 . 2]" 1
158 1 10 LEU HA 1 11 THR HA . . 6.150 4.398 4.298 4.482 . 0 0 "[ . 1 . 2]" 1
159 1 10 LEU HA 1 45 PHE HA . . 6.150 4.806 4.497 5.113 . 0 0 "[ . 1 . 2]" 1
160 1 10 LEU HB2 1 11 THR H . . 4.610 3.995 3.785 4.151 . 0 0 "[ . 1 . 2]" 1
161 1 10 LEU HB2 1 43 LEU MD2 . . 6.150 5.085 4.676 6.090 . 0 0 "[ . 1 . 2]" 1
162 1 10 LEU HB2 1 45 PHE H . . 5.780 5.107 4.591 5.718 . 0 0 "[ . 1 . 2]" 1
163 1 10 LEU HB2 1 45 PHE HA . . 6.150 2.737 2.412 3.260 . 0 0 "[ . 1 . 2]" 1
164 1 10 LEU HB2 1 45 PHE HB2 . . 6.150 5.154 4.616 5.690 . 0 0 "[ . 1 . 2]" 1
165 1 10 LEU HB2 1 45 PHE HB3 . . 6.150 4.330 3.689 5.135 . 0 0 "[ . 1 . 2]" 1
166 1 10 LEU HB2 1 45 PHE QD . . 6.150 2.522 2.088 2.943 . 0 0 "[ . 1 . 2]" 1
167 1 10 LEU HB2 1 45 PHE QE . . 6.150 3.723 2.901 4.107 . 0 0 "[ . 1 . 2]" 1
168 1 10 LEU HB2 1 55 ILE MD . . 6.150 3.492 3.193 4.240 . 0 0 "[ . 1 . 2]" 1
169 1 10 LEU HB3 1 11 THR H . . 4.470 2.823 2.551 3.039 . 0 0 "[ . 1 . 2]" 1
170 1 10 LEU HB3 1 11 THR MG . . 4.750 4.785 4.765 4.814 0.064 5 0 "[ . 1 . 2]" 1
171 1 10 LEU HB3 1 45 PHE HA . . 6.150 4.007 3.618 4.465 . 0 0 "[ . 1 . 2]" 1
172 1 10 LEU HB3 1 45 PHE QD . . 6.150 3.166 2.684 3.864 . 0 0 "[ . 1 . 2]" 1
173 1 10 LEU HB3 1 55 ILE MD . . 5.530 2.605 2.078 3.437 . 0 0 "[ . 1 . 2]" 1
174 1 10 LEU HG 1 43 LEU MD2 . . 5.840 4.468 3.725 5.388 . 0 0 "[ . 1 . 2]" 1
175 1 10 LEU HG 1 44 SER H . . 5.020 4.600 4.367 4.828 . 0 0 "[ . 1 . 2]" 1
176 1 10 LEU HG 1 55 ILE MD . . 6.150 4.608 4.283 5.343 . 0 0 "[ . 1 . 2]" 1
177 1 10 LEU MD1 1 11 THR H . . 6.150 4.812 4.520 4.993 . 0 0 "[ . 1 . 2]" 1
178 1 10 LEU MD1 1 43 LEU MD2 . . 6.040 2.966 2.372 4.461 . 0 0 "[ . 1 . 2]" 1
179 1 10 LEU MD1 1 44 SER H . . 5.720 4.462 4.187 5.341 . 0 0 "[ . 1 . 2]" 1
180 1 10 LEU MD1 1 45 PHE HA . . 6.150 4.250 3.771 4.804 . 0 0 "[ . 1 . 2]" 1
181 1 10 LEU MD1 1 45 PHE QD . . 6.100 3.042 2.339 3.496 . 0 0 "[ . 1 . 2]" 1
182 1 10 LEU MD1 1 45 PHE QE . . 6.150 2.398 2.072 2.675 . 0 0 "[ . 1 . 2]" 1
183 1 10 LEU MD1 1 55 ILE MD . . 6.150 2.451 2.174 3.107 . 0 0 "[ . 1 . 2]" 1
184 1 10 LEU MD1 1 120 LEU MD2 . . 6.150 3.638 2.261 4.738 . 0 0 "[ . 1 . 2]" 1
185 1 10 LEU MD2 1 11 THR H . . 5.420 3.340 3.115 3.577 . 0 0 "[ . 1 . 2]" 1
186 1 10 LEU MD2 1 43 LEU MD2 . . 6.150 4.865 4.174 5.993 . 0 0 "[ . 1 . 2]" 1
187 1 10 LEU MD2 1 44 SER H . . 5.920 5.899 5.730 5.968 0.048 4 0 "[ . 1 . 2]" 1
188 1 10 LEU MD2 1 45 PHE QD . . 6.150 4.619 4.039 5.036 . 0 0 "[ . 1 . 2]" 1
189 1 10 LEU MD2 1 54 ASP HB2 . . 6.150 3.684 3.013 4.534 . 0 0 "[ . 1 . 2]" 1
190 1 10 LEU MD2 1 54 ASP HB3 . . 6.150 3.378 2.381 4.381 . 0 0 "[ . 1 . 2]" 1
191 1 10 LEU MD2 1 55 ILE MD . . 6.150 2.953 2.420 3.890 . 0 0 "[ . 1 . 2]" 1
192 1 10 LEU MD2 1 120 LEU MD2 . . 6.150 5.342 3.704 6.186 0.036 16 0 "[ . 1 . 2]" 1
193 1 11 THR H 1 11 THR MG . . 4.030 2.617 2.427 3.095 . 0 0 "[ . 1 . 2]" 1
194 1 11 THR H 1 45 PHE QD . . 5.930 5.302 4.803 5.898 . 0 0 "[ . 1 . 2]" 1
195 1 11 THR H 1 54 ASP H . . 3.930 3.574 3.101 3.999 0.069 10 0 "[ . 1 . 2]" 1
196 1 11 THR H 1 54 ASP HB2 . . 4.300 2.970 2.279 4.063 . 0 0 "[ . 1 . 2]" 1
197 1 11 THR H 1 54 ASP HB3 . . 5.200 4.058 3.664 4.707 . 0 0 "[ . 1 . 2]" 1
198 1 11 THR H 1 55 ILE H . . 5.600 4.217 3.823 4.603 . 0 0 "[ . 1 . 2]" 1
199 1 11 THR HA 1 12 TYR H . . 3.380 2.144 2.026 2.273 . 0 0 "[ . 1 . 2]" 1
200 1 11 THR HA 1 46 VAL H . . 3.730 3.090 2.611 3.493 . 0 0 "[ . 1 . 2]" 1
201 1 11 THR HA 1 46 VAL HB . . 6.150 4.107 2.892 5.075 . 0 0 "[ . 1 . 2]" 1
202 1 11 THR HA 1 46 VAL MG1 . . 6.150 4.555 3.796 4.999 . 0 0 "[ . 1 . 2]" 1
203 1 11 THR HA 1 47 ARG HA . . 6.150 4.255 3.945 4.496 . 0 0 "[ . 1 . 2]" 1
204 1 11 THR HA 1 48 ILE H . . 6.150 4.681 3.999 5.057 . 0 0 "[ . 1 . 2]" 1
205 1 11 THR HA 1 48 ILE HG13 . . 6.150 6.182 6.029 6.218 0.068 4 0 "[ . 1 . 2]" 1
206 1 11 THR HA 1 48 ILE MG . . 6.150 3.490 3.050 3.853 . 0 0 "[ . 1 . 2]" 1
207 1 11 THR HA 1 53 ALA HA . . 6.150 5.578 5.105 6.145 . 0 0 "[ . 1 . 2]" 1
208 1 11 THR HB 1 12 TYR H . . 3.610 3.088 2.789 3.478 . 0 0 "[ . 1 . 2]" 1
209 1 11 THR HB 1 46 VAL H . . 6.150 5.411 4.934 5.960 . 0 0 "[ . 1 . 2]" 1
210 1 11 THR HB 1 46 VAL HB . . 6.150 5.497 4.297 6.109 . 0 0 "[ . 1 . 2]" 1
211 1 11 THR HB 1 46 VAL MG1 . . 6.150 5.646 4.474 6.206 0.056 9 0 "[ . 1 . 2]" 1
212 1 11 THR HB 1 48 ILE H . . 6.150 4.371 3.773 4.877 . 0 0 "[ . 1 . 2]" 1
213 1 11 THR HB 1 48 ILE HA . . 6.150 5.502 4.613 6.110 . 0 0 "[ . 1 . 2]" 1
214 1 11 THR HB 1 48 ILE HG13 . . 6.150 4.826 4.459 5.374 . 0 0 "[ . 1 . 2]" 1
215 1 11 THR HB 1 48 ILE MD . . 6.150 3.500 2.748 4.569 . 0 0 "[ . 1 . 2]" 1
216 1 11 THR HB 1 48 ILE MG . . 5.740 2.375 1.994 2.996 . 0 0 "[ . 1 . 2]" 1
217 1 11 THR HB 1 53 ALA HA . . 6.150 3.612 2.909 4.321 . 0 0 "[ . 1 . 2]" 1
218 1 11 THR HB 1 53 ALA MB . . 6.150 2.909 2.190 3.641 . 0 0 "[ . 1 . 2]" 1
219 1 11 THR HB 1 54 ASP H . . 4.610 3.792 3.347 4.232 . 0 0 "[ . 1 . 2]" 1
220 1 11 THR HG1 1 53 ALA HA . . 5.690 3.175 2.535 3.537 . 0 0 "[ . 1 . 2]" 1
221 1 11 THR HG1 1 54 ASP H . . 3.960 2.827 2.211 3.498 . 0 0 "[ . 1 . 2]" 1
222 1 11 THR MG 1 12 TYR H . . 3.920 3.905 3.576 3.966 0.046 18 0 "[ . 1 . 2]" 1
223 1 11 THR MG 1 46 VAL H . . 5.610 4.075 3.393 4.526 . 0 0 "[ . 1 . 2]" 1
224 1 11 THR MG 1 46 VAL HB . . 5.190 3.941 2.429 5.026 . 0 0 "[ . 1 . 2]" 1
225 1 11 THR MG 1 46 VAL MG1 . . 4.970 4.113 3.234 4.653 . 0 0 "[ . 1 . 2]" 1
226 1 11 THR MG 1 46 VAL MG2 . . 6.150 3.260 2.152 4.777 . 0 0 "[ . 1 . 2]" 1
227 1 11 THR MG 1 48 ILE H . . 6.150 5.198 4.680 5.548 . 0 0 "[ . 1 . 2]" 1
228 1 11 THR MG 1 48 ILE HA . . 6.150 5.532 4.834 6.092 . 0 0 "[ . 1 . 2]" 1
229 1 11 THR MG 1 48 ILE MD . . 5.580 4.219 3.363 5.089 . 0 0 "[ . 1 . 2]" 1
230 1 11 THR MG 1 53 ALA HA . . 6.150 4.353 3.713 4.983 . 0 0 "[ . 1 . 2]" 1
231 1 11 THR MG 1 54 ASP H . . 4.920 4.213 3.818 4.547 . 0 0 "[ . 1 . 2]" 1
232 1 12 TYR H 1 12 TYR HB3 . . 4.200 3.366 2.985 3.675 . 0 0 "[ . 1 . 2]" 1
233 1 12 TYR H 1 12 TYR QD . . 4.400 2.817 2.476 3.318 . 0 0 "[ . 1 . 2]" 1
234 1 12 TYR H 1 13 ARG H . . 4.520 4.516 4.463 4.566 0.046 12 0 "[ . 1 . 2]" 1
235 1 12 TYR H 1 46 VAL H . . 4.010 4.005 3.791 4.108 0.098 2 0 "[ . 1 . 2]" 1
236 1 12 TYR H 1 46 VAL HB . . 5.580 4.885 4.302 5.479 . 0 0 "[ . 1 . 2]" 1
237 1 12 TYR H 1 46 VAL MG2 . . 5.430 4.545 3.404 5.511 0.081 6 0 "[ . 1 . 2]" 1
238 1 12 TYR H 1 47 ARG H . . 5.070 4.626 4.250 4.898 . 0 0 "[ . 1 . 2]" 1
239 1 12 TYR H 1 47 ARG HA . . 4.800 2.542 2.214 2.773 . 0 0 "[ . 1 . 2]" 1
240 1 12 TYR H 1 47 ARG HB2 . . 4.820 4.809 4.500 5.001 0.181 18 0 "[ . 1 . 2]" 1
241 1 12 TYR H 1 48 ILE H . . 4.120 3.144 2.664 3.473 . 0 0 "[ . 1 . 2]" 1
242 1 12 TYR H 1 48 ILE HG12 . . 4.830 3.572 3.126 4.152 . 0 0 "[ . 1 . 2]" 1
243 1 12 TYR H 1 48 ILE MG . . 3.530 3.429 2.745 3.591 0.061 2 0 "[ . 1 . 2]" 1
244 1 12 TYR H 1 53 ALA HA . . 6.150 5.582 5.010 6.148 . 0 0 "[ . 1 . 2]" 1
245 1 12 TYR H 1 53 ALA MB . . 3.760 3.439 2.909 3.773 0.013 15 0 "[ . 1 . 2]" 1
246 1 12 TYR HA 1 13 ARG H . . 2.890 2.289 2.134 2.489 . 0 0 "[ . 1 . 2]" 1
247 1 12 TYR HA 1 53 ALA H . . 5.470 5.437 5.030 5.590 0.120 12 0 "[ . 1 . 2]" 1
248 1 12 TYR HA 1 53 ALA MB . . 6.150 2.400 2.063 3.059 . 0 0 "[ . 1 . 2]" 1
249 1 12 TYR HA 1 54 ASP H . . 4.460 3.989 3.629 4.356 . 0 0 "[ . 1 . 2]" 1
250 1 12 TYR HA 1 55 ILE H . . 3.820 2.778 2.343 3.221 . 0 0 "[ . 1 . 2]" 1
251 1 12 TYR HA 1 55 ILE HB . . 6.150 2.675 2.290 2.982 . 0 0 "[ . 1 . 2]" 1
252 1 12 TYR HA 1 55 ILE MG . . 6.100 3.704 3.386 3.968 . 0 0 "[ . 1 . 2]" 1
253 1 12 TYR HA 1 57 ILE MD . . 5.720 4.076 3.604 4.607 . 0 0 "[ . 1 . 2]" 1
254 1 12 TYR HB2 1 13 ARG H . . 4.070 3.101 2.510 3.836 . 0 0 "[ . 1 . 2]" 1
255 1 12 TYR HB2 1 55 ILE H . . 5.170 4.833 4.304 5.307 0.137 2 0 "[ . 1 . 2]" 1
256 1 12 TYR HB2 1 55 ILE HB . . 6.150 3.462 2.705 4.468 . 0 0 "[ . 1 . 2]" 1
257 1 12 TYR HB2 1 55 ILE HG13 . . 6.150 5.765 5.186 6.204 0.054 19 0 "[ . 1 . 2]" 1
258 1 12 TYR HB2 1 55 ILE MD . . 6.150 4.599 3.887 5.725 . 0 0 "[ . 1 . 2]" 1
259 1 12 TYR HB2 1 55 ILE MG . . 6.150 3.591 2.295 5.187 . 0 0 "[ . 1 . 2]" 1
260 1 12 TYR HB2 1 57 ILE MD . . 6.150 3.178 2.408 4.160 . 0 0 "[ . 1 . 2]" 1
261 1 12 TYR HB3 1 13 ARG H . . 3.990 3.374 2.415 4.020 0.030 1 0 "[ . 1 . 2]" 1
262 1 12 TYR HB3 1 55 ILE H . . 6.150 4.521 3.878 4.988 . 0 0 "[ . 1 . 2]" 1
263 1 12 TYR HB3 1 55 ILE HB . . 5.330 3.067 2.285 3.900 . 0 0 "[ . 1 . 2]" 1
264 1 12 TYR HB3 1 55 ILE MD . . 6.150 4.034 2.931 5.638 . 0 0 "[ . 1 . 2]" 1
265 1 12 TYR HB3 1 55 ILE MG . . 6.150 3.545 3.085 4.205 . 0 0 "[ . 1 . 2]" 1
266 1 12 TYR QD 1 13 ARG H . . 3.630 3.459 2.931 3.697 0.067 11 0 "[ . 1 . 2]" 1
267 1 12 TYR QD 1 13 ARG HA . . 6.150 4.465 3.309 5.728 . 0 0 "[ . 1 . 2]" 1
268 1 12 TYR QD 1 14 ILE MD . . 6.150 4.743 3.178 6.160 0.010 11 0 "[ . 1 . 2]" 1
269 1 12 TYR QD 1 34 LEU MD1 . . 6.150 4.129 3.421 4.833 . 0 0 "[ . 1 . 2]" 1
270 1 12 TYR QD 1 45 PHE H . . 6.150 5.758 5.316 6.181 0.031 17 0 "[ . 1 . 2]" 1
271 1 12 TYR QD 1 45 PHE HA . . 6.150 3.697 3.225 4.214 . 0 0 "[ . 1 . 2]" 1
272 1 12 TYR QD 1 45 PHE HB2 . . 6.150 4.295 3.350 5.274 . 0 0 "[ . 1 . 2]" 1
273 1 12 TYR QD 1 45 PHE HB3 . . 6.150 2.878 2.224 3.740 . 0 0 "[ . 1 . 2]" 1
274 1 12 TYR QD 1 46 VAL H . . 5.330 3.209 2.760 3.978 . 0 0 "[ . 1 . 2]" 1
275 1 12 TYR QD 1 47 ARG H . . 4.950 4.404 3.831 4.946 . 0 0 "[ . 1 . 2]" 1
276 1 12 TYR QD 1 47 ARG HA . . 6.150 3.474 3.156 3.950 . 0 0 "[ . 1 . 2]" 1
277 1 12 TYR QD 1 47 ARG HB2 . . 6.150 4.568 3.885 5.316 . 0 0 "[ . 1 . 2]" 1
278 1 12 TYR QD 1 47 ARG HD2 . . 6.150 5.435 3.795 6.152 0.002 17 0 "[ . 1 . 2]" 1
279 1 12 TYR QD 1 47 ARG HD3 . . 6.150 5.266 3.374 6.189 0.039 6 0 "[ . 1 . 2]" 1
280 1 12 TYR QD 1 47 ARG HG3 . . 6.150 5.925 4.361 6.208 0.058 17 0 "[ . 1 . 2]" 1
281 1 12 TYR QD 1 48 ILE H . . 5.010 4.874 4.659 5.107 0.097 18 0 "[ . 1 . 2]" 1
282 1 12 TYR QD 1 55 ILE MG . . 6.150 3.427 2.268 4.452 . 0 0 "[ . 1 . 2]" 1
283 1 12 TYR QD 1 57 ILE MD . . 6.150 2.129 2.012 2.466 . 0 0 "[ . 1 . 2]" 1
284 1 12 TYR QE 1 34 LEU MD1 . . 6.150 3.238 2.150 4.419 . 0 0 "[ . 1 . 2]" 1
285 1 12 TYR QE 1 57 ILE MD . . 6.150 3.443 2.749 3.919 . 0 0 "[ . 1 . 2]" 1
286 1 12 TYR QE 1 57 ILE MG . . 6.150 4.665 3.155 6.163 0.013 16 0 "[ . 1 . 2]" 1
287 1 13 ARG H 1 13 ARG HB2 . . 4.040 3.134 2.509 3.406 . 0 0 "[ . 1 . 2]" 1
288 1 13 ARG H 1 13 ARG HB3 . . 3.680 3.005 2.581 3.500 . 0 0 "[ . 1 . 2]" 1
289 1 13 ARG H 1 13 ARG QD . . 4.600 4.560 4.308 4.697 0.097 1 0 "[ . 1 . 2]" 1
290 1 13 ARG H 1 13 ARG QG . . 4.290 4.233 3.722 4.359 0.069 6 0 "[ . 1 . 2]" 1
291 1 13 ARG H 1 14 ILE H . . 4.710 4.176 3.960 4.302 . 0 0 "[ . 1 . 2]" 1
292 1 13 ARG H 1 48 ILE HG12 . . 4.970 4.785 4.423 5.063 0.093 19 0 "[ . 1 . 2]" 1
293 1 13 ARG H 1 48 ILE MD . . 6.150 5.080 4.539 5.680 . 0 0 "[ . 1 . 2]" 1
294 1 13 ARG H 1 53 ALA MB . . 3.620 2.960 2.494 3.543 . 0 0 "[ . 1 . 2]" 1
295 1 13 ARG H 1 55 ILE H . . 4.650 4.409 3.888 4.694 0.044 15 0 "[ . 1 . 2]" 1
296 1 13 ARG H 1 55 ILE HB . . 4.390 4.188 3.908 4.427 0.037 1 0 "[ . 1 . 2]" 1
297 1 13 ARG H 1 56 MET HA . . 3.570 2.670 2.526 2.896 . 0 0 "[ . 1 . 2]" 1
298 1 13 ARG H 1 56 MET HB2 . . 5.530 5.502 5.210 5.611 0.081 5 0 "[ . 1 . 2]" 1
299 1 13 ARG H 1 57 ILE H . . 4.220 3.595 2.947 3.906 . 0 0 "[ . 1 . 2]" 1
300 1 13 ARG H 1 57 ILE MD . . 3.160 2.802 2.319 3.194 0.034 18 0 "[ . 1 . 2]" 1
301 1 13 ARG H 1 57 ILE MG . . 4.660 4.477 3.209 4.701 0.041 12 0 "[ . 1 . 2]" 1
302 1 13 ARG HA 1 14 ILE H . . 3.380 2.174 2.100 2.235 . 0 0 "[ . 1 . 2]" 1
303 1 13 ARG HA 1 48 ILE H . . 3.620 3.580 3.293 3.695 0.075 6 0 "[ . 1 . 2]" 1
304 1 13 ARG HA 1 53 ALA MB . . 6.050 3.980 3.359 4.508 . 0 0 "[ . 1 . 2]" 1
305 1 13 ARG HB2 1 14 ILE H . . 5.180 4.429 4.221 4.733 . 0 0 "[ . 1 . 2]" 1
306 1 13 ARG HB2 1 48 ILE MD . . 6.150 2.801 2.170 4.662 . 0 0 "[ . 1 . 2]" 1
307 1 13 ARG HB2 1 53 ALA H . . 4.600 3.712 2.750 4.609 0.009 15 0 "[ . 1 . 2]" 1
308 1 13 ARG HB2 1 53 ALA MB . . 6.150 2.374 2.048 2.958 . 0 0 "[ . 1 . 2]" 1
309 1 13 ARG HB3 1 13 ARG QG . . 2.730 2.399 2.170 2.581 . 0 0 "[ . 1 . 2]" 1
310 1 13 ARG HB3 1 48 ILE MD . . 6.150 3.867 3.280 5.390 . 0 0 "[ . 1 . 2]" 1
311 1 13 ARG HB3 1 53 ALA H . . 4.740 3.799 2.753 4.596 . 0 0 "[ . 1 . 2]" 1
312 1 13 ARG HB3 1 53 ALA MB . . 5.710 3.004 2.379 3.804 . 0 0 "[ . 1 . 2]" 1
313 1 13 ARG HB3 1 56 MET ME . . 6.150 3.117 2.211 4.610 . 0 0 "[ . 1 . 2]" 1
314 1 13 ARG QD 1 14 ILE H . . 5.080 3.147 2.151 4.467 . 0 0 "[ . 1 . 2]" 1
315 1 13 ARG QD 1 48 ILE HG12 . . 6.150 4.846 3.686 5.812 . 0 0 "[ . 1 . 2]" 1
316 1 13 ARG QD 1 48 ILE MD . . 6.150 3.846 2.230 4.929 . 0 0 "[ . 1 . 2]" 1
317 1 13 ARG QD 1 52 GLU HA . . 6.150 4.982 3.713 6.052 . 0 0 "[ . 1 . 2]" 1
318 1 13 ARG QD 1 53 ALA MB . . 6.150 4.306 3.703 4.932 . 0 0 "[ . 1 . 2]" 1
319 1 13 ARG QG 1 14 ILE H . . 6.150 3.273 2.514 4.345 . 0 0 "[ . 1 . 2]" 1
320 1 13 ARG QG 1 49 ASN HA . . 6.150 4.062 2.255 5.977 . 0 0 "[ . 1 . 2]" 1
321 1 13 ARG QG 1 53 ALA MB . . 6.150 3.582 2.047 4.279 . 0 0 "[ . 1 . 2]" 1
322 1 14 ILE H 1 14 ILE HB . . 4.020 2.606 2.394 2.896 . 0 0 "[ . 1 . 2]" 1
323 1 14 ILE H 1 14 ILE HG12 . . 3.680 3.652 3.098 3.777 0.097 15 0 "[ . 1 . 2]" 1
324 1 14 ILE H 1 14 ILE HG13 . . 4.270 2.385 2.067 2.665 . 0 0 "[ . 1 . 2]" 1
325 1 14 ILE H 1 14 ILE MD . . 3.670 3.496 1.842 3.706 0.036 4 0 "[ . 1 . 2]" 1
326 1 14 ILE H 1 14 ILE MG . . 4.240 3.830 3.766 3.883 . 0 0 "[ . 1 . 2]" 1
327 1 14 ILE H 1 15 SER H . . 4.900 4.518 4.343 4.646 . 0 0 "[ . 1 . 2]" 1
328 1 14 ILE H 1 57 ILE HG13 . . 6.150 5.474 4.615 6.163 0.013 16 0 "[ . 1 . 2]" 1
329 1 14 ILE HA 1 15 SER HA . . 6.150 4.456 4.395 4.514 . 0 0 "[ . 1 . 2]" 1
330 1 14 ILE HA 1 16 LYS H . . 3.800 3.628 3.362 3.848 0.048 7 0 "[ . 1 . 2]" 1
331 1 14 ILE HA 1 57 ILE HA . . 6.150 5.130 4.827 5.662 . 0 0 "[ . 1 . 2]" 1
332 1 14 ILE HA 1 57 ILE HB . . 5.950 4.563 4.312 5.018 . 0 0 "[ . 1 . 2]" 1
333 1 14 ILE HA 1 57 ILE MG . . 6.150 4.729 4.396 5.188 . 0 0 "[ . 1 . 2]" 1
334 1 14 ILE HB 1 15 SER H . . 6.150 4.178 4.001 4.365 . 0 0 "[ . 1 . 2]" 1
335 1 14 ILE HB 1 16 LYS H . . 6.150 4.824 4.435 5.529 . 0 0 "[ . 1 . 2]" 1
336 1 14 ILE HB 1 17 TYR QE . . 6.150 4.157 2.997 5.108 . 0 0 "[ . 1 . 2]" 1
337 1 14 ILE HG12 1 15 SER H . . 6.150 4.744 4.289 5.680 . 0 0 "[ . 1 . 2]" 1
338 1 14 ILE HG13 1 57 ILE HB . . 6.150 5.904 4.531 6.160 0.010 19 0 "[ . 1 . 2]" 1
339 1 14 ILE HG13 1 57 ILE MG . . 6.150 5.254 4.234 5.681 . 0 0 "[ . 1 . 2]" 1
340 1 14 ILE MD 1 16 LYS H . . 5.890 5.553 5.015 5.899 0.009 5 0 "[ . 1 . 2]" 1
341 1 14 ILE MD 1 27 ASP H . . 6.150 4.504 3.450 5.421 . 0 0 "[ . 1 . 2]" 1
342 1 14 ILE MD 1 27 ASP HA . . 6.150 3.306 2.637 3.769 . 0 0 "[ . 1 . 2]" 1
343 1 14 ILE MD 1 30 VAL H . . 6.150 5.765 5.200 6.180 0.030 2 0 "[ . 1 . 2]" 1
344 1 14 ILE MD 1 30 VAL HB . . 6.150 5.486 4.352 6.165 0.015 4 0 "[ . 1 . 2]" 1
345 1 14 ILE MG 1 15 SER H . . 6.150 2.725 2.433 3.006 . 0 0 "[ . 1 . 2]" 1
346 1 14 ILE MG 1 16 LYS H . . 3.800 2.505 2.097 3.029 . 0 0 "[ . 1 . 2]" 1
347 1 14 ILE MG 1 17 TYR HA . . 6.150 3.880 2.941 4.486 . 0 0 "[ . 1 . 2]" 1
348 1 14 ILE MG 1 17 TYR QE . . 6.150 2.753 2.404 3.308 . 0 0 "[ . 1 . 2]" 1
349 1 14 ILE MG 1 26 VAL MG2 . . 6.150 4.971 4.051 5.709 . 0 0 "[ . 1 . 2]" 1
350 1 14 ILE MG 1 57 ILE HB . . 6.150 4.395 3.282 5.427 . 0 0 "[ . 1 . 2]" 1
351 1 14 ILE MG 1 57 ILE MD . . 6.150 3.660 2.813 4.195 . 0 0 "[ . 1 . 2]" 1
352 1 14 ILE MG 1 57 ILE MG . . 6.120 4.957 4.191 5.474 . 0 0 "[ . 1 . 2]" 1
353 1 14 ILE MG 1 58 SER HA . . 6.150 4.229 3.712 5.122 . 0 0 "[ . 1 . 2]" 1
354 1 15 SER H 1 16 LYS H . . 3.490 2.051 1.760 2.349 . 0 0 "[ . 1 . 2]" 1
355 1 15 SER H 1 58 SER HB2 . . 6.150 5.288 4.355 6.174 0.024 15 0 "[ . 1 . 2]" 1
356 1 15 SER HA 1 56 MET ME . . 6.150 4.765 3.582 6.155 0.005 3 0 "[ . 1 . 2]" 1
357 1 15 SER QB 1 16 LYS H . . 6.150 3.436 2.385 4.041 . 0 0 "[ . 1 . 2]" 1
358 1 16 LYS H 1 16 LYS HB3 . . 4.030 2.954 2.416 4.031 0.001 1 0 "[ . 1 . 2]" 1
359 1 16 LYS H 1 16 LYS HG2 . . 4.710 4.092 2.639 4.800 0.090 7 0 "[ . 1 . 2]" 1
360 1 16 LYS H 1 16 LYS HG3 . . 4.990 4.303 2.676 4.804 . 0 0 "[ . 1 . 2]" 1
361 1 16 LYS H 1 16 LYS QD . . 5.050 4.797 4.225 5.090 0.040 18 0 "[ . 1 . 2]" 1
362 1 16 LYS H 1 16 LYS QE . . 4.980 4.819 4.312 5.056 0.076 5 0 "[ . 1 . 2]" 1
363 1 16 LYS H 1 17 TYR H . . 4.810 4.134 2.156 4.451 . 0 0 "[ . 1 . 2]" 1
364 1 16 LYS H 1 17 TYR HA . . 5.040 4.802 4.275 5.052 0.012 18 0 "[ . 1 . 2]" 1
365 1 16 LYS H 1 58 SER HA . . 6.150 3.167 2.583 4.034 . 0 0 "[ . 1 . 2]" 1
366 1 16 LYS H 1 58 SER HB2 . . 6.150 4.782 4.073 5.769 . 0 0 "[ . 1 . 2]" 1
367 1 16 LYS H 1 58 SER HB3 . . 6.150 4.107 2.940 5.737 . 0 0 "[ . 1 . 2]" 1
368 1 16 LYS H 1 59 PHE H . . 5.230 4.658 4.166 5.234 0.004 7 0 "[ . 1 . 2]" 1
369 1 16 LYS HA 1 16 LYS QE . . 4.880 3.798 2.320 4.853 . 0 0 "[ . 1 . 2]" 1
370 1 16 LYS HA 1 17 TYR H . . 3.550 2.367 2.009 3.549 . 0 0 "[ . 1 . 2]" 1
371 1 16 LYS HA 1 17 TYR HA . . 6.150 4.584 4.443 5.393 . 0 0 "[ . 1 . 2]" 1
372 1 16 LYS HA 1 17 TYR HB2 . . 6.150 4.587 4.247 4.969 . 0 0 "[ . 1 . 2]" 1
373 1 16 LYS HA 1 59 PHE H . . 6.150 4.980 4.615 5.609 . 0 0 "[ . 1 . 2]" 1
374 1 16 LYS HA 1 59 PHE QB . . 6.150 5.438 4.768 6.127 . 0 0 "[ . 1 . 2]" 1
375 1 16 LYS HB2 1 17 TYR H . . 4.000 3.655 2.470 4.069 0.069 14 0 "[ . 1 . 2]" 1
376 1 16 LYS HB2 1 17 TYR HA . . 6.150 5.497 4.004 6.039 . 0 0 "[ . 1 . 2]" 1
377 1 16 LYS HB2 1 58 SER HA . . 6.150 3.756 2.027 4.812 . 0 0 "[ . 1 . 2]" 1
378 1 16 LYS HB2 1 58 SER HB2 . . 6.150 4.018 2.620 6.216 0.066 11 0 "[ . 1 . 2]" 1
379 1 16 LYS HB2 1 58 SER HB3 . . 6.150 4.083 3.215 6.179 0.029 20 0 "[ . 1 . 2]" 1
380 1 16 LYS HB2 1 59 PHE H . . 4.020 3.605 1.793 4.109 0.089 20 0 "[ . 1 . 2]" 1
381 1 16 LYS HB3 1 16 LYS QE . . 4.710 3.189 2.229 4.101 . 0 0 "[ . 1 . 2]" 1
382 1 16 LYS HB3 1 17 TYR H . . 4.300 3.600 1.964 4.293 . 0 0 "[ . 1 . 2]" 1
383 1 16 LYS HB3 1 58 SER HA . . 6.150 2.894 2.070 5.042 . 0 0 "[ . 1 . 2]" 1
384 1 16 LYS HB3 1 58 SER HB2 . . 5.900 3.496 2.190 5.934 0.034 11 0 "[ . 1 . 2]" 1
385 1 16 LYS HB3 1 58 SER HB3 . . 6.150 3.557 2.066 5.883 . 0 0 "[ . 1 . 2]" 1
386 1 16 LYS HB3 1 59 PHE H . . 4.300 2.935 2.435 4.423 0.123 4 0 "[ . 1 . 2]" 1
387 1 16 LYS HG2 1 58 SER H . . 6.150 5.904 5.158 6.202 0.052 16 0 "[ . 1 . 2]" 1
388 1 16 LYS HG2 1 58 SER HB2 . . 6.150 3.472 2.142 5.073 . 0 0 "[ . 1 . 2]" 1
389 1 16 LYS HG3 1 17 TYR HA . . 6.150 4.773 3.986 6.227 0.077 13 0 "[ . 1 . 2]" 1
390 1 16 LYS HG3 1 58 SER HB2 . . 6.150 4.356 2.133 6.211 0.061 12 0 "[ . 1 . 2]" 1
391 1 16 LYS HG3 1 58 SER HB3 . . 6.150 4.815 3.034 6.165 0.015 18 0 "[ . 1 . 2]" 1
392 1 16 LYS HG3 1 59 PHE H . . 4.610 2.812 1.715 3.902 . 0 0 "[ . 1 . 2]" 1
393 1 16 LYS QD 1 17 TYR H . . 4.330 3.943 2.440 4.435 0.105 7 0 "[ . 1 . 2]" 1
394 1 16 LYS QD 1 58 SER HB2 . . 6.150 3.871 2.181 5.268 . 0 0 "[ . 1 . 2]" 1
395 1 16 LYS QD 1 58 SER HB3 . . 6.150 4.527 2.239 5.820 . 0 0 "[ . 1 . 2]" 1
396 1 16 LYS QD 1 59 PHE H . . 3.800 3.116 2.004 3.836 0.036 2 0 "[ . 1 . 2]" 1
397 1 17 TYR H 1 17 TYR QD . . 3.240 2.924 2.481 3.252 0.012 7 0 "[ . 1 . 2]" 1
398 1 17 TYR H 1 18 THR H . . 4.690 4.432 4.292 4.667 . 0 0 "[ . 1 . 2]" 1
399 1 17 TYR H 1 26 VAL MG2 . . 6.150 5.854 5.399 6.190 0.040 19 0 "[ . 1 . 2]" 1
400 1 17 TYR HA 1 17 TYR QE . . 6.110 4.803 4.531 4.987 . 0 0 "[ . 1 . 2]" 1
401 1 17 TYR HA 1 18 THR H . . 2.990 2.614 2.319 2.916 . 0 0 "[ . 1 . 2]" 1
402 1 17 TYR HA 1 18 THR HB . . 6.150 4.565 4.028 4.984 . 0 0 "[ . 1 . 2]" 1
403 1 17 TYR HA 1 18 THR MG . . 6.150 3.959 3.688 4.482 . 0 0 "[ . 1 . 2]" 1
404 1 17 TYR HA 1 26 VAL MG1 . . 6.150 3.375 2.342 3.903 . 0 0 "[ . 1 . 2]" 1
405 1 17 TYR HB2 1 18 THR H . . 3.270 3.167 2.704 3.308 0.038 19 0 "[ . 1 . 2]" 1
406 1 17 TYR HB2 1 18 THR MG . . 6.150 4.800 4.142 5.291 . 0 0 "[ . 1 . 2]" 1
407 1 17 TYR HB2 1 26 VAL MG1 . . 6.150 4.897 3.981 5.671 . 0 0 "[ . 1 . 2]" 1
408 1 17 TYR HB3 1 18 THR H . . 3.310 2.122 1.933 2.574 . 0 0 "[ . 1 . 2]" 1
409 1 17 TYR HB3 1 18 THR MG . . 6.150 3.692 3.150 4.154 . 0 0 "[ . 1 . 2]" 1
410 1 17 TYR HB3 1 26 VAL MG1 . . 6.150 3.508 2.467 4.487 . 0 0 "[ . 1 . 2]" 1
411 1 17 TYR QD 1 18 THR H . . 4.360 3.831 3.502 4.336 . 0 0 "[ . 1 . 2]" 1
412 1 17 TYR QD 1 23 SER HA . . 6.150 2.785 2.388 3.237 . 0 0 "[ . 1 . 2]" 1
413 1 17 TYR QD 1 26 VAL H . . 4.910 4.741 4.360 4.956 0.046 17 0 "[ . 1 . 2]" 1
414 1 17 TYR QD 1 26 VAL HA . . 6.150 5.346 4.841 5.967 . 0 0 "[ . 1 . 2]" 1
415 1 17 TYR QD 1 26 VAL HB . . 6.150 2.873 2.010 4.501 . 0 0 "[ . 1 . 2]" 1
416 1 17 TYR QD 1 26 VAL MG1 . . 6.150 2.536 1.971 3.106 . 0 0 "[ . 1 . 2]" 1
417 1 17 TYR QD 1 26 VAL MG2 . . 6.010 2.783 2.074 3.867 . 0 0 "[ . 1 . 2]" 1
418 1 17 TYR QD 1 27 ASP H . . 4.720 4.410 3.472 4.776 0.056 5 0 "[ . 1 . 2]" 1
419 1 17 TYR QE 1 23 SER HA . . 6.150 3.324 2.358 4.410 . 0 0 "[ . 1 . 2]" 1
420 1 17 TYR QE 1 23 SER QB . . 6.150 2.975 2.555 4.311 . 0 0 "[ . 1 . 2]" 1
421 1 17 TYR QE 1 26 VAL H . . 6.150 5.329 4.581 6.086 . 0 0 "[ . 1 . 2]" 1
422 1 17 TYR QE 1 26 VAL HB . . 6.150 3.854 2.448 6.182 0.032 17 0 "[ . 1 . 2]" 1
423 1 17 TYR QE 1 26 VAL MG1 . . 6.150 3.672 2.692 4.633 . 0 0 "[ . 1 . 2]" 1
424 1 17 TYR QE 1 26 VAL MG2 . . 6.060 4.352 3.049 5.423 . 0 0 "[ . 1 . 2]" 1
425 1 17 TYR QE 1 27 ASP H . . 6.150 3.824 3.090 4.564 . 0 0 "[ . 1 . 2]" 1
426 1 17 TYR QE 1 27 ASP HA . . 6.150 4.620 3.324 5.569 . 0 0 "[ . 1 . 2]" 1
427 1 17 TYR QE 1 27 ASP HB2 . . 6.150 3.806 2.284 4.672 . 0 0 "[ . 1 . 2]" 1
428 1 18 THR H 1 18 THR HB . . 4.050 3.059 2.795 3.328 . 0 0 "[ . 1 . 2]" 1
429 1 18 THR H 1 18 THR MG . . 2.900 2.174 1.890 2.542 . 0 0 "[ . 1 . 2]" 1
430 1 18 THR H 1 21 MET H . . 5.380 4.655 4.274 5.045 . 0 0 "[ . 1 . 2]" 1
431 1 18 THR H 1 26 VAL MG1 . . 4.440 3.582 2.526 4.442 0.002 9 0 "[ . 1 . 2]" 1
432 1 18 THR H 1 26 VAL MG2 . . 4.720 2.884 2.026 3.302 . 0 0 "[ . 1 . 2]" 1
433 1 18 THR HA 1 19 PRO HB2 . . 6.150 5.752 5.639 5.819 . 0 0 "[ . 1 . 2]" 1
434 1 18 THR HA 1 59 PHE QB . . 6.150 3.517 2.697 4.186 . 0 0 "[ . 1 . 2]" 1
435 1 18 THR HA 1 95 ASN HD22 . . 6.150 3.796 2.602 5.543 . 0 0 "[ . 1 . 2]" 1
436 1 18 THR HB 1 19 PRO HD2 . . 6.150 3.769 3.554 4.040 . 0 0 "[ . 1 . 2]" 1
437 1 18 THR HB 1 19 PRO HD3 . . 6.150 4.743 4.586 4.896 . 0 0 "[ . 1 . 2]" 1
438 1 18 THR HB 1 19 PRO HG2 . . 6.150 5.806 5.478 6.167 0.017 20 0 "[ . 1 . 2]" 1
439 1 18 THR HB 1 21 MET H . . 5.530 5.160 4.273 5.561 0.031 3 0 "[ . 1 . 2]" 1
440 1 18 THR HB 1 26 VAL MG1 . . 6.150 4.929 4.186 5.424 . 0 0 "[ . 1 . 2]" 1
441 1 18 THR HB 1 59 PHE QB . . 6.150 3.573 2.632 5.041 . 0 0 "[ . 1 . 2]" 1
442 1 18 THR HG1 1 19 PRO HD2 . . 6.150 2.850 2.234 3.388 . 0 0 "[ . 1 . 2]" 1
443 1 18 THR HG1 1 19 PRO HD3 . . 6.150 4.395 3.816 4.877 . 0 0 "[ . 1 . 2]" 1
444 1 18 THR HG1 1 19 PRO HG2 . . 6.150 4.463 3.682 5.231 . 0 0 "[ . 1 . 2]" 1
445 1 18 THR HG1 1 19 PRO HG3 . . 6.150 5.361 4.785 6.004 . 0 0 "[ . 1 . 2]" 1
446 1 18 THR MG 1 20 SER H . . 3.550 2.999 2.604 3.566 0.016 1 0 "[ . 1 . 2]" 1
447 1 18 THR MG 1 21 MET H . . 4.010 2.349 1.785 2.729 . 0 0 "[ . 1 . 2]" 1
448 1 18 THR MG 1 21 MET HB2 . . 6.150 3.171 2.308 4.437 . 0 0 "[ . 1 . 2]" 1
449 1 18 THR MG 1 21 MET HB3 . . 6.150 4.160 3.703 4.629 . 0 0 "[ . 1 . 2]" 1
450 1 18 THR MG 1 21 MET HG2 . . 6.150 3.366 2.042 4.249 . 0 0 "[ . 1 . 2]" 1
451 1 18 THR MG 1 21 MET HG3 . . 6.150 2.486 2.044 3.294 . 0 0 "[ . 1 . 2]" 1
452 1 18 THR MG 1 21 MET ME . . 6.150 4.043 3.634 4.975 . 0 0 "[ . 1 . 2]" 1
453 1 18 THR MG 1 26 VAL MG1 . . 5.160 3.198 2.343 3.757 . 0 0 "[ . 1 . 2]" 1
454 1 18 THR MG 1 26 VAL MG2 . . 6.150 2.374 1.956 3.072 . 0 0 "[ . 1 . 2]" 1
455 1 18 THR MG 1 99 TRP HB2 . . 6.150 2.635 2.212 3.757 . 0 0 "[ . 1 . 2]" 1
456 1 18 THR MG 1 99 TRP HB3 . . 6.150 3.043 2.542 3.856 . 0 0 "[ . 1 . 2]" 1
