NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
594313 |
2ms4   |
25104 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ms4
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 2061
_Distance_constraint_stats_list.Viol_count 924
_Distance_constraint_stats_list.Viol_total 1270.096
_Distance_constraint_stats_list.Viol_max 0.893
_Distance_constraint_stats_list.Viol_rms 0.0147
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0015
_Distance_constraint_stats_list.Viol_average_violations_only 0.0687
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 VAL 0.376 0.134 9 0 "[ . 1 . 2]"
1 3 ASN 0.856 0.155 4 0 "[ . 1 . 2]"
1 4 PRO 0.943 0.131 6 0 "[ . 1 . 2]"
1 5 THR 0.505 0.155 9 0 "[ . 1 . 2]"
1 6 VAL 2.042 0.246 11 0 "[ . 1 . 2]"
1 7 PHE 8.551 0.278 14 0 "[ . 1 . 2]"
1 8 PHE 5.517 0.189 3 0 "[ . 1 . 2]"
1 9 ASP 2.072 0.189 3 0 "[ . 1 . 2]"
1 10 ILE 2.467 0.272 4 0 "[ . 1 . 2]"
1 11 ALA 0.553 0.118 13 0 "[ . 1 . 2]"
1 12 VAL 0.461 0.112 1 0 "[ . 1 . 2]"
1 13 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 GLU 1.198 0.160 9 0 "[ . 1 . 2]"
1 16 PRO 1.198 0.160 9 0 "[ . 1 . 2]"
1 17 LEU 1.205 0.272 4 0 "[ . 1 . 2]"
1 18 GLY 0.053 0.045 3 0 "[ . 1 . 2]"
1 19 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 VAL 0.042 0.034 8 0 "[ . 1 . 2]"
1 21 SER 4.386 0.278 14 0 "[ . 1 . 2]"
1 22 PHE 0.149 0.094 14 0 "[ . 1 . 2]"
1 23 GLU 0.378 0.082 2 0 "[ . 1 . 2]"
1 24 LEU 0.625 0.094 3 0 "[ . 1 . 2]"
1 25 PHE 1.154 0.155 4 0 "[ . 1 . 2]"
1 26 ALA 0.489 0.134 9 0 "[ . 1 . 2]"
1 27 ASP 0.008 0.008 5 0 "[ . 1 . 2]"
1 28 LYS 0.078 0.044 5 0 "[ . 1 . 2]"
1 29 VAL 0.870 0.076 11 0 "[ . 1 . 2]"
1 30 PRO 0.019 0.019 17 0 "[ . 1 . 2]"
1 31 LYS 0.159 0.139 8 0 "[ . 1 . 2]"
1 32 THR 0.981 0.326 3 0 "[ . 1 . 2]"
1 33 ALA 0.315 0.131 6 0 "[ . 1 . 2]"
1 34 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ASN 0.052 0.052 5 0 "[ . 1 . 2]"
1 36 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ALA 0.495 0.081 8 0 "[ . 1 . 2]"
1 39 LEU 0.968 0.118 14 0 "[ . 1 . 2]"
1 40 SER 0.124 0.124 7 0 "[ . 1 . 2]"
1 41 THR 0.647 0.137 11 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LYS 0.670 0.128 4 0 "[ . 1 . 2]"
1 45 GLY 2.661 0.289 18 0 "[ . 1 . 2]"
1 46 PHE 4.047 0.289 18 0 "[ . 1 . 2]"
1 47 GLY 0.374 0.103 11 0 "[ . 1 . 2]"
1 48 TYR 0.667 0.118 14 0 "[ . 1 . 2]"
1 49 LYS 0.361 0.069 7 0 "[ . 1 . 2]"
1 50 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 SER 0.031 0.031 19 0 "[ . 1 . 2]"
1 52 CYS 0.011 0.011 18 0 "[ . 1 . 2]"
1 53 PHE 0.017 0.017 9 0 "[ . 1 . 2]"
1 54 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ARG 0.770 0.249 20 0 "[ . 1 . 2]"
1 56 ILE 0.939 0.105 1 0 "[ . 1 . 2]"
1 57 ILE 0.663 0.087 15 0 "[ . 1 . 2]"
1 58 PRO 0.621 0.066 9 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 PHE 0.911 0.183 15 0 "[ . 1 . 2]"
1 61 MET 1.133 0.226 11 0 "[ . 1 . 2]"
1 62 CYS 0.020 0.020 4 0 "[ . 1 . 2]"
1 63 GLN 0.675 0.249 20 0 "[ . 1 . 2]"
1 64 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 THR 0.694 0.286 17 0 "[ . 1 . 2]"
1 69 ARG 0.575 0.131 1 0 "[ . 1 . 2]"
1 71 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 THR 0.837 0.152 12 0 "[ . 1 . 2]"
1 74 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 GLY 0.620 0.286 17 0 "[ . 1 . 2]"
1 76 LYS 1.004 0.131 1 0 "[ . 1 . 2]"
1 77 SER 0.044 0.044 1 0 "[ . 1 . 2]"
1 78 ILE 1.424 0.128 4 0 "[ . 1 . 2]"
1 79 TYR 0.052 0.052 5 0 "[ . 1 . 2]"
1 80 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 GLU 0.171 0.100 20 0 "[ . 1 . 2]"
1 82 LYS 2.502 0.213 2 0 "[ . 1 . 2]"
1 83 PHE 2.790 0.893 3 1 "[ + . 1 . 2]"
1 84 GLU 1.369 0.187 20 0 "[ . 1 . 2]"
1 85 ASP 0.245 0.150 18 0 "[ . 1 . 2]"
1 86 GLU 0.243 0.139 8 0 "[ . 1 . 2]"
1 87 ASN 0.227 0.091 1 0 "[ . 1 . 2]"
1 88 PHE 0.376 0.103 8 0 "[ . 1 . 2]"
1 89 ILE 0.418 0.103 8 0 "[ . 1 . 2]"
1 90 LEU 0.266 0.096 19 0 "[ . 1 . 2]"
1 91 LYS 0.381 0.075 20 0 "[ . 1 . 2]"
1 92 HIS 0.953 0.135 4 0 "[ . 1 . 2]"
1 93 THR 1.418 0.140 4 0 "[ . 1 . 2]"
1 94 GLY 0.001 0.001 19 0 "[ . 1 . 2]"
1 95 PRO 1.225 0.143 2 0 "[ . 1 . 2]"
1 96 GLY 0.065 0.036 12 0 "[ . 1 . 2]"
1 97 ILE 0.794 0.115 6 0 "[ . 1 . 2]"
1 98 LEU 0.014 0.011 1 0 "[ . 1 . 2]"
1 99 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 MET 2.250 0.893 3 1 "[ + . 1 . 2]"
1 101 ALA 0.314 0.139 11 0 "[ . 1 . 2]"
1 102 ASN 1.624 0.180 6 0 "[ . 1 . 2]"
1 103 ALA 1.300 0.180 6 0 "[ . 1 . 2]"
1 104 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 PRO 1.340 0.187 20 0 "[ . 1 . 2]"
1 106 ASN 0.958 0.143 5 0 "[ . 1 . 2]"
1 107 THR 1.764 0.213 2 0 "[ . 1 . 2]"
1 108 ASN 0.324 0.148 11 0 "[ . 1 . 2]"
1 109 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 SER 1.336 0.220 13 0 "[ . 1 . 2]"
1 111 GLN 0.707 0.220 13 0 "[ . 1 . 2]"
1 112 PHE 2.441 0.731 15 3 "[ - .* 1 + 2]"
1 113 PHE 2.463 0.731 15 3 "[ - .* 1 + 2]"
1 114 ILE 0.029 0.015 20 0 "[ . 1 . 2]"
1 115 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 THR 1.002 0.121 7 0 "[ . 1 . 2]"
1 117 ALA 1.192 0.143 2 0 "[ . 1 . 2]"
1 118 LYS 0.985 0.140 4 0 "[ . 1 . 2]"
1 119 THR 0.787 0.113 12 0 "[ . 1 . 2]"
1 120 GLU 0.273 0.115 5 0 "[ . 1 . 2]"
1 121 TRP 1.510 0.178 6 0 "[ . 1 . 2]"
1 122 LEU 4.507 0.226 11 0 "[ . 1 . 2]"
1 123 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 LYS 0.772 0.138 17 0 "[ . 1 . 2]"
1 126 HIS 0.426 0.056 3 0 "[ . 1 . 2]"
1 127 VAL 0.904 0.235 6 0 "[ . 1 . 2]"
1 128 VAL 0.376 0.299 8 0 "[ . 1 . 2]"
1 129 PHE 1.246 0.076 8 0 "[ . 1 . 2]"
1 130 GLY 0.603 0.079 19 0 "[ . 1 . 2]"
1 131 LYS 0.629 0.115 6 0 "[ . 1 . 2]"
1 132 VAL 0.439 0.094 14 0 "[ . 1 . 2]"
1 133 LYS 0.737 0.260 12 0 "[ . 1 . 2]"
1 134 GLU 0.488 0.260 12 0 "[ . 1 . 2]"
1 135 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 MET 1.086 0.136 3 0 "[ . 1 . 2]"
1 137 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 138 ILE 0.124 0.046 4 0 "[ . 1 . 2]"
1 139 VAL 0.686 0.092 19 0 "[ . 1 . 2]"
1 140 GLU 0.679 0.121 7 0 "[ . 1 . 2]"
1 141 ALA 0.653 0.136 3 0 "[ . 1 . 2]"
1 142 MET 0.567 0.103 13 0 "[ . 1 . 2]"
1 143 GLU 0.511 0.052 12 0 "[ . 1 . 2]"
1 144 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 145 PHE 0.231 0.057 8 0 "[ . 1 . 2]"
1 146 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 SER 0.194 0.066 9 0 "[ . 1 . 2]"
1 148 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 149 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 150 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 LYS 0.903 0.269 14 0 "[ . 1 . 2]"
1 152 THR 0.981 0.269 14 0 "[ . 1 . 2]"
1 153 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 154 LYS 0.178 0.046 8 0 "[ . 1 . 2]"
1 155 LYS 0.149 0.071 9 0 "[ . 1 . 2]"
1 156 ILE 1.872 0.112 1 0 "[ . 1 . 2]"
1 157 THR 0.178 0.071 9 0 "[ . 1 . 2]"
1 158 ILE 1.947 0.138 12 0 "[ . 1 . 2]"
1 159 ALA 0.963 0.150 13 0 "[ . 1 . 2]"
1 160 ASP 0.324 0.069 7 0 "[ . 1 . 2]"
1 161 CYS 2.893 0.220 3 0 "[ . 1 . 2]"
1 162 GLY 0.530 0.137 11 0 "[ . 1 . 2]"
1 163 GLN 0.323 0.098 19 0 "[ . 1 . 2]"
1 164 LEU 3.034 0.155 9 0 "[ . 1 . 2]"
1 165 GLU 0.061 0.061 15 0 "[ . 1 . 2]"
2 5 PRO 0.192 0.112 19 0 "[ . 1 . 2]"
2 7 ALA 0.134 0.113 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 2 VAL HA 1 3 ASN H 3.510 . 4.040 3.055 2.141 3.475 . 0 0 "[ . 1 . 2]" 1
2 1 5 THR HA 1 23 GLU HA 4.030 . 4.630 2.494 2.203 2.809 . 0 0 "[ . 1 . 2]" 1
3 1 7 PHE HA 1 21 SER HA 3.930 . 4.520 2.317 2.074 2.644 . 0 0 "[ . 1 . 2]" 1
4 1 52 CYS HA 1 157 THR HA 3.780 . 4.350 2.101 1.789 2.446 0.011 18 0 "[ . 1 . 2]" 1
5 1 3 ASN HA 1 4 PRO HD2 3.460 . 3.980 2.098 1.920 2.589 . 0 0 "[ . 1 . 2]" 1
6 1 11 ALA HA 1 17 LEU HB2 4.380 . 5.040 3.545 2.897 3.830 . 0 0 "[ . 1 . 2]" 1
7 1 3 ASN HA 1 26 ALA MB 4.060 . 4.670 3.601 2.936 4.009 . 0 0 "[ . 1 . 2]" 1
8 1 11 ALA HA 1 17 LEU HB3 4.290 . 4.930 3.656 2.940 4.151 . 0 0 "[ . 1 . 2]" 1
9 1 10 ILE MG 1 11 ALA HA 4.290 . 4.930 3.869 3.725 4.016 . 0 0 "[ . 1 . 2]" 1
10 1 11 ALA HA 1 12 VAL HA 4.540 . 5.220 4.471 4.421 4.510 . 0 0 "[ . 1 . 2]" 1
11 1 12 VAL HA 1 13 ASP HA 4.530 . 5.210 4.367 4.310 4.431 . 0 0 "[ . 1 . 2]" 1
12 1 13 ASP HA 1 15 GLU H 4.650 . 5.350 4.359 4.183 4.587 . 0 0 "[ . 1 . 2]" 1
13 1 13 ASP HA 1 14 GLY HA3 4.640 . 5.340 4.491 4.390 4.596 . 0 0 "[ . 1 . 2]" 1
14 1 13 ASP HA 1 14 GLY HA2 4.920 . 5.660 4.800 4.648 5.012 . 0 0 "[ . 1 . 2]" 1
15 1 12 VAL H 1 16 PRO HA 4.470 . 5.140 3.925 3.615 4.401 . 0 0 "[ . 1 . 2]" 1
16 1 11 ALA HA 1 16 PRO HA 3.800 . 4.370 2.259 1.855 3.013 . 0 0 "[ . 1 . 2]" 1
17 1 16 PRO HA 1 17 LEU HA 4.630 . 5.320 4.503 4.479 4.527 . 0 0 "[ . 1 . 2]" 1
18 1 9 ASP HA 1 19 ARG HA 3.970 . 4.570 2.309 1.958 2.536 . 0 0 "[ . 1 . 2]" 1
19 1 24 LEU HA 1 129 PHE HA 4.850 . 5.580 4.924 4.661 5.355 . 0 0 "[ . 1 . 2]" 1
20 1 22 PHE HA 1 132 VAL HA 3.910 . 4.500 2.222 1.792 2.668 0.008 16 0 "[ . 1 . 2]" 1
21 1 3 ASN HD22 1 25 PHE HA 4.360 . 5.010 2.483 2.048 3.385 . 0 0 "[ . 1 . 2]" 1
22 1 3 ASN HD21 1 25 PHE HA 4.360 . 5.260 1.887 1.645 2.894 0.155 4 0 "[ . 1 . 2]" 1
23 1 25 PHE HA 1 25 PHE QD 4.000 . 4.600 2.968 2.614 3.241 . 0 0 "[ . 1 . 2]" 1
24 1 163 GLN HA 1 164 LEU HA 4.560 . 5.240 4.412 4.268 4.501 . 0 0 "[ . 1 . 2]" 1
25 1 25 PHE HA 1 26 ALA MB 4.220 . 4.850 4.257 4.193 4.334 . 0 0 "[ . 1 . 2]" 1
26 1 41 THR MG 1 163 GLN HA 4.930 . 5.670 5.193 4.565 5.645 . 0 0 "[ . 1 . 2]" 1
27 1 26 ALA HA 1 30 PRO HA 3.680 . 4.230 2.673 2.046 3.757 . 0 0 "[ . 1 . 2]" 1
28 1 76 LYS HA 1 110 SER HB3 3.730 . 4.290 4.096 3.592 4.405 0.115 8 0 "[ . 1 . 2]" 1
29 1 28 LYS HA 1 89 ILE MG 4.000 . 4.600 4.017 3.565 4.494 . 0 0 "[ . 1 . 2]" 1
30 1 100 MET ME 1 110 SER HB3 4.960 . 5.700 5.400 4.958 5.889 0.189 12 0 "[ . 1 . 2]" 1
31 1 31 LYS HA 1 32 THR HA 4.940 . 5.680 4.763 4.713 4.831 . 0 0 "[ . 1 . 2]" 1
32 1 33 ALA HA 1 34 GLU HA 5.210 . 5.990 4.907 4.842 4.972 . 0 0 "[ . 1 . 2]" 1
33 1 34 GLU HA 1 35 ASN HA 5.620 . 6.460 4.954 4.896 5.006 . 0 0 "[ . 1 . 2]" 1
34 1 34 GLU HA 1 37 ARG HB2 4.810 . 5.530 3.367 2.817 4.024 . 0 0 "[ . 1 . 2]" 1
35 1 34 GLU HA 1 37 ARG HB3 4.810 . 5.530 2.484 2.163 2.841 . 0 0 "[ . 1 . 2]" 1
36 1 6 VAL QG 1 37 ARG HA . . 4.030 2.799 1.945 3.903 . 0 0 "[ . 1 . 2]" 1
37 1 38 ALA HA 1 43 GLU H 4.900 . 5.640 3.120 2.318 4.130 . 0 0 "[ . 1 . 2]" 1
38 1 58 PRO HA 1 143 GLU HG2 4.380 . 5.040 1.934 1.754 2.302 0.046 12 0 "[ . 1 . 2]" 1
39 1 122 LEU HA 1 125 LYS QE 4.370 . 5.030 2.841 1.774 4.889 0.026 13 0 "[ . 1 . 2]" 1
40 1 58 PRO HA 1 143 GLU HG3 4.380 . 5.040 2.900 1.851 3.710 . 0 0 "[ . 1 . 2]" 1
41 1 60 PHE HA 1 60 PHE HD1 4.430 . 5.090 2.418 2.304 2.500 . 0 0 "[ . 1 . 2]" 1
42 1 60 PHE HA 1 60 PHE HD2 4.710 . 5.420 4.671 4.553 4.762 . 0 0 "[ . 1 . 2]" 1
43 1 60 PHE HA 1 61 MET HA 4.820 . 5.540 4.801 4.719 4.870 . 0 0 "[ . 1 . 2]" 1
44 1 97 ILE MG 1 99 SER HA 4.970 . 5.720 4.613 4.094 5.020 . 0 0 "[ . 1 . 2]" 1
45 1 61 MET HA 1 119 THR MG 5.400 . 6.210 4.658 4.386 4.994 . 0 0 "[ . 1 . 2]" 1
46 1 61 MET HA 1 116 THR MG 4.030 . 4.630 3.005 2.388 4.115 . 0 0 "[ . 1 . 2]" 1
47 1 69 ARG HA 1 73 THR HB 4.940 . 5.680 4.773 4.134 5.739 0.059 18 0 "[ . 1 . 2]" 1
48 1 69 ARG HA 1 69 ARG HD2 4.660 . 5.360 4.713 4.350 4.904 . 0 0 "[ . 1 . 2]" 1
49 1 69 ARG HA 1 69 ARG HG2 4.200 . 4.830 2.755 2.410 3.274 . 0 0 "[ . 1 . 2]" 1
50 1 69 ARG HA 1 69 ARG HG3 4.200 . 4.830 2.962 2.600 3.348 . 0 0 "[ . 1 . 2]" 1
51 1 56 ILE H 1 151 LYS HA 5.230 . 6.010 4.472 3.980 4.885 . 0 0 "[ . 1 . 2]" 1
52 1 46 PHE HZ 1 78 ILE HA 3.850 . 4.430 3.502 2.593 4.067 . 0 0 "[ . 1 . 2]" 1
53 1 46 PHE HE2 1 78 ILE HA 4.010 . 4.910 1.792 1.692 2.210 0.108 2 0 "[ . 1 . 2]" 1
54 1 78 ILE HA 1 79 TYR HA 4.810 . 5.530 4.737 4.675 4.806 . 0 0 "[ . 1 . 2]" 1
55 1 78 ILE HA 1 78 ILE MD 4.220 . 4.850 4.253 4.238 4.269 . 0 0 "[ . 1 . 2]" 1
56 1 76 LYS HA 1 81 GLU HA 3.900 . 4.490 3.732 2.846 4.527 0.037 4 0 "[ . 1 . 2]" 1
57 1 81 GLU HA 1 81 GLU HG2 4.170 . 4.800 3.182 2.944 3.265 . 0 0 "[ . 1 . 2]" 1
58 1 76 LYS HB2 1 81 GLU HA 4.330 . 4.980 2.418 1.811 2.912 . 0 0 "[ . 1 . 2]" 1
59 1 82 LYS HA 1 82 LYS HG3 4.240 . 4.880 3.862 3.795 3.917 . 0 0 "[ . 1 . 2]" 1
60 1 83 PHE HA 1 106 ASN H 5.420 . 6.230 6.225 5.738 6.373 0.143 5 0 "[ . 1 . 2]" 1
61 1 82 LYS HA 1 83 PHE HA 4.610 . 5.300 4.610 4.526 4.661 . 0 0 "[ . 1 . 2]" 1
62 1 82 LYS HB2 1 83 PHE HA 4.620 . 5.310 4.420 4.161 4.589 . 0 0 "[ . 1 . 2]" 1
63 1 84 GLU HA 1 106 ASN HA 4.000 . 4.600 2.026 1.768 3.273 0.032 5 0 "[ . 1 . 2]" 1
64 1 84 GLU HA 1 106 ASN HB2 5.180 . 5.960 3.928 3.044 4.647 . 0 0 "[ . 1 . 2]" 1
65 1 84 GLU HA 1 108 ASN QB 5.770 . 6.640 3.465 2.766 3.927 . 0 0 "[ . 1 . 2]" 1
66 1 84 GLU HA 1 84 GLU HG3 3.830 . 4.400 3.837 3.733 4.302 . 0 0 "[ . 1 . 2]" 1
67 1 84 GLU HA 1 105 PRO HB3 5.130 . 5.900 5.365 4.796 5.744 . 0 0 "[ . 1 . 2]" 1
68 1 89 ILE HA 1 89 ILE HG12 3.550 . 4.080 2.551 2.486 2.611 . 0 0 "[ . 1 . 2]" 1
69 1 89 ILE HA 1 90 LEU HA 4.670 . 5.370 4.707 4.675 4.732 . 0 0 "[ . 1 . 2]" 1
70 1 92 HIS HA 1 93 THR MG 4.320 . 4.970 4.330 4.026 4.722 . 0 0 "[ . 1 . 2]" 1
71 1 93 THR HA 1 118 LYS QE 4.160 . 4.780 3.117 2.175 4.176 . 0 0 "[ . 1 . 2]" 1
72 1 93 THR HA 1 93 THR MG 3.320 . 3.820 2.989 2.296 3.272 . 0 0 "[ . 1 . 2]" 1
73 1 95 PRO HA 1 117 ALA HA 4.710 . 5.420 3.381 2.884 4.195 . 0 0 "[ . 1 . 2]" 1
74 1 97 ILE HA 1 131 LYS HA 4.240 . 4.880 2.951 2.592 3.108 . 0 0 "[ . 1 . 2]" 1
75 1 97 ILE HA 1 131 LYS QB 4.280 . 4.920 3.683 3.024 4.117 . 0 0 "[ . 1 . 2]" 1
76 1 98 LEU HA 1 115 CYS H 4.180 . 4.810 3.801 3.416 4.151 . 0 0 "[ . 1 . 2]" 1
77 1 98 LEU HA 1 98 LEU HG 4.240 . 4.880 3.108 2.476 3.268 . 0 0 "[ . 1 . 2]" 1
78 1 102 ASN HD21 1 103 ALA HA 5.020 . 5.770 5.550 4.925 5.724 . 0 0 "[ . 1 . 2]" 1
79 1 85 ASP H 1 106 ASN HA 4.730 . 5.440 4.159 3.694 5.449 0.009 8 0 "[ . 1 . 2]" 1
80 1 82 LYS HB3 1 107 THR HA 3.940 . 4.530 3.805 2.939 4.349 . 0 0 "[ . 1 . 2]" 1
81 1 82 LYS HB2 1 107 THR HA 3.940 . 4.530 2.883 1.924 3.487 . 0 0 "[ . 1 . 2]" 1
82 1 111 GLN HA 1 112 PHE H 3.420 . 3.930 2.545 2.358 2.676 . 0 0 "[ . 1 . 2]" 1
83 1 75 GLY HA2 1 111 GLN HA 5.390 . 6.200 4.663 3.803 5.697 . 0 0 "[ . 1 . 2]" 1
84 1 110 SER HB2 1 111 GLN HA 5.720 . 6.580 5.335 5.077 5.942 . 0 0 "[ . 1 . 2]" 1
85 1 101 ALA MB 1 112 PHE HA 4.380 . 5.040 3.503 2.958 3.886 . 0 0 "[ . 1 . 2]" 1
86 1 63 GLN HA 1 113 PHE HA 4.160 . 4.780 1.957 1.778 2.186 0.022 18 0 "[ . 1 . 2]" 1
87 1 95 PRO HA 1 116 THR HA 4.160 . 4.780 4.011 3.056 4.594 . 0 0 "[ . 1 . 2]" 1
88 1 95 PRO HB3 1 117 ALA HA 3.800 . 4.370 2.914 2.177 3.446 . 0 0 "[ . 1 . 2]" 1
89 1 118 LYS HA 1 118 LYS HG3 4.090 . 4.700 3.772 3.702 3.831 . 0 0 "[ . 1 . 2]" 1
90 1 123 ASP HA 1 125 LYS H 4.240 . 4.880 3.218 2.981 3.517 . 0 0 "[ . 1 . 2]" 1
91 1 125 LYS HA 1 125 LYS QG 3.700 . 4.260 2.570 2.279 3.082 . 0 0 "[ . 1 . 2]" 1
92 1 99 SER HA 1 128 VAL HA 4.140 . 4.760 2.956 1.852 3.603 . 0 0 "[ . 1 . 2]" 1
93 1 131 LYS HA 1 131 LYS HG3 4.060 . 4.670 2.816 2.729 2.916 . 0 0 "[ . 1 . 2]" 1
94 1 97 ILE MG 1 131 LYS HA 4.840 . 5.570 4.876 4.629 5.094 . 0 0 "[ . 1 . 2]" 1
95 1 22 PHE QD 1 132 VAL HA 4.270 . 4.910 2.743 2.038 3.334 . 0 0 "[ . 1 . 2]" 1
96 1 132 VAL HA 1 133 LYS HA 4.630 . 5.320 4.480 4.453 4.508 . 0 0 "[ . 1 . 2]" 1
97 1 136 MET HA 1 139 VAL HB 4.700 . 5.400 2.764 2.378 3.151 . 0 0 "[ . 1 . 2]" 1
98 1 136 MET HA 1 140 GLU QB 5.000 . 5.750 5.618 5.466 5.747 . 0 0 "[ . 1 . 2]" 1
99 1 132 VAL QG 1 136 MET HA . . 3.700 2.025 1.793 2.375 0.007 10 0 "[ . 1 . 2]" 1
100 1 137 ASN HA 1 140 GLU H 4.050 . 4.660 3.533 3.197 3.931 . 0 0 "[ . 1 . 2]" 1
101 1 136 MET HG3 1 137 ASN HA 4.260 . 4.900 3.926 3.440 4.399 . 0 0 "[ . 1 . 2]" 1
102 1 137 ASN HA 1 140 GLU HG3 4.330 . 4.980 3.733 3.179 4.569 . 0 0 "[ . 1 . 2]" 1
103 1 137 ASN HA 1 140 GLU QB 4.090 . 4.700 2.754 2.308 3.310 . 0 0 "[ . 1 . 2]" 1
104 1 136 MET QB 1 137 ASN HA 4.690 . 5.390 4.306 4.139 4.433 . 0 0 "[ . 1 . 2]" 1
105 1 136 MET ME 1 137 ASN HA 5.220 . 6.000 4.969 4.035 5.562 . 0 0 "[ . 1 . 2]" 1
106 1 140 GLU HA 1 143 GLU HB2 4.450 . 5.120 3.028 2.444 3.578 . 0 0 "[ . 1 . 2]" 1
107 1 136 MET ME 1 140 GLU HA 4.050 . 4.660 4.378 4.097 4.667 0.007 16 0 "[ . 1 . 2]" 1
108 1 140 GLU HA 1 143 GLU HB3 4.450 . 5.120 2.788 2.432 3.297 . 0 0 "[ . 1 . 2]" 1
109 1 56 ILE MD 1 143 GLU HA 4.310 . 4.960 3.096 2.525 3.641 . 0 0 "[ . 1 . 2]" 1
110 1 148 ARG HA 1 148 ARG HG2 4.230 . 4.860 2.999 2.737 3.244 . 0 0 "[ . 1 . 2]" 1
111 1 154 LYS HA 1 154 LYS HG3 4.000 . 4.600 3.808 3.736 3.871 . 0 0 "[ . 1 . 2]" 1
112 1 155 LYS HA 1 156 ILE HA 4.650 . 5.350 4.489 4.456 4.522 . 0 0 "[ . 1 . 2]" 1
113 1 155 LYS HA 1 155 LYS QE 4.270 . 4.910 3.375 2.439 4.763 . 0 0 "[ . 1 . 2]" 1
114 1 152 THR MG 1 155 LYS HA 4.520 . 5.200 4.562 3.940 5.120 . 0 0 "[ . 1 . 2]" 1
115 1 12 VAL HA 1 156 ILE HA 4.370 . 5.030 2.490 1.932 2.825 . 0 0 "[ . 1 . 2]" 1
116 1 10 ILE MG 1 156 ILE HA 4.750 . 5.460 4.454 4.190 4.695 . 0 0 "[ . 1 . 2]" 1
117 1 156 ILE HA 1 157 THR MG 4.990 . 5.740 3.827 3.204 4.082 . 0 0 "[ . 1 . 2]" 1
118 1 52 CYS HB2 1 157 THR HA 5.040 . 5.800 4.142 3.318 4.860 . 0 0 "[ . 1 . 2]" 1
119 1 52 CYS HB3 1 157 THR HA 5.040 . 5.800 4.113 2.952 5.463 . 0 0 "[ . 1 . 2]" 1
120 1 10 ILE HA 1 158 ILE HA 4.150 . 4.770 2.967 2.403 3.250 . 0 0 "[ . 1 . 2]" 1
121 1 158 ILE HA 1 159 ALA MB 4.100 . 4.720 4.039 3.995 4.110 . 0 0 "[ . 1 . 2]" 1
122 1 159 ALA HA 1 160 ASP HA 4.730 . 5.440 4.671 4.628 4.735 . 0 0 "[ . 1 . 2]" 1
123 1 11 ALA MB 1 159 ALA HA 4.350 . 5.000 3.344 3.048 3.645 . 0 0 "[ . 1 . 2]" 1
124 1 8 PHE HA 1 161 CYS HA 4.250 . 4.890 2.308 1.931 2.573 . 0 0 "[ . 1 . 2]" 1
125 1 142 MET HB3 1 142 MET ME 4.360 . 5.010 3.304 2.133 4.051 . 0 0 "[ . 1 . 2]" 1
126 1 5 THR HB 1 164 LEU QB 4.150 . 4.770 2.863 1.953 3.888 . 0 0 "[ . 1 . 2]" 1
127 1 6 VAL HB 1 7 PHE H 4.350 . 5.000 3.431 2.676 4.204 . 0 0 "[ . 1 . 2]" 1
128 1 116 THR MG 1 143 GLU HG3 4.670 . 5.370 3.473 2.587 4.307 . 0 0 "[ . 1 . 2]" 1
129 1 11 ALA MB 1 159 ALA H 4.070 . 4.680 2.869 2.695 3.177 . 0 0 "[ . 1 . 2]" 1
130 1 11 ALA MB 1 14 GLY H 3.670 . 4.220 2.984 2.589 3.478 . 0 0 "[ . 1 . 2]" 1
131 1 11 ALA MB 1 15 GLU HA 4.380 . 5.040 3.741 3.382 4.087 . 0 0 "[ . 1 . 2]" 1
132 1 11 ALA MB 1 12 VAL HA 4.290 . 4.930 4.272 4.031 4.389 . 0 0 "[ . 1 . 2]" 1
133 1 11 ALA MB 1 16 PRO HA 3.450 . 3.970 2.536 2.371 2.727 . 0 0 "[ . 1 . 2]" 1
134 1 11 ALA MB 1 16 PRO HD2 5.480 . 6.300 4.443 4.171 4.682 . 0 0 "[ . 1 . 2]" 1
135 1 11 ALA MB 1 14 GLY HA2 3.740 . 4.300 2.665 2.303 2.878 . 0 0 "[ . 1 . 2]" 1
136 1 132 VAL QG 1 136 MET ME . . 4.490 3.233 2.286 3.920 . 0 0 "[ . 1 . 2]" 1
137 1 11 ALA MB 1 17 LEU HB2 4.430 . 5.090 4.975 4.450 5.208 0.118 13 0 "[ . 1 . 2]" 1
138 1 11 ALA MB 1 17 LEU HB3 4.840 . 5.570 5.076 4.442 5.501 . 0 0 "[ . 1 . 2]" 1
139 1 10 ILE MG 1 11 ALA MB 4.320 . 4.970 4.224 3.982 4.439 . 0 0 "[ . 1 . 2]" 1
140 1 11 ALA MB 1 12 VAL MG1 4.970 . 5.720 5.312 4.596 5.537 . 0 0 "[ . 1 . 2]" 1
141 1 105 PRO HB3 1 106 ASN H 4.270 . 4.910 3.360 3.145 3.543 . 0 0 "[ . 1 . 2]" 1
142 1 13 ASP HA 1 155 LYS QB 3.850 . 4.430 2.569 1.848 3.358 . 0 0 "[ . 1 . 2]" 1
143 1 23 GLU HB2 1 133 LYS HG3 4.950 . 5.690 4.422 4.223 5.483 . 0 0 "[ . 1 . 2]" 1
144 1 155 LYS QB 1 157 THR MG 5.030 . 5.780 3.684 2.881 4.138 . 0 0 "[ . 1 . 2]" 1
145 1 26 ALA MB 1 30 PRO HA 3.770 . 4.340 2.932 2.515 3.626 . 0 0 "[ . 1 . 2]" 1
146 1 4 PRO HD3 1 26 ALA MB 3.450 . 3.970 2.737 2.182 3.159 . 0 0 "[ . 1 . 2]" 1
147 1 4 PRO HB3 1 26 ALA MB 4.260 . 4.900 4.534 4.264 5.007 0.107 2 0 "[ . 1 . 2]" 1
148 1 4 PRO HG2 1 26 ALA MB 3.710 . 4.270 3.080 2.587 3.923 . 0 0 "[ . 1 . 2]" 1
149 1 4 PRO HG3 1 26 ALA MB 3.690 . 4.240 2.721 2.363 3.350 . 0 0 "[ . 1 . 2]" 1
150 1 26 ALA MB 1 33 ALA MB 3.010 . 3.460 2.466 2.182 2.754 . 0 0 "[ . 1 . 2]" 1
151 1 2 VAL MG1 1 26 ALA MB 4.810 . 5.530 4.527 2.852 5.587 0.057 6 0 "[ . 1 . 2]" 1
152 1 28 LYS HB3 1 89 ILE HB 4.180 . 4.810 3.071 2.571 3.448 . 0 0 "[ . 1 . 2]" 1
153 1 28 LYS HB3 1 89 ILE HG13 4.310 . 4.960 4.548 4.041 5.004 0.044 5 0 "[ . 1 . 2]" 1
154 1 28 LYS HB2 1 90 LEU HG 4.730 . 5.440 3.511 3.262 3.956 . 0 0 "[ . 1 . 2]" 1
155 1 28 LYS HB2 1 90 LEU MD1 5.240 . 6.030 2.809 2.256 3.435 . 0 0 "[ . 1 . 2]" 1
156 1 30 PRO HA 1 33 ALA MB 3.670 . 4.220 3.161 2.646 3.839 . 0 0 "[ . 1 . 2]" 1
157 1 26 ALA HA 1 33 ALA MB 3.310 . 3.810 2.259 1.982 2.575 . 0 0 "[ . 1 . 2]" 1
158 1 24 LEU HB2 1 33 ALA MB 4.010 . 4.610 3.059 2.722 3.319 . 0 0 "[ . 1 . 2]" 1
159 1 4 PRO HB2 1 33 ALA MB 5.110 . 5.880 5.525 4.936 6.011 0.131 6 0 "[ . 1 . 2]" 1
160 1 24 LEU HB3 1 33 ALA MB 4.010 . 4.610 1.916 1.793 2.110 0.007 8 0 "[ . 1 . 2]" 1
161 1 38 ALA MB 1 43 GLU H 5.590 . 6.430 3.643 3.049 4.714 . 0 0 "[ . 1 . 2]" 1
162 1 36 PHE HA 1 38 ALA MB 5.120 . 5.890 5.230 5.022 5.520 . 0 0 "[ . 1 . 2]" 1
163 1 38 ALA MB 1 78 ILE HA 5.690 . 6.540 4.972 4.719 5.456 . 0 0 "[ . 1 . 2]" 1
164 1 38 ALA MB 1 78 ILE HB 4.340 . 4.990 3.781 3.582 4.313 . 0 0 "[ . 1 . 2]" 1
165 1 38 ALA MB 1 39 LEU HG 4.460 . 5.130 3.806 3.509 4.225 . 0 0 "[ . 1 . 2]" 1
166 1 38 ALA MB 1 78 ILE MG 3.100 . 3.570 1.892 1.739 2.490 0.061 8 0 "[ . 1 . 2]" 1
167 1 38 ALA MB 1 78 ILE MD 3.260 . 3.750 2.742 2.042 3.466 . 0 0 "[ . 1 . 2]" 1
168 1 68 THR HB 1 75 GLY H 4.800 . 5.520 4.071 2.457 5.366 . 0 0 "[ . 1 . 2]" 1
169 1 101 ALA H 1 101 ALA MB 3.380 . 3.890 2.284 2.253 2.324 . 0 0 "[ . 1 . 2]" 1
170 1 101 ALA MB 1 102 ASN H 3.740 . 4.300 2.432 1.992 2.823 . 0 0 "[ . 1 . 2]" 1
171 1 101 ALA MB 1 113 PHE QD 3.760 . 4.320 2.128 1.876 2.387 . 0 0 "[ . 1 . 2]" 1
172 1 100 MET HA 1 101 ALA MB 4.270 . 4.910 3.981 3.869 4.081 . 0 0 "[ . 1 . 2]" 1
173 1 11 ALA H 1 159 ALA MB 3.680 . 4.230 3.807 3.096 4.146 . 0 0 "[ . 1 . 2]" 1
174 1 103 ALA H 1 103 ALA MB 3.290 . 3.780 2.368 2.282 2.495 . 0 0 "[ . 1 . 2]" 1
175 1 102 ASN HA 1 108 ASN QB 4.620 . 5.310 5.112 4.642 5.458 0.148 11 0 "[ . 1 . 2]" 1
176 1 60 PHE HA 1 117 ALA MB 4.050 . 4.660 3.060 2.285 3.771 . 0 0 "[ . 1 . 2]" 1
177 1 95 PRO HA 1 117 ALA MB 4.790 . 5.510 4.650 4.266 5.045 . 0 0 "[ . 1 . 2]" 1
178 1 117 ALA MB 1 118 LYS HA 5.130 . 5.900 4.330 4.279 4.379 . 0 0 "[ . 1 . 2]" 1
179 1 117 ALA MB 1 118 LYS HB3 4.620 . 5.310 4.916 4.731 5.216 . 0 0 "[ . 1 . 2]" 1
180 1 95 PRO HB3 1 117 ALA MB 4.100 . 4.720 4.468 3.870 4.863 0.143 2 0 "[ . 1 . 2]" 1
181 1 117 ALA MB 1 119 THR MG 3.290 . 3.780 2.900 2.436 3.417 . 0 0 "[ . 1 . 2]" 1
182 1 116 THR MG 1 117 ALA MB 4.880 . 5.610 4.979 4.812 5.184 . 0 0 "[ . 1 . 2]" 1
183 1 131 LYS QB 1 132 VAL H 4.020 . 4.620 3.756 3.565 3.915 . 0 0 "[ . 1 . 2]" 1
184 1 116 THR HB 1 140 GLU QB 4.260 . 4.900 4.484 3.912 5.007 0.107 17 0 "[ . 1 . 2]" 1
185 1 15 GLU HB3 1 16 PRO HD3 3.880 . 4.860 4.457 4.026 4.778 . 0 0 "[ . 1 . 2]" 1
186 1 15 GLU HB3 1 16 PRO HD2 4.230 . 5.160 3.299 2.867 3.544 . 0 0 "[ . 1 . 2]" 1
187 1 136 MET HG3 1 140 GLU QB 3.890 . 4.470 4.463 4.328 4.588 0.118 15 0 "[ . 1 . 2]" 1
188 1 141 ALA MB 1 142 MET HA 4.330 . 4.980 3.914 3.814 4.056 . 0 0 "[ . 1 . 2]" 1
189 1 138 ILE HA 1 141 ALA MB 3.290 . 3.780 2.361 2.154 2.738 . 0 0 "[ . 1 . 2]" 1
190 1 17 LEU QD 1 141 ALA MB . . 3.460 2.270 1.907 3.097 . 0 0 "[ . 1 . 2]" 1
191 1 151 LYS QB 1 152 THR MG 5.180 . 5.960 5.265 4.944 6.049 0.089 17 0 "[ . 1 . 2]" 1
192 1 18 GLY H 1 159 ALA MB 5.000 . 5.910 5.547 5.241 5.955 0.045 3 0 "[ . 1 . 2]" 1
193 1 9 ASP HB2 1 159 ALA MB 4.000 . 4.600 2.234 1.794 2.747 0.006 9 0 "[ . 1 . 2]" 1
194 1 10 ILE MG 1 17 LEU HB2 4.350 . 5.000 3.979 3.499 4.914 . 0 0 "[ . 1 . 2]" 1
195 1 17 LEU HB2 1 138 ILE MG 5.020 . 5.770 4.341 4.118 4.627 . 0 0 "[ . 1 . 2]" 1
196 1 8 PHE H 1 21 SER HB2 5.250 . 6.040 5.510 3.592 6.097 0.057 9 0 "[ . 1 . 2]" 1
197 1 31 LYS HB3 1 32 THR HA 4.470 . 5.140 4.263 4.072 4.478 . 0 0 "[ . 1 . 2]" 1
198 1 24 LEU MD1 1 36 PHE HB2 6.140 . 7.060 4.417 3.743 5.483 . 0 0 "[ . 1 . 2]" 1
199 1 118 LYS QE 1 120 GLU HB3 4.260 . 4.900 2.975 1.858 4.326 . 0 0 "[ . 1 . 2]" 1
200 1 84 GLU HB2 1 105 PRO HB3 4.470 . 5.140 5.023 3.636 5.327 0.187 20 0 "[ . 1 . 2]" 1
201 1 118 LYS HB2 1 120 GLU HB3 4.630 . 5.320 4.147 3.714 4.640 . 0 0 "[ . 1 . 2]" 1
202 1 111 GLN HB2 1 112 PHE H 5.010 . 5.760 3.398 3.032 3.990 . 0 0 "[ . 1 . 2]" 1
203 1 95 PRO HB2 1 116 THR HA 4.510 . 5.190 4.220 3.563 5.223 0.033 9 0 "[ . 1 . 2]" 1
204 1 95 PRO HB2 1 117 ALA HA 5.130 . 5.900 4.282 3.554 5.149 . 0 0 "[ . 1 . 2]" 1
205 1 133 LYS HB2 1 134 GLU H 4.440 . 5.110 3.899 3.634 4.187 . 0 0 "[ . 1 . 2]" 1
206 1 142 MET HB2 1 142 MET ME 4.360 . 5.010 2.971 1.979 4.079 . 0 0 "[ . 1 . 2]" 1
207 1 144 ARG H 1 144 ARG HB2 3.950 . 4.540 2.511 2.409 2.670 . 0 0 "[ . 1 . 2]" 1
208 1 12 VAL MG2 1 154 LYS HB2 4.990 . 5.740 4.063 3.554 4.680 . 0 0 "[ . 1 . 2]" 1