457 1 18 THR MG 1 99 TRP HD1 . . 6.150 3.434 2.771 4.531 . 0 0 "[ . 1 . 2]" 1
458 1 18 THR MG 1 108 LEU MD1 . . 6.150 3.044 2.264 4.391 . 0 0 "[ . 1 . 2]" 1
459 1 19 PRO HD2 1 99 TRP HD1 . . 6.150 4.486 3.636 5.118 . 0 0 "[ . 1 . 2]" 1
460 1 19 PRO HG2 1 20 SER H . . 4.080 2.542 2.388 2.636 . 0 0 "[ . 1 . 2]" 1
461 1 19 PRO HG3 1 20 SER H . . 4.040 4.076 3.985 4.112 0.072 10 0 "[ . 1 . 2]" 1
462 1 20 SER H 1 20 SER HB2 . . 3.060 2.285 1.970 2.703 . 0 0 "[ . 1 . 2]" 1
463 1 20 SER H 1 20 SER HB3 . . 3.570 3.158 2.269 3.582 0.012 7 0 "[ . 1 . 2]" 1
464 1 20 SER H 1 21 MET H . . 3.120 2.846 2.555 3.066 . 0 0 "[ . 1 . 2]" 1
465 1 20 SER H 1 99 TRP HB2 . . 4.480 4.176 3.836 4.393 . 0 0 "[ . 1 . 2]" 1
466 1 20 SER H 1 99 TRP HD1 . . 4.460 4.471 4.261 4.570 0.110 3 0 "[ . 1 . 2]" 1
467 1 20 SER HA 1 21 MET HG3 . . 6.150 5.404 4.508 6.309 0.159 3 0 "[ . 1 . 2]" 1
468 1 20 SER HB2 1 21 MET H . . 3.460 3.283 2.750 3.583 0.123 11 0 "[ . 1 . 2]" 1
469 1 20 SER HB2 1 21 MET HG3 . . 6.150 3.999 2.514 5.335 . 0 0 "[ . 1 . 2]" 1
470 1 20 SER HB2 1 99 TRP H . . 4.400 3.195 2.602 4.412 0.012 5 0 "[ . 1 . 2]" 1
471 1 20 SER HB3 1 21 MET H . . 3.940 3.310 2.169 3.994 0.054 6 0 "[ . 1 . 2]" 1
472 1 20 SER HB3 1 21 MET HB3 . . 5.890 5.251 4.130 5.991 0.101 19 0 "[ . 1 . 2]" 1
473 1 20 SER HB3 1 99 TRP H . . 4.470 2.960 1.795 4.507 0.037 11 0 "[ . 1 . 2]" 1
474 1 21 MET H 1 21 MET HB2 . . 3.810 3.066 2.530 3.831 0.021 9 0 "[ . 1 . 2]" 1
475 1 21 MET H 1 21 MET HB3 . . 3.730 3.758 3.427 3.823 0.093 13 0 "[ . 1 . 2]" 1
476 1 21 MET H 1 21 MET HG2 . . 4.090 3.260 2.196 3.983 . 0 0 "[ . 1 . 2]" 1
477 1 21 MET H 1 21 MET HG3 . . 3.890 2.931 2.315 3.906 0.016 3 0 "[ . 1 . 2]" 1
478 1 21 MET H 1 21 MET ME . . 6.150 4.866 4.350 5.115 . 0 0 "[ . 1 . 2]" 1
479 1 21 MET H 1 26 VAL MG2 . . 5.650 4.165 3.356 5.685 0.035 14 0 "[ . 1 . 2]" 1
480 1 21 MET HA 1 21 MET ME . . 6.150 3.967 2.624 4.433 . 0 0 "[ . 1 . 2]" 1
481 1 21 MET HA 1 22 SER H . . 3.070 2.357 2.105 2.610 . 0 0 "[ . 1 . 2]" 1
482 1 21 MET HA 1 22 SER HA . . 6.150 4.435 4.307 4.520 . 0 0 "[ . 1 . 2]" 1
483 1 21 MET HB2 1 22 SER H . . 3.420 3.304 2.772 3.508 0.088 1 0 "[ . 1 . 2]" 1
484 1 21 MET HB2 1 26 VAL MG1 . . 6.150 4.332 2.530 5.390 . 0 0 "[ . 1 . 2]" 1
485 1 21 MET HB3 1 22 SER H . . 3.930 2.859 2.119 3.712 . 0 0 "[ . 1 . 2]" 1
486 1 21 MET HB3 1 25 GLU H . . 5.710 5.107 4.502 5.799 0.089 18 0 "[ . 1 . 2]" 1
487 1 21 MET HB3 1 25 GLU HA . . 6.150 5.507 4.924 6.166 0.016 3 0 "[ . 1 . 2]" 1
488 1 21 MET HB3 1 25 GLU HB3 . . 6.150 3.383 2.820 4.500 . 0 0 "[ . 1 . 2]" 1
489 1 21 MET HB3 1 26 VAL MG1 . . 6.150 5.193 2.663 6.214 0.064 18 0 "[ . 1 . 2]" 1
490 1 21 MET HB3 1 99 TRP HB2 . . 6.150 5.716 5.203 6.232 0.082 14 0 "[ . 1 . 2]" 1
491 1 21 MET HB3 1 99 TRP HB3 . . 6.150 5.594 4.989 6.176 0.026 1 0 "[ . 1 . 2]" 1
492 1 21 MET HB3 1 101 MET HB2 . . 6.150 5.848 3.329 6.235 0.085 12 0 "[ . 1 . 2]" 1
493 1 21 MET HB3 1 101 MET HG2 . . 6.150 5.197 4.177 6.159 0.009 10 0 "[ . 1 . 2]" 1
494 1 21 MET HB3 1 101 MET HG3 . . 6.150 5.598 4.433 6.222 0.072 7 0 "[ . 1 . 2]" 1
495 1 21 MET HG2 1 22 SER H . . 6.150 4.677 3.868 5.302 . 0 0 "[ . 1 . 2]" 1
496 1 21 MET HG2 1 26 VAL MG1 . . 5.930 5.607 4.567 5.986 0.056 20 0 "[ . 1 . 2]" 1
497 1 21 MET HG2 1 100 THR HA . . 6.150 3.507 2.265 5.957 . 0 0 "[ . 1 . 2]" 1
498 1 21 MET HG3 1 22 SER H . . 6.150 4.984 4.718 5.264 . 0 0 "[ . 1 . 2]" 1
499 1 21 MET HG3 1 26 VAL MG1 . . 6.060 4.732 3.997 5.629 . 0 0 "[ . 1 . 2]" 1
500 1 21 MET ME 1 22 SER H . . 6.150 4.341 3.265 5.254 . 0 0 "[ . 1 . 2]" 1
501 1 21 MET ME 1 25 GLU H . . 6.150 5.061 4.333 6.161 0.011 11 0 "[ . 1 . 2]" 1
502 1 21 MET ME 1 25 GLU HA . . 6.150 4.412 3.619 5.424 . 0 0 "[ . 1 . 2]" 1
503 1 21 MET ME 1 25 GLU HG3 . . 6.150 4.456 3.512 5.407 . 0 0 "[ . 1 . 2]" 1
504 1 21 MET ME 1 26 VAL H . . 6.150 3.832 2.944 5.119 . 0 0 "[ . 1 . 2]" 1
505 1 21 MET ME 1 26 VAL HA . . 6.150 3.131 2.093 5.149 . 0 0 "[ . 1 . 2]" 1
506 1 21 MET ME 1 26 VAL MG1 . . 6.150 4.156 2.914 5.894 . 0 0 "[ . 1 . 2]" 1
507 1 21 MET ME 1 26 VAL MG2 . . 6.150 3.187 1.993 4.355 . 0 0 "[ . 1 . 2]" 1
508 1 21 MET ME 1 29 ALA H . . 6.150 4.543 3.728 6.157 0.007 15 0 "[ . 1 . 2]" 1
509 1 21 MET ME 1 100 THR H . . 6.150 4.565 3.270 5.493 . 0 0 "[ . 1 . 2]" 1
510 1 21 MET ME 1 100 THR HA . . 6.150 3.437 2.252 4.225 . 0 0 "[ . 1 . 2]" 1
511 1 21 MET ME 1 100 THR HB . . 6.150 5.483 4.245 6.161 0.011 10 0 "[ . 1 . 2]" 1
512 1 21 MET ME 1 100 THR MG . . 6.150 5.117 4.243 5.683 . 0 0 "[ . 1 . 2]" 1
513 1 21 MET ME 1 101 MET H . . 6.150 3.862 2.616 5.017 . 0 0 "[ . 1 . 2]" 1
514 1 21 MET ME 1 101 MET HA . . 6.150 4.084 2.242 5.033 . 0 0 "[ . 1 . 2]" 1
515 1 21 MET ME 1 101 MET HG2 . . 6.150 2.605 2.023 3.929 . 0 0 "[ . 1 . 2]" 1
516 1 21 MET ME 1 101 MET HG3 . . 6.150 3.215 2.157 4.330 . 0 0 "[ . 1 . 2]" 1
517 1 21 MET ME 1 108 LEU H . . 6.150 3.852 2.913 5.278 . 0 0 "[ . 1 . 2]" 1
518 1 21 MET ME 1 108 LEU MD1 . . 6.150 3.444 2.329 4.568 . 0 0 "[ . 1 . 2]" 1
519 1 21 MET ME 1 108 LEU MD2 . . 6.150 3.363 1.904 5.369 . 0 0 "[ . 1 . 2]" 1
520 1 22 SER H 1 22 SER HB2 . . 4.180 2.454 2.158 2.736 . 0 0 "[ . 1 . 2]" 1
521 1 22 SER H 1 22 SER HB3 . . 3.900 3.592 3.178 3.786 . 0 0 "[ . 1 . 2]" 1
522 1 22 SER H 1 25 GLU HG2 . . 3.940 3.897 3.290 4.017 0.077 14 0 "[ . 1 . 2]" 1
523 1 22 SER H 1 25 GLU HG3 . . 3.330 2.458 1.926 3.155 . 0 0 "[ . 1 . 2]" 1
524 1 22 SER H 1 26 VAL MG2 . . 5.620 4.478 3.790 5.698 0.078 16 0 "[ . 1 . 2]" 1
525 1 22 SER HA 1 23 SER QB . . 6.150 4.567 4.124 4.829 . 0 0 "[ . 1 . 2]" 1
526 1 22 SER HA 1 24 VAL H . . 4.250 4.249 4.073 4.394 0.144 2 0 "[ . 1 . 2]" 1
527 1 22 SER HA 1 25 GLU H . . 6.150 4.654 4.436 4.905 . 0 0 "[ . 1 . 2]" 1
528 1 22 SER HA 1 25 GLU HG3 . . 6.150 4.610 4.233 4.997 . 0 0 "[ . 1 . 2]" 1
529 1 22 SER HB2 1 23 SER H . . 6.150 4.023 3.712 4.420 . 0 0 "[ . 1 . 2]" 1
530 1 22 SER HB2 1 23 SER HA . . 6.150 5.574 5.075 6.040 . 0 0 "[ . 1 . 2]" 1
531 1 22 SER HB2 1 23 SER QB . . 6.150 5.700 4.901 6.166 0.016 4 0 "[ . 1 . 2]" 1
532 1 22 SER HB2 1 24 VAL H . . 3.910 3.619 3.048 4.165 0.255 18 0 "[ . 1 . 2]" 1
533 1 22 SER HB2 1 24 VAL MG2 . . 6.150 5.511 4.566 6.195 0.045 18 0 "[ . 1 . 2]" 1
534 1 22 SER HB2 1 25 GLU H . . 4.580 3.059 2.322 4.210 . 0 0 "[ . 1 . 2]" 1
535 1 22 SER HB2 1 25 GLU HB3 . . 6.150 4.587 4.074 5.717 . 0 0 "[ . 1 . 2]" 1
536 1 22 SER HB2 1 25 GLU HG2 . . 6.150 2.763 2.240 4.140 . 0 0 "[ . 1 . 2]" 1
537 1 22 SER HB2 1 25 GLU HG3 . . 6.150 2.236 1.990 3.228 . 0 0 "[ . 1 . 2]" 1
538 1 22 SER HB3 1 23 SER H . . 6.150 2.925 2.531 3.549 . 0 0 "[ . 1 . 2]" 1
539 1 22 SER HB3 1 23 SER QB . . 6.150 4.652 3.863 5.101 . 0 0 "[ . 1 . 2]" 1
540 1 22 SER HB3 1 24 VAL H . . 3.080 2.832 2.421 3.092 0.012 14 0 "[ . 1 . 2]" 1
541 1 22 SER HB3 1 24 VAL MG2 . . 6.100 5.297 3.604 5.714 . 0 0 "[ . 1 . 2]" 1
542 1 22 SER HB3 1 25 GLU H . . 3.510 3.488 2.895 3.590 0.080 7 0 "[ . 1 . 2]" 1
543 1 22 SER HB3 1 25 GLU HB3 . . 6.150 5.921 5.425 6.155 0.005 10 0 "[ . 1 . 2]" 1
544 1 22 SER HB3 1 25 GLU HG2 . . 6.150 3.874 3.216 4.328 . 0 0 "[ . 1 . 2]" 1
545 1 22 SER HB3 1 25 GLU HG3 . . 6.070 3.754 3.341 3.964 . 0 0 "[ . 1 . 2]" 1
546 1 23 SER H 1 24 VAL H . . 5.010 2.967 2.749 3.178 . 0 0 "[ . 1 . 2]" 1
547 1 23 SER H 1 25 GLU H . . 5.510 4.393 4.123 4.681 . 0 0 "[ . 1 . 2]" 1
548 1 23 SER HA 1 26 VAL H . . 4.530 3.613 3.301 4.046 . 0 0 "[ . 1 . 2]" 1
549 1 23 SER HA 1 26 VAL HB . . 6.150 3.271 2.633 5.290 . 0 0 "[ . 1 . 2]" 1
550 1 23 SER HA 1 26 VAL MG1 . . 6.150 3.825 2.096 4.548 . 0 0 "[ . 1 . 2]" 1
551 1 23 SER HA 1 26 VAL MG2 . . 6.130 3.275 2.386 4.692 . 0 0 "[ . 1 . 2]" 1
552 1 23 SER HA 1 27 ASP H . . 4.100 4.011 3.705 4.143 0.043 14 0 "[ . 1 . 2]" 1
553 1 23 SER QB 1 24 VAL H . . 3.430 3.147 2.526 3.516 0.086 17 0 "[ . 1 . 2]" 1
554 1 23 SER QB 1 24 VAL MG2 . . 6.150 5.092 2.896 5.712 . 0 0 "[ . 1 . 2]" 1
555 1 24 VAL H 1 24 VAL HB . . 3.440 2.556 2.457 2.631 . 0 0 "[ . 1 . 2]" 1
556 1 24 VAL H 1 24 VAL MG1 . . 3.760 2.312 2.047 3.793 0.033 10 0 "[ . 1 . 2]" 1
557 1 24 VAL H 1 24 VAL MG2 . . 3.820 3.731 2.128 3.833 0.013 15 0 "[ . 1 . 2]" 1
558 1 24 VAL H 1 25 GLU HG2 . . 4.290 4.192 3.647 4.389 0.099 18 0 "[ . 1 . 2]" 1
559 1 24 VAL H 1 25 GLU HG3 . . 4.800 4.883 4.817 5.094 0.294 2 0 "[ . 1 . 2]" 1
560 1 24 VAL H 1 26 VAL H . . 4.440 4.039 3.794 4.259 . 0 0 "[ . 1 . 2]" 1
561 1 24 VAL H 1 27 ASP H . . 4.960 4.671 4.456 4.878 . 0 0 "[ . 1 . 2]" 1
562 1 24 VAL HA 1 27 ASP H . . 6.150 3.425 3.094 3.762 . 0 0 "[ . 1 . 2]" 1
563 1 24 VAL HA 1 27 ASP HA . . 6.150 5.285 4.977 5.741 . 0 0 "[ . 1 . 2]" 1
564 1 24 VAL HA 1 27 ASP HB2 . . 6.150 2.823 2.150 3.457 . 0 0 "[ . 1 . 2]" 1
565 1 24 VAL HA 1 27 ASP HB3 . . 6.150 3.072 2.349 3.806 . 0 0 "[ . 1 . 2]" 1
566 1 24 VAL HA 1 28 LYS H . . 4.840 3.790 3.565 4.191 . 0 0 "[ . 1 . 2]" 1
567 1 24 VAL HB 1 25 GLU H . . 4.020 3.878 2.675 4.043 0.023 4 0 "[ . 1 . 2]" 1
568 1 24 VAL HB 1 27 ASP HB2 . . 6.150 5.315 4.644 5.938 . 0 0 "[ . 1 . 2]" 1
569 1 24 VAL HB 1 27 ASP HB3 . . 6.150 5.470 4.729 6.176 0.026 17 0 "[ . 1 . 2]" 1
570 1 24 VAL MG1 1 25 GLU H . . 3.760 2.346 2.109 3.614 . 0 0 "[ . 1 . 2]" 1
571 1 24 VAL MG1 1 28 LYS H . . 4.630 4.671 4.214 4.715 0.085 11 0 "[ . 1 . 2]" 1
572 1 24 VAL MG2 1 25 GLU H . . 3.850 3.892 3.848 3.943 0.093 2 0 "[ . 1 . 2]" 1
573 1 24 VAL MG2 1 25 GLU HA . . 6.150 4.173 3.948 5.496 . 0 0 "[ . 1 . 2]" 1
574 1 24 VAL MG2 1 25 GLU HB2 . . 6.150 5.758 5.623 6.013 . 0 0 "[ . 1 . 2]" 1
575 1 24 VAL MG2 1 25 GLU HG2 . . 6.150 4.344 4.151 4.689 . 0 0 "[ . 1 . 2]" 1
576 1 24 VAL MG2 1 25 GLU HG3 . . 6.150 5.724 5.548 5.983 . 0 0 "[ . 1 . 2]" 1
577 1 24 VAL MG2 1 27 ASP HB2 . . 6.150 4.185 3.489 4.794 . 0 0 "[ . 1 . 2]" 1
578 1 24 VAL MG2 1 27 ASP HB3 . . 6.150 3.743 3.177 4.923 . 0 0 "[ . 1 . 2]" 1
579 1 24 VAL MG2 1 28 LYS HD2 . . 6.150 5.340 2.956 5.876 . 0 0 "[ . 1 . 2]" 1
580 1 24 VAL MG2 1 28 LYS QE . . 6.150 5.111 3.510 6.154 0.004 13 0 "[ . 1 . 2]" 1
581 1 25 GLU H 1 25 GLU HB2 . . 3.230 2.502 2.386 2.688 . 0 0 "[ . 1 . 2]" 1
582 1 25 GLU H 1 25 GLU HB3 . . 3.810 3.590 3.484 3.646 . 0 0 "[ . 1 . 2]" 1
583 1 25 GLU H 1 25 GLU HG2 . . 3.160 2.345 2.013 2.646 . 0 0 "[ . 1 . 2]" 1
584 1 25 GLU H 1 25 GLU HG3 . . 3.290 3.126 2.878 3.346 0.056 2 0 "[ . 1 . 2]" 1
585 1 25 GLU H 1 26 VAL H . . 3.050 2.548 2.405 2.773 . 0 0 "[ . 1 . 2]" 1
586 1 25 GLU H 1 26 VAL HA . . 5.710 5.201 5.092 5.382 . 0 0 "[ . 1 . 2]" 1
587 1 25 GLU H 1 26 VAL HB . . 6.150 4.886 4.289 5.701 . 0 0 "[ . 1 . 2]" 1
588 1 25 GLU H 1 27 ASP H . . 4.570 4.091 3.880 4.349 . 0 0 "[ . 1 . 2]" 1
589 1 25 GLU H 1 27 ASP HB3 . . 6.150 5.554 4.713 6.187 0.037 12 0 "[ . 1 . 2]" 1
590 1 25 GLU H 1 28 LYS HD2 . . 5.940 5.784 5.246 6.032 0.092 18 0 "[ . 1 . 2]" 1
591 1 25 GLU HA 1 28 LYS H . . 4.020 3.565 3.220 3.769 . 0 0 "[ . 1 . 2]" 1
592 1 25 GLU HA 1 28 LYS HG2 . . 6.150 4.586 2.834 5.453 . 0 0 "[ . 1 . 2]" 1
593 1 25 GLU HA 1 28 LYS HG3 . . 6.150 3.883 2.051 5.625 . 0 0 "[ . 1 . 2]" 1
594 1 25 GLU HA 1 28 LYS QB . . 6.150 2.986 2.151 4.235 . 0 0 "[ . 1 . 2]" 1
595 1 25 GLU HB2 1 26 VAL MG1 . . 6.150 5.131 3.227 5.645 . 0 0 "[ . 1 . 2]" 1
596 1 25 GLU HB2 1 27 ASP H . . 5.710 5.142 4.939 5.269 . 0 0 "[ . 1 . 2]" 1
597 1 25 GLU HB2 1 29 ALA H . . 5.770 5.484 5.267 5.657 . 0 0 "[ . 1 . 2]" 1
598 1 25 GLU HB3 1 26 VAL MG1 . . 6.150 5.825 4.280 6.190 0.040 11 0 "[ . 1 . 2]" 1
599 1 25 GLU HB3 1 29 ALA H . . 5.490 4.900 4.669 5.099 . 0 0 "[ . 1 . 2]" 1
600 1 25 GLU HB3 1 101 MET HG2 . . 6.150 4.486 2.766 5.668 . 0 0 "[ . 1 . 2]" 1
601 1 25 GLU HG2 1 26 VAL H . . 4.460 4.354 4.038 4.499 0.039 7 0 "[ . 1 . 2]" 1
602 1 25 GLU HG3 1 26 VAL H . . 4.450 4.478 4.358 4.550 0.100 2 0 "[ . 1 . 2]" 1
603 1 26 VAL H 1 26 VAL HB . . 3.140 2.660 2.319 3.155 0.015 16 0 "[ . 1 . 2]" 1
604 1 26 VAL H 1 26 VAL MG1 . . 3.890 3.473 1.917 3.866 . 0 0 "[ . 1 . 2]" 1
605 1 26 VAL H 1 26 VAL MG2 . . 3.780 2.447 1.908 3.813 0.033 19 0 "[ . 1 . 2]" 1
606 1 26 VAL H 1 27 ASP H . . 3.290 2.794 2.534 3.014 . 0 0 "[ . 1 . 2]" 1
607 1 26 VAL H 1 27 ASP HB2 . . 6.150 4.738 4.296 5.161 . 0 0 "[ . 1 . 2]" 1
608 1 26 VAL H 1 29 ALA MB . . 4.420 4.425 4.332 4.460 0.040 1 0 "[ . 1 . 2]" 1
609 1 26 VAL H 1 108 LEU MD1 . . 6.150 5.633 4.453 6.287 0.137 16 0 "[ . 1 . 2]" 1
610 1 26 VAL HA 1 28 LYS HD2 . . 6.150 5.807 5.121 6.318 0.168 10 0 "[ . 1 . 2]" 1
611 1 26 VAL HA 1 29 ALA H . . 4.580 3.368 2.641 3.607 . 0 0 "[ . 1 . 2]" 1
612 1 26 VAL HA 1 29 ALA HA . . 6.150 5.242 4.552 5.448 . 0 0 "[ . 1 . 2]" 1
613 1 26 VAL HA 1 29 ALA MB . . 6.150 2.363 2.036 2.491 . 0 0 "[ . 1 . 2]" 1
614 1 26 VAL HA 1 108 LEU HB3 . . 6.150 4.421 3.655 4.790 . 0 0 "[ . 1 . 2]" 1
615 1 26 VAL HA 1 108 LEU MD1 . . 6.150 3.632 2.256 4.573 . 0 0 "[ . 1 . 2]" 1
616 1 26 VAL HB 1 27 ASP H . . 4.360 2.870 2.394 4.383 0.023 14 0 "[ . 1 . 2]" 1
617 1 26 VAL MG1 1 27 ASP H . . 4.010 3.289 2.182 3.829 . 0 0 "[ . 1 . 2]" 1
618 1 26 VAL MG1 1 29 ALA H . . 5.980 4.854 4.508 5.427 . 0 0 "[ . 1 . 2]" 1
619 1 26 VAL MG1 1 108 LEU HB3 . . 6.150 5.032 4.232 6.159 0.009 16 0 "[ . 1 . 2]" 1
620 1 26 VAL MG1 1 108 LEU MD1 . . 5.520 2.979 1.948 4.850 . 0 0 "[ . 1 . 2]" 1
621 1 26 VAL MG2 1 27 ASP H . . 4.190 3.786 2.853 3.998 . 0 0 "[ . 1 . 2]" 1
622 1 26 VAL MG2 1 29 ALA H . . 5.180 5.103 4.453 5.227 0.047 18 0 "[ . 1 . 2]" 1
623 1 26 VAL MG2 1 29 ALA MB . . 5.640 3.899 2.914 4.181 . 0 0 "[ . 1 . 2]" 1
624 1 26 VAL MG2 1 30 VAL H . . 5.760 5.419 3.883 5.807 0.047 6 0 "[ . 1 . 2]" 1
625 1 26 VAL MG2 1 108 LEU MD1 . . 4.620 2.935 1.981 4.019 . 0 0 "[ . 1 . 2]" 1
626 1 26 VAL MG2 1 108 LEU MD2 . . 6.150 3.180 1.976 5.050 . 0 0 "[ . 1 . 2]" 1
627 1 27 ASP H 1 27 ASP HB2 . . 3.880 2.181 2.070 2.377 . 0 0 "[ . 1 . 2]" 1
628 1 27 ASP H 1 27 ASP HB3 . . 3.760 3.002 2.562 3.551 . 0 0 "[ . 1 . 2]" 1
629 1 27 ASP H 1 28 LYS H . . 3.420 2.985 2.818 3.251 . 0 0 "[ . 1 . 2]" 1
630 1 27 ASP H 1 28 LYS QB . . 5.620 4.766 4.357 5.381 . 0 0 "[ . 1 . 2]" 1
631 1 27 ASP H 1 29 ALA H . . 4.580 4.186 4.091 4.417 . 0 0 "[ . 1 . 2]" 1
632 1 27 ASP H 1 30 VAL MG2 . . 4.930 4.401 4.144 4.929 . 0 0 "[ . 1 . 2]" 1
633 1 27 ASP HA 1 30 VAL H . . 4.200 3.604 3.384 4.023 . 0 0 "[ . 1 . 2]" 1
634 1 27 ASP HB2 1 28 LYS H . . 3.440 3.331 2.591 3.536 0.096 4 0 "[ . 1 . 2]" 1
635 1 27 ASP HB2 1 29 ALA H . . 6.120 5.480 5.019 5.659 . 0 0 "[ . 1 . 2]" 1
636 1 27 ASP HB3 1 28 LYS H . . 3.460 2.498 2.010 3.076 . 0 0 "[ . 1 . 2]" 1
637 1 28 LYS H 1 28 LYS HD2 . . 4.270 3.902 2.118 4.390 0.120 18 0 "[ . 1 . 2]" 1
638 1 28 LYS H 1 28 LYS HD3 . . 4.910 4.679 3.007 5.007 0.097 1 0 "[ . 1 . 2]" 1
639 1 28 LYS H 1 28 LYS HG2 . . 4.600 4.222 3.285 4.553 . 0 0 "[ . 1 . 2]" 1
640 1 28 LYS H 1 28 LYS HG3 . . 4.760 3.888 2.263 4.616 . 0 0 "[ . 1 . 2]" 1
641 1 28 LYS H 1 28 LYS QB . . 2.710 2.219 1.995 2.536 . 0 0 "[ . 1 . 2]" 1
642 1 28 LYS H 1 28 LYS QE . . 5.750 5.232 4.195 5.789 0.039 17 0 "[ . 1 . 2]" 1
643 1 28 LYS H 1 29 ALA H . . 3.140 2.845 2.661 3.015 . 0 0 "[ . 1 . 2]" 1
644 1 28 LYS H 1 30 VAL H . . 4.800 4.432 4.133 4.634 . 0 0 "[ . 1 . 2]" 1
645 1 28 LYS HA 1 28 LYS QE . . 6.150 5.108 3.879 5.599 . 0 0 "[ . 1 . 2]" 1
646 1 28 LYS HA 1 31 GLU H . . 4.120 3.246 2.729 3.575 . 0 0 "[ . 1 . 2]" 1
647 1 28 LYS HA 1 31 GLU HB2 . . 6.150 3.593 2.235 4.497 . 0 0 "[ . 1 . 2]" 1
648 1 28 LYS HA 1 31 GLU HB3 . . 6.150 3.068 2.070 4.515 . 0 0 "[ . 1 . 2]" 1
649 1 28 LYS HA 1 31 GLU HG3 . . 4.960 3.230 2.199 4.048 . 0 0 "[ . 1 . 2]" 1
650 1 28 LYS HD2 1 29 ALA H . . 5.020 3.256 2.648 4.676 . 0 0 "[ . 1 . 2]" 1
651 1 28 LYS HD2 1 31 GLU H . . 6.150 6.176 5.909 6.255 0.105 11 0 "[ . 1 . 2]" 1
652 1 28 LYS HD3 1 101 MET ME . . 5.870 3.439 2.686 5.476 . 0 0 "[ . 1 . 2]" 1
653 1 28 LYS HD3 1 28 LYS HG2 . . 2.980 2.451 2.257 3.013 0.033 18 0 "[ . 1 . 2]" 1
654 1 28 LYS HG2 1 101 MET ME . . 6.150 5.017 4.431 6.023 . 0 0 "[ . 1 . 2]" 1
655 1 28 LYS HG3 1 31 GLU HG3 . . 6.150 5.747 4.325 6.172 0.022 3 0 "[ . 1 . 2]" 1
656 1 28 LYS HG3 1 101 MET ME . . 5.420 5.131 3.984 5.437 0.017 11 0 "[ . 1 . 2]" 1
657 1 28 LYS QB 1 29 ALA H . . 3.650 3.147 2.555 3.728 0.078 2 0 "[ . 1 . 2]" 1
658 1 28 LYS QB 1 30 VAL H . . 5.350 5.121 4.808 5.384 0.034 12 0 "[ . 1 . 2]" 1
659 1 28 LYS QB 1 31 GLU H . . 5.120 4.893 4.357 5.140 0.020 15 0 "[ . 1 . 2]" 1
660 1 29 ALA H 1 29 ALA MB . . 3.120 2.219 2.160 2.328 . 0 0 "[ . 1 . 2]" 1
661 1 29 ALA H 1 30 VAL H . . 3.030 2.801 2.425 3.010 . 0 0 "[ . 1 . 2]" 1
662 1 29 ALA H 1 30 VAL MG1 . . 5.020 4.580 4.380 5.058 0.038 15 0 "[ . 1 . 2]" 1
663 1 29 ALA H 1 30 VAL MG2 . . 5.250 4.405 4.194 4.745 . 0 0 "[ . 1 . 2]" 1
664 1 29 ALA H 1 32 MET ME . . 6.150 5.414 4.934 6.085 . 0 0 "[ . 1 . 2]" 1
665 1 29 ALA HA 1 31 GLU H . . 4.550 4.424 4.176 4.561 0.011 3 0 "[ . 1 . 2]" 1
666 1 29 ALA HA 1 32 MET H . . 6.150 4.023 3.731 4.505 . 0 0 "[ . 1 . 2]" 1
667 1 29 ALA HA 1 32 MET HB2 . . 6.150 4.019 3.506 4.690 . 0 0 "[ . 1 . 2]" 1
668 1 29 ALA HA 1 32 MET HB3 . . 6.120 5.480 5.022 6.058 . 0 0 "[ . 1 . 2]" 1
669 1 29 ALA HA 1 32 MET HG2 . . 6.150 4.678 3.721 5.025 . 0 0 "[ . 1 . 2]" 1
670 1 29 ALA HA 1 32 MET ME . . 6.150 3.681 3.098 4.290 . 0 0 "[ . 1 . 2]" 1
671 1 29 ALA HA 1 101 MET ME . . 6.150 2.747 2.319 3.961 . 0 0 "[ . 1 . 2]" 1
672 1 29 ALA HA 1 109 PHE HB2 . . 6.150 2.865 2.372 3.410 . 0 0 "[ . 1 . 2]" 1
673 1 29 ALA HA 1 109 PHE HB3 . . 6.150 4.473 3.989 5.004 . 0 0 "[ . 1 . 2]" 1
674 1 29 ALA MB 1 30 VAL H . . 2.970 2.694 2.453 2.887 . 0 0 "[ . 1 . 2]" 1
675 1 29 ALA MB 1 30 VAL HA . . 6.150 4.006 3.874 4.136 . 0 0 "[ . 1 . 2]" 1
676 1 29 ALA MB 1 31 GLU H . . 4.680 4.628 4.520 4.700 0.020 11 0 "[ . 1 . 2]" 1
677 1 29 ALA MB 1 32 MET H . . 6.150 5.092 4.855 5.359 . 0 0 "[ . 1 . 2]" 1
678 1 29 ALA MB 1 32 MET HB2 . . 6.150 5.046 4.761 5.357 . 0 0 "[ . 1 . 2]" 1
679 1 29 ALA MB 1 32 MET HG2 . . 6.150 5.949 5.128 6.188 0.038 1 0 "[ . 1 . 2]" 1
680 1 29 ALA MB 1 101 MET HA . . 6.150 5.137 3.376 6.124 . 0 0 "[ . 1 . 2]" 1
681 1 29 ALA MB 1 101 MET HB3 . . 6.150 5.327 4.367 6.187 0.037 8 0 "[ . 1 . 2]" 1
682 1 29 ALA MB 1 108 LEU HG . . 5.610 3.885 2.259 4.605 . 0 0 "[ . 1 . 2]" 1
683 1 29 ALA MB 1 108 LEU MD1 . . 5.050 3.466 2.045 4.214 . 0 0 "[ . 1 . 2]" 1
684 1 29 ALA MB 1 108 LEU MD2 . . 6.150 2.262 1.924 3.764 . 0 0 "[ . 1 . 2]" 1
685 1 29 ALA MB 1 109 PHE H . . 3.520 2.657 2.136 3.107 . 0 0 "[ . 1 . 2]" 1
686 1 29 ALA MB 1 109 PHE HA . . 6.150 3.352 2.869 3.690 . 0 0 "[ . 1 . 2]" 1
687 1 30 VAL H 1 30 VAL HB . . 3.840 3.681 1.944 3.809 . 0 0 "[ . 1 . 2]" 1
688 1 30 VAL H 1 30 VAL MG1 . . 3.290 2.444 2.250 3.326 0.036 15 0 "[ . 1 . 2]" 1
689 1 30 VAL H 1 30 VAL MG2 . . 3.170 2.377 2.226 2.914 . 0 0 "[ . 1 . 2]" 1
690 1 30 VAL H 1 31 GLU H . . 2.830 2.700 2.532 2.830 0.000 13 0 "[ . 1 . 2]" 1
691 1 30 VAL H 1 32 MET H . . 4.700 4.556 4.222 4.711 0.011 18 0 "[ . 1 . 2]" 1
692 1 30 VAL H 1 112 ALA MB . . 6.150 4.780 4.408 5.168 . 0 0 "[ . 1 . 2]" 1
693 1 30 VAL HA 1 33 ALA H . . 4.100 3.315 2.872 3.589 . 0 0 "[ . 1 . 2]" 1
694 1 30 VAL HA 1 33 ALA HA . . 6.150 5.420 5.101 5.668 . 0 0 "[ . 1 . 2]" 1
695 1 30 VAL HA 1 33 ALA MB . . 6.150 2.737 2.508 2.950 . 0 0 "[ . 1 . 2]" 1
696 1 30 VAL HA 1 109 PHE QD . . 6.150 4.401 3.778 4.913 . 0 0 "[ . 1 . 2]" 1
697 1 30 VAL HA 1 116 PHE QE . . 6.150 3.691 3.134 4.721 . 0 0 "[ . 1 . 2]" 1
698 1 30 VAL MG1 1 31 GLU H . . 4.150 4.099 2.470 4.246 0.096 9 0 "[ . 1 . 2]" 1
699 1 30 VAL MG1 1 33 ALA MB . . 6.150 3.828 3.395 4.101 . 0 0 "[ . 1 . 2]" 1
700 1 30 VAL MG2 1 31 GLU H . . 3.990 2.689 2.427 4.116 0.126 15 0 "[ . 1 . 2]" 1
701 1 30 VAL MG2 1 31 GLU HA . . 6.150 3.422 3.132 5.033 . 0 0 "[ . 1 . 2]" 1
702 1 30 VAL MG2 1 32 MET H . . 5.460 4.835 4.679 5.467 0.007 15 0 "[ . 1 . 2]" 1
703 1 30 VAL MG2 1 33 ALA H . . 5.070 5.014 4.818 5.096 0.026 12 0 "[ . 1 . 2]" 1
704 1 30 VAL MG2 1 33 ALA MB . . 5.110 4.474 3.563 4.698 . 0 0 "[ . 1 . 2]" 1
705 1 30 VAL MG2 1 34 LEU MD1 . . 6.150 3.101 2.305 4.281 . 0 0 "[ . 1 . 2]" 1
706 1 31 GLU H 1 31 GLU HB2 . . 3.290 3.010 1.980 3.431 0.141 1 0 "[ . 1 . 2]" 1
707 1 31 GLU H 1 31 GLU HB3 . . 3.520 2.536 2.021 3.591 0.071 17 0 "[ . 1 . 2]" 1
708 1 31 GLU H 1 31 GLU HG2 . . 3.660 3.288 2.051 3.744 0.084 9 0 "[ . 1 . 2]" 1
709 1 31 GLU H 1 31 GLU HG3 . . 4.160 3.370 2.665 4.201 0.041 11 0 "[ . 1 . 2]" 1
710 1 31 GLU H 1 32 MET H . . 3.120 2.849 2.627 3.087 . 0 0 "[ . 1 . 2]" 1
711 1 31 GLU H 1 32 MET HG2 . . 4.860 4.875 4.553 4.953 0.093 9 0 "[ . 1 . 2]" 1
712 1 31 GLU H 1 32 MET ME . . 6.150 5.892 5.380 6.172 0.022 19 0 "[ . 1 . 2]" 1
713 1 31 GLU HA 1 32 MET HA . . 6.150 4.827 4.629 4.979 . 0 0 "[ . 1 . 2]" 1
714 1 31 GLU HA 1 34 LEU H . . 6.150 3.470 3.091 3.905 . 0 0 "[ . 1 . 2]" 1
715 1 31 GLU HA 1 34 LEU HB2 . . 6.150 3.316 2.780 5.142 . 0 0 "[ . 1 . 2]" 1
716 1 31 GLU HA 1 34 LEU MD1 . . 6.150 2.129 2.008 2.474 . 0 0 "[ . 1 . 2]" 1
717 1 31 GLU HB2 1 32 MET H . . 6.150 3.669 2.282 4.434 . 0 0 "[ . 1 . 2]" 1
718 1 31 GLU HB3 1 32 MET H . . 6.150 3.523 2.410 4.055 . 0 0 "[ . 1 . 2]" 1
719 1 31 GLU HG2 1 32 MET HA . . 6.150 5.519 3.961 6.277 0.127 17 0 "[ . 1 . 2]" 1
720 1 31 GLU HG3 1 32 MET H . . 6.150 3.208 1.967 4.942 . 0 0 "[ . 1 . 2]" 1
721 1 31 GLU HG3 1 32 MET HA . . 6.150 4.620 3.467 6.196 0.046 12 0 "[ . 1 . 2]" 1
722 1 32 MET H 1 32 MET HB2 . . 3.120 2.575 2.480 2.660 . 0 0 "[ . 1 . 2]" 1
723 1 32 MET H 1 32 MET HB3 . . 4.200 3.563 3.505 3.637 . 0 0 "[ . 1 . 2]" 1
724 1 32 MET H 1 32 MET HG2 . . 3.490 2.466 2.042 2.662 . 0 0 "[ . 1 . 2]" 1
725 1 32 MET H 1 32 MET HG3 . . 4.120 2.476 1.997 3.296 . 0 0 "[ . 1 . 2]" 1
726 1 32 MET H 1 32 MET ME . . 6.150 4.290 4.081 4.524 . 0 0 "[ . 1 . 2]" 1
727 1 32 MET H 1 33 ALA H . . 3.090 2.724 2.526 2.858 . 0 0 "[ . 1 . 2]" 1
728 1 32 MET HA 1 32 MET ME . . 6.150 4.618 4.329 4.895 . 0 0 "[ . 1 . 2]" 1
729 1 32 MET HA 1 35 GLN H . . 4.700 3.590 3.205 4.118 . 0 0 "[ . 1 . 2]" 1
730 1 32 MET HA 1 35 GLN HB2 . . 5.580 3.515 2.707 4.184 . 0 0 "[ . 1 . 2]" 1
731 1 32 MET HA 1 35 GLN HB3 . . 6.150 2.894 2.369 3.524 . 0 0 "[ . 1 . 2]" 1
732 1 32 MET HA 1 35 GLN HG2 . . 5.820 5.007 3.891 5.847 0.027 11 0 "[ . 1 . 2]" 1
733 1 32 MET HA 1 35 GLN HG3 . . 6.150 4.890 4.032 5.885 . 0 0 "[ . 1 . 2]" 1
734 1 32 MET HA 1 109 PHE QD . . 5.770 5.342 4.999 5.677 . 0 0 "[ . 1 . 2]" 1
735 1 32 MET HB2 1 33 ALA H . . 3.210 2.843 2.485 3.022 . 0 0 "[ . 1 . 2]" 1
736 1 32 MET HB2 1 34 LEU H . . 5.600 5.229 4.906 5.609 0.009 9 0 "[ . 1 . 2]" 1
737 1 32 MET HB2 1 144 PHE QE . . 6.150 5.882 5.455 6.167 0.017 3 0 "[ . 1 . 2]" 1
738 1 32 MET HB3 1 33 ALA H . . 3.890 3.903 3.677 3.980 0.090 7 0 "[ . 1 . 2]" 1
739 1 32 MET HB3 1 144 PHE QE . . 6.150 5.635 5.308 6.012 . 0 0 "[ . 1 . 2]" 1
740 1 32 MET HG2 1 33 ALA H . . 4.780 4.623 4.263 4.729 . 0 0 "[ . 1 . 2]" 1
741 1 32 MET HG3 1 33 ALA H . . 4.490 4.410 4.069 4.604 0.114 8 0 "[ . 1 . 2]" 1
742 1 32 MET ME 1 109 PHE HB2 . . 6.150 4.267 3.099 5.257 . 0 0 "[ . 1 . 2]" 1
743 1 32 MET ME 1 109 PHE QD . . 6.150 3.473 2.369 4.590 . 0 0 "[ . 1 . 2]" 1
744 1 32 MET ME 1 109 PHE QE . . 6.150 3.612 2.532 4.867 . 0 0 "[ . 1 . 2]" 1
745 1 32 MET ME 1 142 TYR QE . . 6.150 6.139 5.890 6.190 0.040 10 0 "[ . 1 . 2]" 1
746 1 33 ALA H 1 33 ALA HA . . 2.800 2.873 2.850 2.888 0.088 8 0 "[ . 1 . 2]" 1
747 1 33 ALA H 1 33 ALA MB . . 3.190 2.211 2.112 2.301 . 0 0 "[ . 1 . 2]" 1
748 1 33 ALA H 1 34 LEU H . . 3.090 2.597 2.410 2.947 . 0 0 "[ . 1 . 2]" 1
749 1 33 ALA H 1 34 LEU HG . . 3.780 3.837 3.797 3.872 0.092 8 0 "[ . 1 . 2]" 1
750 1 33 ALA H 1 35 GLN H . . 4.310 4.106 3.914 4.271 . 0 0 "[ . 1 . 2]" 1
751 1 33 ALA H 1 36 ALA H . . 5.130 4.759 4.592 4.987 . 0 0 "[ . 1 . 2]" 1
752 1 33 ALA H 1 109 PHE QD . . 3.780 3.378 3.161 3.794 0.014 8 0 "[ . 1 . 2]" 1
753 1 33 ALA H 1 112 ALA MB . . 4.310 4.260 3.934 4.359 0.049 13 0 "[ . 1 . 2]" 1
754 1 33 ALA H 1 113 ALA MB . . 5.050 4.511 4.210 4.790 . 0 0 "[ . 1 . 2]" 1
755 1 33 ALA H 1 116 PHE QD . . 5.610 5.318 4.996 5.637 0.027 17 0 "[ . 1 . 2]" 1
756 1 33 ALA HA 1 35 GLN H . . 4.810 4.504 4.195 4.715 . 0 0 "[ . 1 . 2]" 1
757 1 33 ALA HA 1 36 ALA H . . 3.690 3.408 3.194 3.699 0.009 9 0 "[ . 1 . 2]" 1
758 1 33 ALA HA 1 109 PHE QD . . 6.150 3.477 3.001 3.840 . 0 0 "[ . 1 . 2]" 1
759 1 33 ALA HA 1 109 PHE QE . . 5.610 2.488 2.174 2.934 . 0 0 "[ . 1 . 2]" 1
760 1 33 ALA HA 1 113 ALA H . . 5.090 4.410 3.840 4.768 . 0 0 "[ . 1 . 2]" 1
761 1 33 ALA HA 1 113 ALA MB . . 5.930 2.420 2.217 2.752 . 0 0 "[ . 1 . 2]" 1
762 1 33 ALA MB 1 34 LEU H . . 2.900 2.698 2.378 2.918 0.018 19 0 "[ . 1 . 2]" 1
763 1 33 ALA MB 1 35 GLN H . . 5.070 4.658 4.370 4.844 . 0 0 "[ . 1 . 2]" 1
764 1 33 ALA MB 1 37 TRP H . . 5.230 5.193 4.965 5.265 0.035 6 0 "[ . 1 . 2]" 1
765 1 33 ALA MB 1 109 PHE HA . . 5.890 3.403 2.889 3.839 . 0 0 "[ . 1 . 2]" 1
766 1 33 ALA MB 1 109 PHE QD . . 5.680 2.385 2.125 2.941 . 0 0 "[ . 1 . 2]" 1
767 1 33 ALA MB 1 109 PHE QE . . 6.150 3.237 2.642 3.883 . 0 0 "[ . 1 . 2]" 1
768 1 33 ALA MB 1 112 ALA MB . . 5.140 2.320 2.028 2.518 . 0 0 "[ . 1 . 2]" 1
769 1 33 ALA MB 1 113 ALA H . . 3.800 2.730 2.500 2.992 . 0 0 "[ . 1 . 2]" 1
770 1 33 ALA MB 1 113 ALA HA . . 5.220 2.145 1.982 2.456 . 0 0 "[ . 1 . 2]" 1
771 1 33 ALA MB 1 113 ALA MB . . 6.150 2.350 2.038 2.938 . 0 0 "[ . 1 . 2]" 1
772 1 33 ALA MB 1 116 PHE QD . . 6.150 2.369 2.079 2.786 . 0 0 "[ . 1 . 2]" 1
773 1 34 LEU H 1 34 LEU HB2 . . 3.040 2.653 2.404 3.244 0.204 9 0 "[ . 1 . 2]" 1
774 1 34 LEU H 1 34 LEU HB3 . . 3.930 3.499 2.346 3.601 . 0 0 "[ . 1 . 2]" 1
775 1 34 LEU H 1 34 LEU HG . . 2.730 1.892 1.769 2.047 . 0 0 "[ . 1 . 2]" 1
776 1 34 LEU H 1 34 LEU MD1 . . 3.380 3.428 3.302 3.459 0.079 17 0 "[ . 1 . 2]" 1
777 1 34 LEU H 1 34 LEU MD2 . . 3.520 3.016 2.665 3.347 . 0 0 "[ . 1 . 2]" 1
778 1 34 LEU H 1 35 GLN H . . 2.950 2.671 2.523 2.915 . 0 0 "[ . 1 . 2]" 1
779 1 34 LEU H 1 36 ALA H . . 4.750 4.213 3.947 4.542 . 0 0 "[ . 1 . 2]" 1
780 1 34 LEU H 1 116 PHE QD . . 5.030 4.516 3.960 4.898 . 0 0 "[ . 1 . 2]" 1
781 1 34 LEU H 1 116 PHE QE . . 4.290 3.858 2.802 4.339 0.049 3 0 "[ . 1 . 2]" 1
782 1 34 LEU HA 1 36 ALA H . . 5.070 4.506 4.244 4.902 . 0 0 "[ . 1 . 2]" 1
783 1 34 LEU HA 1 37 TRP H . . 4.290 3.844 3.608 4.191 . 0 0 "[ . 1 . 2]" 1
784 1 34 LEU HA 1 37 TRP HD1 . . 6.150 2.986 2.290 3.457 . 0 0 "[ . 1 . 2]" 1
785 1 34 LEU HA 1 116 PHE QD . . 6.150 4.082 3.299 4.805 . 0 0 "[ . 1 . 2]" 1
786 1 34 LEU HB2 1 35 GLN H . . 4.050 2.424 2.225 3.756 . 0 0 "[ . 1 . 2]" 1
787 1 34 LEU HB3 1 35 GLN H . . 4.020 3.633 3.456 4.075 0.055 9 0 "[ . 1 . 2]" 1
788 1 34 LEU HB3 1 45 PHE H . . 5.440 4.075 3.304 5.465 0.025 9 0 "[ . 1 . 2]" 1
789 1 34 LEU HB3 1 45 PHE QD . . 6.150 2.326 2.077 3.716 . 0 0 "[ . 1 . 2]" 1
790 1 34 LEU HG 1 35 GLN H . . 4.000 3.807 2.469 4.066 0.066 13 0 "[ . 1 . 2]" 1
791 1 34 LEU HG 1 37 TRP HD1 . . 6.150 5.768 5.159 6.182 0.032 3 0 "[ . 1 . 2]" 1
792 1 34 LEU HG 1 45 PHE QD . . 6.150 4.719 4.125 5.170 . 0 0 "[ . 1 . 2]" 1
793 1 34 LEU MD1 1 35 GLN H . . 4.520 4.051 2.701 4.400 . 0 0 "[ . 1 . 2]" 1
794 1 34 LEU MD1 1 45 PHE H . . 5.120 4.471 3.333 5.061 . 0 0 "[ . 1 . 2]" 1
795 1 34 LEU MD1 1 45 PHE HA . . 6.150 4.961 4.442 5.556 . 0 0 "[ . 1 . 2]" 1
796 1 34 LEU MD1 1 45 PHE HB2 . . 6.150 2.703 2.098 3.375 . 0 0 "[ . 1 . 2]" 1
797 1 34 LEU MD1 1 45 PHE HB3 . . 6.150 3.134 2.451 3.896 . 0 0 "[ . 1 . 2]" 1
798 1 34 LEU MD1 1 45 PHE QD . . 6.150 3.800 3.423 4.140 . 0 0 "[ . 1 . 2]" 1
799 1 34 LEU MD1 1 55 ILE MD . . 6.150 5.987 5.571 6.182 0.032 13 0 "[ . 1 . 2]" 1
800 1 34 LEU MD1 1 57 ILE MD . . 6.150 5.234 4.523 6.174 0.024 9 0 "[ . 1 . 2]" 1
801 1 34 LEU MD2 1 35 GLN H . . 5.030 4.562 4.137 4.681 . 0 0 "[ . 1 . 2]" 1
802 1 34 LEU MD2 1 37 TRP HD1 . . 6.150 4.150 3.524 5.720 . 0 0 "[ . 1 . 2]" 1
803 1 34 LEU MD2 1 45 PHE HB2 . . 6.150 2.629 2.128 3.268 . 0 0 "[ . 1 . 2]" 1
804 1 34 LEU MD2 1 45 PHE HB3 . . 6.150 2.471 2.090 3.171 . 0 0 "[ . 1 . 2]" 1
805 1 34 LEU MD2 1 45 PHE QD . . 6.150 2.850 2.216 4.019 . 0 0 "[ . 1 . 2]" 1
806 1 34 LEU MD2 1 45 PHE QE . . 6.150 3.532 3.018 5.058 . 0 0 "[ . 1 . 2]" 1
807 1 34 LEU MD2 1 55 ILE MD . . 6.150 4.454 3.884 5.411 . 0 0 "[ . 1 . 2]" 1
808 1 34 LEU MD2 1 116 PHE QD . . 6.150 3.222 2.583 4.357 . 0 0 "[ . 1 . 2]" 1
809 1 34 LEU MD2 1 116 PHE QE . . 6.150 2.507 2.134 3.002 . 0 0 "[ . 1 . 2]" 1
810 1 35 GLN H 1 35 GLN HB2 . . 3.730 2.356 2.098 2.485 . 0 0 "[ . 1 . 2]" 1
811 1 35 GLN H 1 35 GLN HB3 . . 3.410 2.631 2.436 2.939 . 0 0 "[ . 1 . 2]" 1
812 1 35 GLN H 1 35 GLN HE21 . . 5.540 5.233 4.806 5.587 0.047 3 0 "[ . 1 . 2]" 1
813 1 35 GLN H 1 35 GLN HG2 . . 4.590 4.458 3.988 4.619 0.029 2 0 "[ . 1 . 2]" 1
814 1 35 GLN H 1 35 GLN HG3 . . 4.710 4.503 4.277 4.570 . 0 0 "[ . 1 . 2]" 1
815 1 35 GLN H 1 36 ALA H . . 2.990 2.857 2.634 3.004 0.014 3 0 "[ . 1 . 2]" 1
816 1 35 GLN H 1 37 TRP H . . 4.620 4.538 4.334 4.659 0.039 17 0 "[ . 1 . 2]" 1
817 1 35 GLN H 1 37 TRP HD1 . . 5.740 5.608 5.102 5.763 0.023 2 0 "[ . 1 . 2]" 1
818 1 35 GLN H 1 38 SER H . . 4.790 4.814 4.736 4.855 0.065 4 0 "[ . 1 . 2]" 1
819 1 35 GLN H 1 45 PHE QD . . 5.300 5.005 4.508 5.302 0.002 8 0 "[ . 1 . 2]" 1
820 1 35 GLN HA 1 35 GLN HE22 . . 6.150 3.967 3.078 5.207 . 0 0 "[ . 1 . 2]" 1
821 1 35 GLN HA 1 35 GLN HE21 . . 6.150 2.967 2.192 3.829 . 0 0 "[ . 1 . 2]" 1
822 1 35 GLN HA 1 37 TRP H . . 4.770 4.367 4.066 4.564 . 0 0 "[ . 1 . 2]" 1
823 1 35 GLN HA 1 38 SER H . . 3.590 3.250 3.015 3.485 . 0 0 "[ . 1 . 2]" 1
824 1 35 GLN HB2 1 36 ALA H . . 4.050 3.941 3.624 4.096 0.046 18 0 "[ . 1 . 2]" 1
825 1 35 GLN HB3 1 36 ALA H . . 4.070 2.787 2.573 3.117 . 0 0 "[ . 1 . 2]" 1
826 1 35 GLN HE21 1 39 SER H . . 4.840 3.628 3.093 4.884 0.044 20 0 "[ . 1 . 2]" 1
827 1 35 GLN HE22 1 35 GLN HG2 . . 4.010 3.835 3.526 4.061 0.051 4 0 "[ . 1 . 2]" 1
828 1 35 GLN HG2 1 36 ALA H . . 5.790 4.899 4.433 5.356 . 0 0 "[ . 1 . 2]" 1
829 1 35 GLN HG3 1 36 ALA H . . 4.930 4.550 3.928 5.055 0.125 16 0 "[ . 1 . 2]" 1
830 1 35 GLN HG3 1 39 SER H . . 6.150 5.582 4.739 6.273 0.123 16 0 "[ . 1 . 2]" 1
831 1 36 ALA H 1 36 ALA HA . . 2.780 2.800 2.766 2.844 0.064 18 0 "[ . 1 . 2]" 1
832 1 36 ALA H 1 36 ALA MB . . 2.410 2.189 2.147 2.246 . 0 0 "[ . 1 . 2]" 1
833 1 36 ALA H 1 37 TRP H . . 2.940 2.932 2.822 2.978 0.038 7 0 "[ . 1 . 2]" 1
834 1 36 ALA H 1 37 TRP HD1 . . 5.110 4.907 4.669 5.062 . 0 0 "[ . 1 . 2]" 1
835 1 36 ALA H 1 37 TRP QB . . 5.060 4.903 4.777 5.055 . 0 0 "[ . 1 . 2]" 1
836 1 36 ALA H 1 38 SER H . . 4.340 4.240 4.006 4.360 0.020 6 0 "[ . 1 . 2]" 1
837 1 36 ALA H 1 39 SER H . . 5.560 4.922 4.728 5.112 . 0 0 "[ . 1 . 2]" 1
838 1 36 ALA H 1 113 ALA MB . . 4.950 4.819 4.503 5.010 0.060 18 0 "[ . 1 . 2]" 1
839 1 36 ALA H 1 146 LEU MD1 . . 5.950 5.076 4.607 5.963 0.013 14 0 "[ . 1 . 2]" 1
840 1 36 ALA HA 1 145 HIS H . . 6.150 5.479 4.306 6.185 0.035 17 0 "[ . 1 . 2]" 1
841 1 36 ALA HA 1 146 LEU H . . 4.760 4.390 3.396 4.831 0.071 9 0 "[ . 1 . 2]" 1
842 1 36 ALA HA 1 146 LEU MD1 . . 6.150 3.925 3.312 5.000 . 0 0 "[ . 1 . 2]" 1
843 1 36 ALA HA 1 146 LEU MD2 . . 6.150 4.469 3.339 5.275 . 0 0 "[ . 1 . 2]" 1
844 1 36 ALA MB 1 37 TRP H . . 2.900 2.615 2.409 2.917 0.017 16 0 "[ . 1 . 2]" 1
845 1 36 ALA MB 1 37 TRP HD1 . . 6.150 3.888 3.657 4.237 . 0 0 "[ . 1 . 2]" 1
846 1 36 ALA MB 1 39 SER H . . 4.960 4.672 4.421 4.960 . 0 0 "[ . 1 . 2]" 1
847 1 36 ALA MB 1 113 ALA MB . . 6.150 2.925 2.530 3.281 . 0 0 "[ . 1 . 2]" 1
848 1 36 ALA MB 1 144 PHE QD . . 6.150 5.213 4.765 5.795 . 0 0 "[ . 1 . 2]" 1
849 1 36 ALA MB 1 144 PHE QE . . 6.150 4.828 4.423 5.316 . 0 0 "[ . 1 . 2]" 1
850 1 36 ALA MB 1 145 HIS H . . 5.100 4.570 3.791 5.148 0.048 16 0 "[ . 1 . 2]" 1
851 1 36 ALA MB 1 146 LEU MD1 . . 6.150 2.310 1.968 3.297 . 0 0 "[ . 1 . 2]" 1
852 1 37 TRP H 1 37 TRP HD1 . . 3.050 3.001 2.759 3.092 0.042 16 0 "[ . 1 . 2]" 1
853 1 37 TRP H 1 37 TRP QB . . 2.720 2.338 2.252 2.424 . 0 0 "[ . 1 . 2]" 1
854 1 37 TRP H 1 38 SER H . . 2.950 2.562 2.265 2.756 . 0 0 "[ . 1 . 2]" 1
855 1 37 TRP H 1 38 SER HA . . 6.150 5.228 5.023 5.343 . 0 0 "[ . 1 . 2]" 1
856 1 37 TRP H 1 39 SER H . . 4.210 3.866 3.516 4.049 . 0 0 "[ . 1 . 2]" 1
857 1 37 TRP H 1 40 ALA H . . 5.100 4.865 4.713 5.037 . 0 0 "[ . 1 . 2]" 1
858 1 37 TRP H 1 43 LEU HG . . 6.020 6.046 5.856 6.118 0.098 7 0 "[ . 1 . 2]" 1
859 1 37 TRP H 1 113 ALA MB . . 5.360 4.941 4.577 5.162 . 0 0 "[ . 1 . 2]" 1
860 1 37 TRP H 1 120 LEU MD1 . . 6.150 6.002 5.730 6.224 0.074 17 0 "[ . 1 . 2]" 1
861 1 37 TRP H 1 146 LEU MD1 . . 5.790 4.107 3.533 4.707 . 0 0 "[ . 1 . 2]" 1
862 1 37 TRP H 1 146 LEU MD2 . . 5.060 4.653 4.159 4.885 . 0 0 "[ . 1 . 2]" 1
863 1 37 TRP H 1 154 ILE MD . . 6.150 4.907 4.695 5.210 . 0 0 "[ . 1 . 2]" 1
864 1 37 TRP HA 1 39 SER H . . 4.250 3.677 3.434 3.882 . 0 0 "[ . 1 . 2]" 1
865 1 37 TRP HA 1 40 ALA H . . 3.840 2.992 2.890 3.120 . 0 0 "[ . 1 . 2]" 1
866 1 37 TRP HA 1 41 VAL H . . 4.240 4.243 3.992 4.307 0.067 9 0 "[ . 1 . 2]" 1
867 1 37 TRP HA 1 146 LEU MD1 . . 6.150 3.515 3.006 4.840 . 0 0 "[ . 1 . 2]" 1
868 1 37 TRP HA 1 146 LEU MD2 . . 6.150 3.087 2.466 3.638 . 0 0 "[ . 1 . 2]" 1
869 1 37 TRP HD1 1 45 PHE QD . . 6.150 4.672 3.739 5.787 . 0 0 "[ . 1 . 2]" 1
870 1 37 TRP HD1 1 116 PHE HA . . 6.150 5.868 5.370 6.196 0.046 2 0 "[ . 1 . 2]" 1
871 1 37 TRP HD1 1 116 PHE QB . . 6.150 3.014 2.564 3.356 . 0 0 "[ . 1 . 2]" 1
872 1 37 TRP HD1 1 116 PHE QD . . 6.150 3.541 2.483 4.398 . 0 0 "[ . 1 . 2]" 1
873 1 37 TRP HD1 1 120 LEU MD1 . . 6.150 4.446 3.931 4.785 . 0 0 "[ . 1 . 2]" 1
874 1 37 TRP HD1 1 120 LEU MD2 . . 6.150 4.086 3.571 4.465 . 0 0 "[ . 1 . 2]" 1
875 1 37 TRP HD1 1 154 ILE MD . . 5.020 4.757 4.513 4.932 . 0 0 "[ . 1 . 2]" 1
876 1 37 TRP HE1 1 113 ALA HA . . 6.150 2.493 2.145 2.725 . 0 0 "[ . 1 . 2]" 1
877 1 37 TRP HE1 1 113 ALA MB . . 6.150 3.081 2.717 3.375 . 0 0 "[ . 1 . 2]" 1
878 1 37 TRP HE1 1 117 GLY H . . 3.570 3.079 2.639 3.581 0.011 2 0 "[ . 1 . 2]" 1
879 1 37 TRP HH2 1 122 LEU HB3 . . 6.150 5.176 4.831 5.984 . 0 0 "[ . 1 . 2]" 1
880 1 37 TRP HH2 1 122 LEU HG . . 6.150 5.058 4.630 6.079 . 0 0 "[ . 1 . 2]" 1
881 1 37 TRP HH2 1 122 LEU MD1 . . 6.150 2.465 2.152 3.265 . 0 0 "[ . 1 . 2]" 1
882 1 37 TRP HH2 1 131 LEU HB2 . . 6.150 5.760 5.301 6.164 0.014 12 0 "[ . 1 . 2]" 1
883 1 37 TRP HH2 1 131 LEU HB3 . . 6.150 4.288 3.942 5.842 . 0 0 "[ . 1 . 2]" 1
884 1 37 TRP HH2 1 131 LEU HG . . 6.150 4.897 3.412 5.339 . 0 0 "[ . 1 . 2]" 1
885 1 37 TRP HH2 1 131 LEU MD1 . . 6.030 5.814 3.222 6.069 0.039 2 0 "[ . 1 . 2]" 1
886 1 37 TRP HH2 1 132 MET H . . 5.590 4.988 4.791 5.287 . 0 0 "[ . 1 . 2]" 1
887 1 37 TRP HH2 1 132 MET ME . . 6.150 2.088 1.871 2.699 . 0 0 "[ . 1 . 2]" 1
888 1 37 TRP HH2 1 146 LEU MD2 . . 5.540 4.086 3.030 5.576 0.036 5 0 "[ . 1 . 2]" 1
889 1 37 TRP HH2 1 150 ASP HB2 . . 6.150 3.709 3.319 4.122 . 0 0 "[ . 1 . 2]" 1
890 1 37 TRP HH2 1 150 ASP HB3 . . 6.150 2.287 2.096 2.556 . 0 0 "[ . 1 . 2]" 1
891 1 37 TRP HH2 1 154 ILE HB . . 6.150 4.578 3.995 5.286 . 0 0 "[ . 1 . 2]" 1
892 1 37 TRP HH2 1 154 ILE MG . . 6.150 4.864 4.403 5.137 . 0 0 "[ . 1 . 2]" 1
893 1 37 TRP HZ2 1 113 ALA MB . . 6.150 3.750 2.705 4.164 . 0 0 "[ . 1 . 2]" 1
894 1 37 TRP HZ2 1 114 HIS HA . . 6.150 3.302 2.792 3.682 . 0 0 "[ . 1 . 2]" 1
895 1 37 TRP HZ2 1 117 GLY H . . 3.880 2.884 2.479 3.538 . 0 0 "[ . 1 . 2]" 1
896 1 37 TRP HZ2 1 117 GLY HA3 . . 6.150 2.693 2.253 3.802 . 0 0 "[ . 1 . 2]" 1
897 1 37 TRP HZ2 1 131 LEU MD2 . . 6.150 2.923 2.404 3.669 . 0 0 "[ . 1 . 2]" 1
898 1 37 TRP HZ2 1 146 LEU MD2 . . 6.150 4.901 3.681 6.183 0.033 13 0 "[ . 1 . 2]" 1
899 1 37 TRP HZ3 1 120 LEU MD1 . . 6.150 4.261 2.856 6.188 0.038 15 0 "[ . 1 . 2]" 1
900 1 37 TRP HZ3 1 122 LEU MD1 . . 6.150 2.665 2.375 3.130 . 0 0 "[ . 1 . 2]" 1
901 1 37 TRP HZ3 1 146 LEU HB2 . . 6.150 5.369 5.031 5.710 . 0 0 "[ . 1 . 2]" 1
902 1 37 TRP HZ3 1 146 LEU MD1 . . 6.150 3.639 2.326 4.715 . 0 0 "[ . 1 . 2]" 1
903 1 37 TRP HZ3 1 146 LEU MD2 . . 6.150 3.008 2.138 4.694 . 0 0 "[ . 1 . 2]" 1
904 1 37 TRP HZ3 1 154 ILE H . . 6.150 3.430 2.948 3.988 . 0 0 "[ . 1 . 2]" 1
905 1 37 TRP HZ3 1 154 ILE HB . . 6.150 2.582 2.347 3.207 . 0 0 "[ . 1 . 2]" 1
906 1 37 TRP HZ3 1 154 ILE HG12 . . 6.150 5.321 4.895 5.781 . 0 0 "[ . 1 . 2]" 1
907 1 37 TRP HZ3 1 154 ILE MD . . 6.150 3.447 3.140 3.724 . 0 0 "[ . 1 . 2]" 1
908 1 37 TRP HZ3 1 154 ILE MG . . 6.150 2.768 2.354 3.043 . 0 0 "[ . 1 . 2]" 1
909 1 37 TRP QB 1 38 SER H . . 3.820 2.653 2.515 2.815 . 0 0 "[ . 1 . 2]" 1
910 1 37 TRP QB 1 39 SER H . . 4.390 4.409 4.295 4.468 0.078 15 0 "[ . 1 . 2]" 1
911 1 37 TRP QB 1 40 ALA H . . 4.510 4.532 4.466 4.566 0.056 9 0 "[ . 1 . 2]" 1
912 1 37 TRP QB 1 41 VAL MG2 . . 6.150 3.670 3.039 4.998 . 0 0 "[ . 1 . 2]" 1
913 1 37 TRP QB 1 45 PHE QE . . 6.150 2.156 1.972 2.388 . 0 0 "[ . 1 . 2]" 1
914 1 37 TRP QB 1 120 LEU MD1 . . 6.150 3.617 3.349 3.908 . 0 0 "[ . 1 . 2]" 1
915 1 38 SER H 1 38 SER HB2 . . 3.440 2.994 2.365 3.549 0.109 6 0 "[ . 1 . 2]" 1
916 1 38 SER H 1 39 SER H . . 3.010 2.701 2.566 2.856 . 0 0 "[ . 1 . 2]" 1
917 1 38 SER H 1 40 ALA H . . 4.630 4.306 4.117 4.449 . 0 0 "[ . 1 . 2]" 1
918 1 38 SER H 1 45 PHE QE . . 6.150 3.846 3.023 4.686 . 0 0 "[ . 1 . 2]" 1
919 1 38 SER HA 1 39 SER H . . 3.540 3.398 3.321 3.485 . 0 0 "[ . 1 . 2]" 1
920 1 38 SER HA 1 40 ALA H . . 4.190 4.233 4.207 4.279 0.089 2 0 "[ . 1 . 2]" 1
921 1 38 SER HA 1 41 VAL H . . 3.600 3.344 3.165 3.472 . 0 0 "[ . 1 . 2]" 1
922 1 38 SER HA 1 41 VAL MG2 . . 5.760 3.776 3.123 5.435 . 0 0 "[ . 1 . 2]" 1
923 1 38 SER HA 1 43 LEU H . . 3.640 2.981 2.674 3.362 . 0 0 "[ . 1 . 2]" 1
924 1 38 SER HA 1 43 LEU HB3 . . 6.150 4.865 4.588 5.147 . 0 0 "[ . 1 . 2]" 1
925 1 38 SER HA 1 44 SER H . . 6.150 5.851 5.463 6.204 0.054 11 0 "[ . 1 . 2]" 1
926 1 38 SER HA 1 45 PHE QD . . 6.150 5.664 5.072 6.154 0.004 12 0 "[ . 1 . 2]" 1
927 1 38 SER HA 1 45 PHE QE . . 6.150 5.370 4.367 6.145 . 0 0 "[ . 1 . 2]" 1
928 1 38 SER HB2 1 40 ALA H . . 6.150 5.955 5.494 6.129 . 0 0 "[ . 1 . 2]" 1
929 1 38 SER HB2 1 41 VAL H . . 6.150 5.611 5.286 6.027 . 0 0 "[ . 1 . 2]" 1
930 1 38 SER HB2 1 43 LEU HG . . 6.150 4.191 3.471 5.224 . 0 0 "[ . 1 . 2]" 1
931 1 38 SER HB2 1 43 LEU MD2 . . 6.150 5.420 4.604 6.195 0.045 14 0 "[ . 1 . 2]" 1
932 1 38 SER HB2 1 45 PHE QD . . 5.830 4.689 3.032 5.828 . 0 0 "[ . 1 . 2]" 1
933 1 38 SER HB2 1 45 PHE QE . . 6.150 5.264 3.251 6.187 0.037 12 0 "[ . 1 . 2]" 1
934 1 38 SER HB3 1 39 SER H . . 4.470 3.875 3.180 4.407 . 0 0 "[ . 1 . 2]" 1
935 1 38 SER HB3 1 43 LEU HG . . 6.150 4.528 3.598 5.219 . 0 0 "[ . 1 . 2]" 1
936 1 38 SER HB3 1 43 LEU MD2 . . 6.150 5.611 4.626 6.182 0.032 9 0 "[ . 1 . 2]" 1
937 1 38 SER HB3 1 45 PHE H . . 5.570 5.079 4.429 5.617 0.047 19 0 "[ . 1 . 2]" 1
938 1 38 SER HB3 1 45 PHE QD . . 5.810 4.476 3.048 5.401 . 0 0 "[ . 1 . 2]" 1
939 1 38 SER HB3 1 45 PHE QE . . 6.150 5.021 3.192 6.174 0.024 4 0 "[ . 1 . 2]" 1
940 1 39 SER H 1 39 SER HB2 . . 3.240 2.195 2.091 2.306 . 0 0 "[ . 1 . 2]" 1
941 1 39 SER H 1 39 SER HB3 . . 3.410 3.349 2.991 3.478 0.068 6 0 "[ . 1 . 2]" 1
942 1 39 SER H 1 40 ALA H . . 2.880 2.424 2.127 2.678 . 0 0 "[ . 1 . 2]" 1
943 1 39 SER H 1 40 ALA MB . . 4.610 4.031 3.764 4.258 . 0 0 "[ . 1 . 2]" 1
944 1 39 SER H 1 41 VAL H . . 3.810 3.840 3.642 3.933 0.123 7 0 "[ . 1 . 2]" 1
945 1 39 SER H 1 43 LEU HG . . 5.870 5.755 5.438 5.932 0.062 5 0 "[ . 1 . 2]" 1
946 1 39 SER H 1 146 LEU MD2 . . 5.180 4.962 4.498 5.226 0.046 16 0 "[ . 1 . 2]" 1
947 1 39 SER HA 1 40 ALA HA . . 6.150 4.767 4.692 4.856 . 0 0 "[ . 1 . 2]" 1
948 1 39 SER HA 1 41 VAL H . . 5.250 4.255 4.053 4.470 . 0 0 "[ . 1 . 2]" 1
949 1 39 SER HB2 1 40 ALA H . . 3.400 3.194 2.710 3.475 0.075 9 0 "[ . 1 . 2]" 1
950 1 39 SER HB2 1 40 ALA HA . . 6.150 5.103 4.694 5.496 . 0 0 "[ . 1 . 2]" 1
951 1 39 SER HB2 1 41 VAL H . . 5.540 5.253 4.977 5.531 . 0 0 "[ . 1 . 2]" 1
952 1 39 SER HB3 1 40 ALA H . . 3.880 3.324 2.770 3.748 . 0 0 "[ . 1 . 2]" 1
953 1 39 SER HB3 1 40 ALA HA . . 6.150 4.191 3.942 4.517 . 0 0 "[ . 1 . 2]" 1
954 1 39 SER HB3 1 41 VAL H . . 5.350 5.263 4.919 5.401 0.051 2 0 "[ . 1 . 2]" 1
955 1 39 SER HB3 1 145 HIS HE1 . . 6.150 5.758 4.448 6.208 0.058 2 0 "[ . 1 . 2]" 1
956 1 40 ALA H 1 40 ALA MB . . 2.560 2.131 2.066 2.187 . 0 0 "[ . 1 . 2]" 1
957 1 40 ALA H 1 41 VAL H . . 2.590 2.496 2.294 2.634 0.044 11 0 "[ . 1 . 2]" 1
958 1 40 ALA H 1 41 VAL HA . . 5.520 5.214 5.048 5.330 . 0 0 "[ . 1 . 2]" 1
959 1 40 ALA H 1 41 VAL MG1 . . 5.690 5.216 4.921 5.762 0.072 16 0 "[ . 1 . 2]" 1
960 1 40 ALA H 1 41 VAL MG2 . . 4.300 4.004 3.735 4.341 0.041 15 0 "[ . 1 . 2]" 1
961 1 40 ALA H 1 146 LEU MD2 . . 4.180 3.721 3.319 4.096 . 0 0 "[ . 1 . 2]" 1
962 1 40 ALA H 1 151 VAL MG1 . . 4.530 4.544 4.420 4.587 0.057 15 0 "[ . 1 . 2]" 1
963 1 40 ALA H 1 151 VAL MG2 . . 4.430 4.476 4.439 4.525 0.095 5 0 "[ . 1 . 2]" 1
964 1 40 ALA HA 1 41 VAL MG1 . . 6.150 4.723 4.295 6.100 . 0 0 "[ . 1 . 2]" 1
965 1 40 ALA HA 1 41 VAL MG2 . . 5.530 4.488 3.933 4.926 . 0 0 "[ . 1 . 2]" 1
966 1 40 ALA MB 1 41 VAL H . . 2.990 2.806 2.684 2.921 . 0 0 "[ . 1 . 2]" 1
967 1 40 ALA MB 1 41 VAL MG1 . . 5.320 3.477 2.843 4.742 . 0 0 "[ . 1 . 2]" 1
968 1 40 ALA MB 1 41 VAL MG2 . . 4.980 2.698 2.416 3.205 . 0 0 "[ . 1 . 2]" 1
969 1 40 ALA MB 1 145 HIS HE1 . . 6.150 5.856 4.478 6.206 0.056 19 0 "[ . 1 . 2]" 1
970 1 40 ALA MB 1 146 LEU MD2 . . 5.570 2.103 1.970 2.491 . 0 0 "[ . 1 . 2]" 1
971 1 40 ALA MB 1 151 VAL HA . . 6.150 2.265 2.036 2.644 . 0 0 "[ . 1 . 2]" 1
972 1 40 ALA MB 1 151 VAL HB . . 6.150 4.169 4.028 4.400 . 0 0 "[ . 1 . 2]" 1
973 1 40 ALA MB 1 155 GLN H . . 6.150 4.128 3.757 4.631 . 0 0 "[ . 1 . 2]" 1
974 1 40 ALA MB 1 155 GLN HA . . 6.150 5.146 4.708 5.681 . 0 0 "[ . 1 . 2]" 1
975 1 40 ALA MB 1 155 GLN HG2 . . 6.150 5.452 3.464 6.208 0.058 16 0 "[ . 1 . 2]" 1
976 1 40 ALA MB 1 155 GLN HG3 . . 6.150 5.208 2.893 6.213 0.063 14 0 "[ . 1 . 2]" 1
977 1 40 ALA MB 1 155 GLN QB . . 5.150 4.219 3.510 5.165 0.015 1 0 "[ . 1 . 2]" 1
978 1 41 VAL H 1 41 VAL HB . . 3.940 3.685 2.734 3.976 0.036 5 0 "[ . 1 . 2]" 1
979 1 41 VAL H 1 41 VAL MG1 . . 4.130 3.631 3.415 3.946 . 0 0 "[ . 1 . 2]" 1
980 1 41 VAL H 1 41 VAL MG2 . . 4.420 2.590 2.361 3.131 . 0 0 "[ . 1 . 2]" 1
981 1 41 VAL H 1 42 PRO HD2 . . 4.920 4.887 4.808 4.933 0.013 2 0 "[ . 1 . 2]" 1
982 1 41 VAL H 1 42 PRO HD3 . . 4.890 4.885 4.741 4.944 0.054 14 0 "[ . 1 . 2]" 1
983 1 41 VAL H 1 43 LEU H . . 4.680 4.309 3.915 4.694 0.014 11 0 "[ . 1 . 2]" 1
984 1 41 VAL H 1 43 LEU HG . . 4.830 4.588 4.241 4.796 . 0 0 "[ . 1 . 2]" 1
985 1 41 VAL H 1 154 ILE MD . . 5.950 4.015 3.445 4.284 . 0 0 "[ . 1 . 2]" 1
986 1 41 VAL H 1 154 ILE MG . . 5.880 4.061 3.903 4.213 . 0 0 "[ . 1 . 2]" 1
987 1 41 VAL HA 1 42 PRO QB . . 6.150 4.629 4.539 4.701 . 0 0 "[ . 1 . 2]" 1
988 1 41 VAL HA 1 154 ILE MG . . 6.150 4.660 4.473 4.903 . 0 0 "[ . 1 . 2]" 1
989 1 41 VAL HA 1 158 TYR HB2 . . 6.150 5.176 4.740 5.637 . 0 0 "[ . 1 . 2]" 1
990 1 41 VAL HB 1 42 PRO HD2 . . 6.000 2.587 2.087 4.228 . 0 0 "[ . 1 . 2]" 1
991 1 41 VAL HB 1 42 PRO HD3 . . 5.790 3.906 3.506 5.160 . 0 0 "[ . 1 . 2]" 1
992 1 41 VAL HB 1 43 LEU MD1 . . 6.150 5.516 4.562 6.066 . 0 0 "[ . 1 . 2]" 1
993 1 41 VAL HB 1 158 TYR H . . 5.400 5.181 4.518 5.540 0.140 19 0 "[ . 1 . 2]" 1
994 1 41 VAL HB 1 158 TYR HB2 . . 6.150 3.128 2.394 4.389 . 0 0 "[ . 1 . 2]" 1
995 1 41 VAL HB 1 158 TYR HB3 . . 5.980 4.137 3.264 5.718 . 0 0 "[ . 1 . 2]" 1
996 1 41 VAL MG1 1 42 PRO HD2 . . 6.150 2.523 2.106 2.949 . 0 0 "[ . 1 . 2]" 1
997 1 41 VAL MG1 1 42 PRO HD3 . . 6.070 3.610 3.125 3.857 . 0 0 "[ . 1 . 2]" 1
998 1 41 VAL MG1 1 42 PRO QB . . 6.150 5.037 4.043 5.463 . 0 0 "[ . 1 . 2]" 1
999 1 41 VAL MG1 1 43 LEU H . . 5.510 4.631 2.492 5.533 0.023 12 0 "[ . 1 . 2]" 1
1000 1 41 VAL MG1 1 43 LEU HG . . 6.120 4.934 3.381 5.618 . 0 0 "[ . 1 . 2]" 1
1001 1 41 VAL MG1 1 43 LEU MD1 . . 6.150 5.609 4.259 6.166 0.016 8 0 "[ . 1 . 2]" 1
1002 1 41 VAL MG1 1 43 LEU MD2 . . 6.150 3.640 2.201 4.200 . 0 0 "[ . 1 . 2]" 1
1003 1 41 VAL MG1 1 154 ILE MD . . 5.380 3.475 3.116 4.033 . 0 0 "[ . 1 . 2]" 1
1004 1 41 VAL MG1 1 154 ILE MG . . 4.540 2.588 2.078 4.144 . 0 0 "[ . 1 . 2]" 1
1005 1 41 VAL MG1 1 155 GLN H . . 5.000 3.619 3.011 5.044 0.044 16 0 "[ . 1 . 2]" 1
1006 1 41 VAL MG1 1 155 GLN HA . . 5.200 2.268 1.903 3.348 . 0 0 "[ . 1 . 2]" 1
1007 1 41 VAL MG1 1 155 GLN HG2 . . 6.150 3.469 2.200 4.568 . 0 0 "[ . 1 . 2]" 1
1008 1 41 VAL MG1 1 155 GLN HG3 . . 6.150 3.735 2.310 5.699 . 0 0 "[ . 1 . 2]" 1
1009 1 41 VAL MG1 1 155 GLN QB . . 6.150 3.115 2.159 4.971 . 0 0 "[ . 1 . 2]" 1
1010 1 41 VAL MG1 1 157 LEU H . . 5.400 4.442 3.739 5.129 . 0 0 "[ . 1 . 2]" 1
1011 1 41 VAL MG1 1 158 TYR H . . 4.660 3.379 2.821 3.825 . 0 0 "[ . 1 . 2]" 1
1012 1 41 VAL MG1 1 158 TYR HA . . 6.150 4.824 4.360 5.445 . 0 0 "[ . 1 . 2]" 1
1013 1 41 VAL MG1 1 158 TYR HB2 . . 6.150 2.360 1.915 3.121 . 0 0 "[ . 1 . 2]" 1
1014 1 41 VAL MG1 1 158 TYR HB3 . . 6.150 3.760 3.088 4.609 . 0 0 "[ . 1 . 2]" 1
1015 1 41 VAL MG1 1 158 TYR QD . . 6.150 2.904 2.179 3.737 . 0 0 "[ . 1 . 2]" 1
1016 1 41 VAL MG1 1 159 GLY H . . 5.050 3.727 2.925 4.156 . 0 0 "[ . 1 . 2]" 1
1017 1 41 VAL MG2 1 42 PRO HA . . 6.150 4.857 4.238 5.758 . 0 0 "[ . 1 . 2]" 1
1018 1 41 VAL MG2 1 42 PRO HD2 . . 6.150 3.704 3.117 3.930 . 0 0 "[ . 1 . 2]" 1
1019 1 41 VAL MG2 1 42 PRO HD3 . . 6.150 4.584 4.073 4.751 . 0 0 "[ . 1 . 2]" 1
1020 1 41 VAL MG2 1 42 PRO QB . . 6.150 5.326 4.992 5.795 . 0 0 "[ . 1 . 2]" 1
1021 1 41 VAL MG2 1 43 LEU H . . 5.170 3.423 2.172 5.190 0.020 16 0 "[ . 1 . 2]" 1
1022 1 41 VAL MG2 1 43 LEU MD1 . . 5.390 4.143 3.638 5.436 0.046 19 0 "[ . 1 . 2]" 1
1023 1 41 VAL MG2 1 43 LEU MD2 . . 5.060 2.300 1.936 3.367 . 0 0 "[ . 1 . 2]" 1
1024 1 41 VAL MG2 1 154 ILE HB . . 6.150 4.148 3.921 4.397 . 0 0 "[ . 1 . 2]" 1
1025 1 41 VAL MG2 1 154 ILE MG . . 5.190 2.360 1.902 3.051 . 0 0 "[ . 1 . 2]" 1
1026 1 41 VAL MG2 1 155 GLN HA . . 6.150 3.625 1.992 4.511 . 0 0 "[ . 1 . 2]" 1
1027 1 41 VAL MG2 1 155 GLN HG2 . . 6.150 5.029 2.166 6.187 0.037 20 0 "[ . 1 . 2]" 1
1028 1 41 VAL MG2 1 155 GLN QB . . 6.150 4.332 2.428 5.856 . 0 0 "[ . 1 . 2]" 1
1029 1 41 VAL MG2 1 158 TYR HB2 . . 6.150 3.007 2.578 3.537 . 0 0 "[ . 1 . 2]" 1
1030 1 42 PRO HA 1 43 LEU H . . 3.100 2.586 2.254 3.121 0.021 3 0 "[ . 1 . 2]" 1
1031 1 42 PRO HD2 1 43 LEU H . . 4.830 4.575 3.899 4.883 0.053 12 0 "[ . 1 . 2]" 1
1032 1 42 PRO HD2 1 158 TYR HB2 . . 6.150 4.130 3.712 4.423 . 0 0 "[ . 1 . 2]" 1
1033 1 42 PRO HD3 1 43 LEU H . . 5.260 4.909 4.471 5.143 . 0 0 "[ . 1 . 2]" 1
1034 1 42 PRO HD3 1 158 TYR HB2 . . 6.150 5.890 5.479 6.161 0.011 15 0 "[ . 1 . 2]" 1
1035 1 42 PRO HG3 1 43 LEU H . . 5.790 5.695 5.295 5.817 0.027 8 0 "[ . 1 . 2]" 1
1036 1 42 PRO QB 1 43 LEU H . . 4.380 4.012 3.845 4.147 . 0 0 "[ . 1 . 2]" 1
1037 1 42 PRO QB 1 158 TYR HB2 . . 6.150 6.193 6.129 6.231 0.081 4 0 "[ . 1 . 2]" 1
1038 1 43 LEU H 1 43 LEU HB2 . . 3.880 3.846 3.632 3.930 0.050 1 0 "[ . 1 . 2]" 1
1039 1 43 LEU H 1 43 LEU HB3 . . 3.000 2.881 2.430 3.057 0.057 11 0 "[ . 1 . 2]" 1
1040 1 43 LEU H 1 43 LEU HG . . 2.940 2.787 2.284 2.958 0.018 1 0 "[ . 1 . 2]" 1
1041 1 43 LEU H 1 43 LEU MD1 . . 4.140 3.907 3.706 4.146 0.006 3 0 "[ . 1 . 2]" 1
1042 1 43 LEU H 1 43 LEU MD2 . . 4.140 3.886 3.246 4.145 0.005 17 0 "[ . 1 . 2]" 1
1043 1 43 LEU HA 1 44 SER H . . 2.830 2.464 2.216 2.698 . 0 0 "[ . 1 . 2]" 1
1044 1 43 LEU HB2 1 44 SER H . . 3.350 2.566 2.301 2.804 . 0 0 "[ . 1 . 2]" 1
1045 1 43 LEU HB2 1 158 TYR HB3 . . 6.150 4.697 4.305 4.998 . 0 0 "[ . 1 . 2]" 1
1046 1 43 LEU HB3 1 44 SER H . . 4.050 3.913 3.734 4.063 0.013 10 0 "[ . 1 . 2]" 1
1047 1 43 LEU HB3 1 158 TYR QD . . 6.150 3.696 2.860 3.997 . 0 0 "[ . 1 . 2]" 1