209 1 55 ARG HB2 1 55 ARG HD2 4.090 . 4.700 2.579 2.492 2.678 . 0 0 "[ . 1 . 2]" 1
210 1 55 ARG HB3 1 55 ARG HD2 4.170 . 4.800 2.981 2.800 3.164 . 0 0 "[ . 1 . 2]" 1
211 1 17 LEU HB3 1 138 ILE MG 4.120 . 4.740 3.038 2.809 3.373 . 0 0 "[ . 1 . 2]" 1
212 1 8 PHE H 1 21 SER HB3 5.250 . 6.040 5.297 4.148 6.096 0.056 11 0 "[ . 1 . 2]" 1
213 1 111 GLN HB3 1 112 PHE H 5.010 . 5.760 2.254 1.977 3.402 . 0 0 "[ . 1 . 2]" 1
214 1 76 LYS HB3 1 81 GLU HA 4.330 . 4.980 3.070 2.628 3.591 . 0 0 "[ . 1 . 2]" 1
215 1 84 GLU HB3 1 105 PRO HA 5.500 . 6.330 5.806 4.671 6.427 0.097 5 0 "[ . 1 . 2]" 1
216 1 84 GLU HA 1 106 ASN HB3 5.180 . 5.960 4.884 4.302 5.865 . 0 0 "[ . 1 . 2]" 1
217 1 12 VAL MG1 1 154 LYS HB3 4.990 . 5.740 2.047 1.792 2.801 0.008 6 0 "[ . 1 . 2]" 1
218 1 12 VAL MG2 1 154 LYS HB3 4.990 . 5.740 3.968 3.503 4.849 . 0 0 "[ . 1 . 2]" 1
219 1 39 LEU H 1 39 LEU MD1 4.200 . 4.830 3.772 3.666 3.917 . 0 0 "[ . 1 . 2]" 1
220 1 35 ASN HD22 1 39 LEU MD1 4.700 . 5.400 2.772 2.436 3.131 . 0 0 "[ . 1 . 2]" 1
221 1 39 LEU MD1 1 77 SER HA 4.260 . 4.900 2.193 1.909 2.615 . 0 0 "[ . 1 . 2]" 1
222 1 39 LEU MD1 1 78 ILE MG 3.850 . 4.430 3.342 2.984 3.716 . 0 0 "[ . 1 . 2]" 1
223 1 25 PHE QD 1 90 LEU MD1 3.670 . 4.220 2.418 2.087 2.863 . 0 0 "[ . 1 . 2]" 1
224 1 24 LEU HA 1 90 LEU MD1 5.100 . 5.870 5.147 4.727 5.458 . 0 0 "[ . 1 . 2]" 1
225 1 25 PHE HB2 1 90 LEU MD1 4.260 . 4.900 1.909 1.704 2.278 0.096 19 0 "[ . 1 . 2]" 1
226 1 25 PHE HB3 1 90 LEU MD1 4.260 . 4.900 2.802 2.462 3.007 . 0 0 "[ . 1 . 2]" 1
227 1 90 LEU MD1 1 128 VAL HB 3.990 . 4.590 2.992 2.423 3.519 . 0 0 "[ . 1 . 2]" 1
228 1 89 ILE HB 1 90 LEU HG 3.990 . 4.590 2.865 2.538 3.309 . 0 0 "[ . 1 . 2]" 1
229 1 90 LEU MD1 1 128 VAL MG1 3.400 . 3.910 2.864 2.413 3.095 . 0 0 "[ . 1 . 2]" 1
230 1 95 PRO QG 1 117 ALA HA 4.800 . 5.520 4.575 2.630 5.151 . 0 0 "[ . 1 . 2]" 1
231 1 133 LYS HB2 1 134 GLU QG 4.050 . 4.660 3.488 3.021 4.266 . 0 0 "[ . 1 . 2]" 1
232 1 133 LYS HB3 1 134 GLU QG 4.760 . 5.470 4.694 4.310 5.537 0.067 17 0 "[ . 1 . 2]" 1
233 1 107 THR H 1 107 THR MG 4.030 . 4.630 3.887 2.929 4.021 . 0 0 "[ . 1 . 2]" 1
234 1 2 VAL MG1 1 3 ASN H 4.380 . 5.040 3.247 2.320 4.371 . 0 0 "[ . 1 . 2]" 1
235 1 107 THR HA 1 107 THR MG 3.090 . 3.550 2.360 2.324 2.417 . 0 0 "[ . 1 . 2]" 1
236 1 2 VAL HA 1 2 VAL MG1 3.340 . 3.840 3.053 2.305 3.288 . 0 0 "[ . 1 . 2]" 1
237 1 82 LYS HB3 1 107 THR MG 4.120 . 4.740 4.287 3.271 4.818 0.078 8 0 "[ . 1 . 2]" 1
238 1 82 LYS HB2 1 107 THR MG 5.030 . 5.780 4.206 3.365 4.868 . 0 0 "[ . 1 . 2]" 1
239 1 103 ALA MB 1 107 THR MG 3.770 . 4.340 2.071 1.802 2.532 . 0 0 "[ . 1 . 2]" 1
240 1 6 VAL QG 1 7 PHE H 4.230 . 4.860 3.102 2.149 3.586 . 0 0 "[ . 1 . 2]" 1
241 1 6 VAL QG 1 22 PHE QD . . 3.850 2.276 1.787 3.127 0.013 4 0 "[ . 1 . 2]" 1
242 1 6 VAL QG 1 40 SER HB2 6.000 . 6.900 3.395 2.881 4.471 . 0 0 "[ . 1 . 2]" 1
243 1 6 VAL QG 1 40 SER HB3 6.000 . 6.900 3.504 2.524 4.920 . 0 0 "[ . 1 . 2]" 1
244 1 6 VAL QG 1 22 PHE HB2 4.160 . 4.200 2.292 1.792 3.141 0.008 11 0 "[ . 1 . 2]" 1
245 1 12 VAL H 1 12 VAL MG1 3.760 . 4.320 3.759 2.756 3.927 . 0 0 "[ . 1 . 2]" 1
246 1 12 VAL MG1 1 145 PHE QD 4.470 . 5.140 3.564 2.854 4.159 . 0 0 "[ . 1 . 2]" 1
247 1 12 VAL MG1 1 145 PHE QE 3.940 . 4.530 3.317 2.455 3.872 . 0 0 "[ . 1 . 2]" 1
248 1 12 VAL HA 1 12 VAL MG1 3.450 . 3.970 2.486 2.315 2.600 . 0 0 "[ . 1 . 2]" 1
249 1 12 VAL MG1 1 154 LYS HB2 4.990 . 5.740 2.765 2.389 3.117 . 0 0 "[ . 1 . 2]" 1
250 1 20 VAL MG1 1 22 PHE QE 4.620 . 5.310 2.848 2.564 3.000 . 0 0 "[ . 1 . 2]" 1
251 1 20 VAL HA 1 20 VAL MG1 3.520 . 4.050 2.458 2.373 2.537 . 0 0 "[ . 1 . 2]" 1
252 1 10 ILE HG12 1 20 VAL MG1 4.120 . 4.740 4.101 3.548 4.610 . 0 0 "[ . 1 . 2]" 1
253 1 29 VAL H 1 29 VAL MG1 4.020 . 4.620 3.157 2.973 3.328 . 0 0 "[ . 1 . 2]" 1
254 1 29 VAL MG1 1 129 PHE HA 4.370 . 5.030 3.730 3.391 4.055 . 0 0 "[ . 1 . 2]" 1
255 1 29 VAL MG1 1 32 THR HB 3.880 . 4.460 3.724 3.156 4.437 . 0 0 "[ . 1 . 2]" 1
256 1 28 LYS HB2 1 29 VAL MG1 5.080 . 5.840 3.223 2.727 3.568 . 0 0 "[ . 1 . 2]" 1
257 1 29 VAL MG1 1 90 LEU MD1 4.080 . 4.690 2.780 2.178 3.205 . 0 0 "[ . 1 . 2]" 1
258 1 29 VAL MG1 1 90 LEU MD2 5.100 . 5.870 4.394 3.861 4.873 . 0 0 "[ . 1 . 2]" 1
259 1 86 GLU HB2 1 127 VAL MG1 5.810 . 6.680 4.664 3.124 6.352 . 0 0 "[ . 1 . 2]" 1
260 1 86 GLU HB3 1 127 VAL MG1 5.810 . 6.680 3.388 1.840 4.950 . 0 0 "[ . 1 . 2]" 1
261 1 32 THR MG 1 129 PHE HB2 4.020 . 4.620 3.260 2.768 3.581 . 0 0 "[ . 1 . 2]" 1
262 1 90 LEU HB2 1 128 VAL MG1 3.980 . 4.580 3.787 3.351 4.152 . 0 0 "[ . 1 . 2]" 1
263 1 128 VAL MG1 1 131 LYS QB 4.280 . 4.920 3.741 3.339 4.209 . 0 0 "[ . 1 . 2]" 1
264 1 90 LEU HB3 1 128 VAL MG1 3.980 . 4.580 3.073 2.496 3.383 . 0 0 "[ . 1 . 2]" 1
265 1 29 VAL MG1 1 32 THR MG 4.500 . 5.180 4.179 3.263 5.039 . 0 0 "[ . 1 . 2]" 1
266 1 90 LEU MD2 1 128 VAL MG1 4.130 . 4.750 3.893 3.448 4.303 . 0 0 "[ . 1 . 2]" 1
267 1 132 VAL QG 1 133 LYS H . . 3.860 2.958 2.577 3.248 . 0 0 "[ . 1 . 2]" 1
268 1 132 VAL H 1 132 VAL QG . . 3.680 2.021 1.927 2.191 . 0 0 "[ . 1 . 2]" 1
269 1 22 PHE QD 1 132 VAL QG 4.350 . 5.000 2.763 2.135 3.506 . 0 0 "[ . 1 . 2]" 1
270 1 22 PHE QE 1 139 VAL MG1 4.300 . 4.950 4.077 3.542 4.504 . 0 0 "[ . 1 . 2]" 1
271 1 22 PHE HA 1 132 VAL QG . . 4.750 3.570 3.333 3.794 . 0 0 "[ . 1 . 2]" 1
272 1 96 GLY HA2 1 132 VAL QG . . 4.220 2.552 2.092 2.987 . 0 0 "[ . 1 . 2]" 1
273 1 136 MET HA 1 139 VAL MG1 4.470 . 5.140 4.065 3.752 4.455 . 0 0 "[ . 1 . 2]" 1
274 1 139 VAL HA 1 139 VAL MG1 3.390 . 3.900 2.492 2.445 2.525 . 0 0 "[ . 1 . 2]" 1
275 1 114 ILE MD 1 139 VAL MG1 3.130 . 3.600 2.508 2.238 2.821 . 0 0 "[ . 1 . 2]" 1
276 1 56 ILE MD 1 156 ILE QG 4.470 . 5.140 3.572 3.372 3.688 . 0 0 "[ . 1 . 2]" 1
277 1 10 ILE HG12 1 20 VAL HB 3.760 . 4.320 2.782 2.242 3.201 . 0 0 "[ . 1 . 2]" 1
278 1 10 ILE HG13 1 138 ILE MG 4.040 . 4.650 3.106 2.717 3.691 . 0 0 "[ . 1 . 2]" 1
279 1 92 HIS HA 1 97 ILE HG13 4.350 . 5.000 2.233 1.776 3.109 0.024 9 0 "[ . 1 . 2]" 1
280 1 2 VAL MG2 1 3 ASN H 4.380 . 5.040 4.004 2.624 4.369 . 0 0 "[ . 1 . 2]" 1
281 1 2 VAL HA 1 2 VAL MG2 3.340 . 3.840 2.531 2.298 3.287 . 0 0 "[ . 1 . 2]" 1
282 1 2 VAL MG2 1 26 ALA MB 4.810 . 5.530 4.451 2.974 5.664 0.134 9 0 "[ . 1 . 2]" 1
283 1 5 THR MG 1 22 PHE H 3.990 . 4.590 3.428 2.931 3.952 . 0 0 "[ . 1 . 2]" 1
284 1 5 THR MG 1 6 VAL H 3.350 . 3.850 2.854 2.466 3.200 . 0 0 "[ . 1 . 2]" 1
285 1 5 THR HA 1 5 THR MG 3.480 . 4.000 2.498 2.432 2.580 . 0 0 "[ . 1 . 2]" 1
286 1 5 THR MG 1 23 GLU HA 4.280 . 4.920 3.527 2.652 4.389 . 0 0 "[ . 1 . 2]" 1
287 1 5 THR MG 1 21 SER HB2 4.100 . 4.720 3.083 2.003 3.983 . 0 0 "[ . 1 . 2]" 1
288 1 5 THR MG 1 21 SER HB3 4.100 . 4.720 2.674 1.883 3.860 . 0 0 "[ . 1 . 2]" 1
289 1 5 THR MG 1 23 GLU HB2 4.380 . 5.040 4.059 3.158 4.795 . 0 0 "[ . 1 . 2]" 1
290 1 5 THR MG 1 164 LEU QB 3.040 . 3.500 2.699 2.120 3.247 . 0 0 "[ . 1 . 2]" 1
291 1 5 THR MG 1 133 LYS HG3 4.630 . 5.320 3.672 3.302 4.192 . 0 0 "[ . 1 . 2]" 1
292 1 5 THR MG 1 6 VAL QG . . 4.970 3.919 3.562 4.317 . 0 0 "[ . 1 . 2]" 1
293 1 6 VAL H 1 6 VAL QG . . 3.860 2.152 1.888 2.487 . 0 0 "[ . 1 . 2]" 1
294 1 10 ILE MG 1 157 THR H 5.060 . 5.820 4.331 3.752 4.795 . 0 0 "[ . 1 . 2]" 1
295 1 10 ILE H 1 10 ILE MG 4.270 . 4.910 3.812 3.785 3.870 . 0 0 "[ . 1 . 2]" 1
296 1 10 ILE MG 1 18 GLY H 5.340 . 6.140 4.198 3.876 4.839 . 0 0 "[ . 1 . 2]" 1
297 1 10 ILE MG 1 139 VAL H 6.000 . 6.900 5.522 5.233 5.948 . 0 0 "[ . 1 . 2]" 1
298 1 10 ILE HA 1 10 ILE MG 3.430 . 3.940 2.484 2.406 2.544 . 0 0 "[ . 1 . 2]" 1
299 1 10 ILE MG 1 142 MET ME 3.780 . 4.350 2.840 1.932 3.452 . 0 0 "[ . 1 . 2]" 1
300 1 10 ILE HG13 1 10 ILE MG 3.470 . 3.990 2.398 2.382 2.422 . 0 0 "[ . 1 . 2]" 1
301 1 10 ILE MG 1 17 LEU HB3 4.220 . 4.850 3.042 2.626 3.954 . 0 0 "[ . 1 . 2]" 1
302 1 10 ILE MG 1 156 ILE QG 4.790 . 5.510 4.203 3.897 4.631 . 0 0 "[ . 1 . 2]" 1
303 1 10 ILE MG 1 159 ALA MB 4.590 . 5.280 5.274 5.039 5.430 0.150 13 0 "[ . 1 . 2]" 1
304 1 10 ILE MG 1 138 ILE MG 3.300 . 3.800 2.697 2.310 3.237 . 0 0 "[ . 1 . 2]" 1
305 1 12 VAL MG2 1 13 ASP H 4.570 . 5.260 4.141 3.945 4.399 . 0 0 "[ . 1 . 2]" 1
306 1 12 VAL H 1 12 VAL MG2 3.760 . 4.320 2.488 1.941 2.766 . 0 0 "[ . 1 . 2]" 1
307 1 12 VAL MG2 1 145 PHE QD 4.470 . 5.140 3.123 2.510 4.865 . 0 0 "[ . 1 . 2]" 1
308 1 12 VAL MG2 1 145 PHE QE 3.940 . 4.530 2.593 2.017 3.820 . 0 0 "[ . 1 . 2]" 1
309 1 12 VAL HA 1 12 VAL MG2 3.450 . 3.970 2.473 2.355 3.287 . 0 0 "[ . 1 . 2]" 1
310 1 11 ALA MB 1 12 VAL MG2 4.970 . 5.720 4.503 4.136 4.625 . 0 0 "[ . 1 . 2]" 1
311 1 20 VAL H 1 20 VAL MG2 3.970 . 4.570 2.881 2.685 3.235 . 0 0 "[ . 1 . 2]" 1
312 1 20 VAL MG2 1 21 SER H 4.360 . 5.010 4.073 3.914 4.199 . 0 0 "[ . 1 . 2]" 1
313 1 20 VAL MG2 1 22 PHE QE 4.620 . 5.310 4.421 4.088 4.768 . 0 0 "[ . 1 . 2]" 1
314 1 20 VAL HA 1 20 VAL MG2 3.520 . 4.050 2.473 2.401 2.565 . 0 0 "[ . 1 . 2]" 1
315 1 10 ILE HG12 1 20 VAL MG2 4.120 . 4.740 2.397 2.170 2.657 . 0 0 "[ . 1 . 2]" 1
316 1 10 ILE MD 1 20 VAL MG2 3.750 . 4.310 3.306 3.147 3.443 . 0 0 "[ . 1 . 2]" 1
317 1 20 VAL MG2 1 138 ILE MG 3.740 . 4.300 2.432 2.329 2.586 . 0 0 "[ . 1 . 2]" 1
318 1 29 VAL H 1 29 VAL MG2 4.020 . 4.620 2.192 2.124 2.295 . 0 0 "[ . 1 . 2]" 1
319 1 29 VAL MG2 1 129 PHE HA 4.370 . 5.030 1.834 1.731 2.179 0.069 16 0 "[ . 1 . 2]" 1
320 1 29 VAL MG2 1 32 THR HB 3.880 . 4.460 2.942 2.484 3.378 . 0 0 "[ . 1 . 2]" 1
321 1 28 LYS HB2 1 29 VAL MG2 5.080 . 5.840 2.807 2.468 3.111 . 0 0 "[ . 1 . 2]" 1
322 1 29 VAL MG2 1 32 THR MG 4.500 . 5.180 3.767 2.962 4.315 . 0 0 "[ . 1 . 2]" 1
323 1 29 VAL MG2 1 89 ILE MD 5.090 . 5.850 4.756 4.371 5.441 . 0 0 "[ . 1 . 2]" 1
324 1 29 VAL MG2 1 90 LEU MD1 4.080 . 4.690 2.167 1.976 2.465 . 0 0 "[ . 1 . 2]" 1
325 1 32 THR MG 1 83 PHE HZ 4.010 . 4.610 2.576 2.091 3.626 . 0 0 "[ . 1 . 2]" 1
326 1 32 THR MG 1 129 PHE HB3 4.020 . 4.620 2.215 1.800 2.551 0.000 8 0 "[ . 1 . 2]" 1
327 1 32 THR MG 1 127 VAL MG1 4.090 . 4.700 3.217 2.234 4.742 0.042 16 0 "[ . 1 . 2]" 1
328 1 40 SER H 1 41 THR MG 4.700 . 5.400 4.544 4.132 5.524 0.124 7 0 "[ . 1 . 2]" 1
329 1 146 GLY H 1 152 THR MG 4.600 . 5.290 4.568 3.399 5.151 . 0 0 "[ . 1 . 2]" 1
330 1 152 THR HA 1 152 THR MG 3.390 . 3.900 2.346 2.296 2.426 . 0 0 "[ . 1 . 2]" 1
331 1 55 ARG HA 1 152 THR MG 4.830 . 5.550 3.608 2.846 5.601 0.051 15 0 "[ . 1 . 2]" 1
332 1 41 THR HA 1 41 THR MG 3.480 . 4.000 2.359 2.251 2.421 . 0 0 "[ . 1 . 2]" 1
333 1 151 LYS HA 1 152 THR MG 4.560 . 5.240 4.173 3.598 5.509 0.269 14 0 "[ . 1 . 2]" 1
334 1 38 ALA HA 1 41 THR MG 4.090 . 4.700 4.102 3.693 4.614 . 0 0 "[ . 1 . 2]" 1
335 1 40 SER HB2 1 41 THR MG 4.440 . 5.110 4.180 2.795 5.106 . 0 0 "[ . 1 . 2]" 1
336 1 41 THR MG 1 163 GLN QB 3.430 . 3.940 3.038 2.096 3.876 . 0 0 "[ . 1 . 2]" 1
337 1 56 ILE HB 1 152 THR MG 3.300 . 3.800 2.270 1.863 2.722 . 0 0 "[ . 1 . 2]" 1
338 1 56 ILE MG 1 152 THR MG 3.640 . 4.190 3.512 3.240 3.688 . 0 0 "[ . 1 . 2]" 1
339 1 56 ILE MD 1 152 THR MG 3.150 . 3.620 2.204 1.943 2.390 . 0 0 "[ . 1 . 2]" 1
340 1 56 ILE MG 1 147 SER H 4.170 . 4.800 4.023 3.853 4.187 . 0 0 "[ . 1 . 2]" 1
341 1 56 ILE MG 1 143 GLU H 4.620 . 5.310 4.087 3.745 4.347 . 0 0 "[ . 1 . 2]" 1
342 1 56 ILE MG 1 62 CYS HA 4.120 . 4.740 2.215 1.924 2.517 . 0 0 "[ . 1 . 2]" 1
343 1 56 ILE HA 1 56 ILE MG 3.550 . 4.080 2.471 2.433 2.505 . 0 0 "[ . 1 . 2]" 1
344 1 56 ILE MG 1 58 PRO HD3 4.280 . 4.920 3.517 3.149 3.936 . 0 0 "[ . 1 . 2]" 1
345 1 56 ILE MG 1 143 GLU HA 3.030 . 3.480 1.910 1.768 2.080 0.032 11 0 "[ . 1 . 2]" 1
346 1 56 ILE MG 1 143 GLU HG2 4.290 . 4.930 3.379 2.890 4.168 . 0 0 "[ . 1 . 2]" 1
347 1 56 ILE MG 1 143 GLU HB2 4.570 . 5.260 3.641 3.332 3.939 . 0 0 "[ . 1 . 2]" 1
348 1 56 ILE MG 1 143 GLU HG3 4.290 . 4.930 2.774 2.134 3.754 . 0 0 "[ . 1 . 2]" 1
349 1 56 ILE MG 1 143 GLU HB3 4.570 . 5.260 4.256 4.060 4.526 . 0 0 "[ . 1 . 2]" 1
350 1 56 ILE MG 1 156 ILE QG 4.910 . 5.650 5.540 5.075 5.755 0.105 1 0 "[ . 1 . 2]" 1
351 1 56 ILE MG 1 57 ILE MG 4.460 . 5.130 4.876 4.706 5.074 . 0 0 "[ . 1 . 2]" 1
352 1 56 ILE MD 1 56 ILE MG 3.030 . 3.480 1.978 1.940 2.011 . 0 0 "[ . 1 . 2]" 1
353 1 57 ILE MG 1 60 PHE HD2 3.460 . 3.980 3.008 2.433 3.478 . 0 0 "[ . 1 . 2]" 1
354 1 57 ILE MG 1 60 PHE HE2 4.340 . 4.990 4.585 3.960 5.046 0.056 5 0 "[ . 1 . 2]" 1
355 1 57 ILE HA 1 57 ILE MG 3.520 . 4.050 2.456 2.407 2.502 . 0 0 "[ . 1 . 2]" 1
356 1 57 ILE MG 1 60 PHE HA 4.790 . 5.510 4.991 4.782 5.243 . 0 0 "[ . 1 . 2]" 1
357 1 57 ILE MG 1 58 PRO HD3 4.880 . 5.610 3.701 3.477 3.963 . 0 0 "[ . 1 . 2]" 1
358 1 73 THR MG 1 76 LYS HA 4.160 . 4.780 2.607 2.278 2.982 . 0 0 "[ . 1 . 2]" 1
359 1 73 THR HA 1 73 THR MG 3.100 . 3.570 2.398 2.272 2.509 . 0 0 "[ . 1 . 2]" 1
360 1 73 THR MG 1 82 LYS HB3 4.620 . 5.310 4.167 3.071 5.296 . 0 0 "[ . 1 . 2]" 1
361 1 68 THR MG 1 69 ARG H 4.280 . 4.920 3.134 2.298 4.166 . 0 0 "[ . 1 . 2]" 1
362 1 78 ILE MG 1 80 GLY H 5.100 . 5.870 5.176 4.953 5.611 . 0 0 "[ . 1 . 2]" 1
363 1 44 LYS HA 1 78 ILE MG 5.780 . 6.650 5.093 4.880 5.448 . 0 0 "[ . 1 . 2]" 1
364 1 77 SER HB2 1 78 ILE MG 6.000 . 6.900 4.112 3.860 4.453 . 0 0 "[ . 1 . 2]" 1
365 1 77 SER HB3 1 78 ILE MG 6.000 . 6.900 5.254 5.089 5.522 . 0 0 "[ . 1 . 2]" 1
366 1 78 ILE HA 1 78 ILE MG 3.340 . 3.840 2.432 2.367 2.461 . 0 0 "[ . 1 . 2]" 1
367 1 35 ASN HA 1 78 ILE MG 3.860 . 4.440 2.454 2.070 2.824 . 0 0 "[ . 1 . 2]" 1
368 1 39 LEU HB2 1 78 ILE MG 4.920 . 5.660 4.423 4.101 4.899 . 0 0 "[ . 1 . 2]" 1
369 1 39 LEU HG 1 78 ILE MG 3.700 . 4.260 2.453 2.114 2.965 . 0 0 "[ . 1 . 2]" 1
370 1 89 ILE MG 1 90 LEU H 3.740 . 4.300 3.220 2.974 3.647 . 0 0 "[ . 1 . 2]" 1
371 1 89 ILE MG 1 90 LEU HA 4.030 . 4.630 3.359 3.099 3.725 . 0 0 "[ . 1 . 2]" 1
372 1 89 ILE HA 1 89 ILE MG 3.080 . 3.540 2.529 2.484 2.571 . 0 0 "[ . 1 . 2]" 1
373 1 28 LYS HB3 1 89 ILE MG 3.940 . 4.530 2.423 2.103 2.897 . 0 0 "[ . 1 . 2]" 1
374 1 89 ILE HG12 1 89 ILE MG 3.200 . 3.680 2.502 2.458 2.552 . 0 0 "[ . 1 . 2]" 1
375 1 89 ILE MG 1 90 LEU HG 3.580 . 4.120 2.816 2.520 3.327 . 0 0 "[ . 1 . 2]" 1
376 1 89 ILE MG 1 90 LEU MD2 3.130 . 3.600 2.640 2.134 3.149 . 0 0 "[ . 1 . 2]" 1
377 1 92 HIS H 1 93 THR MG 5.230 . 6.010 4.235 3.380 4.714 . 0 0 "[ . 1 . 2]" 1
378 1 91 LYS HA 1 93 THR MG 5.430 . 6.240 4.738 4.184 5.069 . 0 0 "[ . 1 . 2]" 1
379 1 91 LYS QE 1 93 THR MG 4.810 . 5.530 3.479 2.025 5.542 0.012 17 0 "[ . 1 . 2]" 1
380 1 93 THR MG 1 118 LYS QE 4.970 . 5.720 4.871 4.203 5.836 0.116 17 0 "[ . 1 . 2]" 1
381 1 93 THR MG 1 97 ILE MD 4.470 . 5.140 4.189 3.311 5.228 0.088 15 0 "[ . 1 . 2]" 1
382 1 97 ILE H 1 97 ILE MG 3.860 . 4.440 3.706 3.643 3.805 . 0 0 "[ . 1 . 2]" 1
383 1 119 THR MG 1 121 TRP HZ2 3.870 . 4.450 2.603 2.197 3.208 . 0 0 "[ . 1 . 2]" 1
384 1 92 HIS HA 1 97 ILE MG 3.530 . 4.060 2.380 1.753 3.149 0.047 12 0 "[ . 1 . 2]" 1
385 1 118 LYS HA 1 119 THR MG 4.670 . 5.370 4.004 3.770 4.269 . 0 0 "[ . 1 . 2]" 1
386 1 119 THR MG 2 7 ALA MB 5.450 . 6.270 4.971 3.758 6.383 0.113 12 0 "[ . 1 . 2]" 1
387 1 93 THR MG 1 97 ILE MG 5.460 . 6.280 5.539 4.947 6.268 . 0 0 "[ . 1 . 2]" 1
388 1 90 LEU MD1 1 97 ILE MG 4.900 . 5.640 5.297 4.742 5.669 0.029 11 0 "[ . 1 . 2]" 1
389 1 97 ILE MG 1 128 VAL MG2 3.240 . 3.730 1.998 1.864 2.321 . 0 0 "[ . 1 . 2]" 1
390 1 22 PHE QE 1 114 ILE MG 4.040 . 4.650 2.620 2.027 3.238 . 0 0 "[ . 1 . 2]" 1
391 1 96 GLY HA2 1 114 ILE MG 4.330 . 4.980 2.543 2.100 3.370 . 0 0 "[ . 1 . 2]" 1
392 1 96 GLY HA3 1 114 ILE MG 4.800 . 5.520 3.803 3.411 4.699 . 0 0 "[ . 1 . 2]" 1
393 1 114 ILE MG 1 139 VAL HB 4.340 . 4.990 3.960 3.629 4.157 . 0 0 "[ . 1 . 2]" 1
394 1 114 ILE MG 1 136 MET ME 3.860 . 4.440 3.666 2.946 4.356 . 0 0 "[ . 1 . 2]" 1
395 1 114 ILE MG 1 132 VAL HB 4.130 . 4.750 3.794 3.003 4.450 . 0 0 "[ . 1 . 2]" 1
396 1 114 ILE MD 1 114 ILE MG 3.070 . 3.530 2.102 2.048 2.146 . 0 0 "[ . 1 . 2]" 1
397 1 62 CYS H 1 116 THR MG 4.340 . 4.990 3.075 2.230 4.440 . 0 0 "[ . 1 . 2]" 1
398 1 115 CYS HA 1 116 THR MG 4.330 . 4.980 3.908 3.644 4.228 . 0 0 "[ . 1 . 2]" 1
399 1 96 GLY HA2 1 116 THR MG 5.020 . 5.770 4.289 3.421 5.576 . 0 0 "[ . 1 . 2]" 1
400 1 116 THR HA 1 116 THR MG 3.230 . 3.710 2.408 2.359 2.471 . 0 0 "[ . 1 . 2]" 1
401 1 95 PRO HA 1 116 THR MG 5.610 . 6.450 5.743 4.951 6.176 . 0 0 "[ . 1 . 2]" 1
402 1 116 THR MG 1 139 VAL HA 6.000 . 6.900 4.423 4.157 4.618 . 0 0 "[ . 1 . 2]" 1
403 1 116 THR MG 1 143 GLU HB2 3.890 . 4.470 2.510 1.889 3.324 . 0 0 "[ . 1 . 2]" 1
404 1 116 THR MG 1 140 GLU QB 4.030 . 4.630 4.179 3.492 4.751 0.121 7 0 "[ . 1 . 2]" 1
405 1 116 THR MG 1 143 GLU HB3 3.890 . 4.470 3.459 3.257 4.135 . 0 0 "[ . 1 . 2]" 1
406 1 60 PHE HD1 1 119 THR MG 3.870 . 4.450 2.350 2.070 2.652 . 0 0 "[ . 1 . 2]" 1
407 1 119 THR MG 1 121 TRP HZ3 4.220 . 4.850 4.352 3.656 4.960 0.110 13 0 "[ . 1 . 2]" 1
408 1 119 THR HA 1 119 THR MG 3.420 . 3.930 2.373 2.325 2.416 . 0 0 "[ . 1 . 2]" 1
409 1 119 THR MG 1 122 LEU MD2 4.100 . 4.720 3.820 2.541 4.543 . 0 0 "[ . 1 . 2]" 1
410 1 32 THR MG 1 127 VAL MG2 4.090 . 4.700 4.298 2.282 4.935 0.235 6 0 "[ . 1 . 2]" 1
411 1 92 HIS HA 1 128 VAL MG2 4.240 . 4.880 2.980 2.452 3.589 . 0 0 "[ . 1 . 2]" 1
412 1 90 LEU MD1 1 128 VAL MG2 4.230 . 4.860 4.237 3.789 4.615 . 0 0 "[ . 1 . 2]" 1
413 1 138 ILE H 1 138 ILE MG 4.030 . 4.630 3.823 3.810 3.847 . 0 0 "[ . 1 . 2]" 1
414 1 138 ILE HA 1 138 ILE MG 3.400 . 3.910 2.486 2.443 2.600 . 0 0 "[ . 1 . 2]" 1
415 1 10 ILE HB 1 138 ILE MG 3.770 . 4.340 2.322 2.073 2.697 . 0 0 "[ . 1 . 2]" 1
416 1 20 VAL HB 1 138 ILE MG 5.050 . 5.810 4.658 4.497 4.858 . 0 0 "[ . 1 . 2]" 1
417 1 138 ILE MG 1 141 ALA MB 3.750 . 4.310 3.400 3.159 3.877 . 0 0 "[ . 1 . 2]" 1
418 1 139 VAL MG2 1 140 GLU H 4.190 . 4.820 3.852 3.755 3.939 . 0 0 "[ . 1 . 2]" 1
419 1 139 VAL H 1 139 VAL MG2 3.870 . 4.450 2.112 2.029 2.198 . 0 0 "[ . 1 . 2]" 1
420 1 136 MET HA 1 139 VAL MG2 4.470 . 5.140 2.623 2.273 3.049 . 0 0 "[ . 1 . 2]" 1
421 1 139 VAL HA 1 139 VAL MG2 3.390 . 3.900 2.437 2.382 2.497 . 0 0 "[ . 1 . 2]" 1
422 1 11 ALA H 1 156 ILE MG 4.380 . 5.040 3.202 2.857 3.649 . 0 0 "[ . 1 . 2]" 1
423 1 53 PHE HE1 1 156 ILE MG 4.490 . 5.160 3.426 3.133 3.822 . 0 0 "[ . 1 . 2]" 1
424 1 53 PHE HD1 1 156 ILE MG 3.810 . 4.380 2.493 2.090 3.057 . 0 0 "[ . 1 . 2]" 1
425 1 10 ILE HA 1 156 ILE MG 4.860 . 5.590 3.991 3.644 4.758 . 0 0 "[ . 1 . 2]" 1
426 1 156 ILE HA 1 156 ILE MG 3.380 . 3.890 2.443 2.395 2.535 . 0 0 "[ . 1 . 2]" 1
427 1 156 ILE QG 1 156 ILE MG 3.150 . 3.620 2.391 2.355 2.441 . 0 0 "[ . 1 . 2]" 1
428 1 152 THR MG 1 156 ILE MG 4.590 . 5.280 4.718 3.975 5.287 0.007 1 0 "[ . 1 . 2]" 1
429 1 56 ILE MD 1 156 ILE MG 3.010 . 3.460 3.194 2.754 3.564 0.104 8 0 "[ . 1 . 2]" 1
430 1 17 LEU H 1 17 LEU QD 4.390 . 5.050 3.812 3.760 3.840 . 0 0 "[ . 1 . 2]" 1
431 1 157 THR MG 1 158 ILE H 3.990 . 4.590 3.802 3.689 3.948 . 0 0 "[ . 1 . 2]" 1
432 1 52 CYS HA 1 157 THR MG 3.740 . 4.300 2.608 1.928 4.189 . 0 0 "[ . 1 . 2]" 1
433 1 157 THR HA 1 157 THR MG 3.400 . 3.910 2.447 2.377 3.270 . 0 0 "[ . 1 . 2]" 1
434 1 17 LEU HA 1 17 LEU QD . . 3.760 2.223 2.176 2.260 . 0 0 "[ . 1 . 2]" 1
435 1 155 LYS HA 1 157 THR MG 4.280 . 4.920 4.413 4.092 4.991 0.071 9 0 "[ . 1 . 2]" 1
436 1 52 CYS HB2 1 157 THR MG 3.980 . 4.580 2.909 1.955 4.496 . 0 0 "[ . 1 . 2]" 1
437 1 52 CYS HB3 1 157 THR MG 3.980 . 4.580 2.697 1.868 4.006 . 0 0 "[ . 1 . 2]" 1
438 1 17 LEU HB2 1 17 LEU QD . . 3.220 2.195 2.187 2.205 . 0 0 "[ . 1 . 2]" 1
439 1 17 LEU QD 1 138 ILE MD . . 3.730 3.222 2.647 3.532 . 0 0 "[ . 1 . 2]" 1
440 1 50 GLY H 1 158 ILE MG 4.280 . 4.920 3.262 2.803 3.652 . 0 0 "[ . 1 . 2]" 1
441 1 158 ILE MG 1 161 CYS H 4.510 . 5.190 4.446 3.933 4.800 . 0 0 "[ . 1 . 2]" 1
442 1 8 PHE HZ 1 158 ILE MG 4.280 . 4.920 4.621 4.220 4.854 . 0 0 "[ . 1 . 2]" 1
443 1 8 PHE HA 1 158 ILE MG 4.150 . 4.770 3.412 3.214 3.607 . 0 0 "[ . 1 . 2]" 1
444 1 158 ILE MG 1 161 CYS HA 4.240 . 4.880 3.888 3.670 4.183 . 0 0 "[ . 1 . 2]" 1
445 1 158 ILE HA 1 158 ILE MG 3.450 . 3.970 2.512 2.472 2.562 . 0 0 "[ . 1 . 2]" 1
446 1 49 LYS HA 1 158 ILE MG 3.900 . 4.490 3.726 3.200 4.393 . 0 0 "[ . 1 . 2]" 1
447 1 8 PHE HB2 1 158 ILE MG 5.060 . 5.820 3.453 3.265 3.731 . 0 0 "[ . 1 . 2]" 1
448 1 8 PHE HB3 1 158 ILE MG 5.060 . 5.820 1.947 1.794 2.235 0.006 1 0 "[ . 1 . 2]" 1
449 1 158 ILE MG 1 159 ALA MB 4.320 . 4.970 4.247 3.988 4.366 . 0 0 "[ . 1 . 2]" 1
450 1 136 MET HA 1 136 MET HG2 4.240 . 4.880 3.830 3.753 3.964 . 0 0 "[ . 1 . 2]" 1
451 1 133 LYS HG3 1 134 GLU HA 4.280 . 4.920 4.321 4.156 4.607 . 0 0 "[ . 1 . 2]" 1
452 1 133 LYS HG3 1 134 GLU HB2 4.000 . 4.600 3.156 2.590 3.670 . 0 0 "[ . 1 . 2]" 1
453 1 140 GLU H 1 140 GLU HG2 3.810 . 4.380 3.559 3.395 3.687 . 0 0 "[ . 1 . 2]" 1
454 1 136 MET ME 1 140 GLU HG2 3.960 . 4.550 2.665 2.446 2.928 . 0 0 "[ . 1 . 2]" 1
455 1 116 THR MG 1 143 GLU HG2 4.670 . 5.370 4.332 3.953 4.693 . 0 0 "[ . 1 . 2]" 1
456 1 154 LYS HA 1 154 LYS HG2 4.000 . 4.600 3.112 2.961 3.289 . 0 0 "[ . 1 . 2]" 1
457 1 81 GLU HA 1 81 GLU HG3 4.170 . 4.800 2.703 2.604 2.815 . 0 0 "[ . 1 . 2]" 1
458 1 117 ALA MB 1 118 LYS HG3 4.030 . 4.630 3.887 3.522 4.278 . 0 0 "[ . 1 . 2]" 1
459 1 133 LYS HA 1 133 LYS HG2 4.230 . 4.860 3.786 3.747 3.854 . 0 0 "[ . 1 . 2]" 1
460 1 133 LYS HG2 1 134 GLU QG 4.140 . 4.760 3.894 3.253 5.020 0.260 12 0 "[ . 1 . 2]" 1
461 1 133 LYS HG2 1 134 GLU HB2 3.920 . 4.510 4.162 3.698 4.620 0.110 10 0 "[ . 1 . 2]" 1
462 1 23 GLU HB2 1 133 LYS HG2 4.050 . 4.660 3.342 2.969 4.512 . 0 0 "[ . 1 . 2]" 1
463 1 148 ARG HA 1 148 ARG HG3 4.230 . 4.860 3.781 3.735 3.855 . 0 0 "[ . 1 . 2]" 1
464 1 10 ILE MD 1 11 ALA H 3.910 . 4.500 3.757 3.632 3.912 . 0 0 "[ . 1 . 2]" 1
465 1 10 ILE MD 1 53 PHE HE1 4.330 . 4.980 2.640 2.178 3.400 . 0 0 "[ . 1 . 2]" 1
466 1 10 ILE HA 1 10 ILE MD 3.380 . 3.890 2.095 2.034 2.238 . 0 0 "[ . 1 . 2]" 1
467 1 10 ILE MD 1 158 ILE HA 4.060 . 4.670 3.035 2.516 3.292 . 0 0 "[ . 1 . 2]" 1
468 1 10 ILE MD 1 142 MET ME 4.450 . 5.120 3.104 2.608 4.751 . 0 0 "[ . 1 . 2]" 1
469 1 10 ILE MD 1 20 VAL HB 4.790 . 5.510 3.303 2.760 3.687 . 0 0 "[ . 1 . 2]" 1
470 1 10 ILE MD 1 20 VAL MG1 3.750 . 4.310 3.880 3.464 4.149 . 0 0 "[ . 1 . 2]" 1
471 1 10 ILE MD 1 138 ILE MG 4.000 . 4.600 4.217 3.929 4.646 0.046 4 0 "[ . 1 . 2]" 1
472 1 10 ILE MD 1 158 ILE MG 3.830 . 4.400 3.463 2.346 3.962 . 0 0 "[ . 1 . 2]" 1
473 1 17 LEU QD 1 145 PHE QE . . 3.860 2.214 1.820 3.278 . 0 0 "[ . 1 . 2]" 1
474 1 7 PHE HB3 1 164 LEU MD1 4.340 . 4.990 4.106 3.735 4.807 . 0 0 "[ . 1 . 2]" 1
475 1 24 LEU MD1 1 33 ALA HA 4.550 . 5.230 2.871 2.405 3.401 . 0 0 "[ . 1 . 2]" 1
476 1 6 VAL HB 1 24 LEU MD1 5.060 . 5.820 4.321 3.984 4.932 . 0 0 "[ . 1 . 2]" 1
477 1 24 LEU MD1 1 33 ALA MB 3.880 . 4.460 2.644 2.153 3.111 . 0 0 "[ . 1 . 2]" 1
478 1 57 ILE H 1 57 ILE MD 4.270 . 4.910 4.113 3.940 4.262 . 0 0 "[ . 1 . 2]" 1
479 1 87 ASN HD21 1 89 ILE MD 3.980 . 4.580 2.675 2.024 3.362 . 0 0 "[ . 1 . 2]" 1
480 1 57 ILE MD 1 60 PHE HE2 5.340 . 6.140 2.796 2.249 3.856 . 0 0 "[ . 1 . 2]" 1
481 1 87 ASN HD22 1 89 ILE MD 3.980 . 4.580 2.333 2.082 2.640 . 0 0 "[ . 1 . 2]" 1
482 1 57 ILE HA 1 57 ILE MD 4.280 . 4.920 3.908 3.837 3.966 . 0 0 "[ . 1 . 2]" 1
483 1 89 ILE HA 1 89 ILE MD 3.980 . 4.580 3.873 3.830 3.900 . 0 0 "[ . 1 . 2]" 1
484 1 57 ILE MD 1 60 PHE HB3 4.100 . 4.720 4.143 3.761 4.613 . 0 0 "[ . 1 . 2]" 1
485 1 57 ILE HB 1 57 ILE MD 3.500 . 4.030 2.487 2.436 2.557 . 0 0 "[ . 1 . 2]" 1
486 1 89 ILE MD 1 90 LEU HG 4.530 . 5.210 4.395 4.043 4.773 . 0 0 "[ . 1 . 2]" 1
487 1 89 ILE MD 1 90 LEU MD1 5.010 . 5.760 4.873 4.543 5.285 . 0 0 "[ . 1 . 2]" 1
488 1 89 ILE MD 1 90 LEU MD2 4.730 . 5.440 4.782 4.308 5.314 . 0 0 "[ . 1 . 2]" 1
489 1 78 ILE MD 1 79 TYR HE2 4.340 . 4.990 3.270 2.479 4.026 . 0 0 "[ . 1 . 2]" 1
490 1 35 ASN HA 1 78 ILE MD 3.430 . 3.940 2.033 1.904 2.144 . 0 0 "[ . 1 . 2]" 1
491 1 44 LYS HE2 1 78 ILE MD 4.360 . 5.010 3.717 2.369 5.138 0.128 4 0 "[ . 1 . 2]" 1
492 1 44 LYS HE3 1 78 ILE MD 4.360 . 5.010 4.199 1.978 5.101 0.091 12 0 "[ . 1 . 2]" 1
493 1 34 GLU HG2 1 78 ILE MD 4.430 . 5.090 3.271 2.214 4.406 . 0 0 "[ . 1 . 2]" 1
494 1 34 GLU HG3 1 78 ILE MD 4.430 . 5.090 3.638 2.573 4.761 . 0 0 "[ . 1 . 2]" 1
495 1 78 ILE HB 1 78 ILE MD 3.470 . 3.990 2.459 2.424 2.493 . 0 0 "[ . 1 . 2]" 1
496 1 39 LEU HG 1 78 ILE MD 5.650 . 6.500 4.713 4.426 5.177 . 0 0 "[ . 1 . 2]" 1
497 1 78 ILE MD 1 78 ILE MG 3.050 . 3.510 2.025 1.979 2.072 . 0 0 "[ . 1 . 2]" 1
498 1 97 ILE MD 1 98 LEU H 3.730 . 4.290 3.581 3.255 3.796 . 0 0 "[ . 1 . 2]" 1
499 1 97 ILE MD 1 131 LYS HA 4.180 . 4.810 3.686 3.352 4.104 . 0 0 "[ . 1 . 2]" 1
500 1 92 HIS HA 1 97 ILE MD 4.060 . 4.670 3.091 2.578 3.767 . 0 0 "[ . 1 . 2]" 1
501 1 97 ILE HA 1 97 ILE MD 3.280 . 3.770 2.017 1.966 2.082 . 0 0 "[ . 1 . 2]" 1
502 1 97 ILE MD 1 131 LYS QE 4.570 . 5.260 5.012 4.110 5.375 0.115 6 0 "[ . 1 . 2]" 1
503 1 97 ILE MD 1 131 LYS QB 3.570 . 4.110 3.051 2.126 3.436 . 0 0 "[ . 1 . 2]" 1
504 1 97 ILE MD 1 131 LYS HG2 4.280 . 4.920 4.514 3.789 4.910 . 0 0 "[ . 1 . 2]" 1
505 1 97 ILE MD 1 128 VAL MG2 4.190 . 4.820 2.564 1.966 3.566 . 0 0 "[ . 1 . 2]" 1
506 1 98 LEU MD1 1 99 SER H 5.180 . 5.960 2.899 2.412 4.833 . 0 0 "[ . 1 . 2]" 1
507 1 98 LEU H 1 98 LEU MD1 4.410 . 5.070 4.153 2.299 4.430 . 0 0 "[ . 1 . 2]" 1
508 1 22 PHE QD 1 98 LEU MD1 4.210 . 4.840 3.678 2.153 4.281 . 0 0 "[ . 1 . 2]" 1
509 1 22 PHE QE 1 98 LEU MD1 4.460 . 5.130 3.208 2.565 3.855 . 0 0 "[ . 1 . 2]" 1
510 1 98 LEU HA 1 98 LEU MD1 4.330 . 4.980 2.292 2.146 3.019 . 0 0 "[ . 1 . 2]" 1
511 1 22 PHE HB2 1 98 LEU MD1 5.320 . 6.120 5.200 4.442 5.859 . 0 0 "[ . 1 . 2]" 1
512 1 98 LEU MD1 1 114 ILE HG12 4.650 . 5.350 2.048 1.815 2.823 . 0 0 "[ . 1 . 2]" 1
513 1 98 LEU MD1 1 114 ILE MD 4.340 . 4.990 3.040 2.803 3.338 . 0 0 "[ . 1 . 2]" 1
514 1 98 LEU MD1 1 114 ILE HG13 4.650 . 5.350 2.989 2.587 4.261 . 0 0 "[ . 1 . 2]" 1
515 1 98 LEU MD1 1 114 ILE MG 4.720 . 5.430 3.271 2.079 3.676 . 0 0 "[ . 1 . 2]" 1
516 1 53 PHE HZ 1 114 ILE MD 4.010 . 4.610 3.078 2.428 3.847 . 0 0 "[ . 1 . 2]" 1
517 1 53 PHE HE2 1 114 ILE MD 3.750 . 4.310 2.650 2.125 3.442 . 0 0 "[ . 1 . 2]" 1
518 1 53 PHE HD2 1 114 ILE MD 5.080 . 5.840 4.452 3.750 5.274 . 0 0 "[ . 1 . 2]" 1
519 1 22 PHE HZ 1 114 ILE MD 3.550 . 4.080 2.175 1.925 2.628 . 0 0 "[ . 1 . 2]" 1
520 1 22 PHE QE 1 114 ILE MD 3.470 . 3.990 2.235 2.021 2.619 . 0 0 "[ . 1 . 2]" 1
521 1 114 ILE HB 1 114 ILE MD 3.540 . 4.070 2.400 2.351 2.462 . 0 0 "[ . 1 . 2]" 1
522 1 10 ILE HG13 1 114 ILE MD 4.330 . 4.980 4.534 4.204 4.826 . 0 0 "[ . 1 . 2]" 1
523 1 10 ILE MD 1 114 ILE MD 3.740 . 4.300 3.668 3.362 4.223 . 0 0 "[ . 1 . 2]" 1
524 1 10 ILE MG 1 114 ILE MD 4.710 . 5.420 4.886 4.440 5.231 . 0 0 "[ . 1 . 2]" 1
525 1 114 ILE MD 1 156 ILE MG 5.040 . 5.800 5.487 5.324 5.749 . 0 0 "[ . 1 . 2]" 1
526 1 114 ILE MD 1 139 VAL MG2 3.130 . 3.600 2.624 2.170 2.999 . 0 0 "[ . 1 . 2]" 1
527 1 98 LEU MD2 1 114 ILE MD 4.340 . 4.990 4.122 2.955 4.807 . 0 0 "[ . 1 . 2]" 1
528 1 60 PHE HE1 1 122 LEU MD1 3.980 . 4.580 3.056 2.124 4.763 0.183 15 0 "[ . 1 . 2]" 1
529 1 122 LEU HA 1 122 LEU MD1 4.360 . 5.010 3.288 2.144 3.900 . 0 0 "[ . 1 . 2]" 1
530 1 61 MET ME 1 122 LEU MD1 4.200 . 4.830 3.948 1.893 4.910 0.080 19 0 "[ . 1 . 2]" 1
531 1 119 THR MG 1 122 LEU MD1 4.100 . 4.720 3.224 2.658 4.785 0.065 19 0 "[ . 1 . 2]" 1
532 1 19 ARG H 1 138 ILE MD 3.880 . 4.460 3.657 3.277 3.971 . 0 0 "[ . 1 . 2]" 1
533 1 18 GLY H 1 138 ILE MD 4.330 . 4.980 4.052 3.798 4.267 . 0 0 "[ . 1 . 2]" 1
534 1 17 LEU HA 1 138 ILE MD 4.490 . 5.160 4.794 4.425 5.184 0.024 17 0 "[ . 1 . 2]" 1
535 1 138 ILE HA 1 138 ILE MD 3.120 . 3.590 2.139 2.071 2.217 . 0 0 "[ . 1 . 2]" 1
536 1 138 ILE MD 1 141 ALA MB 3.630 . 4.170 3.334 3.084 3.728 . 0 0 "[ . 1 . 2]" 1
537 1 17 LEU HB3 1 138 ILE MD 4.180 . 4.810 4.213 3.570 4.606 . 0 0 "[ . 1 . 2]" 1
538 1 156 ILE H 1 156 ILE MD 4.150 . 4.770 3.716 3.594 3.889 . 0 0 "[ . 1 . 2]" 1
539 1 145 PHE QD 1 156 ILE MD 3.720 . 4.280 2.444 1.924 3.162 . 0 0 "[ . 1 . 2]" 1
540 1 145 PHE QE 1 156 ILE MD 4.920 . 5.660 4.174 3.624 4.947 . 0 0 "[ . 1 . 2]" 1
541 1 156 ILE HA 1 156 ILE MD 3.610 . 4.150 3.877 3.834 3.915 . 0 0 "[ . 1 . 2]" 1
542 1 145 PHE HA 1 156 ILE MD 4.640 . 5.340 4.605 4.263 5.156 . 0 0 "[ . 1 . 2]" 1
543 1 152 THR HB 1 156 ILE MD 4.250 . 4.890 3.931 3.024 4.777 . 0 0 "[ . 1 . 2]" 1
544 1 12 VAL HA 1 156 ILE MD 3.830 . 4.400 4.220 3.950 4.512 0.112 1 0 "[ . 1 . 2]" 1
545 1 142 MET HA 1 156 ILE MD 4.090 . 4.700 2.823 2.145 3.563 . 0 0 "[ . 1 . 2]" 1
546 1 145 PHE HB2 1 156 ILE MD 3.850 . 4.430 1.955 1.758 2.523 0.042 8 0 "[ . 1 . 2]" 1
547 1 145 PHE HB3 1 156 ILE MD 3.850 . 4.430 2.897 2.384 3.352 . 0 0 "[ . 1 . 2]" 1
548 1 56 ILE HB 1 156 ILE MD 5.160 . 5.930 4.269 3.836 4.600 . 0 0 "[ . 1 . 2]" 1
549 1 152 THR MG 1 156 ILE MD 3.650 . 4.200 3.128 2.202 3.654 . 0 0 "[ . 1 . 2]" 1
550 1 156 ILE MD 1 156 ILE MG 3.270 . 3.760 2.030 1.963 2.069 . 0 0 "[ . 1 . 2]" 1
551 1 8 PHE HZ 1 158 ILE MD 3.760 . 4.320 3.884 3.532 4.166 . 0 0 "[ . 1 . 2]" 1
552 1 158 ILE HA 1 158 ILE MD 4.010 . 4.610 3.864 3.804 3.902 . 0 0 "[ . 1 . 2]" 1
553 1 10 ILE MD 1 158 ILE MD 5.150 . 5.920 3.601 2.846 4.237 . 0 0 "[ . 1 . 2]" 1
554 1 158 ILE MD 1 158 ILE MG 3.060 . 3.520 2.010 1.968 2.043 . 0 0 "[ . 1 . 2]" 1
555 1 7 PHE HD1 1 164 LEU MD1 4.360 . 5.010 2.980 2.568 3.671 . 0 0 "[ . 1 . 2]" 1
556 1 164 LEU HA 1 164 LEU MD1 4.200 . 4.830 3.941 3.893 4.003 . 0 0 "[ . 1 . 2]" 1
557 1 7 PHE HB2 1 164 LEU MD1 4.340 . 4.990 3.012 2.784 3.640 . 0 0 "[ . 1 . 2]" 1
558 1 164 LEU QB 1 164 LEU MD1 2.770 . 3.190 2.147 2.137 2.161 . 0 0 "[ . 1 . 2]" 1
559 1 5 THR MG 1 164 LEU MD1 4.330 . 4.980 3.142 2.129 4.410 . 0 0 "[ . 1 . 2]" 1
560 1 24 LEU MD2 1 33 ALA HA 4.550 . 5.230 3.361 2.438 3.836 . 0 0 "[ . 1 . 2]" 1
561 1 24 LEU MD2 1 36 PHE HB2 6.140 . 7.060 4.517 4.000 5.271 . 0 0 "[ . 1 . 2]" 1
562 1 6 VAL HB 1 24 LEU MD2 5.060 . 5.820 4.397 3.646 4.908 . 0 0 "[ . 1 . 2]" 1
563 1 24 LEU MD2 1 33 ALA MB 3.880 . 4.460 3.399 2.839 3.764 . 0 0 "[ . 1 . 2]" 1
564 1 39 LEU MD2 1 46 PHE HE2 3.510 . 4.040 3.237 2.904 3.583 . 0 0 "[ . 1 . 2]" 1
565 1 39 LEU HA 1 39 LEU MD2 3.480 . 4.000 2.087 1.982 2.135 . 0 0 "[ . 1 . 2]" 1
566 1 38 ALA MB 1 39 LEU MD2 4.350 . 5.000 3.824 3.516 4.127 . 0 0 "[ . 1 . 2]" 1
567 1 39 LEU MD2 1 78 ILE MG 3.320 . 3.820 2.162 2.038 2.475 . 0 0 "[ . 1 . 2]" 1
568 1 90 LEU MD2 1 91 LYS H 4.010 . 4.610 3.659 3.182 3.939 . 0 0 "[ . 1 . 2]" 1
569 1 25 PHE QD 1 90 LEU MD2 4.580 . 5.270 3.439 2.990 3.985 . 0 0 "[ . 1 . 2]" 1
570 1 90 LEU HA 1 90 LEU MD2 2.960 . 3.400 2.113 1.982 2.200 . 0 0 "[ . 1 . 2]" 1
571 1 28 LYS HB2 1 90 LEU MD2 3.690 . 4.240 3.664 3.161 4.085 . 0 0 "[ . 1 . 2]" 1
572 1 89 ILE HB 1 90 LEU MD2 3.860 . 4.440 3.983 3.597 4.471 0.031 6 0 "[ . 1 . 2]" 1
573 1 29 VAL MG2 1 90 LEU MD2 5.100 . 5.870 4.268 4.044 4.534 . 0 0 "[ . 1 . 2]" 1
574 1 22 PHE QD 1 98 LEU MD2 4.210 . 4.840 2.778 2.629 2.984 . 0 0 "[ . 1 . 2]" 1
575 1 22 PHE QE 1 98 LEU MD2 4.460 . 5.130 3.387 3.098 3.618 . 0 0 "[ . 1 . 2]" 1
576 1 98 LEU HA 1 98 LEU MD2 4.330 . 4.980 3.952 3.745 3.991 . 0 0 "[ . 1 . 2]" 1
577 1 22 PHE HB2 1 98 LEU MD2 5.320 . 6.120 3.062 2.646 3.567 . 0 0 "[ . 1 . 2]" 1
578 1 98 LEU MD2 1 114 ILE HG12 4.650 . 5.350 3.809 2.809 4.332 . 0 0 "[ . 1 . 2]" 1
579 1 98 LEU MD2 1 114 ILE HG13 4.650 . 5.350 4.962 3.949 5.361 0.011 1 0 "[ . 1 . 2]" 1
580 1 98 LEU MD2 1 114 ILE MG 4.720 . 5.430 4.421 3.763 4.934 . 0 0 "[ . 1 . 2]" 1
581 1 60 PHE HE1 1 122 LEU MD2 3.980 . 4.580 3.375 1.935 4.067 . 0 0 "[ . 1 . 2]" 1
582 1 122 LEU HA 1 122 LEU MD2 4.360 . 5.010 2.602 2.064 3.884 . 0 0 "[ . 1 . 2]" 1
583 1 164 LEU H 1 164 LEU MD2 3.980 . 4.580 3.426 3.129 3.710 . 0 0 "[ . 1 . 2]" 1
584 1 7 PHE HD1 1 164 LEU MD2 4.360 . 5.010 4.580 3.380 5.163 0.153 14 0 "[ . 1 . 2]" 1
585 1 164 LEU HA 1 164 LEU MD2 4.200 . 4.830 2.132 2.037 2.262 . 0 0 "[ . 1 . 2]" 1
586 1 7 PHE HB2 1 164 LEU MD2 4.340 . 4.990 3.664 2.790 4.161 . 0 0 "[ . 1 . 2]" 1
587 1 7 PHE HB3 1 164 LEU MD2 4.340 . 4.990 3.774 3.230 4.210 . 0 0 "[ . 1 . 2]" 1
588 1 164 LEU QB 1 164 LEU MD2 2.770 . 3.190 2.393 2.358 2.448 . 0 0 "[ . 1 . 2]" 1
589 1 15 GLU HA 1 16 PRO HD3 3.190 . 3.670 2.477 2.068 2.782 . 0 0 "[ . 1 . 2]" 1
590 1 29 VAL HA 1 30 PRO HD2 3.840 . 4.420 2.339 2.034 2.795 . 0 0 "[ . 1 . 2]" 1
591 1 57 ILE HA 1 58 PRO HD3 3.910 . 4.500 2.325 1.962 2.641 . 0 0 "[ . 1 . 2]" 1
592 1 82 LYS HD3 1 107 THR HA 3.910 . 4.500 3.085 1.850 3.352 . 0 0 "[ . 1 . 2]" 1
593 1 82 LYS HD3 1 107 THR MG 4.050 . 4.660 3.095 2.256 3.815 . 0 0 "[ . 1 . 2]" 1
594 1 104 GLY HA2 1 105 PRO HD2 3.920 . 4.510 3.470 3.212 3.847 . 0 0 "[ . 1 . 2]" 1
595 1 104 GLY HA3 1 105 PRO HD2 3.920 . 4.510 2.694 2.495 2.880 . 0 0 "[ . 1 . 2]" 1
596 1 15 GLU HA 1 16 PRO HD2 3.380 . 3.890 2.179 1.954 2.510 . 0 0 "[ . 1 . 2]" 1
597 1 29 VAL HA 1 30 PRO HD3 3.840 . 4.420 2.821 2.257 3.329 . 0 0 "[ . 1 . 2]" 1
598 1 55 ARG HB2 1 55 ARG HD3 4.090 . 4.700 3.244 3.057 3.374 . 0 0 "[ . 1 . 2]" 1
599 1 55 ARG HB3 1 55 ARG HD3 4.170 . 4.800 2.582 2.478 2.678 . 0 0 "[ . 1 . 2]" 1
600 1 57 ILE MG 1 58 PRO HD2 4.200 . 4.830 2.596 2.286 3.032 . 0 0 "[ . 1 . 2]" 1
601 1 69 ARG HA 1 69 ARG HD3 4.660 . 5.360 4.607 4.260 4.880 . 0 0 "[ . 1 . 2]" 1
602 1 131 LYS QE 1 133 LYS HB3 3.980 . 4.580 3.470 2.513 4.225 . 0 0 "[ . 1 . 2]" 1
603 1 104 GLY HA2 1 105 PRO HD3 3.920 . 4.510 2.462 2.266 2.769 . 0 0 "[ . 1 . 2]" 1
604 1 104 GLY HA3 1 105 PRO HD3 3.920 . 4.510 2.685 2.310 3.039 . 0 0 "[ . 1 . 2]" 1
605 1 38 ALA MB 1 44 LYS HE2 4.200 . 4.830 3.982 2.152 4.911 0.081 8 0 "[ . 1 . 2]" 1
606 1 44 LYS HE2 1 78 ILE MG 5.070 . 5.830 4.130 3.529 5.373 . 0 0 "[ . 1 . 2]" 1
607 1 49 LYS HE2 1 160 ASP HA 4.090 . 4.700 2.587 1.783 4.272 0.017 2 0 "[ . 1 . 2]" 1
608 1 44 LYS HE3 1 78 ILE MG 5.070 . 5.830 4.239 2.382 5.124 . 0 0 "[ . 1 . 2]" 1
609 1 49 LYS HE3 1 160 ASP HA 4.090 . 4.700 3.102 1.742 4.050 0.058 7 0 "[ . 1 . 2]" 1
610 1 118 LYS HB3 1 118 LYS QE 4.310 . 4.960 3.219 2.993 3.508 . 0 0 "[ . 1 . 2]" 1
611 1 131 LYS QE 1 131 LYS HG2 3.710 . 4.270 2.438 2.389 2.489 . 0 0 "[ . 1 . 2]" 1
612 1 131 LYS QE 1 133 LYS HG2 5.070 . 5.830 5.382 4.646 5.915 0.085 16 0 "[ . 1 . 2]" 1
613 1 133 LYS QE 1 133 LYS HG3 3.740 . 4.300 2.517 2.444 3.037 . 0 0 "[ . 1 . 2]" 1
614 1 82 LYS QE 1 82 LYS HG3 3.300 . 3.800 2.902 2.469 3.546 . 0 0 "[ . 1 . 2]" 1
615 1 82 LYS QE 1 82 LYS HG2 3.560 . 4.090 2.758 2.504 3.172 . 0 0 "[ . 1 . 2]" 1
616 1 73 THR MG 1 82 LYS QE 5.130 . 5.900 5.807 4.659 6.052 0.152 12 0 "[ . 1 . 2]" 1
617 1 82 LYS QE 1 107 THR MG 3.620 . 4.160 2.768 2.069 3.520 . 0 0 "[ . 1 . 2]" 1
618 1 125 LYS QE 1 125 LYS QG 3.230 . 3.710 2.561 2.317 2.904 . 0 0 "[ . 1 . 2]" 1
619 1 118 LYS QE 1 120 GLU HB2 4.870 . 5.600 4.334 3.391 5.565 . 0 0 "[ . 1 . 2]" 1
620 1 131 LYS QE 1 131 LYS HG3 3.560 . 4.090 3.357 3.346 3.366 . 0 0 "[ . 1 . 2]" 1
621 1 131 LYS QB 1 131 LYS QE 3.220 . 3.700 1.920 1.841 1.998 . 0 0 "[ . 1 . 2]" 1
622 1 133 LYS QE 1 134 GLU H 5.180 . 5.960 4.790 4.493 5.230 . 0 0 "[ . 1 . 2]" 1
623 1 133 LYS QE 1 134 GLU QG 4.220 . 4.850 3.240 2.458 4.540 . 0 0 "[ . 1 . 2]" 1
624 1 133 LYS QE 1 133 LYS HG2 3.350 . 3.850 3.413 3.359 3.550 . 0 0 "[ . 1 . 2]" 1
625 1 5 THR MG 1 133 LYS QE 3.680 . 4.230 3.277 2.420 3.932 . 0 0 "[ . 1 . 2]" 1
626 1 10 ILE HA 1 160 ASP H 4.930 . 5.670 5.266 4.592 5.650 . 0 0 "[ . 1 . 2]" 1
627 1 15 GLU HA 1 15 GLU HG3 4.190 . 4.820 3.806 3.764 3.870 . 0 0 "[ . 1 . 2]" 1
628 1 15 GLU HG3 1 16 PRO HD2 4.670 . 5.370 5.269 4.858 5.522 0.152 9 0 "[ . 1 . 2]" 1
629 1 15 GLU H 1 15 GLU HG2 3.930 . 4.520 2.477 2.214 2.788 . 0 0 "[ . 1 . 2]" 1
630 1 15 GLU HA 1 15 GLU HG2 4.190 . 4.820 3.205 2.982 3.358 . 0 0 "[ . 1 . 2]" 1
631 1 15 GLU HG2 1 16 PRO HD2 4.670 . 5.370 5.176 4.835 5.530 0.160 9 0 "[ . 1 . 2]" 1
632 1 84 GLU H 1 84 GLU HG3 4.370 . 5.030 3.224 3.034 3.837 . 0 0 "[ . 1 . 2]" 1
633 1 100 MET ME 1 109 GLY H 4.170 . 4.800 3.740 3.183 4.203 . 0 0 "[ . 1 . 2]" 1
634 1 100 MET ME 1 111 GLN H 3.820 . 4.390 3.638 3.154 4.292 . 0 0 "[ . 1 . 2]" 1
635 1 100 MET ME 1 101 ALA H 4.700 . 5.400 4.089 3.862 4.611 . 0 0 "[ . 1 . 2]" 1
636 1 83 PHE HZ 1 100 MET ME 4.280 . 4.920 4.765 3.883 5.033 0.113 7 0 "[ . 1 . 2]" 1
637 1 100 MET ME 1 112 PHE HA 4.250 . 4.890 4.184 3.793 4.856 . 0 0 "[ . 1 . 2]" 1
638 1 100 MET HA 1 100 MET ME 4.070 . 4.680 3.828 3.540 4.448 . 0 0 "[ . 1 . 2]" 1
639 1 96 GLY H 1 136 MET ME 3.480 . 4.000 2.639 2.283 3.292 . 0 0 "[ . 1 . 2]" 1
640 1 136 MET ME 1 141 ALA H 5.400 . 6.210 6.025 5.470 6.346 0.136 3 0 "[ . 1 . 2]" 1
641 1 136 MET ME 1 139 VAL H 4.910 . 5.650 5.016 3.820 5.659 0.009 4 0 "[ . 1 . 2]" 1
642 1 96 GLY HA2 1 136 MET ME 3.850 . 4.430 2.629 2.184 2.946 . 0 0 "[ . 1 . 2]" 1
643 1 116 THR HB 1 136 MET ME 3.650 . 4.200 3.128 2.328 4.098 . 0 0 "[ . 1 . 2]" 1
644 1 136 MET HA 1 136 MET ME 3.780 . 4.350 3.569 2.067 4.182 . 0 0 "[ . 1 . 2]" 1
645 1 116 THR HA 1 136 MET ME 3.370 . 3.880 2.200 1.753 3.360 0.047 4 0 "[ . 1 . 2]" 1
646 1 95 PRO HA 1 136 MET ME 4.350 . 5.000 3.922 3.202 4.962 . 0 0 "[ . 1 . 2]" 1
647 1 96 GLY HA3 1 136 MET ME 3.930 . 4.520 3.131 2.737 3.385 . 0 0 "[ . 1 . 2]" 1
648 1 136 MET ME 1 136 MET HG2 3.260 . 3.750 2.782 2.525 3.377 . 0 0 "[ . 1 . 2]" 1
649 1 136 MET ME 1 136 MET HG3 3.060 . 3.520 2.436 2.373 2.505 . 0 0 "[ . 1 . 2]" 1
650 1 136 MET ME 1 139 VAL HB 4.160 . 4.780 3.241 2.018 3.935 . 0 0 "[ . 1 . 2]" 1
651 1 136 MET ME 1 140 GLU HG3 3.960 . 4.550 2.285 1.973 2.544 . 0 0 "[ . 1 . 2]" 1
652 1 116 THR MG 1 136 MET ME 3.090 . 3.550 2.942 2.265 3.476 . 0 0 "[ . 1 . 2]" 1
653 1 73 THR HA 1 75 GLY H 4.900 . 5.640 5.034 4.423 5.497 . 0 0 "[ . 1 . 2]" 1
654 1 68 THR MG 1 69 ARG HA 4.600 . 5.290 4.394 3.531 5.365 0.075 6 0 "[ . 1 . 2]" 1
655 1 68 THR MG 1 69 ARG QB 4.170 . 4.800 3.158 2.826 3.739 . 0 0 "[ . 1 . 2]" 1
656 1 82 LYS HG2 1 107 THR HA 4.470 . 5.140 4.378 4.102 4.860 . 0 0 "[ . 1 . 2]" 1
657 1 121 TRP HE1 1 122 LEU MD1 3.870 . 4.450 3.619 2.541 4.621 0.171 19 0 "[ . 1 . 2]" 1
658 1 121 TRP HE1 1 122 LEU MD2 3.870 . 4.450 3.338 2.612 4.628 0.178 6 0 "[ . 1 . 2]" 1
659 1 23 GLU H 1 23 GLU HB3 3.660 . 4.210 2.622 2.392 2.844 . 0 0 "[ . 1 . 2]" 1
660 1 23 GLU H 1 133 LYS HB3 4.740 . 5.450 3.948 3.168 4.804 . 0 0 "[ . 1 . 2]" 1
661 1 33 ALA H 1 33 ALA MB 3.010 . 3.460 2.269 2.237 2.326 . 0 0 "[ . 1 . 2]" 1
662 1 32 THR H 1 33 ALA H 3.640 . 4.190 2.556 2.417 2.684 . 0 0 "[ . 1 . 2]" 1
663 1 6 VAL H 1 164 LEU H 4.360 . 5.010 4.928 4.459 5.164 0.154 14 0 "[ . 1 . 2]" 1
664 1 164 LEU H 1 165 GLU H 4.080 . 4.690 4.287 4.136 4.485 . 0 0 "[ . 1 . 2]" 1
665 1 6 VAL HA 1 164 LEU H 3.630 . 4.170 3.326 3.009 3.537 . 0 0 "[ . 1 . 2]" 1
666 1 163 GLN HA 1 164 LEU H 3.310 . 3.810 2.178 2.115 2.322 . 0 0 "[ . 1 . 2]" 1
667 1 163 GLN QB 1 164 LEU H 4.350 . 5.000 3.327 2.452 3.972 . 0 0 "[ . 1 . 2]" 1
668 1 164 LEU H 1 164 LEU QB 3.300 . 3.800 2.453 2.377 2.529 . 0 0 "[ . 1 . 2]" 1
669 1 6 VAL QG 1 164 LEU H 4.660 . 5.360 4.569 4.328 4.813 . 0 0 "[ . 1 . 2]" 1
670 1 5 THR H 1 165 GLU H 5.150 . 5.920 5.364 4.646 5.791 . 0 0 "[ . 1 . 2]" 1
671 1 4 PRO HA 1 5 THR H 3.030 . 3.480 2.191 2.117 2.318 . 0 0 "[ . 1 . 2]" 1
672 1 5 THR H 1 5 THR HB 3.590 . 4.130 2.457 2.316 2.634 . 0 0 "[ . 1 . 2]" 1
673 1 4 PRO HB3 1 5 THR H 4.120 . 4.740 3.980 3.539 4.219 . 0 0 "[ . 1 . 2]" 1
674 1 4 PRO HB2 1 5 THR H 3.970 . 4.570 3.519 3.103 3.830 . 0 0 "[ . 1 . 2]" 1
675 1 5 THR H 1 164 LEU QB 4.710 . 5.420 4.665 3.765 5.575 0.155 9 0 "[ . 1 . 2]" 1
676 1 5 THR H 1 5 THR MG 4.150 . 4.770 3.801 3.711 3.886 . 0 0 "[ . 1 . 2]" 1
677 1 5 THR HA 1 6 VAL H 3.080 . 3.540 2.200 2.156 2.256 . 0 0 "[ . 1 . 2]" 1
678 1 5 THR HB 1 6 VAL H 4.290 . 4.930 4.291 4.069 4.481 . 0 0 "[ . 1 . 2]" 1
679 1 6 VAL H 1 6 VAL HB 4.030 . 4.630 3.364 2.607 3.818 . 0 0 "[ . 1 . 2]" 1
680 1 20 VAL HB 1 21 SER H 4.280 . 4.920 4.134 3.951 4.364 . 0 0 "[ . 1 . 2]" 1
681 1 6 VAL H 1 164 LEU QB 4.990 . 5.740 5.541 5.041 5.884 0.144 10 0 "[ . 1 . 2]" 1
682 1 20 VAL MG1 1 21 SER H 4.360 . 5.010 2.619 2.364 3.020 . 0 0 "[ . 1 . 2]" 1
683 1 7 PHE H 1 164 LEU H 4.280 . 4.920 3.187 2.869 3.520 . 0 0 "[ . 1 . 2]" 1
684 1 7 PHE H 1 7 PHE HD1 4.410 . 5.070 5.072 4.855 5.154 0.084 19 0 "[ . 1 . 2]" 1
685 1 6 VAL HA 1 7 PHE H 3.280 . 3.770 2.181 2.057 2.324 . 0 0 "[ . 1 . 2]" 1
686 1 7 PHE H 1 164 LEU QB 4.530 . 5.210 5.113 4.818 5.336 0.126 20 0 "[ . 1 . 2]" 1
687 1 7 PHE HA 1 8 PHE H 3.350 . 3.850 2.143 2.099 2.199 . 0 0 "[ . 1 . 2]" 1
688 1 8 PHE H 1 21 SER HA 3.810 . 4.380 3.392 2.994 3.819 . 0 0 "[ . 1 . 2]" 1
689 1 8 PHE H 1 8 PHE HB2 4.140 . 4.760 2.822 2.712 2.912 . 0 0 "[ . 1 . 2]" 1
690 1 8 PHE H 1 8 PHE HB3 4.140 . 4.760 3.881 3.821 3.932 . 0 0 "[ . 1 . 2]" 1
691 1 8 PHE H 1 20 VAL HB 5.410 . 6.220 4.157 3.866 4.571 . 0 0 "[ . 1 . 2]" 1
692 1 9 ASP H 1 10 ILE H 4.250 . 4.890 4.195 4.104 4.295 . 0 0 "[ . 1 . 2]" 1
693 1 7 PHE HD2 1 9 ASP H 5.300 . 6.100 5.332 4.908 6.160 0.060 3 0 "[ . 1 . 2]" 1
694 1 8 PHE HA 1 9 ASP H 3.390 . 3.900 2.307 2.238 2.354 . 0 0 "[ . 1 . 2]" 1
695 1 9 ASP H 1 161 CYS HA 4.310 . 4.960 3.874 3.531 4.198 . 0 0 "[ . 1 . 2]" 1
696 1 8 PHE HB2 1 9 ASP H 4.430 . 5.090 3.573 3.491 3.675 . 0 0 "[ . 1 . 2]" 1
697 1 8 PHE HB3 1 9 ASP H 4.430 . 5.090 2.439 2.373 2.555 . 0 0 "[ . 1 . 2]" 1
698 1 9 ASP H 1 9 ASP HB2 3.800 . 4.370 2.518 2.398 2.596 . 0 0 "[ . 1 . 2]" 1
699 1 9 ASP H 1 9 ASP HB3 3.800 . 4.370 3.703 3.628 3.754 . 0 0 "[ . 1 . 2]" 1
700 1 9 ASP H 1 158 ILE MG 3.980 . 4.580 2.936 2.611 3.287 . 0 0 "[ . 1 . 2]" 1
701 1 9 ASP HA 1 10 ILE H 3.130 . 3.600 2.154 2.121 2.199 . 0 0 "[ . 1 . 2]" 1
702 1 131 LYS HA 1 132 VAL H 3.210 . 3.690 2.228 2.176 2.296 . 0 0 "[ . 1 . 2]" 1
703 1 96 GLY HA2 1 132 VAL H 4.120 . 4.740 3.902 3.409 4.315 . 0 0 "[ . 1 . 2]" 1
704 1 97 ILE HA 1 132 VAL H 4.380 . 5.040 4.245 3.960 4.510 . 0 0 "[ . 1 . 2]" 1
705 1 96 GLY HA3 1 132 VAL H 4.290 . 4.930 3.190 2.546 3.770 . 0 0 "[ . 1 . 2]" 1
706 1 9 ASP HB2 1 10 ILE H 4.720 . 5.430 4.425 4.316 4.538 . 0 0 "[ . 1 . 2]" 1
707 1 9 ASP HB3 1 10 ILE H 4.720 . 5.430 3.660 3.466 3.832 . 0 0 "[ . 1 . 2]" 1
708 1 10 ILE H 1 10 ILE HB 3.440 . 3.960 2.490 2.422 2.622 . 0 0 "[ . 1 . 2]" 1
709 1 132 VAL H 1 132 VAL HB 3.280 . 3.770 2.672 2.559 2.813 . 0 0 "[ . 1 . 2]" 1
710 1 10 ILE H 1 10 ILE HG12 3.230 . 3.710 2.442 2.369 2.498 . 0 0 "[ . 1 . 2]" 1
711 1 10 ILE H 1 10 ILE HG13 3.900 . 4.490 3.843 3.781 3.896 . 0 0 "[ . 1 . 2]" 1
712 1 131 LYS HG2 1 132 VAL H 4.320 . 4.970 2.870 2.344 3.284 . 0 0 "[ . 1 . 2]" 1
713 1 10 ILE H 1 10 ILE MD 3.380 . 3.890 3.402 3.271 3.482 . 0 0 "[ . 1 . 2]" 1
714 1 131 LYS HG3 1 132 VAL H 3.670 . 4.220 3.436 3.136 3.803 . 0 0 "[ . 1 . 2]" 1
715 1 114 ILE MG 1 132 VAL H 5.210 . 5.990 3.867 3.384 4.213 . 0 0 "[ . 1 . 2]" 1
716 1 10 ILE H 1 138 ILE MG 4.270 . 4.910 3.740 3.377 4.096 . 0 0 "[ . 1 . 2]" 1
717 1 11 ALA H 1 157 THR HA 5.210 . 5.990 4.974 4.778 5.171 . 0 0 "[ . 1 . 2]" 1
718 1 10 ILE HA 1 11 ALA H 3.090 . 3.550 2.201 2.139 2.335 . 0 0 "[ . 1 . 2]" 1
719 1 11 ALA H 1 158 ILE HA 4.350 . 5.000 3.680 3.388 4.100 . 0 0 "[ . 1 . 2]" 1
720 1 11 ALA H 1 11 ALA MB 3.300 . 3.800 2.484 2.364 2.592 . 0 0 "[ . 1 . 2]" 1
721 1 10 ILE MG 1 11 ALA H 3.180 . 3.660 2.701 2.222 3.135 . 0 0 "[ . 1 . 2]" 1
722 1 12 VAL H 1 17 LEU H 3.980 . 4.580 2.980 2.715 3.297 . 0 0 "[ . 1 . 2]" 1
723 1 12 VAL H 1 14 GLY H 4.360 . 5.010 4.128 3.887 4.359 . 0 0 "[ . 1 . 2]" 1
724 1 12 VAL H 1 15 GLU H 3.770 . 4.340 3.745 3.358 4.010 . 0 0 "[ . 1 . 2]" 1
725 1 11 ALA HA 1 12 VAL H 3.060 . 3.520 2.153 2.102 2.212 . 0 0 "[ . 1 . 2]" 1
726 1 12 VAL H 1 12 VAL HB 3.700 . 4.260 2.548 2.388 3.659 . 0 0 "[ . 1 . 2]" 1
727 1 11 ALA MB 1 12 VAL H 3.130 . 3.600 3.108 2.909 3.381 . 0 0 "[ . 1 . 2]" 1
728 1 10 ILE MG 1 12 VAL H 5.350 . 6.150 4.411 3.914 4.914 . 0 0 "[ . 1 . 2]" 1
729 1 12 VAL H 1 13 ASP H 4.640 . 5.340 4.336 4.118 4.506 . 0 0 "[ . 1 . 2]" 1
730 1 13 ASP H 1 155 LYS H 4.160 . 4.780 3.582 2.967 4.422 . 0 0 "[ . 1 . 2]" 1
731 1 13 ASP H 1 15 GLU H 4.410 . 5.070 4.245 4.084 4.542 . 0 0 "[ . 1 . 2]" 1
732 1 13 ASP H 1 156 ILE HA 4.320 . 4.970 3.114 2.598 3.730 . 0 0 "[ . 1 . 2]" 1
733 1 12 VAL HA 1 13 ASP H 3.200 . 3.680 2.157 2.106 2.261 . 0 0 "[ . 1 . 2]" 1
734 1 13 ASP H 1 155 LYS QB 4.130 . 4.750 3.519 3.056 3.941 . 0 0 "[ . 1 . 2]" 1
735 1 12 VAL MG1 1 13 ASP H 4.570 . 5.260 3.057 2.502 3.958 . 0 0 "[ . 1 . 2]" 1
736 1 13 ASP H 1 14 GLY H 3.840 . 4.420 2.663 2.524 2.756 . 0 0 "[ . 1 . 2]" 1
737 1 13 ASP HA 1 14 GLY H 3.410 . 3.920 2.956 2.760 3.072 . 0 0 "[ . 1 . 2]" 1
738 1 14 GLY H 1 15 GLU H 3.630 . 4.170 2.694 2.528 2.807 . 0 0 "[ . 1 . 2]" 1
739 1 11 ALA HA 1 15 GLU H 5.350 . 6.150 4.623 4.279 4.933 . 0 0 "[ . 1 . 2]" 1
740 1 15 GLU H 1 16 PRO HD3 5.080 . 5.840 4.772 4.401 5.092 . 0 0 "[ . 1 . 2]" 1
741 1 15 GLU H 1 16 PRO HD2 5.010 . 5.760 4.933 4.738 5.212 . 0 0 "[ . 1 . 2]" 1
742 1 15 GLU H 1 15 GLU HG3 3.930 . 4.520 3.853 3.711 4.064 . 0 0 "[ . 1 . 2]" 1
743 1 15 GLU H 1 15 GLU HB3 3.690 . 4.240 3.648 3.591 3.689 . 0 0 "[ . 1 . 2]" 1
744 1 15 GLU H 1 15 GLU HB2 3.110 . 3.580 2.514 2.388 2.609 . 0 0 "[ . 1 . 2]" 1
745 1 12 VAL HB 1 15 GLU H 5.020 . 5.770 4.686 4.225 5.172 . 0 0 "[ . 1 . 2]" 1
746 1 11 ALA MB 1 15 GLU H 3.830 . 4.400 3.215 2.990 3.459 . 0 0 "[ . 1 . 2]" 1
747 1 11 ALA HA 1 17 LEU H 3.440 . 3.960 1.996 1.801 2.254 . 0 0 "[ . 1 . 2]" 1
748 1 16 PRO HA 1 17 LEU H 3.130 . 3.600 2.162 2.132 2.223 . 0 0 "[ . 1 . 2]" 1
749 1 16 PRO HB2 1 17 LEU H 4.250 . 4.890 4.089 3.906 4.340 . 0 0 "[ . 1 . 2]" 1
750 1 10 ILE HB 1 17 LEU H 4.720 . 5.430 4.582 4.342 4.964 . 0 0 "[ . 1 . 2]" 1
751 1 16 PRO HB3 1 17 LEU H 4.250 . 4.890 4.164 3.984 4.346 . 0 0 "[ . 1 . 2]" 1
752 1 17 LEU H 1 17 LEU HB2 3.650 . 4.200 2.621 2.480 2.738 . 0 0 "[ . 1 . 2]" 1
753 1 17 LEU H 1 17 LEU HB3 3.780 . 4.350 2.455 2.391 2.535 . 0 0 "[ . 1 . 2]" 1
754 1 11 ALA MB 1 17 LEU H 3.820 . 4.390 3.545 3.074 3.847 . 0 0 "[ . 1 . 2]" 1
755 1 10 ILE MG 1 17 LEU H 4.810 . 5.530 4.083 3.667 4.776 . 0 0 "[ . 1 . 2]" 1
756 1 17 LEU H 1 138 ILE MG 4.950 . 5.690 4.648 4.385 5.052 . 0 0 "[ . 1 . 2]" 1
757 1 17 LEU H 1 18 GLY H 3.210 . 3.690 2.424 2.331 2.500 . 0 0 "[ . 1 . 2]" 1
758 1 10 ILE H 1 18 GLY H 4.050 . 4.660 3.683 3.541 3.825 . 0 0 "[ . 1 . 2]" 1
759 1 18 GLY H 1 19 ARG H 4.590 . 5.280 4.349 4.267 4.397 . 0 0 "[ . 1 . 2]" 1
760 1 11 ALA HA 1 18 GLY H 4.040 . 4.650 4.054 3.728 4.267 . 0 0 "[ . 1 . 2]" 1
761 1 16 PRO HA 1 18 GLY H 4.040 . 4.650 3.600 3.310 3.846 . 0 0 "[ . 1 . 2]" 1
762 1 10 ILE HB 1 18 GLY H 3.970 . 4.570 3.509 3.251 4.012 . 0 0 "[ . 1 . 2]" 1
763 1 17 LEU HB2 1 18 GLY H 3.970 . 4.570 3.883 3.763 3.990 . 0 0 "[ . 1 . 2]" 1
764 1 17 LEU HB3 1 18 GLY H 3.670 . 4.220 2.630 2.422 2.909 . 0 0 "[ . 1 . 2]" 1
765 1 11 ALA MB 1 18 GLY H 4.530 . 5.210 4.983 4.403 5.219 0.009 13 0 "[ . 1 . 2]" 1
766 1 18 GLY H 1 138 ILE MG 3.550 . 4.080 3.244 2.977 3.709 . 0 0 "[ . 1 . 2]" 1
767 1 19 ARG H 1 19 ARG HB3 4.030 . 4.630 3.445 2.869 3.782 . 0 0 "[ . 1 . 2]" 1
768 1 19 ARG H 1 138 ILE MG 4.110 . 4.730 3.725 2.986 4.559 . 0 0 "[ . 1 . 2]" 1
769 1 8 PHE H 1 20 VAL H 3.930 . 4.520 3.394 2.984 3.671 . 0 0 "[ . 1 . 2]" 1
770 1 10 ILE H 1 20 VAL H 4.420 . 5.080 3.681 3.401 3.986 . 0 0 "[ . 1 . 2]" 1
771 1 19 ARG HA 1 20 VAL H 3.290 . 3.780 2.203 2.144 2.266 . 0 0 "[ . 1 . 2]" 1
772 1 9 ASP HA 1 20 VAL H 3.980 . 4.580 3.306 2.901 3.913 . 0 0 "[ . 1 . 2]" 1
773 1 19 ARG HB2 1 20 VAL H 4.320 . 4.970 3.593 2.843 4.363 . 0 0 "[ . 1 . 2]" 1
774 1 20 VAL H 1 20 VAL HB 3.990 . 4.590 2.757 2.592 2.876 . 0 0 "[ . 1 . 2]" 1
775 1 19 ARG HB3 1 20 VAL H 4.320 . 4.970 3.666 2.985 4.195 . 0 0 "[ . 1 . 2]" 1
776 1 20 VAL H 1 20 VAL MG1 3.970 . 4.570 3.926 3.866 3.973 . 0 0 "[ . 1 . 2]" 1
777 1 20 VAL HA 1 21 SER H 3.090 . 3.550 2.186 2.129 2.262 . 0 0 "[ . 1 . 2]" 1
778 1 21 SER H 1 134 GLU HB2 4.440 . 5.110 2.966 2.165 4.458 . 0 0 "[ . 1 . 2]" 1
779 1 6 VAL H 1 22 PHE H 3.570 . 4.110 3.129 2.779 3.436 . 0 0 "[ . 1 . 2]" 1
780 1 22 PHE H 1 22 PHE QD 3.640 . 4.190 2.604 2.209 3.127 . 0 0 "[ . 1 . 2]" 1
781 1 7 PHE HA 1 22 PHE H 4.150 . 4.770 3.718 3.293 3.962 . 0 0 "[ . 1 . 2]" 1
782 1 5 THR HA 1 22 PHE H 5.320 . 6.120 4.664 4.228 5.094 . 0 0 "[ . 1 . 2]" 1
783 1 21 SER HA 1 22 PHE H 3.310 . 3.810 2.186 2.143 2.248 . 0 0 "[ . 1 . 2]" 1
784 1 21 SER HB2 1 22 PHE H 4.460 . 5.130 4.009 3.021 4.443 . 0 0 "[ . 1 . 2]" 1
785 1 21 SER HB3 1 22 PHE H 4.460 . 5.130 3.735 3.170 4.382 . 0 0 "[ . 1 . 2]" 1
786 1 22 PHE H 1 22 PHE HB2 4.140 . 4.760 2.635 2.536 2.731 . 0 0 "[ . 1 . 2]" 1
787 1 6 VAL HB 1 22 PHE H 4.200 . 4.830 4.097 2.657 4.845 0.015 19 0 "[ . 1 . 2]" 1
788 1 23 GLU H 1 133 LYS H 4.560 . 5.240 3.623 2.807 4.504 . 0 0 "[ . 1 . 2]" 1
789 1 22 PHE QD 1 23 GLU H 4.520 . 5.200 4.203 3.809 4.639 . 0 0 "[ . 1 . 2]" 1
790 1 22 PHE HA 1 23 GLU H 3.220 . 3.700 2.337 2.147 2.514 . 0 0 "[ . 1 . 2]" 1
791 1 23 GLU H 1 132 VAL HA 4.110 . 4.730 3.767 3.207 4.237 . 0 0 "[ . 1 . 2]" 1
792 1 22 PHE HB2 1 23 GLU H 4.030 . 4.630 3.715 3.243 4.289 . 0 0 "[ . 1 . 2]" 1
793 1 22 PHE HB3 1 23 GLU H 4.220 . 4.850 2.814 2.239 3.647 . 0 0 "[ . 1 . 2]" 1
794 1 23 GLU H 1 23 GLU HB2 3.480 . 4.000 2.895 2.496 3.216 . 0 0 "[ . 1 . 2]" 1
795 1 6 VAL H 1 24 LEU H 4.720 . 5.430 3.993 3.563 4.508 . 0 0 "[ . 1 . 2]" 1
796 1 23 GLU H 1 24 LEU H 4.970 . 5.720 4.174 3.956 4.426 . 0 0 "[ . 1 . 2]" 1