1048 1 43 LEU HB3 1 158 TYR QE . . 6.150 4.382 3.932 4.746 . 0 0 "[ . 1 . 2]" 1
1049 1 43 LEU HG 1 44 SER H . . 4.100 4.118 4.042 4.182 0.082 19 0 "[ . 1 . 2]" 1
1050 1 43 LEU HG 1 45 PHE H . . 5.900 5.811 5.503 5.968 0.068 19 0 "[ . 1 . 2]" 1
1051 1 43 LEU MD1 1 44 SER H . . 4.690 2.454 2.309 2.593 . 0 0 "[ . 1 . 2]" 1
1052 1 43 LEU MD1 1 45 PHE QE . . 6.150 2.651 2.386 2.948 . 0 0 "[ . 1 . 2]" 1
1053 1 43 LEU MD1 1 120 LEU HA . . 6.150 6.171 5.910 6.242 0.092 3 0 "[ . 1 . 2]" 1
1054 1 43 LEU MD1 1 120 LEU MD1 . . 6.150 4.571 3.420 5.550 . 0 0 "[ . 1 . 2]" 1
1055 1 43 LEU MD1 1 120 LEU MD2 . . 5.650 3.873 3.285 4.468 . 0 0 "[ . 1 . 2]" 1
1056 1 43 LEU MD1 1 154 ILE HG12 . . 6.150 5.720 5.381 5.928 . 0 0 "[ . 1 . 2]" 1
1057 1 43 LEU MD1 1 154 ILE MD . . 6.150 3.690 3.433 3.848 . 0 0 "[ . 1 . 2]" 1
1058 1 43 LEU MD1 1 154 ILE MG . . 6.150 5.957 5.604 6.166 0.016 8 0 "[ . 1 . 2]" 1
1059 1 43 LEU MD1 1 158 TYR HB3 . . 6.150 6.046 5.668 6.203 0.053 10 0 "[ . 1 . 2]" 1
1060 1 43 LEU MD1 1 158 TYR QD . . 6.150 4.894 4.448 5.201 . 0 0 "[ . 1 . 2]" 1
1061 1 43 LEU MD2 1 44 SER H . . 4.190 4.169 3.858 4.272 0.082 16 0 "[ . 1 . 2]" 1
1062 1 43 LEU MD2 1 45 PHE QD . . 6.150 4.589 4.152 5.173 . 0 0 "[ . 1 . 2]" 1
1063 1 43 LEU MD2 1 45 PHE QE . . 6.150 3.540 3.140 3.851 . 0 0 "[ . 1 . 2]" 1
1064 1 43 LEU MD2 1 154 ILE MG . . 6.150 4.239 3.846 4.572 . 0 0 "[ . 1 . 2]" 1
1065 1 43 LEU MD2 1 158 TYR QD . . 6.150 3.007 2.776 3.215 . 0 0 "[ . 1 . 2]" 1
1066 1 43 LEU MD2 1 158 TYR QE . . 6.150 2.744 2.558 2.896 . 0 0 "[ . 1 . 2]" 1
1067 1 44 SER H 1 44 SER HB2 . . 3.560 3.017 2.635 3.695 0.135 19 0 "[ . 1 . 2]" 1
1068 1 44 SER H 1 44 SER HB3 . . 3.730 3.688 3.199 3.822 0.092 4 0 "[ . 1 . 2]" 1
1069 1 44 SER H 1 45 PHE QD . . 5.390 5.048 4.357 5.409 0.019 20 0 "[ . 1 . 2]" 1
1070 1 44 SER HA 1 45 PHE H . . 2.840 2.179 2.039 2.258 . 0 0 "[ . 1 . 2]" 1
1071 1 44 SER HA 1 45 PHE HA . . 6.150 4.477 4.399 4.566 . 0 0 "[ . 1 . 2]" 1
1072 1 44 SER HA 1 45 PHE QD . . 6.150 4.050 3.311 4.898 . 0 0 "[ . 1 . 2]" 1
1073 1 44 SER HB2 1 45 PHE H . . 6.150 3.976 2.890 4.518 . 0 0 "[ . 1 . 2]" 1
1074 1 44 SER HB2 1 46 VAL MG2 . . 5.560 4.553 2.836 5.581 0.021 18 0 "[ . 1 . 2]" 1
1075 1 44 SER HB3 1 45 PHE H . . 3.480 3.342 2.923 3.544 0.064 16 0 "[ . 1 . 2]" 1
1076 1 44 SER HB3 1 46 VAL MG2 . . 6.150 4.147 2.593 5.934 . 0 0 "[ . 1 . 2]" 1
1077 1 45 PHE H 1 45 PHE HB2 . . 3.690 2.468 2.301 2.654 . 0 0 "[ . 1 . 2]" 1
1078 1 45 PHE H 1 45 PHE HB3 . . 3.950 3.647 3.471 3.767 . 0 0 "[ . 1 . 2]" 1
1079 1 45 PHE H 1 45 PHE QD . . 3.920 3.018 2.343 3.916 . 0 0 "[ . 1 . 2]" 1
1080 1 45 PHE H 1 46 VAL MG2 . . 5.400 4.744 3.560 5.447 0.047 9 0 "[ . 1 . 2]" 1
1081 1 45 PHE HA 1 46 VAL HB . . 6.150 5.283 4.586 5.919 . 0 0 "[ . 1 . 2]" 1
1082 1 45 PHE HA 1 46 VAL MG1 . . 6.150 4.785 3.804 5.658 . 0 0 "[ . 1 . 2]" 1
1083 1 45 PHE HA 1 46 VAL MG2 . . 6.150 3.873 3.616 4.162 . 0 0 "[ . 1 . 2]" 1
1084 1 45 PHE HB2 1 55 ILE MD . . 6.150 5.704 5.045 6.168 0.017 19 0 "[ . 1 . 2]" 1
1085 1 45 PHE QD 1 46 VAL H . . 5.450 4.364 3.711 4.717 . 0 0 "[ . 1 . 2]" 1
1086 1 45 PHE QD 1 55 ILE MD . . 6.070 2.831 2.131 3.751 . 0 0 "[ . 1 . 2]" 1
1087 1 45 PHE QE 1 55 ILE MD . . 6.150 2.709 2.111 3.775 . 0 0 "[ . 1 . 2]" 1
1088 1 45 PHE QE 1 120 LEU MD1 . . 6.150 4.014 2.195 5.411 . 0 0 "[ . 1 . 2]" 1
1089 1 45 PHE QE 1 120 LEU MD2 . . 5.590 3.390 2.499 4.709 . 0 0 "[ . 1 . 2]" 1
1090 1 46 VAL H 1 46 VAL HB . . 4.110 3.241 2.451 3.953 . 0 0 "[ . 1 . 2]" 1
1091 1 46 VAL H 1 46 VAL MG1 . . 4.400 3.442 2.893 3.983 . 0 0 "[ . 1 . 2]" 1
1092 1 46 VAL H 1 46 VAL MG2 . . 4.070 2.456 2.112 2.751 . 0 0 "[ . 1 . 2]" 1
1093 1 46 VAL H 1 47 ARG H . . 4.660 4.434 4.254 4.583 . 0 0 "[ . 1 . 2]" 1
1094 1 46 VAL HA 1 47 ARG H . . 2.670 2.158 2.020 2.291 . 0 0 "[ . 1 . 2]" 1
1095 1 46 VAL HA 1 47 ARG HA . . 6.150 4.381 4.323 4.485 . 0 0 "[ . 1 . 2]" 1
1096 1 46 VAL HB 1 47 ARG H . . 4.320 3.583 2.819 4.354 0.034 12 0 "[ . 1 . 2]" 1
1097 1 46 VAL HB 1 48 ILE HA . . 6.150 5.674 4.598 6.236 0.086 16 0 "[ . 1 . 2]" 1
1098 1 46 VAL MG1 1 47 ARG H . . 6.150 3.317 2.487 4.032 . 0 0 "[ . 1 . 2]" 1
1099 1 46 VAL MG1 1 47 ARG HA . . 6.150 4.820 3.895 5.732 . 0 0 "[ . 1 . 2]" 1
1100 1 46 VAL MG2 1 47 ARG H . . 3.880 3.911 3.793 3.952 0.072 6 0 "[ . 1 . 2]" 1
1101 1 47 ARG H 1 47 ARG HB2 . . 3.680 3.619 1.938 3.744 0.064 4 0 "[ . 1 . 2]" 1
1102 1 47 ARG H 1 47 ARG HB3 . . 3.750 2.935 2.613 3.338 . 0 0 "[ . 1 . 2]" 1
1103 1 47 ARG H 1 47 ARG HD2 . . 4.760 4.168 2.210 4.786 0.026 20 0 "[ . 1 . 2]" 1
1104 1 47 ARG H 1 47 ARG HD3 . . 4.400 3.318 1.794 4.347 . 0 0 "[ . 1 . 2]" 1
1105 1 47 ARG H 1 47 ARG HG2 . . 3.910 2.530 2.001 4.053 0.143 18 0 "[ . 1 . 2]" 1
1106 1 47 ARG H 1 47 ARG HG3 . . 4.270 3.564 2.229 4.125 . 0 0 "[ . 1 . 2]" 1
1107 1 47 ARG HA 1 48 ILE H . . 2.940 2.114 1.991 2.276 . 0 0 "[ . 1 . 2]" 1
1108 1 47 ARG HA 1 48 ILE HA . . 6.150 4.428 4.324 4.506 . 0 0 "[ . 1 . 2]" 1
1109 1 47 ARG HB2 1 48 ILE HA . . 6.150 4.955 4.358 5.519 . 0 0 "[ . 1 . 2]" 1
1110 1 47 ARG HB3 1 48 ILE HA . . 6.150 5.922 4.077 6.195 0.045 12 0 "[ . 1 . 2]" 1
1111 1 47 ARG HG2 1 48 ILE H . . 6.150 4.898 4.390 5.242 . 0 0 "[ . 1 . 2]" 1
1112 1 47 ARG HG2 1 48 ILE HA . . 6.150 5.488 4.576 6.238 0.088 18 0 "[ . 1 . 2]" 1
1113 1 48 ILE H 1 48 ILE HG12 . . 3.230 2.418 2.112 3.219 . 0 0 "[ . 1 . 2]" 1
1114 1 48 ILE H 1 48 ILE HG13 . . 3.170 2.667 2.293 3.123 . 0 0 "[ . 1 . 2]" 1
1115 1 48 ILE H 1 48 ILE MD . . 5.410 3.908 3.740 4.036 . 0 0 "[ . 1 . 2]" 1
1116 1 48 ILE H 1 48 ILE MG . . 3.400 2.782 2.387 3.112 . 0 0 "[ . 1 . 2]" 1
1117 1 48 ILE H 1 53 ALA MB . . 6.150 4.039 3.429 4.620 . 0 0 "[ . 1 . 2]" 1
1118 1 48 ILE HA 1 49 ASN HB2 . . 6.150 4.256 3.929 4.694 . 0 0 "[ . 1 . 2]" 1
1119 1 48 ILE HA 1 49 ASN HB3 . . 6.150 5.294 4.842 6.044 . 0 0 "[ . 1 . 2]" 1
1120 1 48 ILE HB 1 49 ASN H . . 6.150 3.005 2.210 4.009 . 0 0 "[ . 1 . 2]" 1
1121 1 48 ILE HB 1 49 ASN HB2 . . 6.150 5.192 4.634 5.612 . 0 0 "[ . 1 . 2]" 1
1122 1 48 ILE HB 1 49 ASN HB3 . . 6.150 5.606 4.698 6.140 . 0 0 "[ . 1 . 2]" 1
1123 1 48 ILE HB 1 50 SER H . . 3.540 2.610 2.451 2.762 . 0 0 "[ . 1 . 2]" 1
1124 1 48 ILE HG12 1 49 ASN HA . . 6.150 5.781 5.286 6.164 0.014 13 0 "[ . 1 . 2]" 1
1125 1 48 ILE HG12 1 50 SER H . . 5.150 4.960 4.191 5.193 0.043 9 0 "[ . 1 . 2]" 1
1126 1 48 ILE HG13 1 50 SER H . . 4.190 3.743 2.593 4.310 0.120 1 0 "[ . 1 . 2]" 1
1127 1 48 ILE HG13 1 52 GLU HA . . 6.150 5.527 4.520 6.180 0.030 1 0 "[ . 1 . 2]" 1
1128 1 48 ILE MD 1 50 SER H . . 3.840 3.267 2.285 3.853 0.013 18 0 "[ . 1 . 2]" 1
1129 1 48 ILE MD 1 52 GLU H . . 4.430 3.546 2.811 4.465 0.035 1 0 "[ . 1 . 2]" 1
1130 1 48 ILE MD 1 52 GLU HA . . 5.830 3.275 3.010 3.876 . 0 0 "[ . 1 . 2]" 1
1131 1 48 ILE MD 1 53 ALA H . . 3.530 3.061 2.483 3.554 0.024 1 0 "[ . 1 . 2]" 1
1132 1 48 ILE MD 1 53 ALA HA . . 5.650 3.011 2.031 4.321 . 0 0 "[ . 1 . 2]" 1
1133 1 48 ILE MD 1 53 ALA MB . . 5.960 2.212 2.004 3.156 . 0 0 "[ . 1 . 2]" 1
1134 1 48 ILE HG13 1 48 ILE MG . . 3.490 3.164 2.910 3.229 . 0 0 "[ . 1 . 2]" 1
1135 1 48 ILE MD 1 48 ILE MG . . 3.710 2.220 2.072 2.937 . 0 0 "[ . 1 . 2]" 1
1136 1 48 ILE MG 1 50 SER H . . 4.180 4.177 3.996 4.299 0.119 2 0 "[ . 1 . 2]" 1
1137 1 48 ILE MG 1 52 GLU HA . . 6.150 6.186 6.097 6.237 0.087 3 0 "[ . 1 . 2]" 1
1138 1 49 ASN H 1 50 SER H . . 4.100 2.506 2.028 3.447 . 0 0 "[ . 1 . 2]" 1
1139 1 49 ASN HB2 1 50 SER H . . 4.150 3.891 3.094 4.212 0.062 20 0 "[ . 1 . 2]" 1
1140 1 49 ASN HB3 1 50 SER H . . 3.830 3.636 2.835 3.887 0.057 6 0 "[ . 1 . 2]" 1
1141 1 50 SER H 1 50 SER QB . . 3.480 2.727 2.273 3.256 . 0 0 "[ . 1 . 2]" 1
1142 1 50 SER H 1 51 GLY H . . 4.690 4.257 3.561 4.494 . 0 0 "[ . 1 . 2]" 1
1143 1 50 SER HA 1 51 GLY H . . 2.920 2.262 2.090 2.416 . 0 0 "[ . 1 . 2]" 1
1144 1 50 SER HA 1 51 GLY HA3 . . 6.150 4.528 4.472 4.598 . 0 0 "[ . 1 . 2]" 1
1145 1 50 SER QB 1 51 GLY H . . 5.890 3.582 2.626 4.053 . 0 0 "[ . 1 . 2]" 1
1146 1 50 SER QB 1 51 GLY HA3 . . 6.020 4.584 3.931 4.960 . 0 0 "[ . 1 . 2]" 1
1147 1 51 GLY H 1 51 GLY HA3 . . 2.800 2.977 2.900 3.010 0.210 8 0 "[ . 1 . 2]" 1
1148 1 51 GLY H 1 52 GLU H . . 4.380 4.284 2.263 4.553 0.173 6 0 "[ . 1 . 2]" 1
1149 1 51 GLY HA3 1 52 GLU H . . 3.050 2.522 2.113 3.492 0.442 8 0 "[ . 1 . 2]" 1
1150 1 51 GLY HA3 1 52 GLU HB3 . . 6.150 5.067 4.549 5.559 . 0 0 "[ . 1 . 2]" 1
1151 1 51 GLY HA3 1 53 ALA H . . 6.150 5.738 5.394 5.845 . 0 0 "[ . 1 . 2]" 1
1152 1 52 GLU H 1 52 GLU HB2 . . 3.030 2.813 2.378 3.078 0.048 20 0 "[ . 1 . 2]" 1
1153 1 52 GLU H 1 52 GLU HB3 . . 3.040 2.681 2.460 3.141 0.101 8 0 "[ . 1 . 2]" 1
1154 1 52 GLU H 1 52 GLU QG . . 4.100 4.060 3.938 4.119 0.019 17 0 "[ . 1 . 2]" 1
1155 1 52 GLU H 1 53 ALA H . . 4.530 4.363 3.725 4.523 . 0 0 "[ . 1 . 2]" 1
1156 1 52 GLU HA 1 53 ALA H . . 2.490 2.091 1.970 2.186 . 0 0 "[ . 1 . 2]" 1
1157 1 52 GLU HA 1 53 ALA MB . . 6.150 3.761 3.580 3.954 . 0 0 "[ . 1 . 2]" 1
1158 1 52 GLU HB2 1 53 ALA H . . 4.270 4.227 3.958 4.341 0.071 9 0 "[ . 1 . 2]" 1
1159 1 52 GLU HB3 1 53 ALA H . . 4.770 4.102 3.672 4.461 . 0 0 "[ . 1 . 2]" 1
1160 1 52 GLU QG 1 53 ALA H . . 3.110 2.710 2.240 3.141 0.031 8 0 "[ . 1 . 2]" 1
1161 1 52 GLU QG 1 53 ALA HA . . 6.150 4.373 3.685 5.257 . 0 0 "[ . 1 . 2]" 1
1162 1 53 ALA H 1 53 ALA HA . . 2.900 2.918 2.765 2.966 0.066 13 0 "[ . 1 . 2]" 1
1163 1 53 ALA H 1 53 ALA MB . . 2.940 2.280 2.117 2.535 . 0 0 "[ . 1 . 2]" 1
1164 1 53 ALA H 1 54 ASP H . . 4.480 4.497 4.375 4.562 0.082 8 0 "[ . 1 . 2]" 1
1165 1 53 ALA H 1 54 ASP HA . . 6.150 5.402 4.689 5.962 . 0 0 "[ . 1 . 2]" 1
1166 1 53 ALA H 1 55 ILE H . . 5.610 5.219 4.941 5.615 0.005 9 0 "[ . 1 . 2]" 1
1167 1 53 ALA H 1 56 MET HG2 . . 4.100 3.387 2.292 4.125 0.025 19 0 "[ . 1 . 2]" 1
1168 1 53 ALA H 1 56 MET HG3 . . 4.150 3.402 2.307 4.184 0.034 19 0 "[ . 1 . 2]" 1
1169 1 53 ALA HA 1 54 ASP H . . 3.090 2.505 2.226 2.901 . 0 0 "[ . 1 . 2]" 1
1170 1 53 ALA HA 1 54 ASP HB2 . . 6.150 4.562 4.263 4.890 . 0 0 "[ . 1 . 2]" 1
1171 1 53 ALA MB 1 54 ASP H . . 2.830 2.237 2.012 2.612 . 0 0 "[ . 1 . 2]" 1
1172 1 53 ALA MB 1 56 MET ME . . 6.150 4.539 3.519 5.526 . 0 0 "[ . 1 . 2]" 1
1173 1 54 ASP H 1 54 ASP HA . . 2.880 2.918 2.889 2.940 0.060 7 0 "[ . 1 . 2]" 1
1174 1 54 ASP H 1 54 ASP HB3 . . 3.470 3.409 3.115 3.553 0.083 18 0 "[ . 1 . 2]" 1
1175 1 54 ASP H 1 55 ILE H . . 3.350 2.293 2.109 2.431 . 0 0 "[ . 1 . 2]" 1
1176 1 54 ASP H 1 55 ILE HB . . 4.500 4.563 4.505 4.600 0.100 18 0 "[ . 1 . 2]" 1
1177 1 54 ASP HB2 1 55 ILE H . . 4.410 3.020 2.297 3.941 . 0 0 "[ . 1 . 2]" 1
1178 1 54 ASP HB2 1 55 ILE HG12 . . 5.940 4.923 3.970 5.714 . 0 0 "[ . 1 . 2]" 1
1179 1 54 ASP HB2 1 55 ILE HG13 . . 6.150 3.540 2.530 4.572 . 0 0 "[ . 1 . 2]" 1
1180 1 54 ASP HB2 1 55 ILE MG . . 6.150 5.688 4.980 6.226 0.076 12 0 "[ . 1 . 2]" 1
1181 1 54 ASP HB3 1 55 ILE H . . 3.910 3.427 3.210 3.740 . 0 0 "[ . 1 . 2]" 1
1182 1 54 ASP HB3 1 55 ILE HG12 . . 6.150 4.120 3.253 5.294 . 0 0 "[ . 1 . 2]" 1
1183 1 54 ASP HB3 1 55 ILE HG13 . . 6.150 2.997 2.320 3.921 . 0 0 "[ . 1 . 2]" 1
1184 1 54 ASP HB3 1 55 ILE MG . . 6.150 5.405 5.018 5.751 . 0 0 "[ . 1 . 2]" 1
1185 1 55 ILE H 1 55 ILE HB . . 3.590 2.464 2.319 2.645 . 0 0 "[ . 1 . 2]" 1
1186 1 55 ILE H 1 55 ILE HG12 . . 4.620 3.885 3.564 4.342 . 0 0 "[ . 1 . 2]" 1
1187 1 55 ILE H 1 55 ILE HG13 . . 3.870 2.788 2.510 3.389 . 0 0 "[ . 1 . 2]" 1
1188 1 55 ILE H 1 55 ILE MD . . 4.360 3.699 2.416 4.202 . 0 0 "[ . 1 . 2]" 1
1189 1 55 ILE H 1 55 ILE MG . . 3.840 3.788 3.732 3.829 . 0 0 "[ . 1 . 2]" 1
1190 1 55 ILE HA 1 56 MET H . . 2.890 2.211 2.011 2.288 . 0 0 "[ . 1 . 2]" 1
1191 1 55 ILE HA 1 90 ASP HA . . 6.150 2.708 2.447 3.167 . 0 0 "[ . 1 . 2]" 1
1192 1 55 ILE HB 1 56 MET H . . 4.540 4.491 4.393 4.546 0.006 11 0 "[ . 1 . 2]" 1
1193 1 55 ILE HG12 1 56 MET H . . 5.320 4.877 4.402 5.382 0.062 9 0 "[ . 1 . 2]" 1
1194 1 55 ILE HG12 1 119 ALA MB . . 6.150 3.004 2.214 3.725 . 0 0 "[ . 1 . 2]" 1
1195 1 55 ILE HG13 1 56 MET H . . 5.260 5.107 4.529 5.289 0.029 19 0 "[ . 1 . 2]" 1
1196 1 55 ILE HG13 1 119 ALA MB . . 6.150 4.117 2.638 4.920 . 0 0 "[ . 1 . 2]" 1
1197 1 55 ILE MD 1 119 ALA MB . . 6.150 2.922 2.290 3.546 . 0 0 "[ . 1 . 2]" 1
1198 1 55 ILE MG 1 56 MET H . . 3.300 3.319 3.242 3.353 0.053 17 0 "[ . 1 . 2]" 1
1199 1 55 ILE MG 1 56 MET HA . . 6.150 4.006 3.666 4.311 . 0 0 "[ . 1 . 2]" 1
1200 1 55 ILE MG 1 90 ASP HA . . 6.150 3.034 2.237 3.660 . 0 0 "[ . 1 . 2]" 1
1201 1 55 ILE MG 1 119 ALA MB . . 6.150 3.310 2.690 3.766 . 0 0 "[ . 1 . 2]" 1
1202 1 56 MET H 1 56 MET HB2 . . 3.540 2.307 2.208 2.399 . 0 0 "[ . 1 . 2]" 1
1203 1 56 MET H 1 56 MET HB3 . . 3.450 3.529 3.480 3.619 0.169 12 0 "[ . 1 . 2]" 1
1204 1 56 MET H 1 56 MET HG2 . . 3.980 3.619 2.838 4.005 0.025 15 0 "[ . 1 . 2]" 1
1205 1 56 MET H 1 56 MET HG3 . . 3.950 3.245 2.679 3.969 0.019 15 0 "[ . 1 . 2]" 1
1206 1 56 MET H 1 57 ILE H . . 4.840 4.470 4.138 4.634 . 0 0 "[ . 1 . 2]" 1
1207 1 56 MET H 1 90 ASP HA . . 3.520 2.449 1.898 3.089 . 0 0 "[ . 1 . 2]" 1
1208 1 56 MET H 1 90 ASP HB2 . . 5.210 4.451 4.050 4.992 . 0 0 "[ . 1 . 2]" 1
1209 1 56 MET H 1 90 ASP HB3 . . 3.650 3.329 2.949 3.661 0.011 20 0 "[ . 1 . 2]" 1
1210 1 56 MET H 1 91 THR H . . 4.120 3.635 2.928 4.129 0.009 18 0 "[ . 1 . 2]" 1
1211 1 56 MET HA 1 56 MET ME . . 6.150 3.497 2.387 4.248 . 0 0 "[ . 1 . 2]" 1
1212 1 56 MET HA 1 57 ILE HB . . 6.150 5.744 5.572 5.898 . 0 0 "[ . 1 . 2]" 1
1213 1 56 MET HB3 1 90 ASP HA . . 6.150 5.087 4.525 5.925 . 0 0 "[ . 1 . 2]" 1
1214 1 56 MET ME 1 58 SER HB2 . . 6.150 5.634 4.296 6.164 0.014 18 0 "[ . 1 . 2]" 1
1215 1 57 ILE H 1 91 THR H . . 6.040 4.937 4.636 5.330 . 0 0 "[ . 1 . 2]" 1
1216 1 57 ILE HA 1 90 ASP HA . . 6.150 5.045 4.556 5.884 . 0 0 "[ . 1 . 2]" 1
1217 1 57 ILE HA 1 91 THR H . . 4.750 3.257 2.911 4.026 . 0 0 "[ . 1 . 2]" 1
1218 1 57 ILE HA 1 91 THR HB . . 6.150 3.485 2.289 5.507 . 0 0 "[ . 1 . 2]" 1
1219 1 57 ILE HA 1 91 THR MG . . 6.150 3.993 3.445 4.761 . 0 0 "[ . 1 . 2]" 1
1220 1 57 ILE HA 1 92 HIS HA . . 6.150 4.423 4.062 4.805 . 0 0 "[ . 1 . 2]" 1
1221 1 57 ILE HB 1 91 THR HB . . 6.150 4.195 2.592 4.637 . 0 0 "[ . 1 . 2]" 1
1222 1 57 ILE HG12 1 59 PHE QE . . 6.150 5.605 4.964 6.157 0.007 15 0 "[ . 1 . 2]" 1
1223 1 57 ILE HG12 1 91 THR MG . . 6.150 6.043 5.628 6.182 0.032 11 0 "[ . 1 . 2]" 1
1224 1 57 ILE HG13 1 59 PHE QD . . 6.150 6.105 5.435 6.197 0.047 19 0 "[ . 1 . 2]" 1
1225 1 57 ILE HG13 1 59 PHE QE . . 6.150 5.123 4.242 5.617 . 0 0 "[ . 1 . 2]" 1
1226 1 57 ILE HG13 1 91 THR HB . . 6.150 5.661 4.828 6.146 . 0 0 "[ . 1 . 2]" 1
1227 1 57 ILE MD 1 91 THR H . . 5.650 5.124 4.796 5.360 . 0 0 "[ . 1 . 2]" 1
1228 1 57 ILE MD 1 91 THR HB . . 6.150 4.715 3.969 6.174 0.024 3 0 "[ . 1 . 2]" 1
1229 1 57 ILE MD 1 91 THR MG . . 5.070 4.857 4.376 5.094 0.024 13 0 "[ . 1 . 2]" 1
1230 1 57 ILE MD 1 93 PHE QE . . 6.150 4.861 4.311 5.382 . 0 0 "[ . 1 . 2]" 1
1231 1 57 ILE MD 1 116 PHE QE . . 6.150 3.922 3.201 4.348 . 0 0 "[ . 1 . 2]" 1
1232 1 57 ILE MD 1 57 ILE MG . . 3.590 2.043 1.965 2.103 . 0 0 "[ . 1 . 2]" 1
1233 1 57 ILE MG 1 58 SER H . . 3.930 3.658 3.431 3.869 . 0 0 "[ . 1 . 2]" 1
1234 1 57 ILE MG 1 58 SER HA . . 6.150 5.439 5.209 5.726 . 0 0 "[ . 1 . 2]" 1
1235 1 57 ILE MG 1 91 THR H . . 4.270 3.141 1.847 4.123 . 0 0 "[ . 1 . 2]" 1
1236 1 57 ILE MG 1 91 THR HB . . 5.780 2.191 1.929 3.876 . 0 0 "[ . 1 . 2]" 1
1237 1 57 ILE MG 1 91 THR MG . . 5.670 2.539 2.115 3.244 . 0 0 "[ . 1 . 2]" 1
1238 1 57 ILE MG 1 92 HIS HA . . 6.150 5.048 4.402 5.582 . 0 0 "[ . 1 . 2]" 1
1239 1 57 ILE MG 1 93 PHE QD . . 6.150 4.137 3.326 5.296 . 0 0 "[ . 1 . 2]" 1
1240 1 57 ILE MG 1 93 PHE QE . . 6.000 2.834 2.144 4.400 . 0 0 "[ . 1 . 2]" 1
1241 1 57 ILE MG 1 116 PHE QD . . 6.150 4.538 3.898 5.187 . 0 0 "[ . 1 . 2]" 1
1242 1 57 ILE MG 1 116 PHE QE . . 6.150 3.226 2.203 4.157 . 0 0 "[ . 1 . 2]" 1
1243 1 58 SER H 1 59 PHE H . . 5.960 4.414 4.265 4.531 . 0 0 "[ . 1 . 2]" 1
1244 1 58 SER H 1 92 HIS HA . . 5.520 3.177 2.918 3.584 . 0 0 "[ . 1 . 2]" 1
1245 1 58 SER HA 1 59 PHE H . . 3.200 2.374 2.207 2.751 . 0 0 "[ . 1 . 2]" 1
1246 1 58 SER HA 1 59 PHE QB . . 6.150 4.334 4.139 4.517 . 0 0 "[ . 1 . 2]" 1
1247 1 58 SER HB2 1 59 PHE H . . 4.360 2.848 2.308 3.898 . 0 0 "[ . 1 . 2]" 1
1248 1 58 SER HB3 1 59 PHE H . . 4.300 3.582 2.130 4.134 . 0 0 "[ . 1 . 2]" 1
1249 1 59 PHE H 1 59 PHE QB . . 3.320 2.470 2.327 2.745 . 0 0 "[ . 1 . 2]" 1
1250 1 59 PHE H 1 60 GLU H . . 4.840 4.318 3.946 4.686 . 0 0 "[ . 1 . 2]" 1
1251 1 59 PHE HA 1 60 GLU H . . 3.200 2.159 1.995 2.300 . 0 0 "[ . 1 . 2]" 1
1252 1 59 PHE HA 1 92 HIS HA . . 6.150 4.360 3.654 5.223 . 0 0 "[ . 1 . 2]" 1
1253 1 59 PHE HA 1 93 PHE H . . 5.720 2.698 2.213 3.385 . 0 0 "[ . 1 . 2]" 1
1254 1 59 PHE HA 1 93 PHE QB . . 6.150 2.548 2.171 2.994 . 0 0 "[ . 1 . 2]" 1
1255 1 59 PHE HA 1 93 PHE QD . . 6.150 4.014 3.571 4.432 . 0 0 "[ . 1 . 2]" 1
1256 1 59 PHE QB 1 60 GLU H . . 3.870 3.295 2.833 3.568 . 0 0 "[ . 1 . 2]" 1
1257 1 59 PHE QB 1 95 ASN HA . . 6.150 3.711 3.105 4.337 . 0 0 "[ . 1 . 2]" 1
1258 1 59 PHE QB 1 95 ASN HB3 . . 5.810 4.184 3.715 4.843 . 0 0 "[ . 1 . 2]" 1
1259 1 59 PHE QD 1 93 PHE QB . . 6.150 2.653 2.393 2.951 . 0 0 "[ . 1 . 2]" 1
1260 1 59 PHE QD 1 94 ASP HA . . 6.150 5.085 4.285 5.958 . 0 0 "[ . 1 . 2]" 1
1261 1 59 PHE QD 1 95 ASN HA . . 6.150 3.457 2.747 4.370 . 0 0 "[ . 1 . 2]" 1
1262 1 60 GLU H 1 60 GLU HB2 . . 4.140 2.629 2.397 3.609 . 0 0 "[ . 1 . 2]" 1
1263 1 60 GLU H 1 60 GLU HG2 . . 4.150 3.266 2.451 4.216 0.066 3 0 "[ . 1 . 2]" 1
1264 1 60 GLU H 1 60 GLU HG3 . . 4.520 4.157 3.082 4.619 0.099 8 0 "[ . 1 . 2]" 1
1265 1 60 GLU H 1 93 PHE H . . 4.480 3.389 2.843 3.777 . 0 0 "[ . 1 . 2]" 1
1266 1 60 GLU H 1 94 ASP HA . . 5.070 3.623 2.761 4.226 . 0 0 "[ . 1 . 2]" 1
1267 1 60 GLU H 1 95 ASN H . . 4.850 3.447 3.043 3.952 . 0 0 "[ . 1 . 2]" 1
1268 1 60 GLU H 1 95 ASN HA . . 6.150 5.121 4.607 5.641 . 0 0 "[ . 1 . 2]" 1
1269 1 60 GLU H 1 95 ASN HB2 . . 4.410 3.420 2.878 4.018 . 0 0 "[ . 1 . 2]" 1
1270 1 60 GLU H 1 95 ASN HB3 . . 4.860 4.531 3.827 4.885 0.025 12 0 "[ . 1 . 2]" 1
1271 1 60 GLU HA 1 61 ASN HA . . 6.150 4.456 4.140 4.558 . 0 0 "[ . 1 . 2]" 1
1272 1 60 GLU HA 1 64 HIS HA . . 6.150 6.063 4.640 6.258 0.108 19 0 "[ . 1 . 2]" 1
1273 1 60 GLU HA 1 95 ASN HB2 . . 5.450 4.009 3.624 4.425 . 0 0 "[ . 1 . 2]" 1
1274 1 60 GLU HA 1 95 ASN HB3 . . 6.150 4.378 3.511 5.086 . 0 0 "[ . 1 . 2]" 1
1275 1 60 GLU HB2 1 61 ASN H . . 5.870 3.721 3.025 4.261 . 0 0 "[ . 1 . 2]" 1
1276 1 60 GLU HB2 1 64 HIS HA . . 6.150 5.672 4.255 6.176 0.026 9 0 "[ . 1 . 2]" 1
1277 1 60 GLU HB2 1 64 HIS HD2 . . 6.150 4.742 3.390 5.384 . 0 0 "[ . 1 . 2]" 1
1278 1 60 GLU HB2 1 92 HIS HA . . 6.150 4.698 4.067 5.298 . 0 0 "[ . 1 . 2]" 1
1279 1 60 GLU HB2 1 92 HIS HB2 . . 6.150 4.931 4.170 5.727 . 0 0 "[ . 1 . 2]" 1
1280 1 60 GLU HB2 1 92 HIS HB3 . . 6.150 3.305 2.497 4.016 . 0 0 "[ . 1 . 2]" 1
1281 1 60 GLU HB2 1 93 PHE H . . 4.390 4.386 4.151 4.464 0.074 7 0 "[ . 1 . 2]" 1
1282 1 60 GLU HB2 1 93 PHE QB . . 6.150 5.739 5.405 6.226 0.076 17 0 "[ . 1 . 2]" 1
1283 1 60 GLU HB3 1 64 HIS HD2 . . 6.150 4.741 3.904 5.788 . 0 0 "[ . 1 . 2]" 1
1284 1 60 GLU HG2 1 61 ASN H . . 5.980 4.743 4.073 5.417 . 0 0 "[ . 1 . 2]" 1
1285 1 60 GLU HG2 1 64 HIS HD2 . . 6.150 5.455 3.868 6.176 0.026 17 0 "[ . 1 . 2]" 1
1286 1 60 GLU HG2 1 92 HIS HA . . 6.150 4.606 3.288 5.942 . 0 0 "[ . 1 . 2]" 1
1287 1 60 GLU HG3 1 64 HIS HB2 . . 6.150 3.232 2.284 5.457 . 0 0 "[ . 1 . 2]" 1
1288 1 60 GLU HG3 1 64 HIS HB3 . . 6.150 3.668 2.223 5.647 . 0 0 "[ . 1 . 2]" 1
1289 1 60 GLU HG3 1 64 HIS HD2 . . 6.150 4.101 3.293 5.678 . 0 0 "[ . 1 . 2]" 1
1290 1 60 GLU HG3 1 92 HIS HA . . 6.150 4.883 3.887 6.162 0.012 17 0 "[ . 1 . 2]" 1
1291 1 60 GLU HG3 1 92 HIS HB2 . . 6.150 5.484 4.429 6.225 0.075 3 0 "[ . 1 . 2]" 1
1292 1 60 GLU HG3 1 92 HIS HB3 . . 6.150 3.908 3.082 4.551 . 0 0 "[ . 1 . 2]" 1
1293 1 61 ASN H 1 64 HIS HB2 . . 6.150 4.921 3.865 6.171 0.021 18 0 "[ . 1 . 2]" 1
1294 1 61 ASN H 1 64 HIS HB3 . . 6.150 3.691 2.529 5.303 . 0 0 "[ . 1 . 2]" 1
1295 1 61 ASN H 1 95 ASN HB2 . . 6.010 4.926 4.092 5.684 . 0 0 "[ . 1 . 2]" 1
1296 1 61 ASN H 1 95 ASN HB3 . . 5.810 4.455 3.397 5.346 . 0 0 "[ . 1 . 2]" 1
1297 1 61 ASN HA 1 94 ASP HA . . 6.150 4.201 3.722 4.505 . 0 0 "[ . 1 . 2]" 1
1298 1 61 ASN HA 1 95 ASN HA . . 6.150 5.588 4.529 6.166 0.016 16 0 "[ . 1 . 2]" 1
1299 1 61 ASN HB2 1 62 GLY H . . 6.150 3.511 1.920 4.604 . 0 0 "[ . 1 . 2]" 1
1300 1 62 GLY H 1 70 PHE HB2 . . 6.150 4.284 1.880 6.159 0.009 10 0 "[ . 1 . 2]" 1
1301 1 62 GLY HA2 1 70 PHE H . . 4.840 3.034 2.140 4.304 . 0 0 "[ . 1 . 2]" 1
1302 1 62 GLY HA2 1 71 ASP HA . . 5.660 5.121 4.458 5.735 0.075 19 0 "[ . 1 . 2]" 1
1303 1 63 ASP HA 1 65 GLY H . . 4.430 3.811 2.973 4.459 0.029 18 0 "[ . 1 . 2]" 1
1304 1 63 ASP HA 1 69 PRO QB . . 6.080 2.500 2.032 3.772 . 0 0 "[ . 1 . 2]" 1
1305 1 63 ASP HA 1 69 PRO QG . . 5.760 4.161 3.546 5.137 . 0 0 "[ . 1 . 2]" 1
1306 1 63 ASP HB2 1 69 PRO QB . . 6.150 3.894 2.629 5.023 . 0 0 "[ . 1 . 2]" 1
1307 1 63 ASP HB2 1 69 PRO QG . . 6.150 5.220 3.982 6.185 0.035 8 0 "[ . 1 . 2]" 1
1308 1 63 ASP HB3 1 64 HIS H . . 6.150 3.833 1.885 4.715 . 0 0 "[ . 1 . 2]" 1
1309 1 63 ASP HB3 1 69 PRO QB . . 6.150 3.942 2.191 5.430 . 0 0 "[ . 1 . 2]" 1
1310 1 63 ASP HB3 1 69 PRO QG . . 6.150 5.290 3.871 6.187 0.037 10 0 "[ . 1 . 2]" 1
1311 1 64 HIS H 1 65 GLY H . . 3.790 2.560 1.757 3.364 . 0 0 "[ . 1 . 2]" 1
1312 1 64 HIS H 1 69 PRO HA . . 6.150 4.028 2.734 6.180 0.030 16 0 "[ . 1 . 2]" 1
1313 1 64 HIS HA 1 65 GLY HA3 . . 6.150 4.451 4.226 4.741 . 0 0 "[ . 1 . 2]" 1
1314 1 64 HIS HB2 1 65 GLY H . . 5.180 4.340 3.211 4.563 . 0 0 "[ . 1 . 2]" 1
1315 1 64 HIS HB3 1 65 GLY H . . 6.130 4.485 2.938 4.727 . 0 0 "[ . 1 . 2]" 1
1316 1 64 HIS HD2 1 66 ASP HB3 . . 6.150 4.579 2.816 5.678 . 0 0 "[ . 1 . 2]" 1
1317 1 64 HIS HD2 1 68 TYR QE . . 6.150 6.175 5.860 6.249 0.099 2 0 "[ . 1 . 2]" 1
1318 1 64 HIS HD2 1 92 HIS HD2 . . 6.150 5.438 4.575 6.219 0.069 8 0 "[ . 1 . 2]" 1
1319 1 64 HIS HD2 1 92 HIS HE1 . . 6.150 3.454 2.593 4.522 . 0 0 "[ . 1 . 2]" 1
1320 1 64 HIS HE1 1 69 PRO HA . . 6.150 3.519 2.421 5.281 . 0 0 "[ . 1 . 2]" 1
1321 1 64 HIS HE1 1 70 PHE HA . . 6.150 4.880 3.896 5.440 . 0 0 "[ . 1 . 2]" 1
1322 1 64 HIS HE1 1 70 PHE HB2 . . 6.150 5.379 3.917 6.238 0.088 6 0 "[ . 1 . 2]" 1
1323 1 64 HIS HE1 1 79 HIS HE1 . . 6.150 5.845 4.700 6.178 0.028 10 0 "[ . 1 . 2]" 1
1324 1 65 GLY H 1 66 ASP H . . 3.840 2.862 2.182 3.293 . 0 0 "[ . 1 . 2]" 1
1325 1 65 GLY HA3 1 66 ASP HA . . 6.150 4.656 4.462 4.828 . 0 0 "[ . 1 . 2]" 1
1326 1 66 ASP H 1 66 ASP HB2 . . 4.020 3.287 2.204 4.102 0.082 2 0 "[ . 1 . 2]" 1
1327 1 66 ASP H 1 67 SER H . . 5.360 4.081 1.812 4.634 . 0 0 "[ . 1 . 2]" 1
1328 1 66 ASP H 1 68 TYR H . . 4.250 4.233 3.937 4.331 0.081 19 0 "[ . 1 . 2]" 1
1329 1 66 ASP HB2 1 67 SER H . . 4.990 3.211 2.122 4.457 . 0 0 "[ . 1 . 2]" 1
1330 1 66 ASP HB2 1 68 TYR QD . . 6.150 3.499 2.494 4.624 . 0 0 "[ . 1 . 2]" 1
1331 1 66 ASP HB2 1 87 LEU MD1 . . 6.150 5.252 2.509 6.175 0.025 8 0 "[ . 1 . 2]" 1
1332 1 66 ASP HB2 1 87 LEU MD2 . . 6.150 4.962 2.433 6.168 0.018 8 0 "[ . 1 . 2]" 1
1333 1 66 ASP HB3 1 67 SER H . . 4.920 3.571 2.405 4.028 . 0 0 "[ . 1 . 2]" 1
1334 1 66 ASP HB3 1 68 TYR QD . . 6.150 3.634 2.517 4.651 . 0 0 "[ . 1 . 2]" 1
1335 1 66 ASP HB3 1 87 LEU MD1 . . 6.150 4.956 3.522 6.089 . 0 0 "[ . 1 . 2]" 1
1336 1 66 ASP HB3 1 87 LEU MD2 . . 6.150 4.626 2.272 6.164 0.014 14 0 "[ . 1 . 2]" 1
1337 1 67 SER H 1 67 SER HB3 . . 3.890 3.476 2.601 4.032 0.142 7 0 "[ . 1 . 2]" 1
1338 1 67 SER H 1 68 TYR H . . 4.590 2.919 2.107 3.267 . 0 0 "[ . 1 . 2]" 1
1339 1 67 SER HA 1 69 PRO HD3 . . 6.150 3.701 3.022 4.876 . 0 0 "[ . 1 . 2]" 1
1340 1 67 SER HB2 1 68 TYR H . . 4.060 3.612 2.036 4.087 0.027 19 0 "[ . 1 . 2]" 1