797 1 5 THR HA 1 24 LEU H 4.050 . 4.660 3.134 2.456 3.995 . 0 0 "[ . 1 . 2]" 1
798 1 23 GLU HA 1 24 LEU H 3.120 . 3.590 2.198 2.125 2.250 . 0 0 "[ . 1 . 2]" 1
799 1 4 PRO HD2 1 24 LEU H 4.710 . 5.420 4.212 3.084 4.952 . 0 0 "[ . 1 . 2]" 1
800 1 4 PRO HG2 1 24 LEU H 3.910 . 4.500 3.807 3.161 4.534 0.034 14 0 "[ . 1 . 2]" 1
801 1 24 LEU H 1 24 LEU HB2 4.150 . 4.770 2.602 2.507 2.671 . 0 0 "[ . 1 . 2]" 1
802 1 23 GLU HG3 1 24 LEU H 3.700 . 4.260 3.698 3.375 3.965 . 0 0 "[ . 1 . 2]" 1
803 1 4 PRO HB2 1 24 LEU H 4.130 . 4.750 4.694 4.142 4.844 0.094 3 0 "[ . 1 . 2]" 1
804 1 24 LEU H 1 24 LEU HB3 4.150 . 4.770 3.675 3.632 3.706 . 0 0 "[ . 1 . 2]" 1
805 1 24 LEU H 1 24 LEU MD1 4.060 . 4.670 3.918 3.779 4.042 . 0 0 "[ . 1 . 2]" 1
806 1 24 LEU H 1 24 LEU MD2 4.060 . 4.670 3.110 2.924 3.340 . 0 0 "[ . 1 . 2]" 1
807 1 25 PHE H 1 26 ALA H 4.200 . 4.830 3.676 3.508 3.859 . 0 0 "[ . 1 . 2]" 1
808 1 25 PHE H 1 25 PHE QD 4.310 . 4.960 2.357 2.028 2.782 . 0 0 "[ . 1 . 2]" 1
809 1 24 LEU HA 1 25 PHE H 3.300 . 3.800 2.159 2.115 2.214 . 0 0 "[ . 1 . 2]" 1
810 1 25 PHE H 1 25 PHE HB2 3.870 . 4.450 2.537 2.481 2.601 . 0 0 "[ . 1 . 2]" 1
811 1 25 PHE H 1 130 GLY HA2 4.370 . 5.030 3.139 2.761 3.579 . 0 0 "[ . 1 . 2]" 1
812 1 25 PHE H 1 130 GLY HA3 4.370 . 5.030 4.571 3.862 5.109 0.079 19 0 "[ . 1 . 2]" 1
813 1 25 PHE H 1 25 PHE HB3 3.870 . 4.450 3.639 3.620 3.654 . 0 0 "[ . 1 . 2]" 1
814 1 24 LEU HB2 1 25 PHE H 4.440 . 5.110 4.179 4.061 4.306 . 0 0 "[ . 1 . 2]" 1
815 1 25 PHE H 1 33 ALA MB 4.310 . 4.960 3.513 3.127 3.879 . 0 0 "[ . 1 . 2]" 1
816 1 24 LEU HB3 1 25 PHE H 4.440 . 5.110 3.371 3.177 3.535 . 0 0 "[ . 1 . 2]" 1
817 1 25 PHE QD 1 26 ALA H 5.420 . 6.230 4.966 4.805 5.038 . 0 0 "[ . 1 . 2]" 1
818 1 25 PHE HA 1 26 ALA H 3.190 . 3.670 2.442 2.391 2.537 . 0 0 "[ . 1 . 2]" 1
819 1 4 PRO HD2 1 26 ALA H 4.000 . 4.600 2.617 2.321 3.034 . 0 0 "[ . 1 . 2]" 1
820 1 25 PHE HB2 1 26 ALA H 4.760 . 5.470 4.472 4.430 4.507 . 0 0 "[ . 1 . 2]" 1
821 1 25 PHE HB3 1 26 ALA H 4.760 . 5.470 4.345 4.270 4.430 . 0 0 "[ . 1 . 2]" 1
822 1 26 ALA H 1 26 ALA MB 2.950 . 3.390 2.254 2.227 2.285 . 0 0 "[ . 1 . 2]" 1
823 1 26 ALA H 1 33 ALA MB 3.700 . 4.260 3.409 3.174 3.697 . 0 0 "[ . 1 . 2]" 1
824 1 26 ALA H 1 27 ASP H 3.270 . 3.760 2.636 2.517 2.732 . 0 0 "[ . 1 . 2]" 1
825 1 27 ASP H 1 28 LYS H 3.200 . 3.680 2.501 2.285 2.724 . 0 0 "[ . 1 . 2]" 1
826 1 25 PHE HA 1 27 ASP H 3.710 . 4.270 3.221 3.028 3.517 . 0 0 "[ . 1 . 2]" 1
827 1 26 ALA MB 1 27 ASP H 3.420 . 3.930 3.036 2.689 3.340 . 0 0 "[ . 1 . 2]" 1
828 1 26 ALA H 1 28 LYS H 4.220 . 4.850 4.250 4.064 4.418 . 0 0 "[ . 1 . 2]" 1
829 1 22 PHE HA 1 134 GLU H 4.400 . 5.060 4.206 3.859 4.958 . 0 0 "[ . 1 . 2]" 1
830 1 26 ALA HA 1 28 LYS H 4.440 . 5.110 3.839 3.583 4.170 . 0 0 "[ . 1 . 2]" 1
831 1 27 ASP HB2 1 28 LYS H 5.610 . 6.450 4.103 3.919 4.346 . 0 0 "[ . 1 . 2]" 1
832 1 27 ASP HB3 1 28 LYS H 5.610 . 6.450 4.125 3.997 4.311 . 0 0 "[ . 1 . 2]" 1
833 1 28 LYS H 1 28 LYS HB2 3.240 . 3.730 2.556 2.447 2.676 . 0 0 "[ . 1 . 2]" 1
834 1 26 ALA MB 1 28 LYS H 4.710 . 5.420 4.552 4.324 4.748 . 0 0 "[ . 1 . 2]" 1
835 1 133 LYS HG3 1 134 GLU H 3.580 . 4.120 2.618 2.245 3.093 . 0 0 "[ . 1 . 2]" 1
836 1 133 LYS HG2 1 134 GLU H 3.610 . 4.150 2.711 2.219 3.142 . 0 0 "[ . 1 . 2]" 1
837 1 132 VAL QG 1 134 GLU H . . 3.900 2.766 2.376 3.116 . 0 0 "[ . 1 . 2]" 1
838 1 27 ASP H 1 29 VAL H 4.550 . 5.230 4.101 3.788 4.335 . 0 0 "[ . 1 . 2]" 1
839 1 28 LYS H 1 29 VAL H 3.010 . 3.460 2.186 2.019 2.320 . 0 0 "[ . 1 . 2]" 1
840 1 27 ASP HA 1 29 VAL H 5.570 . 6.410 4.999 4.770 5.262 . 0 0 "[ . 1 . 2]" 1
841 1 26 ALA HA 1 29 VAL H 4.090 . 4.700 3.418 3.082 3.738 . 0 0 "[ . 1 . 2]" 1
842 1 28 LYS HB2 1 29 VAL H 3.620 . 4.160 2.559 2.392 2.846 . 0 0 "[ . 1 . 2]" 1
843 1 29 VAL H 1 90 LEU MD1 4.450 . 5.120 3.982 3.575 4.428 . 0 0 "[ . 1 . 2]" 1
844 1 31 LYS H 1 32 THR H 3.540 . 4.070 2.724 2.502 2.888 . 0 0 "[ . 1 . 2]" 1
845 1 29 VAL HA 1 31 LYS H 4.770 . 5.490 3.817 3.437 4.388 . 0 0 "[ . 1 . 2]" 1
846 1 30 PRO HD2 1 31 LYS H 4.390 . 5.050 2.920 2.267 3.544 . 0 0 "[ . 1 . 2]" 1
847 1 30 PRO HD3 1 31 LYS H 4.390 . 5.050 4.064 3.644 4.371 . 0 0 "[ . 1 . 2]" 1
848 1 30 PRO HB2 1 31 LYS H 4.160 . 4.780 2.984 2.222 3.557 . 0 0 "[ . 1 . 2]" 1
849 1 30 PRO HG2 1 31 LYS H 4.000 . 4.600 3.048 2.157 4.199 . 0 0 "[ . 1 . 2]" 1
850 1 30 PRO HB3 1 31 LYS H 4.160 . 4.780 4.073 3.697 4.380 . 0 0 "[ . 1 . 2]" 1
851 1 31 LYS H 1 31 LYS HB3 3.550 . 4.080 2.422 2.305 2.574 . 0 0 "[ . 1 . 2]" 1
852 1 31 LYS H 1 31 LYS HB2 3.610 . 4.150 2.563 2.420 2.742 . 0 0 "[ . 1 . 2]" 1
853 1 31 LYS H 1 33 ALA MB 4.980 . 5.730 4.924 4.633 5.465 . 0 0 "[ . 1 . 2]" 1
854 1 32 THR H 1 32 THR HB 3.910 . 4.500 2.655 2.426 2.828 . 0 0 "[ . 1 . 2]" 1
855 1 31 LYS HB3 1 32 THR H 4.130 . 4.750 2.448 2.258 2.721 . 0 0 "[ . 1 . 2]" 1
856 1 31 LYS HB2 1 32 THR H 4.190 . 4.820 3.817 3.670 4.033 . 0 0 "[ . 1 . 2]" 1
857 1 32 THR H 1 32 THR MG 4.060 . 4.670 3.784 3.729 3.824 . 0 0 "[ . 1 . 2]" 1
858 1 29 VAL HA 1 33 ALA H 4.870 . 5.600 5.058 4.882 5.247 . 0 0 "[ . 1 . 2]" 1
859 1 30 PRO HA 1 33 ALA H 5.090 . 5.850 4.068 3.794 4.453 . 0 0 "[ . 1 . 2]" 1
860 1 32 THR HB 1 33 ALA H 3.640 . 4.190 2.886 2.638 3.068 . 0 0 "[ . 1 . 2]" 1
861 1 29 VAL MG2 1 33 ALA H 4.410 . 5.070 3.154 2.765 3.500 . 0 0 "[ . 1 . 2]" 1
862 1 32 THR MG 1 33 ALA H 4.460 . 5.130 3.913 3.660 4.087 . 0 0 "[ . 1 . 2]" 1
863 1 33 ALA H 1 34 GLU H 3.530 . 4.060 2.550 2.406 2.781 . 0 0 "[ . 1 . 2]" 1
864 1 34 GLU H 1 34 GLU HG2 4.690 . 5.390 4.565 4.447 4.669 . 0 0 "[ . 1 . 2]" 1
865 1 34 GLU H 1 34 GLU HB2 3.550 . 4.080 2.553 2.438 2.610 . 0 0 "[ . 1 . 2]" 1
866 1 34 GLU H 1 34 GLU HG3 4.690 . 5.390 4.537 4.488 4.568 . 0 0 "[ . 1 . 2]" 1
867 1 34 GLU H 1 34 GLU HB3 3.550 . 4.080 2.544 2.420 2.641 . 0 0 "[ . 1 . 2]" 1
868 1 26 ALA MB 1 34 GLU H 4.800 . 5.520 4.217 3.474 4.869 . 0 0 "[ . 1 . 2]" 1
869 1 33 ALA MB 1 34 GLU H 3.310 . 3.810 2.549 2.287 2.734 . 0 0 "[ . 1 . 2]" 1
870 1 35 ASN H 1 37 ARG H 4.660 . 5.360 4.142 3.969 4.412 . 0 0 "[ . 1 . 2]" 1
871 1 34 GLU H 1 35 ASN H 3.600 . 4.140 2.647 2.470 2.720 . 0 0 "[ . 1 . 2]" 1
872 1 35 ASN H 1 79 TYR HE2 5.000 . 5.750 4.455 2.976 5.357 . 0 0 "[ . 1 . 2]" 1
873 1 35 ASN H 1 35 ASN HB3 3.770 . 4.340 2.541 2.468 2.614 . 0 0 "[ . 1 . 2]" 1
874 1 35 ASN H 1 35 ASN HB2 3.730 . 4.290 2.530 2.481 2.594 . 0 0 "[ . 1 . 2]" 1
875 1 34 GLU HB2 1 35 ASN H 4.280 . 4.920 3.917 3.689 4.066 . 0 0 "[ . 1 . 2]" 1
876 1 34 GLU HB3 1 35 ASN H 4.280 . 4.920 2.685 2.362 2.901 . 0 0 "[ . 1 . 2]" 1
877 1 35 ASN H 1 78 ILE MD 4.410 . 5.070 3.594 3.228 3.788 . 0 0 "[ . 1 . 2]" 1
878 1 36 PHE H 1 37 ARG H 3.680 . 4.230 2.671 2.578 2.790 . 0 0 "[ . 1 . 2]" 1
879 1 35 ASN H 1 36 PHE H 3.790 . 4.360 2.986 2.787 3.099 . 0 0 "[ . 1 . 2]" 1
880 1 33 ALA HA 1 36 PHE H 4.390 . 5.050 3.779 3.468 4.184 . 0 0 "[ . 1 . 2]" 1
881 1 35 ASN HB3 1 36 PHE H 3.420 . 3.930 2.206 2.116 2.301 . 0 0 "[ . 1 . 2]" 1
882 1 35 ASN HB2 1 36 PHE H 4.260 . 4.900 3.674 3.611 3.726 . 0 0 "[ . 1 . 2]" 1
883 1 24 LEU MD1 1 36 PHE H 5.440 . 6.260 4.300 3.823 5.007 . 0 0 "[ . 1 . 2]" 1
884 1 36 PHE H 1 78 ILE MD 6.000 . 6.900 5.063 4.955 5.239 . 0 0 "[ . 1 . 2]" 1
885 1 24 LEU MD2 1 36 PHE H 5.440 . 6.260 5.292 4.606 5.779 . 0 0 "[ . 1 . 2]" 1
886 1 34 GLU HA 1 37 ARG H 4.180 . 4.810 3.629 3.254 4.031 . 0 0 "[ . 1 . 2]" 1
887 1 33 ALA HA 1 37 ARG H 4.690 . 5.390 4.309 4.044 4.604 . 0 0 "[ . 1 . 2]" 1
888 1 33 ALA MB 1 37 ARG H 4.750 . 5.460 4.748 4.580 4.926 . 0 0 "[ . 1 . 2]" 1
889 1 37 ARG H 1 38 ALA MB 4.690 . 5.390 4.429 4.313 4.542 . 0 0 "[ . 1 . 2]" 1
890 1 24 LEU MD1 1 37 ARG H 4.620 . 5.310 3.061 2.794 3.477 . 0 0 "[ . 1 . 2]" 1
891 1 24 LEU MD2 1 37 ARG H 4.620 . 5.310 4.804 3.971 5.273 . 0 0 "[ . 1 . 2]" 1
892 1 37 ARG H 1 38 ALA H 3.610 . 4.150 2.744 2.639 2.873 . 0 0 "[ . 1 . 2]" 1
893 1 38 ALA H 1 39 LEU H 3.650 . 4.200 2.509 2.387 2.650 . 0 0 "[ . 1 . 2]" 1
894 1 34 GLU HA 1 38 ALA H 4.420 . 5.080 4.029 3.772 4.331 . 0 0 "[ . 1 . 2]" 1
895 1 37 ARG HB2 1 38 ALA H 4.300 . 4.950 3.847 3.598 4.025 . 0 0 "[ . 1 . 2]" 1
896 1 37 ARG HB3 1 38 ALA H 4.300 . 4.950 2.521 2.346 2.709 . 0 0 "[ . 1 . 2]" 1
897 1 38 ALA H 1 39 LEU HB2 4.710 . 5.420 4.694 4.536 4.784 . 0 0 "[ . 1 . 2]" 1
898 1 38 ALA H 1 38 ALA MB 3.120 . 3.590 2.248 2.199 2.284 . 0 0 "[ . 1 . 2]" 1
899 1 36 PHE HA 1 39 LEU H 4.490 . 5.160 3.430 3.260 3.671 . 0 0 "[ . 1 . 2]" 1
900 1 39 LEU H 1 39 LEU HB2 3.740 . 4.300 2.482 2.421 2.536 . 0 0 "[ . 1 . 2]" 1
901 1 38 ALA MB 1 39 LEU H 3.520 . 4.050 2.851 2.709 3.060 . 0 0 "[ . 1 . 2]" 1
902 1 39 LEU H 1 39 LEU HG 3.860 . 4.440 2.458 2.293 2.640 . 0 0 "[ . 1 . 2]" 1
903 1 39 LEU H 1 78 ILE MG 4.050 . 4.660 3.321 3.098 3.633 . 0 0 "[ . 1 . 2]" 1
904 1 39 LEU H 1 39 LEU MD2 3.750 . 4.310 3.356 3.120 3.572 . 0 0 "[ . 1 . 2]" 1
905 1 39 LEU H 1 39 LEU HB3 4.050 . 4.660 3.623 3.596 3.648 . 0 0 "[ . 1 . 2]" 1
906 1 39 LEU H 1 40 SER H 3.690 . 4.240 2.536 2.408 2.667 . 0 0 "[ . 1 . 2]" 1
907 1 40 SER H 1 41 THR H 3.440 . 3.960 2.676 2.485 2.854 . 0 0 "[ . 1 . 2]" 1
908 1 39 LEU HB2 1 40 SER H 4.070 . 4.680 2.655 2.509 2.873 . 0 0 "[ . 1 . 2]" 1
909 1 39 LEU HB3 1 40 SER H 4.390 . 5.050 3.669 3.498 3.890 . 0 0 "[ . 1 . 2]" 1
910 1 38 ALA HA 1 41 THR H 4.160 . 4.780 3.536 3.205 3.843 . 0 0 "[ . 1 . 2]" 1
911 1 40 SER HB2 1 41 THR H 4.620 . 5.310 3.357 2.337 3.883 . 0 0 "[ . 1 . 2]" 1
912 1 40 SER HB3 1 41 THR H 4.620 . 5.310 2.900 2.315 3.977 . 0 0 "[ . 1 . 2]" 1
913 1 41 THR H 1 41 THR MG 3.110 . 3.580 2.512 2.249 3.461 . 0 0 "[ . 1 . 2]" 1
914 1 38 ALA MB 1 41 THR H 4.960 . 5.700 4.850 4.669 5.030 . 0 0 "[ . 1 . 2]" 1
915 1 41 THR H 1 42 GLY H 3.390 . 3.900 2.475 2.346 2.605 . 0 0 "[ . 1 . 2]" 1
916 1 41 THR HB 1 42 GLY H 5.110 . 5.880 3.755 3.342 3.895 . 0 0 "[ . 1 . 2]" 1
917 1 40 SER HA 1 42 GLY H 4.400 . 5.060 4.500 4.221 4.675 . 0 0 "[ . 1 . 2]" 1
918 1 38 ALA HA 1 42 GLY H 4.390 . 5.050 3.520 3.019 3.864 . 0 0 "[ . 1 . 2]" 1
919 1 41 THR MG 1 42 GLY H 4.250 . 4.890 4.091 3.907 4.386 . 0 0 "[ . 1 . 2]" 1
920 1 43 GLU H 1 45 GLY H 4.320 . 4.970 4.128 3.925 4.369 . 0 0 "[ . 1 . 2]" 1
921 1 42 GLY H 1 43 GLU H 3.620 . 4.160 2.410 2.287 2.642 . 0 0 "[ . 1 . 2]" 1
922 1 43 GLU H 1 44 LYS HA 5.460 . 6.280 5.332 5.269 5.395 . 0 0 "[ . 1 . 2]" 1
923 1 43 GLU H 1 43 GLU HG2 5.200 . 5.980 2.256 2.039 2.436 . 0 0 "[ . 1 . 2]" 1
924 1 43 GLU H 1 43 GLU HG3 5.200 . 5.980 3.710 3.559 3.846 . 0 0 "[ . 1 . 2]" 1
925 1 41 THR MG 1 43 GLU H 4.460 . 5.130 4.552 4.341 4.822 . 0 0 "[ . 1 . 2]" 1
926 1 62 CYS H 1 114 ILE H 3.900 . 4.490 3.159 2.603 3.696 . 0 0 "[ . 1 . 2]" 1
927 1 43 GLU H 1 44 LYS H 4.250 . 4.890 2.646 2.581 2.746 . 0 0 "[ . 1 . 2]" 1
928 1 113 PHE HA 1 114 ILE H 3.380 . 3.890 2.215 2.096 2.301 . 0 0 "[ . 1 . 2]" 1
929 1 63 GLN HA 1 114 ILE H 4.190 . 4.820 3.305 2.757 3.708 . 0 0 "[ . 1 . 2]" 1
930 1 38 ALA HA 1 44 LYS H 4.780 . 5.500 4.269 3.592 4.633 . 0 0 "[ . 1 . 2]" 1
931 1 114 ILE H 1 114 ILE HB 3.730 . 4.290 2.783 2.665 2.909 . 0 0 "[ . 1 . 2]" 1
932 1 44 LYS H 1 44 LYS HB2 3.950 . 4.540 2.531 2.356 2.658 . 0 0 "[ . 1 . 2]" 1
933 1 38 ALA MB 1 44 LYS H 4.400 . 5.060 3.184 2.213 3.756 . 0 0 "[ . 1 . 2]" 1
934 1 44 LYS H 1 44 LYS HB3 3.950 . 4.540 3.668 3.603 3.757 . 0 0 "[ . 1 . 2]" 1
935 1 44 LYS H 1 45 GLY H 3.530 . 4.060 2.548 2.389 2.671 . 0 0 "[ . 1 . 2]" 1
936 1 43 GLU HA 1 45 GLY H 4.230 . 4.860 3.718 3.291 3.928 . 0 0 "[ . 1 . 2]" 1
937 1 44 LYS H 1 46 PHE H 3.990 . 4.590 3.665 3.324 3.954 . 0 0 "[ . 1 . 2]" 1
938 1 45 GLY H 1 46 PHE H 3.290 . 3.780 2.733 2.378 3.057 . 0 0 "[ . 1 . 2]" 1
939 1 46 PHE H 1 47 GLY H 4.410 . 5.070 2.422 2.069 2.834 . 0 0 "[ . 1 . 2]" 1
940 1 46 PHE HB2 1 47 GLY H 3.780 . 4.350 2.406 2.283 2.503 . 0 0 "[ . 1 . 2]" 1
941 1 46 PHE HB3 1 47 GLY H 3.780 . 4.350 3.543 3.407 3.668 . 0 0 "[ . 1 . 2]" 1
942 1 39 LEU MD2 1 47 GLY H 4.390 . 5.050 4.532 4.129 5.045 . 0 0 "[ . 1 . 2]" 1
943 1 48 TYR H 1 49 LYS H 4.210 . 4.840 4.124 3.975 4.283 . 0 0 "[ . 1 . 2]" 1
944 1 48 TYR H 1 48 TYR HD2 5.060 . 5.820 3.821 2.415 5.005 . 0 0 "[ . 1 . 2]" 1
945 1 39 LEU HA 1 48 TYR H 4.450 . 5.120 4.026 3.807 4.251 . 0 0 "[ . 1 . 2]" 1
946 1 39 LEU MD2 1 48 TYR H 4.220 . 4.850 4.792 4.362 4.968 0.118 14 0 "[ . 1 . 2]" 1
947 1 49 LYS H 1 50 GLY H 4.310 . 4.960 4.353 3.985 4.488 . 0 0 "[ . 1 . 2]" 1
948 1 49 LYS H 1 51 SER H 4.540 . 5.220 4.533 4.121 4.973 . 0 0 "[ . 1 . 2]" 1
949 1 49 LYS H 1 49 LYS HB2 3.470 . 3.990 2.829 2.627 2.902 . 0 0 "[ . 1 . 2]" 1
950 1 49 LYS H 1 49 LYS HB3 3.470 . 3.990 2.530 2.447 2.708 . 0 0 "[ . 1 . 2]" 1
951 1 49 LYS HA 1 50 GLY H 3.430 . 3.940 2.229 2.172 2.287 . 0 0 "[ . 1 . 2]" 1
952 1 50 GLY H 1 51 SER H 3.820 . 4.390 2.457 1.979 2.673 . 0 0 "[ . 1 . 2]" 1
953 1 48 TYR HA 1 51 SER H 4.860 . 5.590 5.075 4.555 5.621 0.031 19 0 "[ . 1 . 2]" 1
954 1 49 LYS HA 1 51 SER H 4.150 . 4.770 3.612 3.406 4.046 . 0 0 "[ . 1 . 2]" 1
955 1 51 SER H 1 158 ILE HB 4.280 . 4.920 2.477 2.217 2.906 . 0 0 "[ . 1 . 2]" 1
956 1 51 SER H 1 158 ILE MG 4.240 . 4.880 3.858 3.646 4.044 . 0 0 "[ . 1 . 2]" 1
957 1 51 SER H 1 158 ILE MD 4.360 . 5.010 3.535 3.223 4.206 . 0 0 "[ . 1 . 2]" 1
958 1 53 PHE H 1 53 PHE HD1 3.980 . 4.580 2.132 1.892 2.492 . 0 0 "[ . 1 . 2]" 1
959 1 52 CYS HA 1 53 PHE H 3.540 . 4.070 2.166 2.096 2.313 . 0 0 "[ . 1 . 2]" 1
960 1 53 PHE H 1 157 THR HA 4.200 . 4.830 3.189 2.557 3.785 . 0 0 "[ . 1 . 2]" 1
961 1 53 PHE H 1 156 ILE HB 4.210 . 4.840 3.588 3.192 3.915 . 0 0 "[ . 1 . 2]" 1
962 1 53 PHE H 1 157 THR MG 4.350 . 5.000 4.007 3.407 5.017 0.017 9 0 "[ . 1 . 2]" 1
963 1 53 PHE H 1 156 ILE MG 4.280 . 4.920 3.788 2.986 4.323 . 0 0 "[ . 1 . 2]" 1
964 1 55 ARG H 1 63 GLN H 4.820 . 5.540 4.105 3.791 4.447 . 0 0 "[ . 1 . 2]" 1
965 1 54 HIS H 1 55 ARG H 3.550 . 4.080 2.102 1.825 2.514 . 0 0 "[ . 1 . 2]" 1
966 1 53 PHE HA 1 55 ARG H 4.610 . 5.300 3.603 3.314 4.174 . 0 0 "[ . 1 . 2]" 1
967 1 55 ARG H 1 63 GLN HB3 4.570 . 5.260 4.078 3.303 5.509 0.249 20 0 "[ . 1 . 2]" 1
968 1 55 ARG H 1 55 ARG HB2 3.940 . 4.530 3.160 2.898 3.417 . 0 0 "[ . 1 . 2]" 1
969 1 55 ARG H 1 55 ARG HB3 3.780 . 4.350 2.777 2.642 3.043 . 0 0 "[ . 1 . 2]" 1
970 1 55 ARG HA 1 56 ILE H 3.130 . 3.600 2.221 2.140 2.271 . 0 0 "[ . 1 . 2]" 1
971 1 56 ILE H 1 56 ILE HB 3.550 . 4.080 2.759 2.657 2.830 . 0 0 "[ . 1 . 2]" 1
972 1 56 ILE H 1 152 THR MG 3.710 . 4.270 2.831 2.297 4.161 . 0 0 "[ . 1 . 2]" 1
973 1 56 ILE H 1 56 ILE MG 4.000 . 4.600 3.918 3.866 3.944 . 0 0 "[ . 1 . 2]" 1
974 1 56 ILE H 1 56 ILE MD 4.470 . 5.140 4.317 4.193 4.450 . 0 0 "[ . 1 . 2]" 1
975 1 57 ILE H 1 61 MET H 4.520 . 5.200 3.443 3.222 3.574 . 0 0 "[ . 1 . 2]" 1
976 1 57 ILE H 1 62 CYS HA 4.220 . 4.850 3.422 3.037 3.731 . 0 0 "[ . 1 . 2]" 1
977 1 56 ILE HA 1 57 ILE H 3.430 . 3.940 2.160 2.111 2.194 . 0 0 "[ . 1 . 2]" 1
978 1 57 ILE H 1 57 ILE HB 3.900 . 4.490 2.709 2.544 2.798 . 0 0 "[ . 1 . 2]" 1
979 1 56 ILE HB 1 57 ILE H 4.690 . 5.390 4.168 4.019 4.249 . 0 0 "[ . 1 . 2]" 1
980 1 57 ILE H 1 57 ILE QG 4.340 . 4.990 2.818 2.621 2.987 . 0 0 "[ . 1 . 2]" 1
981 1 57 ILE H 1 57 ILE MG 4.010 . 4.610 3.910 3.839 3.947 . 0 0 "[ . 1 . 2]" 1
982 1 56 ILE MG 1 57 ILE H 3.500 . 4.030 2.623 2.341 2.773 . 0 0 "[ . 1 . 2]" 1
983 1 58 PRO HA 1 59 GLY H 3.240 . 3.730 2.180 2.137 2.223 . 0 0 "[ . 1 . 2]" 1
984 1 59 GLY H 1 143 GLU HG2 4.440 . 5.110 3.099 2.349 3.397 . 0 0 "[ . 1 . 2]" 1
985 1 59 GLY H 1 143 GLU HG3 4.440 . 5.110 3.829 2.802 4.707 . 0 0 "[ . 1 . 2]" 1
986 1 59 GLY H 1 60 PHE H 3.610 . 4.150 2.584 2.412 2.770 . 0 0 "[ . 1 . 2]" 1
987 1 60 PHE H 1 60 PHE HD2 4.460 . 5.130 5.008 4.882 5.149 0.019 18 0 "[ . 1 . 2]" 1
988 1 58 PRO HA 1 60 PHE H 3.980 . 4.580 3.490 3.337 3.691 . 0 0 "[ . 1 . 2]" 1
989 1 60 PHE H 1 60 PHE HB3 3.840 . 4.420 2.874 2.755 3.023 . 0 0 "[ . 1 . 2]" 1
990 1 60 PHE H 1 60 PHE HB2 3.860 . 4.440 3.450 3.250 3.591 . 0 0 "[ . 1 . 2]" 1
991 1 57 ILE MG 1 60 PHE H 3.900 . 4.490 4.325 4.088 4.494 0.004 9 0 "[ . 1 . 2]" 1
992 1 9 ASP H 1 160 ASP H 3.660 . 4.210 2.657 2.551 2.791 . 0 0 "[ . 1 . 2]" 1
993 1 160 ASP H 1 161 CYS H 4.360 . 5.010 4.368 4.314 4.412 . 0 0 "[ . 1 . 2]" 1
994 1 158 ILE HA 1 160 ASP H 3.940 . 4.530 3.914 3.696 4.104 . 0 0 "[ . 1 . 2]" 1
995 1 60 PHE HB2 1 61 MET H 4.250 . 4.890 3.770 3.611 3.843 . 0 0 "[ . 1 . 2]" 1
996 1 9 ASP HB2 1 160 ASP H 3.910 . 4.500 2.244 1.840 2.765 . 0 0 "[ . 1 . 2]" 1
997 1 9 ASP HB3 1 160 ASP H 3.910 . 4.500 3.793 3.185 4.225 . 0 0 "[ . 1 . 2]" 1
998 1 159 ALA MB 1 160 ASP H 3.180 . 3.660 2.505 2.277 2.828 . 0 0 "[ . 1 . 2]" 1
999 1 57 ILE MG 1 61 MET H 3.740 . 4.300 4.097 3.869 4.328 0.028 6 0 "[ . 1 . 2]" 1
1000 1 158 ILE MG 1 160 ASP H 3.690 . 4.240 2.865 2.621 3.218 . 0 0 "[ . 1 . 2]" 1
1001 1 61 MET HA 1 62 CYS H 3.530 . 4.060 2.236 2.164 2.322 . 0 0 "[ . 1 . 2]" 1
1002 1 62 CYS H 1 115 CYS HA 4.440 . 5.110 3.864 3.228 4.235 . 0 0 "[ . 1 . 2]" 1
1003 1 61 MET HB2 1 62 CYS H 4.080 . 4.690 3.949 2.576 4.262 . 0 0 "[ . 1 . 2]" 1
1004 1 61 MET HB3 1 62 CYS H 4.080 . 4.690 4.089 3.838 4.269 . 0 0 "[ . 1 . 2]" 1
1005 1 56 ILE MG 1 62 CYS H 4.740 . 5.450 4.168 4.005 4.434 . 0 0 "[ . 1 . 2]" 1
1006 1 62 CYS HA 1 63 GLN H 3.500 . 4.030 2.196 2.154 2.290 . 0 0 "[ . 1 . 2]" 1
1007 1 56 ILE HA 1 63 GLN H 4.260 . 4.900 2.714 2.554 3.089 . 0 0 "[ . 1 . 2]" 1
1008 1 63 GLN H 1 63 GLN HB2 3.950 . 4.540 3.195 2.879 3.937 . 0 0 "[ . 1 . 2]" 1
1009 1 63 GLN H 1 63 GLN HB3 3.910 . 4.500 2.608 2.399 3.038 . 0 0 "[ . 1 . 2]" 1
1010 1 56 ILE HB 1 63 GLN H 4.910 . 5.650 4.897 4.618 5.165 . 0 0 "[ . 1 . 2]" 1
1011 1 55 ARG HB3 1 63 GLN H 4.590 . 5.280 4.141 3.859 4.480 . 0 0 "[ . 1 . 2]" 1
1012 1 56 ILE MG 1 63 GLN H 4.130 . 4.750 3.855 3.529 4.246 . 0 0 "[ . 1 . 2]" 1
1013 1 63 GLN HA 1 64 GLY H 3.390 . 3.900 2.138 2.044 2.233 . 0 0 "[ . 1 . 2]" 1
1014 1 63 GLN HB3 1 64 GLY H 4.430 . 5.090 4.271 4.002 4.423 . 0 0 "[ . 1 . 2]" 1
1015 1 68 THR H 1 68 THR MG 4.270 . 4.910 3.715 1.914 3.846 . 0 0 "[ . 1 . 2]" 1
1016 1 68 THR H 1 69 ARG H 4.460 . 5.130 4.405 4.256 4.648 . 0 0 "[ . 1 . 2]" 1
1017 1 72 GLY H 1 73 THR H 4.210 . 4.840 2.721 2.497 2.898 . 0 0 "[ . 1 . 2]" 1
1018 1 73 THR H 1 74 GLY H 3.550 . 4.080 2.746 2.395 3.179 . 0 0 "[ . 1 . 2]" 1
1019 1 73 THR H 1 73 THR MG 3.720 . 4.280 3.969 3.824 4.049 . 0 0 "[ . 1 . 2]" 1
1020 1 73 THR HB 1 74 GLY H 4.410 . 5.070 1.981 1.833 2.143 . 0 0 "[ . 1 . 2]" 1
1021 1 74 GLY H 1 75 GLY H 4.290 . 4.930 2.963 2.586 3.149 . 0 0 "[ . 1 . 2]" 1
1022 1 68 THR MG 1 75 GLY H 4.720 . 5.430 4.406 2.251 5.716 0.286 17 0 "[ . 1 . 2]" 1
1023 1 76 LYS H 1 110 SER HB3 5.250 . 6.040 5.855 5.315 6.111 0.071 10 0 "[ . 1 . 2]" 1
1024 1 76 LYS HA 1 77 SER H 3.170 . 3.650 2.451 2.282 2.592 . 0 0 "[ . 1 . 2]" 1
1025 1 77 SER H 1 81 GLU HA 4.070 . 4.680 3.581 2.848 4.278 . 0 0 "[ . 1 . 2]" 1
1026 1 78 ILE H 1 79 TYR HA 5.290 . 6.080 5.156 4.967 5.305 . 0 0 "[ . 1 . 2]" 1
1027 1 77 SER HB2 1 78 ILE H 4.580 . 5.270 2.251 2.072 2.530 . 0 0 "[ . 1 . 2]" 1
1028 1 77 SER HB3 1 78 ILE H 4.580 . 5.270 3.679 3.567 3.872 . 0 0 "[ . 1 . 2]" 1
1029 1 35 ASN HA 1 78 ILE H 4.890 . 5.620 3.810 3.505 4.153 . 0 0 "[ . 1 . 2]" 1
1030 1 39 LEU MD1 1 78 ILE H 4.440 . 5.110 3.483 3.075 4.018 . 0 0 "[ . 1 . 2]" 1
1031 1 78 ILE H 1 78 ILE MG 3.430 . 3.940 2.208 2.070 2.323 . 0 0 "[ . 1 . 2]" 1
1032 1 78 ILE H 1 78 ILE MD 3.810 . 4.380 3.811 3.731 3.913 . 0 0 "[ . 1 . 2]" 1
1033 1 78 ILE H 1 79 TYR H 3.980 . 4.580 2.477 2.305 2.681 . 0 0 "[ . 1 . 2]" 1
1034 1 79 TYR H 1 79 TYR HD2 4.180 . 4.810 2.780 2.459 3.257 . 0 0 "[ . 1 . 2]" 1
1035 1 79 TYR H 1 79 TYR HB2 4.190 . 4.820 2.502 2.411 2.586 . 0 0 "[ . 1 . 2]" 1
1036 1 79 TYR H 1 79 TYR HB3 4.190 . 4.820 3.635 3.602 3.701 . 0 0 "[ . 1 . 2]" 1
1037 1 78 ILE MG 1 79 TYR H 4.430 . 5.090 4.040 3.928 4.183 . 0 0 "[ . 1 . 2]" 1
1038 1 79 TYR H 1 80 GLY H 3.410 . 3.920 2.526 2.212 3.000 . 0 0 "[ . 1 . 2]" 1
1039 1 79 TYR HA 1 80 GLY H 3.560 . 4.090 3.230 2.866 3.540 . 0 0 "[ . 1 . 2]" 1
1040 1 78 ILE HA 1 80 GLY H 4.320 . 4.970 3.662 3.306 4.682 . 0 0 "[ . 1 . 2]" 1
1041 1 82 LYS H 1 83 PHE H 4.570 . 5.260 4.351 4.279 4.391 . 0 0 "[ . 1 . 2]" 1
1042 1 82 LYS H 1 82 LYS HB3 3.850 . 4.430 3.531 3.368 3.666 . 0 0 "[ . 1 . 2]" 1
1043 1 82 LYS H 1 82 LYS HG3 3.420 . 3.930 3.448 3.166 3.729 . 0 0 "[ . 1 . 2]" 1
1044 1 83 PHE H 1 108 ASN H 4.470 . 5.140 3.783 3.067 4.786 . 0 0 "[ . 1 . 2]" 1
1045 1 82 LYS HA 1 83 PHE H 3.180 . 3.660 2.515 2.306 2.628 . 0 0 "[ . 1 . 2]" 1
1046 1 83 PHE H 1 107 THR HA 4.810 . 5.530 4.507 3.498 5.505 . 0 0 "[ . 1 . 2]" 1
1047 1 82 LYS HB3 1 83 PHE H 3.720 . 4.280 3.670 3.510 3.946 . 0 0 "[ . 1 . 2]" 1
1048 1 82 LYS HB2 1 83 PHE H 3.550 . 4.080 2.287 2.042 2.725 . 0 0 "[ . 1 . 2]" 1
1049 1 82 LYS HG3 1 83 PHE H 5.390 . 6.200 3.587 3.283 4.101 . 0 0 "[ . 1 . 2]" 1
1050 1 82 LYS HG2 1 83 PHE H 5.720 . 6.580 4.557 4.313 4.916 . 0 0 "[ . 1 . 2]" 1
1051 1 83 PHE QD 1 84 GLU H 4.010 . 4.610 3.273 3.050 3.514 . 0 0 "[ . 1 . 2]" 1
1052 1 83 PHE HA 1 84 GLU H 3.240 . 3.730 2.513 2.432 2.639 . 0 0 "[ . 1 . 2]" 1
1053 1 84 GLU H 1 84 GLU HG2 3.930 . 4.520 2.149 1.858 3.650 . 0 0 "[ . 1 . 2]" 1
1054 1 84 GLU H 1 85 ASP H 4.800 . 5.520 4.569 4.480 4.632 . 0 0 "[ . 1 . 2]" 1
1055 1 84 GLU HA 1 85 ASP H 3.410 . 3.920 2.405 2.281 2.663 . 0 0 "[ . 1 . 2]" 1
1056 1 85 ASP H 1 108 ASN QB 4.480 . 5.150 3.955 3.285 4.411 . 0 0 "[ . 1 . 2]" 1
1057 1 85 ASP H 1 85 ASP HB3 3.860 . 4.440 3.601 3.549 3.656 . 0 0 "[ . 1 . 2]" 1
1058 1 84 GLU HG2 1 85 ASP H 4.320 . 4.970 4.595 3.324 4.919 . 0 0 "[ . 1 . 2]" 1
1059 1 84 GLU HG3 1 85 ASP H 3.720 . 4.280 3.719 3.054 4.366 0.086 5 0 "[ . 1 . 2]" 1
1060 1 85 ASP H 1 85 ASP HB2 4.100 . 4.720 2.449 2.327 2.671 . 0 0 "[ . 1 . 2]" 1
1061 1 85 ASP H 1 105 PRO HB3 4.670 . 5.370 4.821 3.979 5.520 0.150 18 0 "[ . 1 . 2]" 1
1062 1 21 SER H 1 133 LYS H 4.970 . 5.720 4.542 4.069 4.850 . 0 0 "[ . 1 . 2]" 1
1063 1 22 PHE HA 1 133 LYS H 3.750 . 4.310 2.590 2.260 3.025 . 0 0 "[ . 1 . 2]" 1
1064 1 132 VAL HA 1 133 LYS H 3.330 . 3.830 2.171 2.107 2.217 . 0 0 "[ . 1 . 2]" 1
1065 1 85 ASP HB3 1 86 GLU H 4.130 . 4.750 3.069 2.684 3.665 . 0 0 "[ . 1 . 2]" 1
1066 1 86 GLU H 1 86 GLU HB2 4.060 . 4.670 2.630 2.479 2.798 . 0 0 "[ . 1 . 2]" 1
1067 1 85 ASP HB2 1 86 GLU H 4.260 . 4.900 4.097 3.854 4.389 . 0 0 "[ . 1 . 2]" 1
1068 1 86 GLU H 1 86 GLU HB3 4.060 . 4.670 2.460 2.357 2.602 . 0 0 "[ . 1 . 2]" 1
1069 1 133 LYS H 1 133 LYS HB2 4.030 . 4.630 3.698 3.638 3.785 . 0 0 "[ . 1 . 2]" 1
1070 1 133 LYS H 1 133 LYS HB3 3.730 . 4.290 2.875 2.695 3.092 . 0 0 "[ . 1 . 2]" 1
1071 1 86 GLU H 1 87 ASN H 4.010 . 4.610 2.730 2.549 3.027 . 0 0 "[ . 1 . 2]" 1
1072 1 85 ASP HA 1 87 ASN H 4.560 . 5.240 4.497 4.097 4.758 . 0 0 "[ . 1 . 2]" 1
1073 1 85 ASP HB3 1 87 ASN H 4.050 . 4.660 3.644 3.094 4.231 . 0 0 "[ . 1 . 2]" 1
1074 1 86 GLU HB2 1 87 ASN H 3.960 . 4.550 3.738 3.603 3.875 . 0 0 "[ . 1 . 2]" 1
1075 1 86 GLU HB3 1 87 ASN H 3.960 . 4.550 2.312 2.140 2.505 . 0 0 "[ . 1 . 2]" 1
1076 1 87 ASN H 1 127 VAL MG1 3.550 . 4.080 2.843 2.177 3.769 . 0 0 "[ . 1 . 2]" 1
1077 1 87 ASN H 1 127 VAL MG2 3.550 . 4.080 3.053 2.007 4.171 0.091 1 0 "[ . 1 . 2]" 1
1078 1 88 PHE H 1 88 PHE HD1 4.440 . 5.110 4.366 2.309 5.144 0.034 15 0 "[ . 1 . 2]" 1
1079 1 88 PHE H 1 88 PHE HD2 4.700 . 5.400 3.509 2.512 5.111 . 0 0 "[ . 1 . 2]" 1
1080 1 87 ASN HA 1 88 PHE H 3.370 . 3.880 2.502 2.184 2.958 . 0 0 "[ . 1 . 2]" 1
1081 1 87 ASN HB2 1 88 PHE H 3.750 . 4.310 2.567 1.955 3.399 . 0 0 "[ . 1 . 2]" 1
1082 1 87 ASN HB3 1 88 PHE H 3.750 . 4.310 3.831 3.490 4.235 . 0 0 "[ . 1 . 2]" 1
1083 1 89 ILE H 1 90 LEU H 3.880 . 4.460 2.593 2.333 2.834 . 0 0 "[ . 1 . 2]" 1
1084 1 89 ILE H 1 90 LEU HA 5.450 . 6.270 5.250 5.028 5.427 . 0 0 "[ . 1 . 2]" 1
1085 1 87 ASN HA 1 89 ILE H 4.690 . 5.390 4.645 4.354 4.941 . 0 0 "[ . 1 . 2]" 1
1086 1 89 ILE H 1 89 ILE HB 3.290 . 3.780 2.507 2.452 2.553 . 0 0 "[ . 1 . 2]" 1
1087 1 89 ILE H 1 89 ILE HG12 3.670 . 4.220 3.529 3.391 3.660 . 0 0 "[ . 1 . 2]" 1
1088 1 89 ILE H 1 89 ILE MG 3.870 . 4.450 3.826 3.789 3.852 . 0 0 "[ . 1 . 2]" 1
1089 1 90 LEU H 1 90 LEU HB2 3.900 . 4.490 2.417 2.326 2.512 . 0 0 "[ . 1 . 2]" 1
1090 1 90 LEU H 1 128 VAL HB 4.640 . 5.340 4.605 4.175 4.890 . 0 0 "[ . 1 . 2]" 1
1091 1 89 ILE HB 1 90 LEU H 3.640 . 4.190 2.418 2.198 2.833 . 0 0 "[ . 1 . 2]" 1
1092 1 89 ILE HG13 1 90 LEU H 3.980 . 4.580 4.224 4.051 4.337 . 0 0 "[ . 1 . 2]" 1
1093 1 90 LEU H 1 90 LEU HB3 3.900 . 4.490 3.608 3.572 3.655 . 0 0 "[ . 1 . 2]" 1
1094 1 89 ILE MD 1 90 LEU H 4.310 . 4.960 4.532 4.318 4.877 . 0 0 "[ . 1 . 2]" 1
1095 1 90 LEU H 1 90 LEU HG 3.990 . 4.590 2.595 2.382 2.833 . 0 0 "[ . 1 . 2]" 1
1096 1 90 LEU H 1 90 LEU MD2 3.870 . 4.450 3.619 3.438 3.825 . 0 0 "[ . 1 . 2]" 1
1097 1 90 LEU HA 1 91 LYS H 3.100 . 3.570 2.183 2.119 2.408 . 0 0 "[ . 1 . 2]" 1
1098 1 91 LYS H 1 91 LYS HB2 4.010 . 4.610 3.199 2.467 3.984 . 0 0 "[ . 1 . 2]" 1
1099 1 91 LYS H 1 91 LYS HB3 4.010 . 4.610 3.466 2.775 3.806 . 0 0 "[ . 1 . 2]" 1
1100 1 91 LYS H 1 93 THR MG 4.090 . 4.700 3.771 3.290 4.724 0.024 12 0 "[ . 1 . 2]" 1
1101 1 90 LEU HG 1 91 LYS H 5.680 . 6.530 5.099 4.845 5.267 . 0 0 "[ . 1 . 2]" 1
1102 1 90 LEU MD1 1 91 LYS H 6.000 . 6.900 5.153 4.516 5.546 . 0 0 "[ . 1 . 2]" 1
1103 1 91 LYS HB2 1 92 HIS H 4.120 . 4.740 2.918 2.138 3.828 . 0 0 "[ . 1 . 2]" 1
1104 1 91 LYS HB3 1 92 HIS H 4.120 . 4.740 3.009 2.174 3.842 . 0 0 "[ . 1 . 2]" 1
1105 1 93 THR H 1 93 THR HB 3.980 . 4.580 3.068 2.700 3.608 . 0 0 "[ . 1 . 2]" 1
1106 1 92 HIS HA 1 93 THR H 3.220 . 3.700 2.625 2.318 2.992 . 0 0 "[ . 1 . 2]" 1
1107 1 93 THR H 1 97 ILE HB 5.740 . 6.600 5.859 5.250 6.631 0.031 16 0 "[ . 1 . 2]" 1
1108 1 93 THR H 1 97 ILE HG12 4.810 . 5.530 4.849 3.966 5.580 0.050 5 0 "[ . 1 . 2]" 1
1109 1 93 THR H 1 97 ILE HG13 3.750 . 4.310 3.549 2.808 4.169 . 0 0 "[ . 1 . 2]" 1
1110 1 93 THR H 1 93 THR MG 3.140 . 3.610 2.175 1.904 2.911 . 0 0 "[ . 1 . 2]" 1
1111 1 93 THR H 1 97 ILE MD 3.900 . 4.490 3.565 2.682 4.566 0.076 5 0 "[ . 1 . 2]" 1
1112 1 93 THR H 1 128 VAL MG2 5.210 . 5.990 4.350 3.851 5.023 . 0 0 "[ . 1 . 2]" 1
1113 1 93 THR H 1 94 GLY H 3.610 . 4.150 2.574 2.267 3.638 . 0 0 "[ . 1 . 2]" 1
1114 1 94 GLY H 1 97 ILE H 5.240 . 6.030 5.566 4.996 6.031 0.001 19 0 "[ . 1 . 2]" 1
1115 1 92 HIS HA 1 94 GLY H 3.620 . 4.160 3.396 3.028 4.097 . 0 0 "[ . 1 . 2]" 1
1116 1 94 GLY H 1 95 PRO HD3 4.780 . 5.500 4.917 4.603 5.097 . 0 0 "[ . 1 . 2]" 1
1117 1 94 GLY H 1 97 ILE HG12 3.780 . 4.350 3.364 3.008 4.212 . 0 0 "[ . 1 . 2]" 1
1118 1 94 GLY H 1 97 ILE HG13 3.740 . 4.300 2.831 2.316 3.638 . 0 0 "[ . 1 . 2]" 1
1119 1 94 GLY H 1 118 LYS HB2 4.210 . 4.840 3.885 2.666 4.650 . 0 0 "[ . 1 . 2]" 1
1120 1 93 THR MG 1 94 GLY H 4.090 . 4.700 3.593 2.718 4.532 . 0 0 "[ . 1 . 2]" 1
1121 1 94 GLY H 1 97 ILE MD 4.280 . 4.920 3.258 2.341 4.503 . 0 0 "[ . 1 . 2]" 1
1122 1 96 GLY H 1 116 THR HA 4.030 . 4.630 2.552 1.781 3.497 0.019 12 0 "[ . 1 . 2]" 1
1123 1 95 PRO HA 1 96 GLY H 3.300 . 3.800 2.290 2.192 2.339 . 0 0 "[ . 1 . 2]" 1
1124 1 95 PRO HB2 1 96 GLY H 4.040 . 4.650 3.104 2.902 3.499 . 0 0 "[ . 1 . 2]" 1
1125 1 95 PRO HB3 1 96 GLY H 4.030 . 4.630 3.761 3.388 4.044 . 0 0 "[ . 1 . 2]" 1
1126 1 96 GLY H 1 114 ILE MG 4.350 . 5.000 3.842 3.172 4.577 . 0 0 "[ . 1 . 2]" 1
1127 1 96 GLY H 1 116 THR MG 4.840 . 5.570 4.415 3.686 5.243 . 0 0 "[ . 1 . 2]" 1
1128 1 96 GLY H 1 97 ILE H 3.690 . 4.240 2.477 2.261 2.634 . 0 0 "[ . 1 . 2]" 1
1129 1 95 PRO HA 1 97 ILE H 4.300 . 4.950 3.431 3.143 3.617 . 0 0 "[ . 1 . 2]" 1
1130 1 97 ILE H 1 97 ILE HB 3.420 . 3.930 2.273 2.186 2.428 . 0 0 "[ . 1 . 2]" 1
1131 1 97 ILE H 1 97 ILE HG13 4.120 . 4.740 3.830 3.673 3.967 . 0 0 "[ . 1 . 2]" 1
1132 1 97 ILE H 1 97 ILE MD 3.610 . 4.150 3.668 3.502 3.848 . 0 0 "[ . 1 . 2]" 1
1133 1 98 LEU H 1 131 LYS HA 3.700 . 4.260 2.576 2.196 2.942 . 0 0 "[ . 1 . 2]" 1
1134 1 97 ILE HA 1 98 LEU H 3.210 . 3.690 2.181 2.115 2.226 . 0 0 "[ . 1 . 2]" 1
1135 1 98 LEU H 1 131 LYS QB 4.080 . 4.690 3.977 3.571 4.371 . 0 0 "[ . 1 . 2]" 1
1136 1 97 ILE MG 1 98 LEU H 3.300 . 3.800 3.248 2.873 3.502 . 0 0 "[ . 1 . 2]" 1
1137 1 98 LEU H 1 98 LEU HG 4.930 . 5.670 4.396 3.843 4.502 . 0 0 "[ . 1 . 2]" 1
1138 1 98 LEU H 1 98 LEU HB2 3.910 . 4.500 2.811 2.433 2.993 . 0 0 "[ . 1 . 2]" 1
1139 1 98 LEU H 1 98 LEU HB3 3.910 . 4.500 2.595 2.414 3.657 . 0 0 "[ . 1 . 2]" 1
1140 1 98 LEU H 1 98 LEU MD2 4.410 . 5.070 4.378 4.201 4.454 . 0 0 "[ . 1 . 2]" 1
1141 1 98 LEU HA 1 99 SER H 3.210 . 3.690 2.121 2.084 2.146 . 0 0 "[ . 1 . 2]" 1
1142 1 98 LEU HB3 1 99 SER H 4.770 . 5.490 4.258 3.463 4.472 . 0 0 "[ . 1 . 2]" 1
1143 1 98 LEU MD2 1 99 SER H 5.180 . 5.960 4.816 4.635 5.129 . 0 0 "[ . 1 . 2]" 1
1144 1 99 SER HA 1 100 MET H 3.570 . 4.110 2.355 2.221 2.585 . 0 0 "[ . 1 . 2]" 1
1145 1 100 MET H 1 128 VAL HA 4.350 . 5.000 4.597 3.399 5.299 0.299 8 0 "[ . 1 . 2]" 1
1146 1 101 ALA H 1 113 PHE H 4.580 . 5.270 4.092 3.612 4.710 . 0 0 "[ . 1 . 2]" 1
1147 1 101 ALA H 1 112 PHE HA 3.740 . 4.300 2.439 1.890 2.958 . 0 0 "[ . 1 . 2]" 1
1148 1 100 MET HA 1 101 ALA H 3.520 . 4.050 2.302 2.203 2.366 . 0 0 "[ . 1 . 2]" 1
1149 1 103 ALA H 1 107 THR HB 4.240 . 4.880 2.400 1.970 3.190 . 0 0 "[ . 1 . 2]" 1
1150 1 102 ASN HB2 1 103 ALA H 4.080 . 4.690 2.522 2.241 2.985 . 0 0 "[ . 1 . 2]" 1
1151 1 102 ASN HB3 1 103 ALA H 4.080 . 4.690 3.865 3.703 4.175 . 0 0 "[ . 1 . 2]" 1
1152 1 103 ALA H 1 107 THR MG 3.960 . 4.550 2.221 1.947 3.130 . 0 0 "[ . 1 . 2]" 1
1153 1 103 ALA H 1 104 GLY H 3.430 . 3.940 2.229 1.991 2.540 . 0 0 "[ . 1 . 2]" 1
1154 1 103 ALA MB 1 104 GLY H 3.560 . 4.090 3.151 2.344 3.608 . 0 0 "[ . 1 . 2]" 1
1155 1 104 GLY H 1 107 THR MG 4.380 . 5.040 3.346 2.914 3.888 . 0 0 "[ . 1 . 2]" 1
1156 1 85 ASP H 1 106 ASN H 4.120 . 4.740 3.291 2.732 4.374 . 0 0 "[ . 1 . 2]" 1
1157 1 105 PRO HA 1 106 ASN H 3.190 . 3.670 2.203 2.148 2.273 . 0 0 "[ . 1 . 2]" 1
1158 1 84 GLU HA 1 106 ASN H 4.330 . 4.980 2.502 2.047 3.040 . 0 0 "[ . 1 . 2]" 1
1159 1 105 PRO HB2 1 106 ASN H 4.120 . 4.740 3.734 3.523 3.897 . 0 0 "[ . 1 . 2]" 1
1160 1 106 ASN H 1 107 THR H 4.150 . 4.770 2.682 2.603 2.762 . 0 0 "[ . 1 . 2]" 1
1161 1 107 THR H 1 108 ASN H 3.660 . 4.210 2.100 1.958 2.279 . 0 0 "[ . 1 . 2]" 1
1162 1 82 LYS HB2 1 108 ASN H 4.400 . 5.060 3.794 3.278 4.203 . 0 0 "[ . 1 . 2]" 1
1163 1 107 THR MG 1 108 ASN H 4.170 . 4.800 4.317 4.130 4.392 . 0 0 "[ . 1 . 2]" 1
1164 1 109 GLY H 1 110 SER H 4.220 . 4.850 2.184 1.962 2.620 . 0 0 "[ . 1 . 2]" 1
1165 1 100 MET ME 1 110 SER H 4.350 . 5.000 3.645 3.023 4.469 . 0 0 "[ . 1 . 2]" 1
1166 1 110 SER HA 1 111 GLN H 3.480 . 4.000 2.200 2.148 2.223 . 0 0 "[ . 1 . 2]" 1
1167 1 101 ALA MB 1 111 GLN H 5.300 . 6.100 4.597 4.477 4.743 . 0 0 "[ . 1 . 2]" 1
1168 1 64 GLY H 1 112 PHE H 3.990 . 4.590 3.470 2.952 3.906 . 0 0 "[ . 1 . 2]" 1
1169 1 99 SER HA 1 129 PHE H 4.070 . 4.680 3.054 2.606 3.415 . 0 0 "[ . 1 . 2]" 1
1170 1 128 VAL HA 1 129 PHE H 3.540 . 4.070 2.359 2.265 2.451 . 0 0 "[ . 1 . 2]" 1
1171 1 100 MET ME 1 112 PHE H 5.090 . 5.850 4.836 4.426 5.399 . 0 0 "[ . 1 . 2]" 1
1172 1 101 ALA MB 1 112 PHE H 5.040 . 5.800 3.763 3.435 4.376 . 0 0 "[ . 1 . 2]" 1
1173 1 113 PHE H 1 114 ILE H 4.570 . 5.260 4.370 4.282 4.491 . 0 0 "[ . 1 . 2]" 1
1174 1 99 SER H 1 113 PHE H 3.840 . 4.420 3.279 3.030 3.686 . 0 0 "[ . 1 . 2]" 1
1175 1 112 PHE H 1 113 PHE H 5.280 . 6.070 4.343 4.201 4.422 . 0 0 "[ . 1 . 2]" 1
1176 1 112 PHE HD2 1 113 PHE H 4.540 . 5.220 4.318 3.384 5.951 0.731 15 3 "[ - .* 1 + 2]" 1
1177 1 113 PHE H 1 113 PHE QD 4.720 . 5.430 3.049 2.561 3.441 . 0 0 "[ . 1 . 2]" 1
1178 1 112 PHE HA 1 113 PHE H 3.520 . 4.050 2.320 2.182 2.443 . 0 0 "[ . 1 . 2]" 1
1179 1 100 MET HA 1 113 PHE H 4.300 . 4.950 3.098 2.724 3.345 . 0 0 "[ . 1 . 2]" 1
1180 1 114 ILE H 1 114 ILE MD 4.150 . 4.770 3.808 3.662 3.954 . 0 0 "[ . 1 . 2]" 1
1181 1 114 ILE H 1 114 ILE MG 3.850 . 4.430 3.919 3.855 3.974 . 0 0 "[ . 1 . 2]" 1
1182 1 97 ILE H 1 115 CYS H 4.700 . 5.400 3.781 3.454 4.233 . 0 0 "[ . 1 . 2]" 1
1183 1 114 ILE HA 1 115 CYS H 3.190 . 3.670 2.248 2.192 2.327 . 0 0 "[ . 1 . 2]" 1
1184 1 97 ILE MG 1 115 CYS H 4.710 . 5.420 3.469 3.112 4.005 . 0 0 "[ . 1 . 2]" 1
1185 1 114 ILE MG 1 115 CYS H 3.520 . 4.050 3.314 3.001 3.520 . 0 0 "[ . 1 . 2]" 1
1186 1 61 MET HA 1 116 THR H 3.760 . 4.320 2.325 1.733 3.206 0.067 18 0 "[ . 1 . 2]" 1
1187 1 115 CYS HA 1 116 THR H 3.430 . 3.940 2.174 2.101 2.250 . 0 0 "[ . 1 . 2]" 1
1188 1 115 CYS HB2 1 116 THR H 4.410 . 5.070 4.251 3.523 4.462 . 0 0 "[ . 1 . 2]" 1
1189 1 115 CYS HB3 1 116 THR H 4.410 . 5.070 3.916 3.728 4.416 . 0 0 "[ . 1 . 2]" 1
1190 1 116 THR H 1 136 MET ME 5.270 . 6.060 4.663 4.248 5.557 . 0 0 "[ . 1 . 2]" 1
1191 1 116 THR H 1 117 ALA MB 4.730 . 5.440 4.354 4.175 4.515 . 0 0 "[ . 1 . 2]" 1
1192 1 116 THR H 1 119 THR MG 4.220 . 4.850 4.367 4.113 4.815 . 0 0 "[ . 1 . 2]" 1
1193 1 116 THR H 1 116 THR MG 3.620 . 4.160 2.349 2.232 2.541 . 0 0 "[ . 1 . 2]" 1
1194 1 116 THR H 1 117 ALA H 3.280 . 3.770 2.505 2.402 2.643 . 0 0 "[ . 1 . 2]" 1
1195 1 121 TRP H 1 123 ASP H 4.260 . 4.900 4.288 3.966 4.572 . 0 0 "[ . 1 . 2]" 1
1196 1 122 LEU H 1 123 ASP H 3.250 . 3.740 2.544 2.356 2.791 . 0 0 "[ . 1 . 2]" 1
1197 1 115 CYS HA 1 117 ALA H 4.010 . 4.610 3.616 3.410 3.937 . 0 0 "[ . 1 . 2]" 1
1198 1 121 TRP HA 1 123 ASP H 4.020 . 4.620 3.472 3.221 3.675 . 0 0 "[ . 1 . 2]" 1
1199 1 120 GLU HA 1 123 ASP H 4.200 . 4.830 3.788 3.225 4.369 . 0 0 "[ . 1 . 2]" 1
1200 1 95 PRO HA 1 117 ALA H 3.910 . 4.500 4.279 3.488 4.615 0.115 13 0 "[ . 1 . 2]" 1
1201 1 115 CYS HB2 1 117 ALA H 4.610 . 5.300 4.370 2.755 4.907 . 0 0 "[ . 1 . 2]" 1
1202 1 115 CYS HB3 1 117 ALA H 4.610 . 5.300 3.834 3.119 5.099 . 0 0 "[ . 1 . 2]" 1
1203 1 95 PRO HB3 1 117 ALA H 4.450 . 5.350 5.011 4.352 5.420 0.070 16 0 "[ . 1 . 2]" 1
1204 1 117 ALA H 1 117 ALA MB 3.320 . 3.820 2.409 2.325 2.554 . 0 0 "[ . 1 . 2]" 1
1205 1 117 ALA H 1 119 THR MG 3.950 . 4.540 3.412 3.048 4.041 . 0 0 "[ . 1 . 2]" 1
1206 1 116 THR MG 1 117 ALA H 4.490 . 5.160 4.040 3.862 4.292 . 0 0 "[ . 1 . 2]" 1
1207 1 118 LYS H 1 118 LYS HB3 3.960 . 4.550 2.789 2.632 2.873 . 0 0 "[ . 1 . 2]" 1
1208 1 118 LYS H 1 118 LYS HB2 4.100 . 4.720 3.636 3.607 3.665 . 0 0 "[ . 1 . 2]" 1
1209 1 118 LYS H 1 118 LYS HG3 4.320 . 4.970 2.668 2.125 3.031 . 0 0 "[ . 1 . 2]" 1
1210 1 117 ALA MB 1 118 LYS H 3.430 . 3.940 2.519 2.326 2.847 . 0 0 "[ . 1 . 2]" 1
1211 1 118 LYS HA 1 119 THR H 3.370 . 3.880 2.223 2.142 2.358 . 0 0 "[ . 1 . 2]" 1
1212 1 118 LYS HB2 1 119 THR H 4.390 . 5.050 3.936 3.249 4.228 . 0 0 "[ . 1 . 2]" 1
1213 1 118 LYS HG3 1 119 THR H 4.570 . 5.260 4.796 4.490 5.038 . 0 0 "[ . 1 . 2]" 1
1214 1 119 THR H 1 119 THR MG 3.660 . 4.210 2.527 2.353 3.088 . 0 0 "[ . 1 . 2]" 1
1215 1 120 GLU H 1 121 TRP HE3 4.100 . 4.720 3.131 2.781 3.862 . 0 0 "[ . 1 . 2]" 1
1216 1 120 GLU H 1 121 TRP HZ3 4.140 . 4.760 3.391 2.978 4.229 . 0 0 "[ . 1 . 2]" 1
1217 1 120 GLU H 1 121 TRP HA 5.220 . 6.000 5.181 5.092 5.304 . 0 0 "[ . 1 . 2]" 1
1218 1 119 THR HA 1 120 GLU H 3.420 . 3.930 2.233 2.185 2.310 . 0 0 "[ . 1 . 2]" 1
1219 1 118 LYS QE 1 120 GLU H 5.010 . 5.760 4.196 3.048 5.476 . 0 0 "[ . 1 . 2]" 1
1220 1 119 THR HB 1 120 GLU H 4.390 . 5.050 4.090 4.014 4.168 . 0 0 "[ . 1 . 2]" 1
1221 1 120 GLU H 1 120 GLU HG2 4.060 . 4.670 1.955 1.808 2.159 . 0 0 "[ . 1 . 2]" 1
1222 1 120 GLU H 1 120 GLU HG3 4.060 . 4.670 3.135 2.978 3.344 . 0 0 "[ . 1 . 2]" 1
1223 1 120 GLU H 1 120 GLU HB2 3.670 . 4.220 3.608 3.568 3.665 . 0 0 "[ . 1 . 2]" 1
1224 1 120 GLU H 1 120 GLU HB3 3.490 . 4.010 2.704 2.573 2.834 . 0 0 "[ . 1 . 2]" 1
1225 1 118 LYS HG3 1 120 GLU H 4.410 . 5.070 4.656 4.158 5.185 0.115 5 0 "[ . 1 . 2]" 1
1226 1 119 THR MG 1 120 GLU H 4.390 . 5.050 4.253 4.192 4.342 . 0 0 "[ . 1 . 2]" 1
1227 1 120 GLU H 1 121 TRP H 3.650 . 4.200 2.531 2.434 2.670 . 0 0 "[ . 1 . 2]" 1
1228 1 121 TRP H 1 122 LEU H 3.670 . 4.220 2.623 2.505 2.730 . 0 0 "[ . 1 . 2]" 1
1229 1 119 THR HA 1 121 TRP H 4.310 . 4.960 3.588 3.419 3.782 . 0 0 "[ . 1 . 2]" 1
1230 1 121 TRP H 1 121 TRP HB2 3.820 . 4.390 3.631 3.603 3.663 . 0 0 "[ . 1 . 2]" 1
1231 1 121 TRP H 1 121 TRP HB3 3.660 . 4.210 2.735 2.598 2.809 . 0 0 "[ . 1 . 2]" 1
1232 1 120 GLU HG2 1 121 TRP H 4.430 . 5.090 2.986 2.719 3.380 . 0 0 "[ . 1 . 2]" 1
1233 1 120 GLU HG3 1 121 TRP H 4.430 . 5.090 2.775 2.426 3.051 . 0 0 "[ . 1 . 2]" 1
1234 1 120 GLU HB3 1 121 TRP H 4.310 . 4.960 4.190 4.057 4.276 . 0 0 "[ . 1 . 2]" 1
1235 1 120 GLU HA 1 122 LEU H 4.450 . 5.120 3.525 3.294 3.834 . 0 0 "[ . 1 . 2]" 1
1236 1 119 THR HB 1 122 LEU H 4.420 . 5.080 3.604 3.138 4.004 . 0 0 "[ . 1 . 2]" 1
1237 1 122 LEU H 1 122 LEU HB2 4.180 . 4.810 2.437 2.190 2.628 . 0 0 "[ . 1 . 2]" 1
1238 1 122 LEU H 1 122 LEU MD1 4.190 . 4.820 3.670 2.552 4.196 . 0 0 "[ . 1 . 2]" 1
1239 1 122 LEU H 1 122 LEU MD2 4.190 . 4.820 3.391 2.392 4.172 . 0 0 "[ . 1 . 2]" 1
1240 1 122 LEU H 1 122 LEU HB3 4.180 . 4.810 3.627 3.470 3.697 . 0 0 "[ . 1 . 2]" 1
1241 1 124 GLY H 1 125 LYS H 4.030 . 4.630 2.639 2.271 2.943 . 0 0 "[ . 1 . 2]" 1
1242 1 123 ASP H 1 124 GLY H 4.600 . 5.290 4.601 4.509 4.672 . 0 0 "[ . 1 . 2]" 1
1243 1 125 LYS H 1 125 LYS HB2 3.900 . 4.490 2.481 2.193 2.820 . 0 0 "[ . 1 . 2]" 1
1244 1 125 LYS H 1 125 LYS HB3 3.900 . 4.490 3.159 2.498 3.819 . 0 0 "[ . 1 . 2]" 1
1245 1 125 LYS H 1 125 LYS QG 4.200 . 4.830 3.775 2.397 4.218 . 0 0 "[ . 1 . 2]" 1
1246 1 125 LYS HB2 1 126 HIS H 4.110 . 4.730 3.460 2.889 3.782 . 0 0 "[ . 1 . 2]" 1
1247 1 125 LYS HB3 1 126 HIS H 4.110 . 4.730 2.280 1.755 2.975 0.045 1 0 "[ . 1 . 2]" 1
1248 1 127 VAL H 1 127 VAL MG1 4.060 . 4.670 2.940 1.982 3.819 . 0 0 "[ . 1 . 2]" 1
1249 1 127 VAL H 1 127 VAL MG2 4.060 . 4.670 2.799 1.779 3.820 0.021 10 0 "[ . 1 . 2]" 1
1250 1 128 VAL H 1 128 VAL MG2 3.940 . 4.530 2.027 1.871 2.234 . 0 0 "[ . 1 . 2]" 1
1251 1 128 VAL MG1 1 129 PHE H 3.800 . 4.370 2.273 2.091 2.453 . 0 0 "[ . 1 . 2]" 1
1252 1 128 VAL MG2 1 129 PHE H 4.090 . 4.700 4.083 4.006 4.162 . 0 0 "[ . 1 . 2]" 1
1253 1 130 GLY H 1 131 LYS H 4.380 . 5.040 4.406 4.364 4.476 . 0 0 "[ . 1 . 2]" 1
1254 1 129 PHE H 1 130 GLY H 3.150 . 3.620 1.787 1.724 1.930 0.076 8 0 "[ . 1 . 2]" 1
1255 1 98 LEU H 1 130 GLY H 4.040 . 4.650 3.802 3.582 4.024 . 0 0 "[ . 1 . 2]" 1
1256 1 128 VAL HA 1 130 GLY H 4.050 . 4.660 3.882 3.721 4.119 . 0 0 "[ . 1 . 2]" 1
1257 1 130 GLY H 1 131 LYS QB 4.860 . 5.590 4.869 4.712 5.123 . 0 0 "[ . 1 . 2]" 1
1258 1 128 VAL MG1 1 130 GLY H 3.500 . 4.030 2.298 2.048 2.891 . 0 0 "[ . 1 . 2]" 1
1259 1 128 VAL MG2 1 130 GLY H 5.550 . 6.380 4.841 4.684 5.107 . 0 0 "[ . 1 . 2]" 1
1260 1 131 LYS H 1 132 VAL H 4.410 . 5.070 4.176 4.023 4.314 . 0 0 "[ . 1 . 2]" 1
1261 1 23 GLU H 1 131 LYS H 3.700 . 4.260 2.571 1.922 3.319 . 0 0 "[ . 1 . 2]" 1
1262 1 24 LEU HA 1 131 LYS H 4.170 . 4.800 4.025 3.829 4.367 . 0 0 "[ . 1 . 2]" 1
1263 1 130 GLY HA2 1 131 LYS H 3.540 . 4.070 2.366 2.266 2.501 . 0 0 "[ . 1 . 2]" 1
1264 1 130 GLY HA3 1 131 LYS H 3.540 . 4.070 2.688 2.565 2.830 . 0 0 "[ . 1 . 2]" 1
1265 1 131 LYS H 1 131 LYS QB 3.510 . 4.040 2.712 2.634 2.799 . 0 0 "[ . 1 . 2]" 1
1266 1 23 GLU HB3 1 131 LYS H 3.950 . 4.540 3.497 3.078 3.971 . 0 0 "[ . 1 . 2]" 1
1267 1 131 LYS H 1 131 LYS HG2 4.300 . 4.950 4.506 4.393 4.600 . 0 0 "[ . 1 . 2]" 1
1268 1 133 LYS H 1 134 GLU H 3.250 . 3.740 2.173 1.846 2.415 . 0 0 "[ . 1 . 2]" 1
1269 1 21 SER H 1 134 GLU H 3.580 . 4.120 3.289 2.933 3.532 . 0 0 "[ . 1 . 2]" 1
1270 1 132 VAL HA 1 134 GLU H 3.890 . 4.470 3.636 3.450 4.057 . 0 0 "[ . 1 . 2]" 1
1271 1 134 GLU H 1 134 GLU QG 4.080 . 4.690 3.198 2.677 3.988 . 0 0 "[ . 1 . 2]" 1
1272 1 134 GLU H 1 134 GLU HB3 4.030 . 4.630 3.847 3.637 3.938 . 0 0 "[ . 1 . 2]" 1
1273 1 134 GLU H 1 134 GLU HB2 3.610 . 4.150 2.786 2.640 2.937 . 0 0 "[ . 1 . 2]" 1
1274 1 133 LYS HB3 1 134 GLU H 4.300 . 4.950 4.046 3.846 4.267 . 0 0 "[ . 1 . 2]" 1
1275 1 136 MET H 1 136 MET HG3 4.460 . 5.130 4.486 4.417 4.545 . 0 0 "[ . 1 . 2]" 1
1276 1 132 VAL QG 1 136 MET H 4.500 . 5.180 2.822 2.673 3.139 . 0 0 "[ . 1 . 2]" 1
1277 1 137 ASN H 1 138 ILE H 4.050 . 4.660 2.695 2.607 2.803 . 0 0 "[ . 1 . 2]" 1
1278 1 137 ASN H 1 138 ILE HB 5.560 . 6.390 4.963 4.844 5.057 . 0 0 "[ . 1 . 2]" 1
1279 1 138 ILE H 1 140 GLU H 4.280 . 4.920 4.111 3.813 4.332 . 0 0 "[ . 1 . 2]" 1
1280 1 138 ILE H 1 139 VAL H 3.320 . 3.820 2.569 2.457 2.812 . 0 0 "[ . 1 . 2]" 1
1281 1 136 MET HA 1 138 ILE H 4.580 . 5.270 4.178 3.992 4.371 . 0 0 "[ . 1 . 2]" 1
1282 1 138 ILE H 1 138 ILE HB 3.340 . 3.840 2.546 2.472 2.601 . 0 0 "[ . 1 . 2]" 1
1283 1 138 ILE H 1 141 ALA MB 4.580 . 5.270 4.488 4.314 4.722 . 0 0 "[ . 1 . 2]" 1
1284 1 138 ILE H 1 138 ILE MD 3.400 . 3.910 3.241 3.096 3.452 . 0 0 "[ . 1 . 2]" 1
1285 1 136 MET HA 1 139 VAL H 3.660 . 4.210 3.306 3.010 3.552 . 0 0 "[ . 1 . 2]" 1
1286 1 138 ILE HB 1 139 VAL H 3.420 . 3.930 2.716 2.410 2.871 . 0 0 "[ . 1 . 2]" 1
1287 1 139 VAL H 1 139 VAL HB 3.640 . 4.190 2.536 2.448 2.616 . 0 0 "[ . 1 . 2]" 1
1288 1 139 VAL H 1 140 GLU QB 5.260 . 6.050 4.661 4.560 4.874 . 0 0 "[ . 1 . 2]" 1
1289 1 139 VAL H 1 139 VAL MG1 3.870 . 4.450 3.804 3.781 3.826 . 0 0 "[ . 1 . 2]" 1
1290 1 138 ILE MG 1 139 VAL H 3.810 . 4.380 3.586 3.091 3.720 . 0 0 "[ . 1 . 2]" 1
1291 1 140 GLU H 1 141 ALA H 3.230 . 3.710 2.556 2.463 2.637 . 0 0 "[ . 1 . 2]" 1
1292 1 139 VAL H 1 140 GLU H 3.340 . 3.840 2.673 2.588 2.844 . 0 0 "[ . 1 . 2]" 1
1293 1 142 MET H 1 144 ARG H 4.340 . 4.990 4.181 3.951 4.402 . 0 0 "[ . 1 . 2]" 1
1294 1 136 MET HA 1 140 GLU H 4.470 . 5.140 4.273 4.085 4.498 . 0 0 "[ . 1 . 2]" 1
1295 1 138 ILE HA 1 140 GLU H 4.850 . 5.580 4.472 4.253 4.615 . 0 0 "[ . 1 . 2]" 1
1296 1 142 MET H 1 142 MET HB2 3.650 . 4.200 3.387 2.528 3.686 . 0 0 "[ . 1 . 2]" 1
1297 1 139 VAL HB 1 140 GLU H 3.580 . 4.120 2.606 2.481 2.741 . 0 0 "[ . 1 . 2]" 1
1298 1 140 GLU H 1 140 GLU HG3 3.810 . 4.380 2.288 2.158 2.424 . 0 0 "[ . 1 . 2]" 1
1299 1 140 GLU H 1 140 GLU QB 3.320 . 3.820 2.428 2.379 2.486 . 0 0 "[ . 1 . 2]" 1
1300 1 140 GLU H 1 141 ALA MB 4.370 . 5.030 4.261 4.165 4.334 . 0 0 "[ . 1 . 2]" 1
1301 1 139 VAL MG1 1 140 GLU H 4.190 . 4.820 3.450 3.300 3.590 . 0 0 "[ . 1 . 2]" 1
1302 1 10 ILE MG 1 142 MET H 5.140 . 5.910 4.662 4.071 5.955 0.045 4 0 "[ . 1 . 2]" 1
1303 1 116 THR MG 1 140 GLU H 5.340 . 6.140 4.008 3.315 4.571 . 0 0 "[ . 1 . 2]" 1
1304 1 139 VAL H 1 141 ALA H 4.360 . 5.010 3.913 3.733 4.231 . 0 0 "[ . 1 . 2]" 1
1305 1 138 ILE HA 1 141 ALA H 3.860 . 4.440 3.327 3.160 3.688 . 0 0 "[ . 1 . 2]" 1
1306 1 140 GLU HG3 1 141 ALA H 4.410 . 5.070 4.430 4.266 4.562 . 0 0 "[ . 1 . 2]" 1
1307 1 140 GLU QB 1 141 ALA H 3.750 . 4.310 2.835 2.556 3.063 . 0 0 "[ . 1 . 2]" 1
1308 1 141 ALA H 1 141 ALA MB 2.830 . 3.250 2.267 2.252 2.290 . 0 0 "[ . 1 . 2]" 1
1309 1 138 ILE MG 1 141 ALA H 4.650 . 5.350 4.631 4.440 4.807 . 0 0 "[ . 1 . 2]" 1
1310 1 139 VAL HA 1 142 MET H 3.850 . 4.430 3.592 3.282 3.851 . 0 0 "[ . 1 . 2]" 1
1311 1 138 ILE HA 1 142 MET H 4.560 . 5.240 4.059 3.769 4.500 . 0 0 "[ . 1 . 2]" 1
1312 1 141 ALA MB 1 142 MET H 3.260 . 3.750 2.561 2.307 2.929 . 0 0 "[ . 1 . 2]" 1
1313 1 138 ILE MG 1 142 MET H 4.310 . 4.960 4.028 3.769 4.270 . 0 0 "[ . 1 . 2]" 1
1314 1 142 MET H 1 143 GLU H 3.360 . 3.860 2.545 2.356 2.724 . 0 0 "[ . 1 . 2]" 1
1315 1 141 ALA H 1 143 GLU H 4.550 . 5.230 3.913 3.693 4.120 . 0 0 "[ . 1 . 2]" 1
1316 1 140 GLU HA 1 143 GLU H 3.820 . 4.390 3.496 2.976 3.826 . 0 0 "[ . 1 . 2]" 1
1317 1 143 GLU H 1 143 GLU HB2 3.410 . 3.920 2.485 2.400 2.560 . 0 0 "[ . 1 . 2]" 1
1318 1 142 MET ME 1 143 GLU H 5.050 . 5.810 4.554 4.240 5.779 . 0 0 "[ . 1 . 2]" 1
1319 1 143 GLU H 1 143 GLU HB3 3.410 . 3.920 2.550 2.420 2.671 . 0 0 "[ . 1 . 2]" 1
1320 1 141 ALA MB 1 143 GLU H 4.710 . 5.420 4.447 4.355 4.576 . 0 0 "[ . 1 . 2]" 1
1321 1 116 THR MG 1 143 GLU H 4.600 . 5.290 4.183 3.380 4.702 . 0 0 "[ . 1 . 2]" 1
1322 1 143 GLU H 1 144 ARG H 3.360 . 3.860 2.729 2.605 2.863 . 0 0 "[ . 1 . 2]" 1
1323 1 144 ARG H 1 145 PHE H 3.380 . 3.890 2.610 2.416 2.711 . 0 0 "[ . 1 . 2]" 1
1324 1 141 ALA HA 1 144 ARG H 3.820 . 4.390 3.746 3.438 4.050 . 0 0 "[ . 1 . 2]" 1
1325 1 143 GLU HB2 1 144 ARG H 4.240 . 4.880 3.988 3.825 4.096 . 0 0 "[ . 1 . 2]" 1
1326 1 143 GLU HB3 1 144 ARG H 4.240 . 4.880 2.809 2.458 2.985 . 0 0 "[ . 1 . 2]" 1
1327 1 144 ARG H 1 144 ARG HB3 3.950 . 4.540 3.608 3.578 3.642 . 0 0 "[ . 1 . 2]" 1
1328 1 56 ILE MG 1 144 ARG H 4.970 . 5.720 4.453 4.298 4.605 . 0 0 "[ . 1 . 2]" 1
1329 1 145 PHE H 1 145 PHE QD 3.750 . 4.310 3.050 2.317 3.413 . 0 0 "[ . 1 . 2]" 1
1330 1 142 MET HA 1 145 PHE H 4.040 . 4.650 3.529 3.097 3.738 . 0 0 "[ . 1 . 2]" 1
1331 1 143 GLU HA 1 145 PHE H 4.390 . 5.050 3.943 3.649 4.273 . 0 0 "[ . 1 . 2]" 1
1332 1 145 PHE H 1 145 PHE HB2 3.960 . 4.550 2.482 2.430 2.537 . 0 0 "[ . 1 . 2]" 1
1333 1 145 PHE H 1 145 PHE HB3 3.960 . 4.550 3.652 3.627 3.687 . 0 0 "[ . 1 . 2]" 1
1334 1 144 ARG HB2 1 145 PHE H 4.170 . 4.800 3.231 3.042 3.493 . 0 0 "[ . 1 . 2]" 1
1335 1 144 ARG HB3 1 145 PHE H 4.170 . 4.800 4.131 3.969 4.279 . 0 0 "[ . 1 . 2]" 1
1336 1 56 ILE MG 1 145 PHE H 4.370 . 5.030 3.973 3.740 4.217 . 0 0 "[ . 1 . 2]" 1
1337 1 56 ILE MD 1 145 PHE H 6.000 . 6.900 4.521 4.078 4.978 . 0 0 "[ . 1 . 2]" 1
1338 1 145 PHE H 1 156 ILE MD 4.440 . 5.110 3.766 3.545 4.334 . 0 0 "[ . 1 . 2]" 1
1339 1 146 GLY H 1 147 SER H 4.710 . 5.420 4.520 4.395 4.607 . 0 0 "[ . 1 . 2]" 1
1340 1 145 PHE H 1 146 GLY H 3.240 . 3.730 2.485 2.279 2.647 . 0 0 "[ . 1 . 2]" 1
1341 1 144 ARG HA 1 146 GLY H 4.120 . 4.740 3.601 3.142 3.913 . 0 0 "[ . 1 . 2]" 1
1342 1 143 GLU HA 1 146 GLY H 4.060 . 4.670 3.774 3.274 4.109 . 0 0 "[ . 1 . 2]" 1
1343 1 56 ILE HB 1 146 GLY H 5.320 . 6.120 3.914 3.599 4.350 . 0 0 "[ . 1 . 2]" 1
1344 1 56 ILE MG 1 146 GLY H 3.580 . 4.120 2.891 2.629 3.053 . 0 0 "[ . 1 . 2]" 1
1345 1 56 ILE MD 1 146 GLY H 5.230 . 6.010 4.133 3.748 4.639 . 0 0 "[ . 1 . 2]" 1
1346 1 147 SER H 1 150 GLY H 4.190 . 4.820 3.746 3.553 3.915 . 0 0 "[ . 1 . 2]" 1
1347 1 147 SER H 1 151 LYS H 4.240 . 4.880 3.962 3.649 4.369 . 0 0 "[ . 1 . 2]" 1
1348 1 57 ILE HA 1 147 SER H 3.920 . 4.510 3.413 3.128 3.664 . 0 0 "[ . 1 . 2]" 1
1349 1 58 PRO HD3 1 147 SER H 3.650 . 4.200 3.248 2.931 3.567 . 0 0 "[ . 1 . 2]" 1
1350 1 58 PRO HD2 1 147 SER H 3.830 . 4.400 4.190 3.819 4.466 0.066 9 0 "[ . 1 . 2]" 1
1351 1 147 SER H 1 151 LYS QB 4.980 . 5.730 4.418 4.048 4.916 . 0 0 "[ . 1 . 2]" 1
1352 1 56 ILE HB 1 147 SER H 4.320 . 4.970 3.851 3.679 4.082 . 0 0 "[ . 1 . 2]" 1
1353 1 149 ASN H 1 150 GLY H 4.180 . 4.810 2.519 2.313 2.675 . 0 0 "[ . 1 . 2]" 1
1354 1 150 GLY H 1 151 LYS H 3.630 . 4.170 2.451 2.178 2.837 . 0 0 "[ . 1 . 2]" 1
1355 1 57 ILE QG 1 150 GLY H 4.030 . 4.630 2.869 2.373 3.711 . 0 0 "[ . 1 . 2]" 1
1356 1 57 ILE MD 1 150 GLY H 4.580 . 5.270 3.922 3.297 4.889 . 0 0 "[ . 1 . 2]" 1
1357 1 149 ASN HA 1 151 LYS H 4.460 . 5.130 4.626 4.488 4.800 . 0 0 "[ . 1 . 2]" 1
1358 1 151 LYS H 1 151 LYS QB 3.070 . 3.530 2.261 2.210 2.308 . 0 0 "[ . 1 . 2]" 1
1359 1 151 LYS H 1 152 THR H 4.740 . 5.450 4.583 4.404 4.697 . 0 0 "[ . 1 . 2]" 1
1360 1 151 LYS HA 1 152 THR H 2.930 . 3.370 2.223 2.077 2.393 . 0 0 "[ . 1 . 2]" 1
1361 1 152 THR H 1 152 THR MG 3.800 . 4.370 2.880 2.462 3.822 . 0 0 "[ . 1 . 2]" 1
1362 1 153 SER H 1 154 LYS H 3.720 . 4.280 2.550 2.079 2.789 . 0 0 "[ . 1 . 2]" 1
1363 1 152 THR HA 1 153 SER H 3.560 . 4.090 2.159 2.102 2.372 . 0 0 "[ . 1 . 2]" 1
1364 1 152 THR MG 1 153 SER H 4.050 . 4.660 3.836 2.868 4.212 . 0 0 "[ . 1 . 2]" 1
1365 1 152 THR HA 1 154 LYS H 4.210 . 4.840 3.659 3.427 4.042 . 0 0 "[ . 1 . 2]" 1
1366 1 145 PHE HB2 1 154 LYS H 4.430 . 5.090 4.211 3.962 4.754 . 0 0 "[ . 1 . 2]" 1
1367 1 145 PHE HB3 1 154 LYS H 4.430 . 5.090 2.920 2.542 3.512 . 0 0 "[ . 1 . 2]" 1
1368 1 154 LYS H 1 154 LYS HG2 4.480 . 5.150 3.012 2.754 3.224 . 0 0 "[ . 1 . 2]" 1
1369 1 152 THR MG 1 154 LYS H 4.020 . 4.620 3.977 1.969 4.640 0.020 4 0 "[ . 1 . 2]" 1
1370 1 154 LYS H 1 154 LYS HG3 4.480 . 5.150 4.219 4.021 4.433 . 0 0 "[ . 1 . 2]" 1
1371 1 154 LYS H 1 156 ILE MD 4.190 . 4.820 4.148 3.571 4.568 . 0 0 "[ . 1 . 2]" 1
1372 1 154 LYS HA 1 155 LYS H 3.100 . 3.570 2.251 2.164 2.322 . 0 0 "[ . 1 . 2]" 1
1373 1 13 ASP HA 1 155 LYS H 3.960 . 4.550 3.541 2.745 4.536 . 0 0 "[ . 1 . 2]" 1
1374 1 155 LYS H 1 155 LYS QB 3.420 . 3.930 2.345 2.221 2.542 . 0 0 "[ . 1 . 2]" 1
1375 1 155 LYS H 1 156 ILE MD 5.150 . 5.920 5.641 5.351 5.897 . 0 0 "[ . 1 . 2]" 1
1376 1 152 THR HB 1 156 ILE H 4.270 . 4.910 3.961 3.461 4.700 . 0 0 "[ . 1 . 2]" 1
1377 1 155 LYS HA 1 156 ILE H 3.120 . 3.590 2.209 2.135 2.261 . 0 0 "[ . 1 . 2]" 1
1378 1 156 ILE H 1 156 ILE HB 3.800 . 4.370 2.524 2.400 2.601 . 0 0 "[ . 1 . 2]" 1
1379 1 155 LYS QB 1 156 ILE H 4.360 . 5.010 3.933 3.661 4.056 . 0 0 "[ . 1 . 2]" 1
1380 1 156 ILE H 1 156 ILE QG 3.690 . 4.240 2.343 2.131 2.544 . 0 0 "[ . 1 . 2]" 1
1381 1 152 THR MG 1 156 ILE H 4.330 . 4.980 3.840 3.247 4.511 . 0 0 "[ . 1 . 2]" 1
1382 1 156 ILE H 1 156 ILE MG 4.220 . 4.850 3.823 3.767 3.852 . 0 0 "[ . 1 . 2]" 1
1383 1 11 ALA H 1 157 THR H 3.730 . 4.290 3.213 2.610 3.649 . 0 0 "[ . 1 . 2]" 1
1384 1 156 ILE HA 1 157 THR H 3.130 . 3.600 2.170 2.094 2.323 . 0 0 "[ . 1 . 2]" 1
1385 1 12 VAL HA 1 157 THR H 4.280 . 4.920 3.913 3.383 4.267 . 0 0 "[ . 1 . 2]" 1
1386 1 156 ILE QG 1 157 THR H 4.450 . 5.120 4.261 4.130 4.458 . 0 0 "[ . 1 . 2]" 1