1341 1 67 SER HB2 1 68 TYR QE . . 6.150 4.012 3.104 4.879 . 0 0 "[ . 1 . 2]" 1
1342 1 67 SER HB2 1 69 PRO HD2 . . 6.090 6.078 5.660 6.319 0.229 8 0 "[ . 1 . 2]" 1
1343 1 67 SER HB2 1 69 PRO HD3 . . 6.140 5.601 5.089 6.053 . 0 0 "[ . 1 . 2]" 1
1344 1 67 SER HB3 1 68 TYR H . . 4.560 4.171 2.764 4.602 0.042 5 0 "[ . 1 . 2]" 1
1345 1 67 SER HB3 1 68 TYR QD . . 6.150 4.572 2.725 5.518 . 0 0 "[ . 1 . 2]" 1
1346 1 67 SER HB3 1 68 TYR QE . . 6.150 5.087 3.182 6.145 . 0 0 "[ . 1 . 2]" 1
1347 1 68 TYR H 1 68 TYR HB3 . . 4.030 3.701 3.264 3.838 . 0 0 "[ . 1 . 2]" 1
1348 1 68 TYR H 1 68 TYR QD . . 3.720 2.864 2.205 3.483 . 0 0 "[ . 1 . 2]" 1
1349 1 68 TYR H 1 69 PRO HD2 . . 6.150 3.959 3.305 4.657 . 0 0 "[ . 1 . 2]" 1
1350 1 68 TYR H 1 69 PRO HD3 . . 6.150 3.264 2.421 4.636 . 0 0 "[ . 1 . 2]" 1
1351 1 68 TYR H 1 69 PRO QG . . 6.150 5.055 4.353 6.058 . 0 0 "[ . 1 . 2]" 1
1352 1 68 TYR HB2 1 69 PRO HD2 . . 6.150 4.547 4.040 4.898 . 0 0 "[ . 1 . 2]" 1
1353 1 68 TYR HB2 1 69 PRO HD3 . . 6.150 5.134 4.929 5.339 . 0 0 "[ . 1 . 2]" 1
1354 1 68 TYR HB2 1 79 HIS HE1 . . 6.150 4.838 3.064 5.268 . 0 0 "[ . 1 . 2]" 1
1355 1 68 TYR HB3 1 79 HIS HE1 . . 6.150 5.943 4.634 6.192 0.042 17 0 "[ . 1 . 2]" 1
1356 1 68 TYR QD 1 69 PRO HD2 . . 6.150 5.153 4.683 5.339 . 0 0 "[ . 1 . 2]" 1
1357 1 68 TYR QD 1 69 PRO HD3 . . 6.150 5.218 4.402 5.661 . 0 0 "[ . 1 . 2]" 1
1358 1 68 TYR QD 1 79 HIS HD2 . . 6.150 4.791 3.842 6.192 0.042 16 0 "[ . 1 . 2]" 1
1359 1 68 TYR QD 1 79 HIS HE1 . . 6.150 2.956 2.018 3.727 . 0 0 "[ . 1 . 2]" 1
1360 1 68 TYR QD 1 81 PHE QD . . 6.150 5.581 4.737 6.171 0.021 16 0 "[ . 1 . 2]" 1
1361 1 68 TYR QE 1 79 HIS HD2 . . 6.150 5.820 5.358 6.169 0.019 3 0 "[ . 1 . 2]" 1
1362 1 68 TYR QE 1 81 PHE QD . . 6.150 3.979 3.172 4.650 . 0 0 "[ . 1 . 2]" 1
1363 1 69 PRO HA 1 70 PHE H . . 3.280 2.664 2.220 3.393 0.113 10 0 "[ . 1 . 2]" 1
1364 1 69 PRO HA 1 70 PHE HB3 . . 6.150 5.657 4.445 6.059 . 0 0 "[ . 1 . 2]" 1
1365 1 69 PRO QB 1 70 PHE H . . 3.920 2.670 2.032 3.987 0.067 11 0 "[ . 1 . 2]" 1
1366 1 69 PRO QG 1 70 PHE H . . 3.900 3.752 2.378 3.993 0.093 6 0 "[ . 1 . 2]" 1
1367 1 70 PHE H 1 70 PHE HB2 . . 4.190 2.995 2.345 4.116 . 0 0 "[ . 1 . 2]" 1
1368 1 70 PHE H 1 70 PHE HB3 . . 3.770 3.551 2.533 3.783 0.013 5 0 "[ . 1 . 2]" 1
1369 1 70 PHE H 1 70 PHE QD . . 4.300 3.202 2.923 3.509 . 0 0 "[ . 1 . 2]" 1
1370 1 70 PHE H 1 70 PHE QE . . 4.870 4.762 4.154 4.911 0.041 3 0 "[ . 1 . 2]" 1
1371 1 70 PHE HA 1 71 ASP H . . 3.320 2.698 2.298 3.151 . 0 0 "[ . 1 . 2]" 1
1372 1 70 PHE HB2 1 71 ASP H . . 3.500 2.603 2.108 3.552 0.052 1 0 "[ . 1 . 2]" 1
1373 1 70 PHE HB2 1 72 GLY H . . 4.080 3.664 3.229 4.125 0.045 6 0 "[ . 1 . 2]" 1
1374 1 70 PHE HB3 1 71 ASP H . . 3.660 2.487 1.782 3.691 0.031 9 0 "[ . 1 . 2]" 1
1375 1 70 PHE QD 1 71 ASP H . . 4.440 3.691 2.760 4.116 . 0 0 "[ . 1 . 2]" 1
1376 1 70 PHE QD 1 76 THR MG . . 6.150 3.295 2.051 5.546 . 0 0 "[ . 1 . 2]" 1
1377 1 70 PHE QD 1 79 HIS HD2 . . 6.150 4.977 4.036 6.201 0.051 9 0 "[ . 1 . 2]" 1
1378 1 71 ASP H 1 71 ASP HB2 . . 4.030 3.811 3.354 4.046 0.016 11 0 "[ . 1 . 2]" 1
1379 1 71 ASP H 1 71 ASP HB3 . . 4.210 3.220 2.820 3.659 . 0 0 "[ . 1 . 2]" 1
1380 1 71 ASP H 1 72 GLY HA2 . . 4.450 4.293 3.737 4.570 0.120 3 0 "[ . 1 . 2]" 1
1381 1 71 ASP H 1 76 THR MG . . 6.150 5.107 4.436 6.214 0.064 20 0 "[ . 1 . 2]" 1
1382 1 71 ASP H 1 96 ALA MB . . 5.300 4.828 4.162 5.324 0.024 16 0 "[ . 1 . 2]" 1
1383 1 71 ASP HA 1 76 THR HB . . 5.720 5.160 3.012 5.852 0.132 3 0 "[ . 1 . 2]" 1
1384 1 71 ASP HA 1 96 ALA MB . . 6.150 5.786 4.796 6.205 0.055 19 0 "[ . 1 . 2]" 1
1385 1 71 ASP HB2 1 72 GLY H . . 6.150 4.298 3.622 4.553 . 0 0 "[ . 1 . 2]" 1
1386 1 71 ASP HB3 1 72 GLY H . . 4.880 4.135 2.164 4.758 . 0 0 "[ . 1 . 2]" 1
1387 1 72 GLY H 1 72 GLY HA2 . . 2.860 2.320 2.276 2.367 . 0 0 "[ . 1 . 2]" 1
1388 1 72 GLY H 1 73 PRO QD . . 6.150 4.339 3.860 4.558 . 0 0 "[ . 1 . 2]" 1
1389 1 72 GLY H 1 96 ALA MB . . 3.840 3.543 3.051 3.901 0.061 20 0 "[ . 1 . 2]" 1
1390 1 72 GLY HA2 1 96 ALA MB . . 5.870 2.872 1.963 4.554 . 0 0 "[ . 1 . 2]" 1
1391 1 73 PRO HA 1 74 ARG HB2 . . 6.150 5.223 4.229 6.007 . 0 0 "[ . 1 . 2]" 1
1392 1 73 PRO HA 1 74 ARG HB3 . . 6.150 5.631 4.654 6.215 0.065 1 0 "[ . 1 . 2]" 1
1393 1 73 PRO HA 1 74 ARG HG3 . . 6.150 5.838 5.096 6.269 0.119 12 0 "[ . 1 . 2]" 1
1394 1 73 PRO HA 1 74 ARG QD . . 5.180 4.331 3.782 5.170 . 0 0 "[ . 1 . 2]" 1
1395 1 73 PRO HA 1 96 ALA MB . . 6.150 3.215 2.250 4.413 . 0 0 "[ . 1 . 2]" 1
1396 1 73 PRO HB2 1 96 ALA MB . . 6.150 5.029 4.060 6.149 . 0 0 "[ . 1 . 2]" 1
1397 1 73 PRO HB3 1 96 ALA HA . . 6.150 5.564 4.214 6.186 0.036 14 0 "[ . 1 . 2]" 1
1398 1 73 PRO HG2 1 96 ALA MB . . 6.150 5.383 4.458 6.024 . 0 0 "[ . 1 . 2]" 1
1399 1 73 PRO QD 1 96 ALA MB . . 5.190 3.271 2.381 4.155 . 0 0 "[ . 1 . 2]" 1
1400 1 74 ARG H 1 74 ARG HG2 . . 5.500 4.392 3.084 5.217 . 0 0 "[ . 1 . 2]" 1
1401 1 74 ARG H 1 74 ARG HG3 . . 4.740 4.194 3.198 4.802 0.062 11 0 "[ . 1 . 2]" 1
1402 1 74 ARG H 1 74 ARG QD . . 4.000 3.533 2.703 4.138 0.138 12 0 "[ . 1 . 2]" 1
1403 1 74 ARG H 1 75 GLY H . . 4.940 4.454 4.216 4.695 . 0 0 "[ . 1 . 2]" 1
1404 1 74 ARG HA 1 75 GLY H . . 3.180 2.720 2.467 3.093 . 0 0 "[ . 1 . 2]" 1
1405 1 74 ARG HB2 1 75 GLY H . . 3.520 2.856 1.855 3.570 0.050 1 0 "[ . 1 . 2]" 1
1406 1 74 ARG HB3 1 75 GLY H . . 3.310 2.390 1.777 3.428 0.118 5 0 "[ . 1 . 2]" 1
1407 1 74 ARG HG2 1 75 GLY H . . 3.800 3.528 2.101 4.048 0.248 18 0 "[ . 1 . 2]" 1
1408 1 74 ARG HG3 1 75 GLY H . . 3.870 3.480 2.305 3.987 0.117 3 0 "[ . 1 . 2]" 1
1409 1 74 ARG QD 1 75 GLY H . . 6.150 4.426 2.051 4.944 . 0 0 "[ . 1 . 2]" 1
1410 1 75 GLY H 1 76 THR H . . 4.300 4.362 4.319 4.464 0.164 5 0 "[ . 1 . 2]" 1
1411 1 75 GLY H 1 77 LEU HG . . 5.460 5.461 5.089 5.560 0.100 19 0 "[ . 1 . 2]" 1
1412 1 75 GLY HA3 1 76 THR HB . . 6.150 4.512 4.270 4.823 . 0 0 "[ . 1 . 2]" 1
1413 1 76 THR H 1 76 THR HB . . 3.550 2.523 2.344 2.809 . 0 0 "[ . 1 . 2]" 1
1414 1 76 THR H 1 77 LEU H . . 6.010 4.372 4.193 4.513 . 0 0 "[ . 1 . 2]" 1
1415 1 76 THR HA 1 78 ALA H . . 4.330 3.632 3.442 3.784 . 0 0 "[ . 1 . 2]" 1
1416 1 76 THR HB 1 77 LEU H . . 4.640 4.416 4.173 4.602 . 0 0 "[ . 1 . 2]" 1
1417 1 76 THR HB 1 78 ALA H . . 5.160 5.125 4.907 5.208 0.048 2 0 "[ . 1 . 2]" 1
1418 1 76 THR MG 1 77 LEU H . . 4.700 3.247 2.885 3.487 . 0 0 "[ . 1 . 2]" 1
1419 1 76 THR MG 1 78 ALA H . . 3.990 2.902 2.637 3.059 . 0 0 "[ . 1 . 2]" 1
1420 1 76 THR MG 1 94 ASP H . . 4.830 4.793 4.512 4.903 0.073 13 0 "[ . 1 . 2]" 1
1421 1 77 LEU H 1 77 LEU HB2 . . 4.050 2.625 2.178 3.054 . 0 0 "[ . 1 . 2]" 1
1422 1 77 LEU H 1 77 LEU HB3 . . 4.060 3.661 3.481 3.762 . 0 0 "[ . 1 . 2]" 1
1423 1 77 LEU H 1 77 LEU HG . . 4.230 2.507 2.157 3.841 . 0 0 "[ . 1 . 2]" 1
1424 1 77 LEU H 1 77 LEU MD1 . . 5.300 3.782 2.808 4.057 . 0 0 "[ . 1 . 2]" 1
1425 1 77 LEU H 1 77 LEU MD2 . . 5.060 2.995 1.653 3.259 . 0 0 "[ . 1 . 2]" 1
1426 1 77 LEU H 1 78 ALA H . . 2.840 2.353 2.106 2.575 . 0 0 "[ . 1 . 2]" 1
1427 1 77 LEU H 1 99 TRP HH2 . . 6.150 5.550 5.185 6.043 . 0 0 "[ . 1 . 2]" 1
1428 1 77 LEU HA 1 78 ALA H . . 3.480 3.521 3.501 3.553 0.073 10 0 "[ . 1 . 2]" 1
1429 1 77 LEU HA 1 94 ASP HB3 . . 6.150 3.864 3.146 5.331 . 0 0 "[ . 1 . 2]" 1
1430 1 77 LEU HA 1 99 TRP HH2 . . 6.150 3.751 3.205 4.200 . 0 0 "[ . 1 . 2]" 1
1431 1 77 LEU HB2 1 94 ASP H . . 6.150 6.093 5.582 6.200 0.050 12 0 "[ . 1 . 2]" 1
1432 1 77 LEU HB2 1 99 TRP HH2 . . 6.150 3.525 2.342 4.081 . 0 0 "[ . 1 . 2]" 1
1433 1 77 LEU HB3 1 78 ALA H . . 4.420 3.814 3.173 4.274 . 0 0 "[ . 1 . 2]" 1
1434 1 77 LEU HB3 1 99 TRP HH2 . . 6.150 2.403 2.152 2.953 . 0 0 "[ . 1 . 2]" 1
1435 1 77 LEU HB3 1 99 TRP HZ2 . . 6.150 3.900 3.077 4.599 . 0 0 "[ . 1 . 2]" 1
1436 1 77 LEU HB3 1 106 PHE HB2 . . 6.150 4.872 4.182 5.694 . 0 0 "[ . 1 . 2]" 1
1437 1 77 LEU HB3 1 106 PHE HB3 . . 6.150 4.114 3.181 5.468 . 0 0 "[ . 1 . 2]" 1
1438 1 77 LEU HB3 1 106 PHE QD . . 6.150 4.479 3.962 5.625 . 0 0 "[ . 1 . 2]" 1
1439 1 77 LEU HG 1 99 TRP HH2 . . 6.150 5.269 3.999 5.998 . 0 0 "[ . 1 . 2]" 1
1440 1 77 LEU HG 1 136 TYR HB2 . . 6.150 3.553 3.060 4.287 . 0 0 "[ . 1 . 2]" 1
1441 1 77 LEU HG 1 136 TYR HB3 . . 6.150 4.960 3.426 5.824 . 0 0 "[ . 1 . 2]" 1
1442 1 77 LEU MD1 1 78 ALA H . . 4.710 4.597 4.420 4.732 0.022 5 0 "[ . 1 . 2]" 1
1443 1 77 LEU MD1 1 99 TRP HH2 . . 6.150 3.833 2.702 4.606 . 0 0 "[ . 1 . 2]" 1
1444 1 77 LEU MD1 1 106 PHE QD . . 6.150 2.975 2.317 4.227 . 0 0 "[ . 1 . 2]" 1
1445 1 77 LEU MD1 1 111 VAL MG1 . . 5.910 3.041 2.070 4.552 . 0 0 "[ . 1 . 2]" 1
1446 1 77 LEU MD1 1 111 VAL MG2 . . 6.150 3.636 2.088 5.806 . 0 0 "[ . 1 . 2]" 1
1447 1 77 LEU MD1 1 136 TYR HB3 . . 6.150 3.591 2.605 5.178 . 0 0 "[ . 1 . 2]" 1
1448 1 77 LEU MD1 1 136 TYR QD . . 6.150 2.590 2.050 4.390 . 0 0 "[ . 1 . 2]" 1
1449 1 77 LEU MD1 1 136 TYR QE . . 6.150 3.603 2.927 5.195 . 0 0 "[ . 1 . 2]" 1
1450 1 77 LEU MD2 1 78 ALA H . . 4.510 4.445 3.146 4.557 0.047 11 0 "[ . 1 . 2]" 1
1451 1 77 LEU MD2 1 97 GLU HG2 . . 6.150 4.881 4.441 6.276 0.126 18 0 "[ . 1 . 2]" 1
1452 1 77 LEU MD2 1 97 GLU HG3 . . 6.150 4.002 3.210 6.130 . 0 0 "[ . 1 . 2]" 1
1453 1 77 LEU MD2 1 99 TRP HH2 . . 6.150 4.168 3.600 4.825 . 0 0 "[ . 1 . 2]" 1
1454 1 77 LEU MD2 1 106 PHE QD . . 6.150 3.183 2.649 4.237 . 0 0 "[ . 1 . 2]" 1
1455 1 77 LEU MD2 1 111 VAL MG1 . . 6.150 4.355 3.076 5.632 . 0 0 "[ . 1 . 2]" 1
1456 1 77 LEU MD2 1 111 VAL MG2 . . 6.150 4.875 3.705 5.666 . 0 0 "[ . 1 . 2]" 1
1457 1 77 LEU MD2 1 136 TYR QD . . 6.150 4.298 3.284 4.909 . 0 0 "[ . 1 . 2]" 1
1458 1 78 ALA H 1 78 ALA MB . . 2.630 2.639 2.555 2.687 0.057 10 0 "[ . 1 . 2]" 1
1459 1 78 ALA H 1 79 HIS H . . 4.960 4.451 4.251 4.547 . 0 0 "[ . 1 . 2]" 1
1460 1 78 ALA HA 1 93 PHE HA . . 6.150 2.618 2.417 2.846 . 0 0 "[ . 1 . 2]" 1
1461 1 78 ALA HA 1 94 ASP H . . 5.370 3.076 2.303 3.595 . 0 0 "[ . 1 . 2]" 1
1462 1 78 ALA MB 1 79 HIS H . . 3.420 2.629 2.327 3.045 . 0 0 "[ . 1 . 2]" 1
1463 1 78 ALA MB 1 93 PHE HA . . 6.150 3.271 2.385 3.966 . 0 0 "[ . 1 . 2]" 1
1464 1 78 ALA MB 1 93 PHE QB . . 6.150 4.098 3.480 4.654 . 0 0 "[ . 1 . 2]" 1
1465 1 78 ALA MB 1 93 PHE QD . . 6.150 2.457 2.073 3.672 . 0 0 "[ . 1 . 2]" 1
1466 1 78 ALA MB 1 94 ASP H . . 5.830 4.052 3.283 4.773 . 0 0 "[ . 1 . 2]" 1
1467 1 78 ALA MB 1 99 TRP HZ2 . . 6.150 4.315 3.767 5.292 . 0 0 "[ . 1 . 2]" 1
1468 1 78 ALA MB 1 115 GLU H . . 4.200 4.210 3.706 4.314 0.114 6 0 "[ . 1 . 2]" 1
1469 1 78 ALA MB 1 115 GLU HG2 . . 6.150 2.580 2.108 3.065 . 0 0 "[ . 1 . 2]" 1
1470 1 78 ALA MB 1 115 GLU HG3 . . 6.150 2.289 1.864 3.351 . 0 0 "[ . 1 . 2]" 1
1471 1 79 HIS H 1 79 HIS HD2 . . 5.060 3.884 2.990 4.759 . 0 0 "[ . 1 . 2]" 1
1472 1 79 HIS H 1 80 ALA H . . 6.090 3.874 2.802 4.142 . 0 0 "[ . 1 . 2]" 1
1473 1 79 HIS H 1 80 ALA HA . . 6.150 4.754 4.352 4.908 . 0 0 "[ . 1 . 2]" 1
1474 1 79 HIS H 1 80 ALA MB . . 6.150 4.531 3.863 4.835 . 0 0 "[ . 1 . 2]" 1
1475 1 79 HIS H 1 92 HIS H . . 5.150 3.679 3.491 4.024 . 0 0 "[ . 1 . 2]" 1
1476 1 79 HIS H 1 93 PHE HA . . 5.140 3.399 3.100 3.846 . 0 0 "[ . 1 . 2]" 1
1477 1 79 HIS HB2 1 80 ALA H . . 4.530 3.701 3.117 4.492 . 0 0 "[ . 1 . 2]" 1
1478 1 79 HIS HB2 1 92 HIS HB2 . . 5.600 5.555 5.136 5.643 0.043 17 0 "[ . 1 . 2]" 1
1479 1 79 HIS HB3 1 80 ALA H . . 4.800 4.490 4.210 4.682 . 0 0 "[ . 1 . 2]" 1
1480 1 79 HIS HD2 1 80 ALA HA . . 6.150 5.427 4.703 5.764 . 0 0 "[ . 1 . 2]" 1
1481 1 79 HIS HD2 1 80 ALA MB . . 6.150 6.139 5.556 6.253 0.103 11 0 "[ . 1 . 2]" 1
1482 1 79 HIS HD2 1 92 HIS HA . . 6.150 5.360 4.868 6.057 . 0 0 "[ . 1 . 2]" 1
1483 1 79 HIS HD2 1 92 HIS HB2 . . 6.150 2.528 1.969 3.193 . 0 0 "[ . 1 . 2]" 1
1484 1 79 HIS HD2 1 92 HIS HB3 . . 6.150 3.636 3.156 4.291 . 0 0 "[ . 1 . 2]" 1
1485 1 79 HIS HE1 1 81 PHE QD . . 6.150 3.639 2.963 6.152 0.002 3 0 "[ . 1 . 2]" 1
1486 1 80 ALA HA 1 81 PHE HB2 . . 6.150 4.266 4.145 4.426 . 0 0 "[ . 1 . 2]" 1
1487 1 80 ALA HA 1 81 PHE QD . . 6.150 4.186 3.476 4.940 . 0 0 "[ . 1 . 2]" 1
1488 1 80 ALA HA 1 91 THR HA . . 6.080 2.104 1.921 2.520 . 0 0 "[ . 1 . 2]" 1
1489 1 80 ALA HA 1 91 THR HG1 . . 6.150 4.308 3.270 6.165 0.015 11 0 "[ . 1 . 2]" 1
1490 1 80 ALA HA 1 91 THR MG . . 6.150 3.202 2.547 3.686 . 0 0 "[ . 1 . 2]" 1
1491 1 80 ALA HA 1 92 HIS H . . 6.070 2.767 2.271 2.994 . 0 0 "[ . 1 . 2]" 1
1492 1 80 ALA HA 1 115 GLU HB2 . . 6.150 5.613 3.729 6.214 0.064 15 0 "[ . 1 . 2]" 1
1493 1 80 ALA MB 1 81 PHE H . . 3.650 2.572 2.193 2.933 . 0 0 "[ . 1 . 2]" 1
1494 1 80 ALA MB 1 81 PHE HA . . 6.150 4.278 4.135 4.397 . 0 0 "[ . 1 . 2]" 1
1495 1 80 ALA MB 1 81 PHE QD . . 6.150 4.964 4.496 5.301 . 0 0 "[ . 1 . 2]" 1
1496 1 80 ALA MB 1 91 THR HA . . 5.940 2.816 2.125 3.433 . 0 0 "[ . 1 . 2]" 1
1497 1 80 ALA MB 1 91 THR MG . . 5.370 2.268 2.023 2.698 . 0 0 "[ . 1 . 2]" 1
1498 1 80 ALA MB 1 115 GLU H . . 4.810 4.796 4.466 4.882 0.072 10 0 "[ . 1 . 2]" 1
1499 1 80 ALA MB 1 115 GLU HA . . 6.150 2.801 2.342 3.019 . 0 0 "[ . 1 . 2]" 1
1500 1 80 ALA MB 1 115 GLU HB2 . . 6.150 3.307 1.987 3.946 . 0 0 "[ . 1 . 2]" 1
1501 1 80 ALA MB 1 115 GLU HB3 . . 5.540 2.380 2.023 3.586 . 0 0 "[ . 1 . 2]" 1
1502 1 80 ALA MB 1 115 GLU HG2 . . 6.150 4.050 2.274 4.552 . 0 0 "[ . 1 . 2]" 1
1503 1 80 ALA MB 1 118 HIS H . . 3.600 3.596 3.501 3.670 0.070 20 0 "[ . 1 . 2]" 1
1504 1 80 ALA MB 1 118 HIS HB2 . . 6.150 2.118 2.010 2.240 . 0 0 "[ . 1 . 2]" 1
1505 1 80 ALA MB 1 118 HIS HB3 . . 6.150 2.902 2.541 3.310 . 0 0 "[ . 1 . 2]" 1
1506 1 80 ALA MB 1 118 HIS HD2 . . 6.150 3.342 2.505 4.434 . 0 0 "[ . 1 . 2]" 1
1507 1 80 ALA MB 1 119 ALA H . . 3.430 3.248 2.996 3.450 0.020 14 0 "[ . 1 . 2]" 1
1508 1 80 ALA MB 1 119 ALA HA . . 6.150 4.075 3.545 4.491 . 0 0 "[ . 1 . 2]" 1
1509 1 80 ALA MB 1 119 ALA MB . . 5.870 2.790 2.297 3.257 . 0 0 "[ . 1 . 2]" 1
1510 1 81 PHE H 1 81 PHE HB2 . . 3.110 2.120 2.046 2.237 . 0 0 "[ . 1 . 2]" 1
1511 1 81 PHE H 1 81 PHE HB3 . . 3.280 3.324 3.238 3.366 0.086 19 0 "[ . 1 . 2]" 1
1512 1 81 PHE H 1 81 PHE QD . . 3.420 3.120 2.575 3.521 0.101 7 0 "[ . 1 . 2]" 1
1513 1 81 PHE H 1 82 ALA H . . 4.640 4.579 4.487 4.644 0.004 19 0 "[ . 1 . 2]" 1
1514 1 81 PHE H 1 89 GLY HA3 . . 6.040 5.748 5.418 6.024 . 0 0 "[ . 1 . 2]" 1
1515 1 81 PHE H 1 90 ASP H . . 4.000 3.933 3.678 4.067 0.067 12 0 "[ . 1 . 2]" 1
1516 1 81 PHE H 1 91 THR HA . . 4.420 3.237 2.972 3.646 . 0 0 "[ . 1 . 2]" 1
1517 1 81 PHE H 1 91 THR MG . . 4.830 4.526 2.969 4.913 0.083 10 0 "[ . 1 . 2]" 1
1518 1 81 PHE H 1 92 HIS H . . 4.660 4.655 4.332 4.734 0.074 16 0 "[ . 1 . 2]" 1
1519 1 81 PHE HA 1 82 ALA H . . 2.620 2.302 2.141 2.513 . 0 0 "[ . 1 . 2]" 1
1520 1 81 PHE HB2 1 82 ALA H . . 4.030 4.037 3.885 4.078 0.048 14 0 "[ . 1 . 2]" 1
1521 1 81 PHE HB2 1 90 ASP H . . 2.860 2.491 2.375 2.657 . 0 0 "[ . 1 . 2]" 1
1522 1 81 PHE HB3 1 82 ALA H . . 3.700 2.803 2.581 2.959 . 0 0 "[ . 1 . 2]" 1
1523 1 81 PHE HB3 1 88 GLY H . . 4.420 4.412 3.762 4.515 0.095 6 0 "[ . 1 . 2]" 1
1524 1 81 PHE HB3 1 88 GLY HA3 . . 6.150 3.964 3.811 4.151 . 0 0 "[ . 1 . 2]" 1
1525 1 81 PHE HB3 1 89 GLY H . . 3.130 2.206 2.034 2.353 . 0 0 "[ . 1 . 2]" 1
1526 1 81 PHE HB3 1 90 ASP H . . 4.480 3.190 2.648 3.606 . 0 0 "[ . 1 . 2]" 1
1527 1 81 PHE QD 1 82 ALA H . . 4.340 2.857 2.144 3.481 . 0 0 "[ . 1 . 2]" 1
1528 1 81 PHE QD 1 87 LEU HB2 . . 6.150 3.759 3.461 4.081 . 0 0 "[ . 1 . 2]" 1
1529 1 81 PHE QD 1 87 LEU HB3 . . 6.150 3.431 3.087 3.662 . 0 0 "[ . 1 . 2]" 1
1530 1 81 PHE QD 1 87 LEU MD1 . . 6.150 4.375 2.551 5.218 . 0 0 "[ . 1 . 2]" 1
1531 1 81 PHE QD 1 87 LEU MD2 . . 6.150 4.348 3.931 4.889 . 0 0 "[ . 1 . 2]" 1
1532 1 81 PHE QD 1 89 GLY H . . 3.970 3.951 3.499 4.040 0.070 8 0 "[ . 1 . 2]" 1
1533 1 81 PHE QD 1 90 ASP H . . 4.070 4.053 3.805 4.161 0.091 7 0 "[ . 1 . 2]" 1
1534 1 81 PHE QD 1 92 HIS HE1 . . 6.150 3.728 2.817 4.988 . 0 0 "[ . 1 . 2]" 1
1535 1 81 PHE QE 1 87 LEU HA . . 6.150 4.906 4.649 5.174 . 0 0 "[ . 1 . 2]" 1
1536 1 81 PHE QE 1 87 LEU MD1 . . 6.150 3.088 2.676 4.161 . 0 0 "[ . 1 . 2]" 1
1537 1 81 PHE QE 1 87 LEU MD2 . . 6.150 3.255 2.629 4.118 . 0 0 "[ . 1 . 2]" 1
1538 1 81 PHE QE 1 92 HIS HE1 . . 6.150 3.052 2.377 4.248 . 0 0 "[ . 1 . 2]" 1
1539 1 82 ALA H 1 82 ALA MB . . 2.620 2.206 2.157 2.257 . 0 0 "[ . 1 . 2]" 1
1540 1 82 ALA H 1 83 PRO HD2 . . 5.490 4.835 4.768 4.901 . 0 0 "[ . 1 . 2]" 1
1541 1 82 ALA HA 1 83 PRO HB2 . . 6.150 5.865 5.784 5.933 . 0 0 "[ . 1 . 2]" 1
1542 1 82 ALA HA 1 83 PRO HB3 . . 6.150 5.184 5.034 5.264 . 0 0 "[ . 1 . 2]" 1
1543 1 82 ALA HA 1 121 GLY H . . 4.580 4.460 4.182 4.610 0.030 9 0 "[ . 1 . 2]" 1
1544 1 82 ALA MB 1 83 PRO HD2 . . 6.070 2.150 2.092 2.225 . 0 0 "[ . 1 . 2]" 1
1545 1 82 ALA MB 1 83 PRO HD3 . . 6.010 3.556 3.472 3.606 . 0 0 "[ . 1 . 2]" 1
1546 1 82 ALA MB 1 83 PRO HG2 . . 6.150 3.460 3.229 3.672 . 0 0 "[ . 1 . 2]" 1
1547 1 83 PRO HA 1 84 GLY H . . 2.900 2.226 2.121 2.305 . 0 0 "[ . 1 . 2]" 1
1548 1 83 PRO HB2 1 84 GLY H . . 4.600 3.231 2.955 3.458 . 0 0 "[ . 1 . 2]" 1
1549 1 83 PRO HB3 1 84 GLY H . . 4.550 3.779 3.579 3.975 . 0 0 "[ . 1 . 2]" 1
1550 1 83 PRO HB3 1 121 GLY H . . 6.130 4.575 4.094 4.938 . 0 0 "[ . 1 . 2]" 1
1551 1 83 PRO HD2 1 121 GLY H . . 3.750 3.765 3.684 3.835 0.085 12 0 "[ . 1 . 2]" 1
1552 1 83 PRO HG2 1 121 GLY HA3 . . 6.150 4.074 3.763 4.385 . 0 0 "[ . 1 . 2]" 1
1553 1 83 PRO HG3 1 121 GLY H . . 3.690 3.722 3.698 3.762 0.072 12 0 "[ . 1 . 2]" 1
1554 1 83 PRO HG3 1 121 GLY HA3 . . 6.150 2.742 2.411 3.113 . 0 0 "[ . 1 . 2]" 1
1555 1 84 GLY H 1 85 GLU H . . 4.380 4.145 3.719 4.360 . 0 0 "[ . 1 . 2]" 1
1556 1 84 GLY H 1 88 GLY HA3 . . 4.100 3.140 2.598 3.592 . 0 0 "[ . 1 . 2]" 1
1557 1 84 GLY H 1 89 GLY H . . 4.060 3.930 3.652 4.122 0.062 12 0 "[ . 1 . 2]" 1
1558 1 84 GLY HA3 1 85 GLU H . . 3.130 2.218 2.024 2.502 . 0 0 "[ . 1 . 2]" 1
1559 1 85 GLU H 1 85 GLU HB2 . . 3.640 2.940 2.370 3.707 0.067 7 0 "[ . 1 . 2]" 1
1560 1 85 GLU H 1 85 GLU HB3 . . 3.640 3.466 2.769 3.728 0.088 10 0 "[ . 1 . 2]" 1
1561 1 85 GLU H 1 85 GLU QG . . 3.310 2.614 1.779 3.340 0.030 11 0 "[ . 1 . 2]" 1
1562 1 85 GLU H 1 86 GLY H . . 3.980 3.079 2.167 4.108 0.128 7 0 "[ . 1 . 2]" 1
1563 1 85 GLU H 1 88 GLY HA3 . . 4.530 3.068 2.512 3.604 . 0 0 "[ . 1 . 2]" 1
1564 1 85 GLU HA 1 86 GLY HA3 . . 5.420 5.304 4.455 5.416 . 0 0 "[ . 1 . 2]" 1
1565 1 85 GLU HB2 1 86 GLY H . . 3.810 2.288 1.879 3.391 . 0 0 "[ . 1 . 2]" 1
1566 1 85 GLU HB3 1 86 GLY H . . 4.070 3.061 2.115 4.096 0.026 12 0 "[ . 1 . 2]" 1
1567 1 85 GLU QG 1 86 GLY H . . 4.130 3.249 1.835 4.148 0.018 7 0 "[ . 1 . 2]" 1
1568 1 86 GLY H 1 87 LEU HA . . 5.740 5.738 5.574 5.810 0.070 7 0 "[ . 1 . 2]" 1
1569 1 86 GLY HA3 1 87 LEU HA . . 6.150 4.481 4.409 4.535 . 0 0 "[ . 1 . 2]" 1
1570 1 87 LEU H 1 88 GLY H . . 3.430 2.687 2.411 2.987 . 0 0 "[ . 1 . 2]" 1
1571 1 87 LEU HA 1 87 LEU MD1 . . 4.800 3.764 2.060 3.994 . 0 0 "[ . 1 . 2]" 1
1572 1 87 LEU HA 1 88 GLY H . . 3.540 3.512 3.402 3.727 0.187 10 0 "[ . 1 . 2]" 1
1573 1 87 LEU HA 1 90 ASP HB3 . . 6.150 4.420 4.090 4.835 . 0 0 "[ . 1 . 2]" 1
1574 1 87 LEU HB2 1 88 GLY H . . 3.680 2.734 2.478 3.499 . 0 0 "[ . 1 . 2]" 1
1575 1 87 LEU HB2 1 90 ASP H . . 5.540 5.510 5.352 5.560 0.020 2 0 "[ . 1 . 2]" 1
1576 1 87 LEU HB3 1 88 GLY H . . 6.150 3.715 2.632 4.264 . 0 0 "[ . 1 . 2]" 1
1577 1 87 LEU HB3 1 90 ASP H . . 5.410 4.799 4.262 5.043 . 0 0 "[ . 1 . 2]" 1
1578 1 87 LEU MD1 1 88 GLY H . . 4.190 4.235 4.167 4.313 0.123 7 0 "[ . 1 . 2]" 1
1579 1 87 LEU MD1 1 88 GLY HA3 . . 6.150 6.086 5.860 6.210 0.060 5 0 "[ . 1 . 2]" 1
1580 1 87 LEU MD1 1 92 HIS HE1 . . 6.150 4.960 2.292 6.074 . 0 0 "[ . 1 . 2]" 1
1581 1 87 LEU MD2 1 90 ASP H . . 6.150 5.648 5.215 6.032 . 0 0 "[ . 1 . 2]" 1
1582 1 87 LEU MD2 1 90 ASP HB2 . . 6.150 4.192 3.480 4.690 . 0 0 "[ . 1 . 2]" 1
1583 1 87 LEU MD2 1 92 HIS HE1 . . 6.150 3.361 2.259 4.449 . 0 0 "[ . 1 . 2]" 1
1584 1 88 GLY H 1 88 GLY HA3 . . 2.850 2.337 2.193 2.455 . 0 0 "[ . 1 . 2]" 1
1585 1 89 GLY H 1 90 ASP H . . 4.070 2.977 2.761 3.222 . 0 0 "[ . 1 . 2]" 1
1586 1 89 GLY H 1 119 ALA MB . . 3.840 3.874 3.821 3.907 0.067 10 0 "[ . 1 . 2]" 1
1587 1 89 GLY HA3 1 119 ALA MB . . 6.150 3.026 2.513 3.303 . 0 0 "[ . 1 . 2]" 1
1588 1 90 ASP H 1 90 ASP HB2 . . 3.880 2.530 2.397 2.603 . 0 0 "[ . 1 . 2]" 1
1589 1 90 ASP H 1 90 ASP HB3 . . 3.580 3.631 3.589 3.718 0.138 6 0 "[ . 1 . 2]" 1
1590 1 90 ASP H 1 91 THR H . . 4.610 4.621 4.524 4.671 0.061 10 0 "[ . 1 . 2]" 1
1591 1 90 ASP HB2 1 91 THR H . . 5.740 3.957 3.410 4.213 . 0 0 "[ . 1 . 2]" 1
1592 1 90 ASP HB3 1 91 THR H . . 3.750 2.887 2.160 3.239 . 0 0 "[ . 1 . 2]" 1
1593 1 90 ASP HB3 1 91 THR MG . . 6.150 5.812 4.674 6.194 0.044 13 0 "[ . 1 . 2]" 1
1594 1 91 THR H 1 91 THR HB . . 3.930 2.700 2.305 3.889 . 0 0 "[ . 1 . 2]" 1
1595 1 91 THR H 1 91 THR HG1 . . 4.960 3.725 2.819 4.139 . 0 0 "[ . 1 . 2]" 1
1596 1 91 THR H 1 91 THR MG . . 4.540 3.649 2.600 3.943 . 0 0 "[ . 1 . 2]" 1
1597 1 91 THR HA 1 92 HIS HA . . 6.150 4.397 4.318 4.450 . 0 0 "[ . 1 . 2]" 1
1598 1 91 THR HB 1 93 PHE QE . . 6.150 3.995 2.245 5.063 . 0 0 "[ . 1 . 2]" 1
1599 1 91 THR HB 1 115 GLU HB3 . . 6.150 5.025 3.933 6.205 0.055 7 0 "[ . 1 . 2]" 1
1600 1 91 THR HB 1 116 PHE QD . . 6.150 5.185 4.106 6.134 . 0 0 "[ . 1 . 2]" 1
1601 1 91 THR HB 1 116 PHE QE . . 6.150 4.756 3.326 6.159 0.009 3 0 "[ . 1 . 2]" 1
1602 1 91 THR MG 1 92 HIS H . . 6.150 2.794 2.329 3.974 . 0 0 "[ . 1 . 2]" 1
1603 1 91 THR MG 1 93 PHE HZ . . 6.150 3.126 2.421 5.609 . 0 0 "[ . 1 . 2]" 1
1604 1 91 THR MG 1 93 PHE QD . . 6.150 3.746 3.185 6.125 . 0 0 "[ . 1 . 2]" 1
1605 1 91 THR MG 1 93 PHE QE . . 6.150 2.830 2.239 5.092 . 0 0 "[ . 1 . 2]" 1
1606 1 91 THR MG 1 112 ALA HA . . 6.150 4.505 3.775 6.077 . 0 0 "[ . 1 . 2]" 1
1607 1 91 THR MG 1 115 GLU HA . . 6.150 4.476 4.142 5.201 . 0 0 "[ . 1 . 2]" 1
1608 1 91 THR MG 1 115 GLU HB3 . . 6.150 2.732 2.049 5.445 . 0 0 "[ . 1 . 2]" 1
1609 1 91 THR MG 1 115 GLU HG2 . . 6.150 4.167 2.433 4.883 . 0 0 "[ . 1 . 2]" 1
1610 1 91 THR MG 1 115 GLU HG3 . . 6.150 3.732 2.761 5.398 . 0 0 "[ . 1 . 2]" 1
1611 1 91 THR MG 1 116 PHE QD . . 6.150 4.019 2.360 5.016 . 0 0 "[ . 1 . 2]" 1
1612 1 91 THR MG 1 116 PHE QE . . 6.150 4.027 2.253 5.452 . 0 0 "[ . 1 . 2]" 1
1613 1 92 HIS H 1 93 PHE HZ . . 6.150 6.183 6.156 6.239 0.089 16 0 "[ . 1 . 2]" 1
1614 1 92 HIS HB2 1 93 PHE H . . 6.150 4.155 3.560 4.478 . 0 0 "[ . 1 . 2]" 1
1615 1 92 HIS HD2 1 93 PHE H . . 5.790 4.560 4.201 4.923 . 0 0 "[ . 1 . 2]" 1
1616 1 93 PHE H 1 93 PHE QD . . 4.130 3.023 2.190 3.728 . 0 0 "[ . 1 . 2]" 1
1617 1 93 PHE H 1 94 ASP H . . 4.890 4.541 4.228 4.697 . 0 0 "[ . 1 . 2]" 1
1618 1 93 PHE HA 1 94 ASP H . . 3.450 2.240 2.058 2.412 . 0 0 "[ . 1 . 2]" 1
1619 1 93 PHE HA 1 94 ASP HB2 . . 6.150 4.377 3.838 5.623 . 0 0 "[ . 1 . 2]" 1
1620 1 93 PHE HA 1 94 ASP HB3 . . 5.410 5.021 4.259 5.495 0.085 3 0 "[ . 1 . 2]" 1
1621 1 93 PHE HZ 1 108 LEU MD2 . . 6.150 4.764 3.385 6.138 . 0 0 "[ . 1 . 2]" 1
1622 1 93 PHE HZ 1 111 VAL MG1 . . 6.150 5.577 4.083 6.209 0.059 7 0 "[ . 1 . 2]" 1
1623 1 93 PHE HZ 1 112 ALA H . . 6.150 4.850 4.209 5.851 . 0 0 "[ . 1 . 2]" 1
1624 1 93 PHE HZ 1 112 ALA HA . . 6.070 2.583 2.120 3.690 . 0 0 "[ . 1 . 2]" 1
1625 1 93 PHE HZ 1 112 ALA MB . . 6.150 3.164 2.538 3.835 . 0 0 "[ . 1 . 2]" 1
1626 1 93 PHE HZ 1 115 GLU HG3 . . 6.150 4.058 2.791 5.834 . 0 0 "[ . 1 . 2]" 1
1627 1 93 PHE QB 1 94 ASP H . . 3.500 2.956 2.716 3.325 . 0 0 "[ . 1 . 2]" 1
1628 1 93 PHE QB 1 94 ASP HA . . 6.150 4.479 4.163 4.699 . 0 0 "[ . 1 . 2]" 1
1629 1 93 PHE QB 1 99 TRP HZ2 . . 6.150 3.480 2.980 4.144 . 0 0 "[ . 1 . 2]" 1
1630 1 93 PHE QD 1 94 ASP H . . 4.970 3.755 3.102 4.448 . 0 0 "[ . 1 . 2]" 1
1631 1 93 PHE QD 1 99 TRP HH2 . . 6.150 3.568 2.827 4.436 . 0 0 "[ . 1 . 2]" 1
1632 1 93 PHE QD 1 99 TRP HZ2 . . 6.150 3.857 3.258 4.369 . 0 0 "[ . 1 . 2]" 1
1633 1 93 PHE QD 1 108 LEU MD2 . . 6.150 4.896 3.273 5.830 . 0 0 "[ . 1 . 2]" 1