1387 1 157 THR H 1 157 THR MG 3.660 . 4.210 2.966 2.455 3.207 . 0 0 "[ . 1 . 2]" 1
1388 1 156 ILE MG 1 157 THR H 3.550 . 4.080 2.902 2.194 3.342 . 0 0 "[ . 1 . 2]" 1
1389 1 156 ILE MD 1 157 THR H 5.260 . 6.050 5.286 4.892 5.540 . 0 0 "[ . 1 . 2]" 1
1390 1 52 CYS HA 1 158 ILE H 4.060 . 4.670 3.667 3.168 4.092 . 0 0 "[ . 1 . 2]" 1
1391 1 157 THR HA 1 158 ILE H 3.480 . 4.000 2.323 2.256 2.437 . 0 0 "[ . 1 . 2]" 1
1392 1 157 THR HB 1 158 ILE H 3.690 . 4.240 2.852 2.413 3.845 . 0 0 "[ . 1 . 2]" 1
1393 1 158 ILE H 1 158 ILE HB 3.870 . 4.450 2.493 2.433 2.551 . 0 0 "[ . 1 . 2]" 1
1394 1 158 ILE H 1 158 ILE MG 3.880 . 4.460 3.819 3.795 3.848 . 0 0 "[ . 1 . 2]" 1
1395 1 158 ILE H 1 158 ILE MD 4.100 . 4.720 3.824 3.719 4.002 . 0 0 "[ . 1 . 2]" 1
1396 1 11 ALA H 1 159 ALA H 4.180 . 4.810 3.343 2.722 3.723 . 0 0 "[ . 1 . 2]" 1
1397 1 10 ILE HA 1 159 ALA H 3.980 . 4.580 3.349 2.756 3.602 . 0 0 "[ . 1 . 2]" 1
1398 1 158 ILE HA 1 159 ALA H 3.290 . 3.780 2.201 2.149 2.272 . 0 0 "[ . 1 . 2]" 1
1399 1 159 ALA H 1 159 ALA MB 3.100 . 3.570 2.231 2.208 2.255 . 0 0 "[ . 1 . 2]" 1
1400 1 10 ILE MG 1 159 ALA H 4.790 . 5.510 5.061 4.438 5.377 . 0 0 "[ . 1 . 2]" 1
1401 1 10 ILE MD 1 159 ALA H 5.030 . 5.780 4.303 3.835 4.550 . 0 0 "[ . 1 . 2]" 1
1402 1 158 ILE MG 1 159 ALA H 3.850 . 4.430 3.439 3.127 3.532 . 0 0 "[ . 1 . 2]" 1
1403 1 160 ASP HA 1 161 CYS H 3.030 . 3.480 2.432 2.266 2.627 . 0 0 "[ . 1 . 2]" 1
1404 1 7 PHE H 1 162 GLY H 4.290 . 4.930 4.185 3.913 4.441 . 0 0 "[ . 1 . 2]" 1
1405 1 161 CYS H 1 162 GLY H 4.370 . 5.030 4.324 4.270 4.391 . 0 0 "[ . 1 . 2]" 1
1406 1 8 PHE HA 1 162 GLY H 4.290 . 4.930 4.739 4.437 4.937 0.007 15 0 "[ . 1 . 2]" 1
1407 1 161 CYS HA 1 162 GLY H 3.330 . 3.830 2.825 2.787 2.902 . 0 0 "[ . 1 . 2]" 1
1408 1 158 ILE MG 1 162 GLY H 5.410 . 6.220 5.845 5.634 6.062 . 0 0 "[ . 1 . 2]" 1
1409 1 7 PHE H 1 163 GLN H 3.890 . 4.470 3.621 3.450 3.846 . 0 0 "[ . 1 . 2]" 1
1410 1 162 GLY H 1 163 GLN H 4.330 . 4.980 2.168 1.990 2.341 . 0 0 "[ . 1 . 2]" 1
1411 1 163 GLN H 1 163 GLN QB 3.680 . 4.230 2.350 2.155 2.573 . 0 0 "[ . 1 . 2]" 1
1412 1 41 THR MG 1 163 GLN H 3.520 . 4.050 3.628 3.138 4.039 . 0 0 "[ . 1 . 2]" 1
1413 1 6 VAL QG 1 163 GLN H . . 4.930 4.497 3.778 5.028 0.098 19 0 "[ . 1 . 2]" 1
1414 1 164 LEU H 1 164 LEU MD1 3.980 . 4.580 3.766 3.603 3.993 . 0 0 "[ . 1 . 2]" 1
1415 1 163 GLN HA 1 165 GLU H 5.150 . 5.920 5.606 5.359 5.981 0.061 15 0 "[ . 1 . 2]" 1
1416 1 164 LEU HA 1 165 GLU H 3.010 . 3.460 2.205 2.141 2.305 . 0 0 "[ . 1 . 2]" 1
1417 1 164 LEU QB 1 165 GLU H 4.060 . 4.670 3.583 3.302 3.742 . 0 0 "[ . 1 . 2]" 1
1418 1 35 ASN HD21 1 39 LEU MD1 4.700 . 5.400 3.729 3.449 4.043 . 0 0 "[ . 1 . 2]" 1
1419 1 102 ASN HD22 1 103 ALA HA 5.020 . 5.770 5.615 5.043 5.797 0.027 6 0 "[ . 1 . 2]" 1
1420 1 3 ASN HA 1 3 ASN HD22 4.380 . 5.040 3.799 3.486 4.075 . 0 0 "[ . 1 . 2]" 1
1421 1 3 ASN HD21 1 27 ASP H 4.430 . 5.090 3.621 2.838 5.098 0.008 5 0 "[ . 1 . 2]" 1
1422 1 3 ASN HA 1 3 ASN HD21 4.380 . 5.040 2.651 1.853 3.358 . 0 0 "[ . 1 . 2]" 1
1423 1 97 ILE MD 1 131 LYS H 5.300 . 6.100 5.542 4.936 5.805 . 0 0 "[ . 1 . 2]" 1
1424 1 142 MET H 1 142 MET HB3 3.650 . 4.200 2.874 2.526 3.690 . 0 0 "[ . 1 . 2]" 1
1425 1 151 LYS QB 1 152 THR H 3.810 . 4.380 3.702 3.490 3.896 . 0 0 "[ . 1 . 2]" 1
1426 1 141 ALA H 1 142 MET H 3.310 . 3.810 2.602 2.493 2.757 . 0 0 "[ . 1 . 2]" 1
1427 1 60 PHE H 1 61 MET H 3.320 . 3.820 2.513 2.379 2.702 . 0 0 "[ . 1 . 2]" 1
1428 1 159 ALA H 1 160 ASP H 3.220 . 3.700 2.868 2.768 2.955 . 0 0 "[ . 1 . 2]" 1
1429 1 3 ASN HD22 1 27 ASP H 4.430 . 5.090 3.737 2.896 4.840 . 0 0 "[ . 1 . 2]" 1
1430 1 98 LEU HB2 1 99 SER H 4.770 . 5.490 4.332 4.246 4.439 . 0 0 "[ . 1 . 2]" 1
1431 1 98 LEU HG 1 99 SER H 5.520 . 6.350 3.547 3.202 4.404 . 0 0 "[ . 1 . 2]" 1
1432 1 30 PRO HG3 1 31 LYS H 4.000 . 4.600 4.212 3.754 4.619 0.019 17 0 "[ . 1 . 2]" 1
1433 1 32 THR H 1 33 ALA MB 4.560 . 5.240 4.271 4.136 4.435 . 0 0 "[ . 1 . 2]" 1
1434 1 82 LYS HB2 1 107 THR H 4.830 . 5.550 4.852 4.297 5.270 . 0 0 "[ . 1 . 2]" 1
1435 1 82 LYS HD3 1 107 THR H 5.260 . 6.050 5.947 4.323 6.263 0.213 2 0 "[ . 1 . 2]" 1
1436 1 92 HIS H 1 128 VAL MG2 4.550 . 5.230 3.621 3.331 3.964 . 0 0 "[ . 1 . 2]" 1
1437 1 11 ALA MB 1 157 THR H 4.220 . 4.850 3.076 2.641 3.917 . 0 0 "[ . 1 . 2]" 1
1438 1 97 ILE MG 1 130 GLY H 4.520 . 5.200 4.659 4.226 4.906 . 0 0 "[ . 1 . 2]" 1
1439 1 89 ILE H 1 89 ILE MD 3.770 . 4.340 3.775 3.680 3.923 . 0 0 "[ . 1 . 2]" 1
1440 1 56 ILE H 1 57 ILE H 4.500 . 5.180 4.305 4.243 4.380 . 0 0 "[ . 1 . 2]" 1
1441 1 71 ASN H 1 72 GLY H 4.590 . 5.280 3.801 2.022 4.408 . 0 0 "[ . 1 . 2]" 1
1442 1 40 SER H 1 42 GLY H 4.120 . 4.740 3.801 3.653 3.956 . 0 0 "[ . 1 . 2]" 1
1443 1 19 ARG H 1 19 ARG HB2 4.030 . 4.630 3.180 2.478 3.882 . 0 0 "[ . 1 . 2]" 1
1444 1 97 ILE H 1 98 LEU H 4.810 . 5.530 4.414 4.312 4.559 . 0 0 "[ . 1 . 2]" 1
1445 1 50 GLY H 1 158 ILE HB 4.550 . 5.230 2.958 2.468 3.849 . 0 0 "[ . 1 . 2]" 1
1446 1 8 PHE HD1 1 9 ASP H 4.420 . 5.080 3.786 3.603 3.999 . 0 0 "[ . 1 . 2]" 1
1447 1 8 PHE HD2 1 9 ASP H 4.810 . 5.530 5.629 5.565 5.719 0.189 3 0 "[ . 1 . 2]" 1
1448 1 7 PHE HD2 1 8 PHE H 4.460 . 5.130 4.291 3.837 4.793 . 0 0 "[ . 1 . 2]" 1
1449 1 46 PHE HD2 1 47 GLY H 3.900 . 4.490 4.442 4.130 4.593 0.103 11 0 "[ . 1 . 2]" 1
1450 1 46 PHE H 1 46 PHE HD1 4.060 . 4.670 3.929 3.508 4.340 . 0 0 "[ . 1 . 2]" 1
1451 1 46 PHE H 1 46 PHE HD2 4.350 . 5.000 3.766 3.313 4.239 . 0 0 "[ . 1 . 2]" 1
1452 1 35 ASN HB2 1 79 TYR HE2 3.900 . 4.490 2.694 1.748 3.919 0.052 5 0 "[ . 1 . 2]" 1
1453 1 119 THR MG 1 121 TRP HH2 3.880 . 4.460 3.012 2.613 3.575 . 0 0 "[ . 1 . 2]" 1
1454 1 119 THR HA 1 121 TRP HZ3 3.960 . 4.550 3.360 2.904 4.306 . 0 0 "[ . 1 . 2]" 1
1455 1 121 TRP HB3 1 121 TRP HZ3 5.010 . 5.760 5.007 4.881 5.073 . 0 0 "[ . 1 . 2]" 1
1456 1 121 TRP HA 1 121 TRP HD1 4.640 . 5.340 4.590 4.508 4.662 . 0 0 "[ . 1 . 2]" 1
1457 1 121 TRP HD1 1 122 LEU HA 3.970 . 4.570 4.275 3.882 4.682 0.112 14 0 "[ . 1 . 2]" 1
1458 1 8 PHE HD2 1 22 PHE HZ 4.380 . 5.040 3.899 3.279 4.368 . 0 0 "[ . 1 . 2]" 1
1459 1 10 ILE MD 1 22 PHE HZ 3.980 . 4.580 3.473 2.993 4.078 . 0 0 "[ . 1 . 2]" 1
1460 1 8 PHE HA 1 8 PHE HD1 3.350 . 3.850 2.466 2.247 2.674 . 0 0 "[ . 1 . 2]" 1
1461 1 8 PHE HD2 1 10 ILE MD 3.320 . 3.820 3.843 3.478 3.945 0.125 10 0 "[ . 1 . 2]" 1
1462 1 8 PHE HD2 1 158 ILE MG 3.680 . 4.230 4.274 4.080 4.368 0.138 12 0 "[ . 1 . 2]" 1
1463 1 8 PHE HD2 1 158 ILE MD 4.450 . 5.120 3.733 3.402 4.084 . 0 0 "[ . 1 . 2]" 1
1464 1 32 THR HA 1 83 PHE HE2 4.220 . 4.850 3.209 2.085 4.614 . 0 0 "[ . 1 . 2]" 1
1465 1 83 PHE HE1 1 100 MET ME 4.320 . 4.970 3.863 3.391 5.863 0.893 3 1 "[ + . 1 . 2]" 1
1466 1 32 THR MG 1 83 PHE HE2 4.040 . 4.650 3.318 2.297 4.976 0.326 3 0 "[ . 1 . 2]" 1
1467 1 7 PHE HD2 1 8 PHE HA 4.210 . 4.840 3.903 3.522 4.856 0.016 3 0 "[ . 1 . 2]" 1
1468 1 88 PHE HD1 1 89 ILE H 4.910 . 5.650 5.524 4.858 5.753 0.103 8 0 "[ . 1 . 2]" 1
1469 1 88 PHE HA 1 88 PHE HD1 3.680 . 4.230 3.040 2.396 4.074 . 0 0 "[ . 1 . 2]" 1
1470 1 8 PHE HE1 1 158 ILE MG 4.250 . 4.890 3.370 3.102 3.623 . 0 0 "[ . 1 . 2]" 1
1471 1 8 PHE HE2 1 158 ILE MG 4.380 . 5.040 5.018 4.620 5.151 0.111 19 0 "[ . 1 . 2]" 1
1472 1 21 SER HA 1 22 PHE QE 5.040 . 5.800 4.835 4.441 5.306 . 0 0 "[ . 1 . 2]" 1
1473 1 10 ILE MD 1 22 PHE QE 4.910 . 5.650 3.666 3.311 3.977 . 0 0 "[ . 1 . 2]" 1
1474 1 22 PHE QE 1 139 VAL MG2 4.300 . 4.950 3.264 2.643 3.630 . 0 0 "[ . 1 . 2]" 1
1475 1 46 PHE HE2 1 78 ILE MG 3.670 . 4.220 2.741 1.930 3.475 . 0 0 "[ . 1 . 2]" 1
1476 1 57 ILE HB 1 60 PHE HD2 4.340 . 4.990 1.895 1.713 2.282 0.087 15 0 "[ . 1 . 2]" 1
1477 1 57 ILE MD 1 60 PHE HD2 3.740 . 4.300 2.545 2.090 3.481 . 0 0 "[ . 1 . 2]" 1
1478 1 100 MET HA 1 113 PHE QD 4.430 . 5.090 3.951 3.613 4.402 . 0 0 "[ . 1 . 2]" 1
1479 1 101 ALA HA 1 113 PHE QD 4.360 . 5.010 2.542 1.961 3.001 . 0 0 "[ . 1 . 2]" 1
1480 1 63 GLN HB2 1 113 PHE QD 4.420 . 5.080 4.184 3.657 4.469 . 0 0 "[ . 1 . 2]" 1
1481 1 145 PHE QD 1 154 LYS H 4.620 . 5.310 4.624 3.525 5.166 . 0 0 "[ . 1 . 2]" 1
1482 1 145 PHE HA 1 145 PHE QD 3.980 . 4.580 2.468 2.132 3.105 . 0 0 "[ . 1 . 2]" 1
1483 1 141 ALA MB 1 145 PHE QD 5.170 . 5.950 4.647 3.791 5.247 . 0 0 "[ . 1 . 2]" 1
1484 1 21 SER HA 1 22 PHE QD 4.550 . 5.230 3.746 3.309 4.351 . 0 0 "[ . 1 . 2]" 1
1485 1 22 PHE HA 1 22 PHE QD 3.690 . 4.240 2.957 2.469 3.268 . 0 0 "[ . 1 . 2]" 1
1486 1 22 PHE QD 1 132 VAL HB 4.460 . 5.130 3.870 2.279 4.906 . 0 0 "[ . 1 . 2]" 1
1487 1 7 PHE HD2 1 21 SER HA 5.440 . 6.260 6.425 6.281 6.538 0.278 14 0 "[ . 1 . 2]" 1
1488 1 7 PHE HD1 1 161 CYS HA 6.000 . 6.900 7.042 6.849 7.120 0.220 3 0 "[ . 1 . 2]" 1
1489 1 7 PHE HD2 1 161 CYS HA 6.000 . 6.900 3.796 3.287 5.025 . 0 0 "[ . 1 . 2]" 1
1490 1 7 PHE HD1 1 164 LEU HA 6.000 . 6.900 6.851 6.336 7.042 0.142 2 0 "[ . 1 . 2]" 1
1491 1 46 PHE HA 1 46 PHE HD1 3.510 . 4.040 2.184 2.077 2.349 . 0 0 "[ . 1 . 2]" 1
1492 1 45 GLY HA3 1 46 PHE HD1 3.990 . 4.590 4.723 4.630 4.879 0.289 18 0 "[ . 1 . 2]" 1
1493 1 46 PHE HD2 1 78 ILE HA 4.500 . 5.180 3.562 2.969 4.005 . 0 0 "[ . 1 . 2]" 1
1494 1 39 LEU HG 1 46 PHE HD2 3.820 . 4.390 4.345 4.192 4.454 0.064 2 0 "[ . 1 . 2]" 1
1495 1 46 PHE HD2 1 78 ILE MG 4.020 . 4.620 2.790 2.152 3.338 . 0 0 "[ . 1 . 2]" 1
1496 1 39 LEU MD2 1 46 PHE HD2 3.250 . 3.740 1.941 1.812 2.157 . 0 0 "[ . 1 . 2]" 1
1497 1 79 TYR HA 1 79 TYR HD1 3.730 . 4.290 2.738 2.328 3.028 . 0 0 "[ . 1 . 2]" 1
1498 1 83 PHE H 1 83 PHE QD 3.540 . 4.070 2.754 2.295 3.244 . 0 0 "[ . 1 . 2]" 1
1499 1 79 TYR HD2 1 83 PHE QD 3.880 . 4.460 2.968 2.413 3.621 . 0 0 "[ . 1 . 2]" 1
1500 1 77 SER HA 1 83 PHE QD 4.700 . 5.400 4.996 4.500 5.444 0.044 1 0 "[ . 1 . 2]" 1
1501 1 83 PHE QD 1 84 GLU HG2 4.640 . 5.340 4.309 3.718 4.785 . 0 0 "[ . 1 . 2]" 1
1502 1 32 THR MG 1 83 PHE QD 4.760 . 5.470 5.000 4.372 5.425 . 0 0 "[ . 1 . 2]" 1
1503 1 121 TRP H 1 121 TRP HE3 2.990 . 3.440 2.219 1.948 2.748 . 0 0 "[ . 1 . 2]" 1
1504 1 121 TRP HB3 1 121 TRP HE3 3.440 . 3.960 2.633 2.482 2.712 . 0 0 "[ . 1 . 2]" 1
1505 1 119 THR MG 1 121 TRP HE3 4.830 . 5.550 5.172 4.753 5.479 . 0 0 "[ . 1 . 2]" 1
1506 1 88 PHE QE 1 127 VAL H 4.690 . 5.390 3.848 2.565 4.638 . 0 0 "[ . 1 . 2]" 1
1507 1 88 PHE QE 1 127 VAL HA 5.210 . 5.990 4.776 3.447 5.922 . 0 0 "[ . 1 . 2]" 1
1508 1 92 HIS HD2 1 122 LEU MD1 5.200 . 5.980 4.791 2.924 6.065 0.085 5 0 "[ . 1 . 2]" 1
1509 1 92 HIS HD2 1 122 LEU MD2 5.200 . 5.980 5.112 2.782 5.820 . 0 0 "[ . 1 . 2]" 1
1510 1 92 HIS HD2 1 128 VAL MG2 3.850 . 4.430 3.229 2.622 3.683 . 0 0 "[ . 1 . 2]" 1
1511 1 60 PHE HZ 1 119 THR MG 5.470 . 6.290 4.183 3.789 5.118 . 0 0 "[ . 1 . 2]" 1
1512 1 120 GLU HB3 1 121 TRP HE3 4.640 . 5.340 4.855 4.578 5.375 0.035 13 0 "[ . 1 . 2]" 1
1513 1 63 GLN HB3 1 113 PHE QD 6.000 . 6.900 5.358 3.949 5.819 . 0 0 "[ . 1 . 2]" 1
1514 1 35 ASN HB3 1 79 TYR HE2 5.170 . 5.950 4.334 3.359 5.636 . 0 0 "[ . 1 . 2]" 1
1515 1 53 PHE HZ 1 156 ILE MG 4.620 . 5.310 4.714 4.303 5.097 . 0 0 "[ . 1 . 2]" 1
1516 1 29 VAL MG1 1 89 ILE MD 5.090 . 5.850 3.193 2.698 3.720 . 0 0 "[ . 1 . 2]" 1
1517 1 57 ILE MD 2 7 ALA MB 5.280 . 6.070 2.891 1.787 5.438 0.013 14 0 "[ . 1 . 2]" 1
1518 1 60 PHE HB2 1 119 THR MG 4.120 . 4.740 4.525 4.306 4.823 0.083 8 0 "[ . 1 . 2]" 1
1519 1 9 ASP HB3 1 159 ALA MB 4.000 . 4.600 2.512 2.174 3.005 . 0 0 "[ . 1 . 2]" 1
1520 1 158 ILE MG 1 161 CYS HB2 4.770 . 5.490 4.612 4.258 4.848 . 0 0 "[ . 1 . 2]" 1
1521 1 158 ILE MG 1 161 CYS HB3 4.770 . 5.490 3.460 2.908 4.533 . 0 0 "[ . 1 . 2]" 1
1522 1 122 LEU MD1 1 125 LYS QE 4.350 . 5.000 4.041 2.388 5.138 0.138 17 0 "[ . 1 . 2]" 1
1523 1 122 LEU MD2 1 125 LYS QE 4.350 . 5.000 3.189 1.901 4.934 . 0 0 "[ . 1 . 2]" 1
1524 1 69 ARG QB 1 73 THR MG 4.090 . 4.700 3.200 2.521 4.493 . 0 0 "[ . 1 . 2]" 1
1525 1 86 GLU HB2 1 127 VAL MG2 5.810 . 6.680 5.276 3.696 6.578 . 0 0 "[ . 1 . 2]" 1
1526 1 40 SER HB3 1 41 THR MG 4.440 . 5.110 3.591 2.808 5.098 . 0 0 "[ . 1 . 2]" 1
1527 1 32 THR HB 1 33 ALA MB 4.430 . 5.090 4.013 3.755 4.204 . 0 0 "[ . 1 . 2]" 1
1528 1 2 VAL QG 1 3 ASN H 3.770 . 4.340 2.965 2.299 3.789 . 0 0 "[ . 1 . 2]" 1
1529 1 2 VAL QG 1 26 ALA MB 4.040 . 4.650 3.846 2.718 4.761 0.111 12 0 "[ . 1 . 2]" 1
1530 1 3 ASN HA 1 3 ASN QD 3.840 . 4.420 2.591 1.846 3.209 . 0 0 "[ . 1 . 2]" 1
1531 1 3 ASN QB 1 4 PRO HD3 4.830 . 5.550 4.354 3.954 4.577 . 0 0 "[ . 1 . 2]" 1
1532 1 3 ASN QD 1 25 PHE QD 3.990 . 4.590 2.592 2.018 3.522 . 0 0 "[ . 1 . 2]" 1
1533 1 3 ASN QD 1 26 ALA H 4.530 . 5.210 2.935 2.261 3.551 . 0 0 "[ . 1 . 2]" 1
1534 1 3 ASN QD 1 26 ALA MB 4.400 . 5.060 4.186 3.632 4.830 . 0 0 "[ . 1 . 2]" 1
1535 1 3 ASN QD 1 27 ASP H 3.870 . 4.450 3.238 2.554 4.417 . 0 0 "[ . 1 . 2]" 1
1536 1 4 PRO HB2 1 6 VAL QG 4.170 . 4.800 3.633 2.999 4.283 . 0 0 "[ . 1 . 2]" 1
1537 1 4 PRO HB2 1 24 LEU QB 4.280 . 4.920 3.650 3.327 4.036 . 0 0 "[ . 1 . 2]" 1
1538 1 4 PRO HB2 1 24 LEU QD 3.240 . 3.730 3.349 2.893 3.776 0.046 11 0 "[ . 1 . 2]" 1
1539 1 4 PRO HB3 1 24 LEU QD 4.770 . 5.490 4.590 4.192 5.137 . 0 0 "[ . 1 . 2]" 1
1540 1 4 PRO HG2 1 24 LEU QD 4.120 . 4.740 2.807 2.112 3.539 . 0 0 "[ . 1 . 2]" 1
1541 1 4 PRO HG3 1 24 LEU QD 3.980 . 4.580 3.783 3.051 4.612 0.032 3 0 "[ . 1 . 2]" 1
1542 1 5 THR HB 1 164 LEU QD 4.600 . 5.290 4.286 3.202 5.278 . 0 0 "[ . 1 . 2]" 1
1543 1 5 THR MG 1 7 PHE QB 4.640 . 5.340 3.524 3.141 3.778 . 0 0 "[ . 1 . 2]" 1
1544 1 5 THR MG 1 21 SER QB 3.420 . 3.930 2.309 1.866 3.491 . 0 0 "[ . 1 . 2]" 1
1545 1 6 VAL H 1 21 SER QB 4.560 . 5.240 4.597 3.835 5.486 0.246 11 0 "[ . 1 . 2]" 1
1546 1 6 VAL HB 1 24 LEU QD 4.120 . 4.740 3.829 3.450 4.090 . 0 0 "[ . 1 . 2]" 1
1547 1 6 VAL QG 1 21 SER QB 5.120 . 5.890 4.919 4.490 5.139 . 0 0 "[ . 1 . 2]" 1
1548 1 6 VAL QG 1 22 PHE H 3.930 . 4.520 2.989 2.432 3.787 . 0 0 "[ . 1 . 2]" 1
1549 1 6 VAL QG 1 22 PHE HB3 4.350 . 5.000 3.540 3.229 4.189 . 0 0 "[ . 1 . 2]" 1
1550 1 6 VAL QG 1 22 PHE QE 4.210 . 4.840 3.917 3.503 4.291 . 0 0 "[ . 1 . 2]" 1
1551 1 6 VAL QG 1 23 GLU H 4.210 . 4.840 4.595 3.999 4.922 0.082 2 0 "[ . 1 . 2]" 1
1552 1 6 VAL QG 1 24 LEU QB 5.240 . 6.030 3.618 3.382 3.771 . 0 0 "[ . 1 . 2]" 1
1553 1 6 VAL QG 1 24 LEU QD 2.870 . 3.300 1.892 1.772 2.043 0.028 1 0 "[ . 1 . 2]" 1
1554 1 6 VAL QG 1 37 ARG H 4.450 . 5.120 4.322 3.801 4.963 . 0 0 "[ . 1 . 2]" 1
1555 1 6 VAL QG 1 40 SER QB 3.690 . 4.240 3.046 2.404 3.984 . 0 0 "[ . 1 . 2]" 1
1556 1 6 VAL QG 1 41 THR H 5.490 . 6.310 4.969 4.397 5.624 . 0 0 "[ . 1 . 2]" 1
1557 1 6 VAL QG 1 41 THR MG 4.580 . 5.270 3.991 3.151 4.968 . 0 0 "[ . 1 . 2]" 1
1558 1 6 VAL QG 1 98 LEU QD 4.110 . 4.730 3.253 2.773 3.891 . 0 0 "[ . 1 . 2]" 1
1559 1 6 VAL QG 1 131 LYS H 5.620 . 6.460 5.323 4.751 5.856 . 0 0 "[ . 1 . 2]" 1
1560 1 6 VAL QG 1 163 GLN HA 3.860 . 4.440 3.733 3.118 4.354 . 0 0 "[ . 1 . 2]" 1
1561 1 6 VAL QG 1 163 GLN QB 4.170 . 4.800 2.413 2.094 3.101 . 0 0 "[ . 1 . 2]" 1
1562 1 7 PHE H 1 164 LEU QD 4.380 . 5.040 4.786 4.351 5.126 0.086 9 0 "[ . 1 . 2]" 1
1563 1 7 PHE HA 1 21 SER QB 4.380 . 5.040 3.424 2.617 3.930 . 0 0 "[ . 1 . 2]" 1
1564 1 7 PHE QB 1 7 PHE HD1 3.220 . 3.700 2.483 2.398 2.654 . 0 0 "[ . 1 . 2]" 1
1565 1 7 PHE QB 1 8 PHE H 3.810 . 4.380 3.733 3.627 3.886 . 0 0 "[ . 1 . 2]" 1
1566 1 7 PHE QB 1 164 LEU HA 4.720 . 5.430 4.394 4.082 4.741 . 0 0 "[ . 1 . 2]" 1
1567 1 7 PHE QB 1 164 LEU QB 4.730 . 5.440 3.392 2.753 4.006 . 0 0 "[ . 1 . 2]" 1
1568 1 7 PHE QB 1 164 LEU QD 3.360 . 3.860 2.725 2.452 3.049 . 0 0 "[ . 1 . 2]" 1
1569 1 7 PHE HD1 1 164 LEU QD 3.330 . 3.830 2.933 2.559 3.482 . 0 0 "[ . 1 . 2]" 1
1570 1 7 PHE HE1 1 164 LEU QD 4.340 . 4.990 3.844 3.299 4.482 . 0 0 "[ . 1 . 2]" 1
1571 1 7 PHE HD2 1 164 LEU QD 4.970 . 5.720 4.044 3.241 4.681 . 0 0 "[ . 1 . 2]" 1
1572 1 8 PHE H 1 8 PHE QB 3.590 . 4.130 2.758 2.658 2.839 . 0 0 "[ . 1 . 2]" 1
1573 1 8 PHE H 1 20 VAL QG 4.850 . 5.580 4.302 4.096 4.529 . 0 0 "[ . 1 . 2]" 1
1574 1 8 PHE H 1 21 SER QB 4.420 . 5.080 4.708 3.526 5.184 0.104 19 0 "[ . 1 . 2]" 1
1575 1 8 PHE QB 1 9 ASP H 3.730 . 4.290 2.399 2.342 2.507 . 0 0 "[ . 1 . 2]" 1
1576 1 8 PHE QB 1 10 ILE MD 3.580 . 4.120 2.805 2.317 2.965 . 0 0 "[ . 1 . 2]" 1
1577 1 8 PHE QB 1 20 VAL QG 4.470 . 5.140 3.917 3.657 4.123 . 0 0 "[ . 1 . 2]" 1
1578 1 8 PHE QB 1 158 ILE MG 4.260 . 4.900 1.936 1.787 2.218 0.013 1 0 "[ . 1 . 2]" 1
1579 1 8 PHE HD1 1 161 CYS QB 3.500 . 4.030 2.444 2.020 3.317 . 0 0 "[ . 1 . 2]" 1
1580 1 8 PHE HZ 1 161 CYS QB 4.590 . 5.280 4.648 4.297 5.252 . 0 0 "[ . 1 . 2]" 1
1581 1 8 PHE HD2 1 20 VAL QG 4.180 . 4.810 4.194 3.523 4.758 . 0 0 "[ . 1 . 2]" 1
1582 1 9 ASP QB 1 10 ILE H 3.980 . 4.580 3.494 3.331 3.640 . 0 0 "[ . 1 . 2]" 1
1583 1 9 ASP QB 1 158 ILE MG 5.540 . 6.370 4.199 3.927 4.368 . 0 0 "[ . 1 . 2]" 1
1584 1 9 ASP QB 1 159 ALA MB 3.210 . 3.690 2.068 1.766 2.545 0.034 9 0 "[ . 1 . 2]" 1
1585 1 9 ASP QB 1 160 ASP H 3.400 . 3.910 2.227 1.829 2.730 . 0 0 "[ . 1 . 2]" 1
1586 1 10 ILE H 1 20 VAL QG 4.370 . 5.030 3.505 3.154 4.008 . 0 0 "[ . 1 . 2]" 1
1587 1 10 ILE HB 1 17 LEU QD 4.920 . 5.660 3.944 3.423 4.446 . 0 0 "[ . 1 . 2]" 1
1588 1 10 ILE HB 1 20 VAL QG 4.490 . 5.160 3.079 2.823 3.349 . 0 0 "[ . 1 . 2]" 1
1589 1 10 ILE MG 1 17 LEU QD 2.990 . 3.440 2.981 2.352 3.712 0.272 4 0 "[ . 1 . 2]" 1
1590 1 10 ILE MG 1 142 MET QG 4.180 . 4.810 3.190 2.205 3.798 . 0 0 "[ . 1 . 2]" 1
1591 1 10 ILE HG12 1 20 VAL QG 3.460 . 3.980 2.379 2.162 2.618 . 0 0 "[ . 1 . 2]" 1
1592 1 10 ILE HG13 1 20 VAL QG 3.710 . 4.270 2.234 2.118 2.416 . 0 0 "[ . 1 . 2]" 1
1593 1 10 ILE MD 1 20 VAL QG 2.800 . 3.220 3.120 3.032 3.207 . 0 0 "[ . 1 . 2]" 1
1594 1 10 ILE MD 1 158 ILE QG 3.860 . 4.440 2.588 1.974 3.156 . 0 0 "[ . 1 . 2]" 1
1595 1 11 ALA HA 1 12 VAL QG 4.780 . 5.500 3.666 3.248 3.890 . 0 0 "[ . 1 . 2]" 1
1596 1 11 ALA MB 1 12 VAL QG 4.000 . 4.600 4.271 3.853 4.385 . 0 0 "[ . 1 . 2]" 1
1597 1 12 VAL H 1 12 VAL QG 3.280 . 3.770 2.453 1.904 2.713 . 0 0 "[ . 1 . 2]" 1
1598 1 12 VAL H 1 17 LEU QD 4.150 . 4.770 3.932 3.671 4.131 . 0 0 "[ . 1 . 2]" 1
1599 1 12 VAL HA 1 12 VAL QG 2.990 . 3.440 2.192 2.171 2.271 . 0 0 "[ . 1 . 2]" 1
1600 1 12 VAL HB 1 17 LEU QD 3.980 . 4.580 3.274 2.651 3.947 . 0 0 "[ . 1 . 2]" 1
1601 1 12 VAL QG 1 13 ASP H 3.640 . 4.190 2.971 2.481 3.636 . 0 0 "[ . 1 . 2]" 1
1602 1 12 VAL QG 1 17 LEU HB2 4.080 . 4.690 2.042 1.783 2.388 0.017 17 0 "[ . 1 . 2]" 1
1603 1 12 VAL QG 1 17 LEU HB3 2.980 . 3.430 2.927 2.757 3.102 . 0 0 "[ . 1 . 2]" 1
1604 1 12 VAL QG 1 17 LEU QD 2.540 . 2.920 1.918 1.764 2.054 0.036 13 0 "[ . 1 . 2]" 1
1605 1 12 VAL QG 1 142 MET HA 4.580 . 5.270 3.513 2.758 4.448 . 0 0 "[ . 1 . 2]" 1
1606 1 12 VAL QG 1 142 MET ME 5.280 . 6.070 4.778 1.823 6.100 0.030 5 0 "[ . 1 . 2]" 1
1607 1 12 VAL QG 1 145 PHE QB 4.240 . 4.880 3.459 2.717 4.020 . 0 0 "[ . 1 . 2]" 1
1608 1 12 VAL QG 1 145 PHE QE 3.440 . 3.960 2.422 1.999 3.101 . 0 0 "[ . 1 . 2]" 1
1609 1 12 VAL QG 1 145 PHE QD 3.590 . 4.130 2.848 2.395 3.563 . 0 0 "[ . 1 . 2]" 1
1610 1 12 VAL QG 1 154 LYS QB 3.050 . 3.510 1.958 1.768 2.365 0.032 6 0 "[ . 1 . 2]" 1
1611 1 12 VAL QG 1 154 LYS QG 3.580 . 4.120 2.447 2.215 2.943 . 0 0 "[ . 1 . 2]" 1
1612 1 12 VAL QG 1 155 LYS H 4.760 . 5.470 4.136 3.553 4.895 . 0 0 "[ . 1 . 2]" 1
1613 1 12 VAL QG 1 156 ILE HA 4.100 . 4.720 3.484 2.914 3.969 . 0 0 "[ . 1 . 2]" 1
1614 1 12 VAL QG 1 156 ILE QG 3.660 . 4.210 2.096 1.738 2.861 0.062 8 0 "[ . 1 . 2]" 1
1615 1 12 VAL QG 1 157 THR H 4.830 . 5.550 4.650 4.010 4.954 . 0 0 "[ . 1 . 2]" 1
1616 1 13 ASP H 1 154 LYS QB 4.270 . 4.910 3.483 2.823 4.701 . 0 0 "[ . 1 . 2]" 1
1617 1 13 ASP QB 1 14 GLY H 4.290 . 4.930 3.828 3.744 3.923 . 0 0 "[ . 1 . 2]" 1
1618 1 15 GLU H 1 15 GLU QG 3.270 . 3.760 2.449 2.198 2.742 . 0 0 "[ . 1 . 2]" 1
1619 1 15 GLU HA 1 15 GLU QG 3.660 . 4.210 3.045 2.881 3.155 . 0 0 "[ . 1 . 2]" 1
1620 1 15 GLU HA 1 16 PRO QG 4.370 . 5.030 3.922 3.829 3.964 . 0 0 "[ . 1 . 2]" 1
1621 1 16 PRO QB 1 17 LEU H 3.730 . 4.290 3.664 3.573 3.772 . 0 0 "[ . 1 . 2]" 1
1622 1 17 LEU QD 1 18 GLY H 4.130 . 4.750 3.951 3.801 4.184 . 0 0 "[ . 1 . 2]" 1
1623 1 17 LEU QD 1 138 ILE HA 5.140 . 5.910 3.396 3.088 3.681 . 0 0 "[ . 1 . 2]" 1
1624 1 17 LEU QD 1 138 ILE MG 3.050 . 3.510 2.313 1.821 2.728 . 0 0 "[ . 1 . 2]" 1
1625 1 17 LEU QD 1 142 MET H 3.630 . 4.170 3.310 2.744 4.204 0.034 17 0 "[ . 1 . 2]" 1
1626 1 17 LEU QD 1 142 MET HA 4.060 . 4.670 3.118 2.645 4.208 . 0 0 "[ . 1 . 2]" 1
1627 1 17 LEU QD 1 142 MET QB 4.800 . 5.520 2.872 2.072 4.898 . 0 0 "[ . 1 . 2]" 1
1628 1 17 LEU QD 1 142 MET QG 4.740 . 5.450 3.544 2.034 4.274 . 0 0 "[ . 1 . 2]" 1
1629 1 17 LEU QD 1 142 MET ME 5.130 . 5.900 4.561 2.063 5.496 . 0 0 "[ . 1 . 2]" 1
1630 1 17 LEU QD 1 145 PHE H 5.920 . 6.810 5.555 5.131 6.376 . 0 0 "[ . 1 . 2]" 1
1631 1 17 LEU QD 1 145 PHE QD 3.920 . 4.510 3.419 2.789 4.471 . 0 0 "[ . 1 . 2]" 1
1632 1 17 LEU QD 1 156 ILE QG 4.260 . 4.900 4.344 3.757 4.830 . 0 0 "[ . 1 . 2]" 1
1633 1 18 GLY QA 1 19 ARG H 3.070 . 3.530 2.244 2.207 2.280 . 0 0 "[ . 1 . 2]" 1
1634 1 18 GLY QA 1 138 ILE MG 4.150 . 4.770 2.552 2.149 3.318 . 0 0 "[ . 1 . 2]" 1
1635 1 18 GLY QA 1 138 ILE MD 3.530 . 4.060 2.137 1.946 2.412 . 0 0 "[ . 1 . 2]" 1
1636 1 19 ARG H 1 138 ILE QG 4.240 . 4.880 2.790 2.119 3.307 . 0 0 "[ . 1 . 2]" 1
1637 1 19 ARG QB 1 20 VAL H 3.500 . 4.030 3.062 2.765 3.416 . 0 0 "[ . 1 . 2]" 1
1638 1 20 VAL H 1 20 VAL QG 3.380 . 3.890 2.809 2.639 3.093 . 0 0 "[ . 1 . 2]" 1
1639 1 20 VAL HA 1 20 VAL QG 3.080 . 3.540 2.195 2.181 2.206 . 0 0 "[ . 1 . 2]" 1
1640 1 20 VAL HA 1 132 VAL QG 4.530 . 5.210 3.816 3.544 4.282 . 0 0 "[ . 1 . 2]" 1
1641 1 20 VAL HA 1 135 GLY QA 4.250 . 4.890 2.142 1.874 2.598 . 0 0 "[ . 1 . 2]" 1
1642 1 20 VAL HB 1 132 VAL QG 4.080 . 4.690 4.330 4.085 4.551 . 0 0 "[ . 1 . 2]" 1
1643 1 20 VAL QG 1 21 SER H 3.770 . 4.340 2.587 2.347 2.955 . 0 0 "[ . 1 . 2]" 1
1644 1 20 VAL QG 1 22 PHE QE 3.640 . 4.190 2.815 2.540 2.968 . 0 0 "[ . 1 . 2]" 1
1645 1 20 VAL QG 1 22 PHE HZ 3.810 . 4.380 2.731 2.567 2.857 . 0 0 "[ . 1 . 2]" 1
1646 1 20 VAL QG 1 114 ILE MD 3.640 . 4.190 3.275 2.689 3.701 . 0 0 "[ . 1 . 2]" 1
1647 1 20 VAL QG 1 132 VAL QG 3.140 . 3.610 1.903 1.766 2.192 0.034 8 0 "[ . 1 . 2]" 1
1648 1 20 VAL QG 1 134 GLU H 4.200 . 4.830 3.987 3.707 4.220 . 0 0 "[ . 1 . 2]" 1
1649 1 20 VAL QG 1 135 GLY QA 3.540 . 4.070 2.203 1.924 2.431 . 0 0 "[ . 1 . 2]" 1
1650 1 20 VAL QG 1 136 MET HA 4.420 . 5.080 3.691 3.370 4.003 . 0 0 "[ . 1 . 2]" 1
1651 1 20 VAL QG 1 136 MET HG3 5.850 . 6.730 6.067 5.859 6.284 . 0 0 "[ . 1 . 2]" 1
1652 1 20 VAL QG 1 138 ILE H 3.870 . 4.450 3.750 3.576 4.019 . 0 0 "[ . 1 . 2]" 1
1653 1 20 VAL QG 1 138 ILE HA 4.290 . 4.930 4.520 4.386 4.790 . 0 0 "[ . 1 . 2]" 1
1654 1 20 VAL QG 1 138 ILE HB 3.330 . 3.830 2.127 1.940 2.377 . 0 0 "[ . 1 . 2]" 1
1655 1 20 VAL QG 1 138 ILE MG 2.750 . 3.160 2.423 2.322 2.575 . 0 0 "[ . 1 . 2]" 1
1656 1 20 VAL QG 1 138 ILE QG 4.240 . 4.880 3.041 2.795 3.257 . 0 0 "[ . 1 . 2]" 1
1657 1 20 VAL QG 1 138 ILE MD 4.750 . 5.460 4.131 3.963 4.277 . 0 0 "[ . 1 . 2]" 1
1658 1 20 VAL QG 1 139 VAL H 3.540 . 4.070 3.208 3.033 3.448 . 0 0 "[ . 1 . 2]" 1
1659 1 20 VAL QG 1 139 VAL HA 4.070 . 4.680 3.670 3.400 4.046 . 0 0 "[ . 1 . 2]" 1
1660 1 20 VAL QG 1 139 VAL HB 4.130 . 4.750 4.065 3.921 4.307 . 0 0 "[ . 1 . 2]" 1
1661 1 20 VAL QG 1 139 VAL QG 3.880 . 4.460 2.027 1.888 2.271 . 0 0 "[ . 1 . 2]" 1
1662 1 20 VAL QG 1 140 GLU H 4.760 . 5.470 5.170 4.982 5.435 . 0 0 "[ . 1 . 2]" 1
1663 1 20 VAL QG 1 142 MET QG 5.730 . 6.590 4.526 4.180 4.798 . 0 0 "[ . 1 . 2]" 1
1664 1 21 SER H 1 21 SER QB 3.670 . 4.220 2.686 2.442 2.995 . 0 0 "[ . 1 . 2]" 1
1665 1 21 SER H 1 132 VAL QG 4.270 . 4.910 3.392 2.751 3.870 . 0 0 "[ . 1 . 2]" 1
1666 1 21 SER QB 1 22 PHE H 3.710 . 4.270 3.334 2.944 3.867 . 0 0 "[ . 1 . 2]" 1
1667 1 21 SER QB 1 134 GLU H 4.370 . 5.030 3.497 2.879 4.503 . 0 0 "[ . 1 . 2]" 1
1668 1 22 PHE HB2 1 24 LEU QD 4.130 . 4.750 3.096 2.592 3.727 . 0 0 "[ . 1 . 2]" 1
1669 1 22 PHE HB2 1 98 LEU QD 4.090 . 4.700 3.034 2.635 3.430 . 0 0 "[ . 1 . 2]" 1
1670 1 22 PHE HB3 1 24 LEU QD 4.570 . 5.260 3.231 2.704 3.831 . 0 0 "[ . 1 . 2]" 1
1671 1 22 PHE QD 1 98 LEU QD 3.650 . 4.200 2.647 2.095 2.875 . 0 0 "[ . 1 . 2]" 1
1672 1 22 PHE QE 1 98 LEU QD 3.720 . 4.280 2.907 2.456 3.288 . 0 0 "[ . 1 . 2]" 1
1673 1 22 PHE QE 1 132 VAL QG 5.580 . 6.420 2.554 1.706 3.470 0.094 14 0 "[ . 1 . 2]" 1
1674 1 22 PHE QE 1 139 VAL QG 3.660 . 4.210 3.135 2.581 3.480 . 0 0 "[ . 1 . 2]" 1
1675 1 22 PHE HZ 1 139 VAL QG 4.220 . 4.850 3.510 2.874 4.036 . 0 0 "[ . 1 . 2]" 1
1676 1 22 PHE QD 1 24 LEU QD 4.510 . 5.190 4.243 3.671 4.703 . 0 0 "[ . 1 . 2]" 1
1677 1 24 LEU H 1 24 LEU QB 3.640 . 4.190 2.551 2.464 2.612 . 0 0 "[ . 1 . 2]" 1