1634 1 93 PHE QD 1 111 VAL MG2 . . 6.150 3.599 2.684 5.262 . 0 0 "[ . 1 . 2]" 1
1635 1 93 PHE QD 1 112 ALA HA . . 6.150 5.199 4.484 5.504 . 0 0 "[ . 1 . 2]" 1
1636 1 93 PHE QD 1 112 ALA MB . . 6.150 5.143 4.279 5.499 . 0 0 "[ . 1 . 2]" 1
1637 1 93 PHE QD 1 115 GLU HG3 . . 6.150 4.631 3.535 5.883 . 0 0 "[ . 1 . 2]" 1
1638 1 93 PHE QE 1 99 TRP HH2 . . 6.150 4.811 4.081 5.610 . 0 0 "[ . 1 . 2]" 1
1639 1 93 PHE QE 1 108 LEU MD2 . . 6.150 4.340 2.348 5.495 . 0 0 "[ . 1 . 2]" 1
1640 1 93 PHE QE 1 111 VAL MG1 . . 6.150 3.736 2.263 4.783 . 0 0 "[ . 1 . 2]" 1
1641 1 93 PHE QE 1 111 VAL MG2 . . 6.150 3.050 1.990 5.525 . 0 0 "[ . 1 . 2]" 1
1642 1 93 PHE QE 1 112 ALA H . . 6.150 4.155 3.483 4.820 . 0 0 "[ . 1 . 2]" 1
1643 1 93 PHE QE 1 112 ALA HA . . 5.800 3.035 2.404 3.383 . 0 0 "[ . 1 . 2]" 1
1644 1 93 PHE QE 1 112 ALA MB . . 6.150 3.565 2.323 4.068 . 0 0 "[ . 1 . 2]" 1
1645 1 93 PHE QE 1 115 GLU HG2 . . 6.150 3.763 2.808 5.689 . 0 0 "[ . 1 . 2]" 1
1646 1 93 PHE QE 1 115 GLU HG3 . . 6.150 3.340 2.277 4.823 . 0 0 "[ . 1 . 2]" 1
1647 1 93 PHE QE 1 116 PHE QD . . 6.150 5.544 4.703 6.155 0.005 14 0 "[ . 1 . 2]" 1
1648 1 94 ASP H 1 94 ASP HB2 . . 3.700 2.410 1.988 3.754 0.054 10 0 "[ . 1 . 2]" 1
1649 1 94 ASP H 1 94 ASP HB3 . . 3.470 2.855 2.428 3.466 . 0 0 "[ . 1 . 2]" 1
1650 1 94 ASP H 1 99 TRP HZ2 . . 3.870 3.011 2.443 3.464 . 0 0 "[ . 1 . 2]" 1
1651 1 94 ASP HA 1 95 ASN HB2 . . 6.150 4.347 3.657 4.605 . 0 0 "[ . 1 . 2]" 1
1652 1 94 ASP HA 1 95 ASN HB3 . . 6.150 4.666 4.161 5.047 . 0 0 "[ . 1 . 2]" 1
1653 1 94 ASP HA 1 96 ALA MB . . 6.150 4.658 3.705 5.180 . 0 0 "[ . 1 . 2]" 1
1654 1 94 ASP HA 1 97 GLU HG3 . . 6.150 6.091 4.640 6.223 0.073 1 0 "[ . 1 . 2]" 1
1655 1 94 ASP HB2 1 97 GLU HG3 . . 6.150 4.879 3.703 5.734 . 0 0 "[ . 1 . 2]" 1
1656 1 94 ASP HB3 1 97 GLU HG2 . . 6.150 3.115 2.292 5.601 . 0 0 "[ . 1 . 2]" 1
1657 1 94 ASP HB3 1 97 GLU HG3 . . 6.150 3.840 2.436 6.209 0.059 10 0 "[ . 1 . 2]" 1
1658 1 95 ASN HA 1 99 TRP HD1 . . 6.150 4.129 3.553 4.698 . 0 0 "[ . 1 . 2]" 1
1659 1 95 ASN HA 1 99 TRP HE1 . . 6.150 3.099 2.407 4.179 . 0 0 "[ . 1 . 2]" 1
1660 1 95 ASN HB2 1 95 ASN HD22 . . 3.700 3.742 3.480 4.071 0.371 11 0 "[ . 1 . 2]" 1
1661 1 96 ALA H 1 97 GLU H . . 3.500 2.756 2.333 2.960 . 0 0 "[ . 1 . 2]" 1
1662 1 96 ALA MB 1 97 GLU H . . 3.350 3.212 2.374 3.442 0.092 5 0 "[ . 1 . 2]" 1
1663 1 96 ALA MB 1 97 GLU HB2 . . 6.150 5.150 4.816 5.414 . 0 0 "[ . 1 . 2]" 1
1664 1 97 GLU H 1 97 GLU HB2 . . 3.720 3.666 2.811 3.831 0.111 4 0 "[ . 1 . 2]" 1
1665 1 97 GLU H 1 97 GLU HB3 . . 4.180 3.317 3.141 3.837 . 0 0 "[ . 1 . 2]" 1
1666 1 97 GLU H 1 97 GLU HG2 . . 3.390 2.127 1.792 3.261 . 0 0 "[ . 1 . 2]" 1
1667 1 97 GLU H 1 97 GLU HG3 . . 3.340 3.287 2.701 3.429 0.089 13 0 "[ . 1 . 2]" 1
1668 1 97 GLU H 1 98 LYS QE . . 6.150 5.970 5.037 6.232 0.082 15 0 "[ . 1 . 2]" 1
1669 1 97 GLU HA 1 98 LYS H . . 3.420 2.557 2.110 2.940 . 0 0 "[ . 1 . 2]" 1
1670 1 97 GLU HA 1 98 LYS QG . . 6.150 3.642 2.463 4.533 . 0 0 "[ . 1 . 2]" 1
1671 1 97 GLU HB2 1 98 LYS H . . 4.000 2.187 1.807 2.789 . 0 0 "[ . 1 . 2]" 1
1672 1 97 GLU HB2 1 99 TRP HD1 . . 6.150 5.920 4.257 6.204 0.054 14 0 "[ . 1 . 2]" 1
1673 1 97 GLU HB2 1 99 TRP HZ2 . . 6.150 5.544 3.652 6.189 0.039 17 0 "[ . 1 . 2]" 1
1674 1 97 GLU HB2 1 106 PHE QD . . 6.150 3.073 2.161 4.002 . 0 0 "[ . 1 . 2]" 1
1675 1 97 GLU HB3 1 98 LYS H . . 6.150 3.379 1.997 3.588 . 0 0 "[ . 1 . 2]" 1
1676 1 97 GLU HG2 1 98 LYS QG . . 6.110 5.607 5.077 5.976 . 0 0 "[ . 1 . 2]" 1
1677 1 97 GLU HG3 1 99 TRP HD1 . . 6.150 5.186 4.588 6.217 0.067 5 0 "[ . 1 . 2]" 1
1678 1 97 GLU HG3 1 99 TRP HZ2 . . 6.150 3.472 2.786 4.622 . 0 0 "[ . 1 . 2]" 1
1679 1 97 GLU HG3 1 106 PHE QD . . 6.150 3.303 2.477 5.199 . 0 0 "[ . 1 . 2]" 1
1680 1 98 LYS H 1 98 LYS HB2 . . 4.150 3.307 2.675 3.733 . 0 0 "[ . 1 . 2]" 1
1681 1 98 LYS H 1 98 LYS HB3 . . 4.180 3.301 2.712 3.859 . 0 0 "[ . 1 . 2]" 1
1682 1 98 LYS H 1 98 LYS QG . . 4.560 2.032 1.791 2.623 . 0 0 "[ . 1 . 2]" 1
1683 1 98 LYS H 1 98 LYS QD . . 4.160 3.715 2.474 4.184 0.024 5 0 "[ . 1 . 2]" 1
1684 1 98 LYS H 1 99 TRP H . . 5.040 4.484 4.174 4.630 . 0 0 "[ . 1 . 2]" 1
1685 1 98 LYS HA 1 99 TRP H . . 3.270 2.105 1.811 2.299 . 0 0 "[ . 1 . 2]" 1
1686 1 98 LYS HB2 1 99 TRP H . . 4.280 2.967 2.399 4.075 . 0 0 "[ . 1 . 2]" 1
1687 1 98 LYS HB3 1 98 LYS QE . . 4.860 3.155 2.105 4.352 . 0 0 "[ . 1 . 2]" 1
1688 1 98 LYS HB3 1 99 TRP H . . 3.650 3.176 2.413 3.736 0.086 12 0 "[ . 1 . 2]" 1
1689 1 98 LYS HB3 1 99 TRP HA . . 6.150 5.271 4.735 5.776 . 0 0 "[ . 1 . 2]" 1
1690 1 98 LYS HB3 1 99 TRP HB2 . . 6.150 5.817 5.186 6.200 0.050 11 0 "[ . 1 . 2]" 1
1691 1 98 LYS HB3 1 100 THR H . . 6.130 6.195 5.790 6.300 0.170 6 0 "[ . 1 . 2]" 1
1692 1 98 LYS HB3 1 100 THR HB . . 6.150 5.621 5.021 6.168 0.018 7 0 "[ . 1 . 2]" 1
1693 1 98 LYS HB3 1 100 THR MG . . 6.150 5.438 3.875 6.203 0.053 7 0 "[ . 1 . 2]" 1
1694 1 98 LYS HB3 1 105 GLY HA3 . . 6.050 4.619 3.790 5.566 . 0 0 "[ . 1 . 2]" 1
1695 1 98 LYS QG 1 99 TRP H . . 4.080 4.019 3.700 4.243 0.163 14 0 "[ . 1 . 2]" 1
1696 1 98 LYS QG 1 105 GLY HA3 . . 6.150 3.659 2.161 5.723 . 0 0 "[ . 1 . 2]" 1
1697 1 98 LYS QD 1 106 PHE QD . . 6.150 5.261 3.084 6.188 0.038 1 0 "[ . 1 . 2]" 1
1698 1 99 TRP H 1 99 TRP HB2 . . 3.420 2.701 2.487 3.040 . 0 0 "[ . 1 . 2]" 1
1699 1 99 TRP H 1 99 TRP HB3 . . 3.950 3.814 3.662 3.969 0.019 14 0 "[ . 1 . 2]" 1
1700 1 99 TRP H 1 99 TRP HD1 . . 4.110 3.453 2.388 3.847 . 0 0 "[ . 1 . 2]" 1
1701 1 99 TRP H 1 99 TRP HE3 . . 5.270 5.277 5.140 5.351 0.081 5 0 "[ . 1 . 2]" 1
1702 1 99 TRP H 1 100 THR H . . 5.000 4.213 3.847 4.639 . 0 0 "[ . 1 . 2]" 1
1703 1 99 TRP HA 1 100 THR H . . 3.280 2.134 2.001 2.352 . 0 0 "[ . 1 . 2]" 1
1704 1 99 TRP HA 1 100 THR MG . . 6.150 3.800 3.293 4.123 . 0 0 "[ . 1 . 2]" 1
1705 1 99 TRP HA 1 106 PHE H . . 4.070 3.287 2.404 4.084 0.014 20 0 "[ . 1 . 2]" 1
1706 1 99 TRP HA 1 106 PHE HB2 . . 6.150 3.226 2.626 3.773 . 0 0 "[ . 1 . 2]" 1
1707 1 99 TRP HA 1 106 PHE QD . . 6.150 4.582 3.685 5.353 . 0 0 "[ . 1 . 2]" 1
1708 1 99 TRP HB2 1 100 THR H . . 4.540 4.242 3.797 4.537 . 0 0 "[ . 1 . 2]" 1
1709 1 99 TRP HB2 1 108 LEU MD1 . . 6.150 4.357 3.471 6.169 0.019 10 0 "[ . 1 . 2]" 1
1710 1 99 TRP HE3 1 100 THR H . . 3.850 3.538 2.986 3.893 0.043 6 0 "[ . 1 . 2]" 1
1711 1 99 TRP HE3 1 106 PHE HB2 . . 6.150 3.344 2.753 4.051 . 0 0 "[ . 1 . 2]" 1
1712 1 99 TRP HE3 1 106 PHE HB3 . . 6.150 3.959 3.586 4.569 . 0 0 "[ . 1 . 2]" 1
1713 1 99 TRP HE3 1 108 LEU HA . . 6.150 3.035 2.635 3.686 . 0 0 "[ . 1 . 2]" 1
1714 1 99 TRP HE3 1 108 LEU HB2 . . 6.150 3.213 2.695 4.968 . 0 0 "[ . 1 . 2]" 1
1715 1 99 TRP HE3 1 108 LEU MD2 . . 6.150 4.940 2.755 5.557 . 0 0 "[ . 1 . 2]" 1
1716 1 99 TRP HE3 1 111 VAL MG1 . . 6.150 4.656 3.608 5.200 . 0 0 "[ . 1 . 2]" 1
1717 1 99 TRP HH2 1 106 PHE HB2 . . 6.150 4.545 3.951 4.982 . 0 0 "[ . 1 . 2]" 1
1718 1 99 TRP HH2 1 111 VAL MG1 . . 6.150 2.607 2.128 3.901 . 0 0 "[ . 1 . 2]" 1
1719 1 99 TRP HH2 1 111 VAL MG2 . . 6.150 2.653 2.220 3.405 . 0 0 "[ . 1 . 2]" 1
1720 1 99 TRP HZ3 1 106 PHE HA . . 6.150 5.075 4.366 5.601 . 0 0 "[ . 1 . 2]" 1
1721 1 99 TRP HZ3 1 106 PHE HB2 . . 6.150 3.567 3.165 4.157 . 0 0 "[ . 1 . 2]" 1
1722 1 99 TRP HZ3 1 108 LEU HA . . 6.150 2.928 2.576 3.880 . 0 0 "[ . 1 . 2]" 1
1723 1 99 TRP HZ3 1 108 LEU MD2 . . 6.150 5.496 3.886 6.161 0.011 8 0 "[ . 1 . 2]" 1
1724 1 99 TRP HZ3 1 111 VAL HB . . 6.150 3.895 2.512 4.835 . 0 0 "[ . 1 . 2]" 1
1725 1 99 TRP HZ3 1 111 VAL MG1 . . 6.150 2.668 2.168 3.208 . 0 0 "[ . 1 . 2]" 1
1726 1 99 TRP HZ3 1 111 VAL MG2 . . 6.150 2.419 2.046 4.066 . 0 0 "[ . 1 . 2]" 1
1727 1 100 THR H 1 100 THR MG . . 4.180 2.437 2.008 2.828 . 0 0 "[ . 1 . 2]" 1
1728 1 100 THR H 1 101 MET H . . 4.580 4.378 4.033 4.535 . 0 0 "[ . 1 . 2]" 1
1729 1 100 THR H 1 106 PHE H . . 3.620 3.620 3.310 3.692 0.072 15 0 "[ . 1 . 2]" 1
1730 1 100 THR H 1 107 ASN HA . . 3.830 3.525 3.217 3.894 0.064 16 0 "[ . 1 . 2]" 1
1731 1 100 THR HB 1 101 MET H . . 6.150 3.691 3.507 3.988 . 0 0 "[ . 1 . 2]" 1
1732 1 100 THR MG 1 101 MET H . . 4.740 3.165 2.723 4.042 . 0 0 "[ . 1 . 2]" 1
1733 1 100 THR MG 1 101 MET HA . . 6.150 3.883 3.337 4.663 . 0 0 "[ . 1 . 2]" 1
1734 1 100 THR MG 1 102 GLY H . . 4.200 2.480 1.718 3.689 . 0 0 "[ . 1 . 2]" 1
1735 1 100 THR MG 1 103 THR MG . . 6.150 5.276 4.483 5.871 . 0 0 "[ . 1 . 2]" 1
1736 1 100 THR MG 1 104 ASN HB2 . . 6.150 4.448 2.367 5.546 . 0 0 "[ . 1 . 2]" 1
1737 1 100 THR MG 1 104 ASN HB3 . . 6.150 3.998 2.192 5.835 . 0 0 "[ . 1 . 2]" 1
1738 1 100 THR MG 1 105 GLY H . . 3.690 2.336 1.798 3.592 . 0 0 "[ . 1 . 2]" 1
1739 1 100 THR MG 1 105 GLY HA3 . . 6.150 2.354 2.078 2.843 . 0 0 "[ . 1 . 2]" 1
1740 1 100 THR MG 1 106 PHE H . . 3.600 3.201 2.517 3.638 0.038 5 0 "[ . 1 . 2]" 1
1741 1 100 THR MG 1 107 ASN HA . . 6.150 3.639 2.302 5.295 . 0 0 "[ . 1 . 2]" 1
1742 1 101 MET H 1 101 MET HB3 . . 4.010 3.527 2.317 3.898 . 0 0 "[ . 1 . 2]" 1
1743 1 101 MET HA 1 101 MET ME . . 6.150 3.760 2.783 4.414 . 0 0 "[ . 1 . 2]" 1
1744 1 101 MET HB2 1 102 GLY H . . 6.150 3.865 3.160 4.708 . 0 0 "[ . 1 . 2]" 1
1745 1 101 MET HB3 1 102 GLY H . . 6.150 4.077 2.433 4.509 . 0 0 "[ . 1 . 2]" 1
1746 1 101 MET HG2 1 102 GLY H . . 6.150 4.877 4.424 5.211 . 0 0 "[ . 1 . 2]" 1
1747 1 101 MET ME 1 109 PHE HB2 . . 6.150 3.030 2.349 4.411 . 0 0 "[ . 1 . 2]" 1
1748 1 101 MET ME 1 110 THR H . . 6.150 5.373 4.143 6.193 0.043 12 0 "[ . 1 . 2]" 1
1749 1 102 GLY H 1 103 THR H . . 4.670 3.856 2.639 4.622 . 0 0 "[ . 1 . 2]" 1
1750 1 103 THR H 1 103 THR MG . . 4.590 3.284 2.164 4.044 . 0 0 "[ . 1 . 2]" 1
1751 1 103 THR HA 1 104 ASN HA . . 6.150 4.659 4.243 4.889 . 0 0 "[ . 1 . 2]" 1
1752 1 103 THR HA 1 138 TYR QD . . 6.150 4.161 2.863 4.812 . 0 0 "[ . 1 . 2]" 1
1753 1 103 THR HA 1 138 TYR QE . . 6.150 2.727 2.067 3.876 . 0 0 "[ . 1 . 2]" 1
1754 1 103 THR HB 1 104 ASN HA . . 5.890 4.318 3.730 5.250 . 0 0 "[ . 1 . 2]" 1
1755 1 103 THR HB 1 138 TYR QD . . 6.150 5.848 4.608 6.217 0.067 7 0 "[ . 1 . 2]" 1
1756 1 103 THR MG 1 104 ASN HA . . 6.150 4.683 3.426 5.700 . 0 0 "[ . 1 . 2]" 1
1757 1 103 THR MG 1 104 ASN HB3 . . 6.150 5.746 4.650 6.204 0.054 13 0 "[ . 1 . 2]" 1
1758 1 103 THR MG 1 105 GLY H . . 6.150 5.794 4.897 6.179 0.029 9 0 "[ . 1 . 2]" 1
1759 1 103 THR MG 1 138 TYR HB2 . . 6.150 5.062 4.014 6.163 0.013 4 0 "[ . 1 . 2]" 1
1760 1 103 THR MG 1 138 TYR QD . . 6.150 3.685 3.080 4.715 . 0 0 "[ . 1 . 2]" 1
1761 1 103 THR MG 1 138 TYR QE . . 6.150 2.883 2.367 3.653 . 0 0 "[ . 1 . 2]" 1
1762 1 104 ASN HA 1 105 GLY HA3 . . 6.150 5.343 4.561 5.429 . 0 0 "[ . 1 . 2]" 1
1763 1 104 ASN HB2 1 105 GLY H . . 3.680 3.266 2.340 3.791 0.111 7 0 "[ . 1 . 2]" 1
1764 1 104 ASN HB3 1 105 GLY H . . 3.680 2.751 1.939 3.790 0.110 13 0 "[ . 1 . 2]" 1
1765 1 104 ASN HD21 1 105 GLY H . . 4.020 2.927 2.436 3.816 . 0 0 "[ . 1 . 2]" 1
1766 1 105 GLY H 1 106 PHE H . . 4.640 4.513 4.248 4.696 0.056 4 0 "[ . 1 . 2]" 1
1767 1 105 GLY HA3 1 106 PHE H . . 2.950 2.456 2.097 2.780 . 0 0 "[ . 1 . 2]" 1
1768 1 106 PHE H 1 106 PHE HB2 . . 3.290 2.516 2.415 2.760 . 0 0 "[ . 1 . 2]" 1
1769 1 106 PHE H 1 106 PHE HB3 . . 3.830 3.651 3.565 3.826 . 0 0 "[ . 1 . 2]" 1
1770 1 106 PHE H 1 106 PHE QD . . 4.420 3.143 2.281 3.706 . 0 0 "[ . 1 . 2]" 1
1771 1 106 PHE H 1 107 ASN H . . 4.700 4.557 4.402 4.652 . 0 0 "[ . 1 . 2]" 1
1772 1 106 PHE HA 1 136 TYR QE . . 6.150 3.521 2.462 4.412 . 0 0 "[ . 1 . 2]" 1
1773 1 106 PHE QD 1 107 ASN H . . 4.060 3.909 3.390 4.083 0.023 18 0 "[ . 1 . 2]" 1
1774 1 106 PHE QD 1 136 TYR QE . . 6.150 3.034 2.470 3.471 . 0 0 "[ . 1 . 2]" 1
1775 1 107 ASN H 1 107 ASN HB3 . . 4.040 3.268 2.475 3.744 . 0 0 "[ . 1 . 2]" 1
1776 1 107 ASN H 1 107 ASN HD21 . . 5.170 4.206 2.435 5.188 0.018 3 0 "[ . 1 . 2]" 1
1777 1 107 ASN H 1 136 TYR QE . . 6.150 3.158 2.176 4.621 . 0 0 "[ . 1 . 2]" 1
1778 1 107 ASN HA 1 109 PHE H . . 6.150 4.407 3.968 4.832 . 0 0 "[ . 1 . 2]" 1
1779 1 107 ASN HA 1 110 THR H . . 6.150 4.863 4.418 5.564 . 0 0 "[ . 1 . 2]" 1
1780 1 107 ASN HB2 1 110 THR H . . 6.150 3.819 2.644 5.085 . 0 0 "[ . 1 . 2]" 1
1781 1 107 ASN HB2 1 141 PRO HB3 . . 6.150 5.525 3.382 6.178 0.028 1 0 "[ . 1 . 2]" 1
1782 1 107 ASN HB3 1 138 TYR QE . . 6.150 4.449 2.487 6.002 . 0 0 "[ . 1 . 2]" 1
1783 1 108 LEU H 1 109 PHE H . . 4.050 3.099 2.670 3.491 . 0 0 "[ . 1 . 2]" 1
1784 1 108 LEU H 1 111 VAL MG1 . . 6.150 5.434 4.363 6.171 0.021 13 0 "[ . 1 . 2]" 1
1785 1 108 LEU HA 1 108 LEU MD1 . . 4.650 2.948 2.153 3.858 . 0 0 "[ . 1 . 2]" 1
1786 1 108 LEU HA 1 111 VAL MG1 . . 6.150 3.820 2.460 4.183 . 0 0 "[ . 1 . 2]" 1
1787 1 108 LEU HB2 1 109 PHE HB3 . . 6.150 6.039 5.388 6.191 0.041 1 0 "[ . 1 . 2]" 1
1788 1 108 LEU MD1 1 112 ALA HA . . 6.150 5.555 4.054 6.187 0.037 12 0 "[ . 1 . 2]" 1
1789 1 108 LEU MD2 1 109 PHE HB3 . . 6.150 5.305 4.579 6.245 0.095 10 0 "[ . 1 . 2]" 1
1790 1 109 PHE H 1 109 PHE HB2 . . 3.220 2.543 2.425 2.670 . 0 0 "[ . 1 . 2]" 1
1791 1 109 PHE H 1 109 PHE HB3 . . 3.460 2.363 2.236 2.474 . 0 0 "[ . 1 . 2]" 1
1792 1 109 PHE H 1 109 PHE QD . . 4.580 4.212 4.175 4.257 . 0 0 "[ . 1 . 2]" 1
1793 1 109 PHE H 1 110 THR H . . 3.570 3.108 2.919 3.377 . 0 0 "[ . 1 . 2]" 1
1794 1 109 PHE HA 1 110 THR HA . . 6.150 4.856 4.753 5.009 . 0 0 "[ . 1 . 2]" 1
1795 1 109 PHE HA 1 112 ALA MB . . 6.150 2.377 2.160 2.653 . 0 0 "[ . 1 . 2]" 1
1796 1 109 PHE HB2 1 110 THR H . . 4.110 3.926 3.789 4.056 . 0 0 "[ . 1 . 2]" 1
1797 1 109 PHE HB2 1 141 PRO QG . . 6.150 6.002 5.245 6.180 0.030 10 0 "[ . 1 . 2]" 1
1798 1 109 PHE HB3 1 110 THR H . . 6.150 2.524 2.322 2.700 . 0 0 "[ . 1 . 2]" 1
1799 1 109 PHE HB3 1 141 PRO QG . . 6.150 4.913 3.935 5.225 . 0 0 "[ . 1 . 2]" 1
1800 1 109 PHE QD 1 110 THR H . . 3.900 3.886 3.723 3.955 0.055 8 0 "[ . 1 . 2]" 1
1801 1 109 PHE QD 1 110 THR HA . . 6.150 4.303 4.072 4.569 . 0 0 "[ . 1 . 2]" 1
1802 1 109 PHE QD 1 113 ALA H . . 6.150 3.627 3.255 4.157 . 0 0 "[ . 1 . 2]" 1
1803 1 109 PHE QD 1 113 ALA HA . . 6.150 5.184 4.791 5.542 . 0 0 "[ . 1 . 2]" 1
1804 1 109 PHE QD 1 113 ALA MB . . 6.150 3.334 2.854 3.721 . 0 0 "[ . 1 . 2]" 1
1805 1 109 PHE QE 1 110 THR HA . . 6.150 4.942 4.601 5.279 . 0 0 "[ . 1 . 2]" 1
1806 1 110 THR H 1 110 THR HB . . 4.020 2.708 2.322 3.555 . 0 0 "[ . 1 . 2]" 1
1807 1 110 THR H 1 110 THR MG . . 4.030 3.700 2.745 3.820 . 0 0 "[ . 1 . 2]" 1
1808 1 110 THR H 1 111 VAL H . . 3.480 2.975 2.865 3.108 . 0 0 "[ . 1 . 2]" 1
1809 1 110 THR H 1 111 VAL HA . . 6.150 5.550 5.429 5.623 . 0 0 "[ . 1 . 2]" 1
1810 1 110 THR H 1 112 ALA H . . 4.930 4.208 4.083 4.424 . 0 0 "[ . 1 . 2]" 1
1811 1 110 THR H 1 112 ALA MB . . 6.150 4.725 4.571 4.913 . 0 0 "[ . 1 . 2]" 1
1812 1 110 THR H 1 113 ALA MB . . 6.150 5.484 5.255 5.861 . 0 0 "[ . 1 . 2]" 1
1813 1 110 THR H 1 141 PRO QG . . 6.150 5.686 4.226 6.179 0.029 11 0 "[ . 1 . 2]" 1
1814 1 110 THR HA 1 113 ALA MB . . 6.150 3.791 3.436 4.133 . 0 0 "[ . 1 . 2]" 1
1815 1 110 THR HA 1 139 LYS HB3 . . 6.150 5.810 5.122 6.173 0.023 19 0 "[ . 1 . 2]" 1
1816 1 110 THR HA 1 139 LYS HG2 . . 6.150 5.188 4.550 6.181 0.031 4 0 "[ . 1 . 2]" 1
1817 1 110 THR HB 1 111 VAL H . . 3.510 2.837 2.522 3.180 . 0 0 "[ . 1 . 2]" 1
1818 1 110 THR HB 1 111 VAL MG1 . . 6.150 4.143 3.071 5.912 . 0 0 "[ . 1 . 2]" 1
1819 1 110 THR HB 1 139 LYS H . . 4.860 4.433 3.736 4.876 0.016 1 0 "[ . 1 . 2]" 1
1820 1 110 THR HB 1 139 LYS HG2 . . 6.150 5.523 4.870 6.249 0.099 18 0 "[ . 1 . 2]" 1
1821 1 110 THR MG 1 136 TYR QE . . 6.150 3.949 3.007 5.839 . 0 0 "[ . 1 . 2]" 1
1822 1 110 THR MG 1 137 LYS H . . 4.080 3.989 3.544 4.147 0.067 14 0 "[ . 1 . 2]" 1
1823 1 110 THR MG 1 138 TYR H . . 4.830 4.698 4.410 4.905 0.075 13 0 "[ . 1 . 2]" 1
1824 1 110 THR MG 1 138 TYR HA . . 5.160 2.752 2.300 3.326 . 0 0 "[ . 1 . 2]" 1
1825 1 110 THR MG 1 139 LYS H . . 3.730 2.173 1.754 2.882 . 0 0 "[ . 1 . 2]" 1
1826 1 110 THR MG 1 139 LYS HB3 . . 4.650 4.006 3.555 4.377 . 0 0 "[ . 1 . 2]" 1
1827 1 110 THR MG 1 139 LYS QE . . 5.740 4.099 3.265 5.045 . 0 0 "[ . 1 . 2]" 1
1828 1 110 THR MG 1 144 PHE HZ . . 6.150 3.158 2.538 3.707 . 0 0 "[ . 1 . 2]" 1
1829 1 110 THR MG 1 144 PHE QD . . 6.150 5.173 4.551 5.653 . 0 0 "[ . 1 . 2]" 1
1830 1 110 THR MG 1 144 PHE QE . . 6.150 3.736 3.258 4.191 . 0 0 "[ . 1 . 2]" 1
1831 1 111 VAL H 1 111 VAL HB . . 3.930 3.247 2.237 3.808 . 0 0 "[ . 1 . 2]" 1
1832 1 111 VAL H 1 111 VAL MG1 . . 4.080 2.812 1.896 3.760 . 0 0 "[ . 1 . 2]" 1
1833 1 111 VAL H 1 111 VAL MG2 . . 3.900 2.503 2.164 3.870 . 0 0 "[ . 1 . 2]" 1
1834 1 111 VAL H 1 112 ALA H . . 3.360 2.521 2.289 2.696 . 0 0 "[ . 1 . 2]" 1
1835 1 111 VAL H 1 112 ALA MB . . 5.370 4.164 3.951 4.341 . 0 0 "[ . 1 . 2]" 1
1836 1 111 VAL H 1 113 ALA MB . . 5.840 5.482 5.152 5.716 . 0 0 "[ . 1 . 2]" 1
1837 1 111 VAL HB 1 112 ALA H . . 5.160 3.674 2.658 4.499 . 0 0 "[ . 1 . 2]" 1
1838 1 111 VAL MG1 1 112 ALA H . . 4.550 3.711 2.525 4.173 . 0 0 "[ . 1 . 2]" 1
1839 1 111 VAL MG1 1 113 ALA H . . 6.150 5.574 4.867 6.048 . 0 0 "[ . 1 . 2]" 1
1840 1 111 VAL MG1 1 114 HIS HB2 . . 6.150 5.402 4.939 6.042 . 0 0 "[ . 1 . 2]" 1
1841 1 111 VAL MG1 1 114 HIS HB3 . . 6.150 4.428 3.986 5.245 . 0 0 "[ . 1 . 2]" 1
1842 1 111 VAL MG1 1 136 TYR QE . . 6.150 4.252 2.157 6.155 0.005 4 0 "[ . 1 . 2]" 1
1843 1 111 VAL MG2 1 112 ALA HA . . 6.150 3.961 3.111 5.555 . 0 0 "[ . 1 . 2]" 1
1844 1 111 VAL MG2 1 115 GLU HG2 . . 6.150 4.547 2.446 6.194 0.044 6 0 "[ . 1 . 2]" 1
1845 1 111 VAL MG2 1 115 GLU HG3 . . 5.450 4.533 3.091 5.501 0.051 3 0 "[ . 1 . 2]" 1
1846 1 112 ALA H 1 112 ALA MB . . 3.370 2.216 2.193 2.266 . 0 0 "[ . 1 . 2]" 1
1847 1 112 ALA H 1 113 ALA H . . 3.790 2.910 2.791 3.087 . 0 0 "[ . 1 . 2]" 1
1848 1 112 ALA H 1 114 HIS H . . 5.440 4.358 4.096 4.543 . 0 0 "[ . 1 . 2]" 1
1849 1 112 ALA H 1 115 GLU H . . 6.130 4.934 4.695 5.162 . 0 0 "[ . 1 . 2]" 1
1850 1 112 ALA HA 1 115 GLU H . . 5.450 3.572 3.238 3.880 . 0 0 "[ . 1 . 2]" 1
1851 1 112 ALA HA 1 115 GLU HG2 . . 6.150 4.170 3.005 5.330 . 0 0 "[ . 1 . 2]" 1
1852 1 112 ALA HA 1 115 GLU HG3 . . 6.150 3.910 1.989 5.231 . 0 0 "[ . 1 . 2]" 1
1853 1 112 ALA MB 1 113 ALA H . . 3.230 2.512 2.380 2.731 . 0 0 "[ . 1 . 2]" 1
1854 1 113 ALA H 1 113 ALA MB . . 3.010 2.256 2.204 2.348 . 0 0 "[ . 1 . 2]" 1
1855 1 113 ALA H 1 114 HIS H . . 3.340 2.798 2.685 2.910 . 0 0 "[ . 1 . 2]" 1
1856 1 113 ALA H 1 115 GLU H . . 5.040 4.534 4.222 4.794 . 0 0 "[ . 1 . 2]" 1
1857 1 113 ALA HA 1 114 HIS HB2 . . 6.150 5.844 5.673 6.029 . 0 0 "[ . 1 . 2]" 1
1858 1 113 ALA HA 1 116 PHE QB . . 6.150 2.693 2.305 3.205 . 0 0 "[ . 1 . 2]" 1
1859 1 113 ALA HA 1 116 PHE QD . . 6.150 2.862 2.303 3.570 . 0 0 "[ . 1 . 2]" 1
1860 1 113 ALA HA 1 117 GLY H . . 4.670 4.145 3.953 4.303 . 0 0 "[ . 1 . 2]" 1
1861 1 113 ALA MB 1 114 HIS H . . 2.770 2.661 2.487 2.794 0.024 2 0 "[ . 1 . 2]" 1
1862 1 113 ALA MB 1 116 PHE QB . . 6.150 4.049 3.772 4.349 . 0 0 "[ . 1 . 2]" 1
1863 1 113 ALA MB 1 117 GLY H . . 4.720 4.758 4.725 4.787 0.067 6 0 "[ . 1 . 2]" 1
1864 1 113 ALA MB 1 131 LEU MD1 . . 5.840 2.823 2.127 3.926 . 0 0 "[ . 1 . 2]" 1
1865 1 113 ALA MB 1 144 PHE HZ . . 6.150 3.647 3.154 4.066 . 0 0 "[ . 1 . 2]" 1
1866 1 114 HIS H 1 114 HIS HB2 . . 2.580 2.514 2.365 2.612 0.032 18 0 "[ . 1 . 2]" 1
1867 1 114 HIS H 1 114 HIS HB3 . . 2.980 2.396 2.263 2.505 . 0 0 "[ . 1 . 2]" 1
1868 1 114 HIS H 1 114 HIS HD2 . . 5.390 4.888 4.753 5.065 . 0 0 "[ . 1 . 2]" 1
1869 1 114 HIS H 1 115 GLU H . . 3.290 2.993 2.767 3.150 . 0 0 "[ . 1 . 2]" 1
1870 1 114 HIS HA 1 115 GLU HA . . 6.150 4.763 4.655 4.925 . 0 0 "[ . 1 . 2]" 1
1871 1 114 HIS HA 1 117 GLY H . . 3.830 3.610 3.213 3.843 0.013 2 0 "[ . 1 . 2]" 1
1872 1 114 HIS HA 1 118 HIS H . . 5.460 5.134 4.794 5.369 . 0 0 "[ . 1 . 2]" 1
1873 1 114 HIS HA 1 131 LEU HG . . 6.150 2.808 2.164 4.455 . 0 0 "[ . 1 . 2]" 1
1874 1 114 HIS HA 1 131 LEU MD2 . . 6.150 3.206 2.651 4.451 . 0 0 "[ . 1 . 2]" 1
1875 1 114 HIS HA 1 132 MET ME . . 6.150 2.486 1.822 4.133 . 0 0 "[ . 1 . 2]" 1
1876 1 114 HIS HB2 1 115 GLU H . . 6.150 4.023 3.885 4.188 . 0 0 "[ . 1 . 2]" 1
1877 1 114 HIS HB2 1 131 LEU HG . . 6.150 2.768 2.291 5.090 . 0 0 "[ . 1 . 2]" 1
1878 1 114 HIS HB2 1 131 LEU MD2 . . 6.150 3.676 2.667 4.908 . 0 0 "[ . 1 . 2]" 1
1879 1 114 HIS HB2 1 132 MET HA . . 6.150 3.897 3.003 4.526 . 0 0 "[ . 1 . 2]" 1
1880 1 114 HIS HB3 1 115 GLU H . . 4.180 2.651 2.468 2.995 . 0 0 "[ . 1 . 2]" 1
1881 1 114 HIS HB3 1 131 LEU MD2 . . 6.150 4.752 3.967 5.978 . 0 0 "[ . 1 . 2]" 1
1882 1 114 HIS HB3 1 132 MET HA . . 6.150 4.871 4.265 5.395 . 0 0 "[ . 1 . 2]" 1
1883 1 114 HIS HD1 1 132 MET HA . . 6.020 2.990 2.555 4.463 . 0 0 "[ . 1 . 2]" 1
1884 1 114 HIS HD1 1 133 TYR H . . 6.150 4.538 3.943 6.171 0.021 14 0 "[ . 1 . 2]" 1
1885 1 114 HIS HD2 1 115 GLU H . . 4.930 3.419 2.894 4.050 . 0 0 "[ . 1 . 2]" 1
1886 1 114 HIS HD2 1 115 GLU HA . . 6.150 2.868 2.316 3.416 . 0 0 "[ . 1 . 2]" 1
1887 1 114 HIS HD2 1 115 GLU HG3 . . 6.150 4.924 4.138 5.645 . 0 0 "[ . 1 . 2]" 1
1888 1 114 HIS HD2 1 124 HIS HD2 . . 6.150 4.811 4.231 5.175 . 0 0 "[ . 1 . 2]" 1
1889 1 114 HIS HD2 1 132 MET HB2 . . 6.150 6.074 3.707 6.246 0.096 15 0 "[ . 1 . 2]" 1
1890 1 114 HIS HD2 1 132 MET HB3 . . 6.150 5.437 3.789 6.266 0.116 9 0 "[ . 1 . 2]" 1
1891 1 114 HIS HD2 1 132 MET HG2 . . 6.150 5.105 3.481 6.238 0.088 7 0 "[ . 1 . 2]" 1
1892 1 114 HIS HD2 1 132 MET HG3 . . 6.150 4.338 3.241 6.089 . 0 0 "[ . 1 . 2]" 1
1893 1 115 GLU H 1 115 GLU HB2 . . 4.100 2.633 2.218 3.675 . 0 0 "[ . 1 . 2]" 1
1894 1 115 GLU H 1 115 GLU HB3 . . 3.730 3.398 2.756 3.575 . 0 0 "[ . 1 . 2]" 1
1895 1 115 GLU H 1 115 GLU HG2 . . 3.600 2.729 2.103 3.638 0.038 14 0 "[ . 1 . 2]" 1
1896 1 115 GLU H 1 115 GLU HG3 . . 3.610 3.090 2.055 3.697 0.087 17 0 "[ . 1 . 2]" 1
1897 1 115 GLU H 1 116 PHE H . . 3.450 2.919 2.622 3.117 . 0 0 "[ . 1 . 2]" 1
1898 1 115 GLU H 1 116 PHE QD . . 5.710 5.259 4.330 5.663 . 0 0 "[ . 1 . 2]" 1
1899 1 115 GLU H 1 117 GLY H . . 4.960 4.280 4.064 4.425 . 0 0 "[ . 1 . 2]" 1
1900 1 115 GLU H 1 118 HIS H . . 5.330 5.114 4.806 5.303 . 0 0 "[ . 1 . 2]" 1
1901 1 115 GLU HA 1 118 HIS H . . 3.900 3.194 2.680 3.568 . 0 0 "[ . 1 . 2]" 1
1902 1 115 GLU HA 1 118 HIS HB2 . . 6.150 3.080 2.502 3.431 . 0 0 "[ . 1 . 2]" 1
1903 1 115 GLU HA 1 118 HIS HB3 . . 6.150 4.710 4.181 4.996 . 0 0 "[ . 1 . 2]" 1
1904 1 115 GLU HA 1 118 HIS HD2 . . 6.150 2.409 2.018 3.231 . 0 0 "[ . 1 . 2]" 1
1905 1 115 GLU HB3 1 116 PHE QD . . 6.150 5.166 3.433 6.165 0.015 3 0 "[ . 1 . 2]" 1
1906 1 115 GLU HB3 1 118 HIS HB2 . . 6.150 4.475 3.731 4.983 . 0 0 "[ . 1 . 2]" 1
1907 1 115 GLU HB3 1 118 HIS HD2 . . 6.150 4.504 3.520 5.736 . 0 0 "[ . 1 . 2]" 1
1908 1 116 PHE H 1 117 GLY H . . 3.390 2.766 2.640 2.977 . 0 0 "[ . 1 . 2]" 1
1909 1 116 PHE H 1 118 HIS H . . 4.750 4.242 4.023 4.354 . 0 0 "[ . 1 . 2]" 1
1910 1 116 PHE HA 1 118 HIS H . . 3.870 3.896 3.875 3.923 0.053 9 0 "[ . 1 . 2]" 1
1911 1 116 PHE HA 1 119 ALA MB . . 5.480 2.686 2.419 2.934 . 0 0 "[ . 1 . 2]" 1
1912 1 116 PHE QB 1 117 GLY H . . 3.410 2.626 2.441 2.749 . 0 0 "[ . 1 . 2]" 1
1913 1 116 PHE QB 1 118 HIS H . . 5.750 4.621 4.537 4.705 . 0 0 "[ . 1 . 2]" 1
1914 1 116 PHE QB 1 119 ALA MB . . 6.150 4.048 3.703 4.433 . 0 0 "[ . 1 . 2]" 1
1915 1 116 PHE QD 1 117 GLY H . . 4.840 4.530 4.300 4.655 . 0 0 "[ . 1 . 2]" 1
1916 1 116 PHE QD 1 119 ALA MB . . 6.150 3.570 3.109 4.062 . 0 0 "[ . 1 . 2]" 1
1917 1 116 PHE QE 1 120 LEU MD2 . . 6.150 6.134 5.441 6.251 0.101 4 0 "[ . 1 . 2]" 1
1918 1 117 GLY H 1 118 HIS H . . 3.130 2.953 2.889 3.069 . 0 0 "[ . 1 . 2]" 1
1919 1 117 GLY H 1 118 HIS HA . . 6.150 5.569 5.510 5.632 . 0 0 "[ . 1 . 2]" 1
1920 1 117 GLY H 1 118 HIS HB2 . . 4.950 4.988 4.956 5.022 0.072 2 0 "[ . 1 . 2]" 1
1921 1 117 GLY H 1 119 ALA H . . 4.570 4.404 4.173 4.579 0.009 10 0 "[ . 1 . 2]" 1
1922 1 117 GLY H 1 120 LEU H . . 5.710 5.016 4.705 5.319 . 0 0 "[ . 1 . 2]" 1
1923 1 117 GLY H 1 120 LEU MD1 . . 4.130 4.102 3.901 4.215 0.085 20 0 "[ . 1 . 2]" 1