1678 1 24 LEU H 1 24 LEU QD 3.560 . 4.090 2.992 2.859 3.130 . 0 0 "[ . 1 . 2]" 1
1679 1 24 LEU HA 1 24 LEU QD 3.390 . 3.900 2.180 2.107 2.269 . 0 0 "[ . 1 . 2]" 1
1680 1 24 LEU QB 1 25 PHE H 3.850 . 4.430 3.236 3.071 3.381 . 0 0 "[ . 1 . 2]" 1
1681 1 24 LEU QB 1 25 PHE HA 5.110 . 5.880 4.466 4.385 4.554 . 0 0 "[ . 1 . 2]" 1
1682 1 24 LEU QB 1 26 ALA MB 4.130 . 4.750 3.200 2.850 3.647 . 0 0 "[ . 1 . 2]" 1
1683 1 24 LEU QB 1 29 VAL QG 4.950 . 5.690 4.499 4.195 4.789 . 0 0 "[ . 1 . 2]" 1
1684 1 24 LEU QB 1 33 ALA MB 3.310 . 3.810 1.895 1.784 2.062 0.016 8 0 "[ . 1 . 2]" 1
1685 1 24 LEU QD 1 25 PHE H 3.990 . 4.590 3.767 3.653 3.912 . 0 0 "[ . 1 . 2]" 1
1686 1 24 LEU QD 1 26 ALA MB 4.780 . 5.500 3.946 3.499 4.459 . 0 0 "[ . 1 . 2]" 1
1687 1 24 LEU QD 1 33 ALA HA 3.940 . 4.530 2.677 2.331 3.072 . 0 0 "[ . 1 . 2]" 1
1688 1 24 LEU QD 1 33 ALA MB 3.360 . 3.860 2.548 2.129 2.962 . 0 0 "[ . 1 . 2]" 1
1689 1 24 LEU QD 1 36 PHE H 4.590 . 5.280 4.103 3.725 4.537 . 0 0 "[ . 1 . 2]" 1
1690 1 24 LEU QD 1 36 PHE QB 3.820 . 4.390 2.715 2.217 3.228 . 0 0 "[ . 1 . 2]" 1
1691 1 24 LEU MD1 1 36 PHE HB3 6.140 . 7.060 2.965 2.286 4.001 . 0 0 "[ . 1 . 2]" 1
1692 1 24 LEU MD2 1 36 PHE HB3 6.140 . 7.060 3.473 2.873 4.021 . 0 0 "[ . 1 . 2]" 1
1693 1 24 LEU QD 1 37 ARG H 3.540 . 4.070 3.023 2.778 3.419 . 0 0 "[ . 1 . 2]" 1
1694 1 24 LEU QD 1 37 ARG HA 4.330 . 4.980 3.041 2.722 3.859 . 0 0 "[ . 1 . 2]" 1
1695 1 24 LEU QD 1 37 ARG QB 4.180 . 4.810 2.241 1.883 3.184 . 0 0 "[ . 1 . 2]" 1
1696 1 24 LEU QD 1 98 LEU QD 3.470 . 3.990 2.612 2.158 3.429 . 0 0 "[ . 1 . 2]" 1
1697 1 24 LEU QD 1 130 GLY QA 3.880 . 4.460 2.280 2.066 2.683 . 0 0 "[ . 1 . 2]" 1
1698 1 24 LEU QD 1 131 LYS H 4.280 . 4.920 3.639 3.232 4.267 . 0 0 "[ . 1 . 2]" 1
1699 1 25 PHE H 1 25 PHE QB 3.390 . 3.900 2.491 2.442 2.548 . 0 0 "[ . 1 . 2]" 1
1700 1 25 PHE H 1 29 VAL QG 4.260 . 4.900 3.643 3.441 3.826 . 0 0 "[ . 1 . 2]" 1
1701 1 25 PHE H 1 130 GLY QA 3.670 . 4.220 3.086 2.725 3.509 . 0 0 "[ . 1 . 2]" 1
1702 1 25 PHE QB 1 26 ALA H 4.050 . 4.660 3.924 3.899 3.947 . 0 0 "[ . 1 . 2]" 1
1703 1 25 PHE QB 1 28 LYS H 4.110 . 4.730 3.160 2.916 3.549 . 0 0 "[ . 1 . 2]" 1
1704 1 25 PHE QB 1 29 VAL H 4.330 . 4.980 3.527 3.234 3.739 . 0 0 "[ . 1 . 2]" 1
1705 1 25 PHE QB 1 29 VAL QG 3.350 . 3.850 2.588 2.357 2.822 . 0 0 "[ . 1 . 2]" 1
1706 1 25 PHE QD 1 29 VAL QG 4.590 . 5.280 3.876 3.558 4.152 . 0 0 "[ . 1 . 2]" 1
1707 1 27 ASP H 1 27 ASP QB 3.060 . 3.520 2.527 2.411 2.711 . 0 0 "[ . 1 . 2]" 1
1708 1 28 LYS H 1 29 VAL QG 4.060 . 4.670 3.561 3.451 3.661 . 0 0 "[ . 1 . 2]" 1
1709 1 28 LYS HA 1 29 VAL QG 4.300 . 4.950 4.050 3.855 4.185 . 0 0 "[ . 1 . 2]" 1
1710 1 28 LYS HB2 1 29 VAL QG 3.770 . 4.340 2.629 2.390 2.916 . 0 0 "[ . 1 . 2]" 1
1711 1 28 LYS HB3 1 29 VAL QG 5.770 . 6.640 3.037 2.712 3.287 . 0 0 "[ . 1 . 2]" 1
1712 1 29 VAL H 1 29 VAL QG 2.970 . 3.420 2.153 2.080 2.246 . 0 0 "[ . 1 . 2]" 1
1713 1 29 VAL H 1 30 PRO QD 4.080 . 4.690 3.238 2.829 3.645 . 0 0 "[ . 1 . 2]" 1
1714 1 29 VAL HA 1 29 VAL QG 3.060 . 3.520 2.296 2.267 2.321 . 0 0 "[ . 1 . 2]" 1
1715 1 29 VAL HA 1 30 PRO QD 3.330 . 3.830 2.155 2.004 2.296 . 0 0 "[ . 1 . 2]" 1
1716 1 29 VAL HB 1 127 VAL QG 4.020 . 4.620 3.404 2.423 3.998 . 0 0 "[ . 1 . 2]" 1
1717 1 29 VAL QG 1 30 PRO HA 4.690 . 5.390 4.431 4.295 4.615 . 0 0 "[ . 1 . 2]" 1
1718 1 29 VAL QG 1 30 PRO QD 3.870 . 4.450 3.568 3.524 3.606 . 0 0 "[ . 1 . 2]" 1
1719 1 29 VAL QG 1 32 THR H 4.470 . 5.140 3.790 3.665 4.047 . 0 0 "[ . 1 . 2]" 1
1720 1 29 VAL QG 1 32 THR MG 3.920 . 4.510 3.502 2.751 4.082 . 0 0 "[ . 1 . 2]" 1
1721 1 29 VAL QG 1 33 ALA H 3.680 . 4.230 3.124 2.750 3.456 . 0 0 "[ . 1 . 2]" 1
1722 1 29 VAL QG 1 33 ALA HA 4.110 . 4.730 4.064 3.800 4.372 . 0 0 "[ . 1 . 2]" 1
1723 1 29 VAL QG 1 33 ALA MB 3.520 . 4.050 2.404 2.064 2.839 . 0 0 "[ . 1 . 2]" 1
1724 1 29 VAL QG 1 86 GLU QB 3.630 . 4.170 2.991 2.032 3.664 . 0 0 "[ . 1 . 2]" 1
1725 1 29 VAL QG 1 86 GLU QG 3.650 . 4.200 3.167 1.750 4.018 0.050 7 0 "[ . 1 . 2]" 1
1726 1 29 VAL QG 1 87 ASN QD 3.080 . 3.540 2.800 2.039 3.616 0.076 11 0 "[ . 1 . 2]" 1
1727 1 29 VAL QG 1 89 ILE H 4.360 . 5.010 3.574 2.887 4.127 . 0 0 "[ . 1 . 2]" 1
1728 1 29 VAL QG 1 89 ILE MD 4.230 . 4.860 3.145 2.677 3.660 . 0 0 "[ . 1 . 2]" 1
1729 1 29 VAL QG 1 90 LEU H 4.710 . 5.420 3.394 2.985 3.880 . 0 0 "[ . 1 . 2]" 1
1730 1 29 VAL QG 1 90 LEU MD1 3.170 . 3.650 2.088 1.907 2.356 . 0 0 "[ . 1 . 2]" 1
1731 1 29 VAL QG 1 90 LEU MD2 4.280 . 4.920 3.847 3.583 4.163 . 0 0 "[ . 1 . 2]" 1
1732 1 29 VAL QG 1 127 VAL QG 2.750 . 3.160 2.031 1.819 2.608 . 0 0 "[ . 1 . 2]" 1
1733 1 29 VAL QG 1 128 VAL MG1 4.740 . 5.450 4.289 3.997 4.499 . 0 0 "[ . 1 . 2]" 1
1734 1 29 VAL QG 1 129 PHE H 4.350 . 5.000 4.123 4.026 4.274 . 0 0 "[ . 1 . 2]" 1
1735 1 29 VAL QG 1 129 PHE HA 3.000 . 3.450 1.829 1.728 2.170 0.072 16 0 "[ . 1 . 2]" 1
1736 1 29 VAL QG 1 129 PHE QB 3.470 . 3.990 2.414 2.240 2.874 . 0 0 "[ . 1 . 2]" 1
1737 1 29 VAL QG 1 130 GLY H 4.620 . 5.310 4.650 4.532 4.922 . 0 0 "[ . 1 . 2]" 1
1738 1 30 PRO QB 1 31 LYS H 3.630 . 4.170 2.904 2.205 3.410 . 0 0 "[ . 1 . 2]" 1
1739 1 30 PRO QG 1 31 LYS H 3.380 . 3.890 2.941 2.144 3.889 . 0 0 "[ . 1 . 2]" 1
1740 1 30 PRO QD 1 33 ALA MB 5.440 . 6.260 4.964 4.655 5.269 . 0 0 "[ . 1 . 2]" 1
1741 1 31 LYS HA 1 31 LYS QD 4.830 . 5.550 4.236 4.046 4.391 . 0 0 "[ . 1 . 2]" 1
1742 1 31 LYS HB2 1 86 GLU QB 4.450 . 5.120 3.872 2.894 5.121 0.001 7 0 "[ . 1 . 2]" 1
1743 1 31 LYS HB3 1 31 LYS QE 4.200 . 4.830 3.341 2.013 4.268 . 0 0 "[ . 1 . 2]" 1
1744 1 31 LYS QD 1 86 GLU QB 3.740 . 4.300 2.976 1.892 4.439 0.139 8 0 "[ . 1 . 2]" 1
1745 1 32 THR H 1 86 GLU QB 4.220 . 4.850 3.464 2.528 4.702 . 0 0 "[ . 1 . 2]" 1
1746 1 32 THR MG 1 127 VAL QG 3.370 . 3.880 3.007 2.214 3.848 . 0 0 "[ . 1 . 2]" 1
1747 1 33 ALA MB 1 36 PHE QB 5.810 . 6.680 4.502 4.071 4.893 . 0 0 "[ . 1 . 2]" 1
1748 1 34 GLU HA 1 37 ARG QB 3.940 . 4.530 2.418 2.119 2.772 . 0 0 "[ . 1 . 2]" 1
1749 1 34 GLU QB 1 35 ASN H 3.760 . 4.320 2.640 2.338 2.838 . 0 0 "[ . 1 . 2]" 1
1750 1 34 GLU QG 1 78 ILE MD 3.720 . 4.280 2.798 2.195 3.364 . 0 0 "[ . 1 . 2]" 1
1751 1 35 ASN QD 1 39 LEU MD1 3.990 . 4.590 2.700 2.391 3.031 . 0 0 "[ . 1 . 2]" 1
1752 1 36 PHE H 1 36 PHE QB 3.460 . 3.980 2.225 2.179 2.264 . 0 0 "[ . 1 . 2]" 1
1753 1 36 PHE QB 1 37 ARG H 4.210 . 4.840 2.690 2.509 2.820 . 0 0 "[ . 1 . 2]" 1
1754 1 36 PHE QB 1 37 ARG QB 4.370 . 5.030 4.105 3.994 4.235 . 0 0 "[ . 1 . 2]" 1
1755 1 37 ARG H 1 37 ARG QB 3.490 . 4.010 2.241 2.203 2.285 . 0 0 "[ . 1 . 2]" 1
1756 1 37 ARG QB 1 38 ALA H 3.710 . 4.270 2.489 2.323 2.669 . 0 0 "[ . 1 . 2]" 1
1757 1 38 ALA MB 1 44 LYS QG 3.640 . 4.190 1.869 1.741 2.022 0.059 15 0 "[ . 1 . 2]" 1
1758 1 38 ALA MB 1 44 LYS QD 3.930 . 4.520 3.298 2.851 3.733 . 0 0 "[ . 1 . 2]" 1
1759 1 39 LEU HG 1 44 LYS QG 5.070 . 5.830 5.164 4.469 5.885 0.055 6 0 "[ . 1 . 2]" 1
1760 1 39 LEU MD2 1 44 LYS QB 4.510 . 5.190 3.539 3.089 3.989 . 0 0 "[ . 1 . 2]" 1
1761 1 40 SER H 1 40 SER QB 3.630 . 4.170 2.327 2.210 2.601 . 0 0 "[ . 1 . 2]" 1
1762 1 40 SER QB 1 41 THR H 3.980 . 4.580 2.461 2.295 3.382 . 0 0 "[ . 1 . 2]" 1
1763 1 40 SER QB 1 41 THR MG 3.830 . 4.400 3.182 2.707 4.261 . 0 0 "[ . 1 . 2]" 1
1764 1 41 THR MG 1 162 GLY QA 4.040 . 4.650 4.563 4.110 4.787 0.137 11 0 "[ . 1 . 2]" 1
1765 1 43 GLU H 1 43 GLU QG 4.460 . 5.130 2.237 2.028 2.411 . 0 0 "[ . 1 . 2]" 1
1766 1 44 LYS H 1 44 LYS QG 4.350 . 5.000 2.506 2.159 2.773 . 0 0 "[ . 1 . 2]" 1
1767 1 44 LYS H 1 44 LYS QD 4.350 . 5.000 3.698 3.284 4.477 . 0 0 "[ . 1 . 2]" 1
1768 1 44 LYS HA 1 44 LYS QG 3.620 . 4.160 3.042 2.792 3.163 . 0 0 "[ . 1 . 2]" 1
1769 1 44 LYS HA 1 44 LYS QD 3.590 . 4.130 2.275 2.098 3.125 . 0 0 "[ . 1 . 2]" 1
1770 1 44 LYS QB 1 46 PHE HZ 4.340 . 4.990 3.754 3.317 4.158 . 0 0 "[ . 1 . 2]" 1
1771 1 44 LYS QB 1 46 PHE HE2 3.740 . 4.300 2.608 2.226 3.027 . 0 0 "[ . 1 . 2]" 1
1772 1 44 LYS QB 1 46 PHE HD2 3.940 . 4.530 2.620 2.380 2.980 . 0 0 "[ . 1 . 2]" 1
1773 1 44 LYS QB 1 78 ILE MG 4.170 . 4.800 2.706 2.347 3.171 . 0 0 "[ . 1 . 2]" 1
1774 1 44 LYS QB 1 78 ILE MD 5.740 . 6.600 4.526 3.878 4.900 . 0 0 "[ . 1 . 2]" 1
1775 1 44 LYS QE 1 44 LYS QG 3.150 . 3.620 2.336 2.160 2.443 . 0 0 "[ . 1 . 2]" 1
1776 1 44 LYS QG 1 78 ILE MG 3.430 . 3.940 2.146 1.768 2.823 0.032 11 0 "[ . 1 . 2]" 1
1777 1 44 LYS QG 1 78 ILE MD 4.210 . 4.840 3.127 2.494 3.680 . 0 0 "[ . 1 . 2]" 1
1778 1 44 LYS QD 1 46 PHE HE2 5.060 . 5.820 4.953 3.970 5.625 . 0 0 "[ . 1 . 2]" 1
1779 1 44 LYS QD 1 78 ILE MG 4.040 . 4.650 3.784 3.047 4.542 . 0 0 "[ . 1 . 2]" 1
1780 1 44 LYS QD 1 78 ILE MD 4.240 . 4.880 3.614 2.443 4.699 . 0 0 "[ . 1 . 2]" 1
1781 1 44 LYS QE 1 78 ILE MG 4.220 . 4.850 3.659 2.347 4.289 . 0 0 "[ . 1 . 2]" 1
1782 1 44 LYS QE 1 78 ILE MD 3.770 . 4.340 3.262 1.962 4.257 . 0 0 "[ . 1 . 2]" 1
1783 1 46 PHE QB 1 46 PHE HD1 3.070 . 3.530 2.852 2.776 2.915 . 0 0 "[ . 1 . 2]" 1
1784 1 46 PHE QB 1 46 PHE HD2 3.110 . 3.580 2.318 2.289 2.333 . 0 0 "[ . 1 . 2]" 1
1785 1 46 PHE QB 1 47 GLY H 3.270 . 3.760 2.368 2.255 2.463 . 0 0 "[ . 1 . 2]" 1
1786 1 49 LYS HA 1 50 GLY QA 4.380 . 5.040 3.988 3.917 4.035 . 0 0 "[ . 1 . 2]" 1
1787 1 49 LYS QB 1 49 LYS QE 4.010 . 4.610 3.574 2.086 3.911 . 0 0 "[ . 1 . 2]" 1
1788 1 49 LYS QB 1 50 GLY H 4.280 . 4.920 3.840 3.595 4.053 . 0 0 "[ . 1 . 2]" 1
1789 1 49 LYS QE 1 159 ALA MB 4.890 . 5.620 5.112 4.468 5.654 0.034 14 0 "[ . 1 . 2]" 1
1790 1 49 LYS QE 1 160 ASP H 4.390 . 5.050 4.551 3.842 5.100 0.050 13 0 "[ . 1 . 2]" 1
1791 1 49 LYS QE 1 160 ASP HA 3.480 . 4.000 2.075 1.731 3.121 0.069 7 0 "[ . 1 . 2]" 1
1792 1 49 LYS QE 1 160 ASP QB 3.810 . 4.380 3.519 2.879 4.376 . 0 0 "[ . 1 . 2]" 1
1793 1 49 LYS QE 1 161 CYS H 4.130 . 4.750 3.142 2.014 4.607 . 0 0 "[ . 1 . 2]" 1
1794 1 52 CYS QB 1 53 PHE H 3.380 . 3.890 3.307 2.477 3.857 . 0 0 "[ . 1 . 2]" 1
1795 1 52 CYS QB 1 157 THR HA 4.340 . 4.990 3.592 2.800 4.395 . 0 0 "[ . 1 . 2]" 1
1796 1 52 CYS QB 1 157 THR MG 3.460 . 3.980 2.214 1.850 3.744 . 0 0 "[ . 1 . 2]" 1
1797 1 53 PHE H 1 53 PHE QB 3.660 . 4.210 2.419 2.367 2.485 . 0 0 "[ . 1 . 2]" 1
1798 1 53 PHE QB 1 156 ILE MG 3.750 . 4.310 2.899 2.139 3.395 . 0 0 "[ . 1 . 2]" 1
1799 1 53 PHE HZ 1 114 ILE QG 4.990 . 5.740 4.472 3.866 5.218 . 0 0 "[ . 1 . 2]" 1
1800 1 55 ARG HB3 1 55 ARG QD 3.630 . 4.170 2.432 2.343 2.515 . 0 0 "[ . 1 . 2]" 1
1801 1 55 ARG QG 1 56 ILE H 4.160 . 4.780 3.501 3.276 3.664 . 0 0 "[ . 1 . 2]" 1
1802 1 55 ARG QG 1 56 ILE HA 4.220 . 4.850 3.917 3.755 4.118 . 0 0 "[ . 1 . 2]" 1
1803 1 55 ARG QG 1 57 ILE H 4.310 . 4.960 4.677 4.323 5.010 0.050 8 0 "[ . 1 . 2]" 1
1804 1 56 ILE HB 1 62 CYS QB 4.520 . 5.200 4.639 4.377 5.220 0.020 4 0 "[ . 1 . 2]" 1
1805 1 56 ILE HB 1 146 GLY QA 4.840 . 5.570 2.188 1.981 2.479 . 0 0 "[ . 1 . 2]" 1
1806 1 56 ILE MG 1 142 MET QB 5.000 . 5.750 4.426 3.429 5.120 . 0 0 "[ . 1 . 2]" 1
1807 1 56 ILE MG 1 143 GLU QB 3.820 . 4.390 3.445 3.189 3.700 . 0 0 "[ . 1 . 2]" 1
1808 1 56 ILE MG 1 143 GLU QG 3.560 . 4.090 2.640 2.110 3.435 . 0 0 "[ . 1 . 2]" 1
1809 1 56 ILE MG 1 146 GLY QA 3.620 . 4.160 2.111 1.994 2.252 . 0 0 "[ . 1 . 2]" 1
1810 1 56 ILE MD 1 62 CYS QB 4.210 . 4.840 2.460 2.294 3.268 . 0 0 "[ . 1 . 2]" 1
1811 1 58 PRO HA 1 59 GLY QA 4.480 . 5.150 3.969 3.941 3.990 . 0 0 "[ . 1 . 2]" 1
1812 1 58 PRO HA 1 143 GLU QB 4.280 . 4.920 3.886 3.515 4.182 . 0 0 "[ . 1 . 2]" 1
1813 1 58 PRO HA 1 143 GLU QG 3.690 . 4.240 1.864 1.748 2.066 0.052 12 0 "[ . 1 . 2]" 1
1814 1 58 PRO QB 1 59 GLY H 3.830 . 4.400 3.126 2.938 3.315 . 0 0 "[ . 1 . 2]" 1
1815 1 58 PRO QB 1 143 GLU QG 3.350 . 3.850 3.150 2.534 3.619 . 0 0 "[ . 1 . 2]" 1
1816 1 58 PRO QG 1 147 SER H 4.600 . 5.290 4.616 3.912 5.066 . 0 0 "[ . 1 . 2]" 1
1817 1 58 PRO HD2 1 143 GLU QG 5.240 . 6.030 5.097 4.935 5.304 . 0 0 "[ . 1 . 2]" 1
1818 1 58 PRO HD3 1 143 GLU QG 4.350 . 5.000 4.330 4.055 4.740 . 0 0 "[ . 1 . 2]" 1
1819 1 59 GLY H 1 143 GLU QG 3.820 . 4.390 2.923 2.322 3.255 . 0 0 "[ . 1 . 2]" 1
1820 1 60 PHE HD1 1 122 LEU QD 4.800 . 5.520 4.384 3.788 5.002 . 0 0 "[ . 1 . 2]" 1
1821 1 60 PHE HE1 1 122 LEU QD 3.420 . 3.930 2.657 1.931 3.384 . 0 0 "[ . 1 . 2]" 1
1822 1 61 MET QB 1 62 CYS H 3.480 . 4.000 3.549 2.543 3.785 . 0 0 "[ . 1 . 2]" 1
1823 1 61 MET QB 1 116 THR H 4.030 . 4.630 3.722 2.891 4.666 0.036 5 0 "[ . 1 . 2]" 1
1824 1 61 MET QB 1 119 THR MG 3.780 . 4.350 3.181 2.665 3.674 . 0 0 "[ . 1 . 2]" 1
1825 1 61 MET ME 1 122 LEU QD 3.620 . 4.160 3.477 1.779 4.386 0.226 11 0 "[ . 1 . 2]" 1
1826 1 62 CYS H 1 62 CYS QB 3.700 . 4.260 2.845 2.360 3.079 . 0 0 "[ . 1 . 2]" 1
1827 1 62 CYS QB 1 63 GLN H 4.050 . 4.660 3.497 3.303 3.970 . 0 0 "[ . 1 . 2]" 1
1828 1 69 ARG H 1 69 ARG QG 4.220 . 4.850 3.220 2.633 4.240 . 0 0 "[ . 1 . 2]" 1
1829 1 69 ARG HA 1 69 ARG QG 3.660 . 4.210 2.480 2.327 2.538 . 0 0 "[ . 1 . 2]" 1
1830 1 69 ARG HA 1 69 ARG QD 3.960 . 4.550 4.138 3.973 4.300 . 0 0 "[ . 1 . 2]" 1
1831 1 69 ARG QB 1 69 ARG QD 3.180 . 3.660 2.245 2.148 2.439 . 0 0 "[ . 1 . 2]" 1
1832 1 69 ARG QB 1 76 LYS QB 3.970 . 4.570 3.868 3.215 4.546 . 0 0 "[ . 1 . 2]" 1
1833 1 69 ARG QG 1 73 THR MG 4.250 . 4.890 4.312 3.240 4.962 0.072 5 0 "[ . 1 . 2]" 1
1834 1 69 ARG QG 1 76 LYS QB 4.750 . 5.460 4.796 3.994 5.591 0.131 1 0 "[ . 1 . 2]" 1
1835 1 69 ARG QD 1 73 THR HB 4.530 . 5.210 3.765 2.354 5.042 . 0 0 "[ . 1 . 2]" 1
1836 1 69 ARG QD 1 73 THR MG 4.090 . 4.700 3.229 2.444 4.287 . 0 0 "[ . 1 . 2]" 1
1837 1 69 ARG QD 1 76 LYS QB 3.780 . 4.350 3.342 2.312 4.337 . 0 0 "[ . 1 . 2]" 1
1838 1 69 ARG QD 1 76 LYS QD 3.350 . 3.850 2.833 1.776 3.903 0.053 11 0 "[ . 1 . 2]" 1
1839 1 72 GLY QA 1 73 THR HA 4.520 . 5.200 4.082 4.003 4.120 . 0 0 "[ . 1 . 2]" 1
1840 1 73 THR HB 1 74 GLY QA 4.180 . 4.810 3.887 3.765 4.059 . 0 0 "[ . 1 . 2]" 1
1841 1 73 THR MG 1 76 LYS QB 3.620 . 4.160 2.208 1.803 2.812 . 0 0 "[ . 1 . 2]" 1
1842 1 75 GLY HA3 1 111 GLN QB 5.240 . 6.030 4.824 3.941 5.806 . 0 0 "[ . 1 . 2]" 1
1843 1 76 LYS HA 1 76 LYS QD 4.720 . 5.430 4.461 4.306 4.617 . 0 0 "[ . 1 . 2]" 1
1844 1 76 LYS HA 1 77 SER QB 4.530 . 5.210 4.193 3.972 4.320 . 0 0 "[ . 1 . 2]" 1
1845 1 76 LYS QB 1 77 SER H 3.980 . 4.580 2.387 2.156 2.664 . 0 0 "[ . 1 . 2]" 1
1846 1 76 LYS QB 1 81 GLU H 5.350 . 6.150 4.322 3.906 4.600 . 0 0 "[ . 1 . 2]" 1
1847 1 77 SER QB 1 78 ILE H 3.800 . 4.370 2.231 2.059 2.499 . 0 0 "[ . 1 . 2]" 1
1848 1 77 SER QB 1 79 TYR H 3.940 . 4.530 2.531 2.253 2.786 . 0 0 "[ . 1 . 2]" 1
1849 1 77 SER QB 1 80 GLY H 4.220 . 4.850 3.979 3.360 4.846 . 0 0 "[ . 1 . 2]" 1
1850 1 77 SER QB 1 83 PHE QD 3.380 . 3.890 2.554 2.258 3.000 . 0 0 "[ . 1 . 2]" 1
1851 1 79 TYR HD2 1 83 PHE QB 4.210 . 4.840 3.082 2.060 4.237 . 0 0 "[ . 1 . 2]" 1
1852 1 81 GLU HA 1 81 GLU QG 3.640 . 4.190 2.561 2.494 2.644 . 0 0 "[ . 1 . 2]" 1
1853 1 81 GLU QB 1 82 LYS H 3.660 . 4.210 2.455 2.215 2.797 . 0 0 "[ . 1 . 2]" 1
1854 1 81 GLU QB 1 82 LYS HG3 4.060 . 4.670 4.145 3.913 4.501 . 0 0 "[ . 1 . 2]" 1
1855 1 81 GLU QG 1 82 LYS H 4.160 . 4.780 3.525 3.197 3.783 . 0 0 "[ . 1 . 2]" 1
1856 1 81 GLU QG 1 82 LYS HG3 4.220 . 4.850 4.206 3.670 4.950 0.100 20 0 "[ . 1 . 2]" 1
1857 1 81 GLU QG 1 82 LYS QE 4.160 . 4.780 3.749 3.030 4.767 . 0 0 "[ . 1 . 2]" 1
1858 1 83 PHE QB 1 83 PHE HE2 4.800 . 5.520 4.404 4.361 4.439 . 0 0 "[ . 1 . 2]" 1
1859 1 83 PHE QB 1 84 GLU H 3.250 . 3.740 2.264 2.171 2.502 . 0 0 "[ . 1 . 2]" 1
1860 1 84 GLU HA 1 106 ASN QB 4.480 . 5.150 3.771 2.985 4.479 . 0 0 "[ . 1 . 2]" 1
1861 1 85 ASP HA 1 127 VAL QG 4.050 . 4.660 3.464 2.476 4.410 . 0 0 "[ . 1 . 2]" 1
1862 1 85 ASP HB3 1 127 VAL QG 4.980 . 5.730 2.533 1.807 4.064 . 0 0 "[ . 1 . 2]" 1
1863 1 86 GLU H 1 86 GLU QB 3.570 . 4.110 2.255 2.188 2.325 . 0 0 "[ . 1 . 2]" 1
1864 1 86 GLU H 1 127 VAL QG 3.570 . 4.110 2.909 1.822 4.077 . 0 0 "[ . 1 . 2]" 1
1865 1 86 GLU HA 1 86 GLU QG 3.460 . 3.980 2.996 2.523 3.180 . 0 0 "[ . 1 . 2]" 1
1866 1 86 GLU QB 1 127 VAL QG 3.440 . 3.960 3.018 1.824 4.013 0.053 8 0 "[ . 1 . 2]" 1
1867 1 86 GLU HB3 1 127 VAL MG2 5.810 . 6.680 4.050 2.711 5.245 . 0 0 "[ . 1 . 2]" 1
1868 1 86 GLU QG 1 87 ASN H 4.340 . 4.990 3.257 3.010 3.491 . 0 0 "[ . 1 . 2]" 1
1869 1 86 GLU QG 1 87 ASN QD 3.630 . 4.170 3.004 2.462 3.622 . 0 0 "[ . 1 . 2]" 1
1870 1 86 GLU QG 1 127 VAL QG 5.140 . 5.910 4.127 2.714 4.923 . 0 0 "[ . 1 . 2]" 1
1871 1 87 ASN H 1 87 ASN QD 4.350 . 5.000 4.399 4.097 4.704 . 0 0 "[ . 1 . 2]" 1
1872 1 87 ASN H 1 127 VAL QG 3.040 . 3.500 2.389 1.968 3.065 . 0 0 "[ . 1 . 2]" 1
1873 1 87 ASN HA 1 87 ASN QD 4.250 . 4.890 4.365 4.322 4.422 . 0 0 "[ . 1 . 2]" 1
1874 1 87 ASN QB 1 89 ILE H 4.260 . 4.900 3.496 2.828 4.148 . 0 0 "[ . 1 . 2]" 1
1875 1 88 PHE H 1 88 PHE QB 3.670 . 4.220 2.586 2.363 2.817 . 0 0 "[ . 1 . 2]" 1
1876 1 88 PHE QB 1 88 PHE HD2 3.240 . 3.730 2.382 2.304 2.445 . 0 0 "[ . 1 . 2]" 1
1877 1 88 PHE QE 1 127 VAL QG 4.450 . 5.120 3.698 2.448 4.985 . 0 0 "[ . 1 . 2]" 1
1878 1 90 LEU QB 1 90 LEU MD2 2.880 . 3.310 2.341 2.291 2.400 . 0 0 "[ . 1 . 2]" 1
1879 1 90 LEU QB 1 91 LYS H 3.490 . 4.010 3.210 2.435 3.685 . 0 0 "[ . 1 . 2]" 1
1880 1 91 LYS H 1 91 LYS QB 3.360 . 3.860 2.791 2.429 3.326 . 0 0 "[ . 1 . 2]" 1
1881 1 91 LYS QB 1 92 HIS H 3.560 . 4.090 2.307 2.121 2.643 . 0 0 "[ . 1 . 2]" 1
1882 1 91 LYS QB 1 93 THR H 5.090 . 5.850 3.670 2.813 4.498 . 0 0 "[ . 1 . 2]" 1
1883 1 91 LYS QB 1 93 THR MG 3.390 . 3.900 3.095 1.848 3.975 0.075 20 0 "[ . 1 . 2]" 1
1884 1 92 HIS QB 1 93 THR H 4.370 . 5.030 3.913 3.789 3.952 . 0 0 "[ . 1 . 2]" 1
1885 1 92 HIS QB 1 119 THR H 4.250 . 4.890 2.999 2.389 4.840 . 0 0 "[ . 1 . 2]" 1
1886 1 92 HIS HD2 1 122 LEU QB 4.140 . 4.760 3.282 2.982 3.713 . 0 0 "[ . 1 . 2]" 1
1887 1 92 HIS HD2 1 122 LEU QD 3.890 . 4.470 4.129 2.770 4.605 0.135 4 0 "[ . 1 . 2]" 1
1888 1 93 THR HA 1 118 LYS QD 4.200 . 4.830 4.677 4.109 4.970 0.140 4 0 "[ . 1 . 2]" 1
1889 1 96 GLY H 1 132 VAL QG 4.970 . 5.720 4.297 4.003 4.708 . 0 0 "[ . 1 . 2]" 1
1890 1 96 GLY H 1 139 VAL QG 5.480 . 6.300 4.645 4.088 5.481 . 0 0 "[ . 1 . 2]" 1
1891 1 96 GLY HA3 1 132 VAL QG 3.830 . 4.400 2.496 1.764 3.136 0.036 12 0 "[ . 1 . 2]" 1
1892 1 97 ILE H 1 115 CYS QB 5.050 . 5.810 3.292 2.507 4.680 . 0 0 "[ . 1 . 2]" 1
1893 1 97 ILE MG 1 99 SER QB 3.610 . 4.150 3.049 2.558 3.859 . 0 0 "[ . 1 . 2]" 1
1894 1 97 ILE MG 1 115 CYS QB 4.540 . 5.220 3.225 2.565 4.216 . 0 0 "[ . 1 . 2]" 1
1895 1 98 LEU HA 1 98 LEU QD 3.610 . 4.150 2.271 2.137 2.900 . 0 0 "[ . 1 . 2]" 1
1896 1 98 LEU QB 1 99 SER H 3.900 . 4.490 3.812 3.335 3.970 . 0 0 "[ . 1 . 2]" 1
1897 1 98 LEU QB 1 128 VAL MG1 4.270 . 4.910 3.869 3.657 4.086 . 0 0 "[ . 1 . 2]" 1
1898 1 98 LEU QB 1 130 GLY H 3.770 . 4.340 3.161 2.778 3.401 . 0 0 "[ . 1 . 2]" 1
1899 1 98 LEU QD 1 99 SER H 3.870 . 4.450 2.839 2.404 4.349 . 0 0 "[ . 1 . 2]" 1
1900 1 98 LEU QD 1 112 PHE QB 4.170 . 4.800 2.538 2.076 3.841 . 0 0 "[ . 1 . 2]" 1
1901 1 98 LEU QD 1 113 PHE H 4.690 . 5.390 3.329 2.658 5.329 . 0 0 "[ . 1 . 2]" 1
1902 1 98 LEU QD 1 114 ILE MG 3.780 . 4.350 3.181 2.069 3.531 . 0 0 "[ . 1 . 2]" 1
1903 1 98 LEU QD 1 114 ILE QG 3.220 . 3.700 1.983 1.797 2.565 0.003 15 0 "[ . 1 . 2]" 1
1904 1 98 LEU QD 1 114 ILE MD 3.600 . 4.140 2.951 2.559 3.279 . 0 0 "[ . 1 . 2]" 1
1905 1 98 LEU QD 1 131 LYS H 4.530 . 5.210 3.913 2.963 4.313 . 0 0 "[ . 1 . 2]" 1
1906 1 100 MET ME 1 109 GLY QA 3.620 . 4.160 2.342 2.180 2.545 . 0 0 "[ . 1 . 2]" 1
1907 1 101 ALA H 1 111 GLN QB 3.300 . 3.800 3.274 3.024 3.704 . 0 0 "[ . 1 . 2]" 1
1908 1 101 ALA H 1 112 PHE QB 5.480 . 6.300 4.079 3.632 4.580 . 0 0 "[ . 1 . 2]" 1
1909 1 101 ALA MB 1 111 GLN QB 3.600 . 4.140 1.814 1.661 1.917 0.139 11 0 "[ . 1 . 2]" 1
1910 1 101 ALA MB 1 111 GLN QG 4.600 . 5.290 3.605 2.857 3.887 . 0 0 "[ . 1 . 2]" 1
1911 1 102 ASN QB 1 103 ALA H 3.540 . 4.070 2.490 2.223 2.924 . 0 0 "[ . 1 . 2]" 1
1912 1 102 ASN QB 1 103 ALA HA 4.790 . 5.510 4.482 4.170 4.715 . 0 0 "[ . 1 . 2]" 1
1913 1 102 ASN QB 1 104 GLY H 4.150 . 4.770 2.383 1.903 2.937 . 0 0 "[ . 1 . 2]" 1
1914 1 102 ASN QB 1 108 ASN QB 3.790 . 4.360 2.930 2.478 3.625 . 0 0 "[ . 1 . 2]" 1
1915 1 102 ASN QD 1 103 ALA HA 4.300 . 4.950 4.970 4.438 5.130 0.180 6 0 "[ . 1 . 2]" 1
1916 1 104 GLY H 1 105 PRO QD 4.750 . 5.460 4.383 4.255 4.444 . 0 0 "[ . 1 . 2]" 1
1917 1 104 GLY QA 1 105 PRO QD 3.040 . 3.500 2.119 2.087 2.149 . 0 0 "[ . 1 . 2]" 1
1918 1 110 SER HA 1 111 GLN QG 5.270 . 6.060 4.252 3.860 5.759 . 0 0 "[ . 1 . 2]" 1
1919 1 110 SER HB2 1 111 GLN QG 4.610 . 5.300 3.679 2.921 5.473 0.173 2 0 "[ . 1 . 2]" 1
1920 1 110 SER HB2 1 111 GLN QE 3.990 . 4.590 3.598 2.818 4.810 0.220 13 0 "[ . 1 . 2]" 1
1921 1 111 GLN H 1 111 GLN QG 4.200 . 4.830 2.937 2.782 4.161 . 0 0 "[ . 1 . 2]" 1
1922 1 111 GLN HA 1 111 GLN QG 3.470 . 3.990 2.531 2.403 2.738 . 0 0 "[ . 1 . 2]" 1
1923 1 111 GLN HA 1 112 PHE QB 4.720 . 5.430 4.396 4.312 4.743 . 0 0 "[ . 1 . 2]" 1
1924 1 111 GLN QB 1 112 PHE H 4.340 . 4.990 2.216 1.962 3.223 . 0 0 "[ . 1 . 2]" 1
1925 1 111 GLN QG 1 112 PHE H 4.820 . 5.540 3.718 2.098 4.297 . 0 0 "[ . 1 . 2]" 1
1926 1 112 PHE QB 1 113 PHE H 3.500 . 4.030 2.745 2.386 3.175 . 0 0 "[ . 1 . 2]" 1
1927 1 113 PHE H 1 113 PHE QB 3.640 . 4.190 3.140 2.961 3.316 . 0 0 "[ . 1 . 2]" 1
1928 1 113 PHE QB 1 114 ILE H 3.840 . 4.420 2.723 2.404 3.015 . 0 0 "[ . 1 . 2]" 1
1929 1 113 PHE QD 1 122 LEU QD 5.000 . 5.750 3.918 3.337 5.124 . 0 0 "[ . 1 . 2]" 1
1930 1 113 PHE QD 2 5 PRO QG 5.810 . 6.680 3.634 3.016 5.195 . 0 0 "[ . 1 . 2]" 1
1931 1 114 ILE H 1 114 ILE QG 3.820 . 4.390 2.474 2.260 2.636 . 0 0 "[ . 1 . 2]" 1
1932 1 114 ILE HB 1 139 VAL QG 3.850 . 4.430 2.648 2.397 2.938 . 0 0 "[ . 1 . 2]" 1
1933 1 114 ILE MG 1 139 VAL QG 2.750 . 3.160 1.925 1.785 2.040 0.015 20 0 "[ . 1 . 2]" 1
1934 1 114 ILE QG 1 139 VAL QG 3.800 . 4.370 3.608 3.398 3.845 . 0 0 "[ . 1 . 2]" 1
1935 1 115 CYS H 1 115 CYS QB 3.660 . 4.210 2.549 2.449 2.758 . 0 0 "[ . 1 . 2]" 1
1936 1 115 CYS QB 1 117 ALA H 3.780 . 4.350 3.421 2.727 3.705 . 0 0 "[ . 1 . 2]" 1
1937 1 115 CYS QB 1 119 THR H 4.320 . 4.970 3.191 2.776 3.658 . 0 0 "[ . 1 . 2]" 1
1938 1 115 CYS QB 1 119 THR MG 3.570 . 4.110 2.294 1.987 2.921 . 0 0 "[ . 1 . 2]" 1
1939 1 115 CYS QB 1 122 LEU QD 4.260 . 4.900 3.765 3.099 4.885 . 0 0 "[ . 1 . 2]" 1
1940 1 116 THR MG 1 139 VAL QG 3.580 . 4.120 1.867 1.708 2.076 0.092 19 0 "[ . 1 . 2]" 1
1941 1 116 THR MG 1 140 GLU QG 5.080 . 5.840 2.990 2.197 3.664 . 0 0 "[ . 1 . 2]" 1
1942 1 116 THR MG 1 143 GLU QG 3.900 . 4.490 3.313 2.556 3.935 . 0 0 "[ . 1 . 2]" 1
1943 1 118 LYS HB2 1 118 LYS QD 3.670 . 4.220 2.788 2.616 2.935 . 0 0 "[ . 1 . 2]" 1
1944 1 118 LYS HB3 1 118 LYS QD 3.570 . 4.110 2.856 2.559 3.626 . 0 0 "[ . 1 . 2]" 1
1945 1 119 THR HB 1 122 LEU QB 4.030 . 4.630 3.303 2.529 4.069 . 0 0 "[ . 1 . 2]" 1
1946 1 119 THR HB 1 122 LEU QD 3.810 . 4.380 2.243 1.712 2.706 0.088 5 0 "[ . 1 . 2]" 1
1947 1 119 THR MG 1 122 LEU QD 3.490 . 4.010 2.847 2.389 3.137 . 0 0 "[ . 1 . 2]" 1
1948 1 120 GLU QG 1 121 TRP H 3.720 . 4.280 2.543 2.334 2.744 . 0 0 "[ . 1 . 2]" 1
1949 1 120 GLU QG 1 121 TRP HE3 3.890 . 4.470 2.353 2.078 2.735 . 0 0 "[ . 1 . 2]" 1
1950 1 121 TRP HD1 1 122 LEU QD 2.790 . 3.210 2.416 2.103 2.811 . 0 0 "[ . 1 . 2]" 1
1951 1 121 TRP HE1 1 122 LEU QD 3.220 . 3.700 2.771 2.530 3.084 . 0 0 "[ . 1 . 2]" 1
1952 1 121 TRP HZ2 1 122 LEU QD 4.350 . 5.000 4.189 3.462 4.722 . 0 0 "[ . 1 . 2]" 1
1953 1 122 LEU H 1 122 LEU QB 3.590 . 4.130 2.401 2.168 2.575 . 0 0 "[ . 1 . 2]" 1
1954 1 122 LEU H 1 122 LEU QD 3.490 . 4.010 2.924 2.376 3.249 . 0 0 "[ . 1 . 2]" 1
1955 1 122 LEU HA 1 122 LEU QD 3.030 . 3.480 2.193 1.982 2.562 . 0 0 "[ . 1 . 2]" 1
1956 1 122 LEU QB 1 123 ASP H 4.210 . 4.840 3.513 3.196 3.807 . 0 0 "[ . 1 . 2]" 1
1957 1 122 LEU QD 1 123 ASP H 4.840 . 5.570 4.307 4.141 4.436 . 0 0 "[ . 1 . 2]" 1
1958 1 122 LEU QD 1 125 LYS QB 3.820 . 4.390 3.395 2.680 4.421 0.031 7 0 "[ . 1 . 2]" 1
1959 1 122 LEU QD 1 125 LYS QE 3.790 . 4.360 2.820 1.897 3.713 . 0 0 "[ . 1 . 2]" 1
1960 1 122 LEU QD 2 5 PRO QB 4.090 . 4.700 1.897 1.688 2.168 0.112 19 0 "[ . 1 . 2]" 1
1961 1 122 LEU QD 2 5 PRO QG 3.490 . 4.010 2.324 1.824 2.694 . 0 0 "[ . 1 . 2]" 1
1962 1 122 LEU QD 2 5 PRO QD 4.650 . 5.350 3.687 2.794 4.048 . 0 0 "[ . 1 . 2]" 1
1963 1 122 LEU QD 2 7 ALA MB 5.050 . 5.810 4.668 3.759 5.818 0.008 13 0 "[ . 1 . 2]" 1
1964 1 123 ASP H 1 123 ASP QB 3.330 . 3.830 2.444 2.332 2.568 . 0 0 "[ . 1 . 2]" 1
1965 1 123 ASP HA 1 124 GLY QA 4.470 . 5.140 4.012 3.979 4.073 . 0 0 "[ . 1 . 2]" 1
1966 1 124 GLY QA 1 125 LYS HA 4.610 . 5.300 4.142 4.092 4.195 . 0 0 "[ . 1 . 2]" 1
1967 1 125 LYS H 1 125 LYS QB 3.340 . 3.840 2.360 2.166 2.750 . 0 0 "[ . 1 . 2]" 1
1968 1 125 LYS QB 1 125 LYS QE 2.860 . 3.290 2.211 1.986 3.051 . 0 0 "[ . 1 . 2]" 1