1924 1 117 GLY H 1 120 LEU MD2 . . 4.970 4.310 3.076 5.011 0.041 9 0 "[ . 1 . 2]" 1
1925 1 117 GLY H 1 122 LEU MD1 . . 4.730 4.561 4.136 4.779 0.049 7 0 "[ . 1 . 2]" 1
1926 1 117 GLY HA3 1 120 LEU HB3 . . 6.150 5.863 5.407 6.154 0.004 18 0 "[ . 1 . 2]" 1
1927 1 117 GLY HA3 1 120 LEU MD1 . . 6.150 3.765 3.138 4.856 . 0 0 "[ . 1 . 2]" 1
1928 1 117 GLY HA3 1 120 LEU MD2 . . 6.150 4.440 3.234 5.191 . 0 0 "[ . 1 . 2]" 1
1929 1 118 HIS H 1 118 HIS HB2 . . 3.170 2.222 2.071 2.293 . 0 0 "[ . 1 . 2]" 1
1930 1 118 HIS H 1 118 HIS HB3 . . 3.970 3.541 3.431 3.586 . 0 0 "[ . 1 . 2]" 1
1931 1 118 HIS H 1 118 HIS HD2 . . 3.690 3.256 2.634 3.693 0.003 3 0 "[ . 1 . 2]" 1
1932 1 118 HIS H 1 119 ALA H . . 3.060 2.398 2.255 2.550 . 0 0 "[ . 1 . 2]" 1
1933 1 118 HIS H 1 119 ALA MB . . 4.200 4.082 4.003 4.171 . 0 0 "[ . 1 . 2]" 1
1934 1 118 HIS H 1 120 LEU H . . 3.830 3.859 3.771 3.922 0.092 18 0 "[ . 1 . 2]" 1
1935 1 118 HIS H 1 120 LEU MD1 . . 4.830 4.706 4.564 4.838 0.008 15 0 "[ . 1 . 2]" 1
1936 1 118 HIS H 1 122 LEU MD1 . . 5.050 4.862 4.667 5.055 0.005 14 0 "[ . 1 . 2]" 1
1937 1 118 HIS HA 1 120 LEU H . . 5.160 4.037 3.744 4.398 . 0 0 "[ . 1 . 2]" 1
1938 1 118 HIS HA 1 121 GLY H . . 4.160 3.530 3.228 3.870 . 0 0 "[ . 1 . 2]" 1
1939 1 118 HIS HA 1 122 LEU H . . 3.620 3.267 2.916 3.651 0.031 20 0 "[ . 1 . 2]" 1
1940 1 118 HIS HA 1 132 MET ME . . 6.150 5.594 3.795 6.177 0.027 20 0 "[ . 1 . 2]" 1
1941 1 118 HIS HB2 1 119 ALA H . . 3.650 2.722 2.406 2.954 . 0 0 "[ . 1 . 2]" 1
1942 1 118 HIS HB3 1 119 ALA H . . 3.690 3.439 3.070 3.692 0.002 9 0 "[ . 1 . 2]" 1
1943 1 118 HIS HB3 1 119 ALA MB . . 6.150 4.380 4.083 4.688 . 0 0 "[ . 1 . 2]" 1
1944 1 118 HIS HD2 1 119 ALA H . . 5.150 5.019 4.612 5.196 0.046 9 0 "[ . 1 . 2]" 1
1945 1 118 HIS HD2 1 132 MET HA . . 6.150 5.862 5.005 6.208 0.058 17 0 "[ . 1 . 2]" 1
1946 1 118 HIS HD2 1 132 MET ME . . 6.150 5.364 3.790 6.175 0.025 2 0 "[ . 1 . 2]" 1
1947 1 118 HIS HE1 1 123 ALA HA . . 6.150 3.645 2.239 5.677 . 0 0 "[ . 1 . 2]" 1
1948 1 118 HIS HE1 1 123 ALA MB . . 6.150 4.533 2.688 6.165 0.015 20 0 "[ . 1 . 2]" 1
1949 1 118 HIS HE1 1 124 HIS HE1 . . 6.150 3.605 2.577 4.877 . 0 0 "[ . 1 . 2]" 1
1950 1 119 ALA H 1 119 ALA MB . . 2.750 2.223 2.164 2.293 . 0 0 "[ . 1 . 2]" 1
1951 1 119 ALA H 1 120 LEU H . . 3.150 2.612 2.429 2.824 . 0 0 "[ . 1 . 2]" 1
1952 1 119 ALA H 1 120 LEU MD1 . . 4.820 4.600 3.983 4.911 0.091 4 0 "[ . 1 . 2]" 1
1953 1 119 ALA MB 1 120 LEU H . . 6.150 3.073 2.810 3.259 . 0 0 "[ . 1 . 2]" 1
1954 1 119 ALA MB 1 120 LEU MD1 . . 6.150 4.386 2.931 5.185 . 0 0 "[ . 1 . 2]" 1
1955 1 120 LEU H 1 120 LEU HB2 . . 3.680 2.301 2.056 2.487 . 0 0 "[ . 1 . 2]" 1
1956 1 120 LEU H 1 120 LEU HB3 . . 3.390 3.436 3.392 3.464 0.074 14 0 "[ . 1 . 2]" 1
1957 1 120 LEU H 1 120 LEU HG . . 4.540 2.802 1.962 4.249 . 0 0 "[ . 1 . 2]" 1
1958 1 120 LEU H 1 120 LEU MD1 . . 3.910 3.103 2.274 3.560 . 0 0 "[ . 1 . 2]" 1
1959 1 120 LEU H 1 120 LEU MD2 . . 3.450 3.127 2.682 3.504 0.054 8 0 "[ . 1 . 2]" 1
1960 1 120 LEU H 1 121 GLY H . . 2.960 2.519 2.365 2.650 . 0 0 "[ . 1 . 2]" 1
1961 1 120 LEU H 1 122 LEU H . . 4.280 3.746 3.509 4.058 . 0 0 "[ . 1 . 2]" 1
1962 1 120 LEU HA 1 121 GLY H . . 3.520 3.501 3.468 3.535 0.015 3 0 "[ . 1 . 2]" 1
1963 1 120 LEU HA 1 122 LEU H . . 5.500 4.968 4.750 5.114 . 0 0 "[ . 1 . 2]" 1
1964 1 120 LEU HB2 1 122 LEU H . . 4.810 2.628 2.372 3.095 . 0 0 "[ . 1 . 2]" 1
1965 1 120 LEU HB3 1 121 GLY H . . 3.310 3.356 3.249 3.405 0.095 1 0 "[ . 1 . 2]" 1
1966 1 120 LEU HB3 1 122 LEU H . . 3.780 3.686 3.271 3.885 0.105 5 0 "[ . 1 . 2]" 1
1967 1 120 LEU HG 1 121 GLY H . . 6.150 4.312 3.641 5.233 . 0 0 "[ . 1 . 2]" 1
1968 1 120 LEU MD1 1 121 GLY H . . 4.910 4.132 3.959 4.297 . 0 0 "[ . 1 . 2]" 1
1969 1 120 LEU MD1 1 122 LEU H . . 4.870 4.122 3.503 5.028 0.158 17 0 "[ . 1 . 2]" 1
1970 1 120 LEU MD1 1 122 LEU HG . . 6.150 3.354 2.429 4.807 . 0 0 "[ . 1 . 2]" 1
1971 1 120 LEU MD1 1 122 LEU MD1 . . 5.990 2.896 2.012 4.605 . 0 0 "[ . 1 . 2]" 1
1972 1 120 LEU MD1 1 122 LEU MD2 . . 5.060 4.125 3.260 5.162 0.102 8 0 "[ . 1 . 2]" 1
1973 1 120 LEU MD1 1 154 ILE MD . . 5.510 2.433 1.907 3.641 . 0 0 "[ . 1 . 2]" 1
1974 1 120 LEU MD2 1 121 GLY H . . 4.820 4.550 4.360 4.738 . 0 0 "[ . 1 . 2]" 1
1975 1 120 LEU MD2 1 154 ILE HA . . 5.400 4.777 3.532 5.436 0.036 12 0 "[ . 1 . 2]" 1
1976 1 120 LEU MD2 1 154 ILE MD . . 4.350 2.305 1.872 3.115 . 0 0 "[ . 1 . 2]" 1
1977 1 120 LEU MD2 1 158 TYR QD . . 6.150 4.681 4.054 5.333 . 0 0 "[ . 1 . 2]" 1
1978 1 120 LEU MD2 1 158 TYR QE . . 6.150 2.915 2.116 3.940 . 0 0 "[ . 1 . 2]" 1
1979 1 121 GLY H 1 122 LEU H . . 2.910 2.032 1.915 2.251 . 0 0 "[ . 1 . 2]" 1
1980 1 121 GLY H 1 122 LEU HG . . 3.770 3.589 3.446 3.786 0.016 9 0 "[ . 1 . 2]" 1
1981 1 121 GLY H 1 122 LEU MD1 . . 4.850 4.749 4.601 4.856 0.006 20 0 "[ . 1 . 2]" 1
1982 1 121 GLY H 1 122 LEU MD2 . . 4.830 4.542 4.252 4.842 0.012 9 0 "[ . 1 . 2]" 1
1983 1 121 GLY HA3 1 122 LEU MD1 . . 6.150 5.719 5.381 5.925 . 0 0 "[ . 1 . 2]" 1
1984 1 121 GLY HA3 1 157 LEU MD1 . . 6.150 2.876 2.391 3.842 . 0 0 "[ . 1 . 2]" 1
1985 1 122 LEU H 1 122 LEU HB2 . . 3.880 2.691 2.596 2.835 . 0 0 "[ . 1 . 2]" 1
1986 1 122 LEU H 1 122 LEU HB3 . . 3.590 3.618 3.599 3.640 0.050 17 0 "[ . 1 . 2]" 1
1987 1 122 LEU H 1 122 LEU HG . . 2.890 2.040 1.906 2.151 . 0 0 "[ . 1 . 2]" 1
1988 1 122 LEU H 1 122 LEU MD1 . . 3.520 3.489 3.407 3.569 0.049 15 0 "[ . 1 . 2]" 1
1989 1 122 LEU H 1 122 LEU MD2 . . 3.220 3.133 2.924 3.256 0.036 12 0 "[ . 1 . 2]" 1
1990 1 122 LEU H 1 123 ALA H . . 4.950 4.556 4.451 4.623 . 0 0 "[ . 1 . 2]" 1
1991 1 122 LEU HA 1 123 ALA H . . 3.270 2.447 2.278 2.821 . 0 0 "[ . 1 . 2]" 1
1992 1 122 LEU HA 1 157 LEU MD2 . . 6.030 4.415 3.594 5.171 . 0 0 "[ . 1 . 2]" 1
1993 1 122 LEU HB2 1 123 ALA H . . 3.200 3.125 2.664 3.266 0.066 3 0 "[ . 1 . 2]" 1
1994 1 122 LEU HB2 1 132 MET HG2 . . 6.150 3.658 2.498 5.470 . 0 0 "[ . 1 . 2]" 1
1995 1 122 LEU HB2 1 132 MET HG3 . . 6.150 4.162 2.584 5.356 . 0 0 "[ . 1 . 2]" 1
1996 1 122 LEU HB2 1 132 MET ME . . 5.450 3.693 2.343 4.617 . 0 0 "[ . 1 . 2]" 1
1997 1 122 LEU HB3 1 123 ALA H . . 3.410 2.244 1.969 2.535 . 0 0 "[ . 1 . 2]" 1
1998 1 122 LEU HB3 1 132 MET HG3 . . 6.150 4.487 2.611 5.836 . 0 0 "[ . 1 . 2]" 1
1999 1 122 LEU HB3 1 132 MET ME . . 6.150 4.077 2.540 4.958 . 0 0 "[ . 1 . 2]" 1
2000 1 122 LEU HG 1 154 ILE H . . 5.130 5.107 4.797 5.211 0.081 8 0 "[ . 1 . 2]" 1
2001 1 122 LEU MD1 1 123 ALA H . . 4.510 4.299 3.959 4.517 0.007 20 0 "[ . 1 . 2]" 1
2002 1 122 LEU MD1 1 132 MET HG2 . . 6.150 3.847 2.801 5.772 . 0 0 "[ . 1 . 2]" 1
2003 1 122 LEU MD1 1 132 MET HG3 . . 6.150 4.287 2.898 5.196 . 0 0 "[ . 1 . 2]" 1
2004 1 122 LEU MD1 1 153 GLY H . . 4.920 4.690 4.342 4.923 0.003 17 0 "[ . 1 . 2]" 1
2005 1 122 LEU MD1 1 154 ILE H . . 4.040 3.146 2.740 3.406 . 0 0 "[ . 1 . 2]" 1
2006 1 122 LEU MD1 1 154 ILE HB . . 6.150 2.618 2.316 2.963 . 0 0 "[ . 1 . 2]" 1
2007 1 122 LEU MD2 1 123 ALA H . . 3.990 3.789 3.415 4.047 0.057 20 0 "[ . 1 . 2]" 1
2008 1 122 LEU MD2 1 132 MET ME . . 6.150 4.609 3.508 5.304 . 0 0 "[ . 1 . 2]" 1
2009 1 122 LEU MD2 1 153 GLY H . . 4.310 4.301 4.107 4.341 0.031 16 0 "[ . 1 . 2]" 1
2010 1 122 LEU MD2 1 154 ILE H . . 3.720 3.101 2.659 3.459 . 0 0 "[ . 1 . 2]" 1
2011 1 122 LEU MD2 1 154 ILE HB . . 6.150 3.463 2.586 4.088 . 0 0 "[ . 1 . 2]" 1
2012 1 123 ALA H 1 123 ALA MB . . 3.030 2.649 2.396 2.903 . 0 0 "[ . 1 . 2]" 1
2013 1 123 ALA H 1 124 HIS H . . 4.680 4.452 4.292 4.631 . 0 0 "[ . 1 . 2]" 1
2014 1 123 ALA HA 1 124 HIS H . . 2.900 2.629 2.314 2.900 . 0 0 "[ . 1 . 2]" 1
2015 1 123 ALA HA 1 125 SER H . . 5.770 5.545 4.926 5.812 0.042 9 0 "[ . 1 . 2]" 1
2016 1 123 ALA MB 1 124 HIS H . . 2.540 2.299 2.089 2.539 . 0 0 "[ . 1 . 2]" 1
2017 1 123 ALA MB 1 124 HIS HA . . 6.150 4.375 4.267 4.487 . 0 0 "[ . 1 . 2]" 1
2018 1 124 HIS H 1 124 HIS HB2 . . 3.690 2.724 2.419 3.061 . 0 0 "[ . 1 . 2]" 1
2019 1 124 HIS H 1 124 HIS HB3 . . 3.580 3.621 3.552 3.804 0.224 1 0 "[ . 1 . 2]" 1
2020 1 124 HIS H 1 124 HIS HD2 . . 4.500 4.291 3.426 4.641 0.141 1 0 "[ . 1 . 2]" 1
2021 1 124 HIS H 1 125 SER H . . 4.460 4.394 3.968 4.600 0.140 1 0 "[ . 1 . 2]" 1
2022 1 124 HIS HA 1 125 SER H . . 3.140 2.201 1.982 2.373 . 0 0 "[ . 1 . 2]" 1
2023 1 124 HIS HA 1 125 SER HA . . 6.150 4.483 4.382 4.629 . 0 0 "[ . 1 . 2]" 1
2024 1 124 HIS HA 1 132 MET HB2 . . 6.150 3.744 2.669 4.516 . 0 0 "[ . 1 . 2]" 1
2025 1 124 HIS HA 1 132 MET ME . . 6.150 5.359 4.576 5.871 . 0 0 "[ . 1 . 2]" 1
2026 1 124 HIS HA 1 134 PRO HG2 . . 6.150 6.195 6.134 6.279 0.129 14 0 "[ . 1 . 2]" 1
2027 1 124 HIS HB2 1 125 SER H . . 5.020 4.435 4.064 4.726 . 0 0 "[ . 1 . 2]" 1
2028 1 124 HIS HB3 1 125 SER H . . 4.870 3.714 3.103 4.216 . 0 0 "[ . 1 . 2]" 1
2029 1 124 HIS HD2 1 125 SER H . . 4.950 4.781 4.165 5.118 0.168 1 0 "[ . 1 . 2]" 1
2030 1 124 HIS HD2 1 132 MET HA . . 6.150 4.054 3.442 4.623 . 0 0 "[ . 1 . 2]" 1
2031 1 124 HIS HD2 1 132 MET HB2 . . 6.150 5.416 3.540 6.197 0.047 16 0 "[ . 1 . 2]" 1
2032 1 124 HIS HD2 1 135 THR H . . 4.910 4.938 4.700 4.986 0.076 16 0 "[ . 1 . 2]" 1
2033 1 125 SER H 1 125 SER HB2 . . 4.090 2.316 1.973 2.698 . 0 0 "[ . 1 . 2]" 1
2034 1 125 SER H 1 125 SER HB3 . . 3.360 3.206 2.515 3.472 0.112 20 0 "[ . 1 . 2]" 1
2035 1 125 SER H 1 127 ASP H . . 4.860 4.873 4.604 4.979 0.119 10 0 "[ . 1 . 2]" 1
2036 1 125 SER H 1 132 MET HB2 . . 4.750 2.983 1.756 4.238 . 0 0 "[ . 1 . 2]" 1
2037 1 125 SER H 1 132 MET HB3 . . 6.150 2.480 1.808 5.281 . 0 0 "[ . 1 . 2]" 1
2038 1 125 SER H 1 132 MET HG2 . . 4.740 4.132 3.672 4.787 0.047 15 0 "[ . 1 . 2]" 1
2039 1 125 SER H 1 132 MET HG3 . . 5.800 4.317 2.371 5.517 . 0 0 "[ . 1 . 2]" 1
2040 1 125 SER H 1 132 MET ME . . 5.120 5.107 4.610 5.239 0.119 1 0 "[ . 1 . 2]" 1
2041 1 125 SER H 1 133 TYR H . . 5.020 4.171 3.500 4.867 . 0 0 "[ . 1 . 2]" 1
2042 1 125 SER H 1 133 TYR HA . . 6.150 3.666 2.960 4.263 . 0 0 "[ . 1 . 2]" 1
2043 1 125 SER H 1 133 TYR QD . . 6.150 5.455 3.614 6.150 . 0 0 "[ . 1 . 2]" 1
2044 1 125 SER HB2 1 126 THR H . . 4.740 4.044 2.841 4.564 . 0 0 "[ . 1 . 2]" 1
2045 1 125 SER HB2 1 127 ASP H . . 4.000 3.756 3.037 4.086 0.086 9 0 "[ . 1 . 2]" 1
2046 1 125 SER HB2 1 130 ALA MB . . 6.150 2.661 2.042 3.843 . 0 0 "[ . 1 . 2]" 1
2047 1 125 SER HB3 1 126 THR H . . 5.280 3.495 2.414 4.201 . 0 0 "[ . 1 . 2]" 1
2048 1 125 SER HB3 1 127 ASP H . . 4.560 2.874 2.350 3.996 . 0 0 "[ . 1 . 2]" 1
2049 1 125 SER HB3 1 130 ALA MB . . 6.150 2.566 2.284 2.936 . 0 0 "[ . 1 . 2]" 1
2050 1 125 SER HB3 1 132 MET H . . 5.110 5.028 4.275 5.202 0.092 1 0 "[ . 1 . 2]" 1
2051 1 126 THR H 1 126 THR HB . . 4.090 3.424 2.611 3.937 . 0 0 "[ . 1 . 2]" 1
2052 1 126 THR H 1 126 THR MG . . 4.190 3.008 2.155 4.126 . 0 0 "[ . 1 . 2]" 1
2053 1 126 THR H 1 127 ASP H . . 3.330 2.915 2.226 3.394 0.064 13 0 "[ . 1 . 2]" 1
2054 1 126 THR H 1 127 ASP HB2 . . 4.970 4.228 3.581 4.902 . 0 0 "[ . 1 . 2]" 1
2055 1 126 THR H 1 127 ASP HB3 . . 6.150 5.684 5.093 6.168 0.018 13 0 "[ . 1 . 2]" 1
2056 1 126 THR HB 1 127 ASP H . . 4.540 4.372 3.791 4.675 0.135 5 0 "[ . 1 . 2]" 1
2057 1 126 THR MG 1 127 ASP H . . 4.500 4.263 3.487 4.447 . 0 0 "[ . 1 . 2]" 1
2058 1 127 ASP H 1 127 ASP HB2 . . 3.210 2.155 1.878 2.501 . 0 0 "[ . 1 . 2]" 1
2059 1 127 ASP H 1 127 ASP HB3 . . 3.290 3.101 2.389 3.378 0.088 20 0 "[ . 1 . 2]" 1
2060 1 127 ASP H 1 128 PRO HD2 . . 5.830 4.962 4.866 5.105 . 0 0 "[ . 1 . 2]" 1
2061 1 127 ASP H 1 128 PRO HD3 . . 5.800 5.075 4.899 5.305 . 0 0 "[ . 1 . 2]" 1
2062 1 127 ASP H 1 129 SER H . . 4.870 4.885 4.654 5.005 0.135 16 0 "[ . 1 . 2]" 1
2063 1 127 ASP H 1 130 ALA MB . . 3.760 2.919 2.549 3.402 . 0 0 "[ . 1 . 2]" 1
2064 1 127 ASP HB2 1 128 PRO HD2 . . 6.150 4.264 4.080 4.572 . 0 0 "[ . 1 . 2]" 1
2065 1 127 ASP HB2 1 128 PRO HD3 . . 6.150 5.100 4.900 5.362 . 0 0 "[ . 1 . 2]" 1
2066 1 127 ASP HB2 1 129 SER H . . 5.330 4.208 3.797 4.881 . 0 0 "[ . 1 . 2]" 1
2067 1 127 ASP HB2 1 130 ALA H . . 4.650 4.323 3.496 4.775 0.125 13 0 "[ . 1 . 2]" 1
2068 1 127 ASP HB2 1 130 ALA MB . . 6.150 2.446 2.178 2.948 . 0 0 "[ . 1 . 2]" 1
2069 1 127 ASP HB2 1 133 TYR H . . 5.960 5.995 5.749 6.134 0.174 20 0 "[ . 1 . 2]" 1
2070 1 127 ASP HB3 1 128 PRO HD2 . . 6.150 3.401 2.938 4.001 . 0 0 "[ . 1 . 2]" 1
2071 1 127 ASP HB3 1 128 PRO HD3 . . 6.150 4.510 4.186 4.850 . 0 0 "[ . 1 . 2]" 1
2072 1 127 ASP HB3 1 130 ALA H . . 3.890 3.030 1.985 3.837 . 0 0 "[ . 1 . 2]" 1
2073 1 127 ASP HB3 1 130 ALA MB . . 6.150 2.290 1.999 2.797 . 0 0 "[ . 1 . 2]" 1
2074 1 127 ASP HB3 1 133 TYR H . . 6.150 6.044 5.029 6.448 0.298 13 0 "[ . 1 . 2]" 1
2075 1 128 PRO HA 1 130 ALA H . . 6.150 4.438 3.798 5.073 . 0 0 "[ . 1 . 2]" 1
2076 1 128 PRO HA 1 133 TYR HB2 . . 6.150 5.489 4.384 6.194 0.044 2 0 "[ . 1 . 2]" 1
2077 1 128 PRO HA 1 133 TYR QD . . 6.150 4.223 3.167 4.867 . 0 0 "[ . 1 . 2]" 1
2078 1 128 PRO HA 1 133 TYR QE . . 6.150 4.105 2.332 4.818 . 0 0 "[ . 1 . 2]" 1
2079 1 128 PRO HD2 1 129 SER H . . 4.530 3.193 2.818 4.293 . 0 0 "[ . 1 . 2]" 1
2080 1 128 PRO HD3 1 129 SER H . . 4.620 4.177 3.959 4.659 0.039 5 0 "[ . 1 . 2]" 1
2081 1 128 PRO HG2 1 129 SER H . . 4.340 3.301 2.938 4.379 0.039 5 0 "[ . 1 . 2]" 1
2082 1 128 PRO QB 1 129 SER H . . 4.610 3.795 3.668 3.982 . 0 0 "[ . 1 . 2]" 1
2083 1 128 PRO QB 1 133 TYR QD . . 6.150 5.617 4.735 6.145 . 0 0 "[ . 1 . 2]" 1
2084 1 128 PRO QB 1 133 TYR QE . . 6.150 5.073 3.791 5.730 . 0 0 "[ . 1 . 2]" 1
2085 1 129 SER H 1 129 SER HB2 . . 3.660 3.272 2.446 3.797 0.137 16 0 "[ . 1 . 2]" 1
2086 1 129 SER H 1 130 ALA H . . 3.530 2.500 1.844 3.148 . 0 0 "[ . 1 . 2]" 1
2087 1 129 SER HA 1 130 ALA H . . 3.560 2.854 2.181 3.558 . 0 0 "[ . 1 . 2]" 1
2088 1 129 SER HB2 1 130 ALA H . . 4.800 4.114 3.073 4.587 . 0 0 "[ . 1 . 2]" 1
2089 1 129 SER HB3 1 130 ALA H . . 4.690 4.313 3.608 4.664 . 0 0 "[ . 1 . 2]" 1
2090 1 130 ALA H 1 130 ALA MB . . 3.280 2.370 2.133 2.538 . 0 0 "[ . 1 . 2]" 1
2091 1 130 ALA H 1 131 LEU H . . 6.150 4.505 4.348 4.677 . 0 0 "[ . 1 . 2]" 1
2092 1 130 ALA H 1 133 TYR H . . 5.250 4.714 4.126 5.305 0.055 18 0 "[ . 1 . 2]" 1
2093 1 130 ALA H 1 133 TYR QD . . 5.250 4.150 2.817 5.270 0.020 14 0 "[ . 1 . 2]" 1
2094 1 130 ALA H 1 147 PRO HB2 . . 5.150 4.675 4.248 5.116 . 0 0 "[ . 1 . 2]" 1
2095 1 130 ALA H 1 147 PRO HB3 . . 5.170 5.206 5.149 5.266 0.096 1 0 "[ . 1 . 2]" 1
2096 1 130 ALA HA 1 131 LEU HB2 . . 6.150 4.568 4.282 5.659 . 0 0 "[ . 1 . 2]" 1
2097 1 130 ALA HA 1 131 LEU HB3 . . 6.150 4.476 4.195 4.734 . 0 0 "[ . 1 . 2]" 1
2098 1 130 ALA HA 1 132 MET H . . 6.150 4.113 3.692 4.811 . 0 0 "[ . 1 . 2]" 1
2099 1 130 ALA HA 1 133 TYR H . . 6.150 4.558 4.124 5.059 . 0 0 "[ . 1 . 2]" 1
2100 1 130 ALA HA 1 147 PRO HB2 . . 6.150 3.844 2.567 4.261 . 0 0 "[ . 1 . 2]" 1
2101 1 130 ALA HA 1 147 PRO HB3 . . 6.150 4.565 3.503 5.138 . 0 0 "[ . 1 . 2]" 1
2102 1 130 ALA HA 1 148 LYS H . . 4.180 3.799 3.424 4.226 0.046 14 0 "[ . 1 . 2]" 1
2103 1 130 ALA HA 1 150 ASP H . . 4.980 3.656 3.071 4.443 . 0 0 "[ . 1 . 2]" 1
2104 1 130 ALA MB 1 131 LEU H . . 6.150 2.596 1.987 3.024 . 0 0 "[ . 1 . 2]" 1
2105 1 130 ALA MB 1 132 MET H . . 4.360 2.791 2.474 3.261 . 0 0 "[ . 1 . 2]" 1
2106 1 130 ALA MB 1 132 MET ME . . 6.150 4.379 3.471 5.252 . 0 0 "[ . 1 . 2]" 1
2107 1 130 ALA MB 1 133 TYR H . . 3.950 2.675 2.315 3.158 . 0 0 "[ . 1 . 2]" 1
2108 1 130 ALA MB 1 133 TYR HB2 . . 6.150 2.629 2.096 3.917 . 0 0 "[ . 1 . 2]" 1
2109 1 130 ALA MB 1 133 TYR HB3 . . 6.150 3.864 2.320 4.957 . 0 0 "[ . 1 . 2]" 1
2110 1 130 ALA MB 1 149 ASP H . . 6.150 4.058 3.564 4.531 . 0 0 "[ . 1 . 2]" 1
2111 1 130 ALA MB 1 149 ASP HB2 . . 6.150 3.294 2.292 4.427 . 0 0 "[ . 1 . 2]" 1
2112 1 130 ALA MB 1 149 ASP HB3 . . 6.150 2.812 2.143 4.426 . 0 0 "[ . 1 . 2]" 1
2113 1 130 ALA MB 1 150 ASP H . . 4.380 3.933 3.541 4.322 . 0 0 "[ . 1 . 2]" 1
2114 1 131 LEU H 1 132 MET H . . 5.580 2.317 2.009 2.569 . 0 0 "[ . 1 . 2]" 1
2115 1 131 LEU H 1 146 LEU HA . . 6.150 5.275 4.196 5.822 . 0 0 "[ . 1 . 2]" 1
2116 1 131 LEU HA 1 133 TYR H . . 4.650 3.543 3.324 3.817 . 0 0 "[ . 1 . 2]" 1
2117 1 131 LEU HB2 1 132 MET H . . 4.360 4.033 3.854 4.369 0.009 15 0 "[ . 1 . 2]" 1
2118 1 131 LEU HB2 1 133 TYR H . . 5.240 5.293 5.165 5.355 0.115 9 0 "[ . 1 . 2]" 1
2119 1 131 LEU HB2 1 146 LEU HA . . 6.150 3.531 2.326 5.369 . 0 0 "[ . 1 . 2]" 1
2120 1 131 LEU HB3 1 132 MET H . . 4.330 2.835 2.550 4.244 . 0 0 "[ . 1 . 2]" 1
2121 1 131 LEU HB3 1 133 TYR H . . 5.610 4.831 4.591 5.474 . 0 0 "[ . 1 . 2]" 1
2122 1 131 LEU HB3 1 146 LEU HA . . 6.150 4.290 3.543 4.967 . 0 0 "[ . 1 . 2]" 1
2123 1 131 LEU HG 1 132 MET H . . 4.540 3.652 2.862 3.942 . 0 0 "[ . 1 . 2]" 1
2124 1 131 LEU HG 1 132 MET HG2 . . 6.150 5.583 4.424 6.180 0.030 20 0 "[ . 1 . 2]" 1
2125 1 131 LEU HG 1 132 MET HG3 . . 6.150 5.208 3.664 6.172 0.022 6 0 "[ . 1 . 2]" 1
2126 1 131 LEU HG 1 132 MET ME . . 5.480 2.705 2.084 4.285 . 0 0 "[ . 1 . 2]" 1
2127 1 131 LEU HG 1 133 TYR H . . 5.120 5.108 4.831 5.203 0.083 14 0 "[ . 1 . 2]" 1
2128 1 131 LEU HG 1 144 PHE QE . . 6.150 5.418 4.747 6.044 . 0 0 "[ . 1 . 2]" 1
2129 1 131 LEU MD1 1 132 MET H . . 5.420 4.435 3.072 4.639 . 0 0 "[ . 1 . 2]" 1
2130 1 131 LEU MD1 1 132 MET ME . . 6.150 3.920 2.451 5.217 . 0 0 "[ . 1 . 2]" 1
2131 1 131 LEU MD1 1 146 LEU HA . . 6.150 4.346 3.540 5.402 . 0 0 "[ . 1 . 2]" 1
2132 1 131 LEU MD2 1 132 MET H . . 5.180 4.338 4.035 4.595 . 0 0 "[ . 1 . 2]" 1
2133 1 131 LEU MD2 1 132 MET HA . . 6.150 5.087 4.814 5.476 . 0 0 "[ . 1 . 2]" 1
2134 1 131 LEU MD2 1 132 MET ME . . 6.150 2.752 2.113 4.103 . 0 0 "[ . 1 . 2]" 1
2135 1 131 LEU MD2 1 133 TYR H . . 6.120 5.981 5.814 6.117 . 0 0 "[ . 1 . 2]" 1
2136 1 131 LEU MD2 1 144 PHE QE . . 6.150 3.330 2.463 4.209 . 0 0 "[ . 1 . 2]" 1
2137 1 131 LEU MD2 1 146 LEU HA . . 6.150 3.069 2.395 3.872 . 0 0 "[ . 1 . 2]" 1
2138 1 132 MET H 1 132 MET HG2 . . 4.640 3.785 1.874 4.652 0.012 13 0 "[ . 1 . 2]" 1
2139 1 132 MET H 1 132 MET HG3 . . 4.570 3.950 3.302 4.570 . 0 0 "[ . 1 . 2]" 1
2140 1 132 MET H 1 132 MET ME . . 4.790 2.544 2.128 3.482 . 0 0 "[ . 1 . 2]" 1
2141 1 132 MET H 1 133 TYR H . . 4.380 2.725 2.526 2.886 . 0 0 "[ . 1 . 2]" 1
2142 1 132 MET HA 1 132 MET ME . . 6.150 2.922 2.015 3.976 . 0 0 "[ . 1 . 2]" 1
2143 1 132 MET HB2 1 133 TYR H . . 4.250 3.856 3.406 4.322 0.072 7 0 "[ . 1 . 2]" 1
2144 1 132 MET HB3 1 133 TYR H . . 5.870 4.120 3.680 4.579 . 0 0 "[ . 1 . 2]" 1
2145 1 132 MET HG2 1 133 TYR H . . 5.780 5.399 3.498 5.857 0.077 17 0 "[ . 1 . 2]" 1
2146 1 132 MET HG3 1 133 TYR H . . 6.150 5.282 3.825 5.987 . 0 0 "[ . 1 . 2]" 1
2147 1 132 MET ME 1 146 LEU HB2 . . 6.150 6.038 4.905 6.286 0.136 18 0 "[ . 1 . 2]" 1
2148 1 133 TYR H 1 133 TYR HB2 . . 3.840 2.454 2.151 3.631 . 0 0 "[ . 1 . 2]" 1
2149 1 133 TYR H 1 133 TYR HB3 . . 3.580 2.816 2.488 3.027 . 0 0 "[ . 1 . 2]" 1
2150 1 133 TYR H 1 133 TYR QD . . 4.110 4.051 2.922 4.212 0.102 14 0 "[ . 1 . 2]" 1
2151 1 133 TYR HA 1 133 TYR QE . . 6.150 4.541 3.997 5.739 . 0 0 "[ . 1 . 2]" 1
2152 1 133 TYR QD 1 135 THR HA . . 6.150 4.914 4.306 5.859 . 0 0 "[ . 1 . 2]" 1
2153 1 133 TYR QD 1 135 THR HB . . 6.150 3.374 2.057 5.414 . 0 0 "[ . 1 . 2]" 1
2154 1 133 TYR QD 1 135 THR MG . . 6.150 2.509 2.010 3.769 . 0 0 "[ . 1 . 2]" 1
2155 1 133 TYR QE 1 135 THR HA . . 6.150 5.335 4.638 6.174 0.024 7 0 "[ . 1 . 2]" 1
2156 1 133 TYR QE 1 135 THR HB . . 6.150 3.120 2.109 6.151 0.001 7 0 "[ . 1 . 2]" 1
2157 1 133 TYR QE 1 135 THR MG . . 6.150 2.861 2.095 3.858 . 0 0 "[ . 1 . 2]" 1
2158 1 135 THR H 1 135 THR HB . . 3.650 3.461 2.799 3.685 0.035 16 0 "[ . 1 . 2]" 1
2159 1 135 THR H 1 136 TYR H . . 5.460 3.885 1.840 4.380 . 0 0 "[ . 1 . 2]" 1
2160 1 135 THR MG 1 136 TYR H . . 5.570 2.866 1.928 3.911 . 0 0 "[ . 1 . 2]" 1
2161 1 135 THR MG 1 137 LYS H . . 4.090 3.951 3.455 4.145 0.055 17 0 "[ . 1 . 2]" 1
2162 1 136 TYR H 1 136 TYR QD . . 5.020 4.273 4.102 4.651 . 0 0 "[ . 1 . 2]" 1
2163 1 136 TYR HA 1 137 LYS H . . 3.010 2.174 2.091 2.475 . 0 0 "[ . 1 . 2]" 1
2164 1 136 TYR HB2 1 137 LYS H . . 4.510 4.268 3.481 4.566 0.056 14 0 "[ . 1 . 2]" 1
2165 1 136 TYR HB3 1 137 LYS H . . 4.990 4.370 4.207 4.646 . 0 0 "[ . 1 . 2]" 1
2166 1 136 TYR QD 1 137 LYS H . . 5.130 3.230 2.627 4.142 . 0 0 "[ . 1 . 2]" 1
2167 1 136 TYR QE 1 138 TYR HB2 . . 6.150 4.207 3.483 5.148 . 0 0 "[ . 1 . 2]" 1
2168 1 137 LYS H 1 137 LYS HB2 . . 4.080 2.882 2.471 3.345 . 0 0 "[ . 1 . 2]" 1
2169 1 137 LYS H 1 137 LYS HB3 . . 4.010 3.320 2.537 3.956 . 0 0 "[ . 1 . 2]" 1
2170 1 137 LYS H 1 137 LYS QD . . 4.750 4.500 3.959 4.775 0.025 18 0 "[ . 1 . 2]" 1
2171 1 137 LYS H 1 137 LYS QE . . 6.150 5.441 4.673 6.186 0.036 5 0 "[ . 1 . 2]" 1
2172 1 137 LYS H 1 138 TYR H . . 4.620 4.381 4.222 4.502 . 0 0 "[ . 1 . 2]" 1
2173 1 137 LYS HA 1 137 LYS QE . . 6.150 4.006 3.195 4.586 . 0 0 "[ . 1 . 2]" 1
2174 1 137 LYS HA 1 138 TYR H . . 2.740 2.189 2.020 2.446 . 0 0 "[ . 1 . 2]" 1
2175 1 137 LYS HA 1 138 TYR HB3 . . 6.150 4.786 4.415 5.215 . 0 0 "[ . 1 . 2]" 1
2176 1 137 LYS HB2 1 137 LYS QD . . 3.430 2.942 2.249 3.461 0.031 13 0 "[ . 1 . 2]" 1
2177 1 137 LYS HB2 1 137 LYS QE . . 4.010 3.427 2.147 4.075 0.065 8 0 "[ . 1 . 2]" 1
2178 1 137 LYS HB2 1 138 TYR H . . 3.890 3.956 3.892 4.111 0.221 11 0 "[ . 1 . 2]" 1
2179 1 137 LYS HB3 1 137 LYS QD . . 3.440 2.831 2.203 3.503 0.063 9 0 "[ . 1 . 2]" 1
2180 1 137 LYS HB3 1 137 LYS QE . . 4.560 3.650 2.234 4.529 . 0 0 "[ . 1 . 2]" 1
2181 1 137 LYS HB3 1 138 TYR H . . 4.020 3.230 2.672 4.063 0.043 4 0 "[ . 1 . 2]" 1
2182 1 137 LYS QD 1 138 TYR H . . 3.380 3.058 2.346 3.479 0.099 20 0 "[ . 1 . 2]" 1
2183 1 138 TYR H 1 138 TYR HB2 . . 3.120 2.693 2.413 3.006 . 0 0 "[ . 1 . 2]" 1
2184 1 138 TYR H 1 138 TYR HB3 . . 3.160 2.740 2.391 2.982 . 0 0 "[ . 1 . 2]" 1
2185 1 138 TYR H 1 138 TYR QD . . 4.710 4.297 4.161 4.418 . 0 0 "[ . 1 . 2]" 1
2186 1 138 TYR H 1 139 LYS H . . 4.520 4.204 3.804 4.540 0.020 4 0 "[ . 1 . 2]" 1
2187 1 138 TYR HA 1 139 LYS H . . 3.420 2.151 1.925 2.388 . 0 0 "[ . 1 . 2]" 1
2188 1 138 TYR HA 1 139 LYS HA . . 6.150 4.442 4.320 4.571 . 0 0 "[ . 1 . 2]" 1
2189 1 138 TYR HA 1 140 ASN H . . 5.740 5.745 5.376 5.836 0.096 19 0 "[ . 1 . 2]" 1
2190 1 138 TYR HB3 1 140 ASN H . . 6.150 5.906 5.571 6.238 0.088 4 0 "[ . 1 . 2]" 1
2191 1 138 TYR QD 1 139 LYS H . . 4.000 3.668 2.504 4.055 0.055 14 0 "[ . 1 . 2]" 1
2192 1 138 TYR QD 1 139 LYS HB3 . . 6.150 5.798 5.302 6.089 . 0 0 "[ . 1 . 2]" 1
2193 1 138 TYR QD 1 139 LYS QD . . 6.150 5.667 4.528 6.210 0.060 18 0 "[ . 1 . 2]" 1
2194 1 138 TYR QD 1 140 ASN H . . 4.250 4.130 3.533 4.305 0.055 5 0 "[ . 1 . 2]" 1
2195 1 138 TYR QE 1 139 LYS H . . 6.150 4.970 4.003 5.764 . 0 0 "[ . 1 . 2]" 1
2196 1 138 TYR QE 1 140 ASN HA . . 6.150 2.973 2.249 3.785 . 0 0 "[ . 1 . 2]" 1
2197 1 138 TYR QE 1 140 ASN HB3 . . 6.150 5.226 4.260 6.155 0.005 4 0 "[ . 1 . 2]" 1
2198 1 138 TYR QE 1 141 PRO HA . . 6.150 6.049 5.635 6.190 0.040 13 0 "[ . 1 . 2]" 1
2199 1 138 TYR QE 1 141 PRO QD . . 6.150 2.561 2.066 3.345 . 0 0 "[ . 1 . 2]" 1
2200 1 139 LYS H 1 139 LYS HB2 . . 3.870 2.693 2.479 2.954 . 0 0 "[ . 1 . 2]" 1
2201 1 139 LYS H 1 139 LYS HB3 . . 4.170 3.740 3.654 3.909 . 0 0 "[ . 1 . 2]" 1
2202 1 139 LYS H 1 139 LYS HG2 . . 4.120 2.625 2.127 3.383 . 0 0 "[ . 1 . 2]" 1
2203 1 139 LYS H 1 139 LYS HG3 . . 4.130 3.734 2.396 4.222 0.092 16 0 "[ . 1 . 2]" 1
2204 1 139 LYS H 1 139 LYS QD . . 4.170 3.781 3.223 4.191 0.021 16 0 "[ . 1 . 2]" 1
2205 1 139 LYS H 1 144 PHE QD . . 6.150 6.036 5.636 6.187 0.037 2 0 "[ . 1 . 2]" 1
2206 1 139 LYS H 1 144 PHE QE . . 6.150 5.177 4.788 5.513 . 0 0 "[ . 1 . 2]" 1
2207 1 139 LYS HA 1 139 LYS QE . . 6.150 4.291 2.757 5.006 . 0 0 "[ . 1 . 2]" 1
2208 1 139 LYS HA 1 140 ASN H . . 3.130 2.172 2.008 3.247 0.117 4 0 "[ . 1 . 2]" 1
2209 1 139 LYS HA 1 140 ASN HA . . 6.150 4.404 4.255 4.750 . 0 0 "[ . 1 . 2]" 1
2210 1 139 LYS HA 1 140 ASN HB3 . . 6.150 5.579 4.751 5.721 . 0 0 "[ . 1 . 2]" 1
2211 1 139 LYS HA 1 144 PHE QD . . 6.150 5.190 4.927 5.656 . 0 0 "[ . 1 . 2]" 1
2212 1 139 LYS HB2 1 139 LYS QD . . 3.560 3.294 2.516 3.568 0.008 1 0 "[ . 1 . 2]" 1
2213 1 139 LYS HB2 1 139 LYS QE . . 4.350 4.147 3.388 4.417 0.067 16 0 "[ . 1 . 2]" 1
2214 1 139 LYS HB2 1 140 ASN H . . 3.830 3.802 1.863 3.953 0.123 5 0 "[ . 1 . 2]" 1
2215 1 139 LYS HB3 1 139 LYS QE . . 4.790 3.674 2.167 4.050 . 0 0 "[ . 1 . 2]" 1
2216 1 139 LYS HB3 1 140 ASN H . . 4.660 3.102 2.465 3.423 . 0 0 "[ . 1 . 2]" 1
2217 1 139 LYS HB3 1 140 ASN HA . . 6.150 5.213 5.028 5.587 . 0 0 "[ . 1 . 2]" 1
2218 1 139 LYS HB3 1 144 PHE QE . . 6.150 3.455 3.040 3.857 . 0 0 "[ . 1 . 2]" 1
2219 1 139 LYS HG2 1 144 PHE QD . . 6.150 5.277 4.819 5.761 . 0 0 "[ . 1 . 2]" 1
2220 1 139 LYS HG3 1 144 PHE QD . . 6.150 4.028 3.304 5.777 . 0 0 "[ . 1 . 2]" 1
2221 1 140 ASN H 1 140 ASN HB2 . . 3.440 2.346 2.180 3.473 0.033 4 0 "[ . 1 . 2]" 1
2222 1 140 ASN H 1 140 ASN HB3 . . 3.510 3.502 2.961 3.554 0.044 20 0 "[ . 1 . 2]" 1
2223 1 140 ASN H 1 144 PHE QD . . 5.650 4.802 3.748 5.032 . 0 0 "[ . 1 . 2]" 1
2224 1 140 ASN HA 1 142 TYR H . . 4.970 4.624 4.124 4.902 . 0 0 "[ . 1 . 2]" 1
2225 1 140 ASN HB2 1 144 PHE H . . 6.150 5.863 4.862 6.215 0.065 2 0 "[ . 1 . 2]" 1
2226 1 140 ASN HB2 1 144 PHE QD . . 6.150 5.115 4.690 5.359 . 0 0 "[ . 1 . 2]" 1
2227 1 140 ASN HB3 1 144 PHE H . . 6.150 5.825 4.289 6.191 0.041 5 0 "[ . 1 . 2]" 1
2228 1 140 ASN HB3 1 144 PHE QD . . 6.150 5.298 3.856 5.743 . 0 0 "[ . 1 . 2]" 1
2229 1 141 PRO HA 1 144 PHE H . . 4.150 4.049 3.746 4.185 0.035 3 0 "[ . 1 . 2]" 1
2230 1 141 PRO HA 1 144 PHE HB2 . . 6.150 5.986 5.460 6.197 0.047 5 0 "[ . 1 . 2]" 1
2231 1 141 PRO HA 1 144 PHE HB3 . . 5.580 4.547 4.188 4.721 . 0 0 "[ . 1 . 2]" 1
2232 1 141 PRO HA 1 144 PHE HZ . . 6.150 5.405 4.446 6.164 0.014 17 0 "[ . 1 . 2]" 1
2233 1 141 PRO HA 1 144 PHE QD . . 6.150 2.539 2.177 3.043 . 0 0 "[ . 1 . 2]" 1
2234 1 141 PRO HA 1 144 PHE QE . . 6.150 3.023 2.222 3.905 . 0 0 "[ . 1 . 2]" 1
2235 1 141 PRO HB2 1 142 TYR H . . 4.560 4.474 4.351 4.559 . 0 0 "[ . 1 . 2]" 1
2236 1 141 PRO HB2 1 144 PHE QD . . 6.150 5.121 4.630 5.624 . 0 0 "[ . 1 . 2]" 1
2237 1 141 PRO HB2 1 144 PHE QE . . 6.150 4.877 3.860 5.933 . 0 0 "[ . 1 . 2]" 1
2238 1 141 PRO HB3 1 144 PHE QD . . 6.150 4.577 4.198 4.994 . 0 0 "[ . 1 . 2]" 1
2239 1 141 PRO HB3 1 144 PHE QE . . 6.150 3.851 3.100 4.858 . 0 0 "[ . 1 . 2]" 1
2240 1 141 PRO QD 1 144 PHE QD . . 6.150 5.035 4.772 5.329 . 0 0 "[ . 1 . 2]" 1
2241 1 141 PRO QD 1 144 PHE QE . . 6.150 5.123 4.618 5.751 . 0 0 "[ . 1 . 2]" 1
2242 1 141 PRO QG 1 142 TYR H . . 4.600 4.465 4.151 4.600 0.000 3 0 "[ . 1 . 2]" 1
2243 1 141 PRO QG 1 142 TYR QD . . 6.150 3.968 2.931 4.763 . 0 0 "[ . 1 . 2]" 1
2244 1 141 PRO QG 1 142 TYR QE . . 6.150 5.132 3.508 6.180 0.030 17 0 "[ . 1 . 2]" 1
2245 1 141 PRO QG 1 144 PHE QD . . 6.150 5.630 5.313 6.034 . 0 0 "[ . 1 . 2]" 1
2246 1 142 TYR H 1 142 TYR HB2 . . 3.570 2.536 2.383 2.752 . 0 0 "[ . 1 . 2]" 1
2247 1 142 TYR H 1 142 TYR HB3 . . 3.550 3.253 2.794 3.623 0.073 6 0 "[ . 1 . 2]" 1
2248 1 142 TYR H 1 142 TYR QD . . 4.120 3.896 3.291 4.198 0.078 17 0 "[ . 1 . 2]" 1
2249 1 142 TYR H 1 144 PHE H . . 4.810 2.984 2.624 3.452 . 0 0 "[ . 1 . 2]" 1
2250 1 142 TYR QD 1 143 GLY H . . 6.150 4.849 4.336 5.047 . 0 0 "[ . 1 . 2]" 1
2251 1 143 GLY H 1 144 PHE H . . 5.110 2.430 1.923 3.085 . 0 0 "[ . 1 . 2]" 1
2252 1 143 GLY HA2 1 144 PHE HA . . 6.150 4.812 4.659 5.006 . 0 0 "[ . 1 . 2]" 1
2253 1 143 GLY HA2 1 145 HIS HA . . 6.150 5.589 4.554 6.223 0.073 20 0 "[ . 1 . 2]" 1
2254 1 144 PHE H 1 144 PHE HB2 . . 3.930 3.524 3.465 3.611 . 0 0 "[ . 1 . 2]" 1
2255 1 144 PHE H 1 144 PHE HB3 . . 3.930 2.310 2.192 2.609 . 0 0 "[ . 1 . 2]" 1
2256 1 144 PHE H 1 145 HIS H . . 4.600 3.690 2.774 4.648 0.048 12 0 "[ . 1 . 2]" 1
2257 1 144 PHE HA 1 145 HIS HA . . 6.150 4.921 4.406 5.333 . 0 0 "[ . 1 . 2]" 1
2258 1 144 PHE HB2 1 145 HIS H . . 4.630 3.735 2.598 4.535 . 0 0 "[ . 1 . 2]" 1
2259 1 144 PHE HB3 1 145 HIS H . . 4.770 4.227 3.958 4.556 . 0 0 "[ . 1 . 2]" 1
2260 1 144 PHE QD 1 147 PRO HD3 . . 6.150 4.032 3.161 4.960 . 0 0 "[ . 1 . 2]" 1
2261 1 144 PHE QE 1 147 PRO HB3 . . 6.150 5.975 5.150 6.161 0.011 14 0 "[ . 1 . 2]" 1
2262 1 145 HIS H 1 145 HIS HB2 . . 4.130 3.822 3.211 4.044 . 0 0 "[ . 1 . 2]" 1
2263 1 145 HIS H 1 145 HIS HB3 . . 3.880 2.902 2.595 3.837 . 0 0 "[ . 1 . 2]" 1
2264 1 145 HIS H 1 145 HIS HD2 . . 4.230 3.639 2.491 4.291 0.061 7 0 "[ . 1 . 2]" 1
2265 1 145 HIS H 1 146 LEU H . . 4.650 4.498 4.289 4.680 0.030 19 0 "[ . 1 . 2]" 1
2266 1 145 HIS HA 1 146 LEU H . . 3.460 2.992 2.411 3.468 0.008 9 0 "[ . 1 . 2]" 1
2267 1 145 HIS HA 1 146 LEU HA . . 6.150 4.414 4.160 4.655 . 0 0 "[ . 1 . 2]" 1
2268 1 145 HIS HB2 1 146 LEU H . . 4.380 2.375 2.011 4.046 . 0 0 "[ . 1 . 2]" 1
2269 1 145 HIS HB3 1 146 LEU H . . 4.700 3.646 3.449 4.067 . 0 0 "[ . 1 . 2]" 1
2270 1 145 HIS HB3 1 146 LEU MD1 . . 6.150 5.027 4.350 6.158 0.008 13 0 "[ . 1 . 2]" 1
2271 1 145 HIS HD2 1 146 LEU H . . 5.140 4.786 3.523 5.197 0.057 13 0 "[ . 1 . 2]" 1
2272 1 145 HIS HE1 1 146 LEU HA . . 6.150 5.967 5.495 6.193 0.043 19 0 "[ . 1 . 2]" 1
2273 1 145 HIS HE1 1 146 LEU HB2 . . 6.150 4.968 3.285 6.183 0.033 14 0 "[ . 1 . 2]" 1
2274 1 145 HIS HE1 1 146 LEU HB3 . . 6.150 5.819 4.628 6.293 0.143 14 0 "[ . 1 . 2]" 1
2275 1 145 HIS HE1 1 146 LEU MD1 . . 6.150 6.001 5.282 6.207 0.057 16 0 "[ . 1 . 2]" 1
2276 1 145 HIS HE1 1 147 PRO HA . . 6.150 5.127 4.186 6.186 0.036 15 0 "[ . 1 . 2]" 1
2277 1 145 HIS HE1 1 148 LYS HA . . 6.150 5.217 4.113 6.138 . 0 0 "[ . 1 . 2]" 1
2278 1 145 HIS HE1 1 151 VAL MG1 . . 6.150 5.072 3.683 5.710 . 0 0 "[ . 1 . 2]" 1
2279 1 145 HIS HE1 1 151 VAL MG2 . . 6.150 3.611 2.382 4.284 . 0 0 "[ . 1 . 2]" 1
2280 1 146 LEU H 1 146 LEU HB2 . . 3.670 2.672 2.206 3.821 0.151 9 0 "[ . 1 . 2]" 1
2281 1 146 LEU H 1 146 LEU HB3 . . 3.610 3.378 2.507 3.628 0.018 20 0 "[ . 1 . 2]" 1
2282 1 146 LEU H 1 146 LEU HG . . 4.450 4.129 3.772 4.459 0.009 3 0 "[ . 1 . 2]" 1
2283 1 146 LEU H 1 146 LEU MD1 . . 4.520 2.717 2.101 4.028 . 0 0 "[ . 1 . 2]" 1
2284 1 146 LEU H 1 146 LEU MD2 . . 4.180 2.887 1.729 3.505 . 0 0 "[ . 1 . 2]" 1
2285 1 146 LEU HA 1 147 PRO HB2 . . 6.150 5.665 5.409 5.811 . 0 0 "[ . 1 . 2]" 1
2286 1 146 LEU HA 1 147 PRO HB3 . . 6.150 5.021 4.683 5.498 . 0 0 "[ . 1 . 2]" 1
2287 1 146 LEU HB2 1 147 PRO HD3 . . 6.150 4.627 3.390 5.291 . 0 0 "[ . 1 . 2]" 1
2288 1 146 LEU HB2 1 150 ASP H . . 5.790 5.094 3.709 5.805 0.015 2 0 "[ . 1 . 2]" 1
2289 1 146 LEU HB2 1 150 ASP HB3 . . 6.150 4.737 3.453 5.575 . 0 0 "[ . 1 . 2]" 1
2290 1 146 LEU HB2 1 151 VAL H . . 4.380 4.364 4.209 4.483 0.103 16 0 "[ . 1 . 2]" 1
2291 1 146 LEU HB2 1 151 VAL MG1 . . 6.050 4.906 4.276 6.184 0.134 5 0 "[ . 1 . 2]" 1
2292 1 146 LEU HB3 1 147 PRO HD3 . . 6.150 3.990 3.634 4.650 . 0 0 "[ . 1 . 2]" 1
2293 1 146 LEU HB3 1 150 ASP H . . 5.800 4.425 3.753 5.613 . 0 0 "[ . 1 . 2]" 1
2294 1 146 LEU HG 1 147 PRO HD2 . . 6.150 3.370 2.563 4.328 . 0 0 "[ . 1 . 2]" 1
2295 1 146 LEU HG 1 147 PRO HD3 . . 6.150 4.732 3.739 5.662 . 0 0 "[ . 1 . 2]" 1
2296 1 146 LEU HG 1 148 LYS H . . 4.840 4.838 4.342 5.002 0.162 11 0 "[ . 1 . 2]" 1
2297 1 146 LEU HG 1 150 ASP H . . 4.970 4.514 3.769 4.934 . 0 0 "[ . 1 . 2]" 1
2298 1 146 LEU MD1 1 147 PRO HD2 . . 6.150 3.872 3.386 4.585 . 0 0 "[ . 1 . 2]" 1
2299 1 146 LEU MD1 1 147 PRO HD3 . . 6.150 4.491 3.668 5.749 . 0 0 "[ . 1 . 2]" 1
2300 1 146 LEU MD1 1 150 ASP HB2 . . 6.150 3.533 2.107 4.182 . 0 0 "[ . 1 . 2]" 1
2301 1 146 LEU MD1 1 154 ILE MG . . 5.370 4.306 2.750 5.381 0.011 15 0 "[ . 1 . 2]" 1
2302 1 146 LEU MD2 1 147 PRO HD2 . . 6.150 4.433 3.919 4.815 . 0 0 "[ . 1 . 2]" 1
2303 1 146 LEU MD2 1 147 PRO HD3 . . 6.150 5.447 5.062 5.958 . 0 0 "[ . 1 . 2]" 1
2304 1 146 LEU MD2 1 150 ASP H . . 5.050 4.749 4.236 5.162 0.112 9 0 "[ . 1 . 2]" 1
2305 1 146 LEU MD2 1 150 ASP HB2 . . 6.150 2.894 2.229 3.869 . 0 0 "[ . 1 . 2]" 1
2306 1 146 LEU MD2 1 150 ASP HB3 . . 6.150 3.596 2.442 5.016 . 0 0 "[ . 1 . 2]" 1
2307 1 146 LEU MD2 1 151 VAL H . . 4.610 3.540 3.039 4.134 . 0 0 "[ . 1 . 2]" 1
2308 1 146 LEU MD2 1 151 VAL HA . . 6.150 2.776 2.163 3.532 . 0 0 "[ . 1 . 2]" 1
2309 1 146 LEU MD2 1 151 VAL MG1 . . 4.830 3.574 3.362 3.978 . 0 0 "[ . 1 . 2]" 1
2310 1 146 LEU MD2 1 151 VAL MG2 . . 5.690 2.050 1.871 2.442 . 0 0 "[ . 1 . 2]" 1
2311 1 146 LEU MD2 1 154 ILE H . . 5.780 4.921 4.033 5.884 0.104 13 0 "[ . 1 . 2]" 1
2312 1 146 LEU MD2 1 154 ILE MG . . 5.050 3.119 2.536 3.855 . 0 0 "[ . 1 . 2]" 1
2313 1 147 PRO HA 1 148 LYS HA . . 6.150 4.819 4.745 4.911 . 0 0 "[ . 1 . 2]" 1
2314 1 147 PRO HA 1 148 LYS HB2 . . 6.150 4.339 4.102 4.567 . 0 0 "[ . 1 . 2]" 1
2315 1 147 PRO HA 1 148 LYS HB3 . . 6.150 5.456 4.933 5.907 . 0 0 "[ . 1 . 2]" 1
2316 1 147 PRO HB2 1 148 LYS H . . 3.640 2.808 2.322 3.054 . 0 0 "[ . 1 . 2]" 1
2317 1 147 PRO HB2 1 148 LYS QE . . 4.980 4.576 3.598 4.999 0.019 15 0 "[ . 1 . 2]" 1
2318 1 147 PRO HB3 1 148 LYS H . . 4.000 3.951 3.809 4.064 0.064 11 0 "[ . 1 . 2]" 1
2319 1 148 LYS H 1 148 LYS HB2 . . 3.780 3.247 2.862 3.473 . 0 0 "[ . 1 . 2]" 1
2320 1 148 LYS H 1 148 LYS HB3 . . 3.460 3.281 2.876 3.592 0.132 3 0 "[ . 1 . 2]" 1
2321 1 148 LYS H 1 148 LYS HG2 . . 5.150 4.859 4.573 5.195 0.045 13 0 "[ . 1 . 2]" 1
2322 1 148 LYS H 1 148 LYS HG3 . . 5.010 4.760 4.299 5.095 0.085 10 0 "[ . 1 . 2]" 1
2323 1 148 LYS H 1 148 LYS QD . . 5.150 5.073 4.509 5.267 0.117 5 0 "[ . 1 . 2]" 1
2324 1 148 LYS H 1 148 LYS QE . . 5.050 4.835 4.122 5.108 0.058 16 0 "[ . 1 . 2]" 1
2325 1 148 LYS H 1 149 ASP H . . 4.590 2.592 2.054 2.961 . 0 0 "[ . 1 . 2]" 1
2326 1 148 LYS H 1 149 ASP HA . . 4.810 4.821 4.586 4.927 0.117 2 0 "[ . 1 . 2]" 1
2327 1 148 LYS H 1 150 ASP H . . 5.180 3.049 2.777 3.215 . 0 0 "[ . 1 . 2]" 1
2328 1 148 LYS H 1 151 VAL HB . . 6.150 5.095 4.629 5.490 . 0 0 "[ . 1 . 2]" 1
2329 1 148 LYS HA 1 148 LYS QE . . 6.150 4.268 3.526 4.691 . 0 0 "[ . 1 . 2]" 1
2330 1 148 LYS HA 1 150 ASP H . . 4.640 4.582 4.433 4.706 0.066 4 0 "[ . 1 . 2]" 1
2331 1 148 LYS HA 1 151 VAL H . . 4.040 3.791 3.603 4.007 . 0 0 "[ . 1 . 2]" 1
2332 1 148 LYS HA 1 151 VAL HA . . 6.150 5.851 5.514 6.144 . 0 0 "[ . 1 . 2]" 1
2333 1 148 LYS HA 1 151 VAL HB . . 5.300 3.392 2.856 3.769 . 0 0 "[ . 1 . 2]" 1
2334 1 148 LYS HA 1 151 VAL MG1 . . 5.620 4.505 4.032 4.838 . 0 0 "[ . 1 . 2]" 1
2335 1 148 LYS HA 1 151 VAL MG2 . . 5.120 3.030 2.558 3.385 . 0 0 "[ . 1 . 2]" 1
2336 1 148 LYS HB2 1 149 ASP H . . 6.150 3.390 2.668 3.763 . 0 0 "[ . 1 . 2]" 1
2337 1 148 LYS HB2 1 150 ASP H . . 5.730 5.558 5.031 5.769 0.039 12 0 "[ . 1 . 2]" 1
2338 1 148 LYS HB2 1 151 VAL H . . 5.800 5.874 5.823 5.939 0.139 8 0 "[ . 1 . 2]" 1
2339 1 148 LYS HB3 1 148 LYS QD . . 3.090 2.796 2.252 3.232 0.142 13 0 "[ . 1 . 2]" 1
2340 1 148 LYS HB3 1 149 ASP H . . 6.150 2.213 1.937 2.704 . 0 0 "[ . 1 . 2]" 1
2341 1 148 LYS HB3 1 149 ASP HB2 . . 5.540 3.890 3.457 4.584 . 0 0 "[ . 1 . 2]" 1
2342 1 148 LYS HB3 1 149 ASP HB3 . . 6.110 4.873 4.521 5.469 . 0 0 "[ . 1 . 2]" 1
2343 1 148 LYS HB3 1 150 ASP H . . 5.150 4.764 4.502 5.211 0.061 13 0 "[ . 1 . 2]" 1
2344 1 148 LYS HG2 1 151 VAL MG2 . . 6.150 5.172 4.414 5.800 . 0 0 "[ . 1 . 2]" 1
2345 1 148 LYS HG3 1 151 VAL HB . . 5.800 5.033 4.121 5.842 0.042 10 0 "[ . 1 . 2]" 1
2346 1 149 ASP H 1 150 ASP H . . 4.030 2.805 2.593 2.990 . 0 0 "[ . 1 . 2]" 1
2347 1 149 ASP HA 1 152 LYS QB . . 5.430 4.350 3.728 4.733 . 0 0 "[ . 1 . 2]" 1
2348 1 149 ASP HA 1 152 LYS QG . . 5.630 2.438 2.075 3.201 . 0 0 "[ . 1 . 2]" 1
2349 1 149 ASP HA 1 153 GLY H . . 5.590 4.416 3.967 4.774 . 0 0 "[ . 1 . 2]" 1
2350 1 149 ASP HB2 1 150 ASP H . . 6.150 3.726 2.673 4.041 . 0 0 "[ . 1 . 2]" 1
2351 1 149 ASP HB3 1 150 ASP H . . 3.600 2.908 2.360 3.616 0.016 10 0 "[ . 1 . 2]" 1
2352 1 149 ASP HB3 1 151 VAL H . . 5.280 5.063 4.660 5.355 0.075 4 0 "[ . 1 . 2]" 1
2353 1 150 ASP H 1 150 ASP HB2 . . 3.670 2.663 2.412 2.829 . 0 0 "[ . 1 . 2]" 1
2354 1 150 ASP H 1 150 ASP HB3 . . 3.730 3.514 3.446 3.590 . 0 0 "[ . 1 . 2]" 1
2355 1 150 ASP H 1 151 VAL H . . 3.390 2.690 2.434 2.872 . 0 0 "[ . 1 . 2]" 1
2356 1 150 ASP H 1 151 VAL HA . . 5.890 5.327 5.109 5.469 . 0 0 "[ . 1 . 2]" 1
2357 1 150 ASP H 1 151 VAL HB . . 4.990 4.978 4.748 5.087 0.097 20 0 "[ . 1 . 2]" 1
2358 1 150 ASP H 1 152 LYS QG . . 4.920 4.821 4.387 4.954 0.034 17 0 "[ . 1 . 2]" 1
2359 1 150 ASP HB2 1 151 VAL H . . 4.780 2.954 2.317 3.255 . 0 0 "[ . 1 . 2]" 1
2360 1 150 ASP HB2 1 151 VAL MG2 . . 6.150 3.389 2.557 3.699 . 0 0 "[ . 1 . 2]" 1
2361 1 150 ASP HB2 1 153 GLY H . . 5.890 5.321 5.032 5.658 . 0 0 "[ . 1 . 2]" 1
2362 1 150 ASP HB2 1 154 ILE H . . 6.150 5.337 4.934 5.697 . 0 0 "[ . 1 . 2]" 1
2363 1 150 ASP HB3 1 151 VAL H . . 4.260 4.105 3.421 4.293 0.033 8 0 "[ . 1 . 2]" 1
2364 1 150 ASP HB3 1 151 VAL MG2 . . 6.150 4.689 3.573 5.083 . 0 0 "[ . 1 . 2]" 1
2365 1 151 VAL H 1 151 VAL HB . . 3.450 2.494 2.401 2.608 . 0 0 "[ . 1 . 2]" 1
2366 1 151 VAL H 1 151 VAL MG1 . . 3.780 3.814 3.788 3.845 0.065 16 0 "[ . 1 . 2]" 1
2367 1 151 VAL H 1 151 VAL MG2 . . 3.860 2.333 2.222 2.419 . 0 0 "[ . 1 . 2]" 1
2368 1 151 VAL H 1 152 LYS QG . . 4.170 4.053 3.634 4.213 0.043 1 0 "[ . 1 . 2]" 1
2369 1 151 VAL HA 1 152 LYS HA . . 6.150 4.733 4.670 4.895 . 0 0 "[ . 1 . 2]" 1
2370 1 151 VAL HA 1 153 GLY H . . 5.590 4.169 3.870 4.652 . 0 0 "[ . 1 . 2]" 1
2371 1 151 VAL HA 1 154 ILE H . . 4.260 3.698 3.482 3.948 . 0 0 "[ . 1 . 2]" 1
2372 1 151 VAL HA 1 154 ILE HB . . 6.150 4.463 4.110 4.756 . 0 0 "[ . 1 . 2]" 1
2373 1 151 VAL HA 1 154 ILE MG . . 5.590 2.207 2.015 2.416 . 0 0 "[ . 1 . 2]" 1
2374 1 151 VAL HA 1 155 GLN H . . 6.150 4.035 3.701 4.382 . 0 0 "[ . 1 . 2]" 1
2375 1 151 VAL HB 1 152 LYS H . . 3.910 2.531 2.312 2.823 . 0 0 "[ . 1 . 2]" 1
2376 1 151 VAL HB 1 153 GLY H . . 5.540 4.799 4.606 5.147 . 0 0 "[ . 1 . 2]" 1
2377 1 151 VAL MG1 1 152 LYS QD . . 6.150 5.838 5.441 6.181 0.031 15 0 "[ . 1 . 2]" 1
2378 1 151 VAL MG1 1 154 ILE MG . . 4.930 3.338 3.139 3.521 . 0 0 "[ . 1 . 2]" 1
2379 1 151 VAL MG2 1 152 LYS H . . 3.910 3.897 3.744 3.955 0.045 8 0 "[ . 1 . 2]" 1
2380 1 151 VAL MG2 1 152 LYS HA . . 6.090 5.521 5.467 5.639 . 0 0 "[ . 1 . 2]" 1
2381 1 151 VAL MG2 1 152 LYS QB . . 6.150 5.384 5.196 5.781 . 0 0 "[ . 1 . 2]" 1
2382 1 151 VAL MG2 1 152 LYS QG . . 6.150 5.211 4.625 5.551 . 0 0 "[ . 1 . 2]" 1
2383 1 152 LYS H 1 152 LYS QB . . 3.540 2.615 2.363 2.807 . 0 0 "[ . 1 . 2]" 1
2384 1 152 LYS H 1 152 LYS QD . . 3.950 3.626 3.181 3.985 0.035 15 0 "[ . 1 . 2]" 1
2385 1 152 LYS H 1 152 LYS QE . . 6.150 4.490 3.834 5.390 . 0 0 "[ . 1 . 2]" 1
2386 1 152 LYS H 1 152 LYS QG . . 3.940 2.233 1.902 2.525 . 0 0 "[ . 1 . 2]" 1
2387 1 152 LYS HA 1 152 LYS QE . . 6.150 5.227 3.902 5.597 . 0 0 "[ . 1 . 2]" 1
2388 1 152 LYS HA 1 155 GLN H . . 6.150 3.508 3.236 3.835 . 0 0 "[ . 1 . 2]" 1
2389 1 152 LYS HA 1 155 GLN HG2 . . 6.150 4.442 2.088 6.070 . 0 0 "[ . 1 . 2]" 1
2390 1 152 LYS QB 1 153 GLY H . . 3.900 3.721 2.248 3.918 0.018 14 0 "[ . 1 . 2]" 1
2391 1 152 LYS QB 1 156 ALA MB . . 6.050 4.732 4.433 5.172 . 0 0 "[ . 1 . 2]" 1
2392 1 152 LYS QD 1 153 GLY H . . 3.730 2.996 2.423 3.818 0.088 16 0 "[ . 1 . 2]" 1
2393 1 152 LYS QE 1 153 GLY H . . 6.020 4.490 2.284 5.121 . 0 0 "[ . 1 . 2]" 1
2394 1 152 LYS QG 1 153 GLY H . . 3.780 3.145 2.014 3.627 . 0 0 "[ . 1 . 2]" 1
2395 1 153 GLY H 1 154 ILE H . . 3.330 2.891 2.619 3.274 . 0 0 "[ . 1 . 2]" 1
2396 1 153 GLY H 1 154 ILE HB . . 6.150 5.282 5.049 5.763 . 0 0 "[ . 1 . 2]" 1
2397 1 153 GLY H 1 154 ILE MG . . 4.280 3.954 3.712 4.279 . 0 0 "[ . 1 . 2]" 1
2398 1 153 GLY H 1 155 GLN H . . 4.720 4.092 3.859 4.402 . 0 0 "[ . 1 . 2]" 1
2399 1 153 GLY H 1 156 ALA H . . 5.220 4.980 4.779 5.123 . 0 0 "[ . 1 . 2]" 1
2400 1 153 GLY HA2 1 155 GLN H . . 5.270 4.627 4.309 4.818 . 0 0 "[ . 1 . 2]" 1
2401 1 153 GLY HA2 1 156 ALA H . . 3.770 3.783 3.712 3.828 0.058 20 0 "[ . 1 . 2]" 1
2402 1 153 GLY HA2 1 156 ALA MB . . 6.150 3.187 3.038 3.403 . 0 0 "[ . 1 . 2]" 1
2403 1 153 GLY HA2 1 157 LEU MD2 . . 6.150 4.331 4.108 4.499 . 0 0 "[ . 1 . 2]" 1
2404 1 154 ILE H 1 154 ILE HB . . 3.200 2.450 2.367 2.547 . 0 0 "[ . 1 . 2]" 1
2405 1 154 ILE H 1 154 ILE HG12 . . 5.100 4.525 4.470 4.572 . 0 0 "[ . 1 . 2]" 1
2406 1 154 ILE H 1 154 ILE HG13 . . 4.520 4.340 4.253 4.441 . 0 0 "[ . 1 . 2]" 1
2407 1 154 ILE H 1 154 ILE MD . . 4.380 4.390 4.329 4.436 0.056 16 0 "[ . 1 . 2]" 1
2408 1 154 ILE H 1 154 ILE MG . . 3.030 2.154 1.975 2.416 . 0 0 "[ . 1 . 2]" 1
2409 1 154 ILE H 1 155 GLN H . . 3.590 2.942 2.793 3.245 . 0 0 "[ . 1 . 2]" 1
2410 1 154 ILE H 1 156 ALA H . . 4.820 4.299 4.195 4.441 . 0 0 "[ . 1 . 2]" 1
2411 1 154 ILE H 1 157 LEU H . . 6.150 5.459 5.253 5.684 . 0 0 "[ . 1 . 2]" 1
2412 1 154 ILE H 1 157 LEU MD2 . . 5.140 5.120 4.840 5.186 0.046 9 0 "[ . 1 . 2]" 1
2413 1 154 ILE HA 1 157 LEU H . . 4.530 3.501 3.268 3.763 . 0 0 "[ . 1 . 2]" 1
2414 1 154 ILE HA 1 157 LEU MD1 . . 6.150 2.217 2.098 2.365 . 0 0 "[ . 1 . 2]" 1
2415 1 154 ILE HA 1 157 LEU MD2 . . 5.920 3.549 3.412 3.635 . 0 0 "[ . 1 . 2]" 1
2416 1 154 ILE HG12 1 155 GLN H . . 4.760 4.036 3.925 4.182 . 0 0 "[ . 1 . 2]" 1
2417 1 154 ILE HG12 1 158 TYR H . . 5.490 3.971 3.537 4.314 . 0 0 "[ . 1 . 2]" 1
2418 1 154 ILE HG12 1 158 TYR QD . . 6.150 2.250 2.134 2.490 . 0 0 "[ . 1 . 2]" 1
2419 1 154 ILE HG12 1 159 GLY H . . 5.910 5.714 5.384 5.962 0.052 3 0 "[ . 1 . 2]" 1
2420 1 154 ILE HG13 1 155 GLN H . . 5.020 4.855 4.743 4.978 . 0 0 "[ . 1 . 2]" 1
2421 1 154 ILE HG13 1 156 ALA H . . 6.150 5.700 5.473 5.945 . 0 0 "[ . 1 . 2]" 1
2422 1 154 ILE HG13 1 158 TYR QD . . 6.150 2.760 2.393 3.506 . 0 0 "[ . 1 . 2]" 1
2423 1 154 ILE MD 1 157 LEU MD2 . . 5.680 5.691 5.646 5.714 0.034 20 0 "[ . 1 . 2]" 1
2424 1 154 ILE MD 1 158 TYR QD . . 6.150 3.276 3.085 3.467 . 0 0 "[ . 1 . 2]" 1
2425 1 154 ILE HG13 1 154 ILE MG . . 3.720 3.241 3.211 3.281 . 0 0 "[ . 1 . 2]" 1
2426 1 154 ILE MG 1 155 GLN H . . 4.490 2.222 2.034 2.340 . 0 0 "[ . 1 . 2]" 1
2427 1 154 ILE MG 1 155 GLN HA . . 4.920 3.493 3.235 3.674 . 0 0 "[ . 1 . 2]" 1
2428 1 154 ILE MG 1 155 GLN HG2 . . 5.720 4.558 3.035 5.524 . 0 0 "[ . 1 . 2]" 1
2429 1 154 ILE MG 1 155 GLN HG3 . . 6.000 4.488 2.824 5.462 . 0 0 "[ . 1 . 2]" 1
2430 1 154 ILE MG 1 156 ALA H . . 4.320 4.374 4.340 4.399 0.079 6 0 "[ . 1 . 2]" 1
2431 1 154 ILE MG 1 158 TYR QD . . 6.150 4.194 3.938 4.526 . 0 0 "[ . 1 . 2]" 1
2432 1 154 ILE MG 1 158 TYR QE . . 6.150 4.855 4.641 5.242 . 0 0 "[ . 1 . 2]" 1
2433 1 155 GLN H 1 155 GLN HG2 . . 4.870 3.830 2.230 4.580 . 0 0 "[ . 1 . 2]" 1
2434 1 155 GLN H 1 155 GLN HG3 . . 4.860 3.770 2.422 4.623 . 0 0 "[ . 1 . 2]" 1
2435 1 155 GLN H 1 156 ALA H . . 3.600 2.779 2.706 2.883 . 0 0 "[ . 1 . 2]" 1
2436 1 155 GLN H 1 157 LEU H . . 6.050 4.231 4.140 4.322 . 0 0 "[ . 1 . 2]" 1
2437 1 155 GLN H 1 157 LEU MD1 . . 5.320 5.161 5.043 5.314 . 0 0 "[ . 1 . 2]" 1
2438 1 155 GLN HG2 1 156 ALA H . . 5.210 4.645 2.839 5.274 0.064 19 0 "[ . 1 . 2]" 1
2439 1 155 GLN HG2 1 159 GLY H . . 6.130 5.062 3.591 6.213 0.083 8 0 "[ . 1 . 2]" 1
2440 1 155 GLN HG3 1 156 ALA H . . 5.790 4.791 2.919 5.718 . 0 0 "[ . 1 . 2]" 1
2441 1 155 GLN QB 1 156 ALA H . . 4.240 3.272 2.881 3.891 . 0 0 "[ . 1 . 2]" 1
2442 1 155 GLN QB 1 159 GLY H . . 5.430 4.700 3.695 5.426 . 0 0 "[ . 1 . 2]" 1
2443 1 156 ALA H 1 156 ALA MB . . 2.870 2.261 2.203 2.304 . 0 0 "[ . 1 . 2]" 1
2444 1 156 ALA H 1 157 LEU H . . 3.520 2.538 2.412 2.662 . 0 0 "[ . 1 . 2]" 1
2445 1 156 ALA H 1 157 LEU MD1 . . 4.970 4.779 4.445 4.967 . 0 0 "[ . 1 . 2]" 1
2446 1 156 ALA H 1 157 LEU MD2 . . 5.240 4.034 3.769 4.232 . 0 0 "[ . 1 . 2]" 1
2447 1 156 ALA H 1 158 TYR H . . 4.480 4.484 4.351 4.538 0.058 18 0 "[ . 1 . 2]" 1
2448 1 156 ALA MB 1 157 LEU H . . 3.200 3.154 2.957 3.264 0.064 9 0 "[ . 1 . 2]" 1
2449 1 156 ALA MB 1 157 LEU HB2 . . 5.550 5.093 4.830 5.214 . 0 0 "[ . 1 . 2]" 1
2450 1 156 ALA MB 1 157 LEU MD2 . . 6.150 2.741 2.445 3.141 . 0 0 "[ . 1 . 2]" 1
2451 1 156 ALA MB 1 158 TYR H . . 6.150 5.068 4.902 5.188 . 0 0 "[ . 1 . 2]" 1
2452 1 157 LEU H 1 157 LEU HB2 . . 3.590 2.765 2.653 2.944 . 0 0 "[ . 1 . 2]" 1
2453 1 157 LEU H 1 157 LEU HB3 . . 3.780 3.690 3.628 3.796 0.016 9 0 "[ . 1 . 2]" 1
2454 1 157 LEU H 1 157 LEU HG . . 3.530 2.152 1.993 2.324 . 0 0 "[ . 1 . 2]" 1
2455 1 157 LEU H 1 157 LEU MD1 . . 3.900 3.677 3.552 3.777 . 0 0 "[ . 1 . 2]" 1
2456 1 157 LEU H 1 157 LEU MD2 . . 3.970 3.111 2.955 3.243 . 0 0 "[ . 1 . 2]" 1
2457 1 157 LEU H 1 158 TYR H . . 3.780 2.332 2.168 2.603 . 0 0 "[ . 1 . 2]" 1
2458 1 157 LEU H 1 158 TYR QD . . 4.230 3.866 3.710 4.180 . 0 0 "[ . 1 . 2]" 1
2459 1 157 LEU H 1 159 GLY H . . 4.690 3.359 3.122 3.526 . 0 0 "[ . 1 . 2]" 1
2460 1 157 LEU HA 1 158 TYR QD . . 6.150 5.034 4.865 5.133 . 0 0 "[ . 1 . 2]" 1
2461 1 157 LEU HB2 1 158 TYR H . . 3.880 2.380 2.201 2.732 . 0 0 "[ . 1 . 2]" 1
2462 1 157 LEU HB2 1 158 TYR QD . . 6.150 2.533 2.257 2.825 . 0 0 "[ . 1 . 2]" 1
2463 1 157 LEU HB2 1 159 GLY H . . 5.090 4.612 4.434 4.841 . 0 0 "[ . 1 . 2]" 1
2464 1 157 LEU HB3 1 158 TYR H . . 4.420 3.734 3.563 3.998 . 0 0 "[ . 1 . 2]" 1
2465 1 157 LEU HB3 1 158 TYR QD . . 6.150 4.087 3.883 4.331 . 0 0 "[ . 1 . 2]" 1
2466 1 157 LEU HG 1 158 TYR H . . 4.550 3.652 3.460 3.799 . 0 0 "[ . 1 . 2]" 1
2467 1 157 LEU HG 1 159 GLY H . . 5.330 5.366 5.320 5.421 0.091 20 0 "[ . 1 . 2]" 1
2468 1 157 LEU MD1 1 158 TYR H . . 4.810 4.031 3.786 4.329 . 0 0 "[ . 1 . 2]" 1
2469 1 157 LEU MD1 1 158 TYR HB3 . . 6.150 6.184 6.157 6.214 0.064 19 0 "[ . 1 . 2]" 1
2470 1 157 LEU MD1 1 158 TYR QD . . 6.150 3.260 2.987 3.486 . 0 0 "[ . 1 . 2]" 1
2471 1 157 LEU MD2 1 158 TYR QD . . 6.150 5.059 4.906 5.196 . 0 0 "[ . 1 . 2]" 1
2472 1 157 LEU MD2 1 159 GLY H . . 6.150 5.685 5.554 5.897 . 0 0 "[ . 1 . 2]" 1
2473 1 158 TYR H 1 158 TYR QD . . 3.500 2.383 2.195 2.781 . 0 0 "[ . 1 . 2]" 1
2474 1 158 TYR H 1 159 GLY H . . 3.690 2.365 2.105 2.663 . 0 0 "[ . 1 . 2]" 1
2475 1 158 TYR HB2 1 159 GLY H . . 5.060 3.418 3.036 3.701 . 0 0 "[ . 1 . 2]" 1
2476 1 158 TYR HB3 1 159 GLY H . . 5.520 4.244 3.959 4.421 . 0 0 "[ . 1 . 2]" 1
2477 1 158 TYR QD 1 159 GLY H . . 4.400 4.356 4.157 4.446 0.046 11 0 "[ . 1 . 2]" 1
2478 1 159 GLY H 1 160 PRO HD2 . . 4.390 3.512 1.956 4.425 0.035 14 0 "[ . 1 . 2]" 1
2479 1 159 GLY H 1 160 PRO HD3 . . 3.830 3.175 2.389 3.866 0.036 3 0 "[ . 1 . 2]" 1
2480 1 159 GLY H 1 160 PRO HG3 . . 6.150 5.384 4.577 6.171 0.021 1 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 7
_Distance_constraint_stats_list.Viol_count 19
_Distance_constraint_stats_list.Viol_total 285.244
_Distance_constraint_stats_list.Viol_max 1.659
_Distance_constraint_stats_list.Viol_rms 0.3183
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1019
_Distance_constraint_stats_list.Viol_average_violations_only 0.7506
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 64 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ASP 13.918 1.659 6 12 "[ **-*+** 1 * ** * *]"
1 79 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 HIS 0.344 0.176 12 0 "[ . 1 . 2]"
4 1 ZN 13.918 1.659 6 12 "[ **-*+** 1 * ** * *]"
5 1 ZN 0.344 0.176 12 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 64 HIS NE2 4 1 ZN ZN . . 2.800 2.138 2.027 2.239 . 0 0 "[ . 1 . 2]" 2
2 1 66 ASP OD1 4 1 ZN ZN . . 2.800 3.437 2.006 4.459 1.659 6 12 "[ **-*+** 1 * ** * *]" 2
3 1 79 HIS NE2 4 1 ZN ZN . . 2.800 2.136 2.069 2.180 . 0 0 "[ . 1 . 2]" 2
4 1 92 HIS ND1 4 1 ZN ZN . . 2.800 2.179 2.043 2.307 . 0 0 "[ . 1 . 2]" 2
5 1 114 HIS NE2 5 1 ZN ZN . . 2.800 2.179 2.030 2.433 . 0 0 "[ . 1 . 2]" 2
6 1 118 HIS NE2 5 1 ZN ZN . . 2.800 2.201 2.079 2.304 . 0 0 "[ . 1 . 2]" 2
7 1 124 HIS NE2 5 1 ZN ZN . . 2.800 2.357 2.039 2.976 0.176 12 0 "[ . 1 . 2]" 2
stop_
save_
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