1969 1 125 LYS QB 1 126 HIS H 3.550 . 4.080 2.240 1.744 2.865 0.056 3 0 "[ . 1 . 2]" 1
1970 1 126 HIS H 1 126 HIS QB 3.670 . 4.220 2.355 2.057 2.609 . 0 0 "[ . 1 . 2]" 1
1971 1 126 HIS QB 1 126 HIS HE1 4.630 . 5.320 4.454 4.308 4.647 . 0 0 "[ . 1 . 2]" 1
1972 1 127 VAL H 1 127 VAL QG 3.430 . 3.940 2.018 1.776 2.153 0.024 10 0 "[ . 1 . 2]" 1
1973 1 127 VAL QG 1 128 VAL H 4.110 . 4.730 2.459 2.257 3.350 . 0 0 "[ . 1 . 2]" 1
1974 1 127 VAL QG 1 128 VAL MG2 4.270 . 4.910 3.721 3.404 4.351 . 0 0 "[ . 1 . 2]" 1
1975 1 127 VAL QG 1 129 PHE H 5.350 . 6.150 4.522 4.214 4.884 . 0 0 "[ . 1 . 2]" 1
1976 1 131 LYS HA 1 132 VAL QG 5.570 . 6.410 3.674 3.527 3.954 . 0 0 "[ . 1 . 2]" 1
1977 1 131 LYS HG2 1 132 VAL QG 4.010 . 4.610 3.854 2.916 4.444 . 0 0 "[ . 1 . 2]" 1
1978 1 132 VAL QG 1 133 LYS HB3 5.670 . 6.520 4.945 4.630 5.136 . 0 0 "[ . 1 . 2]" 1
1979 1 132 VAL QG 1 136 MET QB 4.170 . 4.800 2.367 2.039 2.650 . 0 0 "[ . 1 . 2]" 1
1980 1 132 VAL QG 1 136 MET HG3 5.440 . 6.260 4.040 3.741 4.324 . 0 0 "[ . 1 . 2]" 1
1981 1 132 VAL QG 1 139 VAL H 5.000 . 5.750 4.020 3.826 4.338 . 0 0 "[ . 1 . 2]" 1
1982 1 132 VAL QG 1 139 VAL HB 4.340 . 4.990 3.250 3.008 3.681 . 0 0 "[ . 1 . 2]" 1
1983 1 132 VAL QG 1 139 VAL QG 3.530 . 4.060 1.971 1.724 2.430 0.076 1 0 "[ . 1 . 2]" 1
1984 1 135 GLY QA 1 138 ILE H 4.330 . 4.980 3.111 2.912 3.380 . 0 0 "[ . 1 . 2]" 1
1985 1 136 MET HA 1 139 VAL QG 3.390 . 3.900 2.591 2.258 2.993 . 0 0 "[ . 1 . 2]" 1
1986 1 136 MET HG3 1 140 GLU QG 4.710 . 5.420 2.984 2.784 3.284 . 0 0 "[ . 1 . 2]" 1
1987 1 136 MET ME 1 139 VAL QG 3.230 . 3.710 3.030 2.390 3.736 0.026 16 0 "[ . 1 . 2]" 1
1988 1 136 MET ME 1 140 GLU QG 3.430 . 3.940 2.142 1.934 2.286 . 0 0 "[ . 1 . 2]" 1
1989 1 137 ASN H 1 137 ASN QB 3.620 . 4.160 2.400 2.211 2.558 . 0 0 "[ . 1 . 2]" 1
1990 1 137 ASN H 1 140 GLU QG 5.640 . 6.490 4.998 4.771 5.457 . 0 0 "[ . 1 . 2]" 1
1991 1 138 ILE H 1 138 ILE QG 3.750 . 4.310 2.181 2.098 2.317 . 0 0 "[ . 1 . 2]" 1
1992 1 138 ILE H 1 139 VAL QG 3.970 . 4.570 3.896 3.801 4.083 . 0 0 "[ . 1 . 2]" 1
1993 1 138 ILE MG 1 139 VAL QG 3.900 . 4.490 3.721 3.250 3.903 . 0 0 "[ . 1 . 2]" 1
1994 1 138 ILE MG 1 142 MET QG 4.070 . 4.680 3.497 2.467 4.284 . 0 0 "[ . 1 . 2]" 1
1995 1 139 VAL H 1 139 VAL QG 3.200 . 3.680 2.102 2.022 2.185 . 0 0 "[ . 1 . 2]" 1
1996 1 139 VAL HA 1 139 VAL QG 2.930 . 3.370 2.194 2.178 2.208 . 0 0 "[ . 1 . 2]" 1
1997 1 139 VAL QG 1 140 GLU H 3.500 . 4.030 3.217 3.115 3.311 . 0 0 "[ . 1 . 2]" 1
1998 1 139 VAL QG 1 140 GLU HA 5.210 . 5.990 3.561 3.396 3.665 . 0 0 "[ . 1 . 2]" 1
1999 1 139 VAL QG 1 140 GLU QB 4.080 . 4.690 4.470 4.365 4.576 . 0 0 "[ . 1 . 2]" 1
2000 1 139 VAL QG 1 140 GLU QG 4.430 . 5.090 3.410 3.191 3.603 . 0 0 "[ . 1 . 2]" 1
2001 1 139 VAL QG 1 141 ALA H 4.260 . 4.900 4.563 4.464 4.696 . 0 0 "[ . 1 . 2]" 1
2002 1 139 VAL QG 1 142 MET QG 4.150 . 4.770 3.367 3.025 4.419 . 0 0 "[ . 1 . 2]" 1
2003 1 139 VAL QG 1 143 GLU H 5.300 . 6.100 4.299 4.175 4.431 . 0 0 "[ . 1 . 2]" 1
2004 1 139 VAL QG 1 143 GLU QB 4.940 . 5.680 3.612 3.208 4.040 . 0 0 "[ . 1 . 2]" 1
2005 1 140 GLU H 1 140 GLU QG 3.290 . 3.780 2.262 2.135 2.392 . 0 0 "[ . 1 . 2]" 1
2006 1 140 GLU HA 1 140 GLU QG 3.490 . 4.010 2.471 2.397 2.525 . 0 0 "[ . 1 . 2]" 1
2007 1 140 GLU HA 1 143 GLU QB 3.860 . 4.440 2.564 2.194 3.044 . 0 0 "[ . 1 . 2]" 1
2008 1 140 GLU QG 1 141 ALA H 3.790 . 4.360 4.188 4.049 4.304 . 0 0 "[ . 1 . 2]" 1
2009 1 141 ALA H 1 142 MET QB 5.350 . 6.150 4.810 4.562 5.021 . 0 0 "[ . 1 . 2]" 1
2010 1 141 ALA MB 1 142 MET QG 4.440 . 5.110 3.957 3.062 4.467 . 0 0 "[ . 1 . 2]" 1
2011 1 142 MET H 1 142 MET QB 3.200 . 3.680 2.553 2.483 2.625 . 0 0 "[ . 1 . 2]" 1
2012 1 142 MET H 1 142 MET QG 3.440 . 3.960 2.276 1.985 2.500 . 0 0 "[ . 1 . 2]" 1
2013 1 142 MET QB 1 142 MET ME 3.800 . 4.370 2.633 1.954 3.610 . 0 0 "[ . 1 . 2]" 1
2014 1 142 MET QB 1 143 GLU H 4.290 . 4.930 3.368 2.491 3.647 . 0 0 "[ . 1 . 2]" 1
2015 1 142 MET QB 1 145 PHE QD 4.930 . 5.670 3.296 2.962 4.044 . 0 0 "[ . 1 . 2]" 1
2016 1 142 MET QB 1 156 ILE MG 4.120 . 4.740 2.590 2.186 3.320 . 0 0 "[ . 1 . 2]" 1
2017 1 142 MET QB 1 156 ILE MD 5.210 . 5.990 1.913 1.697 2.445 0.103 13 0 "[ . 1 . 2]" 1
2018 1 142 MET QG 1 156 ILE MG 5.030 . 5.780 3.552 2.223 4.310 . 0 0 "[ . 1 . 2]" 1
2019 1 143 GLU H 1 143 GLU QG 4.310 . 4.960 3.986 3.955 4.018 . 0 0 "[ . 1 . 2]" 1
2020 1 143 GLU HA 1 143 GLU QG 3.670 . 4.220 2.507 2.402 2.673 . 0 0 "[ . 1 . 2]" 1
2021 1 143 GLU QB 1 144 ARG H 3.610 . 4.150 2.754 2.430 2.913 . 0 0 "[ . 1 . 2]" 1
2022 1 144 ARG H 1 144 ARG QB 3.110 . 3.580 2.466 2.375 2.603 . 0 0 "[ . 1 . 2]" 1
2023 1 144 ARG H 1 144 ARG QG 3.060 . 3.520 2.223 2.017 2.388 . 0 0 "[ . 1 . 2]" 1
2024 1 145 PHE H 1 145 PHE QB 3.430 . 3.940 2.443 2.397 2.493 . 0 0 "[ . 1 . 2]" 1
2025 1 145 PHE QB 1 154 LYS H 3.800 . 4.370 2.867 2.514 3.425 . 0 0 "[ . 1 . 2]" 1
2026 1 145 PHE QB 1 154 LYS QB 3.850 . 4.430 2.280 1.819 3.145 . 0 0 "[ . 1 . 2]" 1
2027 1 145 PHE QB 1 154 LYS QG 4.450 . 5.120 2.655 2.093 3.496 . 0 0 "[ . 1 . 2]" 1
2028 1 145 PHE QB 1 156 ILE MD 3.340 . 3.840 1.923 1.743 2.454 0.057 8 0 "[ . 1 . 2]" 1
2029 1 145 PHE QD 1 154 LYS QG 4.190 . 4.820 2.491 1.959 2.790 . 0 0 "[ . 1 . 2]" 1
2030 1 145 PHE QD 1 154 LYS QD 5.680 . 6.530 4.397 4.051 4.642 . 0 0 "[ . 1 . 2]" 1
2031 1 145 PHE QE 1 154 LYS QG 3.900 . 4.490 3.326 2.587 3.750 . 0 0 "[ . 1 . 2]" 1
2032 1 145 PHE QE 1 154 LYS QD 4.470 . 5.140 4.889 4.568 5.060 . 0 0 "[ . 1 . 2]" 1
2033 1 145 PHE QE 1 154 LYS QE 4.170 . 4.800 3.616 3.083 4.846 0.046 8 0 "[ . 1 . 2]" 1
2034 1 146 GLY QA 1 152 THR MG 3.440 . 3.960 2.832 2.421 3.213 . 0 0 "[ . 1 . 2]" 1
2035 1 147 SER H 1 147 SER QB 3.700 . 4.260 2.723 2.592 2.789 . 0 0 "[ . 1 . 2]" 1
2036 1 148 ARG HA 1 148 ARG QG 3.670 . 4.220 2.887 2.672 3.069 . 0 0 "[ . 1 . 2]" 1
2037 1 151 LYS HA 1 151 LYS QG 3.550 . 4.080 2.540 2.456 2.654 . 0 0 "[ . 1 . 2]" 1
2038 1 151 LYS HA 1 151 LYS QD 4.160 . 4.780 4.163 4.029 4.386 . 0 0 "[ . 1 . 2]" 1
2039 1 151 LYS QG 1 152 THR H 4.250 . 4.890 2.659 2.167 3.203 . 0 0 "[ . 1 . 2]" 1
2040 1 153 SER QB 1 154 LYS H 4.270 . 4.910 2.862 2.554 3.594 . 0 0 "[ . 1 . 2]" 1
2041 1 154 LYS H 1 154 LYS QB 3.510 . 4.040 2.533 2.380 2.685 . 0 0 "[ . 1 . 2]" 1
2042 1 154 LYS H 1 154 LYS QG 3.780 . 4.350 2.950 2.709 3.143 . 0 0 "[ . 1 . 2]" 1
2043 1 154 LYS QB 1 155 LYS H 3.100 . 3.570 2.920 2.642 3.246 . 0 0 "[ . 1 . 2]" 1
2044 1 154 LYS QB 1 156 ILE MD 3.170 . 3.650 2.970 2.363 3.545 . 0 0 "[ . 1 . 2]" 1
2045 1 154 LYS QE 1 154 LYS QG 3.020 . 3.470 2.261 2.166 2.436 . 0 0 "[ . 1 . 2]" 1
2046 1 154 LYS QG 1 155 LYS H 4.780 . 5.500 4.570 4.365 4.758 . 0 0 "[ . 1 . 2]" 1
2047 1 154 LYS QG 1 156 ILE MD 4.220 . 4.850 4.181 3.460 4.893 0.043 8 0 "[ . 1 . 2]" 1
2048 1 155 LYS HA 1 155 LYS QD 3.760 . 4.320 2.440 1.985 4.225 . 0 0 "[ . 1 . 2]" 1
2049 1 155 LYS QD 1 157 THR MG 4.060 . 4.670 3.574 2.478 4.716 0.046 7 0 "[ . 1 . 2]" 1
2050 1 158 ILE H 1 158 ILE QG 4.110 . 4.730 2.399 2.273 2.593 . 0 0 "[ . 1 . 2]" 1
2051 1 158 ILE MG 1 160 ASP QB 4.740 . 5.450 4.565 4.414 4.672 . 0 0 "[ . 1 . 2]" 1
2052 1 158 ILE MG 1 161 CYS QB 4.140 . 4.760 3.344 2.861 4.117 . 0 0 "[ . 1 . 2]" 1
2053 1 159 ALA MB 1 160 ASP QB 4.110 . 4.730 3.161 3.052 3.468 . 0 0 "[ . 1 . 2]" 1
2054 1 160 ASP QB 1 161 CYS H 4.070 . 4.680 3.119 1.986 3.494 . 0 0 "[ . 1 . 2]" 1
2055 1 160 ASP QB 1 161 CYS HA 5.180 . 5.960 4.470 4.007 4.774 . 0 0 "[ . 1 . 2]" 1
2056 1 161 CYS QB 1 162 GLY H 3.630 . 4.170 2.009 1.947 2.119 . 0 0 "[ . 1 . 2]" 1
2057 1 162 GLY QA 1 163 GLN H 3.070 . 3.530 2.502 2.438 2.554 . 0 0 "[ . 1 . 2]" 1
2058 1 163 GLN QB 1 164 LEU QD 5.170 . 5.950 4.956 4.536 5.138 . 0 0 "[ . 1 . 2]" 1
2059 1 164 LEU H 1 164 LEU QD 3.490 . 4.010 3.176 2.976 3.403 . 0 0 "[ . 1 . 2]" 1
2060 1 164 LEU HA 1 164 LEU QD 2.810 . 3.230 2.123 2.030 2.250 . 0 0 "[ . 1 . 2]" 1
2061 1 164 LEU QD 1 165 GLU H 4.590 . 5.280 3.851 3.688 4.115 . 0 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 4
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 101 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 3 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 4 GLY 0.000 0.000 . 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 1 101 ALA MB 2 4 GLY QA 3.500 . 5.000 2.268 1.813 3.135 . 0 0 "[ . 1 . 2]" 2
2 1 101 ALA MB 2 3 PRO QB 3.500 . 5.000 3.314 2.592 4.659 . 0 0 "[ . 1 . 2]" 2
3 1 103 ALA MB 2 3 PRO HA 3.500 . 5.000 2.868 2.406 3.944 . 0 0 "[ . 1 . 2]" 2
4 1 103 ALA MB 2 3 PRO QB 3.500 . 5.000 3.400 1.884 4.303 . 0 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 135
_Distance_constraint_stats_list.Viol_count 568
_Distance_constraint_stats_list.Viol_total 461.398
_Distance_constraint_stats_list.Viol_max 1.666
_Distance_constraint_stats_list.Viol_rms 0.0499
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0085
_Distance_constraint_stats_list.Viol_average_violations_only 0.0406
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 4 PRO 0.019 0.019 9 0 "[ . 1 . 2]"
1 6 VAL 0.009 0.005 17 0 "[ . 1 . 2]"
1 8 PHE 0.067 0.020 12 0 "[ . 1 . 2]"
1 9 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ILE 0.102 0.042 7 0 "[ . 1 . 2]"
1 11 ALA 0.023 0.018 7 0 "[ . 1 . 2]"
1 12 VAL 0.115 0.028 13 0 "[ . 1 . 2]"
1 13 ASP 0.056 0.030 13 0 "[ . 1 . 2]"
1 15 GLU 0.115 0.028 13 0 "[ . 1 . 2]"
1 17 LEU 0.049 0.042 7 0 "[ . 1 . 2]"
1 18 GLY 0.053 0.018 6 0 "[ . 1 . 2]"
1 20 VAL 0.067 0.020 12 0 "[ . 1 . 2]"
1 21 SER 0.645 0.073 13 0 "[ . 1 . 2]"
1 22 PHE 0.009 0.005 17 0 "[ . 1 . 2]"
1 23 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 LEU 0.538 0.085 16 0 "[ . 1 . 2]"
1 25 PHE 0.503 0.046 12 0 "[ . 1 . 2]"
1 26 ALA 0.519 0.085 16 0 "[ . 1 . 2]"
1 28 LYS 0.503 0.046 12 0 "[ . 1 . 2]"
1 29 VAL 0.578 0.061 3 0 "[ . 1 . 2]"
1 30 PRO 0.140 0.026 9 0 "[ . 1 . 2]"
1 31 LYS 0.209 0.029 19 0 "[ . 1 . 2]"
1 33 ALA 1.007 0.061 3 0 "[ . 1 . 2]"
1 34 GLU 0.170 0.026 9 0 "[ . 1 . 2]"
1 35 ASN 0.349 0.040 10 0 "[ . 1 . 2]"
1 36 PHE 0.152 0.047 7 0 "[ . 1 . 2]"
1 37 ARG 0.574 0.054 16 0 "[ . 1 . 2]"
1 38 ALA 0.868 0.073 20 0 "[ . 1 . 2]"
1 39 LEU 0.313 0.064 6 0 "[ . 1 . 2]"
1 40 SER 0.152 0.047 7 0 "[ . 1 . 2]"
1 41 THR 0.145 0.050 4 0 "[ . 1 . 2]"
1 42 GLY 0.970 0.073 20 0 "[ . 1 . 2]"
1 45 GLY 0.131 0.032 2 0 "[ . 1 . 2]"
1 48 TYR 0.173 0.064 6 0 "[ . 1 . 2]"
1 51 SER 0.481 0.056 12 0 "[ . 1 . 2]"
1 53 PHE 0.027 0.020 9 0 "[ . 1 . 2]"
1 54 HIS 0.141 0.075 2 0 "[ . 1 . 2]"
1 55 ARG 8.100 1.666 19 7 "[ * ** *1 -* +2]"
1 56 ILE 0.266 0.056 18 0 "[ . 1 . 2]"
1 57 ILE 0.687 0.087 9 0 "[ . 1 . 2]"
1 58 PRO 0.332 0.140 13 0 "[ . 1 . 2]"
1 61 MET 0.687 0.087 9 0 "[ . 1 . 2]"
1 62 CYS 0.059 0.021 6 0 "[ . 1 . 2]"
1 63 GLN 0.626 0.100 14 0 "[ . 1 . 2]"
1 64 GLY 0.345 0.074 3 0 "[ . 1 . 2]"
1 76 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 SER 0.556 0.077 5 0 "[ . 1 . 2]"
1 80 GLY 0.556 0.077 5 0 "[ . 1 . 2]"
1 83 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 LYS 0.465 0.086 7 0 "[ . 1 . 2]"
1 93 THR 0.465 0.086 7 0 "[ . 1 . 2]"
1 96 GLY 0.096 0.040 8 0 "[ . 1 . 2]"
1 97 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 LEU 1.113 0.118 20 0 "[ . 1 . 2]"
1 99 SER 0.022 0.010 15 0 "[ . 1 . 2]"
1 101 ALA 0.530 0.060 18 0 "[ . 1 . 2]"
1 102 ASN 0.064 0.034 4 0 "[ . 1 . 2]"
1 108 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 GLN 0.740 0.075 2 0 "[ . 1 . 2]"
1 112 PHE 0.345 0.074 3 0 "[ . 1 . 2]"
1 113 PHE 0.022 0.010 15 0 "[ . 1 . 2]"
1 114 ILE 0.059 0.021 6 0 "[ . 1 . 2]"
1 115 CYS 0.059 0.040 8 0 "[ . 1 . 2]"
1 119 THR 0.447 0.083 15 0 "[ . 1 . 2]"
1 120 GLU 1.227 0.080 11 0 "[ . 1 . 2]"
1 121 TRP 0.516 0.137 20 0 "[ . 1 . 2]"
1 122 LEU 0.447 0.083 15 0 "[ . 1 . 2]"
1 123 ASP 1.227 0.080 11 0 "[ . 1 . 2]"
1 129 PHE 1.113 0.118 20 0 "[ . 1 . 2]"
1 131 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 VAL 0.037 0.022 3 0 "[ . 1 . 2]"
1 133 LYS 0.645 0.073 13 0 "[ . 1 . 2]"
1 136 MET 0.027 0.011 9 0 "[ . 1 . 2]"
1 137 ASN 0.328 0.052 17 0 "[ . 1 . 2]"
1 138 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 139 VAL 0.992 0.081 12 0 "[ . 1 . 2]"
1 140 GLU 0.027 0.011 9 0 "[ . 1 . 2]"
1 141 ALA 0.328 0.052 17 0 "[ . 1 . 2]"
1 142 MET 0.680 0.069 13 0 "[ . 1 . 2]"
1 143 GLU 1.343 0.081 12 0 "[ . 1 . 2]"
1 145 PHE 0.708 0.069 13 0 "[ . 1 . 2]"
1 146 GLY 0.351 0.041 19 0 "[ . 1 . 2]"
1 147 SER 0.343 0.056 18 0 "[ . 1 . 2]"
1 150 GLY 0.077 0.024 6 0 "[ . 1 . 2]"
1 153 SER 0.027 0.026 13 0 "[ . 1 . 2]"
1 155 LYS 0.056 0.030 13 0 "[ . 1 . 2]"
1 156 ILE 0.027 0.020 9 0 "[ . 1 . 2]"
1 157 THR 0.023 0.018 7 0 "[ . 1 . 2]"
1 158 ILE 0.481 0.056 12 0 "[ . 1 . 2]"
1 159 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 160 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 2 GLU 7.415 1.666 19 7 "[ * ** *1 -* +2]"
2 3 PRO 0.018 0.018 7 0 "[ . 1 . 2]"
2 4 GLY 0.064 0.034 4 0 "[ . 1 . 2]"
2 5 PRO 0.146 0.048 15 0 "[ . 1 . 2]"
2 6 TYR 0.516 0.137 20 0 "[ . 1 . 2]"
2 8 GLN 0.332 0.140 13 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 55 ARG NH2 2 5 PRO O 3.000 2.800 3.200 2.843 2.752 2.941 0.048 15 0 "[ . 1 . 2]" 3
2 1 55 ARG NH1 2 5 PRO O 3.000 2.800 3.200 2.932 2.785 3.201 0.015 19 0 "[ . 1 . 2]" 3
3 1 102 ASN O 2 4 GLY N 3.000 2.800 3.200 2.979 2.801 3.234 0.034 4 0 "[ . 1 . 2]" 3
4 1 121 TRP NE1 2 6 TYR O 3.000 2.800 3.200 3.148 2.894 3.337 0.137 20 0 "[ . 1 . 2]" 3
5 1 58 PRO O 2 8 GLN NE2 3.000 2.800 3.200 3.026 2.804 3.340 0.140 13 0 "[ . 1 . 2]" 3
6 1 55 ARG NH1 1 63 GLN OE1 3.000 2.800 3.200 2.929 2.787 3.243 0.043 6 0 "[ . 1 . 2]" 3
7 1 63 GLN NE2 2 3 PRO O 3.000 2.800 3.200 2.996 2.814 3.218 0.018 7 0 "[ . 1 . 2]" 3
8 1 63 GLN NE2 1 111 GLN OE1 3.000 2.800 3.200 2.992 2.760 3.207 0.040 3 0 "[ . 1 . 2]" 3
9 1 54 HIS NE2 1 111 GLN OE1 3.000 2.800 3.200 2.950 2.801 3.275 0.075 2 0 "[ . 1 . 2]" 3
10 1 55 ARG NE 2 2 GLU OE1 3.000 2.800 3.200 3.520 2.951 4.866 1.666 19 7 "[ * ** *1 -* +2]" 3
11 1 48 TYR OH 1 76 LYS N 5.500 . 5.500 3.317 2.830 4.334 . 0 0 "[ . 1 . 2]" 3
12 1 4 PRO O 1 24 LEU H 2.000 . 2.200 2.055 1.920 2.179 . 0 0 "[ . 1 . 2]" 3
13 1 4 PRO O 1 24 LEU N 2.900 2.700 3.100 2.973 2.830 3.119 0.019 9 0 "[ . 1 . 2]" 3
14 1 6 VAL O 1 22 PHE H 2.000 . 2.200 1.988 1.903 2.135 . 0 0 "[ . 1 . 2]" 3
15 1 6 VAL O 1 22 PHE N 2.900 2.700 3.100 2.889 2.762 2.995 . 0 0 "[ . 1 . 2]" 3
16 1 8 PHE O 1 20 VAL H 2.000 . 2.200 2.117 2.031 2.211 0.011 2 0 "[ . 1 . 2]" 3
17 1 8 PHE O 1 20 VAL N 2.900 2.700 3.100 3.050 2.956 3.120 0.020 12 0 "[ . 1 . 2]" 3
18 1 9 ASP O 1 159 ALA H 2.000 . 2.200 2.047 1.961 2.122 . 0 0 "[ . 1 . 2]" 3
19 1 9 ASP O 1 159 ALA N 2.900 2.700 3.100 2.777 2.707 2.835 . 0 0 "[ . 1 . 2]" 3
20 1 10 ILE O 1 17 LEU H 2.000 . 2.200 2.058 1.975 2.242 0.042 7 0 "[ . 1 . 2]" 3
21 1 10 ILE O 1 17 LEU N 2.900 2.700 3.100 2.848 2.762 3.043 . 0 0 "[ . 1 . 2]" 3
22 1 11 ALA O 1 157 THR H 2.000 . 2.200 2.048 1.912 2.165 . 0 0 "[ . 1 . 2]" 3
23 1 11 ALA O 1 157 THR N 2.900 2.700 3.100 2.932 2.804 3.086 . 0 0 "[ . 1 . 2]" 3
24 1 12 VAL O 1 15 GLU H 2.000 . 2.200 2.177 2.104 2.223 0.023 16 0 "[ . 1 . 2]" 3
25 1 12 VAL O 1 15 GLU N 2.900 2.700 3.100 3.035 2.943 3.100 . 0 0 "[ . 1 . 2]" 3
26 1 12 VAL H 1 15 GLU O 2.000 . 2.200 2.090 1.970 2.228 0.028 13 0 "[ . 1 . 2]" 3
27 1 12 VAL N 1 15 GLU O 2.900 2.700 3.100 2.879 2.807 2.963 . 0 0 "[ . 1 . 2]" 3
28 1 10 ILE H 1 18 GLY O 2.000 . 2.200 2.160 2.072 2.218 0.018 6 0 "[ . 1 . 2]" 3
29 1 10 ILE N 1 18 GLY O 2.900 2.700 3.100 2.925 2.851 3.008 . 0 0 "[ . 1 . 2]" 3
30 1 8 PHE H 1 20 VAL O 2.000 . 2.200 2.036 1.944 2.148 . 0 0 "[ . 1 . 2]" 3
31 1 8 PHE N 1 20 VAL O 2.900 2.700 3.100 2.976 2.883 3.112 0.012 5 0 "[ . 1 . 2]" 3
32 1 21 SER O 1 133 LYS H 2.000 . 2.200 2.195 2.044 2.273 0.073 13 0 "[ . 1 . 2]" 3
33 1 21 SER O 1 133 LYS N 2.900 2.700 3.100 3.063 2.938 3.155 0.055 14 0 "[ . 1 . 2]" 3
34 1 6 VAL H 1 22 PHE O 2.000 . 2.200 2.051 1.948 2.205 0.005 17 0 "[ . 1 . 2]" 3
35 1 6 VAL N 1 22 PHE O 2.900 2.700 3.100 2.950 2.857 3.077 . 0 0 "[ . 1 . 2]" 3
36 1 24 LEU O 1 26 ALA H 2.000 . 2.200 2.214 2.121 2.285 0.085 16 0 "[ . 1 . 2]" 3
37 1 24 LEU O 1 26 ALA N 2.900 2.700 3.100 3.040 2.917 3.123 0.023 8 0 "[ . 1 . 2]" 3
38 1 25 PHE O 1 28 LYS H 2.000 . 2.200 2.208 2.127 2.246 0.046 12 0 "[ . 1 . 2]" 3
39 1 25 PHE O 1 28 LYS N 2.900 2.700 3.100 3.091 2.983 3.145 0.045 15 0 "[ . 1 . 2]" 3
40 1 25 PHE O 1 29 VAL H 2.000 . 2.200 1.991 1.918 2.103 . 0 0 "[ . 1 . 2]" 3
41 1 25 PHE O 1 29 VAL N 2.900 2.700 3.100 2.952 2.869 3.071 . 0 0 "[ . 1 . 2]" 3
42 1 29 VAL O 1 33 ALA H 2.000 . 2.200 2.172 2.071 2.238 0.038 1 0 "[ . 1 . 2]" 3
43 1 29 VAL O 1 33 ALA N 2.900 2.700 3.100 3.089 3.004 3.161 0.061 3 0 "[ . 1 . 2]" 3
44 1 30 PRO O 1 34 GLU H 2.000 . 2.200 2.149 2.065 2.226 0.026 9 0 "[ . 1 . 2]" 3
45 1 30 PRO O 1 34 GLU N 2.900 2.700 3.100 3.033 2.922 3.119 0.019 12 0 "[ . 1 . 2]" 3
46 1 31 LYS O 1 35 ASN H 2.000 . 2.200 2.173 2.038 2.229 0.029 19 0 "[ . 1 . 2]" 3
47 1 31 LYS O 1 35 ASN N 2.900 2.700 3.100 3.054 2.951 3.113 0.013 12 0 "[ . 1 . 2]" 3
48 1 33 ALA O 1 37 ARG H 2.000 . 2.200 2.170 2.078 2.231 0.031 11 0 "[ . 1 . 2]" 3
49 1 33 ALA O 1 37 ARG N 2.900 2.700 3.100 3.088 2.976 3.154 0.054 16 0 "[ . 1 . 2]" 3
50 1 34 GLU O 1 38 ALA H 2.000 . 2.200 2.071 2.002 2.188 . 0 0 "[ . 1 . 2]" 3
51 1 34 GLU O 1 38 ALA N 2.900 2.700 3.100 2.982 2.858 3.117 0.017 14 0 "[ . 1 . 2]" 3
52 1 35 ASN O 1 39 LEU H 2.000 . 2.200 2.141 2.025 2.240 0.040 10 0 "[ . 1 . 2]" 3
53 1 35 ASN O 1 39 LEU N 2.900 2.700 3.100 3.007 2.877 3.137 0.037 10 0 "[ . 1 . 2]" 3
54 1 36 PHE O 1 40 SER H 2.000 . 2.200 2.126 2.026 2.247 0.047 7 0 "[ . 1 . 2]" 3
55 1 36 PHE O 1 40 SER N 2.900 2.700 3.100 2.977 2.858 3.136 0.036 18 0 "[ . 1 . 2]" 3
56 1 37 ARG O 1 41 THR H 2.000 . 2.200 2.074 1.947 2.175 . 0 0 "[ . 1 . 2]" 3
57 1 37 ARG O 1 41 THR N 2.900 2.700 3.100 3.037 2.914 3.150 0.050 4 0 "[ . 1 . 2]" 3
58 1 38 ALA O 1 42 GLY H 2.000 . 2.200 2.242 2.202 2.273 0.073 20 0 "[ . 1 . 2]" 3
59 1 38 ALA O 1 42 GLY N 2.900 2.700 3.100 2.977 2.923 3.063 . 0 0 "[ . 1 . 2]" 3
60 1 39 LEU O 1 48 TYR H 2.000 . 2.200 2.094 1.960 2.224 0.024 4 0 "[ . 1 . 2]" 3
61 1 39 LEU O 1 48 TYR N 2.900 2.700 3.100 3.014 2.846 3.164 0.064 6 0 "[ . 1 . 2]" 3
62 1 42 GLY O 1 45 GLY H 2.000 . 2.200 2.171 2.099 2.211 0.011 2 0 "[ . 1 . 2]" 3
63 1 42 GLY O 1 45 GLY N 2.900 2.700 3.100 3.066 2.966 3.132 0.032 2 0 "[ . 1 . 2]" 3
64 1 51 SER O 1 158 ILE H 2.000 . 2.200 2.194 1.950 2.256 0.056 12 0 "[ . 1 . 2]" 3
65 1 51 SER O 1 158 ILE N 2.900 2.700 3.100 3.060 2.912 3.150 0.050 9 0 "[ . 1 . 2]" 3
66 1 55 ARG O 1 63 GLN H 2.000 . 2.200 2.029 1.927 2.232 0.032 8 0 "[ . 1 . 2]" 3
67 1 55 ARG O 1 63 GLN N 2.900 2.700 3.100 2.873 2.786 3.032 . 0 0 "[ . 1 . 2]" 3
68 1 55 ARG H 1 63 GLN O 2.250 . 2.700 2.474 2.301 2.656 . 0 0 "[ . 1 . 2]" 3
69 1 55 ARG N 1 63 GLN O 3.050 2.700 3.400 3.386 3.160 3.500 0.100 14 0 "[ . 1 . 2]" 3
70 1 56 ILE O 1 147 SER H 2.000 . 2.200 2.204 2.133 2.256 0.056 18 0 "[ . 1 . 2]" 3
71 1 56 ILE O 1 147 SER N 2.900 2.700 3.100 2.992 2.907 3.075 . 0 0 "[ . 1 . 2]" 3
72 1 57 ILE O 1 61 MET H 2.000 . 2.200 2.158 2.102 2.219 0.019 18 0 "[ . 1 . 2]" 3
73 1 57 ILE O 1 61 MET N 2.900 2.700 3.100 3.128 3.084 3.187 0.087 9 0 "[ . 1 . 2]" 3
74 1 57 ILE H 1 61 MET O 2.000 . 2.200 2.059 1.932 2.209 0.009 9 0 "[ . 1 . 2]" 3
75 1 57 ILE N 1 61 MET O 2.900 2.700 3.100 3.002 2.885 3.142 0.042 9 0 "[ . 1 . 2]" 3
76 1 62 CYS O 1 114 ILE H 2.000 . 2.200 2.021 1.944 2.095 . 0 0 "[ . 1 . 2]" 3
77 1 62 CYS O 1 114 ILE N 2.900 2.700 3.100 2.944 2.860 3.017 . 0 0 "[ . 1 . 2]" 3
78 1 64 GLY O 1 112 PHE H 2.000 . 2.200 2.107 1.940 2.204 0.004 3 0 "[ . 1 . 2]" 3
79 1 64 GLY O 1 112 PHE N 2.900 2.700 3.100 3.077 2.910 3.174 0.074 3 0 "[ . 1 . 2]" 3
80 1 77 SER H 1 80 GLY O 2.000 . 2.200 2.218 2.039 2.277 0.077 5 0 "[ . 1 . 2]" 3
81 1 77 SER N 1 80 GLY O 2.900 2.700 3.100 2.890 2.804 2.971 . 0 0 "[ . 1 . 2]" 3
82 1 91 LYS O 1 93 THR H 2.000 . 2.200 2.201 2.101 2.286 0.086 7 0 "[ . 1 . 2]" 3
83 1 91 LYS O 1 93 THR N 2.900 2.700 3.100 3.041 2.885 3.114 0.014 18 0 "[ . 1 . 2]" 3
84 1 96 GLY O 1 132 VAL H 2.000 . 2.200 2.039 1.945 2.166 . 0 0 "[ . 1 . 2]" 3
85 1 96 GLY O 1 132 VAL N 2.900 2.700 3.100 2.981 2.888 3.122 0.022 3 0 "[ . 1 . 2]" 3
86 1 97 ILE O 1 115 CYS H 2.000 . 2.200 1.997 1.928 2.173 . 0 0 "[ . 1 . 2]" 3
87 1 97 ILE O 1 115 CYS N 2.900 2.700 3.100 2.875 2.728 3.068 . 0 0 "[ . 1 . 2]" 3
88 1 98 LEU O 1 129 PHE H 2.000 . 2.200 2.248 2.050 2.318 0.118 20 0 "[ . 1 . 2]" 3
89 1 98 LEU O 1 129 PHE N 2.900 2.700 3.300 3.221 3.009 3.297 . 0 0 "[ . 1 . 2]" 3
90 1 99 SER O 1 113 PHE H 2.000 . 2.200 1.980 1.920 2.079 . 0 0 "[ . 1 . 2]" 3
91 1 99 SER O 1 113 PHE N 2.900 2.700 3.100 2.887 2.824 3.006 . 0 0 "[ . 1 . 2]" 3
92 1 83 PHE H 1 108 ASN O 2.000 . 2.200 1.937 1.880 2.106 . 0 0 "[ . 1 . 2]" 3
93 1 83 PHE N 1 108 ASN O 2.900 2.700 3.100 2.852 2.758 2.951 . 0 0 "[ . 1 . 2]" 3
94 1 101 ALA H 1 111 GLN O 2.000 . 2.200 2.199 2.147 2.233 0.033 8 0 "[ . 1 . 2]" 3
95 1 101 ALA N 1 111 GLN O 2.900 2.700 3.100 3.108 3.041 3.160 0.060 18 0 "[ . 1 . 2]" 3
96 1 64 GLY H 1 112 PHE O 2.000 . 2.200 2.037 1.951 2.173 . 0 0 "[ . 1 . 2]" 3
97 1 64 GLY N 1 112 PHE O 2.900 2.700 3.100 2.857 2.693 3.031 0.007 19 0 "[ . 1 . 2]" 3
98 1 99 SER H 1 113 PHE O 2.000 . 2.200 2.092 2.001 2.174 . 0 0 "[ . 1 . 2]" 3
99 1 99 SER N 1 113 PHE O 2.900 2.700 3.100 3.045 2.858 3.110 0.010 15 0 "[ . 1 . 2]" 3
100 1 62 CYS H 1 114 ILE O 2.000 . 2.200 2.101 2.030 2.179 . 0 0 "[ . 1 . 2]" 3
101 1 62 CYS N 1 114 ILE O 2.900 2.700 3.100 3.041 2.945 3.121 0.021 6 0 "[ . 1 . 2]" 3
102 1 96 GLY H 1 115 CYS O 2.000 . 2.200 2.090 1.954 2.240 0.040 8 0 "[ . 1 . 2]" 3
103 1 96 GLY N 1 115 CYS O 2.900 2.700 3.100 2.812 2.691 2.957 0.009 14 0 "[ . 1 . 2]" 3
104 1 119 THR O 1 122 LEU H 2.000 . 2.300 2.287 2.166 2.383 0.083 15 0 "[ . 1 . 2]" 3
105 1 119 THR O 1 122 LEU N 2.950 2.700 3.250 3.185 3.060 3.302 0.052 15 0 "[ . 1 . 2]" 3
106 1 120 GLU O 1 123 ASP H 2.000 . 2.200 2.224 2.189 2.280 0.080 11 0 "[ . 1 . 2]" 3
107 1 120 GLU O 1 123 ASP N 2.900 2.700 3.100 3.137 3.105 3.167 0.067 17 0 "[ . 1 . 2]" 3
108 1 25 PHE H 1 129 PHE O 2.000 . 2.200 1.977 1.920 2.053 . 0 0 "[ . 1 . 2]" 3
109 1 25 PHE N 1 129 PHE O 2.900 2.700 3.100 2.892 2.829 2.955 . 0 0 "[ . 1 . 2]" 3
110 1 23 GLU H 1 131 LYS O 2.000 . 2.200 1.995 1.908 2.111 . 0 0 "[ . 1 . 2]" 3
111 1 23 GLU N 1 131 LYS O 2.900 2.700 3.100 2.807 2.706 2.900 . 0 0 "[ . 1 . 2]" 3
112 1 136 MET O 1 140 GLU H 2.000 . 2.200 2.102 2.038 2.169 . 0 0 "[ . 1 . 2]" 3
113 1 136 MET O 1 140 GLU N 2.900 2.700 3.100 3.030 2.955 3.111 0.011 9 0 "[ . 1 . 2]" 3
114 1 137 ASN O 1 141 ALA H 2.000 . 2.200 2.180 2.037 2.252 0.052 17 0 "[ . 1 . 2]" 3
115 1 137 ASN O 1 141 ALA N 2.900 2.700 3.100 2.955 2.854 3.135 0.035 4 0 "[ . 1 . 2]" 3
116 1 138 ILE O 1 142 MET H 2.000 . 2.200 2.031 1.956 2.142 . 0 0 "[ . 1 . 2]" 3
117 1 138 ILE O 1 142 MET N 2.900 2.700 3.100 2.932 2.846 3.016 . 0 0 "[ . 1 . 2]" 3
118 1 139 VAL O 1 143 GLU H 2.000 . 2.200 2.239 2.174 2.281 0.081 12 0 "[ . 1 . 2]" 3
119 1 139 VAL O 1 143 GLU N 2.900 2.700 3.100 3.090 3.005 3.133 0.033 19 0 "[ . 1 . 2]" 3
120 1 142 MET O 1 145 PHE H 2.000 . 2.200 2.223 2.168 2.269 0.069 13 0 "[ . 1 . 2]" 3
121 1 142 MET O 1 145 PHE N 2.900 2.700 3.100 3.092 2.995 3.143 0.043 19 0 "[ . 1 . 2]" 3
122 1 143 GLU O 1 146 GLY H 2.000 . 2.200 2.167 2.025 2.240 0.040 7 0 "[ . 1 . 2]" 3
123 1 143 GLU O 1 146 GLY N 2.900 2.700 3.100 3.062 2.913 3.141 0.041 19 0 "[ . 1 . 2]" 3
124 1 145 PHE O 1 153 SER H 2.000 . 2.200 2.064 1.938 2.226 0.026 13 0 "[ . 1 . 2]" 3
125 1 145 PHE O 1 153 SER N 2.900 2.700 3.100 2.889 2.749 3.016 . 0 0 "[ . 1 . 2]" 3
126 1 147 SER O 1 150 GLY H 2.000 . 2.200 2.153 2.051 2.224 0.024 6 0 "[ . 1 . 2]" 3
127 1 147 SER O 1 150 GLY N 2.900 2.700 3.100 3.014 2.928 3.102 0.002 10 0 "[ . 1 . 2]" 3
128 1 13 ASP H 1 155 LYS O 2.000 . 2.200 2.085 1.926 2.230 0.030 13 0 "[ . 1 . 2]" 3
129 1 13 ASP N 1 155 LYS O 2.900 2.700 3.100 2.861 2.750 2.987 . 0 0 "[ . 1 . 2]" 3
130 1 11 ALA H 1 157 THR O 2.000 . 2.200 2.088 1.971 2.218 0.018 7 0 "[ . 1 . 2]" 3
131 1 11 ALA N 1 157 THR O 2.900 2.700 3.100 2.945 2.844 3.106 0.006 8 0 "[ . 1 . 2]" 3
132 1 53 PHE H 1 156 ILE O 2.000 . 2.200 1.976 1.885 2.131 . 0 0 "[ . 1 . 2]" 3
133 1 53 PHE N 1 156 ILE O 2.900 2.700 3.100 2.793 2.680 2.968 0.020 9 0 "[ . 1 . 2]" 3
134 1 9 ASP H 1 160 ASP O 2.000 . 2.200 2.085 1.989 2.194 . 0 0 "[ . 1 . 2]" 3
135 1 9 ASP N 1 160 ASP O 2.900 2.700 3.100 2.987 2.881 3.093 . 0 0 "[ . 1 . 2]" 3
stop_
save_
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